A0A077Z119_TRITR Loading...

V-type proton ATPase subunit H

Subunit of the V1 complex of vacuolar(H+)-ATPase (V-ATPase), a multisubunit enzyme composed of a peripheral complex (V1) that hydrolyzes ATP and a membrane integral complex (V0) that translocates protons. V-ATPase is responsible for acidifying and maintaining the pH of intracellular compartments and in some cell types, is targeted to the plasma membrane, where it is responsible for acidifying the extracellular environment. Subunit H is essential for V-ATPase activity, but not for the assembly of the complex.

AlphaFold DB , UniProt , Accession A0A077Z119, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 503 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.8	Very low	32.7	Very low	242 Å²	242	161.1 Å²	161.1	100%	1.192	86%	0.856	S	S	*	*				0	100.9	0	-73.5	168.9	80.5	0	0	106.6	E3	M1-E3 PolarHBondContact O-N 3.37Å
2	S	35	Very low	32.9	Very low	121 Å²	121	164.4 Å²	164.4	85%	0.846	86%	0.857	S	S	*	*			trans	-71.3	114.3	176.4	40.4	0	0	0	0	108.9
3	E	34.6	Very low	32.8	Very low	177 Å²	177	160.3 Å²	160.3	83%	0.827	84%	0.844	S	S	*	*			trans	-54.1	143.8	168.9	-79.5	177.1	154.3	0	0	110.7	M1 K5	M1-E3 PolarHBondContact O-N 3.37Å; E3-K5 PolarHBondContact O-N 3.37Å; E3-K5 VanDerWaalsContact O-N 3.13Å
4	P	36.1	Very low	33.3	Very low	122 Å²	122	156.2 Å²	156.2	79%	0.792	83%	0.831	S	S	*	*			trans	-68.7	116.2	-176.4	27.8	-30.4	0	0	0	109	L6	P4-L6 PolarHBondContact O-N 3.38Å
5	K	30.1	Very low	34.3	Very low	200 Å²	200	148.3 Å²	148.3	87%	0.87	79%	0.789	S	S	*	*			trans	-52.8	111.8	167.7	-72	179.6	174.7	-179.6	0	108.1	E3 K7	E3-K5 PolarHBondContact O-N 3.37Å; E3-K5 VanDerWaalsContact O-N 3.13Å; K5-K7 PolarHBondContact O-N 3.36Å
6	L	32.4	Very low	35.5	Very low	171 Å²	171	146.5 Å²	146.5	90%	0.895	77%	0.774	S	S	*	*			trans	-47	118.7	163.4	-115.1	84	0	0	0	107	P4 S8	P4-L6 PolarHBondContact O-N 3.38Å; L6-S8 PolarHBondContact O-N 2.84Å; L6-S8 VanDerWaalsContact O-N 3.16Å
7	K	31.2	Very low	36.7	Very low	203 Å²	203	144.2 Å²	144.2	88%	0.883	77%	0.77	S	S	*	*			trans	-52.5	125.6	173.9	-80.4	177.7	174.4	176.9	0	107.8	K5 V9	K5-K7 PolarHBondContact O-N 3.36Å; K7-V9 PolarHBondContact O-N 3.39Å
8	S	27.1	Very low	38.2	Very low	103 Å²	103	144.2 Å²	144.2	72%	0.72	76%	0.764	S	S	*	*			trans	-45.5	131	175.9	49.4	0	0	0	0	111.7	L6 T10	L6-S8 PolarHBondContact O-N 2.84Å; L6-S8 VanDerWaalsContact O-N 3.16Å; S8-T10 PolarHBondContact O-N 3.19Å
9	V	29.2	Very low	39.8	Very low	133 Å²	133	137.2 Å²	137.2	81%	0.806	73%	0.729	S	S	*	*			trans	33.5	85.9	147.9	-171.3	0	0	0	0	112.5	K7 E11	K7-V9 PolarHBondContact O-N 3.39Å; V9-E11 PolarHBondContact O-N 3.35Å; V9-E11 VanDerWaalsContact O-N 3.08Å
10	T	32.9	Very low	41.2	Very low	123 Å²	123	133.9 Å²	133.9	76%	0.755	71%	0.714	S	S	*	*			trans	-43.3	118.9	160.8	29.6	0	0	0	0	108.3	S8 K12	S8-T10 PolarHBondContact O-N 3.19Å; T10-K12 PolarHBondContact O-N 3.43Å
11	E	29.5	Very low	42.7	Very low	177 Å²	177	132.7 Å²	132.7	83%	0.827	70%	0.704	S	S	*	*			trans	-43.5	129.9	168.5	-81.1	175.5	141	0	0	108.5	V9 T13	V9-E11 PolarHBondContact O-N 3.35Å; V9-E11 VanDerWaalsContact O-N 3.08Å; E11-T13 PolarHBondContact O-N 3.44Å; E11-T13 PolarHBondContact O-OG1 3.47Å
12	K	34.5	Very low	44.2	Very low	201 Å²	201	122.2 Å²	122.2	87%	0.874	66%	0.655	S	S	*	*			trans	-54.8	90.9	175.3	-62	174.9	179.8	-177.5	0	107.6	T10 P14	T10-K12 PolarHBondContact O-N 3.43Å; K12-P14 VanDerWaalsContact C-CD 3.42Å; K12-P14 WeakPolarHBondContact O-CD 3.37Å
13	T	32.4	Very low	46.2	Very low	111 Å²	111	116.6 Å²	116.6	68%	0.681	62%	0.616	S	S	*	*			trans	-91.8	90.5	167	-49.5	0	0	0	0	103.9	E11 L15	E11-T13 PolarHBondContact O-N 3.44Å; E11-T13 PolarHBondContact O-OG1 3.47Å; T13-L15 PolarHBondContact O-N 3.14Å
14	P	38.7	Very low	47.9	Very low	103 Å²	103	110.3 Å²	110.3	67%	0.669	59%	0.587	S	S	*	*			trans	-53.5	140.9	172.1	23.3	-32.4	0	0	0	108	K12 Q16	K12-P14 VanDerWaalsContact C-CD 3.42Å; K12-P14 WeakPolarHBondContact O-CD 3.37Å; P14-Q16 PolarHBondContact O-N 3.26Å
15	L	48.5	Very low	49.6	Very low	37 Å²	37	108.1 Å²	108.1	19%	0.194	57%	0.566	C	S	.	*			trans	-37.5	131.8	175.3	-77.2	160.2	0	0	0	110.2	T13 V20 F255	T13-L15 PolarHBondContact O-N 3.14Å; L15-V20 HydrophobicContact CB-CG2 3.6Å; L15-V20 HydrophobicContact CD1-CG2 3.87Å; L15-V20 HydrophobicContact CG-CG2 4.37Å; L15-F255 HydrophobicContact CD2-CB 4.3Å
16	Q	54.4	Low	51.6	Low	120 Å²	120	99 Å²	99	56%	0.561	53%	0.526	S	S	*	.			trans	-49.1	132.9	168.6	-71	179.1	-10	0	0	107.8	P14 E18 S19	P14-Q16 PolarHBondContact O-N 3.26Å; Q16-E18 PolarHBondContact O-N 3.16Å; Q16-S19 WeakPolarHBondContact O-CB 3.4Å; Q16-S19 PolarHBondContact O-N 3.46Å
17	P	56.1	Low	53	Low	107 Å²	107	91.3 Å²	91.3	70%	0.695	49%	0.486	S	S	*	.	H	α-helix	trans	-48.3	-34.2	-177.2	-30.3	34.8	0	0	0	113.2	S19 V20 Q21	P17-S19 PolarHBondContact O-N 3.18Å; P17-V20 PolarHBondContact O-N 3.05Å; P17-Q21 WeakPolarHBondContact O-CB 3.31Å; P17-Q21 PolarHBondContact O-N 3.36Å
18	E	63.3	Low	54.4	Low	144 Å²	144	86.1 Å²	86.1	67%	0.673	47%	0.468	S	S	*	.	H	α-helix	trans	-58.4	-41.5	175.6	-62.1	176.2	-175.9	0	0	113.1	Q16 Q21 A22	Q16-E18 PolarHBondContact O-N 3.16Å; E18-Q21 PolarHBondContact O-N 3.32Å; E18-A22 WeakPolarHBondContact O-CB 3.46Å; E18-A22 PolarHBondContact O-N 2.78Å
19	S	68.2	Low	56	Low	12 Å²	12	85.7 Å²	85.7	8%	0.084	45%	0.45	C	S	.	.	H	α-helix	trans	-68.6	-39	178.8	-64	0	0	0	0	112.5	Q16 P17 Q21 I23 F255	Q16-S19 WeakPolarHBondContact O-CB 3.4Å; Q16-S19 PolarHBondContact O-N 3.46Å; P17-S19 PolarHBondContact O-N 3.18Å; S19-Q21 VanDerWaalsContact C-N 3.34Å; S19-I23 VanDerWaalsContact O-CG1 3.27Å; S19-I23 WeakPolarHBondContact O-CG1 3.48Å; S19-I23 PolarHBondContact O-N 3.33Å; S19-F255 WeakPolarHBondContact OG-CD1 3.4Å
20	V	68	Low	57.3	Low	71 Å²	71	81.3 Å²	81.3	43%	0.43	42%	0.421	S	S	.	.	H	α-helix	trans	-67.7	-40.9	175.7	179.7	0	0	0	0	110.1	L15 P17 Q24	L15-V20 HydrophobicContact CB-CG2 3.6Å; L15-V20 HydrophobicContact CD1-CG2 3.87Å; L15-V20 HydrophobicContact CG-CG2 4.37Å; P17-V20 PolarHBondContact O-N 3.05Å; V20-Q24 WeakPolarHBondContact O-CB 3.4Å; V20-Q24 PolarHBondContact O-N 3.47Å
21	Q	71.8	Confident	57.9	Low	109 Å²	109	78 Å²	78	51%	0.509	41%	0.406	S	S	.	.	H	α-helix	trans	-63.9	-48.9	177.8	-177	172.3	-5	0	0	111.2	P17 E18 S19 I23 Q24 E25	P17-Q21 WeakPolarHBondContact O-CB 3.31Å; P17-Q21 PolarHBondContact O-N 3.36Å; E18-Q21 PolarHBondContact O-N 3.32Å; S19-Q21 VanDerWaalsContact C-N 3.34Å; Q21-I23 PolarHBondContact O-N 3.06Å; Q21-Q24 PolarHBondContact O-N 3.23Å; Q21-E25 HydrophobicContact CG-CG 4.17Å; Q21-E25 WeakPolarHBondContact CG-OE1 3.39Å; Q21-E25 PolarHBondContact NE2-OE1 3.24Å; Q21-E25 WeakPolarHBondContact O-CB 3.4Å; Q21-E25 WeakPolarHBondContact O-CG 3.32Å; Q21-E25 PolarHBondContact O-N 2.88Å
22	A	75	Confident	58.7	Low	21 Å²	21	72.1 Å²	72.1	17%	0.174	38%	0.382	C	S	.	.	H	α-helix	trans	-57.7	-44.5	177.4	0	0	0	0	0	112.5	E18 Q24 E25 E26 F255	E18-A22 WeakPolarHBondContact O-CB 3.46Å; E18-A22 PolarHBondContact O-N 2.78Å; A22-Q24 VanDerWaalsContact C-N 3.3Å; A22-Q24 PolarHBondContact O-N 3.16Å; A22-E25 PolarHBondContact O-N 2.94Å; A22-E26 WeakPolarHBondContact O-CB 3.49Å; A22-E26 PolarHBondContact O-N 3.33Å; A22-F255 HydrophobicContact CB-CZ 4.42Å
23	I	76.4	Confident	59	Low	4 Å²	4	68.4 Å²	68.4	2%	0.021	37%	0.372	C	S	.	.	H	α-helix	trans	-62	-39.8	176.4	-68.4	170	0	0	0	111.4	S19 Q21 M27 R213 R218 F248 W251 F255	S19-I23 VanDerWaalsContact O-CG1 3.27Å; S19-I23 WeakPolarHBondContact O-CG1 3.48Å; S19-I23 PolarHBondContact O-N 3.33Å; Q21-I23 PolarHBondContact O-N 3.06Å; I23-M27 WeakPolarHBondContact O-CG 3.39Å; I23-M27 PolarHBondContact O-N 3.21Å; I23-R213 HydrophobicContact CG2-CB 4.48Å; I23-R213 HydrophobicContact CG2-CG 3.87Å; I23-R218 VanDerWaalsContact CD1-NH2 3.3Å; I23-F248 HydrophobicContact CG2-CZ 4.12Å; I23-W251 HydrophobicContact CB-CH2 4.39Å; I23-W251 HydrophobicContact CB-CZ3 4.24Å; I23-W251 HydrophobicContact CG1-CH2 3.89Å; I23-W251 HydrophobicContact CG1-CZ3 3.77Å; I23-F255 HydrophobicContact CD1-CD2 3.8Å; I23-F255 HydrophobicContact CD1-CE2 3.85Å; I23-F255 HydrophobicContact CD1-CG 4.34Å; I23-F255 HydrophobicContact CD1-CZ 4.46Å; I23-F255 HydrophobicContact CG1-CD2 4.09Å; I23-F255 HydrophobicContact CG1-CE2 3.59Å; I23-F255 HydrophobicContact CG1-CZ 4.03Å
24	Q	70.4	Confident	59.5	Low	44 Å²	44	70.9 Å²	70.9	21%	0.206	38%	0.378	C	S	.	.	H	α-helix	trans	-71.3	-44.9	179.3	-177	55.5	50.3	0	0	111.4	V20 Q21 A22 E26 M27 D28	V20-Q24 WeakPolarHBondContact O-CB 3.4Å; V20-Q24 PolarHBondContact O-N 3.47Å; Q21-Q24 PolarHBondContact O-N 3.23Å; A22-Q24 VanDerWaalsContact C-N 3.3Å; A22-Q24 PolarHBondContact O-N 3.16Å; Q24-E26 PolarHBondContact O-N 2.66Å; Q24-M27 PolarHBondContact O-N 3.05Å; Q24-D28 PolarHBondContact NE2-OD1 3.42Å; Q24-D28 PolarHBondContact NE2-OD2 2.94Å; Q24-D28 VanDerWaalsContact O-CG 3.25Å; Q24-D28 PolarHBondContact O-N 3.06Å
25	E	72.3	Confident	60.1	Low	76 Å²	76	68 Å²	68	36%	0.355	36%	0.356	S	S	.	.	H	α-helix	trans	-60.5	-44.3	177.7	-74.2	175.9	178.7	0	0	111.8	Q21 A22 M27 D28 R29	Q21-E25 HydrophobicContact CG-CG 4.17Å; Q21-E25 WeakPolarHBondContact CG-OE1 3.39Å; Q21-E25 PolarHBondContact NE2-OE1 3.24Å; Q21-E25 WeakPolarHBondContact O-CB 3.4Å; Q21-E25 WeakPolarHBondContact O-CG 3.32Å; Q21-E25 PolarHBondContact O-N 2.88Å; A22-E25 PolarHBondContact O-N 2.94Å; E25-M27 VanDerWaalsContact C-N 3.27Å; E25-M27 PolarHBondContact O-N 3.46Å; E25-D28 PolarHBondContact O-N 2.8Å; E25-D28 VanDerWaalsContact O-N 3.1Å; E25-R29 WeakPolarHBondContact O-CB 3.45Å; E25-R29 WeakPolarHBondContact O-CG 3.42Å; E25-R29 PolarHBondContact O-N 3.47Å
26	E	71.4	Confident	60.3	Low	8 Å²	8	68.9 Å²	68.9	4%	0.037	36%	0.36	C	S	.	.	H	α-helix	trans	-65	-31.1	179.1	-171.8	60.8	-161.1	0	0	112.8	A22 Q24 R29 H30 Y244 F248 W251 R286	A22-E26 WeakPolarHBondContact O-CB 3.49Å; A22-E26 PolarHBondContact O-N 3.33Å; Q24-E26 PolarHBondContact O-N 2.66Å; E26-R29 IonicContact OE2-CZ 2.94Å; E26-R29 IonicContact OE2-NE 3.5Å; E26-R29 PolarHBondContact OE2-NE 3.19Å; E26-R29 IonicContact OE2-NH2 2.66Å; E26-R29 PolarHBondContact OE2-NH2 3.11Å; E26-H30 PolarHBondContact O-N 3.39Å; E26-H30 PolarHBondContact O-ND1 3.28Å; E26-H30 IonicContact OE1-CE1 2.69Å; E26-H30 PolarHBondContact OE1-CE1 3.05Å; E26-H30 IonicContact OE1-ND1 3.99Å; E26-H30 PolarHBondContact OE1-ND1 3.43Å; E26-Y244 PolarHBondContact OE1-OH 2.88Å; E26-F248 HydrophobicContact CB-CE2 4.2Å; E26-F248 HydrophobicContact CG-CD2 4.24Å; E26-F248 HydrophobicContact CG-CE2 4Å; E26-W251 HydrophobicContact CB-CH2 3.97Å; E26-W251 HydrophobicContact CB-CZ3 4.16Å; E26-W251 HydrophobicContact CG-CH2 4.38Å; E26-W251 HydrophobicContact CG-CZ3 4.34Å; E26-R286 IonicContact OE2-NH2 3.89Å
27	M	60.8	Low	60.3	Low	10 Å²	10	65.7 Å²	65.7	5%	0.049	35%	0.354	C	S	.	.	H	α-helix	trans	-73.5	-37.5	171.7	-71.6	-178.3	70.9	0	0	112.7	I23 Q24 E25 H30 R206 R213 F248	I23-M27 WeakPolarHBondContact O-CG 3.39Å; I23-M27 PolarHBondContact O-N 3.21Å; Q24-M27 PolarHBondContact O-N 3.05Å; E25-M27 VanDerWaalsContact C-N 3.27Å; E25-M27 PolarHBondContact O-N 3.46Å; M27-H30 CarbonylContact O-C 3.58Å; M27-H30 VanDerWaalsContact O-C 3.29Å; M27-H30 PolarHBondContact O-N 3.39Å; M27-R206 VanDerWaalsContact CE-CZ 3.45Å; M27-R213 HydrophobicContact SD-CG 4.43Å; M27-R213 PolarHBondContact SD-NH1 3.45Å; M27-F248 HydrophobicContact CG-CE1 4.37Å; M27-F248 HydrophobicContact CG-CE2 3.89Å; M27-F248 HydrophobicContact CG-CZ 3.48Å; M27-F248 VanDerWaalsContact CG-CZ 3.48Å; M27-F248 HydrophobicContact SD-CE1 4.49Å; M27-F248 HydrophobicContact SD-CZ 4Å
28	D	61.9	Low	60.6	Low	94 Å²	94	66 Å²	66	50%	0.503	35%	0.354	S	S	.	.	H	α-helix	trans	-73	-35.9	179.8	-67.1	-22.7	0	0	0	111.2	Q24 E25 H30 A31	Q24-D28 PolarHBondContact NE2-OD1 3.42Å; Q24-D28 PolarHBondContact NE2-OD2 2.94Å; Q24-D28 VanDerWaalsContact O-CG 3.25Å; Q24-D28 PolarHBondContact O-N 3.06Å; E25-D28 PolarHBondContact O-N 2.8Å; E25-D28 VanDerWaalsContact O-N 3.1Å; D28-H30 PolarHBondContact O-N 2.91Å; D28-A31 PolarHBondContact O-N 3.25Å
29	R	61	Low	61.3	Low	95 Å²	95	60.2 Å²	60.2	36%	0.358	33%	0.329	S	S	.	.	H	α-helix	trans	-56.5	-38.7	170.4	-77.8	-169.7	-78.5	-124.2	11.6	111.9	E25 E26 A31 E333	E25-R29 WeakPolarHBondContact O-CB 3.45Å; E25-R29 WeakPolarHBondContact O-CG 3.42Å; E25-R29 PolarHBondContact O-N 3.47Å; E26-R29 IonicContact OE2-CZ 2.94Å; E26-R29 IonicContact OE2-NE 3.5Å; E26-R29 PolarHBondContact OE2-NE 3.19Å; E26-R29 IonicContact OE2-NH2 2.66Å; E26-R29 PolarHBondContact OE2-NH2 3.11Å; R29-A31 PolarHBondContact O-N 3.11Å; R29-E333 IonicContact CZ-OE2 3.2Å; R29-E333 IonicContact NH1-OE2 3.75Å; R29-E333 PolarHBondContact NH1-OE2 2.8Å; R29-E333 IonicContact NH2-OE1 3.29Å; R29-E333 PolarHBondContact NH2-OE1 3.36Å; R29-E333 IonicContact NH2-OE2 3.24Å; R29-E333 PolarHBondContact NH2-OE2 3.37Å
30	H	55.4	Low	62.1	Low	41 Å²	41	62.7 Å²	62.7	19%	0.19	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	59.5	177.5	-63.8	93.1	0	0	0	110.4	E26 M27 D28 V32 Y244	E26-H30 PolarHBondContact O-N 3.39Å; E26-H30 PolarHBondContact O-ND1 3.28Å; E26-H30 IonicContact OE1-CE1 2.69Å; E26-H30 PolarHBondContact OE1-CE1 3.05Å; E26-H30 IonicContact OE1-ND1 3.99Å; E26-H30 PolarHBondContact OE1-ND1 3.43Å; M27-H30 CarbonylContact O-C 3.58Å; M27-H30 VanDerWaalsContact O-C 3.29Å; M27-H30 PolarHBondContact O-N 3.39Å; D28-H30 PolarHBondContact O-N 2.91Å; H30-V32 PolarHBondContact O-N 2.88Å; H30-V32 VanDerWaalsContact O-N 3.08Å; H30-Y244 HydrophobicContact CB-CE1 4.5Å; H30-Y244 AromaticContact CE1-CE2 3.9Å; H30-Y244 AromaticContact CE1-CZ 3.9Å; H30-Y244 AromaticContact CG-CZ 3.86Å; H30-Y244 AromaticContact ND1-CZ 3.65Å; H30-Y244 PolarHBondContact ND1-OH 3.4Å
31	A	46.3	Very low	63.2	Low	53 Å²	53	59.6 Å²	59.6	44%	0.438	32%	0.32	S	S	.	.			trans	-33.1	114.9	-177.8	0	0	0	0	0	111.8	D28 R29 D33 M34	D28-A31 PolarHBondContact O-N 3.25Å; R29-A31 PolarHBondContact O-N 3.11Å; A31-D33 PolarHBondContact O-N 3.47Å; A31-M34 PolarHBondContact O-N 3.42Å
32	V	46.1	Very low	63.9	Low	53 Å²	53	58.2 Å²	58.2	32%	0.321	31%	0.31	S	S	.	.	H	α-helix	trans	-43.6	-23.1	179.4	178.7	0	0	0	0	113.1	H30 M36 R206	H30-V32 PolarHBondContact O-N 2.88Å; H30-V32 VanDerWaalsContact O-N 3.08Å; V32-M36 HydrophobicContact CG1-CG 4.31Å; V32-M36 WeakPolarHBondContact O-CG 3.16Å; V32-M36 PolarHBondContact O-N 3.32Å; V32-R206 VanDerWaalsContact CG2-NH2 3.26Å
33	D	39.7	Very low	64.5	Low	124 Å²	124	62 Å²	62	66%	0.663	33%	0.325	S	S	*	.	H	α-helix	trans	-71.6	-38.5	-173	-61.6	-26.7	0	0	0	114.9	A31 M36 A37	A31-D33 PolarHBondContact O-N 3.47Å; D33-M36 PolarHBondContact O-N 3.19Å; D33-A37 PolarHBondContact O-N 3.32Å
34	M	44.4	Very low	65.3	Low	163 Å²	163	63.2 Å²	63.2	80%	0.803	33%	0.331	S	S	*	.	H	α-helix	trans	-75.9	-32.8	-174.7	-151	-164	-69.2	0	0	112.2	A31	A31-M34 PolarHBondContact O-N 3.42Å
35	I	51.4	Low	66.3	Low	41 Å²	41	61.4 Å²	61.4	21%	0.21	32%	0.323	C	S	.	.	H	α-helix	trans	-70.6	-37.2	176.7	-59.9	164.6	0	0	0	110.5	A37 S39	I35-A37 VanDerWaalsContact C-N 3.35Å; I35-A37 PolarHBondContact O-N 2.92Å; I35-S39 PolarHBondContact O-N 3.02Å
36	M	51.5	Low	67.2	Low	57 Å²	57	61.9 Å²	61.9	28%	0.281	33%	0.326	S	S	.	.	H	α-helix	trans	-57.9	-50.2	178.2	-71.7	-97.4	-90.2	0	0	109.6	V32 D33 T38 S39 Y42	V32-M36 HydrophobicContact CG1-CG 4.31Å; V32-M36 WeakPolarHBondContact O-CG 3.16Å; V32-M36 PolarHBondContact O-N 3.32Å; D33-M36 PolarHBondContact O-N 3.19Å; M36-T38 VanDerWaalsContact C-N 3.27Å; M36-T38 PolarHBondContact O-N 3.29Å; M36-T38 VanDerWaalsContact O-N 3.07Å; M36-S39 PolarHBondContact O-N 3.42Å; M36-S39 VanDerWaalsContact O-N 3.12Å; M36-S39 PolarHBondContact O-OG 3.24Å; M36-Y42 HydrophobicContact CB-CD2 3.97Å; M36-Y42 HydrophobicContact CB-CE2 4.28Å; M36-Y42 HydrophobicContact CB-CG 4.39Å; M36-Y42 WeakPolarHBondContact O-CB 3.31Å; M36-Y42 VanDerWaalsContact O-CD1 3.29Å; M36-Y42 WeakPolarHBondContact O-CD1 3.3Å; M36-Y42 HydrophobicContact SD-CD2 4.5Å
37	A	54.6	Low	68.1	Low	53 Å²	53	67.8 Å²	67.8	44%	0.438	35%	0.353	S	S	.	.	H	α-helix	trans	-55.8	-32.7	-171.7	0	0	0	0	0	115.4	D33 I35	D33-A37 PolarHBondContact O-N 3.32Å; I35-A37 VanDerWaalsContact C-N 3.35Å; I35-A37 PolarHBondContact O-N 2.92Å
38	T	61.8	Low	69.6	Low	113 Å²	113	67.5 Å²	67.5	69%	0.693	35%	0.352	S	S	*	.	H	α-helix	trans	-103	-3.5	-177.3	62	0	0	0	0	114.4	M36	M36-T38 VanDerWaalsContact C-N 3.27Å; M36-T38 PolarHBondContact O-N 3.29Å; M36-T38 VanDerWaalsContact O-N 3.07Å
39	S	78.1	Confident	71	Confident	22 Å²	22	66.5 Å²	66.5	15%	0.154	34%	0.341	C	S	.	.	S	Bend	trans	-74.4	141.4	-179.7	71.9	0	0	0	0	111.2	I35 M36 L41 Y42 M43	I35-S39 PolarHBondContact O-N 3.02Å; M36-S39 PolarHBondContact O-N 3.42Å; M36-S39 VanDerWaalsContact O-N 3.12Å; M36-S39 PolarHBondContact O-OG 3.24Å; S39-L41 VanDerWaalsContact C-N 3.26Å; S39-L41 PolarHBondContact O-N 3.21Å; S39-Y42 PolarHBondContact O-N 3.38Å; S39-Y42 VanDerWaalsContact O-N 3.11Å; S39-Y42 WeakPolarHBondContact OG-CB 3.43Å; S39-Y42 PolarHBondContact OG-N 3.08Å; S39-M43 PolarHBondContact O-N 3.35Å
40	K	86.5	Confident	72.4	Confident	65 Å²	65	66.5 Å²	66.5	28%	0.283	36%	0.356	S	S	.	.	H	α-helix	trans	-53.7	-44.4	177.3	-177.7	172.1	-178	169.3	0	112	Y42 M43 E44 E199 Y200	K40-Y42 VanDerWaalsContact C-N 3.33Å; K40-Y42 PolarHBondContact O-N 3.36Å; K40-M43 PolarHBondContact O-N 2.71Å; K40-E44 WeakPolarHBondContact CE-OE1 3.32Å; K40-E44 PolarHBondContact O-N 3Å; K40-E199 HydrophobicContact CD-CB 3.84Å; K40-E199 IonicContact NZ-OE1 2.97Å; K40-E199 PolarHBondContact NZ-OE1 2.88Å; K40-E199 IonicContact NZ-OE2 3.41Å; K40-E199 PolarHBondContact NZ-OE2 3.04Å; K40-Y200 HydrophobicContact CB-CE1 4.45Å; K40-Y200 HydrophobicContact CD-CE1 4.33Å; K40-Y200 HydrophobicContact CD-CE2 4.35Å; K40-Y200 HydrophobicContact CG-CE1 4.14Å
41	L	90.3	Very high	73.9	Confident	5 Å²	5	67.5 Å²	67.5	3%	0.026	37%	0.367	C	S	.	.	H	α-helix	trans	-60.1	-42.7	178.9	-166.5	73.5	0	0	0	112.2	S39 S45 F157 N160 Q161 L164 Y200 T203	S39-L41 VanDerWaalsContact C-N 3.26Å; S39-L41 PolarHBondContact O-N 3.21Å; L41-S45 WeakPolarHBondContact O-CB 3.31Å; L41-S45 PolarHBondContact O-N 3.21Å; L41-F157 HydrophobicContact CD1-CD2 3.62Å; L41-F157 HydrophobicContact CD1-CE2 3.81Å; L41-F157 HydrophobicContact CD1-CG 4.09Å; L41-F157 HydrophobicContact CD1-CZ 4.44Å; L41-F157 HydrophobicContact CG-CE2 4.28Å; L41-F157 WeakPolarHBondContact O-CE2 3.42Å; L41-N160 HydrophobicContact CD1-CB 3.88Å; L41-N160 HydrophobicContact CD2-CB 4.39Å; L41-Q161 HydrophobicContact CD1-CB 4.35Å; L41-L164 HydrophobicContact CD2-CD1 3.39Å; L41-L164 HydrophobicContact CD2-CG 4.35Å; L41-Y200 HydrophobicContact CB-CD1 4.03Å; L41-Y200 HydrophobicContact CB-CE1 4.13Å; L41-Y200 HydrophobicContact CD1-CD1 4.01Å; L41-Y200 HydrophobicContact CD1-CE1 3.75Å; L41-T203 HydrophobicContact CD2-CG2 3.77Å
42	Y	87.3	Confident	76	Confident	80 Å²	80	73 Å²	73	31%	0.314	38%	0.377	S	S	.	.	H	α-helix	trans	-67.8	-43.5	178.6	179.6	-94.9	0	0	0	112.1	M36 S39 K40 E44 S45 Q46	M36-Y42 HydrophobicContact CB-CD2 3.97Å; M36-Y42 HydrophobicContact CB-CE2 4.28Å; M36-Y42 HydrophobicContact CB-CG 4.39Å; M36-Y42 WeakPolarHBondContact O-CB 3.31Å; M36-Y42 VanDerWaalsContact O-CD1 3.29Å; M36-Y42 WeakPolarHBondContact O-CD1 3.3Å; M36-Y42 HydrophobicContact SD-CD2 4.5Å; S39-Y42 PolarHBondContact O-N 3.38Å; S39-Y42 VanDerWaalsContact O-N 3.11Å; S39-Y42 WeakPolarHBondContact OG-CB 3.43Å; S39-Y42 PolarHBondContact OG-N 3.08Å; K40-Y42 VanDerWaalsContact C-N 3.33Å; K40-Y42 PolarHBondContact O-N 3.36Å; Y42-E44 PolarHBondContact O-N 3.45Å; Y42-S45 WeakPolarHBondContact O-CA 3.3Å; Y42-S45 WeakPolarHBondContact O-CB 3.3Å; Y42-S45 PolarHBondContact O-N 2.8Å; Y42-S45 PolarHBondContact O-OG 3.35Å; Y42-Q46 HydrophobicContact CD1-CG 4.48Å; Y42-Q46 HydrophobicContact CE1-CG 4.12Å; Y42-Q46 VanDerWaalsContact CZ-NE2 3.35Å; Y42-Q46 PolarHBondContact O-N 3.21Å; Y42-Q46 VanDerWaalsContact O-N 3.13Å; Y42-Q46 PolarHBondContact OH-NE2 2.87Å
43	M	87.6	Confident	78.2	Confident	100 Å²	100	71.2 Å²	71.2	49%	0.493	37%	0.367	S	S	.	.	H	α-helix	trans	-58.4	-49.6	176.5	-68.6	-173.1	-69.8	0	0	111	S39 K40 S45 Q46 E47	S39-M43 PolarHBondContact O-N 3.35Å; K40-M43 PolarHBondContact O-N 2.71Å; M43-S45 PolarHBondContact O-N 3.49Å; M43-Q46 WeakPolarHBondContact O-CB 3.32Å; M43-Q46 PolarHBondContact O-N 3.26Å; M43-Q46 VanDerWaalsContact O-N 3.08Å; M43-E47 PolarHBondContact O-N 2.89Å
44	E	91.9	Very high	80.8	Confident	30 Å²	30	70.4 Å²	70.4	14%	0.14	36%	0.362	C	S	.	.	H	α-helix	trans	-61.2	-33	174.7	-73	-167.7	-145.9	0	0	112	K40 Y42 Q46 E47 V48 R112 F157 Y200	K40-E44 WeakPolarHBondContact CE-OE1 3.32Å; K40-E44 PolarHBondContact O-N 3Å; Y42-E44 PolarHBondContact O-N 3.45Å; E44-Q46 VanDerWaalsContact C-N 3.28Å; E44-Q46 PolarHBondContact O-N 3.05Å; E44-E47 PolarHBondContact O-N 3.48Å; E44-V48 VanDerWaalsContact O-CG2 3.28Å; E44-V48 WeakPolarHBondContact O-CG2 3.4Å; E44-V48 PolarHBondContact O-N 2.85Å; E44-R112 IonicContact OE2-CZ 2.73Å; E44-R112 IonicContact OE2-NH1 2.69Å; E44-R112 PolarHBondContact OE2-NH1 3.18Å; E44-R112 IonicContact OE2-NH2 3.62Å; E44-F157 HydrophobicContact CB-CD2 3.54Å; E44-F157 HydrophobicContact CB-CE2 3.74Å; E44-F157 HydrophobicContact CG-CD2 4.49Å; E44-Y200 PolarHBondContact OE1-OH 3Å
45	S	91.7	Very high	83.2	Confident	6 Å²	6	63.2 Å²	63.2	4%	0.042	33%	0.326	C	S	.	.	H	α-helix	trans	-65.2	-31.3	177	82.8	0	0	0	0	112.4	L41 Y42 M43 R49	L41-S45 WeakPolarHBondContact O-CB 3.31Å; L41-S45 PolarHBondContact O-N 3.21Å; Y42-S45 WeakPolarHBondContact O-CA 3.3Å; Y42-S45 WeakPolarHBondContact O-CB 3.3Å; Y42-S45 PolarHBondContact O-N 2.8Å; Y42-S45 PolarHBondContact O-OG 3.35Å; M43-S45 PolarHBondContact O-N 3.49Å; S45-R49 VanDerWaalsContact O-CG 3.27Å; S45-R49 WeakPolarHBondContact O-CG 3.4Å; S45-R49 PolarHBondContact O-N 3.24Å; S45-R49 VanDerWaalsContact O-N 3.12Å; S45-R49 PolarHBondContact O-NH1 3.24Å; S45-R49 PolarHBondContact OG-NH1 3.35Å
46	Q	90.6	Very high	85.2	Confident	86 Å²	86	69.1 Å²	69.1	40%	0.402	35%	0.346	S	S	.	.	H	α-helix	trans	-70.2	-40.6	174.7	-60.8	-53.6	-39.3	0	0	111.3	Y42 M43 E44 R49 S50	Y42-Q46 HydrophobicContact CD1-CG 4.48Å; Y42-Q46 HydrophobicContact CE1-CG 4.12Å; Y42-Q46 VanDerWaalsContact CZ-NE2 3.35Å; Y42-Q46 PolarHBondContact O-N 3.21Å; Y42-Q46 VanDerWaalsContact O-N 3.13Å; Y42-Q46 PolarHBondContact OH-NE2 2.87Å; M43-Q46 WeakPolarHBondContact O-CB 3.32Å; M43-Q46 PolarHBondContact O-N 3.26Å; M43-Q46 VanDerWaalsContact O-N 3.08Å; E44-Q46 VanDerWaalsContact C-N 3.28Å; E44-Q46 PolarHBondContact O-N 3.05Å; Q46-R49 PolarHBondContact O-N 3.37Å; Q46-S50 PolarHBondContact O-N 3.44Å
47	E	91.6	Very high	87.2	Confident	132 Å²	132	69.3 Å²	69.3	62%	0.617	35%	0.352	S	S	*	.	H	α-helix	trans	-64.1	-45.6	175.7	-64.5	177.7	-177	0	0	111.5	M43 E44 R49 S50	M43-E47 PolarHBondContact O-N 2.89Å; E44-E47 PolarHBondContact O-N 3.48Å; E47-R49 VanDerWaalsContact C-N 3.3Å; E47-R49 PolarHBondContact O-N 3.45Å; E47-S50 WeakPolarHBondContact O-CB 3.2Å; E47-S50 PolarHBondContact O-N 3.45Å; E47-S50 VanDerWaalsContact O-N 3.07Å; E47-S50 PolarHBondContact O-OG 3.39Å
48	V	92.8	Very high	89.1	Confident	4 Å²	4	67.8 Å²	67.8	2%	0.024	34%	0.336	C	S	.	.	H	α-helix	trans	-62.1	-38.6	178.1	175.1	0	0	0	0	111	E44 S50 S51 R112 F113 I116	E44-V48 VanDerWaalsContact O-CG2 3.28Å; E44-V48 WeakPolarHBondContact O-CG2 3.4Å; E44-V48 PolarHBondContact O-N 2.85Å; V48-S50 PolarHBondContact O-N 3.32Å; V48-S51 PolarHBondContact O-N 3.49Å; V48-R112 HydrophobicContact CG1-CB 3.85Å; V48-R112 HydrophobicContact CG2-CB 4.12Å; V48-F113 HydrophobicContact CG1-CB 4.03Å; V48-F113 HydrophobicContact CG1-CD2 4.18Å; V48-F113 WeakPolarHBondContact O-CD2 3.18Å; V48-I116 HydrophobicContact CB-CD1 3.54Å; V48-I116 HydrophobicContact CG1-CD1 3.43Å; V48-I116 VanDerWaalsContact CG1-CD1 3.43Å; V48-I116 HydrophobicContact CG2-CD1 4.41Å
49	R	90.9	Very high	90.7	Very high	73 Å²	73	64.3 Å²	64.3	28%	0.275	31%	0.312	S	S	.	.	H	α-helix	trans	-59.3	-27.5	175.8	-78.5	-177.4	-173.2	93.4	-4.4	113.3	S45 Q46 E47 S51 I116 D120	S45-R49 VanDerWaalsContact O-CG 3.27Å; S45-R49 WeakPolarHBondContact O-CG 3.4Å; S45-R49 PolarHBondContact O-N 3.24Å; S45-R49 VanDerWaalsContact O-N 3.12Å; S45-R49 PolarHBondContact O-NH1 3.24Å; S45-R49 PolarHBondContact OG-NH1 3.35Å; Q46-R49 PolarHBondContact O-N 3.37Å; E47-R49 VanDerWaalsContact C-N 3.3Å; E47-R49 PolarHBondContact O-N 3.45Å; R49-S51 VanDerWaalsContact C-N 3.35Å; R49-I116 HydrophobicContact CG-CG2 4Å; R49-D120 IonicContact CZ-OD1 3.26Å; R49-D120 IonicContact CZ-OD2 3.72Å; R49-D120 IonicContact NE-OD2 3.46Å; R49-D120 PolarHBondContact NE-OD2 3.28Å; R49-D120 IonicContact NH2-OD1 2.72Å; R49-D120 PolarHBondContact NH2-OD1 3.13Å; R49-D120 IonicContact NH2-OD2 2.74Å; R49-D120 PolarHBondContact NH2-OD2 3.26Å
50	S	89.6	Confident	91.4	Very high	96 Å²	96	69.9 Å²	69.9	67%	0.671	34%	0.336	S	S	*	.	H	α-helix	trans	-75.1	-22.8	176.3	77.3	0	0	0	0	113.5	Q46 E47 V48	Q46-S50 PolarHBondContact O-N 3.44Å; E47-S50 WeakPolarHBondContact O-CB 3.2Å; E47-S50 PolarHBondContact O-N 3.45Å; E47-S50 VanDerWaalsContact O-N 3.07Å; E47-S50 PolarHBondContact O-OG 3.39Å; V48-S50 PolarHBondContact O-N 3.32Å
51	S	88.4	Confident	91.7	Very high	61 Å²	61	69.6 Å²	69.6	43%	0.427	34%	0.342	S	S	.	.	S	Bend	trans	-107.6	76.6	-172.3	-68.9	0	0	0	0	111.9	V48 R49	V48-S51 PolarHBondContact O-N 3.49Å; R49-S51 VanDerWaalsContact C-N 3.35Å
52	R	89.9	Confident	91.7	Very high	169 Å²	169	74.6 Å²	74.6	64%	0.638	38%	0.378	S	S	*	.			trans	-68	135.9	-177.1	-64.3	-170.5	-177.3	-171.4	1.3	113.1	F113	R52-F113 HydrophobicContact CG-CE2 4.02Å; R52-F113 HydrophobicContact CG-CZ 4Å
53	P	91.9	Very high	91.8	Very high	16 Å²	16	74.9 Å²	74.9	10%	0.104	38%	0.383	C	S	.	.			trans	-64.1	144.4	173	-22	34.4	0	0	0	112.5	W55 Y58 T110 F113	P53-W55 HydrophobicContact CB-CD2 4.17Å; P53-W55 HydrophobicContact CB-CE3 4.22Å; P53-W55 HydrophobicContact CB-CH2 3.84Å; P53-W55 HydrophobicContact CB-CZ2 3.78Å; P53-W55 HydrophobicContact CB-CZ3 4.05Å; P53-W55 HydrophobicContact CG-CH2 3.76Å; P53-W55 HydrophobicContact CG-CZ2 3.66Å; P53-W55 HydrophobicContact CG-CZ3 4.43Å; P53-W55 PolarHBondContact O-N 3.44Å; P53-Y58 HydrophobicContact CB-CE2 4.28Å; P53-T110 HydrophobicContact CB-CG2 4.03Å; P53-T110 HydrophobicContact CG-CG2 4.01Å; P53-F113 VanDerWaalsContact CD-CD1 3.43Å; P53-F113 HydrophobicContact CG-CB 3.89Å; P53-F113 HydrophobicContact CG-CD1 3.77Å; P53-F113 HydrophobicContact CG-CG 3.85Å
54	N	93.8	Very high	92.1	Very high	106 Å²	106	70.5 Å²	70.5	57%	0.567	36%	0.361	S	S	*	.			trans	-85.8	88	169.8	-176.4	-13.6	0	0	0	109.8	R56 S57 Y58	N54-R56 PolarHBondContact O-N 2.94Å; N54-R56 WeakPolarHBondContact OD1-CB 3.21Å; N54-R56 PolarHBondContact OD1-N 3.27Å; N54-S57 WeakPolarHBondContact O-CB 3.44Å; N54-S57 PolarHBondContact O-N 3.45Å; N54-S57 VanDerWaalsContact O-N 3.11Å; N54-S57 PolarHBondContact OD1-N 3.17Å; N54-Y58 WeakPolarHBondContact O-CD2 3.22Å; N54-Y58 PolarHBondContact O-N 3.2Å
55	W	95	Very high	92.3	Very high	12 Å²	12	72.1 Å²	72.1	5%	0.045	37%	0.373	C	S	.	.	H	α-helix	trans	-58.1	-31.3	-179.5	-56.1	118.8	0	0	0	113.7	P53 S57 Y58 L59 F69 I72 E76 L101 I105 T110 F113 V114 M117	P53-W55 HydrophobicContact CB-CD2 4.17Å; P53-W55 HydrophobicContact CB-CE3 4.22Å; P53-W55 HydrophobicContact CB-CH2 3.84Å; P53-W55 HydrophobicContact CB-CZ2 3.78Å; P53-W55 HydrophobicContact CB-CZ3 4.05Å; P53-W55 HydrophobicContact CG-CH2 3.76Å; P53-W55 HydrophobicContact CG-CZ2 3.66Å; P53-W55 HydrophobicContact CG-CZ3 4.43Å; P53-W55 PolarHBondContact O-N 3.44Å; W55-S57 VanDerWaalsContact C-N 3.3Å; W55-S57 PolarHBondContact O-N 3.08Å; W55-Y58 HydrophobicContact CE3-CD2 4.13Å; W55-Y58 WeakPolarHBondContact O-CB 3.46Å; W55-Y58 PolarHBondContact O-N 3.29Å; W55-Y58 VanDerWaalsContact O-N 3.15Å; W55-L59 PolarHBondContact O-N 3Å; W55-F69 HydrophobicContact CB-CD2 3.77Å; W55-F69 HydrophobicContact CB-CE2 3.83Å; W55-I72 HydrophobicContact CB-CG2 4.27Å; W55-I72 HydrophobicContact CD2-CG1 4.21Å; W55-I72 HydrophobicContact CD2-CG2 3.8Å; W55-I72 HydrophobicContact CE3-CG2 4.26Å; W55-I72 HydrophobicContact CG-CG2 3.79Å; W55-I72 HydrophobicContact CH2-CG1 4.22Å; W55-I72 HydrophobicContact CZ2-CG1 3.77Å; W55-E76 WeakPolarHBondContact CZ2-OE1 3.35Å; W55-E76 VanDerWaalsContact NE1-CD 3.26Å; W55-E76 PolarHBondContact NE1-OE1 2.89Å; W55-E76 PolarHBondContact NE1-OE2 3.38Å; W55-L101 HydrophobicContact CE3-CD2 4.38Å; W55-L101 HydrophobicContact CH2-CD1 4.16Å; W55-L101 HydrophobicContact CZ3-CD1 4.08Å; W55-L101 HydrophobicContact CZ3-CD2 3.87Å; W55-I105 HydrophobicContact CZ3-CD1 4.43Å; W55-T110 HydrophobicContact CH2-CG2 3.88Å; W55-T110 HydrophobicContact CZ3-CG2 3.72Å; W55-F113 HydrophobicContact CZ2-CD1 4.19Å; W55-F113 HydrophobicContact CZ2-CE1 4.43Å; W55-V114 HydrophobicContact CH2-CG2 3.82Å; W55-M117 HydrophobicContact CH2-CE 4.3Å; W55-M117 HydrophobicContact CZ2-CE 3.95Å
56	R	94.4	Very high	92.5	Very high	166 Å²	166	76.7 Å²	76.7	63%	0.626	39%	0.394	S	S	*	.	H	α-helix	trans	-65.5	-36.4	178.9	-171.4	172.4	-176.8	142.9	0.7	111.5	N54 Y58 L59 Q60 F69	N54-R56 PolarHBondContact O-N 2.94Å; N54-R56 WeakPolarHBondContact OD1-CB 3.21Å; N54-R56 PolarHBondContact OD1-N 3.27Å; R56-Y58 VanDerWaalsContact C-N 3.33Å; R56-L59 PolarHBondContact O-N 2.91Å; R56-Q60 WeakPolarHBondContact O-CB 3.35Å; R56-Q60 VanDerWaalsContact O-CG 3.3Å; R56-Q60 WeakPolarHBondContact O-CG 3.47Å; R56-Q60 PolarHBondContact O-N 3.18Å; R56-F69 HydrophobicContact CB-CE2 4.12Å
57	S	93.8	Very high	92.7	Very high	60 Å²	60	77.6 Å²	77.6	42%	0.42	40%	0.398	S	S	.	.	H	α-helix	trans	-63.2	-40.3	173.6	-173.7	0	0	0	0	111.6	N54 W55 Q60 S61	N54-S57 WeakPolarHBondContact O-CB 3.44Å; N54-S57 PolarHBondContact O-N 3.45Å; N54-S57 VanDerWaalsContact O-N 3.11Å; N54-S57 PolarHBondContact OD1-N 3.17Å; W55-S57 VanDerWaalsContact C-N 3.3Å; W55-S57 PolarHBondContact O-N 3.08Å; S57-Q60 PolarHBondContact O-N 3.47Å; S57-S61 PolarHBondContact O-N 2.64Å; S57-S61 PolarHBondContact O-OG 2.94Å
58	Y	94.4	Very high	92.9	Very high	22 Å²	22	71.4 Å²	71.4	9%	0.086	37%	0.369	C	S	.	.	H	α-helix	trans	-68	-36.5	178.2	-74.8	-67.2	0	0	0	112.9	P53 N54 W55 R56 S61 S62 M63 I105 K107 T110	P53-Y58 HydrophobicContact CB-CE2 4.28Å; N54-Y58 WeakPolarHBondContact O-CD2 3.22Å; N54-Y58 PolarHBondContact O-N 3.2Å; W55-Y58 HydrophobicContact CE3-CD2 4.13Å; W55-Y58 WeakPolarHBondContact O-CB 3.46Å; W55-Y58 PolarHBondContact O-N 3.29Å; W55-Y58 VanDerWaalsContact O-N 3.15Å; R56-Y58 VanDerWaalsContact C-N 3.33Å; Y58-S61 WeakPolarHBondContact CA-OG 3.49Å; Y58-S61 PolarHBondContact O-OG 3.5Å; Y58-S61 VanDerWaalsContact O-OG 3.1Å; Y58-S62 PolarHBondContact O-N 2.89Å; Y58-M63 HydrophobicContact CD1-CB 4.07Å; Y58-M63 HydrophobicContact CD1-CG 4.46Å; Y58-M63 HydrophobicContact CD1-SD 3.61Å; Y58-M63 HydrophobicContact CE1-SD 3.8Å; Y58-M63 PolarHBondContact O-N 3.32Å; Y58-I105 HydrophobicContact CD1-CD1 4.32Å; Y58-I105 HydrophobicContact CE1-CD1 4.38Å; Y58-I105 HydrophobicContact CE1-CG2 3.86Å; Y58-K107 WeakPolarHBondContact OH-CB 3.43Å; Y58-K107 WeakPolarHBondContact OH-CD 3.24Å; Y58-T110 HydrophobicContact CE2-CG2 3.94Å; Y58-T110 PolarHBondContact OH-OG1 2.71Å
59	L	93.8	Very high	93.1	Very high	39 Å²	39	73.2 Å²	73.2	20%	0.204	38%	0.377	C	S	.	.	H	α-helix	trans	-66.2	-45.1	173.6	178.2	66	0	0	0	111	W55 R56 S61 S62 I64 F69	W55-L59 PolarHBondContact O-N 3Å; R56-L59 PolarHBondContact O-N 2.91Å; L59-S61 VanDerWaalsContact C-N 3.27Å; L59-S61 PolarHBondContact O-N 3.4Å; L59-S62 PolarHBondContact O-N 3.33Å; L59-I64 HydrophobicContact CB-CD1 4.42Å; L59-I64 HydrophobicContact CB-CG1 4.19Å; L59-F69 HydrophobicContact CB-CB 4.4Å; L59-F69 HydrophobicContact CB-CD2 4.11Å; L59-F69 HydrophobicContact CB-CG 4.33Å; L59-F69 HydrophobicContact CD1-CB 4.22Å; L59-F69 HydrophobicContact CD2-CB 4.11Å; L59-F69 HydrophobicContact CD2-CD1 3.88Å; L59-F69 HydrophobicContact CD2-CD2 4.09Å; L59-F69 HydrophobicContact CD2-CE1 4.35Å; L59-F69 HydrophobicContact CD2-CG 3.73Å; L59-F69 HydrophobicContact CG-CB 4.48Å; L59-F69 HydrophobicContact CG-CG 4.48Å
60	Q	94.5	Very high	93.3	Very high	140 Å²	140	73.9 Å²	73.9	65%	0.654	39%	0.386	S	S	*	.	H	α-helix	trans	-63.9	-32	178.1	-75.4	175.4	-23	0	0	112.8	R56 S57 S62	R56-Q60 WeakPolarHBondContact O-CB 3.35Å; R56-Q60 VanDerWaalsContact O-CG 3.3Å; R56-Q60 WeakPolarHBondContact O-CG 3.47Å; R56-Q60 PolarHBondContact O-N 3.18Å; S57-Q60 PolarHBondContact O-N 3.47Å; Q60-S62 VanDerWaalsContact C-N 3.25Å; Q60-S62 PolarHBondContact O-N 3.26Å
61	S	91.7	Very high	93.7	Very high	58 Å²	58	69.7 Å²	69.7	41%	0.406	36%	0.356	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.1	8.8	174.4	67.3	0	0	0	0	113.8	S57 Y58 L59 M63	S57-S61 PolarHBondContact O-N 2.64Å; S57-S61 PolarHBondContact O-OG 2.94Å; Y58-S61 WeakPolarHBondContact CA-OG 3.49Å; Y58-S61 PolarHBondContact O-OG 3.5Å; Y58-S61 VanDerWaalsContact O-OG 3.1Å; L59-S61 VanDerWaalsContact C-N 3.27Å; L59-S61 PolarHBondContact O-N 3.4Å; S61-M63 PolarHBondContact O-N 3.33Å; S61-M63 VanDerWaalsContact O-N 3.08Å; S61-M63 WeakPolarHBondContact OG-CG 3.45Å
62	S	90.3	Very high	94.1	Very high	111 Å²	111	66.8 Å²	66.8	78%	0.776	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	54.2	25.5	-177.4	-56.7	0	0	0	0	114.6	Y58 L59 Q60	Y58-S62 PolarHBondContact O-N 2.89Å; L59-S62 PolarHBondContact O-N 3.33Å; Q60-S62 VanDerWaalsContact C-N 3.25Å; Q60-S62 PolarHBondContact O-N 3.26Å
63	M	90	Very high	94.3	Very high	86 Å²	86	61.6 Å²	61.6	42%	0.424	32%	0.323	S	S	.	.	S	Bend	trans	-81.5	-21.9	177	-72.7	-178.2	-175.1	0	0	112.2	Y58 S61	Y58-M63 HydrophobicContact CD1-CB 4.07Å; Y58-M63 HydrophobicContact CD1-CG 4.46Å; Y58-M63 HydrophobicContact CD1-SD 3.61Å; Y58-M63 HydrophobicContact CE1-SD 3.8Å; Y58-M63 PolarHBondContact O-N 3.32Å; S61-M63 PolarHBondContact O-N 3.33Å; S61-M63 VanDerWaalsContact O-N 3.08Å; S61-M63 WeakPolarHBondContact OG-CG 3.45Å
64	I	93.9	Very high	94.5	Very high	8 Å²	8	65.3 Å²	65.3	4%	0.041	34%	0.339	C	S	.	.	S	Bend	trans	-132.6	152.1	177.7	68.2	175.2	0	0	0	109.5	L59 D68 F69 L101 I105	L59-I64 HydrophobicContact CB-CD1 4.42Å; L59-I64 HydrophobicContact CB-CG1 4.19Å; I64-D68 HydrophobicContact CB-CB 4.21Å; I64-F69 HydrophobicContact CD1-CB 3.98Å; I64-F69 HydrophobicContact CD1-CD2 4.34Å; I64-L101 HydrophobicContact CB-CD2 4.39Å; I64-L101 HydrophobicContact CG2-CD2 3.41Å; I64-L101 VanDerWaalsContact CG2-CD2 3.41Å; I64-I105 HydrophobicContact CG2-CD1 4.14Å
65	T	94.8	Very high	94.6	Very high	64 Å²	64	60.4 Å²	60.4	39%	0.393	31%	0.312	S	S	.	.			trans	-78.6	164.6	177.9	68	0	0	0	0	111.8	E67 D68 F69	T65-E67 PolarHBondContact O-N 3.38Å; T65-D68 PolarHBondContact N-OD2 3.44Å; T65-D68 PolarHBondContact O-N 3.35Å; T65-D68 PolarHBondContact OG1-N 2.74Å; T65-D68 VanDerWaalsContact OG1-N 3.13Å; T65-D68 PolarHBondContact OG1-OD2 3.12Å; T65-F69 PolarHBondContact O-N 2.75Å
66	Q	96	Very high	94.5	Very high	102 Å²	102	61.6 Å²	61.6	48%	0.477	32%	0.318	S	S	.	.	H	α-helix	trans	-61.4	-35.4	173.2	-172.9	63.9	55.3	0	0	111.9	F69 N70	Q66-F69 PolarHBondContact O-N 2.88Å; Q66-N70 PolarHBondContact NE2-OD1 2.8Å; Q66-N70 WeakPolarHBondContact O-CB 3.47Å; Q66-N70 PolarHBondContact O-N 3.08Å; Q66-N70 PolarHBondContact O-ND2 2.98Å; Q66-N70 PolarHBondContact O-OD1 2.97Å
67	E	95.6	Very high	94.4	Very high	105 Å²	105	57.6 Å²	57.6	49%	0.491	32%	0.316	S	S	.	.	H	α-helix	trans	-63.6	-45	175.5	-62.9	178.4	166	0	0	111.1	T65 N70 F71 K96	T65-E67 PolarHBondContact O-N 3.38Å; E67-N70 PolarHBondContact O-N 2.6Å; E67-F71 WeakPolarHBondContact O-CB 3.42Å; E67-F71 PolarHBondContact O-N 3.39Å; E67-K96 IonicContact OE2-NZ 2.72Å; E67-K96 PolarHBondContact OE2-NZ 3.08Å
68	D	95.7	Very high	94.3	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.011	30%	0.3	C	S	.	.	H	α-helix	trans	-63.1	-44.8	177.2	-63.7	-36.7	0	0	0	111.7	I64 T65 F71 I72 Q93 T97	I64-D68 HydrophobicContact CB-CB 4.21Å; T65-D68 PolarHBondContact N-OD2 3.44Å; T65-D68 PolarHBondContact O-N 3.35Å; T65-D68 PolarHBondContact OG1-N 2.74Å; T65-D68 VanDerWaalsContact OG1-N 3.13Å; T65-D68 PolarHBondContact OG1-OD2 3.12Å; D68-F71 PolarHBondContact O-N 2.99Å; D68-I72 WeakPolarHBondContact O-CB 3.37Å; D68-I72 VanDerWaalsContact O-CG2 3.29Å; D68-I72 WeakPolarHBondContact O-CG2 3.38Å; D68-I72 PolarHBondContact O-N 3.32Å; D68-Q93 PolarHBondContact OD1-NE2 3.08Å; D68-T97 WeakPolarHBondContact CA-OG1 3.21Å; D68-T97 HydrophobicContact CB-CG2 3.91Å; D68-T97 VanDerWaalsContact OD1-CA 3.29Å; D68-T97 WeakPolarHBondContact OD1-CA 3.44Å; D68-T97 WeakPolarHBondContact OD1-CB 3.41Å; D68-T97 PolarHBondContact OD1-OG1 3.01Å
69	F	96.2	Very high	94.1	Very high	42 Å²	42	61.6 Å²	61.6	18%	0.184	33%	0.327	C	S	.	.	H	α-helix	trans	-60.3	-46.1	176.8	174	-94.7	0	0	0	112.2	W55 R56 L59 I64 T65 Q66 T73	W55-F69 HydrophobicContact CB-CD2 3.77Å; W55-F69 HydrophobicContact CB-CE2 3.83Å; R56-F69 HydrophobicContact CB-CE2 4.12Å; L59-F69 HydrophobicContact CB-CB 4.4Å; L59-F69 HydrophobicContact CB-CD2 4.11Å; L59-F69 HydrophobicContact CB-CG 4.33Å; L59-F69 HydrophobicContact CD1-CB 4.22Å; L59-F69 HydrophobicContact CD2-CB 4.11Å; L59-F69 HydrophobicContact CD2-CD1 3.88Å; L59-F69 HydrophobicContact CD2-CD2 4.09Å; L59-F69 HydrophobicContact CD2-CE1 4.35Å; L59-F69 HydrophobicContact CD2-CG 3.73Å; L59-F69 HydrophobicContact CG-CB 4.48Å; L59-F69 HydrophobicContact CG-CG 4.48Å; I64-F69 HydrophobicContact CD1-CB 3.98Å; I64-F69 HydrophobicContact CD1-CD2 4.34Å; T65-F69 PolarHBondContact O-N 2.75Å; Q66-F69 PolarHBondContact O-N 2.88Å; F69-T73 WeakPolarHBondContact O-CB 3.48Å; F69-T73 PolarHBondContact O-N 2.97Å; F69-T73 VanDerWaalsContact O-N 3.14Å; F69-T73 PolarHBondContact O-OG1 3.19Å
70	N	96.4	Very high	94	Very high	87 Å²	87	62.1 Å²	62.1	47%	0.465	34%	0.342	S	S	.	.	H	α-helix	trans	-62.6	-46.9	179.2	-70.4	-11.3	0	0	0	110.6	Q66 E67 Q74	Q66-N70 PolarHBondContact NE2-OD1 2.8Å; Q66-N70 WeakPolarHBondContact O-CB 3.47Å; Q66-N70 PolarHBondContact O-N 3.08Å; Q66-N70 PolarHBondContact O-ND2 2.98Å; Q66-N70 PolarHBondContact O-OD1 2.97Å; E67-N70 PolarHBondContact O-N 2.6Å; N70-Q74 VanDerWaalsContact O-CB 3.32Å; N70-Q74 WeakPolarHBondContact O-CB 3.39Å; N70-Q74 PolarHBondContact O-N 3.45Å; N70-Q74 VanDerWaalsContact O-N 3.13Å
71	F	97.2	Very high	93.8	Very high	8 Å²	8	60.7 Å²	60.7	4%	0.035	34%	0.336	C	S	.	.	H	α-helix	trans	-64.6	-49.6	-179.4	-177	-88.4	0	0	0	111.8	E67 D68 T73 Q74 Y75 L86 L87 N90 Q93 C94 T97 F98	E67-F71 WeakPolarHBondContact O-CB 3.42Å; E67-F71 PolarHBondContact O-N 3.39Å; D68-F71 PolarHBondContact O-N 2.99Å; F71-T73 PolarHBondContact O-N 3.46Å; F71-Q74 PolarHBondContact O-N 2.67Å; F71-Y75 HydrophobicContact CE1-CD2 4.29Å; F71-Y75 HydrophobicContact CE1-CG 4.41Å; F71-Y75 HydrophobicContact CZ-CD2 4.33Å; F71-Y75 WeakPolarHBondContact O-CB 3.37Å; F71-Y75 PolarHBondContact O-N 3.11Å; F71-L86 HydrophobicContact CE2-CD1 4.33Å; F71-L86 HydrophobicContact CE2-CD2 4.4Å; F71-L86 HydrophobicContact CE2-CG 4.13Å; F71-L87 HydrophobicContact CZ-CD2 4.2Å; F71-N90 HydrophobicContact CD2-CB 4.41Å; F71-N90 HydrophobicContact CE2-CB 4.11Å; F71-Q93 HydrophobicContact CB-CG 3.98Å; F71-Q93 HydrophobicContact CD2-CB 4.25Å; F71-Q93 HydrophobicContact CD2-CG 3.84Å; F71-Q93 HydrophobicContact CG-CG 4.01Å; F71-C94 HydrophobicContact CE1-CB 3.93Å; F71-C94 HydrophobicContact CE2-CB 3.98Å; F71-C94 VanDerWaalsContact CZ-CA 3.41Å; F71-C94 HydrophobicContact CZ-CB 3.35Å; F71-T97 HydrophobicContact CD1-CG2 4.02Å; F71-F98 HydrophobicContact CE1-CE2 4.36Å
72	I	96.2	Very high	93.9	Very high	0 Å²	0	63.9 Å²	63.9	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-66.6	-39.4	-174.5	-161.6	61.4	0	0	0	112.1	W55 D68 Q74 Y75 E76 T97 F98 L101 M117	W55-I72 HydrophobicContact CB-CG2 4.27Å; W55-I72 HydrophobicContact CD2-CG1 4.21Å; W55-I72 HydrophobicContact CD2-CG2 3.8Å; W55-I72 HydrophobicContact CE3-CG2 4.26Å; W55-I72 HydrophobicContact CG-CG2 3.79Å; W55-I72 HydrophobicContact CH2-CG1 4.22Å; W55-I72 HydrophobicContact CZ2-CG1 3.77Å; D68-I72 WeakPolarHBondContact O-CB 3.37Å; D68-I72 VanDerWaalsContact O-CG2 3.29Å; D68-I72 WeakPolarHBondContact O-CG2 3.38Å; D68-I72 PolarHBondContact O-N 3.32Å; I72-Q74 VanDerWaalsContact C-N 3.34Å; I72-Q74 PolarHBondContact O-N 3.01Å; I72-Y75 PolarHBondContact O-N 3.49Å; I72-E76 PolarHBondContact O-N 3.2Å; I72-T97 HydrophobicContact CB-CG2 4.23Å; I72-F98 HydrophobicContact CD1-CE1 4.1Å; I72-F98 HydrophobicContact CD1-CZ 4.39Å; I72-L101 HydrophobicContact CB-CD1 4.34Å; I72-L101 HydrophobicContact CD1-CD1 3.83Å; I72-L101 HydrophobicContact CG1-CD1 3.86Å; I72-M117 HydrophobicContact CD1-CE 3.67Å; I72-M117 HydrophobicContact CD1-SD 4.04Å; I72-M117 HydrophobicContact CG1-CE 4.33Å
73	T	95.3	Very high	94.1	Very high	60 Å²	60	60.1 Å²	60.1	37%	0.368	31%	0.313	S	S	.	.	H	α-helix	trans	-64.9	-41.3	176.7	-54	0	0	0	0	110.8	F69 F71 S77	F69-T73 WeakPolarHBondContact O-CB 3.48Å; F69-T73 PolarHBondContact O-N 2.97Å; F69-T73 VanDerWaalsContact O-N 3.14Å; F69-T73 PolarHBondContact O-OG1 3.19Å; F71-T73 PolarHBondContact O-N 3.46Å; T73-S77 PolarHBondContact O-N 3.06Å; T73-S77 PolarHBondContact O-OG 2.9Å
74	Q	95	Very high	94.2	Very high	94 Å²	94	60.9 Å²	60.9	44%	0.439	31%	0.314	S	S	.	.	H	α-helix	trans	-65.8	-45.3	175.8	-168.3	177.5	11.1	0	0	111.3	N70 F71 I72 E76 S77 C78 L86	N70-Q74 VanDerWaalsContact O-CB 3.32Å; N70-Q74 WeakPolarHBondContact O-CB 3.39Å; N70-Q74 PolarHBondContact O-N 3.45Å; N70-Q74 VanDerWaalsContact O-N 3.13Å; F71-Q74 PolarHBondContact O-N 2.67Å; I72-Q74 VanDerWaalsContact C-N 3.34Å; I72-Q74 PolarHBondContact O-N 3.01Å; Q74-E76 VanDerWaalsContact C-N 3.35Å; Q74-E76 PolarHBondContact O-N 3.25Å; Q74-S77 PolarHBondContact O-N 3.24Å; Q74-S77 VanDerWaalsContact O-N 3.13Å; Q74-S77 PolarHBondContact O-OG 3.43Å; Q74-C78 PolarHBondContact O-N 3.47Å; Q74-C78 PolarHBondContact O-SG 3.49Å; Q74-C78 VanDerWaalsContact O-SG 3.36Å; Q74-L86 HydrophobicContact CB-CD2 4.28Å; Q74-L86 VanDerWaalsContact CD-CD1 3.47Å; Q74-L86 HydrophobicContact CG-CD1 4.13Å; Q74-L86 HydrophobicContact CG-CD2 3.97Å
75	Y	96	Very high	94.3	Very high	3 Å²	3	63.9 Å²	63.9	1%	0.012	33%	0.33	C	S	.	.	H	α-helix	trans	-58.5	-43	179.1	-179.4	-89.3	0	0	0	112.6	F71 I72 S77 R83 L86 L87 F98 M117 M121	F71-Y75 HydrophobicContact CE1-CD2 4.29Å; F71-Y75 HydrophobicContact CE1-CG 4.41Å; F71-Y75 HydrophobicContact CZ-CD2 4.33Å; F71-Y75 WeakPolarHBondContact O-CB 3.37Å; F71-Y75 PolarHBondContact O-N 3.11Å; I72-Y75 PolarHBondContact O-N 3.49Å; Y75-S77 VanDerWaalsContact C-N 3.33Å; Y75-S77 PolarHBondContact O-N 2.82Å; Y75-R83 HydrophobicContact CD2-CG 4.31Å; Y75-R83 HydrophobicContact CE2-CG 3.86Å; Y75-L86 HydrophobicContact CD2-CD2 4.39Å; Y75-L87 HydrophobicContact CD2-CD2 4.17Å; Y75-L87 HydrophobicContact CE2-CD1 4.29Å; Y75-L87 HydrophobicContact CE2-CD2 3.95Å; Y75-L87 HydrophobicContact CE2-CG 4.35Å; Y75-F98 HydrophobicContact CD1-CZ 4.06Å; Y75-F98 AromaticContact CE1-CZ 3.88Å; Y75-F98 HydrophobicContact CE1-CZ 3.88Å; Y75-F98 HydrophobicContact CE2-CE2 4.47Å; Y75-F98 HydrophobicContact CE2-CZ 4.4Å; Y75-F98 HydrophobicContact CG-CZ 4.43Å; Y75-M117 HydrophobicContact CD1-SD 4.11Å; Y75-M117 HydrophobicContact CE1-CB 4.2Å; Y75-M117 HydrophobicContact CE1-CG 4.36Å; Y75-M117 HydrophobicContact CE1-SD 4.17Å; Y75-M121 HydrophobicContact CE2-SD 4.38Å; Y75-M121 VanDerWaalsContact OH-CB 3.31Å; Y75-M121 WeakPolarHBondContact OH-CB 3.05Å
76	E	93.4	Very high	94.3	Very high	36 Å²	36	61.2 Å²	61.2	17%	0.168	31%	0.313	C	S	.	.	H	α-helix	trans	-66.7	-33.2	176.3	-76.3	-170.6	-178.4	0	0	113.5	W55 I72 Q74 F113 M117	W55-E76 WeakPolarHBondContact CZ2-OE1 3.35Å; W55-E76 VanDerWaalsContact NE1-CD 3.26Å; W55-E76 PolarHBondContact NE1-OE1 2.89Å; W55-E76 PolarHBondContact NE1-OE2 3.38Å; I72-E76 PolarHBondContact O-N 3.2Å; Q74-E76 VanDerWaalsContact C-N 3.35Å; Q74-E76 PolarHBondContact O-N 3.25Å; E76-F113 WeakPolarHBondContact OE1-CE1 3.36Å; E76-M117 HydrophobicContact CG-SD 3.98Å
77	S	92	Very high	94.3	Very high	83 Å²	83	56.6 Å²	56.6	58%	0.58	29%	0.292	S	S	*	.	H	α-helix	trans	-75.8	-35.2	179.6	71.3	0	0	0	0	112.7	T73 Q74 Y75	T73-S77 PolarHBondContact O-N 3.06Å; T73-S77 PolarHBondContact O-OG 2.9Å; Q74-S77 PolarHBondContact O-N 3.24Å; Q74-S77 VanDerWaalsContact O-N 3.13Å; Q74-S77 PolarHBondContact O-OG 3.43Å; Y75-S77 VanDerWaalsContact C-N 3.33Å; Y75-S77 PolarHBondContact O-N 2.82Å
78	C	91.7	Very high	94.2	Very high	13 Å²	13	55.4 Å²	55.4	9%	0.088	30%	0.295	C	S	.	.			trans	-82.5	142.4	-177.1	-67.7	0	0	0	0	112.1	Q74 E82 R83	Q74-C78 PolarHBondContact O-N 3.47Å; Q74-C78 PolarHBondContact O-SG 3.49Å; Q74-C78 VanDerWaalsContact O-SG 3.36Å; C78-E82 HydrophobicContact CB-CB 3.94Å; C78-R83 HydrophobicContact CB-CB 4.23Å; C78-R83 PolarHBondContact O-NE 3.12Å; C78-R83 PolarHBondContact O-NH2 3.05Å
79	K	91.1	Very high	94.1	Very high	152 Å²	152	63 Å²	63	66%	0.661	33%	0.328	S	S	*	.			trans	-135.5	160.2	174.8	-64.3	-176.2	-178.6	-179.3	0	111	E81 E82	K79-E81 PolarHBondContact O-N 3.19Å; K79-E82 PolarHBondContact O-N 3.44Å
80	G	90.4	Very high	94.1	Very high	50 Å²	50	64.3 Å²	64.3	52%	0.515	34%	0.337	S	S	.	.	H	α-helix	trans	53.3	-125.1	175.1	0	0	0	0	0	112.7	E82 R83 K84	G80-E82 VanDerWaalsContact C-N 3.33Å; G80-E82 PolarHBondContact O-N 3.45Å; G80-R83 PolarHBondContact O-N 3.45Å; G80-K84 PolarHBondContact O-N 3.43Å
81	E	91.6	Very high	94	Very high	110 Å²	110	62.8 Å²	62.8	51%	0.514	33%	0.332	S	S	.	.	H	α-helix	trans	-65.1	-32.7	-175.6	-164.7	58.5	-153.9	0	0	113.3	K79 R83 K84 N85	K79-E81 PolarHBondContact O-N 3.19Å; E81-R83 VanDerWaalsContact C-N 3.34Å; E81-R83 PolarHBondContact O-N 2.99Å; E81-K84 PolarHBondContact O-N 3.22Å; E81-K84 IonicContact OE1-NZ 2.73Å; E81-K84 WeakPolarHBondContact OE2-CD 3.2Å; E81-K84 IonicContact OE2-NZ 2.86Å; E81-N85 WeakPolarHBondContact O-CB 3.43Å; E81-N85 VanDerWaalsContact O-CG 3.31Å; E81-N85 PolarHBondContact O-N 3.12Å; E81-N85 PolarHBondContact O-ND2 3.39Å; E81-N85 VanDerWaalsContact O-ND2 3.08Å
82	E	93.2	Very high	93.9	Very high	125 Å²	125	64.4 Å²	64.4	58%	0.584	35%	0.347	S	S	*	.	H	α-helix	trans	-64.1	-41.9	175.9	-65.5	-177.7	173	0	0	111.5	C78 K79 G80 N85 L86	C78-E82 HydrophobicContact CB-CB 3.94Å; K79-E82 PolarHBondContact O-N 3.44Å; G80-E82 VanDerWaalsContact C-N 3.33Å; G80-E82 PolarHBondContact O-N 3.45Å; E82-N85 PolarHBondContact O-N 3.34Å; E82-L86 WeakPolarHBondContact O-CB 3.46Å; E82-L86 PolarHBondContact O-N 2.99Å
83	R	94.3	Very high	93.9	Very high	32 Å²	32	66.2 Å²	66.2	12%	0.121	36%	0.355	C	S	.	.	H	α-helix	trans	-66	-43.6	176.8	-178.3	-178.3	-63.9	-179.4	-8.2	110.8	Y75 C78 G80 E81 N85 L86 L87 E124	Y75-R83 HydrophobicContact CD2-CG 4.31Å; Y75-R83 HydrophobicContact CE2-CG 3.86Å; C78-R83 HydrophobicContact CB-CB 4.23Å; C78-R83 PolarHBondContact O-NE 3.12Å; C78-R83 PolarHBondContact O-NH2 3.05Å; G80-R83 PolarHBondContact O-N 3.45Å; E81-R83 VanDerWaalsContact C-N 3.34Å; E81-R83 PolarHBondContact O-N 2.99Å; R83-N85 VanDerWaalsContact C-N 3.3Å; R83-N85 PolarHBondContact O-N 3.24Å; R83-L86 WeakPolarHBondContact O-CB 3.5Å; R83-L86 PolarHBondContact O-N 3.41Å; R83-L87 HydrophobicContact CG-CD1 4.12Å; R83-L87 HydrophobicContact CG-CG 4.45Å; R83-L87 VanDerWaalsContact O-CG 3.29Å; R83-L87 WeakPolarHBondContact O-CG 3.23Å; R83-L87 PolarHBondContact O-N 3.31Å; R83-E124 WeakPolarHBondContact CD-OE2 3.38Å; R83-E124 IonicContact CZ-OE1 3.94Å; R83-E124 IonicContact NH1-OE1 3.96Å; R83-E124 PolarHBondContact NH1-OE1 3.47Å
84	K	93.3	Very high	94	Very high	103 Å²	103	63.4 Å²	63.4	45%	0.448	34%	0.338	S	S	.	.	H	α-helix	trans	-57.5	-44.2	174.7	-174.3	-177	173.3	-168.1	0	111.4	G80 E81 L87 S88	G80-K84 PolarHBondContact O-N 3.43Å; E81-K84 PolarHBondContact O-N 3.22Å; E81-K84 IonicContact OE1-NZ 2.73Å; E81-K84 WeakPolarHBondContact OE2-CD 3.2Å; E81-K84 IonicContact OE2-NZ 2.86Å; K84-L87 PolarHBondContact O-N 3.21Å; K84-S88 WeakPolarHBondContact O-CB 3.37Å; K84-S88 PolarHBondContact O-N 3.05Å; K84-S88 PolarHBondContact O-OG 3.09Å
85	N	94.9	Very high	94.1	Very high	71 Å²	71	58.9 Å²	58.9	38%	0.38	32%	0.317	S	S	.	.	H	α-helix	trans	-66.6	-36.2	176.1	-75.5	-38.9	0	0	0	113.5	E81 E82 R83 S88 K89	E81-N85 WeakPolarHBondContact O-CB 3.43Å; E81-N85 VanDerWaalsContact O-CG 3.31Å; E81-N85 PolarHBondContact O-N 3.12Å; E81-N85 PolarHBondContact O-ND2 3.39Å; E81-N85 VanDerWaalsContact O-ND2 3.08Å; E82-N85 PolarHBondContact O-N 3.34Å; R83-N85 VanDerWaalsContact C-N 3.3Å; R83-N85 PolarHBondContact O-N 3.24Å; N85-S88 WeakPolarHBondContact CA-OG 3.47Å; N85-S88 PolarHBondContact O-OG 3.01Å; N85-S88 VanDerWaalsContact O-OG 3.06Å; N85-K89 WeakPolarHBondContact O-CB 3.45Å; N85-K89 VanDerWaalsContact O-CG 3.26Å; N85-K89 WeakPolarHBondContact O-CG 3.34Å; N85-K89 PolarHBondContact O-N 3.02Å; N85-K89 VanDerWaalsContact O-N 3.16Å
86	L	95.2	Very high	94.1	Very high	7 Å²	7	62 Å²	62	4%	0.037	33%	0.33	C	S	.	.	H	α-helix	trans	-63.7	-47	174.5	177.3	63.1	0	0	0	111.2	F71 Q74 Y75 E82 R83 K89 N90	F71-L86 HydrophobicContact CE2-CD1 4.33Å; F71-L86 HydrophobicContact CE2-CD2 4.4Å; F71-L86 HydrophobicContact CE2-CG 4.13Å; Q74-L86 HydrophobicContact CB-CD2 4.28Å; Q74-L86 VanDerWaalsContact CD-CD1 3.47Å; Q74-L86 HydrophobicContact CG-CD1 4.13Å; Q74-L86 HydrophobicContact CG-CD2 3.97Å; Y75-L86 HydrophobicContact CD2-CD2 4.39Å; E82-L86 WeakPolarHBondContact O-CB 3.46Å; E82-L86 PolarHBondContact O-N 2.99Å; R83-L86 WeakPolarHBondContact O-CB 3.5Å; R83-L86 PolarHBondContact O-N 3.41Å; L86-K89 PolarHBondContact O-N 3.05Å; L86-N90 PolarHBondContact O-N 3.41Å
87	L	95.5	Very high	94.3	Very high	6 Å²	6	60.2 Å²	60.2	3%	0.031	32%	0.322	C	S	.	.	H	α-helix	trans	-67.5	-38	-179	-68.3	175.3	0	0	0	112.4	F71 Y75 R83 K84 P91 C94 M121 R128	F71-L87 HydrophobicContact CZ-CD2 4.2Å; Y75-L87 HydrophobicContact CD2-CD2 4.17Å; Y75-L87 HydrophobicContact CE2-CD1 4.29Å; Y75-L87 HydrophobicContact CE2-CD2 3.95Å; Y75-L87 HydrophobicContact CE2-CG 4.35Å; R83-L87 HydrophobicContact CG-CD1 4.12Å; R83-L87 HydrophobicContact CG-CG 4.45Å; R83-L87 VanDerWaalsContact O-CG 3.29Å; R83-L87 WeakPolarHBondContact O-CG 3.23Å; R83-L87 PolarHBondContact O-N 3.31Å; K84-L87 PolarHBondContact O-N 3.21Å; L87-P91 WeakPolarHBondContact O-CA 3.35Å; L87-P91 WeakPolarHBondContact O-CD 3.4Å; L87-C94 HydrophobicContact CD2-CB 4.01Å; L87-C94 WeakPolarHBondContact CD2-SG 3.39Å; L87-M121 HydrophobicContact CD1-CG 3.92Å; L87-M121 HydrophobicContact CD1-SD 4.04Å; L87-M121 HydrophobicContact CD2-SD 3.85Å; L87-R128 VanDerWaalsContact CD1-CZ 3.49Å
88	S	93.5	Very high	94.5	Very high	80 Å²	80	56.3 Å²	56.3	56%	0.559	30%	0.295	S	S	*	.	H	α-helix	trans	-69.3	-34.6	176.9	67.1	0	0	0	0	112.6	K84 N85	K84-S88 WeakPolarHBondContact O-CB 3.37Å; K84-S88 PolarHBondContact O-N 3.05Å; K84-S88 PolarHBondContact O-OG 3.09Å; N85-S88 WeakPolarHBondContact CA-OG 3.47Å; N85-S88 PolarHBondContact O-OG 3.01Å; N85-S88 VanDerWaalsContact O-OG 3.06Å
89	K	94.9	Very high	94.7	Very high	160 Å²	160	57 Å²	57	70%	0.696	30%	0.297	S	S	*	.	H	α-helix	trans	-75.7	-36.6	176.8	-73.3	176.8	-179.4	180	0	113.2	N85 L86 P91	N85-K89 WeakPolarHBondContact O-CB 3.45Å; N85-K89 VanDerWaalsContact O-CG 3.26Å; N85-K89 WeakPolarHBondContact O-CG 3.34Å; N85-K89 PolarHBondContact O-N 3.02Å; N85-K89 VanDerWaalsContact O-N 3.16Å; L86-K89 PolarHBondContact O-N 3.05Å; K89-P91 VanDerWaalsContact C-CD 3.41Å
90	N	94.6	Very high	94.9	Very high	71 Å²	71	50.7 Å²	50.7	38%	0.38	27%	0.272	S	S	.	.			trans	-128.3	51.5	-171.2	-60.8	-64.5	0	0	0	113.8	F71 L86 A92 Q93 C94	F71-N90 HydrophobicContact CD2-CB 4.41Å; F71-N90 HydrophobicContact CE2-CB 4.11Å; L86-N90 PolarHBondContact O-N 3.41Å; N90-A92 PolarHBondContact O-N 3.17Å; N90-Q93 HydrophobicContact CB-CB 4.19Å; N90-Q93 PolarHBondContact O-N 3.21Å; N90-C94 PolarHBondContact O-N 3.12Å
91	P	94.8	Very high	95.1	Very high	54 Å²	54	48.3 Å²	48.3	35%	0.351	25%	0.248	S	C	.	.	H	α-helix	trans	-65.4	-42.3	-175.1	25.6	-33.9	0	0	0	112.5	L87 K89 Q93 C94 A95 I131	L87-P91 WeakPolarHBondContact O-CA 3.35Å; L87-P91 WeakPolarHBondContact O-CD 3.4Å; K89-P91 VanDerWaalsContact C-CD 3.41Å; P91-Q93 VanDerWaalsContact C-N 3.34Å; P91-Q93 PolarHBondContact O-N 3.19Å; P91-C94 VanDerWaalsContact O-CB 3.3Å; P91-C94 WeakPolarHBondContact O-CB 3.35Å; P91-C94 PolarHBondContact O-N 2.86Å; P91-A95 PolarHBondContact O-N 3.34Å; P91-A95 VanDerWaalsContact O-N 3.11Å; P91-I131 HydrophobicContact CB-CG1 4.19Å; P91-I131 HydrophobicContact CB-CG2 4.21Å; P91-I131 WeakPolarHBondContact O-CG2 3.43Å
92	A	95.2	Very high	95.3	Very high	42 Å²	42	43.1 Å²	43.1	35%	0.347	22%	0.224	S	C	.	.	H	α-helix	trans	-64.1	-39.9	179.2	0	0	0	0	0	112.1	N90 C94 A95 K96 Y135	N90-A92 PolarHBondContact O-N 3.17Å; A92-C94 VanDerWaalsContact C-N 3.34Å; A92-A95 PolarHBondContact O-N 3.34Å; A92-K96 WeakPolarHBondContact O-CB 3.41Å; A92-K96 PolarHBondContact O-N 2.9Å; A92-Y135 HydrophobicContact CB-CD2 4.44Å; A92-Y135 WeakPolarHBondContact O-CD2 3.47Å
93	Q	96.6	Very high	95.2	Very high	39 Å²	39	40.5 Å²	40.5	18%	0.182	22%	0.219	C	C	.	.	H	α-helix	trans	-66.6	-38.8	176.4	-173.3	58.6	35.2	0	0	111.2	D68 F71 N90 P91 K96 T97	D68-Q93 PolarHBondContact OD1-NE2 3.08Å; F71-Q93 HydrophobicContact CB-CG 3.98Å; F71-Q93 HydrophobicContact CD2-CB 4.25Å; F71-Q93 HydrophobicContact CD2-CG 3.84Å; F71-Q93 HydrophobicContact CG-CG 4.01Å; N90-Q93 HydrophobicContact CB-CB 4.19Å; N90-Q93 PolarHBondContact O-N 3.21Å; P91-Q93 VanDerWaalsContact C-N 3.34Å; P91-Q93 PolarHBondContact O-N 3.19Å; Q93-K96 PolarHBondContact O-N 3.36Å; Q93-T97 PolarHBondContact NE2-OG1 3.43Å; Q93-T97 WeakPolarHBondContact O-CB 3.3Å; Q93-T97 PolarHBondContact O-N 2.75Å; Q93-T97 PolarHBondContact O-OG1 3.25Å; Q93-T97 VanDerWaalsContact O-OG1 3.08Å
94	C	97.1	Very high	95	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-54.7	-54.9	173.9	-179.7	0	0	0	0	111.9	F71 L87 N90 P91 A92 T97 F98 M121 I131	F71-C94 HydrophobicContact CE1-CB 3.93Å; F71-C94 HydrophobicContact CE2-CB 3.98Å; F71-C94 VanDerWaalsContact CZ-CA 3.41Å; F71-C94 HydrophobicContact CZ-CB 3.35Å; L87-C94 HydrophobicContact CD2-CB 4.01Å; L87-C94 WeakPolarHBondContact CD2-SG 3.39Å; N90-C94 PolarHBondContact O-N 3.12Å; P91-C94 VanDerWaalsContact O-CB 3.3Å; P91-C94 WeakPolarHBondContact O-CB 3.35Å; P91-C94 PolarHBondContact O-N 2.86Å; A92-C94 VanDerWaalsContact C-N 3.34Å; C94-T97 PolarHBondContact O-N 3.06Å; C94-F98 VanDerWaalsContact O-CD2 3.22Å; C94-F98 WeakPolarHBondContact O-CD2 3.48Å; C94-F98 PolarHBondContact O-N 2.96Å; C94-F98 VanDerWaalsContact SG-CD2 3.54Å; C94-F98 VanDerWaalsContact SG-CE2 3.52Å; C94-M121 VanDerWaalsContact SG-SD 3.7Å; C94-I131 HydrophobicContact CB-CG2 4.2Å
95	A	96.5	Very high	94.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.7	-47.3	178.7	0	0	0	0	0	112.1	P91 A92 T97 F98 I99 I131 F132 Y135	P91-A95 PolarHBondContact O-N 3.34Å; P91-A95 VanDerWaalsContact O-N 3.11Å; A92-A95 PolarHBondContact O-N 3.34Å; A95-T97 PolarHBondContact O-N 3.24Å; A95-F98 PolarHBondContact O-N 3.44Å; A95-I99 VanDerWaalsContact O-CB 3.32Å; A95-I99 WeakPolarHBondContact O-CB 3.36Å; A95-I99 VanDerWaalsContact O-CG1 3.29Å; A95-I99 WeakPolarHBondContact O-CG1 3.37Å; A95-I99 PolarHBondContact O-N 2.99Å; A95-I131 HydrophobicContact CB-CG2 4.02Å; A95-F132 HydrophobicContact CB-CD1 3.99Å; A95-F132 HydrophobicContact CB-CE1 4.42Å; A95-Y135 HydrophobicContact CB-CD1 3.74Å; A95-Y135 HydrophobicContact CB-CD2 3.97Å; A95-Y135 HydrophobicContact CB-CG 3.38Å
96	K	96.4	Very high	94.4	Very high	67 Å²	67	39.9 Å²	39.9	29%	0.291	23%	0.23	S	C	.	.	H	α-helix	trans	-54	-52	177.1	-179.5	-177.6	172.6	-171.9	0	111.5	E67 A92 Q93 S100 Y135	E67-K96 IonicContact OE2-NZ 2.72Å; E67-K96 PolarHBondContact OE2-NZ 3.08Å; A92-K96 WeakPolarHBondContact O-CB 3.41Å; A92-K96 PolarHBondContact O-N 2.9Å; Q93-K96 PolarHBondContact O-N 3.36Å; K96-S100 WeakPolarHBondContact O-CB 3.36Å; K96-S100 PolarHBondContact O-N 2.94Å; K96-Y135 HydrophobicContact CB-CE2 3.65Å; K96-Y135 HydrophobicContact CG-CE2 4.4Å
97	T	97.2	Very high	94.3	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-64	-50.5	-177.8	-64.5	0	0	0	0	111.1	D68 F71 I72 Q93 C94 A95 I99 S100 L101	D68-T97 WeakPolarHBondContact CA-OG1 3.21Å; D68-T97 HydrophobicContact CB-CG2 3.91Å; D68-T97 VanDerWaalsContact OD1-CA 3.29Å; D68-T97 WeakPolarHBondContact OD1-CA 3.44Å; D68-T97 WeakPolarHBondContact OD1-CB 3.41Å; D68-T97 PolarHBondContact OD1-OG1 3.01Å; F71-T97 HydrophobicContact CD1-CG2 4.02Å; I72-T97 HydrophobicContact CB-CG2 4.23Å; Q93-T97 PolarHBondContact NE2-OG1 3.43Å; Q93-T97 WeakPolarHBondContact O-CB 3.3Å; Q93-T97 PolarHBondContact O-N 2.75Å; Q93-T97 PolarHBondContact O-OG1 3.25Å; Q93-T97 VanDerWaalsContact O-OG1 3.08Å; C94-T97 PolarHBondContact O-N 3.06Å; A95-T97 PolarHBondContact O-N 3.24Å; T97-I99 PolarHBondContact O-N 2.95Å; T97-S100 PolarHBondContact O-N 3.33Å; T97-L101 HydrophobicContact CG2-CD1 3.78Å; T97-L101 HydrophobicContact CG2-CG 4.17Å; T97-L101 WeakPolarHBondContact O-CB 2.98Å; T97-L101 WeakPolarHBondContact O-CG 3.47Å; T97-L101 PolarHBondContact O-N 3.46Å
98	F	97.6	Very high	94.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-60.8	-43.4	179.2	-80.9	-59.7	0	0	0	112.9	F71 I72 Y75 C94 A95 L101 M102 V114 M117 I118 M121 F132	F71-F98 HydrophobicContact CE1-CE2 4.36Å; I72-F98 HydrophobicContact CD1-CE1 4.1Å; I72-F98 HydrophobicContact CD1-CZ 4.39Å; Y75-F98 HydrophobicContact CD1-CZ 4.06Å; Y75-F98 AromaticContact CE1-CZ 3.88Å; Y75-F98 HydrophobicContact CE1-CZ 3.88Å; Y75-F98 HydrophobicContact CE2-CE2 4.47Å; Y75-F98 HydrophobicContact CE2-CZ 4.4Å; Y75-F98 HydrophobicContact CG-CZ 4.43Å; C94-F98 VanDerWaalsContact O-CD2 3.22Å; C94-F98 WeakPolarHBondContact O-CD2 3.48Å; C94-F98 PolarHBondContact O-N 2.96Å; C94-F98 VanDerWaalsContact SG-CD2 3.54Å; C94-F98 VanDerWaalsContact SG-CE2 3.52Å; A95-F98 PolarHBondContact O-N 3.44Å; F98-L101 PolarHBondContact O-N 3.21Å; F98-M102 WeakPolarHBondContact O-CB 3.49Å; F98-M102 VanDerWaalsContact O-CG 3.32Å; F98-M102 WeakPolarHBondContact O-CG 3.21Å; F98-M102 PolarHBondContact O-N 3.5Å; F98-V114 HydrophobicContact CD1-CG1 3.94Å; F98-M117 HydrophobicContact CE1-CB 3.76Å; F98-M117 HydrophobicContact CE1-CE 4.13Å; F98-M117 HydrophobicContact CZ-CB 4.12Å; F98-I118 HydrophobicContact CB-CD1 3.89Å; F98-I118 HydrophobicContact CB-CG1 4.03Å; F98-I118 HydrophobicContact CD1-CD1 3.9Å; F98-I118 HydrophobicContact CD1-CG1 3.42Å; F98-I118 VanDerWaalsContact CD1-CG1 3.42Å; F98-I118 HydrophobicContact CD2-CG1 4.31Å; F98-I118 HydrophobicContact CE1-CG1 3.9Å; F98-I118 HydrophobicContact CG-CD1 4.08Å; F98-I118 HydrophobicContact CG-CG1 3.67Å; F98-M121 HydrophobicContact CE2-SD 4.06Å; F98-F132 HydrophobicContact CB-CE1 3.98Å; F98-F132 HydrophobicContact CB-CZ 4.3Å; F98-F132 HydrophobicContact CD2-CZ 4.37Å
99	I	96.1	Very high	94.3	Very high	27 Å²	27	47 Å²	47	14%	0.138	25%	0.254	C	S	.	.	H	α-helix	trans	-63.9	-46.5	176.5	-70.6	167.6	0	0	0	110.8	A95 T97 L101 M102 S103 F132 Y135 P146	A95-I99 VanDerWaalsContact O-CB 3.32Å; A95-I99 WeakPolarHBondContact O-CB 3.36Å; A95-I99 VanDerWaalsContact O-CG1 3.29Å; A95-I99 WeakPolarHBondContact O-CG1 3.37Å; A95-I99 PolarHBondContact O-N 2.99Å; T97-I99 PolarHBondContact O-N 2.95Å; I99-L101 PolarHBondContact O-N 3.24Å; I99-M102 HydrophobicContact CG1-CE 4.25Å; I99-M102 PolarHBondContact O-N 2.97Å; I99-S103 WeakPolarHBondContact O-CB 3.34Å; I99-S103 PolarHBondContact O-N 3.44Å; I99-S103 PolarHBondContact O-OG 3.44Å; I99-F132 HydrophobicContact CD1-CD1 4.28Å; I99-F132 HydrophobicContact CG1-CD1 4.41Å; I99-Y135 HydrophobicContact CD1-CD1 3.69Å; I99-Y135 HydrophobicContact CD1-CE1 3.74Å; I99-P146 HydrophobicContact CG1-CB 4.4Å; I99-P146 HydrophobicContact CG2-CB 4.03Å; I99-P146 HydrophobicContact CG2-CG 4.18Å
100	S	94.5	Very high	94.3	Very high	20 Å²	20	39.4 Å²	39.4	14%	0.14	22%	0.221	C	C	.	.	H	α-helix	trans	-57.6	-47.5	177.1	-178.6	0	0	0	0	111.6	K96 T97 M102 S103 N104	K96-S100 WeakPolarHBondContact O-CB 3.36Å; K96-S100 PolarHBondContact O-N 2.94Å; T97-S100 PolarHBondContact O-N 3.33Å; S100-M102 VanDerWaalsContact C-N 3.34Å; S100-M102 PolarHBondContact O-N 3.36Å; S100-S103 PolarHBondContact O-N 3.29Å; S100-N104 VanDerWaalsContact O-CB 3.25Å; S100-N104 WeakPolarHBondContact O-CB 3.44Å; S100-N104 PolarHBondContact O-N 3.34Å; S100-N104 PolarHBondContact O-ND2 3.48Å; S100-N104 PolarHBondContact OG-ND2 2.96Å
101	L	95.2	Very high	94.3	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-64	-36.9	179.2	-66.5	177.3	0	0	0	112.5	W55 I64 I72 T97 F98 I99 I105 V114	W55-L101 HydrophobicContact CE3-CD2 4.38Å; W55-L101 HydrophobicContact CH2-CD1 4.16Å; W55-L101 HydrophobicContact CZ3-CD1 4.08Å; W55-L101 HydrophobicContact CZ3-CD2 3.87Å; I64-L101 HydrophobicContact CB-CD2 4.39Å; I64-L101 HydrophobicContact CG2-CD2 3.41Å; I64-L101 VanDerWaalsContact CG2-CD2 3.41Å; I72-L101 HydrophobicContact CB-CD1 4.34Å; I72-L101 HydrophobicContact CD1-CD1 3.83Å; I72-L101 HydrophobicContact CG1-CD1 3.86Å; T97-L101 HydrophobicContact CG2-CD1 3.78Å; T97-L101 HydrophobicContact CG2-CG 4.17Å; T97-L101 WeakPolarHBondContact O-CB 2.98Å; T97-L101 WeakPolarHBondContact O-CG 3.47Å; T97-L101 PolarHBondContact O-N 3.46Å; F98-L101 PolarHBondContact O-N 3.21Å; I99-L101 PolarHBondContact O-N 3.24Å; L101-I105 HydrophobicContact CB-CD1 4.23Å; L101-I105 HydrophobicContact CD2-CD1 3.56Å; L101-I105 VanDerWaalsContact O-CB 3.31Å; L101-I105 WeakPolarHBondContact O-CB 3.47Å; L101-I105 WeakPolarHBondContact O-CG1 3.49Å; L101-V114 HydrophobicContact CB-CG1 4.02Å; L101-V114 HydrophobicContact CB-CG2 3.88Å; L101-V114 HydrophobicContact CD1-CG2 4.15Å
102	M	94.3	Very high	94.4	Very high	2 Å²	2	35.6 Å²	35.6	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-72.1	-41.6	176.6	-75.8	-171.8	-61.9	0	0	113	F98 I99 S100 V114 L115 I118 F147 L150	F98-M102 WeakPolarHBondContact O-CB 3.49Å; F98-M102 VanDerWaalsContact O-CG 3.32Å; F98-M102 WeakPolarHBondContact O-CG 3.21Å; F98-M102 PolarHBondContact O-N 3.5Å; I99-M102 HydrophobicContact CG1-CE 4.25Å; I99-M102 PolarHBondContact O-N 2.97Å; S100-M102 VanDerWaalsContact C-N 3.34Å; S100-M102 PolarHBondContact O-N 3.36Å; M102-V114 HydrophobicContact CG-CG1 3.58Å; M102-L115 HydrophobicContact CG-CD2 4.37Å; M102-L115 HydrophobicContact SD-CD2 3.56Å; M102-L115 VanDerWaalsContact SD-CD2 3.56Å; M102-I118 HydrophobicContact CE-CD1 3.58Å; M102-I118 HydrophobicContact CG-CD1 4.14Å; M102-I118 HydrophobicContact SD-CD1 3.33Å; M102-I118 WeakPolarHBondContact SD-CD1 3.44Å; M102-F147 HydrophobicContact CE-CD1 4.05Å; M102-F147 HydrophobicContact CE-CE1 3.58Å; M102-F147 HydrophobicContact CE-CZ 3.98Å; M102-F147 HydrophobicContact SD-CD1 4.28Å; M102-F147 HydrophobicContact SD-CE1 4.15Å; M102-L150 HydrophobicContact CB-CD1 4.19Å; M102-L150 HydrophobicContact CG-CD1 4.29Å; M102-L150 HydrophobicContact SD-CD1 3.97Å
103	S	91.5	Very high	94.5	Very high	69 Å²	69	34.3 Å²	34.3	48%	0.483	18%	0.181	S	C	.	.	H	α-helix	trans	-85.5	-34.2	-172	-60.8	0	0	0	0	113.5	I99 S100	I99-S103 WeakPolarHBondContact O-CB 3.34Å; I99-S103 PolarHBondContact O-N 3.44Å; I99-S103 PolarHBondContact O-OG 3.44Å; S100-S103 PolarHBondContact O-N 3.29Å
104	N	89.3	Confident	94.5	Very high	104 Å²	104	32.4 Å²	32.4	56%	0.556	17%	0.172	S	C	*	.	H	α-helix	trans	-98.5	-19.1	-170.9	-60.5	-30	0	0	0	113.7	S100	S100-N104 VanDerWaalsContact O-CB 3.25Å; S100-N104 WeakPolarHBondContact O-CB 3.44Å; S100-N104 PolarHBondContact O-N 3.34Å; S100-N104 PolarHBondContact O-ND2 3.48Å; S100-N104 PolarHBondContact OG-ND2 2.96Å
105	I	90	Very high	94.5	Very high	2 Å²	2	32.4 Å²	32.4	1%	0.01	17%	0.172	C	C	.	.			trans	-90.3	119.7	-178.3	-59	-178.9	0	0	0	110.4	W55 Y58 I64 L101 K107 T110 V111 R153	W55-I105 HydrophobicContact CZ3-CD1 4.43Å; Y58-I105 HydrophobicContact CD1-CD1 4.32Å; Y58-I105 HydrophobicContact CE1-CD1 4.38Å; Y58-I105 HydrophobicContact CE1-CG2 3.86Å; I64-I105 HydrophobicContact CG2-CD1 4.14Å; L101-I105 HydrophobicContact CB-CD1 4.23Å; L101-I105 HydrophobicContact CD2-CD1 3.56Å; L101-I105 VanDerWaalsContact O-CB 3.31Å; L101-I105 WeakPolarHBondContact O-CB 3.47Å; L101-I105 WeakPolarHBondContact O-CG1 3.49Å; I105-K107 HydrophobicContact CG2-CB 4.17Å; I105-T110 HydrophobicContact CD1-CG2 3.76Å; I105-T110 HydrophobicContact CG2-CG2 4.01Å; I105-V111 WeakPolarHBondContact O-CG2 3.26Å; I105-R153 PolarHBondContact O-NH2 3.02Å
106	S	86.9	Confident	94.5	Very high	88 Å²	88	32.6 Å²	32.6	62%	0.615	17%	0.173	S	C	*	.			trans	-75.7	-30.7	177.7	57.2	0	0	0	0	113.6	D108	S106-D108 PolarHBondContact O-N 3.18Å
107	K	93.1	Very high	94.5	Very high	122 Å²	122	30.1 Å²	30.1	53%	0.53	16%	0.162	S	C	.	.			trans	-67.8	111	-176.4	-171	-176.3	-173.7	-179	0	111.5	Y58 I105 Q109 T110 V111	Y58-K107 WeakPolarHBondContact OH-CB 3.43Å; Y58-K107 WeakPolarHBondContact OH-CD 3.24Å; I105-K107 HydrophobicContact CG2-CB 4.17Å; K107-Q109 VanDerWaalsContact C-N 3.33Å; K107-Q109 HydrophobicContact CG-CB 4.46Å; K107-Q109 PolarHBondContact O-N 3.41Å; K107-T110 PolarHBondContact O-N 3.05Å; K107-V111 PolarHBondContact O-N 3.19Å
108	D	93.9	Very high	94.5	Very high	57 Å²	57	30.1 Å²	30.1	31%	0.305	16%	0.162	S	C	.	.	H	α-helix	trans	-56.7	-42.1	-176.4	-66.3	-23.6	0	0	0	113.1	S106 T110 V111 R112 R153 I158	S106-D108 PolarHBondContact O-N 3.18Å; D108-T110 PolarHBondContact O-N 2.73Å; D108-T110 VanDerWaalsContact O-N 3.15Å; D108-V111 CarbonylContact O-C 3.59Å; D108-V111 PolarHBondContact O-N 2.87Å; D108-R112 WeakPolarHBondContact O-CG 3.41Å; D108-R112 PolarHBondContact O-N 2.94Å; D108-R153 IonicContact OD1-CZ 3.87Å; D108-R153 IonicContact OD1-NH1 3.18Å; D108-R153 PolarHBondContact OD1-NH1 3.43Å; D108-R153 IonicContact OD1-NH2 2.79Å; D108-I158 HydrophobicContact CB-CD1 3.74Å
109	Q	94.4	Very high	94.4	Very high	62 Å²	62	30.5 Å²	30.5	29%	0.29	17%	0.165	S	C	.	.	H	α-helix	trans	-55.7	-36.7	178.2	-174.4	60.5	21.2	0	0	113.3	K107 F113	K107-Q109 VanDerWaalsContact C-N 3.33Å; K107-Q109 HydrophobicContact CG-CB 4.46Å; K107-Q109 PolarHBondContact O-N 3.41Å; Q109-F113 PolarHBondContact O-N 2.93Å
110	T	94.6	Very high	94.3	Very high	2 Å²	2	31.4 Å²	31.4	1%	0.012	17%	0.17	C	C	.	.	H	α-helix	trans	-73.5	-41.9	178.1	-58.7	0	0	0	0	110.4	P53 W55 Y58 I105 K107 D108 R112 F113 V114	P53-T110 HydrophobicContact CB-CG2 4.03Å; P53-T110 HydrophobicContact CG-CG2 4.01Å; W55-T110 HydrophobicContact CH2-CG2 3.88Å; W55-T110 HydrophobicContact CZ3-CG2 3.72Å; Y58-T110 HydrophobicContact CE2-CG2 3.94Å; Y58-T110 PolarHBondContact OH-OG1 2.71Å; I105-T110 HydrophobicContact CD1-CG2 3.76Å; I105-T110 HydrophobicContact CG2-CG2 4.01Å; K107-T110 PolarHBondContact O-N 3.05Å; D108-T110 PolarHBondContact O-N 2.73Å; D108-T110 VanDerWaalsContact O-N 3.15Å; T110-R112 PolarHBondContact O-N 3.15Å; T110-F113 PolarHBondContact O-N 3.23Å; T110-V114 HydrophobicContact CG2-CG2 4.35Å; T110-V114 WeakPolarHBondContact O-CG2 3.38Å; T110-V114 PolarHBondContact O-N 3.16Å
111	V	96.2	Very high	94.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-61.3	-43	174.8	-179.5	0	0	0	0	111	I105 K107 D108 F113 V114 L115 L150 I158	I105-V111 WeakPolarHBondContact O-CG2 3.26Å; K107-V111 PolarHBondContact O-N 3.19Å; D108-V111 CarbonylContact O-C 3.59Å; D108-V111 PolarHBondContact O-N 2.87Å; V111-F113 VanDerWaalsContact C-N 3.31Å; V111-F113 PolarHBondContact O-N 3.3Å; V111-V114 PolarHBondContact O-N 3.5Å; V111-L115 HydrophobicContact CG1-CD1 4.01Å; V111-L115 HydrophobicContact CG1-CG 4.29Å; V111-L115 VanDerWaalsContact O-CG 3.28Å; V111-L115 WeakPolarHBondContact O-CG 3.27Å; V111-L115 PolarHBondContact O-N 2.84Å; V111-L150 HydrophobicContact CG1-CD1 4.43Å; V111-L150 HydrophobicContact CG1-CD2 4.3Å; V111-I158 HydrophobicContact CB-CD1 3.9Å; V111-I158 HydrophobicContact CG1-CD1 3.9Å; V111-I158 HydrophobicContact CG1-CG1 4.19Å; V111-I158 HydrophobicContact CG1-CG2 4.33Å
112	R	96.9	Very high	94.3	Very high	44 Å²	44	30.4 Å²	30.4	17%	0.166	16%	0.163	C	C	.	.	H	α-helix	trans	-53.4	-48.9	173.2	-66.7	-173.8	173.8	-147.7	0.4	111.1	E44 V48 D108 T110 L115 I116 D155 F157 I158	E44-R112 IonicContact OE2-CZ 2.73Å; E44-R112 IonicContact OE2-NH1 2.69Å; E44-R112 PolarHBondContact OE2-NH1 3.18Å; E44-R112 IonicContact OE2-NH2 3.62Å; V48-R112 HydrophobicContact CG1-CB 3.85Å; V48-R112 HydrophobicContact CG2-CB 4.12Å; D108-R112 WeakPolarHBondContact O-CG 3.41Å; D108-R112 PolarHBondContact O-N 2.94Å; T110-R112 PolarHBondContact O-N 3.15Å; R112-L115 PolarHBondContact O-N 3.43Å; R112-I116 WeakPolarHBondContact O-CG1 3.26Å; R112-I116 PolarHBondContact O-N 2.97Å; R112-I116 VanDerWaalsContact O-N 3.09Å; R112-D155 IonicContact CZ-OD1 3.76Å; R112-D155 IonicContact CZ-OD2 3.66Å; R112-D155 IonicContact NE-OD1 2.91Å; R112-D155 PolarHBondContact NE-OD1 3.47Å; R112-D155 IonicContact NE-OD2 3.97Å; R112-D155 PolarHBondContact NE-OD2 2.9Å; R112-D155 IonicContact NH2-OD1 2.69Å; R112-D155 PolarHBondContact NH2-OD1 3.37Å; R112-D155 IonicContact NH2-OD2 3.94Å; R112-D155 PolarHBondContact NH2-OD2 2.97Å; R112-F157 HydrophobicContact CB-CD1 3.85Å; R112-F157 HydrophobicContact CB-CE1 3.86Å; R112-F157 HydrophobicContact CG-CB 4.49Å; R112-F157 HydrophobicContact CG-CD1 3.54Å; R112-F157 HydrophobicContact CG-CE1 4.1Å; R112-F157 HydrophobicContact CG-CG 4.24Å; R112-F157 VanDerWaalsContact CZ-CB 3.43Å; R112-I158 HydrophobicContact CG-CD1 4.24Å; R112-I158 HydrophobicContact CG-CG1 3.77Å
113	F	96.5	Very high	94.2	Very high	15 Å²	15	34.3 Å²	34.3	7%	0.066	18%	0.181	C	C	.	.	H	α-helix	trans	-65.4	-41.8	-179.8	-167.7	-89.9	0	0	0	112.5	V48 R52 P53 W55 E76 Q109 T110 V111 I116 M117	V48-F113 HydrophobicContact CG1-CB 4.03Å; V48-F113 HydrophobicContact CG1-CD2 4.18Å; V48-F113 WeakPolarHBondContact O-CD2 3.18Å; R52-F113 HydrophobicContact CG-CE2 4.02Å; R52-F113 HydrophobicContact CG-CZ 4Å; P53-F113 VanDerWaalsContact CD-CD1 3.43Å; P53-F113 HydrophobicContact CG-CB 3.89Å; P53-F113 HydrophobicContact CG-CD1 3.77Å; P53-F113 HydrophobicContact CG-CG 3.85Å; W55-F113 HydrophobicContact CZ2-CD1 4.19Å; W55-F113 HydrophobicContact CZ2-CE1 4.43Å; E76-F113 WeakPolarHBondContact OE1-CE1 3.36Å; Q109-F113 PolarHBondContact O-N 2.93Å; T110-F113 PolarHBondContact O-N 3.23Å; V111-F113 VanDerWaalsContact C-N 3.31Å; V111-F113 PolarHBondContact O-N 3.3Å; F113-I116 PolarHBondContact O-N 3.44Å; F113-M117 HydrophobicContact CD1-CE 3.54Å; F113-M117 HydrophobicContact CD1-CG 4.28Å; F113-M117 HydrophobicContact CD1-SD 4.08Å; F113-M117 HydrophobicContact CE1-CE 3.7Å; F113-M117 HydrophobicContact CE1-CG 3.99Å; F113-M117 HydrophobicContact CE1-SD 3.62Å; F113-M117 PolarHBondContact O-N 3.06Å
114	V	96.9	Very high	94.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-61.2	-44.7	175.9	173.7	0	0	0	0	111.2	W55 F98 L101 M102 T110 V111 I116 M117 I118	W55-V114 HydrophobicContact CH2-CG2 3.82Å; F98-V114 HydrophobicContact CD1-CG1 3.94Å; L101-V114 HydrophobicContact CB-CG1 4.02Å; L101-V114 HydrophobicContact CB-CG2 3.88Å; L101-V114 HydrophobicContact CD1-CG2 4.15Å; M102-V114 HydrophobicContact CG-CG1 3.58Å; T110-V114 HydrophobicContact CG2-CG2 4.35Å; T110-V114 WeakPolarHBondContact O-CG2 3.38Å; T110-V114 PolarHBondContact O-N 3.16Å; V111-V114 PolarHBondContact O-N 3.5Å; V114-I116 PolarHBondContact O-N 3.39Å; V114-M117 HydrophobicContact CB-CE 4.5Å; V114-M117 HydrophobicContact CG2-CE 4.17Å; V114-M117 PolarHBondContact O-N 3.25Å; V114-I118 HydrophobicContact CG1-CD1 4.15Å; V114-I118 WeakPolarHBondContact O-CG1 3.5Å; V114-I118 PolarHBondContact O-N 3.07Å
115	L	97.4	Very high	94.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	17%	0.166	C	C	.	.	H	α-helix	trans	-63.2	-40.1	177.3	-69.1	170.4	0	0	0	112.1	M102 V111 R112 M117 I118 D119 L150 I158 Q161 V162 I165	M102-L115 HydrophobicContact CG-CD2 4.37Å; M102-L115 HydrophobicContact SD-CD2 3.56Å; M102-L115 VanDerWaalsContact SD-CD2 3.56Å; V111-L115 HydrophobicContact CG1-CD1 4.01Å; V111-L115 HydrophobicContact CG1-CG 4.29Å; V111-L115 VanDerWaalsContact O-CG 3.28Å; V111-L115 WeakPolarHBondContact O-CG 3.27Å; V111-L115 PolarHBondContact O-N 2.84Å; R112-L115 PolarHBondContact O-N 3.43Å; L115-M117 VanDerWaalsContact C-N 3.34Å; L115-M117 PolarHBondContact O-N 2.83Å; L115-I118 PolarHBondContact O-N 3.45Å; L115-D119 WeakPolarHBondContact O-CB 3.37Å; L115-D119 PolarHBondContact O-N 3.31Å; L115-L150 HydrophobicContact CD1-CD1 4.47Å; L115-L150 HydrophobicContact CD2-CD1 3.92Å; L115-I158 HydrophobicContact CD1-CB 4.26Å; L115-I158 HydrophobicContact CD1-CG1 4.24Å; L115-I158 HydrophobicContact CD1-CG2 3.93Å; L115-Q161 HydrophobicContact CB-CB 4.42Å; L115-Q161 HydrophobicContact CB-CG 3.67Å; L115-Q161 HydrophobicContact CD1-CB 4.38Å; L115-V162 HydrophobicContact CD1-CB 4.31Å; L115-V162 HydrophobicContact CD2-CB 4.02Å; L115-V162 HydrophobicContact CD2-CG2 4Å; L115-I165 HydrophobicContact CB-CD1 4.05Å; L115-I165 HydrophobicContact CD2-CD1 3.75Å; L115-I165 VanDerWaalsContact O-CD1 3.31Å; L115-I165 WeakPolarHBondContact O-CD1 3.32Å
116	I	96	Very high	94.4	Very high	3 Å²	3	39.2 Å²	39.2	2%	0.015	19%	0.189	C	C	.	.	H	α-helix	trans	-60.7	-44.6	174.1	-69.4	169.5	0	0	0	110.9	V48 R49 R112 F113 V114 I118 D119 D120 F157	V48-I116 HydrophobicContact CB-CD1 3.54Å; V48-I116 HydrophobicContact CG1-CD1 3.43Å; V48-I116 VanDerWaalsContact CG1-CD1 3.43Å; V48-I116 HydrophobicContact CG2-CD1 4.41Å; R49-I116 HydrophobicContact CG-CG2 4Å; R112-I116 WeakPolarHBondContact O-CG1 3.26Å; R112-I116 PolarHBondContact O-N 2.97Å; R112-I116 VanDerWaalsContact O-N 3.09Å; F113-I116 PolarHBondContact O-N 3.44Å; V114-I116 PolarHBondContact O-N 3.39Å; I116-I118 VanDerWaalsContact C-N 3.34Å; I116-I118 PolarHBondContact O-N 3.4Å; I116-D119 PolarHBondContact O-N 3.1Å; I116-D120 WeakPolarHBondContact O-CB 3.34Å; I116-D120 PolarHBondContact O-N 3.45Å; I116-F157 HydrophobicContact CD1-CE1 4.31Å; I116-F157 HydrophobicContact CD1-CZ 3.82Å; I116-F157 HydrophobicContact CG1-CE1 4.25Å; I116-F157 HydrophobicContact CG1-CZ 3.92Å
117	M	96.1	Very high	94.8	Very high	15 Å²	15	38.4 Å²	38.4	7%	0.074	18%	0.184	C	C	.	.	H	α-helix	trans	-61.4	-42.4	178	-74.8	-170.9	-69.6	0	0	112.4	W55 I72 Y75 E76 F98 F113 V114 L115 D119 M121	W55-M117 HydrophobicContact CH2-CE 4.3Å; W55-M117 HydrophobicContact CZ2-CE 3.95Å; I72-M117 HydrophobicContact CD1-CE 3.67Å; I72-M117 HydrophobicContact CD1-SD 4.04Å; I72-M117 HydrophobicContact CG1-CE 4.33Å; Y75-M117 HydrophobicContact CD1-SD 4.11Å; Y75-M117 HydrophobicContact CE1-CB 4.2Å; Y75-M117 HydrophobicContact CE1-CG 4.36Å; Y75-M117 HydrophobicContact CE1-SD 4.17Å; E76-M117 HydrophobicContact CG-SD 3.98Å; F98-M117 HydrophobicContact CE1-CB 3.76Å; F98-M117 HydrophobicContact CE1-CE 4.13Å; F98-M117 HydrophobicContact CZ-CB 4.12Å; F113-M117 HydrophobicContact CD1-CE 3.54Å; F113-M117 HydrophobicContact CD1-CG 4.28Å; F113-M117 HydrophobicContact CD1-SD 4.08Å; F113-M117 HydrophobicContact CE1-CE 3.7Å; F113-M117 HydrophobicContact CE1-CG 3.99Å; F113-M117 HydrophobicContact CE1-SD 3.62Å; F113-M117 PolarHBondContact O-N 3.06Å; V114-M117 HydrophobicContact CB-CE 4.5Å; V114-M117 HydrophobicContact CG2-CE 4.17Å; V114-M117 PolarHBondContact O-N 3.25Å; L115-M117 VanDerWaalsContact C-N 3.34Å; L115-M117 PolarHBondContact O-N 2.83Å; M117-D119 VanDerWaalsContact C-N 3.32Å; M117-M121 VanDerWaalsContact O-CB 3.25Å; M117-M121 WeakPolarHBondContact O-CB 3.48Å; M117-M121 PolarHBondContact O-N 3.25Å
118	I	96.9	Very high	94.8	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.2	-44.4	175.4	-65.5	167.6	0	0	0	110	F98 M102 V114 L115 I116 M121 L122 F132 F147 I165	F98-I118 HydrophobicContact CB-CD1 3.89Å; F98-I118 HydrophobicContact CB-CG1 4.03Å; F98-I118 HydrophobicContact CD1-CD1 3.9Å; F98-I118 HydrophobicContact CD1-CG1 3.42Å; F98-I118 VanDerWaalsContact CD1-CG1 3.42Å; F98-I118 HydrophobicContact CD2-CG1 4.31Å; F98-I118 HydrophobicContact CE1-CG1 3.9Å; F98-I118 HydrophobicContact CG-CD1 4.08Å; F98-I118 HydrophobicContact CG-CG1 3.67Å; M102-I118 HydrophobicContact CE-CD1 3.58Å; M102-I118 HydrophobicContact CG-CD1 4.14Å; M102-I118 HydrophobicContact SD-CD1 3.33Å; M102-I118 WeakPolarHBondContact SD-CD1 3.44Å; V114-I118 HydrophobicContact CG1-CD1 4.15Å; V114-I118 WeakPolarHBondContact O-CG1 3.5Å; V114-I118 PolarHBondContact O-N 3.07Å; L115-I118 PolarHBondContact O-N 3.45Å; I116-I118 VanDerWaalsContact C-N 3.34Å; I116-I118 PolarHBondContact O-N 3.4Å; I118-M121 WeakPolarHBondContact O-CB 3.03Å; I118-M121 PolarHBondContact O-N 3.48Å; I118-L122 HydrophobicContact CG2-CD1 4.22Å; I118-L122 HydrophobicContact CG2-CG 4.5Å; I118-L122 WeakPolarHBondContact O-CG 3.49Å; I118-L122 PolarHBondContact O-N 3.16Å; I118-F132 HydrophobicContact CG1-CZ 4.27Å; I118-F132 HydrophobicContact CG2-CE2 4.05Å; I118-F132 HydrophobicContact CG2-CZ 3.91Å; I118-F147 HydrophobicContact CD1-CE1 4.46Å; I118-I165 HydrophobicContact CB-CD1 4.17Å; I118-I165 HydrophobicContact CG2-CD1 4.08Å; I118-I165 HydrophobicContact CG2-CG1 4.44Å; I118-I165 HydrophobicContact CG2-CG2 3.89Å
119	D	95.5	Very high	94.9	Very high	9 Å²	9	30.9 Å²	30.9	5%	0.048	15%	0.148	C	C	.	.	H	α-helix	trans	-64.6	-47.7	-178.9	-164.2	55.4	0	0	0	112.4	L115 I116 M117 M121 L122 Q123 Q161 I165 K168	L115-D119 WeakPolarHBondContact O-CB 3.37Å; L115-D119 PolarHBondContact O-N 3.31Å; I116-D119 PolarHBondContact O-N 3.1Å; M117-D119 VanDerWaalsContact C-N 3.32Å; D119-M121 VanDerWaalsContact C-N 3.28Å; D119-M121 PolarHBondContact O-N 2.85Å; D119-L122 PolarHBondContact O-N 3.48Å; D119-Q123 VanDerWaalsContact O-CG 3.31Å; D119-Q123 WeakPolarHBondContact O-CG 3.48Å; D119-Q123 PolarHBondContact O-N 3.02Å; D119-Q123 PolarHBondContact OD2-NE2 2.99Å; D119-Q161 VanDerWaalsContact CG-NE2 3.27Å; D119-Q161 PolarHBondContact OD2-NE2 3Å; D119-I165 HydrophobicContact CB-CD1 4.25Å; D119-I165 HydrophobicContact CB-CG1 3.98Å; D119-K168 WeakPolarHBondContact OD1-CD 3.29Å; D119-K168 WeakPolarHBondContact OD1-CE 3.33Å; D119-K168 IonicContact OD1-NZ 3.13Å; D119-K168 PolarHBondContact OD1-NZ 2.92Å; D119-K168 IonicContact OD2-NZ 3.38Å; D119-K168 PolarHBondContact OD2-NZ 3.48Å
120	D	94	Very high	94.9	Very high	45 Å²	45	30.5 Å²	30.5	24%	0.241	15%	0.152	C	C	.	.	H	α-helix	trans	-59.1	-42	175.3	-71.5	-11.7	0	0	0	110.2	R49 I116 L122 Q123 E124	R49-D120 IonicContact CZ-OD1 3.26Å; R49-D120 IonicContact CZ-OD2 3.72Å; R49-D120 IonicContact NE-OD2 3.46Å; R49-D120 PolarHBondContact NE-OD2 3.28Å; R49-D120 IonicContact NH2-OD1 2.72Å; R49-D120 PolarHBondContact NH2-OD1 3.13Å; R49-D120 IonicContact NH2-OD2 2.74Å; R49-D120 PolarHBondContact NH2-OD2 3.26Å; I116-D120 WeakPolarHBondContact O-CB 3.34Å; I116-D120 PolarHBondContact O-N 3.45Å; D120-L122 PolarHBondContact O-N 3.39Å; D120-Q123 PolarHBondContact O-N 3.39Å; D120-E124 WeakPolarHBondContact O-CG 3.18Å; D120-E124 PolarHBondContact O-N 2.74Å
121	M	95.2	Very high	95	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-58	-45.8	176.2	-172.8	-177	67	0	0	112.4	Y75 L87 C94 F98 M117 I118 D119 R128 F132	Y75-M121 HydrophobicContact CE2-SD 4.38Å; Y75-M121 VanDerWaalsContact OH-CB 3.31Å; Y75-M121 WeakPolarHBondContact OH-CB 3.05Å; L87-M121 HydrophobicContact CD1-CG 3.92Å; L87-M121 HydrophobicContact CD1-SD 4.04Å; L87-M121 HydrophobicContact CD2-SD 3.85Å; C94-M121 VanDerWaalsContact SG-SD 3.7Å; F98-M121 HydrophobicContact CE2-SD 4.06Å; M117-M121 VanDerWaalsContact O-CB 3.25Å; M117-M121 WeakPolarHBondContact O-CB 3.48Å; M117-M121 PolarHBondContact O-N 3.25Å; I118-M121 WeakPolarHBondContact O-CB 3.03Å; I118-M121 PolarHBondContact O-N 3.48Å; D119-M121 VanDerWaalsContact C-N 3.28Å; D119-M121 PolarHBondContact O-N 2.85Å; M121-R128 VanDerWaalsContact O-CD 3.26Å; M121-R128 WeakPolarHBondContact O-CD 3.36Å; M121-R128 PolarHBondContact O-NH1 3.27Å; M121-F132 HydrophobicContact CE-CD2 4.47Å; M121-F132 HydrophobicContact CE-CE2 3.36Å; M121-F132 HydrophobicContact CE-CZ 3.64Å
122	L	94.7	Very high	95	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-72.7	-33.5	-179.3	-66.1	179.9	0	0	0	111.7	I118 D119 D120 D125 R126 R128 V129 F132 I165 M169 W172	I118-L122 HydrophobicContact CG2-CD1 4.22Å; I118-L122 HydrophobicContact CG2-CG 4.5Å; I118-L122 WeakPolarHBondContact O-CG 3.49Å; I118-L122 PolarHBondContact O-N 3.16Å; D119-L122 PolarHBondContact O-N 3.48Å; D120-L122 PolarHBondContact O-N 3.39Å; L122-D125 CarbonylContact O-C 3.56Å; L122-D125 PolarHBondContact O-N 3.45Å; L122-R126 PolarHBondContact O-N 3.32Å; L122-R128 HydrophobicContact CD2-CB 4.13Å; L122-V129 HydrophobicContact CD1-CG2 4.45Å; L122-V129 HydrophobicContact CD2-CB 4.5Å; L122-V129 HydrophobicContact CD2-CG2 3.77Å; L122-F132 HydrophobicContact CD2-CE2 4.34Å; L122-I165 HydrophobicContact CD1-CG2 4.1Å; L122-M169 HydrophobicContact CD1-CG 3.85Å; L122-W172 HydrophobicContact CB-CE3 4.42Å; L122-W172 HydrophobicContact CB-CZ3 3.98Å; L122-W172 VanDerWaalsContact O-CZ3 3.32Å; L122-W172 WeakPolarHBondContact O-CZ3 3.36Å
123	Q	91.8	Very high	94.8	Very high	84 Å²	84	29.6 Å²	29.6	39%	0.393	15%	0.15	S	C	.	.	H	α-helix	trans	-65.8	-38.5	176.3	-73.9	-171.1	52.4	0	0	112.4	D119 D120 D125 K168	D119-Q123 VanDerWaalsContact O-CG 3.31Å; D119-Q123 WeakPolarHBondContact O-CG 3.48Å; D119-Q123 PolarHBondContact O-N 3.02Å; D119-Q123 PolarHBondContact OD2-NE2 2.99Å; D120-Q123 PolarHBondContact O-N 3.39Å; Q123-D125 VanDerWaalsContact C-N 3.28Å; Q123-D125 PolarHBondContact O-N 3.17Å; Q123-K168 VanDerWaalsContact CG-NZ 3.31Å; Q123-K168 VanDerWaalsContact NE2-NZ 3.12Å
124	E	91.7	Very high	94.7	Very high	91 Å²	91	33.2 Å²	33.2	43%	0.425	17%	0.17	S	C	.	.	H	α-helix	trans	-61.4	-35.2	176.2	-77.5	177.3	-169.2	0	0	113.1	R83 D120 R128	R83-E124 WeakPolarHBondContact CD-OE2 3.38Å; R83-E124 IonicContact CZ-OE1 3.94Å; R83-E124 IonicContact NH1-OE1 3.96Å; R83-E124 PolarHBondContact NH1-OE1 3.47Å; D120-E124 WeakPolarHBondContact O-CG 3.18Å; D120-E124 PolarHBondContact O-N 2.74Å; E124-R128 VanDerWaalsContact CB-NH1 3.34Å; E124-R128 IonicContact OE2-CZ 3.71Å; E124-R128 IonicContact OE2-NH1 3.86Å; E124-R128 PolarHBondContact OE2-NH1 3.1Å; E124-R128 IonicContact OE2-NH2 2.66Å; E124-R128 PolarHBondContact OE2-NH2 3.29Å
125	D	92.2	Very high	94.7	Very high	56 Å²	56	35.2 Å²	35.2	30%	0.299	18%	0.178	S	C	.	.			trans	-158.1	109.6	180	178	-4.1	0	0	0	110.4	L122 Q123 S127 R128	L122-D125 CarbonylContact O-C 3.56Å; L122-D125 PolarHBondContact O-N 3.45Å; Q123-D125 VanDerWaalsContact C-N 3.28Å; Q123-D125 PolarHBondContact O-N 3.17Å; D125-S127 PolarHBondContact O-N 2.63Å; D125-S127 VanDerWaalsContact O-N 3.16Å; D125-S127 VanDerWaalsContact OD1-CB 3.26Å; D125-S127 WeakPolarHBondContact OD1-CB 3.45Å; D125-S127 PolarHBondContact OD1-N 3.07Å; D125-S127 PolarHBondContact OD1-OG 3.41Å; D125-S127 PolarHBondContact OD2-OG 2.92Å; D125-S127 VanDerWaalsContact OD2-OG 3.13Å; D125-R128 HydrophobicContact CB-CG 3.93Å; D125-R128 VanDerWaalsContact O-CB 3.28Å; D125-R128 WeakPolarHBondContact O-CB 3.41Å; D125-R128 WeakPolarHBondContact O-CG 3.34Å; D125-R128 PolarHBondContact O-N 2.86Å; D125-R128 VanDerWaalsContact O-N 3.08Å; D125-R128 IonicContact OD2-NE 3.46Å
126	R	92.5	Very high	94.5	Very high	131 Å²	131	35.5 Å²	35.5	49%	0.494	18%	0.181	S	C	.	.	G	3₁₀ helix	trans	-59.3	-27.3	-178.3	-59.6	-173.7	-173.4	172.3	4	112.7	L122 R128 V129 W172	L122-R126 PolarHBondContact O-N 3.32Å; R126-R128 PolarHBondContact O-N 3.31Å; R126-V129 WeakPolarHBondContact O-CG2 3.23Å; R126-V129 PolarHBondContact O-N 3.11Å; R126-W172 HydrophobicContact CB-CB 4.19Å; R126-W172 HydrophobicContact CB-CD2 4.03Å; R126-W172 HydrophobicContact CB-CE3 3.97Å; R126-W172 HydrophobicContact CB-CG 4.15Å; R126-W172 HydrophobicContact CG-CD2 3.72Å; R126-W172 HydrophobicContact CG-CE3 3.73Å; R126-W172 HydrophobicContact CG-CG 4.19Å; R126-W172 HydrophobicContact CG-CH2 4.34Å; R126-W172 HydrophobicContact CG-CZ2 4.35Å; R126-W172 HydrophobicContact CG-CZ3 4.05Å
127	S	93.4	Very high	94.4	Very high	71 Å²	71	42.7 Å²	42.7	50%	0.497	21%	0.207	S	C	.	.	G	3₁₀ helix	trans	-66.8	-18.5	180	75.7	0	0	0	0	113	D125 V129 S130	D125-S127 PolarHBondContact O-N 2.63Å; D125-S127 VanDerWaalsContact O-N 3.16Å; D125-S127 VanDerWaalsContact OD1-CB 3.26Å; D125-S127 WeakPolarHBondContact OD1-CB 3.45Å; D125-S127 PolarHBondContact OD1-N 3.07Å; D125-S127 PolarHBondContact OD1-OG 3.41Å; D125-S127 PolarHBondContact OD2-OG 2.92Å; D125-S127 VanDerWaalsContact OD2-OG 3.13Å; S127-V129 PolarHBondContact O-N 3.05Å; S127-V129 VanDerWaalsContact O-N 3.17Å; S127-S130 WeakPolarHBondContact O-CB 3.12Å; S127-S130 PolarHBondContact O-N 3.5Å; S127-S130 VanDerWaalsContact O-N 3.09Å; S127-S130 PolarHBondContact O-OG 2.71Å
128	R	94.9	Very high	94.3	Very high	19 Å²	19	49 Å²	49	7%	0.072	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-67.7	-11.7	179.3	-65.6	174.2	-178.1	172.1	2.4	113.7	L87 M121 L122 E124 D125 R126 S130 I131	L87-R128 VanDerWaalsContact CD1-CZ 3.49Å; M121-R128 VanDerWaalsContact O-CD 3.26Å; M121-R128 WeakPolarHBondContact O-CD 3.36Å; M121-R128 PolarHBondContact O-NH1 3.27Å; L122-R128 HydrophobicContact CD2-CB 4.13Å; E124-R128 VanDerWaalsContact CB-NH1 3.34Å; E124-R128 IonicContact OE2-CZ 3.71Å; E124-R128 IonicContact OE2-NH1 3.86Å; E124-R128 PolarHBondContact OE2-NH1 3.1Å; E124-R128 IonicContact OE2-NH2 2.66Å; E124-R128 PolarHBondContact OE2-NH2 3.29Å; D125-R128 HydrophobicContact CB-CG 3.93Å; D125-R128 VanDerWaalsContact O-CB 3.28Å; D125-R128 WeakPolarHBondContact O-CB 3.41Å; D125-R128 WeakPolarHBondContact O-CG 3.34Å; D125-R128 PolarHBondContact O-N 2.86Å; D125-R128 VanDerWaalsContact O-N 3.08Å; D125-R128 IonicContact OD2-NE 3.46Å; R126-R128 PolarHBondContact O-N 3.31Å; R128-S130 PolarHBondContact O-N 3.28Å; R128-I131 HydrophobicContact CB-CD1 3.96Å; R128-I131 HydrophobicContact CG-CD1 4.09Å; R128-I131 WeakPolarHBondContact O-CB 3.37Å; R128-I131 WeakPolarHBondContact O-CG1 3.35Å; R128-I131 PolarHBondContact O-N 3Å
129	V	94.8	Very high	94.2	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.006	25%	0.254	C	S	.	.	H	α-helix	trans	-53.6	-36.7	167.4	173.5	0	0	0	0	110.9	L122 R126 S127 I131 F132 V133 M169 W172	L122-V129 HydrophobicContact CD1-CG2 4.45Å; L122-V129 HydrophobicContact CD2-CB 4.5Å; L122-V129 HydrophobicContact CD2-CG2 3.77Å; R126-V129 WeakPolarHBondContact O-CG2 3.23Å; R126-V129 PolarHBondContact O-N 3.11Å; S127-V129 PolarHBondContact O-N 3.05Å; S127-V129 VanDerWaalsContact O-N 3.17Å; V129-I131 PolarHBondContact O-N 3.15Å; V129-I131 VanDerWaalsContact O-N 3.11Å; V129-F132 PolarHBondContact O-N 3.1Å; V129-V133 HydrophobicContact CG1-CG2 4.23Å; V129-V133 PolarHBondContact O-N 3.44Å; V129-M169 HydrophobicContact CG1-CB 4.04Å; V129-M169 HydrophobicContact CG1-CG 4.14Å; V129-M169 HydrophobicContact CG2-CG 4.18Å; V129-W172 HydrophobicContact CG2-CB 3.98Å; V129-W172 HydrophobicContact CG2-CE3 4.47Å
130	S	94.7	Very high	94	Very high	55 Å²	55	61.8 Å²	61.8	39%	0.385	29%	0.291	S	S	.	.	H	α-helix	trans	-58.4	-24.6	177.5	66.3	0	0	0	0	113.6	S127 R128 F132 V133 N134	S127-S130 WeakPolarHBondContact O-CB 3.12Å; S127-S130 PolarHBondContact O-N 3.5Å; S127-S130 VanDerWaalsContact O-N 3.09Å; S127-S130 PolarHBondContact O-OG 2.71Å; R128-S130 PolarHBondContact O-N 3.28Å; S130-F132 PolarHBondContact O-N 3.02Å; S130-V133 PolarHBondContact O-N 3.39Å; S130-N134 WeakPolarHBondContact O-CB 3.38Å; S130-N134 PolarHBondContact O-N 3.2Å; S130-N134 PolarHBondContact O-ND2 3.4Å; S130-N134 VanDerWaalsContact O-ND2 3.09Å
131	I	95.9	Very high	93.9	Very high	16 Å²	16	65.6 Å²	65.6	8%	0.082	31%	0.307	C	S	.	.	H	α-helix	trans	-59.9	-47.2	177.5	-65.1	175.5	0	0	0	110.5	P91 C94 A95 R128 V129 Y135	P91-I131 HydrophobicContact CB-CG1 4.19Å; P91-I131 HydrophobicContact CB-CG2 4.21Å; P91-I131 WeakPolarHBondContact O-CG2 3.43Å; C94-I131 HydrophobicContact CB-CG2 4.2Å; A95-I131 HydrophobicContact CB-CG2 4.02Å; R128-I131 HydrophobicContact CB-CD1 3.96Å; R128-I131 HydrophobicContact CG-CD1 4.09Å; R128-I131 WeakPolarHBondContact O-CB 3.37Å; R128-I131 WeakPolarHBondContact O-CG1 3.35Å; R128-I131 PolarHBondContact O-N 3Å; V129-I131 PolarHBondContact O-N 3.15Å; V129-I131 VanDerWaalsContact O-N 3.11Å; I131-Y135 VanDerWaalsContact O-CB 3.31Å; I131-Y135 WeakPolarHBondContact O-CB 3.3Å; I131-Y135 PolarHBondContact O-N 2.74Å; I131-Y135 VanDerWaalsContact O-N 3.15Å
132	F	96.3	Very high	93.7	Very high	2 Å²	2	68.1 Å²	68.1	1%	0.009	32%	0.324	C	S	.	.	H	α-helix	trans	-72.6	-41.5	179.6	-64.5	-75	0	0	0	112.1	A95 F98 I99 I118 M121 L122 V129 S130 Y135 A136 F147 M169	A95-F132 HydrophobicContact CB-CD1 3.99Å; A95-F132 HydrophobicContact CB-CE1 4.42Å; F98-F132 HydrophobicContact CB-CE1 3.98Å; F98-F132 HydrophobicContact CB-CZ 4.3Å; F98-F132 HydrophobicContact CD2-CZ 4.37Å; I99-F132 HydrophobicContact CD1-CD1 4.28Å; I99-F132 HydrophobicContact CG1-CD1 4.41Å; I118-F132 HydrophobicContact CG1-CZ 4.27Å; I118-F132 HydrophobicContact CG2-CE2 4.05Å; I118-F132 HydrophobicContact CG2-CZ 3.91Å; M121-F132 HydrophobicContact CE-CD2 4.47Å; M121-F132 HydrophobicContact CE-CE2 3.36Å; M121-F132 HydrophobicContact CE-CZ 3.64Å; L122-F132 HydrophobicContact CD2-CE2 4.34Å; V129-F132 PolarHBondContact O-N 3.1Å; S130-F132 PolarHBondContact O-N 3.02Å; F132-Y135 PolarHBondContact O-N 3.43Å; F132-A136 WeakPolarHBondContact O-CB 3.43Å; F132-A136 PolarHBondContact O-N 3.07Å; F132-F147 HydrophobicContact CD1-CE2 4.37Å; F132-F147 AromaticContact CD1-CZ 3.8Å; F132-F147 HydrophobicContact CD1-CZ 3.8Å; F132-F147 HydrophobicContact CD2-CZ 4.48Å; F132-F147 HydrophobicContact CE1-CZ 4Å; F132-F147 HydrophobicContact CG-CZ 4.05Å; F132-F147 HydrophobicContact CZ-CZ 4.42Å; F132-M169 HydrophobicContact CB-CE 3.77Å; F132-M169 HydrophobicContact CD2-CE 4.27Å; F132-M169 HydrophobicContact CD2-SD 4.46Å; F132-M169 HydrophobicContact CG-CE 4.21Å
133	V	94.1	Very high	93.6	Very high	9 Å²	9	69.6 Å²	69.6	6%	0.055	33%	0.333	C	S	.	.	H	α-helix	trans	-61.2	-49.6	178.4	176.3	0	0	0	0	111	V129 S130 Y135 A136 R137 V143 D175	V129-V133 HydrophobicContact CG1-CG2 4.23Å; V129-V133 PolarHBondContact O-N 3.44Å; S130-V133 PolarHBondContact O-N 3.39Å; V133-Y135 VanDerWaalsContact C-N 3.34Å; V133-Y135 PolarHBondContact O-N 3.33Å; V133-A136 PolarHBondContact O-N 3.47Å; V133-R137 WeakPolarHBondContact O-CB 3.43Å; V133-R137 PolarHBondContact O-N 3.14Å; V133-V143 HydrophobicContact CG1-CG2 4.49Å; V133-V143 HydrophobicContact CG2-CG1 4Å; V133-D175 WeakPolarHBondContact CG1-OD2 3.43Å
134	N	94.6	Very high	93.7	Very high	91 Å²	91	66.3 Å²	66.3	49%	0.487	32%	0.317	S	S	.	.	H	α-helix	trans	-64.4	-39.4	-180	-71	-26.9	0	0	0	111.8	S130 K138	S130-N134 WeakPolarHBondContact O-CB 3.38Å; S130-N134 PolarHBondContact O-N 3.2Å; S130-N134 PolarHBondContact O-ND2 3.4Å; S130-N134 VanDerWaalsContact O-ND2 3.09Å; N134-K138 WeakPolarHBondContact O-CB 3.34Å; N134-K138 PolarHBondContact O-N 3.04Å
135	Y	95.6	Very high	93.9	Very high	41 Å²	41	65.6 Å²	65.6	16%	0.161	32%	0.316	C	S	.	.	H	α-helix	trans	-63.1	-49.9	175.2	174.9	-99.2	0	0	0	111.8	A92 A95 K96 I99 I131 F132 V133 R137 K138 E139	A92-Y135 HydrophobicContact CB-CD2 4.44Å; A92-Y135 WeakPolarHBondContact O-CD2 3.47Å; A95-Y135 HydrophobicContact CB-CD1 3.74Å; A95-Y135 HydrophobicContact CB-CD2 3.97Å; A95-Y135 HydrophobicContact CB-CG 3.38Å; K96-Y135 HydrophobicContact CB-CE2 3.65Å; K96-Y135 HydrophobicContact CG-CE2 4.4Å; I99-Y135 HydrophobicContact CD1-CD1 3.69Å; I99-Y135 HydrophobicContact CD1-CE1 3.74Å; I131-Y135 VanDerWaalsContact O-CB 3.31Å; I131-Y135 WeakPolarHBondContact O-CB 3.3Å; I131-Y135 PolarHBondContact O-N 2.74Å; I131-Y135 VanDerWaalsContact O-N 3.15Å; F132-Y135 PolarHBondContact O-N 3.43Å; V133-Y135 VanDerWaalsContact C-N 3.34Å; V133-Y135 PolarHBondContact O-N 3.33Å; Y135-R137 VanDerWaalsContact C-N 3.29Å; Y135-R137 PolarHBondContact O-N 3.17Å; Y135-K138 WeakPolarHBondContact O-CB 3.27Å; Y135-K138 PolarHBondContact O-N 3.26Å; Y135-K138 VanDerWaalsContact O-N 3.13Å; Y135-E139 HydrophobicContact CD2-CG 4.19Å; Y135-E139 HydrophobicContact CE1-CG 4.07Å; Y135-E139 HydrophobicContact CE2-CG 3.71Å; Y135-E139 PolarHBondContact O-N 3.22Å
136	A	94.3	Very high	94	Very high	6 Å²	6	64.2 Å²	64.2	5%	0.05	31%	0.31	C	S	.	.	H	α-helix	trans	-61.6	-39.6	179.8	0	0	0	0	0	111.6	F132 V133 K138 E139 K140 Q141 V143	F132-A136 WeakPolarHBondContact O-CB 3.43Å; F132-A136 PolarHBondContact O-N 3.07Å; V133-A136 PolarHBondContact O-N 3.47Å; A136-K138 PolarHBondContact O-N 2.88Å; A136-E139 CarbonylContact O-C 3.56Å; A136-E139 PolarHBondContact O-N 2.72Å; A136-K140 WeakPolarHBondContact O-CA 3.29Å; A136-K140 PolarHBondContact O-N 2.87Å; A136-Q141 CarbonylContact C-O 3.56Å; A136-Q141 WeakPolarHBondContact CB-O 3.23Å; A136-Q141 PolarHBondContact O-N 3.43Å; A136-V143 HydrophobicContact CB-CB 4.26Å; A136-V143 HydrophobicContact CB-CG2 3.82Å
137	R	93	Very high	94.2	Very high	154 Å²	154	58 Å²	58	58%	0.581	29%	0.286	S	S	*	.	H	α-helix	trans	-61.4	-42.7	174.3	-169.2	-179	-65.4	-171.1	-0.6	112.2	V133 Y135 K140 D175	V133-R137 WeakPolarHBondContact O-CB 3.43Å; V133-R137 PolarHBondContact O-N 3.14Å; Y135-R137 VanDerWaalsContact C-N 3.29Å; Y135-R137 PolarHBondContact O-N 3.17Å; R137-K140 PolarHBondContact O-N 3.26Å; R137-D175 IonicContact CZ-OD2 3.92Å; R137-D175 IonicContact NH2-OD1 3.53Å; R137-D175 IonicContact NH2-OD2 2.72Å; R137-D175 PolarHBondContact NH2-OD2 3.34Å
138	K	94.4	Very high	94.4	Very high	147 Å²	147	55 Å²	55	64%	0.639	27%	0.265	S	S	*	.	H	α-helix	trans	-64.2	-44.7	177.2	-176.8	-175.9	174.6	-172.6	0	111.8	N134 Y135 A136 K140	N134-K138 WeakPolarHBondContact O-CB 3.34Å; N134-K138 PolarHBondContact O-N 3.04Å; Y135-K138 WeakPolarHBondContact O-CB 3.27Å; Y135-K138 PolarHBondContact O-N 3.26Å; Y135-K138 VanDerWaalsContact O-N 3.13Å; A136-K138 PolarHBondContact O-N 2.88Å; K138-K140 PolarHBondContact O-N 2.86Å
139	E	93.7	Very high	94.4	Very high	90 Å²	90	57 Å²	57	42%	0.421	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.3	0.2	179.7	-61.6	-55.6	130.4	0	0	113.3	Y135 A136 Q141	Y135-E139 HydrophobicContact CD2-CG 4.19Å; Y135-E139 HydrophobicContact CE1-CG 4.07Å; Y135-E139 HydrophobicContact CE2-CG 3.71Å; Y135-E139 PolarHBondContact O-N 3.22Å; A136-E139 CarbonylContact O-C 3.56Å; A136-E139 PolarHBondContact O-N 2.72Å; E139-Q141 HydrophobicContact CB-CG 4.03Å; E139-Q141 PolarHBondContact O-N 2.82Å
140	K	92.3	Very high	94.5	Very high	189 Å²	189	57.5 Å²	57.5	82%	0.822	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	53	38.4	-175.6	-57	179.6	179.7	178.8	0	112.7	A136 R137 K138	A136-K140 WeakPolarHBondContact O-CA 3.29Å; A136-K140 PolarHBondContact O-N 2.87Å; R137-K140 PolarHBondContact O-N 3.26Å; K138-K140 PolarHBondContact O-N 2.86Å
141	Q	91.2	Very high	94.6	Very high	124 Å²	124	55 Å²	55	58%	0.579	27%	0.271	S	S	*	.			trans	-106.1	151.2	177	-64.4	-60.2	-43.4	0	0	110.5	A136 E139 V143	A136-Q141 CarbonylContact C-O 3.56Å; A136-Q141 WeakPolarHBondContact CB-O 3.23Å; A136-Q141 PolarHBondContact O-N 3.43Å; E139-Q141 HydrophobicContact CB-CG 4.03Å; E139-Q141 PolarHBondContact O-N 2.82Å; Q141-V143 PolarHBondContact O-N 3.26Å
142	P	91.2	Very high	94.6	Very high	54 Å²	54	58.7 Å²	58.7	35%	0.351	30%	0.297	S	S	.	.			trans	-62.4	129	170.3	22.9	-30.3	0	0	0	110.7	W144 N145	P142-W144 VanDerWaalsContact C-N 3.29Å; P142-W144 PolarHBondContact O-N 2.88Å; P142-N145 HydrophobicContact CB-CB 4.2Å; P142-N145 HydrophobicContact CG-CB 3.77Å; P142-N145 WeakPolarHBondContact CG-ND2 3.32Å
143	V	92.1	Very high	94.5	Very high	30 Å²	30	61.9 Å²	61.9	18%	0.182	31%	0.309	C	S	.	.	S	Bend	trans	-58.5	-42.2	-176.3	177.5	0	0	0	0	111.4	V133 A136 Q141 M169	V133-V143 HydrophobicContact CG1-CG2 4.49Å; V133-V143 HydrophobicContact CG2-CG1 4Å; A136-V143 HydrophobicContact CB-CB 4.26Å; A136-V143 HydrophobicContact CB-CG2 3.82Å; Q141-V143 PolarHBondContact O-N 3.26Å; V143-M169 HydrophobicContact CG1-CE 4.4Å
144	W	94.7	Very high	94.4	Very high	16 Å²	16	68.5 Å²	68.5	6%	0.061	35%	0.35	C	S	.	.	S	Bend	trans	-88.5	-30.6	-166.8	-48.2	108.7	0	0	0	113.3	P142 P146 F147 L148 M169 A170 M177 D181	P142-W144 VanDerWaalsContact C-N 3.29Å; P142-W144 PolarHBondContact O-N 2.88Å; W144-P146 VanDerWaalsContact C-CD 3.49Å; W144-F147 PolarHBondContact O-N 3.44Å; W144-L148 HydrophobicContact CB-CD1 3.66Å; W144-L148 HydrophobicContact CB-CG 3.97Å; W144-L148 WeakPolarHBondContact O-CG 3.45Å; W144-L148 PolarHBondContact O-N 3.21Å; W144-M169 HydrophobicContact CH2-CB 4.38Å; W144-M169 HydrophobicContact CZ3-CB 3.7Å; W144-M169 HydrophobicContact CZ3-CE 4.45Å; W144-A170 HydrophobicContact CH2-CB 4.22Å; W144-A170 HydrophobicContact CZ3-CB 4.25Å; W144-M177 HydrophobicContact CB-CE 4.46Å; W144-M177 HydrophobicContact CD2-CB 4.39Å; W144-M177 HydrophobicContact CD2-CE 3.51Å; W144-M177 HydrophobicContact CD2-CG 4.1Å; W144-M177 HydrophobicContact CE3-CE 3.29Å; W144-M177 HydrophobicContact CG-CE 4.02Å; W144-M177 HydrophobicContact CG-CG 4.31Å; W144-M177 HydrophobicContact CH2-CB 4.18Å; W144-M177 HydrophobicContact CH2-CE 4.31Å; W144-M177 HydrophobicContact CZ2-CB 3.7Å; W144-M177 HydrophobicContact CZ2-CE 4.48Å; W144-M177 HydrophobicContact CZ2-CG 4.28Å; W144-M177 HydrophobicContact CZ3-CE 3.71Å; W144-D181 HydrophobicContact CB-CB 4.36Å; W144-D181 VanDerWaalsContact CD1-OD2 3.3Å; W144-D181 HydrophobicContact CG-CB 4.33Å
145	N	94.8	Very high	94.4	Very high	76 Å²	76	65.5 Å²	65.5	41%	0.406	33%	0.334	S	S	.	.	H	α-helix	trans	-52.4	-44.5	-171.6	-73.4	18.9	0	0	0	114.8	P142 F147 L148 A149	P142-N145 HydrophobicContact CB-CB 4.2Å; P142-N145 HydrophobicContact CG-CB 3.77Å; P142-N145 WeakPolarHBondContact CG-ND2 3.32Å; N145-F147 PolarHBondContact O-N 3.06Å; N145-L148 PolarHBondContact O-N 3.45Å; N145-A149 WeakPolarHBondContact O-CB 3.41Å; N145-A149 PolarHBondContact O-N 3.43Å
146	P	94.9	Very high	94.3	Very high	26 Å²	26	64.7 Å²	64.7	17%	0.169	34%	0.338	C	S	.	.	H	α-helix	trans	-58.8	-32.4	178.9	-24.8	35.1	0	0	0	113.2	I99 W144	I99-P146 HydrophobicContact CG1-CB 4.4Å; I99-P146 HydrophobicContact CG2-CB 4.03Å; I99-P146 HydrophobicContact CG2-CG 4.18Å; W144-P146 VanDerWaalsContact C-CD 3.49Å
147	F	97	Very high	94.4	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-85.4	-46	178.7	-58.7	-87.1	0	0	0	111.6	M102 I118 F132 W144 N145 A149 L150 V162 I165 V166 M169	M102-F147 HydrophobicContact CE-CD1 4.05Å; M102-F147 HydrophobicContact CE-CE1 3.58Å; M102-F147 HydrophobicContact CE-CZ 3.98Å; M102-F147 HydrophobicContact SD-CD1 4.28Å; M102-F147 HydrophobicContact SD-CE1 4.15Å; I118-F147 HydrophobicContact CD1-CE1 4.46Å; F132-F147 HydrophobicContact CD1-CE2 4.37Å; F132-F147 AromaticContact CD1-CZ 3.8Å; F132-F147 HydrophobicContact CD1-CZ 3.8Å; F132-F147 HydrophobicContact CD2-CZ 4.48Å; F132-F147 HydrophobicContact CE1-CZ 4Å; F132-F147 HydrophobicContact CG-CZ 4.05Å; F132-F147 HydrophobicContact CZ-CZ 4.42Å; W144-F147 PolarHBondContact O-N 3.44Å; N145-F147 PolarHBondContact O-N 3.06Å; F147-A149 VanDerWaalsContact C-N 3.27Å; F147-A149 PolarHBondContact O-N 3.43Å; F147-L150 WeakPolarHBondContact O-CB 3.33Å; F147-L150 PolarHBondContact O-N 2.79Å; F147-L150 VanDerWaalsContact O-N 3.12Å; F147-V162 HydrophobicContact CB-CG2 4.01Å; F147-V162 HydrophobicContact CD1-CG2 4.25Å; F147-V162 WeakPolarHBondContact O-CG2 3.44Å; F147-I165 HydrophobicContact CD1-CG2 3.97Å; F147-I165 HydrophobicContact CE1-CG2 3.9Å; F147-V166 HydrophobicContact CB-CG2 3.63Å; F147-M169 HydrophobicContact CD1-SD 4.29Å; F147-M169 HydrophobicContact CD2-CE 4.22Å; F147-M169 HydrophobicContact CD2-SD 4.22Å; F147-M169 HydrophobicContact CE1-SD 3.89Å; F147-M169 HydrophobicContact CE2-CE 3.66Å; F147-M169 HydrophobicContact CE2-SD 3.83Å; F147-M169 HydrophobicContact CG-SD 4.44Å; F147-M169 HydrophobicContact CZ-CE 3.96Å; F147-M169 HydrophobicContact CZ-SD 3.65Å
148	L	97.3	Very high	94.6	Very high	8 Å²	8	57 Å²	57	4%	0.042	31%	0.308	C	S	.	.	H	α-helix	trans	-62.9	-34.6	179.6	-66.7	-178.5	0	0	0	111.9	W144 N145 L150 L151 V166 D181 Y184 F185	W144-L148 HydrophobicContact CB-CD1 3.66Å; W144-L148 HydrophobicContact CB-CG 3.97Å; W144-L148 WeakPolarHBondContact O-CG 3.45Å; W144-L148 PolarHBondContact O-N 3.21Å; N145-L148 PolarHBondContact O-N 3.45Å; L148-L150 PolarHBondContact O-N 3.09Å; L148-L151 HydrophobicContact CD2-CD1 3.72Å; L148-L151 VanDerWaalsContact O-CB 3.28Å; L148-L151 WeakPolarHBondContact O-CB 3.32Å; L148-L151 PolarHBondContact O-N 3.16Å; L148-V166 HydrophobicContact CD2-CG1 3.96Å; L148-V166 HydrophobicContact CD2-CG2 4.29Å; L148-D181 HydrophobicContact CD1-CB 3.87Å; L148-Y184 HydrophobicContact CB-CD1 4.35Å; L148-Y184 HydrophobicContact CB-CE1 4.18Å; L148-Y184 HydrophobicContact CD1-CD1 4.19Å; L148-Y184 HydrophobicContact CD2-CD1 4.21Å; L148-Y184 HydrophobicContact CD2-CE1 4.47Å; L148-Y184 HydrophobicContact CG-CD1 4.49Å; L148-F185 HydrophobicContact CD2-CB 4.15Å; L148-F185 HydrophobicContact CD2-CD2 4.16Å; L148-F185 HydrophobicContact CD2-CG 4.41Å
149	A	96	Very high	94.7	Very high	62 Å²	62	50.4 Å²	50.4	51%	0.512	28%	0.279	S	S	.	.	G	3₁₀ helix	trans	-57.6	-33.5	175.7	0	0	0	0	0	112.6	N145 F147 L151 S152	N145-A149 WeakPolarHBondContact O-CB 3.41Å; N145-A149 PolarHBondContact O-N 3.43Å; F147-A149 VanDerWaalsContact C-N 3.27Å; F147-A149 PolarHBondContact O-N 3.43Å; A149-L151 VanDerWaalsContact C-N 3.25Å; A149-L151 PolarHBondContact O-N 3.37Å; A149-S152 PolarHBondContact O-N 2.92Å; A149-S152 PolarHBondContact O-OG 2.72Å
150	L	97	Very high	94.8	Very high	11 Å²	11	46.2 Å²	46.2	6%	0.058	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-70.6	-17.8	178.8	-69.1	176.2	0	0	0	113.4	M102 V111 L115 F147 L148 S152 R153 I158 V162	M102-L150 HydrophobicContact CB-CD1 4.19Å; M102-L150 HydrophobicContact CG-CD1 4.29Å; M102-L150 HydrophobicContact SD-CD1 3.97Å; V111-L150 HydrophobicContact CG1-CD1 4.43Å; V111-L150 HydrophobicContact CG1-CD2 4.3Å; L115-L150 HydrophobicContact CD1-CD1 4.47Å; L115-L150 HydrophobicContact CD2-CD1 3.92Å; F147-L150 WeakPolarHBondContact O-CB 3.33Å; F147-L150 PolarHBondContact O-N 2.79Å; F147-L150 VanDerWaalsContact O-N 3.12Å; L148-L150 PolarHBondContact O-N 3.09Å; L150-S152 PolarHBondContact O-N 3.01Å; L150-S152 VanDerWaalsContact O-N 3.15Å; L150-R153 HydrophobicContact CD2-CG 4.12Å; L150-R153 WeakPolarHBondContact O-CB 2.83Å; L150-R153 WeakPolarHBondContact O-CG 3.5Å; L150-R153 PolarHBondContact O-N 2.89Å; L150-R153 VanDerWaalsContact O-N 3.09Å; L150-I158 HydrophobicContact CB-CG2 4.32Å; L150-I158 HydrophobicContact CD2-CG2 4.48Å; L150-V162 HydrophobicContact CB-CB 4.26Å; L150-V162 HydrophobicContact CB-CG1 3.91Å; L150-V162 HydrophobicContact CB-CG2 4.11Å; L150-V162 HydrophobicContact CD1-CB 4.45Å; L150-V162 HydrophobicContact CD1-CG2 4.01Å
151	L	97	Very high	95.1	Very high	4 Å²	4	37.6 Å²	37.6	2%	0.021	22%	0.222	C	C	.	.	G	3₁₀ helix	trans	-66.4	-12.6	175.9	-63.9	172.9	0	0	0	113.3	L148 A149 I159 V162 Y184 F185 W188	L148-L151 HydrophobicContact CD2-CD1 3.72Å; L148-L151 VanDerWaalsContact O-CB 3.28Å; L148-L151 WeakPolarHBondContact O-CB 3.32Å; L148-L151 PolarHBondContact O-N 3.16Å; A149-L151 VanDerWaalsContact C-N 3.25Å; A149-L151 PolarHBondContact O-N 3.37Å; L151-I159 WeakPolarHBondContact CD2-O 3.37Å; L151-V162 HydrophobicContact CD2-CG1 3.55Å; L151-V162 HydrophobicContact CG-CG1 4.1Å; L151-Y184 HydrophobicContact CD1-CE1 4.03Å; L151-F185 HydrophobicContact CD1-CD2 3.75Å; L151-F185 HydrophobicContact CD1-CE2 4.16Å; L151-W188 HydrophobicContact CD1-CD2 4.44Å; L151-W188 HydrophobicContact CD1-CG 4.36Å; L151-W188 HydrophobicContact CD2-CD2 4.15Å; L151-W188 HydrophobicContact CD2-CE3 4.36Å; L151-W188 HydrophobicContact CD2-CH2 4.11Å; L151-W188 HydrophobicContact CD2-CZ2 3.87Å; L151-W188 HydrophobicContact CD2-CZ3 4.34Å; L151-W188 PolarHBondContact O-NE1 3.04Å
152	S	94.5	Very high	95.4	Very high	92 Å²	92	31.7 Å²	31.7	64%	0.643	20%	0.195	S	C	*	.	G	3₁₀ helix	trans	-89	-4.2	174.9	70.7	0	0	0	0	114.3	A149 L150	A149-S152 PolarHBondContact O-N 2.92Å; A149-S152 PolarHBondContact O-OG 2.72Å; L150-S152 PolarHBondContact O-N 3.01Å; L150-S152 VanDerWaalsContact O-N 3.15Å
153	R	94.3	Very high	95.7	Very high	69 Å²	69	29.1 Å²	29.1	26%	0.26	18%	0.178	S	C	.	.			trans	-65.8	151.6	177.7	-70.8	-70.4	-148.2	137.3	7.7	111.4	I105 D108 L150 I158 I159	I105-R153 PolarHBondContact O-NH2 3.02Å; D108-R153 IonicContact OD1-CZ 3.87Å; D108-R153 IonicContact OD1-NH1 3.18Å; D108-R153 PolarHBondContact OD1-NH1 3.43Å; D108-R153 IonicContact OD1-NH2 2.79Å; L150-R153 HydrophobicContact CD2-CG 4.12Å; L150-R153 WeakPolarHBondContact O-CB 2.83Å; L150-R153 WeakPolarHBondContact O-CG 3.5Å; L150-R153 PolarHBondContact O-N 2.89Å; L150-R153 VanDerWaalsContact O-N 3.09Å; R153-I158 HydrophobicContact CB-CG2 4.02Å; R153-I158 HydrophobicContact CG-CG2 3.95Å; R153-I159 HydrophobicContact CB-CG2 3.99Å; R153-I159 WeakPolarHBondContact O-CG2 3.4Å
154	V	92.6	Very high	95.8	Very high	149 Å²	149	29 Å²	29	90%	0.903	18%	0.176	S	C	*	.	S	Bend	trans	-75.4	-29.6	176	-178.6	0	0	0	0	111.4	G156	V154-G156 PolarHBondContact O-N 2.98Å
155	D	94.8	Very high	95.9	Very high	27 Å²	27	28.3 Å²	28.3	14%	0.144	17%	0.173	C	C	.	.			trans	-67.5	117.1	-176.8	-175.3	-85.7	0	0	0	112.1	R112 F157 I158 I159	R112-D155 IonicContact CZ-OD1 3.76Å; R112-D155 IonicContact CZ-OD2 3.66Å; R112-D155 IonicContact NE-OD1 2.91Å; R112-D155 PolarHBondContact NE-OD1 3.47Å; R112-D155 IonicContact NE-OD2 3.97Å; R112-D155 PolarHBondContact NE-OD2 2.9Å; R112-D155 IonicContact NH2-OD1 2.69Å; R112-D155 PolarHBondContact NH2-OD1 3.37Å; R112-D155 IonicContact NH2-OD2 3.94Å; R112-D155 PolarHBondContact NH2-OD2 2.97Å; D155-F157 VanDerWaalsContact C-N 3.31Å; D155-F157 PolarHBondContact O-N 2.88Å; D155-F157 WeakPolarHBondContact OD1-CB 3.26Å; D155-F157 PolarHBondContact OD1-N 2.86Å; D155-F157 VanDerWaalsContact OD1-N 3.11Å; D155-I158 HydrophobicContact CB-CB 4.08Å; D155-I158 HydrophobicContact CB-CD1 3.88Å; D155-I158 HydrophobicContact CB-CG1 4.13Å; D155-I158 PolarHBondContact O-N 2.97Å; D155-I158 WeakPolarHBondContact OD1-CG1 2.91Å; D155-I158 PolarHBondContact OD1-N 3.5Å; D155-I159 PolarHBondContact O-N 3.36Å
156	G	93.7	Very high	96	Very high	24 Å²	24	24.7 Å²	24.7	25%	0.247	15%	0.154	C	C	.	.	H	α-helix	trans	-62.6	-32.7	-176.5	0	0	0	0	0	114.1	V154 I159 N160	V154-G156 PolarHBondContact O-N 2.98Å; G156-I159 WeakPolarHBondContact O-CG1 3.38Å; G156-N160 WeakPolarHBondContact O-CB 3.21Å; G156-N160 PolarHBondContact O-N 3.28Å; G156-N160 PolarHBondContact O-ND2 3.34Å
157	F	95.7	Very high	96.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-69.9	-49.8	176.7	-179.2	-81.2	0	0	0	110.5	L41 E44 R112 I116 D155 I159 N160 Q161	L41-F157 HydrophobicContact CD1-CD2 3.62Å; L41-F157 HydrophobicContact CD1-CE2 3.81Å; L41-F157 HydrophobicContact CD1-CG 4.09Å; L41-F157 HydrophobicContact CD1-CZ 4.44Å; L41-F157 HydrophobicContact CG-CE2 4.28Å; L41-F157 WeakPolarHBondContact O-CE2 3.42Å; E44-F157 HydrophobicContact CB-CD2 3.54Å; E44-F157 HydrophobicContact CB-CE2 3.74Å; E44-F157 HydrophobicContact CG-CD2 4.49Å; R112-F157 HydrophobicContact CB-CD1 3.85Å; R112-F157 HydrophobicContact CB-CE1 3.86Å; R112-F157 HydrophobicContact CG-CB 4.49Å; R112-F157 HydrophobicContact CG-CD1 3.54Å; R112-F157 HydrophobicContact CG-CE1 4.1Å; R112-F157 HydrophobicContact CG-CG 4.24Å; R112-F157 VanDerWaalsContact CZ-CB 3.43Å; I116-F157 HydrophobicContact CD1-CE1 4.31Å; I116-F157 HydrophobicContact CD1-CZ 3.82Å; I116-F157 HydrophobicContact CG1-CE1 4.25Å; I116-F157 HydrophobicContact CG1-CZ 3.92Å; D155-F157 VanDerWaalsContact C-N 3.31Å; D155-F157 PolarHBondContact O-N 2.88Å; D155-F157 WeakPolarHBondContact OD1-CB 3.26Å; D155-F157 PolarHBondContact OD1-N 2.86Å; D155-F157 VanDerWaalsContact OD1-N 3.11Å; F157-I159 PolarHBondContact O-N 3.4Å; F157-N160 PolarHBondContact O-N 3.17Å; F157-Q161 HydrophobicContact CD1-CB 4.1Å; F157-Q161 HydrophobicContact CE1-CB 3.79Å; F157-Q161 HydrophobicContact CE1-CG 3.97Å; F157-Q161 HydrophobicContact CZ-CB 4.3Å; F157-Q161 HydrophobicContact CZ-CG 4.31Å; F157-Q161 VanDerWaalsContact O-CB 3.29Å; F157-Q161 WeakPolarHBondContact O-CB 3.27Å; F157-Q161 PolarHBondContact O-N 2.86Å
158	I	96.8	Very high	95.9	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-56.3	-50.9	-177.2	-74.1	172.7	0	0	0	110.8	D108 V111 R112 L115 L150 R153 D155 N160 Q161 V162	D108-I158 HydrophobicContact CB-CD1 3.74Å; V111-I158 HydrophobicContact CB-CD1 3.9Å; V111-I158 HydrophobicContact CG1-CD1 3.9Å; V111-I158 HydrophobicContact CG1-CG1 4.19Å; V111-I158 HydrophobicContact CG1-CG2 4.33Å; R112-I158 HydrophobicContact CG-CD1 4.24Å; R112-I158 HydrophobicContact CG-CG1 3.77Å; L115-I158 HydrophobicContact CD1-CB 4.26Å; L115-I158 HydrophobicContact CD1-CG1 4.24Å; L115-I158 HydrophobicContact CD1-CG2 3.93Å; L150-I158 HydrophobicContact CB-CG2 4.32Å; L150-I158 HydrophobicContact CD2-CG2 4.48Å; R153-I158 HydrophobicContact CB-CG2 4.02Å; R153-I158 HydrophobicContact CG-CG2 3.95Å; D155-I158 HydrophobicContact CB-CB 4.08Å; D155-I158 HydrophobicContact CB-CD1 3.88Å; D155-I158 HydrophobicContact CB-CG1 4.13Å; D155-I158 PolarHBondContact O-N 2.97Å; D155-I158 WeakPolarHBondContact OD1-CG1 2.91Å; D155-I158 PolarHBondContact OD1-N 3.5Å; I158-N160 VanDerWaalsContact C-N 3.28Å; I158-N160 PolarHBondContact O-N 2.98Å; I158-Q161 PolarHBondContact O-N 2.81Å; I158-V162 WeakPolarHBondContact O-CB 3.23Å; I158-V162 VanDerWaalsContact O-CG1 3.29Å; I158-V162 WeakPolarHBondContact O-CG1 3.38Å; I158-V162 PolarHBondContact O-N 3.44Å
159	I	97	Very high	95.8	Very high	8 Å²	8	24.4 Å²	24.4	4%	0.041	15%	0.15	C	C	.	.	H	α-helix	trans	-63.6	-35.1	-176.8	65.8	179	0	0	0	112.2	L151 R153 D155 G156 F157 V162 S163 W188	L151-I159 WeakPolarHBondContact CD2-O 3.37Å; R153-I159 HydrophobicContact CB-CG2 3.99Å; R153-I159 WeakPolarHBondContact O-CG2 3.4Å; D155-I159 PolarHBondContact O-N 3.36Å; G156-I159 WeakPolarHBondContact O-CG1 3.38Å; F157-I159 PolarHBondContact O-N 3.4Å; I159-V162 WeakPolarHBondContact O-CG1 3.43Å; I159-S163 WeakPolarHBondContact O-CB 3.27Å; I159-S163 PolarHBondContact O-N 2.97Å; I159-S163 VanDerWaalsContact O-N 3.12Å; I159-W188 HydrophobicContact CB-CZ2 4.02Å; I159-W188 HydrophobicContact CD1-CZ2 4.25Å; I159-W188 HydrophobicContact CG1-CZ2 4.25Å
160	N	96.6	Very high	95.8	Very high	2 Å²	2	21.5 Å²	21.5	1%	0.011	13%	0.126	C	C	.	.	H	α-helix	trans	-81.7	-39.5	-178.6	-78.2	-73.9	0	0	0	111.9	L41 G156 F157 I158 S163 L164 Y200 T203	L41-N160 HydrophobicContact CD1-CB 3.88Å; L41-N160 HydrophobicContact CD2-CB 4.39Å; G156-N160 WeakPolarHBondContact O-CB 3.21Å; G156-N160 PolarHBondContact O-N 3.28Å; G156-N160 PolarHBondContact O-ND2 3.34Å; F157-N160 PolarHBondContact O-N 3.17Å; I158-N160 VanDerWaalsContact C-N 3.28Å; I158-N160 PolarHBondContact O-N 2.98Å; N160-S163 PolarHBondContact O-N 3.25Å; N160-S163 PolarHBondContact O-OG 3.26Å; N160-L164 PolarHBondContact O-N 2.89Å; N160-L164 VanDerWaalsContact O-N 3.16Å; N160-Y200 HydrophobicContact CB-CD1 3.99Å; N160-Y200 HydrophobicContact CB-CG 4.18Å; N160-Y200 VanDerWaalsContact ND2-CB 3.33Å; N160-Y200 WeakPolarHBondContact ND2-CB 3.22Å; N160-Y200 WeakPolarHBondContact ND2-CD2 3.29Å; N160-Y200 VanDerWaalsContact OD1-CB 3.32Å; N160-Y200 WeakPolarHBondContact OD1-CB 3.34Å; N160-T203 HydrophobicContact CB-CG2 4.21Å
161	Q	96.9	Very high	95.6	Very high	8 Å²	8	22 Å²	22	4%	0.037	13%	0.131	C	C	.	.	H	α-helix	trans	-64.3	-44.1	175	-173.7	62.8	43.6	0	0	111.1	L41 L115 D119 F157 I158 S163 L164 I165	L41-Q161 HydrophobicContact CD1-CB 4.35Å; L115-Q161 HydrophobicContact CB-CB 4.42Å; L115-Q161 HydrophobicContact CB-CG 3.67Å; L115-Q161 HydrophobicContact CD1-CB 4.38Å; D119-Q161 VanDerWaalsContact CG-NE2 3.27Å; D119-Q161 PolarHBondContact OD2-NE2 3Å; F157-Q161 HydrophobicContact CD1-CB 4.1Å; F157-Q161 HydrophobicContact CE1-CB 3.79Å; F157-Q161 HydrophobicContact CE1-CG 3.97Å; F157-Q161 HydrophobicContact CZ-CB 4.3Å; F157-Q161 HydrophobicContact CZ-CG 4.31Å; F157-Q161 VanDerWaalsContact O-CB 3.29Å; F157-Q161 WeakPolarHBondContact O-CB 3.27Å; F157-Q161 PolarHBondContact O-N 2.86Å; I158-Q161 PolarHBondContact O-N 2.81Å; Q161-S163 VanDerWaalsContact C-N 3.31Å; Q161-S163 PolarHBondContact O-N 3.22Å; Q161-L164 PolarHBondContact O-N 3.16Å; Q161-I165 HydrophobicContact CG-CD1 4.5Å; Q161-I165 WeakPolarHBondContact O-CG1 3.48Å; Q161-I165 PolarHBondContact O-N 3.41Å
162	V	97.5	Very high	95.4	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-66.9	-34.3	175.6	77.9	0	0	0	0	111.3	L115 F147 L150 L151 I158 I159 L164 I165 V166	L115-V162 HydrophobicContact CD1-CB 4.31Å; L115-V162 HydrophobicContact CD2-CB 4.02Å; L115-V162 HydrophobicContact CD2-CG2 4Å; F147-V162 HydrophobicContact CB-CG2 4.01Å; F147-V162 HydrophobicContact CD1-CG2 4.25Å; F147-V162 WeakPolarHBondContact O-CG2 3.44Å; L150-V162 HydrophobicContact CB-CB 4.26Å; L150-V162 HydrophobicContact CB-CG1 3.91Å; L150-V162 HydrophobicContact CB-CG2 4.11Å; L150-V162 HydrophobicContact CD1-CB 4.45Å; L150-V162 HydrophobicContact CD1-CG2 4.01Å; L151-V162 HydrophobicContact CD2-CG1 3.55Å; L151-V162 HydrophobicContact CG-CG1 4.1Å; I158-V162 WeakPolarHBondContact O-CB 3.23Å; I158-V162 VanDerWaalsContact O-CG1 3.29Å; I158-V162 WeakPolarHBondContact O-CG1 3.38Å; I158-V162 PolarHBondContact O-N 3.44Å; I159-V162 WeakPolarHBondContact O-CG1 3.43Å; V162-L164 VanDerWaalsContact C-N 3.28Å; V162-L164 PolarHBondContact O-N 3Å; V162-I165 PolarHBondContact O-N 3.34Å; V162-V166 HydrophobicContact CG2-CG2 4.31Å; V162-V166 WeakPolarHBondContact O-CB 3.12Å; V162-V166 VanDerWaalsContact O-CG2 3.26Å; V162-V166 WeakPolarHBondContact O-CG2 3.01Å; V162-V166 PolarHBondContact O-N 3.27Å
163	S	97.6	Very high	95	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-59.9	-37	174.5	83.5	0	0	0	0	112.9	I159 N160 Q161 V166 A167 F185 C207	I159-S163 WeakPolarHBondContact O-CB 3.27Å; I159-S163 PolarHBondContact O-N 2.97Å; I159-S163 VanDerWaalsContact O-N 3.12Å; N160-S163 PolarHBondContact O-N 3.25Å; N160-S163 PolarHBondContact O-OG 3.26Å; Q161-S163 VanDerWaalsContact C-N 3.31Å; Q161-S163 PolarHBondContact O-N 3.22Å; S163-V166 PolarHBondContact O-N 2.93Å; S163-A167 WeakPolarHBondContact O-CB 3.31Å; S163-A167 PolarHBondContact O-N 2.81Å; S163-F185 WeakPolarHBondContact O-CZ 3.05Å; S163-C207 PolarHBondContact OG-SG 3.09Å
164	L	95.5	Very high	94.5	Very high	28 Å²	28	27.3 Å²	27.3	15%	0.147	15%	0.15	C	C	.	.	H	α-helix	trans	-66.8	-43.9	175.3	-77.2	175	0	0	0	111.5	L41 N160 Q161 V162 V166 A167 K168 T203 R206	L41-L164 HydrophobicContact CD2-CD1 3.39Å; L41-L164 HydrophobicContact CD2-CG 4.35Å; N160-L164 PolarHBondContact O-N 2.89Å; N160-L164 VanDerWaalsContact O-N 3.16Å; Q161-L164 PolarHBondContact O-N 3.16Å; V162-L164 VanDerWaalsContact C-N 3.28Å; V162-L164 PolarHBondContact O-N 3Å; L164-V166 VanDerWaalsContact C-N 3.35Å; L164-A167 PolarHBondContact O-N 3.31Å; L164-K168 WeakPolarHBondContact O-CB 3.25Å; L164-K168 VanDerWaalsContact O-CG 3.25Å; L164-K168 WeakPolarHBondContact O-CG 3.41Å; L164-K168 PolarHBondContact O-N 2.85Å; L164-T203 HydrophobicContact CD1-CG2 3.92Å; L164-T203 HydrophobicContact CD2-CG2 3.92Å; L164-T203 HydrophobicContact CG-CG2 3.65Å; L164-R206 HydrophobicContact CD2-CG 4.47Å
165	I	96.3	Very high	94.3	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-61.7	-46.3	177.2	-66	165.4	0	0	0	109.8	L115 I118 D119 L122 F147 Q161 V162 A167 K168 M169	L115-I165 HydrophobicContact CB-CD1 4.05Å; L115-I165 HydrophobicContact CD2-CD1 3.75Å; L115-I165 VanDerWaalsContact O-CD1 3.31Å; L115-I165 WeakPolarHBondContact O-CD1 3.32Å; I118-I165 HydrophobicContact CB-CD1 4.17Å; I118-I165 HydrophobicContact CG2-CD1 4.08Å; I118-I165 HydrophobicContact CG2-CG1 4.44Å; I118-I165 HydrophobicContact CG2-CG2 3.89Å; D119-I165 HydrophobicContact CB-CD1 4.25Å; D119-I165 HydrophobicContact CB-CG1 3.98Å; L122-I165 HydrophobicContact CD1-CG2 4.1Å; F147-I165 HydrophobicContact CD1-CG2 3.97Å; F147-I165 HydrophobicContact CE1-CG2 3.9Å; Q161-I165 HydrophobicContact CG-CD1 4.5Å; Q161-I165 WeakPolarHBondContact O-CG1 3.48Å; Q161-I165 PolarHBondContact O-N 3.41Å; V162-I165 PolarHBondContact O-N 3.34Å; I165-A167 PolarHBondContact O-N 3.18Å; I165-K168 PolarHBondContact O-N 3.02Å; I165-M169 HydrophobicContact CG2-CG 4.26Å; I165-M169 HydrophobicContact CG2-SD 3.8Å; I165-M169 WeakPolarHBondContact O-CB 3.46Å; I165-M169 VanDerWaalsContact O-CG 3.29Å; I165-M169 WeakPolarHBondContact O-CG 3.27Å; I165-M169 PolarHBondContact O-N 3Å
166	V	97.2	Very high	94.2	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-59.1	-48	176.9	172.9	0	0	0	0	110.7	F147 L148 V162 S163 L164 K168 M169 A170 M177 F185	F147-V166 HydrophobicContact CB-CG2 3.63Å; L148-V166 HydrophobicContact CD2-CG1 3.96Å; L148-V166 HydrophobicContact CD2-CG2 4.29Å; V162-V166 HydrophobicContact CG2-CG2 4.31Å; V162-V166 WeakPolarHBondContact O-CB 3.12Å; V162-V166 VanDerWaalsContact O-CG2 3.26Å; V162-V166 WeakPolarHBondContact O-CG2 3.01Å; V162-V166 PolarHBondContact O-N 3.27Å; S163-V166 PolarHBondContact O-N 2.93Å; L164-V166 VanDerWaalsContact C-N 3.35Å; V166-K168 PolarHBondContact O-N 3.36Å; V166-M169 PolarHBondContact O-N 2.95Å; V166-A170 VanDerWaalsContact O-CB 3.25Å; V166-A170 WeakPolarHBondContact O-CB 3.42Å; V166-A170 PolarHBondContact O-N 3.25Å; V166-M177 HydrophobicContact CG1-CE 3.51Å; V166-F185 HydrophobicContact CB-CD2 4.49Å; V166-F185 HydrophobicContact CB-CE1 4.48Å; V166-F185 HydrophobicContact CB-CE2 4Å; V166-F185 HydrophobicContact CB-CZ 4Å; V166-F185 HydrophobicContact CG1-CD1 3.87Å; V166-F185 HydrophobicContact CG1-CD2 3.77Å; V166-F185 HydrophobicContact CG1-CE1 3.81Å; V166-F185 HydrophobicContact CG1-CE2 3.71Å; V166-F185 HydrophobicContact CG1-CG 3.85Å; V166-F185 HydrophobicContact CG1-CZ 3.73Å
167	A	95.8	Very high	94.2	Very high	2 Å²	2	24.1 Å²	24.1	2%	0.017	12%	0.121	C	C	.	.	H	α-helix	trans	-61.9	-41.5	177.7	0	0	0	0	0	112.4	S163 L164 I165 C171 F185 C207 V210 M211	S163-A167 WeakPolarHBondContact O-CB 3.31Å; S163-A167 PolarHBondContact O-N 2.81Å; L164-A167 PolarHBondContact O-N 3.31Å; I165-A167 PolarHBondContact O-N 3.18Å; A167-C171 WeakPolarHBondContact O-CB 3.44Å; A167-C171 PolarHBondContact O-N 3.25Å; A167-C171 VanDerWaalsContact O-N 3.15Å; A167-C171 PolarHBondContact O-SG 3.41Å; A167-F185 HydrophobicContact CB-CE1 4.23Å; A167-F185 HydrophobicContact CB-CZ 4.28Å; A167-C207 HydrophobicContact CB-CB 4.1Å; A167-V210 HydrophobicContact CB-CG1 4.49Å; A167-M211 HydrophobicContact CB-CG 4.3Å; A167-M211 HydrophobicContact CB-SD 4.21Å
168	K	94.2	Very high	94.1	Very high	27 Å²	27	29.7 Å²	29.7	12%	0.117	15%	0.151	C	C	.	.	H	α-helix	trans	-62.6	-49.8	174.9	-74.7	172	178.6	179.3	0	111.2	D119 Q123 L164 I165 V166 A170 C171 W172	D119-K168 WeakPolarHBondContact OD1-CD 3.29Å; D119-K168 WeakPolarHBondContact OD1-CE 3.33Å; D119-K168 IonicContact OD1-NZ 3.13Å; D119-K168 PolarHBondContact OD1-NZ 2.92Å; D119-K168 IonicContact OD2-NZ 3.38Å; D119-K168 PolarHBondContact OD2-NZ 3.48Å; Q123-K168 VanDerWaalsContact CG-NZ 3.31Å; Q123-K168 VanDerWaalsContact NE2-NZ 3.12Å; L164-K168 WeakPolarHBondContact O-CB 3.25Å; L164-K168 VanDerWaalsContact O-CG 3.25Å; L164-K168 WeakPolarHBondContact O-CG 3.41Å; L164-K168 PolarHBondContact O-N 2.85Å; I165-K168 PolarHBondContact O-N 3.02Å; V166-K168 PolarHBondContact O-N 3.36Å; K168-A170 VanDerWaalsContact C-N 3.35Å; K168-A170 PolarHBondContact O-N 2.86Å; K168-C171 PolarHBondContact O-N 3.14Å; K168-W172 HydrophobicContact CB-CD2 4.06Å; K168-W172 HydrophobicContact CB-CE3 3.82Å; K168-W172 HydrophobicContact CB-CH2 4.19Å; K168-W172 HydrophobicContact CB-CZ2 4.39Å; K168-W172 HydrophobicContact CB-CZ3 3.88Å; K168-W172 HydrophobicContact CD-CH2 3.58Å; K168-W172 HydrophobicContact CD-CZ2 4.23Å; K168-W172 HydrophobicContact CD-CZ3 3.75Å; K168-W172 HydrophobicContact CG-CD2 4.39Å; K168-W172 HydrophobicContact CG-CE3 4.21Å; K168-W172 HydrophobicContact CG-CH2 3.64Å; K168-W172 HydrophobicContact CG-CZ2 3.8Å; K168-W172 HydrophobicContact CG-CZ3 3.84Å; K168-W172 WeakPolarHBondContact O-CB 3.48Å; K168-W172 VanDerWaalsContact O-CG 3.26Å; K168-W172 PolarHBondContact O-N 3.29Å
169	M	95	Very high	94	Very high	0 Å²	0	32 Å²	32	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.2	-43.6	178.9	-71.4	179.5	62	0	0	111.7	L122 V129 F132 V143 W144 F147 I165 V166 C171 G173	L122-M169 HydrophobicContact CD1-CG 3.85Å; V129-M169 HydrophobicContact CG1-CB 4.04Å; V129-M169 HydrophobicContact CG1-CG 4.14Å; V129-M169 HydrophobicContact CG2-CG 4.18Å; F132-M169 HydrophobicContact CB-CE 3.77Å; F132-M169 HydrophobicContact CD2-CE 4.27Å; F132-M169 HydrophobicContact CD2-SD 4.46Å; F132-M169 HydrophobicContact CG-CE 4.21Å; V143-M169 HydrophobicContact CG1-CE 4.4Å; W144-M169 HydrophobicContact CH2-CB 4.38Å; W144-M169 HydrophobicContact CZ3-CB 3.7Å; W144-M169 HydrophobicContact CZ3-CE 4.45Å; F147-M169 HydrophobicContact CD1-SD 4.29Å; F147-M169 HydrophobicContact CD2-CE 4.22Å; F147-M169 HydrophobicContact CD2-SD 4.22Å; F147-M169 HydrophobicContact CE1-SD 3.89Å; F147-M169 HydrophobicContact CE2-CE 3.66Å; F147-M169 HydrophobicContact CE2-SD 3.83Å; F147-M169 HydrophobicContact CG-SD 4.44Å; F147-M169 HydrophobicContact CZ-CE 3.96Å; F147-M169 HydrophobicContact CZ-SD 3.65Å; I165-M169 HydrophobicContact CG2-CG 4.26Å; I165-M169 HydrophobicContact CG2-SD 3.8Å; I165-M169 WeakPolarHBondContact O-CB 3.46Å; I165-M169 VanDerWaalsContact O-CG 3.29Å; I165-M169 WeakPolarHBondContact O-CG 3.27Å; I165-M169 PolarHBondContact O-N 3Å; V166-M169 PolarHBondContact O-N 2.95Å; M169-C171 PolarHBondContact O-N 3.44Å; M169-G173 PolarHBondContact O-N 3.17Å; M169-G173 VanDerWaalsContact O-N 3.12Å
170	A	94.8	Very high	94	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-64.8	-25.3	178.7	0	0	0	0	0	113.6	W144 V166 K168 M177 M211 Y217	W144-A170 HydrophobicContact CH2-CB 4.22Å; W144-A170 HydrophobicContact CZ3-CB 4.25Å; V166-A170 VanDerWaalsContact O-CB 3.25Å; V166-A170 WeakPolarHBondContact O-CB 3.42Å; V166-A170 PolarHBondContact O-N 3.25Å; K168-A170 VanDerWaalsContact C-N 3.35Å; K168-A170 PolarHBondContact O-N 2.86Å; A170-M177 HydrophobicContact CB-CB 4.15Å; A170-M177 HydrophobicContact CB-CE 4.03Å; A170-M211 HydrophobicContact CB-CE 4.07Å; A170-M211 HydrophobicContact CB-SD 3.79Å; A170-Y217 HydrophobicContact CB-CE2 4.2Å; A170-Y217 WeakPolarHBondContact O-CE2 3.47Å; A170-Y217 PolarHBondContact O-OH 3.04Å
171	C	92.9	Very high	94	Very high	23 Å²	23	37.3 Å²	37.3	16%	0.155	22%	0.215	C	C	.	.	H	α-helix	trans	-109.4	-17.8	-176.1	-59.7	0	0	0	0	114.5	A167 K168 M169 V210	A167-C171 WeakPolarHBondContact O-CB 3.44Å; A167-C171 PolarHBondContact O-N 3.25Å; A167-C171 VanDerWaalsContact O-N 3.15Å; A167-C171 PolarHBondContact O-SG 3.41Å; K168-C171 PolarHBondContact O-N 3.14Å; M169-C171 PolarHBondContact O-N 3.44Å; C171-V210 HydrophobicContact CB-CG1 3.88Å; C171-V210 PolarHBondContact SG-O 3.45Å; C171-V210 VanDerWaalsContact SG-O 3.39Å
172	W	92.5	Very high	94	Very high	62 Å²	62	37.5 Å²	37.5	24%	0.235	22%	0.216	C	C	.	.	H	α-helix	trans	-103.1	-14	179.1	-61	-11.2	0	0	0	112.8	L122 R126 V129 K168	L122-W172 HydrophobicContact CB-CE3 4.42Å; L122-W172 HydrophobicContact CB-CZ3 3.98Å; L122-W172 VanDerWaalsContact O-CZ3 3.32Å; L122-W172 WeakPolarHBondContact O-CZ3 3.36Å; R126-W172 HydrophobicContact CB-CB 4.19Å; R126-W172 HydrophobicContact CB-CD2 4.03Å; R126-W172 HydrophobicContact CB-CE3 3.97Å; R126-W172 HydrophobicContact CB-CG 4.15Å; R126-W172 HydrophobicContact CG-CD2 3.72Å; R126-W172 HydrophobicContact CG-CE3 3.73Å; R126-W172 HydrophobicContact CG-CG 4.19Å; R126-W172 HydrophobicContact CG-CH2 4.34Å; R126-W172 HydrophobicContact CG-CZ2 4.35Å; R126-W172 HydrophobicContact CG-CZ3 4.05Å; V129-W172 HydrophobicContact CG2-CB 3.98Å; V129-W172 HydrophobicContact CG2-CE3 4.47Å; K168-W172 HydrophobicContact CB-CD2 4.06Å; K168-W172 HydrophobicContact CB-CE3 3.82Å; K168-W172 HydrophobicContact CB-CH2 4.19Å; K168-W172 HydrophobicContact CB-CZ2 4.39Å; K168-W172 HydrophobicContact CB-CZ3 3.88Å; K168-W172 HydrophobicContact CD-CH2 3.58Å; K168-W172 HydrophobicContact CD-CZ2 4.23Å; K168-W172 HydrophobicContact CD-CZ3 3.75Å; K168-W172 HydrophobicContact CG-CD2 4.39Å; K168-W172 HydrophobicContact CG-CE3 4.21Å; K168-W172 HydrophobicContact CG-CH2 3.64Å; K168-W172 HydrophobicContact CG-CZ2 3.8Å; K168-W172 HydrophobicContact CG-CZ3 3.84Å; K168-W172 WeakPolarHBondContact O-CB 3.48Å; K168-W172 VanDerWaalsContact O-CG 3.26Å; K168-W172 PolarHBondContact O-N 3.29Å
173	G	86.1	Confident	94	Very high	16 Å²	16	40.4 Å²	40.4	17%	0.165	23%	0.234	C	C	.	.	S	Bend	trans	-75.4	159.2	172.9	0	0	0	0	0	112.9	M169	M169-G173 PolarHBondContact O-N 3.17Å; M169-G173 VanDerWaalsContact O-N 3.12Å
174	Q	85	Confident	94.1	Very high	197 Å²	197	45.4 Å²	45.4	92%	0.921	25%	0.253	S	S	*	.	S	Bend	trans	-77.3	-36.6	168.8	-69.6	-178.7	-22.2	0	0	111.8	L176	Q174-L176 PolarHBondContact O-N 3.4Å
175	D	87.4	Confident	94.2	Very high	70 Å²	70	44.1 Å²	44.1	37%	0.374	25%	0.246	S	C	.	.	S	Bend	trans	-83.1	108.8	175.1	-63.5	-36.6	0	0	0	108.5	V133 R137	V133-D175 WeakPolarHBondContact CG1-OD2 3.43Å; R137-D175 IonicContact CZ-OD2 3.92Å; R137-D175 IonicContact NH2-OD1 3.53Å; R137-D175 IonicContact NH2-OD2 2.72Å; R137-D175 PolarHBondContact NH2-OD2 3.34Å
176	L	92.8	Very high	94.3	Very high	62 Å²	62	44.1 Å²	44.1	33%	0.325	25%	0.246	S	C	.	.			trans	-68.2	147.3	174.6	-63.2	-178.4	0	0	0	110.5	Q174 I214 E216 Y217	Q174-L176 PolarHBondContact O-N 3.4Å; L176-I214 HydrophobicContact CD1-CG2 3.94Å; L176-I214 HydrophobicContact CD2-CG2 4.17Å; L176-E216 HydrophobicContact CD1-CG 4.37Å; L176-Y217 WeakPolarHBondContact CA-OH 3.38Å; L176-Y217 HydrophobicContact CB-CE1 4.2Å; L176-Y217 WeakPolarHBondContact CB-OH 3.3Å; L176-Y217 WeakPolarHBondContact CD2-OH 3.46Å
177	M	95.1	Very high	94.4	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	26%	0.262	C	S	.	.			trans	-71.5	128.5	170.1	-172.9	-171.8	-71.2	0	0	108.9	W144 V166 A170 D181 L182 F185 Y217	W144-M177 HydrophobicContact CB-CE 4.46Å; W144-M177 HydrophobicContact CD2-CB 4.39Å; W144-M177 HydrophobicContact CD2-CE 3.51Å; W144-M177 HydrophobicContact CD2-CG 4.1Å; W144-M177 HydrophobicContact CE3-CE 3.29Å; W144-M177 HydrophobicContact CG-CE 4.02Å; W144-M177 HydrophobicContact CG-CG 4.31Å; W144-M177 HydrophobicContact CH2-CB 4.18Å; W144-M177 HydrophobicContact CH2-CE 4.31Å; W144-M177 HydrophobicContact CZ2-CB 3.7Å; W144-M177 HydrophobicContact CZ2-CE 4.48Å; W144-M177 HydrophobicContact CZ2-CG 4.28Å; W144-M177 HydrophobicContact CZ3-CE 3.71Å; V166-M177 HydrophobicContact CG1-CE 3.51Å; A170-M177 HydrophobicContact CB-CB 4.15Å; A170-M177 HydrophobicContact CB-CE 4.03Å; M177-D181 HydrophobicContact CG-CB 3.94Å; M177-D181 HydrophobicContact SD-CB 4.31Å; M177-L182 HydrophobicContact CG-CB 4.01Å; M177-L182 WeakPolarHBondContact O-CD2 3.39Å; M177-L182 VanDerWaalsContact SD-CA 3.57Å; M177-L182 HydrophobicContact SD-CB 4.31Å; M177-L182 HydrophobicContact SD-CD1 4.37Å; M177-F185 HydrophobicContact SD-CB 4.1Å; M177-Y217 PolarHBondContact N-OH 2.87Å; M177-Y217 WeakPolarHBondContact O-CE1 3.38Å
178	D	93.4	Very high	94.5	Very high	117 Å²	117	47.7 Å²	47.7	63%	0.626	27%	0.266	S	S	*	.			trans	-131.8	178.5	-176.7	67.6	-6.3	0	0	0	112.4	A180 D181 L182	D178-A180 PolarHBondContact O-N 3.27Å; D178-D181 PolarHBondContact O-N 2.98Å; D178-L182 PolarHBondContact O-N 3.45Å
179	G	94.5	Very high	94.7	Very high	49 Å²	49	46.4 Å²	46.4	51%	0.505	26%	0.26	S	S	.	.	H	α-helix	trans	54.1	-131.2	171.5	0	0	0	0	0	115.2	T183	G179-T183 WeakPolarHBondContact O-CB 3.37Å; G179-T183 PolarHBondContact O-N 2.93Å; G179-T183 VanDerWaalsContact O-N 3.09Å; G179-T183 PolarHBondContact O-OG1 3.27Å
180	A	95.9	Very high	94.8	Very high	79 Å²	79	47.5 Å²	47.5	65%	0.653	27%	0.265	S	S	*	.	H	α-helix	trans	-67.3	-35.3	-174.8	0	0	0	0	0	112.8	D178 T183 Y184	D178-A180 PolarHBondContact O-N 3.27Å; A180-T183 PolarHBondContact O-N 2.88Å; A180-Y184 WeakPolarHBondContact O-CB 3.4Å; A180-Y184 PolarHBondContact O-N 3.47Å
181	D	97	Very high	94.9	Very high	42 Å²	42	51.7 Å²	51.7	23%	0.225	28%	0.284	C	S	.	.	H	α-helix	trans	-67.6	-45.3	-179.1	-69.2	-30.3	0	0	0	110.8	W144 L148 M177 D178 Y184 F185	W144-D181 HydrophobicContact CB-CB 4.36Å; W144-D181 VanDerWaalsContact CD1-OD2 3.3Å; W144-D181 HydrophobicContact CG-CB 4.33Å; L148-D181 HydrophobicContact CD1-CB 3.87Å; M177-D181 HydrophobicContact CG-CB 3.94Å; M177-D181 HydrophobicContact SD-CB 4.31Å; D178-D181 PolarHBondContact O-N 2.98Å; D181-Y184 PolarHBondContact O-N 3.15Å; D181-F185 PolarHBondContact O-N 2.88Å
182	L	97.8	Very high	95	Very high	12 Å²	12	54 Å²	54	6%	0.063	29%	0.29	C	S	.	.	H	α-helix	trans	-61.5	-47.8	174.7	-179.6	62.9	0	0	0	111.4	M177 D178 Y184 F185 L186 M211 Y217 A220	M177-L182 HydrophobicContact CG-CB 4.01Å; M177-L182 WeakPolarHBondContact O-CD2 3.39Å; M177-L182 VanDerWaalsContact SD-CA 3.57Å; M177-L182 HydrophobicContact SD-CB 4.31Å; M177-L182 HydrophobicContact SD-CD1 4.37Å; D178-L182 PolarHBondContact O-N 3.45Å; L182-Y184 VanDerWaalsContact C-N 3.31Å; L182-Y184 PolarHBondContact O-N 3.17Å; L182-F185 PolarHBondContact O-N 3.39Å; L182-L186 HydrophobicContact CD1-CD1 3.76Å; L182-L186 HydrophobicContact CD1-CG 3.9Å; L182-L186 HydrophobicContact CD2-CD1 4.5Å; L182-L186 HydrophobicContact CG-CD1 3.87Å; L182-L186 HydrophobicContact CG-CG 4.33Å; L182-L186 WeakPolarHBondContact O-CB 3.26Å; L182-L186 WeakPolarHBondContact O-CG 3.5Å; L182-L186 PolarHBondContact O-N 3.5Å; L182-M211 HydrophobicContact CD1-CE 3.71Å; L182-Y217 HydrophobicContact CD1-CD1 3.55Å; L182-Y217 HydrophobicContact CD1-CE1 3.81Å; L182-Y217 HydrophobicContact CD1-CG 4.04Å; L182-Y217 HydrophobicContact CD2-CD1 3.67Å; L182-Y217 HydrophobicContact CD2-CE1 4.06Å; L182-Y217 HydrophobicContact CG-CD1 4.27Å; L182-A220 HydrophobicContact CD2-CB 3.54Å; L182-A220 HydrophobicContact CG-CB 4.11Å
183	T	98	Very high	95.1	Very high	61 Å²	61	51.3 Å²	51.3	37%	0.374	28%	0.28	S	S	.	.	H	α-helix	trans	-60.9	-43.1	-179.9	-56.9	0	0	0	0	110.8	G179 A180 T187 I224	G179-T183 WeakPolarHBondContact O-CB 3.37Å; G179-T183 PolarHBondContact O-N 2.93Å; G179-T183 VanDerWaalsContact O-N 3.09Å; G179-T183 PolarHBondContact O-OG1 3.27Å; A180-T183 PolarHBondContact O-N 2.88Å; T183-T187 VanDerWaalsContact O-CB 3.22Å; T183-T187 WeakPolarHBondContact O-CB 3.33Å; T183-T187 PolarHBondContact O-N 3.05Å; T183-T187 PolarHBondContact O-OG1 2.88Å; T183-I224 HydrophobicContact CG2-CG2 4.05Å
184	Y	98.3	Very high	95.5	Very high	106 Å²	106	55 Å²	55	42%	0.416	29%	0.289	S	S	.	.	H	α-helix	trans	-60.7	-49.9	176.8	176.8	-101.5	0	0	0	111.5	L148 L151 A180 D181 L182 T187 W188	L148-Y184 HydrophobicContact CB-CD1 4.35Å; L148-Y184 HydrophobicContact CB-CE1 4.18Å; L148-Y184 HydrophobicContact CD1-CD1 4.19Å; L148-Y184 HydrophobicContact CD2-CD1 4.21Å; L148-Y184 HydrophobicContact CD2-CE1 4.47Å; L148-Y184 HydrophobicContact CG-CD1 4.49Å; L151-Y184 HydrophobicContact CD1-CE1 4.03Å; A180-Y184 WeakPolarHBondContact O-CB 3.4Å; A180-Y184 PolarHBondContact O-N 3.47Å; D181-Y184 PolarHBondContact O-N 3.15Å; L182-Y184 VanDerWaalsContact C-N 3.31Å; L182-Y184 PolarHBondContact O-N 3.17Å; Y184-T187 PolarHBondContact O-N 3.37Å; Y184-W188 WeakPolarHBondContact O-CB 3.27Å; Y184-W188 PolarHBondContact O-N 3.3Å
185	F	98.5	Very high	95.8	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-67.3	-43.4	-177.3	-175	-121.1	0	0	0	112.8	L148 L151 S163 V166 A167 M177 D181 L182 T187 W188 L189 M211	L148-F185 HydrophobicContact CD2-CB 4.15Å; L148-F185 HydrophobicContact CD2-CD2 4.16Å; L148-F185 HydrophobicContact CD2-CG 4.41Å; L151-F185 HydrophobicContact CD1-CD2 3.75Å; L151-F185 HydrophobicContact CD1-CE2 4.16Å; S163-F185 WeakPolarHBondContact O-CZ 3.05Å; V166-F185 HydrophobicContact CB-CD2 4.49Å; V166-F185 HydrophobicContact CB-CE1 4.48Å; V166-F185 HydrophobicContact CB-CE2 4Å; V166-F185 HydrophobicContact CB-CZ 4Å; V166-F185 HydrophobicContact CG1-CD1 3.87Å; V166-F185 HydrophobicContact CG1-CD2 3.77Å; V166-F185 HydrophobicContact CG1-CE1 3.81Å; V166-F185 HydrophobicContact CG1-CE2 3.71Å; V166-F185 HydrophobicContact CG1-CG 3.85Å; V166-F185 HydrophobicContact CG1-CZ 3.73Å; A167-F185 HydrophobicContact CB-CE1 4.23Å; A167-F185 HydrophobicContact CB-CZ 4.28Å; M177-F185 HydrophobicContact SD-CB 4.1Å; D181-F185 PolarHBondContact O-N 2.88Å; L182-F185 PolarHBondContact O-N 3.39Å; F185-T187 VanDerWaalsContact C-N 3.34Å; F185-T187 PolarHBondContact O-N 3.15Å; F185-W188 HydrophobicContact CE2-CE3 4.44Å; F185-W188 WeakPolarHBondContact O-CB 3.2Å; F185-W188 PolarHBondContact O-N 2.95Å; F185-L189 HydrophobicContact CD1-CD1 4.23Å; F185-L189 HydrophobicContact CE1-CD1 3.79Å; F185-L189 HydrophobicContact CE1-CG 4.39Å; F185-L189 HydrophobicContact CE2-CG 4.45Å; F185-L189 HydrophobicContact CZ-CD1 4.04Å; F185-L189 HydrophobicContact CZ-CD2 4.31Å; F185-L189 HydrophobicContact CZ-CG 4.23Å; F185-L189 PolarHBondContact O-N 3.41Å; F185-M211 HydrophobicContact CD1-CE 3.98Å; F185-M211 HydrophobicContact CD1-SD 4.29Å; F185-M211 HydrophobicContact CE1-CE 4.24Å; F185-M211 HydrophobicContact CE1-CG 4.05Å; F185-M211 HydrophobicContact CE1-SD 3.94Å
186	L	98.5	Very high	95.9	Very high	0 Å²	0	50.9 Å²	50.9	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-65.5	-37.7	176.5	-68.3	179.7	0	0	0	111.9	L182 W188 L189 K190 M211 A220 F221 I224	L182-L186 HydrophobicContact CD1-CD1 3.76Å; L182-L186 HydrophobicContact CD1-CG 3.9Å; L182-L186 HydrophobicContact CD2-CD1 4.5Å; L182-L186 HydrophobicContact CG-CD1 3.87Å; L182-L186 HydrophobicContact CG-CG 4.33Å; L182-L186 WeakPolarHBondContact O-CB 3.26Å; L182-L186 WeakPolarHBondContact O-CG 3.5Å; L182-L186 PolarHBondContact O-N 3.5Å; L186-W188 VanDerWaalsContact C-N 3.34Å; L186-L189 HydrophobicContact CD2-CD1 4.4Å; L186-L189 PolarHBondContact O-N 3.42Å; L186-K190 WeakPolarHBondContact O-CB 3.38Å; L186-K190 PolarHBondContact O-N 3.44Å; L186-M211 HydrophobicContact CD2-CB 4.4Å; L186-M211 HydrophobicContact CD2-CE 4.21Å; L186-A220 HydrophobicContact CD1-CB 3.59Å; L186-F221 HydrophobicContact CB-CD2 4.46Å; L186-F221 HydrophobicContact CD1-CB 4.15Å; L186-F221 HydrophobicContact CD2-CD2 4.3Å; L186-I224 VanDerWaalsContact C-CD1 3.46Å; L186-I224 HydrophobicContact CB-CD1 3.61Å
187	T	98.3	Very high	95.6	Very high	53 Å²	53	51.5 Å²	51.5	33%	0.325	30%	0.304	S	S	.	.	H	α-helix	trans	-64.3	-41.1	173.3	-58	0	0	0	0	110.8	T183 Y184 F185 L189 K190 E191	T183-T187 VanDerWaalsContact O-CB 3.22Å; T183-T187 WeakPolarHBondContact O-CB 3.33Å; T183-T187 PolarHBondContact O-N 3.05Å; T183-T187 PolarHBondContact O-OG1 2.88Å; Y184-T187 PolarHBondContact O-N 3.37Å; F185-T187 VanDerWaalsContact C-N 3.34Å; F185-T187 PolarHBondContact O-N 3.15Å; T187-L189 PolarHBondContact O-N 3.04Å; T187-K190 WeakPolarHBondContact O-CB 3.44Å; T187-K190 PolarHBondContact O-N 2.92Å; T187-E191 HydrophobicContact CG2-CG 4.5Å; T187-E191 WeakPolarHBondContact O-CG 3.33Å; T187-E191 PolarHBondContact O-N 3.16Å
188	W	98.3	Very high	95.5	Very high	25 Å²	25	52.4 Å²	52.4	10%	0.095	31%	0.308	C	S	.	.	H	α-helix	trans	-59.8	-45.3	174.5	-174.3	97.6	0	0	0	111.7	L151 I159 Y184 F185 L186 E191 R192	L151-W188 HydrophobicContact CD1-CD2 4.44Å; L151-W188 HydrophobicContact CD1-CG 4.36Å; L151-W188 HydrophobicContact CD2-CD2 4.15Å; L151-W188 HydrophobicContact CD2-CE3 4.36Å; L151-W188 HydrophobicContact CD2-CH2 4.11Å; L151-W188 HydrophobicContact CD2-CZ2 3.87Å; L151-W188 HydrophobicContact CD2-CZ3 4.34Å; L151-W188 PolarHBondContact O-NE1 3.04Å; I159-W188 HydrophobicContact CB-CZ2 4.02Å; I159-W188 HydrophobicContact CD1-CZ2 4.25Å; I159-W188 HydrophobicContact CG1-CZ2 4.25Å; Y184-W188 WeakPolarHBondContact O-CB 3.27Å; Y184-W188 PolarHBondContact O-N 3.3Å; F185-W188 HydrophobicContact CE2-CE3 4.44Å; F185-W188 WeakPolarHBondContact O-CB 3.2Å; F185-W188 PolarHBondContact O-N 2.95Å; L186-W188 VanDerWaalsContact C-N 3.34Å; W188-E191 PolarHBondContact O-N 3.04Å; W188-R192 HydrophobicContact CD2-CG 3.86Å; W188-R192 HydrophobicContact CE3-CG 3.89Å; W188-R192 HydrophobicContact CH2-CG 3.78Å; W188-R192 HydrophobicContact CZ2-CG 3.75Å; W188-R192 HydrophobicContact CZ3-CG 3.85Å; W188-R192 WeakPolarHBondContact O-CB 3.42Å; W188-R192 WeakPolarHBondContact O-CG 3.36Å; W188-R192 PolarHBondContact O-N 3.19Å
189	L	98.1	Very high	95.4	Very high	0 Å²	0	53 Å²	53	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-61.8	-44.6	175.5	-69.9	175.3	0	0	0	112	F185 L186 T187 E191 R192 L193 T204 C207 M211	F185-L189 HydrophobicContact CD1-CD1 4.23Å; F185-L189 HydrophobicContact CE1-CD1 3.79Å; F185-L189 HydrophobicContact CE1-CG 4.39Å; F185-L189 HydrophobicContact CE2-CG 4.45Å; F185-L189 HydrophobicContact CZ-CD1 4.04Å; F185-L189 HydrophobicContact CZ-CD2 4.31Å; F185-L189 HydrophobicContact CZ-CG 4.23Å; F185-L189 PolarHBondContact O-N 3.41Å; L186-L189 HydrophobicContact CD2-CD1 4.4Å; L186-L189 PolarHBondContact O-N 3.42Å; T187-L189 PolarHBondContact O-N 3.04Å; L189-E191 PolarHBondContact O-N 3.17Å; L189-R192 PolarHBondContact O-N 2.8Å; L189-L193 PolarHBondContact O-N 2.88Å; L189-T204 HydrophobicContact CD2-CG2 3.97Å; L189-C207 HydrophobicContact CD1-CB 4.16Å; L189-C207 HydrophobicContact CD2-CB 3.59Å; L189-M211 HydrophobicContact CD1-CG 4.34Å
190	K	97.5	Very high	95.3	Very high	22 Å²	22	51.7 Å²	51.7	10%	0.096	29%	0.287	C	S	.	.	H	α-helix	trans	-55	-49.3	176.4	-180	-171.2	175	176.2	0	111.7	L186 T187 L193 R194 I224 D225	L186-K190 WeakPolarHBondContact O-CB 3.38Å; L186-K190 PolarHBondContact O-N 3.44Å; T187-K190 WeakPolarHBondContact O-CB 3.44Å; T187-K190 PolarHBondContact O-N 2.92Å; K190-L193 PolarHBondContact O-N 3.1Å; K190-R194 PolarHBondContact O-N 3.12Å; K190-I224 HydrophobicContact CB-CD1 4.41Å; K190-I224 HydrophobicContact CD-CD1 4.31Å; K190-I224 PolarHBondContact NZ-O 3.36Å; K190-D225 WeakPolarHBondContact CE-O 3.48Å; K190-D225 PolarHBondContact NZ-O 2.67Å; K190-D225 VanDerWaalsContact NZ-O 3.12Å; K190-D225 IonicContact NZ-OD2 2.79Å
191	E	96.7	Very high	95.2	Very high	89 Å²	89	49.4 Å²	49.4	42%	0.416	26%	0.264	S	S	.	.	H	α-helix	trans	-70.6	-31.8	-179.9	-64.8	-49.7	133.6	0	0	112.5	T187 W188 L189 R194 T195	T187-E191 HydrophobicContact CG2-CG 4.5Å; T187-E191 WeakPolarHBondContact O-CG 3.33Å; T187-E191 PolarHBondContact O-N 3.16Å; W188-E191 PolarHBondContact O-N 3.04Å; L189-E191 PolarHBondContact O-N 3.17Å; E191-R194 PolarHBondContact O-N 2.98Å; E191-R194 IonicContact OE1-NH1 3.57Å; E191-T195 PolarHBondContact O-N 3.21Å; E191-T195 VanDerWaalsContact O-N 3.08Å; E191-T195 PolarHBondContact O-OG1 3.3Å
192	R	95.6	Very high	95	Very high	71 Å²	71	49.7 Å²	49.7	27%	0.268	26%	0.264	S	S	.	.	H	α-helix	trans	-68.9	-30.8	174.6	-71	-68.4	171.6	-170.3	-1.3	113.4	W188 L189 R194 N198 T204	W188-R192 HydrophobicContact CD2-CG 3.86Å; W188-R192 HydrophobicContact CE3-CG 3.89Å; W188-R192 HydrophobicContact CH2-CG 3.78Å; W188-R192 HydrophobicContact CZ2-CG 3.75Å; W188-R192 HydrophobicContact CZ3-CG 3.85Å; W188-R192 WeakPolarHBondContact O-CB 3.42Å; W188-R192 WeakPolarHBondContact O-CG 3.36Å; W188-R192 PolarHBondContact O-N 3.19Å; L189-R192 PolarHBondContact O-N 2.8Å; R192-R194 VanDerWaalsContact C-N 3.34Å; R192-N198 PolarHBondContact O-ND2 3.18Å; R192-T204 HydrophobicContact CB-CG2 3.56Å
193	L	94.9	Very high	94.8	Very high	5 Å²	5	49.6 Å²	49.6	3%	0.026	26%	0.264	C	S	.	.	H	α-helix	trans	-66.1	-37.6	171	-72.9	-179.5	0	0	0	112	L189 K190 T195 I201 T204 L208 I230 T233 L246	L189-L193 PolarHBondContact O-N 2.88Å; K190-L193 PolarHBondContact O-N 3.1Å; L193-T195 VanDerWaalsContact C-N 3.33Å; L193-I201 HydrophobicContact CD2-CG1 4.36Å; L193-T204 HydrophobicContact CD2-CG2 3.86Å; L193-T204 HydrophobicContact CG-CG2 3.95Å; L193-L208 HydrophobicContact CD1-CD2 3.76Å; L193-I230 HydrophobicContact CD1-CG1 4.22Å; L193-T233 PolarHBondContact O-OG1 3.13Å; L193-L246 HydrophobicContact CD1-CD2 4.21Å; L193-L246 HydrophobicContact CD2-CD2 3.92Å
194	R	93.3	Very high	94.6	Very high	95 Å²	95	46.7 Å²	46.7	36%	0.358	25%	0.246	S	C	.	.	H	α-helix	trans	-78.6	-15.1	179.8	-69.3	178.4	172.3	171.1	-4.1	114.2	K190 E191 R192 P196 S228	K190-R194 PolarHBondContact O-N 3.12Å; E191-R194 PolarHBondContact O-N 2.98Å; E191-R194 IonicContact OE1-NH1 3.57Å; R192-R194 VanDerWaalsContact C-N 3.34Å; R194-P196 WeakPolarHBondContact O-CD 3.44Å; R194-S228 PolarHBondContact NH2-OG 3.48Å
195	T	92.6	Very high	94.5	Very high	53 Å²	53	41.6 Å²	41.6	33%	0.325	23%	0.226	S	C	.	.	S	Bend	trans	-65.6	113.6	-178.1	-60.6	0	0	0	0	110.1	E191 L193 G197 N198	E191-T195 PolarHBondContact O-N 3.21Å; E191-T195 VanDerWaalsContact O-N 3.08Å; E191-T195 PolarHBondContact O-OG1 3.3Å; L193-T195 VanDerWaalsContact C-N 3.33Å; T195-G197 PolarHBondContact O-N 3.48Å; T195-N198 HydrophobicContact CG2-CB 4.37Å; T195-N198 WeakPolarHBondContact O-CB 3.34Å; T195-N198 PolarHBondContact O-N 2.91Å
196	P	89	Confident	94.2	Very high	126 Å²	126	43.9 Å²	43.9	82%	0.818	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.3	137	180	-21.4	34	0	0	0	111.1	R194 N198	R194-P196 WeakPolarHBondContact O-CD 3.44Å; P196-N198 VanDerWaalsContact C-N 3.26Å; P196-N198 PolarHBondContact O-N 3.27Å
197	G	87.2	Confident	94	Very high	76 Å²	76	43.9 Å²	43.9	78%	0.784	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	67.2	22.1	178.4	0	0	0	0	0	114.6	T195 E199	T195-G197 PolarHBondContact O-N 3.48Å; G197-E199 PolarHBondContact O-N 3.45Å
198	N	91.4	Very high	93.9	Very high	19 Å²	19	41.4 Å²	41.4	10%	0.102	22%	0.219	C	C	.	.			trans	-61	101.7	174.4	179.4	5.1	0	0	0	111	R192 T195 P196 Y200 I201 T204	R192-N198 PolarHBondContact O-ND2 3.18Å; T195-N198 HydrophobicContact CG2-CB 4.37Å; T195-N198 WeakPolarHBondContact O-CB 3.34Å; T195-N198 PolarHBondContact O-N 2.91Å; P196-N198 VanDerWaalsContact C-N 3.26Å; P196-N198 PolarHBondContact O-N 3.27Å; N198-Y200 PolarHBondContact O-N 2.93Å; N198-Y200 VanDerWaalsContact O-N 3.09Å; N198-Y200 WeakPolarHBondContact OD1-CA 3.47Å; N198-Y200 PolarHBondContact OD1-N 3.03Å; N198-I201 HydrophobicContact CB-CB 4.23Å; N198-I201 VanDerWaalsContact O-CB 3.29Å; N198-I201 WeakPolarHBondContact O-CB 3.29Å; N198-I201 WeakPolarHBondContact O-CG2 3.45Å; N198-I201 PolarHBondContact O-N 3.43Å; N198-I201 PolarHBondContact OD1-N 2.99Å; N198-T204 PolarHBondContact ND2-OG1 3.48Å
199	E	91.5	Very high	93.8	Very high	131 Å²	131	40.3 Å²	40.3	61%	0.612	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.4	179.5	-57.1	176.7	112.8	0	0	113.4	K40 G197	K40-E199 HydrophobicContact CD-CB 3.84Å; K40-E199 IonicContact NZ-OE1 2.97Å; K40-E199 PolarHBondContact NZ-OE1 2.88Å; K40-E199 IonicContact NZ-OE2 3.41Å; K40-E199 PolarHBondContact NZ-OE2 3.04Å; G197-E199 PolarHBondContact O-N 3.45Å
200	Y	93.7	Very high	93.5	Very high	21 Å²	21	41.2 Å²	41.2	8%	0.082	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.8	16	178.7	-60.6	-88.6	0	0	0	112.8	K40 L41 E44 N160 N198 H202 T203 T204	K40-Y200 HydrophobicContact CB-CE1 4.45Å; K40-Y200 HydrophobicContact CD-CE1 4.33Å; K40-Y200 HydrophobicContact CD-CE2 4.35Å; K40-Y200 HydrophobicContact CG-CE1 4.14Å; L41-Y200 HydrophobicContact CB-CD1 4.03Å; L41-Y200 HydrophobicContact CB-CE1 4.13Å; L41-Y200 HydrophobicContact CD1-CD1 4.01Å; L41-Y200 HydrophobicContact CD1-CE1 3.75Å; E44-Y200 PolarHBondContact OE1-OH 3Å; N160-Y200 HydrophobicContact CB-CD1 3.99Å; N160-Y200 HydrophobicContact CB-CG 4.18Å; N160-Y200 VanDerWaalsContact ND2-CB 3.33Å; N160-Y200 WeakPolarHBondContact ND2-CB 3.22Å; N160-Y200 WeakPolarHBondContact ND2-CD2 3.29Å; N160-Y200 VanDerWaalsContact OD1-CB 3.32Å; N160-Y200 WeakPolarHBondContact OD1-CB 3.34Å; N198-Y200 PolarHBondContact O-N 2.93Å; N198-Y200 VanDerWaalsContact O-N 3.09Å; N198-Y200 WeakPolarHBondContact OD1-CA 3.47Å; N198-Y200 PolarHBondContact OD1-N 3.03Å; Y200-H202 PolarHBondContact O-N 3.24Å; Y200-H202 VanDerWaalsContact O-N 3.13Å; Y200-T203 WeakPolarHBondContact O-CA 3.5Å; Y200-T203 VanDerWaalsContact O-CB 3.25Å; Y200-T203 WeakPolarHBondContact O-CB 3.34Å; Y200-T203 PolarHBondContact O-N 3.49Å; Y200-T204 PolarHBondContact O-N 3.45Å; Y200-T204 VanDerWaalsContact O-N 3.07Å; Y200-T204 PolarHBondContact O-OG1 3.19Å
201	I	93.1	Very high	93.4	Very high	30 Å²	30	40.2 Å²	40.2	15%	0.154	22%	0.216	C	C	.	.	H	α-helix	trans	-55.6	-34.6	-175.7	-167.3	161.7	0	0	0	113.5	L193 N198 T203 T204 A205 T233 L242	L193-I201 HydrophobicContact CD2-CG1 4.36Å; N198-I201 HydrophobicContact CB-CB 4.23Å; N198-I201 VanDerWaalsContact O-CB 3.29Å; N198-I201 WeakPolarHBondContact O-CB 3.29Å; N198-I201 WeakPolarHBondContact O-CG2 3.45Å; N198-I201 PolarHBondContact O-N 3.43Å; N198-I201 PolarHBondContact OD1-N 2.99Å; I201-T203 VanDerWaalsContact C-N 3.3Å; I201-T203 PolarHBondContact O-N 3.3Å; I201-T204 PolarHBondContact O-N 3.38Å; I201-A205 WeakPolarHBondContact O-CB 3.33Å; I201-A205 PolarHBondContact O-N 3.39Å; I201-T233 HydrophobicContact CD1-CG2 3.86Å; I201-L242 HydrophobicContact CD1-CD1 4.38Å; I201-L242 HydrophobicContact CD1-CD2 3.64Å; I201-L242 HydrophobicContact CG1-CD1 3.96Å; I201-L242 HydrophobicContact CG1-CD2 4.06Å; I201-L242 HydrophobicContact CG2-CD2 4.24Å
202	H	92.6	Very high	93.4	Very high	48 Å²	48	36 Å²	36	22%	0.222	20%	0.196	C	C	.	.	H	α-helix	trans	-65.5	-32.7	175.6	-71.7	-65.4	0	0	0	112.7	Y200 R206 N239 Q245	Y200-H202 PolarHBondContact O-N 3.24Å; Y200-H202 VanDerWaalsContact O-N 3.13Å; H202-R206 VanDerWaalsContact O-CB 3.26Å; H202-R206 WeakPolarHBondContact O-CB 3.3Å; H202-R206 PolarHBondContact O-N 2.9Å; H202-N239 PolarHBondContact CE1-OD1 2.66Å; H202-N239 PolarHBondContact NE2-ND2 3.28Å; H202-Q245 PolarHBondContact ND1-OE1 3.46Å; H202-Q245 PolarHBondContact O-NE2 2.73Å
203	T	93	Very high	93.2	Very high	10 Å²	10	35.1 Å²	35.1	6%	0.061	19%	0.193	C	C	.	.	H	α-helix	trans	-69.3	-47	171.7	-56	0	0	0	0	110.2	L41 N160 L164 Y200 I201 A205 R206 C207	L41-T203 HydrophobicContact CD2-CG2 3.77Å; N160-T203 HydrophobicContact CB-CG2 4.21Å; L164-T203 HydrophobicContact CD1-CG2 3.92Å; L164-T203 HydrophobicContact CD2-CG2 3.92Å; L164-T203 HydrophobicContact CG-CG2 3.65Å; Y200-T203 WeakPolarHBondContact O-CA 3.5Å; Y200-T203 VanDerWaalsContact O-CB 3.25Å; Y200-T203 WeakPolarHBondContact O-CB 3.34Å; Y200-T203 PolarHBondContact O-N 3.49Å; I201-T203 VanDerWaalsContact C-N 3.3Å; I201-T203 PolarHBondContact O-N 3.3Å; T203-A205 PolarHBondContact O-N 3.19Å; T203-R206 WeakPolarHBondContact O-CB 3.25Å; T203-R206 PolarHBondContact O-N 2.97Å; T203-R206 VanDerWaalsContact O-N 3.11Å; T203-C207 PolarHBondContact O-N 3.08Å; T203-C207 PolarHBondContact O-SG 3.17Å; T203-C207 VanDerWaalsContact O-SG 3.36Å
204	T	95	Very high	93.2	Very high	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-57.5	-49.1	177.1	-52.2	0	0	0	0	111.4	L189 R192 L193 N198 Y200 I201 R206 C207 L208	L189-T204 HydrophobicContact CD2-CG2 3.97Å; R192-T204 HydrophobicContact CB-CG2 3.56Å; L193-T204 HydrophobicContact CD2-CG2 3.86Å; L193-T204 HydrophobicContact CG-CG2 3.95Å; N198-T204 PolarHBondContact ND2-OG1 3.48Å; Y200-T204 PolarHBondContact O-N 3.45Å; Y200-T204 VanDerWaalsContact O-N 3.07Å; Y200-T204 PolarHBondContact O-OG1 3.19Å; I201-T204 PolarHBondContact O-N 3.38Å; T204-R206 VanDerWaalsContact C-N 3.28Å; T204-R206 PolarHBondContact O-N 3.25Å; T204-C207 PolarHBondContact O-N 3.27Å; T204-L208 PolarHBondContact O-N 3.27Å
205	A	94.7	Very high	93.2	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-60.6	-39.3	176.3	0	0	0	0	0	111.1	I201 T203 L208 Q209 L242 Q245 L246	I201-A205 WeakPolarHBondContact O-CB 3.33Å; I201-A205 PolarHBondContact O-N 3.39Å; T203-A205 PolarHBondContact O-N 3.19Å; A205-L208 WeakPolarHBondContact O-CB 3.36Å; A205-L208 PolarHBondContact O-N 3.47Å; A205-Q209 WeakPolarHBondContact O-CG 3.42Å; A205-Q209 PolarHBondContact O-N 3.22Å; A205-L242 HydrophobicContact CB-CD1 3.88Å; A205-Q245 HydrophobicContact CB-CB 3.94Å; A205-L246 HydrophobicContact CB-CD2 4.03Å
206	R	92.5	Very high	93.4	Very high	48 Å²	48	37.2 Å²	37.2	18%	0.181	20%	0.204	C	C	.	.	H	α-helix	trans	-65	-45	176.6	-178.3	55.9	176.1	-170.7	-1.6	112.8	M27 V32 L164 H202 T203 T204 L208 Q209 V210	M27-R206 VanDerWaalsContact CE-CZ 3.45Å; V32-R206 VanDerWaalsContact CG2-NH2 3.26Å; L164-R206 HydrophobicContact CD2-CG 4.47Å; H202-R206 VanDerWaalsContact O-CB 3.26Å; H202-R206 WeakPolarHBondContact O-CB 3.3Å; H202-R206 PolarHBondContact O-N 2.9Å; T203-R206 WeakPolarHBondContact O-CB 3.25Å; T203-R206 PolarHBondContact O-N 2.97Å; T203-R206 VanDerWaalsContact O-N 3.11Å; T204-R206 VanDerWaalsContact C-N 3.28Å; T204-R206 PolarHBondContact O-N 3.25Å; R206-L208 PolarHBondContact O-N 3.25Å; R206-Q209 PolarHBondContact O-N 3.05Å; R206-V210 WeakPolarHBondContact O-CG2 3.47Å; R206-V210 PolarHBondContact O-N 2.81Å
207	C	95.8	Very high	93.8	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-54.9	-45.4	173.6	-68.3	0	0	0	0	110	S163 A167 L189 T203 T204 V210 M211	S163-C207 PolarHBondContact OG-SG 3.09Å; A167-C207 HydrophobicContact CB-CB 4.1Å; L189-C207 HydrophobicContact CD1-CB 4.16Å; L189-C207 HydrophobicContact CD2-CB 3.59Å; T203-C207 PolarHBondContact O-N 3.08Å; T203-C207 PolarHBondContact O-SG 3.17Å; T203-C207 VanDerWaalsContact O-SG 3.36Å; T204-C207 PolarHBondContact O-N 3.27Å; C207-V210 PolarHBondContact O-N 3.5Å; C207-M211 VanDerWaalsContact O-CG 3.25Å; C207-M211 WeakPolarHBondContact O-CG 3.41Å; C207-M211 PolarHBondContact O-N 3.47Å
208	L	96.4	Very high	94.3	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-63.4	-43.9	177.6	-173.1	63	0	0	0	112.9	L193 T204 A205 R206 V210 M211 L212 F221 I230	L193-L208 HydrophobicContact CD1-CD2 3.76Å; T204-L208 PolarHBondContact O-N 3.27Å; A205-L208 WeakPolarHBondContact O-CB 3.36Å; A205-L208 PolarHBondContact O-N 3.47Å; R206-L208 PolarHBondContact O-N 3.25Å; L208-V210 VanDerWaalsContact C-N 3.27Å; L208-V210 PolarHBondContact O-N 2.99Å; L208-M211 PolarHBondContact O-N 3.35Å; L208-L212 HydrophobicContact CD1-CD1 3.73Å; L208-L212 HydrophobicContact CD1-CD2 4.29Å; L208-L212 HydrophobicContact CD1-CG 3.8Å; L208-L212 HydrophobicContact CD2-CD1 4.3Å; L208-L212 HydrophobicContact CG-CD1 3.7Å; L208-L212 HydrophobicContact CG-CG 4.14Å; L208-L212 WeakPolarHBondContact O-CB 3.49Å; L208-L212 WeakPolarHBondContact O-CG 3.43Å; L208-L212 PolarHBondContact O-N 2.86Å; L208-F221 HydrophobicContact CD1-CD2 3.8Å; L208-F221 HydrophobicContact CD1-CE1 4.36Å; L208-F221 HydrophobicContact CD1-CE2 3.54Å; L208-F221 HydrophobicContact CD1-CG 4.31Å; L208-F221 HydrophobicContact CD1-CZ 3.84Å; L208-F221 HydrophobicContact CD2-CE1 4.39Å; L208-F221 HydrophobicContact CD2-CE2 4.2Å; L208-F221 HydrophobicContact CD2-CZ 3.77Å; L208-F221 HydrophobicContact CG-CZ 4.45Å; L208-I230 HydrophobicContact CD2-CD1 3.87Å; L208-I230 HydrophobicContact CD2-CG1 4.05Å
209	Q	94.4	Very high	94.6	Very high	3 Å²	3	30.7 Å²	30.7	1%	0.014	14%	0.141	C	C	.	.	H	α-helix	trans	-56.5	-42.2	174.4	-70.9	-175.4	-65.4	0	0	111.8	A205 R206 R213 Q245 F248	A205-Q209 WeakPolarHBondContact O-CG 3.42Å; A205-Q209 PolarHBondContact O-N 3.22Å; R206-Q209 PolarHBondContact O-N 3.05Å; Q209-R213 WeakPolarHBondContact O-CG 3.45Å; Q209-Q245 HydrophobicContact CG-CB 4.44Å; Q209-Q245 WeakPolarHBondContact CG-O 3.4Å; Q209-F248 HydrophobicContact CB-CD1 3.94Å; Q209-F248 HydrophobicContact CB-CE1 4.12Å; Q209-F248 HydrophobicContact CG-CB 4.49Å; Q209-F248 HydrophobicContact CG-CD1 3.7Å; Q209-F248 HydrophobicContact CG-CE1 4.36Å; Q209-F248 HydrophobicContact CG-CG 4.38Å; Q209-F248 VanDerWaalsContact NE2-CG 3.27Å
210	V	92.4	Very high	94.9	Very high	19 Å²	19	25.5 Å²	25.5	12%	0.115	12%	0.12	C	C	.	.	H	α-helix	trans	-67.5	-45.3	179.4	174.3	0	0	0	0	110.6	A167 C171 R206 C207 L208 R213	A167-V210 HydrophobicContact CB-CG1 4.49Å; C171-V210 HydrophobicContact CB-CG1 3.88Å; C171-V210 PolarHBondContact SG-O 3.45Å; C171-V210 VanDerWaalsContact SG-O 3.39Å; R206-V210 WeakPolarHBondContact O-CG2 3.47Å; R206-V210 PolarHBondContact O-N 2.81Å; C207-V210 PolarHBondContact O-N 3.5Å; L208-V210 VanDerWaalsContact C-N 3.27Å; L208-V210 PolarHBondContact O-N 2.99Å; V210-R213 WeakPolarHBondContact O-CB 3.26Å; V210-R213 WeakPolarHBondContact O-CD 3.47Å; V210-R213 WeakPolarHBondContact O-CG 3.38Å; V210-R213 PolarHBondContact O-N 2.69Å
211	M	95.9	Very high	95.1	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-62.5	-48.4	179.4	-67.5	-63.8	-69.5	0	0	112.1	A167 A170 L182 F185 L186 L189 C207 L208 R213 I214 Y217	A167-M211 HydrophobicContact CB-CG 4.3Å; A167-M211 HydrophobicContact CB-SD 4.21Å; A170-M211 HydrophobicContact CB-CE 4.07Å; A170-M211 HydrophobicContact CB-SD 3.79Å; L182-M211 HydrophobicContact CD1-CE 3.71Å; F185-M211 HydrophobicContact CD1-CE 3.98Å; F185-M211 HydrophobicContact CD1-SD 4.29Å; F185-M211 HydrophobicContact CE1-CE 4.24Å; F185-M211 HydrophobicContact CE1-CG 4.05Å; F185-M211 HydrophobicContact CE1-SD 3.94Å; L186-M211 HydrophobicContact CD2-CB 4.4Å; L186-M211 HydrophobicContact CD2-CE 4.21Å; L189-M211 HydrophobicContact CD1-CG 4.34Å; C207-M211 VanDerWaalsContact O-CG 3.25Å; C207-M211 WeakPolarHBondContact O-CG 3.41Å; C207-M211 PolarHBondContact O-N 3.47Å; L208-M211 PolarHBondContact O-N 3.35Å; M211-R213 PolarHBondContact O-N 2.73Å; M211-I214 PolarHBondContact O-N 2.66Å; M211-I214 VanDerWaalsContact O-N 3.09Å; M211-Y217 HydrophobicContact CB-CD2 4.25Å; M211-Y217 HydrophobicContact CE-CD2 3.41Å; M211-Y217 VanDerWaalsContact CE-CD2 3.41Å; M211-Y217 HydrophobicContact CE-CE2 3.59Å; M211-Y217 HydrophobicContact CE-CG 3.94Å; M211-Y217 WeakPolarHBondContact O-CB 3.48Å; M211-Y217 VanDerWaalsContact O-CD2 3.28Å; M211-Y217 WeakPolarHBondContact O-CD2 3.47Å; M211-Y217 HydrophobicContact SD-CD2 4.02Å; M211-Y217 HydrophobicContact SD-CE2 4.05Å
212	L	96	Very high	95.3	Very high	0 Å²	0	24 Å²	24	0%	0	11%	0.113	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.6	0.6	-174.5	-64.4	178	0	0	0	114.4	L208 I214 R218 F221 C252 I253	L208-L212 HydrophobicContact CD1-CD1 3.73Å; L208-L212 HydrophobicContact CD1-CD2 4.29Å; L208-L212 HydrophobicContact CD1-CG 3.8Å; L208-L212 HydrophobicContact CD2-CD1 4.3Å; L208-L212 HydrophobicContact CG-CD1 3.7Å; L208-L212 HydrophobicContact CG-CG 4.14Å; L208-L212 WeakPolarHBondContact O-CB 3.49Å; L208-L212 WeakPolarHBondContact O-CG 3.43Å; L208-L212 PolarHBondContact O-N 2.86Å; L212-I214 VanDerWaalsContact C-N 3.27Å; L212-R218 HydrophobicContact CB-CG 4.4Å; L212-R218 HydrophobicContact CD2-CB 4.44Å; L212-R218 HydrophobicContact CD2-CG 4.18Å; L212-R218 WeakPolarHBondContact O-CG 3.49Å; L212-R218 PolarHBondContact O-NE 3.16Å; L212-F221 HydrophobicContact CD1-CD1 4.3Å; L212-F221 HydrophobicContact CD1-CE1 4.45Å; L212-F221 HydrophobicContact CD2-CB 3.71Å; L212-F221 HydrophobicContact CD2-CD1 4Å; L212-F221 HydrophobicContact CD2-CG 3.92Å; L212-C252 HydrophobicContact CB-CB 3.98Å; L212-C252 WeakPolarHBondContact O-CB 3.45Å; L212-I253 HydrophobicContact CD1-CD1 4.15Å; L212-I253 HydrophobicContact CD1-CG1 4.22Å; L212-I253 HydrophobicContact CD2-CG1 4.49Å
213	R	92.1	Very high	95.5	Very high	54 Å²	54	29.4 Å²	29.4	20%	0.204	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65	-35.1	167.2	-63.5	173.7	54.3	149.9	-1.8	111.9	I23 M27 Q209 V210 M211 R218	I23-R213 HydrophobicContact CG2-CB 4.48Å; I23-R213 HydrophobicContact CG2-CG 3.87Å; M27-R213 HydrophobicContact SD-CG 4.43Å; M27-R213 PolarHBondContact SD-NH1 3.45Å; Q209-R213 WeakPolarHBondContact O-CG 3.45Å; V210-R213 WeakPolarHBondContact O-CB 3.26Å; V210-R213 WeakPolarHBondContact O-CD 3.47Å; V210-R213 WeakPolarHBondContact O-CG 3.38Å; V210-R213 PolarHBondContact O-N 2.69Å; M211-R213 PolarHBondContact O-N 2.73Å; R213-R218 PolarHBondContact O-NH2 3.33Å; R213-R218 VanDerWaalsContact O-NH2 3.13Å
214	I	93.8	Very high	95.7	Very high	40 Å²	40	30 Å²	30	21%	0.205	14%	0.141	C	C	.	.	S	Bend	trans	-86.7	129	-179.6	-56.3	-59.5	0	0	0	108.9	L176 M211 L212 E216 Y217 R218	L176-I214 HydrophobicContact CD1-CG2 3.94Å; L176-I214 HydrophobicContact CD2-CG2 4.17Å; M211-I214 PolarHBondContact O-N 2.66Å; M211-I214 VanDerWaalsContact O-N 3.09Å; L212-I214 VanDerWaalsContact C-N 3.27Å; I214-E216 HydrophobicContact CG2-CB 4.36Å; I214-E216 WeakPolarHBondContact CG2-OE2 3.41Å; I214-E216 PolarHBondContact O-N 2.99Å; I214-Y217 HydrophobicContact CB-CD2 3.57Å; I214-Y217 HydrophobicContact CB-CE2 3.92Å; I214-Y217 HydrophobicContact CB-CG 3.93Å; I214-Y217 HydrophobicContact CG1-CD2 3.94Å; I214-Y217 HydrophobicContact CG1-CE2 3.89Å; I214-Y217 HydrophobicContact CG2-CD1 4.21Å; I214-Y217 HydrophobicContact CG2-CD2 4.02Å; I214-Y217 HydrophobicContact CG2-CE1 4.32Å; I214-Y217 HydrophobicContact CG2-CE2 4.13Å; I214-Y217 HydrophobicContact CG2-CG 4.05Å; I214-Y217 PolarHBondContact O-N 3.3Å; I214-R218 PolarHBondContact O-N 2.78Å
215	E	94.9	Very high	95.8	Very high	45 Å²	45	33.7 Å²	33.7	21%	0.21	16%	0.16	C	C	.	.	H	α-helix	trans	-63.3	-44	-173.6	173.9	159.5	-134.8	0	0	112.7	Y217 R218 F219 S256	E215-Y217 PolarHBondContact O-N 3.24Å; E215-Y217 VanDerWaalsContact O-N 3.15Å; E215-R218 WeakPolarHBondContact O-CA 3.33Å; E215-R218 VanDerWaalsContact O-CB 3.29Å; E215-R218 WeakPolarHBondContact O-CB 3.44Å; E215-R218 PolarHBondContact O-N 3.04Å; E215-F219 HydrophobicContact CG-CD2 3.85Å; E215-F219 HydrophobicContact CG-CE2 3.63Å; E215-F219 WeakPolarHBondContact O-CD2 3.43Å; E215-F219 PolarHBondContact O-N 3.22Å; E215-F219 VanDerWaalsContact O-N 3.13Å; E215-S256 WeakPolarHBondContact OE1-CB 3.17Å; E215-S256 PolarHBondContact OE1-OG 3.34Å
216	E	95.5	Very high	95.9	Very high	111 Å²	111	33.7 Å²	33.7	52%	0.519	16%	0.16	S	C	.	.	H	α-helix	trans	-55.4	-36.2	177.7	-64.7	86.3	164.1	0	0	111.5	L176 I214 F219 A220	L176-E216 HydrophobicContact CD1-CG 4.37Å; I214-E216 HydrophobicContact CG2-CB 4.36Å; I214-E216 WeakPolarHBondContact CG2-OE2 3.41Å; I214-E216 PolarHBondContact O-N 2.99Å; E216-F219 PolarHBondContact O-N 3.47Å; E216-A220 PolarHBondContact O-N 3.12Å
217	Y	97.7	Very high	96.2	Very high	1 Å²	1	31.4 Å²	31.4	0%	0.004	15%	0.152	C	C	.	.	H	α-helix	trans	-74.7	-28.9	178.5	-58.1	-11.2	0	0	0	111.9	A170 L176 M177 L182 M211 I214 E215 F221	A170-Y217 HydrophobicContact CB-CE2 4.2Å; A170-Y217 WeakPolarHBondContact O-CE2 3.47Å; A170-Y217 PolarHBondContact O-OH 3.04Å; L176-Y217 WeakPolarHBondContact CA-OH 3.38Å; L176-Y217 HydrophobicContact CB-CE1 4.2Å; L176-Y217 WeakPolarHBondContact CB-OH 3.3Å; L176-Y217 WeakPolarHBondContact CD2-OH 3.46Å; M177-Y217 PolarHBondContact N-OH 2.87Å; M177-Y217 WeakPolarHBondContact O-CE1 3.38Å; L182-Y217 HydrophobicContact CD1-CD1 3.55Å; L182-Y217 HydrophobicContact CD1-CE1 3.81Å; L182-Y217 HydrophobicContact CD1-CG 4.04Å; L182-Y217 HydrophobicContact CD2-CD1 3.67Å; L182-Y217 HydrophobicContact CD2-CE1 4.06Å; L182-Y217 HydrophobicContact CG-CD1 4.27Å; M211-Y217 HydrophobicContact CB-CD2 4.25Å; M211-Y217 HydrophobicContact CE-CD2 3.41Å; M211-Y217 VanDerWaalsContact CE-CD2 3.41Å; M211-Y217 HydrophobicContact CE-CE2 3.59Å; M211-Y217 HydrophobicContact CE-CG 3.94Å; M211-Y217 WeakPolarHBondContact O-CB 3.48Å; M211-Y217 VanDerWaalsContact O-CD2 3.28Å; M211-Y217 WeakPolarHBondContact O-CD2 3.47Å; M211-Y217 HydrophobicContact SD-CD2 4.02Å; M211-Y217 HydrophobicContact SD-CE2 4.05Å; I214-Y217 HydrophobicContact CB-CD2 3.57Å; I214-Y217 HydrophobicContact CB-CE2 3.92Å; I214-Y217 HydrophobicContact CB-CG 3.93Å; I214-Y217 HydrophobicContact CG1-CD2 3.94Å; I214-Y217 HydrophobicContact CG1-CE2 3.89Å; I214-Y217 HydrophobicContact CG2-CD1 4.21Å; I214-Y217 HydrophobicContact CG2-CD2 4.02Å; I214-Y217 HydrophobicContact CG2-CE1 4.32Å; I214-Y217 HydrophobicContact CG2-CE2 4.13Å; I214-Y217 HydrophobicContact CG2-CG 4.05Å; I214-Y217 PolarHBondContact O-N 3.3Å; E215-Y217 PolarHBondContact O-N 3.24Å; E215-Y217 VanDerWaalsContact O-N 3.15Å; Y217-F221 WeakPolarHBondContact O-CB 3.22Å; Y217-F221 PolarHBondContact O-N 3.18Å
218	R	97.6	Very high	96.2	Very high	0 Å²	0	33 Å²	33	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-65.2	-46.6	171.9	-57.2	168.5	-167.2	170.6	-1.3	110.9	I23 L212 R213 I214 E215 F221 M222 C252 F255 S256 L259	I23-R218 VanDerWaalsContact CD1-NH2 3.3Å; L212-R218 HydrophobicContact CB-CG 4.4Å; L212-R218 HydrophobicContact CD2-CB 4.44Å; L212-R218 HydrophobicContact CD2-CG 4.18Å; L212-R218 WeakPolarHBondContact O-CG 3.49Å; L212-R218 PolarHBondContact O-NE 3.16Å; R213-R218 PolarHBondContact O-NH2 3.33Å; R213-R218 VanDerWaalsContact O-NH2 3.13Å; I214-R218 PolarHBondContact O-N 2.78Å; E215-R218 WeakPolarHBondContact O-CA 3.33Å; E215-R218 VanDerWaalsContact O-CB 3.29Å; E215-R218 WeakPolarHBondContact O-CB 3.44Å; E215-R218 PolarHBondContact O-N 3.04Å; R218-F221 PolarHBondContact O-N 2.88Å; R218-M222 WeakPolarHBondContact O-CB 3.32Å; R218-M222 WeakPolarHBondContact O-CG 3.42Å; R218-M222 PolarHBondContact O-N 3.4Å; R218-C252 WeakPolarHBondContact CD-O 3.29Å; R218-C252 PolarHBondContact NE-O 3.36Å; R218-C252 PolarHBondContact NH1-O 3.12Å; R218-F255 VanDerWaalsContact NH1-CB 3.3Å; R218-S256 PolarHBondContact NH1-OG 2.89Å; R218-L259 HydrophobicContact CB-CD1 3.58Å
219	F	97.8	Very high	96.2	Very high	84 Å²	84	33 Å²	33	37%	0.368	16%	0.163	S	C	.	.	H	α-helix	trans	-61.1	-46.3	176.6	-80.4	-82	0	0	0	111.4	E215 E216 F221 M222 H223 P258 L259	E215-F219 HydrophobicContact CG-CD2 3.85Å; E215-F219 HydrophobicContact CG-CE2 3.63Å; E215-F219 WeakPolarHBondContact O-CD2 3.43Å; E215-F219 PolarHBondContact O-N 3.22Å; E215-F219 VanDerWaalsContact O-N 3.13Å; E216-F219 PolarHBondContact O-N 3.47Å; F219-F221 VanDerWaalsContact C-N 3.35Å; F219-F221 PolarHBondContact O-N 3.31Å; F219-M222 PolarHBondContact O-N 3.23Å; F219-H223 WeakPolarHBondContact O-CB 3.33Å; F219-H223 PolarHBondContact O-N 3.48Å; F219-P258 HydrophobicContact CE1-CB 4.35Å; F219-P258 HydrophobicContact CZ-CB 4.4Å; F219-P258 HydrophobicContact CZ-CG 4.37Å; F219-L259 HydrophobicContact CD1-CD1 4.28Å; F219-L259 HydrophobicContact CD1-CD2 3.65Å; F219-L259 HydrophobicContact CD1-CG 4.14Å; F219-L259 HydrophobicContact CD2-CD1 4.27Å; F219-L259 HydrophobicContact CE1-CD1 4.4Å; F219-L259 HydrophobicContact CE1-CD2 3.66Å; F219-L259 HydrophobicContact CE1-CG 3.91Å; F219-L259 HydrophobicContact CE2-CD1 4.38Å; F219-L259 HydrophobicContact CG-CD1 4.21Å; F219-L259 HydrophobicContact CG-CD2 4.35Å; F219-L259 HydrophobicContact CZ-CD1 4.44Å; F219-L259 HydrophobicContact CZ-CD2 4.38Å; F219-L259 HydrophobicContact CZ-CG 4.11Å
220	A	98.1	Very high	96.4	Very high	21 Å²	21	32.9 Å²	32.9	17%	0.174	16%	0.163	C	C	.	.	H	α-helix	trans	-61.8	-41.8	176.4	0	0	0	0	0	112.3	L182 L186 E216 H223 I224	L182-A220 HydrophobicContact CD2-CB 3.54Å; L182-A220 HydrophobicContact CG-CB 4.11Å; L186-A220 HydrophobicContact CD1-CB 3.59Å; E216-A220 PolarHBondContact O-N 3.12Å; A220-H223 WeakPolarHBondContact O-CB 3.36Å; A220-H223 PolarHBondContact O-N 3.03Å; A220-I224 PolarHBondContact O-N 3.5Å; A220-I224 VanDerWaalsContact O-N 3.16Å
221	F	98.3	Very high	96.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66.3	-39.9	178.1	-173.6	-106.5	0	0	0	112.3	L186 L208 L212 Y217 R218 F219 I224 G226 I230 I253	L186-F221 HydrophobicContact CB-CD2 4.46Å; L186-F221 HydrophobicContact CD1-CB 4.15Å; L186-F221 HydrophobicContact CD2-CD2 4.3Å; L208-F221 HydrophobicContact CD1-CD2 3.8Å; L208-F221 HydrophobicContact CD1-CE1 4.36Å; L208-F221 HydrophobicContact CD1-CE2 3.54Å; L208-F221 HydrophobicContact CD1-CG 4.31Å; L208-F221 HydrophobicContact CD1-CZ 3.84Å; L208-F221 HydrophobicContact CD2-CE1 4.39Å; L208-F221 HydrophobicContact CD2-CE2 4.2Å; L208-F221 HydrophobicContact CD2-CZ 3.77Å; L208-F221 HydrophobicContact CG-CZ 4.45Å; L212-F221 HydrophobicContact CD1-CD1 4.3Å; L212-F221 HydrophobicContact CD1-CE1 4.45Å; L212-F221 HydrophobicContact CD2-CB 3.71Å; L212-F221 HydrophobicContact CD2-CD1 4Å; L212-F221 HydrophobicContact CD2-CG 3.92Å; Y217-F221 WeakPolarHBondContact O-CB 3.22Å; Y217-F221 PolarHBondContact O-N 3.18Å; R218-F221 PolarHBondContact O-N 2.88Å; F219-F221 VanDerWaalsContact C-N 3.35Å; F219-F221 PolarHBondContact O-N 3.31Å; F221-I224 HydrophobicContact CD2-CD1 4.3Å; F221-I224 WeakPolarHBondContact O-CG1 3.33Å; F221-I224 PolarHBondContact O-N 3.03Å; F221-G226 VanDerWaalsContact CZ-O 3.26Å; F221-G226 WeakPolarHBondContact CZ-O 3.41Å; F221-G226 WeakPolarHBondContact O-CA 3.38Å; F221-G226 PolarHBondContact O-N 3.41Å; F221-I230 HydrophobicContact CE1-CD1 3.62Å; F221-I230 HydrophobicContact CE1-CG1 4.11Å; F221-I230 HydrophobicContact CZ-CD1 3.95Å; F221-I230 HydrophobicContact CZ-CG1 4.01Å; F221-I253 HydrophobicContact CD1-CD1 4.14Å; F221-I253 HydrophobicContact CE1-CD1 4.39Å
222	M	97.4	Very high	96.5	Very high	20 Å²	20	35.7 Å²	35.7	10%	0.099	18%	0.182	C	C	.	.	H	α-helix	trans	-67.7	-37.3	174.2	-74	-65.1	-68.4	0	0	112.1	R218 F219 I224 D225 L227 I253 L259 L266	R218-M222 WeakPolarHBondContact O-CB 3.32Å; R218-M222 WeakPolarHBondContact O-CG 3.42Å; R218-M222 PolarHBondContact O-N 3.4Å; F219-M222 PolarHBondContact O-N 3.23Å; M222-I224 VanDerWaalsContact C-N 3.31Å; M222-I224 PolarHBondContact O-N 2.92Å; M222-D225 PolarHBondContact O-N 2.69Å; M222-D225 VanDerWaalsContact O-N 3.08Å; M222-L227 HydrophobicContact CE-CD2 4.06Å; M222-L227 HydrophobicContact SD-CB 3.73Å; M222-L227 HydrophobicContact SD-CD2 3.95Å; M222-L227 HydrophobicContact SD-CG 4.47Å; M222-I253 HydrophobicContact CG-CG2 4.04Å; M222-I253 HydrophobicContact SD-CD1 4.24Å; M222-I253 HydrophobicContact SD-CG2 4.05Å; M222-L259 HydrophobicContact CB-CD2 3.98Å; M222-L259 HydrophobicContact CG-CD1 4Å; M222-L259 HydrophobicContact CG-CD2 3.94Å; M222-L259 HydrophobicContact CG-CG 4.4Å; M222-L266 HydrophobicContact CE-CD1 4.02Å
223	H	96.9	Very high	96.5	Very high	161 Å²	161	36.5 Å²	36.5	75%	0.745	19%	0.187	S	C	*	.	H	α-helix	trans	-61.7	-38.2	177.1	178.1	-89.3	0	0	0	112.4	F219 A220 D225	F219-H223 WeakPolarHBondContact O-CB 3.33Å; F219-H223 PolarHBondContact O-N 3.48Å; A220-H223 WeakPolarHBondContact O-CB 3.36Å; A220-H223 PolarHBondContact O-N 3.03Å; H223-D225 PolarHBondContact O-N 2.69Å
224	I	97	Very high	96.6	Very high	24 Å²	24	34.2 Å²	34.2	12%	0.123	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.8	14.2	176	67.1	164.7	0	0	0	113.4	T183 L186 K190 A220 F221 M222 G226	T183-I224 HydrophobicContact CG2-CG2 4.05Å; L186-I224 VanDerWaalsContact C-CD1 3.46Å; L186-I224 HydrophobicContact CB-CD1 3.61Å; K190-I224 HydrophobicContact CB-CD1 4.41Å; K190-I224 HydrophobicContact CD-CD1 4.31Å; K190-I224 PolarHBondContact NZ-O 3.36Å; A220-I224 PolarHBondContact O-N 3.5Å; A220-I224 VanDerWaalsContact O-N 3.16Å; F221-I224 HydrophobicContact CD2-CD1 4.3Å; F221-I224 WeakPolarHBondContact O-CG1 3.33Å; F221-I224 PolarHBondContact O-N 3.03Å; M222-I224 VanDerWaalsContact C-N 3.31Å; M222-I224 PolarHBondContact O-N 2.92Å; I224-G226 VanDerWaalsContact C-N 3.26Å; I224-G226 PolarHBondContact O-N 3.41Å
225	D	96.8	Very high	96.5	Very high	76 Å²	76	36.1 Å²	36.1	41%	0.406	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	52.3	45.7	-173	-179.3	47.3	0	0	0	111.8	K190 M222 H223 S228	K190-D225 WeakPolarHBondContact CE-O 3.48Å; K190-D225 PolarHBondContact NZ-O 2.67Å; K190-D225 VanDerWaalsContact NZ-O 3.12Å; K190-D225 IonicContact NZ-OD2 2.79Å; M222-D225 PolarHBondContact O-N 2.69Å; M222-D225 VanDerWaalsContact O-N 3.08Å; H223-D225 PolarHBondContact O-N 2.69Å; D225-S228 PolarHBondContact O-OG 3.35Å; D225-S228 WeakPolarHBondContact OD1-CB 3.34Å; D225-S228 PolarHBondContact OD1-OG 3.05Å; D225-S228 WeakPolarHBondContact OD2-CB 3.4Å; D225-S228 PolarHBondContact OD2-OG 3.23Å
226	G	97.6	Very high	96	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-69.9	-34.7	-179.6	0	0	0	0	0	112.5	F221 I224 S228 S229 I230	F221-G226 VanDerWaalsContact CZ-O 3.26Å; F221-G226 WeakPolarHBondContact CZ-O 3.41Å; F221-G226 WeakPolarHBondContact O-CA 3.38Å; F221-G226 PolarHBondContact O-N 3.41Å; I224-G226 VanDerWaalsContact C-N 3.26Å; I224-G226 PolarHBondContact O-N 3.41Å; G226-S228 VanDerWaalsContact C-N 3.28Å; G226-S228 PolarHBondContact O-N 2.89Å; G226-S229 WeakPolarHBondContact O-CB 3.22Å; G226-S229 PolarHBondContact O-N 2.93Å; G226-S229 PolarHBondContact O-OG 2.82Å; G226-I230 PolarHBondContact O-N 3.02Å
227	L	97.6	Very high	94.9	Very high	1 Å²	1	43 Å²	43	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-60.1	-36.4	-177.9	179.9	57.3	0	0	0	112.6	M222 S229 I230 L231 I250 M263 L266 V268	M222-L227 HydrophobicContact CE-CD2 4.06Å; M222-L227 HydrophobicContact SD-CB 3.73Å; M222-L227 HydrophobicContact SD-CD2 3.95Å; M222-L227 HydrophobicContact SD-CG 4.47Å; L227-S229 PolarHBondContact O-N 3.23Å; L227-I230 HydrophobicContact CD1-CD1 4.45Å; L227-I230 WeakPolarHBondContact O-CB 3.48Å; L227-I230 PolarHBondContact O-N 2.84Å; L227-L231 HydrophobicContact CD1-CG 4.26Å; L227-L231 HydrophobicContact CG-CD1 4.2Å; L227-L231 HydrophobicContact CG-CG 4.39Å; L227-L231 WeakPolarHBondContact O-CG 3.12Å; L227-L231 PolarHBondContact O-N 3.44Å; L227-I250 HydrophobicContact CD1-CD1 4.27Å; L227-I250 HydrophobicContact CD1-CG1 3.85Å; L227-M263 HydrophobicContact CD2-CE 4.34Å; L227-M263 HydrophobicContact CD2-CG 3.97Å; L227-L266 HydrophobicContact CD2-CB 4.36Å; L227-L266 HydrophobicContact CD2-CD1 3.6Å; L227-V268 HydrophobicContact CD1-CG2 4.33Å; L227-V268 HydrophobicContact CD2-CG2 3.81Å; L227-V268 HydrophobicContact CG-CG2 4.38Å
228	S	96.3	Very high	94.2	Very high	34 Å²	34	43.5 Å²	43.5	24%	0.238	24%	0.243	C	C	.	.	H	α-helix	trans	-59.8	-34	176.1	70.8	0	0	0	0	112.5	R194 D225 G226 L231 S232	R194-S228 PolarHBondContact NH2-OG 3.48Å; D225-S228 PolarHBondContact O-OG 3.35Å; D225-S228 WeakPolarHBondContact OD1-CB 3.34Å; D225-S228 PolarHBondContact OD1-OG 3.05Å; D225-S228 WeakPolarHBondContact OD2-CB 3.4Å; D225-S228 PolarHBondContact OD2-OG 3.23Å; G226-S228 VanDerWaalsContact C-N 3.28Å; G226-S228 PolarHBondContact O-N 2.89Å; S228-L231 PolarHBondContact O-N 3.32Å; S228-S232 WeakPolarHBondContact O-CB 3.47Å; S228-S232 PolarHBondContact O-N 3.35Å; S228-S232 PolarHBondContact O-OG 3.42Å
229	S	96.4	Very high	93.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68.7	-34.5	175.2	74.4	0	0	0	0	113	G226 L227 S232 T233	G226-S229 WeakPolarHBondContact O-CB 3.22Å; G226-S229 PolarHBondContact O-N 2.93Å; G226-S229 PolarHBondContact O-OG 2.82Å; L227-S229 PolarHBondContact O-N 3.23Å; S229-S232 WeakPolarHBondContact CA-OG 3.33Å; S229-S232 PolarHBondContact O-OG 3.11Å; S229-T233 WeakPolarHBondContact O-CB 3.47Å; S229-T233 PolarHBondContact O-N 3.28Å; S229-T233 PolarHBondContact O-OG1 3.38Å
230	I	97.5	Very high	93.6	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-66.3	-50.9	174.4	-59	-179	0	0	0	109.3	L193 L208 F221 G226 L227 S232 T233 L234 L246 I250	L193-I230 HydrophobicContact CD1-CG1 4.22Å; L208-I230 HydrophobicContact CD2-CD1 3.87Å; L208-I230 HydrophobicContact CD2-CG1 4.05Å; F221-I230 HydrophobicContact CE1-CD1 3.62Å; F221-I230 HydrophobicContact CE1-CG1 4.11Å; F221-I230 HydrophobicContact CZ-CD1 3.95Å; F221-I230 HydrophobicContact CZ-CG1 4.01Å; G226-I230 PolarHBondContact O-N 3.02Å; L227-I230 HydrophobicContact CD1-CD1 4.45Å; L227-I230 WeakPolarHBondContact O-CB 3.48Å; L227-I230 PolarHBondContact O-N 2.84Å; I230-S232 PolarHBondContact O-N 3.12Å; I230-T233 WeakPolarHBondContact O-CB 2.91Å; I230-T233 PolarHBondContact O-N 2.85Å; I230-T233 VanDerWaalsContact O-N 3.12Å; I230-L234 HydrophobicContact CG2-CD1 4.05Å; I230-L234 HydrophobicContact CG2-CG 4.42Å; I230-L234 WeakPolarHBondContact O-CG 3.49Å; I230-L234 PolarHBondContact O-N 3.44Å; I230-L246 HydrophobicContact CG2-CB 3.79Å; I230-L246 HydrophobicContact CG2-CD2 4.24Å; I230-L246 HydrophobicContact CG2-CG 4.39Å; I230-I250 HydrophobicContact CD1-CG1 4.35Å; I230-I250 HydrophobicContact CG2-CD1 3.8Å; I230-I250 HydrophobicContact CG2-CG1 3.87Å
231	L	96.7	Very high	93.3	Very high	18 Å²	18	48.1 Å²	48.1	9%	0.094	26%	0.263	C	S	.	.	H	α-helix	trans	-62	-42.9	-178	-63.8	176.3	0	0	0	112	L227 S228 T233 L234 A235 I250 L266 V268 T271	L227-L231 HydrophobicContact CD1-CG 4.26Å; L227-L231 HydrophobicContact CG-CD1 4.2Å; L227-L231 HydrophobicContact CG-CG 4.39Å; L227-L231 WeakPolarHBondContact O-CG 3.12Å; L227-L231 PolarHBondContact O-N 3.44Å; S228-L231 PolarHBondContact O-N 3.32Å; L231-T233 VanDerWaalsContact C-N 3.26Å; L231-T233 PolarHBondContact O-N 3.38Å; L231-L234 PolarHBondContact O-N 3.28Å; L231-A235 PolarHBondContact O-N 3.02Å; L231-I250 HydrophobicContact CD2-CD1 4.02Å; L231-L266 WeakPolarHBondContact CD1-O 3.24Å; L231-V268 HydrophobicContact CD1-CG2 4.14Å; L231-V268 HydrophobicContact CD2-CG2 4.27Å; L231-T271 HydrophobicContact CD2-CG2 4.09Å
232	S	94.8	Very high	93	Very high	60 Å²	60	48.6 Å²	48.6	42%	0.42	27%	0.266	S	S	.	.	H	α-helix	trans	-61.3	-36.8	175.3	65.2	0	0	0	0	112.5	S228 S229 I230	S228-S232 WeakPolarHBondContact O-CB 3.47Å; S228-S232 PolarHBondContact O-N 3.35Å; S228-S232 PolarHBondContact O-OG 3.42Å; S229-S232 WeakPolarHBondContact CA-OG 3.33Å; S229-S232 PolarHBondContact O-OG 3.11Å; I230-S232 PolarHBondContact O-N 3.12Å
233	T	95	Very high	92.9	Very high	17 Å²	17	48.8 Å²	48.8	10%	0.104	27%	0.266	C	S	.	.	H	α-helix	trans	-72.4	-38.7	179.2	-54.4	0	0	0	0	111.4	L193 I201 S229 I230 L231 G236 L242 L246	L193-T233 PolarHBondContact O-OG1 3.13Å; I201-T233 HydrophobicContact CD1-CG2 3.86Å; S229-T233 WeakPolarHBondContact O-CB 3.47Å; S229-T233 PolarHBondContact O-N 3.28Å; S229-T233 PolarHBondContact O-OG1 3.38Å; I230-T233 WeakPolarHBondContact O-CB 2.91Å; I230-T233 PolarHBondContact O-N 2.85Å; I230-T233 VanDerWaalsContact O-N 3.12Å; L231-T233 VanDerWaalsContact C-N 3.26Å; L231-T233 PolarHBondContact O-N 3.38Å; T233-G236 PolarHBondContact O-N 3.49Å; T233-L242 HydrophobicContact CG2-CD2 4.23Å; T233-L246 HydrophobicContact CG2-CD1 3.58Å
234	L	95.4	Very high	92.9	Very high	5 Å²	5	41.3 Å²	41.3	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-62.7	-41	175.3	-77	174.2	0	0	0	112.2	I230 L231 G236 Q243 L246 I247 I250 T271 I275	I230-L234 HydrophobicContact CG2-CD1 4.05Å; I230-L234 HydrophobicContact CG2-CG 4.42Å; I230-L234 WeakPolarHBondContact O-CG 3.49Å; I230-L234 PolarHBondContact O-N 3.44Å; L231-L234 PolarHBondContact O-N 3.28Å; L234-G236 PolarHBondContact O-N 2.92Å; L234-Q243 HydrophobicContact CD2-CB 4.3Å; L234-Q243 HydrophobicContact CD2-CG 4.18Å; L234-L246 HydrophobicContact CD1-CB 4.4Å; L234-L246 HydrophobicContact CD2-CB 3.8Å; L234-L246 HydrophobicContact CD2-CD1 3.98Å; L234-L246 HydrophobicContact CG-CB 4.07Å; L234-L246 HydrophobicContact CG-CD1 4.03Å; L234-I247 HydrophobicContact CD1-CG1 4.13Å; L234-I247 HydrophobicContact CD2-CG1 4.19Å; L234-I250 HydrophobicContact CD1-CD1 3.79Å; L234-T271 HydrophobicContact CB-CG2 3.97Å; L234-T271 HydrophobicContact CD1-CG2 4.26Å; L234-I275 HydrophobicContact CB-CD1 4.2Å; L234-I275 HydrophobicContact CD1-CD1 4.36Å; L234-I275 HydrophobicContact CD2-CD1 3.92Å; L234-I275 HydrophobicContact CG-CD1 4.4Å
235	A	90.9	Very high	92.7	Very high	80 Å²	80	40.2 Å²	40.2	66%	0.661	23%	0.226	S	C	*	.	H	α-helix	trans	-63.9	-23.6	177.7	0	0	0	0	0	113.6	L231 R237	L231-A235 PolarHBondContact O-N 3.02Å; A235-R237 PolarHBondContact O-N 3.12Å; A235-R237 VanDerWaalsContact O-N 3.08Å
236	G	84.6	Confident	92.8	Very high	61 Å²	61	36.6 Å²	36.6	63%	0.629	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.1	23	-175.5	0	0	0	0	0	116.6	T233 L234	T233-G236 PolarHBondContact O-N 3.49Å; L234-G236 PolarHBondContact O-N 2.92Å
237	R	72.8	Confident	92.8	Very high	239 Å²	239	36.6 Å²	36.6	90%	0.902	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.1	47.9	-173.6	-56.2	-175.3	178.1	-170.9	-1.1	113.7	A235	A235-R237 PolarHBondContact O-N 3.12Å; A235-R237 VanDerWaalsContact O-N 3.08Å
238	A	82.1	Confident	92.7	Very high	13 Å²	13	36.6 Å²	36.6	11%	0.107	21%	0.206	C	C	.	.			trans	-54.1	138.6	169.6	0	0	0	0	0	111.2	L242 Q243	A238-L242 HydrophobicContact CB-CB 4.1Å; A238-L242 HydrophobicContact CB-CD2 3.76Å; A238-L242 HydrophobicContact CB-CG 3.96Å; A238-Q243 HydrophobicContact CB-CG 3.87Å; A238-Q243 PolarHBondContact O-NE2 3.33Å
239	N	90.5	Very high	92.8	Very high	78 Å²	78	35 Å²	35	42%	0.417	20%	0.195	S	C	.	.			trans	-63.7	159.8	171.3	68	45.1	0	0	0	110.5	H202 Q241 L242 Q243	H202-N239 PolarHBondContact CE1-OD1 2.66Å; H202-N239 PolarHBondContact NE2-ND2 3.28Å; N239-Q241 PolarHBondContact O-N 3.45Å; N239-Q241 WeakPolarHBondContact OD1-CB 3.49Å; N239-Q241 PolarHBondContact OD1-N 3.35Å; N239-Q241 VanDerWaalsContact OD1-N 3.12Å; N239-L242 PolarHBondContact O-N 3.06Å; N239-L242 WeakPolarHBondContact OD1-CB 3.48Å; N239-L242 PolarHBondContact OD1-N 3.21Å; N239-Q243 WeakPolarHBondContact O-CG 3.43Å; N239-Q243 PolarHBondContact O-N 3.09Å
240	F	92.3	Very high	92.9	Very high	93 Å²	93	35 Å²	35	41%	0.408	20%	0.195	S	C	.	.	H	α-helix	trans	-57	-27.9	-175.9	69	-96.4	0	0	0	113.8	Y244 K281 V284	F240-Y244 WeakPolarHBondContact O-CB 3.38Å; F240-Y244 PolarHBondContact O-N 3.33Å; F240-K281 HydrophobicContact CB-CB 4.39Å; F240-K281 HydrophobicContact CB-CG 3.77Å; F240-K281 HydrophobicContact CD1-CG 4.35Å; F240-K281 HydrophobicContact CD2-CG 4.17Å; F240-K281 HydrophobicContact CG-CD 4.48Å; F240-K281 HydrophobicContact CG-CG 3.84Å; F240-V284 HydrophobicContact CB-CG2 4.07Å; F240-V284 WeakPolarHBondContact O-CG2 3.34Å
241	Q	91.4	Very high	92.9	Very high	30 Å²	30	35.4 Å²	35.4	14%	0.14	20%	0.197	C	C	.	.	H	α-helix	trans	-71.5	-47.4	177.5	177.8	61.4	35	0	0	110.9	N239 Q243 Y244 Q245	N239-Q241 PolarHBondContact O-N 3.45Å; N239-Q241 WeakPolarHBondContact OD1-CB 3.49Å; N239-Q241 PolarHBondContact OD1-N 3.35Å; N239-Q241 VanDerWaalsContact OD1-N 3.12Å; Q241-Q243 VanDerWaalsContact C-N 3.34Å; Q241-Y244 PolarHBondContact O-N 3.46Å; Q241-Q245 WeakPolarHBondContact O-CG 3.41Å; Q241-Q245 PolarHBondContact O-N 3.18Å
242	L	93.5	Very high	92.9	Very high	10 Å²	10	34.6 Å²	34.6	5%	0.052	19%	0.192	C	C	.	.	H	α-helix	trans	-66	-39.8	176.7	-178.9	61	0	0	0	110.7	I201 A205 T233 A238 N239 Y244 Q245 L246	I201-L242 HydrophobicContact CD1-CD1 4.38Å; I201-L242 HydrophobicContact CD1-CD2 3.64Å; I201-L242 HydrophobicContact CG1-CD1 3.96Å; I201-L242 HydrophobicContact CG1-CD2 4.06Å; I201-L242 HydrophobicContact CG2-CD2 4.24Å; A205-L242 HydrophobicContact CB-CD1 3.88Å; T233-L242 HydrophobicContact CG2-CD2 4.23Å; A238-L242 HydrophobicContact CB-CB 4.1Å; A238-L242 HydrophobicContact CB-CD2 3.76Å; A238-L242 HydrophobicContact CB-CG 3.96Å; N239-L242 PolarHBondContact O-N 3.06Å; N239-L242 WeakPolarHBondContact OD1-CB 3.48Å; N239-L242 PolarHBondContact OD1-N 3.21Å; L242-Y244 PolarHBondContact O-N 2.79Å; L242-Q245 PolarHBondContact O-N 2.98Å; L242-L246 HydrophobicContact CD1-CD1 3.93Å; L242-L246 HydrophobicContact CD1-CD2 4.38Å; L242-L246 HydrophobicContact CD1-CG 3.88Å; L242-L246 HydrophobicContact CD2-CD1 4.5Å; L242-L246 HydrophobicContact CG-CD1 3.87Å; L242-L246 HydrophobicContact CG-CG 4.22Å; L242-L246 WeakPolarHBondContact O-CB 3.36Å; L242-L246 VanDerWaalsContact O-CG 3.29Å; L242-L246 WeakPolarHBondContact O-CG 3.41Å; L242-L246 PolarHBondContact O-N 2.94Å
243	Q	95.5	Very high	93.1	Very high	24 Å²	24	31.7 Å²	31.7	11%	0.112	17%	0.172	C	C	.	.	H	α-helix	trans	-53.8	-53.9	171.4	-71.4	174.9	-16.6	0	0	110.6	L234 A238 N239 Q241 Q245 L246 I247 V284	L234-Q243 HydrophobicContact CD2-CB 4.3Å; L234-Q243 HydrophobicContact CD2-CG 4.18Å; A238-Q243 HydrophobicContact CB-CG 3.87Å; A238-Q243 PolarHBondContact O-NE2 3.33Å; N239-Q243 WeakPolarHBondContact O-CG 3.43Å; N239-Q243 PolarHBondContact O-N 3.09Å; Q241-Q243 VanDerWaalsContact C-N 3.34Å; Q243-Q245 VanDerWaalsContact C-N 3.34Å; Q243-Q245 PolarHBondContact O-N 2.91Å; Q243-L246 PolarHBondContact O-N 2.93Å; Q243-I247 HydrophobicContact CB-CD1 4.22Å; Q243-I247 WeakPolarHBondContact O-CB 3.29Å; Q243-I247 WeakPolarHBondContact O-CD1 3.37Å; Q243-I247 WeakPolarHBondContact O-CG1 3.36Å; Q243-I247 PolarHBondContact O-N 3.4Å; Q243-V284 HydrophobicContact CB-CG1 4.32Å
244	Y	95.2	Very high	93.2	Very high	5 Å²	5	30.9 Å²	30.9	2%	0.02	17%	0.167	C	C	.	.	H	α-helix	trans	-55.1	-47.6	176.7	172.5	-94.9	0	0	0	112.4	E26 H30 F240 Q241 L242 L246 I247 F248 K283 I287	E26-Y244 PolarHBondContact OE1-OH 2.88Å; H30-Y244 HydrophobicContact CB-CE1 4.5Å; H30-Y244 AromaticContact CE1-CE2 3.9Å; H30-Y244 AromaticContact CE1-CZ 3.9Å; H30-Y244 AromaticContact CG-CZ 3.86Å; H30-Y244 AromaticContact ND1-CZ 3.65Å; H30-Y244 PolarHBondContact ND1-OH 3.4Å; F240-Y244 WeakPolarHBondContact O-CB 3.38Å; F240-Y244 PolarHBondContact O-N 3.33Å; Q241-Y244 PolarHBondContact O-N 3.46Å; L242-Y244 PolarHBondContact O-N 2.79Å; Y244-L246 PolarHBondContact O-N 2.68Å; Y244-I247 PolarHBondContact O-N 3.32Å; Y244-F248 VanDerWaalsContact O-CB 3.24Å; Y244-F248 WeakPolarHBondContact O-CB 3.35Å; Y244-F248 PolarHBondContact O-N 3.34Å; Y244-K283 HydrophobicContact CD2-CB 4.45Å; Y244-K283 HydrophobicContact CD2-CG 4.39Å; Y244-I287 HydrophobicContact CD2-CB 4.13Å; Y244-I287 HydrophobicContact CD2-CG2 3.76Å; Y244-I287 HydrophobicContact CE2-CB 4.1Å; Y244-I287 HydrophobicContact CE2-CG1 4.44Å; Y244-I287 HydrophobicContact CE2-CG2 4.25Å
245	Q	94.6	Very high	93.2	Very high	1 Å²	1	31.6 Å²	31.6	1%	0.005	17%	0.17	C	C	.	.	H	α-helix	trans	-63.1	-41.8	-177.7	-69.8	177.3	-57	0	0	112.9	H202 A205 Q209 Q241 L242 Q243 S249	H202-Q245 PolarHBondContact ND1-OE1 3.46Å; H202-Q245 PolarHBondContact O-NE2 2.73Å; A205-Q245 HydrophobicContact CB-CB 3.94Å; Q209-Q245 HydrophobicContact CG-CB 4.44Å; Q209-Q245 WeakPolarHBondContact CG-O 3.4Å; Q241-Q245 WeakPolarHBondContact O-CG 3.41Å; Q241-Q245 PolarHBondContact O-N 3.18Å; L242-Q245 PolarHBondContact O-N 2.98Å; Q243-Q245 VanDerWaalsContact C-N 3.34Å; Q243-Q245 PolarHBondContact O-N 2.91Å; Q245-S249 PolarHBondContact O-N 2.99Å; Q245-S249 PolarHBondContact O-OG 2.86Å
246	L	97.1	Very high	93.5	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-74.1	-38.6	180	-70.4	-176	0	0	0	112.1	L193 A205 I230 T233 L234 L242 Q243 Y244 F248 S249 I250	L193-L246 HydrophobicContact CD1-CD2 4.21Å; L193-L246 HydrophobicContact CD2-CD2 3.92Å; A205-L246 HydrophobicContact CB-CD2 4.03Å; I230-L246 HydrophobicContact CG2-CB 3.79Å; I230-L246 HydrophobicContact CG2-CD2 4.24Å; I230-L246 HydrophobicContact CG2-CG 4.39Å; T233-L246 HydrophobicContact CG2-CD1 3.58Å; L234-L246 HydrophobicContact CD1-CB 4.4Å; L234-L246 HydrophobicContact CD2-CB 3.8Å; L234-L246 HydrophobicContact CD2-CD1 3.98Å; L234-L246 HydrophobicContact CG-CB 4.07Å; L234-L246 HydrophobicContact CG-CD1 4.03Å; L242-L246 HydrophobicContact CD1-CD1 3.93Å; L242-L246 HydrophobicContact CD1-CD2 4.38Å; L242-L246 HydrophobicContact CD1-CG 3.88Å; L242-L246 HydrophobicContact CD2-CD1 4.5Å; L242-L246 HydrophobicContact CG-CD1 3.87Å; L242-L246 HydrophobicContact CG-CG 4.22Å; L242-L246 WeakPolarHBondContact O-CB 3.36Å; L242-L246 VanDerWaalsContact O-CG 3.29Å; L242-L246 WeakPolarHBondContact O-CG 3.41Å; L242-L246 PolarHBondContact O-N 2.94Å; Q243-L246 PolarHBondContact O-N 2.93Å; Y244-L246 PolarHBondContact O-N 2.68Å; L246-F248 VanDerWaalsContact C-N 3.33Å; L246-S249 VanDerWaalsContact O-CB 3.3Å; L246-S249 WeakPolarHBondContact O-CB 3.35Å; L246-S249 PolarHBondContact O-N 3.4Å; L246-I250 WeakPolarHBondContact O-CG1 3.37Å; L246-I250 PolarHBondContact O-N 3.14Å; L246-I250 VanDerWaalsContact O-N 3.08Å
247	I	97.9	Very high	94.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-69.7	-35.3	175.9	-59.4	164.1	0	0	0	110.1	L234 Q243 Y244 S249 I250 W251 L272 I275 V284 I287 I288	L234-I247 HydrophobicContact CD1-CG1 4.13Å; L234-I247 HydrophobicContact CD2-CG1 4.19Å; Q243-I247 HydrophobicContact CB-CD1 4.22Å; Q243-I247 WeakPolarHBondContact O-CB 3.29Å; Q243-I247 WeakPolarHBondContact O-CD1 3.37Å; Q243-I247 WeakPolarHBondContact O-CG1 3.36Å; Q243-I247 PolarHBondContact O-N 3.4Å; Y244-I247 PolarHBondContact O-N 3.32Å; I247-S249 VanDerWaalsContact C-N 3.28Å; I247-S249 PolarHBondContact O-N 3.45Å; I247-I250 CarbonylContact O-C 3.22Å; I247-I250 WeakPolarHBondContact O-CA 3.33Å; I247-I250 WeakPolarHBondContact O-CB 3.49Å; I247-I250 PolarHBondContact O-N 3.26Å; I247-I250 VanDerWaalsContact O-N 3.08Å; I247-W251 WeakPolarHBondContact O-CB 3.11Å; I247-W251 PolarHBondContact O-N 2.98Å; I247-L272 HydrophobicContact CB-CD2 4.36Å; I247-L272 HydrophobicContact CD1-CD2 3.99Å; I247-L272 HydrophobicContact CG1-CD2 3.62Å; I247-L272 HydrophobicContact CG2-CD2 3.88Å; I247-I275 HydrophobicContact CD1-CD1 4.15Å; I247-I275 HydrophobicContact CD1-CG2 4.39Å; I247-V284 HydrophobicContact CD1-CG1 4.1Å; I247-I287 HydrophobicContact CB-CG2 3.98Å; I247-I287 HydrophobicContact CG2-CB 4.4Å; I247-I287 HydrophobicContact CG2-CG1 4.05Å; I247-I287 HydrophobicContact CG2-CG2 3.77Å; I247-I288 HydrophobicContact CD1-CD1 4.05Å; I247-I288 HydrophobicContact CD1-CG1 3.77Å; I247-I288 HydrophobicContact CG2-CG1 4.12Å
248	F	97.1	Very high	95.2	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-58.3	-41.6	169.9	-179.1	-78.4	0	0	0	111.6	I23 E26 M27 Q209 Y244 L246 I250 W251 C252 I287	I23-F248 HydrophobicContact CG2-CZ 4.12Å; E26-F248 HydrophobicContact CB-CE2 4.2Å; E26-F248 HydrophobicContact CG-CD2 4.24Å; E26-F248 HydrophobicContact CG-CE2 4Å; M27-F248 HydrophobicContact CG-CE1 4.37Å; M27-F248 HydrophobicContact CG-CE2 3.89Å; M27-F248 HydrophobicContact CG-CZ 3.48Å; M27-F248 VanDerWaalsContact CG-CZ 3.48Å; M27-F248 HydrophobicContact SD-CE1 4.49Å; M27-F248 HydrophobicContact SD-CZ 4Å; Q209-F248 HydrophobicContact CB-CD1 3.94Å; Q209-F248 HydrophobicContact CB-CE1 4.12Å; Q209-F248 HydrophobicContact CG-CB 4.49Å; Q209-F248 HydrophobicContact CG-CD1 3.7Å; Q209-F248 HydrophobicContact CG-CE1 4.36Å; Q209-F248 HydrophobicContact CG-CG 4.38Å; Q209-F248 VanDerWaalsContact NE2-CG 3.27Å; Y244-F248 VanDerWaalsContact O-CB 3.24Å; Y244-F248 WeakPolarHBondContact O-CB 3.35Å; Y244-F248 PolarHBondContact O-N 3.34Å; L246-F248 VanDerWaalsContact C-N 3.33Å; F248-I250 VanDerWaalsContact C-N 3.33Å; F248-I250 PolarHBondContact O-N 3.4Å; F248-W251 AromaticContact CD2-CE3 3.95Å; F248-W251 HydrophobicContact CD2-CE3 3.95Å; F248-W251 HydrophobicContact CD2-CZ3 4.08Å; F248-W251 AromaticContact CE2-CE3 3.9Å; F248-W251 HydrophobicContact CE2-CE3 3.9Å; F248-W251 AromaticContact CE2-CZ3 3.58Å; F248-W251 HydrophobicContact CE2-CZ3 3.58Å; F248-W251 HydrophobicContact CG-CE3 4.41Å; F248-W251 HydrophobicContact CZ-CE3 4.31Å; F248-W251 AromaticContact CZ-CZ3 3.98Å; F248-W251 HydrophobicContact CZ-CZ3 3.98Å; F248-W251 WeakPolarHBondContact O-CB 3.08Å; F248-W251 PolarHBondContact O-N 3.44Å; F248-C252 WeakPolarHBondContact CE1-SG 3.44Å; F248-C252 PolarHBondContact O-N 3.07Å; F248-C252 PolarHBondContact O-SG 3.03Å; F248-C252 VanDerWaalsContact O-SG 3.34Å; F248-I287 HydrophobicContact CB-CD1 4.45Å; F248-I287 HydrophobicContact CB-CG1 4.29Å; F248-I287 HydrophobicContact CD2-CD1 4.19Å
249	S	97.4	Very high	95.9	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	9%	0.091	C	C	.	.	H	α-helix	trans	-60.7	-41.1	173.5	-72.5	0	0	0	0	112.3	Q245 L246 I247 C252 I253	Q245-S249 PolarHBondContact O-N 2.99Å; Q245-S249 PolarHBondContact O-OG 2.86Å; L246-S249 VanDerWaalsContact O-CB 3.3Å; L246-S249 WeakPolarHBondContact O-CB 3.35Å; L246-S249 PolarHBondContact O-N 3.4Å; I247-S249 VanDerWaalsContact C-N 3.28Å; I247-S249 PolarHBondContact O-N 3.45Å; S249-C252 PolarHBondContact O-N 2.89Å; S249-I253 WeakPolarHBondContact O-CG1 3.39Å; S249-I253 PolarHBondContact O-N 3.26Å
250	I	98.3	Very high	96.2	Very high	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-63.3	-47.7	173.9	-64.6	175.7	0	0	0	110.5	L227 I230 L231 L234 L246 I247 F248 C252 I253 T254 M263 V268 L272 T291	L227-I250 HydrophobicContact CD1-CD1 4.27Å; L227-I250 HydrophobicContact CD1-CG1 3.85Å; I230-I250 HydrophobicContact CD1-CG1 4.35Å; I230-I250 HydrophobicContact CG2-CD1 3.8Å; I230-I250 HydrophobicContact CG2-CG1 3.87Å; L231-I250 HydrophobicContact CD2-CD1 4.02Å; L234-I250 HydrophobicContact CD1-CD1 3.79Å; L246-I250 WeakPolarHBondContact O-CG1 3.37Å; L246-I250 PolarHBondContact O-N 3.14Å; L246-I250 VanDerWaalsContact O-N 3.08Å; I247-I250 CarbonylContact O-C 3.22Å; I247-I250 WeakPolarHBondContact O-CA 3.33Å; I247-I250 WeakPolarHBondContact O-CB 3.49Å; I247-I250 PolarHBondContact O-N 3.26Å; I247-I250 VanDerWaalsContact O-N 3.08Å; F248-I250 VanDerWaalsContact C-N 3.33Å; F248-I250 PolarHBondContact O-N 3.4Å; I250-C252 VanDerWaalsContact C-N 3.33Å; I250-C252 PolarHBondContact O-N 2.89Å; I250-I253 WeakPolarHBondContact O-CA 3.48Å; I250-I253 WeakPolarHBondContact O-CB 3.5Å; I250-I253 PolarHBondContact O-N 3.34Å; I250-T254 PolarHBondContact O-N 2.9Å; I250-T254 VanDerWaalsContact O-N 3.16Å; I250-M263 HydrophobicContact CB-CE 4.46Å; I250-M263 HydrophobicContact CG2-CE 3.3Å; I250-V268 HydrophobicContact CG2-CG1 3.77Å; I250-L272 HydrophobicContact CD1-CD2 4.38Å; I250-T291 HydrophobicContact CG2-CG2 3.83Å
251	W	98.1	Very high	96.4	Very high	10 Å²	10	11.6 Å²	11.6	4%	0.038	6%	0.062	C	C	.	.	H	α-helix	trans	-56.2	-45.1	177	177	66.2	0	0	0	111.8	I23 E26 I247 F248 I253 T254 F255 I287 T291 N294	I23-W251 HydrophobicContact CB-CH2 4.39Å; I23-W251 HydrophobicContact CB-CZ3 4.24Å; I23-W251 HydrophobicContact CG1-CH2 3.89Å; I23-W251 HydrophobicContact CG1-CZ3 3.77Å; E26-W251 HydrophobicContact CB-CH2 3.97Å; E26-W251 HydrophobicContact CB-CZ3 4.16Å; E26-W251 HydrophobicContact CG-CH2 4.38Å; E26-W251 HydrophobicContact CG-CZ3 4.34Å; I247-W251 WeakPolarHBondContact O-CB 3.11Å; I247-W251 PolarHBondContact O-N 2.98Å; F248-W251 AromaticContact CD2-CE3 3.95Å; F248-W251 HydrophobicContact CD2-CE3 3.95Å; F248-W251 HydrophobicContact CD2-CZ3 4.08Å; F248-W251 AromaticContact CE2-CE3 3.9Å; F248-W251 HydrophobicContact CE2-CE3 3.9Å; F248-W251 AromaticContact CE2-CZ3 3.58Å; F248-W251 HydrophobicContact CE2-CZ3 3.58Å; F248-W251 HydrophobicContact CG-CE3 4.41Å; F248-W251 HydrophobicContact CZ-CE3 4.31Å; F248-W251 AromaticContact CZ-CZ3 3.98Å; F248-W251 HydrophobicContact CZ-CZ3 3.98Å; F248-W251 WeakPolarHBondContact O-CB 3.08Å; F248-W251 PolarHBondContact O-N 3.44Å; W251-I253 VanDerWaalsContact C-N 3.26Å; W251-I253 PolarHBondContact O-N 2.92Å; W251-T254 PolarHBondContact O-N 3.07Å; W251-T254 PolarHBondContact O-OG1 3.39Å; W251-F255 AromaticContact CD2-CE2 3.7Å; W251-F255 HydrophobicContact CD2-CE2 3.7Å; W251-F255 HydrophobicContact CD2-CZ 4.45Å; W251-F255 AromaticContact CE2-CE2 3.35Å; W251-F255 AromaticContact CE2-CZ 3.65Å; W251-F255 HydrophobicContact CE3-CE2 4.05Å; W251-F255 HydrophobicContact CG-CE2 4.34Å; W251-F255 AromaticContact CH2-CE2 3.86Å; W251-F255 HydrophobicContact CH2-CE2 3.86Å; W251-F255 AromaticContact CH2-CZ 3.98Å; W251-F255 HydrophobicContact CH2-CZ 3.98Å; W251-F255 AromaticContact CZ2-CE2 3.47Å; W251-F255 HydrophobicContact CZ2-CE2 3.47Å; W251-F255 VanDerWaalsContact CZ2-CE2 3.47Å; W251-F255 AromaticContact CZ2-CZ 3.4Å; W251-F255 HydrophobicContact CZ2-CZ 3.4Å; W251-F255 VanDerWaalsContact CZ2-CZ 3.4Å; W251-F255 HydrophobicContact CZ3-CE2 4.13Å; W251-F255 AromaticContact NE1-CE2 3.75Å; W251-F255 AromaticContact NE1-CZ 3.97Å; W251-F255 WeakPolarHBondContact O-CD2 3.42Å; W251-I287 HydrophobicContact CB-CD1 3.86Å; W251-I287 HydrophobicContact CB-CG1 4.31Å; W251-I287 HydrophobicContact CD2-CD1 3.69Å; W251-I287 HydrophobicContact CE3-CD1 3.86Å; W251-I287 HydrophobicContact CG-CD1 3.72Å; W251-T291 WeakPolarHBondContact CB-OG1 3.32Å; W251-N294 PolarHBondContact NE1-ND2 3.31Å
252	C	96.8	Very high	96.5	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-56.2	-40.2	174.1	-71.5	0	0	0	0	112.5	L212 R218 F248 S249 I250 T254 F255	L212-C252 HydrophobicContact CB-CB 3.98Å; L212-C252 WeakPolarHBondContact O-CB 3.45Å; R218-C252 WeakPolarHBondContact CD-O 3.29Å; R218-C252 PolarHBondContact NE-O 3.36Å; R218-C252 PolarHBondContact NH1-O 3.12Å; F248-C252 WeakPolarHBondContact CE1-SG 3.44Å; F248-C252 PolarHBondContact O-N 3.07Å; F248-C252 PolarHBondContact O-SG 3.03Å; F248-C252 VanDerWaalsContact O-SG 3.34Å; S249-C252 PolarHBondContact O-N 2.89Å; I250-C252 VanDerWaalsContact C-N 3.33Å; I250-C252 PolarHBondContact O-N 2.89Å; C252-T254 VanDerWaalsContact C-N 3.3Å; C252-T254 PolarHBondContact O-N 3.26Å; C252-F255 PolarHBondContact O-N 3.07Å
253	I	97.8	Very high	96.6	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-64	-37	177.9	-62.4	164.7	0	0	0	111	L212 F221 M222 S249 I250 W251 F255 S256 L259 M263	L212-I253 HydrophobicContact CD1-CD1 4.15Å; L212-I253 HydrophobicContact CD1-CG1 4.22Å; L212-I253 HydrophobicContact CD2-CG1 4.49Å; F221-I253 HydrophobicContact CD1-CD1 4.14Å; F221-I253 HydrophobicContact CE1-CD1 4.39Å; M222-I253 HydrophobicContact CG-CG2 4.04Å; M222-I253 HydrophobicContact SD-CD1 4.24Å; M222-I253 HydrophobicContact SD-CG2 4.05Å; S249-I253 WeakPolarHBondContact O-CG1 3.39Å; S249-I253 PolarHBondContact O-N 3.26Å; I250-I253 WeakPolarHBondContact O-CA 3.48Å; I250-I253 WeakPolarHBondContact O-CB 3.5Å; I250-I253 PolarHBondContact O-N 3.34Å; W251-I253 VanDerWaalsContact C-N 3.26Å; W251-I253 PolarHBondContact O-N 2.92Å; I253-F255 PolarHBondContact O-N 3.33Å; I253-F255 VanDerWaalsContact O-N 3.13Å; I253-S256 PolarHBondContact O-N 3.5Å; I253-S256 VanDerWaalsContact O-N 3.14Å; I253-L259 HydrophobicContact CG2-CB 3.74Å; I253-L259 HydrophobicContact CG2-CD1 4.02Å; I253-M263 HydrophobicContact CB-SD 4.24Å; I253-M263 HydrophobicContact CG2-SD 3.68Å
254	T	97.4	Very high	96.4	Very high	0 Å²	0	17 Å²	17	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-64.9	-15.6	-178.3	65	0	0	0	0	114.8	I250 W251 C252 S256 M263 T291 N294 L295	I250-T254 PolarHBondContact O-N 2.9Å; I250-T254 VanDerWaalsContact O-N 3.16Å; W251-T254 PolarHBondContact O-N 3.07Å; W251-T254 PolarHBondContact O-OG1 3.39Å; C252-T254 VanDerWaalsContact C-N 3.3Å; C252-T254 PolarHBondContact O-N 3.26Å; T254-S256 PolarHBondContact O-N 3.42Å; T254-M263 HydrophobicContact CG2-CE 3.7Å; T254-M263 HydrophobicContact CG2-SD 3.79Å; T254-T291 HydrophobicContact CG2-CG2 3.84Å; T254-N294 HydrophobicContact CG2-CB 4.43Å; T254-N294 WeakPolarHBondContact OG1-CB 3.44Å; T254-N294 PolarHBondContact OG1-ND2 2.98Å; T254-L295 HydrophobicContact CG2-CD2 3.8Å; T254-L295 HydrophobicContact CG2-CG 4.02Å
255	F	96.9	Very high	96.3	Very high	19 Å²	19	21.4 Å²	21.4	8%	0.083	11%	0.107	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-14.1	175	-78.7	-81.3	0	0	0	114	L15 S19 A22 I23 R218 W251 C252 I253 P257	L15-F255 HydrophobicContact CD2-CB 4.3Å; S19-F255 WeakPolarHBondContact OG-CD1 3.4Å; A22-F255 HydrophobicContact CB-CZ 4.42Å; I23-F255 HydrophobicContact CD1-CD2 3.8Å; I23-F255 HydrophobicContact CD1-CE2 3.85Å; I23-F255 HydrophobicContact CD1-CG 4.34Å; I23-F255 HydrophobicContact CD1-CZ 4.46Å; I23-F255 HydrophobicContact CG1-CD2 4.09Å; I23-F255 HydrophobicContact CG1-CE2 3.59Å; I23-F255 HydrophobicContact CG1-CZ 4.03Å; R218-F255 VanDerWaalsContact NH1-CB 3.3Å; W251-F255 AromaticContact CD2-CE2 3.7Å; W251-F255 HydrophobicContact CD2-CE2 3.7Å; W251-F255 HydrophobicContact CD2-CZ 4.45Å; W251-F255 AromaticContact CE2-CE2 3.35Å; W251-F255 AromaticContact CE2-CZ 3.65Å; W251-F255 HydrophobicContact CE3-CE2 4.05Å; W251-F255 HydrophobicContact CG-CE2 4.34Å; W251-F255 AromaticContact CH2-CE2 3.86Å; W251-F255 HydrophobicContact CH2-CE2 3.86Å; W251-F255 AromaticContact CH2-CZ 3.98Å; W251-F255 HydrophobicContact CH2-CZ 3.98Å; W251-F255 AromaticContact CZ2-CE2 3.47Å; W251-F255 HydrophobicContact CZ2-CE2 3.47Å; W251-F255 VanDerWaalsContact CZ2-CE2 3.47Å; W251-F255 AromaticContact CZ2-CZ 3.4Å; W251-F255 HydrophobicContact CZ2-CZ 3.4Å; W251-F255 VanDerWaalsContact CZ2-CZ 3.4Å; W251-F255 HydrophobicContact CZ3-CE2 4.13Å; W251-F255 AromaticContact NE1-CE2 3.75Å; W251-F255 AromaticContact NE1-CZ 3.97Å; W251-F255 WeakPolarHBondContact O-CD2 3.42Å; C252-F255 PolarHBondContact O-N 3.07Å; I253-F255 PolarHBondContact O-N 3.33Å; I253-F255 VanDerWaalsContact O-N 3.13Å; F255-P257 WeakPolarHBondContact O-CD 3.46Å
256	S	96.7	Very high	96.4	Very high	0 Å²	0	24.7 Å²	24.7	0%	0	13%	0.125	C	C	.	.	S	Bend	trans	-99.6	105.8	175.2	-65.5	0	0	0	0	108.7	E215 R218 I253 T254 P258 L259 A260	E215-S256 WeakPolarHBondContact OE1-CB 3.17Å; E215-S256 PolarHBondContact OE1-OG 3.34Å; R218-S256 PolarHBondContact NH1-OG 2.89Å; I253-S256 PolarHBondContact O-N 3.5Å; I253-S256 VanDerWaalsContact O-N 3.14Å; T254-S256 PolarHBondContact O-N 3.42Å; S256-P258 VanDerWaalsContact C-CD 3.47Å; S256-L259 WeakPolarHBondContact O-CA 3.33Å; S256-L259 WeakPolarHBondContact O-CB 3.43Å; S256-L259 PolarHBondContact O-N 2.84Å; S256-A260 PolarHBondContact O-N 3.08Å
257	P	96.3	Very high	96.3	Very high	33 Å²	33	26.1 Å²	26.1	21%	0.214	14%	0.14	C	C	.	.	H	α-helix	trans	-50.6	-45.2	-173.3	-27.2	33.9	0	0	0	114.6	F255 L259 A260 E261 K298 E300	F255-P257 WeakPolarHBondContact O-CD 3.46Å; P257-L259 PolarHBondContact O-N 3.47Å; P257-L259 VanDerWaalsContact O-N 3.13Å; P257-A260 PolarHBondContact O-N 3.31Å; P257-E261 WeakPolarHBondContact O-CG 3.3Å; P257-E261 PolarHBondContact O-N 2.78Å; P257-K298 WeakPolarHBondContact CB-O 3.37Å; P257-E300 HydrophobicContact CB-CG 4.3Å
258	P	96.5	Very high	96.3	Very high	60 Å²	60	26.1 Å²	26.1	39%	0.39	14%	0.14	S	C	.	.	H	α-helix	trans	-63.5	-24.3	178.8	-22.6	34.6	0	0	0	114	F219 S256	F219-P258 HydrophobicContact CE1-CB 4.35Å; F219-P258 HydrophobicContact CZ-CB 4.4Å; F219-P258 HydrophobicContact CZ-CG 4.37Å; S256-P258 VanDerWaalsContact C-CD 3.47Å
259	L	97.1	Very high	96.3	Very high	5 Å²	5	26.1 Å²	26.1	3%	0.026	14%	0.14	C	C	.	.	H	α-helix	trans	-84	-44.8	175.8	-57.9	-176.6	0	0	0	110.5	R218 F219 M222 I253 S256 P257 E261 R262 M263	R218-L259 HydrophobicContact CB-CD1 3.58Å; F219-L259 HydrophobicContact CD1-CD1 4.28Å; F219-L259 HydrophobicContact CD1-CD2 3.65Å; F219-L259 HydrophobicContact CD1-CG 4.14Å; F219-L259 HydrophobicContact CD2-CD1 4.27Å; F219-L259 HydrophobicContact CE1-CD1 4.4Å; F219-L259 HydrophobicContact CE1-CD2 3.66Å; F219-L259 HydrophobicContact CE1-CG 3.91Å; F219-L259 HydrophobicContact CE2-CD1 4.38Å; F219-L259 HydrophobicContact CG-CD1 4.21Å; F219-L259 HydrophobicContact CG-CD2 4.35Å; F219-L259 HydrophobicContact CZ-CD1 4.44Å; F219-L259 HydrophobicContact CZ-CD2 4.38Å; F219-L259 HydrophobicContact CZ-CG 4.11Å; M222-L259 HydrophobicContact CB-CD2 3.98Å; M222-L259 HydrophobicContact CG-CD1 4Å; M222-L259 HydrophobicContact CG-CD2 3.94Å; M222-L259 HydrophobicContact CG-CG 4.4Å; I253-L259 HydrophobicContact CG2-CB 3.74Å; I253-L259 HydrophobicContact CG2-CD1 4.02Å; S256-L259 WeakPolarHBondContact O-CA 3.33Å; S256-L259 WeakPolarHBondContact O-CB 3.43Å; S256-L259 PolarHBondContact O-N 2.84Å; P257-L259 PolarHBondContact O-N 3.47Å; P257-L259 VanDerWaalsContact O-N 3.13Å; L259-E261 PolarHBondContact O-N 2.59Å; L259-R262 PolarHBondContact O-N 3.07Å; L259-M263 WeakPolarHBondContact O-CG 3.14Å; L259-M263 PolarHBondContact O-N 3.12Å
260	A	96.3	Very high	96.3	Very high	0 Å²	0	28 Å²	28	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-54.5	-42.5	175.4	0	0	0	0	0	111.5	S256 P257 R262 M263 L295	S256-A260 PolarHBondContact O-N 3.08Å; P257-A260 PolarHBondContact O-N 3.31Å; A260-R262 PolarHBondContact O-N 3.49Å; A260-R262 VanDerWaalsContact O-N 3.14Å; A260-M263 WeakPolarHBondContact O-CB 3.43Å; A260-M263 PolarHBondContact O-N 3.44Å; A260-L295 HydrophobicContact CB-CD2 4.45Å
261	E	96.3	Very high	96.2	Very high	46 Å²	46	29.4 Å²	29.4	22%	0.215	16%	0.164	C	C	.	.	H	α-helix	trans	-58.8	-27.2	178.2	-78.8	178	-179.9	0	0	113.7	P257 L259 H264 P299 E300 D301 I304	P257-E261 WeakPolarHBondContact O-CG 3.3Å; P257-E261 PolarHBondContact O-N 2.78Å; L259-E261 PolarHBondContact O-N 2.59Å; E261-H264 PolarHBondContact O-CE1 2.84Å; E261-H264 PolarHBondContact O-ND1 3.39Å; E261-P299 HydrophobicContact CG-CB 3.78Å; E261-P299 HydrophobicContact CG-CG 4.47Å; E261-E300 PolarHBondContact OE1-N 3.28Å; E261-D301 PolarHBondContact OE1-N 3.39Å; E261-I304 HydrophobicContact CB-CD1 3.73Å; E261-I304 HydrophobicContact CG-CD1 3.69Å; E261-I304 HydrophobicContact CG-CG2 4.4Å
262	R	94.8	Very high	96.2	Very high	157 Å²	157	28.9 Å²	28.9	59%	0.592	16%	0.162	S	C	*	.	H	α-helix	trans	-88.6	-18.2	179.3	-62.5	179.3	68.5	-176.2	0.5	113.1	L259 A260 H264 T265	L259-R262 PolarHBondContact O-N 3.07Å; A260-R262 PolarHBondContact O-N 3.49Å; A260-R262 VanDerWaalsContact O-N 3.14Å; R262-H264 PolarHBondContact O-N 3.2Å; R262-T265 PolarHBondContact O-N 3.43Å; R262-T265 PolarHBondContact O-OG1 3.02Å
263	M	94.6	Very high	96.3	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-71.2	-28.4	-168.2	-74	173.4	72.2	0	0	114	L227 I250 I253 T254 L259 A260 T265 L266 V268 L295	L227-M263 HydrophobicContact CD2-CE 4.34Å; L227-M263 HydrophobicContact CD2-CG 3.97Å; I250-M263 HydrophobicContact CB-CE 4.46Å; I250-M263 HydrophobicContact CG2-CE 3.3Å; I253-M263 HydrophobicContact CB-SD 4.24Å; I253-M263 HydrophobicContact CG2-SD 3.68Å; T254-M263 HydrophobicContact CG2-CE 3.7Å; T254-M263 HydrophobicContact CG2-SD 3.79Å; L259-M263 WeakPolarHBondContact O-CG 3.14Å; L259-M263 PolarHBondContact O-N 3.12Å; A260-M263 WeakPolarHBondContact O-CB 3.43Å; A260-M263 PolarHBondContact O-N 3.44Å; M263-T265 PolarHBondContact O-N 2.84Å; M263-L266 PolarHBondContact O-N 3.43Å; M263-L266 VanDerWaalsContact O-N 3.11Å; M263-V268 HydrophobicContact CB-CG2 4.08Å; M263-V268 HydrophobicContact CE-CG1 4.06Å; M263-V268 HydrophobicContact CE-CG2 4.03Å; M263-V268 HydrophobicContact CG-CG2 4.48Å; M263-L295 HydrophobicContact CB-CD2 3.98Å; M263-L295 HydrophobicContact SD-CD2 4.3Å
264	H	91.2	Very high	96.2	Very high	21 Å²	21	34 Å²	34	10%	0.097	19%	0.19	C	C	.	.	G	3₁₀ helix	trans	-63.4	-27.1	178.4	75	-84.8	0	0	0	112.6	E261 R262 L266 I269 E307 Q311	E261-H264 PolarHBondContact O-CE1 2.84Å; E261-H264 PolarHBondContact O-ND1 3.39Å; R262-H264 PolarHBondContact O-N 3.2Å; H264-L266 VanDerWaalsContact C-N 3.32Å; H264-I269 HydrophobicContact CB-CD1 4.48Å; H264-E307 IonicContact CD2-OE2 3.95Å; H264-E307 PolarHBondContact CD2-OE2 3.19Å; H264-E307 IonicContact CE1-OE2 2.62Å; H264-E307 IonicContact NE2-OE2 3.05Å; H264-E307 PolarHBondContact NE2-OE2 3.08Å; H264-E307 VanDerWaalsContact NE2-OE2 3.13Å; H264-Q311 PolarHBondContact O-NE2 3.28Å; H264-Q311 PolarHBondContact O-OE1 2.62Å
265	T	93.6	Very high	96.1	Very high	97 Å²	97	34.5 Å²	34.5	60%	0.595	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-80.4	-11.6	177.3	67.3	0	0	0	0	114	R262 M263	R262-T265 PolarHBondContact O-N 3.43Å; R262-T265 PolarHBondContact O-OG1 3.02Å; M263-T265 PolarHBondContact O-N 2.84Å
266	L	95.7	Very high	96.1	Very high	70 Å²	70	34 Å²	34	37%	0.366	19%	0.191	S	C	.	.	G	3₁₀ helix	trans	-101	5.3	-168.6	-60.5	175.5	0	0	0	113.5	M222 L227 L231 M263 H264 V268	M222-L266 HydrophobicContact CE-CD1 4.02Å; L227-L266 HydrophobicContact CD2-CB 4.36Å; L227-L266 HydrophobicContact CD2-CD1 3.6Å; L231-L266 WeakPolarHBondContact CD1-O 3.24Å; M263-L266 PolarHBondContact O-N 3.43Å; M263-L266 VanDerWaalsContact O-N 3.11Å; H264-L266 VanDerWaalsContact C-N 3.32Å; L266-V268 VanDerWaalsContact C-N 3.34Å; L266-V268 HydrophobicContact CB-CG2 4.44Å
267	G	95.2	Very high	96	Very high	31 Å²	31	38.3 Å²	38.3	32%	0.32	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.3	17.2	-179.9	0	0	0	0	0	114.4	T271	G267-T271 WeakPolarHBondContact O-CB 3.48Å; G267-T271 PolarHBondContact O-N 3.01Å; G267-T271 VanDerWaalsContact O-N 3.17Å; G267-T271 PolarHBondContact O-OG1 3.42Å
268	V	97.9	Very high	95.9	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-60.4	-49.7	176.6	176.4	0	0	0	0	110.6	L227 L231 I250 M263 L266 A270 T271 L272 L295	L227-V268 HydrophobicContact CD1-CG2 4.33Å; L227-V268 HydrophobicContact CD2-CG2 3.81Å; L227-V268 HydrophobicContact CG-CG2 4.38Å; L231-V268 HydrophobicContact CD1-CG2 4.14Å; L231-V268 HydrophobicContact CD2-CG2 4.27Å; I250-V268 HydrophobicContact CG2-CG1 3.77Å; M263-V268 HydrophobicContact CB-CG2 4.08Å; M263-V268 HydrophobicContact CE-CG1 4.06Å; M263-V268 HydrophobicContact CE-CG2 4.03Å; M263-V268 HydrophobicContact CG-CG2 4.48Å; L266-V268 VanDerWaalsContact C-N 3.34Å; L266-V268 HydrophobicContact CB-CG2 4.44Å; V268-A270 PolarHBondContact O-N 3.4Å; V268-T271 PolarHBondContact O-N 3.08Å; V268-L272 HydrophobicContact CG1-CD1 3.85Å; V268-L272 HydrophobicContact CG1-CG 4.22Å; V268-L272 WeakPolarHBondContact O-CG 3.48Å; V268-L272 PolarHBondContact O-N 2.84Å; V268-L295 HydrophobicContact CG1-CD1 4.34Å
269	I	98.2	Very high	95.8	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-61.6	-47.5	-174.9	-66.7	174.4	0	0	0	111.3	H264 T271 L272 A273 F292 L295 C308 Q311 M312	H264-I269 HydrophobicContact CB-CD1 4.48Å; I269-T271 PolarHBondContact O-N 3.05Å; I269-L272 PolarHBondContact O-N 3.14Å; I269-A273 VanDerWaalsContact O-CB 3.25Å; I269-A273 WeakPolarHBondContact O-CB 3.43Å; I269-A273 PolarHBondContact O-N 3.06Å; I269-F292 HydrophobicContact CG2-CE1 4.39Å; I269-L295 HydrophobicContact CD1-CD1 4.44Å; I269-L295 HydrophobicContact CG1-CD1 3.96Å; I269-C308 HydrophobicContact CD1-CB 3.95Å; I269-Q311 HydrophobicContact CB-CB 4.37Å; I269-Q311 HydrophobicContact CD1-CB 3.92Å; I269-Q311 HydrophobicContact CG2-CB 3.98Å; I269-M312 HydrophobicContact CD1-CE 4.15Å; I269-M312 HydrophobicContact CD1-CG 4.4Å; I269-M312 HydrophobicContact CG1-CE 4.38Å; I269-M312 HydrophobicContact CG2-CB 4.39Å; I269-M312 HydrophobicContact CG2-CG 3.63Å
270	A	96.8	Very high	95.5	Very high	39 Å²	39	47.9 Å²	47.9	32%	0.322	27%	0.267	S	S	.	.	H	α-helix	trans	-58.8	-49	177.5	0	0	0	0	0	111.7	V268 L272 A273 D274	V268-A270 PolarHBondContact O-N 3.4Å; A270-L272 PolarHBondContact O-N 3.04Å; A270-A273 PolarHBondContact O-N 2.81Å; A270-D274 PolarHBondContact O-N 3.28Å
271	T	97	Very high	95.4	Very high	29 Å²	29	52.3 Å²	52.3	18%	0.178	29%	0.286	C	S	.	.	H	α-helix	trans	-59.9	-44.2	-179.6	-54.8	0	0	0	0	112	L231 L234 G267 V268 I269 I275	L231-T271 HydrophobicContact CD2-CG2 4.09Å; L234-T271 HydrophobicContact CB-CG2 3.97Å; L234-T271 HydrophobicContact CD1-CG2 4.26Å; G267-T271 WeakPolarHBondContact O-CB 3.48Å; G267-T271 PolarHBondContact O-N 3.01Å; G267-T271 VanDerWaalsContact O-N 3.17Å; G267-T271 PolarHBondContact O-OG1 3.42Å; V268-T271 PolarHBondContact O-N 3.08Å; I269-T271 PolarHBondContact O-N 3.05Å; T271-I275 HydrophobicContact CG2-CD1 4.4Å; T271-I275 WeakPolarHBondContact O-CG1 3.28Å; T271-I275 PolarHBondContact O-N 3.11Å
272	L	98	Very high	95.2	Very high	0 Å²	0	54.3 Å²	54.3	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-71.8	-35.6	179.6	-63.7	-174.2	0	0	0	112.3	I247 I250 V268 I269 A270 I275 L276 I288 T291 F292	I247-L272 HydrophobicContact CB-CD2 4.36Å; I247-L272 HydrophobicContact CD1-CD2 3.99Å; I247-L272 HydrophobicContact CG1-CD2 3.62Å; I247-L272 HydrophobicContact CG2-CD2 3.88Å; I250-L272 HydrophobicContact CD1-CD2 4.38Å; V268-L272 HydrophobicContact CG1-CD1 3.85Å; V268-L272 HydrophobicContact CG1-CG 4.22Å; V268-L272 WeakPolarHBondContact O-CG 3.48Å; V268-L272 PolarHBondContact O-N 2.84Å; I269-L272 PolarHBondContact O-N 3.14Å; A270-L272 PolarHBondContact O-N 3.04Å; L272-I275 PolarHBondContact O-N 3.29Å; L272-L276 VanDerWaalsContact O-CB 3.29Å; L272-L276 WeakPolarHBondContact O-CB 3.49Å; L272-L276 PolarHBondContact O-N 3.06Å; L272-I288 HydrophobicContact CB-CG2 4.1Å; L272-I288 HydrophobicContact CD2-CG1 4.42Å; L272-T291 HydrophobicContact CD1-CG2 3.65Å; L272-F292 HydrophobicContact CB-CE1 3.62Å; L272-F292 HydrophobicContact CB-CZ 3.64Å; L272-F292 HydrophobicContact CD1-CD1 4.33Å; L272-F292 HydrophobicContact CD1-CE1 3.91Å; L272-F292 HydrophobicContact CG-CE1 4.37Å
273	A	97.6	Very high	95.1	Very high	5 Å²	5	49 Å²	49	4%	0.041	28%	0.277	C	S	.	.	H	α-helix	trans	-65.9	-39.2	176.9	0	0	0	0	0	111.8	I269 A270 L276 S277 F292 C315 V317	I269-A273 VanDerWaalsContact O-CB 3.25Å; I269-A273 WeakPolarHBondContact O-CB 3.43Å; I269-A273 PolarHBondContact O-N 3.06Å; A270-A273 PolarHBondContact O-N 2.81Å; A273-L276 WeakPolarHBondContact O-CB 3.46Å; A273-L276 PolarHBondContact O-N 2.86Å; A273-S277 PolarHBondContact O-N 3Å; A273-F292 HydrophobicContact CB-CZ 4.35Å; A273-C315 HydrophobicContact CB-CB 3.57Å; A273-V317 HydrophobicContact CB-CG2 3.82Å
274	D	95.9	Very high	95.1	Very high	101 Å²	101	49 Å²	49	54%	0.54	28%	0.277	S	S	.	.	H	α-helix	trans	-60.4	-49.5	174.1	-71.4	-19.9	0	0	0	110.5	A270 L276 S277 E278	A270-D274 PolarHBondContact O-N 3.28Å; D274-L276 VanDerWaalsContact C-N 3.35Å; D274-L276 PolarHBondContact O-N 3.43Å; D274-S277 PolarHBondContact O-N 3.13Å; D274-S277 VanDerWaalsContact O-N 3.16Å; D274-S277 PolarHBondContact O-OG 3.24Å; D274-E278 PolarHBondContact O-N 3.05Å
275	I	96.5	Very high	95.4	Very high	11 Å²	11	48.5 Å²	48.5	6%	0.056	28%	0.275	C	S	.	.	H	α-helix	trans	-61.4	-42.9	176.9	-62.2	168	0	0	0	111.3	L234 I247 T271 L272 S277 E278 T279 V284 I288	L234-I275 HydrophobicContact CB-CD1 4.2Å; L234-I275 HydrophobicContact CD1-CD1 4.36Å; L234-I275 HydrophobicContact CD2-CD1 3.92Å; L234-I275 HydrophobicContact CG-CD1 4.4Å; I247-I275 HydrophobicContact CD1-CD1 4.15Å; I247-I275 HydrophobicContact CD1-CG2 4.39Å; T271-I275 HydrophobicContact CG2-CD1 4.4Å; T271-I275 WeakPolarHBondContact O-CG1 3.28Å; T271-I275 PolarHBondContact O-N 3.11Å; L272-I275 PolarHBondContact O-N 3.29Å; I275-S277 PolarHBondContact O-N 2.83Å; I275-E278 PolarHBondContact O-N 3.26Å; I275-E278 VanDerWaalsContact O-N 3.17Å; I275-T279 HydrophobicContact CG2-CG2 4.48Å; I275-T279 WeakPolarHBondContact O-CB 3.24Å; I275-T279 WeakPolarHBondContact O-CG2 3.42Å; I275-T279 PolarHBondContact O-N 2.99Å; I275-V284 HydrophobicContact CG2-CG1 3.92Å; I275-I288 HydrophobicContact CB-CD1 4.11Å; I275-I288 HydrophobicContact CG2-CD1 3.79Å
276	L	96.9	Very high	95.5	Very high	10 Å²	10	45.4 Å²	45.4	5%	0.052	25%	0.252	C	S	.	.	H	α-helix	trans	-58.5	-36.6	177.8	-179.5	62.9	0	0	0	111.8	L272 A273 D274 E278 I285 I288 L289 F292 V317 A320 L324	L272-L276 VanDerWaalsContact O-CB 3.29Å; L272-L276 WeakPolarHBondContact O-CB 3.49Å; L272-L276 PolarHBondContact O-N 3.06Å; A273-L276 WeakPolarHBondContact O-CB 3.46Å; A273-L276 PolarHBondContact O-N 2.86Å; D274-L276 VanDerWaalsContact C-N 3.35Å; D274-L276 PolarHBondContact O-N 3.43Å; L276-E278 VanDerWaalsContact C-N 3.32Å; L276-I285 HydrophobicContact CD1-CB 4.37Å; L276-I285 HydrophobicContact CD1-CG1 4.31Å; L276-I285 HydrophobicContact CD1-CG2 3.78Å; L276-I288 HydrophobicContact CB-CD1 4.14Å; L276-I288 HydrophobicContact CB-CG2 4.2Å; L276-I288 HydrophobicContact CD1-CG2 4.39Å; L276-I288 HydrophobicContact CD2-CG2 4.35Å; L276-L289 HydrophobicContact CD1-CD2 4.42Å; L276-L289 HydrophobicContact CD2-CD2 4.16Å; L276-F292 HydrophobicContact CD2-CE2 4.01Å; L276-V317 HydrophobicContact CD2-CG1 4.22Å; L276-A320 HydrophobicContact CD2-CB 4Å; L276-A320 HydrophobicContact CG-CB 4.12Å; L276-L324 HydrophobicContact CD1-CD1 4.34Å
277	S	94.6	Very high	95.5	Very high	90 Å²	90	42.1 Å²	42.1	63%	0.629	24%	0.235	S	C	*	.	H	α-helix	trans	-73.1	-23.6	-179.4	79.8	0	0	0	0	113.7	A273 D274 I275	A273-S277 PolarHBondContact O-N 3Å; D274-S277 PolarHBondContact O-N 3.13Å; D274-S277 VanDerWaalsContact O-N 3.16Å; D274-S277 PolarHBondContact O-OG 3.24Å; I275-S277 PolarHBondContact O-N 2.83Å
278	E	93.1	Very high	95.6	Very high	154 Å²	154	40.6 Å²	40.6	72%	0.72	22%	0.22	S	C	*	.	H	α-helix	trans	-102.7	-31.5	-175.7	-65.5	-176.8	174.9	0	0	113.4	D274 I275 L276	D274-E278 PolarHBondContact O-N 3.05Å; I275-E278 PolarHBondContact O-N 3.26Å; I275-E278 VanDerWaalsContact O-N 3.17Å; L276-E278 VanDerWaalsContact C-N 3.32Å
279	T	93.9	Very high	95.7	Very high	21 Å²	21	40.6 Å²	40.6	13%	0.129	22%	0.22	C	C	.	.			trans	-77.4	139.3	-172.5	-168.2	0	0	0	0	112.5	I275 K281 V284 I285	I275-T279 HydrophobicContact CG2-CG2 4.48Å; I275-T279 WeakPolarHBondContact O-CB 3.24Å; I275-T279 WeakPolarHBondContact O-CG2 3.42Å; I275-T279 PolarHBondContact O-N 2.99Å; T279-K281 PolarHBondContact OG1-N 3.46Å; T279-V284 HydrophobicContact CG2-CB 4.28Å; T279-V284 HydrophobicContact CG2-CG1 4.05Å; T279-I285 HydrophobicContact CG2-CD1 4.43Å; T279-I285 HydrophobicContact CG2-CG1 3.63Å
280	T	91.9	Very high	95.6	Very high	123 Å²	123	41.3 Å²	41.3	76%	0.755	23%	0.225	S	C	*	.			trans	-106.1	1.5	169.3	67.6	0	0	0	0	112.5	E282	T280-E282 PolarHBondContact O-N 3.42Å
281	K	93.3	Very high	95.7	Very high	93 Å²	93	39.4 Å²	39.4	40%	0.404	21%	0.21	S	C	.	.			trans	-88.2	109.4	-174.2	-61.1	-57.7	-174.4	-177.3	0	109.5	F240 T279 K283 V284 I285	F240-K281 HydrophobicContact CB-CB 4.39Å; F240-K281 HydrophobicContact CB-CG 3.77Å; F240-K281 HydrophobicContact CD1-CG 4.35Å; F240-K281 HydrophobicContact CD2-CG 4.17Å; F240-K281 HydrophobicContact CG-CD 4.48Å; F240-K281 HydrophobicContact CG-CG 3.84Å; T279-K281 PolarHBondContact OG1-N 3.46Å; K281-K283 VanDerWaalsContact C-N 3.27Å; K281-K283 PolarHBondContact O-N 3.01Å; K281-V284 HydrophobicContact CB-CB 4.29Å; K281-V284 HydrophobicContact CB-CG2 3.91Å; K281-V284 WeakPolarHBondContact O-CA 3.41Å; K281-V284 WeakPolarHBondContact O-CB 3.37Å; K281-V284 PolarHBondContact O-N 3.37Å; K281-I285 PolarHBondContact O-N 2.95Å; K281-I285 VanDerWaalsContact O-N 3.1Å
282	E	92.7	Very high	95.8	Very high	89 Å²	89	38 Å²	38	42%	0.416	20%	0.202	S	C	.	.	H	α-helix	trans	-48	-47.2	-178.4	-171.4	-177.2	127.6	0	0	112.9	T280 V284 I285 R286 F334	T280-E282 PolarHBondContact O-N 3.42Å; E282-V284 PolarHBondContact O-N 3.36Å; E282-I285 CarbonylContact O-C 3.57Å; E282-I285 WeakPolarHBondContact O-CA 3.35Å; E282-I285 WeakPolarHBondContact O-CB 3.49Å; E282-I285 PolarHBondContact O-N 2.9Å; E282-R286 HydrophobicContact CG-CG 4.31Å; E282-R286 WeakPolarHBondContact O-CG 3.29Å; E282-R286 PolarHBondContact O-N 2.63Å; E282-F334 HydrophobicContact CG-CD1 4.42Å; E282-F334 HydrophobicContact CG-CE1 3.89Å; E282-F334 HydrophobicContact CG-CZ 4.46Å
283	K	92.6	Very high	95.8	Very high	44 Å²	44	40.9 Å²	40.9	19%	0.191	21%	0.212	C	C	.	.	H	α-helix	trans	-58.5	-32.9	178	73.8	179.6	-145	164.8	0	114.7	Y244 K281 I287	Y244-K283 HydrophobicContact CD2-CB 4.45Å; Y244-K283 HydrophobicContact CD2-CG 4.39Å; K281-K283 VanDerWaalsContact C-N 3.27Å; K281-K283 PolarHBondContact O-N 3.01Å; K283-I287 WeakPolarHBondContact O-CG2 3.46Å; K283-I287 PolarHBondContact O-N 2.98Å
284	V	95.6	Very high	95.8	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-75.4	-40.2	177.3	-179.5	0	0	0	0	109.1	F240 Q243 I247 I275 T279 K281 E282 I287 I288	F240-V284 HydrophobicContact CB-CG2 4.07Å; F240-V284 WeakPolarHBondContact O-CG2 3.34Å; Q243-V284 HydrophobicContact CB-CG1 4.32Å; I247-V284 HydrophobicContact CD1-CG1 4.1Å; I275-V284 HydrophobicContact CG2-CG1 3.92Å; T279-V284 HydrophobicContact CG2-CB 4.28Å; T279-V284 HydrophobicContact CG2-CG1 4.05Å; K281-V284 HydrophobicContact CB-CB 4.29Å; K281-V284 HydrophobicContact CB-CG2 3.91Å; K281-V284 WeakPolarHBondContact O-CA 3.41Å; K281-V284 WeakPolarHBondContact O-CB 3.37Å; K281-V284 PolarHBondContact O-N 3.37Å; E282-V284 PolarHBondContact O-N 3.36Å; V284-I287 WeakPolarHBondContact O-CG2 2.86Å; V284-I288 HydrophobicContact CG1-CD1 3.91Å; V284-I288 WeakPolarHBondContact O-CD1 3.46Å; V284-I288 WeakPolarHBondContact O-CG1 3.3Å; V284-I288 PolarHBondContact O-N 3.43Å; V284-I288 VanDerWaalsContact O-N 3.12Å
285	I	96.4	Very high	95.9	Very high	12 Å²	12	36.3 Å²	36.3	6%	0.062	19%	0.187	C	C	.	.	H	α-helix	trans	-60.4	-50	175.4	-59.4	170.2	0	0	0	109.8	L276 T279 K281 E282 I287 I288 L289 L324 F334	L276-I285 HydrophobicContact CD1-CB 4.37Å; L276-I285 HydrophobicContact CD1-CG1 4.31Å; L276-I285 HydrophobicContact CD1-CG2 3.78Å; T279-I285 HydrophobicContact CG2-CD1 4.43Å; T279-I285 HydrophobicContact CG2-CG1 3.63Å; K281-I285 PolarHBondContact O-N 2.95Å; K281-I285 VanDerWaalsContact O-N 3.1Å; E282-I285 CarbonylContact O-C 3.57Å; E282-I285 WeakPolarHBondContact O-CA 3.35Å; E282-I285 WeakPolarHBondContact O-CB 3.49Å; E282-I285 PolarHBondContact O-N 2.9Å; I285-I287 PolarHBondContact O-N 2.59Å; I285-I288 WeakPolarHBondContact O-CB 3.39Å; I285-I288 PolarHBondContact O-N 3.02Å; I285-I288 VanDerWaalsContact O-N 3.16Å; I285-L289 HydrophobicContact CG2-CD1 4.33Å; I285-L289 HydrophobicContact CG2-CG 4.31Å; I285-L289 WeakPolarHBondContact O-CG 3.48Å; I285-L289 PolarHBondContact O-N 3.28Å; I285-L324 HydrophobicContact CD1-CD2 4.11Å; I285-L324 HydrophobicContact CG2-CD1 3.69Å; I285-L324 HydrophobicContact CG2-CD2 4.17Å; I285-F334 HydrophobicContact CB-CZ 4.31Å; I285-F334 HydrophobicContact CG2-CE2 3.9Å; I285-F334 HydrophobicContact CG2-CZ 3.69Å
286	R	95.5	Very high	96	Very high	31 Å²	31	36.5 Å²	36.5	12%	0.117	19%	0.188	C	C	.	.	H	α-helix	trans	-51.4	-55.6	177.7	-76.4	177.2	60.3	151.9	12.2	112.5	E26 E282 I288 L289 A290 D331 F334	E26-R286 IonicContact OE2-NH2 3.89Å; E282-R286 HydrophobicContact CG-CG 4.31Å; E282-R286 WeakPolarHBondContact O-CG 3.29Å; E282-R286 PolarHBondContact O-N 2.63Å; R286-I288 VanDerWaalsContact C-N 3.27Å; R286-I288 PolarHBondContact O-N 3.31Å; R286-L289 PolarHBondContact O-N 2.84Å; R286-L289 VanDerWaalsContact O-N 3.16Å; R286-A290 WeakPolarHBondContact O-CB 3.35Å; R286-A290 PolarHBondContact O-N 2.87Å; R286-D331 IonicContact CZ-OD2 3.35Å; R286-D331 IonicContact NH1-OD2 3.59Å; R286-D331 PolarHBondContact NH1-OD2 3Å; R286-D331 IonicContact NH2-OD2 3.78Å; R286-D331 PolarHBondContact NH2-OD2 3.42Å; R286-F334 HydrophobicContact CB-CD2 4.27Å; R286-F334 HydrophobicContact CB-CE2 4.37Å; R286-F334 HydrophobicContact CG-CB 4.18Å; R286-F334 HydrophobicContact CG-CD1 3.99Å; R286-F334 HydrophobicContact CG-CD2 3.47Å; R286-F334 VanDerWaalsContact CG-CD2 3.47Å; R286-F334 HydrophobicContact CG-CE1 4.2Å; R286-F334 HydrophobicContact CG-CE2 3.69Å; R286-F334 HydrophobicContact CG-CG 3.63Å; R286-F334 HydrophobicContact CG-CZ 4.07Å
287	I	96.4	Very high	96	Very high	1 Å²	1	39.5 Å²	39.5	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-66.9	-30.2	-177.3	-164.5	63.5	0	0	0	112.2	Y244 I247 F248 W251 K283 V284 I285 T291	Y244-I287 HydrophobicContact CD2-CB 4.13Å; Y244-I287 HydrophobicContact CD2-CG2 3.76Å; Y244-I287 HydrophobicContact CE2-CB 4.1Å; Y244-I287 HydrophobicContact CE2-CG1 4.44Å; Y244-I287 HydrophobicContact CE2-CG2 4.25Å; I247-I287 HydrophobicContact CB-CG2 3.98Å; I247-I287 HydrophobicContact CG2-CB 4.4Å; I247-I287 HydrophobicContact CG2-CG1 4.05Å; I247-I287 HydrophobicContact CG2-CG2 3.77Å; F248-I287 HydrophobicContact CB-CD1 4.45Å; F248-I287 HydrophobicContact CB-CG1 4.29Å; F248-I287 HydrophobicContact CD2-CD1 4.19Å; W251-I287 HydrophobicContact CB-CD1 3.86Å; W251-I287 HydrophobicContact CB-CG1 4.31Å; W251-I287 HydrophobicContact CD2-CD1 3.69Å; W251-I287 HydrophobicContact CE3-CD1 3.86Å; W251-I287 HydrophobicContact CG-CD1 3.72Å; K283-I287 WeakPolarHBondContact O-CG2 3.46Å; K283-I287 PolarHBondContact O-N 2.98Å; V284-I287 WeakPolarHBondContact O-CG2 2.86Å; I285-I287 PolarHBondContact O-N 2.59Å; I287-T291 WeakPolarHBondContact O-CB 3.17Å; I287-T291 PolarHBondContact O-N 3.08Å; I287-T291 PolarHBondContact O-OG1 2.84Å
288	I	98.1	Very high	96	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-65.1	-48.3	172.2	-70.4	166.3	0	0	0	110.4	I247 L272 I275 L276 V284 I285 R286 T291 F292	I247-I288 HydrophobicContact CD1-CD1 4.05Å; I247-I288 HydrophobicContact CD1-CG1 3.77Å; I247-I288 HydrophobicContact CG2-CG1 4.12Å; L272-I288 HydrophobicContact CB-CG2 4.1Å; L272-I288 HydrophobicContact CD2-CG1 4.42Å; I275-I288 HydrophobicContact CB-CD1 4.11Å; I275-I288 HydrophobicContact CG2-CD1 3.79Å; L276-I288 HydrophobicContact CB-CD1 4.14Å; L276-I288 HydrophobicContact CB-CG2 4.2Å; L276-I288 HydrophobicContact CD1-CG2 4.39Å; L276-I288 HydrophobicContact CD2-CG2 4.35Å; V284-I288 HydrophobicContact CG1-CD1 3.91Å; V284-I288 WeakPolarHBondContact O-CD1 3.46Å; V284-I288 WeakPolarHBondContact O-CG1 3.3Å; V284-I288 PolarHBondContact O-N 3.43Å; V284-I288 VanDerWaalsContact O-N 3.12Å; I285-I288 WeakPolarHBondContact O-CB 3.39Å; I285-I288 PolarHBondContact O-N 3.02Å; I285-I288 VanDerWaalsContact O-N 3.16Å; R286-I288 VanDerWaalsContact C-N 3.27Å; R286-I288 PolarHBondContact O-N 3.31Å; I288-T291 WeakPolarHBondContact O-CB 3.37Å; I288-T291 PolarHBondContact O-N 3.24Å; I288-F292 HydrophobicContact CG2-CD2 3.9Å; I288-F292 HydrophobicContact CG2-CE1 4.41Å; I288-F292 HydrophobicContact CG2-CE2 3.56Å; I288-F292 HydrophobicContact CG2-CG 4.46Å; I288-F292 HydrophobicContact CG2-CZ 3.86Å; I288-F292 PolarHBondContact O-N 2.8Å
289	L	98.1	Very high	96.2	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-65.2	-43.8	-179.7	-63.2	-165.2	0	0	0	111.6	L276 I285 R286 T291 F292 R293 L321 L324 F334 D337 M338 I341	L276-L289 HydrophobicContact CD1-CD2 4.42Å; L276-L289 HydrophobicContact CD2-CD2 4.16Å; I285-L289 HydrophobicContact CG2-CD1 4.33Å; I285-L289 HydrophobicContact CG2-CG 4.31Å; I285-L289 WeakPolarHBondContact O-CG 3.48Å; I285-L289 PolarHBondContact O-N 3.28Å; R286-L289 PolarHBondContact O-N 2.84Å; R286-L289 VanDerWaalsContact O-N 3.16Å; L289-T291 PolarHBondContact O-N 3.39Å; L289-F292 HydrophobicContact CD2-CD2 4.25Å; L289-F292 CarbonylContact O-C 3.22Å; L289-F292 PolarHBondContact O-N 2.94Å; L289-R293 PolarHBondContact O-N 2.62Å; L289-L321 HydrophobicContact CD1-CD2 4.13Å; L289-L321 HydrophobicContact CD2-CD2 4Å; L289-L324 HydrophobicContact CD1-CD1 4.31Å; L289-F334 HydrophobicContact CD1-CD2 4.29Å; L289-F334 HydrophobicContact CD1-CE2 3.64Å; L289-F334 HydrophobicContact CG-CE2 4.38Å; L289-D337 HydrophobicContact CB-CB 4.32Å; L289-M338 HydrophobicContact CD1-CB 4.34Å; L289-M338 HydrophobicContact CD1-CG 3.2Å; L289-M338 HydrophobicContact CD1-SD 4.23Å; L289-I341 HydrophobicContact CB-CD1 3.78Å; L289-I341 HydrophobicContact CD2-CD1 4.02Å; L289-I341 HydrophobicContact CG-CD1 4.35Å; L289-I341 VanDerWaalsContact O-CD1 3.3Å; L289-I341 WeakPolarHBondContact O-CD1 3.2Å
290	A	97.3	Very high	96.2	Very high	14 Å²	14	37.3 Å²	37.3	12%	0.116	18%	0.181	C	C	.	.	H	α-helix	trans	-57.8	-37	173.5	0	0	0	0	0	111.9	R286 N294 D337	R286-A290 WeakPolarHBondContact O-CB 3.35Å; R286-A290 PolarHBondContact O-N 2.87Å; A290-N294 PolarHBondContact O-N 3.43Å; A290-N294 VanDerWaalsContact O-N 3.07Å; A290-D337 WeakPolarHBondContact CA-OD2 3.28Å
291	T	98.3	Very high	96.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-66.5	-45.5	173.4	-54.2	0	0	0	0	111.7	I250 W251 T254 L272 I287 I288 L289 N294 L295	I250-T291 HydrophobicContact CG2-CG2 3.83Å; W251-T291 WeakPolarHBondContact CB-OG1 3.32Å; T254-T291 HydrophobicContact CG2-CG2 3.84Å; L272-T291 HydrophobicContact CD1-CG2 3.65Å; I287-T291 WeakPolarHBondContact O-CB 3.17Å; I287-T291 PolarHBondContact O-N 3.08Å; I287-T291 PolarHBondContact O-OG1 2.84Å; I288-T291 WeakPolarHBondContact O-CB 3.37Å; I288-T291 PolarHBondContact O-N 3.24Å; L289-T291 PolarHBondContact O-N 3.39Å; T291-N294 PolarHBondContact O-N 3.49Å; T291-L295 HydrophobicContact CG2-CD1 4.39Å; T291-L295 WeakPolarHBondContact O-CG 3.44Å; T291-L295 PolarHBondContact O-N 3.43Å
292	F	98.6	Very high	96.3	Very high	0 Å²	0	35.5 Å²	35.5	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-63.3	-41.6	176.8	-72.4	-17.3	0	0	0	112.5	I269 L272 A273 L276 I288 L289 N294 L295 L296 M312 V317 I341	I269-F292 HydrophobicContact CG2-CE1 4.39Å; L272-F292 HydrophobicContact CB-CE1 3.62Å; L272-F292 HydrophobicContact CB-CZ 3.64Å; L272-F292 HydrophobicContact CD1-CD1 4.33Å; L272-F292 HydrophobicContact CD1-CE1 3.91Å; L272-F292 HydrophobicContact CG-CE1 4.37Å; A273-F292 HydrophobicContact CB-CZ 4.35Å; L276-F292 HydrophobicContact CD2-CE2 4.01Å; I288-F292 HydrophobicContact CG2-CD2 3.9Å; I288-F292 HydrophobicContact CG2-CE1 4.41Å; I288-F292 HydrophobicContact CG2-CE2 3.56Å; I288-F292 HydrophobicContact CG2-CG 4.46Å; I288-F292 HydrophobicContact CG2-CZ 3.86Å; I288-F292 PolarHBondContact O-N 2.8Å; L289-F292 HydrophobicContact CD2-CD2 4.25Å; L289-F292 CarbonylContact O-C 3.22Å; L289-F292 PolarHBondContact O-N 2.94Å; F292-N294 VanDerWaalsContact C-N 3.35Å; F292-N294 PolarHBondContact O-N 3.1Å; F292-L295 HydrophobicContact CD1-CD1 4.45Å; F292-L295 PolarHBondContact O-N 2.97Å; F292-L296 WeakPolarHBondContact O-CG 3.33Å; F292-L296 PolarHBondContact O-N 3.31Å; F292-L296 VanDerWaalsContact O-N 3.12Å; F292-M312 HydrophobicContact CB-CE 3.66Å; F292-M312 HydrophobicContact CB-SD 3.98Å; F292-M312 HydrophobicContact CD1-CE 3.61Å; F292-M312 HydrophobicContact CD1-SD 4.29Å; F292-M312 HydrophobicContact CD2-SD 4.37Å; F292-M312 HydrophobicContact CE1-CE 4.39Å; F292-M312 HydrophobicContact CG-CE 3.75Å; F292-M312 HydrophobicContact CG-SD 3.99Å; F292-V317 HydrophobicContact CD2-CG1 4.2Å; F292-V317 HydrophobicContact CE2-CG1 4.05Å; F292-V317 HydrophobicContact CE2-CG2 3.82Å; F292-V317 HydrophobicContact CZ-CG2 4.22Å; F292-I341 HydrophobicContact CB-CD1 3.96Å
293	R	98.1	Very high	96.3	Very high	59 Å²	59	35.7 Å²	35.7	22%	0.223	18%	0.175	C	C	.	.	H	α-helix	trans	-55.7	-50.8	172.2	176	173.5	-179.2	165.4	2.2	110.7	L289 L295 L296 E297 D337 Y340 I341	L289-R293 PolarHBondContact O-N 2.62Å; R293-L295 VanDerWaalsContact C-N 3.31Å; R293-L295 PolarHBondContact O-N 3.19Å; R293-L296 PolarHBondContact O-N 3.41Å; R293-E297 IonicContact CZ-OE2 3.33Å; R293-E297 IonicContact NE-OE2 3.89Å; R293-E297 PolarHBondContact NE-OE2 3.43Å; R293-E297 VanDerWaalsContact NE-OE2 3.14Å; R293-E297 IonicContact NH2-OE2 3.93Å; R293-E297 VanDerWaalsContact O-CB 3.3Å; R293-E297 WeakPolarHBondContact O-CB 3.03Å; R293-E297 PolarHBondContact O-N 3.25Å; R293-D337 WeakPolarHBondContact CD-OD1 3.41Å; R293-D337 IonicContact CZ-OD1 2.68Å; R293-D337 IonicContact NE-OD1 2.86Å; R293-D337 IonicContact NH1-OD1 3.31Å; R293-D337 PolarHBondContact NH1-OD1 3.18Å; R293-Y340 HydrophobicContact CB-CD1 4.4Å; R293-Y340 HydrophobicContact CG-CD1 3.83Å; R293-Y340 HydrophobicContact CG-CE1 3.99Å; R293-I341 HydrophobicContact CB-CD1 4.41Å; R293-I341 HydrophobicContact CB-CG1 4.3Å
294	N	98	Very high	96.4	Very high	11 Å²	11	34.8 Å²	34.8	6%	0.059	17%	0.172	C	C	.	.	H	α-helix	trans	-61	-38.5	178.6	-78	-9.5	0	0	0	112.8	W251 T254 A290 T291 F292 L296 E297 K298 P299	W251-N294 PolarHBondContact NE1-ND2 3.31Å; T254-N294 HydrophobicContact CG2-CB 4.43Å; T254-N294 WeakPolarHBondContact OG1-CB 3.44Å; T254-N294 PolarHBondContact OG1-ND2 2.98Å; A290-N294 PolarHBondContact O-N 3.43Å; A290-N294 VanDerWaalsContact O-N 3.07Å; T291-N294 PolarHBondContact O-N 3.49Å; F292-N294 VanDerWaalsContact C-N 3.35Å; F292-N294 PolarHBondContact O-N 3.1Å; N294-L296 PolarHBondContact O-N 3.42Å; N294-E297 PolarHBondContact O-N 3.32Å; N294-K298 HydrophobicContact CB-CG 4.05Å; N294-K298 VanDerWaalsContact O-CB 3.28Å; N294-K298 WeakPolarHBondContact O-CB 3.4Å; N294-K298 WeakPolarHBondContact O-CG 3.41Å; N294-K298 PolarHBondContact O-N 3.34Å; N294-P299 WeakPolarHBondContact O-CD 3.44Å
295	L	98.2	Very high	96.4	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-67.6	-18.5	176	-70	175.8	0	0	0	114	T254 A260 M263 V268 I269 T291 F292 R293 P299 C308 M312	T254-L295 HydrophobicContact CG2-CD2 3.8Å; T254-L295 HydrophobicContact CG2-CG 4.02Å; A260-L295 HydrophobicContact CB-CD2 4.45Å; M263-L295 HydrophobicContact CB-CD2 3.98Å; M263-L295 HydrophobicContact SD-CD2 4.3Å; V268-L295 HydrophobicContact CG1-CD1 4.34Å; I269-L295 HydrophobicContact CD1-CD1 4.44Å; I269-L295 HydrophobicContact CG1-CD1 3.96Å; T291-L295 HydrophobicContact CG2-CD1 4.39Å; T291-L295 WeakPolarHBondContact O-CG 3.44Å; T291-L295 PolarHBondContact O-N 3.43Å; F292-L295 HydrophobicContact CD1-CD1 4.45Å; F292-L295 PolarHBondContact O-N 2.97Å; R293-L295 VanDerWaalsContact C-N 3.31Å; R293-L295 PolarHBondContact O-N 3.19Å; L295-P299 WeakPolarHBondContact O-CG 3.35Å; L295-C308 PolarHBondContact O-SG 2.92Å; L295-C308 VanDerWaalsContact O-SG 3.41Å; L295-M312 HydrophobicContact CB-CE 4.15Å
296	L	98	Very high	96.3	Very high	14 Å²	14	39.9 Å²	39.9	7%	0.073	19%	0.193	C	C	.	.	H	α-helix	trans	-95.7	-28	175.4	-66.6	171	0	0	0	112.7	F292 R293 N294 S305 C308 A309 M312 Y340 I341 K344	F292-L296 WeakPolarHBondContact O-CG 3.33Å; F292-L296 PolarHBondContact O-N 3.31Å; F292-L296 VanDerWaalsContact O-N 3.12Å; R293-L296 PolarHBondContact O-N 3.41Å; N294-L296 PolarHBondContact O-N 3.42Å; L296-S305 WeakPolarHBondContact O-CB 3.41Å; L296-S305 PolarHBondContact O-OG 2.91Å; L296-S305 VanDerWaalsContact O-OG 3.12Å; L296-C308 HydrophobicContact CD2-CB 4.11Å; L296-A309 HydrophobicContact CD2-CB 3.74Å; L296-M312 HydrophobicContact CD1-CE 4.35Å; L296-M312 HydrophobicContact CD1-SD 4.01Å; L296-M312 HydrophobicContact CD2-CE 4.25Å; L296-M312 HydrophobicContact CD2-SD 4.29Å; L296-M312 HydrophobicContact CG-CE 4Å; L296-M312 HydrophobicContact CG-SD 4.22Å; L296-Y340 HydrophobicContact CB-CE1 4.19Å; L296-I341 HydrophobicContact CD1-CG1 4.35Å; L296-I341 HydrophobicContact CD1-CG2 4.13Å; L296-K344 HydrophobicContact CD1-CB 4.14Å
297	E	97	Very high	96.2	Very high	73 Å²	73	42.8 Å²	42.8	34%	0.341	21%	0.208	S	C	.	.	H	α-helix	trans	-101.3	-38.6	-170.7	-165.9	-166.4	121.4	0	0	113.5	R293 N294	R293-E297 IonicContact CZ-OE2 3.33Å; R293-E297 IonicContact NE-OE2 3.89Å; R293-E297 PolarHBondContact NE-OE2 3.43Å; R293-E297 VanDerWaalsContact NE-OE2 3.14Å; R293-E297 IonicContact NH2-OE2 3.93Å; R293-E297 VanDerWaalsContact O-CB 3.3Å; R293-E297 WeakPolarHBondContact O-CB 3.03Å; R293-E297 PolarHBondContact O-N 3.25Å; N294-E297 PolarHBondContact O-N 3.32Å
298	K	95.5	Very high	96.3	Very high	47 Å²	47	42.8 Å²	42.8	20%	0.204	21%	0.208	C	C	.	.	S	Bend	trans	-83.5	-32.5	-170.2	-57.3	-54.1	-178.8	-155.8	0	115.9	P257 N294 E300	P257-K298 WeakPolarHBondContact CB-O 3.37Å; N294-K298 HydrophobicContact CB-CG 4.05Å; N294-K298 VanDerWaalsContact O-CB 3.28Å; N294-K298 WeakPolarHBondContact O-CB 3.4Å; N294-K298 WeakPolarHBondContact O-CG 3.41Å; N294-K298 PolarHBondContact O-N 3.34Å; K298-E300 PolarHBondContact O-N 3.05Å
299	P	95.9	Very high	96.3	Very high	11 Å²	11	43 Å²	43	7%	0.071	21%	0.21	C	C	.	.			trans	-53.7	135.9	174	-27.4	36.1	0	0	0	111.6	E261 N294 L295 I304	E261-P299 HydrophobicContact CG-CB 3.78Å; E261-P299 HydrophobicContact CG-CG 4.47Å; N294-P299 WeakPolarHBondContact O-CD 3.44Å; L295-P299 WeakPolarHBondContact O-CG 3.35Å; P299-I304 HydrophobicContact CB-CB 4.34Å; P299-I304 HydrophobicContact CB-CG2 4.22Å; P299-I304 HydrophobicContact CG-CG2 4.35Å
300	E	94.7	Very high	96.1	Very high	162 Å²	162	44.9 Å²	44.9	76%	0.757	22%	0.22	S	C	*	.	S	Bend	trans	-80.2	-32.8	177.1	-65.1	-177	175.5	0	0	110.5	P257 E261 K298 V302	P257-E300 HydrophobicContact CB-CG 4.3Å; E261-E300 PolarHBondContact OE1-N 3.28Å; K298-E300 PolarHBondContact O-N 3.05Å; E300-V302 PolarHBondContact O-N 3.26Å
301	D	94.3	Very high	96.1	Very high	77 Å²	77	46.5 Å²	46.5	41%	0.412	23%	0.225	S	C	.	.	S	Bend	trans	-76.6	112.9	171.8	-167.2	-14.8	0	0	0	111.5	E261 E303 I304 S305	E261-D301 PolarHBondContact OE1-N 3.39Å; D301-E303 PolarHBondContact O-N 3.44Å; D301-E303 WeakPolarHBondContact OD1-CB 3.38Å; D301-E303 PolarHBondContact OD1-N 3.14Å; D301-I304 HydrophobicContact CB-CB 4.31Å; D301-I304 HydrophobicContact CB-CD1 3.87Å; D301-I304 HydrophobicContact CB-CG1 3.93Å; D301-I304 WeakPolarHBondContact O-CB 3.19Å; D301-I304 PolarHBondContact O-N 3.49Å; D301-I304 VanDerWaalsContact O-N 3.07Å; D301-S305 PolarHBondContact O-N 3.39Å
302	V	93	Very high	96.1	Very high	101 Å²	101	46.5 Å²	46.5	61%	0.612	23%	0.225	S	C	*	.	H	α-helix	trans	-60.4	-30.7	177.8	-179.6	0	0	0	0	112	E300 I304 S305 R306	E300-V302 PolarHBondContact O-N 3.26Å; V302-I304 VanDerWaalsContact C-N 3.31Å; V302-I304 PolarHBondContact O-N 3.04Å; V302-S305 PolarHBondContact O-N 3.39Å; V302-R306 WeakPolarHBondContact O-CB 3.37Å; V302-R306 PolarHBondContact O-N 2.94Å
303	E	92.8	Very high	95.9	Very high	92 Å²	92	48 Å²	48	43%	0.43	23%	0.234	S	C	.	.	H	α-helix	trans	-65.8	-37.6	176.8	-64	-56.4	137.9	0	0	111	D301 R306 E307	D301-E303 PolarHBondContact O-N 3.44Å; D301-E303 WeakPolarHBondContact OD1-CB 3.38Å; D301-E303 PolarHBondContact OD1-N 3.14Å; E303-R306 WeakPolarHBondContact O-CB 3.27Å; E303-R306 PolarHBondContact O-N 3.32Å; E303-R306 IonicContact OE1-CZ 3.48Å; E303-R306 IonicContact OE1-NH1 3.99Å; E303-R306 PolarHBondContact OE1-NH1 2.98Å; E303-R306 IonicContact OE1-NH2 3.82Å; E303-R306 IonicContact OE2-CZ 3.25Å; E303-R306 IonicContact OE2-NH1 3.92Å; E303-R306 PolarHBondContact OE2-NH1 2.9Å; E303-E307 WeakPolarHBondContact O-CG 3.06Å; E303-E307 PolarHBondContact O-N 3.48Å
304	I	95.1	Very high	95.7	Very high	25 Å²	25	51.7 Å²	51.7	13%	0.128	25%	0.254	C	S	.	.	H	α-helix	trans	-67.2	-42.5	176.4	-62.9	177.7	0	0	0	110.7	E261 P299 D301 V302 R306 E307 C308	E261-I304 HydrophobicContact CB-CD1 3.73Å; E261-I304 HydrophobicContact CG-CD1 3.69Å; E261-I304 HydrophobicContact CG-CG2 4.4Å; P299-I304 HydrophobicContact CB-CB 4.34Å; P299-I304 HydrophobicContact CB-CG2 4.22Å; P299-I304 HydrophobicContact CG-CG2 4.35Å; D301-I304 HydrophobicContact CB-CB 4.31Å; D301-I304 HydrophobicContact CB-CD1 3.87Å; D301-I304 HydrophobicContact CB-CG1 3.93Å; D301-I304 WeakPolarHBondContact O-CB 3.19Å; D301-I304 PolarHBondContact O-N 3.49Å; D301-I304 VanDerWaalsContact O-N 3.07Å; V302-I304 VanDerWaalsContact C-N 3.31Å; V302-I304 PolarHBondContact O-N 3.04Å; I304-R306 VanDerWaalsContact C-N 3.28Å; I304-R306 PolarHBondContact O-N 3.17Å; I304-E307 PolarHBondContact O-N 3Å; I304-C308 PolarHBondContact O-N 3.36Å; I304-C308 PolarHBondContact O-SG 3.28Å; I304-C308 VanDerWaalsContact O-SG 3.41Å
305	S	96	Very high	95.6	Very high	19 Å²	19	53.3 Å²	53.3	13%	0.133	27%	0.265	C	S	.	.	H	α-helix	trans	-61.3	-37.9	173.5	-66	0	0	0	0	112.1	L296 D301 V302 C308 A309	L296-S305 WeakPolarHBondContact O-CB 3.41Å; L296-S305 PolarHBondContact O-OG 2.91Å; L296-S305 VanDerWaalsContact O-OG 3.12Å; D301-S305 PolarHBondContact O-N 3.39Å; V302-S305 PolarHBondContact O-N 3.39Å; S305-C308 WeakPolarHBondContact O-CB 3.4Å; S305-C308 PolarHBondContact O-N 3.13Å; S305-A309 PolarHBondContact O-N 3.16Å
306	R	93.2	Very high	95.5	Very high	101 Å²	101	60.7 Å²	60.7	38%	0.381	30%	0.297	S	S	.	.	H	α-helix	trans	-64.2	-45.6	173.8	-176.5	-174.7	-72.6	139.9	2.2	111.1	V302 E303 I304 C308 A309 I310	V302-R306 WeakPolarHBondContact O-CB 3.37Å; V302-R306 PolarHBondContact O-N 2.94Å; E303-R306 WeakPolarHBondContact O-CB 3.27Å; E303-R306 PolarHBondContact O-N 3.32Å; E303-R306 IonicContact OE1-CZ 3.48Å; E303-R306 IonicContact OE1-NH1 3.99Å; E303-R306 PolarHBondContact OE1-NH1 2.98Å; E303-R306 IonicContact OE1-NH2 3.82Å; E303-R306 IonicContact OE2-CZ 3.25Å; E303-R306 IonicContact OE2-NH1 3.92Å; E303-R306 PolarHBondContact OE2-NH1 2.9Å; I304-R306 VanDerWaalsContact C-N 3.28Å; I304-R306 PolarHBondContact O-N 3.17Å; R306-C308 PolarHBondContact O-N 3.13Å; R306-A309 WeakPolarHBondContact O-CB 3.31Å; R306-A309 PolarHBondContact O-N 3.35Å; R306-I310 HydrophobicContact CG-CD1 4.03Å; R306-I310 WeakPolarHBondContact O-CG1 3.38Å; R306-I310 PolarHBondContact O-N 3.37Å
307	E	94.6	Very high	95.5	Very high	92 Å²	92	60.1 Å²	60.1	43%	0.43	30%	0.295	S	S	.	.	H	α-helix	trans	-60.5	-43.6	176.4	-74.6	-176.3	-174.3	0	0	111.9	H264 E303 I304 A309 I310 Q311	H264-E307 IonicContact CD2-OE2 3.95Å; H264-E307 PolarHBondContact CD2-OE2 3.19Å; H264-E307 IonicContact CE1-OE2 2.62Å; H264-E307 IonicContact NE2-OE2 3.05Å; H264-E307 PolarHBondContact NE2-OE2 3.08Å; H264-E307 VanDerWaalsContact NE2-OE2 3.13Å; E303-E307 WeakPolarHBondContact O-CG 3.06Å; E303-E307 PolarHBondContact O-N 3.48Å; I304-E307 PolarHBondContact O-N 3Å; E307-A309 VanDerWaalsContact C-N 3.34Å; E307-A309 PolarHBondContact O-N 3.32Å; E307-I310 PolarHBondContact O-N 3.42Å; E307-Q311 WeakPolarHBondContact O-CG 3.41Å; E307-Q311 PolarHBondContact O-N 3.36Å
308	C	97.3	Very high	95.4	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-54.8	-48.5	172	-76.2	0	0	0	0	111.5	I269 L295 L296 I304 S305 R306 I310 Q311 M312	I269-C308 HydrophobicContact CD1-CB 3.95Å; L295-C308 PolarHBondContact O-SG 2.92Å; L295-C308 VanDerWaalsContact O-SG 3.41Å; L296-C308 HydrophobicContact CD2-CB 4.11Å; I304-C308 PolarHBondContact O-N 3.36Å; I304-C308 PolarHBondContact O-SG 3.28Å; I304-C308 VanDerWaalsContact O-SG 3.41Å; S305-C308 WeakPolarHBondContact O-CB 3.4Å; S305-C308 PolarHBondContact O-N 3.13Å; R306-C308 PolarHBondContact O-N 3.13Å; C308-I310 PolarHBondContact O-N 3.22Å; C308-Q311 PolarHBondContact O-N 2.86Å; C308-M312 HydrophobicContact CB-CE 4.48Å; C308-M312 WeakPolarHBondContact O-CG 3.41Å; C308-M312 PolarHBondContact O-N 2.85Å
309	A	97.5	Very high	95.4	Very high	6 Å²	6	62.3 Å²	62.3	5%	0.05	31%	0.305	C	S	.	.	H	α-helix	trans	-60.8	-44.9	178.5	0	0	0	0	0	111.9	L296 S305 R306 E307 Q311 M312 V313 L345	L296-A309 HydrophobicContact CD2-CB 3.74Å; S305-A309 PolarHBondContact O-N 3.16Å; R306-A309 WeakPolarHBondContact O-CB 3.31Å; R306-A309 PolarHBondContact O-N 3.35Å; E307-A309 VanDerWaalsContact C-N 3.34Å; E307-A309 PolarHBondContact O-N 3.32Å; A309-Q311 PolarHBondContact O-N 3.13Å; A309-M312 PolarHBondContact O-N 3.32Å; A309-V313 WeakPolarHBondContact O-CG2 3.36Å; A309-V313 PolarHBondContact O-N 3.06Å; A309-L345 HydrophobicContact CB-CD2 3.85Å
310	I	93.9	Very high	95.4	Very high	38 Å²	38	62.8 Å²	62.8	20%	0.195	31%	0.31	C	S	.	.	H	α-helix	trans	-60	-45.7	177	-67.3	168.4	0	0	0	110.6	R306 E307 C308 M312 V313 Q314 L352	R306-I310 HydrophobicContact CG-CD1 4.03Å; R306-I310 WeakPolarHBondContact O-CG1 3.38Å; R306-I310 PolarHBondContact O-N 3.37Å; E307-I310 PolarHBondContact O-N 3.42Å; C308-I310 PolarHBondContact O-N 3.22Å; I310-M312 VanDerWaalsContact C-N 3.34Å; I310-M312 PolarHBondContact O-N 3.08Å; I310-V313 PolarHBondContact O-N 3.5Å; I310-Q314 HydrophobicContact CG2-CG 4.39Å; I310-Q314 VanDerWaalsContact O-CG 3.3Å; I310-Q314 WeakPolarHBondContact O-CG 3.45Å; I310-Q314 PolarHBondContact O-N 3.41Å; I310-L352 HydrophobicContact CD1-CD2 4.1Å; I310-L352 HydrophobicContact CG1-CD1 4.24Å; I310-L352 HydrophobicContact CG1-CD2 4.07Å; I310-L352 HydrophobicContact CG1-CG 4.29Å; I310-L352 HydrophobicContact CG2-CD1 4.43Å; I310-L352 HydrophobicContact CG2-CD2 4.42Å
311	Q	97.3	Very high	95.4	Very high	48 Å²	48	55 Å²	55	22%	0.224	27%	0.274	C	S	.	.	H	α-helix	trans	-60.7	-42.7	176.9	-72	-171	18.4	0	0	111.8	H264 I269 E307 C308 A309 V313 Q314 C315	H264-Q311 PolarHBondContact O-NE2 3.28Å; H264-Q311 PolarHBondContact O-OE1 2.62Å; I269-Q311 HydrophobicContact CB-CB 4.37Å; I269-Q311 HydrophobicContact CD1-CB 3.92Å; I269-Q311 HydrophobicContact CG2-CB 3.98Å; E307-Q311 WeakPolarHBondContact O-CG 3.41Å; E307-Q311 PolarHBondContact O-N 3.36Å; C308-Q311 PolarHBondContact O-N 2.86Å; A309-Q311 PolarHBondContact O-N 3.13Å; Q311-V313 PolarHBondContact O-N 2.91Å; Q311-Q314 PolarHBondContact O-N 3.26Å; Q311-C315 WeakPolarHBondContact O-CB 3.34Å; Q311-C315 PolarHBondContact O-N 3.05Å; Q311-C315 PolarHBondContact O-SG 3.34Å
312	M	98.3	Very high	95.4	Very high	0 Å²	0	55.6 Å²	55.6	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-62.7	-40.7	176.7	-70.1	178.1	-162.8	0	0	112	I269 F292 L295 L296 C308 A309 I310 C315 K316 V317 L345	I269-M312 HydrophobicContact CD1-CE 4.15Å; I269-M312 HydrophobicContact CD1-CG 4.4Å; I269-M312 HydrophobicContact CG1-CE 4.38Å; I269-M312 HydrophobicContact CG2-CB 4.39Å; I269-M312 HydrophobicContact CG2-CG 3.63Å; F292-M312 HydrophobicContact CB-CE 3.66Å; F292-M312 HydrophobicContact CB-SD 3.98Å; F292-M312 HydrophobicContact CD1-CE 3.61Å; F292-M312 HydrophobicContact CD1-SD 4.29Å; F292-M312 HydrophobicContact CD2-SD 4.37Å; F292-M312 HydrophobicContact CE1-CE 4.39Å; F292-M312 HydrophobicContact CG-CE 3.75Å; F292-M312 HydrophobicContact CG-SD 3.99Å; L295-M312 HydrophobicContact CB-CE 4.15Å; L296-M312 HydrophobicContact CD1-CE 4.35Å; L296-M312 HydrophobicContact CD1-SD 4.01Å; L296-M312 HydrophobicContact CD2-CE 4.25Å; L296-M312 HydrophobicContact CD2-SD 4.29Å; L296-M312 HydrophobicContact CG-CE 4Å; L296-M312 HydrophobicContact CG-SD 4.22Å; C308-M312 HydrophobicContact CB-CE 4.48Å; C308-M312 WeakPolarHBondContact O-CG 3.41Å; C308-M312 PolarHBondContact O-N 2.85Å; A309-M312 PolarHBondContact O-N 3.32Å; I310-M312 VanDerWaalsContact C-N 3.34Å; I310-M312 PolarHBondContact O-N 3.08Å; M312-C315 CarbonylContact O-C 3.29Å; M312-C315 PolarHBondContact O-N 3.3Å; M312-K316 PolarHBondContact O-N 3.39Å; M312-V317 HydrophobicContact CB-CB 4.11Å; M312-V317 HydrophobicContact CB-CG2 3.98Å; M312-V317 HydrophobicContact CG-CG2 4.37Å; M312-V317 WeakPolarHBondContact O-CB 3.46Å; M312-V317 WeakPolarHBondContact O-CG2 3.36Å; M312-V317 PolarHBondContact O-N 3.07Å; M312-L345 HydrophobicContact CB-CD1 3.96Å; M312-L345 HydrophobicContact CB-CD2 3.78Å; M312-L345 HydrophobicContact SD-CD2 4.08Å
313	V	95.4	Very high	95.4	Very high	32 Å²	32	56 Å²	56	19%	0.194	27%	0.274	C	S	.	.	H	α-helix	trans	-61.4	-47.6	174.2	170.9	0	0	0	0	110.7	A309 I310 Q311 C315 K316 P318 L345 V349 L352	A309-V313 WeakPolarHBondContact O-CG2 3.36Å; A309-V313 PolarHBondContact O-N 3.06Å; I310-V313 PolarHBondContact O-N 3.5Å; Q311-V313 PolarHBondContact O-N 2.91Å; V313-C315 VanDerWaalsContact C-N 3.29Å; V313-C315 PolarHBondContact O-N 2.87Å; V313-K316 PolarHBondContact O-N 3.11Å; V313-P318 HydrophobicContact CG2-CG 4.16Å; V313-L345 HydrophobicContact CG2-CB 4.3Å; V313-L345 HydrophobicContact CG2-CD2 4.31Å; V313-V349 HydrophobicContact CB-CG2 4.4Å; V313-V349 HydrophobicContact CG1-CG2 3.74Å; V313-V349 HydrophobicContact CG2-CG2 3.65Å; V313-L352 HydrophobicContact CG1-CD1 4.31Å
314	Q	93.8	Very high	95.5	Very high	137 Å²	137	52.3 Å²	52.3	64%	0.64	26%	0.258	S	S	*	.	H	α-helix	trans	-63.4	-35.6	178.6	-70.8	174.8	-4.6	0	0	112.2	I310 Q311 K316	I310-Q314 HydrophobicContact CG2-CG 4.39Å; I310-Q314 VanDerWaalsContact O-CG 3.3Å; I310-Q314 WeakPolarHBondContact O-CG 3.45Å; I310-Q314 PolarHBondContact O-N 3.41Å; Q311-Q314 PolarHBondContact O-N 3.26Å; Q314-K316 PolarHBondContact O-N 3.45Å
315	C	96.7	Very high	95.4	Very high	44 Å²	44	53.8 Å²	53.8	30%	0.297	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	11.3	173.9	-60.7	0	0	0	0	113.5	A273 Q311 M312 V313 V317	A273-C315 HydrophobicContact CB-CB 3.57Å; Q311-C315 WeakPolarHBondContact O-CB 3.34Å; Q311-C315 PolarHBondContact O-N 3.05Å; Q311-C315 PolarHBondContact O-SG 3.34Å; M312-C315 CarbonylContact O-C 3.29Å; M312-C315 PolarHBondContact O-N 3.3Å; V313-C315 VanDerWaalsContact C-N 3.29Å; V313-C315 PolarHBondContact O-N 2.87Å; C315-V317 HydrophobicContact CB-CG2 4.48Å; C315-V317 PolarHBondContact O-N 3.36Å
316	K	95.2	Very high	95.3	Very high	155 Å²	155	57.3 Å²	57.3	67%	0.674	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.3	22.4	174.7	-52.2	174.4	-175.5	166.8	0	114.7	M312 V313 Q314 P318 K319	M312-K316 PolarHBondContact O-N 3.39Å; V313-K316 PolarHBondContact O-N 3.11Å; Q314-K316 PolarHBondContact O-N 3.45Å; K316-P318 VanDerWaalsContact C-N 3.3Å; K316-K319 WeakPolarHBondContact O-CB 3.39Å; K316-K319 PolarHBondContact O-N 2.9Å
317	V	97.9	Very high	95.2	Very high	2 Å²	2	58.6 Å²	58.6	1%	0.012	30%	0.299	C	S	.	.	H	α-helix	trans	-53.7	-39.7	173.8	178.1	0	0	0	0	112.6	A273 L276 F292 M312 C315 K319 A320 L321 L345	A273-V317 HydrophobicContact CB-CG2 3.82Å; L276-V317 HydrophobicContact CD2-CG1 4.22Å; F292-V317 HydrophobicContact CD2-CG1 4.2Å; F292-V317 HydrophobicContact CE2-CG1 4.05Å; F292-V317 HydrophobicContact CE2-CG2 3.82Å; F292-V317 HydrophobicContact CZ-CG2 4.22Å; M312-V317 HydrophobicContact CB-CB 4.11Å; M312-V317 HydrophobicContact CB-CG2 3.98Å; M312-V317 HydrophobicContact CG-CG2 4.37Å; M312-V317 WeakPolarHBondContact O-CB 3.46Å; M312-V317 WeakPolarHBondContact O-CG2 3.36Å; M312-V317 PolarHBondContact O-N 3.07Å; C315-V317 HydrophobicContact CB-CG2 4.48Å; C315-V317 PolarHBondContact O-N 3.36Å; V317-K319 PolarHBondContact O-N 3.28Å; V317-K319 VanDerWaalsContact O-N 3.15Å; V317-A320 WeakPolarHBondContact O-CB 3.45Å; V317-A320 PolarHBondContact O-N 2.91Å; V317-L321 HydrophobicContact CG1-CD1 3.97Å; V317-L321 HydrophobicContact CG1-CG 4.18Å; V317-L321 PolarHBondContact O-N 3.23Å; V317-L345 HydrophobicContact CB-CD1 4.09Å; V317-L345 HydrophobicContact CG1-CD1 3.88Å
318	P	96	Very high	95	Very high	18 Å²	18	61 Å²	61	12%	0.117	32%	0.32	C	S	.	.	H	α-helix	trans	-57	-33.1	177	-27.8	35.7	0	0	0	114.2	V313 K316 L321 N322 L345	V313-P318 HydrophobicContact CG2-CG 4.16Å; K316-P318 VanDerWaalsContact C-N 3.3Å; P318-L321 PolarHBondContact O-N 3.24Å; P318-N322 VanDerWaalsContact O-CG 3.25Å; P318-N322 PolarHBondContact O-N 3.45Å; P318-N322 PolarHBondContact O-ND2 2.84Å; P318-L345 HydrophobicContact CG-CB 4.27Å; P318-L345 HydrophobicContact CG-CD1 3.91Å
319	K	94.1	Very high	94.6	Very high	148 Å²	148	63.3 Å²	63.3	64%	0.643	33%	0.329	S	S	*	.	H	α-helix	trans	-67.7	-40.1	176.9	-174.9	-177.7	176.1	-174.8	0	111.2	K316 V317 L323	K316-K319 WeakPolarHBondContact O-CB 3.39Å; K316-K319 PolarHBondContact O-N 2.9Å; V317-K319 PolarHBondContact O-N 3.28Å; V317-K319 VanDerWaalsContact O-N 3.15Å; K319-L323 PolarHBondContact O-N 3.12Å
320	A	95.4	Very high	94.2	Very high	21 Å²	21	71.3 Å²	71.3	17%	0.174	37%	0.371	C	S	.	.	H	α-helix	trans	-65.7	-45.7	175.6	0	0	0	0	0	110.8	L276 V317 N322 L323 L324	L276-A320 HydrophobicContact CD2-CB 4Å; L276-A320 HydrophobicContact CG-CB 4.12Å; V317-A320 WeakPolarHBondContact O-CB 3.45Å; V317-A320 PolarHBondContact O-N 2.91Å; A320-N322 PolarHBondContact O-N 3.35Å; A320-L323 WeakPolarHBondContact O-CB 3.26Å; A320-L323 PolarHBondContact O-N 3.08Å; A320-L323 VanDerWaalsContact O-N 3.1Å; A320-L324 WeakPolarHBondContact O-CG 3.36Å; A320-L324 PolarHBondContact O-N 2.69Å
321	L	96	Very high	94	Very high	0 Å²	0	70.9 Å²	70.9	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-58.9	-42.9	177.6	-71.5	170.3	0	0	0	112.6	L289 V317 P318 L323 L324 L325 M338 I341 N342 L345	L289-L321 HydrophobicContact CD1-CD2 4.13Å; L289-L321 HydrophobicContact CD2-CD2 4Å; V317-L321 HydrophobicContact CG1-CD1 3.97Å; V317-L321 HydrophobicContact CG1-CG 4.18Å; V317-L321 PolarHBondContact O-N 3.23Å; P318-L321 PolarHBondContact O-N 3.24Å; L321-L323 VanDerWaalsContact C-N 3.25Å; L321-L323 PolarHBondContact O-N 3.27Å; L321-L324 PolarHBondContact O-N 3.42Å; L321-L324 VanDerWaalsContact O-N 3.09Å; L321-L325 WeakPolarHBondContact O-CB 3.5Å; L321-L325 WeakPolarHBondContact O-CG 3.37Å; L321-L325 PolarHBondContact O-N 3.49Å; L321-M338 HydrophobicContact CD2-CB 4.49Å; L321-M338 HydrophobicContact CD2-CG 4.32Å; L321-I341 HydrophobicContact CD1-CB 4.15Å; L321-I341 HydrophobicContact CD1-CG2 3.61Å; L321-N342 HydrophobicContact CD1-CB 4.28Å; L321-L345 HydrophobicContact CD1-CD1 3.98Å
322	N	94	Very high	93.6	Very high	89 Å²	89	72.8 Å²	72.8	48%	0.476	39%	0.385	S	S	.	.	H	α-helix	trans	-58.8	-36.6	176.3	-73.5	-25.3	0	0	0	112.9	P318 A320 S326	P318-N322 VanDerWaalsContact O-CG 3.25Å; P318-N322 PolarHBondContact O-N 3.45Å; P318-N322 PolarHBondContact O-ND2 2.84Å; A320-N322 PolarHBondContact O-N 3.35Å; N322-S326 PolarHBondContact O-N 2.68Å
323	L	93.4	Very high	93.1	Very high	108 Å²	108	75.5 Å²	75.5	57%	0.565	40%	0.398	S	S	*	.	H	α-helix	trans	-72.8	-36.6	176.4	-66.9	172.1	0	0	0	111.7	K319 A320 L321 S326	K319-L323 PolarHBondContact O-N 3.12Å; A320-L323 WeakPolarHBondContact O-CB 3.26Å; A320-L323 PolarHBondContact O-N 3.08Å; A320-L323 VanDerWaalsContact O-N 3.1Å; L321-L323 VanDerWaalsContact C-N 3.25Å; L321-L323 PolarHBondContact O-N 3.27Å; L323-S326 PolarHBondContact O-OG 2.86Å
324	L	94.4	Very high	93	Very high	15 Å²	15	74.1 Å²	74.1	8%	0.079	39%	0.39	C	S	.	.	H	α-helix	trans	-70	-50.3	177.7	-63.9	171.4	0	0	0	111	L276 I285 L289 A320 L321 S326 K327 Y329 M338	L276-L324 HydrophobicContact CD1-CD1 4.34Å; I285-L324 HydrophobicContact CD1-CD2 4.11Å; I285-L324 HydrophobicContact CG2-CD1 3.69Å; I285-L324 HydrophobicContact CG2-CD2 4.17Å; L289-L324 HydrophobicContact CD1-CD1 4.31Å; A320-L324 WeakPolarHBondContact O-CG 3.36Å; A320-L324 PolarHBondContact O-N 2.69Å; L321-L324 PolarHBondContact O-N 3.42Å; L321-L324 VanDerWaalsContact O-N 3.09Å; L324-S326 PolarHBondContact O-N 3.31Å; L324-S326 VanDerWaalsContact O-N 3.11Å; L324-K327 WeakPolarHBondContact O-CB 3.49Å; L324-K327 PolarHBondContact O-N 3.11Å; L324-Y329 WeakPolarHBondContact CD2-OH 3.39Å; L324-Y329 WeakPolarHBondContact O-CE2 3.49Å; L324-M338 HydrophobicContact CB-SD 3.59Å; L324-M338 VanDerWaalsContact CB-SD 3.59Å; L324-M338 HydrophobicContact CD1-SD 4.42Å
325	L	93.7	Very high	93	Very high	57 Å²	57	69.3 Å²	69.3	30%	0.298	37%	0.37	S	S	.	.	H	α-helix	trans	-62.2	-18.8	178.2	-72.7	169.3	0	0	0	113.9	L321 K327 M338 E339 N342	L321-L325 WeakPolarHBondContact O-CB 3.5Å; L321-L325 WeakPolarHBondContact O-CG 3.37Å; L321-L325 PolarHBondContact O-N 3.49Å; L325-K327 PolarHBondContact O-N 3.35Å; L325-M338 HydrophobicContact CD2-CB 3.75Å; L325-M338 HydrophobicContact CG-CB 4.31Å; L325-E339 HydrophobicContact CD2-CG 4.12Å; L325-N342 HydrophobicContact CD1-CB 3.76Å
326	S	93	Very high	92.9	Very high	93 Å²	93	72.2 Å²	72.2	65%	0.65	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.4	-9.5	171.9	75.4	0	0	0	0	113.8	N322 L323 L324	N322-S326 PolarHBondContact O-N 2.68Å; L323-S326 PolarHBondContact O-OG 2.86Å; L324-S326 PolarHBondContact O-N 3.31Å; L324-S326 VanDerWaalsContact O-N 3.11Å
327	K	91.9	Very high	93	Very high	128 Å²	128	65.3 Å²	65.3	56%	0.557	35%	0.349	S	S	*	.	S	Bend	trans	-109.2	156.8	179.6	-57.6	175	-177.6	176.1	0	110.4	L324 L325 Y329	L324-K327 WeakPolarHBondContact O-CB 3.49Å; L324-K327 PolarHBondContact O-N 3.11Å; L325-K327 PolarHBondContact O-N 3.35Å; K327-Y329 HydrophobicContact CB-CE2 3.82Å
328	T	89.2	Confident	92.9	Very high	143 Å²	143	65.2 Å²	65.2	88%	0.877	35%	0.349	S	S	*	.			trans	-97.5	138	172.8	54	0	0	0	0	110.2
329	Y	89.7	Confident	92.9	Very high	47 Å²	47	69.8 Å²	69.8	18%	0.184	37%	0.368	C	S	.	.			trans	-126.2	146.2	177.3	-63.6	-86.7	0	0	0	109.9	L324 K327 D331 F334 M338	L324-Y329 WeakPolarHBondContact CD2-OH 3.39Å; L324-Y329 WeakPolarHBondContact O-CE2 3.49Å; K327-Y329 HydrophobicContact CB-CE2 3.82Å; Y329-D331 VanDerWaalsContact C-N 3.34Å; Y329-F334 AromaticContact CD1-CD1 3.84Å; Y329-F334 HydrophobicContact CD1-CD1 3.84Å; Y329-F334 AromaticContact CD1-CE1 3.51Å; Y329-F334 HydrophobicContact CD1-CE1 3.51Å; Y329-F334 HydrophobicContact CD2-CD1 4.37Å; Y329-F334 HydrophobicContact CD2-CE1 4.14Å; Y329-F334 HydrophobicContact CE1-CD1 4.34Å; Y329-F334 AromaticContact CE1-CE1 3.54Å; Y329-F334 HydrophobicContact CE1-CE1 3.54Å; Y329-F334 HydrophobicContact CE1-CZ 4.44Å; Y329-F334 HydrophobicContact CE2-CE1 4.15Å; Y329-F334 AromaticContact CG-CD1 3.84Å; Y329-F334 HydrophobicContact CG-CD1 3.84Å; Y329-F334 AromaticContact CG-CE1 3.81Å; Y329-F334 HydrophobicContact CG-CE1 3.81Å; Y329-F334 AromaticContact CZ-CE1 3.85Å; Y329-M338 HydrophobicContact CD2-CE 3.54Å; Y329-M338 HydrophobicContact CD2-SD 4.49Å; Y329-M338 HydrophobicContact CE2-CE 3.77Å; Y329-M338 HydrophobicContact CE2-SD 4.12Å; Y329-M338 HydrophobicContact CG-CE 4.3Å
330	D	88.3	Confident	93	Very high	174 Å²	174	65 Å²	65	93%	0.93	35%	0.347	S	S	*	.	S	Bend	trans	-78.7	-21.5	-179.7	-63.3	-37	0	0	0	112.4	P332	D330-P332 WeakPolarHBondContact O-CD 3.36Å
331	D	89.4	Confident	93.2	Very high	30 Å²	30	64 Å²	64	16%	0.16	34%	0.339	C	S	.	.			trans	-86.2	114	-178.4	-166.8	-44.1	0	0	0	111.1	R286 Y329 E333 F334 T335	R286-D331 IonicContact CZ-OD2 3.35Å; R286-D331 IonicContact NH1-OD2 3.59Å; R286-D331 PolarHBondContact NH1-OD2 3Å; R286-D331 IonicContact NH2-OD2 3.78Å; R286-D331 PolarHBondContact NH2-OD2 3.42Å; Y329-D331 VanDerWaalsContact C-N 3.34Å; D331-E333 WeakPolarHBondContact OD1-CB 3.45Å; D331-E333 PolarHBondContact OD1-N 3.07Å; D331-F334 HydrophobicContact CB-CB 3.95Å; D331-F334 PolarHBondContact O-N 2.78Å; D331-F334 PolarHBondContact OD1-N 3.27Å; D331-T335 PolarHBondContact O-N 2.97Å; D331-T335 PolarHBondContact O-OG1 2.85Å
332	P	90	Very high	93.2	Very high	87 Å²	87	65.7 Å²	65.7	57%	0.565	35%	0.348	S	S	*	.	H	α-helix	trans	-69.1	-38	-178.5	27.6	-33.6	0	0	0	112.5	D330 F334 T335 E336	D330-P332 WeakPolarHBondContact O-CD 3.36Å; P332-F334 VanDerWaalsContact C-N 3.26Å; P332-F334 PolarHBondContact O-N 2.98Å; P332-T335 PolarHBondContact O-N 3.46Å; P332-T335 VanDerWaalsContact O-N 3.09Å; P332-E336 WeakPolarHBondContact O-CG 3.25Å; P332-E336 PolarHBondContact O-N 2.78Å
333	E	88.5	Confident	93.4	Very high	58 Å²	58	67.3 Å²	67.3	27%	0.271	35%	0.352	S	S	.	.	H	α-helix	trans	-61.9	-40.1	179.6	-174.2	-175.4	177	0	0	110	R29 D331 T335 E336 D337	R29-E333 IonicContact CZ-OE2 3.2Å; R29-E333 IonicContact NH1-OE2 3.75Å; R29-E333 PolarHBondContact NH1-OE2 2.8Å; R29-E333 IonicContact NH2-OE1 3.29Å; R29-E333 PolarHBondContact NH2-OE1 3.36Å; R29-E333 IonicContact NH2-OE2 3.24Å; R29-E333 PolarHBondContact NH2-OE2 3.37Å; D331-E333 WeakPolarHBondContact OD1-CB 3.45Å; D331-E333 PolarHBondContact OD1-N 3.07Å; E333-T335 VanDerWaalsContact C-N 3.35Å; E333-T335 PolarHBondContact O-N 2.84Å; E333-E336 PolarHBondContact O-N 3.06Å; E333-D337 PolarHBondContact O-N 2.8Å
334	F	92.2	Very high	93.5	Very high	2 Å²	2	66.2 Å²	66.2	1%	0.009	34%	0.343	C	S	.	.	H	α-helix	trans	-64.2	-39.8	175.8	-177.9	-146.4	0	0	0	112.7	E282 I285 R286 L289 Y329 D331 P332 M338	E282-F334 HydrophobicContact CG-CD1 4.42Å; E282-F334 HydrophobicContact CG-CE1 3.89Å; E282-F334 HydrophobicContact CG-CZ 4.46Å; I285-F334 HydrophobicContact CB-CZ 4.31Å; I285-F334 HydrophobicContact CG2-CE2 3.9Å; I285-F334 HydrophobicContact CG2-CZ 3.69Å; R286-F334 HydrophobicContact CB-CD2 4.27Å; R286-F334 HydrophobicContact CB-CE2 4.37Å; R286-F334 HydrophobicContact CG-CB 4.18Å; R286-F334 HydrophobicContact CG-CD1 3.99Å; R286-F334 HydrophobicContact CG-CD2 3.47Å; R286-F334 VanDerWaalsContact CG-CD2 3.47Å; R286-F334 HydrophobicContact CG-CE1 4.2Å; R286-F334 HydrophobicContact CG-CE2 3.69Å; R286-F334 HydrophobicContact CG-CG 3.63Å; R286-F334 HydrophobicContact CG-CZ 4.07Å; L289-F334 HydrophobicContact CD1-CD2 4.29Å; L289-F334 HydrophobicContact CD1-CE2 3.64Å; L289-F334 HydrophobicContact CG-CE2 4.38Å; Y329-F334 AromaticContact CD1-CD1 3.84Å; Y329-F334 HydrophobicContact CD1-CD1 3.84Å; Y329-F334 AromaticContact CD1-CE1 3.51Å; Y329-F334 HydrophobicContact CD1-CE1 3.51Å; Y329-F334 HydrophobicContact CD2-CD1 4.37Å; Y329-F334 HydrophobicContact CD2-CE1 4.14Å; Y329-F334 HydrophobicContact CE1-CD1 4.34Å; Y329-F334 AromaticContact CE1-CE1 3.54Å; Y329-F334 HydrophobicContact CE1-CE1 3.54Å; Y329-F334 HydrophobicContact CE1-CZ 4.44Å; Y329-F334 HydrophobicContact CE2-CE1 4.15Å; Y329-F334 AromaticContact CG-CD1 3.84Å; Y329-F334 HydrophobicContact CG-CD1 3.84Å; Y329-F334 AromaticContact CG-CE1 3.81Å; Y329-F334 HydrophobicContact CG-CE1 3.81Å; Y329-F334 AromaticContact CZ-CE1 3.85Å; D331-F334 HydrophobicContact CB-CB 3.95Å; D331-F334 PolarHBondContact O-N 2.78Å; D331-F334 PolarHBondContact OD1-N 3.27Å; P332-F334 VanDerWaalsContact C-N 3.26Å; P332-F334 PolarHBondContact O-N 2.98Å; F334-M338 HydrophobicContact CD1-CE 3.9Å; F334-M338 HydrophobicContact CD2-CE 4.17Å; F334-M338 HydrophobicContact CD2-CG 4.48Å; F334-M338 HydrophobicContact CE1-CE 3.92Å; F334-M338 HydrophobicContact CE1-SD 4.42Å; F334-M338 HydrophobicContact CE2-CE 4.21Å; F334-M338 HydrophobicContact CE2-CG 4.26Å; F334-M338 HydrophobicContact CE2-SD 4.16Å; F334-M338 HydrophobicContact CG-CE 4.02Å; F334-M338 HydrophobicContact CZ-CE 4.07Å; F334-M338 HydrophobicContact CZ-SD 4.04Å; F334-M338 WeakPolarHBondContact O-CE 3.33Å; F334-M338 WeakPolarHBondContact O-CG 3.49Å; F334-M338 PolarHBondContact O-N 2.75Å; F334-M338 VanDerWaalsContact O-N 3.15Å
335	T	93.5	Very high	93.6	Very high	37 Å²	37	65.5 Å²	65.5	23%	0.227	34%	0.339	C	S	.	.	H	α-helix	trans	-69.3	-42.3	178.6	-54.2	0	0	0	0	111.3	D331 P332 E333 D337 M338 E339	D331-T335 PolarHBondContact O-N 2.97Å; D331-T335 PolarHBondContact O-OG1 2.85Å; P332-T335 PolarHBondContact O-N 3.46Å; P332-T335 VanDerWaalsContact O-N 3.09Å; E333-T335 VanDerWaalsContact C-N 3.35Å; E333-T335 PolarHBondContact O-N 2.84Å; T335-D337 VanDerWaalsContact C-N 3.35Å; T335-D337 PolarHBondContact O-N 2.97Å; T335-M338 WeakPolarHBondContact O-CB 3.41Å; T335-M338 PolarHBondContact O-N 3.34Å; T335-M338 VanDerWaalsContact O-N 3.17Å; T335-E339 HydrophobicContact CG2-CG 4.46Å; T335-E339 WeakPolarHBondContact O-CG 3.46Å; T335-E339 PolarHBondContact O-N 2.85Å
336	E	94.9	Very high	93.7	Very high	105 Å²	105	65.9 Å²	65.9	49%	0.491	34%	0.34	S	S	.	.	H	α-helix	trans	-59	-43.6	174.2	-72.8	174.5	-163.9	0	0	112	P332 E333 M338 E339 Y340	P332-E336 WeakPolarHBondContact O-CG 3.25Å; P332-E336 PolarHBondContact O-N 2.78Å; E333-E336 PolarHBondContact O-N 3.06Å; E336-M338 VanDerWaalsContact C-N 3.35Å; E336-M338 PolarHBondContact O-N 3.13Å; E336-E339 PolarHBondContact O-N 2.62Å; E336-Y340 VanDerWaalsContact O-CB 3.22Å; E336-Y340 WeakPolarHBondContact O-CB 3.26Å; E336-Y340 PolarHBondContact O-N 2.97Å
337	D	96.9	Very high	93.7	Very high	9 Å²	9	64.7 Å²	64.7	5%	0.048	33%	0.325	C	S	.	.	H	α-helix	trans	-59.4	-45.3	174.6	-78.4	-6.9	0	0	0	111.6	L289 A290 R293 E333 T335 I341	L289-D337 HydrophobicContact CB-CB 4.32Å; A290-D337 WeakPolarHBondContact CA-OD2 3.28Å; R293-D337 WeakPolarHBondContact CD-OD1 3.41Å; R293-D337 IonicContact CZ-OD1 2.68Å; R293-D337 IonicContact NE-OD1 2.86Å; R293-D337 IonicContact NH1-OD1 3.31Å; R293-D337 PolarHBondContact NH1-OD1 3.18Å; E333-D337 PolarHBondContact O-N 2.8Å; T335-D337 VanDerWaalsContact C-N 3.35Å; T335-D337 PolarHBondContact O-N 2.97Å; D337-I341 WeakPolarHBondContact O-CB 3.17Å; D337-I341 VanDerWaalsContact O-CD1 3.24Å; D337-I341 WeakPolarHBondContact O-CD1 3.34Å; D337-I341 WeakPolarHBondContact O-CG1 3.37Å; D337-I341 PolarHBondContact O-N 3.45Å
338	M	96.2	Very high	93.7	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.005	30%	0.301	C	S	.	.	H	α-helix	trans	-61.8	-46.3	178.2	-76.9	-176.2	-72	0	0	112.3	L289 L321 L324 L325 Y329 F334 T335 E336 N342	L289-M338 HydrophobicContact CD1-CB 4.34Å; L289-M338 HydrophobicContact CD1-CG 3.2Å; L289-M338 HydrophobicContact CD1-SD 4.23Å; L321-M338 HydrophobicContact CD2-CB 4.49Å; L321-M338 HydrophobicContact CD2-CG 4.32Å; L324-M338 HydrophobicContact CB-SD 3.59Å; L324-M338 VanDerWaalsContact CB-SD 3.59Å; L324-M338 HydrophobicContact CD1-SD 4.42Å; L325-M338 HydrophobicContact CD2-CB 3.75Å; L325-M338 HydrophobicContact CG-CB 4.31Å; Y329-M338 HydrophobicContact CD2-CE 3.54Å; Y329-M338 HydrophobicContact CD2-SD 4.49Å; Y329-M338 HydrophobicContact CE2-CE 3.77Å; Y329-M338 HydrophobicContact CE2-SD 4.12Å; Y329-M338 HydrophobicContact CG-CE 4.3Å; F334-M338 HydrophobicContact CD1-CE 3.9Å; F334-M338 HydrophobicContact CD2-CE 4.17Å; F334-M338 HydrophobicContact CD2-CG 4.48Å; F334-M338 HydrophobicContact CE1-CE 3.92Å; F334-M338 HydrophobicContact CE1-SD 4.42Å; F334-M338 HydrophobicContact CE2-CE 4.21Å; F334-M338 HydrophobicContact CE2-CG 4.26Å; F334-M338 HydrophobicContact CE2-SD 4.16Å; F334-M338 HydrophobicContact CG-CE 4.02Å; F334-M338 HydrophobicContact CZ-CE 4.07Å; F334-M338 HydrophobicContact CZ-SD 4.04Å; F334-M338 WeakPolarHBondContact O-CE 3.33Å; F334-M338 WeakPolarHBondContact O-CG 3.49Å; F334-M338 PolarHBondContact O-N 2.75Å; F334-M338 VanDerWaalsContact O-N 3.15Å; T335-M338 WeakPolarHBondContact O-CB 3.41Å; T335-M338 PolarHBondContact O-N 3.34Å; T335-M338 VanDerWaalsContact O-N 3.17Å; E336-M338 VanDerWaalsContact C-N 3.35Å; E336-M338 PolarHBondContact O-N 3.13Å; M338-N342 WeakPolarHBondContact O-CB 3.44Å; M338-N342 PolarHBondContact O-N 3.09Å
339	E	95.6	Very high	93.8	Very high	113 Å²	113	53.7 Å²	53.7	53%	0.528	27%	0.269	S	S	.	.	H	α-helix	trans	-65.7	-46.9	-179.3	-72.1	179.7	173.2	0	0	111.4	L325 T335 E336 I341 N342 E343	L325-E339 HydrophobicContact CD2-CG 4.12Å; T335-E339 HydrophobicContact CG2-CG 4.46Å; T335-E339 WeakPolarHBondContact O-CG 3.46Å; T335-E339 PolarHBondContact O-N 2.85Å; E336-E339 PolarHBondContact O-N 2.62Å; E339-I341 PolarHBondContact O-N 2.97Å; E339-N342 PolarHBondContact O-N 2.78Å; E339-E343 WeakPolarHBondContact O-CB 3.38Å; E339-E343 PolarHBondContact O-N 3.25Å
340	Y	97.6	Very high	93.7	Very high	49 Å²	49	56.6 Å²	56.6	19%	0.192	28%	0.284	C	S	.	.	H	α-helix	trans	-57.5	-50.7	177.7	177.8	-88	0	0	0	111.6	R293 L296 E336 N342 E343 K344	R293-Y340 HydrophobicContact CB-CD1 4.4Å; R293-Y340 HydrophobicContact CG-CD1 3.83Å; R293-Y340 HydrophobicContact CG-CE1 3.99Å; L296-Y340 HydrophobicContact CB-CE1 4.19Å; E336-Y340 VanDerWaalsContact O-CB 3.22Å; E336-Y340 WeakPolarHBondContact O-CB 3.26Å; E336-Y340 PolarHBondContact O-N 2.97Å; Y340-N342 VanDerWaalsContact C-N 3.35Å; Y340-N342 PolarHBondContact O-N 2.96Å; Y340-E343 PolarHBondContact O-N 3.26Å; Y340-K344 HydrophobicContact CD1-CG 4.32Å; Y340-K344 HydrophobicContact CE1-CG 3.9Å; Y340-K344 WeakPolarHBondContact O-CG 3.42Å; Y340-K344 PolarHBondContact O-N 3.21Å
341	I	98.2	Very high	93.8	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-64.5	-44.8	-179.9	-60.7	161.2	0	0	0	109.3	L289 F292 R293 L296 L321 D337 E339 E343 K344 L345	L289-I341 HydrophobicContact CB-CD1 3.78Å; L289-I341 HydrophobicContact CD2-CD1 4.02Å; L289-I341 HydrophobicContact CG-CD1 4.35Å; L289-I341 VanDerWaalsContact O-CD1 3.3Å; L289-I341 WeakPolarHBondContact O-CD1 3.2Å; F292-I341 HydrophobicContact CB-CD1 3.96Å; R293-I341 HydrophobicContact CB-CD1 4.41Å; R293-I341 HydrophobicContact CB-CG1 4.3Å; L296-I341 HydrophobicContact CD1-CG1 4.35Å; L296-I341 HydrophobicContact CD1-CG2 4.13Å; L321-I341 HydrophobicContact CD1-CB 4.15Å; L321-I341 HydrophobicContact CD1-CG2 3.61Å; D337-I341 WeakPolarHBondContact O-CB 3.17Å; D337-I341 VanDerWaalsContact O-CD1 3.24Å; D337-I341 WeakPolarHBondContact O-CD1 3.34Å; D337-I341 WeakPolarHBondContact O-CG1 3.37Å; D337-I341 PolarHBondContact O-N 3.45Å; E339-I341 PolarHBondContact O-N 2.97Å; I341-E343 PolarHBondContact O-N 2.91Å; I341-K344 PolarHBondContact O-N 3.48Å; I341-L345 HydrophobicContact CG2-CD1 3.86Å; I341-L345 HydrophobicContact CG2-CG 3.97Å; I341-L345 WeakPolarHBondContact O-CB 3.19Å; I341-L345 VanDerWaalsContact O-CG 3.26Å; I341-L345 WeakPolarHBondContact O-CG 3.36Å; I341-L345 PolarHBondContact O-N 3.13Å
342	N	97.1	Very high	93.7	Very high	35 Å²	35	52.9 Å²	52.9	19%	0.187	26%	0.264	C	S	.	.	H	α-helix	trans	-59.1	-46.3	179.7	-177.5	58.4	0	0	0	111.5	L321 L325 M338 E339 Y340 L345 Q346	L321-N342 HydrophobicContact CD1-CB 4.28Å; L325-N342 HydrophobicContact CD1-CB 3.76Å; M338-N342 WeakPolarHBondContact O-CB 3.44Å; M338-N342 PolarHBondContact O-N 3.09Å; E339-N342 PolarHBondContact O-N 2.78Å; Y340-N342 VanDerWaalsContact C-N 3.35Å; Y340-N342 PolarHBondContact O-N 2.96Å; N342-L345 PolarHBondContact O-N 3.39Å; N342-Q346 WeakPolarHBondContact O-CB 3.34Å; N342-Q346 VanDerWaalsContact O-CG 3.26Å; N342-Q346 WeakPolarHBondContact O-CG 3.41Å; N342-Q346 PolarHBondContact O-N 3.21Å
343	E	96.6	Very high	93.5	Very high	122 Å²	122	52.5 Å²	52.5	57%	0.57	25%	0.251	S	S	*	.	H	α-helix	trans	-57.4	-51.8	175.9	-173.8	-173.7	168.9	0	0	111.7	E339 Y340 I341 L345 Q346 I347	E339-E343 WeakPolarHBondContact O-CB 3.38Å; E339-E343 PolarHBondContact O-N 3.25Å; Y340-E343 PolarHBondContact O-N 3.26Å; I341-E343 PolarHBondContact O-N 2.91Å; E343-L345 VanDerWaalsContact C-N 3.33Å; E343-L345 PolarHBondContact O-N 3.49Å; E343-Q346 PolarHBondContact O-N 3.38Å; E343-Q346 VanDerWaalsContact O-N 3.16Å; E343-I347 HydrophobicContact CG-CD1 4.3Å; E343-I347 WeakPolarHBondContact O-CG1 3.47Å; E343-I347 PolarHBondContact O-N 3.16Å
344	K	96.8	Very high	93.5	Very high	86 Å²	86	52.7 Å²	52.7	37%	0.374	25%	0.252	S	S	.	.	H	α-helix	trans	-59.9	-41.4	179.6	-70.8	-64.4	-176.3	-176.8	0	112.7	L296 Y340 I341 I347 S348	L296-K344 HydrophobicContact CD1-CB 4.14Å; Y340-K344 HydrophobicContact CD1-CG 4.32Å; Y340-K344 HydrophobicContact CE1-CG 3.9Å; Y340-K344 WeakPolarHBondContact O-CG 3.42Å; Y340-K344 PolarHBondContact O-N 3.21Å; I341-K344 PolarHBondContact O-N 3.48Å; K344-I347 PolarHBondContact O-N 3.3Å; K344-S348 PolarHBondContact O-N 3.49Å
345	L	97.1	Very high	93.4	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-71.4	-33.5	177.6	-62.6	-169	0	0	0	112.1	A309 M312 V313 V317 P318 L321 I341 N342 E343 I347 S348 V349	A309-L345 HydrophobicContact CB-CD2 3.85Å; M312-L345 HydrophobicContact CB-CD1 3.96Å; M312-L345 HydrophobicContact CB-CD2 3.78Å; M312-L345 HydrophobicContact SD-CD2 4.08Å; V313-L345 HydrophobicContact CG2-CB 4.3Å; V313-L345 HydrophobicContact CG2-CD2 4.31Å; V317-L345 HydrophobicContact CB-CD1 4.09Å; V317-L345 HydrophobicContact CG1-CD1 3.88Å; P318-L345 HydrophobicContact CG-CB 4.27Å; P318-L345 HydrophobicContact CG-CD1 3.91Å; L321-L345 HydrophobicContact CD1-CD1 3.98Å; I341-L345 HydrophobicContact CG2-CD1 3.86Å; I341-L345 HydrophobicContact CG2-CG 3.97Å; I341-L345 WeakPolarHBondContact O-CB 3.19Å; I341-L345 VanDerWaalsContact O-CG 3.26Å; I341-L345 WeakPolarHBondContact O-CG 3.36Å; I341-L345 PolarHBondContact O-N 3.13Å; N342-L345 PolarHBondContact O-N 3.39Å; E343-L345 VanDerWaalsContact C-N 3.33Å; E343-L345 PolarHBondContact O-N 3.49Å; L345-I347 VanDerWaalsContact C-N 3.35Å; L345-S348 PolarHBondContact O-N 3.15Å; L345-V349 VanDerWaalsContact O-CG2 3.27Å; L345-V349 WeakPolarHBondContact O-CG2 3.45Å; L345-V349 PolarHBondContact O-N 3.12Å
346	Q	94.6	Very high	93.2	Very high	65 Å²	65	56.7 Å²	56.7	30%	0.304	27%	0.274	S	S	.	.	H	α-helix	trans	-64.1	-40.5	173.3	-71.8	-55.8	-35.2	0	0	111.8	N342 E343 V349 Q350	N342-Q346 WeakPolarHBondContact O-CB 3.34Å; N342-Q346 VanDerWaalsContact O-CG 3.26Å; N342-Q346 WeakPolarHBondContact O-CG 3.41Å; N342-Q346 PolarHBondContact O-N 3.21Å; E343-Q346 PolarHBondContact O-N 3.38Å; E343-Q346 VanDerWaalsContact O-N 3.16Å; Q346-V349 PolarHBondContact O-N 3.33Å; Q346-Q350 WeakPolarHBondContact O-CG 3.43Å; Q346-Q350 PolarHBondContact O-N 3.27Å
347	I	93.1	Very high	93.2	Very high	68 Å²	68	51.8 Å²	51.8	35%	0.349	25%	0.251	S	S	.	.	H	α-helix	trans	-60.4	-50.1	173.1	-65.4	166.4	0	0	0	109.6	E343 K344 L345 V349 Q350 D351	E343-I347 HydrophobicContact CG-CD1 4.3Å; E343-I347 WeakPolarHBondContact O-CG1 3.47Å; E343-I347 PolarHBondContact O-N 3.16Å; K344-I347 PolarHBondContact O-N 3.3Å; L345-I347 VanDerWaalsContact C-N 3.35Å; I347-V349 VanDerWaalsContact C-N 3.31Å; I347-V349 PolarHBondContact O-N 2.94Å; I347-Q350 WeakPolarHBondContact O-CA 3.37Å; I347-Q350 WeakPolarHBondContact O-CB 3.42Å; I347-Q350 PolarHBondContact O-N 2.88Å; I347-D351 PolarHBondContact O-N 2.87Å
348	S	92.4	Very high	93	Very high	6 Å²	6	54.4 Å²	54.4	4%	0.042	27%	0.265	C	S	.	.	H	α-helix	trans	-59.3	-38.1	177.8	-179	0	0	0	0	113.2	K344 L345 Q350 D351 L352	K344-S348 PolarHBondContact O-N 3.49Å; L345-S348 PolarHBondContact O-N 3.15Å; S348-Q350 VanDerWaalsContact C-N 3.33Å; S348-Q350 PolarHBondContact O-N 2.87Å; S348-D351 PolarHBondContact O-N 3.46Å; S348-L352 WeakPolarHBondContact O-CB 3.41Å; S348-L352 VanDerWaalsContact O-CG 3.29Å; S348-L352 WeakPolarHBondContact O-CG 3.47Å; S348-L352 PolarHBondContact O-N 3.3Å
349	V	90	Very high	92.9	Very high	34 Å²	34	59.6 Å²	59.6	21%	0.206	29%	0.29	C	S	.	.	H	α-helix	trans	-66.7	-34.1	174	169.7	0	0	0	0	112	V313 L345 Q346 I347 R353	V313-V349 HydrophobicContact CB-CG2 4.4Å; V313-V349 HydrophobicContact CG1-CG2 3.74Å; V313-V349 HydrophobicContact CG2-CG2 3.65Å; L345-V349 VanDerWaalsContact O-CG2 3.27Å; L345-V349 WeakPolarHBondContact O-CG2 3.45Å; L345-V349 PolarHBondContact O-N 3.12Å; Q346-V349 PolarHBondContact O-N 3.33Å; I347-V349 VanDerWaalsContact C-N 3.31Å; I347-V349 PolarHBondContact O-N 2.94Å; V349-R353 VanDerWaalsContact O-CG 3.31Å; V349-R353 WeakPolarHBondContact O-CG 3.43Å; V349-R353 PolarHBondContact O-N 3.05Å; V349-R353 PolarHBondContact O-NE 2.6Å
350	Q	89.3	Confident	92.9	Very high	108 Å²	108	54.2 Å²	54.2	51%	0.505	26%	0.264	S	S	.	.	H	α-helix	trans	-69.3	-45	173.9	-72	174.2	21.7	0	0	111	Q346 I347 S348 R353 Q354	Q346-Q350 WeakPolarHBondContact O-CG 3.43Å; Q346-Q350 PolarHBondContact O-N 3.27Å; I347-Q350 WeakPolarHBondContact O-CA 3.37Å; I347-Q350 WeakPolarHBondContact O-CB 3.42Å; I347-Q350 PolarHBondContact O-N 2.88Å; S348-Q350 VanDerWaalsContact C-N 3.33Å; S348-Q350 PolarHBondContact O-N 2.87Å; Q350-R353 VanDerWaalsContact CG-NH2 3.3Å; Q350-R353 WeakPolarHBondContact O-CB 3.42Å; Q350-R353 PolarHBondContact O-N 3.31Å; Q350-R353 VanDerWaalsContact O-N 3.17Å; Q350-Q354 PolarHBondContact O-N 3.35Å
351	D	89.2	Confident	92.9	Very high	64 Å²	64	53.4 Å²	53.4	34%	0.342	26%	0.263	S	S	.	.	H	α-helix	trans	-59.7	-49.1	177.4	-66.9	-13	0	0	0	111	I347 S348 R353 Q354 D355	I347-D351 PolarHBondContact O-N 2.87Å; S348-D351 PolarHBondContact O-N 3.46Å; D351-R353 VanDerWaalsContact C-N 3.25Å; D351-R353 PolarHBondContact O-N 3.01Å; D351-Q354 CarbonylContact O-C 3.58Å; D351-Q354 WeakPolarHBondContact O-CA 3.28Å; D351-Q354 WeakPolarHBondContact O-CB 3.47Å; D351-Q354 PolarHBondContact O-N 3.19Å; D351-D355 VanDerWaalsContact O-CG 3.32Å; D351-D355 PolarHBondContact O-N 3.07Å
352	L	87.1	Confident	92.7	Very high	61 Å²	61	58.1 Å²	58.1	32%	0.319	29%	0.292	S	S	.	.	H	α-helix	trans	-58.4	-36.8	176.3	-74	172.6	0	0	0	112.9	I310 V313 S348 S356	I310-L352 HydrophobicContact CD1-CD2 4.1Å; I310-L352 HydrophobicContact CG1-CD1 4.24Å; I310-L352 HydrophobicContact CG1-CD2 4.07Å; I310-L352 HydrophobicContact CG1-CG 4.29Å; I310-L352 HydrophobicContact CG2-CD1 4.43Å; I310-L352 HydrophobicContact CG2-CD2 4.42Å; V313-L352 HydrophobicContact CG1-CD1 4.31Å; S348-L352 WeakPolarHBondContact O-CB 3.41Å; S348-L352 VanDerWaalsContact O-CG 3.29Å; S348-L352 WeakPolarHBondContact O-CG 3.47Å; S348-L352 PolarHBondContact O-N 3.3Å; L352-S356 PolarHBondContact O-N 3.36Å
353	R	86.1	Confident	92.7	Very high	79 Å²	79	57.3 Å²	57.3	30%	0.298	29%	0.287	S	S	.	.	H	α-helix	trans	-69.4	-40.7	175	-77.9	-176.2	-68.3	169.1	-3.7	111.1	V349 Q350 D351 S356 L357	V349-R353 VanDerWaalsContact O-CG 3.31Å; V349-R353 WeakPolarHBondContact O-CG 3.43Å; V349-R353 PolarHBondContact O-N 3.05Å; V349-R353 PolarHBondContact O-NE 2.6Å; Q350-R353 VanDerWaalsContact CG-NH2 3.3Å; Q350-R353 WeakPolarHBondContact O-CB 3.42Å; Q350-R353 PolarHBondContact O-N 3.31Å; Q350-R353 VanDerWaalsContact O-N 3.17Å; D351-R353 VanDerWaalsContact C-N 3.25Å; D351-R353 PolarHBondContact O-N 3.01Å; R353-S356 PolarHBondContact O-N 3.41Å; R353-S356 PolarHBondContact O-OG 3.23Å; R353-L357 PolarHBondContact O-N 2.69Å; R353-L357 VanDerWaalsContact O-N 3.14Å
354	Q	88.8	Confident	92.7	Very high	62 Å²	62	51.6 Å²	51.6	29%	0.29	26%	0.26	S	S	.	.	H	α-helix	trans	-61.2	-48.9	175.9	-177.2	56.8	33.9	0	0	111.1	Q350 D351 S356 L357 D358	Q350-Q354 PolarHBondContact O-N 3.35Å; D351-Q354 CarbonylContact O-C 3.58Å; D351-Q354 WeakPolarHBondContact O-CA 3.28Å; D351-Q354 WeakPolarHBondContact O-CB 3.47Å; D351-Q354 PolarHBondContact O-N 3.19Å; Q354-S356 VanDerWaalsContact C-N 3.3Å; Q354-S356 PolarHBondContact O-N 2.81Å; Q354-L357 PolarHBondContact O-N 3.47Å; Q354-D358 PolarHBondContact NE2-OD1 3.46Å; Q354-D358 PolarHBondContact NE2-OD2 3.33Å; Q354-D358 PolarHBondContact O-N 2.9Å
355	D	89.2	Confident	92.6	Very high	96 Å²	96	53.1 Å²	53.1	51%	0.513	27%	0.267	S	S	.	.	H	α-helix	trans	-57.1	-43.6	177.9	-66.9	-23.5	0	0	0	111.5	D351 L357 D358 E359	D351-D355 VanDerWaalsContact O-CG 3.32Å; D351-D355 PolarHBondContact O-N 3.07Å; D355-L357 VanDerWaalsContact C-N 3.32Å; D355-L357 PolarHBondContact O-N 3.27Å; D355-D358 PolarHBondContact O-N 3.45Å; D355-E359 WeakPolarHBondContact O-CB 3.36Å; D355-E359 PolarHBondContact O-N 2.92Å
356	S	90.6	Very high	92.5	Very high	28 Å²	28	56.4 Å²	56.4	20%	0.196	29%	0.29	C	S	.	.	H	α-helix	trans	-64.3	-34.7	177.3	74.5	0	0	0	0	113.2	L352 R353 Q354 Y360 V374	L352-S356 PolarHBondContact O-N 3.36Å; R353-S356 PolarHBondContact O-N 3.41Å; R353-S356 PolarHBondContact O-OG 3.23Å; Q354-S356 VanDerWaalsContact C-N 3.3Å; Q354-S356 PolarHBondContact O-N 2.81Å; S356-Y360 PolarHBondContact O-N 3.22Å; S356-V374 WeakPolarHBondContact O-CG1 3.4Å
357	L	93.9	Very high	92.5	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-74.2	-38.5	175.5	-178.7	63.5	0	0	0	111	R353 Q354 D355 E359 Y360 I361 F380 N384 R387 F388 I395	R353-L357 PolarHBondContact O-N 2.69Å; R353-L357 VanDerWaalsContact O-N 3.14Å; Q354-L357 PolarHBondContact O-N 3.47Å; D355-L357 VanDerWaalsContact C-N 3.32Å; D355-L357 PolarHBondContact O-N 3.27Å; L357-E359 VanDerWaalsContact C-N 3.35Å; L357-Y360 HydrophobicContact CD1-CD1 4.47Å; L357-Y360 WeakPolarHBondContact O-CB 3.27Å; L357-Y360 PolarHBondContact O-N 3.48Å; L357-I361 HydrophobicContact CD1-CD1 4.2Å; L357-I361 HydrophobicContact CD1-CG1 4.27Å; L357-I361 HydrophobicContact CD2-CD1 4.23Å; L357-I361 HydrophobicContact CG-CD1 3.78Å; L357-I361 HydrophobicContact CG-CG1 4.27Å; L357-I361 WeakPolarHBondContact O-CB 3.29Å; L357-I361 VanDerWaalsContact O-CG1 3.27Å; L357-I361 WeakPolarHBondContact O-CG1 3.2Å; L357-I361 PolarHBondContact O-N 3.12Å; L357-F380 HydrophobicContact CD1-CZ 4.26Å; L357-N384 HydrophobicContact CD1-CB 4.26Å; L357-R387 HydrophobicContact CD2-CB 4.06Å; L357-R387 VanDerWaalsContact CD2-NH1 3.32Å; L357-F388 HydrophobicContact CD1-CE2 4.06Å; L357-I395 HydrophobicContact CD1-CD1 4.26Å
358	D	93.8	Very high	92.5	Very high	65 Å²	65	61.2 Å²	61.2	35%	0.348	31%	0.31	S	S	.	.	H	α-helix	trans	-68.6	-35.1	178.5	-71.8	-26.4	0	0	0	111.7	Q354 D355 I361 T362	Q354-D358 PolarHBondContact NE2-OD1 3.46Å; Q354-D358 PolarHBondContact NE2-OD2 3.33Å; Q354-D358 PolarHBondContact O-N 2.9Å; D355-D358 PolarHBondContact O-N 3.45Å; D358-I361 PolarHBondContact O-N 3.33Å; D358-T362 VanDerWaalsContact O-CB 3.25Å; D358-T362 WeakPolarHBondContact O-CB 3.46Å; D358-T362 PolarHBondContact O-N 3.45Å; D358-T362 PolarHBondContact O-OG1 2.95Å
359	E	93	Very high	92.7	Very high	110 Å²	110	61 Å²	61	51%	0.514	31%	0.309	S	S	.	.	H	α-helix	trans	-57.6	-51.5	168.1	-174.4	-178.6	-174.2	0	0	110.5	D355 L357 I361 T362 E363	D355-E359 WeakPolarHBondContact O-CB 3.36Å; D355-E359 PolarHBondContact O-N 2.92Å; L357-E359 VanDerWaalsContact C-N 3.35Å; E359-I361 PolarHBondContact O-N 3.16Å; E359-T362 PolarHBondContact O-N 3.24Å; E359-E363 WeakPolarHBondContact O-CB 3.34Å; E359-E363 PolarHBondContact O-N 2.83Å
360	Y	97.1	Very high	92.9	Very high	0 Å²	0	65 Å²	65	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-57.7	-47.7	176.5	178.2	-86.8	0	0	0	112.4	S356 L357 T362 E363 L364 V374 H375 F380 W381 F388 I395 D418	S356-Y360 PolarHBondContact O-N 3.22Å; L357-Y360 HydrophobicContact CD1-CD1 4.47Å; L357-Y360 WeakPolarHBondContact O-CB 3.27Å; L357-Y360 PolarHBondContact O-N 3.48Å; Y360-T362 VanDerWaalsContact C-N 3.32Å; Y360-T362 PolarHBondContact O-N 2.96Å; Y360-E363 PolarHBondContact O-N 3.39Å; Y360-L364 HydrophobicContact CE1-CB 4.41Å; Y360-L364 HydrophobicContact CE1-CD2 3.98Å; Y360-L364 WeakPolarHBondContact O-CB 3.38Å; Y360-L364 PolarHBondContact O-N 2.89Å; Y360-V374 HydrophobicContact CD2-CB 4.05Å; Y360-V374 HydrophobicContact CD2-CG2 3.8Å; Y360-V374 HydrophobicContact CG-CG2 4.46Å; Y360-H375 AromaticContact CD2-CE1 3.69Å; Y360-H375 AromaticContact CE2-CE1 3.27Å; Y360-H375 WeakPolarHBondContact CE2-CE1 3.25Å; Y360-H375 AromaticContact CE2-ND1 3.56Å; Y360-F380 HydrophobicContact CD1-CZ 4.3Å; Y360-F380 AromaticContact CD2-CE1 3.99Å; Y360-F380 HydrophobicContact CD2-CE1 3.99Å; Y360-F380 AromaticContact CD2-CZ 3.68Å; Y360-F380 HydrophobicContact CD2-CZ 3.68Å; Y360-F380 HydrophobicContact CE2-CE1 4.34Å; Y360-F380 HydrophobicContact CE2-CZ 4.4Å; Y360-F380 HydrophobicContact CG-CE1 4.36Å; Y360-F380 HydrophobicContact CG-CE2 4.42Å; Y360-F380 AromaticContact CG-CZ 3.64Å; Y360-F380 HydrophobicContact CG-CZ 3.64Å; Y360-W381 HydrophobicContact CE2-CH2 4.37Å; Y360-F388 HydrophobicContact CD1-CE2 4.37Å; Y360-F388 AromaticContact CD1-CZ 3.91Å; Y360-F388 HydrophobicContact CD1-CZ 3.91Å; Y360-F388 AromaticContact CE1-CE1 3.75Å; Y360-F388 HydrophobicContact CE1-CE1 3.75Å; Y360-F388 HydrophobicContact CE1-CE2 4.13Å; Y360-F388 AromaticContact CE1-CZ 3.29Å; Y360-F388 HydrophobicContact CE1-CZ 3.29Å; Y360-F388 HydrophobicContact CE2-CZ 4.1Å; Y360-F388 AromaticContact CZ-CE1 3.75Å; Y360-F388 AromaticContact CZ-CZ 3.44Å; Y360-F388 VanDerWaalsContact CZ-CZ 3.44Å; Y360-I395 HydrophobicContact CE1-CG2 3.75Å; Y360-D418 WeakPolarHBondContact CE2-OD2 3.31Å; Y360-D418 PolarHBondContact OH-OD2 2.86Å
361	I	96	Very high	93.3	Very high	32 Å²	32	63.4 Å²	63.4	16%	0.164	32%	0.315	C	S	.	.	H	α-helix	trans	-64.9	-38.8	-179.4	-70.4	169.3	0	0	0	110.6	L357 D358 E359 L364 K365 I395	L357-I361 HydrophobicContact CD1-CD1 4.2Å; L357-I361 HydrophobicContact CD1-CG1 4.27Å; L357-I361 HydrophobicContact CD2-CD1 4.23Å; L357-I361 HydrophobicContact CG-CD1 3.78Å; L357-I361 HydrophobicContact CG-CG1 4.27Å; L357-I361 WeakPolarHBondContact O-CB 3.29Å; L357-I361 VanDerWaalsContact O-CG1 3.27Å; L357-I361 WeakPolarHBondContact O-CG1 3.2Å; L357-I361 PolarHBondContact O-N 3.12Å; D358-I361 PolarHBondContact O-N 3.33Å; E359-I361 PolarHBondContact O-N 3.16Å; I361-L364 PolarHBondContact O-N 2.68Å; I361-K365 HydrophobicContact CG2-CD 3.87Å; I361-K365 HydrophobicContact CG2-CG 4.33Å; I361-K365 WeakPolarHBondContact O-CB 3.4Å; I361-K365 VanDerWaalsContact O-CG 3.29Å; I361-K365 WeakPolarHBondContact O-CG 3.41Å; I361-K365 PolarHBondContact O-N 3.2Å; I361-I395 HydrophobicContact CD1-CD1 3.92Å; I361-I395 HydrophobicContact CG1-CD1 3.81Å; I361-I395 HydrophobicContact CG1-CG1 4.27Å
362	T	95.5	Very high	93.4	Very high	98 Å²	98	61 Å²	61	60%	0.601	30%	0.303	S	S	*	.	H	α-helix	trans	-65.8	-46.3	177.9	-60.2	0	0	0	0	110.7	D358 E359 Y360 K365 S366	D358-T362 VanDerWaalsContact O-CB 3.25Å; D358-T362 WeakPolarHBondContact O-CB 3.46Å; D358-T362 PolarHBondContact O-N 3.45Å; D358-T362 PolarHBondContact O-OG1 2.95Å; E359-T362 PolarHBondContact O-N 3.24Å; Y360-T362 VanDerWaalsContact C-N 3.32Å; Y360-T362 PolarHBondContact O-N 2.96Å; T362-K365 PolarHBondContact O-N 3.34Å; T362-S366 PolarHBondContact O-N 3.29Å
363	E	96.6	Very high	93.6	Very high	19 Å²	19	62.1 Å²	62.1	9%	0.089	31%	0.314	C	S	.	.	H	α-helix	trans	-58.1	-49.4	174	-171.7	178.7	179.6	0	0	111	E359 Y360 K365 S366 G367 L369 Q370 S372 H375	E359-E363 WeakPolarHBondContact O-CB 3.34Å; E359-E363 PolarHBondContact O-N 2.83Å; Y360-E363 PolarHBondContact O-N 3.39Å; E363-K365 PolarHBondContact O-N 3.06Å; E363-S366 WeakPolarHBondContact O-CB 3.41Å; E363-S366 PolarHBondContact O-N 3.33Å; E363-S366 PolarHBondContact O-OG 3.32Å; E363-G367 PolarHBondContact O-N 2.79Å; E363-L369 HydrophobicContact CG-CD2 4.15Å; E363-Q370 WeakPolarHBondContact OE1-CG 3.46Å; E363-Q370 PolarHBondContact OE1-N 3.21Å; E363-Q370 VanDerWaalsContact OE1-O 3.06Å; E363-S372 PolarHBondContact OE2-OG 3.37Å; E363-H375 IonicContact OE1-CD2 2.97Å; E363-H375 IonicContact OE1-NE2 3.05Å; E363-H375 PolarHBondContact OE1-NE2 3.24Å; E363-H375 IonicContact OE2-CD2 2.73Å; E363-H375 IonicContact OE2-NE2 3.05Å; E363-H375 PolarHBondContact OE2-NE2 3.48Å
364	L	97.1	Very high	93.9	Very high	2 Å²	2	58.7 Å²	58.7	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-59.3	-46.7	178.7	-178.5	69.3	0	0	0	112.6	Y360 I361 S366 G367 L369 I395 I398 L399 I402	Y360-L364 HydrophobicContact CE1-CB 4.41Å; Y360-L364 HydrophobicContact CE1-CD2 3.98Å; Y360-L364 WeakPolarHBondContact O-CB 3.38Å; Y360-L364 PolarHBondContact O-N 2.89Å; I361-L364 PolarHBondContact O-N 2.68Å; L364-S366 VanDerWaalsContact C-N 3.27Å; L364-S366 PolarHBondContact O-N 3.29Å; L364-G367 PolarHBondContact O-N 3.38Å; L364-G367 VanDerWaalsContact O-N 3.13Å; L364-L369 HydrophobicContact CB-CD2 4.33Å; L364-L369 HydrophobicContact CD1-CD1 4.31Å; L364-L369 HydrophobicContact CD1-CD2 4.07Å; L364-I395 HydrophobicContact CD2-CB 4.33Å; L364-I395 HydrophobicContact CD2-CG2 3.72Å; L364-I398 HydrophobicContact CD1-CG2 3.99Å; L364-I398 HydrophobicContact CD2-CB 4.05Å; L364-I398 HydrophobicContact CD2-CG2 4.07Å; L364-I398 HydrophobicContact CG-CB 4.2Å; L364-I398 HydrophobicContact CG-CG2 3.66Å; L364-L399 HydrophobicContact CD1-CD2 3.51Å; L364-L399 HydrophobicContact CD1-CG 3.77Å; L364-L399 HydrophobicContact CD2-CG 4.48Å; L364-I402 HydrophobicContact CD1-CD1 3.53Å; L364-I402 HydrophobicContact CG-CD1 4.43Å
365	K	95.2	Very high	94.3	Very high	117 Å²	117	55.7 Å²	55.7	51%	0.509	29%	0.287	S	S	.	.	H	α-helix	trans	-68.1	-26.2	179.7	-76.4	179.8	176	-177	0	112.9	I361 T362 E363 G367 E394 I398	I361-K365 HydrophobicContact CG2-CD 3.87Å; I361-K365 HydrophobicContact CG2-CG 4.33Å; I361-K365 WeakPolarHBondContact O-CB 3.4Å; I361-K365 VanDerWaalsContact O-CG 3.29Å; I361-K365 WeakPolarHBondContact O-CG 3.41Å; I361-K365 PolarHBondContact O-N 3.2Å; T362-K365 PolarHBondContact O-N 3.34Å; E363-K365 PolarHBondContact O-N 3.06Å; K365-G367 PolarHBondContact O-N 3.4Å; K365-E394 IonicContact NZ-OE1 3.7Å; K365-E394 PolarHBondContact NZ-OE1 2.7Å; K365-I398 HydrophobicContact CG-CD1 4.2Å
366	S	94.4	Very high	94.4	Very high	69 Å²	69	57.5 Å²	57.5	48%	0.483	29%	0.291	S	S	.	.	H	α-helix	trans	-69.8	-21	174	83.1	0	0	0	0	113	T362 E363 L364 R368	T362-S366 PolarHBondContact O-N 3.29Å; E363-S366 WeakPolarHBondContact O-CB 3.41Å; E363-S366 PolarHBondContact O-N 3.33Å; E363-S366 PolarHBondContact O-OG 3.32Å; L364-S366 VanDerWaalsContact C-N 3.27Å; L364-S366 PolarHBondContact O-N 3.29Å; S366-R368 PolarHBondContact O-N 3.42Å; S366-R368 PolarHBondContact OG-N 3.29Å; S366-R368 VanDerWaalsContact OG-N 3.1Å
367	G	93.6	Very high	94.4	Very high	30 Å²	30	61.6 Å²	61.6	31%	0.309	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.1	1.4	-173	0	0	0	0	0	114.5	E363 L364 K365 L369	E363-G367 PolarHBondContact O-N 2.79Å; L364-G367 PolarHBondContact O-N 3.38Å; L364-G367 VanDerWaalsContact O-N 3.13Å; K365-G367 PolarHBondContact O-N 3.4Å; G367-L369 PolarHBondContact O-N 2.93Å
368	R	93.3	Very high	94.4	Very high	204 Å²	204	65.8 Å²	65.8	77%	0.77	33%	0.328	S	S	*	.			trans	-101.6	56.8	-179.4	-60.3	-174.1	-178.3	-157.7	0.2	111.3	S366 Q370	S366-R368 PolarHBondContact O-N 3.42Å; S366-R368 PolarHBondContact OG-N 3.29Å; S366-R368 VanDerWaalsContact OG-N 3.1Å; R368-Q370 PolarHBondContact O-N 2.85Å
369	L	96.6	Very high	94.2	Very high	2 Å²	2	69 Å²	69	1%	0.01	34%	0.339	C	S	.	.			trans	-60.2	131.9	177.5	-65.5	176.4	0	0	0	110.9	E363 L364 G367 L399 I402 V411 V414 A415	E363-L369 HydrophobicContact CG-CD2 4.15Å; L364-L369 HydrophobicContact CB-CD2 4.33Å; L364-L369 HydrophobicContact CD1-CD1 4.31Å; L364-L369 HydrophobicContact CD1-CD2 4.07Å; G367-L369 PolarHBondContact O-N 2.93Å; L369-L399 HydrophobicContact CD1-CD2 4.31Å; L369-I402 HydrophobicContact CD1-CD1 4.01Å; L369-I402 HydrophobicContact CD1-CG2 4.29Å; L369-I402 HydrophobicContact CG-CD1 4.4Å; L369-V411 HydrophobicContact CB-CG1 4.17Å; L369-V411 HydrophobicContact CB-CG2 4.44Å; L369-V411 HydrophobicContact CD1-CG1 4.25Å; L369-V411 HydrophobicContact CG-CG1 4.38Å; L369-V414 HydrophobicContact CB-CB 3.94Å; L369-V414 HydrophobicContact CB-CG1 3.9Å; L369-V414 HydrophobicContact CD1-CB 4.4Å; L369-V414 HydrophobicContact CD1-CG1 4.23Å; L369-V414 HydrophobicContact CG-CG1 4.48Å; L369-A415 HydrophobicContact CD1-CB 3.75Å
370	Q	95.3	Very high	94.3	Very high	119 Å²	119	64.3 Å²	64.3	56%	0.556	32%	0.316	S	S	*	.			trans	-136.7	164.5	177.4	55.4	173	6.5	0	0	110	E363 R368 S372 H375	E363-Q370 WeakPolarHBondContact OE1-CG 3.46Å; E363-Q370 PolarHBondContact OE1-N 3.21Å; E363-Q370 VanDerWaalsContact OE1-O 3.06Å; R368-Q370 PolarHBondContact O-N 2.85Å; Q370-S372 VanDerWaalsContact C-N 3.32Å; Q370-S372 PolarHBondContact O-N 3.4Å; Q370-H375 PolarHBondContact O-CD2 2.81Å
371	W	96.8	Very high	94.2	Very high	74 Å²	74	64.3 Å²	64.3	28%	0.28	32%	0.317	S	S	.	.			trans	-77.1	77	-177.3	-79.5	125.5	0	0	0	112.9	H375 K376 L410 C413 V414 H417 H456	W371-H375 HydrophobicContact CE3-CB 3.98Å; W371-H375 HydrophobicContact CZ3-CB 4.07Å; W371-K376 HydrophobicContact CE3-CG 4.27Å; W371-K376 WeakPolarHBondContact O-CE 3.41Å; W371-K376 PolarHBondContact O-NZ 3.21Å; W371-K376 VanDerWaalsContact O-NZ 3.07Å; W371-L410 VanDerWaalsContact CD1-CD1 3.43Å; W371-L410 HydrophobicContact CG-CD1 4.42Å; W371-C413 HydrophobicContact CZ2-CB 4.16Å; W371-V414 HydrophobicContact CD2-CG2 3.69Å; W371-V414 HydrophobicContact CE3-CG2 4.01Å; W371-V414 HydrophobicContact CG-CG2 4.14Å; W371-V414 HydrophobicContact CH2-CG2 4.22Å; W371-V414 HydrophobicContact CZ2-CG2 3.91Å; W371-V414 HydrophobicContact CZ3-CG2 4.26Å; W371-H417 HydrophobicContact CH2-CB 3.59Å; W371-H417 AromaticContact CH2-CD2 3.98Å; W371-H417 AromaticContact CH2-CG 3.54Å; W371-H417 AromaticContact CH2-ND1 3.92Å; W371-H417 HydrophobicContact CZ3-CB 4.27Å; W371-H417 AromaticContact CZ3-CG 3.86Å; W371-H417 AromaticContact CZ3-ND1 3.74Å; W371-H456 AromaticContact CH2-CE1 3.65Å; W371-H456 AromaticContact CH2-ND1 3.92Å; W371-H456 AromaticContact CZ2-CE1 3.36Å; W371-H456 WeakPolarHBondContact CZ2-CE1 3.37Å; W371-H456 AromaticContact CZ2-ND1 3.86Å; W371-H456 AromaticContact CZ2-NE2 3.61Å
372	S	92.2	Very high	94.1	Very high	13 Å²	13	69.2 Å²	69.2	9%	0.091	34%	0.337	C	S	.	.			trans	-96.1	170.2	176.7	69.3	0	0	0	0	112.8	E363 Q370 V374 H375 K376	E363-S372 PolarHBondContact OE2-OG 3.37Å; Q370-S372 VanDerWaalsContact C-N 3.32Å; Q370-S372 PolarHBondContact O-N 3.4Å; S372-V374 VanDerWaalsContact C-N 3.25Å; S372-V374 PolarHBondContact O-N 3.15Å; S372-V374 WeakPolarHBondContact OG-CG2 3.29Å; S372-H375 PolarHBondContact O-N 3.31Å; S372-H375 PolarHBondContact OG-CD2 3.45Å; S372-K376 PolarHBondContact O-N 3.07Å
373	P	89.9	Confident	93.8	Very high	85 Å²	85	67.7 Å²	67.7	55%	0.552	32%	0.323	S	S	*	.	H	α-helix	trans	-56.1	-33.7	178.7	-27.8	36.8	0	0	0	114.5	H375 K376 M377	P373-H375 PolarHBondContact O-N 3.22Å; P373-K376 PolarHBondContact O-N 3.22Å; P373-M377 HydrophobicContact CB-CG 4.17Å; P373-M377 VanDerWaalsContact O-CB 3.23Å; P373-M377 WeakPolarHBondContact O-CB 3.35Å; P373-M377 VanDerWaalsContact O-CG 3.27Å; P373-M377 WeakPolarHBondContact O-CG 3.42Å; P373-M377 PolarHBondContact O-N 3.05Å
374	V	94.1	Very high	93.7	Very high	6 Å²	6	66.9 Å²	66.9	4%	0.036	32%	0.319	C	S	.	.	H	α-helix	trans	-63.6	-25.8	179.2	-64.4	0	0	0	0	112.7	S356 Y360 S372 F380	S356-V374 WeakPolarHBondContact O-CG1 3.4Å; Y360-V374 HydrophobicContact CD2-CB 4.05Å; Y360-V374 HydrophobicContact CD2-CG2 3.8Å; Y360-V374 HydrophobicContact CG-CG2 4.46Å; S372-V374 VanDerWaalsContact C-N 3.25Å; S372-V374 PolarHBondContact O-N 3.15Å; S372-V374 WeakPolarHBondContact OG-CG2 3.29Å; V374-F380 HydrophobicContact CB-CD2 3.95Å; V374-F380 HydrophobicContact CB-CE2 3.9Å; V374-F380 HydrophobicContact CB-CG 4.28Å; V374-F380 HydrophobicContact CB-CZ 4.19Å; V374-F380 HydrophobicContact CG1-CD2 3.92Å; V374-F380 HydrophobicContact CG1-CE2 3.94Å; V374-F380 WeakPolarHBondContact O-CD1 3.49Å; V374-F380 WeakPolarHBondContact O-CE1 3.33Å; V374-F380 WeakPolarHBondContact O-CG 3.43Å
375	H	95.6	Very high	93.6	Very high	0 Å²	0	67 Å²	67	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-86.3	-32.1	174.7	-60.2	-69.6	0	0	0	113	Y360 E363 Q370 W371 S372 P373 W381 V414 H417 D418	Y360-H375 AromaticContact CD2-CE1 3.69Å; Y360-H375 AromaticContact CE2-CE1 3.27Å; Y360-H375 WeakPolarHBondContact CE2-CE1 3.25Å; Y360-H375 AromaticContact CE2-ND1 3.56Å; E363-H375 IonicContact OE1-CD2 2.97Å; E363-H375 IonicContact OE1-NE2 3.05Å; E363-H375 PolarHBondContact OE1-NE2 3.24Å; E363-H375 IonicContact OE2-CD2 2.73Å; E363-H375 IonicContact OE2-NE2 3.05Å; E363-H375 PolarHBondContact OE2-NE2 3.48Å; Q370-H375 PolarHBondContact O-CD2 2.81Å; W371-H375 HydrophobicContact CE3-CB 3.98Å; W371-H375 HydrophobicContact CZ3-CB 4.07Å; S372-H375 PolarHBondContact O-N 3.31Å; S372-H375 PolarHBondContact OG-CD2 3.45Å; P373-H375 PolarHBondContact O-N 3.22Å; H375-W381 PolarHBondContact O-NE1 3.27Å; H375-V414 HydrophobicContact CB-CG1 4.34Å; H375-V414 WeakPolarHBondContact ND1-CG1 3.42Å; H375-H417 PolarHBondContact O-CE1 3.4Å; H375-D418 IonicContact CE1-OD2 2.68Å; H375-D418 PolarHBondContact CE1-OD2 3.38Å; H375-D418 IonicContact CG-OD1 3.07Å; H375-D418 IonicContact ND1-OD1 3.14Å; H375-D418 PolarHBondContact ND1-OD1 2.71Å; H375-D418 IonicContact ND1-OD2 3.97Å; H375-D418 PolarHBondContact ND1-OD2 2.95Å
376	K	92.2	Very high	93.5	Very high	133 Å²	133	68.6 Å²	68.6	58%	0.578	33%	0.329	S	S	*	.	H	α-helix	trans	-94.4	-30.4	-170.3	-64.4	179.2	-174.9	165.1	0	114.5	W371 S372 P373 E378	W371-K376 HydrophobicContact CE3-CG 4.27Å; W371-K376 WeakPolarHBondContact O-CE 3.41Å; W371-K376 PolarHBondContact O-NZ 3.21Å; W371-K376 VanDerWaalsContact O-NZ 3.07Å; S372-K376 PolarHBondContact O-N 3.07Å; P373-K376 PolarHBondContact O-N 3.22Å; K376-E378 PolarHBondContact O-N 3.48Å
377	M	91.4	Very high	93.5	Very high	115 Å²	115	68 Å²	68	57%	0.567	32%	0.316	S	S	*	.			trans	-81.4	117.3	-171.2	-72.2	-96.9	157.3	0	0	110.9	P373 K379 F380	P373-M377 HydrophobicContact CB-CG 4.17Å; P373-M377 VanDerWaalsContact O-CB 3.23Å; P373-M377 WeakPolarHBondContact O-CB 3.35Å; P373-M377 VanDerWaalsContact O-CG 3.27Å; P373-M377 WeakPolarHBondContact O-CG 3.42Å; P373-M377 PolarHBondContact O-N 3.05Å; M377-K379 PolarHBondContact O-N 2.92Å; M377-K379 VanDerWaalsContact O-N 3.15Å; M377-F380 HydrophobicContact CB-CB 4.42Å; M377-F380 WeakPolarHBondContact O-CB 3.36Å; M377-F380 PolarHBondContact O-N 3.34Å
378	E	92.8	Very high	93.7	Very high	88 Å²	88	66.6 Å²	66.6	41%	0.411	30%	0.302	S	S	.	.	H	α-helix	trans	-56.7	-31.8	174.9	-169	-176.8	161.1	0	0	112.3	K376 F380 W381 K382 H425	K376-E378 PolarHBondContact O-N 3.48Å; E378-F380 VanDerWaalsContact C-N 3.35Å; E378-F380 PolarHBondContact O-N 3.44Å; E378-W381 PolarHBondContact O-N 3.19Å; E378-K382 HydrophobicContact CG-CD 4.38Å; E378-K382 WeakPolarHBondContact O-CG 3.12Å; E378-K382 PolarHBondContact O-N 3.48Å; E378-K382 WeakPolarHBondContact OE1-CE 3.29Å; E378-K382 IonicContact OE1-NZ 2.67Å; E378-K382 PolarHBondContact OE1-NZ 3.23Å; E378-H425 WeakPolarHBondContact CG-NE2 3.33Å
379	K	89.8	Confident	93.8	Very high	134 Å²	134	58.3 Å²	58.3	58%	0.583	27%	0.273	S	S	*	.	H	α-helix	trans	-58	-44.5	175.9	-176.5	-178.6	173.7	-169.5	0	112.1	M377 W381 K382 E383	M377-K379 PolarHBondContact O-N 2.92Å; M377-K379 VanDerWaalsContact O-N 3.15Å; K379-W381 VanDerWaalsContact C-N 3.32Å; K379-W381 PolarHBondContact O-N 2.84Å; K379-K382 PolarHBondContact O-N 3.18Å; K379-E383 WeakPolarHBondContact CE-OE1 3.31Å; K379-E383 HydrophobicContact CG-CG 4.46Å; K379-E383 WeakPolarHBondContact CG-OE1 3.43Å; K379-E383 IonicContact NZ-OE1 3.4Å; K379-E383 WeakPolarHBondContact O-CB 3.45Å; K379-E383 VanDerWaalsContact O-CG 3.32Å; K379-E383 WeakPolarHBondContact O-CG 3.22Å; K379-E383 PolarHBondContact O-N 2.89Å
380	F	94.7	Very high	93.7	Very high	10 Å²	10	62.5 Å²	62.5	4%	0.044	29%	0.292	C	S	.	.	H	α-helix	trans	-57.5	-47.7	178.2	169.6	-91.1	0	0	0	110.8	L357 Y360 V374 M377 E378 E383 N384 F388	L357-F380 HydrophobicContact CD1-CZ 4.26Å; Y360-F380 HydrophobicContact CD1-CZ 4.3Å; Y360-F380 AromaticContact CD2-CE1 3.99Å; Y360-F380 HydrophobicContact CD2-CE1 3.99Å; Y360-F380 AromaticContact CD2-CZ 3.68Å; Y360-F380 HydrophobicContact CD2-CZ 3.68Å; Y360-F380 HydrophobicContact CE2-CE1 4.34Å; Y360-F380 HydrophobicContact CE2-CZ 4.4Å; Y360-F380 HydrophobicContact CG-CE1 4.36Å; Y360-F380 HydrophobicContact CG-CE2 4.42Å; Y360-F380 AromaticContact CG-CZ 3.64Å; Y360-F380 HydrophobicContact CG-CZ 3.64Å; V374-F380 HydrophobicContact CB-CD2 3.95Å; V374-F380 HydrophobicContact CB-CE2 3.9Å; V374-F380 HydrophobicContact CB-CG 4.28Å; V374-F380 HydrophobicContact CB-CZ 4.19Å; V374-F380 HydrophobicContact CG1-CD2 3.92Å; V374-F380 HydrophobicContact CG1-CE2 3.94Å; V374-F380 WeakPolarHBondContact O-CD1 3.49Å; V374-F380 WeakPolarHBondContact O-CE1 3.33Å; V374-F380 WeakPolarHBondContact O-CG 3.43Å; M377-F380 HydrophobicContact CB-CB 4.42Å; M377-F380 WeakPolarHBondContact O-CB 3.36Å; M377-F380 PolarHBondContact O-N 3.34Å; E378-F380 VanDerWaalsContact C-N 3.35Å; E378-F380 PolarHBondContact O-N 3.44Å; F380-E383 PolarHBondContact O-N 3.37Å; F380-N384 VanDerWaalsContact CD2-ND2 3.26Å; F380-N384 WeakPolarHBondContact CD2-ND2 3.25Å; F380-N384 HydrophobicContact CE1-CB 4.46Å; F380-N384 HydrophobicContact CE2-CB 4.25Å; F380-N384 WeakPolarHBondContact CE2-ND2 3.4Å; F380-N384 HydrophobicContact CZ-CB 4.2Å; F380-N384 VanDerWaalsContact O-CB 3.32Å; F380-N384 WeakPolarHBondContact O-CB 3.32Å; F380-N384 PolarHBondContact O-N 3.33Å; F380-N384 PolarHBondContact O-ND2 3.44Å; F380-F388 HydrophobicContact CE1-CE2 4.22Å; F380-F388 HydrophobicContact CE1-CZ 4.16Å; F380-F388 HydrophobicContact CZ-CE2 4.22Å; F380-F388 HydrophobicContact CZ-CZ 4.38Å
381	W	95.7	Very high	93.6	Very high	1 Å²	1	64.2 Å²	64.2	0%	0.004	30%	0.298	C	S	.	.	H	α-helix	trans	-69	-39.6	-178.1	-65.8	102.7	0	0	0	112.8	Y360 H375 E378 K379 E383 A385 F388 D418 E421 H425	Y360-W381 HydrophobicContact CE2-CH2 4.37Å; H375-W381 PolarHBondContact O-NE1 3.27Å; E378-W381 PolarHBondContact O-N 3.19Å; K379-W381 VanDerWaalsContact C-N 3.32Å; K379-W381 PolarHBondContact O-N 2.84Å; W381-E383 PolarHBondContact O-N 2.81Å; W381-A385 WeakPolarHBondContact O-CB 3.41Å; W381-A385 PolarHBondContact O-N 2.86Å; W381-F388 HydrophobicContact CE3-CZ 4.39Å; W381-F388 AromaticContact CH2-CE1 3.8Å; W381-F388 HydrophobicContact CH2-CE1 3.8Å; W381-F388 AromaticContact CH2-CZ 3.8Å; W381-F388 HydrophobicContact CH2-CZ 3.8Å; W381-F388 HydrophobicContact CZ3-CD1 4.26Å; W381-F388 AromaticContact CZ3-CE1 3.5Å; W381-F388 HydrophobicContact CZ3-CE1 3.5Å; W381-F388 VanDerWaalsContact CZ3-CE1 3.5Å; W381-F388 HydrophobicContact CZ3-CE2 4.29Å; W381-F388 AromaticContact CZ3-CZ 3.51Å; W381-F388 HydrophobicContact CZ3-CZ 3.51Å; W381-D418 HydrophobicContact CH2-CB 3.66Å; W381-D418 WeakPolarHBondContact CH2-O 3.45Å; W381-D418 HydrophobicContact CZ2-CB 3.97Å; W381-D418 WeakPolarHBondContact CZ2-OD1 3.36Å; W381-E421 HydrophobicContact CD2-CB 3.49Å; W381-E421 VanDerWaalsContact CD2-CB 3.49Å; W381-E421 HydrophobicContact CD2-CG 4.39Å; W381-E421 VanDerWaalsContact CE2-CB 3.42Å; W381-E421 HydrophobicContact CE3-CB 3.86Å; W381-E421 HydrophobicContact CG-CB 3.95Å; W381-E421 HydrophobicContact CH2-CB 4.14Å; W381-E421 HydrophobicContact CZ2-CB 3.78Å; W381-E421 HydrophobicContact CZ2-CG 4.47Å; W381-E421 HydrophobicContact CZ3-CB 4.16Å; W381-H425 HydrophobicContact CB-CB 4.19Å; W381-H425 VanDerWaalsContact CB-CE1 3.49Å; W381-H425 WeakPolarHBondContact CB-CE1 3.18Å; W381-H425 WeakPolarHBondContact CB-ND1 3.41Å; W381-H425 AromaticContact CG-ND1 3.97Å
382	K	92.7	Very high	93.5	Very high	135 Å²	135	66 Å²	66	59%	0.587	31%	0.313	S	S	*	.	H	α-helix	trans	-58	-37.2	172.4	-76.7	178.9	178.4	164.9	0	112.5	E378 K379	E378-K382 HydrophobicContact CG-CD 4.38Å; E378-K382 WeakPolarHBondContact O-CG 3.12Å; E378-K382 PolarHBondContact O-N 3.48Å; E378-K382 WeakPolarHBondContact OE1-CE 3.29Å; E378-K382 IonicContact OE1-NZ 2.67Å; E378-K382 PolarHBondContact OE1-NZ 3.23Å; K379-K382 PolarHBondContact O-N 3.18Å
383	E	90.2	Very high	93.7	Very high	66 Å²	66	68 Å²	68	31%	0.308	32%	0.32	S	S	.	.	H	α-helix	trans	-84.9	-35.6	-176.4	-69.9	173.2	168.7	0	0	112.8	K379 F380 W381	K379-E383 WeakPolarHBondContact CE-OE1 3.31Å; K379-E383 HydrophobicContact CG-CG 4.46Å; K379-E383 WeakPolarHBondContact CG-OE1 3.43Å; K379-E383 IonicContact NZ-OE1 3.4Å; K379-E383 WeakPolarHBondContact O-CB 3.45Å; K379-E383 VanDerWaalsContact O-CG 3.32Å; K379-E383 WeakPolarHBondContact O-CG 3.22Å; K379-E383 PolarHBondContact O-N 2.89Å; F380-E383 PolarHBondContact O-N 3.37Å; W381-E383 PolarHBondContact O-N 2.81Å
384	N	94.3	Very high	94	Very high	2 Å²	2	66.9 Å²	66.9	1%	0.011	31%	0.308	C	S	.	.	H	α-helix	trans	-113.8	-13	-167.9	-66.4	-56.8	0	0	0	115.2	L357 F380 Q386 R387 F388	L357-N384 HydrophobicContact CD1-CB 4.26Å; F380-N384 VanDerWaalsContact CD2-ND2 3.26Å; F380-N384 WeakPolarHBondContact CD2-ND2 3.25Å; F380-N384 HydrophobicContact CE1-CB 4.46Å; F380-N384 HydrophobicContact CE2-CB 4.25Å; F380-N384 WeakPolarHBondContact CE2-ND2 3.4Å; F380-N384 HydrophobicContact CZ-CB 4.2Å; F380-N384 VanDerWaalsContact O-CB 3.32Å; F380-N384 WeakPolarHBondContact O-CB 3.32Å; F380-N384 PolarHBondContact O-N 3.33Å; F380-N384 PolarHBondContact O-ND2 3.44Å; N384-Q386 PolarHBondContact O-N 3.02Å; N384-Q386 VanDerWaalsContact O-N 3.12Å; N384-R387 WeakPolarHBondContact O-CA 3.49Å; N384-R387 VanDerWaalsContact O-CB 3.29Å; N384-R387 WeakPolarHBondContact O-CB 3.11Å; N384-R387 PolarHBondContact O-N 3.32Å; N384-F388 WeakPolarHBondContact O-CD2 3.33Å; N384-F388 PolarHBondContact O-N 3.47Å
385	A	94.7	Very high	94.2	Very high	3 Å²	3	67.2 Å²	67.2	3%	0.025	31%	0.309	C	S	.	.	G	3₁₀ helix	trans	-58.7	-32.6	-175.2	0	0	0	0	0	113.4	W381 R387 F388 Y422 H425	W381-A385 WeakPolarHBondContact O-CB 3.41Å; W381-A385 PolarHBondContact O-N 2.86Å; A385-R387 VanDerWaalsContact C-N 3.28Å; A385-R387 PolarHBondContact O-N 3.09Å; A385-F388 WeakPolarHBondContact O-CB 3.19Å; A385-F388 PolarHBondContact O-N 3.41Å; A385-Y422 WeakPolarHBondContact O-CE2 3.41Å; A385-H425 HydrophobicContact CB-CB 3.59Å
386	Q	94.3	Very high	94.3	Very high	152 Å²	152	67.2 Å²	67.2	71%	0.71	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-66.6	-30.8	174.7	-174.7	171.8	-8.6	0	0	112.6	N384 F388 N389	N384-Q386 PolarHBondContact O-N 3.02Å; N384-Q386 VanDerWaalsContact O-N 3.12Å; Q386-F388 VanDerWaalsContact C-N 3.28Å; Q386-F388 PolarHBondContact O-N 3.13Å; Q386-N389 WeakPolarHBondContact O-CB 3.48Å; Q386-N389 PolarHBondContact O-N 2.9Å; Q386-N389 PolarHBondContact O-ND2 3.37Å
387	R	94	Very high	94.6	Very high	56 Å²	56	64.6 Å²	64.6	21%	0.211	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-74.9	-17	-179.3	-56.1	-173.6	63.6	-168.1	-0.6	113	L357 N384 A385 N389 E390	L357-R387 HydrophobicContact CD2-CB 4.06Å; L357-R387 VanDerWaalsContact CD2-NH1 3.32Å; N384-R387 WeakPolarHBondContact O-CA 3.49Å; N384-R387 VanDerWaalsContact O-CB 3.29Å; N384-R387 WeakPolarHBondContact O-CB 3.11Å; N384-R387 PolarHBondContact O-N 3.32Å; A385-R387 VanDerWaalsContact C-N 3.28Å; A385-R387 PolarHBondContact O-N 3.09Å; R387-N389 PolarHBondContact O-N 3.25Å; R387-E390 HydrophobicContact CB-CG 4.46Å; R387-E390 VanDerWaalsContact CB-OE1 3.3Å; R387-E390 WeakPolarHBondContact CB-OE1 3.41Å; R387-E390 WeakPolarHBondContact CG-OE1 3.31Å; R387-E390 IonicContact CZ-OE1 3.7Å; R387-E390 IonicContact NE-OE1 2.62Å; R387-E390 PolarHBondContact NE-OE1 3.2Å; R387-E390 IonicContact NH2-OE1 3.95Å; R387-E390 IonicContact NH2-OE2 3.74Å; R387-E390 VanDerWaalsContact O-CB 3.23Å; R387-E390 WeakPolarHBondContact O-CB 3.41Å; R387-E390 VanDerWaalsContact O-CG 3.27Å; R387-E390 WeakPolarHBondContact O-CG 3.25Å; R387-E390 PolarHBondContact O-N 3.2Å
388	F	96.7	Very high	94.9	Very high	0 Å²	0	61 Å²	61	0%	0	28%	0.28	C	S	.	.	G	3₁₀ helix	trans	-63.7	-13.3	172.1	-80.1	-136.1	0	0	0	112.8	L357 Y360 F380 W381 N384 A385 Q386 I395 V396 L399 Y422	L357-F388 HydrophobicContact CD1-CE2 4.06Å; Y360-F388 HydrophobicContact CD1-CE2 4.37Å; Y360-F388 AromaticContact CD1-CZ 3.91Å; Y360-F388 HydrophobicContact CD1-CZ 3.91Å; Y360-F388 AromaticContact CE1-CE1 3.75Å; Y360-F388 HydrophobicContact CE1-CE1 3.75Å; Y360-F388 HydrophobicContact CE1-CE2 4.13Å; Y360-F388 AromaticContact CE1-CZ 3.29Å; Y360-F388 HydrophobicContact CE1-CZ 3.29Å; Y360-F388 HydrophobicContact CE2-CZ 4.1Å; Y360-F388 AromaticContact CZ-CE1 3.75Å; Y360-F388 AromaticContact CZ-CZ 3.44Å; Y360-F388 VanDerWaalsContact CZ-CZ 3.44Å; F380-F388 HydrophobicContact CE1-CE2 4.22Å; F380-F388 HydrophobicContact CE1-CZ 4.16Å; F380-F388 HydrophobicContact CZ-CE2 4.22Å; F380-F388 HydrophobicContact CZ-CZ 4.38Å; W381-F388 HydrophobicContact CE3-CZ 4.39Å; W381-F388 AromaticContact CH2-CE1 3.8Å; W381-F388 HydrophobicContact CH2-CE1 3.8Å; W381-F388 AromaticContact CH2-CZ 3.8Å; W381-F388 HydrophobicContact CH2-CZ 3.8Å; W381-F388 HydrophobicContact CZ3-CD1 4.26Å; W381-F388 AromaticContact CZ3-CE1 3.5Å; W381-F388 HydrophobicContact CZ3-CE1 3.5Å; W381-F388 VanDerWaalsContact CZ3-CE1 3.5Å; W381-F388 HydrophobicContact CZ3-CE2 4.29Å; W381-F388 AromaticContact CZ3-CZ 3.51Å; W381-F388 HydrophobicContact CZ3-CZ 3.51Å; N384-F388 WeakPolarHBondContact O-CD2 3.33Å; N384-F388 PolarHBondContact O-N 3.47Å; A385-F388 WeakPolarHBondContact O-CB 3.19Å; A385-F388 PolarHBondContact O-N 3.41Å; Q386-F388 VanDerWaalsContact C-N 3.28Å; Q386-F388 PolarHBondContact O-N 3.13Å; F388-I395 HydrophobicContact CB-CB 4.49Å; F388-I395 HydrophobicContact CB-CG2 4.45Å; F388-I395 HydrophobicContact CD1-CB 4.17Å; F388-I395 HydrophobicContact CD1-CG2 3.29Å; F388-I395 HydrophobicContact CD2-CD1 4.09Å; F388-I395 HydrophobicContact CD2-CG2 4.23Å; F388-I395 HydrophobicContact CE1-CG2 3.37Å; F388-I395 HydrophobicContact CE2-CD1 4.39Å; F388-I395 HydrophobicContact CE2-CG2 4.3Å; F388-I395 HydrophobicContact CG-CB 4.25Å; F388-I395 HydrophobicContact CG-CD1 4.35Å; F388-I395 HydrophobicContact CG-CG2 3.74Å; F388-I395 HydrophobicContact CZ-CG2 3.9Å; F388-V396 HydrophobicContact CB-CG2 4.2Å; F388-V396 HydrophobicContact CD1-CG2 4.49Å; F388-L399 HydrophobicContact CE1-CD1 4.19Å; F388-Y422 HydrophobicContact CB-CD2 3.68Å; F388-Y422 HydrophobicContact CB-CE2 3.67Å; F388-Y422 HydrophobicContact CD1-CD2 4.06Å; F388-Y422 HydrophobicContact CD1-CG 4.43Å; F388-Y422 HydrophobicContact CG-CD2 4.11Å
389	N	95.8	Very high	95.1	Very high	30 Å²	30	56.8 Å²	56.8	16%	0.16	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-85.4	-13.5	175	-52.5	-47.7	0	0	0	113.3	Q386 R387 F393 Y422 Y426	Q386-N389 WeakPolarHBondContact O-CB 3.48Å; Q386-N389 PolarHBondContact O-N 2.9Å; Q386-N389 PolarHBondContact O-ND2 3.37Å; R387-N389 PolarHBondContact O-N 3.25Å; N389-F393 HydrophobicContact CB-CD1 3.94Å; N389-F393 HydrophobicContact CB-CE1 3.73Å; N389-F393 PolarHBondContact O-N 2.91Å; N389-F393 WeakPolarHBondContact OD1-CD1 3.29Å; N389-F393 VanDerWaalsContact OD1-CE1 3.27Å; N389-F393 WeakPolarHBondContact OD1-CE1 3.2Å; N389-Y422 PolarHBondContact OD1-OH 3.43Å; N389-Y426 WeakPolarHBondContact ND2-CE1 3.4Å
390	E	94.1	Very high	95.5	Very high	91 Å²	91	51.2 Å²	51.2	43%	0.425	24%	0.237	S	C	.	.	H	α-helix	trans	-60.5	158	178.7	-66.5	172.7	-162.3	0	0	111.1	R387 N392 F393 E394	R387-E390 HydrophobicContact CB-CG 4.46Å; R387-E390 VanDerWaalsContact CB-OE1 3.3Å; R387-E390 WeakPolarHBondContact CB-OE1 3.41Å; R387-E390 WeakPolarHBondContact CG-OE1 3.31Å; R387-E390 IonicContact CZ-OE1 3.7Å; R387-E390 IonicContact NE-OE1 2.62Å; R387-E390 PolarHBondContact NE-OE1 3.2Å; R387-E390 IonicContact NH2-OE1 3.95Å; R387-E390 IonicContact NH2-OE2 3.74Å; R387-E390 VanDerWaalsContact O-CB 3.23Å; R387-E390 WeakPolarHBondContact O-CB 3.41Å; R387-E390 VanDerWaalsContact O-CG 3.27Å; R387-E390 WeakPolarHBondContact O-CG 3.25Å; R387-E390 PolarHBondContact O-N 3.2Å; E390-N392 PolarHBondContact O-N 3.31Å; E390-N392 VanDerWaalsContact O-N 3.16Å; E390-F393 PolarHBondContact O-N 3.45Å; E390-F393 VanDerWaalsContact O-N 3.1Å; E390-E394 PolarHBondContact O-N 3.36Å
391	K	94.3	Very high	95.5	Very high	155 Å²	155	57.4 Å²	57.4	67%	0.674	26%	0.264	S	S	*	.	H	α-helix	trans	50.7	41.6	178.6	-60.5	175.3	-178.7	172.8	0	113.4	E394	K391-E394 HydrophobicContact CB-CB 3.94Å; K391-E394 WeakPolarHBondContact CD-OE2 3.28Å; K391-E394 PolarHBondContact O-N 2.98Å
392	N	94.5	Very high	95.6	Very high	111 Å²	111	58 Å²	58	59%	0.594	27%	0.267	S	S	*	.	H	α-helix	trans	57.2	51.9	-178	-172.1	23.2	0	0	0	112.3	E390 E394 K397	E390-N392 PolarHBondContact O-N 3.31Å; E390-N392 VanDerWaalsContact O-N 3.16Å; N392-E394 VanDerWaalsContact C-N 3.31Å; N392-E394 PolarHBondContact O-N 3.39Å; N392-K397 PolarHBondContact ND2-NZ 3.27Å; N392-K397 VanDerWaalsContact O-CE 3.26Å; N392-K397 WeakPolarHBondContact O-CE 3.21Å; N392-K397 PolarHBondContact O-NZ 3.09Å
393	F	96.3	Very high	95.8	Very high	55 Å²	55	52 Å²	52	24%	0.241	24%	0.241	C	C	.	.	H	α-helix	trans	59.6	35.8	178	-45.4	-83.3	0	0	0	113.5	N389 E390 I395 V396 K397 V432 L436	N389-F393 HydrophobicContact CB-CD1 3.94Å; N389-F393 HydrophobicContact CB-CE1 3.73Å; N389-F393 PolarHBondContact O-N 2.91Å; N389-F393 WeakPolarHBondContact OD1-CD1 3.29Å; N389-F393 VanDerWaalsContact OD1-CE1 3.27Å; N389-F393 WeakPolarHBondContact OD1-CE1 3.2Å; E390-F393 PolarHBondContact O-N 3.45Å; E390-F393 VanDerWaalsContact O-N 3.1Å; F393-I395 VanDerWaalsContact C-N 3.32Å; F393-I395 PolarHBondContact O-N 3.42Å; F393-V396 HydrophobicContact CB-CB 4.24Å; F393-V396 HydrophobicContact CB-CG2 4.47Å; F393-V396 PolarHBondContact O-N 3.22Å; F393-K397 WeakPolarHBondContact O-CG 3.5Å; F393-K397 PolarHBondContact O-N 2.81Å; F393-V432 HydrophobicContact CB-CG1 4.31Å; F393-V432 HydrophobicContact CD1-CB 4.44Å; F393-V432 HydrophobicContact CD1-CG1 3.46Å; F393-V432 VanDerWaalsContact CD1-CG1 3.46Å; F393-V432 HydrophobicContact CD1-CG2 4.15Å; F393-V432 HydrophobicContact CD2-CG1 4.28Å; F393-V432 HydrophobicContact CE1-CB 4.3Å; F393-V432 HydrophobicContact CE1-CG1 3.75Å; F393-V432 HydrophobicContact CE1-CG2 3.54Å; F393-V432 HydrophobicContact CG-CG1 3.77Å; F393-V432 HydrophobicContact CZ-CG1 4.28Å; F393-V432 HydrophobicContact CZ-CG2 3.87Å; F393-L436 HydrophobicContact CB-CD1 4.21Å
394	E	96.6	Very high	96	Very high	62 Å²	62	53 Å²	53	29%	0.29	25%	0.249	S	C	.	.	H	α-helix	trans	-54	-47.6	-177.1	-176.5	-172.8	-175	0	0	111.5	K365 E390 K391 N392 V396 K397 I398	K365-E394 IonicContact NZ-OE1 3.7Å; K365-E394 PolarHBondContact NZ-OE1 2.7Å; E390-E394 PolarHBondContact O-N 3.36Å; K391-E394 HydrophobicContact CB-CB 3.94Å; K391-E394 WeakPolarHBondContact CD-OE2 3.28Å; K391-E394 PolarHBondContact O-N 2.98Å; N392-E394 VanDerWaalsContact C-N 3.31Å; N392-E394 PolarHBondContact O-N 3.39Å; E394-V396 PolarHBondContact O-N 2.8Å; E394-K397 PolarHBondContact O-N 3.03Å; E394-I398 HydrophobicContact CG-CD1 3.95Å; E394-I398 WeakPolarHBondContact O-CG1 3.26Å; E394-I398 PolarHBondContact O-N 3.34Å
395	I	97.6	Very high	96	Very high	13 Å²	13	57.2 Å²	57.2	7%	0.067	27%	0.274	C	S	.	.	H	α-helix	trans	-59.5	-48.6	-179.4	-66.7	178	0	0	0	111	L357 Y360 I361 L364 F388 F393 K397 I398 L399	L357-I395 HydrophobicContact CD1-CD1 4.26Å; Y360-I395 HydrophobicContact CE1-CG2 3.75Å; I361-I395 HydrophobicContact CD1-CD1 3.92Å; I361-I395 HydrophobicContact CG1-CD1 3.81Å; I361-I395 HydrophobicContact CG1-CG1 4.27Å; L364-I395 HydrophobicContact CD2-CB 4.33Å; L364-I395 HydrophobicContact CD2-CG2 3.72Å; F388-I395 HydrophobicContact CB-CB 4.49Å; F388-I395 HydrophobicContact CB-CG2 4.45Å; F388-I395 HydrophobicContact CD1-CB 4.17Å; F388-I395 HydrophobicContact CD1-CG2 3.29Å; F388-I395 HydrophobicContact CD2-CD1 4.09Å; F388-I395 HydrophobicContact CD2-CG2 4.23Å; F388-I395 HydrophobicContact CE1-CG2 3.37Å; F388-I395 HydrophobicContact CE2-CD1 4.39Å; F388-I395 HydrophobicContact CE2-CG2 4.3Å; F388-I395 HydrophobicContact CG-CB 4.25Å; F388-I395 HydrophobicContact CG-CD1 4.35Å; F388-I395 HydrophobicContact CG-CG2 3.74Å; F388-I395 HydrophobicContact CZ-CG2 3.9Å; F393-I395 VanDerWaalsContact C-N 3.32Å; F393-I395 PolarHBondContact O-N 3.42Å; I395-K397 VanDerWaalsContact C-N 3.33Å; I395-K397 PolarHBondContact O-N 3.04Å; I395-I398 PolarHBondContact O-N 3.15Å; I395-L399 HydrophobicContact CG2-CD1 4.44Å; I395-L399 PolarHBondContact O-N 3.47Å
396	V	97.6	Very high	95.9	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-62.1	-41.9	178.8	-178.1	0	0	0	0	110.9	F388 F393 E394 I398 L399 I400 L419 Y422 I433 L436	F388-V396 HydrophobicContact CB-CG2 4.2Å; F388-V396 HydrophobicContact CD1-CG2 4.49Å; F393-V396 HydrophobicContact CB-CB 4.24Å; F393-V396 HydrophobicContact CB-CG2 4.47Å; F393-V396 PolarHBondContact O-N 3.22Å; E394-V396 PolarHBondContact O-N 2.8Å; V396-I398 PolarHBondContact O-N 3.04Å; V396-L399 PolarHBondContact O-N 3.15Å; V396-I400 HydrophobicContact CG1-CD1 3.91Å; V396-I400 VanDerWaalsContact O-CG1 3.3Å; V396-I400 WeakPolarHBondContact O-CG1 3.48Å; V396-I400 PolarHBondContact O-N 3.22Å; V396-L419 HydrophobicContact CG1-CD2 4.11Å; V396-Y422 HydrophobicContact CG2-CD1 4.28Å; V396-Y422 HydrophobicContact CG2-CE1 3.96Å; V396-Y422 HydrophobicContact CG2-CE2 4.26Å; V396-I433 HydrophobicContact CG1-CD1 3.6Å; V396-L436 HydrophobicContact CB-CD1 4.43Å; V396-L436 HydrophobicContact CG1-CD1 3.94Å
397	K	97.8	Very high	95.9	Very high	78 Å²	78	58.1 Å²	58.1	34%	0.339	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-39.6	177.3	-72.9	169.7	177.1	166.8	0	112.4	N392 F393 E394 I395 I400 K401 L436	N392-K397 PolarHBondContact ND2-NZ 3.27Å; N392-K397 VanDerWaalsContact O-CE 3.26Å; N392-K397 WeakPolarHBondContact O-CE 3.21Å; N392-K397 PolarHBondContact O-NZ 3.09Å; F393-K397 WeakPolarHBondContact O-CG 3.5Å; F393-K397 PolarHBondContact O-N 2.81Å; E394-K397 PolarHBondContact O-N 3.03Å; I395-K397 VanDerWaalsContact C-N 3.33Å; I395-K397 PolarHBondContact O-N 3.04Å; K397-I400 PolarHBondContact O-N 3.35Å; K397-K401 WeakPolarHBondContact O-CB 3.4Å; K397-K401 PolarHBondContact O-N 3.37Å; K397-L436 HydrophobicContact CG-CD1 3.95Å; K397-L436 HydrophobicContact CG-CD2 4.25Å
398	I	97.3	Very high	96	Very high	39 Å²	39	59.1 Å²	59.1	20%	0.2	30%	0.295	C	S	.	.	H	α-helix	trans	-66.5	-44.4	176.7	-63.8	165.2	0	0	0	110.2	L364 K365 E394 I395 V396 I400 K401 I402	L364-I398 HydrophobicContact CD1-CG2 3.99Å; L364-I398 HydrophobicContact CD2-CB 4.05Å; L364-I398 HydrophobicContact CD2-CG2 4.07Å; L364-I398 HydrophobicContact CG-CB 4.2Å; L364-I398 HydrophobicContact CG-CG2 3.66Å; K365-I398 HydrophobicContact CG-CD1 4.2Å; E394-I398 HydrophobicContact CG-CD1 3.95Å; E394-I398 WeakPolarHBondContact O-CG1 3.26Å; E394-I398 PolarHBondContact O-N 3.34Å; I395-I398 PolarHBondContact O-N 3.15Å; V396-I398 PolarHBondContact O-N 3.04Å; I398-I400 PolarHBondContact O-N 2.85Å; I398-K401 WeakPolarHBondContact O-CB 3.43Å; I398-K401 PolarHBondContact O-N 2.74Å; I398-I402 HydrophobicContact CG2-CD1 3.99Å; I398-I402 HydrophobicContact CG2-CG1 4.39Å; I398-I402 WeakPolarHBondContact O-CG1 3.36Å; I398-I402 PolarHBondContact O-N 3.09Å
399	L	97.8	Very high	96	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-56.3	-48.3	174.8	-77.9	169.4	0	0	0	112.1	L364 L369 F388 I395 V396 K401 I402 L403 A415 D418 L419	L364-L399 HydrophobicContact CD1-CD2 3.51Å; L364-L399 HydrophobicContact CD1-CG 3.77Å; L364-L399 HydrophobicContact CD2-CG 4.48Å; L369-L399 HydrophobicContact CD1-CD2 4.31Å; F388-L399 HydrophobicContact CE1-CD1 4.19Å; I395-L399 HydrophobicContact CG2-CD1 4.44Å; I395-L399 PolarHBondContact O-N 3.47Å; V396-L399 PolarHBondContact O-N 3.15Å; L399-K401 VanDerWaalsContact C-N 3.33Å; L399-K401 PolarHBondContact O-N 2.69Å; L399-I402 WeakPolarHBondContact O-CB 3.44Å; L399-I402 PolarHBondContact O-N 3.12Å; L399-L403 PolarHBondContact O-N 2.72Å; L399-L403 VanDerWaalsContact O-N 3.12Å; L399-A415 HydrophobicContact CD2-CB 4.05Å; L399-D418 HydrophobicContact CD1-CB 4.16Å; L399-D418 HydrophobicContact CD2-CB 4.02Å; L399-L419 HydrophobicContact CB-CD2 3.75Å; L399-L419 HydrophobicContact CB-CG 4.15Å; L399-L419 HydrophobicContact CD1-CD2 3.8Å; L399-L419 HydrophobicContact CD1-CG 4.27Å; L399-L419 HydrophobicContact CG-CD2 4.43Å
400	I	97.4	Very high	96	Very high	17 Å²	17	63.3 Å²	63.3	9%	0.087	32%	0.319	C	S	.	.	H	α-helix	trans	-61.7	-42.7	178.1	-67.4	169.3	0	0	0	110.7	V396 K397 I398 I402 L403 D404 L419 I433 L436 M441	V396-I400 HydrophobicContact CG1-CD1 3.91Å; V396-I400 VanDerWaalsContact O-CG1 3.3Å; V396-I400 WeakPolarHBondContact O-CG1 3.48Å; V396-I400 PolarHBondContact O-N 3.22Å; K397-I400 PolarHBondContact O-N 3.35Å; I398-I400 PolarHBondContact O-N 2.85Å; I400-I402 VanDerWaalsContact C-N 3.33Å; I400-I402 PolarHBondContact O-N 3.26Å; I400-L403 WeakPolarHBondContact O-CB 3.33Å; I400-L403 PolarHBondContact O-N 3.26Å; I400-D404 PolarHBondContact O-N 3.17Å; I400-L419 HydrophobicContact CG1-CD1 4.21Å; I400-L419 HydrophobicContact CG1-CD2 4.24Å; I400-I433 HydrophobicContact CD1-CD1 4.49Å; I400-L436 HydrophobicContact CD1-CB 3.54Å; I400-L436 HydrophobicContact CD1-CD1 4.22Å; I400-M441 HydrophobicContact CG2-CG 3.98Å
401	K	96.5	Very high	96.2	Very high	140 Å²	140	59.1 Å²	59.1	61%	0.609	30%	0.3	S	S	*	.	H	α-helix	trans	-61.2	-40.8	175.5	-176.2	174.1	179.2	179.2	0	111.9	K397 I398 L399 L403 D404 V405	K397-K401 WeakPolarHBondContact O-CB 3.4Å; K397-K401 PolarHBondContact O-N 3.37Å; I398-K401 WeakPolarHBondContact O-CB 3.43Å; I398-K401 PolarHBondContact O-N 2.74Å; L399-K401 VanDerWaalsContact C-N 3.33Å; L399-K401 PolarHBondContact O-N 2.69Å; K401-L403 VanDerWaalsContact C-N 3.31Å; K401-L403 PolarHBondContact O-N 2.72Å; K401-D404 PolarHBondContact O-N 2.66Å; K401-D404 VanDerWaalsContact O-N 3.12Å; K401-V405 HydrophobicContact CG-CG1 4.35Å; K401-V405 HydrophobicContact CG-CG2 4.48Å; K401-V405 VanDerWaalsContact O-CG2 3.23Å; K401-V405 WeakPolarHBondContact O-CG2 3.45Å; K401-V405 PolarHBondContact O-N 2.91Å
402	I	96.7	Very high	96.4	Very high	12 Å²	12	51.9 Å²	51.9	6%	0.062	27%	0.269	C	S	.	.	H	α-helix	trans	-60.2	-40.6	176.3	-73.2	169.5	0	0	0	111.2	L364 L369 I398 L399 I400 D404 V405 S406 V411 A415	L364-I402 HydrophobicContact CD1-CD1 3.53Å; L364-I402 HydrophobicContact CG-CD1 4.43Å; L369-I402 HydrophobicContact CD1-CD1 4.01Å; L369-I402 HydrophobicContact CD1-CG2 4.29Å; L369-I402 HydrophobicContact CG-CD1 4.4Å; I398-I402 HydrophobicContact CG2-CD1 3.99Å; I398-I402 HydrophobicContact CG2-CG1 4.39Å; I398-I402 WeakPolarHBondContact O-CG1 3.36Å; I398-I402 PolarHBondContact O-N 3.09Å; L399-I402 WeakPolarHBondContact O-CB 3.44Å; L399-I402 PolarHBondContact O-N 3.12Å; I400-I402 VanDerWaalsContact C-N 3.33Å; I400-I402 PolarHBondContact O-N 3.26Å; I402-D404 PolarHBondContact O-N 2.65Å; I402-V405 PolarHBondContact O-N 3.08Å; I402-S406 WeakPolarHBondContact O-CB 3.4Å; I402-S406 PolarHBondContact O-N 3.35Å; I402-V411 HydrophobicContact CG2-CG1 3.36Å; I402-A415 HydrophobicContact CG2-CB 3.94Å
403	L	96.3	Very high	96.5	Very high	10 Å²	10	46.9 Å²	46.9	5%	0.052	24%	0.242	C	C	.	.	H	α-helix	trans	-62.6	-28.1	176.1	-62	-174.2	0	0	0	113.6	L399 I400 K401 L412 A415 A416 L419 M441 V442 L445	L399-L403 PolarHBondContact O-N 2.72Å; L399-L403 VanDerWaalsContact O-N 3.12Å; I400-L403 WeakPolarHBondContact O-CB 3.33Å; I400-L403 PolarHBondContact O-N 3.26Å; K401-L403 VanDerWaalsContact C-N 3.31Å; K401-L403 PolarHBondContact O-N 2.72Å; L403-L412 HydrophobicContact CD2-CD2 4.22Å; L403-A415 HydrophobicContact CD2-CB 3.45Å; L403-A415 VanDerWaalsContact CD2-CB 3.45Å; L403-A415 HydrophobicContact CG-CB 4.23Å; L403-A416 HydrophobicContact CD2-CB 4.28Å; L403-L419 HydrophobicContact CD1-CD1 3.48Å; L403-L419 VanDerWaalsContact CD1-CD1 3.48Å; L403-L419 HydrophobicContact CG-CD1 4.38Å; L403-M441 HydrophobicContact CB-CB 4.14Å; L403-M441 HydrophobicContact CD1-CB 4.09Å; L403-V442 HydrophobicContact CD1-CG2 3.6Å; L403-L445 HydrophobicContact CD2-CD1 3.78Å
404	D	94.7	Very high	96.6	Very high	88 Å²	88	44.2 Å²	44.2	47%	0.471	23%	0.231	S	C	.	.	H	α-helix	trans	-85.8	-37.8	179.5	-172.4	42.7	0	0	0	112.6	I400 K401 I402 M441 R444	I400-D404 PolarHBondContact O-N 3.17Å; K401-D404 PolarHBondContact O-N 2.66Å; K401-D404 VanDerWaalsContact O-N 3.12Å; I402-D404 PolarHBondContact O-N 2.65Å; D404-M441 HydrophobicContact CB-SD 4.29Å; D404-R444 IonicContact OD1-NH1 3.47Å; D404-R444 PolarHBondContact OD1-NH1 3.15Å
405	V	94.4	Very high	96.7	Very high	89 Å²	89	41.3 Å²	41.3	54%	0.539	22%	0.217	S	C	.	.	H	α-helix	trans	-98.9	-22.6	-172	-58.4	0	0	0	0	115.3	K401 I402	K401-V405 HydrophobicContact CG-CG1 4.35Å; K401-V405 HydrophobicContact CG-CG2 4.48Å; K401-V405 VanDerWaalsContact O-CG2 3.23Å; K401-V405 WeakPolarHBondContact O-CG2 3.45Å; K401-V405 PolarHBondContact O-N 2.91Å; I402-V405 PolarHBondContact O-N 3.08Å
406	S	93.4	Very high	96.7	Very high	24 Å²	24	40.7 Å²	40.7	17%	0.168	21%	0.214	C	C	.	.			trans	-82.2	137.4	-175.3	-172	0	0	0	0	111.5	I402 D408	I402-S406 WeakPolarHBondContact O-CB 3.4Å; I402-S406 PolarHBondContact O-N 3.35Å; S406-D408 PolarHBondContact OG-N 3.16Å
407	N	93	Very high	96.6	Very high	150 Å²	150	42 Å²	42	80%	0.802	22%	0.22	S	C	*	.			trans	-106.2	0.9	169.5	-64.4	-50.8	0	0	0	112.3	P409	N407-P409 VanDerWaalsContact O-CD 3.32Å; N407-P409 WeakPolarHBondContact O-CD 3.28Å
408	D	96.5	Very high	96.6	Very high	77 Å²	77	38.2 Å²	38.2	41%	0.412	20%	0.204	S	C	.	.			trans	-81.5	115.3	178.6	-177.1	-19.7	0	0	0	109.6	S406 L410 V411 L412	S406-D408 PolarHBondContact OG-N 3.16Å; D408-L410 PolarHBondContact O-N 3.2Å; D408-L410 WeakPolarHBondContact OD1-CB 3.22Å; D408-L410 PolarHBondContact OD1-N 3.36Å; D408-V411 HydrophobicContact CB-CB 4.01Å; D408-V411 HydrophobicContact CB-CG2 3.84Å; D408-V411 PolarHBondContact O-N 3.41Å; D408-L412 WeakPolarHBondContact O-CG 3.19Å; D408-L412 PolarHBondContact O-N 3.41Å
409	P	96.8	Very high	96.6	Very high	46 Å²	46	36.4 Å²	36.4	30%	0.299	19%	0.194	S	C	.	.	H	α-helix	trans	-56.1	-35.5	-179.7	-25.5	35.4	0	0	0	113.5	N407 C413 D450 V453	N407-P409 VanDerWaalsContact O-CD 3.32Å; N407-P409 WeakPolarHBondContact O-CD 3.28Å; P409-C413 PolarHBondContact O-N 3.08Å; P409-C413 PolarHBondContact O-SG 3.03Å; P409-D450 HydrophobicContact CB-CB 4.06Å; P409-D450 HydrophobicContact CG-CB 4.38Å; P409-V453 HydrophobicContact CB-CG2 3.78Å; P409-V453 WeakPolarHBondContact O-CG2 3.2Å
410	L	97.1	Very high	96.5	Very high	72 Å²	72	36.4 Å²	36.4	38%	0.377	19%	0.194	S	C	.	.	H	α-helix	trans	-66.1	-48.3	179.5	175.7	62.5	0	0	0	110.8	W371 D408 L412 C413 V414	W371-L410 VanDerWaalsContact CD1-CD1 3.43Å; W371-L410 HydrophobicContact CG-CD1 4.42Å; D408-L410 PolarHBondContact O-N 3.2Å; D408-L410 WeakPolarHBondContact OD1-CB 3.22Å; D408-L410 PolarHBondContact OD1-N 3.36Å; L410-L412 VanDerWaalsContact C-N 3.31Å; L410-L412 PolarHBondContact O-N 3.27Å; L410-C413 WeakPolarHBondContact O-CB 3.47Å; L410-C413 PolarHBondContact O-N 2.94Å; L410-C413 VanDerWaalsContact O-N 3.17Å; L410-V414 HydrophobicContact CD1-CG2 4.43Å; L410-V414 WeakPolarHBondContact O-CG2 2.92Å; L410-V414 PolarHBondContact O-N 2.88Å
411	V	97.7	Very high	96.5	Very high	3 Å²	3	36 Å²	36	2%	0.018	19%	0.192	C	C	.	.	H	α-helix	trans	-61.3	-41.8	179.7	173.2	0	0	0	0	110.7	L369 I402 D408 V414 A415	L369-V411 HydrophobicContact CB-CG1 4.17Å; L369-V411 HydrophobicContact CB-CG2 4.44Å; L369-V411 HydrophobicContact CD1-CG1 4.25Å; L369-V411 HydrophobicContact CG-CG1 4.38Å; I402-V411 HydrophobicContact CG2-CG1 3.36Å; D408-V411 HydrophobicContact CB-CB 4.01Å; D408-V411 HydrophobicContact CB-CG2 3.84Å; D408-V411 PolarHBondContact O-N 3.41Å; V411-V414 PolarHBondContact O-N 2.92Å; V411-A415 WeakPolarHBondContact O-CB 3.48Å; V411-A415 PolarHBondContact O-N 3.32Å
412	L	97.9	Very high	96.5	Very high	4 Å²	4	29.3 Å²	29.3	2%	0.021	16%	0.163	C	C	.	.	H	α-helix	trans	-63.3	-40.8	175.9	-68.2	175.3	0	0	0	112.2	L403 D408 L410 A416 L445 V453	L403-L412 HydrophobicContact CD2-CD2 4.22Å; D408-L412 WeakPolarHBondContact O-CG 3.19Å; D408-L412 PolarHBondContact O-N 3.41Å; L410-L412 VanDerWaalsContact C-N 3.31Å; L410-L412 PolarHBondContact O-N 3.27Å; L412-A416 VanDerWaalsContact O-CB 3.26Å; L412-A416 WeakPolarHBondContact O-CB 3.45Å; L412-A416 PolarHBondContact O-N 3.02Å; L412-L445 HydrophobicContact CB-CD1 4.45Å; L412-L445 HydrophobicContact CD1-CD2 4.15Å; L412-L445 HydrophobicContact CD2-CD1 4.38Å; L412-L445 HydrophobicContact CD2-CD2 4.35Å; L412-V453 HydrophobicContact CB-CG1 4.18Å; L412-V453 HydrophobicContact CB-CG2 4.17Å; L412-V453 HydrophobicContact CD1-CG1 4.47Å
413	C	98	Very high	96.4	Very high	5 Å²	5	29.1 Å²	29.1	3%	0.034	16%	0.162	C	C	.	.	H	α-helix	trans	-59.9	-48.8	175.7	-71.1	0	0	0	0	111.8	W371 P409 L410 H417 V453 H456	W371-C413 HydrophobicContact CZ2-CB 4.16Å; P409-C413 PolarHBondContact O-N 3.08Å; P409-C413 PolarHBondContact O-SG 3.03Å; L410-C413 WeakPolarHBondContact O-CB 3.47Å; L410-C413 PolarHBondContact O-N 2.94Å; L410-C413 VanDerWaalsContact O-N 3.17Å; C413-H417 VanDerWaalsContact O-CB 3.24Å; C413-H417 WeakPolarHBondContact O-CB 3.26Å; C413-H417 PolarHBondContact O-N 2.66Å; C413-V453 VanDerWaalsContact SG-CA 3.57Å; C413-V453 PolarHBondContact SG-N 3.08Å; C413-V453 VanDerWaalsContact SG-N 3.44Å; C413-H456 HydrophobicContact CB-CB 4.18Å
414	V	97.9	Very high	96.3	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-65.4	-48.8	-179	179.7	0	0	0	0	110.4	L369 W371 H375 L410 V411 A416 H417 D418	L369-V414 HydrophobicContact CB-CB 3.94Å; L369-V414 HydrophobicContact CB-CG1 3.9Å; L369-V414 HydrophobicContact CD1-CB 4.4Å; L369-V414 HydrophobicContact CD1-CG1 4.23Å; L369-V414 HydrophobicContact CG-CG1 4.48Å; W371-V414 HydrophobicContact CD2-CG2 3.69Å; W371-V414 HydrophobicContact CE3-CG2 4.01Å; W371-V414 HydrophobicContact CG-CG2 4.14Å; W371-V414 HydrophobicContact CH2-CG2 4.22Å; W371-V414 HydrophobicContact CZ2-CG2 3.91Å; W371-V414 HydrophobicContact CZ3-CG2 4.26Å; H375-V414 HydrophobicContact CB-CG1 4.34Å; H375-V414 WeakPolarHBondContact ND1-CG1 3.42Å; L410-V414 HydrophobicContact CD1-CG2 4.43Å; L410-V414 WeakPolarHBondContact O-CG2 2.92Å; L410-V414 PolarHBondContact O-N 2.88Å; V411-V414 PolarHBondContact O-N 2.92Å; V414-A416 PolarHBondContact O-N 3.12Å; V414-H417 WeakPolarHBondContact O-CB 3.4Å; V414-H417 PolarHBondContact O-N 2.91Å; V414-D418 WeakPolarHBondContact O-CB 3.28Å; V414-D418 VanDerWaalsContact O-CG 3.29Å; V414-D418 PolarHBondContact O-N 3.16Å
415	A	97.7	Very high	96.3	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62	-41.5	-179.6	0	0	0	0	0	112.8	L369 L399 I402 L403 V411 D418 L419	L369-A415 HydrophobicContact CD1-CB 3.75Å; L399-A415 HydrophobicContact CD2-CB 4.05Å; I402-A415 HydrophobicContact CG2-CB 3.94Å; L403-A415 HydrophobicContact CD2-CB 3.45Å; L403-A415 VanDerWaalsContact CD2-CB 3.45Å; L403-A415 HydrophobicContact CG-CB 4.23Å; V411-A415 WeakPolarHBondContact O-CB 3.48Å; V411-A415 PolarHBondContact O-N 3.32Å; A415-D418 PolarHBondContact O-N 3.02Å; A415-L419 WeakPolarHBondContact O-CG 3.34Å; A415-L419 PolarHBondContact O-N 3.42Å
416	A	97.5	Very high	96.3	Very high	0 Å²	0	28.4 Å²	28.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-64.9	-45.7	176.8	0	0	0	0	0	110.8	L403 L412 V414 D418 L419 G420 L445 A460	L403-A416 HydrophobicContact CD2-CB 4.28Å; L412-A416 VanDerWaalsContact O-CB 3.26Å; L412-A416 WeakPolarHBondContact O-CB 3.45Å; L412-A416 PolarHBondContact O-N 3.02Å; V414-A416 PolarHBondContact O-N 3.12Å; A416-D418 VanDerWaalsContact C-N 3.34Å; A416-D418 PolarHBondContact O-N 3.48Å; A416-L419 PolarHBondContact O-N 3.23Å; A416-G420 PolarHBondContact O-N 3.23Å; A416-L445 HydrophobicContact CB-CD1 4.38Å; A416-A460 HydrophobicContact CB-CB 4.44Å; A416-A460 WeakPolarHBondContact O-CB 3.26Å
417	H	97.1	Very high	96.2	Very high	27 Å²	27	31.8 Å²	31.8	13%	0.125	17%	0.166	C	C	.	.	H	α-helix	trans	-56	-47.8	176.3	171.2	-87	0	0	0	112.4	W371 H375 C413 V414 L419 G420 E421	W371-H417 HydrophobicContact CH2-CB 3.59Å; W371-H417 AromaticContact CH2-CD2 3.98Å; W371-H417 AromaticContact CH2-CG 3.54Å; W371-H417 AromaticContact CH2-ND1 3.92Å; W371-H417 HydrophobicContact CZ3-CB 4.27Å; W371-H417 AromaticContact CZ3-CG 3.86Å; W371-H417 AromaticContact CZ3-ND1 3.74Å; H375-H417 PolarHBondContact O-CE1 3.4Å; C413-H417 VanDerWaalsContact O-CB 3.24Å; C413-H417 WeakPolarHBondContact O-CB 3.26Å; C413-H417 PolarHBondContact O-N 2.66Å; V414-H417 WeakPolarHBondContact O-CB 3.4Å; V414-H417 PolarHBondContact O-N 2.91Å; H417-L419 PolarHBondContact O-N 3.44Å; H417-G420 CarbonylContact O-C 3.58Å; H417-G420 WeakPolarHBondContact O-CA 3.26Å; H417-G420 PolarHBondContact O-N 3.23Å; H417-E421 WeakPolarHBondContact CE1-CG 3.36Å; H417-E421 PolarHBondContact O-N 3.47Å
418	D	97.9	Very high	96.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.1	-41.4	-178.2	-81	14.3	0	0	0	113.2	Y360 H375 W381 L399 V414 A415 A416 G420 E421 Y422	Y360-D418 WeakPolarHBondContact CE2-OD2 3.31Å; Y360-D418 PolarHBondContact OH-OD2 2.86Å; H375-D418 IonicContact CE1-OD2 2.68Å; H375-D418 PolarHBondContact CE1-OD2 3.38Å; H375-D418 IonicContact CG-OD1 3.07Å; H375-D418 IonicContact ND1-OD1 3.14Å; H375-D418 PolarHBondContact ND1-OD1 2.71Å; H375-D418 IonicContact ND1-OD2 3.97Å; H375-D418 PolarHBondContact ND1-OD2 2.95Å; W381-D418 HydrophobicContact CH2-CB 3.66Å; W381-D418 WeakPolarHBondContact CH2-O 3.45Å; W381-D418 HydrophobicContact CZ2-CB 3.97Å; W381-D418 WeakPolarHBondContact CZ2-OD1 3.36Å; L399-D418 HydrophobicContact CD1-CB 4.16Å; L399-D418 HydrophobicContact CD2-CB 4.02Å; V414-D418 WeakPolarHBondContact O-CB 3.28Å; V414-D418 VanDerWaalsContact O-CG 3.29Å; V414-D418 PolarHBondContact O-N 3.16Å; A415-D418 PolarHBondContact O-N 3.02Å; A416-D418 VanDerWaalsContact C-N 3.34Å; A416-D418 PolarHBondContact O-N 3.48Å; D418-G420 PolarHBondContact O-N 3.22Å; D418-E421 PolarHBondContact O-N 3.11Å; D418-Y422 WeakPolarHBondContact O-CB 3.25Å; D418-Y422 PolarHBondContact O-N 2.9Å
419	L	97.2	Very high	96	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.1	-36.7	173.3	-68	172.3	0	0	0	111.4	V396 L399 I400 L403 A415 A416 H417 V423 I433 V442	V396-L419 HydrophobicContact CG1-CD2 4.11Å; L399-L419 HydrophobicContact CB-CD2 3.75Å; L399-L419 HydrophobicContact CB-CG 4.15Å; L399-L419 HydrophobicContact CD1-CD2 3.8Å; L399-L419 HydrophobicContact CD1-CG 4.27Å; L399-L419 HydrophobicContact CG-CD2 4.43Å; I400-L419 HydrophobicContact CG1-CD1 4.21Å; I400-L419 HydrophobicContact CG1-CD2 4.24Å; L403-L419 HydrophobicContact CD1-CD1 3.48Å; L403-L419 VanDerWaalsContact CD1-CD1 3.48Å; L403-L419 HydrophobicContact CG-CD1 4.38Å; A415-L419 WeakPolarHBondContact O-CG 3.34Å; A415-L419 PolarHBondContact O-N 3.42Å; A416-L419 PolarHBondContact O-N 3.23Å; H417-L419 PolarHBondContact O-N 3.44Å; L419-V423 WeakPolarHBondContact O-CG2 3.39Å; L419-V423 PolarHBondContact O-N 3.25Å; L419-I433 HydrophobicContact CB-CD1 4.46Å; L419-I433 HydrophobicContact CD2-CD1 3.56Å; L419-I433 HydrophobicContact CG-CD1 4.47Å; L419-V442 HydrophobicContact CD1-CG2 3.83Å
420	G	95.6	Very high	95.8	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.4	-44.3	172.7	0	0	0	0	0	112.7	A416 H417 D418 V423 R424 K463	A416-G420 PolarHBondContact O-N 3.23Å; H417-G420 CarbonylContact O-C 3.58Å; H417-G420 WeakPolarHBondContact O-CA 3.26Å; H417-G420 PolarHBondContact O-N 3.23Å; D418-G420 PolarHBondContact O-N 3.22Å; G420-V423 PolarHBondContact O-N 3.21Å; G420-R424 WeakPolarHBondContact O-CB 3.42Å; G420-R424 PolarHBondContact O-N 3.39Å; G420-K463 WeakPolarHBondContact O-CD 3.32Å
421	E	96.1	Very high	95.6	Very high	8 Å²	8	31.8 Å²	31.8	4%	0.037	15%	0.149	C	C	.	.	H	α-helix	trans	-68.2	-37	177.8	-76.2	-60.5	129.7	0	0	113.1	W381 H417 D418 R424 H425 K463	W381-E421 HydrophobicContact CD2-CB 3.49Å; W381-E421 VanDerWaalsContact CD2-CB 3.49Å; W381-E421 HydrophobicContact CD2-CG 4.39Å; W381-E421 VanDerWaalsContact CE2-CB 3.42Å; W381-E421 HydrophobicContact CE3-CB 3.86Å; W381-E421 HydrophobicContact CG-CB 3.95Å; W381-E421 HydrophobicContact CH2-CB 4.14Å; W381-E421 HydrophobicContact CZ2-CB 3.78Å; W381-E421 HydrophobicContact CZ2-CG 4.47Å; W381-E421 HydrophobicContact CZ3-CB 4.16Å; H417-E421 WeakPolarHBondContact CE1-CG 3.36Å; H417-E421 PolarHBondContact O-N 3.47Å; D418-E421 PolarHBondContact O-N 3.11Å; E421-R424 WeakPolarHBondContact O-CB 3.39Å; E421-R424 PolarHBondContact O-N 3.27Å; E421-R424 IonicContact OE1-NH1 3.49Å; E421-R424 PolarHBondContact OE1-NH1 3.23Å; E421-R424 IonicContact OE2-NH1 3.13Å; E421-R424 PolarHBondContact OE2-NH1 3.39Å; E421-H425 PolarHBondContact O-N 3.38Å; E421-H425 PolarHBondContact O-ND1 2.92Å; E421-H425 VanDerWaalsContact O-ND1 3.11Å; E421-H425 IonicContact OE2-CE1 3.01Å; E421-H425 PolarHBondContact OE2-CE1 3.05Å; E421-H425 IonicContact OE2-ND1 3.25Å; E421-H425 PolarHBondContact OE2-ND1 3.36Å; E421-K463 WeakPolarHBondContact OE1-CE 3.15Å; E421-K463 IonicContact OE1-NZ 2.64Å; E421-K463 PolarHBondContact OE1-NZ 3.15Å
422	Y	97.1	Very high	95.4	Very high	0 Å²	0	32.4 Å²	32.4	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-57.2	-50.5	171.3	165.6	-110.1	0	0	0	111.3	A385 F388 N389 V396 D418 R424 H425 Y426 I433	A385-Y422 WeakPolarHBondContact O-CE2 3.41Å; F388-Y422 HydrophobicContact CB-CD2 3.68Å; F388-Y422 HydrophobicContact CB-CE2 3.67Å; F388-Y422 HydrophobicContact CD1-CD2 4.06Å; F388-Y422 HydrophobicContact CD1-CG 4.43Å; F388-Y422 HydrophobicContact CG-CD2 4.11Å; N389-Y422 PolarHBondContact OD1-OH 3.43Å; V396-Y422 HydrophobicContact CG2-CD1 4.28Å; V396-Y422 HydrophobicContact CG2-CE1 3.96Å; V396-Y422 HydrophobicContact CG2-CE2 4.26Å; D418-Y422 WeakPolarHBondContact O-CB 3.25Å; D418-Y422 PolarHBondContact O-N 2.9Å; Y422-R424 VanDerWaalsContact C-N 3.33Å; Y422-R424 PolarHBondContact O-N 3.48Å; Y422-H425 PolarHBondContact O-N 3.22Å; Y422-Y426 AromaticContact CE2-CD1 3.8Å; Y422-Y426 HydrophobicContact CE2-CD1 3.8Å; Y422-Y426 HydrophobicContact CE2-CG 4.36Å; Y422-Y426 AromaticContact CZ-CD1 3.76Å; Y422-Y426 WeakPolarHBondContact O-CA 3.49Å; Y422-Y426 WeakPolarHBondContact O-CB 3.48Å; Y422-Y426 PolarHBondContact O-N 3.13Å; Y422-Y426 WeakPolarHBondContact OH-CD1 3.38Å; Y422-I433 HydrophobicContact CD1-CD1 4.19Å; Y422-I433 HydrophobicContact CD1-CG1 4.22Å; Y422-I433 HydrophobicContact CE1-CD1 4.3Å; Y422-I433 HydrophobicContact CE1-CG1 4.16Å
423	V	95.2	Very high	95.3	Very high	8 Å²	8	32.2 Å²	32.2	5%	0.048	15%	0.152	C	C	.	.	H	α-helix	trans	-67.4	-35.5	178.7	176.3	0	0	0	0	111.9	L419 G420 H425 Y426 P427 K430 I433 I464	L419-V423 WeakPolarHBondContact O-CG2 3.39Å; L419-V423 PolarHBondContact O-N 3.25Å; G420-V423 PolarHBondContact O-N 3.21Å; V423-H425 PolarHBondContact O-N 2.89Å; V423-Y426 CarbonylContact O-C 3.51Å; V423-P427 WeakPolarHBondContact O-CA 3.31Å; V423-K430 HydrophobicContact CG1-CB 4.11Å; V423-I433 HydrophobicContact CG2-CG1 3.68Å; V423-I464 HydrophobicContact CB-CG1 4.41Å; V423-I464 HydrophobicContact CG2-CG1 4.14Å
424	R	93.5	Very high	95.1	Very high	72 Å²	72	37.2 Å²	37.2	27%	0.272	18%	0.175	S	C	.	.	H	α-helix	trans	-59.8	-45.7	176	176.8	-174	174	-179.5	4.1	112	G420 E421 Y422 W469	G420-R424 WeakPolarHBondContact O-CB 3.42Å; G420-R424 PolarHBondContact O-N 3.39Å; E421-R424 WeakPolarHBondContact O-CB 3.39Å; E421-R424 PolarHBondContact O-N 3.27Å; E421-R424 IonicContact OE1-NH1 3.49Å; E421-R424 PolarHBondContact OE1-NH1 3.23Å; E421-R424 IonicContact OE2-NH1 3.13Å; E421-R424 PolarHBondContact OE2-NH1 3.39Å; Y422-R424 VanDerWaalsContact C-N 3.33Å; Y422-R424 PolarHBondContact O-N 3.48Å; R424-W469 HydrophobicContact CG-CZ2 4.33Å; R424-W469 VanDerWaalsContact CZ-CZ2 3.4Å; R424-W469 VanDerWaalsContact NE-CZ2 3.28Å
425	H	94.4	Very high	94.9	Very high	43 Å²	43	44.8 Å²	44.8	20%	0.199	21%	0.21	C	C	.	.	H	α-helix	trans	-90.9	-17.3	-175.9	-70	95.6	0	0	0	113.6	E378 W381 A385 E421 Y422 V423	E378-H425 WeakPolarHBondContact CG-NE2 3.33Å; W381-H425 HydrophobicContact CB-CB 4.19Å; W381-H425 VanDerWaalsContact CB-CE1 3.49Å; W381-H425 WeakPolarHBondContact CB-CE1 3.18Å; W381-H425 WeakPolarHBondContact CB-ND1 3.41Å; W381-H425 AromaticContact CG-ND1 3.97Å; A385-H425 HydrophobicContact CB-CB 3.59Å; E421-H425 PolarHBondContact O-N 3.38Å; E421-H425 PolarHBondContact O-ND1 2.92Å; E421-H425 VanDerWaalsContact O-ND1 3.11Å; E421-H425 IonicContact OE2-CE1 3.01Å; E421-H425 PolarHBondContact OE2-CE1 3.05Å; E421-H425 IonicContact OE2-ND1 3.25Å; E421-H425 PolarHBondContact OE2-ND1 3.36Å; Y422-H425 PolarHBondContact O-N 3.22Å; V423-H425 PolarHBondContact O-N 2.89Å
426	Y	94.3	Very high	94.8	Very high	57 Å²	57	47.1 Å²	47.1	22%	0.224	22%	0.222	C	C	.	.			trans	-130.5	86.1	171.2	-175.7	-111.3	0	0	0	109.4	N389 Y422 V423 R428 G429	N389-Y426 WeakPolarHBondContact ND2-CE1 3.4Å; Y422-Y426 AromaticContact CE2-CD1 3.8Å; Y422-Y426 HydrophobicContact CE2-CD1 3.8Å; Y422-Y426 HydrophobicContact CE2-CG 4.36Å; Y422-Y426 AromaticContact CZ-CD1 3.76Å; Y422-Y426 WeakPolarHBondContact O-CA 3.49Å; Y422-Y426 WeakPolarHBondContact O-CB 3.48Å; Y422-Y426 PolarHBondContact O-N 3.13Å; Y422-Y426 WeakPolarHBondContact OH-CD1 3.38Å; V423-Y426 CarbonylContact O-C 3.51Å; Y426-R428 HydrophobicContact CD1-CB 4.32Å; Y426-R428 HydrophobicContact CE1-CB 3.71Å; Y426-R428 HydrophobicContact CE2-CB 4.12Å; Y426-R428 PolarHBondContact O-N 3.36Å; Y426-R428 VanDerWaalsContact O-N 3.12Å; Y426-G429 WeakPolarHBondContact O-CA 3.36Å; Y426-G429 PolarHBondContact O-N 2.68Å
427	P	92.1	Very high	94.6	Very high	95 Å²	95	51.9 Å²	51.9	62%	0.617	25%	0.247	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.7	-30.4	-174.9	-29.4	36.4	0	0	0	114.8	V423 G429 K430	V423-P427 WeakPolarHBondContact O-CA 3.31Å; P427-G429 PolarHBondContact O-N 3.09Å; P427-K430 WeakPolarHBondContact O-CB 3.19Å; P427-K430 PolarHBondContact O-N 3.17Å
428	R	92.2	Very high	94.4	Very high	192 Å²	192	50.6 Å²	50.6	73%	0.725	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64	-18.3	172.2	-70.2	-179.2	179.7	171.8	0.2	112.7	Y426 K430 T431	Y426-R428 HydrophobicContact CD1-CB 4.32Å; Y426-R428 HydrophobicContact CE1-CB 3.71Å; Y426-R428 HydrophobicContact CE2-CB 4.12Å; Y426-R428 PolarHBondContact O-N 3.36Å; Y426-R428 VanDerWaalsContact O-N 3.12Å; R428-K430 PolarHBondContact O-N 3.46Å; R428-T431 PolarHBondContact O-N 3Å; R428-T431 PolarHBondContact O-OG1 3.35Å
429	G	93.4	Very high	94.2	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-61.9	-20.5	174.2	0	0	0	0	0	113.3	Y426 P427 T431 V432 I433	Y426-G429 WeakPolarHBondContact O-CA 3.36Å; Y426-G429 PolarHBondContact O-N 2.68Å; P427-G429 PolarHBondContact O-N 3.09Å; G429-T431 VanDerWaalsContact C-N 3.31Å; G429-T431 PolarHBondContact O-N 3.22Å; G429-V432 WeakPolarHBondContact O-CB 3.49Å; G429-V432 PolarHBondContact O-N 2.99Å; G429-V432 VanDerWaalsContact O-N 3.08Å; G429-I433 WeakPolarHBondContact O-CG1 3.4Å; G429-I433 PolarHBondContact O-N 2.74Å
430	K	92.3	Very high	94	Very high	75 Å²	75	57.3 Å²	57.3	33%	0.326	28%	0.278	S	S	.	.	H	α-helix	trans	-55.7	-44.9	174.9	-175.9	176.7	179.5	171.7	0	112.2	V423 P427 R428 V432 I433 E434 I464	V423-K430 HydrophobicContact CG1-CB 4.11Å; P427-K430 WeakPolarHBondContact O-CB 3.19Å; P427-K430 PolarHBondContact O-N 3.17Å; R428-K430 PolarHBondContact O-N 3.46Å; K430-V432 VanDerWaalsContact C-N 3.29Å; K430-V432 PolarHBondContact O-N 3.49Å; K430-I433 PolarHBondContact O-N 2.95Å; K430-E434 WeakPolarHBondContact O-CB 3.42Å; K430-E434 PolarHBondContact O-N 3.13Å; K430-I464 VanDerWaalsContact CD-O 3.31Å; K430-I464 WeakPolarHBondContact CD-O 3.34Å; K430-I464 WeakPolarHBondContact CE-O 3.37Å; K430-I464 PolarHBondContact NZ-O 3.11Å
431	T	92.5	Very high	93.9	Very high	79 Å²	79	59.5 Å²	59.5	49%	0.485	29%	0.289	S	S	.	.	H	α-helix	trans	-68.7	-31.4	178.8	55.7	0	0	0	0	111.7	R428 G429 H435	R428-T431 PolarHBondContact O-N 3Å; R428-T431 PolarHBondContact O-OG1 3.35Å; G429-T431 VanDerWaalsContact C-N 3.31Å; G429-T431 PolarHBondContact O-N 3.22Å; T431-H435 WeakPolarHBondContact O-CB 3.22Å; T431-H435 PolarHBondContact O-N 3.17Å; T431-H435 PolarHBondContact O-ND1 3.34Å
432	V	94.4	Very high	93.8	Very high	16 Å²	16	59.1 Å²	59.1	10%	0.097	29%	0.287	C	S	.	.	H	α-helix	trans	-68	-48.5	176.5	-179.9	0	0	0	0	110.4	F393 G429 K430 E434 H435 L436	F393-V432 HydrophobicContact CB-CG1 4.31Å; F393-V432 HydrophobicContact CD1-CB 4.44Å; F393-V432 HydrophobicContact CD1-CG1 3.46Å; F393-V432 VanDerWaalsContact CD1-CG1 3.46Å; F393-V432 HydrophobicContact CD1-CG2 4.15Å; F393-V432 HydrophobicContact CD2-CG1 4.28Å; F393-V432 HydrophobicContact CE1-CB 4.3Å; F393-V432 HydrophobicContact CE1-CG1 3.75Å; F393-V432 HydrophobicContact CE1-CG2 3.54Å; F393-V432 HydrophobicContact CG-CG1 3.77Å; F393-V432 HydrophobicContact CZ-CG1 4.28Å; F393-V432 HydrophobicContact CZ-CG2 3.87Å; G429-V432 WeakPolarHBondContact O-CB 3.49Å; G429-V432 PolarHBondContact O-N 2.99Å; G429-V432 VanDerWaalsContact O-N 3.08Å; K430-V432 VanDerWaalsContact C-N 3.29Å; K430-V432 PolarHBondContact O-N 3.49Å; V432-E434 VanDerWaalsContact C-N 3.26Å; V432-E434 PolarHBondContact O-N 3.48Å; V432-H435 PolarHBondContact O-N 3Å; V432-L436 HydrophobicContact CG1-CD1 3.81Å; V432-L436 HydrophobicContact CG1-CG 4.45Å; V432-L436 WeakPolarHBondContact O-CB 3.29Å; V432-L436 WeakPolarHBondContact O-CG 3.47Å; V432-L436 PolarHBondContact O-N 2.72Å
433	I	95.1	Very high	93.6	Very high	0 Å²	0	62.6 Å²	62.6	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-61.4	-35.8	177.2	-66.8	-64.3	0	0	0	111.7	V396 I400 L419 Y422 V423 G429 K430 D437 G438 K439 I464	V396-I433 HydrophobicContact CG1-CD1 3.6Å; I400-I433 HydrophobicContact CD1-CD1 4.49Å; L419-I433 HydrophobicContact CB-CD1 4.46Å; L419-I433 HydrophobicContact CD2-CD1 3.56Å; L419-I433 HydrophobicContact CG-CD1 4.47Å; Y422-I433 HydrophobicContact CD1-CD1 4.19Å; Y422-I433 HydrophobicContact CD1-CG1 4.22Å; Y422-I433 HydrophobicContact CE1-CD1 4.3Å; Y422-I433 HydrophobicContact CE1-CG1 4.16Å; V423-I433 HydrophobicContact CG2-CG1 3.68Å; G429-I433 WeakPolarHBondContact O-CG1 3.4Å; G429-I433 PolarHBondContact O-N 2.74Å; K430-I433 PolarHBondContact O-N 2.95Å; I433-D437 PolarHBondContact O-N 3.13Å; I433-G438 PolarHBondContact O-N 3.24Å; I433-K439 HydrophobicContact CG2-CB 4.17Å; I433-K439 PolarHBondContact O-N 3.4Å; I433-I464 HydrophobicContact CG2-CD1 4.3Å
434	E	92.7	Very high	93.5	Very high	110 Å²	110	70.2 Å²	70.2	51%	0.514	33%	0.332	S	S	.	.	H	α-helix	trans	-69.6	-45	175.2	-172.3	160.9	-142.6	0	0	112.2	K430 V432 L436 D437	K430-E434 WeakPolarHBondContact O-CB 3.42Å; K430-E434 PolarHBondContact O-N 3.13Å; V432-E434 VanDerWaalsContact C-N 3.26Å; V432-E434 PolarHBondContact O-N 3.48Å; E434-L436 VanDerWaalsContact C-N 3.3Å; E434-L436 PolarHBondContact O-N 3.26Å; E434-D437 PolarHBondContact O-N 3.45Å
435	H	94	Very high	93.6	Very high	159 Å²	159	67.3 Å²	67.3	74%	0.736	32%	0.321	S	S	*	.	H	α-helix	trans	-67.6	-26.8	177.7	-82.7	74	0	0	0	114	T431 V432	T431-H435 WeakPolarHBondContact O-CB 3.22Å; T431-H435 PolarHBondContact O-N 3.17Å; T431-H435 PolarHBondContact O-ND1 3.34Å; V432-H435 PolarHBondContact O-N 3Å
436	L	95.3	Very high	93.5	Very high	48 Å²	48	68 Å²	68	25%	0.251	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.1	13.4	179.2	-63.9	177.1	0	0	0	112.9	F393 V396 K397 I400 V432 E434 G438	F393-L436 HydrophobicContact CB-CD1 4.21Å; V396-L436 HydrophobicContact CB-CD1 4.43Å; V396-L436 HydrophobicContact CG1-CD1 3.94Å; K397-L436 HydrophobicContact CG-CD1 3.95Å; K397-L436 HydrophobicContact CG-CD2 4.25Å; I400-L436 HydrophobicContact CD1-CB 3.54Å; I400-L436 HydrophobicContact CD1-CD1 4.22Å; V432-L436 HydrophobicContact CG1-CD1 3.81Å; V432-L436 HydrophobicContact CG1-CG 4.45Å; V432-L436 WeakPolarHBondContact O-CB 3.29Å; V432-L436 WeakPolarHBondContact O-CG 3.47Å; V432-L436 PolarHBondContact O-N 2.72Å; E434-L436 VanDerWaalsContact C-N 3.3Å; E434-L436 PolarHBondContact O-N 3.26Å; L436-G438 PolarHBondContact O-N 2.81Å
437	D	94	Very high	93.5	Very high	101 Å²	101	70.4 Å²	70.4	54%	0.54	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.4	13.9	-176.2	-66	-53.2	0	0	0	115.1	I433 E434 K439 T440 M441	I433-D437 PolarHBondContact O-N 3.13Å; E434-D437 PolarHBondContact O-N 3.45Å; D437-K439 VanDerWaalsContact C-N 3.27Å; D437-K439 PolarHBondContact O-N 3.14Å; D437-T440 WeakPolarHBondContact O-CB 3.33Å; D437-T440 PolarHBondContact O-N 3.28Å; D437-T440 VanDerWaalsContact O-N 3.08Å; D437-M441 PolarHBondContact O-N 2.94Å
438	G	94.2	Very high	93.6	Very high	0 Å²	0	68.1 Å²	68.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.9	-34.2	-177.6	0	0	0	0	0	112.5	I433 L436 T440 M441 V442	I433-G438 PolarHBondContact O-N 3.24Å; L436-G438 PolarHBondContact O-N 2.81Å; G438-T440 VanDerWaalsContact C-N 3.32Å; G438-T440 PolarHBondContact O-N 3.4Å; G438-M441 PolarHBondContact O-N 3.02Å; G438-V442 WeakPolarHBondContact O-CG2 3.11Å; G438-V442 PolarHBondContact O-N 2.78Å
439	K	92	Very high	93.7	Very high	58 Å²	58	66.2 Å²	66.2	25%	0.252	34%	0.336	S	S	.	.	H	α-helix	trans	-60.4	-43	174.4	-179.5	-178.3	171.7	-168.1	0	111.5	I433 D437 M441 V442 M443 I464	I433-K439 HydrophobicContact CG2-CB 4.17Å; I433-K439 PolarHBondContact O-N 3.4Å; D437-K439 VanDerWaalsContact C-N 3.27Å; D437-K439 PolarHBondContact O-N 3.14Å; K439-M441 VanDerWaalsContact C-N 3.33Å; K439-V442 PolarHBondContact O-N 2.9Å; K439-M443 HydrophobicContact CG-SD 4.15Å; K439-M443 WeakPolarHBondContact O-CB 3.32Å; K439-M443 VanDerWaalsContact O-CG 3.31Å; K439-M443 WeakPolarHBondContact O-CG 3.22Å; K439-M443 PolarHBondContact O-N 2.88Å; K439-I464 HydrophobicContact CG-CG2 4.49Å
440	T	93.2	Very high	93.8	Very high	83 Å²	83	68.2 Å²	68.2	51%	0.509	35%	0.347	S	S	.	.	H	α-helix	trans	-63	-41.9	178.2	-53.5	0	0	0	0	110.7	D437 G438 M443 R444	D437-T440 WeakPolarHBondContact O-CB 3.33Å; D437-T440 PolarHBondContact O-N 3.28Å; D437-T440 VanDerWaalsContact O-N 3.08Å; G438-T440 VanDerWaalsContact C-N 3.32Å; G438-T440 PolarHBondContact O-N 3.4Å; T440-M443 PolarHBondContact O-N 3.46Å; T440-R444 PolarHBondContact O-N 3.35Å
441	M	93.3	Very high	94	Very high	46 Å²	46	68.4 Å²	68.4	23%	0.227	36%	0.356	C	S	.	.	H	α-helix	trans	-63.5	-45.6	177.1	-63.3	-56	148.5	0	0	112.5	I400 L403 D404 D437 G438 K439 M443 R444	I400-M441 HydrophobicContact CG2-CG 3.98Å; L403-M441 HydrophobicContact CB-CB 4.14Å; L403-M441 HydrophobicContact CD1-CB 4.09Å; D404-M441 HydrophobicContact CB-SD 4.29Å; D437-M441 PolarHBondContact O-N 2.94Å; G438-M441 PolarHBondContact O-N 3.02Å; K439-M441 VanDerWaalsContact C-N 3.33Å; M441-M443 VanDerWaalsContact C-N 3.35Å; M441-M443 PolarHBondContact O-N 3.01Å; M441-R444 PolarHBondContact O-N 3.4Å
442	V	94.6	Very high	94.1	Very high	0 Å²	0	69.3 Å²	69.3	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-64.6	-39.7	175.9	-178.6	0	0	0	0	111.1	L403 L419 G438 K439 R444 L445 A457 A460 V461 I464	L403-V442 HydrophobicContact CD1-CG2 3.6Å; L419-V442 HydrophobicContact CD1-CG2 3.83Å; G438-V442 WeakPolarHBondContact O-CG2 3.11Å; G438-V442 PolarHBondContact O-N 2.78Å; K439-V442 PolarHBondContact O-N 2.9Å; V442-R444 VanDerWaalsContact C-N 3.34Å; V442-R444 PolarHBondContact O-N 3Å; V442-L445 WeakPolarHBondContact O-CB 3.29Å; V442-L445 PolarHBondContact O-N 3.46Å; V442-A457 HydrophobicContact CG1-CB 4.28Å; V442-A460 HydrophobicContact CG1-CB 3.76Å; V442-V461 HydrophobicContact CB-CG2 4.49Å; V442-V461 HydrophobicContact CG1-CG2 3.72Å; V442-I464 HydrophobicContact CG2-CD1 4.48Å
443	M	93.1	Very high	94.3	Very high	73 Å²	73	68.6 Å²	68.6	36%	0.36	35%	0.354	S	S	.	.	H	α-helix	trans	-64	-36	179.1	-79	-177.8	135.2	0	0	113	K439 T440 M441 L445 L446 V461 M465	K439-M443 HydrophobicContact CG-SD 4.15Å; K439-M443 WeakPolarHBondContact O-CB 3.32Å; K439-M443 VanDerWaalsContact O-CG 3.31Å; K439-M443 WeakPolarHBondContact O-CG 3.22Å; K439-M443 PolarHBondContact O-N 2.88Å; T440-M443 PolarHBondContact O-N 3.46Å; M441-M443 VanDerWaalsContact C-N 3.35Å; M441-M443 PolarHBondContact O-N 3.01Å; M443-L445 PolarHBondContact O-N 3.45Å; M443-L446 VanDerWaalsContact O-CB 3.32Å; M443-L446 WeakPolarHBondContact O-CB 3.41Å; M443-L446 WeakPolarHBondContact O-CG 3.18Å; M443-L446 PolarHBondContact O-N 3.43Å; M443-L446 VanDerWaalsContact O-N 3.11Å; M443-V461 HydrophobicContact CG-CG2 4.15Å; M443-M465 HydrophobicContact CE-CE 4.5Å; M443-M465 HydrophobicContact CE-SD 3.68Å
444	R	93.9	Very high	94.4	Very high	167 Å²	167	73.1 Å²	73.1	63%	0.63	37%	0.371	S	S	*	.	H	α-helix	trans	-57.5	-34	174.9	-175.5	-179.5	176.6	-168.8	-3.2	112.1	D404 T440 M441 V442 L446 S447	D404-R444 IonicContact OD1-NH1 3.47Å; D404-R444 PolarHBondContact OD1-NH1 3.15Å; T440-R444 PolarHBondContact O-N 3.35Å; M441-R444 PolarHBondContact O-N 3.4Å; V442-R444 VanDerWaalsContact C-N 3.34Å; V442-R444 PolarHBondContact O-N 3Å; R444-L446 VanDerWaalsContact C-N 3.26Å; R444-L446 PolarHBondContact O-N 3.44Å; R444-S447 PolarHBondContact O-N 3.43Å
445	L	94.7	Very high	94.5	Very high	11 Å²	11	74.3 Å²	74.3	6%	0.058	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-73.1	-12.8	-179.6	-63.2	-179.4	0	0	0	114.2	L403 L412 A416 V442 M443 S447 H448 V453 A457	L403-L445 HydrophobicContact CD2-CD1 3.78Å; L412-L445 HydrophobicContact CB-CD1 4.45Å; L412-L445 HydrophobicContact CD1-CD2 4.15Å; L412-L445 HydrophobicContact CD2-CD1 4.38Å; L412-L445 HydrophobicContact CD2-CD2 4.35Å; A416-L445 HydrophobicContact CB-CD1 4.38Å; V442-L445 WeakPolarHBondContact O-CB 3.29Å; V442-L445 PolarHBondContact O-N 3.46Å; M443-L445 PolarHBondContact O-N 3.45Å; L445-S447 PolarHBondContact O-N 2.91Å; L445-H448 WeakPolarHBondContact O-CB 3.42Å; L445-H448 PolarHBondContact O-N 3.42Å; L445-H448 VanDerWaalsContact O-N 3.08Å; L445-V453 HydrophobicContact CB-CG1 3.96Å; L445-V453 HydrophobicContact CD1-CG1 4.27Å; L445-V453 HydrophobicContact CD2-CG1 4.03Å; L445-V453 HydrophobicContact CG-CG1 4.31Å; L445-A457 HydrophobicContact CB-CB 3.67Å
446	L	93.1	Very high	94.6	Very high	59 Å²	59	68.2 Å²	68.2	31%	0.309	34%	0.343	S	S	.	.	G	3₁₀ helix	trans	-63.7	-21.2	173.3	-62.8	174.6	0	0	0	112.6	M443 R444 R454 A457 L458 V461	M443-L446 VanDerWaalsContact O-CB 3.32Å; M443-L446 WeakPolarHBondContact O-CB 3.41Å; M443-L446 WeakPolarHBondContact O-CG 3.18Å; M443-L446 PolarHBondContact O-N 3.43Å; M443-L446 VanDerWaalsContact O-N 3.11Å; R444-L446 VanDerWaalsContact C-N 3.26Å; R444-L446 PolarHBondContact O-N 3.44Å; L446-R454 WeakPolarHBondContact O-CD 3.32Å; L446-R454 WeakPolarHBondContact O-CG 3.32Å; L446-A457 HydrophobicContact CD2-CB 3.97Å; L446-L458 HydrophobicContact CD2-CB 3.95Å; L446-L458 HydrophobicContact CD2-CD1 4.37Å; L446-V461 HydrophobicContact CD1-CG2 4.4Å
447	S	93.6	Very high	94.6	Very high	106 Å²	106	66 Å²	66	74%	0.741	33%	0.331	S	S	*	.	G	3₁₀ helix	trans	-105.2	13.9	175.9	-56.1	0	0	0	0	113.2	R444 L445	R444-S447 PolarHBondContact O-N 3.43Å; L445-S447 PolarHBondContact O-N 2.91Å
448	H	95.2	Very high	94.7	Very high	47 Å²	47	64.8 Å²	64.8	22%	0.218	33%	0.325	C	S	.	.			trans	-67	149.5	177.6	-168.3	-89.1	0	0	0	111.5	L445 D450 V453 R454	L445-H448 WeakPolarHBondContact O-CB 3.42Å; L445-H448 PolarHBondContact O-N 3.42Å; L445-H448 VanDerWaalsContact O-N 3.08Å; H448-D450 WeakPolarHBondContact ND1-CB 3.47Å; H448-D450 PolarHBondContact ND1-N 3.41Å; H448-D450 PolarHBondContact O-N 3.16Å; H448-V453 HydrophobicContact CB-CB 4.1Å; H448-V453 HydrophobicContact CB-CG1 3.65Å; H448-R454 HydrophobicContact CB-CG 4.38Å; H448-R454 WeakPolarHBondContact O-CD 3.3Å; H448-R454 WeakPolarHBondContact O-CG 3.47Å; H448-R454 PolarHBondContact O-NH1 2.89Å
449	D	94	Very high	94.7	Very high	152 Å²	152	66.6 Å²	66.6	81%	0.813	33%	0.334	S	S	*	.	S	Bend	trans	-66.6	-38.5	-177.1	-67.4	-36.1	0	0	0	112.8	P451 R454	D449-P451 WeakPolarHBondContact O-CD 3.29Å; D449-R454 VanDerWaalsContact C-NH1 3.33Å; D449-R454 PolarHBondContact O-NH1 3.19Å
450	D	95.8	Very high	94.8	Very high	42 Å²	42	63.9 Å²	63.9	23%	0.225	32%	0.322	C	S	.	.	S	Bend	trans	-70.2	122.8	176.8	-169.1	-66.7	0	0	0	112.1	P409 H448 N452 V453 R454	P409-D450 HydrophobicContact CB-CB 4.06Å; P409-D450 HydrophobicContact CG-CB 4.38Å; H448-D450 WeakPolarHBondContact ND1-CB 3.47Å; H448-D450 PolarHBondContact ND1-N 3.41Å; H448-D450 PolarHBondContact O-N 3.16Å; D450-N452 VanDerWaalsContact C-N 3.34Å; D450-N452 PolarHBondContact O-N 3.41Å; D450-N452 WeakPolarHBondContact OD1-CA 3.25Å; D450-N452 VanDerWaalsContact OD1-CB 3.23Å; D450-N452 WeakPolarHBondContact OD1-CB 3.38Å; D450-N452 PolarHBondContact OD1-N 3.17Å; D450-N452 PolarHBondContact OD1-ND2 2.95Å; D450-V453 HydrophobicContact CB-CB 4.2Å; D450-V453 HydrophobicContact CB-CG2 3.84Å; D450-V453 PolarHBondContact O-N 3.36Å; D450-V453 PolarHBondContact OD1-N 3.1Å; D450-R454 PolarHBondContact O-N 3.08Å
451	P	95.7	Very high	94.8	Very high	79 Å²	79	60.6 Å²	60.6	51%	0.513	30%	0.302	S	S	.	.	H	α-helix	trans	-60.9	-33.6	178.5	-21.7	31.7	0	0	0	115.4	D449 R454 Y455	D449-P451 WeakPolarHBondContact O-CD 3.29Å; P451-R454 PolarHBondContact O-N 3.01Å; P451-Y455 WeakPolarHBondContact O-CB 3.5Å; P451-Y455 PolarHBondContact O-N 3.34Å
452	N	95.2	Very high	94.6	Very high	98 Å²	98	59.1 Å²	59.1	52%	0.524	30%	0.295	S	S	.	.	H	α-helix	trans	-69.3	-39.1	179.3	-59.3	-61	0	0	0	110.7	D450 Y455 H456	D450-N452 VanDerWaalsContact C-N 3.34Å; D450-N452 PolarHBondContact O-N 3.41Å; D450-N452 WeakPolarHBondContact OD1-CA 3.25Å; D450-N452 VanDerWaalsContact OD1-CB 3.23Å; D450-N452 WeakPolarHBondContact OD1-CB 3.38Å; D450-N452 PolarHBondContact OD1-N 3.17Å; D450-N452 PolarHBondContact OD1-ND2 2.95Å; N452-Y455 WeakPolarHBondContact O-CB 3.48Å; N452-Y455 PolarHBondContact O-N 3.06Å; N452-H456 PolarHBondContact O-CD2 2.98Å; N452-H456 PolarHBondContact O-N 2.96Å
453	V	97.4	Very high	94.5	Very high	1 Å²	1	60.1 Å²	60.1	1%	0.006	30%	0.299	C	S	.	.	H	α-helix	trans	-61.2	-47.1	175.4	176.6	0	0	0	0	110.1	P409 L412 C413 L445 H448 D450 Y455 H456 A457	P409-V453 HydrophobicContact CB-CG2 3.78Å; P409-V453 WeakPolarHBondContact O-CG2 3.2Å; L412-V453 HydrophobicContact CB-CG1 4.18Å; L412-V453 HydrophobicContact CB-CG2 4.17Å; L412-V453 HydrophobicContact CD1-CG1 4.47Å; C413-V453 VanDerWaalsContact SG-CA 3.57Å; C413-V453 PolarHBondContact SG-N 3.08Å; C413-V453 VanDerWaalsContact SG-N 3.44Å; L445-V453 HydrophobicContact CB-CG1 3.96Å; L445-V453 HydrophobicContact CD1-CG1 4.27Å; L445-V453 HydrophobicContact CD2-CG1 4.03Å; L445-V453 HydrophobicContact CG-CG1 4.31Å; H448-V453 HydrophobicContact CB-CB 4.1Å; H448-V453 HydrophobicContact CB-CG1 3.65Å; D450-V453 HydrophobicContact CB-CB 4.2Å; D450-V453 HydrophobicContact CB-CG2 3.84Å; D450-V453 PolarHBondContact O-N 3.36Å; D450-V453 PolarHBondContact OD1-N 3.1Å; V453-Y455 VanDerWaalsContact C-N 3.29Å; V453-Y455 PolarHBondContact O-N 3.3Å; V453-H456 PolarHBondContact O-N 3.16Å; V453-A457 WeakPolarHBondContact O-CB 3.49Å; V453-A457 PolarHBondContact O-N 3.41Å
454	R	96.7	Very high	94.3	Very high	95 Å²	95	56.9 Å²	56.9	36%	0.358	28%	0.283	S	S	.	.	H	α-helix	trans	-58.9	-41.5	175.3	-64.4	-167.1	-63	-94	1.3	112.1	L446 H448 D449 D450 P451 L458	L446-R454 WeakPolarHBondContact O-CD 3.32Å; L446-R454 WeakPolarHBondContact O-CG 3.32Å; H448-R454 HydrophobicContact CB-CG 4.38Å; H448-R454 WeakPolarHBondContact O-CD 3.3Å; H448-R454 WeakPolarHBondContact O-CG 3.47Å; H448-R454 PolarHBondContact O-NH1 2.89Å; D449-R454 VanDerWaalsContact C-NH1 3.33Å; D449-R454 PolarHBondContact O-NH1 3.19Å; D450-R454 PolarHBondContact O-N 3.08Å; P451-R454 PolarHBondContact O-N 3.01Å; R454-L458 WeakPolarHBondContact O-CB 3.47Å; R454-L458 PolarHBondContact O-N 3.42Å
455	Y	95.8	Very high	93.7	Very high	135 Å²	135	53 Å²	53	53%	0.529	27%	0.274	S	S	.	.	H	α-helix	trans	-63.1	-51.4	178.7	175.5	-103.4	0	0	0	112.3	P451 N452 V453 A457 L458 L459	P451-Y455 WeakPolarHBondContact O-CB 3.5Å; P451-Y455 PolarHBondContact O-N 3.34Å; N452-Y455 WeakPolarHBondContact O-CB 3.48Å; N452-Y455 PolarHBondContact O-N 3.06Å; V453-Y455 VanDerWaalsContact C-N 3.29Å; V453-Y455 PolarHBondContact O-N 3.3Å; Y455-A457 PolarHBondContact O-N 3.42Å; Y455-L458 PolarHBondContact O-N 3.09Å; Y455-L459 HydrophobicContact CD1-CD1 4.13Å; Y455-L459 HydrophobicContact CE1-CD1 3.51Å; Y455-L459 HydrophobicContact CE1-CG 4.38Å; Y455-L459 HydrophobicContact CE2-CD1 4.32Å; Y455-L459 HydrophobicContact CE2-CG 4.46Å; Y455-L459 WeakPolarHBondContact O-CG 3.47Å; Y455-L459 PolarHBondContact O-N 2.85Å
456	H	96.2	Very high	92.4	Very high	32 Å²	32	55.4 Å²	55.4	15%	0.148	29%	0.288	C	S	.	.	H	α-helix	trans	-67.1	-36.6	178.9	-79.4	-76	0	0	0	112.5	W371 C413 N452 V453 L459 A460	W371-H456 AromaticContact CH2-CE1 3.65Å; W371-H456 AromaticContact CH2-ND1 3.92Å; W371-H456 AromaticContact CZ2-CE1 3.36Å; W371-H456 WeakPolarHBondContact CZ2-CE1 3.37Å; W371-H456 AromaticContact CZ2-ND1 3.86Å; W371-H456 AromaticContact CZ2-NE2 3.61Å; C413-H456 HydrophobicContact CB-CB 4.18Å; N452-H456 PolarHBondContact O-CD2 2.98Å; N452-H456 PolarHBondContact O-N 2.96Å; V453-H456 PolarHBondContact O-N 3.16Å; H456-L459 PolarHBondContact O-N 3.45Å; H456-A460 WeakPolarHBondContact O-CB 3.41Å; H456-A460 PolarHBondContact O-N 3Å
457	A	95.7	Very high	90.6	Very high	0 Å²	0	60.6 Å²	60.6	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-61.2	-44.1	171.7	0	0	0	0	0	111.7	V442 L445 L446 V453 Y455 A460 V461	V442-A457 HydrophobicContact CG1-CB 4.28Å; L445-A457 HydrophobicContact CB-CB 3.67Å; L446-A457 HydrophobicContact CD2-CB 3.97Å; V453-A457 WeakPolarHBondContact O-CB 3.49Å; V453-A457 PolarHBondContact O-N 3.41Å; Y455-A457 PolarHBondContact O-N 3.42Å; A457-A460 PolarHBondContact O-N 2.99Å; A457-V461 VanDerWaalsContact O-CG2 3.3Å; A457-V461 WeakPolarHBondContact O-CG2 3.46Å; A457-V461 PolarHBondContact O-N 3.23Å
458	L	94.6	Very high	88.6	Confident	77 Å²	77	61.2 Å²	61.2	40%	0.403	31%	0.306	S	S	.	.	H	α-helix	trans	-61.1	-47.1	176.5	-179.7	63.9	0	0	0	111.7	L446 R454 Y455 A460 V461 Q462	L446-L458 HydrophobicContact CD2-CB 3.95Å; L446-L458 HydrophobicContact CD2-CD1 4.37Å; R454-L458 WeakPolarHBondContact O-CB 3.47Å; R454-L458 PolarHBondContact O-N 3.42Å; Y455-L458 PolarHBondContact O-N 3.09Å; L458-A460 VanDerWaalsContact C-N 3.31Å; L458-A460 PolarHBondContact O-N 3.47Å; L458-V461 PolarHBondContact O-N 3.37Å; L458-Q462 VanDerWaalsContact O-CG 3.3Å; L458-Q462 WeakPolarHBondContact O-CG 3.36Å; L458-Q462 PolarHBondContact O-N 3.47Å
459	L	94.2	Very high	86.9	Confident	38 Å²	38	61.9 Å²	61.9	20%	0.199	31%	0.306	C	S	.	.	H	α-helix	trans	-60.1	-41.6	176.4	-70.4	179.7	0	0	0	112.1	Y455 H456 Q462 K463	Y455-L459 HydrophobicContact CD1-CD1 4.13Å; Y455-L459 HydrophobicContact CE1-CD1 3.51Å; Y455-L459 HydrophobicContact CE1-CG 4.38Å; Y455-L459 HydrophobicContact CE2-CD1 4.32Å; Y455-L459 HydrophobicContact CE2-CG 4.46Å; Y455-L459 WeakPolarHBondContact O-CG 3.47Å; Y455-L459 PolarHBondContact O-N 2.85Å; H456-L459 PolarHBondContact O-N 3.45Å; L459-Q462 PolarHBondContact O-N 3.48Å; L459-K463 WeakPolarHBondContact O-CG 3.15Å; L459-K463 PolarHBondContact O-N 3.43Å; L459-K463 VanDerWaalsContact O-N 3.11Å
460	A	94.7	Very high	85	Confident	0 Å²	0	59.9 Å²	59.9	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.1	-46.8	176.4	0	0	0	0	0	111.5	A416 V442 H456 A457 L458 Q462 K463 I464	A416-A460 HydrophobicContact CB-CB 4.44Å; A416-A460 WeakPolarHBondContact O-CB 3.26Å; V442-A460 HydrophobicContact CG1-CB 3.76Å; H456-A460 WeakPolarHBondContact O-CB 3.41Å; H456-A460 PolarHBondContact O-N 3Å; A457-A460 PolarHBondContact O-N 2.99Å; L458-A460 VanDerWaalsContact C-N 3.31Å; L458-A460 PolarHBondContact O-N 3.47Å; A460-Q462 VanDerWaalsContact C-N 3.31Å; A460-Q462 PolarHBondContact O-N 3.11Å; A460-K463 PolarHBondContact O-N 3Å; A460-I464 WeakPolarHBondContact O-CD1 3.34Å; A460-I464 WeakPolarHBondContact O-CG1 3.3Å; A460-I464 PolarHBondContact O-N 3.45Å
461	V	92.7	Very high	82.9	Confident	14 Å²	14	66.4 Å²	66.4	9%	0.085	32%	0.315	C	S	.	.	H	α-helix	trans	-59.6	-41.4	176	171.8	0	0	0	0	111.3	V442 M443 L446 A457 L458 K463 I464 M465	V442-V461 HydrophobicContact CB-CG2 4.49Å; V442-V461 HydrophobicContact CG1-CG2 3.72Å; M443-V461 HydrophobicContact CG-CG2 4.15Å; L446-V461 HydrophobicContact CD1-CG2 4.4Å; A457-V461 VanDerWaalsContact O-CG2 3.3Å; A457-V461 WeakPolarHBondContact O-CG2 3.46Å; A457-V461 PolarHBondContact O-N 3.23Å; L458-V461 PolarHBondContact O-N 3.37Å; V461-K463 PolarHBondContact O-N 3.41Å; V461-I464 PolarHBondContact O-N 2.93Å; V461-M465 HydrophobicContact CG1-CG 3.94Å; V461-M465 HydrophobicContact CG1-SD 3.46Å; V461-M465 WeakPolarHBondContact CG1-SD 3.43Å; V461-M465 VanDerWaalsContact O-CB 3.3Å; V461-M465 WeakPolarHBondContact O-CB 3.45Å; V461-M465 WeakPolarHBondContact O-CG 3.31Å; V461-M465 PolarHBondContact O-N 2.97Å
462	Q	90.4	Very high	80.9	Confident	16 Å²	16	65.9 Å²	65.9	8%	0.075	31%	0.307	C	S	.	.	H	α-helix	trans	-59.3	-46.2	176.2	-73	174.1	0.6	0	0	111.6	L458 L459 A460 I464 V466 L472	L458-Q462 VanDerWaalsContact O-CG 3.3Å; L458-Q462 WeakPolarHBondContact O-CG 3.36Å; L458-Q462 PolarHBondContact O-N 3.47Å; L459-Q462 PolarHBondContact O-N 3.48Å; A460-Q462 VanDerWaalsContact C-N 3.31Å; A460-Q462 PolarHBondContact O-N 3.11Å; Q462-I464 VanDerWaalsContact C-N 3.31Å; Q462-I464 PolarHBondContact O-N 3Å; Q462-V466 WeakPolarHBondContact O-CB 3.4Å; Q462-V466 PolarHBondContact O-N 3.36Å; Q462-L472 HydrophobicContact CG-CD2 3.91Å
463	K	91.2	Very high	79	Confident	21 Å²	21	62.3 Å²	62.3	9%	0.091	29%	0.294	C	S	.	.	H	α-helix	trans	-64	-34.9	176.2	-66.5	171.6	-168.1	175.3	0	112.3	G420 E421 L459 A460 V461 W469	G420-K463 WeakPolarHBondContact O-CD 3.32Å; E421-K463 WeakPolarHBondContact OE1-CE 3.15Å; E421-K463 IonicContact OE1-NZ 2.64Å; E421-K463 PolarHBondContact OE1-NZ 3.15Å; L459-K463 WeakPolarHBondContact O-CG 3.15Å; L459-K463 PolarHBondContact O-N 3.43Å; L459-K463 VanDerWaalsContact O-N 3.11Å; A460-K463 PolarHBondContact O-N 3Å; V461-K463 PolarHBondContact O-N 3.41Å; K463-W469 HydrophobicContact CG-CD2 4.15Å; K463-W469 HydrophobicContact CG-CE3 4.46Å; K463-W469 HydrophobicContact CG-CG 4.28Å
464	I	89.7	Confident	77.1	Confident	5 Å²	5	68.9 Å²	68.9	3%	0.026	32%	0.322	C	S	.	.	H	α-helix	trans	-76.5	-40.3	179.7	-66.1	162.7	0	0	0	112.1	V423 K430 I433 K439 V442 A460 V461 Q462	V423-I464 HydrophobicContact CB-CG1 4.41Å; V423-I464 HydrophobicContact CG2-CG1 4.14Å; K430-I464 VanDerWaalsContact CD-O 3.31Å; K430-I464 WeakPolarHBondContact CD-O 3.34Å; K430-I464 WeakPolarHBondContact CE-O 3.37Å; K430-I464 PolarHBondContact NZ-O 3.11Å; I433-I464 HydrophobicContact CG2-CD1 4.3Å; K439-I464 HydrophobicContact CG-CG2 4.49Å; V442-I464 HydrophobicContact CG2-CD1 4.48Å; A460-I464 WeakPolarHBondContact O-CD1 3.34Å; A460-I464 WeakPolarHBondContact O-CG1 3.3Å; A460-I464 PolarHBondContact O-N 3.45Å; V461-I464 PolarHBondContact O-N 2.93Å; Q462-I464 VanDerWaalsContact C-N 3.31Å; Q462-I464 PolarHBondContact O-N 3Å
465	M	82.1	Confident	74.9	Confident	86 Å²	86	69.9 Å²	69.9	42%	0.424	33%	0.331	S	S	.	.	H	α-helix	trans	-93.2	-33.5	-168.6	-69.4	-170.1	61.1	0	0	114.1	M443 V461	M443-M465 HydrophobicContact CE-CE 4.5Å; M443-M465 HydrophobicContact CE-SD 3.68Å; V461-M465 HydrophobicContact CG1-CG 3.94Å; V461-M465 HydrophobicContact CG1-SD 3.46Å; V461-M465 WeakPolarHBondContact CG1-SD 3.43Å; V461-M465 VanDerWaalsContact O-CB 3.3Å; V461-M465 WeakPolarHBondContact O-CB 3.45Å; V461-M465 WeakPolarHBondContact O-CG 3.31Å; V461-M465 PolarHBondContact O-N 2.97Å
466	V	65.5	Low	73	Confident	61 Å²	61	67 Å²	67	37%	0.37	32%	0.324	S	S	.	.			trans	-103.7	126.5	-167	-173.7	0	0	0	0	111.5	Q462 N468	Q462-V466 WeakPolarHBondContact O-CB 3.4Å; Q462-V466 PolarHBondContact O-N 3.36Å; V466-N468 PolarHBondContact O-N 2.88Å
467	H	55.6	Low	71	Confident	167 Å²	167	71.8 Å²	71.8	77%	0.773	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	117.2	157.3	-81.8	-6.1	0	0	0	107.4
468	N	52.9	Low	68.9	Low	120 Å²	120	78 Å²	78	64%	0.642	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.7	43.7	-176.8	-49.4	-27.3	0	0	0	117	V466 E470 Y471	V466-N468 PolarHBondContact O-N 2.88Å; N468-E470 PolarHBondContact O-N 3.37Å; N468-E470 VanDerWaalsContact O-N 3.14Å; N468-Y471 HydrophobicContact CB-CD2 4.33Å; N468-Y471 PolarHBondContact O-N 3.41Å
469	W	58.1	Low	66.9	Low	61 Å²	61	78.9 Å²	78.9	23%	0.231	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-26.7	175.4	70.2	-87.5	0	0	0	115	R424 K463 Y471 L472 G473	R424-W469 HydrophobicContact CG-CZ2 4.33Å; R424-W469 VanDerWaalsContact CZ-CZ2 3.4Å; R424-W469 VanDerWaalsContact NE-CZ2 3.28Å; K463-W469 HydrophobicContact CG-CD2 4.15Å; K463-W469 HydrophobicContact CG-CE3 4.46Å; K463-W469 HydrophobicContact CG-CG 4.28Å; W469-Y471 PolarHBondContact O-N 2.97Å; W469-L472 PolarHBondContact O-N 3.4Å; W469-G473 PolarHBondContact O-N 2.89Å
470	E	54.6	Low	64.8	Low	110 Å²	110	81.4 Å²	81.4	51%	0.514	40%	0.396	S	S	.	.	H	α-helix	trans	-55.6	-33.1	177.6	-70.9	-175.6	175.8	0	0	113.5	N468 L472	N468-E470 PolarHBondContact O-N 3.37Å; N468-E470 VanDerWaalsContact O-N 3.14Å; E470-L472 VanDerWaalsContact C-N 3.34Å
471	Y	51.7	Low	62.5	Low	179 Å²	179	88 Å²	88	70%	0.702	43%	0.427	S	S	*	.	H	α-helix	trans	-70.7	-30.8	179.3	-86.7	-89	0	0	0	112.5	N468 W469	N468-Y471 HydrophobicContact CB-CD2 4.33Å; N468-Y471 PolarHBondContact O-N 3.41Å; W469-Y471 PolarHBondContact O-N 2.97Å
472	L	53.5	Low	60.3	Low	67 Å²	67	93.5 Å²	93.5	35%	0.351	45%	0.452	S	S	.	.	H	α-helix	trans	-79.1	-39.2	-177.8	-158.1	74.8	0	0	0	111.7	Q462 W469 E470 K474 Q475 L476	Q462-L472 HydrophobicContact CG-CD2 3.91Å; W469-L472 PolarHBondContact O-N 3.4Å; E470-L472 VanDerWaalsContact C-N 3.34Å; L472-K474 PolarHBondContact O-N 2.97Å; L472-Q475 WeakPolarHBondContact O-CB 3.41Å; L472-Q475 PolarHBondContact O-N 3.25Å; L472-L476 PolarHBondContact O-N 3.13Å; L472-L476 VanDerWaalsContact O-N 3.16Å
473	G	56	Low	58.2	Low	23 Å²	23	96 Å²	96	24%	0.237	47%	0.47	C	S	.	.	H	α-helix	trans	-61.3	-42.1	177	0	0	0	0	0	112.8	W469 Q475 L476 E477	W469-G473 PolarHBondContact O-N 2.89Å; G473-Q475 VanDerWaalsContact C-N 3.28Å; G473-Q475 PolarHBondContact O-N 2.69Å; G473-L476 PolarHBondContact O-N 3.39Å; G473-E477 PolarHBondContact O-N 2.86Å
474	K	56.6	Low	56	Low	139 Å²	139	103 Å²	103	60%	0.604	50%	0.501	S	S	*	.	H	α-helix	trans	-65.1	-28.1	175.6	-71.9	179.2	-179.5	172.2	0	113.5	L472 K478	L472-K474 PolarHBondContact O-N 2.97Å; K474-K478 WeakPolarHBondContact O-CG 3.43Å; K474-K478 PolarHBondContact O-N 3.08Å
475	Q	51.6	Low	53.8	Low	116 Å²	116	106.7 Å²	106.7	54%	0.542	53%	0.525	S	S	.	.	H	α-helix	trans	-71.7	-42.8	173.2	-87.8	172.7	-30.9	0	0	111.4	L472 G473 K478 D479	L472-Q475 WeakPolarHBondContact O-CB 3.41Å; L472-Q475 PolarHBondContact O-N 3.25Å; G473-Q475 VanDerWaalsContact C-N 3.28Å; G473-Q475 PolarHBondContact O-N 2.69Å; Q475-K478 WeakPolarHBondContact O-CB 3.4Å; Q475-K478 PolarHBondContact O-N 3.36Å; Q475-D479 VanDerWaalsContact O-CG 3.22Å; Q475-D479 PolarHBondContact O-N 2.86Å
476	L	54.9	Low	51.9	Low	75 Å²	75	110.4 Å²	110.4	39%	0.393	54%	0.539	S	S	.	.	H	α-helix	trans	-66.9	-39.4	178.7	-73.7	162.4	0	0	0	112.9	L472 G473 K478 D479 T480	L472-L476 PolarHBondContact O-N 3.13Å; L472-L476 VanDerWaalsContact O-N 3.16Å; G473-L476 PolarHBondContact O-N 3.39Å; L476-K478 VanDerWaalsContact C-N 3.31Å; L476-K478 PolarHBondContact O-N 3.35Å; L476-D479 PolarHBondContact O-N 2.88Å; L476-T480 PolarHBondContact O-N 3.38Å; L476-T480 PolarHBondContact O-OG1 3.29Å
477	E	54.5	Low	50.9	Low	132 Å²	132	110.8 Å²	110.8	62%	0.617	55%	0.548	S	S	*	.	H	α-helix	trans	-63.2	-38.5	173.5	-75	-174.6	169	0	0	111.9	G473 T480 Q481	G473-E477 PolarHBondContact O-N 2.86Å; E477-T480 PolarHBondContact O-N 2.95Å; E477-Q481 WeakPolarHBondContact O-CB 3.46Å; E477-Q481 WeakPolarHBondContact O-CG 3.34Å; E477-Q481 PolarHBondContact O-N 3.13Å
478	K	51.6	Low	50.4	Low	132 Å²	132	106 Å²	106	57%	0.574	54%	0.538	S	S	*	.	H	α-helix	trans	-62.1	-44.7	171.2	-81.1	-178.6	174	-174.2	0	111.5	K474 Q475 L476 T480 Q481 E482	K474-K478 WeakPolarHBondContact O-CG 3.43Å; K474-K478 PolarHBondContact O-N 3.08Å; Q475-K478 WeakPolarHBondContact O-CB 3.4Å; Q475-K478 PolarHBondContact O-N 3.36Å; L476-K478 VanDerWaalsContact C-N 3.31Å; L476-K478 PolarHBondContact O-N 3.35Å; K478-T480 VanDerWaalsContact C-N 3.27Å; K478-T480 PolarHBondContact O-N 2.93Å; K478-Q481 PolarHBondContact O-N 3.37Å; K478-Q481 VanDerWaalsContact O-N 3.16Å; K478-E482 WeakPolarHBondContact O-CB 3.42Å; K478-E482 WeakPolarHBondContact O-CG 3.47Å; K478-E482 PolarHBondContact O-N 3.48Å
479	D	52	Low	49.8	Very low	95 Å²	95	107.5 Å²	107.5	51%	0.508	54%	0.541	S	S	.	.	H	α-helix	trans	-64.2	-32.6	177.6	-65.3	-22	0	0	0	112.3	Q475 L476 S483	Q475-D479 VanDerWaalsContact O-CG 3.22Å; Q475-D479 PolarHBondContact O-N 2.86Å; L476-D479 PolarHBondContact O-N 2.88Å; D479-S483 WeakPolarHBondContact O-CB 3.29Å; D479-S483 PolarHBondContact O-N 3.49Å; D479-S483 PolarHBondContact O-OG 2.96Å
480	T	51.3	Low	49.1	Very low	90 Å²	90	107.7 Å²	107.7	55%	0.552	56%	0.556	S	S	*	*	H	α-helix	trans	-76.9	-28	176.8	-38	0	0	0	0	112.2	L476 E477 K478 S483	L476-T480 PolarHBondContact O-N 3.38Å; L476-T480 PolarHBondContact O-OG1 3.29Å; E477-T480 PolarHBondContact O-N 2.95Å; K478-T480 VanDerWaalsContact C-N 3.27Å; K478-T480 PolarHBondContact O-N 2.93Å; T480-S483 WeakPolarHBondContact CA-OG 3.18Å; T480-S483 PolarHBondContact O-OG 2.71Å; T480-S483 VanDerWaalsContact O-OG 3.05Å
481	Q	45.9	Very low	48.7	Very low	140 Å²	140	105.5 Å²	105.5	65%	0.654	56%	0.557	S	S	*	*	H	α-helix	trans	-83	-36.2	173.5	-72.7	-177.2	7.6	0	0	112.4	E477 K478 S483 K484 P485	E477-Q481 WeakPolarHBondContact O-CB 3.46Å; E477-Q481 WeakPolarHBondContact O-CG 3.34Å; E477-Q481 PolarHBondContact O-N 3.13Å; K478-Q481 PolarHBondContact O-N 3.37Å; K478-Q481 VanDerWaalsContact O-N 3.16Å; Q481-S483 VanDerWaalsContact C-N 3.28Å; Q481-S483 PolarHBondContact O-N 3.18Å; Q481-K484 PolarHBondContact O-N 3.28Å; Q481-P485 WeakPolarHBondContact O-CD 3.47Å
482	E	46.4	Very low	48.4	Very low	129 Å²	129	105.1 Å²	105.1	60%	0.603	56%	0.559	S	S	*	*	H	α-helix	trans	-74.8	-14.7	177.4	-74.1	-174.2	-171.6	0	0	113.6	K478 P485	K478-E482 WeakPolarHBondContact O-CB 3.42Å; K478-E482 WeakPolarHBondContact O-CG 3.47Å; K478-E482 PolarHBondContact O-N 3.48Å; E482-P485 VanDerWaalsContact O-CD 3.31Å; E482-P485 WeakPolarHBondContact O-CD 3.48Å
483	S	46.5	Very low	48	Very low	67 Å²	67	110.4 Å²	110.4	47%	0.469	58%	0.579	S	S	.	*	H	α-helix	trans	-80.9	-17.2	172.5	45.3	0	0	0	0	113.6	D479 T480 Q481	D479-S483 WeakPolarHBondContact O-CB 3.29Å; D479-S483 PolarHBondContact O-N 3.49Å; D479-S483 PolarHBondContact O-OG 2.96Å; T480-S483 WeakPolarHBondContact CA-OG 3.18Å; T480-S483 PolarHBondContact O-OG 2.71Å; T480-S483 VanDerWaalsContact O-OG 3.05Å; Q481-S483 VanDerWaalsContact C-N 3.28Å; Q481-S483 PolarHBondContact O-N 3.18Å
484	K	44.1	Very low	47.5	Very low	169 Å²	169	112.9 Å²	112.9	74%	0.735	60%	0.597	S	S	*	*	H	α-helix	trans	-70.3	-37	178	-76.4	-173.9	176.3	178.9	0	115.3	Q481	Q481-K484 PolarHBondContact O-N 3.28Å
485	P	44.3	Very low	47	Very low	82 Å²	82	112.9 Å²	112.9	53%	0.532	60%	0.603	S	S	.	*	H	α-helix	trans	-77.2	-26.3	-179.4	-13.5	28.7	0	0	0	113.6	Q481 E482 A488 Q489	Q481-P485 WeakPolarHBondContact O-CD 3.47Å; E482-P485 VanDerWaalsContact O-CD 3.31Å; E482-P485 WeakPolarHBondContact O-CD 3.48Å; P485-A488 PolarHBondContact O-N 3.38Å; P485-Q489 PolarHBondContact O-N 3.05Å
486	K	42.9	Very low	46.6	Very low	164 Å²	164	114.2 Å²	114.2	71%	0.713	61%	0.614	S	S	*	*	H	α-helix	trans	-72.5	-30.9	-176.7	-74.8	-176.2	179	172.4	0	113.1	A490	K486-A490 PolarHBondContact O-N 3.48Å
487	A	43.3	Very low	46.2	Very low	69 Å²	69	116.8 Å²	116.8	57%	0.57	63%	0.633	S	S	*	*	H	α-helix	trans	-68.4	-35.1	175.3	0	0	0	0	0	112.6	A491	A487-A491 PolarHBondContact O-N 3.39Å
488	A	44.7	Very low	45.4	Very low	67 Å²	67	114.7 Å²	114.7	55%	0.554	64%	0.638	S	S	*	*	H	α-helix	trans	-72.1	-30.1	-179.9	0	0	0	0	0	113.3	P485	P485-A488 PolarHBondContact O-N 3.38Å
489	Q	41	Very low	44.9	Very low	151 Å²	151	114.8 Å²	114.8	71%	0.706	65%	0.65	S	S	*	*	H	α-helix	trans	-78.1	-30.6	176	-94.7	178.9	-1.9	0	0	113.4	P485	P485-Q489 PolarHBondContact O-N 3.05Å
490	A	44	Very low	44.2	Very low	66 Å²	66	115.9 Å²	115.9	55%	0.545	66%	0.662	S	S	.	*	H	α-helix	trans	-70.3	-38	177.2	0	0	0	0	0	112.2	K486 K492 K493	K486-A490 PolarHBondContact O-N 3.48Å; A490-K492 VanDerWaalsContact C-N 3.33Å; A490-K492 PolarHBondContact O-N 3.36Å; A490-K493 PolarHBondContact O-N 2.72Å
491	A	45.4	Very low	43.3	Very low	64 Å²	64	116.8 Å²	116.8	53%	0.529	68%	0.679	S	S	.	*	H	α-helix	trans	-66.6	-29.9	179.9	0	0	0	0	0	113.6	A487	A487-A491 PolarHBondContact O-N 3.39Å
492	K	45.6	Very low	42.9	Very low	171 Å²	171	119.7 Å²	119.7	74%	0.743	69%	0.689	S	S	*	*	H	α-helix	trans	-74.2	-31	177	-89.9	-173.9	173.1	-177.4	0	113.7	A490	A490-K492 VanDerWaalsContact C-N 3.33Å; A490-K492 PolarHBondContact O-N 3.36Å
493	K	45	Very low	42.3	Very low	177 Å²	177	122 Å²	122	77%	0.77	73%	0.731	S	S	*	*	H	α-helix	trans	-78.3	-20.2	-178.7	-79.3	-172.1	175.6	-176.4	0	114.1	A490	A490-K493 PolarHBondContact O-N 2.72Å
494	A	46.9	Very low	42.1	Very low	75 Å²	75	124.8 Å²	124.8	62%	0.62	74%	0.744	S	S	*	*	H	α-helix	trans	-80.9	-22.8	-177.1	0	0	0	0	0	114
495	N	44.8	Very low	41.9	Very low	139 Å²	139	122.5 Å²	122.5	74%	0.743	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.7	-15	-175.5	-85.8	-2.7	0	0	0	115
496	D	43.7	Very low	41.8	Very low	144 Å²	144	124.7 Å²	124.7	77%	0.77	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.3	2.8	-173.4	-74.7	-18.5	0	0	0	114.9
497	V	45.9	Very low	41.8	Very low	130 Å²	130	122.4 Å²	122.4	79%	0.788	76%	0.758	S	S	*	*	S	Bend	trans	-113.6	8.5	-174.9	-166.8	0	0	0	0	113.8
498	A	38.2	Very low	41.7	Very low	87 Å²	87	125.8 Å²	125.8	72%	0.719	77%	0.77	S	S	*	*			trans	-110.5	74.8	178.9	0	0	0	0	0	112.6
499	T	40.4	Very low	41.4	Very low	135 Å²	135	129.7 Å²	129.7	83%	0.828	79%	0.785	S	S	*	*			trans	-132.7	116.1	153.7	10.2	0	0	0	0	109.2
500	P	38.2	Very low	41.5	Very low	118 Å²	118	128.1 Å²	128.1	77%	0.766	79%	0.79	S	S	*	*			trans	-90.5	133.7	-166.3	33.8	-31.1	0	0	0	111.8	K502	P500-K502 PolarHBondContact O-N 3.34Å
501	A	32.6	Very low	41.3	Very low	108 Å²	108	132.9 Å²	132.9	89%	0.893	81%	0.809	S	S	*	*			trans	-68.5	116.6	162.5	0	0	0	0	0	109.4
502	K	36.8	Very low	40.9	Very low	202 Å²	202	138.7 Å²	138.7	88%	0.878	83%	0.832	S	S	*	*			trans	-119.5	139.5	159.7	-89.5	-172.7	175.2	-179.1	0	108.6	P500	P500-K502 PolarHBondContact O-N 3.34Å
503	A	33.3	Very low	40.5	Very low	178 Å²	178	135.7 Å²	135.7	100%	1.471	84%	0.841	S	S	*	*			trans	-43.2	0	-174.3	0	0	0	0	0	116.1

Retrieved 503 of 503 residues in 798.7 ms (Link to these results)

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