A0A087YSQ9_POEFO Loading...

Gap junction protein

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

AlphaFold DB , UniProt , Accession A0A087YSQ9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 488 aa.

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(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	37.4	Very low	49.9	Very low	241 Å²	241	103.5 Å²	103.5	100%	1.187	57%	0.567	S	S	*	*				0	148.6	0	-74.9	163.5	167.7	0	0	108
2	G	43.3	Very low	50	Low	56 Å²	56	105.4 Å²	105.4	58%	0.577	57%	0.568	S	S	*	*			trans	-73.7	145.4	-178.1	0	0	0	0	0	112.9	W4	G2-W4 PolarHBondContact O-N 3.34Å
3	D	54.6	Low	49.5	Very low	119 Å²	119	102.2 Å²	102.2	64%	0.636	55%	0.547	S	S	*	.			trans	-73.4	82.5	-177.7	-66.1	-63	0	0	0	112.7	N5 F6 L7	D3-N5 PolarHBondContact O-N 3.15Å; D3-F6 HydrophobicContact CB-CB 3.63Å; D3-F6 WeakPolarHBondContact O-CA 3.3Å; D3-F6 WeakPolarHBondContact O-CB 3.31Å; D3-F6 PolarHBondContact O-N 3.44Å; D3-L7 PolarHBondContact O-N 2.97Å; D3-L7 VanDerWaalsContact O-N 3.1Å
4	W	50.4	Low	49.6	Very low	205 Å²	205	97.5 Å²	97.5	78%	0.777	52%	0.524	S	S	*	.	H	α-helix	trans	-57.2	-28.9	170.4	-62.7	102.4	0	0	0	112.4	G2 F6 L7 G8	G2-W4 PolarHBondContact O-N 3.34Å; W4-F6 VanDerWaalsContact C-N 3.35Å; W4-L7 HydrophobicContact CE3-CD1 4.38Å; W4-L7 PolarHBondContact O-N 2.95Å; W4-G8 PolarHBondContact O-N 2.99Å
5	N	51.8	Low	49.4	Very low	149 Å²	149	94.5 Å²	94.5	80%	0.797	51%	0.505	S	S	*	.	H	α-helix	trans	-64.7	-34.8	171.1	-72.6	-53.5	0	0	0	113	D3 G9	D3-N5 PolarHBondContact O-N 3.15Å; N5-G9 PolarHBondContact O-N 3.1Å
6	F	51	Low	49.4	Very low	67 Å²	67	93.1 Å²	93.1	29%	0.294	50%	0.497	S	S	.	.	H	α-helix	trans	-74.9	-41	177.1	-176.7	-104	0	0	0	111.2	D3 W4 G9 I10 R101 E104	D3-F6 HydrophobicContact CB-CB 3.63Å; D3-F6 WeakPolarHBondContact O-CA 3.3Å; D3-F6 WeakPolarHBondContact O-CB 3.31Å; D3-F6 PolarHBondContact O-N 3.44Å; W4-F6 VanDerWaalsContact C-N 3.35Å; F6-G9 PolarHBondContact O-N 3.31Å; F6-I10 HydrophobicContact CD1-CD1 3.94Å; F6-I10 HydrophobicContact CE1-CD1 3.37Å; F6-I10 HydrophobicContact CE1-CG1 4.4Å; F6-I10 HydrophobicContact CE2-CD1 4.35Å; F6-I10 HydrophobicContact CZ-CD1 3.61Å; F6-I10 HydrophobicContact CZ-CG1 4.41Å; F6-I10 WeakPolarHBondContact O-CG1 3.39Å; F6-I10 PolarHBondContact O-N 2.65Å; F6-R101 VanDerWaalsContact CE1-NH1 3.3Å; F6-E104 WeakPolarHBondContact CE2-OE1 3.48Å; F6-E104 WeakPolarHBondContact CZ-OE1 3.41Å; F6-E104 WeakPolarHBondContact CZ-OE2 3.32Å
7	L	47	Very low	49.2	Very low	92 Å²	92	93.1 Å²	93.1	48%	0.482	49%	0.493	S	S	.	.	H	α-helix	trans	-63.7	-42.3	171.9	-84.6	163.4	0	0	0	112.2	D3 W4 I10 L11	D3-L7 PolarHBondContact O-N 2.97Å; D3-L7 VanDerWaalsContact O-N 3.1Å; W4-L7 HydrophobicContact CE3-CD1 4.38Å; W4-L7 PolarHBondContact O-N 2.95Å; L7-I10 PolarHBondContact O-N 2.91Å; L7-L11 WeakPolarHBondContact O-CB 3.4Å; L7-L11 PolarHBondContact O-N 3.16Å
8	G	54.1	Low	49.5	Very low	35 Å²	35	88.7 Å²	88.7	36%	0.361	47%	0.471	S	S	.	.	H	α-helix	trans	-60.5	-48.8	173.2	0	0	0	0	0	112	W4 I10 L11 E12	W4-G8 PolarHBondContact O-N 2.99Å; G8-I10 VanDerWaalsContact C-N 3.33Å; G8-I10 PolarHBondContact O-N 3.38Å; G8-L11 WeakPolarHBondContact O-CB 3.43Å; G8-L11 PolarHBondContact O-N 3Å; G8-L11 VanDerWaalsContact O-N 3.11Å; G8-E12 WeakPolarHBondContact O-CB 3.48Å; G8-E12 PolarHBondContact O-N 3.34Å
9	G	54.2	Low	50.1	Low	41 Å²	41	86.1 Å²	86.1	42%	0.423	46%	0.459	S	S	.	.	H	α-helix	trans	-59.6	-38.2	175.7	0	0	0	0	0	113.7	N5 F6 E13	N5-G9 PolarHBondContact O-N 3.1Å; F6-G9 PolarHBondContact O-N 3.31Å; G9-E13 VanDerWaalsContact O-CB 3.24Å; G9-E13 WeakPolarHBondContact O-CB 3.43Å; G9-E13 PolarHBondContact O-N 3.3Å
10	I	52.6	Low	50.7	Low	19 Å²	19	87.2 Å²	87.2	10%	0.097	46%	0.463	C	S	.	.	H	α-helix	trans	-68.3	-41.1	172.8	-74.8	178.5	0	0	0	111.5	F6 L7 G8 E12 E13 V14 I97 L100	F6-I10 HydrophobicContact CD1-CD1 3.94Å; F6-I10 HydrophobicContact CE1-CD1 3.37Å; F6-I10 HydrophobicContact CE1-CG1 4.4Å; F6-I10 HydrophobicContact CE2-CD1 4.35Å; F6-I10 HydrophobicContact CZ-CD1 3.61Å; F6-I10 HydrophobicContact CZ-CG1 4.41Å; F6-I10 WeakPolarHBondContact O-CG1 3.39Å; F6-I10 PolarHBondContact O-N 2.65Å; L7-I10 PolarHBondContact O-N 2.91Å; G8-I10 VanDerWaalsContact C-N 3.33Å; G8-I10 PolarHBondContact O-N 3.38Å; I10-E12 VanDerWaalsContact C-N 3.33Å; I10-E12 PolarHBondContact O-N 2.97Å; I10-E13 PolarHBondContact O-N 2.86Å; I10-V14 HydrophobicContact CG2-CG2 4.18Å; I10-V14 VanDerWaalsContact O-CB 3.27Å; I10-V14 WeakPolarHBondContact O-CB 3.2Å; I10-V14 VanDerWaalsContact O-CG2 3.23Å; I10-V14 WeakPolarHBondContact O-CG2 3.37Å; I10-V14 PolarHBondContact O-N 3.04Å; I10-I97 HydrophobicContact CG2-CG1 4.11Å; I10-L100 HydrophobicContact CD1-CD1 4.39Å; I10-L100 HydrophobicContact CG1-CD1 4.33Å; I10-L100 HydrophobicContact CG2-CD1 4.19Å
11	L	52.6	Low	51.3	Low	115 Å²	115	87.4 Å²	87.4	60%	0.602	47%	0.467	S	S	*	.	H	α-helix	trans	-62.6	-43.4	178.9	-164.7	69.5	0	0	0	110.8	L7 G8 H15	L7-L11 WeakPolarHBondContact O-CB 3.4Å; L7-L11 PolarHBondContact O-N 3.16Å; G8-L11 WeakPolarHBondContact O-CB 3.43Å; G8-L11 PolarHBondContact O-N 3Å; G8-L11 VanDerWaalsContact O-N 3.11Å; L11-H15 WeakPolarHBondContact O-CB 3.34Å; L11-H15 PolarHBondContact O-N 2.99Å
12	E	50.6	Low	52.6	Low	126 Å²	126	76.2 Å²	76.2	59%	0.589	41%	0.413	S	S	*	.	H	α-helix	trans	-61.1	-53.2	173.8	-161.8	79.3	-119.9	0	0	111.8	G8 I10 V14 H15 I16	G8-E12 WeakPolarHBondContact O-CB 3.48Å; G8-E12 PolarHBondContact O-N 3.34Å; I10-E12 VanDerWaalsContact C-N 3.33Å; I10-E12 PolarHBondContact O-N 2.97Å; E12-V14 PolarHBondContact O-N 3.21Å; E12-H15 WeakPolarHBondContact O-CA 3.24Å; E12-H15 WeakPolarHBondContact O-CB 3.43Å; E12-H15 PolarHBondContact O-N 3.16Å; E12-I16 HydrophobicContact CG-CD1 4.35Å; E12-I16 WeakPolarHBondContact O-CG1 3.4Å; E12-I16 PolarHBondContact O-N 3.13Å; E12-I16 VanDerWaalsContact O-N 3.11Å
13	E	43.4	Very low	54	Low	63 Å²	63	75 Å²	75	29%	0.294	39%	0.392	S	S	.	.	H	α-helix	trans	-62.3	-39.9	-179.4	-177.2	72.1	170.7	0	0	112	G9 I10 H15 I16 K146	G9-E13 VanDerWaalsContact O-CB 3.24Å; G9-E13 WeakPolarHBondContact O-CB 3.43Å; G9-E13 PolarHBondContact O-N 3.3Å; I10-E13 PolarHBondContact O-N 2.86Å; E13-H15 VanDerWaalsContact C-N 3.27Å; E13-H15 PolarHBondContact O-N 2.98Å; E13-I16 PolarHBondContact O-N 3.02Å; E13-K146 WeakPolarHBondContact OE1-CG 3.49Å; E13-K146 WeakPolarHBondContact OE2-CE 3.49Å
14	V	51.6	Low	55.1	Low	37 Å²	37	72.5 Å²	72.5	22%	0.224	38%	0.378	C	S	.	.	H	α-helix	trans	-68.1	-26.7	173.1	171.2	0	0	0	0	111.5	I10 E12 K23 Y92	I10-V14 HydrophobicContact CG2-CG2 4.18Å; I10-V14 VanDerWaalsContact O-CB 3.27Å; I10-V14 WeakPolarHBondContact O-CB 3.2Å; I10-V14 VanDerWaalsContact O-CG2 3.23Å; I10-V14 WeakPolarHBondContact O-CG2 3.37Å; I10-V14 PolarHBondContact O-N 3.04Å; E12-V14 PolarHBondContact O-N 3.21Å; V14-K23 PolarHBondContact O-NZ 3.48Å; V14-Y92 HydrophobicContact CG1-CE1 4.42Å
15	H	47	Very low	56.4	Low	52 Å²	52	69.4 Å²	69.4	24%	0.241	37%	0.366	C	S	.	.	H	α-helix	trans	-70.1	-43.2	175.8	-135.3	-142.5	0	0	0	112.1	L11 E12 E13 H17 S18 I24	L11-H15 WeakPolarHBondContact O-CB 3.34Å; L11-H15 PolarHBondContact O-N 2.99Å; E12-H15 WeakPolarHBondContact O-CA 3.24Å; E12-H15 WeakPolarHBondContact O-CB 3.43Å; E12-H15 PolarHBondContact O-N 3.16Å; E13-H15 VanDerWaalsContact C-N 3.27Å; E13-H15 PolarHBondContact O-N 2.98Å; H15-H17 VanDerWaalsContact C-N 3.29Å; H15-H17 PolarHBondContact O-N 3.21Å; H15-S18 PolarHBondContact O-N 2.93Å; H15-I24 VanDerWaalsContact CE1-CG1 3.5Å; H15-I24 WeakPolarHBondContact CE1-CG1 3.29Å
16	I	48.7	Very low	57.6	Low	72 Å²	72	62.8 Å²	62.8	37%	0.369	33%	0.331	S	S	.	.	H	α-helix	trans	-63	-26.4	-168.6	-71.8	162.9	0	0	0	114.4	E12 E13 K146	E12-I16 HydrophobicContact CG-CD1 4.35Å; E12-I16 WeakPolarHBondContact O-CG1 3.4Å; E12-I16 PolarHBondContact O-N 3.13Å; E12-I16 VanDerWaalsContact O-N 3.11Å; E13-I16 PolarHBondContact O-N 3.02Å; I16-K146 HydrophobicContact CG2-CD 4.34Å
17	H	46.5	Very low	59.1	Low	93 Å²	93	63.2 Å²	63.2	43%	0.431	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	-5	-173.8	-95.4	-52.7	0	0	0	116.9	H15 L149	H15-H17 VanDerWaalsContact C-N 3.29Å; H15-H17 PolarHBondContact O-N 3.21Å; H17-L149 HydrophobicContact CB-CD1 3.63Å; H17-L149 HydrophobicContact CB-CD2 3.98Å; H17-L149 HydrophobicContact CB-CG 4.49Å
18	S	53.4	Low	60.9	Low	15 Å²	15	63 Å²	63	11%	0.105	34%	0.338	C	S	.	.	S	Bend	trans	-96.9	176.4	165.9	-68.5	0	0	0	0	111	H15 M20 K23 Y157	H15-S18 PolarHBondContact O-N 2.93Å; S18-M20 PolarHBondContact O-N 3.09Å; S18-K23 WeakPolarHBondContact OG-CE 3.06Å; S18-K23 PolarHBondContact OG-NZ 2.82Å; S18-Y157 WeakPolarHBondContact CB-OH 3.34Å; S18-Y157 PolarHBondContact OG-OH 3.18Å
19	T	62	Low	62.4	Low	38 Å²	38	62.4 Å²	62.4	23%	0.233	33%	0.326	C	S	.	.			trans	-60.2	103.9	161	9.2	0	0	0	0	109.6	V21 G22 K23 E229 H232	T19-V21 PolarHBondContact O-N 2.9Å; T19-V21 VanDerWaalsContact O-N 3.11Å; T19-G22 WeakPolarHBondContact O-CA 3.47Å; T19-G22 PolarHBondContact O-N 3.16Å; T19-K23 PolarHBondContact O-N 3.28Å; T19-K23 VanDerWaalsContact O-N 3.15Å; T19-E229 PolarHBondContact OG1-OE1 3.07Å; T19-H232 VanDerWaalsContact CG2-CE1 3.48Å; T19-H232 WeakPolarHBondContact CG2-CE1 3.09Å; T19-H232 WeakPolarHBondContact CG2-ND1 3.49Å
20	M	61.6	Low	63.8	Low	108 Å²	108	63.3 Å²	63.3	53%	0.532	32%	0.319	S	S	.	.	H	α-helix	trans	-49	-39.7	175.6	-72.4	175.6	69.2	0	0	111.5	S18 G22 K23 I24	S18-M20 PolarHBondContact O-N 3.09Å; M20-G22 PolarHBondContact O-N 2.96Å; M20-K23 PolarHBondContact O-N 3.15Å; M20-I24 HydrophobicContact CB-CD1 4.2Å; M20-I24 HydrophobicContact CE-CD1 4.42Å; M20-I24 VanDerWaalsContact O-CB 3.27Å; M20-I24 WeakPolarHBondContact O-CB 3.35Å; M20-I24 WeakPolarHBondContact O-CD1 3.17Å; M20-I24 WeakPolarHBondContact O-CG1 3.24Å; M20-I24 PolarHBondContact O-N 3.01Å
21	V	63.6	Low	65.4	Low	93 Å²	93	67.4 Å²	67.4	56%	0.564	34%	0.339	S	S	*	.	H	α-helix	trans	-53.3	-54.3	173.2	-174.3	0	0	0	0	111.3	T19 K23 W25	T19-V21 PolarHBondContact O-N 2.9Å; T19-V21 VanDerWaalsContact O-N 3.11Å; V21-K23 PolarHBondContact O-N 3.4Å; V21-W25 WeakPolarHBondContact O-CB 3.5Å; V21-W25 PolarHBondContact O-N 3.24Å
22	G	65.3	Low	67.1	Low	5 Å²	5	65.7 Å²	65.7	5%	0.052	33%	0.327	C	S	.	.	H	α-helix	trans	-57.3	-51.8	179.8	0	0	0	0	0	112.1	T19 M20 L26	T19-G22 WeakPolarHBondContact O-CA 3.47Å; T19-G22 PolarHBondContact O-N 3.16Å; M20-G22 PolarHBondContact O-N 2.96Å; G22-L26 WeakPolarHBondContact O-CB 3.44Å; G22-L26 WeakPolarHBondContact O-CG 3.47Å; G22-L26 PolarHBondContact O-N 2.03Å
23	K	71.6	Confident	69	Low	32 Å²	32	60.1 Å²	60.1	14%	0.139	30%	0.301	C	S	.	.	H	α-helix	trans	-64.4	-45.3	-179	-75.7	-171.9	166.2	154.3	0	113.9	V14 S18 T19 M20 V21 T27	V14-K23 PolarHBondContact O-NZ 3.48Å; S18-K23 WeakPolarHBondContact OG-CE 3.06Å; S18-K23 PolarHBondContact OG-NZ 2.82Å; T19-K23 PolarHBondContact O-N 3.28Å; T19-K23 VanDerWaalsContact O-N 3.15Å; M20-K23 PolarHBondContact O-N 3.15Å; V21-K23 PolarHBondContact O-N 3.4Å; K23-T27 WeakPolarHBondContact O-CB 3.38Å; K23-T27 PolarHBondContact O-N 3.05Å; K23-T27 VanDerWaalsContact O-N 3.08Å; K23-T27 PolarHBondContact O-OG1 2.98Å
24	I	77.8	Confident	71.1	Confident	66 Å²	66	60.4 Å²	60.4	34%	0.338	30%	0.303	S	S	.	.	H	α-helix	trans	-62.9	-52.7	179.2	-68.6	166.5	0	0	0	109.8	H15 M20 L26 T27 I28	H15-I24 VanDerWaalsContact CE1-CG1 3.5Å; H15-I24 WeakPolarHBondContact CE1-CG1 3.29Å; M20-I24 HydrophobicContact CB-CD1 4.2Å; M20-I24 HydrophobicContact CE-CD1 4.42Å; M20-I24 VanDerWaalsContact O-CB 3.27Å; M20-I24 WeakPolarHBondContact O-CB 3.35Å; M20-I24 WeakPolarHBondContact O-CD1 3.17Å; M20-I24 WeakPolarHBondContact O-CG1 3.24Å; M20-I24 PolarHBondContact O-N 3.01Å; I24-L26 PolarHBondContact O-N 3.38Å; I24-T27 PolarHBondContact O-N 2.7Å; I24-I28 HydrophobicContact CG2-CD1 3.65Å; I24-I28 HydrophobicContact CG2-CG1 4.41Å; I24-I28 WeakPolarHBondContact O-CG1 3.41Å; I24-I28 PolarHBondContact O-N 3.04Å
25	W	78.8	Confident	72.8	Confident	139 Å²	139	63.6 Å²	63.6	53%	0.527	32%	0.318	S	S	.	.	H	α-helix	trans	-66.7	-40	-177.3	-77	92.7	0	0	0	112.7	V21 T27 I28 L29 L225	V21-W25 WeakPolarHBondContact O-CB 3.5Å; V21-W25 PolarHBondContact O-N 3.24Å; W25-T27 PolarHBondContact O-N 3.34Å; W25-I28 PolarHBondContact O-N 2.98Å; W25-L29 WeakPolarHBondContact O-CB 3.42Å; W25-L29 WeakPolarHBondContact O-CD1 2.98Å; W25-L29 WeakPolarHBondContact O-CG 3.47Å; W25-L29 PolarHBondContact O-N 3.4Å; W25-L225 HydrophobicContact CB-CD1 3.7Å
26	L	77.1	Confident	74.8	Confident	11 Å²	11	61.5 Å²	61.5	6%	0.058	31%	0.309	C	S	.	.	H	α-helix	trans	-66.4	-24.2	175.4	-70.9	172.9	0	0	0	113.4	G22 I24 F30 S222 L225	G22-L26 WeakPolarHBondContact O-CB 3.44Å; G22-L26 WeakPolarHBondContact O-CG 3.47Å; G22-L26 PolarHBondContact O-N 2.03Å; I24-L26 PolarHBondContact O-N 3.38Å; L26-F30 WeakPolarHBondContact O-CB 3.38Å; L26-F30 PolarHBondContact O-N 2.96Å; L26-S222 WeakPolarHBondContact CD2-O 3.5Å; L26-L225 HydrophobicContact CD2-CB 3.95Å; L26-L225 HydrophobicContact CD2-CD1 4.47Å; L26-L225 HydrophobicContact CG-CB 4.28Å
27	T	82.3	Confident	76.7	Confident	75 Å²	75	58.7 Å²	58.7	46%	0.46	30%	0.295	S	S	.	.	H	α-helix	trans	-81.9	-43.6	174.5	-54.9	0	0	0	0	111.2	K23 I24 W25 L29 F30 I31	K23-T27 WeakPolarHBondContact O-CB 3.38Å; K23-T27 PolarHBondContact O-N 3.05Å; K23-T27 VanDerWaalsContact O-N 3.08Å; K23-T27 PolarHBondContact O-OG1 2.98Å; I24-T27 PolarHBondContact O-N 2.7Å; W25-T27 PolarHBondContact O-N 3.34Å; T27-L29 PolarHBondContact O-N 3.23Å; T27-F30 WeakPolarHBondContact O-CB 3.43Å; T27-F30 PolarHBondContact O-N 3.19Å; T27-F30 VanDerWaalsContact O-N 3.14Å; T27-I31 HydrophobicContact CG2-CD1 4.13Å; T27-I31 WeakPolarHBondContact O-CG1 3.27Å; T27-I31 PolarHBondContact O-N 3.47Å
28	I	84.5	Confident	78.7	Confident	88 Å²	88	56.2 Å²	56.2	45%	0.451	29%	0.294	S	S	.	.	H	α-helix	trans	-59	-46.9	174.1	-69.3	169.8	0	0	0	110.6	I24 W25 F30 I31 F32	I24-I28 HydrophobicContact CG2-CD1 3.65Å; I24-I28 HydrophobicContact CG2-CG1 4.41Å; I24-I28 WeakPolarHBondContact O-CG1 3.41Å; I24-I28 PolarHBondContact O-N 3.04Å; W25-I28 PolarHBondContact O-N 2.98Å; I28-F30 VanDerWaalsContact C-N 3.26Å; I28-F30 PolarHBondContact O-N 3.36Å; I28-I31 PolarHBondContact O-N 2.84Å; I28-F32 VanDerWaalsContact O-CB 3.26Å; I28-F32 WeakPolarHBondContact O-CB 3.39Å; I28-F32 PolarHBondContact O-N 3.33Å
29	L	85.1	Confident	80.4	Confident	22 Å²	22	58.9 Å²	58.9	12%	0.115	31%	0.31	C	S	.	.	H	α-helix	trans	-63.6	-30.8	177.2	-68.3	166.3	0	0	0	112.5	W25 T27 R33 I218 I221 L225	W25-L29 WeakPolarHBondContact O-CB 3.42Å; W25-L29 WeakPolarHBondContact O-CD1 2.98Å; W25-L29 WeakPolarHBondContact O-CG 3.47Å; W25-L29 PolarHBondContact O-N 3.4Å; T27-L29 PolarHBondContact O-N 3.23Å; L29-R33 WeakPolarHBondContact O-CB 3.24Å; L29-R33 PolarHBondContact O-N 2.96Å; L29-I218 HydrophobicContact CB-CG2 4.46Å; L29-I218 HydrophobicContact CD2-CG2 4.24Å; L29-I221 HydrophobicContact CD1-CB 4.47Å; L29-I221 HydrophobicContact CD1-CG2 3.79Å; L29-I221 HydrophobicContact CD2-CG2 4.43Å; L29-L225 HydrophobicContact CD1-CD1 3.54Å
30	F	83.9	Confident	81.5	Confident	61 Å²	61	57.1 Å²	57.1	27%	0.268	30%	0.299	S	S	.	.	H	α-helix	trans	-71.5	-47.2	174.4	-177.2	-93.7	0	0	0	112.1	L26 T27 I28 F32 R33 M34 V82	L26-F30 WeakPolarHBondContact O-CB 3.38Å; L26-F30 PolarHBondContact O-N 2.96Å; T27-F30 WeakPolarHBondContact O-CB 3.43Å; T27-F30 PolarHBondContact O-N 3.19Å; T27-F30 VanDerWaalsContact O-N 3.14Å; I28-F30 VanDerWaalsContact C-N 3.26Å; I28-F30 PolarHBondContact O-N 3.36Å; F30-F32 VanDerWaalsContact C-N 3.3Å; F30-F32 PolarHBondContact O-N 2.9Å; F30-R33 WeakPolarHBondContact O-CB 3.49Å; F30-R33 PolarHBondContact O-N 3.49Å; F30-M34 HydrophobicContact CD1-CG 4.49Å; F30-M34 HydrophobicContact CE1-CE 4.44Å; F30-M34 HydrophobicContact CE1-CG 4.15Å; F30-M34 HydrophobicContact CE1-SD 4.12Å; F30-M34 HydrophobicContact CE2-CE 4.2Å; F30-M34 HydrophobicContact CZ-CE 4.09Å; F30-M34 HydrophobicContact CZ-SD 4.03Å; F30-M34 PolarHBondContact O-N 3.35Å; F30-M34 VanDerWaalsContact O-N 3.07Å; F30-V82 HydrophobicContact CE2-CG1 3.97Å; F30-V82 HydrophobicContact CZ-CG1 4.05Å
31	I	87.3	Confident	82.5	Confident	104 Å²	104	53.6 Å²	53.6	53%	0.533	29%	0.287	S	S	.	.	H	α-helix	trans	-59.2	-44.8	174.8	-66.4	165.2	0	0	0	110.2	T27 I28 R33 M34 L35	T27-I31 HydrophobicContact CG2-CD1 4.13Å; T27-I31 WeakPolarHBondContact O-CG1 3.27Å; T27-I31 PolarHBondContact O-N 3.47Å; I28-I31 PolarHBondContact O-N 2.84Å; I31-R33 VanDerWaalsContact C-N 3.29Å; I31-R33 PolarHBondContact O-N 2.85Å; I31-M34 WeakPolarHBondContact O-CB 3.4Å; I31-M34 PolarHBondContact O-N 3.04Å; I31-L35 PolarHBondContact O-N 3.17Å
32	F	86.9	Confident	83.2	Confident	80 Å²	80	56.4 Å²	56.4	35%	0.351	29%	0.294	S	S	.	.	H	α-helix	trans	-61.9	-37.7	178	-170.2	-97.1	0	0	0	112.1	I28 F30 M34 L35 V36 F214 I218	I28-F32 VanDerWaalsContact O-CB 3.26Å; I28-F32 WeakPolarHBondContact O-CB 3.39Å; I28-F32 PolarHBondContact O-N 3.33Å; F30-F32 VanDerWaalsContact C-N 3.3Å; F30-F32 PolarHBondContact O-N 2.9Å; F32-M34 VanDerWaalsContact C-N 3.32Å; F32-M34 PolarHBondContact O-N 3.5Å; F32-L35 PolarHBondContact O-N 2.91Å; F32-V36 HydrophobicContact CD1-CG2 4.04Å; F32-V36 HydrophobicContact CE1-CG2 3.53Å; F32-V36 HydrophobicContact CZ-CG2 3.88Å; F32-V36 WeakPolarHBondContact O-CG2 3.48Å; F32-V36 PolarHBondContact O-N 2.96Å; F32-F214 AromaticContact CE1-CE1 3.46Å; F32-F214 HydrophobicContact CE1-CE1 3.46Å; F32-F214 VanDerWaalsContact CE1-CE1 3.46Å; F32-F214 HydrophobicContact CE1-CE2 4.44Å; F32-F214 AromaticContact CE1-CZ 3.4Å; F32-F214 HydrophobicContact CE1-CZ 3.4Å; F32-F214 VanDerWaalsContact CE1-CZ 3.4Å; F32-F214 AromaticContact CZ-CE1 3.69Å; F32-F214 HydrophobicContact CZ-CE1 3.69Å; F32-F214 AromaticContact CZ-CZ 3.54Å; F32-F214 HydrophobicContact CZ-CZ 3.54Å; F32-I218 HydrophobicContact CD1-CD1 3.79Å; F32-I218 HydrophobicContact CD1-CG1 4.42Å; F32-I218 HydrophobicContact CE1-CD1 3.74Å
33	R	89.9	Confident	84.1	Confident	9 Å²	9	61.3 Å²	61.3	3%	0.034	32%	0.319	C	S	.	.	H	α-helix	trans	-63.9	-32.7	172.2	-164.8	176	-160.3	154.8	14.8	113.2	L29 F30 I31 L37 V82 E168 M215	L29-R33 WeakPolarHBondContact O-CB 3.24Å; L29-R33 PolarHBondContact O-N 2.96Å; F30-R33 WeakPolarHBondContact O-CB 3.49Å; F30-R33 PolarHBondContact O-N 3.49Å; I31-R33 VanDerWaalsContact C-N 3.29Å; I31-R33 PolarHBondContact O-N 2.85Å; R33-L37 WeakPolarHBondContact O-CB 3.22Å; R33-L37 WeakPolarHBondContact O-CD1 3.27Å; R33-L37 WeakPolarHBondContact O-CG 3.39Å; R33-L37 PolarHBondContact O-N 3.14Å; R33-V82 HydrophobicContact CG-CG2 4.09Å; R33-E168 IonicContact CZ-OE1 2.68Å; R33-E168 IonicContact NH1-OE1 3.95Å; R33-E168 PolarHBondContact NH1-OE1 2.89Å; R33-E168 IonicContact NH1-OE2 3.54Å; R33-E168 IonicContact NH2-OE1 3.35Å; R33-M215 HydrophobicContact CG-CE 3.83Å; R33-M215 HydrophobicContact CG-SD 4.04Å
34	M	87.4	Confident	84.9	Confident	69 Å²	69	59.9 Å²	59.9	34%	0.34	31%	0.313	S	S	.	.	H	α-helix	trans	-67.8	-44.7	172.6	-59.6	-56.1	83.7	0	0	111.1	F30 I31 F32 L37 G38 V82	F30-M34 HydrophobicContact CD1-CG 4.49Å; F30-M34 HydrophobicContact CE1-CE 4.44Å; F30-M34 HydrophobicContact CE1-CG 4.15Å; F30-M34 HydrophobicContact CE1-SD 4.12Å; F30-M34 HydrophobicContact CE2-CE 4.2Å; F30-M34 HydrophobicContact CZ-CE 4.09Å; F30-M34 HydrophobicContact CZ-SD 4.03Å; F30-M34 PolarHBondContact O-N 3.35Å; F30-M34 VanDerWaalsContact O-N 3.07Å; I31-M34 WeakPolarHBondContact O-CB 3.4Å; I31-M34 PolarHBondContact O-N 3.04Å; F32-M34 VanDerWaalsContact C-N 3.32Å; F32-M34 PolarHBondContact O-N 3.5Å; M34-L37 HydrophobicContact CE-CD1 4.22Å; M34-L37 PolarHBondContact O-N 3.47Å; M34-G38 PolarHBondContact O-N 3.13Å; M34-V82 HydrophobicContact CE-CB 4.07Å; M34-V82 HydrophobicContact CE-CG1 3.5Å; M34-V82 HydrophobicContact CE-CG2 3.4Å; M34-V82 HydrophobicContact SD-CG1 4.01Å
35	L	89.3	Confident	85.5	Confident	103 Å²	103	57.2 Å²	57.2	54%	0.539	30%	0.299	S	S	.	.	H	α-helix	trans	-60.8	-48	179.1	-171.3	160.2	0	0	0	111.2	I31 F32 L37 G38 V39	I31-L35 PolarHBondContact O-N 3.17Å; F32-L35 PolarHBondContact O-N 2.91Å; L35-L37 VanDerWaalsContact C-N 3.27Å; L35-L37 PolarHBondContact O-N 2.92Å; L35-G38 PolarHBondContact O-N 2.95Å; L35-V39 HydrophobicContact CD2-CG2 4.25Å; L35-V39 PolarHBondContact O-N 3.39Å; L35-V39 VanDerWaalsContact O-N 3.15Å
36	V	88.3	Confident	86	Confident	8 Å²	8	57 Å²	57	5%	0.048	31%	0.308	C	S	.	.	H	α-helix	trans	-60.2	-37.4	176.3	173.9	0	0	0	0	111.6	F32 A40 F211 F214 M215	F32-V36 HydrophobicContact CD1-CG2 4.04Å; F32-V36 HydrophobicContact CE1-CG2 3.53Å; F32-V36 HydrophobicContact CZ-CG2 3.88Å; F32-V36 WeakPolarHBondContact O-CG2 3.48Å; F32-V36 PolarHBondContact O-N 2.96Å; V36-A40 WeakPolarHBondContact O-CB 3.42Å; V36-A40 PolarHBondContact O-N 3.24Å; V36-F211 HydrophobicContact CG1-CD1 4.06Å; V36-F211 HydrophobicContact CG1-CE1 4.42Å; V36-F214 HydrophobicContact CG1-CD1 4.39Å; V36-F214 HydrophobicContact CG2-CD1 4.16Å; V36-F214 HydrophobicContact CG2-CE1 3.76Å; V36-M215 HydrophobicContact CB-SD 4.2Å; V36-M215 HydrophobicContact CG1-CG 4.15Å; V36-M215 HydrophobicContact CG1-SD 3.69Å
37	L	89	Confident	86.6	Confident	14 Å²	14	57.5 Å²	57.5	7%	0.073	31%	0.31	C	S	.	.	H	α-helix	trans	-69.7	-38.3	177.7	-80.8	167.1	0	0	0	113.6	R33 M34 L35 A41 I75 W78 V82 M215	R33-L37 WeakPolarHBondContact O-CB 3.22Å; R33-L37 WeakPolarHBondContact O-CD1 3.27Å; R33-L37 WeakPolarHBondContact O-CG 3.39Å; R33-L37 PolarHBondContact O-N 3.14Å; M34-L37 HydrophobicContact CE-CD1 4.22Å; M34-L37 PolarHBondContact O-N 3.47Å; L35-L37 VanDerWaalsContact C-N 3.27Å; L35-L37 PolarHBondContact O-N 2.92Å; L37-A41 WeakPolarHBondContact O-CB 3.42Å; L37-A41 PolarHBondContact O-N 3.12Å; L37-A41 VanDerWaalsContact O-N 3.11Å; L37-I75 HydrophobicContact CD2-CD1 4.43Å; L37-W78 HydrophobicContact CD1-CB 4.25Å; L37-W78 HydrophobicContact CD2-CB 3.53Å; L37-W78 HydrophobicContact CD2-CD2 4.36Å; L37-W78 HydrophobicContact CD2-CE3 3.81Å; L37-W78 HydrophobicContact CD2-CG 4.31Å; L37-W78 HydrophobicContact CG-CB 4.42Å; L37-V82 HydrophobicContact CD1-CG2 3.76Å; L37-M215 HydrophobicContact CD1-CE 4.08Å; L37-M215 HydrophobicContact CD2-CE 3.91Å; L37-M215 HydrophobicContact CG-CE 3.78Å
38	G	87.9	Confident	87	Confident	40 Å²	40	55.4 Å²	55.4	41%	0.412	30%	0.296	S	S	.	.	H	α-helix	trans	-60.3	-55	174.2	0	0	0	0	0	111.5	M34 L35 A40 A41	M34-G38 PolarHBondContact O-N 3.13Å; L35-G38 PolarHBondContact O-N 2.95Å; G38-A40 PolarHBondContact O-N 3.46Å; G38-A41 PolarHBondContact O-N 3.28Å
39	V	88.4	Confident	87.2	Confident	72 Å²	72	56.3 Å²	56.3	44%	0.436	30%	0.298	S	S	.	.	H	α-helix	trans	-61.9	-46.3	-179.1	178.1	0	0	0	0	111.8	L35 A41 D43	L35-V39 HydrophobicContact CD2-CG2 4.25Å; L35-V39 PolarHBondContact O-N 3.39Å; L35-V39 VanDerWaalsContact O-N 3.15Å; V39-A41 VanDerWaalsContact C-N 3.34Å; V39-A41 PolarHBondContact O-N 2.73Å; V39-D43 PolarHBondContact O-N 3Å
40	A	85.8	Confident	87.6	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-68.1	-31.4	-177	0	0	0	0	0	113.5	V36 G38 V44 W45 I75 F211	V36-A40 WeakPolarHBondContact O-CB 3.42Å; V36-A40 PolarHBondContact O-N 3.24Å; G38-A40 PolarHBondContact O-N 3.46Å; A40-V44 PolarHBondContact O-N 3.17Å; A40-W45 HydrophobicContact CB-CE3 4.05Å; A40-W45 HydrophobicContact CB-CZ3 4.02Å; A40-W45 PolarHBondContact O-N 3.34Å; A40-I75 HydrophobicContact CB-CD1 3.94Å; A40-F211 HydrophobicContact CB-CD1 3.95Å; A40-F211 HydrophobicContact CB-CE1 4.05Å; A40-F211 HydrophobicContact CB-CG 4.45Å
41	A	82.7	Confident	88	Confident	35 Å²	35	59.6 Å²	59.6	29%	0.289	32%	0.324	S	S	.	.	H	α-helix	trans	-66.9	-41.9	-177	0	0	0	0	0	112.8	L37 G38 V39 N46 I75	L37-A41 WeakPolarHBondContact O-CB 3.42Å; L37-A41 PolarHBondContact O-N 3.12Å; L37-A41 VanDerWaalsContact O-N 3.11Å; G38-A41 PolarHBondContact O-N 3.28Å; V39-A41 VanDerWaalsContact C-N 3.34Å; V39-A41 PolarHBondContact O-N 2.73Å; A41-N46 PolarHBondContact O-N 2.99Å; A41-I75 HydrophobicContact CB-CD1 4.25Å; A41-I75 HydrophobicContact CB-CG1 4.41Å; A41-I75 HydrophobicContact CB-CG2 3.95Å
42	E	78.8	Confident	88.4	Confident	151 Å²	151	54.7 Å²	54.7	71%	0.706	30%	0.298	S	S	*	.	H	α-helix	trans	-84.9	-43	-173.4	-64.1	-179.1	-176.2	0	0	112.5	N46	E42-N46 WeakPolarHBondContact O-CB 3.44Å
43	D	83.6	Confident	88.9	Confident	108 Å²	108	55.6 Å²	55.6	58%	0.578	31%	0.306	S	S	*	.	H	α-helix	trans	-85.7	-35.9	-173.8	-73.2	-37.6	0	0	0	114.5	V39	V39-D43 PolarHBondContact O-N 3Å
44	V	88.9	Confident	89.2	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.018	31%	0.309	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.7	-28.4	-161.8	-177.3	0	0	0	0	112.8	A40 E207 K208 F211	A40-V44 PolarHBondContact O-N 3.17Å; V44-E207 HydrophobicContact CG1-CB 4.48Å; V44-E207 HydrophobicContact CG1-CG 3.8Å; V44-E207 HydrophobicContact CG2-CG 4.16Å; V44-K208 HydrophobicContact CG1-CG 3.73Å; V44-K208 WeakPolarHBondContact O-CE 3.21Å; V44-K208 PolarHBondContact O-NZ 2.91Å; V44-F211 HydrophobicContact CG1-CD2 4.31Å; V44-F211 HydrophobicContact CG1-CE2 4.43Å; V44-F211 HydrophobicContact CG2-CD2 4.39Å; V44-F211 HydrophobicContact CG2-CE2 3.76Å; V44-F211 HydrophobicContact CG2-CZ 4.26Å
45	W	90.7	Very high	89.7	Confident	10 Å²	10	58.5 Å²	58.5	4%	0.038	33%	0.325	C	S	.	.	S	Bend	trans	-109.4	-9.6	-177.7	-92.6	-87	0	0	0	115	A40 D47 E48 L74 I75 W78 K208 F211	A40-W45 HydrophobicContact CB-CE3 4.05Å; A40-W45 HydrophobicContact CB-CZ3 4.02Å; A40-W45 PolarHBondContact O-N 3.34Å; W45-D47 VanDerWaalsContact C-N 3.29Å; W45-D47 PolarHBondContact O-N 2.86Å; W45-E48 VanDerWaalsContact CD1-OE2 3.25Å; W45-E48 VanDerWaalsContact O-CB 3.26Å; W45-E48 WeakPolarHBondContact O-CB 3.19Å; W45-E48 WeakPolarHBondContact O-CG 3.43Å; W45-E48 PolarHBondContact O-N 3.45Å; W45-E48 VanDerWaalsContact O-N 3.1Å; W45-L74 HydrophobicContact CZ2-CB 3.83Å; W45-L74 HydrophobicContact CZ2-CD2 3.85Å; W45-L74 HydrophobicContact CZ2-CG 4.44Å; W45-I75 HydrophobicContact CB-CD1 4.21Å; W45-I75 HydrophobicContact CB-CG1 3.54Å; W45-I75 HydrophobicContact CD2-CD1 3.85Å; W45-I75 HydrophobicContact CD2-CG1 3.81Å; W45-I75 HydrophobicContact CE3-CD1 3.71Å; W45-I75 HydrophobicContact CE3-CG1 4.19Å; W45-I75 HydrophobicContact CG-CD1 4.08Å; W45-I75 HydrophobicContact CG-CG1 3.51Å; W45-I75 HydrophobicContact CZ3-CD1 4.4Å; W45-W78 AromaticContact CH2-CH2 3.5Å; W45-W78 HydrophobicContact CH2-CH2 3.5Å; W45-W78 AromaticContact CH2-CZ3 3.69Å; W45-W78 HydrophobicContact CH2-CZ3 3.69Å; W45-W78 AromaticContact CZ2-CH2 3.91Å; W45-W78 HydrophobicContact CZ2-CH2 3.91Å; W45-W78 HydrophobicContact CZ2-CZ3 4.13Å; W45-W78 HydrophobicContact CZ3-CH2 4.19Å; W45-W78 AromaticContact CZ3-CZ3 3.94Å; W45-W78 HydrophobicContact CZ3-CZ3 3.94Å; W45-K208 HydrophobicContact CD2-CD 4.5Å; W45-K208 HydrophobicContact CD2-CG 4.25Å; W45-K208 HydrophobicContact CE3-CG 4.41Å; W45-K208 HydrophobicContact CH2-CB 3.75Å; W45-K208 HydrophobicContact CH2-CG 3.73Å; W45-K208 HydrophobicContact CZ2-CB 3.61Å; W45-K208 HydrophobicContact CZ2-CD 4.13Å; W45-K208 HydrophobicContact CZ2-CG 3.52Å; W45-K208 HydrophobicContact CZ3-CG 4.17Å; W45-F211 HydrophobicContact CH2-CB 3.79Å; W45-F211 HydrophobicContact CZ3-CB 3.82Å; W45-F211 HydrophobicContact CZ3-CD2 4.21Å; W45-F211 HydrophobicContact CZ3-CG 4.08Å
46	N	88.2	Confident	90	Very high	134 Å²	134	55.7 Å²	55.7	72%	0.717	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-37.3	176.2	-170.7	14.5	0	0	0	112.6	A41 E42 E48	A41-N46 PolarHBondContact O-N 2.99Å; E42-N46 WeakPolarHBondContact O-CB 3.44Å; N46-E48 VanDerWaalsContact C-N 3.32Å; N46-E48 PolarHBondContact O-N 2.92Å
47	D	89.8	Confident	90.3	Very high	21 Å²	21	64.7 Å²	64.7	11%	0.112	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	6.9	176.5	68.3	33.3	0	0	0	115.2	W45 Q49 S50 D51 S203 R204 K208	W45-D47 VanDerWaalsContact C-N 3.29Å; W45-D47 PolarHBondContact O-N 2.86Å; D47-Q49 PolarHBondContact O-N 3.22Å; D47-S50 VanDerWaalsContact CA-OG 3.28Å; D47-S50 WeakPolarHBondContact CA-OG 3.31Å; D47-S50 WeakPolarHBondContact CB-OG 3.44Å; D47-S50 PolarHBondContact O-N 3.36Å; D47-S50 PolarHBondContact O-OG 3.4Å; D47-D51 HydrophobicContact CB-CB 4.26Å; D47-D51 PolarHBondContact O-N 3.37Å; D47-S203 PolarHBondContact OD1-OG 3.42Å; D47-R204 IonicContact OD1-NE 2.63Å; D47-R204 WeakPolarHBondContact OD2-CD 3.47Å; D47-R204 IonicContact OD2-CZ 2.67Å; D47-R204 VanDerWaalsContact OD2-CZ 3.31Å; D47-R204 IonicContact OD2-NE 2.78Å; D47-R204 PolarHBondContact OD2-NE 2.68Å; D47-R204 IonicContact OD2-NH2 3.09Å; D47-R204 PolarHBondContact OD2-NH2 3.44Å; D47-R204 VanDerWaalsContact OD2-NH2 3.09Å; D47-K208 IonicContact OD1-NZ 3.14Å; D47-K208 PolarHBondContact OD1-NZ 3.42Å
48	E	90.1	Very high	90.6	Very high	32 Å²	32	67.8 Å²	67.8	15%	0.15	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-33.1	-169	71	172.5	164.4	0	0	114	W45 N46 Y66 S73	W45-E48 VanDerWaalsContact CD1-OE2 3.25Å; W45-E48 VanDerWaalsContact O-CB 3.26Å; W45-E48 WeakPolarHBondContact O-CB 3.19Å; W45-E48 WeakPolarHBondContact O-CG 3.43Å; W45-E48 PolarHBondContact O-N 3.45Å; W45-E48 VanDerWaalsContact O-N 3.1Å; N46-E48 VanDerWaalsContact C-N 3.32Å; N46-E48 PolarHBondContact O-N 2.92Å; E48-Y66 VanDerWaalsContact CG-OH 3.23Å; E48-Y66 WeakPolarHBondContact CG-OH 3.33Å; E48-Y66 WeakPolarHBondContact O-CE2 3.36Å; E48-Y66 PolarHBondContact OE1-OH 2.76Å; E48-Y66 PolarHBondContact OE2-OH 3.4Å; E48-S73 WeakPolarHBondContact OE1-CB 3.33Å; E48-S73 PolarHBondContact OE1-OG 3.3Å; E48-S73 WeakPolarHBondContact OE2-CB 3.36Å
49	Q	90.3	Very high	91	Very high	107 Å²	107	70.8 Å²	70.8	50%	0.5	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.7	-28.4	179.8	-167.1	175.9	-1.2	0	0	113	D47 R62 Y66	D47-Q49 PolarHBondContact O-N 3.22Å; Q49-R62 PolarHBondContact O-NH2 3.03Å; Q49-Y66 HydrophobicContact CB-CE1 4.25Å; Q49-Y66 HydrophobicContact CB-CE2 4.15Å; Q49-Y66 HydrophobicContact CG-CD1 4.06Å; Q49-Y66 HydrophobicContact CG-CD2 4.44Å; Q49-Y66 HydrophobicContact CG-CE1 4Å; Q49-Y66 HydrophobicContact CG-CE2 4.39Å; Q49-Y66 HydrophobicContact CG-CG 4.29Å
50	S	91.8	Very high	91.3	Very high	70 Å²	70	69.1 Å²	69.1	49%	0.49	38%	0.377	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-28.7	179.4	60.2	0	0	0	0	113	D47 R62	D47-S50 VanDerWaalsContact CA-OG 3.28Å; D47-S50 WeakPolarHBondContact CA-OG 3.31Å; D47-S50 WeakPolarHBondContact CB-OG 3.44Å; D47-S50 PolarHBondContact O-N 3.36Å; D47-S50 PolarHBondContact O-OG 3.4Å; S50-R62 PolarHBondContact O-NH2 3.35Å
51	D	94	Very high	91.9	Very high	81 Å²	81	69.1 Å²	69.1	43%	0.433	38%	0.377	S	S	.	.	S	Bend	trans	-114.5	8.8	-172.5	-69.7	45.9	0	0	0	111.9	D47 I53	D47-D51 HydrophobicContact CB-CB 4.26Å; D47-D51 PolarHBondContact O-N 3.37Å; D51-I53 PolarHBondContact O-N 2.85Å
52	F	95.6	Very high	92.5	Very high	1 Å²	1	71.8 Å²	71.8	0%	0.004	38%	0.38	C	S	.	.			trans	-79.5	101.1	165	-176.8	-95.7	0	0	0	110.2	R62 C65 Y66 A69 F70 C200 F201 V202	F52-R62 HydrophobicContact CD1-CG 4.39Å; F52-R62 PolarHBondContact O-NE 2.96Å; F52-R62 PolarHBondContact O-NH2 3.41Å; F52-C65 HydrophobicContact CE1-CB 4.04Å; F52-C65 HydrophobicContact CZ-CB 4.29Å; F52-Y66 HydrophobicContact CB-CD2 3.96Å; F52-Y66 AromaticContact CD1-CD2 4Å; F52-Y66 HydrophobicContact CD1-CD2 4Å; F52-Y66 HydrophobicContact CD1-CG 4.38Å; F52-Y66 HydrophobicContact CD2-CD2 4.21Å; F52-Y66 AromaticContact CG-CD2 3.8Å; F52-Y66 HydrophobicContact CG-CD2 3.8Å; F52-A69 HydrophobicContact CE2-CB 4.28Å; F52-A69 HydrophobicContact CZ-CB 4.3Å; F52-F70 HydrophobicContact CD2-CE2 4.11Å; F52-F70 HydrophobicContact CE2-CE2 4.04Å; F52-C200 HydrophobicContact CE1-CB 3.95Å; F52-C200 HydrophobicContact CE2-CB 4.11Å; F52-C200 HydrophobicContact CZ-CB 3.55Å; F52-F201 WeakPolarHBondContact CA-O 3.5Å; F52-V202 HydrophobicContact CD2-CG2 4.41Å; F52-V202 HydrophobicContact CE2-CG2 4.23Å
53	I	96.3	Very high	93.3	Very high	99 Å²	99	69.2 Å²	69.2	51%	0.508	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	124.8	-171	-61.4	170.9	0	0	0	110	D51 C200 F201	D51-I53 PolarHBondContact O-N 2.85Å; I53-C200 CarbonylContact O-C 3.53Å; I53-C200 WeakPolarHBondContact O-CA 3.35Å; I53-F201 PolarHBondContact N-O 3.16Å; I53-F201 PolarHBondContact O-N 2.88Å
54	C	97.1	Very high	93.9	Very high	13 Å²	13	65.7 Å²	65.7	9%	0.088	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	140.4	172	-62.3	0	0	0	0	111.1	T56 C200	C54-T56 HydrophobicContact CB-CG2 3.99Å; C54-T56 PolarHBondContact O-N 3.47Å; C54-C200 HydrophobicContact CB-CB 4.07Å; C54-C200 WeakPolarHBondContact CB-SG 3.37Å; C54-C200 WeakPolarHBondContact SG-CB 3.26Å; C54-C200 CovalentContact SG-SG 2.04Å; C54-C200 PolarHBondContact SG-SG 3.49Å
55	N	96.4	Very high	94.3	Very high	127 Å²	127	65.5 Å²	65.5	68%	0.679	35%	0.352	S	S	*	.	S	Bend	trans	-77.5	69.7	177.8	-172.3	20.8	0	0	0	111.3	D199	N55-D199 PolarHBondContact N-O 3.08Å
56	T	95.9	Very high	94.6	Very high	43 Å²	43	66.2 Å²	66.2	26%	0.264	36%	0.355	S	S	.	.			trans	-163.6	144.1	-178.8	-172.2	0	0	0	0	111.3	C54 Q58 C61 V198	C54-T56 HydrophobicContact CB-CG2 3.99Å; C54-T56 PolarHBondContact O-N 3.47Å; T56-Q58 VanDerWaalsContact C-N 3.33Å; T56-Q58 HydrophobicContact CG2-CB 4.49Å; T56-Q58 WeakPolarHBondContact OG1-CB 3.24Å; T56-Q58 PolarHBondContact OG1-N 3.12Å; T56-C61 HydrophobicContact CG2-CB 4.13Å; T56-V198 HydrophobicContact CG2-CG1 4.25Å
57	E	94.9	Very high	94.9	Very high	197 Å²	197	63.7 Å²	63.7	92%	0.921	34%	0.341	S	S	*	.			trans	-88.3	-2.6	172.3	-59.6	-174.6	152	0	0	112.4	P59	E57-P59 WeakPolarHBondContact O-CD 3.36Å
58	Q	95.8	Very high	95.2	Very high	80 Å²	80	66.7 Å²	66.7	37%	0.374	36%	0.355	S	S	.	.			trans	-67.5	120	-174.6	-179.8	66.1	5.4	0	0	111.8	T56 C61 P193	T56-Q58 VanDerWaalsContact C-N 3.33Å; T56-Q58 HydrophobicContact CG2-CB 4.49Å; T56-Q58 WeakPolarHBondContact OG1-CB 3.24Å; T56-Q58 PolarHBondContact OG1-N 3.12Å; Q58-C61 HydrophobicContact CB-CB 4Å; Q58-C61 HydrophobicContact CG-CB 3.96Å; Q58-C61 WeakPolarHBondContact O-CB 3.34Å; Q58-C61 PolarHBondContact O-N 2.96Å; Q58-P193 VanDerWaalsContact CG-O 3.26Å; Q58-P193 WeakPolarHBondContact CG-O 3.42Å; Q58-P193 PolarHBondContact NE2-O 3.49Å
59	P	96.5	Very high	95.4	Very high	102 Å²	102	65.9 Å²	65.9	66%	0.662	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	142.9	179.1	25.5	-34.3	0	0	0	111.6	E57 C61	E57-P59 WeakPolarHBondContact O-CD 3.36Å; P59-C61 PolarHBondContact O-N 3.45Å
60	G	95.3	Very high	95.6	Very high	38 Å²	38	61.8 Å²	61.8	39%	0.392	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.1	-24.9	179.7	0	0	0	0	0	115.8	R62 N63 V64	G60-R62 VanDerWaalsContact C-N 3.35Å; G60-R62 PolarHBondContact O-N 2.71Å; G60-N63 PolarHBondContact O-N 2.86Å; G60-V64 PolarHBondContact O-N 3.45Å
61	C	96.8	Very high	95.7	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-54.6	-47	-179.9	172.3	0	0	0	0	112.2	T56 Q58 P59 N63 V64 C65 C194	T56-C61 HydrophobicContact CG2-CB 4.13Å; Q58-C61 HydrophobicContact CB-CB 4Å; Q58-C61 HydrophobicContact CG-CB 3.96Å; Q58-C61 WeakPolarHBondContact O-CB 3.34Å; Q58-C61 PolarHBondContact O-N 2.96Å; P59-C61 PolarHBondContact O-N 3.45Å; C61-N63 VanDerWaalsContact C-N 3.26Å; C61-N63 PolarHBondContact O-N 2.88Å; C61-V64 WeakPolarHBondContact O-CG2 3.33Å; C61-V64 PolarHBondContact O-N 3.26Å; C61-C65 WeakPolarHBondContact O-CB 3.49Å; C61-C65 PolarHBondContact O-N 2.97Å; C61-C65 PolarHBondContact O-SG 3.21Å; C61-C194 WeakPolarHBondContact CA-SG 3.29Å; C61-C194 HydrophobicContact CB-CB 4.06Å; C61-C194 WeakPolarHBondContact CB-SG 3.41Å; C61-C194 WeakPolarHBondContact SG-CB 3.49Å; C61-C194 CovalentContact SG-SG 2.03Å; C61-C194 PolarHBondContact SG-SG 3.47Å
62	R	95.9	Very high	95.7	Very high	90 Å²	90	61.6 Å²	61.6	34%	0.34	33%	0.331	S	S	.	.	H	α-helix	trans	-51	-42.7	173.8	178.2	-178.7	169.5	160.1	1.9	113.3	Q49 S50 F52 G60 Y66	Q49-R62 PolarHBondContact O-NH2 3.03Å; S50-R62 PolarHBondContact O-NH2 3.35Å; F52-R62 HydrophobicContact CD1-CG 4.39Å; F52-R62 PolarHBondContact O-NE 2.96Å; F52-R62 PolarHBondContact O-NH2 3.41Å; G60-R62 VanDerWaalsContact C-N 3.35Å; G60-R62 PolarHBondContact O-N 2.71Å; R62-Y66 WeakPolarHBondContact O-CB 3.26Å; R62-Y66 PolarHBondContact O-N 2.68Å
63	N	95.8	Very high	95.6	Very high	98 Å²	98	61.9 Å²	61.9	52%	0.524	33%	0.333	S	S	.	.	H	α-helix	trans	-72.5	-42.5	-175.3	-65.8	39.5	0	0	0	111.7	G60 C61 C65 Y66 D67	G60-N63 PolarHBondContact O-N 2.86Å; C61-N63 VanDerWaalsContact C-N 3.26Å; C61-N63 PolarHBondContact O-N 2.88Å; N63-C65 VanDerWaalsContact C-N 3.35Å; N63-Y66 PolarHBondContact O-N 2.96Å; N63-D67 WeakPolarHBondContact O-CB 3.48Å; N63-D67 PolarHBondContact O-N 3.48Å
64	V	96.8	Very high	95.4	Very high	33 Å²	33	57.2 Å²	57.2	20%	0.2	31%	0.309	C	S	.	.	H	α-helix	trans	-70.8	-31.1	178.2	-59.5	0	0	0	0	112.3	G60 C61 Q68 R191	G60-V64 PolarHBondContact O-N 3.45Å; C61-V64 WeakPolarHBondContact O-CG2 3.33Å; C61-V64 PolarHBondContact O-N 3.26Å; V64-Q68 WeakPolarHBondContact O-CB 3.44Å; V64-Q68 PolarHBondContact O-N 3.42Å; V64-R191 HydrophobicContact CB-CG 4.28Å; V64-R191 HydrophobicContact CG2-CB 4.43Å; V64-R191 HydrophobicContact CG2-CG 4.26Å; V64-R191 PolarHBondContact O-NH1 2.67Å
65	C	96.9	Very high	95.1	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-71.2	-38.9	173.4	-63.9	0	0	0	0	112.1	F52 C61 N63 Q68 A69 C189 C194	F52-C65 HydrophobicContact CE1-CB 4.04Å; F52-C65 HydrophobicContact CZ-CB 4.29Å; C61-C65 WeakPolarHBondContact O-CB 3.49Å; C61-C65 PolarHBondContact O-N 2.97Å; C61-C65 PolarHBondContact O-SG 3.21Å; N63-C65 VanDerWaalsContact C-N 3.35Å; C65-Q68 PolarHBondContact O-N 3.48Å; C65-A69 VanDerWaalsContact O-CB 3.3Å; C65-A69 WeakPolarHBondContact O-CB 3.47Å; C65-A69 PolarHBondContact O-N 3.21Å; C65-C189 WeakPolarHBondContact CA-SG 3.45Å; C65-C189 HydrophobicContact CB-CB 3.67Å; C65-C189 WeakPolarHBondContact CB-SG 3.27Å; C65-C189 WeakPolarHBondContact SG-CB 3.5Å; C65-C189 CovalentContact SG-SG 2.03Å; C65-C189 PolarHBondContact SG-SG 2.98Å; C65-C194 PolarHBondContact SG-SG 3.03Å
66	Y	95.8	Very high	95	Very high	25 Å²	25	59.7 Å²	59.7	10%	0.098	31%	0.309	C	S	.	.	H	α-helix	trans	-61.7	-49.1	173.7	177.9	-96.8	0	0	0	111.4	E48 Q49 F52 R62 N63 Q68 A69 F70	E48-Y66 VanDerWaalsContact CG-OH 3.23Å; E48-Y66 WeakPolarHBondContact CG-OH 3.33Å; E48-Y66 WeakPolarHBondContact O-CE2 3.36Å; E48-Y66 PolarHBondContact OE1-OH 2.76Å; E48-Y66 PolarHBondContact OE2-OH 3.4Å; Q49-Y66 HydrophobicContact CB-CE1 4.25Å; Q49-Y66 HydrophobicContact CB-CE2 4.15Å; Q49-Y66 HydrophobicContact CG-CD1 4.06Å; Q49-Y66 HydrophobicContact CG-CD2 4.44Å; Q49-Y66 HydrophobicContact CG-CE1 4Å; Q49-Y66 HydrophobicContact CG-CE2 4.39Å; Q49-Y66 HydrophobicContact CG-CG 4.29Å; F52-Y66 HydrophobicContact CB-CD2 3.96Å; F52-Y66 AromaticContact CD1-CD2 4Å; F52-Y66 HydrophobicContact CD1-CD2 4Å; F52-Y66 HydrophobicContact CD1-CG 4.38Å; F52-Y66 HydrophobicContact CD2-CD2 4.21Å; F52-Y66 AromaticContact CG-CD2 3.8Å; F52-Y66 HydrophobicContact CG-CD2 3.8Å; R62-Y66 WeakPolarHBondContact O-CB 3.26Å; R62-Y66 PolarHBondContact O-N 2.68Å; N63-Y66 PolarHBondContact O-N 2.96Å; Y66-Q68 VanDerWaalsContact C-N 3.27Å; Y66-Q68 PolarHBondContact O-N 3.39Å; Y66-A69 PolarHBondContact O-N 2.88Å; Y66-F70 HydrophobicContact CD2-CD2 4.01Å; Y66-F70 HydrophobicContact CE2-CB 4.39Å; Y66-F70 AromaticContact CE2-CD2 3.83Å; Y66-F70 HydrophobicContact CE2-CD2 3.83Å; Y66-F70 HydrophobicContact CE2-CG 4.44Å; Y66-F70 PolarHBondContact O-N 2.93Å
67	D	95.5	Very high	94.9	Very high	81 Å²	81	58.5 Å²	58.5	43%	0.433	30%	0.3	S	S	.	.	H	α-helix	trans	-57.4	-37	175.2	176.2	77.2	0	0	0	112.6	N63 P71 R191	N63-D67 WeakPolarHBondContact O-CB 3.48Å; N63-D67 PolarHBondContact O-N 3.48Å; D67-P71 VanDerWaalsContact O-CA 3.31Å; D67-P71 WeakPolarHBondContact O-CA 3.4Å; D67-R191 IonicContact OD2-CZ 3.88Å; D67-R191 VanDerWaalsContact OD2-CZ 3.27Å; D67-R191 IonicContact OD2-NH1 2.71Å; D67-R191 PolarHBondContact OD2-NH1 2.91Å; D67-R191 IonicContact OD2-NH2 3.67Å; D67-R191 PolarHBondContact OD2-NH2 2.92Å
68	Q	95	Very high	94.9	Very high	84 Å²	84	49.1 Å²	49.1	39%	0.393	26%	0.256	S	S	.	.	H	α-helix	trans	-77.3	-33.3	178.2	-158.7	-176.3	-7.4	0	0	113.3	V64 C65 Y66 Y187	V64-Q68 WeakPolarHBondContact O-CB 3.44Å; V64-Q68 PolarHBondContact O-N 3.42Å; C65-Q68 PolarHBondContact O-N 3.48Å; Y66-Q68 VanDerWaalsContact C-N 3.27Å; Y66-Q68 PolarHBondContact O-N 3.39Å; Q68-Y187 WeakPolarHBondContact CB-OH 3.34Å; Q68-Y187 VanDerWaalsContact CG-OH 3.26Å; Q68-Y187 WeakPolarHBondContact CG-OH 3.35Å; Q68-Y187 PolarHBondContact O-OH 2.99Å
69	A	94.3	Very high	94.8	Very high	14 Å²	14	48.4 Å²	48.4	12%	0.116	26%	0.257	C	S	.	.	H	α-helix	trans	-77.1	-36.2	178	0	0	0	0	0	112.3	F52 C65 Y66 Y187	F52-A69 HydrophobicContact CE2-CB 4.28Å; F52-A69 HydrophobicContact CZ-CB 4.3Å; C65-A69 VanDerWaalsContact O-CB 3.3Å; C65-A69 WeakPolarHBondContact O-CB 3.47Å; C65-A69 PolarHBondContact O-N 3.21Å; Y66-A69 PolarHBondContact O-N 2.88Å; A69-Y187 HydrophobicContact CB-CD1 3.98Å; A69-Y187 HydrophobicContact CB-CD2 3.75Å; A69-Y187 HydrophobicContact CB-CE1 3.91Å; A69-Y187 HydrophobicContact CB-CE2 3.69Å; A69-Y187 HydrophobicContact CB-CG 3.89Å
70	F	94.9	Very high	94.7	Very high	21 Å²	21	47 Å²	47	9%	0.092	24%	0.243	C	C	.	.			trans	-132.9	64.9	-174.9	-57.5	-73.7	0	0	0	111.6	F52 Y66 I72 L74 Y179 L183 V202	F52-F70 HydrophobicContact CD2-CE2 4.11Å; F52-F70 HydrophobicContact CE2-CE2 4.04Å; Y66-F70 HydrophobicContact CD2-CD2 4.01Å; Y66-F70 HydrophobicContact CE2-CB 4.39Å; Y66-F70 AromaticContact CE2-CD2 3.83Å; Y66-F70 HydrophobicContact CE2-CD2 3.83Å; Y66-F70 HydrophobicContact CE2-CG 4.44Å; Y66-F70 PolarHBondContact O-N 2.93Å; F70-I72 PolarHBondContact O-N 3.43Å; F70-L74 HydrophobicContact CD1-CD1 4.15Å; F70-L74 HydrophobicContact CE1-CD1 4.48Å; F70-Y179 HydrophobicContact CD1-CE1 4.48Å; F70-L183 HydrophobicContact CE1-CD1 3.84Å; F70-L183 HydrophobicContact CE1-CD2 4.14Å; F70-L183 HydrophobicContact CZ-CD1 4.01Å; F70-L183 HydrophobicContact CZ-CD2 4.24Å; F70-V202 HydrophobicContact CE2-CG1 4.32Å; F70-V202 HydrophobicContact CE2-CG2 4.17Å; F70-V202 HydrophobicContact CZ-CG1 3.78Å; F70-V202 HydrophobicContact CZ-CG2 3.99Å
71	P	94.4	Very high	94.7	Very high	83 Å²	83	45.3 Å²	45.3	54%	0.539	23%	0.225	S	C	.	.	S	Bend	trans	-61.7	-20	-178.3	26	-36.1	0	0	0	113.3	D67	D67-P71 VanDerWaalsContact O-CA 3.31Å; D67-P71 WeakPolarHBondContact O-CA 3.4Å
72	I	94.6	Very high	94.4	Very high	65 Å²	65	46 Å²	46	33%	0.333	23%	0.229	S	C	.	.	S	Bend	trans	-136	140.1	160.9	-55.9	177.8	0	0	0	105.6	F70 R76 Y179	F70-I72 PolarHBondContact O-N 3.43Å; I72-R76 HydrophobicContact CG2-CB 3.94Å; I72-Y179 PolarHBondContact O-OH 3.49Å
73	S	92.6	Very high	94.2	Very high	6 Å²	6	45.9 Å²	45.9	4%	0.042	24%	0.235	C	C	.	.			trans	-80.5	148.5	171.4	56.4	0	0	0	0	112.7	E48 I75 R76 Y77	E48-S73 WeakPolarHBondContact OE1-CB 3.33Å; E48-S73 PolarHBondContact OE1-OG 3.3Å; E48-S73 WeakPolarHBondContact OE2-CB 3.36Å; S73-I75 VanDerWaalsContact C-N 3.29Å; S73-I75 PolarHBondContact O-N 3.34Å; S73-R76 WeakPolarHBondContact O-CB 3.11Å; S73-R76 PolarHBondContact O-N 2.99Å; S73-R76 WeakPolarHBondContact OG-CD 3.45Å; S73-Y77 PolarHBondContact O-N 2.95Å
74	L	91.4	Very high	94.1	Very high	1 Å²	1	46.5 Å²	46.5	1%	0.005	23%	0.233	C	C	.	.	H	α-helix	trans	-64.5	-33.1	-166	-79	63.9	0	0	0	112.5	W45 F70 Y77 W78 Y179 M212	W45-L74 HydrophobicContact CZ2-CB 3.83Å; W45-L74 HydrophobicContact CZ2-CD2 3.85Å; W45-L74 HydrophobicContact CZ2-CG 4.44Å; F70-L74 HydrophobicContact CD1-CD1 4.15Å; F70-L74 HydrophobicContact CE1-CD1 4.48Å; L74-Y77 WeakPolarHBondContact O-CB 3.26Å; L74-Y77 PolarHBondContact O-N 2.82Å; L74-W78 HydrophobicContact CB-CH2 4.19Å; L74-W78 HydrophobicContact CB-CZ2 4.22Å; L74-W78 HydrophobicContact CB-CZ3 4.39Å; L74-W78 HydrophobicContact CD2-CZ2 4.39Å; L74-W78 VanDerWaalsContact O-CD2 3.28Å; L74-W78 VanDerWaalsContact O-CG 3.31Å; L74-W78 PolarHBondContact O-N 3.02Å; L74-Y179 HydrophobicContact CD1-CD1 3.76Å; L74-Y179 HydrophobicContact CD1-CD2 4.34Å; L74-Y179 HydrophobicContact CD1-CE1 3.52Å; L74-Y179 HydrophobicContact CD1-CE2 4.15Å; L74-Y179 HydrophobicContact CD1-CG 4.16Å; L74-Y179 HydrophobicContact CG-CD2 4.31Å; L74-Y179 HydrophobicContact CG-CE1 4.44Å; L74-Y179 HydrophobicContact CG-CE2 4.23Å; L74-Y179 HydrophobicContact CG-CG 4.46Å; L74-M212 HydrophobicContact CD2-CE 4.28Å; L74-M212 HydrophobicContact CD2-CG 3.53Å; L74-M212 HydrophobicContact CD2-SD 3.55Å; L74-M212 VanDerWaalsContact CD2-SD 3.55Å
75	I	91.9	Very high	93.8	Very high	24 Å²	24	45 Å²	45	12%	0.123	22%	0.223	C	C	.	.	H	α-helix	trans	-59.6	-48.7	171.2	-59.3	-62	0	0	0	111.1	L37 A40 A41 W45 S73 Y77 W78 V79	L37-I75 HydrophobicContact CD2-CD1 4.43Å; A40-I75 HydrophobicContact CB-CD1 3.94Å; A41-I75 HydrophobicContact CB-CD1 4.25Å; A41-I75 HydrophobicContact CB-CG1 4.41Å; A41-I75 HydrophobicContact CB-CG2 3.95Å; W45-I75 HydrophobicContact CB-CD1 4.21Å; W45-I75 HydrophobicContact CB-CG1 3.54Å; W45-I75 HydrophobicContact CD2-CD1 3.85Å; W45-I75 HydrophobicContact CD2-CG1 3.81Å; W45-I75 HydrophobicContact CE3-CD1 3.71Å; W45-I75 HydrophobicContact CE3-CG1 4.19Å; W45-I75 HydrophobicContact CG-CD1 4.08Å; W45-I75 HydrophobicContact CG-CG1 3.51Å; W45-I75 HydrophobicContact CZ3-CD1 4.4Å; S73-I75 VanDerWaalsContact C-N 3.29Å; S73-I75 PolarHBondContact O-N 3.34Å; I75-Y77 VanDerWaalsContact C-N 3.3Å; I75-Y77 PolarHBondContact O-N 3.44Å; I75-W78 HydrophobicContact CD1-CE3 4.09Å; I75-W78 HydrophobicContact CD1-CZ3 4.08Å; I75-W78 PolarHBondContact O-N 3.19Å; I75-V79 HydrophobicContact CG2-CG2 4.47Å; I75-V79 WeakPolarHBondContact O-CG2 3.31Å; I75-V79 PolarHBondContact O-N 2.78Å
76	R	93.4	Very high	93.4	Very high	168 Å²	168	46.2 Å²	46.2	63%	0.634	23%	0.232	S	C	*	.	H	α-helix	trans	-62	-40.4	177.6	-61.8	178	-173.3	173.9	5.8	111	I72 S73 V79 L80	I72-R76 HydrophobicContact CG2-CB 3.94Å; S73-R76 WeakPolarHBondContact O-CB 3.11Å; S73-R76 PolarHBondContact O-N 2.99Å; S73-R76 WeakPolarHBondContact OG-CD 3.45Å; R76-V79 PolarHBondContact O-N 3.02Å; R76-L80 WeakPolarHBondContact O-CG 3.43Å; R76-L80 PolarHBondContact O-N 3.3Å
77	Y	95	Very high	93.2	Very high	19 Å²	19	47.6 Å²	47.6	8%	0.075	25%	0.245	C	C	.	.	H	α-helix	trans	-59.2	-46.5	175.7	-169.5	-90.8	0	0	0	112.1	S73 L74 I75 L80 Q81 F171 G174 Q175 L178 Y179	S73-Y77 PolarHBondContact O-N 2.95Å; L74-Y77 WeakPolarHBondContact O-CB 3.26Å; L74-Y77 PolarHBondContact O-N 2.82Å; I75-Y77 VanDerWaalsContact C-N 3.3Å; I75-Y77 PolarHBondContact O-N 3.44Å; Y77-L80 PolarHBondContact O-N 2.86Å; Y77-Q81 PolarHBondContact O-N 3.2Å; Y77-F171 HydrophobicContact CD1-CD1 4.41Å; Y77-F171 HydrophobicContact CE1-CB 4.44Å; Y77-F171 AromaticContact CE1-CD1 3.7Å; Y77-F171 HydrophobicContact CE1-CD1 3.7Å; Y77-F171 HydrophobicContact CE2-CD1 4.27Å; Y77-F171 AromaticContact CZ-CD1 3.6Å; Y77-F171 WeakPolarHBondContact OH-CA 3.37Å; Y77-F171 PolarHBondContact OH-O 3.47Å; Y77-G174 WeakPolarHBondContact OH-CA 3.48Å; Y77-Q175 HydrophobicContact CD1-CB 4.49Å; Y77-Q175 HydrophobicContact CE1-CB 3.8Å; Y77-Q175 HydrophobicContact CE1-CG 4.43Å; Y77-Q175 PolarHBondContact OH-N 3.27Å; Y77-Q175 VanDerWaalsContact OH-N 3.15Å; Y77-L178 HydrophobicContact CE2-CD2 4.39Å; Y77-Y179 HydrophobicContact CD2-CE2 4.39Å; Y77-Y179 HydrophobicContact CG-CE2 4.39Å
78	W	94.5	Very high	92.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-72.1	-33.9	178.7	-65.9	-32	0	0	0	114	L37 W45 L74 I75 L80 Q81 V82 F211 M212 M215	L37-W78 HydrophobicContact CD1-CB 4.25Å; L37-W78 HydrophobicContact CD2-CB 3.53Å; L37-W78 HydrophobicContact CD2-CD2 4.36Å; L37-W78 HydrophobicContact CD2-CE3 3.81Å; L37-W78 HydrophobicContact CD2-CG 4.31Å; L37-W78 HydrophobicContact CG-CB 4.42Å; W45-W78 AromaticContact CH2-CH2 3.5Å; W45-W78 HydrophobicContact CH2-CH2 3.5Å; W45-W78 AromaticContact CH2-CZ3 3.69Å; W45-W78 HydrophobicContact CH2-CZ3 3.69Å; W45-W78 AromaticContact CZ2-CH2 3.91Å; W45-W78 HydrophobicContact CZ2-CH2 3.91Å; W45-W78 HydrophobicContact CZ2-CZ3 4.13Å; W45-W78 HydrophobicContact CZ3-CH2 4.19Å; W45-W78 AromaticContact CZ3-CZ3 3.94Å; W45-W78 HydrophobicContact CZ3-CZ3 3.94Å; L74-W78 HydrophobicContact CB-CH2 4.19Å; L74-W78 HydrophobicContact CB-CZ2 4.22Å; L74-W78 HydrophobicContact CB-CZ3 4.39Å; L74-W78 HydrophobicContact CD2-CZ2 4.39Å; L74-W78 VanDerWaalsContact O-CD2 3.28Å; L74-W78 VanDerWaalsContact O-CG 3.31Å; L74-W78 PolarHBondContact O-N 3.02Å; I75-W78 HydrophobicContact CD1-CE3 4.09Å; I75-W78 HydrophobicContact CD1-CZ3 4.08Å; I75-W78 PolarHBondContact O-N 3.19Å; W78-L80 VanDerWaalsContact C-N 3.34Å; W78-Q81 WeakPolarHBondContact O-CB 3.28Å; W78-Q81 PolarHBondContact O-N 3.27Å; W78-V82 WeakPolarHBondContact O-CB 3.5Å; W78-V82 VanDerWaalsContact O-CG2 3.29Å; W78-V82 WeakPolarHBondContact O-CG2 3.48Å; W78-V82 PolarHBondContact O-N 2.67Å; W78-F211 HydrophobicContact CH2-CB 4.21Å; W78-M212 HydrophobicContact CH2-CG 4.25Å; W78-M212 HydrophobicContact CZ2-CB 4.4Å; W78-M212 HydrophobicContact CZ2-CG 3.91Å; W78-M215 HydrophobicContact CB-CE 3.73Å; W78-M215 HydrophobicContact CD2-CE 3.71Å; W78-M215 HydrophobicContact CD2-CG 4.19Å; W78-M215 HydrophobicContact CE3-CE 4.01Å; W78-M215 HydrophobicContact CE3-CG 4.33Å; W78-M215 HydrophobicContact CG-CE 3.58Å; W78-M215 HydrophobicContact CH2-CG 4.35Å; W78-M215 HydrophobicContact CZ2-CB 4.23Å; W78-M215 HydrophobicContact CZ2-CG 4.22Å; W78-M215 HydrophobicContact CZ3-CG 4.4Å
79	V	93.5	Very high	92.5	Very high	64 Å²	64	42.1 Å²	42.1	39%	0.388	22%	0.222	S	C	.	.	H	α-helix	trans	-62.2	-43.2	171.4	168.6	0	0	0	0	110.5	I75 R76 V82 I83	I75-V79 HydrophobicContact CG2-CG2 4.47Å; I75-V79 WeakPolarHBondContact O-CG2 3.31Å; I75-V79 PolarHBondContact O-N 2.78Å; R76-V79 PolarHBondContact O-N 3.02Å; V79-V82 WeakPolarHBondContact O-CB 3.45Å; V79-V82 PolarHBondContact O-N 2.87Å; V79-I83 HydrophobicContact CG1-CD1 3.95Å; V79-I83 WeakPolarHBondContact O-CD1 3.48Å; V79-I83 VanDerWaalsContact O-CG1 3.31Å; V79-I83 WeakPolarHBondContact O-CG1 3.46Å; V79-I83 PolarHBondContact O-N 2.8Å; V79-I83 VanDerWaalsContact O-N 3.08Å
80	L	94.6	Very high	92	Very high	73 Å²	73	46.4 Å²	46.4	38%	0.382	24%	0.243	S	C	.	.	H	α-helix	trans	-61.7	-47.7	172.6	-69.6	170.2	0	0	0	111.4	R76 Y77 W78 V82 I83 F84 F171	R76-L80 WeakPolarHBondContact O-CG 3.43Å; R76-L80 PolarHBondContact O-N 3.3Å; Y77-L80 PolarHBondContact O-N 2.86Å; W78-L80 VanDerWaalsContact C-N 3.34Å; L80-V82 VanDerWaalsContact C-N 3.26Å; L80-V82 PolarHBondContact O-N 2.84Å; L80-I83 PolarHBondContact O-N 2.63Å; L80-I83 VanDerWaalsContact O-N 3.12Å; L80-F84 HydrophobicContact CD2-CE2 4.44Å; L80-F84 VanDerWaalsContact O-CD2 3.29Å; L80-F84 WeakPolarHBondContact O-CD2 3.31Å; L80-F84 PolarHBondContact O-N 3.3Å; L80-F171 HydrophobicContact CB-CE1 4.13Å; L80-F171 HydrophobicContact CB-CZ 4.33Å
81	Q	94.5	Very high	91.7	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.009	27%	0.267	C	S	.	.	H	α-helix	trans	-54.3	-43.8	176.6	-175.6	170.1	14.7	0	0	111.9	Y77 W78 F84 V85 E168 F171	Y77-Q81 PolarHBondContact O-N 3.2Å; W78-Q81 WeakPolarHBondContact O-CB 3.28Å; W78-Q81 PolarHBondContact O-N 3.27Å; Q81-F84 PolarHBondContact O-N 3.33Å; Q81-V85 HydrophobicContact CG-CG2 4.17Å; Q81-V85 VanDerWaalsContact O-CB 3.23Å; Q81-V85 WeakPolarHBondContact O-CB 3.49Å; Q81-V85 WeakPolarHBondContact O-CG2 3.42Å; Q81-V85 PolarHBondContact O-N 3.09Å; Q81-E168 PolarHBondContact NE2-OE1 3.02Å; Q81-F171 HydrophobicContact CB-CB 4.1Å; Q81-F171 HydrophobicContact CB-CD1 3.49Å; Q81-F171 VanDerWaalsContact CB-CD1 3.49Å; Q81-F171 HydrophobicContact CB-CD2 4.32Å; Q81-F171 HydrophobicContact CB-CE1 3.93Å; Q81-F171 HydrophobicContact CB-CG 3.72Å; Q81-F171 HydrophobicContact CG-CB 3.5Å; Q81-F171 HydrophobicContact CG-CD1 3.91Å; Q81-F171 HydrophobicContact CG-CD2 4.13Å; Q81-F171 HydrophobicContact CG-CG 3.59Å
82	V	90.8	Very high	91.3	Very high	14 Å²	14	47.2 Å²	47.2	9%	0.085	25%	0.246	C	C	.	.	H	α-helix	trans	-59	-48.2	176.1	154.2	0	0	0	0	112.3	F30 R33 M34 L37 W78 V79 L80 V85 S86	F30-V82 HydrophobicContact CE2-CG1 3.97Å; F30-V82 HydrophobicContact CZ-CG1 4.05Å; R33-V82 HydrophobicContact CG-CG2 4.09Å; M34-V82 HydrophobicContact CE-CB 4.07Å; M34-V82 HydrophobicContact CE-CG1 3.5Å; M34-V82 HydrophobicContact CE-CG2 3.4Å; M34-V82 HydrophobicContact SD-CG1 4.01Å; L37-V82 HydrophobicContact CD1-CG2 3.76Å; W78-V82 WeakPolarHBondContact O-CB 3.5Å; W78-V82 VanDerWaalsContact O-CG2 3.29Å; W78-V82 WeakPolarHBondContact O-CG2 3.48Å; W78-V82 PolarHBondContact O-N 2.67Å; V79-V82 WeakPolarHBondContact O-CB 3.45Å; V79-V82 PolarHBondContact O-N 2.87Å; L80-V82 VanDerWaalsContact C-N 3.26Å; L80-V82 PolarHBondContact O-N 2.84Å; V82-V85 PolarHBondContact O-N 2.88Å; V82-S86 VanDerWaalsContact O-CB 3.29Å; V82-S86 WeakPolarHBondContact O-CB 3.38Å; V82-S86 PolarHBondContact O-N 3.19Å; V82-S86 PolarHBondContact O-OG 3.33Å
83	I	91.5	Very high	90.7	Very high	89 Å²	89	48 Å²	48	46%	0.456	25%	0.249	S	C	.	.	H	α-helix	trans	-64.1	-46.4	-178.7	-67.8	163.2	0	0	0	110	V79 L80 S86 S87	V79-I83 HydrophobicContact CG1-CD1 3.95Å; V79-I83 WeakPolarHBondContact O-CD1 3.48Å; V79-I83 VanDerWaalsContact O-CG1 3.31Å; V79-I83 WeakPolarHBondContact O-CG1 3.46Å; V79-I83 PolarHBondContact O-N 2.8Å; V79-I83 VanDerWaalsContact O-N 3.08Å; L80-I83 PolarHBondContact O-N 2.63Å; L80-I83 VanDerWaalsContact O-N 3.12Å; I83-S86 PolarHBondContact O-OG 3.44Å; I83-S86 VanDerWaalsContact O-OG 3.13Å; I83-S87 WeakPolarHBondContact O-CB 3.27Å; I83-S87 PolarHBondContact O-N 3.47Å
84	F	94.8	Very high	90.3	Very high	110 Å²	110	49.6 Å²	49.6	48%	0.482	27%	0.266	S	S	.	.	H	α-helix	trans	-71.4	-33.5	179.8	-77.2	-74.3	0	0	0	113.5	L80 Q81 P88 V167 F171	L80-F84 HydrophobicContact CD2-CE2 4.44Å; L80-F84 VanDerWaalsContact O-CD2 3.29Å; L80-F84 WeakPolarHBondContact O-CD2 3.31Å; L80-F84 PolarHBondContact O-N 3.3Å; Q81-F84 PolarHBondContact O-N 3.33Å; F84-P88 WeakPolarHBondContact O-CD 3.39Å; F84-V167 HydrophobicContact CB-CG1 3.68Å; F84-F171 HydrophobicContact CB-CE2 3.7Å; F84-F171 HydrophobicContact CB-CZ 4.2Å; F84-F171 AromaticContact CD2-CE2 4Å; F84-F171 HydrophobicContact CD2-CE2 4Å; F84-F171 AromaticContact CD2-CZ 3.66Å; F84-F171 HydrophobicContact CD2-CZ 3.66Å; F84-F171 HydrophobicContact CE2-CZ 4.44Å; F84-F171 HydrophobicContact CG-CE2 4.07Å; F84-F171 HydrophobicContact CG-CZ 4.22Å
85	V	90.9	Very high	90	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	28%	0.276	C	S	.	.	H	α-helix	trans	-74.8	-32.3	176.3	169.4	0	0	0	0	112	Q81 V82 R164 V167 E168	Q81-V85 HydrophobicContact CG-CG2 4.17Å; Q81-V85 VanDerWaalsContact O-CB 3.23Å; Q81-V85 WeakPolarHBondContact O-CB 3.49Å; Q81-V85 WeakPolarHBondContact O-CG2 3.42Å; Q81-V85 PolarHBondContact O-N 3.09Å; V82-V85 PolarHBondContact O-N 2.88Å; V85-R164 HydrophobicContact CG1-CG 4.03Å; V85-V167 HydrophobicContact CG2-CG1 3.82Å; V85-E168 HydrophobicContact CG2-CB 4.22Å
86	S	87.5	Confident	89.6	Confident	27 Å²	27	50.7 Å²	50.7	19%	0.189	27%	0.271	C	S	.	.	H	α-helix	trans	-80.5	-38.9	178.1	57.6	0	0	0	0	113.4	V82 I83 S89 L90	V82-S86 VanDerWaalsContact O-CB 3.29Å; V82-S86 WeakPolarHBondContact O-CB 3.38Å; V82-S86 PolarHBondContact O-N 3.19Å; V82-S86 PolarHBondContact O-OG 3.33Å; I83-S86 PolarHBondContact O-OG 3.44Å; I83-S86 VanDerWaalsContact O-OG 3.13Å; S86-S89 WeakPolarHBondContact O-CA 3.49Å; S86-S89 WeakPolarHBondContact O-CB 3.39Å; S86-S89 PolarHBondContact O-N 3.38Å; S86-S89 PolarHBondContact O-OG 2.81Å; S86-L90 PolarHBondContact O-N 3.26Å
87	S	90.9	Very high	89	Confident	53 Å²	53	45.1 Å²	45.1	37%	0.371	25%	0.254	S	S	.	.	H	α-helix	trans	-48.3	-48.4	-176.2	168	0	0	0	0	114.9	I83 S89 L90 V91	I83-S87 WeakPolarHBondContact O-CB 3.27Å; I83-S87 PolarHBondContact O-N 3.47Å; S87-S89 PolarHBondContact O-N 3.09Å; S87-S89 VanDerWaalsContact O-N 3.09Å; S87-L90 WeakPolarHBondContact O-CB 3.39Å; S87-L90 PolarHBondContact O-N 3.06Å; S87-V91 WeakPolarHBondContact O-CG2 3.28Å; S87-V91 PolarHBondContact O-N 2.8Å
88	P	90.7	Very high	88.6	Confident	17 Å²	17	51.5 Å²	51.5	11%	0.11	28%	0.278	C	S	.	.	H	α-helix	trans	-54.5	-31.5	174.6	-29.7	37.1	0	0	0	114.3	F84 Y92 H160 T163	F84-P88 WeakPolarHBondContact O-CD 3.39Å; P88-Y92 PolarHBondContact O-N 3.46Å; P88-H160 PolarHBondContact O-CD2 3.11Å; P88-H160 VanDerWaalsContact O-CD2 3.24Å; P88-T163 HydrophobicContact CB-CG2 4.41Å; P88-T163 HydrophobicContact CG-CG2 3.93Å
89	S	85.4	Confident	88.1	Confident	33 Å²	33	54.3 Å²	54.3	23%	0.231	29%	0.292	C	S	.	.	H	α-helix	trans	-74.8	-36.2	178.7	-44.8	0	0	0	0	111.8	S86 S87 M93 H160	S86-S89 WeakPolarHBondContact O-CA 3.49Å; S86-S89 WeakPolarHBondContact O-CB 3.39Å; S86-S89 PolarHBondContact O-N 3.38Å; S86-S89 PolarHBondContact O-OG 2.81Å; S87-S89 PolarHBondContact O-N 3.09Å; S87-S89 VanDerWaalsContact O-N 3.09Å; S89-M93 WeakPolarHBondContact O-CB 3.24Å; S89-M93 PolarHBondContact O-N 3.04Å; S89-H160 VanDerWaalsContact CA-NE2 3.33Å; S89-H160 WeakPolarHBondContact CA-NE2 3.41Å; S89-H160 WeakPolarHBondContact CB-NE2 3.49Å; S89-H160 PolarHBondContact N-CD2 3.01Å; S89-H160 PolarHBondContact OG-NE2 3.01Å
90	L	84.3	Confident	87.5	Confident	105 Å²	105	52.8 Å²	52.8	55%	0.55	28%	0.281	S	S	.	.	H	α-helix	trans	-67.3	-41.4	172.9	-59.3	177.6	0	0	0	111	S86 S87 M93 G94	S86-L90 PolarHBondContact O-N 3.26Å; S87-L90 WeakPolarHBondContact O-CB 3.39Å; S87-L90 PolarHBondContact O-N 3.06Å; L90-M93 HydrophobicContact CD2-CE 3.9Å; L90-M93 PolarHBondContact O-N 2.92Å; L90-G94 PolarHBondContact O-N 3.33Å
91	V	89.1	Confident	87	Confident	100 Å²	100	55.3 Å²	55.3	61%	0.606	29%	0.285	S	S	*	.	H	α-helix	trans	-61.9	-45.1	174.8	175	0	0	0	0	111.2	S87 G94 H95	S87-V91 WeakPolarHBondContact O-CG2 3.28Å; S87-V91 PolarHBondContact O-N 2.8Å; V91-G94 PolarHBondContact O-N 3.19Å; V91-H95 PolarHBondContact O-N 3.42Å
92	Y	86.1	Confident	86.5	Confident	21 Å²	21	57.1 Å²	57.1	8%	0.082	30%	0.301	C	S	.	.	H	α-helix	trans	-61	-45.6	174.1	170.8	-103.5	0	0	0	112.4	V14 P88 H95 A96 L153 Y157 H160	V14-Y92 HydrophobicContact CG1-CE1 4.42Å; P88-Y92 PolarHBondContact O-N 3.46Å; Y92-H95 PolarHBondContact O-N 2.84Å; Y92-A96 WeakPolarHBondContact O-CB 3.39Å; Y92-A96 PolarHBondContact O-N 3.49Å; Y92-L153 HydrophobicContact CE2-CD1 3.85Å; Y92-Y157 HydrophobicContact CE1-CD2 4.27Å; Y92-Y157 HydrophobicContact CE2-CD2 4.22Å; Y92-Y157 HydrophobicContact CE2-CG 4.28Å; Y92-H160 HydrophobicContact CG-CB 4.31Å
93	M	81.3	Confident	86.2	Confident	80 Å²	80	59.7 Å²	59.7	39%	0.394	31%	0.314	S	S	.	.	H	α-helix	trans	-62.5	-42.9	178.6	-176.1	170.6	67.3	0	0	111.8	S89 L90 A96 I97	S89-M93 WeakPolarHBondContact O-CB 3.24Å; S89-M93 PolarHBondContact O-N 3.04Å; L90-M93 HydrophobicContact CD2-CE 3.9Å; L90-M93 PolarHBondContact O-N 2.92Å; M93-A96 PolarHBondContact O-N 3Å; M93-I97 HydrophobicContact CG-CD1 3.89Å; M93-I97 WeakPolarHBondContact O-CB 3.32Å; M93-I97 VanDerWaalsContact O-CG1 3.29Å; M93-I97 WeakPolarHBondContact O-CG1 3.15Å; M93-I97 PolarHBondContact O-N 3.32Å
94	G	84.4	Confident	85.8	Confident	40 Å²	40	58.1 Å²	58.1	41%	0.412	30%	0.304	S	S	.	.	H	α-helix	trans	-60.9	-45	174.2	0	0	0	0	0	112.6	L90 V91 I97 Y98	L90-G94 PolarHBondContact O-N 3.33Å; V91-G94 PolarHBondContact O-N 3.19Å; G94-I97 PolarHBondContact O-N 2.98Å; G94-Y98 WeakPolarHBondContact O-CB 3.22Å; G94-Y98 PolarHBondContact O-N 3.41Å
95	H	85.4	Confident	85.4	Confident	46 Å²	46	60.4 Å²	60.4	21%	0.213	31%	0.314	C	S	.	.	H	α-helix	trans	-63	-42.6	174.4	178.5	-114.4	0	0	0	112.2	V91 Y92 Y98 Q99 T156	V91-H95 PolarHBondContact O-N 3.42Å; Y92-H95 PolarHBondContact O-N 2.84Å; H95-Y98 PolarHBondContact O-N 3.05Å; H95-Q99 WeakPolarHBondContact NE2-CG 3.32Å; H95-Q99 PolarHBondContact NE2-NE2 3.4Å; H95-Q99 WeakPolarHBondContact O-CB 3.42Å; H95-Q99 VanDerWaalsContact O-CG 3.26Å; H95-Q99 WeakPolarHBondContact O-CG 3.43Å; H95-Q99 PolarHBondContact O-N 3.4Å; H95-T156 VanDerWaalsContact CE1-CG2 3.42Å; H95-T156 WeakPolarHBondContact CE1-CG2 3.18Å; H95-T156 PolarHBondContact CE1-OG1 2.86Å; H95-T156 WeakPolarHBondContact ND1-CG2 3.47Å; H95-T156 PolarHBondContact ND1-OG1 3.31Å
96	A	82.6	Confident	85.2	Confident	2 Å²	2	64.7 Å²	64.7	2%	0.017	33%	0.334	C	S	.	.	H	α-helix	trans	-61.7	-46	177	0	0	0	0	0	111.7	Y92 M93 Q99 L100 L153	Y92-A96 WeakPolarHBondContact O-CB 3.39Å; Y92-A96 PolarHBondContact O-N 3.49Å; M93-A96 PolarHBondContact O-N 3Å; A96-Q99 PolarHBondContact O-N 3Å; A96-L100 WeakPolarHBondContact O-CB 3.48Å; A96-L100 VanDerWaalsContact O-CG 3.24Å; A96-L100 WeakPolarHBondContact O-CG 3.27Å; A96-L100 PolarHBondContact O-N 2.97Å; A96-L153 HydrophobicContact CB-CD1 3.93Å
97	I	82.3	Confident	85	Confident	52 Å²	52	66.4 Å²	66.4	27%	0.267	34%	0.337	S	S	.	.	H	α-helix	trans	-62.6	-44.3	176	-68.8	165.4	0	0	0	110.9	I10 M93 G94 L100 R101	I10-I97 HydrophobicContact CG2-CG1 4.11Å; M93-I97 HydrophobicContact CG-CD1 3.89Å; M93-I97 WeakPolarHBondContact O-CB 3.32Å; M93-I97 VanDerWaalsContact O-CG1 3.29Å; M93-I97 WeakPolarHBondContact O-CG1 3.15Å; M93-I97 PolarHBondContact O-N 3.32Å; G94-I97 PolarHBondContact O-N 2.98Å; I97-L100 PolarHBondContact O-N 3.33Å; I97-R101 HydrophobicContact CG2-CG 4.41Å; I97-R101 WeakPolarHBondContact O-CB 3.48Å; I97-R101 VanDerWaalsContact O-CG 3.32Å; I97-R101 WeakPolarHBondContact O-CG 3.39Å; I97-R101 PolarHBondContact O-N 2.86Å
98	Y	85.8	Confident	84.7	Confident	152 Å²	152	69.8 Å²	69.8	60%	0.596	35%	0.346	S	S	*	.	H	α-helix	trans	-58.9	-48.7	176.7	176.2	-93.1	0	0	0	112.1	G94 H95 R101 A102	G94-Y98 WeakPolarHBondContact O-CB 3.22Å; G94-Y98 PolarHBondContact O-N 3.41Å; H95-Y98 PolarHBondContact O-N 3.05Å; Y98-R101 PolarHBondContact O-N 2.91Å; Y98-A102 PolarHBondContact O-N 3.34Å
99	Q	83.3	Confident	84.7	Confident	59 Å²	59	70.7 Å²	70.7	28%	0.276	35%	0.353	S	S	.	.	H	α-helix	trans	-63.8	-41.3	177.5	-68.1	-70.3	-5.1	0	0	112	H95 A96 A102 L103	H95-Q99 WeakPolarHBondContact NE2-CG 3.32Å; H95-Q99 PolarHBondContact NE2-NE2 3.4Å; H95-Q99 WeakPolarHBondContact O-CB 3.42Å; H95-Q99 VanDerWaalsContact O-CG 3.26Å; H95-Q99 WeakPolarHBondContact O-CG 3.43Å; H95-Q99 PolarHBondContact O-N 3.4Å; A96-Q99 PolarHBondContact O-N 3Å; Q99-A102 PolarHBondContact O-N 2.89Å; Q99-L103 WeakPolarHBondContact O-CB 3.4Å; Q99-L103 WeakPolarHBondContact O-CG 3.32Å; Q99-L103 PolarHBondContact O-N 3.25Å
100	L	80.9	Confident	84.8	Confident	32 Å²	32	73.9 Å²	73.9	17%	0.168	36%	0.363	C	S	.	.	H	α-helix	trans	-60	-46.2	174.6	-75.6	168	0	0	0	111.2	I10 A96 I97 A102 L103 E104	I10-L100 HydrophobicContact CD1-CD1 4.39Å; I10-L100 HydrophobicContact CG1-CD1 4.33Å; I10-L100 HydrophobicContact CG2-CD1 4.19Å; A96-L100 WeakPolarHBondContact O-CB 3.48Å; A96-L100 VanDerWaalsContact O-CG 3.24Å; A96-L100 WeakPolarHBondContact O-CG 3.27Å; A96-L100 PolarHBondContact O-N 2.97Å; I97-L100 PolarHBondContact O-N 3.33Å; L100-A102 PolarHBondContact O-N 3.15Å; L100-L103 PolarHBondContact O-N 3.4Å; L100-E104 WeakPolarHBondContact O-CB 3.41Å; L100-E104 WeakPolarHBondContact O-CG 3.47Å; L100-E104 PolarHBondContact O-N 3.09Å
101	R	84.4	Confident	84.9	Confident	126 Å²	126	73 Å²	73	48%	0.475	35%	0.354	S	S	.	.	H	α-helix	trans	-64.4	-36.8	177.4	-71.2	-61.1	-129.7	-170.7	1.6	113	F6 I97 Y98 E104 K105	F6-R101 VanDerWaalsContact CE1-NH1 3.3Å; I97-R101 HydrophobicContact CG2-CG 4.41Å; I97-R101 WeakPolarHBondContact O-CB 3.48Å; I97-R101 VanDerWaalsContact O-CG 3.32Å; I97-R101 WeakPolarHBondContact O-CG 3.39Å; I97-R101 PolarHBondContact O-N 2.86Å; Y98-R101 PolarHBondContact O-N 2.91Å; R101-E104 VanDerWaalsContact CD-OE2 3.22Å; R101-E104 WeakPolarHBondContact CD-OE2 3.18Å; R101-E104 IonicContact NH1-OE2 2.68Å; R101-E104 PolarHBondContact NH1-OE2 3.35Å; R101-E104 PolarHBondContact O-N 2.97Å; R101-K105 WeakPolarHBondContact O-CG 3.47Å; R101-K105 PolarHBondContact O-N 3.32Å
102	A	85.3	Confident	84.9	Confident	40 Å²	40	70.5 Å²	70.5	33%	0.331	34%	0.339	S	S	.	.	H	α-helix	trans	-63.4	-48	173.3	0	0	0	0	0	111.5	Y98 Q99 L100 E104 K105 E106	Y98-A102 PolarHBondContact O-N 3.34Å; Q99-A102 PolarHBondContact O-N 2.89Å; L100-A102 PolarHBondContact O-N 3.15Å; A102-E104 VanDerWaalsContact C-N 3.31Å; A102-E104 PolarHBondContact O-N 2.96Å; A102-K105 PolarHBondContact O-N 2.79Å; A102-E106 PolarHBondContact O-N 3.18Å
103	L	82.5	Confident	85.1	Confident	69 Å²	69	71.7 Å²	71.7	36%	0.361	35%	0.353	S	S	.	.	H	α-helix	trans	-68.1	-26.1	177	-67.6	169.8	0	0	0	113.2	Q99 L100 R107	Q99-L103 WeakPolarHBondContact O-CB 3.4Å; Q99-L103 WeakPolarHBondContact O-CG 3.32Å; Q99-L103 PolarHBondContact O-N 3.25Å; L100-L103 PolarHBondContact O-N 3.4Å; L103-R107 WeakPolarHBondContact O-CB 3.47Å; L103-R107 VanDerWaalsContact O-CG 3.26Å; L103-R107 WeakPolarHBondContact O-CG 3.34Å; L103-R107 PolarHBondContact O-N 2.91Å; L103-R107 PolarHBondContact O-NE 2.94Å
104	E	83.3	Confident	85.5	Confident	55 Å²	55	69 Å²	69	26%	0.257	34%	0.34	S	S	.	.	H	α-helix	trans	-68.5	-47.9	168.7	-77.7	-179.8	158.5	0	0	111.9	F6 L100 R101 A102 E106 R107 H108	F6-E104 WeakPolarHBondContact CE2-OE1 3.48Å; F6-E104 WeakPolarHBondContact CZ-OE1 3.41Å; F6-E104 WeakPolarHBondContact CZ-OE2 3.32Å; L100-E104 WeakPolarHBondContact O-CB 3.41Å; L100-E104 WeakPolarHBondContact O-CG 3.47Å; L100-E104 PolarHBondContact O-N 3.09Å; R101-E104 VanDerWaalsContact CD-OE2 3.22Å; R101-E104 WeakPolarHBondContact CD-OE2 3.18Å; R101-E104 IonicContact NH1-OE2 2.68Å; R101-E104 PolarHBondContact NH1-OE2 3.35Å; R101-E104 PolarHBondContact O-N 2.97Å; A102-E104 VanDerWaalsContact C-N 3.31Å; A102-E104 PolarHBondContact O-N 2.96Å; E104-E106 PolarHBondContact O-N 2.91Å; E104-R107 PolarHBondContact O-N 3.34Å; E104-H108 WeakPolarHBondContact O-CB 3.24Å; E104-H108 PolarHBondContact O-N 3.44Å
105	K	87.3	Confident	85.6	Confident	158 Å²	158	74 Å²	74	69%	0.687	35%	0.347	S	S	*	.	H	α-helix	trans	-59.1	-46.9	176	-74.2	-177.8	175.2	-168	0	111.8	R101 A102 R107 H108 C109	R101-K105 WeakPolarHBondContact O-CG 3.47Å; R101-K105 PolarHBondContact O-N 3.32Å; A102-K105 PolarHBondContact O-N 2.79Å; K105-R107 PolarHBondContact O-N 2.91Å; K105-H108 PolarHBondContact O-N 2.9Å; K105-C109 PolarHBondContact O-N 3.43Å
106	E	86.1	Confident	85.8	Confident	92 Å²	92	77.8 Å²	77.8	43%	0.43	36%	0.359	S	S	.	.	H	α-helix	trans	-59.6	-47.1	178	-166.2	-158.6	145.9	0	0	111.8	A102 E104 H108 K110	A102-E106 PolarHBondContact O-N 3.18Å; E104-E106 PolarHBondContact O-N 2.91Å; E106-H108 VanDerWaalsContact C-N 3.32Å; E106-H108 PolarHBondContact O-N 3.31Å; E106-K110 HydrophobicContact CG-CD 4.37Å; E106-K110 WeakPolarHBondContact O-CB 3.3Å; E106-K110 WeakPolarHBondContact O-CG 3.33Å; E106-K110 PolarHBondContact O-N 3.29Å; E106-K110 WeakPolarHBondContact OE1-CE 3.45Å; E106-K110 IonicContact OE1-NZ 2.65Å; E106-K110 PolarHBondContact OE1-NZ 2.83Å
107	R	83.4	Confident	86	Confident	62 Å²	62	82.6 Å²	82.6	23%	0.234	38%	0.381	C	S	.	.	H	α-helix	trans	-65.1	-34.1	175.7	-74.8	177.9	-66.1	167.8	3.8	112.6	L103 E104 K105 K111	L103-R107 WeakPolarHBondContact O-CB 3.47Å; L103-R107 VanDerWaalsContact O-CG 3.26Å; L103-R107 WeakPolarHBondContact O-CG 3.34Å; L103-R107 PolarHBondContact O-N 2.91Å; L103-R107 PolarHBondContact O-NE 2.94Å; E104-R107 PolarHBondContact O-N 3.34Å; K105-R107 PolarHBondContact O-N 2.91Å; R107-K111 WeakPolarHBondContact O-CB 3.42Å; R107-K111 PolarHBondContact O-N 3.25Å
108	H	85.6	Confident	86.3	Confident	124 Å²	124	82 Å²	82	57%	0.574	38%	0.378	S	S	*	.	H	α-helix	trans	-67.1	-51.4	176.4	-166.2	-92.9	0	0	0	111.1	E104 K105 E106 K110 K111 V112	E104-H108 WeakPolarHBondContact O-CB 3.24Å; E104-H108 PolarHBondContact O-N 3.44Å; K105-H108 PolarHBondContact O-N 2.9Å; E106-H108 VanDerWaalsContact C-N 3.32Å; E106-H108 PolarHBondContact O-N 3.31Å; H108-K110 VanDerWaalsContact C-N 3.32Å; H108-K110 PolarHBondContact O-N 2.86Å; H108-K111 PolarHBondContact O-N 3.41Å; H108-K111 VanDerWaalsContact O-N 3.13Å; H108-V112 WeakPolarHBondContact O-CG2 3.5Å; H108-V112 PolarHBondContact O-N 3.06Å
109	C	89.6	Confident	86.3	Confident	37 Å²	37	80.5 Å²	80.5	25%	0.25	38%	0.377	C	S	.	.	H	α-helix	trans	-60.3	-41.1	176.2	-66.5	0	0	0	0	112.1	K105 K111 V112 A113 C373	K105-C109 PolarHBondContact O-N 3.43Å; C109-K111 PolarHBondContact O-N 3.34Å; C109-V112 PolarHBondContact O-N 2.98Å; C109-A113 WeakPolarHBondContact O-CB 3.4Å; C109-A113 PolarHBondContact O-N 3.38Å; C109-C373 HydrophobicContact CB-CB 3.92Å; C109-C373 WeakPolarHBondContact CB-SG 3.36Å; C109-C373 WeakPolarHBondContact SG-CB 3.5Å; C109-C373 CovalentContact SG-SG 2.03Å; C109-C373 PolarHBondContact SG-SG 3.27Å
110	K	87.7	Confident	86.5	Confident	100 Å²	100	81.7 Å²	81.7	44%	0.435	40%	0.397	S	S	.	.	H	α-helix	trans	-62	-39.8	174	-76.5	176.8	172.4	175.5	0	112.8	E106 H108 L114 L139	E106-K110 HydrophobicContact CG-CD 4.37Å; E106-K110 WeakPolarHBondContact O-CB 3.3Å; E106-K110 WeakPolarHBondContact O-CG 3.33Å; E106-K110 PolarHBondContact O-N 3.29Å; E106-K110 WeakPolarHBondContact OE1-CE 3.45Å; E106-K110 IonicContact OE1-NZ 2.65Å; E106-K110 PolarHBondContact OE1-NZ 2.83Å; H108-K110 VanDerWaalsContact C-N 3.32Å; H108-K110 PolarHBondContact O-N 2.86Å; K110-L114 PolarHBondContact O-N 2.81Å; K110-L139 HydrophobicContact CB-CD1 4.3Å
111	K	86.6	Confident	86.7	Confident	85 Å²	85	81.8 Å²	81.8	37%	0.37	40%	0.399	S	S	.	.	H	α-helix	trans	-66.7	-36.8	174.5	-173.5	174.3	175.6	177	0	112.3	R107 H108 C109 R115 M136 E140	R107-K111 WeakPolarHBondContact O-CB 3.42Å; R107-K111 PolarHBondContact O-N 3.25Å; H108-K111 PolarHBondContact O-N 3.41Å; H108-K111 VanDerWaalsContact O-N 3.13Å; C109-K111 PolarHBondContact O-N 3.34Å; K111-R115 VanDerWaalsContact O-CB 3.27Å; K111-R115 WeakPolarHBondContact O-CB 3.33Å; K111-R115 PolarHBondContact O-N 2.82Å; K111-R115 VanDerWaalsContact O-N 3.12Å; K111-M136 HydrophobicContact CD-CE 4.39Å; K111-M136 HydrophobicContact CG-CE 3.75Å; K111-E140 IonicContact NZ-OE1 2.99Å; K111-E140 PolarHBondContact NZ-OE1 3.48Å
112	V	89.9	Confident	86.6	Confident	49 Å²	49	82.3 Å²	82.3	30%	0.297	41%	0.411	S	S	.	.	H	α-helix	trans	-70.3	-41.9	175.7	173	0	0	0	0	111.4	H108 C109 R115 R116	H108-V112 WeakPolarHBondContact O-CG2 3.5Å; H108-V112 PolarHBondContact O-N 3.06Å; C109-V112 PolarHBondContact O-N 2.98Å; V112-R115 PolarHBondContact O-N 3.33Å; V112-R116 PolarHBondContact O-N 3.07Å
113	A	90.5	Very high	85.9	Confident	46 Å²	46	84.4 Å²	84.4	38%	0.38	43%	0.428	S	S	.	.	H	α-helix	trans	-61.6	-53.5	176.4	0	0	0	0	0	111.7	C109 R115 R116 E117	C109-A113 WeakPolarHBondContact O-CB 3.4Å; C109-A113 PolarHBondContact O-N 3.38Å; A113-R115 PolarHBondContact O-N 2.83Å; A113-R116 PolarHBondContact O-N 3.41Å; A113-R116 VanDerWaalsContact O-N 3.09Å; A113-E117 PolarHBondContact O-N 3.44Å
114	L	88.5	Confident	85.3	Confident	22 Å²	22	90.2 Å²	90.2	12%	0.115	45%	0.453	C	S	.	.	H	α-helix	trans	-59.6	-31.7	175.8	-99.2	79.7	0	0	0	112.7	K110 L118 I132 E135 M136 L139	K110-L114 PolarHBondContact O-N 2.81Å; L114-L118 WeakPolarHBondContact O-CB 3.19Å; L114-L118 PolarHBondContact O-N 3.24Å; L114-I132 HydrophobicContact CB-CG2 4.11Å; L114-I132 HydrophobicContact CD2-CG2 4.13Å; L114-I132 HydrophobicContact CG-CG2 4.05Å; L114-I132 VanDerWaalsContact O-CG2 3.24Å; L114-I132 WeakPolarHBondContact O-CG2 3.44Å; L114-E135 HydrophobicContact CD2-CB 3.52Å; L114-M136 HydrophobicContact CB-CG 3.94Å; L114-M136 HydrophobicContact CD2-CG 3.87Å; L114-L139 HydrophobicContact CD2-CD1 4.36Å
115	R	87.4	Confident	85.2	Confident	145 Å²	145	93.1 Å²	93.1	55%	0.547	47%	0.469	S	S	.	.	H	α-helix	trans	-67.4	-45.4	175.3	-179.4	175.5	176.8	175	0.8	111.5	K111 V112 A113 E117 L118 E119 M136	K111-R115 VanDerWaalsContact O-CB 3.27Å; K111-R115 WeakPolarHBondContact O-CB 3.33Å; K111-R115 PolarHBondContact O-N 2.82Å; K111-R115 VanDerWaalsContact O-N 3.12Å; V112-R115 PolarHBondContact O-N 3.33Å; A113-R115 PolarHBondContact O-N 2.83Å; R115-E117 VanDerWaalsContact C-N 3.33Å; R115-E117 PolarHBondContact O-N 3.03Å; R115-L118 WeakPolarHBondContact O-CB 3.4Å; R115-L118 PolarHBondContact O-N 3.03Å; R115-L118 VanDerWaalsContact O-N 3.16Å; R115-E119 WeakPolarHBondContact CG-OE1 3.02Å; R115-E119 IonicContact CZ-OE1 3.69Å; R115-E119 VanDerWaalsContact CZ-OE1 3.32Å; R115-E119 IonicContact NE-OE1 3.67Å; R115-E119 PolarHBondContact NE-OE1 2.86Å; R115-E119 IonicContact NE-OE2 3.97Å; R115-E119 IonicContact NH2-OE1 2.75Å; R115-E119 PolarHBondContact NH2-OE1 3.39Å; R115-E119 WeakPolarHBondContact O-CB 3.21Å; R115-E119 WeakPolarHBondContact O-CG 3.2Å; R115-E119 PolarHBondContact O-N 3.48Å; R115-M136 HydrophobicContact CB-CE 4.25Å
116	R	88.6	Confident	85	Confident	126 Å²	126	90 Å²	90	48%	0.475	46%	0.463	S	S	.	.	H	α-helix	trans	-62.4	-38.9	175	-72.4	174.4	172.2	158.3	-2.4	111.5	V112 A113 E119 A120 D370	V112-R116 PolarHBondContact O-N 3.07Å; A113-R116 PolarHBondContact O-N 3.41Å; A113-R116 VanDerWaalsContact O-N 3.09Å; R116-E119 PolarHBondContact O-N 3.37Å; R116-A120 VanDerWaalsContact O-CB 3.31Å; R116-A120 WeakPolarHBondContact O-CB 3.46Å; R116-A120 PolarHBondContact O-N 3.06Å; R116-D370 IonicContact CZ-OD1 3.25Å; R116-D370 IonicContact NH2-OD1 3.76Å; R116-D370 PolarHBondContact NH2-OD1 3.05Å
117	E	87.8	Confident	84.8	Confident	104 Å²	104	90.9 Å²	90.9	49%	0.486	47%	0.467	S	S	.	.	H	α-helix	trans	-63.1	-42.4	171.3	-69	177.1	170.8	0	0	112.3	A113 R115 E119 A120 V121 I132	A113-E117 PolarHBondContact O-N 3.44Å; R115-E117 VanDerWaalsContact C-N 3.33Å; R115-E117 PolarHBondContact O-N 3.03Å; E117-E119 VanDerWaalsContact C-N 3.28Å; E117-E119 PolarHBondContact O-N 3.4Å; E117-A120 PolarHBondContact O-N 2.91Å; E117-V121 VanDerWaalsContact O-CG2 3.3Å; E117-V121 WeakPolarHBondContact O-CG2 3.5Å; E117-V121 PolarHBondContact O-N 2.94Å; E117-I132 HydrophobicContact CB-CD1 4.09Å
118	L	87.9	Confident	84.8	Confident	39 Å²	39	90.6 Å²	90.6	20%	0.204	47%	0.472	C	S	.	.	H	α-helix	trans	-64.5	-32.8	177.4	-165.8	74.2	0	0	0	112.8	L114 R115 K129 I132 M136	L114-L118 WeakPolarHBondContact O-CB 3.19Å; L114-L118 PolarHBondContact O-N 3.24Å; R115-L118 WeakPolarHBondContact O-CB 3.4Å; R115-L118 PolarHBondContact O-N 3.03Å; R115-L118 VanDerWaalsContact O-N 3.16Å; L118-K129 HydrophobicContact CD1-CG 3.65Å; L118-I132 HydrophobicContact CB-CG2 3.89Å; L118-I132 HydrophobicContact CD1-CB 3.87Å; L118-I132 HydrophobicContact CD1-CG2 3.81Å; L118-I132 HydrophobicContact CG-CG2 4.43Å; L118-M136 HydrophobicContact CD2-SD 4.25Å
119	E	86.1	Confident	84.8	Confident	121 Å²	121	89.3 Å²	89.3	57%	0.565	47%	0.465	S	S	*	.	H	α-helix	trans	-81.8	-21.4	178.9	-71.8	165.9	172.1	0	0	112.3	R115 R116 E117	R115-E119 WeakPolarHBondContact CG-OE1 3.02Å; R115-E119 IonicContact CZ-OE1 3.69Å; R115-E119 VanDerWaalsContact CZ-OE1 3.32Å; R115-E119 IonicContact NE-OE1 3.67Å; R115-E119 PolarHBondContact NE-OE1 2.86Å; R115-E119 IonicContact NE-OE2 3.97Å; R115-E119 IonicContact NH2-OE1 2.75Å; R115-E119 PolarHBondContact NH2-OE1 3.39Å; R115-E119 WeakPolarHBondContact O-CB 3.21Å; R115-E119 WeakPolarHBondContact O-CG 3.2Å; R115-E119 PolarHBondContact O-N 3.48Å; R116-E119 PolarHBondContact O-N 3.37Å; E117-E119 VanDerWaalsContact C-N 3.28Å; E117-E119 PolarHBondContact O-N 3.4Å
120	A	86.4	Confident	84.6	Confident	84 Å²	84	94 Å²	94	69%	0.694	48%	0.477	S	S	*	.	H	α-helix	trans	-95.3	-3.9	177.6	0	0	0	0	0	115	R116 E117	R116-A120 VanDerWaalsContact O-CB 3.31Å; R116-A120 WeakPolarHBondContact O-CB 3.46Å; R116-A120 PolarHBondContact O-N 3.06Å; E117-A120 PolarHBondContact O-N 2.91Å
121	V	86.8	Confident	84.6	Confident	34 Å²	34	96.4 Å²	96.4	21%	0.206	48%	0.483	C	S	.	.	S	Bend	trans	-92.8	115.1	178.5	167.6	0	0	0	0	111	E117 M125 V128 I132	E117-V121 VanDerWaalsContact O-CG2 3.3Å; E117-V121 WeakPolarHBondContact O-CG2 3.5Å; E117-V121 PolarHBondContact O-N 2.94Å; V121-M125 HydrophobicContact CG1-CB 3.66Å; V121-V128 HydrophobicContact CG1-CB 4.32Å; V121-V128 HydrophobicContact CG1-CG1 4.4Å; V121-V128 HydrophobicContact CG2-CG1 4.21Å; V121-I132 HydrophobicContact CG2-CD1 4.04Å
122	D	81	Confident	84.4	Confident	137 Å²	137	93.2 Å²	93.2	73%	0.733	47%	0.47	S	S	*	.			trans	-56.3	152.8	178.6	-92.2	-53.2	0	0	0	114.3	E124 M125	D122-E124 PolarHBondContact O-N 3.38Å; D122-E124 VanDerWaalsContact O-N 3.1Å; D122-M125 PolarHBondContact O-N 2.9Å
123	A	70.3	Confident	84.2	Confident	84 Å²	84	94.6 Å²	94.6	69%	0.694	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	-25.7	-169.4	0	0	0	0	0	114.9	V126	A123-V126 WeakPolarHBondContact O-CG2 3.35Å
124	E	71.5	Confident	84	Confident	190 Å²	190	96.9 Å²	96.9	89%	0.888	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	-26.4	175.9	-64.7	-157.5	136.1	0	0	113.2	D122 V126	D122-E124 PolarHBondContact O-N 3.38Å; D122-E124 VanDerWaalsContact O-N 3.1Å; E124-V126 PolarHBondContact O-N 3.13Å
125	M	80.9	Confident	83.8	Confident	117 Å²	117	101.1 Å²	101.1	58%	0.576	49%	0.494	S	S	*	.			trans	-82.8	48.6	-178.7	-81.2	-151.3	170.4	0	0	113.3	V121 D122 E127 V128 K129	V121-M125 HydrophobicContact CG1-CB 3.66Å; D122-M125 PolarHBondContact O-N 2.9Å; M125-E127 PolarHBondContact O-N 2.89Å; M125-E127 VanDerWaalsContact O-N 3.16Å; M125-V128 HydrophobicContact CB-CB 4.23Å; M125-V128 HydrophobicContact CB-CG2 4.22Å; M125-V128 HydrophobicContact CG-CG2 4.47Å; M125-V128 PolarHBondContact O-N 3.43Å; M125-V128 HydrophobicContact SD-CG2 3.82Å; M125-K129 PolarHBondContact O-N 3.42Å
126	V	81.7	Confident	83.4	Confident	93 Å²	93	95.6 Å²	95.6	56%	0.564	47%	0.474	S	S	*	.	H	α-helix	trans	-51.4	-40.3	179.8	-177.3	0	0	0	0	112.5	A123 E124 V128 R130	A123-V126 WeakPolarHBondContact O-CG2 3.35Å; E124-V126 PolarHBondContact O-N 3.13Å; V126-V128 VanDerWaalsContact C-N 3.32Å; V126-V128 PolarHBondContact O-N 3.45Å; V126-R130 WeakPolarHBondContact O-CB 3.23Å; V126-R130 PolarHBondContact O-N 3.45Å
127	E	83.2	Confident	83	Confident	109 Å²	109	96.5 Å²	96.5	51%	0.509	48%	0.478	S	S	.	.	H	α-helix	trans	-72.5	-22.2	-178.8	-163.3	59.1	-133.9	0	0	113.4	M125 R131	M125-E127 PolarHBondContact O-N 2.89Å; M125-E127 VanDerWaalsContact O-N 3.16Å; E127-R131 WeakPolarHBondContact O-CG 3.29Å; E127-R131 PolarHBondContact O-NE 3.38Å
128	V	83.6	Confident	82.7	Confident	56 Å²	56	97.5 Å²	97.5	34%	0.339	48%	0.483	S	S	.	.	H	α-helix	trans	-82.9	-48.5	173.5	-179.4	0	0	0	0	109.8	V121 M125 V126 R130 R131 I132	V121-V128 HydrophobicContact CG1-CB 4.32Å; V121-V128 HydrophobicContact CG1-CG1 4.4Å; V121-V128 HydrophobicContact CG2-CG1 4.21Å; M125-V128 HydrophobicContact CB-CB 4.23Å; M125-V128 HydrophobicContact CB-CG2 4.22Å; M125-V128 HydrophobicContact CG-CG2 4.47Å; M125-V128 PolarHBondContact O-N 3.43Å; M125-V128 HydrophobicContact SD-CG2 3.82Å; V126-V128 VanDerWaalsContact C-N 3.32Å; V126-V128 PolarHBondContact O-N 3.45Å; V128-R130 PolarHBondContact O-N 2.88Å; V128-R131 WeakPolarHBondContact O-CA 3.27Å; V128-R131 WeakPolarHBondContact O-CB 3.24Å; V128-R131 PolarHBondContact O-N 2.7Å; V128-I132 HydrophobicContact CG1-CD1 4.1Å; V128-I132 PolarHBondContact O-N 2.9Å; V128-I132 VanDerWaalsContact O-N 3.16Å
129	K	85.1	Confident	82	Confident	98 Å²	98	98.1 Å²	98.1	43%	0.426	49%	0.486	S	S	.	.	H	α-helix	trans	-50.5	-44.3	174	-169.7	173.5	-173.8	162.2	0	111.8	L118 M125 R131 I132 E133	L118-K129 HydrophobicContact CD1-CG 3.65Å; M125-K129 PolarHBondContact O-N 3.42Å; K129-R131 VanDerWaalsContact C-N 3.28Å; K129-R131 PolarHBondContact O-N 3.04Å; K129-I132 PolarHBondContact O-N 3.13Å; K129-E133 WeakPolarHBondContact O-CB 3.4Å; K129-E133 PolarHBondContact O-N 3.47Å
130	R	86	Confident	81.3	Confident	134 Å²	134	96.8 Å²	96.8	51%	0.506	48%	0.479	S	S	.	.	H	α-helix	trans	-67	-15.8	176.3	177.8	172.5	162.2	76	-7.2	115	V126 V128 K134	V126-R130 WeakPolarHBondContact O-CB 3.23Å; V126-R130 PolarHBondContact O-N 3.45Å; V128-R130 PolarHBondContact O-N 2.88Å; R130-K134 VanDerWaalsContact O-CD 3.29Å; R130-K134 WeakPolarHBondContact O-CD 3.3Å; R130-K134 VanDerWaalsContact O-CG 3.24Å; R130-K134 WeakPolarHBondContact O-CG 3.34Å
131	R	86.2	Confident	80.4	Confident	152 Å²	152	98.4 Å²	98.4	57%	0.574	47%	0.473	S	S	*	.	H	α-helix	trans	-86	-49.5	170.8	-67.6	170.3	-162.4	-135.3	2.4	110.8	E127 V128 K129 E133 K134 E135	E127-R131 WeakPolarHBondContact O-CG 3.29Å; E127-R131 PolarHBondContact O-NE 3.38Å; V128-R131 WeakPolarHBondContact O-CA 3.27Å; V128-R131 WeakPolarHBondContact O-CB 3.24Å; V128-R131 PolarHBondContact O-N 2.7Å; K129-R131 VanDerWaalsContact C-N 3.28Å; K129-R131 PolarHBondContact O-N 3.04Å; R131-E133 VanDerWaalsContact C-N 3.28Å; R131-E133 PolarHBondContact O-N 3.16Å; R131-K134 WeakPolarHBondContact O-CA 3.31Å; R131-K134 WeakPolarHBondContact O-CB 3.25Å; R131-K134 PolarHBondContact O-N 2.81Å; R131-E135 PolarHBondContact O-N 2.97Å
132	I	83.8	Confident	79.2	Confident	18 Å²	18	98.3 Å²	98.3	9%	0.092	48%	0.479	C	S	.	.	H	α-helix	trans	-56.4	-45.5	177.8	-59.6	167.4	0	0	0	110	L114 E117 L118 V121 V128 K129 K134 E135 M136	L114-I132 HydrophobicContact CB-CG2 4.11Å; L114-I132 HydrophobicContact CD2-CG2 4.13Å; L114-I132 HydrophobicContact CG-CG2 4.05Å; L114-I132 VanDerWaalsContact O-CG2 3.24Å; L114-I132 WeakPolarHBondContact O-CG2 3.44Å; E117-I132 HydrophobicContact CB-CD1 4.09Å; L118-I132 HydrophobicContact CB-CG2 3.89Å; L118-I132 HydrophobicContact CD1-CB 3.87Å; L118-I132 HydrophobicContact CD1-CG2 3.81Å; L118-I132 HydrophobicContact CG-CG2 4.43Å; V121-I132 HydrophobicContact CG2-CD1 4.04Å; V128-I132 HydrophobicContact CG1-CD1 4.1Å; V128-I132 PolarHBondContact O-N 2.9Å; V128-I132 VanDerWaalsContact O-N 3.16Å; K129-I132 PolarHBondContact O-N 3.13Å; I132-K134 VanDerWaalsContact C-N 3.32Å; I132-K134 PolarHBondContact O-N 2.9Å; I132-E135 PolarHBondContact O-N 3.19Å; I132-E135 VanDerWaalsContact O-N 3.14Å; I132-M136 PolarHBondContact O-N 3.03Å
133	E	85.2	Confident	78.1	Confident	78 Å²	78	99.2 Å²	99.2	36%	0.364	48%	0.476	S	S	.	.	H	α-helix	trans	-63.3	-34.3	176.9	-157.4	-153.7	138.3	0	0	113.2	K129 R131 R137	K129-E133 WeakPolarHBondContact O-CB 3.4Å; K129-E133 PolarHBondContact O-N 3.47Å; R131-E133 VanDerWaalsContact C-N 3.28Å; R131-E133 PolarHBondContact O-N 3.16Å; E133-R137 WeakPolarHBondContact O-CB 3.4Å; E133-R137 VanDerWaalsContact O-CG 3.24Å; E133-R137 WeakPolarHBondContact O-CG 3.47Å; E133-R137 PolarHBondContact O-N 3.45Å; E133-R137 IonicContact OE1-CZ 2.7Å; E133-R137 IonicContact OE1-NE 3.32Å; E133-R137 PolarHBondContact OE1-NE 3.01Å; E133-R137 IonicContact OE1-NH2 2.73Å; E133-R137 PolarHBondContact OE1-NH2 2.96Å
134	K	86.4	Confident	77.1	Confident	94 Å²	94	102.5 Å²	102.5	41%	0.409	48%	0.482	S	S	.	.	H	α-helix	trans	-68.1	-39.2	173.3	-77	170.4	-174.6	171.3	0	111.7	R130 R131 I132 R137 Q138	R130-K134 VanDerWaalsContact O-CD 3.29Å; R130-K134 WeakPolarHBondContact O-CD 3.3Å; R130-K134 VanDerWaalsContact O-CG 3.24Å; R130-K134 WeakPolarHBondContact O-CG 3.34Å; R131-K134 WeakPolarHBondContact O-CA 3.31Å; R131-K134 WeakPolarHBondContact O-CB 3.25Å; R131-K134 PolarHBondContact O-N 2.81Å; I132-K134 VanDerWaalsContact C-N 3.32Å; I132-K134 PolarHBondContact O-N 2.9Å; K134-R137 CarbonylContact O-C 3.6Å; K134-R137 PolarHBondContact O-N 3.24Å; K134-Q138 WeakPolarHBondContact O-CG 3.33Å; K134-Q138 PolarHBondContact O-N 2.78Å
135	E	83.1	Confident	75.9	Confident	111 Å²	111	99.1 Å²	99.1	52%	0.519	47%	0.47	S	S	.	.	H	α-helix	trans	-72.3	-35.3	178.3	-73.9	-167.1	-155.5	0	0	112.3	L114 R131 I132 R137 Q138 L139	L114-E135 HydrophobicContact CD2-CB 3.52Å; R131-E135 PolarHBondContact O-N 2.97Å; I132-E135 PolarHBondContact O-N 3.19Å; I132-E135 VanDerWaalsContact O-N 3.14Å; E135-R137 PolarHBondContact O-N 3.09Å; E135-Q138 PolarHBondContact O-N 3.31Å; E135-L139 WeakPolarHBondContact O-CG 3.48Å; E135-L139 PolarHBondContact O-N 2.85Å
136	M	80.4	Confident	74.4	Confident	28 Å²	28	97.5 Å²	97.5	14%	0.138	46%	0.459	C	S	.	.	H	α-helix	trans	-58.1	-47.4	166.3	-69.5	-166.5	81.7	0	0	111.5	K111 L114 R115 L118 I132 Q138 L139 E140	K111-M136 HydrophobicContact CD-CE 4.39Å; K111-M136 HydrophobicContact CG-CE 3.75Å; L114-M136 HydrophobicContact CB-CG 3.94Å; L114-M136 HydrophobicContact CD2-CG 3.87Å; R115-M136 HydrophobicContact CB-CE 4.25Å; L118-M136 HydrophobicContact CD2-SD 4.25Å; I132-M136 PolarHBondContact O-N 3.03Å; M136-Q138 VanDerWaalsContact C-N 3.3Å; M136-Q138 PolarHBondContact O-N 3.3Å; M136-L139 PolarHBondContact O-N 3.43Å; M136-E140 PolarHBondContact O-N 2.85Å
137	R	80.6	Confident	72.9	Confident	146 Å²	146	94.6 Å²	94.6	55%	0.551	45%	0.445	S	S	*	.	H	α-helix	trans	-62.9	-33.7	176	-71.1	168.9	-177.3	-93.6	7.3	112.2	E133 K134 E135 Q141	E133-R137 WeakPolarHBondContact O-CB 3.4Å; E133-R137 VanDerWaalsContact O-CG 3.24Å; E133-R137 WeakPolarHBondContact O-CG 3.47Å; E133-R137 PolarHBondContact O-N 3.45Å; E133-R137 IonicContact OE1-CZ 2.7Å; E133-R137 IonicContact OE1-NE 3.32Å; E133-R137 PolarHBondContact OE1-NE 3.01Å; E133-R137 IonicContact OE1-NH2 2.73Å; E133-R137 PolarHBondContact OE1-NH2 2.96Å; K134-R137 CarbonylContact O-C 3.6Å; K134-R137 PolarHBondContact O-N 3.24Å; E135-R137 PolarHBondContact O-N 3.09Å; R137-Q141 WeakPolarHBondContact O-CB 3.36Å; R137-Q141 VanDerWaalsContact O-CG 3.24Å; R137-Q141 WeakPolarHBondContact O-CG 3.46Å; R137-Q141 PolarHBondContact O-N 2.98Å
138	Q	79.8	Confident	71.4	Confident	125 Å²	125	94.3 Å²	94.3	58%	0.584	45%	0.452	S	S	*	.	H	α-helix	trans	-70.5	-37.8	172.9	-75.2	-178.8	30.7	0	0	112.8	K134 E135 M136 E140 Q141 G142	K134-Q138 WeakPolarHBondContact O-CG 3.33Å; K134-Q138 PolarHBondContact O-N 2.78Å; E135-Q138 PolarHBondContact O-N 3.31Å; M136-Q138 VanDerWaalsContact C-N 3.3Å; M136-Q138 PolarHBondContact O-N 3.3Å; Q138-E140 VanDerWaalsContact C-N 3.31Å; Q138-E140 PolarHBondContact O-N 2.88Å; Q138-Q141 PolarHBondContact O-N 3.4Å; Q138-G142 PolarHBondContact O-N 3.39Å
139	L	74	Confident	70	Confident	51 Å²	51	94 Å²	94	27%	0.267	45%	0.449	S	S	.	.	H	α-helix	trans	-63.6	-37	173.7	-75.4	166.3	0	0	0	111.5	K110 L114 E135 M136 G142 K143	K110-L139 HydrophobicContact CB-CD1 4.3Å; L114-L139 HydrophobicContact CD2-CD1 4.36Å; E135-L139 WeakPolarHBondContact O-CG 3.48Å; E135-L139 PolarHBondContact O-N 2.85Å; M136-L139 PolarHBondContact O-N 3.43Å; L139-G142 CarbonylContact O-C 3.55Å; L139-G142 PolarHBondContact O-N 3.13Å; L139-K143 PolarHBondContact O-N 3.5Å; L139-K143 VanDerWaalsContact O-N 3.09Å
140	E	72.1	Confident	68.9	Low	93 Å²	93	99.9 Å²	99.9	44%	0.435	47%	0.468	S	S	.	.	H	α-helix	trans	-74.8	-39.9	174.9	-67.7	-171.7	149	0	0	112.7	K111 M136 Q138 G142 K143 L144	K111-E140 IonicContact NZ-OE1 2.99Å; K111-E140 PolarHBondContact NZ-OE1 3.48Å; M136-E140 PolarHBondContact O-N 2.85Å; Q138-E140 VanDerWaalsContact C-N 3.31Å; Q138-E140 PolarHBondContact O-N 2.88Å; E140-G142 VanDerWaalsContact C-N 3.27Å; E140-G142 PolarHBondContact O-N 3.46Å; E140-K143 WeakPolarHBondContact O-CA 3.42Å; E140-K143 WeakPolarHBondContact O-CB 3.33Å; E140-K143 PolarHBondContact O-N 3.14Å; E140-L144 PolarHBondContact O-N 3.43Å
141	Q	67	Low	68.2	Low	118 Å²	118	96.2 Å²	96.2	55%	0.551	47%	0.472	S	S	*	.	H	α-helix	trans	-63	-33.8	169.5	-74.1	173.4	-4.8	0	0	111.8	R137 Q138 K143 L144 N145	R137-Q141 WeakPolarHBondContact O-CB 3.36Å; R137-Q141 VanDerWaalsContact O-CG 3.24Å; R137-Q141 WeakPolarHBondContact O-CG 3.46Å; R137-Q141 PolarHBondContact O-N 2.98Å; Q138-Q141 PolarHBondContact O-N 3.4Å; Q141-K143 PolarHBondContact O-N 2.97Å; Q141-L144 PolarHBondContact O-N 3.19Å; Q141-N145 VanDerWaalsContact O-CB 3.28Å; Q141-N145 WeakPolarHBondContact O-CB 3.38Å; Q141-N145 PolarHBondContact O-N 3.47Å; Q141-N145 PolarHBondContact O-ND2 3.43Å; Q141-N145 VanDerWaalsContact O-ND2 3.15Å
142	G	62	Low	67.7	Low	33 Å²	33	92 Å²	92	34%	0.34	47%	0.466	S	S	.	.	H	α-helix	trans	-72.4	-9.3	169.6	0	0	0	0	0	114.4	Q138 L139 E140	Q138-G142 PolarHBondContact O-N 3.39Å; L139-G142 CarbonylContact O-C 3.55Å; L139-G142 PolarHBondContact O-N 3.13Å; E140-G142 VanDerWaalsContact C-N 3.27Å; E140-G142 PolarHBondContact O-N 3.46Å
143	K	56.6	Low	67.5	Low	156 Å²	156	92.7 Å²	92.7	68%	0.678	47%	0.469	S	S	*	.	H	α-helix	trans	-83.8	-29.4	167.3	-148.8	-178.2	-176.4	-172.3	0	111.4	L139 E140 Q141	L139-K143 PolarHBondContact O-N 3.5Å; L139-K143 VanDerWaalsContact O-N 3.09Å; E140-K143 WeakPolarHBondContact O-CA 3.42Å; E140-K143 WeakPolarHBondContact O-CB 3.33Å; E140-K143 PolarHBondContact O-N 3.14Å; Q141-K143 PolarHBondContact O-N 2.97Å
144	L	49.4	Very low	67.3	Low	153 Å²	153	90.7 Å²	90.7	80%	0.801	46%	0.461	S	S	*	.	H	α-helix	trans	-84.1	-39.7	173.3	-133.5	83.1	0	0	0	112.6	E140 Q141 K146	E140-L144 PolarHBondContact O-N 3.43Å; Q141-L144 PolarHBondContact O-N 3.19Å; L144-K146 PolarHBondContact O-N 2.87Å
145	N	47.6	Very low	67.2	Low	119 Å²	119	90.4 Å²	90.4	64%	0.636	47%	0.47	S	S	*	.	S	Bend	trans	-81.6	69	179.5	-70.6	-42.1	0	0	0	111	Q141	Q141-N145 VanDerWaalsContact O-CB 3.28Å; Q141-N145 WeakPolarHBondContact O-CB 3.38Å; Q141-N145 PolarHBondContact O-N 3.47Å; Q141-N145 PolarHBondContact O-ND2 3.43Å; Q141-N145 VanDerWaalsContact O-ND2 3.15Å
146	K	49.8	Very low	67.4	Low	83 Å²	83	87 Å²	87	36%	0.361	46%	0.457	S	S	.	.			trans	16.1	111.4	161.8	-62.6	-168.2	160.3	134.4	0	115.9	E13 I16 L144 P148	E13-K146 WeakPolarHBondContact OE1-CG 3.49Å; E13-K146 WeakPolarHBondContact OE2-CE 3.49Å; I16-K146 HydrophobicContact CG2-CD 4.34Å; L144-K146 PolarHBondContact O-N 2.87Å; K146-P148 WeakPolarHBondContact O-CD 3.33Å
147	A	50	Low	67.5	Low	31 Å²	31	85.9 Å²	85.9	26%	0.256	45%	0.451	S	S	.	.			trans	-48	109.9	178.2	0	0	0	0	0	110.4	L149	A147-L149 PolarHBondContact O-N 3.11Å
148	P	50.8	Low	67.9	Low	103 Å²	103	81.8 Å²	81.8	67%	0.669	44%	0.442	S	S	*	.			trans	-62.6	133.9	-170.8	-25	34.4	0	0	0	110.7	K146 R150	K146-P148 WeakPolarHBondContact O-CD 3.33Å; P148-R150 WeakPolarHBondContact O-CB 3.43Å; P148-R150 PolarHBondContact O-N 3.19Å
149	L	54.1	Low	68.4	Low	51 Å²	51	78.2 Å²	78.2	27%	0.267	43%	0.434	S	S	.	.			trans	-67	74.6	173.7	-79.9	70.6	0	0	0	110.1	H17 A147 L153	H17-L149 HydrophobicContact CB-CD1 3.63Å; H17-L149 HydrophobicContact CB-CD2 3.98Å; H17-L149 HydrophobicContact CB-CG 4.49Å; A147-L149 PolarHBondContact O-N 3.11Å; L149-L153 HydrophobicContact CG-CD2 4.08Å
150	R	62.6	Low	69.1	Low	221 Å²	221	77 Å²	77	83%	0.834	43%	0.427	S	S	*	.			trans	-100.4	118.6	-166.5	-161	179.3	-169.8	-161.6	2.4	110	P148 S152	P148-R150 WeakPolarHBondContact O-CB 3.43Å; P148-R150 PolarHBondContact O-N 3.19Å; R150-S152 PolarHBondContact O-N 3.2Å
151	G	71.8	Confident	70	Confident	56 Å²	56	72.7 Å²	72.7	58%	0.577	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.4	-104	173.5	0	0	0	0	0	113.4	L153 L154 C155	G151-L153 PolarHBondContact O-N 2.89Å; G151-L154 PolarHBondContact O-N 3.29Å; G151-C155 PolarHBondContact O-N 3.42Å
152	S	75.6	Confident	71.2	Confident	64 Å²	64	70.3 Å²	70.3	45%	0.448	40%	0.4	S	S	.	.	H	α-helix	trans	-48.2	-53.9	-172.5	178	0	0	0	0	113.7	R150 L154 C155 T156	R150-S152 PolarHBondContact O-N 3.2Å; S152-L154 VanDerWaalsContact C-N 3.3Å; S152-L154 PolarHBondContact O-N 3.43Å; S152-C155 WeakPolarHBondContact O-CA 3.38Å; S152-C155 VanDerWaalsContact O-CB 3.31Å; S152-C155 WeakPolarHBondContact O-CB 3.5Å; S152-C155 PolarHBondContact O-N 2.96Å; S152-T156 PolarHBondContact O-N 3.34Å; S152-T156 PolarHBondContact O-OG1 3.17Å
153	L	79.5	Confident	72.8	Confident	33 Å²	33	72.3 Å²	72.3	17%	0.173	41%	0.406	C	S	.	.	H	α-helix	trans	-59.8	-41	-175.2	-174.8	58.1	0	0	0	112.1	Y92 A96 L149 G151 T156 Y157	Y92-L153 HydrophobicContact CE2-CD1 3.85Å; A96-L153 HydrophobicContact CB-CD1 3.93Å; L149-L153 HydrophobicContact CG-CD2 4.08Å; G151-L153 PolarHBondContact O-N 2.89Å; L153-T156 PolarHBondContact O-N 2.87Å; L153-T156 PolarHBondContact O-OG1 3.42Å; L153-Y157 WeakPolarHBondContact O-CB 3.23Å; L153-Y157 PolarHBondContact O-N 3.15Å
154	L	79.4	Confident	74.5	Confident	35 Å²	35	66.1 Å²	66.1	18%	0.183	38%	0.378	C	S	.	.	H	α-helix	trans	-67.8	-36.2	174.6	-172	75.5	0	0	0	112.3	G151 S152 Y157 V158 K237	G151-L154 PolarHBondContact O-N 3.29Å; S152-L154 VanDerWaalsContact C-N 3.3Å; S152-L154 PolarHBondContact O-N 3.43Å; L154-Y157 HydrophobicContact CD1-CD1 4.14Å; L154-Y157 PolarHBondContact O-N 3.45Å; L154-V158 WeakPolarHBondContact O-CG2 3.2Å; L154-V158 PolarHBondContact O-N 3.01Å; L154-K237 VanDerWaalsContact CD2-NZ 3.33Å
155	C	84.7	Confident	76.6	Confident	88 Å²	88	59.3 Å²	59.3	60%	0.595	34%	0.344	S	S	*	.	H	α-helix	trans	-63.6	-46.8	175.2	-166.9	0	0	0	0	111.1	G151 S152 Y157 V158 A159	G151-C155 PolarHBondContact O-N 3.42Å; S152-C155 WeakPolarHBondContact O-CA 3.38Å; S152-C155 VanDerWaalsContact O-CB 3.31Å; S152-C155 WeakPolarHBondContact O-CB 3.5Å; S152-C155 PolarHBondContact O-N 2.96Å; C155-Y157 VanDerWaalsContact C-N 3.3Å; C155-Y157 PolarHBondContact O-N 2.84Å; C155-V158 PolarHBondContact O-N 3.37Å; C155-A159 WeakPolarHBondContact O-CB 3.29Å; C155-A159 PolarHBondContact O-N 2.68Å
156	T	86.9	Confident	78.9	Confident	41 Å²	41	57.8 Å²	57.8	25%	0.252	34%	0.338	S	S	.	.	H	α-helix	trans	-65.2	-32.2	176.7	57.8	0	0	0	0	113	H95 S152 L153 H160	H95-T156 VanDerWaalsContact CE1-CG2 3.42Å; H95-T156 WeakPolarHBondContact CE1-CG2 3.18Å; H95-T156 PolarHBondContact CE1-OG1 2.86Å; H95-T156 WeakPolarHBondContact ND1-CG2 3.47Å; H95-T156 PolarHBondContact ND1-OG1 3.31Å; S152-T156 PolarHBondContact O-N 3.34Å; S152-T156 PolarHBondContact O-OG1 3.17Å; L153-T156 PolarHBondContact O-N 2.87Å; L153-T156 PolarHBondContact O-OG1 3.42Å; T156-H160 VanDerWaalsContact O-CB 3.27Å; T156-H160 WeakPolarHBondContact O-CB 3.43Å; T156-H160 PolarHBondContact O-N 2.89Å
157	Y	84.5	Confident	81.2	Confident	3 Å²	3	55.1 Å²	55.1	1%	0.012	33%	0.329	C	S	.	.	H	α-helix	trans	-68	-44.4	173.7	175.5	-126.8	0	0	0	112.6	S18 Y92 L153 L154 C155 H160 I161 E229 L233	S18-Y157 WeakPolarHBondContact CB-OH 3.34Å; S18-Y157 PolarHBondContact OG-OH 3.18Å; Y92-Y157 HydrophobicContact CE1-CD2 4.27Å; Y92-Y157 HydrophobicContact CE2-CD2 4.22Å; Y92-Y157 HydrophobicContact CE2-CG 4.28Å; L153-Y157 WeakPolarHBondContact O-CB 3.23Å; L153-Y157 PolarHBondContact O-N 3.15Å; L154-Y157 HydrophobicContact CD1-CD1 4.14Å; L154-Y157 PolarHBondContact O-N 3.45Å; C155-Y157 VanDerWaalsContact C-N 3.3Å; C155-Y157 PolarHBondContact O-N 2.84Å; Y157-H160 WeakPolarHBondContact O-CB 3.18Å; Y157-H160 PolarHBondContact O-N 3.15Å; Y157-I161 HydrophobicContact CD1-CD1 4.47Å; Y157-I161 HydrophobicContact CD2-CD1 4.13Å; Y157-I161 HydrophobicContact CD2-CG1 4.42Å; Y157-I161 HydrophobicContact CE1-CD1 4.07Å; Y157-I161 HydrophobicContact CE2-CD1 3.65Å; Y157-I161 HydrophobicContact CE2-CG1 4.11Å; Y157-I161 WeakPolarHBondContact O-CG1 3.31Å; Y157-I161 PolarHBondContact O-N 2.91Å; Y157-I161 VanDerWaalsContact O-N 3.13Å; Y157-E229 WeakPolarHBondContact OH-CG 3.29Å; Y157-E229 PolarHBondContact OH-OE1 3.36Å; Y157-E229 PolarHBondContact OH-OE2 3.01Å; Y157-L233 HydrophobicContact CD1-CD1 4.23Å; Y157-L233 HydrophobicContact CE1-CD1 3.49Å; Y157-L233 VanDerWaalsContact CE1-CD1 3.49Å; Y157-L233 HydrophobicContact CE1-CD2 4.06Å; Y157-L233 HydrophobicContact CE1-CG 4.42Å
158	V	87.5	Confident	83.3	Confident	60 Å²	60	53.9 Å²	53.9	36%	0.364	32%	0.318	S	S	.	.	H	α-helix	trans	-65.8	-43.2	175.2	172.3	0	0	0	0	110.8	L154 C155 H160 I161 V162	L154-V158 WeakPolarHBondContact O-CG2 3.2Å; L154-V158 PolarHBondContact O-N 3.01Å; C155-V158 PolarHBondContact O-N 3.37Å; V158-H160 VanDerWaalsContact C-N 3.31Å; V158-H160 PolarHBondContact O-N 3.47Å; V158-I161 PolarHBondContact O-N 2.73Å; V158-V162 HydrophobicContact CG1-CG2 4.36Å; V158-V162 WeakPolarHBondContact O-CB 3.4Å; V158-V162 VanDerWaalsContact O-CG2 3.31Å; V158-V162 WeakPolarHBondContact O-CG2 3.49Å; V158-V162 PolarHBondContact O-N 2.99Å
159	A	90	Very high	85.6	Confident	51 Å²	51	51.5 Å²	51.5	42%	0.421	30%	0.301	S	S	.	.	H	α-helix	trans	-59.9	-40.6	175	0	0	0	0	0	112	C155 V162 T163	C155-A159 WeakPolarHBondContact O-CB 3.29Å; C155-A159 PolarHBondContact O-N 2.68Å; A159-V162 PolarHBondContact O-N 3.48Å; A159-T163 WeakPolarHBondContact O-CB 3.42Å; A159-T163 PolarHBondContact O-N 3.12Å; A159-T163 PolarHBondContact O-OG1 2.96Å; A159-T163 VanDerWaalsContact O-OG1 3.05Å
160	H	90.3	Very high	87.6	Confident	24 Å²	24	52.4 Å²	52.4	11%	0.111	31%	0.312	C	S	.	.	H	α-helix	trans	-56.4	-53.5	173.5	152.3	-122.9	0	0	0	112.7	P88 S89 Y92 T156 Y157 V158 V162 T163 R164	P88-H160 PolarHBondContact O-CD2 3.11Å; P88-H160 VanDerWaalsContact O-CD2 3.24Å; S89-H160 VanDerWaalsContact CA-NE2 3.33Å; S89-H160 WeakPolarHBondContact CA-NE2 3.41Å; S89-H160 WeakPolarHBondContact CB-NE2 3.49Å; S89-H160 PolarHBondContact N-CD2 3.01Å; S89-H160 PolarHBondContact OG-NE2 3.01Å; Y92-H160 HydrophobicContact CG-CB 4.31Å; T156-H160 VanDerWaalsContact O-CB 3.27Å; T156-H160 WeakPolarHBondContact O-CB 3.43Å; T156-H160 PolarHBondContact O-N 2.89Å; Y157-H160 WeakPolarHBondContact O-CB 3.18Å; Y157-H160 PolarHBondContact O-N 3.15Å; V158-H160 VanDerWaalsContact C-N 3.31Å; V158-H160 PolarHBondContact O-N 3.47Å; H160-V162 VanDerWaalsContact C-N 3.34Å; H160-V162 PolarHBondContact O-N 3.11Å; H160-T163 PolarHBondContact O-N 3.28Å; H160-R164 WeakPolarHBondContact O-CB 3.41Å; H160-R164 PolarHBondContact O-N 2.86Å
161	I	90	Very high	89.2	Confident	3 Å²	3	43.4 Å²	43.4	2%	0.015	28%	0.279	C	S	.	.	H	α-helix	trans	-67.2	-37.6	-177.6	-52.1	157.6	0	0	0	110.7	Y157 V158 S165 E229 I230 L233	Y157-I161 HydrophobicContact CD1-CD1 4.47Å; Y157-I161 HydrophobicContact CD2-CD1 4.13Å; Y157-I161 HydrophobicContact CD2-CG1 4.42Å; Y157-I161 HydrophobicContact CE1-CD1 4.07Å; Y157-I161 HydrophobicContact CE2-CD1 3.65Å; Y157-I161 HydrophobicContact CE2-CG1 4.11Å; Y157-I161 WeakPolarHBondContact O-CG1 3.31Å; Y157-I161 PolarHBondContact O-N 2.91Å; Y157-I161 VanDerWaalsContact O-N 3.13Å; V158-I161 PolarHBondContact O-N 2.73Å; I161-S165 WeakPolarHBondContact O-CB 3.5Å; I161-S165 PolarHBondContact O-N 3.49Å; I161-S165 PolarHBondContact O-OG 2.7Å; I161-E229 HydrophobicContact CD1-CG 4.02Å; I161-I230 HydrophobicContact CB-CD1 4.2Å; I161-I230 HydrophobicContact CB-CG1 4.13Å; I161-I230 HydrophobicContact CG2-CD1 3.73Å; I161-I230 HydrophobicContact CG2-CG1 3.74Å; I161-L233 HydrophobicContact CD1-CD1 4.02Å
162	V	92.4	Very high	90.4	Very high	68 Å²	68	42.8 Å²	42.8	41%	0.412	26%	0.262	S	S	.	.	H	α-helix	trans	-62.9	-51.8	175.9	170.6	0	0	0	0	110.9	V158 A159 H160 R164 S165 V166 I230	V158-V162 HydrophobicContact CG1-CG2 4.36Å; V158-V162 WeakPolarHBondContact O-CB 3.4Å; V158-V162 VanDerWaalsContact O-CG2 3.31Å; V158-V162 WeakPolarHBondContact O-CG2 3.49Å; V158-V162 PolarHBondContact O-N 2.99Å; A159-V162 PolarHBondContact O-N 3.48Å; H160-V162 VanDerWaalsContact C-N 3.34Å; H160-V162 PolarHBondContact O-N 3.11Å; V162-R164 VanDerWaalsContact C-N 3.35Å; V162-R164 PolarHBondContact O-N 3.44Å; V162-S165 PolarHBondContact O-N 3.49Å; V162-S165 VanDerWaalsContact O-N 3.13Å; V162-V166 WeakPolarHBondContact O-CG2 3.33Å; V162-V166 PolarHBondContact O-N 3.4Å; V162-I230 HydrophobicContact CG2-CD1 3.97Å
163	T	94.4	Very high	91.4	Very high	75 Å²	75	42.9 Å²	42.9	46%	0.46	26%	0.26	S	S	.	.	H	α-helix	trans	-60.4	-43.1	177.8	-61.9	0	0	0	0	111.5	P88 A159 H160 S165 V166 V167	P88-T163 HydrophobicContact CB-CG2 4.41Å; P88-T163 HydrophobicContact CG-CG2 3.93Å; A159-T163 WeakPolarHBondContact O-CB 3.42Å; A159-T163 PolarHBondContact O-N 3.12Å; A159-T163 PolarHBondContact O-OG1 2.96Å; A159-T163 VanDerWaalsContact O-OG1 3.05Å; H160-T163 PolarHBondContact O-N 3.28Å; T163-S165 VanDerWaalsContact C-N 3.33Å; T163-S165 PolarHBondContact O-N 3.13Å; T163-V166 PolarHBondContact O-N 2.96Å; T163-V167 VanDerWaalsContact O-CG2 3.3Å; T163-V167 WeakPolarHBondContact O-CG2 3.45Å; T163-V167 PolarHBondContact O-N 2.94Å
164	R	92.8	Very high	92.2	Very high	26 Å²	26	42.1 Å²	42.1	10%	0.098	26%	0.26	C	S	.	.	H	α-helix	trans	-58	-44.9	173.7	-179.2	-179.5	175.6	167.4	2.2	111.7	V85 H160 V162 V167 E168	V85-R164 HydrophobicContact CG1-CG 4.03Å; H160-R164 WeakPolarHBondContact O-CB 3.41Å; H160-R164 PolarHBondContact O-N 2.86Å; V162-R164 VanDerWaalsContact C-N 3.35Å; V162-R164 PolarHBondContact O-N 3.44Å; R164-V167 PolarHBondContact O-N 3.45Å; R164-E168 WeakPolarHBondContact O-CB 3.19Å; R164-E168 PolarHBondContact O-N 3.49Å
165	S	94.1	Very high	93	Very high	11 Å²	11	40.8 Å²	40.8	8%	0.077	25%	0.252	C	S	.	.	H	α-helix	trans	-66.6	-41.7	-179	-57	0	0	0	0	111.8	I161 V162 T163 E168 V169	I161-S165 WeakPolarHBondContact O-CB 3.5Å; I161-S165 PolarHBondContact O-N 3.49Å; I161-S165 PolarHBondContact O-OG 2.7Å; V162-S165 PolarHBondContact O-N 3.49Å; V162-S165 VanDerWaalsContact O-N 3.13Å; T163-S165 VanDerWaalsContact C-N 3.33Å; T163-S165 PolarHBondContact O-N 3.13Å; S165-E168 PolarHBondContact O-N 2.97Å; S165-V169 WeakPolarHBondContact O-CB 3.27Å; S165-V169 VanDerWaalsContact O-CG2 3.3Å; S165-V169 WeakPolarHBondContact O-CG2 3.4Å; S165-V169 PolarHBondContact O-N 3.11Å
166	V	96.5	Very high	93.5	Very high	86 Å²	86	42.6 Å²	42.6	52%	0.521	25%	0.248	S	C	.	.	H	α-helix	trans	-61.5	-45.3	174.4	171.1	0	0	0	0	110.6	V162 T163 V169 S170	V162-V166 WeakPolarHBondContact O-CG2 3.33Å; V162-V166 PolarHBondContact O-N 3.4Å; T163-V166 PolarHBondContact O-N 2.96Å; V166-V169 PolarHBondContact O-N 3.04Å; V166-S170 WeakPolarHBondContact O-CB 3.37Å; V166-S170 PolarHBondContact O-N 2.96Å; V166-S170 PolarHBondContact O-OG 2.82Å
167	V	96.6	Very high	93.9	Very high	28 Å²	28	46.6 Å²	46.6	17%	0.17	27%	0.266	C	S	.	.	H	α-helix	trans	-63.7	-47	177.6	170.8	0	0	0	0	112	F84 V85 T163 R164 V169 S170 F171	F84-V167 HydrophobicContact CB-CG1 3.68Å; V85-V167 HydrophobicContact CG2-CG1 3.82Å; T163-V167 VanDerWaalsContact O-CG2 3.3Å; T163-V167 WeakPolarHBondContact O-CG2 3.45Å; T163-V167 PolarHBondContact O-N 2.94Å; R164-V167 PolarHBondContact O-N 3.45Å; V167-V169 VanDerWaalsContact C-N 3.28Å; V167-V169 PolarHBondContact O-N 3.38Å; V167-S170 PolarHBondContact O-N 2.92Å; V167-S170 VanDerWaalsContact O-N 3.15Å; V167-F171 HydrophobicContact CG1-CD2 3.85Å; V167-F171 HydrophobicContact CG1-CE2 3.97Å; V167-F171 WeakPolarHBondContact O-CD2 3.34Å; V167-F171 PolarHBondContact O-N 3.49Å
168	E	95.6	Very high	94.3	Very high	4 Å²	4	50.4 Å²	50.4	2%	0.019	29%	0.286	C	S	.	.	H	α-helix	trans	-59.2	-40.5	178	-168.1	89.5	-95.6	0	0	111	R33 Q81 V85 R164 S165 M172 A219 S222 L223	R33-E168 IonicContact CZ-OE1 2.68Å; R33-E168 IonicContact NH1-OE1 3.95Å; R33-E168 PolarHBondContact NH1-OE1 2.89Å; R33-E168 IonicContact NH1-OE2 3.54Å; R33-E168 IonicContact NH2-OE1 3.35Å; Q81-E168 PolarHBondContact NE2-OE1 3.02Å; V85-E168 HydrophobicContact CG2-CB 4.22Å; R164-E168 WeakPolarHBondContact O-CB 3.19Å; R164-E168 PolarHBondContact O-N 3.49Å; S165-E168 PolarHBondContact O-N 2.97Å; E168-M172 WeakPolarHBondContact O-CB 3.37Å; E168-M172 PolarHBondContact O-N 2.9Å; E168-A219 HydrophobicContact CG-CB 4.4Å; E168-S222 PolarHBondContact OE2-OG 2.9Å; E168-L223 HydrophobicContact CG-CB 4.4Å
169	V	97.4	Very high	94.6	Very high	53 Å²	53	48.5 Å²	48.5	32%	0.321	27%	0.273	S	S	.	.	H	α-helix	trans	-64.7	-46.3	172.4	170.9	0	0	0	0	111.9	S165 V166 V167 F171 M172 T173 L223	S165-V169 WeakPolarHBondContact O-CB 3.27Å; S165-V169 VanDerWaalsContact O-CG2 3.3Å; S165-V169 WeakPolarHBondContact O-CG2 3.4Å; S165-V169 PolarHBondContact O-N 3.11Å; V166-V169 PolarHBondContact O-N 3.04Å; V167-V169 VanDerWaalsContact C-N 3.28Å; V167-V169 PolarHBondContact O-N 3.38Å; V169-F171 VanDerWaalsContact C-N 3.32Å; V169-F171 PolarHBondContact O-N 3.37Å; V169-M172 HydrophobicContact CG2-CE 4.11Å; V169-M172 WeakPolarHBondContact O-CB 3.48Å; V169-M172 PolarHBondContact O-N 2.93Å; V169-T173 PolarHBondContact O-N 3.44Å; V169-T173 PolarHBondContact O-OG1 2.92Å; V169-L223 HydrophobicContact CG2-CD1 3.84Å; V169-L223 HydrophobicContact CG2-CD2 3.52Å; V169-L223 HydrophobicContact CG2-CG 4.35Å
170	S	97.3	Very high	94.8	Very high	71 Å²	71	47.1 Å²	47.1	50%	0.497	26%	0.264	S	S	.	.	H	α-helix	trans	-58.7	-41.3	179.6	-67.2	0	0	0	0	112.6	V166 V167 G174	V166-S170 WeakPolarHBondContact O-CB 3.37Å; V166-S170 PolarHBondContact O-N 2.96Å; V166-S170 PolarHBondContact O-OG 2.82Å; V167-S170 PolarHBondContact O-N 2.92Å; V167-S170 VanDerWaalsContact O-N 3.15Å; S170-G174 PolarHBondContact O-N 2.9Å
171	F	96.8	Very high	94.8	Very high	31 Å²	31	50.8 Å²	50.8	14%	0.136	28%	0.281	C	S	.	.	H	α-helix	trans	-74.5	-34.7	175.6	-82.2	-89.3	0	0	0	113	Y77 L80 Q81 F84 V167 V169 G174 Q175	Y77-F171 HydrophobicContact CD1-CD1 4.41Å; Y77-F171 HydrophobicContact CE1-CB 4.44Å; Y77-F171 AromaticContact CE1-CD1 3.7Å; Y77-F171 HydrophobicContact CE1-CD1 3.7Å; Y77-F171 HydrophobicContact CE2-CD1 4.27Å; Y77-F171 AromaticContact CZ-CD1 3.6Å; Y77-F171 WeakPolarHBondContact OH-CA 3.37Å; Y77-F171 PolarHBondContact OH-O 3.47Å; L80-F171 HydrophobicContact CB-CE1 4.13Å; L80-F171 HydrophobicContact CB-CZ 4.33Å; Q81-F171 HydrophobicContact CB-CB 4.1Å; Q81-F171 HydrophobicContact CB-CD1 3.49Å; Q81-F171 VanDerWaalsContact CB-CD1 3.49Å; Q81-F171 HydrophobicContact CB-CD2 4.32Å; Q81-F171 HydrophobicContact CB-CE1 3.93Å; Q81-F171 HydrophobicContact CB-CG 3.72Å; Q81-F171 HydrophobicContact CG-CB 3.5Å; Q81-F171 HydrophobicContact CG-CD1 3.91Å; Q81-F171 HydrophobicContact CG-CD2 4.13Å; Q81-F171 HydrophobicContact CG-CG 3.59Å; F84-F171 HydrophobicContact CB-CE2 3.7Å; F84-F171 HydrophobicContact CB-CZ 4.2Å; F84-F171 AromaticContact CD2-CE2 4Å; F84-F171 HydrophobicContact CD2-CE2 4Å; F84-F171 AromaticContact CD2-CZ 3.66Å; F84-F171 HydrophobicContact CD2-CZ 3.66Å; F84-F171 HydrophobicContact CE2-CZ 4.44Å; F84-F171 HydrophobicContact CG-CE2 4.07Å; F84-F171 HydrophobicContact CG-CZ 4.22Å; V167-F171 HydrophobicContact CG1-CD2 3.85Å; V167-F171 HydrophobicContact CG1-CE2 3.97Å; V167-F171 WeakPolarHBondContact O-CD2 3.34Å; V167-F171 PolarHBondContact O-N 3.49Å; V169-F171 VanDerWaalsContact C-N 3.32Å; V169-F171 PolarHBondContact O-N 3.37Å; F171-G174 PolarHBondContact O-N 3.21Å; F171-Q175 WeakPolarHBondContact O-CB 3.19Å; F171-Q175 PolarHBondContact O-N 2.94Å
172	M	95.8	Very high	94.9	Very high	43 Å²	43	58.3 Å²	58.3	21%	0.212	31%	0.309	C	S	.	.	H	α-helix	trans	-60.4	-48	171.4	166.7	166.2	69.3	0	0	111.6	E168 V169 Y176 Q216 L223	E168-M172 WeakPolarHBondContact O-CB 3.37Å; E168-M172 PolarHBondContact O-N 2.9Å; V169-M172 HydrophobicContact CG2-CE 4.11Å; V169-M172 WeakPolarHBondContact O-CB 3.48Å; V169-M172 PolarHBondContact O-N 2.93Å; M172-Y176 PolarHBondContact O-N 2.93Å; M172-Q216 PolarHBondContact SD-NE2 3.1Å; M172-L223 HydrophobicContact CE-CD2 3.68Å
173	T	96.3	Very high	95	Very high	67 Å²	67	56.4 Å²	56.4	41%	0.411	30%	0.296	S	S	.	.	H	α-helix	trans	-67.3	-39.4	176.3	-59.4	0	0	0	0	111.6	V169 Y176 I177	V169-T173 PolarHBondContact O-N 3.44Å; V169-T173 PolarHBondContact O-OG1 2.92Å; T173-Y176 PolarHBondContact O-N 3.19Å; T173-I177 HydrophobicContact CG2-CD1 3.78Å; T173-I177 HydrophobicContact CG2-CG1 4.44Å; T173-I177 WeakPolarHBondContact O-CG1 3.26Å; T173-I177 PolarHBondContact O-N 3.36Å
174	G	96.3	Very high	94.8	Very high	16 Å²	16	58.3 Å²	58.3	17%	0.165	30%	0.304	C	S	.	.	H	α-helix	trans	-62.8	-47.1	176.9	0	0	0	0	0	113	Y77 S170 F171 Y176 I177 L178	Y77-G174 WeakPolarHBondContact OH-CA 3.48Å; S170-G174 PolarHBondContact O-N 2.9Å; F171-G174 PolarHBondContact O-N 3.21Å; G174-Y176 VanDerWaalsContact C-N 3.28Å; G174-Y176 PolarHBondContact O-N 2.98Å; G174-I177 PolarHBondContact O-N 3.36Å; G174-L178 WeakPolarHBondContact O-CD1 3.16Å; G174-L178 PolarHBondContact O-N 3.25Å
175	Q	95.8	Very high	94.9	Very high	7 Å²	7	61.4 Å²	61.4	3%	0.033	33%	0.326	C	S	.	.	H	α-helix	trans	-58.9	-41.8	176.1	-170	-175.1	-57.8	0	0	111.3	Y77 F171 Y179 G180	Y77-Q175 HydrophobicContact CD1-CB 4.49Å; Y77-Q175 HydrophobicContact CE1-CB 3.8Å; Y77-Q175 HydrophobicContact CE1-CG 4.43Å; Y77-Q175 PolarHBondContact OH-N 3.27Å; Y77-Q175 VanDerWaalsContact OH-N 3.15Å; F171-Q175 WeakPolarHBondContact O-CB 3.19Å; F171-Q175 PolarHBondContact O-N 2.94Å; Q175-Y179 HydrophobicContact CG-CD2 4.03Å; Q175-Y179 PolarHBondContact O-N 3.34Å; Q175-G180 PolarHBondContact O-N 2.94Å
176	Y	95.4	Very high	94.9	Very high	126 Å²	126	63.8 Å²	63.8	49%	0.494	34%	0.337	S	S	.	.	H	α-helix	trans	-64.8	-39.4	177	177.1	-110.6	0	0	0	112.9	M172 T173 G174 G180 H181	M172-Y176 PolarHBondContact O-N 2.93Å; T173-Y176 PolarHBondContact O-N 3.19Å; G174-Y176 VanDerWaalsContact C-N 3.28Å; G174-Y176 PolarHBondContact O-N 2.98Å; Y176-G180 WeakPolarHBondContact O-CA 3.37Å; Y176-G180 PolarHBondContact O-N 2.97Å; Y176-H181 AromaticContact CD2-CE1 3.34Å; Y176-H181 WeakPolarHBondContact CD2-CE1 3.43Å; Y176-H181 AromaticContact CD2-CG 3.99Å; Y176-H181 AromaticContact CD2-ND1 3.57Å; Y176-H181 AromaticContact CD2-NE2 3.64Å; Y176-H181 AromaticContact CE2-CD2 3.62Å; Y176-H181 AromaticContact CE2-CE1 3.61Å; Y176-H181 AromaticContact CE2-CG 3.98Å; Y176-H181 AromaticContact CE2-ND1 3.98Å; Y176-H181 AromaticContact CE2-NE2 3.37Å; Y176-H181 WeakPolarHBondContact CE2-NE2 3.46Å
177	I	95.7	Very high	94.9	Very high	126 Å²	126	62.5 Å²	62.5	65%	0.646	32%	0.323	S	S	*	.	H	α-helix	trans	-72.1	-38.4	178.1	-69	170.3	0	0	0	111.8	T173 G174	T173-I177 HydrophobicContact CG2-CD1 3.78Å; T173-I177 HydrophobicContact CG2-CG1 4.44Å; T173-I177 WeakPolarHBondContact O-CG1 3.26Å; T173-I177 PolarHBondContact O-N 3.36Å; G174-I177 PolarHBondContact O-N 3.36Å
178	L	94.2	Very high	94.9	Very high	82 Å²	82	67.2 Å²	67.2	43%	0.429	34%	0.341	S	S	.	.	H	α-helix	trans	-77.9	-41.2	-178.5	-90.2	66.7	0	0	0	113.3	Y77 G174	Y77-L178 HydrophobicContact CE2-CD2 4.39Å; G174-L178 WeakPolarHBondContact O-CD1 3.16Å; G174-L178 PolarHBondContact O-N 3.25Å
179	Y	93.5	Very high	95	Very high	20 Å²	20	67 Å²	67	8%	0.078	34%	0.341	C	S	.	.	H	α-helix	trans	-130.9	-3.8	-168.5	-41.7	-76.6	0	0	0	114.5	F70 I72 L74 Y77 Q175	F70-Y179 HydrophobicContact CD1-CE1 4.48Å; I72-Y179 PolarHBondContact O-OH 3.49Å; L74-Y179 HydrophobicContact CD1-CD1 3.76Å; L74-Y179 HydrophobicContact CD1-CD2 4.34Å; L74-Y179 HydrophobicContact CD1-CE1 3.52Å; L74-Y179 HydrophobicContact CD1-CE2 4.15Å; L74-Y179 HydrophobicContact CD1-CG 4.16Å; L74-Y179 HydrophobicContact CG-CD2 4.31Å; L74-Y179 HydrophobicContact CG-CE1 4.44Å; L74-Y179 HydrophobicContact CG-CE2 4.23Å; L74-Y179 HydrophobicContact CG-CG 4.46Å; Y77-Y179 HydrophobicContact CD2-CE2 4.39Å; Y77-Y179 HydrophobicContact CG-CE2 4.39Å; Q175-Y179 HydrophobicContact CG-CD2 4.03Å; Q175-Y179 PolarHBondContact O-N 3.34Å
180	G	93.3	Very high	95	Very high	23 Å²	23	72 Å²	72	24%	0.237	36%	0.36	C	S	.	.			trans	67	-157.3	-177	0	0	0	0	0	114.5	Q175 Y176 M212	Q175-G180 PolarHBondContact O-N 2.94Å; Y176-G180 WeakPolarHBondContact O-CA 3.37Å; Y176-G180 PolarHBondContact O-N 2.97Å; G180-M212 WeakPolarHBondContact O-CE 3.49Å
181	H	89.9	Confident	94.9	Very high	101 Å²	101	72.9 Å²	72.9	47%	0.468	35%	0.353	S	S	.	.	S	Bend	trans	-97.6	-11.9	175.8	-66.8	-40.2	0	0	0	114	Y176 M213	Y176-H181 AromaticContact CD2-CE1 3.34Å; Y176-H181 WeakPolarHBondContact CD2-CE1 3.43Å; Y176-H181 AromaticContact CD2-CG 3.99Å; Y176-H181 AromaticContact CD2-ND1 3.57Å; Y176-H181 AromaticContact CD2-NE2 3.64Å; Y176-H181 AromaticContact CE2-CD2 3.62Å; Y176-H181 AromaticContact CE2-CE1 3.61Å; Y176-H181 AromaticContact CE2-CG 3.98Å; Y176-H181 AromaticContact CE2-ND1 3.98Å; Y176-H181 AromaticContact CE2-NE2 3.37Å; Y176-H181 WeakPolarHBondContact CE2-NE2 3.46Å; H181-M213 HydrophobicContact CB-SD 4.39Å
182	R	92.8	Very high	94.8	Very high	161 Å²	161	79 Å²	79	61%	0.608	38%	0.382	S	S	*	.	S	Bend	trans	-145.4	124.4	-173.8	-58.6	-68.2	-69.3	-175.5	-3.1	107.7	T209	R182-T209 HydrophobicContact CB-CG2 4.48Å
183	L	93.4	Very high	94.8	Very high	27 Å²	27	79.1 Å²	79.1	14%	0.141	39%	0.386	C	S	.	.			trans	-80.1	123.1	173.1	-169.1	56.7	0	0	0	108.8	F70 V202 P205 K208 T209 M212	F70-L183 HydrophobicContact CE1-CD1 3.84Å; F70-L183 HydrophobicContact CE1-CD2 4.14Å; F70-L183 HydrophobicContact CZ-CD1 4.01Å; F70-L183 HydrophobicContact CZ-CD2 4.24Å; L183-V202 HydrophobicContact CD2-CG1 3.79Å; L183-V202 HydrophobicContact CG-CG1 4.13Å; L183-P205 HydrophobicContact CG-CB 4.42Å; L183-K208 HydrophobicContact CD2-CB 4.05Å; L183-K208 HydrophobicContact CD2-CD 4.44Å; L183-T209 WeakPolarHBondContact CB-OG1 3.41Å; L183-T209 PolarHBondContact N-OG1 2.94Å; L183-M212 HydrophobicContact CB-SD 4.32Å
184	N	92.1	Very high	94.9	Very high	116 Å²	116	76.4 Å²	76.4	62%	0.62	37%	0.37	S	S	*	.			trans	-72.4	148.2	178.9	-69.7	-37.5	0	0	0	110.7	L186	N184-L186 VanDerWaalsContact C-N 3.28Å
185	T	93.6	Very high	94.8	Very high	91 Å²	91	79.6 Å²	79.6	56%	0.558	39%	0.387	S	S	*	.	S	Bend	trans	-66.9	-31.1	173.3	46.5	0	0	0	0	112.8	F201 V202 P205	T185-F201 WeakPolarHBondContact O-CA 3.34Å; T185-V202 PolarHBondContact O-N 2.7Å; T185-P205 HydrophobicContact CG2-CB 4.44Å; T185-P205 HydrophobicContact CG2-CG 3.55Å
186	L	95.6	Very high	94.7	Very high	60 Å²	60	85.2 Å²	85.2	31%	0.314	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.7	-175.6	179.3	66.8	0	0	0	110.3	N184 D199 F201	N184-L186 VanDerWaalsContact C-N 3.28Å; L186-D199 HydrophobicContact CD1-CB 3.63Å; L186-F201 HydrophobicContact CD1-CD1 4.32Å; L186-F201 HydrophobicContact CD1-CE1 3.98Å; L186-F201 HydrophobicContact CD1-CZ 4.28Å
187	Y	95.7	Very high	94.7	Very high	59 Å²	59	82.7 Å²	82.7	23%	0.231	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	129.3	168.6	-177.6	-95.2	0	0	0	108.8	Q68 A69 C189 C200	Q68-Y187 WeakPolarHBondContact CB-OH 3.34Å; Q68-Y187 VanDerWaalsContact CG-OH 3.26Å; Q68-Y187 WeakPolarHBondContact CG-OH 3.35Å; Q68-Y187 PolarHBondContact O-OH 2.99Å; A69-Y187 HydrophobicContact CB-CD1 3.98Å; A69-Y187 HydrophobicContact CB-CD2 3.75Å; A69-Y187 HydrophobicContact CB-CE1 3.91Å; A69-Y187 HydrophobicContact CB-CE2 3.69Å; A69-Y187 HydrophobicContact CB-CG 3.89Å; Y187-C189 HydrophobicContact CD1-CB 4.01Å; Y187-C189 HydrophobicContact CE1-CB 3.8Å; Y187-C200 PolarHBondContact N-O 3.15Å; Y187-C200 PolarHBondContact O-N 2.9Å
188	K	96.8	Very high	94.8	Very high	127 Å²	127	77.1 Å²	77.1	55%	0.552	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	124.5	175.6	-75.5	-176.6	179.2	-73	0	109.1	V197 D199	K188-V197 HydrophobicContact CB-CG1 4.02Å; K188-V197 HydrophobicContact CG-CG1 4.42Å; K188-D199 WeakPolarHBondContact CE-OD1 3.47Å; K188-D199 WeakPolarHBondContact CG-OD1 3.18Å; K188-D199 IonicContact NZ-OD1 4Å; K188-D199 PolarHBondContact NZ-OD1 3.38Å; K188-D199 IonicContact NZ-OD2 3.08Å
189	C	97.2	Very high	94.9	Very high	1 Å²	1	75.7 Å²	75.7	1%	0.007	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.4	-171.6	178.7	0	0	0	0	111.3	C65 Y187 V197 V198	C65-C189 WeakPolarHBondContact CA-SG 3.45Å; C65-C189 HydrophobicContact CB-CB 3.67Å; C65-C189 WeakPolarHBondContact CB-SG 3.27Å; C65-C189 WeakPolarHBondContact SG-CB 3.5Å; C65-C189 CovalentContact SG-SG 2.03Å; C65-C189 PolarHBondContact SG-SG 2.98Å; Y187-C189 HydrophobicContact CD1-CB 4.01Å; Y187-C189 HydrophobicContact CE1-CB 3.8Å; C189-V197 CarbonylContact O-C 3.55Å; C189-V197 VanDerWaalsContact O-CA 3.31Å; C189-V197 WeakPolarHBondContact O-CA 3.42Å; C189-V198 HydrophobicContact CB-CG2 3.84Å; C189-V198 PolarHBondContact N-O 3.18Å; C189-V198 PolarHBondContact O-N 2.75Å
190	E	96.6	Very high	95.1	Very high	156 Å²	156	74.8 Å²	74.8	73%	0.729	38%	0.376	S	S	*	.			trans	-135.2	62.2	-178.1	-165.4	-179.7	172.7	0	0	108.8	V197	E190-V197 HydrophobicContact CB-CG2 4.12Å; E190-V197 HydrophobicContact CG-CG2 3.88Å
191	R	95.6	Very high	95.3	Very high	90 Å²	90	78.6 Å²	78.6	34%	0.34	39%	0.387	S	S	.	.			trans	-133.4	131.8	-173.2	-176.3	174.8	-178.6	-165.1	6.4	110.9	V64 D67 C194	V64-R191 HydrophobicContact CB-CG 4.28Å; V64-R191 HydrophobicContact CG2-CB 4.43Å; V64-R191 HydrophobicContact CG2-CG 4.26Å; V64-R191 PolarHBondContact O-NH1 2.67Å; D67-R191 IonicContact OD2-CZ 3.88Å; D67-R191 VanDerWaalsContact OD2-CZ 3.27Å; D67-R191 IonicContact OD2-NH1 2.71Å; D67-R191 PolarHBondContact OD2-NH1 2.91Å; D67-R191 IonicContact OD2-NH2 3.67Å; D67-R191 PolarHBondContact OD2-NH2 2.92Å; R191-C194 WeakPolarHBondContact O-CB 3.31Å; R191-C194 PolarHBondContact O-N 3Å; R191-C194 PolarHBondContact O-SG 3.38Å
192	E	95.4	Very high	95.5	Very high	160 Å²	160	74.6 Å²	74.6	75%	0.748	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	130.4	175.1	-67.6	-62.9	162.8	0	0	111.5
193	P	96.3	Very high	95.5	Very high	46 Å²	46	67.5 Å²	67.5	30%	0.299	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	cis	-99	23.4	16.4	40.2	-38.4	0	0	0	115.1	Q58	Q58-P193 VanDerWaalsContact CG-O 3.26Å; Q58-P193 WeakPolarHBondContact CG-O 3.42Å; Q58-P193 PolarHBondContact NE2-O 3.49Å
194	C	96.8	Very high	95.5	Very high	10 Å²	10	71.1 Å²	71.1	7%	0.068	36%	0.356	C	S	.	.			trans	-67.8	133	179.8	-57.7	0	0	0	0	111.7	C61 C65 R191 N196 V198	C61-C194 WeakPolarHBondContact CA-SG 3.29Å; C61-C194 HydrophobicContact CB-CB 4.06Å; C61-C194 WeakPolarHBondContact CB-SG 3.41Å; C61-C194 WeakPolarHBondContact SG-CB 3.49Å; C61-C194 CovalentContact SG-SG 2.03Å; C61-C194 PolarHBondContact SG-SG 3.47Å; C65-C194 PolarHBondContact SG-SG 3.03Å; R191-C194 WeakPolarHBondContact O-CB 3.31Å; R191-C194 PolarHBondContact O-N 3Å; R191-C194 PolarHBondContact O-SG 3.38Å; C194-N196 VanDerWaalsContact C-N 3.33Å; C194-N196 PolarHBondContact O-N 3.25Å; C194-V198 HydrophobicContact CB-CG1 4.38Å; C194-V198 HydrophobicContact CB-CG2 4.41Å
195	P	94.4	Very high	95.6	Very high	82 Å²	82	66.3 Å²	66.3	53%	0.532	33%	0.331	S	S	.	.	S	Bend	trans	-77	-15.9	-167.9	31.1	-37.4	0	0	0	114.8
196	N	94.3	Very high	95.6	Very high	125 Å²	125	66.6 Å²	66.6	67%	0.668	33%	0.333	S	S	*	.	S	Bend	trans	-159.8	-178.2	-179.9	-82.3	-78.2	0	0	0	107.5	C194 V198	C194-N196 VanDerWaalsContact C-N 3.33Å; C194-N196 PolarHBondContact O-N 3.25Å; N196-V198 PolarHBondContact O-N 3.32Å; N196-V198 VanDerWaalsContact O-N 3.11Å
197	V	96.3	Very high	95.5	Very high	73 Å²	73	67 Å²	67	44%	0.442	33%	0.333	S	S	.	.			trans	-58.9	113.4	164.5	-173.9	0	0	0	0	109.6	K188 C189 E190	K188-V197 HydrophobicContact CB-CG1 4.02Å; K188-V197 HydrophobicContact CG-CG1 4.42Å; C189-V197 CarbonylContact O-C 3.55Å; C189-V197 VanDerWaalsContact O-CA 3.31Å; C189-V197 WeakPolarHBondContact O-CA 3.42Å; E190-V197 HydrophobicContact CB-CG2 4.12Å; E190-V197 HydrophobicContact CG-CG2 3.88Å
198	V	97.3	Very high	95.4	Very high	10 Å²	10	64.5 Å²	64.5	6%	0.061	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	144.8	176.1	-61.4	0	0	0	0	111.6	T56 C189 C194 N196	T56-V198 HydrophobicContact CG2-CG1 4.25Å; C189-V198 HydrophobicContact CB-CG2 3.84Å; C189-V198 PolarHBondContact N-O 3.18Å; C189-V198 PolarHBondContact O-N 2.75Å; C194-V198 HydrophobicContact CB-CG1 4.38Å; C194-V198 HydrophobicContact CB-CG2 4.41Å; N196-V198 PolarHBondContact O-N 3.32Å; N196-V198 VanDerWaalsContact O-N 3.11Å
199	D	97.3	Very high	95.3	Very high	52 Å²	52	58.5 Å²	58.5	28%	0.278	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	118	172.7	-82.1	-28	0	0	0	109.7	N55 L186 K188	N55-D199 PolarHBondContact N-O 3.08Å; L186-D199 HydrophobicContact CD1-CB 3.63Å; K188-D199 WeakPolarHBondContact CE-OD1 3.47Å; K188-D199 WeakPolarHBondContact CG-OD1 3.18Å; K188-D199 IonicContact NZ-OD1 4Å; K188-D199 PolarHBondContact NZ-OD1 3.38Å; K188-D199 IonicContact NZ-OD2 3.08Å
200	C	96.9	Very high	95.2	Very high	0 Å²	0	63 Å²	63	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	134.1	177.5	-58.6	0	0	0	0	111.7	F52 I53 C54 Y187	F52-C200 HydrophobicContact CE1-CB 3.95Å; F52-C200 HydrophobicContact CE2-CB 4.11Å; F52-C200 HydrophobicContact CZ-CB 3.55Å; I53-C200 CarbonylContact O-C 3.53Å; I53-C200 WeakPolarHBondContact O-CA 3.35Å; C54-C200 HydrophobicContact CB-CB 4.07Å; C54-C200 WeakPolarHBondContact CB-SG 3.37Å; C54-C200 WeakPolarHBondContact SG-CB 3.26Å; C54-C200 CovalentContact SG-SG 2.04Å; C54-C200 PolarHBondContact SG-SG 3.49Å; Y187-C200 PolarHBondContact N-O 3.15Å; Y187-C200 PolarHBondContact O-N 2.9Å
201	F	96.4	Very high	95	Very high	104 Å²	104	57.6 Å²	57.6	46%	0.456	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	132.4	-176.8	-59.8	-80.7	0	0	0	111	F52 I53 T185 L186	F52-F201 WeakPolarHBondContact CA-O 3.5Å; I53-F201 PolarHBondContact N-O 3.16Å; I53-F201 PolarHBondContact O-N 2.88Å; T185-F201 WeakPolarHBondContact O-CA 3.34Å; L186-F201 HydrophobicContact CD1-CD1 4.32Å; L186-F201 HydrophobicContact CD1-CE1 3.98Å; L186-F201 HydrophobicContact CD1-CZ 4.28Å
202	V	94.8	Very high	94.9	Very high	16 Å²	16	53.4 Å²	53.4	10%	0.097	28%	0.283	C	S	.	.	P	Polyproline II helix	trans	-90.3	127.9	-179.8	177.8	0	0	0	0	109.8	F52 F70 L183 T185 P205	F52-V202 HydrophobicContact CD2-CG2 4.41Å; F52-V202 HydrophobicContact CE2-CG2 4.23Å; F70-V202 HydrophobicContact CE2-CG1 4.32Å; F70-V202 HydrophobicContact CE2-CG2 4.17Å; F70-V202 HydrophobicContact CZ-CG1 3.78Å; F70-V202 HydrophobicContact CZ-CG2 3.99Å; L183-V202 HydrophobicContact CD2-CG1 3.79Å; L183-V202 HydrophobicContact CG-CG1 4.13Å; T185-V202 PolarHBondContact O-N 2.7Å; V202-P205 HydrophobicContact CB-CB 4.4Å; V202-P205 HydrophobicContact CG1-CB 4.24Å; V202-P205 WeakPolarHBondContact O-CD 3.31Å
203	S	93.1	Very high	94.8	Very high	12 Å²	12	50.1 Å²	50.1	8%	0.084	27%	0.269	C	S	.	.	S	Bend	trans	-59.9	134.9	171.5	164.4	0	0	0	0	111.9	D47 K208	D47-S203 PolarHBondContact OD1-OG 3.42Å; S203-K208 WeakPolarHBondContact O-CD 3.39Å; S203-K208 PolarHBondContact O-NZ 2.9Å; S203-K208 PolarHBondContact OG-NZ 3.26Å
204	R	93.3	Very high	94.7	Very high	103 Å²	103	52.3 Å²	52.3	39%	0.389	27%	0.274	S	S	.	.	S	Bend	trans	47.8	47.6	170.1	-61.9	166.7	-175.5	-112.9	18.9	115.4	D47 T206 E207 K208	D47-R204 IonicContact OD1-NE 2.63Å; D47-R204 WeakPolarHBondContact OD2-CD 3.47Å; D47-R204 IonicContact OD2-CZ 2.67Å; D47-R204 VanDerWaalsContact OD2-CZ 3.31Å; D47-R204 IonicContact OD2-NE 2.78Å; D47-R204 PolarHBondContact OD2-NE 2.68Å; D47-R204 IonicContact OD2-NH2 3.09Å; D47-R204 PolarHBondContact OD2-NH2 3.44Å; D47-R204 VanDerWaalsContact OD2-NH2 3.09Å; R204-T206 VanDerWaalsContact C-N 3.32Å; R204-T206 PolarHBondContact O-N 3.05Å; R204-E207 HydrophobicContact CB-CB 4.16Å; R204-E207 VanDerWaalsContact CD-OE2 3.28Å; R204-E207 WeakPolarHBondContact CD-OE2 3.32Å; R204-E207 IonicContact CZ-OE2 3.31Å; R204-E207 IonicContact NE-OE2 3.82Å; R204-E207 IonicContact NH1-OE2 2.67Å; R204-E207 PolarHBondContact NH1-OE2 3.41Å; R204-E207 VanDerWaalsContact NH1-OE2 3.08Å; R204-E207 PolarHBondContact O-N 2.9Å; R204-K208 HydrophobicContact CB-CD 4.44Å; R204-K208 HydrophobicContact CB-CG 4.46Å; R204-K208 WeakPolarHBondContact O-CB 3.48Å; R204-K208 WeakPolarHBondContact O-CG 3.18Å; R204-K208 PolarHBondContact O-N 2.8Å
205	P	94.3	Very high	94.4	Very high	16 Å²	16	51.9 Å²	51.9	10%	0.104	27%	0.271	C	S	.	.	H	α-helix	trans	-70.6	-30.2	-168.4	29.8	-32.1	0	0	0	112.2	L183 T185 V202 T209	L183-P205 HydrophobicContact CG-CB 4.42Å; T185-P205 HydrophobicContact CG2-CB 4.44Å; T185-P205 HydrophobicContact CG2-CG 3.55Å; V202-P205 HydrophobicContact CB-CB 4.4Å; V202-P205 HydrophobicContact CG1-CB 4.24Å; V202-P205 WeakPolarHBondContact O-CD 3.31Å; P205-T209 WeakPolarHBondContact O-CB 3.26Å; P205-T209 PolarHBondContact O-N 2.66Å; P205-T209 PolarHBondContact O-OG1 2.71Å
206	T	94.1	Very high	94.4	Very high	96 Å²	96	49 Å²	49	59%	0.589	25%	0.25	S	S	*	.	H	α-helix	trans	-67.7	-47.4	173.9	43.4	0	0	0	0	112.1	R204 T209 V210	R204-T206 VanDerWaalsContact C-N 3.32Å; R204-T206 PolarHBondContact O-N 3.05Å; T206-T209 WeakPolarHBondContact O-CB 3.37Å; T206-T209 PolarHBondContact O-N 3.31Å; T206-V210 WeakPolarHBondContact O-CG2 3.47Å; T206-V210 PolarHBondContact O-N 3.36Å
207	E	93.3	Very high	94.4	Very high	69 Å²	69	45.2 Å²	45.2	32%	0.322	24%	0.237	S	C	.	.	H	α-helix	trans	-63.8	-52	177.8	-173.2	171.9	-152	0	0	110.7	V44 R204 T209 V210 F211	V44-E207 HydrophobicContact CG1-CB 4.48Å; V44-E207 HydrophobicContact CG1-CG 3.8Å; V44-E207 HydrophobicContact CG2-CG 4.16Å; R204-E207 HydrophobicContact CB-CB 4.16Å; R204-E207 VanDerWaalsContact CD-OE2 3.28Å; R204-E207 WeakPolarHBondContact CD-OE2 3.32Å; R204-E207 IonicContact CZ-OE2 3.31Å; R204-E207 IonicContact NE-OE2 3.82Å; R204-E207 IonicContact NH1-OE2 2.67Å; R204-E207 PolarHBondContact NH1-OE2 3.41Å; R204-E207 VanDerWaalsContact NH1-OE2 3.08Å; R204-E207 PolarHBondContact O-N 2.9Å; E207-T209 PolarHBondContact O-N 2.94Å; E207-V210 WeakPolarHBondContact O-CA 3.4Å; E207-V210 WeakPolarHBondContact O-CB 3.3Å; E207-V210 PolarHBondContact O-N 3.02Å; E207-F211 HydrophobicContact CG-CD2 4.22Å; E207-F211 HydrophobicContact CG-CE2 3.98Å; E207-F211 WeakPolarHBondContact O-CD2 3.4Å; E207-F211 PolarHBondContact O-N 2.96Å; E207-F211 VanDerWaalsContact O-N 3.09Å
208	K	93.6	Very high	94.2	Very high	6 Å²	6	42.2 Å²	42.2	3%	0.026	22%	0.218	C	C	.	.	H	α-helix	trans	-56	-38.5	175.2	-68.9	174.2	-178	153.3	0	111.7	V44 W45 D47 L183 S203 R204 F211 M212	V44-K208 HydrophobicContact CG1-CG 3.73Å; V44-K208 WeakPolarHBondContact O-CE 3.21Å; V44-K208 PolarHBondContact O-NZ 2.91Å; W45-K208 HydrophobicContact CD2-CD 4.5Å; W45-K208 HydrophobicContact CD2-CG 4.25Å; W45-K208 HydrophobicContact CE3-CG 4.41Å; W45-K208 HydrophobicContact CH2-CB 3.75Å; W45-K208 HydrophobicContact CH2-CG 3.73Å; W45-K208 HydrophobicContact CZ2-CB 3.61Å; W45-K208 HydrophobicContact CZ2-CD 4.13Å; W45-K208 HydrophobicContact CZ2-CG 3.52Å; W45-K208 HydrophobicContact CZ3-CG 4.17Å; D47-K208 IonicContact OD1-NZ 3.14Å; D47-K208 PolarHBondContact OD1-NZ 3.42Å; L183-K208 HydrophobicContact CD2-CB 4.05Å; L183-K208 HydrophobicContact CD2-CD 4.44Å; S203-K208 WeakPolarHBondContact O-CD 3.39Å; S203-K208 PolarHBondContact O-NZ 2.9Å; S203-K208 PolarHBondContact OG-NZ 3.26Å; R204-K208 HydrophobicContact CB-CD 4.44Å; R204-K208 HydrophobicContact CB-CG 4.46Å; R204-K208 WeakPolarHBondContact O-CB 3.48Å; R204-K208 WeakPolarHBondContact O-CG 3.18Å; R204-K208 PolarHBondContact O-N 2.8Å; K208-F211 PolarHBondContact O-N 3.32Å; K208-M212 VanDerWaalsContact O-CG 3.29Å; K208-M212 WeakPolarHBondContact O-CG 3.43Å; K208-M212 PolarHBondContact O-N 2.95Å
209	T	94.5	Very high	94	Very high	2 Å²	2	41.8 Å²	41.8	1%	0.012	22%	0.215	C	C	.	.	H	α-helix	trans	-64.6	-37.8	172.6	-67.1	0	0	0	0	113.7	R182 L183 P205 T206 E207 M212 M213	R182-T209 HydrophobicContact CB-CG2 4.48Å; L183-T209 WeakPolarHBondContact CB-OG1 3.41Å; L183-T209 PolarHBondContact N-OG1 2.94Å; P205-T209 WeakPolarHBondContact O-CB 3.26Å; P205-T209 PolarHBondContact O-N 2.66Å; P205-T209 PolarHBondContact O-OG1 2.71Å; T206-T209 WeakPolarHBondContact O-CB 3.37Å; T206-T209 PolarHBondContact O-N 3.31Å; E207-T209 PolarHBondContact O-N 2.94Å; T209-M212 PolarHBondContact O-N 3.41Å; T209-M213 HydrophobicContact CG2-CG 4.4Å; T209-M213 WeakPolarHBondContact O-CB 3.18Å; T209-M213 VanDerWaalsContact O-CG 3.31Å; T209-M213 WeakPolarHBondContact O-CG 3.02Å; T209-M213 PolarHBondContact O-N 3.08Å
210	V	94.1	Very high	93.9	Very high	95 Å²	95	42 Å²	42	58%	0.576	22%	0.221	S	C	*	.	H	α-helix	trans	-63.7	-47	175.5	169.7	0	0	0	0	110.1	T206 E207 M212 M213 F214	T206-V210 WeakPolarHBondContact O-CG2 3.47Å; T206-V210 PolarHBondContact O-N 3.36Å; E207-V210 WeakPolarHBondContact O-CA 3.4Å; E207-V210 WeakPolarHBondContact O-CB 3.3Å; E207-V210 PolarHBondContact O-N 3.02Å; V210-M212 PolarHBondContact O-N 3.25Å; V210-M213 PolarHBondContact O-N 2.95Å; V210-F214 WeakPolarHBondContact O-CB 3.47Å; V210-F214 PolarHBondContact O-N 3.34Å
211	F	93.3	Very high	93.7	Very high	43 Å²	43	46 Å²	46	19%	0.189	24%	0.241	C	C	.	.	H	α-helix	trans	-62	-40.7	175	-76.6	-80.7	0	0	0	112.6	V36 A40 V44 W45 W78 E207 K208 F214 M215	V36-F211 HydrophobicContact CG1-CD1 4.06Å; V36-F211 HydrophobicContact CG1-CE1 4.42Å; A40-F211 HydrophobicContact CB-CD1 3.95Å; A40-F211 HydrophobicContact CB-CE1 4.05Å; A40-F211 HydrophobicContact CB-CG 4.45Å; V44-F211 HydrophobicContact CG1-CD2 4.31Å; V44-F211 HydrophobicContact CG1-CE2 4.43Å; V44-F211 HydrophobicContact CG2-CD2 4.39Å; V44-F211 HydrophobicContact CG2-CE2 3.76Å; V44-F211 HydrophobicContact CG2-CZ 4.26Å; W45-F211 HydrophobicContact CH2-CB 3.79Å; W45-F211 HydrophobicContact CZ3-CB 3.82Å; W45-F211 HydrophobicContact CZ3-CD2 4.21Å; W45-F211 HydrophobicContact CZ3-CG 4.08Å; W78-F211 HydrophobicContact CH2-CB 4.21Å; E207-F211 HydrophobicContact CG-CD2 4.22Å; E207-F211 HydrophobicContact CG-CE2 3.98Å; E207-F211 WeakPolarHBondContact O-CD2 3.4Å; E207-F211 PolarHBondContact O-N 2.96Å; E207-F211 VanDerWaalsContact O-N 3.09Å; K208-F211 PolarHBondContact O-N 3.32Å; F211-F214 PolarHBondContact O-N 3.24Å; F211-M215 WeakPolarHBondContact O-CB 3.26Å; F211-M215 WeakPolarHBondContact O-CG 3.2Å; F211-M215 PolarHBondContact O-N 3.5Å
212	M	93.4	Very high	93.4	Very high	2 Å²	2	41.2 Å²	41.2	1%	0.01	22%	0.221	C	C	.	.	H	α-helix	trans	-56.8	-50.3	172.5	-75.2	172.2	74.5	0	0	112.6	L74 W78 G180 L183 K208 T209 V210 F214 Q216	L74-M212 HydrophobicContact CD2-CE 4.28Å; L74-M212 HydrophobicContact CD2-CG 3.53Å; L74-M212 HydrophobicContact CD2-SD 3.55Å; L74-M212 VanDerWaalsContact CD2-SD 3.55Å; W78-M212 HydrophobicContact CH2-CG 4.25Å; W78-M212 HydrophobicContact CZ2-CB 4.4Å; W78-M212 HydrophobicContact CZ2-CG 3.91Å; G180-M212 WeakPolarHBondContact O-CE 3.49Å; L183-M212 HydrophobicContact CB-SD 4.32Å; K208-M212 VanDerWaalsContact O-CG 3.29Å; K208-M212 WeakPolarHBondContact O-CG 3.43Å; K208-M212 PolarHBondContact O-N 2.95Å; T209-M212 PolarHBondContact O-N 3.41Å; V210-M212 PolarHBondContact O-N 3.25Å; M212-F214 VanDerWaalsContact C-N 3.29Å; M212-F214 PolarHBondContact O-N 2.95Å; M212-Q216 WeakPolarHBondContact O-CB 3.45Å; M212-Q216 PolarHBondContact O-N 3.48Å
213	M	93.6	Very high	93.3	Very high	91 Å²	91	41.5 Å²	41.5	45%	0.448	22%	0.221	S	C	.	.	H	α-helix	trans	-65.4	-34.3	-179.7	-71.3	-66.2	-67	0	0	111.8	H181 T209 V210 A217	H181-M213 HydrophobicContact CB-SD 4.39Å; T209-M213 HydrophobicContact CG2-CG 4.4Å; T209-M213 WeakPolarHBondContact O-CB 3.18Å; T209-M213 VanDerWaalsContact O-CG 3.31Å; T209-M213 WeakPolarHBondContact O-CG 3.02Å; T209-M213 PolarHBondContact O-N 3.08Å; V210-M213 PolarHBondContact O-N 2.95Å; M213-A217 WeakPolarHBondContact O-CB 3.37Å; M213-A217 PolarHBondContact O-N 3.06Å
214	F	93.1	Very high	93.3	Very high	91 Å²	91	46.9 Å²	46.9	40%	0.399	24%	0.243	S	C	.	.	H	α-helix	trans	-71.4	-49.4	178.8	-168.5	-133.5	0	0	0	112.3	F32 V36 V210 F211 M212 Q216 A217 I218	F32-F214 AromaticContact CE1-CE1 3.46Å; F32-F214 HydrophobicContact CE1-CE1 3.46Å; F32-F214 VanDerWaalsContact CE1-CE1 3.46Å; F32-F214 HydrophobicContact CE1-CE2 4.44Å; F32-F214 AromaticContact CE1-CZ 3.4Å; F32-F214 HydrophobicContact CE1-CZ 3.4Å; F32-F214 VanDerWaalsContact CE1-CZ 3.4Å; F32-F214 AromaticContact CZ-CE1 3.69Å; F32-F214 HydrophobicContact CZ-CE1 3.69Å; F32-F214 AromaticContact CZ-CZ 3.54Å; F32-F214 HydrophobicContact CZ-CZ 3.54Å; V36-F214 HydrophobicContact CG1-CD1 4.39Å; V36-F214 HydrophobicContact CG2-CD1 4.16Å; V36-F214 HydrophobicContact CG2-CE1 3.76Å; V210-F214 WeakPolarHBondContact O-CB 3.47Å; V210-F214 PolarHBondContact O-N 3.34Å; F211-F214 PolarHBondContact O-N 3.24Å; M212-F214 VanDerWaalsContact C-N 3.29Å; M212-F214 PolarHBondContact O-N 2.95Å; F214-Q216 PolarHBondContact O-N 3.35Å; F214-A217 PolarHBondContact O-N 2.99Å; F214-A217 VanDerWaalsContact O-N 3.13Å; F214-I218 HydrophobicContact CD1-CD1 4.09Å; F214-I218 HydrophobicContact CD2-CD1 4.45Å; F214-I218 HydrophobicContact CE1-CD1 4.17Å; F214-I218 HydrophobicContact CE2-CD1 4.49Å; F214-I218 HydrophobicContact CG-CD1 4.25Å; F214-I218 HydrophobicContact CZ-CD1 4.37Å; F214-I218 WeakPolarHBondContact O-CD1 3.42Å; F214-I218 VanDerWaalsContact O-CG1 3.3Å; F214-I218 WeakPolarHBondContact O-CG1 3.37Å; F214-I218 PolarHBondContact O-N 3.13Å
215	M	92	Very high	93.1	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-58.4	-38.4	173.1	-72.3	-70.4	-89.1	0	0	111.6	R33 V36 L37 W78 F211 A219	R33-M215 HydrophobicContact CG-CE 3.83Å; R33-M215 HydrophobicContact CG-SD 4.04Å; V36-M215 HydrophobicContact CB-SD 4.2Å; V36-M215 HydrophobicContact CG1-CG 4.15Å; V36-M215 HydrophobicContact CG1-SD 3.69Å; L37-M215 HydrophobicContact CD1-CE 4.08Å; L37-M215 HydrophobicContact CD2-CE 3.91Å; L37-M215 HydrophobicContact CG-CE 3.78Å; W78-M215 HydrophobicContact CB-CE 3.73Å; W78-M215 HydrophobicContact CD2-CE 3.71Å; W78-M215 HydrophobicContact CD2-CG 4.19Å; W78-M215 HydrophobicContact CE3-CE 4.01Å; W78-M215 HydrophobicContact CE3-CG 4.33Å; W78-M215 HydrophobicContact CG-CE 3.58Å; W78-M215 HydrophobicContact CH2-CG 4.35Å; W78-M215 HydrophobicContact CZ2-CB 4.23Å; W78-M215 HydrophobicContact CZ2-CG 4.22Å; W78-M215 HydrophobicContact CZ3-CG 4.4Å; F211-M215 WeakPolarHBondContact O-CB 3.26Å; F211-M215 WeakPolarHBondContact O-CG 3.2Å; F211-M215 PolarHBondContact O-N 3.5Å; M215-A219 WeakPolarHBondContact O-CB 2.99Å; M215-A219 PolarHBondContact O-N 2.91Å
216	Q	93.4	Very high	92.8	Very high	22 Å²	22	42.6 Å²	42.6	10%	0.103	23%	0.227	C	C	.	.	H	α-helix	trans	-66.6	-41.5	174.8	-176.3	57.4	85.5	0	0	112.5	M172 M212 F214 A219 C220	M172-Q216 PolarHBondContact SD-NE2 3.1Å; M212-Q216 WeakPolarHBondContact O-CB 3.45Å; M212-Q216 PolarHBondContact O-N 3.48Å; F214-Q216 PolarHBondContact O-N 3.35Å; Q216-A219 PolarHBondContact O-N 3.24Å; Q216-C220 PolarHBondContact NE2-SG 3.31Å; Q216-C220 PolarHBondContact O-N 3.04Å; Q216-C220 PolarHBondContact O-SG 3.47Å
217	A	94.4	Very high	92.6	Very high	46 Å²	46	42 Å²	42	38%	0.38	22%	0.22	S	C	.	.	H	α-helix	trans	-63.5	-42.4	176.2	0	0	0	0	0	112	M213 F214 A219 C220 I221	M213-A217 WeakPolarHBondContact O-CB 3.37Å; M213-A217 PolarHBondContact O-N 3.06Å; F214-A217 PolarHBondContact O-N 2.99Å; F214-A217 VanDerWaalsContact O-N 3.13Å; A217-A219 VanDerWaalsContact C-N 3.35Å; A217-A219 PolarHBondContact O-N 3.4Å; A217-C220 WeakPolarHBondContact O-CB 2.94Å; A217-C220 PolarHBondContact O-N 2.91Å; A217-I221 VanDerWaalsContact O-CG1 3.31Å; A217-I221 WeakPolarHBondContact O-CG1 3.31Å; A217-I221 PolarHBondContact O-N 3.01Å
218	I	92.6	Very high	92.3	Very high	9 Å²	9	42.7 Å²	42.7	5%	0.046	23%	0.226	C	C	.	.	H	α-helix	trans	-60.8	-43.7	175.8	-64.8	156.2	0	0	0	110.7	L29 F32 F214 I221 S222	L29-I218 HydrophobicContact CB-CG2 4.46Å; L29-I218 HydrophobicContact CD2-CG2 4.24Å; F32-I218 HydrophobicContact CD1-CD1 3.79Å; F32-I218 HydrophobicContact CD1-CG1 4.42Å; F32-I218 HydrophobicContact CE1-CD1 3.74Å; F214-I218 HydrophobicContact CD1-CD1 4.09Å; F214-I218 HydrophobicContact CD2-CD1 4.45Å; F214-I218 HydrophobicContact CE1-CD1 4.17Å; F214-I218 HydrophobicContact CE2-CD1 4.49Å; F214-I218 HydrophobicContact CG-CD1 4.25Å; F214-I218 HydrophobicContact CZ-CD1 4.37Å; F214-I218 WeakPolarHBondContact O-CD1 3.42Å; F214-I218 VanDerWaalsContact O-CG1 3.3Å; F214-I218 WeakPolarHBondContact O-CG1 3.37Å; F214-I218 PolarHBondContact O-N 3.13Å; I218-I221 PolarHBondContact O-N 2.86Å; I218-S222 PolarHBondContact O-N 3.38Å; I218-S222 PolarHBondContact O-OG 2.93Å
219	A	92.8	Very high	92	Very high	1 Å²	1	42.9 Å²	42.9	1%	0.008	23%	0.226	C	C	.	.	H	α-helix	trans	-65.3	-36.1	175.8	0	0	0	0	0	113.1	E168 M215 Q216 A217 S222 L223	E168-A219 HydrophobicContact CG-CB 4.4Å; M215-A219 WeakPolarHBondContact O-CB 2.99Å; M215-A219 PolarHBondContact O-N 2.91Å; Q216-A219 PolarHBondContact O-N 3.24Å; A217-A219 VanDerWaalsContact C-N 3.35Å; A217-A219 PolarHBondContact O-N 3.4Å; A219-S222 WeakPolarHBondContact CA-OG 3.44Å; A219-S222 PolarHBondContact O-OG 3.14Å; A219-L223 VanDerWaalsContact O-CB 3.27Å; A219-L223 WeakPolarHBondContact O-CB 3.4Å; A219-L223 PolarHBondContact O-N 3.34Å
220	C	94.3	Very high	91.5	Very high	58 Å²	58	45 Å²	45	39%	0.392	24%	0.237	S	C	.	.	H	α-helix	trans	-64.7	-39.1	172.6	-69.9	0	0	0	0	111.9	Q216 A217 F224	Q216-C220 PolarHBondContact NE2-SG 3.31Å; Q216-C220 PolarHBondContact O-N 3.04Å; Q216-C220 PolarHBondContact O-SG 3.47Å; A217-C220 WeakPolarHBondContact O-CB 2.94Å; A217-C220 PolarHBondContact O-N 2.91Å; C220-F224 WeakPolarHBondContact O-CB 3.3Å; C220-F224 PolarHBondContact O-N 3.22Å
221	I	93	Very high	91.1	Very high	84 Å²	84	46.9 Å²	46.9	43%	0.431	24%	0.242	S	C	.	.	H	α-helix	trans	-71.6	-41.7	178.4	-63.4	163.8	0	0	0	111	L29 A217 I218 F224 L225	L29-I221 HydrophobicContact CD1-CB 4.47Å; L29-I221 HydrophobicContact CD1-CG2 3.79Å; L29-I221 HydrophobicContact CD2-CG2 4.43Å; A217-I221 VanDerWaalsContact O-CG1 3.31Å; A217-I221 WeakPolarHBondContact O-CG1 3.31Å; A217-I221 PolarHBondContact O-N 3.01Å; I218-I221 PolarHBondContact O-N 2.86Å; I221-F224 PolarHBondContact O-N 3.35Å; I221-L225 HydrophobicContact CG2-CD1 4.04Å; I221-L225 HydrophobicContact CG2-CG 4.48Å; I221-L225 WeakPolarHBondContact O-CB 3.34Å; I221-L225 WeakPolarHBondContact O-CG 3.33Å; I221-L225 PolarHBondContact O-N 3.07Å
222	S	90.7	Very high	90.7	Very high	3 Å²	3	48 Å²	48	2%	0.021	25%	0.247	C	C	.	.	H	α-helix	trans	-64.2	-39.8	175.3	61.2	0	0	0	0	112	L26 E168 I218 A219 S226	L26-S222 WeakPolarHBondContact CD2-O 3.5Å; E168-S222 PolarHBondContact OE2-OG 2.9Å; I218-S222 PolarHBondContact O-N 3.38Å; I218-S222 PolarHBondContact O-OG 2.93Å; A219-S222 WeakPolarHBondContact CA-OG 3.44Å; A219-S222 PolarHBondContact O-OG 3.14Å; S222-S226 WeakPolarHBondContact O-CB 3.33Å; S222-S226 PolarHBondContact O-N 3.32Å; S222-S226 PolarHBondContact O-OG 3.01Å
223	L	92.8	Very high	90.1	Very high	22 Å²	22	49.4 Å²	49.4	12%	0.115	26%	0.255	C	S	.	.	H	α-helix	trans	-62.8	-47.9	173	-178.7	62.5	0	0	0	111.4	E168 V169 M172 A219 L225 S226 L227	E168-L223 HydrophobicContact CG-CB 4.4Å; V169-L223 HydrophobicContact CG2-CD1 3.84Å; V169-L223 HydrophobicContact CG2-CD2 3.52Å; V169-L223 HydrophobicContact CG2-CG 4.35Å; M172-L223 HydrophobicContact CE-CD2 3.68Å; A219-L223 VanDerWaalsContact O-CB 3.27Å; A219-L223 WeakPolarHBondContact O-CB 3.4Å; A219-L223 PolarHBondContact O-N 3.34Å; L223-L225 PolarHBondContact O-N 3.15Å; L223-S226 WeakPolarHBondContact O-CB 3.36Å; L223-S226 PolarHBondContact O-N 2.03Å; L223-L227 HydrophobicContact CD1-CD1 4.47Å; L223-L227 HydrophobicContact CD1-CG 4.46Å; L223-L227 HydrophobicContact CG-CD1 4.21Å; L223-L227 WeakPolarHBondContact O-CG 3.31Å; L223-L227 PolarHBondContact O-N 2.92Å
224	F	92.3	Very high	89.4	Confident	125 Å²	125	46.4 Å²	46.4	55%	0.548	25%	0.247	S	C	.	.	H	α-helix	trans	-59.7	-43.8	178.4	177.4	-111.1	0	0	0	112.5	C220 I221 L227 L228	C220-F224 WeakPolarHBondContact O-CB 3.3Å; C220-F224 PolarHBondContact O-N 3.22Å; I221-F224 PolarHBondContact O-N 3.35Å; F224-L227 PolarHBondContact O-N 3.4Å; F224-L228 HydrophobicContact CD1-CD1 4.07Å; F224-L228 HydrophobicContact CD1-CG 4.49Å; F224-L228 HydrophobicContact CE1-CD1 3.5Å; F224-L228 VanDerWaalsContact CE1-CD1 3.5Å; F224-L228 HydrophobicContact CE1-CG 4.12Å; F224-L228 HydrophobicContact CE2-CD1 4.44Å; F224-L228 HydrophobicContact CE2-CD2 4.33Å; F224-L228 HydrophobicContact CE2-CG 4.23Å; F224-L228 HydrophobicContact CZ-CD1 3.72Å; F224-L228 HydrophobicContact CZ-CD2 4.14Å; F224-L228 HydrophobicContact CZ-CG 3.98Å; F224-L228 WeakPolarHBondContact O-CG 2.95Å; F224-L228 PolarHBondContact O-N 3.03Å
225	L	89.6	Confident	88.9	Confident	26 Å²	26	48.7 Å²	48.7	14%	0.136	26%	0.257	C	S	.	.	H	α-helix	trans	-64.5	-38.6	175.1	-71.7	168.8	0	0	0	112.5	W25 L26 L29 I221 L223 L227 L228 E229	W25-L225 HydrophobicContact CB-CD1 3.7Å; L26-L225 HydrophobicContact CD2-CB 3.95Å; L26-L225 HydrophobicContact CD2-CD1 4.47Å; L26-L225 HydrophobicContact CG-CB 4.28Å; L29-L225 HydrophobicContact CD1-CD1 3.54Å; I221-L225 HydrophobicContact CG2-CD1 4.04Å; I221-L225 HydrophobicContact CG2-CG 4.48Å; I221-L225 WeakPolarHBondContact O-CB 3.34Å; I221-L225 WeakPolarHBondContact O-CG 3.33Å; I221-L225 PolarHBondContact O-N 3.07Å; L223-L225 PolarHBondContact O-N 3.15Å; L225-L227 VanDerWaalsContact C-N 3.35Å; L225-L228 PolarHBondContact O-N 2.87Å; L225-E229 PolarHBondContact O-N 3.24Å
226	S	88.3	Confident	88.2	Confident	2 Å²	2	54.7 Å²	54.7	1%	0.014	28%	0.283	C	S	.	.	H	α-helix	trans	-64.2	-39.8	175.1	-57.2	0	0	0	0	111.6	S222 L223 E229 I230	S222-S226 WeakPolarHBondContact O-CB 3.33Å; S222-S226 PolarHBondContact O-N 3.32Å; S222-S226 PolarHBondContact O-OG 3.01Å; L223-S226 WeakPolarHBondContact O-CB 3.36Å; L223-S226 PolarHBondContact O-N 2.03Å; S226-E229 PolarHBondContact O-N 2.99Å; S226-I230 WeakPolarHBondContact O-CG1 3.35Å; S226-I230 PolarHBondContact O-N 3.45Å
227	L	89.2	Confident	87.4	Confident	84 Å²	84	60.1 Å²	60.1	44%	0.44	31%	0.306	S	S	.	.	H	α-helix	trans	-67.6	-41.1	173.7	-69	172.6	0	0	0	112.2	L223 F224 L225 E229 I230 M231	L223-L227 HydrophobicContact CD1-CD1 4.47Å; L223-L227 HydrophobicContact CD1-CG 4.46Å; L223-L227 HydrophobicContact CG-CD1 4.21Å; L223-L227 WeakPolarHBondContact O-CG 3.31Å; L223-L227 PolarHBondContact O-N 2.92Å; F224-L227 PolarHBondContact O-N 3.4Å; L225-L227 VanDerWaalsContact C-N 3.35Å; L227-E229 VanDerWaalsContact C-N 3.31Å; L227-E229 PolarHBondContact O-N 3.18Å; L227-I230 PolarHBondContact O-N 3.04Å; L227-M231 WeakPolarHBondContact O-CB 3.05Å; L227-M231 VanDerWaalsContact O-CG 3.25Å; L227-M231 WeakPolarHBondContact O-CG 3.08Å; L227-M231 PolarHBondContact O-N 2.93Å
228	L	88.2	Confident	86.6	Confident	84 Å²	84	62.9 Å²	62.9	44%	0.44	31%	0.313	S	S	.	.	H	α-helix	trans	-61.6	-38.5	173.6	-75	-177.3	0	0	0	112.1	F224 L225 M231 H232	F224-L228 HydrophobicContact CD1-CD1 4.07Å; F224-L228 HydrophobicContact CD1-CG 4.49Å; F224-L228 HydrophobicContact CE1-CD1 3.5Å; F224-L228 VanDerWaalsContact CE1-CD1 3.5Å; F224-L228 HydrophobicContact CE1-CG 4.12Å; F224-L228 HydrophobicContact CE2-CD1 4.44Å; F224-L228 HydrophobicContact CE2-CD2 4.33Å; F224-L228 HydrophobicContact CE2-CG 4.23Å; F224-L228 HydrophobicContact CZ-CD1 3.72Å; F224-L228 HydrophobicContact CZ-CD2 4.14Å; F224-L228 HydrophobicContact CZ-CG 3.98Å; F224-L228 WeakPolarHBondContact O-CG 2.95Å; F224-L228 PolarHBondContact O-N 3.03Å; L225-L228 PolarHBondContact O-N 2.87Å; L228-M231 PolarHBondContact O-N 3.23Å; L228-H232 WeakPolarHBondContact O-CB 3.07Å; L228-H232 PolarHBondContact O-N 3.2Å
229	E	85.6	Confident	85.9	Confident	9 Å²	9	68.3 Å²	68.3	4%	0.042	34%	0.337	C	S	.	.	H	α-helix	trans	-64.7	-48	175.8	-174	151.6	-105.3	0	0	111.2	T19 Y157 I161 L225 S226 L227 M231 H232 L233	T19-E229 PolarHBondContact OG1-OE1 3.07Å; Y157-E229 WeakPolarHBondContact OH-CG 3.29Å; Y157-E229 PolarHBondContact OH-OE1 3.36Å; Y157-E229 PolarHBondContact OH-OE2 3.01Å; I161-E229 HydrophobicContact CD1-CG 4.02Å; L225-E229 PolarHBondContact O-N 3.24Å; S226-E229 PolarHBondContact O-N 2.99Å; L227-E229 VanDerWaalsContact C-N 3.31Å; L227-E229 PolarHBondContact O-N 3.18Å; E229-M231 PolarHBondContact O-N 3.33Å; E229-H232 PolarHBondContact O-N 3.03Å; E229-L233 HydrophobicContact CG-CD1 4Å; E229-L233 WeakPolarHBondContact O-CB 3.46Å; E229-L233 WeakPolarHBondContact O-CD1 3.29Å; E229-L233 WeakPolarHBondContact O-CG 3.15Å; E229-L233 PolarHBondContact O-N 3.3Å
230	I	85.4	Confident	85.2	Confident	47 Å²	47	75 Å²	75	24%	0.241	37%	0.366	C	S	.	.	H	α-helix	trans	-56.7	-47.4	172.1	-70.3	171	0	0	0	111.2	I161 V162 S226 L227 H232 L233 G234	I161-I230 HydrophobicContact CB-CD1 4.2Å; I161-I230 HydrophobicContact CB-CG1 4.13Å; I161-I230 HydrophobicContact CG2-CD1 3.73Å; I161-I230 HydrophobicContact CG2-CG1 3.74Å; V162-I230 HydrophobicContact CG2-CD1 3.97Å; S226-I230 WeakPolarHBondContact O-CG1 3.35Å; S226-I230 PolarHBondContact O-N 3.45Å; L227-I230 PolarHBondContact O-N 3.04Å; I230-H232 PolarHBondContact O-N 3.18Å; I230-L233 PolarHBondContact O-N 3.38Å; I230-G234 PolarHBondContact O-N 3.44Å
231	M	85.5	Confident	84.4	Confident	135 Å²	135	74.2 Å²	74.2	67%	0.665	37%	0.367	S	S	*	.	H	α-helix	trans	-64.3	-40.5	-178	-76.4	-63.7	-68.4	0	0	112.5	L227 L228 E229 G234 F235	L227-M231 WeakPolarHBondContact O-CB 3.05Å; L227-M231 VanDerWaalsContact O-CG 3.25Å; L227-M231 WeakPolarHBondContact O-CG 3.08Å; L227-M231 PolarHBondContact O-N 2.93Å; L228-M231 PolarHBondContact O-N 3.23Å; E229-M231 PolarHBondContact O-N 3.33Å; M231-G234 PolarHBondContact O-N 3Å; M231-F235 VanDerWaalsContact O-CB 3.27Å; M231-F235 WeakPolarHBondContact O-CB 3.36Å; M231-F235 PolarHBondContact O-N 3.41Å
232	H	83.6	Confident	83.7	Confident	66 Å²	66	74.8 Å²	74.8	31%	0.306	37%	0.37	S	S	.	.	H	α-helix	trans	-68	-39.2	176.2	165.1	-114.2	0	0	0	112.4	T19 L228 E229 I230 K236	T19-H232 VanDerWaalsContact CG2-CE1 3.48Å; T19-H232 WeakPolarHBondContact CG2-CE1 3.09Å; T19-H232 WeakPolarHBondContact CG2-ND1 3.49Å; L228-H232 WeakPolarHBondContact O-CB 3.07Å; L228-H232 PolarHBondContact O-N 3.2Å; E229-H232 PolarHBondContact O-N 3.03Å; I230-H232 PolarHBondContact O-N 3.18Å; H232-K236 PolarHBondContact CE1-NZ 2.93Å; H232-K236 WeakPolarHBondContact NE2-CE 3.46Å; H232-K236 PolarHBondContact NE2-NZ 3.3Å; H232-K236 PolarHBondContact O-N 2.98Å
233	L	80.8	Confident	83	Confident	32 Å²	32	76.9 Å²	76.9	17%	0.168	38%	0.381	C	S	.	.	H	α-helix	trans	-65.2	-45.5	173.4	-67.8	163.4	0	0	0	111.4	Y157 I161 E229 I230 K236 K237	Y157-L233 HydrophobicContact CD1-CD1 4.23Å; Y157-L233 HydrophobicContact CE1-CD1 3.49Å; Y157-L233 VanDerWaalsContact CE1-CD1 3.49Å; Y157-L233 HydrophobicContact CE1-CD2 4.06Å; Y157-L233 HydrophobicContact CE1-CG 4.42Å; I161-L233 HydrophobicContact CD1-CD1 4.02Å; E229-L233 HydrophobicContact CG-CD1 4Å; E229-L233 WeakPolarHBondContact O-CB 3.46Å; E229-L233 WeakPolarHBondContact O-CD1 3.29Å; E229-L233 WeakPolarHBondContact O-CG 3.15Å; E229-L233 PolarHBondContact O-N 3.3Å; I230-L233 PolarHBondContact O-N 3.38Å; L233-K236 PolarHBondContact O-N 3.44Å; L233-K237 WeakPolarHBondContact O-CG 3.37Å; L233-K237 PolarHBondContact O-N 3.3Å
234	G	80.8	Confident	81.9	Confident	28 Å²	28	81.4 Å²	81.4	29%	0.289	41%	0.405	S	S	.	.	H	α-helix	trans	-59.2	-49.5	174.8	0	0	0	0	0	111.9	I230 M231 K236 K237 I238	I230-G234 PolarHBondContact O-N 3.44Å; M231-G234 PolarHBondContact O-N 3Å; G234-K236 VanDerWaalsContact C-N 3.34Å; G234-K236 PolarHBondContact O-N 2.99Å; G234-K237 WeakPolarHBondContact O-CB 3.4Å; G234-K237 PolarHBondContact O-N 2.93Å; G234-K237 VanDerWaalsContact O-N 3.09Å; G234-I238 WeakPolarHBondContact O-CB 3.35Å; G234-I238 VanDerWaalsContact O-CG1 3.28Å; G234-I238 WeakPolarHBondContact O-CG1 3.21Å; G234-I238 PolarHBondContact O-N 3.11Å
235	F	80.6	Confident	80.9	Confident	138 Å²	138	84.3 Å²	84.3	61%	0.605	41%	0.414	S	S	*	.	H	α-helix	trans	-61.1	-40.1	178	-170.5	-97	0	0	0	112.4	M231 K237 I238 K239	M231-F235 VanDerWaalsContact O-CB 3.27Å; M231-F235 WeakPolarHBondContact O-CB 3.36Å; M231-F235 PolarHBondContact O-N 3.41Å; F235-K237 PolarHBondContact O-N 3.32Å; F235-I238 PolarHBondContact O-N 2.87Å; F235-K239 HydrophobicContact CE1-CD 4.49Å; F235-K239 VanDerWaalsContact O-CB 3.26Å; F235-K239 WeakPolarHBondContact O-CB 3.26Å; F235-K239 PolarHBondContact O-N 2.79Å
236	K	78.6	Confident	79.9	Confident	127 Å²	127	89.9 Å²	89.9	55%	0.552	43%	0.434	S	S	*	.	H	α-helix	trans	-62.2	-39.8	172.8	-85.1	177.2	165.2	165.3	0	112.7	H232 L233 G234 K240	H232-K236 PolarHBondContact CE1-NZ 2.93Å; H232-K236 WeakPolarHBondContact NE2-CE 3.46Å; H232-K236 PolarHBondContact NE2-NZ 3.3Å; H232-K236 PolarHBondContact O-N 2.98Å; L233-K236 PolarHBondContact O-N 3.44Å; G234-K236 VanDerWaalsContact C-N 3.34Å; G234-K236 PolarHBondContact O-N 2.99Å; K236-K240 WeakPolarHBondContact O-CB 3.21Å; K236-K240 PolarHBondContact O-N 3.43Å
237	K	77.2	Confident	78.6	Confident	136 Å²	136	93.7 Å²	93.7	59%	0.591	46%	0.458	S	S	*	.	H	α-helix	trans	-67.4	-48.5	175	-75.8	-77.4	-175	165.5	0	112	L154 L233 G234 F235 K240 G241	L154-K237 VanDerWaalsContact CD2-NZ 3.33Å; L233-K237 WeakPolarHBondContact O-CG 3.37Å; L233-K237 PolarHBondContact O-N 3.3Å; G234-K237 WeakPolarHBondContact O-CB 3.4Å; G234-K237 PolarHBondContact O-N 2.93Å; G234-K237 VanDerWaalsContact O-N 3.09Å; F235-K237 PolarHBondContact O-N 3.32Å; K237-K240 PolarHBondContact O-N 2.91Å; K237-G241 PolarHBondContact O-N 2.04Å
238	I	77.5	Confident	77.2	Confident	104 Å²	104	96.2 Å²	96.2	53%	0.533	47%	0.468	S	S	.	.	H	α-helix	trans	-61.4	-48.6	179.2	-68.2	163.8	0	0	0	110.3	G234 F235 K240 G241 I242	G234-I238 WeakPolarHBondContact O-CB 3.35Å; G234-I238 VanDerWaalsContact O-CG1 3.28Å; G234-I238 WeakPolarHBondContact O-CG1 3.21Å; G234-I238 PolarHBondContact O-N 3.11Å; F235-I238 PolarHBondContact O-N 2.87Å; I238-K240 VanDerWaalsContact C-N 3.31Å; I238-K240 PolarHBondContact O-N 2.98Å; I238-G241 WeakPolarHBondContact O-CA 3.23Å; I238-G241 PolarHBondContact O-N 2.85Å; I238-G241 VanDerWaalsContact O-N 3.09Å; I238-I242 HydrophobicContact CG2-CD1 3.68Å; I238-I242 HydrophobicContact CG2-CG1 4.34Å; I238-I242 WeakPolarHBondContact O-CG1 3.48Å; I238-I242 PolarHBondContact O-N 3.17Å
239	K	78.2	Confident	75.9	Confident	124 Å²	124	97.1 Å²	97.1	54%	0.539	47%	0.473	S	S	.	.	H	α-helix	trans	-58	-41.3	176.3	-176.6	172.1	-179.9	174.8	0	112.1	F235 L243	F235-K239 HydrophobicContact CE1-CD 4.49Å; F235-K239 VanDerWaalsContact O-CB 3.26Å; F235-K239 WeakPolarHBondContact O-CB 3.26Å; F235-K239 PolarHBondContact O-N 2.79Å; K239-L243 VanDerWaalsContact O-CB 3.27Å; K239-L243 WeakPolarHBondContact O-CB 3.48Å; K239-L243 PolarHBondContact O-N 3.2Å
240	K	77.4	Confident	74.6	Confident	142 Å²	142	100.7 Å²	100.7	62%	0.617	49%	0.488	S	S	*	.	H	α-helix	trans	-71.2	-32.3	176.3	-169.8	164.9	-176.2	169.1	0	112.8	K236 K237 I238 N244	K236-K240 WeakPolarHBondContact O-CB 3.21Å; K236-K240 PolarHBondContact O-N 3.43Å; K237-K240 PolarHBondContact O-N 2.91Å; I238-K240 VanDerWaalsContact C-N 3.31Å; I238-K240 PolarHBondContact O-N 2.98Å; K240-N244 WeakPolarHBondContact O-CB 3.42Å; K240-N244 PolarHBondContact O-N 2.97Å; K240-N244 VanDerWaalsContact O-N 3.12Å; K240-N244 PolarHBondContact O-OD1 2.9Å
241	G	77.3	Confident	73.5	Confident	40 Å²	40	103.3 Å²	103.3	41%	0.412	50%	0.503	S	S	.	.	H	α-helix	trans	-64.6	-49.7	171.5	0	0	0	0	0	112.2	K237 I238 L243 N244 Y245	K237-G241 PolarHBondContact O-N 2.04Å; I238-G241 WeakPolarHBondContact O-CA 3.23Å; I238-G241 PolarHBondContact O-N 2.85Å; I238-G241 VanDerWaalsContact O-N 3.09Å; G241-L243 PolarHBondContact O-N 3.37Å; G241-N244 PolarHBondContact O-N 2.03Å; G241-N244 VanDerWaalsContact O-N 3.16Å; G241-Y245 WeakPolarHBondContact O-CB 3.16Å; G241-Y245 PolarHBondContact O-N 2.98Å
242	I	78.7	Confident	72.3	Confident	96 Å²	96	101.4 Å²	101.4	49%	0.492	50%	0.495	S	S	.	.	H	α-helix	trans	-62.2	-42.3	177.6	-65.7	169.7	0	0	0	111	I238 N244 Y245 Y246	I238-I242 HydrophobicContact CG2-CD1 3.68Å; I238-I242 HydrophobicContact CG2-CG1 4.34Å; I238-I242 WeakPolarHBondContact O-CG1 3.48Å; I238-I242 PolarHBondContact O-N 3.17Å; I242-N244 VanDerWaalsContact C-N 3.27Å; I242-N244 PolarHBondContact O-N 3.35Å; I242-Y245 PolarHBondContact O-N 3.28Å; I242-Y246 PolarHBondContact O-N 3.05Å
243	L	75.3	Confident	71.5	Confident	47 Å²	47	101.9 Å²	101.9	25%	0.246	50%	0.499	C	S	.	.	H	α-helix	trans	-67	-26	177	-167.9	66.5	0	0	0	113.3	K239 G241 K250	K239-L243 VanDerWaalsContact O-CB 3.27Å; K239-L243 WeakPolarHBondContact O-CB 3.48Å; K239-L243 PolarHBondContact O-N 3.2Å; G241-L243 PolarHBondContact O-N 3.37Å; L243-K250 HydrophobicContact CD1-CB 3.64Å; L243-K250 HydrophobicContact CD1-CG 4.09Å; L243-K250 HydrophobicContact CD2-CD 4.44Å; L243-K250 HydrophobicContact CD2-CG 4.29Å; L243-K250 HydrophobicContact CG-CB 4.03Å; L243-K250 HydrophobicContact CG-CD 4.3Å; L243-K250 HydrophobicContact CG-CG 4.13Å
244	N	70.4	Confident	70.7	Confident	117 Å²	117	104 Å²	104	63%	0.626	51%	0.511	S	S	*	.	H	α-helix	trans	-81.3	-21.5	170.5	-72.9	-2.9	0	0	0	112.7	K240 G241 I242	K240-N244 WeakPolarHBondContact O-CB 3.42Å; K240-N244 PolarHBondContact O-N 2.97Å; K240-N244 VanDerWaalsContact O-N 3.12Å; K240-N244 PolarHBondContact O-OD1 2.9Å; G241-N244 PolarHBondContact O-N 2.03Å; G241-N244 VanDerWaalsContact O-N 3.16Å; I242-N244 VanDerWaalsContact C-N 3.27Å; I242-N244 PolarHBondContact O-N 3.35Å
245	Y	70.6	Confident	69.7	Low	187 Å²	187	108 Å²	108	73%	0.733	53%	0.526	S	S	*	.	H	α-helix	trans	-86.6	-33.3	178.6	-170.5	-90	0	0	0	112.2	G241 I242 P247	G241-Y245 WeakPolarHBondContact O-CB 3.16Å; G241-Y245 PolarHBondContact O-N 2.98Å; I242-Y245 PolarHBondContact O-N 3.28Å; Y245-P247 VanDerWaalsContact C-CD 3.44Å; Y245-P247 WeakPolarHBondContact O-CD 3.48Å
246	Y	69.3	Low	68.9	Low	142 Å²	142	108.8 Å²	108.8	56%	0.557	53%	0.526	S	S	*	.			trans	-107.4	79.5	169.7	-84.5	-85.1	0	0	0	110.5	I242 H248 L249	I242-Y246 PolarHBondContact O-N 3.05Å; Y246-H248 VanDerWaalsContact C-N 3.27Å; Y246-H248 PolarHBondContact O-N 3.21Å; Y246-L249 PolarHBondContact O-N 3.44Å
247	P	60.9	Low	67.9	Low	82 Å²	82	110.5 Å²	110.5	53%	0.532	53%	0.53	S	S	.	.	H	α-helix	trans	-59.2	-38.8	178.1	23.6	-33.4	0	0	0	112.1	Y245 L249 K250 D251	Y245-P247 VanDerWaalsContact C-CD 3.44Å; Y245-P247 WeakPolarHBondContact O-CD 3.48Å; P247-L249 VanDerWaalsContact C-N 3.27Å; P247-L249 PolarHBondContact O-N 3.06Å; P247-K250 WeakPolarHBondContact O-CA 3.47Å; P247-K250 VanDerWaalsContact O-CB 3.22Å; P247-K250 WeakPolarHBondContact O-CB 3.43Å; P247-K250 PolarHBondContact O-N 3.38Å; P247-D251 PolarHBondContact O-N 3.35Å
248	H	59.3	Low	66.9	Low	138 Å²	138	107.3 Å²	107.3	64%	0.639	52%	0.521	S	S	*	.	H	α-helix	trans	-59.3	-34.5	-177.8	-154.7	-52.4	0	0	0	113.6	Y246 K250 D251 D252	Y246-H248 VanDerWaalsContact C-N 3.27Å; Y246-H248 PolarHBondContact O-N 3.21Å; H248-K250 VanDerWaalsContact C-N 3.27Å; H248-K250 PolarHBondContact O-N 3.38Å; H248-D251 PolarHBondContact O-N 3.47Å; H248-D252 IonicContact ND1-OD2 3.27Å; H248-D252 PolarHBondContact O-N 3.04Å
249	L	61	Low	65.9	Low	103 Å²	103	104.7 Å²	104.7	54%	0.539	51%	0.513	S	S	.	.	H	α-helix	trans	-75.7	-17.2	177.9	-168	68.4	0	0	0	112.3	Y246 P247 L253	Y246-L249 PolarHBondContact O-N 3.44Å; P247-L249 VanDerWaalsContact C-N 3.27Å; P247-L249 PolarHBondContact O-N 3.06Å; L249-L253 WeakPolarHBondContact O-CB 3.43Å; L249-L253 PolarHBondContact O-N 3.4Å
250	K	58.6	Low	64.6	Low	84 Å²	84	104.4 Å²	104.4	37%	0.365	51%	0.511	S	S	.	.	H	α-helix	trans	-74.8	-42.8	173.5	-174.8	-178.9	169.3	-64.6	0	110.5	L243 P247 H248 L253 D254	L243-K250 HydrophobicContact CD1-CB 3.64Å; L243-K250 HydrophobicContact CD1-CG 4.09Å; L243-K250 HydrophobicContact CD2-CD 4.44Å; L243-K250 HydrophobicContact CD2-CG 4.29Å; L243-K250 HydrophobicContact CG-CB 4.03Å; L243-K250 HydrophobicContact CG-CD 4.3Å; L243-K250 HydrophobicContact CG-CG 4.13Å; P247-K250 WeakPolarHBondContact O-CA 3.47Å; P247-K250 VanDerWaalsContact O-CB 3.22Å; P247-K250 WeakPolarHBondContact O-CB 3.43Å; P247-K250 PolarHBondContact O-N 3.38Å; H248-K250 VanDerWaalsContact C-N 3.27Å; H248-K250 PolarHBondContact O-N 3.38Å; K250-L253 PolarHBondContact O-N 3.41Å; K250-D254 IonicContact NZ-OD2 2.9Å; K250-D254 PolarHBondContact NZ-OD2 2.68Å; K250-D254 WeakPolarHBondContact O-CB 3.37Å; K250-D254 PolarHBondContact O-N 3.1Å
251	D	61.9	Low	63.2	Low	102 Å²	102	101.5 Å²	101.5	55%	0.545	51%	0.509	S	S	.	.	H	α-helix	trans	-62.4	-46.2	177.7	-59.7	-45.5	0	0	0	110.4	P247 H248 L253 D254 D255	P247-D251 PolarHBondContact O-N 3.35Å; H248-D251 PolarHBondContact O-N 3.47Å; D251-L253 VanDerWaalsContact C-N 3.28Å; D251-L253 PolarHBondContact O-N 3.48Å; D251-D254 PolarHBondContact O-N 3.11Å; D251-D255 WeakPolarHBondContact O-CB 3.34Å; D251-D255 PolarHBondContact O-N 3.01Å
252	D	61.3	Low	61.8	Low	95 Å²	95	106.2 Å²	106.2	51%	0.508	52%	0.518	S	S	.	.	H	α-helix	trans	-55.6	-38.8	173	-72	-52.1	0	0	0	113.4	H248 Y256	H248-D252 IonicContact ND1-OD2 3.27Å; H248-D252 PolarHBondContact O-N 3.04Å; D252-Y256 WeakPolarHBondContact O-CB 3.32Å; D252-Y256 PolarHBondContact O-N 3.47Å
253	L	66.8	Low	60.5	Low	75 Å²	75	108.2 Å²	108.2	39%	0.393	52%	0.523	S	S	.	.	H	α-helix	trans	-77.2	-39.8	-178.3	-177.7	63	0	0	0	112.6	L249 K250 D251 Y257	L249-L253 WeakPolarHBondContact O-CB 3.43Å; L249-L253 PolarHBondContact O-N 3.4Å; K250-L253 PolarHBondContact O-N 3.41Å; D251-L253 VanDerWaalsContact C-N 3.28Å; D251-L253 PolarHBondContact O-N 3.48Å; L253-Y257 PolarHBondContact O-N 3.27Å
254	D	62.5	Low	59	Low	76 Å²	76	111.8 Å²	111.8	41%	0.406	54%	0.542	S	S	.	.	H	α-helix	trans	-67	-40.6	174.8	-78.5	-33.8	0	0	0	109.8	K250 D251 Y257 V258	K250-D254 IonicContact NZ-OD2 2.9Å; K250-D254 PolarHBondContact NZ-OD2 2.68Å; K250-D254 WeakPolarHBondContact O-CB 3.37Å; K250-D254 PolarHBondContact O-N 3.1Å; D251-D254 PolarHBondContact O-N 3.11Å; D254-Y257 PolarHBondContact O-N 2.98Å; D254-V258 WeakPolarHBondContact O-CB 3.38Å; D254-V258 VanDerWaalsContact O-CG2 3.31Å; D254-V258 WeakPolarHBondContact O-CG2 3.35Å; D254-V258 PolarHBondContact O-N 3.15Å
255	D	61	Low	58.1	Low	114 Å²	114	110 Å²	110	61%	0.61	54%	0.539	S	S	*	.	H	α-helix	trans	-69.3	-35.4	177	-138.7	8.4	0	0	0	112	D251 Y257 V258 S259	D251-D255 WeakPolarHBondContact O-CB 3.34Å; D251-D255 PolarHBondContact O-N 3.01Å; D255-Y257 PolarHBondContact O-N 2.92Å; D255-V258 PolarHBondContact O-N 2.67Å; D255-S259 WeakPolarHBondContact O-CB 3.4Å; D255-S259 PolarHBondContact O-N 3.36Å
256	Y	63.9	Low	56.9	Low	154 Å²	154	105.8 Å²	105.8	60%	0.604	53%	0.532	S	S	*	.	H	α-helix	trans	-61.2	-41	169.2	-179.1	-103.1	0	0	0	112.3	D252 K260	D252-Y256 WeakPolarHBondContact O-CB 3.32Å; D252-Y256 PolarHBondContact O-N 3.47Å; Y256-K260 WeakPolarHBondContact O-CB 3.44Å; Y256-K260 PolarHBondContact O-N 2.87Å
257	Y	56.1	Low	55.8	Low	163 Å²	163	105 Å²	105	64%	0.639	54%	0.543	S	S	*	.	H	α-helix	trans	-71.1	-40.9	176.6	-114	-93.9	0	0	0	112.8	L253 D254 D255 K260 S261	L253-Y257 PolarHBondContact O-N 3.27Å; D254-Y257 PolarHBondContact O-N 2.98Å; D255-Y257 PolarHBondContact O-N 2.92Å; Y257-K260 PolarHBondContact O-N 3.32Å; Y257-S261 WeakPolarHBondContact O-CB 3.48Å; Y257-S261 PolarHBondContact O-N 3.22Å
258	V	56.3	Low	54.8	Low	68 Å²	68	109.6 Å²	109.6	41%	0.412	56%	0.556	S	S	.	*	H	α-helix	trans	-65.9	-40.6	175.4	168.5	0	0	0	0	111	D254 D255 S261 K262	D254-V258 WeakPolarHBondContact O-CB 3.38Å; D254-V258 VanDerWaalsContact O-CG2 3.31Å; D254-V258 WeakPolarHBondContact O-CG2 3.35Å; D254-V258 PolarHBondContact O-N 3.15Å; D255-V258 PolarHBondContact O-N 2.67Å; V258-S261 PolarHBondContact O-N 3.09Å; V258-K262 HydrophobicContact CG1-CD 4.41Å; V258-K262 WeakPolarHBondContact O-CB 2.79Å; V258-K262 PolarHBondContact O-N 2.77Å
259	S	56.5	Low	54.1	Low	50 Å²	50	111 Å²	111	35%	0.35	56%	0.563	S	S	.	*	H	α-helix	trans	-61.3	-42.5	173.4	-174.7	0	0	0	0	111.7	D255 K263	D255-S259 WeakPolarHBondContact O-CB 3.4Å; D255-S259 PolarHBondContact O-N 3.36Å; S259-K263 WeakPolarHBondContact O-CB 3.34Å; S259-K263 WeakPolarHBondContact O-CG 3.46Å; S259-K263 PolarHBondContact O-N 3.03Å
260	K	51.8	Low	53.1	Low	118 Å²	118	112 Å²	112	51%	0.513	57%	0.574	S	S	.	*	H	α-helix	trans	-67.4	-38.9	174.9	-165.6	171.5	-176.4	176.7	0	112.4	Y256 Y257 K263 N264	Y256-K260 WeakPolarHBondContact O-CB 3.44Å; Y256-K260 PolarHBondContact O-N 2.87Å; Y257-K260 PolarHBondContact O-N 3.32Å; K260-K263 PolarHBondContact O-N 3Å; K260-N264 PolarHBondContact O-N 3.29Å; K260-N264 VanDerWaalsContact O-N 3.13Å; K260-N264 PolarHBondContact O-OD1 2.92Å
261	S	49	Very low	51.9	Low	80 Å²	80	114.2 Å²	114.2	56%	0.559	60%	0.598	S	S	*	*	H	α-helix	trans	-63.7	-47.7	174.3	-177.4	0	0	0	0	112	Y257 V258 K263 N264 S265	Y257-S261 WeakPolarHBondContact O-CB 3.48Å; Y257-S261 PolarHBondContact O-N 3.22Å; V258-S261 PolarHBondContact O-N 3.09Å; S261-K263 PolarHBondContact O-N 2.9Å; S261-N264 PolarHBondContact O-N 3.36Å; S261-S265 PolarHBondContact O-N 2.92Å
262	K	47.6	Very low	50.7	Low	140 Å²	140	116.9 Å²	116.9	61%	0.609	62%	0.617	S	S	*	*	H	α-helix	trans	-60	-41.7	174.8	-80.7	-179.7	175	173.5	0	112.3	V258 N264 S265 V266	V258-K262 HydrophobicContact CG1-CD 4.41Å; V258-K262 WeakPolarHBondContact O-CB 2.79Å; V258-K262 PolarHBondContact O-N 2.77Å; K262-N264 VanDerWaalsContact C-N 3.33Å; K262-N264 PolarHBondContact O-N 3.26Å; K262-S265 PolarHBondContact O-N 3.35Å; K262-S265 VanDerWaalsContact O-N 3.14Å; K262-V266 WeakPolarHBondContact O-CB 3.19Å; K262-V266 VanDerWaalsContact O-CG2 3.31Å; K262-V266 WeakPolarHBondContact O-CG2 3.28Å; K262-V266 PolarHBondContact O-N 3.25Å
263	K	49.9	Very low	49.2	Very low	138 Å²	138	115.4 Å²	115.4	60%	0.6	63%	0.625	S	S	*	*	H	α-helix	trans	-59.9	-41.9	175.2	-77.1	170	-179.7	172.9	0	112.2	S259 K260 S261 S265 V267	S259-K263 WeakPolarHBondContact O-CB 3.34Å; S259-K263 WeakPolarHBondContact O-CG 3.46Å; S259-K263 PolarHBondContact O-N 3.03Å; K260-K263 PolarHBondContact O-N 3Å; S261-K263 PolarHBondContact O-N 2.9Å; K263-S265 VanDerWaalsContact C-N 3.34Å; K263-S265 PolarHBondContact O-N 3.29Å; K263-V267 WeakPolarHBondContact O-CG2 3.28Å; K263-V267 PolarHBondContact O-N 3.24Å
264	N	45.7	Very low	47.5	Very low	122 Å²	122	118.1 Å²	118.1	65%	0.652	65%	0.645	S	S	*	*	H	α-helix	trans	-67.9	-32.5	175	-69.9	9.3	0	0	0	112.8	K260 S261 K262	K260-N264 PolarHBondContact O-N 3.29Å; K260-N264 VanDerWaalsContact O-N 3.13Å; K260-N264 PolarHBondContact O-OD1 2.92Å; S261-N264 PolarHBondContact O-N 3.36Å; K262-N264 VanDerWaalsContact C-N 3.33Å; K262-N264 PolarHBondContact O-N 3.26Å
265	S	50.1	Low	46	Very low	80 Å²	80	119.8 Å²	119.8	56%	0.559	66%	0.662	S	S	*	*	H	α-helix	trans	-75.4	-39	177.8	-168.1	0	0	0	0	113.4	S261 K262 K263 H268	S261-S265 PolarHBondContact O-N 2.92Å; K262-S265 PolarHBondContact O-N 3.35Å; K262-S265 VanDerWaalsContact O-N 3.14Å; K263-S265 VanDerWaalsContact C-N 3.34Å; K263-S265 PolarHBondContact O-N 3.29Å; S265-H268 PolarHBondContact O-N 2.62Å
266	V	44.9	Very low	44.7	Very low	97 Å²	97	121.2 Å²	121.2	59%	0.588	68%	0.675	S	S	*	*	H	α-helix	trans	-71.8	-30.6	-175.2	168.4	0	0	0	0	112.2	K262 H268 Q269	K262-V266 WeakPolarHBondContact O-CB 3.19Å; K262-V266 VanDerWaalsContact O-CG2 3.31Å; K262-V266 WeakPolarHBondContact O-CG2 3.28Å; K262-V266 PolarHBondContact O-N 3.25Å; V266-H268 PolarHBondContact O-N 3.26Å; V266-H268 VanDerWaalsContact O-N 3.11Å; V266-Q269 PolarHBondContact O-N 2.69Å
267	V	46.2	Very low	43.1	Very low	127 Å²	127	117.2 Å²	117.2	77%	0.77	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60	-20.8	174.6	169.3	0	0	0	0	112.5	K263	K263-V267 WeakPolarHBondContact O-CG2 3.28Å; K263-V267 PolarHBondContact O-N 3.24Å
268	H	41.2	Very low	42	Very low	177 Å²	177	122 Å²	122	82%	0.819	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.2	5.1	-178.7	-138.1	-71	0	0	0	114.8	S265 V266	S265-H268 PolarHBondContact O-N 2.62Å; V266-H268 PolarHBondContact O-N 3.26Å; V266-H268 VanDerWaalsContact O-N 3.11Å
269	Q	43.2	Very low	40.8	Very low	168 Å²	168	128.4 Å²	128.4	79%	0.785	72%	0.72	S	S	*	*	S	Bend	trans	-130.5	24	-174.3	-151	179	-11.7	0	0	115.2	V266	V266-Q269 PolarHBondContact O-N 2.69Å
270	V	40.3	Very low	39.5	Very low	125 Å²	125	131.2 Å²	131.2	76%	0.758	74%	0.739	S	S	*	*			trans	-136.1	82.6	166.5	-173.4	0	0	0	0	110.7
271	C	34.9	Very low	38.4	Very low	130 Å²	130	131.6 Å²	131.6	88%	0.878	75%	0.751	S	S	*	*			trans	-174.4	81.9	153	-112.4	0	0	0	0	112.2
272	V	36.1	Very low	37.6	Very low	157 Å²	157	135.1 Å²	135.1	95%	0.952	76%	0.762	S	S	*	*			trans	-136.6	110.1	161.8	179.2	0	0	0	0	107.1
273	G	30.3	Very low	37.5	Very low	64 Å²	64	133.5 Å²	133.5	66%	0.66	77%	0.766	S	S	*	*			trans	150.1	83.7	179.9	0	0	0	0	0	116.1
274	T	30.9	Very low	36.6	Very low	133 Å²	133	134 Å²	134	82%	0.816	78%	0.781	S	S	*	*			trans	45.2	126.4	140.2	51.7	0	0	0	0	122.7
275	S	30.7	Very low	35.8	Very low	110 Å²	110	132.3 Å²	132.3	77%	0.769	78%	0.784	S	S	*	*				102	124.4	129.1	77.4	0	0	0	0	122.1
276	V	33.3	Very low	35.5	Very low	145 Å²	145	133.6 Å²	133.6	88%	0.879	79%	0.79	S	S	*	*			trans	54.8	99.1	137.7	-173.3	0	0	0	0	120.3
277	G	30.9	Very low	34.7	Very low	70 Å²	70	134.4 Å²	134.4	72%	0.722	80%	0.8	S	S	*	*				101.8	147	99.7	0	0	0	0	0	121.6
278	R	32	Very low	33.8	Very low	263 Å²	263	131.1 Å²	131.1	99%	0.992	79%	0.793	S	S	*	*			trans	80	170	165.8	-71.4	-175.4	169	166.7	-2.1	118.7
279	K	30.5	Very low	33.2	Very low	203 Å²	203	131.8 Å²	131.8	88%	0.883	79%	0.789	S	S	*	*			trans	-134.6	173.5	-153.5	-64.6	-180	174.6	-179	0	111.3
280	S	29.4	Very low	32.7	Very low	108 Å²	108	130.3 Å²	130.3	76%	0.755	79%	0.792	S	S	*	*			trans	83.7	148.4	160.5	-142.2	0	0	0	0	114.6
281	T	29.4	Very low	32.2	Very low	126 Å²	126	131.3 Å²	131.3	77%	0.773	79%	0.792	S	S	*	*			cis	-144.7	157	11.1	-37.5	0	0	0	0	111.3
282	I	31.9	Very low	32.1	Very low	154 Å²	154	132 Å²	132	79%	0.79	79%	0.786	S	S	*	*			trans	-94.3	-164.4	163.8	6.1	175	0	0	0	108.7
283	P	46.7	Very low	31.9	Very low	107 Å²	107	131.4 Å²	131.4	70%	0.695	78%	0.777	S	S	*	*			cis	-130.3	168.5	-9	39.6	-23.9	0	0	0	115.4
284	T	29.2	Very low	31.9	Very low	147 Å²	147	134.6 Å²	134.6	90%	0.902	78%	0.775	S	S	*	*				-152.9	141.8	129.9	-17.2	0	0	0	0	111.6
285	A	30	Very low	31.9	Very low	88 Å²	88	135.8 Å²	135.8	73%	0.727	77%	0.769	S	S	*	*			trans	-141.8	-167.7	173.6	0	0	0	0	0	105.8
286	P	43.3	Very low	31.8	Very low	106 Å²	106	139.1 Å²	139.1	69%	0.688	77%	0.772	S	S	*	*			cis	-142.5	-166.5	7.4	44.8	-25	0	0	0	115.7
287	S	28.3	Very low	31.5	Very low	114 Å²	114	135.3 Å²	135.3	80%	0.797	76%	0.762	S	S	*	*			trans	129.2	132.3	156.7	-167.5	0	0	0	0	111.4
288	G	27.5	Very low	31.5	Very low	59 Å²	59	140.4 Å²	140.4	61%	0.608	77%	0.773	S	S	*	*			cis	-147.3	-169.1	-0	0	0	0	0	0	111.9
289	Y	29.1	Very low	31.2	Very low	190 Å²	190	131.1 Å²	131.1	75%	0.745	76%	0.76	S	S	*	*			trans	-148	143.5	-151.8	3.5	-108	0	0	0	116.4
290	T	33	Very low	31.9	Very low	138 Å²	138	126.7 Å²	126.7	85%	0.847	75%	0.752	S	S	*	*			trans	-179.1	127.6	152.8	27.6	0	0	0	0	106.8
291	L	29.5	Very low	31.8	Very low	146 Å²	146	127 Å²	127	76%	0.764	75%	0.745	S	S	*	*			cis	58.8	137	25.2	-76.7	171	0	0	0	113.4
292	L	31.2	Very low	31.7	Very low	143 Å²	143	129.9 Å²	129.9	75%	0.749	74%	0.743	S	S	*	*			cis	-133.7	174.7	26.4	-68.1	167	0	0	0	109.7
293	L	32.3	Very low	32.2	Very low	145 Å²	145	128.4 Å²	128.4	76%	0.759	74%	0.743	S	S	*	*			cis	-160	-172.7	-11.4	-104.6	165.3	0	0	0	104.8
294	E	30.8	Very low	31.3	Very low	131 Å²	131	130.4 Å²	130.4	61%	0.612	75%	0.747	S	S	*	*			cis	-147.9	-155.1	3.2	-139.9	-155.8	-30.1	0	0	106.5
295	K	30.2	Very low	31.4	Very low	159 Å²	159	130.5 Å²	130.5	69%	0.691	74%	0.741	S	S	*	*			cis	-151.7	180	-0.6	-161.3	156.4	-164.9	73.9	0	109.5
296	Q	29.7	Very low	31.2	Very low	179 Å²	179	131.1 Å²	131.1	84%	0.836	74%	0.74	S	S	*	*			trans	-86.2	167.2	168.4	-67	159.4	-38.7	0	0	112.7
297	G	27.7	Very low	30.4	Very low	65 Å²	65	130.4 Å²	130.4	67%	0.67	74%	0.743	S	S	*	*			cis	165	-171.2	-3.3	0	0	0	0	0	113.9
298	N	29	Very low	30.4	Very low	177 Å²	177	130.3 Å²	130.3	95%	0.947	74%	0.743	S	S	*	*			trans	73.2	140.8	178.9	-65	7.8	0	0	0	118.7
299	G	26.8	Very low	30.5	Very low	69 Å²	69	132.8 Å²	132.8	71%	0.711	75%	0.75	S	S	*	*			trans	-125.8	-147.2	169.8	0	0	0	0	0	110.4
300	P	44.5	Very low	30.6	Very low	110 Å²	110	128.2 Å²	128.2	71%	0.714	75%	0.752	S	S	*	*			cis	-139.7	-161.8	7.6	40.7	-19.6	0	0	0	115.3
301	N	28.2	Very low	30.4	Very low	114 Å²	114	130.9 Å²	130.9	61%	0.61	75%	0.752	S	S	*	*			trans	89.7	97.3	160	-59.7	-11.3	0	0	0	121.7
302	Y	27	Very low	30.7	Very low	187 Å²	187	130.1 Å²	130.1	73%	0.733	75%	0.753	S	S	*	*			trans	-31.5	176.9	137.9	30.6	-109.1	0	0	0	117.5
303	P	42.2	Very low	31	Very low	122 Å²	122	128.6 Å²	128.6	79%	0.792	75%	0.752	S	S	*	*			cis	-126.3	-166.9	3.5	13.6	14.7	0	0	0	112.8
304	L	28	Very low	30.8	Very low	150 Å²	150	130 Å²	130	79%	0.785	76%	0.758	S	S	*	*			cis	163.4	148.7	-22.6	-174.1	96	0	0	0	106.9
305	L	31.1	Very low	30.7	Very low	149 Å²	149	132.8 Å²	132.8	78%	0.78	77%	0.772	S	S	*	*			trans	83.6	126.7	162.1	-77.8	170.2	0	0	0	124.1
306	S	26	Very low	30.6	Very low	100 Å²	100	129 Å²	129	70%	0.699	78%	0.777	S	S	*	*			trans	69.2	108.4	131.8	-72.2	0	0	0	0	125.8
307	A	26.6	Very low	30.4	Very low	92 Å²	92	127.6 Å²	127.6	76%	0.76	78%	0.776	S	S	*	*				71.1	111	107.8	0	0	0	0	0	123.3
308	S	28.4	Very low	31.2	Very low	112 Å²	112	130 Å²	130	78%	0.783	78%	0.78	S	S	*	*				96.7	137.6	126.3	-152.9	0	0	0	0	121.9
309	S	29.6	Very low	31	Very low	110 Å²	110	124.8 Å²	124.8	77%	0.769	77%	0.767	S	S	*	*			trans	92.2	137	148	78.3	0	0	0	0	122.3
310	A	30.8	Very low	31	Very low	94 Å²	94	126.9 Å²	126.9	78%	0.777	78%	0.778	S	S	*	*			trans	68.9	116.5	143.7	0	0	0	0	0	123.2
311	F	29.8	Very low	30.2	Very low	195 Å²	195	131.2 Å²	131.2	86%	0.855	79%	0.785	S	S	*	*			trans	-33.7	165.7	135.8	-78.4	-102.7	0	0	0	114.7
312	V	34.2	Very low	31.3	Very low	130 Å²	130	130.9 Å²	130.9	79%	0.788	79%	0.789	S	S	*	*			cis	-138.8	-144.2	28.1	-144.9	0	0	0	0	112.2
313	P	37.6	Very low	31.3	Very low	111 Å²	111	131.2 Å²	131.2	72%	0.721	80%	0.798	S	S	*	*			trans	-117.6	-170.8	-149.8	46.2	-28.6	0	0	0	115.5
314	I	28.1	Very low	30.6	Very low	174 Å²	174	129.2 Å²	129.2	89%	0.892	80%	0.799	S	S	*	*			trans	-129.4	144.2	162.6	-67.1	-177.5	0	0	0	110.3
315	Q	28.8	Very low	30.7	Very low	190 Å²	190	130.6 Å²	130.6	89%	0.888	80%	0.801	S	S	*	*			trans	-104.7	148.4	179.4	-179.8	179.5	13	0	0	110.3
316	G	27.9	Very low	30.7	Very low	79 Å²	79	130.5 Å²	130.5	81%	0.814	80%	0.795	S	S	*	*			trans	-158	116.8	177.6	0	0	0	0	0	113.9
317	D	26.6	Very low	31	Very low	149 Å²	149	130.9 Å²	130.9	80%	0.797	79%	0.789	S	S	*	*			trans	-135.2	166.7	167.5	-155	44.3	0	0	0	104.4
318	P	43.7	Very low	31.2	Very low	117 Å²	117	132.4 Å²	132.4	76%	0.76	79%	0.788	S	S	*	*			cis	-141.2	173.5	17.2	43.6	-25.4	0	0	0	117.9
319	G	25	Very low	31.3	Very low	66 Å²	66	134.5 Å²	134.5	68%	0.68	78%	0.784	S	S	*	*			trans	143.4	134.9	136.2	0	0	0	0	0	119.9
320	A	26.6	Very low	31.2	Very low	113 Å²	113	136.8 Å²	136.8	93%	0.934	78%	0.782	S	S	*	*			trans	79.7	159.9	154.6	0	0	0	0	0	121.2
321	K	28.2	Very low	30.9	Very low	201 Å²	201	135.8 Å²	135.8	87%	0.874	78%	0.781	S	S	*	*			trans	-153.2	175.5	-169	-122.9	-176	-177.8	-178.9	0	106
322	P	50.9	Low	30.7	Very low	107 Å²	107	135 Å²	135	70%	0.695	78%	0.782	S	S	*	*			cis	-137.6	-151	-7.2	35.5	-11.9	0	0	0	113.2
323	E	26.4	Very low	31.2	Very low	195 Å²	195	134.3 Å²	134.3	91%	0.911	78%	0.78	S	S	*	*			trans	100.9	139	158.7	-52.4	-152.7	115.4	0	0	119.7
324	G	27.7	Very low	30.8	Very low	80 Å²	80	134 Å²	134	83%	0.825	78%	0.781	S	S	*	*			trans	152.8	86.4	-178.3	0	0	0	0	0	115.8
325	H	29.9	Very low	31.7	Very low	178 Å²	178	131.4 Å²	131.4	82%	0.824	78%	0.775	S	S	*	*			trans	-73	171	166.9	-90.6	-34.3	0	0	0	111.6
326	K	32.4	Very low	31.7	Very low	147 Å²	147	128.5 Å²	128.5	64%	0.639	77%	0.771	S	S	*	*			cis	-169.1	-179.2	5.3	-123.4	179.7	179.1	-72.2	0	108.4
327	D	31.5	Very low	31.8	Very low	109 Å²	109	132.2 Å²	132.2	58%	0.583	77%	0.767	S	S	*	*			cis	-164.9	166.1	-7.8	-139.3	7.4	0	0	0	109.7
328	V	30.6	Very low	32	Very low	123 Å²	123	132.9 Å²	132.9	75%	0.745	77%	0.765	S	S	*	*			trans	61.7	162.9	145.8	159.7	0	0	0	0	119.4
329	K	31.4	Very low	31.4	Very low	157 Å²	157	134.3 Å²	134.3	68%	0.683	77%	0.766	S	S	*	*			cis	169.9	158.2	-42.3	-119.4	-162.4	176.3	-143.6	0	105.7
330	E	27.6	Very low	31.7	Very low	158 Å²	158	135 Å²	135	74%	0.738	76%	0.761	S	S	*	*			cis	-165.5	166.4	-4.7	-168.9	151.8	-119.4	0	0	108.9
331	G	23.8	Very low	31.9	Very low	73 Å²	73	137.5 Å²	137.5	75%	0.753	76%	0.758	S	S	*	*			trans	178	136.7	172.8	0	0	0	0	0	116.6
332	M	25.8	Very low	32.3	Very low	177 Å²	177	133 Å²	133	87%	0.872	75%	0.752	S	S	*	*			trans	-141.8	172.2	-173.5	-149.6	56.3	93.7	0	0	107.2
333	P	45.2	Very low	31.4	Very low	117 Å²	117	135.7 Å²	135.7	76%	0.76	76%	0.761	S	S	*	*			cis	-138.5	-172.3	8	41.6	-20.6	0	0	0	117.4
334	S	27.9	Very low	31.7	Very low	105 Å²	105	133.4 Å²	133.4	73%	0.734	76%	0.755	S	S	*	*			trans	-79.4	-150.8	172.4	-27.7	0	0	0	0	112.3
335	P	48.8	Very low	31.8	Very low	118 Å²	118	135.8 Å²	135.8	77%	0.766	75%	0.754	S	S	*	*			cis	-145.6	165.7	12.7	44.4	-24.8	0	0	0	120
336	T	27.7	Very low	31.7	Very low	130 Å²	130	132.7 Å²	132.7	80%	0.798	75%	0.752	S	S	*	*			trans	178.6	147	142	34.8	0	0	0	0	107.9
337	E	30.4	Very low	31.6	Very low	156 Å²	156	131.2 Å²	131.2	73%	0.729	76%	0.76	S	S	*	*			cis	-152.7	-179.2	-5.5	-129.3	-176.3	142.4	0	0	112.7
338	Q	29.8	Very low	31.5	Very low	164 Å²	164	134.5 Å²	134.5	77%	0.766	77%	0.772	S	S	*	*			trans	-43.8	175.5	178	-61.5	169.6	62.1	0	0	118.2
339	N	30.8	Very low	31.4	Very low	147 Å²	147	135.4 Å²	135.4	79%	0.786	78%	0.778	S	S	*	*			cis	179.6	178	-37.4	-145.2	2	0	0	0	106.4
340	S	32.4	Very low	31.3	Very low	80 Å²	80	138.9 Å²	138.9	56%	0.559	79%	0.787	S	S	*	*			cis	-162.6	135.1	-2.7	-168.3	0	0	0	0	111.7
341	N	31.5	Very low	31.9	Very low	165 Å²	165	136.8 Å²	136.8	88%	0.882	79%	0.789	S	S	*	*			trans	52.8	171.6	155.2	-77	-8.8	0	0	0	123.3
342	S	36.5	Very low	32.7	Very low	107 Å²	107	139.1 Å²	139.1	75%	0.748	79%	0.791	S	S	*	*			trans	-122.1	167.8	-163.3	55.4	0	0	0	0	114.5
343	N	30.6	Very low	33.6	Very low	163 Å²	163	136.2 Å²	136.2	87%	0.872	79%	0.785	S	S	*	*			trans	-162.3	160	155.7	-108.7	-37.2	0	0	0	112.9
344	N	32.4	Very low	32.8	Very low	148 Å²	148	138.4 Å²	138.4	79%	0.791	79%	0.787	S	S	*	*			trans	-100.7	163.3	-173.3	-63	-54.1	0	0	0	113.6
345	T	29.7	Very low	32.9	Very low	130 Å²	130	138.3 Å²	138.3	80%	0.798	78%	0.779	S	S	*	*				162.4	152.4	111.9	-65.7	0	0	0	0	112.7
346	S	28.6	Very low	31.9	Very low	112 Å²	112	140 Å²	140	78%	0.783	77%	0.774	S	S	*	*			trans	76.1	136.9	173.7	77.2	0	0	0	0	116.2
347	S	30.9	Very low	31.8	Very low	116 Å²	116	141.5 Å²	141.5	81%	0.811	77%	0.772	S	S	*	*			cis	-148	175.7	-5.6	47.6	0	0	0	0	112.5
348	E	29.4	Very low	31.6	Very low	179 Å²	179	141 Å²	141	84%	0.836	77%	0.774	S	S	*	*			trans	-61.4	166.8	-172.3	-59.8	161	100.9	0	0	113.8
349	T	28.7	Very low	31.5	Very low	141 Å²	141	140.5 Å²	140.5	87%	0.865	77%	0.772	S	S	*	*			cis	-145.7	163.9	27.6	-50.7	0	0	0	0	113.2
350	R	28.9	Very low	31.8	Very low	231 Å²	231	139 Å²	139	87%	0.872	77%	0.77	S	S	*	*			trans	-103.1	137.5	-170.5	179.7	-170	-161.7	166.2	5.8	113.4
351	S	39.1	Very low	31.8	Very low	114 Å²	114	143.4 Å²	143.4	80%	0.797	78%	0.782	S	S	*	*			trans	-93.4	149.1	168.7	-46.1	0	0	0	0	113
352	P	40.5	Very low	31.5	Very low	121 Å²	121	143.7 Å²	143.7	79%	0.786	78%	0.783	S	S	*	*			trans	-127	163.9	157.7	37.7	-25.6	0	0	0	114.1
353	P	46.5	Very low	31.3	Very low	116 Å²	116	146.3 Å²	146.3	75%	0.753	79%	0.788	S	S	*	*			trans	-125.9	177.3	-171.3	42.2	-28.5	0	0	0	117.1
354	M	28.5	Very low	31.1	Very low	163 Å²	163	144 Å²	144	80%	0.803	79%	0.785	S	S	*	*			trans	75.3	153.5	169.2	-48.9	-167.5	72.6	0	0	116.4
355	D	28.4	Very low	30.9	Very low	103 Å²	103	142.1 Å²	142.1	55%	0.551	78%	0.783	S	S	*	*			cis	-153.8	163.2	6.8	-151.1	3.4	0	0	0	114.2
356	K	29.4	Very low	31.1	Very low	155 Å²	155	141.5 Å²	141.5	67%	0.674	78%	0.781	S	S	*	*			trans	39.4	131.4	159.1	-70.5	173.5	-172.6	88.9	0	123.6
357	H	25.3	Very low	31.1	Very low	160 Å²	160	144.9 Å²	144.9	74%	0.741	78%	0.784	S	S	*	*				-171.7	140.8	100.5	-112.2	-87.4	0	0	0	114.5
358	D	26.3	Very low	31.2	Very low	145 Å²	145	147.4 Å²	147.4	78%	0.775	78%	0.783	S	S	*	*			trans	45.8	150.8	154.5	-56.3	-25.1	0	0	0	126.8
359	E	27.9	Very low	31.4	Very low	155 Å²	155	146 Å²	146	72%	0.724	78%	0.781	S	S	*	*			trans	-77.5	171.3	176	-95.1	-84.6	114.4	0	0	113	E361	E359-E361 PolarHBondContact OE2-N 2.76Å
360	P	35.3	Very low	31.7	Very low	115 Å²	115	144.2 Å²	144.2	75%	0.747	77%	0.766	S	S	*	*			cis	-143.3	176	39.2	42.5	-22.2	0	0	0	120.2
361	E	33.4	Very low	32.4	Very low	173 Å²	173	140.1 Å²	140.1	81%	0.808	76%	0.761	S	S	*	*			trans	-36.4	144.5	172.4	-51.2	-178.5	104.8	0	0	117.9	E359	E359-E361 PolarHBondContact OE2-N 2.76Å
362	D	25.8	Very low	32.5	Very low	171 Å²	171	143.5 Å²	143.5	91%	0.914	76%	0.764	S	S	*	*			trans	-150.5	161.5	142.7	-147.7	-19.7	0	0	0	111.4
363	L	31.8	Very low	32.6	Very low	161 Å²	161	141.5 Å²	141.5	84%	0.843	75%	0.752	S	S	*	*			trans	-122.6	119.6	-153	-177.5	78.3	0	0	0	114.4
364	S	26.7	Very low	32.3	Very low	116 Å²	116	139 Å²	139	81%	0.811	75%	0.747	S	S	*	*			trans	-161.4	130.7	158.8	42.9	0	0	0	0	117.8
365	S	27.3	Very low	32.7	Very low	108 Å²	108	136.2 Å²	136.2	76%	0.755	74%	0.744	S	S	*	*			trans	35.8	133.1	152.3	-154.3	0	0	0	0	123.1
366	P	35.5	Very low	32.8	Very low	116 Å²	116	136 Å²	136	75%	0.753	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-75.8	152.9	163.2	33.9	-34.4	0	0	0	112.4
367	H	27.7	Very low	33.1	Very low	184 Å²	184	136.9 Å²	136.9	85%	0.852	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-74.2	146.2	173.5	-87.2	-104	0	0	0	112.8
368	H	32.6	Very low	33.3	Very low	168 Å²	168	138.3 Å²	138.3	78%	0.778	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-93.5	117.4	164.7	-111.3	-115.9	0	0	0	109.5	D370	H368-D370 PolarHBondContact O-N 2.91Å; H368-D370 VanDerWaalsContact O-N 3.17Å
369	D	34.8	Very low	33.7	Very low	149 Å²	149	137.5 Å²	137.5	80%	0.797	76%	0.76	S	S	*	*			trans	-79.3	88	168.1	-81.2	-48.9	0	0	0	110	L371	D369-L371 HydrophobicContact CB-CD1 4.49Å; D369-L371 PolarHBondContact O-N 3.23Å
370	D	35.1	Very low	33.9	Very low	105 Å²	105	136.4 Å²	136.4	56%	0.561	76%	0.764	S	S	*	*			trans	-74	88.7	172.9	-102.4	-60.6	0	0	0	111.1	R116 H368 E372	R116-D370 IonicContact CZ-OD1 3.25Å; R116-D370 IonicContact NH2-OD1 3.76Å; R116-D370 PolarHBondContact NH2-OD1 3.05Å; H368-D370 PolarHBondContact O-N 2.91Å; H368-D370 VanDerWaalsContact O-N 3.17Å; D370-E372 PolarHBondContact O-N 3.43Å
371	L	42.2	Very low	33.7	Very low	144 Å²	144	138.6 Å²	138.6	75%	0.754	77%	0.769	S	S	*	*			trans	-66	102.2	163.8	-95.3	74.7	0	0	0	109.7	D369 C373	D369-L371 HydrophobicContact CB-CD1 4.49Å; D369-L371 PolarHBondContact O-N 3.23Å; L371-C373 PolarHBondContact O-N 3.23Å; L371-C373 VanDerWaalsContact O-N 3.15Å
372	E	41	Very low	33.6	Very low	186 Å²	186	135.9 Å²	135.9	87%	0.869	77%	0.766	S	S	*	*			trans	-56.3	116.4	163.2	-71.9	-166.1	98.1	0	0	110	D370 G374	D370-E372 PolarHBondContact O-N 3.43Å; E372-G374 PolarHBondContact O-N 3.33Å
373	C	43.9	Very low	33.9	Very low	78 Å²	78	134.2 Å²	134.2	53%	0.527	76%	0.762	S	S	.	*			trans	-80.5	78	171.1	-169.3	0	0	0	0	109.7	C109 L371 S375	C109-C373 HydrophobicContact CB-CB 3.92Å; C109-C373 WeakPolarHBondContact CB-SG 3.36Å; C109-C373 WeakPolarHBondContact SG-CB 3.5Å; C109-C373 CovalentContact SG-SG 2.03Å; C109-C373 PolarHBondContact SG-SG 3.27Å; L371-C373 PolarHBondContact O-N 3.23Å; L371-C373 VanDerWaalsContact O-N 3.15Å; C373-S375 PolarHBondContact O-N 3.38Å
374	G	39.4	Very low	33.9	Very low	63 Å²	63	131 Å²	131	65%	0.649	76%	0.758	S	S	*	*			trans	-53.1	125.9	178.3	0	0	0	0	0	112.2	E372 S376	E372-G374 PolarHBondContact O-N 3.33Å; G374-S376 PolarHBondContact O-N 3.08Å; G374-S376 VanDerWaalsContact O-N 3.13Å
375	S	37.2	Very low	34	Very low	106 Å²	106	132.8 Å²	132.8	74%	0.741	76%	0.759	S	S	*	*			trans	-69.7	103.8	179.7	47.6	0	0	0	0	111.1	C373 E377	C373-S375 PolarHBondContact O-N 3.38Å; S375-E377 VanDerWaalsContact C-N 3.31Å; S375-E377 PolarHBondContact O-N 2.67Å
376	S	30.8	Very low	34.1	Very low	98 Å²	98	134 Å²	134	69%	0.685	76%	0.762	S	S	*	*			trans	-75.7	77.2	176.5	179.8	0	0	0	0	111.6	G374	G374-S376 PolarHBondContact O-N 3.08Å; G374-S376 VanDerWaalsContact O-N 3.13Å
377	E	35.3	Very low	33.8	Very low	174 Å²	174	134.3 Å²	134.3	81%	0.813	77%	0.767	S	S	*	*			trans	-64.4	140.9	162.7	-67.8	-169.9	104.7	0	0	110.7	S375	S375-E377 VanDerWaalsContact C-N 3.31Å; S375-E377 PolarHBondContact O-N 2.67Å
378	Y	30	Very low	33.9	Very low	189 Å²	189	130.9 Å²	130.9	74%	0.741	76%	0.764	S	S	*	*			trans	-96.4	138.3	169.2	-86.2	-101.9	0	0	0	109.2	T380	Y378-T380 PolarHBondContact O-N 3.09Å; Y378-T380 VanDerWaalsContact O-N 3.15Å
379	P	33.8	Very low	33.6	Very low	128 Å²	128	128.1 Å²	128.1	83%	0.831	76%	0.763	S	S	*	*			trans	-67.4	115.8	-176.2	27.1	-34.3	0	0	0	111.1
380	T	33.1	Very low	33.2	Very low	133 Å²	133	126.9 Å²	126.9	82%	0.816	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-95.1	133.5	164.4	-57.5	0	0	0	0	108.1	Y378	Y378-T380 PolarHBondContact O-N 3.09Å; Y378-T380 VanDerWaalsContact O-N 3.15Å
381	L	29.9	Very low	32.8	Very low	160 Å²	160	127.6 Å²	127.6	84%	0.838	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-65.4	144.5	179.6	-77.6	167.1	0	0	0	111.2
382	P	32.5	Very low	32.2	Very low	116 Å²	116	127.8 Å²	127.8	75%	0.753	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-75.1	142.6	-167.2	29.7	-35.9	0	0	0	113.1
383	V	31	Very low	31.5	Very low	137 Å²	137	124.5 Å²	124.5	83%	0.83	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-90.4	136.8	154.7	177.6	0	0	0	0	107.1
384	A	32.6	Very low	30.6	Very low	93 Å²	93	124.2 Å²	124.2	77%	0.769	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-87.3	120.4	178.4	0	0	0	0	0	111
385	D	27.7	Very low	30.2	Very low	153 Å²	153	129.3 Å²	129.3	82%	0.818	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-81.3	140	163.8	-80.5	-41.7	0	0	0	110.5
386	T	29.8	Very low	29.8	Very low	133 Å²	133	128.5 Å²	128.5	82%	0.816	79%	0.788	S	S	*	*			trans	-160	144.2	143.9	-9.9	0	0	0	0	114
387	S	29.6	Very low	29.7	Very low	123 Å²	123	135.4 Å²	135.4	86%	0.86	80%	0.8	S	S	*	*			trans	79	146.9	165	79.1	0	0	0	0	118.3
388	S	29.2	Very low	29.5	Very low	113 Å²	113	136.7 Å²	136.7	79%	0.79	80%	0.802	S	S	*	*			trans	-141.2	151	-165.7	52.3	0	0	0	0	110.2
389	S	26.3	Very low	29.5	Very low	110 Å²	110	134.8 Å²	134.8	77%	0.769	81%	0.81	S	S	*	*			trans	179.1	130.2	147.1	35.5	0	0	0	0	114.4
390	T	26.7	Very low	29.2	Very low	122 Å²	122	139.3 Å²	139.3	75%	0.748	81%	0.811	S	S	*	*			trans	45.6	137.2	140.6	55.1	0	0	0	0	124.8
391	T	28	Very low	29	Very low	121 Å²	121	143 Å²	143	74%	0.742	81%	0.81	S	S	*	*			trans	88.1	125	137.5	45.5	0	0	0	0	123.8
392	L	27.9	Very low	28.8	Very low	147 Å²	147	143.1 Å²	143.1	77%	0.77	81%	0.811	S	S	*	*			trans	61.2	117.5	146.9	-86.5	81.6	0	0	0	123
393	S	26.7	Very low	28.7	Very low	118 Å²	118	142.9 Å²	142.9	83%	0.825	81%	0.811	S	S	*	*				54.4	122.7	122.7	-55.3	0	0	0	0	122
394	G	25.9	Very low	29.4	Very low	71 Å²	71	141.1 Å²	141.1	73%	0.732	80%	0.803	S	S	*	*			trans	166	90.3	152	0	0	0	0	0	119.9
395	I	30.2	Very low	29.6	Very low	170 Å²	170	142.9 Å²	142.9	87%	0.872	81%	0.807	S	S	*	*			trans	44.1	87.7	134.9	-51	178.5	0	0	0	119
396	A	28.3	Very low	29.7	Very low	89 Å²	89	146.4 Å²	146.4	74%	0.736	81%	0.808	S	S	*	*				71.6	158	118.5	0	0	0	0	0	124.5
397	R	29.9	Very low	29.4	Very low	244 Å²	244	146.9 Å²	146.9	92%	0.921	81%	0.806	S	S	*	*			trans	94.5	107.3	161.3	-59.3	-173	-179.6	174.8	2.7	119
398	K	30.5	Very low	29.1	Very low	201 Å²	201	147 Å²	147	87%	0.874	81%	0.805	S	S	*	*			trans	-54.8	149	157.3	-57.9	163.9	176.4	169.1	0	111.3
399	T	30	Very low	29	Very low	148 Å²	148	146.8 Å²	146.8	91%	0.908	80%	0.804	S	S	*	*				-159.3	170.2	115.7	6.4	0	0	0	0	114.6
400	R	28.4	Very low	29	Very low	223 Å²	223	147.7 Å²	147.7	84%	0.842	81%	0.805	S	S	*	*			trans	-80.2	134.1	-158.2	-70.8	170.9	175.9	170.9	-1.8	115.4
401	R	28	Very low	29.1	Very low	212 Å²	212	148.5 Å²	148.5	80%	0.8	81%	0.81	S	S	*	*				38.8	116.6	115.3	-177.2	-134.8	-64.3	-109.7	2	118.2
402	L	26.1	Very low	29.2	Very low	162 Å²	162	147.6 Å²	147.6	85%	0.848	80%	0.804	S	S	*	*				-171.9	170.3	117.3	-98.7	166.4	0	0	0	111.3
403	S	29.2	Very low	29.2	Very low	110 Å²	110	149.8 Å²	149.8	77%	0.769	81%	0.81	S	S	*	*			trans	-122	-171.9	-169.6	-42.8	0	0	0	0	111.9
404	P	46.3	Very low	29.3	Very low	101 Å²	101	147.4 Å²	147.4	66%	0.656	80%	0.804	S	S	*	*				-99.8	-173.1	-120.3	41.8	-29	0	0	0	114.3
405	P	37.8	Very low	29.3	Very low	130 Å²	130	151.6 Å²	151.6	84%	0.844	81%	0.81	S	S	*	*				-132.3	-174.2	110.2	39.1	-31	0	0	0	114.5
406	W	28.4	Very low	29.2	Very low	226 Å²	226	148.4 Å²	148.4	86%	0.856	80%	0.801	S	S	*	*			trans	-96	170.2	-162.7	-89.3	25.5	0	0	0	116.4
407	N	24.8	Very low	29.4	Very low	143 Å²	143	149.4 Å²	149.4	77%	0.765	80%	0.803	S	S	*	*			trans	83.7	114.8	155.6	-68.3	-9.4	0	0	0	119.4
408	C	23.2	Very low	29.3	Very low	125 Å²	125	144.7 Å²	144.7	85%	0.845	80%	0.796	S	S	*	*			trans	-79.1	152	168.7	-48.6	0	0	0	0	112.1
409	S	25.9	Very low	29.2	Very low	110 Å²	110	140.8 Å²	140.8	77%	0.769	79%	0.794	S	S	*	*			trans	-167	166	138.1	-85.9	0	0	0	0	111.2
410	T	26.8	Very low	29.2	Very low	129 Å²	129	137 Å²	137	79%	0.791	78%	0.784	S	S	*	*			trans	71.6	109.2	174.2	68.1	0	0	0	0	118
411	V	28.8	Very low	29.2	Very low	139 Å²	139	133.5 Å²	133.5	84%	0.842	78%	0.783	S	S	*	*				-172.1	126.8	122.4	157.6	0	0	0	0	103.8
412	V	30.4	Very low	29.4	Very low	101 Å²	101	129.3 Å²	129.3	61%	0.612	79%	0.786	S	S	*	*			cis	101.7	106.1	20.4	-178.7	0	0	0	0	113.8
413	E	28	Very low	29.5	Very low	194 Å²	194	131.6 Å²	131.6	91%	0.907	79%	0.785	S	S	*	*			trans	72.4	154.9	154	-68.4	171.7	141	0	0	122.7
414	G	28	Very low	29.5	Very low	68 Å²	68	135.7 Å²	135.7	70%	0.701	79%	0.791	S	S	*	*			trans	110.3	85	-177.9	0	0	0	0	0	113.4
415	N	27.2	Very low	28.7	Very low	158 Å²	158	133.9 Å²	133.9	85%	0.845	79%	0.791	S	S	*	*				53.8	135.9	70.4	-72	-1.8	0	0	0	114.5
416	C	26.8	Very low	28.3	Very low	103 Å²	103	135.9 Å²	135.9	70%	0.696	80%	0.795	S	S	*	*			cis	-162.5	158.6	3.7	-130.5	0	0	0	0	112.5
417	S	32.2	Very low	28.3	Very low	110 Å²	110	130.1 Å²	130.1	77%	0.769	79%	0.789	S	S	*	*			trans	61	166.6	151.8	-63.9	0	0	0	0	120.9
418	D	27.9	Very low	28.7	Very low	146 Å²	146	128.8 Å²	128.8	78%	0.781	79%	0.791	S	S	*	*			cis	-168.6	174.9	-43.4	-153.2	-18.3	0	0	0	108.7
419	S	30.1	Very low	29.1	Very low	118 Å²	118	130.4 Å²	130.4	83%	0.825	79%	0.788	S	S	*	*			trans	80.2	147.9	179	-29.6	0	0	0	0	116.2
420	G	28.4	Very low	29.2	Very low	69 Å²	69	133.7 Å²	133.7	71%	0.711	79%	0.788	S	S	*	*			cis	175	141	-8.3	0	0	0	0	0	113.6
421	D	29	Very low	29.3	Very low	150 Å²	150	134.5 Å²	134.5	80%	0.802	79%	0.787	S	S	*	*			trans	44.6	125	161.9	-61.5	-20.6	0	0	0	124.1
422	S	32.8	Very low	29.3	Very low	124 Å²	124	139.9 Å²	139.9	87%	0.867	79%	0.792	S	S	*	*				-168.3	158.4	130	19.6	0	0	0	0	111.9
423	Y	27.3	Very low	29.2	Very low	210 Å²	210	139.8 Å²	139.8	82%	0.824	80%	0.796	S	S	*	*			trans	-115.6	168.3	-165.5	-88.1	-96.8	0	0	0	115.1
424	H	30.3	Very low	29.2	Very low	195 Å²	195	136 Å²	136	90%	0.903	79%	0.791	S	S	*	*			trans	98.6	132.5	177.5	-69.6	-93.5	0	0	0	115.9
425	G	28.4	Very low	29.2	Very low	64 Å²	64	139.2 Å²	139.2	66%	0.66	80%	0.801	S	S	*	*			cis	164	131.9	-11.9	0	0	0	0	0	113.8
426	N	29.5	Very low	29.4	Very low	172 Å²	172	136.5 Å²	136.5	92%	0.92	80%	0.801	S	S	*	*			trans	61.8	150.1	-178.7	-76.6	-10.7	0	0	0	116.2
427	S	29.6	Very low	29.7	Very low	105 Å²	105	135.1 Å²	135.1	73%	0.734	80%	0.804	S	S	*	*			cis	-155.8	132.5	-16.8	178.9	0	0	0	0	107.1
428	S	31.5	Very low	30.4	Very low	114 Å²	114	136.4 Å²	136.4	80%	0.797	81%	0.81	S	S	*	*				179.3	159.8	93.7	42.8	0	0	0	0	112.4
429	M	31.6	Very low	30.5	Very low	159 Å²	159	141.4 Å²	141.4	78%	0.783	82%	0.817	S	S	*	*			trans	-104.8	164.8	170.8	-83.7	-163.4	177	0	0	109.9
430	K	28.8	Very low	30.6	Very low	179 Å²	179	140.5 Å²	140.5	78%	0.778	82%	0.817	S	S	*	*			cis	-152.9	153.9	10.4	-141.2	157.8	-173.6	154.6	0	112.5
431	L	28.7	Very low	30.7	Very low	146 Å²	146	148.8 Å²	148.8	76%	0.764	83%	0.827	S	S	*	*			trans	-78.6	150.4	166.7	-176.5	73.2	0	0	0	111.7
432	R	28.7	Very low	30.7	Very low	252 Å²	252	149.4 Å²	149.4	95%	0.951	83%	0.829	S	S	*	*			trans	-147.9	136.6	139.8	-121.2	179.3	-172.9	-166.6	1.1	111.9
433	S	28.4	Very low	30.6	Very low	100 Å²	100	149.5 Å²	149.5	70%	0.699	82%	0.824	S	S	*	*			trans	-128.9	160.6	178.8	57.3	0	0	0	0	110.2
434	S	28.9	Very low	30.6	Very low	113 Å²	113	145.5 Å²	145.5	79%	0.79	83%	0.826	S	S	*	*			trans	-166.3	128.3	140.9	-168.7	0	0	0	0	110
435	C	27.5	Very low	30.6	Very low	136 Å²	136	145.3 Å²	145.3	92%	0.919	82%	0.823	S	S	*	*			trans	-131.3	134.3	167.8	-71.1	0	0	0	0	108.1
436	A	32	Very low	30.7	Very low	102 Å²	102	147.3 Å²	147.3	84%	0.843	83%	0.827	S	S	*	*			trans	-119.4	142	177.3	0	0	0	0	0	110.6
437	G	31.3	Very low	30.6	Very low	73 Å²	73	146.2 Å²	146.2	75%	0.753	82%	0.821	S	S	*	*			trans	-83.6	168.1	-170.8	0	0	0	0	0	115.8
438	P	47.9	Very low	30.7	Very low	138 Å²	138	145.8 Å²	145.8	90%	0.896	82%	0.818	S	S	*	*			trans	-89.2	168.9	-173.5	36.8	-37.1	0	0	0	113.8
439	R	30.6	Very low	30.5	Very low	250 Å²	250	150.4 Å²	150.4	94%	0.943	82%	0.824	S	S	*	*			trans	-142.7	124.5	168.2	-140.4	175.8	-168.2	-178.2	4.4	111.4
440	A	31.6	Very low	30.5	Very low	99 Å²	99	154.3 Å²	154.3	82%	0.818	83%	0.83	S	S	*	*			trans	-90.4	165.7	176.5	0	0	0	0	0	112.2
441	R	29.6	Very low	31.3	Very low	243 Å²	243	151 Å²	151	92%	0.917	83%	0.826	S	S	*	*			trans	-149.3	145.3	167.5	-167.3	174.4	-74.4	-173.8	-3.5	110.6
442	I	29.6	Very low	31.4	Very low	164 Å²	164	149.4 Å²	149.4	84%	0.841	83%	0.827	S	S	*	*			trans	-113.2	159.2	-175.4	-70.1	174.8	0	0	0	110.7
443	V	31.9	Very low	31.5	Very low	126 Å²	126	148.2 Å²	148.2	76%	0.764	82%	0.823	S	S	*	*			trans	-69.9	151.8	-176.7	173.1	0	0	0	0	113.8
444	S	25.8	Very low	31.4	Very low	125 Å²	125	147.5 Å²	147.5	87%	0.874	82%	0.818	S	S	*	*			trans	-150.7	172.5	156.1	-79.2	0	0	0	0	110.3
445	K	31.1	Very low	31.5	Very low	192 Å²	192	151.4 Å²	151.4	84%	0.835	82%	0.824	S	S	*	*			trans	-139.2	156.1	-145.8	-157.3	-178.8	-173.3	-176.5	0	114.3
446	S	29.5	Very low	31.8	Very low	106 Å²	106	150.3 Å²	150.3	74%	0.741	82%	0.817	S	S	*	*			trans	67	154	169.6	18.4	0	0	0	0	116
447	D	28.3	Very low	32.9	Very low	148 Å²	148	150.4 Å²	150.4	79%	0.791	81%	0.809	S	S	*	*			cis	-143.7	-150.8	27.1	-149.6	-35.4	0	0	0	114.3
448	S	32	Very low	33	Very low	96 Å²	96	153.5 Å²	153.5	67%	0.671	81%	0.809	S	S	*	*			trans	-129.5	162.8	-147.8	-46.4	0	0	0	0	117.3
449	K	27.3	Very low	32.3	Very low	212 Å²	212	151.6 Å²	151.6	92%	0.922	80%	0.799	S	S	*	*			trans	113.9	146.3	154.4	-65.3	177.4	177.4	172.9	0	119.4
450	R	30.6	Very low	32.5	Very low	241 Å²	241	146.3 Å²	146.3	91%	0.909	79%	0.794	S	S	*	*			trans	-94.8	-176.9	172.2	-106.9	-176.4	-177.2	-178.2	2.4	109.7
451	P	46.8	Very low	32.5	Very low	108 Å²	108	145.4 Å²	145.4	70%	0.701	79%	0.794	S	S	*	*			cis	-147.9	-175.6	23.4	44	-23.6	0	0	0	119.4
452	S	30.7	Very low	32.7	Very low	114 Å²	114	142.2 Å²	142.2	80%	0.797	79%	0.79	S	S	*	*			trans	76.6	156.8	152.2	85.3	0	0	0	0	118.8
453	R	29.7	Very low	32.9	Very low	226 Å²	226	143 Å²	143	85%	0.853	79%	0.794	S	S	*	*			cis	-155.1	146.1	-6	-151	-164.5	166.4	152.1	-3.5	112.5
454	S	26.5	Very low	33	Very low	86 Å²	86	142 Å²	142	60%	0.601	79%	0.794	S	S	*	*			trans	13.9	136.3	154	62	0	0	0	0	124.4
455	Q	30.6	Very low	33.3	Very low	195 Å²	195	141.3 Å²	141.3	91%	0.911	79%	0.788	S	S	*	*				-160.7	162.9	125.9	-111.4	172.7	49.2	0	0	113.1
456	S	33.9	Very low	33.4	Very low	112 Å²	112	137.7 Å²	137.7	78%	0.783	79%	0.787	S	S	*	*			trans	-162.1	-179.5	-176.9	-49.4	0	0	0	0	107.6
457	P	56.9	Low	34.6	Very low	104 Å²	104	138.9 Å²	138.9	68%	0.675	79%	0.792	S	S	*	*			cis	-133.9	-177.1	-1.1	43.9	-26.9	0	0	0	114.9
458	D	31.4	Very low	35.1	Very low	139 Å²	139	139.6 Å²	139.6	74%	0.743	80%	0.796	S	S	*	*				169.6	125.8	124.3	-94.3	-33.1	0	0	0	110.3
459	S	35.2	Very low	35.3	Very low	97 Å²	97	147.1 Å²	147.1	68%	0.678	81%	0.81	S	S	*	*				86.6	125.1	64.1	-63.3	0	0	0	0	111.7
460	V	34.1	Very low	35.8	Very low	140 Å²	140	148.3 Å²	148.3	85%	0.848	81%	0.809	S	S	*	*			cis	-148	157.4	3.7	-171.2	0	0	0	0	109.6
461	G	31	Very low	36	Very low	79 Å²	79	143 Å²	143	81%	0.814	80%	0.802	S	S	*	*			trans	174.9	105.1	164.9	0	0	0	0	0	115.6
462	E	34	Very low	35.4	Very low	177 Å²	177	142.8 Å²	142.8	83%	0.827	80%	0.804	S	S	*	*			trans	-105.4	150.5	-178.4	-67.5	-170.7	93	0	0	114.2
463	L	34.4	Very low	35.6	Very low	179 Å²	179	141.8 Å²	141.8	94%	0.937	80%	0.803	S	S	*	*				-168.4	161.4	116.4	-103.8	160.7	0	0	0	111.3
464	S	34.4	Very low	35.8	Very low	107 Å²	107	135.6 Å²	135.6	75%	0.748	80%	0.799	S	S	*	*			trans	-140.3	150.2	-161.3	178.4	0	0	0	0	112.9
465	S	30.8	Very low	36.3	Very low	109 Å²	109	136.3 Å²	136.3	76%	0.762	81%	0.805	S	S	*	*			trans	-175.3	153	136.6	45.1	0	0	0	0	114.2
466	S	32.6	Very low	36.5	Very low	117 Å²	117	132.6 Å²	132.6	82%	0.818	80%	0.8	S	S	*	*			trans	-151.5	156.7	158.9	-70.1	0	0	0	0	107
467	P	55.1	Low	36.4	Very low	130 Å²	130	131.3 Å²	131.3	84%	0.844	81%	0.805	S	S	*	*			trans	-142.8	150.5	136.6	34.9	-20.6	0	0	0	115
468	N	39.8	Very low	35.5	Very low	164 Å²	164	132.3 Å²	132.3	88%	0.877	81%	0.814	S	S	*	*			trans	-77	157.3	166.9	-88.7	-52.7	0	0	0	112.2
469	R	35.4	Very low	35.7	Very low	253 Å²	253	131.6 Å²	131.6	96%	0.955	82%	0.82	S	S	*	*			trans	-139.7	161.1	150.9	-112.7	-175.7	-176.4	-163.3	1.3	111.8
470	R	37.4	Very low	36	Very low	238 Å²	238	137.9 Å²	137.9	90%	0.898	83%	0.829	S	S	*	*			trans	-143.1	174.8	-171.3	-172.7	-169.5	-102	-164.2	-4	107.7
471	V	34.5	Very low	36.1	Very low	128 Å²	128	143.3 Å²	143.3	78%	0.776	83%	0.834	S	S	*	*			trans	87	133.5	169.2	-179.2	0	0	0	0	113.9
472	S	34.1	Very low	36.7	Very low	104 Å²	104	143.8 Å²	143.8	73%	0.727	83%	0.83	S	S	*	*			cis	-167.4	151.6	-17.5	-99.3	0	0	0	0	113.7
473	A	35.1	Very low	37.8	Very low	94 Å²	94	141 Å²	141	78%	0.777	83%	0.827	S	S	*	*			trans	62	145.7	135.6	0	0	0	0	0	125.2
474	A	33.8	Very low	38.3	Very low	95 Å²	95	139.1 Å²	139.1	79%	0.785	82%	0.824	S	S	*	*			trans	69.3	146.3	150.3	0	0	0	0	0	119.8
475	S	36.8	Very low	38.8	Very low	102 Å²	102	141.2 Å²	141.2	71%	0.713	83%	0.827	S	S	*	*			cis	-166.3	162.3	-16.8	51.9	0	0	0	0	112.7
476	S	35.7	Very low	39.4	Very low	117 Å²	117	144.1 Å²	144.1	82%	0.818	83%	0.832	S	S	*	*			trans	57.1	125.1	146.7	59.3	0	0	0	0	121.5
477	G	32.9	Very low	40	Very low	85 Å²	85	146.8 Å²	146.8	88%	0.876	83%	0.832	S	S	*	*			trans	175	89.9	163.1	0	0	0	0	0	114
478	S	38	Very low	39.6	Very low	125 Å²	125	152.1 Å²	152.1	87%	0.874	85%	0.851	S	S	*	*			trans	-131.2	120.2	178.7	164.2	0	0	0	0	111.7
479	S	33.9	Very low	39.6	Very low	123 Å²	123	151.6 Å²	151.6	86%	0.86	85%	0.85	S	S	*	*			trans	-159.3	168.5	152.2	-159.8	0	0	0	0	111.7
480	R	41.8	Very low	39.8	Very low	229 Å²	229	146.2 Å²	146.2	86%	0.864	84%	0.844	S	S	*	*			trans	-103.3	151.8	-173	-50.7	171	-177.9	-177.8	-1.4	111.2
481	R	36	Very low	40	Very low	254 Å²	254	141.1 Å²	141.1	96%	0.958	84%	0.841	S	S	*	*			trans	-175.5	155.5	132.3	-102.7	163.7	-160.6	174.9	6	112.7
482	A	44.7	Very low	40.3	Very low	89 Å²	89	141.9 Å²	141.9	74%	0.736	85%	0.845	S	S	*	*			trans	-153.9	179.4	164.3	0	0	0	0	0	105.8
483	P	57	Low	40.7	Very low	118 Å²	118	144.3 Å²	144.3	77%	0.766	85%	0.853	S	S	*	*			cis	-121	-178.4	-18.7	40.9	-28.1	0	0	0	111.8
484	T	44	Very low	41.1	Very low	141 Å²	141	147.6 Å²	147.6	87%	0.865	86%	0.858	S	S	*	*			trans	-157	130.8	153.7	37.8	0	0	0	0	110.5
485	D	44.6	Very low	41.6	Very low	151 Å²	151	151.4 Å²	151.4	81%	0.807	86%	0.863	S	S	*	*			trans	-72.9	154.1	159.3	-60.1	-79.4	0	0	0	111.1
486	L	45.2	Very low	41.9	Very low	169 Å²	169	155.2 Å²	155.2	89%	0.885	87%	0.874	S	S	*	*				-159.7	160.3	126.5	-136.7	76.6	0	0	0	111.8
487	Q	44.2	Very low	42.5	Very low	173 Å²	173	158.3 Å²	158.3	81%	0.808	88%	0.879	S	S	*	*			trans	-85.4	151	-179.4	-55.9	158.2	-74.5	0	0	112
488	I	47.3	Very low	43.3	Very low	243 Å²	243	165 Å²	165	100%	1.246	88%	0.879	S	S	*	*				-133.4	0	129	-61	-173	0	0	0	106.3

Retrieved 488 of 488 residues in 717 ms (Link to these results)

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