A0A077Z0C2_TRITR Loading...

Phosphodiesterase

AlphaFold DB , UniProt , Accession A0A077Z0C2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 497 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.6	Very low	57	Low	209 Å²	209	85.6 Å²	85.6	100%	1.03	52%	0.515	S	S	*	.				0	-87.2	0	-67	-167.9	176.1	0	0	111	V3 S4	M1-V3 PolarHBondContact O-N 3.34Å; M1-S4 WeakPolarHBondContact CA-OG 3.4Å; M1-S4 PolarHBondContact N-OG 3.39Å; M1-S4 PolarHBondContact O-OG 3.4Å
2	A	51.3	Low	57.6	Low	74 Å²	74	90.6 Å²	90.6	61%	0.612	53%	0.525	S	S	*	.			trans	-71.9	-26.8	-174.9	0	0	0	0	0	116.1	S5	A2-S5 PolarHBondContact O-OG 2.77Å
3	V	50.7	Low	58.1	Low	41 Å²	41	89.9 Å²	89.9	25%	0.248	51%	0.51	C	S	.	.	S	Bend	trans	-81	-36.6	178.9	-174.7	0	0	0	0	111.7	M1 S5 M6 Q11 F14	M1-V3 PolarHBondContact O-N 3.34Å; V3-S5 PolarHBondContact O-N 2.77Å; V3-M6 HydrophobicContact CG1-SD 4.47Å; V3-M6 WeakPolarHBondContact O-CB 3.09Å; V3-M6 PolarHBondContact O-N 2.89Å; V3-Q11 HydrophobicContact CG1-CG 4.13Å; V3-Q11 WeakPolarHBondContact O-CG 3.26Å; V3-F14 HydrophobicContact CB-CD1 4.49Å; V3-F14 HydrophobicContact CG1-CD1 3.98Å; V3-F14 HydrophobicContact CG2-CD1 3.62Å; V3-F14 HydrophobicContact CG2-CE1 3.35Å; V3-F14 HydrophobicContact CG2-CG 4.37Å; V3-F14 HydrophobicContact CG2-CZ 3.89Å
4	S	57.8	Low	58.6	Low	84 Å²	84	88.9 Å²	88.9	59%	0.587	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	0.8	-178.7	44.7	0	0	0	0	114.7	M1	M1-S4 WeakPolarHBondContact CA-OG 3.4Å; M1-S4 PolarHBondContact N-OG 3.39Å; M1-S4 PolarHBondContact O-OG 3.4Å
5	S	58.6	Low	59.2	Low	100 Å²	100	89.9 Å²	89.9	70%	0.699	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.6	11.8	173.4	58.7	0	0	0	0	112.9	A2 V3	A2-S5 PolarHBondContact O-OG 2.77Å; V3-S5 PolarHBondContact O-N 2.77Å
6	M	62.4	Low	59.7	Low	71 Å²	71	86.3 Å²	86.3	35%	0.35	48%	0.481	S	S	.	.	S	Bend	trans	-95.4	154.9	172.5	-61	175.9	175.8	0	0	110	V3 Q11 F14	V3-M6 HydrophobicContact CG1-SD 4.47Å; V3-M6 WeakPolarHBondContact O-CB 3.09Å; V3-M6 PolarHBondContact O-N 2.89Å; M6-Q11 HydrophobicContact CB-CG 3.81Å; M6-Q11 PolarHBondContact O-NE2 3.45Å; M6-F14 HydrophobicContact CE-CD2 4.36Å; M6-F14 HydrophobicContact SD-CB 4.26Å; M6-F14 HydrophobicContact SD-CG 4.47Å
7	D	69.3	Low	60.5	Low	79 Å²	79	84.7 Å²	84.7	42%	0.422	47%	0.471	S	S	.	.			trans	-64.2	157.4	169.9	69.8	84.6	0	0	0	111.4	T9 S10 Q11	D7-T9 PolarHBondContact O-N 3.4Å; D7-T9 VanDerWaalsContact O-N 3.17Å; D7-T9 WeakPolarHBondContact OD1-CA 3.39Å; D7-T9 VanDerWaalsContact OD1-CB 3.27Å; D7-T9 WeakPolarHBondContact OD1-CB 3.4Å; D7-T9 PolarHBondContact OD1-N 2.97Å; D7-S10 CarbonylContact O-C 3.5Å; D7-S10 PolarHBondContact O-N 3.45Å; D7-S10 VanDerWaalsContact O-N 3.07Å; D7-S10 PolarHBondContact OD1-N 2.68Å; D7-S10 PolarHBondContact OD1-OG 2.88Å; D7-S10 WeakPolarHBondContact OD2-CB 3.45Å; D7-S10 PolarHBondContact OD2-OG 2.86Å; D7-Q11 WeakPolarHBondContact O-CG 3.04Å; D7-Q11 PolarHBondContact O-N 3.04Å
8	P	59.4	Low	61.2	Low	107 Å²	107	88.9 Å²	88.9	70%	0.695	48%	0.478	S	S	*	.	H	α-helix	trans	-55.6	-35.4	-176	-27.9	36.1	0	0	0	114.4	Q11 F12	P8-Q11 PolarHBondContact O-N 3.38Å; P8-F12 WeakPolarHBondContact O-CB 3.47Å; P8-F12 PolarHBondContact O-N 3.39Å
9	T	55.5	Low	61.5	Low	72 Å²	72	88.8 Å²	88.8	44%	0.442	47%	0.473	S	S	.	.	H	α-helix	trans	-71	-40.1	178.6	-47.6	0	0	0	0	111.4	D7 Y13 R62	D7-T9 PolarHBondContact O-N 3.4Å; D7-T9 VanDerWaalsContact O-N 3.17Å; D7-T9 WeakPolarHBondContact OD1-CA 3.39Å; D7-T9 VanDerWaalsContact OD1-CB 3.27Å; D7-T9 WeakPolarHBondContact OD1-CB 3.4Å; D7-T9 PolarHBondContact OD1-N 2.97Å; T9-Y13 WeakPolarHBondContact O-CB 3.46Å; T9-Y13 PolarHBondContact O-N 2.88Å; T9-R62 VanDerWaalsContact CG2-NH2 3.28Å
10	S	63.6	Low	62.1	Low	40 Å²	40	86.3 Å²	86.3	28%	0.28	46%	0.458	S	S	.	.	H	α-helix	trans	-69.4	-33.3	172.7	-66.7	0	0	0	0	112.6	D7 Y13 F14	D7-S10 CarbonylContact O-C 3.5Å; D7-S10 PolarHBondContact O-N 3.45Å; D7-S10 VanDerWaalsContact O-N 3.07Å; D7-S10 PolarHBondContact OD1-N 2.68Å; D7-S10 PolarHBondContact OD1-OG 2.88Å; D7-S10 WeakPolarHBondContact OD2-CB 3.45Å; D7-S10 PolarHBondContact OD2-OG 2.86Å; S10-Y13 PolarHBondContact O-N 3.1Å; S10-F14 VanDerWaalsContact O-CB 3.3Å; S10-F14 WeakPolarHBondContact O-CB 3.24Å; S10-F14 PolarHBondContact O-N 3.47Å
11	Q	57.4	Low	62.7	Low	65 Å²	65	84.3 Å²	84.3	30%	0.304	46%	0.455	S	S	.	.	H	α-helix	trans	-63.1	-50.3	171	-69.7	-171.7	43.1	0	0	110.9	V3 M6 D7 P8 Y13 F14 L15	V3-Q11 HydrophobicContact CG1-CG 4.13Å; V3-Q11 WeakPolarHBondContact O-CG 3.26Å; M6-Q11 HydrophobicContact CB-CG 3.81Å; M6-Q11 PolarHBondContact O-NE2 3.45Å; D7-Q11 WeakPolarHBondContact O-CG 3.04Å; D7-Q11 PolarHBondContact O-N 3.04Å; P8-Q11 PolarHBondContact O-N 3.38Å; Q11-Y13 VanDerWaalsContact C-N 3.32Å; Q11-Y13 PolarHBondContact O-N 2.88Å; Q11-F14 PolarHBondContact O-N 2.8Å; Q11-L15 WeakPolarHBondContact O-CB 3.33Å; Q11-L15 VanDerWaalsContact O-CG 3.28Å; Q11-L15 WeakPolarHBondContact O-CG 3.41Å; Q11-L15 PolarHBondContact O-N 2.97Å
12	F	64.4	Low	64.2	Low	145 Å²	145	77.9 Å²	77.9	64%	0.636	43%	0.429	S	S	*	.	H	α-helix	trans	-56.5	-44.9	175.4	177.1	-93.1	0	0	0	112	P8 L15 T16	P8-F12 WeakPolarHBondContact O-CB 3.47Å; P8-F12 PolarHBondContact O-N 3.39Å; F12-L15 PolarHBondContact O-N 3.16Å; F12-T16 VanDerWaalsContact O-CB 3.29Å; F12-T16 WeakPolarHBondContact O-CB 3.47Å; F12-T16 PolarHBondContact O-N 2.6Å; F12-T16 PolarHBondContact O-OG1 3.22Å
13	Y	63.7	Low	65.3	Low	82 Å²	82	77.2 Å²	77.2	32%	0.322	41%	0.411	S	S	.	.	H	α-helix	trans	-62.3	-44.8	176.3	-176.9	-96.5	0	0	0	112.4	T9 S10 Q11 T16 L17 N55	T9-Y13 WeakPolarHBondContact O-CB 3.46Å; T9-Y13 PolarHBondContact O-N 2.88Å; S10-Y13 PolarHBondContact O-N 3.1Å; Q11-Y13 VanDerWaalsContact C-N 3.32Å; Q11-Y13 PolarHBondContact O-N 2.88Å; Y13-T16 PolarHBondContact O-N 2.79Å; Y13-L17 HydrophobicContact CD1-CD1 3.96Å; Y13-L17 HydrophobicContact CD1-CG 4.42Å; Y13-L17 HydrophobicContact CE1-CD1 3.34Å; Y13-L17 HydrophobicContact CE1-CG 4.06Å; Y13-L17 PolarHBondContact O-N 3.45Å; Y13-N55 HydrophobicContact CE2-CB 3.83Å; Y13-N55 WeakPolarHBondContact CE2-OD1 3.23Å
14	F	66.2	Low	66.7	Low	76 Å²	76	78.1 Å²	78.1	33%	0.333	41%	0.414	S	S	.	.	H	α-helix	trans	-63.9	-43.3	177	-178.3	-88.1	0	0	0	112.2	V3 M6 S10 Q11 R18	V3-F14 HydrophobicContact CB-CD1 4.49Å; V3-F14 HydrophobicContact CG1-CD1 3.98Å; V3-F14 HydrophobicContact CG2-CD1 3.62Å; V3-F14 HydrophobicContact CG2-CE1 3.35Å; V3-F14 HydrophobicContact CG2-CG 4.37Å; V3-F14 HydrophobicContact CG2-CZ 3.89Å; M6-F14 HydrophobicContact CE-CD2 4.36Å; M6-F14 HydrophobicContact SD-CB 4.26Å; M6-F14 HydrophobicContact SD-CG 4.47Å; S10-F14 VanDerWaalsContact O-CB 3.3Å; S10-F14 WeakPolarHBondContact O-CB 3.24Å; S10-F14 PolarHBondContact O-N 3.47Å; Q11-F14 PolarHBondContact O-N 2.8Å; F14-R18 VanDerWaalsContact O-CB 3.25Å; F14-R18 WeakPolarHBondContact O-CB 3.25Å; F14-R18 PolarHBondContact O-N 2.93Å
15	L	67	Low	67.7	Low	103 Å²	103	83 Å²	83	54%	0.539	42%	0.419	S	S	.	.	H	α-helix	trans	-62.7	-43	175.7	-70.8	169.2	0	0	0	111.3	Q11 F12 R18 K19	Q11-L15 WeakPolarHBondContact O-CB 3.33Å; Q11-L15 VanDerWaalsContact O-CG 3.28Å; Q11-L15 WeakPolarHBondContact O-CG 3.41Å; Q11-L15 PolarHBondContact O-N 2.97Å; F12-L15 PolarHBondContact O-N 3.16Å; L15-R18 PolarHBondContact O-N 3.01Å; L15-K19 WeakPolarHBondContact O-CB 3.29Å; L15-K19 PolarHBondContact O-N 2.63Å
16	T	67.7	Low	68.5	Low	32 Å²	32	84.9 Å²	84.9	20%	0.196	41%	0.412	C	S	.	.	H	α-helix	trans	-60.5	-53.8	175.8	-63	0	0	0	0	111.2	F12 Y13 R18 K19 H20	F12-T16 VanDerWaalsContact O-CB 3.29Å; F12-T16 WeakPolarHBondContact O-CB 3.47Å; F12-T16 PolarHBondContact O-N 2.6Å; F12-T16 PolarHBondContact O-OG1 3.22Å; Y13-T16 PolarHBondContact O-N 2.79Å; T16-R18 VanDerWaalsContact C-N 3.3Å; T16-R18 PolarHBondContact O-N 3.46Å; T16-K19 PolarHBondContact O-N 3.49Å; T16-H20 PolarHBondContact O-CD2 2.97Å; T16-H20 PolarHBondContact O-N 2.68Å
17	L	72.5	Confident	69.2	Low	60 Å²	60	82 Å²	82	31%	0.314	40%	0.398	S	S	.	.	H	α-helix	trans	-57.6	-41.1	175.4	-75.8	-175.6	0	0	0	112.4	Y13 H20 A21	Y13-L17 HydrophobicContact CD1-CD1 3.96Å; Y13-L17 HydrophobicContact CD1-CG 4.42Å; Y13-L17 HydrophobicContact CE1-CD1 3.34Å; Y13-L17 HydrophobicContact CE1-CG 4.06Å; Y13-L17 PolarHBondContact O-N 3.45Å; L17-H20 PolarHBondContact O-N 3.31Å; L17-A21 WeakPolarHBondContact O-CB 3.38Å; L17-A21 PolarHBondContact O-N 3.43Å
18	R	72.6	Confident	69.5	Low	160 Å²	160	82.5 Å²	82.5	60%	0.604	40%	0.4	S	S	*	.	H	α-helix	trans	-63.1	-44.7	177.1	-177.5	177.3	174.3	126.8	-2.5	111.7	F14 L15 T16 H20 A21 C22	F14-R18 VanDerWaalsContact O-CB 3.25Å; F14-R18 WeakPolarHBondContact O-CB 3.25Å; F14-R18 PolarHBondContact O-N 2.93Å; L15-R18 PolarHBondContact O-N 3.01Å; T16-R18 VanDerWaalsContact C-N 3.3Å; T16-R18 PolarHBondContact O-N 3.46Å; R18-H20 VanDerWaalsContact C-N 3.35Å; R18-H20 PolarHBondContact O-N 2.87Å; R18-A21 PolarHBondContact O-N 3.19Å; R18-C22 WeakPolarHBondContact O-CB 3.41Å; R18-C22 PolarHBondContact O-N 3.43Å; R18-C22 PolarHBondContact O-SG 3.24Å
19	K	67.7	Low	70.2	Confident	88 Å²	88	83.2 Å²	83.2	38%	0.383	39%	0.39	S	S	.	.	H	α-helix	trans	-60.8	-42.1	176.4	-178.6	157.6	168.6	157.6	0	111.3	L15 T16 C22 R23 D430	L15-K19 WeakPolarHBondContact O-CB 3.29Å; L15-K19 PolarHBondContact O-N 2.63Å; T16-K19 PolarHBondContact O-N 3.49Å; K19-C22 PolarHBondContact O-N 3.44Å; K19-R23 PolarHBondContact O-N 2.99Å; K19-D430 WeakPolarHBondContact CE-OD1 3.29Å; K19-D430 IonicContact NZ-OD1 2.96Å; K19-D430 PolarHBondContact NZ-OD1 2.75Å
20	H	74.1	Confident	71.3	Confident	37 Å²	37	80.9 Å²	80.9	17%	0.171	37%	0.374	C	S	.	.	H	α-helix	trans	-70.3	-38.3	175.5	-65.1	-55.4	0	0	0	113.6	T16 L17 R18 C22 R23 L24 I51	T16-H20 PolarHBondContact O-CD2 2.97Å; T16-H20 PolarHBondContact O-N 2.68Å; L17-H20 PolarHBondContact O-N 3.31Å; R18-H20 VanDerWaalsContact C-N 3.35Å; R18-H20 PolarHBondContact O-N 2.87Å; H20-C22 VanDerWaalsContact C-N 3.34Å; H20-C22 PolarHBondContact O-N 2.83Å; H20-R23 PolarHBondContact O-N 2.65Å; H20-L24 WeakPolarHBondContact O-CG 3.4Å; H20-L24 PolarHBondContact O-N 3.41Å; H20-I51 WeakPolarHBondContact CE1-CD1 3.13Å; H20-I51 WeakPolarHBondContact NE2-CD1 3.46Å
21	A	74.2	Confident	71.8	Confident	46 Å²	46	83.4 Å²	83.4	38%	0.38	38%	0.382	S	S	.	.	H	α-helix	trans	-63.4	-38.4	173.5	0	0	0	0	0	112.3	L17 R18 R25	L17-A21 WeakPolarHBondContact O-CB 3.38Å; L17-A21 PolarHBondContact O-N 3.43Å; R18-A21 PolarHBondContact O-N 3.19Å; A21-R25 WeakPolarHBondContact O-CG 3.22Å; A21-R25 PolarHBondContact O-N 3.28Å; A21-R25 VanDerWaalsContact O-N 3.1Å
22	C	73.1	Confident	72.7	Confident	73 Å²	73	88.1 Å²	88.1	49%	0.493	40%	0.404	S	S	.	.	H	α-helix	trans	-63.6	-44.7	171.8	-75.3	0	0	0	0	111.8	R18 K19 H20 L24 R25 Y26	R18-C22 WeakPolarHBondContact O-CB 3.41Å; R18-C22 PolarHBondContact O-N 3.43Å; R18-C22 PolarHBondContact O-SG 3.24Å; K19-C22 PolarHBondContact O-N 3.44Å; H20-C22 VanDerWaalsContact C-N 3.34Å; H20-C22 PolarHBondContact O-N 2.83Å; C22-L24 PolarHBondContact O-N 3.01Å; C22-R25 PolarHBondContact O-N 3.42Å; C22-Y26 PolarHBondContact O-N 3.19Å
23	R	73.3	Confident	73.5	Confident	60 Å²	60	87.5 Å²	87.5	23%	0.226	40%	0.397	C	S	.	.	H	α-helix	trans	-62.2	-41.6	175.8	-179.4	170.8	163.4	-155	-7.2	112.6	K19 H20 R25 Y26 I27 N44	K19-R23 PolarHBondContact O-N 2.99Å; H20-R23 PolarHBondContact O-N 2.65Å; R23-R25 VanDerWaalsContact C-N 3.34Å; R23-R25 PolarHBondContact O-N 2.96Å; R23-Y26 PolarHBondContact O-N 2.79Å; R23-Y26 VanDerWaalsContact O-N 3.16Å; R23-I27 HydrophobicContact CG-CD1 3.96Å; R23-I27 WeakPolarHBondContact O-CD1 3.32Å; R23-I27 WeakPolarHBondContact O-CG1 3.49Å; R23-I27 PolarHBondContact O-N 2.84Å; R23-N44 VanDerWaalsContact CZ-OD1 3.32Å; R23-N44 PolarHBondContact NE-OD1 2.85Å; R23-N44 VanDerWaalsContact NE-OD1 3.13Å; R23-N44 PolarHBondContact NH2-OD1 2.7Å
24	L	79.8	Confident	74.2	Confident	60 Å²	60	86.9 Å²	86.9	31%	0.314	42%	0.415	S	S	.	.	H	α-helix	trans	-61.3	-40.3	174.4	-74.1	171.4	0	0	0	112.1	H20 C22 Y26 I27 I28 A48	H20-L24 WeakPolarHBondContact O-CG 3.4Å; H20-L24 PolarHBondContact O-N 3.41Å; C22-L24 PolarHBondContact O-N 3.01Å; L24-Y26 VanDerWaalsContact C-N 3.34Å; L24-Y26 PolarHBondContact O-N 2.82Å; L24-I27 HydrophobicContact CD2-CD1 4.29Å; L24-I27 PolarHBondContact O-N 2.99Å; L24-I28 VanDerWaalsContact O-CG1 3.31Å; L24-I28 WeakPolarHBondContact O-CG1 3.23Å; L24-I28 PolarHBondContact O-N 3.46Å; L24-A48 HydrophobicContact CD2-CB 4.04Å
25	R	79.3	Confident	74.9	Confident	187 Å²	187	88 Å²	88	71%	0.706	42%	0.422	S	S	*	.	H	α-helix	trans	-64.1	-36.8	173.1	-70.6	174.3	-174.2	-80.4	-0.5	112.6	A21 C22 R23 I28 Y29	A21-R25 WeakPolarHBondContact O-CG 3.22Å; A21-R25 PolarHBondContact O-N 3.28Å; A21-R25 VanDerWaalsContact O-N 3.1Å; C22-R25 PolarHBondContact O-N 3.42Å; R23-R25 VanDerWaalsContact C-N 3.34Å; R23-R25 PolarHBondContact O-N 2.96Å; R25-I28 PolarHBondContact O-N 3.34Å; R25-Y29 WeakPolarHBondContact O-CB 3.06Å; R25-Y29 PolarHBondContact O-N 2.94Å
26	Y	75.2	Confident	75.5	Confident	139 Å²	139	85 Å²	85	55%	0.545	41%	0.406	S	S	.	.	H	α-helix	trans	-68.5	-38.6	174.8	-177.8	-106.5	0	0	0	112.6	C22 R23 L24 Y29 Q30	C22-Y26 PolarHBondContact O-N 3.19Å; R23-Y26 PolarHBondContact O-N 2.79Å; R23-Y26 VanDerWaalsContact O-N 3.16Å; L24-Y26 VanDerWaalsContact C-N 3.34Å; L24-Y26 PolarHBondContact O-N 2.82Å; Y26-Y29 HydrophobicContact CD2-CD1 4.43Å; Y26-Y29 HydrophobicContact CE2-CD1 4.37Å; Y26-Y29 WeakPolarHBondContact O-CB 3.47Å; Y26-Y29 PolarHBondContact O-N 3.26Å; Y26-Q30 HydrophobicContact CD1-CG 4.46Å; Y26-Q30 HydrophobicContact CE1-CG 3.97Å; Y26-Q30 HydrophobicContact CE2-CG 4.26Å; Y26-Q30 PolarHBondContact O-N 3.1Å
27	I	77.7	Confident	76.2	Confident	10 Å²	10	86 Å²	86	5%	0.051	41%	0.414	C	S	.	.	H	α-helix	trans	-62	-45.8	172.9	-65.9	152.9	0	0	0	110.4	R23 L24 Y29 Q30 M31 L36 L41 N44	R23-I27 HydrophobicContact CG-CD1 3.96Å; R23-I27 WeakPolarHBondContact O-CD1 3.32Å; R23-I27 WeakPolarHBondContact O-CG1 3.49Å; R23-I27 PolarHBondContact O-N 2.84Å; L24-I27 HydrophobicContact CD2-CD1 4.29Å; L24-I27 PolarHBondContact O-N 2.99Å; I27-Y29 VanDerWaalsContact C-N 3.29Å; I27-Y29 PolarHBondContact O-N 3.43Å; I27-Q30 PolarHBondContact O-N 3.21Å; I27-M31 HydrophobicContact CG2-CG 4.47Å; I27-M31 HydrophobicContact CG2-SD 4.28Å; I27-M31 WeakPolarHBondContact O-CG 3.17Å; I27-M31 PolarHBondContact O-N 3.15Å; I27-L36 HydrophobicContact CG2-CD2 4.2Å; I27-L41 HydrophobicContact CG2-CD1 3.82Å; I27-N44 HydrophobicContact CD1-CB 3.62Å; I27-N44 HydrophobicContact CG1-CB 4.34Å
28	I	75.8	Confident	76.4	Confident	90 Å²	90	87.4 Å²	87.4	46%	0.462	43%	0.43	S	S	.	.	H	α-helix	trans	-59.2	-40.4	174.9	-69.6	163.2	0	0	0	111.3	L24 R25 M31 H32	L24-I28 VanDerWaalsContact O-CG1 3.31Å; L24-I28 WeakPolarHBondContact O-CG1 3.23Å; L24-I28 PolarHBondContact O-N 3.46Å; R25-I28 PolarHBondContact O-N 3.34Å; I28-M31 PolarHBondContact O-N 2.98Å; I28-H32 PolarHBondContact O-CD2 3.1Å; I28-H32 PolarHBondContact O-N 2.92Å
29	Y	74.4	Confident	76.6	Confident	123 Å²	123	86.5 Å²	86.5	48%	0.482	43%	0.43	S	S	.	.	H	α-helix	trans	-61.8	-45.7	174.7	175.9	-94.2	0	0	0	112.4	R25 Y26 I27 H32 R33	R25-Y29 WeakPolarHBondContact O-CB 3.06Å; R25-Y29 PolarHBondContact O-N 2.94Å; Y26-Y29 HydrophobicContact CD2-CD1 4.43Å; Y26-Y29 HydrophobicContact CE2-CD1 4.37Å; Y26-Y29 WeakPolarHBondContact O-CB 3.47Å; Y26-Y29 PolarHBondContact O-N 3.26Å; I27-Y29 VanDerWaalsContact C-N 3.29Å; I27-Y29 PolarHBondContact O-N 3.43Å; Y29-H32 PolarHBondContact O-N 3.39Å; Y29-R33 VanDerWaalsContact CE1-CD 3.43Å; Y29-R33 PolarHBondContact O-N 2.98Å; Y29-R33 PolarHBondContact OH-NH1 2.83Å
30	Q	77.2	Confident	77	Confident	22 Å²	22	86.7 Å²	86.7	10%	0.103	43%	0.432	C	S	.	.	H	α-helix	trans	-68.5	-32.8	176.4	-66.6	-58.7	90.5	0	0	112.7	Y26 I27 R33 G34 E35 L36	Y26-Q30 HydrophobicContact CD1-CG 4.46Å; Y26-Q30 HydrophobicContact CE1-CG 3.97Å; Y26-Q30 HydrophobicContact CE2-CG 4.26Å; Y26-Q30 PolarHBondContact O-N 3.1Å; I27-Q30 PolarHBondContact O-N 3.21Å; Q30-R33 PolarHBondContact O-N 2.84Å; Q30-G34 PolarHBondContact O-N 3.02Å; Q30-G34 VanDerWaalsContact O-N 3.12Å; Q30-E35 PolarHBondContact NE2-OE2 3.48Å; Q30-E35 PolarHBondContact O-N 3.18Å; Q30-L36 HydrophobicContact CB-CB 4.09Å; Q30-L36 HydrophobicContact CB-CD1 3.82Å; Q30-L36 HydrophobicContact CG-CD1 4.45Å
31	M	75.4	Confident	77.2	Confident	93 Å²	93	86.8 Å²	86.8	46%	0.458	43%	0.434	S	S	.	.	H	α-helix	trans	-62.3	-44.6	170.9	-73.1	176.8	69.3	0	0	111.9	I27 I28 R33 G34 L41	I27-M31 HydrophobicContact CG2-CG 4.47Å; I27-M31 HydrophobicContact CG2-SD 4.28Å; I27-M31 WeakPolarHBondContact O-CG 3.17Å; I27-M31 PolarHBondContact O-N 3.15Å; I28-M31 PolarHBondContact O-N 2.98Å; M31-R33 PolarHBondContact O-N 3.06Å; M31-G34 PolarHBondContact O-N 3.21Å; M31-L41 HydrophobicContact CE-CD1 4.32Å; M31-L41 HydrophobicContact CE-CD2 3.65Å; M31-L41 HydrophobicContact CG-CD1 4.36Å; M31-L41 HydrophobicContact SD-CD1 3.49Å; M31-L41 WeakPolarHBondContact SD-CD1 3.45Å; M31-L41 HydrophobicContact SD-CD2 3.92Å; M31-L41 HydrophobicContact SD-CG 4.35Å
32	H	75.5	Confident	77.2	Confident	164 Å²	164	88.4 Å²	88.4	76%	0.759	44%	0.435	S	S	*	.	H	α-helix	trans	-62.9	-22.9	175.6	-80.8	-63.1	0	0	0	113.6	I28 Y29	I28-H32 PolarHBondContact O-CD2 3.1Å; I28-H32 PolarHBondContact O-N 2.92Å; Y29-H32 PolarHBondContact O-N 3.39Å
33	R	81.5	Confident	77.4	Confident	133 Å²	133	88.5 Å²	88.5	50%	0.502	43%	0.431	S	S	.	.	H	α-helix	trans	-89.9	-10.2	174.5	-67.6	176.2	61.1	147.9	-5.4	113.9	Y29 Q30 M31 E35	Y29-R33 VanDerWaalsContact CE1-CD 3.43Å; Y29-R33 PolarHBondContact O-N 2.98Å; Y29-R33 PolarHBondContact OH-NH1 2.83Å; Q30-R33 PolarHBondContact O-N 2.84Å; M31-R33 PolarHBondContact O-N 3.06Å; R33-E35 HydrophobicContact CB-CB 4.35Å; R33-E35 HydrophobicContact CB-CG 3.97Å; R33-E35 IonicContact CZ-OE1 3.85Å; R33-E35 IonicContact CZ-OE2 2.7Å; R33-E35 VanDerWaalsContact NE-CD 3.3Å; R33-E35 IonicContact NE-OE1 3.69Å; R33-E35 PolarHBondContact NE-OE1 3.2Å; R33-E35 IonicContact NE-OE2 2.7Å; R33-E35 PolarHBondContact NE-OE2 2.86Å; R33-E35 IonicContact NH2-OE1 2.66Å; R33-E35 PolarHBondContact NH2-OE1 3.03Å; R33-E35 IonicContact NH2-OE2 2.79Å; R33-E35 PolarHBondContact O-N 2.98Å
34	G	78.6	Confident	77.6	Confident	68 Å²	68	87.1 Å²	87.1	70%	0.701	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.9	16.1	-173	0	0	0	0	0	114.2	Q30 M31	Q30-G34 PolarHBondContact O-N 3.02Å; Q30-G34 VanDerWaalsContact O-N 3.12Å; M31-G34 PolarHBondContact O-N 3.21Å
35	E	80.8	Confident	77.6	Confident	99 Å²	99	88.7 Å²	88.7	46%	0.463	44%	0.436	S	S	.	.			trans	-89.8	-4.2	-172.9	-76.4	175.4	-159.8	0	0	114.1	Q30 R33	Q30-E35 PolarHBondContact NE2-OE2 3.48Å; Q30-E35 PolarHBondContact O-N 3.18Å; R33-E35 HydrophobicContact CB-CB 4.35Å; R33-E35 HydrophobicContact CB-CG 3.97Å; R33-E35 IonicContact CZ-OE1 3.85Å; R33-E35 IonicContact CZ-OE2 2.7Å; R33-E35 VanDerWaalsContact NE-CD 3.3Å; R33-E35 IonicContact NE-OE1 3.69Å; R33-E35 PolarHBondContact NE-OE1 3.2Å; R33-E35 IonicContact NE-OE2 2.7Å; R33-E35 PolarHBondContact NE-OE2 2.86Å; R33-E35 IonicContact NH2-OE1 2.66Å; R33-E35 PolarHBondContact NH2-OE1 3.03Å; R33-E35 IonicContact NH2-OE2 2.79Å; R33-E35 PolarHBondContact O-N 2.98Å
36	L	79	Confident	77.5	Confident	40 Å²	40	85.8 Å²	85.8	21%	0.209	43%	0.431	C	S	.	.	S	Bend	trans	-112.2	126.9	-175.2	-154.6	118.3	0	0	0	110.3	I27 Q30 E40 L41	I27-L36 HydrophobicContact CG2-CD2 4.2Å; Q30-L36 HydrophobicContact CB-CB 4.09Å; Q30-L36 HydrophobicContact CB-CD1 3.82Å; Q30-L36 HydrophobicContact CG-CD1 4.45Å; L36-E40 HydrophobicContact CD2-CB 3.97Å; L36-E40 HydrophobicContact CG-CB 3.98Å; L36-L41 HydrophobicContact CD2-CB 3.74Å; L36-L41 HydrophobicContact CD2-CD1 4.37Å
37	S	81.7	Confident	77.4	Confident	53 Å²	53	82.7 Å²	82.7	37%	0.371	42%	0.418	S	S	.	.			trans	-70.9	154.3	178.3	71.3	0	0	0	0	111.9	K39 E40 L41	S37-K39 PolarHBondContact O-N 3.44Å; S37-K39 VanDerWaalsContact O-N 3.15Å; S37-E40 WeakPolarHBondContact CB-OE2 3.43Å; S37-E40 PolarHBondContact N-OE2 3.02Å; S37-E40 PolarHBondContact O-N 2.95Å; S37-E40 VanDerWaalsContact O-N 3.11Å; S37-E40 WeakPolarHBondContact OG-CG 3.29Å; S37-E40 PolarHBondContact OG-N 3.47Å; S37-E40 PolarHBondContact OG-OE2 2.86Å; S37-L41 PolarHBondContact O-N 3.49Å
38	S	77	Confident	77.2	Confident	91 Å²	91	83 Å²	83	64%	0.636	42%	0.423	S	S	*	.	H	α-helix	trans	-58	-29.3	175.7	-177.2	0	0	0	0	112.6	I42	S38-I42 WeakPolarHBondContact O-CD1 3.23Å; S38-I42 WeakPolarHBondContact O-CG1 3.41Å; S38-I42 PolarHBondContact O-N 3.08Å
39	K	76.7	Confident	77	Confident	140 Å²	140	80.7 Å²	80.7	61%	0.609	42%	0.417	S	S	*	.	H	α-helix	trans	-70.7	-49.5	174.5	-174.7	-174.9	174.1	-168.1	0	111.2	S37 L41 I42 D43	S37-K39 PolarHBondContact O-N 3.44Å; S37-K39 VanDerWaalsContact O-N 3.15Å; K39-L41 PolarHBondContact O-N 2.96Å; K39-I42 PolarHBondContact O-N 3.32Å; K39-D43 WeakPolarHBondContact CE-OD1 3.38Å; K39-D43 VanDerWaalsContact CE-OD2 3.28Å; K39-D43 WeakPolarHBondContact CE-OD2 3.46Å; K39-D43 IonicContact NZ-OD2 2.74Å; K39-D43 PolarHBondContact O-N 2.95Å
40	E	75.8	Confident	77	Confident	92 Å²	92	77.4 Å²	77.4	43%	0.43	41%	0.412	S	S	.	.	H	α-helix	trans	-59.5	-31.9	178	-71.4	160.9	119.2	0	0	111.7	L36 S37 N44	L36-E40 HydrophobicContact CD2-CB 3.97Å; L36-E40 HydrophobicContact CG-CB 3.98Å; S37-E40 WeakPolarHBondContact CB-OE2 3.43Å; S37-E40 PolarHBondContact N-OE2 3.02Å; S37-E40 PolarHBondContact O-N 2.95Å; S37-E40 VanDerWaalsContact O-N 3.11Å; S37-E40 WeakPolarHBondContact OG-CG 3.29Å; S37-E40 PolarHBondContact OG-N 3.47Å; S37-E40 PolarHBondContact OG-OE2 2.86Å; E40-N44 VanDerWaalsContact O-CB 3.29Å; E40-N44 WeakPolarHBondContact O-CB 3.46Å; E40-N44 PolarHBondContact O-N 2.86Å; E40-N44 PolarHBondContact O-ND2 3.3Å
41	L	78.3	Confident	76.7	Confident	39 Å²	39	77.6 Å²	77.6	20%	0.204	41%	0.413	C	S	.	.	H	α-helix	trans	-63.3	-48.1	172.8	-177.4	56	0	0	0	111.6	I27 M31 L36 S37 K39 N44 L45	I27-L41 HydrophobicContact CG2-CD1 3.82Å; M31-L41 HydrophobicContact CE-CD1 4.32Å; M31-L41 HydrophobicContact CE-CD2 3.65Å; M31-L41 HydrophobicContact CG-CD1 4.36Å; M31-L41 HydrophobicContact SD-CD1 3.49Å; M31-L41 WeakPolarHBondContact SD-CD1 3.45Å; M31-L41 HydrophobicContact SD-CD2 3.92Å; M31-L41 HydrophobicContact SD-CG 4.35Å; L36-L41 HydrophobicContact CD2-CB 3.74Å; L36-L41 HydrophobicContact CD2-CD1 4.37Å; S37-L41 PolarHBondContact O-N 3.49Å; K39-L41 PolarHBondContact O-N 2.96Å; L41-N44 PolarHBondContact O-N 3.25Å; L41-L45 HydrophobicContact CD1-CD1 3.86Å; L41-L45 HydrophobicContact CD1-CG 4.06Å; L41-L45 HydrophobicContact CG-CD1 3.87Å; L41-L45 HydrophobicContact CG-CG 4.46Å; L41-L45 WeakPolarHBondContact O-CB 3.44Å; L41-L45 VanDerWaalsContact O-CG 3.26Å; L41-L45 WeakPolarHBondContact O-CG 3.39Å; L41-L45 PolarHBondContact O-N 3.3Å
42	I	75.3	Confident	76.6	Confident	81 Å²	81	78.2 Å²	78.2	42%	0.415	42%	0.418	S	S	.	.	H	α-helix	trans	-61.5	-53.5	176.7	-66.7	163.4	0	0	0	110.3	S38 K39 N44 L45 E46	S38-I42 WeakPolarHBondContact O-CD1 3.23Å; S38-I42 WeakPolarHBondContact O-CG1 3.41Å; S38-I42 PolarHBondContact O-N 3.08Å; K39-I42 PolarHBondContact O-N 3.32Å; I42-N44 PolarHBondContact O-N 3.46Å; I42-N44 VanDerWaalsContact O-N 3.13Å; I42-L45 PolarHBondContact O-N 3.01Å; I42-E46 HydrophobicContact CG2-CG 4.15Å; I42-E46 WeakPolarHBondContact CG2-OE1 3.34Å; I42-E46 PolarHBondContact O-N 2.65Å
43	D	76.8	Confident	76.5	Confident	75 Å²	75	76.2 Å²	76.2	40%	0.401	41%	0.409	S	S	.	.	H	α-helix	trans	-54.9	-35.1	179.3	-66.6	-3.2	0	0	0	111.7	K39 Y47	K39-D43 WeakPolarHBondContact CE-OD1 3.38Å; K39-D43 VanDerWaalsContact CE-OD2 3.28Å; K39-D43 WeakPolarHBondContact CE-OD2 3.46Å; K39-D43 IonicContact NZ-OD2 2.74Å; K39-D43 PolarHBondContact O-N 2.95Å; D43-Y47 VanDerWaalsContact O-CB 3.32Å; D43-Y47 WeakPolarHBondContact O-CB 3.4Å; D43-Y47 PolarHBondContact O-N 2.96Å
44	N	78.4	Confident	75.8	Confident	30 Å²	30	72.6 Å²	72.6	16%	0.16	40%	0.404	C	S	.	.	H	α-helix	trans	-79.2	-34.9	175.7	-83.2	-81.4	0	0	0	113.9	R23 I27 E40 L41 I42 A48	R23-N44 VanDerWaalsContact CZ-OD1 3.32Å; R23-N44 PolarHBondContact NE-OD1 2.85Å; R23-N44 VanDerWaalsContact NE-OD1 3.13Å; R23-N44 PolarHBondContact NH2-OD1 2.7Å; I27-N44 HydrophobicContact CD1-CB 3.62Å; I27-N44 HydrophobicContact CG1-CB 4.34Å; E40-N44 VanDerWaalsContact O-CB 3.29Å; E40-N44 WeakPolarHBondContact O-CB 3.46Å; E40-N44 PolarHBondContact O-N 2.86Å; E40-N44 PolarHBondContact O-ND2 3.3Å; L41-N44 PolarHBondContact O-N 3.25Å; I42-N44 PolarHBondContact O-N 3.46Å; I42-N44 VanDerWaalsContact O-N 3.13Å; N44-A48 WeakPolarHBondContact O-CB 3.09Å; N44-A48 PolarHBondContact O-N 3.43Å
45	L	79.4	Confident	75	Confident	94 Å²	94	70.4 Å²	70.4	49%	0.492	38%	0.376	S	S	.	.	H	α-helix	trans	-72.9	-42.5	178	-74.6	172.7	0	0	0	111.7	L41 I42 Y47 A48 A49	L41-L45 HydrophobicContact CD1-CD1 3.86Å; L41-L45 HydrophobicContact CD1-CG 4.06Å; L41-L45 HydrophobicContact CG-CD1 3.87Å; L41-L45 HydrophobicContact CG-CG 4.46Å; L41-L45 WeakPolarHBondContact O-CB 3.44Å; L41-L45 VanDerWaalsContact O-CG 3.26Å; L41-L45 WeakPolarHBondContact O-CG 3.39Å; L41-L45 PolarHBondContact O-N 3.3Å; I42-L45 PolarHBondContact O-N 3.01Å; L45-Y47 VanDerWaalsContact C-N 3.31Å; L45-Y47 PolarHBondContact O-N 3.1Å; L45-A48 PolarHBondContact O-N 2.98Å; L45-A49 WeakPolarHBondContact O-CB 3.25Å; L45-A49 PolarHBondContact O-N 3.26Å
46	E	77.4	Confident	73.9	Confident	126 Å²	126	73.5 Å²	73.5	59%	0.589	39%	0.385	S	S	*	.	H	α-helix	trans	-59.8	-42.3	171.7	-70.1	-176.8	177.1	0	0	111	I42 A48 A49 S50	I42-E46 HydrophobicContact CG2-CG 4.15Å; I42-E46 WeakPolarHBondContact CG2-OE1 3.34Å; I42-E46 PolarHBondContact O-N 2.65Å; E46-A48 PolarHBondContact O-N 2.9Å; E46-A49 PolarHBondContact O-N 3.2Å; E46-S50 WeakPolarHBondContact O-CB 3.46Å; E46-S50 PolarHBondContact O-N 3.25Å; E46-S50 PolarHBondContact O-OG 2.9Å
47	Y	71.9	Confident	72.7	Confident	73 Å²	73	74.8 Å²	74.8	29%	0.286	39%	0.394	S	S	.	.	H	α-helix	trans	-61.5	-44.3	174.1	-173.2	-89.5	0	0	0	112	D43 L45 S50 I51 R433	D43-Y47 VanDerWaalsContact O-CB 3.32Å; D43-Y47 WeakPolarHBondContact O-CB 3.4Å; D43-Y47 PolarHBondContact O-N 2.96Å; L45-Y47 VanDerWaalsContact C-N 3.31Å; L45-Y47 PolarHBondContact O-N 3.1Å; Y47-S50 PolarHBondContact O-N 2.79Å; Y47-S50 PolarHBondContact O-OG 2.95Å; Y47-I51 HydrophobicContact CD1-CD1 4.06Å; Y47-I51 HydrophobicContact CE1-CD1 3.34Å; Y47-I51 HydrophobicContact CE1-CG1 4.32Å; Y47-I51 PolarHBondContact O-N 2.87Å; Y47-R433 PolarHBondContact OH-NH1 3.19Å
48	A	75.1	Confident	71.4	Confident	18 Å²	18	75.2 Å²	75.2	15%	0.149	39%	0.392	C	S	.	.	H	α-helix	trans	-65	-40.1	176.7	0	0	0	0	0	112.4	L24 N44 L45 E46 I51 L52	L24-A48 HydrophobicContact CD2-CB 4.04Å; N44-A48 WeakPolarHBondContact O-CB 3.09Å; N44-A48 PolarHBondContact O-N 3.43Å; L45-A48 PolarHBondContact O-N 2.98Å; E46-A48 PolarHBondContact O-N 2.9Å; A48-I51 PolarHBondContact O-N 3.06Å; A48-L52 WeakPolarHBondContact O-CG 3.48Å; A48-L52 PolarHBondContact O-N 3.22Å
49	A	71.8	Confident	70.3	Confident	41 Å²	41	73.2 Å²	73.2	34%	0.339	38%	0.378	S	S	.	.	H	α-helix	trans	-61.7	-51.5	174.6	0	0	0	0	0	111.2	L45 E46 I51 L52 E53	L45-A49 WeakPolarHBondContact O-CB 3.25Å; L45-A49 PolarHBondContact O-N 3.26Å; E46-A49 PolarHBondContact O-N 3.2Å; A49-I51 PolarHBondContact O-N 3Å; A49-I51 VanDerWaalsContact O-N 3.17Å; A49-L52 CarbonylContact O-C 3.56Å; A49-L52 WeakPolarHBondContact O-CA 3.37Å; A49-L52 PolarHBondContact O-N 2.9Å; A49-E53 WeakPolarHBondContact O-CB 3.46Å; A49-E53 WeakPolarHBondContact O-CG 3.33Å; A49-E53 PolarHBondContact O-N 2.88Å
50	S	73	Confident	68.8	Low	53 Å²	53	68.6 Å²	68.6	37%	0.371	36%	0.364	S	S	.	.	H	α-helix	trans	-59	-31.9	-179.9	68.9	0	0	0	0	113.6	E46 Y47 S54	E46-S50 WeakPolarHBondContact O-CB 3.46Å; E46-S50 PolarHBondContact O-N 3.25Å; E46-S50 PolarHBondContact O-OG 2.9Å; Y47-S50 PolarHBondContact O-N 2.79Å; Y47-S50 PolarHBondContact O-OG 2.95Å; S50-S54 WeakPolarHBondContact O-CB 3.5Å; S50-S54 PolarHBondContact O-N 2.9Å; S50-S54 PolarHBondContact O-OG 2.94Å
51	I	71.5	Confident	67.4	Low	26 Å²	26	70.3 Å²	70.3	13%	0.133	37%	0.366	C	S	.	.	H	α-helix	trans	-74.8	-40.9	173.4	-72	-172.8	0	0	0	111.5	H20 Y47 A48 A49 E53 S54 N55	H20-I51 WeakPolarHBondContact CE1-CD1 3.13Å; H20-I51 WeakPolarHBondContact NE2-CD1 3.46Å; Y47-I51 HydrophobicContact CD1-CD1 4.06Å; Y47-I51 HydrophobicContact CE1-CD1 3.34Å; Y47-I51 HydrophobicContact CE1-CG1 4.32Å; Y47-I51 PolarHBondContact O-N 2.87Å; A48-I51 PolarHBondContact O-N 3.06Å; A49-I51 PolarHBondContact O-N 3Å; A49-I51 VanDerWaalsContact O-N 3.17Å; I51-E53 VanDerWaalsContact C-N 3.3Å; I51-E53 PolarHBondContact O-N 2.87Å; I51-S54 WeakPolarHBondContact CA-OG 3.3Å; I51-S54 PolarHBondContact O-N 3.13Å; I51-S54 PolarHBondContact O-OG 2.79Å; I51-N55 VanDerWaalsContact CG2-ND2 3.32Å; I51-N55 WeakPolarHBondContact CG2-ND2 3.08Å; I51-N55 WeakPolarHBondContact O-CB 2.96Å; I51-N55 VanDerWaalsContact O-CG 3.27Å; I51-N55 PolarHBondContact O-N 2.88Å; I51-N55 PolarHBondContact O-ND2 3.43Å
52	L	73.2	Confident	66	Low	106 Å²	106	74.7 Å²	74.7	56%	0.555	38%	0.38	S	S	*	.	H	α-helix	trans	-64.5	-36.1	173.2	-70	170.3	0	0	0	112	A48 A49 Y56	A48-L52 WeakPolarHBondContact O-CG 3.48Å; A48-L52 PolarHBondContact O-N 3.22Å; A49-L52 CarbonylContact O-C 3.56Å; A49-L52 WeakPolarHBondContact O-CA 3.37Å; A49-L52 PolarHBondContact O-N 2.9Å; L52-Y56 VanDerWaalsContact O-CB 3.27Å; L52-Y56 WeakPolarHBondContact O-CB 3.19Å; L52-Y56 PolarHBondContact O-N 3.31Å
53	E	73.4	Confident	64.3	Low	123 Å²	123	80.4 Å²	80.4	58%	0.575	40%	0.396	S	S	*	.	H	α-helix	trans	-64.4	-50.3	173.2	-72.7	169.2	-179.8	0	0	111.6	A49 I51 N55 Y56 V57	A49-E53 WeakPolarHBondContact O-CB 3.46Å; A49-E53 WeakPolarHBondContact O-CG 3.33Å; A49-E53 PolarHBondContact O-N 2.88Å; I51-E53 VanDerWaalsContact C-N 3.3Å; I51-E53 PolarHBondContact O-N 2.87Å; E53-N55 VanDerWaalsContact C-N 3.34Å; E53-N55 PolarHBondContact O-N 3.1Å; E53-Y56 PolarHBondContact O-N 3.4Å; E53-Y56 VanDerWaalsContact O-N 3.15Å; E53-V57 WeakPolarHBondContact O-CB 3.4Å; E53-V57 WeakPolarHBondContact O-CG2 3.4Å; E53-V57 PolarHBondContact O-N 3.2Å
54	S	67.7	Low	62.6	Low	57 Å²	57	79.6 Å²	79.6	40%	0.399	40%	0.4	S	S	.	.	H	α-helix	trans	-59.7	-43.3	176.8	65.6	0	0	0	0	112.2	S50 I51 Y56 V57 D58	S50-S54 WeakPolarHBondContact O-CB 3.5Å; S50-S54 PolarHBondContact O-N 2.9Å; S50-S54 PolarHBondContact O-OG 2.94Å; I51-S54 WeakPolarHBondContact CA-OG 3.3Å; I51-S54 PolarHBondContact O-N 3.13Å; I51-S54 PolarHBondContact O-OG 2.79Å; S54-Y56 VanDerWaalsContact C-N 3.34Å; S54-Y56 PolarHBondContact O-N 3.35Å; S54-V57 PolarHBondContact O-N 2.91Å; S54-D58 PolarHBondContact O-N 2.96Å
55	N	60.6	Low	60.5	Low	21 Å²	21	80.4 Å²	80.4	11%	0.112	41%	0.407	C	S	.	.	H	α-helix	trans	-65.7	-33.8	175.6	-74.2	-47.5	0	0	0	112.8	Y13 I51 E53 S59	Y13-N55 HydrophobicContact CE2-CB 3.83Å; Y13-N55 WeakPolarHBondContact CE2-OD1 3.23Å; I51-N55 VanDerWaalsContact CG2-ND2 3.32Å; I51-N55 WeakPolarHBondContact CG2-ND2 3.08Å; I51-N55 WeakPolarHBondContact O-CB 2.96Å; I51-N55 VanDerWaalsContact O-CG 3.27Å; I51-N55 PolarHBondContact O-N 2.88Å; I51-N55 PolarHBondContact O-ND2 3.43Å; E53-N55 VanDerWaalsContact C-N 3.34Å; E53-N55 PolarHBondContact O-N 3.1Å; N55-S59 VanDerWaalsContact O-CB 3.23Å; N55-S59 WeakPolarHBondContact O-CB 3.22Å; N55-S59 PolarHBondContact O-N 3.34Å; N55-S59 PolarHBondContact O-OG 2.87Å
56	Y	58.1	Low	58.4	Low	165 Å²	165	81.9 Å²	81.9	65%	0.647	42%	0.42	S	S	*	.	H	α-helix	trans	-72.9	-39	173.6	-179.7	-96	0	0	0	112	L52 E53 S54 S59 S60	L52-Y56 VanDerWaalsContact O-CB 3.27Å; L52-Y56 WeakPolarHBondContact O-CB 3.19Å; L52-Y56 PolarHBondContact O-N 3.31Å; E53-Y56 PolarHBondContact O-N 3.4Å; E53-Y56 VanDerWaalsContact O-N 3.15Å; S54-Y56 VanDerWaalsContact C-N 3.34Å; S54-Y56 PolarHBondContact O-N 3.35Å; Y56-S59 PolarHBondContact O-N 3.42Å; Y56-S60 WeakPolarHBondContact CE1-OG 3.5Å; Y56-S60 WeakPolarHBondContact O-CB 3.47Å; Y56-S60 PolarHBondContact O-N 3.32Å; Y56-S60 PolarHBondContact O-OG 3.45Å
57	V	54.8	Low	56.3	Low	67 Å²	67	80.5 Å²	80.5	41%	0.406	43%	0.425	S	S	.	.	H	α-helix	trans	-61.7	-46.7	173.3	167.6	0	0	0	0	110	E53 S54 S60 R61	E53-V57 WeakPolarHBondContact O-CB 3.4Å; E53-V57 WeakPolarHBondContact O-CG2 3.4Å; E53-V57 PolarHBondContact O-N 3.2Å; S54-V57 PolarHBondContact O-N 2.91Å; V57-S60 PolarHBondContact O-N 2.78Å; V57-R61 HydrophobicContact CG1-CG 4.41Å; V57-R61 WeakPolarHBondContact O-CB 3.32Å; V57-R61 VanDerWaalsContact O-CG 3.28Å; V57-R61 WeakPolarHBondContact O-CG 3.28Å; V57-R61 PolarHBondContact O-N 3.24Å
58	D	54	Low	54.4	Low	62 Å²	62	85 Å²	85	33%	0.332	45%	0.446	S	S	.	.	H	α-helix	trans	-70.1	-35.4	177	-82.1	-5	0	0	0	112.8	S54 S60 R61 R62	S54-D58 PolarHBondContact O-N 2.96Å; D58-S60 VanDerWaalsContact C-N 3.31Å; D58-S60 PolarHBondContact O-N 3.16Å; D58-R61 PolarHBondContact O-N 2.98Å; D58-R61 WeakPolarHBondContact OD1-CD 3.4Å; D58-R61 IonicContact OD1-NH1 2.73Å; D58-R61 PolarHBondContact OD1-NH1 2.89Å; D58-R61 VanDerWaalsContact OD1-NH1 3.07Å; D58-R62 WeakPolarHBondContact O-CB 3.28Å; D58-R62 VanDerWaalsContact O-CG 3.24Å; D58-R62 WeakPolarHBondContact O-CG 3.35Å; D58-R62 PolarHBondContact O-N 3.48Å
59	S	52.9	Low	52.1	Low	49 Å²	49	92.9 Å²	92.9	34%	0.343	48%	0.479	S	S	.	.	H	α-helix	trans	-64.1	-36.3	171.1	-63.5	0	0	0	0	112.3	N55 Y56 R63	N55-S59 VanDerWaalsContact O-CB 3.23Å; N55-S59 WeakPolarHBondContact O-CB 3.22Å; N55-S59 PolarHBondContact O-N 3.34Å; N55-S59 PolarHBondContact O-OG 2.87Å; Y56-S59 PolarHBondContact O-N 3.42Å; S59-R63 PolarHBondContact O-N 3.24Å
60	S	44.8	Very low	50.3	Low	43 Å²	43	94.5 Å²	94.5	30%	0.301	49%	0.493	S	S	.	.	H	α-helix	trans	-75.1	-40.6	177.8	-60	0	0	0	0	111.6	Y56 V57 D58 R63 A64	Y56-S60 WeakPolarHBondContact CE1-OG 3.5Å; Y56-S60 WeakPolarHBondContact O-CB 3.47Å; Y56-S60 PolarHBondContact O-N 3.32Å; Y56-S60 PolarHBondContact O-OG 3.45Å; V57-S60 PolarHBondContact O-N 2.78Å; D58-S60 VanDerWaalsContact C-N 3.31Å; D58-S60 PolarHBondContact O-N 3.16Å; S60-R63 PolarHBondContact O-N 3.17Å; S60-A64 WeakPolarHBondContact O-CB 3.26Å; S60-A64 PolarHBondContact O-N 3.49Å
61	R	47.5	Very low	48.2	Very low	127 Å²	127	100.6 Å²	100.6	48%	0.479	52%	0.516	S	S	.	.	H	α-helix	trans	-58.6	-46	168.9	-77.1	169.3	168.4	176.6	-8.3	110.6	V57 D58 R63 A64 C65	V57-R61 HydrophobicContact CG1-CG 4.41Å; V57-R61 WeakPolarHBondContact O-CB 3.32Å; V57-R61 VanDerWaalsContact O-CG 3.28Å; V57-R61 WeakPolarHBondContact O-CG 3.28Å; V57-R61 PolarHBondContact O-N 3.24Å; D58-R61 PolarHBondContact O-N 2.98Å; D58-R61 WeakPolarHBondContact OD1-CD 3.4Å; D58-R61 IonicContact OD1-NH1 2.73Å; D58-R61 PolarHBondContact OD1-NH1 2.89Å; D58-R61 VanDerWaalsContact OD1-NH1 3.07Å; R61-R63 PolarHBondContact O-N 2.97Å; R61-A64 CarbonylContact O-C 3.57Å; R61-A64 PolarHBondContact O-N 3.29Å; R61-C65 WeakPolarHBondContact O-CB 3.37Å; R61-C65 PolarHBondContact O-N 2.83Å
62	R	49	Very low	46.3	Very low	131 Å²	131	108.5 Å²	108.5	49%	0.494	55%	0.552	S	S	.	*	H	α-helix	trans	-61.4	-42.9	175.6	-74.8	176.4	-167.3	-158.9	4.2	111.9	T9 D58 C65 T66	T9-R62 VanDerWaalsContact CG2-NH2 3.28Å; D58-R62 WeakPolarHBondContact O-CB 3.28Å; D58-R62 VanDerWaalsContact O-CG 3.24Å; D58-R62 WeakPolarHBondContact O-CG 3.35Å; D58-R62 PolarHBondContact O-N 3.48Å; R62-C65 CarbonylContact O-C 2.86Å; R62-C65 PolarHBondContact O-N 3.06Å; R62-T66 PolarHBondContact O-N 2.91Å; R62-T66 PolarHBondContact O-OG1 3.31Å
63	R	39.9	Very low	44.3	Very low	202 Å²	202	108.4 Å²	108.4	76%	0.762	55%	0.551	S	S	*	*	H	α-helix	trans	-63.8	-39.1	173.7	-79.6	179.6	170.7	169.9	-2.2	113.4	S59 S60 R61 C65 T66	S59-R63 PolarHBondContact O-N 3.24Å; S60-R63 PolarHBondContact O-N 3.17Å; R61-R63 PolarHBondContact O-N 2.97Å; R63-C65 VanDerWaalsContact C-N 3.34Å; R63-T66 WeakPolarHBondContact CA-OG1 3.47Å; R63-T66 PolarHBondContact O-OG1 2.83Å
64	A	41.1	Very low	42.5	Very low	57 Å²	57	106.5 Å²	106.5	47%	0.471	55%	0.545	S	S	.	.	H	α-helix	trans	-68.3	-34.1	172.5	0	0	0	0	0	112.1	S60 R61 S67 K68	S60-A64 WeakPolarHBondContact O-CB 3.26Å; S60-A64 PolarHBondContact O-N 3.49Å; R61-A64 CarbonylContact O-C 3.57Å; R61-A64 PolarHBondContact O-N 3.29Å; A64-S67 PolarHBondContact O-N 2.99Å; A64-S67 PolarHBondContact O-OG 3.17Å; A64-K68 PolarHBondContact O-N 3.48Å
65	C	34.5	Very low	41.5	Very low	47 Å²	47	105 Å²	105	32%	0.318	53%	0.534	S	S	.	.	H	α-helix	trans	-76.5	-29.6	178.6	-169.9	0	0	0	0	112.7	R61 R62 R63 S67 K68 Q69 A70	R61-C65 WeakPolarHBondContact O-CB 3.37Å; R61-C65 PolarHBondContact O-N 2.83Å; R62-C65 CarbonylContact O-C 2.86Å; R62-C65 PolarHBondContact O-N 3.06Å; R63-C65 VanDerWaalsContact C-N 3.34Å; C65-S67 PolarHBondContact O-N 2.93Å; C65-S67 VanDerWaalsContact O-N 3.09Å; C65-K68 CarbonylContact C-O 3.44Å; C65-K68 VanDerWaalsContact CA-O 3.25Å; C65-K68 WeakPolarHBondContact CA-O 3.45Å; C65-K68 CarbonylContact O-C 3.45Å; C65-K68 PolarHBondContact O-N 3.41Å; C65-K68 PolarHBondContact SG-O 3.5Å; C65-Q69 PolarHBondContact O-N 2.88Å; C65-A70 PolarHBondContact SG-N 3.07Å; C65-A70 VanDerWaalsContact SG-N 3.38Å
66	T	33.4	Very low	40.8	Very low	125 Å²	125	111 Å²	111	77%	0.767	56%	0.561	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.5	-11	167.3	46.2	0	0	0	0	113.6	R62 R63	R62-T66 PolarHBondContact O-N 2.91Å; R62-T66 PolarHBondContact O-OG1 3.31Å; R63-T66 WeakPolarHBondContact CA-OG1 3.47Å; R63-T66 PolarHBondContact O-OG1 2.83Å
67	S	35.1	Very low	40.3	Very low	97 Å²	97	107.9 Å²	107.9	68%	0.678	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	-7.3	168.7	69	0	0	0	0	114.5	A64 C65	A64-S67 PolarHBondContact O-N 2.99Å; A64-S67 PolarHBondContact O-OG 3.17Å; C65-S67 PolarHBondContact O-N 2.93Å; C65-S67 VanDerWaalsContact O-N 3.09Å
68	K	30.2	Very low	39.9	Very low	167 Å²	167	105.3 Å²	105.3	73%	0.726	54%	0.541	S	S	*	.	S	Bend	trans	-153.8	99.7	175.8	-71.3	-166.7	176.2	-170.1	0	109	A64 C65 A70	A64-K68 PolarHBondContact O-N 3.48Å; C65-K68 CarbonylContact C-O 3.44Å; C65-K68 VanDerWaalsContact CA-O 3.25Å; C65-K68 WeakPolarHBondContact CA-O 3.45Å; C65-K68 CarbonylContact O-C 3.45Å; C65-K68 PolarHBondContact O-N 3.41Å; C65-K68 PolarHBondContact SG-O 3.5Å; K68-A70 PolarHBondContact O-N 2.88Å
69	Q	28.8	Very low	39.7	Very low	184 Å²	184	104.6 Å²	104.6	86%	0.86	54%	0.54	S	S	*	.			trans	-52.7	118.7	173.8	-69.7	170.1	-76.3	0	0	108.5	C65 E71	C65-Q69 PolarHBondContact O-N 2.88Å; Q69-E71 PolarHBondContact O-N 3.21Å
70	A	32.3	Very low	39.4	Very low	76 Å²	76	106.2 Å²	106.2	63%	0.628	54%	0.541	S	S	*	.			trans	-80.7	108.3	173.1	0	0	0	0	0	106.9	C65 K68 Q72	C65-A70 PolarHBondContact SG-N 3.07Å; C65-A70 VanDerWaalsContact SG-N 3.38Å; K68-A70 PolarHBondContact O-N 2.88Å; A70-Q72 PolarHBondContact O-N 3.39Å
71	E	30.1	Very low	39.5	Very low	181 Å²	181	110.8 Å²	110.8	85%	0.846	56%	0.558	S	S	*	*			trans	-61.5	119.4	178.3	-68.9	160.3	153	0	0	108.8	Q69 I73	Q69-E71 PolarHBondContact O-N 3.21Å; E71-I73 PolarHBondContact O-N 2.59Å
72	Q	30.9	Very low	39.4	Very low	191 Å²	191	105.7 Å²	105.7	89%	0.893	54%	0.541	S	S	*	.			trans	-78.3	103.5	176.5	-71.8	-176.1	-80.1	0	0	108.6	A70 D74	A70-Q72 PolarHBondContact O-N 3.39Å; Q72-D74 PolarHBondContact O-N 2.66Å
73	I	31.3	Very low	39.5	Very low	105 Å²	105	103.1 Å²	103.1	54%	0.538	53%	0.531	S	S	.	.			trans	-59.8	114.7	178.2	-63.6	175.7	0	0	0	109.8	E71 D77	E71-I73 PolarHBondContact O-N 2.59Å; I73-D77 HydrophobicContact CB-CB 4.28Å; I73-D77 HydrophobicContact CG2-CB 3.69Å
74	D	35.9	Very low	40	Very low	83 Å²	83	98.8 Å²	98.8	44%	0.444	52%	0.518	S	S	.	.			trans	-76.9	165.9	167.8	-155.8	-38.6	0	0	0	110	Q72 E76 D77 V78	Q72-D74 PolarHBondContact O-N 2.66Å; D74-E76 PolarHBondContact O-N 2.94Å; D74-D77 PolarHBondContact N-OD2 2.84Å; D74-D77 PolarHBondContact O-N 2.94Å; D74-V78 PolarHBondContact O-N 3.07Å
75	S	45.4	Very low	40.9	Very low	25 Å²	25	98.7 Å²	98.7	18%	0.175	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-46.1	-25.7	164.6	57.8	0	0	0	0	115.1	R83 K307	S75-R83 PolarHBondContact O-NH2 2.93Å; S75-K307 WeakPolarHBondContact OG-CD 3.23Å; S75-K307 WeakPolarHBondContact OG-CE 3.14Å; S75-K307 PolarHBondContact OG-NZ 2.72Å
76	E	46.9	Very low	41.8	Very low	146 Å²	146	96.7 Å²	96.7	68%	0.682	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-24.2	178.5	-70.1	172	-147.3	0	0	112.5	D74 V78 K307	D74-E76 PolarHBondContact O-N 2.94Å; E76-V78 VanDerWaalsContact C-N 3.31Å; E76-V78 PolarHBondContact O-N 2.85Å; E76-K307 IonicContact OE1-NZ 2.65Å; E76-K307 PolarHBondContact OE1-NZ 3.15Å
77	D	48.2	Very low	42.8	Very low	100 Å²	100	92.7 Å²	92.7	54%	0.535	47%	0.471	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.9	-7.6	176	-62.7	-51	0	0	0	113.5	I73 D74 P79	I73-D77 HydrophobicContact CB-CB 4.28Å; I73-D77 HydrophobicContact CG2-CB 3.69Å; D74-D77 PolarHBondContact N-OD2 2.84Å; D74-D77 PolarHBondContact O-N 2.94Å; D77-P79 WeakPolarHBondContact O-CD 3.32Å
78	V	46.7	Very low	43.7	Very low	14 Å²	14	92.9 Å²	92.9	9%	0.085	46%	0.464	C	S	.	.	S	Bend	trans	-62.4	122.6	170.9	178.2	0	0	0	0	108.7	D74 E76 E80 V82 R83 F303	D74-V78 PolarHBondContact O-N 3.07Å; E76-V78 VanDerWaalsContact C-N 3.31Å; E76-V78 PolarHBondContact O-N 2.85Å; V78-E80 PolarHBondContact O-N 3.24Å; V78-V82 HydrophobicContact CG1-CB 4.16Å; V78-V82 HydrophobicContact CG1-CG1 4.22Å; V78-R83 PolarHBondContact O-NH1 3.34Å; V78-R83 PolarHBondContact O-NH2 3.1Å; V78-F303 HydrophobicContact CG1-CE1 4Å; V78-F303 HydrophobicContact CG1-CE2 4.36Å; V78-F303 HydrophobicContact CG1-CZ 3.71Å; V78-F303 HydrophobicContact CG2-CE1 4.1Å
79	P	48	Very low	44.8	Very low	47 Å²	47	85 Å²	85	31%	0.305	43%	0.43	S	S	.	.			trans	-56.2	139.1	-177.2	-26	34.3	0	0	0	112.3	D77 E81 V82 R83 F390	D77-P79 WeakPolarHBondContact O-CD 3.32Å; P79-E81 WeakPolarHBondContact CB-OE2 3.37Å; P79-E81 PolarHBondContact O-N 3.42Å; P79-V82 HydrophobicContact CB-CG2 4.16Å; P79-V82 HydrophobicContact CG-CG2 4.35Å; P79-V82 WeakPolarHBondContact O-CB 3.35Å; P79-V82 PolarHBondContact O-N 2.94Å; P79-R83 PolarHBondContact O-N 3.44Å; P79-R83 VanDerWaalsContact O-N 3.14Å; P79-F390 HydrophobicContact CG-CE1 4.25Å
80	E	48	Very low	46.2	Very low	82 Å²	82	77.7 Å²	77.7	38%	0.383	40%	0.395	S	S	.	.	H	α-helix	trans	-61.7	-27.4	-178	176.6	59.2	-169.4	0	0	111.8	V78 R83 K84	V78-E80 PolarHBondContact O-N 3.24Å; E80-R83 PolarHBondContact O-N 3.18Å; E80-R83 IonicContact OE2-CZ 3.2Å; E80-R83 IonicContact OE2-NH1 3.1Å; E80-R83 PolarHBondContact OE2-NH1 3.09Å; E80-K84 HydrophobicContact CG-CD 4.36Å; E80-K84 VanDerWaalsContact O-CB 3.29Å; E80-K84 WeakPolarHBondContact O-CB 3.48Å; E80-K84 VanDerWaalsContact O-CG 3.29Å; E80-K84 WeakPolarHBondContact O-CG 3.49Å; E80-K84 PolarHBondContact O-N 3.2Å; E80-K84 WeakPolarHBondContact OE1-CE 3.36Å; E80-K84 IonicContact OE1-NZ 2.91Å; E80-K84 PolarHBondContact OE1-NZ 3.23Å
81	E	45.8	Very low	47.1	Very low	140 Å²	140	76 Å²	76	65%	0.654	38%	0.377	S	S	*	.	H	α-helix	trans	-62.6	-40.2	171.1	-62.5	69.2	-152.6	0	0	112.2	P79 W85	P79-E81 WeakPolarHBondContact CB-OE2 3.37Å; P79-E81 PolarHBondContact O-N 3.42Å; E81-W85 WeakPolarHBondContact O-CB 3.22Å; E81-W85 PolarHBondContact O-N 3.15Å
82	V	45.3	Very low	47.6	Very low	19 Å²	19	68.2 Å²	68.2	12%	0.115	34%	0.341	C	S	.	.	H	α-helix	trans	-72.7	-40.8	178.3	179.5	0	0	0	0	110.5	V78 P79 W85 L86 F390 I391	V78-V82 HydrophobicContact CG1-CB 4.16Å; V78-V82 HydrophobicContact CG1-CG1 4.22Å; P79-V82 HydrophobicContact CB-CG2 4.16Å; P79-V82 HydrophobicContact CG-CG2 4.35Å; P79-V82 WeakPolarHBondContact O-CB 3.35Å; P79-V82 PolarHBondContact O-N 2.94Å; V82-W85 HydrophobicContact CG1-CE3 4.33Å; V82-W85 PolarHBondContact O-N 2.79Å; V82-L86 PolarHBondContact O-N 3.27Å; V82-F390 HydrophobicContact CG1-CB 3.93Å; V82-F390 HydrophobicContact CG1-CD2 4.4Å; V82-F390 HydrophobicContact CG1-CG 4.27Å; V82-F390 HydrophobicContact CG2-CD2 3.78Å; V82-F390 HydrophobicContact CG2-CE2 4.03Å; V82-F390 HydrophobicContact CG2-CG 4.08Å; V82-I391 HydrophobicContact CG1-CD1 4.36Å
83	R	51.3	Low	48	Very low	78 Å²	78	59.1 Å²	59.1	29%	0.294	30%	0.298	S	S	.	.	H	α-helix	trans	-63.6	-44.2	176.2	-164.6	-177.8	-65.4	99.3	5	111.5	S75 V78 P79 E80 A87 F303	S75-R83 PolarHBondContact O-NH2 2.93Å; V78-R83 PolarHBondContact O-NH1 3.34Å; V78-R83 PolarHBondContact O-NH2 3.1Å; P79-R83 PolarHBondContact O-N 3.44Å; P79-R83 VanDerWaalsContact O-N 3.14Å; E80-R83 PolarHBondContact O-N 3.18Å; E80-R83 IonicContact OE2-CZ 3.2Å; E80-R83 IonicContact OE2-NH1 3.1Å; E80-R83 PolarHBondContact OE2-NH1 3.09Å; R83-A87 PolarHBondContact O-N 3.5Å; R83-F303 HydrophobicContact CB-CE2 4.39Å; R83-F303 HydrophobicContact CG-CD2 4.33Å; R83-F303 HydrophobicContact CG-CE2 4.22Å
84	K	51.7	Low	48.7	Very low	111 Å²	111	54.5 Å²	54.5	48%	0.483	28%	0.275	S	S	.	.	H	α-helix	trans	-64.4	-40.9	170.9	-76.8	179.2	165.6	96.8	0	112.5	E80 A87 L88	E80-K84 HydrophobicContact CG-CD 4.36Å; E80-K84 VanDerWaalsContact O-CB 3.29Å; E80-K84 WeakPolarHBondContact O-CB 3.48Å; E80-K84 VanDerWaalsContact O-CG 3.29Å; E80-K84 WeakPolarHBondContact O-CG 3.49Å; E80-K84 PolarHBondContact O-N 3.2Å; E80-K84 WeakPolarHBondContact OE1-CE 3.36Å; E80-K84 IonicContact OE1-NZ 2.91Å; E80-K84 PolarHBondContact OE1-NZ 3.23Å; K84-A87 PolarHBondContact O-N 3.1Å; K84-L88 WeakPolarHBondContact O-CB 3.39Å; K84-L88 VanDerWaalsContact O-CG 3.25Å; K84-L88 WeakPolarHBondContact O-CG 3.46Å; K84-L88 PolarHBondContact O-N 3.03Å
85	W	58.1	Low	48.6	Very low	54 Å²	54	54 Å²	54	21%	0.205	27%	0.272	C	S	.	.	H	α-helix	trans	-62.5	-42.1	178.5	165.7	78.1	0	0	0	112.1	E81 V82 L88 T89 F90 L372 F387	E81-W85 WeakPolarHBondContact O-CB 3.22Å; E81-W85 PolarHBondContact O-N 3.15Å; V82-W85 HydrophobicContact CG1-CE3 4.33Å; V82-W85 PolarHBondContact O-N 2.79Å; W85-L88 PolarHBondContact O-N 2.68Å; W85-T89 PolarHBondContact NE1-OG1 3.27Å; W85-T89 VanDerWaalsContact NE1-OG1 3.1Å; W85-T89 VanDerWaalsContact O-CB 3.25Å; W85-T89 WeakPolarHBondContact O-CB 3.38Å; W85-T89 PolarHBondContact O-N 3.41Å; W85-T89 PolarHBondContact O-OG1 2.86Å; W85-F90 HydrophobicContact CH2-CE2 4.06Å; W85-F90 HydrophobicContact CZ2-CE2 4.22Å; W85-L372 HydrophobicContact CZ2-CD1 3.65Å; W85-L372 HydrophobicContact CZ2-CG 4.26Å; W85-F387 HydrophobicContact CH2-CD2 4.1Å
86	L	54.7	Low	48.1	Very low	6 Å²	6	58.8 Å²	58.8	3%	0.031	29%	0.292	C	S	.	.	H	α-helix	trans	-59.6	-48.4	173.1	-88.5	-173.1	0	0	0	111.3	V82 L88 T89 F90 M299 F303 I391	V82-L86 PolarHBondContact O-N 3.27Å; L86-L88 PolarHBondContact O-N 2.82Å; L86-T89 PolarHBondContact O-N 3Å; L86-F90 HydrophobicContact CD2-CD2 3.64Å; L86-F90 HydrophobicContact CD2-CE2 3.68Å; L86-F90 WeakPolarHBondContact O-CA 3.4Å; L86-F90 WeakPolarHBondContact O-CB 3.45Å; L86-F90 WeakPolarHBondContact O-CD2 3.33Å; L86-F90 PolarHBondContact O-N 3.18Å; L86-M299 HydrophobicContact CD1-CE 4.16Å; L86-M299 HydrophobicContact CD2-CE 3.67Å; L86-F303 HydrophobicContact CD1-CD2 4.41Å; L86-F303 HydrophobicContact CD1-CE2 3.63Å; L86-F303 HydrophobicContact CD1-CZ 3.81Å; L86-I391 HydrophobicContact CD1-CD1 3.7Å; L86-I391 HydrophobicContact CG-CD1 4.27Å
87	A	55	Low	47.5	Very low	40 Å²	40	55.8 Å²	55.8	33%	0.331	29%	0.285	S	S	.	.	H	α-helix	trans	-58.9	-51	177.8	0	0	0	0	0	112	R83 K84 T89 F90 T91	R83-A87 PolarHBondContact O-N 3.5Å; K84-A87 PolarHBondContact O-N 3.1Å; A87-T89 VanDerWaalsContact C-N 3.31Å; A87-T89 PolarHBondContact O-N 3.31Å; A87-F90 CarbonylContact O-C 3.58Å; A87-F90 PolarHBondContact O-N 3.49Å; A87-T91 HydrophobicContact CB-CG2 4.48Å; A87-T91 PolarHBondContact O-N 2.9Å; A87-T91 VanDerWaalsContact O-N 3.07Å; A87-T91 PolarHBondContact O-OG1 3.34Å
88	L	52.7	Low	46.3	Very low	102 Å²	102	62 Å²	62	53%	0.534	30%	0.301	S	S	.	.	H	α-helix	trans	-68	-25.8	-177.4	-68.2	168.3	0	0	0	113.7	K84 W85 L86 S235 P371	K84-L88 WeakPolarHBondContact O-CB 3.39Å; K84-L88 VanDerWaalsContact O-CG 3.25Å; K84-L88 WeakPolarHBondContact O-CG 3.46Å; K84-L88 PolarHBondContact O-N 3.03Å; W85-L88 PolarHBondContact O-N 2.68Å; L86-L88 PolarHBondContact O-N 2.82Å; L88-S235 WeakPolarHBondContact O-CB 3.28Å; L88-S235 PolarHBondContact O-OG 3.45Å; L88-P371 HydrophobicContact CB-CG 3.71Å; L88-P371 VanDerWaalsContact O-CD 3.22Å; L88-P371 WeakPolarHBondContact O-CD 3.34Å
89	T	52.9	Low	45.1	Very low	0 Å²	0	69.1 Å²	69.1	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-87.1	-30.5	175.6	-48.7	0	0	0	0	111.7	W85 L86 A87 T233 F355	W85-T89 PolarHBondContact NE1-OG1 3.27Å; W85-T89 VanDerWaalsContact NE1-OG1 3.1Å; W85-T89 VanDerWaalsContact O-CB 3.25Å; W85-T89 WeakPolarHBondContact O-CB 3.38Å; W85-T89 PolarHBondContact O-N 3.41Å; W85-T89 PolarHBondContact O-OG1 2.86Å; L86-T89 PolarHBondContact O-N 3Å; A87-T89 VanDerWaalsContact C-N 3.31Å; A87-T89 PolarHBondContact O-N 3.31Å; T89-T233 VanDerWaalsContact O-CB 3.26Å; T89-T233 WeakPolarHBondContact O-CB 3.45Å; T89-T233 PolarHBondContact O-OG1 3.19Å; T89-F355 HydrophobicContact CG2-CE2 4.34Å
90	F	58.4	Low	43.9	Very low	31 Å²	31	75.6 Å²	75.6	14%	0.136	36%	0.357	C	S	.	.	H	α-helix	trans	-136	41.4	-165.8	-54	-89.8	0	0	0	115.8	W85 L86 A87 T233 N234 M299 F355	W85-F90 HydrophobicContact CH2-CE2 4.06Å; W85-F90 HydrophobicContact CZ2-CE2 4.22Å; L86-F90 HydrophobicContact CD2-CD2 3.64Å; L86-F90 HydrophobicContact CD2-CE2 3.68Å; L86-F90 WeakPolarHBondContact O-CA 3.4Å; L86-F90 WeakPolarHBondContact O-CB 3.45Å; L86-F90 WeakPolarHBondContact O-CD2 3.33Å; L86-F90 PolarHBondContact O-N 3.18Å; A87-F90 CarbonylContact O-C 3.58Å; A87-F90 PolarHBondContact O-N 3.49Å; F90-T233 HydrophobicContact CD1-CG2 4.27Å; F90-T233 HydrophobicContact CE1-CG2 4.44Å; F90-N234 HydrophobicContact CB-CB 4.34Å; F90-N234 WeakPolarHBondContact O-CB 3.29Å; F90-M299 HydrophobicContact CB-CB 4.11Å; F90-M299 HydrophobicContact CG-CB 4.26Å; F90-F355 HydrophobicContact CE1-CE1 4.49Å; F90-F355 AromaticContact CE1-CZ 3.78Å; F90-F355 HydrophobicContact CE1-CZ 3.78Å; F90-F355 HydrophobicContact CZ-CE2 4.42Å; F90-F355 AromaticContact CZ-CZ 3.94Å; F90-F355 HydrophobicContact CZ-CZ 3.94Å
91	T	51.6	Low	42.7	Very low	42 Å²	42	78.1 Å²	78.1	26%	0.258	38%	0.377	S	S	.	.	S	Bend	trans	-121.2	91.6	166.3	50.4	0	0	0	0	118.2	A87 S235	A87-T91 HydrophobicContact CB-CG2 4.48Å; A87-T91 PolarHBondContact O-N 2.9Å; A87-T91 VanDerWaalsContact O-N 3.07Å; A87-T91 PolarHBondContact O-OG1 3.34Å; T91-S235 VanDerWaalsContact C-CA 3.41Å; T91-S235 VanDerWaalsContact CA-N 3.33Å; T91-S235 CarbonylContact O-C 3.52Å; T91-S235 VanDerWaalsContact O-C 3.28Å; T91-S235 WeakPolarHBondContact O-CA 3.27Å; T91-S235 PolarHBondContact O-N 3.45Å
92	Q	40.8	Very low	41.7	Very low	17 Å²	17	76.7 Å²	76.7	8%	0.079	38%	0.383	C	S	.	.			trans	71	125.8	176.1	-63.4	66.4	77.2	0	0	119.1	N234 S235 Y236 H237 V238 V253	Q92-N234 CarbonylContact C-O 3.28Å; Q92-N234 WeakPolarHBondContact CA-OD1 3.3Å; Q92-N234 VanDerWaalsContact N-CG 3.35Å; Q92-N234 PolarHBondContact N-OD1 2.94Å; Q92-N234 PolarHBondContact NE2-OD1 3.26Å; Q92-N234 CarbonylContact O-C 3.46Å; Q92-S235 CarbonylContact O-C 3.56Å; Q92-S235 WeakPolarHBondContact O-CA 3.28Å; Q92-S235 PolarHBondContact O-N 2.87Å; Q92-S235 VanDerWaalsContact O-N 3.14Å; Q92-Y236 CarbonylContact O-C 2.94Å; Q92-Y236 PolarHBondContact O-N 3.37Å; Q92-H237 HydrophobicContact CB-CB 3.87Å; Q92-H237 WeakPolarHBondContact O-CB 3.22Å; Q92-H237 PolarHBondContact O-N 3.04Å; Q92-V238 HydrophobicContact CB-CG2 4.19Å; Q92-V253 HydrophobicContact CB-CB 4.16Å; Q92-V253 HydrophobicContact CB-CG2 3.93Å; Q92-V253 HydrophobicContact CG-CB 3.7Å; Q92-V253 HydrophobicContact CG-CG2 3.21Å
93	S	39	Very low	40.9	Very low	0 Å²	0	83.7 Å²	83.7	0%	0	41%	0.412	C	S	.	.			trans	-135	120.2	-173.4	126.5	0	0	0	0	130	T230 H232 T233 N234 Y236 H237	S93-T230 PolarHBondContact O-OG1 3.36Å; S93-H232 WeakPolarHBondContact OG-CB 3.31Å; S93-T233 WeakPolarHBondContact CA-O 3.11Å; S93-T233 VanDerWaalsContact CB-O 3.23Å; S93-T233 WeakPolarHBondContact CB-O 3.37Å; S93-T233 PolarHBondContact OG-O 3.27Å; S93-N234 WeakPolarHBondContact CB-O 3.44Å; S93-N234 PolarHBondContact OG-O 2.99Å; S93-N234 VanDerWaalsContact OG-O 3.04Å; S93-Y236 VanDerWaalsContact CB-N 3.29Å; S93-Y236 WeakPolarHBondContact OG-CD1 3.33Å; S93-Y236 WeakPolarHBondContact OG-CE1 3.25Å; S93-H237 VanDerWaalsContact CA-CD2 3.49Å; S93-H237 WeakPolarHBondContact CA-CD2 3.35Å; S93-H237 PolarHBondContact N-CD2 3.5Å; S93-H237 PolarHBondContact N-NE2 3.41Å; S93-H237 PolarHBondContact O-CE1 2.86Å; S93-H237 PolarHBondContact O-ND1 2.86Å; S93-H237 VanDerWaalsContact O-ND1 3.16Å; S93-H237 PolarHBondContact O-NE2 3.3Å; S93-H237 VanDerWaalsContact O-NE2 3.16Å
94	I	45.4	Very low	39.8	Very low	7 Å²	7	89.3 Å²	89.3	4%	0.036	44%	0.438	C	S	.	.			trans	116.9	140.8	154.2	-63.2	-164.8	0	0	0	121.2	T230 H232 Y236 H237 S242	I94-T230 VanDerWaalsContact CD1-C 3.41Å; I94-T230 WeakPolarHBondContact CD1-O 3.37Å; I94-T230 VanDerWaalsContact CD1-OG1 3.28Å; I94-T230 WeakPolarHBondContact CD1-OG1 3.25Å; I94-H232 HydrophobicContact CD1-CB 3.53Å; I94-H232 WeakPolarHBondContact CD1-ND1 3.44Å; I94-H232 HydrophobicContact CG1-CB 3.59Å; I94-Y236 HydrophobicContact CG1-CE1 4.04Å; I94-H237 PolarHBondContact N-ND1 3.19Å; I94-H237 PolarHBondContact O-ND1 3.34Å; I94-S242 WeakPolarHBondContact O-CB 3.37Å; I94-S242 PolarHBondContact O-OG 2.69Å
95	N	35.8	Very low	38.7	Very low	74 Å²	74	89.1 Å²	89.1	40%	0.396	45%	0.451	S	S	.	.			trans	-123.2	163.2	145.9	-140.1	-21.6	0	0	0	115.6	D243	N95-D243 PolarHBondContact ND2-OD1 3.07Å
96	E	33	Very low	37.3	Very low	125 Å²	125	89 Å²	89	58%	0.584	46%	0.456	S	S	*	.			trans	-87.9	-166.7	-153	-118	-167.3	-166.1	0	0	117.8
97	P	35.7	Very low	36.1	Very low	83 Å²	83	92.5 Å²	92.5	54%	0.539	49%	0.486	S	S	.	.			cis	-147	173.6	-21.5	28.9	-4.2	0	0	0	120.1
98	R	23.5	Very low	34.8	Very low	229 Å²	229	97.8 Å²	97.8	86%	0.864	51%	0.509	S	S	*	.				135.1	127.7	125.8	-68.1	-164.7	176.5	167.9	2.3	122.5
99	Q	21.2	Very low	33.9	Very low	165 Å²	165	95.2 Å²	95.2	77%	0.771	50%	0.502	S	S	*	.			trans	82.1	113.1	139.8	-94.8	-171.2	9.8	0	0	125.7
100	K	21.3	Very low	33	Very low	183 Å²	183	97.8 Å²	97.8	80%	0.796	52%	0.515	S	S	*	.				42.3	149.3	128.8	-61.1	-178.7	-178.3	178.8	0	120.5
101	V	23.3	Very low	31.8	Very low	134 Å²	134	106.9 Å²	106.9	81%	0.812	55%	0.549	S	S	*	.			cis	-163.9	157.5	45.2	-142.2	0	0	0	0	115.5
102	S	26.1	Very low	31.1	Very low	110 Å²	110	109.1 Å²	109.1	77%	0.769	57%	0.566	S	S	*	*			trans	80.8	173.2	141.3	-142.8	0	0	0	0	122.3
103	F	28.2	Very low	30.9	Very low	167 Å²	167	112.4 Å²	112.4	73%	0.732	58%	0.581	S	S	*	*			trans	-158.8	169.8	-148.3	-135.9	-96.2	0	0	0	114.8
104	K	27.6	Very low	30.9	Very low	196 Å²	196	116.7 Å²	116.7	85%	0.852	60%	0.597	S	S	*	*			trans	86.4	93.8	166.6	-62.3	-177.6	176.2	177.4	0	119.4
105	S	28.3	Very low	30.5	Very low	106 Å²	106	125.2 Å²	125.2	74%	0.741	63%	0.634	S	S	*	*	S	Bend	trans	-154.8	-42	150.8	58.5	0	0	0	0	113	A107	S105-A107 VanDerWaalsContact C-N 3.29Å; S105-A107 PolarHBondContact O-N 3.03Å
106	V	28.2	Very low	30.4	Very low	52 Å²	52	128.9 Å²	128.9	32%	0.315	65%	0.647	S	S	.	*	G	3₁₀ helix	trans	-58.1	-21.1	-163.1	-164.5	0	0	0	0	117	N108 A109 I110	V106-N108 VanDerWaalsContact C-N 3.29Å; V106-N108 PolarHBondContact O-N 3.46Å; V106-A109 PolarHBondContact O-N 2.77Å; V106-I110 HydrophobicContact CG1-CD1 4.1Å; V106-I110 HydrophobicContact CG1-CG1 4.21Å
107	A	30.4	Very low	30.8	Very low	79 Å²	79	124.8 Å²	124.8	65%	0.653	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-56	-31.4	-163.4	0	0	0	0	0	116.2	S105	S105-A107 VanDerWaalsContact C-N 3.29Å; S105-A107 PolarHBondContact O-N 3.03Å
108	N	28	Very low	31.2	Very low	152 Å²	152	125.5 Å²	125.5	81%	0.813	64%	0.636	S	S	*	*	G	3₁₀ helix	trans	-88.5	-21.5	-175.8	-75.5	-13.9	0	0	0	114.5	V106	V106-N108 VanDerWaalsContact C-N 3.29Å; V106-N108 PolarHBondContact O-N 3.46Å
109	A	32.9	Very low	32	Very low	48 Å²	48	119 Å²	119	40%	0.397	63%	0.625	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70	-42.3	179.6	0	0	0	0	0	112	V106 R111 S112	V106-A109 PolarHBondContact O-N 2.77Å; A109-R111 PolarHBondContact O-N 2.93Å; A109-S112 PolarHBondContact O-N 3.17Å; A109-S112 PolarHBondContact O-OG 2.85Å; A109-S112 VanDerWaalsContact O-OG 3.06Å
110	I	35.2	Very low	33	Very low	53 Å²	53	119.1 Å²	119.1	27%	0.272	62%	0.623	S	S	.	*	H	α-helix	trans	-51.1	-32.4	-173.9	-62.7	164	0	0	0	113.2	V106 R114	V106-I110 HydrophobicContact CG1-CD1 4.1Å; V106-I110 HydrophobicContact CG1-CG1 4.21Å; I110-R114 PolarHBondContact O-N 2.9Å
111	R	33.1	Very low	34.6	Very low	223 Å²	223	111.7 Å²	111.7	84%	0.842	59%	0.592	S	S	*	*	H	α-helix	trans	-79.4	-29.5	-171.9	-162.2	171.1	-173.2	166.1	2.5	114	A109	A109-R111 PolarHBondContact O-N 2.93Å
112	S	36.2	Very low	36.9	Very low	89 Å²	89	113.7 Å²	113.7	62%	0.622	59%	0.585	S	S	*	*	H	α-helix	trans	-79.4	-34	174.3	46.3	0	0	0	0	112.3	A109	A109-S112 PolarHBondContact O-N 3.17Å; A109-S112 PolarHBondContact O-OG 2.85Å; A109-S112 VanDerWaalsContact O-OG 3.06Å
113	E	36.5	Very low	39.7	Very low	85 Å²	85	109 Å²	109	40%	0.397	55%	0.551	S	S	.	*	H	α-helix	trans	-71.2	-36.8	-176.6	-67.6	-176.2	162.9	0	0	112.8	K115 K116 L117	E113-K115 PolarHBondContact O-N 3.38Å; E113-K116 WeakPolarHBondContact O-CA 3.42Å; E113-K116 PolarHBondContact O-N 3.33Å; E113-L117 WeakPolarHBondContact O-CB 3.27Å; E113-L117 PolarHBondContact O-N 3.05Å
114	R	38.8	Very low	42.5	Very low	90 Å²	90	104.8 Å²	104.8	34%	0.34	54%	0.536	S	S	.	.	H	α-helix	trans	-45.1	-38.1	-178	-97.9	-177.6	158.8	149.7	-1.6	115.1	I110 S118 M147 E167	I110-R114 PolarHBondContact O-N 2.9Å; R114-S118 PolarHBondContact O-N 3.36Å; R114-S118 PolarHBondContact O-OG 2.69Å; R114-M147 PolarHBondContact NH2-SD 3.4Å; R114-E167 IonicContact CZ-OE1 3.64Å; R114-E167 IonicContact NH1-OE1 3.93Å; R114-E167 PolarHBondContact NH1-OE1 3.01Å; R114-E167 IonicContact NH2-OE1 3.94Å; R114-E167 PolarHBondContact NH2-OE1 3.17Å
115	K	36.9	Very low	45.5	Very low	186 Å²	186	98.9 Å²	98.9	81%	0.809	51%	0.514	S	S	*	.	H	α-helix	trans	-82.5	-21.5	178.6	-78.7	-166.8	173.6	-171.2	0	115.1	E113 S118	E113-K115 PolarHBondContact O-N 3.38Å; K115-S118 PolarHBondContact O-OG 3.29Å
116	K	35	Very low	48.5	Very low	152 Å²	152	94.2 Å²	94.2	66%	0.661	48%	0.48	S	S	*	.	H	α-helix	trans	-83.7	-45.3	170.5	-68.4	-174.9	177.5	-178.6	0	110.1	E113 S118 S119 F120	E113-K116 WeakPolarHBondContact O-CA 3.42Å; E113-K116 PolarHBondContact O-N 3.33Å; K116-S118 VanDerWaalsContact C-N 3.34Å; K116-S118 PolarHBondContact O-N 3.27Å; K116-S119 PolarHBondContact O-N 3.5Å; K116-S119 PolarHBondContact O-OG 2.98Å; K116-S119 VanDerWaalsContact O-OG 3.1Å; K116-F120 VanDerWaalsContact O-CD2 3.24Å; K116-F120 WeakPolarHBondContact O-CD2 3.48Å; K116-F120 PolarHBondContact O-N 3.02Å
117	L	40.6	Very low	51.5	Low	39 Å²	39	93.4 Å²	93.4	20%	0.204	47%	0.474	C	S	.	.	H	α-helix	trans	-57.7	-45.3	-176.5	-168.5	67.6	0	0	0	111.5	E113 S119 F120 I121 L133 C144	E113-L117 WeakPolarHBondContact O-CB 3.27Å; E113-L117 PolarHBondContact O-N 3.05Å; L117-S119 PolarHBondContact O-N 3.33Å; L117-S119 VanDerWaalsContact O-N 3.08Å; L117-F120 PolarHBondContact O-N 2.98Å; L117-I121 HydrophobicContact CD1-CD1 3.89Å; L117-I121 HydrophobicContact CD1-CG1 3.56Å; L117-I121 HydrophobicContact CD2-CD1 4.12Å; L117-I121 HydrophobicContact CG-CD1 3.61Å; L117-I121 HydrophobicContact CG-CG1 3.73Å; L117-I121 WeakPolarHBondContact O-CG1 3.26Å; L117-I121 PolarHBondContact O-N 2.94Å; L117-L133 HydrophobicContact CD1-CD1 4.09Å; L117-C144 HydrophobicContact CD2-CB 4.21Å
118	S	43.1	Very low	54.5	Low	98 Å²	98	90.7 Å²	90.7	69%	0.685	45%	0.448	S	S	*	.	H	α-helix	trans	-59.3	-22.4	-179.6	58.3	0	0	0	0	115.6	R114 K115 K116	R114-S118 PolarHBondContact O-N 3.36Å; R114-S118 PolarHBondContact O-OG 2.69Å; K115-S118 PolarHBondContact O-OG 3.29Å; K116-S118 VanDerWaalsContact C-N 3.34Å; K116-S118 PolarHBondContact O-N 3.27Å
119	S	40.8	Very low	57.7	Low	93 Å²	93	85.9 Å²	85.9	65%	0.65	42%	0.422	S	S	*	.	H	α-helix	trans	-103.6	-8.7	175.6	55.5	0	0	0	0	113.8	K116 L117	K116-S119 PolarHBondContact O-N 3.5Å; K116-S119 PolarHBondContact O-OG 2.98Å; K116-S119 VanDerWaalsContact O-OG 3.1Å; L117-S119 PolarHBondContact O-N 3.33Å; L117-S119 VanDerWaalsContact O-N 3.08Å
120	F	41.8	Very low	60.8	Low	166 Å²	166	83.7 Å²	83.7	73%	0.728	40%	0.403	S	S	*	.	H	α-helix	trans	-103.8	-29.8	-177.3	-87.8	-108	0	0	0	113.9	K116 L117 R122	K116-F120 VanDerWaalsContact O-CD2 3.24Å; K116-F120 WeakPolarHBondContact O-CD2 3.48Å; K116-F120 PolarHBondContact O-N 3.02Å; L117-F120 PolarHBondContact O-N 2.98Å; F120-R122 PolarHBondContact O-N 3.3Å
121	I	54.9	Low	63.7	Low	27 Å²	27	81.3 Å²	81.3	14%	0.138	39%	0.391	C	S	.	.			trans	-71.6	106.5	-177.7	-42.1	162.1	0	0	0	111.2	L117 I123 F128 L133 A148	L117-I121 HydrophobicContact CD1-CD1 3.89Å; L117-I121 HydrophobicContact CD1-CG1 3.56Å; L117-I121 HydrophobicContact CD2-CD1 4.12Å; L117-I121 HydrophobicContact CG-CD1 3.61Å; L117-I121 HydrophobicContact CG-CG1 3.73Å; L117-I121 WeakPolarHBondContact O-CG1 3.26Å; L117-I121 PolarHBondContact O-N 2.94Å; I121-I123 HydrophobicContact CB-CG2 4.17Å; I121-I123 HydrophobicContact CG2-CB 4.33Å; I121-I123 HydrophobicContact CG2-CG2 3.35Å; I121-I123 PolarHBondContact O-N 3.38Å; I121-F128 HydrophobicContact CG2-CD2 4.42Å; I121-F128 HydrophobicContact CG2-CE1 4.3Å; I121-F128 HydrophobicContact CG2-CE2 3.42Å; I121-F128 VanDerWaalsContact CG2-CE2 3.42Å; I121-F128 HydrophobicContact CG2-CZ 3.36Å; I121-L133 HydrophobicContact CG1-CD1 4.45Å; I121-A148 HydrophobicContact CD1-CB 3.96Å
122	R	72.5	Confident	66.6	Low	177 Å²	177	76.1 Å²	76.1	67%	0.668	38%	0.376	S	S	*	.			trans	-77	50.7	169.9	-64.1	-177.7	174.4	-178.4	-2.9	112.4	F120 N124 N125 F128	F120-R122 PolarHBondContact O-N 3.3Å; R122-N124 PolarHBondContact O-N 3Å; R122-N125 WeakPolarHBondContact O-CB 3.41Å; R122-N125 PolarHBondContact O-N 3.34Å; R122-F128 HydrophobicContact CB-CD2 4.46Å; R122-F128 WeakPolarHBondContact O-CD2 3.42Å
123	I	84.1	Confident	69.3	Low	11 Å²	11	72 Å²	72	6%	0.056	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-14.9	178.7	49.7	166.2	0	0	0	114.3	I121 N125 A148 L149 Q195 H198	I121-I123 HydrophobicContact CB-CG2 4.17Å; I121-I123 HydrophobicContact CG2-CB 4.33Å; I121-I123 HydrophobicContact CG2-CG2 3.35Å; I121-I123 PolarHBondContact O-N 3.38Å; I123-N125 VanDerWaalsContact C-N 3.29Å; I123-A148 HydrophobicContact CD1-CB 4.25Å; I123-L149 HydrophobicContact CD1-CD2 3.67Å; I123-Q195 HydrophobicContact CB-CG 4.37Å; I123-Q195 HydrophobicContact CG2-CG 4.34Å; I123-Q195 PolarHBondContact O-NE2 3.49Å; I123-H198 PolarHBondContact O-CD2 3.05Å
124	N	86.7	Confident	72.1	Confident	78 Å²	78	68.7 Å²	68.7	42%	0.417	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.3	14.9	178.3	-43.6	-70.9	0	0	0	112.9	R122 K152 H198 W199	R122-N124 PolarHBondContact O-N 3Å; N124-K152 PolarHBondContact OD1-NZ 3.08Å; N124-H198 PolarHBondContact OD1-NE2 2.89Å; N124-W199 VanDerWaalsContact C-CD1 3.48Å; N124-W199 PolarHBondContact O-NE1 3.49Å
125	N	90.6	Very high	74.6	Confident	72 Å²	72	69.9 Å²	69.9	39%	0.385	34%	0.342	S	S	.	.			trans	-103.8	140.7	174	-72.1	14.9	0	0	0	110.9	R122 I123 Q195 W199	R122-N125 WeakPolarHBondContact O-CB 3.41Å; R122-N125 PolarHBondContact O-N 3.34Å; I123-N125 VanDerWaalsContact C-N 3.29Å; N125-Q195 PolarHBondContact O-NE2 3.39Å; N125-W199 VanDerWaalsContact C-CD1 3.46Å
126	W	92.8	Very high	77.2	Confident	9 Å²	9	65.7 Å²	65.7	3%	0.034	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-48.8	173.1	-179	-104.6	0	0	0	112.2	F128 T196 W199 L200 A338 M396 P437 W438	W126-F128 PolarHBondContact O-N 3.21Å; W126-T196 HydrophobicContact CE3-CG2 4.16Å; W126-T196 HydrophobicContact CH2-CG2 3.76Å; W126-T196 HydrophobicContact CZ3-CG2 3.43Å; W126-T196 VanDerWaalsContact CZ3-CG2 3.43Å; W126-W199 HydrophobicContact CB-CD2 4.26Å; W126-W199 HydrophobicContact CB-CZ2 4.03Å; W126-W199 HydrophobicContact CD2-CE3 4.28Å; W126-W199 HydrophobicContact CD2-CZ3 4.35Å; W126-W199 AromaticContact CE3-CD2 3.64Å; W126-W199 HydrophobicContact CE3-CD2 3.64Å; W126-W199 AromaticContact CE3-CE3 3.24Å; W126-W199 HydrophobicContact CE3-CE3 3.24Å; W126-W199 HydrophobicContact CE3-CG 4.23Å; W126-W199 HydrophobicContact CE3-CH2 4.23Å; W126-W199 AromaticContact CE3-CZ3 3.59Å; W126-W199 HydrophobicContact CE3-CZ3 3.59Å; W126-W199 HydrophobicContact CZ3-CD2 4.39Å; W126-W199 AromaticContact CZ3-CE3 3.62Å; W126-W199 HydrophobicContact CZ3-CE3 3.62Å; W126-W199 AromaticContact CZ3-CZ3 3.92Å; W126-W199 HydrophobicContact CZ3-CZ3 3.92Å; W126-L200 HydrophobicContact CH2-CD2 4.31Å; W126-L200 HydrophobicContact CZ3-CD2 3.81Å; W126-L200 HydrophobicContact CZ3-CG 4.11Å; W126-A338 HydrophobicContact CZ2-CB 3.86Å; W126-A338 PolarHBondContact NE1-O 2.86Å; W126-M396 HydrophobicContact CH2-CE 3.92Å; W126-M396 HydrophobicContact CZ2-CE 4.13Å; W126-P437 HydrophobicContact CB-CB 4.43Å; W126-P437 HydrophobicContact CB-CG 3.88Å; W126-P437 HydrophobicContact CG-CB 4.04Å; W126-P437 HydrophobicContact CG-CG 3.85Å; W126-W438 HydrophobicContact CD2-CZ3 4.49Å; W126-W438 HydrophobicContact CE3-CZ3 4.35Å; W126-W438 HydrophobicContact CH2-CE3 4.1Å; W126-W438 AromaticContact CH2-CZ3 3.98Å; W126-W438 HydrophobicContact CH2-CZ3 3.98Å; W126-W438 AromaticContact CZ2-CE3 3.84Å; W126-W438 HydrophobicContact CZ2-CE3 3.84Å; W126-W438 HydrophobicContact CZ2-CZ3 4.15Å; W126-W438 HydrophobicContact CZ3-CZ3 4.08Å
127	D	91.5	Very high	79.8	Confident	35 Å²	35	58.9 Å²	58.9	19%	0.187	30%	0.299	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.4	56.4	173.7	-59.4	-63.9	0	0	0	110.9	K340 F343	D127-K340 HydrophobicContact CB-CD 4.1Å; D127-K340 HydrophobicContact CB-CG 4.38Å; D127-K340 VanDerWaalsContact CG-NZ 3.29Å; D127-K340 WeakPolarHBondContact OD1-CB 3.48Å; D127-K340 VanDerWaalsContact OD1-CG 3.3Å; D127-K340 WeakPolarHBondContact OD1-CG 3.23Å; D127-K340 PolarHBondContact OD1-N 3.32Å; D127-K340 IonicContact OD2-NZ 3.23Å; D127-K340 PolarHBondContact OD2-NZ 2.98Å; D127-F343 HydrophobicContact CB-CE2 4.16Å
128	F	92.8	Very high	82.3	Confident	22 Å²	22	61.5 Å²	61.5	10%	0.096	31%	0.313	C	S	.	.			trans	-78.4	129.8	171.3	179.3	-101.9	0	0	0	109.9	I121 R122 W126 I130 L133 Q195	I121-F128 HydrophobicContact CG2-CD2 4.42Å; I121-F128 HydrophobicContact CG2-CE1 4.3Å; I121-F128 HydrophobicContact CG2-CE2 3.42Å; I121-F128 VanDerWaalsContact CG2-CE2 3.42Å; I121-F128 HydrophobicContact CG2-CZ 3.36Å; R122-F128 HydrophobicContact CB-CD2 4.46Å; R122-F128 WeakPolarHBondContact O-CD2 3.42Å; W126-F128 PolarHBondContact O-N 3.21Å; F128-I130 HydrophobicContact CD1-CB 4.46Å; F128-I130 HydrophobicContact CD1-CD1 4.14Å; F128-I130 HydrophobicContact CE1-CD1 3.9Å; F128-I130 PolarHBondContact O-N 3.44Å; F128-L133 HydrophobicContact CE1-CB 3.89Å; F128-L133 HydrophobicContact CE1-CD2 3.74Å; F128-L133 HydrophobicContact CE1-CG 4.4Å; F128-L133 HydrophobicContact CZ-CB 3.87Å; F128-L133 HydrophobicContact CZ-CD2 3.88Å; F128-L133 HydrophobicContact CZ-CG 4.3Å; F128-Q195 HydrophobicContact CB-CG 4.28Å; F128-Q195 HydrophobicContact CD1-CG 3.93Å; F128-Q195 HydrophobicContact CG-CG 4.23Å
129	D	95.3	Very high	84.7	Confident	50 Å²	50	61.2 Å²	61.2	27%	0.267	30%	0.304	S	S	.	.			trans	-80.5	85.6	-179.2	-165.4	-22.2	0	0	0	110.7	F131 Q132 L133 F343	D129-F131 PolarHBondContact O-N 3.02Å; D129-F131 PolarHBondContact OD1-N 3.2Å; D129-Q132 HydrophobicContact CB-CB 3.87Å; D129-Q132 PolarHBondContact O-N 3.19Å; D129-Q132 WeakPolarHBondContact OD1-CB 3.38Å; D129-Q132 PolarHBondContact OD1-N 2.96Å; D129-L133 PolarHBondContact O-N 3.3Å; D129-F343 HydrophobicContact CB-CE1 3.96Å; D129-F343 HydrophobicContact CB-CZ 3.73Å; D129-F343 VanDerWaalsContact CG-CE1 3.46Å
130	I	96.9	Very high	87.3	Confident	2 Å²	2	58 Å²	58	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-64.5	-28.2	179	-160.8	64.9	0	0	0	112.6	F128 L133 N134 A141 V145 V188 A191 D192 W347	F128-I130 HydrophobicContact CD1-CB 4.46Å; F128-I130 HydrophobicContact CD1-CD1 4.14Å; F128-I130 HydrophobicContact CE1-CD1 3.9Å; F128-I130 PolarHBondContact O-N 3.44Å; I130-L133 HydrophobicContact CD1-CD2 4.18Å; I130-L133 PolarHBondContact O-N 3.19Å; I130-N134 PolarHBondContact O-N 3.36Å; I130-A141 HydrophobicContact CD1-CB 4.5Å; I130-V145 HydrophobicContact CD1-CG2 3.94Å; I130-V188 HydrophobicContact CG1-CG1 4.17Å; I130-V188 HydrophobicContact CG2-CG1 4.12Å; I130-A191 HydrophobicContact CD1-CB 3.7Å; I130-A191 HydrophobicContact CG1-CB 4.03Å; I130-D192 HydrophobicContact CB-CB 4.23Å; I130-D192 HydrophobicContact CG1-CB 3.96Å; I130-D192 HydrophobicContact CG2-CB 3.95Å; I130-W347 HydrophobicContact CG2-CZ2 4.06Å
131	F	96.6	Very high	89.9	Confident	4 Å²	4	50.1 Å²	50.1	2%	0.018	25%	0.245	C	C	.	.	H	α-helix	trans	-73.8	-45	178.3	-60.3	-70.7	0	0	0	110.9	D129 L133 N134 E135 V188 F343 R346 W347	D129-F131 PolarHBondContact O-N 3.02Å; D129-F131 PolarHBondContact OD1-N 3.2Å; F131-L133 VanDerWaalsContact C-N 3.27Å; F131-L133 PolarHBondContact O-N 3.15Å; F131-N134 WeakPolarHBondContact O-CA 3.48Å; F131-N134 WeakPolarHBondContact O-CB 3.44Å; F131-N134 PolarHBondContact O-N 3.05Å; F131-E135 WeakPolarHBondContact O-CB 3.17Å; F131-E135 VanDerWaalsContact O-CG 3.3Å; F131-E135 WeakPolarHBondContact O-CG 3.45Å; F131-E135 PolarHBondContact O-N 2.63Å; F131-V188 HydrophobicContact CD1-CG1 3.94Å; F131-V188 HydrophobicContact CE1-CG1 4.14Å; F131-F343 HydrophobicContact CD2-CD1 4.11Å; F131-F343 HydrophobicContact CE2-CB 4.41Å; F131-F343 HydrophobicContact CE2-CD1 4.37Å; F131-R346 HydrophobicContact CD1-CG 4.44Å; F131-R346 VanDerWaalsContact CD1-CZ 3.44Å; F131-R346 HydrophobicContact CD2-CG 4.47Å; F131-R346 HydrophobicContact CE1-CG 3.94Å; F131-R346 HydrophobicContact CE2-CB 4.04Å; F131-R346 HydrophobicContact CE2-CG 3.97Å; F131-R346 HydrophobicContact CZ-CB 4.06Å; F131-R346 HydrophobicContact CZ-CG 3.66Å; F131-W347 HydrophobicContact CE1-CD2 4.39Å; F131-W347 HydrophobicContact CE1-CE3 4.47Å; F131-W347 AromaticContact CE1-CH2 3.76Å; F131-W347 HydrophobicContact CE1-CH2 3.76Å; F131-W347 AromaticContact CE1-CZ2 3.74Å; F131-W347 HydrophobicContact CE1-CZ2 3.74Å; F131-W347 HydrophobicContact CE1-CZ3 4.17Å; F131-W347 HydrophobicContact CE2-CZ2 4.36Å; F131-W347 AromaticContact CZ-CD2 3.64Å; F131-W347 HydrophobicContact CZ-CD2 3.64Å; F131-W347 AromaticContact CZ-CE2 3.36Å; F131-W347 HydrophobicContact CZ-CE3 4.12Å; F131-W347 HydrophobicContact CZ-CG 4.09Å; F131-W347 AromaticContact CZ-CH2 3.94Å; F131-W347 HydrophobicContact CZ-CH2 3.94Å; F131-W347 AromaticContact CZ-CZ2 3.53Å; F131-W347 HydrophobicContact CZ-CZ2 3.53Å; F131-W347 HydrophobicContact CZ-CZ3 4.24Å; F131-W347 AromaticContact CZ-NE1 3.76Å
132	Q	94.5	Very high	91.9	Very high	113 Å²	113	48.8 Å²	48.8	53%	0.528	24%	0.238	S	C	.	.	H	α-helix	trans	-58.7	-40.3	169.9	-179.5	171.5	102.4	0	0	111.1	D129 N134 E135 I136	D129-Q132 HydrophobicContact CB-CB 3.87Å; D129-Q132 PolarHBondContact O-N 3.19Å; D129-Q132 WeakPolarHBondContact OD1-CB 3.38Å; D129-Q132 PolarHBondContact OD1-N 2.96Å; Q132-N134 VanDerWaalsContact C-N 3.31Å; Q132-N134 PolarHBondContact O-N 3.23Å; Q132-E135 PolarHBondContact O-N 2.81Å; Q132-I136 HydrophobicContact CG-CG2 4.32Å; Q132-I136 WeakPolarHBondContact O-CG1 3.49Å; Q132-I136 WeakPolarHBondContact O-CG2 3.11Å; Q132-I136 PolarHBondContact O-N 3.36Å
133	L	91.9	Very high	93	Very high	4 Å²	4	41.9 Å²	41.9	2%	0.021	21%	0.213	C	C	.	.	H	α-helix	trans	-60.6	-40.8	173.3	-176.9	62.1	0	0	0	111.8	L117 I121 F128 D129 I130 F131 I136 S137 C144 V145	L117-L133 HydrophobicContact CD1-CD1 4.09Å; I121-L133 HydrophobicContact CG1-CD1 4.45Å; F128-L133 HydrophobicContact CE1-CB 3.89Å; F128-L133 HydrophobicContact CE1-CD2 3.74Å; F128-L133 HydrophobicContact CE1-CG 4.4Å; F128-L133 HydrophobicContact CZ-CB 3.87Å; F128-L133 HydrophobicContact CZ-CD2 3.88Å; F128-L133 HydrophobicContact CZ-CG 4.3Å; D129-L133 PolarHBondContact O-N 3.3Å; I130-L133 HydrophobicContact CD1-CD2 4.18Å; I130-L133 PolarHBondContact O-N 3.19Å; F131-L133 VanDerWaalsContact C-N 3.27Å; F131-L133 PolarHBondContact O-N 3.15Å; L133-I136 HydrophobicContact CD1-CD1 4.28Å; L133-I136 HydrophobicContact CD1-CG1 4.38Å; L133-S137 VanDerWaalsContact O-CB 3.22Å; L133-S137 WeakPolarHBondContact O-CB 3.29Å; L133-S137 PolarHBondContact O-N 2.9Å; L133-S137 VanDerWaalsContact O-N 3.15Å; L133-S137 PolarHBondContact O-OG 2.91Å; L133-C144 HydrophobicContact CD1-CB 4.11Å; L133-C144 HydrophobicContact CD2-CB 4.08Å; L133-C144 HydrophobicContact CG-CB 4.3Å; L133-V145 HydrophobicContact CD2-CG2 3.63Å
134	N	95.3	Very high	93.5	Very high	14 Å²	14	42.1 Å²	42.1	8%	0.075	22%	0.215	C	C	.	.	H	α-helix	trans	-64.9	-43.3	177.7	-165.5	63.2	0	0	0	112.5	I130 F131 Q132 S137 D138 N139 A141 M187 V188	I130-N134 PolarHBondContact O-N 3.36Å; F131-N134 WeakPolarHBondContact O-CA 3.48Å; F131-N134 WeakPolarHBondContact O-CB 3.44Å; F131-N134 PolarHBondContact O-N 3.05Å; Q132-N134 VanDerWaalsContact C-N 3.31Å; Q132-N134 PolarHBondContact O-N 3.23Å; N134-S137 PolarHBondContact O-N 2.86Å; N134-S137 PolarHBondContact O-OG 3.19Å; N134-D138 PolarHBondContact O-N 2.88Å; N134-N139 PolarHBondContact ND2-OD1 2.91Å; N134-N139 PolarHBondContact O-N 3.32Å; N134-N139 WeakPolarHBondContact OD1-CA 3.35Å; N134-A141 HydrophobicContact CB-CB 3.85Å; N134-A141 WeakPolarHBondContact OD1-CB 3.37Å; N134-M187 VanDerWaalsContact OD1-CE 3.26Å; N134-M187 WeakPolarHBondContact OD1-CE 3.48Å; N134-V188 HydrophobicContact CB-CG1 4.3Å; N134-V188 HydrophobicContact CB-CG2 4.05Å; N134-V188 VanDerWaalsContact CG-CG2 3.49Å
135	E	92.9	Very high	93.9	Very high	116 Å²	116	38.4 Å²	38.4	54%	0.542	20%	0.196	S	C	.	.	H	α-helix	trans	-67.6	-42	-179	-70.1	163.1	-156.3	0	0	111.5	F131 Q132 S137 R346	F131-E135 WeakPolarHBondContact O-CB 3.17Å; F131-E135 VanDerWaalsContact O-CG 3.3Å; F131-E135 WeakPolarHBondContact O-CG 3.45Å; F131-E135 PolarHBondContact O-N 2.63Å; Q132-E135 PolarHBondContact O-N 2.81Å; E135-S137 VanDerWaalsContact C-N 3.34Å; E135-S137 PolarHBondContact O-N 3.43Å; E135-R346 IonicContact OE1-CZ 3.53Å; E135-R346 IonicContact OE1-NH1 2.88Å; E135-R346 PolarHBondContact OE1-NH1 2.96Å; E135-R346 IonicContact OE1-NH2 3.5Å; E135-R346 PolarHBondContact OE1-NH2 2.92Å
136	I	91.2	Very high	94.3	Very high	97 Å²	97	35 Å²	35	50%	0.497	18%	0.177	S	C	.	.	H	α-helix	trans	-77.7	-13.2	176.7	72.3	-174.4	0	0	0	114.5	Q132 L133	Q132-I136 HydrophobicContact CG-CG2 4.32Å; Q132-I136 WeakPolarHBondContact O-CG1 3.49Å; Q132-I136 WeakPolarHBondContact O-CG2 3.11Å; Q132-I136 PolarHBondContact O-N 3.36Å; L133-I136 HydrophobicContact CD1-CD1 4.28Å; L133-I136 HydrophobicContact CD1-CG1 4.38Å
137	S	89.9	Confident	94.4	Very high	9 Å²	9	36.6 Å²	36.6	6%	0.063	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.9	11.5	-178.6	64.9	0	0	0	0	114.1	L133 N134 E135 N139 N140 A141 C144	L133-S137 VanDerWaalsContact O-CB 3.22Å; L133-S137 WeakPolarHBondContact O-CB 3.29Å; L133-S137 PolarHBondContact O-N 2.9Å; L133-S137 VanDerWaalsContact O-N 3.15Å; L133-S137 PolarHBondContact O-OG 2.91Å; N134-S137 PolarHBondContact O-N 2.86Å; N134-S137 PolarHBondContact O-OG 3.19Å; E135-S137 VanDerWaalsContact C-N 3.34Å; E135-S137 PolarHBondContact O-N 3.43Å; S137-N139 PolarHBondContact O-N 3.32Å; S137-N140 WeakPolarHBondContact O-CB 3.43Å; S137-N140 PolarHBondContact O-N 3.42Å; S137-N140 PolarHBondContact O-ND2 3.48Å; S137-N140 PolarHBondContact OG-N 2.92Å; S137-A141 PolarHBondContact OG-N 3.26Å; S137-C144 VanDerWaalsContact CB-SG 3.57Å
138	D	92.4	Very high	94.4	Very high	95 Å²	95	36.3 Å²	36.3	51%	0.508	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.4	59.6	-174.1	-173.9	23.2	0	0	0	111.8	N134 N140	N134-D138 PolarHBondContact O-N 2.88Å; D138-N140 PolarHBondContact O-ND2 3.32Å
139	N	93.9	Very high	94.5	Very high	91 Å²	91	35.2 Å²	35.2	49%	0.487	18%	0.183	S	C	.	.	S	Bend	trans	63.7	42.5	177.8	-57.7	-78.7	0	0	0	114.3	N134 S137 M187	N134-N139 PolarHBondContact ND2-OD1 2.91Å; N134-N139 PolarHBondContact O-N 3.32Å; N134-N139 WeakPolarHBondContact OD1-CA 3.35Å; S137-N139 PolarHBondContact O-N 3.32Å; N139-M187 HydrophobicContact CB-CE 3.78Å; N139-M187 VanDerWaalsContact O-CE 3.31Å; N139-M187 WeakPolarHBondContact O-CE 3.39Å
140	N	95	Very high	94.6	Very high	26 Å²	26	32.9 Å²	32.9	14%	0.139	17%	0.171	C	C	.	.			trans	-125.6	30	176.4	-68.7	-86.2	0	0	0	113.4	S137 D138 L142 K143 C144 Q174	S137-N140 WeakPolarHBondContact O-CB 3.43Å; S137-N140 PolarHBondContact O-N 3.42Å; S137-N140 PolarHBondContact O-ND2 3.48Å; S137-N140 PolarHBondContact OG-N 2.92Å; D138-N140 PolarHBondContact O-ND2 3.32Å; N140-L142 PolarHBondContact O-N 3.47Å; N140-K143 HydrophobicContact CB-CB 4.25Å; N140-K143 HydrophobicContact CB-CD 4.48Å; N140-K143 PolarHBondContact O-N 3.05Å; N140-C144 WeakPolarHBondContact O-CB 3.15Å; N140-C144 PolarHBondContact O-N 3.24Å; N140-C144 PolarHBondContact O-SG 2.9Å; N140-C144 VanDerWaalsContact O-SG 3.34Å; N140-Q174 PolarHBondContact OD1-NE2 3.18Å
141	A	95.4	Very high	94.3	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-52	-51.4	-177.6	0	0	0	0	0	112.9	I130 N134 S137 K143 C144 V145 A191	I130-A141 HydrophobicContact CD1-CB 4.5Å; N134-A141 HydrophobicContact CB-CB 3.85Å; N134-A141 WeakPolarHBondContact OD1-CB 3.37Å; S137-A141 PolarHBondContact OG-N 3.26Å; A141-K143 PolarHBondContact O-N 2.93Å; A141-C144 WeakPolarHBondContact O-CB 3.26Å; A141-C144 PolarHBondContact O-N 2.99Å; A141-C144 VanDerWaalsContact O-N 3.17Å; A141-V145 WeakPolarHBondContact O-CG2 3.49Å; A141-V145 PolarHBondContact O-N 2.8Å; A141-A191 HydrophobicContact CB-CB 3.84Å
142	L	97.8	Very high	94.1	Very high	0 Å²	0	39.9 Å²	39.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-59.9	-45.9	179.7	-177.6	57	0	0	0	112	N140 C144 V145 A146 L173 Q174 Y177 M187 A190 A191 M223	N140-L142 PolarHBondContact O-N 3.47Å; L142-C144 VanDerWaalsContact C-N 3.32Å; L142-C144 PolarHBondContact O-N 2.91Å; L142-V145 PolarHBondContact O-N 2.85Å; L142-A146 WeakPolarHBondContact O-CB 3.4Å; L142-A146 PolarHBondContact O-N 3.35Å; L142-L173 HydrophobicContact CD2-CD2 3.69Å; L142-L173 HydrophobicContact CD2-CG 3.81Å; L142-L173 HydrophobicContact CG-CD2 4.23Å; L142-Q174 HydrophobicContact CB-CG 4.14Å; L142-Q174 HydrophobicContact CD2-CG 4.25Å; L142-Y177 HydrophobicContact CD2-CD2 3.91Å; L142-Y177 HydrophobicContact CD2-CE2 3.89Å; L142-M187 HydrophobicContact CB-CB 4.19Å; L142-M187 WeakPolarHBondContact CB-O 3.36Å; L142-M187 HydrophobicContact CD2-CB 4.1Å; L142-A190 HydrophobicContact CD1-CB 4.19Å; L142-A190 HydrophobicContact CD2-CB 4.14Å; L142-A191 HydrophobicContact CB-CB 4.02Å; L142-A191 HydrophobicContact CD1-CB 4.35Å; L142-M223 HydrophobicContact CD1-CB 4.28Å; L142-M223 HydrophobicContact CD1-CG 4.1Å
143	K	95.5	Very high	94	Very high	31 Å²	31	35.2 Å²	35.2	14%	0.135	19%	0.193	C	C	.	.	H	α-helix	trans	-63.9	-35.9	176.9	179.5	174.8	-173.7	172	0	112.3	N140 A141 M147 L170 S171	N140-K143 HydrophobicContact CB-CB 4.25Å; N140-K143 HydrophobicContact CB-CD 4.48Å; N140-K143 PolarHBondContact O-N 3.05Å; A141-K143 PolarHBondContact O-N 2.93Å; K143-M147 WeakPolarHBondContact O-CB 3.1Å; K143-M147 WeakPolarHBondContact O-CG 3.34Å; K143-M147 PolarHBondContact O-N 2.88Å; K143-L170 HydrophobicContact CB-CB 4.29Å; K143-L170 HydrophobicContact CB-CD1 4.41Å; K143-L170 HydrophobicContact CD-CB 4.49Å; K143-L170 HydrophobicContact CG-CB 4.08Å; K143-L170 HydrophobicContact CG-CD1 3.97Å; K143-S171 PolarHBondContact NZ-OG 3.22Å
144	C	94.8	Very high	94.2	Very high	17 Å²	17	38.5 Å²	38.5	12%	0.115	21%	0.21	C	C	.	.	H	α-helix	trans	-69.4	-46.5	175.6	-74	0	0	0	0	112.4	L117 L133 S137 N140 A141 L142 A148	L117-C144 HydrophobicContact CD2-CB 4.21Å; L133-C144 HydrophobicContact CD1-CB 4.11Å; L133-C144 HydrophobicContact CD2-CB 4.08Å; L133-C144 HydrophobicContact CG-CB 4.3Å; S137-C144 VanDerWaalsContact CB-SG 3.57Å; N140-C144 WeakPolarHBondContact O-CB 3.15Å; N140-C144 PolarHBondContact O-N 3.24Å; N140-C144 PolarHBondContact O-SG 2.9Å; N140-C144 VanDerWaalsContact O-SG 3.34Å; A141-C144 WeakPolarHBondContact O-CB 3.26Å; A141-C144 PolarHBondContact O-N 2.99Å; A141-C144 VanDerWaalsContact O-N 3.17Å; L142-C144 VanDerWaalsContact C-N 3.32Å; L142-C144 PolarHBondContact O-N 2.91Å; C144-A148 WeakPolarHBondContact O-CB 3.4Å; C144-A148 PolarHBondContact O-N 2.87Å
145	V	96.1	Very high	94.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-62.1	-51.8	175	174.9	0	0	0	0	110.3	I130 L133 A141 L142 M147 A148 L149 A191 T194 Q195	I130-V145 HydrophobicContact CD1-CG2 3.94Å; L133-V145 HydrophobicContact CD2-CG2 3.63Å; A141-V145 WeakPolarHBondContact O-CG2 3.49Å; A141-V145 PolarHBondContact O-N 2.8Å; L142-V145 PolarHBondContact O-N 2.85Å; V145-M147 PolarHBondContact O-N 3Å; V145-A148 WeakPolarHBondContact O-CB 3.34Å; V145-A148 PolarHBondContact O-N 3.33Å; V145-L149 HydrophobicContact CG1-CD1 3.76Å; V145-L149 HydrophobicContact CG1-CG 4.25Å; V145-L149 WeakPolarHBondContact O-CG 3.32Å; V145-L149 PolarHBondContact O-N 3.03Å; V145-A191 HydrophobicContact CG2-CB 4.26Å; V145-T194 HydrophobicContact CG1-CG2 3.65Å; V145-Q195 HydrophobicContact CG1-CB 4.17Å; V145-Q195 HydrophobicContact CG2-CB 4.48Å
146	A	97.4	Very high	94.5	Very high	0 Å²	0	33.7 Å²	33.7	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59.8	-43.1	179.8	0	0	0	0	0	112.5	L142 A148 L149 F150 F166 L170 M223	L142-A146 WeakPolarHBondContact O-CB 3.4Å; L142-A146 PolarHBondContact O-N 3.35Å; A146-A148 VanDerWaalsContact C-N 3.32Å; A146-A148 PolarHBondContact O-N 3.28Å; A146-L149 PolarHBondContact O-N 3.06Å; A146-F150 VanDerWaalsContact O-CB 3.32Å; A146-F150 WeakPolarHBondContact O-CB 3.35Å; A146-F150 VanDerWaalsContact O-CD2 3.24Å; A146-F150 WeakPolarHBondContact O-CD2 3.29Å; A146-F150 PolarHBondContact O-N 3.32Å; A146-F166 HydrophobicContact CB-CZ 4.18Å; A146-L170 HydrophobicContact CB-CD1 4.04Å; A146-L170 HydrophobicContact CB-CD2 3.52Å; A146-L170 HydrophobicContact CB-CG 4.45Å; A146-M223 HydrophobicContact CB-CE 3.6Å; A146-M223 HydrophobicContact CB-SD 3.51Å; A146-M223 VanDerWaalsContact CB-SD 3.51Å
147	M	95.1	Very high	94.8	Very high	42 Å²	42	34.7 Å²	34.7	21%	0.207	19%	0.194	C	C	.	.	H	α-helix	trans	-60.3	-39.2	173.7	-81.5	-67.1	-24.8	0	0	112.8	R114 K143 V145 G151 L163 F166 L170	R114-M147 PolarHBondContact NH2-SD 3.4Å; K143-M147 WeakPolarHBondContact O-CB 3.1Å; K143-M147 WeakPolarHBondContact O-CG 3.34Å; K143-M147 PolarHBondContact O-N 2.88Å; V145-M147 PolarHBondContact O-N 3Å; M147-G151 PolarHBondContact O-N 3.26Å; M147-L163 HydrophobicContact CE-CD1 3.99Å; M147-L163 HydrophobicContact SD-CD1 4Å; M147-F166 HydrophobicContact CE-CE1 4.5Å; M147-F166 HydrophobicContact CG-CE1 4.4Å; M147-F166 HydrophobicContact SD-CD1 3.8Å; M147-F166 HydrophobicContact SD-CE1 3.68Å; M147-L170 HydrophobicContact CG-CD1 4.13Å; M147-L170 HydrophobicContact SD-CD1 4.45Å
148	A	92.6	Very high	95.2	Very high	29 Å²	29	37.9 Å²	37.9	24%	0.24	21%	0.207	C	C	.	.	H	α-helix	trans	-69	-42.8	178.1	0	0	0	0	0	111.9	I121 I123 C144 V145 A146 G151 K152	I121-A148 HydrophobicContact CD1-CB 3.96Å; I123-A148 HydrophobicContact CD1-CB 4.25Å; C144-A148 WeakPolarHBondContact O-CB 3.4Å; C144-A148 PolarHBondContact O-N 2.87Å; V145-A148 WeakPolarHBondContact O-CB 3.34Å; V145-A148 PolarHBondContact O-N 3.33Å; A146-A148 VanDerWaalsContact C-N 3.32Å; A146-A148 PolarHBondContact O-N 3.28Å; A148-G151 PolarHBondContact O-N 2.96Å; A148-K152 WeakPolarHBondContact O-CB 3.42Å; A148-K152 PolarHBondContact O-N 3.18Å
149	L	95.2	Very high	95.4	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-73.9	-42.2	-178.5	-63.5	179.6	0	0	0	113.1	I123 V145 A146 G151 K152 Y153 T194 H198 I219	I123-L149 HydrophobicContact CD1-CD2 3.67Å; V145-L149 HydrophobicContact CG1-CD1 3.76Å; V145-L149 HydrophobicContact CG1-CG 4.25Å; V145-L149 WeakPolarHBondContact O-CG 3.32Å; V145-L149 PolarHBondContact O-N 3.03Å; A146-L149 PolarHBondContact O-N 3.06Å; L149-G151 PolarHBondContact O-N 3.42Å; L149-K152 PolarHBondContact O-N 2.95Å; L149-K152 VanDerWaalsContact O-N 3.16Å; L149-Y153 HydrophobicContact CB-CD2 4.48Å; L149-Y153 HydrophobicContact CD2-CE2 4.24Å; L149-Y153 WeakPolarHBondContact O-CD2 3.45Å; L149-Y153 PolarHBondContact O-N 3.21Å; L149-T194 HydrophobicContact CD1-CG2 3.59Å; L149-H198 HydrophobicContact CD1-CB 3.91Å; L149-H198 HydrophobicContact CD2-CB 3.86Å; L149-H198 WeakPolarHBondContact CD2-ND1 3.24Å; L149-I219 HydrophobicContact CB-CG2 4.21Å; L149-I219 HydrophobicContact CD1-CD1 4.45Å; L149-I219 HydrophobicContact CD1-CG2 3.96Å
150	F	96.3	Very high	95.6	Very high	1 Å²	1	37.5 Å²	37.5	0%	0.004	20%	0.196	C	C	.	.	H	α-helix	trans	-65.5	-27.6	174.6	-82.2	-123.3	0	0	0	111.9	A146 N154 F155 L156 I161 F166 F216 I219 M223 I274	A146-F150 VanDerWaalsContact O-CB 3.32Å; A146-F150 WeakPolarHBondContact O-CB 3.35Å; A146-F150 VanDerWaalsContact O-CD2 3.24Å; A146-F150 WeakPolarHBondContact O-CD2 3.29Å; A146-F150 PolarHBondContact O-N 3.32Å; F150-N154 WeakPolarHBondContact O-CA 3.4Å; F150-N154 PolarHBondContact O-N 2.97Å; F150-F155 HydrophobicContact CB-CD2 4.28Å; F150-F155 HydrophobicContact CD1-CB 3.86Å; F150-F155 AromaticContact CD1-CD2 3.92Å; F150-F155 HydrophobicContact CD1-CD2 3.92Å; F150-F155 HydrophobicContact CD1-CG 4.42Å; F150-F155 AromaticContact CD2-CD2 3.75Å; F150-F155 HydrophobicContact CD2-CD2 3.75Å; F150-F155 HydrophobicContact CD2-CE2 4.27Å; F150-F155 HydrophobicContact CE1-CB 4.33Å; F150-F155 HydrophobicContact CE1-CD2 4.18Å; F150-F155 HydrophobicContact CE2-CD2 4Å; F150-F155 HydrophobicContact CE2-CE2 4.37Å; F150-F155 HydrophobicContact CG-CB 4.28Å; F150-F155 AromaticContact CG-CD2 3.71Å; F150-F155 HydrophobicContact CG-CD2 3.71Å; F150-F155 HydrophobicContact CZ-CD2 4.23Å; F150-F155 PolarHBondContact O-N 3.33Å; F150-L156 HydrophobicContact CB-CD2 4.48Å; F150-L156 HydrophobicContact CB-CG 4.23Å; F150-L156 HydrophobicContact CD1-CD2 3.88Å; F150-L156 HydrophobicContact CD1-CG 4.41Å; F150-I161 HydrophobicContact CE1-CD1 4.29Å; F150-F166 HydrophobicContact CB-CE1 3.84Å; F150-F166 HydrophobicContact CB-CZ 3.76Å; F150-F166 HydrophobicContact CD1-CD2 4.09Å; F150-F166 AromaticContact CD1-CE1 3.93Å; F150-F166 HydrophobicContact CD1-CE1 3.93Å; F150-F166 AromaticContact CD1-CE2 3.42Å; F150-F166 HydrophobicContact CD1-CE2 3.42Å; F150-F166 VanDerWaalsContact CD1-CE2 3.42Å; F150-F166 AromaticContact CD1-CZ 3.31Å; F150-F166 HydrophobicContact CD1-CZ 3.31Å; F150-F166 HydrophobicContact CD2-CE1 4.5Å; F150-F166 HydrophobicContact CD2-CE2 4.11Å; F150-F166 AromaticContact CD2-CZ 3.58Å; F150-F166 HydrophobicContact CD2-CZ 3.58Å; F150-F166 AromaticContact CE1-CD2 3.98Å; F150-F166 HydrophobicContact CE1-CD2 3.98Å; F150-F166 AromaticContact CE1-CE2 3.3Å; F150-F166 HydrophobicContact CE1-CE2 3.3Å; F150-F166 AromaticContact CE1-CZ 3.69Å; F150-F166 HydrophobicContact CE1-CZ 3.69Å; F150-F166 HydrophobicContact CE2-CE2 4.03Å; F150-F166 AromaticContact CE2-CZ 3.94Å; F150-F166 HydrophobicContact CE2-CZ 3.94Å; F150-F166 AromaticContact CG-CE1 3.84Å; F150-F166 HydrophobicContact CG-CE1 3.84Å; F150-F166 AromaticContact CG-CE2 3.83Å; F150-F166 HydrophobicContact CG-CE2 3.83Å; F150-F166 AromaticContact CG-CZ 3.24Å; F150-F166 HydrophobicContact CG-CZ 3.24Å; F150-F166 AromaticContact CZ-CE2 3.62Å; F150-F166 HydrophobicContact CZ-CE2 3.62Å; F150-F166 AromaticContact CZ-CZ 3.98Å; F150-F166 HydrophobicContact CZ-CZ 3.98Å; F150-F216 HydrophobicContact CE1-CD2 4.33Å; F150-F216 AromaticContact CE1-CE2 3.65Å; F150-F216 HydrophobicContact CE1-CE2 3.65Å; F150-F216 HydrophobicContact CE1-CZ 4.45Å; F150-F216 HydrophobicContact CZ-CD2 4.17Å; F150-F216 AromaticContact CZ-CE2 3.63Å; F150-F216 HydrophobicContact CZ-CE2 3.63Å; F150-I219 HydrophobicContact CE2-CG2 4.35Å; F150-M223 HydrophobicContact CD2-SD 4.4Å; F150-M223 HydrophobicContact CE2-CE 4.11Å; F150-M223 HydrophobicContact CE2-SD 3.57Å; F150-M223 VanDerWaalsContact CE2-SD 3.57Å; F150-M223 HydrophobicContact CZ-CE 4.38Å; F150-M223 HydrophobicContact CZ-SD 4.3Å; F150-I274 HydrophobicContact CE1-CD1 4.28Å; F150-I274 HydrophobicContact CZ-CD1 4.49Å
151	G	91.6	Very high	95.8	Very high	48 Å²	48	36.6 Å²	36.6	50%	0.495	19%	0.191	S	C	.	.	H	α-helix	trans	-69	-53.4	166.6	0	0	0	0	0	112.3	M147 A148 L149 Y153 N154	M147-G151 PolarHBondContact O-N 3.26Å; A148-G151 PolarHBondContact O-N 2.96Å; L149-G151 PolarHBondContact O-N 3.42Å; G151-Y153 PolarHBondContact O-N 2.71Å; G151-N154 PolarHBondContact O-N 3.35Å
152	K	91.8	Very high	95.9	Very high	105 Å²	105	39.3 Å²	39.3	46%	0.457	21%	0.209	S	C	.	.	H	α-helix	trans	-56.7	-46.8	-178.8	173.4	166.8	171.5	154.5	0	112.9	N124 A148 L149 H198	N124-K152 PolarHBondContact OD1-NZ 3.08Å; A148-K152 WeakPolarHBondContact O-CB 3.42Å; A148-K152 PolarHBondContact O-N 3.18Å; L149-K152 PolarHBondContact O-N 2.95Å; L149-K152 VanDerWaalsContact O-N 3.16Å; K152-H198 PolarHBondContact NZ-CE1 3.33Å
153	Y	92.8	Very high	95.8	Very high	15 Å²	15	42.7 Å²	42.7	6%	0.059	23%	0.227	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.9	0.7	-178.9	-62.6	-61.8	0	0	0	113.8	L149 G151 F155 K158 H198 V207 L215 I219	L149-Y153 HydrophobicContact CB-CD2 4.48Å; L149-Y153 HydrophobicContact CD2-CE2 4.24Å; L149-Y153 WeakPolarHBondContact O-CD2 3.45Å; L149-Y153 PolarHBondContact O-N 3.21Å; G151-Y153 PolarHBondContact O-N 2.71Å; Y153-F155 VanDerWaalsContact CB-CE1 3.45Å; Y153-F155 VanDerWaalsContact CB-CZ 3.43Å; Y153-F155 HydrophobicContact CD2-CE2 4.16Å; Y153-F155 AromaticContact CD2-CZ 3.94Å; Y153-F155 HydrophobicContact CD2-CZ 3.94Å; Y153-F155 HydrophobicContact CG-CE1 4.29Å; Y153-F155 HydrophobicContact CG-CE2 4.42Å; Y153-F155 AromaticContact CG-CZ 3.91Å; Y153-F155 HydrophobicContact CG-CZ 3.91Å; Y153-F155 PolarHBondContact O-N 2.99Å; Y153-K158 WeakPolarHBondContact O-CE 3.29Å; Y153-K158 PolarHBondContact O-NZ 2.98Å; Y153-H198 AromaticContact CE2-ND1 3.6Å; Y153-H198 AromaticContact CZ-ND1 3.64Å; Y153-H198 PolarHBondContact OH-CE1 3.34Å; Y153-H198 PolarHBondContact OH-ND1 3.16Å; Y153-V207 HydrophobicContact CE1-CG1 4.08Å; Y153-L215 HydrophobicContact CD1-CD1 4.33Å; Y153-L215 HydrophobicContact CD1-CD2 3.78Å; Y153-L215 HydrophobicContact CD1-CG 4.35Å; Y153-L215 HydrophobicContact CE1-CD1 4.24Å; Y153-L215 HydrophobicContact CE1-CD2 4.24Å; Y153-L215 HydrophobicContact CG-CD2 4.28Å; Y153-L215 HydrophobicContact CG-CG 4.47Å; Y153-I219 HydrophobicContact CD2-CG1 4.44Å; Y153-I219 HydrophobicContact CE2-CD1 4.38Å; Y153-I219 HydrophobicContact CE2-CG1 4.32Å
154	N	95.4	Very high	95.9	Very high	72 Å²	72	46.8 Å²	46.8	39%	0.385	25%	0.254	S	S	.	.			trans	61	21.7	175.6	-161.7	31.4	0	0	0	115.2	F150 G151 L156 N157 K158	F150-N154 WeakPolarHBondContact O-CA 3.4Å; F150-N154 PolarHBondContact O-N 2.97Å; G151-N154 PolarHBondContact O-N 3.35Å; N154-L156 PolarHBondContact O-N 3.48Å; N154-L156 VanDerWaalsContact O-N 3.15Å; N154-N157 PolarHBondContact O-N 3.46Å; N154-N157 VanDerWaalsContact O-N 3.1Å; N154-N157 WeakPolarHBondContact OD1-CB 3.07Å; N154-N157 PolarHBondContact OD1-ND2 3.29Å; N154-K158 HydrophobicContact CB-CD 4.43Å; N154-K158 WeakPolarHBondContact O-CG 3.46Å; N154-K158 PolarHBondContact O-N 2.98Å; N154-K158 VanDerWaalsContact O-N 3.09Å
155	F	97.9	Very high	96	Very high	0 Å²	0	47.7 Å²	47.7	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-53.9	-37.2	-176.2	-60.3	-36.7	0	0	0	113.1	F150 Y153 N157 K158 Y159 L215 F216 I219	F150-F155 HydrophobicContact CB-CD2 4.28Å; F150-F155 HydrophobicContact CD1-CB 3.86Å; F150-F155 AromaticContact CD1-CD2 3.92Å; F150-F155 HydrophobicContact CD1-CD2 3.92Å; F150-F155 HydrophobicContact CD1-CG 4.42Å; F150-F155 AromaticContact CD2-CD2 3.75Å; F150-F155 HydrophobicContact CD2-CD2 3.75Å; F150-F155 HydrophobicContact CD2-CE2 4.27Å; F150-F155 HydrophobicContact CE1-CB 4.33Å; F150-F155 HydrophobicContact CE1-CD2 4.18Å; F150-F155 HydrophobicContact CE2-CD2 4Å; F150-F155 HydrophobicContact CE2-CE2 4.37Å; F150-F155 HydrophobicContact CG-CB 4.28Å; F150-F155 AromaticContact CG-CD2 3.71Å; F150-F155 HydrophobicContact CG-CD2 3.71Å; F150-F155 HydrophobicContact CZ-CD2 4.23Å; F150-F155 PolarHBondContact O-N 3.33Å; Y153-F155 VanDerWaalsContact CB-CE1 3.45Å; Y153-F155 VanDerWaalsContact CB-CZ 3.43Å; Y153-F155 HydrophobicContact CD2-CE2 4.16Å; Y153-F155 AromaticContact CD2-CZ 3.94Å; Y153-F155 HydrophobicContact CD2-CZ 3.94Å; Y153-F155 HydrophobicContact CG-CE1 4.29Å; Y153-F155 HydrophobicContact CG-CE2 4.42Å; Y153-F155 AromaticContact CG-CZ 3.91Å; Y153-F155 HydrophobicContact CG-CZ 3.91Å; Y153-F155 PolarHBondContact O-N 2.99Å; F155-N157 VanDerWaalsContact C-N 3.3Å; F155-N157 PolarHBondContact O-N 3.27Å; F155-K158 PolarHBondContact O-N 3.24Å; F155-Y159 HydrophobicContact CB-CD2 4.41Å; F155-Y159 HydrophobicContact CD1-CE2 4.37Å; F155-Y159 PolarHBondContact O-N 2.9Å; F155-L215 HydrophobicContact CE1-CB 4.49Å; F155-L215 HydrophobicContact CE1-CD2 4.46Å; F155-L215 HydrophobicContact CE1-CG 3.94Å; F155-L215 HydrophobicContact CZ-CG 3.95Å; F155-L215 WeakPolarHBondContact CZ-O 3.5Å; F155-F216 HydrophobicContact CB-CD2 4.46Å; F155-F216 HydrophobicContact CD1-CB 3.9Å; F155-F216 HydrophobicContact CD1-CD2 4.45Å; F155-F216 HydrophobicContact CD1-CG 4.32Å; F155-F216 AromaticContact CD2-CD2 3.95Å; F155-F216 HydrophobicContact CD2-CD2 3.95Å; F155-F216 HydrophobicContact CE1-CB 3.75Å; F155-F216 HydrophobicContact CE2-CD2 4.26Å; F155-F216 HydrophobicContact CG-CB 4.38Å; F155-F216 HydrophobicContact CG-CD2 4.07Å; F155-F216 HydrophobicContact CG-CG 4.35Å; F155-F216 HydrophobicContact CZ-CB 4.13Å; F155-I219 HydrophobicContact CE2-CB 4.07Å; F155-I219 HydrophobicContact CE2-CG1 4.31Å; F155-I219 HydrophobicContact CE2-CG2 4.2Å; F155-I219 HydrophobicContact CZ-CB 4.4Å; F155-I219 HydrophobicContact CZ-CG1 4.28Å
156	L	96.7	Very high	96.1	Very high	29 Å²	29	47.7 Å²	47.7	15%	0.152	26%	0.256	C	S	.	.	H	α-helix	trans	-60.3	-38	-179.2	-60.6	179.7	0	0	0	112.8	F150 N154 K160 I161 L163 F166	F150-L156 HydrophobicContact CB-CD2 4.48Å; F150-L156 HydrophobicContact CB-CG 4.23Å; F150-L156 HydrophobicContact CD1-CD2 3.88Å; F150-L156 HydrophobicContact CD1-CG 4.41Å; N154-L156 PolarHBondContact O-N 3.48Å; N154-L156 VanDerWaalsContact O-N 3.15Å; L156-K160 CarbonylContact O-C 3.44Å; L156-K160 WeakPolarHBondContact O-CA 3.25Å; L156-K160 PolarHBondContact O-N 3.4Å; L156-I161 HydrophobicContact CD2-CB 3.84Å; L156-I161 HydrophobicContact CD2-CD1 4.39Å; L156-I161 HydrophobicContact CD2-CG2 4.05Å; L156-I161 PolarHBondContact O-N 3.15Å; L156-L163 HydrophobicContact CD1-CD1 4.06Å; L156-F166 HydrophobicContact CD1-CD1 4.27Å; L156-F166 HydrophobicContact CD2-CB 4.01Å; L156-F166 HydrophobicContact CD2-CD1 3.69Å; L156-F166 HydrophobicContact CD2-CD2 4.41Å; L156-F166 HydrophobicContact CD2-CE1 4.19Å; L156-F166 HydrophobicContact CD2-CG 3.79Å
157	N	97.3	Very high	96.1	Very high	119 Å²	119	50.2 Å²	50.2	64%	0.636	27%	0.268	S	S	*	.	H	α-helix	trans	-84.3	-43.5	178.4	-67	-50.8	0	0	0	111.4	N154 F155 Y159 K160	N154-N157 PolarHBondContact O-N 3.46Å; N154-N157 VanDerWaalsContact O-N 3.1Å; N154-N157 WeakPolarHBondContact OD1-CB 3.07Å; N154-N157 PolarHBondContact OD1-ND2 3.29Å; F155-N157 VanDerWaalsContact C-N 3.3Å; F155-N157 PolarHBondContact O-N 3.27Å; N157-Y159 PolarHBondContact O-N 2.76Å; N157-K160 PolarHBondContact O-N 3.08Å
158	K	97.6	Very high	96.3	Very high	76 Å²	76	49.7 Å²	49.7	33%	0.33	27%	0.27	S	S	.	.	H	α-helix	trans	-53.5	-51.8	177.7	-71.8	170	173	176.4	0	111.4	Y153 N154 F155 D212	Y153-K158 WeakPolarHBondContact O-CE 3.29Å; Y153-K158 PolarHBondContact O-NZ 2.98Å; N154-K158 HydrophobicContact CB-CD 4.43Å; N154-K158 WeakPolarHBondContact O-CG 3.46Å; N154-K158 PolarHBondContact O-N 2.98Å; N154-K158 VanDerWaalsContact O-N 3.09Å; F155-K158 PolarHBondContact O-N 3.24Å; K158-D212 HydrophobicContact CD-CB 4.3Å; K158-D212 VanDerWaalsContact CD-OD2 3.23Å; K158-D212 WeakPolarHBondContact CD-OD2 3.36Å; K158-D212 WeakPolarHBondContact CE-OD1 3.42Å; K158-D212 WeakPolarHBondContact CE-OD2 3.27Å; K158-D212 IonicContact NZ-OD1 3.92Å; K158-D212 PolarHBondContact NZ-OD1 2.82Å; K158-D212 IonicContact NZ-OD2 3.89Å; K158-D212 PolarHBondContact NZ-OD2 2.86Å; K158-D212 VanDerWaalsContact NZ-OD2 3.1Å
159	Y	98.1	Very high	96.6	Very high	20 Å²	20	48.3 Å²	48.3	8%	0.078	26%	0.259	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.3	15.1	-178.7	-56.9	-61.2	0	0	0	114	F155 N157 I161 D212 L213 F216 K277 L278	F155-Y159 HydrophobicContact CB-CD2 4.41Å; F155-Y159 HydrophobicContact CD1-CE2 4.37Å; F155-Y159 PolarHBondContact O-N 2.9Å; N157-Y159 PolarHBondContact O-N 2.76Å; Y159-I161 PolarHBondContact O-N 3.02Å; Y159-D212 WeakPolarHBondContact OH-CB 3.43Å; Y159-D212 PolarHBondContact OH-O 3.33Å; Y159-L213 HydrophobicContact CE1-CD1 3.97Å; Y159-L213 WeakPolarHBondContact OH-CA 3.34Å; Y159-L213 PolarHBondContact OH-N 3.01Å; Y159-F216 HydrophobicContact CD2-CB 4.42Å; Y159-F216 AromaticContact CD2-CD1 3.38Å; Y159-F216 HydrophobicContact CD2-CD1 3.38Å; Y159-F216 AromaticContact CD2-CE1 3.8Å; Y159-F216 HydrophobicContact CD2-CE1 3.8Å; Y159-F216 HydrophobicContact CD2-CG 4.02Å; Y159-F216 HydrophobicContact CE2-CB 3.79Å; Y159-F216 AromaticContact CE2-CD1 3.45Å; Y159-F216 HydrophobicContact CE2-CD1 3.45Å; Y159-F216 VanDerWaalsContact CE2-CD1 3.45Å; Y159-F216 HydrophobicContact CE2-CE1 4.32Å; Y159-F216 AromaticContact CE2-CG 3.88Å; Y159-F216 HydrophobicContact CE2-CG 3.88Å; Y159-F216 HydrophobicContact CG-CD1 4.1Å; Y159-F216 HydrophobicContact CG-CE1 4.19Å; Y159-K277 WeakPolarHBondContact O-CB 3.46Å; Y159-L278 HydrophobicContact CD1-CD2 3.27Å; Y159-L278 HydrophobicContact CE1-CD2 3.88Å; Y159-L278 HydrophobicContact CG-CD2 3.82Å
160	K	97.9	Very high	96.7	Very high	157 Å²	157	48.3 Å²	48.3	68%	0.683	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	34	172.5	-57.3	161.7	-171.2	159.9	0	113.2	L156 N157 P162 K277	L156-K160 CarbonylContact O-C 3.44Å; L156-K160 WeakPolarHBondContact O-CA 3.25Å; L156-K160 PolarHBondContact O-N 3.4Å; N157-K160 PolarHBondContact O-N 3.08Å; K160-P162 VanDerWaalsContact O-CD 3.31Å; K160-P162 WeakPolarHBondContact O-CD 3.49Å; K160-K277 HydrophobicContact CB-CB 4.19Å; K160-K277 HydrophobicContact CB-CG 4.23Å
161	I	98.1	Very high	96.8	Very high	7 Å²	7	49.9 Å²	49.9	4%	0.036	27%	0.269	C	S	.	.			trans	-76.1	116.1	-174.9	-48.5	-178.9	0	0	0	108.6	F150 L156 Y159 L163 F166 F216 I274	F150-I161 HydrophobicContact CE1-CD1 4.29Å; L156-I161 HydrophobicContact CD2-CB 3.84Å; L156-I161 HydrophobicContact CD2-CD1 4.39Å; L156-I161 HydrophobicContact CD2-CG2 4.05Å; L156-I161 PolarHBondContact O-N 3.15Å; Y159-I161 PolarHBondContact O-N 3.02Å; I161-L163 PolarHBondContact O-N 3.44Å; I161-F166 HydrophobicContact CG2-CB 4.14Å; I161-F216 HydrophobicContact CD1-CE1 4.43Å; I161-F216 HydrophobicContact CD1-CZ 3.93Å; I161-I274 HydrophobicContact CD1-CB 4.45Å; I161-I274 HydrophobicContact CG2-CB 3.7Å; I161-I274 HydrophobicContact CG2-CG2 3.93Å
162	P	97.3	Very high	97.1	Very high	57 Å²	57	49.8 Å²	49.8	37%	0.37	26%	0.256	S	S	.	.			trans	-64.7	126.3	178.6	-19.8	32.9	0	0	0	110.3	K160 V164 K165 F166	K160-P162 VanDerWaalsContact O-CD 3.31Å; K160-P162 WeakPolarHBondContact O-CD 3.49Å; P162-V164 PolarHBondContact O-N 2.84Å; P162-K165 HydrophobicContact CB-CB 4.39Å; P162-K165 HydrophobicContact CB-CG 4.3Å; P162-K165 HydrophobicContact CG-CD 4.3Å; P162-K165 HydrophobicContact CG-CG 4.36Å; P162-K165 WeakPolarHBondContact O-CA 3.5Å; P162-K165 WeakPolarHBondContact O-CB 3.32Å; P162-K165 PolarHBondContact O-N 2.82Å; P162-F166 PolarHBondContact O-N 3.25Å
163	L	96	Very high	97.4	Very high	72 Å²	72	44.8 Å²	44.8	38%	0.377	23%	0.234	S	C	.	.	H	α-helix	trans	-53	-35.7	-177.7	179.5	61.4	0	0	0	112.7	M147 L156 I161 F166 E167	M147-L163 HydrophobicContact CE-CD1 3.99Å; M147-L163 HydrophobicContact SD-CD1 4Å; L156-L163 HydrophobicContact CD1-CD1 4.06Å; I161-L163 PolarHBondContact O-N 3.44Å; L163-F166 HydrophobicContact CD1-CD1 4.4Å; L163-F166 PolarHBondContact O-N 3.45Å; L163-E167 HydrophobicContact CD1-CG 4.17Å; L163-E167 HydrophobicContact CG-CG 4.37Å; L163-E167 WeakPolarHBondContact O-CB 3.2Å; L163-E167 WeakPolarHBondContact O-CG 3.28Å; L163-E167 PolarHBondContact O-N 3.12Å
164	V	97.2	Very high	97.7	Very high	117 Å²	117	44.9 Å²	44.9	71%	0.709	24%	0.235	S	C	*	.	H	α-helix	trans	-64.1	-40	176.2	-178.3	0	0	0	0	112.2	P162 A168	P162-V164 PolarHBondContact O-N 2.84Å; V164-A168 VanDerWaalsContact O-CB 3.29Å; V164-A168 WeakPolarHBondContact O-CB 3.47Å; V164-A168 PolarHBondContact O-N 2.9Å
165	K	97.8	Very high	97.8	Very high	36 Å²	36	45.5 Å²	45.5	16%	0.157	24%	0.235	C	C	.	.	H	α-helix	trans	-68.2	-39.8	173.7	-73.1	-162.6	176.7	-168.4	0	111.4	P162 A168 F169 S270 E276	P162-K165 HydrophobicContact CB-CB 4.39Å; P162-K165 HydrophobicContact CB-CG 4.3Å; P162-K165 HydrophobicContact CG-CD 4.3Å; P162-K165 HydrophobicContact CG-CG 4.36Å; P162-K165 WeakPolarHBondContact O-CA 3.5Å; P162-K165 WeakPolarHBondContact O-CB 3.32Å; P162-K165 PolarHBondContact O-N 2.82Å; K165-A168 PolarHBondContact O-N 2.98Å; K165-F169 VanDerWaalsContact O-CB 3.28Å; K165-F169 WeakPolarHBondContact O-CB 3.22Å; K165-F169 PolarHBondContact O-N 3.27Å; K165-S270 WeakPolarHBondContact CE-O 3.29Å; K165-S270 PolarHBondContact NZ-O 2.75Å; K165-E276 IonicContact NZ-OE1 3.31Å; K165-E276 PolarHBondContact NZ-OE1 3.17Å; K165-E276 IonicContact NZ-OE2 2.65Å; K165-E276 PolarHBondContact NZ-OE2 3.4Å
166	F	98.4	Very high	97.9	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-65.3	-44.5	176.9	-176	-126.9	0	0	0	112.2	A146 M147 F150 L156 I161 P162 L163 A168 F169 L170 I274	A146-F166 HydrophobicContact CB-CZ 4.18Å; M147-F166 HydrophobicContact CE-CE1 4.5Å; M147-F166 HydrophobicContact CG-CE1 4.4Å; M147-F166 HydrophobicContact SD-CD1 3.8Å; M147-F166 HydrophobicContact SD-CE1 3.68Å; F150-F166 HydrophobicContact CB-CE1 3.84Å; F150-F166 HydrophobicContact CB-CZ 3.76Å; F150-F166 HydrophobicContact CD1-CD2 4.09Å; F150-F166 AromaticContact CD1-CE1 3.93Å; F150-F166 HydrophobicContact CD1-CE1 3.93Å; F150-F166 AromaticContact CD1-CE2 3.42Å; F150-F166 HydrophobicContact CD1-CE2 3.42Å; F150-F166 VanDerWaalsContact CD1-CE2 3.42Å; F150-F166 AromaticContact CD1-CZ 3.31Å; F150-F166 HydrophobicContact CD1-CZ 3.31Å; F150-F166 HydrophobicContact CD2-CE1 4.5Å; F150-F166 HydrophobicContact CD2-CE2 4.11Å; F150-F166 AromaticContact CD2-CZ 3.58Å; F150-F166 HydrophobicContact CD2-CZ 3.58Å; F150-F166 AromaticContact CE1-CD2 3.98Å; F150-F166 HydrophobicContact CE1-CD2 3.98Å; F150-F166 AromaticContact CE1-CE2 3.3Å; F150-F166 HydrophobicContact CE1-CE2 3.3Å; F150-F166 AromaticContact CE1-CZ 3.69Å; F150-F166 HydrophobicContact CE1-CZ 3.69Å; F150-F166 HydrophobicContact CE2-CE2 4.03Å; F150-F166 AromaticContact CE2-CZ 3.94Å; F150-F166 HydrophobicContact CE2-CZ 3.94Å; F150-F166 AromaticContact CG-CE1 3.84Å; F150-F166 HydrophobicContact CG-CE1 3.84Å; F150-F166 AromaticContact CG-CE2 3.83Å; F150-F166 HydrophobicContact CG-CE2 3.83Å; F150-F166 AromaticContact CG-CZ 3.24Å; F150-F166 HydrophobicContact CG-CZ 3.24Å; F150-F166 AromaticContact CZ-CE2 3.62Å; F150-F166 HydrophobicContact CZ-CE2 3.62Å; F150-F166 AromaticContact CZ-CZ 3.98Å; F150-F166 HydrophobicContact CZ-CZ 3.98Å; L156-F166 HydrophobicContact CD1-CD1 4.27Å; L156-F166 HydrophobicContact CD2-CB 4.01Å; L156-F166 HydrophobicContact CD2-CD1 3.69Å; L156-F166 HydrophobicContact CD2-CD2 4.41Å; L156-F166 HydrophobicContact CD2-CE1 4.19Å; L156-F166 HydrophobicContact CD2-CG 3.79Å; I161-F166 HydrophobicContact CG2-CB 4.14Å; P162-F166 PolarHBondContact O-N 3.25Å; L163-F166 HydrophobicContact CD1-CD1 4.4Å; L163-F166 PolarHBondContact O-N 3.45Å; F166-A168 VanDerWaalsContact C-N 3.32Å; F166-A168 PolarHBondContact O-N 3.24Å; F166-F169 HydrophobicContact CD2-CD1 4.42Å; F166-F169 PolarHBondContact O-N 3.32Å; F166-L170 HydrophobicContact CD1-CD1 4.01Å; F166-L170 HydrophobicContact CD2-CD1 4.3Å; F166-L170 HydrophobicContact CD2-CG 4.15Å; F166-L170 HydrophobicContact CE1-CD1 3.62Å; F166-L170 HydrophobicContact CE1-CG 4.45Å; F166-L170 HydrophobicContact CE2-CD1 3.91Å; F166-L170 HydrophobicContact CE2-CD2 3.94Å; F166-L170 HydrophobicContact CE2-CG 3.86Å; F166-L170 HydrophobicContact CG-CD1 4.35Å; F166-L170 HydrophobicContact CZ-CD1 3.56Å; F166-L170 HydrophobicContact CZ-CD2 4.15Å; F166-L170 HydrophobicContact CZ-CG 4.04Å; F166-L170 WeakPolarHBondContact O-CB 3.31Å; F166-L170 WeakPolarHBondContact O-CG 3.46Å; F166-L170 PolarHBondContact O-N 2.9Å; F166-I274 HydrophobicContact CB-CG2 4.46Å; F166-I274 HydrophobicContact CD2-CD1 4.41Å; F166-I274 HydrophobicContact CD2-CG2 4.29Å
167	E	97.3	Very high	97.9	Very high	53 Å²	53	44.1 Å²	44.1	25%	0.248	23%	0.228	C	C	.	.	H	α-helix	trans	-62.8	-37.7	174.2	-74.3	177.5	-173.3	0	0	112.3	R114 L163 S171	R114-E167 IonicContact CZ-OE1 3.64Å; R114-E167 IonicContact NH1-OE1 3.93Å; R114-E167 PolarHBondContact NH1-OE1 3.01Å; R114-E167 IonicContact NH2-OE1 3.94Å; R114-E167 PolarHBondContact NH2-OE1 3.17Å; L163-E167 HydrophobicContact CD1-CG 4.17Å; L163-E167 HydrophobicContact CG-CG 4.37Å; L163-E167 WeakPolarHBondContact O-CB 3.2Å; L163-E167 WeakPolarHBondContact O-CG 3.28Å; L163-E167 PolarHBondContact O-N 3.12Å; E167-S171 WeakPolarHBondContact O-CB 3.42Å; E167-S171 PolarHBondContact O-N 3.16Å; E167-S171 VanDerWaalsContact O-N 3.11Å; E167-S171 PolarHBondContact O-OG 3.43Å
168	A	98	Very high	97.9	Very high	31 Å²	31	42 Å²	42	26%	0.256	22%	0.222	S	C	.	.	H	α-helix	trans	-66.8	-46.4	174.5	0	0	0	0	0	111.8	V164 K165 F166 S171 K172 Y272	V164-A168 VanDerWaalsContact O-CB 3.29Å; V164-A168 WeakPolarHBondContact O-CB 3.47Å; V164-A168 PolarHBondContact O-N 2.9Å; K165-A168 PolarHBondContact O-N 2.98Å; F166-A168 VanDerWaalsContact C-N 3.32Å; F166-A168 PolarHBondContact O-N 3.24Å; A168-S171 PolarHBondContact O-N 3.32Å; A168-K172 PolarHBondContact O-N 2.87Å; A168-Y272 HydrophobicContact CB-CD1 3.91Å; A168-Y272 HydrophobicContact CB-CE1 4.04Å
169	F	98.8	Very high	97.9	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-56.4	-55.1	174.5	170.8	-97.4	0	0	0	111.3	K165 F166 S171 K172 L173 F220 M223 V224 I262 M266 Y272 I274	K165-F169 VanDerWaalsContact O-CB 3.28Å; K165-F169 WeakPolarHBondContact O-CB 3.22Å; K165-F169 PolarHBondContact O-N 3.27Å; F166-F169 HydrophobicContact CD2-CD1 4.42Å; F166-F169 PolarHBondContact O-N 3.32Å; F169-S171 PolarHBondContact O-N 3.08Å; F169-K172 CarbonylContact O-C 3.58Å; F169-K172 PolarHBondContact O-N 3.41Å; F169-L173 HydrophobicContact CE1-CD2 4Å; F169-L173 HydrophobicContact CZ-CD2 4.37Å; F169-L173 WeakPolarHBondContact O-CB 3.22Å; F169-L173 PolarHBondContact O-N 3.34Å; F169-F220 HydrophobicContact CE1-CE2 4.05Å; F169-F220 HydrophobicContact CE2-CE2 4.25Å; F169-F220 HydrophobicContact CE2-CZ 4.5Å; F169-F220 HydrophobicContact CZ-CD2 4.49Å; F169-F220 AromaticContact CZ-CE2 3.49Å; F169-F220 HydrophobicContact CZ-CE2 3.49Å; F169-F220 VanDerWaalsContact CZ-CE2 3.49Å; F169-F220 AromaticContact CZ-CZ 3.98Å; F169-F220 HydrophobicContact CZ-CZ 3.98Å; F169-M223 HydrophobicContact CE1-CE 4.25Å; F169-V224 HydrophobicContact CZ-CG1 4.43Å; F169-I262 HydrophobicContact CE2-CD1 3.74Å; F169-I262 HydrophobicContact CE2-CG1 4.23Å; F169-I262 HydrophobicContact CZ-CD1 3.94Å; F169-I262 HydrophobicContact CZ-CG1 4.32Å; F169-M266 HydrophobicContact CD2-CG 4.31Å; F169-M266 HydrophobicContact CD2-SD 4.37Å; F169-M266 HydrophobicContact CE2-CG 4.13Å; F169-M266 HydrophobicContact CE2-SD 3.93Å; F169-Y272 VanDerWaalsContact CD2-O 3.31Å; F169-Y272 WeakPolarHBondContact CD2-O 3.3Å; F169-I274 HydrophobicContact CB-CG2 3.69Å; F169-I274 HydrophobicContact CD1-CD1 4.07Å; F169-I274 HydrophobicContact CD1-CG2 4.26Å; F169-I274 HydrophobicContact CD2-CG2 4.45Å; F169-I274 HydrophobicContact CE1-CD1 4.03Å; F169-I274 HydrophobicContact CG-CD1 4.49Å; F169-I274 HydrophobicContact CG-CG2 3.88Å; F169-I274 HydrophobicContact CZ-CD1 4.41Å
170	L	98.5	Very high	97.8	Very high	0 Å²	0	44 Å²	44	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-58.5	-36.5	179	-69	176.9	0	0	0	112.6	K143 A146 M147 F166 K172 L173 Q174 M223	K143-L170 HydrophobicContact CB-CB 4.29Å; K143-L170 HydrophobicContact CB-CD1 4.41Å; K143-L170 HydrophobicContact CD-CB 4.49Å; K143-L170 HydrophobicContact CG-CB 4.08Å; K143-L170 HydrophobicContact CG-CD1 3.97Å; A146-L170 HydrophobicContact CB-CD1 4.04Å; A146-L170 HydrophobicContact CB-CD2 3.52Å; A146-L170 HydrophobicContact CB-CG 4.45Å; M147-L170 HydrophobicContact CG-CD1 4.13Å; M147-L170 HydrophobicContact SD-CD1 4.45Å; F166-L170 HydrophobicContact CD1-CD1 4.01Å; F166-L170 HydrophobicContact CD2-CD1 4.3Å; F166-L170 HydrophobicContact CD2-CG 4.15Å; F166-L170 HydrophobicContact CE1-CD1 3.62Å; F166-L170 HydrophobicContact CE1-CG 4.45Å; F166-L170 HydrophobicContact CE2-CD1 3.91Å; F166-L170 HydrophobicContact CE2-CD2 3.94Å; F166-L170 HydrophobicContact CE2-CG 3.86Å; F166-L170 HydrophobicContact CG-CD1 4.35Å; F166-L170 HydrophobicContact CZ-CD1 3.56Å; F166-L170 HydrophobicContact CZ-CD2 4.15Å; F166-L170 HydrophobicContact CZ-CG 4.04Å; F166-L170 WeakPolarHBondContact O-CB 3.31Å; F166-L170 WeakPolarHBondContact O-CG 3.46Å; F166-L170 PolarHBondContact O-N 2.9Å; L170-K172 VanDerWaalsContact C-N 3.33Å; L170-L173 HydrophobicContact CD2-CD2 4.1Å; L170-L173 PolarHBondContact O-N 3.21Å; L170-Q174 PolarHBondContact O-N 2.88Å; L170-M223 HydrophobicContact CD2-CE 3.54Å
171	S	97.8	Very high	97.7	Very high	33 Å²	33	42.6 Å²	42.6	23%	0.231	23%	0.231	C	C	.	.	H	α-helix	trans	-70.9	-28.7	177.8	-52.7	0	0	0	0	112.4	K143 E167 A168 F169 Q175	K143-S171 PolarHBondContact NZ-OG 3.22Å; E167-S171 WeakPolarHBondContact O-CB 3.42Å; E167-S171 PolarHBondContact O-N 3.16Å; E167-S171 VanDerWaalsContact O-N 3.11Å; E167-S171 PolarHBondContact O-OG 3.43Å; A168-S171 PolarHBondContact O-N 3.32Å; F169-S171 PolarHBondContact O-N 3.08Å; S171-Q175 VanDerWaalsContact O-CG 3.22Å; S171-Q175 WeakPolarHBondContact O-CG 3.47Å; S171-Q175 PolarHBondContact O-N 3.2Å; S171-Q175 PolarHBondContact O-NE2 2.57Å
172	K	98.5	Very high	97.7	Very high	47 Å²	47	42.8 Å²	42.8	20%	0.204	23%	0.233	C	C	.	.	H	α-helix	trans	-87.7	-25.1	175	178.9	54.4	-173.5	152.2	0	113.1	A168 F169 L170 Q175 G176 Y227 L265 Y272	A168-K172 PolarHBondContact O-N 2.87Å; F169-K172 CarbonylContact O-C 3.58Å; F169-K172 PolarHBondContact O-N 3.41Å; L170-K172 VanDerWaalsContact C-N 3.33Å; K172-Q175 HydrophobicContact CD-CB 4.37Å; K172-Q175 PolarHBondContact O-N 3.47Å; K172-G176 PolarHBondContact O-N 2.82Å; K172-Y227 PolarHBondContact O-OH 2.81Å; K172-L265 HydrophobicContact CD-CD1 4.25Å; K172-L265 VanDerWaalsContact CE-CD1 3.48Å; K172-L265 HydrophobicContact CG-CD1 3.68Å; K172-L265 HydrophobicContact CG-CD2 3.86Å; K172-L265 HydrophobicContact CG-CG 4.35Å; K172-Y272 HydrophobicContact CB-CD1 4.07Å; K172-Y272 HydrophobicContact CB-CD2 4.47Å; K172-Y272 HydrophobicContact CB-CE1 3.94Å; K172-Y272 HydrophobicContact CB-CE2 4.38Å; K172-Y272 HydrophobicContact CB-CG 4.36Å; K172-Y272 HydrophobicContact CG-CD2 4.02Å; K172-Y272 HydrophobicContact CG-CE1 4.36Å; K172-Y272 HydrophobicContact CG-CE2 3.9Å; K172-Y272 HydrophobicContact CG-CG 4.36Å
173	L	98.7	Very high	97.7	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.5	-55.6	168.7	-179.3	65.3	0	0	0	109.9	L142 F169 L170 Q175 G176 Y177 M223 V224 Y227 I262	L142-L173 HydrophobicContact CD2-CD2 3.69Å; L142-L173 HydrophobicContact CD2-CG 3.81Å; L142-L173 HydrophobicContact CG-CD2 4.23Å; F169-L173 HydrophobicContact CE1-CD2 4Å; F169-L173 HydrophobicContact CZ-CD2 4.37Å; F169-L173 WeakPolarHBondContact O-CB 3.22Å; F169-L173 PolarHBondContact O-N 3.34Å; L170-L173 HydrophobicContact CD2-CD2 4.1Å; L170-L173 PolarHBondContact O-N 3.21Å; L173-Q175 VanDerWaalsContact C-N 3.26Å; L173-Q175 PolarHBondContact O-N 2.62Å; L173-G176 PolarHBondContact O-N 3.38Å; L173-Y177 HydrophobicContact CD1-CD2 4.36Å; L173-Y177 HydrophobicContact CD1-CE2 3.92Å; L173-Y177 HydrophobicContact CG-CD2 4.33Å; L173-Y177 HydrophobicContact CG-CE2 4.17Å; L173-Y177 WeakPolarHBondContact O-CD2 2.98Å; L173-Y177 PolarHBondContact O-N 3.21Å; L173-M223 HydrophobicContact CD2-CB 4.38Å; L173-M223 HydrophobicContact CD2-CE 3.97Å; L173-V224 HydrophobicContact CD1-CB 4.46Å; L173-V224 HydrophobicContact CD1-CG1 3.87Å; L173-V224 HydrophobicContact CD2-CG1 4.48Å; L173-Y227 HydrophobicContact CD1-CD2 3.57Å; L173-Y227 HydrophobicContact CD1-CE2 3.99Å; L173-Y227 HydrophobicContact CD1-CG 4.23Å; L173-Y227 WeakPolarHBondContact O-CE2 3.42Å; L173-I262 HydrophobicContact CD1-CD1 3.76Å
174	Q	98.3	Very high	97.9	Very high	16 Å²	16	37.7 Å²	37.7	8%	0.075	20%	0.203	C	C	.	.	H	α-helix	trans	-57	-36.8	174.6	-71.4	-178.6	176.3	0	0	112.6	N140 L142 L170 G176 Y177 C178 M187	N140-Q174 PolarHBondContact OD1-NE2 3.18Å; L142-Q174 HydrophobicContact CB-CG 4.14Å; L142-Q174 HydrophobicContact CD2-CG 4.25Å; L170-Q174 PolarHBondContact O-N 2.88Å; Q174-G176 VanDerWaalsContact C-N 3.31Å; Q174-G176 PolarHBondContact O-N 3.39Å; Q174-Y177 PolarHBondContact O-N 3.27Å; Q174-C178 PolarHBondContact O-N 3.35Å; Q174-C178 PolarHBondContact O-SG 3.1Å; Q174-M187 HydrophobicContact CB-CB 4.43Å; Q174-M187 HydrophobicContact CB-CG 4.37Å; Q174-M187 HydrophobicContact CG-CB 4.05Å; Q174-M187 HydrophobicContact CG-CG 4.16Å; Q174-M187 HydrophobicContact CG-SD 4.49Å
175	Q	98	Very high	97.9	Very high	86 Å²	86	33.2 Å²	33.2	40%	0.402	18%	0.175	S	C	.	.	H	α-helix	trans	-64.2	-31.4	175.6	-76.6	165.6	25.3	0	0	113.9	S171 K172 L173 K179	S171-Q175 VanDerWaalsContact O-CG 3.22Å; S171-Q175 WeakPolarHBondContact O-CG 3.47Å; S171-Q175 PolarHBondContact O-N 3.2Å; S171-Q175 PolarHBondContact O-NE2 2.57Å; K172-Q175 HydrophobicContact CD-CB 4.37Å; K172-Q175 PolarHBondContact O-N 3.47Å; L173-Q175 VanDerWaalsContact C-N 3.26Å; L173-Q175 PolarHBondContact O-N 2.62Å; Q175-K179 PolarHBondContact O-N 2.96Å
176	G	98.4	Very high	97.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-72.8	-41.1	174.8	0	0	0	0	0	112	K172 L173 Q174 C178 K179	K172-G176 PolarHBondContact O-N 2.82Å; L173-G176 PolarHBondContact O-N 3.38Å; Q174-G176 VanDerWaalsContact C-N 3.31Å; Q174-G176 PolarHBondContact O-N 3.39Å; G176-C178 VanDerWaalsContact C-N 3.29Å; G176-C178 PolarHBondContact O-N 2.88Å; G176-K179 WeakPolarHBondContact O-CB 3.46Å; G176-K179 PolarHBondContact O-N 2.07Å; G176-K179 VanDerWaalsContact O-N 3.13Å
177	Y	98.6	Very high	97.9	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-61.4	-33.5	170.6	-82.9	-72	0	0	0	114	L142 L173 Q174 K179 M187 A190 M223 D226 Y227	L142-Y177 HydrophobicContact CD2-CD2 3.91Å; L142-Y177 HydrophobicContact CD2-CE2 3.89Å; L173-Y177 HydrophobicContact CD1-CD2 4.36Å; L173-Y177 HydrophobicContact CD1-CE2 3.92Å; L173-Y177 HydrophobicContact CG-CD2 4.33Å; L173-Y177 HydrophobicContact CG-CE2 4.17Å; L173-Y177 WeakPolarHBondContact O-CD2 2.98Å; L173-Y177 PolarHBondContact O-N 3.21Å; Q174-Y177 PolarHBondContact O-N 3.27Å; Y177-K179 VanDerWaalsContact C-N 3.34Å; Y177-M187 HydrophobicContact CD2-CB 4.25Å; Y177-M187 HydrophobicContact CG-CB 4.01Å; Y177-A190 HydrophobicContact CD1-CB 4.32Å; Y177-A190 HydrophobicContact CD2-CB 4.45Å; Y177-A190 HydrophobicContact CE1-CB 3.61Å; Y177-A190 HydrophobicContact CE2-CB 3.8Å; Y177-A190 WeakPolarHBondContact OH-CB 3.48Å; Y177-M223 PolarHBondContact OH-O 2.68Å; Y177-D226 HydrophobicContact CE1-CB 3.43Å; Y177-D226 VanDerWaalsContact CE1-CB 3.43Å; Y177-D226 VanDerWaalsContact CE1-O 3.24Å; Y177-D226 WeakPolarHBondContact CE1-O 3.4Å; Y177-D226 PolarHBondContact OH-N 3.28Å; Y177-Y227 HydrophobicContact CD2-CD2 4.43Å; Y177-Y227 HydrophobicContact CE2-CD2 4.37Å
178	C	96.5	Very high	98	Very high	74 Å²	74	31.1 Å²	31.1	50%	0.5	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-2.4	175.8	-63.5	0	0	0	0	113.9	Q174 G176 H180 N181	Q174-C178 PolarHBondContact O-N 3.35Å; Q174-C178 PolarHBondContact O-SG 3.1Å; G176-C178 VanDerWaalsContact C-N 3.29Å; G176-C178 PolarHBondContact O-N 2.88Å; C178-H180 VanDerWaalsContact C-N 3.28Å; C178-H180 PolarHBondContact O-N 2.96Å; C178-N181 PolarHBondContact O-N 2.93Å
179	K	96.6	Very high	98	Very high	80 Å²	80	29.7 Å²	29.7	35%	0.348	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	-36.3	-173.7	179.2	-174.1	167.3	-162.5	0	113.5	Q175 G176 Y177 E228	Q175-K179 PolarHBondContact O-N 2.96Å; G176-K179 WeakPolarHBondContact O-CB 3.46Å; G176-K179 PolarHBondContact O-N 2.07Å; G176-K179 VanDerWaalsContact O-N 3.13Å; Y177-K179 VanDerWaalsContact C-N 3.34Å; K179-E228 HydrophobicContact CD-CB 3.94Å; K179-E228 HydrophobicContact CD-CG 3.92Å; K179-E228 IonicContact NZ-OE2 2.71Å; K179-E228 PolarHBondContact NZ-OE2 3.39Å
180	H	96.2	Very high	98	Very high	58 Å²	58	29.7 Å²	29.7	27%	0.269	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-2	-174	-67.2	-90.4	0	0	0	114	C178 N182 H229 T230	C178-H180 VanDerWaalsContact C-N 3.28Å; C178-H180 PolarHBondContact O-N 2.96Å; H180-N182 WeakPolarHBondContact CB-OD1 3.12Å; H180-N182 PolarHBondContact O-N 3.35Å; H180-H229 PolarHBondContact CD2-O 3.46Å; H180-T230 WeakPolarHBondContact CB-O 3.46Å; H180-T230 PolarHBondContact ND1-O 2.77Å
181	N	96.4	Very high	98	Very high	127 Å²	127	29.7 Å²	29.7	68%	0.679	16%	0.155	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.8	42.8	-179.4	-165.1	53.9	0	0	0	114.2	C178 R357	C178-N181 PolarHBondContact O-N 2.93Å; N181-R357 PolarHBondContact O-NH1 2.83Å
182	N	98.2	Very high	98.1	Very high	11 Å²	11	28.3 Å²	28.3	6%	0.059	15%	0.145	C	C	.	.			trans	-65.8	128.7	-176.4	-60.2	-5.7	0	0	0	112.3	H180 Y184 H185 N186 H229 G231 E354	H180-N182 WeakPolarHBondContact CB-OD1 3.12Å; H180-N182 PolarHBondContact O-N 3.35Å; N182-Y184 PolarHBondContact O-N 2.83Å; N182-H185 WeakPolarHBondContact CB-O 3.47Å; N182-H185 PolarHBondContact ND2-O 3.36Å; N182-N186 HydrophobicContact CB-CB 4.48Å; N182-N186 PolarHBondContact O-ND2 3.17Å; N182-H229 PolarHBondContact ND2-O 2.74Å; N182-G231 WeakPolarHBondContact OD1-CA 3.24Å; N182-G231 PolarHBondContact OD1-N 2.77Å; N182-E354 WeakPolarHBondContact CB-OE2 3.1Å
183	P	98.1	Very high	98.1	Very high	18 Å²	18	26.1 Å²	26.1	12%	0.117	14%	0.136	C	C	.	.	S	Bend	trans	-58.4	-41.5	172	-26.5	35.6	0	0	0	113.9	N186 Q350 E353 E354 R357	P183-N186 PolarHBondContact O-ND2 2.74Å; P183-Q350 HydrophobicContact CB-CB 4.36Å; P183-Q350 WeakPolarHBondContact CB-O 3.48Å; P183-Q350 WeakPolarHBondContact O-CB 3.26Å; P183-Q350 WeakPolarHBondContact O-CG 3.35Å; P183-Q350 PolarHBondContact O-OE1 2.58Å; P183-E353 HydrophobicContact CB-CG 4.3Å; P183-E353 HydrophobicContact CG-CG 3.97Å; P183-E354 HydrophobicContact CB-CB 4.17Å; P183-E354 VanDerWaalsContact CD-OE2 3.31Å; P183-E354 WeakPolarHBondContact CD-OE2 3.45Å; P183-E354 HydrophobicContact CG-CB 4.05Å; P183-R357 VanDerWaalsContact CG-CZ 3.44Å
184	Y	98.6	Very high	98.1	Very high	5 Å²	5	26.1 Å²	26.1	2%	0.02	14%	0.136	C	C	.	.	S	Bend	trans	-108.1	-63.8	-175.1	-176.7	-86.7	0	0	0	112.3	N182 N186 H189 W347 Q350 L351 E354	N182-Y184 PolarHBondContact O-N 2.83Å; Y184-N186 PolarHBondContact O-N 2.93Å; Y184-N186 PolarHBondContact O-ND2 3.09Å; Y184-H189 AromaticContact CE1-CE1 3.51Å; Y184-H189 AromaticContact CE1-ND1 3.53Å; Y184-H189 AromaticContact CE1-NE2 3.7Å; Y184-H189 AromaticContact CE2-CE1 3.83Å; Y184-H189 AromaticContact CZ-CE1 3.22Å; Y184-H189 AromaticContact CZ-ND1 3.62Å; Y184-H189 AromaticContact CZ-NE2 3.71Å; Y184-H189 WeakPolarHBondContact O-CB 3.26Å; Y184-H189 PolarHBondContact OH-CE1 3.43Å; Y184-H189 PolarHBondContact OH-NE2 3.43Å; Y184-W347 AromaticContact CD2-CE3 3.72Å; Y184-W347 HydrophobicContact CD2-CE3 3.72Å; Y184-W347 HydrophobicContact CD2-CZ3 4.38Å; Y184-W347 HydrophobicContact CE2-CB 4.21Å; Y184-W347 HydrophobicContact CE2-CD2 4.3Å; Y184-W347 AromaticContact CE2-CE3 3.83Å; Y184-W347 HydrophobicContact CE2-CE3 3.83Å; Y184-W347 HydrophobicContact CE2-CG 4.49Å; Y184-Q350 HydrophobicContact CD2-CB 4.4Å; Y184-L351 HydrophobicContact CD1-CD1 3.85Å; Y184-L351 HydrophobicContact CD2-CB 3.6Å; Y184-L351 HydrophobicContact CD2-CD1 3.96Å; Y184-L351 HydrophobicContact CD2-CG 4.33Å; Y184-L351 HydrophobicContact CE1-CD1 4.14Å; Y184-L351 HydrophobicContact CE2-CB 4.04Å; Y184-L351 HydrophobicContact CE2-CD1 4.22Å; Y184-L351 HydrophobicContact CG-CB 4.11Å; Y184-L351 HydrophobicContact CG-CD1 3.76Å; Y184-E354 WeakPolarHBondContact CA-OE2 3.08Å; Y184-E354 WeakPolarHBondContact CB-OE2 3.05Å; Y184-E354 PolarHBondContact N-OE2 3.46Å
185	H	98.5	Very high	98	Very high	23 Å²	23	25.4 Å²	25.4	11%	0.106	13%	0.132	C	C	.	.	S	Bend	trans	-77	69.9	-171.6	-56.4	98.2	0	0	0	111.1	N182 D226 H229 E354	N182-H185 WeakPolarHBondContact CB-O 3.47Å; N182-H185 PolarHBondContact ND2-O 3.36Å; H185-D226 IonicContact CD2-OD2 2.97Å; H185-D226 PolarHBondContact CD2-OD2 3.5Å; H185-D226 IonicContact CG-OD2 2.79Å; H185-H229 HydrophobicContact CB-CB 3.83Å; H185-H229 VanDerWaalsContact CB-CG 3.47Å; H185-H229 WeakPolarHBondContact CB-ND1 3.36Å; H185-H229 AromaticContact CD2-CE1 3.93Å; H185-H229 AromaticContact CD2-NE2 3.93Å; H185-H229 AromaticContact CE1-CE1 3.67Å; H185-H229 AromaticContact CG-CE1 3.38Å; H185-H229 AromaticContact CG-CG 3.81Å; H185-H229 AromaticContact CG-ND1 3.39Å; H185-H229 AromaticContact CG-NE2 3.82Å; H185-H229 AromaticContact ND1-CE1 3.2Å; H185-H229 PolarHBondContact ND1-CE1 3.48Å; H185-H229 AromaticContact ND1-ND1 3.54Å; H185-H229 AromaticContact ND1-NE2 3.9Å; H185-E354 IonicContact CE1-OE1 2.98Å; H185-E354 IonicContact CG-OE1 3.22Å; H185-E354 PolarHBondContact N-OE2 3.34Å; H185-E354 IonicContact ND1-OE1 2.95Å; H185-E354 PolarHBondContact ND1-OE1 2.98Å; H185-E354 IonicContact ND1-OE2 2.79Å
186	N	98.3	Very high	98	Very high	23 Å²	23	21.3 Å²	21.3	12%	0.123	11%	0.113	C	C	.	.	S	Bend	trans	-132.3	-178.9	-174.7	67.1	52.6	0	0	0	111.3	N182 P183 Y184 V188 H189 A190	N182-N186 HydrophobicContact CB-CB 4.48Å; N182-N186 PolarHBondContact O-ND2 3.17Å; P183-N186 PolarHBondContact O-ND2 2.74Å; Y184-N186 PolarHBondContact O-N 2.93Å; Y184-N186 PolarHBondContact O-ND2 3.09Å; N186-V188 PolarHBondContact O-N 2.9Å; N186-V188 VanDerWaalsContact O-N 3.15Å; N186-V188 WeakPolarHBondContact OD1-CB 3.25Å; N186-V188 PolarHBondContact OD1-N 3.46Å; N186-H189 WeakPolarHBondContact O-CB 3.36Å; N186-H189 PolarHBondContact O-N 3.23Å; N186-A190 PolarHBondContact O-N 2.69Å
187	M	98.1	Very high	97.9	Very high	9 Å²	9	21.3 Å²	21.3	4%	0.044	11%	0.113	C	C	.	.	H	α-helix	trans	-68.9	-13.9	-173.6	63.3	84	-169.2	0	0	114.4	N134 N139 L142 Q174 Y177 A191	N134-M187 VanDerWaalsContact OD1-CE 3.26Å; N134-M187 WeakPolarHBondContact OD1-CE 3.48Å; N139-M187 HydrophobicContact CB-CE 3.78Å; N139-M187 VanDerWaalsContact O-CE 3.31Å; N139-M187 WeakPolarHBondContact O-CE 3.39Å; L142-M187 HydrophobicContact CB-CB 4.19Å; L142-M187 WeakPolarHBondContact CB-O 3.36Å; L142-M187 HydrophobicContact CD2-CB 4.1Å; Q174-M187 HydrophobicContact CB-CB 4.43Å; Q174-M187 HydrophobicContact CB-CG 4.37Å; Q174-M187 HydrophobicContact CG-CB 4.05Å; Q174-M187 HydrophobicContact CG-CG 4.16Å; Q174-M187 HydrophobicContact CG-SD 4.49Å; Y177-M187 HydrophobicContact CD2-CB 4.25Å; Y177-M187 HydrophobicContact CG-CB 4.01Å; M187-A191 VanDerWaalsContact O-CB 3.26Å; M187-A191 WeakPolarHBondContact O-CB 3.44Å; M187-A191 PolarHBondContact O-N 3.33Å; M187-A191 VanDerWaalsContact O-N 3.16Å
188	V	98.5	Very high	97.8	Very high	12 Å²	12	21.3 Å²	21.3	7%	0.073	11%	0.113	C	C	.	.	H	α-helix	trans	-77.1	-40.1	171	-170.1	0	0	0	0	110.1	I130 F131 N134 N186 A191 D192 W347	I130-V188 HydrophobicContact CG1-CG1 4.17Å; I130-V188 HydrophobicContact CG2-CG1 4.12Å; F131-V188 HydrophobicContact CD1-CG1 3.94Å; F131-V188 HydrophobicContact CE1-CG1 4.14Å; N134-V188 HydrophobicContact CB-CG1 4.3Å; N134-V188 HydrophobicContact CB-CG2 4.05Å; N134-V188 VanDerWaalsContact CG-CG2 3.49Å; N186-V188 PolarHBondContact O-N 2.9Å; N186-V188 VanDerWaalsContact O-N 3.15Å; N186-V188 WeakPolarHBondContact OD1-CB 3.25Å; N186-V188 PolarHBondContact OD1-N 3.46Å; V188-A191 PolarHBondContact O-N 3.46Å; V188-D192 PolarHBondContact O-N 3.01Å; V188-W347 HydrophobicContact CB-CH2 4.01Å; V188-W347 HydrophobicContact CG1-CH2 3.93Å; V188-W347 HydrophobicContact CG1-CZ2 4.18Å
189	H	98.7	Very high	97.6	Very high	1 Å²	1	18.3 Å²	18.3	1%	0.005	9%	0.091	C	C	.	.	H	α-helix	trans	-63	-51.5	173.8	167.6	76.6	0	0	0	110	Y184 N186 A191 D192 V193 H225 D226 D333 W347	Y184-H189 AromaticContact CE1-CE1 3.51Å; Y184-H189 AromaticContact CE1-ND1 3.53Å; Y184-H189 AromaticContact CE1-NE2 3.7Å; Y184-H189 AromaticContact CE2-CE1 3.83Å; Y184-H189 AromaticContact CZ-CE1 3.22Å; Y184-H189 AromaticContact CZ-ND1 3.62Å; Y184-H189 AromaticContact CZ-NE2 3.71Å; Y184-H189 WeakPolarHBondContact O-CB 3.26Å; Y184-H189 PolarHBondContact OH-CE1 3.43Å; Y184-H189 PolarHBondContact OH-NE2 3.43Å; N186-H189 WeakPolarHBondContact O-CB 3.36Å; N186-H189 PolarHBondContact O-N 3.23Å; H189-A191 PolarHBondContact O-N 2.95Å; H189-A191 VanDerWaalsContact O-N 3.12Å; H189-D192 WeakPolarHBondContact O-CA 3.43Å; H189-D192 WeakPolarHBondContact O-CB 3.36Å; H189-D192 PolarHBondContact O-N 3.04Å; H189-V193 WeakPolarHBondContact O-CG2 3.32Å; H189-V193 PolarHBondContact O-N 3.37Å; H189-H225 AromaticContact CD2-NE2 3.82Å; H189-D226 IonicContact CD2-OD2 3.43Å; H189-D226 PolarHBondContact CD2-OD2 3.01Å; H189-D226 VanDerWaalsContact CD2-OD2 3.31Å; H189-D333 PolarHBondContact NE2-O 3.04Å; H189-D333 IonicContact NE2-OD1 2.67Å; H189-D333 PolarHBondContact NE2-OD1 3.09Å; H189-W347 VanDerWaalsContact CA-CH2 3.47Å; H189-W347 HydrophobicContact CB-CH2 3.75Å; H189-W347 HydrophobicContact CB-CZ2 4.39Å; H189-W347 HydrophobicContact CB-CZ3 3.92Å; H189-W347 VanDerWaalsContact N-CH2 3.33Å
190	A	98.8	Very high	97.4	Very high	0 Å²	0	14.5 Å²	14.5	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-55.8	-34.6	175.8	0	0	0	0	0	113.6	L142 Y177 N186 T194	L142-A190 HydrophobicContact CD1-CB 4.19Å; L142-A190 HydrophobicContact CD2-CB 4.14Å; Y177-A190 HydrophobicContact CD1-CB 4.32Å; Y177-A190 HydrophobicContact CD2-CB 4.45Å; Y177-A190 HydrophobicContact CE1-CB 3.61Å; Y177-A190 HydrophobicContact CE2-CB 3.8Å; Y177-A190 WeakPolarHBondContact OH-CB 3.48Å; N186-A190 PolarHBondContact O-N 2.69Å; A190-T194 VanDerWaalsContact O-CB 3.25Å; A190-T194 WeakPolarHBondContact O-CB 3.44Å; A190-T194 PolarHBondContact O-N 3.5Å; A190-T194 PolarHBondContact O-OG1 3.32Å
191	A	98.5	Very high	97.1	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	6%	0.062	C	C	.	.	H	α-helix	trans	-71.1	-36.4	175	0	0	0	0	0	112.7	I130 A141 L142 V145 M187 V188 H189 Q195	I130-A191 HydrophobicContact CD1-CB 3.7Å; I130-A191 HydrophobicContact CG1-CB 4.03Å; A141-A191 HydrophobicContact CB-CB 3.84Å; L142-A191 HydrophobicContact CB-CB 4.02Å; L142-A191 HydrophobicContact CD1-CB 4.35Å; V145-A191 HydrophobicContact CG2-CB 4.26Å; M187-A191 VanDerWaalsContact O-CB 3.26Å; M187-A191 WeakPolarHBondContact O-CB 3.44Å; M187-A191 PolarHBondContact O-N 3.33Å; M187-A191 VanDerWaalsContact O-N 3.16Å; V188-A191 PolarHBondContact O-N 3.46Å; H189-A191 PolarHBondContact O-N 2.95Å; H189-A191 VanDerWaalsContact O-N 3.12Å; A191-Q195 WeakPolarHBondContact O-CB 3.14Å; A191-Q195 PolarHBondContact O-N 3.17Å
192	D	98.6	Very high	96.4	Very high	4 Å²	4	7 Å²	7	2%	0.021	4%	0.041	C	C	.	.	H	α-helix	trans	-67.3	-48.2	176	-160	26.9	0	0	0	110.9	I130 V188 H189 T194 Q195 T196 K339 W347	I130-D192 HydrophobicContact CB-CB 4.23Å; I130-D192 HydrophobicContact CG1-CB 3.96Å; I130-D192 HydrophobicContact CG2-CB 3.95Å; V188-D192 PolarHBondContact O-N 3.01Å; H189-D192 WeakPolarHBondContact O-CA 3.43Å; H189-D192 WeakPolarHBondContact O-CB 3.36Å; H189-D192 PolarHBondContact O-N 3.04Å; D192-T194 PolarHBondContact O-N 3.45Å; D192-Q195 PolarHBondContact O-N 3.23Å; D192-T196 WeakPolarHBondContact O-CB 3.13Å; D192-T196 PolarHBondContact O-N 3.43Å; D192-T196 PolarHBondContact O-OG1 2.89Å; D192-K339 IonicContact OD1-NZ 2.66Å; D192-K339 PolarHBondContact OD1-NZ 2.77Å; D192-K339 IonicContact OD2-NZ 3.9Å; D192-K339 PolarHBondContact OD2-NZ 2.74Å; D192-W347 HydrophobicContact CB-CZ2 4.02Å; D192-W347 PolarHBondContact OD2-NE1 2.73Å
193	V	98.7	Very high	95.3	Very high	1 Å²	1	7.9 Å²	7.9	1%	0.006	5%	0.045	C	C	.	.	H	α-helix	trans	-59.4	-46.5	173.8	-179	0	0	0	0	110.9	H189 Q195 T196 A197 D333	H189-V193 WeakPolarHBondContact O-CG2 3.32Å; H189-V193 PolarHBondContact O-N 3.37Å; V193-Q195 VanDerWaalsContact C-N 3.32Å; V193-Q195 PolarHBondContact O-N 2.86Å; V193-T196 PolarHBondContact O-N 3.46Å; V193-A197 VanDerWaalsContact O-CB 3.27Å; V193-A197 WeakPolarHBondContact O-CB 3.35Å; V193-A197 PolarHBondContact O-N 3.07Å; V193-D333 HydrophobicContact CG1-CB 4.48Å
194	T	98.7	Very high	94	Very high	0 Å²	0	7 Å²	7	0%	0	4%	0.039	C	C	.	.	H	α-helix	trans	-58.2	-42.3	175.6	-60.2	0	0	0	0	112.5	V145 L149 A190 D192 H198 I219 A222 M223	V145-T194 HydrophobicContact CG1-CG2 3.65Å; L149-T194 HydrophobicContact CD1-CG2 3.59Å; A190-T194 VanDerWaalsContact O-CB 3.25Å; A190-T194 WeakPolarHBondContact O-CB 3.44Å; A190-T194 PolarHBondContact O-N 3.5Å; A190-T194 PolarHBondContact O-OG1 3.32Å; D192-T194 PolarHBondContact O-N 3.45Å; T194-H198 WeakPolarHBondContact O-CB 3.41Å; T194-H198 PolarHBondContact O-N 2.83Å; T194-I219 HydrophobicContact CG2-CG2 4.46Å; T194-A222 VanDerWaalsContact OG1-C 3.28Å; T194-A222 PolarHBondContact OG1-O 2.76Å; T194-M223 HydrophobicContact CG2-CG 3.53Å; T194-M223 HydrophobicContact CG2-SD 4.4Å; T194-M223 VanDerWaalsContact OG1-CA 3.3Å; T194-M223 WeakPolarHBondContact OG1-CA 3.27Å; T194-M223 VanDerWaalsContact OG1-CG 3.28Å; T194-M223 WeakPolarHBondContact OG1-CG 3.5Å; T194-M223 PolarHBondContact OG1-N 3.33Å
195	Q	97.4	Very high	92.4	Very high	1 Å²	1	6.8 Å²	6.8	1%	0.005	4%	0.038	C	C	.	.	H	α-helix	trans	-71.9	-35.6	178.8	-176	-82	-43.4	0	0	112.1	I123 N125 F128 V145 A191 D192 V193 W199	I123-Q195 HydrophobicContact CB-CG 4.37Å; I123-Q195 HydrophobicContact CG2-CG 4.34Å; I123-Q195 PolarHBondContact O-NE2 3.49Å; N125-Q195 PolarHBondContact O-NE2 3.39Å; F128-Q195 HydrophobicContact CB-CG 4.28Å; F128-Q195 HydrophobicContact CD1-CG 3.93Å; F128-Q195 HydrophobicContact CG-CG 4.23Å; V145-Q195 HydrophobicContact CG1-CB 4.17Å; V145-Q195 HydrophobicContact CG2-CB 4.48Å; A191-Q195 WeakPolarHBondContact O-CB 3.14Å; A191-Q195 PolarHBondContact O-N 3.17Å; D192-Q195 PolarHBondContact O-N 3.23Å; V193-Q195 VanDerWaalsContact C-N 3.32Å; V193-Q195 PolarHBondContact O-N 2.86Å; Q195-W199 PolarHBondContact O-N 3.15Å
196	T	97.6	Very high	91.1	Very high	0 Å²	0	5.9 Å²	5.9	0%	0	3%	0.034	C	C	.	.	H	α-helix	trans	-69.5	-44.4	177.6	-50.5	0	0	0	0	111.4	W126 D192 V193 H198 W199 L200 K339	W126-T196 HydrophobicContact CE3-CG2 4.16Å; W126-T196 HydrophobicContact CH2-CG2 3.76Å; W126-T196 HydrophobicContact CZ3-CG2 3.43Å; W126-T196 VanDerWaalsContact CZ3-CG2 3.43Å; D192-T196 WeakPolarHBondContact O-CB 3.13Å; D192-T196 PolarHBondContact O-N 3.43Å; D192-T196 PolarHBondContact O-OG1 2.89Å; V193-T196 PolarHBondContact O-N 3.46Å; T196-H198 VanDerWaalsContact C-N 3.33Å; T196-H198 PolarHBondContact O-N 3.03Å; T196-W199 WeakPolarHBondContact O-CA 3.44Å; T196-W199 WeakPolarHBondContact O-CB 3.2Å; T196-W199 PolarHBondContact O-N 2.88Å; T196-L200 PolarHBondContact O-N 3.07Å; T196-K339 WeakPolarHBondContact OG1-CE 3.24Å; T196-K339 PolarHBondContact OG1-NZ 2.63Å
197	A	97.1	Very high	89.7	Confident	0 Å²	0	6.7 Å²	6.7	0%	0	4%	0.04	C	C	.	.	H	α-helix	trans	-58.6	-45.4	175.1	0	0	0	0	0	111.3	V193 W199 L201 Y218 A222 I329 S332	V193-A197 VanDerWaalsContact O-CB 3.27Å; V193-A197 WeakPolarHBondContact O-CB 3.35Å; V193-A197 PolarHBondContact O-N 3.07Å; A197-W199 VanDerWaalsContact C-N 3.3Å; A197-W199 PolarHBondContact O-N 3.38Å; A197-L201 VanDerWaalsContact O-CB 3.27Å; A197-L201 WeakPolarHBondContact O-CB 3.46Å; A197-L201 PolarHBondContact O-N 2.97Å; A197-L201 VanDerWaalsContact O-N 3.09Å; A197-Y218 WeakPolarHBondContact CA-OH 3.45Å; A197-Y218 HydrophobicContact CB-CE1 3.98Å; A197-Y218 WeakPolarHBondContact O-CE1 3.49Å; A197-Y218 PolarHBondContact O-OH 3.22Å; A197-A222 HydrophobicContact CB-CB 3.84Å; A197-I329 HydrophobicContact CB-CD1 3.41Å; A197-I329 VanDerWaalsContact CB-CD1 3.41Å; A197-S332 WeakPolarHBondContact CA-OG 3.41Å; A197-S332 PolarHBondContact N-OG 3.08Å; A197-S332 VanDerWaalsContact N-OG 3.14Å
198	H	94.8	Very high	88.5	Confident	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.068	C	C	.	.	H	α-helix	trans	-58.3	-39.9	171.3	162.9	68.2	0	0	0	112.6	I123 N124 L149 K152 Y153 T194 T196 A202 I219	I123-H198 PolarHBondContact O-CD2 3.05Å; N124-H198 PolarHBondContact OD1-NE2 2.89Å; L149-H198 HydrophobicContact CD1-CB 3.91Å; L149-H198 HydrophobicContact CD2-CB 3.86Å; L149-H198 WeakPolarHBondContact CD2-ND1 3.24Å; K152-H198 PolarHBondContact NZ-CE1 3.33Å; Y153-H198 AromaticContact CE2-ND1 3.6Å; Y153-H198 AromaticContact CZ-ND1 3.64Å; Y153-H198 PolarHBondContact OH-CE1 3.34Å; Y153-H198 PolarHBondContact OH-ND1 3.16Å; T194-H198 WeakPolarHBondContact O-CB 3.41Å; T194-H198 PolarHBondContact O-N 2.83Å; T196-H198 VanDerWaalsContact C-N 3.33Å; T196-H198 PolarHBondContact O-N 3.03Å; H198-A202 WeakPolarHBondContact O-CB 3.34Å; H198-A202 PolarHBondContact O-N 3.25Å; H198-I219 HydrophobicContact CB-CD1 4.15Å
199	W	93.4	Very high	87.6	Confident	11 Å²	11	14.1 Å²	14.1	4%	0.042	8%	0.077	C	C	.	.	H	α-helix	trans	-67.9	-48.1	179	-172.4	91.3	0	0	0	112.7	N124 N125 W126 Q195 T196 A197 L201 A202 Q203 S435 P437 W438	N124-W199 VanDerWaalsContact C-CD1 3.48Å; N124-W199 PolarHBondContact O-NE1 3.49Å; N125-W199 VanDerWaalsContact C-CD1 3.46Å; W126-W199 HydrophobicContact CB-CD2 4.26Å; W126-W199 HydrophobicContact CB-CZ2 4.03Å; W126-W199 HydrophobicContact CD2-CE3 4.28Å; W126-W199 HydrophobicContact CD2-CZ3 4.35Å; W126-W199 AromaticContact CE3-CD2 3.64Å; W126-W199 HydrophobicContact CE3-CD2 3.64Å; W126-W199 AromaticContact CE3-CE3 3.24Å; W126-W199 HydrophobicContact CE3-CE3 3.24Å; W126-W199 HydrophobicContact CE3-CG 4.23Å; W126-W199 HydrophobicContact CE3-CH2 4.23Å; W126-W199 AromaticContact CE3-CZ3 3.59Å; W126-W199 HydrophobicContact CE3-CZ3 3.59Å; W126-W199 HydrophobicContact CZ3-CD2 4.39Å; W126-W199 AromaticContact CZ3-CE3 3.62Å; W126-W199 HydrophobicContact CZ3-CE3 3.62Å; W126-W199 AromaticContact CZ3-CZ3 3.92Å; W126-W199 HydrophobicContact CZ3-CZ3 3.92Å; Q195-W199 PolarHBondContact O-N 3.15Å; T196-W199 WeakPolarHBondContact O-CA 3.44Å; T196-W199 WeakPolarHBondContact O-CB 3.2Å; T196-W199 PolarHBondContact O-N 2.88Å; A197-W199 VanDerWaalsContact C-N 3.3Å; A197-W199 PolarHBondContact O-N 3.38Å; W199-L201 VanDerWaalsContact C-N 3.34Å; W199-L201 PolarHBondContact O-N 3.38Å; W199-A202 CarbonylContact O-C 3.16Å; W199-A202 WeakPolarHBondContact O-CA 3.03Å; W199-A202 WeakPolarHBondContact O-CB 3.27Å; W199-A202 PolarHBondContact O-N 3Å; W199-A202 VanDerWaalsContact O-N 3.09Å; W199-Q203 HydrophobicContact CD2-CG 3.96Å; W199-Q203 HydrophobicContact CE3-CG 3.66Å; W199-Q203 HydrophobicContact CH2-CG 3.37Å; W199-Q203 VanDerWaalsContact CZ2-CD 3.48Å; W199-Q203 HydrophobicContact CZ2-CG 3.64Å; W199-Q203 HydrophobicContact CZ3-CG 3.34Å; W199-Q203 PolarHBondContact O-N 3.01Å; W199-S435 WeakPolarHBondContact CH2-O 3.41Å; W199-P437 HydrophobicContact CH2-CG 4.08Å; W199-P437 HydrophobicContact CZ2-CG 4.17Å; W199-W438 HydrophobicContact CH2-CH2 4.29Å; W199-W438 AromaticContact CH2-CZ3 3.91Å; W199-W438 HydrophobicContact CH2-CZ3 3.91Å; W199-W438 AromaticContact CZ3-CH2 3.88Å; W199-W438 HydrophobicContact CZ3-CH2 3.88Å; W199-W438 AromaticContact CZ3-CZ3 3.54Å; W199-W438 HydrophobicContact CZ3-CZ3 3.54Å
200	L	92.5	Very high	87.1	Confident	0 Å²	0	14.9 Å²	14.9	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-58.9	-47.6	178.5	-70	174.3	0	0	0	110.8	W126 T196 A202 Q203 S204 L328 C331 S332 L403 W438	W126-L200 HydrophobicContact CH2-CD2 4.31Å; W126-L200 HydrophobicContact CZ3-CD2 3.81Å; W126-L200 HydrophobicContact CZ3-CG 4.11Å; T196-L200 PolarHBondContact O-N 3.07Å; L200-A202 VanDerWaalsContact C-N 3.28Å; L200-A202 PolarHBondContact O-N 3.38Å; L200-Q203 PolarHBondContact O-N 3.5Å; L200-S204 PolarHBondContact O-N 3.48Å; L200-L328 HydrophobicContact CB-CD2 4.23Å; L200-L328 HydrophobicContact CD1-CB 4.47Å; L200-L328 HydrophobicContact CD1-CD2 4.1Å; L200-L328 WeakPolarHBondContact CD1-O 3.13Å; L200-C331 HydrophobicContact CD1-CB 4.07Å; L200-S332 WeakPolarHBondContact CD1-OG 3.27Å; L200-L403 HydrophobicContact CD2-CD1 4.17Å; L200-W438 HydrophobicContact CD2-CH2 4.19Å; L200-W438 HydrophobicContact CD2-CZ3 4.33Å
201	L	88.5	Confident	86.9	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-54.6	-44.7	173.9	-174.7	84.7	0	0	0	111.4	A197 W199 Q203 S204 L206 V207 L210 L215 Y218	A197-L201 VanDerWaalsContact O-CB 3.27Å; A197-L201 WeakPolarHBondContact O-CB 3.46Å; A197-L201 PolarHBondContact O-N 2.97Å; A197-L201 VanDerWaalsContact O-N 3.09Å; W199-L201 VanDerWaalsContact C-N 3.34Å; W199-L201 PolarHBondContact O-N 3.38Å; L201-Q203 VanDerWaalsContact C-N 3.3Å; L201-Q203 PolarHBondContact O-N 3.23Å; L201-S204 PolarHBondContact O-N 2.67Å; L201-S204 PolarHBondContact O-OG 3.22Å; L201-L206 HydrophobicContact CD1-CB 3.63Å; L201-L206 HydrophobicContact CD1-CD1 4.14Å; L201-V207 HydrophobicContact CD2-CG2 3.9Å; L201-V207 HydrophobicContact CG-CG2 3.82Å; L201-L210 HydrophobicContact CD1-CD1 3.72Å; L201-L215 HydrophobicContact CD2-CD1 3.4Å; L201-Y218 HydrophobicContact CB-CE1 3.77Å; L201-Y218 HydrophobicContact CD1-CD1 4.17Å; L201-Y218 HydrophobicContact CD1-CE1 3.96Å; L201-Y218 HydrophobicContact CD2-CD1 4.24Å; L201-Y218 HydrophobicContact CD2-CE1 4.13Å; L201-Y218 HydrophobicContact CG-CE1 4.17Å
202	A	82.8	Confident	86.8	Confident	29 Å²	29	21.8 Å²	21.8	24%	0.24	12%	0.121	C	C	.	.	H	α-helix	trans	-70.2	-16.6	177.8	0	0	0	0	0	114.8	H198 W199 L200	H198-A202 WeakPolarHBondContact O-CB 3.34Å; H198-A202 PolarHBondContact O-N 3.25Å; W199-A202 CarbonylContact O-C 3.16Å; W199-A202 WeakPolarHBondContact O-CA 3.03Å; W199-A202 WeakPolarHBondContact O-CB 3.27Å; W199-A202 PolarHBondContact O-N 3Å; W199-A202 VanDerWaalsContact O-N 3.09Å; L200-A202 VanDerWaalsContact C-N 3.28Å; L200-A202 PolarHBondContact O-N 3.38Å
203	Q	75.9	Confident	86.7	Confident	29 Å²	29	22.5 Å²	22.5	14%	0.136	13%	0.125	C	C	.	.	H	α-helix	trans	-85.6	-35.5	168.5	-58.1	-49.9	-96.2	0	0	112.5	W199 L200 L201 G205 R433	W199-Q203 HydrophobicContact CD2-CG 3.96Å; W199-Q203 HydrophobicContact CE3-CG 3.66Å; W199-Q203 HydrophobicContact CH2-CG 3.37Å; W199-Q203 VanDerWaalsContact CZ2-CD 3.48Å; W199-Q203 HydrophobicContact CZ2-CG 3.64Å; W199-Q203 HydrophobicContact CZ3-CG 3.34Å; W199-Q203 PolarHBondContact O-N 3.01Å; L200-Q203 PolarHBondContact O-N 3.5Å; L201-Q203 VanDerWaalsContact C-N 3.3Å; L201-Q203 PolarHBondContact O-N 3.23Å; Q203-G205 VanDerWaalsContact C-N 3.34Å; Q203-G205 PolarHBondContact O-N 3.25Å; Q203-R433 PolarHBondContact OE1-O 2.89Å
204	S	70.2	Confident	86.7	Confident	0 Å²	0	24.2 Å²	24.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-69.9	-19.6	-168.4	69.1	0	0	0	0	116.4	L200 L201 L206 L403 L407	L200-S204 PolarHBondContact O-N 3.48Å; L201-S204 PolarHBondContact O-N 2.67Å; L201-S204 PolarHBondContact O-OG 3.22Å; S204-L206 PolarHBondContact O-N 3.46Å; S204-L206 WeakPolarHBondContact OG-CB 3.38Å; S204-L206 VanDerWaalsContact OG-CG 3.28Å; S204-L206 WeakPolarHBondContact OG-CG 3.24Å; S204-L206 PolarHBondContact OG-N 2.91Å; S204-L403 VanDerWaalsContact CB-CD2 3.4Å; S204-L407 PolarHBondContact O-N 3.02Å
205	G	65.6	Low	86.6	Confident	0 Å²	0	24.5 Å²	24.5	0%	0	13%	0.134	C	C	.	.	S	Bend	trans	77.3	-10.3	-164.9	0	0	0	0	0	114.9	Q203 V207 E208	Q203-G205 VanDerWaalsContact C-N 3.34Å; Q203-G205 PolarHBondContact O-N 3.25Å; G205-V207 PolarHBondContact O-N 3.34Å; G205-E208 PolarHBondContact O-N 3.16Å
206	L	69.5	Low	86.6	Confident	4 Å²	4	24.4 Å²	24.4	2%	0.021	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-53.8	-25.8	-179.2	-77.1	172.5	0	0	0	114.3	L201 S204 E208 C209 L210 L325 L328 L406	L201-L206 HydrophobicContact CD1-CB 3.63Å; L201-L206 HydrophobicContact CD1-CD1 4.14Å; S204-L206 PolarHBondContact O-N 3.46Å; S204-L206 WeakPolarHBondContact OG-CB 3.38Å; S204-L206 VanDerWaalsContact OG-CG 3.28Å; S204-L206 WeakPolarHBondContact OG-CG 3.24Å; S204-L206 PolarHBondContact OG-N 2.91Å; L206-E208 PolarHBondContact O-N 3.46Å; L206-C209 HydrophobicContact CD2-CB 4.29Å; L206-C209 PolarHBondContact O-N 2.96Å; L206-L210 HydrophobicContact CB-CD1 4.4Å; L206-L210 HydrophobicContact CB-CG 4.25Å; L206-L210 HydrophobicContact CD2-CD2 4.41Å; L206-L210 WeakPolarHBondContact O-CG 3.36Å; L206-L210 PolarHBondContact O-N 3.24Å; L206-L325 HydrophobicContact CD1-CD2 4.26Å; L206-L328 HydrophobicContact CD1-CD1 3.6Å; L206-L406 HydrophobicContact CD1-CD1 3.82Å; L206-L406 HydrophobicContact CD2-CD1 4.06Å; L206-L406 HydrophobicContact CD2-CD2 3.75Å; L206-L406 HydrophobicContact CD2-CG 4.41Å; L206-L406 HydrophobicContact CG-CD1 3.9Å; L206-L406 HydrophobicContact CG-CD2 4.45Å
207	V	69.2	Low	86.7	Confident	40 Å²	40	24.4 Å²	24.4	24%	0.242	13%	0.134	C	C	.	.	G	3₁₀ helix	trans	-50.7	-32.7	174.9	-174.8	0	0	0	0	112.1	Y153 L201 G205	Y153-V207 HydrophobicContact CE1-CG1 4.08Å; L201-V207 HydrophobicContact CD2-CG2 3.9Å; L201-V207 HydrophobicContact CG-CG2 3.82Å; G205-V207 PolarHBondContact O-N 3.34Å
208	E	72.6	Confident	86.7	Confident	137 Å²	137	24.4 Å²	24.4	64%	0.64	13%	0.134	S	C	*	.	G	3₁₀ helix	trans	-93.3	-13.4	178.1	-48.2	-58.4	136	0	0	113.3	G205 L206 L410	G205-E208 PolarHBondContact O-N 3.16Å; L206-E208 PolarHBondContact O-N 3.46Å; E208-L410 HydrophobicContact CB-CD1 4.23Å; E208-L410 HydrophobicContact CB-CD2 4.4Å
209	C	80.2	Confident	86.9	Confident	40 Å²	40	24.4 Å²	24.4	27%	0.27	13%	0.134	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.6	-19.5	-177.1	-55.4	0	0	0	0	113.7	L206 K321	L206-C209 HydrophobicContact CD2-CB 4.29Å; L206-C209 PolarHBondContact O-N 2.96Å; C209-K321 PolarHBondContact O-NZ 3.04Å
210	L	89.5	Confident	87.1	Confident	16 Å²	16	23.9 Å²	23.9	8%	0.084	13%	0.132	C	C	.	.	S	Bend	trans	-88.4	145.8	176.6	-63.5	-178.2	0	0	0	110.9	L201 L206 E214 L215 K321 L325	L201-L210 HydrophobicContact CD1-CD1 3.72Å; L206-L210 HydrophobicContact CB-CD1 4.4Å; L206-L210 HydrophobicContact CB-CG 4.25Å; L206-L210 HydrophobicContact CD2-CD2 4.41Å; L206-L210 WeakPolarHBondContact O-CG 3.36Å; L206-L210 PolarHBondContact O-N 3.24Å; L210-E214 HydrophobicContact CB-CB 4.18Å; L210-E214 HydrophobicContact CD2-CB 4.04Å; L210-E214 HydrophobicContact CG-CB 4.47Å; L210-L215 HydrophobicContact CB-CB 4.33Å; L210-L215 HydrophobicContact CD1-CB 4.33Å; L210-L215 HydrophobicContact CD1-CD1 4.5Å; L210-K321 HydrophobicContact CD2-CD 4.27Å; L210-L325 HydrophobicContact CD1-CD1 4.39Å; L210-L325 HydrophobicContact CD1-CD2 3.79Å; L210-L325 HydrophobicContact CD2-CD1 3.92Å; L210-L325 HydrophobicContact CD2-CD2 4.25Å; L210-L325 HydrophobicContact CD2-CG 4.41Å
211	T	94.1	Very high	87.4	Confident	77 Å²	77	23.9 Å²	23.9	47%	0.472	13%	0.132	S	C	.	.			trans	-64.7	157.5	159	63.1	0	0	0	0	110.5	L213 E214 L215	T211-L213 PolarHBondContact O-N 2.9Å; T211-L213 PolarHBondContact OG1-N 2.89Å; T211-E214 VanDerWaalsContact CB-OE2 3.25Å; T211-E214 WeakPolarHBondContact CB-OE2 3.29Å; T211-E214 VanDerWaalsContact CG2-OE2 3.29Å; T211-E214 WeakPolarHBondContact CG2-OE2 3.5Å; T211-E214 PolarHBondContact N-OE2 3.48Å; T211-E214 PolarHBondContact O-N 2.99Å; T211-E214 WeakPolarHBondContact OG1-CG 3.34Å; T211-E214 PolarHBondContact OG1-N 3.34Å; T211-E214 PolarHBondContact OG1-OE2 3.06Å; T211-L215 VanDerWaalsContact O-CB 3.28Å; T211-L215 WeakPolarHBondContact O-CB 3.4Å; T211-L215 PolarHBondContact O-N 3.23Å
212	D	95.4	Very high	87.9	Confident	68 Å²	68	23.9 Å²	23.9	36%	0.364	13%	0.132	S	C	.	.	H	α-helix	trans	-56.5	-19.7	172.1	-86.8	-25.1	0	0	0	113.7	K158 Y159 F216	K158-D212 HydrophobicContact CD-CB 4.3Å; K158-D212 VanDerWaalsContact CD-OD2 3.23Å; K158-D212 WeakPolarHBondContact CD-OD2 3.36Å; K158-D212 WeakPolarHBondContact CE-OD1 3.42Å; K158-D212 WeakPolarHBondContact CE-OD2 3.27Å; K158-D212 IonicContact NZ-OD1 3.92Å; K158-D212 PolarHBondContact NZ-OD1 2.82Å; K158-D212 IonicContact NZ-OD2 3.89Å; K158-D212 PolarHBondContact NZ-OD2 2.86Å; K158-D212 VanDerWaalsContact NZ-OD2 3.1Å; Y159-D212 WeakPolarHBondContact OH-CB 3.43Å; Y159-D212 PolarHBondContact OH-O 3.33Å; D212-F216 VanDerWaalsContact O-CB 3.3Å; D212-F216 WeakPolarHBondContact O-CB 3.41Å; D212-F216 PolarHBondContact O-N 3.38Å
213	L	98	Very high	88.7	Confident	19 Å²	19	22.5 Å²	22.5	10%	0.099	12%	0.121	C	C	.	.	H	α-helix	trans	-88.7	-43.2	-177.5	-168.8	71	0	0	0	111.3	Y159 T211 L215 F216 A217 L278 E282 E285 F286	Y159-L213 HydrophobicContact CE1-CD1 3.97Å; Y159-L213 WeakPolarHBondContact OH-CA 3.34Å; Y159-L213 PolarHBondContact OH-N 3.01Å; T211-L213 PolarHBondContact O-N 2.9Å; T211-L213 PolarHBondContact OG1-N 2.89Å; L213-L215 VanDerWaalsContact C-N 3.3Å; L213-F216 PolarHBondContact O-N 3.49Å; L213-A217 WeakPolarHBondContact O-CB 3.18Å; L213-A217 PolarHBondContact O-N 3.1Å; L213-L278 HydrophobicContact CD1-CD1 4.5Å; L213-L278 HydrophobicContact CD1-CD2 4.33Å; L213-E282 HydrophobicContact CD1-CB 4.16Å; L213-E282 HydrophobicContact CD2-CB 3.95Å; L213-E282 HydrophobicContact CD2-CG 4.17Å; L213-E285 HydrophobicContact CD2-CB 3.83Å; L213-F286 HydrophobicContact CD1-CB 4.16Å; L213-F286 HydrophobicContact CD1-CD2 4.21Å; L213-F286 HydrophobicContact CG-CB 4.38Å
214	E	97.3	Very high	89.8	Confident	38 Å²	38	21.1 Å²	21.1	18%	0.178	11%	0.114	C	C	.	.	H	α-helix	trans	-60.1	-43.4	169.4	-68.1	158.7	114.7	0	0	110.6	L210 T211 F216 A217 Y218 L289 K321 L325	L210-E214 HydrophobicContact CB-CB 4.18Å; L210-E214 HydrophobicContact CD2-CB 4.04Å; L210-E214 HydrophobicContact CG-CB 4.47Å; T211-E214 VanDerWaalsContact CB-OE2 3.25Å; T211-E214 WeakPolarHBondContact CB-OE2 3.29Å; T211-E214 VanDerWaalsContact CG2-OE2 3.29Å; T211-E214 WeakPolarHBondContact CG2-OE2 3.5Å; T211-E214 PolarHBondContact N-OE2 3.48Å; T211-E214 PolarHBondContact O-N 2.99Å; T211-E214 WeakPolarHBondContact OG1-CG 3.34Å; T211-E214 PolarHBondContact OG1-N 3.34Å; T211-E214 PolarHBondContact OG1-OE2 3.06Å; E214-F216 VanDerWaalsContact C-N 3.35Å; E214-F216 PolarHBondContact O-N 3.47Å; E214-A217 PolarHBondContact O-N 3.3Å; E214-Y218 WeakPolarHBondContact O-CB 3.48Å; E214-Y218 PolarHBondContact O-N 3.2Å; E214-L289 HydrophobicContact CB-CD2 3.98Å; E214-L289 HydrophobicContact CG-CD2 3.87Å; E214-K321 VanDerWaalsContact OE1-CD 3.29Å; E214-K321 WeakPolarHBondContact OE1-CD 3.32Å; E214-L325 HydrophobicContact CB-CD1 4.4Å
215	L	96.2	Very high	91.2	Very high	5 Å²	5	21.1 Å²	21.1	3%	0.026	11%	0.114	C	C	.	.	H	α-helix	trans	-62.1	-39.3	176.4	178.8	54.2	0	0	0	112.6	Y153 F155 L201 L210 T211 L213 I219	Y153-L215 HydrophobicContact CD1-CD1 4.33Å; Y153-L215 HydrophobicContact CD1-CD2 3.78Å; Y153-L215 HydrophobicContact CD1-CG 4.35Å; Y153-L215 HydrophobicContact CE1-CD1 4.24Å; Y153-L215 HydrophobicContact CE1-CD2 4.24Å; Y153-L215 HydrophobicContact CG-CD2 4.28Å; Y153-L215 HydrophobicContact CG-CG 4.47Å; F155-L215 HydrophobicContact CE1-CB 4.49Å; F155-L215 HydrophobicContact CE1-CD2 4.46Å; F155-L215 HydrophobicContact CE1-CG 3.94Å; F155-L215 HydrophobicContact CZ-CG 3.95Å; F155-L215 WeakPolarHBondContact CZ-O 3.5Å; L201-L215 HydrophobicContact CD2-CD1 3.4Å; L210-L215 HydrophobicContact CB-CB 4.33Å; L210-L215 HydrophobicContact CD1-CB 4.33Å; L210-L215 HydrophobicContact CD1-CD1 4.5Å; T211-L215 VanDerWaalsContact O-CB 3.28Å; T211-L215 WeakPolarHBondContact O-CB 3.4Å; T211-L215 PolarHBondContact O-N 3.23Å; L213-L215 VanDerWaalsContact C-N 3.3Å; L215-I219 WeakPolarHBondContact O-CG1 3.36Å; L215-I219 PolarHBondContact O-N 2.97Å
216	F	98.3	Very high	92.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-69.6	-43.9	173.7	176.9	-150.1	0	0	0	111.6	F150 F155 Y159 I161 D212 L213 E214 F220 I274 L275 F286	F150-F216 HydrophobicContact CE1-CD2 4.33Å; F150-F216 AromaticContact CE1-CE2 3.65Å; F150-F216 HydrophobicContact CE1-CE2 3.65Å; F150-F216 HydrophobicContact CE1-CZ 4.45Å; F150-F216 HydrophobicContact CZ-CD2 4.17Å; F150-F216 AromaticContact CZ-CE2 3.63Å; F150-F216 HydrophobicContact CZ-CE2 3.63Å; F155-F216 HydrophobicContact CB-CD2 4.46Å; F155-F216 HydrophobicContact CD1-CB 3.9Å; F155-F216 HydrophobicContact CD1-CD2 4.45Å; F155-F216 HydrophobicContact CD1-CG 4.32Å; F155-F216 AromaticContact CD2-CD2 3.95Å; F155-F216 HydrophobicContact CD2-CD2 3.95Å; F155-F216 HydrophobicContact CE1-CB 3.75Å; F155-F216 HydrophobicContact CE2-CD2 4.26Å; F155-F216 HydrophobicContact CG-CB 4.38Å; F155-F216 HydrophobicContact CG-CD2 4.07Å; F155-F216 HydrophobicContact CG-CG 4.35Å; F155-F216 HydrophobicContact CZ-CB 4.13Å; Y159-F216 HydrophobicContact CD2-CB 4.42Å; Y159-F216 AromaticContact CD2-CD1 3.38Å; Y159-F216 HydrophobicContact CD2-CD1 3.38Å; Y159-F216 AromaticContact CD2-CE1 3.8Å; Y159-F216 HydrophobicContact CD2-CE1 3.8Å; Y159-F216 HydrophobicContact CD2-CG 4.02Å; Y159-F216 HydrophobicContact CE2-CB 3.79Å; Y159-F216 AromaticContact CE2-CD1 3.45Å; Y159-F216 HydrophobicContact CE2-CD1 3.45Å; Y159-F216 VanDerWaalsContact CE2-CD1 3.45Å; Y159-F216 HydrophobicContact CE2-CE1 4.32Å; Y159-F216 AromaticContact CE2-CG 3.88Å; Y159-F216 HydrophobicContact CE2-CG 3.88Å; Y159-F216 HydrophobicContact CG-CD1 4.1Å; Y159-F216 HydrophobicContact CG-CE1 4.19Å; I161-F216 HydrophobicContact CD1-CE1 4.43Å; I161-F216 HydrophobicContact CD1-CZ 3.93Å; D212-F216 VanDerWaalsContact O-CB 3.3Å; D212-F216 WeakPolarHBondContact O-CB 3.41Å; D212-F216 PolarHBondContact O-N 3.38Å; L213-F216 PolarHBondContact O-N 3.49Å; E214-F216 VanDerWaalsContact C-N 3.35Å; E214-F216 PolarHBondContact O-N 3.47Å; F216-F220 HydrophobicContact CD2-CB 4.5Å; F216-F220 HydrophobicContact CE2-CB 4.42Å; F216-F220 HydrophobicContact CE2-CD2 4.45Å; F216-F220 WeakPolarHBondContact O-CB 3.5Å; F216-F220 PolarHBondContact O-N 3.33Å; F216-I274 HydrophobicContact CZ-CD1 4.3Å; F216-L275 HydrophobicContact CE1-CD2 3.73Å; F216-L275 HydrophobicContact CZ-CD2 3.63Å; F216-F286 HydrophobicContact CB-CE2 4.34Å; F216-F286 AromaticContact CD1-CD2 3.81Å; F216-F286 HydrophobicContact CD1-CD2 3.81Å; F216-F286 AromaticContact CD1-CE2 3.44Å; F216-F286 HydrophobicContact CD1-CE2 3.44Å; F216-F286 VanDerWaalsContact CD1-CE2 3.44Å; F216-F286 HydrophobicContact CD1-CZ 4.43Å; F216-F286 AromaticContact CD2-CE2 3.97Å; F216-F286 HydrophobicContact CD2-CE2 3.97Å; F216-F286 HydrophobicContact CE1-CD2 4.1Å; F216-F286 AromaticContact CE1-CE2 3.56Å; F216-F286 HydrophobicContact CE1-CE2 3.56Å; F216-F286 HydrophobicContact CE1-CZ 4.14Å; F216-F286 HydrophobicContact CE2-CE2 4.04Å; F216-F286 HydrophobicContact CE2-CZ 4.31Å; F216-F286 HydrophobicContact CG-CD2 4.28Å; F216-F286 AromaticContact CG-CE2 3.66Å; F216-F286 HydrophobicContact CG-CE2 3.66Å; F216-F286 AromaticContact CZ-CE2 3.85Å; F216-F286 HydrophobicContact CZ-CE2 3.85Å; F216-F286 HydrophobicContact CZ-CZ 4.07Å
217	A	98.7	Very high	94.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-61.3	-43.1	177.6	0	0	0	0	0	112.4	L213 E214 F220 S221 F286 L289 V290	L213-A217 WeakPolarHBondContact O-CB 3.18Å; L213-A217 PolarHBondContact O-N 3.1Å; E214-A217 PolarHBondContact O-N 3.3Å; A217-F220 PolarHBondContact O-N 2.97Å; A217-S221 WeakPolarHBondContact O-CB 3.19Å; A217-S221 PolarHBondContact O-N 3.09Å; A217-S221 PolarHBondContact O-OG 3.39Å; A217-F286 HydrophobicContact CB-CD2 3.81Å; A217-F286 HydrophobicContact CB-CE2 4.06Å; A217-F286 HydrophobicContact CB-CG 4.45Å; A217-L289 HydrophobicContact CB-CB 4.24Å; A217-L289 HydrophobicContact CB-CD2 3.71Å; A217-L289 HydrophobicContact CB-CG 3.96Å; A217-V290 HydrophobicContact CB-CG2 3.88Å
218	Y	98.2	Very high	95.5	Very high	0 Å²	0	21.2 Å²	21.2	0%	0	11%	0.112	C	C	.	.	H	α-helix	trans	-61.6	-53.1	178	173.6	-104.8	0	0	0	112.4	A197 L201 E214 F220 S221 A222 L325 L328 I329	A197-Y218 WeakPolarHBondContact CA-OH 3.45Å; A197-Y218 HydrophobicContact CB-CE1 3.98Å; A197-Y218 WeakPolarHBondContact O-CE1 3.49Å; A197-Y218 PolarHBondContact O-OH 3.22Å; L201-Y218 HydrophobicContact CB-CE1 3.77Å; L201-Y218 HydrophobicContact CD1-CD1 4.17Å; L201-Y218 HydrophobicContact CD1-CE1 3.96Å; L201-Y218 HydrophobicContact CD2-CD1 4.24Å; L201-Y218 HydrophobicContact CD2-CE1 4.13Å; L201-Y218 HydrophobicContact CG-CE1 4.17Å; E214-Y218 WeakPolarHBondContact O-CB 3.48Å; E214-Y218 PolarHBondContact O-N 3.2Å; Y218-F220 VanDerWaalsContact C-N 3.31Å; Y218-F220 PolarHBondContact O-N 2.72Å; Y218-S221 PolarHBondContact O-N 3.36Å; Y218-A222 PolarHBondContact O-N 2.88Å; Y218-A222 VanDerWaalsContact O-N 3.12Å; Y218-L325 HydrophobicContact CD2-CB 3.91Å; Y218-L325 HydrophobicContact CD2-CD2 3.44Å; Y218-L325 VanDerWaalsContact CD2-CD2 3.44Å; Y218-L325 HydrophobicContact CD2-CG 4.2Å; Y218-L325 HydrophobicContact CE2-CB 4.43Å; Y218-L325 HydrophobicContact CE2-CD2 3.86Å; Y218-L325 HydrophobicContact CG-CD2 3.78Å; Y218-L328 HydrophobicContact CE2-CB 4.02Å; Y218-I329 HydrophobicContact CD2-CD1 3.67Å; Y218-I329 HydrophobicContact CD2-CG1 3.82Å; Y218-I329 HydrophobicContact CE1-CD1 4.43Å; Y218-I329 HydrophobicContact CE2-CD1 3.29Å; Y218-I329 HydrophobicContact CE2-CG1 3.66Å; Y218-I329 HydrophobicContact CG-CD1 4.42Å
219	I	98.4	Very high	96.7	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-65.6	-35.1	178.2	-61	-60.9	0	0	0	111.3	L149 F150 Y153 F155 T194 H198 L215 M223	L149-I219 HydrophobicContact CB-CG2 4.21Å; L149-I219 HydrophobicContact CD1-CD1 4.45Å; L149-I219 HydrophobicContact CD1-CG2 3.96Å; F150-I219 HydrophobicContact CE2-CG2 4.35Å; Y153-I219 HydrophobicContact CD2-CG1 4.44Å; Y153-I219 HydrophobicContact CE2-CD1 4.38Å; Y153-I219 HydrophobicContact CE2-CG1 4.32Å; F155-I219 HydrophobicContact CE2-CB 4.07Å; F155-I219 HydrophobicContact CE2-CG1 4.31Å; F155-I219 HydrophobicContact CE2-CG2 4.2Å; F155-I219 HydrophobicContact CZ-CB 4.4Å; F155-I219 HydrophobicContact CZ-CG1 4.28Å; T194-I219 HydrophobicContact CG2-CG2 4.46Å; H198-I219 HydrophobicContact CB-CD1 4.15Å; L215-I219 WeakPolarHBondContact O-CG1 3.36Å; L215-I219 PolarHBondContact O-N 2.97Å; I219-M223 HydrophobicContact CG2-SD 4.39Å; I219-M223 WeakPolarHBondContact O-CG 3.38Å; I219-M223 PolarHBondContact O-N 2.8Å
220	F	98.9	Very high	97.6	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	7%	0.072	C	C	.	.	H	α-helix	trans	-65	-44.1	173.7	-177.8	-90.6	0	0	0	111.9	F169 F216 A217 Y218 A222 M223 V224 I262 M266 I274 F286 V290	F169-F220 HydrophobicContact CE1-CE2 4.05Å; F169-F220 HydrophobicContact CE2-CE2 4.25Å; F169-F220 HydrophobicContact CE2-CZ 4.5Å; F169-F220 HydrophobicContact CZ-CD2 4.49Å; F169-F220 AromaticContact CZ-CE2 3.49Å; F169-F220 HydrophobicContact CZ-CE2 3.49Å; F169-F220 VanDerWaalsContact CZ-CE2 3.49Å; F169-F220 AromaticContact CZ-CZ 3.98Å; F169-F220 HydrophobicContact CZ-CZ 3.98Å; F216-F220 HydrophobicContact CD2-CB 4.5Å; F216-F220 HydrophobicContact CE2-CB 4.42Å; F216-F220 HydrophobicContact CE2-CD2 4.45Å; F216-F220 WeakPolarHBondContact O-CB 3.5Å; F216-F220 PolarHBondContact O-N 3.33Å; A217-F220 PolarHBondContact O-N 2.97Å; Y218-F220 VanDerWaalsContact C-N 3.31Å; Y218-F220 PolarHBondContact O-N 2.72Å; F220-A222 PolarHBondContact O-N 3.23Å; F220-M223 WeakPolarHBondContact O-CB 3.3Å; F220-M223 PolarHBondContact O-N 2.78Å; F220-M223 VanDerWaalsContact O-N 3.08Å; F220-V224 HydrophobicContact CD1-CG1 4.32Å; F220-V224 HydrophobicContact CD1-CG2 3.95Å; F220-V224 HydrophobicContact CE1-CB 4.47Å; F220-V224 HydrophobicContact CE1-CG1 3.99Å; F220-V224 HydrophobicContact CE1-CG2 3.74Å; F220-V224 HydrophobicContact CE2-CG1 4.21Å; F220-V224 HydrophobicContact CZ-CG1 3.92Å; F220-V224 HydrophobicContact CZ-CG2 4.46Å; F220-V224 WeakPolarHBondContact O-CG1 3.44Å; F220-V224 WeakPolarHBondContact O-CG2 3.38Å; F220-V224 PolarHBondContact O-N 2.81Å; F220-I262 HydrophobicContact CE1-CG2 4.45Å; F220-I262 HydrophobicContact CZ-CG1 3.98Å; F220-M266 HydrophobicContact CE1-CE 4.33Å; F220-M266 HydrophobicContact CE2-CE 4.32Å; F220-M266 HydrophobicContact CE2-SD 4.4Å; F220-M266 HydrophobicContact CZ-CE 3.57Å; F220-M266 HydrophobicContact CZ-SD 4.2Å; F220-I274 HydrophobicContact CD2-CD1 4.11Å; F220-I274 HydrophobicContact CE2-CD1 3.89Å; F220-I274 HydrophobicContact CE2-CG1 4.5Å; F220-F286 HydrophobicContact CB-CE2 4.22Å; F220-F286 HydrophobicContact CB-CZ 3.79Å; F220-F286 HydrophobicContact CD1-CE1 4.02Å; F220-F286 AromaticContact CD1-CZ 3.69Å; F220-F286 HydrophobicContact CD1-CZ 3.69Å; F220-F286 HydrophobicContact CD2-CZ 4.06Å; F220-F286 HydrophobicContact CE1-CE1 4.22Å; F220-F286 HydrophobicContact CE1-CZ 4.26Å; F220-F286 HydrophobicContact CG-CE1 4.33Å; F220-F286 HydrophobicContact CG-CE2 4.47Å; F220-F286 AromaticContact CG-CZ 3.57Å; F220-F286 HydrophobicContact CG-CZ 3.57Å; F220-V290 HydrophobicContact CD1-CG1 3.86Å; F220-V290 HydrophobicContact CD1-CG2 3.85Å; F220-V290 HydrophobicContact CE1-CG1 4.01Å
221	S	98.9	Very high	97.9	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-58.8	-47	178.7	-55.7	0	0	0	0	111.2	A217 Y218 M223 V224 H225 V290 I293	A217-S221 WeakPolarHBondContact O-CB 3.19Å; A217-S221 PolarHBondContact O-N 3.09Å; A217-S221 PolarHBondContact O-OG 3.39Å; Y218-S221 PolarHBondContact O-N 3.36Å; S221-M223 PolarHBondContact O-N 3.01Å; S221-M223 VanDerWaalsContact O-N 3.17Å; S221-V224 PolarHBondContact O-N 3.43Å; S221-H225 PolarHBondContact O-N 3.12Å; S221-V290 WeakPolarHBondContact OG-CA 3.21Å; S221-I293 VanDerWaalsContact CB-CG2 3.43Å
222	A	98.9	Very high	98	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-56.9	-32.9	176	0	0	0	0	0	113.2	T194 A197 Y218 F220 H225 I329	T194-A222 VanDerWaalsContact OG1-C 3.28Å; T194-A222 PolarHBondContact OG1-O 2.76Å; A197-A222 HydrophobicContact CB-CB 3.84Å; Y218-A222 PolarHBondContact O-N 2.88Å; Y218-A222 VanDerWaalsContact O-N 3.12Å; F220-A222 PolarHBondContact O-N 3.23Å; A222-H225 PolarHBondContact O-CE1 2.99Å; A222-H225 PolarHBondContact O-ND1 2.83Å; A222-I329 HydrophobicContact CB-CD1 3.7Å
223	M	98.8	Very high	98	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	4%	0.038	C	C	.	.	H	α-helix	trans	-78.3	-13.7	178.2	-71.9	172.6	37.2	0	0	114.9	L142 A146 F150 F169 L170 L173 Y177 T194 I219 F220 S221	L142-M223 HydrophobicContact CD1-CB 4.28Å; L142-M223 HydrophobicContact CD1-CG 4.1Å; A146-M223 HydrophobicContact CB-CE 3.6Å; A146-M223 HydrophobicContact CB-SD 3.51Å; A146-M223 VanDerWaalsContact CB-SD 3.51Å; F150-M223 HydrophobicContact CD2-SD 4.4Å; F150-M223 HydrophobicContact CE2-CE 4.11Å; F150-M223 HydrophobicContact CE2-SD 3.57Å; F150-M223 VanDerWaalsContact CE2-SD 3.57Å; F150-M223 HydrophobicContact CZ-CE 4.38Å; F150-M223 HydrophobicContact CZ-SD 4.3Å; F169-M223 HydrophobicContact CE1-CE 4.25Å; L170-M223 HydrophobicContact CD2-CE 3.54Å; L173-M223 HydrophobicContact CD2-CB 4.38Å; L173-M223 HydrophobicContact CD2-CE 3.97Å; Y177-M223 PolarHBondContact OH-O 2.68Å; T194-M223 HydrophobicContact CG2-CG 3.53Å; T194-M223 HydrophobicContact CG2-SD 4.4Å; T194-M223 VanDerWaalsContact OG1-CA 3.3Å; T194-M223 WeakPolarHBondContact OG1-CA 3.27Å; T194-M223 VanDerWaalsContact OG1-CG 3.28Å; T194-M223 WeakPolarHBondContact OG1-CG 3.5Å; T194-M223 PolarHBondContact OG1-N 3.33Å; I219-M223 HydrophobicContact CG2-SD 4.39Å; I219-M223 WeakPolarHBondContact O-CG 3.38Å; I219-M223 PolarHBondContact O-N 2.8Å; F220-M223 WeakPolarHBondContact O-CB 3.3Å; F220-M223 PolarHBondContact O-N 2.78Å; F220-M223 VanDerWaalsContact O-N 3.08Å; S221-M223 PolarHBondContact O-N 3.01Å; S221-M223 VanDerWaalsContact O-N 3.17Å
224	V	98.9	Very high	97.8	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-135.1	-2.7	-166.8	-48	0	0	0	0	114.6	F169 L173 F220 S221 D226 Y227 I262 V294	F169-V224 HydrophobicContact CZ-CG1 4.43Å; L173-V224 HydrophobicContact CD1-CB 4.46Å; L173-V224 HydrophobicContact CD1-CG1 3.87Å; L173-V224 HydrophobicContact CD2-CG1 4.48Å; F220-V224 HydrophobicContact CD1-CG1 4.32Å; F220-V224 HydrophobicContact CD1-CG2 3.95Å; F220-V224 HydrophobicContact CE1-CB 4.47Å; F220-V224 HydrophobicContact CE1-CG1 3.99Å; F220-V224 HydrophobicContact CE1-CG2 3.74Å; F220-V224 HydrophobicContact CE2-CG1 4.21Å; F220-V224 HydrophobicContact CZ-CG1 3.92Å; F220-V224 HydrophobicContact CZ-CG2 4.46Å; F220-V224 WeakPolarHBondContact O-CG1 3.44Å; F220-V224 WeakPolarHBondContact O-CG2 3.38Å; F220-V224 PolarHBondContact O-N 2.81Å; S221-V224 PolarHBondContact O-N 3.43Å; V224-D226 PolarHBondContact O-N 2.99Å; V224-Y227 VanDerWaalsContact O-CB 3.26Å; V224-Y227 WeakPolarHBondContact O-CB 3.33Å; V224-Y227 PolarHBondContact O-N 3.15Å; V224-I262 HydrophobicContact CB-CB 4.42Å; V224-I262 HydrophobicContact CB-CG1 4.05Å; V224-I262 HydrophobicContact CB-CG2 4.32Å; V224-I262 HydrophobicContact CG1-CD1 4.22Å; V224-I262 HydrophobicContact CG1-CG1 3.9Å; V224-I262 HydrophobicContact CG2-CG2 4.07Å; V224-V294 HydrophobicContact CG2-CG2 4.48Å
225	H	98.8	Very high	97.6	Very high	0 Å²	0	5.7 Å²	5.7	0%	0	3%	0.03	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.2	-41.4	-176.1	64.2	-76.9	0	0	0	112.6	H189 S221 A222 H258 V294 T297	H189-H225 AromaticContact CD2-NE2 3.82Å; S221-H225 PolarHBondContact O-N 3.12Å; A222-H225 PolarHBondContact O-CE1 2.99Å; A222-H225 PolarHBondContact O-ND1 2.83Å; H225-H258 WeakPolarHBondContact O-CB 3.45Å; H225-H258 PolarHBondContact O-CD2 2.9Å; H225-V294 HydrophobicContact CB-CG2 4.28Å; H225-T297 HydrophobicContact CB-CG2 4.06Å
226	D	98.7	Very high	97.4	Very high	9 Å²	9	5.5 Å²	5.5	5%	0.048	3%	0.029	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.4	23.7	177.1	-88.5	8.3	0	0	0	114.6	Y177 H185 H189 V224 E228 H229	Y177-D226 HydrophobicContact CE1-CB 3.43Å; Y177-D226 VanDerWaalsContact CE1-CB 3.43Å; Y177-D226 VanDerWaalsContact CE1-O 3.24Å; Y177-D226 WeakPolarHBondContact CE1-O 3.4Å; Y177-D226 PolarHBondContact OH-N 3.28Å; H185-D226 IonicContact CD2-OD2 2.97Å; H185-D226 PolarHBondContact CD2-OD2 3.5Å; H185-D226 IonicContact CG-OD2 2.79Å; H189-D226 IonicContact CD2-OD2 3.43Å; H189-D226 PolarHBondContact CD2-OD2 3.01Å; H189-D226 VanDerWaalsContact CD2-OD2 3.31Å; V224-D226 PolarHBondContact O-N 2.99Å; D226-E228 PolarHBondContact O-N 3.4Å; D226-E228 VanDerWaalsContact O-N 3.1Å; D226-H229 HydrophobicContact CB-CB 4.11Å; D226-H229 WeakPolarHBondContact O-CB 3.18Å; D226-H229 PolarHBondContact O-N 3.16Å
227	Y	98.8	Very high	97.2	Very high	3 Å²	3	5.5 Å²	5.5	1%	0.012	3%	0.029	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	118.4	-171.3	-178.4	-118.4	0	0	0	113.6	K172 L173 Y177 V224 H229 H258 A261 I262 L265	K172-Y227 PolarHBondContact O-OH 2.81Å; L173-Y227 HydrophobicContact CD1-CD2 3.57Å; L173-Y227 HydrophobicContact CD1-CE2 3.99Å; L173-Y227 HydrophobicContact CD1-CG 4.23Å; L173-Y227 WeakPolarHBondContact O-CE2 3.42Å; Y177-Y227 HydrophobicContact CD2-CD2 4.43Å; Y177-Y227 HydrophobicContact CE2-CD2 4.37Å; V224-Y227 VanDerWaalsContact O-CB 3.26Å; V224-Y227 WeakPolarHBondContact O-CB 3.33Å; V224-Y227 PolarHBondContact O-N 3.15Å; Y227-H229 VanDerWaalsContact C-N 3.32Å; Y227-H258 WeakPolarHBondContact O-CA 3.39Å; Y227-H258 PolarHBondContact O-ND1 2.84Å; Y227-A261 HydrophobicContact CD1-CB 3.91Å; Y227-A261 HydrophobicContact CE1-CB 4.18Å; Y227-I262 HydrophobicContact CD1-CB 3.7Å; Y227-I262 HydrophobicContact CD1-CD1 3.66Å; Y227-I262 HydrophobicContact CD1-CG1 4.27Å; Y227-I262 HydrophobicContact CD2-CD1 4.18Å; Y227-I262 HydrophobicContact CE1-CB 4.35Å; Y227-I262 HydrophobicContact CE1-CD1 3.8Å; Y227-I262 HydrophobicContact CE2-CD1 4.3Å; Y227-I262 HydrophobicContact CG-CB 4.23Å; Y227-I262 HydrophobicContact CG-CD1 3.85Å; Y227-L265 HydrophobicContact CE1-CD2 4.42Å
228	E	98.3	Very high	96.8	Very high	34 Å²	34	8.7 Å²	8.7	16%	0.159	5%	0.048	C	C	.	.	T	Hydrogen-bonded Turn	trans	64.8	28.3	-169.7	-54.1	-157	148.6	0	0	114.2	K179 D226 T230 H257	K179-E228 HydrophobicContact CD-CB 3.94Å; K179-E228 HydrophobicContact CD-CG 3.92Å; K179-E228 IonicContact NZ-OE2 2.71Å; K179-E228 PolarHBondContact NZ-OE2 3.39Å; D226-E228 PolarHBondContact O-N 3.4Å; D226-E228 VanDerWaalsContact O-N 3.1Å; E228-T230 VanDerWaalsContact O-CG2 3.32Å; E228-T230 WeakPolarHBondContact O-CG2 3.48Å; E228-T230 PolarHBondContact O-N 3.33Å; E228-H257 IonicContact OE2-NE2 2.63Å
229	H	98.4	Very high	96.5	Very high	8 Å²	8	12.4 Å²	12.4	4%	0.037	7%	0.066	C	C	.	.			trans	-47.9	136.2	166.7	-163.2	-82.4	0	0	0	111.2	H180 N182 H185 D226 Y227 G231 H232 H258 E354	H180-H229 PolarHBondContact CD2-O 3.46Å; N182-H229 PolarHBondContact ND2-O 2.74Å; H185-H229 HydrophobicContact CB-CB 3.83Å; H185-H229 VanDerWaalsContact CB-CG 3.47Å; H185-H229 WeakPolarHBondContact CB-ND1 3.36Å; H185-H229 AromaticContact CD2-CE1 3.93Å; H185-H229 AromaticContact CD2-NE2 3.93Å; H185-H229 AromaticContact CE1-CE1 3.67Å; H185-H229 AromaticContact CG-CE1 3.38Å; H185-H229 AromaticContact CG-CG 3.81Å; H185-H229 AromaticContact CG-ND1 3.39Å; H185-H229 AromaticContact CG-NE2 3.82Å; H185-H229 AromaticContact ND1-CE1 3.2Å; H185-H229 PolarHBondContact ND1-CE1 3.48Å; H185-H229 AromaticContact ND1-ND1 3.54Å; H185-H229 AromaticContact ND1-NE2 3.9Å; D226-H229 HydrophobicContact CB-CB 4.11Å; D226-H229 WeakPolarHBondContact O-CB 3.18Å; D226-H229 PolarHBondContact O-N 3.16Å; Y227-H229 VanDerWaalsContact C-N 3.32Å; H229-G231 PolarHBondContact ND1-N 3.34Å; H229-H232 PolarHBondContact CE1-O 3.39Å; H229-H258 VanDerWaalsContact CA-CE1 3.44Å; H229-H258 WeakPolarHBondContact CA-CE1 3.08Å; H229-H258 AromaticContact CD2-CE1 3.99Å; H229-H258 AromaticContact CD2-NE2 3.5Å; H229-H258 PolarHBondContact CD2-NE2 2.82Å; H229-H258 PolarHBondContact N-CE1 3.32Å; H229-E354 IonicContact CE1-OE1 3.81Å; H229-E354 IonicContact ND1-OE1 3.58Å
230	T	97.2	Very high	96.1	Very high	4 Å²	4	13.7 Å²	13.7	3%	0.025	8%	0.075	C	C	.	.			trans	-99.3	-9.5	-156	59.3	0	0	0	0	112.5	S93 I94 H180 E228 Y244 L254	S93-T230 PolarHBondContact O-OG1 3.36Å; I94-T230 VanDerWaalsContact CD1-C 3.41Å; I94-T230 WeakPolarHBondContact CD1-O 3.37Å; I94-T230 VanDerWaalsContact CD1-OG1 3.28Å; I94-T230 WeakPolarHBondContact CD1-OG1 3.25Å; H180-T230 WeakPolarHBondContact CB-O 3.46Å; H180-T230 PolarHBondContact ND1-O 2.77Å; E228-T230 VanDerWaalsContact O-CG2 3.32Å; E228-T230 WeakPolarHBondContact O-CG2 3.48Å; E228-T230 PolarHBondContact O-N 3.33Å; T230-Y244 HydrophobicContact CG2-CE2 4.25Å; T230-L254 HydrophobicContact CG2-CD2 4Å; T230-L254 WeakPolarHBondContact OG1-CD2 3.16Å
231	G	97.4	Very high	95.8	Very high	6 Å²	6	17.8 Å²	17.8	6%	0.062	10%	0.103	C	C	.	.	S	Bend	trans	101.8	11.3	164.7	0	0	0	0	0	115.2	N182 H229 E354	N182-G231 WeakPolarHBondContact OD1-CA 3.24Å; N182-G231 PolarHBondContact OD1-N 2.77Å; H229-G231 PolarHBondContact ND1-N 3.34Å; G231-E354 VanDerWaalsContact C-OE1 3.23Å; G231-E354 VanDerWaalsContact CA-OE1 3.23Å; G231-E354 WeakPolarHBondContact CA-OE1 3.34Å; G231-E354 WeakPolarHBondContact O-CG 3.37Å
232	H	95.5	Very high	95.5	Very high	27 Å²	27	17.8 Å²	17.8	13%	0.125	10%	0.103	C	C	.	.	S	Bend	trans	-133.4	166.3	173.6	-57.1	34.1	0	0	0	104.8	S93 I94 H229 Y236 Q358 L361	S93-H232 WeakPolarHBondContact OG-CB 3.31Å; I94-H232 HydrophobicContact CD1-CB 3.53Å; I94-H232 WeakPolarHBondContact CD1-ND1 3.44Å; I94-H232 HydrophobicContact CG1-CB 3.59Å; H229-H232 PolarHBondContact CE1-O 3.39Å; H232-Y236 HydrophobicContact CB-CE1 4.03Å; H232-Y236 AromaticContact CD2-CE1 3.42Å; H232-Y236 VanDerWaalsContact CD2-CE1 3.42Å; H232-Y236 WeakPolarHBondContact CD2-CE1 3.49Å; H232-Y236 AromaticContact CD2-CZ 3.92Å; H232-Q358 HydrophobicContact CB-CB 3.92Å; H232-Q358 HydrophobicContact CB-CG 4.12Å; H232-Q358 VanDerWaalsContact CD2-CA 3.48Å; H232-Q358 WeakPolarHBondContact CD2-CA 3.39Å; H232-L361 VanDerWaalsContact NE2-CD2 3.26Å; H232-L361 WeakPolarHBondContact NE2-CD2 3.31Å
233	T	94.9	Very high	95.4	Very high	3 Å²	3	22.8 Å²	22.8	2%	0.018	13%	0.13	C	C	.	.			trans	-63.9	-171.9	-178.5	59.7	0	0	0	0	110.4	T89 F90 S93 L254 F355 Q358	T89-T233 VanDerWaalsContact O-CB 3.26Å; T89-T233 WeakPolarHBondContact O-CB 3.45Å; T89-T233 PolarHBondContact O-OG1 3.19Å; F90-T233 HydrophobicContact CD1-CG2 4.27Å; F90-T233 HydrophobicContact CE1-CG2 4.44Å; S93-T233 WeakPolarHBondContact CA-O 3.11Å; S93-T233 VanDerWaalsContact CB-O 3.23Å; S93-T233 WeakPolarHBondContact CB-O 3.37Å; S93-T233 PolarHBondContact OG-O 3.27Å; T233-L254 WeakPolarHBondContact O-CD1 3.08Å; T233-F355 HydrophobicContact CG2-CD1 3.56Å; T233-F355 HydrophobicContact CG2-CE1 3.22Å; T233-F355 HydrophobicContact CG2-CG 4.44Å; T233-F355 HydrophobicContact CG2-CZ 3.84Å; T233-Q358 PolarHBondContact OG1-NE2 2.98Å; T233-Q358 PolarHBondContact OG1-OE1 3.42Å
234	N	94.8	Very high	95.2	Very high	12 Å²	12	24.3 Å²	24.3	6%	0.064	14%	0.136	C	C	.	.	S	Bend	trans	-52.8	-138.7	136.4	-89.1	-82	0	0	0	111.1	F90 Q92 S93 Y236 E255	F90-N234 HydrophobicContact CB-CB 4.34Å; F90-N234 WeakPolarHBondContact O-CB 3.29Å; Q92-N234 CarbonylContact C-O 3.28Å; Q92-N234 WeakPolarHBondContact CA-OD1 3.3Å; Q92-N234 VanDerWaalsContact N-CG 3.35Å; Q92-N234 PolarHBondContact N-OD1 2.94Å; Q92-N234 PolarHBondContact NE2-OD1 3.26Å; Q92-N234 CarbonylContact O-C 3.46Å; S93-N234 WeakPolarHBondContact CB-O 3.44Å; S93-N234 PolarHBondContact OG-O 2.99Å; S93-N234 VanDerWaalsContact OG-O 3.04Å; N234-Y236 PolarHBondContact O-N 3.14Å; N234-Y236 VanDerWaalsContact O-N 3.1Å; N234-E255 PolarHBondContact ND2-OE1 3.4Å
235	S	92.1	Very high	95	Very high	8 Å²	8	24.4 Å²	24.4	6%	0.056	14%	0.137	C	C	.	.	S	Bend	trans	62.7	-62.9	-172.6	-159.1	0	0	0	0	123.3	L88 T91 Q92 Q239 S370	L88-S235 WeakPolarHBondContact O-CB 3.28Å; L88-S235 PolarHBondContact O-OG 3.45Å; T91-S235 VanDerWaalsContact C-CA 3.41Å; T91-S235 VanDerWaalsContact CA-N 3.33Å; T91-S235 CarbonylContact O-C 3.52Å; T91-S235 VanDerWaalsContact O-C 3.28Å; T91-S235 WeakPolarHBondContact O-CA 3.27Å; T91-S235 PolarHBondContact O-N 3.45Å; Q92-S235 CarbonylContact O-C 3.56Å; Q92-S235 WeakPolarHBondContact O-CA 3.28Å; Q92-S235 PolarHBondContact O-N 2.87Å; Q92-S235 VanDerWaalsContact O-N 3.14Å; S235-Q239 PolarHBondContact O-NE2 3.38Å; S235-Q239 PolarHBondContact OG-NE2 2.92Å; S235-S370 PolarHBondContact OG-OG 2.79Å; S235-S370 VanDerWaalsContact OG-OG 3.13Å
236	Y	93.3	Very high	94.9	Very high	2 Å²	2	30 Å²	30	1%	0.008	17%	0.166	C	C	.	.	H	α-helix	trans	-104	3.2	-168	103.3	-80.7	0	0	0	120.6	Q92 S93 I94 H232 N234 V238 Q239 S240 Q358 L361 E362 M365 I367	Q92-Y236 CarbonylContact O-C 2.94Å; Q92-Y236 PolarHBondContact O-N 3.37Å; S93-Y236 VanDerWaalsContact CB-N 3.29Å; S93-Y236 WeakPolarHBondContact OG-CD1 3.33Å; S93-Y236 WeakPolarHBondContact OG-CE1 3.25Å; I94-Y236 HydrophobicContact CG1-CE1 4.04Å; H232-Y236 HydrophobicContact CB-CE1 4.03Å; H232-Y236 AromaticContact CD2-CE1 3.42Å; H232-Y236 VanDerWaalsContact CD2-CE1 3.42Å; H232-Y236 WeakPolarHBondContact CD2-CE1 3.49Å; H232-Y236 AromaticContact CD2-CZ 3.92Å; N234-Y236 PolarHBondContact O-N 3.14Å; N234-Y236 VanDerWaalsContact O-N 3.1Å; Y236-V238 VanDerWaalsContact C-N 3.32Å; Y236-V238 PolarHBondContact O-N 3.32Å; Y236-Q239 CarbonylContact O-C 3.55Å; Y236-Q239 PolarHBondContact O-N 2.67Å; Y236-S240 VanDerWaalsContact O-CB 3.29Å; Y236-S240 WeakPolarHBondContact O-CB 3.06Å; Y236-S240 PolarHBondContact O-N 3.39Å; Y236-S240 PolarHBondContact O-OG 3.42Å; Y236-Q358 HydrophobicContact CD1-CG 4.14Å; Y236-Q358 HydrophobicContact CE1-CG 4.34Å; Y236-L361 WeakPolarHBondContact OH-CD2 3.35Å; Y236-E362 HydrophobicContact CG-CG 4.29Å; Y236-M365 HydrophobicContact CE2-CE 4.13Å; Y236-M365 HydrophobicContact CE2-SD 3.94Å; Y236-I367 HydrophobicContact CD2-CD1 3.58Å; Y236-I367 HydrophobicContact CE2-CD1 4.3Å; Y236-I367 HydrophobicContact CG-CD1 4.32Å
237	H	93.2	Very high	94.9	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-53.5	-49.2	166.1	-90.5	-41.2	0	0	0	110.1	Q92 S93 I94 S240 S241 S242 Y244 A245 V253	Q92-H237 HydrophobicContact CB-CB 3.87Å; Q92-H237 WeakPolarHBondContact O-CB 3.22Å; Q92-H237 PolarHBondContact O-N 3.04Å; S93-H237 VanDerWaalsContact CA-CD2 3.49Å; S93-H237 WeakPolarHBondContact CA-CD2 3.35Å; S93-H237 PolarHBondContact N-CD2 3.5Å; S93-H237 PolarHBondContact N-NE2 3.41Å; S93-H237 PolarHBondContact O-CE1 2.86Å; S93-H237 PolarHBondContact O-ND1 2.86Å; S93-H237 VanDerWaalsContact O-ND1 3.16Å; S93-H237 PolarHBondContact O-NE2 3.3Å; S93-H237 VanDerWaalsContact O-NE2 3.16Å; I94-H237 PolarHBondContact N-ND1 3.19Å; I94-H237 PolarHBondContact O-ND1 3.34Å; H237-S240 CarbonylContact O-C 3.56Å; H237-S240 PolarHBondContact O-N 2.66Å; H237-S240 PolarHBondContact O-OG 2.77Å; H237-S241 WeakPolarHBondContact O-CA 3.43Å; H237-S241 PolarHBondContact O-N 2.82Å; H237-S242 WeakPolarHBondContact CB-OG 3.49Å; H237-S242 PolarHBondContact ND1-OG 3.06Å; H237-S242 PolarHBondContact O-N 2.94Å; H237-S242 VanDerWaalsContact O-N 3.15Å; H237-Y244 WeakPolarHBondContact CE1-CB 3.33Å; H237-Y244 AromaticContact CE1-CD2 3.66Å; H237-Y244 AromaticContact CE1-CG 3.81Å; H237-A245 HydrophobicContact CB-CB 3.64Å; H237-V253 VanDerWaalsContact CD2-CB 3.5Å; H237-V253 WeakPolarHBondContact CD2-CB 3.38Å; H237-V253 WeakPolarHBondContact CD2-CG1 3.5Å; H237-V253 WeakPolarHBondContact NE2-CG1 3.49Å
238	V	91.5	Very high	94.8	Very high	66 Å²	66	35.4 Å²	35.4	40%	0.4	19%	0.193	S	C	.	.	H	α-helix	trans	-59.4	-52.1	177.2	165.2	0	0	0	0	108.5	Q92 Y236 S240 S241 D250	Q92-V238 HydrophobicContact CB-CG2 4.19Å; Y236-V238 VanDerWaalsContact C-N 3.32Å; Y236-V238 PolarHBondContact O-N 3.32Å; V238-S240 VanDerWaalsContact C-N 3.26Å; V238-S240 PolarHBondContact O-N 3.21Å; V238-S241 PolarHBondContact O-N 2.84Å; V238-D250 HydrophobicContact CG2-CB 3.82Å; V238-D250 WeakPolarHBondContact CG2-OD1 3.21Å
239	Q	91.2	Very high	94.8	Very high	79 Å²	79	39.3 Å²	39.3	37%	0.369	22%	0.215	S	C	.	.	H	α-helix	trans	-64.4	-26.3	-178.5	-53.9	-176	66.9	0	0	113.4	S235 Y236	S235-Q239 PolarHBondContact O-NE2 3.38Å; S235-Q239 PolarHBondContact OG-NE2 2.92Å; Y236-Q239 CarbonylContact O-C 3.55Å; Y236-Q239 PolarHBondContact O-N 2.67Å
240	S	90.4	Very high	94.6	Very high	27 Å²	27	42.7 Å²	42.7	19%	0.189	23%	0.233	C	C	.	.	H	α-helix	trans	-102.8	-0.1	176.5	62.9	0	0	0	0	114.7	Y236 H237 V238 S242	Y236-S240 VanDerWaalsContact O-CB 3.29Å; Y236-S240 WeakPolarHBondContact O-CB 3.06Å; Y236-S240 PolarHBondContact O-N 3.39Å; Y236-S240 PolarHBondContact O-OG 3.42Å; H237-S240 CarbonylContact O-C 3.56Å; H237-S240 PolarHBondContact O-N 2.66Å; H237-S240 PolarHBondContact O-OG 2.77Å; V238-S240 VanDerWaalsContact C-N 3.26Å; V238-S240 PolarHBondContact O-N 3.21Å; S240-S242 VanDerWaalsContact C-N 3.29Å; S240-S242 PolarHBondContact O-N 3.07Å
241	S	91.4	Very high	94.6	Very high	85 Å²	85	51.4 Å²	51.4	59%	0.594	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	43.2	-178.7	-60.7	0	0	0	0	114.6	H237 V238 L246	H237-S241 WeakPolarHBondContact O-CA 3.43Å; H237-S241 PolarHBondContact O-N 2.82Å; V238-S241 PolarHBondContact O-N 2.84Å; S241-L246 WeakPolarHBondContact O-CD1 3.37Å
242	S	93.2	Very high	94.5	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.271	C	S	.	.			trans	-74.3	157.8	-173	64.8	0	0	0	0	116	I94 H237 S240 Y244 A245 L246	I94-S242 WeakPolarHBondContact O-CB 3.37Å; I94-S242 PolarHBondContact O-OG 2.69Å; H237-S242 WeakPolarHBondContact CB-OG 3.49Å; H237-S242 PolarHBondContact ND1-OG 3.06Å; H237-S242 PolarHBondContact O-N 2.94Å; H237-S242 VanDerWaalsContact O-N 3.15Å; S240-S242 VanDerWaalsContact C-N 3.29Å; S240-S242 PolarHBondContact O-N 3.07Å; S242-Y244 PolarHBondContact O-N 2.8Å; S242-Y244 VanDerWaalsContact O-N 3.12Å; S242-A245 WeakPolarHBondContact O-CB 3.46Å; S242-A245 PolarHBondContact O-N 3.07Å; S242-L246 WeakPolarHBondContact O-CG 3.41Å; S242-L246 PolarHBondContact O-N 3.04Å
243	D	96.7	Very high	94.6	Very high	106 Å²	106	51 Å²	51	57%	0.567	27%	0.265	S	S	*	.	H	α-helix	trans	-47.2	-40	177	-63.6	45.3	0	0	0	114.2	N95 L247	N95-D243 PolarHBondContact ND2-OD1 3.07Å; D243-L247 VanDerWaalsContact O-CB 3.22Å; D243-L247 WeakPolarHBondContact O-CB 3.22Å; D243-L247 PolarHBondContact O-N 3.49Å
244	Y	95.9	Very high	94.8	Very high	32 Å²	32	50.9 Å²	50.9	13%	0.125	26%	0.264	C	S	.	.	H	α-helix	trans	-71.8	-42.8	178.5	-67.7	-60.5	0	0	0	112.4	T230 H237 S242 L246 L247 Y248 V253 H257	T230-Y244 HydrophobicContact CG2-CE2 4.25Å; H237-Y244 WeakPolarHBondContact CE1-CB 3.33Å; H237-Y244 AromaticContact CE1-CD2 3.66Å; H237-Y244 AromaticContact CE1-CG 3.81Å; S242-Y244 PolarHBondContact O-N 2.8Å; S242-Y244 VanDerWaalsContact O-N 3.12Å; Y244-L246 VanDerWaalsContact C-N 3.34Å; Y244-L246 PolarHBondContact O-N 2.98Å; Y244-L247 PolarHBondContact O-N 2.83Å; Y244-Y248 WeakPolarHBondContact O-CD2 3.13Å; Y244-Y248 PolarHBondContact O-N 2.98Å; Y244-V253 VanDerWaalsContact O-CG1 3.22Å; Y244-V253 WeakPolarHBondContact O-CG1 3.42Å; Y244-H257 AromaticContact CD1-ND1 3.7Å; Y244-H257 AromaticContact CE1-CE1 3.35Å; Y244-H257 WeakPolarHBondContact CE1-CE1 3.39Å; Y244-H257 AromaticContact CE1-CG 3.98Å; Y244-H257 AromaticContact CE1-ND1 3.22Å; Y244-H257 WeakPolarHBondContact CE1-ND1 3.47Å; Y244-H257 AromaticContact CZ-CE1 3.83Å
245	A	94.6	Very high	95	Very high	1 Å²	1	50.8 Å²	50.8	1%	0.008	26%	0.263	C	S	.	.	H	α-helix	trans	-57.5	-49.2	172.4	0	0	0	0	0	111	H237 S242 L247 Y248 N249 D250	H237-A245 HydrophobicContact CB-CB 3.64Å; S242-A245 WeakPolarHBondContact O-CB 3.46Å; S242-A245 PolarHBondContact O-N 3.07Å; A245-L247 VanDerWaalsContact C-N 3.25Å; A245-L247 PolarHBondContact O-N 3.21Å; A245-Y248 CarbonylContact O-C 3.6Å; A245-Y248 PolarHBondContact O-N 3.42Å; A245-N249 WeakPolarHBondContact O-CA 3.35Å; A245-N249 PolarHBondContact O-N 3.46Å; A245-D250 WeakPolarHBondContact CB-OD1 3.44Å; A245-D250 PolarHBondContact O-N 2.87Å
246	L	96.2	Very high	95.3	Very high	119 Å²	119	52.8 Å²	52.8	62%	0.623	27%	0.273	S	S	*	.	H	α-helix	trans	-61.4	-34.1	178.5	-63.1	172.8	0	0	0	112	S241 S242 Y244	S241-L246 WeakPolarHBondContact O-CD1 3.37Å; S242-L246 WeakPolarHBondContact O-CG 3.41Å; S242-L246 PolarHBondContact O-N 3.04Å; Y244-L246 VanDerWaalsContact C-N 3.34Å; Y244-L246 PolarHBondContact O-N 2.98Å
247	L	97.5	Very high	95.5	Very high	96 Å²	96	53.1 Å²	53.1	50%	0.503	28%	0.275	S	S	.	.	H	α-helix	trans	-73.3	-40.5	177.3	-179.6	61.9	0	0	0	113.3	D243 Y244 A245 N249	D243-L247 VanDerWaalsContact O-CB 3.22Å; D243-L247 WeakPolarHBondContact O-CB 3.22Å; D243-L247 PolarHBondContact O-N 3.49Å; Y244-L247 PolarHBondContact O-N 2.83Å; A245-L247 VanDerWaalsContact C-N 3.25Å; A245-L247 PolarHBondContact O-N 3.21Å; L247-N249 PolarHBondContact O-ND2 3.36Å
248	Y	97.5	Very high	95.8	Very high	29 Å²	29	53.1 Å²	53.1	11%	0.114	28%	0.275	C	S	.	.	H	α-helix	trans	-105.7	9.4	-176.1	-56.5	-61.8	0	0	0	114.3	Y244 A245 D250 V253 N256 H257 S260 R264	Y244-Y248 WeakPolarHBondContact O-CD2 3.13Å; Y244-Y248 PolarHBondContact O-N 2.98Å; A245-Y248 CarbonylContact O-C 3.6Å; A245-Y248 PolarHBondContact O-N 3.42Å; Y248-D250 PolarHBondContact O-N 3.45Å; Y248-V253 HydrophobicContact CD2-CG1 3.84Å; Y248-V253 WeakPolarHBondContact CD2-O 3.16Å; Y248-V253 HydrophobicContact CG-CG1 4.5Å; Y248-N256 HydrophobicContact CD1-CB 3.62Å; Y248-N256 HydrophobicContact CD2-CB 3.97Å; Y248-N256 HydrophobicContact CE1-CB 3.94Å; Y248-N256 HydrophobicContact CE2-CB 4.26Å; Y248-N256 HydrophobicContact CG-CB 3.64Å; Y248-H257 HydrophobicContact CE2-CB 3.85Å; Y248-S260 WeakPolarHBondContact OH-CB 3.17Å; Y248-R264 PolarHBondContact OH-NH2 3.23Å
249	N	97.4	Very high	96.1	Very high	116 Å²	116	50.2 Å²	50.2	62%	0.62	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.1	47.6	172.2	-55.2	-103.6	0	0	0	112.7	A245 L247 R251	A245-N249 WeakPolarHBondContact O-CA 3.35Å; A245-N249 PolarHBondContact O-N 3.46Å; L247-N249 PolarHBondContact O-ND2 3.36Å; N249-R251 VanDerWaalsContact C-N 3.31Å; N249-R251 PolarHBondContact O-N 3.19Å
250	D	95.3	Very high	96.5	Very high	78 Å²	78	48 Å²	48	42%	0.417	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.3	36.1	174.9	-53.3	-39.8	0	0	0	114.9	V238 A245 Y248	V238-D250 HydrophobicContact CG2-CB 3.82Å; V238-D250 WeakPolarHBondContact CG2-OD1 3.21Å; A245-D250 WeakPolarHBondContact CB-OD1 3.44Å; A245-D250 PolarHBondContact O-N 2.87Å; Y248-D250 PolarHBondContact O-N 3.45Å
251	R	95.9	Very high	96.9	Very high	187 Å²	187	47.2 Å²	47.2	71%	0.706	25%	0.246	S	C	*	.	S	Bend	trans	-132.7	122.7	177.8	-65.9	170.8	-171.4	-151.6	-1.8	111.4	N249 V253 N256	N249-R251 VanDerWaalsContact C-N 3.31Å; N249-R251 PolarHBondContact O-N 3.19Å; R251-V253 VanDerWaalsContact N-CG2 3.35Å; R251-V253 WeakPolarHBondContact O-CA 2.91Å; R251-V253 WeakPolarHBondContact O-CG2 3.4Å; R251-V253 PolarHBondContact O-N 3.49Å; R251-N256 PolarHBondContact O-ND2 3.3Å; R251-N256 VanDerWaalsContact O-ND2 3.15Å
252	S	96.5	Very high	97.2	Very high	25 Å²	25	43.1 Å²	43.1	18%	0.175	22%	0.217	C	C	.	.	S	Bend	trans	38.8	52.7	173	-45.1	0	0	0	0	111.5	E255 N256 D298	S252-E255 WeakPolarHBondContact CA-OE2 3.43Å; S252-E255 PolarHBondContact O-N 3.36Å; S252-N256 VanDerWaalsContact O-CB 3.25Å; S252-N256 WeakPolarHBondContact O-CB 3.3Å; S252-N256 PolarHBondContact O-N 3.45Å; S252-N256 PolarHBondContact O-ND2 3.32Å; S252-D298 VanDerWaalsContact CA-OD2 3.24Å; S252-D298 WeakPolarHBondContact CA-OD2 3.45Å; S252-D298 WeakPolarHBondContact CB-OD2 3.26Å; S252-D298 PolarHBondContact OG-OD2 2.73Å
253	V	97.9	Very high	97.5	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-77.6	-33	-153.6	175.5	0	0	0	0	111.2	Q92 H237 Y244 Y248 R251 E255 H257	Q92-V253 HydrophobicContact CB-CB 4.16Å; Q92-V253 HydrophobicContact CB-CG2 3.93Å; Q92-V253 HydrophobicContact CG-CB 3.7Å; Q92-V253 HydrophobicContact CG-CG2 3.21Å; H237-V253 VanDerWaalsContact CD2-CB 3.5Å; H237-V253 WeakPolarHBondContact CD2-CB 3.38Å; H237-V253 WeakPolarHBondContact CD2-CG1 3.5Å; H237-V253 WeakPolarHBondContact NE2-CG1 3.49Å; Y244-V253 VanDerWaalsContact O-CG1 3.22Å; Y244-V253 WeakPolarHBondContact O-CG1 3.42Å; Y248-V253 HydrophobicContact CD2-CG1 3.84Å; Y248-V253 WeakPolarHBondContact CD2-O 3.16Å; Y248-V253 HydrophobicContact CG-CG1 4.5Å; R251-V253 VanDerWaalsContact N-CG2 3.35Å; R251-V253 WeakPolarHBondContact O-CA 2.91Å; R251-V253 WeakPolarHBondContact O-CG2 3.4Å; R251-V253 PolarHBondContact O-N 3.49Å; V253-E255 PolarHBondContact N-OE2 3.43Å; V253-H257 WeakPolarHBondContact O-CB 3.18Å; V253-H257 PolarHBondContact O-N 3.14Å
254	L	98.3	Very high	97.6	Very high	0 Å²	0	43 Å²	43	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-74.1	-43.4	174.1	-73.9	174	0	0	0	110	T230 T233 N256 H257 H258	T230-L254 HydrophobicContact CG2-CD2 4Å; T230-L254 WeakPolarHBondContact OG1-CD2 3.16Å; T233-L254 WeakPolarHBondContact O-CD1 3.08Å; L254-N256 PolarHBondContact O-N 3.31Å; L254-H257 CarbonylContact O-C 3.53Å; L254-H257 VanDerWaalsContact O-CA 3.26Å; L254-H257 WeakPolarHBondContact O-CA 3.28Å; L254-H257 WeakPolarHBondContact O-CB 3.4Å; L254-H257 PolarHBondContact O-N 2.68Å; L254-H258 PolarHBondContact O-CD2 3.29Å; L254-H258 PolarHBondContact O-CE1 2.95Å; L254-H258 PolarHBondContact O-N 2.98Å; L254-H258 PolarHBondContact O-ND1 2.95Å; L254-H258 PolarHBondContact O-NE2 2.88Å
255	E	98.5	Very high	97.7	Very high	11 Å²	11	42 Å²	42	5%	0.051	21%	0.206	C	C	.	.	H	α-helix	trans	-62.6	-43.8	178.7	-56.4	78.3	-170.3	0	0	111.3	N234 S252 V253 H257 H258 A259 L295 D298	N234-E255 PolarHBondContact ND2-OE1 3.4Å; S252-E255 WeakPolarHBondContact CA-OE2 3.43Å; S252-E255 PolarHBondContact O-N 3.36Å; V253-E255 PolarHBondContact N-OE2 3.43Å; E255-H257 VanDerWaalsContact C-N 3.34Å; E255-H258 PolarHBondContact O-N 3.03Å; E255-A259 WeakPolarHBondContact O-CB 3.09Å; E255-A259 PolarHBondContact O-N 2.66Å; E255-A259 VanDerWaalsContact O-N 3.08Å; E255-L295 HydrophobicContact CB-CD2 4.09Å; E255-D298 HydrophobicContact CG-CB 3.9Å
256	N	98.5	Very high	97.9	Very high	49 Å²	49	42.1 Å²	42.1	26%	0.262	21%	0.206	S	C	.	.	H	α-helix	trans	-61.6	-39.4	167.7	-86.1	-78.5	0	0	0	112	Y248 R251 S252 L254 S260 L295	Y248-N256 HydrophobicContact CD1-CB 3.62Å; Y248-N256 HydrophobicContact CD2-CB 3.97Å; Y248-N256 HydrophobicContact CE1-CB 3.94Å; Y248-N256 HydrophobicContact CE2-CB 4.26Å; Y248-N256 HydrophobicContact CG-CB 3.64Å; R251-N256 PolarHBondContact O-ND2 3.3Å; R251-N256 VanDerWaalsContact O-ND2 3.15Å; S252-N256 VanDerWaalsContact O-CB 3.25Å; S252-N256 WeakPolarHBondContact O-CB 3.3Å; S252-N256 PolarHBondContact O-N 3.45Å; S252-N256 PolarHBondContact O-ND2 3.32Å; L254-N256 PolarHBondContact O-N 3.31Å; N256-S260 WeakPolarHBondContact O-CB 3.48Å; N256-S260 PolarHBondContact O-N 2.82Å; N256-L295 HydrophobicContact CB-CD2 4.45Å; N256-L295 WeakPolarHBondContact ND2-CD2 3.29Å
257	H	98.6	Very high	98	Very high	9 Å²	9	43.3 Å²	43.3	4%	0.042	21%	0.208	C	C	.	.	H	α-helix	trans	-60.4	-50.5	174.2	178.7	68.9	0	0	0	111.3	E228 Y244 Y248 V253 L254 E255 S260 A261	E228-H257 IonicContact OE2-NE2 2.63Å; Y244-H257 AromaticContact CD1-ND1 3.7Å; Y244-H257 AromaticContact CE1-CE1 3.35Å; Y244-H257 WeakPolarHBondContact CE1-CE1 3.39Å; Y244-H257 AromaticContact CE1-CG 3.98Å; Y244-H257 AromaticContact CE1-ND1 3.22Å; Y244-H257 WeakPolarHBondContact CE1-ND1 3.47Å; Y244-H257 AromaticContact CZ-CE1 3.83Å; Y248-H257 HydrophobicContact CE2-CB 3.85Å; V253-H257 WeakPolarHBondContact O-CB 3.18Å; V253-H257 PolarHBondContact O-N 3.14Å; L254-H257 CarbonylContact O-C 3.53Å; L254-H257 VanDerWaalsContact O-CA 3.26Å; L254-H257 WeakPolarHBondContact O-CA 3.28Å; L254-H257 WeakPolarHBondContact O-CB 3.4Å; L254-H257 PolarHBondContact O-N 2.68Å; E255-H257 VanDerWaalsContact C-N 3.34Å; H257-S260 PolarHBondContact O-N 3.26Å; H257-A261 WeakPolarHBondContact O-CA 3.42Å; H257-A261 WeakPolarHBondContact O-CB 3.44Å; H257-A261 PolarHBondContact O-N 3.25Å
258	H	98.7	Very high	98	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-62.2	-53.6	-175.6	-55.3	-29.7	0	0	0	111.8	H225 Y227 H229 L254 E255 S260 A261 I262 V294	H225-H258 WeakPolarHBondContact O-CB 3.45Å; H225-H258 PolarHBondContact O-CD2 2.9Å; Y227-H258 WeakPolarHBondContact O-CA 3.39Å; Y227-H258 PolarHBondContact O-ND1 2.84Å; H229-H258 VanDerWaalsContact CA-CE1 3.44Å; H229-H258 WeakPolarHBondContact CA-CE1 3.08Å; H229-H258 AromaticContact CD2-CE1 3.99Å; H229-H258 AromaticContact CD2-NE2 3.5Å; H229-H258 PolarHBondContact CD2-NE2 2.82Å; H229-H258 PolarHBondContact N-CE1 3.32Å; L254-H258 PolarHBondContact O-CD2 3.29Å; L254-H258 PolarHBondContact O-CE1 2.95Å; L254-H258 PolarHBondContact O-N 2.98Å; L254-H258 PolarHBondContact O-ND1 2.95Å; L254-H258 PolarHBondContact O-NE2 2.88Å; E255-H258 PolarHBondContact O-N 3.03Å; H258-S260 VanDerWaalsContact C-N 3.34Å; H258-S260 PolarHBondContact O-N 2.89Å; H258-A261 PolarHBondContact O-N 3.18Å; H258-I262 WeakPolarHBondContact O-CG2 3.37Å; H258-I262 PolarHBondContact O-N 3.49Å; H258-V294 HydrophobicContact CB-CG1 4.28Å
259	A	98.6	Very high	98	Very high	5 Å²	5	47.6 Å²	47.6	4%	0.041	23%	0.226	C	C	.	.	H	α-helix	trans	-58.3	-45.6	175.9	0	0	0	0	0	111.4	E255 F263 V291 V294	E255-A259 WeakPolarHBondContact O-CB 3.09Å; E255-A259 PolarHBondContact O-N 2.66Å; E255-A259 VanDerWaalsContact O-N 3.08Å; A259-F263 VanDerWaalsContact O-CD2 3.25Å; A259-F263 WeakPolarHBondContact O-CD2 3.36Å; A259-F263 PolarHBondContact O-N 3.14Å; A259-V291 HydrophobicContact CB-CG2 4.44Å; A259-V294 HydrophobicContact CB-CB 4.3Å; A259-V294 HydrophobicContact CB-CG1 4Å
260	S	98.6	Very high	98	Very high	33 Å²	33	45.5 Å²	45.5	23%	0.231	22%	0.22	C	C	.	.	H	α-helix	trans	-72.2	-35.5	-178.5	-167.5	0	0	0	0	112.6	Y248 N256 H257 H258 R264	Y248-S260 WeakPolarHBondContact OH-CB 3.17Å; N256-S260 WeakPolarHBondContact O-CB 3.48Å; N256-S260 PolarHBondContact O-N 2.82Å; H257-S260 PolarHBondContact O-N 3.26Å; H258-S260 VanDerWaalsContact C-N 3.34Å; H258-S260 PolarHBondContact O-N 2.89Å; S260-R264 VanDerWaalsContact CB-NH2 3.31Å; S260-R264 WeakPolarHBondContact O-CB 3.19Å; S260-R264 VanDerWaalsContact O-CG 3.28Å; S260-R264 WeakPolarHBondContact O-CG 3.35Å; S260-R264 PolarHBondContact O-N 2.94Å; S260-R264 PolarHBondContact O-NE 2.98Å; S260-R264 VanDerWaalsContact O-NE 3.08Å; S260-R264 PolarHBondContact OG-NH1 3.13Å; S260-R264 PolarHBondContact OG-NH2 2.92Å
261	A	98.6	Very high	98.2	Very high	9 Å²	9	45.7 Å²	45.7	7%	0.074	22%	0.218	C	C	.	.	H	α-helix	trans	-68.3	-45.3	177.7	0	0	0	0	0	112.2	Y227 H257 H258 F263 R264 L265	Y227-A261 HydrophobicContact CD1-CB 3.91Å; Y227-A261 HydrophobicContact CE1-CB 4.18Å; H257-A261 WeakPolarHBondContact O-CA 3.42Å; H257-A261 WeakPolarHBondContact O-CB 3.44Å; H257-A261 PolarHBondContact O-N 3.25Å; H258-A261 PolarHBondContact O-N 3.18Å; A261-F263 PolarHBondContact O-N 2.92Å; A261-R264 PolarHBondContact O-N 2.94Å; A261-L265 WeakPolarHBondContact O-CB 3.25Å; A261-L265 PolarHBondContact O-N 3.13Å
262	I	98.7	Very high	98.3	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-68.8	-36.3	-178.7	-163.3	68.1	0	0	0	112	F169 L173 F220 V224 Y227 H258 L265 M266	F169-I262 HydrophobicContact CE2-CD1 3.74Å; F169-I262 HydrophobicContact CE2-CG1 4.23Å; F169-I262 HydrophobicContact CZ-CD1 3.94Å; F169-I262 HydrophobicContact CZ-CG1 4.32Å; L173-I262 HydrophobicContact CD1-CD1 3.76Å; F220-I262 HydrophobicContact CE1-CG2 4.45Å; F220-I262 HydrophobicContact CZ-CG1 3.98Å; V224-I262 HydrophobicContact CB-CB 4.42Å; V224-I262 HydrophobicContact CB-CG1 4.05Å; V224-I262 HydrophobicContact CB-CG2 4.32Å; V224-I262 HydrophobicContact CG1-CD1 4.22Å; V224-I262 HydrophobicContact CG1-CG1 3.9Å; V224-I262 HydrophobicContact CG2-CG2 4.07Å; Y227-I262 HydrophobicContact CD1-CB 3.7Å; Y227-I262 HydrophobicContact CD1-CD1 3.66Å; Y227-I262 HydrophobicContact CD1-CG1 4.27Å; Y227-I262 HydrophobicContact CD2-CD1 4.18Å; Y227-I262 HydrophobicContact CE1-CB 4.35Å; Y227-I262 HydrophobicContact CE1-CD1 3.8Å; Y227-I262 HydrophobicContact CE2-CD1 4.3Å; Y227-I262 HydrophobicContact CG-CB 4.23Å; Y227-I262 HydrophobicContact CG-CD1 3.85Å; H258-I262 WeakPolarHBondContact O-CG2 3.37Å; H258-I262 PolarHBondContact O-N 3.49Å; I262-L265 HydrophobicContact CD1-CD2 4.06Å; I262-L265 WeakPolarHBondContact O-CB 3.46Å; I262-M266 HydrophobicContact CG1-CE 4.5Å; I262-M266 PolarHBondContact O-N 2.7Å
263	F	98.8	Very high	98.4	Very high	7 Å²	7	39.6 Å²	39.6	3%	0.031	19%	0.194	C	C	.	.	H	α-helix	trans	-73.7	-35.9	174.5	-80	-70.6	0	0	0	112.7	A259 A261 M266 H267 L275 Y283 F286 R287 V290 V291	A259-F263 VanDerWaalsContact O-CD2 3.25Å; A259-F263 WeakPolarHBondContact O-CD2 3.36Å; A259-F263 PolarHBondContact O-N 3.14Å; A261-F263 PolarHBondContact O-N 2.92Å; F263-M266 HydrophobicContact CD1-CE 3.73Å; F263-M266 HydrophobicContact CE1-CE 3.97Å; F263-M266 HydrophobicContact CG-CE 4.38Å; F263-M266 PolarHBondContact O-N 3.18Å; F263-H267 WeakPolarHBondContact O-CB 3.44Å; F263-H267 PolarHBondContact O-N 2.74Å; F263-L275 HydrophobicContact CD1-CD1 4.34Å; F263-L275 HydrophobicContact CE1-CD1 3.69Å; F263-Y283 HydrophobicContact CE1-CE2 4.43Å; F263-F286 HydrophobicContact CE1-CD1 4.33Å; F263-F286 HydrophobicContact CE1-CE1 4.22Å; F263-F286 HydrophobicContact CZ-CD1 4.18Å; F263-F286 HydrophobicContact CZ-CE1 4.04Å; F263-R287 VanDerWaalsContact CB-NH1 3.32Å; F263-R287 HydrophobicContact CE1-CB 4.13Å; F263-R287 HydrophobicContact CE1-CG 4.16Å; F263-R287 HydrophobicContact CE2-CG 4.11Å; F263-R287 HydrophobicContact CZ-CB 3.99Å; F263-R287 HydrophobicContact CZ-CG 3.94Å; F263-V290 HydrophobicContact CE2-CB 4.04Å; F263-V290 HydrophobicContact CE2-CG1 3.68Å; F263-V290 HydrophobicContact CZ-CB 4.03Å; F263-V290 HydrophobicContact CZ-CG1 3.98Å; F263-V291 HydrophobicContact CE2-CG2 4.28Å
264	R	98.5	Very high	98.4	Very high	95 Å²	95	39.8 Å²	39.8	36%	0.358	20%	0.195	S	C	.	.	H	α-helix	trans	-60.5	-44.5	169.1	-81	177.9	-67.3	-136.1	-2.9	111.8	Y248 S260 A261 M266 H267 D268	Y248-R264 PolarHBondContact OH-NH2 3.23Å; S260-R264 VanDerWaalsContact CB-NH2 3.31Å; S260-R264 WeakPolarHBondContact O-CB 3.19Å; S260-R264 VanDerWaalsContact O-CG 3.28Å; S260-R264 WeakPolarHBondContact O-CG 3.35Å; S260-R264 PolarHBondContact O-N 2.94Å; S260-R264 PolarHBondContact O-NE 2.98Å; S260-R264 VanDerWaalsContact O-NE 3.08Å; S260-R264 PolarHBondContact OG-NH1 3.13Å; S260-R264 PolarHBondContact OG-NH2 2.92Å; A261-R264 PolarHBondContact O-N 2.94Å; R264-M266 VanDerWaalsContact C-N 3.27Å; R264-M266 PolarHBondContact O-N 2.9Å; R264-H267 PolarHBondContact O-N 3.5Å; R264-D268 WeakPolarHBondContact O-CB 3.47Å; R264-D268 PolarHBondContact O-N 3.27Å
265	L	98.6	Very high	98.4	Very high	11 Å²	11	40 Å²	40	6%	0.058	20%	0.196	C	C	.	.	H	α-helix	trans	-53.1	-44.8	176.2	-177.8	76.5	0	0	0	112.1	K172 Y227 A261 I262 Y269 Y272	K172-L265 HydrophobicContact CD-CD1 4.25Å; K172-L265 VanDerWaalsContact CE-CD1 3.48Å; K172-L265 HydrophobicContact CG-CD1 3.68Å; K172-L265 HydrophobicContact CG-CD2 3.86Å; K172-L265 HydrophobicContact CG-CG 4.35Å; Y227-L265 HydrophobicContact CE1-CD2 4.42Å; A261-L265 WeakPolarHBondContact O-CB 3.25Å; A261-L265 PolarHBondContact O-N 3.13Å; I262-L265 HydrophobicContact CD1-CD2 4.06Å; I262-L265 WeakPolarHBondContact O-CB 3.46Å; L265-Y269 HydrophobicContact CD1-CD2 4.04Å; L265-Y269 WeakPolarHBondContact O-CB 3.29Å; L265-Y269 PolarHBondContact O-N 3.07Å; L265-Y272 HydrophobicContact CD1-CD2 3.86Å; L265-Y272 HydrophobicContact CD1-CE2 4.38Å; L265-Y272 HydrophobicContact CG-CD2 4.13Å
266	M	98.5	Very high	98.3	Very high	4 Å²	4	43.5 Å²	43.5	2%	0.02	21%	0.213	C	C	.	.	H	α-helix	trans	-77.6	-26.9	178.9	-66.3	-173.5	-70.2	0	0	113.2	F169 F220 I262 F263 R264 N273 I274 L275	F169-M266 HydrophobicContact CD2-CG 4.31Å; F169-M266 HydrophobicContact CD2-SD 4.37Å; F169-M266 HydrophobicContact CE2-CG 4.13Å; F169-M266 HydrophobicContact CE2-SD 3.93Å; F220-M266 HydrophobicContact CE1-CE 4.33Å; F220-M266 HydrophobicContact CE2-CE 4.32Å; F220-M266 HydrophobicContact CE2-SD 4.4Å; F220-M266 HydrophobicContact CZ-CE 3.57Å; F220-M266 HydrophobicContact CZ-SD 4.2Å; I262-M266 HydrophobicContact CG1-CE 4.5Å; I262-M266 PolarHBondContact O-N 2.7Å; F263-M266 HydrophobicContact CD1-CE 3.73Å; F263-M266 HydrophobicContact CE1-CE 3.97Å; F263-M266 HydrophobicContact CG-CE 4.38Å; F263-M266 PolarHBondContact O-N 3.18Å; R264-M266 VanDerWaalsContact C-N 3.27Å; R264-M266 PolarHBondContact O-N 2.9Å; M266-N273 HydrophobicContact CB-CB 4.26Å; M266-N273 VanDerWaalsContact O-CB 3.22Å; M266-N273 WeakPolarHBondContact O-CB 3.38Å; M266-N273 VanDerWaalsContact O-CG 3.25Å; M266-N273 PolarHBondContact O-ND2 3.07Å; M266-I274 HydrophobicContact SD-CG1 3.99Å; M266-L275 HydrophobicContact CE-CD1 3.56Å; M266-L275 HydrophobicContact CE-CG 4.22Å; M266-L275 HydrophobicContact SD-CD1 3.93Å; M266-L275 HydrophobicContact SD-CG 3.9Å
267	H	97.7	Very high	98.3	Very high	145 Å²	145	46.3 Å²	46.3	67%	0.671	22%	0.223	S	C	*	.	H	α-helix	trans	-70.4	-51.9	174.5	178.6	-91.7	0	0	0	111.5	F263 R264	F263-H267 WeakPolarHBondContact O-CB 3.44Å; F263-H267 PolarHBondContact O-N 2.74Å; R264-H267 PolarHBondContact O-N 3.5Å
268	D	98.3	Very high	98.3	Very high	95 Å²	95	46.9 Å²	46.9	51%	0.508	23%	0.226	S	C	.	.	H	α-helix	trans	-81.3	-23.2	-169.6	-57.2	-26.7	0	0	0	113	R264	R264-D268 WeakPolarHBondContact O-CB 3.47Å; R264-D268 PolarHBondContact O-N 3.27Å
269	Y	98.3	Very high	98.3	Very high	119 Å²	119	49.4 Å²	49.4	47%	0.467	24%	0.244	S	C	.	.			trans	-127.6	90.7	-174.8	-58.1	-74.6	0	0	0	111.8	L265 Q271 Y272 N273	L265-Y269 HydrophobicContact CD1-CD2 4.04Å; L265-Y269 WeakPolarHBondContact O-CB 3.29Å; L265-Y269 PolarHBondContact O-N 3.07Å; Y269-Q271 PolarHBondContact O-N 3.42Å; Y269-Y272 VanDerWaalsContact CB-CD2 3.46Å; Y269-Y272 HydrophobicContact CD2-CD2 4.45Å; Y269-Y272 HydrophobicContact CG-CD2 4.09Å; Y269-Y272 HydrophobicContact CG-CE2 4.15Å; Y269-Y272 PolarHBondContact O-N 3.39Å; Y269-N273 PolarHBondContact O-N 2.72Å
270	S	97.6	Very high	98.2	Very high	73 Å²	73	57.9 Å²	57.9	51%	0.51	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-21.3	-175.8	60.8	0	0	0	0	114.9	K165 Y272 N273	K165-S270 WeakPolarHBondContact CE-O 3.29Å; K165-S270 PolarHBondContact NZ-O 2.75Å; S270-Y272 VanDerWaalsContact C-N 3.33Å; S270-N273 PolarHBondContact O-N 2.8Å
271	Q	98	Very high	98.2	Very high	81 Å²	81	62.4 Å²	62.4	38%	0.379	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-21	174.2	74	-79.9	10.9	0	0	114.1	Y269	Y269-Q271 PolarHBondContact O-N 3.42Å
272	Y	98.4	Very high	98.2	Very high	53 Å²	53	64.9 Å²	64.9	21%	0.208	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	-9.2	173.4	-49.9	-47.1	0	0	0	112.4	A168 F169 K172 L265 Y269 S270 I274	A168-Y272 HydrophobicContact CB-CD1 3.91Å; A168-Y272 HydrophobicContact CB-CE1 4.04Å; F169-Y272 VanDerWaalsContact CD2-O 3.31Å; F169-Y272 WeakPolarHBondContact CD2-O 3.3Å; K172-Y272 HydrophobicContact CB-CD1 4.07Å; K172-Y272 HydrophobicContact CB-CD2 4.47Å; K172-Y272 HydrophobicContact CB-CE1 3.94Å; K172-Y272 HydrophobicContact CB-CE2 4.38Å; K172-Y272 HydrophobicContact CB-CG 4.36Å; K172-Y272 HydrophobicContact CG-CD2 4.02Å; K172-Y272 HydrophobicContact CG-CE1 4.36Å; K172-Y272 HydrophobicContact CG-CE2 3.9Å; K172-Y272 HydrophobicContact CG-CG 4.36Å; L265-Y272 HydrophobicContact CD1-CD2 3.86Å; L265-Y272 HydrophobicContact CD1-CE2 4.38Å; L265-Y272 HydrophobicContact CG-CD2 4.13Å; Y269-Y272 VanDerWaalsContact CB-CD2 3.46Å; Y269-Y272 HydrophobicContact CD2-CD2 4.45Å; Y269-Y272 HydrophobicContact CG-CD2 4.09Å; Y269-Y272 HydrophobicContact CG-CE2 4.15Å; Y269-Y272 PolarHBondContact O-N 3.39Å; S270-Y272 VanDerWaalsContact C-N 3.33Å; Y272-I274 PolarHBondContact O-N 2.76Å
273	N	98.4	Very high	98.2	Very high	31 Å²	31	68.6 Å²	68.6	17%	0.166	32%	0.322	C	S	.	.			trans	-71.2	98.8	179.2	-165.1	-27.4	0	0	0	111.7	M266 Y269 S270 L275 E276	M266-N273 HydrophobicContact CB-CB 4.26Å; M266-N273 VanDerWaalsContact O-CB 3.22Å; M266-N273 WeakPolarHBondContact O-CB 3.38Å; M266-N273 VanDerWaalsContact O-CG 3.25Å; M266-N273 PolarHBondContact O-ND2 3.07Å; Y269-N273 PolarHBondContact O-N 2.72Å; S270-N273 PolarHBondContact O-N 2.8Å; N273-L275 VanDerWaalsContact C-N 3.34Å; N273-L275 WeakPolarHBondContact OD1-CA 3.29Å; N273-L275 PolarHBondContact OD1-N 3.33Å; N273-E276 HydrophobicContact CB-CB 4.5Å; N273-E276 PolarHBondContact OD1-N 2.92Å
274	I	98.4	Very high	98.2	Very high	4 Å²	4	76.5 Å²	76.5	2%	0.021	35%	0.351	C	S	.	.	S	Bend	trans	-83.5	-10.4	174.5	66.3	167.6	0	0	0	113.2	F150 I161 F166 F169 F216 F220 M266 Y272	F150-I274 HydrophobicContact CE1-CD1 4.28Å; F150-I274 HydrophobicContact CZ-CD1 4.49Å; I161-I274 HydrophobicContact CD1-CB 4.45Å; I161-I274 HydrophobicContact CG2-CB 3.7Å; I161-I274 HydrophobicContact CG2-CG2 3.93Å; F166-I274 HydrophobicContact CB-CG2 4.46Å; F166-I274 HydrophobicContact CD2-CD1 4.41Å; F166-I274 HydrophobicContact CD2-CG2 4.29Å; F169-I274 HydrophobicContact CB-CG2 3.69Å; F169-I274 HydrophobicContact CD1-CD1 4.07Å; F169-I274 HydrophobicContact CD1-CG2 4.26Å; F169-I274 HydrophobicContact CD2-CG2 4.45Å; F169-I274 HydrophobicContact CE1-CD1 4.03Å; F169-I274 HydrophobicContact CG-CD1 4.49Å; F169-I274 HydrophobicContact CG-CG2 3.88Å; F169-I274 HydrophobicContact CZ-CD1 4.41Å; F216-I274 HydrophobicContact CZ-CD1 4.3Å; F220-I274 HydrophobicContact CD2-CD1 4.11Å; F220-I274 HydrophobicContact CE2-CD1 3.89Å; F220-I274 HydrophobicContact CE2-CG1 4.5Å; M266-I274 HydrophobicContact SD-CG1 3.99Å; Y272-I274 PolarHBondContact O-N 2.76Å
275	L	98.3	Very high	98.2	Very high	4 Å²	4	76 Å²	76	2%	0.021	35%	0.353	C	S	.	.			trans	-96.7	-2	-177.6	-52	178.6	0	0	0	113	F216 F263 M266 N273 K277 L278 Y283 F286	F216-L275 HydrophobicContact CE1-CD2 3.73Å; F216-L275 HydrophobicContact CZ-CD2 3.63Å; F263-L275 HydrophobicContact CD1-CD1 4.34Å; F263-L275 HydrophobicContact CE1-CD1 3.69Å; M266-L275 HydrophobicContact CE-CD1 3.56Å; M266-L275 HydrophobicContact CE-CG 4.22Å; M266-L275 HydrophobicContact SD-CD1 3.93Å; M266-L275 HydrophobicContact SD-CG 3.9Å; N273-L275 VanDerWaalsContact C-N 3.34Å; N273-L275 WeakPolarHBondContact OD1-CA 3.29Å; N273-L275 PolarHBondContact OD1-N 3.33Å; L275-K277 PolarHBondContact O-N 3.47Å; L275-L278 HydrophobicContact CB-CD1 4.15Å; L275-L278 HydrophobicContact CB-CG 4.41Å; L275-L278 HydrophobicContact CD2-CD1 4Å; L275-L278 WeakPolarHBondContact O-CB 3.49Å; L275-L278 PolarHBondContact O-N 3.2Å; L275-Y283 HydrophobicContact CB-CD2 4.16Å; L275-Y283 HydrophobicContact CB-CE2 4.33Å; L275-Y283 HydrophobicContact CD1-CD2 4.23Å; L275-Y283 HydrophobicContact CD1-CE2 3.93Å; L275-F286 HydrophobicContact CD1-CD1 3.88Å; L275-F286 HydrophobicContact CD1-CE1 3.52Å; L275-F286 HydrophobicContact CD1-CZ 4.36Å; L275-F286 HydrophobicContact CD2-CD1 4.16Å; L275-F286 HydrophobicContact CD2-CE1 3.63Å; L275-F286 HydrophobicContact CD2-CE2 4.24Å; L275-F286 HydrophobicContact CD2-CZ 3.66Å; L275-F286 HydrophobicContact CG-CE1 4.24Å
276	E	97.2	Very high	98.2	Very high	85 Å²	85	75.5 Å²	75.5	40%	0.397	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.9	-22.1	-175.1	-173.4	-167.4	-114.6	0	0	114.6	K165 N273	K165-E276 IonicContact NZ-OE1 3.31Å; K165-E276 PolarHBondContact NZ-OE1 3.17Å; K165-E276 IonicContact NZ-OE2 2.65Å; K165-E276 PolarHBondContact NZ-OE2 3.4Å; N273-E276 HydrophobicContact CB-CB 4.5Å; N273-E276 PolarHBondContact OD1-N 2.92Å
277	K	98	Very high	98.2	Very high	109 Å²	109	79.4 Å²	79.4	47%	0.474	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104	-0.3	-178.2	-55.9	-48.1	-173.6	-143.2	0	114.5	Y159 K160 L275	Y159-K277 WeakPolarHBondContact O-CB 3.46Å; K160-K277 HydrophobicContact CB-CB 4.19Å; K160-K277 HydrophobicContact CB-CG 4.23Å; L275-K277 PolarHBondContact O-N 3.47Å
278	L	98.2	Very high	98.3	Very high	20 Å²	20	77.8 Å²	77.8	11%	0.105	36%	0.361	C	S	.	.	S	Bend	trans	-67	145.5	166.5	-61.7	-171.3	0	0	0	109.9	Y159 L213 L275 E282 F286	Y159-L278 HydrophobicContact CD1-CD2 3.27Å; Y159-L278 HydrophobicContact CE1-CD2 3.88Å; Y159-L278 HydrophobicContact CG-CD2 3.82Å; L213-L278 HydrophobicContact CD1-CD1 4.5Å; L213-L278 HydrophobicContact CD1-CD2 4.33Å; L275-L278 HydrophobicContact CB-CD1 4.15Å; L275-L278 HydrophobicContact CB-CG 4.41Å; L275-L278 HydrophobicContact CD2-CD1 4Å; L275-L278 WeakPolarHBondContact O-CB 3.49Å; L275-L278 PolarHBondContact O-N 3.2Å; L278-E282 HydrophobicContact CB-CB 4.02Å; L278-E282 HydrophobicContact CD1-CB 4.48Å; L278-E282 HydrophobicContact CD2-CB 4.24Å; L278-E282 HydrophobicContact CG-CB 4.48Å; L278-F286 HydrophobicContact CD1-CB 4.18Å; L278-F286 HydrophobicContact CD1-CG 4.24Å
279	S	98.1	Very high	98.3	Very high	55 Å²	55	74.1 Å²	74.1	39%	0.385	34%	0.342	S	S	.	.			trans	-67	168	166.9	69.8	0	0	0	0	111.6	Q281 E282 Y283	S279-Q281 PolarHBondContact O-N 2.85Å; S279-Q281 VanDerWaalsContact O-N 3.16Å; S279-Q281 PolarHBondContact OG-N 3.37Å; S279-E282 WeakPolarHBondContact CA-OE2 3.47Å; S279-E282 WeakPolarHBondContact CB-OE2 3.47Å; S279-E282 PolarHBondContact N-OE2 3.38Å; S279-E282 PolarHBondContact O-N 2.9Å; S279-E282 WeakPolarHBondContact OG-CG 3.2Å; S279-E282 PolarHBondContact OG-N 3.13Å; S279-E282 PolarHBondContact OG-OE2 3.42Å; S279-Y283 WeakPolarHBondContact O-CB 3.5Å; S279-Y283 PolarHBondContact O-N 3.5Å
280	K	98	Very high	98.3	Very high	183 Å²	183	68.4 Å²	68.4	80%	0.796	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-18.1	175.2	-65.8	-175.3	-179.9	-179.8	0	113.6	R284	K280-R284 VanDerWaalsContact O-CD 3.24Å; K280-R284 WeakPolarHBondContact O-CD 3.34Å; K280-R284 VanDerWaalsContact O-CG 3.26Å; K280-R284 WeakPolarHBondContact O-CG 3.32Å
281	Q	98.4	Very high	98.4	Very high	127 Å²	127	66.6 Å²	66.6	59%	0.593	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-57.1	175.1	176.4	168.4	-8.9	0	0	110	S279 Y283 R284 E285	S279-Q281 PolarHBondContact O-N 2.85Å; S279-Q281 VanDerWaalsContact O-N 3.16Å; S279-Q281 PolarHBondContact OG-N 3.37Å; Q281-Y283 PolarHBondContact O-N 3.06Å; Q281-R284 WeakPolarHBondContact O-CA 3.47Å; Q281-R284 WeakPolarHBondContact O-CB 3.49Å; Q281-R284 PolarHBondContact O-N 3.12Å; Q281-E285 VanDerWaalsContact CG-CD 3.5Å; Q281-E285 HydrophobicContact CG-CG 4.47Å; Q281-E285 WeakPolarHBondContact CG-OE1 3.3Å; Q281-E285 PolarHBondContact NE2-OE1 3.2Å; Q281-E285 PolarHBondContact O-N 3.25Å
282	E	98.5	Very high	98.4	Very high	61 Å²	61	67.5 Å²	67.5	29%	0.285	31%	0.309	S	S	.	.	H	α-helix	trans	-54.1	-40.7	178	-68.3	158.8	107.1	0	0	111.9	L213 L278 S279 R284 E285 F286	L213-E282 HydrophobicContact CD1-CB 4.16Å; L213-E282 HydrophobicContact CD2-CB 3.95Å; L213-E282 HydrophobicContact CD2-CG 4.17Å; L278-E282 HydrophobicContact CB-CB 4.02Å; L278-E282 HydrophobicContact CD1-CB 4.48Å; L278-E282 HydrophobicContact CD2-CB 4.24Å; L278-E282 HydrophobicContact CG-CB 4.48Å; S279-E282 WeakPolarHBondContact CA-OE2 3.47Å; S279-E282 WeakPolarHBondContact CB-OE2 3.47Å; S279-E282 PolarHBondContact N-OE2 3.38Å; S279-E282 PolarHBondContact O-N 2.9Å; S279-E282 WeakPolarHBondContact OG-CG 3.2Å; S279-E282 PolarHBondContact OG-N 3.13Å; S279-E282 PolarHBondContact OG-OE2 3.42Å; E282-R284 VanDerWaalsContact C-N 3.31Å; E282-R284 PolarHBondContact O-N 3.05Å; E282-E285 PolarHBondContact O-N 3.23Å; E282-F286 WeakPolarHBondContact O-CB 3.28Å; E282-F286 PolarHBondContact O-N 3.31Å
283	Y	98.7	Very high	98.4	Very high	79 Å²	79	65 Å²	65	31%	0.31	30%	0.299	S	S	.	.	H	α-helix	trans	-63.2	-34.6	176.6	179.1	-91.3	0	0	0	113	F263 L275 S279 Q281 R287	F263-Y283 HydrophobicContact CE1-CE2 4.43Å; L275-Y283 HydrophobicContact CB-CD2 4.16Å; L275-Y283 HydrophobicContact CB-CE2 4.33Å; L275-Y283 HydrophobicContact CD1-CD2 4.23Å; L275-Y283 HydrophobicContact CD1-CE2 3.93Å; S279-Y283 WeakPolarHBondContact O-CB 3.5Å; S279-Y283 PolarHBondContact O-N 3.5Å; Q281-Y283 PolarHBondContact O-N 3.06Å; Y283-R287 HydrophobicContact CE1-CB 4.45Å; Y283-R287 WeakPolarHBondContact O-CB 3.33Å; Y283-R287 PolarHBondContact O-N 3.27Å
284	R	98.5	Very high	98.4	Very high	172 Å²	172	63.5 Å²	63.5	65%	0.649	29%	0.291	S	S	*	.	H	α-helix	trans	-73.1	-47.6	177.2	-73.4	170.7	174.9	-178	-5.3	111	K280 Q281 E282 R287 N288	K280-R284 VanDerWaalsContact O-CD 3.24Å; K280-R284 WeakPolarHBondContact O-CD 3.34Å; K280-R284 VanDerWaalsContact O-CG 3.26Å; K280-R284 WeakPolarHBondContact O-CG 3.32Å; Q281-R284 WeakPolarHBondContact O-CA 3.47Å; Q281-R284 WeakPolarHBondContact O-CB 3.49Å; Q281-R284 PolarHBondContact O-N 3.12Å; E282-R284 VanDerWaalsContact C-N 3.31Å; E282-R284 PolarHBondContact O-N 3.05Å; R284-R287 PolarHBondContact O-N 3.24Å; R284-N288 WeakPolarHBondContact O-CB 3.49Å; R284-N288 PolarHBondContact O-N 2.79Å; R284-N288 PolarHBondContact O-OD1 2.98Å
285	E	98.5	Very high	98.4	Very high	86 Å²	86	65.4 Å²	65.4	40%	0.402	30%	0.301	S	S	.	.	H	α-helix	trans	-59.9	-50.2	178.4	-69.7	159.9	174.2	0	0	110.5	L213 Q281 E282 N288 L289	L213-E285 HydrophobicContact CD2-CB 3.83Å; Q281-E285 VanDerWaalsContact CG-CD 3.5Å; Q281-E285 HydrophobicContact CG-CG 4.47Å; Q281-E285 WeakPolarHBondContact CG-OE1 3.3Å; Q281-E285 PolarHBondContact NE2-OE1 3.2Å; Q281-E285 PolarHBondContact O-N 3.25Å; E282-E285 PolarHBondContact O-N 3.23Å; E285-N288 PolarHBondContact O-N 3.41Å; E285-L289 WeakPolarHBondContact O-CB 3.38Å; E285-L289 PolarHBondContact O-N 3.04Å; E285-L289 VanDerWaalsContact O-N 3.08Å
286	F	98.8	Very high	98.4	Very high	0 Å²	0	66.3 Å²	66.3	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-57.7	-49.4	173.3	-179.1	-84.6	0	0	0	112.3	L213 F216 A217 F220 F263 L275 L278 E282 N288 L289 V290	L213-F286 HydrophobicContact CD1-CB 4.16Å; L213-F286 HydrophobicContact CD1-CD2 4.21Å; L213-F286 HydrophobicContact CG-CB 4.38Å; F216-F286 HydrophobicContact CB-CE2 4.34Å; F216-F286 AromaticContact CD1-CD2 3.81Å; F216-F286 HydrophobicContact CD1-CD2 3.81Å; F216-F286 AromaticContact CD1-CE2 3.44Å; F216-F286 HydrophobicContact CD1-CE2 3.44Å; F216-F286 VanDerWaalsContact CD1-CE2 3.44Å; F216-F286 HydrophobicContact CD1-CZ 4.43Å; F216-F286 AromaticContact CD2-CE2 3.97Å; F216-F286 HydrophobicContact CD2-CE2 3.97Å; F216-F286 HydrophobicContact CE1-CD2 4.1Å; F216-F286 AromaticContact CE1-CE2 3.56Å; F216-F286 HydrophobicContact CE1-CE2 3.56Å; F216-F286 HydrophobicContact CE1-CZ 4.14Å; F216-F286 HydrophobicContact CE2-CE2 4.04Å; F216-F286 HydrophobicContact CE2-CZ 4.31Å; F216-F286 HydrophobicContact CG-CD2 4.28Å; F216-F286 AromaticContact CG-CE2 3.66Å; F216-F286 HydrophobicContact CG-CE2 3.66Å; F216-F286 AromaticContact CZ-CE2 3.85Å; F216-F286 HydrophobicContact CZ-CE2 3.85Å; F216-F286 HydrophobicContact CZ-CZ 4.07Å; A217-F286 HydrophobicContact CB-CD2 3.81Å; A217-F286 HydrophobicContact CB-CE2 4.06Å; A217-F286 HydrophobicContact CB-CG 4.45Å; F220-F286 HydrophobicContact CB-CE2 4.22Å; F220-F286 HydrophobicContact CB-CZ 3.79Å; F220-F286 HydrophobicContact CD1-CE1 4.02Å; F220-F286 AromaticContact CD1-CZ 3.69Å; F220-F286 HydrophobicContact CD1-CZ 3.69Å; F220-F286 HydrophobicContact CD2-CZ 4.06Å; F220-F286 HydrophobicContact CE1-CE1 4.22Å; F220-F286 HydrophobicContact CE1-CZ 4.26Å; F220-F286 HydrophobicContact CG-CE1 4.33Å; F220-F286 HydrophobicContact CG-CE2 4.47Å; F220-F286 AromaticContact CG-CZ 3.57Å; F220-F286 HydrophobicContact CG-CZ 3.57Å; F263-F286 HydrophobicContact CE1-CD1 4.33Å; F263-F286 HydrophobicContact CE1-CE1 4.22Å; F263-F286 HydrophobicContact CZ-CD1 4.18Å; F263-F286 HydrophobicContact CZ-CE1 4.04Å; L275-F286 HydrophobicContact CD1-CD1 3.88Å; L275-F286 HydrophobicContact CD1-CE1 3.52Å; L275-F286 HydrophobicContact CD1-CZ 4.36Å; L275-F286 HydrophobicContact CD2-CD1 4.16Å; L275-F286 HydrophobicContact CD2-CE1 3.63Å; L275-F286 HydrophobicContact CD2-CE2 4.24Å; L275-F286 HydrophobicContact CD2-CZ 3.66Å; L275-F286 HydrophobicContact CG-CE1 4.24Å; L278-F286 HydrophobicContact CD1-CB 4.18Å; L278-F286 HydrophobicContact CD1-CG 4.24Å; E282-F286 WeakPolarHBondContact O-CB 3.28Å; E282-F286 PolarHBondContact O-N 3.31Å; F286-N288 PolarHBondContact O-N 2.99Å; F286-L289 PolarHBondContact O-N 2.87Å; F286-V290 HydrophobicContact CD1-CG2 4.03Å; F286-V290 HydrophobicContact CE1-CG2 3.72Å; F286-V290 HydrophobicContact CE2-CG2 4.37Å; F286-V290 HydrophobicContact CG-CG2 4.47Å; F286-V290 HydrophobicContact CZ-CG2 3.92Å; F286-V290 WeakPolarHBondContact O-CB 3.36Å; F286-V290 VanDerWaalsContact O-CG2 3.25Å; F286-V290 WeakPolarHBondContact O-CG2 3.47Å; F286-V290 PolarHBondContact O-N 2.76Å
287	R	98.7	Very high	98.5	Very high	85 Å²	85	62.6 Å²	62.6	32%	0.321	29%	0.291	S	S	.	.	H	α-helix	trans	-64.1	-42.3	-178.6	175.4	172.7	165.8	71.8	5.8	112	F263 Y283 R284 V291	F263-R287 VanDerWaalsContact CB-NH1 3.32Å; F263-R287 HydrophobicContact CE1-CB 4.13Å; F263-R287 HydrophobicContact CE1-CG 4.16Å; F263-R287 HydrophobicContact CE2-CG 4.11Å; F263-R287 HydrophobicContact CZ-CB 3.99Å; F263-R287 HydrophobicContact CZ-CG 3.94Å; Y283-R287 HydrophobicContact CE1-CB 4.45Å; Y283-R287 WeakPolarHBondContact O-CB 3.33Å; Y283-R287 PolarHBondContact O-N 3.27Å; R284-R287 PolarHBondContact O-N 3.24Å; R287-V291 HydrophobicContact CG-CG2 4.21Å; R287-V291 WeakPolarHBondContact O-CB 3.27Å; R287-V291 VanDerWaalsContact O-CG2 3.23Å; R287-V291 WeakPolarHBondContact O-CG2 3.48Å; R287-V291 PolarHBondContact O-N 3.28Å
288	N	98.7	Very high	98.4	Very high	111 Å²	111	57.4 Å²	57.4	59%	0.594	27%	0.269	S	S	*	.	H	α-helix	trans	-61.6	-50.3	179.3	-70.3	2	0	0	0	110.2	R284 E285 F286 V290 V291 E292	R284-N288 WeakPolarHBondContact O-CB 3.49Å; R284-N288 PolarHBondContact O-N 2.79Å; R284-N288 PolarHBondContact O-OD1 2.98Å; E285-N288 PolarHBondContact O-N 3.41Å; F286-N288 PolarHBondContact O-N 2.99Å; N288-V290 PolarHBondContact O-N 3.44Å; N288-V291 PolarHBondContact O-N 3.44Å; N288-E292 PolarHBondContact O-N 2.87Å
289	L	98.7	Very high	98.3	Very high	18 Å²	18	57.2 Å²	57.2	9%	0.094	27%	0.267	C	S	.	.	H	α-helix	trans	-63.5	-40.7	-179.9	-178.1	55.9	0	0	0	112.8	E214 A217 E285 F286 E292 I293 T322 L325	E214-L289 HydrophobicContact CB-CD2 3.98Å; E214-L289 HydrophobicContact CG-CD2 3.87Å; A217-L289 HydrophobicContact CB-CB 4.24Å; A217-L289 HydrophobicContact CB-CD2 3.71Å; A217-L289 HydrophobicContact CB-CG 3.96Å; E285-L289 WeakPolarHBondContact O-CB 3.38Å; E285-L289 PolarHBondContact O-N 3.04Å; E285-L289 VanDerWaalsContact O-N 3.08Å; F286-L289 PolarHBondContact O-N 2.87Å; L289-E292 PolarHBondContact O-N 3.18Å; L289-I293 HydrophobicContact CD1-CD1 3.66Å; L289-I293 HydrophobicContact CD1-CG1 4.03Å; L289-I293 HydrophobicContact CG-CD1 3.82Å; L289-I293 WeakPolarHBondContact O-CB 3.31Å; L289-I293 VanDerWaalsContact O-CG1 3.23Å; L289-I293 WeakPolarHBondContact O-CG1 3.44Å; L289-I293 PolarHBondContact O-N 3.47Å; L289-T322 HydrophobicContact CD1-CG2 3.83Å; L289-L325 HydrophobicContact CD1-CD1 4.4Å; L289-L325 HydrophobicContact CD2-CD1 4.28Å
290	V	98.9	Very high	98	Very high	0 Å²	0	57.6 Å²	57.6	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-66.4	-38.9	175.3	173.5	0	0	0	0	112	A217 F220 S221 F263 F286 N288 V294	A217-V290 HydrophobicContact CB-CG2 3.88Å; F220-V290 HydrophobicContact CD1-CG1 3.86Å; F220-V290 HydrophobicContact CD1-CG2 3.85Å; F220-V290 HydrophobicContact CE1-CG1 4.01Å; S221-V290 WeakPolarHBondContact OG-CA 3.21Å; F263-V290 HydrophobicContact CE2-CB 4.04Å; F263-V290 HydrophobicContact CE2-CG1 3.68Å; F263-V290 HydrophobicContact CZ-CB 4.03Å; F263-V290 HydrophobicContact CZ-CG1 3.98Å; F286-V290 HydrophobicContact CD1-CG2 4.03Å; F286-V290 HydrophobicContact CE1-CG2 3.72Å; F286-V290 HydrophobicContact CE2-CG2 4.37Å; F286-V290 HydrophobicContact CG-CG2 4.47Å; F286-V290 HydrophobicContact CZ-CG2 3.92Å; F286-V290 WeakPolarHBondContact O-CB 3.36Å; F286-V290 VanDerWaalsContact O-CG2 3.25Å; F286-V290 WeakPolarHBondContact O-CG2 3.47Å; F286-V290 PolarHBondContact O-N 2.76Å; N288-V290 PolarHBondContact O-N 3.44Å; V290-V294 HydrophobicContact CG1-CG2 4.35Å; V290-V294 WeakPolarHBondContact O-CB 3.23Å; V290-V294 VanDerWaalsContact O-CG2 3.26Å; V290-V294 WeakPolarHBondContact O-CG2 3.22Å; V290-V294 PolarHBondContact O-N 2.99Å; V290-V294 VanDerWaalsContact O-N 3.1Å
291	V	98.8	Very high	97.8	Very high	34 Å²	34	50.9 Å²	50.9	21%	0.206	24%	0.244	C	C	.	.	H	α-helix	trans	-66.2	-43.6	177.3	168.5	0	0	0	0	110.7	A259 F263 R287 N288 V294 L295	A259-V291 HydrophobicContact CB-CG2 4.44Å; F263-V291 HydrophobicContact CE2-CG2 4.28Å; R287-V291 HydrophobicContact CG-CG2 4.21Å; R287-V291 WeakPolarHBondContact O-CB 3.27Å; R287-V291 VanDerWaalsContact O-CG2 3.23Å; R287-V291 WeakPolarHBondContact O-CG2 3.48Å; R287-V291 PolarHBondContact O-N 3.28Å; N288-V291 PolarHBondContact O-N 3.44Å; V291-V294 PolarHBondContact O-N 2.99Å; V291-L295 HydrophobicContact CG1-CD1 3.83Å; V291-L295 HydrophobicContact CG1-CG 4.42Å; V291-L295 WeakPolarHBondContact O-CB 3.33Å; V291-L295 VanDerWaalsContact O-CG 3.27Å; V291-L295 WeakPolarHBondContact O-CG 2.92Å; V291-L295 PolarHBondContact O-N 3.49Å
292	E	98.5	Very high	97.7	Very high	100 Å²	100	44.9 Å²	44.9	47%	0.467	22%	0.216	S	C	.	.	H	α-helix	trans	-61.2	-52.3	177.9	-158.8	71.9	-174.8	0	0	111.3	N288 L289 V294 L295 C296 T322	N288-E292 PolarHBondContact O-N 2.87Å; L289-E292 PolarHBondContact O-N 3.18Å; E292-V294 VanDerWaalsContact C-N 3.32Å; E292-V294 PolarHBondContact O-N 3.25Å; E292-L295 PolarHBondContact O-N 3.3Å; E292-C296 PolarHBondContact O-N 2.99Å; E292-C296 PolarHBondContact O-SG 2.81Å; E292-C296 VanDerWaalsContact O-SG 3.37Å; E292-T322 HydrophobicContact CB-CG2 4.18Å; E292-T322 HydrophobicContact CG-CG2 3.81Å
293	I	98.8	Very high	97.6	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-59.3	-40.7	-178.8	-69.4	170.6	0	0	0	111.9	S221 L289 C296 L325 S326 I329	S221-I293 VanDerWaalsContact CB-CG2 3.43Å; L289-I293 HydrophobicContact CD1-CD1 3.66Å; L289-I293 HydrophobicContact CD1-CG1 4.03Å; L289-I293 HydrophobicContact CG-CD1 3.82Å; L289-I293 WeakPolarHBondContact O-CB 3.31Å; L289-I293 VanDerWaalsContact O-CG1 3.23Å; L289-I293 WeakPolarHBondContact O-CG1 3.44Å; L289-I293 PolarHBondContact O-N 3.47Å; I293-C296 PolarHBondContact O-N 3.25Å; I293-L325 HydrophobicContact CD1-CB 3.94Å; I293-L325 HydrophobicContact CG1-CB 4.46Å; I293-S326 WeakPolarHBondContact CG1-OG 3.43Å; I293-I329 HydrophobicContact CG2-CB 3.79Å; I293-I329 HydrophobicContact CG2-CG1 3.46Å; I293-I329 VanDerWaalsContact CG2-CG1 3.46Å; I293-I329 HydrophobicContact CG2-CG2 4.07Å
294	V	98.8	Very high	97.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-74.3	-33.5	179.8	174	0	0	0	0	111.9	V224 H225 H258 A259 V290 V291 E292 C296 T297	V224-V294 HydrophobicContact CG2-CG2 4.48Å; H225-V294 HydrophobicContact CB-CG2 4.28Å; H258-V294 HydrophobicContact CB-CG1 4.28Å; A259-V294 HydrophobicContact CB-CB 4.3Å; A259-V294 HydrophobicContact CB-CG1 4Å; V290-V294 HydrophobicContact CG1-CG2 4.35Å; V290-V294 WeakPolarHBondContact O-CB 3.23Å; V290-V294 VanDerWaalsContact O-CG2 3.26Å; V290-V294 WeakPolarHBondContact O-CG2 3.22Å; V290-V294 PolarHBondContact O-N 2.99Å; V290-V294 VanDerWaalsContact O-N 3.1Å; V291-V294 PolarHBondContact O-N 2.99Å; E292-V294 VanDerWaalsContact C-N 3.32Å; E292-V294 PolarHBondContact O-N 3.25Å; V294-C296 PolarHBondContact O-N 2.71Å; V294-T297 PolarHBondContact O-N 3.19Å; V294-T297 PolarHBondContact O-OG1 2.74Å
295	L	98.4	Very high	97.4	Very high	44 Å²	44	35.7 Å²	35.7	23%	0.23	19%	0.194	C	C	.	.	H	α-helix	trans	-67.8	-26.2	172.2	-69.2	174.1	0	0	0	112.2	E255 N256 V291 E292 T297 D298	E255-L295 HydrophobicContact CB-CD2 4.09Å; N256-L295 HydrophobicContact CB-CD2 4.45Å; N256-L295 WeakPolarHBondContact ND2-CD2 3.29Å; V291-L295 HydrophobicContact CG1-CD1 3.83Å; V291-L295 HydrophobicContact CG1-CG 4.42Å; V291-L295 WeakPolarHBondContact O-CB 3.33Å; V291-L295 VanDerWaalsContact O-CG 3.27Å; V291-L295 WeakPolarHBondContact O-CG 2.92Å; V291-L295 PolarHBondContact O-N 3.49Å; E292-L295 PolarHBondContact O-N 3.3Å; L295-T297 VanDerWaalsContact C-N 3.29Å; L295-T297 PolarHBondContact O-N 3.48Å; L295-D298 WeakPolarHBondContact O-CB 3.28Å; L295-D298 PolarHBondContact O-N 3.42Å
296	C	97.9	Very high	97.3	Very high	23 Å²	23	32.2 Å²	32.2	16%	0.155	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	0.8	173.6	-68.2	0	0	0	0	115.4	E292 I293 V294 D298 Q305 H330	E292-C296 PolarHBondContact O-N 2.99Å; E292-C296 PolarHBondContact O-SG 2.81Å; E292-C296 VanDerWaalsContact O-SG 3.37Å; I293-C296 PolarHBondContact O-N 3.25Å; V294-C296 PolarHBondContact O-N 2.71Å; C296-D298 VanDerWaalsContact C-N 3.32Å; C296-Q305 PolarHBondContact O-NE2 3.28Å; C296-H330 PolarHBondContact O-CE1 2.89Å; C296-H330 PolarHBondContact O-ND1 3.17Å
297	T	98	Very high	97.3	Very high	7 Å²	7	35.3 Å²	35.3	4%	0.043	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.4	-12.6	166.6	60.6	0	0	0	0	112.8	H225 V294 L295 M299 I329 H330	H225-T297 HydrophobicContact CB-CG2 4.06Å; V294-T297 PolarHBondContact O-N 3.19Å; V294-T297 PolarHBondContact O-OG1 2.74Å; L295-T297 VanDerWaalsContact C-N 3.29Å; L295-T297 PolarHBondContact O-N 3.48Å; T297-M299 PolarHBondContact O-N 2.87Å; T297-I329 HydrophobicContact CG2-CG2 3.93Å; T297-H330 WeakPolarHBondContact CA-CE1 3.49Å; T297-H330 PolarHBondContact O-CE1 3.46Å; T297-H330 PolarHBondContact O-NE2 2.82Å
298	D	97.5	Very high	97.2	Very high	1 Å²	1	35.1 Å²	35.1	1%	0.005	20%	0.195	C	C	.	.			trans	-59.3	111.2	174.7	-177.6	-21.7	0	0	0	110.9	S252 E255 L295 C296 S300 T301	S252-D298 VanDerWaalsContact CA-OD2 3.24Å; S252-D298 WeakPolarHBondContact CA-OD2 3.45Å; S252-D298 WeakPolarHBondContact CB-OD2 3.26Å; S252-D298 PolarHBondContact OG-OD2 2.73Å; E255-D298 HydrophobicContact CG-CB 3.9Å; L295-D298 WeakPolarHBondContact O-CB 3.28Å; L295-D298 PolarHBondContact O-N 3.42Å; C296-D298 VanDerWaalsContact C-N 3.32Å; D298-S300 PolarHBondContact O-N 2.9Å; D298-S300 VanDerWaalsContact O-N 3.1Å; D298-S300 WeakPolarHBondContact OD1-CB 3.44Å; D298-S300 PolarHBondContact OD1-N 2.9Å; D298-S300 PolarHBondContact OD1-OG 2.73Å; D298-S300 PolarHBondContact OD2-OG 3.4Å; D298-T301 HydrophobicContact CB-CG2 4.18Å; D298-T301 WeakPolarHBondContact O-CB 3.42Å; D298-T301 PolarHBondContact O-N 3.01Å; D298-T301 PolarHBondContact O-OG1 3.44Å
299	M	94.7	Very high	97.1	Very high	15 Å²	15	30 Å²	30	7%	0.074	17%	0.168	C	C	.	.	G	3₁₀ helix	trans	-58.8	-20.4	-179	-81.4	-61	-57.7	0	0	114.4	L86 F90 T297 T301 H302 H330 I334 F387 I391	L86-M299 HydrophobicContact CD1-CE 4.16Å; L86-M299 HydrophobicContact CD2-CE 3.67Å; F90-M299 HydrophobicContact CB-CB 4.11Å; F90-M299 HydrophobicContact CG-CB 4.26Å; T297-M299 PolarHBondContact O-N 2.87Å; M299-T301 PolarHBondContact O-N 3.2Å; M299-H302 HydrophobicContact CE-CB 4.16Å; M299-H302 VanDerWaalsContact O-CB 3.24Å; M299-H302 WeakPolarHBondContact O-CB 3.32Å; M299-H302 PolarHBondContact O-N 2.62Å; M299-H330 WeakPolarHBondContact CA-NE2 3.45Å; M299-H330 PolarHBondContact SD-NE2 2.91Å; M299-I334 HydrophobicContact CE-CD1 4.31Å; M299-I334 HydrophobicContact SD-CD1 4.08Å; M299-I334 HydrophobicContact SD-CG2 4.02Å; M299-F387 HydrophobicContact CE-CE2 4.48Å; M299-I391 HydrophobicContact CE-CG2 4.09Å
300	S	92.9	Very high	97	Very high	64 Å²	64	32.5 Å²	32.5	45%	0.448	18%	0.178	S	C	.	.	G	3₁₀ helix	trans	-66	-23.8	172.7	72.6	0	0	0	0	112.8	D298	D298-S300 PolarHBondContact O-N 2.9Å; D298-S300 VanDerWaalsContact O-N 3.1Å; D298-S300 WeakPolarHBondContact OD1-CB 3.44Å; D298-S300 PolarHBondContact OD1-N 2.9Å; D298-S300 PolarHBondContact OD1-OG 2.73Å; D298-S300 PolarHBondContact OD2-OG 3.4Å
301	T	94	Very high	96.9	Very high	41 Å²	41	38.1 Å²	38.1	25%	0.252	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	-85.2	-11.1	177.6	72.3	0	0	0	0	113.6	D298 M299 F303 A304 Q305	D298-T301 HydrophobicContact CB-CG2 4.18Å; D298-T301 WeakPolarHBondContact O-CB 3.42Å; D298-T301 PolarHBondContact O-N 3.01Å; D298-T301 PolarHBondContact O-OG1 3.44Å; M299-T301 PolarHBondContact O-N 3.2Å; T301-F303 PolarHBondContact O-N 3.48Å; T301-A304 WeakPolarHBondContact O-CB 3.13Å; T301-A304 PolarHBondContact O-N 3.46Å; T301-Q305 PolarHBondContact O-N 3.03Å; T301-Q305 PolarHBondContact OG1-NE2 3.27Å
302	H	96.3	Very high	96.7	Very high	2 Å²	2	37.6 Å²	37.6	1%	0.009	20%	0.2	C	C	.	.	H	α-helix	trans	-48.2	-55.7	-169.3	176.6	83.6	0	0	0	113.8	M299 A304 Q305 V306 H330 I391	M299-H302 HydrophobicContact CE-CB 4.16Å; M299-H302 VanDerWaalsContact O-CB 3.24Å; M299-H302 WeakPolarHBondContact O-CB 3.32Å; M299-H302 PolarHBondContact O-N 2.62Å; H302-A304 VanDerWaalsContact C-N 3.29Å; H302-A304 PolarHBondContact O-N 3.31Å; H302-Q305 PolarHBondContact O-N 2.68Å; H302-V306 WeakPolarHBondContact O-CG2 2.98Å; H302-V306 PolarHBondContact O-N 2.72Å; H302-H330 AromaticContact ND1-CD2 3.63Å; H302-I391 VanDerWaalsContact CE1-CG2 3.5Å; H302-I391 WeakPolarHBondContact CE1-CG2 3.17Å
303	F	95.2	Very high	96.4	Very high	37 Å²	37	34 Å²	34	16%	0.162	18%	0.183	C	C	.	.	H	α-helix	trans	-67	-28.8	-178	-63.1	-56.2	0	0	0	113.3	V78 R83 L86 T301 K307 I391	V78-F303 HydrophobicContact CG1-CE1 4Å; V78-F303 HydrophobicContact CG1-CE2 4.36Å; V78-F303 HydrophobicContact CG1-CZ 3.71Å; V78-F303 HydrophobicContact CG2-CE1 4.1Å; R83-F303 HydrophobicContact CB-CE2 4.39Å; R83-F303 HydrophobicContact CG-CD2 4.33Å; R83-F303 HydrophobicContact CG-CE2 4.22Å; L86-F303 HydrophobicContact CD1-CD2 4.41Å; L86-F303 HydrophobicContact CD1-CE2 3.63Å; L86-F303 HydrophobicContact CD1-CZ 3.81Å; T301-F303 PolarHBondContact O-N 3.48Å; F303-K307 WeakPolarHBondContact O-CB 3.16Å; F303-K307 PolarHBondContact O-N 2.94Å; F303-I391 HydrophobicContact CE1-CD1 3.89Å; F303-I391 HydrophobicContact CZ-CD1 3.63Å
304	A	96.1	Very high	96.1	Very high	66 Å²	66	39.5 Å²	39.5	55%	0.545	22%	0.217	S	C	.	.	H	α-helix	trans	-69.5	-46.7	175.5	0	0	0	0	0	110.5	T301 H302 V306 K307 E308	T301-A304 WeakPolarHBondContact O-CB 3.13Å; T301-A304 PolarHBondContact O-N 3.46Å; H302-A304 VanDerWaalsContact C-N 3.29Å; H302-A304 PolarHBondContact O-N 3.31Å; A304-V306 PolarHBondContact O-N 3.11Å; A304-K307 PolarHBondContact O-N 3.07Å; A304-E308 WeakPolarHBondContact O-CB 3.43Å; A304-E308 PolarHBondContact O-N 3.24Å
305	Q	97	Very high	95.7	Very high	15 Å²	15	40.9 Å²	40.9	7%	0.07	23%	0.227	C	C	.	.	H	α-helix	trans	-58.9	-47.6	173.7	-68.1	-173.7	62.3	0	0	111.9	C296 T301 H302 K307 E308 V309 F327 H330	C296-Q305 PolarHBondContact O-NE2 3.28Å; T301-Q305 PolarHBondContact O-N 3.03Å; T301-Q305 PolarHBondContact OG1-NE2 3.27Å; H302-Q305 PolarHBondContact O-N 2.68Å; Q305-K307 VanDerWaalsContact C-N 3.32Å; Q305-K307 PolarHBondContact O-N 2.71Å; Q305-E308 PolarHBondContact O-N 3Å; Q305-V309 WeakPolarHBondContact O-CB 3.05Å; Q305-V309 VanDerWaalsContact O-CG2 3.32Å; Q305-V309 WeakPolarHBondContact O-CG2 3.34Å; Q305-V309 PolarHBondContact O-N 3.41Å; Q305-F327 HydrophobicContact CB-CD2 4.19Å; Q305-H330 PolarHBondContact NE2-CE1 3.18Å
306	V	97.6	Very high	95.2	Very high	13 Å²	13	48.3 Å²	48.3	8%	0.079	26%	0.26	C	S	.	.	H	α-helix	trans	-60.1	-40.3	178.4	170	0	0	0	0	111.6	H302 A304 K310 F327 M395 V398	H302-V306 WeakPolarHBondContact O-CG2 2.98Å; H302-V306 PolarHBondContact O-N 2.72Å; A304-V306 PolarHBondContact O-N 3.11Å; V306-K310 WeakPolarHBondContact O-CB 3.21Å; V306-K310 WeakPolarHBondContact O-CG 3.33Å; V306-K310 PolarHBondContact O-N 3.41Å; V306-F327 HydrophobicContact CG2-CE2 3.84Å; V306-F327 HydrophobicContact CG2-CZ 4.37Å; V306-M395 HydrophobicContact CG2-CG 4.49Å; V306-V398 HydrophobicContact CG1-CG2 4.2Å
307	K	97.3	Very high	94.6	Very high	66 Å²	66	53 Å²	53	29%	0.287	28%	0.284	S	S	.	.	H	α-helix	trans	-69.5	-44.6	177	-168.7	169	-168.1	146.9	0	111.8	S75 E76 F303 A304 Q305 K310 Q311	S75-K307 WeakPolarHBondContact OG-CD 3.23Å; S75-K307 WeakPolarHBondContact OG-CE 3.14Å; S75-K307 PolarHBondContact OG-NZ 2.72Å; E76-K307 IonicContact OE1-NZ 2.65Å; E76-K307 PolarHBondContact OE1-NZ 3.15Å; F303-K307 WeakPolarHBondContact O-CB 3.16Å; F303-K307 PolarHBondContact O-N 2.94Å; A304-K307 PolarHBondContact O-N 3.07Å; Q305-K307 VanDerWaalsContact C-N 3.32Å; Q305-K307 PolarHBondContact O-N 2.71Å; K307-K310 PolarHBondContact O-N 2.8Å; K307-Q311 WeakPolarHBondContact O-CG 3.48Å; K307-Q311 PolarHBondContact O-N 3.1Å; K307-Q311 VanDerWaalsContact O-N 3.1Å
308	E	96.8	Very high	94	Very high	80 Å²	80	60.2 Å²	60.2	37%	0.374	32%	0.317	S	S	.	.	H	α-helix	trans	-65.2	-43.8	179.7	-176.9	169.2	-134.2	0	0	112.1	A304 Q305 Q311 M312 K323	A304-E308 WeakPolarHBondContact O-CB 3.43Å; A304-E308 PolarHBondContact O-N 3.24Å; Q305-E308 PolarHBondContact O-N 3Å; E308-Q311 PolarHBondContact O-N 3.16Å; E308-M312 WeakPolarHBondContact O-CB 3.26Å; E308-M312 PolarHBondContact O-N 3.46Å; E308-K323 HydrophobicContact CG-CD 4.35Å; E308-K323 WeakPolarHBondContact OE1-CE 3.43Å; E308-K323 IonicContact OE1-NZ 2.68Å; E308-K323 PolarHBondContact OE1-NZ 2.9Å; E308-K323 IonicContact OE2-NZ 3.9Å
309	V	96.9	Very high	93.6	Very high	3 Å²	3	60.7 Å²	60.7	2%	0.018	32%	0.32	C	S	.	.	H	α-helix	trans	-66.6	-39.2	178	174.4	0	0	0	0	111.3	Q305 Q311 M312 I313 F327 V398 L402	Q305-V309 WeakPolarHBondContact O-CB 3.05Å; Q305-V309 VanDerWaalsContact O-CG2 3.32Å; Q305-V309 WeakPolarHBondContact O-CG2 3.34Å; Q305-V309 PolarHBondContact O-N 3.41Å; V309-Q311 VanDerWaalsContact C-N 3.34Å; V309-Q311 PolarHBondContact O-N 3.34Å; V309-M312 HydrophobicContact CG2-CE 4.4Å; V309-M312 PolarHBondContact O-N 3.39Å; V309-I313 HydrophobicContact CG1-CD1 3.79Å; V309-I313 HydrophobicContact CG1-CG1 4.32Å; V309-I313 WeakPolarHBondContact O-CD1 3.49Å; V309-I313 WeakPolarHBondContact O-CG1 3.49Å; V309-I313 PolarHBondContact O-N 3.44Å; V309-F327 HydrophobicContact CB-CG 4.48Å; V309-F327 HydrophobicContact CG1-CD1 4.01Å; V309-F327 HydrophobicContact CG1-CE1 4.15Å; V309-F327 HydrophobicContact CG1-CG 4.43Å; V309-F327 HydrophobicContact CG2-CB 3.91Å; V309-F327 HydrophobicContact CG2-CD1 4.23Å; V309-F327 HydrophobicContact CG2-CD2 4.1Å; V309-F327 HydrophobicContact CG2-CG 3.82Å; V309-V398 HydrophobicContact CB-CG1 4.07Å; V309-V398 HydrophobicContact CG1-CG1 3.59Å; V309-L402 HydrophobicContact CG1-CB 4.24Å; V309-L402 HydrophobicContact CG1-CD1 4.28Å; V309-L402 HydrophobicContact CG1-CD2 4.07Å; V309-L402 HydrophobicContact CG1-CG 4.42Å
310	K	96.4	Very high	93.6	Very high	72 Å²	72	62.7 Å²	62.7	31%	0.313	33%	0.331	S	S	.	.	H	α-helix	trans	-57.4	-44.2	170.7	-80.7	-179.3	174.7	-173	0	112.4	V306 K307 T314 V398	V306-K310 WeakPolarHBondContact O-CB 3.21Å; V306-K310 WeakPolarHBondContact O-CG 3.33Å; V306-K310 PolarHBondContact O-N 3.41Å; K307-K310 PolarHBondContact O-N 2.8Å; K310-T314 PolarHBondContact O-N 2.96Å; K310-T314 PolarHBondContact O-OG1 2.89Å; K310-V398 HydrophobicContact CD-CG2 3.98Å; K310-V398 HydrophobicContact CG-CG1 4.14Å; K310-V398 HydrophobicContact CG-CG2 3.54Å
311	Q	96.3	Very high	93.5	Very high	118 Å²	118	62.7 Å²	62.7	55%	0.551	32%	0.323	S	S	*	.	H	α-helix	trans	-65	-40.8	177.7	-72.1	172.8	-16.8	0	0	111.6	K307 E308 V309 T314 S315	K307-Q311 WeakPolarHBondContact O-CG 3.48Å; K307-Q311 PolarHBondContact O-N 3.1Å; K307-Q311 VanDerWaalsContact O-N 3.1Å; E308-Q311 PolarHBondContact O-N 3.16Å; V309-Q311 VanDerWaalsContact C-N 3.34Å; V309-Q311 PolarHBondContact O-N 3.34Å; Q311-T314 WeakPolarHBondContact CA-OG1 3.24Å; Q311-T314 PolarHBondContact O-N 2.76Å; Q311-T314 PolarHBondContact O-OG1 3.21Å; Q311-T314 VanDerWaalsContact O-OG1 3.1Å; Q311-S315 PolarHBondContact O-N 3.1Å
312	M	94.7	Very high	93.6	Very high	23 Å²	23	63.4 Å²	63.4	11%	0.113	33%	0.327	C	S	.	.	H	α-helix	trans	-67.4	-40.7	178.4	-163.3	-164.4	-46.5	0	0	112.7	E308 V309 T314 S315 I319 D320 K323	E308-M312 WeakPolarHBondContact O-CB 3.26Å; E308-M312 PolarHBondContact O-N 3.46Å; V309-M312 HydrophobicContact CG2-CE 4.4Å; V309-M312 PolarHBondContact O-N 3.39Å; M312-T314 VanDerWaalsContact C-N 3.3Å; M312-T314 PolarHBondContact O-N 3.28Å; M312-S315 PolarHBondContact O-N 3.04Å; M312-S315 PolarHBondContact O-OG 3.07Å; M312-I319 HydrophobicContact CG-CD1 3.82Å; M312-I319 WeakPolarHBondContact O-CD1 3.45Å; M312-I319 HydrophobicContact SD-CB 4.42Å; M312-I319 HydrophobicContact SD-CD1 4.2Å; M312-I319 HydrophobicContact SD-CG2 3.77Å; M312-D320 HydrophobicContact CE-CB 4.22Å; M312-D320 HydrophobicContact SD-CB 3.97Å; M312-D320 PolarHBondContact SD-N 3.2Å; M312-D320 VanDerWaalsContact SD-N 3.43Å; M312-K323 HydrophobicContact CE-CB 3.58Å; M312-K323 HydrophobicContact CE-CD 3.76Å; M312-K323 HydrophobicContact CE-CG 4.33Å
313	I	92.8	Very high	93.6	Very high	23 Å²	23	66.8 Å²	66.8	12%	0.118	34%	0.342	C	S	.	.	H	α-helix	trans	-60.8	-40.7	174.3	-68.3	158.1	0	0	0	111.2	V309 V398 E401 L402 K405	V309-I313 HydrophobicContact CG1-CD1 3.79Å; V309-I313 HydrophobicContact CG1-CG1 4.32Å; V309-I313 WeakPolarHBondContact O-CD1 3.49Å; V309-I313 WeakPolarHBondContact O-CG1 3.49Å; V309-I313 PolarHBondContact O-N 3.44Å; I313-V398 HydrophobicContact CD1-CG1 3.99Å; I313-E401 HydrophobicContact CD1-CB 3.83Å; I313-E401 HydrophobicContact CG2-CB 4.32Å; I313-L402 HydrophobicContact CD1-CB 3.99Å; I313-L402 HydrophobicContact CG1-CB 4.34Å; I313-L402 HydrophobicContact CG1-CD1 4.31Å; I313-K405 HydrophobicContact CG2-CB 4.35Å; I313-K405 PolarHBondContact O-NZ 3.2Å
314	T	92.7	Very high	93.5	Very high	117 Å²	117	65 Å²	65	72%	0.718	33%	0.334	S	S	*	.	H	α-helix	trans	-82.8	-14.2	-176.3	48.5	0	0	0	0	114.3	K310 Q311 M312	K310-T314 PolarHBondContact O-N 2.96Å; K310-T314 PolarHBondContact O-OG1 2.89Å; Q311-T314 WeakPolarHBondContact CA-OG1 3.24Å; Q311-T314 PolarHBondContact O-N 2.76Å; Q311-T314 PolarHBondContact O-OG1 3.21Å; Q311-T314 VanDerWaalsContact O-OG1 3.1Å; M312-T314 VanDerWaalsContact C-N 3.3Å; M312-T314 PolarHBondContact O-N 3.28Å
315	S	91	Very high	93.6	Very high	29 Å²	29	62 Å²	62	20%	0.203	31%	0.308	C	S	.	.	S	Bend	trans	-72.6	159.9	171.5	74.2	0	0	0	0	113.2	Q311 M312 D317 K405	Q311-S315 PolarHBondContact O-N 3.1Å; M312-S315 PolarHBondContact O-N 3.04Å; M312-S315 PolarHBondContact O-OG 3.07Å; S315-D317 VanDerWaalsContact C-N 3.32Å; S315-K405 PolarHBondContact O-NZ 2.66Å
316	E	86.2	Confident	93.6	Very high	199 Å²	199	61.4 Å²	61.4	93%	0.93	31%	0.306	S	S	*	.	S	Bend	trans	-87.4	-2.7	170	-63.8	-174.5	171.7	0	0	112.6
317	D	86.5	Confident	93.6	Very high	122 Å²	122	60.8 Å²	60.8	65%	0.652	30%	0.302	S	S	*	.	S	Bend	trans	-73.5	163.8	-178.7	-60.9	-66.8	0	0	0	113.1	S315	S315-D317 VanDerWaalsContact C-N 3.32Å
318	E	85.9	Confident	93.6	Very high	159 Å²	159	57.6 Å²	57.6	74%	0.743	29%	0.289	S	S	*	.	P	Polyproline II helix	trans	-66.2	135.1	172.2	-171.6	178.8	171.3	0	0	110.7	D320	E318-D320 PolarHBondContact O-N 3.41Å
319	I	89.1	Confident	93.7	Very high	10 Å²	10	53.8 Å²	53.8	5%	0.051	27%	0.271	C	S	.	.	P	Polyproline II helix	trans	-64.5	121.2	179.1	-62	-57.2	0	0	0	110.6	M312 K321 A324 L402 K405 L406	M312-I319 HydrophobicContact CG-CD1 3.82Å; M312-I319 WeakPolarHBondContact O-CD1 3.45Å; M312-I319 HydrophobicContact SD-CB 4.42Å; M312-I319 HydrophobicContact SD-CD1 4.2Å; M312-I319 HydrophobicContact SD-CG2 3.77Å; I319-K321 PolarHBondContact O-N 3.15Å; I319-A324 HydrophobicContact CG2-CB 3.94Å; I319-L402 HydrophobicContact CG2-CD1 4.15Å; I319-K405 HydrophobicContact CD1-CG 3.82Å; I319-K405 HydrophobicContact CG1-CG 4Å; I319-L406 HydrophobicContact CB-CD2 4.08Å; I319-L406 HydrophobicContact CG1-CD2 4.35Å; I319-L406 HydrophobicContact CG2-CD2 3.71Å; I319-L406 HydrophobicContact CG2-CG 4.49Å
320	D	93	Very high	93.8	Very high	58 Å²	58	53.7 Å²	53.7	31%	0.31	27%	0.27	S	S	.	.			trans	-62.2	104.5	173.3	-177	-22.7	0	0	0	109.8	M312 E318 T322 K323 A324	M312-D320 HydrophobicContact CE-CB 4.22Å; M312-D320 HydrophobicContact SD-CB 3.97Å; M312-D320 PolarHBondContact SD-N 3.2Å; M312-D320 VanDerWaalsContact SD-N 3.43Å; E318-D320 PolarHBondContact O-N 3.41Å; D320-T322 PolarHBondContact O-N 3.16Å; D320-T322 WeakPolarHBondContact OD1-CA 3.18Å; D320-T322 VanDerWaalsContact OD1-CB 3.22Å; D320-T322 WeakPolarHBondContact OD1-CB 3.34Å; D320-T322 PolarHBondContact OD1-N 3.31Å; D320-T322 PolarHBondContact OD1-OG1 3.44Å; D320-K323 HydrophobicContact CB-CB 4.2Å; D320-K323 HydrophobicContact CB-CD 4.03Å; D320-K323 HydrophobicContact CB-CG 4.26Å; D320-K323 PolarHBondContact O-N 3.33Å; D320-K323 PolarHBondContact OD1-N 3.2Å; D320-K323 WeakPolarHBondContact OD2-CD 3.26Å; D320-K323 WeakPolarHBondContact OD2-CE 3.25Å; D320-K323 WeakPolarHBondContact OD2-CG 3.42Å; D320-K323 IonicContact OD2-NZ 3.76Å; D320-A324 WeakPolarHBondContact O-CB 3.22Å; D320-A324 PolarHBondContact O-N 3.17Å
321	K	92.1	Very high	93.8	Very high	64 Å²	64	50.3 Å²	50.3	28%	0.278	26%	0.255	S	S	.	.	H	α-helix	trans	-57.6	-34.9	-179.4	-59.7	-177.6	-173.2	-175.1	0	112.2	C209 L210 E214 I319 L325	C209-K321 PolarHBondContact O-NZ 3.04Å; L210-K321 HydrophobicContact CD2-CD 4.27Å; E214-K321 VanDerWaalsContact OE1-CD 3.29Å; E214-K321 WeakPolarHBondContact OE1-CD 3.32Å; I319-K321 PolarHBondContact O-N 3.15Å; K321-L325 VanDerWaalsContact O-CB 3.29Å; K321-L325 WeakPolarHBondContact O-CB 3.36Å; K321-L325 WeakPolarHBondContact O-CD1 3.26Å; K321-L325 WeakPolarHBondContact O-CG 3.25Å; K321-L325 PolarHBondContact O-N 3.07Å
322	T	95.4	Very high	93.9	Very high	55 Å²	55	44.7 Å²	44.7	34%	0.337	23%	0.229	S	C	.	.	H	α-helix	trans	-64.3	-49.3	-179.1	-50.9	0	0	0	0	110.1	L289 E292 D320 L325 S326	L289-T322 HydrophobicContact CD1-CG2 3.83Å; E292-T322 HydrophobicContact CB-CG2 4.18Å; E292-T322 HydrophobicContact CG-CG2 3.81Å; D320-T322 PolarHBondContact O-N 3.16Å; D320-T322 WeakPolarHBondContact OD1-CA 3.18Å; D320-T322 VanDerWaalsContact OD1-CB 3.22Å; D320-T322 WeakPolarHBondContact OD1-CB 3.34Å; D320-T322 PolarHBondContact OD1-N 3.31Å; D320-T322 PolarHBondContact OD1-OG1 3.44Å; T322-L325 PolarHBondContact O-N 3.32Å; T322-S326 WeakPolarHBondContact O-CB 3.42Å; T322-S326 PolarHBondContact O-N 3.12Å; T322-S326 PolarHBondContact O-OG 3.42Å
323	K	95.9	Very high	94.1	Very high	74 Å²	74	44.2 Å²	44.2	32%	0.322	23%	0.227	S	C	.	.	H	α-helix	trans	-69.7	-39.6	179.7	-65.7	175.9	-174.7	-179.8	0	112	E308 M312 D320 S326 F327	E308-K323 HydrophobicContact CG-CD 4.35Å; E308-K323 WeakPolarHBondContact OE1-CE 3.43Å; E308-K323 IonicContact OE1-NZ 2.68Å; E308-K323 PolarHBondContact OE1-NZ 2.9Å; E308-K323 IonicContact OE2-NZ 3.9Å; M312-K323 HydrophobicContact CE-CB 3.58Å; M312-K323 HydrophobicContact CE-CD 3.76Å; M312-K323 HydrophobicContact CE-CG 4.33Å; D320-K323 HydrophobicContact CB-CB 4.2Å; D320-K323 HydrophobicContact CB-CD 4.03Å; D320-K323 HydrophobicContact CB-CG 4.26Å; D320-K323 PolarHBondContact O-N 3.33Å; D320-K323 PolarHBondContact OD1-N 3.2Å; D320-K323 WeakPolarHBondContact OD2-CD 3.26Å; D320-K323 WeakPolarHBondContact OD2-CE 3.25Å; D320-K323 WeakPolarHBondContact OD2-CG 3.42Å; D320-K323 IonicContact OD2-NZ 3.76Å; K323-S326 PolarHBondContact O-N 3.3Å; K323-F327 WeakPolarHBondContact O-CB 3.32Å; K323-F327 PolarHBondContact O-N 3.27Å
324	A	94.8	Very high	94.4	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-61.1	-44.3	173.9	0	0	0	0	0	111.9	I319 D320 L328 L402	I319-A324 HydrophobicContact CG2-CB 3.94Å; D320-A324 WeakPolarHBondContact O-CB 3.22Å; D320-A324 PolarHBondContact O-N 3.17Å; A324-L328 WeakPolarHBondContact O-CB 3.45Å; A324-L328 VanDerWaalsContact O-CG 3.26Å; A324-L328 WeakPolarHBondContact O-CG 3.22Å; A324-L328 PolarHBondContact O-N 3.13Å; A324-L402 HydrophobicContact CB-CD1 4.29Å; A324-L402 HydrophobicContact CB-CD2 4.2Å
325	L	96.5	Very high	94.6	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.005	19%	0.191	C	C	.	.	H	α-helix	trans	-67	-41.1	176.9	-69.6	172	0	0	0	112.2	L206 L210 E214 Y218 L289 I293 K321 T322 L328 I329	L206-L325 HydrophobicContact CD1-CD2 4.26Å; L210-L325 HydrophobicContact CD1-CD1 4.39Å; L210-L325 HydrophobicContact CD1-CD2 3.79Å; L210-L325 HydrophobicContact CD2-CD1 3.92Å; L210-L325 HydrophobicContact CD2-CD2 4.25Å; L210-L325 HydrophobicContact CD2-CG 4.41Å; E214-L325 HydrophobicContact CB-CD1 4.4Å; Y218-L325 HydrophobicContact CD2-CB 3.91Å; Y218-L325 HydrophobicContact CD2-CD2 3.44Å; Y218-L325 VanDerWaalsContact CD2-CD2 3.44Å; Y218-L325 HydrophobicContact CD2-CG 4.2Å; Y218-L325 HydrophobicContact CE2-CB 4.43Å; Y218-L325 HydrophobicContact CE2-CD2 3.86Å; Y218-L325 HydrophobicContact CG-CD2 3.78Å; L289-L325 HydrophobicContact CD1-CD1 4.4Å; L289-L325 HydrophobicContact CD2-CD1 4.28Å; I293-L325 HydrophobicContact CD1-CB 3.94Å; I293-L325 HydrophobicContact CG1-CB 4.46Å; K321-L325 VanDerWaalsContact O-CB 3.29Å; K321-L325 WeakPolarHBondContact O-CB 3.36Å; K321-L325 WeakPolarHBondContact O-CD1 3.26Å; K321-L325 WeakPolarHBondContact O-CG 3.25Å; K321-L325 PolarHBondContact O-N 3.07Å; T322-L325 PolarHBondContact O-N 3.32Å; L325-L328 PolarHBondContact O-N 2.72Å; L325-I329 PolarHBondContact O-N 2.85Å
326	S	98.2	Very high	95	Very high	3 Å²	3	36.9 Å²	36.9	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-58.8	-49.9	174.8	-59.6	0	0	0	0	111.3	I293 T322 K323 L328 I329 H330	I293-S326 WeakPolarHBondContact CG1-OG 3.43Å; T322-S326 WeakPolarHBondContact O-CB 3.42Å; T322-S326 PolarHBondContact O-N 3.12Å; T322-S326 PolarHBondContact O-OG 3.42Å; K323-S326 PolarHBondContact O-N 3.3Å; S326-L328 VanDerWaalsContact C-N 3.34Å; S326-L328 PolarHBondContact O-N 3.48Å; S326-I329 PolarHBondContact O-N 3.38Å; S326-I329 VanDerWaalsContact O-N 3.17Å; S326-H330 PolarHBondContact O-N 3.36Å
327	F	97.8	Very high	95.5	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-64.5	-35	178	-172.5	-109.2	0	0	0	113	Q305 V306 V309 K323 H330 C331 M395 V398 C399 L402	Q305-F327 HydrophobicContact CB-CD2 4.19Å; V306-F327 HydrophobicContact CG2-CE2 3.84Å; V306-F327 HydrophobicContact CG2-CZ 4.37Å; V309-F327 HydrophobicContact CB-CG 4.48Å; V309-F327 HydrophobicContact CG1-CD1 4.01Å; V309-F327 HydrophobicContact CG1-CE1 4.15Å; V309-F327 HydrophobicContact CG1-CG 4.43Å; V309-F327 HydrophobicContact CG2-CB 3.91Å; V309-F327 HydrophobicContact CG2-CD1 4.23Å; V309-F327 HydrophobicContact CG2-CD2 4.1Å; V309-F327 HydrophobicContact CG2-CG 3.82Å; K323-F327 WeakPolarHBondContact O-CB 3.32Å; K323-F327 PolarHBondContact O-N 3.27Å; F327-H330 PolarHBondContact O-N 3.06Å; F327-C331 VanDerWaalsContact CE1-SG 3.51Å; F327-C331 WeakPolarHBondContact O-CB 3.41Å; F327-C331 PolarHBondContact O-N 2.98Å; F327-C331 PolarHBondContact O-SG 3.02Å; F327-M395 HydrophobicContact CE2-CG 4.02Å; F327-M395 HydrophobicContact CZ-CG 3.8Å; F327-V398 HydrophobicContact CE1-CB 4.3Å; F327-V398 HydrophobicContact CE1-CG1 3.87Å; F327-V398 HydrophobicContact CZ-CB 4.03Å; F327-V398 HydrophobicContact CZ-CG1 3.8Å; F327-C399 HydrophobicContact CE1-CB 4.31Å; F327-L402 HydrophobicContact CD1-CD2 3.78Å
328	L	97	Very high	96.1	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.106	C	C	.	.	H	α-helix	trans	-70.7	-29.1	175	-69.8	178.3	0	0	0	113.2	L200 L206 Y218 A324 L325 S326 S332 L402 L403	L200-L328 HydrophobicContact CB-CD2 4.23Å; L200-L328 HydrophobicContact CD1-CB 4.47Å; L200-L328 HydrophobicContact CD1-CD2 4.1Å; L200-L328 WeakPolarHBondContact CD1-O 3.13Å; L206-L328 HydrophobicContact CD1-CD1 3.6Å; Y218-L328 HydrophobicContact CE2-CB 4.02Å; A324-L328 WeakPolarHBondContact O-CB 3.45Å; A324-L328 VanDerWaalsContact O-CG 3.26Å; A324-L328 WeakPolarHBondContact O-CG 3.22Å; A324-L328 PolarHBondContact O-N 3.13Å; L325-L328 PolarHBondContact O-N 2.72Å; S326-L328 VanDerWaalsContact C-N 3.34Å; S326-L328 PolarHBondContact O-N 3.48Å; L328-S332 WeakPolarHBondContact O-CB 3.33Å; L328-S332 PolarHBondContact O-N 2.77Å; L328-S332 VanDerWaalsContact O-N 3.17Å; L328-S332 PolarHBondContact O-OG 3.16Å; L328-L402 HydrophobicContact CD2-CD2 4.35Å; L328-L402 HydrophobicContact CG-CD2 4.34Å; L328-L403 HydrophobicContact CD2-CD2 4.05Å
329	I	98.5	Very high	96.7	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-71	-45.2	168	-64.6	-47.9	0	0	0	110.8	A197 Y218 A222 I293 T297 L325 S326 C331 S332 D333	A197-I329 HydrophobicContact CB-CD1 3.41Å; A197-I329 VanDerWaalsContact CB-CD1 3.41Å; Y218-I329 HydrophobicContact CD2-CD1 3.67Å; Y218-I329 HydrophobicContact CD2-CG1 3.82Å; Y218-I329 HydrophobicContact CE1-CD1 4.43Å; Y218-I329 HydrophobicContact CE2-CD1 3.29Å; Y218-I329 HydrophobicContact CE2-CG1 3.66Å; Y218-I329 HydrophobicContact CG-CD1 4.42Å; A222-I329 HydrophobicContact CB-CD1 3.7Å; I293-I329 HydrophobicContact CG2-CB 3.79Å; I293-I329 HydrophobicContact CG2-CG1 3.46Å; I293-I329 VanDerWaalsContact CG2-CG1 3.46Å; I293-I329 HydrophobicContact CG2-CG2 4.07Å; T297-I329 HydrophobicContact CG2-CG2 3.93Å; L325-I329 PolarHBondContact O-N 2.85Å; S326-I329 PolarHBondContact O-N 3.38Å; S326-I329 VanDerWaalsContact O-N 3.17Å; I329-C331 VanDerWaalsContact C-N 3.31Å; I329-C331 PolarHBondContact O-N 2.96Å; I329-S332 WeakPolarHBondContact O-CA 3.39Å; I329-S332 VanDerWaalsContact O-CB 3.29Å; I329-S332 WeakPolarHBondContact O-CB 3.33Å; I329-S332 PolarHBondContact O-N 3.24Å; I329-D333 PolarHBondContact O-N 3.01Å
330	H	98.3	Very high	97.1	Very high	1 Å²	1	18.7 Å²	18.7	1%	0.005	9%	0.09	C	C	.	.	H	α-helix	trans	-57.2	-43.4	175.4	-166.5	88.5	0	0	0	112.1	C296 T297 M299 H302 Q305 S326 F327 S332 D333 I334	C296-H330 PolarHBondContact O-CE1 2.89Å; C296-H330 PolarHBondContact O-ND1 3.17Å; T297-H330 WeakPolarHBondContact CA-CE1 3.49Å; T297-H330 PolarHBondContact O-CE1 3.46Å; T297-H330 PolarHBondContact O-NE2 2.82Å; M299-H330 WeakPolarHBondContact CA-NE2 3.45Å; M299-H330 PolarHBondContact SD-NE2 2.91Å; H302-H330 AromaticContact ND1-CD2 3.63Å; Q305-H330 PolarHBondContact NE2-CE1 3.18Å; S326-H330 PolarHBondContact O-N 3.36Å; F327-H330 PolarHBondContact O-N 3.06Å; H330-S332 VanDerWaalsContact C-N 3.25Å; H330-S332 PolarHBondContact O-N 2.61Å; H330-D333 PolarHBondContact O-N 3.2Å; H330-I334 PolarHBondContact O-N 3.1Å
331	C	98.2	Very high	97.3	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64	-25.7	172.3	-73.6	0	0	0	0	114	L200 F327 I329 S335 M395	L200-C331 HydrophobicContact CD1-CB 4.07Å; F327-C331 VanDerWaalsContact CE1-SG 3.51Å; F327-C331 WeakPolarHBondContact O-CB 3.41Å; F327-C331 PolarHBondContact O-N 2.98Å; F327-C331 PolarHBondContact O-SG 3.02Å; I329-C331 VanDerWaalsContact C-N 3.31Å; I329-C331 PolarHBondContact O-N 2.96Å; C331-S335 VanDerWaalsContact O-CB 3.29Å; C331-S335 WeakPolarHBondContact O-CB 3.33Å; C331-M395 HydrophobicContact CB-CE 4.14Å; C331-M395 HydrophobicContact CB-SD 4.39Å
332	S	98.4	Very high	97.6	Very high	0 Å²	0	19.3 Å²	19.3	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-81.7	-37.3	179.5	-64.8	0	0	0	0	112.7	A197 L200 L328 I329 H330 S335	A197-S332 WeakPolarHBondContact CA-OG 3.41Å; A197-S332 PolarHBondContact N-OG 3.08Å; A197-S332 VanDerWaalsContact N-OG 3.14Å; L200-S332 WeakPolarHBondContact CD1-OG 3.27Å; L328-S332 WeakPolarHBondContact O-CB 3.33Å; L328-S332 PolarHBondContact O-N 2.77Å; L328-S332 VanDerWaalsContact O-N 3.17Å; L328-S332 PolarHBondContact O-OG 3.16Å; I329-S332 WeakPolarHBondContact O-CA 3.39Å; I329-S332 VanDerWaalsContact O-CB 3.29Å; I329-S332 WeakPolarHBondContact O-CB 3.33Å; I329-S332 PolarHBondContact O-N 3.24Å; H330-S332 VanDerWaalsContact C-N 3.25Å; H330-S332 PolarHBondContact O-N 2.61Å; S332-S335 WeakPolarHBondContact O-CB 3.25Å; S332-S335 PolarHBondContact O-OG 3.06Å
333	D	98.7	Very high	97.7	Very high	14 Å²	14	18.1 Å²	18.1	8%	0.075	9%	0.088	C	C	.	.	H	α-helix	trans	-59.1	-70.6	176.6	-179.7	-6.4	0	0	0	110.5	H189 V193 I329 H330 S335	H189-D333 PolarHBondContact NE2-O 3.04Å; H189-D333 IonicContact NE2-OD1 2.67Å; H189-D333 PolarHBondContact NE2-OD1 3.09Å; V193-D333 HydrophobicContact CG1-CB 4.48Å; I329-D333 PolarHBondContact O-N 3.01Å; H330-D333 PolarHBondContact O-N 3.2Å; D333-S335 PolarHBondContact O-N 3Å
334	I	98	Very high	97.8	Very high	12 Å²	12	14.6 Å²	14.6	6%	0.062	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	24.1	179.8	64.1	168.4	0	0	0	113.8	M299 H330 H336 P337 F387 I391 V392 M395	M299-I334 HydrophobicContact CE-CD1 4.31Å; M299-I334 HydrophobicContact SD-CD1 4.08Å; M299-I334 HydrophobicContact SD-CG2 4.02Å; H330-I334 PolarHBondContact O-N 3.1Å; I334-H336 VanDerWaalsContact C-N 3.29Å; I334-H336 PolarHBondContact O-N 2.9Å; I334-P337 WeakPolarHBondContact O-CD 3.29Å; I334-F387 HydrophobicContact CB-CZ 4.01Å; I334-F387 HydrophobicContact CD1-CZ 4.19Å; I334-F387 HydrophobicContact CG2-CZ 4.14Å; I334-I391 HydrophobicContact CD1-CG2 3.7Å; I334-V392 HydrophobicContact CD1-CG2 4.49Å; I334-M395 HydrophobicContact CD1-CE 4.19Å; I334-M395 HydrophobicContact CD1-SD 3.69Å; I334-M395 HydrophobicContact CG1-CE 3.9Å; I334-M395 HydrophobicContact CG1-SD 3.81Å
335	S	98	Very high	97.9	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.007	9%	0.085	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-16.3	-177.6	66	0	0	0	0	115	C331 S332 D333 P337 A338 K339	C331-S335 VanDerWaalsContact O-CB 3.29Å; C331-S335 WeakPolarHBondContact O-CB 3.33Å; S332-S335 WeakPolarHBondContact O-CB 3.25Å; S332-S335 PolarHBondContact O-OG 3.06Å; D333-S335 PolarHBondContact O-N 3Å; S335-P337 VanDerWaalsContact C-CD 3.42Å; S335-A338 WeakPolarHBondContact O-CA 3.39Å; S335-A338 WeakPolarHBondContact O-CB 3.33Å; S335-A338 PolarHBondContact O-N 2.7Å; S335-K339 VanDerWaalsContact OG-CE 3.26Å; S335-K339 WeakPolarHBondContact OG-CE 3.34Å; S335-K339 PolarHBondContact OG-NZ 2.8Å
336	H	98	Very high	98	Very high	2 Å²	2	22.3 Å²	22.3	1%	0.009	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-59.4	-32.3	-168	77.7	106.8	0	0	0	115.9	I334 A338 K339 H344 W347 T348	I334-H336 VanDerWaalsContact C-N 3.29Å; I334-H336 PolarHBondContact O-N 2.9Å; H336-A338 PolarHBondContact O-N 2.91Å; H336-K339 PolarHBondContact O-N 2.76Å; H336-K339 VanDerWaalsContact O-N 3.16Å; H336-H344 AromaticContact CE1-ND1 3.71Å; H336-H344 AromaticContact ND1-CE1 3.93Å; H336-H344 AromaticContact ND1-ND1 3.19Å; H336-H344 PolarHBondContact ND1-ND1 3.48Å; H336-H344 VanDerWaalsContact ND1-ND1 3.19Å; H336-H344 PolarHBondContact ND1-O 3.04Å; H336-H344 VanDerWaalsContact O-CB 3.23Å; H336-H344 WeakPolarHBondContact O-CB 3.41Å; H336-W347 HydrophobicContact CB-CB 3.76Å; H336-W347 HydrophobicContact CB-CG 3.87Å; H336-W347 VanDerWaalsContact ND1-CB 3.32Å; H336-W347 WeakPolarHBondContact ND1-CB 3.29Å; H336-T348 PolarHBondContact CE1-OG1 2.98Å
337	P	98.2	Very high	98	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-72.1	-15.1	174.8	-15.1	33	0	0	0	113.7	I334 S335 H344 F387 I388 V392 N445	I334-P337 WeakPolarHBondContact O-CD 3.29Å; S335-P337 VanDerWaalsContact C-CD 3.42Å; P337-H344 WeakPolarHBondContact CA-ND1 3.49Å; P337-F387 HydrophobicContact CG-CD1 3.96Å; P337-F387 HydrophobicContact CG-CE1 3.92Å; P337-I388 HydrophobicContact CB-CD1 4.14Å; P337-I388 HydrophobicContact CB-CG1 3.69Å; P337-V392 HydrophobicContact CB-CG1 4.24Å; P337-V392 HydrophobicContact CB-CG2 4.47Å; P337-V392 HydrophobicContact CG-CG1 4.38Å; P337-V392 HydrophobicContact CG-CG2 3.93Å; P337-N445 PolarHBondContact O-ND2 3.25Å
338	A	98	Very high	98.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	10%	0.103	C	C	.	.	G	3₁₀ helix	trans	-89.6	-1	172.3	0	0	0	0	0	113.7	W126 S335 H336 M396 W438 I441 I442	W126-A338 HydrophobicContact CZ2-CB 3.86Å; W126-A338 PolarHBondContact NE1-O 2.86Å; S335-A338 WeakPolarHBondContact O-CA 3.39Å; S335-A338 WeakPolarHBondContact O-CB 3.33Å; S335-A338 PolarHBondContact O-N 2.7Å; H336-A338 PolarHBondContact O-N 2.91Å; A338-M396 HydrophobicContact CB-CG 4.31Å; A338-W438 HydrophobicContact CB-CB 3.83Å; A338-I441 WeakPolarHBondContact O-CG2 3.35Å; A338-I442 HydrophobicContact CB-CD1 4.19Å; A338-I442 HydrophobicContact CB-CG1 4.14Å
339	K	97.9	Very high	98.1	Very high	2 Å²	2	25 Å²	25	1%	0.009	12%	0.118	C	C	.	.	S	Bend	trans	-102	157	176.4	-66	178.7	-178.1	172.5	0	111.9	D192 T196 S335 H336 W341 F343 I441 N445	D192-K339 IonicContact OD1-NZ 2.66Å; D192-K339 PolarHBondContact OD1-NZ 2.77Å; D192-K339 IonicContact OD2-NZ 3.9Å; D192-K339 PolarHBondContact OD2-NZ 2.74Å; T196-K339 WeakPolarHBondContact OG1-CE 3.24Å; T196-K339 PolarHBondContact OG1-NZ 2.63Å; S335-K339 VanDerWaalsContact OG-CE 3.26Å; S335-K339 WeakPolarHBondContact OG-CE 3.34Å; S335-K339 PolarHBondContact OG-NZ 2.8Å; H336-K339 PolarHBondContact O-N 2.76Å; H336-K339 VanDerWaalsContact O-N 3.16Å; K339-W341 PolarHBondContact O-N 3.06Å; K339-F343 HydrophobicContact CB-CB 4.48Å; K339-I441 VanDerWaalsContact C-CG2 3.42Å; K339-I441 VanDerWaalsContact O-CG2 3.23Å; K339-I441 WeakPolarHBondContact O-CG2 3.24Å; K339-N445 PolarHBondContact O-ND2 2.71Å
340	K	97.4	Very high	98.1	Very high	105 Å²	105	27 Å²	27	46%	0.457	13%	0.127	S	C	.	.			trans	-46.7	138.4	-179.9	-90	-178.8	-179.2	86.4	0	112.9	D127 P342 F343 H344	D127-K340 HydrophobicContact CB-CD 4.1Å; D127-K340 HydrophobicContact CB-CG 4.38Å; D127-K340 VanDerWaalsContact CG-NZ 3.29Å; D127-K340 WeakPolarHBondContact OD1-CB 3.48Å; D127-K340 VanDerWaalsContact OD1-CG 3.3Å; D127-K340 WeakPolarHBondContact OD1-CG 3.23Å; D127-K340 PolarHBondContact OD1-N 3.32Å; D127-K340 IonicContact OD2-NZ 3.23Å; D127-K340 PolarHBondContact OD2-NZ 2.98Å; K340-P342 VanDerWaalsContact C-CD 3.4Å; K340-P342 WeakPolarHBondContact O-CD 3.45Å; K340-F343 HydrophobicContact CB-CD2 4.15Å; K340-F343 HydrophobicContact CB-CE2 4.38Å; K340-F343 WeakPolarHBondContact O-CB 3.46Å; K340-F343 PolarHBondContact O-N 2.77Å; K340-H344 PolarHBondContact O-N 2.93Å
341	W	97.9	Very high	98.1	Very high	50 Å²	50	27.7 Å²	27.7	19%	0.189	13%	0.13	C	C	.	.	H	α-helix	trans	-38.4	-47.6	-175.6	178.4	-106	0	0	0	116.9	K339 F343 H344 F345 N445 K448 W449	K339-W341 PolarHBondContact O-N 3.06Å; W341-F343 PolarHBondContact O-N 3.01Å; W341-H344 AromaticContact CE3-CD2 3.98Å; W341-H344 AromaticContact CZ3-CD2 3.99Å; W341-H344 PolarHBondContact O-N 2.82Å; W341-F345 HydrophobicContact CD2-CB 4.29Å; W341-F345 AromaticContact CH2-CD2 3.83Å; W341-F345 HydrophobicContact CH2-CD2 3.83Å; W341-F345 HydrophobicContact CZ2-CB 4.14Å; W341-F345 AromaticContact CZ2-CD2 3.48Å; W341-F345 HydrophobicContact CZ2-CD2 3.48Å; W341-F345 VanDerWaalsContact CZ2-CD2 3.48Å; W341-F345 HydrophobicContact CZ2-CE2 4.1Å; W341-F345 AromaticContact CZ2-CG 3.97Å; W341-F345 HydrophobicContact CZ2-CG 3.97Å; W341-F345 WeakPolarHBondContact O-CB 3.32Å; W341-F345 PolarHBondContact O-N 3.49Å; W341-N445 WeakPolarHBondContact CA-OD1 3.49Å; W341-N445 HydrophobicContact CE3-CB 4.33Å; W341-N445 PolarHBondContact N-OD1 3.45Å; W341-K448 HydrophobicContact CB-CD 3.8Å; W341-K448 HydrophobicContact CD2-CB 3.92Å; W341-K448 HydrophobicContact CD2-CD 3.56Å; W341-K448 HydrophobicContact CD2-CG 4.35Å; W341-K448 HydrophobicContact CE3-CB 3.68Å; W341-K448 HydrophobicContact CE3-CD 3.88Å; W341-K448 HydrophobicContact CE3-CG 4.43Å; W341-K448 HydrophobicContact CG-CD 3.51Å; W341-K448 HydrophobicContact CH2-CB 3.83Å; W341-K448 HydrophobicContact CZ2-CB 4.06Å; W341-K448 HydrophobicContact CZ3-CB 3.63Å; W341-W449 AromaticContact CH2-CD2 3.67Å; W341-W449 HydrophobicContact CH2-CD2 3.67Å; W341-W449 AromaticContact CH2-CE2 3.65Å; W341-W449 AromaticContact CH2-CE3 3.88Å; W341-W449 HydrophobicContact CH2-CE3 3.88Å; W341-W449 HydrophobicContact CH2-CG 4.21Å; W341-W449 HydrophobicContact CH2-CH2 4.09Å; W341-W449 AromaticContact CH2-CZ2 3.86Å; W341-W449 HydrophobicContact CH2-CZ2 3.86Å; W341-W449 HydrophobicContact CH2-CZ3 4.09Å; W341-W449 AromaticContact CZ3-CD1 3.95Å; W341-W449 AromaticContact CZ3-CD2 3.93Å; W341-W449 HydrophobicContact CZ3-CD2 3.93Å; W341-W449 AromaticContact CZ3-CE2 3.62Å; W341-W449 HydrophobicContact CZ3-CG 4.13Å; W341-W449 HydrophobicContact CZ3-CZ2 4.05Å; W341-W449 AromaticContact CZ3-NE1 3.64Å
342	P	97.5	Very high	98	Very high	86 Å²	86	27.8 Å²	27.8	56%	0.558	13%	0.131	S	C	*	.	H	α-helix	trans	-60.6	-33.6	-179.6	-23.1	35.6	0	0	0	113.3	K340 R346	K340-P342 VanDerWaalsContact C-CD 3.4Å; K340-P342 WeakPolarHBondContact O-CD 3.45Å; P342-R346 VanDerWaalsContact O-CB 3.24Å; P342-R346 WeakPolarHBondContact O-CB 3.33Å; P342-R346 PolarHBondContact O-N 3.48Å; P342-R346 VanDerWaalsContact O-N 3.16Å
343	F	98	Very high	98	Very high	30 Å²	30	30.8 Å²	30.8	13%	0.132	15%	0.145	C	C	.	.	H	α-helix	trans	-78.5	-46.9	176.7	-49.6	-37.2	0	0	0	110.8	D127 D129 F131 K339 K340 W341 F345 R346 W347	D127-F343 HydrophobicContact CB-CE2 4.16Å; D129-F343 HydrophobicContact CB-CE1 3.96Å; D129-F343 HydrophobicContact CB-CZ 3.73Å; D129-F343 VanDerWaalsContact CG-CE1 3.46Å; F131-F343 HydrophobicContact CD2-CD1 4.11Å; F131-F343 HydrophobicContact CE2-CB 4.41Å; F131-F343 HydrophobicContact CE2-CD1 4.37Å; K339-F343 HydrophobicContact CB-CB 4.48Å; K340-F343 HydrophobicContact CB-CD2 4.15Å; K340-F343 HydrophobicContact CB-CE2 4.38Å; K340-F343 WeakPolarHBondContact O-CB 3.46Å; K340-F343 PolarHBondContact O-N 2.77Å; W341-F343 PolarHBondContact O-N 3.01Å; F343-F345 PolarHBondContact O-N 3.3Å; F343-R346 PolarHBondContact O-N 3.16Å; F343-W347 WeakPolarHBondContact O-CB 3.17Å; F343-W347 PolarHBondContact O-N 3.32Å
344	H	98.3	Very high	98	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-54.1	-52.2	175.8	176.2	32.3	0	0	0	111.5	H336 P337 K340 W341 W347 T348 N445 W449	H336-H344 AromaticContact CE1-ND1 3.71Å; H336-H344 AromaticContact ND1-CE1 3.93Å; H336-H344 AromaticContact ND1-ND1 3.19Å; H336-H344 PolarHBondContact ND1-ND1 3.48Å; H336-H344 VanDerWaalsContact ND1-ND1 3.19Å; H336-H344 PolarHBondContact ND1-O 3.04Å; H336-H344 VanDerWaalsContact O-CB 3.23Å; H336-H344 WeakPolarHBondContact O-CB 3.41Å; P337-H344 WeakPolarHBondContact CA-ND1 3.49Å; K340-H344 PolarHBondContact O-N 2.93Å; W341-H344 AromaticContact CE3-CD2 3.98Å; W341-H344 AromaticContact CZ3-CD2 3.99Å; W341-H344 PolarHBondContact O-N 2.82Å; H344-W347 PolarHBondContact O-N 2.82Å; H344-T348 PolarHBondContact CE1-OG1 3.07Å; H344-T348 PolarHBondContact O-N 2.85Å; H344-T348 PolarHBondContact O-OG1 3.29Å; H344-T348 VanDerWaalsContact O-OG1 3.1Å; H344-N445 PolarHBondContact CD2-ND2 2.89Å; H344-W449 AromaticContact CD2-NE1 3.64Å; H344-W449 AromaticContact CE1-NE1 3.78Å; H344-W449 AromaticContact NE2-CD1 3.84Å; H344-W449 AromaticContact NE2-CE2 3.76Å; H344-W449 AromaticContact NE2-NE1 2.87Å; H344-W449 PolarHBondContact NE2-NE1 2.68Å
345	F	98	Very high	97.9	Very high	58 Å²	58	29.7 Å²	29.7	25%	0.254	14%	0.139	S	C	.	.	H	α-helix	trans	-65.4	-40.8	-179.4	-173.6	-106	0	0	0	112.2	W341 F343 W347 T348 N349 W449 Y452	W341-F345 HydrophobicContact CD2-CB 4.29Å; W341-F345 AromaticContact CH2-CD2 3.83Å; W341-F345 HydrophobicContact CH2-CD2 3.83Å; W341-F345 HydrophobicContact CZ2-CB 4.14Å; W341-F345 AromaticContact CZ2-CD2 3.48Å; W341-F345 HydrophobicContact CZ2-CD2 3.48Å; W341-F345 VanDerWaalsContact CZ2-CD2 3.48Å; W341-F345 HydrophobicContact CZ2-CE2 4.1Å; W341-F345 AromaticContact CZ2-CG 3.97Å; W341-F345 HydrophobicContact CZ2-CG 3.97Å; W341-F345 WeakPolarHBondContact O-CB 3.32Å; W341-F345 PolarHBondContact O-N 3.49Å; F343-F345 PolarHBondContact O-N 3.3Å; F345-W347 VanDerWaalsContact C-N 3.33Å; F345-W347 PolarHBondContact O-N 2.62Å; F345-T348 PolarHBondContact O-N 3.18Å; F345-N349 VanDerWaalsContact CD1-ND2 3.27Å; F345-N349 WeakPolarHBondContact CD1-ND2 3.47Å; F345-N349 WeakPolarHBondContact CE1-ND2 3.46Å; F345-N349 VanDerWaalsContact CZ-ND2 3.31Å; F345-N349 WeakPolarHBondContact CZ-ND2 3.49Å; F345-N349 PolarHBondContact O-N 3.14Å; F345-N349 PolarHBondContact O-ND2 3.31Å; F345-W449 AromaticContact CD2-CH2 3.54Å; F345-W449 HydrophobicContact CD2-CH2 3.54Å; F345-W449 HydrophobicContact CD2-CZ2 4.13Å; F345-W449 HydrophobicContact CD2-CZ3 4.11Å; F345-W449 AromaticContact CE2-CH2 3.83Å; F345-W449 HydrophobicContact CE2-CH2 3.83Å; F345-W449 HydrophobicContact CE2-CZ3 4.03Å; F345-Y452 HydrophobicContact CE2-CD2 4.38Å; F345-Y452 HydrophobicContact CE2-CE2 4.01Å; F345-Y452 HydrophobicContact CZ-CE2 4.15Å
346	R	98.3	Very high	97.9	Very high	104 Å²	104	30.7 Å²	30.7	39%	0.392	14%	0.144	S	C	.	.	H	α-helix	trans	-63.5	-38.8	173.7	-174.4	168.2	173.5	173	-5.6	111.2	F131 E135 P342 F343 Q350	F131-R346 HydrophobicContact CD1-CG 4.44Å; F131-R346 VanDerWaalsContact CD1-CZ 3.44Å; F131-R346 HydrophobicContact CD2-CG 4.47Å; F131-R346 HydrophobicContact CE1-CG 3.94Å; F131-R346 HydrophobicContact CE2-CB 4.04Å; F131-R346 HydrophobicContact CE2-CG 3.97Å; F131-R346 HydrophobicContact CZ-CB 4.06Å; F131-R346 HydrophobicContact CZ-CG 3.66Å; E135-R346 IonicContact OE1-CZ 3.53Å; E135-R346 IonicContact OE1-NH1 2.88Å; E135-R346 PolarHBondContact OE1-NH1 2.96Å; E135-R346 IonicContact OE1-NH2 3.5Å; E135-R346 PolarHBondContact OE1-NH2 2.92Å; P342-R346 VanDerWaalsContact O-CB 3.24Å; P342-R346 WeakPolarHBondContact O-CB 3.33Å; P342-R346 PolarHBondContact O-N 3.48Å; P342-R346 VanDerWaalsContact O-N 3.16Å; F343-R346 PolarHBondContact O-N 3.16Å; R346-Q350 WeakPolarHBondContact O-CG 3.35Å; R346-Q350 PolarHBondContact O-N 3.34Å; R346-Q350 PolarHBondContact O-NE2 2.9Å
347	W	98.6	Very high	97.9	Very high	1 Å²	1	35.2 Å²	35.2	0%	0.004	16%	0.161	C	C	.	.	H	α-helix	trans	-66.5	-48.1	173.4	-80.5	133.4	0	0	0	113	I130 F131 Y184 V188 H189 D192 H336 F343 H344 F345 N349 Q350 L351	I130-W347 HydrophobicContact CG2-CZ2 4.06Å; F131-W347 HydrophobicContact CE1-CD2 4.39Å; F131-W347 HydrophobicContact CE1-CE3 4.47Å; F131-W347 AromaticContact CE1-CH2 3.76Å; F131-W347 HydrophobicContact CE1-CH2 3.76Å; F131-W347 AromaticContact CE1-CZ2 3.74Å; F131-W347 HydrophobicContact CE1-CZ2 3.74Å; F131-W347 HydrophobicContact CE1-CZ3 4.17Å; F131-W347 HydrophobicContact CE2-CZ2 4.36Å; F131-W347 AromaticContact CZ-CD2 3.64Å; F131-W347 HydrophobicContact CZ-CD2 3.64Å; F131-W347 AromaticContact CZ-CE2 3.36Å; F131-W347 HydrophobicContact CZ-CE3 4.12Å; F131-W347 HydrophobicContact CZ-CG 4.09Å; F131-W347 AromaticContact CZ-CH2 3.94Å; F131-W347 HydrophobicContact CZ-CH2 3.94Å; F131-W347 AromaticContact CZ-CZ2 3.53Å; F131-W347 HydrophobicContact CZ-CZ2 3.53Å; F131-W347 HydrophobicContact CZ-CZ3 4.24Å; F131-W347 AromaticContact CZ-NE1 3.76Å; Y184-W347 AromaticContact CD2-CE3 3.72Å; Y184-W347 HydrophobicContact CD2-CE3 3.72Å; Y184-W347 HydrophobicContact CD2-CZ3 4.38Å; Y184-W347 HydrophobicContact CE2-CB 4.21Å; Y184-W347 HydrophobicContact CE2-CD2 4.3Å; Y184-W347 AromaticContact CE2-CE3 3.83Å; Y184-W347 HydrophobicContact CE2-CE3 3.83Å; Y184-W347 HydrophobicContact CE2-CG 4.49Å; V188-W347 HydrophobicContact CB-CH2 4.01Å; V188-W347 HydrophobicContact CG1-CH2 3.93Å; V188-W347 HydrophobicContact CG1-CZ2 4.18Å; H189-W347 VanDerWaalsContact CA-CH2 3.47Å; H189-W347 HydrophobicContact CB-CH2 3.75Å; H189-W347 HydrophobicContact CB-CZ2 4.39Å; H189-W347 HydrophobicContact CB-CZ3 3.92Å; H189-W347 VanDerWaalsContact N-CH2 3.33Å; D192-W347 HydrophobicContact CB-CZ2 4.02Å; D192-W347 PolarHBondContact OD2-NE1 2.73Å; H336-W347 HydrophobicContact CB-CB 3.76Å; H336-W347 HydrophobicContact CB-CG 3.87Å; H336-W347 VanDerWaalsContact ND1-CB 3.32Å; H336-W347 WeakPolarHBondContact ND1-CB 3.29Å; F343-W347 WeakPolarHBondContact O-CB 3.17Å; F343-W347 PolarHBondContact O-N 3.32Å; H344-W347 PolarHBondContact O-N 2.82Å; F345-W347 VanDerWaalsContact C-N 3.33Å; F345-W347 PolarHBondContact O-N 2.62Å; W347-N349 PolarHBondContact O-N 2.7Å; W347-Q350 WeakPolarHBondContact O-CB 3.39Å; W347-Q350 PolarHBondContact O-N 2.7Å; W347-L351 PolarHBondContact O-N 2.85Å
348	T	98.3	Very high	97.9	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-56.7	-46.7	176.5	-60.3	0	0	0	0	112.1	H336 H344 F345 Q350 L351 M352 I380 Q384 W449	H336-T348 PolarHBondContact CE1-OG1 2.98Å; H344-T348 PolarHBondContact CE1-OG1 3.07Å; H344-T348 PolarHBondContact O-N 2.85Å; H344-T348 PolarHBondContact O-OG1 3.29Å; H344-T348 VanDerWaalsContact O-OG1 3.1Å; F345-T348 PolarHBondContact O-N 3.18Å; T348-Q350 VanDerWaalsContact C-N 3.27Å; T348-Q350 PolarHBondContact O-N 3.01Å; T348-L351 PolarHBondContact O-N 3.15Å; T348-M352 HydrophobicContact CG2-CG 4.15Å; T348-M352 WeakPolarHBondContact O-CG 3.42Å; T348-M352 PolarHBondContact O-N 2.94Å; T348-I380 HydrophobicContact CG2-CG2 3.68Å; T348-Q384 VanDerWaalsContact CG2-CD 3.48Å; T348-Q384 HydrophobicContact CG2-CG 3.61Å; T348-Q384 VanDerWaalsContact CG2-OE1 3.31Å; T348-Q384 PolarHBondContact OG1-OE1 2.7Å; T348-W449 HydrophobicContact CG2-CH2 3.8Å; T348-W449 HydrophobicContact CG2-CZ2 3.8Å
349	N	97.6	Very high	97.8	Very high	60 Å²	60	35.2 Å²	35.2	32%	0.321	16%	0.161	S	C	.	.	H	α-helix	trans	-64.7	-32.8	-179.1	-73.3	-60.1	0	0	0	112.6	F345 W347 E353	F345-N349 VanDerWaalsContact CD1-ND2 3.27Å; F345-N349 WeakPolarHBondContact CD1-ND2 3.47Å; F345-N349 WeakPolarHBondContact CE1-ND2 3.46Å; F345-N349 VanDerWaalsContact CZ-ND2 3.31Å; F345-N349 WeakPolarHBondContact CZ-ND2 3.49Å; F345-N349 PolarHBondContact O-N 3.14Å; F345-N349 PolarHBondContact O-ND2 3.31Å; W347-N349 PolarHBondContact O-N 2.7Å; N349-E353 WeakPolarHBondContact O-CB 3Å; N349-E353 PolarHBondContact O-N 2.87Å
350	Q	98.4	Very high	97.8	Very high	41 Å²	41	37.9 Å²	37.9	19%	0.192	18%	0.175	C	C	.	.	H	α-helix	trans	-68.1	-47.6	171.6	-77	167.5	124.8	0	0	111	P183 Y184 R346 W347 T348 M352 E353 E354	P183-Q350 HydrophobicContact CB-CB 4.36Å; P183-Q350 WeakPolarHBondContact CB-O 3.48Å; P183-Q350 WeakPolarHBondContact O-CB 3.26Å; P183-Q350 WeakPolarHBondContact O-CG 3.35Å; P183-Q350 PolarHBondContact O-OE1 2.58Å; Y184-Q350 HydrophobicContact CD2-CB 4.4Å; R346-Q350 WeakPolarHBondContact O-CG 3.35Å; R346-Q350 PolarHBondContact O-N 3.34Å; R346-Q350 PolarHBondContact O-NE2 2.9Å; W347-Q350 WeakPolarHBondContact O-CB 3.39Å; W347-Q350 PolarHBondContact O-N 2.7Å; T348-Q350 VanDerWaalsContact C-N 3.27Å; T348-Q350 PolarHBondContact O-N 3.01Å; Q350-M352 VanDerWaalsContact C-N 3.35Å; Q350-M352 PolarHBondContact O-N 3.19Å; Q350-E353 PolarHBondContact O-N 3.11Å; Q350-E354 PolarHBondContact O-N 3.49Å
351	L	98	Very high	97.7	Very high	15 Å²	15	35.8 Å²	35.8	8%	0.079	17%	0.168	C	C	.	.	H	α-helix	trans	-58.9	-45.3	178.9	-171.9	64.3	0	0	0	111.9	Y184 W347 T348 E354 F355	Y184-L351 HydrophobicContact CD1-CD1 3.85Å; Y184-L351 HydrophobicContact CD2-CB 3.6Å; Y184-L351 HydrophobicContact CD2-CD1 3.96Å; Y184-L351 HydrophobicContact CD2-CG 4.33Å; Y184-L351 HydrophobicContact CE1-CD1 4.14Å; Y184-L351 HydrophobicContact CE2-CB 4.04Å; Y184-L351 HydrophobicContact CE2-CD1 4.22Å; Y184-L351 HydrophobicContact CG-CB 4.11Å; Y184-L351 HydrophobicContact CG-CD1 3.76Å; W347-L351 PolarHBondContact O-N 2.85Å; T348-L351 PolarHBondContact O-N 3.15Å; L351-E354 WeakPolarHBondContact O-CB 3.46Å; L351-E354 PolarHBondContact O-N 2.99Å; L351-F355 HydrophobicContact CD1-CD1 4.18Å; L351-F355 HydrophobicContact CD1-CE1 3.4Å; L351-F355 VanDerWaalsContact CD1-CE1 3.4Å; L351-F355 HydrophobicContact CD1-CE2 4.42Å; L351-F355 HydrophobicContact CD1-CZ 3.57Å; L351-F355 HydrophobicContact CD2-CE2 4.26Å; L351-F355 HydrophobicContact CD2-CZ 3.99Å; L351-F355 HydrophobicContact CG-CD1 4.41Å; L351-F355 HydrophobicContact CG-CE1 3.85Å; L351-F355 HydrophobicContact CG-CE2 4.03Å; L351-F355 HydrophobicContact CG-CZ 3.65Å; L351-F355 WeakPolarHBondContact O-CD1 3.36Å; L351-F355 WeakPolarHBondContact O-CG 3.48Å; L351-F355 PolarHBondContact O-N 3.33Å
352	M	97.1	Very high	97.6	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.01	16%	0.159	C	C	.	.	H	α-helix	trans	-66.8	-42.2	179.3	-65.2	-51.3	-44.9	0	0	112.4	T348 Q350 E354 F355 F356 L372 V378 I380	T348-M352 HydrophobicContact CG2-CG 4.15Å; T348-M352 WeakPolarHBondContact O-CG 3.42Å; T348-M352 PolarHBondContact O-N 2.94Å; Q350-M352 VanDerWaalsContact C-N 3.35Å; Q350-M352 PolarHBondContact O-N 3.19Å; M352-E354 PolarHBondContact O-N 3.21Å; M352-F355 HydrophobicContact CE-CD2 4.38Å; M352-F355 PolarHBondContact O-N 2.85Å; M352-F355 HydrophobicContact SD-CD2 4.35Å; M352-F356 HydrophobicContact CB-CD2 4.42Å; M352-F356 HydrophobicContact CB-CE2 3.98Å; M352-F356 HydrophobicContact CB-CZ 4.14Å; M352-F356 HydrophobicContact CE-CD1 4.19Å; M352-F356 HydrophobicContact CE-CE1 3.38Å; M352-F356 HydrophobicContact CE-CE2 4.42Å; M352-F356 HydrophobicContact CE-CZ 3.53Å; M352-F356 VanDerWaalsContact O-CB 3.25Å; M352-F356 WeakPolarHBondContact O-CB 3.44Å; M352-F356 WeakPolarHBondContact O-CD1 3.42Å; M352-F356 WeakPolarHBondContact O-CD2 3.41Å; M352-F356 WeakPolarHBondContact O-CG 3.32Å; M352-F356 PolarHBondContact O-N 2.91Å; M352-L372 HydrophobicContact CE-CB 4.32Å; M352-L372 WeakPolarHBondContact CE-O 3.35Å; M352-V378 HydrophobicContact CE-CG1 3.77Å; M352-I380 HydrophobicContact CB-CD1 4.22Å; M352-I380 HydrophobicContact CE-CG1 4.31Å; M352-I380 HydrophobicContact CG-CB 4.5Å; M352-I380 HydrophobicContact CG-CD1 4.02Å; M352-I380 HydrophobicContact CG-CG1 3.95Å; M352-I380 HydrophobicContact CG-CG2 3.87Å; M352-I380 HydrophobicContact SD-CG1 4.47Å
353	E	98.2	Very high	97.5	Very high	64 Å²	64	33.4 Å²	33.4	30%	0.299	15%	0.153	S	C	.	.	H	α-helix	trans	-65.3	-25.7	174.2	167.2	58.2	-170.5	0	0	112.6	P183 N349 Q350 R357 R375	P183-E353 HydrophobicContact CB-CG 4.3Å; P183-E353 HydrophobicContact CG-CG 3.97Å; N349-E353 WeakPolarHBondContact O-CB 3Å; N349-E353 PolarHBondContact O-N 2.87Å; Q350-E353 PolarHBondContact O-N 3.11Å; E353-R357 VanDerWaalsContact O-CG 3.3Å; E353-R357 WeakPolarHBondContact O-CG 3.08Å; E353-R357 PolarHBondContact O-N 3.38Å; E353-R357 IonicContact OE1-CZ 3.42Å; E353-R357 VanDerWaalsContact OE1-CZ 3.23Å; E353-R357 IonicContact OE1-NE 3.73Å; E353-R357 PolarHBondContact OE1-NE 2.78Å; E353-R357 IonicContact OE1-NH2 3.12Å; E353-R357 PolarHBondContact OE1-NH2 3.23Å; E353-R375 IonicContact OE2-NH1 3.16Å; E353-R375 PolarHBondContact OE2-NH1 3.21Å; E353-R375 IonicContact OE2-NH2 2.73Å
354	E	98.3	Very high	97.3	Very high	0 Å²	0	37.5 Å²	37.5	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-73.1	-50.5	170.9	-165	162	139.9	0	0	111.8	N182 P183 Y184 H185 H229 G231 Q350 L351 M352 F356 R357 Q358	N182-E354 WeakPolarHBondContact CB-OE2 3.1Å; P183-E354 HydrophobicContact CB-CB 4.17Å; P183-E354 VanDerWaalsContact CD-OE2 3.31Å; P183-E354 WeakPolarHBondContact CD-OE2 3.45Å; P183-E354 HydrophobicContact CG-CB 4.05Å; Y184-E354 WeakPolarHBondContact CA-OE2 3.08Å; Y184-E354 WeakPolarHBondContact CB-OE2 3.05Å; Y184-E354 PolarHBondContact N-OE2 3.46Å; H185-E354 IonicContact CE1-OE1 2.98Å; H185-E354 IonicContact CG-OE1 3.22Å; H185-E354 PolarHBondContact N-OE2 3.34Å; H185-E354 IonicContact ND1-OE1 2.95Å; H185-E354 PolarHBondContact ND1-OE1 2.98Å; H185-E354 IonicContact ND1-OE2 2.79Å; H229-E354 IonicContact CE1-OE1 3.81Å; H229-E354 IonicContact ND1-OE1 3.58Å; G231-E354 VanDerWaalsContact C-OE1 3.23Å; G231-E354 VanDerWaalsContact CA-OE1 3.23Å; G231-E354 WeakPolarHBondContact CA-OE1 3.34Å; G231-E354 WeakPolarHBondContact O-CG 3.37Å; Q350-E354 PolarHBondContact O-N 3.49Å; L351-E354 WeakPolarHBondContact O-CB 3.46Å; L351-E354 PolarHBondContact O-N 2.99Å; M352-E354 PolarHBondContact O-N 3.21Å; E354-F356 PolarHBondContact O-N 3.13Å; E354-R357 WeakPolarHBondContact O-CB 3.48Å; E354-R357 PolarHBondContact O-N 3.15Å; E354-R357 VanDerWaalsContact O-N 3.07Å; E354-Q358 PolarHBondContact O-N 3.21Å
355	F	97.2	Very high	97.1	Very high	3 Å²	3	41.8 Å²	41.8	1%	0.013	20%	0.201	C	C	.	.	H	α-helix	trans	-58.1	-37.2	175	-69.3	2.5	0	0	0	112	T89 F90 T233 L351 M352 R357 Q358 G359 L372 C373	T89-F355 HydrophobicContact CG2-CE2 4.34Å; F90-F355 HydrophobicContact CE1-CE1 4.49Å; F90-F355 AromaticContact CE1-CZ 3.78Å; F90-F355 HydrophobicContact CE1-CZ 3.78Å; F90-F355 HydrophobicContact CZ-CE2 4.42Å; F90-F355 AromaticContact CZ-CZ 3.94Å; F90-F355 HydrophobicContact CZ-CZ 3.94Å; T233-F355 HydrophobicContact CG2-CD1 3.56Å; T233-F355 HydrophobicContact CG2-CE1 3.22Å; T233-F355 HydrophobicContact CG2-CG 4.44Å; T233-F355 HydrophobicContact CG2-CZ 3.84Å; L351-F355 HydrophobicContact CD1-CD1 4.18Å; L351-F355 HydrophobicContact CD1-CE1 3.4Å; L351-F355 VanDerWaalsContact CD1-CE1 3.4Å; L351-F355 HydrophobicContact CD1-CE2 4.42Å; L351-F355 HydrophobicContact CD1-CZ 3.57Å; L351-F355 HydrophobicContact CD2-CE2 4.26Å; L351-F355 HydrophobicContact CD2-CZ 3.99Å; L351-F355 HydrophobicContact CG-CD1 4.41Å; L351-F355 HydrophobicContact CG-CE1 3.85Å; L351-F355 HydrophobicContact CG-CE2 4.03Å; L351-F355 HydrophobicContact CG-CZ 3.65Å; L351-F355 WeakPolarHBondContact O-CD1 3.36Å; L351-F355 WeakPolarHBondContact O-CG 3.48Å; L351-F355 PolarHBondContact O-N 3.33Å; M352-F355 HydrophobicContact CE-CD2 4.38Å; M352-F355 PolarHBondContact O-N 2.85Å; M352-F355 HydrophobicContact SD-CD2 4.35Å; F355-R357 VanDerWaalsContact C-N 3.35Å; F355-R357 PolarHBondContact O-N 2.99Å; F355-Q358 WeakPolarHBondContact O-CB 3.23Å; F355-Q358 PolarHBondContact O-N 3.13Å; F355-G359 PolarHBondContact O-N 2.97Å; F355-L372 HydrophobicContact CD2-CB 3.84Å; F355-L372 HydrophobicContact CD2-CD1 4.49Å; F355-L372 HydrophobicContact CE2-CB 4.28Å; F355-L372 HydrophobicContact CE2-CD1 4.23Å; F355-C373 WeakPolarHBondContact O-CA 3.31Å; F355-C373 WeakPolarHBondContact O-CB 3.33Å; F355-C373 PolarHBondContact O-SG 2.81Å
356	F	97.9	Very high	96.8	Very high	22 Å²	22	42.4 Å²	42.4	10%	0.096	22%	0.224	C	C	.	.	H	α-helix	trans	-70.1	-28	178.2	-64.2	-21.7	0	0	0	113.4	M352 E354 D360 L372 C373 R375 V378 I380	M352-F356 HydrophobicContact CB-CD2 4.42Å; M352-F356 HydrophobicContact CB-CE2 3.98Å; M352-F356 HydrophobicContact CB-CZ 4.14Å; M352-F356 HydrophobicContact CE-CD1 4.19Å; M352-F356 HydrophobicContact CE-CE1 3.38Å; M352-F356 HydrophobicContact CE-CE2 4.42Å; M352-F356 HydrophobicContact CE-CZ 3.53Å; M352-F356 VanDerWaalsContact O-CB 3.25Å; M352-F356 WeakPolarHBondContact O-CB 3.44Å; M352-F356 WeakPolarHBondContact O-CD1 3.42Å; M352-F356 WeakPolarHBondContact O-CD2 3.41Å; M352-F356 WeakPolarHBondContact O-CG 3.32Å; M352-F356 PolarHBondContact O-N 2.91Å; E354-F356 PolarHBondContact O-N 3.13Å; F356-D360 WeakPolarHBondContact O-CB 3.08Å; F356-D360 PolarHBondContact O-N 3.38Å; F356-L372 WeakPolarHBondContact CE1-O 3.49Å; F356-C373 WeakPolarHBondContact CA-O 3.31Å; F356-R375 HydrophobicContact CB-CB 3.94Å; F356-R375 VanDerWaalsContact CB-CZ 3.46Å; F356-R375 HydrophobicContact CD1-CB 3.74Å; F356-R375 HydrophobicContact CD2-CB 3.78Å; F356-R375 HydrophobicContact CE1-CB 4.11Å; F356-R375 HydrophobicContact CE2-CB 4.15Å; F356-R375 HydrophobicContact CG-CB 3.55Å; F356-R375 HydrophobicContact CZ-CB 4.3Å; F356-V378 HydrophobicContact CE1-CB 4.17Å; F356-V378 HydrophobicContact CE1-CG1 4.4Å; F356-V378 HydrophobicContact CE1-CG2 4.48Å; F356-V378 HydrophobicContact CZ-CB 4.5Å; F356-I380 HydrophobicContact CE2-CD1 4.34Å; F356-I380 HydrophobicContact CZ-CD1 4.27Å; F356-I380 HydrophobicContact CZ-CG1 4.32Å
357	R	97.9	Very high	96.3	Very high	97 Å²	97	39.2 Å²	39.2	37%	0.366	22%	0.215	S	C	.	.	H	α-helix	trans	-69.9	-38.5	170.5	-72.9	167.8	-172.5	-168	6.5	111.9	N181 P183 E353 E354 F355 L361	N181-R357 PolarHBondContact O-NH1 2.83Å; P183-R357 VanDerWaalsContact CG-CZ 3.44Å; E353-R357 VanDerWaalsContact O-CG 3.3Å; E353-R357 WeakPolarHBondContact O-CG 3.08Å; E353-R357 PolarHBondContact O-N 3.38Å; E353-R357 IonicContact OE1-CZ 3.42Å; E353-R357 VanDerWaalsContact OE1-CZ 3.23Å; E353-R357 IonicContact OE1-NE 3.73Å; E353-R357 PolarHBondContact OE1-NE 2.78Å; E353-R357 IonicContact OE1-NH2 3.12Å; E353-R357 PolarHBondContact OE1-NH2 3.23Å; E354-R357 WeakPolarHBondContact O-CB 3.48Å; E354-R357 PolarHBondContact O-N 3.15Å; E354-R357 VanDerWaalsContact O-N 3.07Å; F355-R357 VanDerWaalsContact C-N 3.35Å; F355-R357 PolarHBondContact O-N 2.99Å; R357-L361 PolarHBondContact O-N 3.41Å; R357-L361 VanDerWaalsContact O-N 3.09Å
358	Q	97	Very high	95.9	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-59.9	-49.1	170.8	167.4	174.6	-6.1	0	0	111.1	H232 T233 Y236 E354 F355 D360 L361 E362 S370	H232-Q358 HydrophobicContact CB-CB 3.92Å; H232-Q358 HydrophobicContact CB-CG 4.12Å; H232-Q358 VanDerWaalsContact CD2-CA 3.48Å; H232-Q358 WeakPolarHBondContact CD2-CA 3.39Å; T233-Q358 PolarHBondContact OG1-NE2 2.98Å; T233-Q358 PolarHBondContact OG1-OE1 3.42Å; Y236-Q358 HydrophobicContact CD1-CG 4.14Å; Y236-Q358 HydrophobicContact CE1-CG 4.34Å; E354-Q358 PolarHBondContact O-N 3.21Å; F355-Q358 WeakPolarHBondContact O-CB 3.23Å; F355-Q358 PolarHBondContact O-N 3.13Å; Q358-D360 PolarHBondContact O-N 3.24Å; Q358-L361 WeakPolarHBondContact O-CB 3.42Å; Q358-L361 PolarHBondContact O-N 2.95Å; Q358-L361 VanDerWaalsContact O-N 3.07Å; Q358-E362 HydrophobicContact CG-CG 4.14Å; Q358-E362 VanDerWaalsContact CG-OE1 3.31Å; Q358-E362 WeakPolarHBondContact CG-OE1 3.43Å; Q358-E362 PolarHBondContact NE2-OE1 3.28Å; Q358-E362 VanDerWaalsContact O-CG 3.32Å; Q358-E362 WeakPolarHBondContact O-CG 3.46Å; Q358-E362 PolarHBondContact O-N 3.06Å; Q358-S370 PolarHBondContact NE2-OG 3.37Å
359	G	96.6	Very high	95.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.5	-37.7	-179.4	0	0	0	0	0	113.7	F355 L361 E362 M363 C373	F355-G359 PolarHBondContact O-N 2.97Å; G359-L361 VanDerWaalsContact C-N 3.32Å; G359-L361 PolarHBondContact O-N 3.3Å; G359-E362 PolarHBondContact O-N 3.43Å; G359-M363 WeakPolarHBondContact O-CG 3.36Å; G359-M363 PolarHBondContact O-N 2.91Å; G359-C373 WeakPolarHBondContact CA-O 3.2Å
360	D	97.3	Very high	95.4	Very high	57 Å²	57	43.6 Å²	43.6	31%	0.305	25%	0.245	S	C	.	.	H	α-helix	trans	-59.3	-42.7	170.8	-67.4	-23.9	0	0	0	111.4	F356 Q358 T364 R375	F356-D360 WeakPolarHBondContact O-CB 3.08Å; F356-D360 PolarHBondContact O-N 3.38Å; Q358-D360 PolarHBondContact O-N 3.24Å; D360-T364 WeakPolarHBondContact O-CG2 3.26Å; D360-T364 PolarHBondContact O-N 3.39Å; D360-R375 VanDerWaalsContact CG-NE 3.35Å; D360-R375 IonicContact OD1-CZ 3.45Å; D360-R375 IonicContact OD1-NE 3.07Å; D360-R375 PolarHBondContact OD1-NE 2.86Å; D360-R375 IonicContact OD2-CZ 3.93Å; D360-R375 VanDerWaalsContact OD2-CZ 3.22Å; D360-R375 IonicContact OD2-NE 2.76Å; D360-R375 PolarHBondContact OD2-NE 3.43Å; D360-R375 IonicContact OD2-NH2 3.63Å; D360-R375 PolarHBondContact OD2-NH2 3.25Å
361	L	95.9	Very high	94.9	Very high	61 Å²	61	43.8 Å²	43.8	32%	0.319	25%	0.25	S	S	.	.	H	α-helix	trans	-68.9	-46.7	178.4	-176.1	60.4	0	0	0	111.9	H232 Y236 R357 Q358 G359 M363 T364 M365	H232-L361 VanDerWaalsContact NE2-CD2 3.26Å; H232-L361 WeakPolarHBondContact NE2-CD2 3.31Å; Y236-L361 WeakPolarHBondContact OH-CD2 3.35Å; R357-L361 PolarHBondContact O-N 3.41Å; R357-L361 VanDerWaalsContact O-N 3.09Å; Q358-L361 WeakPolarHBondContact O-CB 3.42Å; Q358-L361 PolarHBondContact O-N 2.95Å; Q358-L361 VanDerWaalsContact O-N 3.07Å; G359-L361 VanDerWaalsContact C-N 3.32Å; G359-L361 PolarHBondContact O-N 3.3Å; L361-M363 VanDerWaalsContact C-N 3.29Å; L361-M363 PolarHBondContact O-N 2.86Å; L361-T364 PolarHBondContact O-N 2.96Å; L361-T364 PolarHBondContact O-OG1 3.25Å; L361-M365 HydrophobicContact CD1-CG 4.37Å; L361-M365 HydrophobicContact CD1-SD 4.28Å; L361-M365 HydrophobicContact CD2-SD 4.46Å; L361-M365 HydrophobicContact CG-CG 4.47Å; L361-M365 HydrophobicContact CG-SD 3.94Å; L361-M365 WeakPolarHBondContact O-CG 3.36Å; L361-M365 PolarHBondContact O-N 3.49Å
362	E	95.8	Very high	94.6	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-53.1	-45	174.7	-72.3	168.3	161.5	0	0	111.1	Y236 Q358 G359 T364 M365 G366 I367 V369 S370	Y236-E362 HydrophobicContact CG-CG 4.29Å; Q358-E362 HydrophobicContact CG-CG 4.14Å; Q358-E362 VanDerWaalsContact CG-OE1 3.31Å; Q358-E362 WeakPolarHBondContact CG-OE1 3.43Å; Q358-E362 PolarHBondContact NE2-OE1 3.28Å; Q358-E362 VanDerWaalsContact O-CG 3.32Å; Q358-E362 WeakPolarHBondContact O-CG 3.46Å; Q358-E362 PolarHBondContact O-N 3.06Å; G359-E362 PolarHBondContact O-N 3.43Å; E362-T364 PolarHBondContact O-N 3.23Å; E362-M365 PolarHBondContact O-N 2.74Å; E362-G366 PolarHBondContact O-N 2.82Å; E362-G366 VanDerWaalsContact O-N 3.11Å; E362-I367 HydrophobicContact CB-CD1 4.27Å; E362-I367 HydrophobicContact CB-CG1 3.92Å; E362-I367 HydrophobicContact CG-CD1 3.98Å; E362-I367 HydrophobicContact CG-CG1 4.17Å; E362-I367 WeakPolarHBondContact O-CG1 3.49Å; E362-I367 PolarHBondContact O-N 2.99Å; E362-V369 HydrophobicContact CB-CG2 4.44Å; E362-V369 WeakPolarHBondContact OE2-CA 3.42Å; E362-S370 WeakPolarHBondContact OE1-CB 3.22Å; E362-S370 PolarHBondContact OE1-OG 3.34Å; E362-S370 PolarHBondContact OE2-N 2.75Å
363	M	94.4	Very high	94.4	Very high	87 Å²	87	44.2 Å²	44.2	43%	0.429	25%	0.253	S	S	.	.	H	α-helix	trans	-59.5	-44.1	173.2	-75.8	-170.2	-80.6	0	0	112.9	G359 L361 M365 G366 V369	G359-M363 WeakPolarHBondContact O-CG 3.36Å; G359-M363 PolarHBondContact O-N 2.91Å; L361-M363 VanDerWaalsContact C-N 3.29Å; L361-M363 PolarHBondContact O-N 2.86Å; M363-M365 VanDerWaalsContact C-N 3.29Å; M363-M365 PolarHBondContact O-N 3.2Å; M363-G366 PolarHBondContact O-N 2.94Å; M363-V369 HydrophobicContact CG-CG2 3.35Å; M363-V369 HydrophobicContact SD-CG2 4.33Å
364	T	95.4	Very high	94.1	Very high	116 Å²	116	42.8 Å²	42.8	71%	0.712	25%	0.247	S	C	*	.	H	α-helix	trans	-69.8	-25.3	177.4	63.1	0	0	0	0	113.8	D360 L361 E362 G366	D360-T364 WeakPolarHBondContact O-CG2 3.26Å; D360-T364 PolarHBondContact O-N 3.39Å; L361-T364 PolarHBondContact O-N 2.96Å; L361-T364 PolarHBondContact O-OG1 3.25Å; E362-T364 PolarHBondContact O-N 3.23Å; T364-G366 VanDerWaalsContact C-N 3.33Å
365	M	92.6	Very high	93.9	Very high	89 Å²	89	47.2 Å²	47.2	44%	0.438	26%	0.264	S	S	.	.	H	α-helix	trans	-81.4	-11.4	174.9	-69.6	177.6	65.1	0	0	113	Y236 L361 E362 M363 I367	Y236-M365 HydrophobicContact CE2-CE 4.13Å; Y236-M365 HydrophobicContact CE2-SD 3.94Å; L361-M365 HydrophobicContact CD1-CG 4.37Å; L361-M365 HydrophobicContact CD1-SD 4.28Å; L361-M365 HydrophobicContact CD2-SD 4.46Å; L361-M365 HydrophobicContact CG-CG 4.47Å; L361-M365 HydrophobicContact CG-SD 3.94Å; L361-M365 WeakPolarHBondContact O-CG 3.36Å; L361-M365 PolarHBondContact O-N 3.49Å; E362-M365 PolarHBondContact O-N 2.74Å; M363-M365 VanDerWaalsContact C-N 3.29Å; M363-M365 PolarHBondContact O-N 3.2Å; M365-I367 VanDerWaalsContact C-N 3.28Å; M365-I367 HydrophobicContact CB-CD1 4.33Å; M365-I367 HydrophobicContact CB-CG1 4.08Å; M365-I367 HydrophobicContact CE-CD1 4.34Å; M365-I367 PolarHBondContact O-N 2.71Å
366	G	91.6	Very high	93.6	Very high	71 Å²	71	54 Å²	54	73%	0.732	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.8	18.6	-179.3	0	0	0	0	0	114.2	E362 M363 T364	E362-G366 PolarHBondContact O-N 2.82Å; E362-G366 VanDerWaalsContact O-N 3.11Å; M363-G366 PolarHBondContact O-N 2.94Å; T364-G366 VanDerWaalsContact C-N 3.33Å
367	I	88.3	Confident	93.1	Very high	38 Å²	38	58.1 Å²	58.1	20%	0.195	33%	0.326	C	S	.	.	S	Bend	trans	-95.2	161.5	174.6	58.7	178.2	0	0	0	110.2	Y236 E362 M365 V369	Y236-I367 HydrophobicContact CD2-CD1 3.58Å; Y236-I367 HydrophobicContact CE2-CD1 4.3Å; Y236-I367 HydrophobicContact CG-CD1 4.32Å; E362-I367 HydrophobicContact CB-CD1 4.27Å; E362-I367 HydrophobicContact CB-CG1 3.92Å; E362-I367 HydrophobicContact CG-CD1 3.98Å; E362-I367 HydrophobicContact CG-CG1 4.17Å; E362-I367 WeakPolarHBondContact O-CG1 3.49Å; E362-I367 PolarHBondContact O-N 2.99Å; M365-I367 VanDerWaalsContact C-N 3.28Å; M365-I367 HydrophobicContact CB-CD1 4.33Å; M365-I367 HydrophobicContact CB-CG1 4.08Å; M365-I367 HydrophobicContact CE-CD1 4.34Å; M365-I367 PolarHBondContact O-N 2.71Å; I367-V369 PolarHBondContact O-N 3.37Å
368	P	90.5	Very high	92.7	Very high	95 Å²	95	55 Å²	55	62%	0.617	32%	0.319	S	S	*	.	P	Polyproline II helix	trans	-58.4	135.6	174.8	-22.2	34.4	0	0	0	110.9
369	V	92.3	Very high	92.3	Very high	50 Å²	50	58.2 Å²	58.2	30%	0.303	34%	0.336	S	S	.	.	P	Polyproline II helix	trans	-71.8	130.7	174.2	-177.9	0	0	0	0	109.3	E362 M363 I367 C373 D374	E362-V369 HydrophobicContact CB-CG2 4.44Å; E362-V369 WeakPolarHBondContact OE2-CA 3.42Å; M363-V369 HydrophobicContact CG-CG2 3.35Å; M363-V369 HydrophobicContact SD-CG2 4.33Å; I367-V369 PolarHBondContact O-N 3.37Å; V369-C373 HydrophobicContact CG1-CB 3.92Å; V369-D374 HydrophobicContact CG1-CB 3.91Å
370	S	92.3	Very high	92.1	Very high	7 Å²	7	59.6 Å²	59.6	5%	0.049	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-63.9	150.9	178.8	-69.1	0	0	0	0	111.3	S235 Q358 E362 C373	S235-S370 PolarHBondContact OG-OG 2.79Å; S235-S370 VanDerWaalsContact OG-OG 3.13Å; Q358-S370 PolarHBondContact NE2-OG 3.37Å; E362-S370 WeakPolarHBondContact OE1-CB 3.22Å; E362-S370 PolarHBondContact OE1-OG 3.34Å; E362-S370 PolarHBondContact OE2-N 2.75Å; S370-C373 VanDerWaalsContact O-CB 3.28Å; S370-C373 WeakPolarHBondContact O-CB 3.39Å; S370-C373 PolarHBondContact O-N 2.9Å
371	P	89.3	Confident	91.8	Very high	45 Å²	45	56.9 Å²	56.9	29%	0.292	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	146.9	175.5	-17.7	30.7	0	0	0	111	L88 C373	L88-P371 HydrophobicContact CB-CG 3.71Å; L88-P371 VanDerWaalsContact O-CD 3.22Å; L88-P371 WeakPolarHBondContact O-CD 3.34Å; P371-C373 PolarHBondContact O-N 2.64Å; P371-C373 VanDerWaalsContact O-N 3.07Å
372	L	90.6	Very high	91.5	Very high	27 Å²	27	58.2 Å²	58.2	14%	0.141	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	62.5	-8.7	-168.9	-55.7	-163.6	0	0	0	117	W85 M352 F355 F356 V378	W85-L372 HydrophobicContact CZ2-CD1 3.65Å; W85-L372 HydrophobicContact CZ2-CG 4.26Å; M352-L372 HydrophobicContact CE-CB 4.32Å; M352-L372 WeakPolarHBondContact CE-O 3.35Å; F355-L372 HydrophobicContact CD2-CB 3.84Å; F355-L372 HydrophobicContact CD2-CD1 4.49Å; F355-L372 HydrophobicContact CE2-CB 4.28Å; F355-L372 HydrophobicContact CE2-CD1 4.23Å; F356-L372 WeakPolarHBondContact CE1-O 3.49Å; L372-V378 HydrophobicContact CD2-CG1 3.95Å; L372-V378 HydrophobicContact CD2-CG2 4.45Å
373	C	93.3	Very high	91.3	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-16.8	-179.1	-62.4	0	0	0	0	114.1	F355 F356 G359 V369 S370 P371 R375	F355-C373 WeakPolarHBondContact O-CA 3.31Å; F355-C373 WeakPolarHBondContact O-CB 3.33Å; F355-C373 PolarHBondContact O-SG 2.81Å; F356-C373 WeakPolarHBondContact CA-O 3.31Å; G359-C373 WeakPolarHBondContact CA-O 3.2Å; V369-C373 HydrophobicContact CG1-CB 3.92Å; S370-C373 VanDerWaalsContact O-CB 3.28Å; S370-C373 WeakPolarHBondContact O-CB 3.39Å; S370-C373 PolarHBondContact O-N 2.9Å; P371-C373 PolarHBondContact O-N 2.64Å; P371-C373 VanDerWaalsContact O-N 3.07Å; C373-R375 PolarHBondContact O-N 3.43Å
374	D	92.5	Very high	91.4	Very high	34 Å²	34	55 Å²	55	18%	0.182	32%	0.321	C	S	.	.			trans	-80.2	104.4	176.2	178.2	11.2	0	0	0	113	V369 L376 T377 V378	V369-D374 HydrophobicContact CG1-CB 3.91Å; D374-L376 PolarHBondContact O-N 2.83Å; D374-L376 VanDerWaalsContact OD1-CB 3.29Å; D374-L376 WeakPolarHBondContact OD1-CB 3.24Å; D374-L376 PolarHBondContact OD1-N 3.47Å; D374-T377 WeakPolarHBondContact CB-OG1 3.28Å; D374-T377 VanDerWaalsContact CG-OG1 3.23Å; D374-T377 PolarHBondContact O-N 3.43Å; D374-T377 WeakPolarHBondContact OD2-CB 3.48Å; D374-T377 WeakPolarHBondContact OD2-CG2 3.45Å; D374-T377 PolarHBondContact OD2-OG1 2.79Å; D374-V378 WeakPolarHBondContact O-CB 3.38Å; D374-V378 WeakPolarHBondContact O-CG2 3.47Å; D374-V378 PolarHBondContact O-N 2.63Å
375	R	93.6	Very high	91.2	Very high	92 Å²	92	50.3 Å²	50.3	35%	0.347	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-10.1	176.4	63.5	169.4	74.7	-111.9	10.3	115.5	E353 F356 D360 C373	E353-R375 IonicContact OE2-NH1 3.16Å; E353-R375 PolarHBondContact OE2-NH1 3.21Å; E353-R375 IonicContact OE2-NH2 2.73Å; F356-R375 HydrophobicContact CB-CB 3.94Å; F356-R375 VanDerWaalsContact CB-CZ 3.46Å; F356-R375 HydrophobicContact CD1-CB 3.74Å; F356-R375 HydrophobicContact CD2-CB 3.78Å; F356-R375 HydrophobicContact CE1-CB 4.11Å; F356-R375 HydrophobicContact CE2-CB 4.15Å; F356-R375 HydrophobicContact CG-CB 3.55Å; F356-R375 HydrophobicContact CZ-CB 4.3Å; D360-R375 VanDerWaalsContact CG-NE 3.35Å; D360-R375 IonicContact OD1-CZ 3.45Å; D360-R375 IonicContact OD1-NE 3.07Å; D360-R375 PolarHBondContact OD1-NE 2.86Å; D360-R375 IonicContact OD2-CZ 3.93Å; D360-R375 VanDerWaalsContact OD2-CZ 3.22Å; D360-R375 IonicContact OD2-NE 2.76Å; D360-R375 PolarHBondContact OD2-NE 3.43Å; D360-R375 IonicContact OD2-NH2 3.63Å; D360-R375 PolarHBondContact OD2-NH2 3.25Å; C373-R375 PolarHBondContact O-N 3.43Å
376	L	90.1	Very high	91.1	Very high	145 Å²	145	47.8 Å²	47.8	76%	0.759	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-28.9	-179.4	-55.2	-179.8	0	0	0	113.5	D374	D374-L376 PolarHBondContact O-N 2.83Å; D374-L376 VanDerWaalsContact OD1-CB 3.29Å; D374-L376 WeakPolarHBondContact OD1-CB 3.24Å; D374-L376 PolarHBondContact OD1-N 3.47Å
377	T	88.5	Confident	91.3	Very high	109 Å²	109	45.1 Å²	45.1	67%	0.669	25%	0.254	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.8	-22.7	-174.6	57	0	0	0	0	114.8	D374 N379	D374-T377 WeakPolarHBondContact CB-OG1 3.28Å; D374-T377 VanDerWaalsContact CG-OG1 3.23Å; D374-T377 PolarHBondContact O-N 3.43Å; D374-T377 WeakPolarHBondContact OD2-CB 3.48Å; D374-T377 WeakPolarHBondContact OD2-CG2 3.45Å; D374-T377 PolarHBondContact OD2-OG1 2.79Å; T377-N379 PolarHBondContact O-N 2.93Å
378	V	88.1	Confident	91.6	Very high	33 Å²	33	43.3 Å²	43.3	20%	0.2	24%	0.244	C	C	.	.			trans	-73.1	122.1	-170.1	171.9	0	0	0	0	113	M352 F356 L372 D374 I380	M352-V378 HydrophobicContact CE-CG1 3.77Å; F356-V378 HydrophobicContact CE1-CB 4.17Å; F356-V378 HydrophobicContact CE1-CG1 4.4Å; F356-V378 HydrophobicContact CE1-CG2 4.48Å; F356-V378 HydrophobicContact CZ-CB 4.5Å; L372-V378 HydrophobicContact CD2-CG1 3.95Å; L372-V378 HydrophobicContact CD2-CG2 4.45Å; D374-V378 WeakPolarHBondContact O-CB 3.38Å; D374-V378 WeakPolarHBondContact O-CG2 3.47Å; D374-V378 PolarHBondContact O-N 2.63Å; V378-I380 HydrophobicContact CG1-CG1 4.49Å; V378-I380 PolarHBondContact O-N 2.94Å
379	N	90.1	Very high	91.7	Very high	67 Å²	67	41.2 Å²	41.2	36%	0.358	23%	0.228	S	C	.	.			trans	-84.2	100.2	161.9	-172.3	-2.1	0	0	0	109.9	T377 A381 D382 S383	T377-N379 PolarHBondContact O-N 2.93Å; N379-A381 VanDerWaalsContact C-N 3.26Å; N379-A381 PolarHBondContact O-N 3.42Å; N379-A381 PolarHBondContact OD1-N 3.23Å; N379-A381 VanDerWaalsContact OD1-N 3.16Å; N379-D382 HydrophobicContact CB-CB 4.14Å; N379-D382 PolarHBondContact ND2-OD1 3.22Å; N379-D382 PolarHBondContact ND2-OD2 3.38Å; N379-D382 PolarHBondContact O-N 3.1Å; N379-S383 PolarHBondContact O-N 3.07Å; N379-S383 VanDerWaalsContact O-N 3.12Å
380	I	91.3	Very high	91.7	Very high	29 Å²	29	42 Å²	42	15%	0.149	23%	0.228	C	C	.	.	H	α-helix	trans	-51.3	-47.3	177.9	-60.6	175.5	0	0	0	110.6	T348 M352 F356 V378 S383 Q384 W449	T348-I380 HydrophobicContact CG2-CG2 3.68Å; M352-I380 HydrophobicContact CB-CD1 4.22Å; M352-I380 HydrophobicContact CE-CG1 4.31Å; M352-I380 HydrophobicContact CG-CB 4.5Å; M352-I380 HydrophobicContact CG-CD1 4.02Å; M352-I380 HydrophobicContact CG-CG1 3.95Å; M352-I380 HydrophobicContact CG-CG2 3.87Å; M352-I380 HydrophobicContact SD-CG1 4.47Å; F356-I380 HydrophobicContact CE2-CD1 4.34Å; F356-I380 HydrophobicContact CZ-CD1 4.27Å; F356-I380 HydrophobicContact CZ-CG1 4.32Å; V378-I380 HydrophobicContact CG1-CG1 4.49Å; V378-I380 PolarHBondContact O-N 2.94Å; I380-S383 PolarHBondContact O-N 2.91Å; I380-S383 PolarHBondContact O-OG 3.18Å; I380-Q384 HydrophobicContact CG2-CG 4.26Å; I380-Q384 WeakPolarHBondContact O-CG 3.44Å; I380-Q384 PolarHBondContact O-N 3.39Å; I380-W449 HydrophobicContact CG2-CH2 4.14Å; I380-W449 HydrophobicContact CG2-CZ3 4.25Å
381	A	92.1	Very high	91.8	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-70.4	-38	-172	0	0	0	0	0	113.3	N379 S383 Q384 V385 W449 Y452 I453	N379-A381 VanDerWaalsContact C-N 3.26Å; N379-A381 PolarHBondContact O-N 3.42Å; N379-A381 PolarHBondContact OD1-N 3.23Å; N379-A381 VanDerWaalsContact OD1-N 3.16Å; A381-S383 VanDerWaalsContact C-N 3.34Å; A381-Q384 PolarHBondContact O-N 2.98Å; A381-V385 WeakPolarHBondContact O-CG2 3.32Å; A381-V385 PolarHBondContact O-N 3.41Å; A381-W449 HydrophobicContact CB-CB 4.36Å; A381-W449 HydrophobicContact CB-CD2 4.26Å; A381-W449 HydrophobicContact CB-CE3 3.51Å; A381-W449 HydrophobicContact CB-CZ3 4.19Å; A381-Y452 HydrophobicContact CB-CD1 3.95Å; A381-I453 HydrophobicContact CB-CD1 3.84Å; A381-I453 HydrophobicContact CB-CG1 3.42Å; A381-I453 VanDerWaalsContact CB-CG1 3.42Å
382	D	89.7	Confident	92.1	Very high	88 Å²	88	39.6 Å²	39.6	47%	0.471	21%	0.212	S	C	.	.	H	α-helix	trans	-63.5	-42.2	172.2	-68	-14.2	0	0	0	110.5	N379 Q384 V385 A386 I453	N379-D382 HydrophobicContact CB-CB 4.14Å; N379-D382 PolarHBondContact ND2-OD1 3.22Å; N379-D382 PolarHBondContact ND2-OD2 3.38Å; N379-D382 PolarHBondContact O-N 3.1Å; D382-Q384 VanDerWaalsContact C-N 3.34Å; D382-Q384 PolarHBondContact O-N 2.7Å; D382-V385 PolarHBondContact O-N 3.05Å; D382-A386 PolarHBondContact O-N 3.1Å; D382-I453 WeakPolarHBondContact OD1-CD1 3.29Å
383	S	91.4	Very high	92.4	Very high	14 Å²	14	40.9 Å²	40.9	10%	0.098	22%	0.217	C	C	.	.	H	α-helix	trans	-63.6	-37.5	178.7	79.4	0	0	0	0	112.7	N379 I380 A381 A386 F387	N379-S383 PolarHBondContact O-N 3.07Å; N379-S383 VanDerWaalsContact O-N 3.12Å; I380-S383 PolarHBondContact O-N 2.91Å; I380-S383 PolarHBondContact O-OG 3.18Å; A381-S383 VanDerWaalsContact C-N 3.34Å; S383-A386 PolarHBondContact O-N 3.48Å; S383-F387 WeakPolarHBondContact O-CB 3.23Å; S383-F387 PolarHBondContact O-N 3.17Å
384	Q	95.4	Very high	92.5	Very high	6 Å²	6	43 Å²	43	3%	0.028	23%	0.231	C	C	.	.	H	α-helix	trans	-75	-33.6	177.5	-63.3	-62.8	-87.1	0	0	112.5	T348 I380 A381 D382 F387 I388 W449	T348-Q384 VanDerWaalsContact CG2-CD 3.48Å; T348-Q384 HydrophobicContact CG2-CG 3.61Å; T348-Q384 VanDerWaalsContact CG2-OE1 3.31Å; T348-Q384 PolarHBondContact OG1-OE1 2.7Å; I380-Q384 HydrophobicContact CG2-CG 4.26Å; I380-Q384 WeakPolarHBondContact O-CG 3.44Å; I380-Q384 PolarHBondContact O-N 3.39Å; A381-Q384 PolarHBondContact O-N 2.98Å; D382-Q384 VanDerWaalsContact C-N 3.34Å; D382-Q384 PolarHBondContact O-N 2.7Å; Q384-F387 PolarHBondContact O-N 3.3Å; Q384-I388 WeakPolarHBondContact O-CB 3.47Å; Q384-I388 VanDerWaalsContact O-CG1 3.27Å; Q384-I388 WeakPolarHBondContact O-CG1 3.3Å; Q384-I388 PolarHBondContact O-N 3.42Å; Q384-W449 HydrophobicContact CB-CD2 4.03Å; Q384-W449 HydrophobicContact CB-CG 4.17Å; Q384-W449 HydrophobicContact CB-CZ2 4.1Å; Q384-W449 HydrophobicContact CG-CD2 4.46Å; Q384-W449 HydrophobicContact CG-CH2 4.32Å; Q384-W449 HydrophobicContact CG-CZ2 3.75Å
385	V	92.1	Very high	92.7	Very high	18 Å²	18	41.4 Å²	41.4	11%	0.109	22%	0.222	C	C	.	.	H	α-helix	trans	-63.9	-45.2	170.2	171.5	0	0	0	0	110.2	A381 D382 F387 I388 D389 W449 K450	A381-V385 WeakPolarHBondContact O-CG2 3.32Å; A381-V385 PolarHBondContact O-N 3.41Å; D382-V385 PolarHBondContact O-N 3.05Å; V385-F387 PolarHBondContact O-N 3.32Å; V385-I388 PolarHBondContact O-N 2.89Å; V385-D389 WeakPolarHBondContact CG1-OD2 3.46Å; V385-D389 VanDerWaalsContact O-CB 3.29Å; V385-D389 WeakPolarHBondContact O-CB 3.42Å; V385-D389 PolarHBondContact O-N 3.34Å; V385-W449 HydrophobicContact CG2-CB 3.62Å; V385-W449 HydrophobicContact CG2-CG 4.42Å; V385-K450 HydrophobicContact CG2-CG 4.38Å
386	A	90.3	Very high	92.9	Very high	36 Å²	36	37 Å²	37	30%	0.298	21%	0.206	S	C	.	.	H	α-helix	trans	-62.4	-42.4	175.5	0	0	0	0	0	112.5	D382 S383 I388 D389 F390	D382-A386 PolarHBondContact O-N 3.1Å; S383-A386 PolarHBondContact O-N 3.48Å; A386-I388 PolarHBondContact O-N 3.19Å; A386-D389 PolarHBondContact O-N 3.4Å; A386-F390 HydrophobicContact CB-CD2 4.15Å; A386-F390 HydrophobicContact CB-CE2 4.32Å; A386-F390 WeakPolarHBondContact O-CB 3.43Å; A386-F390 VanDerWaalsContact O-CD2 3.25Å; A386-F390 WeakPolarHBondContact O-CD2 3.32Å; A386-F390 PolarHBondContact O-N 2.95Å
387	F	94.7	Very high	93.1	Very high	14 Å²	14	33.5 Å²	33.5	6%	0.061	19%	0.187	C	C	.	.	H	α-helix	trans	-63.7	-39.1	176.4	-172.1	-118.9	0	0	0	112.3	W85 M299 I334 P337 S383 Q384 V385 I391 V392	W85-F387 HydrophobicContact CH2-CD2 4.1Å; M299-F387 HydrophobicContact CE-CE2 4.48Å; I334-F387 HydrophobicContact CB-CZ 4.01Å; I334-F387 HydrophobicContact CD1-CZ 4.19Å; I334-F387 HydrophobicContact CG2-CZ 4.14Å; P337-F387 HydrophobicContact CG-CD1 3.96Å; P337-F387 HydrophobicContact CG-CE1 3.92Å; S383-F387 WeakPolarHBondContact O-CB 3.23Å; S383-F387 PolarHBondContact O-N 3.17Å; Q384-F387 PolarHBondContact O-N 3.3Å; V385-F387 PolarHBondContact O-N 3.32Å; F387-I391 HydrophobicContact CD2-CB 3.88Å; F387-I391 HydrophobicContact CD2-CG1 3.74Å; F387-I391 HydrophobicContact CD2-CG2 4.26Å; F387-I391 HydrophobicContact CE2-CB 3.96Å; F387-I391 HydrophobicContact CE2-CG1 4.06Å; F387-I391 HydrophobicContact CE2-CG2 3.81Å; F387-I391 HydrophobicContact CZ-CG2 4.42Å; F387-I391 WeakPolarHBondContact O-CA 3.45Å; F387-I391 VanDerWaalsContact O-CB 3.3Å; F387-I391 WeakPolarHBondContact O-CB 3.23Å; F387-I391 PolarHBondContact O-N 3.48Å; F387-I391 VanDerWaalsContact O-N 3.13Å; F387-V392 HydrophobicContact CD1-CG2 3.77Å; F387-V392 HydrophobicContact CE1-CG2 3.51Å; F387-V392 HydrophobicContact CE2-CG2 4.5Å; F387-V392 HydrophobicContact CG-CG2 4.38Å; F387-V392 HydrophobicContact CZ-CG2 3.91Å; F387-V392 PolarHBondContact O-N 2.93Å
388	I	95.1	Very high	93.5	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	16%	0.155	C	C	.	.	I	π-helix	trans	-63.9	-51	171.6	-75.1	166.9	0	0	0	111.1	P337 Q384 V385 A386 E393 I442 N445 R446	P337-I388 HydrophobicContact CB-CD1 4.14Å; P337-I388 HydrophobicContact CB-CG1 3.69Å; Q384-I388 WeakPolarHBondContact O-CB 3.47Å; Q384-I388 VanDerWaalsContact O-CG1 3.27Å; Q384-I388 WeakPolarHBondContact O-CG1 3.3Å; Q384-I388 PolarHBondContact O-N 3.42Å; V385-I388 PolarHBondContact O-N 2.89Å; A386-I388 PolarHBondContact O-N 3.19Å; I388-E393 WeakPolarHBondContact O-CB 3.41Å; I388-E393 PolarHBondContact O-N 3.43Å; I388-I442 HydrophobicContact CG2-CG2 3.53Å; I388-N445 HydrophobicContact CD1-CB 4.4Å; I388-R446 HydrophobicContact CG2-CB 4.45Å
389	D	92.2	Very high	93.8	Very high	52 Å²	52	26.7 Å²	26.7	28%	0.278	15%	0.145	S	C	.	.	I	π-helix	trans	-71.9	-33.8	-169	-68.7	1.6	0	0	0	112.6	V385 A386 R446	V385-D389 WeakPolarHBondContact CG1-OD2 3.46Å; V385-D389 VanDerWaalsContact O-CB 3.29Å; V385-D389 WeakPolarHBondContact O-CB 3.42Å; V385-D389 PolarHBondContact O-N 3.34Å; A386-D389 PolarHBondContact O-N 3.4Å; D389-R446 IonicContact OD1-CZ 3.38Å; D389-R446 IonicContact OD1-NE 3.18Å; D389-R446 PolarHBondContact OD1-NE 2.92Å; D389-R446 IonicContact OD1-NH2 2.7Å; D389-R446 PolarHBondContact OD1-NH2 2.92Å
390	F	92.2	Very high	93.9	Very high	67 Å²	67	24 Å²	24	29%	0.294	13%	0.131	S	C	.	.	I	π-helix	trans	-106.7	-24.2	-175.8	-59.4	-63.5	0	0	0	115.6	P79 V82 A386	P79-F390 HydrophobicContact CG-CE1 4.25Å; V82-F390 HydrophobicContact CG1-CB 3.93Å; V82-F390 HydrophobicContact CG1-CD2 4.4Å; V82-F390 HydrophobicContact CG1-CG 4.27Å; V82-F390 HydrophobicContact CG2-CD2 3.78Å; V82-F390 HydrophobicContact CG2-CE2 4.03Å; V82-F390 HydrophobicContact CG2-CG 4.08Å; A386-F390 HydrophobicContact CB-CD2 4.15Å; A386-F390 HydrophobicContact CB-CE2 4.32Å; A386-F390 WeakPolarHBondContact O-CB 3.43Å; A386-F390 VanDerWaalsContact O-CD2 3.25Å; A386-F390 WeakPolarHBondContact O-CD2 3.32Å; A386-F390 PolarHBondContact O-N 2.95Å
391	I	94.5	Very high	94	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.143	C	C	.	.	I	π-helix	trans	-112.3	-63.4	-175.7	-49.5	-53.2	0	0	0	110.4	V82 L86 M299 H302 F303 I334 F387 M395	V82-I391 HydrophobicContact CG1-CD1 4.36Å; L86-I391 HydrophobicContact CD1-CD1 3.7Å; L86-I391 HydrophobicContact CG-CD1 4.27Å; M299-I391 HydrophobicContact CE-CG2 4.09Å; H302-I391 VanDerWaalsContact CE1-CG2 3.5Å; H302-I391 WeakPolarHBondContact CE1-CG2 3.17Å; F303-I391 HydrophobicContact CE1-CD1 3.89Å; F303-I391 HydrophobicContact CZ-CD1 3.63Å; I334-I391 HydrophobicContact CD1-CG2 3.7Å; F387-I391 HydrophobicContact CD2-CB 3.88Å; F387-I391 HydrophobicContact CD2-CG1 3.74Å; F387-I391 HydrophobicContact CD2-CG2 4.26Å; F387-I391 HydrophobicContact CE2-CB 3.96Å; F387-I391 HydrophobicContact CE2-CG1 4.06Å; F387-I391 HydrophobicContact CE2-CG2 3.81Å; F387-I391 HydrophobicContact CZ-CG2 4.42Å; F387-I391 WeakPolarHBondContact O-CA 3.45Å; F387-I391 VanDerWaalsContact O-CB 3.3Å; F387-I391 WeakPolarHBondContact O-CB 3.23Å; F387-I391 PolarHBondContact O-N 3.48Å; F387-I391 VanDerWaalsContact O-N 3.13Å; I391-M395 WeakPolarHBondContact O-CB 3.43Å; I391-M395 PolarHBondContact O-N 3.32Å; I391-M395 VanDerWaalsContact O-N 3.07Å
392	V	96.7	Very high	94	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.143	C	C	.	.	I	π-helix	trans	-78.5	-41.5	-164.5	-179.1	0	0	0	0	112.9	I334 P337 F387 M395 M396 I442	I334-V392 HydrophobicContact CD1-CG2 4.49Å; P337-V392 HydrophobicContact CB-CG1 4.24Å; P337-V392 HydrophobicContact CB-CG2 4.47Å; P337-V392 HydrophobicContact CG-CG1 4.38Å; P337-V392 HydrophobicContact CG-CG2 3.93Å; F387-V392 HydrophobicContact CD1-CG2 3.77Å; F387-V392 HydrophobicContact CE1-CG2 3.51Å; F387-V392 HydrophobicContact CE2-CG2 4.5Å; F387-V392 HydrophobicContact CG-CG2 4.38Å; F387-V392 HydrophobicContact CZ-CG2 3.91Å; F387-V392 PolarHBondContact O-N 2.93Å; V392-M395 PolarHBondContact O-N 2.87Å; V392-M396 HydrophobicContact CG1-CG 3.97Å; V392-M396 VanDerWaalsContact O-CB 3.3Å; V392-M396 WeakPolarHBondContact O-CB 3.43Å; V392-M396 WeakPolarHBondContact O-CG 3.29Å; V392-M396 PolarHBondContact O-N 3.49Å; V392-I442 HydrophobicContact CG1-CD1 4.14Å
393	E	95.8	Very high	94	Very high	55 Å²	55	22.4 Å²	22.4	26%	0.257	12%	0.121	S	C	.	.	H	α-helix	trans	-65.1	-46.7	176.7	-164.9	173.6	-114	0	0	112.1	I388 M395 M396 I397 I442 R446	I388-E393 WeakPolarHBondContact O-CB 3.41Å; I388-E393 PolarHBondContact O-N 3.43Å; E393-M395 PolarHBondContact O-N 3.01Å; E393-M396 PolarHBondContact O-N 3.46Å; E393-I397 HydrophobicContact CG-CD1 4.28Å; E393-I397 VanDerWaalsContact O-CG1 3.3Å; E393-I397 WeakPolarHBondContact O-CG1 3.3Å; E393-I397 PolarHBondContact O-N 3.4Å; E393-I442 HydrophobicContact CB-CD1 4.42Å; E393-I442 HydrophobicContact CB-CG2 4.11Å; E393-I442 HydrophobicContact CG-CG2 4.12Å; E393-I442 WeakPolarHBondContact OE1-CG2 3.28Å; E393-R446 VanDerWaalsContact CD-NH1 3.31Å; E393-R446 VanDerWaalsContact CD-NH2 3.27Å; E393-R446 IonicContact OE1-CZ 2.62Å; E393-R446 IonicContact OE1-NH1 2.74Å; E393-R446 PolarHBondContact OE1-NH1 3.41Å; E393-R446 IonicContact OE1-NH2 3.13Å; E393-R446 PolarHBondContact OE1-NH2 2.97Å; E393-R446 IonicContact OE2-CZ 3.71Å; E393-R446 IonicContact OE2-NH1 2.77Å; E393-R446 PolarHBondContact OE2-NH1 3.22Å; E393-R446 IonicContact OE2-NH2 2.61Å; E393-R446 PolarHBondContact OE2-NH2 3.12Å
394	P	96.1	Very high	93.8	Very high	44 Å²	44	23.9 Å²	23.9	29%	0.286	13%	0.134	S	C	.	.	H	α-helix	trans	-58.8	-43.7	173.5	-26.7	37.2	0	0	0	113.6	I397 V398	P394-I397 PolarHBondContact O-N 3.38Å; P394-V398 PolarHBondContact O-N 2.9Å
395	M	97.8	Very high	93.4	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.5	-44.6	177.9	-177.1	-161.2	70.6	0	0	112.2	V306 F327 C331 I334 I391 V392 E393 I397 V398 C399	V306-M395 HydrophobicContact CG2-CG 4.49Å; F327-M395 HydrophobicContact CE2-CG 4.02Å; F327-M395 HydrophobicContact CZ-CG 3.8Å; C331-M395 HydrophobicContact CB-CE 4.14Å; C331-M395 HydrophobicContact CB-SD 4.39Å; I334-M395 HydrophobicContact CD1-CE 4.19Å; I334-M395 HydrophobicContact CD1-SD 3.69Å; I334-M395 HydrophobicContact CG1-CE 3.9Å; I334-M395 HydrophobicContact CG1-SD 3.81Å; I391-M395 WeakPolarHBondContact O-CB 3.43Å; I391-M395 PolarHBondContact O-N 3.32Å; I391-M395 VanDerWaalsContact O-N 3.07Å; V392-M395 PolarHBondContact O-N 2.87Å; E393-M395 PolarHBondContact O-N 3.01Å; M395-I397 VanDerWaalsContact C-N 3.28Å; M395-I397 PolarHBondContact O-N 3.06Å; M395-V398 PolarHBondContact O-N 3.05Å; M395-V398 VanDerWaalsContact O-N 3.17Å; M395-C399 PolarHBondContact O-N 2.88Å
396	M	96.8	Very high	93.1	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	14%	0.139	C	C	.	.	H	α-helix	trans	-71.2	-22.2	-179.2	-68	-56.8	-58.6	0	0	113.1	W126 A338 V392 E393 C399 S400 W438 I442	W126-M396 HydrophobicContact CH2-CE 3.92Å; W126-M396 HydrophobicContact CZ2-CE 4.13Å; A338-M396 HydrophobicContact CB-CG 4.31Å; V392-M396 HydrophobicContact CG1-CG 3.97Å; V392-M396 VanDerWaalsContact O-CB 3.3Å; V392-M396 WeakPolarHBondContact O-CB 3.43Å; V392-M396 WeakPolarHBondContact O-CG 3.29Å; V392-M396 PolarHBondContact O-N 3.49Å; E393-M396 PolarHBondContact O-N 3.46Å; M396-C399 HydrophobicContact CE-CB 4.46Å; M396-C399 HydrophobicContact SD-CB 4.46Å; M396-S400 PolarHBondContact O-N 3.36Å; M396-S400 PolarHBondContact O-OG 2.88Å; M396-W438 HydrophobicContact CB-CB 4.45Å; M396-W438 HydrophobicContact CB-CG 4.06Å; M396-W438 HydrophobicContact CE-CB 4.28Å; M396-W438 HydrophobicContact CE-CD2 3.27Å; M396-W438 HydrophobicContact CE-CE3 3.29Å; M396-W438 HydrophobicContact CE-CG 3.76Å; M396-W438 HydrophobicContact CE-CH2 3.96Å; M396-W438 HydrophobicContact CE-CZ2 3.94Å; M396-W438 HydrophobicContact CE-CZ3 3.63Å; M396-W438 PolarHBondContact O-NE1 3.45Å; M396-W438 VanDerWaalsContact O-NE1 3.16Å; M396-I442 HydrophobicContact CB-CD1 4.17Å; M396-I442 HydrophobicContact CG-CD1 4.16Å
397	I	95.3	Very high	92.7	Very high	70 Å²	70	24.7 Å²	24.7	36%	0.359	13%	0.13	S	C	.	.	H	α-helix	trans	-67.1	-49.9	166.6	-70	163.8	0	0	0	110.1	E393 P394 M395 C399 S400 E401	E393-I397 HydrophobicContact CG-CD1 4.28Å; E393-I397 VanDerWaalsContact O-CG1 3.3Å; E393-I397 WeakPolarHBondContact O-CG1 3.3Å; E393-I397 PolarHBondContact O-N 3.4Å; P394-I397 PolarHBondContact O-N 3.38Å; M395-I397 VanDerWaalsContact C-N 3.28Å; M395-I397 PolarHBondContact O-N 3.06Å; I397-C399 VanDerWaalsContact C-N 3.25Å; I397-C399 PolarHBondContact O-N 3.08Å; I397-S400 WeakPolarHBondContact O-CA 3.34Å; I397-S400 VanDerWaalsContact O-CB 3.27Å; I397-S400 WeakPolarHBondContact O-CB 3.4Å; I397-S400 PolarHBondContact O-N 3.21Å; I397-E401 WeakPolarHBondContact O-CG 3.35Å; I397-E401 PolarHBondContact O-N 3.26Å
398	V	95.8	Very high	92.2	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-63.2	-33.4	176.7	178.5	0	0	0	0	111.6	V306 V309 K310 I313 F327 P394 M395 E401 L402	V306-V398 HydrophobicContact CG1-CG2 4.2Å; V309-V398 HydrophobicContact CB-CG1 4.07Å; V309-V398 HydrophobicContact CG1-CG1 3.59Å; K310-V398 HydrophobicContact CD-CG2 3.98Å; K310-V398 HydrophobicContact CG-CG1 4.14Å; K310-V398 HydrophobicContact CG-CG2 3.54Å; I313-V398 HydrophobicContact CD1-CG1 3.99Å; F327-V398 HydrophobicContact CE1-CB 4.3Å; F327-V398 HydrophobicContact CE1-CG1 3.87Å; F327-V398 HydrophobicContact CZ-CB 4.03Å; F327-V398 HydrophobicContact CZ-CG1 3.8Å; P394-V398 PolarHBondContact O-N 2.9Å; M395-V398 PolarHBondContact O-N 3.05Å; M395-V398 VanDerWaalsContact O-N 3.17Å; V398-E401 PolarHBondContact O-N 3.23Å; V398-L402 WeakPolarHBondContact O-CB 2.8Å; V398-L402 PolarHBondContact O-N 3.29Å
399	C	95.1	Very high	91.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-62.5	-46	170.8	-169.5	0	0	0	0	111.6	F327 M395 M396 I397 E401 L402 L403	F327-C399 HydrophobicContact CE1-CB 4.31Å; M395-C399 PolarHBondContact O-N 2.88Å; M396-C399 HydrophobicContact CE-CB 4.46Å; M396-C399 HydrophobicContact SD-CB 4.46Å; I397-C399 VanDerWaalsContact C-N 3.25Å; I397-C399 PolarHBondContact O-N 3.08Å; C399-E401 VanDerWaalsContact C-N 3.27Å; C399-E401 PolarHBondContact O-N 3.01Å; C399-L402 PolarHBondContact O-N 3.2Å; C399-L403 WeakPolarHBondContact O-CB 3.47Å; C399-L403 WeakPolarHBondContact O-CD1 3.45Å; C399-L403 WeakPolarHBondContact O-CG 3.49Å; C399-L403 PolarHBondContact O-N 3.04Å
400	S	92.5	Very high	90.8	Very high	9 Å²	9	30 Å²	30	6%	0.063	16%	0.158	C	C	.	.	H	α-helix	trans	-55.9	-41.8	173.5	-76.7	0	0	0	0	112.5	M396 I397 A404 Q436 W438	M396-S400 PolarHBondContact O-N 3.36Å; M396-S400 PolarHBondContact O-OG 2.88Å; I397-S400 WeakPolarHBondContact O-CA 3.34Å; I397-S400 VanDerWaalsContact O-CB 3.27Å; I397-S400 WeakPolarHBondContact O-CB 3.4Å; I397-S400 PolarHBondContact O-N 3.21Å; S400-A404 WeakPolarHBondContact O-CB 3.41Å; S400-A404 PolarHBondContact O-N 3.03Å; S400-Q436 WeakPolarHBondContact OG-CG 3.26Å; S400-Q436 PolarHBondContact OG-NE2 3.21Å; S400-Q436 PolarHBondContact OG-OE1 2.84Å; S400-W438 WeakPolarHBondContact OG-CZ2 3.36Å; S400-W438 PolarHBondContact OG-NE1 3Å
401	E	92.2	Very high	90.2	Very high	85 Å²	85	29.3 Å²	29.3	40%	0.397	16%	0.157	S	C	.	.	H	α-helix	trans	-71	-44.7	-178.8	-67.1	168.3	167.3	0	0	111.9	I313 I397 V398 C399 A404 K405	I313-E401 HydrophobicContact CD1-CB 3.83Å; I313-E401 HydrophobicContact CG2-CB 4.32Å; I397-E401 WeakPolarHBondContact O-CG 3.35Å; I397-E401 PolarHBondContact O-N 3.26Å; V398-E401 PolarHBondContact O-N 3.23Å; C399-E401 VanDerWaalsContact C-N 3.27Å; C399-E401 PolarHBondContact O-N 3.01Å; E401-A404 PolarHBondContact O-N 3.02Å; E401-K405 PolarHBondContact O-N 3.47Å
402	L	92.1	Very high	89.4	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-60.2	-48.9	174.9	179.5	61.7	0	0	0	111.6	V309 I313 I319 A324 F327 L328 V398 C399 A404 K405 L406	V309-L402 HydrophobicContact CG1-CB 4.24Å; V309-L402 HydrophobicContact CG1-CD1 4.28Å; V309-L402 HydrophobicContact CG1-CD2 4.07Å; V309-L402 HydrophobicContact CG1-CG 4.42Å; I313-L402 HydrophobicContact CD1-CB 3.99Å; I313-L402 HydrophobicContact CG1-CB 4.34Å; I313-L402 HydrophobicContact CG1-CD1 4.31Å; I319-L402 HydrophobicContact CG2-CD1 4.15Å; A324-L402 HydrophobicContact CB-CD1 4.29Å; A324-L402 HydrophobicContact CB-CD2 4.2Å; F327-L402 HydrophobicContact CD1-CD2 3.78Å; L328-L402 HydrophobicContact CD2-CD2 4.35Å; L328-L402 HydrophobicContact CG-CD2 4.34Å; V398-L402 WeakPolarHBondContact O-CB 2.8Å; V398-L402 PolarHBondContact O-N 3.29Å; C399-L402 PolarHBondContact O-N 3.2Å; L402-A404 PolarHBondContact O-N 3.47Å; L402-K405 PolarHBondContact O-N 2.78Å; L402-L406 HydrophobicContact CD1-CD1 3.95Å; L402-L406 HydrophobicContact CD1-CG 4.12Å; L402-L406 HydrophobicContact CG-CD1 3.8Å; L402-L406 HydrophobicContact CG-CG 4.41Å; L402-L406 WeakPolarHBondContact O-CB 3.3Å; L402-L406 VanDerWaalsContact O-CG 3.26Å; L402-L406 WeakPolarHBondContact O-CG 3.46Å; L402-L406 PolarHBondContact O-N 3.48Å
403	L	89.9	Confident	88.5	Confident	0 Å²	0	36.9 Å²	36.9	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-58.2	-33.9	177.5	-68	170.6	0	0	0	111.5	L200 S204 L328 C399 L407 L434 W438	L200-L403 HydrophobicContact CD2-CD1 4.17Å; S204-L403 VanDerWaalsContact CB-CD2 3.4Å; L328-L403 HydrophobicContact CD2-CD2 4.05Å; C399-L403 WeakPolarHBondContact O-CB 3.47Å; C399-L403 WeakPolarHBondContact O-CD1 3.45Å; C399-L403 WeakPolarHBondContact O-CG 3.49Å; C399-L403 PolarHBondContact O-N 3.04Å; L403-L407 WeakPolarHBondContact O-CB 3.39Å; L403-L407 PolarHBondContact O-N 3.11Å; L403-L407 VanDerWaalsContact O-N 3.16Å; L403-L434 HydrophobicContact CB-CD1 3.72Å; L403-L434 HydrophobicContact CB-CD2 4.49Å; L403-L434 HydrophobicContact CB-CG 4.14Å; L403-W438 HydrophobicContact CD1-CH2 3.99Å; L403-W438 HydrophobicContact CD1-CZ2 4.26Å
404	A	87.2	Confident	87.4	Confident	45 Å²	45	36.5 Å²	36.5	37%	0.372	20%	0.203	S	C	.	.	H	α-helix	trans	-75.3	-45.8	-179.7	0	0	0	0	0	112	S400 E401 L402 L406 L407 E408 L434	S400-A404 WeakPolarHBondContact O-CB 3.41Å; S400-A404 PolarHBondContact O-N 3.03Å; E401-A404 PolarHBondContact O-N 3.02Å; L402-A404 PolarHBondContact O-N 3.47Å; A404-L406 VanDerWaalsContact C-N 3.35Å; A404-L406 PolarHBondContact O-N 3.43Å; A404-L407 PolarHBondContact O-N 3.44Å; A404-E408 WeakPolarHBondContact O-CB 3.5Å; A404-E408 PolarHBondContact O-N 3.21Å; A404-L434 HydrophobicContact CB-CD1 3.75Å; A404-L434 VanDerWaalsContact N-CD1 3.3Å
405	K	86.8	Confident	86.3	Confident	43 Å²	43	41.1 Å²	41.1	19%	0.187	22%	0.22	C	C	.	.	H	α-helix	trans	-60.8	-41.5	175.6	179	70.6	174.6	-132.3	0	112.2	I313 S315 I319 E401 L402 E408 T409	I313-K405 HydrophobicContact CG2-CB 4.35Å; I313-K405 PolarHBondContact O-NZ 3.2Å; S315-K405 PolarHBondContact O-NZ 2.66Å; I319-K405 HydrophobicContact CD1-CG 3.82Å; I319-K405 HydrophobicContact CG1-CG 4Å; E401-K405 PolarHBondContact O-N 3.47Å; L402-K405 PolarHBondContact O-N 2.78Å; K405-E408 PolarHBondContact O-N 2.92Å; K405-T409 PolarHBondContact O-N 3.48Å; K405-T409 PolarHBondContact O-OG1 3.18Å
406	L	86	Confident	85.2	Confident	13 Å²	13	47.6 Å²	47.6	7%	0.068	26%	0.255	C	S	.	.	H	α-helix	trans	-63.7	-45.8	175.5	-74.8	170.4	0	0	0	112.1	L206 I319 L402 A404 T409 L410	L206-L406 HydrophobicContact CD1-CD1 3.82Å; L206-L406 HydrophobicContact CD2-CD1 4.06Å; L206-L406 HydrophobicContact CD2-CD2 3.75Å; L206-L406 HydrophobicContact CD2-CG 4.41Å; L206-L406 HydrophobicContact CG-CD1 3.9Å; L206-L406 HydrophobicContact CG-CD2 4.45Å; I319-L406 HydrophobicContact CB-CD2 4.08Å; I319-L406 HydrophobicContact CG1-CD2 4.35Å; I319-L406 HydrophobicContact CG2-CD2 3.71Å; I319-L406 HydrophobicContact CG2-CG 4.49Å; L402-L406 HydrophobicContact CD1-CD1 3.95Å; L402-L406 HydrophobicContact CD1-CG 4.12Å; L402-L406 HydrophobicContact CG-CD1 3.8Å; L402-L406 HydrophobicContact CG-CG 4.41Å; L402-L406 WeakPolarHBondContact O-CB 3.3Å; L402-L406 VanDerWaalsContact O-CG 3.26Å; L402-L406 WeakPolarHBondContact O-CG 3.46Å; L402-L406 PolarHBondContact O-N 3.48Å; A404-L406 VanDerWaalsContact C-N 3.35Å; A404-L406 PolarHBondContact O-N 3.43Å; L406-T409 PolarHBondContact O-N 3.06Å; L406-L410 PolarHBondContact O-N 3.25Å; L406-L410 VanDerWaalsContact O-N 3.13Å
407	L	82.9	Confident	83.9	Confident	20 Å²	20	49.3 Å²	49.3	11%	0.105	27%	0.267	C	S	.	.	H	α-helix	trans	-63.2	-43.7	175.5	-179.2	59.1	0	0	0	110.9	S204 L403 A404 T409 L410 L411 F432	S204-L407 PolarHBondContact O-N 3.02Å; L403-L407 WeakPolarHBondContact O-CB 3.39Å; L403-L407 PolarHBondContact O-N 3.11Å; L403-L407 VanDerWaalsContact O-N 3.16Å; A404-L407 PolarHBondContact O-N 3.44Å; L407-T409 PolarHBondContact O-N 3.01Å; L407-L410 WeakPolarHBondContact O-CB 3.36Å; L407-L410 PolarHBondContact O-N 3.34Å; L407-L411 WeakPolarHBondContact O-CG 3.35Å; L407-L411 PolarHBondContact O-N 3.49Å; L407-F432 HydrophobicContact CD1-CB 3.77Å; L407-F432 HydrophobicContact CD1-CD2 4.09Å; L407-F432 HydrophobicContact CD1-CG 3.89Å; L407-F432 HydrophobicContact CD2-CB 4.11Å
408	E	82.6	Confident	82.3	Confident	103 Å²	103	54.2 Å²	54.2	48%	0.481	29%	0.294	S	S	.	.	H	α-helix	trans	-58.4	-45.2	176.8	-171.5	-178.7	175.6	0	0	112.1	A404 K405 L410 L411 Q412	A404-E408 WeakPolarHBondContact O-CB 3.5Å; A404-E408 PolarHBondContact O-N 3.21Å; K405-E408 PolarHBondContact O-N 2.92Å; E408-L410 VanDerWaalsContact C-N 3.31Å; E408-L410 PolarHBondContact O-N 2.99Å; E408-L411 WeakPolarHBondContact O-CB 3.46Å; E408-L411 PolarHBondContact O-N 2.83Å; E408-L411 VanDerWaalsContact O-N 3.1Å; E408-Q412 HydrophobicContact CG-CG 4.48Å; E408-Q412 WeakPolarHBondContact O-CG 3.34Å; E408-Q412 PolarHBondContact O-N 3.07Å; E408-Q412 PolarHBondContact OE1-NE2 3.28Å
409	T	80.1	Confident	80.5	Confident	61 Å²	61	57.7 Å²	57.7	37%	0.374	32%	0.316	S	S	.	.	H	α-helix	trans	-59.7	-42	177.1	-53.5	0	0	0	0	111.4	K405 L406 L407 Q412 A413	K405-T409 PolarHBondContact O-N 3.48Å; K405-T409 PolarHBondContact O-OG1 3.18Å; L406-T409 PolarHBondContact O-N 3.06Å; L407-T409 PolarHBondContact O-N 3.01Å; T409-Q412 PolarHBondContact O-N 3.09Å; T409-A413 WeakPolarHBondContact O-CB 3.34Å; T409-A413 PolarHBondContact O-N 3.21Å
410	L	79.1	Confident	78.6	Confident	14 Å²	14	66.4 Å²	66.4	7%	0.073	36%	0.362	C	S	.	.	H	α-helix	trans	-63.6	-40.7	173.7	175.3	60.9	0	0	0	112.3	E208 L406 L407 E408 A413 L414 F432	E208-L410 HydrophobicContact CB-CD1 4.23Å; E208-L410 HydrophobicContact CB-CD2 4.4Å; L406-L410 PolarHBondContact O-N 3.25Å; L406-L410 VanDerWaalsContact O-N 3.13Å; L407-L410 WeakPolarHBondContact O-CB 3.36Å; L407-L410 PolarHBondContact O-N 3.34Å; E408-L410 VanDerWaalsContact C-N 3.31Å; E408-L410 PolarHBondContact O-N 2.99Å; L410-A413 PolarHBondContact O-N 3.4Å; L410-L414 HydrophobicContact CD1-CD1 3.99Å; L410-L414 HydrophobicContact CD1-CG 4.18Å; L410-L414 HydrophobicContact CG-CD1 4.03Å; L410-L414 VanDerWaalsContact O-CG 3.32Å; L410-L414 WeakPolarHBondContact O-CG 3.43Å; L410-L414 PolarHBondContact O-N 2.89Å; L410-F432 HydrophobicContact CD2-CE2 4.3Å; L410-F432 HydrophobicContact CD2-CZ 4.44Å
411	L	78.1	Confident	76.9	Confident	53 Å²	53	69.1 Å²	69.1	28%	0.277	38%	0.376	S	S	.	.	H	α-helix	trans	-62.6	-47.2	176.4	-64.3	-176.3	0	0	0	111.5	L407 E408 A413 L414 E415 V429	L407-L411 WeakPolarHBondContact O-CG 3.35Å; L407-L411 PolarHBondContact O-N 3.49Å; E408-L411 WeakPolarHBondContact O-CB 3.46Å; E408-L411 PolarHBondContact O-N 2.83Å; E408-L411 VanDerWaalsContact O-N 3.1Å; L411-A413 VanDerWaalsContact C-N 3.33Å; L411-A413 PolarHBondContact O-N 3.49Å; L411-L414 PolarHBondContact O-N 3.35Å; L411-E415 WeakPolarHBondContact O-CG 3.46Å; L411-E415 PolarHBondContact O-N 3.41Å; L411-V429 HydrophobicContact CD2-CB 3.99Å; L411-V429 HydrophobicContact CD2-CG1 3.47Å; L411-V429 VanDerWaalsContact CD2-CG1 3.47Å; L411-V429 HydrophobicContact CD2-CG2 3.3Å
412	Q	79.1	Confident	75	Confident	96 Å²	96	72.6 Å²	72.6	45%	0.449	39%	0.386	S	S	.	.	H	α-helix	trans	-62.1	-39.9	177.4	-66.3	176.8	11.7	0	0	111.6	E408 T409 E415 N416	E408-Q412 HydrophobicContact CG-CG 4.48Å; E408-Q412 WeakPolarHBondContact O-CG 3.34Å; E408-Q412 PolarHBondContact O-N 3.07Å; E408-Q412 PolarHBondContact OE1-NE2 3.28Å; T409-Q412 PolarHBondContact O-N 3.09Å; Q412-E415 PolarHBondContact O-N 3.47Å; Q412-N416 WeakPolarHBondContact O-CB 3.25Å; Q412-N416 PolarHBondContact O-N 3.43Å; Q412-N416 VanDerWaalsContact O-N 3.1Å; Q412-N416 PolarHBondContact O-ND2 3.47Å
413	A	76.9	Confident	73.2	Confident	62 Å²	62	77.3 Å²	77.3	51%	0.512	42%	0.419	S	S	.	.	H	α-helix	trans	-64.5	-39.3	175.5	0	0	0	0	0	112.7	T409 L410 L411 S417	T409-A413 WeakPolarHBondContact O-CB 3.34Å; T409-A413 PolarHBondContact O-N 3.21Å; L410-A413 PolarHBondContact O-N 3.4Å; L411-A413 VanDerWaalsContact C-N 3.33Å; L411-A413 PolarHBondContact O-N 3.49Å; A413-S417 PolarHBondContact O-N 3Å
414	L	73.3	Confident	71.6	Confident	48 Å²	48	83.9 Å²	83.9	25%	0.251	45%	0.447	S	S	.	.	H	α-helix	trans	-69.5	-43.1	175.5	-70.8	165.8	0	0	0	112	L410 L411 N416 S417 Q425 V429	L410-L414 HydrophobicContact CD1-CD1 3.99Å; L410-L414 HydrophobicContact CD1-CG 4.18Å; L410-L414 HydrophobicContact CG-CD1 4.03Å; L410-L414 VanDerWaalsContact O-CG 3.32Å; L410-L414 WeakPolarHBondContact O-CG 3.43Å; L410-L414 PolarHBondContact O-N 2.89Å; L411-L414 PolarHBondContact O-N 3.35Å; L414-N416 VanDerWaalsContact C-N 3.29Å; L414-N416 PolarHBondContact O-N 3.15Å; L414-S417 WeakPolarHBondContact O-CB 3.34Å; L414-S417 PolarHBondContact O-N 2.94Å; L414-S417 PolarHBondContact O-OG 3.28Å; L414-Q425 HydrophobicContact CD2-CG 4.39Å; L414-V429 HydrophobicContact CD1-CG2 4.27Å
415	E	73	Confident	69.9	Low	140 Å²	140	83.5 Å²	83.5	65%	0.654	44%	0.438	S	S	*	.	H	α-helix	trans	-64.9	-30.9	179.1	-75.2	-168.9	173.5	0	0	113.5	L411 Q412 S417	L411-E415 WeakPolarHBondContact O-CG 3.46Å; L411-E415 PolarHBondContact O-N 3.41Å; Q412-E415 PolarHBondContact O-N 3.47Å; E415-S417 VanDerWaalsContact C-N 3.31Å
416	N	73.5	Confident	68.2	Low	136 Å²	136	86.2 Å²	86.2	73%	0.727	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.4	-8.7	173.1	-73.9	-52.1	0	0	0	113.7	Q412 L414 D418	Q412-N416 WeakPolarHBondContact O-CB 3.25Å; Q412-N416 PolarHBondContact O-N 3.43Å; Q412-N416 VanDerWaalsContact O-N 3.1Å; Q412-N416 PolarHBondContact O-ND2 3.47Å; L414-N416 VanDerWaalsContact C-N 3.29Å; L414-N416 PolarHBondContact O-N 3.15Å; N416-D418 PolarHBondContact O-N 2.96Å
417	S	70.3	Confident	66.6	Low	37 Å²	37	88.4 Å²	88.4	26%	0.259	47%	0.473	S	S	.	.			trans	-78.4	111.9	175.3	76.4	0	0	0	0	110.3	A413 L414 E415 T419 Q425	A413-S417 PolarHBondContact O-N 3Å; L414-S417 WeakPolarHBondContact O-CB 3.34Å; L414-S417 PolarHBondContact O-N 2.94Å; L414-S417 PolarHBondContact O-OG 3.28Å; E415-S417 VanDerWaalsContact C-N 3.31Å; S417-T419 PolarHBondContact O-N 3.49Å; S417-Q425 PolarHBondContact OG-NE2 2.99Å
418	D	61.6	Low	65.1	Low	174 Å²	174	89.5 Å²	89.5	93%	0.93	49%	0.485	S	S	*	.			trans	-76.5	41.7	-172.7	-152.9	16.9	0	0	0	113	N416	N416-D418 PolarHBondContact O-N 2.96Å
419	T	58.9	Low	63.5	Low	73 Å²	73	86.2 Å²	86.2	45%	0.448	47%	0.472	S	S	.	.			trans	-99.9	137.2	-173.7	68.6	0	0	0	0	111.5	S417 D421 Q425	S417-T419 PolarHBondContact O-N 3.49Å; T419-D421 PolarHBondContact O-N 3.31Å; T419-Q425 PolarHBondContact OG1-NE2 3.07Å
420	N	54.8	Low	62.1	Low	183 Å²	183	87.6 Å²	87.6	98%	0.979	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	10.2	-176.5	-101	-37.6	0	0	0	115.2
421	D	57.5	Low	60.8	Low	66 Å²	66	94.4 Å²	94.4	35%	0.353	51%	0.508	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.1	21.8	-176.2	-138.9	-8.6	0	0	0	113.3	T419 S423 K424 Q425	T419-D421 PolarHBondContact O-N 3.31Å; D421-S423 PolarHBondContact O-N 3.34Å; D421-K424 PolarHBondContact O-N 3.27Å; D421-K424 WeakPolarHBondContact OD1-CD 3.3Å; D421-K424 WeakPolarHBondContact OD1-CE 3.48Å; D421-K424 VanDerWaalsContact OD1-CG 3.23Å; D421-K424 WeakPolarHBondContact OD1-CG 3.49Å; D421-K424 IonicContact OD1-NZ 2.71Å; D421-K424 PolarHBondContact OD1-NZ 2.83Å; D421-K424 WeakPolarHBondContact OD2-CD 3.42Å; D421-K424 IonicContact OD2-NZ 2.68Å; D421-K424 PolarHBondContact OD2-NZ 3.34Å; D421-Q425 PolarHBondContact O-N 3.33Å; D421-Q425 VanDerWaalsContact O-N 3.15Å
422	R	50.9	Low	59.7	Low	158 Å²	158	94.1 Å²	94.1	60%	0.596	51%	0.505	S	S	*	.	H	α-helix	trans	-43.8	-36.5	178.9	-148.9	175.5	-165.2	168	8.1	113.5	Q425 I426	R422-Q425 PolarHBondContact O-N 3.41Å; R422-I426 HydrophobicContact CG-CD1 4.36Å; R422-I426 VanDerWaalsContact O-CG1 3.29Å; R422-I426 WeakPolarHBondContact O-CG1 3.34Å; R422-I426 PolarHBondContact O-N 3.01Å
423	S	55.7	Low	58.6	Low	99 Å²	99	94.8 Å²	94.8	69%	0.692	50%	0.503	S	S	*	.	H	α-helix	trans	-65.3	-38.3	176.7	-54	0	0	0	0	113.8	D421 A427	D421-S423 PolarHBondContact O-N 3.34Å; S423-A427 WeakPolarHBondContact O-CB 3.1Å; S423-A427 PolarHBondContact O-N 2.86Å
424	K	54.7	Low	58.2	Low	137 Å²	137	93.9 Å²	93.9	60%	0.596	49%	0.49	S	S	*	.	H	α-helix	trans	-77.1	-36.6	175.4	-69.2	-175.2	-150.4	135.5	0	111.7	D421 A427 A428	D421-K424 PolarHBondContact O-N 3.27Å; D421-K424 WeakPolarHBondContact OD1-CD 3.3Å; D421-K424 WeakPolarHBondContact OD1-CE 3.48Å; D421-K424 VanDerWaalsContact OD1-CG 3.23Å; D421-K424 WeakPolarHBondContact OD1-CG 3.49Å; D421-K424 IonicContact OD1-NZ 2.71Å; D421-K424 PolarHBondContact OD1-NZ 2.83Å; D421-K424 WeakPolarHBondContact OD2-CD 3.42Å; D421-K424 IonicContact OD2-NZ 2.68Å; D421-K424 PolarHBondContact OD2-NZ 3.34Å; K424-A427 PolarHBondContact O-N 2.97Å; K424-A428 PolarHBondContact O-N 3.44Å
425	Q	51.7	Low	58.6	Low	38 Å²	38	94.1 Å²	94.1	18%	0.178	50%	0.495	C	S	.	.	H	α-helix	trans	-58.4	-51.4	173.3	-69.3	177.4	-29.3	0	0	110.6	L414 S417 T419 D421 R422 A427 A428 V429	L414-Q425 HydrophobicContact CD2-CG 4.39Å; S417-Q425 PolarHBondContact OG-NE2 2.99Å; T419-Q425 PolarHBondContact OG1-NE2 3.07Å; D421-Q425 PolarHBondContact O-N 3.33Å; D421-Q425 VanDerWaalsContact O-N 3.15Å; R422-Q425 PolarHBondContact O-N 3.41Å; Q425-A427 VanDerWaalsContact C-N 3.28Å; Q425-A427 PolarHBondContact O-N 3.05Å; Q425-A428 WeakPolarHBondContact O-CB 3.32Å; Q425-A428 PolarHBondContact O-N 2.85Å; Q425-V429 WeakPolarHBondContact O-CG2 3.11Å; Q425-V429 PolarHBondContact O-N 3.4Å
426	I	50.7	Low	59.2	Low	100 Å²	100	90.8 Å²	90.8	51%	0.513	48%	0.48	S	S	.	.	H	α-helix	trans	-60.6	-36.8	176.4	-66.7	166.1	0	0	0	111.8	R422 A428 V429 D430	R422-I426 HydrophobicContact CG-CD1 4.36Å; R422-I426 VanDerWaalsContact O-CG1 3.29Å; R422-I426 WeakPolarHBondContact O-CG1 3.34Å; R422-I426 PolarHBondContact O-N 3.01Å; I426-A428 VanDerWaalsContact C-N 3.34Å; I426-A428 PolarHBondContact O-N 3.42Å; I426-V429 WeakPolarHBondContact O-CB 3.48Å; I426-V429 PolarHBondContact O-N 3.01Å; I426-D430 PolarHBondContact O-N 3.26Å
427	A	52.7	Low	60.1	Low	58 Å²	58	85.5 Å²	85.5	48%	0.479	45%	0.453	S	S	.	.	H	α-helix	trans	-70.4	-24.9	175.7	0	0	0	0	0	114.2	S423 K424 Q425	S423-A427 WeakPolarHBondContact O-CB 3.1Å; S423-A427 PolarHBondContact O-N 2.86Å; K424-A427 PolarHBondContact O-N 2.97Å; Q425-A427 VanDerWaalsContact C-N 3.28Å; Q425-A427 PolarHBondContact O-N 3.05Å
428	A	51.5	Low	61.2	Low	43 Å²	43	83.9 Å²	83.9	36%	0.355	44%	0.441	S	S	.	.	H	α-helix	trans	-76.5	-41.9	168.1	0	0	0	0	0	110.9	K424 Q425 I426 D430 Q431	K424-A428 PolarHBondContact O-N 3.44Å; Q425-A428 WeakPolarHBondContact O-CB 3.32Å; Q425-A428 PolarHBondContact O-N 2.85Å; I426-A428 VanDerWaalsContact C-N 3.34Å; I426-A428 PolarHBondContact O-N 3.42Å; A428-D430 VanDerWaalsContact C-N 3.27Å; A428-D430 PolarHBondContact O-N 3.07Å; A428-Q431 VanDerWaalsContact O-CB 3.29Å; A428-Q431 WeakPolarHBondContact O-CB 3.43Å; A428-Q431 PolarHBondContact O-N 3.24Å
429	V	50.3	Low	62.6	Low	35 Å²	35	79.7 Å²	79.7	21%	0.212	42%	0.417	C	S	.	.	H	α-helix	trans	-56	-38.7	174.5	166.4	0	0	0	0	112.5	L411 L414 Q425 I426 Q431 F432	L411-V429 HydrophobicContact CD2-CB 3.99Å; L411-V429 HydrophobicContact CD2-CG1 3.47Å; L411-V429 VanDerWaalsContact CD2-CG1 3.47Å; L411-V429 HydrophobicContact CD2-CG2 3.3Å; L414-V429 HydrophobicContact CD1-CG2 4.27Å; Q425-V429 WeakPolarHBondContact O-CG2 3.11Å; Q425-V429 PolarHBondContact O-N 3.4Å; I426-V429 WeakPolarHBondContact O-CB 3.48Å; I426-V429 PolarHBondContact O-N 3.01Å; V429-Q431 PolarHBondContact O-N 2.6Å; V429-F432 PolarHBondContact O-N 3.36Å; V429-F432 VanDerWaalsContact O-N 3.15Å
430	D	50	Low	64.3	Low	89 Å²	89	82.9 Å²	82.9	48%	0.476	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68	-12.2	176.7	-107.6	-11.9	0	0	0	114.4	K19 I426 A428	K19-D430 WeakPolarHBondContact CE-OD1 3.29Å; K19-D430 IonicContact NZ-OD1 2.96Å; K19-D430 PolarHBondContact NZ-OD1 2.75Å; I426-D430 PolarHBondContact O-N 3.26Å; A428-D430 VanDerWaalsContact C-N 3.27Å; A428-D430 PolarHBondContact O-N 3.07Å
431	Q	52.7	Low	66.3	Low	157 Å²	157	74.7 Å²	74.7	73%	0.734	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.5	-30.9	171.9	-55.3	-176.2	34.5	0	0	112.4	A428 V429 R433	A428-Q431 VanDerWaalsContact O-CB 3.29Å; A428-Q431 WeakPolarHBondContact O-CB 3.43Å; A428-Q431 PolarHBondContact O-N 3.24Å; V429-Q431 PolarHBondContact O-N 2.6Å; Q431-R433 VanDerWaalsContact C-N 3.33Å; Q431-R433 PolarHBondContact O-N 3.17Å
432	F	55.2	Low	68.2	Low	48 Å²	48	71.6 Å²	71.6	21%	0.211	36%	0.364	C	S	.	.			trans	-70.9	89.5	173.6	-63.7	-65.1	0	0	0	110.1	L407 L410 V429	L407-F432 HydrophobicContact CD1-CB 3.77Å; L407-F432 HydrophobicContact CD1-CD2 4.09Å; L407-F432 HydrophobicContact CD1-CG 3.89Å; L407-F432 HydrophobicContact CD2-CB 4.11Å; L410-F432 HydrophobicContact CD2-CE2 4.3Å; L410-F432 HydrophobicContact CD2-CZ 4.44Å; V429-F432 PolarHBondContact O-N 3.36Å; V429-F432 VanDerWaalsContact O-N 3.15Å
433	R	55.3	Low	70.3	Confident	110 Å²	110	65.5 Å²	65.5	42%	0.415	35%	0.345	S	S	.	.			trans	-95.5	117.2	159.1	-58.3	-170.3	-160.4	157.4	13.2	107.4	Y47 Q203 Q431 S435	Y47-R433 PolarHBondContact OH-NH1 3.19Å; Q203-R433 PolarHBondContact OE1-O 2.89Å; Q431-R433 VanDerWaalsContact C-N 3.33Å; Q431-R433 PolarHBondContact O-N 3.17Å; R433-S435 VanDerWaalsContact C-N 3.25Å; R433-S435 PolarHBondContact O-N 3.35Å
434	L	69.3	Low	72.3	Confident	43 Å²	43	64.2 Å²	64.2	23%	0.225	33%	0.328	C	S	.	.			trans	-72.2	87.6	169.7	-163.9	158.4	0	0	0	108.2	L403 A404 Q436	L403-L434 HydrophobicContact CB-CD1 3.72Å; L403-L434 HydrophobicContact CB-CD2 4.49Å; L403-L434 HydrophobicContact CB-CG 4.14Å; A404-L434 HydrophobicContact CB-CD1 3.75Å; A404-L434 VanDerWaalsContact N-CD1 3.3Å; L434-Q436 HydrophobicContact CD2-CG 3.53Å
435	S	80.5	Confident	74.4	Confident	52 Å²	52	57.7 Å²	57.7	36%	0.364	30%	0.3	S	S	.	.			trans	-73.1	140.7	176	-166.7	0	0	0	0	109.5	W199 R433	W199-S435 WeakPolarHBondContact CH2-O 3.41Å; R433-S435 VanDerWaalsContact C-N 3.25Å; R433-S435 PolarHBondContact O-N 3.35Å
436	Q	86.8	Confident	76.4	Confident	71 Å²	71	58 Å²	58	33%	0.332	30%	0.299	S	S	.	.			trans	-129.9	68.2	177.7	-57.5	177.5	-2.9	0	0	110.6	S400 L434 W438 M439	S400-Q436 WeakPolarHBondContact OG-CG 3.26Å; S400-Q436 PolarHBondContact OG-NE2 3.21Å; S400-Q436 PolarHBondContact OG-OE1 2.84Å; L434-Q436 HydrophobicContact CD2-CG 3.53Å; Q436-W438 HydrophobicContact CB-CD2 4.3Å; Q436-W438 HydrophobicContact CB-CZ2 3.99Å; Q436-W438 HydrophobicContact CG-CZ2 3.93Å; Q436-W438 PolarHBondContact O-N 3.29Å; Q436-W438 VanDerWaalsContact O-N 3.13Å; Q436-M439 HydrophobicContact CB-CB 4.46Å; Q436-M439 HydrophobicContact CB-CG 3.7Å; Q436-M439 WeakPolarHBondContact O-CB 3.44Å; Q436-M439 PolarHBondContact O-N 3.44Å; Q436-M439 VanDerWaalsContact O-N 3.07Å
437	P	90.7	Very high	78.5	Confident	25 Å²	25	57.7 Å²	57.7	16%	0.162	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.9	-32.7	-175.5	-26.8	36.6	0	0	0	113.7	W126 W199 M439 K440 I441	W126-P437 HydrophobicContact CB-CB 4.43Å; W126-P437 HydrophobicContact CB-CG 3.88Å; W126-P437 HydrophobicContact CG-CB 4.04Å; W126-P437 HydrophobicContact CG-CG 3.85Å; W199-P437 HydrophobicContact CH2-CG 4.08Å; W199-P437 HydrophobicContact CZ2-CG 4.17Å; P437-M439 VanDerWaalsContact C-N 3.26Å; P437-M439 PolarHBondContact O-N 2.83Å; P437-K440 PolarHBondContact O-N 3.49Å; P437-K440 VanDerWaalsContact O-N 3.14Å; P437-I441 HydrophobicContact CB-CD1 3.8Å; P437-I441 WeakPolarHBondContact O-CG1 3.16Å; P437-I441 PolarHBondContact O-N 3.39Å
438	W	94.2	Very high	80.6	Confident	2 Å²	2	58 Å²	58	1%	0.008	29%	0.288	C	S	.	.	H	α-helix	trans	-55.5	-34.4	176.2	48.2	97.6	0	0	0	114.1	W126 W199 L200 A338 M396 S400 L403 Q436 K440 I441 I442	W126-W438 HydrophobicContact CD2-CZ3 4.49Å; W126-W438 HydrophobicContact CE3-CZ3 4.35Å; W126-W438 HydrophobicContact CH2-CE3 4.1Å; W126-W438 AromaticContact CH2-CZ3 3.98Å; W126-W438 HydrophobicContact CH2-CZ3 3.98Å; W126-W438 AromaticContact CZ2-CE3 3.84Å; W126-W438 HydrophobicContact CZ2-CE3 3.84Å; W126-W438 HydrophobicContact CZ2-CZ3 4.15Å; W126-W438 HydrophobicContact CZ3-CZ3 4.08Å; W199-W438 HydrophobicContact CH2-CH2 4.29Å; W199-W438 AromaticContact CH2-CZ3 3.91Å; W199-W438 HydrophobicContact CH2-CZ3 3.91Å; W199-W438 AromaticContact CZ3-CH2 3.88Å; W199-W438 HydrophobicContact CZ3-CH2 3.88Å; W199-W438 AromaticContact CZ3-CZ3 3.54Å; W199-W438 HydrophobicContact CZ3-CZ3 3.54Å; L200-W438 HydrophobicContact CD2-CH2 4.19Å; L200-W438 HydrophobicContact CD2-CZ3 4.33Å; A338-W438 HydrophobicContact CB-CB 3.83Å; M396-W438 HydrophobicContact CB-CB 4.45Å; M396-W438 HydrophobicContact CB-CG 4.06Å; M396-W438 HydrophobicContact CE-CB 4.28Å; M396-W438 HydrophobicContact CE-CD2 3.27Å; M396-W438 HydrophobicContact CE-CE3 3.29Å; M396-W438 HydrophobicContact CE-CG 3.76Å; M396-W438 HydrophobicContact CE-CH2 3.96Å; M396-W438 HydrophobicContact CE-CZ2 3.94Å; M396-W438 HydrophobicContact CE-CZ3 3.63Å; M396-W438 PolarHBondContact O-NE1 3.45Å; M396-W438 VanDerWaalsContact O-NE1 3.16Å; S400-W438 WeakPolarHBondContact OG-CZ2 3.36Å; S400-W438 PolarHBondContact OG-NE1 3Å; L403-W438 HydrophobicContact CD1-CH2 3.99Å; L403-W438 HydrophobicContact CD1-CZ2 4.26Å; Q436-W438 HydrophobicContact CB-CD2 4.3Å; Q436-W438 HydrophobicContact CB-CZ2 3.99Å; Q436-W438 HydrophobicContact CG-CZ2 3.93Å; Q436-W438 PolarHBondContact O-N 3.29Å; Q436-W438 VanDerWaalsContact O-N 3.13Å; W438-K440 PolarHBondContact O-N 3.23Å; W438-I441 PolarHBondContact O-N 3.37Å; W438-I442 HydrophobicContact CB-CD1 3.85Å; W438-I442 HydrophobicContact CB-CG1 4.08Å; W438-I442 WeakPolarHBondContact O-CB 3.5Å; W438-I442 PolarHBondContact O-N 3.16Å
439	M	91	Very high	82.8	Confident	86 Å²	86	56 Å²	56	42%	0.424	27%	0.271	S	S	.	.	H	α-helix	trans	-61.2	-21.5	179.9	-64.3	-61.8	-72.5	0	0	113.2	Q436 P437	Q436-M439 HydrophobicContact CB-CB 4.46Å; Q436-M439 HydrophobicContact CB-CG 3.7Å; Q436-M439 WeakPolarHBondContact O-CB 3.44Å; Q436-M439 PolarHBondContact O-N 3.44Å; Q436-M439 VanDerWaalsContact O-N 3.07Å; P437-M439 VanDerWaalsContact C-N 3.26Å; P437-M439 PolarHBondContact O-N 2.83Å
440	K	93.8	Very high	84.7	Confident	141 Å²	141	59.4 Å²	59.4	61%	0.613	28%	0.283	S	S	*	.	H	α-helix	trans	-99.5	-45.6	169.1	177.5	166.7	178.3	167.4	0	112	P437 W438 P443 E444	P437-K440 PolarHBondContact O-N 3.49Å; P437-K440 VanDerWaalsContact O-N 3.14Å; W438-K440 PolarHBondContact O-N 3.23Å; K440-P443 WeakPolarHBondContact O-CD 3.37Å; K440-E444 WeakPolarHBondContact CE-OE1 3.43Å; K440-E444 WeakPolarHBondContact CG-OE1 3.34Å; K440-E444 IonicContact NZ-OE1 2.68Å; K440-E444 WeakPolarHBondContact O-CG 2.93Å; K440-E444 PolarHBondContact O-N 2.88Å
441	I	96.9	Very high	86.7	Confident	10 Å²	10	60.1 Å²	60.1	5%	0.051	28%	0.284	C	S	.	.	H	α-helix	trans	-69.6	-39.3	-170.9	-66.6	169.3	0	0	0	112.8	A338 K339 P437 W438 E444 N445	A338-I441 WeakPolarHBondContact O-CG2 3.35Å; K339-I441 VanDerWaalsContact C-CG2 3.42Å; K339-I441 VanDerWaalsContact O-CG2 3.23Å; K339-I441 WeakPolarHBondContact O-CG2 3.24Å; P437-I441 HydrophobicContact CB-CD1 3.8Å; P437-I441 WeakPolarHBondContact O-CG1 3.16Å; P437-I441 PolarHBondContact O-N 3.39Å; W438-I441 PolarHBondContact O-N 3.37Å; I441-E444 PolarHBondContact O-N 2.84Å; I441-N445 WeakPolarHBondContact CG2-ND2 3.4Å; I441-N445 WeakPolarHBondContact O-CB 3.24Å; I441-N445 PolarHBondContact O-N 3.38Å
442	I	97.3	Very high	88.4	Confident	2 Å²	2	55.3 Å²	55.3	1%	0.01	26%	0.259	C	S	.	.	H	α-helix	trans	-61.5	-50.8	-180	-71.6	179	0	0	0	110.9	A338 I388 V392 E393 M396 W438 E444 N445 R446	A338-I442 HydrophobicContact CB-CD1 4.19Å; A338-I442 HydrophobicContact CB-CG1 4.14Å; I388-I442 HydrophobicContact CG2-CG2 3.53Å; V392-I442 HydrophobicContact CG1-CD1 4.14Å; E393-I442 HydrophobicContact CB-CD1 4.42Å; E393-I442 HydrophobicContact CB-CG2 4.11Å; E393-I442 HydrophobicContact CG-CG2 4.12Å; E393-I442 WeakPolarHBondContact OE1-CG2 3.28Å; M396-I442 HydrophobicContact CB-CD1 4.17Å; M396-I442 HydrophobicContact CG-CD1 4.16Å; W438-I442 HydrophobicContact CB-CD1 3.85Å; W438-I442 HydrophobicContact CB-CG1 4.08Å; W438-I442 WeakPolarHBondContact O-CB 3.5Å; W438-I442 PolarHBondContact O-N 3.16Å; I442-E444 VanDerWaalsContact C-N 3.33Å; I442-E444 PolarHBondContact O-N 2.77Å; I442-N445 PolarHBondContact O-N 3.16Å; I442-R446 VanDerWaalsContact O-CB 3.29Å; I442-R446 WeakPolarHBondContact O-CB 3.41Å; I442-R446 PolarHBondContact O-N 2.91Å
443	P	96.2	Very high	89.8	Confident	29 Å²	29	54.2 Å²	54.2	19%	0.188	26%	0.255	C	S	.	.	H	α-helix	trans	-55.7	-40.2	171.2	-29.4	35.8	0	0	0	114.6	K440 I447	K440-P443 WeakPolarHBondContact O-CD 3.37Å; P443-I447 VanDerWaalsContact O-CG1 3.3Å; P443-I447 WeakPolarHBondContact O-CG1 3.2Å; P443-I447 PolarHBondContact O-N 3.36Å
444	E	97.3	Very high	91	Very high	72 Å²	72	51.5 Å²	51.5	34%	0.336	26%	0.256	S	S	.	.	H	α-helix	trans	-65.1	-43.5	177.2	-74.1	-179.3	-171.9	0	0	112.5	K440 I441 I442 I447 K448	K440-E444 WeakPolarHBondContact CE-OE1 3.43Å; K440-E444 WeakPolarHBondContact CG-OE1 3.34Å; K440-E444 IonicContact NZ-OE1 2.68Å; K440-E444 WeakPolarHBondContact O-CG 2.93Å; K440-E444 PolarHBondContact O-N 2.88Å; I441-E444 PolarHBondContact O-N 2.84Å; I442-E444 VanDerWaalsContact C-N 3.33Å; I442-E444 PolarHBondContact O-N 2.77Å; E444-I447 PolarHBondContact O-N 3.32Å; E444-K448 WeakPolarHBondContact O-CG 3.16Å; E444-K448 PolarHBondContact O-N 3.25Å; E444-K448 VanDerWaalsContact O-N 3.08Å
445	N	97.9	Very high	91.7	Very high	1 Å²	1	55.5 Å²	55.5	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-69.3	-39.3	178.5	-73.8	-13.4	0	0	0	111.6	P337 K339 W341 H344 I388 I441 I442 I447 K448 W449	P337-N445 PolarHBondContact O-ND2 3.25Å; K339-N445 PolarHBondContact O-ND2 2.71Å; W341-N445 WeakPolarHBondContact CA-OD1 3.49Å; W341-N445 HydrophobicContact CE3-CB 4.33Å; W341-N445 PolarHBondContact N-OD1 3.45Å; H344-N445 PolarHBondContact CD2-ND2 2.89Å; I388-N445 HydrophobicContact CD1-CB 4.4Å; I441-N445 WeakPolarHBondContact CG2-ND2 3.4Å; I441-N445 WeakPolarHBondContact O-CB 3.24Å; I441-N445 PolarHBondContact O-N 3.38Å; I442-N445 PolarHBondContact O-N 3.16Å; N445-I447 VanDerWaalsContact C-N 3.3Å; N445-I447 PolarHBondContact O-N 2.88Å; N445-K448 PolarHBondContact O-N 3.28Å; N445-W449 PolarHBondContact O-N 3.21Å
446	R	94.4	Very high	91.6	Very high	44 Å²	44	56.6 Å²	56.6	17%	0.166	27%	0.273	C	S	.	.	H	α-helix	trans	-58.2	-38.6	171.8	175.1	-171.8	-79.8	142.8	-11.7	112.4	I388 D389 E393 I442 K450	I388-R446 HydrophobicContact CG2-CB 4.45Å; D389-R446 IonicContact OD1-CZ 3.38Å; D389-R446 IonicContact OD1-NE 3.18Å; D389-R446 PolarHBondContact OD1-NE 2.92Å; D389-R446 IonicContact OD1-NH2 2.7Å; D389-R446 PolarHBondContact OD1-NH2 2.92Å; E393-R446 VanDerWaalsContact CD-NH1 3.31Å; E393-R446 VanDerWaalsContact CD-NH2 3.27Å; E393-R446 IonicContact OE1-CZ 2.62Å; E393-R446 IonicContact OE1-NH1 2.74Å; E393-R446 PolarHBondContact OE1-NH1 3.41Å; E393-R446 IonicContact OE1-NH2 3.13Å; E393-R446 PolarHBondContact OE1-NH2 2.97Å; E393-R446 IonicContact OE2-CZ 3.71Å; E393-R446 IonicContact OE2-NH1 2.77Å; E393-R446 PolarHBondContact OE2-NH1 3.22Å; E393-R446 IonicContact OE2-NH2 2.61Å; E393-R446 PolarHBondContact OE2-NH2 3.12Å; I442-R446 VanDerWaalsContact O-CB 3.29Å; I442-R446 WeakPolarHBondContact O-CB 3.41Å; I442-R446 PolarHBondContact O-N 2.91Å; R446-K450 WeakPolarHBondContact O-CG 3.48Å
447	I	95.1	Very high	91.1	Very high	94 Å²	94	58.7 Å²	58.7	48%	0.482	28%	0.283	S	S	.	.	H	α-helix	trans	-68.7	-46.7	175.1	-71.5	165	0	0	0	110.3	P443 E444 N445 W449 K450 E451	P443-I447 VanDerWaalsContact O-CG1 3.3Å; P443-I447 WeakPolarHBondContact O-CG1 3.2Å; P443-I447 PolarHBondContact O-N 3.36Å; E444-I447 PolarHBondContact O-N 3.32Å; N445-I447 VanDerWaalsContact C-N 3.3Å; N445-I447 PolarHBondContact O-N 2.88Å; I447-W449 VanDerWaalsContact C-N 3.32Å; I447-W449 PolarHBondContact O-N 2.79Å; I447-K450 CarbonylContact O-C 3.58Å; I447-K450 WeakPolarHBondContact O-CA 3.29Å; I447-K450 WeakPolarHBondContact O-CB 3.48Å; I447-K450 PolarHBondContact O-N 3.45Å; I447-E451 HydrophobicContact CG2-CG 4.24Å; I447-E451 PolarHBondContact O-N 2.88Å
448	K	97.2	Very high	90.4	Very high	64 Å²	64	63.4 Å²	63.4	28%	0.278	30%	0.303	S	S	.	.	H	α-helix	trans	-63	-33	-178.2	-73.3	170	-173.9	163.8	0	114.1	W341 E444 N445 K450 E451 Y452	W341-K448 HydrophobicContact CB-CD 3.8Å; W341-K448 HydrophobicContact CD2-CB 3.92Å; W341-K448 HydrophobicContact CD2-CD 3.56Å; W341-K448 HydrophobicContact CD2-CG 4.35Å; W341-K448 HydrophobicContact CE3-CB 3.68Å; W341-K448 HydrophobicContact CE3-CD 3.88Å; W341-K448 HydrophobicContact CE3-CG 4.43Å; W341-K448 HydrophobicContact CG-CD 3.51Å; W341-K448 HydrophobicContact CH2-CB 3.83Å; W341-K448 HydrophobicContact CZ2-CB 4.06Å; W341-K448 HydrophobicContact CZ3-CB 3.63Å; E444-K448 WeakPolarHBondContact O-CG 3.16Å; E444-K448 PolarHBondContact O-N 3.25Å; E444-K448 VanDerWaalsContact O-N 3.08Å; N445-K448 PolarHBondContact O-N 3.28Å; K448-K450 VanDerWaalsContact C-N 3.34Å; K448-E451 WeakPolarHBondContact CA-OE2 3.43Å; K448-E451 PolarHBondContact O-N 2.83Å; K448-Y452 WeakPolarHBondContact O-CB 3.14Å; K448-Y452 PolarHBondContact O-N 2.79Å
449	W	96	Very high	89.6	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-66.1	-36.1	169.8	-74.5	122.3	0	0	0	112.8	W341 H344 F345 T348 I380 A381 Q384 V385 N445 I447 Y452 I453	W341-W449 AromaticContact CH2-CD2 3.67Å; W341-W449 HydrophobicContact CH2-CD2 3.67Å; W341-W449 AromaticContact CH2-CE2 3.65Å; W341-W449 AromaticContact CH2-CE3 3.88Å; W341-W449 HydrophobicContact CH2-CE3 3.88Å; W341-W449 HydrophobicContact CH2-CG 4.21Å; W341-W449 HydrophobicContact CH2-CH2 4.09Å; W341-W449 AromaticContact CH2-CZ2 3.86Å; W341-W449 HydrophobicContact CH2-CZ2 3.86Å; W341-W449 HydrophobicContact CH2-CZ3 4.09Å; W341-W449 AromaticContact CZ3-CD1 3.95Å; W341-W449 AromaticContact CZ3-CD2 3.93Å; W341-W449 HydrophobicContact CZ3-CD2 3.93Å; W341-W449 AromaticContact CZ3-CE2 3.62Å; W341-W449 HydrophobicContact CZ3-CG 4.13Å; W341-W449 HydrophobicContact CZ3-CZ2 4.05Å; W341-W449 AromaticContact CZ3-NE1 3.64Å; H344-W449 AromaticContact CD2-NE1 3.64Å; H344-W449 AromaticContact CE1-NE1 3.78Å; H344-W449 AromaticContact NE2-CD1 3.84Å; H344-W449 AromaticContact NE2-CE2 3.76Å; H344-W449 AromaticContact NE2-NE1 2.87Å; H344-W449 PolarHBondContact NE2-NE1 2.68Å; F345-W449 AromaticContact CD2-CH2 3.54Å; F345-W449 HydrophobicContact CD2-CH2 3.54Å; F345-W449 HydrophobicContact CD2-CZ2 4.13Å; F345-W449 HydrophobicContact CD2-CZ3 4.11Å; F345-W449 AromaticContact CE2-CH2 3.83Å; F345-W449 HydrophobicContact CE2-CH2 3.83Å; F345-W449 HydrophobicContact CE2-CZ3 4.03Å; T348-W449 HydrophobicContact CG2-CH2 3.8Å; T348-W449 HydrophobicContact CG2-CZ2 3.8Å; I380-W449 HydrophobicContact CG2-CH2 4.14Å; I380-W449 HydrophobicContact CG2-CZ3 4.25Å; A381-W449 HydrophobicContact CB-CB 4.36Å; A381-W449 HydrophobicContact CB-CD2 4.26Å; A381-W449 HydrophobicContact CB-CE3 3.51Å; A381-W449 HydrophobicContact CB-CZ3 4.19Å; Q384-W449 HydrophobicContact CB-CD2 4.03Å; Q384-W449 HydrophobicContact CB-CG 4.17Å; Q384-W449 HydrophobicContact CB-CZ2 4.1Å; Q384-W449 HydrophobicContact CG-CD2 4.46Å; Q384-W449 HydrophobicContact CG-CH2 4.32Å; Q384-W449 HydrophobicContact CG-CZ2 3.75Å; V385-W449 HydrophobicContact CG2-CB 3.62Å; V385-W449 HydrophobicContact CG2-CG 4.42Å; N445-W449 PolarHBondContact O-N 3.21Å; I447-W449 VanDerWaalsContact C-N 3.32Å; I447-W449 PolarHBondContact O-N 2.79Å; W449-Y452 HydrophobicContact CE3-CD1 4.22Å; W449-Y452 HydrophobicContact CE3-CG 4.27Å; W449-Y452 HydrophobicContact CZ3-CD1 4.17Å; W449-Y452 HydrophobicContact CZ3-CE1 4.43Å; W449-Y452 HydrophobicContact CZ3-CG 4.32Å; W449-Y452 PolarHBondContact O-N 2.98Å; W449-I453 WeakPolarHBondContact O-CD1 3.45Å; W449-I453 VanDerWaalsContact O-CG1 3.24Å; W449-I453 WeakPolarHBondContact O-CG1 3.34Å; W449-I453 PolarHBondContact O-N 2.95Å
450	K	91.1	Very high	88.9	Confident	107 Å²	107	71.1 Å²	71.1	47%	0.465	34%	0.338	S	S	.	.	H	α-helix	trans	-70.8	-34.4	176.1	-66.4	173.9	-175.3	-176.6	0	112	V385 R446 I447 K448 A454	V385-K450 HydrophobicContact CG2-CG 4.38Å; R446-K450 WeakPolarHBondContact O-CG 3.48Å; I447-K450 CarbonylContact O-C 3.58Å; I447-K450 WeakPolarHBondContact O-CA 3.29Å; I447-K450 WeakPolarHBondContact O-CB 3.48Å; I447-K450 PolarHBondContact O-N 3.45Å; K448-K450 VanDerWaalsContact C-N 3.34Å; K450-A454 PolarHBondContact O-N 3.4Å
451	E	91.7	Very high	88	Confident	104 Å²	104	69 Å²	69	49%	0.486	33%	0.333	S	S	.	.	H	α-helix	trans	-63.8	-47.9	168.7	-66.4	170.6	155.1	0	0	111	I447 K448 I453 A454 E455	I447-E451 HydrophobicContact CG2-CG 4.24Å; I447-E451 PolarHBondContact O-N 2.88Å; K448-E451 WeakPolarHBondContact CA-OE2 3.43Å; K448-E451 PolarHBondContact O-N 2.83Å; E451-I453 VanDerWaalsContact C-N 3.33Å; E451-I453 PolarHBondContact O-N 3.22Å; E451-A454 WeakPolarHBondContact O-CB 3.31Å; E451-A454 PolarHBondContact O-N 2.91Å; E451-A454 VanDerWaalsContact O-N 3.07Å; E451-E455 PolarHBondContact O-N 3.25Å
452	Y	89.5	Confident	87.1	Confident	57 Å²	57	71.3 Å²	71.3	22%	0.224	35%	0.348	C	S	.	.	H	α-helix	trans	-59.7	-38.8	176.8	-172.5	-87.5	0	0	0	112.8	F345 A381 K448 W449 E455 Q456	F345-Y452 HydrophobicContact CE2-CD2 4.38Å; F345-Y452 HydrophobicContact CE2-CE2 4.01Å; F345-Y452 HydrophobicContact CZ-CE2 4.15Å; A381-Y452 HydrophobicContact CB-CD1 3.95Å; K448-Y452 WeakPolarHBondContact O-CB 3.14Å; K448-Y452 PolarHBondContact O-N 2.79Å; W449-Y452 HydrophobicContact CE3-CD1 4.22Å; W449-Y452 HydrophobicContact CE3-CG 4.27Å; W449-Y452 HydrophobicContact CZ3-CD1 4.17Å; W449-Y452 HydrophobicContact CZ3-CE1 4.43Å; W449-Y452 HydrophobicContact CZ3-CG 4.32Å; W449-Y452 PolarHBondContact O-N 2.98Å; Y452-E455 PolarHBondContact O-N 2.93Å; Y452-Q456 HydrophobicContact CD1-CG 3.9Å; Y452-Q456 HydrophobicContact CE1-CG 3.62Å; Y452-Q456 WeakPolarHBondContact O-CB 3.28Å; Y452-Q456 VanDerWaalsContact O-CG 3.28Å; Y452-Q456 WeakPolarHBondContact O-CG 3.28Å; Y452-Q456 PolarHBondContact O-N 3.38Å; Y452-Q456 PolarHBondContact OH-NE2 3.07Å
453	I	82.8	Confident	86.1	Confident	25 Å²	25	76 Å²	76	13%	0.128	37%	0.372	C	S	.	.	H	α-helix	trans	-59.6	-46.8	172.9	-70.4	158.7	0	0	0	110.5	A381 D382 W449 E451 Q456 Q457	A381-I453 HydrophobicContact CB-CD1 3.84Å; A381-I453 HydrophobicContact CB-CG1 3.42Å; A381-I453 VanDerWaalsContact CB-CG1 3.42Å; D382-I453 WeakPolarHBondContact OD1-CD1 3.29Å; W449-I453 WeakPolarHBondContact O-CD1 3.45Å; W449-I453 VanDerWaalsContact O-CG1 3.24Å; W449-I453 WeakPolarHBondContact O-CG1 3.34Å; W449-I453 PolarHBondContact O-N 2.95Å; E451-I453 VanDerWaalsContact C-N 3.33Å; E451-I453 PolarHBondContact O-N 3.22Å; I453-Q456 PolarHBondContact O-N 3.36Å; I453-Q457 HydrophobicContact CG2-CG 4.45Å; I453-Q457 VanDerWaalsContact CG2-NE2 3.34Å; I453-Q457 WeakPolarHBondContact O-CB 3.27Å; I453-Q457 VanDerWaalsContact O-CG 3.29Å; I453-Q457 WeakPolarHBondContact O-CG 3.35Å; I453-Q457 PolarHBondContact O-N 2.93Å
454	A	81.3	Confident	85.3	Confident	53 Å²	53	81 Å²	81	44%	0.438	39%	0.391	S	S	.	.	H	α-helix	trans	-64.2	-42.2	178.6	0	0	0	0	0	111.9	K450 E451 Q457 Q458	K450-A454 PolarHBondContact O-N 3.4Å; E451-A454 WeakPolarHBondContact O-CB 3.31Å; E451-A454 PolarHBondContact O-N 2.91Å; E451-A454 VanDerWaalsContact O-N 3.07Å; A454-Q457 PolarHBondContact O-N 3.38Å; A454-Q458 VanDerWaalsContact O-CB 3.22Å; A454-Q458 WeakPolarHBondContact O-CB 3.44Å; A454-Q458 PolarHBondContact O-N 2.88Å
455	E	83.6	Confident	84.4	Confident	127 Å²	127	82.7 Å²	82.7	59%	0.593	40%	0.402	S	S	*	.	H	α-helix	trans	-62.3	-42.2	175.4	-71.2	-174.6	165	0	0	112.5	E451 Y452 S459	E451-E455 PolarHBondContact O-N 3.25Å; Y452-E455 PolarHBondContact O-N 2.93Å; E455-S459 VanDerWaalsContact O-CB 3.23Å; E455-S459 WeakPolarHBondContact O-CB 3.22Å; E455-S459 PolarHBondContact O-N 2.85Å; E455-S459 PolarHBondContact O-OG 3.31Å
456	Q	78.1	Confident	83.5	Confident	74 Å²	74	88.4 Å²	88.4	35%	0.346	43%	0.427	S	S	.	.	H	α-helix	trans	-65.7	-43.3	176	-73.8	-67.7	-17.6	0	0	111.9	Y452 I453 S459 R460	Y452-Q456 HydrophobicContact CD1-CG 3.9Å; Y452-Q456 HydrophobicContact CE1-CG 3.62Å; Y452-Q456 WeakPolarHBondContact O-CB 3.28Å; Y452-Q456 VanDerWaalsContact O-CG 3.28Å; Y452-Q456 WeakPolarHBondContact O-CG 3.28Å; Y452-Q456 PolarHBondContact O-N 3.38Å; Y452-Q456 PolarHBondContact OH-NE2 3.07Å; I453-Q456 PolarHBondContact O-N 3.36Å; Q456-S459 PolarHBondContact O-N 3.41Å; Q456-R460 WeakPolarHBondContact O-CB 3.23Å; Q456-R460 VanDerWaalsContact O-CG 3.28Å; Q456-R460 WeakPolarHBondContact O-CG 3.25Å; Q456-R460 PolarHBondContact O-N 2.86Å
457	Q	77.9	Confident	82.8	Confident	115 Å²	115	92.3 Å²	92.3	54%	0.537	45%	0.445	S	S	.	.	H	α-helix	trans	-64.2	-46.2	175.8	-72	176.4	8.6	0	0	111.5	I453 A454 S459 R460 L461	I453-Q457 HydrophobicContact CG2-CG 4.45Å; I453-Q457 VanDerWaalsContact CG2-NE2 3.34Å; I453-Q457 WeakPolarHBondContact O-CB 3.27Å; I453-Q457 VanDerWaalsContact O-CG 3.29Å; I453-Q457 WeakPolarHBondContact O-CG 3.35Å; I453-Q457 PolarHBondContact O-N 2.93Å; A454-Q457 PolarHBondContact O-N 3.38Å; Q457-S459 VanDerWaalsContact C-N 3.31Å; Q457-S459 PolarHBondContact O-N 2.9Å; Q457-R460 PolarHBondContact O-N 3.4Å; Q457-L461 WeakPolarHBondContact O-CB 3.42Å; Q457-L461 WeakPolarHBondContact O-CG 3.42Å; Q457-L461 PolarHBondContact O-N 2.73Å
458	Q	76.1	Confident	82	Confident	125 Å²	125	91.2 Å²	91.2	58%	0.584	44%	0.44	S	S	*	.	H	α-helix	trans	-61.5	-38.6	176.4	-171.8	69.2	0.4	0	0	111.9	A454 T462	A454-Q458 VanDerWaalsContact O-CB 3.22Å; A454-Q458 WeakPolarHBondContact O-CB 3.44Å; A454-Q458 PolarHBondContact O-N 2.88Å; Q458-T462 WeakPolarHBondContact O-CB 3.39Å; Q458-T462 PolarHBondContact O-N 3.29Å; Q458-T462 PolarHBondContact O-OG1 2.89Å
459	S	76.6	Confident	81.2	Confident	70 Å²	70	93.6 Å²	93.6	49%	0.49	46%	0.455	S	S	.	.	H	α-helix	trans	-67.8	-45.2	176	-62.4	0	0	0	0	111.9	E455 Q456 Q457 T462 L463	E455-S459 VanDerWaalsContact O-CB 3.23Å; E455-S459 WeakPolarHBondContact O-CB 3.22Å; E455-S459 PolarHBondContact O-N 2.85Å; E455-S459 PolarHBondContact O-OG 3.31Å; Q456-S459 PolarHBondContact O-N 3.41Å; Q457-S459 VanDerWaalsContact C-N 3.31Å; Q457-S459 PolarHBondContact O-N 2.9Å; S459-T462 PolarHBondContact O-N 2.9Å; S459-L463 WeakPolarHBondContact O-CB 3.31Å; S459-L463 PolarHBondContact O-N 2.86Å
460	R	75.7	Confident	80.4	Confident	180 Å²	180	98.6 Å²	98.6	68%	0.679	48%	0.479	S	S	*	.	H	α-helix	trans	-61.4	-44	174.5	-73.4	174.5	-178.6	-159.7	-0.7	111.7	Q456 Q457 L463 F464	Q456-R460 WeakPolarHBondContact O-CB 3.23Å; Q456-R460 VanDerWaalsContact O-CG 3.28Å; Q456-R460 WeakPolarHBondContact O-CG 3.25Å; Q456-R460 PolarHBondContact O-N 2.86Å; Q457-R460 PolarHBondContact O-N 3.4Å; R460-L463 PolarHBondContact O-N 3.38Å; R460-F464 VanDerWaalsContact O-CB 3.31Å; R460-F464 WeakPolarHBondContact O-CB 3.27Å; R460-F464 PolarHBondContact O-N 3.47Å
461	L	75.7	Confident	79.7	Confident	95 Å²	95	95.6 Å²	95.6	50%	0.497	47%	0.474	S	S	.	.	H	α-helix	trans	-61	-44.9	174	-77.2	165.6	0	0	0	111.8	Q457 L463 F464 L465	Q457-L461 WeakPolarHBondContact O-CB 3.42Å; Q457-L461 WeakPolarHBondContact O-CG 3.42Å; Q457-L461 PolarHBondContact O-N 2.73Å; L461-L463 VanDerWaalsContact C-N 3.35Å; L461-L463 PolarHBondContact O-N 2.88Å; L461-F464 PolarHBondContact O-N 3.36Å; L461-L465 WeakPolarHBondContact O-CB 3.35Å; L461-L465 VanDerWaalsContact O-CG 3.27Å; L461-L465 WeakPolarHBondContact O-CG 3.32Å; L461-L465 PolarHBondContact O-N 2.73Å
462	T	77.8	Confident	79.2	Confident	60 Å²	60	94.2 Å²	94.2	37%	0.368	48%	0.475	S	S	.	.	H	α-helix	trans	-63.5	-40.3	177.8	-58.9	0	0	0	0	111.7	Q458 S459 K466	Q458-T462 WeakPolarHBondContact O-CB 3.39Å; Q458-T462 PolarHBondContact O-N 3.29Å; Q458-T462 PolarHBondContact O-OG1 2.89Å; S459-T462 PolarHBondContact O-N 2.9Å; T462-K466 WeakPolarHBondContact O-CG 3.5Å; T462-K466 PolarHBondContact O-N 3.44Å
463	L	77.1	Confident	78.9	Confident	101 Å²	101	96.4 Å²	96.4	53%	0.529	49%	0.491	S	S	.	.	H	α-helix	trans	-67.5	-44.8	176.8	-163.5	75.7	0	0	0	111.5	S459 R460 L461 L465 K466 F467	S459-L463 WeakPolarHBondContact O-CB 3.31Å; S459-L463 PolarHBondContact O-N 2.86Å; R460-L463 PolarHBondContact O-N 3.38Å; L461-L463 VanDerWaalsContact C-N 3.35Å; L461-L463 PolarHBondContact O-N 2.88Å; L463-L465 PolarHBondContact O-N 3.49Å; L463-K466 PolarHBondContact O-N 2.99Å; L463-F467 HydrophobicContact CD1-CE2 4.29Å; L463-F467 HydrophobicContact CD2-CE2 3.99Å; L463-F467 HydrophobicContact CG-CD2 4.03Å; L463-F467 HydrophobicContact CG-CE2 3.76Å; L463-F467 WeakPolarHBondContact O-CD2 3.38Å; L463-F467 PolarHBondContact O-N 2.79Å
464	F	78	Confident	78.7	Confident	132 Å²	132	100 Å²	100	58%	0.579	51%	0.51	S	S	*	.	H	α-helix	trans	-60.9	-43.2	175.2	179.9	-102.7	0	0	0	111.9	R460 L461 F467 N468	R460-F464 VanDerWaalsContact O-CB 3.31Å; R460-F464 WeakPolarHBondContact O-CB 3.27Å; R460-F464 PolarHBondContact O-N 3.47Å; L461-F464 PolarHBondContact O-N 3.36Å; F464-F467 PolarHBondContact O-N 3.26Å; F464-N468 WeakPolarHBondContact CD1-ND2 3.38Å; F464-N468 VanDerWaalsContact CE1-ND2 3.32Å; F464-N468 WeakPolarHBondContact CE1-ND2 3.32Å; F464-N468 VanDerWaalsContact CE2-ND2 3.35Å; F464-N468 WeakPolarHBondContact CE2-ND2 3.33Å; F464-N468 VanDerWaalsContact CZ-ND2 3.25Å; F464-N468 WeakPolarHBondContact CZ-ND2 3.4Å; F464-N468 PolarHBondContact O-N 3.04Å; F464-N468 PolarHBondContact O-ND2 3.45Å
465	L	79.7	Confident	78.6	Confident	108 Å²	108	103.5 Å²	103.5	57%	0.565	52%	0.517	S	S	*	.	H	α-helix	trans	-62.9	-41	175.3	-74.6	168.3	0	0	0	111.9	L461 L463 N468 L469	L461-L465 WeakPolarHBondContact O-CB 3.35Å; L461-L465 VanDerWaalsContact O-CG 3.27Å; L461-L465 WeakPolarHBondContact O-CG 3.32Å; L461-L465 PolarHBondContact O-N 2.73Å; L463-L465 PolarHBondContact O-N 3.49Å; L465-N468 PolarHBondContact O-N 3.48Å; L465-L469 WeakPolarHBondContact O-CB 3.36Å; L465-L469 PolarHBondContact O-N 2.88Å
466	K	79	Confident	78.5	Confident	122 Å²	122	99.6 Å²	99.6	53%	0.53	51%	0.507	S	S	.	.	H	α-helix	trans	-60.9	-51.7	173.8	-76.3	176.1	178.1	-178.3	0	112.1	T462 L463 N468 L469 E470	T462-K466 WeakPolarHBondContact O-CG 3.5Å; T462-K466 PolarHBondContact O-N 3.44Å; L463-K466 PolarHBondContact O-N 2.99Å; K466-N468 VanDerWaalsContact C-N 3.3Å; K466-N468 PolarHBondContact O-N 3.26Å; K466-L469 WeakPolarHBondContact O-CB 3.42Å; K466-L469 PolarHBondContact O-N 3.06Å; K466-E470 WeakPolarHBondContact O-CG 3.47Å; K466-E470 PolarHBondContact O-N 2.93Å
467	F	78.5	Confident	78.6	Confident	126 Å²	126	101.5 Å²	101.5	55%	0.553	52%	0.515	S	S	*	.	H	α-helix	trans	-58.8	-39.9	178.4	-82.1	-58.3	0	0	0	112.7	L463 F464 E470 A471	L463-F467 HydrophobicContact CD1-CE2 4.29Å; L463-F467 HydrophobicContact CD2-CE2 3.99Å; L463-F467 HydrophobicContact CG-CD2 4.03Å; L463-F467 HydrophobicContact CG-CE2 3.76Å; L463-F467 WeakPolarHBondContact O-CD2 3.38Å; L463-F467 PolarHBondContact O-N 2.79Å; F464-F467 PolarHBondContact O-N 3.26Å; F467-E470 PolarHBondContact O-N 2.97Å; F467-A471 WeakPolarHBondContact O-CB 3.31Å; F467-A471 PolarHBondContact O-N 2.94Å
468	N	79.3	Confident	78.6	Confident	70 Å²	70	101 Å²	101	37%	0.374	51%	0.513	S	S	.	.	H	α-helix	trans	-68.7	-36.8	174.9	-77.4	-77.4	0	0	0	112.4	F464 L465 K466 A471 C472	F464-N468 WeakPolarHBondContact CD1-ND2 3.38Å; F464-N468 VanDerWaalsContact CE1-ND2 3.32Å; F464-N468 WeakPolarHBondContact CE1-ND2 3.32Å; F464-N468 VanDerWaalsContact CE2-ND2 3.35Å; F464-N468 WeakPolarHBondContact CE2-ND2 3.33Å; F464-N468 VanDerWaalsContact CZ-ND2 3.25Å; F464-N468 WeakPolarHBondContact CZ-ND2 3.4Å; F464-N468 PolarHBondContact O-N 3.04Å; F464-N468 PolarHBondContact O-ND2 3.45Å; L465-N468 PolarHBondContact O-N 3.48Å; K466-N468 VanDerWaalsContact C-N 3.3Å; K466-N468 PolarHBondContact O-N 3.26Å; N468-A471 PolarHBondContact O-N 3.33Å; N468-C472 WeakPolarHBondContact O-CB 3.36Å; N468-C472 PolarHBondContact O-N 3.48Å; N468-C472 PolarHBondContact O-SG 2.91Å
469	L	80.1	Confident	78.9	Confident	114 Å²	114	100.5 Å²	100.5	60%	0.597	51%	0.511	S	S	*	.	H	α-helix	trans	-63	-44	173.5	-129.7	83	0	0	0	111.5	L465 K466 C472 N473	L465-L469 WeakPolarHBondContact O-CB 3.36Å; L465-L469 PolarHBondContact O-N 2.88Å; K466-L469 WeakPolarHBondContact O-CB 3.42Å; K466-L469 PolarHBondContact O-N 3.06Å; L469-C472 PolarHBondContact O-N 3.48Å; L469-N473 WeakPolarHBondContact O-CB 3.45Å; L469-N473 VanDerWaalsContact O-CG 3.23Å; L469-N473 PolarHBondContact O-N 3.43Å; L469-N473 PolarHBondContact O-ND2 3.26Å
470	E	78.8	Confident	79.2	Confident	105 Å²	105	106.1 Å²	106.1	49%	0.491	52%	0.521	S	S	.	.	H	α-helix	trans	-64	-44.1	177.1	-72.7	169.3	-165.2	0	0	111.4	K466 F467 C472 N473 L474	K466-E470 WeakPolarHBondContact O-CG 3.47Å; K466-E470 PolarHBondContact O-N 2.93Å; F467-E470 PolarHBondContact O-N 2.97Å; E470-C472 PolarHBondContact O-N 3.42Å; E470-N473 PolarHBondContact O-N 2.86Å; E470-L474 WeakPolarHBondContact O-CB 3.46Å; E470-L474 VanDerWaalsContact O-CG 3.31Å; E470-L474 WeakPolarHBondContact O-CG 3.38Å; E470-L474 PolarHBondContact O-N 2.88Å
471	A	76.9	Confident	79.3	Confident	45 Å²	45	103.8 Å²	103.8	37%	0.372	52%	0.519	S	S	.	.	H	α-helix	trans	-61	-43	173.8	0	0	0	0	0	112.6	F467 N468 L474 Q475	F467-A471 WeakPolarHBondContact O-CB 3.31Å; F467-A471 PolarHBondContact O-N 2.94Å; N468-A471 PolarHBondContact O-N 3.33Å; A471-L474 PolarHBondContact O-N 2.91Å; A471-Q475 WeakPolarHBondContact O-CG 3.4Å; A471-Q475 PolarHBondContact O-N 3.38Å
472	C	80.5	Confident	79.6	Confident	75 Å²	75	105.4 Å²	105.4	51%	0.507	52%	0.522	S	S	.	.	H	α-helix	trans	-64	-40.6	174.5	-75.2	0	0	0	0	112.3	N468 L469 E470 Q475 A476	N468-C472 WeakPolarHBondContact O-CB 3.36Å; N468-C472 PolarHBondContact O-N 3.48Å; N468-C472 PolarHBondContact O-SG 2.91Å; L469-C472 PolarHBondContact O-N 3.48Å; E470-C472 PolarHBondContact O-N 3.42Å; C472-Q475 PolarHBondContact O-N 3.18Å; C472-A476 WeakPolarHBondContact O-CB 3.43Å; C472-A476 PolarHBondContact O-N 2.95Å
473	N	83.2	Confident	79.8	Confident	102 Å²	102	111.5 Å²	111.5	55%	0.545	54%	0.539	S	S	.	.	H	α-helix	trans	-64.9	-44.3	175.7	-75.2	-31.2	0	0	0	111.5	L469 E470 Q475 A476 E477	L469-N473 WeakPolarHBondContact O-CB 3.45Å; L469-N473 VanDerWaalsContact O-CG 3.23Å; L469-N473 PolarHBondContact O-N 3.43Å; L469-N473 PolarHBondContact O-ND2 3.26Å; E470-N473 PolarHBondContact O-N 2.86Å; N473-Q475 PolarHBondContact O-N 3.27Å; N473-A476 PolarHBondContact O-N 3.21Å; N473-E477 WeakPolarHBondContact O-CB 3.4Å; N473-E477 PolarHBondContact O-N 2.93Å
474	L	78.6	Confident	79.9	Confident	102 Å²	102	115 Å²	115	53%	0.534	55%	0.545	S	S	.	.	H	α-helix	trans	-60.7	-42.5	174.6	-74.5	166.1	0	0	0	112	E470 A471 E477 Q478	E470-L474 WeakPolarHBondContact O-CB 3.46Å; E470-L474 VanDerWaalsContact O-CG 3.31Å; E470-L474 WeakPolarHBondContact O-CG 3.38Å; E470-L474 PolarHBondContact O-N 2.88Å; A471-L474 PolarHBondContact O-N 2.91Å; L474-E477 PolarHBondContact O-N 3.48Å; L474-Q478 WeakPolarHBondContact O-CG 3.26Å; L474-Q478 PolarHBondContact O-N 3.42Å
475	Q	79.7	Confident	79.8	Confident	126 Å²	126	110.9 Å²	110.9	59%	0.589	54%	0.535	S	S	*	.	H	α-helix	trans	-62.8	-45	172.9	-76.1	-173.2	-7.4	0	0	112	A471 C472 N473 E477 Q478 H479	A471-Q475 WeakPolarHBondContact O-CG 3.4Å; A471-Q475 PolarHBondContact O-N 3.38Å; C472-Q475 PolarHBondContact O-N 3.18Å; N473-Q475 PolarHBondContact O-N 3.27Å; Q475-E477 VanDerWaalsContact C-N 3.3Å; Q475-E477 PolarHBondContact O-N 3.37Å; Q475-Q478 PolarHBondContact O-N 3.41Å; Q475-H479 PolarHBondContact O-CD2 2.85Å; Q475-H479 VanDerWaalsContact O-CD2 3.27Å; Q475-H479 PolarHBondContact O-N 2.91Å
476	A	81.5	Confident	79.8	Confident	45 Å²	45	108 Å²	108	37%	0.372	53%	0.525	S	S	.	.	H	α-helix	trans	-62	-38.2	177.6	0	0	0	0	0	112	C472 N473 H479 R480	C472-A476 WeakPolarHBondContact O-CB 3.43Å; C472-A476 PolarHBondContact O-N 2.95Å; N473-A476 PolarHBondContact O-N 3.21Å; A476-H479 PolarHBondContact O-N 2.84Å; A476-R480 WeakPolarHBondContact O-CG 3.35Å; A476-R480 PolarHBondContact O-N 3Å
477	E	80.2	Confident	79.8	Confident	113 Å²	113	111.5 Å²	111.5	53%	0.528	53%	0.534	S	S	.	.	H	α-helix	trans	-69.3	-45.2	176	-172.8	154.1	-120.3	0	0	112.2	N473 L474 Q475 H479 R480 M481	N473-E477 WeakPolarHBondContact O-CB 3.4Å; N473-E477 PolarHBondContact O-N 2.93Å; L474-E477 PolarHBondContact O-N 3.48Å; Q475-E477 VanDerWaalsContact C-N 3.3Å; Q475-E477 PolarHBondContact O-N 3.37Å; E477-H479 PolarHBondContact O-N 2.92Å; E477-R480 CarbonylContact O-C 3.59Å; E477-R480 WeakPolarHBondContact O-CA 3.34Å; E477-R480 WeakPolarHBondContact O-CB 3.45Å; E477-R480 PolarHBondContact O-N 2.94Å; E477-M481 WeakPolarHBondContact O-CG 3.47Å; E477-M481 PolarHBondContact O-N 3.06Å
478	Q	78.5	Confident	79.5	Confident	106 Å²	106	110.7 Å²	110.7	50%	0.495	54%	0.535	S	S	.	.	H	α-helix	trans	-56.2	-39.3	170.1	-73.5	-177	19.8	0	0	112	L474 Q475 M481 K482	L474-Q478 WeakPolarHBondContact O-CG 3.26Å; L474-Q478 PolarHBondContact O-N 3.42Å; Q475-Q478 PolarHBondContact O-N 3.41Å; Q478-M481 PolarHBondContact O-N 3.28Å; Q478-K482 WeakPolarHBondContact O-CB 3.4Å; Q478-K482 VanDerWaalsContact O-CG 3.26Å; Q478-K482 WeakPolarHBondContact O-CG 3.38Å; Q478-K482 PolarHBondContact O-N 3.36Å
479	H	82	Confident	79.2	Confident	114 Å²	114	115.4 Å²	115.4	53%	0.528	56%	0.557	S	S	.	*	H	α-helix	trans	-67.2	-35.3	174.3	-88.5	-75.1	0	0	0	113	Q475 A476 E477 R483	Q475-H479 PolarHBondContact O-CD2 2.85Å; Q475-H479 VanDerWaalsContact O-CD2 3.27Å; Q475-H479 PolarHBondContact O-N 2.91Å; A476-H479 PolarHBondContact O-N 2.84Å; E477-H479 PolarHBondContact O-N 2.92Å; H479-R483 WeakPolarHBondContact O-CB 3.4Å; H479-R483 WeakPolarHBondContact O-CG 3.46Å; H479-R483 PolarHBondContact O-N 3.45Å
480	R	82.8	Confident	78.7	Confident	188 Å²	188	118.8 Å²	118.8	71%	0.709	56%	0.562	S	S	*	*	H	α-helix	trans	-65.1	-46.9	171.4	-71.4	172.2	-177.3	-167.7	1.6	111.2	A476 E477 R483 W484	A476-R480 WeakPolarHBondContact O-CG 3.35Å; A476-R480 PolarHBondContact O-N 3Å; E477-R480 CarbonylContact O-C 3.59Å; E477-R480 WeakPolarHBondContact O-CA 3.34Å; E477-R480 WeakPolarHBondContact O-CB 3.45Å; E477-R480 PolarHBondContact O-N 2.94Å; R480-R483 PolarHBondContact O-N 2.96Å; R480-W484 PolarHBondContact O-N 3.39Å
481	M	78	Confident	77.8	Confident	130 Å²	130	115.7 Å²	115.7	64%	0.64	56%	0.558	S	S	*	*	H	α-helix	trans	-60	-46.7	176.7	-66.5	-178.4	81.8	0	0	111.8	E477 Q478 R483 W484 A485	E477-M481 WeakPolarHBondContact O-CG 3.47Å; E477-M481 PolarHBondContact O-N 3.06Å; Q478-M481 PolarHBondContact O-N 3.28Å; M481-R483 VanDerWaalsContact C-N 3.33Å; M481-R483 PolarHBondContact O-N 3.47Å; M481-W484 PolarHBondContact O-N 2.87Å; M481-A485 WeakPolarHBondContact O-CB 3.46Å; M481-A485 PolarHBondContact O-N 3.13Å
482	K	82.3	Confident	76.8	Confident	129 Å²	129	119.7 Å²	119.7	56%	0.561	58%	0.58	S	S	*	*	H	α-helix	trans	-58.7	-40.8	175	-74	167.8	-178.2	169.8	0	112.2	Q478 S486	Q478-K482 WeakPolarHBondContact O-CB 3.4Å; Q478-K482 VanDerWaalsContact O-CG 3.26Å; Q478-K482 WeakPolarHBondContact O-CG 3.38Å; Q478-K482 PolarHBondContact O-N 3.36Å; K482-S486 WeakPolarHBondContact O-CB 3.39Å; K482-S486 PolarHBondContact O-N 3.39Å
483	R	82.1	Confident	75.6	Confident	189 Å²	189	122.2 Å²	122.2	71%	0.713	60%	0.598	S	S	*	*	H	α-helix	trans	-67.2	-39.1	174.7	-76.9	178.4	176.7	-167.4	1	112.8	H479 R480 M481 S486 R487	H479-R483 WeakPolarHBondContact O-CB 3.4Å; H479-R483 WeakPolarHBondContact O-CG 3.46Å; H479-R483 PolarHBondContact O-N 3.45Å; R480-R483 PolarHBondContact O-N 2.96Å; M481-R483 VanDerWaalsContact C-N 3.33Å; M481-R483 PolarHBondContact O-N 3.47Å; R483-S486 PolarHBondContact O-N 3.21Å; R483-R487 PolarHBondContact O-N 3.03Å; R483-R487 VanDerWaalsContact O-N 3.13Å
484	W	77.7	Confident	73.9	Confident	173 Å²	173	123.6 Å²	123.6	66%	0.655	61%	0.612	S	S	*	*	H	α-helix	trans	-68.4	-45.8	177.7	-176.3	78.9	0	0	0	111.8	R480 M481 S486 R487 L488	R480-W484 PolarHBondContact O-N 3.39Å; M481-W484 PolarHBondContact O-N 2.87Å; W484-S486 VanDerWaalsContact C-N 3.33Å; W484-S486 PolarHBondContact O-N 3.17Å; W484-R487 WeakPolarHBondContact O-CA 3.4Å; W484-R487 WeakPolarHBondContact O-CB 3.44Å; W484-R487 PolarHBondContact O-N 3.21Å; W484-L488 HydrophobicContact CD2-CD1 4.07Å; W484-L488 HydrophobicContact CE3-CD1 3.86Å; W484-L488 HydrophobicContact CH2-CD1 3.54Å; W484-L488 HydrophobicContact CZ2-CD1 3.73Å; W484-L488 HydrophobicContact CZ2-CG 4.49Å; W484-L488 HydrophobicContact CZ3-CD1 3.6Å; W484-L488 PolarHBondContact O-N 3.26Å
485	A	76.5	Confident	72.2	Confident	46 Å²	46	121.7 Å²	121.7	38%	0.38	62%	0.617	S	S	.	*	H	α-helix	trans	-58.4	-42.2	172.4	0	0	0	0	0	112	M481 R487 L488 M489	M481-A485 WeakPolarHBondContact O-CB 3.46Å; M481-A485 PolarHBondContact O-N 3.13Å; A485-R487 PolarHBondContact O-N 2.97Å; A485-L488 PolarHBondContact O-N 2.97Å; A485-M489 WeakPolarHBondContact O-CB 3.45Å; A485-M489 WeakPolarHBondContact O-CG 3.36Å; A485-M489 PolarHBondContact O-N 3.28Å
486	S	79.3	Confident	70.5	Confident	49 Å²	49	124.5 Å²	124.5	34%	0.343	64%	0.635	S	S	.	*	H	α-helix	trans	-66.8	-17.6	174.4	-166.4	0	0	0	0	114	K482 R483 W484 R490	K482-S486 WeakPolarHBondContact O-CB 3.39Å; K482-S486 PolarHBondContact O-N 3.39Å; R483-S486 PolarHBondContact O-N 3.21Å; W484-S486 VanDerWaalsContact C-N 3.33Å; W484-S486 PolarHBondContact O-N 3.17Å; S486-R490 WeakPolarHBondContact O-CD 3.44Å; S486-R490 WeakPolarHBondContact O-CG 3.21Å; S486-R490 PolarHBondContact O-NE 2.89Å; S486-R490 PolarHBondContact OG-NH2 2.92Å
487	R	79.4	Confident	68.6	Low	195 Å²	195	134.9 Å²	134.9	74%	0.736	68%	0.675	S	S	*	*	H	α-helix	trans	-84.3	-39.9	169.5	-75	179.5	175.2	-171.9	-2.6	112	R483 W484 A485 R490	R483-R487 PolarHBondContact O-N 3.03Å; R483-R487 VanDerWaalsContact O-N 3.13Å; W484-R487 WeakPolarHBondContact O-CA 3.4Å; W484-R487 WeakPolarHBondContact O-CB 3.44Å; W484-R487 PolarHBondContact O-N 3.21Å; A485-R487 PolarHBondContact O-N 2.97Å; R487-R490 CarbonylContact O-C 3.35Å; R487-R490 PolarHBondContact O-N 3.27Å
488	L	73.3	Confident	68	Low	108 Å²	108	136 Å²	136	57%	0.565	68%	0.683	S	S	*	*	H	α-helix	trans	-65.5	-38.9	174.5	-70.2	178	0	0	0	112.7	W484 A485 R490 G491	W484-L488 HydrophobicContact CD2-CD1 4.07Å; W484-L488 HydrophobicContact CE3-CD1 3.86Å; W484-L488 HydrophobicContact CH2-CD1 3.54Å; W484-L488 HydrophobicContact CZ2-CD1 3.73Å; W484-L488 HydrophobicContact CZ2-CG 4.49Å; W484-L488 HydrophobicContact CZ3-CD1 3.6Å; W484-L488 PolarHBondContact O-N 3.26Å; A485-L488 PolarHBondContact O-N 2.97Å; L488-R490 PolarHBondContact O-N 2.94Å; L488-G491 PolarHBondContact O-N 3.41Å
489	M	72.5	Confident	67.4	Low	169 Å²	169	137.5 Å²	137.5	83%	0.833	69%	0.693	S	S	*	*	S	Bend	trans	-62.7	-24.5	173.6	-69.8	-81.5	-76.7	0	0	112.6	A485 G491	A485-M489 WeakPolarHBondContact O-CB 3.45Å; A485-M489 WeakPolarHBondContact O-CG 3.36Å; A485-M489 PolarHBondContact O-N 3.28Å; M489-G491 VanDerWaalsContact C-N 3.29Å; M489-G491 PolarHBondContact O-N 3.17Å
490	R	68.5	Low	66.6	Low	185 Å²	185	138.8 Å²	138.8	70%	0.698	70%	0.702	S	S	*	*	S	Bend	trans	-89.6	73.8	167	-65	172.5	-138.7	-120.2	-0.9	107.7	S486 R487 L488	S486-R490 WeakPolarHBondContact O-CD 3.44Å; S486-R490 WeakPolarHBondContact O-CG 3.21Å; S486-R490 PolarHBondContact O-NE 2.89Å; S486-R490 PolarHBondContact OG-NH2 2.92Å; R487-R490 CarbonylContact O-C 3.35Å; R487-R490 PolarHBondContact O-N 3.27Å; L488-R490 PolarHBondContact O-N 2.94Å
491	G	60	Low	65.7	Low	41 Å²	41	135.9 Å²	135.9	42%	0.423	70%	0.701	S	S	.	*			trans	-51.2	159.6	-179.1	0	0	0	0	0	112.9	L488 M489 C493	L488-G491 PolarHBondContact O-N 3.41Å; M489-G491 VanDerWaalsContact C-N 3.29Å; M489-G491 PolarHBondContact O-N 3.17Å; G491-C493 PolarHBondContact O-N 3.15Å; G491-C493 VanDerWaalsContact O-N 3.15Å
492	P	56.6	Low	64.9	Low	128 Å²	128	136.3 Å²	136.3	83%	0.831	71%	0.705	S	S	*	*			trans	-53.2	122.7	-173.7	23.4	-34.4	0	0	0	110.6	P494	P492-P494 WeakPolarHBondContact O-CD 3.14Å
493	C	55.1	Low	63.7	Low	129 Å²	129	136.8 Å²	136.8	87%	0.872	72%	0.715	S	S	*	*			trans	-52	110.9	-173.2	-66.8	0	0	0	0	111.3	G491 G495	G491-C493 PolarHBondContact O-N 3.15Å; G491-C493 VanDerWaalsContact O-N 3.15Å; C493-G495 PolarHBondContact O-N 3.35Å
494	P	46.7	Very low	62.4	Low	131 Å²	131	133.1 Å²	133.1	85%	0.851	72%	0.715	S	S	*	*			trans	-80.8	114.8	179.8	-4.7	22.4	0	0	0	109.3	P492	P492-P494 WeakPolarHBondContact O-CD 3.14Å
495	G	43.2	Very low	61.3	Low	62 Å²	62	130 Å²	130	64%	0.639	72%	0.719	S	S	*	*			trans	94.3	107.3	165.9	0	0	0	0	0	116	C493	C493-G495 PolarHBondContact O-N 3.35Å
496	L	45.3	Very low	60	Low	184 Å²	184	137 Å²	137	96%	0.963	75%	0.748	S	S	*	*				-126.1	141.5	117.3	-97.7	154	0	0	0	106
497	H	39.9	Very low	58.2	Low	263 Å²	263	145 Å²	145	100%	1.218	78%	0.784	S	S	*	*			trans	-80.3	0	-162.8	-82.2	-79	0	0	0	114.3

Retrieved 497 of 497 residues in 516.6 ms (Link to these results)

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