A0A077Z1E2_TRITR Loading...

MFS 1 domain containing protein

AlphaFold DB , UniProt , Accession A0A077Z1E2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 680 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	31.2	Very low	34.7	Very low	181 Å²	181	70.5 Å²	70.5	89%	0.892	39%	0.393	S	S	*	.				0	130.1	0	-73.2	-174.2	168.8	0	0	107.9	L5	M1-L5 HydrophobicContact CB-CD2 4.38Å; M1-L5 HydrophobicContact CE-CD2 4.11Å; M1-L5 HydrophobicContact CG-CD2 4Å; M1-L5 HydrophobicContact SD-CD2 3.89Å
2	P	26.3	Very low	35.2	Very low	90 Å²	90	65.6 Å²	65.6	58%	0.584	37%	0.365	S	S	*	.			trans	-57.1	144.8	168.1	23.5	-28.6	0	0	0	108.9	D4 L5	P2-D4 PolarHBondContact O-N 2.98Å; P2-L5 HydrophobicContact CG-CB 4.47Å; P2-L5 PolarHBondContact O-N 3.26Å
3	S	29.1	Very low	35.5	Very low	98 Å²	98	62.9 Å²	62.9	69%	0.685	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.8	-21.2	-172.3	46	0	0	0	0	114.6
4	D	32.9	Very low	35.8	Very low	89 Å²	89	64.7 Å²	64.7	48%	0.476	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	-14	-168.2	-53.3	-17.9	0	0	0	113	P2 T7 R8	P2-D4 PolarHBondContact O-N 2.98Å; D4-T7 PolarHBondContact O-N 2.96Å; D4-R8 WeakPolarHBondContact O-CB 3.14Å; D4-R8 PolarHBondContact O-N 3.35Å
5	L	33.5	Very low	35.9	Very low	36 Å²	36	64 Å²	64	19%	0.188	36%	0.359	C	S	.	.	H	α-helix	trans	-59.5	-43.1	-178.2	-168.6	71.6	0	0	0	113.2	M1 P2 T7 R8 I9 E45	M1-L5 HydrophobicContact CB-CD2 4.38Å; M1-L5 HydrophobicContact CE-CD2 4.11Å; M1-L5 HydrophobicContact CG-CD2 4Å; M1-L5 HydrophobicContact SD-CD2 3.89Å; P2-L5 HydrophobicContact CG-CB 4.47Å; P2-L5 PolarHBondContact O-N 3.26Å; L5-T7 VanDerWaalsContact C-N 3.35Å; L5-T7 PolarHBondContact O-N 3.07Å; L5-R8 PolarHBondContact O-N 2.76Å; L5-I9 HydrophobicContact CD1-CD1 4.23Å; L5-I9 HydrophobicContact CD2-CD1 4.34Å; L5-I9 HydrophobicContact CG-CD1 3.77Å; L5-I9 HydrophobicContact CG-CG1 4.41Å; L5-I9 WeakPolarHBondContact O-CB 3.35Å; L5-I9 WeakPolarHBondContact O-CG1 3.46Å; L5-I9 PolarHBondContact O-N 3.02Å; L5-E45 HydrophobicContact CD1-CG 4.45Å
6	P	34.2	Very low	35.9	Very low	41 Å²	41	62.4 Å²	62.4	27%	0.266	35%	0.349	S	S	.	.	H	α-helix	trans	-65.5	-36.7	177.9	-19.6	33.1	0	0	0	113.1	R10 L396	P6-R10 WeakPolarHBondContact O-CB 3.08Å; P6-R10 WeakPolarHBondContact O-CG 3.32Å; P6-R10 PolarHBondContact O-N 2.94Å; P6-L396 HydrophobicContact CB-CD1 4.16Å; P6-L396 HydrophobicContact CG-CD1 4.23Å
7	T	37.1	Very low	35.8	Very low	64 Å²	64	63.5 Å²	63.5	39%	0.393	35%	0.354	S	S	.	.	H	α-helix	trans	-69.8	-43.3	179.3	-40.8	0	0	0	0	110.4	D4 L5 R10 S11	D4-T7 PolarHBondContact O-N 2.96Å; L5-T7 VanDerWaalsContact C-N 3.35Å; L5-T7 PolarHBondContact O-N 3.07Å; T7-R10 PolarHBondContact O-N 3.27Å; T7-S11 PolarHBondContact O-N 3Å
8	R	35.4	Very low	35.7	Very low	40 Å²	40	67.6 Å²	67.6	15%	0.151	37%	0.372	C	S	.	.	H	α-helix	trans	-64.7	-42.6	175.6	-164	179.4	-172.7	-147.6	6.7	112.4	D4 L5 R10 S11 I12 P39 E45	D4-R8 WeakPolarHBondContact O-CB 3.14Å; D4-R8 PolarHBondContact O-N 3.35Å; L5-R8 PolarHBondContact O-N 2.76Å; R8-R10 VanDerWaalsContact C-N 3.31Å; R8-R10 PolarHBondContact O-N 3.05Å; R8-S11 PolarHBondContact O-N 3.02Å; R8-S11 PolarHBondContact O-OG 3.15Å; R8-I12 HydrophobicContact CG-CD1 4.23Å; R8-I12 WeakPolarHBondContact O-CB 3.26Å; R8-I12 WeakPolarHBondContact O-CD1 3.32Å; R8-I12 WeakPolarHBondContact O-CG1 3.35Å; R8-I12 PolarHBondContact O-N 3.11Å; R8-P39 VanDerWaalsContact NH2-CG 3.33Å; R8-E45 IonicContact CZ-OE1 3.84Å; R8-E45 IonicContact NH1-OE1 2.87Å; R8-E45 PolarHBondContact NH1-OE1 3.16Å
9	I	39.6	Very low	35.4	Very low	11 Å²	11	70.9 Å²	70.9	6%	0.056	38%	0.384	C	S	.	.	H	α-helix	trans	-64.3	-36.6	174.8	-69.7	169.2	0	0	0	111.1	L5 I12 S13 E45 I48 L52	L5-I9 HydrophobicContact CD1-CD1 4.23Å; L5-I9 HydrophobicContact CD2-CD1 4.34Å; L5-I9 HydrophobicContact CG-CD1 3.77Å; L5-I9 HydrophobicContact CG-CG1 4.41Å; L5-I9 WeakPolarHBondContact O-CB 3.35Å; L5-I9 WeakPolarHBondContact O-CG1 3.46Å; L5-I9 PolarHBondContact O-N 3.02Å; I9-I12 PolarHBondContact O-N 3.45Å; I9-S13 PolarHBondContact O-N 2.74Å; I9-E45 HydrophobicContact CG1-CG 4.36Å; I9-I48 HydrophobicContact CD1-CB 4.26Å; I9-I48 HydrophobicContact CD1-CD1 3.82Å; I9-I48 HydrophobicContact CD1-CG2 3.98Å; I9-I48 HydrophobicContact CG2-CB 4.5Å; I9-I48 HydrophobicContact CG2-CG2 3.96Å; I9-L52 HydrophobicContact CG2-CD1 3.98Å
10	R	42	Very low	35.2	Very low	78 Å²	78	72.9 Å²	72.9	29%	0.294	39%	0.391	S	S	.	.	H	α-helix	trans	-69.3	-41.6	175.3	-80.1	-178.3	-172.6	-176.1	-0.7	112.9	P6 T7 R8 I12 S13 Q14 D397	P6-R10 WeakPolarHBondContact O-CB 3.08Å; P6-R10 WeakPolarHBondContact O-CG 3.32Å; P6-R10 PolarHBondContact O-N 2.94Å; T7-R10 PolarHBondContact O-N 3.27Å; R8-R10 VanDerWaalsContact C-N 3.31Å; R8-R10 PolarHBondContact O-N 3.05Å; R10-I12 VanDerWaalsContact C-N 3.25Å; R10-I12 PolarHBondContact O-N 3.44Å; R10-S13 PolarHBondContact O-N 2.7Å; R10-Q14 WeakPolarHBondContact O-CB 3.47Å; R10-Q14 WeakPolarHBondContact O-CG 3.37Å; R10-Q14 PolarHBondContact O-N 3.09Å; R10-D397 IonicContact NH2-OD1 3.24Å; R10-D397 PolarHBondContact NH2-OD1 3.49Å
11	S	40.7	Very low	35.1	Very low	48 Å²	48	72.8 Å²	72.8	34%	0.336	40%	0.4	S	S	.	.	H	α-helix	trans	-64.3	-34.7	174.6	67.3	0	0	0	0	111.2	T7 R8 S15	T7-S11 PolarHBondContact O-N 3Å; R8-S11 PolarHBondContact O-N 3.02Å; R8-S11 PolarHBondContact O-OG 3.15Å; S11-S15 VanDerWaalsContact O-CB 3.29Å; S11-S15 WeakPolarHBondContact O-CB 3.47Å; S11-S15 PolarHBondContact O-N 3.49Å; S11-S15 PolarHBondContact O-OG 3.49Å
12	I	39.8	Very low	35	Very low	11 Å²	11	67.9 Å²	67.9	6%	0.056	38%	0.384	C	S	.	.	H	α-helix	trans	-64.4	-49.3	171.1	-67.6	162.9	0	0	0	111.1	R8 I9 R10 Q14 S15 I16 V41 E45	R8-I12 HydrophobicContact CG-CD1 4.23Å; R8-I12 WeakPolarHBondContact O-CB 3.26Å; R8-I12 WeakPolarHBondContact O-CD1 3.32Å; R8-I12 WeakPolarHBondContact O-CG1 3.35Å; R8-I12 PolarHBondContact O-N 3.11Å; I9-I12 PolarHBondContact O-N 3.45Å; R10-I12 VanDerWaalsContact C-N 3.25Å; R10-I12 PolarHBondContact O-N 3.44Å; I12-Q14 VanDerWaalsContact C-N 3.35Å; I12-Q14 PolarHBondContact O-N 3.11Å; I12-S15 WeakPolarHBondContact CA-OG 3.49Å; I12-S15 PolarHBondContact O-N 3.35Å; I12-S15 PolarHBondContact O-OG 3.41Å; I12-I16 HydrophobicContact CG2-CD1 3.79Å; I12-I16 HydrophobicContact CG2-CG1 4.49Å; I12-I16 VanDerWaalsContact O-CG1 3.23Å; I12-I16 WeakPolarHBondContact O-CG1 3.34Å; I12-I16 PolarHBondContact O-N 3.22Å; I12-V41 HydrophobicContact CD1-CG1 4.1Å; I12-V41 HydrophobicContact CD1-CG2 3.87Å; I12-V41 HydrophobicContact CG1-CG2 4.03Å; I12-V41 HydrophobicContact CG2-CG1 4.23Å; I12-V41 HydrophobicContact CG2-CG2 4.3Å; I12-E45 HydrophobicContact CD1-CB 4.5Å
13	S	40.2	Very low	35.2	Very low	31 Å²	31	70.7 Å²	70.7	22%	0.217	39%	0.394	C	S	.	.	H	α-helix	trans	-57.5	-45.7	175.9	-174.9	0	0	0	0	111.9	I9 R10 I16 D17	I9-S13 PolarHBondContact O-N 2.74Å; R10-S13 PolarHBondContact O-N 2.7Å; S13-I16 PolarHBondContact O-N 3.2Å; S13-D17 VanDerWaalsContact O-CG 3.24Å; S13-D17 PolarHBondContact O-N 3.39Å
14	Q	39.7	Very low	35.2	Very low	88 Å²	88	69.4 Å²	69.4	41%	0.411	40%	0.396	S	S	.	.	H	α-helix	trans	-69.9	-34.7	-179.9	-74.6	-179.8	-15.4	0	0	113	R10 I12 D17 M18	R10-Q14 WeakPolarHBondContact O-CB 3.47Å; R10-Q14 WeakPolarHBondContact O-CG 3.37Å; R10-Q14 PolarHBondContact O-N 3.09Å; I12-Q14 VanDerWaalsContact C-N 3.35Å; I12-Q14 PolarHBondContact O-N 3.11Å; Q14-D17 PolarHBondContact O-N 2.81Å; Q14-M18 WeakPolarHBondContact O-CB 3.39Å; Q14-M18 WeakPolarHBondContact O-CG 3.32Å; Q14-M18 PolarHBondContact O-N 3.45Å
15	S	36.1	Very low	35	Very low	54 Å²	54	68 Å²	68	38%	0.378	40%	0.402	S	S	.	.	H	α-helix	trans	-70.7	-35.3	174.7	50.3	0	0	0	0	111.9	S11 I12 M18 Q19	S11-S15 VanDerWaalsContact O-CB 3.29Å; S11-S15 WeakPolarHBondContact O-CB 3.47Å; S11-S15 PolarHBondContact O-N 3.49Å; S11-S15 PolarHBondContact O-OG 3.49Å; I12-S15 WeakPolarHBondContact CA-OG 3.49Å; I12-S15 PolarHBondContact O-N 3.35Å; I12-S15 PolarHBondContact O-OG 3.41Å; S15-M18 PolarHBondContact O-N 3.23Å; S15-Q19 WeakPolarHBondContact O-CG 3.24Å; S15-Q19 PolarHBondContact O-N 3.47Å
16	I	36.8	Very low	34.7	Very low	39 Å²	39	71.5 Å²	71.5	20%	0.2	43%	0.43	C	S	.	.	H	α-helix	trans	-63	-47.6	169	-66.3	165.8	0	0	0	110.2	I12 S13 M18 Q19 E20	I12-I16 HydrophobicContact CG2-CD1 3.79Å; I12-I16 HydrophobicContact CG2-CG1 4.49Å; I12-I16 VanDerWaalsContact O-CG1 3.23Å; I12-I16 WeakPolarHBondContact O-CG1 3.34Å; I12-I16 PolarHBondContact O-N 3.22Å; S13-I16 PolarHBondContact O-N 3.2Å; I16-M18 VanDerWaalsContact C-N 3.32Å; I16-M18 PolarHBondContact O-N 2.91Å; I16-Q19 WeakPolarHBondContact O-CB 3.48Å; I16-Q19 PolarHBondContact O-N 3.26Å; I16-Q19 VanDerWaalsContact O-N 3.16Å; I16-E20 PolarHBondContact O-N 2.85Å
17	D	34.3	Very low	34.4	Very low	80 Å²	80	78.4 Å²	78.4	43%	0.428	46%	0.456	S	S	.	.	H	α-helix	trans	-61.1	-38.2	177.6	-70.7	-30.2	0	0	0	112.2	S13 Q14 E20 A21	S13-D17 VanDerWaalsContact O-CG 3.24Å; S13-D17 PolarHBondContact O-N 3.39Å; Q14-D17 PolarHBondContact O-N 2.81Å; D17-E20 PolarHBondContact O-N 3.13Å; D17-A21 VanDerWaalsContact O-CB 3.3Å; D17-A21 WeakPolarHBondContact O-CB 3.48Å; D17-A21 PolarHBondContact O-N 2.81Å
18	M	34.2	Very low	33.8	Very low	138 Å²	138	85.1 Å²	85.1	68%	0.68	48%	0.479	S	S	*	.	H	α-helix	trans	-68.5	-36.9	175.4	-79.2	-163.2	-81.7	0	0	112.5	Q14 S15 I16 S22	Q14-M18 WeakPolarHBondContact O-CB 3.39Å; Q14-M18 WeakPolarHBondContact O-CG 3.32Å; Q14-M18 PolarHBondContact O-N 3.45Å; S15-M18 PolarHBondContact O-N 3.23Å; I16-M18 VanDerWaalsContact C-N 3.32Å; I16-M18 PolarHBondContact O-N 2.91Å; M18-S22 WeakPolarHBondContact O-CB 3.31Å; M18-S22 PolarHBondContact O-N 3.11Å; M18-S22 VanDerWaalsContact O-N 3.11Å
19	Q	29.2	Very low	33.4	Very low	130 Å²	130	88.4 Å²	88.4	61%	0.607	51%	0.509	S	S	*	.	H	α-helix	trans	-64.6	-43.1	171.7	-77.4	-177.3	-12.7	0	0	111.3	S15 I16 S22 N23	S15-Q19 WeakPolarHBondContact O-CG 3.24Å; S15-Q19 PolarHBondContact O-N 3.47Å; I16-Q19 WeakPolarHBondContact O-CB 3.48Å; I16-Q19 PolarHBondContact O-N 3.26Å; I16-Q19 VanDerWaalsContact O-N 3.16Å; Q19-S22 PolarHBondContact O-N 3.22Å; Q19-S22 PolarHBondContact O-OG 2.99Å; Q19-N23 PolarHBondContact O-N 3.4Å
20	E	32.8	Very low	32.7	Very low	111 Å²	111	94.5 Å²	94.5	52%	0.519	55%	0.547	S	S	.	.	H	α-helix	trans	-67.7	-40.6	178.1	-72	-174	-175.1	0	0	112.5	I16 D17 S22 N23 K250	I16-E20 PolarHBondContact O-N 2.85Å; D17-E20 PolarHBondContact O-N 3.13Å; E20-S22 VanDerWaalsContact C-N 3.29Å; E20-S22 PolarHBondContact O-N 3.44Å; E20-N23 PolarHBondContact O-N 3.27Å; E20-K250 IonicContact OE1-NZ 3.76Å
21	A	31.7	Very low	32.1	Very low	71 Å²	71	96.1 Å²	96.1	59%	0.587	57%	0.567	S	S	*	*	H	α-helix	trans	-63.9	-33.2	175.3	0	0	0	0	0	112.4	D17 N23 G24	D17-A21 VanDerWaalsContact O-CB 3.3Å; D17-A21 WeakPolarHBondContact O-CB 3.48Å; D17-A21 PolarHBondContact O-N 2.81Å; A21-N23 VanDerWaalsContact C-N 3.3Å; A21-N23 PolarHBondContact O-N 3.3Å; A21-G24 PolarHBondContact O-N 3.24Å
22	S	30.5	Very low	31.4	Very low	78 Å²	78	102.8 Å²	102.8	55%	0.545	59%	0.593	S	S	.	*	H	α-helix	trans	-69.2	-26.3	176.6	80.4	0	0	0	0	113.5	M18 Q19 E20 G24	M18-S22 WeakPolarHBondContact O-CB 3.31Å; M18-S22 PolarHBondContact O-N 3.11Å; M18-S22 VanDerWaalsContact O-N 3.11Å; Q19-S22 PolarHBondContact O-N 3.22Å; Q19-S22 PolarHBondContact O-OG 2.99Å; E20-S22 VanDerWaalsContact C-N 3.29Å; E20-S22 PolarHBondContact O-N 3.44Å; S22-G24 PolarHBondContact O-N 3.26Å
23	N	30.4	Very low	30.7	Very low	149 Å²	149	113.5 Å²	113.5	80%	0.797	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.3	-9.7	175.3	-79.5	-19.9	0	0	0	113	Q19 E20 A21	Q19-N23 PolarHBondContact O-N 3.4Å; E20-N23 PolarHBondContact O-N 3.27Å; A21-N23 VanDerWaalsContact C-N 3.3Å; A21-N23 PolarHBondContact O-N 3.3Å
24	G	28.9	Very low	30.4	Very low	70 Å²	70	117 Å²	117	72%	0.722	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.5	38	-175.6	0	0	0	0	0	114.7	A21 S22	A21-G24 PolarHBondContact O-N 3.24Å; S22-G24 PolarHBondContact O-N 3.26Å
25	G	27.9	Very low	30.1	Very low	60 Å²	60	118.7 Å²	118.7	62%	0.619	67%	0.666	S	S	*	*	S	Bend	trans	164.6	125.7	173.3	0	0	0	0	0	115.7	K27	G25-K27 PolarHBondContact O-N 2.89Å
26	S	26.4	Very low	30.2	Very low	109 Å²	109	121.2 Å²	121.2	76%	0.762	69%	0.691	S	S	*	*			trans	-44.2	127.3	177	162.3	0	0	0	0	115.9
27	K	27.9	Very low	30.1	Very low	187 Å²	187	126.8 Å²	126.8	81%	0.813	72%	0.721	S	S	*	*			trans	63.9	108.6	146.9	-69.7	-178.9	177.6	177.8	0	119.2	G25	G25-K27 PolarHBondContact O-N 2.89Å
28	K	26.1	Very low	30.4	Very low	204 Å²	204	128.2 Å²	128.2	89%	0.887	73%	0.726	S	S	*	*				133.8	84.1	128.9	-76.9	-176.7	178.4	-179.1	0	113.6
29	S	27.1	Very low	30.7	Very low	110 Å²	110	123.3 Å²	123.3	77%	0.769	71%	0.705	S	S	*	*			trans	174.7	119.5	134.2	51.8	0	0	0	0	106.9
30	T	24.8	Very low	31.8	Very low	139 Å²	139	122.3 Å²	122.3	85%	0.853	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-50.2	121.8	165.2	18.8	0	0	0	0	108.5	E32	T30-E32 PolarHBondContact O-N 2.91Å
31	P	28.3	Very low	32.8	Very low	112 Å²	112	120.5 Å²	120.5	73%	0.727	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-62.4	132.1	174	-0.5	10.9	0	0	0	107.7	R33	P31-R33 PolarHBondContact O-N 3.41Å; P31-R33 VanDerWaalsContact O-N 3.17Å
32	E	27.1	Very low	34.4	Very low	187 Å²	187	118.3 Å²	118.3	87%	0.874	69%	0.685	S	S	*	*	P	Polyproline II helix	trans	-47.7	125.6	162	-83.2	176.3	149.8	0	0	107.5	T30 P34	T30-E32 PolarHBondContact O-N 2.91Å; E32-P34 WeakPolarHBondContact O-CD 3.48Å; E32-P34 VanDerWaalsContact O-N 3.16Å
33	R	24.4	Very low	35.9	Very low	236 Å²	236	118.5 Å²	118.5	89%	0.891	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-54.3	124.3	174	-86.7	178.7	171.6	179.8	-3.1	106.6	P31 D35	P31-R33 PolarHBondContact O-N 3.41Å; P31-R33 VanDerWaalsContact O-N 3.17Å; R33-D35 PolarHBondContact O-N 3.34Å
34	P	33.1	Very low	37.2	Very low	104 Å²	104	111.7 Å²	111.7	68%	0.675	64%	0.641	S	S	*	*	P	Polyproline II helix	trans	-55.4	134.2	173.2	21.3	-29.6	0	0	0	108	E32 A36	E32-P34 WeakPolarHBondContact O-CD 3.48Å; E32-P34 VanDerWaalsContact O-N 3.16Å; P34-A36 PolarHBondContact O-N 2.92Å; P34-A36 VanDerWaalsContact O-N 3.1Å
35	D	33.5	Very low	38.9	Very low	124 Å²	124	108.7 Å²	108.7	66%	0.663	61%	0.609	S	S	*	*			trans	-39.8	119.4	-177.8	-89.2	-40.4	0	0	0	110.6	R33 N37 M38	R33-D35 PolarHBondContact O-N 3.34Å; D35-N37 PolarHBondContact O-N 3.5Å; D35-M38 PolarHBondContact O-N 3.36Å
36	A	39	Very low	40.9	Very low	107 Å²	107	109.6 Å²	109.6	88%	0.884	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-7.1	-177.9	0	0	0	0	0	113.5	P34	P34-A36 PolarHBondContact O-N 2.92Å; P34-A36 VanDerWaalsContact O-N 3.1Å
37	N	35.4	Very low	43	Very low	157 Å²	157	104.4 Å²	104.4	84%	0.84	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.4	3.8	176.7	-83.8	-10.3	0	0	0	114.5	D35	D35-N37 PolarHBondContact O-N 3.5Å
38	M	38.8	Very low	44.9	Very low	110 Å²	110	96.8 Å²	96.8	54%	0.542	53%	0.528	S	S	.	.	S	Bend	trans	-74.4	127.2	174.8	-118.8	-165.5	-91.1	0	0	110.5	D35	D35-M38 PolarHBondContact O-N 3.36Å
39	P	41	Very low	47	Very low	34 Å²	34	87.4 Å²	87.4	22%	0.221	49%	0.489	C	S	.	.	P	Polyproline II helix	trans	-59.1	147.1	174.2	-15.6	24.6	0	0	0	110.8	R8 V41 P423	R8-P39 VanDerWaalsContact NH2-CG 3.33Å; P39-V41 PolarHBondContact O-N 3.42Å; P39-P423 HydrophobicContact CB-CB 4.05Å
40	P	51.8	Low	49.3	Very low	110 Å²	110	82.6 Å²	82.6	71%	0.714	46%	0.455	S	S	*	.	P	Polyproline II helix	trans	-57.7	137.7	177.7	23.2	-32.2	0	0	0	111	T42	P40-T42 PolarHBondContact O-N 3.38Å
41	V	55.7	Low	51.6	Low	73 Å²	73	76 Å²	76	44%	0.442	41%	0.414	S	S	.	.	P	Polyproline II helix	trans	-60.5	129	176.8	178.9	0	0	0	0	109.1	I12 P39 E45 Q46	I12-V41 HydrophobicContact CD1-CG1 4.1Å; I12-V41 HydrophobicContact CD1-CG2 3.87Å; I12-V41 HydrophobicContact CG1-CG2 4.03Å; I12-V41 HydrophobicContact CG2-CG1 4.23Å; I12-V41 HydrophobicContact CG2-CG2 4.3Å; P39-V41 PolarHBondContact O-N 3.42Å; V41-E45 HydrophobicContact CG1-CB 3.86Å; V41-Q46 HydrophobicContact CG1-CB 4.46Å
42	T	64.8	Low	53.8	Low	25 Å²	25	73.5 Å²	73.5	15%	0.153	39%	0.394	C	S	.	.	P	Polyproline II helix	trans	-75.2	151.7	177.7	64.8	0	0	0	0	110.6	P40 G44 E45 Q46 V424 V426	P40-T42 PolarHBondContact O-N 3.38Å; T42-G44 PolarHBondContact O-N 2.86Å; T42-E45 WeakPolarHBondContact CG2-OE2 3.34Å; T42-E45 PolarHBondContact N-OE2 3.18Å; T42-E45 PolarHBondContact O-N 3.35Å; T42-E45 VanDerWaalsContact O-N 3.09Å; T42-E45 WeakPolarHBondContact OG1-CB 3.47Å; T42-E45 VanDerWaalsContact OG1-CD 3.26Å; T42-E45 WeakPolarHBondContact OG1-CG 3.24Å; T42-E45 PolarHBondContact OG1-N 3.4Å; T42-E45 VanDerWaalsContact OG1-N 3.09Å; T42-E45 PolarHBondContact OG1-OE2 3.5Å; T42-Q46 PolarHBondContact O-N 3.38Å; T42-V424 WeakPolarHBondContact CG2-O 3.38Å; T42-V426 HydrophobicContact CG2-CG2 4.05Å
43	K	62.2	Low	56.2	Low	81 Å²	81	66 Å²	66	35%	0.352	36%	0.36	S	S	.	.	H	α-helix	trans	-59.8	-29.4	175.1	-65.8	-172	176.4	-176.3	0	113	L47 S257 M258 S261	K43-L47 WeakPolarHBondContact O-CB 3.35Å; K43-L47 PolarHBondContact O-N 2.98Å; K43-S257 PolarHBondContact NZ-O 3.37Å; K43-M258 HydrophobicContact CB-CE 4.42Å; K43-M258 HydrophobicContact CB-CG 3.63Å; K43-M258 HydrophobicContact CB-SD 4.22Å; K43-M258 HydrophobicContact CD-CG 3.98Å; K43-M258 HydrophobicContact CG-CG 4.45Å; K43-S261 PolarHBondContact NZ-OG 3.2Å
44	G	57.6	Low	58.5	Low	6 Å²	6	58.6 Å²	58.6	6%	0.062	35%	0.349	C	S	.	.	H	α-helix	trans	-67.5	-43.8	173.5	0	0	0	0	0	112.7	T42 Q46 L47 I48	T42-G44 PolarHBondContact O-N 2.86Å; G44-Q46 VanDerWaalsContact C-N 3.33Å; G44-Q46 PolarHBondContact O-N 3.01Å; G44-L47 PolarHBondContact O-N 3.02Å; G44-I48 WeakPolarHBondContact O-CG1 3.47Å; G44-I48 PolarHBondContact O-N 3.21Å; G44-I48 VanDerWaalsContact O-N 3.07Å
45	E	64.6	Low	60.5	Low	8 Å²	8	55 Å²	55	4%	0.037	32%	0.322	C	S	.	.	H	α-helix	trans	-62.6	-40.6	173.2	-74.4	163.2	149.3	0	0	111.3	L5 R8 I9 I12 V41 T42 I48 A49	L5-E45 HydrophobicContact CD1-CG 4.45Å; R8-E45 IonicContact CZ-OE1 3.84Å; R8-E45 IonicContact NH1-OE1 2.87Å; R8-E45 PolarHBondContact NH1-OE1 3.16Å; I9-E45 HydrophobicContact CG1-CG 4.36Å; I12-E45 HydrophobicContact CD1-CB 4.5Å; V41-E45 HydrophobicContact CG1-CB 3.86Å; T42-E45 WeakPolarHBondContact CG2-OE2 3.34Å; T42-E45 PolarHBondContact N-OE2 3.18Å; T42-E45 PolarHBondContact O-N 3.35Å; T42-E45 VanDerWaalsContact O-N 3.09Å; T42-E45 WeakPolarHBondContact OG1-CB 3.47Å; T42-E45 VanDerWaalsContact OG1-CD 3.26Å; T42-E45 WeakPolarHBondContact OG1-CG 3.24Å; T42-E45 PolarHBondContact OG1-N 3.4Å; T42-E45 VanDerWaalsContact OG1-N 3.09Å; T42-E45 PolarHBondContact OG1-OE2 3.5Å; E45-I48 PolarHBondContact O-N 3.45Å; E45-A49 WeakPolarHBondContact O-CB 3.46Å; E45-A49 PolarHBondContact O-N 3.12Å
46	Q	69.2	Low	62.6	Low	78 Å²	78	53.4 Å²	53.4	36%	0.364	33%	0.326	S	S	.	.	H	α-helix	trans	-62.8	-43.7	175.3	-173.1	173.7	2.3	0	0	111.9	V41 T42 G44 I48 A49 D50 T254	V41-Q46 HydrophobicContact CG1-CB 4.46Å; T42-Q46 PolarHBondContact O-N 3.38Å; G44-Q46 VanDerWaalsContact C-N 3.33Å; G44-Q46 PolarHBondContact O-N 3.01Å; Q46-I48 VanDerWaalsContact C-N 3.31Å; Q46-I48 PolarHBondContact O-N 3.38Å; Q46-A49 PolarHBondContact O-N 3.36Å; Q46-D50 WeakPolarHBondContact O-CB 3.3Å; Q46-D50 VanDerWaalsContact O-CG 3.31Å; Q46-D50 PolarHBondContact O-N 3.05Å; Q46-T254 HydrophobicContact CG-CG2 4.39Å
47	L	69.9	Low	64.5	Low	0 Å²	0	49.3 Å²	49.3	0%	0	29%	0.289	C	S	.	.	H	α-helix	trans	-59.6	-42.6	175.9	-179.2	68.2	0	0	0	111.9	K43 G44 A51 V251 T254 L255 M258 I434	K43-L47 WeakPolarHBondContact O-CB 3.35Å; K43-L47 PolarHBondContact O-N 2.98Å; G44-L47 PolarHBondContact O-N 3.02Å; L47-A51 WeakPolarHBondContact O-CB 3.49Å; L47-A51 PolarHBondContact O-N 3.16Å; L47-V251 HydrophobicContact CD1-CG1 3.77Å; L47-T254 HydrophobicContact CB-CG2 3.84Å; L47-T254 HydrophobicContact CD1-CG2 4.03Å; L47-L255 HydrophobicContact CD1-CD2 4.03Å; L47-L255 HydrophobicContact CD1-CG 3.81Å; L47-L255 HydrophobicContact CD2-CD2 3.84Å; L47-M258 HydrophobicContact CB-SD 4.13Å; L47-M258 HydrophobicContact CD2-SD 3.97Å; L47-I434 HydrophobicContact CD2-CG2 3.46Å; L47-I434 VanDerWaalsContact CD2-CG2 3.46Å
48	I	69	Low	67	Low	27 Å²	27	42.6 Å²	42.6	14%	0.138	26%	0.257	C	S	.	.	H	α-helix	trans	-65.3	-45.2	177.2	-61.9	164.3	0	0	0	109.8	I9 G44 E45 Q46 D50 A51 L52 F389	I9-I48 HydrophobicContact CD1-CB 4.26Å; I9-I48 HydrophobicContact CD1-CD1 3.82Å; I9-I48 HydrophobicContact CD1-CG2 3.98Å; I9-I48 HydrophobicContact CG2-CB 4.5Å; I9-I48 HydrophobicContact CG2-CG2 3.96Å; G44-I48 WeakPolarHBondContact O-CG1 3.47Å; G44-I48 PolarHBondContact O-N 3.21Å; G44-I48 VanDerWaalsContact O-N 3.07Å; E45-I48 PolarHBondContact O-N 3.45Å; Q46-I48 VanDerWaalsContact C-N 3.31Å; Q46-I48 PolarHBondContact O-N 3.38Å; I48-D50 PolarHBondContact O-N 3.43Å; I48-A51 PolarHBondContact O-N 3.35Å; I48-A51 VanDerWaalsContact O-N 3.17Å; I48-L52 HydrophobicContact CG2-CD1 4.45Å; I48-L52 HydrophobicContact CG2-CG 4.5Å; I48-L52 WeakPolarHBondContact O-CG 3.48Å; I48-L52 PolarHBondContact O-N 3.28Å; I48-F389 HydrophobicContact CG1-CE1 3.92Å; I48-F389 HydrophobicContact CG1-CE2 4.5Å; I48-F389 HydrophobicContact CG1-CZ 3.89Å; I48-F389 HydrophobicContact CG2-CD1 4.42Å
49	A	70.8	Confident	69.4	Low	8 Å²	8	40.4 Å²	40.4	7%	0.066	26%	0.263	C	S	.	.	H	α-helix	trans	-58.6	-47.2	177.5	0	0	0	0	0	111.8	E45 Q46 A51 L52	E45-A49 WeakPolarHBondContact O-CB 3.46Å; E45-A49 PolarHBondContact O-N 3.12Å; Q46-A49 PolarHBondContact O-N 3.36Å; A49-A51 VanDerWaalsContact C-N 3.27Å; A49-A51 PolarHBondContact O-N 2.7Å; A49-L52 PolarHBondContact O-N 2.72Å
50	D	74.6	Confident	71.8	Confident	9 Å²	9	44.5 Å²	44.5	5%	0.048	27%	0.274	C	S	.	.	H	α-helix	trans	-66.3	-30	177.1	-68.3	-28.4	0	0	0	112.5	Q46 I48 Q247 K250 V251 T254	Q46-D50 WeakPolarHBondContact O-CB 3.3Å; Q46-D50 VanDerWaalsContact O-CG 3.31Å; Q46-D50 PolarHBondContact O-N 3.05Å; I48-D50 PolarHBondContact O-N 3.43Å; D50-Q247 VanDerWaalsContact O-CG 3.3Å; D50-Q247 WeakPolarHBondContact O-CG 3.45Å; D50-Q247 PolarHBondContact O-NE2 2.89Å; D50-K250 HydrophobicContact CB-CD 4.33Å; D50-K250 HydrophobicContact CB-CG 4.41Å; D50-K250 VanDerWaalsContact OD1-CD 3.3Å; D50-K250 WeakPolarHBondContact OD1-CD 3.49Å; D50-K250 WeakPolarHBondContact OD1-CE 3.21Å; D50-K250 IonicContact OD1-NZ 2.81Å; D50-K250 PolarHBondContact OD1-NZ 3.26Å; D50-V251 HydrophobicContact CB-CG2 3.87Å; D50-V251 WeakPolarHBondContact O-CG2 3.44Å; D50-T254 PolarHBondContact OD2-OG1 2.8Å
51	A	72.8	Confident	73.8	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-79	-20.5	178.5	0	0	0	0	0	113.5	L47 I48 A49 Q247 V251 I386 F389 N390	L47-A51 WeakPolarHBondContact O-CB 3.49Å; L47-A51 PolarHBondContact O-N 3.16Å; I48-A51 PolarHBondContact O-N 3.35Å; I48-A51 VanDerWaalsContact O-N 3.17Å; A49-A51 VanDerWaalsContact C-N 3.27Å; A49-A51 PolarHBondContact O-N 2.7Å; A51-Q247 PolarHBondContact O-NE2 3.34Å; A51-V251 HydrophobicContact CB-CG2 4.25Å; A51-I386 HydrophobicContact CB-CG1 4.17Å; A51-F389 HydrophobicContact CB-CB 4.4Å; A51-F389 HydrophobicContact CB-CD2 3.54Å; A51-F389 HydrophobicContact CB-CE2 4.23Å; A51-F389 HydrophobicContact CB-CG 4.3Å; A51-N390 PolarHBondContact O-ND2 3.13Å
52	L	75.4	Confident	75.7	Confident	59 Å²	59	40.2 Å²	40.2	31%	0.309	24%	0.236	S	C	.	.	S	Bend	trans	-71.5	129.6	177.2	-72.2	170.4	0	0	0	110.7	I9 I48 A49 A54 Q247	I9-L52 HydrophobicContact CG2-CD1 3.98Å; I48-L52 HydrophobicContact CG2-CD1 4.45Å; I48-L52 HydrophobicContact CG2-CG 4.5Å; I48-L52 WeakPolarHBondContact O-CG 3.48Å; I48-L52 PolarHBondContact O-N 3.28Å; A49-L52 PolarHBondContact O-N 2.72Å; L52-A54 PolarHBondContact O-N 3.38Å; L52-Q247 PolarHBondContact O-NE2 3.44Å
53	I	76.4	Confident	77.2	Confident	29 Å²	29	41.9 Å²	41.9	15%	0.149	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-80.6	119.6	-179.4	-63.7	169.3	0	0	0	109.5	V241 P243 I386 N390	I53-V241 HydrophobicContact CG2-CB 4.49Å; I53-V241 HydrophobicContact CG2-CG1 3.7Å; I53-P243 HydrophobicContact CD1-CG 4.23Å; I53-I386 HydrophobicContact CD1-CG2 3.96Å; I53-I386 HydrophobicContact CG1-CG2 3.89Å; I53-N390 HydrophobicContact CD1-CB 4.02Å; I53-N390 HydrophobicContact CG1-CB 4.44Å; I53-N390 PolarHBondContact N-OD1 3.14Å
54	A	73	Confident	78.8	Confident	81 Å²	81	38 Å²	38	67%	0.669	23%	0.229	S	C	*	.	P	Polyproline II helix	trans	-66.4	135.8	171.1	0	0	0	0	0	110.9	L52	L52-A54 PolarHBondContact O-N 3.38Å
55	R	75.9	Confident	80.6	Confident	30 Å²	30	37.9 Å²	37.9	11%	0.113	23%	0.226	C	C	.	.	P	Polyproline II helix	trans	-95.6	126.6	-173.6	-70.1	179.5	-82.5	-157.4	-0.3	111.2	D57 S179 E180 E183 D397	R55-D57 VanDerWaalsContact C-N 3.32Å; R55-D57 PolarHBondContact O-N 3.4Å; R55-S179 PolarHBondContact NH1-O 3.36Å; R55-S179 VanDerWaalsContact NH1-O 3.1Å; R55-E180 WeakPolarHBondContact CG-O 2.96Å; R55-E183 HydrophobicContact CB-CB 4.22Å; R55-E183 IonicContact CZ-OE1 3.54Å; R55-E183 IonicContact CZ-OE2 3.4Å; R55-E183 VanDerWaalsContact CZ-OE2 3.24Å; R55-E183 IonicContact NE-OE2 3.22Å; R55-E183 PolarHBondContact NE-OE2 2.68Å; R55-E183 IonicContact NH2-OE1 2.89Å; R55-E183 PolarHBondContact NH2-OE1 2.77Å; R55-E183 IonicContact NH2-OE2 2.68Å; R55-E183 PolarHBondContact NH2-OE2 3.18Å; R55-D397 IonicContact NH1-OD2 3.87Å; R55-D397 IonicContact NH2-OD2 3.64Å
56	A	76.5	Confident	82.1	Confident	89 Å²	89	42.3 Å²	42.3	74%	0.736	25%	0.249	S	C	*	.			trans	-75.2	-14.1	-172.9	0	0	0	0	0	115	G58	A56-G58 PolarHBondContact O-N 3.21Å; A56-G58 VanDerWaalsContact O-N 3.13Å
57	D	80.3	Confident	83.5	Confident	22 Å²	22	38.9 Å²	38.9	12%	0.118	23%	0.233	C	C	.	.	S	Bend	trans	50.4	37.5	-177	-84.2	-43.7	0	0	0	113.3	R55 Y181 F182 E183 T184 K185	R55-D57 VanDerWaalsContact C-N 3.32Å; R55-D57 PolarHBondContact O-N 3.4Å; D57-Y181 PolarHBondContact N-O 3.48Å; D57-F182 HydrophobicContact CB-CD1 4.39Å; D57-F182 VanDerWaalsContact OD1-CA 3.23Å; D57-F182 WeakPolarHBondContact OD1-CA 3.49Å; D57-F182 WeakPolarHBondContact OD1-CD1 3.12Å; D57-E183 PolarHBondContact OD1-N 3.35Å; D57-T184 VanDerWaalsContact CG-OG1 3.32Å; D57-T184 PolarHBondContact OD1-N 2.82Å; D57-T184 WeakPolarHBondContact OD2-CB 3.38Å; D57-T184 WeakPolarHBondContact OD2-CG2 3.48Å; D57-T184 PolarHBondContact OD2-N 3.22Å; D57-T184 PolarHBondContact OD2-OG1 3.25Å; D57-K185 PolarHBondContact OD1-N 2.94Å
58	G	86.6	Confident	84.8	Confident	16 Å²	16	39 Å²	39	17%	0.165	23%	0.234	C	C	.	.	S	Bend	trans	178.3	-162.2	-175.8	0	0	0	0	0	115.5	A56 W60 G61	A56-G58 PolarHBondContact O-N 3.21Å; A56-G58 VanDerWaalsContact O-N 3.13Å; G58-W60 PolarHBondContact O-N 3.36Å; G58-G61 PolarHBondContact O-N 3.39Å
59	G	88.5	Confident	86.2	Confident	64 Å²	64	39.8 Å²	39.8	66%	0.66	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	62.8	-129.2	177.6	0	0	0	0	0	113.5	G61 W62	G59-G61 PolarHBondContact O-N 2.73Å; G59-G61 VanDerWaalsContact O-N 3.11Å; G59-W62 PolarHBondContact O-N 3.39Å; G59-W62 VanDerWaalsContact O-N 3.16Å
60	W	92.7	Very high	87.5	Confident	119 Å²	119	41.7 Å²	41.7	45%	0.451	25%	0.248	S	C	.	.	H	α-helix	trans	-59.1	-21.3	177.7	-167.3	-92.2	0	0	0	113.1	G58 W62 V63 V64 Y181 L237	G58-W60 PolarHBondContact O-N 3.36Å; W60-W62 PolarHBondContact O-N 3.01Å; W60-V63 HydrophobicContact CD2-CB 4.3Å; W60-V63 HydrophobicContact CE3-CG2 4.32Å; W60-V63 HydrophobicContact CH2-CG1 4.39Å; W60-V63 HydrophobicContact CZ2-CG1 4.21Å; W60-V63 WeakPolarHBondContact O-CB 3.5Å; W60-V63 PolarHBondContact O-N 3.47Å; W60-V64 PolarHBondContact O-N 3.11Å; W60-Y181 HydrophobicContact CB-CE1 4.16Å; W60-Y181 AromaticContact CD1-CZ 3.84Å; W60-Y181 VanDerWaalsContact CD1-OH 3.31Å; W60-L237 HydrophobicContact CH2-CD2 4.14Å; W60-L237 HydrophobicContact CZ2-CB 4.5Å; W60-L237 HydrophobicContact CZ2-CD2 3.82Å; W60-L237 PolarHBondContact NE1-O 2.84Å
61	G	92.9	Very high	88.5	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-54.9	-36	174.5	0	0	0	0	0	112.9	G58 G59 V64 V65 F182	G58-G61 PolarHBondContact O-N 3.39Å; G59-G61 PolarHBondContact O-N 2.73Å; G59-G61 VanDerWaalsContact O-N 3.11Å; G61-V64 WeakPolarHBondContact O-CB 3.3Å; G61-V64 PolarHBondContact O-N 2.91Å; G61-V65 WeakPolarHBondContact O-CG2 3.44Å; G61-V65 PolarHBondContact O-N 3.16Å; G61-F182 WeakPolarHBondContact O-CE2 3.27Å
62	W	95.4	Very high	89.6	Confident	94 Å²	94	41.5 Å²	41.5	36%	0.356	25%	0.247	S	C	.	.	H	α-helix	trans	-72.6	-31.7	177.2	-69	112.8	0	0	0	113.4	G59 W60 V64 V65 M66 F182 K185 L188 I192	G59-W62 PolarHBondContact O-N 3.39Å; G59-W62 VanDerWaalsContact O-N 3.16Å; W60-W62 PolarHBondContact O-N 3.01Å; W62-V64 VanDerWaalsContact C-N 3.32Å; W62-V65 HydrophobicContact CE3-CB 4.33Å; W62-V65 HydrophobicContact CE3-CG1 4.34Å; W62-V65 HydrophobicContact CE3-CG2 4.39Å; W62-V65 PolarHBondContact O-N 2.87Å; W62-M66 PolarHBondContact O-N 3.1Å; W62-F182 HydrophobicContact CD2-CE1 4.36Å; W62-F182 AromaticContact CD2-CZ 3.95Å; W62-F182 HydrophobicContact CD2-CZ 3.95Å; W62-F182 AromaticContact CE2-CE1 3.91Å; W62-F182 AromaticContact CE2-CZ 3.97Å; W62-F182 HydrophobicContact CE3-CZ 4.28Å; W62-F182 HydrophobicContact CG-CZ 4.29Å; W62-F182 HydrophobicContact CH2-CE1 4.44Å; W62-F182 AromaticContact CZ2-CE1 3.96Å; W62-F182 HydrophobicContact CZ2-CE1 3.96Å; W62-F182 HydrophobicContact CZ2-CZ 4.34Å; W62-K185 HydrophobicContact CZ2-CD 4.42Å; W62-L188 HydrophobicContact CH2-CD2 4.35Å; W62-I192 HydrophobicContact CH2-CD1 4.41Å; W62-I192 HydrophobicContact CZ3-CD1 3.88Å
63	V	96.5	Very high	90.7	Very high	59 Å²	59	39.8 Å²	39.8	36%	0.358	24%	0.239	S	C	.	.	H	α-helix	trans	-64.7	-41.9	171.8	-179.7	0	0	0	0	109.8	W60 M66 A67 L237	W60-V63 HydrophobicContact CD2-CB 4.3Å; W60-V63 HydrophobicContact CE3-CG2 4.32Å; W60-V63 HydrophobicContact CH2-CG1 4.39Å; W60-V63 HydrophobicContact CZ2-CG1 4.21Å; W60-V63 WeakPolarHBondContact O-CB 3.5Å; W60-V63 PolarHBondContact O-N 3.47Å; V63-M66 PolarHBondContact O-N 3.21Å; V63-A67 WeakPolarHBondContact O-CB 3.38Å; V63-A67 PolarHBondContact O-N 3.36Å; V63-L237 HydrophobicContact CG1-CD1 4.31Å
64	V	95.7	Very high	91.7	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-62.5	-46	174.4	171.3	0	0	0	0	111.1	W60 G61 W62 M66 A67 V68 I177 Y181 F238	W60-V64 PolarHBondContact O-N 3.11Å; G61-V64 WeakPolarHBondContact O-CB 3.3Å; G61-V64 PolarHBondContact O-N 2.91Å; W62-V64 VanDerWaalsContact C-N 3.32Å; V64-M66 VanDerWaalsContact C-N 3.28Å; V64-M66 PolarHBondContact O-N 2.94Å; V64-A67 WeakPolarHBondContact O-CB 3.45Å; V64-A67 PolarHBondContact O-N 2.94Å; V64-A67 VanDerWaalsContact O-N 3.12Å; V64-V68 HydrophobicContact CG1-CG2 4.34Å; V64-V68 WeakPolarHBondContact O-CG2 3.41Å; V64-V68 PolarHBondContact O-N 3.29Å; V64-I177 HydrophobicContact CG1-CB 4.2Å; V64-I177 HydrophobicContact CG1-CG1 3.75Å; V64-I177 HydrophobicContact CG1-CG2 3.43Å; V64-I177 VanDerWaalsContact CG1-CG2 3.43Å; V64-Y181 HydrophobicContact CG2-CD2 4.3Å; V64-Y181 HydrophobicContact CG2-CE2 3.89Å; V64-F238 HydrophobicContact CG1-CD1 4.33Å
65	V	96	Very high	92.8	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.018	20%	0.203	C	C	.	.	H	α-helix	trans	-56.2	-44.1	176.2	167.5	0	0	0	0	111.1	G61 W62 V68 F69 I178 F182 A189 I192 A193	G61-V65 WeakPolarHBondContact O-CG2 3.44Å; G61-V65 PolarHBondContact O-N 3.16Å; W62-V65 HydrophobicContact CE3-CB 4.33Å; W62-V65 HydrophobicContact CE3-CG1 4.34Å; W62-V65 HydrophobicContact CE3-CG2 4.39Å; W62-V65 PolarHBondContact O-N 2.87Å; V65-V68 PolarHBondContact O-N 2.95Å; V65-F69 WeakPolarHBondContact O-CB 3.3Å; V65-F69 PolarHBondContact O-N 2.75Å; V65-I178 HydrophobicContact CG2-CG1 4.34Å; V65-F182 HydrophobicContact CG2-CD2 4.39Å; V65-F182 HydrophobicContact CG2-CE2 3.59Å; V65-F182 HydrophobicContact CG2-CZ 4.13Å; V65-A189 HydrophobicContact CG2-CB 3.78Å; V65-I192 HydrophobicContact CG1-CB 4.06Å; V65-I192 HydrophobicContact CG1-CG2 3.73Å; V65-A193 HydrophobicContact CG1-CB 4.27Å
66	M	97.2	Very high	93.7	Very high	102 Å²	102	34.3 Å²	34.3	50%	0.502	20%	0.2	S	C	.	.	H	α-helix	trans	-66.9	-39.4	176.8	-168.6	63.2	-161.8	0	0	112.3	W62 V63 V64 F69 V70	W62-M66 PolarHBondContact O-N 3.1Å; V63-M66 PolarHBondContact O-N 3.21Å; V64-M66 VanDerWaalsContact C-N 3.28Å; V64-M66 PolarHBondContact O-N 2.94Å; M66-F69 HydrophobicContact CE-CD1 3.72Å; M66-F69 HydrophobicContact CE-CE1 4.14Å; M66-F69 WeakPolarHBondContact O-CB 3.31Å; M66-F69 PolarHBondContact O-N 2.87Å; M66-F69 HydrophobicContact SD-CB 4.49Å; M66-F69 HydrophobicContact SD-CD1 4.08Å; M66-V70 HydrophobicContact CE-CG2 3.73Å; M66-V70 WeakPolarHBondContact O-CG2 3.34Å; M66-V70 PolarHBondContact O-N 3.49Å
67	A	97.8	Very high	94.7	Very high	5 Å²	5	30 Å²	30	4%	0.041	17%	0.165	C	C	.	.	H	α-helix	trans	-62.5	-42.7	175.4	0	0	0	0	0	111.8	V63 V64 S71 C234 L237 F238	V63-A67 WeakPolarHBondContact O-CB 3.38Å; V63-A67 PolarHBondContact O-N 3.36Å; V64-A67 WeakPolarHBondContact O-CB 3.45Å; V64-A67 PolarHBondContact O-N 2.94Å; V64-A67 VanDerWaalsContact O-N 3.12Å; A67-S71 WeakPolarHBondContact O-CB 3.32Å; A67-S71 PolarHBondContact O-N 2.81Å; A67-S71 PolarHBondContact O-OG 3.38Å; A67-C234 HydrophobicContact CB-CB 4.11Å; A67-L237 HydrophobicContact CB-CB 4.2Å; A67-L237 HydrophobicContact CB-CD1 3.94Å; A67-F238 HydrophobicContact CB-CE1 4.07Å
68	V	97.4	Very high	95.5	Very high	4 Å²	4	29 Å²	29	2%	0.024	16%	0.16	C	C	.	.	H	α-helix	trans	-64	-45.8	174.7	-179.4	0	0	0	0	110.2	V64 V65 V70 S71 S72 I177 I178 A193 F238	V64-V68 HydrophobicContact CG1-CG2 4.34Å; V64-V68 WeakPolarHBondContact O-CG2 3.41Å; V64-V68 PolarHBondContact O-N 3.29Å; V65-V68 PolarHBondContact O-N 2.95Å; V68-V70 PolarHBondContact O-N 3.05Å; V68-S71 WeakPolarHBondContact CA-OG 3.42Å; V68-S71 PolarHBondContact O-N 3.26Å; V68-S71 PolarHBondContact O-OG 3.44Å; V68-S72 WeakPolarHBondContact O-CB 3.44Å; V68-S72 PolarHBondContact O-N 3.46Å; V68-S72 PolarHBondContact O-OG 2.83Å; V68-I177 HydrophobicContact CG2-CG2 4.1Å; V68-I178 HydrophobicContact CB-CD1 4.17Å; V68-I178 HydrophobicContact CG1-CD1 4.06Å; V68-I178 HydrophobicContact CG2-CD1 4.12Å; V68-I178 HydrophobicContact CG2-CG1 4.29Å; V68-A193 HydrophobicContact CB-CB 3.99Å; V68-A193 HydrophobicContact CG1-CB 3.8Å; V68-F238 HydrophobicContact CG2-CE1 3.62Å; V68-F238 HydrophobicContact CG2-CZ 3.81Å
69	F	97.2	Very high	95.9	Very high	42 Å²	42	28.4 Å²	28.4	18%	0.184	15%	0.153	C	C	.	.	H	α-helix	trans	-52.8	-53.9	175.2	176.4	-92.4	0	0	0	112.4	V65 M66 S71 S72 V73 I192 A193 C195 G196 V199	V65-F69 WeakPolarHBondContact O-CB 3.3Å; V65-F69 PolarHBondContact O-N 2.75Å; M66-F69 HydrophobicContact CE-CD1 3.72Å; M66-F69 HydrophobicContact CE-CE1 4.14Å; M66-F69 WeakPolarHBondContact O-CB 3.31Å; M66-F69 PolarHBondContact O-N 2.87Å; M66-F69 HydrophobicContact SD-CB 4.49Å; M66-F69 HydrophobicContact SD-CD1 4.08Å; F69-S71 PolarHBondContact O-N 2.85Å; F69-S72 PolarHBondContact O-N 2.92Å; F69-V73 HydrophobicContact CD1-CG2 4.18Å; F69-V73 HydrophobicContact CE1-CG2 3.83Å; F69-V73 HydrophobicContact CZ-CG2 4.06Å; F69-V73 WeakPolarHBondContact O-CG2 3.49Å; F69-V73 PolarHBondContact O-N 2.99Å; F69-I192 VanDerWaalsContact CD2-O 3.24Å; F69-I192 WeakPolarHBondContact CD2-O 3.4Å; F69-A193 WeakPolarHBondContact CA-O 3.45Å; F69-C195 HydrophobicContact CE2-CB 4.22Å; F69-G196 VanDerWaalsContact CD2-CA 3.45Å; F69-G196 VanDerWaalsContact CD2-N 3.3Å; F69-G196 VanDerWaalsContact CE2-CA 3.45Å; F69-V199 HydrophobicContact CE2-CG2 4.35Å; F69-V199 HydrophobicContact CZ-CB 4.39Å; F69-V199 HydrophobicContact CZ-CG2 4.05Å
70	V	98	Very high	96.1	Very high	49 Å²	49	26 Å²	26	30%	0.297	13%	0.125	S	C	.	.	H	α-helix	trans	-61.5	-44.7	-179.8	174.8	0	0	0	0	110.9	M66 V68 S72 V73 I74	M66-V70 HydrophobicContact CE-CG2 3.73Å; M66-V70 WeakPolarHBondContact O-CG2 3.34Å; M66-V70 PolarHBondContact O-N 3.49Å; V68-V70 PolarHBondContact O-N 3.05Å; V70-S72 VanDerWaalsContact C-N 3.33Å; V70-S72 PolarHBondContact O-N 2.97Å; V70-V73 WeakPolarHBondContact O-CB 3.15Å; V70-V73 PolarHBondContact O-N 3.27Å; V70-I74 HydrophobicContact CG1-CD1 4.06Å; V70-I74 WeakPolarHBondContact O-CG1 3.23Å; V70-I74 PolarHBondContact O-N 3.45Å
71	S	97.6	Very high	96.2	Very high	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-61.1	-42.3	177	67.4	0	0	0	0	111.8	A67 V68 F69 V73 I74 F75	A67-S71 WeakPolarHBondContact O-CB 3.32Å; A67-S71 PolarHBondContact O-N 2.81Å; A67-S71 PolarHBondContact O-OG 3.38Å; V68-S71 WeakPolarHBondContact CA-OG 3.42Å; V68-S71 PolarHBondContact O-N 3.26Å; V68-S71 PolarHBondContact O-OG 3.44Å; F69-S71 PolarHBondContact O-N 2.85Å; S71-V73 PolarHBondContact O-N 2.96Å; S71-I74 PolarHBondContact O-N 3.11Å; S71-I74 VanDerWaalsContact O-N 3.12Å; S71-F75 VanDerWaalsContact C-CE1 3.41Å; S71-F75 WeakPolarHBondContact O-CD1 3.3Å; S71-F75 WeakPolarHBondContact O-CE1 3.43Å; S71-F75 WeakPolarHBondContact O-CG 3.43Å; S71-F75 PolarHBondContact O-N 2.93Å
72	S	95.7	Very high	96.3	Very high	4 Å²	4	20.4 Å²	20.4	3%	0.028	10%	0.104	C	C	.	.	H	α-helix	trans	-65	-36.7	176.7	-73.2	0	0	0	0	113.1	V68 F69 V70 I74 F75 D76	V68-S72 WeakPolarHBondContact O-CB 3.44Å; V68-S72 PolarHBondContact O-N 3.46Å; V68-S72 PolarHBondContact O-OG 2.83Å; F69-S72 PolarHBondContact O-N 2.92Å; V70-S72 VanDerWaalsContact C-N 3.33Å; V70-S72 PolarHBondContact O-N 2.97Å; S72-I74 VanDerWaalsContact C-N 3.25Å; S72-I74 PolarHBondContact O-N 3.04Å; S72-F75 VanDerWaalsContact OG-CZ 3.31Å; S72-F75 WeakPolarHBondContact OG-CZ 3.36Å; S72-D76 VanDerWaalsContact O-CB 3.29Å; S72-D76 WeakPolarHBondContact O-CB 3.47Å; S72-D76 PolarHBondContact O-N 2.72Å; S72-D76 VanDerWaalsContact O-N 3.13Å
73	V	97.6	Very high	96.2	Very high	24 Å²	24	16 Å²	16	15%	0.145	9%	0.087	C	C	.	.	H	α-helix	trans	-55.9	-46.1	170.7	171.7	0	0	0	0	110.2	F69 V70 S71 G77 G196 V199 G200 F204	F69-V73 HydrophobicContact CD1-CG2 4.18Å; F69-V73 HydrophobicContact CE1-CG2 3.83Å; F69-V73 HydrophobicContact CZ-CG2 4.06Å; F69-V73 WeakPolarHBondContact O-CG2 3.49Å; F69-V73 PolarHBondContact O-N 2.99Å; V70-V73 WeakPolarHBondContact O-CB 3.15Å; V70-V73 PolarHBondContact O-N 3.27Å; S71-V73 PolarHBondContact O-N 2.96Å; V73-G77 WeakPolarHBondContact O-CA 3.47Å; V73-G77 PolarHBondContact O-N 3.15Å; V73-G77 VanDerWaalsContact O-N 3.14Å; V73-G196 VanDerWaalsContact CA-O 3.24Å; V73-G196 WeakPolarHBondContact CA-O 3.31Å; V73-G196 VanDerWaalsContact CG2-O 3.26Å; V73-G196 WeakPolarHBondContact CG2-O 3.39Å; V73-V199 HydrophobicContact CG1-CG1 4.43Å; V73-V199 HydrophobicContact CG2-CB 4.07Å; V73-V199 HydrophobicContact CG2-CG1 4.05Å; V73-G200 VanDerWaalsContact O-CA 3.29Å; V73-G200 WeakPolarHBondContact O-CA 3.19Å; V73-F204 HydrophobicContact CG1-CE2 4.13Å; V73-F204 WeakPolarHBondContact O-CE2 3.4Å
74	I	97.9	Very high	96	Very high	11 Å²	11	13.2 Å²	13.2	6%	0.056	7%	0.07	C	C	.	.	H	α-helix	trans	-71.2	-62	-175.8	-63.6	164.6	0	0	0	111.2	V70 S71 S72 G77 I78 V227 H230	V70-I74 HydrophobicContact CG1-CD1 4.06Å; V70-I74 WeakPolarHBondContact O-CG1 3.23Å; V70-I74 PolarHBondContact O-N 3.45Å; S71-I74 PolarHBondContact O-N 3.11Å; S71-I74 VanDerWaalsContact O-N 3.12Å; S72-I74 VanDerWaalsContact C-N 3.25Å; S72-I74 PolarHBondContact O-N 3.04Å; I74-G77 PolarHBondContact O-N 2.77Å; I74-I78 HydrophobicContact CG2-CD1 3.74Å; I74-I78 WeakPolarHBondContact O-CB 3.44Å; I74-I78 WeakPolarHBondContact O-CD1 3.29Å; I74-I78 WeakPolarHBondContact O-CG1 3.32Å; I74-I78 PolarHBondContact O-N 3.36Å; I74-V227 HydrophobicContact CG1-CG1 4.22Å; I74-V227 HydrophobicContact CG2-CG1 4.12Å; I74-H230 HydrophobicContact CD1-CB 4.08Å
75	F	95.8	Very high	95.9	Very high	1 Å²	1	13.5 Å²	13.5	0%	0.004	7%	0.073	C	C	.	.	H	α-helix	trans	-70	-41.2	-171	65.6	-110.7	0	0	0	112.5	S71 S72 L79 Y112 F167 M170 Y171	S71-F75 VanDerWaalsContact C-CE1 3.41Å; S71-F75 WeakPolarHBondContact O-CD1 3.3Å; S71-F75 WeakPolarHBondContact O-CE1 3.43Å; S71-F75 WeakPolarHBondContact O-CG 3.43Å; S71-F75 PolarHBondContact O-N 2.93Å; S72-F75 VanDerWaalsContact OG-CZ 3.31Å; S72-F75 WeakPolarHBondContact OG-CZ 3.36Å; F75-L79 WeakPolarHBondContact O-CB 3.46Å; F75-L79 PolarHBondContact O-N 3.04Å; F75-Y112 AromaticContact CD2-CE2 3.81Å; F75-Y112 HydrophobicContact CD2-CE2 3.81Å; F75-Y112 AromaticContact CE2-CE2 3.82Å; F75-Y112 HydrophobicContact CE2-CE2 3.82Å; F75-Y112 WeakPolarHBondContact CE2-OH 3.34Å; F75-F167 HydrophobicContact CB-CB 4.27Å; F75-F167 HydrophobicContact CB-CD1 3.63Å; F75-F167 HydrophobicContact CB-CD2 3.85Å; F75-F167 HydrophobicContact CB-CE1 3.71Å; F75-F167 HydrophobicContact CB-CE2 3.92Å; F75-F167 HydrophobicContact CB-CG 3.68Å; F75-F167 HydrophobicContact CB-CZ 3.83Å; F75-M170 HydrophobicContact CD1-CB 4.38Å; F75-M170 HydrophobicContact CE1-CB 4.42Å; F75-Y171 HydrophobicContact CE2-CD2 4.08Å; F75-Y171 HydrophobicContact CE2-CG 4.48Å; F75-Y171 AromaticContact CZ-CD2 4Å; F75-Y171 HydrophobicContact CZ-CD2 4Å; F75-Y171 HydrophobicContact CZ-CG 4.45Å
76	D	95.1	Very high	95.9	Very high	12 Å²	12	13.4 Å²	13.4	6%	0.064	7%	0.072	C	C	.	.	H	α-helix	trans	-74.7	-32.6	179	-66.7	-40.4	0	0	0	111.2	S72 L79 L80 Y112 S197	S72-D76 VanDerWaalsContact O-CB 3.29Å; S72-D76 WeakPolarHBondContact O-CB 3.47Å; S72-D76 PolarHBondContact O-N 2.72Å; S72-D76 VanDerWaalsContact O-N 3.13Å; D76-L79 PolarHBondContact O-N 3.08Å; D76-L80 WeakPolarHBondContact O-CB 3.48Å; D76-L80 WeakPolarHBondContact O-CG 2.95Å; D76-L80 PolarHBondContact O-N 3.29Å; D76-Y112 PolarHBondContact OD1-OH 2.71Å; D76-S197 WeakPolarHBondContact OD2-CB 3.24Å
77	G	96.1	Very high	95.8	Very high	0 Å²	0	8.9 Å²	8.9	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-61	-46.7	172.7	0	0	0	0	0	112.1	V73 I74 S81 G200 F204	V73-G77 WeakPolarHBondContact O-CA 3.47Å; V73-G77 PolarHBondContact O-N 3.15Å; V73-G77 VanDerWaalsContact O-N 3.14Å; I74-G77 PolarHBondContact O-N 2.77Å; G77-S81 WeakPolarHBondContact O-CB 3.5Å; G77-S81 PolarHBondContact O-N 2.85Å; G77-S81 VanDerWaalsContact O-N 3.14Å; G77-S81 PolarHBondContact O-OG 3.38Å; G77-G200 VanDerWaalsContact CA-C 3.49Å; G77-F204 WeakPolarHBondContact O-CB 3.34Å
78	I	96.9	Very high	95.6	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.061	C	C	.	.	H	α-helix	trans	-63.8	-50.5	173.6	-65.9	162.9	0	0	0	110.6	I74 L80 S81 A82 F143 F167 F204 F208 I224	I74-I78 HydrophobicContact CG2-CD1 3.74Å; I74-I78 WeakPolarHBondContact O-CB 3.44Å; I74-I78 WeakPolarHBondContact O-CD1 3.29Å; I74-I78 WeakPolarHBondContact O-CG1 3.32Å; I74-I78 PolarHBondContact O-N 3.36Å; I78-L80 VanDerWaalsContact C-N 3.29Å; I78-L80 PolarHBondContact O-N 3.46Å; I78-S81 PolarHBondContact O-N 3.41Å; I78-A82 HydrophobicContact CG2-CB 4.3Å; I78-A82 WeakPolarHBondContact O-CB 3.15Å; I78-A82 PolarHBondContact O-N 3.44Å; I78-F143 HydrophobicContact CD1-CE2 4.45Å; I78-F143 HydrophobicContact CG2-CZ 3.91Å; I78-F167 HydrophobicContact CB-CE2 4.25Å; I78-F167 HydrophobicContact CB-CZ 4.3Å; I78-F167 HydrophobicContact CD1-CZ 4.13Å; I78-F167 HydrophobicContact CG2-CE2 4.14Å; I78-F167 HydrophobicContact CG2-CZ 4.25Å; I78-F204 HydrophobicContact CD1-CE1 4.23Å; I78-F204 HydrophobicContact CG1-CD1 3.95Å; I78-F204 HydrophobicContact CG1-CE1 3.54Å; I78-F204 HydrophobicContact CG1-CZ 4.14Å; I78-F208 HydrophobicContact CG1-CZ 4.37Å; I78-F208 HydrophobicContact CG2-CZ 4.4Å; I78-I224 HydrophobicContact CD1-CG2 3.66Å; I78-I224 HydrophobicContact CG1-CG2 4.04Å; I78-I224 HydrophobicContact CG2-CG2 4.27Å
79	L	95.8	Very high	95.5	Very high	4 Å²	4	12.9 Å²	12.9	2%	0.021	7%	0.072	C	C	.	.	H	α-helix	trans	-55.6	-42.3	-176.3	-176.6	68.9	0	0	0	112.7	F75 D76 Q108 N109 Y112	F75-L79 WeakPolarHBondContact O-CB 3.46Å; F75-L79 PolarHBondContact O-N 3.04Å; D76-L79 PolarHBondContact O-N 3.08Å; L79-Q108 HydrophobicContact CD1-CB 4.22Å; L79-Q108 HydrophobicContact CD1-CG 3.71Å; L79-N109 HydrophobicContact CD1-CB 4.48Å; L79-N109 WeakPolarHBondContact CD1-OD1 3.49Å; L79-N109 WeakPolarHBondContact CD2-OD1 3.28Å; L79-N109 VanDerWaalsContact CG-OD1 3.27Å; L79-N109 WeakPolarHBondContact CG-OD1 3.47Å; L79-Y112 HydrophobicContact CD2-CD1 3.96Å; L79-Y112 HydrophobicContact CD2-CD2 4.19Å; L79-Y112 HydrophobicContact CD2-CE1 4.08Å; L79-Y112 HydrophobicContact CD2-CE2 4.27Å; L79-Y112 HydrophobicContact CD2-CG 4Å
80	L	93.5	Very high	95.5	Very high	14 Å²	14	10.9 Å²	10.9	7%	0.073	6%	0.063	C	C	.	.	H	α-helix	trans	-89.7	-18.4	-175.5	-64.2	173.1	0	0	0	113.8	D76 I78 S201 Y483	D76-L80 WeakPolarHBondContact O-CB 3.48Å; D76-L80 WeakPolarHBondContact O-CG 2.95Å; D76-L80 PolarHBondContact O-N 3.29Å; I78-L80 VanDerWaalsContact C-N 3.29Å; I78-L80 PolarHBondContact O-N 3.46Å; L80-S201 WeakPolarHBondContact CD1-OG 3.36Å; L80-Y483 HydrophobicContact CB-CD1 4.21Å; L80-Y483 HydrophobicContact CB-CE1 4.48Å; L80-Y483 HydrophobicContact CD1-CE1 4.26Å; L80-Y483 HydrophobicContact CD2-CD1 4.34Å; L80-Y483 HydrophobicContact CD2-CD2 4.24Å; L80-Y483 HydrophobicContact CD2-CE2 4.41Å; L80-Y483 HydrophobicContact CD2-CG 4.2Å
81	S	94	Very high	95.4	Very high	1 Å²	1	10.1 Å²	10.1	1%	0.007	6%	0.059	C	C	.	.	H	α-helix	trans	-117.3	-15.6	-170.6	-41	0	0	0	0	114.7	G77 I78 Q84 P205	G77-S81 WeakPolarHBondContact O-CB 3.5Å; G77-S81 PolarHBondContact O-N 2.85Å; G77-S81 VanDerWaalsContact O-N 3.14Å; G77-S81 PolarHBondContact O-OG 3.38Å; I78-S81 PolarHBondContact O-N 3.41Å; S81-Q84 VanDerWaalsContact O-CG 3.24Å; S81-Q84 WeakPolarHBondContact O-CG 3.4Å; S81-P205 WeakPolarHBondContact OG-CD 3.38Å; S81-P205 WeakPolarHBondContact OG-CG 2.87Å
82	A	95	Very high	95.3	Very high	0 Å²	0	18.6 Å²	18.6	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-71.8	-37	-179.1	0	0	0	0	0	112.2	I78 Q84 A85 F86 F105 Y159 F208	I78-A82 HydrophobicContact CG2-CB 4.3Å; I78-A82 WeakPolarHBondContact O-CB 3.15Å; I78-A82 PolarHBondContact O-N 3.44Å; A82-Q84 PolarHBondContact O-N 3.47Å; A82-A85 PolarHBondContact O-N 3.35Å; A82-F86 HydrophobicContact CB-CD2 3.99Å; A82-F86 HydrophobicContact CB-CE2 4.14Å; A82-F86 VanDerWaalsContact O-CD2 3.25Å; A82-F86 WeakPolarHBondContact O-CD2 3.29Å; A82-F86 PolarHBondContact O-N 3.29Å; A82-F105 HydrophobicContact CB-CD1 4.4Å; A82-F105 HydrophobicContact CB-CE1 3.83Å; A82-Y159 WeakPolarHBondContact CB-OH 3.28Å; A82-F208 HydrophobicContact CB-CE1 4.28Å; A82-F208 HydrophobicContact CB-CE2 4.16Å; A82-F208 HydrophobicContact CB-CZ 3.81Å
83	G	93.9	Very high	95.4	Very high	0 Å²	0	24.4 Å²	24.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-56.9	-49.1	-177.6	0	0	0	0	0	113	A85 F86 I87	G83-A85 VanDerWaalsContact C-N 3.27Å; G83-A85 PolarHBondContact O-N 3.17Å; G83-F86 PolarHBondContact O-N 3.1Å; G83-I87 VanDerWaalsContact O-CB 3.3Å; G83-I87 WeakPolarHBondContact O-CB 3.37Å; G83-I87 VanDerWaalsContact O-CD1 3.31Å; G83-I87 WeakPolarHBondContact O-CD1 3.33Å; G83-I87 WeakPolarHBondContact O-CG1 3.28Å; G83-I87 PolarHBondContact O-N 2.87Å
84	Q	92.3	Very high	95.3	Very high	2 Å²	2	24.6 Å²	24.6	1%	0.009	12%	0.117	C	C	.	.	H	α-helix	trans	-59.6	-36.8	179.9	69.7	91.4	22	0	0	112.6	S81 A82 P487 R488 L504	S81-Q84 VanDerWaalsContact O-CG 3.24Å; S81-Q84 WeakPolarHBondContact O-CG 3.4Å; A82-Q84 PolarHBondContact O-N 3.47Å; Q84-P487 HydrophobicContact CB-CG 4.18Å; Q84-R488 PolarHBondContact O-NH2 3.06Å; Q84-L504 HydrophobicContact CB-CD1 4.35Å; Q84-L504 HydrophobicContact CG-CD1 3.81Å
85	A	93.5	Very high	95.3	Very high	6 Å²	6	32.4 Å²	32.4	5%	0.05	16%	0.155	C	C	.	.	H	α-helix	trans	-79.3	-43.8	-177.4	0	0	0	0	0	112.8	A82 G83 P88 I89 F208 V212	A82-A85 PolarHBondContact O-N 3.35Å; G83-A85 VanDerWaalsContact C-N 3.27Å; G83-A85 PolarHBondContact O-N 3.17Å; A85-P88 WeakPolarHBondContact O-CD 3.25Å; A85-P88 WeakPolarHBondContact O-CG 3.34Å; A85-I89 WeakPolarHBondContact O-CD1 3.45Å; A85-F208 HydrophobicContact CB-CB 3.82Å; A85-F208 HydrophobicContact CB-CD1 4.38Å; A85-F208 HydrophobicContact CB-CG 4.27Å; A85-V212 HydrophobicContact CB-CG1 4.4Å
86	F	95.8	Very high	95.2	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-89.1	-26.8	-172.2	-70.9	-60.3	0	0	0	114.8	A82 G83 I89 W90 F105 F208 V212 W217 V220 M221	A82-F86 HydrophobicContact CB-CD2 3.99Å; A82-F86 HydrophobicContact CB-CE2 4.14Å; A82-F86 VanDerWaalsContact O-CD2 3.25Å; A82-F86 WeakPolarHBondContact O-CD2 3.29Å; A82-F86 PolarHBondContact O-N 3.29Å; G83-F86 PolarHBondContact O-N 3.1Å; F86-I89 PolarHBondContact O-N 3.42Å; F86-W90 HydrophobicContact CB-CD2 3.87Å; F86-W90 HydrophobicContact CB-CE3 3.98Å; F86-W90 HydrophobicContact CB-CG 4.45Å; F86-W90 HydrophobicContact CB-CH2 4.24Å; F86-W90 HydrophobicContact CB-CZ2 4.13Å; F86-W90 HydrophobicContact CB-CZ3 4.18Å; F86-W90 HydrophobicContact CD1-CZ2 4.24Å; F86-W90 HydrophobicContact CD2-CZ2 4.45Å; F86-W90 HydrophobicContact CG-CH2 4.35Å; F86-W90 HydrophobicContact CG-CZ2 4.01Å; F86-W90 WeakPolarHBondContact O-CB 3.45Å; F86-W90 PolarHBondContact O-N 3.39Å; F86-F105 HydrophobicContact CB-CE2 4.49Å; F86-F105 HydrophobicContact CB-CZ 3.78Å; F86-F105 HydrophobicContact CD2-CZ 4.37Å; F86-F208 AromaticContact CE2-CD1 3.9Å; F86-F208 HydrophobicContact CE2-CD1 3.9Å; F86-F208 AromaticContact CE2-CE1 3.51Å; F86-F208 HydrophobicContact CE2-CE1 3.51Å; F86-F208 HydrophobicContact CE2-CZ 4.42Å; F86-F208 HydrophobicContact CZ-CD1 4.13Å; F86-F208 AromaticContact CZ-CE1 3.94Å; F86-F208 HydrophobicContact CZ-CE1 3.94Å; F86-V212 HydrophobicContact CE1-CG1 4.1Å; F86-V212 HydrophobicContact CZ-CG1 4.5Å; F86-W217 HydrophobicContact CD1-CB 4.13Å; F86-W217 HydrophobicContact CE1-CB 3.94Å; F86-V220 HydrophobicContact CE1-CB 4.35Å; F86-V220 HydrophobicContact CE1-CG1 4.24Å; F86-V220 HydrophobicContact CZ-CB 4.2Å; F86-V220 HydrophobicContact CZ-CG1 3.67Å; F86-M221 HydrophobicContact CD1-CE 4.15Å; F86-M221 HydrophobicContact CD2-CE 3.66Å; F86-M221 HydrophobicContact CE1-CE 3.6Å; F86-M221 HydrophobicContact CE2-CE 3.04Å; F86-M221 HydrophobicContact CG-CE 4.19Å; F86-M221 HydrophobicContact CZ-CE 3.02Å
87	I	94.6	Very high	95.2	Very high	7 Å²	7	36.2 Å²	36.2	4%	0.036	18%	0.18	C	C	.	.	H	α-helix	trans	-48.6	-54	179	-75.2	167.9	0	0	0	112.7	G83 I89 T91 V101 F105 L484 Y485	G83-I87 VanDerWaalsContact O-CB 3.3Å; G83-I87 WeakPolarHBondContact O-CB 3.37Å; G83-I87 VanDerWaalsContact O-CD1 3.31Å; G83-I87 WeakPolarHBondContact O-CD1 3.33Å; G83-I87 WeakPolarHBondContact O-CG1 3.28Å; G83-I87 PolarHBondContact O-N 2.87Å; I87-I89 VanDerWaalsContact C-N 3.3Å; I87-I89 PolarHBondContact O-N 2.72Å; I87-T91 VanDerWaalsContact O-CB 3.24Å; I87-T91 WeakPolarHBondContact O-CB 3.36Å; I87-T91 PolarHBondContact O-N 3.38Å; I87-T91 PolarHBondContact O-OG1 3.47Å; I87-V101 HydrophobicContact CB-CG1 4.5Å; I87-V101 HydrophobicContact CG1-CG1 4.2Å; I87-F105 HydrophobicContact CD1-CD2 4.25Å; I87-F105 HydrophobicContact CD1-CE2 4.45Å; I87-F105 HydrophobicContact CG1-CD2 4.02Å; I87-F105 HydrophobicContact CG1-CE2 3.76Å; I87-L484 HydrophobicContact CD1-CD2 4.14Å; I87-L484 HydrophobicContact CD1-CG 4.36Å; I87-Y485 HydrophobicContact CD1-CE1 4.15Å
88	P	93.5	Very high	95.1	Very high	44 Å²	44	37.5 Å²	37.5	29%	0.286	19%	0.189	S	C	.	.	H	α-helix	trans	-63.3	-35.6	-179.8	32.1	-44.6	0	0	0	113.1	A85 K92	A85-P88 WeakPolarHBondContact O-CD 3.25Å; A85-P88 WeakPolarHBondContact O-CG 3.34Å; P88-K92 WeakPolarHBondContact O-CB 3.41Å; P88-K92 PolarHBondContact O-N 2.94Å; P88-K92 VanDerWaalsContact O-N 3.13Å
89	I	95.6	Very high	95	Very high	49 Å²	49	38.4 Å²	38.4	25%	0.251	20%	0.195	S	C	.	.	H	α-helix	trans	-71.8	-47.4	-174.6	-63.8	168.8	0	0	0	108.9	A85 F86 I87 K92 Y93 V212 W217	A85-I89 WeakPolarHBondContact O-CD1 3.45Å; F86-I89 PolarHBondContact O-N 3.42Å; I87-I89 VanDerWaalsContact C-N 3.3Å; I87-I89 PolarHBondContact O-N 2.72Å; I89-K92 PolarHBondContact O-N 2.93Å; I89-Y93 WeakPolarHBondContact O-CB 3.3Å; I89-Y93 PolarHBondContact O-N 2.9Å; I89-V212 HydrophobicContact CD1-CB 3.8Å; I89-V212 HydrophobicContact CD1-CG1 3.87Å; I89-V212 HydrophobicContact CD1-CG2 4.32Å; I89-W217 HydrophobicContact CG2-CB 3.96Å; I89-W217 HydrophobicContact CG2-CG 4.02Å
90	W	97.4	Very high	95	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-71.5	-37.1	179.7	-70.8	-12.7	0	0	0	112.6	F86 K92 Y93 F94 V101 V104 F105 L155 Y159 W217 M221	F86-W90 HydrophobicContact CB-CD2 3.87Å; F86-W90 HydrophobicContact CB-CE3 3.98Å; F86-W90 HydrophobicContact CB-CG 4.45Å; F86-W90 HydrophobicContact CB-CH2 4.24Å; F86-W90 HydrophobicContact CB-CZ2 4.13Å; F86-W90 HydrophobicContact CB-CZ3 4.18Å; F86-W90 HydrophobicContact CD1-CZ2 4.24Å; F86-W90 HydrophobicContact CD2-CZ2 4.45Å; F86-W90 HydrophobicContact CG-CH2 4.35Å; F86-W90 HydrophobicContact CG-CZ2 4.01Å; F86-W90 WeakPolarHBondContact O-CB 3.45Å; F86-W90 PolarHBondContact O-N 3.39Å; W90-K92 VanDerWaalsContact C-N 3.3Å; W90-K92 PolarHBondContact O-N 3.4Å; W90-Y93 PolarHBondContact O-N 3.45Å; W90-F94 HydrophobicContact CB-CD2 3.92Å; W90-F94 HydrophobicContact CB-CE2 4.17Å; W90-F94 AromaticContact CD1-CE2 3.79Å; W90-F94 HydrophobicContact CG-CD2 4.23Å; W90-F94 AromaticContact CG-CE2 3.96Å; W90-F94 HydrophobicContact CG-CE2 3.96Å; W90-F94 WeakPolarHBondContact O-CB 3.44Å; W90-F94 WeakPolarHBondContact O-CD2 3.34Å; W90-F94 PolarHBondContact O-N 3.38Å; W90-V101 HydrophobicContact CB-CG1 3.65Å; W90-V101 HydrophobicContact CB-CG2 4.26Å; W90-V101 HydrophobicContact CE3-CG1 3.92Å; W90-V104 HydrophobicContact CH2-CG1 4.28Å; W90-V104 HydrophobicContact CZ3-CB 4.14Å; W90-V104 HydrophobicContact CZ3-CG1 3.72Å; W90-V104 HydrophobicContact CZ3-CG2 4.38Å; W90-F105 AromaticContact CE3-CE2 3.96Å; W90-F105 HydrophobicContact CE3-CE2 3.96Å; W90-F105 AromaticContact CE3-CZ 3.85Å; W90-F105 HydrophobicContact CE3-CZ 3.85Å; W90-F105 HydrophobicContact CH2-CE1 4.41Å; W90-F105 AromaticContact CH2-CZ 3.86Å; W90-F105 HydrophobicContact CH2-CZ 3.86Å; W90-F105 HydrophobicContact CZ3-CE1 4.08Å; W90-F105 AromaticContact CZ3-CE2 3.67Å; W90-F105 HydrophobicContact CZ3-CE2 3.67Å; W90-F105 AromaticContact CZ3-CZ 3.22Å; W90-F105 HydrophobicContact CZ3-CZ 3.22Å; W90-L155 HydrophobicContact CD2-CD1 3.69Å; W90-L155 HydrophobicContact CE3-CD1 3.87Å; W90-L155 HydrophobicContact CG-CD1 4.22Å; W90-L155 HydrophobicContact CH2-CD1 4.11Å; W90-L155 HydrophobicContact CH2-CD2 4.28Å; W90-L155 HydrophobicContact CZ2-CD1 3.94Å; W90-L155 HydrophobicContact CZ2-CD2 4.14Å; W90-L155 HydrophobicContact CZ3-CD1 4.06Å; W90-Y159 HydrophobicContact CH2-CD2 4Å; W90-Y159 HydrophobicContact CH2-CE2 4.26Å; W90-Y159 HydrophobicContact CH2-CG 4.26Å; W90-W217 HydrophobicContact CZ2-CE3 4.43Å; W90-W217 AromaticContact NE1-CD2 3.47Å; W90-W217 AromaticContact NE1-CE3 3.29Å; W90-W217 VanDerWaalsContact NE1-CE3 3.29Å; W90-W217 AromaticContact NE1-CG 3.96Å; W90-W217 AromaticContact NE1-CZ3 3.79Å; W90-M221 HydrophobicContact CH2-CE 4.42Å; W90-M221 HydrophobicContact CZ2-CE 3.97Å; W90-M221 HydrophobicContact CZ2-SD 4.33Å
91	T	96	Very high	95.1	Very high	33 Å²	33	39.6 Å²	39.6	20%	0.202	21%	0.205	C	C	.	.	H	α-helix	trans	-55.9	-46.8	171	-72.8	0	0	0	0	110.6	I87 M95 S96 P98	I87-T91 VanDerWaalsContact O-CB 3.24Å; I87-T91 WeakPolarHBondContact O-CB 3.36Å; I87-T91 PolarHBondContact O-N 3.38Å; I87-T91 PolarHBondContact O-OG1 3.47Å; T91-M95 WeakPolarHBondContact O-CA 3.16Å; T91-M95 PolarHBondContact O-N 3.5Å; T91-S96 VanDerWaalsContact CG2-O 3.32Å; T91-S96 WeakPolarHBondContact CG2-O 3.46Å; T91-S96 PolarHBondContact O-N 2.96Å; T91-P98 HydrophobicContact CG2-CG 4.09Å
92	K	96.1	Very high	95.3	Very high	179 Å²	179	39.5 Å²	39.5	78%	0.778	20%	0.204	S	C	*	.	H	α-helix	trans	-71	-44.7	178.3	-173.6	177.5	179.6	179.9	0	112.9	P88 I89 W90	P88-K92 WeakPolarHBondContact O-CB 3.41Å; P88-K92 PolarHBondContact O-N 2.94Å; P88-K92 VanDerWaalsContact O-N 3.13Å; I89-K92 PolarHBondContact O-N 2.93Å; W90-K92 VanDerWaalsContact C-N 3.3Å; W90-K92 PolarHBondContact O-N 3.4Å
93	Y	96.5	Very high	95.4	Very high	125 Å²	125	42.2 Å²	42.2	49%	0.49	22%	0.218	S	C	.	.	H	α-helix	trans	-69.9	-44.7	-174.3	-177.7	-90.3	0	0	0	112.6	I89 W90 M95 W217	I89-Y93 WeakPolarHBondContact O-CB 3.3Å; I89-Y93 PolarHBondContact O-N 2.9Å; W90-Y93 PolarHBondContact O-N 3.45Å; Y93-M95 VanDerWaalsContact C-N 3.35Å; Y93-W217 HydrophobicContact CD1-CZ2 4.01Å; Y93-W217 AromaticContact CD1-NE1 3.91Å; Y93-W217 AromaticContact CD2-NE1 3.58Å; Y93-W217 AromaticContact CE1-CZ2 3.7Å; Y93-W217 HydrophobicContact CE1-CZ2 3.7Å; Y93-W217 AromaticContact CE2-NE1 3.74Å; Y93-W217 AromaticContact CG-NE1 3.66Å
94	F	97	Very high	95.5	Very high	29 Å²	29	42.2 Å²	42.2	13%	0.127	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	1.5	179.6	-63.1	-70.7	0	0	0	113.3	W90 S96 A149 T150 V152 L155 W217	W90-F94 HydrophobicContact CB-CD2 3.92Å; W90-F94 HydrophobicContact CB-CE2 4.17Å; W90-F94 AromaticContact CD1-CE2 3.79Å; W90-F94 HydrophobicContact CG-CD2 4.23Å; W90-F94 AromaticContact CG-CE2 3.96Å; W90-F94 HydrophobicContact CG-CE2 3.96Å; W90-F94 WeakPolarHBondContact O-CB 3.44Å; W90-F94 WeakPolarHBondContact O-CD2 3.34Å; W90-F94 PolarHBondContact O-N 3.38Å; F94-S96 PolarHBondContact O-N 3.09Å; F94-S96 VanDerWaalsContact O-N 3.16Å; F94-A149 HydrophobicContact CZ-CB 4.25Å; F94-T150 VanDerWaalsContact CE1-C 3.48Å; F94-V152 HydrophobicContact CB-CG2 3.74Å; F94-V152 HydrophobicContact CD2-CG2 3.99Å; F94-V152 HydrophobicContact CG-CG2 3.92Å; F94-L155 HydrophobicContact CD2-CD1 4.33Å; F94-L155 HydrophobicContact CE2-CD1 3.47Å; F94-L155 VanDerWaalsContact CE2-CD1 3.47Å; F94-L155 HydrophobicContact CZ-CD1 3.87Å; F94-W217 HydrophobicContact CE2-CZ2 4.32Å; F94-W217 AromaticContact CZ-CH2 4Å; F94-W217 HydrophobicContact CZ-CH2 4Å; F94-W217 AromaticContact CZ-CZ2 3.88Å; F94-W217 HydrophobicContact CZ-CZ2 3.88Å
95	M	96.2	Very high	95.8	Very high	174 Å²	174	42.1 Å²	42.1	86%	0.857	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	50.1	38.9	-175.6	-58	175.9	-72.6	0	0	112.1	T91 Y93	T91-M95 WeakPolarHBondContact O-CA 3.16Å; T91-M95 PolarHBondContact O-N 3.5Å; Y93-M95 VanDerWaalsContact C-N 3.35Å
96	S	95.1	Very high	95.9	Very high	30 Å²	30	41.9 Å²	41.9	21%	0.21	22%	0.216	C	C	.	.			trans	-111.9	160.8	-173.6	-168.6	0	0	0	0	110.6	T91 F94 S100	T91-S96 VanDerWaalsContact CG2-O 3.32Å; T91-S96 WeakPolarHBondContact CG2-O 3.46Å; T91-S96 PolarHBondContact O-N 2.96Å; F94-S96 PolarHBondContact O-N 3.09Å; F94-S96 VanDerWaalsContact O-N 3.16Å; S96-S100 WeakPolarHBondContact OG-CB 3.2Å
97	T	95	Very high	96	Very high	63 Å²	63	43.3 Å²	43.3	39%	0.387	22%	0.223	S	C	.	.			trans	-71.9	146.2	-178.8	68.5	0	0	0	0	111.2	S99 S100 V101 E614	T97-S99 PolarHBondContact O-N 2.84Å; T97-S99 PolarHBondContact OG1-OG 2.96Å; T97-S100 WeakPolarHBondContact O-CB 3.39Å; T97-S100 PolarHBondContact O-N 3.44Å; T97-S100 VanDerWaalsContact O-N 3.09Å; T97-S100 WeakPolarHBondContact OG1-CB 3.5Å; T97-S100 PolarHBondContact OG1-N 3.38Å; T97-S100 PolarHBondContact OG1-OG 3.17Å; T97-V101 WeakPolarHBondContact O-CG2 3.34Å; T97-V101 PolarHBondContact O-N 2.91Å; T97-E614 VanDerWaalsContact CB-OE1 3.24Å; T97-E614 WeakPolarHBondContact CB-OE1 3.25Å
98	P	93	Very high	96.1	Very high	27 Å²	27	43 Å²	43	18%	0.175	22%	0.222	C	C	.	.	H	α-helix	trans	-50.3	-37.8	172.6	-29.2	34.4	0	0	0	113.9	T91 V101 S102 A610 E614	T91-P98 HydrophobicContact CG2-CG 4.09Å; P98-V101 PolarHBondContact O-N 3.19Å; P98-S102 VanDerWaalsContact O-CB 3.3Å; P98-S102 WeakPolarHBondContact O-CB 3.07Å; P98-S102 PolarHBondContact O-N 2.84Å; P98-S102 PolarHBondContact O-OG 2.94Å; P98-A610 HydrophobicContact CB-CB 4.37Å; P98-E614 WeakPolarHBondContact CD-OE1 3.2Å
99	S	94.4	Very high	96.2	Very high	20 Å²	20	41.2 Å²	41.2	14%	0.14	21%	0.21	C	C	.	.	H	α-helix	trans	-62.1	-47.3	176.2	55.3	0	0	0	0	111.8	T97 V101 S102 L103 A610 E614	T97-S99 PolarHBondContact O-N 2.84Å; T97-S99 PolarHBondContact OG1-OG 2.96Å; S99-V101 VanDerWaalsContact C-N 3.35Å; S99-V101 PolarHBondContact O-N 3.19Å; S99-S102 PolarHBondContact O-N 3.29Å; S99-S102 PolarHBondContact O-OG 3.21Å; S99-L103 PolarHBondContact O-N 3.19Å; S99-A610 VanDerWaalsContact CA-CB 3.49Å; S99-E614 VanDerWaalsContact CB-OE1 3.25Å; S99-E614 WeakPolarHBondContact CB-OE1 3.42Å; S99-E614 WeakPolarHBondContact CB-OE2 3.35Å; S99-E614 PolarHBondContact N-OE1 3.18Å; S99-E614 PolarHBondContact OG-OE1 3.46Å; S99-E614 PolarHBondContact OG-OE2 3.22Å
100	S	96	Very high	96.2	Very high	42 Å²	42	40.6 Å²	40.6	29%	0.294	21%	0.206	S	C	.	.	H	α-helix	trans	-61.5	-42.7	176.6	-62.2	0	0	0	0	111.8	S96 T97 L103 V152	S96-S100 WeakPolarHBondContact OG-CB 3.2Å; T97-S100 WeakPolarHBondContact O-CB 3.39Å; T97-S100 PolarHBondContact O-N 3.44Å; T97-S100 VanDerWaalsContact O-N 3.09Å; T97-S100 WeakPolarHBondContact OG1-CB 3.5Å; T97-S100 PolarHBondContact OG1-N 3.38Å; T97-S100 PolarHBondContact OG1-OG 3.17Å; S100-L103 WeakPolarHBondContact O-CB 3.34Å; S100-L103 PolarHBondContact O-N 3.39Å; S100-V152 WeakPolarHBondContact O-CG1 3.15Å
101	V	97.2	Very high	96.2	Very high	0 Å²	0	43 Å²	43	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-68.7	-38.8	178.2	177	0	0	0	0	111.7	I87 W90 T97 P98 S99 L103 V104 V152	I87-V101 HydrophobicContact CB-CG1 4.5Å; I87-V101 HydrophobicContact CG1-CG1 4.2Å; W90-V101 HydrophobicContact CB-CG1 3.65Å; W90-V101 HydrophobicContact CB-CG2 4.26Å; W90-V101 HydrophobicContact CE3-CG1 3.92Å; T97-V101 WeakPolarHBondContact O-CG2 3.34Å; T97-V101 PolarHBondContact O-N 2.91Å; P98-V101 PolarHBondContact O-N 3.19Å; S99-V101 VanDerWaalsContact C-N 3.35Å; S99-V101 PolarHBondContact O-N 3.19Å; V101-L103 PolarHBondContact O-N 3.03Å; V101-V104 WeakPolarHBondContact O-CB 3.47Å; V101-V104 WeakPolarHBondContact O-CG2 3.41Å; V101-V104 PolarHBondContact O-N 3.48Å; V101-V104 VanDerWaalsContact O-N 3.08Å; V101-V152 HydrophobicContact CG2-CG1 4.5Å; V101-V152 HydrophobicContact CG2-CG2 4.09Å
102	S	96.7	Very high	96.2	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-63.4	-21.9	178	76.9	0	0	0	0	113.4	P98 S99 V104 F105 S106 Y485 P607	P98-S102 VanDerWaalsContact O-CB 3.3Å; P98-S102 WeakPolarHBondContact O-CB 3.07Å; P98-S102 PolarHBondContact O-N 2.84Å; P98-S102 PolarHBondContact O-OG 2.94Å; S99-S102 PolarHBondContact O-N 3.29Å; S99-S102 PolarHBondContact O-OG 3.21Å; S102-V104 PolarHBondContact O-N 3.4Å; S102-F105 PolarHBondContact O-N 3.19Å; S102-S106 WeakPolarHBondContact O-CB 3.4Å; S102-S106 PolarHBondContact O-N 3.07Å; S102-S106 PolarHBondContact O-OG 3.33Å; S102-Y485 WeakPolarHBondContact CB-OH 3.48Å; S102-P607 WeakPolarHBondContact OG-CA 3.34Å
103	L	96.7	Very high	96	Very high	56 Å²	56	34.6 Å²	34.6	29%	0.293	18%	0.178	S	C	.	.	H	α-helix	trans	-59.6	-32.1	173.4	-71.8	168.3	0	0	0	112	S99 S100 V101 F105 S106 L107 F603 P607	S99-L103 PolarHBondContact O-N 3.19Å; S100-L103 WeakPolarHBondContact O-CB 3.34Å; S100-L103 PolarHBondContact O-N 3.39Å; V101-L103 PolarHBondContact O-N 3.03Å; L103-F105 PolarHBondContact O-N 3.49Å; L103-S106 PolarHBondContact O-N 3.08Å; L103-L107 VanDerWaalsContact O-CB 3.3Å; L103-L107 WeakPolarHBondContact O-CB 3.4Å; L103-L107 VanDerWaalsContact O-CG 3.27Å; L103-L107 WeakPolarHBondContact O-CG 3.26Å; L103-L107 PolarHBondContact O-N 3.44Å; L103-F603 HydrophobicContact CD2-CE2 3.82Å; L103-F603 HydrophobicContact CD2-CZ 3.99Å; L103-P607 HydrophobicContact CD2-CB 3.94Å; L103-P607 HydrophobicContact CD2-CG 3.58Å; L103-P607 HydrophobicContact CG-CB 4.41Å; L103-P607 HydrophobicContact CG-CG 4.23Å
104	V	97.9	Very high	95.7	Very high	0 Å²	0	30.6 Å²	30.6	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-57.7	-49.5	178.7	179.6	0	0	0	0	110.6	W90 V101 S102 Q108 V152 L155 Y159 G160	W90-V104 HydrophobicContact CH2-CG1 4.28Å; W90-V104 HydrophobicContact CZ3-CB 4.14Å; W90-V104 HydrophobicContact CZ3-CG1 3.72Å; W90-V104 HydrophobicContact CZ3-CG2 4.38Å; V101-V104 WeakPolarHBondContact O-CB 3.47Å; V101-V104 WeakPolarHBondContact O-CG2 3.41Å; V101-V104 PolarHBondContact O-N 3.48Å; V101-V104 VanDerWaalsContact O-N 3.08Å; S102-V104 PolarHBondContact O-N 3.4Å; V104-Q108 PolarHBondContact O-N 2.8Å; V104-Q108 VanDerWaalsContact O-N 3.12Å; V104-V152 HydrophobicContact CG2-CG1 3.93Å; V104-L155 HydrophobicContact CG1-CB 4.14Å; V104-L155 HydrophobicContact CG2-CB 3.81Å; V104-Y159 HydrophobicContact CG1-CD1 3.46Å; V104-Y159 VanDerWaalsContact CG1-CD1 3.46Å; V104-Y159 HydrophobicContact CG1-CE1 4.34Å; V104-Y159 HydrophobicContact CG1-CG 3.83Å; V104-G160 WeakPolarHBondContact O-CA 3Å
105	F	96.6	Very high	95.3	Very high	1 Å²	1	29.4 Å²	29.4	0%	0.004	16%	0.16	C	C	.	.	H	α-helix	trans	-75.3	-30.3	179.9	-56.3	-73.1	0	0	0	112.7	A82 F86 I87 W90 S102 L103 Q108 N109 Y159 L484	A82-F105 HydrophobicContact CB-CD1 4.4Å; A82-F105 HydrophobicContact CB-CE1 3.83Å; F86-F105 HydrophobicContact CB-CE2 4.49Å; F86-F105 HydrophobicContact CB-CZ 3.78Å; F86-F105 HydrophobicContact CD2-CZ 4.37Å; I87-F105 HydrophobicContact CD1-CD2 4.25Å; I87-F105 HydrophobicContact CD1-CE2 4.45Å; I87-F105 HydrophobicContact CG1-CD2 4.02Å; I87-F105 HydrophobicContact CG1-CE2 3.76Å; W90-F105 AromaticContact CE3-CE2 3.96Å; W90-F105 HydrophobicContact CE3-CE2 3.96Å; W90-F105 AromaticContact CE3-CZ 3.85Å; W90-F105 HydrophobicContact CE3-CZ 3.85Å; W90-F105 HydrophobicContact CH2-CE1 4.41Å; W90-F105 AromaticContact CH2-CZ 3.86Å; W90-F105 HydrophobicContact CH2-CZ 3.86Å; W90-F105 HydrophobicContact CZ3-CE1 4.08Å; W90-F105 AromaticContact CZ3-CE2 3.67Å; W90-F105 HydrophobicContact CZ3-CE2 3.67Å; W90-F105 AromaticContact CZ3-CZ 3.22Å; W90-F105 HydrophobicContact CZ3-CZ 3.22Å; S102-F105 PolarHBondContact O-N 3.19Å; L103-F105 PolarHBondContact O-N 3.49Å; F105-Q108 PolarHBondContact O-N 3.1Å; F105-N109 PolarHBondContact O-N 3.35Å; F105-N109 PolarHBondContact O-ND2 2.75Å; F105-Y159 AromaticContact CD1-CE1 3.68Å; F105-Y159 HydrophobicContact CD1-CE1 3.68Å; F105-Y159 HydrophobicContact CE1-CD1 4.41Å; F105-Y159 AromaticContact CE1-CE1 3.57Å; F105-Y159 HydrophobicContact CE1-CE1 3.57Å; F105-Y159 AromaticContact CE1-CZ 3.73Å; F105-L484 HydrophobicContact CB-CD2 4.35Å
106	S	96.6	Very high	94.5	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-69.8	-41.5	177.2	-54.6	0	0	0	0	111.2	S102 L103 N109 M110 F603 P606 P607	S102-S106 WeakPolarHBondContact O-CB 3.4Å; S102-S106 PolarHBondContact O-N 3.07Å; S102-S106 PolarHBondContact O-OG 3.33Å; L103-S106 PolarHBondContact O-N 3.08Å; S106-N109 PolarHBondContact O-N 3.39Å; S106-M110 VanDerWaalsContact O-CB 3.29Å; S106-M110 WeakPolarHBondContact O-CB 3.16Å; S106-M110 PolarHBondContact O-N 2.86Å; S106-F603 WeakPolarHBondContact CB-O 3.15Å; S106-P606 WeakPolarHBondContact OG-CB 3.4Å; S106-P607 VanDerWaalsContact OG-CD 3.27Å; S106-P607 WeakPolarHBondContact OG-CD 3.39Å; S106-P607 WeakPolarHBondContact OG-CG 3.41Å
107	L	97.4	Very high	94	Very high	31 Å²	31	20.3 Å²	20.3	16%	0.162	11%	0.114	C	C	.	.	H	α-helix	trans	-63.7	-41	171.4	-74.4	169.4	0	0	0	111.3	L103 N109 M110 F111 C156 F603	L103-L107 VanDerWaalsContact O-CB 3.3Å; L103-L107 WeakPolarHBondContact O-CB 3.4Å; L103-L107 VanDerWaalsContact O-CG 3.27Å; L103-L107 WeakPolarHBondContact O-CG 3.26Å; L103-L107 PolarHBondContact O-N 3.44Å; L107-N109 PolarHBondContact O-N 3.06Å; L107-M110 HydrophobicContact CD2-SD 4.35Å; L107-M110 WeakPolarHBondContact O-CB 3.28Å; L107-M110 PolarHBondContact O-N 3.25Å; L107-F111 HydrophobicContact CD2-CD2 4.49Å; L107-F111 HydrophobicContact CD2-CE2 4.11Å; L107-F111 WeakPolarHBondContact O-CD2 3.44Å; L107-F111 PolarHBondContact O-N 2.71Å; L107-C156 HydrophobicContact CD1-CB 3.6Å; L107-F603 HydrophobicContact CD2-CD2 4.16Å; L107-F603 HydrophobicContact CD2-CE2 3.9Å; L107-F603 HydrophobicContact CG-CD2 4.47Å; L107-F603 HydrophobicContact CG-CE2 4.2Å
108	Q	97.5	Very high	93.6	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-57.6	-50.5	175.2	-165.1	-177.1	41.1	0	0	111.7	L79 V104 F105 M110 F111 Y112 Y159 G160	L79-Q108 HydrophobicContact CD1-CB 4.22Å; L79-Q108 HydrophobicContact CD1-CG 3.71Å; V104-Q108 PolarHBondContact O-N 2.8Å; V104-Q108 VanDerWaalsContact O-N 3.12Å; F105-Q108 PolarHBondContact O-N 3.1Å; Q108-M110 VanDerWaalsContact C-N 3.35Å; Q108-M110 PolarHBondContact O-N 3.36Å; Q108-F111 PolarHBondContact O-N 2.87Å; Q108-Y112 WeakPolarHBondContact O-CB 2.95Å; Q108-Y112 PolarHBondContact O-N 2.98Å; Q108-Y159 HydrophobicContact CB-CE1 4.48Å; Q108-Y159 VanDerWaalsContact CD-CE1 3.42Å; Q108-Y159 HydrophobicContact CG-CE1 4.43Å; Q108-G160 VanDerWaalsContact CA-O 3.25Å; Q108-G160 WeakPolarHBondContact CA-O 3.46Å
109	N	95.2	Very high	93.3	Very high	7 Å²	7	20.6 Å²	20.6	4%	0.037	11%	0.112	C	C	.	.	H	α-helix	trans	-63.7	-38	177.1	-82.1	-70.1	0	0	0	113.2	L79 F105 S106 L107 S113 V602	L79-N109 HydrophobicContact CD1-CB 4.48Å; L79-N109 WeakPolarHBondContact CD1-OD1 3.49Å; L79-N109 WeakPolarHBondContact CD2-OD1 3.28Å; L79-N109 VanDerWaalsContact CG-OD1 3.27Å; L79-N109 WeakPolarHBondContact CG-OD1 3.47Å; F105-N109 PolarHBondContact O-N 3.35Å; F105-N109 PolarHBondContact O-ND2 2.75Å; S106-N109 PolarHBondContact O-N 3.39Å; L107-N109 PolarHBondContact O-N 3.06Å; N109-S113 PolarHBondContact O-N 3.35Å; N109-S113 VanDerWaalsContact O-N 3.16Å; N109-S113 PolarHBondContact O-OG 2.88Å; N109-V602 HydrophobicContact CB-CB 4.38Å; N109-V602 HydrophobicContact CB-CG2 3.9Å
110	M	96.3	Very high	92.9	Very high	36 Å²	36	19.7 Å²	19.7	18%	0.177	11%	0.105	C	C	.	.	H	α-helix	trans	-61.1	-55	176	179.3	-178.9	174.5	0	0	110.8	S106 L107 Q108 Y112 S113 L114 G599 F603	S106-M110 VanDerWaalsContact O-CB 3.29Å; S106-M110 WeakPolarHBondContact O-CB 3.16Å; S106-M110 PolarHBondContact O-N 2.86Å; L107-M110 HydrophobicContact CD2-SD 4.35Å; L107-M110 WeakPolarHBondContact O-CB 3.28Å; L107-M110 PolarHBondContact O-N 3.25Å; Q108-M110 VanDerWaalsContact C-N 3.35Å; Q108-M110 PolarHBondContact O-N 3.36Å; M110-Y112 VanDerWaalsContact C-N 3.33Å; M110-Y112 PolarHBondContact O-N 3.49Å; M110-S113 PolarHBondContact O-N 3.48Å; M110-S113 VanDerWaalsContact O-N 3.14Å; M110-L114 HydrophobicContact CE-CD2 4Å; M110-L114 WeakPolarHBondContact O-CB 3.41Å; M110-L114 PolarHBondContact O-N 3.46Å; M110-G599 WeakPolarHBondContact CG-O 3.3Å; M110-F603 HydrophobicContact CB-CB 4.07Å; M110-F603 HydrophobicContact CG-CB 4.25Å; M110-F603 HydrophobicContact SD-CB 3.98Å; M110-F603 HydrophobicContact SD-CD2 3.98Å; M110-F603 HydrophobicContact SD-CG 3.96Å
111	F	96.4	Very high	92.4	Very high	49 Å²	49	17.8 Å²	17.8	22%	0.215	9%	0.092	C	C	.	.	H	α-helix	trans	-71.3	-29.3	-178.2	-81.5	-80.6	0	0	0	112.3	L107 Q108 S113 L114 T115 V161 G164 V165	L107-F111 HydrophobicContact CD2-CD2 4.49Å; L107-F111 HydrophobicContact CD2-CE2 4.11Å; L107-F111 WeakPolarHBondContact O-CD2 3.44Å; L107-F111 PolarHBondContact O-N 2.71Å; Q108-F111 PolarHBondContact O-N 2.87Å; F111-S113 VanDerWaalsContact C-N 3.27Å; F111-S113 PolarHBondContact O-N 2.97Å; F111-L114 HydrophobicContact CE1-CD2 4.42Å; F111-T115 WeakPolarHBondContact O-CB 3.24Å; F111-T115 PolarHBondContact O-N 3.13Å; F111-T115 PolarHBondContact O-OG1 2.87Å; F111-V161 HydrophobicContact CD1-CG1 4.22Å; F111-V161 HydrophobicContact CD2-CB 4.28Å; F111-V161 HydrophobicContact CD2-CG1 4.19Å; F111-V161 HydrophobicContact CD2-CG2 3.96Å; F111-V161 HydrophobicContact CE1-CG1 4.09Å; F111-V161 HydrophobicContact CE2-CB 4.31Å; F111-V161 HydrophobicContact CE2-CG1 4.07Å; F111-V161 HydrophobicContact CE2-CG2 3.66Å; F111-V161 HydrophobicContact CG-CG1 4.27Å; F111-V161 HydrophobicContact CZ-CG1 4.01Å; F111-V161 HydrophobicContact CZ-CG2 4.24Å; F111-G164 CarbonylContact C-O 3.58Å; F111-V165 HydrophobicContact CB-CG2 4.07Å; F111-V165 HydrophobicContact CD1-CG2 3.71Å; F111-V165 HydrophobicContact CG-CG2 4.19Å
112	Y	95.5	Very high	91.9	Very high	28 Å²	28	21.6 Å²	21.6	11%	0.11	11%	0.109	C	C	.	.	H	α-helix	trans	-55	-43.6	167.5	172.7	-97.9	0	0	0	112	F75 D76 L79 Q108 M110 G164 F167 G168 Y171	F75-Y112 AromaticContact CD2-CE2 3.81Å; F75-Y112 HydrophobicContact CD2-CE2 3.81Å; F75-Y112 AromaticContact CE2-CE2 3.82Å; F75-Y112 HydrophobicContact CE2-CE2 3.82Å; F75-Y112 WeakPolarHBondContact CE2-OH 3.34Å; D76-Y112 PolarHBondContact OD1-OH 2.71Å; L79-Y112 HydrophobicContact CD2-CD1 3.96Å; L79-Y112 HydrophobicContact CD2-CD2 4.19Å; L79-Y112 HydrophobicContact CD2-CE1 4.08Å; L79-Y112 HydrophobicContact CD2-CE2 4.27Å; L79-Y112 HydrophobicContact CD2-CG 4Å; Q108-Y112 WeakPolarHBondContact O-CB 2.95Å; Q108-Y112 PolarHBondContact O-N 2.98Å; M110-Y112 VanDerWaalsContact C-N 3.33Å; M110-Y112 PolarHBondContact O-N 3.49Å; Y112-G164 VanDerWaalsContact CA-O 3.29Å; Y112-G164 WeakPolarHBondContact CA-O 3.31Å; Y112-G164 PolarHBondContact N-O 3.19Å; Y112-F167 HydrophobicContact CD2-CB 3.66Å; Y112-F167 HydrophobicContact CE2-CB 4.23Å; Y112-G168 WeakPolarHBondContact O-CA 3.42Å; Y112-Y171 HydrophobicContact CE2-CG 4.19Å; Y112-Y171 AromaticContact CZ-CG 3.89Å; Y112-Y171 VanDerWaalsContact OH-CD2 3.31Å; Y112-Y171 WeakPolarHBondContact OH-CD2 3.5Å
113	S	92.1	Very high	91.5	Very high	8 Å²	8	21.6 Å²	21.6	6%	0.056	11%	0.109	C	C	.	.	H	α-helix	trans	-81.1	-45.1	179.3	-57.7	0	0	0	0	113.1	N109 M110 F111 T115 G116 N598	N109-S113 PolarHBondContact O-N 3.35Å; N109-S113 VanDerWaalsContact O-N 3.16Å; N109-S113 PolarHBondContact O-OG 2.88Å; M110-S113 PolarHBondContact O-N 3.48Å; M110-S113 VanDerWaalsContact O-N 3.14Å; F111-S113 VanDerWaalsContact C-N 3.27Å; F111-S113 PolarHBondContact O-N 2.97Å; S113-T115 VanDerWaalsContact C-N 3.26Å; S113-T115 PolarHBondContact O-N 2.87Å; S113-G116 PolarHBondContact O-N 3.27Å; S113-N598 PolarHBondContact OG-ND2 3.04Å
114	L	90.7	Very high	90.9	Very high	41 Å²	41	19.4 Å²	19.4	22%	0.215	10%	0.097	C	C	.	.	H	α-helix	trans	-69	-25.6	-173.3	-173.4	62	0	0	0	112.6	M110 F111 G116 P117 L596	M110-L114 HydrophobicContact CE-CD2 4Å; M110-L114 WeakPolarHBondContact O-CB 3.41Å; M110-L114 PolarHBondContact O-N 3.46Å; F111-L114 HydrophobicContact CE1-CD2 4.42Å; L114-G116 PolarHBondContact O-N 2.85Å; L114-P117 WeakPolarHBondContact O-CD 3.46Å; L114-L596 HydrophobicContact CD1-CD1 3.29Å
115	T	88.2	Confident	90.1	Very high	5 Å²	5	20.9 Å²	20.9	3%	0.031	11%	0.11	C	C	.	.	H	α-helix	trans	-69	-14	177.8	-56.9	0	0	0	0	112.1	F111 S113 I118 S119 V165	F111-T115 WeakPolarHBondContact O-CB 3.24Å; F111-T115 PolarHBondContact O-N 3.13Å; F111-T115 PolarHBondContact O-OG1 2.87Å; S113-T115 VanDerWaalsContact C-N 3.26Å; S113-T115 PolarHBondContact O-N 2.87Å; T115-I118 PolarHBondContact O-N 3.32Å; T115-I118 VanDerWaalsContact O-N 3.16Å; T115-S119 WeakPolarHBondContact CG2-OG 3.33Å; T115-S119 WeakPolarHBondContact O-CB 3.46Å; T115-S119 PolarHBondContact O-N 3.43Å; T115-V165 HydrophobicContact CG2-CG1 3.94Å; T115-V165 WeakPolarHBondContact OG1-CA 3.39Å
116	G	80.9	Confident	89.6	Confident	6 Å²	6	25.4 Å²	25.4	6%	0.062	13%	0.129	C	C	.	.	H	α-helix	trans	-47.6	-61.6	-179.8	0	0	0	0	0	114.7	S113 L114 I118 G120 L172	S113-G116 PolarHBondContact O-N 3.27Å; L114-G116 PolarHBondContact O-N 2.85Å; G116-I118 VanDerWaalsContact C-N 3.33Å; G116-I118 PolarHBondContact O-N 3.45Å; G116-G120 PolarHBondContact O-N 2.92Å; G116-L172 WeakPolarHBondContact O-CD2 3.45Å
117	P	82.9	Confident	89.2	Confident	6 Å²	6	26.5 Å²	26.5	4%	0.039	14%	0.141	C	C	.	.	H	α-helix	trans	-59.1	-40.3	177.8	-27.7	36.4	0	0	0	114	L114 G120 A121 L454 I455	L114-P117 WeakPolarHBondContact O-CD 3.46Å; P117-G120 PolarHBondContact O-N 3.38Å; P117-A121 PolarHBondContact O-N 3.35Å; P117-L454 HydrophobicContact CB-CB 3.98Å; P117-L454 HydrophobicContact CB-CD1 4.25Å; P117-L454 WeakPolarHBondContact O-CD1 3.17Å; P117-I455 HydrophobicContact CB-CD1 4.31Å; P117-I455 HydrophobicContact CB-CG1 4.24Å
118	I	87	Confident	89	Confident	91 Å²	91	25.1 Å²	25.1	47%	0.467	13%	0.134	S	C	.	.	H	α-helix	trans	-68.5	-54.3	-176.8	-62.8	170.3	0	0	0	109.9	T115 G116 G120 A121 F122	T115-I118 PolarHBondContact O-N 3.32Å; T115-I118 VanDerWaalsContact O-N 3.16Å; G116-I118 VanDerWaalsContact C-N 3.33Å; G116-I118 PolarHBondContact O-N 3.45Å; I118-G120 PolarHBondContact O-N 3.44Å; I118-A121 VanDerWaalsContact O-CB 3.29Å; I118-A121 WeakPolarHBondContact O-CB 3.49Å; I118-A121 PolarHBondContact O-N 3.31Å; I118-F122 HydrophobicContact CG2-CD2 3.96Å; I118-F122 HydrophobicContact CG2-CE2 3.73Å; I118-F122 VanDerWaalsContact O-CD2 3.24Å; I118-F122 WeakPolarHBondContact O-CD2 3.48Å; I118-F122 PolarHBondContact O-N 2.92Å; I118-F122 VanDerWaalsContact O-N 3.14Å
119	S	87.7	Confident	88.8	Confident	6 Å²	6	31 Å²	31	4%	0.042	16%	0.156	C	C	.	.	H	α-helix	trans	-59.8	-34.5	176.7	-80.9	0	0	0	0	112.1	T115 A121 F122 V123 A169 L172	T115-S119 WeakPolarHBondContact CG2-OG 3.33Å; T115-S119 WeakPolarHBondContact O-CB 3.46Å; T115-S119 PolarHBondContact O-N 3.43Å; S119-A121 VanDerWaalsContact C-N 3.27Å; S119-A121 PolarHBondContact O-N 3.32Å; S119-F122 CarbonylContact O-C 3.53Å; S119-F122 PolarHBondContact O-N 2.98Å; S119-F122 VanDerWaalsContact O-N 3.16Å; S119-V123 WeakPolarHBondContact O-CB 3.23Å; S119-V123 VanDerWaalsContact O-CG2 3.3Å; S119-V123 WeakPolarHBondContact O-CG2 3.42Å; S119-V123 PolarHBondContact O-N 3.09Å; S119-A169 WeakPolarHBondContact OG-CA 3.33Å; S119-A169 VanDerWaalsContact OG-CB 3.25Å; S119-A169 WeakPolarHBondContact OG-CB 3.23Å; S119-L172 VanDerWaalsContact C-CD2 3.48Å
120	G	84.6	Confident	88.8	Confident	1 Å²	1	35.3 Å²	35.3	1%	0.01	18%	0.178	C	C	.	.	H	α-helix	trans	-59.8	-42.9	175.5	0	0	0	0	0	111.4	G116 P117 I118 F122 V123 N124 L172 L393	G116-G120 PolarHBondContact O-N 2.92Å; P117-G120 PolarHBondContact O-N 3.38Å; I118-G120 PolarHBondContact O-N 3.44Å; G120-F122 PolarHBondContact O-N 2.96Å; G120-V123 PolarHBondContact O-N 3.13Å; G120-N124 WeakPolarHBondContact O-CB 3.33Å; G120-N124 PolarHBondContact O-N 3.16Å; G120-L172 VanDerWaalsContact CA-CD2 3.43Å; G120-L393 WeakPolarHBondContact O-CD1 3.4Å
121	A	85.3	Confident	88.7	Confident	1 Å²	1	34.2 Å²	34.2	1%	0.008	17%	0.173	C	C	.	.	H	α-helix	trans	-63.2	-39.9	175.9	0	0	0	0	0	113	P117 I118 S119 A125 I447 A450 V451	P117-A121 PolarHBondContact O-N 3.35Å; I118-A121 VanDerWaalsContact O-CB 3.29Å; I118-A121 WeakPolarHBondContact O-CB 3.49Å; I118-A121 PolarHBondContact O-N 3.31Å; S119-A121 VanDerWaalsContact C-N 3.27Å; S119-A121 PolarHBondContact O-N 3.32Å; A121-A125 PolarHBondContact O-N 3.22Å; A121-I447 HydrophobicContact CB-CB 4.23Å; A121-I447 HydrophobicContact CB-CG1 4.28Å; A121-I447 HydrophobicContact CB-CG2 3.9Å; A121-A450 VanDerWaalsContact CA-CB 3.48Å; A121-A450 HydrophobicContact CB-CB 3.7Å; A121-V451 HydrophobicContact CB-CG2 3.79Å
122	F	88.6	Confident	88.7	Confident	80 Å²	80	31.9 Å²	31.9	35%	0.351	16%	0.163	S	C	.	.	H	α-helix	trans	-67.9	-40	173.3	-77.4	-82.9	0	0	0	112.4	I118 S119 G120 N124 A125 F126 V131 I447	I118-F122 HydrophobicContact CG2-CD2 3.96Å; I118-F122 HydrophobicContact CG2-CE2 3.73Å; I118-F122 VanDerWaalsContact O-CD2 3.24Å; I118-F122 WeakPolarHBondContact O-CD2 3.48Å; I118-F122 PolarHBondContact O-N 2.92Å; I118-F122 VanDerWaalsContact O-N 3.14Å; S119-F122 CarbonylContact O-C 3.53Å; S119-F122 PolarHBondContact O-N 2.98Å; S119-F122 VanDerWaalsContact O-N 3.16Å; G120-F122 PolarHBondContact O-N 2.96Å; F122-N124 VanDerWaalsContact C-N 3.3Å; F122-N124 PolarHBondContact O-N 3.11Å; F122-A125 PolarHBondContact O-N 2.88Å; F122-A125 VanDerWaalsContact O-N 3.1Å; F122-F126 HydrophobicContact CB-CD2 4.42Å; F122-F126 AromaticContact CD1-CD2 3.79Å; F122-F126 HydrophobicContact CD1-CD2 3.79Å; F122-F126 AromaticContact CD1-CE2 3.6Å; F122-F126 HydrophobicContact CD1-CE2 3.6Å; F122-F126 HydrophobicContact CE1-CE2 4.07Å; F122-F126 WeakPolarHBondContact O-CD2 3.37Å; F122-F126 PolarHBondContact O-N 3.21Å; F122-V131 HydrophobicContact CB-CG1 4.27Å; F122-V131 HydrophobicContact CB-CG2 3.75Å; F122-I447 HydrophobicContact CD1-CD1 4.16Å; F122-I447 HydrophobicContact CE1-CD1 3.88Å; F122-I447 HydrophobicContact CZ-CD1 4.1Å
123	V	88	Confident	88.8	Confident	1 Å²	1	32.5 Å²	32.5	1%	0.006	17%	0.168	C	C	.	.	H	α-helix	trans	-62.5	-40.7	177.1	166.4	0	0	0	0	110.5	S119 G120 A125 G127 C128 V131 C173 I176 P392	S119-V123 WeakPolarHBondContact O-CB 3.23Å; S119-V123 VanDerWaalsContact O-CG2 3.3Å; S119-V123 WeakPolarHBondContact O-CG2 3.42Å; S119-V123 PolarHBondContact O-N 3.09Å; G120-V123 PolarHBondContact O-N 3.13Å; V123-A125 PolarHBondContact O-N 3.24Å; V123-G127 WeakPolarHBondContact O-CA 3.4Å; V123-G127 PolarHBondContact O-N 2.94Å; V123-C128 WeakPolarHBondContact CG1-SG 3.45Å; V123-V131 HydrophobicContact CG2-CB 3.95Å; V123-V131 HydrophobicContact CG2-CG1 3.93Å; V123-V131 HydrophobicContact CG2-CG2 4.12Å; V123-C173 VanDerWaalsContact CG2-SG 3.54Å; V123-I176 HydrophobicContact CB-CD1 4.43Å; V123-I176 HydrophobicContact CG1-CD1 3.97Å; V123-I176 HydrophobicContact CG1-CG2 4.12Å; V123-P392 HydrophobicContact CG1-CB 4.02Å; V123-P392 HydrophobicContact CG1-CG 4.01Å
124	N	83.1	Confident	89.1	Confident	9 Å²	9	35 Å²	35	5%	0.048	19%	0.19	C	C	.	.	H	α-helix	trans	-64.1	-26.3	176.1	-164.9	59.3	0	0	0	113.2	G120 F122 R391 L393 A450	G120-N124 WeakPolarHBondContact O-CB 3.33Å; G120-N124 PolarHBondContact O-N 3.16Å; F122-N124 VanDerWaalsContact C-N 3.3Å; F122-N124 PolarHBondContact O-N 3.11Å; N124-R391 WeakPolarHBondContact OD1-CB 3.18Å; N124-L393 HydrophobicContact CB-CB 4.36Å; N124-L393 HydrophobicContact CB-CD1 4.3Å; N124-L393 HydrophobicContact CB-CG 4.46Å; N124-A450 HydrophobicContact CB-CB 4.21Å
125	A	82.3	Confident	89.4	Confident	32 Å²	32	33.3 Å²	33.3	26%	0.264	18%	0.182	S	C	.	.	H	α-helix	trans	-94.6	-39.2	-178.5	0	0	0	0	0	113.9	A121 F122 V123 W443 I447	A121-A125 PolarHBondContact O-N 3.22Å; F122-A125 PolarHBondContact O-N 2.88Å; F122-A125 VanDerWaalsContact O-N 3.1Å; V123-A125 PolarHBondContact O-N 3.24Å; A125-W443 HydrophobicContact CB-CB 4.46Å; A125-I447 HydrophobicContact CB-CG1 4.29Å
126	F	86.3	Confident	89.8	Confident	95 Å²	95	33.1 Å²	33.1	42%	0.417	18%	0.18	S	C	.	.	H	α-helix	trans	-119.4	-8.1	-170.4	-57.6	-69.6	0	0	0	114.1	F122 I130 V131 W443	F122-F126 HydrophobicContact CB-CD2 4.42Å; F122-F126 AromaticContact CD1-CD2 3.79Å; F122-F126 HydrophobicContact CD1-CD2 3.79Å; F122-F126 AromaticContact CD1-CE2 3.6Å; F122-F126 HydrophobicContact CD1-CE2 3.6Å; F122-F126 HydrophobicContact CE1-CE2 4.07Å; F122-F126 WeakPolarHBondContact O-CD2 3.37Å; F122-F126 PolarHBondContact O-N 3.21Å; F126-I130 HydrophobicContact CB-CB 4.35Å; F126-I130 HydrophobicContact CB-CG2 4.37Å; F126-V131 HydrophobicContact CB-CG2 4.24Å; F126-W443 HydrophobicContact CE1-CB 4.36Å; F126-W443 HydrophobicContact CZ-CB 3.99Å; F126-W443 HydrophobicContact CZ-CD2 4.4Å; F126-W443 HydrophobicContact CZ-CE3 4.38Å; F126-W443 HydrophobicContact CZ-CG 4.25Å
127	G	87.4	Confident	90.6	Very high	23 Å²	23	35 Å²	35	24%	0.237	20%	0.195	C	C	.	.	H	α-helix	trans	80.9	159.9	-176.2	0	0	0	0	0	114.1	V123 R129 V131	V123-G127 WeakPolarHBondContact O-CA 3.4Å; V123-G127 PolarHBondContact O-N 2.94Å; G127-R129 VanDerWaalsContact C-N 3.3Å; G127-R129 PolarHBondContact O-N 3.48Å; G127-V131 WeakPolarHBondContact O-CG2 3.35Å; G127-V131 PolarHBondContact O-N 3Å
128	C	92.5	Very high	91.4	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.02	21%	0.208	C	C	.	.	H	α-helix	trans	-59.2	-34.7	-176.2	-63.9	0	0	0	0	113.7	V123 G132 C173 I177 F238	V123-C128 WeakPolarHBondContact CG1-SG 3.45Å; C128-G132 WeakPolarHBondContact O-CA 3.47Å; C128-G132 PolarHBondContact O-N 2.76Å; C128-C173 HydrophobicContact CB-CB 4.28Å; C128-I177 HydrophobicContact CB-CB 4.25Å; C128-I177 HydrophobicContact CB-CD1 4.25Å; C128-F238 HydrophobicContact CB-CB 4.43Å
129	R	94.8	Very high	91.9	Very high	123 Å²	123	33.1 Å²	33.1	46%	0.464	19%	0.185	S	C	.	.	H	α-helix	trans	-62.4	-53.6	-177.7	-164.4	176.6	174.5	-176.6	-1.6	113	G127 G132 L133 A236 F238	G127-R129 VanDerWaalsContact C-N 3.3Å; G127-R129 PolarHBondContact O-N 3.48Å; R129-G132 PolarHBondContact O-N 2.95Å; R129-L133 HydrophobicContact CG-CD1 4.19Å; R129-L133 WeakPolarHBondContact O-CB 3.48Å; R129-L133 VanDerWaalsContact O-CG 3.25Å; R129-L133 WeakPolarHBondContact O-CG 3.42Å; R129-L133 PolarHBondContact O-N 3.03Å; R129-A236 PolarHBondContact NE-O 2.7Å; R129-A236 VanDerWaalsContact NE-O 3.15Å; R129-F238 VanDerWaalsContact CB-O 3.29Å; R129-F238 WeakPolarHBondContact CB-O 3.26Å
130	I	94.2	Very high	92.4	Very high	98 Å²	98	32.8 Å²	32.8	50%	0.503	18%	0.183	S	C	.	.	H	α-helix	trans	-69.4	-41.6	-174.2	-62.1	-59.5	0	0	0	109.9	F126 L133 A134	F126-I130 HydrophobicContact CB-CB 4.35Å; F126-I130 HydrophobicContact CB-CG2 4.37Å; I130-L133 PolarHBondContact O-N 3.42Å; I130-A134 WeakPolarHBondContact O-CB 3.48Å; I130-A134 PolarHBondContact O-N 3Å
131	V	95.1	Very high	93	Very high	12 Å²	12	36.8 Å²	36.8	7%	0.073	20%	0.204	C	C	.	.	H	α-helix	trans	-66.8	-40.9	177.7	-178.3	0	0	0	0	111.3	F122 V123 F126 G127 A134 G135 A169	F122-V131 HydrophobicContact CB-CG1 4.27Å; F122-V131 HydrophobicContact CB-CG2 3.75Å; V123-V131 HydrophobicContact CG2-CB 3.95Å; V123-V131 HydrophobicContact CG2-CG1 3.93Å; V123-V131 HydrophobicContact CG2-CG2 4.12Å; F126-V131 HydrophobicContact CB-CG2 4.24Å; G127-V131 WeakPolarHBondContact O-CG2 3.35Å; G127-V131 PolarHBondContact O-N 3Å; V131-A134 PolarHBondContact O-N 3.06Å; V131-G135 PolarHBondContact O-N 3.03Å; V131-A169 HydrophobicContact CG1-CB 4.41Å
132	G	95.7	Very high	93.6	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.204	C	C	.	.	H	α-helix	trans	-60.3	-49.9	173.6	0	0	0	0	0	112.1	C128 R129 A134 G135 S136 A235	C128-G132 WeakPolarHBondContact O-CA 3.47Å; C128-G132 PolarHBondContact O-N 2.76Å; R129-G132 PolarHBondContact O-N 2.95Å; G132-A134 VanDerWaalsContact C-N 3.32Å; G132-A134 PolarHBondContact O-N 2.77Å; G132-G135 PolarHBondContact O-N 3.09Å; G132-G135 VanDerWaalsContact O-N 3.13Å; G132-S136 PolarHBondContact O-N 3.32Å; G132-S136 PolarHBondContact O-OG 2.75Å; G132-A235 VanDerWaalsContact C-CB 3.49Å
133	L	97.9	Very high	94.1	Very high	42 Å²	42	32.9 Å²	32.9	22%	0.22	19%	0.187	C	C	.	.	H	α-helix	trans	-59	-42.6	178	-73.6	170.3	0	0	0	112.3	R129 I130 S136 A137 L232 A235 A236	R129-L133 HydrophobicContact CG-CD1 4.19Å; R129-L133 WeakPolarHBondContact O-CB 3.48Å; R129-L133 VanDerWaalsContact O-CG 3.25Å; R129-L133 WeakPolarHBondContact O-CG 3.42Å; R129-L133 PolarHBondContact O-N 3.03Å; I130-L133 PolarHBondContact O-N 3.42Å; L133-S136 PolarHBondContact O-OG 3.09Å; L133-A137 VanDerWaalsContact O-CB 3.27Å; L133-A137 WeakPolarHBondContact O-CB 3.4Å; L133-A137 PolarHBondContact O-N 3.44Å; L133-L232 HydrophobicContact CD2-CD2 4.01Å; L133-L232 HydrophobicContact CD2-CG 3.77Å; L133-L232 VanDerWaalsContact CD2-O 3.28Å; L133-L232 WeakPolarHBondContact CD2-O 3.26Å; L133-A235 HydrophobicContact CD2-CB 4.08Å; L133-A235 HydrophobicContact CG-CB 4.18Å; L133-A236 HydrophobicContact CD2-CB 4.16Å
134	A	97.1	Very high	94.6	Very high	61 Å²	61	35.9 Å²	35.9	50%	0.504	20%	0.202	S	C	.	.	H	α-helix	trans	-66	-40.8	176.1	0	0	0	0	0	111.8	I130 V131 G132 A137 L138	I130-A134 WeakPolarHBondContact O-CB 3.48Å; I130-A134 PolarHBondContact O-N 3Å; V131-A134 PolarHBondContact O-N 3.06Å; G132-A134 VanDerWaalsContact C-N 3.32Å; G132-A134 PolarHBondContact O-N 2.77Å; A134-A137 PolarHBondContact O-N 3.47Å; A134-L138 VanDerWaalsContact O-CB 3.27Å; A134-L138 WeakPolarHBondContact O-CB 3.39Å; A134-L138 PolarHBondContact O-N 2.86Å
135	G	97.4	Very high	95.3	Very high	5 Å²	5	38.2 Å²	38.2	5%	0.052	21%	0.214	C	C	.	.	H	α-helix	trans	-62.5	-48.6	177	0	0	0	0	0	112.8	V131 G132 L138 A139 G166	V131-G135 PolarHBondContact O-N 3.03Å; G132-G135 PolarHBondContact O-N 3.09Å; G132-G135 VanDerWaalsContact O-N 3.13Å; G135-L138 PolarHBondContact O-N 2.75Å; G135-A139 PolarHBondContact O-N 2.87Å; G135-G166 WeakPolarHBondContact O-CA 3.36Å
136	S	97.7	Very high	96.1	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-63.7	-44.7	175.3	58.2	0	0	0	0	111.8	G132 L133 L138 A139 G140 E228 L232	G132-S136 PolarHBondContact O-N 3.32Å; G132-S136 PolarHBondContact O-OG 2.75Å; L133-S136 PolarHBondContact O-OG 3.09Å; S136-L138 VanDerWaalsContact C-N 3.26Å; S136-L138 PolarHBondContact O-N 3.23Å; S136-A139 PolarHBondContact O-N 3.41Å; S136-G140 PolarHBondContact O-N 3.36Å; S136-E228 WeakPolarHBondContact CA-OE1 2.96Å; S136-L232 WeakPolarHBondContact OG-CA 3.48Å
137	A	98.1	Very high	96.6	Very high	45 Å²	45	33.3 Å²	33.3	37%	0.372	19%	0.189	S	C	.	.	H	α-helix	trans	-61.6	-36.7	178.2	0	0	0	0	0	112.2	L133 A134 L141 L232	L133-A137 VanDerWaalsContact O-CB 3.27Å; L133-A137 WeakPolarHBondContact O-CB 3.4Å; L133-A137 PolarHBondContact O-N 3.44Å; A134-A137 PolarHBondContact O-N 3.47Å; A137-L141 VanDerWaalsContact O-CB 3.3Å; A137-L141 WeakPolarHBondContact O-CB 3.41Å; A137-L141 PolarHBondContact O-N 2.87Å; A137-L232 HydrophobicContact CB-CD1 4.43Å
138	L	97.8	Very high	97.1	Very high	58 Å²	58	39.2 Å²	39.2	30%	0.304	21%	0.208	S	C	.	.	H	α-helix	trans	-68	-40.7	176.7	-177.3	64.8	0	0	0	112.3	A134 G135 S136 L141 G142 M162 V165	A134-L138 VanDerWaalsContact O-CB 3.27Å; A134-L138 WeakPolarHBondContact O-CB 3.39Å; A134-L138 PolarHBondContact O-N 2.86Å; G135-L138 PolarHBondContact O-N 2.75Å; S136-L138 VanDerWaalsContact C-N 3.26Å; S136-L138 PolarHBondContact O-N 3.23Å; L138-L141 PolarHBondContact O-N 3.48Å; L138-G142 PolarHBondContact O-N 2.95Å; L138-M162 HydrophobicContact CD1-CB 4.4Å; L138-M162 HydrophobicContact CD1-CE 3.91Å; L138-V165 HydrophobicContact CD2-CB 4.09Å; L138-V165 HydrophobicContact CD2-CG1 3.73Å
139	A	98	Very high	97.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-67.6	-45.2	176.8	0	0	0	0	0	112.3	G135 S136 L141 G142 F143 A163 F167 E228	G135-A139 PolarHBondContact O-N 2.87Å; S136-A139 PolarHBondContact O-N 3.41Å; A139-L141 VanDerWaalsContact C-N 3.32Å; A139-L141 PolarHBondContact O-N 2.78Å; A139-G142 WeakPolarHBondContact O-CA 3.45Å; A139-G142 PolarHBondContact O-N 3.49Å; A139-G142 VanDerWaalsContact O-N 3.08Å; A139-F143 WeakPolarHBondContact O-CD2 3.29Å; A139-F143 PolarHBondContact O-N 2.84Å; A139-A163 HydrophobicContact CB-CB 4.34Å; A139-F167 HydrophobicContact CB-CD1 3.69Å; A139-F167 HydrophobicContact CB-CE1 3.77Å; A139-E228 HydrophobicContact CB-CG 4.2Å; A139-E228 WeakPolarHBondContact CB-OE1 3.27Å
140	G	98	Very high	97.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-58.4	-43.5	173.3	0	0	0	0	0	112.4	S136 G142 F143 I144 E228	S136-G140 PolarHBondContact O-N 3.36Å; G140-G142 VanDerWaalsContact C-N 3.34Å; G140-G142 PolarHBondContact O-N 3.45Å; G140-F143 PolarHBondContact O-N 3.25Å; G140-I144 VanDerWaalsContact O-CG1 3.25Å; G140-I144 WeakPolarHBondContact O-CG1 3.4Å; G140-I144 PolarHBondContact O-N 3.45Å; G140-E228 WeakPolarHBondContact CA-OE2 3.3Å; G140-E228 VanDerWaalsContact N-CD 3.27Å; G140-E228 PolarHBondContact N-OE1 2.87Å; G140-E228 PolarHBondContact N-OE2 3.2Å; G140-E228 VanDerWaalsContact N-OE2 3.08Å
141	L	98.1	Very high	97.4	Very high	84 Å²	84	36.3 Å²	36.3	44%	0.44	21%	0.211	S	C	.	.	H	α-helix	trans	-62.5	-40.6	173.7	-178.1	62.9	0	0	0	112	A137 L138 A139 I144 L145 M162	A137-L141 VanDerWaalsContact O-CB 3.3Å; A137-L141 WeakPolarHBondContact O-CB 3.41Å; A137-L141 PolarHBondContact O-N 2.87Å; L138-L141 PolarHBondContact O-N 3.48Å; A139-L141 VanDerWaalsContact C-N 3.32Å; A139-L141 PolarHBondContact O-N 2.78Å; L141-I144 PolarHBondContact O-N 3.18Å; L141-L145 HydrophobicContact CD1-CD1 4.1Å; L141-L145 HydrophobicContact CD1-CG 4Å; L141-L145 HydrophobicContact CG-CD1 3.92Å; L141-L145 HydrophobicContact CG-CG 4.25Å; L141-L145 WeakPolarHBondContact O-CB 3.48Å; L141-L145 VanDerWaalsContact O-CG 3.26Å; L141-L145 WeakPolarHBondContact O-CG 3.36Å; L141-L145 PolarHBondContact O-N 3.23Å; L141-M162 HydrophobicContact CD2-CE 3.98Å; L141-M162 HydrophobicContact CG-CE 4.02Å
142	G	98.4	Very high	97.5	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-54.6	-51.9	174.5	0	0	0	0	0	111.8	L138 A139 G140 L145 S146 T158	L138-G142 PolarHBondContact O-N 2.95Å; A139-G142 WeakPolarHBondContact O-CA 3.45Å; A139-G142 PolarHBondContact O-N 3.49Å; A139-G142 VanDerWaalsContact O-N 3.08Å; G140-G142 VanDerWaalsContact C-N 3.34Å; G140-G142 PolarHBondContact O-N 3.45Å; G142-L145 PolarHBondContact O-N 2.86Å; G142-S146 PolarHBondContact O-N 3.21Å; G142-S146 PolarHBondContact O-OG 3.27Å; G142-T158 WeakPolarHBondContact CA-O 3.36Å
143	F	98.2	Very high	97.5	Very high	0 Å²	0	42.5 Å²	42.5	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-66.4	-40.4	178.4	-64.8	-44.7	0	0	0	113.5	I78 A139 G140 L145 S146 Y159 A163 F167 I224 A225 E228	I78-F143 HydrophobicContact CD1-CE2 4.45Å; I78-F143 HydrophobicContact CG2-CZ 3.91Å; A139-F143 WeakPolarHBondContact O-CD2 3.29Å; A139-F143 PolarHBondContact O-N 2.84Å; G140-F143 PolarHBondContact O-N 3.25Å; F143-L145 VanDerWaalsContact C-N 3.33Å; F143-L145 PolarHBondContact O-N 2.76Å; F143-S146 WeakPolarHBondContact O-CB 3.39Å; F143-S146 PolarHBondContact O-N 3.27Å; F143-Y159 AromaticContact CD1-CD2 3.65Å; F143-Y159 HydrophobicContact CD1-CD2 3.65Å; F143-Y159 AromaticContact CD1-CE2 3.69Å; F143-Y159 HydrophobicContact CD1-CE2 3.69Å; F143-Y159 AromaticContact CE1-CD2 3.58Å; F143-Y159 HydrophobicContact CE1-CD2 3.58Å; F143-Y159 HydrophobicContact CE1-CE1 4.45Å; F143-Y159 AromaticContact CE1-CE2 3.3Å; F143-Y159 HydrophobicContact CE1-CE2 3.3Å; F143-Y159 HydrophobicContact CE1-CG 4.25Å; F143-Y159 AromaticContact CE1-CZ 3.75Å; F143-Y159 HydrophobicContact CZ-CE2 4.43Å; F143-A163 HydrophobicContact CD1-CB 4.32Å; F143-A163 HydrophobicContact CE1-CB 3.83Å; F143-A163 HydrophobicContact CE2-CB 4.4Å; F143-A163 HydrophobicContact CZ-CB 3.89Å; F143-F167 AromaticContact CE2-CE1 3.87Å; F143-F167 HydrophobicContact CE2-CE1 3.87Å; F143-F167 HydrophobicContact CE2-CE2 4.39Å; F143-F167 AromaticContact CE2-CZ 3.48Å; F143-F167 HydrophobicContact CE2-CZ 3.48Å; F143-F167 VanDerWaalsContact CE2-CZ 3.48Å; F143-F167 HydrophobicContact CZ-CE1 4.17Å; F143-F167 AromaticContact CZ-CE2 3.91Å; F143-F167 HydrophobicContact CZ-CE2 3.91Å; F143-F167 AromaticContact CZ-CZ 3.43Å; F143-F167 HydrophobicContact CZ-CZ 3.43Å; F143-F167 VanDerWaalsContact CZ-CZ 3.43Å; F143-I224 HydrophobicContact CD2-CG2 4.38Å; F143-I224 HydrophobicContact CE2-CG2 4.34Å; F143-A225 HydrophobicContact CB-CB 3.72Å; F143-E228 HydrophobicContact CD2-CB 3.97Å; F143-E228 HydrophobicContact CD2-CG 3.93Å; F143-E228 HydrophobicContact CE2-CB 4.02Å; F143-E228 HydrophobicContact CE2-CG 3.78Å
144	I	98.4	Very high	97.5	Very high	63 Å²	63	44 Å²	44	32%	0.323	24%	0.244	S	C	.	.	H	α-helix	trans	-62.2	-42.5	176	-69.2	166	0	0	0	110.7	G140 L141 S146 V147 A225	G140-I144 VanDerWaalsContact O-CG1 3.25Å; G140-I144 WeakPolarHBondContact O-CG1 3.4Å; G140-I144 PolarHBondContact O-N 3.45Å; L141-I144 PolarHBondContact O-N 3.18Å; I144-S146 VanDerWaalsContact C-N 3.33Å; I144-S146 PolarHBondContact O-N 3.15Å; I144-V147 VanDerWaalsContact O-CB 3.26Å; I144-V147 WeakPolarHBondContact O-CB 3.39Å; I144-V147 VanDerWaalsContact O-CG2 3.26Å; I144-V147 WeakPolarHBondContact O-CG2 3.44Å; I144-V147 PolarHBondContact O-N 3.01Å; I144-A225 HydrophobicContact CG1-CB 3.82Å
145	L	98.3	Very high	97.6	Very high	59 Å²	59	41.1 Å²	41.1	31%	0.309	22%	0.221	S	C	.	.	H	α-helix	trans	-66.5	-36.5	177.5	-71	175.2	0	0	0	111.6	L141 G142 F143 V147 F148 F154 T158 M162	L141-L145 HydrophobicContact CD1-CD1 4.1Å; L141-L145 HydrophobicContact CD1-CG 4Å; L141-L145 HydrophobicContact CG-CD1 3.92Å; L141-L145 HydrophobicContact CG-CG 4.25Å; L141-L145 WeakPolarHBondContact O-CB 3.48Å; L141-L145 VanDerWaalsContact O-CG 3.26Å; L141-L145 WeakPolarHBondContact O-CG 3.36Å; L141-L145 PolarHBondContact O-N 3.23Å; G142-L145 PolarHBondContact O-N 2.86Å; F143-L145 VanDerWaalsContact C-N 3.33Å; F143-L145 PolarHBondContact O-N 2.76Å; L145-V147 PolarHBondContact O-N 3Å; L145-V147 VanDerWaalsContact O-N 3.1Å; L145-F148 PolarHBondContact O-N 2.58Å; L145-F154 WeakPolarHBondContact O-CE1 3.45Å; L145-T158 HydrophobicContact CB-CG2 3.72Å; L145-T158 HydrophobicContact CD1-CG2 4.44Å; L145-M162 HydrophobicContact CD1-CE 3.83Å; L145-M162 HydrophobicContact CD1-SD 4.06Å
146	S	98.3	Very high	97.6	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.5	-22.1	177.1	-61	0	0	0	0	114.2	G142 F143 I144 F148 A149 T158 Y159	G142-S146 PolarHBondContact O-N 3.21Å; G142-S146 PolarHBondContact O-OG 3.27Å; F143-S146 WeakPolarHBondContact O-CB 3.39Å; F143-S146 PolarHBondContact O-N 3.27Å; I144-S146 VanDerWaalsContact C-N 3.33Å; I144-S146 PolarHBondContact O-N 3.15Å; S146-F148 PolarHBondContact O-N 3.08Å; S146-A149 WeakPolarHBondContact O-CB 3.42Å; S146-A149 PolarHBondContact O-N 3.33Å; S146-A149 VanDerWaalsContact O-N 3.14Å; S146-T158 WeakPolarHBondContact OG-CB 3.32Å; S146-T158 PolarHBondContact OG-OG1 3.04Å; S146-Y159 WeakPolarHBondContact OG-CB 3.29Å; S146-Y159 PolarHBondContact OG-N 3.38Å
147	V	97.9	Very high	97.7	Very high	24 Å²	24	47.5 Å²	47.5	15%	0.145	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-34.6	173.8	-180	0	0	0	0	111.8	I144 L145 A149 Q218 M221 L222	I144-V147 VanDerWaalsContact O-CB 3.26Å; I144-V147 WeakPolarHBondContact O-CB 3.39Å; I144-V147 VanDerWaalsContact O-CG2 3.26Å; I144-V147 WeakPolarHBondContact O-CG2 3.44Å; I144-V147 PolarHBondContact O-N 3.01Å; L145-V147 PolarHBondContact O-N 3Å; L145-V147 VanDerWaalsContact O-N 3.1Å; V147-A149 VanDerWaalsContact C-N 3.3Å; V147-A149 PolarHBondContact O-N 3.37Å; V147-Q218 HydrophobicContact CG1-CB 4.15Å; V147-M221 HydrophobicContact CG2-CB 3.95Å; V147-L222 HydrophobicContact CG1-CD1 4.34Å; V147-L222 HydrophobicContact CG1-CG 4.26Å; V147-L222 HydrophobicContact CG2-CD2 3.67Å; V147-L222 HydrophobicContact CG2-CG 3.63Å
148	F	97	Very high	97.7	Very high	146 Å²	146	45.4 Å²	45.4	64%	0.64	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.9	13.3	-178.2	-54.5	-77.3	0	0	0	112.9	L145 S146 T150	L145-F148 PolarHBondContact O-N 2.58Å; S146-F148 PolarHBondContact O-N 3.08Å; F148-T150 PolarHBondContact O-N 3.08Å
149	A	96.6	Very high	97.7	Very high	5 Å²	5	42.7 Å²	42.7	4%	0.041	22%	0.218	C	C	.	.			trans	-67.1	124.3	-176.3	0	0	0	0	0	112.3	F94 S146 V147 F154 L155 W217	F94-A149 HydrophobicContact CZ-CB 4.25Å; S146-A149 WeakPolarHBondContact O-CB 3.42Å; S146-A149 PolarHBondContact O-N 3.33Å; S146-A149 VanDerWaalsContact O-N 3.14Å; V147-A149 VanDerWaalsContact C-N 3.3Å; V147-A149 PolarHBondContact O-N 3.37Å; A149-F154 VanDerWaalsContact CA-CD1 3.48Å; A149-F154 HydrophobicContact CB-CD1 3.55Å; A149-F154 HydrophobicContact CB-CE1 4.15Å; A149-F154 HydrophobicContact CB-CG 4.48Å; A149-L155 HydrophobicContact CB-CD1 4.34Å; A149-L155 HydrophobicContact CB-CD2 3.48Å; A149-L155 VanDerWaalsContact CB-CD2 3.48Å; A149-L155 HydrophobicContact CB-CG 3.59Å; A149-W217 HydrophobicContact CB-CH2 4.2Å
150	T	94.9	Very high	97.7	Very high	124 Å²	124	42.7 Å²	42.7	76%	0.761	22%	0.218	S	C	*	.			trans	-102.5	-10.3	174.6	54.2	0	0	0	0	112.8	F94 F148	F94-T150 VanDerWaalsContact CE1-C 3.48Å; F148-T150 PolarHBondContact O-N 3.08Å
151	S	96.5	Very high	97.7	Very high	35 Å²	35	44.4 Å²	44.4	25%	0.245	23%	0.228	C	C	.	.	S	Bend	trans	-149.2	164.1	178.7	88	0	0	0	0	112.2	E153 F154 L155	S151-E153 VanDerWaalsContact C-N 3.33Å; S151-E153 WeakPolarHBondContact CB-OE2 3.28Å; S151-E153 PolarHBondContact OG-N 2.92Å; S151-E153 PolarHBondContact OG-OE2 3.28Å; S151-F154 PolarHBondContact O-N 2.93Å; S151-F154 PolarHBondContact OG-N 3.28Å; S151-L155 PolarHBondContact O-N 3.45Å
152	V	97.2	Very high	97.7	Very high	8 Å²	8	41.5 Å²	41.5	5%	0.048	21%	0.212	C	C	.	.	H	α-helix	trans	-68.5	-34.1	177.7	-179.9	0	0	0	0	111.1	F94 S100 V101 V104 F154 L155 C156	F94-V152 HydrophobicContact CB-CG2 3.74Å; F94-V152 HydrophobicContact CD2-CG2 3.99Å; F94-V152 HydrophobicContact CG-CG2 3.92Å; S100-V152 WeakPolarHBondContact O-CG1 3.15Å; V101-V152 HydrophobicContact CG2-CG1 4.5Å; V101-V152 HydrophobicContact CG2-CG2 4.09Å; V104-V152 HydrophobicContact CG2-CG1 3.93Å; V152-F154 VanDerWaalsContact C-N 3.28Å; V152-F154 PolarHBondContact O-N 2.94Å; V152-L155 CarbonylContact O-C 3.48Å; V152-L155 WeakPolarHBondContact O-CA 3.46Å; V152-L155 WeakPolarHBondContact O-CB 3.45Å; V152-L155 PolarHBondContact O-N 3.26Å; V152-L155 VanDerWaalsContact O-N 3.1Å; V152-C156 PolarHBondContact O-N 2.9Å; V152-C156 PolarHBondContact O-SG 2.96Å; V152-C156 VanDerWaalsContact O-SG 3.36Å
153	E	96.8	Very high	97.6	Very high	133 Å²	133	41.5 Å²	41.5	62%	0.621	21%	0.212	S	C	*	.	H	α-helix	trans	-63.2	-37.5	177.1	-55.8	75.9	-165.2	0	0	111.4	S151 L155 C156 F157	S151-E153 VanDerWaalsContact C-N 3.33Å; S151-E153 WeakPolarHBondContact CB-OE2 3.28Å; S151-E153 PolarHBondContact OG-N 2.92Å; S151-E153 PolarHBondContact OG-OE2 3.28Å; E153-L155 VanDerWaalsContact C-N 3.34Å; E153-C156 WeakPolarHBondContact O-CB 3.25Å; E153-C156 PolarHBondContact O-N 2.85Å; E153-F157 PolarHBondContact O-N 3.05Å; E153-F157 VanDerWaalsContact O-N 3.12Å
154	F	97.9	Very high	97.6	Very high	74 Å²	74	41.5 Å²	41.5	33%	0.325	21%	0.212	S	C	.	.	H	α-helix	trans	-65.5	-37.9	174.1	-173.2	-86.9	0	0	0	111.7	L145 A149 S151 V152 F157 T158	L145-F154 WeakPolarHBondContact O-CE1 3.45Å; A149-F154 VanDerWaalsContact CA-CD1 3.48Å; A149-F154 HydrophobicContact CB-CD1 3.55Å; A149-F154 HydrophobicContact CB-CE1 4.15Å; A149-F154 HydrophobicContact CB-CG 4.48Å; S151-F154 PolarHBondContact O-N 2.93Å; S151-F154 PolarHBondContact OG-N 3.28Å; V152-F154 VanDerWaalsContact C-N 3.28Å; V152-F154 PolarHBondContact O-N 2.94Å; F154-F157 PolarHBondContact O-N 2.9Å; F154-T158 HydrophobicContact CD1-CG2 4.02Å; F154-T158 HydrophobicContact CE1-CG2 3.57Å; F154-T158 HydrophobicContact CE2-CG2 4.37Å; F154-T158 HydrophobicContact CZ-CG2 3.77Å; F154-T158 WeakPolarHBondContact O-CG2 3.21Å; F154-T158 PolarHBondContact O-N 3.45Å; F154-T158 PolarHBondContact O-OG1 3.02Å
155	L	98.2	Very high	97.6	Very high	1 Å²	1	40.5 Å²	40.5	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-67.3	-40.1	171.8	-71.7	173.5	0	0	0	112.2	W90 F94 V104 A149 S151 V152 E153 F157 T158 Y159 G160	W90-L155 HydrophobicContact CD2-CD1 3.69Å; W90-L155 HydrophobicContact CE3-CD1 3.87Å; W90-L155 HydrophobicContact CG-CD1 4.22Å; W90-L155 HydrophobicContact CH2-CD1 4.11Å; W90-L155 HydrophobicContact CH2-CD2 4.28Å; W90-L155 HydrophobicContact CZ2-CD1 3.94Å; W90-L155 HydrophobicContact CZ2-CD2 4.14Å; W90-L155 HydrophobicContact CZ3-CD1 4.06Å; F94-L155 HydrophobicContact CD2-CD1 4.33Å; F94-L155 HydrophobicContact CE2-CD1 3.47Å; F94-L155 VanDerWaalsContact CE2-CD1 3.47Å; F94-L155 HydrophobicContact CZ-CD1 3.87Å; V104-L155 HydrophobicContact CG1-CB 4.14Å; V104-L155 HydrophobicContact CG2-CB 3.81Å; A149-L155 HydrophobicContact CB-CD1 4.34Å; A149-L155 HydrophobicContact CB-CD2 3.48Å; A149-L155 VanDerWaalsContact CB-CD2 3.48Å; A149-L155 HydrophobicContact CB-CG 3.59Å; S151-L155 PolarHBondContact O-N 3.45Å; V152-L155 CarbonylContact O-C 3.48Å; V152-L155 WeakPolarHBondContact O-CA 3.46Å; V152-L155 WeakPolarHBondContact O-CB 3.45Å; V152-L155 PolarHBondContact O-N 3.26Å; V152-L155 VanDerWaalsContact O-N 3.1Å; E153-L155 VanDerWaalsContact C-N 3.34Å; L155-F157 PolarHBondContact O-N 3Å; L155-T158 PolarHBondContact O-N 2.77Å; L155-Y159 WeakPolarHBondContact O-CA 3.36Å; L155-Y159 VanDerWaalsContact O-CB 3.27Å; L155-Y159 WeakPolarHBondContact O-CB 3.14Å; L155-Y159 PolarHBondContact O-N 2.91Å; L155-G160 PolarHBondContact O-N 3.01Å
156	C	98.1	Very high	97.5	Very high	19 Å²	19	37.7 Å²	37.7	13%	0.128	19%	0.194	C	C	.	.	I	π-helix	trans	-55.4	-40.8	175	-75.2	0	0	0	0	111.2	L107 V152 E153 G160 V161	L107-C156 HydrophobicContact CD1-CB 3.6Å; V152-C156 PolarHBondContact O-N 2.9Å; V152-C156 PolarHBondContact O-SG 2.96Å; V152-C156 VanDerWaalsContact O-SG 3.36Å; E153-C156 WeakPolarHBondContact O-CB 3.25Å; E153-C156 PolarHBondContact O-N 2.85Å; C156-G160 CarbonylContact O-C 3.45Å; C156-G160 WeakPolarHBondContact O-CA 3.4Å; C156-G160 PolarHBondContact O-N 3.33Å; C156-V161 PolarHBondContact O-N 2.99Å
157	F	98.3	Very high	97.5	Very high	120 Å²	120	37.7 Å²	37.7	53%	0.526	19%	0.194	S	C	.	.	I	π-helix	trans	-74	-53.8	176.1	-179	-105.3	0	0	0	112.9	E153 F154 L155 V161 M162	E153-F157 PolarHBondContact O-N 3.05Å; E153-F157 VanDerWaalsContact O-N 3.12Å; F154-F157 PolarHBondContact O-N 2.9Å; L155-F157 PolarHBondContact O-N 3Å; F157-V161 WeakPolarHBondContact O-CB 3.37Å; F157-V161 PolarHBondContact O-N 3.16Å; F157-M162 HydrophobicContact CD1-SD 4.12Å; F157-M162 HydrophobicContact CE1-CG 4.17Å; F157-M162 HydrophobicContact CE1-SD 3.63Å; F157-M162 HydrophobicContact CZ-CG 4.28Å; F157-M162 HydrophobicContact CZ-SD 4.21Å; F157-M162 PolarHBondContact O-N 3.43Å
158	T	98.2	Very high	97.3	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.006	19%	0.188	C	C	.	.	I	π-helix	trans	-74	-55.1	-172.7	53.7	0	0	0	0	112.8	G142 L145 S146 F154 L155 M162 A163	G142-T158 WeakPolarHBondContact CA-O 3.36Å; L145-T158 HydrophobicContact CB-CG2 3.72Å; L145-T158 HydrophobicContact CD1-CG2 4.44Å; S146-T158 WeakPolarHBondContact OG-CB 3.32Å; S146-T158 PolarHBondContact OG-OG1 3.04Å; F154-T158 HydrophobicContact CD1-CG2 4.02Å; F154-T158 HydrophobicContact CE1-CG2 3.57Å; F154-T158 HydrophobicContact CE2-CG2 4.37Å; F154-T158 HydrophobicContact CZ-CG2 3.77Å; F154-T158 WeakPolarHBondContact O-CG2 3.21Å; F154-T158 PolarHBondContact O-N 3.45Å; F154-T158 PolarHBondContact O-OG1 3.02Å; L155-T158 PolarHBondContact O-N 2.77Å; T158-M162 HydrophobicContact CG2-SD 4.37Å; T158-M162 WeakPolarHBondContact O-CB 3.44Å; T158-A163 PolarHBondContact O-N 3.29Å
159	Y	98.1	Very high	97.3	Very high	1 Å²	1	29.9 Å²	29.9	0%	0.004	16%	0.159	C	C	.	.	I	π-helix	trans	-77.8	-45.4	179.5	-170.6	-74.1	0	0	0	111.2	A82 W90 V104 F105 Q108 F143 S146 L155 A163 M221	A82-Y159 WeakPolarHBondContact CB-OH 3.28Å; W90-Y159 HydrophobicContact CH2-CD2 4Å; W90-Y159 HydrophobicContact CH2-CE2 4.26Å; W90-Y159 HydrophobicContact CH2-CG 4.26Å; V104-Y159 HydrophobicContact CG1-CD1 3.46Å; V104-Y159 VanDerWaalsContact CG1-CD1 3.46Å; V104-Y159 HydrophobicContact CG1-CE1 4.34Å; V104-Y159 HydrophobicContact CG1-CG 3.83Å; F105-Y159 AromaticContact CD1-CE1 3.68Å; F105-Y159 HydrophobicContact CD1-CE1 3.68Å; F105-Y159 HydrophobicContact CE1-CD1 4.41Å; F105-Y159 AromaticContact CE1-CE1 3.57Å; F105-Y159 HydrophobicContact CE1-CE1 3.57Å; F105-Y159 AromaticContact CE1-CZ 3.73Å; Q108-Y159 HydrophobicContact CB-CE1 4.48Å; Q108-Y159 VanDerWaalsContact CD-CE1 3.42Å; Q108-Y159 HydrophobicContact CG-CE1 4.43Å; F143-Y159 AromaticContact CD1-CD2 3.65Å; F143-Y159 HydrophobicContact CD1-CD2 3.65Å; F143-Y159 AromaticContact CD1-CE2 3.69Å; F143-Y159 HydrophobicContact CD1-CE2 3.69Å; F143-Y159 AromaticContact CE1-CD2 3.58Å; F143-Y159 HydrophobicContact CE1-CD2 3.58Å; F143-Y159 HydrophobicContact CE1-CE1 4.45Å; F143-Y159 AromaticContact CE1-CE2 3.3Å; F143-Y159 HydrophobicContact CE1-CE2 3.3Å; F143-Y159 HydrophobicContact CE1-CG 4.25Å; F143-Y159 AromaticContact CE1-CZ 3.75Å; F143-Y159 HydrophobicContact CZ-CE2 4.43Å; S146-Y159 WeakPolarHBondContact OG-CB 3.29Å; S146-Y159 PolarHBondContact OG-N 3.38Å; L155-Y159 WeakPolarHBondContact O-CA 3.36Å; L155-Y159 VanDerWaalsContact O-CB 3.27Å; L155-Y159 WeakPolarHBondContact O-CB 3.14Å; L155-Y159 PolarHBondContact O-N 2.91Å; Y159-A163 WeakPolarHBondContact O-CB 3.29Å; Y159-M221 HydrophobicContact CD2-CE 4.38Å; Y159-M221 HydrophobicContact CD2-SD 3.9Å; Y159-M221 HydrophobicContact CE2-CE 3.91Å; Y159-M221 HydrophobicContact CE2-SD 3.93Å
160	G	97.9	Very high	97.2	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	16%	0.158	C	C	.	.	I	π-helix	trans	-70.2	-68.8	-177.7	0	0	0	0	0	112.2	V104 Q108 L155 C156 G164	V104-G160 WeakPolarHBondContact O-CA 3Å; Q108-G160 VanDerWaalsContact CA-O 3.25Å; Q108-G160 WeakPolarHBondContact CA-O 3.46Å; L155-G160 PolarHBondContact O-N 3.01Å; C156-G160 CarbonylContact O-C 3.45Å; C156-G160 WeakPolarHBondContact O-CA 3.4Å; C156-G160 PolarHBondContact O-N 3.33Å; G160-G164 WeakPolarHBondContact O-CA 3.49Å; G160-G164 PolarHBondContact O-N 3.01Å; G160-G164 VanDerWaalsContact O-N 3.12Å
161	V	97.9	Very high	97.1	Very high	35 Å²	35	26.2 Å²	26.2	21%	0.212	13%	0.131	C	C	.	.	I	π-helix	trans	-73.8	-56.2	-173.1	-175.9	0	0	0	0	112.3	F111 C156 F157 G164 V165	F111-V161 HydrophobicContact CD1-CG1 4.22Å; F111-V161 HydrophobicContact CD2-CB 4.28Å; F111-V161 HydrophobicContact CD2-CG1 4.19Å; F111-V161 HydrophobicContact CD2-CG2 3.96Å; F111-V161 HydrophobicContact CE1-CG1 4.09Å; F111-V161 HydrophobicContact CE2-CB 4.31Å; F111-V161 HydrophobicContact CE2-CG1 4.07Å; F111-V161 HydrophobicContact CE2-CG2 3.66Å; F111-V161 HydrophobicContact CG-CG1 4.27Å; F111-V161 HydrophobicContact CZ-CG1 4.01Å; F111-V161 HydrophobicContact CZ-CG2 4.24Å; C156-V161 PolarHBondContact O-N 2.99Å; F157-V161 WeakPolarHBondContact O-CB 3.37Å; F157-V161 PolarHBondContact O-N 3.16Å; V161-G164 PolarHBondContact O-N 3.26Å; V161-V165 HydrophobicContact CG1-CG2 4.46Å; V161-V165 VanDerWaalsContact O-CG2 3.27Å; V161-V165 WeakPolarHBondContact O-CG2 3.38Å; V161-V165 PolarHBondContact O-N 3.1Å
162	M	97.8	Very high	96.9	Very high	24 Å²	24	25 Å²	25	12%	0.118	12%	0.121	C	C	.	.	I	π-helix	trans	-65.2	-50.3	-172.5	-60.7	175.2	57.1	0	0	112	L138 L141 L145 F157 T158 V165 G166	L138-M162 HydrophobicContact CD1-CB 4.4Å; L138-M162 HydrophobicContact CD1-CE 3.91Å; L141-M162 HydrophobicContact CD2-CE 3.98Å; L141-M162 HydrophobicContact CG-CE 4.02Å; L145-M162 HydrophobicContact CD1-CE 3.83Å; L145-M162 HydrophobicContact CD1-SD 4.06Å; F157-M162 HydrophobicContact CD1-SD 4.12Å; F157-M162 HydrophobicContact CE1-CG 4.17Å; F157-M162 HydrophobicContact CE1-SD 3.63Å; F157-M162 HydrophobicContact CZ-CG 4.28Å; F157-M162 HydrophobicContact CZ-SD 4.21Å; F157-M162 PolarHBondContact O-N 3.43Å; T158-M162 HydrophobicContact CG2-SD 4.37Å; T158-M162 WeakPolarHBondContact O-CB 3.44Å; M162-V165 PolarHBondContact O-N 3.34Å; M162-G166 PolarHBondContact O-N 3.34Å; M162-G166 VanDerWaalsContact O-N 3.08Å
163	A	97.9	Very high	96.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-69.5	-34	178.2	0	0	0	0	0	112.8	A139 F143 T158 Y159 G166 F167	A139-A163 HydrophobicContact CB-CB 4.34Å; F143-A163 HydrophobicContact CD1-CB 4.32Å; F143-A163 HydrophobicContact CE1-CB 3.83Å; F143-A163 HydrophobicContact CE2-CB 4.4Å; F143-A163 HydrophobicContact CZ-CB 3.89Å; T158-A163 PolarHBondContact O-N 3.29Å; Y159-A163 WeakPolarHBondContact O-CB 3.29Å; A163-G166 PolarHBondContact O-N 2.92Å; A163-F167 WeakPolarHBondContact O-CB 3.44Å; A163-F167 WeakPolarHBondContact O-CG 3.4Å; A163-F167 PolarHBondContact O-N 3.12Å
164	G	97.7	Very high	96.5	Very high	0 Å²	0	18.2 Å²	18.2	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-59.5	-46	172.6	0	0	0	0	0	112.8	F111 Y112 G160 V161 F167 G168	F111-G164 CarbonylContact C-O 3.58Å; Y112-G164 VanDerWaalsContact CA-O 3.29Å; Y112-G164 WeakPolarHBondContact CA-O 3.31Å; Y112-G164 PolarHBondContact N-O 3.19Å; G160-G164 WeakPolarHBondContact O-CA 3.49Å; G160-G164 PolarHBondContact O-N 3.01Å; G160-G164 VanDerWaalsContact O-N 3.12Å; V161-G164 PolarHBondContact O-N 3.26Å; G164-F167 PolarHBondContact O-N 3.13Å; G164-G168 PolarHBondContact O-N 3.4Å
165	V	97.3	Very high	96.2	Very high	41 Å²	41	15.2 Å²	15.2	25%	0.248	8%	0.077	C	C	.	.	H	α-helix	trans	-61.9	-44.2	175.3	172.1	0	0	0	0	111.2	F111 T115 L138 V161 M162 G168 A169	F111-V165 HydrophobicContact CB-CG2 4.07Å; F111-V165 HydrophobicContact CD1-CG2 3.71Å; F111-V165 HydrophobicContact CG-CG2 4.19Å; T115-V165 HydrophobicContact CG2-CG1 3.94Å; T115-V165 WeakPolarHBondContact OG1-CA 3.39Å; L138-V165 HydrophobicContact CD2-CB 4.09Å; L138-V165 HydrophobicContact CD2-CG1 3.73Å; V161-V165 HydrophobicContact CG1-CG2 4.46Å; V161-V165 VanDerWaalsContact O-CG2 3.27Å; V161-V165 WeakPolarHBondContact O-CG2 3.38Å; V161-V165 PolarHBondContact O-N 3.1Å; M162-V165 PolarHBondContact O-N 3.34Å; V165-G168 PolarHBondContact O-N 2.73Å; V165-A169 WeakPolarHBondContact O-CB 3.38Å; V165-A169 PolarHBondContact O-N 3.4Å
166	G	97.6	Very high	95.7	Very high	0 Å²	0	15.2 Å²	15.2	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-61.2	-47	178.3	0	0	0	0	0	113.2	G135 M162 A163 A169 M170	G135-G166 WeakPolarHBondContact O-CA 3.36Å; M162-G166 PolarHBondContact O-N 3.34Å; M162-G166 VanDerWaalsContact O-N 3.08Å; A163-G166 PolarHBondContact O-N 2.92Å; G166-A169 PolarHBondContact O-N 2.86Å; G166-M170 PolarHBondContact O-N 3.09Å
167	F	97.2	Very high	95.4	Very high	1 Å²	1	14.3 Å²	14.3	0%	0.004	7%	0.07	C	C	.	.	H	α-helix	trans	-64	-41.9	176.2	-72.4	-4.4	0	0	0	112.3	F75 I78 Y112 A139 F143 A163 G164 A169 M170 Y171 E228	F75-F167 HydrophobicContact CB-CB 4.27Å; F75-F167 HydrophobicContact CB-CD1 3.63Å; F75-F167 HydrophobicContact CB-CD2 3.85Å; F75-F167 HydrophobicContact CB-CE1 3.71Å; F75-F167 HydrophobicContact CB-CE2 3.92Å; F75-F167 HydrophobicContact CB-CG 3.68Å; F75-F167 HydrophobicContact CB-CZ 3.83Å; I78-F167 HydrophobicContact CB-CE2 4.25Å; I78-F167 HydrophobicContact CB-CZ 4.3Å; I78-F167 HydrophobicContact CD1-CZ 4.13Å; I78-F167 HydrophobicContact CG2-CE2 4.14Å; I78-F167 HydrophobicContact CG2-CZ 4.25Å; Y112-F167 HydrophobicContact CD2-CB 3.66Å; Y112-F167 HydrophobicContact CE2-CB 4.23Å; A139-F167 HydrophobicContact CB-CD1 3.69Å; A139-F167 HydrophobicContact CB-CE1 3.77Å; F143-F167 AromaticContact CE2-CE1 3.87Å; F143-F167 HydrophobicContact CE2-CE1 3.87Å; F143-F167 HydrophobicContact CE2-CE2 4.39Å; F143-F167 AromaticContact CE2-CZ 3.48Å; F143-F167 HydrophobicContact CE2-CZ 3.48Å; F143-F167 VanDerWaalsContact CE2-CZ 3.48Å; F143-F167 HydrophobicContact CZ-CE1 4.17Å; F143-F167 AromaticContact CZ-CE2 3.91Å; F143-F167 HydrophobicContact CZ-CE2 3.91Å; F143-F167 AromaticContact CZ-CZ 3.43Å; F143-F167 HydrophobicContact CZ-CZ 3.43Å; F143-F167 VanDerWaalsContact CZ-CZ 3.43Å; A163-F167 WeakPolarHBondContact O-CB 3.44Å; A163-F167 WeakPolarHBondContact O-CG 3.4Å; A163-F167 PolarHBondContact O-N 3.12Å; G164-F167 PolarHBondContact O-N 3.13Å; F167-A169 VanDerWaalsContact C-N 3.34Å; F167-A169 PolarHBondContact O-N 3.19Å; F167-M170 PolarHBondContact O-N 3.36Å; F167-Y171 WeakPolarHBondContact O-CB 3.17Å; F167-Y171 PolarHBondContact O-N 3.42Å; F167-E228 HydrophobicContact CE1-CG 3.88Å
168	G	95.4	Very high	95.1	Very high	1 Å²	1	8.6 Å²	8.6	1%	0.01	5%	0.045	C	C	.	.	H	α-helix	trans	-62.9	-39.2	177.4	0	0	0	0	0	112.8	Y112 G164 V165 L172	Y112-G168 WeakPolarHBondContact O-CA 3.42Å; G164-G168 PolarHBondContact O-N 3.4Å; V165-G168 PolarHBondContact O-N 2.73Å; G168-L172 WeakPolarHBondContact O-CB 3.45Å; G168-L172 PolarHBondContact O-N 3.22Å; G168-L172 VanDerWaalsContact O-N 3.14Å
169	A	95.2	Very high	94.5	Very high	5 Å²	5	8.6 Å²	8.6	4%	0.041	5%	0.046	C	C	.	.	H	α-helix	trans	-63.6	-45.2	173.5	0	0	0	0	0	112.1	S119 V131 V165 G166 F167 L172 C173	S119-A169 WeakPolarHBondContact OG-CA 3.33Å; S119-A169 VanDerWaalsContact OG-CB 3.25Å; S119-A169 WeakPolarHBondContact OG-CB 3.23Å; V131-A169 HydrophobicContact CG1-CB 4.41Å; V165-A169 WeakPolarHBondContact O-CB 3.38Å; V165-A169 PolarHBondContact O-N 3.4Å; G166-A169 PolarHBondContact O-N 2.86Å; F167-A169 VanDerWaalsContact C-N 3.34Å; F167-A169 PolarHBondContact O-N 3.19Å; A169-L172 PolarHBondContact O-N 3.5Å; A169-C173 WeakPolarHBondContact O-CB 3.44Å; A169-C173 PolarHBondContact O-N 3.47Å; A169-C173 PolarHBondContact O-SG 2.95Å
170	M	95	Very high	93.9	Very high	1 Å²	1	9.6 Å²	9.6	1%	0.005	5%	0.05	C	C	.	.	H	α-helix	trans	-61.6	-48.4	177.6	-81.3	-63.5	-60.4	0	0	112.5	F75 G166 F167 L172 C173 G174 C231 A235 F238	F75-M170 HydrophobicContact CD1-CB 4.38Å; F75-M170 HydrophobicContact CE1-CB 4.42Å; G166-M170 PolarHBondContact O-N 3.09Å; F167-M170 PolarHBondContact O-N 3.36Å; M170-L172 PolarHBondContact O-N 3.1Å; M170-C173 PolarHBondContact O-N 3.2Å; M170-G174 PolarHBondContact O-N 3.28Å; M170-C231 HydrophobicContact CE-CB 3.97Å; M170-A235 HydrophobicContact CE-CB 4.17Å; M170-A235 HydrophobicContact SD-CB 3.92Å; M170-F238 HydrophobicContact CE-CE2 4.31Å; M170-F238 HydrophobicContact CE-CZ 4.45Å
171	Y	93.6	Very high	93.4	Very high	51 Å²	51	10.7 Å²	10.7	20%	0.2	5%	0.054	C	C	.	.	H	α-helix	trans	-56.9	-49.2	177.7	171.4	-104.8	0	0	0	111.5	F75 Y112 F167 C173 G174 I175	F75-Y171 HydrophobicContact CE2-CD2 4.08Å; F75-Y171 HydrophobicContact CE2-CG 4.48Å; F75-Y171 AromaticContact CZ-CD2 4Å; F75-Y171 HydrophobicContact CZ-CD2 4Å; F75-Y171 HydrophobicContact CZ-CG 4.45Å; Y112-Y171 HydrophobicContact CE2-CG 4.19Å; Y112-Y171 AromaticContact CZ-CG 3.89Å; Y112-Y171 VanDerWaalsContact OH-CD2 3.31Å; Y112-Y171 WeakPolarHBondContact OH-CD2 3.5Å; F167-Y171 WeakPolarHBondContact O-CB 3.17Å; F167-Y171 PolarHBondContact O-N 3.42Å; Y171-C173 PolarHBondContact O-N 3.16Å; Y171-G174 PolarHBondContact O-N 3.47Å; Y171-I175 HydrophobicContact CE1-CG1 4.44Å; Y171-I175 HydrophobicContact CE2-CD1 4.31Å; Y171-I175 HydrophobicContact CE2-CG1 4.1Å; Y171-I175 PolarHBondContact O-N 2.81Å
172	L	91.6	Very high	92.9	Very high	8 Å²	8	9 Å²	9	4%	0.042	4%	0.044	C	C	.	.	H	α-helix	trans	-63.4	-44.8	-179.4	-174.5	73.6	0	0	0	112.2	G116 S119 G120 G168 A169 M170 G174 I175 I176 L399	G116-L172 WeakPolarHBondContact O-CD2 3.45Å; S119-L172 VanDerWaalsContact C-CD2 3.48Å; G120-L172 VanDerWaalsContact CA-CD2 3.43Å; G168-L172 WeakPolarHBondContact O-CB 3.45Å; G168-L172 PolarHBondContact O-N 3.22Å; G168-L172 VanDerWaalsContact O-N 3.14Å; A169-L172 PolarHBondContact O-N 3.5Å; M170-L172 PolarHBondContact O-N 3.1Å; L172-G174 PolarHBondContact O-N 2.94Å; L172-I175 PolarHBondContact O-N 2.6Å; L172-I176 HydrophobicContact CD1-CD1 4.09Å; L172-I176 HydrophobicContact CD1-CG1 4.48Å; L172-I176 HydrophobicContact CD2-CD1 4.25Å; L172-I176 HydrophobicContact CG-CD1 3.8Å; L172-I176 HydrophobicContact CG-CG1 4.43Å; L172-I176 WeakPolarHBondContact O-CG1 3.3Å; L172-I176 PolarHBondContact O-N 3.31Å; L172-L399 HydrophobicContact CD1-CD2 3.96Å
173	C	93.7	Very high	91.9	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-57.9	-41	177.2	-70.1	0	0	0	0	111.1	V123 C128 A169 M170 Y171 I176 I177 F238	V123-C173 VanDerWaalsContact CG2-SG 3.54Å; C128-C173 HydrophobicContact CB-CB 4.28Å; A169-C173 WeakPolarHBondContact O-CB 3.44Å; A169-C173 PolarHBondContact O-N 3.47Å; A169-C173 PolarHBondContact O-SG 2.95Å; M170-C173 PolarHBondContact O-N 3.2Å; Y171-C173 PolarHBondContact O-N 3.16Å; C173-I176 PolarHBondContact O-N 2.7Å; C173-I177 WeakPolarHBondContact O-CB 3.19Å; C173-I177 VanDerWaalsContact O-CG2 3.23Å; C173-I177 WeakPolarHBondContact O-CG2 3.45Å; C173-I177 PolarHBondContact O-N 3.07Å; C173-F238 HydrophobicContact CB-CD2 4.1Å; C173-F238 HydrophobicContact CB-CE2 3.93Å
174	G	93.1	Very high	90.8	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-62.5	-43.8	178.9	0	0	0	0	0	113.7	M170 Y171 L172 I177 I178	M170-G174 PolarHBondContact O-N 3.28Å; Y171-G174 PolarHBondContact O-N 3.47Å; L172-G174 PolarHBondContact O-N 2.94Å; G174-I177 WeakPolarHBondContact O-CG2 3.43Å; G174-I178 WeakPolarHBondContact O-CD1 3.32Å; G174-I178 VanDerWaalsContact O-CG1 3.29Å; G174-I178 WeakPolarHBondContact O-CG1 3.37Å; G174-I178 PolarHBondContact O-N 2.85Å
175	I	90	Very high	89.9	Confident	11 Å²	11	17.5 Å²	17.5	6%	0.056	9%	0.086	C	C	.	.	H	α-helix	trans	-67.6	-44.2	177.4	-61.6	-58.3	0	0	0	111.2	Y171 L172 I178 S179 T190 V194	Y171-I175 HydrophobicContact CE1-CG1 4.44Å; Y171-I175 HydrophobicContact CE2-CD1 4.31Å; Y171-I175 HydrophobicContact CE2-CG1 4.1Å; Y171-I175 PolarHBondContact O-N 2.81Å; L172-I175 PolarHBondContact O-N 2.6Å; I175-I178 PolarHBondContact O-N 3.36Å; I175-S179 PolarHBondContact O-N 3.41Å; I175-T190 HydrophobicContact CD1-CG2 4.28Å; I175-V194 HydrophobicContact CD1-CG2 3.77Å
176	I	89.3	Confident	89.2	Confident	0 Å²	0	15.6 Å²	15.6	0%	0	7%	0.074	C	C	.	.	H	α-helix	trans	-65.6	-45.9	-177.5	-67.9	176.5	0	0	0	111	V123 L172 C173 I178 S179 E180 P392 L393 L399	V123-I176 HydrophobicContact CB-CD1 4.43Å; V123-I176 HydrophobicContact CG1-CD1 3.97Å; V123-I176 HydrophobicContact CG1-CG2 4.12Å; L172-I176 HydrophobicContact CD1-CD1 4.09Å; L172-I176 HydrophobicContact CD1-CG1 4.48Å; L172-I176 HydrophobicContact CD2-CD1 4.25Å; L172-I176 HydrophobicContact CG-CD1 3.8Å; L172-I176 HydrophobicContact CG-CG1 4.43Å; L172-I176 WeakPolarHBondContact O-CG1 3.3Å; L172-I176 PolarHBondContact O-N 3.31Å; C173-I176 PolarHBondContact O-N 2.7Å; I176-I178 VanDerWaalsContact C-N 3.29Å; I176-I178 PolarHBondContact O-N 3.3Å; I176-S179 WeakPolarHBondContact O-CB 3.49Å; I176-S179 PolarHBondContact O-N 3.3Å; I176-S179 PolarHBondContact O-OG 3.49Å; I176-E180 PolarHBondContact O-N 2.82Å; I176-P392 HydrophobicContact CG2-CB 3.4Å; I176-P392 VanDerWaalsContact CG2-CB 3.4Å; I176-P392 HydrophobicContact CG2-CG 4.4Å; I176-L393 HydrophobicContact CD1-CD2 3.98Å; I176-L399 HydrophobicContact CG1-CD2 4.1Å
177	I	91.6	Very high	88.3	Confident	0 Å²	0	17.2 Å²	17.2	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64.2	-33	-176.9	-166.3	63.8	0	0	0	112.2	V64 V68 C128 C173 G174 S179 E180 Y181 F238	V64-I177 HydrophobicContact CG1-CB 4.2Å; V64-I177 HydrophobicContact CG1-CG1 3.75Å; V64-I177 HydrophobicContact CG1-CG2 3.43Å; V64-I177 VanDerWaalsContact CG1-CG2 3.43Å; V68-I177 HydrophobicContact CG2-CG2 4.1Å; C128-I177 HydrophobicContact CB-CB 4.25Å; C128-I177 HydrophobicContact CB-CD1 4.25Å; C173-I177 WeakPolarHBondContact O-CB 3.19Å; C173-I177 VanDerWaalsContact O-CG2 3.23Å; C173-I177 WeakPolarHBondContact O-CG2 3.45Å; C173-I177 PolarHBondContact O-N 3.07Å; G174-I177 WeakPolarHBondContact O-CG2 3.43Å; I177-S179 VanDerWaalsContact C-N 3.3Å; I177-S179 PolarHBondContact O-N 3.08Å; I177-E180 HydrophobicContact CD1-CB 4.45Å; I177-E180 WeakPolarHBondContact CD1-OE2 3.32Å; I177-E180 WeakPolarHBondContact O-CB 3.47Å; I177-E180 PolarHBondContact O-N 2.89Å; I177-Y181 HydrophobicContact CD1-CD2 4.45Å; I177-Y181 HydrophobicContact CD1-CE2 4.07Å; I177-Y181 HydrophobicContact CG1-CD2 4.33Å; I177-Y181 HydrophobicContact CG1-CE2 4.18Å; I177-Y181 WeakPolarHBondContact O-CD2 3.49Å; I177-Y181 PolarHBondContact O-N 3.34Å; I177-F238 HydrophobicContact CG1-CB 4.24Å; I177-F238 HydrophobicContact CG2-CD1 4.08Å; I177-F238 HydrophobicContact CG2-CE1 4.28Å; I177-F238 HydrophobicContact CG2-CG 4.27Å
178	I	91.2	Very high	87.7	Confident	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.109	C	C	.	.	H	α-helix	trans	-63.1	-40.3	174.5	-67.5	166.9	0	0	0	110.4	V65 V68 G174 I175 I176 E180 Y181 F182 A189 A193	V65-I178 HydrophobicContact CG2-CG1 4.34Å; V68-I178 HydrophobicContact CB-CD1 4.17Å; V68-I178 HydrophobicContact CG1-CD1 4.06Å; V68-I178 HydrophobicContact CG2-CD1 4.12Å; V68-I178 HydrophobicContact CG2-CG1 4.29Å; G174-I178 WeakPolarHBondContact O-CD1 3.32Å; G174-I178 VanDerWaalsContact O-CG1 3.29Å; G174-I178 WeakPolarHBondContact O-CG1 3.37Å; G174-I178 PolarHBondContact O-N 2.85Å; I175-I178 PolarHBondContact O-N 3.36Å; I176-I178 VanDerWaalsContact C-N 3.29Å; I176-I178 PolarHBondContact O-N 3.3Å; I178-E180 PolarHBondContact O-N 3.2Å; I178-Y181 PolarHBondContact O-N 3.29Å; I178-Y181 VanDerWaalsContact O-N 3.16Å; I178-F182 HydrophobicContact CG2-CD2 4.08Å; I178-F182 PolarHBondContact O-N 3.2Å; I178-A189 HydrophobicContact CG2-CB 3.93Å; I178-A193 HydrophobicContact CD1-CB 3.35Å
179	S	85	Confident	87.4	Confident	2 Å²	2	21.7 Å²	21.7	1%	0.014	11%	0.108	C	C	.	.	H	α-helix	trans	-65.7	-23.7	178.2	84.1	0	0	0	0	113.3	R55 I175 I176 I177 R395 A398	R55-S179 PolarHBondContact NH1-O 3.36Å; R55-S179 VanDerWaalsContact NH1-O 3.1Å; I175-S179 PolarHBondContact O-N 3.41Å; I176-S179 WeakPolarHBondContact O-CB 3.49Å; I176-S179 PolarHBondContact O-N 3.3Å; I176-S179 PolarHBondContact O-OG 3.49Å; I177-S179 VanDerWaalsContact C-N 3.3Å; I177-S179 PolarHBondContact O-N 3.08Å; S179-R395 PolarHBondContact O-NH1 3.4Å; S179-A398 WeakPolarHBondContact CB-O 3.22Å; S179-A398 PolarHBondContact OG-O 2.89Å
180	E	86.2	Confident	87	Confident	21 Å²	21	21.7 Å²	21.7	10%	0.098	11%	0.108	C	C	.	.	H	α-helix	trans	-71.5	-35.8	174	-66.5	-177.7	-153.6	0	0	112	R55 I176 I177 I178 V241 P392	R55-E180 WeakPolarHBondContact CG-O 2.96Å; I176-E180 PolarHBondContact O-N 2.82Å; I177-E180 HydrophobicContact CD1-CB 4.45Å; I177-E180 WeakPolarHBondContact CD1-OE2 3.32Å; I177-E180 WeakPolarHBondContact O-CB 3.47Å; I177-E180 PolarHBondContact O-N 2.89Å; I178-E180 PolarHBondContact O-N 3.2Å; E180-V241 HydrophobicContact CB-CG2 4.35Å; E180-P392 WeakPolarHBondContact OE1-CG 3.41Å
181	Y	87.7	Confident	86.5	Confident	24 Å²	24	23.2 Å²	23.2	9%	0.094	12%	0.124	C	C	.	.	H	α-helix	trans	-91.5	-30	-177	-81.3	-84.1	0	0	0	114.5	D57 W60 V64 I177 I178 R239 V241	D57-Y181 PolarHBondContact N-O 3.48Å; W60-Y181 HydrophobicContact CB-CE1 4.16Å; W60-Y181 AromaticContact CD1-CZ 3.84Å; W60-Y181 VanDerWaalsContact CD1-OH 3.31Å; V64-Y181 HydrophobicContact CG2-CD2 4.3Å; V64-Y181 HydrophobicContact CG2-CE2 3.89Å; I177-Y181 HydrophobicContact CD1-CD2 4.45Å; I177-Y181 HydrophobicContact CD1-CE2 4.07Å; I177-Y181 HydrophobicContact CG1-CD2 4.33Å; I177-Y181 HydrophobicContact CG1-CE2 4.18Å; I177-Y181 WeakPolarHBondContact O-CD2 3.49Å; I177-Y181 PolarHBondContact O-N 3.34Å; I178-Y181 PolarHBondContact O-N 3.29Å; I178-Y181 VanDerWaalsContact O-N 3.16Å; Y181-R239 VanDerWaalsContact CE2-O 3.26Å; Y181-R239 WeakPolarHBondContact CE2-O 3.37Å; Y181-R239 PolarHBondContact OH-O 2.89Å; Y181-V241 HydrophobicContact CD1-CG2 3.96Å; Y181-V241 HydrophobicContact CD2-CG2 4.2Å; Y181-V241 HydrophobicContact CE1-CG2 3.81Å; Y181-V241 HydrophobicContact CE2-CG2 4.06Å; Y181-V241 HydrophobicContact CG-CG2 4.16Å
182	F	86	Confident	86.4	Confident	0 Å²	0	24.1 Å²	24.1	0%	0	13%	0.132	C	C	.	.			trans	-121.5	139.3	-170	-63.7	-85.6	0	0	0	113.8	D57 G61 W62 V65 I178 K185 R186 A189	D57-F182 HydrophobicContact CB-CD1 4.39Å; D57-F182 VanDerWaalsContact OD1-CA 3.23Å; D57-F182 WeakPolarHBondContact OD1-CA 3.49Å; D57-F182 WeakPolarHBondContact OD1-CD1 3.12Å; G61-F182 WeakPolarHBondContact O-CE2 3.27Å; W62-F182 HydrophobicContact CD2-CE1 4.36Å; W62-F182 AromaticContact CD2-CZ 3.95Å; W62-F182 HydrophobicContact CD2-CZ 3.95Å; W62-F182 AromaticContact CE2-CE1 3.91Å; W62-F182 AromaticContact CE2-CZ 3.97Å; W62-F182 HydrophobicContact CE3-CZ 4.28Å; W62-F182 HydrophobicContact CG-CZ 4.29Å; W62-F182 HydrophobicContact CH2-CE1 4.44Å; W62-F182 AromaticContact CZ2-CE1 3.96Å; W62-F182 HydrophobicContact CZ2-CE1 3.96Å; W62-F182 HydrophobicContact CZ2-CZ 4.34Å; V65-F182 HydrophobicContact CG2-CD2 4.39Å; V65-F182 HydrophobicContact CG2-CE2 3.59Å; V65-F182 HydrophobicContact CG2-CZ 4.13Å; I178-F182 HydrophobicContact CG2-CD2 4.08Å; I178-F182 PolarHBondContact O-N 3.2Å; F182-K185 HydrophobicContact CD1-CB 4.09Å; F182-R186 HydrophobicContact CB-CB 4.07Å; F182-R186 HydrophobicContact CB-CG 4.43Å; F182-R186 PolarHBondContact O-NE 3.44Å; F182-A189 HydrophobicContact CB-CB 4.33Å; F182-A189 HydrophobicContact CD1-CB 4.07Å; F182-A189 HydrophobicContact CD2-CB 3.63Å; F182-A189 HydrophobicContact CE1-CB 4.26Å; F182-A189 HydrophobicContact CE2-CB 3.84Å; F182-A189 HydrophobicContact CG-CB 3.75Å; F182-A189 HydrophobicContact CZ-CB 4.14Å
183	E	77.9	Confident	86.5	Confident	51 Å²	51	23.8 Å²	23.8	24%	0.238	13%	0.13	C	C	.	.	S	Bend	trans	-120.9	-66.4	176.5	-175.5	147.2	-159.3	0	0	111.2	R55 D57 V404	R55-E183 HydrophobicContact CB-CB 4.22Å; R55-E183 IonicContact CZ-OE1 3.54Å; R55-E183 IonicContact CZ-OE2 3.4Å; R55-E183 VanDerWaalsContact CZ-OE2 3.24Å; R55-E183 IonicContact NE-OE2 3.22Å; R55-E183 PolarHBondContact NE-OE2 2.68Å; R55-E183 IonicContact NH2-OE1 2.89Å; R55-E183 PolarHBondContact NH2-OE1 2.77Å; R55-E183 IonicContact NH2-OE2 2.68Å; R55-E183 PolarHBondContact NH2-OE2 3.18Å; D57-E183 PolarHBondContact OD1-N 3.35Å; E183-V404 HydrophobicContact CG-CB 4.24Å; E183-V404 HydrophobicContact CG-CG2 4.35Å
184	T	74.1	Confident	86.3	Confident	51 Å²	51	24.3 Å²	24.3	31%	0.313	13%	0.133	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-40.4	-175.3	65.3	0	0	0	0	111.2	D57 R186 S403 K405	D57-T184 VanDerWaalsContact CG-OG1 3.32Å; D57-T184 PolarHBondContact OD1-N 2.82Å; D57-T184 WeakPolarHBondContact OD2-CB 3.38Å; D57-T184 WeakPolarHBondContact OD2-CG2 3.48Å; D57-T184 PolarHBondContact OD2-N 3.22Å; D57-T184 PolarHBondContact OD2-OG1 3.25Å; T184-R186 VanDerWaalsContact C-N 3.31Å; T184-S403 PolarHBondContact O-OG 2.89Å; T184-S403 VanDerWaalsContact O-OG 3.08Å; T184-K405 HydrophobicContact CG2-CD 4.04Å; T184-K405 HydrophobicContact CG2-CG 4.41Å
185	K	79.7	Confident	86.2	Confident	99 Å²	99	25 Å²	25	43%	0.43	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	-92.6	13.3	178.9	-63	179.4	-175.6	170.5	0	112.6	D57 W62 F182 S187 L188 A189	D57-K185 PolarHBondContact OD1-N 2.94Å; W62-K185 HydrophobicContact CZ2-CD 4.42Å; F182-K185 HydrophobicContact CD1-CB 4.09Å; K185-S187 VanDerWaalsContact C-N 3.34Å; K185-S187 PolarHBondContact O-N 3.33Å; K185-L188 PolarHBondContact O-N 3.01Å; K185-A189 WeakPolarHBondContact O-CB 3.4Å; K185-A189 PolarHBondContact O-N 3.14Å
186	R	82.7	Confident	86.3	Confident	1 Å²	1	24.4 Å²	24.4	0%	0.004	14%	0.135	C	C	.	.	H	α-helix	trans	-59.4	-42.7	-175.7	-170.7	-171.3	-59.4	169.2	10.8	112.8	F182 T184 L188 A189 T190 D397 Y400	F182-R186 HydrophobicContact CB-CB 4.07Å; F182-R186 HydrophobicContact CB-CG 4.43Å; F182-R186 PolarHBondContact O-NE 3.44Å; T184-R186 VanDerWaalsContact C-N 3.31Å; R186-L188 VanDerWaalsContact C-N 3.32Å; R186-L188 PolarHBondContact O-N 3.32Å; R186-A189 PolarHBondContact O-N 2.92Å; R186-T190 VanDerWaalsContact O-CB 3.28Å; R186-T190 WeakPolarHBondContact O-CB 3.43Å; R186-T190 PolarHBondContact O-N 3.44Å; R186-T190 PolarHBondContact O-OG1 3.02Å; R186-D397 IonicContact CZ-OD2 3.75Å; R186-D397 PolarHBondContact NH1-O 3.04Å; R186-D397 IonicContact NH1-OD2 2.96Å; R186-D397 PolarHBondContact NH1-OD2 3.42Å; R186-D397 IonicContact NH2-OD2 3.77Å; R186-D397 PolarHBondContact NH2-OD2 3.44Å; R186-Y400 WeakPolarHBondContact CD-O 3.31Å; R186-Y400 PolarHBondContact NH1-O 3.43Å
187	S	78.8	Confident	86.5	Confident	34 Å²	34	24.6 Å²	24.6	24%	0.238	14%	0.136	C	C	.	.	H	α-helix	trans	-58.7	-45.5	177.7	51.5	0	0	0	0	111.8	K185 G191 Q401	K185-S187 VanDerWaalsContact C-N 3.34Å; K185-S187 PolarHBondContact O-N 3.33Å; S187-G191 PolarHBondContact O-N 2.88Å; S187-Q401 VanDerWaalsContact CA-O 3.29Å; S187-Q401 WeakPolarHBondContact CA-O 3.29Å
188	L	84.1	Confident	86.5	Confident	96 Å²	96	24.6 Å²	24.6	50%	0.503	14%	0.136	S	C	.	.	H	α-helix	trans	-64.3	-48.7	176.7	-179.2	64.1	0	0	0	111.8	W62 K185 R186 T190 G191 I192	W62-L188 HydrophobicContact CH2-CD2 4.35Å; K185-L188 PolarHBondContact O-N 3.01Å; R186-L188 VanDerWaalsContact C-N 3.32Å; R186-L188 PolarHBondContact O-N 3.32Å; L188-T190 PolarHBondContact O-N 3.31Å; L188-G191 PolarHBondContact O-N 2.65Å; L188-I192 HydrophobicContact CD1-CD1 4.02Å; L188-I192 HydrophobicContact CD1-CG1 4.38Å; L188-I192 HydrophobicContact CG-CD1 3.99Å; L188-I192 WeakPolarHBondContact O-CG1 3.45Å; L188-I192 PolarHBondContact O-N 3.15Å
189	A	88.9	Confident	86.7	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-62.1	-44	-179.5	0	0	0	0	0	112.1	V65 I178 F182 K185 R186 A193	V65-A189 HydrophobicContact CG2-CB 3.78Å; I178-A189 HydrophobicContact CG2-CB 3.93Å; F182-A189 HydrophobicContact CB-CB 4.33Å; F182-A189 HydrophobicContact CD1-CB 4.07Å; F182-A189 HydrophobicContact CD2-CB 3.63Å; F182-A189 HydrophobicContact CE1-CB 4.26Å; F182-A189 HydrophobicContact CE2-CB 3.84Å; F182-A189 HydrophobicContact CG-CB 3.75Å; F182-A189 HydrophobicContact CZ-CB 4.14Å; K185-A189 WeakPolarHBondContact O-CB 3.4Å; K185-A189 PolarHBondContact O-N 3.14Å; R186-A189 PolarHBondContact O-N 2.92Å; A189-A193 WeakPolarHBondContact O-CB 3.44Å; A189-A193 PolarHBondContact O-N 3.43Å
190	T	86.9	Confident	87.2	Confident	5 Å²	5	26.5 Å²	26.5	3%	0.031	15%	0.147	C	C	.	.	H	α-helix	trans	-66.2	-43.9	175.8	-51.3	0	0	0	0	110.5	I175 R186 L188 I192 A193 V194 Q401	I175-T190 HydrophobicContact CD1-CG2 4.28Å; R186-T190 VanDerWaalsContact O-CB 3.28Å; R186-T190 WeakPolarHBondContact O-CB 3.43Å; R186-T190 PolarHBondContact O-N 3.44Å; R186-T190 PolarHBondContact O-OG1 3.02Å; L188-T190 PolarHBondContact O-N 3.31Å; T190-I192 PolarHBondContact O-N 3.5Å; T190-A193 PolarHBondContact O-N 2.95Å; T190-V194 HydrophobicContact CG2-CG2 3.96Å; T190-V194 WeakPolarHBondContact O-CB 3.49Å; T190-V194 WeakPolarHBondContact O-CG2 3.28Å; T190-V194 PolarHBondContact O-N 3.45Å; T190-Q401 HydrophobicContact CG2-CB 3.78Å; T190-Q401 HydrophobicContact CG2-CG 3.8Å
191	G	85.5	Confident	87.5	Confident	33 Å²	33	25.6 Å²	25.6	34%	0.34	14%	0.143	S	C	.	.	H	α-helix	trans	-56.4	-49.6	176.1	0	0	0	0	0	112.2	S187 L188 V194 C195	S187-G191 PolarHBondContact O-N 2.88Å; L188-G191 PolarHBondContact O-N 2.65Å; G191-V194 PolarHBondContact O-N 3.41Å; G191-C195 PolarHBondContact O-N 3.31Å; G191-C195 PolarHBondContact O-SG 3.21Å
192	I	91.1	Very high	87.7	Confident	71 Å²	71	28.5 Å²	28.5	36%	0.364	16%	0.157	S	C	.	.	H	α-helix	trans	-60.4	-51.2	176.8	-68.8	164.8	0	0	0	110.6	W62 V65 F69 L188 T190 V194 C195	W62-I192 HydrophobicContact CH2-CD1 4.41Å; W62-I192 HydrophobicContact CZ3-CD1 3.88Å; V65-I192 HydrophobicContact CG1-CB 4.06Å; V65-I192 HydrophobicContact CG1-CG2 3.73Å; F69-I192 VanDerWaalsContact CD2-O 3.24Å; F69-I192 WeakPolarHBondContact CD2-O 3.4Å; L188-I192 HydrophobicContact CD1-CD1 4.02Å; L188-I192 HydrophobicContact CD1-CG1 4.38Å; L188-I192 HydrophobicContact CG-CD1 3.99Å; L188-I192 WeakPolarHBondContact O-CG1 3.45Å; L188-I192 PolarHBondContact O-N 3.15Å; T190-I192 PolarHBondContact O-N 3.5Å; I192-V194 VanDerWaalsContact C-N 3.31Å; I192-V194 PolarHBondContact O-N 3.06Å; I192-C195 WeakPolarHBondContact O-CB 3.5Å; I192-C195 PolarHBondContact O-N 3.44Å
193	A	92.5	Very high	88.2	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-57	-46.1	-179.8	0	0	0	0	0	112.2	V65 V68 F69 I178 A189 T190 C195 G196	V65-A193 HydrophobicContact CG1-CB 4.27Å; V68-A193 HydrophobicContact CB-CB 3.99Å; V68-A193 HydrophobicContact CG1-CB 3.8Å; F69-A193 WeakPolarHBondContact CA-O 3.45Å; I178-A193 HydrophobicContact CD1-CB 3.35Å; A189-A193 WeakPolarHBondContact O-CB 3.44Å; A189-A193 PolarHBondContact O-N 3.43Å; T190-A193 PolarHBondContact O-N 2.95Å; A193-C195 VanDerWaalsContact C-N 3.34Å; A193-C195 PolarHBondContact O-N 2.99Å; A193-G196 PolarHBondContact O-N 2.99Å
194	V	89.3	Confident	89.1	Confident	11 Å²	11	28.8 Å²	28.8	7%	0.067	16%	0.161	C	C	.	.	H	α-helix	trans	-75.6	-21.2	-175.2	170	0	0	0	0	112.3	I175 T190 G191 I192 G196 S197 R515	I175-V194 HydrophobicContact CD1-CG2 3.77Å; T190-V194 HydrophobicContact CG2-CG2 3.96Å; T190-V194 WeakPolarHBondContact O-CB 3.49Å; T190-V194 WeakPolarHBondContact O-CG2 3.28Å; T190-V194 PolarHBondContact O-N 3.45Å; G191-V194 PolarHBondContact O-N 3.41Å; I192-V194 VanDerWaalsContact C-N 3.31Å; I192-V194 PolarHBondContact O-N 3.06Å; V194-G196 PolarHBondContact O-N 3.02Å; V194-G196 VanDerWaalsContact O-N 3.1Å; V194-S197 PolarHBondContact O-N 3.34Å; V194-S197 VanDerWaalsContact O-N 3.14Å; V194-S197 PolarHBondContact O-OG 3.29Å; V194-R515 PolarHBondContact O-NH1 3.29Å
195	C	90.9	Very high	90.1	Very high	14 Å²	14	26.4 Å²	26.4	10%	0.095	15%	0.146	C	C	.	.	H	α-helix	trans	-56.8	-22.6	168.2	-74.8	0	0	0	0	112.7	F69 G191 I192 A193 S197 G198 V199 T512	F69-C195 HydrophobicContact CE2-CB 4.22Å; G191-C195 PolarHBondContact O-N 3.31Å; G191-C195 PolarHBondContact O-SG 3.21Å; I192-C195 WeakPolarHBondContact O-CB 3.5Å; I192-C195 PolarHBondContact O-N 3.44Å; A193-C195 VanDerWaalsContact C-N 3.34Å; A193-C195 PolarHBondContact O-N 2.99Å; C195-S197 PolarHBondContact O-N 3.38Å; C195-G198 PolarHBondContact O-N 2.93Å; C195-G198 VanDerWaalsContact O-N 3.07Å; C195-V199 PolarHBondContact O-N 3Å; C195-T512 HydrophobicContact CB-CG2 4.04Å
196	G	93.9	Very high	90.9	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-53	-37.6	174.8	0	0	0	0	0	112.5	F69 V73 A193 V194 G198 V199 G200	F69-G196 VanDerWaalsContact CD2-CA 3.45Å; F69-G196 VanDerWaalsContact CD2-N 3.3Å; F69-G196 VanDerWaalsContact CE2-CA 3.45Å; V73-G196 VanDerWaalsContact CA-O 3.24Å; V73-G196 WeakPolarHBondContact CA-O 3.31Å; V73-G196 VanDerWaalsContact CG2-O 3.26Å; V73-G196 WeakPolarHBondContact CG2-O 3.39Å; A193-G196 PolarHBondContact O-N 2.99Å; V194-G196 PolarHBondContact O-N 3.02Å; V194-G196 VanDerWaalsContact O-N 3.1Å; G196-G198 VanDerWaalsContact C-N 3.33Å; G196-G198 PolarHBondContact O-N 3.44Å; G196-V199 PolarHBondContact O-N 3.27Å; G196-G200 PolarHBondContact O-N 3.23Å
197	S	92.8	Very high	91.5	Very high	4 Å²	4	27 Å²	27	3%	0.028	16%	0.156	C	C	.	.	H	α-helix	trans	-63.9	-38.1	179.7	88.1	0	0	0	0	112.8	D76 V194 C195 G200 S201 R515	D76-S197 WeakPolarHBondContact OD2-CB 3.24Å; V194-S197 PolarHBondContact O-N 3.34Å; V194-S197 VanDerWaalsContact O-N 3.14Å; V194-S197 PolarHBondContact O-OG 3.29Å; C195-S197 PolarHBondContact O-N 3.38Å; S197-G200 PolarHBondContact O-N 2.94Å; S197-S201 PolarHBondContact O-N 3.12Å; S197-S201 PolarHBondContact O-OG 2.87Å; S197-R515 PolarHBondContact OG-NH1 3.03Å
198	G	91.8	Very high	92.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-72.7	-37.7	179.8	0	0	0	0	0	111.9	C195 G196 G200 S201 F202 G508 T512	C195-G198 PolarHBondContact O-N 2.93Å; C195-G198 VanDerWaalsContact O-N 3.07Å; G196-G198 VanDerWaalsContact C-N 3.33Å; G196-G198 PolarHBondContact O-N 3.44Å; G198-G200 VanDerWaalsContact C-N 3.33Å; G198-S201 PolarHBondContact O-N 3.37Å; G198-F202 WeakPolarHBondContact O-CB 3.38Å; G198-F202 PolarHBondContact O-N 3.05Å; G198-G508 CarbonylContact O-C 3.56Å; G198-G508 WeakPolarHBondContact O-CA 3.37Å; G198-T512 VanDerWaalsContact C-OG1 3.31Å; G198-T512 VanDerWaalsContact CA-OG1 3.26Å; G198-T512 WeakPolarHBondContact CA-OG1 3.5Å
199	V	94.7	Very high	92.8	Very high	42 Å²	42	21.1 Å²	21.1	26%	0.255	12%	0.122	S	C	.	.	H	α-helix	trans	-63.1	-40.7	169.5	175.2	0	0	0	0	110.8	F69 V73 C195 G196 F202 V203	F69-V199 HydrophobicContact CE2-CG2 4.35Å; F69-V199 HydrophobicContact CZ-CB 4.39Å; F69-V199 HydrophobicContact CZ-CG2 4.05Å; V73-V199 HydrophobicContact CG1-CG1 4.43Å; V73-V199 HydrophobicContact CG2-CB 4.07Å; V73-V199 HydrophobicContact CG2-CG1 4.05Å; C195-V199 PolarHBondContact O-N 3Å; G196-V199 PolarHBondContact O-N 3.27Å; V199-F202 WeakPolarHBondContact O-CB 3.46Å; V199-F202 PolarHBondContact O-N 3.42Å; V199-F202 VanDerWaalsContact O-N 3.15Å; V199-V203 HydrophobicContact CG1-CG2 4.08Å; V199-V203 WeakPolarHBondContact O-CB 3.24Å; V199-V203 WeakPolarHBondContact O-CG2 3.4Å; V199-V203 PolarHBondContact O-N 2.79Å
200	G	95.8	Very high	93.1	Very high	0 Å²	0	26 Å²	26	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-58.8	-50.3	173.9	0	0	0	0	0	112.5	V73 G77 G196 S197 G198 F202 V203 F204	V73-G200 VanDerWaalsContact O-CA 3.29Å; V73-G200 WeakPolarHBondContact O-CA 3.19Å; G77-G200 VanDerWaalsContact CA-C 3.49Å; G196-G200 PolarHBondContact O-N 3.23Å; S197-G200 PolarHBondContact O-N 2.94Å; G198-G200 VanDerWaalsContact C-N 3.33Å; G200-F202 PolarHBondContact O-N 3.16Å; G200-V203 PolarHBondContact O-N 3.3Å; G200-F204 WeakPolarHBondContact O-CB 3.16Å; G200-F204 WeakPolarHBondContact O-CD2 3.26Å; G200-F204 PolarHBondContact O-N 2.97Å
201	S	92.1	Very high	93.6	Very high	1 Å²	1	26.6 Å²	26.6	1%	0.007	15%	0.151	C	C	.	.	H	α-helix	trans	-62.4	-23.6	175	-55.1	0	0	0	0	113.5	L80 S197 G198 P205	L80-S201 WeakPolarHBondContact CD1-OG 3.36Å; S197-S201 PolarHBondContact O-N 3.12Å; S197-S201 PolarHBondContact O-OG 2.87Å; G198-S201 PolarHBondContact O-N 3.37Å; S201-P205 WeakPolarHBondContact O-CD 3.44Å; S201-P205 WeakPolarHBondContact O-CG 3.47Å
202	F	93.3	Very high	94.1	Very high	86 Å²	86	26.8 Å²	26.8	38%	0.377	15%	0.145	S	C	.	.	H	α-helix	trans	-79.6	-45.9	174.1	154	-114.4	0	0	0	112.7	G198 V199 G200 S505 I509	G198-F202 WeakPolarHBondContact O-CB 3.38Å; G198-F202 PolarHBondContact O-N 3.05Å; V199-F202 WeakPolarHBondContact O-CB 3.46Å; V199-F202 PolarHBondContact O-N 3.42Å; V199-F202 VanDerWaalsContact O-N 3.15Å; G200-F202 PolarHBondContact O-N 3.16Å; F202-S505 PolarHBondContact O-OG 2.71Å; F202-S505 VanDerWaalsContact O-OG 3.12Å; F202-I509 HydrophobicContact CB-CG1 4.18Å; F202-I509 HydrophobicContact CD2-CD1 3.81Å; F202-I509 HydrophobicContact CD2-CG1 3.79Å; F202-I509 HydrophobicContact CE2-CD1 4.14Å; F202-I509 HydrophobicContact CE2-CG1 4.48Å; F202-I509 HydrophobicContact CG-CD1 4.5Å; F202-I509 HydrophobicContact CG-CG1 4Å
203	V	95.7	Very high	94.2	Very high	46 Å²	46	28.4 Å²	28.4	28%	0.279	15%	0.151	S	C	.	.	H	α-helix	trans	-84.8	-39	-170.5	172.3	0	0	0	0	112.6	V199 G200 P206 I207	V199-V203 HydrophobicContact CG1-CG2 4.08Å; V199-V203 WeakPolarHBondContact O-CB 3.24Å; V199-V203 WeakPolarHBondContact O-CG2 3.4Å; V199-V203 PolarHBondContact O-N 2.79Å; G200-V203 PolarHBondContact O-N 3.3Å; V203-P206 WeakPolarHBondContact O-CD 3.1Å; V203-P206 WeakPolarHBondContact O-CG 3.13Å; V203-I207 HydrophobicContact CG1-CD1 3.42Å; V203-I207 VanDerWaalsContact CG1-CD1 3.42Å; V203-I207 HydrophobicContact CG1-CG1 4.31Å; V203-I207 WeakPolarHBondContact O-CG1 3.31Å
204	F	96.8	Very high	94.4	Very high	11 Å²	11	33.7 Å²	33.7	5%	0.048	18%	0.18	C	C	.	.	H	α-helix	trans	-71.4	-36.4	-172.1	-85.3	-95.6	0	0	0	115.4	V73 G77 I78 G200 I207 F208 I224 V227	V73-F204 HydrophobicContact CG1-CE2 4.13Å; V73-F204 WeakPolarHBondContact O-CE2 3.4Å; G77-F204 WeakPolarHBondContact O-CB 3.34Å; I78-F204 HydrophobicContact CD1-CE1 4.23Å; I78-F204 HydrophobicContact CG1-CD1 3.95Å; I78-F204 HydrophobicContact CG1-CE1 3.54Å; I78-F204 HydrophobicContact CG1-CZ 4.14Å; G200-F204 WeakPolarHBondContact O-CB 3.16Å; G200-F204 WeakPolarHBondContact O-CD2 3.26Å; G200-F204 PolarHBondContact O-N 2.97Å; F204-I207 PolarHBondContact O-N 3.01Å; F204-F208 HydrophobicContact CB-CD2 4.11Å; F204-F208 HydrophobicContact CB-CE2 4.12Å; F204-F208 HydrophobicContact CD1-CD2 4.24Å; F204-F208 AromaticContact CD1-CE2 3.68Å; F204-F208 HydrophobicContact CD1-CE2 3.68Å; F204-F208 HydrophobicContact CD1-CZ 4.35Å; F204-F208 HydrophobicContact CG-CE2 4.36Å; F204-F208 VanDerWaalsContact O-CD2 3.25Å; F204-F208 WeakPolarHBondContact O-CD2 3.16Å; F204-F208 PolarHBondContact O-N 3.34Å; F204-I224 HydrophobicContact CE1-CD1 4.34Å; F204-V227 HydrophobicContact CZ-CG1 4.24Å
205	P	95.9	Very high	94.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-55	-52.6	179.1	-23.3	31.5	0	0	0	114.2	S81 S201 I207 F208 T209 S501 L504	S81-P205 WeakPolarHBondContact OG-CD 3.38Å; S81-P205 WeakPolarHBondContact OG-CG 2.87Å; S201-P205 WeakPolarHBondContact O-CD 3.44Å; S201-P205 WeakPolarHBondContact O-CG 3.47Å; P205-I207 VanDerWaalsContact C-N 3.32Å; P205-I207 PolarHBondContact O-N 2.8Å; P205-F208 PolarHBondContact O-N 3.24Å; P205-T209 PolarHBondContact O-N 3.09Å; P205-T209 VanDerWaalsContact O-N 3.08Å; P205-T209 PolarHBondContact O-OG1 3.09Å; P205-T209 VanDerWaalsContact O-OG1 3.13Å; P205-S501 WeakPolarHBondContact CB-O 3.46Å; P205-L504 HydrophobicContact CB-CB 4.13Å; P205-L504 HydrophobicContact CB-CD1 4.43Å; P205-L504 HydrophobicContact CG-CB 3.69Å; P205-L504 HydrophobicContact CG-CD1 4.29Å
206	P	94.8	Very high	95	Very high	46 Å²	46	40.3 Å²	40.3	30%	0.299	21%	0.21	S	C	.	.	H	α-helix	trans	-67.7	-31.9	177.7	26.5	-34.6	0	0	0	112.7	V203 T209 L210	V203-P206 WeakPolarHBondContact O-CD 3.1Å; V203-P206 WeakPolarHBondContact O-CG 3.13Å; P206-T209 PolarHBondContact O-N 3.25Å; P206-L210 WeakPolarHBondContact O-CB 3.36Å; P206-L210 PolarHBondContact O-N 3.45Å
207	I	96	Very high	95.2	Very high	67 Å²	67	40.9 Å²	40.9	34%	0.344	21%	0.212	S	C	.	.	H	α-helix	trans	-62.2	-46.1	173.8	-71.3	179.1	0	0	0	110.6	V203 F204 P205 L210 L211	V203-I207 HydrophobicContact CG1-CD1 3.42Å; V203-I207 VanDerWaalsContact CG1-CD1 3.42Å; V203-I207 HydrophobicContact CG1-CG1 4.31Å; V203-I207 WeakPolarHBondContact O-CG1 3.31Å; F204-I207 PolarHBondContact O-N 3.01Å; P205-I207 VanDerWaalsContact C-N 3.32Å; P205-I207 PolarHBondContact O-N 2.8Å; I207-L210 PolarHBondContact O-N 2.89Å; I207-L211 HydrophobicContact CG2-CD1 3.67Å; I207-L211 HydrophobicContact CG2-CG 4.14Å; I207-L211 WeakPolarHBondContact O-CB 3.33Å; I207-L211 WeakPolarHBondContact O-CG 3.47Å; I207-L211 PolarHBondContact O-N 2.85Å
208	F	96.6	Very high	95.4	Very high	1 Å²	1	42.8 Å²	42.8	0%	0.004	22%	0.22	C	C	.	.	H	α-helix	trans	-61.7	-47.4	178.2	-87.9	-66.4	0	0	0	111.5	I78 A82 A85 F86 F204 P205 L210 L211 V212 V220 I224	I78-F208 HydrophobicContact CG1-CZ 4.37Å; I78-F208 HydrophobicContact CG2-CZ 4.4Å; A82-F208 HydrophobicContact CB-CE1 4.28Å; A82-F208 HydrophobicContact CB-CE2 4.16Å; A82-F208 HydrophobicContact CB-CZ 3.81Å; A85-F208 HydrophobicContact CB-CB 3.82Å; A85-F208 HydrophobicContact CB-CD1 4.38Å; A85-F208 HydrophobicContact CB-CG 4.27Å; F86-F208 AromaticContact CE2-CD1 3.9Å; F86-F208 HydrophobicContact CE2-CD1 3.9Å; F86-F208 AromaticContact CE2-CE1 3.51Å; F86-F208 HydrophobicContact CE2-CE1 3.51Å; F86-F208 HydrophobicContact CE2-CZ 4.42Å; F86-F208 HydrophobicContact CZ-CD1 4.13Å; F86-F208 AromaticContact CZ-CE1 3.94Å; F86-F208 HydrophobicContact CZ-CE1 3.94Å; F204-F208 HydrophobicContact CB-CD2 4.11Å; F204-F208 HydrophobicContact CB-CE2 4.12Å; F204-F208 HydrophobicContact CD1-CD2 4.24Å; F204-F208 AromaticContact CD1-CE2 3.68Å; F204-F208 HydrophobicContact CD1-CE2 3.68Å; F204-F208 HydrophobicContact CD1-CZ 4.35Å; F204-F208 HydrophobicContact CG-CE2 4.36Å; F204-F208 VanDerWaalsContact O-CD2 3.25Å; F204-F208 WeakPolarHBondContact O-CD2 3.16Å; F204-F208 PolarHBondContact O-N 3.34Å; P205-F208 PolarHBondContact O-N 3.24Å; F208-L210 VanDerWaalsContact C-N 3.34Å; F208-L210 PolarHBondContact O-N 3.13Å; F208-L211 PolarHBondContact O-N 2.85Å; F208-V212 WeakPolarHBondContact O-CG1 3.23Å; F208-V212 WeakPolarHBondContact O-CG2 3.13Å; F208-V212 PolarHBondContact O-N 3.02Å; F208-V220 HydrophobicContact CD1-CG1 4.39Å; F208-V220 HydrophobicContact CE1-CG1 4.47Å; F208-I224 HydrophobicContact CD1-CD1 4.44Å; F208-I224 HydrophobicContact CE1-CD1 3.57Å; F208-I224 HydrophobicContact CE1-CG1 3.71Å; F208-I224 HydrophobicContact CE2-CD1 4.41Å; F208-I224 HydrophobicContact CZ-CD1 3.54Å; F208-I224 HydrophobicContact CZ-CG1 4.02Å
209	T	94.5	Very high	95.7	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.031	24%	0.242	C	C	.	.	H	α-helix	trans	-53.9	-51.4	176.3	-58.1	0	0	0	0	111	P205 P206 L211 V212 E213 V497 E498 S501	P205-T209 PolarHBondContact O-N 3.09Å; P205-T209 VanDerWaalsContact O-N 3.08Å; P205-T209 PolarHBondContact O-OG1 3.09Å; P205-T209 VanDerWaalsContact O-OG1 3.13Å; P206-T209 PolarHBondContact O-N 3.25Å; T209-L211 PolarHBondContact O-N 3.42Å; T209-V212 WeakPolarHBondContact O-CG2 3.45Å; T209-V212 PolarHBondContact O-N 2.79Å; T209-E213 VanDerWaalsContact CG2-OE1 3.25Å; T209-E213 WeakPolarHBondContact CG2-OE1 3.09Å; T209-E213 VanDerWaalsContact O-CG 3.29Å; T209-E213 WeakPolarHBondContact O-CG 3.26Å; T209-E213 PolarHBondContact O-N 3.1Å; T209-E213 VanDerWaalsContact O-N 3.12Å; T209-V497 HydrophobicContact CG2-CG1 3.87Å; T209-E498 HydrophobicContact CG2-CG 4.31Å; T209-S501 WeakPolarHBondContact OG1-CB 3.3Å; T209-S501 PolarHBondContact OG1-OG 3.32Å
210	L	95.2	Very high	95.8	Very high	102 Å²	102	45.4 Å²	45.4	53%	0.534	23%	0.23	S	C	.	.	H	α-helix	trans	-62.4	-39.6	178.6	-178.3	144	0	0	0	112.9	P206 I207 F208 N214	P206-L210 WeakPolarHBondContact O-CB 3.36Å; P206-L210 PolarHBondContact O-N 3.45Å; I207-L210 PolarHBondContact O-N 2.89Å; F208-L210 VanDerWaalsContact C-N 3.34Å; F208-L210 PolarHBondContact O-N 3.13Å; L210-N214 PolarHBondContact O-N 3.37Å; L210-N214 PolarHBondContact O-ND2 3.44Å
211	L	96.9	Very high	95.9	Very high	18 Å²	18	45.4 Å²	45.4	9%	0.094	23%	0.23	C	C	.	.	H	α-helix	trans	-69.4	-42.9	-180	-74.2	177.8	0	0	0	112	I207 F208 T209 E213 N214 Y215 V220 I223 I224	I207-L211 HydrophobicContact CG2-CD1 3.67Å; I207-L211 HydrophobicContact CG2-CG 4.14Å; I207-L211 WeakPolarHBondContact O-CB 3.33Å; I207-L211 WeakPolarHBondContact O-CG 3.47Å; I207-L211 PolarHBondContact O-N 2.85Å; F208-L211 PolarHBondContact O-N 2.85Å; T209-L211 PolarHBondContact O-N 3.42Å; L211-E213 VanDerWaalsContact C-N 3.3Å; L211-E213 PolarHBondContact O-N 3.31Å; L211-N214 PolarHBondContact O-N 3.4Å; L211-Y215 HydrophobicContact CD2-CD2 3.99Å; L211-Y215 HydrophobicContact CD2-CE2 4.11Å; L211-Y215 WeakPolarHBondContact O-CB 3.42Å; L211-Y215 PolarHBondContact O-N 2.92Å; L211-V220 HydrophobicContact CB-CG1 3.88Å; L211-V220 HydrophobicContact CB-CG2 3.89Å; L211-V220 HydrophobicContact CD1-CG1 4.1Å; L211-V220 WeakPolarHBondContact O-CG2 3.35Å; L211-I223 HydrophobicContact CD1-CG2 4.15Å; L211-I223 HydrophobicContact CD2-CD1 4.01Å; L211-I223 HydrophobicContact CD2-CG2 4.46Å; L211-I224 HydrophobicContact CD1-CD1 4.48Å
212	V	95.6	Very high	96.2	Very high	38 Å²	38	49.7 Å²	49.7	23%	0.23	25%	0.252	C	S	.	.	H	α-helix	trans	-74.6	-20.4	-179	-59.2	0	0	0	0	113.3	A85 F86 I89 F208 T209 V220	A85-V212 HydrophobicContact CB-CG1 4.4Å; F86-V212 HydrophobicContact CE1-CG1 4.1Å; F86-V212 HydrophobicContact CZ-CG1 4.5Å; I89-V212 HydrophobicContact CD1-CB 3.8Å; I89-V212 HydrophobicContact CD1-CG1 3.87Å; I89-V212 HydrophobicContact CD1-CG2 4.32Å; F208-V212 WeakPolarHBondContact O-CG1 3.23Å; F208-V212 WeakPolarHBondContact O-CG2 3.13Å; F208-V212 PolarHBondContact O-N 3.02Å; T209-V212 WeakPolarHBondContact O-CG2 3.45Å; T209-V212 PolarHBondContact O-N 2.79Å; V212-V220 HydrophobicContact CG1-CG1 4.47Å; V212-V220 HydrophobicContact CG1-CG2 4.24Å
213	E	94.1	Very high	96.4	Very high	104 Å²	104	48.6 Å²	48.6	49%	0.486	25%	0.25	S	C	.	.	H	α-helix	trans	-72.2	-36.7	171.6	-77.9	168.6	-169.6	0	0	112.6	T209 L211	T209-E213 VanDerWaalsContact CG2-OE1 3.25Å; T209-E213 WeakPolarHBondContact CG2-OE1 3.09Å; T209-E213 VanDerWaalsContact O-CG 3.29Å; T209-E213 WeakPolarHBondContact O-CG 3.26Å; T209-E213 PolarHBondContact O-N 3.1Å; T209-E213 VanDerWaalsContact O-N 3.12Å; L211-E213 VanDerWaalsContact C-N 3.3Å; L211-E213 PolarHBondContact O-N 3.31Å
214	N	95.2	Very high	96.4	Very high	111 Å²	111	46.5 Å²	46.5	59%	0.594	24%	0.237	S	C	*	.	H	α-helix	trans	-101.1	-21.1	-172.1	-70	-79.7	0	0	0	114	L210 L211	L210-N214 PolarHBondContact O-N 3.37Å; L210-N214 PolarHBondContact O-ND2 3.44Å; L211-N214 PolarHBondContact O-N 3.4Å
215	Y	97.4	Very high	96.5	Very high	115 Å²	115	46 Å²	46	45%	0.451	24%	0.235	S	C	.	.	S	Bend	trans	-130.3	156.6	-173.5	-62	-77.3	0	0	0	111.9	L211 I223	L211-Y215 HydrophobicContact CD2-CD2 3.99Å; L211-Y215 HydrophobicContact CD2-CE2 4.11Å; L211-Y215 WeakPolarHBondContact O-CB 3.42Å; L211-Y215 PolarHBondContact O-N 2.92Å; Y215-I223 HydrophobicContact CD2-CD1 4.25Å; Y215-I223 HydrophobicContact CE2-CD1 4.38Å; Y215-I223 HydrophobicContact CG-CD1 4.45Å
216	S	96.8	Very high	96.6	Very high	49 Å²	49	47.7 Å²	47.7	34%	0.343	25%	0.252	S	S	.	.			trans	-68.1	151.7	170.9	83.8	0	0	0	0	110.6	Q218 Q219 V220	S216-Q218 PolarHBondContact O-N 3.48Å; S216-Q218 VanDerWaalsContact O-N 3.09Å; S216-Q218 PolarHBondContact OG-OE1 3.39Å; S216-Q219 WeakPolarHBondContact O-CA 3.39Å; S216-Q219 WeakPolarHBondContact O-CB 3.34Å; S216-Q219 PolarHBondContact O-N 2.99Å; S216-Q219 WeakPolarHBondContact OG-CG 3.17Å; S216-Q219 PolarHBondContact OG-N 3.18Å; S216-V220 WeakPolarHBondContact O-CG2 3.28Å; S216-V220 PolarHBondContact O-N 3.33Å
217	W	96.7	Very high	96.7	Very high	12 Å²	12	48 Å²	48	5%	0.045	25%	0.253	C	S	.	.	H	α-helix	trans	-57.6	-30.5	-179.6	70.4	-96.7	0	0	0	112.8	F86 I89 W90 Y93 F94 A149 V220 M221	F86-W217 HydrophobicContact CD1-CB 4.13Å; F86-W217 HydrophobicContact CE1-CB 3.94Å; I89-W217 HydrophobicContact CG2-CB 3.96Å; I89-W217 HydrophobicContact CG2-CG 4.02Å; W90-W217 HydrophobicContact CZ2-CE3 4.43Å; W90-W217 AromaticContact NE1-CD2 3.47Å; W90-W217 AromaticContact NE1-CE3 3.29Å; W90-W217 VanDerWaalsContact NE1-CE3 3.29Å; W90-W217 AromaticContact NE1-CG 3.96Å; W90-W217 AromaticContact NE1-CZ3 3.79Å; Y93-W217 HydrophobicContact CD1-CZ2 4.01Å; Y93-W217 AromaticContact CD1-NE1 3.91Å; Y93-W217 AromaticContact CD2-NE1 3.58Å; Y93-W217 AromaticContact CE1-CZ2 3.7Å; Y93-W217 HydrophobicContact CE1-CZ2 3.7Å; Y93-W217 AromaticContact CE2-NE1 3.74Å; Y93-W217 AromaticContact CG-NE1 3.66Å; F94-W217 HydrophobicContact CE2-CZ2 4.32Å; F94-W217 AromaticContact CZ-CH2 4Å; F94-W217 HydrophobicContact CZ-CH2 4Å; F94-W217 AromaticContact CZ-CZ2 3.88Å; F94-W217 HydrophobicContact CZ-CZ2 3.88Å; A149-W217 HydrophobicContact CB-CH2 4.2Å; W217-V220 PolarHBondContact O-N 2.99Å; W217-M221 HydrophobicContact CE3-CG 4.01Å; W217-M221 HydrophobicContact CZ3-CG 4.27Å; W217-M221 VanDerWaalsContact O-CG 3.27Å; W217-M221 WeakPolarHBondContact O-CG 3.49Å; W217-M221 PolarHBondContact O-N 2.78Å
218	Q	97.6	Very high	96.8	Very high	44 Å²	44	44.8 Å²	44.8	21%	0.206	24%	0.237	C	C	.	.	H	α-helix	trans	-66.7	-41.1	173.8	-59.8	92.6	-17.4	0	0	112.3	V147 S216 M221 L222	V147-Q218 HydrophobicContact CG1-CB 4.15Å; S216-Q218 PolarHBondContact O-N 3.48Å; S216-Q218 VanDerWaalsContact O-N 3.09Å; S216-Q218 PolarHBondContact OG-OE1 3.39Å; Q218-M221 WeakPolarHBondContact O-CB 3.25Å; Q218-M221 PolarHBondContact O-N 2.88Å; Q218-L222 PolarHBondContact O-N 3.39Å; Q218-L222 VanDerWaalsContact O-N 3.15Å
219	Q	97.7	Very high	96.8	Very high	97 Å²	97	48.1 Å²	48.1	45%	0.453	25%	0.254	S	S	.	.	H	α-helix	trans	-67.2	-40.7	174.7	-69.6	169.3	-19.8	0	0	110.8	S216 M221 L222 I223	S216-Q219 WeakPolarHBondContact O-CA 3.39Å; S216-Q219 WeakPolarHBondContact O-CB 3.34Å; S216-Q219 PolarHBondContact O-N 2.99Å; S216-Q219 WeakPolarHBondContact OG-CG 3.17Å; S216-Q219 PolarHBondContact OG-N 3.18Å; Q219-M221 VanDerWaalsContact C-N 3.32Å; Q219-M221 PolarHBondContact O-N 3.29Å; Q219-L222 WeakPolarHBondContact O-CB 3.24Å; Q219-L222 PolarHBondContact O-N 2.94Å; Q219-I223 WeakPolarHBondContact O-CG1 3.29Å; Q219-I223 PolarHBondContact O-N 3.35Å
220	V	97.8	Very high	97	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.277	C	S	.	.	H	α-helix	trans	-60.3	-42.5	173.8	-176.3	0	0	0	0	110.7	F86 F208 L211 V212 S216 W217 L222 I223 I224	F86-V220 HydrophobicContact CE1-CB 4.35Å; F86-V220 HydrophobicContact CE1-CG1 4.24Å; F86-V220 HydrophobicContact CZ-CB 4.2Å; F86-V220 HydrophobicContact CZ-CG1 3.67Å; F208-V220 HydrophobicContact CD1-CG1 4.39Å; F208-V220 HydrophobicContact CE1-CG1 4.47Å; L211-V220 HydrophobicContact CB-CG1 3.88Å; L211-V220 HydrophobicContact CB-CG2 3.89Å; L211-V220 HydrophobicContact CD1-CG1 4.1Å; L211-V220 WeakPolarHBondContact O-CG2 3.35Å; V212-V220 HydrophobicContact CG1-CG1 4.47Å; V212-V220 HydrophobicContact CG1-CG2 4.24Å; S216-V220 WeakPolarHBondContact O-CG2 3.28Å; S216-V220 PolarHBondContact O-N 3.33Å; W217-V220 PolarHBondContact O-N 2.99Å; V220-L222 VanDerWaalsContact C-N 3.33Å; V220-L222 PolarHBondContact O-N 2.97Å; V220-I223 PolarHBondContact O-N 3.42Å; V220-I224 HydrophobicContact CG1-CG1 4.19Å; V220-I224 WeakPolarHBondContact O-CB 3.4Å; V220-I224 VanDerWaalsContact O-CG1 3.28Å; V220-I224 WeakPolarHBondContact O-CG1 3.48Å; V220-I224 PolarHBondContact O-N 3.44Å
221	M	97	Very high	97.1	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-57.2	-43.2	174.2	-75.3	-68.9	118.5	0	0	112.4	F86 W90 V147 Y159 W217 Q218 Q219 I224 A225	F86-M221 HydrophobicContact CD1-CE 4.15Å; F86-M221 HydrophobicContact CD2-CE 3.66Å; F86-M221 HydrophobicContact CE1-CE 3.6Å; F86-M221 HydrophobicContact CE2-CE 3.04Å; F86-M221 HydrophobicContact CG-CE 4.19Å; F86-M221 HydrophobicContact CZ-CE 3.02Å; W90-M221 HydrophobicContact CH2-CE 4.42Å; W90-M221 HydrophobicContact CZ2-CE 3.97Å; W90-M221 HydrophobicContact CZ2-SD 4.33Å; V147-M221 HydrophobicContact CG2-CB 3.95Å; Y159-M221 HydrophobicContact CD2-CE 4.38Å; Y159-M221 HydrophobicContact CD2-SD 3.9Å; Y159-M221 HydrophobicContact CE2-CE 3.91Å; Y159-M221 HydrophobicContact CE2-SD 3.93Å; W217-M221 HydrophobicContact CE3-CG 4.01Å; W217-M221 HydrophobicContact CZ3-CG 4.27Å; W217-M221 VanDerWaalsContact O-CG 3.27Å; W217-M221 WeakPolarHBondContact O-CG 3.49Å; W217-M221 PolarHBondContact O-N 2.78Å; Q218-M221 WeakPolarHBondContact O-CB 3.25Å; Q218-M221 PolarHBondContact O-N 2.88Å; Q219-M221 VanDerWaalsContact C-N 3.32Å; Q219-M221 PolarHBondContact O-N 3.29Å; M221-I224 PolarHBondContact O-N 3.14Å; M221-A225 WeakPolarHBondContact O-CB 2.89Å; M221-A225 PolarHBondContact O-N 3.04Å
222	L	97.7	Very high	97.1	Very high	91 Å²	91	50.8 Å²	50.8	48%	0.476	27%	0.265	S	S	.	.	H	α-helix	trans	-64.4	-41.3	176.2	-75.4	171.5	0	0	0	112.6	V147 Q218 Q219 V220 A225 G226	V147-L222 HydrophobicContact CG1-CD1 4.34Å; V147-L222 HydrophobicContact CG1-CG 4.26Å; V147-L222 HydrophobicContact CG2-CD2 3.67Å; V147-L222 HydrophobicContact CG2-CG 3.63Å; Q218-L222 PolarHBondContact O-N 3.39Å; Q218-L222 VanDerWaalsContact O-N 3.15Å; Q219-L222 WeakPolarHBondContact O-CB 3.24Å; Q219-L222 PolarHBondContact O-N 2.94Å; V220-L222 VanDerWaalsContact C-N 3.33Å; V220-L222 PolarHBondContact O-N 2.97Å; L222-A225 PolarHBondContact O-N 2.77Å; L222-G226 PolarHBondContact O-N 3.3Å
223	I	98	Very high	97.2	Very high	63 Å²	63	53.3 Å²	53.3	32%	0.323	28%	0.28	S	S	.	.	H	α-helix	trans	-63	-46.5	176.5	-66.8	167.6	0	0	0	110	L211 Y215 Q219 V220 A225 G226 V227	L211-I223 HydrophobicContact CD1-CG2 4.15Å; L211-I223 HydrophobicContact CD2-CD1 4.01Å; L211-I223 HydrophobicContact CD2-CG2 4.46Å; Y215-I223 HydrophobicContact CD2-CD1 4.25Å; Y215-I223 HydrophobicContact CE2-CD1 4.38Å; Y215-I223 HydrophobicContact CG-CD1 4.45Å; Q219-I223 WeakPolarHBondContact O-CG1 3.29Å; Q219-I223 PolarHBondContact O-N 3.35Å; V220-I223 PolarHBondContact O-N 3.42Å; I223-A225 VanDerWaalsContact C-N 3.32Å; I223-A225 PolarHBondContact O-N 3.29Å; I223-G226 PolarHBondContact O-N 3.41Å; I223-G226 VanDerWaalsContact O-N 3.11Å; I223-V227 WeakPolarHBondContact O-CG2 3.39Å; I223-V227 PolarHBondContact O-N 3.06Å
224	I	96.8	Very high	97.4	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.01	26%	0.26	C	S	.	.	H	α-helix	trans	-63.2	-38.1	177.5	-67.1	-64.3	0	0	0	111.5	I78 F143 F204 F208 L211 V220 M221 G226 V227 E228	I78-I224 HydrophobicContact CD1-CG2 3.66Å; I78-I224 HydrophobicContact CG1-CG2 4.04Å; I78-I224 HydrophobicContact CG2-CG2 4.27Å; F143-I224 HydrophobicContact CD2-CG2 4.38Å; F143-I224 HydrophobicContact CE2-CG2 4.34Å; F204-I224 HydrophobicContact CE1-CD1 4.34Å; F208-I224 HydrophobicContact CD1-CD1 4.44Å; F208-I224 HydrophobicContact CE1-CD1 3.57Å; F208-I224 HydrophobicContact CE1-CG1 3.71Å; F208-I224 HydrophobicContact CE2-CD1 4.41Å; F208-I224 HydrophobicContact CZ-CD1 3.54Å; F208-I224 HydrophobicContact CZ-CG1 4.02Å; L211-I224 HydrophobicContact CD1-CD1 4.48Å; V220-I224 HydrophobicContact CG1-CG1 4.19Å; V220-I224 WeakPolarHBondContact O-CB 3.4Å; V220-I224 VanDerWaalsContact O-CG1 3.28Å; V220-I224 WeakPolarHBondContact O-CG1 3.48Å; V220-I224 PolarHBondContact O-N 3.44Å; M221-I224 PolarHBondContact O-N 3.14Å; I224-G226 VanDerWaalsContact C-N 3.35Å; I224-V227 PolarHBondContact O-N 2.79Å; I224-E228 VanDerWaalsContact O-CB 3.26Å; I224-E228 WeakPolarHBondContact O-CB 3.29Å; I224-E228 PolarHBondContact O-N 3.03Å
225	A	98	Very high	97.4	Very high	2 Å²	2	43.6 Å²	43.6	2%	0.017	23%	0.232	C	C	.	.	H	α-helix	trans	-61.9	-42	172	0	0	0	0	0	111.9	F143 I144 M221 L222 I223 E228 L229	F143-A225 HydrophobicContact CB-CB 3.72Å; I144-A225 HydrophobicContact CG1-CB 3.82Å; M221-A225 WeakPolarHBondContact O-CB 2.89Å; M221-A225 PolarHBondContact O-N 3.04Å; L222-A225 PolarHBondContact O-N 2.77Å; I223-A225 VanDerWaalsContact C-N 3.32Å; I223-A225 PolarHBondContact O-N 3.29Å; A225-E228 PolarHBondContact O-N 3.48Å; A225-L229 VanDerWaalsContact O-CG 3.29Å; A225-L229 WeakPolarHBondContact O-CG 3.38Å; A225-L229 PolarHBondContact O-N 3.07Å
226	G	97.9	Very high	97.4	Very high	34 Å²	34	39.7 Å²	39.7	35%	0.351	22%	0.224	S	C	.	.	H	α-helix	trans	-62.7	-41.7	175.1	0	0	0	0	0	113.1	L222 I223 I224 L229 H230	L222-G226 PolarHBondContact O-N 3.3Å; I223-G226 PolarHBondContact O-N 3.41Å; I223-G226 VanDerWaalsContact O-N 3.11Å; I224-G226 VanDerWaalsContact C-N 3.35Å; G226-L229 PolarHBondContact O-N 2.98Å; G226-H230 PolarHBondContact O-CE1 2.84Å; G226-H230 PolarHBondContact O-ND1 2.96Å
227	V	97.8	Very high	97.4	Very high	52 Å²	52	40 Å²	40	32%	0.315	22%	0.221	S	C	.	.	H	α-helix	trans	-64.9	-45.9	174.1	174.6	0	0	0	0	110.4	I74 F204 I223 I224 L229 H230	I74-V227 HydrophobicContact CG1-CG1 4.22Å; I74-V227 HydrophobicContact CG2-CG1 4.12Å; F204-V227 HydrophobicContact CZ-CG1 4.24Å; I223-V227 WeakPolarHBondContact O-CG2 3.39Å; I223-V227 PolarHBondContact O-N 3.06Å; I224-V227 PolarHBondContact O-N 2.79Å; V227-L229 VanDerWaalsContact C-N 3.29Å; V227-L229 PolarHBondContact O-N 3.45Å; V227-H230 VanDerWaalsContact O-CB 3.32Å; V227-H230 WeakPolarHBondContact O-CB 3.41Å; V227-H230 PolarHBondContact O-N 3.09Å; V227-H230 VanDerWaalsContact O-N 3.16Å; V227-H230 PolarHBondContact O-ND1 3.43Å
228	E	97.2	Very high	97.2	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-55	-43.3	176.5	-178.5	-73.2	152.6	0	0	111.9	S136 A139 G140 F143 F167 I224 A225 H230 C231	S136-E228 WeakPolarHBondContact CA-OE1 2.96Å; A139-E228 HydrophobicContact CB-CG 4.2Å; A139-E228 WeakPolarHBondContact CB-OE1 3.27Å; G140-E228 WeakPolarHBondContact CA-OE2 3.3Å; G140-E228 VanDerWaalsContact N-CD 3.27Å; G140-E228 PolarHBondContact N-OE1 2.87Å; G140-E228 PolarHBondContact N-OE2 3.2Å; G140-E228 VanDerWaalsContact N-OE2 3.08Å; F143-E228 HydrophobicContact CD2-CB 3.97Å; F143-E228 HydrophobicContact CD2-CG 3.93Å; F143-E228 HydrophobicContact CE2-CB 4.02Å; F143-E228 HydrophobicContact CE2-CG 3.78Å; F167-E228 HydrophobicContact CE1-CG 3.88Å; I224-E228 VanDerWaalsContact O-CB 3.26Å; I224-E228 WeakPolarHBondContact O-CB 3.29Å; I224-E228 PolarHBondContact O-N 3.03Å; A225-E228 PolarHBondContact O-N 3.48Å; E228-H230 PolarHBondContact O-N 3.47Å; E228-C231 WeakPolarHBondContact O-CB 3.39Å; E228-C231 PolarHBondContact O-N 3.45Å; E228-C231 PolarHBondContact O-SG 3.21Å; E228-C231 VanDerWaalsContact O-SG 3.41Å
229	L	97.5	Very high	96.8	Very high	70 Å²	70	44.4 Å²	44.4	37%	0.366	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.4	-13.1	-176.1	-75.5	170.1	0	0	0	113.2	A225 G226 V227 C231 L232	A225-L229 VanDerWaalsContact O-CG 3.29Å; A225-L229 WeakPolarHBondContact O-CG 3.38Å; A225-L229 PolarHBondContact O-N 3.07Å; G226-L229 PolarHBondContact O-N 2.98Å; V227-L229 VanDerWaalsContact C-N 3.29Å; V227-L229 PolarHBondContact O-N 3.45Å; L229-C231 PolarHBondContact O-N 3.35Å; L229-L232 WeakPolarHBondContact O-CB 3.48Å; L229-L232 PolarHBondContact O-N 3.33Å
230	H	97.5	Very high	95.9	Very high	113 Å²	113	42.2 Å²	42.2	52%	0.523	23%	0.234	S	C	.	.	H	α-helix	trans	-65	-23.5	168.5	-67.8	71	0	0	0	112.4	I74 G226 V227 E228 L232 V233 C234	I74-H230 HydrophobicContact CD1-CB 4.08Å; G226-H230 PolarHBondContact O-CE1 2.84Å; G226-H230 PolarHBondContact O-ND1 2.96Å; V227-H230 VanDerWaalsContact O-CB 3.32Å; V227-H230 WeakPolarHBondContact O-CB 3.41Å; V227-H230 PolarHBondContact O-N 3.09Å; V227-H230 VanDerWaalsContact O-N 3.16Å; V227-H230 PolarHBondContact O-ND1 3.43Å; E228-H230 PolarHBondContact O-N 3.47Å; H230-L232 PolarHBondContact O-N 3.17Å; H230-V233 WeakPolarHBondContact O-CB 3.42Å; H230-V233 PolarHBondContact O-N 3.26Å; H230-V233 VanDerWaalsContact O-N 3.09Å; H230-C234 PolarHBondContact O-N 3.49Å; H230-C234 VanDerWaalsContact O-N 3.09Å; H230-C234 PolarHBondContact O-SG 3.26Å; H230-C234 VanDerWaalsContact O-SG 3.38Å
231	C	97.8	Very high	95.2	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.007	25%	0.247	C	C	.	.	H	α-helix	trans	-59.1	-26.8	169	-70.3	0	0	0	0	112.1	M170 E228 L229 C234 A235	M170-C231 HydrophobicContact CE-CB 3.97Å; E228-C231 WeakPolarHBondContact O-CB 3.39Å; E228-C231 PolarHBondContact O-N 3.45Å; E228-C231 PolarHBondContact O-SG 3.21Å; E228-C231 VanDerWaalsContact O-SG 3.41Å; L229-C231 PolarHBondContact O-N 3.35Å; C231-C234 WeakPolarHBondContact O-CB 3.37Å; C231-C234 PolarHBondContact O-N 2.9Å; C231-A235 VanDerWaalsContact O-CB 3.32Å; C231-A235 WeakPolarHBondContact O-CB 3.26Å; C231-A235 PolarHBondContact O-N 3.21Å
232	L	97.4	Very high	94.3	Very high	68 Å²	68	47.6 Å²	47.6	36%	0.356	27%	0.267	S	S	.	.	H	α-helix	trans	-66.6	-39.3	174.8	-166.6	142.8	0	0	0	111.4	L133 S136 A137 L229 H230 A235 A236	L133-L232 HydrophobicContact CD2-CD2 4.01Å; L133-L232 HydrophobicContact CD2-CG 3.77Å; L133-L232 VanDerWaalsContact CD2-O 3.28Å; L133-L232 WeakPolarHBondContact CD2-O 3.26Å; S136-L232 WeakPolarHBondContact OG-CA 3.48Å; A137-L232 HydrophobicContact CB-CD1 4.43Å; L229-L232 WeakPolarHBondContact O-CB 3.48Å; L229-L232 PolarHBondContact O-N 3.33Å; H230-L232 PolarHBondContact O-N 3.17Å; L232-A235 PolarHBondContact O-N 3.1Å; L232-A236 WeakPolarHBondContact O-CB 3.34Å; L232-A236 PolarHBondContact O-N 3.45Å
233	V	97.4	Very high	93.2	Very high	91 Å²	91	44.1 Å²	44.1	55%	0.552	25%	0.25	S	S	*	.	H	α-helix	trans	-65.8	-44	173.1	-177.3	0	0	0	0	110	H230 A235 A236 L237	H230-V233 WeakPolarHBondContact O-CB 3.42Å; H230-V233 PolarHBondContact O-N 3.26Å; H230-V233 VanDerWaalsContact O-N 3.09Å; V233-A235 PolarHBondContact O-N 3.35Å; V233-A236 WeakPolarHBondContact O-CB 3.46Å; V233-A236 PolarHBondContact O-N 2.87Å; V233-L237 WeakPolarHBondContact O-CG 3.2Å; V233-L237 PolarHBondContact O-N 2.83Å
234	C	97.3	Very high	92.3	Very high	10 Å²	10	47.5 Å²	47.5	7%	0.068	26%	0.264	C	S	.	.	H	α-helix	trans	-59.8	-46.8	176.5	-61.2	0	0	0	0	111.6	A67 H230 C231 A236 L237	A67-C234 HydrophobicContact CB-CB 4.11Å; H230-C234 PolarHBondContact O-N 3.49Å; H230-C234 VanDerWaalsContact O-N 3.09Å; H230-C234 PolarHBondContact O-SG 3.26Å; H230-C234 VanDerWaalsContact O-SG 3.38Å; C231-C234 WeakPolarHBondContact O-CB 3.37Å; C231-C234 PolarHBondContact O-N 2.9Å; C234-A236 VanDerWaalsContact C-N 3.31Å; C234-A236 PolarHBondContact O-N 3.5Å; C234-L237 WeakPolarHBondContact O-CB 3.48Å; C234-L237 PolarHBondContact O-N 3.28Å; C234-L237 VanDerWaalsContact O-N 3.09Å
235	A	96.9	Very high	91.6	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.296	C	S	.	.	H	α-helix	trans	-64.6	-33.6	177.3	0	0	0	0	0	112.6	G132 L133 M170 C231 L232 V233 L237 F238	G132-A235 VanDerWaalsContact C-CB 3.49Å; L133-A235 HydrophobicContact CD2-CB 4.08Å; L133-A235 HydrophobicContact CG-CB 4.18Å; M170-A235 HydrophobicContact CE-CB 4.17Å; M170-A235 HydrophobicContact SD-CB 3.92Å; C231-A235 VanDerWaalsContact O-CB 3.32Å; C231-A235 WeakPolarHBondContact O-CB 3.26Å; C231-A235 PolarHBondContact O-N 3.21Å; L232-A235 PolarHBondContact O-N 3.1Å; V233-A235 PolarHBondContact O-N 3.35Å; A235-L237 PolarHBondContact O-N 3.43Å; A235-F238 HydrophobicContact CB-CD2 4.45Å; A235-F238 WeakPolarHBondContact O-CB 3.4Å; A235-F238 PolarHBondContact O-N 3.45Å; A235-F238 VanDerWaalsContact O-N 3.1Å
236	A	96.5	Very high	90.9	Very high	34 Å²	34	62.3 Å²	62.3	28%	0.281	33%	0.328	S	S	.	.	H	α-helix	trans	-61.2	-24.8	174.7	0	0	0	0	0	112.8	R129 L133 L232 V233 C234	R129-A236 PolarHBondContact NE-O 2.7Å; R129-A236 VanDerWaalsContact NE-O 3.15Å; L133-A236 HydrophobicContact CD2-CB 4.16Å; L232-A236 WeakPolarHBondContact O-CB 3.34Å; L232-A236 PolarHBondContact O-N 3.45Å; V233-A236 WeakPolarHBondContact O-CB 3.46Å; V233-A236 PolarHBondContact O-N 2.87Å; C234-A236 VanDerWaalsContact C-N 3.31Å; C234-A236 PolarHBondContact O-N 3.5Å
237	L	95.9	Very high	90	Very high	54 Å²	54	62.1 Å²	62.1	28%	0.283	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.5	-10.2	178.2	-60.4	170.3	0	0	0	113.7	W60 V63 A67 V233 C234 A235 R239	W60-L237 HydrophobicContact CH2-CD2 4.14Å; W60-L237 HydrophobicContact CZ2-CB 4.5Å; W60-L237 HydrophobicContact CZ2-CD2 3.82Å; W60-L237 PolarHBondContact NE1-O 2.84Å; V63-L237 HydrophobicContact CG1-CD1 4.31Å; A67-L237 HydrophobicContact CB-CB 4.2Å; A67-L237 HydrophobicContact CB-CD1 3.94Å; V233-L237 WeakPolarHBondContact O-CG 3.2Å; V233-L237 PolarHBondContact O-N 2.83Å; C234-L237 WeakPolarHBondContact O-CB 3.48Å; C234-L237 PolarHBondContact O-N 3.28Å; C234-L237 VanDerWaalsContact O-N 3.09Å; A235-L237 PolarHBondContact O-N 3.43Å; L237-R239 PolarHBondContact O-N 2.79Å
238	F	92.6	Very high	89.2	Confident	1 Å²	1	60 Å²	60	0%	0.004	31%	0.305	C	S	.	.			trans	-73.3	59.5	178.7	-63.8	-10.6	0	0	0	112.5	V64 A67 V68 C128 R129 M170 C173 I177 A235 A240	V64-F238 HydrophobicContact CG1-CD1 4.33Å; A67-F238 HydrophobicContact CB-CE1 4.07Å; V68-F238 HydrophobicContact CG2-CE1 3.62Å; V68-F238 HydrophobicContact CG2-CZ 3.81Å; C128-F238 HydrophobicContact CB-CB 4.43Å; R129-F238 VanDerWaalsContact CB-O 3.29Å; R129-F238 WeakPolarHBondContact CB-O 3.26Å; M170-F238 HydrophobicContact CE-CE2 4.31Å; M170-F238 HydrophobicContact CE-CZ 4.45Å; C173-F238 HydrophobicContact CB-CD2 4.1Å; C173-F238 HydrophobicContact CB-CE2 3.93Å; I177-F238 HydrophobicContact CG1-CB 4.24Å; I177-F238 HydrophobicContact CG2-CD1 4.08Å; I177-F238 HydrophobicContact CG2-CE1 4.28Å; I177-F238 HydrophobicContact CG2-CG 4.27Å; A235-F238 HydrophobicContact CB-CD2 4.45Å; A235-F238 WeakPolarHBondContact O-CB 3.4Å; A235-F238 PolarHBondContact O-N 3.45Å; A235-F238 VanDerWaalsContact O-N 3.1Å; F238-A240 PolarHBondContact O-N 3.26Å
239	R	89.1	Confident	88.6	Confident	149 Å²	149	64.1 Å²	64.1	56%	0.562	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-72	127.5	175.4	-174.4	175.3	178.8	174.4	-0.8	109.2	Y181 L237	Y181-R239 VanDerWaalsContact CE2-O 3.26Å; Y181-R239 WeakPolarHBondContact CE2-O 3.37Å; Y181-R239 PolarHBondContact OH-O 2.89Å; L237-R239 PolarHBondContact O-N 2.79Å
240	A	80.7	Confident	87.9	Confident	51 Å²	51	64.2 Å²	64.2	42%	0.421	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-69	149.6	172.4	0	0	0	0	0	110.9	F238 T242	F238-A240 PolarHBondContact O-N 3.26Å; A240-T242 PolarHBondContact O-N 3.31Å; A240-T242 PolarHBondContact O-OG1 3.17Å
241	V	82.1	Confident	86.9	Confident	45 Å²	45	58.9 Å²	58.9	27%	0.273	30%	0.297	S	S	.	.	P	Polyproline II helix	trans	-63.7	119.8	175.6	-174.2	0	0	0	0	108.7	I53 E180 Y181	I53-V241 HydrophobicContact CG2-CB 4.49Å; I53-V241 HydrophobicContact CG2-CG1 3.7Å; E180-V241 HydrophobicContact CB-CG2 4.35Å; Y181-V241 HydrophobicContact CD1-CG2 3.96Å; Y181-V241 HydrophobicContact CD2-CG2 4.2Å; Y181-V241 HydrophobicContact CE1-CG2 3.81Å; Y181-V241 HydrophobicContact CE2-CG2 4.06Å; Y181-V241 HydrophobicContact CG-CG2 4.16Å
242	T	77.4	Confident	86	Confident	68 Å²	68	60.1 Å²	60.1	42%	0.417	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-90.3	137.6	-177.8	-45	0	0	0	0	109.3	A240 E244	A240-T242 PolarHBondContact O-N 3.31Å; A240-T242 PolarHBondContact O-OG1 3.17Å; T242-E244 PolarHBondContact O-N 3.35Å
243	P	74.4	Confident	85.2	Confident	18 Å²	18	63.4 Å²	63.4	12%	0.117	32%	0.317	C	S	.	.	P	Polyproline II helix	trans	-56.3	137	176.7	-24.9	33.4	0	0	0	112.3	I53 V248 Y383 I386	I53-P243 HydrophobicContact CD1-CG 4.23Å; P243-V248 HydrophobicContact CB-CG2 3.91Å; P243-Y383 HydrophobicContact CB-CD2 4.48Å; P243-Y383 HydrophobicContact CB-CE2 4.36Å; P243-Y383 HydrophobicContact CG-CD2 4.14Å; P243-Y383 HydrophobicContact CG-CE2 3.8Å; P243-I386 HydrophobicContact CB-CD1 4.16Å; P243-I386 HydrophobicContact CB-CG2 3.91Å; P243-I386 HydrophobicContact CG-CB 4.24Å; P243-I386 HydrophobicContact CG-CG2 3.48Å; P243-I386 VanDerWaalsContact CG-CG2 3.48Å
244	E	79.1	Confident	84.2	Confident	134 Å²	134	59.4 Å²	59.4	63%	0.626	29%	0.293	S	S	*	.	P	Polyproline II helix	trans	-71.3	149.8	173.8	-67.2	-165.3	174.4	0	0	111.4	T242 K246 Q247 V248	T242-E244 PolarHBondContact O-N 3.35Å; E244-K246 VanDerWaalsContact C-N 3.25Å; E244-K246 PolarHBondContact O-N 3.24Å; E244-Q247 HydrophobicContact CB-CB 4.39Å; E244-Q247 WeakPolarHBondContact O-CB 3.21Å; E244-Q247 PolarHBondContact O-N 3.12Å; E244-Q247 VanDerWaalsContact O-N 3.1Å; E244-V248 WeakPolarHBondContact O-CG2 3.33Å; E244-V248 PolarHBondContact O-N 3Å
245	K	82.3	Confident	83	Confident	155 Å²	155	59.2 Å²	59.2	67%	0.674	29%	0.291	S	S	*	.	H	α-helix	trans	-56.1	-41.7	177.7	-70.7	-177.4	179.7	177.9	0	112.1	Q247 V248 E249	K245-Q247 VanDerWaalsContact C-N 3.34Å; K245-Q247 PolarHBondContact O-N 2.89Å; K245-V248 PolarHBondContact O-N 3.49Å; K245-E249 WeakPolarHBondContact O-CG 3.42Å; K245-E249 PolarHBondContact O-N 3.48Å
246	K	83.5	Confident	82	Confident	159 Å²	159	61.4 Å²	61.4	69%	0.691	30%	0.304	S	S	*	.	H	α-helix	trans	-61.5	-40.3	177.6	-67	-176.8	177.5	-178	0	112.5	E244 E249 K250	E244-K246 VanDerWaalsContact C-N 3.25Å; E244-K246 PolarHBondContact O-N 3.24Å; K246-E249 PolarHBondContact O-N 3.17Å; K246-K250 PolarHBondContact O-N 3.28Å
247	Q	79.7	Confident	80.9	Confident	30 Å²	30	61.4 Å²	61.4	14%	0.14	30%	0.302	C	S	.	.	H	α-helix	trans	-67.3	-43.1	177.7	-173	-175.7	-5.4	0	0	111.3	D50 A51 L52 E244 K245 E249 K250 V251 I386	D50-Q247 VanDerWaalsContact O-CG 3.3Å; D50-Q247 WeakPolarHBondContact O-CG 3.45Å; D50-Q247 PolarHBondContact O-NE2 2.89Å; A51-Q247 PolarHBondContact O-NE2 3.34Å; L52-Q247 PolarHBondContact O-NE2 3.44Å; E244-Q247 HydrophobicContact CB-CB 4.39Å; E244-Q247 WeakPolarHBondContact O-CB 3.21Å; E244-Q247 PolarHBondContact O-N 3.12Å; E244-Q247 VanDerWaalsContact O-N 3.1Å; K245-Q247 VanDerWaalsContact C-N 3.34Å; K245-Q247 PolarHBondContact O-N 2.89Å; Q247-E249 VanDerWaalsContact C-N 3.26Å; Q247-E249 PolarHBondContact O-N 3.14Å; Q247-K250 PolarHBondContact O-N 3.18Å; Q247-V251 WeakPolarHBondContact O-CG2 3.44Å; Q247-V251 PolarHBondContact O-N 3.31Å; Q247-I386 HydrophobicContact CG-CD1 4.28Å
248	V	81.7	Confident	79.5	Confident	8 Å²	8	59.2 Å²	59.2	5%	0.048	29%	0.291	C	S	.	.	H	α-helix	trans	-60	-41.1	175.4	178.4	0	0	0	0	110.7	P243 E244 K245 E252 R379 Y383 I386	P243-V248 HydrophobicContact CB-CG2 3.91Å; E244-V248 WeakPolarHBondContact O-CG2 3.33Å; E244-V248 PolarHBondContact O-N 3Å; K245-V248 PolarHBondContact O-N 3.49Å; V248-E252 VanDerWaalsContact O-CB 3.32Å; V248-E252 WeakPolarHBondContact O-CB 3.35Å; V248-E252 PolarHBondContact O-N 2.91Å; V248-R379 HydrophobicContact CG1-CG 3.78Å; V248-Y383 HydrophobicContact CG2-CD2 4.28Å; V248-I386 HydrophobicContact CB-CD1 4.4Å; V248-I386 HydrophobicContact CG2-CD1 3.83Å
249	E	84	Confident	78.2	Confident	88 Å²	88	60.4 Å²	60.4	41%	0.411	30%	0.297	S	S	.	.	H	α-helix	trans	-65.4	-42	176	-72.9	161.7	-168.7	0	0	111.8	K245 K246 Q247 E252 E253	K245-E249 WeakPolarHBondContact O-CG 3.42Å; K245-E249 PolarHBondContact O-N 3.48Å; K246-E249 PolarHBondContact O-N 3.17Å; Q247-E249 VanDerWaalsContact C-N 3.26Å; Q247-E249 PolarHBondContact O-N 3.14Å; E249-E252 WeakPolarHBondContact O-CB 3.43Å; E249-E252 PolarHBondContact O-N 2.94Å; E249-E253 WeakPolarHBondContact O-CG 3.42Å; E249-E253 PolarHBondContact O-N 3.46Å
250	K	83.4	Confident	77.1	Confident	72 Å²	72	59.5 Å²	59.5	31%	0.313	30%	0.299	S	S	.	.	H	α-helix	trans	-62.2	-44.5	175.7	-164.2	-178.3	-171.5	-163.3	0	112.5	E20 D50 K246 Q247 E252 E253 T254	E20-K250 IonicContact OE1-NZ 3.76Å; D50-K250 HydrophobicContact CB-CD 4.33Å; D50-K250 HydrophobicContact CB-CG 4.41Å; D50-K250 VanDerWaalsContact OD1-CD 3.3Å; D50-K250 WeakPolarHBondContact OD1-CD 3.49Å; D50-K250 WeakPolarHBondContact OD1-CE 3.21Å; D50-K250 IonicContact OD1-NZ 2.81Å; D50-K250 PolarHBondContact OD1-NZ 3.26Å; K246-K250 PolarHBondContact O-N 3.28Å; Q247-K250 PolarHBondContact O-N 3.18Å; K250-E252 VanDerWaalsContact C-N 3.33Å; K250-E253 WeakPolarHBondContact O-CB 3.35Å; K250-E253 PolarHBondContact O-N 3.05Å; K250-T254 PolarHBondContact O-N 3.38Å; K250-T254 PolarHBondContact O-OG1 3.48Å
251	V	76.8	Confident	76.2	Confident	0 Å²	0	60 Å²	60	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.9	-39.1	175.2	171.9	0	0	0	0	111.1	L47 D50 A51 Q247 T254 L255 I386	L47-V251 HydrophobicContact CD1-CG1 3.77Å; D50-V251 HydrophobicContact CB-CG2 3.87Å; D50-V251 WeakPolarHBondContact O-CG2 3.44Å; A51-V251 HydrophobicContact CB-CG2 4.25Å; Q247-V251 WeakPolarHBondContact O-CG2 3.44Å; Q247-V251 PolarHBondContact O-N 3.31Å; V251-T254 PolarHBondContact O-N 3.39Å; V251-L255 HydrophobicContact CG1-CD1 4.09Å; V251-L255 WeakPolarHBondContact O-CB 3.37Å; V251-L255 WeakPolarHBondContact O-CG 3.29Å; V251-L255 PolarHBondContact O-N 3.34Å; V251-I386 HydrophobicContact CB-CD1 4.29Å; V251-I386 HydrophobicContact CB-CG1 4.5Å; V251-I386 HydrophobicContact CG1-CG1 4.45Å; V251-I386 HydrophobicContact CG2-CD1 3.95Å; V251-I386 HydrophobicContact CG2-CG1 3.92Å
252	E	78	Confident	75.1	Confident	28 Å²	28	60.3 Å²	60.3	13%	0.131	30%	0.298	C	S	.	.	H	α-helix	trans	-59.9	-45.3	173.8	-175.1	178.1	163.1	0	0	110.9	V248 E249 K250 L255 V256 L378 S382	V248-E252 VanDerWaalsContact O-CB 3.32Å; V248-E252 WeakPolarHBondContact O-CB 3.35Å; V248-E252 PolarHBondContact O-N 2.91Å; E249-E252 WeakPolarHBondContact O-CB 3.43Å; E249-E252 PolarHBondContact O-N 2.94Å; K250-E252 VanDerWaalsContact C-N 3.33Å; E252-L255 PolarHBondContact O-N 3.34Å; E252-V256 WeakPolarHBondContact O-CB 3.35Å; E252-V256 VanDerWaalsContact O-CG2 3.24Å; E252-V256 WeakPolarHBondContact O-CG2 3.5Å; E252-V256 PolarHBondContact O-N 3.45Å; E252-L378 HydrophobicContact CG-CB 4.18Å; E252-S382 VanDerWaalsContact CA-OG 3.3Å; E252-S382 WeakPolarHBondContact CA-OG 3.26Å; E252-S382 WeakPolarHBondContact CB-OG 3.44Å; E252-S382 PolarHBondContact N-OG 2.89Å
253	E	81	Confident	73.9	Confident	137 Å²	137	61.7 Å²	61.7	64%	0.64	30%	0.298	S	S	*	.	H	α-helix	trans	-62	-45.6	175.6	-73.1	173.8	-175.7	0	0	112.3	E249 K250 L255 V256 S257	E249-E253 WeakPolarHBondContact O-CG 3.42Å; E249-E253 PolarHBondContact O-N 3.46Å; K250-E253 WeakPolarHBondContact O-CB 3.35Å; K250-E253 PolarHBondContact O-N 3.05Å; E253-L255 PolarHBondContact O-N 3.16Å; E253-V256 PolarHBondContact O-N 3.16Å; E253-S257 WeakPolarHBondContact O-CB 3.46Å; E253-S257 PolarHBondContact O-N 2.89Å
254	T	76.4	Confident	72.3	Confident	7 Å²	7	66.5 Å²	66.5	4%	0.043	33%	0.329	C	S	.	.	H	α-helix	trans	-62.6	-43.1	177.6	-61.7	0	0	0	0	111.2	Q46 L47 D50 K250 V251 S257 M258	Q46-T254 HydrophobicContact CG-CG2 4.39Å; L47-T254 HydrophobicContact CB-CG2 3.84Å; L47-T254 HydrophobicContact CD1-CG2 4.03Å; D50-T254 PolarHBondContact OD2-OG1 2.8Å; K250-T254 PolarHBondContact O-N 3.38Å; K250-T254 PolarHBondContact O-OG1 3.48Å; V251-T254 PolarHBondContact O-N 3.39Å; T254-S257 PolarHBondContact O-N 3.49Å; T254-S257 PolarHBondContact O-OG 3.14Å; T254-M258 WeakPolarHBondContact O-CG 3.19Å; T254-M258 PolarHBondContact O-N 3.39Å
255	L	72.4	Confident	70.4	Confident	6 Å²	6	63 Å²	63	3%	0.031	33%	0.329	C	S	.	.	H	α-helix	trans	-61.3	-44.7	174	-76.5	168.2	0	0	0	112.2	L47 V251 E252 E253 S257 M258 L259 I381 S382	L47-L255 HydrophobicContact CD1-CD2 4.03Å; L47-L255 HydrophobicContact CD1-CG 3.81Å; L47-L255 HydrophobicContact CD2-CD2 3.84Å; V251-L255 HydrophobicContact CG1-CD1 4.09Å; V251-L255 WeakPolarHBondContact O-CB 3.37Å; V251-L255 WeakPolarHBondContact O-CG 3.29Å; V251-L255 PolarHBondContact O-N 3.34Å; E252-L255 PolarHBondContact O-N 3.34Å; E253-L255 PolarHBondContact O-N 3.16Å; L255-S257 VanDerWaalsContact C-N 3.29Å; L255-S257 PolarHBondContact O-N 3.05Å; L255-M258 PolarHBondContact O-N 2.89Å; L255-L259 VanDerWaalsContact O-CG 3.31Å; L255-L259 WeakPolarHBondContact O-CG 3.14Å; L255-L259 PolarHBondContact O-N 3.34Å; L255-I381 HydrophobicContact CD1-CG2 4.12Å; L255-S382 WeakPolarHBondContact CD1-OG 2.96Å
256	V	75.8	Confident	68	Low	46 Å²	46	61.7 Å²	61.7	28%	0.279	33%	0.33	S	S	.	.	H	α-helix	trans	-59.8	-43.3	175.5	168.7	0	0	0	0	110.3	E252 E253 M258 L259 Q260 L378	E252-V256 WeakPolarHBondContact O-CB 3.35Å; E252-V256 VanDerWaalsContact O-CG2 3.24Å; E252-V256 WeakPolarHBondContact O-CG2 3.5Å; E252-V256 PolarHBondContact O-N 3.45Å; E253-V256 PolarHBondContact O-N 3.16Å; V256-M258 VanDerWaalsContact C-N 3.34Å; V256-M258 PolarHBondContact O-N 2.92Å; V256-L259 PolarHBondContact O-N 3.33Å; V256-Q260 HydrophobicContact CG1-CG 4.42Å; V256-Q260 WeakPolarHBondContact O-CB 3.29Å; V256-Q260 VanDerWaalsContact O-CG 3.31Å; V256-Q260 WeakPolarHBondContact O-CG 3.31Å; V256-Q260 PolarHBondContact O-N 3.41Å; V256-L378 HydrophobicContact CG2-CD1 4.02Å
257	S	72.7	Confident	66	Low	34 Å²	34	60.3 Å²	60.3	24%	0.238	34%	0.34	C	S	.	.	H	α-helix	trans	-64.9	-35.6	178.6	87.7	0	0	0	0	112.9	K43 E253 T254 L255 S261	K43-S257 PolarHBondContact NZ-O 3.37Å; E253-S257 WeakPolarHBondContact O-CB 3.46Å; E253-S257 PolarHBondContact O-N 2.89Å; T254-S257 PolarHBondContact O-N 3.49Å; T254-S257 PolarHBondContact O-OG 3.14Å; L255-S257 VanDerWaalsContact C-N 3.29Å; L255-S257 PolarHBondContact O-N 3.05Å; S257-S261 PolarHBondContact O-N 3.16Å; S257-S261 VanDerWaalsContact O-N 3.11Å; S257-S261 PolarHBondContact O-OG 2.78Å; S257-S261 VanDerWaalsContact O-OG 3.13Å
258	M	66.1	Low	64.1	Low	8 Å²	8	65.1 Å²	65.1	4%	0.039	37%	0.372	C	S	.	.	H	α-helix	trans	-67.4	-46.8	175.5	-73.1	179.2	79.3	0	0	110.5	K43 L47 T254 L255 V256 Q260 S261 E262 V431	K43-M258 HydrophobicContact CB-CE 4.42Å; K43-M258 HydrophobicContact CB-CG 3.63Å; K43-M258 HydrophobicContact CB-SD 4.22Å; K43-M258 HydrophobicContact CD-CG 3.98Å; K43-M258 HydrophobicContact CG-CG 4.45Å; L47-M258 HydrophobicContact CB-SD 4.13Å; L47-M258 HydrophobicContact CD2-SD 3.97Å; T254-M258 WeakPolarHBondContact O-CG 3.19Å; T254-M258 PolarHBondContact O-N 3.39Å; L255-M258 PolarHBondContact O-N 2.89Å; V256-M258 VanDerWaalsContact C-N 3.34Å; V256-M258 PolarHBondContact O-N 2.92Å; M258-Q260 VanDerWaalsContact C-N 3.3Å; M258-Q260 PolarHBondContact O-N 3.11Å; M258-S261 PolarHBondContact O-N 2.93Å; M258-S261 PolarHBondContact O-OG 3.27Å; M258-E262 PolarHBondContact O-N 3.34Å; M258-V431 HydrophobicContact CE-CG2 3.87Å
259	L	65.8	Low	61.8	Low	26 Å²	26	68.7 Å²	68.7	14%	0.136	39%	0.39	C	S	.	.	H	α-helix	trans	-60.6	-38.9	176.5	-70.6	169.4	0	0	0	112	L255 V256 E262 F263 L378	L255-L259 VanDerWaalsContact O-CG 3.31Å; L255-L259 WeakPolarHBondContact O-CG 3.14Å; L255-L259 PolarHBondContact O-N 3.34Å; V256-L259 PolarHBondContact O-N 3.33Å; L259-E262 PolarHBondContact O-N 3.47Å; L259-F263 WeakPolarHBondContact O-CD2 3.46Å; L259-F263 PolarHBondContact O-N 2.96Å; L259-L378 HydrophobicContact CD1-CD2 4.11Å
260	Q	66.4	Low	59.6	Low	130 Å²	130	66.5 Å²	66.5	61%	0.607	39%	0.391	S	S	*	.	H	α-helix	trans	-68.3	-39.1	177	-75.4	174.8	-8.3	0	0	112.9	V256 M258 E262 F263	V256-Q260 HydrophobicContact CG1-CG 4.42Å; V256-Q260 WeakPolarHBondContact O-CB 3.29Å; V256-Q260 VanDerWaalsContact O-CG 3.31Å; V256-Q260 WeakPolarHBondContact O-CG 3.31Å; V256-Q260 PolarHBondContact O-N 3.41Å; M258-Q260 VanDerWaalsContact C-N 3.3Å; M258-Q260 PolarHBondContact O-N 3.11Å; Q260-E262 VanDerWaalsContact C-N 3.3Å; Q260-E262 PolarHBondContact O-N 2.96Å; Q260-F263 CarbonylContact O-C 3.22Å; Q260-F263 VanDerWaalsContact O-C 3.22Å; Q260-F263 PolarHBondContact O-N 3.08Å
261	S	61.7	Low	57.3	Low	62 Å²	62	69.2 Å²	69.2	43%	0.434	40%	0.403	S	S	.	.	H	α-helix	trans	-68.3	-30.6	174.3	41.6	0	0	0	0	113.3	K43 S257 M258 F263	K43-S261 PolarHBondContact NZ-OG 3.2Å; S257-S261 PolarHBondContact O-N 3.16Å; S257-S261 VanDerWaalsContact O-N 3.11Å; S257-S261 PolarHBondContact O-OG 2.78Å; S257-S261 VanDerWaalsContact O-OG 3.13Å; M258-S261 PolarHBondContact O-N 2.93Å; M258-S261 PolarHBondContact O-OG 3.27Å; S261-F263 VanDerWaalsContact C-N 3.3Å
262	E	57.5	Low	55.4	Low	51 Å²	51	75.7 Å²	75.7	24%	0.238	43%	0.433	C	S	.	.	H	α-helix	trans	-71.5	-28.3	177.3	-152.3	78.1	-153.4	0	0	111.8	M258 L259 Q260 R428	M258-E262 PolarHBondContact O-N 3.34Å; L259-E262 PolarHBondContact O-N 3.47Å; Q260-E262 VanDerWaalsContact C-N 3.3Å; Q260-E262 PolarHBondContact O-N 2.96Å; E262-R428 WeakPolarHBondContact OE1-CG 3.23Å; E262-R428 IonicContact OE1-NE 2.7Å
263	F	53.3	Low	53.7	Low	97 Å²	97	76.7 Å²	76.7	43%	0.425	44%	0.443	S	S	.	.			trans	-132	72.1	-178.7	-59.9	-80.3	0	0	0	112.7	L259 Q260 S261 G265	L259-F263 WeakPolarHBondContact O-CD2 3.46Å; L259-F263 PolarHBondContact O-N 2.96Å; Q260-F263 CarbonylContact O-C 3.22Å; Q260-F263 VanDerWaalsContact O-C 3.22Å; Q260-F263 PolarHBondContact O-N 3.08Å; S261-F263 VanDerWaalsContact C-N 3.3Å; F263-G265 PolarHBondContact O-N 2.94Å
264	P	39.7	Very low	51.8	Low	119 Å²	119	71.2 Å²	71.2	77%	0.773	42%	0.419	S	S	*	.			trans	-78.9	84.6	176.3	30.9	-31.7	0	0	0	110.4
265	G	40.2	Very low	50	Low	60 Å²	60	73.2 Å²	73.2	62%	0.619	43%	0.433	S	S	*	.			trans	145.3	89.2	169.3	0	0	0	0	0	115.8	F263	F263-G265 PolarHBondContact O-N 2.94Å
266	N	31.9	Very low	48.5	Very low	128 Å²	128	76.3 Å²	76.3	68%	0.684	45%	0.446	S	S	*	.			trans	176.6	81.4	140.1	-94	-13.1	0	0	0	107.8	T268	N266-T268 PolarHBondContact O-N 3.48Å
267	S	41.5	Very low	46.9	Very low	129 Å²	129	75 Å²	75	90%	0.902	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	17.3	-174.8	42.8	0	0	0	0	115.4
268	T	39.1	Very low	45.1	Very low	132 Å²	132	80 Å²	80	81%	0.81	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.9	-1.4	178.5	43.1	0	0	0	0	116.6	N266	N266-T268 PolarHBondContact O-N 3.48Å
269	D	33.8	Very low	43.6	Very low	82 Å²	82	87.2 Å²	87.2	44%	0.439	48%	0.482	S	S	.	.			trans	-149.3	87.3	170.2	-124.1	-18	0	0	0	111.1	K271	D269-K271 VanDerWaalsContact CG-NZ 3.32Å; D269-K271 PolarHBondContact O-N 3.46Å; D269-K271 WeakPolarHBondContact OD1-CD 3.46Å; D269-K271 WeakPolarHBondContact OD1-CE 3.4Å; D269-K271 WeakPolarHBondContact OD1-CG 3.36Å; D269-K271 IonicContact OD1-NZ 3.96Å; D269-K271 PolarHBondContact OD1-NZ 3.01Å; D269-K271 IonicContact OD2-NZ 2.85Å; D269-K271 PolarHBondContact OD2-NZ 2.98Å
270	G	38.3	Very low	41.9	Very low	42 Å²	42	86.4 Å²	86.4	43%	0.433	48%	0.481	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	24	172	0	0	0	0	0	114.3	K374	G270-K374 VanDerWaalsContact O-CE 3.32Å; G270-K374 WeakPolarHBondContact O-CE 3.43Å; G270-K374 PolarHBondContact O-NZ 3.05Å
271	K	35.8	Very low	40.1	Very low	129 Å²	129	81.9 Å²	81.9	56%	0.561	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.5	-34.8	174.5	-71.2	177.7	-171.3	142.5	0	111.6	D269 S275	D269-K271 VanDerWaalsContact CG-NZ 3.32Å; D269-K271 PolarHBondContact O-N 3.46Å; D269-K271 WeakPolarHBondContact OD1-CD 3.46Å; D269-K271 WeakPolarHBondContact OD1-CE 3.4Å; D269-K271 WeakPolarHBondContact OD1-CG 3.36Å; D269-K271 IonicContact OD1-NZ 3.96Å; D269-K271 PolarHBondContact OD1-NZ 3.01Å; D269-K271 IonicContact OD2-NZ 2.85Å; D269-K271 PolarHBondContact OD2-NZ 2.98Å; K271-S275 WeakPolarHBondContact O-CB 3.21Å; K271-S275 PolarHBondContact O-N 3.29Å
272	E	36.2	Very low	38.5	Very low	136 Å²	136	82.4 Å²	82.4	64%	0.636	47%	0.469	S	S	*	.	H	α-helix	trans	-78.3	-45.6	-174.3	-71.1	-168.3	150.4	0	0	113.3	L274 S275 F276	E272-L274 VanDerWaalsContact C-N 3.27Å; E272-L274 PolarHBondContact O-N 3.26Å; E272-L274 VanDerWaalsContact O-N 3.16Å; E272-S275 WeakPolarHBondContact O-CB 3.13Å; E272-S275 PolarHBondContact O-N 2.95Å; E272-S275 PolarHBondContact O-OG 3.39Å; E272-F276 PolarHBondContact O-N 3.38Å
273	S	41.7	Very low	37	Very low	49 Å²	49	86.8 Å²	86.8	34%	0.343	49%	0.489	S	S	.	.	H	α-helix	trans	-57.4	-36.3	-175	-44.2	0	0	0	0	113.5
274	L	42.5	Very low	35.6	Very low	23 Å²	23	86.6 Å²	86.6	12%	0.12	50%	0.496	C	S	.	.	H	α-helix	trans	-92	-18.2	178.8	-132.7	96.3	0	0	0	113.8	E272 F276 V277 K278 K374 E377 L378	E272-L274 VanDerWaalsContact C-N 3.27Å; E272-L274 PolarHBondContact O-N 3.26Å; E272-L274 VanDerWaalsContact O-N 3.16Å; L274-F276 PolarHBondContact O-N 3.21Å; L274-V277 HydrophobicContact CD1-CG2 4.43Å; L274-V277 HydrophobicContact CG-CB 4.27Å; L274-V277 HydrophobicContact CG-CG2 4.28Å; L274-V277 PolarHBondContact O-N 3.21Å; L274-K278 PolarHBondContact O-N 3.38Å; L274-K374 HydrophobicContact CD2-CB 4.43Å; L274-K374 HydrophobicContact CD2-CG 4.17Å; L274-E377 HydrophobicContact CD2-CB 4.47Å; L274-L378 HydrophobicContact CD1-CD1 4.33Å; L274-L378 HydrophobicContact CD1-CD2 4.26Å; L274-L378 HydrophobicContact CD1-CG 4.14Å
275	S	38.3	Very low	34.7	Very low	48 Å²	48	86.5 Å²	86.5	34%	0.336	49%	0.488	S	S	.	.	H	α-helix	trans	-62.9	-30	169.9	78	0	0	0	0	110.9	K271 E272 R279	K271-S275 WeakPolarHBondContact O-CB 3.21Å; K271-S275 PolarHBondContact O-N 3.29Å; E272-S275 WeakPolarHBondContact O-CB 3.13Å; E272-S275 PolarHBondContact O-N 2.95Å; E272-S275 PolarHBondContact O-OG 3.39Å; S275-R279 VanDerWaalsContact O-CB 3.31Å; S275-R279 WeakPolarHBondContact O-CB 3.45Å; S275-R279 WeakPolarHBondContact O-CG 3.28Å; S275-R279 PolarHBondContact O-N 3.37Å
276	F	39.8	Very low	33.8	Very low	72 Å²	72	88.8 Å²	88.8	32%	0.316	49%	0.492	S	S	.	.	H	α-helix	trans	-70.8	-41.1	170.9	-175.7	-98	0	0	0	112.6	E272 L274 K278 R279 G280 K432	E272-F276 PolarHBondContact O-N 3.38Å; L274-F276 PolarHBondContact O-N 3.21Å; F276-K278 VanDerWaalsContact C-N 3.26Å; F276-K278 PolarHBondContact O-N 2.93Å; F276-R279 CarbonylContact O-C 3.56Å; F276-R279 PolarHBondContact O-N 3.49Å; F276-R279 VanDerWaalsContact O-N 3.15Å; F276-G280 PolarHBondContact O-N 3.29Å; F276-K432 HydrophobicContact CE1-CG 4.3Å; F276-K432 HydrophobicContact CZ-CD 4.26Å; F276-K432 HydrophobicContact CZ-CG 4.24Å
277	V	43	Very low	33.4	Very low	18 Å²	18	88.3 Å²	88.3	11%	0.109	50%	0.495	C	S	.	.	H	α-helix	trans	-58.4	-43.1	173.4	180	0	0	0	0	110.3	L274 A281 I381 V435	L274-V277 HydrophobicContact CD1-CG2 4.43Å; L274-V277 HydrophobicContact CG-CB 4.27Å; L274-V277 HydrophobicContact CG-CG2 4.28Å; L274-V277 PolarHBondContact O-N 3.21Å; V277-A281 WeakPolarHBondContact O-CB 3.47Å; V277-A281 PolarHBondContact O-N 2.84Å; V277-I381 HydrophobicContact CG1-CD1 3.68Å; V277-V435 HydrophobicContact CG1-CG1 4.15Å; V277-V435 HydrophobicContact CG2-CG1 4.11Å
278	K	34.9	Very low	32.5	Very low	138 Å²	138	87.5 Å²	87.5	60%	0.6	49%	0.49	S	S	*	.	H	α-helix	trans	-68.6	-37.8	174.1	-71.5	-175.1	177	-177.4	0	113.4	L274 F276 A281 S282	L274-K278 PolarHBondContact O-N 3.38Å; F276-K278 VanDerWaalsContact C-N 3.26Å; F276-K278 PolarHBondContact O-N 2.93Å; K278-A281 PolarHBondContact O-N 3.31Å; K278-S282 WeakPolarHBondContact O-CB 3.21Å; K278-S282 PolarHBondContact O-N 3.46Å
279	R	33.1	Very low	31.7	Very low	160 Å²	160	89.2 Å²	89.2	60%	0.604	49%	0.488	S	S	*	.	H	α-helix	trans	-70	-38.8	175.7	-83.3	-176.2	-174.5	173.1	3.6	111.8	S275 F276 A281 S282 E283	S275-R279 VanDerWaalsContact O-CB 3.31Å; S275-R279 WeakPolarHBondContact O-CB 3.45Å; S275-R279 WeakPolarHBondContact O-CG 3.28Å; S275-R279 PolarHBondContact O-N 3.37Å; F276-R279 CarbonylContact O-C 3.56Å; F276-R279 PolarHBondContact O-N 3.49Å; F276-R279 VanDerWaalsContact O-N 3.15Å; R279-A281 VanDerWaalsContact C-N 3.31Å; R279-A281 PolarHBondContact O-N 2.67Å; R279-S282 CarbonylContact O-C 3.05Å; R279-S282 PolarHBondContact O-N 3.25Å; R279-S282 VanDerWaalsContact O-N 3.13Å; R279-E283 VanDerWaalsContact O-CB 3.25Å; R279-E283 WeakPolarHBondContact O-CB 3.46Å; R279-E283 WeakPolarHBondContact O-CG 3.38Å; R279-E283 PolarHBondContact O-N 2.83Å
280	G	30.6	Very low	31.2	Very low	10 Å²	10	94.5 Å²	94.5	10%	0.103	51%	0.508	C	S	.	.	H	α-helix	trans	-62.7	-37.8	172.3	0	0	0	0	0	112	F276 V284	F276-G280 PolarHBondContact O-N 3.29Å; G280-V284 VanDerWaalsContact O-CG2 3.3Å; G280-V284 WeakPolarHBondContact O-CG2 3.39Å
281	A	29.8	Very low	30.4	Very low	35 Å²	35	100.3 Å²	100.3	29%	0.289	53%	0.528	S	S	.	.	H	α-helix	trans	-70.9	-33.6	171	0	0	0	0	0	113.1	V277 K278 R279 E438	V277-A281 WeakPolarHBondContact O-CB 3.47Å; V277-A281 PolarHBondContact O-N 2.84Å; K278-A281 PolarHBondContact O-N 3.31Å; R279-A281 VanDerWaalsContact C-N 3.31Å; R279-A281 PolarHBondContact O-N 2.67Å; A281-E438 WeakPolarHBondContact CB-OE2 3.1Å
282	S	27.3	Very low	29.8	Very low	73 Å²	73	98.4 Å²	98.4	51%	0.51	53%	0.531	S	S	.	.	H	α-helix	trans	-91.7	-26.4	-174.5	-163.7	0	0	0	0	115	K278 R279 V284 I285	K278-S282 WeakPolarHBondContact O-CB 3.21Å; K278-S282 PolarHBondContact O-N 3.46Å; R279-S282 CarbonylContact O-C 3.05Å; R279-S282 PolarHBondContact O-N 3.25Å; R279-S282 VanDerWaalsContact O-N 3.13Å; S282-V284 VanDerWaalsContact C-N 3.25Å; S282-I285 PolarHBondContact O-N 3.48Å
283	E	25.5	Very low	29.2	Very low	142 Å²	142	100.8 Å²	100.8	66%	0.664	54%	0.542	S	S	*	.	H	α-helix	trans	-74.4	-17	175.1	-81.3	178.9	164.6	0	0	112	R279	R279-E283 VanDerWaalsContact O-CB 3.25Å; R279-E283 WeakPolarHBondContact O-CB 3.46Å; R279-E283 WeakPolarHBondContact O-CG 3.38Å; R279-E283 PolarHBondContact O-N 2.83Å
284	V	25.2	Very low	28.1	Very low	94 Å²	94	104.8 Å²	104.8	57%	0.57	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.3	-8.9	174.7	-177.4	0	0	0	0	111.9	G280 S282 P286	G280-V284 VanDerWaalsContact O-CG2 3.3Å; G280-V284 WeakPolarHBondContact O-CG2 3.39Å; S282-V284 VanDerWaalsContact C-N 3.25Å; V284-P286 VanDerWaalsContact O-CD 3.24Å; V284-P286 WeakPolarHBondContact O-CD 3.48Å
285	I	20.7	Very low	27.1	Very low	117 Å²	117	111.4 Å²	111.4	60%	0.6	60%	0.599	S	S	*	*	S	Bend	trans	-85.3	103.4	163.5	-54	171.4	0	0	0	105.8	S282 P287	S282-I285 PolarHBondContact O-N 3.48Å; I285-P287 WeakPolarHBondContact O-CD 3.08Å
286	P	21.5	Very low	26.3	Very low	108 Å²	108	114.8 Å²	114.8	70%	0.701	62%	0.623	S	S	*	*			trans	-61	126.7	-175.1	23.9	-31.5	0	0	0	109	V284 S288	V284-P286 VanDerWaalsContact O-CD 3.24Å; V284-P286 WeakPolarHBondContact O-CD 3.48Å; P286-S288 PolarHBondContact O-N 2.73Å
287	P	22.8	Very low	25.4	Very low	117 Å²	117	118.6 Å²	118.6	76%	0.76	65%	0.645	S	S	*	*			trans	-65.5	121.5	178.1	24.2	-30.1	0	0	0	108.6	I285 H289	I285-P287 WeakPolarHBondContact O-CD 3.08Å; P287-H289 PolarHBondContact O-N 3.37Å; P287-H289 VanDerWaalsContact O-N 3.08Å
288	S	22	Very low	24.4	Very low	113 Å²	113	125.5 Å²	125.5	79%	0.79	68%	0.681	S	S	*	*	S	Bend	trans	-55.1	115.8	170.3	54	0	0	0	0	109.4	P286	P286-S288 PolarHBondContact O-N 2.73Å
289	H	22.8	Very low	23.7	Very low	167 Å²	167	122.3 Å²	122.3	77%	0.773	69%	0.688	S	S	*	*			trans	59.8	94.9	165.9	-90.6	-91.2	0	0	0	117.6	P287	P287-H289 PolarHBondContact O-N 3.37Å; P287-H289 VanDerWaalsContact O-N 3.08Å
290	K	23.4	Very low	23.1	Very low	194 Å²	194	126.1 Å²	126.1	84%	0.843	70%	0.702	S	S	*	*			trans	-135.8	63.6	133.3	-88.6	-168.5	176.5	-175.2	0	109.7	S292	K290-S292 PolarHBondContact O-N 2.7Å
291	L	21.8	Very low	22.7	Very low	163 Å²	163	130.2 Å²	130.2	85%	0.853	73%	0.729	S	S	*	*			trans	-85.1	71.6	157.5	-170.6	80.8	0	0	0	107.4
292	S	22.6	Very low	22.2	Very low	89 Å²	89	135.5 Å²	135.5	62%	0.622	75%	0.752	S	S	*	*			trans	-173	77.3	168.7	58	0	0	0	0	109.8	K290	K290-S292 PolarHBondContact O-N 2.7Å
293	Q	23.7	Very low	22	Very low	187 Å²	187	137.1 Å²	137.1	87%	0.874	76%	0.764	S	S	*	*			trans	-172.2	47.7	151.8	-103.5	163.3	8.8	0	0	110.9
294	T	18.8	Very low	21.7	Very low	133 Å²	133	136.6 Å²	136.6	82%	0.816	77%	0.77	S	S	*	*			trans	-91.3	101.9	141.3	39.7	0	0	0	0	105.4
295	L	21	Very low	21.5	Very low	161 Å²	161	139.9 Å²	139.9	84%	0.843	78%	0.782	S	S	*	*			trans	155.7	86.3	157.1	-87.2	149.5	0	0	0	110
296	S	22.4	Very low	21.4	Very low	119 Å²	119	138.5 Å²	138.5	83%	0.832	78%	0.783	S	S	*	*			trans	-159.3	99.6	139.9	56.2	0	0	0	0	108.2
297	I	20.7	Very low	21.3	Very low	152 Å²	152	139.8 Å²	139.8	78%	0.779	78%	0.784	S	S	*	*			trans	-62.8	117.4	159.7	-65.9	161.1	0	0	0	105.9
298	D	21.2	Very low	21.2	Very low	163 Å²	163	140.3 Å²	140.3	87%	0.872	79%	0.786	S	S	*	*			trans	-165.9	136.7	142.6	-99.3	-26.4	0	0	0	110.3
299	G	21.8	Very low	21.1	Very low	72 Å²	72	139.3 Å²	139.3	74%	0.742	78%	0.784	S	S	*	*			trans	-95.2	-164.8	-167.9	0	0	0	0	0	115.5
300	R	19.8	Very low	21	Very low	240 Å²	240	136.9 Å²	136.9	91%	0.906	79%	0.786	S	S	*	*			trans	87.7	104.1	171.2	-71.5	-176.3	172.4	179.6	-2	118
301	S	21.7	Very low	20.9	Very low	95 Å²	95	135.3 Å²	135.3	66%	0.664	79%	0.786	S	S	*	*				67.5	111.9	114.3	-57	0	0	0	0	119.7
302	D	20.6	Very low	20.9	Very low	147 Å²	147	134.1 Å²	134.1	79%	0.786	79%	0.786	S	S	*	*				72.7	139.1	123.8	-60.6	-35	0	0	0	121.7
303	S	22.2	Very low	20.8	Very low	107 Å²	107	136.1 Å²	136.1	75%	0.748	79%	0.794	S	S	*	*			trans	82.7	104.1	155.2	66.8	0	0	0	0	118.6
304	V	19.9	Very low	20.8	Very low	130 Å²	130	133 Å²	133	79%	0.788	79%	0.79	S	S	*	*				33.7	115.4	113.7	-174.8	0	0	0	0	115.3
305	I	20.5	Very low	21	Very low	163 Å²	163	135.1 Å²	135.1	84%	0.836	79%	0.791	S	S	*	*				-168.5	123.5	126.2	-90.6	149.2	0	0	0	108.2
306	S	19	Very low	21.3	Very low	88 Å²	88	136.2 Å²	136.2	62%	0.615	79%	0.791	S	S	*	*			trans	-70.5	135.4	157.9	53	0	0	0	0	109.6
307	D	19.8	Very low	21.8	Very low	136 Å²	136	134.8 Å²	134.8	73%	0.727	77%	0.774	S	S	*	*				160.4	133.3	121.2	-84.6	-22.5	0	0	0	112.7
308	T	20	Very low	22	Very low	128 Å²	128	134.8 Å²	134.8	79%	0.785	77%	0.771	S	S	*	*			trans	53.7	114.3	148.4	41.9	0	0	0	0	121.4
309	A	20.3	Very low	22.3	Very low	91 Å²	91	131 Å²	131	75%	0.752	76%	0.762	S	S	*	*				45.1	109.4	122.8	0	0	0	0	0	118.6
310	S	20.9	Very low	22.7	Very low	117 Å²	117	137.2 Å²	137.2	82%	0.818	76%	0.763	S	S	*	*				172.4	144.1	109	45.9	0	0	0	0	112.7
311	N	20.3	Very low	23	Very low	160 Å²	160	133.4 Å²	133.4	86%	0.856	75%	0.749	S	S	*	*			trans	-36.3	123.1	173.3	-59.6	-51.7	0	0	0	116.3
312	V	22.6	Very low	23.1	Very low	138 Å²	138	139.2 Å²	139.2	84%	0.836	76%	0.756	S	S	*	*			trans	-144	122.6	143.4	-177.9	0	0	0	0	109.9
313	V	20.9	Very low	23.4	Very low	132 Å²	132	139.2 Å²	139.2	80%	0.8	75%	0.749	S	S	*	*			trans	-79.6	133.9	171.3	171.6	0	0	0	0	109.4
314	P	23.3	Very low	23.7	Very low	120 Å²	120	138.6 Å²	138.6	78%	0.779	74%	0.741	S	S	*	*			trans	-113.1	146.2	159.1	15.3	5	0	0	0	113
315	Q	23.3	Very low	23.8	Very low	179 Å²	179	142.1 Å²	142.1	84%	0.836	74%	0.74	S	S	*	*			trans	-87.2	106.5	-165.9	-179.7	-175.1	0.9	0	0	111.6
316	E	26.8	Very low	24.1	Very low	184 Å²	184	137.3 Å²	137.3	86%	0.86	73%	0.725	S	S	*	*			trans	-133.6	34.6	166.7	-78.9	-162.3	151.2	0	0	113	H318	E316-H318 PolarHBondContact O-N 3.42Å
317	D	31.5	Very low	24.4	Very low	88 Å²	88	138.1 Å²	138.1	47%	0.471	72%	0.722	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.1	9.4	-172	-154.8	33.4	0	0	0	115.7	R321	D317-R321 PolarHBondContact O-NE 3.05Å; D317-R321 IonicContact OD2-CZ 2.76Å; D317-R321 IonicContact OD2-NE 3.62Å; D317-R321 IonicContact OD2-NH2 3.05Å; D317-R321 PolarHBondContact OD2-NH2 2.8Å
318	H	26.8	Very low	24.9	Very low	153 Å²	153	135.8 Å²	135.8	71%	0.708	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.7	-33.7	-177.3	-90.1	-77.1	0	0	0	115.5	E316	E316-H318 PolarHBondContact O-N 3.42Å
319	A	27.3	Very low	25.1	Very low	83 Å²	83	137.2 Å²	137.2	69%	0.686	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75	-35.8	-178.6	0	0	0	0	0	112.5	R321 R322	A319-R321 VanDerWaalsContact C-N 3.29Å; A319-R321 PolarHBondContact O-N 3.03Å; A319-R322 PolarHBondContact O-N 3.42Å
320	R	28.6	Very low	25.4	Very low	202 Å²	202	138.3 Å²	138.3	76%	0.762	71%	0.711	S	S	*	*	H	α-helix	trans	-61.3	-33.5	-178.3	-124.4	176.2	-177.9	-122.1	0.1	113.3	R322 F323 V324	R320-R322 VanDerWaalsContact C-N 3.31Å; R320-R322 PolarHBondContact O-N 3.49Å; R320-F323 PolarHBondContact O-N 3.43Å; R320-V324 PolarHBondContact O-N 2.96Å
321	R	27.2	Very low	25.7	Very low	161 Å²	161	137 Å²	137	61%	0.608	71%	0.708	S	S	*	*	H	α-helix	trans	-69.9	-23.7	-179.2	-65.3	-176.5	-172.8	-165.7	2.7	113.4	D317 A319	D317-R321 PolarHBondContact O-NE 3.05Å; D317-R321 IonicContact OD2-CZ 2.76Å; D317-R321 IonicContact OD2-NE 3.62Å; D317-R321 IonicContact OD2-NH2 3.05Å; D317-R321 PolarHBondContact OD2-NH2 2.8Å; A319-R321 VanDerWaalsContact C-N 3.29Å; A319-R321 PolarHBondContact O-N 3.03Å
322	R	23.1	Very low	26	Very low	217 Å²	217	133.8 Å²	133.8	82%	0.819	70%	0.698	S	S	*	*	H	α-helix	trans	-78.9	-35.1	175.1	-78.5	-173.7	175.2	172.2	-0.5	112.5	A319 R320 R325	A319-R322 PolarHBondContact O-N 3.42Å; R320-R322 VanDerWaalsContact C-N 3.31Å; R320-R322 PolarHBondContact O-N 3.49Å; R322-R325 PolarHBondContact O-N 2.99Å
323	F	26.7	Very low	26.2	Very low	147 Å²	147	133.5 Å²	133.5	65%	0.645	70%	0.696	S	S	*	*	H	α-helix	trans	-69.3	-37.1	-178.5	-166.4	-102	0	0	0	112.8	R320 R325 A326 L327	R320-F323 PolarHBondContact O-N 3.43Å; F323-R325 VanDerWaalsContact C-N 3.32Å; F323-R325 PolarHBondContact O-N 3.4Å; F323-A326 PolarHBondContact O-N 3.48Å; F323-L327 HydrophobicContact CD1-CD1 3.99Å; F323-L327 HydrophobicContact CE1-CD1 3.53Å; F323-L327 HydrophobicContact CZ-CD1 4.18Å
324	V	29.2	Very low	26.4	Very low	93 Å²	93	139 Å²	139	56%	0.564	70%	0.702	S	S	*	*	H	α-helix	trans	-67.8	-28.9	179.8	177.8	0	0	0	0	112.7	R320	R320-V324 PolarHBondContact O-N 2.96Å
325	R	22.3	Very low	26.7	Very low	204 Å²	204	138.2 Å²	138.2	77%	0.77	70%	0.699	S	S	*	*	H	α-helix	trans	-72.5	-26.8	176.1	-87.3	-174.8	-175.9	161.8	2.2	113.7	R322 F323 S328	R322-R325 PolarHBondContact O-N 2.99Å; F323-R325 VanDerWaalsContact C-N 3.32Å; F323-R325 PolarHBondContact O-N 3.4Å; R325-S328 PolarHBondContact O-OG 3.2Å; R325-S328 VanDerWaalsContact O-OG 3.08Å
326	A	26.8	Very low	27	Very low	63 Å²	63	135.6 Å²	135.6	52%	0.521	70%	0.701	S	S	.	*	H	α-helix	trans	-72.3	-34.7	177.4	0	0	0	0	0	111.7	F323 Q329	F323-A326 PolarHBondContact O-N 3.48Å; A326-Q329 PolarHBondContact O-N 3.4Å
327	L	25.1	Very low	27.1	Very low	105 Å²	105	136.7 Å²	136.7	55%	0.55	70%	0.703	S	S	.	*	H	α-helix	trans	-76.5	-21.1	-177.8	-92.1	148.6	0	0	0	114.4	F323 Q329 T330	F323-L327 HydrophobicContact CD1-CD1 3.99Å; F323-L327 HydrophobicContact CE1-CD1 3.53Å; F323-L327 HydrophobicContact CZ-CD1 4.18Å; L327-Q329 VanDerWaalsContact C-N 3.26Å; L327-Q329 PolarHBondContact O-N 2.92Å; L327-T330 PolarHBondContact O-OG1 3.24Å
328	S	29.1	Very low	27	Very low	87 Å²	87	137.3 Å²	137.3	61%	0.608	72%	0.72	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	-15.5	174.5	55.8	0	0	0	0	113.7	R325	R325-S328 PolarHBondContact O-OG 3.2Å; R325-S328 VanDerWaalsContact O-OG 3.08Å
329	Q	25.4	Very low	27	Very low	158 Å²	158	141.2 Å²	141.2	74%	0.738	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	-11.3	-177.4	-74	-173.2	-15.1	0	0	114.3	A326 L327	A326-Q329 PolarHBondContact O-N 3.4Å; L327-Q329 VanDerWaalsContact C-N 3.26Å; L327-Q329 PolarHBondContact O-N 2.92Å
330	T	26.6	Very low	26.8	Very low	113 Å²	113	147.7 Å²	147.7	69%	0.693	74%	0.736	S	S	*	*	S	Bend	trans	-100.3	0.5	-177.8	46.8	0	0	0	0	115	L327	L327-T330 PolarHBondContact O-OG1 3.24Å
331	A	27.2	Very low	26.8	Very low	91 Å²	91	147.8 Å²	147.8	75%	0.752	74%	0.742	S	S	*	*	S	Bend	trans	-96.2	4.4	-178.9	0	0	0	0	0	115.4
332	S	26.4	Very low	26.8	Very low	92 Å²	92	145.8 Å²	145.8	64%	0.643	75%	0.75	S	S	*	*			trans	-89.6	6.6	-173.5	66	0	0	0	0	116.6
333	V	26.7	Very low	27.2	Very low	131 Å²	131	141.9 Å²	141.9	79%	0.794	75%	0.75	S	S	*	*	S	Bend	trans	-106.9	12.9	-168.3	-174.4	0	0	0	0	115.5
334	R	25	Very low	27	Very low	248 Å²	248	146 Å²	146	94%	0.936	76%	0.761	S	S	*	*			trans	-127.1	20.3	-175.8	-108.6	179.9	177.8	174.7	-0.3	119.2
335	S	30.1	Very low	26.9	Very low	103 Å²	103	150.4 Å²	150.4	72%	0.72	78%	0.776	S	S	*	*			trans	-97.2	5.7	-176.6	61.1	0	0	0	0	117.7
336	S	29.8	Very low	27	Very low	124 Å²	124	149.1 Å²	149.1	87%	0.867	78%	0.783	S	S	*	*	S	Bend	trans	-88.6	0.5	-170.4	-75.6	0	0	0	0	118.6
337	F	28	Very low	26.8	Very low	207 Å²	207	151.5 Å²	151.5	91%	0.908	80%	0.796	S	S	*	*	S	Bend	trans	-110.8	-7	-174.8	-146.6	-102.2	0	0	0	116.9
338	A	29.7	Very low	26.7	Very low	101 Å²	101	155.3 Å²	155.3	84%	0.835	81%	0.813	S	S	*	*	S	Bend	trans	-95.4	10.3	-170.8	0	0	0	0	0	116.1
339	R	26.3	Very low	26.4	Very low	235 Å²	235	157.6 Å²	157.6	89%	0.887	82%	0.823	S	S	*	*			trans	-108.4	73.3	179.6	-66.8	-169	-172	-153.2	3.8	112.5
340	R	24.4	Very low	26.3	Very low	220 Å²	220	156.2 Å²	156.2	83%	0.83	83%	0.825	S	S	*	*			trans	-155.1	33.2	166.8	-147.9	83.4	-175	-172.3	2.6	117.1
341	F	27	Very low	26.1	Very low	204 Å²	204	157.6 Å²	157.6	90%	0.895	83%	0.833	S	S	*	*			trans	-145.7	113.7	165.7	-80.2	-76.8	0	0	0	112.4
342	P	28.6	Very low	25.9	Very low	119 Å²	119	158.4 Å²	158.4	77%	0.773	83%	0.833	S	S	*	*			trans	-98.6	100.5	171.2	34	-22.3	0	0	0	109.3
343	V	30	Very low	25.8	Very low	135 Å²	135	165.2 Å²	165.2	82%	0.818	85%	0.845	S	S	*	*			trans	-126.4	96.1	159.5	-177.1	0	0	0	0	106.6
344	R	23.2	Very low	25.8	Very low	233 Å²	233	169 Å²	169	88%	0.879	85%	0.851	S	S	*	*			trans	-71	144.2	174.7	-74.3	174.3	167.2	174.8	-4.6	108.4
345	Q	26.9	Very low	25.7	Very low	186 Å²	186	162.1 Å²	162.1	87%	0.869	84%	0.841	S	S	*	*	S	Bend	trans	88.2	57.4	179.6	-54.8	-174.3	-17.1	0	0	116.3
346	L	24.1	Very low	25.3	Very low	176 Å²	176	163.5 Å²	163.5	92%	0.921	84%	0.844	S	S	*	*			trans	179.8	73.5	145	-98.2	151.1	0	0	0	108.1
347	S	23.2	Very low	24.9	Very low	113 Å²	113	163.9 Å²	163.9	79%	0.79	84%	0.836	S	S	*	*			trans	-139.7	64.9	173.7	67.6	0	0	0	0	109.9
348	M	22.8	Very low	24.5	Very low	185 Å²	185	159 Å²	159	91%	0.911	83%	0.826	S	S	*	*	S	Bend	trans	-91.9	98.3	148.4	-110.9	-174.2	-89.6	0	0	107
349	V	23.6	Very low	24.1	Very low	135 Å²	135	158.2 Å²	158.2	82%	0.818	81%	0.811	S	S	*	*	S	Bend	trans	73.3	58.5	151.2	-157.3	0	0	0	0	116.4
350	V	22.1	Very low	23.8	Very low	129 Å²	129	153.1 Å²	153.1	78%	0.782	81%	0.811	S	S	*	*	S	Bend	trans	-132.7	128.9	147.2	-175.3	0	0	0	0	106.8
351	V	22.3	Very low	23.7	Very low	142 Å²	142	147.6 Å²	147.6	86%	0.861	80%	0.797	S	S	*	*	S	Bend	trans	82.5	104	-179.3	-160.5	0	0	0	0	116.4
352	S	22.9	Very low	23.7	Very low	109 Å²	109	142.6 Å²	142.6	76%	0.762	79%	0.785	S	S	*	*			trans	130.2	75.9	144.7	-165.8	0	0	0	0	114
353	R	25.5	Very low	23.5	Very low	234 Å²	234	142.1 Å²	142.1	88%	0.883	78%	0.784	S	S	*	*			trans	-146.5	57.4	145.5	-75.7	-150.7	-179.6	-165.4	2.3	110.1
354	F	26	Very low	23.1	Very low	212 Å²	212	142.2 Å²	142.2	93%	0.93	79%	0.785	S	S	*	*			trans	-115.7	77.5	159.3	-99.6	-86.4	0	0	0	107.3
355	S	22.9	Very low	23.2	Very low	103 Å²	103	138.8 Å²	138.8	72%	0.72	77%	0.773	S	S	*	*	S	Bend	trans	-161	106.4	162.5	-82.3	0	0	0	0	108	I357	S355-I357 PolarHBondContact O-N 3.37Å; S355-I357 VanDerWaalsContact O-N 3.13Å
356	V	22	Very low	23.1	Very low	131 Å²	131	135 Å²	135	79%	0.794	76%	0.759	S	S	*	*			trans	5.5	93.7	145.4	-173.1	0	0	0	0	113.5	C358	V356-C358 HydrophobicContact CG1-CB 4.27Å
357	I	20.7	Very low	23.3	Very low	133 Å²	133	133.5 Å²	133.5	68%	0.682	75%	0.751	S	S	*	*			trans	-99.6	78.9	155.9	-64.2	-177.8	0	0	0	105.3	S355 V359	S355-I357 PolarHBondContact O-N 3.37Å; S355-I357 VanDerWaalsContact O-N 3.13Å; I357-V359 HydrophobicContact CG2-CB 3.61Å; I357-V359 HydrophobicContact CG2-CG2 3.35Å; I357-V359 PolarHBondContact O-N 3.38Å; I357-V359 VanDerWaalsContact O-N 3.09Å
358	C	20	Very low	23.4	Very low	105 Å²	105	137.5 Å²	137.5	71%	0.709	75%	0.749	S	S	*	*			trans	-67.6	90.3	150	-78.3	0	0	0	0	106	V356	V356-C358 HydrophobicContact CG1-CB 4.27Å
359	V	21.8	Very low	23.6	Very low	84 Å²	84	132.9 Å²	132.9	51%	0.509	73%	0.728	S	S	.	*			trans	-125.7	98.2	167.7	171.7	0	0	0	0	106.6	I357 I361	I357-V359 HydrophobicContact CG2-CB 3.61Å; I357-V359 HydrophobicContact CG2-CG2 3.35Å; I357-V359 PolarHBondContact O-N 3.38Å; I357-V359 VanDerWaalsContact O-N 3.09Å; V359-I361 HydrophobicContact CG1-CB 4.08Å; V359-I361 HydrophobicContact CG1-CD1 3.16Å; V359-I361 HydrophobicContact CG1-CG1 3.3Å; V359-I361 PolarHBondContact O-N 3.03Å; V359-I361 VanDerWaalsContact O-N 3.16Å
360	S	20.6	Very low	23.9	Very low	127 Å²	127	129.9 Å²	129.9	89%	0.888	71%	0.709	S	S	*	*			trans	-51.5	110.5	155.1	-46.9	0	0	0	0	107.5
361	I	21.9	Very low	24.6	Very low	105 Å²	105	129.1 Å²	129.1	54%	0.538	70%	0.697	S	S	.	*			trans	-135.7	143.7	172.5	-90.5	173	0	0	0	110.4	V359 Y365	V359-I361 HydrophobicContact CG1-CB 4.08Å; V359-I361 HydrophobicContact CG1-CD1 3.16Å; V359-I361 HydrophobicContact CG1-CG1 3.3Å; V359-I361 PolarHBondContact O-N 3.03Å; V359-I361 VanDerWaalsContact O-N 3.16Å; I361-Y365 HydrophobicContact CG2-CD2 4.11Å; I361-Y365 HydrophobicContact CG2-CE2 3.42Å; I361-Y365 VanDerWaalsContact CG2-CE2 3.42Å
362	P	27.5	Very low	25.5	Very low	98 Å²	98	128 Å²	128	64%	0.636	68%	0.684	S	S	*	*			trans	-93.4	166.2	-152.9	-0.1	22.5	0	0	0	113.3
363	S	22.6	Very low	27	Very low	109 Å²	109	127.3 Å²	127.3	76%	0.762	67%	0.672	S	S	*	*	S	Bend	trans	23.1	115.2	140.9	-159.1	0	0	0	0	117.4
364	V	23.4	Very low	28.7	Very low	137 Å²	137	118.7 Å²	118.7	83%	0.83	64%	0.641	S	S	*	*			trans	59.8	66	164.8	-162.8	0	0	0	0	114.3
365	Y	24.4	Very low	30.7	Very low	161 Å²	161	116 Å²	116	63%	0.631	63%	0.625	S	S	*	*			trans	-84.2	118.9	156.2	-99.8	-95	0	0	0	109.6	I361	I361-Y365 HydrophobicContact CG2-CD2 4.11Å; I361-Y365 HydrophobicContact CG2-CE2 3.42Å; I361-Y365 VanDerWaalsContact CG2-CE2 3.42Å
366	D	24.9	Very low	32.9	Very low	108 Å²	108	116.1 Å²	116.1	58%	0.578	61%	0.614	S	S	*	*			trans	-31.9	122.6	176.5	-156.6	-8.5	0	0	0	114.6	R368 N369	D366-R368 PolarHBondContact O-N 3.41Å; D366-N369 PolarHBondContact O-N 3.34Å
367	L	28.8	Very low	35.2	Very low	144 Å²	144	113.1 Å²	113.1	75%	0.754	59%	0.591	S	S	*	*	H	α-helix	trans	-51.5	-26.4	-177.8	-92.8	134.6	0	0	0	113.3	N369 V370 E371	L367-N369 VanDerWaalsContact C-N 3.3Å; L367-N369 PolarHBondContact O-N 3.09Å; L367-V370 PolarHBondContact O-N 3.39Å; L367-E371 PolarHBondContact O-N 3.13Å
368	R	24.4	Very low	37.6	Very low	196 Å²	196	107.8 Å²	107.8	74%	0.74	56%	0.564	S	S	*	*	H	α-helix	trans	-59.2	-37	177.2	-130.4	175.6	-170.3	177.6	2.7	113.2	D366 M372	D366-R368 PolarHBondContact O-N 3.41Å; R368-M372 WeakPolarHBondContact O-CB 3.15Å; R368-M372 WeakPolarHBondContact O-CG 3.41Å; R368-M372 PolarHBondContact O-N 2.88Å
369	N	26.9	Very low	40.2	Very low	89 Å²	89	107.8 Å²	107.8	48%	0.476	55%	0.549	S	S	.	.	H	α-helix	trans	-75.4	-29	-178.6	-76.6	-24.9	0	0	0	112.8	D366 L367 N373	D366-N369 PolarHBondContact O-N 3.34Å; L367-N369 VanDerWaalsContact C-N 3.3Å; L367-N369 PolarHBondContact O-N 3.09Å; N369-N373 WeakPolarHBondContact O-CB 3.48Å; N369-N373 PolarHBondContact O-N 3.25Å; N369-N373 VanDerWaalsContact O-N 3.11Å
370	V	30.1	Very low	42.6	Very low	71 Å²	71	108.8 Å²	108.8	43%	0.43	55%	0.546	S	S	.	.	H	α-helix	trans	-71.8	-42.6	177.1	176.6	0	0	0	0	110.4	L367 N373 K374	L367-V370 PolarHBondContact O-N 3.39Å; V370-N373 PolarHBondContact O-N 3.05Å; V370-K374 WeakPolarHBondContact O-CG 3.39Å; V370-K374 PolarHBondContact O-N 2.91Å; V370-K374 VanDerWaalsContact O-N 3.11Å
371	E	37.2	Very low	45.1	Very low	113 Å²	113	104.4 Å²	104.4	53%	0.528	51%	0.512	S	S	.	.	H	α-helix	trans	-71.1	-38.7	178.2	-166.7	153.3	-176.2	0	0	112.7	L367 N373 K374 R375	L367-E371 PolarHBondContact O-N 3.13Å; E371-N373 VanDerWaalsContact C-N 3.34Å; E371-N373 PolarHBondContact O-N 3.42Å; E371-K374 PolarHBondContact O-N 2.72Å; E371-K374 VanDerWaalsContact O-N 3.15Å; E371-R375 PolarHBondContact O-N 3Å
372	M	41.1	Very low	47.5	Very low	119 Å²	119	99.4 Å²	99.4	59%	0.586	49%	0.487	S	S	*	.	H	α-helix	trans	-58	-44	171.3	-76.1	-68.9	-65.7	0	0	112.1	R368 K374 Q376	R368-M372 WeakPolarHBondContact O-CB 3.15Å; R368-M372 WeakPolarHBondContact O-CG 3.41Å; R368-M372 PolarHBondContact O-N 2.88Å; M372-K374 PolarHBondContact O-N 3.44Å; M372-Q376 VanDerWaalsContact O-CB 3.26Å; M372-Q376 WeakPolarHBondContact O-CB 3.49Å; M372-Q376 PolarHBondContact O-N 3.46Å
373	N	53.9	Low	49.7	Very low	95 Å²	95	98.9 Å²	98.9	51%	0.508	47%	0.473	S	S	.	.	H	α-helix	trans	-62.8	-40.7	174.9	-84.2	-20.9	0	0	0	111.9	N369 V370 E371 Q376 E377	N369-N373 WeakPolarHBondContact O-CB 3.48Å; N369-N373 PolarHBondContact O-N 3.25Å; N369-N373 VanDerWaalsContact O-N 3.11Å; V370-N373 PolarHBondContact O-N 3.05Å; E371-N373 VanDerWaalsContact C-N 3.34Å; E371-N373 PolarHBondContact O-N 3.42Å; N373-Q376 PolarHBondContact O-N 3.48Å; N373-E377 WeakPolarHBondContact O-CG 3.25Å; N373-E377 PolarHBondContact O-N 3.18Å
374	K	62.3	Low	52	Low	53 Å²	53	96.2 Å²	96.2	23%	0.23	46%	0.457	C	S	.	.	H	α-helix	trans	-63.2	-48.5	179.1	-70.5	175.2	-175.4	178.4	0	112.2	G270 L274 V370 E371 M372 Q376 E377 L378	G270-K374 VanDerWaalsContact O-CE 3.32Å; G270-K374 WeakPolarHBondContact O-CE 3.43Å; G270-K374 PolarHBondContact O-NZ 3.05Å; L274-K374 HydrophobicContact CD2-CB 4.43Å; L274-K374 HydrophobicContact CD2-CG 4.17Å; V370-K374 WeakPolarHBondContact O-CG 3.39Å; V370-K374 PolarHBondContact O-N 2.91Å; V370-K374 VanDerWaalsContact O-N 3.11Å; E371-K374 PolarHBondContact O-N 2.72Å; E371-K374 VanDerWaalsContact O-N 3.15Å; M372-K374 PolarHBondContact O-N 3.44Å; K374-Q376 VanDerWaalsContact C-N 3.33Å; K374-Q376 PolarHBondContact O-N 3.35Å; K374-E377 PolarHBondContact O-N 3.32Å; K374-L378 PolarHBondContact O-N 3.02Å
375	R	66.8	Low	54.1	Low	156 Å²	156	89.9 Å²	89.9	59%	0.589	42%	0.419	S	S	*	.	H	α-helix	trans	-62.9	-40.4	175.9	-74.4	-171.8	-176.7	-126.6	4.9	111.6	E371 E377 L378 R379	E371-R375 PolarHBondContact O-N 3Å; R375-E377 PolarHBondContact O-N 3.17Å; R375-L378 PolarHBondContact O-N 3.02Å; R375-R379 VanDerWaalsContact O-CB 3.24Å; R375-R379 WeakPolarHBondContact O-CB 3.26Å; R375-R379 PolarHBondContact O-N 3.36Å
376	Q	70.4	Confident	56.3	Low	105 Å²	105	82.2 Å²	82.2	49%	0.491	39%	0.389	S	S	.	.	H	α-helix	trans	-64	-39	178.3	-170.3	175.5	4.2	0	0	112.5	M372 N373 K374 K380	M372-Q376 VanDerWaalsContact O-CB 3.26Å; M372-Q376 WeakPolarHBondContact O-CB 3.49Å; M372-Q376 PolarHBondContact O-N 3.46Å; N373-Q376 PolarHBondContact O-N 3.48Å; K374-Q376 VanDerWaalsContact C-N 3.33Å; K374-Q376 PolarHBondContact O-N 3.35Å; Q376-K380 WeakPolarHBondContact O-CG 3.45Å; Q376-K380 PolarHBondContact O-N 2.82Å; Q376-K380 VanDerWaalsContact O-N 3.12Å
377	E	69.2	Low	58.6	Low	68 Å²	68	81.8 Å²	81.8	32%	0.318	38%	0.384	S	S	.	.	H	α-helix	trans	-68.9	-45.3	174.7	-67.2	-51	130	0	0	112.1	L274 N373 K374 R375 R379 K380 I381	L274-E377 HydrophobicContact CD2-CB 4.47Å; N373-E377 WeakPolarHBondContact O-CG 3.25Å; N373-E377 PolarHBondContact O-N 3.18Å; K374-E377 PolarHBondContact O-N 3.32Å; R375-E377 PolarHBondContact O-N 3.17Å; E377-R379 VanDerWaalsContact C-N 3.28Å; E377-R379 PolarHBondContact O-N 3.2Å; E377-K380 WeakPolarHBondContact O-CB 3.38Å; E377-K380 PolarHBondContact O-N 2.85Å; E377-K380 VanDerWaalsContact O-N 3.11Å; E377-K380 IonicContact OE1-NZ 2.96Å; E377-K380 PolarHBondContact OE1-NZ 3.42Å; E377-K380 IonicContact OE2-NZ 3.63Å; E377-I381 WeakPolarHBondContact O-CG1 3.26Å; E377-I381 PolarHBondContact O-N 3.44Å
378	L	72.2	Confident	60.5	Low	20 Å²	20	75.8 Å²	75.8	11%	0.105	35%	0.353	C	S	.	.	H	α-helix	trans	-58.9	-40.7	174.9	-77.7	167.6	0	0	0	111.9	E252 V256 L259 L274 K374 R375 K380 I381 S382	E252-L378 HydrophobicContact CG-CB 4.18Å; V256-L378 HydrophobicContact CG2-CD1 4.02Å; L259-L378 HydrophobicContact CD1-CD2 4.11Å; L274-L378 HydrophobicContact CD1-CD1 4.33Å; L274-L378 HydrophobicContact CD1-CD2 4.26Å; L274-L378 HydrophobicContact CD1-CG 4.14Å; K374-L378 PolarHBondContact O-N 3.02Å; R375-L378 PolarHBondContact O-N 3.02Å; L378-K380 VanDerWaalsContact C-N 3.34Å; L378-K380 PolarHBondContact O-N 3.07Å; L378-I381 PolarHBondContact O-N 3.14Å; L378-S382 WeakPolarHBondContact O-CB 3.46Å; L378-S382 PolarHBondContact O-N 2.87Å; L378-S382 PolarHBondContact O-OG 3.48Å
379	R	74	Confident	62.6	Low	106 Å²	106	68.3 Å²	68.3	40%	0.4	33%	0.326	S	S	.	.	H	α-helix	trans	-63.4	-37.6	175.7	-168.1	177.7	-171.9	156.7	15.9	112.6	V248 R375 E377 Y383	V248-R379 HydrophobicContact CG1-CG 3.78Å; R375-R379 VanDerWaalsContact O-CB 3.24Å; R375-R379 WeakPolarHBondContact O-CB 3.26Å; R375-R379 PolarHBondContact O-N 3.36Å; E377-R379 VanDerWaalsContact C-N 3.28Å; E377-R379 PolarHBondContact O-N 3.2Å; R379-Y383 WeakPolarHBondContact O-CB 3.26Å; R379-Y383 PolarHBondContact O-N 2.69Å
380	K	71.7	Confident	64.8	Low	104 Å²	104	65.3 Å²	65.3	45%	0.452	31%	0.311	S	S	.	.	H	α-helix	trans	-65.2	-44	174	-72.7	170.3	-173.1	169.8	0	111.5	Q376 E377 L378 Y383 A384	Q376-K380 WeakPolarHBondContact O-CG 3.45Å; Q376-K380 PolarHBondContact O-N 2.82Å; Q376-K380 VanDerWaalsContact O-N 3.12Å; E377-K380 WeakPolarHBondContact O-CB 3.38Å; E377-K380 PolarHBondContact O-N 2.85Å; E377-K380 VanDerWaalsContact O-N 3.11Å; E377-K380 IonicContact OE1-NZ 2.96Å; E377-K380 PolarHBondContact OE1-NZ 3.42Å; E377-K380 IonicContact OE2-NZ 3.63Å; L378-K380 VanDerWaalsContact C-N 3.34Å; L378-K380 PolarHBondContact O-N 3.07Å; K380-Y383 PolarHBondContact O-N 3.29Å; K380-A384 WeakPolarHBondContact O-CB 3.41Å; K380-A384 PolarHBondContact O-N 3.41Å
381	I	73.5	Confident	66.9	Low	35 Å²	35	64.6 Å²	64.6	18%	0.179	30%	0.3	C	S	.	.	H	α-helix	trans	-62	-48.1	176.7	-65.3	167.4	0	0	0	109.6	L255 V277 E377 L378 Y383 A384 S385	L255-I381 HydrophobicContact CD1-CG2 4.12Å; V277-I381 HydrophobicContact CG1-CD1 3.68Å; E377-I381 WeakPolarHBondContact O-CG1 3.26Å; E377-I381 PolarHBondContact O-N 3.44Å; L378-I381 PolarHBondContact O-N 3.14Å; I381-Y383 VanDerWaalsContact C-N 3.32Å; I381-Y383 PolarHBondContact O-N 2.92Å; I381-A384 PolarHBondContact O-N 2.86Å; I381-A384 VanDerWaalsContact O-N 3.1Å; I381-S385 WeakPolarHBondContact O-CB 3.36Å; I381-S385 PolarHBondContact O-N 3.27Å; I381-S385 PolarHBondContact O-OG 3.42Å; I381-S385 VanDerWaalsContact O-OG 3.06Å
382	S	72.8	Confident	68.7	Low	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-55.7	-47.1	177.3	-53.6	0	0	0	0	111.4	E252 L255 L378 S385 I386	E252-S382 VanDerWaalsContact CA-OG 3.3Å; E252-S382 WeakPolarHBondContact CA-OG 3.26Å; E252-S382 WeakPolarHBondContact CB-OG 3.44Å; E252-S382 PolarHBondContact N-OG 2.89Å; L255-S382 WeakPolarHBondContact CD1-OG 2.96Å; L378-S382 WeakPolarHBondContact O-CB 3.46Å; L378-S382 PolarHBondContact O-N 2.87Å; L378-S382 PolarHBondContact O-OG 3.48Å; S382-S385 PolarHBondContact O-N 3.15Å; S382-I386 WeakPolarHBondContact O-CD1 3.49Å; S382-I386 VanDerWaalsContact O-CG1 3.28Å; S382-I386 WeakPolarHBondContact O-CG1 3.49Å; S382-I386 PolarHBondContact O-N 2.81Å
383	Y	73.5	Confident	70	Confident	88 Å²	88	54.2 Å²	54.2	35%	0.345	25%	0.251	S	S	.	.	H	α-helix	trans	-63.2	-43.3	176.2	-173.1	-97.2	0	0	0	112.7	P243 V248 R379 K380 I381 I386 Q387	P243-Y383 HydrophobicContact CB-CD2 4.48Å; P243-Y383 HydrophobicContact CB-CE2 4.36Å; P243-Y383 HydrophobicContact CG-CD2 4.14Å; P243-Y383 HydrophobicContact CG-CE2 3.8Å; V248-Y383 HydrophobicContact CG2-CD2 4.28Å; R379-Y383 WeakPolarHBondContact O-CB 3.26Å; R379-Y383 PolarHBondContact O-N 2.69Å; K380-Y383 PolarHBondContact O-N 3.29Å; I381-Y383 VanDerWaalsContact C-N 3.32Å; I381-Y383 PolarHBondContact O-N 2.92Å; Y383-I386 PolarHBondContact O-N 3.04Å; Y383-Q387 HydrophobicContact CD1-CG 4.28Å; Y383-Q387 HydrophobicContact CE1-CG 3.94Å; Y383-Q387 VanDerWaalsContact CZ-NE2 3.32Å; Y383-Q387 WeakPolarHBondContact O-CG 3.45Å; Y383-Q387 PolarHBondContact O-N 3.46Å; Y383-Q387 PolarHBondContact OH-NE2 3.32Å; Y383-Q387 VanDerWaalsContact OH-NE2 3.08Å
384	A	70.7	Confident	70.6	Confident	52 Å²	52	53.4 Å²	53.4	43%	0.43	24%	0.244	S	C	.	.	H	α-helix	trans	-66.2	-38.4	178.2	0	0	0	0	0	112.5	K380 I381 Q387 S388	K380-A384 WeakPolarHBondContact O-CB 3.41Å; K380-A384 PolarHBondContact O-N 3.41Å; I381-A384 PolarHBondContact O-N 2.86Å; I381-A384 VanDerWaalsContact O-N 3.1Å; A384-Q387 PolarHBondContact O-N 3.13Å; A384-S388 WeakPolarHBondContact O-CB 3.41Å; A384-S388 PolarHBondContact O-N 3.4Å; A384-S388 PolarHBondContact O-OG 3.29Å
385	S	67.1	Low	70.9	Confident	4 Å²	4	52.6 Å²	52.6	3%	0.028	24%	0.24	C	C	.	.	H	α-helix	trans	-62.4	-46.6	173.4	-62.2	0	0	0	0	110.9	I381 S382 Q387 S388 F389	I381-S385 WeakPolarHBondContact O-CB 3.36Å; I381-S385 PolarHBondContact O-N 3.27Å; I381-S385 PolarHBondContact O-OG 3.42Å; I381-S385 VanDerWaalsContact O-OG 3.06Å; S382-S385 PolarHBondContact O-N 3.15Å; S385-Q387 VanDerWaalsContact C-N 3.33Å; S385-Q387 PolarHBondContact O-N 2.94Å; S385-S388 PolarHBondContact O-N 3.22Å; S385-S388 PolarHBondContact O-OG 3.34Å; S385-F389 WeakPolarHBondContact O-CD2 3.45Å; S385-F389 PolarHBondContact O-N 3.03Å
386	I	71.7	Confident	70.5	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-58.8	-47	175.1	-65.4	161.6	0	0	0	110.4	A51 I53 P243 Q247 V248 V251 S382 Y383 S388 F389 N390	A51-I386 HydrophobicContact CB-CG1 4.17Å; I53-I386 HydrophobicContact CD1-CG2 3.96Å; I53-I386 HydrophobicContact CG1-CG2 3.89Å; P243-I386 HydrophobicContact CB-CD1 4.16Å; P243-I386 HydrophobicContact CB-CG2 3.91Å; P243-I386 HydrophobicContact CG-CB 4.24Å; P243-I386 HydrophobicContact CG-CG2 3.48Å; P243-I386 VanDerWaalsContact CG-CG2 3.48Å; Q247-I386 HydrophobicContact CG-CD1 4.28Å; V248-I386 HydrophobicContact CB-CD1 4.4Å; V248-I386 HydrophobicContact CG2-CD1 3.83Å; V251-I386 HydrophobicContact CB-CD1 4.29Å; V251-I386 HydrophobicContact CB-CG1 4.5Å; V251-I386 HydrophobicContact CG1-CG1 4.45Å; V251-I386 HydrophobicContact CG2-CD1 3.95Å; V251-I386 HydrophobicContact CG2-CG1 3.92Å; S382-I386 WeakPolarHBondContact O-CD1 3.49Å; S382-I386 VanDerWaalsContact O-CG1 3.28Å; S382-I386 WeakPolarHBondContact O-CG1 3.49Å; S382-I386 PolarHBondContact O-N 2.81Å; Y383-I386 PolarHBondContact O-N 3.04Å; I386-S388 VanDerWaalsContact C-N 3.33Å; I386-S388 PolarHBondContact O-N 2.92Å; I386-F389 PolarHBondContact O-N 2.77Å; I386-N390 WeakPolarHBondContact O-CB 3.47Å; I386-N390 PolarHBondContact O-N 3.09Å; I386-N390 VanDerWaalsContact O-N 3.09Å; I386-N390 PolarHBondContact O-ND2 3.47Å
387	Q	72.7	Confident	70.2	Confident	100 Å²	100	42.4 Å²	42.4	47%	0.467	20%	0.2	S	C	.	.	H	α-helix	trans	-63.6	-37	178.4	-75	-167.4	-24.8	0	0	113.3	Y383 A384 S385 R391	Y383-Q387 HydrophobicContact CD1-CG 4.28Å; Y383-Q387 HydrophobicContact CE1-CG 3.94Å; Y383-Q387 VanDerWaalsContact CZ-NE2 3.32Å; Y383-Q387 WeakPolarHBondContact O-CG 3.45Å; Y383-Q387 PolarHBondContact O-N 3.46Å; Y383-Q387 PolarHBondContact OH-NE2 3.32Å; Y383-Q387 VanDerWaalsContact OH-NE2 3.08Å; A384-Q387 PolarHBondContact O-N 3.13Å; S385-Q387 VanDerWaalsContact C-N 3.33Å; S385-Q387 PolarHBondContact O-N 2.94Å; Q387-R391 WeakPolarHBondContact O-CG 3.21Å; Q387-R391 PolarHBondContact O-N 2.96Å
388	S	67.6	Low	70.1	Confident	17 Å²	17	39.2 Å²	39.2	12%	0.119	19%	0.186	C	C	.	.	H	α-helix	trans	-66.9	-47.7	178.5	69.6	0	0	0	0	110.5	A384 S385 I386 N390 R391 Q394	A384-S388 WeakPolarHBondContact O-CB 3.41Å; A384-S388 PolarHBondContact O-N 3.4Å; A384-S388 PolarHBondContact O-OG 3.29Å; S385-S388 PolarHBondContact O-N 3.22Å; S385-S388 PolarHBondContact O-OG 3.34Å; I386-S388 VanDerWaalsContact C-N 3.33Å; I386-S388 PolarHBondContact O-N 2.92Å; S388-N390 VanDerWaalsContact C-N 3.28Å; S388-N390 PolarHBondContact O-N 2.57Å; S388-R391 WeakPolarHBondContact O-CG 3.32Å; S388-R391 PolarHBondContact O-N 2.87Å; S388-Q394 PolarHBondContact O-OE1 2.93Å
389	F	68.7	Low	70.2	Confident	39 Å²	39	38.9 Å²	38.9	17%	0.171	18%	0.184	C	C	.	.	H	α-helix	trans	-67.8	-24.1	-179.9	-70.1	-60.9	0	0	0	114.2	I48 A51 S385 I386	I48-F389 HydrophobicContact CG1-CE1 3.92Å; I48-F389 HydrophobicContact CG1-CE2 4.5Å; I48-F389 HydrophobicContact CG1-CZ 3.89Å; I48-F389 HydrophobicContact CG2-CD1 4.42Å; A51-F389 HydrophobicContact CB-CB 4.4Å; A51-F389 HydrophobicContact CB-CD2 3.54Å; A51-F389 HydrophobicContact CB-CE2 4.23Å; A51-F389 HydrophobicContact CB-CG 4.3Å; S385-F389 WeakPolarHBondContact O-CD2 3.45Å; S385-F389 PolarHBondContact O-N 3.03Å; I386-F389 PolarHBondContact O-N 2.77Å
390	N	73.5	Confident	70	Confident	27 Å²	27	34 Å²	34	14%	0.144	17%	0.165	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.7	19.7	-179	-64.7	-86.1	0	0	0	113.7	A51 I53 I386 S388	A51-N390 PolarHBondContact O-ND2 3.13Å; I53-N390 HydrophobicContact CD1-CB 4.02Å; I53-N390 HydrophobicContact CG1-CB 4.44Å; I53-N390 PolarHBondContact N-OD1 3.14Å; I386-N390 WeakPolarHBondContact O-CB 3.47Å; I386-N390 PolarHBondContact O-N 3.09Å; I386-N390 VanDerWaalsContact O-N 3.09Å; I386-N390 PolarHBondContact O-ND2 3.47Å; S388-N390 VanDerWaalsContact C-N 3.28Å; S388-N390 PolarHBondContact O-N 2.57Å
391	R	74	Confident	69.7	Low	55 Å²	55	30.5 Å²	30.5	21%	0.208	15%	0.15	C	C	.	.			trans	-58.1	140.3	173.9	-75	-175.1	-176.1	179.8	2.5	110.7	N124 Q387 S388 L393 Q394 S446	N124-R391 WeakPolarHBondContact OD1-CB 3.18Å; Q387-R391 WeakPolarHBondContact O-CG 3.21Å; Q387-R391 PolarHBondContact O-N 2.96Å; S388-R391 WeakPolarHBondContact O-CG 3.32Å; S388-R391 PolarHBondContact O-N 2.87Å; R391-L393 PolarHBondContact O-N 3.25Å; R391-Q394 HydrophobicContact CB-CB 4.25Å; R391-Q394 HydrophobicContact CB-CG 3.95Å; R391-Q394 PolarHBondContact O-N 3.44Å; R391-Q394 VanDerWaalsContact O-N 3.13Å; R391-S446 PolarHBondContact NH1-OG 3.37Å; R391-S446 VanDerWaalsContact NH1-OG 3.16Å
392	P	75.1	Confident	68.9	Low	13 Å²	13	29.2 Å²	29.2	8%	0.084	15%	0.146	C	C	.	.	G	3₁₀ helix	trans	-58.8	-41.5	-166.7	-24.2	31.4	0	0	0	114.5	V123 I176 E180 A398	V123-P392 HydrophobicContact CG1-CB 4.02Å; V123-P392 HydrophobicContact CG1-CG 4.01Å; I176-P392 HydrophobicContact CG2-CB 3.4Å; I176-P392 VanDerWaalsContact CG2-CB 3.4Å; I176-P392 HydrophobicContact CG2-CG 4.4Å; E180-P392 WeakPolarHBondContact OE1-CG 3.41Å; P392-A398 WeakPolarHBondContact O-CB 3.42Å
393	L	68.9	Low	68.1	Low	1 Å²	1	29.7 Å²	29.7	1%	0.005	15%	0.149	C	C	.	.	G	3₁₀ helix	trans	-88.4	-10.3	-178.7	-72.8	-172.9	0	0	0	115.2	G120 N124 I176 R391 R395 A450 Q453 L454 T588	G120-L393 WeakPolarHBondContact O-CD1 3.4Å; N124-L393 HydrophobicContact CB-CB 4.36Å; N124-L393 HydrophobicContact CB-CD1 4.3Å; N124-L393 HydrophobicContact CB-CG 4.46Å; I176-L393 HydrophobicContact CD1-CD2 3.98Å; R391-L393 PolarHBondContact O-N 3.25Å; L393-R395 PolarHBondContact O-N 3.22Å; L393-A450 HydrophobicContact CD1-CB 4.12Å; L393-Q453 PolarHBondContact O-NE2 3.2Å; L393-Q453 PolarHBondContact O-OE1 3.24Å; L393-L454 HydrophobicContact CD1-CD1 3.69Å; L393-L454 HydrophobicContact CD1-CD2 4.41Å; L393-L454 HydrophobicContact CD1-CG 4.29Å; L393-T588 HydrophobicContact CD2-CG2 4.28Å
394	Q	65.6	Low	67.4	Low	78 Å²	78	26.2 Å²	26.2	36%	0.364	14%	0.137	S	C	.	.	G	3₁₀ helix	trans	-73	-13.3	173.4	-68.7	-171.9	-11	0	0	111.8	S388 R391	S388-Q394 PolarHBondContact O-OE1 2.93Å; R391-Q394 HydrophobicContact CB-CB 4.25Å; R391-Q394 HydrophobicContact CB-CG 3.95Å; R391-Q394 PolarHBondContact O-N 3.44Å; R391-Q394 VanDerWaalsContact O-N 3.13Å
395	R	69.1	Low	66.7	Low	37 Å²	37	30.8 Å²	30.8	14%	0.14	15%	0.147	C	C	.	.	S	Bend	trans	-79.7	122.7	173.1	-51.4	-179.3	72.9	166.8	26.8	110.3	S179 L393 D397 A398	S179-R395 PolarHBondContact O-NH1 3.4Å; L393-R395 PolarHBondContact O-N 3.22Å; R395-D397 PolarHBondContact O-N 2.96Å; R395-D397 VanDerWaalsContact O-N 3.14Å; R395-A398 HydrophobicContact CB-CB 4.28Å; R395-A398 WeakPolarHBondContact O-CB 3.38Å; R395-A398 PolarHBondContact O-N 3.48Å; R395-A398 VanDerWaalsContact O-N 3.15Å
396	L	58.8	Low	66.1	Low	47 Å²	47	32.7 Å²	32.7	25%	0.246	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-25.3	-179.6	-61.5	175.3	0	0	0	113.2	P6 I584 T588	P6-L396 HydrophobicContact CB-CD1 4.16Å; P6-L396 HydrophobicContact CG-CD1 4.23Å; L396-I584 HydrophobicContact CB-CG1 4.46Å; L396-T588 PolarHBondContact O-OG1 3.04Å
397	D	63.5	Low	65.3	Low	0 Å²	0	33 Å²	33	0%	0	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.1	11	-177.8	60.1	-55	0	0	0	113.7	R10 R55 R186 R395 L399 Y400 I584	R10-D397 IonicContact NH2-OD1 3.24Å; R10-D397 PolarHBondContact NH2-OD1 3.49Å; R55-D397 IonicContact NH1-OD2 3.87Å; R55-D397 IonicContact NH2-OD2 3.64Å; R186-D397 IonicContact CZ-OD2 3.75Å; R186-D397 PolarHBondContact NH1-O 3.04Å; R186-D397 IonicContact NH1-OD2 2.96Å; R186-D397 PolarHBondContact NH1-OD2 3.42Å; R186-D397 IonicContact NH2-OD2 3.77Å; R186-D397 PolarHBondContact NH2-OD2 3.44Å; R395-D397 PolarHBondContact O-N 2.96Å; R395-D397 VanDerWaalsContact O-N 3.14Å; D397-L399 VanDerWaalsContact C-N 3.33Å; D397-L399 PolarHBondContact O-N 2.94Å; D397-Y400 VanDerWaalsContact O-CB 3.28Å; D397-Y400 WeakPolarHBondContact O-CB 3.48Å; D397-Y400 PolarHBondContact O-N 3.38Å; D397-I584 HydrophobicContact CB-CD1 3.96Å
398	A	66.7	Low	64.1	Low	1 Å²	1	31.9 Å²	31.9	1%	0.008	16%	0.156	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-41.4	-175.3	0	0	0	0	0	113.8	S179 P392 R395 Y400	S179-A398 WeakPolarHBondContact CB-O 3.22Å; S179-A398 PolarHBondContact OG-O 2.89Å; P392-A398 WeakPolarHBondContact O-CB 3.42Å; R395-A398 HydrophobicContact CB-CB 4.28Å; R395-A398 WeakPolarHBondContact O-CB 3.38Å; R395-A398 PolarHBondContact O-N 3.48Å; R395-A398 VanDerWaalsContact O-N 3.15Å; A398-Y400 VanDerWaalsContact C-N 3.35Å
399	L	74	Confident	63.1	Low	12 Å²	12	35.1 Å²	35.1	6%	0.063	18%	0.184	C	C	.	.	T	Hydrogen-bonded Turn	trans	-92.3	4.1	177.6	-60.8	-177.2	0	0	0	112.9	L172 I176 D397 Q401 T588 F591	L172-L399 HydrophobicContact CD1-CD2 3.96Å; I176-L399 HydrophobicContact CG1-CD2 4.1Å; D397-L399 VanDerWaalsContact C-N 3.33Å; D397-L399 PolarHBondContact O-N 2.94Å; L399-Q401 PolarHBondContact O-N 3.29Å; L399-T588 HydrophobicContact CD1-CG2 3.98Å; L399-T588 HydrophobicContact CG-CG2 4.37Å; L399-F591 HydrophobicContact CB-CB 4.49Å; L399-F591 HydrophobicContact CB-CG 4.47Å; L399-F591 HydrophobicContact CD1-CB 3.79Å; L399-F591 HydrophobicContact CD1-CG 4.5Å
400	Y	71.2	Confident	62	Low	3 Å²	3	37 Å²	37	1%	0.012	19%	0.192	C	C	.	.			trans	-80.5	117.7	177.7	-174.6	-117.3	0	0	0	110.9	R186 D397 A398 G402 I407 L576 L579 L587	R186-Y400 WeakPolarHBondContact CD-O 3.31Å; R186-Y400 PolarHBondContact NH1-O 3.43Å; D397-Y400 VanDerWaalsContact O-CB 3.28Å; D397-Y400 WeakPolarHBondContact O-CB 3.48Å; D397-Y400 PolarHBondContact O-N 3.38Å; A398-Y400 VanDerWaalsContact C-N 3.35Å; Y400-G402 WeakPolarHBondContact CD1-O 3.33Å; Y400-G402 VanDerWaalsContact CE1-CA 3.43Å; Y400-G402 WeakPolarHBondContact CE1-O 3.36Å; Y400-I407 HydrophobicContact CD1-CD1 3.89Å; Y400-I407 HydrophobicContact CD1-CG1 4.39Å; Y400-I407 HydrophobicContact CE1-CD1 3.73Å; Y400-I407 HydrophobicContact CE1-CG1 3.72Å; Y400-L576 HydrophobicContact CE2-CD2 3.73Å; Y400-L576 WeakPolarHBondContact OH-CD2 3.48Å; Y400-L579 HydrophobicContact CD2-CD2 4.05Å; Y400-L579 HydrophobicContact CE2-CB 4.28Å; Y400-L579 HydrophobicContact CE2-CD2 3.3Å; Y400-L579 HydrophobicContact CE2-CG 4.31Å; Y400-L587 HydrophobicContact CD2-CD2 3.62Å; Y400-L587 HydrophobicContact CG-CD2 4Å
401	Q	65.3	Low	60.6	Low	31 Å²	31	38.1 Å²	38.1	15%	0.145	20%	0.2	C	C	.	.			trans	-88.5	-14.1	-177.6	-60.9	-172.4	-7	0	0	113.7	S187 T190 L399	S187-Q401 VanDerWaalsContact CA-O 3.29Å; S187-Q401 WeakPolarHBondContact CA-O 3.29Å; T190-Q401 HydrophobicContact CG2-CB 3.78Å; T190-Q401 HydrophobicContact CG2-CG 3.8Å; L399-Q401 PolarHBondContact O-N 3.29Å
402	G	55.6	Low	58.7	Low	8 Å²	8	38.4 Å²	38.4	8%	0.082	22%	0.22	C	C	.	.	S	Bend	trans	-82.9	-179.7	179.8	0	0	0	0	0	114.1	Y400	Y400-G402 WeakPolarHBondContact CD1-O 3.33Å; Y400-G402 VanDerWaalsContact CE1-CA 3.43Å; Y400-G402 WeakPolarHBondContact CE1-O 3.36Å
403	S	56.2	Low	56.7	Low	10 Å²	10	42 Å²	42	7%	0.07	24%	0.238	C	C	.	.			trans	-76.6	130.2	174	-175	0	0	0	0	111	T184 K405 N406	T184-S403 PolarHBondContact O-OG 2.89Å; T184-S403 VanDerWaalsContact O-OG 3.08Å; S403-K405 VanDerWaalsContact C-N 3.26Å; S403-K405 PolarHBondContact O-N 3.08Å; S403-N406 PolarHBondContact O-N 2.99Å
404	V	60.3	Low	54.6	Low	15 Å²	15	46.6 Å²	46.6	9%	0.091	27%	0.266	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-31.8	-179.8	-177.8	0	0	0	0	111.6	E183 N406 I407	E183-V404 HydrophobicContact CG-CB 4.24Å; E183-V404 HydrophobicContact CG-CG2 4.35Å; V404-N406 PolarHBondContact O-N 2.57Å; V404-I407 HydrophobicContact CB-CD1 4.39Å; V404-I407 HydrophobicContact CG1-CD1 4.1Å; V404-I407 WeakPolarHBondContact O-CB 3.32Å; V404-I407 WeakPolarHBondContact O-CG1 3.44Å; V404-I407 PolarHBondContact O-N 2.88Å; V404-I407 VanDerWaalsContact O-N 3.08Å
405	K	54.2	Low	52.9	Low	148 Å²	148	50.9 Å²	50.9	64%	0.643	29%	0.286	S	S	*	.	H	α-helix	trans	-60.2	-34.3	176.4	-75.3	-174	168.4	-179.8	0	112.6	T184 S403 I407	T184-K405 HydrophobicContact CG2-CD 4.04Å; T184-K405 HydrophobicContact CG2-CG 4.41Å; S403-K405 VanDerWaalsContact C-N 3.26Å; S403-K405 PolarHBondContact O-N 3.08Å; K405-I407 VanDerWaalsContact C-N 3.26Å; K405-I407 PolarHBondContact O-N 3.3Å
406	N	54.4	Low	50.8	Low	44 Å²	44	52.4 Å²	52.4	24%	0.235	31%	0.312	C	S	.	.	H	α-helix	trans	-78.6	-8.9	179.8	-71.4	-8.6	0	0	0	113	S403 V404 K410 D523	S403-N406 PolarHBondContact O-N 2.99Å; V404-N406 PolarHBondContact O-N 2.57Å; N406-K410 VanDerWaalsContact O-CB 3.29Å; N406-K410 WeakPolarHBondContact O-CB 3.34Å; N406-K410 VanDerWaalsContact O-CG 3.31Å; N406-K410 WeakPolarHBondContact O-CG 3.37Å; N406-K410 PolarHBondContact O-N 3.16Å; N406-D523 PolarHBondContact ND2-OD1 3.28Å
407	I	55.6	Low	49	Very low	7 Å²	7	55.2 Å²	55.2	4%	0.036	33%	0.332	C	S	.	.	H	α-helix	trans	-63.3	-52.8	176.3	-62.2	176.5	0	0	0	109.1	Y400 V404 K405 A409 K410 T411 L579 I584	Y400-I407 HydrophobicContact CD1-CD1 3.89Å; Y400-I407 HydrophobicContact CD1-CG1 4.39Å; Y400-I407 HydrophobicContact CE1-CD1 3.73Å; Y400-I407 HydrophobicContact CE1-CG1 3.72Å; V404-I407 HydrophobicContact CB-CD1 4.39Å; V404-I407 HydrophobicContact CG1-CD1 4.1Å; V404-I407 WeakPolarHBondContact O-CB 3.32Å; V404-I407 WeakPolarHBondContact O-CG1 3.44Å; V404-I407 PolarHBondContact O-N 2.88Å; V404-I407 VanDerWaalsContact O-N 3.08Å; K405-I407 VanDerWaalsContact C-N 3.26Å; K405-I407 PolarHBondContact O-N 3.3Å; I407-A409 VanDerWaalsContact C-N 3.31Å; I407-A409 PolarHBondContact O-N 3Å; I407-K410 PolarHBondContact O-N 3.2Å; I407-T411 HydrophobicContact CG2-CG2 3.75Å; I407-T411 WeakPolarHBondContact O-CB 3.44Å; I407-T411 WeakPolarHBondContact O-CG2 3.35Å; I407-T411 PolarHBondContact O-N 3.45Å; I407-T411 PolarHBondContact O-OG1 3.41Å; I407-L579 HydrophobicContact CG1-CD2 4.24Å; I407-I584 HydrophobicContact CD1-CD1 3.8Å; I407-I584 HydrophobicContact CD1-CG1 4.21Å
408	N	47.4	Very low	47.3	Very low	77 Å²	77	60 Å²	60	41%	0.412	36%	0.357	S	S	.	.	H	α-helix	trans	-58.5	-43.1	-177.6	-67	-0.2	0	0	0	112.1	K410 G412	N408-K410 VanDerWaalsContact C-N 3.34Å; N408-K410 PolarHBondContact O-N 3.36Å; N408-G412 PolarHBondContact O-N 3.44Å
409	A	47.7	Very low	45.2	Very low	85 Å²	85	64.7 Å²	64.7	70%	0.702	39%	0.389	S	S	*	.	H	α-helix	trans	-65.6	-32.9	177.1	0	0	0	0	0	113.3	I407	I407-A409 VanDerWaalsContact C-N 3.31Å; I407-A409 PolarHBondContact O-N 3Å
410	K	44.6	Very low	42.8	Very low	79 Å²	79	70.2 Å²	70.2	34%	0.343	42%	0.424	S	S	.	.	H	α-helix	trans	-92.2	-25.8	-177.7	-73.6	-177.7	176	-176.5	0	114.5	N406 I407 N408 G412 A522	N406-K410 VanDerWaalsContact O-CB 3.29Å; N406-K410 WeakPolarHBondContact O-CB 3.34Å; N406-K410 VanDerWaalsContact O-CG 3.31Å; N406-K410 WeakPolarHBondContact O-CG 3.37Å; N406-K410 PolarHBondContact O-N 3.16Å; I407-K410 PolarHBondContact O-N 3.2Å; N408-K410 VanDerWaalsContact C-N 3.34Å; N408-K410 PolarHBondContact O-N 3.36Å; K410-G412 VanDerWaalsContact C-N 3.3Å; K410-A522 WeakPolarHBondContact CE-O 3.29Å; K410-A522 PolarHBondContact NZ-O 3.35Å
411	T	44.8	Very low	40.5	Very low	49 Å²	49	73.2 Å²	73.2	30%	0.301	45%	0.449	S	S	.	.	H	α-helix	trans	-85.3	-4.5	178.5	56	0	0	0	0	112.6	I407 I413	I407-T411 HydrophobicContact CG2-CG2 3.75Å; I407-T411 WeakPolarHBondContact O-CB 3.44Å; I407-T411 WeakPolarHBondContact O-CG2 3.35Å; I407-T411 PolarHBondContact O-N 3.45Å; I407-T411 PolarHBondContact O-OG1 3.41Å; T411-I413 PolarHBondContact O-N 3.18Å; T411-I413 WeakPolarHBondContact OG1-CD1 3.16Å; T411-I413 WeakPolarHBondContact OG1-CG1 3.1Å
412	G	33.6	Very low	38.5	Very low	61 Å²	61	75.4 Å²	75.4	63%	0.629	47%	0.472	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.5	21.5	-178.5	0	0	0	0	0	113.2	N408 K410 T414	N408-G412 PolarHBondContact O-N 3.44Å; K410-G412 VanDerWaalsContact C-N 3.3Å; G412-T414 VanDerWaalsContact C-N 3.32Å; G412-T414 PolarHBondContact O-N 2.86Å
413	I	33	Very low	37	Very low	90 Å²	90	78.7 Å²	78.7	46%	0.462	49%	0.492	S	S	.	.			trans	-83.4	86.1	176.6	-58.9	173	0	0	0	106.1	T411	T411-I413 PolarHBondContact O-N 3.18Å; T411-I413 WeakPolarHBondContact OG1-CD1 3.16Å; T411-I413 WeakPolarHBondContact OG1-CG1 3.1Å
414	T	25.2	Very low	35.5	Very low	97 Å²	97	82.2 Å²	82.2	60%	0.595	51%	0.513	S	S	*	.			trans	-63	133.3	163.5	39.9	0	0	0	0	108.6	G412 G416	G412-T414 VanDerWaalsContact C-N 3.32Å; G412-T414 PolarHBondContact O-N 2.86Å; T414-G416 PolarHBondContact O-N 3.01Å
415	E	29.3	Very low	33.8	Very low	168 Å²	168	86.6 Å²	86.6	79%	0.785	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-8.5	-178.4	-73.1	176.1	156.2	0	0	114.5
416	G	25.5	Very low	32.7	Very low	68 Å²	68	81.8 Å²	81.8	70%	0.701	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.4	-9.3	-172.9	0	0	0	0	0	118.4	T414 I418	T414-G416 PolarHBondContact O-N 3.01Å; G416-I418 PolarHBondContact O-N 3.36Å
417	T	21.9	Very low	31.6	Very low	107 Å²	107	84.8 Å²	84.8	66%	0.656	54%	0.539	S	S	*	.			trans	-100.8	56.4	-176.5	-33.2	0	0	0	0	112
418	I	26.7	Very low	30.5	Very low	101 Å²	101	92.3 Å²	92.3	52%	0.518	57%	0.567	S	S	.	*			trans	-118.3	87.9	169.5	-57.6	178.2	0	0	0	107.4	G416 T420	G416-I418 PolarHBondContact O-N 3.36Å; I418-T420 PolarHBondContact O-N 3.08Å
419	S	23.6	Very low	29.9	Very low	98 Å²	98	96 Å²	96	69%	0.685	58%	0.582	S	S	*	*			trans	-65.3	115	172.9	-168.1	0	0	0	0	109.8	A421	S419-A421 PolarHBondContact O-N 3.42Å
420	T	22.5	Very low	29.4	Very low	129 Å²	129	95.3 Å²	95.3	79%	0.791	57%	0.566	S	S	*	*			trans	31.1	63.9	142	61.5	0	0	0	0	116.7	I418	I418-T420 PolarHBondContact O-N 3.08Å
421	A	23.9	Very low	29.2	Very low	65 Å²	65	92.2 Å²	92.2	54%	0.537	55%	0.554	S	S	.	*			trans	-82.2	122.9	157.5	0	0	0	0	0	107.9	S419	S419-A421 PolarHBondContact O-N 3.42Å
422	A	22.5	Very low	28.7	Very low	78 Å²	78	94.8 Å²	94.8	65%	0.645	56%	0.561	S	S	*	*			trans	-49	147	174.6	0	0	0	0	0	111	V424	A422-V424 PolarHBondContact O-N 2.89Å
423	P	23.4	Very low	29	Very low	77 Å²	77	94.9 Å²	94.9	50%	0.5	55%	0.552	S	S	.	*			trans	-54.7	115.5	178	19.6	-29.3	0	0	0	109.5	P39 T425	P39-P423 HydrophobicContact CB-CB 4.05Å; P423-T425 VanDerWaalsContact C-N 3.32Å; P423-T425 PolarHBondContact O-N 3.15Å
424	V	25.5	Very low	29.5	Very low	83 Å²	83	91.5 Å²	91.5	50%	0.503	54%	0.535	S	S	.	.			trans	-65.5	98.5	167.3	178.2	0	0	0	0	105.8	T42 A422 V426	T42-V424 WeakPolarHBondContact CG2-O 3.38Å; A422-V424 PolarHBondContact O-N 2.89Å; V424-V426 PolarHBondContact O-N 3.48Å
425	T	24.5	Very low	30.4	Very low	108 Å²	108	88.1 Å²	88.1	66%	0.663	51%	0.514	S	S	*	.			trans	-64.2	117.8	165.4	46.7	0	0	0	0	106.8	P423 D427	P423-T425 VanDerWaalsContact C-N 3.32Å; P423-T425 PolarHBondContact O-N 3.15Å; T425-D427 PolarHBondContact O-N 3.34Å
426	V	31.9	Very low	30.8	Very low	46 Å²	46	82 Å²	82	28%	0.279	49%	0.489	S	S	.	.			trans	-60	109.4	173.8	176.1	0	0	0	0	107	T42 V424 D430 V431	T42-V426 HydrophobicContact CG2-CG2 4.05Å; V424-V426 PolarHBondContact O-N 3.48Å; V426-D430 HydrophobicContact CG1-CB 3.62Å; V426-V431 HydrophobicContact CG1-CG2 3.89Å
427	D	29.5	Very low	31.5	Very low	108 Å²	108	83.4 Å²	83.4	58%	0.578	48%	0.479	S	S	*	.			trans	-74.1	158.6	178.4	-106.7	-34.5	0	0	0	110.3	T425 E429 D430	T425-D427 PolarHBondContact O-N 3.34Å; D427-E429 PolarHBondContact O-N 3.5Å; D427-D430 WeakPolarHBondContact O-CB 3.21Å; D427-D430 PolarHBondContact O-N 3.39Å
428	R	33.3	Very low	32.2	Very low	165 Å²	165	84.5 Å²	84.5	62%	0.623	48%	0.476	S	S	*	.	H	α-helix	trans	-46.6	-29.7	173.2	-109.3	179.1	175.6	178.2	0.4	113.8	E262 K432	E262-R428 WeakPolarHBondContact OE1-CG 3.23Å; E262-R428 IonicContact OE1-NE 2.7Å; R428-K432 WeakPolarHBondContact O-CB 3.37Å; R428-K432 WeakPolarHBondContact O-CG 3.34Å; R428-K432 PolarHBondContact O-N 2.89Å
429	E	35.1	Very low	32.8	Very low	155 Å²	155	86.5 Å²	86.5	72%	0.724	48%	0.481	S	S	*	.	H	α-helix	trans	-72	-32.9	178.4	-70.7	-172.2	157.8	0	0	113	D427 K432 S433	D427-E429 PolarHBondContact O-N 3.5Å; E429-K432 PolarHBondContact O-N 3.38Å; E429-S433 VanDerWaalsContact O-CB 3.28Å; E429-S433 WeakPolarHBondContact O-CB 3.42Å; E429-S433 PolarHBondContact O-N 3.47Å
430	D	37.5	Very low	33.9	Very low	70 Å²	70	87.2 Å²	87.2	37%	0.374	48%	0.482	S	S	.	.	H	α-helix	trans	-70.1	-45.2	178.6	-76.1	-31.1	0	0	0	110.6	V426 D427 K432 S433 I434	V426-D430 HydrophobicContact CG1-CB 3.62Å; D427-D430 WeakPolarHBondContact O-CB 3.21Å; D427-D430 PolarHBondContact O-N 3.39Å; D430-K432 VanDerWaalsContact C-N 3.35Å; D430-K432 PolarHBondContact O-N 2.94Å; D430-S433 PolarHBondContact O-N 3.47Å; D430-S433 VanDerWaalsContact O-N 3.09Å; D430-S433 PolarHBondContact O-OG 2.78Å; D430-I434 WeakPolarHBondContact O-CB 3.36Å; D430-I434 WeakPolarHBondContact O-CD1 3.33Å; D430-I434 WeakPolarHBondContact O-CG1 3.16Å; D430-I434 PolarHBondContact O-N 3.19Å
431	V	39.8	Very low	35.3	Very low	14 Å²	14	83.6 Å²	83.6	9%	0.085	46%	0.456	C	S	.	.	H	α-helix	trans	-62.7	-42.6	175.1	-174.9	0	0	0	0	110.7	M258 V426 S433 I434 V435	M258-V431 HydrophobicContact CE-CG2 3.87Å; V426-V431 HydrophobicContact CG1-CG2 3.89Å; V431-S433 VanDerWaalsContact C-N 3.35Å; V431-S433 PolarHBondContact O-N 3.06Å; V431-I434 PolarHBondContact O-N 3.21Å; V431-V435 HydrophobicContact CG1-CG2 4.18Å; V431-V435 WeakPolarHBondContact O-CB 3.37Å; V431-V435 VanDerWaalsContact O-CG2 3.29Å; V431-V435 WeakPolarHBondContact O-CG2 3.13Å; V431-V435 PolarHBondContact O-N 2.81Å
432	K	33.7	Very low	37.4	Very low	103 Å²	103	83.6 Å²	83.6	45%	0.448	45%	0.449	S	S	.	.	H	α-helix	trans	-61.4	-41.1	171.3	-78.3	-175.6	-171.4	-174.4	0	111.6	F276 R428 E429 D430 I434 C436	F276-K432 HydrophobicContact CE1-CG 4.3Å; F276-K432 HydrophobicContact CZ-CD 4.26Å; F276-K432 HydrophobicContact CZ-CG 4.24Å; R428-K432 WeakPolarHBondContact O-CB 3.37Å; R428-K432 WeakPolarHBondContact O-CG 3.34Å; R428-K432 PolarHBondContact O-N 2.89Å; E429-K432 PolarHBondContact O-N 3.38Å; D430-K432 VanDerWaalsContact C-N 3.35Å; D430-K432 PolarHBondContact O-N 2.94Å; K432-I434 VanDerWaalsContact C-N 3.31Å; K432-I434 PolarHBondContact O-N 3.47Å; K432-C436 WeakPolarHBondContact O-CA 3.39Å; K432-C436 WeakPolarHBondContact O-CB 3.44Å; K432-C436 PolarHBondContact O-N 3.32Å; K432-C436 PolarHBondContact O-SG 2.92Å
433	S	40.4	Very low	40	Very low	63 Å²	63	86 Å²	86	44%	0.441	44%	0.442	S	S	.	.	H	α-helix	trans	-66.4	-34.8	179.5	81.3	0	0	0	0	112.5	E429 D430 V431 M437	E429-S433 VanDerWaalsContact O-CB 3.28Å; E429-S433 WeakPolarHBondContact O-CB 3.42Å; E429-S433 PolarHBondContact O-N 3.47Å; D430-S433 PolarHBondContact O-N 3.47Å; D430-S433 VanDerWaalsContact O-N 3.09Å; D430-S433 PolarHBondContact O-OG 2.78Å; V431-S433 VanDerWaalsContact C-N 3.35Å; V431-S433 PolarHBondContact O-N 3.06Å; S433-M437 VanDerWaalsContact O-CG 3.31Å; S433-M437 WeakPolarHBondContact O-CG 3.35Å; S433-M437 PolarHBondContact O-N 2.9Å
434	I	44.9	Very low	42.7	Very low	19 Å²	19	90.7 Å²	90.7	10%	0.097	45%	0.449	C	S	.	.	H	α-helix	trans	-74.4	-48.2	178.6	-68.4	164.1	0	0	0	110.6	L47 D430 V431 K432 M437	L47-I434 HydrophobicContact CD2-CG2 3.46Å; L47-I434 VanDerWaalsContact CD2-CG2 3.46Å; D430-I434 WeakPolarHBondContact O-CB 3.36Å; D430-I434 WeakPolarHBondContact O-CD1 3.33Å; D430-I434 WeakPolarHBondContact O-CG1 3.16Å; D430-I434 PolarHBondContact O-N 3.19Å; V431-I434 PolarHBondContact O-N 3.21Å; K432-I434 VanDerWaalsContact C-N 3.31Å; K432-I434 PolarHBondContact O-N 3.47Å; I434-M437 VanDerWaalsContact O-CB 3.28Å; I434-M437 WeakPolarHBondContact O-CB 3.42Å; I434-M437 WeakPolarHBondContact O-CG 3.21Å; I434-M437 PolarHBondContact O-N 2.93Å
435	V	43.6	Very low	45.2	Very low	26 Å²	26	91 Å²	91	16%	0.158	45%	0.445	C	S	.	.	H	α-helix	trans	-72.7	-36	178.7	177.4	0	0	0	0	111.1	V277 V431 M437	V277-V435 HydrophobicContact CG1-CG1 4.15Å; V277-V435 HydrophobicContact CG2-CG1 4.11Å; V431-V435 HydrophobicContact CG1-CG2 4.18Å; V431-V435 WeakPolarHBondContact O-CB 3.37Å; V431-V435 VanDerWaalsContact O-CG2 3.29Å; V431-V435 WeakPolarHBondContact O-CG2 3.13Å; V431-V435 PolarHBondContact O-N 2.81Å; V435-M437 PolarHBondContact O-N 3.16Å
436	C	37.3	Very low	47.5	Very low	40 Å²	40	86 Å²	86	27%	0.27	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-80.9	17.6	171	-59.6	0	0	0	0	113.1	K432 E438 K439	K432-C436 WeakPolarHBondContact O-CA 3.39Å; K432-C436 WeakPolarHBondContact O-CB 3.44Å; K432-C436 PolarHBondContact O-N 3.32Å; K432-C436 PolarHBondContact O-SG 2.92Å; C436-E438 CarbonylContact O-C 3.43Å; C436-E438 PolarHBondContact O-N 2.99Å; C436-K439 PolarHBondContact O-N 3.34Å
437	M	40.1	Very low	49.7	Very low	97 Å²	97	85.1 Å²	85.1	48%	0.478	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-61.6	-2	163.1	-77.6	-142.5	161.1	0	0	112.9	S433 I434 V435 K439	S433-M437 VanDerWaalsContact O-CG 3.31Å; S433-M437 WeakPolarHBondContact O-CG 3.35Å; S433-M437 PolarHBondContact O-N 2.9Å; I434-M437 VanDerWaalsContact O-CB 3.28Å; I434-M437 WeakPolarHBondContact O-CB 3.42Å; I434-M437 WeakPolarHBondContact O-CG 3.21Å; I434-M437 PolarHBondContact O-N 2.93Å; V435-M437 PolarHBondContact O-N 3.16Å; M437-K439 PolarHBondContact O-N 3.09Å
438	E	36.6	Very low	52.2	Low	130 Å²	130	86.3 Å²	86.3	61%	0.607	41%	0.408	S	S	*	.	G	3₁₀ helix	trans	-74.1	20.8	156.7	-146	-177.6	-170	0	0	114	A281 C436 T440	A281-E438 WeakPolarHBondContact CB-OE2 3.1Å; C436-E438 CarbonylContact O-C 3.43Å; C436-E438 PolarHBondContact O-N 2.99Å; E438-T440 PolarHBondContact O-N 3.09Å
439	K	40.3	Very low	54.3	Low	143 Å²	143	82.4 Å²	82.4	62%	0.622	40%	0.397	S	S	*	.	S	Bend	trans	-57.2	97	139.4	-79.7	-170.9	-177.3	176.2	0	104.6	C436 M437 H441	C436-K439 PolarHBondContact O-N 3.34Å; M437-K439 PolarHBondContact O-N 3.09Å; K439-H441 WeakPolarHBondContact O-CA 3.47Å; K439-H441 PolarHBondContact O-N 3.37Å
440	T	46.3	Very low	56.4	Low	113 Å²	113	75 Å²	75	69%	0.693	36%	0.363	S	S	*	.			trans	-47.5	87.3	162.2	35.8	0	0	0	0	105.9	E438 T442	E438-T440 PolarHBondContact O-N 3.09Å; T440-T442 PolarHBondContact O-N 3.49Å
441	H	51.4	Low	58.5	Low	53 Å²	53	74.1 Å²	74.1	25%	0.245	36%	0.359	C	S	.	.			trans	-70.4	94.7	-173.1	-151	-85.8	0	0	0	102.5	K439 W443 Q445 S446 Q449	K439-H441 WeakPolarHBondContact O-CA 3.47Å; K439-H441 PolarHBondContact O-N 3.37Å; H441-W443 PolarHBondContact O-N 2.89Å; H441-Q445 VanDerWaalsContact CE1-C 3.49Å; H441-Q445 WeakPolarHBondContact CE1-CB 3.18Å; H441-Q445 WeakPolarHBondContact ND1-CB 3.32Å; H441-S446 PolarHBondContact ND1-N 2.86Å; H441-S446 PolarHBondContact ND1-OG 3.37Å; H441-Q449 PolarHBondContact CE1-NE2 3.34Å; H441-Q449 VanDerWaalsContact CE1-NE2 3.27Å; H441-Q449 PolarHBondContact CE1-OE1 3.38Å; H441-Q449 PolarHBondContact NE2-NE2 3.35Å; H441-Q449 PolarHBondContact NE2-OE1 3Å
442	T	68.1	Low	60.6	Low	65 Å²	65	78.9 Å²	78.9	40%	0.399	38%	0.381	S	S	.	.			trans	-54.5	140.6	-174.5	55.9	0	0	0	0	105.9	T440 R444 Q445 S446	T440-T442 PolarHBondContact O-N 3.49Å; T442-R444 CarbonylContact O-C 3.5Å; T442-R444 PolarHBondContact O-N 3.03Å; T442-Q445 PolarHBondContact O-N 2.97Å; T442-S446 PolarHBondContact O-N 2.86Å
443	W	76.4	Confident	62.8	Low	129 Å²	129	76.7 Å²	76.7	49%	0.489	37%	0.372	S	S	.	.	H	α-helix	trans	-48.3	-30	-179.8	59.9	-92.7	0	0	0	111.7	A125 F126 H441 S446 I447	A125-W443 HydrophobicContact CB-CB 4.46Å; F126-W443 HydrophobicContact CE1-CB 4.36Å; F126-W443 HydrophobicContact CZ-CB 3.99Å; F126-W443 HydrophobicContact CZ-CD2 4.4Å; F126-W443 HydrophobicContact CZ-CE3 4.38Å; F126-W443 HydrophobicContact CZ-CG 4.25Å; H441-W443 PolarHBondContact O-N 2.89Å; W443-S446 PolarHBondContact O-N 2.73Å; W443-I447 HydrophobicContact CE3-CD1 3.56Å; W443-I447 HydrophobicContact CZ3-CD1 3.81Å; W443-I447 WeakPolarHBondContact O-CB 3.37Å; W443-I447 VanDerWaalsContact O-CG1 3.28Å; W443-I447 WeakPolarHBondContact O-CG1 3.38Å; W443-I447 PolarHBondContact O-N 2.99Å
444	R	81.1	Confident	64.7	Low	174 Å²	174	73.9 Å²	73.9	66%	0.657	35%	0.352	S	S	*	.	H	α-helix	trans	-59.1	-46.5	171.1	-63.1	-174.6	178.3	-166.2	-0.5	114.4	T442 I447 K448	T442-R444 CarbonylContact O-C 3.5Å; T442-R444 PolarHBondContact O-N 3.03Å; R444-I447 PolarHBondContact O-N 3.27Å; R444-K448 WeakPolarHBondContact O-CB 3.47Å; R444-K448 PolarHBondContact O-N 3.03Å
445	Q	76.9	Confident	66.7	Low	89 Å²	89	75.6 Å²	75.6	42%	0.416	36%	0.361	S	S	.	.	H	α-helix	trans	-68.5	-38.6	177.4	-71.4	172.7	-22.3	0	0	111.2	H441 T442 I447 K448 Q449	H441-Q445 VanDerWaalsContact CE1-C 3.49Å; H441-Q445 WeakPolarHBondContact CE1-CB 3.18Å; H441-Q445 WeakPolarHBondContact ND1-CB 3.32Å; T442-Q445 PolarHBondContact O-N 2.97Å; Q445-I447 VanDerWaalsContact C-N 3.31Å; Q445-I447 PolarHBondContact O-N 2.84Å; Q445-K448 PolarHBondContact O-N 3.34Å; Q445-Q449 WeakPolarHBondContact O-CB 3.25Å; Q445-Q449 WeakPolarHBondContact O-CG 3.36Å; Q445-Q449 PolarHBondContact O-N 3.15Å
446	S	72.7	Confident	68.8	Low	3 Å²	3	76.4 Å²	76.4	2%	0.021	37%	0.365	C	S	.	.	H	α-helix	trans	-63.3	-39.2	175.6	-58	0	0	0	0	111.6	R391 H441 T442 W443 A450	R391-S446 PolarHBondContact NH1-OG 3.37Å; R391-S446 VanDerWaalsContact NH1-OG 3.16Å; H441-S446 PolarHBondContact ND1-N 2.86Å; H441-S446 PolarHBondContact ND1-OG 3.37Å; T442-S446 PolarHBondContact O-N 2.86Å; W443-S446 PolarHBondContact O-N 2.73Å; S446-A450 WeakPolarHBondContact O-CB 3.25Å; S446-A450 PolarHBondContact O-N 2.87Å; S446-A450 VanDerWaalsContact O-N 3.16Å
447	I	79.2	Confident	71.4	Confident	29 Å²	29	80.1 Å²	80.1	15%	0.149	38%	0.376	C	S	.	.	H	α-helix	trans	-65.9	-50.2	173.2	-73.1	174.8	0	0	0	110.6	A121 F122 A125 W443 R444 Q445 Q449 A450 V451	A121-I447 HydrophobicContact CB-CB 4.23Å; A121-I447 HydrophobicContact CB-CG1 4.28Å; A121-I447 HydrophobicContact CB-CG2 3.9Å; F122-I447 HydrophobicContact CD1-CD1 4.16Å; F122-I447 HydrophobicContact CE1-CD1 3.88Å; F122-I447 HydrophobicContact CZ-CD1 4.1Å; A125-I447 HydrophobicContact CB-CG1 4.29Å; W443-I447 HydrophobicContact CE3-CD1 3.56Å; W443-I447 HydrophobicContact CZ3-CD1 3.81Å; W443-I447 WeakPolarHBondContact O-CB 3.37Å; W443-I447 VanDerWaalsContact O-CG1 3.28Å; W443-I447 WeakPolarHBondContact O-CG1 3.38Å; W443-I447 PolarHBondContact O-N 2.99Å; R444-I447 PolarHBondContact O-N 3.27Å; Q445-I447 VanDerWaalsContact C-N 3.31Å; Q445-I447 PolarHBondContact O-N 2.84Å; I447-Q449 PolarHBondContact O-N 2.9Å; I447-A450 PolarHBondContact O-N 2.99Å; I447-A450 VanDerWaalsContact O-N 3.16Å; I447-V451 HydrophobicContact CG2-CG2 4.32Å; I447-V451 WeakPolarHBondContact O-CG2 3.36Å; I447-V451 PolarHBondContact O-N 3.46Å
448	K	81.2	Confident	73.9	Confident	132 Å²	132	83.4 Å²	83.4	57%	0.574	39%	0.388	S	S	*	.	H	α-helix	trans	-56.3	-49.3	-178.6	-178.4	177.7	171.7	179.7	0	111.7	R444 Q445 A450 V451 E452	R444-K448 WeakPolarHBondContact O-CB 3.47Å; R444-K448 PolarHBondContact O-N 3.03Å; Q445-K448 PolarHBondContact O-N 3.34Å; K448-A450 VanDerWaalsContact C-N 3.34Å; K448-A450 PolarHBondContact O-N 3.46Å; K448-V451 PolarHBondContact O-N 2.96Å; K448-E452 WeakPolarHBondContact CE-OE1 3.37Å; K448-E452 IonicContact NZ-OE1 2.9Å; K448-E452 WeakPolarHBondContact O-CG 3.14Å; K448-E452 PolarHBondContact O-N 3.21Å
449	Q	77.3	Confident	76.5	Confident	83 Å²	83	77.4 Å²	77.4	39%	0.388	36%	0.36	S	S	.	.	H	α-helix	trans	-61.3	-41.8	177.6	-76.5	175.5	-6.4	0	0	112.4	H441 Q445 I447 E452 Q453	H441-Q449 PolarHBondContact CE1-NE2 3.34Å; H441-Q449 VanDerWaalsContact CE1-NE2 3.27Å; H441-Q449 PolarHBondContact CE1-OE1 3.38Å; H441-Q449 PolarHBondContact NE2-NE2 3.35Å; H441-Q449 PolarHBondContact NE2-OE1 3Å; Q445-Q449 WeakPolarHBondContact O-CB 3.25Å; Q445-Q449 WeakPolarHBondContact O-CG 3.36Å; Q445-Q449 PolarHBondContact O-N 3.15Å; I447-Q449 PolarHBondContact O-N 2.9Å; Q449-E452 PolarHBondContact O-N 3.04Å; Q449-Q453 WeakPolarHBondContact O-CB 3.27Å; Q449-Q453 PolarHBondContact O-N 3.19Å
450	A	79.1	Confident	79	Confident	1 Å²	1	72.5 Å²	72.5	1%	0.008	34%	0.34	C	S	.	.	H	α-helix	trans	-65.7	-40.2	178.5	0	0	0	0	0	112	A121 N124 L393 S446 I447 K448 Q453 L454	A121-A450 VanDerWaalsContact CA-CB 3.48Å; A121-A450 HydrophobicContact CB-CB 3.7Å; N124-A450 HydrophobicContact CB-CB 4.21Å; L393-A450 HydrophobicContact CD1-CB 4.12Å; S446-A450 WeakPolarHBondContact O-CB 3.25Å; S446-A450 PolarHBondContact O-N 2.87Å; S446-A450 VanDerWaalsContact O-N 3.16Å; I447-A450 PolarHBondContact O-N 2.99Å; I447-A450 VanDerWaalsContact O-N 3.16Å; K448-A450 VanDerWaalsContact C-N 3.34Å; K448-A450 PolarHBondContact O-N 3.46Å; A450-Q453 PolarHBondContact O-N 3.26Å; A450-L454 WeakPolarHBondContact O-CB 3.46Å; A450-L454 VanDerWaalsContact O-CD1 3.23Å; A450-L454 WeakPolarHBondContact O-CD1 3.38Å; A450-L454 WeakPolarHBondContact O-CG 3.11Å; A450-L454 PolarHBondContact O-N 3.21Å
451	V	82.8	Confident	81.3	Confident	50 Å²	50	78 Å²	78	30%	0.303	35%	0.349	S	S	.	.	H	α-helix	trans	-64.3	-44.4	174.7	175.1	0	0	0	0	111.1	A121 I447 K448 Q453 L454 I455	A121-V451 HydrophobicContact CB-CG2 3.79Å; I447-V451 HydrophobicContact CG2-CG2 4.32Å; I447-V451 WeakPolarHBondContact O-CG2 3.36Å; I447-V451 PolarHBondContact O-N 3.46Å; K448-V451 PolarHBondContact O-N 2.96Å; V451-Q453 VanDerWaalsContact C-N 3.28Å; V451-Q453 PolarHBondContact O-N 2.82Å; V451-L454 PolarHBondContact O-N 2.88Å; V451-I455 HydrophobicContact CG1-CD1 4Å; V451-I455 PolarHBondContact O-N 3.37Å
452	E	82.6	Confident	83.3	Confident	114 Å²	114	76.3 Å²	76.3	53%	0.533	34%	0.342	S	S	.	.	H	α-helix	trans	-61.4	-36.8	175.8	-73.9	172.7	175.7	0	0	112.1	K448 Q449	K448-E452 WeakPolarHBondContact CE-OE1 3.37Å; K448-E452 IonicContact NZ-OE1 2.9Å; K448-E452 WeakPolarHBondContact O-CG 3.14Å; K448-E452 PolarHBondContact O-N 3.21Å; Q449-E452 PolarHBondContact O-N 3.04Å
453	Q	80.2	Confident	84.6	Confident	57 Å²	57	75.6 Å²	75.6	27%	0.266	34%	0.339	S	S	.	.	H	α-helix	trans	-72.2	-36	175.6	-170.8	-175.5	-2.8	0	0	112.2	L393 Q449 A450 V451 S589	L393-Q453 PolarHBondContact O-NE2 3.2Å; L393-Q453 PolarHBondContact O-OE1 3.24Å; Q449-Q453 WeakPolarHBondContact O-CB 3.27Å; Q449-Q453 PolarHBondContact O-N 3.19Å; A450-Q453 PolarHBondContact O-N 3.26Å; V451-Q453 VanDerWaalsContact C-N 3.28Å; V451-Q453 PolarHBondContact O-N 2.82Å; Q453-S589 WeakPolarHBondContact O-CA 3.43Å; Q453-S589 WeakPolarHBondContact O-CB 3.2Å; Q453-S589 PolarHBondContact O-OG 3.35Å
454	L	81.8	Confident	85.5	Confident	5 Å²	5	69.4 Å²	69.4	3%	0.026	32%	0.315	C	S	.	.	H	α-helix	trans	-78.9	-27.4	-178.6	-71	158	0	0	0	112.6	P117 L393 A450 V451 T588	P117-L454 HydrophobicContact CB-CB 3.98Å; P117-L454 HydrophobicContact CB-CD1 4.25Å; P117-L454 WeakPolarHBondContact O-CD1 3.17Å; L393-L454 HydrophobicContact CD1-CD1 3.69Å; L393-L454 HydrophobicContact CD1-CD2 4.41Å; L393-L454 HydrophobicContact CD1-CG 4.29Å; A450-L454 WeakPolarHBondContact O-CB 3.46Å; A450-L454 VanDerWaalsContact O-CD1 3.23Å; A450-L454 WeakPolarHBondContact O-CD1 3.38Å; A450-L454 WeakPolarHBondContact O-CG 3.11Å; A450-L454 PolarHBondContact O-N 3.21Å; V451-L454 PolarHBondContact O-N 2.88Å; L454-T588 HydrophobicContact CD2-CG2 3.74Å
455	I	86.4	Confident	86.1	Confident	54 Å²	54	61.1 Å²	61.1	28%	0.277	28%	0.284	S	S	.	.			trans	-116.5	72.9	-176.7	-50	-179.4	0	0	0	110	P117 V451 F457 L593	P117-I455 HydrophobicContact CB-CD1 4.31Å; P117-I455 HydrophobicContact CB-CG1 4.24Å; V451-I455 HydrophobicContact CG1-CD1 4Å; V451-I455 PolarHBondContact O-N 3.37Å; I455-F457 HydrophobicContact CG2-CD2 3.84Å; I455-F457 HydrophobicContact CG2-CE1 4.31Å; I455-F457 HydrophobicContact CG2-CE2 3.27Å; I455-F457 HydrophobicContact CG2-CZ 3.54Å; I455-L593 HydrophobicContact CG2-CD2 4.31Å
456	D	87.2	Confident	87.1	Confident	44 Å²	44	60.7 Å²	60.7	24%	0.235	28%	0.284	C	S	.	.			trans	-99.6	88.9	172.3	-174.3	7.6	0	0	0	111.7	K458 L459 L593	D456-K458 PolarHBondContact O-N 3.24Å; D456-K458 WeakPolarHBondContact OD1-CB 3.35Å; D456-K458 VanDerWaalsContact OD1-CG 3.25Å; D456-K458 WeakPolarHBondContact OD1-CG 3.22Å; D456-K458 PolarHBondContact OD1-N 3.14Å; D456-L459 WeakPolarHBondContact O-CB 3.22Å; D456-L459 PolarHBondContact O-N 3.01Å; D456-L459 VanDerWaalsContact O-N 3.12Å; D456-L593 WeakPolarHBondContact O-CD1 3.3Å
457	F	92.7	Very high	88.2	Confident	117 Å²	117	63 Å²	63	51%	0.513	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-60.9	-13.2	177.6	-69	-70.5	0	0	0	114.2	I455 L459 L460 L593 L596	I455-F457 HydrophobicContact CG2-CD2 3.84Å; I455-F457 HydrophobicContact CG2-CE1 4.31Å; I455-F457 HydrophobicContact CG2-CE2 3.27Å; I455-F457 HydrophobicContact CG2-CZ 3.54Å; F457-L459 PolarHBondContact O-N 3.23Å; F457-L460 HydrophobicContact CD1-CD1 3.85Å; F457-L460 PolarHBondContact O-N 2.95Å; F457-L460 VanDerWaalsContact O-N 3.09Å; F457-L593 HydrophobicContact CD1-CD2 3.83Å; F457-L593 HydrophobicContact CE1-CD2 3.81Å; F457-L596 HydrophobicContact CE1-CD2 4.36Å; F457-L596 HydrophobicContact CZ-CD2 4.31Å
458	K	91.7	Very high	89	Confident	166 Å²	166	61.8 Å²	61.8	72%	0.722	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-60.6	-25.2	173.7	-63.2	173.2	-179	171.8	0	111.9	D456 L460 R461	D456-K458 PolarHBondContact O-N 3.24Å; D456-K458 WeakPolarHBondContact OD1-CB 3.35Å; D456-K458 VanDerWaalsContact OD1-CG 3.25Å; D456-K458 WeakPolarHBondContact OD1-CG 3.22Å; D456-K458 PolarHBondContact OD1-N 3.14Å; K458-L460 VanDerWaalsContact C-N 3.28Å; K458-L460 PolarHBondContact O-N 2.69Å; K458-R461 WeakPolarHBondContact O-CB 3.29Å; K458-R461 PolarHBondContact O-N 3.04Å; K458-R461 VanDerWaalsContact O-N 3.15Å
459	L	90.4	Very high	89.7	Confident	4 Å²	4	55.8 Å²	55.8	2%	0.021	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-61.8	-33.3	175.4	-78.2	170.9	0	0	0	113.3	D456 F457 R461 S462 F465 V582 R586 A590 L593	D456-L459 WeakPolarHBondContact O-CB 3.22Å; D456-L459 PolarHBondContact O-N 3.01Å; D456-L459 VanDerWaalsContact O-N 3.12Å; F457-L459 PolarHBondContact O-N 3.23Å; L459-R461 PolarHBondContact O-N 2.96Å; L459-R461 VanDerWaalsContact O-N 3.08Å; L459-S462 WeakPolarHBondContact O-CB 3.34Å; L459-S462 PolarHBondContact O-N 3.38Å; L459-F465 HydrophobicContact CB-CD1 3.87Å; L459-F465 HydrophobicContact CB-CE1 3.77Å; L459-F465 WeakPolarHBondContact O-CD1 3.4Å; L459-V582 HydrophobicContact CD2-CB 4.22Å; L459-V582 HydrophobicContact CD2-CG1 3.93Å; L459-R586 HydrophobicContact CD2-CB 3.96Å; L459-R586 HydrophobicContact CD2-CG 4.46Å; L459-A590 HydrophobicContact CD1-CB 3.87Å; L459-A590 VanDerWaalsContact CD1-N 3.35Å; L459-L593 HydrophobicContact CB-CD1 3.87Å; L459-L593 HydrophobicContact CD1-CD1 4.22Å
460	L	94.3	Very high	90.6	Very high	40 Å²	40	54.4 Å²	54.4	21%	0.209	26%	0.264	C	S	.	.	G	3₁₀ helix	trans	-66.8	-9.6	177.6	-62.6	179.6	0	0	0	113.1	F457 K458 S462 F465 L466 V469 L593 F597	F457-L460 HydrophobicContact CD1-CD1 3.85Å; F457-L460 PolarHBondContact O-N 2.95Å; F457-L460 VanDerWaalsContact O-N 3.09Å; K458-L460 VanDerWaalsContact C-N 3.28Å; K458-L460 PolarHBondContact O-N 2.69Å; L460-S462 VanDerWaalsContact C-N 3.31Å; L460-F465 HydrophobicContact CD2-CD1 4.25Å; L460-F465 HydrophobicContact CD2-CE1 4.01Å; L460-L466 HydrophobicContact CB-CD1 4.49Å; L460-L466 HydrophobicContact CD2-CD1 4.31Å; L460-V469 HydrophobicContact CD2-CG1 4.45Å; L460-V469 HydrophobicContact CD2-CG2 4.41Å; L460-L593 HydrophobicContact CD2-CD1 4.32Å; L460-L593 HydrophobicContact CG-CD1 4.17Å; L460-F597 HydrophobicContact CD1-CE2 3.97Å; L460-F597 HydrophobicContact CD1-CZ 3.99Å; L460-F597 HydrophobicContact CD2-CE2 4.11Å
461	R	93.6	Very high	91.4	Very high	230 Å²	230	54.7 Å²	54.7	87%	0.868	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-75.2	-20.8	171.8	-165.5	173.8	-178.6	169.5	2.1	112.7	K458 L459 P463	K458-R461 WeakPolarHBondContact O-CB 3.29Å; K458-R461 PolarHBondContact O-N 3.04Å; K458-R461 VanDerWaalsContact O-N 3.15Å; L459-R461 PolarHBondContact O-N 2.96Å; L459-R461 VanDerWaalsContact O-N 3.08Å; R461-P463 VanDerWaalsContact O-CD 3.28Å; R461-P463 WeakPolarHBondContact O-CD 3Å
462	S	93.8	Very high	92	Very high	17 Å²	17	52.7 Å²	52.7	12%	0.119	25%	0.254	C	S	.	.	S	Bend	trans	-72.4	117.3	173.7	168	0	0	0	0	109.4	L459 L460 S464 F465 L466 E647	L459-S462 WeakPolarHBondContact O-CB 3.34Å; L459-S462 PolarHBondContact O-N 3.38Å; L460-S462 VanDerWaalsContact C-N 3.31Å; S462-S464 VanDerWaalsContact C-N 3.29Å; S462-S464 PolarHBondContact O-N 3.12Å; S462-F465 PolarHBondContact O-N 3.4Å; S462-F465 PolarHBondContact OG-N 3.12Å; S462-L466 WeakPolarHBondContact O-CB 3.44Å; S462-L466 PolarHBondContact O-N 2.91Å; S462-E647 WeakPolarHBondContact CA-OE1 3.13Å; S462-E647 WeakPolarHBondContact CB-OE1 3.34Å; S462-E647 VanDerWaalsContact OG-CD 3.24Å; S462-E647 PolarHBondContact OG-OE1 3.17Å; S462-E647 PolarHBondContact OG-OE2 3.01Å
463	P	95	Very high	92.6	Very high	49 Å²	49	49.8 Å²	49.8	32%	0.318	24%	0.24	S	C	.	.	H	α-helix	trans	-60	-38	-178.9	-28.5	40	0	0	0	113	R461 L466 L467 L643 W646 E647	R461-P463 VanDerWaalsContact O-CD 3.28Å; R461-P463 WeakPolarHBondContact O-CD 3Å; P463-L466 PolarHBondContact O-N 3.46Å; P463-L467 WeakPolarHBondContact O-CB 3.36Å; P463-L467 PolarHBondContact O-N 3.42Å; P463-L643 HydrophobicContact CB-CD1 4.11Å; P463-L643 HydrophobicContact CB-CD2 4.15Å; P463-L643 HydrophobicContact CB-CG 4.29Å; P463-L643 WeakPolarHBondContact O-CD2 3.34Å; P463-W646 HydrophobicContact CB-CZ3 4.5Å; P463-W646 HydrophobicContact CG-CZ3 4.14Å; P463-E647 WeakPolarHBondContact CD-OE1 3.24Å
464	S	94.5	Very high	93.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-66.9	-44.8	178.8	-47.7	0	0	0	0	111.3	S462 L467 F468 L640 L643 L644 E647	S462-S464 VanDerWaalsContact C-N 3.29Å; S462-S464 PolarHBondContact O-N 3.12Å; S464-L467 PolarHBondContact O-N 3.15Å; S464-F468 WeakPolarHBondContact O-CB 3.27Å; S464-F468 PolarHBondContact O-N 3.03Å; S464-L640 VanDerWaalsContact O-CD1 3.26Å; S464-L640 WeakPolarHBondContact O-CD1 3.32Å; S464-L643 PolarHBondContact OG-O 2.83Å; S464-L644 VanDerWaalsContact OG-CA 3.29Å; S464-L644 WeakPolarHBondContact OG-CA 3.12Å; S464-L644 PolarHBondContact OG-N 3.09Å; S464-E647 WeakPolarHBondContact CB-OE2 3.4Å; S464-E647 PolarHBondContact N-OE2 2.92Å; S464-E647 VanDerWaalsContact N-OE2 3.14Å; S464-E647 PolarHBondContact OG-OE2 3.17Å
465	F	95.5	Very high	94	Very high	0 Å²	0	49.9 Å²	49.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-66.5	-40	176.5	-175.6	-111.1	0	0	0	112.2	L459 L460 S462 L467 F468 V469 T578 V582 A590 L593 L594	L459-F465 HydrophobicContact CB-CD1 3.87Å; L459-F465 HydrophobicContact CB-CE1 3.77Å; L459-F465 WeakPolarHBondContact O-CD1 3.4Å; L460-F465 HydrophobicContact CD2-CD1 4.25Å; L460-F465 HydrophobicContact CD2-CE1 4.01Å; S462-F465 PolarHBondContact O-N 3.4Å; S462-F465 PolarHBondContact OG-N 3.12Å; F465-L467 PolarHBondContact O-N 3.31Å; F465-F468 PolarHBondContact O-N 3.01Å; F465-V469 HydrophobicContact CD1-CG2 3.95Å; F465-V469 HydrophobicContact CD2-CG2 4.16Å; F465-V469 HydrophobicContact CE1-CG2 3.51Å; F465-V469 HydrophobicContact CE2-CG2 3.72Å; F465-V469 HydrophobicContact CG-CG2 4.27Å; F465-V469 HydrophobicContact CZ-CG2 3.38Å; F465-V469 WeakPolarHBondContact O-CB 3.39Å; F465-V469 VanDerWaalsContact O-CG2 3.32Å; F465-V469 WeakPolarHBondContact O-CG2 3.42Å; F465-V469 PolarHBondContact O-N 3.02Å; F465-T578 HydrophobicContact CE2-CG2 4.31Å; F465-V582 HydrophobicContact CB-CG1 4.14Å; F465-V582 HydrophobicContact CD2-CG1 3.57Å; F465-V582 HydrophobicContact CE2-CG1 4.16Å; F465-V582 HydrophobicContact CG-CG1 3.89Å; F465-A590 HydrophobicContact CD2-CB 4.49Å; F465-A590 HydrophobicContact CE2-CB 3.63Å; F465-A590 HydrophobicContact CZ-CB 3.73Å; F465-L593 HydrophobicContact CE1-CB 4.49Å; F465-L593 HydrophobicContact CE1-CD1 3.92Å; F465-L593 HydrophobicContact CZ-CB 4.37Å; F465-L593 HydrophobicContact CZ-CD1 4.46Å; F465-L594 HydrophobicContact CE2-CD1 4.35Å; F465-L594 HydrophobicContact CE2-CG 4.36Å; F465-L594 HydrophobicContact CZ-CG 4.4Å
466	L	96	Very high	94.4	Very high	80 Å²	80	47.6 Å²	47.6	42%	0.419	23%	0.232	S	C	.	.	H	α-helix	trans	-61.8	-44.5	177.4	-178.1	63.3	0	0	0	111.8	L460 S462 P463 F468 V469 S470	L460-L466 HydrophobicContact CB-CD1 4.49Å; L460-L466 HydrophobicContact CD2-CD1 4.31Å; S462-L466 WeakPolarHBondContact O-CB 3.44Å; S462-L466 PolarHBondContact O-N 2.91Å; P463-L466 PolarHBondContact O-N 3.46Å; L466-F468 VanDerWaalsContact C-N 3.33Å; L466-V469 PolarHBondContact O-N 3.22Å; L466-S470 WeakPolarHBondContact O-CB 3.5Å; L466-S470 PolarHBondContact O-N 3.47Å; L466-S470 PolarHBondContact O-OG 3.29Å
467	L	95.8	Very high	94.9	Very high	50 Å²	50	46.1 Å²	46.1	26%	0.262	22%	0.224	S	C	.	.	H	α-helix	trans	-61.3	-44	175.3	-177.9	63.4	0	0	0	111	P463 S464 F465 S470 A471 A636 L640 L643	P463-L467 WeakPolarHBondContact O-CB 3.36Å; P463-L467 PolarHBondContact O-N 3.42Å; S464-L467 PolarHBondContact O-N 3.15Å; F465-L467 PolarHBondContact O-N 3.31Å; L467-S470 PolarHBondContact O-N 3.25Å; L467-A471 WeakPolarHBondContact O-CB 3.47Å; L467-A471 PolarHBondContact O-N 3.48Å; L467-A636 HydrophobicContact CD1-CB 4.12Å; L467-L640 HydrophobicContact CB-CD1 4.48Å; L467-L640 HydrophobicContact CD2-CD1 4.26Å; L467-L643 HydrophobicContact CB-CD2 4.1Å; L467-L643 HydrophobicContact CD2-CD2 3.75Å
468	F	96	Very high	95	Very high	4 Å²	4	40.6 Å²	40.6	2%	0.018	20%	0.2	C	C	.	.	H	α-helix	trans	-64.7	-45.5	178.7	178.3	-111.4	0	0	0	113	S464 F465 L466 S470 A471 C472 F533 R574 V577 T578 L581 L594 L640	S464-F468 WeakPolarHBondContact O-CB 3.27Å; S464-F468 PolarHBondContact O-N 3.03Å; F465-F468 PolarHBondContact O-N 3.01Å; L466-F468 VanDerWaalsContact C-N 3.33Å; F468-S470 VanDerWaalsContact C-N 3.33Å; F468-S470 PolarHBondContact O-N 2.97Å; F468-A471 PolarHBondContact O-N 3.44Å; F468-C472 VanDerWaalsContact CZ-SG 3.6Å; F468-C472 WeakPolarHBondContact O-CB 3.35Å; F468-C472 PolarHBondContact O-N 3.39Å; F468-C472 PolarHBondContact O-SG 3.44Å; F468-F533 HydrophobicContact CD2-CE1 4.24Å; F468-F533 HydrophobicContact CE2-CD1 4.04Å; F468-F533 AromaticContact CE2-CE1 3.56Å; F468-F533 HydrophobicContact CE2-CE1 3.56Å; F468-F533 HydrophobicContact CE2-CE2 4.44Å; F468-F533 AromaticContact CE2-CZ 3.78Å; F468-F533 HydrophobicContact CE2-CZ 3.78Å; F468-F533 HydrophobicContact CZ-CE1 4.49Å; F468-F533 HydrophobicContact CZ-CZ 4.3Å; F468-R574 HydrophobicContact CZ-CG 4.15Å; F468-V577 HydrophobicContact CD2-CG1 3.64Å; F468-V577 HydrophobicContact CE1-CG1 4.31Å; F468-V577 HydrophobicContact CE2-CB 3.91Å; F468-V577 HydrophobicContact CE2-CG1 3.3Å; F468-V577 HydrophobicContact CG-CG1 4.28Å; F468-V577 HydrophobicContact CZ-CB 3.94Å; F468-V577 HydrophobicContact CZ-CG1 3.67Å; F468-T578 WeakPolarHBondContact CE1-OG1 3.45Å; F468-L581 HydrophobicContact CB-CD1 3.43Å; F468-L581 VanDerWaalsContact CB-CD1 3.43Å; F468-L581 HydrophobicContact CD1-CD1 3.79Å; F468-L581 HydrophobicContact CD2-CD1 4.2Å; F468-L581 HydrophobicContact CG-CD1 3.54Å; F468-L594 HydrophobicContact CD1-CD2 4.13Å; F468-L594 HydrophobicContact CE1-CD1 3.86Å; F468-L594 HydrophobicContact CE1-CD2 3.91Å; F468-L640 HydrophobicContact CB-CD1 4.25Å; F468-L640 HydrophobicContact CB-CD2 4.35Å; F468-L640 HydrophobicContact CD2-CD2 4.04Å
469	V	96.2	Very high	95.1	Very high	7 Å²	7	34.5 Å²	34.5	4%	0.042	17%	0.174	C	C	.	.	H	α-helix	trans	-61.3	-43.3	175.1	170.4	0	0	0	0	110.6	L460 F465 L466 C472 F473 L594 F597	L460-V469 HydrophobicContact CD2-CG1 4.45Å; L460-V469 HydrophobicContact CD2-CG2 4.41Å; F465-V469 HydrophobicContact CD1-CG2 3.95Å; F465-V469 HydrophobicContact CD2-CG2 4.16Å; F465-V469 HydrophobicContact CE1-CG2 3.51Å; F465-V469 HydrophobicContact CE2-CG2 3.72Å; F465-V469 HydrophobicContact CG-CG2 4.27Å; F465-V469 HydrophobicContact CZ-CG2 3.38Å; F465-V469 WeakPolarHBondContact O-CB 3.39Å; F465-V469 VanDerWaalsContact O-CG2 3.32Å; F465-V469 WeakPolarHBondContact O-CG2 3.42Å; F465-V469 PolarHBondContact O-N 3.02Å; L466-V469 PolarHBondContact O-N 3.22Å; V469-C472 PolarHBondContact O-N 2.83Å; V469-F473 WeakPolarHBondContact O-CB 3.27Å; V469-F473 PolarHBondContact O-N 3.13Å; V469-L594 HydrophobicContact CB-CD2 4.39Å; V469-L594 HydrophobicContact CG2-CD2 3.73Å; V469-L594 HydrophobicContact CG2-CG 4.29Å; V469-F597 HydrophobicContact CG1-CB 4.24Å; V469-F597 HydrophobicContact CG1-CD2 3.53Å; V469-F597 HydrophobicContact CG1-CE2 4.14Å; V469-F597 HydrophobicContact CG1-CG 4.04Å
470	S	95.9	Very high	95.2	Very high	54 Å²	54	34.3 Å²	34.3	38%	0.378	17%	0.173	S	C	.	.	H	α-helix	trans	-64.1	-44.3	178.4	-55.1	0	0	0	0	111.7	L466 L467 F468 F473 L474	L466-S470 WeakPolarHBondContact O-CB 3.5Å; L466-S470 PolarHBondContact O-N 3.47Å; L466-S470 PolarHBondContact O-OG 3.29Å; L467-S470 PolarHBondContact O-N 3.25Å; F468-S470 VanDerWaalsContact C-N 3.33Å; F468-S470 PolarHBondContact O-N 2.97Å; S470-F473 WeakPolarHBondContact O-CB 3.41Å; S470-F473 PolarHBondContact O-N 3.08Å; S470-L474 WeakPolarHBondContact O-CG 3.35Å; S470-L474 PolarHBondContact O-N 2.93Å
471	A	95.8	Very high	95.3	Very high	6 Å²	6	32.6 Å²	32.6	5%	0.05	16%	0.164	C	C	.	.	H	α-helix	trans	-62.4	-44.7	174.8	0	0	0	0	0	111.6	L467 F468 F473 L474 A475 A633 A636	L467-A471 WeakPolarHBondContact O-CB 3.47Å; L467-A471 PolarHBondContact O-N 3.48Å; F468-A471 PolarHBondContact O-N 3.44Å; A471-F473 VanDerWaalsContact C-N 3.32Å; A471-F473 PolarHBondContact O-N 2.74Å; A471-L474 PolarHBondContact O-N 3.29Å; A471-A475 WeakPolarHBondContact O-CB 3.48Å; A471-A475 PolarHBondContact O-N 3.14Å; A471-A633 HydrophobicContact CB-CB 4.14Å; A471-A633 WeakPolarHBondContact O-CB 3.4Å; A471-A636 HydrophobicContact CB-CB 4.42Å
472	C	95.6	Very high	95.4	Very high	9 Å²	9	21.7 Å²	21.7	6%	0.061	12%	0.123	C	C	.	.	H	α-helix	trans	-59.9	-42.5	175.1	-71.2	0	0	0	0	111.8	F468 V469 A475 S476 L594	F468-C472 VanDerWaalsContact CZ-SG 3.6Å; F468-C472 WeakPolarHBondContact O-CB 3.35Å; F468-C472 PolarHBondContact O-N 3.39Å; F468-C472 PolarHBondContact O-SG 3.44Å; V469-C472 PolarHBondContact O-N 2.83Å; C472-A475 PolarHBondContact O-N 2.99Å; C472-S476 VanDerWaalsContact O-CB 3.3Å; C472-S476 WeakPolarHBondContact O-CB 3.27Å; C472-S476 PolarHBondContact O-N 3.16Å; C472-S476 PolarHBondContact O-OG 2.79Å; C472-L594 HydrophobicContact CB-CD2 4.19Å
473	F	96.2	Very high	95.4	Very high	53 Å²	53	21 Å²	21	23%	0.232	12%	0.118	C	C	.	.	H	α-helix	trans	-58.4	-51.2	176.4	-177.9	-84.1	0	0	0	111.2	V469 S470 A471 A475 S476 V477 F597 I600 A601 L604	V469-F473 WeakPolarHBondContact O-CB 3.27Å; V469-F473 PolarHBondContact O-N 3.13Å; S470-F473 WeakPolarHBondContact O-CB 3.41Å; S470-F473 PolarHBondContact O-N 3.08Å; A471-F473 VanDerWaalsContact C-N 3.32Å; A471-F473 PolarHBondContact O-N 2.74Å; F473-A475 PolarHBondContact O-N 3.44Å; F473-S476 PolarHBondContact O-N 3.37Å; F473-V477 HydrophobicContact CD1-CG2 4.33Å; F473-V477 HydrophobicContact CE1-CG2 3.99Å; F473-V477 HydrophobicContact CZ-CG2 4.5Å; F473-V477 WeakPolarHBondContact O-CG2 3.39Å; F473-V477 PolarHBondContact O-N 3.33Å; F473-V477 VanDerWaalsContact O-N 3.12Å; F473-F597 HydrophobicContact CD2-CB 4.16Å; F473-F597 WeakPolarHBondContact CD2-O 3.48Å; F473-I600 HydrophobicContact CE2-CB 4.11Å; F473-I600 HydrophobicContact CE2-CG2 3.93Å; F473-I600 HydrophobicContact CZ-CG2 4.3Å; F473-A601 HydrophobicContact CD1-CB 4.44Å; F473-A601 HydrophobicContact CD2-CB 3.67Å; F473-A601 HydrophobicContact CE2-CB 3.78Å; F473-A601 HydrophobicContact CG-CB 4.01Å; F473-A601 HydrophobicContact CZ-CB 4.21Å; F473-A601 VanDerWaalsContact O-CB 3.32Å; F473-A601 WeakPolarHBondContact O-CB 3.48Å; F473-L604 HydrophobicContact CZ-CD1 4.15Å
474	L	95.7	Very high	95.4	Very high	54 Å²	54	18.7 Å²	18.7	28%	0.283	10%	0.103	S	C	.	.	H	α-helix	trans	-59.7	-45.9	179.1	-66.6	173.6	0	0	0	112	S470 A471 S476 V477 L629 V632 A633	S470-L474 WeakPolarHBondContact O-CG 3.35Å; S470-L474 PolarHBondContact O-N 2.93Å; A471-L474 PolarHBondContact O-N 3.29Å; L474-S476 VanDerWaalsContact C-N 3.32Å; L474-S476 PolarHBondContact O-N 3.49Å; L474-V477 PolarHBondContact O-N 3.28Å; L474-L629 HydrophobicContact CD2-CD2 3.94Å; L474-V632 HydrophobicContact CD1-CG1 4.12Å; L474-A633 HydrophobicContact CB-CB 4.29Å
475	A	96.1	Very high	95.5	Very high	10 Å²	10	18.7 Å²	18.7	8%	0.083	10%	0.103	C	C	.	.	H	α-helix	trans	-61.6	-40.1	177	0	0	0	0	0	112.1	A471 C472 F473 V477 G478 F479 N537 M630 A633	A471-A475 WeakPolarHBondContact O-CB 3.48Å; A471-A475 PolarHBondContact O-N 3.14Å; C472-A475 PolarHBondContact O-N 2.99Å; F473-A475 PolarHBondContact O-N 3.44Å; A475-V477 VanDerWaalsContact C-N 3.35Å; A475-V477 PolarHBondContact O-N 3.17Å; A475-G478 PolarHBondContact O-N 3.14Å; A475-F479 PolarHBondContact O-N 2.83Å; A475-N537 WeakPolarHBondContact CB-OD1 3.17Å; A475-M630 HydrophobicContact CB-CG 4.46Å; A475-A633 HydrophobicContact CB-CB 3.88Å
476	S	95.2	Very high	95.6	Very high	5 Å²	5	18.7 Å²	18.7	4%	0.035	10%	0.103	C	C	.	.	H	α-helix	trans	-69.8	-25.9	-179.5	-70.3	0	0	0	0	114.1	C472 F473 L474 G478 N598	C472-S476 VanDerWaalsContact O-CB 3.3Å; C472-S476 WeakPolarHBondContact O-CB 3.27Å; C472-S476 PolarHBondContact O-N 3.16Å; C472-S476 PolarHBondContact O-OG 2.79Å; F473-S476 PolarHBondContact O-N 3.37Å; L474-S476 VanDerWaalsContact C-N 3.32Å; L474-S476 PolarHBondContact O-N 3.49Å; S476-G478 VanDerWaalsContact C-N 3.34Å; S476-N598 WeakPolarHBondContact CB-OD1 3.08Å; S476-N598 PolarHBondContact OG-OD1 2.92Å
477	V	96.2	Very high	95.6	Very high	13 Å²	13	14.9 Å²	14.9	8%	0.079	8%	0.083	C	C	.	.	H	α-helix	trans	-64.3	-41.9	170.7	176.1	0	0	0	0	110.4	F473 L474 A475 A601 G605 L629	F473-V477 HydrophobicContact CD1-CG2 4.33Å; F473-V477 HydrophobicContact CE1-CG2 3.99Å; F473-V477 HydrophobicContact CZ-CG2 4.5Å; F473-V477 WeakPolarHBondContact O-CG2 3.39Å; F473-V477 PolarHBondContact O-N 3.33Å; F473-V477 VanDerWaalsContact O-N 3.12Å; L474-V477 PolarHBondContact O-N 3.28Å; A475-V477 VanDerWaalsContact C-N 3.35Å; A475-V477 PolarHBondContact O-N 3.17Å; V477-A601 HydrophobicContact CG2-CB 3.84Å; V477-G605 WeakPolarHBondContact O-CA 3.4Å; V477-L629 HydrophobicContact CB-CD1 4.08Å; V477-L629 HydrophobicContact CG1-CD1 3.73Å
478	G	94.9	Very high	95.5	Very high	1 Å²	1	14.7 Å²	14.7	1%	0.01	8%	0.079	C	C	.	.	H	α-helix	trans	-75.1	-28.6	178.5	0	0	0	0	0	114.2	A475 S476 N480 V481 P482 S626	A475-G478 PolarHBondContact O-N 3.14Å; S476-G478 VanDerWaalsContact C-N 3.34Å; G478-N480 PolarHBondContact O-N 3.41Å; G478-V481 PolarHBondContact O-N 3.2Å; G478-P482 VanDerWaalsContact O-CD 3.24Å; G478-P482 WeakPolarHBondContact O-CD 3.46Å; G478-S626 VanDerWaalsContact C-OG 3.27Å; G478-S626 WeakPolarHBondContact CA-OG 3.36Å; G478-S626 PolarHBondContact O-OG 2.86Å
479	F	93.6	Very high	95.5	Very high	38 Å²	38	15.1 Å²	15.1	17%	0.167	8%	0.081	C	C	.	.	H	α-helix	trans	-51.8	-50.1	-169.1	169.4	-106.2	0	0	0	116.1	A475 V481 P482 Y483 I567	A475-F479 PolarHBondContact O-N 2.83Å; F479-V481 VanDerWaalsContact C-N 3.35Å; F479-P482 WeakPolarHBondContact O-CD 3.19Å; F479-Y483 HydrophobicContact CD2-CE2 4.49Å; F479-Y483 HydrophobicContact CE2-CD2 4.41Å; F479-Y483 AromaticContact CE2-CE2 3.7Å; F479-Y483 HydrophobicContact CE2-CE2 3.7Å; F479-Y483 HydrophobicContact CZ-CD2 4.25Å; F479-Y483 AromaticContact CZ-CE2 3.71Å; F479-Y483 HydrophobicContact CZ-CE2 3.71Å; F479-I567 HydrophobicContact CD2-CD1 3.53Å; F479-I567 HydrophobicContact CD2-CG1 4.14Å; F479-I567 HydrophobicContact CE2-CB 4.41Å; F479-I567 HydrophobicContact CE2-CD1 3.77Å; F479-I567 HydrophobicContact CE2-CG1 3.91Å; F479-I567 HydrophobicContact CE2-CG2 3.61Å; F479-I567 HydrophobicContact CZ-CG2 4.41Å
480	N	92.8	Very high	95.5	Very high	1 Å²	1	14.8 Å²	14.8	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-81.1	-15	-173	-85.1	-28.4	0	0	0	113.7	G478 Y483 L484 P606	G478-N480 PolarHBondContact O-N 3.41Å; N480-Y483 PolarHBondContact O-N 3.38Å; N480-L484 PolarHBondContact O-N 2.91Å; N480-P606 HydrophobicContact CB-CG 3.85Å
481	V	96.4	Very high	95.5	Very high	4 Å²	4	14.2 Å²	14.2	2%	0.024	7%	0.07	C	C	.	.	H	α-helix	trans	-62.1	-47.7	-175	172.7	0	0	0	0	111.5	G478 F479 L484 Y485 A609 F623	G478-V481 PolarHBondContact O-N 3.2Å; F479-V481 VanDerWaalsContact C-N 3.35Å; V481-L484 PolarHBondContact O-N 3.12Å; V481-Y485 HydrophobicContact CG1-CD2 4.07Å; V481-Y485 WeakPolarHBondContact O-CD2 3.47Å; V481-Y485 PolarHBondContact O-N 2.85Å; V481-A609 HydrophobicContact CB-CB 4.39Å; V481-A609 HydrophobicContact CG1-CB 3.75Å; V481-A609 HydrophobicContact CG2-CB 3.78Å; V481-F623 HydrophobicContact CG1-CD1 4.19Å; V481-F623 HydrophobicContact CG1-CE1 4.22Å
482	P	95.7	Very high	95.4	Very high	0 Å²	0	18.8 Å²	18.8	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-60	-43.8	174.2	-29	38.8	0	0	0	114.5	G478 F479 L484 L486 T544 Y559 F563	G478-P482 VanDerWaalsContact O-CD 3.24Å; G478-P482 WeakPolarHBondContact O-CD 3.46Å; F479-P482 WeakPolarHBondContact O-CD 3.19Å; P482-L484 VanDerWaalsContact C-N 3.26Å; P482-L484 PolarHBondContact O-N 3.43Å; P482-L486 WeakPolarHBondContact O-CB 3.35Å; P482-L486 PolarHBondContact O-N 2.88Å; P482-T544 HydrophobicContact CG-CG2 3.98Å; P482-Y559 HydrophobicContact CB-CE1 4.48Å; P482-Y559 WeakPolarHBondContact CB-OH 3.41Å; P482-Y559 WeakPolarHBondContact CG-OH 3.47Å; P482-F563 HydrophobicContact CB-CE1 4.03Å; P482-F563 HydrophobicContact CB-CE2 4.21Å; P482-F563 HydrophobicContact CB-CZ 3.86Å; P482-F563 HydrophobicContact CG-CD2 4.42Å; P482-F563 HydrophobicContact CG-CE1 4.4Å; P482-F563 HydrophobicContact CG-CE2 3.75Å; P482-F563 HydrophobicContact CG-CZ 3.73Å
483	Y	94.3	Very high	95.5	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.008	11%	0.105	C	C	.	.	H	α-helix	trans	-58.8	-38.9	-179.6	-79.5	-78.5	0	0	0	112.5	L80 F479 N480 L504 I507 F563	L80-Y483 HydrophobicContact CB-CD1 4.21Å; L80-Y483 HydrophobicContact CB-CE1 4.48Å; L80-Y483 HydrophobicContact CD1-CE1 4.26Å; L80-Y483 HydrophobicContact CD2-CD1 4.34Å; L80-Y483 HydrophobicContact CD2-CD2 4.24Å; L80-Y483 HydrophobicContact CD2-CE2 4.41Å; L80-Y483 HydrophobicContact CD2-CG 4.2Å; F479-Y483 HydrophobicContact CD2-CE2 4.49Å; F479-Y483 HydrophobicContact CE2-CD2 4.41Å; F479-Y483 AromaticContact CE2-CE2 3.7Å; F479-Y483 HydrophobicContact CE2-CE2 3.7Å; F479-Y483 HydrophobicContact CZ-CD2 4.25Å; F479-Y483 AromaticContact CZ-CE2 3.71Å; F479-Y483 HydrophobicContact CZ-CE2 3.71Å; N480-Y483 PolarHBondContact O-N 3.38Å; Y483-L504 HydrophobicContact CD1-CD2 4.18Å; Y483-L504 WeakPolarHBondContact O-CD1 3.45Å; Y483-L504 WeakPolarHBondContact O-CD2 3.35Å; Y483-I507 HydrophobicContact CE1-CG2 3.65Å; Y483-I507 VanDerWaalsContact OH-CG2 3.29Å; Y483-I507 WeakPolarHBondContact OH-CG2 3.43Å; Y483-F563 HydrophobicContact CD2-CE1 4.06Å; Y483-F563 AromaticContact CE2-CE1 3.64Å; Y483-F563 HydrophobicContact CE2-CE1 3.64Å; Y483-F563 HydrophobicContact CE2-CZ 4.29Å
484	L	94.7	Very high	95.5	Very high	1 Å²	1	22.1 Å²	22.1	1%	0.005	13%	0.127	C	C	.	.	H	α-helix	trans	-82.9	-41.6	-177.3	-91.4	61.7	0	0	0	113.2	I87 F105 N480 V481 P482 P606	I87-L484 HydrophobicContact CD1-CD2 4.14Å; I87-L484 HydrophobicContact CD1-CG 4.36Å; F105-L484 HydrophobicContact CB-CD2 4.35Å; N480-L484 PolarHBondContact O-N 2.91Å; V481-L484 PolarHBondContact O-N 3.12Å; P482-L484 VanDerWaalsContact C-N 3.26Å; P482-L484 PolarHBondContact O-N 3.43Å; L484-P606 HydrophobicContact CD2-CB 3.67Å; L484-P606 HydrophobicContact CD2-CG 4.02Å
485	Y	96.4	Very high	95.5	Very high	1 Å²	1	21.1 Å²	21.1	0%	0.004	12%	0.122	C	C	.	.	H	α-helix	trans	-112.6	-9.7	-166.2	-54.3	-61.7	0	0	0	115	I87 S102 V481 R488 Q489 P606 A609 A610 Y619	I87-Y485 HydrophobicContact CD1-CE1 4.15Å; S102-Y485 WeakPolarHBondContact CB-OH 3.48Å; V481-Y485 HydrophobicContact CG1-CD2 4.07Å; V481-Y485 WeakPolarHBondContact O-CD2 3.47Å; V481-Y485 PolarHBondContact O-N 2.85Å; Y485-R488 WeakPolarHBondContact O-CB 3.44Å; Y485-R488 PolarHBondContact O-N 3.46Å; Y485-Q489 PolarHBondContact O-N 2.87Å; Y485-P606 HydrophobicContact CE2-CB 4.2Å; Y485-P606 WeakPolarHBondContact CE2-O 3.07Å; Y485-P606 PolarHBondContact OH-O 3.29Å; Y485-A609 HydrophobicContact CD2-CB 3.93Å; Y485-A609 HydrophobicContact CE2-CB 3.6Å; Y485-A610 HydrophobicContact CE1-CB 4.5Å; Y485-A610 WeakPolarHBondContact OH-CB 3.49Å; Y485-Y619 HydrophobicContact CD1-CD1 4.13Å; Y485-Y619 AromaticContact CD1-CE1 3.34Å; Y485-Y619 HydrophobicContact CD1-CE1 3.34Å; Y485-Y619 AromaticContact CD1-CZ 3.71Å; Y485-Y619 HydrophobicContact CD2-CD1 4.45Å; Y485-Y619 HydrophobicContact CD2-CE1 4.33Å; Y485-Y619 AromaticContact CE1-CE1 3.97Å; Y485-Y619 HydrophobicContact CE1-CE1 3.97Å; Y485-Y619 AromaticContact CG-CD1 3.85Å; Y485-Y619 HydrophobicContact CG-CD1 3.85Å; Y485-Y619 AromaticContact CG-CE1 3.55Å; Y485-Y619 HydrophobicContact CG-CE1 3.55Å
486	L	97.1	Very high	95.5	Very high	0 Å²	0	22.9 Å²	22.9	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-59	-46.3	173.4	174	71.4	0	0	0	112.3	P482 R488 Q489 A490 L503 I507 L547 L556 Y559	P482-L486 WeakPolarHBondContact O-CB 3.35Å; P482-L486 PolarHBondContact O-N 2.88Å; L486-R488 VanDerWaalsContact C-N 3.27Å; L486-R488 PolarHBondContact O-N 2.94Å; L486-Q489 PolarHBondContact O-N 2.92Å; L486-A490 PolarHBondContact O-N 2.89Å; L486-L503 HydrophobicContact CD2-CB 3.99Å; L486-L503 HydrophobicContact CD2-CD1 4.39Å; L486-L503 HydrophobicContact CG-CD1 4.14Å; L486-I507 HydrophobicContact CD2-CD1 4.01Å; L486-L547 HydrophobicContact CD1-CD1 3.76Å; L486-L547 HydrophobicContact CD1-CD2 3.84Å; L486-L547 HydrophobicContact CD1-CG 4.36Å; L486-L556 HydrophobicContact CD1-CD2 4.15Å; L486-Y559 HydrophobicContact CD1-CD1 4.08Å; L486-Y559 HydrophobicContact CD1-CE1 4.02Å; L486-Y559 HydrophobicContact CD2-CD1 4.09Å; L486-Y559 HydrophobicContact CD2-CE1 3.86Å; L486-Y559 HydrophobicContact CG-CE1 4.5Å
487	P	96.1	Very high	95.4	Very high	0 Å²	0	25.5 Å²	25.5	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59.5	-39.8	176.4	-25.7	37.1	0	0	0	112	Q84 Q489 A490 E491 S500 L504	Q84-P487 HydrophobicContact CB-CG 4.18Å; P487-Q489 PolarHBondContact O-N 3.38Å; P487-A490 WeakPolarHBondContact O-CB 3.43Å; P487-A490 PolarHBondContact O-N 3.38Å; P487-A490 VanDerWaalsContact O-N 3.14Å; P487-E491 WeakPolarHBondContact O-CG 3.34Å; P487-E491 PolarHBondContact O-N 2.83Å; P487-S500 WeakPolarHBondContact O-CB 3.45Å; P487-L504 HydrophobicContact CG-CD1 3.86Å; P487-L504 HydrophobicContact CG-CD2 4.06Å; P487-L504 HydrophobicContact CG-CG 3.77Å
488	R	94.1	Very high	95.3	Very high	46 Å²	46	29.3 Å²	29.3	17%	0.174	17%	0.166	C	C	.	.	H	α-helix	trans	-63.3	-42.2	177	-67.4	-72.9	163.6	-144.4	-24.6	112.6	Q84 Y485 L486 A490 E491 M492 Y619	Q84-R488 PolarHBondContact O-NH2 3.06Å; Y485-R488 WeakPolarHBondContact O-CB 3.44Å; Y485-R488 PolarHBondContact O-N 3.46Å; L486-R488 VanDerWaalsContact C-N 3.27Å; L486-R488 PolarHBondContact O-N 2.94Å; R488-A490 VanDerWaalsContact C-N 3.29Å; R488-A490 PolarHBondContact O-N 3.39Å; R488-E491 IonicContact CZ-OE1 3.66Å; R488-E491 IonicContact CZ-OE2 3.48Å; R488-E491 IonicContact NH1-OE1 3.43Å; R488-E491 PolarHBondContact NH1-OE1 3.26Å; R488-E491 IonicContact NH1-OE2 2.65Å; R488-E491 PolarHBondContact NH1-OE2 2.94Å; R488-E491 IonicContact NH2-OE1 3.83Å; R488-E491 PolarHBondContact O-N 3.37Å; R488-M492 WeakPolarHBondContact O-CG 3.38Å; R488-M492 PolarHBondContact O-N 3.42Å; R488-Y619 HydrophobicContact CB-CD2 4.36Å; R488-Y619 HydrophobicContact CB-CE2 3.62Å
489	Q	96	Very high	95.4	Very high	12 Å²	12	32.7 Å²	32.7	6%	0.056	18%	0.184	C	C	.	.	H	α-helix	trans	-61.3	-40.5	174	-179.5	67	14	0	0	111.3	Y485 L486 P487 M492 L493 F623	Y485-Q489 PolarHBondContact O-N 2.87Å; L486-Q489 PolarHBondContact O-N 2.92Å; P487-Q489 PolarHBondContact O-N 3.38Å; Q489-M492 PolarHBondContact O-N 2.93Å; Q489-L493 HydrophobicContact CG-CD1 4.45Å; Q489-L493 WeakPolarHBondContact O-CG 3.37Å; Q489-L493 PolarHBondContact O-N 3.21Å; Q489-L493 VanDerWaalsContact O-N 3.14Å; Q489-F623 HydrophobicContact CB-CE2 3.84Å; Q489-F623 HydrophobicContact CB-CZ 4.17Å; Q489-F623 HydrophobicContact CG-CE2 3.88Å
490	A	97.4	Very high	95.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.7	-41.5	176.8	0	0	0	0	0	112.2	L486 P487 R488 L493 G494 N495 S500 L503 L556	L486-A490 PolarHBondContact O-N 2.89Å; P487-A490 WeakPolarHBondContact O-CB 3.43Å; P487-A490 PolarHBondContact O-N 3.38Å; P487-A490 VanDerWaalsContact O-N 3.14Å; R488-A490 VanDerWaalsContact C-N 3.29Å; R488-A490 PolarHBondContact O-N 3.39Å; A490-L493 CarbonylContact O-C 3.56Å; A490-L493 WeakPolarHBondContact O-CB 3.13Å; A490-L493 PolarHBondContact O-N 3.43Å; A490-L493 VanDerWaalsContact O-N 3.16Å; A490-G494 PolarHBondContact O-N 2.9Å; A490-N495 HydrophobicContact CB-CB 4.34Å; A490-N495 WeakPolarHBondContact O-CB 3.44Å; A490-N495 PolarHBondContact O-N 3.09Å; A490-N495 PolarHBondContact O-ND2 3.1Å; A490-S500 WeakPolarHBondContact CB-OG 3.2Å; A490-L503 HydrophobicContact CB-CD1 3.62Å; A490-L556 HydrophobicContact CB-CD1 3.88Å
491	E	95.7	Very high	95.6	Very high	43 Å²	43	31 Å²	31	20%	0.201	18%	0.176	C	C	.	.	H	α-helix	trans	-60.5	-43.3	173.2	-69.9	170.9	-157	0	0	111.8	P487 R488 L493 G494	P487-E491 WeakPolarHBondContact O-CG 3.34Å; P487-E491 PolarHBondContact O-N 2.83Å; R488-E491 IonicContact CZ-OE1 3.66Å; R488-E491 IonicContact CZ-OE2 3.48Å; R488-E491 IonicContact NH1-OE1 3.43Å; R488-E491 PolarHBondContact NH1-OE1 3.26Å; R488-E491 IonicContact NH1-OE2 2.65Å; R488-E491 PolarHBondContact NH1-OE2 2.94Å; R488-E491 IonicContact NH2-OE1 3.83Å; R488-E491 PolarHBondContact O-N 3.37Å; E491-L493 PolarHBondContact O-N 2.99Å; E491-G494 WeakPolarHBondContact O-CA 3.29Å; E491-G494 PolarHBondContact O-N 3.35Å
492	M	94.2	Very high	95.6	Very high	101 Å²	101	34.2 Å²	34.2	50%	0.498	19%	0.193	S	C	.	.	H	α-helix	trans	-63.6	-25.8	175.8	-72.2	180	72.5	0	0	113.3	R488 Q489 G494 F613 G617 Y619	R488-M492 WeakPolarHBondContact O-CG 3.38Å; R488-M492 PolarHBondContact O-N 3.42Å; Q489-M492 PolarHBondContact O-N 2.93Å; M492-G494 PolarHBondContact O-N 2.92Å; M492-F613 HydrophobicContact CE-CE2 4.09Å; M492-F613 HydrophobicContact SD-CE2 3.75Å; M492-F613 HydrophobicContact SD-CZ 4.43Å; M492-G617 WeakPolarHBondContact CE-O 3.49Å; M492-Y619 HydrophobicContact SD-CD2 3.99Å; M492-Y619 HydrophobicContact SD-CE2 4.04Å
493	L	96.2	Very high	95.7	Very high	64 Å²	64	34.2 Å²	34.2	34%	0.335	19%	0.193	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.3	2.9	172.1	-67.6	168.2	0	0	0	112.8	Q489 A490 E491 I551 L556	Q489-L493 HydrophobicContact CG-CD1 4.45Å; Q489-L493 WeakPolarHBondContact O-CG 3.37Å; Q489-L493 PolarHBondContact O-N 3.21Å; Q489-L493 VanDerWaalsContact O-N 3.14Å; A490-L493 CarbonylContact O-C 3.56Å; A490-L493 WeakPolarHBondContact O-CB 3.13Å; A490-L493 PolarHBondContact O-N 3.43Å; A490-L493 VanDerWaalsContact O-N 3.16Å; E491-L493 PolarHBondContact O-N 2.99Å; L493-I551 HydrophobicContact CD2-CB 4.42Å; L493-I551 HydrophobicContact CD2-CG2 4.19Å; L493-L556 HydrophobicContact CD1-CD1 4.29Å
494	G	95.9	Very high	95.8	Very high	68 Å²	68	34.1 Å²	34.1	70%	0.701	19%	0.193	S	C	*	.	T	Hydrogen-bonded Turn	trans	91.5	11.3	176.2	0	0	0	0	0	115.1	A490 E491 M492	A490-G494 PolarHBondContact O-N 2.9Å; E491-G494 WeakPolarHBondContact O-CA 3.29Å; E491-G494 PolarHBondContact O-N 3.35Å; M492-G494 PolarHBondContact O-N 2.92Å
495	N	97	Very high	95.9	Very high	34 Å²	34	34.3 Å²	34.3	18%	0.182	19%	0.194	C	C	.	.			trans	-76.7	152.5	173.9	-60.7	-89.3	0	0	0	110.9	A490	A490-N495 HydrophobicContact CB-CB 4.34Å; A490-N495 WeakPolarHBondContact O-CB 3.44Å; A490-N495 PolarHBondContact O-N 3.09Å; A490-N495 PolarHBondContact O-ND2 3.1Å
496	S	96.2	Very high	96	Very high	47 Å²	47	36.1 Å²	36.1	33%	0.329	20%	0.204	S	C	.	.			trans	-69.1	159.2	175.8	87.3	0	0	0	0	111.6	E498 L499 S500	S496-E498 VanDerWaalsContact C-N 3.27Å; S496-E498 WeakPolarHBondContact CB-OE2 3.4Å; S496-E498 PolarHBondContact O-N 3.14Å; S496-E498 PolarHBondContact OG-OE2 3.3Å; S496-L499 PolarHBondContact O-N 2.8Å; S496-L499 PolarHBondContact OG-N 2.95Å; S496-S500 VanDerWaalsContact O-CB 3.29Å; S496-S500 WeakPolarHBondContact O-CB 3.34Å; S496-S500 PolarHBondContact O-N 3.03Å; S496-S500 PolarHBondContact O-OG 3.01Å
497	V	93.2	Very high	96	Very high	59 Å²	59	36.1 Å²	36.1	36%	0.358	20%	0.204	S	C	.	.	H	α-helix	trans	-61.5	-39.8	178.8	180	0	0	0	0	110.6	T209 S500 S501	T209-V497 HydrophobicContact CG2-CG1 3.87Å; V497-S500 PolarHBondContact O-N 2.95Å; V497-S501 WeakPolarHBondContact O-CB 3.28Å; V497-S501 PolarHBondContact O-N 3.5Å
498	E	93.7	Very high	96	Very high	93 Å²	93	36.1 Å²	36.1	44%	0.435	20%	0.204	S	C	.	.	H	α-helix	trans	-63.3	-51.8	178.7	-49.9	78.7	-175.9	0	0	110.3	T209 S496 S500 S501 L502	T209-E498 HydrophobicContact CG2-CG 4.31Å; S496-E498 VanDerWaalsContact C-N 3.27Å; S496-E498 WeakPolarHBondContact CB-OE2 3.4Å; S496-E498 PolarHBondContact O-N 3.14Å; S496-E498 PolarHBondContact OG-OE2 3.3Å; E498-S500 VanDerWaalsContact C-N 3.27Å; E498-S500 PolarHBondContact O-N 3.25Å; E498-S501 PolarHBondContact O-N 2.92Å; E498-S501 PolarHBondContact O-OG 2.9Å; E498-L502 WeakPolarHBondContact O-CG 3.26Å; E498-L502 PolarHBondContact O-N 3.24Å; E498-L502 VanDerWaalsContact O-N 3.11Å
499	L	95.9	Very high	96.1	Very high	73 Å²	73	37.6 Å²	37.6	38%	0.382	21%	0.214	S	C	.	.	H	α-helix	trans	-59.5	-39.1	176.5	-74.4	178.5	0	0	0	112.2	S496 L502 Y553	S496-L499 PolarHBondContact O-N 2.8Å; S496-L499 PolarHBondContact OG-N 2.95Å; L499-L502 HydrophobicContact CD2-CD1 4.39Å; L499-L502 WeakPolarHBondContact O-CB 3.25Å; L499-L502 PolarHBondContact O-N 3.4Å; L499-Y553 HydrophobicContact CB-CE2 3.91Å; L499-Y553 VanDerWaalsContact O-CE2 3.27Å; L499-Y553 WeakPolarHBondContact O-CE2 3.39Å; L499-Y553 PolarHBondContact O-OH 3.38Å
500	S	96.3	Very high	96.2	Very high	0 Å²	0	38.5 Å²	38.5	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-68.5	-38.3	-179.3	-58.6	0	0	0	0	111.7	P487 A490 S496 V497 E498 L502 L503	P487-S500 WeakPolarHBondContact O-CB 3.45Å; A490-S500 WeakPolarHBondContact CB-OG 3.2Å; S496-S500 VanDerWaalsContact O-CB 3.29Å; S496-S500 WeakPolarHBondContact O-CB 3.34Å; S496-S500 PolarHBondContact O-N 3.03Å; S496-S500 PolarHBondContact O-OG 3.01Å; V497-S500 PolarHBondContact O-N 2.95Å; E498-S500 VanDerWaalsContact C-N 3.27Å; E498-S500 PolarHBondContact O-N 3.25Å; S500-L502 VanDerWaalsContact C-N 3.32Å; S500-L502 PolarHBondContact O-N 3.08Å; S500-L503 WeakPolarHBondContact O-CB 3.1Å; S500-L503 PolarHBondContact O-N 3.43Å
501	S	95.2	Very high	95.9	Very high	2 Å²	2	38.6 Å²	38.6	1%	0.014	22%	0.221	C	C	.	.	H	α-helix	trans	-67.5	-30.6	173.7	74.7	0	0	0	0	113	P205 T209 V497 E498 L503 L504 S505	P205-S501 WeakPolarHBondContact CB-O 3.46Å; T209-S501 WeakPolarHBondContact OG1-CB 3.3Å; T209-S501 PolarHBondContact OG1-OG 3.32Å; V497-S501 WeakPolarHBondContact O-CB 3.28Å; V497-S501 PolarHBondContact O-N 3.5Å; E498-S501 PolarHBondContact O-N 2.92Å; E498-S501 PolarHBondContact O-OG 2.9Å; S501-L503 PolarHBondContact O-N 3.43Å; S501-L504 PolarHBondContact O-N 2.99Å; S501-S505 PolarHBondContact O-N 2.95Å
502	L	97	Very high	95.8	Very high	72 Å²	72	37.8 Å²	37.8	38%	0.377	22%	0.219	S	C	.	.	H	α-helix	trans	-66.1	-20.8	175.1	-69.2	175.2	0	0	0	113.1	E498 L499 S500 L504 S505 I506	E498-L502 WeakPolarHBondContact O-CG 3.26Å; E498-L502 PolarHBondContact O-N 3.24Å; E498-L502 VanDerWaalsContact O-N 3.11Å; L499-L502 HydrophobicContact CD2-CD1 4.39Å; L499-L502 WeakPolarHBondContact O-CB 3.25Å; L499-L502 PolarHBondContact O-N 3.4Å; S500-L502 VanDerWaalsContact C-N 3.32Å; S500-L502 PolarHBondContact O-N 3.08Å; L502-L504 VanDerWaalsContact C-N 3.34Å; L502-L504 PolarHBondContact O-N 3.35Å; L502-S505 WeakPolarHBondContact O-CA 3.47Å; L502-S505 WeakPolarHBondContact O-CB 3.47Å; L502-S505 PolarHBondContact O-N 3.23Å; L502-I506 WeakPolarHBondContact O-CG1 3.18Å; L502-I506 PolarHBondContact O-N 3.28Å
503	L	97.9	Very high	95.8	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-61.5	-42.7	172.9	-66.6	173.6	0	0	0	111.5	L486 A490 S500 S501 S505 I506 I507 Y553 L556 C560	L486-L503 HydrophobicContact CD2-CB 3.99Å; L486-L503 HydrophobicContact CD2-CD1 4.39Å; L486-L503 HydrophobicContact CG-CD1 4.14Å; A490-L503 HydrophobicContact CB-CD1 3.62Å; S500-L503 WeakPolarHBondContact O-CB 3.1Å; S500-L503 PolarHBondContact O-N 3.43Å; S501-L503 PolarHBondContact O-N 3.43Å; L503-S505 PolarHBondContact O-N 3.31Å; L503-I506 HydrophobicContact CD2-CD1 4.46Å; L503-I506 PolarHBondContact O-N 2.95Å; L503-I507 WeakPolarHBondContact O-CG1 3.22Å; L503-I507 PolarHBondContact O-N 3.26Å; L503-I507 VanDerWaalsContact O-N 3.13Å; L503-Y553 HydrophobicContact CD1-CE2 4.43Å; L503-Y553 HydrophobicContact CD2-CD2 4.31Å; L503-Y553 HydrophobicContact CD2-CE2 3.73Å; L503-Y553 HydrophobicContact CG-CE2 3.95Å; L503-L556 HydrophobicContact CD1-CB 4.19Å; L503-L556 HydrophobicContact CD1-CD1 4.15Å; L503-L556 HydrophobicContact CD2-CB 3.9Å; L503-C560 PolarHBondContact O-SG 3.44Å; L503-C560 VanDerWaalsContact O-SG 3.39Å
504	L	96.2	Very high	95.6	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-64.4	-31.2	173.1	-59.5	-173.4	0	0	0	111.6	Q84 P205 Y483 P487 S501 L502 I507 G508	Q84-L504 HydrophobicContact CB-CD1 4.35Å; Q84-L504 HydrophobicContact CG-CD1 3.81Å; P205-L504 HydrophobicContact CB-CB 4.13Å; P205-L504 HydrophobicContact CB-CD1 4.43Å; P205-L504 HydrophobicContact CG-CB 3.69Å; P205-L504 HydrophobicContact CG-CD1 4.29Å; Y483-L504 HydrophobicContact CD1-CD2 4.18Å; Y483-L504 WeakPolarHBondContact O-CD1 3.45Å; Y483-L504 WeakPolarHBondContact O-CD2 3.35Å; P487-L504 HydrophobicContact CG-CD1 3.86Å; P487-L504 HydrophobicContact CG-CD2 4.06Å; P487-L504 HydrophobicContact CG-CG 3.77Å; S501-L504 PolarHBondContact O-N 2.99Å; L502-L504 VanDerWaalsContact C-N 3.34Å; L502-L504 PolarHBondContact O-N 3.35Å; L504-I507 HydrophobicContact CD2-CD1 4.09Å; L504-I507 WeakPolarHBondContact O-CB 3.38Å; L504-I507 PolarHBondContact O-N 3.39Å; L504-G508 PolarHBondContact O-N 2.98Å
505	S	97.2	Very high	95.3	Very high	4 Å²	4	33.2 Å²	33.2	3%	0.028	18%	0.179	C	C	.	.	H	α-helix	trans	-65.8	-41.4	176.7	-56.2	0	0	0	0	111.9	F202 S501 L502 L503 G508 I509	F202-S505 PolarHBondContact O-OG 2.71Å; F202-S505 VanDerWaalsContact O-OG 3.12Å; S501-S505 PolarHBondContact O-N 2.95Å; L502-S505 WeakPolarHBondContact O-CA 3.47Å; L502-S505 WeakPolarHBondContact O-CB 3.47Å; L502-S505 PolarHBondContact O-N 3.23Å; L503-S505 PolarHBondContact O-N 3.31Å; S505-G508 PolarHBondContact O-N 2.89Å; S505-I509 WeakPolarHBondContact O-CG1 3.07Å; S505-I509 PolarHBondContact O-N 3.41Å
506	I	97.9	Very high	94.9	Very high	40 Å²	40	35.9 Å²	35.9	21%	0.205	20%	0.197	C	C	.	.	H	α-helix	trans	-60.7	-45.1	172.8	-63	167.5	0	0	0	110.4	L502 L503 G508 I509 V510 C560	L502-I506 WeakPolarHBondContact O-CG1 3.18Å; L502-I506 PolarHBondContact O-N 3.28Å; L503-I506 HydrophobicContact CD2-CD1 4.46Å; L503-I506 PolarHBondContact O-N 2.95Å; I506-G508 VanDerWaalsContact C-N 3.3Å; I506-G508 PolarHBondContact O-N 3.48Å; I506-I509 PolarHBondContact O-N 2.86Å; I506-V510 HydrophobicContact CG2-CG2 4.31Å; I506-V510 WeakPolarHBondContact O-CG2 3.16Å; I506-V510 PolarHBondContact O-N 3.12Å; I506-C560 HydrophobicContact CB-CB 3.86Å; I506-C560 HydrophobicContact CG2-CB 3.56Å
507	I	97	Very high	94.7	Very high	0 Å²	0	37 Å²	37	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-56.4	-45.8	175.7	-65.5	172	0	0	0	110.4	Y483 L486 L503 L504 N511 C560 F563	Y483-I507 HydrophobicContact CE1-CG2 3.65Å; Y483-I507 VanDerWaalsContact OH-CG2 3.29Å; Y483-I507 WeakPolarHBondContact OH-CG2 3.43Å; L486-I507 HydrophobicContact CD2-CD1 4.01Å; L503-I507 WeakPolarHBondContact O-CG1 3.22Å; L503-I507 PolarHBondContact O-N 3.26Å; L503-I507 VanDerWaalsContact O-N 3.13Å; L504-I507 HydrophobicContact CD2-CD1 4.09Å; L504-I507 WeakPolarHBondContact O-CB 3.38Å; L504-I507 PolarHBondContact O-N 3.39Å; I507-N511 WeakPolarHBondContact O-CB 3.43Å; I507-N511 PolarHBondContact O-N 2.91Å; I507-C560 HydrophobicContact CD1-CB 4.49Å; I507-C560 HydrophobicContact CG1-CB 3.69Å; I507-F563 HydrophobicContact CD1-CD1 3.96Å; I507-F563 HydrophobicContact CG1-CD1 4.37Å; I507-F563 HydrophobicContact CG2-CD1 4.11Å
508	G	95.9	Very high	94.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-62	-46	178.9	0	0	0	0	0	114.1	G198 L504 S505 I506 T512	G198-G508 CarbonylContact O-C 3.56Å; G198-G508 WeakPolarHBondContact O-CA 3.37Å; L504-G508 PolarHBondContact O-N 2.98Å; S505-G508 PolarHBondContact O-N 2.89Å; I506-G508 VanDerWaalsContact C-N 3.3Å; I506-G508 PolarHBondContact O-N 3.48Å; G508-T512 PolarHBondContact O-N 3.41Å; G508-T512 PolarHBondContact O-OG1 3.13Å
509	I	96.3	Very high	93.9	Very high	77 Å²	77	31.8 Å²	31.8	40%	0.395	18%	0.183	S	C	.	.	H	α-helix	trans	-60.7	-50.7	177.4	-66.7	165.2	0	0	0	110.1	F202 S505 I506 T512 I513	F202-I509 HydrophobicContact CB-CG1 4.18Å; F202-I509 HydrophobicContact CD2-CD1 3.81Å; F202-I509 HydrophobicContact CD2-CG1 3.79Å; F202-I509 HydrophobicContact CE2-CD1 4.14Å; F202-I509 HydrophobicContact CE2-CG1 4.48Å; F202-I509 HydrophobicContact CG-CD1 4.5Å; F202-I509 HydrophobicContact CG-CG1 4Å; S505-I509 WeakPolarHBondContact O-CG1 3.07Å; S505-I509 PolarHBondContact O-N 3.41Å; I506-I509 PolarHBondContact O-N 2.86Å; I509-T512 WeakPolarHBondContact O-CB 3.32Å; I509-T512 PolarHBondContact O-N 3.38Å; I509-I513 HydrophobicContact CG2-CD1 4.06Å; I509-I513 WeakPolarHBondContact O-CG1 3.34Å; I509-I513 PolarHBondContact O-N 3.12Å; I509-I513 VanDerWaalsContact O-N 3.13Å
510	V	97.2	Very high	93.4	Very high	31 Å²	31	35.6 Å²	35.6	19%	0.188	19%	0.192	C	C	.	.	H	α-helix	trans	-70	-36.7	-175.8	-179	0	0	0	0	111.6	I506 T512 I513 A514 C561 A565	I506-V510 HydrophobicContact CG2-CG2 4.31Å; I506-V510 WeakPolarHBondContact O-CG2 3.16Å; I506-V510 PolarHBondContact O-N 3.12Å; V510-T512 VanDerWaalsContact C-N 3.33Å; V510-T512 PolarHBondContact O-N 2.98Å; V510-I513 PolarHBondContact O-N 3.37Å; V510-A514 VanDerWaalsContact O-CB 3.22Å; V510-A514 WeakPolarHBondContact O-CB 3.4Å; V510-A514 PolarHBondContact O-N 2.78Å; V510-C561 WeakPolarHBondContact CG1-O 3.42Å; V510-C561 HydrophobicContact CG2-CB 4.37Å; V510-A565 HydrophobicContact CG1-CB 3.8Å
511	N	92.8	Very high	93	Very high	1 Å²	1	38.8 Å²	38.8	1%	0.005	21%	0.208	C	C	.	.	H	α-helix	trans	-56.9	-47.1	171.6	178.3	-1.1	0	0	0	111.2	I507 I513 A514 R515 G564 G568	I507-N511 WeakPolarHBondContact O-CB 3.43Å; I507-N511 PolarHBondContact O-N 2.91Å; N511-I513 PolarHBondContact O-N 3.43Å; N511-A514 PolarHBondContact O-N 2.61Å; N511-R515 WeakPolarHBondContact O-CG 3.45Å; N511-R515 PolarHBondContact O-N 3.03Å; N511-R515 WeakPolarHBondContact OD1-CD 3.36Å; N511-G564 VanDerWaalsContact CA-O 3.29Å; N511-G564 WeakPolarHBondContact CA-O 3.41Å; N511-G568 WeakPolarHBondContact OD1-CA 3.37Å
512	T	91.9	Very high	92.3	Very high	27 Å²	27	38.8 Å²	38.8	17%	0.166	21%	0.208	C	C	.	.	H	α-helix	trans	-57.8	-49.5	178.2	-52.7	0	0	0	0	111.5	C195 G198 G508 I509 V510 R515 V516	C195-T512 HydrophobicContact CB-CG2 4.04Å; G198-T512 VanDerWaalsContact C-OG1 3.31Å; G198-T512 VanDerWaalsContact CA-OG1 3.26Å; G198-T512 WeakPolarHBondContact CA-OG1 3.5Å; G508-T512 PolarHBondContact O-N 3.41Å; G508-T512 PolarHBondContact O-OG1 3.13Å; I509-T512 WeakPolarHBondContact O-CB 3.32Å; I509-T512 PolarHBondContact O-N 3.38Å; V510-T512 VanDerWaalsContact C-N 3.33Å; V510-T512 PolarHBondContact O-N 2.98Å; T512-R515 PolarHBondContact O-N 3.48Å; T512-V516 PolarHBondContact O-N 3.29Å
513	I	94.3	Very high	91.5	Very high	102 Å²	102	38.7 Å²	38.7	52%	0.523	21%	0.208	S	C	.	.	H	α-helix	trans	-62	-46.7	178.4	-64.5	168.8	0	0	0	110.5	I509 V510 N511 R515 V516 V517	I509-I513 HydrophobicContact CG2-CD1 4.06Å; I509-I513 WeakPolarHBondContact O-CG1 3.34Å; I509-I513 PolarHBondContact O-N 3.12Å; I509-I513 VanDerWaalsContact O-N 3.13Å; V510-I513 PolarHBondContact O-N 3.37Å; N511-I513 PolarHBondContact O-N 3.43Å; I513-R515 VanDerWaalsContact C-N 3.32Å; I513-R515 PolarHBondContact O-N 3.15Å; I513-V516 PolarHBondContact O-N 3.06Å; I513-V517 HydrophobicContact CG2-CG2 4.24Å; I513-V517 WeakPolarHBondContact O-CG2 3.45Å; I513-V517 PolarHBondContact O-N 3.39Å
514	A	93.5	Very high	90.8	Very high	11 Å²	11	44.3 Å²	44.3	9%	0.091	23%	0.229	C	C	.	.	H	α-helix	trans	-63.6	-35.7	-177.9	0	0	0	0	0	112.7	V510 N511 V516 V517 C518 A565	V510-A514 VanDerWaalsContact O-CB 3.22Å; V510-A514 WeakPolarHBondContact O-CB 3.4Å; V510-A514 PolarHBondContact O-N 2.78Å; N511-A514 PolarHBondContact O-N 2.61Å; A514-V516 PolarHBondContact O-N 3.37Å; A514-V517 PolarHBondContact O-N 3.21Å; A514-C518 WeakPolarHBondContact O-CB 3.22Å; A514-C518 PolarHBondContact O-N 3.5Å; A514-C518 PolarHBondContact O-SG 3.14Å; A514-A565 HydrophobicContact CB-CB 4.21Å; A514-A565 WeakPolarHBondContact CB-O 3.15Å
515	R	89.3	Confident	89.9	Confident	23 Å²	23	49.6 Å²	49.6	9%	0.087	26%	0.263	C	S	.	.	H	α-helix	trans	-61	-44.2	174.4	-75.3	-177.4	131.1	166.3	3.2	112.4	V194 S197 N511 T512 I513 G519 M571	V194-R515 PolarHBondContact O-NH1 3.29Å; S197-R515 PolarHBondContact OG-NH1 3.03Å; N511-R515 WeakPolarHBondContact O-CG 3.45Å; N511-R515 PolarHBondContact O-N 3.03Å; N511-R515 WeakPolarHBondContact OD1-CD 3.36Å; T512-R515 PolarHBondContact O-N 3.48Å; I513-R515 VanDerWaalsContact C-N 3.32Å; I513-R515 PolarHBondContact O-N 3.15Å; R515-G519 PolarHBondContact O-N 2.83Å; R515-M571 PolarHBondContact NH2-SD 2.87Å; R515-M571 VanDerWaalsContact NH2-SD 3.42Å
516	V	89	Confident	89.2	Confident	91 Å²	91	56.9 Å²	56.9	55%	0.552	30%	0.297	S	S	*	.	H	α-helix	trans	-65	-48.2	177.7	178.4	0	0	0	0	110.5	T512 I513 A514 G519 W520	T512-V516 PolarHBondContact O-N 3.29Å; I513-V516 PolarHBondContact O-N 3.06Å; A514-V516 PolarHBondContact O-N 3.37Å; V516-G519 PolarHBondContact O-N 2.88Å; V516-W520 WeakPolarHBondContact O-CB 3.37Å; V516-W520 PolarHBondContact O-N 2.84Å
517	V	91	Very high	88.7	Confident	69 Å²	69	57 Å²	57	42%	0.418	30%	0.3	S	S	.	.	H	α-helix	trans	-63	-47.6	-179.8	173.9	0	0	0	0	111.3	I513 A514 G519 W520 M521	I513-V517 HydrophobicContact CG2-CG2 4.24Å; I513-V517 WeakPolarHBondContact O-CG2 3.45Å; I513-V517 PolarHBondContact O-N 3.39Å; A514-V517 PolarHBondContact O-N 3.21Å; V517-G519 PolarHBondContact O-N 3.49Å; V517-W520 PolarHBondContact O-N 3.25Å; V517-M521 HydrophobicContact CG1-CG 4.31Å; V517-M521 HydrophobicContact CG1-SD 3.87Å; V517-M521 WeakPolarHBondContact O-CB 3.28Å; V517-M521 VanDerWaalsContact O-CG 3.26Å; V517-M521 WeakPolarHBondContact O-CG 3.46Å; V517-M521 PolarHBondContact O-N 3.06Å
518	C	88.7	Confident	88.3	Confident	12 Å²	12	59 Å²	59	8%	0.081	31%	0.31	C	S	.	.	H	α-helix	trans	-67.1	-36.5	179.1	-69	0	0	0	0	112.4	A514 M521 A522 A569 M573	A514-C518 WeakPolarHBondContact O-CB 3.22Å; A514-C518 PolarHBondContact O-N 3.5Å; A514-C518 PolarHBondContact O-SG 3.14Å; C518-M521 PolarHBondContact O-N 3.47Å; C518-A522 VanDerWaalsContact O-CB 3.26Å; C518-A522 WeakPolarHBondContact O-CB 3.49Å; C518-A522 PolarHBondContact O-N 3.4Å; C518-A569 WeakPolarHBondContact SG-CB 3.44Å; C518-M573 HydrophobicContact CB-CE 4.11Å; C518-M573 WeakPolarHBondContact O-CE 3.29Å
519	G	82.6	Confident	88	Confident	31 Å²	31	59.5 Å²	59.5	32%	0.32	31%	0.314	S	S	.	.	H	α-helix	trans	-59.4	-48.2	172	0	0	0	0	0	111.6	R515 V516 V517 A522 D523	R515-G519 PolarHBondContact O-N 2.83Å; V516-G519 PolarHBondContact O-N 2.88Å; V517-G519 PolarHBondContact O-N 3.49Å; G519-A522 PolarHBondContact O-N 3.29Å; G519-D523 PolarHBondContact O-N 2.7Å
520	W	85.2	Confident	87.8	Confident	154 Å²	154	55.9 Å²	55.9	58%	0.583	30%	0.295	S	S	*	.	H	α-helix	trans	-63.5	-43.2	176.2	174.8	81	0	0	0	113.1	V516 V517 A522 D523	V516-W520 WeakPolarHBondContact O-CB 3.37Å; V516-W520 PolarHBondContact O-N 2.84Å; V517-W520 PolarHBondContact O-N 3.25Å; W520-A522 VanDerWaalsContact C-N 3.29Å; W520-A522 PolarHBondContact O-N 3.5Å; W520-D523 PolarHBondContact O-N 2.86Å
521	M	86.7	Confident	87.5	Confident	67 Å²	67	57.8 Å²	57.8	33%	0.33	31%	0.306	S	S	.	.	H	α-helix	trans	-61.4	-39.2	176	-73.2	173.9	70	0	0	111.6	V517 C518 D523 R524 V527 I532	V517-M521 HydrophobicContact CG1-CG 4.31Å; V517-M521 HydrophobicContact CG1-SD 3.87Å; V517-M521 WeakPolarHBondContact O-CB 3.28Å; V517-M521 VanDerWaalsContact O-CG 3.26Å; V517-M521 WeakPolarHBondContact O-CG 3.46Å; V517-M521 PolarHBondContact O-N 3.06Å; C518-M521 PolarHBondContact O-N 3.47Å; M521-D523 PolarHBondContact O-N 3.01Å; M521-R524 WeakPolarHBondContact O-CB 3.4Å; M521-R524 PolarHBondContact O-N 3.13Å; M521-R524 VanDerWaalsContact O-N 3.14Å; M521-V527 WeakPolarHBondContact O-CB 3.49Å; M521-I532 HydrophobicContact CB-CD1 4.28Å; M521-I532 HydrophobicContact CE-CD1 3.98Å
522	A	81.8	Confident	87.5	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.008	31%	0.312	C	S	.	.	H	α-helix	trans	-70.1	-17.4	-178	0	0	0	0	0	113.6	K410 C518 G519 W520 R524 M573 L576	K410-A522 WeakPolarHBondContact CE-O 3.29Å; K410-A522 PolarHBondContact NZ-O 3.35Å; C518-A522 VanDerWaalsContact O-CB 3.26Å; C518-A522 WeakPolarHBondContact O-CB 3.49Å; C518-A522 PolarHBondContact O-N 3.4Å; G519-A522 PolarHBondContact O-N 3.29Å; W520-A522 VanDerWaalsContact C-N 3.29Å; W520-A522 PolarHBondContact O-N 3.5Å; A522-R524 PolarHBondContact O-N 3.25Å; A522-M573 HydrophobicContact CB-CE 3.55Å; A522-M573 HydrophobicContact CB-SD 3.89Å; A522-L576 HydrophobicContact CB-CD1 3.52Å
523	D	78.5	Confident	87.6	Confident	70 Å²	70	57.8 Å²	57.8	37%	0.374	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	-6.2	173.7	-74.2	-28.8	0	0	0	113	N406 G519 W520 M521	N406-D523 PolarHBondContact ND2-OD1 3.28Å; G519-D523 PolarHBondContact O-N 2.7Å; W520-D523 PolarHBondContact O-N 2.86Å; M521-D523 PolarHBondContact O-N 3.01Å
524	R	83.1	Confident	87.5	Confident	118 Å²	118	53.4 Å²	53.4	45%	0.445	28%	0.283	S	S	.	.	S	Bend	trans	-84.2	129.2	176.3	-59.5	-63.1	177.2	177.9	-2.1	111.4	M521 A522 E526 V527	M521-R524 WeakPolarHBondContact O-CB 3.4Å; M521-R524 PolarHBondContact O-N 3.13Å; M521-R524 VanDerWaalsContact O-N 3.14Å; A522-R524 PolarHBondContact O-N 3.25Å; R524-E526 PolarHBondContact O-N 2.97Å; R524-V527 HydrophobicContact CB-CB 4.24Å; R524-V527 HydrophobicContact CB-CG2 3.74Å; R524-V527 PolarHBondContact O-N 3.35Å
525	P	78.2	Confident	87.5	Confident	113 Å²	113	56.3 Å²	56.3	73%	0.734	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-24.4	-177.9	25.7	-32.4	0	0	0	113.2	V527	P525-V527 PolarHBondContact O-N 3.03Å
526	E	82.7	Confident	87.8	Confident	156 Å²	156	55.6 Å²	55.6	73%	0.729	30%	0.301	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.6	-10.6	179.4	-53.3	78.9	-170.4	0	0	113.1	R524	R524-E526 PolarHBondContact O-N 2.97Å
527	V	86.8	Confident	88.1	Confident	43 Å²	43	51.3 Å²	51.3	26%	0.261	28%	0.275	S	S	.	.			trans	-101.6	114.4	-170	175.4	0	0	0	0	110.8	M521 R524 P525 C529 I532	M521-V527 WeakPolarHBondContact O-CB 3.49Å; R524-V527 HydrophobicContact CB-CB 4.24Å; R524-V527 HydrophobicContact CB-CG2 3.74Å; R524-V527 PolarHBondContact O-N 3.35Å; P525-V527 PolarHBondContact O-N 3.03Å; V527-C529 PolarHBondContact O-N 3.46Å; V527-I532 HydrophobicContact CG1-CD1 3.24Å; V527-I532 HydrophobicContact CG1-CG1 4.05Å
528	D	89.2	Confident	88.3	Confident	42 Å²	42	52.3 Å²	52.3	23%	0.225	27%	0.274	C	S	.	.			trans	-80.3	113.6	174	-166.2	-14.4	0	0	0	111.6	I530 V531 I532 K580 N641	D528-I530 PolarHBondContact O-N 3.47Å; D528-I530 WeakPolarHBondContact OD1-CB 3.35Å; D528-I530 PolarHBondContact OD1-N 3.09Å; D528-V531 HydrophobicContact CB-CB 4.22Å; D528-V531 HydrophobicContact CB-CG2 3.86Å; D528-V531 PolarHBondContact O-N 3.23Å; D528-I532 PolarHBondContact O-N 3.39Å; D528-K580 IonicContact OD1-NZ 2.81Å; D528-K580 PolarHBondContact OD1-NZ 3.28Å; D528-K580 IonicContact OD2-NZ 2.93Å; D528-K580 PolarHBondContact OD2-NZ 3.29Å; D528-N641 PolarHBondContact OD2-ND2 3.03Å; D528-N641 PolarHBondContact OD2-OD1 2.63Å
529	C	89.7	Confident	88.7	Confident	11 Å²	11	55 Å²	55	7%	0.074	29%	0.289	C	S	.	.	H	α-helix	trans	-58.2	-30.2	176.7	-57.8	0	0	0	0	112.8	V527 F533 M573 L576 V577	V527-C529 PolarHBondContact O-N 3.46Å; C529-F533 WeakPolarHBondContact O-CB 3.43Å; C529-F533 PolarHBondContact O-N 3.49Å; C529-M573 HydrophobicContact CB-SD 4.06Å; C529-L576 HydrophobicContact CB-CB 4.02Å; C529-V577 HydrophobicContact CB-CG2 4.35Å
530	I	91	Very high	89.4	Confident	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-66.7	-42	176.5	-70.3	171.6	0	0	0	110.3	D528 F533 N534 V577 K580 L581 L640 N641	D528-I530 PolarHBondContact O-N 3.47Å; D528-I530 WeakPolarHBondContact OD1-CB 3.35Å; D528-I530 PolarHBondContact OD1-N 3.09Å; I530-F533 PolarHBondContact O-N 3.38Å; I530-N534 WeakPolarHBondContact CG2-ND2 3.49Å; I530-N534 WeakPolarHBondContact O-CB 3.47Å; I530-N534 PolarHBondContact O-N 3.01Å; I530-N534 PolarHBondContact O-ND2 3.08Å; I530-N534 VanDerWaalsContact O-ND2 3.15Å; I530-N534 PolarHBondContact O-OD1 3.11Å; I530-V577 HydrophobicContact CG1-CB 4.4Å; I530-V577 HydrophobicContact CG1-CG1 3.89Å; I530-V577 HydrophobicContact CG1-CG2 3.95Å; I530-K580 HydrophobicContact CD1-CD 3.69Å; I530-K580 HydrophobicContact CD1-CG 4.22Å; I530-K580 HydrophobicContact CG1-CD 4.28Å; I530-L581 HydrophobicContact CD1-CD2 4.44Å; I530-L640 HydrophobicContact CD1-CD2 4.4Å; I530-L640 HydrophobicContact CG1-CD2 4.42Å; I530-L640 HydrophobicContact CG2-CB 4.28Å; I530-L640 HydrophobicContact CG2-CD2 4.04Å; I530-L640 HydrophobicContact CG2-CG 4.46Å; I530-N641 WeakPolarHBondContact CD1-OD1 3.36Å
531	V	91.9	Very high	90	Very high	71 Å²	71	46.2 Å²	46.2	43%	0.43	25%	0.246	S	C	.	.	H	α-helix	trans	-65.1	-46.9	178.9	176.3	0	0	0	0	110.4	D528 F533 N534 C535	D528-V531 HydrophobicContact CB-CB 4.22Å; D528-V531 HydrophobicContact CB-CG2 3.86Å; D528-V531 PolarHBondContact O-N 3.23Å; V531-F533 VanDerWaalsContact C-N 3.33Å; V531-F533 PolarHBondContact O-N 3.29Å; V531-N534 PolarHBondContact O-N 3.49Å; V531-C535 WeakPolarHBondContact O-CB 3.5Å; V531-C535 PolarHBondContact O-N 2.76Å; V531-C535 PolarHBondContact O-SG 2.83Å; V531-C535 VanDerWaalsContact O-SG 3.32Å
532	I	92.5	Very high	90.5	Very high	24 Å²	24	45.6 Å²	45.6	12%	0.123	24%	0.244	C	C	.	.	H	α-helix	trans	-56.7	-48.5	175.7	-65	-179.7	0	0	0	110.8	M521 V527 D528 N534 C535 A536 A569 M573	M521-I532 HydrophobicContact CB-CD1 4.28Å; M521-I532 HydrophobicContact CE-CD1 3.98Å; V527-I532 HydrophobicContact CG1-CD1 3.24Å; V527-I532 HydrophobicContact CG1-CG1 4.05Å; D528-I532 PolarHBondContact O-N 3.39Å; I532-N534 VanDerWaalsContact C-N 3.31Å; I532-N534 PolarHBondContact O-N 2.92Å; I532-C535 PolarHBondContact O-N 3.39Å; I532-A536 VanDerWaalsContact O-CB 3.3Å; I532-A536 WeakPolarHBondContact O-CB 3.34Å; I532-A536 PolarHBondContact O-N 3.45Å; I532-A569 HydrophobicContact CG2-CB 4.44Å; I532-M573 HydrophobicContact CB-CG 4.17Å; I532-M573 HydrophobicContact CB-SD 4.49Å; I532-M573 HydrophobicContact CD1-SD 4.47Å; I532-M573 HydrophobicContact CG2-CG 3.7Å; I532-M573 HydrophobicContact CG2-SD 4.33Å
533	F	93	Very high	91.3	Very high	5 Å²	5	45.9 Å²	45.9	2%	0.022	25%	0.246	C	C	.	.	H	α-helix	trans	-59.8	-40.9	-179.3	-175.8	-94.9	0	0	0	112.3	F468 C529 I530 V531 N537 L570 M573 R574 V577	F468-F533 HydrophobicContact CD2-CE1 4.24Å; F468-F533 HydrophobicContact CE2-CD1 4.04Å; F468-F533 AromaticContact CE2-CE1 3.56Å; F468-F533 HydrophobicContact CE2-CE1 3.56Å; F468-F533 HydrophobicContact CE2-CE2 4.44Å; F468-F533 AromaticContact CE2-CZ 3.78Å; F468-F533 HydrophobicContact CE2-CZ 3.78Å; F468-F533 HydrophobicContact CZ-CE1 4.49Å; F468-F533 HydrophobicContact CZ-CZ 4.3Å; C529-F533 WeakPolarHBondContact O-CB 3.43Å; C529-F533 PolarHBondContact O-N 3.49Å; I530-F533 PolarHBondContact O-N 3.38Å; V531-F533 VanDerWaalsContact C-N 3.33Å; V531-F533 PolarHBondContact O-N 3.29Å; F533-N537 WeakPolarHBondContact CE1-ND2 3.5Å; F533-N537 PolarHBondContact O-N 3.25Å; F533-N537 VanDerWaalsContact O-N 3.12Å; F533-N537 PolarHBondContact O-ND2 3.33Å; F533-N537 VanDerWaalsContact O-ND2 3.13Å; F533-L570 HydrophobicContact CD1-CD2 4.46Å; F533-L570 HydrophobicContact CD2-CD2 3.62Å; F533-L570 HydrophobicContact CE1-CD2 4.39Å; F533-L570 HydrophobicContact CE2-CB 4.29Å; F533-L570 HydrophobicContact CE2-CD2 3.55Å; F533-L570 HydrophobicContact CG-CD2 4.09Å; F533-L570 HydrophobicContact CZ-CD2 3.96Å; F533-L570 VanDerWaalsContact O-CD2 3.28Å; F533-L570 WeakPolarHBondContact O-CD2 3.46Å; F533-M573 HydrophobicContact CB-CB 4.05Å; F533-M573 HydrophobicContact CD2-CB 4.02Å; F533-R574 HydrophobicContact CE2-CB 4.25Å; F533-V577 HydrophobicContact CB-CG2 3.89Å; F533-V577 HydrophobicContact CG-CG2 4.17Å
534	N	93.3	Very high	92.2	Very high	10 Å²	10	42.5 Å²	42.5	5%	0.053	23%	0.228	C	C	.	.	H	α-helix	trans	-71.5	-45.2	179.3	-64	-20.2	0	0	0	112.2	I530 V531 I532 A536 N537 F538 G637	I530-N534 WeakPolarHBondContact CG2-ND2 3.49Å; I530-N534 WeakPolarHBondContact O-CB 3.47Å; I530-N534 PolarHBondContact O-N 3.01Å; I530-N534 PolarHBondContact O-ND2 3.08Å; I530-N534 VanDerWaalsContact O-ND2 3.15Å; I530-N534 PolarHBondContact O-OD1 3.11Å; V531-N534 PolarHBondContact O-N 3.49Å; I532-N534 VanDerWaalsContact C-N 3.31Å; I532-N534 PolarHBondContact O-N 2.92Å; N534-A536 VanDerWaalsContact C-N 3.28Å; N534-A536 PolarHBondContact O-N 2.97Å; N534-N537 PolarHBondContact O-N 3.47Å; N534-F538 WeakPolarHBondContact O-CB 3.47Å; N534-F538 PolarHBondContact O-N 3.02Å; N534-G637 PolarHBondContact ND2-O 3.16Å; N534-G637 VanDerWaalsContact OD1-CA 3.25Å; N534-G637 WeakPolarHBondContact OD1-CA 3.35Å
535	C	93.4	Very high	92.9	Very high	71 Å²	71	40.3 Å²	40.3	48%	0.48	22%	0.224	S	C	.	.	H	α-helix	trans	-58.7	-42.5	175.3	-71	0	0	0	0	111	V531 I532 F538 V539	V531-C535 WeakPolarHBondContact O-CB 3.5Å; V531-C535 PolarHBondContact O-N 2.76Å; V531-C535 PolarHBondContact O-SG 2.83Å; V531-C535 VanDerWaalsContact O-SG 3.32Å; I532-C535 PolarHBondContact O-N 3.39Å; C535-F538 PolarHBondContact O-N 2.95Å; C535-V539 WeakPolarHBondContact O-CB 3.25Å; C535-V539 VanDerWaalsContact O-CG2 3.31Å; C535-V539 WeakPolarHBondContact O-CG2 3.38Å; C535-V539 PolarHBondContact O-N 3.47Å
536	A	95.7	Very high	93.9	Very high	9 Å²	9	38.6 Å²	38.6	7%	0.074	21%	0.208	C	C	.	.	H	α-helix	trans	-61.7	-46.5	176.7	0	0	0	0	0	112.4	I532 N534 F538 T540 A569 L570	I532-A536 VanDerWaalsContact O-CB 3.3Å; I532-A536 WeakPolarHBondContact O-CB 3.34Å; I532-A536 PolarHBondContact O-N 3.45Å; N534-A536 VanDerWaalsContact C-N 3.28Å; N534-A536 PolarHBondContact O-N 2.97Å; A536-F538 VanDerWaalsContact C-N 3.34Å; A536-F538 PolarHBondContact O-N 3.33Å; A536-T540 WeakPolarHBondContact O-CB 3.05Å; A536-T540 WeakPolarHBondContact O-CG2 3.32Å; A536-T540 PolarHBondContact O-N 3.12Å; A536-T540 PolarHBondContact O-OG1 3.31Å; A536-A569 HydrophobicContact CB-CB 3.71Å; A536-L570 HydrophobicContact CB-CD2 3.89Å; A536-L570 HydrophobicContact CB-CG 3.98Å
537	N	95.7	Very high	94.6	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-60.4	-43.4	174.7	-87.4	-61.4	0	0	0	111.9	A475 F533 N534 T540 G541 L570	A475-N537 WeakPolarHBondContact CB-OD1 3.17Å; F533-N537 WeakPolarHBondContact CE1-ND2 3.5Å; F533-N537 PolarHBondContact O-N 3.25Å; F533-N537 VanDerWaalsContact O-N 3.12Å; F533-N537 PolarHBondContact O-ND2 3.33Å; F533-N537 VanDerWaalsContact O-ND2 3.13Å; N534-N537 PolarHBondContact O-N 3.47Å; N537-T540 WeakPolarHBondContact CA-OG1 3.29Å; N537-T540 PolarHBondContact O-OG1 3.5Å; N537-G541 PolarHBondContact O-N 2.97Å; N537-L570 HydrophobicContact CB-CD2 4.21Å; N537-L570 WeakPolarHBondContact ND2-CD2 3.18Å; N537-L570 WeakPolarHBondContact OD1-CD1 3.11Å
538	F	94.7	Very high	95	Very high	90 Å²	90	29.7 Å²	29.7	40%	0.395	16%	0.164	S	C	.	.	H	α-helix	trans	-67.5	-46	-176.9	-163.9	-103.6	0	0	0	111.8	N534 C535 A536 G541 I542 T631	N534-F538 WeakPolarHBondContact O-CB 3.47Å; N534-F538 PolarHBondContact O-N 3.02Å; C535-F538 PolarHBondContact O-N 2.95Å; A536-F538 VanDerWaalsContact C-N 3.34Å; A536-F538 PolarHBondContact O-N 3.33Å; F538-G541 PolarHBondContact O-N 3.27Å; F538-I542 HydrophobicContact CD1-CD1 3.65Å; F538-I542 HydrophobicContact CE1-CD1 3.19Å; F538-I542 HydrophobicContact CE1-CG1 4.38Å; F538-I542 HydrophobicContact CE2-CD1 4.22Å; F538-I542 HydrophobicContact CG-CD1 4.34Å; F538-I542 HydrophobicContact CZ-CD1 3.53Å; F538-I542 WeakPolarHBondContact O-CB 3.29Å; F538-I542 WeakPolarHBondContact O-CG1 3.34Å; F538-I542 PolarHBondContact O-N 2.88Å; F538-T631 HydrophobicContact CD2-CG2 3.89Å; F538-T631 HydrophobicContact CE2-CG2 3.72Å
539	V	96.1	Very high	95.4	Very high	68 Å²	68	32.8 Å²	32.8	41%	0.412	18%	0.177	S	C	.	.	H	α-helix	trans	-64	-45.8	177.4	171.2	0	0	0	0	111.1	C535 S543 L562	C535-V539 WeakPolarHBondContact O-CB 3.25Å; C535-V539 VanDerWaalsContact O-CG2 3.31Å; C535-V539 WeakPolarHBondContact O-CG2 3.38Å; C535-V539 PolarHBondContact O-N 3.47Å; V539-S543 VanDerWaalsContact O-CB 3.28Å; V539-S543 WeakPolarHBondContact O-CB 3.24Å; V539-S543 PolarHBondContact O-N 3.39Å; V539-S543 PolarHBondContact O-OG 3.36Å; V539-S543 VanDerWaalsContact O-OG 3.11Å; V539-L562 HydrophobicContact CG1-CD2 4.15Å
540	T	98	Very high	95.7	Very high	0 Å²	0	34 Å²	34	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-65.8	-38.4	178.5	49.2	0	0	0	0	112.7	A536 N537 S543 T544 M630	A536-T540 WeakPolarHBondContact O-CB 3.05Å; A536-T540 WeakPolarHBondContact O-CG2 3.32Å; A536-T540 PolarHBondContact O-N 3.12Å; A536-T540 PolarHBondContact O-OG1 3.31Å; N537-T540 WeakPolarHBondContact CA-OG1 3.29Å; N537-T540 PolarHBondContact O-OG1 3.5Å; T540-S543 PolarHBondContact O-OG 3.44Å; T540-S543 VanDerWaalsContact O-OG 3.11Å; T540-T544 VanDerWaalsContact O-CB 3.26Å; T540-T544 WeakPolarHBondContact O-CB 3.42Å; T540-T544 PolarHBondContact O-N 3.47Å; T540-T544 PolarHBondContact O-OG1 3.39Å; T540-M630 WeakPolarHBondContact OG1-CE 3.37Å
541	G	98.2	Very high	95.8	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-65.6	-50.9	176.7	0	0	0	0	0	112.1	N537 F538 S543 T544 M545 G627 T631	N537-G541 PolarHBondContact O-N 2.97Å; F538-G541 PolarHBondContact O-N 3.27Å; G541-S543 PolarHBondContact O-N 3.19Å; G541-T544 PolarHBondContact O-N 3.04Å; G541-M545 WeakPolarHBondContact O-CB 3.25Å; G541-M545 PolarHBondContact O-N 3.27Å; G541-G627 CarbonylContact C-O 3.6Å; G541-G627 VanDerWaalsContact CA-O 3.25Å; G541-G627 WeakPolarHBondContact CA-O 3.21Å; G541-G627 CarbonylContact O-C 3.6Å; G541-G627 WeakPolarHBondContact O-CA 3.25Å; G541-T631 WeakPolarHBondContact CA-OG1 3.42Å
542	I	97.7	Very high	96.1	Very high	55 Å²	55	39.1 Å²	39.1	28%	0.282	21%	0.207	S	C	.	.	H	α-helix	trans	-63	-45.2	178.4	-70.4	179	0	0	0	110.7	F538 T544 M545 L546 T631	F538-I542 HydrophobicContact CD1-CD1 3.65Å; F538-I542 HydrophobicContact CE1-CD1 3.19Å; F538-I542 HydrophobicContact CE1-CG1 4.38Å; F538-I542 HydrophobicContact CE2-CD1 4.22Å; F538-I542 HydrophobicContact CG-CD1 4.34Å; F538-I542 HydrophobicContact CZ-CD1 3.53Å; F538-I542 WeakPolarHBondContact O-CB 3.29Å; F538-I542 WeakPolarHBondContact O-CG1 3.34Å; F538-I542 PolarHBondContact O-N 2.88Å; I542-T544 VanDerWaalsContact C-N 3.28Å; I542-T544 PolarHBondContact O-N 3.47Å; I542-M545 PolarHBondContact O-N 3.39Å; I542-L546 HydrophobicContact CG2-CD1 3.86Å; I542-L546 HydrophobicContact CG2-CG 4.32Å; I542-L546 WeakPolarHBondContact O-CG 3.41Å; I542-L546 PolarHBondContact O-N 3.28Å; I542-T631 HydrophobicContact CG1-CG2 4.08Å; I542-T631 PolarHBondContact N-OG1 3.46Å
543	S	97.9	Very high	96.3	Very high	6 Å²	6	40.5 Å²	40.5	4%	0.042	21%	0.212	C	C	.	.	H	α-helix	trans	-62.6	-37.4	179.3	71.2	0	0	0	0	111.8	V539 T540 G541 L546 L547 Y559	V539-S543 VanDerWaalsContact O-CB 3.28Å; V539-S543 WeakPolarHBondContact O-CB 3.24Å; V539-S543 PolarHBondContact O-N 3.39Å; V539-S543 PolarHBondContact O-OG 3.36Å; V539-S543 VanDerWaalsContact O-OG 3.11Å; T540-S543 PolarHBondContact O-OG 3.44Å; T540-S543 VanDerWaalsContact O-OG 3.11Å; G541-S543 PolarHBondContact O-N 3.19Å; S543-L546 PolarHBondContact O-N 3.3Å; S543-L547 PolarHBondContact O-N 3.43Å; S543-L547 VanDerWaalsContact O-N 3.07Å; S543-Y559 WeakPolarHBondContact O-CD2 3.48Å
544	T	98.3	Very high	96.6	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-70.9	-35.8	176.1	-56	0	0	0	0	111.9	P482 T540 G541 I542 L546 L547 Y559	P482-T544 HydrophobicContact CG-CG2 3.98Å; T540-T544 VanDerWaalsContact O-CB 3.26Å; T540-T544 WeakPolarHBondContact O-CB 3.42Å; T540-T544 PolarHBondContact O-N 3.47Å; T540-T544 PolarHBondContact O-OG1 3.39Å; G541-T544 PolarHBondContact O-N 3.04Å; I542-T544 VanDerWaalsContact C-N 3.28Å; I542-T544 PolarHBondContact O-N 3.47Å; T544-L546 VanDerWaalsContact C-N 3.31Å; T544-L546 PolarHBondContact O-N 3.4Å; T544-L547 WeakPolarHBondContact O-CB 3.37Å; T544-L547 PolarHBondContact O-N 3.12Å; T544-Y559 WeakPolarHBondContact OG1-CE2 3.5Å; T544-Y559 PolarHBondContact OG1-OH 2.82Å
545	M	97.4	Very high	96.8	Very high	72 Å²	72	47.4 Å²	47.4	36%	0.355	25%	0.253	S	S	.	.	H	α-helix	trans	-69.2	-30.6	174.7	-165.8	175.3	67.7	0	0	112	G541 I542 P548 Y624	G541-M545 WeakPolarHBondContact O-CB 3.25Å; G541-M545 PolarHBondContact O-N 3.27Å; I542-M545 PolarHBondContact O-N 3.39Å; M545-P548 WeakPolarHBondContact O-CD 3.47Å; M545-Y624 HydrophobicContact CG-CD1 3.87Å; M545-Y624 VanDerWaalsContact O-CD1 3.24Å; M545-Y624 WeakPolarHBondContact O-CD1 3.34Å; M545-Y624 WeakPolarHBondContact O-CE1 3.15Å
546	L	97.8	Very high	97	Very high	76 Å²	76	44 Å²	44	40%	0.398	23%	0.23	S	C	.	.	H	α-helix	trans	-80.3	-18	174.9	-68.8	174.9	0	0	0	113.4	I542 S543 T544 P548 H549 F550	I542-L546 HydrophobicContact CG2-CD1 3.86Å; I542-L546 HydrophobicContact CG2-CG 4.32Å; I542-L546 WeakPolarHBondContact O-CG 3.41Å; I542-L546 PolarHBondContact O-N 3.28Å; S543-L546 PolarHBondContact O-N 3.3Å; T544-L546 VanDerWaalsContact C-N 3.31Å; T544-L546 PolarHBondContact O-N 3.4Å; L546-P548 VanDerWaalsContact C-N 3.34Å; L546-H549 WeakPolarHBondContact O-CB 3.49Å; L546-H549 PolarHBondContact O-N 3.3Å; L546-H549 PolarHBondContact O-ND1 3.03Å; L546-H549 VanDerWaalsContact O-ND1 3.17Å; L546-F550 HydrophobicContact CB-CE1 4.33Å; L546-F550 HydrophobicContact CB-CZ 4Å
547	L	97.7	Very high	97.1	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.005	23%	0.234	C	C	.	.	G	3₁₀ helix	trans	-48.7	-41.5	-176.1	177.8	61.9	0	0	0	115	L486 S543 T544 H549 F550 L556 Y559 F623	L486-L547 HydrophobicContact CD1-CD1 3.76Å; L486-L547 HydrophobicContact CD1-CD2 3.84Å; L486-L547 HydrophobicContact CD1-CG 4.36Å; S543-L547 PolarHBondContact O-N 3.43Å; S543-L547 VanDerWaalsContact O-N 3.07Å; T544-L547 WeakPolarHBondContact O-CB 3.37Å; T544-L547 PolarHBondContact O-N 3.12Å; L547-H549 PolarHBondContact O-N 3.1Å; L547-F550 HydrophobicContact CD1-CB 4.44Å; L547-F550 HydrophobicContact CD1-CD2 4.28Å; L547-F550 WeakPolarHBondContact O-CB 3.39Å; L547-F550 PolarHBondContact O-N 3.32Å; L547-L556 HydrophobicContact CD1-CD2 3.62Å; L547-Y559 HydrophobicContact CB-CD2 4.36Å; L547-Y559 HydrophobicContact CB-CE2 4.36Å; L547-Y559 HydrophobicContact CD1-CD1 3.61Å; L547-Y559 HydrophobicContact CD1-CD2 4.21Å; L547-Y559 HydrophobicContact CD1-CE1 4Å; L547-Y559 HydrophobicContact CD1-CG 3.71Å; L547-Y559 HydrophobicContact CD2-CD1 4.26Å; L547-Y559 HydrophobicContact CD2-CE1 3.76Å; L547-Y559 HydrophobicContact CD2-CE2 4.35Å; L547-Y559 HydrophobicContact CG-CD1 4.47Å; L547-Y559 HydrophobicContact CG-CE1 4.43Å; L547-F623 HydrophobicContact CD2-CB 4.48Å; L547-F623 HydrophobicContact CD2-CD1 3.59Å; L547-F623 HydrophobicContact CD2-CD2 3.97Å; L547-F623 HydrophobicContact CD2-CE1 3.67Å; L547-F623 HydrophobicContact CD2-CE2 4.04Å; L547-F623 HydrophobicContact CD2-CG 3.76Å; L547-F623 HydrophobicContact CD2-CZ 3.9Å; L547-F623 HydrophobicContact CG-CD2 4.39Å; L547-F623 HydrophobicContact CG-CG 4.43Å
548	P	96.5	Very high	97.2	Very high	11 Å²	11	48.3 Å²	48.3	7%	0.071	26%	0.256	C	S	.	.	G	3₁₀ helix	trans	-55.6	-22.4	176.6	-30.1	39.7	0	0	0	115	M545 L546 Q620 F623 Y624	M545-P548 WeakPolarHBondContact O-CD 3.47Å; L546-P548 VanDerWaalsContact C-N 3.34Å; P548-Q620 HydrophobicContact CB-CB 4.07Å; P548-Q620 HydrophobicContact CB-CG 4.01Å; P548-Q620 HydrophobicContact CG-CB 4.2Å; P548-F623 HydrophobicContact CG-CB 3.92Å; P548-F623 HydrophobicContact CG-CD2 4.47Å; P548-Y624 HydrophobicContact CB-CE1 4.29Å; P548-Y624 HydrophobicContact CB-CE2 4.35Å; P548-Y624 HydrophobicContact CG-CD1 4.21Å; P548-Y624 HydrophobicContact CG-CE1 3.84Å; P548-Y624 HydrophobicContact CG-CE2 4.16Å
549	H	96.3	Very high	97.4	Very high	108 Å²	108	44 Å²	44	50%	0.5	24%	0.238	S	C	.	.	G	3₁₀ helix	trans	-90.1	-9.3	179.1	-51.3	89.6	0	0	0	113	L546 L547 I551 Y624	L546-H549 WeakPolarHBondContact O-CB 3.49Å; L546-H549 PolarHBondContact O-N 3.3Å; L546-H549 PolarHBondContact O-ND1 3.03Å; L546-H549 VanDerWaalsContact O-ND1 3.17Å; L547-H549 PolarHBondContact O-N 3.1Å; H549-I551 PolarHBondContact O-N 3.43Å; H549-I551 VanDerWaalsContact O-N 3.1Å; H549-Y624 AromaticContact CE1-CE1 3.8Å; H549-Y624 AromaticContact CE1-CZ 3.86Å; H549-Y624 PolarHBondContact CE1-OH 3.32Å; H549-Y624 PolarHBondContact NE2-OH 2.98Å
550	F	95.8	Very high	97.5	Very high	37 Å²	37	40.8 Å²	40.8	16%	0.162	22%	0.218	C	C	.	.			trans	-86.6	77.7	179.5	-65	-12.7	0	0	0	110.4	L546 L547 L555 L556	L546-F550 HydrophobicContact CB-CE1 4.33Å; L546-F550 HydrophobicContact CB-CZ 4Å; L547-F550 HydrophobicContact CD1-CB 4.44Å; L547-F550 HydrophobicContact CD1-CD2 4.28Å; L547-F550 WeakPolarHBondContact O-CB 3.39Å; L547-F550 PolarHBondContact O-N 3.32Å; F550-L555 HydrophobicContact CB-CB 3.68Å; F550-L555 HydrophobicContact CD1-CB 4.12Å; F550-L555 HydrophobicContact CD1-CD1 4.37Å; F550-L555 HydrophobicContact CG-CB 3.89Å; F550-L556 HydrophobicContact CB-CD2 4.09Å; F550-L556 WeakPolarHBondContact O-CD2 3.43Å; F550-L556 WeakPolarHBondContact O-CG 3.39Å
551	I	94.6	Very high	97.5	Very high	110 Å²	110	43.4 Å²	43.4	56%	0.564	24%	0.235	S	C	*	.			trans	-77.8	-18.3	-174.1	50.8	170.3	0	0	0	114.6	L493 H549	L493-I551 HydrophobicContact CD2-CB 4.42Å; L493-I551 HydrophobicContact CD2-CG2 4.19Å; H549-I551 PolarHBondContact O-N 3.43Å; H549-I551 VanDerWaalsContact O-N 3.1Å
552	T	96.9	Very high	97.5	Very high	67 Å²	67	46.7 Å²	46.7	41%	0.411	25%	0.253	S	S	.	.	S	Bend	trans	-106.1	149.3	-178.2	62.6	0	0	0	0	111.8	L555 L556	T552-L555 PolarHBondContact O-N 3.21Å; T552-L555 WeakPolarHBondContact OG1-CD1 3.48Å; T552-L555 WeakPolarHBondContact OG1-CG 3.4Å; T552-L556 PolarHBondContact O-N 3.12Å
553	Y	97.7	Very high	97.6	Very high	54 Å²	54	44 Å²	44	21%	0.212	24%	0.239	C	C	.	.	H	α-helix	trans	-53.9	-41.2	179.8	-168.2	-93.6	0	0	0	114.5	L499 L503 L555 L556 S557	L499-Y553 HydrophobicContact CB-CE2 3.91Å; L499-Y553 VanDerWaalsContact O-CE2 3.27Å; L499-Y553 WeakPolarHBondContact O-CE2 3.39Å; L499-Y553 PolarHBondContact O-OH 3.38Å; L503-Y553 HydrophobicContact CD1-CE2 4.43Å; L503-Y553 HydrophobicContact CD2-CD2 4.31Å; L503-Y553 HydrophobicContact CD2-CE2 3.73Å; L503-Y553 HydrophobicContact CG-CE2 3.95Å; Y553-L555 VanDerWaalsContact C-N 3.34Å; Y553-L555 PolarHBondContact O-N 3.3Å; Y553-L556 PolarHBondContact O-N 2.81Å; Y553-S557 WeakPolarHBondContact CE1-OG 3.4Å; Y553-S557 WeakPolarHBondContact O-CB 3.28Å; Y553-S557 PolarHBondContact O-N 3.39Å; Y553-S557 PolarHBondContact O-OG 3.34Å
554	P	98	Very high	97.5	Very high	89 Å²	89	43.8 Å²	43.8	58%	0.578	24%	0.237	S	C	*	.	H	α-helix	trans	-62.2	-37.7	175	-25	36.7	0	0	0	113.4	S557 V558	P554-S557 WeakPolarHBondContact O-CB 3.44Å; P554-S557 PolarHBondContact O-N 3.31Å; P554-V558 WeakPolarHBondContact O-CG2 3.35Å; P554-V558 PolarHBondContact O-N 3.3Å
555	L	97.9	Very high	97.4	Very high	70 Å²	70	45.5 Å²	45.5	37%	0.366	25%	0.252	S	S	.	.	H	α-helix	trans	-69.4	-40.1	176.7	-67.9	174.6	0	0	0	111.6	F550 T552 Y553 S557 V558 Y559	F550-L555 HydrophobicContact CB-CB 3.68Å; F550-L555 HydrophobicContact CD1-CB 4.12Å; F550-L555 HydrophobicContact CD1-CD1 4.37Å; F550-L555 HydrophobicContact CG-CB 3.89Å; T552-L555 PolarHBondContact O-N 3.21Å; T552-L555 WeakPolarHBondContact OG1-CD1 3.48Å; T552-L555 WeakPolarHBondContact OG1-CG 3.4Å; Y553-L555 VanDerWaalsContact C-N 3.34Å; Y553-L555 PolarHBondContact O-N 3.3Å; L555-S557 VanDerWaalsContact C-N 3.25Å; L555-S557 PolarHBondContact O-N 3.19Å; L555-V558 PolarHBondContact O-N 3.07Å; L555-Y559 PolarHBondContact O-N 3.25Å
556	L	98.2	Very high	97.4	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.7	-38.4	171.3	-64.8	175.5	0	0	0	111.3	L486 A490 L493 L503 L547 F550 T552 Y553 Y559 C560	L486-L556 HydrophobicContact CD1-CD2 4.15Å; A490-L556 HydrophobicContact CB-CD1 3.88Å; L493-L556 HydrophobicContact CD1-CD1 4.29Å; L503-L556 HydrophobicContact CD1-CB 4.19Å; L503-L556 HydrophobicContact CD1-CD1 4.15Å; L503-L556 HydrophobicContact CD2-CB 3.9Å; L547-L556 HydrophobicContact CD1-CD2 3.62Å; F550-L556 HydrophobicContact CB-CD2 4.09Å; F550-L556 WeakPolarHBondContact O-CD2 3.43Å; F550-L556 WeakPolarHBondContact O-CG 3.39Å; T552-L556 PolarHBondContact O-N 3.12Å; Y553-L556 PolarHBondContact O-N 2.81Å; L556-Y559 WeakPolarHBondContact O-CB 3.31Å; L556-Y559 PolarHBondContact O-N 2.92Å; L556-C560 PolarHBondContact O-N 3.48Å; L556-C560 PolarHBondContact O-SG 2.9Å
557	S	98.2	Very high	97.2	Very high	22 Å²	22	38.9 Å²	38.9	15%	0.154	22%	0.22	C	C	.	.	H	α-helix	trans	-67.1	-42.1	176.4	-58.6	0	0	0	0	112.1	Y553 P554 L555 Y559 C560 C561	Y553-S557 WeakPolarHBondContact CE1-OG 3.4Å; Y553-S557 WeakPolarHBondContact O-CB 3.28Å; Y553-S557 PolarHBondContact O-N 3.39Å; Y553-S557 PolarHBondContact O-OG 3.34Å; P554-S557 WeakPolarHBondContact O-CB 3.44Å; P554-S557 PolarHBondContact O-N 3.31Å; L555-S557 VanDerWaalsContact C-N 3.25Å; L555-S557 PolarHBondContact O-N 3.19Å; S557-Y559 VanDerWaalsContact C-N 3.3Å; S557-Y559 PolarHBondContact O-N 3.11Å; S557-C560 WeakPolarHBondContact O-CB 3.37Å; S557-C560 PolarHBondContact O-N 3.33Å; S557-C560 VanDerWaalsContact O-N 3.13Å; S557-C561 PolarHBondContact O-N 3Å; S557-C561 PolarHBondContact O-SG 3.32Å; S557-C561 VanDerWaalsContact O-SG 3.39Å
558	V	98.2	Very high	97	Very high	79 Å²	79	38.9 Å²	38.9	48%	0.479	22%	0.219	S	C	.	.	H	α-helix	trans	-59.5	-43.1	172.9	170.1	0	0	0	0	110.7	P554 L555 C560 C561 L562	P554-V558 WeakPolarHBondContact O-CG2 3.35Å; P554-V558 PolarHBondContact O-N 3.3Å; L555-V558 PolarHBondContact O-N 3.07Å; V558-C560 PolarHBondContact O-N 3.12Å; V558-C561 WeakPolarHBondContact O-CB 3.36Å; V558-C561 PolarHBondContact O-N 3.48Å; V558-L562 HydrophobicContact CG1-CD1 4.33Å; V558-L562 WeakPolarHBondContact O-CG 3.26Å; V558-L562 PolarHBondContact O-N 2.93Å
559	Y	98.5	Very high	96.8	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-57.8	-46.5	172.3	164.7	-102.1	0	0	0	112.4	P482 L486 S543 T544 L547 L555 L556 S557 C561 L562 F563	P482-Y559 HydrophobicContact CB-CE1 4.48Å; P482-Y559 WeakPolarHBondContact CB-OH 3.41Å; P482-Y559 WeakPolarHBondContact CG-OH 3.47Å; L486-Y559 HydrophobicContact CD1-CD1 4.08Å; L486-Y559 HydrophobicContact CD1-CE1 4.02Å; L486-Y559 HydrophobicContact CD2-CD1 4.09Å; L486-Y559 HydrophobicContact CD2-CE1 3.86Å; L486-Y559 HydrophobicContact CG-CE1 4.5Å; S543-Y559 WeakPolarHBondContact O-CD2 3.48Å; T544-Y559 WeakPolarHBondContact OG1-CE2 3.5Å; T544-Y559 PolarHBondContact OG1-OH 2.82Å; L547-Y559 HydrophobicContact CB-CD2 4.36Å; L547-Y559 HydrophobicContact CB-CE2 4.36Å; L547-Y559 HydrophobicContact CD1-CD1 3.61Å; L547-Y559 HydrophobicContact CD1-CD2 4.21Å; L547-Y559 HydrophobicContact CD1-CE1 4Å; L547-Y559 HydrophobicContact CD1-CG 3.71Å; L547-Y559 HydrophobicContact CD2-CD1 4.26Å; L547-Y559 HydrophobicContact CD2-CE1 3.76Å; L547-Y559 HydrophobicContact CD2-CE2 4.35Å; L547-Y559 HydrophobicContact CG-CD1 4.47Å; L547-Y559 HydrophobicContact CG-CE1 4.43Å; L555-Y559 PolarHBondContact O-N 3.25Å; L556-Y559 WeakPolarHBondContact O-CB 3.31Å; L556-Y559 PolarHBondContact O-N 2.92Å; S557-Y559 VanDerWaalsContact C-N 3.3Å; S557-Y559 PolarHBondContact O-N 3.11Å; Y559-C561 PolarHBondContact O-N 2.9Å; Y559-L562 PolarHBondContact O-N 3.28Å; Y559-L562 VanDerWaalsContact O-N 3.12Å; Y559-F563 HydrophobicContact CE1-CB 4.27Å; Y559-F563 HydrophobicContact CE2-CB 3.99Å; Y559-F563 HydrophobicContact CE2-CD2 4.26Å; Y559-F563 HydrophobicContact CE2-CG 4.39Å; Y559-F563 AromaticContact CZ-CD2 3.99Å; Y559-F563 AromaticContact CZ-CG 3.97Å; Y559-F563 WeakPolarHBondContact O-CB 3.21Å; Y559-F563 PolarHBondContact O-N 2.68Å; Y559-F563 WeakPolarHBondContact OH-CD2 3.43Å
560	C	98.4	Very high	96.7	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-57.9	-38.6	178.2	-67.6	0	0	0	0	112	L503 I506 I507 L556 S557 V558 G564	L503-C560 PolarHBondContact O-SG 3.44Å; L503-C560 VanDerWaalsContact O-SG 3.39Å; I506-C560 HydrophobicContact CB-CB 3.86Å; I506-C560 HydrophobicContact CG2-CB 3.56Å; I507-C560 HydrophobicContact CD1-CB 4.49Å; I507-C560 HydrophobicContact CG1-CB 3.69Å; L556-C560 PolarHBondContact O-N 3.48Å; L556-C560 PolarHBondContact O-SG 2.9Å; S557-C560 WeakPolarHBondContact O-CB 3.37Å; S557-C560 PolarHBondContact O-N 3.33Å; S557-C560 VanDerWaalsContact O-N 3.13Å; V558-C560 PolarHBondContact O-N 3.12Å; C560-G564 PolarHBondContact O-N 3.2Å
561	C	98.3	Very high	96.4	Very high	54 Å²	54	34.7 Å²	34.7	37%	0.365	20%	0.202	S	C	.	.	H	α-helix	trans	-64	-48.3	174.2	-65	0	0	0	0	112	V510 S557 V558 Y559 A565	V510-C561 WeakPolarHBondContact CG1-O 3.42Å; V510-C561 HydrophobicContact CG2-CB 4.37Å; S557-C561 PolarHBondContact O-N 3Å; S557-C561 PolarHBondContact O-SG 3.32Å; S557-C561 VanDerWaalsContact O-SG 3.39Å; V558-C561 WeakPolarHBondContact O-CB 3.36Å; V558-C561 PolarHBondContact O-N 3.48Å; Y559-C561 PolarHBondContact O-N 2.9Å; C561-A565 WeakPolarHBondContact O-CB 3.33Å; C561-A565 PolarHBondContact O-N 3.47Å
562	L	98.2	Very high	96	Very high	69 Å²	69	30.4 Å²	30.4	36%	0.361	18%	0.182	S	C	.	.	H	α-helix	trans	-63.2	-44.7	178.9	-66.8	173.4	0	0	0	111.8	V539 V558 Y559 G566	V539-L562 HydrophobicContact CG1-CD2 4.15Å; V558-L562 HydrophobicContact CG1-CD1 4.33Å; V558-L562 WeakPolarHBondContact O-CG 3.26Å; V558-L562 PolarHBondContact O-N 2.93Å; Y559-L562 PolarHBondContact O-N 3.28Å; Y559-L562 VanDerWaalsContact O-N 3.12Å; L562-G566 PolarHBondContact O-N 3.27Å
563	F	97.9	Very high	95.6	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-67	-51.4	-179.9	-171.8	-99.9	0	0	0	111.4	P482 Y483 I507 Y559 A565 G566 I567 M630	P482-F563 HydrophobicContact CB-CE1 4.03Å; P482-F563 HydrophobicContact CB-CE2 4.21Å; P482-F563 HydrophobicContact CB-CZ 3.86Å; P482-F563 HydrophobicContact CG-CD2 4.42Å; P482-F563 HydrophobicContact CG-CE1 4.4Å; P482-F563 HydrophobicContact CG-CE2 3.75Å; P482-F563 HydrophobicContact CG-CZ 3.73Å; Y483-F563 HydrophobicContact CD2-CE1 4.06Å; Y483-F563 AromaticContact CE2-CE1 3.64Å; Y483-F563 HydrophobicContact CE2-CE1 3.64Å; Y483-F563 HydrophobicContact CE2-CZ 4.29Å; I507-F563 HydrophobicContact CD1-CD1 3.96Å; I507-F563 HydrophobicContact CG1-CD1 4.37Å; I507-F563 HydrophobicContact CG2-CD1 4.11Å; Y559-F563 HydrophobicContact CE1-CB 4.27Å; Y559-F563 HydrophobicContact CE2-CB 3.99Å; Y559-F563 HydrophobicContact CE2-CD2 4.26Å; Y559-F563 HydrophobicContact CE2-CG 4.39Å; Y559-F563 AromaticContact CZ-CD2 3.99Å; Y559-F563 AromaticContact CZ-CG 3.97Å; Y559-F563 WeakPolarHBondContact O-CB 3.21Å; Y559-F563 PolarHBondContact O-N 2.68Å; Y559-F563 WeakPolarHBondContact OH-CD2 3.43Å; F563-A565 VanDerWaalsContact C-N 3.32Å; F563-A565 PolarHBondContact O-N 3.33Å; F563-G566 PolarHBondContact O-N 3.16Å; F563-I567 HydrophobicContact CD1-CG1 3.99Å; F563-I567 HydrophobicContact CD2-CG1 4.42Å; F563-I567 HydrophobicContact CE1-CD1 4.38Å; F563-I567 HydrophobicContact CE1-CG1 3.63Å; F563-I567 HydrophobicContact CE2-CD1 4.08Å; F563-I567 HydrophobicContact CE2-CG1 4.09Å; F563-I567 HydrophobicContact CG-CG1 4.38Å; F563-I567 HydrophobicContact CZ-CD1 3.91Å; F563-I567 HydrophobicContact CZ-CG1 3.68Å; F563-I567 WeakPolarHBondContact O-CB 3.38Å; F563-I567 WeakPolarHBondContact O-CG1 3.35Å; F563-I567 PolarHBondContact O-N 2.87Å; F563-M630 HydrophobicContact CE2-CE 4.08Å; F563-M630 HydrophobicContact CE2-SD 4.38Å
564	G	97	Very high	95.3	Very high	0 Å²	0	27.3 Å²	27.3	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-57.8	-42.8	177.4	0	0	0	0	0	112.6	N511 C560 G568	N511-G564 VanDerWaalsContact CA-O 3.29Å; N511-G564 WeakPolarHBondContact CA-O 3.41Å; C560-G564 PolarHBondContact O-N 3.2Å; G564-G568 PolarHBondContact O-N 2.94Å
565	A	96.9	Very high	94.7	Very high	37 Å²	37	23.2 Å²	23.2	31%	0.306	14%	0.135	S	C	.	.	H	α-helix	trans	-63.9	-48	178.3	0	0	0	0	0	111.9	V510 A514 C561 F563 G568 A569	V510-A565 HydrophobicContact CG1-CB 3.8Å; A514-A565 HydrophobicContact CB-CB 4.21Å; A514-A565 WeakPolarHBondContact CB-O 3.15Å; C561-A565 WeakPolarHBondContact O-CB 3.33Å; C561-A565 PolarHBondContact O-N 3.47Å; F563-A565 VanDerWaalsContact C-N 3.32Å; F563-A565 PolarHBondContact O-N 3.33Å; A565-G568 PolarHBondContact O-N 3.08Å; A565-A569 PolarHBondContact O-N 2.92Å
566	G	96.2	Very high	94.2	Very high	6 Å²	6	20.8 Å²	20.8	6%	0.062	12%	0.123	C	C	.	.	H	α-helix	trans	-71	-37.5	-178.9	0	0	0	0	0	113	L562 F563 G568 A569 L570	L562-G566 PolarHBondContact O-N 3.27Å; F563-G566 PolarHBondContact O-N 3.16Å; G566-G568 VanDerWaalsContact C-N 3.35Å; G566-G568 PolarHBondContact O-N 3.27Å; G566-A569 WeakPolarHBondContact O-CB 3.27Å; G566-A569 PolarHBondContact O-N 3.42Å; G566-L570 WeakPolarHBondContact O-CB 3.35Å; G566-L570 WeakPolarHBondContact O-CG 3.39Å; G566-L570 PolarHBondContact O-N 3.44Å
567	I	94.3	Very high	93.9	Very high	3 Å²	3	20.8 Å²	20.8	2%	0.015	12%	0.123	C	C	.	.	H	α-helix	trans	-60	-45.3	171.4	-68.4	-41.7	0	0	0	111.2	F479 F563 A569 L570 M571 M630	F479-I567 HydrophobicContact CD2-CD1 3.53Å; F479-I567 HydrophobicContact CD2-CG1 4.14Å; F479-I567 HydrophobicContact CE2-CB 4.41Å; F479-I567 HydrophobicContact CE2-CD1 3.77Å; F479-I567 HydrophobicContact CE2-CG1 3.91Å; F479-I567 HydrophobicContact CE2-CG2 3.61Å; F479-I567 HydrophobicContact CZ-CG2 4.41Å; F563-I567 HydrophobicContact CD1-CG1 3.99Å; F563-I567 HydrophobicContact CD2-CG1 4.42Å; F563-I567 HydrophobicContact CE1-CD1 4.38Å; F563-I567 HydrophobicContact CE1-CG1 3.63Å; F563-I567 HydrophobicContact CE2-CD1 4.08Å; F563-I567 HydrophobicContact CE2-CG1 4.09Å; F563-I567 HydrophobicContact CG-CG1 4.38Å; F563-I567 HydrophobicContact CZ-CD1 3.91Å; F563-I567 HydrophobicContact CZ-CG1 3.68Å; F563-I567 WeakPolarHBondContact O-CB 3.38Å; F563-I567 WeakPolarHBondContact O-CG1 3.35Å; F563-I567 PolarHBondContact O-N 2.87Å; I567-A569 VanDerWaalsContact C-N 3.29Å; I567-A569 PolarHBondContact O-N 3.32Å; I567-L570 HydrophobicContact CD1-CD1 4.08Å; I567-L570 PolarHBondContact O-N 3.35Å; I567-M571 HydrophobicContact CG2-CG 4.3Å; I567-M571 HydrophobicContact CG2-SD 4.14Å; I567-M571 WeakPolarHBondContact O-CG 3.38Å; I567-M571 PolarHBondContact O-N 2.96Å; I567-M630 HydrophobicContact CD1-CE 4.12Å
568	G	92.8	Very high	93.6	Very high	0 Å²	0	19.8 Å²	19.8	0%	0	12%	0.115	C	C	.	.	H	α-helix	trans	-58.4	-41.6	176.6	0	0	0	0	0	112.4	N511 G564 A565 G566 S572	N511-G568 WeakPolarHBondContact OD1-CA 3.37Å; G564-G568 PolarHBondContact O-N 2.94Å; A565-G568 PolarHBondContact O-N 3.08Å; G566-G568 VanDerWaalsContact C-N 3.35Å; G566-G568 PolarHBondContact O-N 3.27Å; G568-S572 WeakPolarHBondContact O-CB 3.36Å; G568-S572 PolarHBondContact O-N 3.13Å; G568-S572 PolarHBondContact O-OG 3.12Å
569	A	93.3	Very high	93.1	Very high	6 Å²	6	16.3 Å²	16.3	5%	0.05	9%	0.094	C	C	.	.	H	α-helix	trans	-64.9	-46.8	174.2	0	0	0	0	0	112.4	C518 I532 A536 A565 G566 I567 M571 S572 M573	C518-A569 WeakPolarHBondContact SG-CB 3.44Å; I532-A569 HydrophobicContact CG2-CB 4.44Å; A536-A569 HydrophobicContact CB-CB 3.71Å; A565-A569 PolarHBondContact O-N 2.92Å; G566-A569 WeakPolarHBondContact O-CB 3.27Å; G566-A569 PolarHBondContact O-N 3.42Å; I567-A569 VanDerWaalsContact C-N 3.29Å; I567-A569 PolarHBondContact O-N 3.32Å; A569-M571 PolarHBondContact O-N 3.27Å; A569-S572 PolarHBondContact O-N 3.4Å; A569-M573 WeakPolarHBondContact O-CB 3.49Å; A569-M573 WeakPolarHBondContact O-CG 3.3Å; A569-M573 PolarHBondContact O-N 2.88Å
570	L	93.6	Very high	92.7	Very high	9 Å²	9	20.5 Å²	20.5	5%	0.047	11%	0.112	C	C	.	.	H	α-helix	trans	-60.7	-45.2	-179.2	-71.7	177.2	0	0	0	112.2	F533 A536 N537 G566 I567 S572 R574	F533-L570 HydrophobicContact CD1-CD2 4.46Å; F533-L570 HydrophobicContact CD2-CD2 3.62Å; F533-L570 HydrophobicContact CE1-CD2 4.39Å; F533-L570 HydrophobicContact CE2-CB 4.29Å; F533-L570 HydrophobicContact CE2-CD2 3.55Å; F533-L570 HydrophobicContact CG-CD2 4.09Å; F533-L570 HydrophobicContact CZ-CD2 3.96Å; F533-L570 VanDerWaalsContact O-CD2 3.28Å; F533-L570 WeakPolarHBondContact O-CD2 3.46Å; A536-L570 HydrophobicContact CB-CD2 3.89Å; A536-L570 HydrophobicContact CB-CG 3.98Å; N537-L570 HydrophobicContact CB-CD2 4.21Å; N537-L570 WeakPolarHBondContact ND2-CD2 3.18Å; N537-L570 WeakPolarHBondContact OD1-CD1 3.11Å; G566-L570 WeakPolarHBondContact O-CB 3.35Å; G566-L570 WeakPolarHBondContact O-CG 3.39Å; G566-L570 PolarHBondContact O-N 3.44Å; I567-L570 HydrophobicContact CD1-CD1 4.08Å; I567-L570 PolarHBondContact O-N 3.35Å; L570-S572 VanDerWaalsContact C-N 3.35Å; L570-R574 WeakPolarHBondContact O-CB 3.4Å; L570-R574 PolarHBondContact O-N 2.94Å; L570-R574 VanDerWaalsContact O-N 3.14Å
571	M	89.1	Confident	92.3	Very high	54 Å²	54	21.2 Å²	21.2	27%	0.266	12%	0.116	S	C	.	.	H	α-helix	trans	-65.5	-39.8	178.6	-65.7	-171.5	84.7	0	0	111.7	R515 I567 A569	R515-M571 PolarHBondContact NH2-SD 2.87Å; R515-M571 VanDerWaalsContact NH2-SD 3.42Å; I567-M571 HydrophobicContact CG2-CG 4.3Å; I567-M571 HydrophobicContact CG2-SD 4.14Å; I567-M571 WeakPolarHBondContact O-CG 3.38Å; I567-M571 PolarHBondContact O-N 2.96Å; A569-M571 PolarHBondContact O-N 3.27Å
572	S	87.3	Confident	91.9	Very high	20 Å²	20	19.9 Å²	19.9	14%	0.14	11%	0.106	C	C	.	.	H	α-helix	trans	-71	-43.1	-178.8	-54	0	0	0	0	112.2	G568 A569 L570	G568-S572 WeakPolarHBondContact O-CB 3.36Å; G568-S572 PolarHBondContact O-N 3.13Å; G568-S572 PolarHBondContact O-OG 3.12Å; A569-S572 PolarHBondContact O-N 3.4Å; L570-S572 VanDerWaalsContact C-N 3.35Å
573	M	88.1	Confident	91.2	Very high	2 Å²	2	17.8 Å²	17.8	1%	0.01	10%	0.101	C	C	.	.	H	α-helix	trans	-81.8	-21.4	-173.2	-66.7	-57.1	99.6	0	0	113.4	C518 A522 C529 I532 F533 A569 S575 L576 V577	C518-M573 HydrophobicContact CB-CE 4.11Å; C518-M573 WeakPolarHBondContact O-CE 3.29Å; A522-M573 HydrophobicContact CB-CE 3.55Å; A522-M573 HydrophobicContact CB-SD 3.89Å; C529-M573 HydrophobicContact CB-SD 4.06Å; I532-M573 HydrophobicContact CB-CG 4.17Å; I532-M573 HydrophobicContact CB-SD 4.49Å; I532-M573 HydrophobicContact CD1-SD 4.47Å; I532-M573 HydrophobicContact CG2-CG 3.7Å; I532-M573 HydrophobicContact CG2-SD 4.33Å; F533-M573 HydrophobicContact CB-CB 4.05Å; F533-M573 HydrophobicContact CD2-CB 4.02Å; A569-M573 WeakPolarHBondContact O-CB 3.49Å; A569-M573 WeakPolarHBondContact O-CG 3.3Å; A569-M573 PolarHBondContact O-N 2.88Å; M573-S575 PolarHBondContact O-N 2.8Å; M573-L576 HydrophobicContact CE-CD1 3.84Å; M573-L576 PolarHBondContact O-N 2.69Å; M573-L576 HydrophobicContact SD-CD1 4.06Å; M573-V577 WeakPolarHBondContact O-CG2 3.34Å; M573-V577 PolarHBondContact O-N 3Å
574	R	91.2	Very high	90.3	Very high	54 Å²	54	19.4 Å²	19.4	20%	0.204	11%	0.11	C	C	.	.	H	α-helix	trans	-52.7	-42.4	-178.3	-171.8	-177.6	-63.2	161.4	-1.9	112.5	F468 F533 L570 T578	F468-R574 HydrophobicContact CZ-CG 4.15Å; F533-R574 HydrophobicContact CE2-CB 4.25Å; L570-R574 WeakPolarHBondContact O-CB 3.4Å; L570-R574 PolarHBondContact O-N 2.94Å; L570-R574 VanDerWaalsContact O-N 3.14Å; R574-T578 WeakPolarHBondContact O-CB 3.47Å; R574-T578 PolarHBondContact O-N 3.39Å; R574-T578 PolarHBondContact O-OG1 3Å
575	S	86.1	Confident	89.2	Confident	3 Å²	3	21.5 Å²	21.5	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-66.2	-40	179.8	69.3	0	0	0	0	113.2	M573 L579 F591	M573-S575 PolarHBondContact O-N 2.8Å; S575-L579 WeakPolarHBondContact O-CB 3.43Å; S575-L579 PolarHBondContact O-N 3.11Å; S575-F591 VanDerWaalsContact CA-CE2 3.47Å
576	L	87.6	Confident	88.6	Confident	19 Å²	19	26.7 Å²	26.7	10%	0.099	14%	0.143	C	C	.	.	H	α-helix	trans	-73.8	-39.8	-178.2	-60.1	-178.3	0	0	0	111.8	Y400 A522 C529 M573 L579 K580	Y400-L576 HydrophobicContact CE2-CD2 3.73Å; Y400-L576 WeakPolarHBondContact OH-CD2 3.48Å; A522-L576 HydrophobicContact CB-CD1 3.52Å; C529-L576 HydrophobicContact CB-CB 4.02Å; M573-L576 HydrophobicContact CE-CD1 3.84Å; M573-L576 PolarHBondContact O-N 2.69Å; M573-L576 HydrophobicContact SD-CD1 4.06Å; L576-L579 PolarHBondContact O-N 3.01Å; L576-K580 PolarHBondContact O-N 2.87Å
577	V	91.8	Very high	87.9	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.6	-47.4	173.3	174.9	0	0	0	0	110	F468 C529 I530 F533 M573 L579 K580 L581 L640	F468-V577 HydrophobicContact CD2-CG1 3.64Å; F468-V577 HydrophobicContact CE1-CG1 4.31Å; F468-V577 HydrophobicContact CE2-CB 3.91Å; F468-V577 HydrophobicContact CE2-CG1 3.3Å; F468-V577 HydrophobicContact CG-CG1 4.28Å; F468-V577 HydrophobicContact CZ-CB 3.94Å; F468-V577 HydrophobicContact CZ-CG1 3.67Å; C529-V577 HydrophobicContact CB-CG2 4.35Å; I530-V577 HydrophobicContact CG1-CB 4.4Å; I530-V577 HydrophobicContact CG1-CG1 3.89Å; I530-V577 HydrophobicContact CG1-CG2 3.95Å; F533-V577 HydrophobicContact CB-CG2 3.89Å; F533-V577 HydrophobicContact CG-CG2 4.17Å; M573-V577 WeakPolarHBondContact O-CG2 3.34Å; M573-V577 PolarHBondContact O-N 3Å; V577-L579 VanDerWaalsContact C-N 3.3Å; V577-L579 PolarHBondContact O-N 2.98Å; V577-K580 PolarHBondContact O-N 3.43Å; V577-K580 VanDerWaalsContact O-N 3.09Å; V577-L581 HydrophobicContact CG1-CD1 4.01Å; V577-L581 HydrophobicContact CG1-CG 4.28Å; V577-L581 WeakPolarHBondContact O-CG 2.97Å; V577-L581 PolarHBondContact O-N 3.19Å; V577-L640 HydrophobicContact CG1-CD2 4.15Å
578	T	91.7	Very high	87.3	Confident	0 Å²	0	26.5 Å²	26.5	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-57.1	-45.7	177.2	-52.4	0	0	0	0	111.2	F465 F468 R574 K580 L581 V582 L587 A590 F591 L594	F465-T578 HydrophobicContact CE2-CG2 4.31Å; F468-T578 WeakPolarHBondContact CE1-OG1 3.45Å; R574-T578 WeakPolarHBondContact O-CB 3.47Å; R574-T578 PolarHBondContact O-N 3.39Å; R574-T578 PolarHBondContact O-OG1 3Å; T578-K580 VanDerWaalsContact C-N 3.34Å; T578-K580 PolarHBondContact O-N 2.91Å; T578-L581 PolarHBondContact O-N 3.45Å; T578-V582 HydrophobicContact CG2-CG2 4.09Å; T578-V582 WeakPolarHBondContact O-CG2 3.07Å; T578-V582 PolarHBondContact O-N 2.88Å; T578-L587 HydrophobicContact CG2-CD1 3.7Å; T578-A590 HydrophobicContact CG2-CB 3.52Å; T578-F591 HydrophobicContact CG2-CD2 4.4Å; T578-L594 HydrophobicContact CG2-CD1 3.85Å; T578-L594 VanDerWaalsContact OG1-CD1 3.23Å; T578-L594 WeakPolarHBondContact OG1-CD1 3.29Å
579	L	87.8	Confident	87	Confident	7 Å²	7	27 Å²	27	4%	0.037	15%	0.145	C	C	.	.	H	α-helix	trans	-56.7	-45.3	175.6	175	65.6	0	0	0	112.2	Y400 I407 S575 L576 V577 L581 G583 I584 L587	Y400-L579 HydrophobicContact CD2-CD2 4.05Å; Y400-L579 HydrophobicContact CE2-CB 4.28Å; Y400-L579 HydrophobicContact CE2-CD2 3.3Å; Y400-L579 HydrophobicContact CE2-CG 4.31Å; I407-L579 HydrophobicContact CG1-CD2 4.24Å; S575-L579 WeakPolarHBondContact O-CB 3.43Å; S575-L579 PolarHBondContact O-N 3.11Å; L576-L579 PolarHBondContact O-N 3.01Å; V577-L579 VanDerWaalsContact C-N 3.3Å; V577-L579 PolarHBondContact O-N 2.98Å; L579-L581 VanDerWaalsContact C-N 3.29Å; L579-L581 PolarHBondContact O-N 2.95Å; L579-G583 WeakPolarHBondContact O-CA 3.47Å; L579-G583 PolarHBondContact O-N 3.02Å; L579-I584 HydrophobicContact CD1-CB 3.85Å; L579-I584 HydrophobicContact CD1-CD1 3.87Å; L579-I584 HydrophobicContact CD1-CG1 4.47Å; L579-L587 HydrophobicContact CB-CD1 4.2Å; L579-L587 HydrophobicContact CD1-CD2 4.37Å
580	K	89.3	Confident	86.9	Confident	87 Å²	87	26.8 Å²	26.8	38%	0.378	14%	0.143	S	C	.	.	H	α-helix	trans	-65.3	-31.5	179.7	-176.3	168.4	169.8	-179.5	0	112.7	D528 I530 L576 V577 T578 L644	D528-K580 IonicContact OD1-NZ 2.81Å; D528-K580 PolarHBondContact OD1-NZ 3.28Å; D528-K580 IonicContact OD2-NZ 2.93Å; D528-K580 PolarHBondContact OD2-NZ 3.29Å; I530-K580 HydrophobicContact CD1-CD 3.69Å; I530-K580 HydrophobicContact CD1-CG 4.22Å; I530-K580 HydrophobicContact CG1-CD 4.28Å; L576-K580 PolarHBondContact O-N 2.87Å; V577-K580 PolarHBondContact O-N 3.43Å; V577-K580 VanDerWaalsContact O-N 3.09Å; T578-K580 VanDerWaalsContact C-N 3.34Å; T578-K580 PolarHBondContact O-N 2.91Å; K580-L644 HydrophobicContact CG-CD2 4.04Å
581	L	90.9	Very high	86.6	Confident	16 Å²	16	27.4 Å²	27.4	8%	0.084	15%	0.145	C	C	.	.	H	α-helix	trans	-81.2	-43	-179.1	-64.1	179.4	0	0	0	113.7	F468 I530 V577 T578 L579 L640 L644	F468-L581 HydrophobicContact CB-CD1 3.43Å; F468-L581 VanDerWaalsContact CB-CD1 3.43Å; F468-L581 HydrophobicContact CD1-CD1 3.79Å; F468-L581 HydrophobicContact CD2-CD1 4.2Å; F468-L581 HydrophobicContact CG-CD1 3.54Å; I530-L581 HydrophobicContact CD1-CD2 4.44Å; V577-L581 HydrophobicContact CG1-CD1 4.01Å; V577-L581 HydrophobicContact CG1-CG 4.28Å; V577-L581 WeakPolarHBondContact O-CG 2.97Å; V577-L581 PolarHBondContact O-N 3.19Å; T578-L581 PolarHBondContact O-N 3.45Å; L579-L581 VanDerWaalsContact C-N 3.29Å; L579-L581 PolarHBondContact O-N 2.95Å; L581-L640 HydrophobicContact CD1-CD1 4.25Å; L581-L640 HydrophobicContact CD1-CD2 4.24Å; L581-L640 HydrophobicContact CD2-CD1 4.03Å; L581-L640 HydrophobicContact CD2-CD2 4.37Å; L581-L640 HydrophobicContact CD2-CG 4.12Å; L581-L644 HydrophobicContact CD2-CB 4.43Å; L581-L644 HydrophobicContact CD2-CD1 4.02Å; L581-L644 HydrophobicContact CD2-CD2 4.15Å; L581-L644 HydrophobicContact CD2-CG 4.43Å
582	V	89	Confident	86.6	Confident	25 Å²	25	24.9 Å²	24.9	15%	0.152	13%	0.133	C	C	.	.	H	α-helix	trans	-111.1	-10.4	-171.1	-57.4	0	0	0	0	114.4	L459 F465 T578 R586 A590	L459-V582 HydrophobicContact CD2-CB 4.22Å; L459-V582 HydrophobicContact CD2-CG1 3.93Å; F465-V582 HydrophobicContact CB-CG1 4.14Å; F465-V582 HydrophobicContact CD2-CG1 3.57Å; F465-V582 HydrophobicContact CE2-CG1 4.16Å; F465-V582 HydrophobicContact CG-CG1 3.89Å; T578-V582 HydrophobicContact CG2-CG2 4.09Å; T578-V582 WeakPolarHBondContact O-CG2 3.07Å; T578-V582 PolarHBondContact O-N 2.88Å; V582-R586 HydrophobicContact CB-CB 4.32Å; V582-R586 HydrophobicContact CG2-CB 4.39Å; V582-A590 HydrophobicContact CB-CB 4.38Å; V582-A590 HydrophobicContact CG1-CB 4.11Å; V582-A590 HydrophobicContact CG2-CB 3.61Å
583	G	83	Confident	86.8	Confident	25 Å²	25	24 Å²	24	26%	0.258	13%	0.126	S	C	.	.			trans	74.6	168.6	-172.9	0	0	0	0	0	113.5	L579 G585 R586 L587	L579-G583 WeakPolarHBondContact O-CA 3.47Å; L579-G583 PolarHBondContact O-N 3.02Å; G583-G585 VanDerWaalsContact C-N 3.3Å; G583-G585 PolarHBondContact O-N 2.98Å; G583-R586 PolarHBondContact O-N 3.35Å; G583-L587 PolarHBondContact O-N 3.21Å
584	I	79.1	Confident	87.1	Confident	34 Å²	34	24.3 Å²	24.3	17%	0.174	13%	0.128	C	C	.	.	G	3₁₀ helix	trans	-64.7	-34.5	-175.6	-167.9	59.8	0	0	0	112.4	L396 D397 I407 L579 R586 L587	L396-I584 HydrophobicContact CB-CG1 4.46Å; D397-I584 HydrophobicContact CB-CD1 3.96Å; I407-I584 HydrophobicContact CD1-CD1 3.8Å; I407-I584 HydrophobicContact CD1-CG1 4.21Å; L579-I584 HydrophobicContact CD1-CB 3.85Å; L579-I584 HydrophobicContact CD1-CD1 3.87Å; L579-I584 HydrophobicContact CD1-CG1 4.47Å; I584-R586 PolarHBondContact O-N 3.43Å; I584-L587 HydrophobicContact CD1-CD2 3.94Å; I584-L587 WeakPolarHBondContact O-CB 3.49Å; I584-L587 PolarHBondContact O-N 3.44Å
585	G	73.8	Confident	87.1	Confident	45 Å²	45	23 Å²	23	46%	0.464	13%	0.125	S	C	.	.	G	3₁₀ helix	trans	-66.1	-22.1	-174.9	0	0	0	0	0	114.9	G583	G583-G585 VanDerWaalsContact C-N 3.3Å; G583-G585 PolarHBondContact O-N 2.98Å
586	R	84.4	Confident	87.4	Confident	146 Å²	146	24.5 Å²	24.5	55%	0.551	13%	0.133	S	C	*	.	G	3₁₀ helix	trans	-119.5	8.3	-180	-58	-175.9	-177.5	169.4	1.6	113.1	L459 V582 G583 I584 T588 S589 A590	L459-R586 HydrophobicContact CD2-CB 3.96Å; L459-R586 HydrophobicContact CD2-CG 4.46Å; V582-R586 HydrophobicContact CB-CB 4.32Å; V582-R586 HydrophobicContact CG2-CB 4.39Å; G583-R586 PolarHBondContact O-N 3.35Å; I584-R586 PolarHBondContact O-N 3.43Å; R586-T588 PolarHBondContact O-N 3.32Å; R586-S589 PolarHBondContact O-N 3.43Å; R586-A590 WeakPolarHBondContact O-CB 3.24Å; R586-A590 PolarHBondContact O-N 2.71Å
587	L	82.8	Confident	87.7	Confident	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-59.9	-45.1	-176	-179.7	64	0	0	0	111.8	Y400 T578 L579 G583 I584 S589 A590 F591	Y400-L587 HydrophobicContact CD2-CD2 3.62Å; Y400-L587 HydrophobicContact CG-CD2 4Å; T578-L587 HydrophobicContact CG2-CD1 3.7Å; L579-L587 HydrophobicContact CB-CD1 4.2Å; L579-L587 HydrophobicContact CD1-CD2 4.37Å; G583-L587 PolarHBondContact O-N 3.21Å; I584-L587 HydrophobicContact CD1-CD2 3.94Å; I584-L587 WeakPolarHBondContact O-CB 3.49Å; I584-L587 PolarHBondContact O-N 3.44Å; L587-S589 PolarHBondContact O-N 3.3Å; L587-A590 PolarHBondContact O-N 2.95Å; L587-F591 HydrophobicContact CD1-CD2 3.69Å; L587-F591 HydrophobicContact CD1-CE2 3.88Å; L587-F591 HydrophobicContact CG-CD2 4.06Å; L587-F591 HydrophobicContact CG-CE2 4.47Å; L587-F591 WeakPolarHBondContact O-CB 3.32Å; L587-F591 PolarHBondContact O-N 2.63Å
588	T	80.7	Confident	87.8	Confident	4 Å²	4	27.1 Å²	27.1	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-59.4	-45.6	179.5	-58.6	0	0	0	0	111.9	L393 L396 L399 L454 R586 F591 G592	L393-T588 HydrophobicContact CD2-CG2 4.28Å; L396-T588 PolarHBondContact O-OG1 3.04Å; L399-T588 HydrophobicContact CD1-CG2 3.98Å; L399-T588 HydrophobicContact CG-CG2 4.37Å; L454-T588 HydrophobicContact CD2-CG2 3.74Å; R586-T588 PolarHBondContact O-N 3.32Å; T588-F591 PolarHBondContact O-N 2.91Å; T588-G592 PolarHBondContact O-N 3.32Å
589	S	86.2	Confident	87.9	Confident	12 Å²	12	27.2 Å²	27.2	8%	0.084	15%	0.145	C	C	.	.	H	α-helix	trans	-66.7	-40.7	177.3	-46.3	0	0	0	0	112.1	Q453 R586 L587 G592 L593	Q453-S589 WeakPolarHBondContact O-CA 3.43Å; Q453-S589 WeakPolarHBondContact O-CB 3.2Å; Q453-S589 PolarHBondContact O-OG 3.35Å; R586-S589 PolarHBondContact O-N 3.43Å; L587-S589 PolarHBondContact O-N 3.3Å; S589-G592 PolarHBondContact O-N 3.41Å; S589-L593 PolarHBondContact O-N 2.86Å; S589-L593 VanDerWaalsContact O-N 3.09Å
590	A	91.1	Very high	88.2	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.6	-42	177.1	0	0	0	0	0	111.9	L459 F465 T578 V582 R586 L587 L593 L594	L459-A590 HydrophobicContact CD1-CB 3.87Å; L459-A590 VanDerWaalsContact CD1-N 3.35Å; F465-A590 HydrophobicContact CD2-CB 4.49Å; F465-A590 HydrophobicContact CE2-CB 3.63Å; F465-A590 HydrophobicContact CZ-CB 3.73Å; T578-A590 HydrophobicContact CG2-CB 3.52Å; V582-A590 HydrophobicContact CB-CB 4.38Å; V582-A590 HydrophobicContact CG1-CB 4.11Å; V582-A590 HydrophobicContact CG2-CB 3.61Å; R586-A590 WeakPolarHBondContact O-CB 3.24Å; R586-A590 PolarHBondContact O-N 2.71Å; L587-A590 PolarHBondContact O-N 2.95Å; A590-L593 PolarHBondContact O-N 3.19Å; A590-L594 WeakPolarHBondContact O-CG 3.14Å; A590-L594 PolarHBondContact O-N 3.4Å
591	F	87.3	Confident	88.6	Confident	23 Å²	23	25.9 Å²	25.9	10%	0.101	14%	0.142	C	C	.	.	H	α-helix	trans	-62.4	-41.2	173	-108	-77.9	0	0	0	112.8	L399 S575 T578 L587 T588 L593 L594 L595	L399-F591 HydrophobicContact CB-CB 4.49Å; L399-F591 HydrophobicContact CB-CG 4.47Å; L399-F591 HydrophobicContact CD1-CB 3.79Å; L399-F591 HydrophobicContact CD1-CG 4.5Å; S575-F591 VanDerWaalsContact CA-CE2 3.47Å; T578-F591 HydrophobicContact CG2-CD2 4.4Å; L587-F591 HydrophobicContact CD1-CD2 3.69Å; L587-F591 HydrophobicContact CD1-CE2 3.88Å; L587-F591 HydrophobicContact CG-CD2 4.06Å; L587-F591 HydrophobicContact CG-CE2 4.47Å; L587-F591 WeakPolarHBondContact O-CB 3.32Å; L587-F591 PolarHBondContact O-N 2.63Å; T588-F591 PolarHBondContact O-N 2.91Å; F591-L593 VanDerWaalsContact C-N 3.35Å; F591-L593 PolarHBondContact O-N 2.72Å; F591-L594 PolarHBondContact O-N 2.94Å; F591-L595 WeakPolarHBondContact O-CG 3.42Å; F591-L595 PolarHBondContact O-N 3.03Å
592	G	88.9	Confident	88.7	Confident	1 Å²	1	25.3 Å²	25.3	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-57.7	-46.4	175.3	0	0	0	0	0	112.2	T588 S589 L595 L596	T588-G592 PolarHBondContact O-N 3.32Å; S589-G592 PolarHBondContact O-N 3.41Å; G592-L595 PolarHBondContact O-N 3.28Å; G592-L596 WeakPolarHBondContact O-CB 3.5Å; G592-L596 PolarHBondContact O-N 2.96Å
593	L	92.7	Very high	89	Confident	0 Å²	0	27 Å²	27	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-64.4	-42.2	174.5	-70.5	179.2	0	0	0	112.8	I455 D456 F457 L459 L460 F465 S589 A590 F591 L595 L596 F597	I455-L593 HydrophobicContact CG2-CD2 4.31Å; D456-L593 WeakPolarHBondContact O-CD1 3.3Å; F457-L593 HydrophobicContact CD1-CD2 3.83Å; F457-L593 HydrophobicContact CE1-CD2 3.81Å; L459-L593 HydrophobicContact CB-CD1 3.87Å; L459-L593 HydrophobicContact CD1-CD1 4.22Å; L460-L593 HydrophobicContact CD2-CD1 4.32Å; L460-L593 HydrophobicContact CG-CD1 4.17Å; F465-L593 HydrophobicContact CE1-CB 4.49Å; F465-L593 HydrophobicContact CE1-CD1 3.92Å; F465-L593 HydrophobicContact CZ-CB 4.37Å; F465-L593 HydrophobicContact CZ-CD1 4.46Å; S589-L593 PolarHBondContact O-N 2.86Å; S589-L593 VanDerWaalsContact O-N 3.09Å; A590-L593 PolarHBondContact O-N 3.19Å; F591-L593 VanDerWaalsContact C-N 3.35Å; F591-L593 PolarHBondContact O-N 2.72Å; L593-L595 VanDerWaalsContact C-N 3.34Å; L593-L595 PolarHBondContact O-N 3.41Å; L593-L596 HydrophobicContact CD2-CD2 4.41Å; L593-L596 WeakPolarHBondContact O-CB 3.43Å; L593-L596 PolarHBondContact O-N 3.34Å; L593-F597 WeakPolarHBondContact O-CD2 3.49Å; L593-F597 PolarHBondContact O-N 3.27Å
594	L	93.2	Very high	89.6	Confident	9 Å²	9	28.8 Å²	28.8	5%	0.047	15%	0.147	C	C	.	.	H	α-helix	trans	-60.3	-43.3	176.5	-76.1	163.5	0	0	0	111.7	F465 F468 V469 C472 T578 A590 F591 N598	F465-L594 HydrophobicContact CE2-CD1 4.35Å; F465-L594 HydrophobicContact CE2-CG 4.36Å; F465-L594 HydrophobicContact CZ-CG 4.4Å; F468-L594 HydrophobicContact CD1-CD2 4.13Å; F468-L594 HydrophobicContact CE1-CD1 3.86Å; F468-L594 HydrophobicContact CE1-CD2 3.91Å; V469-L594 HydrophobicContact CB-CD2 4.39Å; V469-L594 HydrophobicContact CG2-CD2 3.73Å; V469-L594 HydrophobicContact CG2-CG 4.29Å; C472-L594 HydrophobicContact CB-CD2 4.19Å; T578-L594 HydrophobicContact CG2-CD1 3.85Å; T578-L594 VanDerWaalsContact OG1-CD1 3.23Å; T578-L594 WeakPolarHBondContact OG1-CD1 3.29Å; A590-L594 WeakPolarHBondContact O-CG 3.14Å; A590-L594 PolarHBondContact O-N 3.4Å; F591-L594 PolarHBondContact O-N 2.94Å; L594-N598 WeakPolarHBondContact O-CB 3.43Å; L594-N598 PolarHBondContact O-N 3.41Å
595	L	91.2	Very high	90.3	Very high	27 Å²	27	27.3 Å²	27.3	14%	0.141	14%	0.141	C	C	.	.	H	α-helix	trans	-65.9	-39.9	177.1	-71.7	175.2	0	0	0	112.3	F591 G592 L593 N598 G599	F591-L595 WeakPolarHBondContact O-CG 3.42Å; F591-L595 PolarHBondContact O-N 3.03Å; G592-L595 PolarHBondContact O-N 3.28Å; L593-L595 VanDerWaalsContact C-N 3.34Å; L593-L595 PolarHBondContact O-N 3.41Å; L595-N598 PolarHBondContact O-N 3.12Å; L595-G599 PolarHBondContact O-N 3.25Å
596	L	92.4	Very high	91.2	Very high	35 Å²	35	25.2 Å²	25.2	18%	0.183	12%	0.118	C	C	.	.	H	α-helix	trans	-57.9	-54.6	175.1	172.9	63.6	0	0	0	111.3	L114 F457 G592 L593 G599 I600	L114-L596 HydrophobicContact CD1-CD1 3.29Å; F457-L596 HydrophobicContact CE1-CD2 4.36Å; F457-L596 HydrophobicContact CZ-CD2 4.31Å; G592-L596 WeakPolarHBondContact O-CB 3.5Å; G592-L596 PolarHBondContact O-N 2.96Å; L593-L596 HydrophobicContact CD2-CD2 4.41Å; L593-L596 WeakPolarHBondContact O-CB 3.43Å; L593-L596 PolarHBondContact O-N 3.34Å; L596-G599 PolarHBondContact O-N 3.29Å; L596-I600 PolarHBondContact O-N 3.04Å
597	F	94.8	Very high	91.7	Very high	53 Å²	53	19.1 Å²	19.1	23%	0.232	10%	0.098	C	C	.	.	H	α-helix	trans	-69.6	-34.9	179.8	-72.3	-63.7	0	0	0	112.3	L460 V469 F473 L593 G599 I600 A601	L460-F597 HydrophobicContact CD1-CE2 3.97Å; L460-F597 HydrophobicContact CD1-CZ 3.99Å; L460-F597 HydrophobicContact CD2-CE2 4.11Å; V469-F597 HydrophobicContact CG1-CB 4.24Å; V469-F597 HydrophobicContact CG1-CD2 3.53Å; V469-F597 HydrophobicContact CG1-CE2 4.14Å; V469-F597 HydrophobicContact CG1-CG 4.04Å; F473-F597 HydrophobicContact CD2-CB 4.16Å; F473-F597 WeakPolarHBondContact CD2-O 3.48Å; L593-F597 WeakPolarHBondContact O-CD2 3.49Å; L593-F597 PolarHBondContact O-N 3.27Å; F597-G599 VanDerWaalsContact C-N 3.34Å; F597-G599 PolarHBondContact O-N 3.33Å; F597-I600 PolarHBondContact O-N 3.12Å; F597-A601 WeakPolarHBondContact O-CB 3.47Å; F597-A601 PolarHBondContact O-N 3.43Å
598	N	93.7	Very high	92.3	Very high	21 Å²	21	23.5 Å²	23.5	11%	0.112	12%	0.12	C	C	.	.	H	α-helix	trans	-59.3	-44.6	173.4	-177.2	78.8	0	0	0	111.5	S113 S476 L594 L595 I600 A601 V602	S113-N598 PolarHBondContact OG-ND2 3.04Å; S476-N598 WeakPolarHBondContact CB-OD1 3.08Å; S476-N598 PolarHBondContact OG-OD1 2.92Å; L594-N598 WeakPolarHBondContact O-CB 3.43Å; L594-N598 PolarHBondContact O-N 3.41Å; L595-N598 PolarHBondContact O-N 3.12Å; N598-I600 VanDerWaalsContact C-N 3.31Å; N598-I600 PolarHBondContact O-N 3.28Å; N598-A601 WeakPolarHBondContact O-CB 3.47Å; N598-A601 PolarHBondContact O-N 3.48Å; N598-A601 VanDerWaalsContact O-N 3.16Å; N598-V602 WeakPolarHBondContact O-CG1 3.45Å; N598-V602 WeakPolarHBondContact O-CG2 3.31Å; N598-V602 PolarHBondContact O-N 2.76Å
599	G	94.2	Very high	93.1	Very high	1 Å²	1	23.5 Å²	23.5	1%	0.01	12%	0.12	C	C	.	.	H	α-helix	trans	-57.4	-42.8	177.6	0	0	0	0	0	112.8	M110 L595 L596 F597 V602 F603	M110-G599 WeakPolarHBondContact CG-O 3.3Å; L595-G599 PolarHBondContact O-N 3.25Å; L596-G599 PolarHBondContact O-N 3.29Å; F597-G599 VanDerWaalsContact C-N 3.34Å; F597-G599 PolarHBondContact O-N 3.33Å; G599-V602 WeakPolarHBondContact O-CG2 3.27Å; G599-F603 PolarHBondContact O-N 2.78Å
600	I	94.5	Very high	93.5	Very high	67 Å²	67	22.9 Å²	22.9	34%	0.344	12%	0.116	S	C	.	.	H	α-helix	trans	-66.8	-42.2	175.9	-60.3	168.7	0	0	0	110.9	F473 L596 F597 N598 F603	F473-I600 HydrophobicContact CE2-CB 4.11Å; F473-I600 HydrophobicContact CE2-CG2 3.93Å; F473-I600 HydrophobicContact CZ-CG2 4.3Å; L596-I600 PolarHBondContact O-N 3.04Å; F597-I600 PolarHBondContact O-N 3.12Å; N598-I600 VanDerWaalsContact C-N 3.31Å; N598-I600 PolarHBondContact O-N 3.28Å; I600-F603 WeakPolarHBondContact O-CB 3.3Å; I600-F603 PolarHBondContact O-N 3.3Å
601	A	95.7	Very high	93.8	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-63.4	-49.3	179.9	0	0	0	0	0	112.8	F473 V477 F597 N598 F603 L604	F473-A601 HydrophobicContact CD1-CB 4.44Å; F473-A601 HydrophobicContact CD2-CB 3.67Å; F473-A601 HydrophobicContact CE2-CB 3.78Å; F473-A601 HydrophobicContact CG-CB 4.01Å; F473-A601 HydrophobicContact CZ-CB 4.21Å; F473-A601 VanDerWaalsContact O-CB 3.32Å; F473-A601 WeakPolarHBondContact O-CB 3.48Å; V477-A601 HydrophobicContact CG2-CB 3.84Å; F597-A601 WeakPolarHBondContact O-CB 3.47Å; F597-A601 PolarHBondContact O-N 3.43Å; N598-A601 WeakPolarHBondContact O-CB 3.47Å; N598-A601 PolarHBondContact O-N 3.48Å; N598-A601 VanDerWaalsContact O-N 3.16Å; A601-F603 PolarHBondContact O-N 2.84Å; A601-L604 PolarHBondContact O-N 3.28Å; A601-L604 VanDerWaalsContact O-N 3.12Å
602	V	94.3	Very high	94.2	Very high	4 Å²	4	25.8 Å²	25.8	2%	0.024	14%	0.138	C	C	.	.	H	α-helix	trans	-68.1	-22.1	-177.4	-62.7	0	0	0	0	113.1	N109 N598 G599 P606	N109-V602 HydrophobicContact CB-CB 4.38Å; N109-V602 HydrophobicContact CB-CG2 3.9Å; N598-V602 WeakPolarHBondContact O-CG1 3.45Å; N598-V602 WeakPolarHBondContact O-CG2 3.31Å; N598-V602 PolarHBondContact O-N 2.76Å; G599-V602 WeakPolarHBondContact O-CG2 3.27Å; V602-P606 VanDerWaalsContact O-CD 3.3Å; V602-P606 WeakPolarHBondContact O-CD 3.36Å
603	F	95	Very high	94.6	Very high	61 Å²	61	28 Å²	28	27%	0.268	15%	0.147	S	C	.	.	H	α-helix	trans	-66	-40.2	171.7	170.5	-106	0	0	0	112.3	L103 S106 L107 M110 G599 I600 A601 P607	L103-F603 HydrophobicContact CD2-CE2 3.82Å; L103-F603 HydrophobicContact CD2-CZ 3.99Å; S106-F603 WeakPolarHBondContact CB-O 3.15Å; L107-F603 HydrophobicContact CD2-CD2 4.16Å; L107-F603 HydrophobicContact CD2-CE2 3.9Å; L107-F603 HydrophobicContact CG-CD2 4.47Å; L107-F603 HydrophobicContact CG-CE2 4.2Å; M110-F603 HydrophobicContact CB-CB 4.07Å; M110-F603 HydrophobicContact CG-CB 4.25Å; M110-F603 HydrophobicContact SD-CB 3.98Å; M110-F603 HydrophobicContact SD-CD2 3.98Å; M110-F603 HydrophobicContact SD-CG 3.96Å; G599-F603 PolarHBondContact O-N 2.78Å; I600-F603 WeakPolarHBondContact O-CB 3.3Å; I600-F603 PolarHBondContact O-N 3.3Å; A601-F603 PolarHBondContact O-N 2.84Å; F603-P607 WeakPolarHBondContact O-CD 3.24Å; F603-P607 WeakPolarHBondContact O-CG 3.45Å
604	L	95.1	Very high	94.7	Very high	62 Å²	62	31.7 Å²	31.7	33%	0.325	17%	0.165	S	C	.	.	H	α-helix	trans	-74.8	-37.6	-172.4	-67.9	172.2	0	0	0	113.2	F473 A601 P607 M608	F473-L604 HydrophobicContact CZ-CD1 4.15Å; A601-L604 PolarHBondContact O-N 3.28Å; A601-L604 VanDerWaalsContact O-N 3.12Å; L604-P607 WeakPolarHBondContact O-CD 3.47Å; L604-M608 HydrophobicContact CB-SD 4Å; L604-M608 VanDerWaalsContact O-CB 3.28Å; L604-M608 WeakPolarHBondContact O-CB 3.38Å; L604-M608 WeakPolarHBondContact O-CG 3.33Å; L604-M608 PolarHBondContact O-N 3.38Å
605	G	94.2	Very high	94.8	Very high	3 Å²	3	35.6 Å²	35.6	3%	0.031	19%	0.193	C	C	.	.	H	α-helix	trans	-55.9	-62.9	-170.2	0	0	0	0	0	114.5	V477 M608 A609	V477-G605 WeakPolarHBondContact O-CA 3.4Å; G605-M608 PolarHBondContact O-N 2.8Å; G605-A609 WeakPolarHBondContact O-CB 3.45Å; G605-A609 PolarHBondContact O-N 3.07Å
606	P	93.9	Very high	95	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-63.7	-42.1	-173.7	-21.3	31.1	0	0	0	116	S106 N480 L484 Y485 V602 A609 A610	S106-P606 WeakPolarHBondContact OG-CB 3.4Å; N480-P606 HydrophobicContact CB-CG 3.85Å; L484-P606 HydrophobicContact CD2-CB 3.67Å; L484-P606 HydrophobicContact CD2-CG 4.02Å; Y485-P606 HydrophobicContact CE2-CB 4.2Å; Y485-P606 WeakPolarHBondContact CE2-O 3.07Å; Y485-P606 PolarHBondContact OH-O 3.29Å; V602-P606 VanDerWaalsContact O-CD 3.3Å; V602-P606 WeakPolarHBondContact O-CD 3.36Å; P606-A609 PolarHBondContact O-N 3.37Å; P606-A610 PolarHBondContact O-N 3.2Å
607	P	94	Very high	95.1	Very high	19 Å²	19	37.9 Å²	37.9	12%	0.123	22%	0.218	C	C	.	.	H	α-helix	trans	-67	-38.7	178	-21.3	35.1	0	0	0	111.8	S102 L103 S106 F603 L604 A610 A611	S102-P607 WeakPolarHBondContact OG-CA 3.34Å; L103-P607 HydrophobicContact CD2-CB 3.94Å; L103-P607 HydrophobicContact CD2-CG 3.58Å; L103-P607 HydrophobicContact CG-CB 4.41Å; L103-P607 HydrophobicContact CG-CG 4.23Å; S106-P607 VanDerWaalsContact OG-CD 3.27Å; S106-P607 WeakPolarHBondContact OG-CD 3.39Å; S106-P607 WeakPolarHBondContact OG-CG 3.41Å; F603-P607 WeakPolarHBondContact O-CD 3.24Å; F603-P607 WeakPolarHBondContact O-CG 3.45Å; L604-P607 WeakPolarHBondContact O-CD 3.47Å; P607-A610 PolarHBondContact O-N 3.01Å; P607-A611 WeakPolarHBondContact O-CB 3.48Å; P607-A611 PolarHBondContact O-N 2.85Å
608	M	95.2	Very high	95.2	Very high	92 Å²	92	37.5 Å²	37.5	45%	0.453	22%	0.22	S	C	.	.	H	α-helix	trans	-61.1	-46.6	172.4	-72.8	176.2	58.9	0	0	111.1	L604 G605 A610 A611 L612	L604-M608 HydrophobicContact CB-SD 4Å; L604-M608 VanDerWaalsContact O-CB 3.28Å; L604-M608 WeakPolarHBondContact O-CB 3.38Å; L604-M608 WeakPolarHBondContact O-CG 3.33Å; L604-M608 PolarHBondContact O-N 3.38Å; G605-M608 PolarHBondContact O-N 2.8Å; M608-A610 VanDerWaalsContact C-N 3.32Å; M608-A610 PolarHBondContact O-N 2.95Å; M608-A611 PolarHBondContact O-N 3.32Å; M608-L612 VanDerWaalsContact O-CG 3.28Å; M608-L612 WeakPolarHBondContact O-CG 3.43Å; M608-L612 PolarHBondContact O-N 3.36Å
609	A	96.8	Very high	95.2	Very high	3 Å²	3	37 Å²	37	3%	0.025	22%	0.217	C	C	.	.	H	α-helix	trans	-62.3	-36.4	178.2	0	0	0	0	0	113.3	V481 Y485 G605 P606 F613 S622	V481-A609 HydrophobicContact CB-CB 4.39Å; V481-A609 HydrophobicContact CG1-CB 3.75Å; V481-A609 HydrophobicContact CG2-CB 3.78Å; Y485-A609 HydrophobicContact CD2-CB 3.93Å; Y485-A609 HydrophobicContact CE2-CB 3.6Å; G605-A609 WeakPolarHBondContact O-CB 3.45Å; G605-A609 PolarHBondContact O-N 3.07Å; P606-A609 PolarHBondContact O-N 3.37Å; A609-F613 PolarHBondContact O-N 3.49Å; A609-S622 WeakPolarHBondContact CA-OG 3.39Å; A609-S622 PolarHBondContact O-OG 2.91Å
610	A	95.4	Very high	95.3	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-72	-39.1	174	0	0	0	0	0	112.7	P98 S99 Y485 P606 P607 M608 L612 F613 E614	P98-A610 HydrophobicContact CB-CB 4.37Å; S99-A610 VanDerWaalsContact CA-CB 3.49Å; Y485-A610 HydrophobicContact CE1-CB 4.5Å; Y485-A610 WeakPolarHBondContact OH-CB 3.49Å; P606-A610 PolarHBondContact O-N 3.2Å; P607-A610 PolarHBondContact O-N 3.01Å; M608-A610 VanDerWaalsContact C-N 3.32Å; M608-A610 PolarHBondContact O-N 2.95Å; A610-L612 VanDerWaalsContact C-N 3.28Å; A610-L612 PolarHBondContact O-N 3.42Å; A610-F613 WeakPolarHBondContact O-CA 3.2Å; A610-F613 WeakPolarHBondContact O-CB 3.33Å; A610-F613 PolarHBondContact O-N 2.96Å; A610-F613 VanDerWaalsContact O-N 3.11Å; A610-E614 WeakPolarHBondContact O-CG 3.39Å; A610-E614 PolarHBondContact O-N 3.08Å
611	A	96.7	Very high	95.4	Very high	44 Å²	44	41 Å²	41	36%	0.364	24%	0.236	S	C	.	.	H	α-helix	trans	-63.8	-34.6	175.5	0	0	0	0	0	112.4	P607 M608 E614 S615	P607-A611 WeakPolarHBondContact O-CB 3.48Å; P607-A611 PolarHBondContact O-N 2.85Å; M608-A611 PolarHBondContact O-N 3.32Å; A611-E614 PolarHBondContact O-N 3.34Å; A611-S615 PolarHBondContact O-N 2.88Å; A611-S615 VanDerWaalsContact O-N 3.15Å; A611-S615 PolarHBondContact O-OG 3.49Å; A611-S615 VanDerWaalsContact O-OG 3.06Å
612	L	97.4	Very high	95.5	Very high	39 Å²	39	41.2 Å²	41.2	20%	0.204	24%	0.237	C	C	.	.	H	α-helix	trans	-67.2	-37.8	171.9	-67	168.9	0	0	0	111.8	M608 A610 S615 T616 L621 S622 I625	M608-L612 VanDerWaalsContact O-CG 3.28Å; M608-L612 WeakPolarHBondContact O-CG 3.43Å; M608-L612 PolarHBondContact O-N 3.36Å; A610-L612 VanDerWaalsContact C-N 3.28Å; A610-L612 PolarHBondContact O-N 3.42Å; L612-S615 PolarHBondContact O-N 2.64Å; L612-S615 PolarHBondContact O-OG 3.02Å; L612-S615 VanDerWaalsContact O-OG 3.05Å; L612-T616 WeakPolarHBondContact O-CB 3.36Å; L612-T616 WeakPolarHBondContact O-CG2 3.17Å; L612-T616 PolarHBondContact O-N 3.02Å; L612-T616 PolarHBondContact O-OG1 3.07Å; L612-L621 HydrophobicContact CD1-CG 4.34Å; L612-L621 HydrophobicContact CD2-CD2 3.76Å; L612-L621 HydrophobicContact CD2-CG 4.2Å; L612-S622 WeakPolarHBondContact CB-OG 3.49Å; L612-I625 HydrophobicContact CD1-CD1 3.66Å
613	F	96.1	Very high	95.7	Very high	47 Å²	47	41 Å²	41	21%	0.206	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-43.2	172.3	175	-93.7	0	0	0	111.8	M492 A609 A610 S615 T616 G617 Y619	M492-F613 HydrophobicContact CE-CE2 4.09Å; M492-F613 HydrophobicContact SD-CE2 3.75Å; M492-F613 HydrophobicContact SD-CZ 4.43Å; A609-F613 PolarHBondContact O-N 3.49Å; A610-F613 WeakPolarHBondContact O-CA 3.2Å; A610-F613 WeakPolarHBondContact O-CB 3.33Å; A610-F613 PolarHBondContact O-N 2.96Å; A610-F613 VanDerWaalsContact O-N 3.11Å; F613-S615 VanDerWaalsContact C-N 3.26Å; F613-S615 PolarHBondContact O-N 3.45Å; F613-T616 PolarHBondContact O-N 2.9Å; F613-G617 VanDerWaalsContact O-CA 3.25Å; F613-G617 WeakPolarHBondContact O-CA 3.2Å; F613-G617 PolarHBondContact O-N 3.4Å; F613-Y619 HydrophobicContact CB-CD1 3.83Å; F613-Y619 HydrophobicContact CB-CE1 3.6Å; F613-Y619 HydrophobicContact CD1-CE1 4.41Å; F613-Y619 AromaticContact CD2-CD1 3.85Å; F613-Y619 HydrophobicContact CD2-CD1 3.85Å; F613-Y619 AromaticContact CD2-CD2 3.63Å; F613-Y619 HydrophobicContact CD2-CD2 3.63Å; F613-Y619 AromaticContact CD2-CE1 3.67Å; F613-Y619 HydrophobicContact CD2-CE1 3.67Å; F613-Y619 AromaticContact CD2-CE2 3.43Å; F613-Y619 HydrophobicContact CD2-CE2 3.43Å; F613-Y619 VanDerWaalsContact CD2-CE2 3.43Å; F613-Y619 AromaticContact CD2-CG 3.83Å; F613-Y619 HydrophobicContact CD2-CG 3.83Å; F613-Y619 AromaticContact CD2-CZ 3.47Å; F613-Y619 VanDerWaalsContact CD2-CZ 3.47Å; F613-Y619 AromaticContact CE2-CD2 3.9Å; F613-Y619 HydrophobicContact CE2-CD2 3.9Å; F613-Y619 HydrophobicContact CE2-CE1 4.5Å; F613-Y619 AromaticContact CE2-CE2 3.51Å; F613-Y619 HydrophobicContact CE2-CE2 3.51Å; F613-Y619 AromaticContact CE2-CZ 3.85Å; F613-Y619 HydrophobicContact CG-CD1 4.09Å; F613-Y619 AromaticContact CG-CE1 3.63Å; F613-Y619 HydrophobicContact CG-CE1 3.63Å; F613-Y619 HydrophobicContact CG-CE2 4.13Å; F613-Y619 AromaticContact CG-CZ 3.66Å; F613-Y619 HydrophobicContact CZ-CE2 4.23Å
614	E	95.3	Very high	95.8	Very high	79 Å²	79	41.7 Å²	41.7	37%	0.369	24%	0.237	S	C	.	.	H	α-helix	trans	-61.1	-34	178.4	-73.6	163.4	-176.6	0	0	112.9	T97 P98 S99 A610 A611	T97-E614 VanDerWaalsContact CB-OE1 3.24Å; T97-E614 WeakPolarHBondContact CB-OE1 3.25Å; P98-E614 WeakPolarHBondContact CD-OE1 3.2Å; S99-E614 VanDerWaalsContact CB-OE1 3.25Å; S99-E614 WeakPolarHBondContact CB-OE1 3.42Å; S99-E614 WeakPolarHBondContact CB-OE2 3.35Å; S99-E614 PolarHBondContact N-OE1 3.18Å; S99-E614 PolarHBondContact OG-OE1 3.46Å; S99-E614 PolarHBondContact OG-OE2 3.22Å; A610-E614 WeakPolarHBondContact O-CG 3.39Å; A610-E614 PolarHBondContact O-N 3.08Å; A611-E614 PolarHBondContact O-N 3.34Å
615	S	95	Very high	96	Very high	91 Å²	91	42 Å²	42	64%	0.636	24%	0.238	S	C	*	.	H	α-helix	trans	-85.7	-32.3	179.4	52.4	0	0	0	0	114.2	A611 L612 F613	A611-S615 PolarHBondContact O-N 2.88Å; A611-S615 VanDerWaalsContact O-N 3.15Å; A611-S615 PolarHBondContact O-OG 3.49Å; A611-S615 VanDerWaalsContact O-OG 3.06Å; L612-S615 PolarHBondContact O-N 2.64Å; L612-S615 PolarHBondContact O-OG 3.02Å; L612-S615 VanDerWaalsContact O-OG 3.05Å; F613-S615 VanDerWaalsContact C-N 3.26Å; F613-S615 PolarHBondContact O-N 3.45Å
616	T	96.3	Very high	96.1	Very high	67 Å²	67	42 Å²	42	41%	0.411	24%	0.237	S	C	.	.	H	α-helix	trans	-106.3	-15.1	-173.9	65.4	0	0	0	0	114.2	L612 F613 T618 L621	L612-T616 WeakPolarHBondContact O-CB 3.36Å; L612-T616 WeakPolarHBondContact O-CG2 3.17Å; L612-T616 PolarHBondContact O-N 3.02Å; L612-T616 PolarHBondContact O-OG1 3.07Å; F613-T616 PolarHBondContact O-N 2.9Å; T616-T618 PolarHBondContact O-N 3.2Å; T616-T618 PolarHBondContact OG1-N 2.88Å; T616-T618 PolarHBondContact OG1-O 3.15Å; T616-L621 HydrophobicContact CG2-CD2 4.31Å
617	G	94.4	Very high	96.3	Very high	42 Å²	42	42 Å²	42	43%	0.433	24%	0.237	S	C	.	.	S	Bend	trans	71.4	6.4	-172.3	0	0	0	0	0	114.7	M492 F613	M492-G617 WeakPolarHBondContact CE-O 3.49Å; F613-G617 VanDerWaalsContact O-CA 3.25Å; F613-G617 WeakPolarHBondContact O-CA 3.2Å; F613-G617 PolarHBondContact O-N 3.4Å
618	T	95.2	Very high	96.5	Very high	46 Å²	46	42 Å²	42	28%	0.282	24%	0.242	S	C	.	.	S	Bend	trans	-142.5	156.3	-178.6	75.4	0	0	0	0	111.9	T616 Q620	T616-T618 PolarHBondContact O-N 3.2Å; T616-T618 PolarHBondContact OG1-N 2.88Å; T616-T618 PolarHBondContact OG1-O 3.15Å; T618-Q620 VanDerWaalsContact C-N 3.3Å
619	Y	95.4	Very high	96.6	Very high	11 Å²	11	39.9 Å²	39.9	4%	0.043	23%	0.232	C	C	.	.	S	Bend	trans	-86.8	3.4	176	-67.2	-74.1	0	0	0	113.6	Y485 R488 M492 F613 L621 S622 F623	Y485-Y619 HydrophobicContact CD1-CD1 4.13Å; Y485-Y619 AromaticContact CD1-CE1 3.34Å; Y485-Y619 HydrophobicContact CD1-CE1 3.34Å; Y485-Y619 AromaticContact CD1-CZ 3.71Å; Y485-Y619 HydrophobicContact CD2-CD1 4.45Å; Y485-Y619 HydrophobicContact CD2-CE1 4.33Å; Y485-Y619 AromaticContact CE1-CE1 3.97Å; Y485-Y619 HydrophobicContact CE1-CE1 3.97Å; Y485-Y619 AromaticContact CG-CD1 3.85Å; Y485-Y619 HydrophobicContact CG-CD1 3.85Å; Y485-Y619 AromaticContact CG-CE1 3.55Å; Y485-Y619 HydrophobicContact CG-CE1 3.55Å; R488-Y619 HydrophobicContact CB-CD2 4.36Å; R488-Y619 HydrophobicContact CB-CE2 3.62Å; M492-Y619 HydrophobicContact SD-CD2 3.99Å; M492-Y619 HydrophobicContact SD-CE2 4.04Å; F613-Y619 HydrophobicContact CB-CD1 3.83Å; F613-Y619 HydrophobicContact CB-CE1 3.6Å; F613-Y619 HydrophobicContact CD1-CE1 4.41Å; F613-Y619 AromaticContact CD2-CD1 3.85Å; F613-Y619 HydrophobicContact CD2-CD1 3.85Å; F613-Y619 AromaticContact CD2-CD2 3.63Å; F613-Y619 HydrophobicContact CD2-CD2 3.63Å; F613-Y619 AromaticContact CD2-CE1 3.67Å; F613-Y619 HydrophobicContact CD2-CE1 3.67Å; F613-Y619 AromaticContact CD2-CE2 3.43Å; F613-Y619 HydrophobicContact CD2-CE2 3.43Å; F613-Y619 VanDerWaalsContact CD2-CE2 3.43Å; F613-Y619 AromaticContact CD2-CG 3.83Å; F613-Y619 HydrophobicContact CD2-CG 3.83Å; F613-Y619 AromaticContact CD2-CZ 3.47Å; F613-Y619 VanDerWaalsContact CD2-CZ 3.47Å; F613-Y619 AromaticContact CE2-CD2 3.9Å; F613-Y619 HydrophobicContact CE2-CD2 3.9Å; F613-Y619 HydrophobicContact CE2-CE1 4.5Å; F613-Y619 AromaticContact CE2-CE2 3.51Å; F613-Y619 HydrophobicContact CE2-CE2 3.51Å; F613-Y619 AromaticContact CE2-CZ 3.85Å; F613-Y619 HydrophobicContact CG-CD1 4.09Å; F613-Y619 AromaticContact CG-CE1 3.63Å; F613-Y619 HydrophobicContact CG-CE1 3.63Å; F613-Y619 HydrophobicContact CG-CE2 4.13Å; F613-Y619 AromaticContact CG-CZ 3.66Å; F613-Y619 HydrophobicContact CZ-CE2 4.23Å; Y619-L621 PolarHBondContact O-N 3.49Å; Y619-S622 VanDerWaalsContact O-CB 3.32Å; Y619-S622 WeakPolarHBondContact O-CB 3.34Å; Y619-S622 PolarHBondContact O-N 3.28Å; Y619-S622 VanDerWaalsContact O-N 3.15Å; Y619-F623 VanDerWaalsContact CB-CE2 3.46Å; Y619-F623 WeakPolarHBondContact O-CD2 3.38Å; Y619-F623 PolarHBondContact O-N 2.73Å
620	Q	96	Very high	96.6	Very high	80 Å²	80	39.8 Å²	39.8	37%	0.374	23%	0.231	S	C	.	.	H	α-helix	trans	-60.5	-48.9	-171.6	-59.5	-172	5.3	0	0	112.1	P548 T618 S622 F623 Y624	P548-Q620 HydrophobicContact CB-CB 4.07Å; P548-Q620 HydrophobicContact CB-CG 4.01Å; P548-Q620 HydrophobicContact CG-CB 4.2Å; T618-Q620 VanDerWaalsContact C-N 3.3Å; Q620-S622 VanDerWaalsContact C-N 3.27Å; Q620-S622 PolarHBondContact O-N 3.3Å; Q620-F623 PolarHBondContact O-N 3.36Å; Q620-Y624 HydrophobicContact CB-CE2 4.16Å; Q620-Y624 WeakPolarHBondContact O-CD2 3.27Å; Q620-Y624 PolarHBondContact O-N 3.41Å
621	L	96.7	Very high	96.7	Very high	72 Å²	72	40.9 Å²	40.9	38%	0.377	24%	0.238	S	C	.	.	H	α-helix	trans	-62.9	-35.7	178.6	-174.7	54.7	0	0	0	111.8	L612 T616 Y619 F623 Y624 I625	L612-L621 HydrophobicContact CD1-CG 4.34Å; L612-L621 HydrophobicContact CD2-CD2 3.76Å; L612-L621 HydrophobicContact CD2-CG 4.2Å; T616-L621 HydrophobicContact CG2-CD2 4.31Å; Y619-L621 PolarHBondContact O-N 3.49Å; L621-F623 PolarHBondContact O-N 3.28Å; L621-Y624 PolarHBondContact O-N 2.88Å; L621-I625 HydrophobicContact CD1-CD1 3.92Å; L621-I625 HydrophobicContact CD1-CG1 4.17Å; L621-I625 HydrophobicContact CG-CD1 3.93Å; L621-I625 WeakPolarHBondContact O-CB 3.33Å; L621-I625 WeakPolarHBondContact O-CG1 3.43Å; L621-I625 PolarHBondContact O-N 3.45Å
622	S	96.9	Very high	96.7	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.021	25%	0.245	C	C	.	.	H	α-helix	trans	-62	-41.9	175.2	-49.1	0	0	0	0	111.9	A609 L612 Y619 Q620 S626	A609-S622 WeakPolarHBondContact CA-OG 3.39Å; A609-S622 PolarHBondContact O-OG 2.91Å; L612-S622 WeakPolarHBondContact CB-OG 3.49Å; Y619-S622 VanDerWaalsContact O-CB 3.32Å; Y619-S622 WeakPolarHBondContact O-CB 3.34Å; Y619-S622 PolarHBondContact O-N 3.28Å; Y619-S622 VanDerWaalsContact O-N 3.15Å; Q620-S622 VanDerWaalsContact C-N 3.27Å; Q620-S622 PolarHBondContact O-N 3.3Å; S622-S626 WeakPolarHBondContact O-CB 3.5Å; S622-S626 PolarHBondContact O-N 2.92Å
623	F	98.2	Very high	96.6	Very high	0 Å²	0	41 Å²	41	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-73.3	-37.8	176	-63.7	-52.4	0	0	0	113.1	V481 Q489 L547 P548 Y619 Q620 L621 S626 G627	V481-F623 HydrophobicContact CG1-CD1 4.19Å; V481-F623 HydrophobicContact CG1-CE1 4.22Å; Q489-F623 HydrophobicContact CB-CE2 3.84Å; Q489-F623 HydrophobicContact CB-CZ 4.17Å; Q489-F623 HydrophobicContact CG-CE2 3.88Å; L547-F623 HydrophobicContact CD2-CB 4.48Å; L547-F623 HydrophobicContact CD2-CD1 3.59Å; L547-F623 HydrophobicContact CD2-CD2 3.97Å; L547-F623 HydrophobicContact CD2-CE1 3.67Å; L547-F623 HydrophobicContact CD2-CE2 4.04Å; L547-F623 HydrophobicContact CD2-CG 3.76Å; L547-F623 HydrophobicContact CD2-CZ 3.9Å; L547-F623 HydrophobicContact CG-CD2 4.39Å; L547-F623 HydrophobicContact CG-CG 4.43Å; P548-F623 HydrophobicContact CG-CB 3.92Å; P548-F623 HydrophobicContact CG-CD2 4.47Å; Y619-F623 VanDerWaalsContact CB-CE2 3.46Å; Y619-F623 WeakPolarHBondContact O-CD2 3.38Å; Y619-F623 PolarHBondContact O-N 2.73Å; Q620-F623 PolarHBondContact O-N 3.36Å; L621-F623 PolarHBondContact O-N 3.28Å; F623-S626 PolarHBondContact O-N 3.22Å; F623-G627 PolarHBondContact O-N 2.74Å
624	Y	98.2	Very high	96.5	Very high	76 Å²	76	38.8 Å²	38.8	30%	0.298	23%	0.226	S	C	.	.	H	α-helix	trans	-60.1	-46	173.3	-71.1	-48.2	0	0	0	112	M545 P548 H549 Q620 L621 G628	M545-Y624 HydrophobicContact CG-CD1 3.87Å; M545-Y624 VanDerWaalsContact O-CD1 3.24Å; M545-Y624 WeakPolarHBondContact O-CD1 3.34Å; M545-Y624 WeakPolarHBondContact O-CE1 3.15Å; P548-Y624 HydrophobicContact CB-CE1 4.29Å; P548-Y624 HydrophobicContact CB-CE2 4.35Å; P548-Y624 HydrophobicContact CG-CD1 4.21Å; P548-Y624 HydrophobicContact CG-CE1 3.84Å; P548-Y624 HydrophobicContact CG-CE2 4.16Å; H549-Y624 AromaticContact CE1-CE1 3.8Å; H549-Y624 AromaticContact CE1-CZ 3.86Å; H549-Y624 PolarHBondContact CE1-OH 3.32Å; H549-Y624 PolarHBondContact NE2-OH 2.98Å; Q620-Y624 HydrophobicContact CB-CE2 4.16Å; Q620-Y624 WeakPolarHBondContact O-CD2 3.27Å; Q620-Y624 PolarHBondContact O-N 3.41Å; L621-Y624 PolarHBondContact O-N 2.88Å; Y624-G628 WeakPolarHBondContact O-CA 3.43Å; Y624-G628 PolarHBondContact O-N 3.49Å
625	I	97.8	Very high	96.4	Very high	67 Å²	67	37.1 Å²	37.1	34%	0.344	23%	0.225	S	C	.	.	H	α-helix	trans	-68.1	-47	178.8	-69.5	169.6	0	0	0	110.7	L612 L621 G628 L629	L612-I625 HydrophobicContact CD1-CD1 3.66Å; L621-I625 HydrophobicContact CD1-CD1 3.92Å; L621-I625 HydrophobicContact CD1-CG1 4.17Å; L621-I625 HydrophobicContact CG-CD1 3.93Å; L621-I625 WeakPolarHBondContact O-CB 3.33Å; L621-I625 WeakPolarHBondContact O-CG1 3.43Å; L621-I625 PolarHBondContact O-N 3.45Å; I625-G628 PolarHBondContact O-N 2.97Å; I625-L629 HydrophobicContact CG2-CD1 3.94Å; I625-L629 HydrophobicContact CG2-CG 4.38Å; I625-L629 VanDerWaalsContact O-CG 3.27Å; I625-L629 WeakPolarHBondContact O-CG 3.28Å; I625-L629 PolarHBondContact O-N 3.34Å
626	S	97.5	Very high	96.1	Very high	3 Å²	3	34.3 Å²	34.3	2%	0.021	21%	0.208	C	C	.	.	H	α-helix	trans	-56.8	-52.9	177.5	166	0	0	0	0	111.8	G478 S622 F623 G628 L629 M630	G478-S626 VanDerWaalsContact C-OG 3.27Å; G478-S626 WeakPolarHBondContact CA-OG 3.36Å; G478-S626 PolarHBondContact O-OG 2.86Å; S622-S626 WeakPolarHBondContact O-CB 3.5Å; S622-S626 PolarHBondContact O-N 2.92Å; F623-S626 PolarHBondContact O-N 3.22Å; S626-G628 PolarHBondContact O-N 2.94Å; S626-L629 PolarHBondContact O-N 3.45Å; S626-M630 WeakPolarHBondContact O-CG 3.13Å; S626-M630 PolarHBondContact O-N 2.85Å
627	G	98.1	Very high	95.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-65.4	-37.6	178.6	0	0	0	0	0	113.2	G541 F623 M630 T631	G541-G627 CarbonylContact C-O 3.6Å; G541-G627 VanDerWaalsContact CA-O 3.25Å; G541-G627 WeakPolarHBondContact CA-O 3.21Å; G541-G627 CarbonylContact O-C 3.6Å; G541-G627 WeakPolarHBondContact O-CA 3.25Å; F623-G627 PolarHBondContact O-N 2.74Å; G627-M630 PolarHBondContact O-N 3.19Å; G627-T631 WeakPolarHBondContact O-CB 3.33Å; G627-T631 PolarHBondContact O-N 3.41Å; G627-T631 PolarHBondContact O-OG1 3.14Å
628	G	97.9	Very high	95.3	Very high	21 Å²	21	35.3 Å²	35.3	22%	0.216	20%	0.201	C	C	.	.	H	α-helix	trans	-60.7	-47.7	175.2	0	0	0	0	0	112.5	Y624 I625 S626 M630 T631 V632	Y624-G628 WeakPolarHBondContact O-CA 3.43Å; Y624-G628 PolarHBondContact O-N 3.49Å; I625-G628 PolarHBondContact O-N 2.97Å; S626-G628 PolarHBondContact O-N 2.94Å; G628-M630 PolarHBondContact O-N 3.07Å; G628-T631 PolarHBondContact O-N 2.91Å; G628-V632 WeakPolarHBondContact O-CG2 3.27Å; G628-V632 PolarHBondContact O-N 3Å
629	L	97.1	Very high	95	Very high	47 Å²	47	34.7 Å²	34.7	25%	0.246	20%	0.203	C	C	.	.	H	α-helix	trans	-60.9	-42.8	177.4	-69.5	170.6	0	0	0	112.1	L474 V477 I625 S626 V632 A633	L474-L629 HydrophobicContact CD2-CD2 3.94Å; V477-L629 HydrophobicContact CB-CD1 4.08Å; V477-L629 HydrophobicContact CG1-CD1 3.73Å; I625-L629 HydrophobicContact CG2-CD1 3.94Å; I625-L629 HydrophobicContact CG2-CG 4.38Å; I625-L629 VanDerWaalsContact O-CG 3.27Å; I625-L629 WeakPolarHBondContact O-CG 3.28Å; I625-L629 PolarHBondContact O-N 3.34Å; S626-L629 PolarHBondContact O-N 3.45Å; L629-V632 PolarHBondContact O-N 3.47Å; L629-A633 PolarHBondContact O-N 3.23Å
630	M	96.8	Very high	94.8	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-65.9	-38.1	175.9	-66.7	175.7	77.2	0	0	112.3	A475 T540 F563 I567 S626 G627 G628 A633 G634	A475-M630 HydrophobicContact CB-CG 4.46Å; T540-M630 WeakPolarHBondContact OG1-CE 3.37Å; F563-M630 HydrophobicContact CE2-CE 4.08Å; F563-M630 HydrophobicContact CE2-SD 4.38Å; I567-M630 HydrophobicContact CD1-CE 4.12Å; S626-M630 WeakPolarHBondContact O-CG 3.13Å; S626-M630 PolarHBondContact O-N 2.85Å; G627-M630 PolarHBondContact O-N 3.19Å; G628-M630 PolarHBondContact O-N 3.07Å; M630-A633 WeakPolarHBondContact O-CB 3.5Å; M630-A633 PolarHBondContact O-N 2.93Å; M630-G634 PolarHBondContact O-N 2.95Å
631	T	97.4	Very high	94.6	Very high	23 Å²	23	32.4 Å²	32.4	14%	0.141	20%	0.195	C	C	.	.	H	α-helix	trans	-65.6	-44.1	176.5	-55.7	0	0	0	0	111	F538 G541 I542 G627 G628 A633 G634 A635	F538-T631 HydrophobicContact CD2-CG2 3.89Å; F538-T631 HydrophobicContact CE2-CG2 3.72Å; G541-T631 WeakPolarHBondContact CA-OG1 3.42Å; I542-T631 HydrophobicContact CG1-CG2 4.08Å; I542-T631 PolarHBondContact N-OG1 3.46Å; G627-T631 WeakPolarHBondContact O-CB 3.33Å; G627-T631 PolarHBondContact O-N 3.41Å; G627-T631 PolarHBondContact O-OG1 3.14Å; G628-T631 PolarHBondContact O-N 2.91Å; T631-A633 VanDerWaalsContact C-N 3.32Å; T631-A633 PolarHBondContact O-N 3.39Å; T631-G634 PolarHBondContact O-N 3.16Å; T631-A635 WeakPolarHBondContact O-CB 3.3Å; T631-A635 PolarHBondContact O-N 3.25Å
632	V	96.3	Very high	94.3	Very high	84 Å²	84	37 Å²	37	51%	0.509	21%	0.211	S	C	.	.	H	α-helix	trans	-61.5	-40.5	174.8	171.5	0	0	0	0	111	L474 G628 L629 A635 A636	L474-V632 HydrophobicContact CD1-CG1 4.12Å; G628-V632 WeakPolarHBondContact O-CG2 3.27Å; G628-V632 PolarHBondContact O-N 3Å; L629-V632 PolarHBondContact O-N 3.47Å; V632-A635 PolarHBondContact O-N 2.65Å; V632-A636 WeakPolarHBondContact O-CB 3.32Å; V632-A636 PolarHBondContact O-N 2.79Å
633	A	95.3	Very high	94.1	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-60.3	-44.8	174	0	0	0	0	0	112.4	A471 L474 A475 L629 M630 T631 A636 G637	A471-A633 HydrophobicContact CB-CB 4.14Å; A471-A633 WeakPolarHBondContact O-CB 3.4Å; L474-A633 HydrophobicContact CB-CB 4.29Å; A475-A633 HydrophobicContact CB-CB 3.88Å; L629-A633 PolarHBondContact O-N 3.23Å; M630-A633 WeakPolarHBondContact O-CB 3.5Å; M630-A633 PolarHBondContact O-N 2.93Å; T631-A633 VanDerWaalsContact C-N 3.32Å; T631-A633 PolarHBondContact O-N 3.39Å; A633-A636 PolarHBondContact O-N 2.93Å; A633-G637 PolarHBondContact O-N 3.3Å; A633-G637 VanDerWaalsContact O-N 3.16Å
634	G	94.2	Very high	93.8	Very high	1 Å²	1	39.4 Å²	39.4	1%	0.01	22%	0.224	C	C	.	.	H	α-helix	trans	-63.3	-41.8	175.4	0	0	0	0	0	113	M630 T631 G637	M630-G634 PolarHBondContact O-N 2.95Å; T631-G634 PolarHBondContact O-N 3.16Å; G634-G637 PolarHBondContact O-N 3.35Å
635	A	93	Very high	93.5	Very high	44 Å²	44	41.1 Å²	41.1	36%	0.364	24%	0.237	S	C	.	.	H	α-helix	trans	-65.8	-42.6	177.4	0	0	0	0	0	112.3	T631 V632 G637 L638	T631-A635 WeakPolarHBondContact O-CB 3.3Å; T631-A635 PolarHBondContact O-N 3.25Å; V632-A635 PolarHBondContact O-N 2.65Å; A635-G637 PolarHBondContact O-N 2.93Å; A635-L638 WeakPolarHBondContact O-CB 3.45Å; A635-L638 PolarHBondContact O-N 3.22Å; A635-L638 VanDerWaalsContact O-N 3.08Å
636	A	89.7	Confident	93.3	Very high	32 Å²	32	43.7 Å²	43.7	26%	0.264	24%	0.243	S	C	.	.	H	α-helix	trans	-57.1	-35.9	173	0	0	0	0	0	111.5	L467 A471 V632 A633 L638 G639	L467-A636 HydrophobicContact CD1-CB 4.12Å; A471-A636 HydrophobicContact CB-CB 4.42Å; V632-A636 WeakPolarHBondContact O-CB 3.32Å; V632-A636 PolarHBondContact O-N 2.79Å; A633-A636 PolarHBondContact O-N 2.93Å; A636-L638 VanDerWaalsContact C-N 3.3Å; A636-L638 PolarHBondContact O-N 2.71Å; A636-G639 PolarHBondContact O-N 3.47Å
637	G	84.8	Confident	93	Very high	4 Å²	4	44.5 Å²	44.5	4%	0.041	25%	0.247	C	C	.	.	H	α-helix	trans	-60.5	-30.2	175.6	0	0	0	0	0	115.1	N534 A633 G634 A635 G639 L640	N534-G637 PolarHBondContact ND2-O 3.16Å; N534-G637 VanDerWaalsContact OD1-CA 3.25Å; N534-G637 WeakPolarHBondContact OD1-CA 3.35Å; A633-G637 PolarHBondContact O-N 3.3Å; A633-G637 VanDerWaalsContact O-N 3.16Å; G634-G637 PolarHBondContact O-N 3.35Å; A635-G637 PolarHBondContact O-N 2.93Å; G637-G639 PolarHBondContact O-N 3.45Å; G637-L640 WeakPolarHBondContact O-CB 3.39Å; G637-L640 PolarHBondContact O-N 3.42Å
638	L	88.4	Confident	92.6	Very high	127 Å²	127	49.2 Å²	49.2	67%	0.665	27%	0.269	S	S	*	.	H	α-helix	trans	-60.5	-29.9	179.9	-63.7	175.8	0	0	0	112.5	A635 A636	A635-L638 WeakPolarHBondContact O-CB 3.45Å; A635-L638 PolarHBondContact O-N 3.22Å; A635-L638 VanDerWaalsContact O-N 3.08Å; A636-L638 VanDerWaalsContact C-N 3.3Å; A636-L638 PolarHBondContact O-N 2.71Å
639	G	88.4	Confident	92.2	Very high	32 Å²	32	50.9 Å²	50.9	33%	0.33	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-13.1	175.1	0	0	0	0	0	114.3	A636 G637 N641 K642 L643	A636-G639 PolarHBondContact O-N 3.47Å; G637-G639 PolarHBondContact O-N 3.45Å; G639-N641 PolarHBondContact O-N 3.21Å; G639-K642 PolarHBondContact O-N 3.13Å; G639-L643 WeakPolarHBondContact O-CB 3.5Å; G639-L643 PolarHBondContact O-N 2.76Å
640	L	92.4	Very high	91.9	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-64.5	-43.4	-167.7	-172.4	62.1	0	0	0	112.9	S464 L467 F468 I530 V577 L581 G637 K642 L643 L644	S464-L640 VanDerWaalsContact O-CD1 3.26Å; S464-L640 WeakPolarHBondContact O-CD1 3.32Å; L467-L640 HydrophobicContact CB-CD1 4.48Å; L467-L640 HydrophobicContact CD2-CD1 4.26Å; F468-L640 HydrophobicContact CB-CD1 4.25Å; F468-L640 HydrophobicContact CB-CD2 4.35Å; F468-L640 HydrophobicContact CD2-CD2 4.04Å; I530-L640 HydrophobicContact CD1-CD2 4.4Å; I530-L640 HydrophobicContact CG1-CD2 4.42Å; I530-L640 HydrophobicContact CG2-CB 4.28Å; I530-L640 HydrophobicContact CG2-CD2 4.04Å; I530-L640 HydrophobicContact CG2-CG 4.46Å; V577-L640 HydrophobicContact CG1-CD2 4.15Å; L581-L640 HydrophobicContact CD1-CD1 4.25Å; L581-L640 HydrophobicContact CD1-CD2 4.24Å; L581-L640 HydrophobicContact CD2-CD1 4.03Å; L581-L640 HydrophobicContact CD2-CD2 4.37Å; L581-L640 HydrophobicContact CD2-CG 4.12Å; G637-L640 WeakPolarHBondContact O-CB 3.39Å; G637-L640 PolarHBondContact O-N 3.42Å; L640-K642 PolarHBondContact O-N 3.41Å; L640-L643 PolarHBondContact O-N 3.04Å; L640-L644 WeakPolarHBondContact O-CB 3.41Å; L640-L644 PolarHBondContact O-N 3.22Å
641	N	90.7	Very high	91.2	Very high	42 Å²	42	61 Å²	61	23%	0.225	32%	0.317	C	S	.	.	H	α-helix	trans	-63	-42	176.4	-89.9	-19.1	0	0	0	111.9	D528 I530 G639 L644 L645	D528-N641 PolarHBondContact OD2-ND2 3.03Å; D528-N641 PolarHBondContact OD2-OD1 2.63Å; I530-N641 WeakPolarHBondContact CD1-OD1 3.36Å; G639-N641 PolarHBondContact O-N 3.21Å; N641-L644 PolarHBondContact O-N 3.4Å; N641-L645 WeakPolarHBondContact O-CG 3.36Å; N641-L645 PolarHBondContact O-N 2.91Å; N641-L645 VanDerWaalsContact O-N 3.08Å
642	K	91.6	Very high	90.5	Very high	167 Å²	167	61.5 Å²	61.5	73%	0.726	33%	0.327	S	S	*	.	H	α-helix	trans	-65.9	-40.7	177.9	-66.2	-177.7	179.9	179.3	0	111.3	G639 L640 W646	G639-K642 PolarHBondContact O-N 3.13Å; L640-K642 PolarHBondContact O-N 3.41Å; K642-W646 WeakPolarHBondContact O-CB 3.42Å; K642-W646 PolarHBondContact O-N 3.17Å
643	L	93.2	Very high	89.7	Confident	44 Å²	44	63.6 Å²	63.6	23%	0.23	33%	0.329	C	S	.	.	H	α-helix	trans	-66.5	-39.9	177.9	-172.6	58.6	0	0	0	111.9	P463 S464 L467 G639 L640 W646 E647	P463-L643 HydrophobicContact CB-CD1 4.11Å; P463-L643 HydrophobicContact CB-CD2 4.15Å; P463-L643 HydrophobicContact CB-CG 4.29Å; P463-L643 WeakPolarHBondContact O-CD2 3.34Å; S464-L643 PolarHBondContact OG-O 2.83Å; L467-L643 HydrophobicContact CB-CD2 4.1Å; L467-L643 HydrophobicContact CD2-CD2 3.75Å; G639-L643 WeakPolarHBondContact O-CB 3.5Å; G639-L643 PolarHBondContact O-N 2.76Å; L640-L643 PolarHBondContact O-N 3.04Å; L643-W646 HydrophobicContact CD1-CE3 3.86Å; L643-W646 HydrophobicContact CD1-CZ3 4.27Å; L643-W646 PolarHBondContact O-N 3.18Å; L643-E647 WeakPolarHBondContact O-CB 3.42Å; L643-E647 PolarHBondContact O-N 2.92Å
644	L	91.7	Very high	88.9	Confident	10 Å²	10	69.9 Å²	69.9	5%	0.052	36%	0.357	C	S	.	.	H	α-helix	trans	-61	-49.5	175.4	179.3	64.2	0	0	0	111.7	S464 K580 L581 L640 N641 W646 E647 Q648	S464-L644 VanDerWaalsContact OG-CA 3.29Å; S464-L644 WeakPolarHBondContact OG-CA 3.12Å; S464-L644 PolarHBondContact OG-N 3.09Å; K580-L644 HydrophobicContact CG-CD2 4.04Å; L581-L644 HydrophobicContact CD2-CB 4.43Å; L581-L644 HydrophobicContact CD2-CD1 4.02Å; L581-L644 HydrophobicContact CD2-CD2 4.15Å; L581-L644 HydrophobicContact CD2-CG 4.43Å; L640-L644 WeakPolarHBondContact O-CB 3.41Å; L640-L644 PolarHBondContact O-N 3.22Å; N641-L644 PolarHBondContact O-N 3.4Å; L644-W646 VanDerWaalsContact C-N 3.31Å; L644-W646 PolarHBondContact O-N 2.9Å; L644-E647 PolarHBondContact O-N 3.4Å; L644-Q648 WeakPolarHBondContact O-CG 3.48Å; L644-Q648 PolarHBondContact O-N 3.16Å
645	L	91.3	Very high	87.9	Confident	112 Å²	112	73.4 Å²	73.4	59%	0.586	38%	0.38	S	S	*	.	H	α-helix	trans	-62.3	-40.4	177.6	-68.5	172.9	0	0	0	111.6	N641 S649	N641-L645 WeakPolarHBondContact O-CG 3.36Å; N641-L645 PolarHBondContact O-N 2.91Å; N641-L645 VanDerWaalsContact O-N 3.08Å; L645-S649 WeakPolarHBondContact O-CB 3.34Å; L645-S649 PolarHBondContact O-N 2.92Å
646	W	93.2	Very high	87.1	Confident	121 Å²	121	75.9 Å²	75.9	46%	0.458	38%	0.384	S	S	.	.	H	α-helix	trans	-61.8	-45	174.3	173	88.4	0	0	0	111.9	P463 K642 L643 L644 S649 R650	P463-W646 HydrophobicContact CB-CZ3 4.5Å; P463-W646 HydrophobicContact CG-CZ3 4.14Å; K642-W646 WeakPolarHBondContact O-CB 3.42Å; K642-W646 PolarHBondContact O-N 3.17Å; L643-W646 HydrophobicContact CD1-CE3 3.86Å; L643-W646 HydrophobicContact CD1-CZ3 4.27Å; L643-W646 PolarHBondContact O-N 3.18Å; L644-W646 VanDerWaalsContact C-N 3.31Å; L644-W646 PolarHBondContact O-N 2.9Å; W646-S649 PolarHBondContact O-N 3.39Å; W646-S649 PolarHBondContact O-OG 3.37Å; W646-R650 VanDerWaalsContact CZ2-CD 3.41Å; W646-R650 HydrophobicContact CZ2-CG 4.37Å; W646-R650 PolarHBondContact O-N 3.1Å; W646-R650 VanDerWaalsContact O-N 3.12Å
647	E	91.4	Very high	86.4	Confident	21 Å²	21	80.6 Å²	80.6	10%	0.098	40%	0.401	C	S	.	.	H	α-helix	trans	-62.4	-45.5	179.2	-176.6	171.8	-176.4	0	0	111.5	S462 P463 S464 L643 L644 S649 R650 Q651	S462-E647 WeakPolarHBondContact CA-OE1 3.13Å; S462-E647 WeakPolarHBondContact CB-OE1 3.34Å; S462-E647 VanDerWaalsContact OG-CD 3.24Å; S462-E647 PolarHBondContact OG-OE1 3.17Å; S462-E647 PolarHBondContact OG-OE2 3.01Å; P463-E647 WeakPolarHBondContact CD-OE1 3.24Å; S464-E647 WeakPolarHBondContact CB-OE2 3.4Å; S464-E647 PolarHBondContact N-OE2 2.92Å; S464-E647 VanDerWaalsContact N-OE2 3.14Å; S464-E647 PolarHBondContact OG-OE2 3.17Å; L643-E647 WeakPolarHBondContact O-CB 3.42Å; L643-E647 PolarHBondContact O-N 2.92Å; L644-E647 PolarHBondContact O-N 3.4Å; E647-S649 PolarHBondContact O-N 3.17Å; E647-R650 PolarHBondContact O-N 2.95Å; E647-Q651 WeakPolarHBondContact O-CG 3.11Å; E647-Q651 PolarHBondContact O-N 3.49Å; E647-Q651 VanDerWaalsContact O-N 3.09Å
648	Q	89.7	Confident	85.7	Confident	99 Å²	99	86.4 Å²	86.4	46%	0.463	43%	0.43	S	S	.	.	H	α-helix	trans	-60.5	-43.5	175	-72.1	174.9	-15.7	0	0	111.6	L644 R650 Q651 G652	L644-Q648 WeakPolarHBondContact O-CG 3.48Å; L644-Q648 PolarHBondContact O-N 3.16Å; Q648-R650 VanDerWaalsContact C-N 3.3Å; Q648-R650 PolarHBondContact O-N 3.34Å; Q648-Q651 PolarHBondContact O-N 2.86Å; Q648-Q651 VanDerWaalsContact O-N 3.16Å; Q648-G652 PolarHBondContact O-N 3.48Å
649	S	90.4	Very high	85	Confident	56 Å²	56	85 Å²	85	39%	0.392	43%	0.426	S	S	.	.	H	α-helix	trans	-61.7	-35	178	78.7	0	0	0	0	113.1	L645 W646 E647 K653	L645-S649 WeakPolarHBondContact O-CB 3.34Å; L645-S649 PolarHBondContact O-N 2.92Å; W646-S649 PolarHBondContact O-N 3.39Å; W646-S649 PolarHBondContact O-OG 3.37Å; E647-S649 PolarHBondContact O-N 3.17Å; S649-K653 WeakPolarHBondContact O-CG 3.48Å; S649-K653 PolarHBondContact O-N 3.14Å; S649-K653 VanDerWaalsContact O-N 3.09Å
650	R	89	Confident	83.7	Confident	142 Å²	142	85.2 Å²	85.2	54%	0.536	43%	0.429	S	S	.	.	H	α-helix	trans	-74.6	-33.2	175.9	-68.7	-159.1	88.1	178.6	11.9	112.6	W646 E647 Q648 K654	W646-R650 VanDerWaalsContact CZ2-CD 3.41Å; W646-R650 HydrophobicContact CZ2-CG 4.37Å; W646-R650 PolarHBondContact O-N 3.1Å; W646-R650 VanDerWaalsContact O-N 3.12Å; E647-R650 PolarHBondContact O-N 2.95Å; Q648-R650 VanDerWaalsContact C-N 3.3Å; Q648-R650 PolarHBondContact O-N 3.34Å; R650-K654 WeakPolarHBondContact O-CG 3.47Å; R650-K654 PolarHBondContact O-N 3.49Å; R650-K654 VanDerWaalsContact O-N 3.15Å
651	Q	84.1	Confident	82.1	Confident	117 Å²	117	89.9 Å²	89.9	55%	0.547	46%	0.457	S	S	.	.	H	α-helix	trans	-68.2	-42.4	174.1	-69.7	179.1	8.3	0	0	110.9	E647 Q648 K654 C655	E647-Q651 WeakPolarHBondContact O-CG 3.11Å; E647-Q651 PolarHBondContact O-N 3.49Å; E647-Q651 VanDerWaalsContact O-N 3.09Å; Q648-Q651 PolarHBondContact O-N 2.86Å; Q648-Q651 VanDerWaalsContact O-N 3.16Å; Q651-K654 PolarHBondContact O-N 2.88Å; Q651-C655 PolarHBondContact O-N 3.27Å
652	G	80.7	Confident	80.1	Confident	35 Å²	35	94.7 Å²	94.7	36%	0.361	48%	0.478	S	S	.	.	H	α-helix	trans	-57.1	-51.9	173.4	0	0	0	0	0	112.3	Q648 K654 C655 E656	Q648-G652 PolarHBondContact O-N 3.48Å; G652-K654 VanDerWaalsContact C-N 3.34Å; G652-K654 PolarHBondContact O-N 3.03Å; G652-C655 WeakPolarHBondContact O-CA 3.48Å; G652-C655 WeakPolarHBondContact O-CB 3.45Å; G652-C655 PolarHBondContact O-N 3.15Å; G652-E656 PolarHBondContact O-N 3.01Å
653	K	81.3	Confident	77.8	Confident	128 Å²	128	88.5 Å²	88.5	56%	0.557	46%	0.461	S	S	*	.	H	α-helix	trans	-58.2	-41.2	177.1	-74.8	178.9	178.5	-174.1	0	113.6	S649 C655 E656 E657	S649-K653 WeakPolarHBondContact O-CG 3.48Å; S649-K653 PolarHBondContact O-N 3.14Å; S649-K653 VanDerWaalsContact O-N 3.09Å; K653-C655 VanDerWaalsContact C-N 3.32Å; K653-C655 PolarHBondContact O-N 3.42Å; K653-E656 PolarHBondContact O-N 3.37Å; K653-E657 WeakPolarHBondContact O-CB 3.18Å; K653-E657 WeakPolarHBondContact O-CG 3.43Å; K653-E657 PolarHBondContact O-N 3.38Å
654	K	77.6	Confident	75.4	Confident	132 Å²	132	90.8 Å²	90.8	57%	0.574	48%	0.477	S	S	*	.	H	α-helix	trans	-64.8	-37.3	175	-77.8	179.8	177.7	-175.8	0	112.3	R650 Q651 G652 L658	R650-K654 WeakPolarHBondContact O-CG 3.47Å; R650-K654 PolarHBondContact O-N 3.49Å; R650-K654 VanDerWaalsContact O-N 3.15Å; Q651-K654 PolarHBondContact O-N 2.88Å; G652-K654 VanDerWaalsContact C-N 3.34Å; G652-K654 PolarHBondContact O-N 3.03Å; K654-L658 WeakPolarHBondContact O-CB 3.47Å; K654-L658 WeakPolarHBondContact O-CD1 3.36Å; K654-L658 WeakPolarHBondContact O-CG 3.32Å; K654-L658 PolarHBondContact O-N 2.79Å
655	C	73.4	Confident	72.7	Confident	74 Å²	74	98.5 Å²	98.5	50%	0.5	52%	0.515	S	S	.	.	H	α-helix	trans	-66.5	-44.5	175.7	-169.2	0	0	0	0	110.6	Q651 G652 K653 E657 L658 V659	Q651-C655 PolarHBondContact O-N 3.27Å; G652-C655 WeakPolarHBondContact O-CA 3.48Å; G652-C655 WeakPolarHBondContact O-CB 3.45Å; G652-C655 PolarHBondContact O-N 3.15Å; K653-C655 VanDerWaalsContact C-N 3.32Å; K653-C655 PolarHBondContact O-N 3.42Å; C655-E657 PolarHBondContact O-N 3.17Å; C655-L658 PolarHBondContact O-N 3.11Å; C655-V659 WeakPolarHBondContact O-CB 3.36Å; C655-V659 VanDerWaalsContact O-CG2 3.26Å; C655-V659 WeakPolarHBondContact O-CG2 3.49Å; C655-V659 PolarHBondContact O-N 3.4Å
656	E	76.5	Confident	70	Confident	97 Å²	97	100.6 Å²	100.6	45%	0.453	52%	0.522	S	S	.	.	H	α-helix	trans	-61	-41.4	173.8	-70.5	176.9	167.6	0	0	112.5	G652 K653 V659 G660	G652-E656 PolarHBondContact O-N 3.01Å; K653-E656 PolarHBondContact O-N 3.37Å; E656-V659 PolarHBondContact O-N 2.8Å; E656-G660 WeakPolarHBondContact O-CA 3.25Å; E656-G660 PolarHBondContact O-N 3.32Å
657	E	74.2	Confident	67	Low	130 Å²	130	102.9 Å²	102.9	61%	0.607	54%	0.535	S	S	*	.	H	α-helix	trans	-63.4	-43.2	174.4	-76.3	170.2	-174.1	0	0	111.5	K653 C655 G660 V661	K653-E657 WeakPolarHBondContact O-CB 3.18Å; K653-E657 WeakPolarHBondContact O-CG 3.43Å; K653-E657 PolarHBondContact O-N 3.38Å; C655-E657 PolarHBondContact O-N 3.17Å; E657-G660 PolarHBondContact O-N 3.01Å; E657-V661 WeakPolarHBondContact O-CB 3.28Å; E657-V661 WeakPolarHBondContact O-CG2 3.46Å; E657-V661 PolarHBondContact O-N 3.4Å
658	L	70.4	Confident	64	Low	127 Å²	127	109.1 Å²	109.1	67%	0.665	57%	0.569	S	S	*	*	H	α-helix	trans	-66.3	-42.9	177.3	-73.4	167.8	0	0	0	112	K654 C655 V661 H662	K654-L658 WeakPolarHBondContact O-CB 3.47Å; K654-L658 WeakPolarHBondContact O-CD1 3.36Å; K654-L658 WeakPolarHBondContact O-CG 3.32Å; K654-L658 PolarHBondContact O-N 2.79Å; C655-L658 PolarHBondContact O-N 3.11Å; L658-V661 PolarHBondContact O-N 3.26Å; L658-H662 PolarHBondContact O-N 2.81Å
659	V	73.8	Confident	61.3	Low	96 Å²	96	113.7 Å²	113.7	58%	0.582	59%	0.588	S	S	*	*	H	α-helix	trans	-67.3	-37	174.9	173.8	0	0	0	0	110.6	C655 E656 H662 G663	C655-V659 WeakPolarHBondContact O-CB 3.36Å; C655-V659 VanDerWaalsContact O-CG2 3.26Å; C655-V659 WeakPolarHBondContact O-CG2 3.49Å; C655-V659 PolarHBondContact O-N 3.4Å; E656-V659 PolarHBondContact O-N 2.8Å; V659-H662 PolarHBondContact O-N 2.87Å; V659-G663 WeakPolarHBondContact O-CA 3.36Å; V659-G663 PolarHBondContact O-N 2.91Å
660	G	60.2	Low	58.3	Low	38 Å²	38	117.9 Å²	117.9	39%	0.392	61%	0.611	S	S	.	*	H	α-helix	trans	-69.2	-34.1	175.8	0	0	0	0	0	113.1	E656 E657 T664	E656-G660 WeakPolarHBondContact O-CA 3.25Å; E656-G660 PolarHBondContact O-N 3.32Å; E657-G660 PolarHBondContact O-N 3.01Å; G660-T664 WeakPolarHBondContact O-CB 3.25Å; G660-T664 WeakPolarHBondContact O-CG2 3.41Å; G660-T664 PolarHBondContact O-N 3.35Å; G660-T664 PolarHBondContact O-OG1 3.31Å
661	V	59.4	Low	55.6	Low	99 Å²	99	120.6 Å²	120.6	60%	0.6	63%	0.627	S	S	*	*	H	α-helix	trans	-72.9	-36.5	173.2	172.1	0	0	0	0	111.4	E657 L658 T664	E657-V661 WeakPolarHBondContact O-CB 3.28Å; E657-V661 WeakPolarHBondContact O-CG2 3.46Å; E657-V661 PolarHBondContact O-N 3.4Å; L658-V661 PolarHBondContact O-N 3.26Å; V661-T664 WeakPolarHBondContact CA-OG1 3.41Å; V661-T664 PolarHBondContact O-OG1 2.99Å; V661-T664 VanDerWaalsContact O-OG1 3.05Å
662	H	49.1	Very low	53	Low	144 Å²	144	120.4 Å²	120.4	67%	0.667	64%	0.639	S	S	*	*	H	α-helix	trans	-74.5	-37.8	172.6	-121.6	63.2	0	0	0	112.4	L658 V659 T664 M665 E666	L658-H662 PolarHBondContact O-N 2.81Å; V659-H662 PolarHBondContact O-N 2.87Å; H662-T664 VanDerWaalsContact C-N 3.27Å; H662-T664 PolarHBondContact O-N 2.77Å; H662-M665 WeakPolarHBondContact O-CA 3.24Å; H662-M665 WeakPolarHBondContact O-CB 3.18Å; H662-M665 PolarHBondContact O-N 3.34Å; H662-E666 PolarHBondContact O-N 3.41Å
663	G	44	Very low	50.7	Low	36 Å²	36	122.7 Å²	122.7	37%	0.371	65%	0.649	S	S	.	*	H	α-helix	trans	-72.7	-15.7	176.1	0	0	0	0	0	113.7	V659 E666 K667	V659-G663 WeakPolarHBondContact O-CA 3.36Å; V659-G663 PolarHBondContact O-N 2.91Å; G663-E666 CarbonylContact O-C 3.56Å; G663-K667 PolarHBondContact O-N 3Å
664	T	41.5	Very low	48.4	Very low	92 Å²	92	120.1 Å²	120.1	56%	0.564	65%	0.646	S	S	*	*	H	α-helix	trans	-82.1	-18	166	37.2	0	0	0	0	113	G660 V661 H662	G660-T664 WeakPolarHBondContact O-CB 3.25Å; G660-T664 WeakPolarHBondContact O-CG2 3.41Å; G660-T664 PolarHBondContact O-N 3.35Å; G660-T664 PolarHBondContact O-OG1 3.31Å; V661-T664 WeakPolarHBondContact CA-OG1 3.41Å; V661-T664 PolarHBondContact O-OG1 2.99Å; V661-T664 VanDerWaalsContact O-OG1 3.05Å; H662-T664 VanDerWaalsContact C-N 3.27Å; H662-T664 PolarHBondContact O-N 2.77Å
665	M	35.8	Very low	46.2	Very low	172 Å²	172	117.4 Å²	117.4	85%	0.847	65%	0.647	S	S	*	*	H	α-helix	trans	-78.1	-31.2	162.5	-70.9	-118.6	-156.6	0	0	111.8	H662	H662-M665 WeakPolarHBondContact O-CA 3.24Å; H662-M665 WeakPolarHBondContact O-CB 3.18Å; H662-M665 PolarHBondContact O-N 3.34Å
666	E	34.8	Very low	44.2	Very low	157 Å²	157	121.5 Å²	121.5	73%	0.734	66%	0.659	S	S	*	*	S	Bend	trans	-104.2	64.1	170.2	-77.3	-171.9	146.3	0	0	111.8	H662 G663 N668	H662-E666 PolarHBondContact O-N 3.41Å; G663-E666 CarbonylContact O-C 3.56Å; E666-N668 PolarHBondContact O-N 2.72Å
667	K	29.9	Very low	42	Very low	169 Å²	169	124 Å²	124	74%	0.735	67%	0.671	S	S	*	*			trans	-66.2	82.6	162	-82.9	-173.6	178	178.6	0	109.4	G663	G663-K667 PolarHBondContact O-N 3Å
668	N	28.8	Very low	40	Very low	151 Å²	151	125.6 Å²	125.6	81%	0.807	68%	0.683	S	S	*	*	S	Bend	trans	179.7	79.2	149.1	-91.2	-17.3	0	0	0	109.7	E666	E666-N668 PolarHBondContact O-N 2.72Å
669	K	32.2	Very low	38.2	Very low	195 Å²	195	129.1 Å²	129.1	85%	0.848	69%	0.693	S	S	*	*			trans	172	123.3	135.9	-91.2	156.5	-172.3	-177.1	0	109.8	F671	K669-F671 PolarHBondContact O-N 3.05Å
670	T	28.4	Very low	36.2	Very low	145 Å²	145	134.7 Å²	134.7	89%	0.89	72%	0.717	S	S	*	*			trans	-53.4	119.7	175.6	41.6	0	0	0	0	111.9
671	F	30.8	Very low	35	Very low	199 Å²	199	139.6 Å²	139.6	87%	0.873	73%	0.734	S	S	*	*			trans	-118.3	124.9	167	-111.8	-92.3	0	0	0	109.3	K669	K669-F671 PolarHBondContact O-N 3.05Å
672	S	30.5	Very low	33.7	Very low	112 Å²	112	141.7 Å²	141.7	78%	0.783	74%	0.741	S	S	*	*			trans	-71	145.2	173	45.5	0	0	0	0	111.1
673	S	31.3	Very low	32.8	Very low	83 Å²	83	141.6 Å²	141.6	58%	0.58	75%	0.745	S	S	*	*			trans	-81	155.6	-163.9	80.7	0	0	0	0	114.6	A675	S673-A675 PolarHBondContact O-N 3.06Å
674	P	34.2	Very low	32.2	Very low	75 Å²	75	147.8 Å²	147.8	49%	0.487	77%	0.767	S	S	.	*	G	3₁₀ helix	trans	-73	-5.8	-176.1	-14.8	30.6	0	0	0	115.2	E676 Q677	P674-E676 PolarHBondContact O-N 3.46Å; P674-Q677 PolarHBondContact O-N 3.41Å
675	A	32	Very low	31.6	Very low	74 Å²	74	151.3 Å²	151.3	61%	0.612	78%	0.779	S	S	*	*	G	3₁₀ helix	trans	-68.8	-19.3	-173.8	0	0	0	0	0	113.9	S673	S673-A675 PolarHBondContact O-N 3.06Å
676	E	29.9	Very low	31.3	Very low	160 Å²	160	149.9 Å²	149.9	75%	0.748	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-83.2	-21.8	178.5	-84.6	-176.6	149.8	0	0	114.2	P674 L678	P674-E676 PolarHBondContact O-N 3.46Å; E676-L678 PolarHBondContact O-N 3.15Å
677	Q	30.8	Very low	31.1	Very low	151 Å²	151	149.4 Å²	149.4	71%	0.706	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.4	-9.8	-175.4	-76.4	-174.7	-15.6	0	0	114.7	P674	P674-Q677 PolarHBondContact O-N 3.41Å
678	L	33.1	Very low	31.2	Very low	163 Å²	163	147.8 Å²	147.8	85%	0.853	78%	0.781	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98	6	-178.1	-106.2	148.1	0	0	0	114.2	E676	E676-L678 PolarHBondContact O-N 3.15Å
679	K	31.2	Very low	31.4	Very low	201 Å²	201	147.6 Å²	147.6	87%	0.874	78%	0.779	S	S	*	*			trans	-102.1	-3.3	174.4	-95.6	-174.3	177.3	-179.3	0	114.5
680	I	31.9	Very low	31.3	Very low	213 Å²	213	143.3 Å²	143.3	100%	1.092	77%	0.772	S	S	*	*			trans	-107.4	0	171.1	-55.9	172.7	0	0	0	106.6

Retrieved 680 of 680 residues in 2433.2 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).