A0A096M7X4_POEFO Loading...

Nuclear receptor subfamily 5, group A, member 1a

AlphaFold DB , UniProt , Accession A0A096M7X4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 486 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	33.9	Very low	35.5	Very low	232 Å²	232	142.1 Å²	142.1	100%	1.143	84%	0.836	S	S	*	*				0	165.5	0	-64.9	-177.1	-177.7	0	0	108.3
2	L	35.5	Very low	35.2	Very low	170 Å²	170	146.3 Å²	146.3	89%	0.89	84%	0.836	S	S	*	*			trans	36.6	111.1	157	-68.3	160.3	0	0	0	118
3	G	32.5	Very low	35	Very low	76 Å²	76	143.5 Å²	143.5	78%	0.784	82%	0.823	S	S	*	*			trans	-90.7	140.3	160.1	0	0	0	0	0	110.9
4	D	37.3	Very low	35.1	Very low	172 Å²	172	142.8 Å²	142.8	92%	0.92	81%	0.811	S	S	*	*			trans	-77.1	144.6	-176.7	-90.5	-53.7	0	0	0	114.1
5	K	36.8	Very low	34.8	Very low	168 Å²	168	144.4 Å²	144.4	73%	0.73	81%	0.809	S	S	*	*			trans	-89.5	113.7	178.1	-74.4	-178.5	177.2	179.5	0	111.1	H7	K5-H7 PolarHBondContact O-N 3.21Å; K5-H7 VanDerWaalsContact O-N 3.11Å; K5-H7 PolarHBondContact O-ND1 2.91Å
6	A	39.3	Very low	34.5	Very low	106 Å²	106	145.9 Å²	145.9	88%	0.876	80%	0.8	S	S	*	*			trans	-60.6	111.7	161.8	0	0	0	0	0	110.1
7	H	39.3	Very low	34.4	Very low	155 Å²	155	144.5 Å²	144.5	72%	0.718	80%	0.797	S	S	*	*			trans	-96.3	101	174.3	-74.9	77.1	0	0	0	109.3	K5 V9	K5-H7 PolarHBondContact O-N 3.21Å; K5-H7 VanDerWaalsContact O-N 3.11Å; K5-H7 PolarHBondContact O-ND1 2.91Å; H7-V9 PolarHBondContact O-N 3.11Å
8	G	36.2	Very low	34.7	Very low	73 Å²	73	148.7 Å²	148.7	75%	0.753	80%	0.8	S	S	*	*			trans	-67.2	118.8	172.7	0	0	0	0	0	110.8	T10	G8-T10 PolarHBondContact O-N 2.79Å
9	V	34.3	Very low	35.2	Very low	140 Å²	140	148.6 Å²	148.6	85%	0.848	80%	0.8	S	S	*	*			trans	-77.4	107.6	174.1	178.6	0	0	0	0	108.8	H7 L11	H7-V9 PolarHBondContact O-N 3.11Å; V9-L11 PolarHBondContact O-N 2.91Å; V9-L11 VanDerWaalsContact O-N 3.1Å
10	T	35	Very low	35.5	Very low	126 Å²	126	149 Å²	149	77%	0.773	80%	0.802	S	S	*	*			trans	-67	108.2	176.9	-53.6	0	0	0	0	110.5	G8 K12	G8-T10 PolarHBondContact O-N 2.79Å; T10-K12 PolarHBondContact O-N 2.78Å
11	L	30.7	Very low	36.1	Very low	145 Å²	145	146.7 Å²	146.7	76%	0.759	79%	0.789	S	S	*	*			trans	-73.8	90.1	-179.3	-152.7	167.8	0	0	0	110	V9 V13	V9-L11 PolarHBondContact O-N 2.91Å; V9-L11 VanDerWaalsContact O-N 3.1Å; L11-V13 HydrophobicContact CD2-CG2 3.89Å; L11-V13 PolarHBondContact O-N 3.32Å
12	K	31.7	Very low	37.1	Very low	192 Å²	192	142.3 Å²	142.3	84%	0.835	77%	0.769	S	S	*	*			trans	-68.9	96.7	167.7	-83.1	-166.9	174	-175	0	109.2	T10 M14	T10-K12 PolarHBondContact O-N 2.78Å; K12-M14 PolarHBondContact O-N 2.86Å
13	V	33	Very low	38.6	Very low	111 Å²	111	139.1 Å²	139.1	67%	0.673	75%	0.75	S	S	*	*			trans	-61.5	107.9	162.8	-179.1	0	0	0	0	107.3	L11 E15	L11-V13 HydrophobicContact CD2-CG2 3.89Å; L11-V13 PolarHBondContact O-N 3.32Å; V13-E15 HydrophobicContact CG1-CG 4.09Å; V13-E15 PolarHBondContact O-N 3.24Å
14	M	36.2	Very low	40.9	Very low	133 Å²	133	139.8 Å²	139.8	66%	0.655	73%	0.733	S	S	*	*			trans	-87.4	90.5	175.6	-170.2	164.4	178.3	0	0	108.1	K12 Y16	K12-M14 PolarHBondContact O-N 2.86Å; M14-Y16 VanDerWaalsContact C-N 3.34Å; M14-Y16 HydrophobicContact CB-CD2 4.37Å; M14-Y16 HydrophobicContact CB-CE2 4.14Å; M14-Y16 HydrophobicContact CE-CE1 3.97Å; M14-Y16 HydrophobicContact CE-CE2 4.01Å; M14-Y16 WeakPolarHBondContact CE-OH 3.43Å; M14-Y16 HydrophobicContact CG-CD2 3.97Å; M14-Y16 HydrophobicContact CG-CE2 3.62Å; M14-Y16 WeakPolarHBondContact O-CD2 3.32Å; M14-Y16 PolarHBondContact O-N 3.33Å; M14-Y16 HydrophobicContact SD-CE2 3.68Å
15	E	30.3	Very low	43.6	Very low	167 Å²	167	136.2 Å²	136.2	78%	0.78	71%	0.713	S	S	*	*			trans	-65.4	92.3	175.4	-67.5	-171.6	132	0	0	110.2	V13 T17	V13-E15 HydrophobicContact CG1-CG 4.09Å; V13-E15 PolarHBondContact O-N 3.24Å; E15-T17 VanDerWaalsContact C-N 3.35Å; E15-T17 PolarHBondContact O-N 2.95Å
16	Y	30.3	Very low	46.5	Very low	169 Å²	169	128.3 Å²	128.3	66%	0.663	68%	0.679	S	S	*	*			trans	-72.3	89.7	170.7	-81.3	-85.6	0	0	0	109.8	M14 Y18	M14-Y16 VanDerWaalsContact C-N 3.34Å; M14-Y16 HydrophobicContact CB-CD2 4.37Å; M14-Y16 HydrophobicContact CB-CE2 4.14Å; M14-Y16 HydrophobicContact CE-CE1 3.97Å; M14-Y16 HydrophobicContact CE-CE2 4.01Å; M14-Y16 WeakPolarHBondContact CE-OH 3.43Å; M14-Y16 HydrophobicContact CG-CD2 3.97Å; M14-Y16 HydrophobicContact CG-CE2 3.62Å; M14-Y16 WeakPolarHBondContact O-CD2 3.32Å; M14-Y16 PolarHBondContact O-N 3.33Å; M14-Y16 HydrophobicContact SD-CE2 3.68Å; Y16-Y18 PolarHBondContact O-N 3.42Å
17	T	33	Very low	49.1	Very low	121 Å²	121	126 Å²	126	74%	0.742	66%	0.655	S	S	*	*			trans	-61.3	102	170.1	51.2	0	0	0	0	109.9	E15 D19	E15-T17 VanDerWaalsContact C-N 3.35Å; E15-T17 PolarHBondContact O-N 2.95Å; T17-D19 PolarHBondContact O-N 2.95Å
18	Y	40.2	Very low	51.9	Low	220 Å²	220	118.7 Å²	118.7	86%	0.863	62%	0.621	S	S	*	*			trans	-78.1	53.2	-175.4	-114.7	-83.1	0	0	0	112.8	Y16	Y16-Y18 PolarHBondContact O-N 3.42Å
19	D	42.7	Very low	54.8	Low	148 Å²	148	115.4 Å²	115.4	79%	0.791	59%	0.587	S	S	*	*			trans	-127.7	19	-174.4	-99	-47.7	0	0	0	114.1	T17 D21	T17-D19 PolarHBondContact O-N 2.95Å; D19-D21 PolarHBondContact O-N 2.9Å
20	D	41.7	Very low	57.7	Low	156 Å²	156	110.7 Å²	110.7	83%	0.834	57%	0.566	S	S	*	*			trans	-75	77.1	161.4	-164.2	46.5	0	0	0	109.1	L22	D20-L22 PolarHBondContact O-N 3.39Å
21	D	49.1	Very low	60.7	Low	100 Å²	100	105.7 Å²	105.7	54%	0.535	54%	0.535	S	S	.	.			trans	-64.8	123.3	177.8	-163.9	12.4	0	0	0	109	D19 E23 K123	D19-D21 PolarHBondContact O-N 2.9Å; D21-E23 VanDerWaalsContact C-N 3.25Å; D21-E23 PolarHBondContact O-N 3.28Å; D21-K123 IonicContact OD1-NZ 2.67Å; D21-K123 PolarHBondContact OD1-NZ 2.7Å
22	L	54.8	Low	63.8	Low	140 Å²	140	104.3 Å²	104.3	73%	0.733	52%	0.523	S	S	*	.			trans	-61.6	85.5	176.7	-76.7	166.4	0	0	0	110.2	D20 E24	D20-L22 PolarHBondContact O-N 3.39Å; L22-E24 PolarHBondContact O-N 2.88Å
23	E	65.4	Low	66.8	Low	104 Å²	104	96.7 Å²	96.7	49%	0.486	49%	0.492	S	S	.	.			trans	-65.9	98	178.9	-70.9	-149.3	162.6	0	0	109.7	D21 L25 K32	D21-E23 VanDerWaalsContact C-N 3.25Å; D21-E23 PolarHBondContact O-N 3.28Å; E23-L25 WeakPolarHBondContact O-CG 3.47Å; E23-L25 PolarHBondContact O-N 3.22Å; E23-K32 WeakPolarHBondContact OE1-CE 3.48Å; E23-K32 IonicContact OE1-NZ 2.8Å; E23-K32 PolarHBondContact OE1-NZ 3.02Å; E23-K32 VanDerWaalsContact OE2-CD 3.31Å; E23-K32 WeakPolarHBondContact OE2-CD 3.47Å; E23-K32 WeakPolarHBondContact OE2-CE 3.41Å; E23-K32 IonicContact OE2-NZ 3.43Å; E23-K32 PolarHBondContact OE2-NZ 3.35Å
24	E	81.2	Confident	69.7	Low	89 Å²	89	94.5 Å²	94.5	42%	0.416	48%	0.482	S	S	.	.			trans	-58.3	109.9	-178.4	-162.1	175.8	146.6	0	0	109.8	L22 V33 L41 K119	L22-E24 PolarHBondContact O-N 2.88Å; E24-V33 VanDerWaalsContact O-CB 3.23Å; E24-V33 WeakPolarHBondContact O-CB 3.32Å; E24-V33 WeakPolarHBondContact O-CG2 3.45Å; E24-L41 WeakPolarHBondContact OE2-CD1 3.4Å; E24-K119 IonicContact OE1-NZ 2.98Å; E24-K119 PolarHBondContact OE1-NZ 3.39Å; E24-K119 IonicContact OE2-NZ 3.92Å; E24-K119 PolarHBondContact OE2-NZ 3.2Å
25	L	94.9	Very high	72.3	Confident	98 Å²	98	89.2 Å²	89.2	51%	0.513	46%	0.461	S	S	.	.	B	Isolated β-bridge	trans	-82.8	145.7	-177.8	-60.4	-176.9	0	0	0	111	E23 P27	E23-L25 WeakPolarHBondContact O-CG 3.47Å; E23-L25 PolarHBondContact O-N 3.22Å; L25-P27 WeakPolarHBondContact O-CD 3.3Å; L25-P27 VanDerWaalsContact O-N 3.15Å
26	C	96.5	Very high	75.3	Confident	1 Å²	1	83.1 Å²	83.1	1%	0.007	43%	0.431	C	S	.	.			trans	-63	115	-177.9	173.6	0	0	0	0	111.1	V28 C29 G30 D31 V33 C43	C26-V28 PolarHBondContact O-N 2.9Å; C26-C29 PolarHBondContact O-N 3.32Å; C26-G30 PolarHBondContact O-N 3.48Å; C26-D31 WeakPolarHBondContact CB-O 3.43Å; C26-D31 PolarHBondContact N-O 3.31Å; C26-V33 HydrophobicContact CB-CG2 4.33Å; C26-C43 HydrophobicContact CB-CB 3.81Å; C26-C43 PolarHBondContact SG-N 3.01Å; C26-C43 VanDerWaalsContact SG-SG 3.63Å
27	P	95.3	Very high	78.3	Confident	59 Å²	59	76.2 Å²	76.2	38%	0.383	41%	0.405	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-23.7	-170.7	23.3	-34	0	0	0	113.7	L25 C29 L40 L41 K85 V89	L25-P27 WeakPolarHBondContact O-CD 3.3Å; L25-P27 VanDerWaalsContact O-N 3.15Å; P27-C29 VanDerWaalsContact C-N 3.35Å; P27-C29 PolarHBondContact O-N 3.47Å; P27-L40 HydrophobicContact CG-CD1 3.61Å; P27-L41 WeakPolarHBondContact CD-O 3.41Å; P27-K85 VanDerWaalsContact O-CE 3.26Å; P27-K85 WeakPolarHBondContact O-CE 3.42Å; P27-K85 PolarHBondContact O-NZ 3.43Å; P27-V89 HydrophobicContact CB-CB 4.4Å; P27-V89 HydrophobicContact CB-CG1 4.12Å; P27-V89 HydrophobicContact CG-CB 4.29Å; P27-V89 HydrophobicContact CG-CG2 4.3Å
28	V	97.7	Very high	81.2	Confident	0 Å²	0	72.2 Å²	72.2	0%	0	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-38	171.4	-173.5	0	0	0	0	112.5	C26 T42 C46 I70 R82 K85 V89 M91	C26-V28 PolarHBondContact O-N 2.9Å; V28-T42 HydrophobicContact CG2-CG2 4.4Å; V28-C46 HydrophobicContact CB-CB 4.39Å; V28-C46 HydrophobicContact CG1-CB 4.5Å; V28-C46 HydrophobicContact CG2-CB 4.36Å; V28-I70 HydrophobicContact CG1-CG2 4.16Å; V28-I70 VanDerWaalsContact O-CG2 3.23Å; V28-I70 WeakPolarHBondContact O-CG2 3.49Å; V28-R82 HydrophobicContact CG1-CG 4.35Å; V28-K85 VanDerWaalsContact O-CD 3.31Å; V28-K85 WeakPolarHBondContact O-CD 3.32Å; V28-K85 VanDerWaalsContact O-CE 3.26Å; V28-K85 WeakPolarHBondContact O-CE 3.41Å; V28-K85 PolarHBondContact O-NZ 3.39Å; V28-V89 HydrophobicContact CG2-CG2 3.61Å; V28-M91 HydrophobicContact CG2-SD 4.21Å
29	C	97	Very high	83.5	Confident	4 Å²	4	62 Å²	62	3%	0.027	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-154.9	7.7	-165	67.5	0	0	0	0	118	C26 P27 D31 I70 D71 K72 R75	C26-C29 PolarHBondContact O-N 3.32Å; P27-C29 VanDerWaalsContact C-N 3.35Å; P27-C29 PolarHBondContact O-N 3.47Å; C29-D31 PolarHBondContact O-N 3.27Å; C29-D31 VanDerWaalsContact O-N 3.14Å; C29-I70 HydrophobicContact CB-CG2 4.07Å; C29-D71 CarbonylContact O-C 3.25Å; C29-D71 VanDerWaalsContact O-C 3.25Å; C29-D71 VanDerWaalsContact O-CA 3.31Å; C29-D71 WeakPolarHBondContact O-CA 3.42Å; C29-K72 PolarHBondContact O-N 3.28Å; C29-R75 HydrophobicContact CB-CB 4.35Å; C29-R75 PolarHBondContact SG-NH1 2.9Å
30	G	95.6	Very high	85.8	Confident	41 Å²	41	56.6 Å²	56.6	42%	0.423	31%	0.309	S	S	.	.	S	Bend	trans	69.4	6.1	178.2	0	0	0	0	0	115.8	C26	C26-G30 PolarHBondContact O-N 3.48Å
31	D	96.6	Very high	88.3	Confident	22 Å²	22	50.2 Å²	50.2	12%	0.118	28%	0.275	C	S	.	.	P	Polyproline II helix	trans	-84.5	153	175.4	-165.8	19.8	0	0	0	111.3	C26 C29 V33 C43 K72 R75	C26-D31 WeakPolarHBondContact CB-O 3.43Å; C26-D31 PolarHBondContact N-O 3.31Å; C29-D31 PolarHBondContact O-N 3.27Å; C29-D31 VanDerWaalsContact O-N 3.14Å; D31-V33 PolarHBondContact O-N 3.13Å; D31-C43 HydrophobicContact CB-CB 4.03Å; D31-K72 HydrophobicContact CB-CB 4.27Å; D31-K72 HydrophobicContact CB-CD 4.14Å; D31-K72 HydrophobicContact CB-CG 4.08Å; D31-K72 VanDerWaalsContact OD1-CD 3.31Å; D31-K72 WeakPolarHBondContact OD1-CD 3.45Å; D31-K72 WeakPolarHBondContact OD1-CE 3.45Å; D31-K72 IonicContact OD1-NZ 3.23Å; D31-K72 PolarHBondContact OD1-NZ 3.26Å; D31-R75 VanDerWaalsContact CB-NH1 3.31Å; D31-R75 IonicContact OD2-CZ 2.72Å; D31-R75 IonicContact OD2-NH1 3.03Å; D31-R75 PolarHBondContact OD2-NH1 2.75Å; D31-R75 IonicContact OD2-NH2 2.73Å; D31-R75 PolarHBondContact OD2-NH2 3.11Å
32	K	95.9	Very high	90.5	Very high	115 Å²	115	45.4 Å²	45.4	50%	0.5	25%	0.249	S	C	.	.	B	Isolated β-bridge	trans	-57.6	133.6	-173.6	-173.2	165.2	-177.5	151.8	0	112	E23 C43	E23-K32 WeakPolarHBondContact OE1-CE 3.48Å; E23-K32 IonicContact OE1-NZ 2.8Å; E23-K32 PolarHBondContact OE1-NZ 3.02Å; E23-K32 VanDerWaalsContact OE2-CD 3.31Å; E23-K32 WeakPolarHBondContact OE2-CD 3.47Å; E23-K32 WeakPolarHBondContact OE2-CE 3.41Å; E23-K32 IonicContact OE2-NZ 3.43Å; E23-K32 PolarHBondContact OE2-NZ 3.35Å; K32-C43 WeakPolarHBondContact O-CA 3.4Å; K32-C43 WeakPolarHBondContact O-CB 3.32Å
33	V	95.3	Very high	92.6	Very high	33 Å²	33	38.8 Å²	38.8	20%	0.2	22%	0.215	C	C	.	.	P	Polyproline II helix	trans	-66.2	139.6	176.9	159.6	0	0	0	0	110.9	E24 C26 D31 L41	E24-V33 VanDerWaalsContact O-CB 3.23Å; E24-V33 WeakPolarHBondContact O-CB 3.32Å; E24-V33 WeakPolarHBondContact O-CG2 3.45Å; C26-V33 HydrophobicContact CB-CG2 4.33Å; D31-V33 PolarHBondContact O-N 3.13Å; V33-L41 HydrophobicContact CG1-CB 3.84Å; V33-L41 HydrophobicContact CG1-CD1 4.48Å; V33-L41 HydrophobicContact CG1-CD2 3.88Å; V33-L41 HydrophobicContact CG1-CG 4.27Å; V33-L41 HydrophobicContact CG2-CB 4.07Å
34	S	94.3	Very high	94.1	Very high	65 Å²	65	38.6 Å²	38.6	46%	0.455	21%	0.214	S	C	.	.			trans	-109.9	-0.3	171.9	66.8	0	0	0	0	113.7	H37 T42 E44	S34-H37 PolarHBondContact OG-NE2 3.1Å; S34-T42 PolarHBondContact N-O 3Å; S34-E44 PolarHBondContact OG-N 3.38Å; S34-E44 PolarHBondContact OG-OE2 2.97Å
35	G	91.1	Very high	94.9	Very high	21 Å²	21	36.5 Å²	36.5	22%	0.216	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	138.9	-171	177.2	0	0	0	0	0	113.7	H37 L41 T42	G35-H37 PolarHBondContact O-CD2 2.93Å; G35-H37 PolarHBondContact O-N 2.94Å; G35-H37 PolarHBondContact O-NE2 2.85Å; G35-L41 WeakPolarHBondContact O-CA 3.48Å; G35-T42 PolarHBondContact O-N 3.11Å; G35-T42 VanDerWaalsContact O-N 3.09Å
36	Y	91.9	Very high	95.1	Very high	40 Å²	40	31.8 Å²	31.8	16%	0.157	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	117.1	177.4	-72.2	-92.6	0	0	0	110.1	L40 L41 Y112 D115 R116	Y36-L40 WeakPolarHBondContact CA-O 3.49Å; Y36-L41 HydrophobicContact CD1-CD2 4.01Å; Y36-L41 HydrophobicContact CD1-CG 4.18Å; Y36-L41 HydrophobicContact CD2-CD2 3.41Å; Y36-L41 VanDerWaalsContact CD2-CD2 3.41Å; Y36-L41 HydrophobicContact CD2-CG 4.31Å; Y36-L41 HydrophobicContact CE1-CD2 4.09Å; Y36-L41 HydrophobicContact CE1-CG 3.94Å; Y36-L41 HydrophobicContact CE2-CD1 4.45Å; Y36-L41 HydrophobicContact CE2-CD2 3.49Å; Y36-L41 VanDerWaalsContact CE2-CD2 3.49Å; Y36-L41 HydrophobicContact CE2-CG 4.07Å; Y36-L41 HydrophobicContact CG-CD2 3.67Å; Y36-L41 HydrophobicContact CG-CG 4.35Å; Y36-Y112 AromaticContact CD1-CD1 3.51Å; Y36-Y112 HydrophobicContact CD1-CD1 3.51Å; Y36-Y112 HydrophobicContact CD1-CE1 4.1Å; Y36-Y112 AromaticContact CD1-CG 3.97Å; Y36-Y112 HydrophobicContact CD1-CG 3.97Å; Y36-Y112 HydrophobicContact CE1-CD1 4.23Å; Y36-Y112 AromaticContact CG-CD1 3.92Å; Y36-Y112 HydrophobicContact CG-CD1 3.92Å; Y36-Y112 HydrophobicContact CG-CE1 4.5Å; Y36-Y112 AromaticContact CG-CG 3.93Å; Y36-Y112 HydrophobicContact CG-CG 3.93Å; Y36-D115 HydrophobicContact CE1-CB 4.21Å; Y36-D115 WeakPolarHBondContact CE1-OD2 3.06Å; Y36-D115 PolarHBondContact OH-OD2 2.75Å; Y36-R116 PolarHBondContact OH-N 2.95Å
37	H	94.1	Very high	95.1	Very high	23 Å²	23	34.3 Å²	34.3	11%	0.106	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	119	178	-49.4	-64.2	0	0	0	109.8	S34 G35 G39 L40 T42 E44 K47	S34-H37 PolarHBondContact OG-NE2 3.1Å; G35-H37 PolarHBondContact O-CD2 2.93Å; G35-H37 PolarHBondContact O-N 2.94Å; G35-H37 PolarHBondContact O-NE2 2.85Å; H37-G39 VanDerWaalsContact C-N 3.31Å; H37-G39 PolarHBondContact O-N 2.92Å; H37-L40 PolarHBondContact N-O 3.49Å; H37-T42 PolarHBondContact CD2-O 2.96Å; H37-T42 PolarHBondContact CD2-OG1 2.86Å; H37-E44 IonicContact CE1-OE2 3.85Å; H37-E44 IonicContact NE2-OE2 2.76Å; H37-K47 HydrophobicContact CB-CB 3.79Å; H37-K47 HydrophobicContact CB-CD 4.44Å; H37-K47 HydrophobicContact CB-CG 3.78Å; H37-K47 VanDerWaalsContact CE1-CE 3.45Å; H37-K47 WeakPolarHBondContact CE1-CE 3.29Å; H37-K47 WeakPolarHBondContact ND1-CD 3.48Å; H37-K47 WeakPolarHBondContact ND1-CE 3.48Å
38	Y	93.2	Very high	95.2	Very high	38 Å²	38	32.2 Å²	32.2	15%	0.149	19%	0.185	C	C	.	.	T	Hydrogen-bonded Turn	trans	55.4	38.1	174.9	-44.8	-68.4	0	0	0	114.8	K47 F50 K51 M91 R92 A95 V96	Y38-K47 HydrophobicContact CE2-CB 4.3Å; Y38-K47 HydrophobicContact CE2-CG 3.75Å; Y38-K47 WeakPolarHBondContact CE2-O 3.48Å; Y38-F50 AromaticContact CD2-CD1 3.79Å; Y38-F50 HydrophobicContact CD2-CD1 3.79Å; Y38-F50 HydrophobicContact CE2-CD1 4.46Å; Y38-F50 AromaticContact CG-CD1 3.86Å; Y38-F50 HydrophobicContact CG-CD1 3.86Å; Y38-F50 HydrophobicContact CG-CE1 4.17Å; Y38-K51 HydrophobicContact CE2-CB 4.31Å; Y38-K51 WeakPolarHBondContact OH-CB 3.5Å; Y38-M91 HydrophobicContact CD2-CE 3.77Å; Y38-M91 HydrophobicContact CG-CE 4.47Å; Y38-M91 CarbonylContact O-C 3.55Å; Y38-M91 WeakPolarHBondContact O-CA 3.5Å; Y38-R92 WeakPolarHBondContact O-CB 3.41Å; Y38-R92 PolarHBondContact O-N 3.46Å; Y38-A95 HydrophobicContact CD1-CB 3.97Å; Y38-V96 HydrophobicContact CD1-CG2 3.68Å; Y38-V96 HydrophobicContact CE1-CB 4.48Å; Y38-V96 HydrophobicContact CE1-CG2 3.81Å; Y38-V96 HydrophobicContact CG-CG2 4.29Å
39	G	88.5	Confident	95.3	Very high	6 Å²	6	33 Å²	33	6%	0.062	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	125.5	-39	173.7	0	0	0	0	0	114.3	H37 M111 Y112	H37-G39 VanDerWaalsContact C-N 3.31Å; H37-G39 PolarHBondContact O-N 2.92Å; G39-M111 WeakPolarHBondContact O-CE 3.22Å; G39-Y112 PolarHBondContact N-OH 3.12Å; G39-Y112 VanDerWaalsContact N-OH 3.12Å
40	L	92.1	Very high	95.3	Very high	33 Å²	33	32.8 Å²	32.8	17%	0.173	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	174.3	-172.2	66.6	145.9	0	0	0	113.3	P27 Y36 H37 T42 V89 G90 M91	P27-L40 HydrophobicContact CG-CD1 3.61Å; Y36-L40 WeakPolarHBondContact CA-O 3.49Å; H37-L40 PolarHBondContact N-O 3.49Å; L40-T42 HydrophobicContact CD1-CG2 4.11Å; L40-T42 HydrophobicContact CG-CG2 4.1Å; L40-T42 PolarHBondContact O-N 2.99Å; L40-V89 HydrophobicContact CD1-CB 4.38Å; L40-V89 HydrophobicContact CD1-CG2 4.07Å; L40-V89 VanDerWaalsContact CD1-O 3.32Å; L40-V89 WeakPolarHBondContact CD1-O 3.46Å; L40-V89 VanDerWaalsContact CD2-O 3.3Å; L40-V89 WeakPolarHBondContact CD2-O 3.46Å; L40-G90 VanDerWaalsContact CD2-C 3.4Å; L40-G90 WeakPolarHBondContact CD2-O 3.27Å; L40-M91 HydrophobicContact CD2-CB 4.43Å; L40-M91 HydrophobicContact CD2-CG 3.73Å
41	L	92.9	Very high	95.3	Very high	22 Å²	22	35.1 Å²	35.1	12%	0.115	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	121.8	174.6	-71.7	-177.5	0	0	0	111.5	E24 P27 V33 G35 Y36	E24-L41 WeakPolarHBondContact OE2-CD1 3.4Å; P27-L41 WeakPolarHBondContact CD-O 3.41Å; V33-L41 HydrophobicContact CG1-CB 3.84Å; V33-L41 HydrophobicContact CG1-CD1 4.48Å; V33-L41 HydrophobicContact CG1-CD2 3.88Å; V33-L41 HydrophobicContact CG1-CG 4.27Å; V33-L41 HydrophobicContact CG2-CB 4.07Å; G35-L41 WeakPolarHBondContact O-CA 3.48Å; Y36-L41 HydrophobicContact CD1-CD2 4.01Å; Y36-L41 HydrophobicContact CD1-CG 4.18Å; Y36-L41 HydrophobicContact CD2-CD2 3.41Å; Y36-L41 VanDerWaalsContact CD2-CD2 3.41Å; Y36-L41 HydrophobicContact CD2-CG 4.31Å; Y36-L41 HydrophobicContact CE1-CD2 4.09Å; Y36-L41 HydrophobicContact CE1-CG 3.94Å; Y36-L41 HydrophobicContact CE2-CD1 4.45Å; Y36-L41 HydrophobicContact CE2-CD2 3.49Å; Y36-L41 VanDerWaalsContact CE2-CD2 3.49Å; Y36-L41 HydrophobicContact CE2-CG 4.07Å; Y36-L41 HydrophobicContact CG-CD2 3.67Å; Y36-L41 HydrophobicContact CG-CG 4.35Å
42	T	96.5	Very high	95.3	Very high	0 Å²	0	41 Å²	41	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	169.2	177.1	53.6	0	0	0	0	112.5	V28 S34 G35 H37 L40 M91	V28-T42 HydrophobicContact CG2-CG2 4.4Å; S34-T42 PolarHBondContact N-O 3Å; G35-T42 PolarHBondContact O-N 3.11Å; G35-T42 VanDerWaalsContact O-N 3.09Å; H37-T42 PolarHBondContact CD2-O 2.96Å; H37-T42 PolarHBondContact CD2-OG1 2.86Å; L40-T42 HydrophobicContact CD1-CG2 4.11Å; L40-T42 HydrophobicContact CG-CG2 4.1Å; L40-T42 PolarHBondContact O-N 2.99Å; T42-M91 HydrophobicContact CG2-CE 4.49Å; T42-M91 HydrophobicContact CG2-SD 4.19Å
43	C	97.8	Very high	95.4	Very high	1 Å²	1	35.7 Å²	35.7	1%	0.007	18%	0.183	C	C	.	.			trans	-79.5	154.8	172.5	71.5	0	0	0	0	112.2	C26 D31 K32 S45 C46 K47 R75	C26-C43 HydrophobicContact CB-CB 3.81Å; C26-C43 PolarHBondContact SG-N 3.01Å; C26-C43 VanDerWaalsContact SG-SG 3.63Å; D31-C43 HydrophobicContact CB-CB 4.03Å; K32-C43 WeakPolarHBondContact O-CA 3.4Å; K32-C43 WeakPolarHBondContact O-CB 3.32Å; C43-S45 PolarHBondContact O-N 2.97Å; C43-S45 VanDerWaalsContact O-N 3.13Å; C43-C46 PolarHBondContact O-N 3Å; C43-C46 VanDerWaalsContact SG-SG 3.66Å; C43-K47 PolarHBondContact O-N 2.94Å; C43-K47 VanDerWaalsContact O-N 3.13Å; C43-R75 PolarHBondContact SG-NH1 3.46Å
44	E	97.8	Very high	95.4	Very high	100 Å²	100	36 Å²	36	47%	0.467	19%	0.185	S	C	.	.	H	α-helix	trans	-55.8	-33.2	-179.3	-164.4	62.2	-156.1	0	0	113.2	S34 H37 K47 G48	S34-E44 PolarHBondContact OG-N 3.38Å; S34-E44 PolarHBondContact OG-OE2 2.97Å; H37-E44 IonicContact CE1-OE2 3.85Å; H37-E44 IonicContact NE2-OE2 2.76Å; E44-K47 VanDerWaalsContact CD-CD 3.42Å; E44-K47 VanDerWaalsContact OE1-CD 3.26Å; E44-K47 WeakPolarHBondContact OE1-CD 3.47Å; E44-K47 WeakPolarHBondContact OE1-CE 3.17Å; E44-K47 IonicContact OE1-NZ 2.76Å; E44-K47 PolarHBondContact OE1-NZ 3.03Å; E44-K47 WeakPolarHBondContact OE2-CD 3.24Å; E44-K47 IonicContact OE2-NZ 3.18Å; E44-K47 PolarHBondContact OE2-NZ 3.4Å; E44-G48 PolarHBondContact O-N 3.29Å
45	S	97.8	Very high	95.3	Very high	44 Å²	44	35.1 Å²	35.1	31%	0.308	17%	0.173	S	C	.	.	H	α-helix	trans	-65	-42.4	177.5	-168.9	0	0	0	0	112.6	C43 F49 R82	C43-S45 PolarHBondContact O-N 2.97Å; C43-S45 VanDerWaalsContact O-N 3.13Å; S45-F49 VanDerWaalsContact O-CB 3.27Å; S45-F49 WeakPolarHBondContact O-CB 3.37Å; S45-F49 PolarHBondContact O-N 2.96Å; S45-R82 VanDerWaalsContact C-NH2 3.31Å; S45-R82 PolarHBondContact O-NH2 3.13Å; S45-R82 PolarHBondContact OG-NH2 2.71Å
46	C	98.4	Very high	95.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-76.8	-40	-179	-70.1	0	0	0	0	111.8	V28 C43 G48 F49 F50 R82	V28-C46 HydrophobicContact CB-CB 4.39Å; V28-C46 HydrophobicContact CG1-CB 4.5Å; V28-C46 HydrophobicContact CG2-CB 4.36Å; C43-C46 PolarHBondContact O-N 3Å; C43-C46 VanDerWaalsContact SG-SG 3.66Å; C46-G48 PolarHBondContact O-N 2.86Å; C46-F49 PolarHBondContact O-N 3.44Å; C46-F50 VanDerWaalsContact O-CB 3.28Å; C46-F50 WeakPolarHBondContact O-CB 3.3Å; C46-F50 PolarHBondContact O-N 3.4Å; C46-R82 PolarHBondContact SG-NH2 3.19Å
47	K	97.8	Very high	95.4	Very high	53 Å²	53	42.2 Å²	42.2	23%	0.23	21%	0.209	C	C	.	.	H	α-helix	trans	-49.3	-54.5	165.1	170.4	-154.5	-163.7	-179.7	0	111.9	H37 Y38 C43 E44 K51	H37-K47 HydrophobicContact CB-CB 3.79Å; H37-K47 HydrophobicContact CB-CD 4.44Å; H37-K47 HydrophobicContact CB-CG 3.78Å; H37-K47 VanDerWaalsContact CE1-CE 3.45Å; H37-K47 WeakPolarHBondContact CE1-CE 3.29Å; H37-K47 WeakPolarHBondContact ND1-CD 3.48Å; H37-K47 WeakPolarHBondContact ND1-CE 3.48Å; Y38-K47 HydrophobicContact CE2-CB 4.3Å; Y38-K47 HydrophobicContact CE2-CG 3.75Å; Y38-K47 WeakPolarHBondContact CE2-O 3.48Å; C43-K47 PolarHBondContact O-N 2.94Å; C43-K47 VanDerWaalsContact O-N 3.13Å; E44-K47 VanDerWaalsContact CD-CD 3.42Å; E44-K47 VanDerWaalsContact OE1-CD 3.26Å; E44-K47 WeakPolarHBondContact OE1-CD 3.47Å; E44-K47 WeakPolarHBondContact OE1-CE 3.17Å; E44-K47 IonicContact OE1-NZ 2.76Å; E44-K47 PolarHBondContact OE1-NZ 3.03Å; E44-K47 WeakPolarHBondContact OE2-CD 3.24Å; E44-K47 IonicContact OE2-NZ 3.18Å; E44-K47 PolarHBondContact OE2-NZ 3.4Å; K47-K51 WeakPolarHBondContact O-CB 3.41Å; K47-K51 PolarHBondContact O-N 3.34Å
48	G	97.5	Very high	95.5	Very high	16 Å²	16	46.6 Å²	46.6	17%	0.165	23%	0.228	C	C	.	.	H	α-helix	trans	-66.7	-37.3	-177.7	0	0	0	0	0	113.2	E44 C46 R52	E44-G48 PolarHBondContact O-N 3.29Å; C46-G48 PolarHBondContact O-N 2.86Å; G48-R52 WeakPolarHBondContact O-CG 3.36Å; G48-R52 VanDerWaalsContact O-CZ 3.27Å; G48-R52 PolarHBondContact O-N 2.8Å; G48-R52 PolarHBondContact O-NH1 2.81Å
49	F	98.5	Very high	95.5	Very high	16 Å²	16	55.9 Å²	55.9	7%	0.07	26%	0.263	C	S	.	.	H	α-helix	trans	-63.3	-56.7	173.3	172.7	-101.8	0	0	0	111.5	S45 C46 K51 R52 T53 Y60 P79 R82 F83	S45-F49 VanDerWaalsContact O-CB 3.27Å; S45-F49 WeakPolarHBondContact O-CB 3.37Å; S45-F49 PolarHBondContact O-N 2.96Å; C46-F49 PolarHBondContact O-N 3.44Å; F49-K51 PolarHBondContact O-N 3.27Å; F49-R52 PolarHBondContact O-N 2.93Å; F49-T53 PolarHBondContact O-N 3.06Å; F49-T53 PolarHBondContact O-OG1 3.49Å; F49-T53 VanDerWaalsContact O-OG1 3.08Å; F49-Y60 AromaticContact CE2-CE2 3.9Å; F49-Y60 HydrophobicContact CE2-CE2 3.9Å; F49-Y60 HydrophobicContact CZ-CD2 4.38Å; F49-Y60 AromaticContact CZ-CE2 3.64Å; F49-Y60 HydrophobicContact CZ-CE2 3.64Å; F49-P79 HydrophobicContact CE2-CB 4.07Å; F49-P79 HydrophobicContact CZ-CB 4.19Å; F49-P79 WeakPolarHBondContact CZ-O 3.44Å; F49-R82 HydrophobicContact CD1-CG 3.93Å; F49-R82 HydrophobicContact CE1-CB 3.99Å; F49-R82 HydrophobicContact CE1-CG 3.69Å; F49-R82 HydrophobicContact CZ-CB 4.14Å; F49-R82 HydrophobicContact CZ-CG 4.22Å; F49-F83 HydrophobicContact CE1-CB 3.82Å; F49-F83 HydrophobicContact CE1-CD2 4.2Å; F49-F83 HydrophobicContact CE1-CG 4.5Å; F49-F83 HydrophobicContact CZ-CB 3.99Å
50	F	98.1	Very high	95.9	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-55.3	-47.6	-179.1	-170	-99.8	0	0	0	112	Y38 C46 R52 T53 V54 F83 C86 L87 M91 R92 L93 V96	Y38-F50 AromaticContact CD2-CD1 3.79Å; Y38-F50 HydrophobicContact CD2-CD1 3.79Å; Y38-F50 HydrophobicContact CE2-CD1 4.46Å; Y38-F50 AromaticContact CG-CD1 3.86Å; Y38-F50 HydrophobicContact CG-CD1 3.86Å; Y38-F50 HydrophobicContact CG-CE1 4.17Å; C46-F50 VanDerWaalsContact O-CB 3.28Å; C46-F50 WeakPolarHBondContact O-CB 3.3Å; C46-F50 PolarHBondContact O-N 3.4Å; F50-R52 PolarHBondContact O-N 2.91Å; F50-T53 PolarHBondContact O-N 2.85Å; F50-V54 HydrophobicContact CD1-CG2 4.33Å; F50-V54 HydrophobicContact CE1-CG2 4.07Å; F50-V54 HydrophobicContact CE2-CG2 4.43Å; F50-V54 HydrophobicContact CZ-CG2 4.11Å; F50-V54 WeakPolarHBondContact O-CG2 3.42Å; F50-V54 PolarHBondContact O-N 3.45Å; F50-F83 AromaticContact CD2-CD2 3.96Å; F50-F83 HydrophobicContact CD2-CD2 3.96Å; F50-F83 AromaticContact CD2-CE2 3.59Å; F50-F83 HydrophobicContact CD2-CE2 3.59Å; F50-F83 HydrophobicContact CE2-CD2 4.28Å; F50-F83 AromaticContact CE2-CE2 3.61Å; F50-F83 HydrophobicContact CE2-CE2 3.61Å; F50-F83 HydrophobicContact CE2-CZ 4.38Å; F50-C86 HydrophobicContact CD2-CB 3.68Å; F50-C86 HydrophobicContact CE2-CB 4.14Å; F50-L87 HydrophobicContact CE2-CD2 3.9Å; F50-L87 HydrophobicContact CZ-CD2 4.28Å; F50-M91 HydrophobicContact CB-CE 3.68Å; F50-M91 HydrophobicContact CB-SD 4.27Å; F50-M91 HydrophobicContact CD1-CB 4.35Å; F50-M91 HydrophobicContact CD1-CE 4Å; F50-M91 HydrophobicContact CD2-CB 3.89Å; F50-M91 HydrophobicContact CD2-CE 4.32Å; F50-M91 HydrophobicContact CD2-SD 4.21Å; F50-M91 HydrophobicContact CE1-CB 4.08Å; F50-M91 HydrophobicContact CE2-CB 3.59Å; F50-M91 HydrophobicContact CG-CB 4.26Å; F50-M91 HydrophobicContact CG-CE 3.75Å; F50-M91 HydrophobicContact CG-SD 4.22Å; F50-M91 HydrophobicContact CZ-CB 3.7Å; F50-M91 WeakPolarHBondContact CZ-O 3.43Å; F50-R92 WeakPolarHBondContact CE1-O 3.27Å; F50-L93 HydrophobicContact CE2-CD2 4.39Å; F50-L93 HydrophobicContact CZ-CD2 3.95Å; F50-V96 HydrophobicContact CD1-CG2 3.87Å; F50-V96 HydrophobicContact CE1-CG2 3.7Å
51	K	95.8	Very high	96.1	Very high	89 Å²	89	63.4 Å²	63.4	39%	0.387	30%	0.302	S	S	.	.	H	α-helix	trans	-53.2	-49.5	174.6	-175.9	-178.9	173.1	177.2	0	112.1	Y38 K47 F49 Q55	Y38-K51 HydrophobicContact CE2-CB 4.31Å; Y38-K51 WeakPolarHBondContact OH-CB 3.5Å; K47-K51 WeakPolarHBondContact O-CB 3.41Å; K47-K51 PolarHBondContact O-N 3.34Å; F49-K51 PolarHBondContact O-N 3.27Å; K51-Q55 HydrophobicContact CG-CG 4.2Å; K51-Q55 VanDerWaalsContact O-CB 3.29Å; K51-Q55 WeakPolarHBondContact O-CB 3.39Å; K51-Q55 WeakPolarHBondContact O-CG 3.33Å; K51-Q55 PolarHBondContact O-N 3.08Å
52	R	96.4	Very high	96.3	Very high	147 Å²	147	63.4 Å²	63.4	56%	0.555	30%	0.303	S	S	*	.	H	α-helix	trans	-69.9	-31.5	-178.1	-74.1	-171.8	-57.1	-91.3	-2.6	112.8	G48 F49 F50 N56	G48-R52 WeakPolarHBondContact O-CG 3.36Å; G48-R52 VanDerWaalsContact O-CZ 3.27Å; G48-R52 PolarHBondContact O-N 2.8Å; G48-R52 PolarHBondContact O-NH1 2.81Å; F49-R52 PolarHBondContact O-N 2.93Å; F50-R52 PolarHBondContact O-N 2.91Å; R52-N56 WeakPolarHBondContact O-CB 3.49Å; R52-N56 PolarHBondContact O-ND2 2.86Å
53	T	97.3	Very high	96.3	Very high	2 Å²	2	68 Å²	68	1%	0.012	34%	0.342	C	S	.	.	H	α-helix	trans	-66.4	-51.4	175.4	-54.3	0	0	0	0	110.3	F49 F50 N57 K58 Y60 F83	F49-T53 PolarHBondContact O-N 3.06Å; F49-T53 PolarHBondContact O-OG1 3.49Å; F49-T53 VanDerWaalsContact O-OG1 3.08Å; F50-T53 PolarHBondContact O-N 2.85Å; T53-N57 PolarHBondContact O-N 3.18Å; T53-K58 HydrophobicContact CG2-CB 4.16Å; T53-K58 WeakPolarHBondContact CG2-O 3.18Å; T53-K58 PolarHBondContact O-N 3.08Å; T53-Y60 HydrophobicContact CG2-CD2 4.31Å; T53-Y60 HydrophobicContact CG2-CE2 3.55Å; T53-Y60 PolarHBondContact OG1-OH 3.32Å; T53-F83 HydrophobicContact CG2-CD1 3.96Å; T53-F83 HydrophobicContact CG2-CD2 3.54Å; T53-F83 HydrophobicContact CG2-CE1 3.91Å; T53-F83 HydrophobicContact CG2-CE2 3.49Å; T53-F83 VanDerWaalsContact CG2-CE2 3.49Å; T53-F83 HydrophobicContact CG2-CG 3.77Å; T53-F83 HydrophobicContact CG2-CZ 3.68Å
54	V	95.4	Very high	96.1	Very high	41 Å²	41	73.6 Å²	73.6	25%	0.248	37%	0.368	C	S	.	.	H	α-helix	trans	-70.1	-50.6	-177.7	-177.5	0	0	0	0	112.2	F50 N56 N57 F83 L93 V96	F50-V54 HydrophobicContact CD1-CG2 4.33Å; F50-V54 HydrophobicContact CE1-CG2 4.07Å; F50-V54 HydrophobicContact CE2-CG2 4.43Å; F50-V54 HydrophobicContact CZ-CG2 4.11Å; F50-V54 WeakPolarHBondContact O-CG2 3.42Å; F50-V54 PolarHBondContact O-N 3.45Å; V54-N56 PolarHBondContact O-N 3.37Å; V54-N57 PolarHBondContact O-N 3.39Å; V54-N57 VanDerWaalsContact O-N 3.13Å; V54-F83 HydrophobicContact CG2-CE2 4.08Å; V54-F83 HydrophobicContact CG2-CZ 4.13Å; V54-L93 HydrophobicContact CG1-CD2 4.4Å; V54-L93 HydrophobicContact CG2-CD2 3.49Å; V54-L93 VanDerWaalsContact CG2-CD2 3.49Å; V54-V96 HydrophobicContact CB-CB 4.21Å; V54-V96 HydrophobicContact CB-CG1 4.11Å; V54-V96 HydrophobicContact CB-CG2 4.03Å; V54-V96 HydrophobicContact CG1-CB 3.86Å; V54-V96 HydrophobicContact CG1-CG1 4.02Å; V54-V96 HydrophobicContact CG1-CG2 4.1Å; V54-V96 HydrophobicContact CG2-CG2 4.21Å
55	Q	92.8	Very high	95.9	Very high	45 Å²	45	74 Å²	74	21%	0.21	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-8.3	-176.8	-69.3	-164.1	-44.3	0	0	115.5	K51 V96 R97 R100	K51-Q55 HydrophobicContact CG-CG 4.2Å; K51-Q55 VanDerWaalsContact O-CB 3.29Å; K51-Q55 WeakPolarHBondContact O-CB 3.39Å; K51-Q55 WeakPolarHBondContact O-CG 3.33Å; K51-Q55 PolarHBondContact O-N 3.08Å; Q55-V96 HydrophobicContact CG-CG1 3.37Å; Q55-R97 PolarHBondContact NE2-O 2.85Å; Q55-R100 PolarHBondContact O-NH2 3.5Å
56	N	93.1	Very high	95.7	Very high	74 Å²	74	77.9 Å²	77.9	40%	0.396	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.5	18.6	176.9	-51.8	-75.7	0	0	0	111.9	R52 V54 K58 R100	R52-N56 WeakPolarHBondContact O-CB 3.49Å; R52-N56 PolarHBondContact O-ND2 2.86Å; V54-N56 PolarHBondContact O-N 3.37Å; N56-K58 HydrophobicContact CB-CD 4.38Å; N56-K58 HydrophobicContact CB-CG 4.12Å; N56-K58 PolarHBondContact O-N 3.5Å; N56-K58 VanDerWaalsContact O-N 3.08Å; N56-R100 PolarHBondContact OD1-NH2 3.5Å
57	N	91.8	Very high	95.6	Very high	137 Å²	137	85.2 Å²	85.2	73%	0.733	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	40.8	46.2	-179.5	-162.4	14.2	0	0	0	113.7	T53 V54 R59	T53-N57 PolarHBondContact O-N 3.18Å; V54-N57 PolarHBondContact O-N 3.39Å; V54-N57 VanDerWaalsContact O-N 3.13Å; N57-R59 PolarHBondContact O-N 2.59Å
58	K	95.8	Very high	95.5	Very high	115 Å²	115	84.2 Å²	84.2	50%	0.5	42%	0.42	S	S	.	.			trans	-75.8	109.5	-174.4	-65.4	-58.9	-171.6	-176.7	0	110.3	T53 N56 Y60	T53-K58 HydrophobicContact CG2-CB 4.16Å; T53-K58 WeakPolarHBondContact CG2-O 3.18Å; T53-K58 PolarHBondContact O-N 3.08Å; N56-K58 HydrophobicContact CB-CD 4.38Å; N56-K58 HydrophobicContact CB-CG 4.12Å; N56-K58 PolarHBondContact O-N 3.5Å; N56-K58 VanDerWaalsContact O-N 3.08Å; K58-Y60 HydrophobicContact CB-CE1 4.03Å; K58-Y60 HydrophobicContact CB-CE2 4.39Å
59	R	93.9	Very high	95.5	Very high	232 Å²	232	90.7 Å²	90.7	88%	0.875	44%	0.443	S	S	*	.			trans	-75.8	141.9	160.2	-70.1	-178.5	160.9	-162.5	-8.6	109.7	N57	N57-R59 PolarHBondContact O-N 2.59Å
60	Y	97.2	Very high	95.4	Very high	70 Å²	70	90.4 Å²	90.4	28%	0.275	44%	0.443	S	S	.	.			trans	-127.4	159.3	172.4	-57.6	-56.7	0	0	0	108.3	F49 T53 K58 P79 F80 F83	F49-Y60 AromaticContact CE2-CE2 3.9Å; F49-Y60 HydrophobicContact CE2-CE2 3.9Å; F49-Y60 HydrophobicContact CZ-CD2 4.38Å; F49-Y60 AromaticContact CZ-CE2 3.64Å; F49-Y60 HydrophobicContact CZ-CE2 3.64Å; T53-Y60 HydrophobicContact CG2-CD2 4.31Å; T53-Y60 HydrophobicContact CG2-CE2 3.55Å; T53-Y60 PolarHBondContact OG1-OH 3.32Å; K58-Y60 HydrophobicContact CB-CE1 4.03Å; K58-Y60 HydrophobicContact CB-CE2 4.39Å; Y60-P79 HydrophobicContact CD1-CB 3.86Å; Y60-P79 HydrophobicContact CD1-CG 3.82Å; Y60-P79 HydrophobicContact CD2-CB 3.9Å; Y60-P79 HydrophobicContact CE1-CB 3.99Å; Y60-P79 HydrophobicContact CE1-CG 4.3Å; Y60-P79 HydrophobicContact CE2-CB 4.01Å; Y60-P79 HydrophobicContact CG-CB 3.83Å; Y60-P79 HydrophobicContact CG-CG 3.96Å; Y60-F80 WeakPolarHBondContact O-CD2 3.28Å; Y60-F83 HydrophobicContact CD2-CB 4.26Å; Y60-F83 HydrophobicContact CE2-CB 4.43Å
61	T	96.3	Very high	95.4	Very high	127 Å²	127	92 Å²	92	78%	0.779	45%	0.451	S	S	*	.			trans	-124.6	147.4	171.7	-45	0	0	0	0	107.6
62	C	97.1	Very high	95.4	Very high	22 Å²	22	93.5 Å²	93.5	15%	0.149	46%	0.458	C	S	.	.			trans	-81	142.3	168.8	-162.2	0	0	0	0	109.8	E64 Q66 C68 F80 C81	C62-E64 PolarHBondContact SG-N 3.39Å; C62-E64 PolarHBondContact SG-O 2.93Å; C62-Q66 HydrophobicContact CB-CG 3.86Å; C62-C68 VanDerWaalsContact SG-SG 3.6Å; C62-F80 HydrophobicContact CB-CB 4.28Å; C62-F80 HydrophobicContact CB-CD1 3.75Å; C62-F80 HydrophobicContact CB-CE1 4.44Å; C62-F80 HydrophobicContact CB-CG 4.15Å; C62-C81 VanDerWaalsContact SG-SG 3.68Å
63	A	95.8	Very high	95.3	Very high	98 Å²	98	92.1 Å²	92.1	81%	0.81	47%	0.466	S	S	*	.	S	Bend	trans	-85.9	-14.1	168.2	0	0	0	0	0	112.6
64	E	94.5	Very high	95.2	Very high	118 Å²	118	95.2 Å²	95.2	55%	0.551	48%	0.48	S	S	*	.	S	Bend	trans	-117.3	-171.7	-176	-45.1	-69.1	174.9	0	0	110.4	C62 Q66	C62-E64 PolarHBondContact SG-N 3.39Å; C62-E64 PolarHBondContact SG-O 2.93Å; E64-Q66 PolarHBondContact O-N 2.78Å
65	N	93.3	Very high	95.3	Very high	108 Å²	108	94.7 Å²	94.7	58%	0.578	47%	0.474	S	S	*	.	S	Bend	trans	-61.3	16.7	179	79.6	-23.7	0	0	0	117.9	E67	N65-E67 PolarHBondContact ND2-OE2 3.37Å; N65-E67 PolarHBondContact O-N 3.09Å; N65-E67 WeakPolarHBondContact OD1-CB 3.46Å; N65-E67 PolarHBondContact OD1-N 2.84Å; N65-E67 VanDerWaalsContact OD1-N 3.08Å
66	Q	93.9	Very high	95.4	Very high	126 Å²	126	101.4 Å²	101.4	59%	0.589	50%	0.502	S	S	*	.	S	Bend	trans	67.6	3.3	-175.5	-56.8	-174.4	45.7	0	0	116.9	C62 E64 F80 C81	C62-Q66 HydrophobicContact CB-CG 3.86Å; E64-Q66 PolarHBondContact O-N 2.78Å; Q66-F80 HydrophobicContact CB-CD1 4.49Å; Q66-F80 HydrophobicContact CB-CE1 3.9Å; Q66-F80 HydrophobicContact CG-CD1 4.33Å; Q66-F80 HydrophobicContact CG-CE1 3.74Å; Q66-F80 HydrophobicContact CG-CZ 4.42Å; Q66-C81 PolarHBondContact O-SG 3.16Å
67	E	95.1	Very high	95.6	Very high	154 Å²	154	107.2 Å²	107.2	72%	0.72	52%	0.519	S	S	*	.			trans	-105.8	15.5	-176.4	-58.1	-179.4	142.3	0	0	114.5	N65 K69	N65-E67 PolarHBondContact ND2-OE2 3.37Å; N65-E67 PolarHBondContact O-N 3.09Å; N65-E67 WeakPolarHBondContact OD1-CB 3.46Å; N65-E67 PolarHBondContact OD1-N 2.84Å; N65-E67 VanDerWaalsContact OD1-N 3.08Å; E67-K69 PolarHBondContact O-N 3.27Å
68	C	97	Very high	95.9	Very high	32 Å²	32	101.1 Å²	101.1	22%	0.216	49%	0.487	C	S	.	.			trans	-52.6	123	-172.6	-53.7	0	0	0	0	113.5	C62 I70 C78 C81	C62-C68 VanDerWaalsContact SG-SG 3.6Å; C68-I70 WeakPolarHBondContact O-CD1 3.39Å; C68-I70 WeakPolarHBondContact O-CG1 3.36Å; C68-I70 PolarHBondContact O-N 3.46Å; C68-C78 HydrophobicContact CB-CB 3.69Å; C68-C81 HydrophobicContact CB-CB 3.92Å; C68-C81 PolarHBondContact N-SG 2.89Å; C68-C81 VanDerWaalsContact SG-SG 3.68Å
69	K	95.7	Very high	96	Very high	151 Å²	151	97.8 Å²	97.8	66%	0.657	48%	0.476	S	S	*	.			trans	-54.2	126.4	177.6	-177.4	172.6	176.8	174.2	0	112	E67 Q74	E67-K69 PolarHBondContact O-N 3.27Å; K69-Q74 WeakPolarHBondContact O-CG 3.39Å
70	I	97.9	Very high	96.2	Very high	11 Å²	11	88.8 Å²	88.8	6%	0.056	44%	0.444	C	S	.	.			trans	-112.3	108.6	178.8	-52	-58	0	0	0	110.1	V28 C29 C68 R75 C81 R82 K85	V28-I70 HydrophobicContact CG1-CG2 4.16Å; V28-I70 VanDerWaalsContact O-CG2 3.23Å; V28-I70 WeakPolarHBondContact O-CG2 3.49Å; C29-I70 HydrophobicContact CB-CG2 4.07Å; C68-I70 WeakPolarHBondContact O-CD1 3.39Å; C68-I70 WeakPolarHBondContact O-CG1 3.36Å; C68-I70 PolarHBondContact O-N 3.46Å; I70-R75 HydrophobicContact CG2-CB 3.76Å; I70-C81 HydrophobicContact CD1-CB 4.04Å; I70-C81 HydrophobicContact CG1-CB 4.39Å; I70-R82 HydrophobicContact CD1-CB 4.04Å; I70-R82 HydrophobicContact CG1-CB 4.49Å; I70-R82 HydrophobicContact CG2-CB 4.5Å; I70-R82 HydrophobicContact CG2-CG 4.19Å; I70-K85 HydrophobicContact CB-CD 3.95Å; I70-K85 HydrophobicContact CG1-CD 4.23Å; I70-K85 PolarHBondContact O-NZ 3.23Å
71	D	96.6	Very high	96.3	Very high	34 Å²	34	85.9 Å²	85.9	18%	0.182	43%	0.433	C	S	.	.			trans	-135.8	179.7	175.2	63.1	49.1	0	0	0	111.7	C29 T73 Q74 R75	C29-D71 CarbonylContact O-C 3.25Å; C29-D71 VanDerWaalsContact O-C 3.25Å; C29-D71 VanDerWaalsContact O-CA 3.31Å; C29-D71 WeakPolarHBondContact O-CA 3.42Å; D71-T73 VanDerWaalsContact C-N 3.25Å; D71-T73 PolarHBondContact O-N 2.97Å; D71-T73 PolarHBondContact OD1-N 3.29Å; D71-T73 PolarHBondContact OD1-OG1 2.95Å; D71-Q74 PolarHBondContact OD1-N 2.88Å; D71-Q74 PolarHBondContact OD2-NE2 3.05Å; D71-R75 WeakPolarHBondContact O-CB 3.21Å; D71-R75 WeakPolarHBondContact O-CD 3.5Å; D71-R75 WeakPolarHBondContact O-CG 3.16Å; D71-R75 PolarHBondContact O-N 3.07Å
72	K	96.1	Very high	96.4	Very high	119 Å²	119	80.4 Å²	80.4	52%	0.517	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-35.2	-174	-178.8	169.8	178.5	148.7	0	113.7	C29 D31 R75	C29-K72 PolarHBondContact O-N 3.28Å; D31-K72 HydrophobicContact CB-CB 4.27Å; D31-K72 HydrophobicContact CB-CD 4.14Å; D31-K72 HydrophobicContact CB-CG 4.08Å; D31-K72 VanDerWaalsContact OD1-CD 3.31Å; D31-K72 WeakPolarHBondContact OD1-CD 3.45Å; D31-K72 WeakPolarHBondContact OD1-CE 3.45Å; D31-K72 IonicContact OD1-NZ 3.23Å; D31-K72 PolarHBondContact OD1-NZ 3.26Å; K72-R75 PolarHBondContact O-NE 2.99Å
73	T	95.9	Very high	96.4	Very high	119 Å²	119	81.1 Å²	81.1	73%	0.73	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.1	-51.2	-176.5	68	0	0	0	0	110.7	D71	D71-T73 VanDerWaalsContact C-N 3.25Å; D71-T73 PolarHBondContact O-N 2.97Å; D71-T73 PolarHBondContact OD1-N 3.29Å; D71-T73 PolarHBondContact OD1-OG1 2.95Å
74	Q	94.4	Very high	96.5	Very high	66 Å²	66	80.2 Å²	80.2	31%	0.308	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	1.7	-169.3	78.5	-169.7	-53.6	0	0	115.9	K69 D71 K76 R77	K69-Q74 WeakPolarHBondContact O-CG 3.39Å; D71-Q74 PolarHBondContact OD1-N 2.88Å; D71-Q74 PolarHBondContact OD2-NE2 3.05Å; Q74-K76 PolarHBondContact O-N 2.77Å; Q74-R77 VanDerWaalsContact O-CB 3.31Å; Q74-R77 WeakPolarHBondContact O-CB 3.47Å; Q74-R77 PolarHBondContact O-N 2.68Å
75	R	96.4	Very high	96.7	Very high	31 Å²	31	77.9 Å²	77.9	12%	0.117	37%	0.366	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	2.8	170.1	61.5	-171.9	172.6	170	-1.2	116.7	C29 D31 C43 I70 D71 K72 R82	C29-R75 HydrophobicContact CB-CB 4.35Å; C29-R75 PolarHBondContact SG-NH1 2.9Å; D31-R75 VanDerWaalsContact CB-NH1 3.31Å; D31-R75 IonicContact OD2-CZ 2.72Å; D31-R75 IonicContact OD2-NH1 3.03Å; D31-R75 PolarHBondContact OD2-NH1 2.75Å; D31-R75 IonicContact OD2-NH2 2.73Å; D31-R75 PolarHBondContact OD2-NH2 3.11Å; C43-R75 PolarHBondContact SG-NH1 3.46Å; I70-R75 HydrophobicContact CG2-CB 3.76Å; D71-R75 WeakPolarHBondContact O-CB 3.21Å; D71-R75 WeakPolarHBondContact O-CD 3.5Å; D71-R75 WeakPolarHBondContact O-CG 3.16Å; D71-R75 PolarHBondContact O-N 3.07Å; K72-R75 PolarHBondContact O-NE 2.99Å; R75-R82 VanDerWaalsContact O-CD 3.28Å; R75-R82 WeakPolarHBondContact O-CD 3.3Å; R75-R82 PolarHBondContact O-NH1 3.31Å
76	K	96.3	Very high	96.9	Very high	185 Å²	185	72.8 Å²	72.8	80%	0.804	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-20.7	168.2	-68.5	-178.3	-179.5	176.7	0	113	Q74	Q74-K76 PolarHBondContact O-N 2.77Å
77	R	97.1	Very high	97	Very high	197 Å²	197	69.3 Å²	69.3	74%	0.743	32%	0.324	S	S	*	.	S	Bend	trans	-69.4	-44.1	-167.6	-170.3	172.5	179.8	159.1	0.6	113.4	Q74	Q74-R77 VanDerWaalsContact O-CB 3.31Å; Q74-R77 WeakPolarHBondContact O-CB 3.47Å; Q74-R77 PolarHBondContact O-N 2.68Å
78	C	98	Very high	96.9	Very high	9 Å²	9	67.7 Å²	67.7	6%	0.061	32%	0.32	C	S	.	.			trans	-123	106.1	173.2	-172.7	0	0	0	0	111.2	C68 F80 C81 R82	C68-C78 HydrophobicContact CB-CB 3.69Å; C78-F80 VanDerWaalsContact C-N 3.32Å; C78-C81 HydrophobicContact CB-CB 4.2Å; C78-C81 PolarHBondContact SG-N 2.9Å; C78-C81 VanDerWaalsContact SG-N 3.42Å; C78-C81 PolarHBondContact SG-SG 3.18Å; C78-R82 WeakPolarHBondContact O-CB 3.29Å; C78-R82 PolarHBondContact O-N 3.22Å
79	P	97.8	Very high	96.7	Very high	44 Å²	44	68.1 Å²	68.1	29%	0.286	32%	0.322	S	S	.	.	H	α-helix	trans	-72.1	-26.3	176.6	29.7	-34	0	0	0	112.3	F49 Y60 F83	F49-P79 HydrophobicContact CE2-CB 4.07Å; F49-P79 HydrophobicContact CZ-CB 4.19Å; F49-P79 WeakPolarHBondContact CZ-O 3.44Å; Y60-P79 HydrophobicContact CD1-CB 3.86Å; Y60-P79 HydrophobicContact CD1-CG 3.82Å; Y60-P79 HydrophobicContact CD2-CB 3.9Å; Y60-P79 HydrophobicContact CE1-CB 3.99Å; Y60-P79 HydrophobicContact CE1-CG 4.3Å; Y60-P79 HydrophobicContact CE2-CB 4.01Å; Y60-P79 HydrophobicContact CG-CB 3.83Å; Y60-P79 HydrophobicContact CG-CG 3.96Å; P79-F83 WeakPolarHBondContact O-CB 3.36Å; P79-F83 PolarHBondContact O-N 3.07Å
80	F	98.4	Very high	96.5	Very high	44 Å²	44	62.8 Å²	62.8	19%	0.193	31%	0.31	C	S	.	.	H	α-helix	trans	-62.3	-61.7	174.3	176.8	-91.6	0	0	0	111.3	Y60 C62 Q66 C78 R82 F83 Q84	Y60-F80 WeakPolarHBondContact O-CD2 3.28Å; C62-F80 HydrophobicContact CB-CB 4.28Å; C62-F80 HydrophobicContact CB-CD1 3.75Å; C62-F80 HydrophobicContact CB-CE1 4.44Å; C62-F80 HydrophobicContact CB-CG 4.15Å; Q66-F80 HydrophobicContact CB-CD1 4.49Å; Q66-F80 HydrophobicContact CB-CE1 3.9Å; Q66-F80 HydrophobicContact CG-CD1 4.33Å; Q66-F80 HydrophobicContact CG-CE1 3.74Å; Q66-F80 HydrophobicContact CG-CZ 4.42Å; C78-F80 VanDerWaalsContact C-N 3.32Å; F80-R82 PolarHBondContact O-N 2.89Å; F80-F83 PolarHBondContact O-N 3.1Å; F80-Q84 PolarHBondContact O-N 2.91Å
81	C	98.1	Very high	96.4	Very high	8 Å²	8	62.5 Å²	62.5	5%	0.054	31%	0.308	C	S	.	.	H	α-helix	trans	-59.6	-33	179.5	-57.1	0	0	0	0	111.9	C62 Q66 C68 I70 C78 K85	C62-C81 VanDerWaalsContact SG-SG 3.68Å; Q66-C81 PolarHBondContact O-SG 3.16Å; C68-C81 HydrophobicContact CB-CB 3.92Å; C68-C81 PolarHBondContact N-SG 2.89Å; C68-C81 VanDerWaalsContact SG-SG 3.68Å; I70-C81 HydrophobicContact CD1-CB 4.04Å; I70-C81 HydrophobicContact CG1-CB 4.39Å; C78-C81 HydrophobicContact CB-CB 4.2Å; C78-C81 PolarHBondContact SG-N 2.9Å; C78-C81 VanDerWaalsContact SG-N 3.42Å; C78-C81 PolarHBondContact SG-SG 3.18Å; C81-K85 WeakPolarHBondContact O-CB 3.33Å; C81-K85 PolarHBondContact O-N 2.88Å
82	R	98.5	Very high	96.2	Very high	12 Å²	12	66 Å²	66	5%	0.045	32%	0.319	C	S	.	.	H	α-helix	trans	-63.9	-45.5	172.4	-170.5	-174.4	-171.3	160.1	-5.5	112.4	V28 S45 C46 F49 I70 R75 C78 F80 K85 C86	V28-R82 HydrophobicContact CG1-CG 4.35Å; S45-R82 VanDerWaalsContact C-NH2 3.31Å; S45-R82 PolarHBondContact O-NH2 3.13Å; S45-R82 PolarHBondContact OG-NH2 2.71Å; C46-R82 PolarHBondContact SG-NH2 3.19Å; F49-R82 HydrophobicContact CD1-CG 3.93Å; F49-R82 HydrophobicContact CE1-CB 3.99Å; F49-R82 HydrophobicContact CE1-CG 3.69Å; F49-R82 HydrophobicContact CZ-CB 4.14Å; F49-R82 HydrophobicContact CZ-CG 4.22Å; I70-R82 HydrophobicContact CD1-CB 4.04Å; I70-R82 HydrophobicContact CG1-CB 4.49Å; I70-R82 HydrophobicContact CG2-CB 4.5Å; I70-R82 HydrophobicContact CG2-CG 4.19Å; R75-R82 VanDerWaalsContact O-CD 3.28Å; R75-R82 WeakPolarHBondContact O-CD 3.3Å; R75-R82 PolarHBondContact O-NH1 3.31Å; C78-R82 WeakPolarHBondContact O-CB 3.29Å; C78-R82 PolarHBondContact O-N 3.22Å; F80-R82 PolarHBondContact O-N 2.89Å; R82-K85 PolarHBondContact O-N 3.39Å; R82-C86 PolarHBondContact O-N 2.93Å; R82-C86 PolarHBondContact O-SG 2.69Å; R82-C86 VanDerWaalsContact O-SG 3.34Å
83	F	98.4	Very high	96	Very high	38 Å²	38	64.4 Å²	64.4	17%	0.167	32%	0.316	C	S	.	.	H	α-helix	trans	-70.2	-41.4	-179.8	-172.5	-120.7	0	0	0	111.6	F49 F50 T53 V54 Y60 P79 F80 K85 C86 L87 L93	F49-F83 HydrophobicContact CE1-CB 3.82Å; F49-F83 HydrophobicContact CE1-CD2 4.2Å; F49-F83 HydrophobicContact CE1-CG 4.5Å; F49-F83 HydrophobicContact CZ-CB 3.99Å; F50-F83 AromaticContact CD2-CD2 3.96Å; F50-F83 HydrophobicContact CD2-CD2 3.96Å; F50-F83 AromaticContact CD2-CE2 3.59Å; F50-F83 HydrophobicContact CD2-CE2 3.59Å; F50-F83 HydrophobicContact CE2-CD2 4.28Å; F50-F83 AromaticContact CE2-CE2 3.61Å; F50-F83 HydrophobicContact CE2-CE2 3.61Å; F50-F83 HydrophobicContact CE2-CZ 4.38Å; T53-F83 HydrophobicContact CG2-CD1 3.96Å; T53-F83 HydrophobicContact CG2-CD2 3.54Å; T53-F83 HydrophobicContact CG2-CE1 3.91Å; T53-F83 HydrophobicContact CG2-CE2 3.49Å; T53-F83 VanDerWaalsContact CG2-CE2 3.49Å; T53-F83 HydrophobicContact CG2-CG 3.77Å; T53-F83 HydrophobicContact CG2-CZ 3.68Å; V54-F83 HydrophobicContact CG2-CE2 4.08Å; V54-F83 HydrophobicContact CG2-CZ 4.13Å; Y60-F83 HydrophobicContact CD2-CB 4.26Å; Y60-F83 HydrophobicContact CE2-CB 4.43Å; P79-F83 WeakPolarHBondContact O-CB 3.36Å; P79-F83 PolarHBondContact O-N 3.07Å; F80-F83 PolarHBondContact O-N 3.1Å; F83-K85 VanDerWaalsContact C-N 3.34Å; F83-K85 PolarHBondContact O-N 3.41Å; F83-C86 WeakPolarHBondContact O-CB 3.23Å; F83-C86 PolarHBondContact O-N 2.89Å; F83-C86 VanDerWaalsContact O-N 3.13Å; F83-L87 HydrophobicContact CD1-CD1 4.18Å; F83-L87 HydrophobicContact CE1-CD1 3.89Å; F83-L87 HydrophobicContact CE1-CG 4.5Å; F83-L87 HydrophobicContact CZ-CD1 4.28Å; F83-L87 HydrophobicContact CZ-CD2 4.41Å; F83-L87 HydrophobicContact CZ-CG 4.46Å; F83-L87 WeakPolarHBondContact O-CG 3.42Å; F83-L87 PolarHBondContact O-N 2.94Å; F83-L93 HydrophobicContact CZ-CD2 3.98Å
84	Q	97.7	Very high	95.6	Very high	79 Å²	79	62.8 Å²	62.8	37%	0.369	30%	0.3	S	S	.	.	H	α-helix	trans	-59.8	-45.2	172.7	-165.5	58.9	47	0	0	110.9	F80 C86 L87 N88	F80-Q84 PolarHBondContact O-N 2.91Å; Q84-C86 VanDerWaalsContact C-N 3.33Å; Q84-C86 PolarHBondContact O-N 3.01Å; Q84-L87 PolarHBondContact O-N 3.07Å; Q84-L87 VanDerWaalsContact O-N 3.12Å; Q84-N88 PolarHBondContact NE2-OD1 3.43Å; Q84-N88 WeakPolarHBondContact O-CB 2.99Å; Q84-N88 VanDerWaalsContact O-CG 3.22Å; Q84-N88 PolarHBondContact O-N 3.15Å; Q84-N88 PolarHBondContact O-OD1 3.37Å
85	K	97.9	Very high	95.3	Very high	69 Å²	69	60.7 Å²	60.7	30%	0.3	29%	0.294	S	S	.	.	H	α-helix	trans	-64.2	-33.5	174.9	-166.5	176.1	178.4	-167.4	0	113	P27 V28 I70 C81 R82 F83 V89	P27-K85 VanDerWaalsContact O-CE 3.26Å; P27-K85 WeakPolarHBondContact O-CE 3.42Å; P27-K85 PolarHBondContact O-NZ 3.43Å; V28-K85 VanDerWaalsContact O-CD 3.31Å; V28-K85 WeakPolarHBondContact O-CD 3.32Å; V28-K85 VanDerWaalsContact O-CE 3.26Å; V28-K85 WeakPolarHBondContact O-CE 3.41Å; V28-K85 PolarHBondContact O-NZ 3.39Å; I70-K85 HydrophobicContact CB-CD 3.95Å; I70-K85 HydrophobicContact CG1-CD 4.23Å; I70-K85 PolarHBondContact O-NZ 3.23Å; C81-K85 WeakPolarHBondContact O-CB 3.33Å; C81-K85 PolarHBondContact O-N 2.88Å; R82-K85 PolarHBondContact O-N 3.39Å; F83-K85 VanDerWaalsContact C-N 3.34Å; F83-K85 PolarHBondContact O-N 3.41Å; K85-V89 HydrophobicContact CG-CG1 4.41Å; K85-V89 WeakPolarHBondContact O-CG1 3.44Å; K85-V89 WeakPolarHBondContact O-CG2 3.21Å; K85-V89 PolarHBondContact O-N 3.47Å; K85-V89 VanDerWaalsContact O-N 3.1Å
86	C	97.9	Very high	95	Very high	0 Å²	0	60 Å²	60	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-59.5	-46	170.2	-76.8	0	0	0	0	111.7	F50 R82 F83 Q84 V89 M91	F50-C86 HydrophobicContact CD2-CB 3.68Å; F50-C86 HydrophobicContact CE2-CB 4.14Å; R82-C86 PolarHBondContact O-N 2.93Å; R82-C86 PolarHBondContact O-SG 2.69Å; R82-C86 VanDerWaalsContact O-SG 3.34Å; F83-C86 WeakPolarHBondContact O-CB 3.23Å; F83-C86 PolarHBondContact O-N 2.89Å; F83-C86 VanDerWaalsContact O-N 3.13Å; Q84-C86 VanDerWaalsContact C-N 3.33Å; Q84-C86 PolarHBondContact O-N 3.01Å; C86-V89 WeakPolarHBondContact O-CG2 3.42Å; C86-M91 HydrophobicContact CB-CB 4.27Å; C86-M91 HydrophobicContact CB-CG 4.22Å; C86-M91 HydrophobicContact CB-SD 3.66Å; C86-M91 WeakPolarHBondContact O-CB 3.45Å; C86-M91 VanDerWaalsContact O-CG 3.29Å; C86-M91 WeakPolarHBondContact O-CG 2.98Å; C86-M91 PolarHBondContact O-N 3.35Å
87	L	95.6	Very high	94.4	Very high	54 Å²	54	56 Å²	56	28%	0.283	27%	0.273	S	S	.	.	H	α-helix	trans	-65.6	-46.4	177.2	-63.9	170.9	0	0	0	111.4	F50 F83 Q84 V89 G90 L93	F50-L87 HydrophobicContact CE2-CD2 3.9Å; F50-L87 HydrophobicContact CZ-CD2 4.28Å; F83-L87 HydrophobicContact CD1-CD1 4.18Å; F83-L87 HydrophobicContact CE1-CD1 3.89Å; F83-L87 HydrophobicContact CE1-CG 4.5Å; F83-L87 HydrophobicContact CZ-CD1 4.28Å; F83-L87 HydrophobicContact CZ-CD2 4.41Å; F83-L87 HydrophobicContact CZ-CG 4.46Å; F83-L87 WeakPolarHBondContact O-CG 3.42Å; F83-L87 PolarHBondContact O-N 2.94Å; Q84-L87 PolarHBondContact O-N 3.07Å; Q84-L87 VanDerWaalsContact O-N 3.12Å; L87-V89 VanDerWaalsContact C-N 3.29Å; L87-V89 PolarHBondContact O-N 3.04Å; L87-G90 WeakPolarHBondContact O-CA 3.46Å; L87-G90 PolarHBondContact O-N 3.07Å; L87-L93 HydrophobicContact CD2-CD1 4.42Å; L87-L93 HydrophobicContact CD2-CD2 3.88Å; L87-L93 HydrophobicContact CD2-CG 3.95Å
88	N	94.1	Very high	93.4	Very high	119 Å²	119	51.1 Å²	51.1	64%	0.636	28%	0.275	S	S	*	.	H	α-helix	trans	-62.8	-30.2	-178.4	-66.3	13.7	0	0	0	113.2	Q84 G90	Q84-N88 PolarHBondContact NE2-OD1 3.43Å; Q84-N88 WeakPolarHBondContact O-CB 2.99Å; Q84-N88 VanDerWaalsContact O-CG 3.22Å; Q84-N88 PolarHBondContact O-N 3.15Å; Q84-N88 PolarHBondContact O-OD1 3.37Å; N88-G90 VanDerWaalsContact C-N 3.26Å; N88-G90 PolarHBondContact O-N 3.38Å
89	V	92.8	Very high	92.1	Very high	42 Å²	42	54.3 Å²	54.3	26%	0.255	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.3	9.7	172.3	-53	0	0	0	0	113.5	P27 V28 L40 K85 C86 L87 M91	P27-V89 HydrophobicContact CB-CB 4.4Å; P27-V89 HydrophobicContact CB-CG1 4.12Å; P27-V89 HydrophobicContact CG-CB 4.29Å; P27-V89 HydrophobicContact CG-CG2 4.3Å; V28-V89 HydrophobicContact CG2-CG2 3.61Å; L40-V89 HydrophobicContact CD1-CB 4.38Å; L40-V89 HydrophobicContact CD1-CG2 4.07Å; L40-V89 VanDerWaalsContact CD1-O 3.32Å; L40-V89 WeakPolarHBondContact CD1-O 3.46Å; L40-V89 VanDerWaalsContact CD2-O 3.3Å; L40-V89 WeakPolarHBondContact CD2-O 3.46Å; K85-V89 HydrophobicContact CG-CG1 4.41Å; K85-V89 WeakPolarHBondContact O-CG1 3.44Å; K85-V89 WeakPolarHBondContact O-CG2 3.21Å; K85-V89 PolarHBondContact O-N 3.47Å; K85-V89 VanDerWaalsContact O-N 3.1Å; C86-V89 WeakPolarHBondContact O-CG2 3.42Å; L87-V89 VanDerWaalsContact C-N 3.29Å; L87-V89 PolarHBondContact O-N 3.04Å; V89-M91 HydrophobicContact CG2-CG 4.34Å
90	G	91.3	Very high	90.9	Very high	39 Å²	39	60 Å²	60	40%	0.402	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.8	21.7	173.7	0	0	0	0	0	116.2	L40 L87 N88 R92	L40-G90 VanDerWaalsContact CD2-C 3.4Å; L40-G90 WeakPolarHBondContact CD2-O 3.27Å; L87-G90 WeakPolarHBondContact O-CA 3.46Å; L87-G90 PolarHBondContact O-N 3.07Å; N88-G90 VanDerWaalsContact C-N 3.26Å; N88-G90 PolarHBondContact O-N 3.38Å; G90-R92 PolarHBondContact O-N 2.92Å
91	M	96	Very high	89.7	Confident	4 Å²	4	64.3 Å²	64.3	2%	0.02	33%	0.329	C	S	.	.			trans	-70.2	114.5	170.7	-62	-170.1	75.1	0	0	110.2	V28 Y38 L40 T42 F50 C86 V89	V28-M91 HydrophobicContact CG2-SD 4.21Å; Y38-M91 HydrophobicContact CD2-CE 3.77Å; Y38-M91 HydrophobicContact CG-CE 4.47Å; Y38-M91 CarbonylContact O-C 3.55Å; Y38-M91 WeakPolarHBondContact O-CA 3.5Å; L40-M91 HydrophobicContact CD2-CB 4.43Å; L40-M91 HydrophobicContact CD2-CG 3.73Å; T42-M91 HydrophobicContact CG2-CE 4.49Å; T42-M91 HydrophobicContact CG2-SD 4.19Å; F50-M91 HydrophobicContact CB-CE 3.68Å; F50-M91 HydrophobicContact CB-SD 4.27Å; F50-M91 HydrophobicContact CD1-CB 4.35Å; F50-M91 HydrophobicContact CD1-CE 4Å; F50-M91 HydrophobicContact CD2-CB 3.89Å; F50-M91 HydrophobicContact CD2-CE 4.32Å; F50-M91 HydrophobicContact CD2-SD 4.21Å; F50-M91 HydrophobicContact CE1-CB 4.08Å; F50-M91 HydrophobicContact CE2-CB 3.59Å; F50-M91 HydrophobicContact CG-CB 4.26Å; F50-M91 HydrophobicContact CG-CE 3.75Å; F50-M91 HydrophobicContact CG-SD 4.22Å; F50-M91 HydrophobicContact CZ-CB 3.7Å; F50-M91 WeakPolarHBondContact CZ-O 3.43Å; C86-M91 HydrophobicContact CB-CB 4.27Å; C86-M91 HydrophobicContact CB-CG 4.22Å; C86-M91 HydrophobicContact CB-SD 3.66Å; C86-M91 WeakPolarHBondContact O-CB 3.45Å; C86-M91 VanDerWaalsContact O-CG 3.29Å; C86-M91 WeakPolarHBondContact O-CG 2.98Å; C86-M91 PolarHBondContact O-N 3.35Å; V89-M91 HydrophobicContact CG2-CG 4.34Å
92	R	90.7	Very high	88.5	Confident	109 Å²	109	76.2 Å²	76.2	41%	0.411	37%	0.373	S	S	.	.			trans	-80.5	117.5	-171.5	-79.9	172.7	174.4	-87.5	-0.3	112.7	Y38 F50 G90 E94 A95	Y38-R92 WeakPolarHBondContact O-CB 3.41Å; Y38-R92 PolarHBondContact O-N 3.46Å; F50-R92 WeakPolarHBondContact CE1-O 3.27Å; G90-R92 PolarHBondContact O-N 2.92Å; R92-E94 VanDerWaalsContact C-N 3.29Å; R92-E94 WeakPolarHBondContact CB-OE1 3.39Å; R92-E94 WeakPolarHBondContact CB-OE2 3.49Å; R92-E94 VanDerWaalsContact CD-OE1 3.23Å; R92-E94 WeakPolarHBondContact CD-OE1 3.48Å; R92-E94 VanDerWaalsContact CG-OE1 3.28Å; R92-E94 WeakPolarHBondContact CG-OE1 3.07Å; R92-E94 IonicContact CZ-OE1 2.7Å; R92-E94 IonicContact NE-OE1 3.98Å; R92-E94 IonicContact NH1-OE1 2.73Å; R92-E94 PolarHBondContact NH1-OE1 2.99Å; R92-E94 PolarHBondContact O-N 3.43Å; R92-A95 HydrophobicContact CB-CB 3.93Å; R92-A95 WeakPolarHBondContact O-CB 3.41Å; R92-A95 PolarHBondContact O-N 2.89Å; R92-A95 VanDerWaalsContact O-N 3.16Å
93	L	91.7	Very high	87	Confident	85 Å²	85	78.2 Å²	78.2	45%	0.445	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-56.6	-44.9	176.3	-67.1	174.2	0	0	0	111.2	F50 V54 F83 L87 A95 V96	F50-L93 HydrophobicContact CE2-CD2 4.39Å; F50-L93 HydrophobicContact CZ-CD2 3.95Å; V54-L93 HydrophobicContact CG1-CD2 4.4Å; V54-L93 HydrophobicContact CG2-CD2 3.49Å; V54-L93 VanDerWaalsContact CG2-CD2 3.49Å; F83-L93 HydrophobicContact CZ-CD2 3.98Å; L87-L93 HydrophobicContact CD2-CD1 4.42Å; L87-L93 HydrophobicContact CD2-CD2 3.88Å; L87-L93 HydrophobicContact CD2-CG 3.95Å; L93-A95 PolarHBondContact O-N 2.61Å; L93-A95 VanDerWaalsContact O-N 3.17Å; L93-V96 WeakPolarHBondContact O-CB 3.44Å; L93-V96 PolarHBondContact O-N 3.09Å
94	E	87.9	Confident	85.4	Confident	84 Å²	84	79.7 Å²	79.7	39%	0.393	42%	0.423	S	S	.	.	G	3₁₀ helix	trans	-72.3	-3.3	-178.1	81.9	-66.6	171.3	0	0	114	R92 K107 F108	R92-E94 VanDerWaalsContact C-N 3.29Å; R92-E94 WeakPolarHBondContact CB-OE1 3.39Å; R92-E94 WeakPolarHBondContact CB-OE2 3.49Å; R92-E94 VanDerWaalsContact CD-OE1 3.23Å; R92-E94 WeakPolarHBondContact CD-OE1 3.48Å; R92-E94 VanDerWaalsContact CG-OE1 3.28Å; R92-E94 WeakPolarHBondContact CG-OE1 3.07Å; R92-E94 IonicContact CZ-OE1 2.7Å; R92-E94 IonicContact NE-OE1 3.98Å; R92-E94 IonicContact NH1-OE1 2.73Å; R92-E94 PolarHBondContact NH1-OE1 2.99Å; R92-E94 PolarHBondContact O-N 3.43Å; E94-K107 WeakPolarHBondContact O-CE 3.13Å; E94-K107 PolarHBondContact O-NZ 3.12Å; E94-F108 HydrophobicContact CG-CZ 4.1Å; E94-F108 WeakPolarHBondContact OE1-CZ 3.42Å
95	A	88.5	Confident	83.9	Confident	22 Å²	22	87.3 Å²	87.3	18%	0.182	45%	0.448	C	S	.	.	G	3₁₀ helix	trans	-85.6	-11.4	167.9	0	0	0	0	0	113.2	Y38 R92 L93 F108	Y38-A95 HydrophobicContact CD1-CB 3.97Å; R92-A95 HydrophobicContact CB-CB 3.93Å; R92-A95 WeakPolarHBondContact O-CB 3.41Å; R92-A95 PolarHBondContact O-N 2.89Å; R92-A95 VanDerWaalsContact O-N 3.16Å; L93-A95 PolarHBondContact O-N 2.61Å; L93-A95 VanDerWaalsContact O-N 3.17Å; A95-F108 HydrophobicContact CB-CD2 3.85Å; A95-F108 HydrophobicContact CB-CE2 3.5Å; A95-F108 VanDerWaalsContact CB-CE2 3.5Å; A95-F108 HydrophobicContact CB-CZ 4.46Å
96	V	90.1	Very high	82.4	Confident	17 Å²	17	88.3 Å²	88.3	10%	0.103	46%	0.457	C	S	.	.	S	Bend	trans	-88.9	121.3	173.3	-174.2	0	0	0	0	108.9	Y38 F50 V54 Q55 L93	Y38-V96 HydrophobicContact CD1-CG2 3.68Å; Y38-V96 HydrophobicContact CE1-CB 4.48Å; Y38-V96 HydrophobicContact CE1-CG2 3.81Å; Y38-V96 HydrophobicContact CG-CG2 4.29Å; F50-V96 HydrophobicContact CD1-CG2 3.87Å; F50-V96 HydrophobicContact CE1-CG2 3.7Å; V54-V96 HydrophobicContact CB-CB 4.21Å; V54-V96 HydrophobicContact CB-CG1 4.11Å; V54-V96 HydrophobicContact CB-CG2 4.03Å; V54-V96 HydrophobicContact CG1-CB 3.86Å; V54-V96 HydrophobicContact CG1-CG1 4.02Å; V54-V96 HydrophobicContact CG1-CG2 4.1Å; V54-V96 HydrophobicContact CG2-CG2 4.21Å; Q55-V96 HydrophobicContact CG-CG1 3.37Å; L93-V96 WeakPolarHBondContact O-CB 3.44Å; L93-V96 PolarHBondContact O-N 3.09Å
97	R	83.6	Confident	81.3	Confident	100 Å²	100	95.3 Å²	95.3	38%	0.377	49%	0.488	S	S	.	.			trans	-76.6	141	175.8	-61.3	-164.9	-167.5	130.4	-2.4	111.7	Q55 D99 G103 G104 R105	Q55-R97 PolarHBondContact NE2-O 2.85Å; R97-D99 WeakPolarHBondContact CB-OD1 3.41Å; R97-D99 WeakPolarHBondContact CD-OD2 3.38Å; R97-G103 PolarHBondContact NH1-O 3.13Å; R97-G104 PolarHBondContact NH2-O 3.17Å; R97-R105 PolarHBondContact NH2-O 3.33Å
98	A	76.3	Confident	80.5	Confident	95 Å²	95	94.3 Å²	94.3	79%	0.785	48%	0.481	S	S	*	.	S	Bend	trans	-74.3	-35.1	173.4	0	0	0	0	0	112.8	R100	A98-R100 PolarHBondContact O-N 2.68Å
99	D	69.9	Low	79.8	Confident	76 Å²	76	89.2 Å²	89.2	41%	0.406	46%	0.457	S	S	.	.	S	Bend	trans	-60.4	-14.5	-170.8	63.6	17	0	0	0	116.7	R97 M101	R97-D99 WeakPolarHBondContact CB-OD1 3.41Å; R97-D99 WeakPolarHBondContact CD-OD2 3.38Å; D99-M101 HydrophobicContact CB-CB 4.41Å; D99-M101 HydrophobicContact CB-CE 3.9Å; D99-M101 HydrophobicContact CB-CG 4.08Å; D99-M101 PolarHBondContact O-N 3.34Å; D99-M101 PolarHBondContact OD1-N 2.91Å
100	R	74.1	Confident	79.2	Confident	163 Å²	163	91.7 Å²	91.7	62%	0.615	47%	0.474	S	S	*	.			trans	56.2	6.9	-171.3	-59.5	-179.5	173.4	-167.9	-6.1	115.1	Q55 N56 A98	Q55-R100 PolarHBondContact O-NH2 3.5Å; N56-R100 PolarHBondContact OD1-NH2 3.5Å; A98-R100 PolarHBondContact O-N 2.68Å
101	M	73	Confident	78.8	Confident	136 Å²	136	93.5 Å²	93.5	67%	0.67	47%	0.472	S	S	*	.			trans	-72.8	151.7	-174.8	-68.9	-162.6	-74.9	0	0	112.7	D99	D99-M101 HydrophobicContact CB-CB 4.41Å; D99-M101 HydrophobicContact CB-CE 3.9Å; D99-M101 HydrophobicContact CB-CG 4.08Å; D99-M101 PolarHBondContact O-N 3.34Å; D99-M101 PolarHBondContact OD1-N 2.91Å
102	R	72.8	Confident	78.3	Confident	258 Å²	258	94.9 Å²	94.9	97%	0.974	48%	0.478	S	S	*	.			trans	-103	113.9	-174.3	-165.8	179.7	-170.9	-176.7	2.3	110.8
103	G	67.4	Low	77.8	Confident	54 Å²	54	97.4 Å²	97.4	56%	0.557	49%	0.492	S	S	*	.			trans	104	-175.8	178.4	0	0	0	0	0	113.9	R97	R97-G103 PolarHBondContact NH1-O 3.13Å
104	G	64.4	Low	77.2	Confident	68 Å²	68	101.1 Å²	101.1	70%	0.701	50%	0.5	S	S	*	.			trans	92.9	151	-178.2	0	0	0	0	0	114.8	R97	R97-G104 PolarHBondContact NH2-O 3.17Å
105	R	65.1	Low	76.6	Confident	239 Å²	239	99.8 Å²	99.8	90%	0.902	50%	0.495	S	S	*	.			trans	-58.9	145.8	-169.8	-134.1	170.9	-169	161.3	2.5	112.8	R97	R97-R105 PolarHBondContact NH2-O 3.33Å
106	N	68.1	Low	76.3	Confident	91 Å²	91	105.6 Å²	105.6	49%	0.487	51%	0.512	S	S	.	.			trans	-91.9	120.6	178.5	52.8	-14.2	0	0	0	111.1	F108 G109	N106-F108 PolarHBondContact O-N 3.23Å; N106-G109 PolarHBondContact O-N 2.9Å
107	K	73.2	Confident	75.8	Confident	146 Å²	146	107.2 Å²	107.2	64%	0.635	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-29.6	178	67.1	179.5	-179.1	179.7	0	113.3	E94 G109	E94-K107 WeakPolarHBondContact O-CE 3.13Å; E94-K107 PolarHBondContact O-NZ 3.12Å; K107-G109 VanDerWaalsContact C-N 3.34Å
108	F	79.1	Confident	75.5	Confident	33 Å²	33	107 Å²	107	15%	0.145	53%	0.533	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	6.2	174	-60.6	-72.6	0	0	0	114.6	E94 A95 N106 M111 Y112	E94-F108 HydrophobicContact CG-CZ 4.1Å; E94-F108 WeakPolarHBondContact OE1-CZ 3.42Å; A95-F108 HydrophobicContact CB-CD2 3.85Å; A95-F108 HydrophobicContact CB-CE2 3.5Å; A95-F108 VanDerWaalsContact CB-CE2 3.5Å; A95-F108 HydrophobicContact CB-CZ 4.46Å; N106-F108 PolarHBondContact O-N 3.23Å; F108-M111 HydrophobicContact CD1-SD 4.07Å; F108-M111 WeakPolarHBondContact O-CB 3.19Å; F108-M111 PolarHBondContact O-N 3.22Å; F108-M111 VanDerWaalsContact O-N 3.1Å; F108-Y112 HydrophobicContact CB-CE1 3.89Å; F108-Y112 HydrophobicContact CB-CE2 3.85Å; F108-Y112 WeakPolarHBondContact O-CD2 3.32Å; F108-Y112 PolarHBondContact O-N 3.18Å; F108-Y112 VanDerWaalsContact O-N 3.09Å
109	G	79.3	Confident	75.5	Confident	12 Å²	12	105.6 Å²	105.6	12%	0.124	51%	0.51	C	S	.	.	H	α-helix	trans	-53.4	-44.2	178.7	0	0	0	0	0	114.5	N106 K107 Y112 K113	N106-G109 PolarHBondContact O-N 2.9Å; K107-G109 VanDerWaalsContact C-N 3.34Å; G109-Y112 PolarHBondContact O-N 3.5Å; G109-K113 PolarHBondContact O-N 3.35Å
110	P	81.7	Confident	76	Confident	95 Å²	95	108 Å²	108	62%	0.617	52%	0.518	S	S	*	.	H	α-helix	trans	-63.1	-39	174.4	-24.7	35.9	0	0	0	113.5	K113 R114	P110-K113 PolarHBondContact O-N 3.32Å; P110-R114 PolarHBondContact O-N 3.19Å
111	M	82.9	Confident	76.3	Confident	76 Å²	76	106.5 Å²	106.5	37%	0.374	52%	0.519	S	S	.	.	H	α-helix	trans	-60.2	-48.4	176.3	179.7	-169.5	174.1	0	0	111.1	G39 F108 K113 R114 D115	G39-M111 WeakPolarHBondContact O-CE 3.22Å; F108-M111 HydrophobicContact CD1-SD 4.07Å; F108-M111 WeakPolarHBondContact O-CB 3.19Å; F108-M111 PolarHBondContact O-N 3.22Å; F108-M111 VanDerWaalsContact O-N 3.1Å; M111-K113 VanDerWaalsContact C-N 3.25Å; M111-K113 PolarHBondContact O-N 2.83Å; M111-R114 PolarHBondContact O-N 3Å; M111-R114 VanDerWaalsContact O-N 3.11Å; M111-D115 PolarHBondContact O-N 3.25Å
112	Y	84.8	Confident	76.4	Confident	33 Å²	33	106.9 Å²	106.9	13%	0.129	52%	0.517	C	S	.	.	H	α-helix	trans	-67.1	-24.6	179.7	-52.3	-30.1	0	0	0	113.3	Y36 G39 F108 G109 R116	Y36-Y112 AromaticContact CD1-CD1 3.51Å; Y36-Y112 HydrophobicContact CD1-CD1 3.51Å; Y36-Y112 HydrophobicContact CD1-CE1 4.1Å; Y36-Y112 AromaticContact CD1-CG 3.97Å; Y36-Y112 HydrophobicContact CD1-CG 3.97Å; Y36-Y112 HydrophobicContact CE1-CD1 4.23Å; Y36-Y112 AromaticContact CG-CD1 3.92Å; Y36-Y112 HydrophobicContact CG-CD1 3.92Å; Y36-Y112 HydrophobicContact CG-CE1 4.5Å; Y36-Y112 AromaticContact CG-CG 3.93Å; Y36-Y112 HydrophobicContact CG-CG 3.93Å; G39-Y112 PolarHBondContact N-OH 3.12Å; G39-Y112 VanDerWaalsContact N-OH 3.12Å; F108-Y112 HydrophobicContact CB-CE1 3.89Å; F108-Y112 HydrophobicContact CB-CE2 3.85Å; F108-Y112 WeakPolarHBondContact O-CD2 3.32Å; F108-Y112 PolarHBondContact O-N 3.18Å; F108-Y112 VanDerWaalsContact O-N 3.09Å; G109-Y112 PolarHBondContact O-N 3.5Å; Y112-R116 VanDerWaalsContact O-CB 3.3Å; Y112-R116 WeakPolarHBondContact O-CB 3.05Å; Y112-R116 PolarHBondContact O-N 3.35Å
113	K	79.7	Confident	76.6	Confident	163 Å²	163	99.8 Å²	99.8	71%	0.709	49%	0.493	S	S	*	.	H	α-helix	trans	-71.2	-44.8	169.5	-74.7	-173.9	173.3	-166.3	0	111.3	G109 P110 M111 A117	G109-K113 PolarHBondContact O-N 3.35Å; P110-K113 PolarHBondContact O-N 3.32Å; M111-K113 VanDerWaalsContact C-N 3.25Å; M111-K113 PolarHBondContact O-N 2.83Å; K113-A117 WeakPolarHBondContact O-CB 3.43Å; K113-A117 PolarHBondContact O-N 3.44Å
114	R	79.9	Confident	76.9	Confident	163 Å²	163	99.9 Å²	99.9	62%	0.615	49%	0.488	S	S	*	.	H	α-helix	trans	-64.5	-48.2	179.5	-170.7	-175.8	-70.5	148.2	-6.4	112.2	P110 M111 R116 A117 L118	P110-R114 PolarHBondContact O-N 3.19Å; M111-R114 PolarHBondContact O-N 3Å; M111-R114 VanDerWaalsContact O-N 3.11Å; R114-R116 VanDerWaalsContact C-N 3.33Å; R114-R116 PolarHBondContact O-N 3.02Å; R114-A117 PolarHBondContact O-N 3.44Å; R114-A117 VanDerWaalsContact O-N 3.16Å; R114-L118 HydrophobicContact CG-CD1 4.1Å; R114-L118 WeakPolarHBondContact O-CG 3.43Å; R114-L118 PolarHBondContact O-N 3.4Å
115	D	75.7	Confident	77.4	Confident	55 Å²	55	101.6 Å²	101.6	29%	0.294	48%	0.481	S	S	.	.	H	α-helix	trans	-61.5	-41.4	178.2	-171	51.2	0	0	0	111.7	Y36 M111 A117 L118 K119	Y36-D115 HydrophobicContact CE1-CB 4.21Å; Y36-D115 WeakPolarHBondContact CE1-OD2 3.06Å; Y36-D115 PolarHBondContact OH-OD2 2.75Å; M111-D115 PolarHBondContact O-N 3.25Å; D115-A117 PolarHBondContact O-N 3.15Å; D115-L118 PolarHBondContact O-N 3.32Å; D115-K119 WeakPolarHBondContact O-CB 3.46Å; D115-K119 WeakPolarHBondContact O-CG 3.13Å; D115-K119 PolarHBondContact O-N 3.18Å; D115-K119 VanDerWaalsContact OD2-CE 3.32Å; D115-K119 WeakPolarHBondContact OD2-CE 3.08Å; D115-K119 IonicContact OD2-NZ 2.66Å; D115-K119 PolarHBondContact OD2-NZ 2.98Å
116	R	81.6	Confident	77.8	Confident	144 Å²	144	95.4 Å²	95.4	54%	0.543	46%	0.464	S	S	.	.	H	α-helix	trans	-59.8	-45.4	173.2	-174.5	-175	-61.7	-155.2	-3.9	112.1	Y36 Y112 R114 K119 Q120	Y36-R116 PolarHBondContact OH-N 2.95Å; Y112-R116 VanDerWaalsContact O-CB 3.3Å; Y112-R116 WeakPolarHBondContact O-CB 3.05Å; Y112-R116 PolarHBondContact O-N 3.35Å; R114-R116 VanDerWaalsContact C-N 3.33Å; R114-R116 PolarHBondContact O-N 3.02Å; R116-K119 PolarHBondContact O-N 3.34Å; R116-Q120 HydrophobicContact CG-CG 4.49Å; R116-Q120 WeakPolarHBondContact O-CB 3.14Å; R116-Q120 VanDerWaalsContact O-CG 3.29Å; R116-Q120 WeakPolarHBondContact O-CG 3.43Å; R116-Q120 PolarHBondContact O-N 3.13Å
117	A	78.8	Confident	78.2	Confident	51 Å²	51	101 Å²	101	42%	0.421	48%	0.478	S	S	.	.	H	α-helix	trans	-63.8	-45.6	179.6	0	0	0	0	0	111.7	K113 R114 D115 K119 Q120 Q121	K113-A117 WeakPolarHBondContact O-CB 3.43Å; K113-A117 PolarHBondContact O-N 3.44Å; R114-A117 PolarHBondContact O-N 3.44Å; R114-A117 VanDerWaalsContact O-N 3.16Å; D115-A117 PolarHBondContact O-N 3.15Å; A117-K119 PolarHBondContact O-N 2.93Å; A117-Q120 PolarHBondContact O-N 3.49Å; A117-Q121 WeakPolarHBondContact O-CB 3.35Å; A117-Q121 PolarHBondContact O-N 3.5Å
118	L	77.3	Confident	78	Confident	95 Å²	95	97.1 Å²	97.1	50%	0.497	47%	0.47	S	S	.	.	H	α-helix	trans	-60.4	-43.5	175.8	-71.9	167.3	0	0	0	112	R114 D115 Q121 K122	R114-L118 HydrophobicContact CG-CD1 4.1Å; R114-L118 WeakPolarHBondContact O-CG 3.43Å; R114-L118 PolarHBondContact O-N 3.4Å; D115-L118 PolarHBondContact O-N 3.32Å; L118-Q121 PolarHBondContact O-N 2.93Å; L118-K122 WeakPolarHBondContact O-CB 3.47Å; L118-K122 PolarHBondContact O-N 3.49Å
119	K	77	Confident	77	Confident	67 Å²	67	100.8 Å²	100.8	29%	0.291	49%	0.491	S	S	.	.	H	α-helix	trans	-65.6	-37.5	175.5	-73.7	178.5	174.3	-172	0	112.7	E24 D115 R116 A117 K122 K123	E24-K119 IonicContact OE1-NZ 2.98Å; E24-K119 PolarHBondContact OE1-NZ 3.39Å; E24-K119 IonicContact OE2-NZ 3.92Å; E24-K119 PolarHBondContact OE2-NZ 3.2Å; D115-K119 WeakPolarHBondContact O-CB 3.46Å; D115-K119 WeakPolarHBondContact O-CG 3.13Å; D115-K119 PolarHBondContact O-N 3.18Å; D115-K119 VanDerWaalsContact OD2-CE 3.32Å; D115-K119 WeakPolarHBondContact OD2-CE 3.08Å; D115-K119 IonicContact OD2-NZ 2.66Å; D115-K119 PolarHBondContact OD2-NZ 2.98Å; R116-K119 PolarHBondContact O-N 3.34Å; A117-K119 PolarHBondContact O-N 2.93Å; K119-K122 PolarHBondContact O-N 3.47Å; K119-K123 PolarHBondContact O-N 2.7Å
120	Q	80.9	Confident	75.6	Confident	125 Å²	125	103.3 Å²	103.3	58%	0.584	52%	0.518	S	S	*	.	H	α-helix	trans	-66.6	-43.6	174	-76.2	174.4	-38.1	0	0	111.6	R116 A117 K122 K123 A124	R116-Q120 HydrophobicContact CG-CG 4.49Å; R116-Q120 WeakPolarHBondContact O-CB 3.14Å; R116-Q120 VanDerWaalsContact O-CG 3.29Å; R116-Q120 WeakPolarHBondContact O-CG 3.43Å; R116-Q120 PolarHBondContact O-N 3.13Å; A117-Q120 PolarHBondContact O-N 3.49Å; Q120-K122 VanDerWaalsContact C-N 3.35Å; Q120-K122 PolarHBondContact O-N 3.38Å; Q120-K123 PolarHBondContact O-N 3.07Å; Q120-A124 WeakPolarHBondContact O-CB 3.19Å; Q120-A124 PolarHBondContact O-N 2.91Å
121	Q	80.5	Confident	74	Confident	133 Å²	133	108 Å²	108	62%	0.621	53%	0.528	S	S	*	.	H	α-helix	trans	-61.1	-41.5	174.3	-171.5	179.3	6.2	0	0	111.6	A117 L118 A124 L125	A117-Q121 WeakPolarHBondContact O-CB 3.35Å; A117-Q121 PolarHBondContact O-N 3.5Å; L118-Q121 PolarHBondContact O-N 2.93Å; Q121-A124 PolarHBondContact O-N 3.48Å; Q121-L125 WeakPolarHBondContact O-CB 3.41Å; Q121-L125 PolarHBondContact O-N 2.96Å
122	K	75.3	Confident	72.1	Confident	144 Å²	144	113.6 Å²	113.6	63%	0.626	55%	0.551	S	S	*	*	H	α-helix	trans	-64.7	-44.1	174.4	-173.1	171.2	-179.9	174.6	0	112.5	L118 K119 Q120 A124 L125 I126	L118-K122 WeakPolarHBondContact O-CB 3.47Å; L118-K122 PolarHBondContact O-N 3.49Å; K119-K122 PolarHBondContact O-N 3.47Å; Q120-K122 VanDerWaalsContact C-N 3.35Å; Q120-K122 PolarHBondContact O-N 3.38Å; K122-A124 VanDerWaalsContact C-N 3.29Å; K122-A124 PolarHBondContact O-N 3.35Å; K122-L125 PolarHBondContact O-N 3.13Å; K122-I126 HydrophobicContact CG-CD1 4.08Å; K122-I126 VanDerWaalsContact O-CG1 3.31Å; K122-I126 WeakPolarHBondContact O-CG1 3.37Å; K122-I126 PolarHBondContact O-N 2.94Å; K122-I126 VanDerWaalsContact O-N 3.07Å
123	K	76.8	Confident	69.9	Low	108 Å²	108	120 Å²	120	47%	0.47	59%	0.586	S	S	.	*	H	α-helix	trans	-61	-37.3	172.9	-80.2	-162.1	173.4	-170.2	0	111.7	D21 K119 Q120 R127	D21-K123 IonicContact OD1-NZ 2.67Å; D21-K123 PolarHBondContact OD1-NZ 2.7Å; K119-K123 PolarHBondContact O-N 2.7Å; Q120-K123 PolarHBondContact O-N 3.07Å; K123-R127 PolarHBondContact O-N 3.15Å; K123-R127 VanDerWaalsContact O-N 3.16Å
124	A	73.9	Confident	67.7	Low	56 Å²	56	121.2 Å²	121.2	46%	0.463	59%	0.594	S	S	.	*	H	α-helix	trans	-68	-43.2	176.4	0	0	0	0	0	113	Q120 Q121 K122 I126 R127 S128	Q120-A124 WeakPolarHBondContact O-CB 3.19Å; Q120-A124 PolarHBondContact O-N 2.91Å; Q121-A124 PolarHBondContact O-N 3.48Å; K122-A124 VanDerWaalsContact C-N 3.29Å; K122-A124 PolarHBondContact O-N 3.35Å; A124-I126 PolarHBondContact O-N 3.14Å; A124-R127 WeakPolarHBondContact O-CB 3.32Å; A124-R127 PolarHBondContact O-N 2.93Å; A124-R127 VanDerWaalsContact O-N 3.16Å; A124-S128 PolarHBondContact O-N 3.23Å
125	L	74.8	Confident	65.4	Low	104 Å²	104	120 Å²	120	55%	0.545	61%	0.605	S	S	.	*	H	α-helix	trans	-65.1	-37.9	177.9	-177.8	62.8	0	0	0	112.5	Q121 K122 R127 S128 N129	Q121-L125 WeakPolarHBondContact O-CB 3.41Å; Q121-L125 PolarHBondContact O-N 2.96Å; K122-L125 PolarHBondContact O-N 3.13Å; L125-R127 VanDerWaalsContact C-N 3.32Å; L125-S128 WeakPolarHBondContact CA-OG 3.49Å; L125-S128 PolarHBondContact O-N 2.77Å; L125-S128 PolarHBondContact O-OG 2.86Å; L125-N129 WeakPolarHBondContact O-CB 3.44Å; L125-N129 VanDerWaalsContact O-CG 3.31Å; L125-N129 PolarHBondContact O-N 2.97Å; L125-N129 PolarHBondContact O-OD1 3.42Å
126	I	73.4	Confident	63.3	Low	109 Å²	109	123 Å²	123	56%	0.559	63%	0.631	S	S	*	*	H	α-helix	trans	-63.1	-42.1	172.9	-67.7	165.3	0	0	0	110.1	K122 A124 N129 G130	K122-I126 HydrophobicContact CG-CD1 4.08Å; K122-I126 VanDerWaalsContact O-CG1 3.31Å; K122-I126 WeakPolarHBondContact O-CG1 3.37Å; K122-I126 PolarHBondContact O-N 2.94Å; K122-I126 VanDerWaalsContact O-N 3.07Å; A124-I126 PolarHBondContact O-N 3.14Å; I126-N129 PolarHBondContact O-N 2.82Å; I126-G130 PolarHBondContact O-N 3.41Å
127	R	76.1	Confident	61	Low	208 Å²	208	120.9 Å²	120.9	79%	0.785	64%	0.644	S	S	*	*	H	α-helix	trans	-64.7	-37.6	176.4	-173.5	-179	-71	-172.8	-6.2	113	K123 A124 L125	K123-R127 PolarHBondContact O-N 3.15Å; K123-R127 VanDerWaalsContact O-N 3.16Å; A124-R127 WeakPolarHBondContact O-CB 3.32Å; A124-R127 PolarHBondContact O-N 2.93Å; A124-R127 VanDerWaalsContact O-N 3.16Å; L125-R127 VanDerWaalsContact C-N 3.32Å
128	S	68.3	Low	59	Low	66 Å²	66	124 Å²	124	46%	0.462	66%	0.66	S	S	.	*	H	α-helix	trans	-72	-34.8	177	57.5	0	0	0	0	113.1	A124 L125 G130 F131	A124-S128 PolarHBondContact O-N 3.23Å; L125-S128 WeakPolarHBondContact CA-OG 3.49Å; L125-S128 PolarHBondContact O-N 2.77Å; L125-S128 PolarHBondContact O-OG 2.86Å; S128-G130 VanDerWaalsContact C-N 3.3Å; S128-G130 PolarHBondContact O-N 3.45Å; S128-F131 PolarHBondContact O-N 3.04Å
129	N	58	Low	57	Low	109 Å²	109	125.1 Å²	125.1	58%	0.583	67%	0.673	S	S	*	*	H	α-helix	trans	-74.7	-20.9	-177.9	-71.5	15.8	0	0	0	112.9	L125 I126 F131	L125-N129 WeakPolarHBondContact O-CB 3.44Å; L125-N129 VanDerWaalsContact O-CG 3.31Å; L125-N129 PolarHBondContact O-N 2.97Å; L125-N129 PolarHBondContact O-OD1 3.42Å; I126-N129 PolarHBondContact O-N 2.82Å; N129-F131 PolarHBondContact O-N 3Å; N129-F131 VanDerWaalsContact O-N 3.14Å
130	G	50.5	Low	55.2	Low	66 Å²	66	128.1 Å²	128.1	68%	0.68	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.3	-5.1	172.8	0	0	0	0	0	115.4	I126 S128	I126-G130 PolarHBondContact O-N 3.41Å; S128-G130 VanDerWaalsContact C-N 3.3Å; S128-G130 PolarHBondContact O-N 3.45Å
131	F	47.2	Very low	53	Low	192 Å²	192	126.9 Å²	126.9	84%	0.842	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.6	11	-175.9	-120.2	-84.6	0	0	0	114.8	S128 N129	S128-F131 PolarHBondContact O-N 3.04Å; N129-F131 PolarHBondContact O-N 3Å; N129-F131 VanDerWaalsContact O-N 3.14Å
132	K	43.7	Very low	50.5	Low	194 Å²	194	126.2 Å²	126.2	84%	0.843	72%	0.721	S	S	*	*			trans	-127	79.3	176.5	-81.2	-165.1	170.9	-171	0	112.7
133	L	37.7	Very low	48.6	Very low	167 Å²	167	124.8 Å²	124.8	87%	0.874	73%	0.726	S	S	*	*			trans	-152.9	89.1	159.4	-173.9	68.4	0	0	0	111.5
134	E	34	Very low	46.4	Very low	189 Å²	189	127.6 Å²	127.6	88%	0.883	75%	0.745	S	S	*	*			trans	-157.4	165.4	148.3	-82.7	-137.2	117.5	0	0	108.6
135	T	31.9	Very low	44.2	Very low	138 Å²	138	134.1 Å²	134.1	85%	0.847	77%	0.766	S	S	*	*			trans	74.8	71.3	177.1	-40.5	0	0	0	0	117.6
136	S	31.2	Very low	42	Very low	118 Å²	118	135.2 Å²	135.2	83%	0.825	78%	0.777	S	S	*	*				-178.1	121.5	124.2	60.7	0	0	0	0	111.1
137	A	33	Very low	39.8	Very low	100 Å²	100	136.8 Å²	136.8	83%	0.826	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-94.1	140.7	174.8	0	0	0	0	0	111.5
138	P	36.7	Very low	37.6	Very low	115 Å²	115	138.1 Å²	138.1	75%	0.747	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-83.7	150	174.8	33.8	-34.2	0	0	0	112.4
139	P	36.7	Very low	35.6	Very low	120 Å²	120	139.7 Å²	139.7	78%	0.779	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-75.6	156.4	171.3	32.3	-34.7	0	0	0	112.2
140	P	38	Very low	34	Very low	129 Å²	129	144.2 Å²	144.2	84%	0.838	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-80	159	-176.7	33.2	-36.4	0	0	0	113.7
141	A	34.8	Very low	32.9	Very low	100 Å²	100	146.9 Å²	146.9	83%	0.826	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-92.2	160	178.6	0	0	0	0	0	113.6
142	S	28.4	Very low	31.9	Very low	119 Å²	119	140.8 Å²	140.8	83%	0.832	81%	0.814	S	S	*	*			trans	-146.8	156.5	169.8	-71.1	0	0	0	0	109.5
143	P	36.5	Very low	31.9	Very low	113 Å²	113	137.1 Å²	137.1	73%	0.734	81%	0.81	S	S	*	*			trans	-113.4	158.4	-135.3	39.7	-35	0	0	0	117.6
144	L	28.9	Very low	31.4	Very low	167 Å²	167	136 Å²	136	87%	0.874	80%	0.804	S	S	*	*			trans	41.4	116.4	144.4	-66.1	168.1	0	0	0	119.7
145	Q	28.3	Very low	31.1	Very low	194 Å²	194	135.5 Å²	135.5	91%	0.907	80%	0.801	S	S	*	*			trans	-152.5	129.2	130.1	-117.1	166	27.5	0	0	114.6
146	T	28.5	Very low	30.9	Very low	126 Å²	126	133.6 Å²	133.6	77%	0.773	80%	0.8	S	S	*	*			trans	-3.7	141.1	162.1	-35.8	0	0	0	0	121.6
147	D	27.9	Very low	30.6	Very low	142 Å²	142	135.8 Å²	135.8	76%	0.759	80%	0.801	S	S	*	*			trans	-63	153.2	168.8	-48.7	-95.7	0	0	0	115.2
148	Y	30	Very low	30.8	Very low	236 Å²	236	136 Å²	136	93%	0.925	80%	0.795	S	S	*	*			trans	-150.2	151.6	143.2	-114.5	-82.2	0	0	0	110.2
149	S	25	Very low	30.2	Very low	99 Å²	99	135.7 Å²	135.7	69%	0.692	79%	0.79	S	S	*	*			trans	-116.6	175	-166.4	-65.4	0	0	0	0	114.2
150	F	25.7	Very low	29.7	Very low	205 Å²	205	137.1 Å²	137.1	90%	0.899	79%	0.79	S	S	*	*			trans	73.2	144.3	171.8	-94.5	-139.5	0	0	0	115.2
151	T	27.6	Very low	29.2	Very low	121 Å²	121	136.7 Å²	136.7	74%	0.742	79%	0.79	S	S	*	*			cis	-139.6	163.5	2.2	49.6	0	0	0	0	112
152	G	26.1	Very low	28.8	Very low	65 Å²	65	141.7 Å²	141.7	67%	0.67	79%	0.793	S	S	*	*			trans	-95	-158.1	154.8	0	0	0	0	0	111.7
153	P	43.9	Very low	28.7	Very low	117 Å²	117	141.7 Å²	141.7	76%	0.76	79%	0.793	S	S	*	*			cis	-136.1	-158	-9.1	36.7	-15	0	0	0	113.6
154	L	27.3	Very low	28.3	Very low	143 Å²	143	143.9 Å²	143.9	75%	0.749	80%	0.798	S	S	*	*			trans	113.9	135.6	153.5	-56.5	-174.4	0	0	0	120.2
155	H	27.1	Very low	28.2	Very low	178 Å²	178	143.4 Å²	143.4	82%	0.824	80%	0.796	S	S	*	*			trans	12.7	137.7	158.2	-51.1	-69	0	0	0	120.8
156	A	26.8	Very low	28.4	Very low	99 Å²	99	140.4 Å²	140.4	82%	0.818	79%	0.793	S	S	*	*				-169.9	166.5	63.7	0	0	0	0	0	115.8
157	L	25.2	Very low	28.2	Very low	163 Å²	163	139.2 Å²	139.2	85%	0.853	79%	0.789	S	S	*	*			trans	-96.1	173.2	162.1	-87.2	157.7	0	0	0	108.9
158	P	37	Very low	28.3	Very low	105 Å²	105	138.5 Å²	138.5	68%	0.682	79%	0.79	S	S	*	*			cis	-152.1	-176.6	28	40.2	-16.3	0	0	0	119.9
159	T	24.4	Very low	28.6	Very low	108 Å²	108	133.7 Å²	133.7	66%	0.663	79%	0.788	S	S	*	*			trans	71.6	126	145	41.2	0	0	0	0	125.5
160	I	26.1	Very low	28.7	Very low	150 Å²	150	134.1 Å²	134.1	77%	0.769	79%	0.791	S	S	*	*			trans	69	117.3	132.6	-59.8	166.2	0	0	0	118.2
161	S	26.7	Very low	28.8	Very low	120 Å²	120	129.2 Å²	129.2	84%	0.839	78%	0.783	S	S	*	*				-164.2	159.9	95.7	-72.6	0	0	0	0	114.5
162	K	27.8	Very low	28.8	Very low	206 Å²	206	130.2 Å²	130.2	90%	0.896	78%	0.782	S	S	*	*			trans	-93.9	149.9	174.6	-60.5	172.7	177.9	175.5	0	112.1
163	S	25.4	Very low	28.8	Very low	119 Å²	119	133.2 Å²	133.2	83%	0.832	79%	0.787	S	S	*	*			trans	-164.2	167.7	146.2	51.2	0	0	0	0	111.3
164	L	27.8	Very low	27.9	Very low	158 Å²	158	132 Å²	132	83%	0.827	78%	0.782	S	S	*	*			trans	-111.5	167.4	-174.7	-78.7	80.9	0	0	0	112.8
165	L	27.7	Very low	28	Very low	158 Å²	158	130.6 Å²	130.6	83%	0.827	78%	0.779	S	S	*	*			trans	-13.8	148.9	155.4	-69.8	155.2	0	0	0	117.8
166	P	31.8	Very low	27.9	Very low	130 Å²	130	129.3 Å²	129.3	84%	0.844	78%	0.778	S	S	*	*				-136.1	177.3	111.7	38.6	-29.1	0	0	0	115
167	S	24.9	Very low	28.1	Very low	101 Å²	101	134 Å²	134	71%	0.706	78%	0.776	S	S	*	*			trans	-125	149.9	-169.7	54	0	0	0	0	114.3
168	T	30.3	Very low	28.2	Very low	127 Å²	127	133.5 Å²	133.5	78%	0.779	77%	0.769	S	S	*	*			trans	39.1	137.2	147.1	58.6	0	0	0	0	122.7
169	P	35.1	Very low	27.7	Very low	135 Å²	135	133.2 Å²	133.2	88%	0.877	78%	0.776	S	S	*	*			trans	-134	-178.7	132.6	38	-25.7	0	0	0	114.5
170	S	27	Very low	27.9	Very low	109 Å²	109	135.5 Å²	135.5	76%	0.762	78%	0.784	S	S	*	*			trans	-155.6	179.9	-174.5	77.6	0	0	0	0	111.8
171	S	27.7	Very low	27.9	Very low	102 Å²	102	134.9 Å²	134.9	71%	0.713	78%	0.781	S	S	*	*			cis	-126.1	-107.5	2.9	-72.4	0	0	0	0	112.6
172	I	28.5	Very low	28.2	Very low	142 Å²	142	139.4 Å²	139.4	73%	0.728	78%	0.782	S	S	*	*			cis	-160.2	137.3	1.4	-24.6	169.5	0	0	0	110.6
173	T	27.1	Very low	28.2	Very low	128 Å²	128	132.5 Å²	132.5	79%	0.785	77%	0.769	S	S	*	*			trans	59.5	158.4	159.5	44.2	0	0	0	0	120
174	S	23.9	Very low	29.1	Very low	92 Å²	92	132.7 Å²	132.7	64%	0.643	77%	0.767	S	S	*	*			cis	-164.1	163.9	-5	-117.1	0	0	0	0	113.2
175	T	28.7	Very low	29	Very low	112 Å²	112	131.4 Å²	131.4	69%	0.687	77%	0.766	S	S	*	*			trans	58.2	139.4	151.2	54.8	0	0	0	0	120
176	D	26.6	Very low	29	Very low	151 Å²	151	128.5 Å²	128.5	81%	0.807	76%	0.759	S	S	*	*			cis	-164.9	-171.9	-2.2	-105.2	-10.2	0	0	0	108.5
177	Y	30.3	Very low	29	Very low	199 Å²	199	130.6 Å²	130.6	78%	0.78	76%	0.762	S	S	*	*			cis	-148.1	-134.5	19.2	88.7	-43.7	0	0	0	114.3
178	E	28.3	Very low	29	Very low	152 Å²	152	129.4 Å²	129.4	71%	0.71	77%	0.766	S	S	*	*			trans	-61.9	165	-173.2	-64.3	-175.5	161.6	0	0	117.2
179	A	26.5	Very low	29	Very low	99 Å²	99	132.3 Å²	132.3	82%	0.818	77%	0.773	S	S	*	*			cis	-138.8	171.2	17.2	0	0	0	0	0	114.5
180	N	26.9	Very low	28.7	Very low	155 Å²	155	130 Å²	130	83%	0.829	77%	0.766	S	S	*	*			trans	-118.6	-156.2	-167.4	-146.6	-29.3	0	0	0	112.1
181	L	27.7	Very low	28.7	Very low	137 Å²	137	131.4 Å²	131.4	72%	0.717	76%	0.762	S	S	*	*			trans	89.3	121.6	173.9	-46.1	163.8	0	0	0	114.3
182	Y	31.5	Very low	28.7	Very low	215 Å²	215	134.6 Å²	134.6	84%	0.843	77%	0.766	S	S	*	*			cis	-150.5	147.9	-8	-105.4	-59.1	0	0	0	109.6
183	G	28.2	Very low	28.5	Very low	61 Å²	61	131.9 Å²	131.9	63%	0.629	76%	0.759	S	S	*	*			trans	-102.8	-148	158.7	0	0	0	0	0	110.6
184	P	44.2	Very low	28.6	Very low	123 Å²	123	134.2 Å²	134.2	80%	0.799	76%	0.761	S	S	*	*			cis	-126.8	-165.7	-9.6	39.1	-19.6	0	0	0	111
185	T	26.7	Very low	28.8	Very low	131 Å²	131	136.2 Å²	136.2	80%	0.804	77%	0.769	S	S	*	*				-177.9	164.5	81.2	-52	0	0	0	0	109
186	S	28.2	Very low	29.5	Very low	98 Å²	98	136 Å²	136	69%	0.685	77%	0.769	S	S	*	*			trans	-136.9	-174.1	-163	61.3	0	0	0	0	114.9
187	L	30	Very low	29.5	Very low	173 Å²	173	136.7 Å²	136.7	91%	0.906	77%	0.772	S	S	*	*			trans	89.4	138.6	160.2	-110.5	73.9	0	0	0	120.3
188	G	25.9	Very low	29.4	Very low	76 Å²	76	133.4 Å²	133.4	78%	0.784	77%	0.773	S	S	*	*			trans	167.4	107.9	172.7	0	0	0	0	0	109.9
189	M	30.2	Very low	29.9	Very low	188 Å²	188	131.1 Å²	131.1	93%	0.926	77%	0.771	S	S	*	*			trans	-134.9	143.3	-174.9	-97.8	-161.2	168.5	0	0	113.2
190	A	27.9	Very low	29.8	Very low	88 Å²	88	135.5 Å²	135.5	73%	0.727	78%	0.775	S	S	*	*			trans	-153.4	116.4	153.9	0	0	0	0	0	107.5
191	M	28.5	Very low	29.8	Very low	137 Å²	137	139.1 Å²	139.1	68%	0.675	78%	0.778	S	S	*	*				59.7	102	101.8	-62.2	-59.6	104.4	0	0	113.6
192	Q	27.1	Very low	29.7	Very low	170 Å²	170	141.2 Å²	141.2	79%	0.794	79%	0.785	S	S	*	*				77.6	138.8	91.4	-78.5	-173.2	8.4	0	0	114
193	S	24.2	Very low	29.4	Very low	84 Å²	84	142.4 Å²	142.4	59%	0.587	79%	0.789	S	S	*	*			cis	-166.3	166.5	-3.4	51.1	0	0	0	0	113.6
194	H	28.8	Very low	29.3	Very low	178 Å²	178	145.8 Å²	145.8	82%	0.824	80%	0.798	S	S	*	*			trans	72.3	166.2	162.7	-59.2	-61.3	0	0	0	121
195	V	28.3	Very low	28.5	Very low	133 Å²	133	144 Å²	144	81%	0.806	79%	0.794	S	S	*	*			trans	-166.8	161.1	-144.2	166.7	0	0	0	0	107.5
196	P	43.2	Very low	28.6	Very low	107 Å²	107	147 Å²	147	70%	0.695	80%	0.796	S	S	*	*			cis	-122.6	-179.4	-12.2	37.7	-22.6	0	0	0	114.1
197	L	27	Very low	29	Very low	166 Å²	166	148.4 Å²	148.4	87%	0.869	80%	0.803	S	S	*	*				-175.6	161.5	120.4	-100.9	166.1	0	0	0	112
198	T	27.7	Very low	28.9	Very low	131 Å²	131	147.8 Å²	147.8	80%	0.804	80%	0.8	S	S	*	*			trans	-123.6	-171.6	-179.4	60	0	0	0	0	110.6
199	P	38.7	Very low	29.1	Very low	104 Å²	104	156.1 Å²	156.1	68%	0.675	81%	0.808	S	S	*	*				-118.1	164.7	-97.8	35.6	-19.3	0	0	0	114.3
200	Q	25.9	Very low	29	Very low	190 Å²	190	151.4 Å²	151.4	89%	0.888	80%	0.799	S	S	*	*			trans	-128.7	129.2	161.1	-76.9	-163.9	-31.7	0	0	111.4
201	Y	26.9	Very low	29.1	Very low	231 Å²	231	155.4 Å²	155.4	91%	0.906	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-77.2	126.4	170.9	-77	-95.1	0	0	0	109.8
202	Q	24.2	Very low	29	Very low	182 Å²	182	158.1 Å²	158.1	85%	0.85	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-99.4	121.6	167.1	-75.3	-173.8	-30.3	0	0	110.4
203	Y	24.9	Very low	29	Very low	239 Å²	239	154.4 Å²	154.4	94%	0.937	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-65.5	134.3	165.6	-116.9	-97.5	0	0	0	109.3
204	T	27.1	Very low	29	Very low	132 Å²	132	160.2 Å²	160.2	81%	0.81	83%	0.831	S	S	*	*			trans	-116.4	137.6	169.9	46.8	0	0	0	0	109.7
205	A	26.3	Very low	29	Very low	87 Å²	87	157.3 Å²	157.3	72%	0.719	83%	0.829	S	S	*	*			trans	-116.9	135.3	-171.6	0	0	0	0	0	111.8
206	F	30.6	Very low	29.5	Very low	193 Å²	193	156.8 Å²	156.8	85%	0.846	83%	0.829	S	S	*	*			trans	17.7	143.3	159.5	-55.1	-75.1	0	0	0	121.9
207	P	34.6	Very low	28.8	Very low	128 Å²	128	158.8 Å²	158.8	83%	0.831	83%	0.834	S	S	*	*			trans	-103.7	143.7	135.6	34.3	-30	0	0	0	112.4
208	N	28.4	Very low	29	Very low	160 Å²	160	161.7 Å²	161.7	86%	0.856	84%	0.835	S	S	*	*			trans	-76.4	156.6	-178.3	-84.4	-52.2	0	0	0	114.5
209	R	30.7	Very low	29.1	Very low	250 Å²	250	161.1 Å²	161.1	94%	0.943	83%	0.831	S	S	*	*			trans	-144.8	129.8	138.8	-152.4	171.8	-169.3	172.4	3.7	110.7
210	A	27.6	Very low	28.8	Very low	89 Å²	89	160.9 Å²	160.9	74%	0.736	83%	0.832	S	S	*	*			trans	-101.9	162.6	-169.4	0	0	0	0	0	113.7
211	I	30.7	Very low	29.2	Very low	172 Å²	172	157.6 Å²	157.6	88%	0.882	83%	0.83	S	S	*	*			trans	-149.8	155.1	158.9	-98	147.2	0	0	0	108.4
212	K	25.5	Very low	30.3	Very low	194 Å²	194	152 Å²	152	84%	0.843	82%	0.822	S	S	*	*			trans	-63.3	144.9	-178.3	-60.7	175.2	178.7	-177.6	0	111.4
213	A	26.9	Very low	30.5	Very low	93 Å²	93	152.2 Å²	152.2	77%	0.769	82%	0.823	S	S	*	*			cis	82	104.1	33.5	0	0	0	0	0	115
214	E	24.6	Very low	30.9	Very low	205 Å²	205	145.1 Å²	145.1	96%	0.958	81%	0.808	S	S	*	*			trans	-161.5	139.2	154.7	-122.4	165.1	-141.4	0	0	109.4
215	C	29.4	Very low	31.2	Very low	117 Å²	117	146.6 Å²	146.6	79%	0.791	81%	0.809	S	S	*	*			trans	-164.7	139.6	178.9	-167.9	0	0	0	0	109.3
216	P	39	Very low	31.7	Very low	123 Å²	123	149 Å²	149	80%	0.799	82%	0.816	S	S	*	*			trans	-97.2	142	174.3	1.1	19.9	0	0	0	113.3
217	D	27.3	Very low	31.7	Very low	149 Å²	149	143 Å²	143	80%	0.797	81%	0.809	S	S	*	*			trans	-69.3	163.9	-176	-51	-89.4	0	0	0	115.8
218	Y	32	Very low	32	Very low	226 Å²	226	148.5 Å²	148.5	89%	0.886	81%	0.814	S	S	*	*			trans	-143.2	147.2	133.4	-113	-80.8	0	0	0	112.1
219	T	30.3	Very low	32.3	Very low	120 Å²	120	146.2 Å²	146.2	74%	0.736	81%	0.808	S	S	*	*			trans	-62.4	167.4	-176.7	55.9	0	0	0	0	114
220	S	31.3	Very low	32.9	Very low	99 Å²	99	144.7 Å²	144.7	69%	0.692	80%	0.804	S	S	*	*			cis	-165.7	133.7	20.9	25	0	0	0	0	109.7
221	S	33.9	Very low	33.5	Very low	121 Å²	121	145.3 Å²	145.3	85%	0.846	80%	0.801	S	S	*	*				72.3	154.6	104.9	-78.5	0	0	0	0	118.6
222	P	51.3	Low	33.9	Very low	112 Å²	112	144 Å²	144	73%	0.727	79%	0.791	S	S	*	*			trans	-128	176.5	-137.6	44.8	-33.3	0	0	0	116.4
223	E	28.5	Very low	34.4	Very low	187 Å²	187	141.2 Å²	141.2	87%	0.874	79%	0.789	S	S	*	*			trans	166.8	158.6	145.1	-94.4	167	-155.5	0	0	108.9
224	S	32.6	Very low	34.9	Very low	91 Å²	91	145 Å²	145	64%	0.636	79%	0.785	S	S	*	*			cis	-165.7	-179	-33	60.8	0	0	0	0	110.1
225	I	32.8	Very low	35.7	Very low	162 Å²	162	140.9 Å²	140.9	83%	0.831	78%	0.776	S	S	*	*			trans	76.6	130.8	165.6	-63.3	169.3	0	0	0	118.1
226	T	36.7	Very low	36.1	Very low	138 Å²	138	140.4 Å²	140.4	85%	0.847	77%	0.774	S	S	*	*			trans	-75.4	140	175.5	46.9	0	0	0	0	113.6
227	G	30.6	Very low	36.3	Very low	68 Å²	68	138.9 Å²	138.9	70%	0.701	77%	0.772	S	S	*	*			trans	-152.6	115.4	160.9	0	0	0	0	0	111.5	P229	G227-P229 WeakPolarHBondContact O-CD 3.4Å
228	Y	41.2	Very low	37	Very low	243 Å²	243	136 Å²	136	95%	0.953	76%	0.764	S	S	*	*			trans	-82.1	118.8	164.4	-84.9	-81.5	0	0	0	109
229	P	35.4	Very low	37.7	Very low	112 Å²	112	131.3 Å²	131.3	73%	0.727	76%	0.761	S	S	*	*			trans	-129	154.5	132.1	35.9	-28	0	0	0	111.8	G227 P231	G227-P229 WeakPolarHBondContact O-CD 3.4Å; P229-P231 WeakPolarHBondContact O-CD 3.47Å
230	Y	43.8	Very low	38.6	Very low	218 Å²	218	134 Å²	134	86%	0.855	77%	0.765	S	S	*	*			trans	-73.5	131.6	175.8	-149	-91.3	0	0	0	110.2
231	P	40.5	Very low	39.9	Very low	102 Å²	102	134.6 Å²	134.6	66%	0.662	77%	0.766	S	S	*	*			trans	-104.7	121.2	162.4	2.2	19.2	0	0	0	110.1	P229 V233	P229-P231 WeakPolarHBondContact O-CD 3.47Å; P231-V233 PolarHBondContact O-N 3.46Å
232	E	38.4	Very low	41.3	Very low	145 Å²	145	132.3 Å²	132.3	68%	0.678	75%	0.748	S	S	*	*			trans	-66.5	112	164.4	-67	176	113.8	0	0	109.5	Y234	E232-Y234 VanDerWaalsContact C-N 3.31Å; E232-Y234 HydrophobicContact CB-CD2 4.17Å; E232-Y234 HydrophobicContact CB-CE2 4.22Å; E232-Y234 PolarHBondContact O-N 3.28Å; E232-Y234 VanDerWaalsContact O-N 3.11Å
233	V	35.1	Very low	42.6	Very low	134 Å²	134	131.6 Å²	131.6	81%	0.812	75%	0.746	S	S	*	*			trans	-84.4	82.7	168	-174.2	0	0	0	0	108.3	P231 P235	P231-V233 PolarHBondContact O-N 3.46Å; V233-P235 WeakPolarHBondContact O-CD 3.39Å
234	Y	38	Very low	45.4	Very low	174 Å²	174	126.2 Å²	126.2	68%	0.682	72%	0.723	S	S	*	*			trans	-51.4	127.8	158.8	-81	-95.3	0	0	0	108.7	E232 S236	E232-Y234 VanDerWaalsContact C-N 3.31Å; E232-Y234 HydrophobicContact CB-CD2 4.17Å; E232-Y234 HydrophobicContact CB-CE2 4.22Å; E232-Y234 PolarHBondContact O-N 3.28Å; E232-Y234 VanDerWaalsContact O-N 3.11Å; Y234-S236 PolarHBondContact O-N 2.99Å
235	P	42.3	Very low	48.3	Very low	118 Å²	118	122 Å²	122	77%	0.766	69%	0.694	S	S	*	*			trans	-65	101.2	164.4	-14.1	28.7	0	0	0	107.3	V233 A237	V233-P235 WeakPolarHBondContact O-CD 3.39Å; P235-A237 PolarHBondContact O-N 3.27Å
236	S	38	Very low	51.2	Low	106 Å²	106	119.3 Å²	119.3	74%	0.741	69%	0.687	S	S	*	*			trans	-69	85	171.5	-174.5	0	0	0	0	108.1	Y234 S238	Y234-S236 PolarHBondContact O-N 2.99Å; S236-S238 PolarHBondContact O-N 3.46Å
237	A	43.3	Very low	54	Low	92 Å²	92	114.1 Å²	114.1	76%	0.76	65%	0.653	S	S	*	*			trans	-73.9	59	-176.9	0	0	0	0	0	111.3	P235 P239	P235-A237 PolarHBondContact O-N 3.27Å; A237-P239 WeakPolarHBondContact O-CD 3.23Å
238	S	40.2	Very low	57.1	Low	89 Å²	89	110.9 Å²	110.9	62%	0.622	62%	0.62	S	S	*	*			trans	-57.9	120.1	152.1	-62.7	0	0	0	0	106.7	S236 Q240	S236-S238 PolarHBondContact O-N 3.46Å; S238-Q240 PolarHBondContact O-N 2.98Å
239	P	48.2	Very low	59.6	Low	127 Å²	127	102.2 Å²	102.2	83%	0.825	59%	0.59	S	S	*	*			trans	-66.3	104.1	178.7	26.5	-32.9	0	0	0	108.3	A237	A237-P239 WeakPolarHBondContact O-CD 3.23Å
240	Q	49.1	Very low	62.4	Low	177 Å²	177	100.1 Å²	100.1	83%	0.827	57%	0.571	S	S	*	*	P	Polyproline II helix	trans	-59.4	137.2	166.5	-71.1	-168.9	-16	0	0	107.8	S238	S238-Q240 PolarHBondContact O-N 2.98Å
241	P	57.5	Low	64.8	Low	110 Å²	110	89.8 Å²	89.8	71%	0.714	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-57.8	142.6	173.1	26.5	-34	0	0	0	108.8	S243	P241-S243 PolarHBondContact O-N 3.37Å; P241-S243 VanDerWaalsContact O-N 3.11Å
242	P	63	Low	67.3	Low	73 Å²	73	87.6 Å²	87.6	47%	0.474	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-53.3	121.5	-175.4	19.7	-32.1	0	0	0	110.6	L244 S430	P242-L244 PolarHBondContact O-N 3.4Å; P242-L244 VanDerWaalsContact O-N 3.1Å; P242-S430 WeakPolarHBondContact CB-O 3.37Å; P242-S430 WeakPolarHBondContact CG-O 3.45Å
243	S	79.3	Confident	69.9	Low	98 Å²	98	90.4 Å²	90.4	69%	0.685	52%	0.517	S	S	*	.			trans	-68.5	108.9	-177.3	53.8	0	0	0	0	109.9	P241	P241-S243 PolarHBondContact O-N 3.37Å; P241-S243 VanDerWaalsContact O-N 3.11Å
244	L	87.2	Confident	72.6	Confident	74 Å²	74	84.9 Å²	84.9	39%	0.387	48%	0.484	S	S	.	.			trans	-47.9	124.1	174.7	-81.7	148.3	0	0	0	110.7	P242 L249 R389 Y427	P242-L244 PolarHBondContact O-N 3.4Å; P242-L244 VanDerWaalsContact O-N 3.1Å; L244-L249 HydrophobicContact CB-CD1 4.1Å; L244-L249 HydrophobicContact CB-CD2 3.84Å; L244-L249 HydrophobicContact CB-CG 3.94Å; L244-L249 HydrophobicContact CD1-CD2 4.04Å; L244-L249 HydrophobicContact CG-CD2 4.36Å; L244-R389 HydrophobicContact CD2-CG 4.11Å; L244-Y427 HydrophobicContact CD2-CD2 3.75Å; L244-Y427 HydrophobicContact CD2-CE2 3.45Å; L244-Y427 VanDerWaalsContact CD2-CE2 3.45Å
245	P	93.3	Very high	75.1	Confident	2 Å²	2	78.4 Å²	78.4	1%	0.013	46%	0.461	C	S	.	.			trans	-55.9	133.3	-177.5	-28.9	36.4	0	0	0	111.2	L247 V248 L249 A423 E426	P245-L247 PolarHBondContact O-N 3.45Å; P245-L247 VanDerWaalsContact O-N 3.11Å; P245-V248 HydrophobicContact CB-CB 4.46Å; P245-V248 HydrophobicContact CB-CG2 4.09Å; P245-V248 HydrophobicContact CG-CG2 4.4Å; P245-V248 WeakPolarHBondContact O-CB 3.47Å; P245-V248 PolarHBondContact O-N 3.05Å; P245-L249 PolarHBondContact O-N 2.88Å; P245-A423 HydrophobicContact CB-CB 4.4Å; P245-E426 HydrophobicContact CG-CB 4.04Å; P245-E426 HydrophobicContact CG-CG 3.8Å
246	P	93.9	Very high	77.4	Confident	106 Å²	106	75.1 Å²	75.1	69%	0.688	44%	0.44	S	S	*	.	H	α-helix	trans	-55.4	-36.9	-171.7	-29.3	35.6	0	0	0	114	L249 E250	P246-L249 WeakPolarHBondContact O-CB 3.39Å; P246-L249 PolarHBondContact O-N 3.31Å; P246-E250 PolarHBondContact O-N 2.92Å; P246-E250 VanDerWaalsContact O-N 3.13Å
247	L	95	Very high	79.9	Confident	28 Å²	28	74.5 Å²	74.5	15%	0.147	43%	0.428	C	S	.	.	H	α-helix	trans	-63.1	-45.2	176.2	-179.6	56.4	0	0	0	111.7	P245 L249 E250 L251 F308 Q419 A423	P245-L247 PolarHBondContact O-N 3.45Å; P245-L247 VanDerWaalsContact O-N 3.11Å; L247-L249 PolarHBondContact O-N 3.46Å; L247-E250 WeakPolarHBondContact O-CA 3.21Å; L247-E250 PolarHBondContact O-N 3.36Å; L247-L251 HydrophobicContact CD1-CD2 3.9Å; L247-L251 HydrophobicContact CD1-CG 4.04Å; L247-L251 HydrophobicContact CG-CD1 4.3Å; L247-L251 HydrophobicContact CG-CG 4.19Å; L247-L251 WeakPolarHBondContact O-CG 3.21Å; L247-L251 PolarHBondContact O-N 2.88Å; L247-F308 HydrophobicContact CD1-CE2 3.8Å; L247-F308 HydrophobicContact CD1-CZ 3.76Å; L247-Q419 HydrophobicContact CD2-CB 3.86Å; L247-A423 HydrophobicContact CB-CB 3.99Å; L247-A423 HydrophobicContact CD2-CB 3.91Å; L247-A423 HydrophobicContact CG-CB 4.23Å
248	V	95.5	Very high	82.1	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	40%	0.4	C	S	.	.	H	α-helix	trans	-59.6	-36.4	178.7	176.3	0	0	0	0	111.4	P245 L252 R389 A423	P245-V248 HydrophobicContact CB-CB 4.46Å; P245-V248 HydrophobicContact CB-CG2 4.09Å; P245-V248 HydrophobicContact CG-CG2 4.4Å; P245-V248 WeakPolarHBondContact O-CB 3.47Å; P245-V248 PolarHBondContact O-N 3.05Å; V248-L252 VanDerWaalsContact O-CB 3.29Å; V248-L252 WeakPolarHBondContact O-CB 3.46Å; V248-L252 PolarHBondContact O-N 3.4Å; V248-R389 HydrophobicContact CG1-CB 3.66Å; V248-R389 HydrophobicContact CG1-CG 3.95Å; V248-A423 HydrophobicContact CG2-CB 3.95Å
249	L	93.9	Very high	84.6	Confident	61 Å²	61	72.3 Å²	72.3	32%	0.319	40%	0.395	S	S	.	.	H	α-helix	trans	-66.4	-38.1	173.3	-64.8	174.2	0	0	0	112.5	L244 P245 P246 L247 R253	L244-L249 HydrophobicContact CB-CD1 4.1Å; L244-L249 HydrophobicContact CB-CD2 3.84Å; L244-L249 HydrophobicContact CB-CG 3.94Å; L244-L249 HydrophobicContact CD1-CD2 4.04Å; L244-L249 HydrophobicContact CG-CD2 4.36Å; P245-L249 PolarHBondContact O-N 2.88Å; P246-L249 WeakPolarHBondContact O-CB 3.39Å; P246-L249 PolarHBondContact O-N 3.31Å; L247-L249 PolarHBondContact O-N 3.46Å; L249-R253 WeakPolarHBondContact O-CD 3.47Å; L249-R253 WeakPolarHBondContact O-CG 3.29Å; L249-R253 PolarHBondContact O-N 2.9Å
250	E	94.1	Very high	86.7	Confident	69 Å²	69	70 Å²	70	32%	0.322	38%	0.378	S	S	.	.	H	α-helix	trans	-70.7	-42.7	176.1	-178.2	160.3	-144.7	0	0	112.7	P246 L247 L252 R253 C254 I307	P246-E250 PolarHBondContact O-N 2.92Å; P246-E250 VanDerWaalsContact O-N 3.13Å; L247-E250 WeakPolarHBondContact O-CA 3.21Å; L247-E250 PolarHBondContact O-N 3.36Å; E250-L252 VanDerWaalsContact C-N 3.33Å; E250-L252 PolarHBondContact O-N 2.95Å; E250-R253 PolarHBondContact O-N 3.3Å; E250-C254 PolarHBondContact O-N 2.97Å; E250-C254 PolarHBondContact O-SG 2.75Å; E250-I307 WeakPolarHBondContact OE1-CD1 3.31Å
251	L	94.6	Very high	88.8	Confident	1 Å²	1	62.2 Å²	62.2	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-60.1	-43.8	173.9	-60.9	-172.5	0	0	0	111	L247 R253 C254 F308 F396 V420	L247-L251 HydrophobicContact CD1-CD2 3.9Å; L247-L251 HydrophobicContact CD1-CG 4.04Å; L247-L251 HydrophobicContact CG-CD1 4.3Å; L247-L251 HydrophobicContact CG-CG 4.19Å; L247-L251 WeakPolarHBondContact O-CG 3.21Å; L247-L251 PolarHBondContact O-N 2.88Å; L251-R253 PolarHBondContact O-N 3.19Å; L251-C254 WeakPolarHBondContact O-CB 3.26Å; L251-C254 PolarHBondContact O-N 3.49Å; L251-F308 HydrophobicContact CD2-CE2 4.2Å; L251-F396 HydrophobicContact CB-CD2 3.71Å; L251-F396 HydrophobicContact CB-CE2 3.67Å; L251-F396 HydrophobicContact CD1-CB 4.39Å; L251-F396 HydrophobicContact CD1-CD2 3.85Å; L251-F396 HydrophobicContact CD1-CG 4.36Å; L251-F396 HydrophobicContact CD2-CD1 4.44Å; L251-F396 HydrophobicContact CD2-CD2 3.57Å; L251-F396 HydrophobicContact CD2-CE2 3.72Å; L251-F396 HydrophobicContact CD2-CG 3.96Å; L251-F396 HydrophobicContact CD2-CZ 4.23Å; L251-F396 HydrophobicContact CG-CD2 3.86Å; L251-F396 HydrophobicContact CG-CE2 4.14Å; L251-V420 HydrophobicContact CD1-CG1 3.96Å; L251-V420 HydrophobicContact CD1-CG2 3.97Å
252	L	93.8	Very high	90.6	Very high	56 Å²	56	59.5 Å²	59.5	29%	0.293	32%	0.321	S	S	.	.	H	α-helix	trans	-66	-36	177.8	-175.4	64.3	0	0	0	112.6	V248 E250 C254 D255 R388 R389 A392	V248-L252 VanDerWaalsContact O-CB 3.29Å; V248-L252 WeakPolarHBondContact O-CB 3.46Å; V248-L252 PolarHBondContact O-N 3.4Å; E250-L252 VanDerWaalsContact C-N 3.33Å; E250-L252 PolarHBondContact O-N 2.95Å; L252-C254 PolarHBondContact O-N 3.26Å; L252-D255 PolarHBondContact O-N 3.18Å; L252-R388 HydrophobicContact CD1-CB 4.29Å; L252-R389 HydrophobicContact CD2-CG 4.33Å; L252-A392 HydrophobicContact CD1-CB 4.45Å
253	R	92.7	Very high	92.1	Very high	204 Å²	204	60.4 Å²	60.4	77%	0.77	32%	0.321	S	S	*	.	H	α-helix	trans	-63.7	-18.6	174.1	-77	166.3	-177.6	172	2.1	113.8	L249 E250 L251	L249-R253 WeakPolarHBondContact O-CD 3.47Å; L249-R253 WeakPolarHBondContact O-CG 3.29Å; L249-R253 PolarHBondContact O-N 2.9Å; E250-R253 PolarHBondContact O-N 3.3Å; L251-R253 PolarHBondContact O-N 3.19Å
254	C	92	Very high	92.8	Very high	18 Å²	18	60.3 Å²	60.3	12%	0.122	31%	0.309	C	S	.	.	H	α-helix	trans	-81.1	-25.8	176.9	-61.7	0	0	0	0	112.7	E250 L251 L252 W302 S305 F396	E250-C254 PolarHBondContact O-N 2.97Å; E250-C254 PolarHBondContact O-SG 2.75Å; L251-C254 WeakPolarHBondContact O-CB 3.26Å; L251-C254 PolarHBondContact O-N 3.49Å; L252-C254 PolarHBondContact O-N 3.26Å; C254-W302 VanDerWaalsContact O-CD1 3.25Å; C254-S305 WeakPolarHBondContact CB-OG 3.47Å; C254-S305 PolarHBondContact O-OG 2.7Å; C254-S305 VanDerWaalsContact O-OG 3.12Å; C254-F396 HydrophobicContact CB-CE2 4.42Å; C254-F396 HydrophobicContact CB-CZ 3.99Å
255	D	91	Very high	93.2	Very high	38 Å²	38	56.8 Å²	56.8	20%	0.203	29%	0.29	C	S	.	.	S	Bend	trans	-73.6	126.4	-173.7	-153.4	42.7	0	0	0	111	L252 K395	L252-D255 PolarHBondContact O-N 3.18Å; D255-K395 IonicContact OD1-NZ 2.76Å; D255-K395 PolarHBondContact OD1-NZ 3.35Å
256	P	89.8	Confident	93.2	Very high	49 Å²	49	58.5 Å²	58.5	32%	0.318	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-74.2	151.2	-174.9	31	-36.4	0	0	0	112	E258 V261	P256-E258 PolarHBondContact O-N 3.03Å; P256-V261 HydrophobicContact CB-CG2 3.86Å; P256-V261 HydrophobicContact CG-CG2 3.86Å
257	D	90.7	Very high	93.2	Very high	93 Å²	93	56 Å²	56	50%	0.497	29%	0.289	S	S	.	.	P	Polyproline II helix	trans	-60.1	127.5	172.1	179.5	-86.6	0	0	0	111.3	L259 V260 V261	D257-L259 PolarHBondContact O-N 2.75Å; D257-L259 WeakPolarHBondContact OD1-CA 3.36Å; D257-L259 WeakPolarHBondContact OD1-CB 3.48Å; D257-L259 PolarHBondContact OD1-N 3.26Å; D257-V260 HydrophobicContact CB-CB 4.1Å; D257-V260 HydrophobicContact CB-CG2 3.92Å; D257-V260 PolarHBondContact O-N 3.19Å; D257-V260 PolarHBondContact OD1-N 3.46Å; D257-V261 WeakPolarHBondContact O-CG2 3.43Å; D257-V261 PolarHBondContact O-N 3.31Å
258	E	89.4	Confident	93	Very high	36 Å²	36	57.8 Å²	57.8	17%	0.168	30%	0.296	C	S	.	.	H	α-helix	trans	-67.7	-34.8	-172.6	-179.8	165.7	-159.1	0	0	112.6	P256 V261 Q262 R336 R388	P256-E258 PolarHBondContact O-N 3.03Å; E258-V261 PolarHBondContact O-N 2.93Å; E258-Q262 WeakPolarHBondContact O-CB 3.15Å; E258-Q262 PolarHBondContact O-N 3.11Å; E258-R336 IonicContact OE1-CZ 2.74Å; E258-R336 IonicContact OE1-NE 2.73Å; E258-R336 PolarHBondContact OE1-NE 3.11Å; E258-R336 IonicContact OE1-NH2 2.55Å; E258-R336 PolarHBondContact OE1-NH2 3.36Å; E258-R388 IonicContact OE2-CZ 2.75Å; E258-R388 IonicContact OE2-NH2 2.73Å; E258-R388 PolarHBondContact OE2-NH2 3.31Å
259	L	92.1	Very high	92.7	Very high	99 Å²	99	58.3 Å²	58.3	52%	0.518	30%	0.299	S	S	.	.	H	α-helix	trans	-72.1	-35.2	177.1	179.8	60.1	0	0	0	110.7	D257 N263	D257-L259 PolarHBondContact O-N 2.75Å; D257-L259 WeakPolarHBondContact OD1-CA 3.36Å; D257-L259 WeakPolarHBondContact OD1-CB 3.48Å; D257-L259 PolarHBondContact OD1-N 3.26Å; L259-N263 VanDerWaalsContact O-CB 3.27Å; L259-N263 WeakPolarHBondContact O-CB 3.31Å; L259-N263 PolarHBondContact O-N 3.47Å; L259-N263 PolarHBondContact O-ND2 2.87Å
260	V	93	Very high	92.4	Very high	78 Å²	78	60.9 Å²	60.9	47%	0.473	31%	0.309	S	S	.	.	H	α-helix	trans	-63	-43.3	170.5	174.4	0	0	0	0	111.1	D257 N263 K264	D257-V260 HydrophobicContact CB-CB 4.1Å; D257-V260 HydrophobicContact CB-CG2 3.92Å; D257-V260 PolarHBondContact O-N 3.19Å; D257-V260 PolarHBondContact OD1-N 3.46Å; V260-N263 PolarHBondContact O-N 3.36Å; V260-K264 WeakPolarHBondContact O-CB 3.47Å; V260-K264 WeakPolarHBondContact O-CG 3.33Å; V260-K264 PolarHBondContact O-N 3.14Å
261	V	92.7	Very high	92.1	Very high	14 Å²	14	64.7 Å²	64.7	9%	0.085	33%	0.327	C	S	.	.	H	α-helix	trans	-65.8	-45.9	176.4	173.1	0	0	0	0	111.5	P256 D257 E258 N263 K264 I265	P256-V261 HydrophobicContact CB-CG2 3.86Å; P256-V261 HydrophobicContact CG-CG2 3.86Å; D257-V261 WeakPolarHBondContact O-CG2 3.43Å; D257-V261 PolarHBondContact O-N 3.31Å; E258-V261 PolarHBondContact O-N 2.93Å; V261-N263 PolarHBondContact O-N 3.37Å; V261-K264 PolarHBondContact O-N 3.03Å; V261-I265 HydrophobicContact CG1-CD1 3.71Å; V261-I265 VanDerWaalsContact O-CG1 3.32Å; V261-I265 WeakPolarHBondContact O-CG1 3.44Å; V261-I265 PolarHBondContact O-N 2.94Å
262	Q	95	Very high	91.3	Very high	53 Å²	53	67.8 Å²	67.8	25%	0.248	34%	0.342	C	S	.	.	H	α-helix	trans	-54.7	-50.2	173.3	172.8	176.5	11.8	0	0	111.2	E258 I265 V266 V349 T350	E258-Q262 WeakPolarHBondContact O-CB 3.15Å; E258-Q262 PolarHBondContact O-N 3.11Å; Q262-I265 PolarHBondContact O-N 3.26Å; Q262-V266 HydrophobicContact CG-CG2 4.29Å; Q262-V266 WeakPolarHBondContact O-CB 3.39Å; Q262-V266 VanDerWaalsContact O-CG2 3.31Å; Q262-V266 WeakPolarHBondContact O-CG2 3.3Å; Q262-V266 PolarHBondContact O-N 2.88Å; Q262-V349 WeakPolarHBondContact CG-O 3.47Å; Q262-T350 PolarHBondContact NE2-O 3.47Å
263	N	95	Very high	90.4	Very high	91 Å²	91	70.1 Å²	70.1	49%	0.487	35%	0.351	S	S	.	.	H	α-helix	trans	-64.8	-41.5	-178.8	-74.8	-36	0	0	0	112.5	L259 V260 V261 I265 A267	L259-N263 VanDerWaalsContact O-CB 3.27Å; L259-N263 WeakPolarHBondContact O-CB 3.31Å; L259-N263 PolarHBondContact O-N 3.47Å; L259-N263 PolarHBondContact O-ND2 2.87Å; V260-N263 PolarHBondContact O-N 3.36Å; V261-N263 PolarHBondContact O-N 3.37Å; N263-I265 VanDerWaalsContact C-N 3.33Å; N263-I265 PolarHBondContact O-N 3.04Å; N263-A267 VanDerWaalsContact O-CB 3.31Å; N263-A267 WeakPolarHBondContact O-CB 3.42Å; N263-A267 PolarHBondContact O-N 3.15Å
264	K	94.4	Very high	89.2	Confident	96 Å²	96	65.6 Å²	65.6	42%	0.417	35%	0.35	S	S	.	.	H	α-helix	trans	-53.8	-49.6	171.2	-80.2	175.9	171.8	179.8	0	110.9	V260 V261 H268 E301	V260-K264 WeakPolarHBondContact O-CB 3.47Å; V260-K264 WeakPolarHBondContact O-CG 3.33Å; V260-K264 PolarHBondContact O-N 3.14Å; V261-K264 PolarHBondContact O-N 3.03Å; K264-H268 PolarHBondContact O-N 3.35Å; K264-H268 VanDerWaalsContact O-N 3.12Å; K264-E301 IonicContact NZ-OE1 2.86Å; K264-E301 IonicContact NZ-OE2 4Å; K264-E301 PolarHBondContact NZ-OE2 2.93Å
265	I	94.4	Very high	87.8	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.005	38%	0.378	C	S	.	.	H	α-helix	trans	-69.5	-45.2	-176.1	-66.8	166.5	0	0	0	111.4	V261 Q262 N263 A267 H268 L269 M291 Q294 T295 V349 T350	V261-I265 HydrophobicContact CG1-CD1 3.71Å; V261-I265 VanDerWaalsContact O-CG1 3.32Å; V261-I265 WeakPolarHBondContact O-CG1 3.44Å; V261-I265 PolarHBondContact O-N 2.94Å; Q262-I265 PolarHBondContact O-N 3.26Å; N263-I265 VanDerWaalsContact C-N 3.33Å; N263-I265 PolarHBondContact O-N 3.04Å; I265-A267 PolarHBondContact O-N 3.44Å; I265-H268 PolarHBondContact O-N 3.37Å; I265-L269 HydrophobicContact CG2-CD1 3.79Å; I265-L269 HydrophobicContact CG2-CG 4.37Å; I265-L269 VanDerWaalsContact O-CG 3.26Å; I265-L269 WeakPolarHBondContact O-CG 3.17Å; I265-L269 PolarHBondContact O-N 2.92Å; I265-M291 HydrophobicContact CG2-CG 4.48Å; I265-Q294 HydrophobicContact CG1-CB 3.88Å; I265-Q294 HydrophobicContact CG2-CB 4.47Å; I265-T295 WeakPolarHBondContact CD1-OG1 3.41Å; I265-V349 HydrophobicContact CD1-CG1 4.16Å; I265-V349 HydrophobicContact CD1-CG2 3.58Å; I265-V349 HydrophobicContact CG2-CG1 4.23Å; I265-T350 HydrophobicContact CG2-CG2 4.42Å
266	V	94.3	Very high	86.4	Confident	37 Å²	37	72.4 Å²	72.4	22%	0.224	39%	0.392	C	S	.	.	H	α-helix	trans	-60	-45.7	177.7	169.8	0	0	0	0	111	Q262 H268 L269 Q270 T350	Q262-V266 HydrophobicContact CG-CG2 4.29Å; Q262-V266 WeakPolarHBondContact O-CB 3.39Å; Q262-V266 VanDerWaalsContact O-CG2 3.31Å; Q262-V266 WeakPolarHBondContact O-CG2 3.3Å; Q262-V266 PolarHBondContact O-N 2.88Å; V266-H268 PolarHBondContact O-N 3.49Å; V266-L269 PolarHBondContact O-N 3Å; V266-Q270 WeakPolarHBondContact O-CG 3.38Å; V266-Q270 PolarHBondContact O-N 3.16Å; V266-T350 HydrophobicContact CG2-CG2 3.92Å
267	A	93.3	Very high	84.6	Confident	53 Å²	53	73.1 Å²	73.1	44%	0.438	41%	0.408	S	S	.	.	H	α-helix	trans	-61.5	-44.7	177.7	0	0	0	0	0	112.2	N263 I265 L269 Q270 Q271	N263-A267 VanDerWaalsContact O-CB 3.31Å; N263-A267 WeakPolarHBondContact O-CB 3.42Å; N263-A267 PolarHBondContact O-N 3.15Å; I265-A267 PolarHBondContact O-N 3.44Å; A267-L269 PolarHBondContact O-N 2.83Å; A267-Q270 PolarHBondContact O-N 3.26Å; A267-Q271 WeakPolarHBondContact O-CB 3.47Å; A267-Q271 PolarHBondContact O-N 2.73Å
268	H	90.8	Very high	82.7	Confident	66 Å²	66	81.1 Å²	81.1	31%	0.306	43%	0.431	S	S	.	.	H	α-helix	trans	-59.6	-45.4	176.1	-177.6	102	0	0	0	112	K264 I265 V266 Q270 Q271 E272 Q294	K264-H268 PolarHBondContact O-N 3.35Å; K264-H268 VanDerWaalsContact O-N 3.12Å; I265-H268 PolarHBondContact O-N 3.37Å; V266-H268 PolarHBondContact O-N 3.49Å; H268-Q270 VanDerWaalsContact C-N 3.32Å; H268-Q270 PolarHBondContact O-N 3.25Å; H268-Q271 PolarHBondContact O-N 3.17Å; H268-E272 PolarHBondContact O-N 3.24Å; H268-Q294 PolarHBondContact CE1-OE1 3.42Å; H268-Q294 PolarHBondContact ND1-OE1 3.47Å; H268-Q294 VanDerWaalsContact ND1-OE1 3.13Å
269	L	89.2	Confident	81	Confident	11 Å²	11	85.6 Å²	85.6	6%	0.058	46%	0.455	C	S	.	.	H	α-helix	trans	-66.9	-32.4	180	-67.5	170.2	0	0	0	112.8	I265 V266 A267 Q273 L287 R290 M291 T350	I265-L269 HydrophobicContact CG2-CD1 3.79Å; I265-L269 HydrophobicContact CG2-CG 4.37Å; I265-L269 VanDerWaalsContact O-CG 3.26Å; I265-L269 WeakPolarHBondContact O-CG 3.17Å; I265-L269 PolarHBondContact O-N 2.92Å; V266-L269 PolarHBondContact O-N 3Å; A267-L269 PolarHBondContact O-N 2.83Å; L269-Q273 WeakPolarHBondContact O-CG 3.37Å; L269-Q273 PolarHBondContact O-N 2.95Å; L269-Q273 PolarHBondContact O-NE2 3.16Å; L269-L287 HydrophobicContact CD1-CD1 4.37Å; L269-L287 HydrophobicContact CD2-CD1 3.92Å; L269-R290 HydrophobicContact CD2-CB 3.65Å; L269-M291 HydrophobicContact CD1-CG 3.52Å; L269-M291 HydrophobicContact CD1-SD 4.35Å; L269-M291 HydrophobicContact CD2-CG 4.47Å; L269-T350 HydrophobicContact CD1-CG2 3.66Å
270	Q	88.4	Confident	79.4	Confident	116 Å²	116	87.7 Å²	87.7	54%	0.542	47%	0.466	S	S	.	.	H	α-helix	trans	-69.1	-43.6	172.2	-71.4	172.4	1	0	0	111.2	V266 A267 H268 E272 Q273 S274	V266-Q270 WeakPolarHBondContact O-CG 3.38Å; V266-Q270 PolarHBondContact O-N 3.16Å; A267-Q270 PolarHBondContact O-N 3.26Å; H268-Q270 VanDerWaalsContact C-N 3.32Å; H268-Q270 PolarHBondContact O-N 3.25Å; Q270-E272 PolarHBondContact O-N 3.3Å; Q270-Q273 PolarHBondContact O-N 3.48Å; Q270-Q273 VanDerWaalsContact O-N 3.14Å; Q270-S274 PolarHBondContact O-N 2.89Å; Q270-S274 PolarHBondContact O-OG 2.98Å
271	Q	86.5	Confident	78.1	Confident	148 Å²	148	93.7 Å²	93.7	69%	0.692	49%	0.486	S	S	*	.	H	α-helix	trans	-60.8	-44.2	177.4	-174.3	177.9	-4.8	0	0	112.4	A267 H268 Q273 S274 G275	A267-Q271 WeakPolarHBondContact O-CB 3.47Å; A267-Q271 PolarHBondContact O-N 2.73Å; H268-Q271 PolarHBondContact O-N 3.17Å; Q271-Q273 PolarHBondContact O-N 2.52Å; Q271-S274 PolarHBondContact O-N 3.15Å; Q271-G275 PolarHBondContact O-N 3.32Å; Q271-G275 VanDerWaalsContact O-N 3.13Å
272	E	78.7	Confident	77	Confident	66 Å²	66	95 Å²	95	31%	0.308	50%	0.495	S	S	.	.	H	α-helix	trans	-63.6	-26.3	175.3	-109.2	-68.7	120.9	0	0	113.5	H268 Q270 R276 R290	H268-E272 PolarHBondContact O-N 3.24Å; Q270-E272 PolarHBondContact O-N 3.3Å; E272-R276 WeakPolarHBondContact O-CD 3.25Å; E272-R276 WeakPolarHBondContact O-CG 3.49Å; E272-R276 IonicContact OE1-NH2 3.14Å; E272-R276 IonicContact OE2-CZ 3.58Å; E272-R276 VanDerWaalsContact OE2-CZ 3.24Å; E272-R276 IonicContact OE2-NE 3.79Å; E272-R276 PolarHBondContact OE2-NE 2.86Å; E272-R276 IonicContact OE2-NH2 2.72Å; E272-R276 PolarHBondContact OE2-NH2 3.27Å; E272-R290 IonicContact OE2-CZ 2.68Å; E272-R290 IonicContact OE2-NH1 3.85Å; E272-R290 PolarHBondContact OE2-NH1 3.04Å; E272-R290 IonicContact OE2-NH2 2.79Å
273	Q	75.6	Confident	76.4	Confident	106 Å²	106	95.5 Å²	95.5	50%	0.495	50%	0.504	S	S	.	.	H	α-helix	trans	-79.1	-43.6	174.1	-75.6	170.4	84.8	0	0	111.5	L269 Q270 Q271 G275 R276	L269-Q273 WeakPolarHBondContact O-CG 3.37Å; L269-Q273 PolarHBondContact O-N 2.95Å; L269-Q273 PolarHBondContact O-NE2 3.16Å; Q270-Q273 PolarHBondContact O-N 3.48Å; Q270-Q273 VanDerWaalsContact O-N 3.14Å; Q271-Q273 PolarHBondContact O-N 2.52Å; Q273-G275 PolarHBondContact O-N 2.91Å; Q273-R276 PolarHBondContact O-N 3.47Å
274	S	66.9	Low	75.8	Confident	108 Å²	108	95 Å²	95	76%	0.755	51%	0.505	S	S	*	.	H	α-helix	trans	-59.9	-31	176.1	-63	0	0	0	0	113.2	Q270 Q271 R276	Q270-S274 PolarHBondContact O-N 2.89Å; Q270-S274 PolarHBondContact O-OG 2.98Å; Q271-S274 PolarHBondContact O-N 3.15Å; S274-R276 VanDerWaalsContact C-N 3.3Å; S274-R276 PolarHBondContact O-N 3.32Å
275	G	61.8	Low	75.3	Confident	67 Å²	67	91.7 Å²	91.7	69%	0.691	49%	0.49	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-14.2	174	0	0	0	0	0	115.2	Q271 Q273	Q271-G275 PolarHBondContact O-N 3.32Å; Q271-G275 VanDerWaalsContact O-N 3.13Å; Q273-G275 PolarHBondContact O-N 2.91Å
276	R	61.5	Low	74.9	Confident	133 Å²	133	92.6 Å²	92.6	50%	0.502	50%	0.497	S	S	.	.	S	Bend	trans	-111.1	77.8	-174.7	-67.5	177.5	-171.6	-100.5	-4.4	111.3	E272 Q273 S274 R278	E272-R276 WeakPolarHBondContact O-CD 3.25Å; E272-R276 WeakPolarHBondContact O-CG 3.49Å; E272-R276 IonicContact OE1-NH2 3.14Å; E272-R276 IonicContact OE2-CZ 3.58Å; E272-R276 VanDerWaalsContact OE2-CZ 3.24Å; E272-R276 IonicContact OE2-NE 3.79Å; E272-R276 PolarHBondContact OE2-NE 2.86Å; E272-R276 IonicContact OE2-NH2 2.72Å; E272-R276 PolarHBondContact OE2-NH2 3.27Å; Q273-R276 PolarHBondContact O-N 3.47Å; S274-R276 VanDerWaalsContact C-N 3.3Å; S274-R276 PolarHBondContact O-N 3.32Å; R276-R278 PolarHBondContact O-N 3.23Å
277	G	53.5	Low	74.6	Confident	63 Å²	63	93 Å²	93	65%	0.649	50%	0.497	S	S	*	.			trans	-59.9	108.1	177.6	0	0	0	0	0	113.2	I279	G277-I279 PolarHBondContact O-N 3.47Å
278	R	49.4	Very low	74.4	Confident	262 Å²	262	93.4 Å²	93.4	99%	0.989	49%	0.491	S	S	*	.	S	Bend	trans	54.6	6.4	166.1	-116.6	-173.2	-167.6	-156.6	3.9	119	R276	R276-R278 PolarHBondContact O-N 3.23Å
279	I	55.3	Low	74.4	Confident	130 Å²	130	90.7 Å²	90.7	67%	0.667	48%	0.479	S	S	*	.	S	Bend	trans	-102.2	111.7	176.6	-62.2	168.1	0	0	0	108.8	G277	G277-I279 PolarHBondContact O-N 3.47Å
280	D	58	Low	74.5	Confident	143 Å²	143	91.9 Å²	91.9	77%	0.765	48%	0.483	S	S	*	.			trans	45.5	108.3	170.8	-55.8	-33	0	0	0	117.9
281	K	64.8	Low	74.7	Confident	203 Å²	203	86.8 Å²	86.8	88%	0.883	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-58.7	125.2	168.1	-176.2	179.9	179.3	-177.1	0	108.7
282	P	70.8	Confident	75.2	Confident	41 Å²	41	81 Å²	81	27%	0.266	44%	0.437	S	S	.	.	P	Polyproline II helix	trans	-62.3	144.5	-177.9	25.4	-34.2	0	0	0	111.1
283	S	80.9	Confident	75.9	Confident	65 Å²	65	78.5 Å²	78.5	46%	0.455	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-61.2	153.9	173.8	67.3	0	0	0	0	111.1	F285 S286 L287	S283-F285 PolarHBondContact O-N 3.42Å; S283-S286 WeakPolarHBondContact O-CA 3.32Å; S283-S286 WeakPolarHBondContact O-CB 3.17Å; S283-S286 PolarHBondContact O-N 2.94Å; S283-S286 WeakPolarHBondContact OG-CB 3.28Å; S283-S286 PolarHBondContact OG-N 2.89Å; S283-L287 PolarHBondContact O-N 3.38Å
284	T	82.6	Confident	76.8	Confident	80 Å²	80	75 Å²	75	49%	0.491	41%	0.409	S	S	.	.	H	α-helix	trans	-52.7	-41.6	177.3	-47	0	0	0	0	111.4	L287 M288	T284-L287 PolarHBondContact O-N 3.43Å; T284-M288 WeakPolarHBondContact O-CG 3.25Å; T284-M288 PolarHBondContact O-N 2.85Å
285	F	85	Confident	78.2	Confident	27 Å²	27	70.7 Å²	70.7	12%	0.118	38%	0.378	C	S	.	.	H	α-helix	trans	-65.9	-40.6	176	-175.3	-103.5	0	0	0	113.3	S283 L287 M288 C289 Y459 L460 K463 E468 V469	S283-F285 PolarHBondContact O-N 3.42Å; F285-L287 VanDerWaalsContact C-N 3.31Å; F285-L287 PolarHBondContact O-N 3.47Å; F285-M288 HydrophobicContact CB-CE 4.4Å; F285-M288 HydrophobicContact CD2-CE 4.03Å; F285-M288 PolarHBondContact O-N 2.69Å; F285-C289 PolarHBondContact O-N 3.05Å; F285-C289 PolarHBondContact O-SG 3.19Å; F285-Y459 HydrophobicContact CD2-CE1 4.32Å; F285-Y459 HydrophobicContact CE2-CD1 4.4Å; F285-Y459 AromaticContact CE2-CE1 3.71Å; F285-Y459 HydrophobicContact CE2-CE1 3.71Å; F285-Y459 HydrophobicContact CZ-CE1 4.48Å; F285-L460 HydrophobicContact CZ-CD1 4.17Å; F285-K463 HydrophobicContact CD1-CB 4.43Å; F285-K463 HydrophobicContact CD1-CD 4.46Å; F285-K463 HydrophobicContact CD1-CG 4.47Å; F285-K463 HydrophobicContact CE1-CB 3.43Å; F285-K463 VanDerWaalsContact CE1-CB 3.43Å; F285-K463 HydrophobicContact CE1-CD 4.15Å; F285-K463 HydrophobicContact CE1-CG 3.72Å; F285-K463 HydrophobicContact CE2-CG 4.2Å; F285-K463 HydrophobicContact CZ-CB 3.54Å; F285-K463 HydrophobicContact CZ-CD 4.36Å; F285-K463 HydrophobicContact CZ-CG 3.57Å; F285-E468 HydrophobicContact CD1-CB 4.31Å; F285-E468 HydrophobicContact CE1-CB 4.42Å; F285-V469 HydrophobicContact CD1-CG2 4.5Å; F285-V469 HydrophobicContact CE1-CG2 3.55Å; F285-V469 HydrophobicContact CZ-CG2 4.21Å
286	S	86.1	Confident	79.9	Confident	20 Å²	20	67.5 Å²	67.5	14%	0.14	35%	0.345	C	S	.	.	H	α-helix	trans	-63.2	-37.6	173.6	-172	0	0	0	0	112	S283 C289 R290	S283-S286 WeakPolarHBondContact O-CA 3.32Å; S283-S286 WeakPolarHBondContact O-CB 3.17Å; S283-S286 PolarHBondContact O-N 2.94Å; S283-S286 WeakPolarHBondContact OG-CB 3.28Å; S283-S286 PolarHBondContact OG-N 2.89Å; S286-C289 PolarHBondContact O-N 3.5Å; S286-R290 WeakPolarHBondContact O-CG 3.49Å; S286-R290 PolarHBondContact O-N 2.89Å
287	L	87.1	Confident	81.5	Confident	44 Å²	44	66 Å²	66	23%	0.23	34%	0.343	C	S	.	.	H	α-helix	trans	-65.9	-46.2	174.9	-174.8	61.7	0	0	0	111.6	L269 S283 T284 F285 C289 R290 M291	L269-L287 HydrophobicContact CD1-CD1 4.37Å; L269-L287 HydrophobicContact CD2-CD1 3.92Å; S283-L287 PolarHBondContact O-N 3.38Å; T284-L287 PolarHBondContact O-N 3.43Å; F285-L287 VanDerWaalsContact C-N 3.31Å; F285-L287 PolarHBondContact O-N 3.47Å; L287-C289 VanDerWaalsContact C-N 3.3Å; L287-C289 PolarHBondContact O-N 3.34Å; L287-R290 WeakPolarHBondContact O-CB 3.18Å; L287-R290 PolarHBondContact O-N 2.68Å; L287-R290 VanDerWaalsContact O-N 3.12Å; L287-M291 HydrophobicContact CD1-SD 4.48Å; L287-M291 HydrophobicContact CG-SD 3.89Å; L287-M291 WeakPolarHBondContact O-CG 3.48Å; L287-M291 PolarHBondContact O-N 3.47Å
288	M	89.5	Confident	83.5	Confident	62 Å²	62	63.7 Å²	63.7	31%	0.305	32%	0.316	S	S	.	.	H	α-helix	trans	-58.7	-39.5	174.4	-70.8	-170.7	-62.8	0	0	112.3	T284 F285 R290 M291 A292	T284-M288 WeakPolarHBondContact O-CG 3.25Å; T284-M288 PolarHBondContact O-N 2.85Å; F285-M288 HydrophobicContact CB-CE 4.4Å; F285-M288 HydrophobicContact CD2-CE 4.03Å; F285-M288 PolarHBondContact O-N 2.69Å; M288-R290 VanDerWaalsContact C-N 3.34Å; M288-R290 PolarHBondContact O-N 3.06Å; M288-M291 PolarHBondContact O-N 3.27Å; M288-A292 WeakPolarHBondContact O-CB 3.43Å; M288-A292 PolarHBondContact O-N 3.43Å
289	C	91.8	Very high	85.8	Confident	9 Å²	9	51.4 Å²	51.4	6%	0.061	27%	0.27	C	S	.	.	H	α-helix	trans	-62.2	-38.6	175.3	-68.5	0	0	0	0	112.7	F285 S286 L287 D293 V469 L475	F285-C289 PolarHBondContact O-N 3.05Å; F285-C289 PolarHBondContact O-SG 3.19Å; S286-C289 PolarHBondContact O-N 3.5Å; L287-C289 VanDerWaalsContact C-N 3.3Å; L287-C289 PolarHBondContact O-N 3.34Å; C289-D293 WeakPolarHBondContact O-CB 3.18Å; C289-D293 PolarHBondContact O-N 3.45Å; C289-V469 HydrophobicContact CB-CG1 4.25Å; C289-L475 HydrophobicContact CB-CD2 4.13Å; C289-L475 WeakPolarHBondContact O-CD2 3.4Å
290	R	90.4	Very high	87.8	Confident	36 Å²	36	47 Å²	47	14%	0.136	25%	0.249	C	C	.	.	H	α-helix	trans	-68.1	-38.2	174.8	-63.3	163.4	-174	-123.2	1.2	112	L269 E272 S286 L287 M288 D293 Q294	L269-R290 HydrophobicContact CD2-CB 3.65Å; E272-R290 IonicContact OE2-CZ 2.68Å; E272-R290 IonicContact OE2-NH1 3.85Å; E272-R290 PolarHBondContact OE2-NH1 3.04Å; E272-R290 IonicContact OE2-NH2 2.79Å; S286-R290 WeakPolarHBondContact O-CG 3.49Å; S286-R290 PolarHBondContact O-N 2.89Å; L287-R290 WeakPolarHBondContact O-CB 3.18Å; L287-R290 PolarHBondContact O-N 2.68Å; L287-R290 VanDerWaalsContact O-N 3.12Å; M288-R290 VanDerWaalsContact C-N 3.34Å; M288-R290 PolarHBondContact O-N 3.06Å; R290-D293 PolarHBondContact O-N 3.03Å; R290-Q294 WeakPolarHBondContact O-CG 3.38Å; R290-Q294 PolarHBondContact O-N 2.89Å
291	M	93.4	Very high	89.6	Confident	9 Å²	9	45.5 Å²	45.5	4%	0.044	24%	0.238	C	C	.	.	H	α-helix	trans	-65.5	-44.6	176.7	-69.8	158.1	67.3	0	0	111.5	I265 L269 L287 M288 Q294 T295 L348 V349 T350	I265-M291 HydrophobicContact CG2-CG 4.48Å; L269-M291 HydrophobicContact CD1-CG 3.52Å; L269-M291 HydrophobicContact CD1-SD 4.35Å; L269-M291 HydrophobicContact CD2-CG 4.47Å; L287-M291 HydrophobicContact CD1-SD 4.48Å; L287-M291 HydrophobicContact CG-SD 3.89Å; L287-M291 WeakPolarHBondContact O-CG 3.48Å; L287-M291 PolarHBondContact O-N 3.47Å; M288-M291 PolarHBondContact O-N 3.27Å; M291-Q294 PolarHBondContact O-N 3.3Å; M291-T295 WeakPolarHBondContact O-CB 3.31Å; M291-T295 PolarHBondContact O-N 2.95Å; M291-T295 PolarHBondContact O-OG1 3.18Å; M291-L348 HydrophobicContact CE-CB 3.61Å; M291-L348 HydrophobicContact CE-CD1 3.68Å; M291-L348 HydrophobicContact CE-CD2 4.5Å; M291-L348 HydrophobicContact CE-CG 4.14Å; M291-V349 HydrophobicContact CB-CG1 4.02Å; M291-V349 HydrophobicContact CE-CG1 3.92Å; M291-V349 HydrophobicContact CG-CG1 4.44Å; M291-T350 HydrophobicContact CE-CG2 3.81Å; M291-T350 HydrophobicContact CG-CG2 4.33Å; M291-T350 HydrophobicContact SD-CG2 4.25Å
292	A	95.1	Very high	91.1	Very high	27 Å²	27	36.2 Å²	36.2	22%	0.223	20%	0.197	C	C	.	.	H	α-helix	trans	-62	-42.6	174.2	0	0	0	0	0	111.8	M288 T295 L296 L329 L475	M288-A292 WeakPolarHBondContact O-CB 3.43Å; M288-A292 PolarHBondContact O-N 3.43Å; A292-T295 PolarHBondContact O-N 3.47Å; A292-L296 VanDerWaalsContact O-CB 3.24Å; A292-L296 WeakPolarHBondContact O-CB 3.36Å; A292-L296 PolarHBondContact O-N 2.9Å; A292-L329 HydrophobicContact CB-CD1 4.39Å; A292-L475 HydrophobicContact CB-CD1 4.23Å; A292-L475 HydrophobicContact CB-CD2 4.08Å
293	D	94.8	Very high	92.3	Very high	14 Å²	14	34.2 Å²	34.2	8%	0.075	18%	0.184	C	C	.	.	H	α-helix	trans	-59.5	-48.1	176.1	-176.9	82.1	0	0	0	112.9	C289 R290 L296 F297 N473 L474 L475	C289-D293 WeakPolarHBondContact O-CB 3.18Å; C289-D293 PolarHBondContact O-N 3.45Å; R290-D293 PolarHBondContact O-N 3.03Å; D293-L296 WeakPolarHBondContact O-CB 3.3Å; D293-L296 PolarHBondContact O-N 3.28Å; D293-L296 VanDerWaalsContact O-N 3.17Å; D293-F297 VanDerWaalsContact O-CD2 3.3Å; D293-F297 WeakPolarHBondContact O-CD2 3.48Å; D293-F297 PolarHBondContact O-N 2.89Å; D293-N473 VanDerWaalsContact OD1-CB 3.28Å; D293-N473 WeakPolarHBondContact OD1-CB 3.44Å; D293-L474 WeakPolarHBondContact OD1-CA 3.43Å; D293-L474 WeakPolarHBondContact OD1-CB 3.21Å; D293-L474 PolarHBondContact OD1-N 2.92Å; D293-L475 HydrophobicContact CB-CB 4.06Å; D293-L475 PolarHBondContact OD1-N 2.86Å
294	Q	94.7	Very high	93	Very high	33 Å²	33	38.4 Å²	38.4	15%	0.154	19%	0.19	C	C	.	.	H	α-helix	trans	-73.5	-28.4	178.7	-62.9	-59.7	-71.3	0	0	113.2	I265 H268 R290 M291 L296 S298	I265-Q294 HydrophobicContact CG1-CB 3.88Å; I265-Q294 HydrophobicContact CG2-CB 4.47Å; H268-Q294 PolarHBondContact CE1-OE1 3.42Å; H268-Q294 PolarHBondContact ND1-OE1 3.47Å; H268-Q294 VanDerWaalsContact ND1-OE1 3.13Å; R290-Q294 WeakPolarHBondContact O-CG 3.38Å; R290-Q294 PolarHBondContact O-N 2.89Å; M291-Q294 PolarHBondContact O-N 3.3Å; Q294-L296 VanDerWaalsContact C-N 3.33Å; Q294-S298 PolarHBondContact O-N 3.32Å; Q294-S298 PolarHBondContact O-OG 3.5Å; Q294-S298 VanDerWaalsContact O-OG 3.07Å
295	T	95.9	Very high	93.5	Very high	16 Å²	16	36.9 Å²	36.9	10%	0.098	18%	0.183	C	C	.	.	H	α-helix	trans	-65.8	-39.2	167.8	-51	0	0	0	0	110.3	I265 M291 A292 S298 I299 L329	I265-T295 WeakPolarHBondContact CD1-OG1 3.41Å; M291-T295 WeakPolarHBondContact O-CB 3.31Å; M291-T295 PolarHBondContact O-N 2.95Å; M291-T295 PolarHBondContact O-OG1 3.18Å; A292-T295 PolarHBondContact O-N 3.47Å; T295-S298 CarbonylContact O-C 3.57Å; T295-S298 WeakPolarHBondContact O-CA 3.45Å; T295-S298 VanDerWaalsContact O-CB 3.29Å; T295-S298 WeakPolarHBondContact O-CB 3.41Å; T295-S298 PolarHBondContact O-N 3.43Å; T295-I299 HydrophobicContact CG2-CD1 4.37Å; T295-I299 PolarHBondContact O-N 3.07Å; T295-L329 HydrophobicContact CG2-CD2 3.64Å
296	L	96.6	Very high	93.9	Very high	0 Å²	0	35.7 Å²	35.7	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-67.7	-36.5	179	-176.9	52.1	0	0	0	112.7	A292 D293 Q294 S298 I299 V300 W325 L329 L474 L475 M478	A292-L296 VanDerWaalsContact O-CB 3.24Å; A292-L296 WeakPolarHBondContact O-CB 3.36Å; A292-L296 PolarHBondContact O-N 2.9Å; D293-L296 WeakPolarHBondContact O-CB 3.3Å; D293-L296 PolarHBondContact O-N 3.28Å; D293-L296 VanDerWaalsContact O-N 3.17Å; Q294-L296 VanDerWaalsContact C-N 3.33Å; L296-S298 VanDerWaalsContact C-N 3.27Å; L296-S298 PolarHBondContact O-N 3.16Å; L296-I299 HydrophobicContact CD1-CB 4.45Å; L296-I299 PolarHBondContact O-N 3.07Å; L296-V300 WeakPolarHBondContact O-CG2 3.23Å; L296-V300 PolarHBondContact O-N 3.39Å; L296-W325 HydrophobicContact CD1-CB 3.72Å; L296-W325 HydrophobicContact CD2-CE3 3.97Å; L296-L329 HydrophobicContact CB-CD1 4.45Å; L296-L329 HydrophobicContact CB-CD2 4.42Å; L296-L474 HydrophobicContact CD2-CD2 4.47Å; L296-L474 HydrophobicContact CD2-CG 4.16Å; L296-L474 HydrophobicContact CG-CD2 3.97Å; L296-L474 HydrophobicContact CG-CG 4.21Å; L296-L475 HydrophobicContact CD2-CD1 4.28Å; L296-M478 HydrophobicContact CD2-CB 4.13Å; L296-M478 HydrophobicContact CD2-CG 3.93Å
297	F	96	Very high	94	Very high	103 Å²	103	37.7 Å²	37.7	45%	0.452	19%	0.186	S	C	.	.	H	α-helix	trans	-57.9	-40.1	166.6	-83.4	-75.8	0	0	0	112.1	D293 V300 E301 L474	D293-F297 VanDerWaalsContact O-CD2 3.3Å; D293-F297 WeakPolarHBondContact O-CD2 3.48Å; D293-F297 PolarHBondContact O-N 2.89Å; F297-V300 PolarHBondContact O-N 2.93Å; F297-E301 PolarHBondContact O-N 3.26Å; F297-L474 HydrophobicContact CD1-CD2 3.85Å; F297-L474 HydrophobicContact CD2-CB 4.42Å; F297-L474 HydrophobicContact CD2-CD2 3.97Å; F297-L474 HydrophobicContact CE1-CD2 3.87Å; F297-L474 HydrophobicContact CE2-CB 3.76Å; F297-L474 HydrophobicContact CE2-CD2 3.98Å; F297-L474 HydrophobicContact CG-CD2 3.89Å; F297-L474 HydrophobicContact CZ-CB 3.84Å; F297-L474 HydrophobicContact CZ-CD2 3.93Å; F297-L474 HydrophobicContact CZ-CG 4.48Å
298	S	96.1	Very high	94.4	Very high	13 Å²	13	36.5 Å²	36.5	9%	0.091	18%	0.179	C	C	.	.	H	α-helix	trans	-68.7	-35.3	177.3	-52.7	0	0	0	0	112.3	Q294 T295 L296 E301 W302	Q294-S298 PolarHBondContact O-N 3.32Å; Q294-S298 PolarHBondContact O-OG 3.5Å; Q294-S298 VanDerWaalsContact O-OG 3.07Å; T295-S298 CarbonylContact O-C 3.57Å; T295-S298 WeakPolarHBondContact O-CA 3.45Å; T295-S298 VanDerWaalsContact O-CB 3.29Å; T295-S298 WeakPolarHBondContact O-CB 3.41Å; T295-S298 PolarHBondContact O-N 3.43Å; L296-S298 VanDerWaalsContact C-N 3.27Å; L296-S298 PolarHBondContact O-N 3.16Å; S298-E301 PolarHBondContact O-N 3.38Å; S298-W302 WeakPolarHBondContact O-CB 3.32Å; S298-W302 PolarHBondContact O-N 3.16Å
299	I	97.1	Very high	94.7	Very high	5 Å²	5	33.6 Å²	33.6	3%	0.026	17%	0.165	C	C	.	.	H	α-helix	trans	-65.6	-38	172	-70.1	166.3	0	0	0	111.4	T295 L296 W302 A303 L328 L329	T295-I299 HydrophobicContact CG2-CD1 4.37Å; T295-I299 PolarHBondContact O-N 3.07Å; L296-I299 HydrophobicContact CD1-CB 4.45Å; L296-I299 PolarHBondContact O-N 3.07Å; I299-W302 HydrophobicContact CG2-CE3 4.33Å; I299-W302 PolarHBondContact O-N 3.33Å; I299-A303 WeakPolarHBondContact O-CB 3.32Å; I299-A303 PolarHBondContact O-N 3.14Å; I299-L328 HydrophobicContact CD1-CB 4.02Å; I299-L328 HydrophobicContact CG2-CB 4.29Å; I299-L328 HydrophobicContact CG2-CD1 3.65Å; I299-L329 HydrophobicContact CD1-CD2 3.63Å; I299-L329 HydrophobicContact CD1-CG 3.85Å
300	V	96.7	Very high	94.9	Very high	36 Å²	36	39 Å²	39	22%	0.218	19%	0.187	C	C	.	.	H	α-helix	trans	-70.5	-35.6	175	174.5	0	0	0	0	111.5	L296 F297 R304 L321 L474	L296-V300 WeakPolarHBondContact O-CG2 3.23Å; L296-V300 PolarHBondContact O-N 3.39Å; F297-V300 PolarHBondContact O-N 2.93Å; V300-R304 WeakPolarHBondContact O-CB 3.44Å; V300-R304 WeakPolarHBondContact O-CD 3.41Å; V300-R304 WeakPolarHBondContact O-CG 3.29Å; V300-R304 PolarHBondContact O-N 2.67Å; V300-L321 HydrophobicContact CG2-CD1 4.36Å; V300-L474 HydrophobicContact CG2-CD2 4.47Å
301	E	95.3	Very high	95.2	Very high	113 Å²	113	43.4 Å²	43.4	53%	0.528	21%	0.209	S	C	.	.	H	α-helix	trans	-63.7	-45.3	171.5	-173.2	169.4	-133.7	0	0	111.3	K264 F297 S298 R304 S305	K264-E301 IonicContact NZ-OE1 2.86Å; K264-E301 IonicContact NZ-OE2 4Å; K264-E301 PolarHBondContact NZ-OE2 2.93Å; F297-E301 PolarHBondContact O-N 3.26Å; S298-E301 PolarHBondContact O-N 3.38Å; E301-R304 PolarHBondContact O-N 3.01Å; E301-S305 PolarHBondContact O-N 3.44Å; E301-S305 VanDerWaalsContact O-N 3.13Å
302	W	96.8	Very high	95.3	Very high	7 Å²	7	43.3 Å²	43.3	3%	0.027	21%	0.209	C	C	.	.	H	α-helix	trans	-58.6	-52.1	173.8	166.2	79.2	0	0	0	113	C254 S298 I299 R304 S305 C306 L328 K395 F396 L399	C254-W302 VanDerWaalsContact O-CD1 3.25Å; S298-W302 WeakPolarHBondContact O-CB 3.32Å; S298-W302 PolarHBondContact O-N 3.16Å; I299-W302 HydrophobicContact CG2-CE3 4.33Å; I299-W302 PolarHBondContact O-N 3.33Å; W302-R304 PolarHBondContact O-N 3.27Å; W302-S305 WeakPolarHBondContact O-CB 3.45Å; W302-S305 PolarHBondContact O-N 2.85Å; W302-S305 PolarHBondContact O-OG 3.42Å; W302-C306 PolarHBondContact O-N 2.94Å; W302-L328 HydrophobicContact CZ3-CD1 3.79Å; W302-L328 HydrophobicContact CZ3-CD2 4.43Å; W302-K395 HydrophobicContact CH2-CB 3.75Å; W302-K395 HydrophobicContact CZ2-CB 3.67Å; W302-F396 AromaticContact CE2-CZ 3.83Å; W302-F396 HydrophobicContact CH2-CD1 4.06Å; W302-F396 AromaticContact CH2-CE1 3.97Å; W302-F396 HydrophobicContact CH2-CE1 3.97Å; W302-F396 HydrophobicContact CH2-CG 4.46Å; W302-F396 HydrophobicContact CH2-CZ 4.29Å; W302-F396 AromaticContact CZ2-CD1 3.93Å; W302-F396 HydrophobicContact CZ2-CD1 3.93Å; W302-F396 HydrophobicContact CZ2-CD2 4.01Å; W302-F396 AromaticContact CZ2-CE1 3.57Å; W302-F396 HydrophobicContact CZ2-CE1 3.57Å; W302-F396 AromaticContact CZ2-CE2 3.66Å; W302-F396 HydrophobicContact CZ2-CE2 3.66Å; W302-F396 HydrophobicContact CZ2-CG 4.14Å; W302-F396 AromaticContact CZ2-CZ 3.44Å; W302-F396 HydrophobicContact CZ2-CZ 3.44Å; W302-F396 VanDerWaalsContact CZ2-CZ 3.44Å; W302-F396 AromaticContact NE1-CZ 3.95Å; W302-L399 HydrophobicContact CH2-CB 4.15Å; W302-L399 HydrophobicContact CH2-CD2 3.89Å; W302-L399 HydrophobicContact CZ3-CB 4.31Å; W302-L399 HydrophobicContact CZ3-CD2 3.81Å; W302-L399 HydrophobicContact CZ3-CG 4.48Å
303	A	97.2	Very high	95.4	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.9	-35	180	0	0	0	0	0	111.4	I299 S305 C306 F309 L321 L399	I299-A303 WeakPolarHBondContact O-CB 3.32Å; I299-A303 PolarHBondContact O-N 3.14Å; A303-S305 VanDerWaalsContact C-N 3.33Å; A303-S305 PolarHBondContact O-N 2.94Å; A303-C306 WeakPolarHBondContact O-CB 3.42Å; A303-F309 HydrophobicContact CB-CD1 4.38Å; A303-F309 HydrophobicContact CB-CE1 4.22Å; A303-F309 HydrophobicContact CB-CE2 4.38Å; A303-F309 HydrophobicContact CB-CZ 4.22Å; A303-F309 WeakPolarHBondContact O-CB 3.23Å; A303-F309 WeakPolarHBondContact O-CD1 3.39Å; A303-F309 WeakPolarHBondContact O-CG 3.48Å; A303-L321 HydrophobicContact CB-CD2 3.83Å; A303-L399 HydrophobicContact CB-CD1 4.36Å; A303-L399 HydrophobicContact CB-CD2 4.05Å
304	R	95.2	Very high	95.5	Very high	153 Å²	153	54 Å²	54	58%	0.577	25%	0.253	S	S	*	.	H	α-helix	trans	-76.5	-13.2	176.2	-67.3	170.4	63.9	76.2	4.4	114.3	V300 E301 W302 F309 K310	V300-R304 WeakPolarHBondContact O-CB 3.44Å; V300-R304 WeakPolarHBondContact O-CD 3.41Å; V300-R304 WeakPolarHBondContact O-CG 3.29Å; V300-R304 PolarHBondContact O-N 2.67Å; E301-R304 PolarHBondContact O-N 3.01Å; W302-R304 PolarHBondContact O-N 3.27Å; R304-F309 HydrophobicContact CG-CD1 4.49Å; R304-F309 HydrophobicContact CG-CE1 4.24Å; R304-K310 WeakPolarHBondContact O-CE 3.39Å
305	S	92.9	Very high	95.5	Very high	48 Å²	48	54 Å²	54	34%	0.336	26%	0.261	S	S	.	.	H	α-helix	trans	-79.9	-30.7	174.8	86.3	0	0	0	0	112.2	C254 E301 W302 A303 K310	C254-S305 WeakPolarHBondContact CB-OG 3.47Å; C254-S305 PolarHBondContact O-OG 2.7Å; C254-S305 VanDerWaalsContact O-OG 3.12Å; E301-S305 PolarHBondContact O-N 3.44Å; E301-S305 VanDerWaalsContact O-N 3.13Å; W302-S305 WeakPolarHBondContact O-CB 3.45Å; W302-S305 PolarHBondContact O-N 2.85Å; W302-S305 PolarHBondContact O-OG 3.42Å; A303-S305 VanDerWaalsContact C-N 3.33Å; A303-S305 PolarHBondContact O-N 2.94Å; S305-K310 WeakPolarHBondContact O-CE 3.45Å; S305-K310 PolarHBondContact O-NZ 3.29Å
306	C	92.5	Very high	95.6	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.007	26%	0.257	C	S	.	.	S	Bend	trans	-56	146	177.1	-179.1	0	0	0	0	113.6	W302 A303 F309 K310 F396	W302-C306 PolarHBondContact O-N 2.94Å; A303-C306 WeakPolarHBondContact O-CB 3.42Å; C306-F309 HydrophobicContact CB-CB 3.99Å; C306-K310 VanDerWaalsContact O-CD 3.28Å; C306-K310 WeakPolarHBondContact O-CD 3.5Å; C306-K310 WeakPolarHBondContact O-CE 3.48Å; C306-K310 WeakPolarHBondContact O-CG 3.46Å; C306-K310 PolarHBondContact O-NZ 3.03Å; C306-F396 HydrophobicContact CB-CE1 3.78Å; C306-F396 HydrophobicContact CB-CZ 4.11Å; C306-F396 WeakPolarHBondContact SG-CE1 3.33Å
307	I	89.6	Confident	95.6	Very high	62 Å²	62	54.4 Å²	54.4	32%	0.318	26%	0.262	S	S	.	.	H	α-helix	trans	-66.9	-60	173.1	47	154.4	0	0	0	112.4	E250 F309 K310	E250-I307 WeakPolarHBondContact OE1-CD1 3.31Å; I307-F309 PolarHBondContact O-N 2.88Å; I307-F309 VanDerWaalsContact O-N 3.09Å; I307-K310 WeakPolarHBondContact O-CB 3.43Å; I307-K310 PolarHBondContact O-N 2.9Å
308	F	95.3	Very high	95.6	Very high	19 Å²	19	54.1 Å²	54.1	8%	0.083	26%	0.264	C	S	.	.	H	α-helix	trans	-56.7	-33.1	-175.1	-49.6	-66	0	0	0	113.3	L247 L251 K310 E311 F400 F412 V416	L247-F308 HydrophobicContact CD1-CE2 3.8Å; L247-F308 HydrophobicContact CD1-CZ 3.76Å; L251-F308 HydrophobicContact CD2-CE2 4.2Å; F308-K310 VanDerWaalsContact C-N 3.28Å; F308-K310 PolarHBondContact O-N 3.41Å; F308-E311 PolarHBondContact O-N 3.03Å; F308-F400 HydrophobicContact CB-CE1 4.12Å; F308-F400 HydrophobicContact CB-CE2 4.3Å; F308-F400 HydrophobicContact CB-CZ 3.66Å; F308-F412 HydrophobicContact CB-CE1 4.12Å; F308-F412 HydrophobicContact CB-CZ 3.96Å; F308-F412 HydrophobicContact CD1-CZ 4.39Å; F308-F412 WeakPolarHBondContact O-CE1 3.41Å; F308-F412 WeakPolarHBondContact O-CZ 3.43Å; F308-V416 HydrophobicContact CB-CG1 4.28Å; F308-V416 HydrophobicContact CB-CG2 3.94Å; F308-V416 HydrophobicContact CD1-CG2 3.83Å; F308-V416 HydrophobicContact CD2-CG1 4.01Å; F308-V416 HydrophobicContact CG-CG1 4.07Å; F308-V416 HydrophobicContact CG-CG2 3.86Å
309	F	96.4	Very high	95.7	Very high	2 Å²	2	55.8 Å²	55.8	1%	0.009	27%	0.269	C	S	.	.	H	α-helix	trans	-68.7	-28.1	179.9	-163.6	-99.6	0	0	0	112.4	A303 R304 C306 I307 E311 L312 Q317 L321 L399 F400	A303-F309 HydrophobicContact CB-CD1 4.38Å; A303-F309 HydrophobicContact CB-CE1 4.22Å; A303-F309 HydrophobicContact CB-CE2 4.38Å; A303-F309 HydrophobicContact CB-CZ 4.22Å; A303-F309 WeakPolarHBondContact O-CB 3.23Å; A303-F309 WeakPolarHBondContact O-CD1 3.39Å; A303-F309 WeakPolarHBondContact O-CG 3.48Å; R304-F309 HydrophobicContact CG-CD1 4.49Å; R304-F309 HydrophobicContact CG-CE1 4.24Å; C306-F309 HydrophobicContact CB-CB 3.99Å; I307-F309 PolarHBondContact O-N 2.88Å; I307-F309 VanDerWaalsContact O-N 3.09Å; F309-E311 VanDerWaalsContact C-N 3.34Å; F309-L312 PolarHBondContact O-N 3.07Å; F309-Q317 HydrophobicContact CD1-CG 3.98Å; F309-Q317 HydrophobicContact CE1-CB 3.72Å; F309-Q317 HydrophobicContact CE1-CG 3.57Å; F309-Q317 HydrophobicContact CE2-CB 4.09Å; F309-Q317 HydrophobicContact CE2-CG 4.14Å; F309-Q317 HydrophobicContact CG-CG 4.45Å; F309-Q317 HydrophobicContact CZ-CB 3.42Å; F309-Q317 VanDerWaalsContact CZ-CB 3.42Å; F309-Q317 HydrophobicContact CZ-CG 3.66Å; F309-Q317 PolarHBondContact O-NE2 3.26Å; F309-L321 HydrophobicContact CE1-CD1 4.3Å; F309-L321 HydrophobicContact CE2-CG 4.28Å; F309-L321 HydrophobicContact CZ-CD1 3.64Å; F309-L321 HydrophobicContact CZ-CG 3.82Å; F309-L399 HydrophobicContact CD2-CD1 4.32Å; F309-L399 HydrophobicContact CD2-CD2 3.98Å; F309-L399 HydrophobicContact CD2-CG 4.34Å; F309-L399 HydrophobicContact CE2-CD1 3.95Å; F309-L399 HydrophobicContact CE2-CD2 4.41Å; F309-L399 HydrophobicContact CE2-CG 4.46Å; F309-F400 HydrophobicContact CB-CZ 4.11Å; F309-F400 HydrophobicContact CD2-CZ 4.27Å
310	K	95.2	Very high	95.7	Very high	122 Å²	122	55.6 Å²	55.6	53%	0.53	27%	0.268	S	S	.	.	H	α-helix	trans	-74.9	-24	177.7	-63.7	160.9	-167.6	154.3	0	112.7	R304 S305 C306 I307 F308	R304-K310 WeakPolarHBondContact O-CE 3.39Å; S305-K310 WeakPolarHBondContact O-CE 3.45Å; S305-K310 PolarHBondContact O-NZ 3.29Å; C306-K310 VanDerWaalsContact O-CD 3.28Å; C306-K310 WeakPolarHBondContact O-CD 3.5Å; C306-K310 WeakPolarHBondContact O-CE 3.48Å; C306-K310 WeakPolarHBondContact O-CG 3.46Å; C306-K310 PolarHBondContact O-NZ 3.03Å; I307-K310 WeakPolarHBondContact O-CB 3.43Å; I307-K310 PolarHBondContact O-N 2.9Å; F308-K310 VanDerWaalsContact C-N 3.28Å; F308-K310 PolarHBondContact O-N 3.41Å
311	E	96.1	Very high	95.7	Very high	128 Å²	128	54.7 Å²	54.7	60%	0.598	26%	0.262	S	S	*	.	H	α-helix	trans	-75.5	-27.9	176.1	-63	175.2	-109.8	0	0	112	F308 F309 F412	F308-E311 PolarHBondContact O-N 3.03Å; F309-E311 VanDerWaalsContact C-N 3.34Å; E311-F412 HydrophobicContact CB-CE2 4.19Å; E311-F412 HydrophobicContact CB-CZ 3.79Å; E311-F412 HydrophobicContact CG-CZ 4.39Å; E311-F412 WeakPolarHBondContact OE2-CE2 3.48Å
312	L	96.6	Very high	95.8	Very high	8 Å²	8	51 Å²	51	4%	0.042	24%	0.244	C	C	.	.	S	Bend	trans	-68.3	143.4	174.9	-72.5	177.8	0	0	0	112.4	F309 D316 Q317 L320 F400 F412 V413	F309-L312 PolarHBondContact O-N 3.07Å; L312-D316 HydrophobicContact CB-CB 4.44Å; L312-D316 HydrophobicContact CD2-CB 4.21Å; L312-Q317 HydrophobicContact CB-CG 3.93Å; L312-Q317 PolarHBondContact O-NE2 3.3Å; L312-Q317 VanDerWaalsContact O-NE2 3.08Å; L312-L320 HydrophobicContact CD1-CD1 3.43Å; L312-L320 VanDerWaalsContact CD1-CD1 3.43Å; L312-F400 HydrophobicContact CD1-CD1 4.45Å; L312-F400 HydrophobicContact CD1-CE1 3.82Å; L312-F412 HydrophobicContact CD2-CD1 3.65Å; L312-F412 HydrophobicContact CD2-CE1 4.04Å; L312-F412 HydrophobicContact CG-CD1 4.09Å; L312-F412 HydrophobicContact CG-CE1 3.95Å; L312-V413 HydrophobicContact CD1-CG2 4.37Å; L312-V413 HydrophobicContact CD2-CG2 4.26Å
313	R	96.3	Very high	95.7	Very high	169 Å²	169	52.6 Å²	52.6	64%	0.638	25%	0.254	S	S	*	.			trans	-63.6	148.2	168.8	-67.6	177.1	176.9	178.6	2.6	110.2	G315 D316 Q317 E408	R313-G315 PolarHBondContact O-N 2.98Å; R313-D316 PolarHBondContact O-N 3.1Å; R313-Q317 PolarHBondContact O-N 2.84Å; R313-E408 WeakPolarHBondContact CD-OE2 3.31Å; R313-E408 IonicContact CZ-OE2 3.67Å; R313-E408 IonicContact NE-OE2 3.8Å; R313-E408 IonicContact NH1-OE2 2.81Å; R313-E408 PolarHBondContact NH1-OE2 3.34Å
314	V	96.6	Very high	95.7	Very high	97 Å²	97	52.6 Å²	52.6	59%	0.588	25%	0.254	S	S	*	.	H	α-helix	trans	-52.9	-33.2	177.7	-176.4	0	0	0	0	112.4	M318	V314-M318 HydrophobicContact CG1-CG 4.39Å; V314-M318 HydrophobicContact CG1-SD 4.36Å; V314-M318 WeakPolarHBondContact O-CB 3.43Å; V314-M318 VanDerWaalsContact O-CG 3.32Å; V314-M318 WeakPolarHBondContact O-CG 3.41Å; V314-M318 PolarHBondContact O-N 2.78Å
315	G	96.1	Very high	95.9	Very high	31 Å²	31	45.6 Å²	45.6	32%	0.32	23%	0.227	S	C	.	.	H	α-helix	trans	-58	-46.4	173.2	0	0	0	0	0	113.2	R313 K319	R313-G315 PolarHBondContact O-N 2.98Å; G315-K319 WeakPolarHBondContact O-CD 3.47Å; G315-K319 VanDerWaalsContact O-CE 3.23Å; G315-K319 WeakPolarHBondContact O-CE 3.38Å; G315-K319 WeakPolarHBondContact O-CG 3.29Å; G315-K319 PolarHBondContact O-N 3.09Å; G315-K319 VanDerWaalsContact O-N 3.16Å
316	D	97.2	Very high	96.1	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-76.7	-40.3	178.6	-74.3	-3.2	0	0	0	111.9	L312 R313 M318 K319 L320 L407 E408 N409	L312-D316 HydrophobicContact CB-CB 4.44Å; L312-D316 HydrophobicContact CD2-CB 4.21Å; R313-D316 PolarHBondContact O-N 3.1Å; D316-M318 PolarHBondContact O-N 2.95Å; D316-K319 PolarHBondContact O-N 3.37Å; D316-K319 VanDerWaalsContact O-N 3.07Å; D316-K319 IonicContact OD1-NZ 2.75Å; D316-K319 PolarHBondContact OD1-NZ 3.47Å; D316-L320 WeakPolarHBondContact O-CG 3.43Å; D316-L320 PolarHBondContact O-N 2.88Å; D316-L407 HydrophobicContact CB-CD2 3.85Å; D316-L407 WeakPolarHBondContact OD1-CA 3.33Å; D316-E408 VanDerWaalsContact CG-N 3.27Å; D316-E408 PolarHBondContact OD1-N 2.96Å; D316-E408 WeakPolarHBondContact OD2-CA 3.31Å; D316-E408 WeakPolarHBondContact OD2-CB 3.26Å; D316-E408 PolarHBondContact OD2-N 3.26Å; D316-N409 PolarHBondContact OD2-N 3.17Å
317	Q	97.4	Very high	96.4	Very high	24 Å²	24	43.9 Å²	43.9	11%	0.112	22%	0.215	C	C	.	.	H	α-helix	trans	-50.2	-45.8	171.5	-70.4	177.8	-8.8	0	0	111.6	F309 L312 R313 L321	F309-Q317 HydrophobicContact CD1-CG 3.98Å; F309-Q317 HydrophobicContact CE1-CB 3.72Å; F309-Q317 HydrophobicContact CE1-CG 3.57Å; F309-Q317 HydrophobicContact CE2-CB 4.09Å; F309-Q317 HydrophobicContact CE2-CG 4.14Å; F309-Q317 HydrophobicContact CG-CG 4.45Å; F309-Q317 HydrophobicContact CZ-CB 3.42Å; F309-Q317 VanDerWaalsContact CZ-CB 3.42Å; F309-Q317 HydrophobicContact CZ-CG 3.66Å; F309-Q317 PolarHBondContact O-NE2 3.26Å; L312-Q317 HydrophobicContact CB-CG 3.93Å; L312-Q317 PolarHBondContact O-NE2 3.3Å; L312-Q317 VanDerWaalsContact O-NE2 3.08Å; R313-Q317 PolarHBondContact O-N 2.84Å; Q317-L321 WeakPolarHBondContact O-CB 3.47Å; Q317-L321 WeakPolarHBondContact O-CG 3.37Å; Q317-L321 PolarHBondContact O-N 2.76Å; Q317-L321 VanDerWaalsContact O-N 3.12Å
318	M	95.9	Very high	96.8	Very high	98 Å²	98	41 Å²	41	48%	0.483	20%	0.199	S	C	.	.	H	α-helix	trans	-69.1	-42.9	176.5	-69.9	-173.7	81.1	0	0	112.4	V314 D316 L320 L321 H322	V314-M318 HydrophobicContact CG1-CG 4.39Å; V314-M318 HydrophobicContact CG1-SD 4.36Å; V314-M318 WeakPolarHBondContact O-CB 3.43Å; V314-M318 VanDerWaalsContact O-CG 3.32Å; V314-M318 WeakPolarHBondContact O-CG 3.41Å; V314-M318 PolarHBondContact O-N 2.78Å; D316-M318 PolarHBondContact O-N 2.95Å; M318-L320 PolarHBondContact O-N 3.11Å; M318-L321 PolarHBondContact O-N 3.17Å; M318-H322 VanDerWaalsContact O-CB 3.23Å; M318-H322 WeakPolarHBondContact O-CB 3.42Å; M318-H322 PolarHBondContact O-CD2 2.96Å; M318-H322 VanDerWaalsContact O-CD2 3.32Å; M318-H322 PolarHBondContact O-N 3.38Å; M318-H322 PolarHBondContact O-ND1 3.4Å
319	K	96.7	Very high	96.9	Very high	47 Å²	47	41.2 Å²	41.2	20%	0.204	20%	0.202	C	C	.	.	H	α-helix	trans	-59.1	-44.3	177.9	-68.7	162.1	-149.2	162.6	0	111.9	G315 D316 N323 V404 L406 L407 E408	G315-K319 WeakPolarHBondContact O-CD 3.47Å; G315-K319 VanDerWaalsContact O-CE 3.23Å; G315-K319 WeakPolarHBondContact O-CE 3.38Å; G315-K319 WeakPolarHBondContact O-CG 3.29Å; G315-K319 PolarHBondContact O-N 3.09Å; G315-K319 VanDerWaalsContact O-N 3.16Å; D316-K319 PolarHBondContact O-N 3.37Å; D316-K319 VanDerWaalsContact O-N 3.07Å; D316-K319 IonicContact OD1-NZ 2.75Å; D316-K319 PolarHBondContact OD1-NZ 3.47Å; K319-N323 PolarHBondContact O-N 3.11Å; K319-N323 VanDerWaalsContact O-N 3.13Å; K319-V404 HydrophobicContact CB-CG1 3.81Å; K319-L406 WeakPolarHBondContact CD-O 3.38Å; K319-L406 VanDerWaalsContact CE-O 3.3Å; K319-L406 WeakPolarHBondContact CE-O 3.4Å; K319-L406 PolarHBondContact NZ-O 3.22Å; K319-L407 HydrophobicContact CB-CD2 4.27Å; K319-L407 HydrophobicContact CD-CD2 4.36Å; K319-E408 IonicContact NZ-OE1 2.62Å; K319-E408 PolarHBondContact NZ-OE1 3.44Å
320	L	97.7	Very high	97	Very high	1 Å²	1	42.3 Å²	42.3	1%	0.005	21%	0.209	C	C	.	.	H	α-helix	trans	-64.5	-52.2	177.5	-66.7	-176.8	0	0	0	111.4	L312 D316 M318 H322 N323 C324 L399 F400 V404 L407 V413	L312-L320 HydrophobicContact CD1-CD1 3.43Å; L312-L320 VanDerWaalsContact CD1-CD1 3.43Å; D316-L320 WeakPolarHBondContact O-CG 3.43Å; D316-L320 PolarHBondContact O-N 2.88Å; M318-L320 PolarHBondContact O-N 3.11Å; L320-H322 PolarHBondContact O-N 3.26Å; L320-N323 WeakPolarHBondContact O-CA 3.16Å; L320-N323 WeakPolarHBondContact O-CB 3.36Å; L320-N323 PolarHBondContact O-N 2.9Å; L320-C324 PolarHBondContact O-N 3.4Å; L320-C324 PolarHBondContact O-SG 3.14Å; L320-C324 VanDerWaalsContact O-SG 3.35Å; L320-L399 HydrophobicContact CB-CD1 4.43Å; L320-F400 HydrophobicContact CD1-CD1 4.09Å; L320-F400 HydrophobicContact CD1-CE1 4.31Å; L320-V404 HydrophobicContact CD2-CB 4.22Å; L320-V404 HydrophobicContact CD2-CG1 4.49Å; L320-V404 HydrophobicContact CD2-CG2 4.05Å; L320-L407 HydrophobicContact CD2-CD1 4.26Å; L320-L407 HydrophobicContact CD2-CD2 3.9Å; L320-L407 HydrophobicContact CG-CD2 4.13Å; L320-V413 HydrophobicContact CD1-CG2 4.21Å; L320-V413 HydrophobicContact CD2-CG1 4.28Å
321	L	97.8	Very high	97.2	Very high	17 Å²	17	36.7 Å²	36.7	9%	0.089	18%	0.184	C	C	.	.	H	α-helix	trans	-60.4	-41.8	177.7	-75.5	172.1	0	0	0	112.5	V300 A303 F309 Q317 M318 N323 C324 W325 L399 M478	V300-L321 HydrophobicContact CG2-CD1 4.36Å; A303-L321 HydrophobicContact CB-CD2 3.83Å; F309-L321 HydrophobicContact CE1-CD1 4.3Å; F309-L321 HydrophobicContact CE2-CG 4.28Å; F309-L321 HydrophobicContact CZ-CD1 3.64Å; F309-L321 HydrophobicContact CZ-CG 3.82Å; Q317-L321 WeakPolarHBondContact O-CB 3.47Å; Q317-L321 WeakPolarHBondContact O-CG 3.37Å; Q317-L321 PolarHBondContact O-N 2.76Å; Q317-L321 VanDerWaalsContact O-N 3.12Å; M318-L321 PolarHBondContact O-N 3.17Å; L321-N323 PolarHBondContact O-N 2.94Å; L321-C324 PolarHBondContact O-N 3.22Å; L321-W325 WeakPolarHBondContact O-CB 3.39Å; L321-W325 PolarHBondContact O-N 3.35Å; L321-L399 HydrophobicContact CD2-CD1 4Å; L321-L399 HydrophobicContact CG-CD1 4.46Å; L321-M478 HydrophobicContact CB-CE 4.11Å; L321-M478 VanDerWaalsContact O-CE 3.3Å; L321-M478 WeakPolarHBondContact O-CE 3.26Å
322	H	96.1	Very high	97.2	Very high	35 Å²	35	31.9 Å²	31.9	16%	0.162	16%	0.163	C	C	.	.	H	α-helix	trans	-61.6	-25.4	173.6	-66.5	169	0	0	0	112.5	M318 L320 A481 K482	M318-H322 VanDerWaalsContact O-CB 3.23Å; M318-H322 WeakPolarHBondContact O-CB 3.42Å; M318-H322 PolarHBondContact O-CD2 2.96Å; M318-H322 VanDerWaalsContact O-CD2 3.32Å; M318-H322 PolarHBondContact O-N 3.38Å; M318-H322 PolarHBondContact O-ND1 3.4Å; L320-H322 PolarHBondContact O-N 3.26Å; H322-A481 HydrophobicContact CB-CB 4.48Å; H322-K482 WeakPolarHBondContact O-CB 3.35Å; H322-K482 VanDerWaalsContact O-CD 3.25Å; H322-K482 WeakPolarHBondContact O-CD 3.5Å; H322-K482 WeakPolarHBondContact O-CG 3.24Å
323	N	95.9	Very high	97.2	Very high	42 Å²	42	34.6 Å²	34.6	23%	0.225	18%	0.175	C	C	.	.	H	α-helix	trans	-81.3	-53.1	175.8	-170.5	-114.9	0	0	0	111.7	K319 L320 L321 N401 V404 K482	K319-N323 PolarHBondContact O-N 3.11Å; K319-N323 VanDerWaalsContact O-N 3.13Å; L320-N323 WeakPolarHBondContact O-CA 3.16Å; L320-N323 WeakPolarHBondContact O-CB 3.36Å; L320-N323 PolarHBondContact O-N 2.9Å; L321-N323 PolarHBondContact O-N 2.94Å; N323-N401 PolarHBondContact OD1-ND2 3.36Å; N323-V404 HydrophobicContact CB-CG2 3.6Å; N323-V404 VanDerWaalsContact CG-CG2 3.48Å; N323-V404 WeakPolarHBondContact OD1-CG2 3.39Å; N323-K482 WeakPolarHBondContact O-CD 3.49Å; N323-K482 WeakPolarHBondContact O-CE 3.48Å; N323-K482 PolarHBondContact O-NZ 3.01Å
324	C	97.3	Very high	97.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-92.2	-9	-164.3	71.3	0	0	0	0	116	L320 L321 S326 E327 L328 L398	L320-C324 PolarHBondContact O-N 3.4Å; L320-C324 PolarHBondContact O-SG 3.14Å; L320-C324 VanDerWaalsContact O-SG 3.35Å; L321-C324 PolarHBondContact O-N 3.22Å; C324-S326 VanDerWaalsContact C-N 3.3Å; C324-S326 PolarHBondContact O-N 2.88Å; C324-S326 VanDerWaalsContact O-N 3.15Å; C324-E327 WeakPolarHBondContact O-CB 3.39Å; C324-E327 PolarHBondContact O-N 3.33Å; C324-E327 VanDerWaalsContact O-N 3.11Å; C324-L328 HydrophobicContact CB-CD1 4.36Å; C324-L328 HydrophobicContact CB-CG 4.44Å; C324-L328 WeakPolarHBondContact O-CG 3.48Å; C324-L328 PolarHBondContact O-N 3.36Å; C324-L328 VanDerWaalsContact SG-CD1 3.53Å; C324-L398 VanDerWaalsContact CB-O 3.26Å; C324-L398 WeakPolarHBondContact CB-O 3.5Å
325	W	97.9	Very high	97.3	Very high	6 Å²	6	22.6 Å²	22.6	2%	0.023	12%	0.119	C	C	.	.	H	α-helix	trans	-54.3	-39.8	-168.8	68.8	-88.6	0	0	0	115	L296 L321 L329 E457 L460 L475 M478 L479	L296-W325 HydrophobicContact CD1-CB 3.72Å; L296-W325 HydrophobicContact CD2-CE3 3.97Å; L321-W325 WeakPolarHBondContact O-CB 3.39Å; L321-W325 PolarHBondContact O-N 3.35Å; W325-L329 HydrophobicContact CE3-CD1 3.69Å; W325-L329 HydrophobicContact CZ3-CD1 3.8Å; W325-L329 WeakPolarHBondContact O-CG 3.44Å; W325-L329 PolarHBondContact O-N 3.29Å; W325-E457 HydrophobicContact CH2-CG 4.17Å; W325-E457 HydrophobicContact CZ2-CG 3.97Å; W325-L460 HydrophobicContact CH2-CD2 4.13Å; W325-L475 HydrophobicContact CE3-CD1 4.3Å; W325-L475 HydrophobicContact CH2-CD1 4.13Å; W325-L475 HydrophobicContact CZ3-CD1 3.51Å; W325-M478 HydrophobicContact CB-CE 3.67Å; W325-M478 HydrophobicContact CD2-CB 4.05Å; W325-M478 HydrophobicContact CG-CB 4.13Å; W325-M478 HydrophobicContact CG-CE 3.84Å; W325-M478 PolarHBondContact NE1-O 3.47Å; W325-L479 HydrophobicContact CH2-CB 4.37Å; W325-L479 HydrophobicContact CH2-CD1 4.41Å; W325-L479 HydrophobicContact CZ2-CB 4.04Å; W325-L479 HydrophobicContact CZ2-CD1 4.11Å
326	S	97.9	Very high	97.4	Very high	5 Å²	5	22.5 Å²	22.5	4%	0.035	11%	0.109	C	C	.	.	H	α-helix	trans	-76.3	-37.4	-179.7	53	0	0	0	0	112.3	C324 L328 L329 V330 E457 K482	C324-S326 VanDerWaalsContact C-N 3.3Å; C324-S326 PolarHBondContact O-N 2.88Å; C324-S326 VanDerWaalsContact O-N 3.15Å; S326-L328 VanDerWaalsContact C-N 3.33Å; S326-L329 PolarHBondContact O-N 3.01Å; S326-V330 WeakPolarHBondContact O-CB 3.36Å; S326-V330 VanDerWaalsContact O-CG2 3.31Å; S326-V330 WeakPolarHBondContact O-CG2 3.3Å; S326-V330 PolarHBondContact O-N 2.77Å; S326-E457 VanDerWaalsContact CB-OE1 3.32Å; S326-E457 WeakPolarHBondContact CB-OE1 3.09Å; S326-E457 PolarHBondContact OG-OE1 3.24Å; S326-K482 PolarHBondContact OG-NZ 3.01Å; S326-K482 VanDerWaalsContact OG-NZ 3.17Å
327	E	98.3	Very high	97.4	Very high	8 Å²	8	22.5 Å²	22.5	4%	0.037	11%	0.109	C	C	.	.	H	α-helix	trans	-61.5	-42.6	172.5	-69.6	158.3	-115.7	0	0	110.2	C324 L331 L398 R450 S453 K482	C324-E327 WeakPolarHBondContact O-CB 3.39Å; C324-E327 PolarHBondContact O-N 3.33Å; C324-E327 VanDerWaalsContact O-N 3.11Å; E327-L331 WeakPolarHBondContact O-CB 3.37Å; E327-L331 PolarHBondContact O-N 2.91Å; E327-L398 HydrophobicContact CB-CD1 4.13Å; E327-L398 HydrophobicContact CB-CD2 4.21Å; E327-L398 WeakPolarHBondContact OE2-CD2 3.43Å; E327-R450 HydrophobicContact CG-CG 4.02Å; E327-R450 WeakPolarHBondContact OE2-CG 3.42Å; E327-R450 IonicContact OE2-CZ 3.29Å; E327-R450 IonicContact OE2-NE 3.35Å; E327-R450 PolarHBondContact OE2-NE 3.35Å; E327-R450 IonicContact OE2-NH2 2.68Å; E327-S453 VanDerWaalsContact CG-OG 3.23Å; E327-S453 WeakPolarHBondContact CG-OG 3.47Å; E327-K482 IonicContact OE1-NZ 3.7Å; E327-K482 PolarHBondContact OE1-NZ 2.92Å
328	L	98.4	Very high	97.3	Very high	0 Å²	0	22.4 Å²	22.4	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-67.5	-44.7	175.9	-67.2	175.2	0	0	0	113	I299 W302 C324 S326 V330 L331 D332 K395 L398	I299-L328 HydrophobicContact CD1-CB 4.02Å; I299-L328 HydrophobicContact CG2-CB 4.29Å; I299-L328 HydrophobicContact CG2-CD1 3.65Å; W302-L328 HydrophobicContact CZ3-CD1 3.79Å; W302-L328 HydrophobicContact CZ3-CD2 4.43Å; C324-L328 HydrophobicContact CB-CD1 4.36Å; C324-L328 HydrophobicContact CB-CG 4.44Å; C324-L328 WeakPolarHBondContact O-CG 3.48Å; C324-L328 PolarHBondContact O-N 3.36Å; C324-L328 VanDerWaalsContact SG-CD1 3.53Å; S326-L328 VanDerWaalsContact C-N 3.33Å; L328-V330 VanDerWaalsContact C-N 3.35Å; L328-V330 PolarHBondContact O-N 2.88Å; L328-L331 PolarHBondContact O-N 3.21Å; L328-D332 WeakPolarHBondContact O-CB 3.34Å; L328-D332 PolarHBondContact O-N 2.93Å; L328-K395 HydrophobicContact CD2-CB 3.91Å; L328-K395 HydrophobicContact CD2-CG 4.04Å; L328-L398 HydrophobicContact CD2-CB 4.08Å; L328-L398 HydrophobicContact CD2-CD1 4.09Å
329	L	98	Very high	97.3	Very high	25 Å²	25	20.8 Å²	20.8	13%	0.131	10%	0.102	C	C	.	.	H	α-helix	trans	-60.1	-42.7	176.2	-80.1	175.2	0	0	0	112.5	A292 T295 L296 I299 W325 S326 H333 L475	A292-L329 HydrophobicContact CB-CD1 4.39Å; T295-L329 HydrophobicContact CG2-CD2 3.64Å; L296-L329 HydrophobicContact CB-CD1 4.45Å; L296-L329 HydrophobicContact CB-CD2 4.42Å; I299-L329 HydrophobicContact CD1-CD2 3.63Å; I299-L329 HydrophobicContact CD1-CG 3.85Å; W325-L329 HydrophobicContact CE3-CD1 3.69Å; W325-L329 HydrophobicContact CZ3-CD1 3.8Å; W325-L329 WeakPolarHBondContact O-CG 3.44Å; W325-L329 PolarHBondContact O-N 3.29Å; S326-L329 PolarHBondContact O-N 3.01Å; L329-H333 WeakPolarHBondContact O-CB 3.46Å; L329-H333 PolarHBondContact O-N 3.43Å; L329-H333 VanDerWaalsContact O-N 3.14Å; L329-L475 HydrophobicContact CD1-CD1 4.21Å
330	V	98.3	Very high	97.2	Very high	25 Å²	25	23 Å²	23	15%	0.152	11%	0.113	C	C	.	.	H	α-helix	trans	-69.7	-38.8	177.5	174.5	0	0	0	0	110.6	S326 L328 H333 I334 L449 L452	S326-V330 WeakPolarHBondContact O-CB 3.36Å; S326-V330 VanDerWaalsContact O-CG2 3.31Å; S326-V330 WeakPolarHBondContact O-CG2 3.3Å; S326-V330 PolarHBondContact O-N 2.77Å; L328-V330 VanDerWaalsContact C-N 3.35Å; L328-V330 PolarHBondContact O-N 2.88Å; V330-H333 PolarHBondContact O-N 3.26Å; V330-I334 HydrophobicContact CG1-CD1 3.71Å; V330-I334 HydrophobicContact CG1-CG1 4.34Å; V330-I334 WeakPolarHBondContact O-CB 3.42Å; V330-I334 VanDerWaalsContact O-CG1 3.3Å; V330-I334 WeakPolarHBondContact O-CG1 3.38Å; V330-I334 PolarHBondContact O-N 2.86Å; V330-L449 HydrophobicContact CB-CD1 4.17Å; V330-L449 HydrophobicContact CG1-CD1 3.69Å; V330-L452 HydrophobicContact CG1-CD2 3.81Å; V330-L452 HydrophobicContact CG1-CG 4.1Å
331	L	98.3	Very high	96.9	Very high	4 Å²	4	23.7 Å²	23.7	2%	0.021	12%	0.12	C	C	.	.	H	α-helix	trans	-65.3	-49	177.9	-174.6	59.6	0	0	0	112.6	E327 L328 H333 I334 F335 M391 L394 K395 L398 L449	E327-L331 WeakPolarHBondContact O-CB 3.37Å; E327-L331 PolarHBondContact O-N 2.91Å; L328-L331 PolarHBondContact O-N 3.21Å; L331-H333 VanDerWaalsContact C-N 3.26Å; L331-H333 PolarHBondContact O-N 3.48Å; L331-I334 PolarHBondContact O-N 2.72Å; L331-F335 WeakPolarHBondContact O-CB 3.44Å; L331-F335 PolarHBondContact O-N 2.69Å; L331-M391 HydrophobicContact CD1-CE 3.81Å; L331-M391 HydrophobicContact CD1-SD 3.44Å; L331-M391 WeakPolarHBondContact CD1-SD 3.22Å; L331-M391 HydrophobicContact CD2-SD 3.58Å; L331-M391 VanDerWaalsContact CD2-SD 3.58Å; L331-M391 HydrophobicContact CG-CE 4.41Å; L331-M391 HydrophobicContact CG-SD 3.38Å; L331-M391 WeakPolarHBondContact CG-SD 3.42Å; L331-L394 HydrophobicContact CD2-CB 4.11Å; L331-K395 HydrophobicContact CD2-CG 3.88Å; L331-L398 HydrophobicContact CD2-CD1 3.52Å; L331-L449 HydrophobicContact CB-CD1 4.22Å; L331-L449 HydrophobicContact CB-CD2 4.1Å; L331-L449 HydrophobicContact CD1-CD1 4.46Å; L331-L449 HydrophobicContact CD1-CD2 4.09Å; L331-L449 HydrophobicContact CD2-CD2 4.36Å; L331-L449 HydrophobicContact CG-CD2 4.42Å
332	D	97.1	Very high	96.6	Very high	27 Å²	27	28.6 Å²	28.6	14%	0.144	14%	0.14	C	C	.	.	H	α-helix	trans	-62	-34.4	176.4	-81	-22.6	0	0	0	111.4	L328 R336 K395	L328-D332 WeakPolarHBondContact O-CB 3.34Å; L328-D332 PolarHBondContact O-N 2.93Å; D332-R336 PolarHBondContact O-N 2.85Å; D332-K395 WeakPolarHBondContact OD1-CD 3.48Å; D332-K395 VanDerWaalsContact OD1-CE 3.25Å; D332-K395 WeakPolarHBondContact OD1-CE 3.48Å; D332-K395 IonicContact OD1-NZ 2.86Å; D332-K395 PolarHBondContact OD1-NZ 3.44Å; D332-K395 IonicContact OD2-NZ 2.93Å; D332-K395 PolarHBondContact OD2-NZ 3.12Å
333	H	96.9	Very high	96.2	Very high	65 Å²	65	35.3 Å²	35.3	30%	0.301	17%	0.172	S	C	.	.	H	α-helix	trans	-67.4	-48.6	173.7	174.6	60.4	0	0	0	112.6	L329 V330 L331 R336 Q337 I346	L329-H333 WeakPolarHBondContact O-CB 3.46Å; L329-H333 PolarHBondContact O-N 3.43Å; L329-H333 VanDerWaalsContact O-N 3.14Å; V330-H333 PolarHBondContact O-N 3.26Å; L331-H333 VanDerWaalsContact C-N 3.26Å; L331-H333 PolarHBondContact O-N 3.48Å; H333-R336 WeakPolarHBondContact O-CB 3.27Å; H333-R336 PolarHBondContact O-N 2.81Å; H333-Q337 PolarHBondContact CE1-NE2 3.08Å; H333-Q337 PolarHBondContact ND1-NE2 2.97Å; H333-Q337 WeakPolarHBondContact O-CG 3.35Å; H333-Q337 PolarHBondContact O-N 3.02Å; H333-Q337 PolarHBondContact O-NE2 3.37Å; H333-I346 VanDerWaalsContact CE1-CG2 3.44Å; H333-I346 WeakPolarHBondContact CE1-CG2 3.35Å
334	I	97.8	Very high	95.9	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.01	19%	0.194	C	C	.	.	H	α-helix	trans	-63	-42.6	178.8	-75.4	175.4	0	0	0	110.6	V330 L331 R336 Q337 V338 L377 L381 L449 L452	V330-I334 HydrophobicContact CG1-CD1 3.71Å; V330-I334 HydrophobicContact CG1-CG1 4.34Å; V330-I334 WeakPolarHBondContact O-CB 3.42Å; V330-I334 VanDerWaalsContact O-CG1 3.3Å; V330-I334 WeakPolarHBondContact O-CG1 3.38Å; V330-I334 PolarHBondContact O-N 2.86Å; L331-I334 PolarHBondContact O-N 2.72Å; I334-R336 VanDerWaalsContact C-N 3.3Å; I334-R336 PolarHBondContact O-N 2.91Å; I334-Q337 CarbonylContact O-C 3.48Å; I334-Q337 WeakPolarHBondContact O-CA 3.41Å; I334-Q337 WeakPolarHBondContact O-CB 3.32Å; I334-Q337 PolarHBondContact O-N 2.97Å; I334-V338 HydrophobicContact CG2-CG2 4.4Å; I334-V338 WeakPolarHBondContact O-CG2 3.46Å; I334-V338 PolarHBondContact O-N 2.9Å; I334-L377 HydrophobicContact CD1-CB 4.37Å; I334-L377 HydrophobicContact CD1-CD2 3.68Å; I334-L377 HydrophobicContact CD1-CG 4.03Å; I334-L381 HydrophobicContact CG2-CD1 3.54Å; I334-L449 HydrophobicContact CD1-CD1 4.29Å; I334-L452 HydrophobicContact CD1-CD2 3.88Å
335	F	97.3	Very high	95.7	Very high	11 Å²	11	40 Å²	40	5%	0.048	20%	0.198	C	C	.	.	H	α-helix	trans	-65.9	-32	-180	-173.2	-130.5	0	0	0	113.1	L331 Q337 V338 Q339 R388 M391	L331-F335 WeakPolarHBondContact O-CB 3.44Å; L331-F335 PolarHBondContact O-N 2.69Å; F335-Q337 VanDerWaalsContact C-N 3.32Å; F335-V338 HydrophobicContact CD2-CB 4.27Å; F335-V338 HydrophobicContact CD2-CG1 4.47Å; F335-V338 PolarHBondContact O-N 3.21Å; F335-Q339 HydrophobicContact CD2-CG 4.4Å; F335-Q339 HydrophobicContact CE2-CG 4.01Å; F335-Q339 HydrophobicContact CZ-CG 4.09Å; F335-Q339 PolarHBondContact O-N 3.32Å; F335-R388 HydrophobicContact CE1-CG 3.87Å; F335-R388 HydrophobicContact CZ-CB 4.31Å; F335-R388 HydrophobicContact CZ-CG 3.69Å; F335-M391 HydrophobicContact CB-CE 3.99Å; F335-M391 HydrophobicContact CB-CG 4.21Å; F335-M391 HydrophobicContact CB-SD 4.18Å; F335-M391 HydrophobicContact CD1-CB 4.05Å; F335-M391 HydrophobicContact CD1-CG 3.5Å; F335-M391 VanDerWaalsContact CD1-CG 3.5Å; F335-M391 HydrophobicContact CD2-CB 4.28Å; F335-M391 HydrophobicContact CD2-CE 3.63Å; F335-M391 HydrophobicContact CD2-CG 4.11Å; F335-M391 HydrophobicContact CE1-CB 3.72Å; F335-M391 HydrophobicContact CE1-CG 3.69Å; F335-M391 HydrophobicContact CE2-CB 4.02Å; F335-M391 HydrophobicContact CE2-CE 4.22Å; F335-M391 HydrophobicContact CE2-CG 4.32Å; F335-M391 HydrophobicContact CG-CB 4.29Å; F335-M391 HydrophobicContact CG-CE 3.86Å; F335-M391 HydrophobicContact CG-CG 3.69Å; F335-M391 HydrophobicContact CG-SD 4.19Å; F335-M391 HydrophobicContact CZ-CB 3.72Å; F335-M391 HydrophobicContact CZ-CG 4.12Å
336	R	96.9	Very high	95.6	Very high	29 Å²	29	40.3 Å²	40.3	11%	0.109	20%	0.2	C	C	.	.	H	α-helix	trans	-62.3	-38.7	166.8	-177.6	173.5	-58.4	99.5	17.9	112	E258 D332 H333 I334 H340 G341 L347	E258-R336 IonicContact OE1-CZ 2.74Å; E258-R336 IonicContact OE1-NE 2.73Å; E258-R336 PolarHBondContact OE1-NE 3.11Å; E258-R336 IonicContact OE1-NH2 2.55Å; E258-R336 PolarHBondContact OE1-NH2 3.36Å; D332-R336 PolarHBondContact O-N 2.85Å; H333-R336 WeakPolarHBondContact O-CB 3.27Å; H333-R336 PolarHBondContact O-N 2.81Å; I334-R336 VanDerWaalsContact C-N 3.3Å; I334-R336 PolarHBondContact O-N 2.91Å; R336-H340 WeakPolarHBondContact O-CA 3.5Å; R336-H340 WeakPolarHBondContact O-CB 3.41Å; R336-H340 PolarHBondContact O-N 2.83Å; R336-G341 PolarHBondContact O-N 3.49Å; R336-L347 HydrophobicContact CG-CD2 3.9Å; R336-L347 HydrophobicContact CG-CG 4.23Å
337	Q	97.1	Very high	95.4	Very high	1 Å²	1	41 Å²	41	1%	0.005	20%	0.203	C	C	.	.	H	α-helix	trans	-67.3	-38.6	175	-50.1	-35.8	-69.8	0	0	111.2	H333 I334 F335 G341 L347 T378 R382	H333-Q337 PolarHBondContact CE1-NE2 3.08Å; H333-Q337 PolarHBondContact ND1-NE2 2.97Å; H333-Q337 WeakPolarHBondContact O-CG 3.35Å; H333-Q337 PolarHBondContact O-N 3.02Å; H333-Q337 PolarHBondContact O-NE2 3.37Å; I334-Q337 CarbonylContact O-C 3.48Å; I334-Q337 WeakPolarHBondContact O-CA 3.41Å; I334-Q337 WeakPolarHBondContact O-CB 3.32Å; I334-Q337 PolarHBondContact O-N 2.97Å; F335-Q337 VanDerWaalsContact C-N 3.32Å; Q337-G341 WeakPolarHBondContact O-CA 3.37Å; Q337-G341 PolarHBondContact O-N 2.93Å; Q337-L347 PolarHBondContact NE2-O 2.99Å; Q337-T378 HydrophobicContact CB-CG2 3.48Å; Q337-T378 VanDerWaalsContact CB-CG2 3.48Å; Q337-R382 PolarHBondContact O-NE 3.32Å; Q337-R382 PolarHBondContact O-NH2 3Å
338	V	96.8	Very high	95.3	Very high	23 Å²	23	41.6 Å²	41.6	14%	0.139	21%	0.207	C	C	.	.	H	α-helix	trans	-60	-48.7	176.1	173.5	0	0	0	0	111.4	I334 F335 T378 L381 R382	I334-V338 HydrophobicContact CG2-CG2 4.4Å; I334-V338 WeakPolarHBondContact O-CG2 3.46Å; I334-V338 PolarHBondContact O-N 2.9Å; F335-V338 HydrophobicContact CD2-CB 4.27Å; F335-V338 HydrophobicContact CD2-CG1 4.47Å; F335-V338 PolarHBondContact O-N 3.21Å; V338-T378 HydrophobicContact CG2-CG2 3.94Å; V338-L381 HydrophobicContact CG2-CB 3.68Å; V338-L381 HydrophobicContact CG2-CD1 4.45Å; V338-R382 HydrophobicContact CB-CG 4.27Å; V338-R382 HydrophobicContact CG1-CG 4.03Å; V338-R382 HydrophobicContact CG2-CG 4.28Å
339	Q	94.7	Very high	95.1	Very high	63 Å²	63	42.2 Å²	42.2	29%	0.294	21%	0.21	S	C	.	.	H	α-helix	trans	-79.8	-36.7	-177.4	-70.7	-176.4	84.9	0	0	114.7	F335 R388	F335-Q339 HydrophobicContact CD2-CG 4.4Å; F335-Q339 HydrophobicContact CE2-CG 4.01Å; F335-Q339 HydrophobicContact CZ-CG 4.09Å; F335-Q339 PolarHBondContact O-N 3.32Å; Q339-R388 VanDerWaalsContact OE1-CZ 3.23Å
340	H	94.7	Very high	94.9	Very high	95 Å²	95	41.7 Å²	41.7	44%	0.44	21%	0.208	S	C	.	.	H	α-helix	trans	-137.6	-6.7	-161.4	-58.2	-37.3	0	0	0	114.3	R336 L347	R336-H340 WeakPolarHBondContact O-CA 3.5Å; R336-H340 WeakPolarHBondContact O-CB 3.41Å; R336-H340 PolarHBondContact O-N 2.83Å; H340-L347 HydrophobicContact CB-CD2 3.49Å; H340-L347 VanDerWaalsContact CB-CD2 3.49Å
341	G	91.3	Very high	94.6	Very high	15 Å²	15	42.3 Å²	42.3	16%	0.155	22%	0.22	C	C	.	.			trans	-76.9	137.2	177	0	0	0	0	0	112.2	R336 Q337 R382	R336-G341 PolarHBondContact O-N 3.49Å; Q337-G341 WeakPolarHBondContact O-CA 3.37Å; Q337-G341 PolarHBondContact O-N 2.93Å; G341-R382 PolarHBondContact O-NH2 2.7Å; G341-R382 VanDerWaalsContact O-NH2 3.11Å
342	K	91.4	Very high	94.3	Very high	119 Å²	119	47 Å²	47	52%	0.517	24%	0.242	S	C	.	.			trans	-87.5	178.5	173.4	-57.8	161.9	-177.5	163.8	0	110.5	E353	K342-E353 WeakPolarHBondContact CE-OE1 3.49Å; K342-E353 IonicContact NZ-OE1 3.24Å; K342-E353 PolarHBondContact NZ-OE1 3.28Å; K342-E353 IonicContact NZ-OE2 2.78Å; K342-E353 PolarHBondContact NZ-OE2 3.27Å
343	E	87.5	Confident	94	Very high	177 Å²	177	50.2 Å²	50.2	83%	0.827	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	157.5	166.7	-63.9	179.7	157.4	0	0	110.5	S345	E343-S345 PolarHBondContact O-N 2.88Å; E343-S345 PolarHBondContact O-OG 2.62Å
344	D	89.5	Confident	93.8	Very high	127 Å²	127	48.9 Å²	48.9	68%	0.679	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	45.4	25.2	179.1	-63.5	-31	0	0	0	117.2	M356	D344-M356 WeakPolarHBondContact O-CB 3.36Å; D344-M356 PolarHBondContact O-N 2.96Å
345	S	94.2	Very high	93.5	Very high	13 Å²	13	54.2 Å²	54.2	9%	0.091	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	164.8	-178.8	55.4	0	0	0	0	113.3	E343 I354 Q375	E343-S345 PolarHBondContact O-N 2.88Å; E343-S345 PolarHBondContact O-OG 2.62Å; S345-I354 CarbonylContact C-O 3.55Å; S345-I354 WeakPolarHBondContact CA-O 3.46Å; S345-Q375 PolarHBondContact O-NE2 2.97Å
346	I	94.3	Very high	93.1	Very high	12 Å²	12	55 Å²	55	6%	0.062	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	119.3	178	-51.7	-173.4	0	0	0	109	H333 L348 E353 I354 M356 I359 V371	H333-I346 VanDerWaalsContact CE1-CG2 3.44Å; H333-I346 WeakPolarHBondContact CE1-CG2 3.35Å; I346-L348 HydrophobicContact CG2-CD2 4.44Å; I346-E353 WeakPolarHBondContact O-CA 3.34Å; I346-I354 PolarHBondContact N-O 3.06Å; I346-I354 PolarHBondContact O-N 2.81Å; I346-M356 HydrophobicContact CD1-SD 3.99Å; I346-M356 HydrophobicContact CG1-CE 4.47Å; I346-M356 HydrophobicContact CG1-SD 3.8Å; I346-I359 HydrophobicContact CD1-CD1 3.41Å; I346-I359 VanDerWaalsContact CD1-CD1 3.41Å; I346-I359 HydrophobicContact CG1-CD1 4.29Å; I346-V371 HydrophobicContact CD1-CB 4.47Å; I346-V371 HydrophobicContact CD1-CG1 3.65Å; I346-V371 HydrophobicContact CD1-CG2 3.98Å
347	L	95.3	Very high	92.7	Very high	21 Å²	21	56.2 Å²	56.2	11%	0.11	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	114.9	175.9	-176.4	65.6	0	0	0	110.7	R336 Q337 H340 E353	R336-L347 HydrophobicContact CG-CD2 3.9Å; R336-L347 HydrophobicContact CG-CG 4.23Å; Q337-L347 PolarHBondContact NE2-O 2.99Å; H340-L347 HydrophobicContact CB-CD2 3.49Å; H340-L347 VanDerWaalsContact CB-CD2 3.49Å; L347-E353 HydrophobicContact CD1-CG 3.72Å
348	L	94.6	Very high	92.2	Very high	20 Å²	20	58.9 Å²	58.9	11%	0.105	31%	0.311	C	S	.	.			trans	-78.7	163.1	178.8	-56	-176.1	0	0	0	112.4	M291 I346 T350 G351 Q352 I354	M291-L348 HydrophobicContact CE-CB 3.61Å; M291-L348 HydrophobicContact CE-CD1 3.68Å; M291-L348 HydrophobicContact CE-CD2 4.5Å; M291-L348 HydrophobicContact CE-CG 4.14Å; I346-L348 HydrophobicContact CG2-CD2 4.44Å; L348-T350 PolarHBondContact O-N 2.89Å; L348-T350 VanDerWaalsContact O-N 3.13Å; L348-G351 PolarHBondContact O-N 3Å; L348-Q352 WeakPolarHBondContact CB-O 3.36Å; L348-Q352 HydrophobicContact CD1-CB 4.17Å; L348-Q352 WeakPolarHBondContact CG-O 3.45Å; L348-Q352 PolarHBondContact N-O 2.89Å; L348-I354 HydrophobicContact CD1-CD1 3.85Å; L348-I354 HydrophobicContact CD1-CG1 4.06Å; L348-I354 HydrophobicContact CD2-CD1 4.09Å; L348-I354 HydrophobicContact CD2-CG1 4.49Å; L348-I354 HydrophobicContact CG-CD1 4.29Å; L348-I354 HydrophobicContact CG-CG1 4.31Å
349	V	94.4	Very high	91.6	Very high	13 Å²	13	58.5 Å²	58.5	8%	0.079	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-16.6	174.6	69.2	0	0	0	0	113.8	Q262 I265 M291 G351	Q262-V349 WeakPolarHBondContact CG-O 3.47Å; I265-V349 HydrophobicContact CD1-CG1 4.16Å; I265-V349 HydrophobicContact CD1-CG2 3.58Å; I265-V349 HydrophobicContact CG2-CG1 4.23Å; M291-V349 HydrophobicContact CB-CG1 4.02Å; M291-V349 HydrophobicContact CE-CG1 3.92Å; M291-V349 HydrophobicContact CG-CG1 4.44Å; V349-G351 VanDerWaalsContact C-N 3.3Å
350	T	93.9	Very high	91	Very high	14 Å²	14	60 Å²	60	9%	0.086	32%	0.317	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-8.2	171.7	46.2	0	0	0	0	113.5	Q262 I265 V266 L269 M291 L348 Q352	Q262-T350 PolarHBondContact NE2-O 3.47Å; I265-T350 HydrophobicContact CG2-CG2 4.42Å; V266-T350 HydrophobicContact CG2-CG2 3.92Å; L269-T350 HydrophobicContact CD1-CG2 3.66Å; M291-T350 HydrophobicContact CE-CG2 3.81Å; M291-T350 HydrophobicContact CG-CG2 4.33Å; M291-T350 HydrophobicContact SD-CG2 4.25Å; L348-T350 PolarHBondContact O-N 2.89Å; L348-T350 VanDerWaalsContact O-N 3.13Å; T350-Q352 VanDerWaalsContact C-N 3.29Å; T350-Q352 WeakPolarHBondContact OG1-CG 3.21Å; T350-Q352 PolarHBondContact OG1-OE1 2.99Å
351	G	92.1	Very high	90.4	Very high	38 Å²	38	60 Å²	60	39%	0.392	33%	0.328	S	S	.	.	S	Bend	trans	79.3	8.6	-169.1	0	0	0	0	0	114.1	L348 V349	L348-G351 PolarHBondContact O-N 3Å; V349-G351 VanDerWaalsContact C-N 3.3Å
352	Q	91.4	Very high	89.7	Confident	103 Å²	103	65 Å²	65	48%	0.481	35%	0.348	S	S	.	.			trans	-83.4	140.8	173.4	-63.3	172.3	-79.8	0	0	110.1	L348 T350	L348-Q352 WeakPolarHBondContact CB-O 3.36Å; L348-Q352 HydrophobicContact CD1-CB 4.17Å; L348-Q352 WeakPolarHBondContact CG-O 3.45Å; L348-Q352 PolarHBondContact N-O 2.89Å; T350-Q352 VanDerWaalsContact C-N 3.29Å; T350-Q352 WeakPolarHBondContact OG1-CG 3.21Å; T350-Q352 PolarHBondContact OG1-OE1 2.99Å
353	E	92.8	Very high	88.4	Confident	93 Å²	93	62 Å²	62	44%	0.435	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	135.6	175	-67.4	172.8	176.8	0	0	110	K342 I346 L347	K342-E353 WeakPolarHBondContact CE-OE1 3.49Å; K342-E353 IonicContact NZ-OE1 3.24Å; K342-E353 PolarHBondContact NZ-OE1 3.28Å; K342-E353 IonicContact NZ-OE2 2.78Å; K342-E353 PolarHBondContact NZ-OE2 3.27Å; I346-E353 WeakPolarHBondContact O-CA 3.34Å; L347-E353 HydrophobicContact CD1-CG 3.72Å
354	I	90.9	Very high	88.3	Confident	37 Å²	37	56.2 Å²	56.2	19%	0.19	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	129	169	-58	-177.8	0	0	0	108.3	S345 I346 L348 I359	S345-I354 CarbonylContact C-O 3.55Å; S345-I354 WeakPolarHBondContact CA-O 3.46Å; I346-I354 PolarHBondContact N-O 3.06Å; I346-I354 PolarHBondContact O-N 2.81Å; L348-I354 HydrophobicContact CD1-CD1 3.85Å; L348-I354 HydrophobicContact CD1-CG1 4.06Å; L348-I354 HydrophobicContact CD2-CD1 4.09Å; L348-I354 HydrophobicContact CD2-CG1 4.49Å; L348-I354 HydrophobicContact CG-CD1 4.29Å; L348-I354 HydrophobicContact CG-CG1 4.31Å; I354-I359 HydrophobicContact CG2-CD1 3.84Å; I354-I359 HydrophobicContact CG2-CG1 3.82Å
355	E	92.1	Very high	88.2	Confident	114 Å²	114	55.5 Å²	55.5	53%	0.533	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	135.1	174	-164.3	-170	149	0	0	111.2	S357 S358	E355-S357 VanDerWaalsContact C-N 3.29Å; E355-S357 WeakPolarHBondContact CG-OG 3.38Å; E355-S357 PolarHBondContact O-N 3.02Å; E355-S357 WeakPolarHBondContact OE1-CB 3.38Å; E355-S357 PolarHBondContact OE1-OG 3.35Å; E355-S358 WeakPolarHBondContact O-CB 3.49Å; E355-S358 PolarHBondContact O-N 3.47Å; E355-S358 VanDerWaalsContact O-N 3.14Å
356	M	89.4	Confident	88.1	Confident	27 Å²	27	58.2 Å²	58.2	13%	0.133	34%	0.34	C	S	.	.	H	α-helix	trans	-60.3	-39.7	-176.3	-145.5	81.8	71.2	0	0	112	D344 I346 S358 I359 L360 V371 Q375	D344-M356 WeakPolarHBondContact O-CB 3.36Å; D344-M356 PolarHBondContact O-N 2.96Å; I346-M356 HydrophobicContact CD1-SD 3.99Å; I346-M356 HydrophobicContact CG1-CE 4.47Å; I346-M356 HydrophobicContact CG1-SD 3.8Å; M356-S358 PolarHBondContact O-N 3.1Å; M356-I359 PolarHBondContact O-N 3.32Å; M356-L360 HydrophobicContact CG-CD1 4.43Å; M356-L360 WeakPolarHBondContact O-CG 3.43Å; M356-L360 PolarHBondContact O-N 3Å; M356-V371 HydrophobicContact CG-CG1 4.46Å; M356-V371 HydrophobicContact SD-CG1 3.52Å; M356-V371 VanDerWaalsContact SD-CG1 3.52Å; M356-Q375 HydrophobicContact CE-CG 3.78Å; M356-Q375 HydrophobicContact SD-CG 4.21Å
357	S	88.5	Confident	87.9	Confident	56 Å²	56	59 Å²	59	39%	0.392	34%	0.344	S	S	.	.	H	α-helix	trans	-56	-37.9	178.1	73.3	0	0	0	0	112.2	E355 I359 L360 S361	E355-S357 VanDerWaalsContact C-N 3.29Å; E355-S357 WeakPolarHBondContact CG-OG 3.38Å; E355-S357 PolarHBondContact O-N 3.02Å; E355-S357 WeakPolarHBondContact OE1-CB 3.38Å; E355-S357 PolarHBondContact OE1-OG 3.35Å; S357-I359 PolarHBondContact O-N 2.96Å; S357-L360 PolarHBondContact O-N 2.9Å; S357-S361 VanDerWaalsContact O-CB 3.29Å; S357-S361 WeakPolarHBondContact O-CB 3.36Å; S357-S361 PolarHBondContact O-N 2.8Å; S357-S361 PolarHBondContact O-OG 2.9Å
358	S	86.7	Confident	87.7	Confident	56 Å²	56	58.9 Å²	58.9	39%	0.392	35%	0.346	S	S	.	.	H	α-helix	trans	-71.9	-16	179.9	-71.1	0	0	0	0	112.8	E355 M356 Q362	E355-S358 WeakPolarHBondContact O-CB 3.49Å; E355-S358 PolarHBondContact O-N 3.47Å; E355-S358 VanDerWaalsContact O-N 3.14Å; M356-S358 PolarHBondContact O-N 3.1Å; S358-Q362 WeakPolarHBondContact O-CG 3.05Å; S358-Q362 PolarHBondContact O-NE2 3.04Å
359	I	84.4	Confident	87.7	Confident	16 Å²	16	60.6 Å²	60.6	8%	0.082	36%	0.359	C	S	.	.	H	α-helix	trans	-90.7	-50	171.7	-58.9	170	0	0	0	109.7	I346 I354 M356 S357 S361 Q362 L367 V371	I346-I359 HydrophobicContact CD1-CD1 3.41Å; I346-I359 VanDerWaalsContact CD1-CD1 3.41Å; I346-I359 HydrophobicContact CG1-CD1 4.29Å; I354-I359 HydrophobicContact CG2-CD1 3.84Å; I354-I359 HydrophobicContact CG2-CG1 3.82Å; M356-I359 PolarHBondContact O-N 3.32Å; S357-I359 PolarHBondContact O-N 2.96Å; I359-S361 PolarHBondContact O-N 2.99Å; I359-Q362 WeakPolarHBondContact O-CB 3.27Å; I359-Q362 PolarHBondContact O-N 3.17Å; I359-L367 HydrophobicContact CG2-CD2 4.05Å; I359-L367 HydrophobicContact CG2-CG 4.04Å; I359-V371 HydrophobicContact CD1-CG2 4.4Å; I359-V371 HydrophobicContact CG2-CG2 4.33Å
360	L	81.7	Confident	87.7	Confident	93 Å²	93	60.9 Å²	60.9	49%	0.487	36%	0.36	S	S	.	.	H	α-helix	trans	-59.8	-34.6	-177.5	-63.2	175.7	0	0	0	112.5	M356 S357 Q362	M356-L360 HydrophobicContact CG-CD1 4.43Å; M356-L360 WeakPolarHBondContact O-CG 3.43Å; M356-L360 PolarHBondContact O-N 3Å; S357-L360 PolarHBondContact O-N 2.9Å; L360-Q362 VanDerWaalsContact C-N 3.3Å; L360-Q362 PolarHBondContact O-N 3.16Å
361	S	82.3	Confident	87.7	Confident	96 Å²	96	61.3 Å²	61.3	67%	0.671	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.3	-11.6	177.2	53	0	0	0	0	115.3	S357 I359 G363	S357-S361 VanDerWaalsContact O-CB 3.29Å; S357-S361 WeakPolarHBondContact O-CB 3.36Å; S357-S361 PolarHBondContact O-N 2.8Å; S357-S361 PolarHBondContact O-OG 2.9Å; I359-S361 PolarHBondContact O-N 2.99Å; S361-G363 PolarHBondContact O-N 3.44Å
362	Q	76.5	Confident	87.8	Confident	120 Å²	120	65 Å²	65	56%	0.561	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-6.6	177.2	-70.4	175.7	58.6	0	0	113.5	S358 I359 L360 E364	S358-Q362 WeakPolarHBondContact O-CG 3.05Å; S358-Q362 PolarHBondContact O-NE2 3.04Å; I359-Q362 WeakPolarHBondContact O-CB 3.27Å; I359-Q362 PolarHBondContact O-N 3.17Å; L360-Q362 VanDerWaalsContact C-N 3.3Å; L360-Q362 PolarHBondContact O-N 3.16Å; Q362-E364 PolarHBondContact O-N 2.84Å; Q362-E364 VanDerWaalsContact O-N 3.15Å
363	G	64.4	Low	88	Confident	57 Å²	57	62.7 Å²	62.7	59%	0.588	36%	0.357	S	S	*	.			trans	74.7	-4.7	173.3	0	0	0	0	0	116.2	S361 T365	S361-G363 PolarHBondContact O-N 3.44Å; G363-T365 PolarHBondContact O-N 3.01Å
364	E	84.2	Confident	88.2	Confident	55 Å²	55	58.8 Å²	58.8	26%	0.257	34%	0.341	S	S	.	.			trans	-78.7	86.9	178.6	-173.4	147.8	-146.3	0	0	111	Q362 T366 L367 S368 Y459 K463	Q362-E364 PolarHBondContact O-N 2.84Å; Q362-E364 VanDerWaalsContact O-N 3.15Å; E364-T366 VanDerWaalsContact C-N 3.26Å; E364-T366 PolarHBondContact O-N 3.16Å; E364-T366 VanDerWaalsContact O-N 3.14Å; E364-L367 HydrophobicContact CB-CB 4.26Å; E364-L367 HydrophobicContact CG-CB 4.03Å; E364-L367 WeakPolarHBondContact O-CB 3.3Å; E364-L367 PolarHBondContact O-N 3.38Å; E364-S368 PolarHBondContact O-N 3.12Å; E364-S368 VanDerWaalsContact O-N 3.1Å; E364-S368 PolarHBondContact O-OG 2.76Å; E364-Y459 HydrophobicContact CG-CE2 4.19Å; E364-Y459 PolarHBondContact OE2-OH 2.85Å; E364-K463 VanDerWaalsContact CD-NZ 3.25Å; E364-K463 WeakPolarHBondContact OE1-CE 3.46Å; E364-K463 IonicContact OE1-NZ 2.69Å; E364-K463 PolarHBondContact OE1-NZ 3.33Å; E364-K463 WeakPolarHBondContact OE2-CE 3.29Å; E364-K463 IonicContact OE2-NZ 2.82Å; E364-K463 PolarHBondContact OE2-NZ 2.83Å
365	T	88.1	Confident	88.4	Confident	111 Å²	111	58.6 Å²	58.6	68%	0.681	34%	0.34	S	S	*	.	H	α-helix	trans	-52.8	-36.9	-172.2	55.5	0	0	0	0	114.5	G363 S368 S369	G363-T365 PolarHBondContact O-N 3.01Å; T365-S368 PolarHBondContact O-N 3.31Å; T365-S369 WeakPolarHBondContact O-CB 3.32Å; T365-S369 PolarHBondContact O-N 3.43Å
366	T	91.1	Very high	88.6	Confident	71 Å²	71	57.1 Å²	57.1	44%	0.436	33%	0.333	S	S	.	.	H	α-helix	trans	-64	-42.8	175.8	-52.3	0	0	0	0	112.1	E364 S369 L370 Y459	E364-T366 VanDerWaalsContact C-N 3.26Å; E364-T366 PolarHBondContact O-N 3.16Å; E364-T366 VanDerWaalsContact O-N 3.14Å; T366-S369 PolarHBondContact O-N 3.38Å; T366-L370 HydrophobicContact CG2-CD1 4.39Å; T366-L370 WeakPolarHBondContact O-CG 3.34Å; T366-L370 PolarHBondContact O-N 2.97Å; T366-Y459 HydrophobicContact CG2-CD2 3.69Å; T366-Y459 HydrophobicContact CG2-CE2 4.43Å; T366-Y459 HydrophobicContact CG2-CG 4.23Å
367	L	90.8	Very high	89	Confident	27 Å²	27	56 Å²	56	14%	0.141	33%	0.327	C	S	.	.	H	α-helix	trans	-66.6	-44.9	177.7	-179.5	60.4	0	0	0	111	I359 E364 S369 L370 V371 Y459	I359-L367 HydrophobicContact CG2-CD2 4.05Å; I359-L367 HydrophobicContact CG2-CG 4.04Å; E364-L367 HydrophobicContact CB-CB 4.26Å; E364-L367 HydrophobicContact CG-CB 4.03Å; E364-L367 WeakPolarHBondContact O-CB 3.3Å; E364-L367 PolarHBondContact O-N 3.38Å; L367-S369 VanDerWaalsContact C-N 3.31Å; L367-S369 PolarHBondContact O-N 2.93Å; L367-L370 PolarHBondContact O-N 3.48Å; L367-V371 HydrophobicContact CD1-CG2 4.41Å; L367-V371 WeakPolarHBondContact O-CG2 3.4Å; L367-V371 PolarHBondContact O-N 2.67Å; L367-Y459 HydrophobicContact CB-CE2 4.48Å; L367-Y459 HydrophobicContact CD1-CE1 4Å
368	S	91.8	Very high	89.4	Confident	20 Å²	20	53.4 Å²	53.4	14%	0.14	31%	0.309	C	S	.	.	H	α-helix	trans	-58.1	-42.7	175.5	-60.6	0	0	0	0	112.1	E364 T365 V371 Q372	E364-S368 PolarHBondContact O-N 3.12Å; E364-S368 VanDerWaalsContact O-N 3.1Å; E364-S368 PolarHBondContact O-OG 2.76Å; T365-S368 PolarHBondContact O-N 3.31Å; S368-V371 PolarHBondContact O-N 2.87Å; S368-Q372 WeakPolarHBondContact O-CB 3.49Å; S368-Q372 PolarHBondContact O-N 3.05Å
369	S	93.9	Very high	89.9	Confident	56 Å²	56	52.9 Å²	52.9	39%	0.392	31%	0.308	S	S	.	.	H	α-helix	trans	-66.9	-42.7	177.3	-174	0	0	0	0	112.7	T365 T366 L367 V371 Q372 R373	T365-S369 WeakPolarHBondContact O-CB 3.32Å; T365-S369 PolarHBondContact O-N 3.43Å; T366-S369 PolarHBondContact O-N 3.38Å; L367-S369 VanDerWaalsContact C-N 3.31Å; L367-S369 PolarHBondContact O-N 2.93Å; S369-V371 PolarHBondContact O-N 3.46Å; S369-Q372 PolarHBondContact O-N 3Å; S369-R373 WeakPolarHBondContact O-CB 3.28Å; S369-R373 WeakPolarHBondContact O-CG 3.39Å; S369-R373 PolarHBondContact O-N 3.47Å
370	L	95.1	Very high	90.5	Very high	18 Å²	18	56.2 Å²	56.2	9%	0.094	32%	0.32	C	S	.	.	H	α-helix	trans	-59.2	-45.8	174.2	-75.1	171.7	0	0	0	111.8	T366 L367 G374 L452 Q455 A456 Y459	T366-L370 HydrophobicContact CG2-CD1 4.39Å; T366-L370 WeakPolarHBondContact O-CG 3.34Å; T366-L370 PolarHBondContact O-N 2.97Å; L367-L370 PolarHBondContact O-N 3.48Å; L370-G374 PolarHBondContact O-N 2.89Å; L370-L452 HydrophobicContact CD2-CD1 3.8Å; L370-Q455 HydrophobicContact CD2-CB 3.62Å; L370-A456 HydrophobicContact CD2-CB 4.39Å; L370-Y459 HydrophobicContact CD1-CD1 3.84Å; L370-Y459 HydrophobicContact CD1-CG 3.85Å
371	V	93.8	Very high	91.2	Very high	23 Å²	23	52 Å²	52	14%	0.139	30%	0.298	C	S	.	.	H	α-helix	trans	-62.6	-48.2	177.5	164.5	0	0	0	0	111.3	I346 M356 I359 L367 S368 S369 R373 G374 Q375	I346-V371 HydrophobicContact CD1-CB 4.47Å; I346-V371 HydrophobicContact CD1-CG1 3.65Å; I346-V371 HydrophobicContact CD1-CG2 3.98Å; M356-V371 HydrophobicContact CG-CG1 4.46Å; M356-V371 HydrophobicContact SD-CG1 3.52Å; M356-V371 VanDerWaalsContact SD-CG1 3.52Å; I359-V371 HydrophobicContact CD1-CG2 4.4Å; I359-V371 HydrophobicContact CG2-CG2 4.33Å; L367-V371 HydrophobicContact CD1-CG2 4.41Å; L367-V371 WeakPolarHBondContact O-CG2 3.4Å; L367-V371 PolarHBondContact O-N 2.67Å; S368-V371 PolarHBondContact O-N 2.87Å; S369-V371 PolarHBondContact O-N 3.46Å; V371-R373 PolarHBondContact O-N 3.29Å; V371-G374 PolarHBondContact O-N 2.83Å; V371-Q375 WeakPolarHBondContact O-CG 3.35Å; V371-Q375 PolarHBondContact O-N 3.27Å
372	Q	93.9	Very high	91.9	Very high	116 Å²	116	51.3 Å²	51.3	54%	0.542	28%	0.28	S	S	.	.	H	α-helix	trans	-59	-49.9	179.3	-173	-172.4	-35.7	0	0	111.4	S368 S369 G374 Q375 E376	S368-Q372 WeakPolarHBondContact O-CB 3.49Å; S368-Q372 PolarHBondContact O-N 3.05Å; S369-Q372 PolarHBondContact O-N 3Å; Q372-G374 VanDerWaalsContact C-N 3.27Å; Q372-G374 PolarHBondContact O-N 3.44Å; Q372-Q375 PolarHBondContact O-N 3.09Å; Q372-Q375 VanDerWaalsContact O-N 3.08Å; Q372-E376 WeakPolarHBondContact CG-OE1 3.46Å; Q372-E376 PolarHBondContact NE2-OE1 2.86Å; Q372-E376 WeakPolarHBondContact O-CG 3.23Å; Q372-E376 PolarHBondContact O-N 2.89Å
373	R	96.2	Very high	92.8	Very high	54 Å²	54	51.5 Å²	51.5	20%	0.204	29%	0.29	C	S	.	.	H	α-helix	trans	-61.6	-34.9	177.8	-69.2	-175.9	72.8	-145.3	-1.6	112.7	S369 V371 L377 S451 L452	S369-R373 WeakPolarHBondContact O-CB 3.28Å; S369-R373 WeakPolarHBondContact O-CG 3.39Å; S369-R373 PolarHBondContact O-N 3.47Å; V371-R373 PolarHBondContact O-N 3.29Å; R373-L377 WeakPolarHBondContact O-CB 3.33Å; R373-L377 PolarHBondContact O-N 2.74Å; R373-S451 PolarHBondContact NH1-OG 3.45Å; R373-S451 PolarHBondContact NH2-OG 3.01Å; R373-L452 HydrophobicContact CB-CD1 3.94Å
374	G	96.6	Very high	94.2	Very high	11 Å²	11	50 Å²	50	11%	0.113	27%	0.268	C	S	.	.	H	α-helix	trans	-64.3	-40.4	172.6	0	0	0	0	0	113.1	L370 V371 Q372 T378	L370-G374 PolarHBondContact O-N 2.89Å; V371-G374 PolarHBondContact O-N 2.83Å; Q372-G374 VanDerWaalsContact C-N 3.27Å; Q372-G374 PolarHBondContact O-N 3.44Å; G374-T378 WeakPolarHBondContact O-CB 3.39Å; G374-T378 PolarHBondContact O-N 3.21Å; G374-T378 PolarHBondContact O-OG1 3Å
375	Q	95.4	Very high	94.7	Very high	34 Å²	34	53.2 Å²	53.2	16%	0.159	28%	0.283	C	S	.	.	H	α-helix	trans	-71.9	-38	175.8	-68.3	-66.9	-8.2	0	0	112.4	S345 M356 V371 Q372 L377 T378 A379	S345-Q375 PolarHBondContact O-NE2 2.97Å; M356-Q375 HydrophobicContact CE-CG 3.78Å; M356-Q375 HydrophobicContact SD-CG 4.21Å; V371-Q375 WeakPolarHBondContact O-CG 3.35Å; V371-Q375 PolarHBondContact O-N 3.27Å; Q372-Q375 PolarHBondContact O-N 3.09Å; Q372-Q375 VanDerWaalsContact O-N 3.08Å; Q375-L377 VanDerWaalsContact C-N 3.35Å; Q375-L377 PolarHBondContact O-N 3.34Å; Q375-T378 WeakPolarHBondContact O-CB 3.45Å; Q375-T378 PolarHBondContact O-N 2.89Å; Q375-A379 WeakPolarHBondContact O-CB 3.33Å; Q375-A379 PolarHBondContact O-N 2.96Å
376	E	96.1	Very high	95.1	Very high	82 Å²	82	48.4 Å²	48.4	38%	0.383	25%	0.253	S	S	.	.	H	α-helix	trans	-59.8	-43.3	172.7	-71.1	167.1	-173	0	0	111.9	Q372 A379 R380	Q372-E376 WeakPolarHBondContact CG-OE1 3.46Å; Q372-E376 PolarHBondContact NE2-OE1 2.86Å; Q372-E376 WeakPolarHBondContact O-CG 3.23Å; Q372-E376 PolarHBondContact O-N 2.89Å; E376-A379 PolarHBondContact O-N 3.38Å; E376-R380 WeakPolarHBondContact O-CG 3.37Å; E376-R380 PolarHBondContact O-N 3.49Å; E376-R380 PolarHBondContact O-NH1 3.11Å
377	L	97.3	Very high	95.3	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.021	24%	0.237	C	C	.	.	H	α-helix	trans	-69.9	-39.1	175.6	178.3	52.4	0	0	0	111.6	I334 R373 Q375 A379 R380 L381 Q445 L449 L452	I334-L377 HydrophobicContact CD1-CB 4.37Å; I334-L377 HydrophobicContact CD1-CD2 3.68Å; I334-L377 HydrophobicContact CD1-CG 4.03Å; R373-L377 WeakPolarHBondContact O-CB 3.33Å; R373-L377 PolarHBondContact O-N 2.74Å; Q375-L377 VanDerWaalsContact C-N 3.35Å; Q375-L377 PolarHBondContact O-N 3.34Å; L377-A379 VanDerWaalsContact C-N 3.32Å; L377-A379 PolarHBondContact O-N 2.89Å; L377-R380 PolarHBondContact O-N 3.45Å; L377-L381 HydrophobicContact CD1-CD1 4.18Å; L377-L381 HydrophobicContact CD1-CG 4.24Å; L377-L381 HydrophobicContact CG-CD1 4.25Å; L377-L381 WeakPolarHBondContact O-CG 3.48Å; L377-L381 PolarHBondContact O-N 3.41Å; L377-Q445 HydrophobicContact CD1-CB 3.99Å; L377-Q445 HydrophobicContact CD1-CG 4.34Å; L377-L449 HydrophobicContact CD2-CB 4.19Å; L377-L449 HydrophobicContact CD2-CD1 4.3Å; L377-L452 HydrophobicContact CD2-CD2 4.44Å
378	T	97.8	Very high	95.5	Very high	1 Å²	1	48.6 Å²	48.6	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-56.6	-45.8	171.4	-60.4	0	0	0	0	111.3	Q337 V338 G374 Q375 R380 L381 R382	Q337-T378 HydrophobicContact CB-CG2 3.48Å; Q337-T378 VanDerWaalsContact CB-CG2 3.48Å; V338-T378 HydrophobicContact CG2-CG2 3.94Å; G374-T378 WeakPolarHBondContact O-CB 3.39Å; G374-T378 PolarHBondContact O-N 3.21Å; G374-T378 PolarHBondContact O-OG1 3Å; Q375-T378 WeakPolarHBondContact O-CB 3.45Å; Q375-T378 PolarHBondContact O-N 2.89Å; T378-R380 PolarHBondContact O-N 3.41Å; T378-L381 PolarHBondContact O-N 3.48Å; T378-R382 HydrophobicContact CG2-CG 4.46Å; T378-R382 VanDerWaalsContact CG2-CZ 3.49Å; T378-R382 WeakPolarHBondContact O-CG 3.28Å; T378-R382 PolarHBondContact O-N 3.29Å
379	A	96.6	Very high	95.7	Very high	46 Å²	46	51.2 Å²	51.2	38%	0.38	25%	0.252	S	S	.	.	H	α-helix	trans	-61.7	-42.8	178.6	0	0	0	0	0	111.9	Q375 E376 L377 L381 R382 V383	Q375-A379 WeakPolarHBondContact O-CB 3.33Å; Q375-A379 PolarHBondContact O-N 2.96Å; E376-A379 PolarHBondContact O-N 3.38Å; L377-A379 VanDerWaalsContact C-N 3.32Å; L377-A379 PolarHBondContact O-N 2.89Å; A379-L381 PolarHBondContact O-N 2.55Å; A379-R382 PolarHBondContact O-N 2.94Å; A379-V383 WeakPolarHBondContact O-CG2 3.45Å; A379-V383 PolarHBondContact O-N 3Å
380	R	96.8	Very high	95.9	Very high	85 Å²	85	48.5 Å²	48.5	32%	0.321	23%	0.234	S	C	.	.	H	α-helix	trans	-59.9	-44.5	174.4	-69.2	-168.6	-64.1	-83.5	23.1	112.2	E376 L377 T378 V383 L384 D448	E376-R380 WeakPolarHBondContact O-CG 3.37Å; E376-R380 PolarHBondContact O-N 3.49Å; E376-R380 PolarHBondContact O-NH1 3.11Å; L377-R380 PolarHBondContact O-N 3.45Å; T378-R380 PolarHBondContact O-N 3.41Å; R380-V383 PolarHBondContact O-N 3.42Å; R380-L384 WeakPolarHBondContact O-CG 3.22Å; R380-L384 PolarHBondContact O-N 3.14Å; R380-D448 IonicContact CZ-OD2 3.41Å; R380-D448 IonicContact NE-OD2 3.35Å; R380-D448 IonicContact NH2-OD2 2.75Å; R380-D448 PolarHBondContact NH2-OD2 3.3Å
381	L	97.1	Very high	95.9	Very high	4 Å²	4	47.8 Å²	47.8	2%	0.021	23%	0.23	C	C	.	.	H	α-helix	trans	-71.2	-29.6	179.1	-63.1	169.5	0	0	0	113.1	I334 V338 L377 T378 A379 L384 Q385 V386 L442 Q445	I334-L381 HydrophobicContact CG2-CD1 3.54Å; V338-L381 HydrophobicContact CG2-CB 3.68Å; V338-L381 HydrophobicContact CG2-CD1 4.45Å; L377-L381 HydrophobicContact CD1-CD1 4.18Å; L377-L381 HydrophobicContact CD1-CG 4.24Å; L377-L381 HydrophobicContact CG-CD1 4.25Å; L377-L381 WeakPolarHBondContact O-CG 3.48Å; L377-L381 PolarHBondContact O-N 3.41Å; T378-L381 PolarHBondContact O-N 3.48Å; A379-L381 PolarHBondContact O-N 2.55Å; L381-L384 HydrophobicContact CD2-CD1 4.5Å; L381-Q385 PolarHBondContact O-N 2.96Å; L381-V386 HydrophobicContact CB-CB 4.48Å; L381-V386 HydrophobicContact CB-CG2 4.17Å; L381-V386 HydrophobicContact CD2-CG2 3.8Å; L381-V386 WeakPolarHBondContact O-CG2 3.36Å; L381-V386 PolarHBondContact O-N 2.92Å; L381-V386 VanDerWaalsContact O-N 3.14Å; L381-L442 HydrophobicContact CD2-CD1 4.04Å; L381-Q445 HydrophobicContact CD2-CB 4.36Å; L381-Q445 HydrophobicContact CD2-CG 3.99Å
382	R	96.4	Very high	96.1	Very high	82 Å²	82	46.7 Å²	46.7	31%	0.309	22%	0.223	S	C	.	.	H	α-helix	trans	-66.3	-45	168.8	-73.4	-178	-171.7	135.5	-6.2	111.7	Q337 V338 G341 T378 A379 L384 Q385	Q337-R382 PolarHBondContact O-NE 3.32Å; Q337-R382 PolarHBondContact O-NH2 3Å; V338-R382 HydrophobicContact CB-CG 4.27Å; V338-R382 HydrophobicContact CG1-CG 4.03Å; V338-R382 HydrophobicContact CG2-CG 4.28Å; G341-R382 PolarHBondContact O-NH2 2.7Å; G341-R382 VanDerWaalsContact O-NH2 3.11Å; T378-R382 HydrophobicContact CG2-CG 4.46Å; T378-R382 VanDerWaalsContact CG2-CZ 3.49Å; T378-R382 WeakPolarHBondContact O-CG 3.28Å; T378-R382 PolarHBondContact O-N 3.29Å; A379-R382 PolarHBondContact O-N 2.94Å; R382-L384 VanDerWaalsContact C-N 3.32Å; R382-L384 PolarHBondContact O-N 3.4Å; R382-Q385 PolarHBondContact O-N 2.93Å
383	V	95.2	Very high	96.2	Very high	125 Å²	125	41.1 Å²	41.1	76%	0.758	20%	0.197	S	C	*	.	H	α-helix	trans	-62.1	-39.8	176.9	169.5	0	0	0	0	111.5	A379 R380 Q385	A379-V383 WeakPolarHBondContact O-CG2 3.45Å; A379-V383 PolarHBondContact O-N 3Å; R380-V383 PolarHBondContact O-N 3.42Å; V383-Q385 PolarHBondContact O-N 3.5Å
384	L	94.7	Very high	96.3	Very high	24 Å²	24	38.7 Å²	38.7	13%	0.126	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.7	-10.7	173	-73.4	173	0	0	0	113.9	R380 L381 R382 V386 K438 Q441 L442 Q445	R380-L384 WeakPolarHBondContact O-CG 3.22Å; R380-L384 PolarHBondContact O-N 3.14Å; L381-L384 HydrophobicContact CD2-CD1 4.5Å; R382-L384 VanDerWaalsContact C-N 3.32Å; R382-L384 PolarHBondContact O-N 3.4Å; L384-V386 HydrophobicContact CB-CG2 3.75Å; L384-K438 WeakPolarHBondContact O-CE 3.4Å; L384-K438 PolarHBondContact O-NZ 2.84Å; L384-Q441 HydrophobicContact CD1-CB 4.44Å; L384-Q441 HydrophobicContact CD2-CB 3.79Å; L384-L442 HydrophobicContact CD1-CD1 4.48Å; L384-Q445 HydrophobicContact CD1-CG 4.27Å
385	Q	95	Very high	96.4	Very high	123 Å²	123	38.6 Å²	38.6	58%	0.575	18%	0.184	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.6	54.7	-173	-55.6	-176.8	7.3	0	0	111.7	L381 R382 V383 K438	L381-Q385 PolarHBondContact O-N 2.96Å; R382-Q385 PolarHBondContact O-N 2.93Å; V383-Q385 PolarHBondContact O-N 3.5Å; Q385-K438 PolarHBondContact O-NZ 3.32Å
386	V	95.9	Very high	96.5	Very high	10 Å²	10	37 Å²	37	6%	0.061	18%	0.177	C	C	.	.			trans	-72.5	128.7	-178.5	179.5	0	0	0	0	111.3	L381 L384 E390 M391 L442	L381-V386 HydrophobicContact CB-CB 4.48Å; L381-V386 HydrophobicContact CB-CG2 4.17Å; L381-V386 HydrophobicContact CD2-CG2 3.8Å; L381-V386 WeakPolarHBondContact O-CG2 3.36Å; L381-V386 PolarHBondContact O-N 2.92Å; L381-V386 VanDerWaalsContact O-N 3.14Å; L384-V386 HydrophobicContact CB-CG2 3.75Å; V386-E390 VanDerWaalsContact CA-OE2 3.31Å; V386-E390 WeakPolarHBondContact CA-OE2 3.45Å; V386-E390 HydrophobicContact CG1-CB 4.13Å; V386-M391 HydrophobicContact CG1-CE 3.82Å; V386-L442 HydrophobicContact CG1-CD1 4.16Å; V386-L442 HydrophobicContact CG2-CD1 3.51Å
387	D	95.1	Very high	96.6	Very high	16 Å²	16	33.5 Å²	33.5	9%	0.086	16%	0.161	C	C	.	.			trans	-107.7	177.6	-173.4	75.5	53.1	0	0	0	114.5	R389 E390 M391 Y427 Y432	D387-R389 VanDerWaalsContact CG-NE 3.26Å; D387-R389 PolarHBondContact O-N 3.28Å; D387-R389 VanDerWaalsContact OD1-CA 3.31Å; D387-R389 WeakPolarHBondContact OD1-CA 3.43Å; D387-R389 WeakPolarHBondContact OD1-CB 3.47Å; D387-R389 IonicContact OD1-CZ 3.71Å; D387-R389 PolarHBondContact OD1-N 2.91Å; D387-R389 IonicContact OD1-NE 2.7Å; D387-R389 PolarHBondContact OD1-NE 3.11Å; D387-R389 IonicContact OD1-NH2 3.33Å; D387-R389 IonicContact OD2-CZ 2.69Å; D387-R389 IonicContact OD2-NE 3.4Å; D387-R389 PolarHBondContact OD2-NE 3.02Å; D387-R389 IonicContact OD2-NH2 3.69Å; D387-R389 PolarHBondContact OD2-NH2 2.8Å; D387-E390 PolarHBondContact N-OE2 3.36Å; D387-E390 PolarHBondContact O-N 3.5Å; D387-E390 PolarHBondContact OD1-N 3.33Å; D387-M391 VanDerWaalsContact O-CB 3.29Å; D387-M391 WeakPolarHBondContact O-CB 3.46Å; D387-M391 PolarHBondContact O-N 3.01Å; D387-Y427 WeakPolarHBondContact OD2-CE1 3.37Å; D387-Y427 PolarHBondContact OD2-OH 3.13Å; D387-Y432 PolarHBondContact OD2-OH 2.68Å
388	R	95.6	Very high	96.6	Very high	86 Å²	86	33.3 Å²	33.3	33%	0.325	16%	0.16	S	C	.	.	H	α-helix	trans	-67.8	-28.7	-178.3	-68.9	-169.5	174.4	-127.3	-9.1	114.1	L252 E258 F335 Q339 A392	L252-R388 HydrophobicContact CD1-CB 4.29Å; E258-R388 IonicContact OE2-CZ 2.75Å; E258-R388 IonicContact OE2-NH2 2.73Å; E258-R388 PolarHBondContact OE2-NH2 3.31Å; F335-R388 HydrophobicContact CE1-CG 3.87Å; F335-R388 HydrophobicContact CZ-CB 4.31Å; F335-R388 HydrophobicContact CZ-CG 3.69Å; Q339-R388 VanDerWaalsContact OE1-CZ 3.23Å; R388-A392 WeakPolarHBondContact O-CB 3.44Å; R388-A392 PolarHBondContact O-N 3.44Å
389	R	95.8	Very high	96.6	Very high	75 Å²	75	33.2 Å²	33.2	28%	0.283	16%	0.16	S	C	.	.	H	α-helix	trans	-71.3	-48	175.9	-65.8	73.4	60	172.3	2.4	109.8	L244 V248 L252 D387 A392 C393 Y427	L244-R389 HydrophobicContact CD2-CG 4.11Å; V248-R389 HydrophobicContact CG1-CB 3.66Å; V248-R389 HydrophobicContact CG1-CG 3.95Å; L252-R389 HydrophobicContact CD2-CG 4.33Å; D387-R389 VanDerWaalsContact CG-NE 3.26Å; D387-R389 PolarHBondContact O-N 3.28Å; D387-R389 VanDerWaalsContact OD1-CA 3.31Å; D387-R389 WeakPolarHBondContact OD1-CA 3.43Å; D387-R389 WeakPolarHBondContact OD1-CB 3.47Å; D387-R389 IonicContact OD1-CZ 3.71Å; D387-R389 PolarHBondContact OD1-N 2.91Å; D387-R389 IonicContact OD1-NE 2.7Å; D387-R389 PolarHBondContact OD1-NE 3.11Å; D387-R389 IonicContact OD1-NH2 3.33Å; D387-R389 IonicContact OD2-CZ 2.69Å; D387-R389 IonicContact OD2-NE 3.4Å; D387-R389 PolarHBondContact OD2-NE 3.02Å; D387-R389 IonicContact OD2-NH2 3.69Å; D387-R389 PolarHBondContact OD2-NH2 2.8Å; R389-A392 PolarHBondContact O-N 3.01Å; R389-C393 PolarHBondContact O-N 3.39Å; R389-C393 VanDerWaalsContact O-N 3.13Å; R389-C393 PolarHBondContact O-SG 3.02Å; R389-Y427 HydrophobicContact CB-CD1 4.32Å; R389-Y427 HydrophobicContact CB-CE1 3.9Å; R389-Y427 HydrophobicContact CB-CE2 4.34Å; R389-Y427 HydrophobicContact CG-CE2 4.22Å; R389-Y427 VanDerWaalsContact CZ-OH 3.28Å; R389-Y427 PolarHBondContact NE-OH 2.96Å; R389-Y427 PolarHBondContact NH2-OH 3.25Å
390	E	96.5	Very high	96.7	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-62.4	-45.2	177.7	-64.1	171.8	149.6	0	0	110.6	V386 D387 A392 C393 L394 L424 Y427 I428 Y432 K438 L442	V386-E390 VanDerWaalsContact CA-OE2 3.31Å; V386-E390 WeakPolarHBondContact CA-OE2 3.45Å; V386-E390 HydrophobicContact CG1-CB 4.13Å; D387-E390 PolarHBondContact N-OE2 3.36Å; D387-E390 PolarHBondContact O-N 3.5Å; D387-E390 PolarHBondContact OD1-N 3.33Å; E390-A392 PolarHBondContact O-N 3.4Å; E390-C393 WeakPolarHBondContact O-CB 3.33Å; E390-C393 PolarHBondContact O-N 3.13Å; E390-L394 WeakPolarHBondContact O-CG 3.46Å; E390-L394 PolarHBondContact O-N 2.78Å; E390-L424 HydrophobicContact CB-CD1 4.21Å; E390-L424 HydrophobicContact CG-CD1 4.04Å; E390-Y427 HydrophobicContact CG-CD1 3.99Å; E390-Y427 HydrophobicContact CG-CE1 3.67Å; E390-I428 HydrophobicContact CG-CG1 4.42Å; E390-I428 WeakPolarHBondContact OE1-CG1 3.46Å; E390-Y432 WeakPolarHBondContact OE1-CE2 3.44Å; E390-K438 WeakPolarHBondContact OE1-CD 3.5Å; E390-K438 WeakPolarHBondContact OE1-CE 3.05Å; E390-K438 IonicContact OE1-NZ 3.87Å; E390-K438 PolarHBondContact OE1-NZ 3.12Å; E390-K438 WeakPolarHBondContact OE2-CE 3.14Å; E390-K438 IonicContact OE2-NZ 3.59Å; E390-K438 PolarHBondContact OE2-NZ 3.3Å; E390-L442 HydrophobicContact CB-CD2 4.18Å
391	M	97	Very high	96.6	Very high	2 Å²	2	27.6 Å²	27.6	1%	0.01	13%	0.129	C	C	.	.	H	α-helix	trans	-62.2	-43.1	177	-170.9	55.7	50.9	0	0	113	L331 F335 V386 D387 C393 L394 K395	L331-M391 HydrophobicContact CD1-CE 3.81Å; L331-M391 HydrophobicContact CD1-SD 3.44Å; L331-M391 WeakPolarHBondContact CD1-SD 3.22Å; L331-M391 HydrophobicContact CD2-SD 3.58Å; L331-M391 VanDerWaalsContact CD2-SD 3.58Å; L331-M391 HydrophobicContact CG-CE 4.41Å; L331-M391 HydrophobicContact CG-SD 3.38Å; L331-M391 WeakPolarHBondContact CG-SD 3.42Å; F335-M391 HydrophobicContact CB-CE 3.99Å; F335-M391 HydrophobicContact CB-CG 4.21Å; F335-M391 HydrophobicContact CB-SD 4.18Å; F335-M391 HydrophobicContact CD1-CB 4.05Å; F335-M391 HydrophobicContact CD1-CG 3.5Å; F335-M391 VanDerWaalsContact CD1-CG 3.5Å; F335-M391 HydrophobicContact CD2-CB 4.28Å; F335-M391 HydrophobicContact CD2-CE 3.63Å; F335-M391 HydrophobicContact CD2-CG 4.11Å; F335-M391 HydrophobicContact CE1-CB 3.72Å; F335-M391 HydrophobicContact CE1-CG 3.69Å; F335-M391 HydrophobicContact CE2-CB 4.02Å; F335-M391 HydrophobicContact CE2-CE 4.22Å; F335-M391 HydrophobicContact CE2-CG 4.32Å; F335-M391 HydrophobicContact CG-CB 4.29Å; F335-M391 HydrophobicContact CG-CE 3.86Å; F335-M391 HydrophobicContact CG-CG 3.69Å; F335-M391 HydrophobicContact CG-SD 4.19Å; F335-M391 HydrophobicContact CZ-CB 3.72Å; F335-M391 HydrophobicContact CZ-CG 4.12Å; V386-M391 HydrophobicContact CG1-CE 3.82Å; D387-M391 VanDerWaalsContact O-CB 3.29Å; D387-M391 WeakPolarHBondContact O-CB 3.46Å; D387-M391 PolarHBondContact O-N 3.01Å; M391-C393 VanDerWaalsContact C-N 3.28Å; M391-C393 PolarHBondContact O-N 2.85Å; M391-L394 HydrophobicContact CE-CD1 4.27Å; M391-L394 PolarHBondContact O-N 3.22Å; M391-L394 HydrophobicContact SD-CB 4.46Å; M391-K395 HydrophobicContact CG-CD 4.33Å; M391-K395 WeakPolarHBondContact O-CG 3.47Å; M391-K395 PolarHBondContact O-N 3.24Å
392	A	96.7	Very high	96.6	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-56.9	-45.1	174.3	0	0	0	0	0	110.8	L252 R388 R389 E390 L394 K395 F396	L252-A392 HydrophobicContact CD1-CB 4.45Å; R388-A392 WeakPolarHBondContact O-CB 3.44Å; R388-A392 PolarHBondContact O-N 3.44Å; R389-A392 PolarHBondContact O-N 3.01Å; E390-A392 PolarHBondContact O-N 3.4Å; A392-L394 PolarHBondContact O-N 3.07Å; A392-K395 PolarHBondContact O-N 3.01Å; A392-F396 WeakPolarHBondContact O-CD2 3.3Å; A392-F396 PolarHBondContact O-N 2.91Å; A392-F396 VanDerWaalsContact O-N 3.15Å
393	C	97.4	Very high	96.4	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-60.8	-45.5	175.3	-59.6	0	0	0	0	112	R389 E390 M391 K395 F396 L397 V420 L424	R389-C393 PolarHBondContact O-N 3.39Å; R389-C393 VanDerWaalsContact O-N 3.13Å; R389-C393 PolarHBondContact O-SG 3.02Å; E390-C393 WeakPolarHBondContact O-CB 3.33Å; E390-C393 PolarHBondContact O-N 3.13Å; M391-C393 VanDerWaalsContact C-N 3.28Å; M391-C393 PolarHBondContact O-N 2.85Å; C393-K395 PolarHBondContact O-N 3Å; C393-F396 PolarHBondContact O-N 3.23Å; C393-F396 VanDerWaalsContact O-N 3.1Å; C393-L397 WeakPolarHBondContact O-CG 3.28Å; C393-L397 PolarHBondContact O-N 2.66Å; C393-V420 HydrophobicContact CB-CG1 4.02Å; C393-L424 HydrophobicContact CB-CB 4.02Å; C393-L424 HydrophobicContact CB-CD1 3.89Å; C393-L424 HydrophobicContact CB-CD2 3.96Å; C393-L424 HydrophobicContact CB-CG 4.17Å
394	L	97.9	Very high	96.4	Very high	3 Å²	3	24.6 Å²	24.6	2%	0.016	12%	0.116	C	C	.	.	H	α-helix	trans	-59.7	-42.4	176.7	-65.6	-168.2	0	0	0	112.6	L331 E390 M391 A392 F396 L397 L398 L424 L442 L446	L331-L394 HydrophobicContact CD2-CB 4.11Å; E390-L394 WeakPolarHBondContact O-CG 3.46Å; E390-L394 PolarHBondContact O-N 2.78Å; M391-L394 HydrophobicContact CE-CD1 4.27Å; M391-L394 PolarHBondContact O-N 3.22Å; M391-L394 HydrophobicContact SD-CB 4.46Å; A392-L394 PolarHBondContact O-N 3.07Å; L394-F396 VanDerWaalsContact C-N 3.25Å; L394-F396 PolarHBondContact O-N 2.77Å; L394-L397 HydrophobicContact CD2-CD1 4.17Å; L394-L397 PolarHBondContact O-N 2.99Å; L394-L398 WeakPolarHBondContact O-CG 3.33Å; L394-L398 PolarHBondContact O-N 3.13Å; L394-L424 HydrophobicContact CD2-CD2 4.21Å; L394-L442 HydrophobicContact CD1-CD1 3.93Å; L394-L442 HydrophobicContact CD1-CD2 4.45Å; L394-L442 HydrophobicContact CD1-CG 4.12Å; L394-L442 HydrophobicContact CD2-CD2 4.2Å; L394-L442 HydrophobicContact CD2-CG 4.17Å; L394-L442 HydrophobicContact CG-CD2 4.45Å; L394-L446 HydrophobicContact CD1-CD2 4.45Å; L394-L446 HydrophobicContact CD2-CD1 4.46Å; L394-L446 HydrophobicContact CD2-CD2 4.31Å
395	K	97.9	Very high	96.2	Very high	8 Å²	8	30.1 Å²	30.1	4%	0.035	14%	0.139	C	C	.	.	H	α-helix	trans	-58.5	-38.9	175.1	-68.8	171.3	69.8	161.7	0	111.2	D255 W302 L328 L331 D332 M391 A392 C393 L398 L399	D255-K395 IonicContact OD1-NZ 2.76Å; D255-K395 PolarHBondContact OD1-NZ 3.35Å; W302-K395 HydrophobicContact CH2-CB 3.75Å; W302-K395 HydrophobicContact CZ2-CB 3.67Å; L328-K395 HydrophobicContact CD2-CB 3.91Å; L328-K395 HydrophobicContact CD2-CG 4.04Å; L331-K395 HydrophobicContact CD2-CG 3.88Å; D332-K395 WeakPolarHBondContact OD1-CD 3.48Å; D332-K395 VanDerWaalsContact OD1-CE 3.25Å; D332-K395 WeakPolarHBondContact OD1-CE 3.48Å; D332-K395 IonicContact OD1-NZ 2.86Å; D332-K395 PolarHBondContact OD1-NZ 3.44Å; D332-K395 IonicContact OD2-NZ 2.93Å; D332-K395 PolarHBondContact OD2-NZ 3.12Å; M391-K395 HydrophobicContact CG-CD 4.33Å; M391-K395 WeakPolarHBondContact O-CG 3.47Å; M391-K395 PolarHBondContact O-N 3.24Å; A392-K395 PolarHBondContact O-N 3.01Å; C393-K395 PolarHBondContact O-N 3Å; K395-L398 PolarHBondContact O-N 3.21Å; K395-L399 WeakPolarHBondContact O-CB 3.48Å; K395-L399 PolarHBondContact O-N 3.05Å
396	F	98	Very high	96.1	Very high	1 Å²	1	31.5 Å²	31.5	0%	0.004	15%	0.15	C	C	.	.	H	α-helix	trans	-73.8	-35.7	175.5	-76.5	-65.4	0	0	0	114.3	L251 C254 W302 C306 A392 C393 L394 L398 L399 F400 V420	L251-F396 HydrophobicContact CB-CD2 3.71Å; L251-F396 HydrophobicContact CB-CE2 3.67Å; L251-F396 HydrophobicContact CD1-CB 4.39Å; L251-F396 HydrophobicContact CD1-CD2 3.85Å; L251-F396 HydrophobicContact CD1-CG 4.36Å; L251-F396 HydrophobicContact CD2-CD1 4.44Å; L251-F396 HydrophobicContact CD2-CD2 3.57Å; L251-F396 HydrophobicContact CD2-CE2 3.72Å; L251-F396 HydrophobicContact CD2-CG 3.96Å; L251-F396 HydrophobicContact CD2-CZ 4.23Å; L251-F396 HydrophobicContact CG-CD2 3.86Å; L251-F396 HydrophobicContact CG-CE2 4.14Å; C254-F396 HydrophobicContact CB-CE2 4.42Å; C254-F396 HydrophobicContact CB-CZ 3.99Å; W302-F396 AromaticContact CE2-CZ 3.83Å; W302-F396 HydrophobicContact CH2-CD1 4.06Å; W302-F396 AromaticContact CH2-CE1 3.97Å; W302-F396 HydrophobicContact CH2-CE1 3.97Å; W302-F396 HydrophobicContact CH2-CG 4.46Å; W302-F396 HydrophobicContact CH2-CZ 4.29Å; W302-F396 AromaticContact CZ2-CD1 3.93Å; W302-F396 HydrophobicContact CZ2-CD1 3.93Å; W302-F396 HydrophobicContact CZ2-CD2 4.01Å; W302-F396 AromaticContact CZ2-CE1 3.57Å; W302-F396 HydrophobicContact CZ2-CE1 3.57Å; W302-F396 AromaticContact CZ2-CE2 3.66Å; W302-F396 HydrophobicContact CZ2-CE2 3.66Å; W302-F396 HydrophobicContact CZ2-CG 4.14Å; W302-F396 AromaticContact CZ2-CZ 3.44Å; W302-F396 HydrophobicContact CZ2-CZ 3.44Å; W302-F396 VanDerWaalsContact CZ2-CZ 3.44Å; W302-F396 AromaticContact NE1-CZ 3.95Å; C306-F396 HydrophobicContact CB-CE1 3.78Å; C306-F396 HydrophobicContact CB-CZ 4.11Å; C306-F396 WeakPolarHBondContact SG-CE1 3.33Å; A392-F396 WeakPolarHBondContact O-CD2 3.3Å; A392-F396 PolarHBondContact O-N 2.91Å; A392-F396 VanDerWaalsContact O-N 3.15Å; C393-F396 PolarHBondContact O-N 3.23Å; C393-F396 VanDerWaalsContact O-N 3.1Å; L394-F396 VanDerWaalsContact C-N 3.25Å; L394-F396 PolarHBondContact O-N 2.77Å; F396-L398 VanDerWaalsContact C-N 3.26Å; F396-L398 PolarHBondContact O-N 3.13Å; F396-L399 HydrophobicContact CD1-CD2 4.2Å; F396-L399 HydrophobicContact CE1-CD2 4.22Å; F396-L399 PolarHBondContact O-N 2.73Å; F396-F400 HydrophobicContact CD1-CD2 4.08Å; F396-F400 AromaticContact CD1-CE2 3.8Å; F396-F400 HydrophobicContact CD1-CE2 3.8Å; F396-F400 HydrophobicContact CE1-CE2 4.32Å; F396-F400 PolarHBondContact O-N 3.41Å; F396-V420 HydrophobicContact CB-CG1 4.15Å; F396-V420 HydrophobicContact CB-CG2 4.2Å
397	L	97.5	Very high	96	Very high	8 Å²	8	32 Å²	32	4%	0.042	15%	0.152	C	C	.	.	H	α-helix	trans	-63.9	-30.1	172	-66.7	178	0	0	0	112.8	C393 L394 Q417 V420 N421 L424	C393-L397 WeakPolarHBondContact O-CG 3.28Å; C393-L397 PolarHBondContact O-N 2.66Å; L394-L397 HydrophobicContact CD2-CD1 4.17Å; L394-L397 PolarHBondContact O-N 2.99Å; L397-Q417 HydrophobicContact CD2-CG 3.88Å; L397-V420 HydrophobicContact CD2-CB 3.87Å; L397-V420 HydrophobicContact CD2-CG1 3.69Å; L397-V420 HydrophobicContact CG-CG1 3.78Å; L397-N421 WeakPolarHBondContact CD2-ND2 3.29Å; L397-L424 HydrophobicContact CD1-CD2 4.15Å
398	L	97.8	Very high	96	Very high	0 Å²	0	36.2 Å²	36.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-76.3	-42.5	172.9	-68.2	173.9	0	0	0	112.6	C324 E327 L328 L331 L394 K395 F396 L446 L449	C324-L398 VanDerWaalsContact CB-O 3.26Å; C324-L398 WeakPolarHBondContact CB-O 3.5Å; E327-L398 HydrophobicContact CB-CD1 4.13Å; E327-L398 HydrophobicContact CB-CD2 4.21Å; E327-L398 WeakPolarHBondContact OE2-CD2 3.43Å; L328-L398 HydrophobicContact CD2-CB 4.08Å; L328-L398 HydrophobicContact CD2-CD1 4.09Å; L331-L398 HydrophobicContact CD2-CD1 3.52Å; L394-L398 WeakPolarHBondContact O-CG 3.33Å; L394-L398 PolarHBondContact O-N 3.13Å; K395-L398 PolarHBondContact O-N 3.21Å; F396-L398 VanDerWaalsContact C-N 3.26Å; F396-L398 PolarHBondContact O-N 3.13Å; L398-L446 HydrophobicContact CD2-CD2 4.23Å; L398-L446 HydrophobicContact CG-CD2 4.49Å; L398-L449 HydrophobicContact CD1-CD2 3.69Å; L398-L449 HydrophobicContact CD2-CD2 4.36Å
399	L	98	Very high	96.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-65.7	-48.4	178.8	-179.8	63.6	0	0	0	111.8	W302 A303 F309 L320 L321 K395 F396 N401	W302-L399 HydrophobicContact CH2-CB 4.15Å; W302-L399 HydrophobicContact CH2-CD2 3.89Å; W302-L399 HydrophobicContact CZ3-CB 4.31Å; W302-L399 HydrophobicContact CZ3-CD2 3.81Å; W302-L399 HydrophobicContact CZ3-CG 4.48Å; A303-L399 HydrophobicContact CB-CD1 4.36Å; A303-L399 HydrophobicContact CB-CD2 4.05Å; F309-L399 HydrophobicContact CD2-CD1 4.32Å; F309-L399 HydrophobicContact CD2-CD2 3.98Å; F309-L399 HydrophobicContact CD2-CG 4.34Å; F309-L399 HydrophobicContact CE2-CD1 3.95Å; F309-L399 HydrophobicContact CE2-CD2 4.41Å; F309-L399 HydrophobicContact CE2-CG 4.46Å; L320-L399 HydrophobicContact CB-CD1 4.43Å; L321-L399 HydrophobicContact CD2-CD1 4Å; L321-L399 HydrophobicContact CG-CD1 4.46Å; K395-L399 WeakPolarHBondContact O-CB 3.48Å; K395-L399 PolarHBondContact O-N 3.05Å; F396-L399 HydrophobicContact CD1-CD2 4.2Å; F396-L399 HydrophobicContact CE1-CD2 4.22Å; F396-L399 PolarHBondContact O-N 2.73Å; L399-N401 VanDerWaalsContact C-N 3.32Å; L399-N401 PolarHBondContact O-N 3.13Å
400	F	97.9	Very high	96.1	Very high	1 Å²	1	36.7 Å²	36.7	0%	0.004	18%	0.183	C	C	.	.	S	Bend	trans	-91	66.1	179.3	-67.8	-79.2	0	0	0	110.6	F308 F309 L312 L320 F396 P402 F412 V413 V416 Q417	F308-F400 HydrophobicContact CB-CE1 4.12Å; F308-F400 HydrophobicContact CB-CE2 4.3Å; F308-F400 HydrophobicContact CB-CZ 3.66Å; F309-F400 HydrophobicContact CB-CZ 4.11Å; F309-F400 HydrophobicContact CD2-CZ 4.27Å; L312-F400 HydrophobicContact CD1-CD1 4.45Å; L312-F400 HydrophobicContact CD1-CE1 3.82Å; L320-F400 HydrophobicContact CD1-CD1 4.09Å; L320-F400 HydrophobicContact CD1-CE1 4.31Å; F396-F400 HydrophobicContact CD1-CD2 4.08Å; F396-F400 AromaticContact CD1-CE2 3.8Å; F396-F400 HydrophobicContact CD1-CE2 3.8Å; F396-F400 HydrophobicContact CE1-CE2 4.32Å; F396-F400 PolarHBondContact O-N 3.41Å; F400-P402 WeakPolarHBondContact O-CD 3.42Å; F400-F412 HydrophobicContact CE1-CE1 4.49Å; F400-V413 HydrophobicContact CB-CG1 4.02Å; F400-V413 HydrophobicContact CD1-CG1 4.32Å; F400-V416 HydrophobicContact CB-CG1 4.08Å; F400-V416 HydrophobicContact CD1-CB 4.23Å; F400-V416 HydrophobicContact CD1-CG1 3.9Å; F400-V416 HydrophobicContact CD2-CG1 3.65Å; F400-V416 HydrophobicContact CE1-CG1 4.25Å; F400-V416 HydrophobicContact CE2-CG1 4.02Å; F400-V416 HydrophobicContact CG-CB 4.27Å; F400-V416 HydrophobicContact CG-CG1 3.59Å; F400-V416 HydrophobicContact CZ-CG1 4.33Å; F400-Q417 PolarHBondContact O-NE2 2.82Å
401	N	96.1	Very high	96.2	Very high	11 Å²	11	40 Å²	40	6%	0.059	21%	0.21	C	C	.	.			trans	-90.8	110.2	175	-178.7	15.3	0	0	0	110.8	N323 L399 N403 V404	N323-N401 PolarHBondContact OD1-ND2 3.36Å; L399-N401 VanDerWaalsContact C-N 3.32Å; L399-N401 PolarHBondContact O-N 3.13Å; N401-N403 VanDerWaalsContact C-N 3.25Å; N401-N403 PolarHBondContact O-N 3.16Å; N401-N403 WeakPolarHBondContact OD1-CB 3.4Å; N401-N403 PolarHBondContact OD1-N 2.96Å; N401-N403 PolarHBondContact OD1-ND2 2.9Å; N401-V404 HydrophobicContact CB-CG2 4.07Å; N401-V404 VanDerWaalsContact O-CG2 3.27Å; N401-V404 WeakPolarHBondContact O-CG2 3.31Å; N401-V404 PolarHBondContact O-N 2.89Å
402	P	95.4	Very high	96.2	Very high	11 Å²	11	42 Å²	42	7%	0.071	22%	0.218	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-17.2	-177.7	31.2	-37	0	0	0	113.3	F400 V404 Q410 V413 E414	F400-P402 WeakPolarHBondContact O-CD 3.42Å; P402-V404 PolarHBondContact O-N 3.35Å; P402-V404 VanDerWaalsContact O-N 3.08Å; P402-Q410 HydrophobicContact CB-CG 4.35Å; P402-V413 HydrophobicContact CB-CG1 4.21Å; P402-E414 HydrophobicContact CB-CB 4.43Å; P402-E414 HydrophobicContact CB-CG 3.31Å; P402-E414 HydrophobicContact CG-CG 3.98Å
403	N	93.8	Very high	96.3	Very high	127 Å²	127	42 Å²	42	68%	0.679	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	-71.8	2.5	177.2	-54.4	-86.2	0	0	0	113.3	N401 K405	N401-N403 VanDerWaalsContact C-N 3.25Å; N401-N403 PolarHBondContact O-N 3.16Å; N401-N403 WeakPolarHBondContact OD1-CB 3.4Å; N401-N403 PolarHBondContact OD1-N 2.96Å; N401-N403 PolarHBondContact OD1-ND2 2.9Å; N403-K405 PolarHBondContact O-N 3.5Å
404	V	94.3	Very high	96.3	Very high	11 Å²	11	45.5 Å²	45.5	7%	0.067	24%	0.235	C	C	.	.	S	Bend	trans	-72.8	118.1	177.4	172.2	0	0	0	0	109.8	K319 L320 N323 N401 P402 L407	K319-V404 HydrophobicContact CB-CG1 3.81Å; L320-V404 HydrophobicContact CD2-CB 4.22Å; L320-V404 HydrophobicContact CD2-CG1 4.49Å; L320-V404 HydrophobicContact CD2-CG2 4.05Å; N323-V404 HydrophobicContact CB-CG2 3.6Å; N323-V404 VanDerWaalsContact CG-CG2 3.48Å; N323-V404 WeakPolarHBondContact OD1-CG2 3.39Å; N401-V404 HydrophobicContact CB-CG2 4.07Å; N401-V404 VanDerWaalsContact O-CG2 3.27Å; N401-V404 WeakPolarHBondContact O-CG2 3.31Å; N401-V404 PolarHBondContact O-N 2.89Å; P402-V404 PolarHBondContact O-N 3.35Å; P402-V404 VanDerWaalsContact O-N 3.08Å; V404-L407 HydrophobicContact CB-CD1 4.04Å; V404-L407 HydrophobicContact CB-CG 4.14Å; V404-L407 HydrophobicContact CG1-CD2 4.25Å; V404-L407 HydrophobicContact CG1-CG 4.17Å; V404-L407 WeakPolarHBondContact O-CG 3.44Å
405	K	91.3	Very high	96.3	Very high	139 Å²	139	46.4 Å²	46.4	60%	0.604	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.5	140.6	-178	-57	179	-173.8	180	0	111.4	N403 L407 V486	N403-K405 PolarHBondContact O-N 3.5Å; K405-L407 VanDerWaalsContact C-N 3.34Å; K405-L407 PolarHBondContact O-N 3.37Å; K405-V486 PolarHBondContact NZ-O 3.43Å
406	L	91.7	Very high	96.3	Very high	153 Å²	153	46.1 Å²	46.1	80%	0.801	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.8	27.8	170.9	-49.8	174.1	0	0	0	115.4	K319	K319-L406 WeakPolarHBondContact CD-O 3.38Å; K319-L406 VanDerWaalsContact CE-O 3.3Å; K319-L406 WeakPolarHBondContact CE-O 3.4Å; K319-L406 PolarHBondContact NZ-O 3.22Å
407	L	94.6	Very high	96.3	Very high	20 Å²	20	48.4 Å²	48.4	11%	0.105	25%	0.254	C	S	.	.			trans	-57.9	141.8	163.8	-72.1	170.1	0	0	0	110.7	D316 K319 L320 V404 K405 Q410 V413	D316-L407 HydrophobicContact CB-CD2 3.85Å; D316-L407 WeakPolarHBondContact OD1-CA 3.33Å; K319-L407 HydrophobicContact CB-CD2 4.27Å; K319-L407 HydrophobicContact CD-CD2 4.36Å; L320-L407 HydrophobicContact CD2-CD1 4.26Å; L320-L407 HydrophobicContact CD2-CD2 3.9Å; L320-L407 HydrophobicContact CG-CD2 4.13Å; V404-L407 HydrophobicContact CB-CD1 4.04Å; V404-L407 HydrophobicContact CB-CG 4.14Å; V404-L407 HydrophobicContact CG1-CD2 4.25Å; V404-L407 HydrophobicContact CG1-CG 4.17Å; V404-L407 WeakPolarHBondContact O-CG 3.44Å; K405-L407 VanDerWaalsContact C-N 3.34Å; K405-L407 PolarHBondContact O-N 3.37Å; L407-Q410 HydrophobicContact CB-CB 4.21Å; L407-Q410 HydrophobicContact CD1-CB 4.48Å; L407-Q410 HydrophobicContact CD1-CG 4.43Å; L407-V413 HydrophobicContact CD1-CB 4.28Å; L407-V413 HydrophobicContact CD1-CG1 4.38Å; L407-V413 HydrophobicContact CD1-CG2 4.04Å
408	E	95.8	Very high	96.2	Very high	104 Å²	104	54.9 Å²	54.9	49%	0.486	29%	0.285	S	S	.	.	S	Bend	trans	-82.7	-30.7	174.8	-71.5	165.8	-122.8	0	0	111.6	R313 D316 K319	R313-E408 WeakPolarHBondContact CD-OE2 3.31Å; R313-E408 IonicContact CZ-OE2 3.67Å; R313-E408 IonicContact NE-OE2 3.8Å; R313-E408 IonicContact NH1-OE2 2.81Å; R313-E408 PolarHBondContact NH1-OE2 3.34Å; D316-E408 VanDerWaalsContact CG-N 3.27Å; D316-E408 PolarHBondContact OD1-N 2.96Å; D316-E408 WeakPolarHBondContact OD2-CA 3.31Å; D316-E408 WeakPolarHBondContact OD2-CB 3.26Å; D316-E408 PolarHBondContact OD2-N 3.26Å; K319-E408 IonicContact NZ-OE1 2.62Å; K319-E408 PolarHBondContact NZ-OE1 3.44Å
409	N	95.8	Very high	96.2	Very high	79 Å²	79	59.7 Å²	59.7	42%	0.422	31%	0.307	S	S	.	.			trans	-129.1	65.4	176.2	-166.3	0.9	0	0	0	112	D316 A411 F412 V413	D316-N409 PolarHBondContact OD2-N 3.17Å; N409-A411 VanDerWaalsContact C-N 3.33Å; N409-A411 PolarHBondContact O-N 2.7Å; N409-F412 HydrophobicContact CB-CB 4.35Å; N409-F412 VanDerWaalsContact CG-CB 3.42Å; N409-F412 VanDerWaalsContact ND2-CB 3.3Å; N409-F412 WeakPolarHBondContact ND2-CB 3.46Å; N409-F412 PolarHBondContact O-N 3.23Å; N409-F412 WeakPolarHBondContact OD1-CB 3.44Å; N409-F412 PolarHBondContact OD1-N 2.94Å; N409-V413 PolarHBondContact O-N 2.95Å
410	Q	97.3	Very high	96.1	Very high	93 Å²	93	59.7 Å²	59.7	44%	0.435	31%	0.307	S	S	.	.	H	α-helix	trans	-57.6	-43	178.8	-173.8	179.9	-38.2	0	0	112.3	P402 L407 F412 V413 E414	P402-Q410 HydrophobicContact CB-CG 4.35Å; L407-Q410 HydrophobicContact CB-CB 4.21Å; L407-Q410 HydrophobicContact CD1-CB 4.48Å; L407-Q410 HydrophobicContact CD1-CG 4.43Å; Q410-F412 VanDerWaalsContact C-N 3.27Å; Q410-F412 PolarHBondContact O-N 3.31Å; Q410-V413 WeakPolarHBondContact O-CA 3.36Å; Q410-V413 WeakPolarHBondContact O-CB 3.46Å; Q410-V413 PolarHBondContact O-N 3.45Å; Q410-E414 HydrophobicContact CG-CG 4.31Å; Q410-E414 PolarHBondContact NE2-OE1 3.38Å; Q410-E414 WeakPolarHBondContact O-CG 3.49Å; Q410-E414 PolarHBondContact O-N 2.84Å
411	A	97.4	Very high	96	Very high	68 Å²	68	61.7 Å²	61.7	56%	0.562	32%	0.318	S	S	*	.	H	α-helix	trans	-60.8	-31.5	-178.6	0	0	0	0	0	113.8	N409 G415	N409-A411 VanDerWaalsContact C-N 3.33Å; N409-A411 PolarHBondContact O-N 2.7Å; A411-G415 PolarHBondContact O-N 2.73Å
412	F	98.1	Very high	96	Very high	44 Å²	44	63 Å²	63	19%	0.193	33%	0.334	C	S	.	.	H	α-helix	trans	-69.2	-41	171.3	176.7	-87.1	0	0	0	111.9	F308 E311 L312 F400 N409 Q410 E414 G415 V416	F308-F412 HydrophobicContact CB-CE1 4.12Å; F308-F412 HydrophobicContact CB-CZ 3.96Å; F308-F412 HydrophobicContact CD1-CZ 4.39Å; F308-F412 WeakPolarHBondContact O-CE1 3.41Å; F308-F412 WeakPolarHBondContact O-CZ 3.43Å; E311-F412 HydrophobicContact CB-CE2 4.19Å; E311-F412 HydrophobicContact CB-CZ 3.79Å; E311-F412 HydrophobicContact CG-CZ 4.39Å; E311-F412 WeakPolarHBondContact OE2-CE2 3.48Å; L312-F412 HydrophobicContact CD2-CD1 3.65Å; L312-F412 HydrophobicContact CD2-CE1 4.04Å; L312-F412 HydrophobicContact CG-CD1 4.09Å; L312-F412 HydrophobicContact CG-CE1 3.95Å; F400-F412 HydrophobicContact CE1-CE1 4.49Å; N409-F412 HydrophobicContact CB-CB 4.35Å; N409-F412 VanDerWaalsContact CG-CB 3.42Å; N409-F412 VanDerWaalsContact ND2-CB 3.3Å; N409-F412 WeakPolarHBondContact ND2-CB 3.46Å; N409-F412 PolarHBondContact O-N 3.23Å; N409-F412 WeakPolarHBondContact OD1-CB 3.44Å; N409-F412 PolarHBondContact OD1-N 2.94Å; Q410-F412 VanDerWaalsContact C-N 3.27Å; Q410-F412 PolarHBondContact O-N 3.31Å; F412-E414 VanDerWaalsContact C-N 3.31Å; F412-E414 PolarHBondContact O-N 3Å; F412-G415 PolarHBondContact O-N 3.29Å; F412-V416 HydrophobicContact CD1-CG2 4.11Å; F412-V416 HydrophobicContact CE1-CG2 3.78Å; F412-V416 HydrophobicContact CE2-CG2 4.45Å; F412-V416 HydrophobicContact CZ-CG2 3.97Å; F412-V416 WeakPolarHBondContact O-CB 3.38Å; F412-V416 VanDerWaalsContact O-CG2 3.29Å; F412-V416 WeakPolarHBondContact O-CG2 3.48Å; F412-V416 PolarHBondContact O-N 2.99Å
413	V	98.1	Very high	96	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	33%	0.334	C	S	.	.	H	α-helix	trans	-64.9	-38.1	176.5	-179.5	0	0	0	0	110.9	L312 L320 F400 P402 L407 N409 Q410 Q417	L312-V413 HydrophobicContact CD1-CG2 4.37Å; L312-V413 HydrophobicContact CD2-CG2 4.26Å; L320-V413 HydrophobicContact CD1-CG2 4.21Å; L320-V413 HydrophobicContact CD2-CG1 4.28Å; F400-V413 HydrophobicContact CB-CG1 4.02Å; F400-V413 HydrophobicContact CD1-CG1 4.32Å; P402-V413 HydrophobicContact CB-CG1 4.21Å; L407-V413 HydrophobicContact CD1-CB 4.28Å; L407-V413 HydrophobicContact CD1-CG1 4.38Å; L407-V413 HydrophobicContact CD1-CG2 4.04Å; N409-V413 PolarHBondContact O-N 2.95Å; Q410-V413 WeakPolarHBondContact O-CA 3.36Å; Q410-V413 WeakPolarHBondContact O-CB 3.46Å; Q410-V413 PolarHBondContact O-N 3.45Å; V413-Q417 WeakPolarHBondContact O-CB 3.44Å; V413-Q417 PolarHBondContact O-N 3.32Å
414	E	97.8	Very high	96.1	Very high	75 Å²	75	56.9 Å²	56.9	35%	0.35	30%	0.302	S	S	.	.	H	α-helix	trans	-61.7	-54.4	172	-68.1	169.4	164	0	0	111	P402 Q410 F412 V416 Q417 E418	P402-E414 HydrophobicContact CB-CB 4.43Å; P402-E414 HydrophobicContact CB-CG 3.31Å; P402-E414 HydrophobicContact CG-CG 3.98Å; Q410-E414 HydrophobicContact CG-CG 4.31Å; Q410-E414 PolarHBondContact NE2-OE1 3.38Å; Q410-E414 WeakPolarHBondContact O-CG 3.49Å; Q410-E414 PolarHBondContact O-N 2.84Å; F412-E414 VanDerWaalsContact C-N 3.31Å; F412-E414 PolarHBondContact O-N 3Å; E414-V416 VanDerWaalsContact C-N 3.3Å; E414-V416 PolarHBondContact O-N 3.33Å; E414-Q417 WeakPolarHBondContact O-CA 3.46Å; E414-Q417 WeakPolarHBondContact O-CB 3.16Å; E414-Q417 PolarHBondContact O-N 3.43Å; E414-E418 PolarHBondContact O-N 3.42Å
415	G	98.1	Very high	96.1	Very high	22 Å²	22	59.5 Å²	59.5	23%	0.227	32%	0.315	C	S	.	.	H	α-helix	trans	-62.4	-30.5	179.5	0	0	0	0	0	114.4	A411 F412 Q419	A411-G415 PolarHBondContact O-N 2.73Å; F412-G415 PolarHBondContact O-N 3.29Å; G415-Q419 WeakPolarHBondContact O-CG 3.47Å; G415-Q419 PolarHBondContact O-N 2.86Å; G415-Q419 PolarHBondContact O-NE2 3.44Å
416	V	97.8	Very high	96.2	Very high	2 Å²	2	57.7 Å²	57.7	1%	0.012	31%	0.309	C	S	.	.	H	α-helix	trans	-71.1	-43.2	170.6	172.5	0	0	0	0	110.7	F308 F400 F412 E414 E418 Q419 V420	F308-V416 HydrophobicContact CB-CG1 4.28Å; F308-V416 HydrophobicContact CB-CG2 3.94Å; F308-V416 HydrophobicContact CD1-CG2 3.83Å; F308-V416 HydrophobicContact CD2-CG1 4.01Å; F308-V416 HydrophobicContact CG-CG1 4.07Å; F308-V416 HydrophobicContact CG-CG2 3.86Å; F400-V416 HydrophobicContact CB-CG1 4.08Å; F400-V416 HydrophobicContact CD1-CB 4.23Å; F400-V416 HydrophobicContact CD1-CG1 3.9Å; F400-V416 HydrophobicContact CD2-CG1 3.65Å; F400-V416 HydrophobicContact CE1-CG1 4.25Å; F400-V416 HydrophobicContact CE2-CG1 4.02Å; F400-V416 HydrophobicContact CG-CB 4.27Å; F400-V416 HydrophobicContact CG-CG1 3.59Å; F400-V416 HydrophobicContact CZ-CG1 4.33Å; F412-V416 HydrophobicContact CD1-CG2 4.11Å; F412-V416 HydrophobicContact CE1-CG2 3.78Å; F412-V416 HydrophobicContact CE2-CG2 4.45Å; F412-V416 HydrophobicContact CZ-CG2 3.97Å; F412-V416 WeakPolarHBondContact O-CB 3.38Å; F412-V416 VanDerWaalsContact O-CG2 3.29Å; F412-V416 WeakPolarHBondContact O-CG2 3.48Å; F412-V416 PolarHBondContact O-N 2.99Å; E414-V416 VanDerWaalsContact C-N 3.3Å; E414-V416 PolarHBondContact O-N 3.33Å; V416-E418 VanDerWaalsContact C-N 3.33Å; V416-E418 PolarHBondContact O-N 2.94Å; V416-Q419 PolarHBondContact O-N 2.95Å; V416-V420 HydrophobicContact CG1-CG2 4.37Å; V416-V420 WeakPolarHBondContact O-CG2 3.19Å; V416-V420 PolarHBondContact O-N 3.01Å
417	Q	96.8	Very high	96.3	Very high	48 Å²	48	50.6 Å²	50.6	22%	0.224	27%	0.271	C	S	.	.	H	α-helix	trans	-61.9	-39.1	176.5	-178.1	168.7	108.6	0	0	112.3	L397 F400 V413 E414 N421	L397-Q417 HydrophobicContact CD2-CG 3.88Å; F400-Q417 PolarHBondContact O-NE2 2.82Å; V413-Q417 WeakPolarHBondContact O-CB 3.44Å; V413-Q417 PolarHBondContact O-N 3.32Å; E414-Q417 WeakPolarHBondContact O-CA 3.46Å; E414-Q417 WeakPolarHBondContact O-CB 3.16Å; E414-Q417 PolarHBondContact O-N 3.43Å; Q417-N421 WeakPolarHBondContact O-CB 3.37Å; Q417-N421 PolarHBondContact O-N 3.42Å; Q417-N421 PolarHBondContact O-ND2 2.91Å
418	E	96.1	Very high	96.2	Very high	144 Å²	144	49.6 Å²	49.6	67%	0.673	27%	0.266	S	S	*	.	H	α-helix	trans	-62.7	-46.8	174.8	-72.3	-178.9	169	0	0	111.9	E414 V416 V420 N421 G422	E414-E418 PolarHBondContact O-N 3.42Å; V416-E418 VanDerWaalsContact C-N 3.33Å; V416-E418 PolarHBondContact O-N 2.94Å; E418-V420 PolarHBondContact O-N 2.87Å; E418-N421 PolarHBondContact O-N 3.44Å; E418-G422 PolarHBondContact O-N 2.8Å
419	Q	97.4	Very high	95.9	Very high	101 Å²	101	48.7 Å²	48.7	47%	0.472	26%	0.264	S	S	.	.	H	α-helix	trans	-60.4	-44.3	176.9	-76.5	170.5	88.8	0	0	112.4	L247 G415 V416 G422 A423	L247-Q419 HydrophobicContact CD2-CB 3.86Å; G415-Q419 WeakPolarHBondContact O-CG 3.47Å; G415-Q419 PolarHBondContact O-N 2.86Å; G415-Q419 PolarHBondContact O-NE2 3.44Å; V416-Q419 PolarHBondContact O-N 2.95Å; Q419-G422 PolarHBondContact O-N 3Å; Q419-A423 WeakPolarHBondContact O-CB 3.17Å; Q419-A423 PolarHBondContact O-N 2.76Å
420	V	96.9	Very high	95.7	Very high	1 Å²	1	47 Å²	47	1%	0.006	26%	0.258	C	S	.	.	H	α-helix	trans	-66.6	-39.8	178.4	178	0	0	0	0	111.3	L251 C393 F396 L397 V416 E418 L424	L251-V420 HydrophobicContact CD1-CG1 3.96Å; L251-V420 HydrophobicContact CD1-CG2 3.97Å; C393-V420 HydrophobicContact CB-CG1 4.02Å; F396-V420 HydrophobicContact CB-CG1 4.15Å; F396-V420 HydrophobicContact CB-CG2 4.2Å; L397-V420 HydrophobicContact CD2-CB 3.87Å; L397-V420 HydrophobicContact CD2-CG1 3.69Å; L397-V420 HydrophobicContact CG-CG1 3.78Å; V416-V420 HydrophobicContact CG1-CG2 4.37Å; V416-V420 WeakPolarHBondContact O-CG2 3.19Å; V416-V420 PolarHBondContact O-N 3.01Å; E418-V420 PolarHBondContact O-N 2.87Å; V420-L424 VanDerWaalsContact O-CB 3.24Å; V420-L424 WeakPolarHBondContact O-CB 3.39Å; V420-L424 PolarHBondContact O-N 3.19Å
421	N	95.9	Very high	95.4	Very high	43 Å²	43	44.7 Å²	44.7	23%	0.23	25%	0.251	C	S	.	.	H	α-helix	trans	-63.2	-46.1	173.9	-83.3	-64.3	0	0	0	111.9	L397 Q417 E418 L424 L425 F439	L397-N421 WeakPolarHBondContact CD2-ND2 3.29Å; Q417-N421 WeakPolarHBondContact O-CB 3.37Å; Q417-N421 PolarHBondContact O-N 3.42Å; Q417-N421 PolarHBondContact O-ND2 2.91Å; E418-N421 PolarHBondContact O-N 3.44Å; N421-L424 PolarHBondContact O-N 3.02Å; N421-L425 WeakPolarHBondContact O-CB 3.26Å; N421-L425 PolarHBondContact O-N 3.17Å; N421-F439 HydrophobicContact CB-CZ 4.5Å
422	G	94.8	Very high	95	Very high	39 Å²	39	43 Å²	43	40%	0.402	23%	0.231	S	C	.	.	H	α-helix	trans	-60.3	-48.3	179.1	0	0	0	0	0	112.3	E418 Q419 L424 L425 E426	E418-G422 PolarHBondContact O-N 2.8Å; Q419-G422 PolarHBondContact O-N 3Å; G422-L424 PolarHBondContact O-N 3.26Å; G422-L425 PolarHBondContact O-N 3.03Å; G422-E426 WeakPolarHBondContact O-CB 3.3Å; G422-E426 PolarHBondContact O-N 2.84Å
423	A	96.3	Very high	94.4	Very high	8 Å²	8	44.5 Å²	44.5	7%	0.066	24%	0.244	C	C	.	.	H	α-helix	trans	-69.2	-31.7	179.5	0	0	0	0	0	113.1	P245 L247 V248 Q419 Y427	P245-A423 HydrophobicContact CB-CB 4.4Å; L247-A423 HydrophobicContact CB-CB 3.99Å; L247-A423 HydrophobicContact CD2-CB 3.91Å; L247-A423 HydrophobicContact CG-CB 4.23Å; V248-A423 HydrophobicContact CG2-CB 3.95Å; Q419-A423 WeakPolarHBondContact O-CB 3.17Å; Q419-A423 PolarHBondContact O-N 2.76Å; A423-Y427 WeakPolarHBondContact O-CB 3.38Å; A423-Y427 PolarHBondContact O-N 2.96Å
424	L	95.8	Very high	93.9	Very high	0 Å²	0	50.3 Å²	50.3	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-67.7	-41.3	171.4	177.4	58.9	0	0	0	111.9	E390 C393 L394 L397 V420 N421 G422 Y427 I428 F439 L442	E390-L424 HydrophobicContact CB-CD1 4.21Å; E390-L424 HydrophobicContact CG-CD1 4.04Å; C393-L424 HydrophobicContact CB-CB 4.02Å; C393-L424 HydrophobicContact CB-CD1 3.89Å; C393-L424 HydrophobicContact CB-CD2 3.96Å; C393-L424 HydrophobicContact CB-CG 4.17Å; L394-L424 HydrophobicContact CD2-CD2 4.21Å; L397-L424 HydrophobicContact CD1-CD2 4.15Å; V420-L424 VanDerWaalsContact O-CB 3.24Å; V420-L424 WeakPolarHBondContact O-CB 3.39Å; V420-L424 PolarHBondContact O-N 3.19Å; N421-L424 PolarHBondContact O-N 3.02Å; G422-L424 PolarHBondContact O-N 3.26Å; L424-Y427 PolarHBondContact O-N 3.5Å; L424-I428 HydrophobicContact CD1-CD1 3.87Å; L424-I428 HydrophobicContact CD1-CG1 4.22Å; L424-I428 HydrophobicContact CG-CD1 4.15Å; L424-I428 WeakPolarHBondContact O-CB 3.38Å; L424-I428 WeakPolarHBondContact O-CG1 3.47Å; L424-I428 PolarHBondContact O-N 3.1Å; L424-F439 HydrophobicContact CB-CE2 4.29Å; L424-F439 HydrophobicContact CD2-CD2 4.41Å; L424-F439 HydrophobicContact CD2-CE2 4.13Å; L424-F439 HydrophobicContact CG-CD2 4.1Å; L424-F439 HydrophobicContact CG-CE2 4.06Å; L424-L442 HydrophobicContact CD2-CD2 4.39Å
425	L	94.6	Very high	93.3	Very high	67 Å²	67	51.4 Å²	51.4	35%	0.351	28%	0.275	S	S	.	.	H	α-helix	trans	-65.7	-46.6	176.1	179.5	61.9	0	0	0	111.4	N421 G422 Y427 I428 L429 F439	N421-L425 WeakPolarHBondContact O-CB 3.26Å; N421-L425 PolarHBondContact O-N 3.17Å; G422-L425 PolarHBondContact O-N 3.03Å; L425-Y427 VanDerWaalsContact C-N 3.31Å; L425-Y427 PolarHBondContact O-N 3.4Å; L425-I428 PolarHBondContact O-N 3.31Å; L425-L429 HydrophobicContact CD1-CD1 3.84Å; L425-L429 HydrophobicContact CD1-CG 4.01Å; L425-L429 HydrophobicContact CG-CD1 3.91Å; L425-L429 HydrophobicContact CG-CG 4.44Å; L425-L429 WeakPolarHBondContact O-CB 3.33Å; L425-L429 VanDerWaalsContact O-CG 3.32Å; L425-L429 WeakPolarHBondContact O-CG 3.32Å; L425-L429 PolarHBondContact O-N 3.47Å; L425-F439 HydrophobicContact CB-CD2 3.83Å; L425-F439 HydrophobicContact CB-CE2 3.82Å; L425-F439 HydrophobicContact CB-CG 4.42Å; L425-F439 HydrophobicContact CB-CZ 4.38Å; L425-F439 HydrophobicContact CD1-CB 3.86Å; L425-F439 HydrophobicContact CD1-CD1 4.06Å; L425-F439 HydrophobicContact CD1-CD2 3.96Å; L425-F439 HydrophobicContact CD1-CG 3.69Å; L425-F439 HydrophobicContact CG-CD2 4.5Å
426	E	92.9	Very high	92.6	Very high	101 Å²	101	57.4 Å²	57.4	47%	0.472	30%	0.298	S	S	.	.	H	α-helix	trans	-56.9	-45.3	174.4	-173.6	-169.7	164.7	0	0	111.3	P245 G422 S430	P245-E426 HydrophobicContact CG-CB 4.04Å; P245-E426 HydrophobicContact CG-CG 3.8Å; G422-E426 WeakPolarHBondContact O-CB 3.3Å; G422-E426 PolarHBondContact O-N 2.84Å; E426-S430 VanDerWaalsContact O-CB 3.3Å; E426-S430 WeakPolarHBondContact O-CB 3.44Å; E426-S430 PolarHBondContact O-N 3.05Å; E426-S430 PolarHBondContact O-OG 3.35Å
427	Y	94.8	Very high	92.2	Very high	3 Å²	3	63.1 Å²	63.1	1%	0.012	32%	0.324	C	S	.	.	H	α-helix	trans	-62.1	-45.4	176.9	173.5	-103	0	0	0	112.8	L244 D387 R389 E390 A423 L424 L425 S430 T431 Y432	L244-Y427 HydrophobicContact CD2-CD2 3.75Å; L244-Y427 HydrophobicContact CD2-CE2 3.45Å; L244-Y427 VanDerWaalsContact CD2-CE2 3.45Å; D387-Y427 WeakPolarHBondContact OD2-CE1 3.37Å; D387-Y427 PolarHBondContact OD2-OH 3.13Å; R389-Y427 HydrophobicContact CB-CD1 4.32Å; R389-Y427 HydrophobicContact CB-CE1 3.9Å; R389-Y427 HydrophobicContact CB-CE2 4.34Å; R389-Y427 HydrophobicContact CG-CE2 4.22Å; R389-Y427 VanDerWaalsContact CZ-OH 3.28Å; R389-Y427 PolarHBondContact NE-OH 2.96Å; R389-Y427 PolarHBondContact NH2-OH 3.25Å; E390-Y427 HydrophobicContact CG-CD1 3.99Å; E390-Y427 HydrophobicContact CG-CE1 3.67Å; A423-Y427 WeakPolarHBondContact O-CB 3.38Å; A423-Y427 PolarHBondContact O-N 2.96Å; L424-Y427 PolarHBondContact O-N 3.5Å; L425-Y427 VanDerWaalsContact C-N 3.31Å; L425-Y427 PolarHBondContact O-N 3.4Å; Y427-S430 PolarHBondContact O-OG 2.93Å; Y427-S430 VanDerWaalsContact O-OG 3.13Å; Y427-T431 WeakPolarHBondContact CD2-OG1 3.22Å; Y427-T431 HydrophobicContact CE2-CG2 4.27Å; Y427-T431 WeakPolarHBondContact CE2-OG1 3.06Å; Y427-T431 VanDerWaalsContact O-CB 3.27Å; Y427-T431 WeakPolarHBondContact O-CB 3.39Å; Y427-T431 PolarHBondContact O-N 3.03Å; Y427-T431 PolarHBondContact O-OG1 3.05Å; Y427-Y432 HydrophobicContact CE1-CE2 4.19Å
428	I	91.6	Very high	92	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	31%	0.314	C	S	.	.	H	α-helix	trans	-66.6	-46.1	179.4	-76.4	176.1	0	0	0	110.9	E390 L424 L425 S430 T431 Y432 K438 F439 L442	E390-I428 HydrophobicContact CG-CG1 4.42Å; E390-I428 WeakPolarHBondContact OE1-CG1 3.46Å; L424-I428 HydrophobicContact CD1-CD1 3.87Å; L424-I428 HydrophobicContact CD1-CG1 4.22Å; L424-I428 HydrophobicContact CG-CD1 4.15Å; L424-I428 WeakPolarHBondContact O-CB 3.38Å; L424-I428 WeakPolarHBondContact O-CG1 3.47Å; L424-I428 PolarHBondContact O-N 3.1Å; L425-I428 PolarHBondContact O-N 3.31Å; I428-S430 VanDerWaalsContact C-N 3.32Å; I428-S430 PolarHBondContact O-N 3.25Å; I428-T431 PolarHBondContact O-N 3.01Å; I428-Y432 CarbonylContact O-C 3.48Å; I428-Y432 WeakPolarHBondContact O-CA 3.13Å; I428-Y432 WeakPolarHBondContact O-CB 3.44Å; I428-Y432 PolarHBondContact O-N 3.46Å; I428-K438 HydrophobicContact CD1-CG 4.42Å; I428-K438 HydrophobicContact CG2-CB 3.86Å; I428-K438 HydrophobicContact CG2-CD 4.39Å; I428-K438 HydrophobicContact CG2-CG 4.37Å; I428-F439 HydrophobicContact CD1-CB 4.1Å; I428-F439 HydrophobicContact CD1-CD2 4.24Å; I428-F439 HydrophobicContact CG2-CB 4.33Å; I428-L442 HydrophobicContact CD1-CD2 4.08Å
429	L	90.3	Very high	91.8	Very high	84 Å²	84	56.3 Å²	56.3	44%	0.44	29%	0.292	S	S	.	.	H	α-helix	trans	-66.5	-32.5	-179.5	-68.2	174.1	0	0	0	112.8	L425	L425-L429 HydrophobicContact CD1-CD1 3.84Å; L425-L429 HydrophobicContact CD1-CG 4.01Å; L425-L429 HydrophobicContact CG-CD1 3.91Å; L425-L429 HydrophobicContact CG-CG 4.44Å; L425-L429 WeakPolarHBondContact O-CB 3.33Å; L425-L429 VanDerWaalsContact O-CG 3.32Å; L425-L429 WeakPolarHBondContact O-CG 3.32Å; L425-L429 PolarHBondContact O-N 3.47Å
430	S	90.8	Very high	91.6	Very high	43 Å²	43	53.6 Å²	53.6	30%	0.301	28%	0.284	S	S	.	.	H	α-helix	trans	-81.8	-32.8	178.3	58.4	0	0	0	0	113.9	P242 E426 Y427 I428	P242-S430 WeakPolarHBondContact CB-O 3.37Å; P242-S430 WeakPolarHBondContact CG-O 3.45Å; E426-S430 VanDerWaalsContact O-CB 3.3Å; E426-S430 WeakPolarHBondContact O-CB 3.44Å; E426-S430 PolarHBondContact O-N 3.05Å; E426-S430 PolarHBondContact O-OG 3.35Å; Y427-S430 PolarHBondContact O-OG 2.93Å; Y427-S430 VanDerWaalsContact O-OG 3.13Å; I428-S430 VanDerWaalsContact C-N 3.32Å; I428-S430 PolarHBondContact O-N 3.25Å
431	T	91.4	Very high	91.5	Very high	46 Å²	46	58.2 Å²	58.2	28%	0.282	31%	0.305	S	S	.	.	H	α-helix	trans	-93.9	-31.1	-178.2	-47.8	0	0	0	0	113	Y427 I428	Y427-T431 WeakPolarHBondContact CD2-OG1 3.22Å; Y427-T431 HydrophobicContact CE2-CG2 4.27Å; Y427-T431 WeakPolarHBondContact CE2-OG1 3.06Å; Y427-T431 VanDerWaalsContact O-CB 3.27Å; Y427-T431 WeakPolarHBondContact O-CB 3.39Å; Y427-T431 PolarHBondContact O-N 3.03Å; Y427-T431 PolarHBondContact O-OG1 3.05Å; I428-T431 PolarHBondContact O-N 3.01Å
432	Y	89.3	Confident	91.4	Very high	33 Å²	33	56.1 Å²	56.1	13%	0.129	29%	0.294	C	S	.	.			trans	-127.4	50.8	-174.3	-59.6	-72.7	0	0	0	112.5	D387 E390 Y427 I428 Q434 F435 K438	D387-Y432 PolarHBondContact OD2-OH 2.68Å; E390-Y432 WeakPolarHBondContact OE1-CE2 3.44Å; Y427-Y432 HydrophobicContact CE1-CE2 4.19Å; I428-Y432 CarbonylContact O-C 3.48Å; I428-Y432 WeakPolarHBondContact O-CA 3.13Å; I428-Y432 WeakPolarHBondContact O-CB 3.44Å; I428-Y432 PolarHBondContact O-N 3.46Å; Y432-Q434 PolarHBondContact O-N 2.79Å; Y432-F435 HydrophobicContact CD1-CD2 4.23Å; Y432-F435 PolarHBondContact O-N 2.82Å; Y432-K438 HydrophobicContact CD2-CD 3.96Å; Y432-K438 VanDerWaalsContact CE2-NZ 3.31Å; Y432-K438 HydrophobicContact CG-CD 4.1Å
433	P	85.6	Confident	91.2	Very high	74 Å²	74	56.5 Å²	56.5	48%	0.481	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-24.1	-174.7	25.3	-36	0	0	0	114.3	F435	P433-F435 VanDerWaalsContact C-N 3.29Å
434	Q	86.3	Confident	91	Very high	122 Å²	122	60.7 Å²	60.7	57%	0.57	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-11.4	174	72.2	-77.4	3.8	0	0	114.4	Y432	Y432-Q434 PolarHBondContact O-N 2.79Å
435	F	85.5	Confident	91	Very high	99 Å²	99	61.7 Å²	61.7	43%	0.434	32%	0.317	S	S	.	.			trans	-122	62.4	-178	-59.5	-55.8	0	0	0	110.9	Y432 P433 E437 K438	Y432-F435 HydrophobicContact CD1-CD2 4.23Å; Y432-F435 PolarHBondContact O-N 2.82Å; P433-F435 VanDerWaalsContact C-N 3.29Å; F435-E437 PolarHBondContact O-N 2.99Å; F435-K438 HydrophobicContact CB-CB 4.01Å; F435-K438 WeakPolarHBondContact O-CB 3.31Å; F435-K438 PolarHBondContact O-N 3.01Å
436	Q	83.1	Confident	91	Very high	148 Å²	148	59.3 Å²	59.3	69%	0.692	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.1	-36.4	-176.4	-63.1	179	-3.8	0	0	113.1	K438	Q436-K438 VanDerWaalsContact C-N 3.28Å; Q436-K438 PolarHBondContact O-N 3.35Å
437	E	89.6	Confident	91.1	Very high	121 Å²	121	58.4 Å²	58.4	57%	0.565	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	5.1	175.9	-63.1	-61.9	156.2	0	0	114.4	F435 F439 S440 Q441	F435-E437 PolarHBondContact O-N 2.99Å; E437-F439 VanDerWaalsContact C-N 3.32Å; E437-F439 PolarHBondContact O-N 3.34Å; E437-S440 WeakPolarHBondContact CA-OG 2.97Å; E437-S440 PolarHBondContact O-N 3.02Å; E437-S440 PolarHBondContact O-OG 3.48Å; E437-S440 PolarHBondContact OE2-OG 2.85Å; E437-Q441 HydrophobicContact CB-CG 4.39Å; E437-Q441 VanDerWaalsContact CB-NE2 3.33Å; E437-Q441 WeakPolarHBondContact O-CB 3.23Å; E437-Q441 WeakPolarHBondContact O-CG 3.24Å; E437-Q441 PolarHBondContact O-N 3.43Å
438	K	92.9	Very high	91.2	Very high	6 Å²	6	61.1 Å²	61.1	3%	0.026	32%	0.323	C	S	.	.	H	α-helix	trans	-62	-40.9	179.8	-173	-179.9	-173.4	-176.7	0	111.4	L384 Q385 E390 I428 Y432 F435 Q436 L442	L384-K438 WeakPolarHBondContact O-CE 3.4Å; L384-K438 PolarHBondContact O-NZ 2.84Å; Q385-K438 PolarHBondContact O-NZ 3.32Å; E390-K438 WeakPolarHBondContact OE1-CD 3.5Å; E390-K438 WeakPolarHBondContact OE1-CE 3.05Å; E390-K438 IonicContact OE1-NZ 3.87Å; E390-K438 PolarHBondContact OE1-NZ 3.12Å; E390-K438 WeakPolarHBondContact OE2-CE 3.14Å; E390-K438 IonicContact OE2-NZ 3.59Å; E390-K438 PolarHBondContact OE2-NZ 3.3Å; I428-K438 HydrophobicContact CD1-CG 4.42Å; I428-K438 HydrophobicContact CG2-CB 3.86Å; I428-K438 HydrophobicContact CG2-CD 4.39Å; I428-K438 HydrophobicContact CG2-CG 4.37Å; Y432-K438 HydrophobicContact CD2-CD 3.96Å; Y432-K438 VanDerWaalsContact CE2-NZ 3.31Å; Y432-K438 HydrophobicContact CG-CD 4.1Å; F435-K438 HydrophobicContact CB-CB 4.01Å; F435-K438 WeakPolarHBondContact O-CB 3.31Å; F435-K438 PolarHBondContact O-N 3.01Å; Q436-K438 VanDerWaalsContact C-N 3.28Å; Q436-K438 PolarHBondContact O-N 3.35Å; K438-L442 WeakPolarHBondContact O-CB 3.32Å; K438-L442 PolarHBondContact O-N 3.35Å
439	F	92.6	Very high	91.5	Very high	44 Å²	44	61.3 Å²	61.3	19%	0.193	32%	0.324	C	S	.	.	H	α-helix	trans	-63.7	-49	178.9	179.1	-89.4	0	0	0	112	N421 L424 L425 I428 E437 L442 V443	N421-F439 HydrophobicContact CB-CZ 4.5Å; L424-F439 HydrophobicContact CB-CE2 4.29Å; L424-F439 HydrophobicContact CD2-CD2 4.41Å; L424-F439 HydrophobicContact CD2-CE2 4.13Å; L424-F439 HydrophobicContact CG-CD2 4.1Å; L424-F439 HydrophobicContact CG-CE2 4.06Å; L425-F439 HydrophobicContact CB-CD2 3.83Å; L425-F439 HydrophobicContact CB-CE2 3.82Å; L425-F439 HydrophobicContact CB-CG 4.42Å; L425-F439 HydrophobicContact CB-CZ 4.38Å; L425-F439 HydrophobicContact CD1-CB 3.86Å; L425-F439 HydrophobicContact CD1-CD1 4.06Å; L425-F439 HydrophobicContact CD1-CD2 3.96Å; L425-F439 HydrophobicContact CD1-CG 3.69Å; L425-F439 HydrophobicContact CG-CD2 4.5Å; I428-F439 HydrophobicContact CD1-CB 4.1Å; I428-F439 HydrophobicContact CD1-CD2 4.24Å; I428-F439 HydrophobicContact CG2-CB 4.33Å; E437-F439 VanDerWaalsContact C-N 3.32Å; E437-F439 PolarHBondContact O-N 3.34Å; F439-L442 PolarHBondContact O-N 2.96Å; F439-V443 HydrophobicContact CD1-CG2 4.42Å; F439-V443 HydrophobicContact CE1-CG2 4.05Å; F439-V443 HydrophobicContact CE2-CG2 4.32Å; F439-V443 HydrophobicContact CZ-CG2 3.99Å; F439-V443 WeakPolarHBondContact O-CG2 3.46Å; F439-V443 PolarHBondContact O-N 3.34Å
440	S	92.6	Very high	91.8	Very high	44 Å²	44	61 Å²	61	31%	0.308	32%	0.317	S	S	.	.	H	α-helix	trans	-62.1	-47.3	179.5	59.3	0	0	0	0	111.1	E437 L442 V443 V444	E437-S440 WeakPolarHBondContact CA-OG 2.97Å; E437-S440 PolarHBondContact O-N 3.02Å; E437-S440 PolarHBondContact O-OG 3.48Å; E437-S440 PolarHBondContact OE2-OG 2.85Å; S440-L442 VanDerWaalsContact C-N 3.34Å; S440-L442 PolarHBondContact O-N 3.46Å; S440-V443 PolarHBondContact O-N 3.1Å; S440-V444 WeakPolarHBondContact O-CB 3.43Å; S440-V444 VanDerWaalsContact O-CG2 3.22Å; S440-V444 WeakPolarHBondContact O-CG2 3.46Å; S440-V444 PolarHBondContact O-N 3.38Å; S440-V444 VanDerWaalsContact O-N 3.09Å
441	Q	94.3	Very high	92.1	Very high	97 Å²	97	61.1 Å²	61.1	45%	0.453	32%	0.318	S	S	.	.	H	α-helix	trans	-64.6	-35.8	178.6	-67.2	174.1	28.9	0	0	112.8	L384 E437 Q445	L384-Q441 HydrophobicContact CD1-CB 4.44Å; L384-Q441 HydrophobicContact CD2-CB 3.79Å; E437-Q441 HydrophobicContact CB-CG 4.39Å; E437-Q441 VanDerWaalsContact CB-NE2 3.33Å; E437-Q441 WeakPolarHBondContact O-CB 3.23Å; E437-Q441 WeakPolarHBondContact O-CG 3.24Å; E437-Q441 PolarHBondContact O-N 3.43Å; Q441-Q445 WeakPolarHBondContact O-CG 3.34Å; Q441-Q445 PolarHBondContact O-NE2 3.08Å
442	L	93.6	Very high	92.4	Very high	0 Å²	0	59.4 Å²	59.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-67.9	-48.5	177.4	-173.8	66	0	0	0	112	L381 L384 V386 E390 L394 L424 I428 K438 F439 S440 V444 Q445	L381-L442 HydrophobicContact CD2-CD1 4.04Å; L384-L442 HydrophobicContact CD1-CD1 4.48Å; V386-L442 HydrophobicContact CG1-CD1 4.16Å; V386-L442 HydrophobicContact CG2-CD1 3.51Å; E390-L442 HydrophobicContact CB-CD2 4.18Å; L394-L442 HydrophobicContact CD1-CD1 3.93Å; L394-L442 HydrophobicContact CD1-CD2 4.45Å; L394-L442 HydrophobicContact CD1-CG 4.12Å; L394-L442 HydrophobicContact CD2-CD2 4.2Å; L394-L442 HydrophobicContact CD2-CG 4.17Å; L394-L442 HydrophobicContact CG-CD2 4.45Å; L424-L442 HydrophobicContact CD2-CD2 4.39Å; I428-L442 HydrophobicContact CD1-CD2 4.08Å; K438-L442 WeakPolarHBondContact O-CB 3.32Å; K438-L442 PolarHBondContact O-N 3.35Å; F439-L442 PolarHBondContact O-N 2.96Å; S440-L442 VanDerWaalsContact C-N 3.34Å; S440-L442 PolarHBondContact O-N 3.46Å; L442-V444 VanDerWaalsContact C-N 3.28Å; L442-V444 PolarHBondContact O-N 2.93Å; L442-Q445 WeakPolarHBondContact O-CB 3.09Å; L442-Q445 PolarHBondContact O-N 3.26Å; L442-Q445 VanDerWaalsContact O-N 3.07Å
443	V	90.2	Very high	92.8	Very high	46 Å²	46	57.8 Å²	57.8	28%	0.279	30%	0.3	S	S	.	.	H	α-helix	trans	-63.6	-35.2	178.9	173.3	0	0	0	0	111.4	F439 S440 Q445 L446	F439-V443 HydrophobicContact CD1-CG2 4.42Å; F439-V443 HydrophobicContact CE1-CG2 4.05Å; F439-V443 HydrophobicContact CE2-CG2 4.32Å; F439-V443 HydrophobicContact CZ-CG2 3.99Å; F439-V443 WeakPolarHBondContact O-CG2 3.46Å; F439-V443 PolarHBondContact O-N 3.34Å; S440-V443 PolarHBondContact O-N 3.1Å; V443-Q445 PolarHBondContact O-N 3.29Å; V443-Q445 VanDerWaalsContact O-N 3.15Å; V443-L446 WeakPolarHBondContact O-CB 3.46Å; V443-L446 PolarHBondContact O-N 3.12Å; V443-L446 VanDerWaalsContact O-N 3.07Å
444	V	93.2	Very high	93.4	Very high	96 Å²	96	57.5 Å²	57.5	58%	0.582	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-12.9	175	167.5	0	0	0	0	113.5	S440 L442 P447	S440-V444 WeakPolarHBondContact O-CB 3.43Å; S440-V444 VanDerWaalsContact O-CG2 3.22Å; S440-V444 WeakPolarHBondContact O-CG2 3.46Å; S440-V444 PolarHBondContact O-N 3.38Å; S440-V444 VanDerWaalsContact O-N 3.09Å; L442-V444 VanDerWaalsContact C-N 3.28Å; L442-V444 PolarHBondContact O-N 2.93Å; V444-P447 WeakPolarHBondContact O-CD 3.41Å
445	Q	95.1	Very high	93.9	Very high	21 Å²	21	55.6 Å²	55.6	10%	0.098	29%	0.288	C	S	.	.	H	α-helix	trans	-79.4	-17.2	172	-53.2	-44.9	-64.1	0	0	113.9	L377 L381 L384 Q441 L442 V443 D448 L449	L377-Q445 HydrophobicContact CD1-CB 3.99Å; L377-Q445 HydrophobicContact CD1-CG 4.34Å; L381-Q445 HydrophobicContact CD2-CB 4.36Å; L381-Q445 HydrophobicContact CD2-CG 3.99Å; L384-Q445 HydrophobicContact CD1-CG 4.27Å; Q441-Q445 WeakPolarHBondContact O-CG 3.34Å; Q441-Q445 PolarHBondContact O-NE2 3.08Å; L442-Q445 WeakPolarHBondContact O-CB 3.09Å; L442-Q445 PolarHBondContact O-N 3.26Å; L442-Q445 VanDerWaalsContact O-N 3.07Å; V443-Q445 PolarHBondContact O-N 3.29Å; V443-Q445 VanDerWaalsContact O-N 3.15Å; Q445-D448 PolarHBondContact O-N 2.93Å; Q445-L449 PolarHBondContact O-N 2.99Å
446	L	94.6	Very high	94.4	Very high	17 Å²	17	52.4 Å²	52.4	9%	0.089	28%	0.28	C	S	.	.	H	α-helix	trans	-67.8	-36.7	-176.2	-61.6	177.5	0	0	0	114.3	L394 L398 V443 L449 R450	L394-L446 HydrophobicContact CD1-CD2 4.45Å; L394-L446 HydrophobicContact CD2-CD1 4.46Å; L394-L446 HydrophobicContact CD2-CD2 4.31Å; L398-L446 HydrophobicContact CD2-CD2 4.23Å; L398-L446 HydrophobicContact CG-CD2 4.49Å; V443-L446 WeakPolarHBondContact O-CB 3.46Å; V443-L446 PolarHBondContact O-N 3.12Å; V443-L446 VanDerWaalsContact O-N 3.07Å; L446-L449 HydrophobicContact CD2-CD2 4.2Å; L446-L449 PolarHBondContact O-N 2.91Å; L446-R450 WeakPolarHBondContact O-CB 3.29Å; L446-R450 WeakPolarHBondContact O-CG 3.37Å; L446-R450 PolarHBondContact O-N 2.84Å
447	P	95.8	Very high	95	Very high	82 Å²	82	46 Å²	46	53%	0.532	25%	0.25	S	C	.	.	H	α-helix	trans	-61.2	-38.6	170.2	-25.9	36.2	0	0	0	113.8	V444 R450 S451	V444-P447 WeakPolarHBondContact O-CD 3.41Å; P447-R450 PolarHBondContact O-N 2.72Å; P447-S451 WeakPolarHBondContact O-CB 3.5Å; P447-S451 PolarHBondContact O-N 3.31Å
448	D	95.9	Very high	95.3	Very high	60 Å²	60	44.1 Å²	44.1	32%	0.321	24%	0.244	S	C	.	.	H	α-helix	trans	-66.8	-44.6	176.4	-83.4	-21	0	0	0	111.4	R380 Q445 R450 S451 L452	R380-D448 IonicContact CZ-OD2 3.41Å; R380-D448 IonicContact NE-OD2 3.35Å; R380-D448 IonicContact NH2-OD2 2.75Å; R380-D448 PolarHBondContact NH2-OD2 3.3Å; Q445-D448 PolarHBondContact O-N 2.93Å; D448-R450 VanDerWaalsContact C-N 3.3Å; D448-R450 PolarHBondContact O-N 2.73Å; D448-S451 WeakPolarHBondContact O-CB 3.33Å; D448-S451 PolarHBondContact O-N 3.33Å; D448-L452 WeakPolarHBondContact O-CB 3.28Å; D448-L452 PolarHBondContact O-N 2.72Å
449	L	97.9	Very high	95.3	Very high	4 Å²	4	44.7 Å²	44.7	2%	0.021	25%	0.246	C	C	.	.	H	α-helix	trans	-56.1	-44.2	173.3	179.8	70.8	0	0	0	111.6	V330 L331 I334 L377 L398 Q445 L446 L452 S453	V330-L449 HydrophobicContact CB-CD1 4.17Å; V330-L449 HydrophobicContact CG1-CD1 3.69Å; L331-L449 HydrophobicContact CB-CD1 4.22Å; L331-L449 HydrophobicContact CB-CD2 4.1Å; L331-L449 HydrophobicContact CD1-CD1 4.46Å; L331-L449 HydrophobicContact CD1-CD2 4.09Å; L331-L449 HydrophobicContact CD2-CD2 4.36Å; L331-L449 HydrophobicContact CG-CD2 4.42Å; I334-L449 HydrophobicContact CD1-CD1 4.29Å; L377-L449 HydrophobicContact CD2-CB 4.19Å; L377-L449 HydrophobicContact CD2-CD1 4.3Å; L398-L449 HydrophobicContact CD1-CD2 3.69Å; L398-L449 HydrophobicContact CD2-CD2 4.36Å; Q445-L449 PolarHBondContact O-N 2.99Å; L446-L449 HydrophobicContact CD2-CD2 4.2Å; L446-L449 PolarHBondContact O-N 2.91Å; L449-L452 PolarHBondContact O-N 3.17Å; L449-S453 WeakPolarHBondContact O-CB 3.49Å; L449-S453 PolarHBondContact O-N 3.2Å; L449-S453 PolarHBondContact O-OG 3.3Å
450	R	97.3	Very high	95.4	Very high	79 Å²	79	43.4 Å²	43.4	30%	0.298	24%	0.241	S	C	.	.	H	α-helix	trans	-64.2	-40	175.6	-80.8	169.4	174.2	167.3	3.9	113.3	E327 L446 P447 D448 L452 S453 T454	E327-R450 HydrophobicContact CG-CG 4.02Å; E327-R450 WeakPolarHBondContact OE2-CG 3.42Å; E327-R450 IonicContact OE2-CZ 3.29Å; E327-R450 IonicContact OE2-NE 3.35Å; E327-R450 PolarHBondContact OE2-NE 3.35Å; E327-R450 IonicContact OE2-NH2 2.68Å; L446-R450 WeakPolarHBondContact O-CB 3.29Å; L446-R450 WeakPolarHBondContact O-CG 3.37Å; L446-R450 PolarHBondContact O-N 2.84Å; P447-R450 PolarHBondContact O-N 2.72Å; D448-R450 VanDerWaalsContact C-N 3.3Å; D448-R450 PolarHBondContact O-N 2.73Å; R450-L452 VanDerWaalsContact C-N 3.33Å; R450-S453 PolarHBondContact O-OG 3.03Å; R450-T454 WeakPolarHBondContact O-CB 3.4Å; R450-T454 PolarHBondContact O-N 3.37Å; R450-T454 PolarHBondContact O-OG1 3.34Å
451	S	97.5	Very high	95.4	Very high	45 Å²	45	42.4 Å²	42.4	32%	0.315	23%	0.234	S	C	.	.	H	α-helix	trans	-64.2	-39.1	174.1	177.4	0	0	0	0	111.7	R373 P447 D448 Q455	R373-S451 PolarHBondContact NH1-OG 3.45Å; R373-S451 PolarHBondContact NH2-OG 3.01Å; P447-S451 WeakPolarHBondContact O-CB 3.5Å; P447-S451 PolarHBondContact O-N 3.31Å; D448-S451 WeakPolarHBondContact O-CB 3.33Å; D448-S451 PolarHBondContact O-N 3.33Å; S451-Q455 WeakPolarHBondContact O-CG 3.39Å; S451-Q455 PolarHBondContact O-N 2.86Å
452	L	98.2	Very high	95.3	Very high	9 Å²	9	43.1 Å²	43.1	5%	0.047	24%	0.236	C	C	.	.	H	α-helix	trans	-72	-45.5	178.3	-178.3	59.2	0	0	0	112.2	V330 I334 L370 R373 L377 D448 L449 R450 T454 Q455 A456	V330-L452 HydrophobicContact CG1-CD2 3.81Å; V330-L452 HydrophobicContact CG1-CG 4.1Å; I334-L452 HydrophobicContact CD1-CD2 3.88Å; L370-L452 HydrophobicContact CD2-CD1 3.8Å; R373-L452 HydrophobicContact CB-CD1 3.94Å; L377-L452 HydrophobicContact CD2-CD2 4.44Å; D448-L452 WeakPolarHBondContact O-CB 3.28Å; D448-L452 PolarHBondContact O-N 2.72Å; L449-L452 PolarHBondContact O-N 3.17Å; R450-L452 VanDerWaalsContact C-N 3.33Å; L452-T454 PolarHBondContact O-N 2.9Å; L452-Q455 PolarHBondContact O-N 3.14Å; L452-A456 PolarHBondContact O-N 2.55Å
453	S	97.9	Very high	95.2	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-65.2	-38.5	178.3	64.9	0	0	0	0	112.5	E327 L449 R450 Q455 A456 E457	E327-S453 VanDerWaalsContact CG-OG 3.23Å; E327-S453 WeakPolarHBondContact CG-OG 3.47Å; L449-S453 WeakPolarHBondContact O-CB 3.49Å; L449-S453 PolarHBondContact O-N 3.2Å; L449-S453 PolarHBondContact O-OG 3.3Å; R450-S453 PolarHBondContact O-OG 3.03Å; S453-Q455 PolarHBondContact O-N 3.14Å; S453-A456 WeakPolarHBondContact O-CB 3.48Å; S453-A456 PolarHBondContact O-N 2.8Å; S453-E457 WeakPolarHBondContact O-CG 3.39Å; S453-E457 PolarHBondContact O-N 3.38Å
454	T	96.9	Very high	95.1	Very high	67 Å²	67	42.8 Å²	42.8	41%	0.411	23%	0.231	S	C	.	.	H	α-helix	trans	-61.1	-44	174.8	-55.8	0	0	0	0	111.4	R450 L452 A456 E457 D458	R450-T454 WeakPolarHBondContact O-CB 3.4Å; R450-T454 PolarHBondContact O-N 3.37Å; R450-T454 PolarHBondContact O-OG1 3.34Å; L452-T454 PolarHBondContact O-N 2.9Å; T454-A456 VanDerWaalsContact C-N 3.35Å; T454-A456 PolarHBondContact O-N 2.77Å; T454-E457 WeakPolarHBondContact O-CB 3.44Å; T454-E457 PolarHBondContact O-N 3.39Å; T454-D458 PolarHBondContact O-N 3.01Å
455	Q	96.9	Very high	94.9	Very high	83 Å²	83	44.7 Å²	44.7	39%	0.388	24%	0.237	S	C	.	.	H	α-helix	trans	-68.1	-34.3	176.3	-70.4	178.2	0.8	0	0	112.2	L370 S451 L452 S453 D458 Y459	L370-Q455 HydrophobicContact CD2-CB 3.62Å; S451-Q455 WeakPolarHBondContact O-CG 3.39Å; S451-Q455 PolarHBondContact O-N 2.86Å; L452-Q455 PolarHBondContact O-N 3.14Å; S453-Q455 PolarHBondContact O-N 3.14Å; Q455-D458 PolarHBondContact O-N 3.44Å; Q455-Y459 WeakPolarHBondContact O-CB 3.43Å; Q455-Y459 PolarHBondContact O-N 3.32Å
456	A	96.4	Very high	94.5	Very high	32 Å²	32	47.9 Å²	47.9	26%	0.264	26%	0.255	S	S	.	.	H	α-helix	trans	-66.1	-36.7	172.5	0	0	0	0	0	112.2	L370 L452 S453 T454 L460	L370-A456 HydrophobicContact CD2-CB 4.39Å; L452-A456 PolarHBondContact O-N 2.55Å; S453-A456 WeakPolarHBondContact O-CB 3.48Å; S453-A456 PolarHBondContact O-N 2.8Å; T454-A456 VanDerWaalsContact C-N 3.35Å; T454-A456 PolarHBondContact O-N 2.77Å; A456-L460 VanDerWaalsContact O-CB 3.27Å; A456-L460 WeakPolarHBondContact O-CB 3.37Å; A456-L460 PolarHBondContact O-N 3.15Å
457	E	95.7	Very high	93.9	Very high	12 Å²	12	49.9 Å²	49.9	6%	0.056	28%	0.28	C	S	.	.	H	α-helix	trans	-64.9	-40.4	171.9	-75.2	176.3	-130.6	0	0	112.7	W325 S326 S453 T454 C461 L479 K482 R483	W325-E457 HydrophobicContact CH2-CG 4.17Å; W325-E457 HydrophobicContact CZ2-CG 3.97Å; S326-E457 VanDerWaalsContact CB-OE1 3.32Å; S326-E457 WeakPolarHBondContact CB-OE1 3.09Å; S326-E457 PolarHBondContact OG-OE1 3.24Å; S453-E457 WeakPolarHBondContact O-CG 3.39Å; S453-E457 PolarHBondContact O-N 3.38Å; T454-E457 WeakPolarHBondContact O-CB 3.44Å; T454-E457 PolarHBondContact O-N 3.39Å; E457-C461 WeakPolarHBondContact O-CB 3.5Å; E457-C461 PolarHBondContact O-N 3.04Å; E457-L479 HydrophobicContact CB-CD1 4.02Å; E457-L479 HydrophobicContact CG-CD1 4.22Å; E457-K482 WeakPolarHBondContact OE1-CD 3.31Å; E457-K482 VanDerWaalsContact OE1-CE 3.23Å; E457-K482 WeakPolarHBondContact OE1-CE 3.37Å; E457-K482 IonicContact OE1-NZ 2.82Å; E457-K482 PolarHBondContact OE1-NZ 3.02Å; E457-K482 WeakPolarHBondContact OE2-CD 3.39Å; E457-R483 PolarHBondContact O-NH2 3.21Å
458	D	95.3	Very high	93.1	Very high	82 Å²	82	49.6 Å²	49.6	44%	0.439	27%	0.271	S	S	.	.	H	α-helix	trans	-69.4	-40.6	177.3	-79.8	-30.5	0	0	0	111.8	T454 Q455 C461 F462 R483	T454-D458 PolarHBondContact O-N 3.01Å; Q455-D458 PolarHBondContact O-N 3.44Å; D458-C461 WeakPolarHBondContact O-CB 3.31Å; D458-C461 PolarHBondContact O-N 2.89Å; D458-F462 WeakPolarHBondContact O-CB 3.49Å; D458-F462 PolarHBondContact O-N 3.26Å; D458-R483 VanDerWaalsContact CA-NH2 3.27Å; D458-R483 IonicContact OD1-CZ 3.64Å; D458-R483 VanDerWaalsContact OD1-CZ 3.23Å; D458-R483 IonicContact OD1-NH1 3.91Å; D458-R483 PolarHBondContact OD1-NH1 2.9Å; D458-R483 IonicContact OD1-NH2 2.68Å; D458-R483 PolarHBondContact OD1-NH2 2.79Å
459	Y	94.2	Very high	92.2	Very high	18 Å²	18	47 Å²	47	7%	0.071	26%	0.258	C	S	.	.	H	α-helix	trans	-62.1	-46.4	172.4	179.2	-113.5	0	0	0	112.2	F285 E364 T366 L367 L370 Q455 C461 F462 K463	F285-Y459 HydrophobicContact CD2-CE1 4.32Å; F285-Y459 HydrophobicContact CE2-CD1 4.4Å; F285-Y459 AromaticContact CE2-CE1 3.71Å; F285-Y459 HydrophobicContact CE2-CE1 3.71Å; F285-Y459 HydrophobicContact CZ-CE1 4.48Å; E364-Y459 HydrophobicContact CG-CE2 4.19Å; E364-Y459 PolarHBondContact OE2-OH 2.85Å; T366-Y459 HydrophobicContact CG2-CD2 3.69Å; T366-Y459 HydrophobicContact CG2-CE2 4.43Å; T366-Y459 HydrophobicContact CG2-CG 4.23Å; L367-Y459 HydrophobicContact CB-CE2 4.48Å; L367-Y459 HydrophobicContact CD1-CE1 4Å; L370-Y459 HydrophobicContact CD1-CD1 3.84Å; L370-Y459 HydrophobicContact CD1-CG 3.85Å; Q455-Y459 WeakPolarHBondContact O-CB 3.43Å; Q455-Y459 PolarHBondContact O-N 3.32Å; Y459-C461 VanDerWaalsContact C-N 3.31Å; Y459-C461 PolarHBondContact O-N 3.18Å; Y459-F462 PolarHBondContact O-N 3.13Å; Y459-K463 HydrophobicContact CD2-CG 4.45Å; Y459-K463 HydrophobicContact CE1-CG 4.42Å; Y459-K463 HydrophobicContact CE2-CD 4.45Å; Y459-K463 HydrophobicContact CE2-CG 4.13Å; Y459-K463 WeakPolarHBondContact O-CB 2.98Å; Y459-K463 VanDerWaalsContact O-CG 3.3Å; Y459-K463 WeakPolarHBondContact O-CG 3.11Å; Y459-K463 PolarHBondContact O-N 2.68Å; Y459-K463 WeakPolarHBondContact OH-CE 3.49Å
460	L	94.1	Very high	91	Very high	18 Å²	18	50.9 Å²	50.9	9%	0.094	28%	0.281	C	S	.	.	H	α-helix	trans	-61.3	-39.1	174.3	-179.9	65.6	0	0	0	111.9	F285 W325 A456 H464 V469 L475 L479	F285-L460 HydrophobicContact CZ-CD1 4.17Å; W325-L460 HydrophobicContact CH2-CD2 4.13Å; A456-L460 VanDerWaalsContact O-CB 3.27Å; A456-L460 WeakPolarHBondContact O-CB 3.37Å; A456-L460 PolarHBondContact O-N 3.15Å; L460-H464 WeakPolarHBondContact O-CB 3.38Å; L460-H464 PolarHBondContact O-N 3.08Å; L460-V469 HydrophobicContact CD1-CG2 4.12Å; L460-L475 HydrophobicContact CD1-CD2 4.26Å; L460-L475 HydrophobicContact CD2-CD1 4.03Å; L460-L475 HydrophobicContact CD2-CD2 4.18Å; L460-L475 HydrophobicContact CD2-CG 3.96Å; L460-L479 HydrophobicContact CD2-CD2 4.04Å; L460-L479 HydrophobicContact CG-CD2 4Å
461	C	92.9	Very high	89.4	Confident	23 Å²	23	51 Å²	51	16%	0.155	29%	0.293	C	S	.	.	H	α-helix	trans	-64.6	-46.4	176.5	-170.8	0	0	0	0	111.8	E457 D458 Y459 H464 L465 L479	E457-C461 WeakPolarHBondContact O-CB 3.5Å; E457-C461 PolarHBondContact O-N 3.04Å; D458-C461 WeakPolarHBondContact O-CB 3.31Å; D458-C461 PolarHBondContact O-N 2.89Å; Y459-C461 VanDerWaalsContact C-N 3.31Å; Y459-C461 PolarHBondContact O-N 3.18Å; C461-H464 PolarHBondContact O-N 3.19Å; C461-L465 WeakPolarHBondContact O-CB 3.41Å; C461-L465 VanDerWaalsContact O-CG 3.28Å; C461-L465 WeakPolarHBondContact O-CG 3.5Å; C461-L465 PolarHBondContact O-N 3.18Å; C461-L479 HydrophobicContact CB-CD2 4.25Å
462	F	92.4	Very high	88.2	Confident	112 Å²	112	56.2 Å²	56.2	49%	0.491	32%	0.318	S	S	.	.	H	α-helix	trans	-56.3	-52.2	174.4	170	-109	0	0	0	111.6	D458 Y459 H464 L465 N466	D458-F462 WeakPolarHBondContact O-CB 3.49Å; D458-F462 PolarHBondContact O-N 3.26Å; Y459-F462 PolarHBondContact O-N 3.13Å; F462-H464 VanDerWaalsContact C-N 3.33Å; F462-H464 PolarHBondContact O-N 2.94Å; F462-L465 PolarHBondContact O-N 2.98Å; F462-N466 WeakPolarHBondContact CE1-ND2 3.27Å; F462-N466 WeakPolarHBondContact CE2-ND2 3.43Å; F462-N466 WeakPolarHBondContact CZ-ND2 3.39Å; F462-N466 VanDerWaalsContact O-CG 3.27Å; F462-N466 PolarHBondContact O-N 2.99Å; F462-N466 PolarHBondContact O-ND2 3.14Å
463	K	90.3	Very high	87.7	Confident	14 Å²	14	56.8 Å²	56.8	6%	0.061	32%	0.321	C	S	.	.	H	α-helix	trans	-60.4	-38.8	177.5	-68.7	-70	-165.6	179	0	113.1	F285 E364 Y459 N466 G467 E468 V469	F285-K463 HydrophobicContact CD1-CB 4.43Å; F285-K463 HydrophobicContact CD1-CD 4.46Å; F285-K463 HydrophobicContact CD1-CG 4.47Å; F285-K463 HydrophobicContact CE1-CB 3.43Å; F285-K463 VanDerWaalsContact CE1-CB 3.43Å; F285-K463 HydrophobicContact CE1-CD 4.15Å; F285-K463 HydrophobicContact CE1-CG 3.72Å; F285-K463 HydrophobicContact CE2-CG 4.2Å; F285-K463 HydrophobicContact CZ-CB 3.54Å; F285-K463 HydrophobicContact CZ-CD 4.36Å; F285-K463 HydrophobicContact CZ-CG 3.57Å; E364-K463 VanDerWaalsContact CD-NZ 3.25Å; E364-K463 WeakPolarHBondContact OE1-CE 3.46Å; E364-K463 IonicContact OE1-NZ 2.69Å; E364-K463 PolarHBondContact OE1-NZ 3.33Å; E364-K463 WeakPolarHBondContact OE2-CE 3.29Å; E364-K463 IonicContact OE2-NZ 2.82Å; E364-K463 PolarHBondContact OE2-NZ 2.83Å; Y459-K463 HydrophobicContact CD2-CG 4.45Å; Y459-K463 HydrophobicContact CE1-CG 4.42Å; Y459-K463 HydrophobicContact CE2-CD 4.45Å; Y459-K463 HydrophobicContact CE2-CG 4.13Å; Y459-K463 WeakPolarHBondContact O-CB 2.98Å; Y459-K463 VanDerWaalsContact O-CG 3.3Å; Y459-K463 WeakPolarHBondContact O-CG 3.11Å; Y459-K463 PolarHBondContact O-N 2.68Å; Y459-K463 WeakPolarHBondContact OH-CE 3.49Å; K463-N466 PolarHBondContact O-N 3.26Å; K463-G467 PolarHBondContact O-N 3.45Å; K463-E468 HydrophobicContact CB-CB 4.46Å; K463-E468 WeakPolarHBondContact CD-OE1 3.47Å; K463-E468 VanDerWaalsContact CD-OE2 3.32Å; K463-E468 WeakPolarHBondContact CD-OE2 3.44Å; K463-E468 IonicContact NZ-OE1 2.9Å; K463-E468 PolarHBondContact NZ-OE1 2.85Å; K463-E468 IonicContact NZ-OE2 3.37Å; K463-E468 PolarHBondContact NZ-OE2 2.93Å; K463-E468 WeakPolarHBondContact O-CB 3.42Å; K463-E468 PolarHBondContact O-N 3.3Å; K463-V469 HydrophobicContact CB-CG2 4.4Å
464	H	89.4	Confident	87.5	Confident	25 Å²	25	58.3 Å²	58.3	12%	0.116	33%	0.329	C	S	.	.	H	α-helix	trans	-66.6	-41.8	174.9	172.6	56.7	0	0	0	112.6	L460 C461 F462 N466 G467 V469 I476 H480	L460-H464 WeakPolarHBondContact O-CB 3.38Å; L460-H464 PolarHBondContact O-N 3.08Å; C461-H464 PolarHBondContact O-N 3.19Å; F462-H464 VanDerWaalsContact C-N 3.33Å; F462-H464 PolarHBondContact O-N 2.94Å; H464-N466 VanDerWaalsContact C-N 3.28Å; H464-N466 PolarHBondContact O-N 3.2Å; H464-G467 PolarHBondContact O-N 3.02Å; H464-V469 HydrophobicContact CB-CB 4.22Å; H464-V469 HydrophobicContact CB-CG2 4.31Å; H464-I476 HydrophobicContact CB-CD1 3.9Å; H464-H480 AromaticContact CD2-NE2 3.52Å; H464-H480 AromaticContact NE2-CE1 3.59Å; H464-H480 AromaticContact NE2-NE2 2.97Å; H464-H480 PolarHBondContact NE2-NE2 3.41Å
465	L	88.7	Confident	87.4	Confident	135 Å²	135	55.3 Å²	55.3	71%	0.707	31%	0.31	S	S	*	.	H	α-helix	trans	-65.2	-30.7	175.7	-71.2	169.7	0	0	0	112.6	C461 F462 G467	C461-L465 WeakPolarHBondContact O-CB 3.41Å; C461-L465 VanDerWaalsContact O-CG 3.28Å; C461-L465 WeakPolarHBondContact O-CG 3.5Å; C461-L465 PolarHBondContact O-N 3.18Å; F462-L465 PolarHBondContact O-N 2.98Å; L465-G467 PolarHBondContact O-N 3.13Å
466	N	87.2	Confident	87.2	Confident	88 Å²	88	51.5 Å²	51.5	47%	0.471	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	-74.9	-8.4	171.6	-62.6	-18.3	0	0	0	113.4	F462 K463 H464 E468	F462-N466 WeakPolarHBondContact CE1-ND2 3.27Å; F462-N466 WeakPolarHBondContact CE2-ND2 3.43Å; F462-N466 WeakPolarHBondContact CZ-ND2 3.39Å; F462-N466 VanDerWaalsContact O-CG 3.27Å; F462-N466 PolarHBondContact O-N 2.99Å; F462-N466 PolarHBondContact O-ND2 3.14Å; K463-N466 PolarHBondContact O-N 3.26Å; H464-N466 VanDerWaalsContact C-N 3.28Å; H464-N466 PolarHBondContact O-N 3.2Å; N466-E468 HydrophobicContact CB-CG 4.5Å
467	G	81.8	Confident	87.1	Confident	60 Å²	60	56 Å²	56	62%	0.619	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	85.9	7.7	-179.3	0	0	0	0	0	115.4	K463 H464 L465 V469	K463-G467 PolarHBondContact O-N 3.45Å; H464-G467 PolarHBondContact O-N 3.02Å; L465-G467 PolarHBondContact O-N 3.13Å; G467-V469 PolarHBondContact O-N 3.22Å
468	E	79.1	Confident	87.1	Confident	76 Å²	76	56 Å²	56	36%	0.355	31%	0.309	S	S	.	.			trans	-72.6	-12.5	179.3	-64.6	175.3	-113.4	0	0	113	F285 K463 N466	F285-E468 HydrophobicContact CD1-CB 4.31Å; F285-E468 HydrophobicContact CE1-CB 4.42Å; K463-E468 HydrophobicContact CB-CB 4.46Å; K463-E468 WeakPolarHBondContact CD-OE1 3.47Å; K463-E468 VanDerWaalsContact CD-OE2 3.32Å; K463-E468 WeakPolarHBondContact CD-OE2 3.44Å; K463-E468 IonicContact NZ-OE1 2.9Å; K463-E468 PolarHBondContact NZ-OE1 2.85Å; K463-E468 IonicContact NZ-OE2 3.37Å; K463-E468 PolarHBondContact NZ-OE2 2.93Å; K463-E468 WeakPolarHBondContact O-CB 3.42Å; K463-E468 PolarHBondContact O-N 3.3Å; N466-E468 HydrophobicContact CB-CG 4.5Å
469	V	76.9	Confident	87	Confident	5 Å²	5	52.2 Å²	52.2	3%	0.03	29%	0.288	C	S	.	.	S	Bend	trans	-121.6	128.9	-180	-166.2	0	0	0	0	111.9	F285 C289 L460 K463 H464 G467 C471 I476	F285-V469 HydrophobicContact CD1-CG2 4.5Å; F285-V469 HydrophobicContact CE1-CG2 3.55Å; F285-V469 HydrophobicContact CZ-CG2 4.21Å; C289-V469 HydrophobicContact CB-CG1 4.25Å; L460-V469 HydrophobicContact CD1-CG2 4.12Å; K463-V469 HydrophobicContact CB-CG2 4.4Å; H464-V469 HydrophobicContact CB-CB 4.22Å; H464-V469 HydrophobicContact CB-CG2 4.31Å; G467-V469 PolarHBondContact O-N 3.22Å; V469-C471 PolarHBondContact O-N 2.8Å; V469-I476 HydrophobicContact CB-CD1 4.27Å; V469-I476 HydrophobicContact CG1-CD1 3.81Å; V469-I476 HydrophobicContact CG1-CG1 3.78Å
470	T	72.1	Confident	87	Confident	85 Å²	85	56.3 Å²	56.3	52%	0.521	31%	0.307	S	S	.	.			trans	-64.2	125.3	176.6	48.9	0	0	0	0	112.3	N472	T470-N472 PolarHBondContact O-N 2.97Å
471	C	62.6	Low	86.8	Confident	81 Å²	81	56.4 Å²	56.4	55%	0.547	31%	0.311	S	S	.	.	S	Bend	trans	-70.2	-2.6	-172.4	-50.8	0	0	0	0	116.3	V469	V469-C471 PolarHBondContact O-N 2.8Å
472	N	74	Confident	86.7	Confident	155 Å²	155	56.3 Å²	56.3	83%	0.829	31%	0.308	S	S	*	.	S	Bend	trans	-115.4	53.9	-167.7	-62.2	-5	0	0	0	111.1	T470	T470-N472 PolarHBondContact O-N 2.97Å
473	N	86.9	Confident	86.3	Confident	22 Å²	22	55.6 Å²	55.6	12%	0.118	30%	0.302	C	S	.	.	S	Bend	trans	-145.8	162.4	177.5	74.7	-1.9	0	0	0	111.7	D293 L475 I476 E477	D293-N473 VanDerWaalsContact OD1-CB 3.28Å; D293-N473 WeakPolarHBondContact OD1-CB 3.44Å; N473-L475 VanDerWaalsContact C-N 3.27Å; N473-L475 PolarHBondContact O-N 3.45Å; N473-I476 PolarHBondContact O-N 2.87Å; N473-I476 WeakPolarHBondContact OD1-CB 3.33Å; N473-I476 WeakPolarHBondContact OD1-CG1 3.28Å; N473-I476 PolarHBondContact OD1-N 2.88Å; N473-E477 PolarHBondContact O-N 3.01Å; N473-E477 VanDerWaalsContact O-N 3.16Å
474	L	93.4	Very high	85.8	Confident	31 Å²	31	57.9 Å²	57.9	16%	0.162	32%	0.324	C	S	.	.	H	α-helix	trans	-62.8	-37.2	-176	178.2	63.4	0	0	0	111	D293 L296 F297 V300 I476 E477 M478	D293-L474 WeakPolarHBondContact OD1-CA 3.43Å; D293-L474 WeakPolarHBondContact OD1-CB 3.21Å; D293-L474 PolarHBondContact OD1-N 2.92Å; L296-L474 HydrophobicContact CD2-CD2 4.47Å; L296-L474 HydrophobicContact CD2-CG 4.16Å; L296-L474 HydrophobicContact CG-CD2 3.97Å; L296-L474 HydrophobicContact CG-CG 4.21Å; F297-L474 HydrophobicContact CD1-CD2 3.85Å; F297-L474 HydrophobicContact CD2-CB 4.42Å; F297-L474 HydrophobicContact CD2-CD2 3.97Å; F297-L474 HydrophobicContact CE1-CD2 3.87Å; F297-L474 HydrophobicContact CE2-CB 3.76Å; F297-L474 HydrophobicContact CE2-CD2 3.98Å; F297-L474 HydrophobicContact CG-CD2 3.89Å; F297-L474 HydrophobicContact CZ-CB 3.84Å; F297-L474 HydrophobicContact CZ-CD2 3.93Å; F297-L474 HydrophobicContact CZ-CG 4.48Å; V300-L474 HydrophobicContact CG2-CD2 4.47Å; L474-I476 VanDerWaalsContact C-N 3.35Å; L474-I476 PolarHBondContact O-N 3Å; L474-E477 PolarHBondContact O-N 3.19Å; L474-M478 HydrophobicContact CD1-CG 3.73Å; L474-M478 HydrophobicContact CD1-SD 4.25Å; L474-M478 HydrophobicContact CG-CG 4.01Å; L474-M478 WeakPolarHBondContact O-CB 3.05Å; L474-M478 WeakPolarHBondContact O-CG 3.23Å; L474-M478 PolarHBondContact O-N 2.88Å
475	L	94.6	Very high	84.4	Confident	4 Å²	4	60.2 Å²	60.2	2%	0.021	34%	0.342	C	S	.	.	H	α-helix	trans	-54.1	-46.7	176.9	-177.6	67	0	0	0	112.8	C289 A292 D293 L296 W325 L329 L460 N473 L479	C289-L475 HydrophobicContact CB-CD2 4.13Å; C289-L475 WeakPolarHBondContact O-CD2 3.4Å; A292-L475 HydrophobicContact CB-CD1 4.23Å; A292-L475 HydrophobicContact CB-CD2 4.08Å; D293-L475 HydrophobicContact CB-CB 4.06Å; D293-L475 PolarHBondContact OD1-N 2.86Å; L296-L475 HydrophobicContact CD2-CD1 4.28Å; W325-L475 HydrophobicContact CE3-CD1 4.3Å; W325-L475 HydrophobicContact CH2-CD1 4.13Å; W325-L475 HydrophobicContact CZ3-CD1 3.51Å; L329-L475 HydrophobicContact CD1-CD1 4.21Å; L460-L475 HydrophobicContact CD1-CD2 4.26Å; L460-L475 HydrophobicContact CD2-CD1 4.03Å; L460-L475 HydrophobicContact CD2-CD2 4.18Å; L460-L475 HydrophobicContact CD2-CG 3.96Å; N473-L475 VanDerWaalsContact C-N 3.27Å; N473-L475 PolarHBondContact O-N 3.45Å; L475-L479 WeakPolarHBondContact O-CB 3.31Å; L475-L479 PolarHBondContact O-N 3.04Å; L475-L479 VanDerWaalsContact O-N 3.11Å
476	I	93.6	Very high	82.7	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.015	35%	0.352	C	S	.	.	H	α-helix	trans	-75.7	-36.1	178.9	-68.6	-57.4	0	0	0	111.9	H464 V469 N473 L474 M478 L479 H480	H464-I476 HydrophobicContact CB-CD1 3.9Å; V469-I476 HydrophobicContact CB-CD1 4.27Å; V469-I476 HydrophobicContact CG1-CD1 3.81Å; V469-I476 HydrophobicContact CG1-CG1 3.78Å; N473-I476 PolarHBondContact O-N 2.87Å; N473-I476 WeakPolarHBondContact OD1-CB 3.33Å; N473-I476 WeakPolarHBondContact OD1-CG1 3.28Å; N473-I476 PolarHBondContact OD1-N 2.88Å; L474-I476 VanDerWaalsContact C-N 3.35Å; L474-I476 PolarHBondContact O-N 3Å; I476-M478 VanDerWaalsContact C-N 3.34Å; I476-M478 PolarHBondContact O-N 3.35Å; I476-L479 HydrophobicContact CD1-CD2 4.04Å; I476-L479 PolarHBondContact O-N 2.96Å; I476-H480 WeakPolarHBondContact CG2-NE2 3.12Å; I476-H480 WeakPolarHBondContact O-CB 3.26Å; I476-H480 PolarHBondContact O-CD2 3.48Å; I476-H480 PolarHBondContact O-N 2.85Å
477	E	93.6	Very high	82.5	Confident	128 Å²	128	59.6 Å²	59.6	60%	0.598	35%	0.346	S	S	*	.	H	α-helix	trans	-60.6	-43	173.7	-70.4	-172	173.6	0	0	111.8	N473 L474 H480 A481	N473-E477 PolarHBondContact O-N 3.01Å; N473-E477 VanDerWaalsContact O-N 3.16Å; L474-E477 PolarHBondContact O-N 3.19Å; E477-H480 PolarHBondContact O-N 3.23Å; E477-A481 VanDerWaalsContact O-CB 3.28Å; E477-A481 WeakPolarHBondContact O-CB 3.31Å; E477-A481 PolarHBondContact O-N 3.06Å
478	M	95.4	Very high	82.5	Confident	12 Å²	12	59.5 Å²	59.5	6%	0.059	33%	0.331	C	S	.	.	H	α-helix	trans	-68.9	-38	178.5	-67.4	-71.4	-70.5	0	0	112.5	L296 L321 W325 L474 I476 A481 K482	L296-M478 HydrophobicContact CD2-CB 4.13Å; L296-M478 HydrophobicContact CD2-CG 3.93Å; L321-M478 HydrophobicContact CB-CE 4.11Å; L321-M478 VanDerWaalsContact O-CE 3.3Å; L321-M478 WeakPolarHBondContact O-CE 3.26Å; W325-M478 HydrophobicContact CB-CE 3.67Å; W325-M478 HydrophobicContact CD2-CB 4.05Å; W325-M478 HydrophobicContact CG-CB 4.13Å; W325-M478 HydrophobicContact CG-CE 3.84Å; W325-M478 PolarHBondContact NE1-O 3.47Å; L474-M478 HydrophobicContact CD1-CG 3.73Å; L474-M478 HydrophobicContact CD1-SD 4.25Å; L474-M478 HydrophobicContact CG-CG 4.01Å; L474-M478 WeakPolarHBondContact O-CB 3.05Å; L474-M478 WeakPolarHBondContact O-CG 3.23Å; L474-M478 PolarHBondContact O-N 2.88Å; I476-M478 VanDerWaalsContact C-N 3.34Å; I476-M478 PolarHBondContact O-N 3.35Å; M478-A481 PolarHBondContact O-N 3.42Å; M478-K482 PolarHBondContact O-N 2.97Å
479	L	94.7	Very high	82.7	Confident	1 Å²	1	58.6 Å²	58.6	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-61.7	-45.2	171.6	179.8	69	0	0	0	112.1	W325 E457 L460 C461 L475 I476 A481 R483	W325-L479 HydrophobicContact CH2-CB 4.37Å; W325-L479 HydrophobicContact CH2-CD1 4.41Å; W325-L479 HydrophobicContact CZ2-CB 4.04Å; W325-L479 HydrophobicContact CZ2-CD1 4.11Å; E457-L479 HydrophobicContact CB-CD1 4.02Å; E457-L479 HydrophobicContact CG-CD1 4.22Å; L460-L479 HydrophobicContact CD2-CD2 4.04Å; L460-L479 HydrophobicContact CG-CD2 4Å; C461-L479 HydrophobicContact CB-CD2 4.25Å; L475-L479 WeakPolarHBondContact O-CB 3.31Å; L475-L479 PolarHBondContact O-N 3.04Å; L475-L479 VanDerWaalsContact O-N 3.11Å; I476-L479 HydrophobicContact CD1-CD2 4.04Å; I476-L479 PolarHBondContact O-N 2.96Å; L479-A481 VanDerWaalsContact C-N 3.34Å; L479-R483 WeakPolarHBondContact O-CG 3.37Å; L479-R483 PolarHBondContact O-N 2.78Å
480	H	92.3	Very high	83	Confident	104 Å²	104	61.8 Å²	61.8	48%	0.481	35%	0.347	S	S	.	.	H	α-helix	trans	-66.7	-37.1	176.9	-74.9	-154.4	0	0	0	111.3	H464 I476 E477 A484	H464-H480 AromaticContact CD2-NE2 3.52Å; H464-H480 AromaticContact NE2-CE1 3.59Å; H464-H480 AromaticContact NE2-NE2 2.97Å; H464-H480 PolarHBondContact NE2-NE2 3.41Å; I476-H480 WeakPolarHBondContact CG2-NE2 3.12Å; I476-H480 WeakPolarHBondContact O-CB 3.26Å; I476-H480 PolarHBondContact O-CD2 3.48Å; I476-H480 PolarHBondContact O-N 2.85Å; E477-H480 PolarHBondContact O-N 3.23Å; H480-A484 VanDerWaalsContact O-CB 3.32Å; H480-A484 WeakPolarHBondContact O-CB 3.47Å; H480-A484 PolarHBondContact O-N 3.19Å; H480-A484 VanDerWaalsContact O-N 3.14Å
481	A	91.6	Very high	83.7	Confident	21 Å²	21	60.3 Å²	60.3	17%	0.174	34%	0.337	C	S	.	.	H	α-helix	trans	-67.4	-47.4	178.4	0	0	0	0	0	112.6	H322 E477 M478 L479 R483 A484 C485	H322-A481 HydrophobicContact CB-CB 4.48Å; E477-A481 VanDerWaalsContact O-CB 3.28Å; E477-A481 WeakPolarHBondContact O-CB 3.31Å; E477-A481 PolarHBondContact O-N 3.06Å; M478-A481 PolarHBondContact O-N 3.42Å; L479-A481 VanDerWaalsContact C-N 3.34Å; A481-R483 PolarHBondContact O-N 2.78Å; A481-A484 PolarHBondContact O-N 3.33Å; A481-A484 VanDerWaalsContact O-N 3.11Å; A481-C485 PolarHBondContact O-N 3.18Å; A481-C485 PolarHBondContact O-SG 2.75Å
482	K	89.1	Confident	85.1	Confident	21 Å²	21	58.9 Å²	58.9	9%	0.091	32%	0.323	C	S	.	.	H	α-helix	trans	-57.6	-50	176.6	-169.4	163	172.5	175	0	110.8	H322 N323 S326 E327 E457 M478 A484 C485 V486	H322-K482 WeakPolarHBondContact O-CB 3.35Å; H322-K482 VanDerWaalsContact O-CD 3.25Å; H322-K482 WeakPolarHBondContact O-CD 3.5Å; H322-K482 WeakPolarHBondContact O-CG 3.24Å; N323-K482 WeakPolarHBondContact O-CD 3.49Å; N323-K482 WeakPolarHBondContact O-CE 3.48Å; N323-K482 PolarHBondContact O-NZ 3.01Å; S326-K482 PolarHBondContact OG-NZ 3.01Å; S326-K482 VanDerWaalsContact OG-NZ 3.17Å; E327-K482 IonicContact OE1-NZ 3.7Å; E327-K482 PolarHBondContact OE1-NZ 2.92Å; E457-K482 WeakPolarHBondContact OE1-CD 3.31Å; E457-K482 VanDerWaalsContact OE1-CE 3.23Å; E457-K482 WeakPolarHBondContact OE1-CE 3.37Å; E457-K482 IonicContact OE1-NZ 2.82Å; E457-K482 PolarHBondContact OE1-NZ 3.02Å; E457-K482 WeakPolarHBondContact OE2-CD 3.39Å; M478-K482 PolarHBondContact O-N 2.97Å; K482-A484 PolarHBondContact O-N 3.33Å; K482-A484 VanDerWaalsContact O-N 3.16Å; K482-C485 PolarHBondContact O-N 3.27Å; K482-V486 PolarHBondContact O-N 3.08Å
483	R	85.4	Confident	85.9	Confident	96 Å²	96	52.1 Å²	52.1	36%	0.362	29%	0.286	S	S	.	.	H	α-helix	trans	-66.1	-13.6	177.7	-67.5	-177.8	-174.7	-91.9	-5.6	114.8	E457 D458 L479 A481	E457-R483 PolarHBondContact O-NH2 3.21Å; D458-R483 VanDerWaalsContact CA-NH2 3.27Å; D458-R483 IonicContact OD1-CZ 3.64Å; D458-R483 VanDerWaalsContact OD1-CZ 3.23Å; D458-R483 IonicContact OD1-NH1 3.91Å; D458-R483 PolarHBondContact OD1-NH1 2.9Å; D458-R483 IonicContact OD1-NH2 2.68Å; D458-R483 PolarHBondContact OD1-NH2 2.79Å; L479-R483 WeakPolarHBondContact O-CG 3.37Å; L479-R483 PolarHBondContact O-N 2.78Å; A481-R483 PolarHBondContact O-N 2.78Å
484	A	79	Confident	85.8	Confident	62 Å²	62	54.4 Å²	54.4	51%	0.512	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-3.6	173.8	0	0	0	0	0	113.9	H480 A481 K482	H480-A484 VanDerWaalsContact O-CB 3.32Å; H480-A484 WeakPolarHBondContact O-CB 3.47Å; H480-A484 PolarHBondContact O-N 3.19Å; H480-A484 VanDerWaalsContact O-N 3.14Å; A481-A484 PolarHBondContact O-N 3.33Å; A481-A484 VanDerWaalsContact O-N 3.11Å; K482-A484 PolarHBondContact O-N 3.33Å; K482-A484 VanDerWaalsContact O-N 3.16Å
485	C	60.7	Low	85.2	Confident	75 Å²	75	56.3 Å²	56.3	51%	0.507	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-112.6	-7.6	-179.8	-60.4	0	0	0	0	114	A481 K482	A481-C485 PolarHBondContact O-N 3.18Å; A481-C485 PolarHBondContact O-SG 2.75Å; K482-C485 PolarHBondContact O-N 3.27Å
486	V	52.1	Low	84.3	Confident	149 Å²	149	61.1 Å²	61.1	90%	0.903	34%	0.337	S	S	*	.			trans	-77.3	0	173.4	176.7	0	0	0	0	110.4	K405 K482	K405-V486 PolarHBondContact NZ-O 3.43Å; K482-V486 PolarHBondContact O-N 3.08Å

Retrieved 486 of 486 residues in 1353 ms (Link to these results)

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