A0A077ZKW5_TRITR Loading...

NFU1 iron sulfur cluster scaffold

AlphaFold DB , UniProt , Accession A0A077ZKW5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 501 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	41.3	Very low	62.9	Low	220 Å²	220	112.2 Å²	112.2	100%	1.084	63%	0.628	S	S	*	*				0	47.7	0	-62.6	-177.7	-177.8	0	0	108.2
2	N	46.6	Very low	62.4	Low	136 Å²	136	112.9 Å²	112.9	73%	0.727	63%	0.628	S	S	*	*				80.2	89.2	82.6	-71.1	19.8	0	0	0	109.6	S4 L5	N2-S4 PolarHBondContact O-N 3.12Å; N2-L5 PolarHBondContact O-N 2.88Å
3	S	63.8	Low	61.5	Low	95 Å²	95	116 Å²	116	66%	0.664	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	19.1	-50.8	149.6	-168.7	0	0	0	0	118.3	L5 L6 V7	S3-L5 VanDerWaalsContact C-N 3.34Å; S3-L5 PolarHBondContact O-N 3.35Å; S3-L6 PolarHBondContact O-N 3.38Å; S3-V7 WeakPolarHBondContact O-CG2 3.34Å; S3-V7 PolarHBondContact O-N 3.49Å
4	S	70.4	Confident	60.5	Low	77 Å²	77	115.7 Å²	115.7	54%	0.538	63%	0.632	S	S	.	*	H	α-helix	trans	-45.2	-48.3	177	-159.7	0	0	0	0	114.3	N2 L6 V7 E8	N2-S4 PolarHBondContact O-N 3.12Å; S4-L6 VanDerWaalsContact C-N 3.31Å; S4-L6 PolarHBondContact O-N 3.3Å; S4-V7 PolarHBondContact O-N 3.47Å; S4-E8 PolarHBondContact O-N 3.26Å
5	L	67.1	Low	59.1	Low	112 Å²	112	114.4 Å²	114.4	59%	0.586	63%	0.632	S	S	*	*	H	α-helix	trans	-68.5	-31.1	-179.1	-83.8	171.7	0	0	0	113.1	N2 S3 L9	N2-L5 PolarHBondContact O-N 2.88Å; S3-L5 VanDerWaalsContact C-N 3.34Å; S3-L5 PolarHBondContact O-N 3.35Å; L5-L9 WeakPolarHBondContact O-CB 3.32Å; L5-L9 PolarHBondContact O-N 2.9Å
6	L	69.8	Low	57.6	Low	132 Å²	132	118.1 Å²	118.1	69%	0.691	64%	0.643	S	S	*	*	H	α-helix	trans	-76.2	-35.6	179	-131.1	160.2	0	0	0	110.4	S3 S4 N10	S3-L6 PolarHBondContact O-N 3.38Å; S4-L6 VanDerWaalsContact C-N 3.31Å; S4-L6 PolarHBondContact O-N 3.3Å; L6-N10 WeakPolarHBondContact O-CB 3.47Å; L6-N10 PolarHBondContact O-N 3.01Å
7	V	72.5	Confident	56.2	Low	91 Å²	91	117.4 Å²	117.4	55%	0.552	65%	0.646	S	S	*	*	H	α-helix	trans	-65.9	-45.5	172.1	174.9	0	0	0	0	110.8	S3 S4 L9 N10 A11	S3-V7 WeakPolarHBondContact O-CG2 3.34Å; S3-V7 PolarHBondContact O-N 3.49Å; S4-V7 PolarHBondContact O-N 3.47Å; V7-L9 PolarHBondContact O-N 3.31Å; V7-N10 PolarHBondContact O-N 3.48Å; V7-A11 WeakPolarHBondContact O-CB 3.43Å; V7-A11 PolarHBondContact O-N 2.99Å
8	E	71.9	Confident	54.9	Low	110 Å²	110	120.1 Å²	120.1	51%	0.514	66%	0.658	S	S	.	*	H	α-helix	trans	-64.4	-39	175.9	-78.3	-179.7	164.8	0	0	112.8	S4 N10 A11 L12	S4-E8 PolarHBondContact O-N 3.26Å; E8-N10 VanDerWaalsContact C-N 3.32Å; E8-N10 PolarHBondContact O-N 3.41Å; E8-A11 PolarHBondContact O-N 3.38Å; E8-L12 WeakPolarHBondContact O-CB 3.18Å; E8-L12 WeakPolarHBondContact O-CG 3.29Å; E8-L12 PolarHBondContact O-N 2.95Å
9	L	63.3	Low	53.4	Low	113 Å²	113	123.5 Å²	123.5	59%	0.592	67%	0.669	S	S	*	*	H	α-helix	trans	-62.8	-40.2	174	-103.7	163.1	0	0	0	111.7	L5 V7 L12 Q13	L5-L9 WeakPolarHBondContact O-CB 3.32Å; L5-L9 PolarHBondContact O-N 2.9Å; V7-L9 PolarHBondContact O-N 3.31Å; L9-L12 PolarHBondContact O-N 3.04Å; L9-Q13 WeakPolarHBondContact O-CB 3.46Å; L9-Q13 PolarHBondContact O-N 3.46Å
10	N	60.8	Low	52.2	Low	91 Å²	91	126.7 Å²	126.7	49%	0.487	68%	0.677	S	S	.	*	H	α-helix	trans	-71.9	-39.1	-179.8	-143.3	-6.3	0	0	0	111.7	L6 V7 E8 L12 Q13 N14	L6-N10 WeakPolarHBondContact O-CB 3.47Å; L6-N10 PolarHBondContact O-N 3.01Å; V7-N10 PolarHBondContact O-N 3.48Å; E8-N10 VanDerWaalsContact C-N 3.32Å; E8-N10 PolarHBondContact O-N 3.41Å; N10-L12 VanDerWaalsContact C-N 3.27Å; N10-L12 PolarHBondContact O-N 2.7Å; N10-Q13 PolarHBondContact O-N 3.18Å; N10-N14 PolarHBondContact O-N 2.96Å
11	A	64.7	Low	51	Low	57 Å²	57	128.3 Å²	128.3	47%	0.471	69%	0.685	S	S	.	*	H	α-helix	trans	-66.2	-25.7	173.1	0	0	0	0	0	113.1	V7 E8 N14 P15	V7-A11 WeakPolarHBondContact O-CB 3.43Å; V7-A11 PolarHBondContact O-N 2.99Å; E8-A11 PolarHBondContact O-N 3.38Å; A11-N14 CarbonylContact O-C 3.6Å; A11-N14 VanDerWaalsContact O-C 3.28Å; A11-N14 VanDerWaalsContact O-O 3.13Å; A11-P15 WeakPolarHBondContact O-CA 3.31Å
12	L	56.8	Low	50.6	Low	121 Å²	121	123.1 Å²	123.1	63%	0.634	67%	0.666	S	S	*	*	H	α-helix	trans	-82.6	-28.2	173.6	-78.4	166.6	0	0	0	113.3	E8 L9 N10	E8-L12 WeakPolarHBondContact O-CB 3.18Å; E8-L12 WeakPolarHBondContact O-CG 3.29Å; E8-L12 PolarHBondContact O-N 2.95Å; L9-L12 PolarHBondContact O-N 3.04Å; N10-L12 VanDerWaalsContact C-N 3.27Å; N10-L12 PolarHBondContact O-N 2.7Å
13	Q	50.2	Low	49.8	Very low	153 Å²	153	123.5 Å²	123.5	72%	0.715	67%	0.668	S	S	*	*	H	α-helix	trans	-80.5	-30.7	177.1	-166.3	160.7	-6.5	0	0	111.5	L9 N10	L9-Q13 WeakPolarHBondContact O-CB 3.46Å; L9-Q13 PolarHBondContact O-N 3.46Å; N10-Q13 PolarHBondContact O-N 3.18Å
14	N	47.3	Very low	48.3	Very low	112 Å²	112	128.4 Å²	128.4	60%	0.599	68%	0.68	S	S	*	*	S	Bend	trans	-124.1	79.2	170.3	-62.7	-48.9	0	0	0	109	N10 A11 E16	N10-N14 PolarHBondContact O-N 2.96Å; A11-N14 CarbonylContact O-C 3.6Å; A11-N14 VanDerWaalsContact O-C 3.28Å; A11-N14 VanDerWaalsContact O-O 3.13Å; N14-E16 PolarHBondContact O-N 3.3Å; N14-E16 VanDerWaalsContact O-N 3.17Å
15	P	40.1	Very low	46.5	Very low	96 Å²	96	128.7 Å²	128.7	62%	0.623	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-59.8	123.8	176.4	25.7	-32.5	0	0	0	109	A11	A11-P15 WeakPolarHBondContact O-CA 3.31Å
16	E	35.3	Very low	44.9	Very low	173 Å²	173	130.5 Å²	130.5	81%	0.808	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-51.8	130.1	165.7	-76	179.2	175.7	0	0	107.6	N14 L18	N14-E16 PolarHBondContact O-N 3.3Å; N14-E16 VanDerWaalsContact O-N 3.17Å; E16-L18 PolarHBondContact O-N 2.85Å
17	P	33.8	Very low	43.8	Very low	107 Å²	107	130.2 Å²	130.2	70%	0.695	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-56.7	132	-177.7	22.7	-30.9	0	0	0	108.4	E19	P17-E19 PolarHBondContact O-N 3.22Å
18	L	33.2	Very low	42.3	Very low	165 Å²	165	133.1 Å²	133.1	86%	0.864	71%	0.709	S	S	*	*			trans	-39.7	117.9	174.3	-85.4	152	0	0	0	109.1	E16 F20	E16-L18 PolarHBondContact O-N 2.85Å; L18-F20 PolarHBondContact O-N 2.92Å
19	E	26.4	Very low	41.1	Very low	186 Å²	186	132.2 Å²	132.2	87%	0.869	71%	0.708	S	S	*	*			trans	-56.9	81.4	179.2	-68.7	179	171	0	0	110.2	P17	P17-E19 PolarHBondContact O-N 3.22Å
20	F	28	Very low	40.2	Very low	187 Å²	187	129.6 Å²	129.6	82%	0.82	71%	0.708	S	S	*	*			trans	-85	104.7	143.2	-106.2	-89.5	0	0	0	104.5	L18 V22	L18-F20 PolarHBondContact O-N 2.92Å; F20-V22 VanDerWaalsContact C-N 3.3Å; F20-V22 PolarHBondContact O-N 3.48Å
21	N	27.9	Very low	39.5	Very low	161 Å²	161	130.6 Å²	130.6	86%	0.861	71%	0.706	S	S	*	*			trans	-52.7	92.7	177.5	-153.5	8.7	0	0	0	109.1
22	V	33.4	Very low	38.8	Very low	111 Å²	111	133.5 Å²	133.5	67%	0.673	71%	0.708	S	S	*	*			trans	-141.1	107.1	176.9	-177.7	0	0	0	0	104.5	F20 E24	F20-V22 VanDerWaalsContact C-N 3.3Å; F20-V22 PolarHBondContact O-N 3.48Å; V22-E24 PolarHBondContact O-N 3.24Å
23	D	29.3	Very low	38.4	Very low	143 Å²	143	132.3 Å²	132.3	77%	0.765	70%	0.702	S	S	*	*			trans	-40.7	121.3	-172.5	-66.4	-56.5	0	0	0	112.3	S25	D23-S25 VanDerWaalsContact C-N 3.29Å; D23-S25 PolarHBondContact O-N 3.4Å
24	E	32.5	Very low	38.2	Very low	198 Å²	198	127 Å²	127	93%	0.925	68%	0.684	S	S	*	*			trans	-66	87.1	171.2	-80.6	-179.1	140.9	0	0	109.5	V22	V22-E24 PolarHBondContact O-N 3.24Å
25	S	32.2	Very low	38.6	Very low	84 Å²	84	125.1 Å²	125.1	59%	0.587	67%	0.673	S	S	*	*			trans	-135.8	109.7	159.4	54.8	0	0	0	0	109.7	D23	D23-S25 VanDerWaalsContact C-N 3.29Å; D23-S25 PolarHBondContact O-N 3.4Å
26	D	33.6	Very low	39.3	Very low	149 Å²	149	124.4 Å²	124.4	80%	0.797	66%	0.664	S	S	*	*			trans	81.5	120.8	161.4	-58.6	-25.7	0	0	0	119.6	E28	D26-E28 PolarHBondContact O-N 3Å
27	S	45.9	Very low	40.3	Very low	126 Å²	126	118 Å²	118	88%	0.881	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	32.5	-167.1	66.9	0	0	0	0	115.8
28	E	42.1	Very low	41.2	Very low	153 Å²	153	115 Å²	115	72%	0.715	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.8	-0.2	-179.7	-65.2	-151.7	149.7	0	0	115	D26	D26-E28 PolarHBondContact O-N 3Å
29	D	46.9	Very low	42.2	Very low	90 Å²	90	115 Å²	115	48%	0.481	60%	0.602	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.9	11.9	-164.9	-75.3	-10.5	0	0	0	117.1	W31 F32 L33	D29-W31 PolarHBondContact O-N 3.31Å; D29-F32 HydrophobicContact CB-CB 4.01Å; D29-F32 WeakPolarHBondContact O-CB 3.49Å; D29-F32 PolarHBondContact O-N 2.84Å; D29-L33 PolarHBondContact O-N 2.98Å
30	G	43.2	Very low	43.6	Very low	59 Å²	59	108.5 Å²	108.5	61%	0.608	58%	0.578	S	S	*	*	H	α-helix	trans	-58.6	-33.6	174.5	0	0	0	0	0	113.4	A34	G30-A34 PolarHBondContact O-N 3.24Å
31	W	47.5	Very low	44.6	Very low	112 Å²	112	99.9 Å²	99.9	42%	0.424	54%	0.54	S	S	.	.	H	α-helix	trans	-73.3	-36.1	172.6	-95	72.4	0	0	0	112.5	D29 L33 A34 L35 A232 M236	D29-W31 PolarHBondContact O-N 3.31Å; W31-L33 VanDerWaalsContact C-N 3.28Å; W31-L33 PolarHBondContact O-N 3.04Å; W31-A34 PolarHBondContact O-N 3.28Å; W31-L35 WeakPolarHBondContact O-CB 3.43Å; W31-L35 PolarHBondContact O-N 3.38Å; W31-A232 HydrophobicContact CD2-CB 4.13Å; W31-A232 HydrophobicContact CE3-CB 4.25Å; W31-A232 VanDerWaalsContact CH2-CA 3.48Å; W31-A232 HydrophobicContact CH2-CB 3.37Å; W31-A232 WeakPolarHBondContact CH2-O 3.3Å; W31-A232 HydrophobicContact CZ2-CB 3.13Å; W31-A232 HydrophobicContact CZ3-CB 3.89Å; W31-M236 HydrophobicContact CH2-CB 3.88Å; W31-M236 HydrophobicContact CZ3-CB 4.49Å
32	F	49.2	Very low	45.8	Very low	118 Å²	118	94.9 Å²	94.9	52%	0.518	52%	0.516	S	S	.	.	H	α-helix	trans	-64.1	-36.8	177.9	-158.6	-99.9	0	0	0	111.2	D29 L35 L36	D29-F32 HydrophobicContact CB-CB 4.01Å; D29-F32 WeakPolarHBondContact O-CB 3.49Å; D29-F32 PolarHBondContact O-N 2.84Å; F32-L35 PolarHBondContact O-N 3.16Å; F32-L36 HydrophobicContact CD1-CD1 3.55Å; F32-L36 HydrophobicContact CD1-CG 3.98Å; F32-L36 HydrophobicContact CE1-CD1 3.66Å; F32-L36 HydrophobicContact CE1-CD2 4.36Å; F32-L36 HydrophobicContact CE1-CG 3.95Å; F32-L36 VanDerWaalsContact O-CB 3.32Å; F32-L36 WeakPolarHBondContact O-CB 3.33Å; F32-L36 WeakPolarHBondContact O-CG 3.5Å; F32-L36 PolarHBondContact O-N 2.78Å
33	L	48.2	Very low	46.5	Very low	96 Å²	96	95.6 Å²	95.6	50%	0.503	51%	0.511	S	S	.	.	H	α-helix	trans	-69.7	-34.2	175.4	-69.2	172.8	0	0	0	113.6	D29 W31 L36 V37 R194	D29-L33 PolarHBondContact O-N 2.98Å; W31-L33 VanDerWaalsContact C-N 3.28Å; W31-L33 PolarHBondContact O-N 3.04Å; L33-L36 HydrophobicContact CD2-CD1 4.37Å; L33-V37 WeakPolarHBondContact O-CG2 3.26Å; L33-V37 PolarHBondContact O-N 2.95Å; L33-V37 VanDerWaalsContact O-N 3.16Å; L33-R194 PolarHBondContact O-NH1 2.76Å
34	A	46.6	Very low	47.3	Very low	42 Å²	42	89.9 Å²	89.9	35%	0.347	48%	0.483	S	S	.	.	H	α-helix	trans	-67.4	-44.6	171.2	0	0	0	0	0	110.7	G30 W31 L36 V37 I38	G30-A34 PolarHBondContact O-N 3.24Å; W31-A34 PolarHBondContact O-N 3.28Å; A34-L36 PolarHBondContact O-N 3.09Å; A34-V37 PolarHBondContact O-N 3.32Å; A34-I38 WeakPolarHBondContact O-CG1 3.37Å; A34-I38 PolarHBondContact O-N 3.2Å
35	L	54.6	Low	48	Very low	72 Å²	72	80.8 Å²	80.8	38%	0.377	44%	0.441	S	S	.	.	H	α-helix	trans	-63.8	-39.4	177.6	-143.4	108.2	0	0	0	112.2	W31 F32 V37 I38 R39 E239	W31-L35 WeakPolarHBondContact O-CB 3.43Å; W31-L35 PolarHBondContact O-N 3.38Å; F32-L35 PolarHBondContact O-N 3.16Å; L35-V37 VanDerWaalsContact C-N 3.34Å; L35-I38 PolarHBondContact O-N 3.34Å; L35-R39 WeakPolarHBondContact O-CB 3.33Å; L35-R39 PolarHBondContact O-N 2.98Å; L35-E239 VanDerWaalsContact CD1-OE1 3.29Å; L35-E239 WeakPolarHBondContact CD1-OE1 3.48Å
36	L	56.2	Low	48.6	Very low	81 Å²	81	80.7 Å²	80.7	42%	0.424	44%	0.44	S	S	.	.	H	α-helix	trans	-64.8	-37.4	174.4	-84.4	170.6	0	0	0	111.7	F32 L33 A34 S40	F32-L36 HydrophobicContact CD1-CD1 3.55Å; F32-L36 HydrophobicContact CD1-CG 3.98Å; F32-L36 HydrophobicContact CE1-CD1 3.66Å; F32-L36 HydrophobicContact CE1-CD2 4.36Å; F32-L36 HydrophobicContact CE1-CG 3.95Å; F32-L36 VanDerWaalsContact O-CB 3.32Å; F32-L36 WeakPolarHBondContact O-CB 3.33Å; F32-L36 WeakPolarHBondContact O-CG 3.5Å; F32-L36 PolarHBondContact O-N 2.78Å; L33-L36 HydrophobicContact CD2-CD1 4.37Å; A34-L36 PolarHBondContact O-N 3.09Å; L36-S40 WeakPolarHBondContact O-CB 3.19Å; L36-S40 PolarHBondContact O-N 3.02Å
37	V	55.1	Low	49.2	Very low	38 Å²	38	78.4 Å²	78.4	23%	0.23	43%	0.431	C	S	.	.	H	α-helix	trans	-70.1	-43.5	174.6	167.3	0	0	0	0	111.3	L33 A34 L35 R39 S40 I41	L33-V37 WeakPolarHBondContact O-CG2 3.26Å; L33-V37 PolarHBondContact O-N 2.95Å; L33-V37 VanDerWaalsContact O-N 3.16Å; A34-V37 PolarHBondContact O-N 3.32Å; L35-V37 VanDerWaalsContact C-N 3.34Å; V37-R39 VanDerWaalsContact C-N 3.32Å; V37-R39 PolarHBondContact O-N 3.22Å; V37-S40 PolarHBondContact O-N 2.91Å; V37-I41 HydrophobicContact CG1-CD1 3.75Å; V37-I41 HydrophobicContact CG1-CG1 4.34Å; V37-I41 WeakPolarHBondContact O-CB 3.42Å; V37-I41 WeakPolarHBondContact O-CD1 3.39Å; V37-I41 WeakPolarHBondContact O-CG1 3.44Å; V37-I41 PolarHBondContact O-N 3.44Å
38	I	54.1	Low	48.8	Very low	45 Å²	45	74.8 Å²	74.8	23%	0.231	40%	0.403	C	S	.	.	H	α-helix	trans	-62.6	-42.1	175.7	-68.6	170.3	0	0	0	110.4	A34 L35 I41 V42 E239	A34-I38 WeakPolarHBondContact O-CG1 3.37Å; A34-I38 PolarHBondContact O-N 3.2Å; L35-I38 PolarHBondContact O-N 3.34Å; I38-I41 WeakPolarHBondContact O-CB 2.98Å; I38-I41 PolarHBondContact O-N 3.23Å; I38-V42 VanDerWaalsContact O-CG2 3.26Å; I38-V42 WeakPolarHBondContact O-CG2 3.22Å; I38-V42 PolarHBondContact O-N 3.05Å; I38-E239 HydrophobicContact CD1-CB 4.35Å; I38-E239 WeakPolarHBondContact CD1-OE2 3.26Å; I38-E239 HydrophobicContact CG2-CB 4.38Å
39	R	53.6	Low	48.5	Very low	163 Å²	163	79.1 Å²	79.1	62%	0.615	41%	0.413	S	S	*	.	H	α-helix	trans	-65.6	-41.2	175	-169.2	175.8	-179	168.3	1.6	112.1	L35 V37 I41 V42 E43	L35-R39 WeakPolarHBondContact O-CB 3.33Å; L35-R39 PolarHBondContact O-N 2.98Å; V37-R39 VanDerWaalsContact C-N 3.32Å; V37-R39 PolarHBondContact O-N 3.22Å; R39-I41 VanDerWaalsContact C-N 3.34Å; R39-V42 WeakPolarHBondContact O-CB 3.39Å; R39-V42 PolarHBondContact O-N 3.4Å; R39-E43 WeakPolarHBondContact O-CB 3.44Å; R39-E43 PolarHBondContact O-N 2.93Å
40	S	55.2	Low	48.1	Very low	51 Å²	51	78.8 Å²	78.8	36%	0.357	42%	0.423	S	S	.	.	H	α-helix	trans	-63.4	-39.4	173.6	178.7	0	0	0	0	111.7	L36 V37 E43 S44	L36-S40 WeakPolarHBondContact O-CB 3.19Å; L36-S40 PolarHBondContact O-N 3.02Å; V37-S40 PolarHBondContact O-N 2.91Å; S40-E43 PolarHBondContact O-N 2.67Å; S40-S44 VanDerWaalsContact O-CB 3.25Å; S40-S44 WeakPolarHBondContact O-CB 3.34Å; S40-S44 PolarHBondContact O-N 2.9Å; S40-S44 PolarHBondContact O-OG 3.25Å
41	I	50.2	Low	47.5	Very low	6 Å²	6	85.1 Å²	85.1	3%	0.031	43%	0.434	C	S	.	.	H	α-helix	trans	-59.9	-50.3	171	-71.3	163.4	0	0	0	109.1	V37 I38 R39 E43 S44 I45 L184 Q187 L243	V37-I41 HydrophobicContact CG1-CD1 3.75Å; V37-I41 HydrophobicContact CG1-CG1 4.34Å; V37-I41 WeakPolarHBondContact O-CB 3.42Å; V37-I41 WeakPolarHBondContact O-CD1 3.39Å; V37-I41 WeakPolarHBondContact O-CG1 3.44Å; V37-I41 PolarHBondContact O-N 3.44Å; I38-I41 WeakPolarHBondContact O-CB 2.98Å; I38-I41 PolarHBondContact O-N 3.23Å; R39-I41 VanDerWaalsContact C-N 3.34Å; I41-E43 VanDerWaalsContact C-N 3.34Å; I41-E43 PolarHBondContact O-N 2.65Å; I41-S44 WeakPolarHBondContact O-CB 3.37Å; I41-S44 PolarHBondContact O-N 2.99Å; I41-I45 HydrophobicContact CG2-CD1 3.46Å; I41-I45 VanDerWaalsContact CG2-CD1 3.46Å; I41-I45 HydrophobicContact CG2-CG1 4.32Å; I41-I45 VanDerWaalsContact O-CB 3.28Å; I41-I45 WeakPolarHBondContact O-CB 3.4Å; I41-I45 WeakPolarHBondContact O-CD1 3.33Å; I41-I45 WeakPolarHBondContact O-CG1 3.5Å; I41-I45 PolarHBondContact O-N 3.29Å; I41-L184 HydrophobicContact CG2-CD1 4.39Å; I41-Q187 HydrophobicContact CD1-CB 4.12Å; I41-Q187 HydrophobicContact CG1-CB 3.89Å; I41-Q187 HydrophobicContact CG1-CG 4.2Å; I41-L243 HydrophobicContact CG2-CD1 3.96Å; I41-L243 HydrophobicContact CG2-CD2 4.47Å
42	V	52.5	Low	46.8	Very low	56 Å²	56	85.1 Å²	85.1	34%	0.339	44%	0.442	S	S	.	.	H	α-helix	trans	-58.2	-41.9	177.4	167.7	0	0	0	0	112.5	I38 R39 I45 S46 M246	I38-V42 VanDerWaalsContact O-CG2 3.26Å; I38-V42 WeakPolarHBondContact O-CG2 3.22Å; I38-V42 PolarHBondContact O-N 3.05Å; R39-V42 WeakPolarHBondContact O-CB 3.39Å; R39-V42 PolarHBondContact O-N 3.4Å; V42-I45 CarbonylContact O-C 3.48Å; V42-I45 PolarHBondContact O-N 3.14Å; V42-S46 PolarHBondContact O-N 3.49Å; V42-M246 HydrophobicContact CG1-CE 4.15Å; V42-M246 HydrophobicContact CG2-CE 4.36Å
43	E	48.8	Very low	46.2	Very low	125 Å²	125	83.9 Å²	83.9	58%	0.584	44%	0.443	S	S	*	.	H	α-helix	trans	-74.6	-35.9	-179.1	-152.6	146.6	-143.9	0	0	111.3	R39 S40 I41 I45 S46	R39-E43 WeakPolarHBondContact O-CB 3.44Å; R39-E43 PolarHBondContact O-N 2.93Å; S40-E43 PolarHBondContact O-N 2.67Å; I41-E43 VanDerWaalsContact C-N 3.34Å; I41-E43 PolarHBondContact O-N 2.65Å; E43-I45 VanDerWaalsContact C-N 3.3Å; E43-I45 PolarHBondContact O-N 3.35Å; E43-S46 WeakPolarHBondContact O-CB 3.45Å; E43-S46 PolarHBondContact O-N 3.13Å; E43-S46 PolarHBondContact O-OG 3.46Å
44	S	46.2	Very low	45.3	Very low	24 Å²	24	85.3 Å²	85.3	17%	0.168	45%	0.451	C	S	.	.	H	α-helix	trans	-63.2	-39.1	170.1	-54.3	0	0	0	0	111.2	S40 I41 R183	S40-S44 VanDerWaalsContact O-CB 3.25Å; S40-S44 WeakPolarHBondContact O-CB 3.34Å; S40-S44 PolarHBondContact O-N 2.9Å; S40-S44 PolarHBondContact O-OG 3.25Å; I41-S44 WeakPolarHBondContact O-CB 3.37Å; I41-S44 PolarHBondContact O-N 2.99Å; S44-R183 PolarHBondContact OG-NH2 3.49Å
45	I	45.8	Very low	45	Very low	7 Å²	7	91 Å²	91	4%	0.036	48%	0.475	C	S	.	.	H	α-helix	trans	-69.6	-34.8	175.5	-70.1	168.3	0	0	0	109.7	I41 V42 E43 V47 T48 L184 L243 M246 L247 R250	I41-I45 HydrophobicContact CG2-CD1 3.46Å; I41-I45 VanDerWaalsContact CG2-CD1 3.46Å; I41-I45 HydrophobicContact CG2-CG1 4.32Å; I41-I45 VanDerWaalsContact O-CB 3.28Å; I41-I45 WeakPolarHBondContact O-CB 3.4Å; I41-I45 WeakPolarHBondContact O-CD1 3.33Å; I41-I45 WeakPolarHBondContact O-CG1 3.5Å; I41-I45 PolarHBondContact O-N 3.29Å; V42-I45 CarbonylContact O-C 3.48Å; V42-I45 PolarHBondContact O-N 3.14Å; E43-I45 VanDerWaalsContact C-N 3.3Å; E43-I45 PolarHBondContact O-N 3.35Å; I45-V47 PolarHBondContact O-N 2.99Å; I45-T48 PolarHBondContact O-N 2.9Å; I45-T48 PolarHBondContact O-OG1 3.04Å; I45-L184 HydrophobicContact CD1-CD1 4.06Å; I45-L184 HydrophobicContact CG1-CD1 4.22Å; I45-L243 HydrophobicContact CD1-CD1 3.41Å; I45-L243 VanDerWaalsContact CD1-CD1 3.41Å; I45-M246 HydrophobicContact CB-SD 4.15Å; I45-M246 HydrophobicContact CG2-CG 3.96Å; I45-M246 HydrophobicContact CG2-SD 3.35Å; I45-M246 WeakPolarHBondContact CG2-SD 3.25Å; I45-L247 HydrophobicContact CD1-CD2 4.46Å; I45-R250 VanDerWaalsContact C-NH2 3.33Å; I45-R250 VanDerWaalsContact CG2-NH1 3.28Å; I45-R250 VanDerWaalsContact CG2-NH2 3.31Å; I45-R250 PolarHBondContact O-NH1 3.49Å; I45-R250 PolarHBondContact O-NH2 3.23Å
46	S	44.4	Very low	44.1	Very low	81 Å²	81	96.3 Å²	96.3	57%	0.566	50%	0.496	S	S	*	.	H	α-helix	trans	-54.4	-20.4	178.7	77.3	0	0	0	0	115.7	V42 E43	V42-S46 PolarHBondContact O-N 3.49Å; E43-S46 WeakPolarHBondContact O-CB 3.45Å; E43-S46 PolarHBondContact O-N 3.13Å; E43-S46 PolarHBondContact O-OG 3.46Å
47	V	46.9	Very low	43.2	Very low	102 Å²	102	98 Å²	98	62%	0.618	51%	0.512	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-11.4	-179.7	-172.5	0	0	0	0	113.7	I45 R49	I45-V47 PolarHBondContact O-N 2.99Å; V47-R49 PolarHBondContact O-N 2.92Å
48	T	38.3	Very low	42.2	Very low	49 Å²	49	100.9 Å²	100.9	30%	0.301	53%	0.533	S	S	.	.			trans	-81.6	82.1	177.3	24	0	0	0	0	111.9	I45 Q180 R250	I45-T48 PolarHBondContact O-N 2.9Å; I45-T48 PolarHBondContact O-OG1 3.04Å; T48-Q180 HydrophobicContact CG2-CB 4.05Å; T48-Q180 HydrophobicContact CG2-CG 4.31Å; T48-R250 PolarHBondContact O-NH1 3.43Å; T48-R250 VanDerWaalsContact O-NH1 3.08Å; T48-R250 PolarHBondContact OG1-NH1 3.08Å
49	R	34.4	Very low	41.3	Very low	245 Å²	245	107.9 Å²	107.9	93%	0.925	57%	0.565	S	S	*	*			trans	-109	82.6	156.8	-156.6	-179.1	-169.2	-169.6	3.2	107.6	V47	V47-R49 PolarHBondContact O-N 2.92Å
50	A	38.2	Very low	40.3	Very low	82 Å²	82	107.8 Å²	107.8	68%	0.678	57%	0.572	S	S	*	*	P	Polyproline II helix	trans	-75.5	124.3	166.8	0	0	0	0	0	107.7	L52	A50-L52 PolarHBondContact O-N 3.34Å
51	K	31.8	Very low	39.3	Very low	192 Å²	192	111.8 Å²	111.8	84%	0.835	59%	0.594	S	S	*	*	P	Polyproline II helix	trans	-76.1	120	168.7	-173.8	178.1	178.2	-174.7	0	106.6	V53	K51-V53 PolarHBondContact O-N 3.4Å
52	L	32.2	Very low	38.8	Very low	113 Å²	113	117 Å²	117	59%	0.592	63%	0.626	S	S	*	*	P	Polyproline II helix	trans	-62.1	120.7	171	-144.2	83.3	0	0	0	107.8	A50 P252	A50-L52 PolarHBondContact O-N 3.34Å; L52-P252 HydrophobicContact CD1-CG 3.75Å; L52-P252 HydrophobicContact CD2-CG 3.82Å; L52-P252 HydrophobicContact CG-CG 4.34Å
53	V	36.2	Very low	37.9	Very low	92 Å²	92	119.5 Å²	119.5	56%	0.558	64%	0.643	S	S	*	*			trans	-88.4	113.4	170	178.8	0	0	0	0	105.9	K51 L55	K51-V53 PolarHBondContact O-N 3.4Å; V53-L55 PolarHBondContact O-N 3.04Å
54	N	30.8	Very low	37.4	Very low	125 Å²	125	119 Å²	119	67%	0.668	65%	0.654	S	S	*	*			trans	-62.7	126.8	171.9	-69.7	-25.7	0	0	0	108.3	F56	N54-F56 PolarHBondContact O-N 3.17Å
55	L	39.7	Very low	36.8	Very low	162 Å²	162	125.9 Å²	125.9	85%	0.848	68%	0.683	S	S	*	*	S	Bend	trans	-66.4	1.1	-179.9	-100.2	87.2	0	0	0	114.7	V53	V53-L55 PolarHBondContact O-N 3.04Å
56	F	34.6	Very low	36.6	Very low	183 Å²	183	131.6 Å²	131.6	80%	0.803	72%	0.721	S	S	*	*	S	Bend	trans	-117.9	101.3	170.2	-60.9	-76.7	0	0	0	107.6	N54 S58	N54-F56 PolarHBondContact O-N 3.17Å; F56-S58 VanDerWaalsContact C-N 3.33Å; F56-S58 PolarHBondContact O-N 3.12Å
57	P	37.2	Very low	36.6	Very low	118 Å²	118	131.6 Å²	131.6	77%	0.766	72%	0.717	S	S	*	*			trans	-63.3	103.9	165.5	-6.8	21.9	0	0	0	105.9	E59	P57-E59 PolarHBondContact O-N 3.31Å; P57-E59 VanDerWaalsContact O-N 3.16Å
58	S	34.9	Very low	36.5	Very low	98 Å²	98	135 Å²	135	69%	0.685	73%	0.731	S	S	*	*			trans	-53	122.8	153.2	48.2	0	0	0	0	105.4	F56 E60	F56-S58 VanDerWaalsContact C-N 3.33Å; F56-S58 PolarHBondContact O-N 3.12Å; S58-E60 PolarHBondContact O-N 2.9Å
59	E	34.6	Very low	36.7	Very low	191 Å²	191	143.2 Å²	143.2	89%	0.893	76%	0.756	S	S	*	*			trans	-55.1	73	-178	-66.9	174.7	149.7	0	0	111.6	P57 V61	P57-E59 PolarHBondContact O-N 3.31Å; P57-E59 VanDerWaalsContact O-N 3.16Å; E59-V61 PolarHBondContact O-N 2.94Å
60	E	32.7	Very low	37.4	Very low	161 Å²	161	138.3 Å²	138.3	75%	0.752	74%	0.744	S	S	*	*			trans	-90.3	98	160.4	-83.3	-167.9	161.3	0	0	105.9	S58 V62	S58-E60 PolarHBondContact O-N 2.9Å; E60-V62 PolarHBondContact O-N 3.28Å
61	V	34.2	Very low	38	Very low	136 Å²	136	143.5 Å²	143.5	82%	0.824	75%	0.751	S	S	*	*			trans	-60.7	86.2	167.4	-179.1	0	0	0	0	107.6	E59	E59-V61 PolarHBondContact O-N 2.94Å
62	V	40.3	Very low	38.9	Very low	115 Å²	115	141.5 Å²	141.5	70%	0.697	75%	0.749	S	S	*	*			trans	-80.7	123.2	168	-177.9	0	0	0	0	107.5	E60 S64	E60-V62 PolarHBondContact O-N 3.28Å; V62-S64 PolarHBondContact O-N 3.37Å
63	P	34	Very low	40.2	Very low	108 Å²	108	137.5 Å²	137.5	70%	0.701	73%	0.733	S	S	*	*			trans	-63.1	133.7	-174	-18.6	30.5	0	0	0	111.8	E65	P63-E65 PolarHBondContact O-N 3.26Å; P63-E65 VanDerWaalsContact O-N 3.08Å
64	S	37.3	Very low	41.4	Very low	116 Å²	116	137.4 Å²	137.4	81%	0.811	73%	0.728	S	S	*	*			trans	-66.8	99.4	176	45	0	0	0	0	111	V62 P66	V62-S64 PolarHBondContact O-N 3.37Å; S64-P66 WeakPolarHBondContact O-CD 3.44Å
65	E	34	Very low	43	Very low	167 Å²	167	135.7 Å²	135.7	78%	0.78	72%	0.719	S	S	*	*			trans	-86	116.1	158.3	-75.7	-166.9	173.5	0	0	109.3	P63 T67	P63-E65 PolarHBondContact O-N 3.26Å; P63-E65 VanDerWaalsContact O-N 3.08Å; E65-T67 PolarHBondContact O-N 3.17Å; E65-T67 VanDerWaalsContact O-N 3.16Å
66	P	42.7	Very low	44.2	Very low	128 Å²	128	129.8 Å²	129.8	83%	0.831	69%	0.687	S	S	*	*			trans	-79.9	101.3	177.9	31.3	-30.5	0	0	0	108.7	S64	S64-P66 WeakPolarHBondContact O-CD 3.44Å
67	T	43.6	Very low	45.8	Very low	81 Å²	81	124.7 Å²	124.7	50%	0.497	67%	0.669	S	S	.	*			trans	-108.4	110	173.3	61.4	0	0	0	0	110.7	E65 R69	E65-T67 PolarHBondContact O-N 3.17Å; E65-T67 VanDerWaalsContact O-N 3.16Å; T67-R69 PolarHBondContact O-N 3.5Å
68	L	44.8	Very low	47.1	Very low	172 Å²	172	125.6 Å²	125.6	90%	0.901	66%	0.663	S	S	*	*			trans	-60	30.7	168.7	-73.7	160.2	0	0	0	113.7	H70	L68-H70 VanDerWaalsContact C-N 3.34Å
69	R	42.6	Very low	48.5	Very low	223 Å²	223	126.6 Å²	126.6	84%	0.842	66%	0.655	S	S	*	*			trans	-95.1	19.3	177	-64.9	-167.8	-170.8	-157.6	5.5	112.9	T67 K71	T67-R69 PolarHBondContact O-N 3.5Å; R69-K71 PolarHBondContact O-N 2.94Å; R69-K71 VanDerWaalsContact O-N 3.12Å
70	H	49.4	Very low	49.8	Very low	142 Å²	142	118.4 Å²	118.4	66%	0.657	62%	0.617	S	S	*	*	G	3₁₀ helix	trans	-68.5	-0.7	175.1	-75	-70.1	0	0	0	115	L68 N72	L68-H70 VanDerWaalsContact C-N 3.34Å; H70-N72 PolarHBondContact O-N 3.31Å
71	K	49.4	Very low	51.6	Low	190 Å²	190	114.1 Å²	114.1	83%	0.826	61%	0.609	S	S	*	*	G	3₁₀ helix	trans	-78.6	-6.7	-170.7	-71.2	-170.4	176.4	-176.7	0	116.9	R69	R69-K71 PolarHBondContact O-N 2.94Å; R69-K71 VanDerWaalsContact O-N 3.12Å
72	N	52.5	Low	52.9	Low	150 Å²	150	113.1 Å²	113.1	80%	0.802	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-122.7	21.1	-176.3	-66.2	-7.2	0	0	0	114	H70 I74	H70-N72 PolarHBondContact O-N 3.31Å; N72-I74 PolarHBondContact O-N 2.94Å
73	A	58.6	Low	54.3	Low	29 Å²	29	111.6 Å²	111.6	24%	0.24	57%	0.573	C	S	.	*			trans	-76.2	99.2	171	0	0	0	0	0	109.5	L75 V168 L172	A73-L75 PolarHBondContact O-N 2.91Å; A73-V168 HydrophobicContact CB-CG1 4.39Å; A73-L172 HydrophobicContact CB-CD1 3.64Å
74	I	61.7	Low	56.1	Low	90 Å²	90	113.9 Å²	113.9	46%	0.462	57%	0.572	S	S	.	*			trans	-65.1	104.3	174.1	-53.6	169.9	0	0	0	108.2	N72 E78 K79	N72-I74 PolarHBondContact O-N 2.94Å; I74-E78 WeakPolarHBondContact CA-OE2 3.3Å; I74-E78 HydrophobicContact CG2-CB 3.96Å; I74-E78 WeakPolarHBondContact CG2-OE2 3.46Å; I74-K79 HydrophobicContact CG2-CD 3.96Å; I74-K79 HydrophobicContact CG2-CG 3.62Å
75	L	65.1	Low	57.7	Low	90 Å²	90	111 Å²	111	47%	0.471	56%	0.56	S	S	.	*			trans	-70.4	158	177.5	-78.8	142.9	0	0	0	110.8	A73 D77 E78 K79	A73-L75 PolarHBondContact O-N 2.91Å; L75-D77 PolarHBondContact O-N 3.42Å; L75-E78 HydrophobicContact CB-CG 4.48Å; L75-E78 WeakPolarHBondContact O-CB 3.15Å; L75-E78 PolarHBondContact O-N 2.78Å; L75-K79 PolarHBondContact O-N 2.91Å
76	L	63.1	Low	59.6	Low	37 Å²	37	112.1 Å²	112.1	19%	0.194	56%	0.557	C	S	.	*	H	α-helix	trans	-56.9	-40	179.7	-81.8	168.9	0	0	0	111.7	E78 K79 D80 Y83 A175 Q179	L76-E78 PolarHBondContact O-N 3.17Å; L76-K79 PolarHBondContact O-N 3.24Å; L76-D80 PolarHBondContact O-N 3.05Å; L76-Y83 HydrophobicContact CB-CD1 4.47Å; L76-Y83 HydrophobicContact CB-CD2 3.89Å; L76-Y83 HydrophobicContact CB-CG 3.78Å; L76-Y83 HydrophobicContact CD1-CD1 4.16Å; L76-Y83 HydrophobicContact CD1-CD2 4.43Å; L76-Y83 HydrophobicContact CD1-CE1 4.28Å; L76-Y83 HydrophobicContact CD1-CG 4.23Å; L76-Y83 HydrophobicContact CD2-CD2 4.18Å; L76-Y83 HydrophobicContact CD2-CE2 4.18Å; L76-Y83 HydrophobicContact CG-CD2 4.41Å; L76-Y83 HydrophobicContact CG-CG 4.48Å; L76-A175 HydrophobicContact CD1-CB 3.44Å; L76-A175 VanDerWaalsContact CD1-CB 3.44Å; L76-A175 HydrophobicContact CD2-CB 3.93Å; L76-A175 HydrophobicContact CG-CB 3.63Å; L76-Q179 HydrophobicContact CD2-CG 4.05Å
77	D	68.1	Low	61	Low	77 Å²	77	112.8 Å²	112.8	41%	0.412	56%	0.559	S	S	.	*	H	α-helix	trans	-56.4	-29.8	177.2	-54.1	26.7	0	0	0	112.8	L75 K84	L75-D77 PolarHBondContact O-N 3.42Å; D77-K84 HydrophobicContact CB-CB 4.47Å
78	E	65.7	Low	62.1	Low	136 Å²	136	111.5 Å²	111.5	64%	0.636	55%	0.551	S	S	*	*	H	α-helix	trans	-81.9	-29	177.5	-62.8	-175.9	170.1	0	0	112.6	I74 L75 L76	I74-E78 WeakPolarHBondContact CA-OE2 3.3Å; I74-E78 HydrophobicContact CG2-CB 3.96Å; I74-E78 WeakPolarHBondContact CG2-OE2 3.46Å; L75-E78 HydrophobicContact CB-CG 4.48Å; L75-E78 WeakPolarHBondContact O-CB 3.15Å; L75-E78 PolarHBondContact O-N 2.78Å; L76-E78 PolarHBondContact O-N 3.17Å
79	K	64	Low	63.2	Low	119 Å²	119	106.1 Å²	106.1	52%	0.517	53%	0.528	S	S	.	.	H	α-helix	trans	-92.5	-31.9	-178.7	-81.1	179.7	177.8	-178.9	0	113.6	I74 L75 L76	I74-K79 HydrophobicContact CG2-CD 3.96Å; I74-K79 HydrophobicContact CG2-CG 3.62Å; L75-K79 PolarHBondContact O-N 2.91Å; L76-K79 PolarHBondContact O-N 3.24Å
80	D	62	Low	64.3	Low	19 Å²	19	104.7 Å²	104.7	10%	0.102	53%	0.528	C	S	.	.			trans	-141.9	114.2	-169.6	-172.5	-7.8	0	0	0	109.2	L76 R82 Y83 N419	L76-D80 PolarHBondContact O-N 3.05Å; D80-R82 PolarHBondContact O-N 3.39Å; D80-R82 WeakPolarHBondContact OD1-CB 3.38Å; D80-R82 WeakPolarHBondContact OD1-CG 3.47Å; D80-R82 IonicContact OD1-CZ 3.63Å; D80-R82 PolarHBondContact OD1-N 2.69Å; D80-R82 IonicContact OD1-NE 2.76Å; D80-R82 PolarHBondContact OD1-NE 3.38Å; D80-R82 VanDerWaalsContact OD1-NE 3.09Å; D80-R82 IonicContact OD2-CZ 2.8Å; D80-R82 IonicContact OD2-NE 3.93Å; D80-R82 PolarHBondContact OD2-NE 3.37Å; D80-R82 IonicContact OD2-NH2 2.65Å; D80-R82 PolarHBondContact OD2-NH2 3.49Å; D80-Y83 HydrophobicContact CB-CD2 3.96Å; D80-Y83 HydrophobicContact CB-CE2 4.39Å; D80-Y83 PolarHBondContact O-N 3.02Å; D80-N419 PolarHBondContact OD1-ND2 3.4Å
81	A	69.3	Low	65.3	Low	72 Å²	72	102.4 Å²	102.4	60%	0.595	53%	0.528	S	S	*	.	G	3₁₀ helix	trans	-57.8	-20.7	-177.2	0	0	0	0	0	113	Y83 K84	A81-Y83 PolarHBondContact O-N 3.13Å; A81-K84 WeakPolarHBondContact O-CB 3.43Å; A81-K84 PolarHBondContact O-N 3.38Å
82	R	62.9	Low	66	Low	114 Å²	114	96.7 Å²	96.7	43%	0.43	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-60	-30.8	174.9	-67.8	-176.7	-72.2	-166.4	4	113.6	D80 N419	D80-R82 PolarHBondContact O-N 3.39Å; D80-R82 WeakPolarHBondContact OD1-CB 3.38Å; D80-R82 WeakPolarHBondContact OD1-CG 3.47Å; D80-R82 IonicContact OD1-CZ 3.63Å; D80-R82 PolarHBondContact OD1-N 2.69Å; D80-R82 IonicContact OD1-NE 2.76Å; D80-R82 PolarHBondContact OD1-NE 3.38Å; D80-R82 VanDerWaalsContact OD1-NE 3.09Å; D80-R82 IonicContact OD2-CZ 2.8Å; D80-R82 IonicContact OD2-NE 3.93Å; D80-R82 PolarHBondContact OD2-NE 3.37Å; D80-R82 IonicContact OD2-NH2 2.65Å; D80-R82 PolarHBondContact OD2-NH2 3.49Å; R82-N419 WeakPolarHBondContact CD-OD1 3.42Å; R82-N419 PolarHBondContact NE-ND2 3.31Å; R82-N419 PolarHBondContact NH1-OD1 3.28Å
83	Y	69	Low	66.8	Low	84 Å²	84	94.5 Å²	94.5	33%	0.329	49%	0.494	S	S	.	.	G	3₁₀ helix	trans	-97.9	-5.5	-180	-60.9	-79.9	0	0	0	112.5	L76 D80 A81 G85	L76-Y83 HydrophobicContact CB-CD1 4.47Å; L76-Y83 HydrophobicContact CB-CD2 3.89Å; L76-Y83 HydrophobicContact CB-CG 3.78Å; L76-Y83 HydrophobicContact CD1-CD1 4.16Å; L76-Y83 HydrophobicContact CD1-CD2 4.43Å; L76-Y83 HydrophobicContact CD1-CE1 4.28Å; L76-Y83 HydrophobicContact CD1-CG 4.23Å; L76-Y83 HydrophobicContact CD2-CD2 4.18Å; L76-Y83 HydrophobicContact CD2-CE2 4.18Å; L76-Y83 HydrophobicContact CG-CD2 4.41Å; L76-Y83 HydrophobicContact CG-CG 4.48Å; D80-Y83 HydrophobicContact CB-CD2 3.96Å; D80-Y83 HydrophobicContact CB-CE2 4.39Å; D80-Y83 PolarHBondContact O-N 3.02Å; A81-Y83 PolarHBondContact O-N 3.13Å; Y83-G85 VanDerWaalsContact C-N 3.28Å; Y83-G85 PolarHBondContact O-N 2.99Å
84	K	72.7	Confident	66.9	Low	156 Å²	156	99.6 Å²	99.6	68%	0.678	52%	0.517	S	S	*	.			trans	-67.8	89.4	178.3	-170.4	-179.6	-178.5	-178.8	0	109.2	D77 A81	D77-K84 HydrophobicContact CB-CB 4.47Å; A81-K84 WeakPolarHBondContact O-CB 3.43Å; A81-K84 PolarHBondContact O-N 3.38Å
85	G	70.4	Confident	66.8	Low	55 Å²	55	97.4 Å²	97.4	57%	0.567	51%	0.51	S	S	*	.	P	Polyproline II helix	trans	-57.7	146.1	176.4	0	0	0	0	0	111.2	Y83	Y83-G85 VanDerWaalsContact C-N 3.28Å; Y83-G85 PolarHBondContact O-N 2.99Å
86	R	73.6	Confident	66.3	Low	190 Å²	190	95.5 Å²	95.5	72%	0.717	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-86.7	130.1	168.6	-171.9	178.1	-177.5	-172.9	-2.1	108.1	V88	R86-V88 WeakPolarHBondContact O-CG2 3.43Å; R86-V88 PolarHBondContact O-N 3.29Å
87	V	72.1	Confident	65.8	Low	143 Å²	143	97.2 Å²	97.2	87%	0.867	51%	0.513	S	S	*	.	P	Polyproline II helix	trans	-70.1	120.8	170.4	-179	0	0	0	0	107.9
88	V	67	Low	64.7	Low	54 Å²	54	100.2 Å²	100.2	33%	0.327	53%	0.525	S	S	.	.			trans	-121.7	142.6	177.6	-124.4	0	0	0	0	109	R86 N92 F96	R86-V88 WeakPolarHBondContact O-CG2 3.43Å; R86-V88 PolarHBondContact O-N 3.29Å; V88-N92 HydrophobicContact CG1-CB 3.94Å; V88-F96 HydrophobicContact CG1-CD2 3.77Å; V88-F96 HydrophobicContact CG1-CE2 3.25Å; V88-F96 HydrophobicContact CG1-CZ 3.69Å
89	S	68.8	Low	63.6	Low	59 Å²	59	98.9 Å²	98.9	41%	0.413	52%	0.519	S	S	.	.			trans	-69.8	148.7	169.2	56.8	0	0	0	0	109.5	S91 N92 L93	S89-S91 PolarHBondContact O-N 2.91Å; S89-S91 VanDerWaalsContact O-N 3.16Å; S89-S91 PolarHBondContact OG-OG 2.89Å; S89-N92 WeakPolarHBondContact O-CA 3.18Å; S89-N92 PolarHBondContact O-N 3.49Å; S89-N92 PolarHBondContact OG-ND2 3.24Å; S89-N92 PolarHBondContact OG-OD1 3.34Å; S89-L93 PolarHBondContact O-N 2.87Å
90	F	64.4	Low	62.7	Low	192 Å²	192	100.2 Å²	100.2	84%	0.842	53%	0.526	S	S	*	.	G	3₁₀ helix	trans	-54.9	-35.7	-179.8	-168	-97	0	0	0	112.4	N92 L93	F90-N92 PolarHBondContact O-N 3.12Å; F90-L93 WeakPolarHBondContact O-CB 3.43Å; F90-L93 PolarHBondContact O-N 3.18Å; F90-L93 VanDerWaalsContact O-N 3.13Å
91	S	71.4	Confident	61.7	Low	94 Å²	94	103.4 Å²	103.4	66%	0.657	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-60	-25.8	174.3	62.6	0	0	0	0	114.7	S89	S89-S91 PolarHBondContact O-N 2.91Å; S89-S91 VanDerWaalsContact O-N 3.16Å; S89-S91 PolarHBondContact OG-OG 2.89Å
92	N	64.2	Low	60.2	Low	71 Å²	71	106.3 Å²	106.3	38%	0.38	54%	0.542	S	S	.	.	G	3₁₀ helix	trans	-102.1	2.7	-177.7	-61.9	3.2	0	0	0	110.6	V88 S89 F90 D94 S95 F96	V88-N92 HydrophobicContact CG1-CB 3.94Å; S89-N92 WeakPolarHBondContact O-CA 3.18Å; S89-N92 PolarHBondContact O-N 3.49Å; S89-N92 PolarHBondContact OG-ND2 3.24Å; S89-N92 PolarHBondContact OG-OD1 3.34Å; F90-N92 PolarHBondContact O-N 3.12Å; N92-D94 VanDerWaalsContact C-N 3.35Å; N92-S95 PolarHBondContact O-OG 3Å; N92-S95 VanDerWaalsContact O-OG 3.1Å; N92-F96 HydrophobicContact CB-CE2 4.33Å; N92-F96 WeakPolarHBondContact O-CD2 3.43Å
93	L	69.1	Low	59.2	Low	104 Å²	104	105.7 Å²	105.7	55%	0.545	55%	0.551	S	S	.	*	H	α-helix	trans	-67.1	-39	-178.8	-174.1	62.7	0	0	0	111.4	S89 F90	S89-L93 PolarHBondContact O-N 2.87Å; F90-L93 WeakPolarHBondContact O-CB 3.43Å; F90-L93 PolarHBondContact O-N 3.18Å; F90-L93 VanDerWaalsContact O-N 3.13Å
94	D	60.5	Low	57.6	Low	135 Å²	135	109.2 Å²	109.2	72%	0.722	57%	0.57	S	S	*	*	H	α-helix	trans	-68.9	-40.1	178.8	-105.8	-1.2	0	0	0	112.6	N92 F96 S97 E98	N92-D94 VanDerWaalsContact C-N 3.35Å; D94-F96 PolarHBondContact O-N 2.99Å; D94-S97 WeakPolarHBondContact O-CB 3.47Å; D94-S97 PolarHBondContact O-N 3.22Å; D94-S97 VanDerWaalsContact O-N 3.13Å; D94-E98 PolarHBondContact O-N 3.3Å
95	S	60.1	Low	55.7	Low	45 Å²	45	108.1 Å²	108.1	32%	0.315	56%	0.562	S	S	.	*	H	α-helix	trans	-65.1	-25.9	-178.5	67.5	0	0	0	0	112.7	N92 E98 E99	N92-S95 PolarHBondContact O-OG 3Å; N92-S95 VanDerWaalsContact O-OG 3.1Å; S95-E98 PolarHBondContact O-N 3.45Å; S95-E99 WeakPolarHBondContact O-CG 3.39Å; S95-E99 PolarHBondContact O-N 3.5Å
96	F	53.1	Low	54	Low	50 Å²	50	109.1 Å²	109.1	22%	0.219	57%	0.565	C	S	.	*	H	α-helix	trans	-75.8	-30.4	176.8	-84.7	-103.9	0	0	0	112.9	V88 N92 D94 E98 E99 E100	V88-F96 HydrophobicContact CG1-CD2 3.77Å; V88-F96 HydrophobicContact CG1-CE2 3.25Å; V88-F96 HydrophobicContact CG1-CZ 3.69Å; N92-F96 HydrophobicContact CB-CE2 4.33Å; N92-F96 WeakPolarHBondContact O-CD2 3.43Å; D94-F96 PolarHBondContact O-N 2.99Å; F96-E98 PolarHBondContact O-N 3.41Å; F96-E99 PolarHBondContact O-N 3.02Å; F96-E100 PolarHBondContact O-N 2.99Å; F96-E100 VanDerWaalsContact O-N 3.13Å
97	S	54	Low	52.1	Low	72 Å²	72	108.5 Å²	108.5	50%	0.503	57%	0.57	S	S	.	*	H	α-helix	trans	-63.3	-34.2	172.5	-166.2	0	0	0	0	110.6	D94 E101	D94-S97 WeakPolarHBondContact O-CB 3.47Å; D94-S97 PolarHBondContact O-N 3.22Å; D94-S97 VanDerWaalsContact O-N 3.13Å; S97-E101 WeakPolarHBondContact O-CB 3Å; S97-E101 WeakPolarHBondContact O-CG 3.33Å; S97-E101 PolarHBondContact O-N 2.91Å
98	E	44.2	Very low	50.2	Low	141 Å²	141	109.5 Å²	109.5	66%	0.659	57%	0.565	S	S	*	*	H	α-helix	trans	-78.1	-38.4	178	-63.3	-174.6	166.7	0	0	112.9	D94 S95 F96 E101 E102	D94-E98 PolarHBondContact O-N 3.3Å; S95-E98 PolarHBondContact O-N 3.45Å; F96-E98 PolarHBondContact O-N 3.41Å; E98-E101 PolarHBondContact O-N 2.93Å; E98-E102 PolarHBondContact O-N 3.02Å
99	E	43.6	Very low	48.5	Very low	108 Å²	108	116.6 Å²	116.6	51%	0.505	59%	0.587	S	S	.	*	H	α-helix	trans	-67.9	-41.2	178.7	-76.4	-178.3	-167.6	0	0	112.9	S95 F96 E101 E102 V103	S95-E99 WeakPolarHBondContact O-CG 3.39Å; S95-E99 PolarHBondContact O-N 3.5Å; F96-E99 PolarHBondContact O-N 3.02Å; E99-E101 VanDerWaalsContact C-N 3.33Å; E99-E102 PolarHBondContact O-N 3.16Å; E99-V103 WeakPolarHBondContact O-CG2 3.1Å; E99-V103 PolarHBondContact O-N 3.28Å
100	E	44.3	Very low	46.7	Very low	146 Å²	146	120.1 Å²	120.1	68%	0.682	60%	0.601	S	S	*	*	H	α-helix	trans	-66.4	-37.3	174.4	-77.4	-170.4	172.3	0	0	111.5	F96 E102 V103 E104	F96-E100 PolarHBondContact O-N 2.99Å; F96-E100 VanDerWaalsContact O-N 3.13Å; E100-E102 VanDerWaalsContact C-N 3.31Å; E100-E102 PolarHBondContact O-N 3.29Å; E100-V103 PolarHBondContact O-N 2.72Å; E100-E104 PolarHBondContact O-N 3.32Å
101	E	41.6	Very low	45.2	Very low	87 Å²	87	116 Å²	116	41%	0.407	60%	0.597	S	S	.	*	H	α-helix	trans	-63.7	-34.7	172.4	-82.5	-166.9	-162.8	0	0	112.7	S97 E98 E99 E104 R105	S97-E101 WeakPolarHBondContact O-CB 3Å; S97-E101 WeakPolarHBondContact O-CG 3.33Å; S97-E101 PolarHBondContact O-N 2.91Å; E98-E101 PolarHBondContact O-N 2.93Å; E99-E101 VanDerWaalsContact C-N 3.33Å; E101-E104 PolarHBondContact O-N 2.67Å; E101-R105 WeakPolarHBondContact O-CB 3.19Å; E101-R105 PolarHBondContact O-N 3.03Å; E101-R105 IonicContact OE2-NH2 2.58Å; E101-R105 PolarHBondContact OE2-NH2 3.3Å
102	E	37.4	Very low	43.3	Very low	133 Å²	133	119.2 Å²	119.2	62%	0.621	61%	0.606	S	S	*	*	H	α-helix	trans	-68.4	-37.3	177.4	-123.6	-173.2	-176.6	0	0	112.1	E98 E99 E100 R105 A106	E98-E102 PolarHBondContact O-N 3.02Å; E99-E102 PolarHBondContact O-N 3.16Å; E100-E102 VanDerWaalsContact C-N 3.31Å; E100-E102 PolarHBondContact O-N 3.29Å; E102-R105 PolarHBondContact O-N 3.26Å; E102-A106 WeakPolarHBondContact O-CB 3.47Å; E102-A106 PolarHBondContact O-N 2.74Å
103	V	41.2	Very low	41.7	Very low	101 Å²	101	123.2 Å²	123.2	61%	0.612	63%	0.626	S	S	*	*	H	α-helix	trans	-68.3	-41.1	175.4	-179.7	0	0	0	0	111.1	E99 E100 A106 E107	E99-V103 WeakPolarHBondContact O-CG2 3.1Å; E99-V103 PolarHBondContact O-N 3.28Å; E100-V103 PolarHBondContact O-N 2.72Å; V103-A106 PolarHBondContact O-N 3.01Å; V103-E107 PolarHBondContact O-N 3.47Å
104	E	36.3	Very low	39.9	Very low	158 Å²	158	123.1 Å²	123.1	74%	0.738	63%	0.634	S	S	*	*	H	α-helix	trans	-70.6	-34.1	175.3	-70.3	-159.7	162.7	0	0	112.7	E100 E101 E107	E100-E104 PolarHBondContact O-N 3.32Å; E101-E104 PolarHBondContact O-N 2.67Å; E104-E107 PolarHBondContact O-N 3.13Å
105	R	31.7	Very low	38.6	Very low	133 Å²	133	125 Å²	125	50%	0.502	64%	0.638	S	S	.	*	H	α-helix	trans	-71.2	-31.7	176.8	-163	179.9	-58.8	141.1	-1.5	111.9	E101 E102 E107 H108	E101-R105 WeakPolarHBondContact O-CB 3.19Å; E101-R105 PolarHBondContact O-N 3.03Å; E101-R105 IonicContact OE2-NH2 2.58Å; E101-R105 PolarHBondContact OE2-NH2 3.3Å; E102-R105 PolarHBondContact O-N 3.26Å; R105-E107 VanDerWaalsContact C-N 3.27Å; R105-E107 PolarHBondContact O-N 3.25Å; R105-H108 PolarHBondContact O-N 3.3Å
106	A	36.6	Very low	37.1	Very low	76 Å²	76	128 Å²	128	63%	0.628	66%	0.66	S	S	*	*	H	α-helix	trans	-65.7	-26.9	172.7	0	0	0	0	0	112.9	E102 V103	E102-A106 WeakPolarHBondContact O-CB 3.47Å; E102-A106 PolarHBondContact O-N 2.74Å; V103-A106 PolarHBondContact O-N 3.01Å
107	E	33.4	Very low	36.2	Very low	176 Å²	176	133.5 Å²	133.5	82%	0.822	69%	0.691	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-6.6	178	-69.1	-130.4	165.7	0	0	114.3	V103 E104 R105	V103-E107 PolarHBondContact O-N 3.47Å; E104-E107 PolarHBondContact O-N 3.13Å; R105-E107 VanDerWaalsContact C-N 3.27Å; R105-E107 PolarHBondContact O-N 3.25Å
108	H	31.1	Very low	34.9	Very low	164 Å²	164	137.3 Å²	137.3	76%	0.759	71%	0.705	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	16.9	-177.9	-148.9	-68.5	0	0	0	115.3	R105	R105-H108 PolarHBondContact O-N 3.3Å
109	Y	32.1	Very low	34.5	Very low	203 Å²	203	140.5 Å²	140.5	80%	0.796	72%	0.717	S	S	*	*			trans	-109.1	87.4	172.5	-86.9	-91.8	0	0	0	112.1
110	D	30.5	Very low	33.8	Very low	133 Å²	133	144.6 Å²	144.6	71%	0.711	74%	0.736	S	S	*	*			trans	-170.9	72.3	138.3	-163.7	6.3	0	0	0	110.3
111	S	33	Very low	33	Very low	107 Å²	107	141.1 Å²	141.1	75%	0.748	74%	0.739	S	S	*	*			trans	-143.2	62.6	164	-177.8	0	0	0	0	109.7
112	N	31.7	Very low	32.6	Very low	160 Å²	160	145 Å²	145	86%	0.856	76%	0.763	S	S	*	*			trans	-155.9	70.7	158.5	-91.9	-24.5	0	0	0	109.5
113	I	30.9	Very low	32.2	Very low	156 Å²	156	145.5 Å²	145.5	80%	0.8	77%	0.77	S	S	*	*			trans	-102.1	90.4	158.7	-75.3	173	0	0	0	106.7
114	S	31.5	Very low	32	Very low	101 Å²	101	148.4 Å²	148.4	71%	0.706	78%	0.782	S	S	*	*			trans	-150.6	129.5	157.6	-178.8	0	0	0	0	108.3
115	E	32.3	Very low	31.7	Very low	174 Å²	174	147.8 Å²	147.8	81%	0.813	78%	0.784	S	S	*	*			trans	76.2	84.5	170.5	-79	174.6	157.5	0	0	119	L117	E115-L117 PolarHBondContact O-N 3.14Å
116	S	28.1	Very low	31.8	Very low	109 Å²	109	147.5 Å²	147.5	76%	0.762	80%	0.796	S	S	*	*			trans	-18.5	106.3	131.5	-174.7	0	0	0	0	114.3
117	L	34.7	Very low	31.3	Very low	166 Å²	166	151.9 Å²	151.9	87%	0.869	80%	0.804	S	S	*	*			trans	-131.2	112	152.4	-77.8	176.1	0	0	0	108.8	E115 K119	E115-L117 PolarHBondContact O-N 3.14Å; L117-K119 PolarHBondContact O-N 3.09Å
118	D	27.8	Very low	31	Very low	151 Å²	151	148 Å²	148	81%	0.807	80%	0.796	S	S	*	*			trans	-55.3	127.6	167.4	-66.1	-53.5	0	0	0	110.5
119	K	35.7	Very low	31	Very low	209 Å²	209	145.1 Å²	145.1	91%	0.909	80%	0.795	S	S	*	*			trans	-158.3	106.2	146	-109.7	178.1	-172.7	-178.7	0	110.6	L117	L117-K119 PolarHBondContact O-N 3.09Å
120	E	28.2	Very low	30.7	Very low	194 Å²	194	144.1 Å²	144.1	91%	0.907	80%	0.802	S	S	*	*			trans	-49	145.7	156.2	-69.5	-85.8	174.1	0	0	112.2
121	G	27.2	Very low	30.7	Very low	73 Å²	73	143.5 Å²	143.5	75%	0.753	81%	0.808	S	S	*	*			trans	129.4	105.6	148.4	0	0	0	0	0	117.7
122	D	32.9	Very low	30.4	Very low	167 Å²	167	145.7 Å²	145.7	89%	0.893	81%	0.811	S	S	*	*			trans	95.8	107.3	142.5	-109.6	4.7	0	0	0	120.6
123	D	29.6	Very low	30.1	Very low	145 Å²	145	144.2 Å²	144.2	78%	0.775	81%	0.808	S	S	*	*			trans	-61.1	140.6	155.1	-80.3	-47.7	0	0	0	110.6
124	D	36.9	Very low	30	Very low	161 Å²	161	140.8 Å²	140.8	86%	0.861	80%	0.803	S	S	*	*			trans	-163.2	99.4	138.6	-98.3	-26	0	0	0	109.8
125	D	29.7	Very low	29.7	Very low	145 Å²	145	141.1 Å²	141.1	78%	0.775	81%	0.805	S	S	*	*			trans	-7.3	167.6	143.6	-92.7	-36.7	0	0	0	122.6
126	V	33.7	Very low	29.7	Very low	127 Å²	127	141.9 Å²	141.9	77%	0.77	81%	0.809	S	S	*	*			trans	84.1	106	157.3	-62	0	0	0	0	119.3
127	E	26.5	Very low	29.7	Very low	168 Å²	168	143.9 Å²	143.9	79%	0.785	81%	0.811	S	S	*	*				91	125.6	62.2	-91.3	-80.6	-169.8	0	0	114.8
128	S	26.6	Very low	29.7	Very low	95 Å²	95	144.9 Å²	144.9	66%	0.664	81%	0.811	S	S	*	*			trans	66.5	146.8	156.2	92.7	0	0	0	0	116.9
129	S	31.9	Very low	29.7	Very low	104 Å²	104	146.5 Å²	146.5	73%	0.727	81%	0.814	S	S	*	*			cis	-157.2	136.8	30.5	-82.3	0	0	0	0	109.9	S131	S129-S131 PolarHBondContact O-N 3.28Å
130	L	25.4	Very low	29.6	Very low	182 Å²	182	144.9 Å²	144.9	95%	0.953	81%	0.81	S	S	*	*			trans	-67	108.5	156.8	-67.1	162.4	0	0	0	108.2
131	S	30.4	Very low	29.7	Very low	119 Å²	119	144.7 Å²	144.7	83%	0.832	81%	0.809	S	S	*	*			trans	-98	104.2	165	60.9	0	0	0	0	109.1	S129	S129-S131 PolarHBondContact O-N 3.28Å
132	N	26	Very low	30.1	Very low	153 Å²	153	147.9 Å²	147.9	82%	0.818	81%	0.807	S	S	*	*			trans	-88.3	156.2	169	-141.7	1	0	0	0	108.4
133	V	26.6	Very low	30.2	Very low	130 Å²	130	149 Å²	149	79%	0.788	81%	0.807	S	S	*	*			trans	89.7	110.3	159.9	-171.7	0	0	0	0	118.4
134	A	27.9	Very low	30.4	Very low	83 Å²	83	146.7 Å²	146.7	69%	0.686	80%	0.802	S	S	*	*				151.9	108	117.3	0	0	0	0	0	109
135	S	26.3	Very low	30.3	Very low	109 Å²	109	146.3 Å²	146.3	76%	0.762	80%	0.795	S	S	*	*				79.2	116.6	90.3	-53.7	0	0	0	0	112.9
136	E	32.3	Very low	30.7	Very low	189 Å²	189	148.3 Å²	148.3	88%	0.883	80%	0.797	S	S	*	*			trans	164.1	92.8	148.3	-91.9	166.4	-160.4	0	0	105.6
137	D	26.7	Very low	30.8	Very low	151 Å²	151	151.4 Å²	151.4	81%	0.807	80%	0.803	S	S	*	*				47	84.1	87.5	-83.2	-11.2	0	0	0	113.3
138	E	35.4	Very low	31.4	Very low	187 Å²	187	151.1 Å²	151.1	87%	0.874	80%	0.802	S	S	*	*			trans	-131.3	92.6	147	-73.9	-169.1	170.4	0	0	107.9	E140	E138-E140 PolarHBondContact O-N 3.5Å
139	E	28.2	Very low	31.9	Very low	185 Å²	185	153.1 Å²	153.1	86%	0.864	80%	0.8	S	S	*	*			trans	-69.3	104.6	161.8	-65.9	-175.6	162.8	0	0	108
140	E	33.8	Very low	32.3	Very low	176 Å²	176	156.7 Å²	156.7	82%	0.822	81%	0.806	S	S	*	*			trans	-108.2	118.5	159.2	-75.9	-150.8	164.1	0	0	109.9	E138 I142	E138-E140 PolarHBondContact O-N 3.5Å; E140-I142 PolarHBondContact O-N 2.95Å
141	E	29.7	Very low	33.1	Very low	190 Å²	190	156.2 Å²	156.2	89%	0.888	80%	0.799	S	S	*	*			trans	-55.1	114.5	173.8	-65.7	173.4	148.3	0	0	111.3
142	I	35.1	Very low	33.7	Very low	140 Å²	140	157.5 Å²	157.5	72%	0.718	79%	0.792	S	S	*	*			trans	-115.7	73.3	155.1	-54.9	178.6	0	0	0	107.2	E140 S144	E140-I142 PolarHBondContact O-N 2.95Å; I142-S144 VanDerWaalsContact C-N 3.32Å; I142-S144 PolarHBondContact O-N 3.19Å
143	E	34.8	Very low	34.6	Very low	189 Å²	189	157.6 Å²	157.6	88%	0.883	79%	0.787	S	S	*	*			trans	-82.3	79.4	156.6	-78	-158.9	155.3	0	0	108.4
144	S	34.5	Very low	35.5	Very low	98 Å²	98	159 Å²	159	69%	0.685	79%	0.785	S	S	*	*			trans	-164.2	35.1	163.3	49.5	0	0	0	0	116.3	I142	I142-S144 VanDerWaalsContact C-N 3.32Å; I142-S144 PolarHBondContact O-N 3.19Å
145	E	34.9	Very low	36.3	Very low	153 Å²	153	161 Å²	161	72%	0.715	79%	0.785	S	S	*	*			trans	-139	30	169.6	-67.8	-172.1	175.4	0	0	114.3	E147	E145-E147 VanDerWaalsContact C-N 3.28Å; E145-E147 PolarHBondContact O-N 3.25Å
146	K	37.7	Very low	37.4	Very low	186 Å²	186	159.3 Å²	159.3	81%	0.809	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	17.8	174.7	-82.6	-171.5	178.2	173.9	0	115.6
147	E	36.2	Very low	38.2	Very low	192 Å²	192	152.5 Å²	152.5	90%	0.897	75%	0.748	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.9	5.4	175.8	-71.3	-171.5	176.8	0	0	114.1	E145	E145-E147 VanDerWaalsContact C-N 3.28Å; E145-E147 PolarHBondContact O-N 3.25Å
148	E	38	Very low	39.4	Very low	162 Å²	162	150.4 Å²	150.4	76%	0.757	74%	0.737	S	S	*	*	S	Bend	trans	-109	-1	171.6	-68.3	-170.7	176.3	0	0	114
149	E	37.1	Very low	40	Very low	137 Å²	137	148.4 Å²	148.4	64%	0.64	73%	0.726	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-8.6	177.3	-74.3	-175.6	165.7	0	0	114.7
150	E	41.4	Very low	41.2	Very low	180 Å²	180	142.9 Å²	142.9	84%	0.841	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.1	-15	179.5	-71.4	-168.2	175.3	0	0	114.2
151	E	42.3	Very low	42	Very low	172 Å²	172	140.2 Å²	140.2	80%	0.804	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	-18.9	175.8	-69.2	-166.4	174.6	0	0	113.6
152	E	42.4	Very low	43.2	Very low	146 Å²	146	135 Å²	135	68%	0.682	67%	0.674	S	S	*	*	H	α-helix	trans	-83.2	-13.9	178.1	-66.6	-163.7	167.6	0	0	114.4	S156	E152-S156 WeakPolarHBondContact O-CB 3Å; E152-S156 PolarHBondContact O-N 3.17Å; E152-S156 PolarHBondContact O-OG 2.92Å
153	E	45.6	Very low	44.2	Very low	154 Å²	154	135.4 Å²	135.4	72%	0.72	67%	0.672	S	S	*	*	H	α-helix	trans	-74.9	-27.4	176.7	-75.3	-152.1	165.2	0	0	113.3	A157	E153-A157 WeakPolarHBondContact O-CB 3.37Å; E153-A157 PolarHBondContact O-N 3.29Å; E153-A157 VanDerWaalsContact O-N 3.1Å
154	E	46	Very low	45.2	Very low	159 Å²	159	136.2 Å²	136.2	74%	0.743	67%	0.667	S	S	*	*	H	α-helix	trans	-73.4	-40	177.5	-72.3	-160.6	158.4	0	0	112	A157 D158	E154-A157 PolarHBondContact O-N 3.45Å; E154-D158 PolarHBondContact O-N 2.93Å; E154-D158 VanDerWaalsContact O-N 3.15Å
155	D	43.4	Very low	46.3	Very low	127 Å²	127	139.9 Å²	139.9	68%	0.679	67%	0.673	S	S	*	*	H	α-helix	trans	-69.8	-36.4	176.5	-80.7	-12.2	0	0	0	111.9	A157 D158 F159	D155-A157 VanDerWaalsContact C-N 3.34Å; D155-A157 PolarHBondContact O-N 3.38Å; D155-D158 PolarHBondContact O-N 3.42Å; D155-F159 VanDerWaalsContact O-CB 3.26Å; D155-F159 WeakPolarHBondContact O-CB 3.48Å; D155-F159 PolarHBondContact O-N 2.88Å
156	S	50.4	Low	47.7	Very low	73 Å²	73	136 Å²	136	51%	0.51	66%	0.659	S	S	.	*	H	α-helix	trans	-64.8	-37.6	173	-73.9	0	0	0	0	112.2	E152 V160	E152-S156 WeakPolarHBondContact O-CB 3Å; E152-S156 PolarHBondContact O-N 3.17Å; E152-S156 PolarHBondContact O-OG 2.92Å; S156-V160 WeakPolarHBondContact O-CB 3.45Å; S156-V160 WeakPolarHBondContact O-CG2 3.4Å; S156-V160 PolarHBondContact O-N 3.11Å
157	A	49.4	Very low	49.5	Very low	45 Å²	45	131.1 Å²	131.1	37%	0.372	64%	0.642	S	S	.	*	H	α-helix	trans	-68.4	-35.4	177.7	0	0	0	0	0	112.4	E153 E154 D155 K161	E153-A157 WeakPolarHBondContact O-CB 3.37Å; E153-A157 PolarHBondContact O-N 3.29Å; E153-A157 VanDerWaalsContact O-N 3.1Å; E154-A157 PolarHBondContact O-N 3.45Å; D155-A157 VanDerWaalsContact C-N 3.34Å; D155-A157 PolarHBondContact O-N 3.38Å; A157-K161 WeakPolarHBondContact O-CD 3.41Å; A157-K161 WeakPolarHBondContact O-CG 3.34Å; A157-K161 PolarHBondContact O-N 2.76Å; A157-K161 VanDerWaalsContact O-N 3.15Å
158	D	50.4	Low	51.7	Low	108 Å²	108	124.6 Å²	124.6	58%	0.578	62%	0.615	S	S	*	*	H	α-helix	trans	-77.3	-36.8	176.2	-126.2	32.6	0	0	0	112.4	E154 D155 V160 K161 S162	E154-D158 PolarHBondContact O-N 2.93Å; E154-D158 VanDerWaalsContact O-N 3.15Å; D155-D158 PolarHBondContact O-N 3.42Å; D158-V160 PolarHBondContact O-N 2.85Å; D158-K161 PolarHBondContact O-N 2.78Å; D158-K161 IonicContact OD1-NZ 3.51Å; D158-K161 PolarHBondContact OD1-NZ 3.25Å; D158-S162 PolarHBondContact O-N 3.42Å; D158-S162 VanDerWaalsContact O-N 3.15Å
159	F	49.4	Very low	53.8	Low	144 Å²	144	123.7 Å²	123.7	63%	0.632	61%	0.611	S	S	*	*	H	α-helix	trans	-61	-43.5	171.1	-173.9	-105.1	0	0	0	112.1	D155 K161 S162	D155-F159 VanDerWaalsContact O-CB 3.26Å; D155-F159 WeakPolarHBondContact O-CB 3.48Å; D155-F159 PolarHBondContact O-N 2.88Å; F159-K161 PolarHBondContact O-N 3.48Å; F159-S162 PolarHBondContact O-N 3.42Å; F159-S162 PolarHBondContact O-OG 3.21Å
160	V	52.7	Low	56	Low	69 Å²	69	120.2 Å²	120.2	42%	0.418	59%	0.594	S	S	.	*	H	α-helix	trans	-71.1	-29.5	177.8	172.5	0	0	0	0	112.5	S156 D158 F163 R164	S156-V160 WeakPolarHBondContact O-CB 3.45Å; S156-V160 WeakPolarHBondContact O-CG2 3.4Å; S156-V160 PolarHBondContact O-N 3.11Å; D158-V160 PolarHBondContact O-N 2.85Å; V160-F163 PolarHBondContact O-N 3.44Å; V160-R164 PolarHBondContact O-N 2.9Å
161	K	50.8	Low	58.1	Low	120 Å²	120	116.3 Å²	116.3	52%	0.522	58%	0.576	S	S	.	*	H	α-helix	trans	-67.3	-36.5	173.3	-75.7	166.3	-158.5	158.5	0	111.9	A157 D158 F159 F163 R164	A157-K161 WeakPolarHBondContact O-CD 3.41Å; A157-K161 WeakPolarHBondContact O-CG 3.34Å; A157-K161 PolarHBondContact O-N 2.76Å; A157-K161 VanDerWaalsContact O-N 3.15Å; D158-K161 PolarHBondContact O-N 2.78Å; D158-K161 IonicContact OD1-NZ 3.51Å; D158-K161 PolarHBondContact OD1-NZ 3.25Å; F159-K161 PolarHBondContact O-N 3.48Å; K161-F163 VanDerWaalsContact C-N 3.26Å; K161-F163 PolarHBondContact O-N 3.37Å; K161-R164 PolarHBondContact O-N 2.94Å
162	S	54.7	Low	60.2	Low	80 Å²	80	109.6 Å²	109.6	56%	0.559	55%	0.546	S	S	*	.	H	α-helix	trans	-60.9	-35.3	176.1	80.9	0	0	0	0	112.4	D158 F159	D158-S162 PolarHBondContact O-N 3.42Å; D158-S162 VanDerWaalsContact O-N 3.15Å; F159-S162 PolarHBondContact O-N 3.42Å; F159-S162 PolarHBondContact O-OG 3.21Å
163	F	55.2	Low	62.3	Low	150 Å²	150	105.1 Å²	105.1	66%	0.658	53%	0.534	S	S	*	.	H	α-helix	trans	-79.9	-21.3	177.4	-122.4	-88.2	0	0	0	114	V160 K161 V166	V160-F163 PolarHBondContact O-N 3.44Å; K161-F163 VanDerWaalsContact C-N 3.26Å; K161-F163 PolarHBondContact O-N 3.37Å; F163-V166 WeakPolarHBondContact O-CG2 3.41Å
164	R	55.8	Low	64.3	Low	206 Å²	206	102.9 Å²	102.9	78%	0.777	52%	0.521	S	S	*	.	H	α-helix	trans	-82.9	-14.7	-178.3	-82.3	-176.6	175.6	174.8	2.5	114.4	V160 K161 V166	V160-R164 PolarHBondContact O-N 2.9Å; K161-R164 PolarHBondContact O-N 2.94Å; R164-V166 PolarHBondContact O-N 2.88Å
165	Q	58.3	Low	66.3	Low	175 Å²	175	95.9 Å²	95.9	82%	0.818	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	32.6	174	-70.5	-174.8	-13.3	0	0	112.9	D167	Q165-D167 VanDerWaalsContact C-N 3.35Å; Q165-D167 PolarHBondContact O-N 3.1Å
166	V	64.5	Low	68.5	Low	71 Å²	71	95.4 Å²	95.4	43%	0.43	48%	0.483	S	S	.	.			trans	-61.9	102.4	161.2	174.2	0	0	0	0	106.6	F163 R164 V168 H171	F163-V166 WeakPolarHBondContact O-CG2 3.41Å; R164-V166 PolarHBondContact O-N 2.88Å; V166-V168 VanDerWaalsContact C-N 3.26Å; V166-V168 PolarHBondContact O-N 3.14Å; V166-H171 VanDerWaalsContact CG1-CD2 3.48Å; V166-H171 WeakPolarHBondContact CG1-CD2 3.33Å
167	D	76.3	Confident	70.3	Confident	84 Å²	84	93.2 Å²	93.2	45%	0.449	47%	0.469	S	S	.	.			trans	-66.9	92.7	172.1	-175.2	-9.3	0	0	0	108.3	Q165 H169 E170 H171	Q165-D167 VanDerWaalsContact C-N 3.35Å; Q165-D167 PolarHBondContact O-N 3.1Å; D167-H169 PolarHBondContact O-N 3.46Å; D167-H169 VanDerWaalsContact O-N 3.08Å; D167-H169 WeakPolarHBondContact OD1-CA 3.29Å; D167-H169 WeakPolarHBondContact OD1-CB 2.93Å; D167-H169 PolarHBondContact OD1-N 3.07Å; D167-E170 HydrophobicContact CB-CB 3.92Å; D167-E170 PolarHBondContact O-N 3.11Å; D167-E170 PolarHBondContact OD1-N 3.47Å; D167-H171 PolarHBondContact O-CD2 3.23Å; D167-H171 VanDerWaalsContact O-CD2 3.3Å; D167-H171 PolarHBondContact O-N 3.5Å
168	V	81.3	Confident	72.2	Confident	54 Å²	54	94 Å²	94	33%	0.327	47%	0.469	S	S	.	.	H	α-helix	trans	-52.3	-33.8	178.4	-178.6	0	0	0	0	110.6	A73 V166 L172	A73-V168 HydrophobicContact CB-CG1 4.39Å; V166-V168 VanDerWaalsContact C-N 3.26Å; V166-V168 PolarHBondContact O-N 3.14Å; V168-L172 HydrophobicContact CG1-CD1 3.98Å; V168-L172 HydrophobicContact CG1-CG 4.31Å; V168-L172 WeakPolarHBondContact O-CB 3.32Å; V168-L172 WeakPolarHBondContact O-CD1 3.37Å; V168-L172 WeakPolarHBondContact O-CG 3.43Å; V168-L172 PolarHBondContact O-N 3.03Å
169	H	82.2	Confident	74	Confident	143 Å²	143	91.7 Å²	91.7	66%	0.662	46%	0.455	S	S	*	.	H	α-helix	trans	-67.8	-44.3	178.4	-169.8	73.8	0	0	0	111.9	D167 L172 A173	D167-H169 PolarHBondContact O-N 3.46Å; D167-H169 VanDerWaalsContact O-N 3.08Å; D167-H169 WeakPolarHBondContact OD1-CA 3.29Å; D167-H169 WeakPolarHBondContact OD1-CB 2.93Å; D167-H169 PolarHBondContact OD1-N 3.07Å; H169-L172 PolarHBondContact O-N 3.09Å; H169-A173 WeakPolarHBondContact O-CB 3.4Å; H169-A173 PolarHBondContact O-N 3.12Å
170	E	84.4	Confident	75.9	Confident	64 Å²	64	88 Å²	88	30%	0.299	44%	0.44	S	S	.	.	H	α-helix	trans	-64.4	-44.4	176.6	-165	-168.7	165.3	0	0	111.5	D167 L172 A173 K174	D167-E170 HydrophobicContact CB-CB 3.92Å; D167-E170 PolarHBondContact O-N 3.11Å; D167-E170 PolarHBondContact OD1-N 3.47Å; E170-L172 VanDerWaalsContact C-N 3.33Å; E170-L172 PolarHBondContact O-N 3.33Å; E170-A173 PolarHBondContact O-N 3.46Å; E170-A173 VanDerWaalsContact O-N 3.16Å; E170-K174 VanDerWaalsContact CD-NZ 3.32Å; E170-K174 HydrophobicContact CG-CD 4.44Å; E170-K174 WeakPolarHBondContact O-CG 3.48Å; E170-K174 PolarHBondContact O-N 2.63Å; E170-K174 WeakPolarHBondContact OE1-CE 3.34Å; E170-K174 IonicContact OE1-NZ 3.43Å; E170-K174 PolarHBondContact OE1-NZ 3.16Å; E170-K174 IonicContact OE2-NZ 3.04Å
171	H	84.5	Confident	77.7	Confident	99 Å²	99	91 Å²	91	46%	0.458	45%	0.449	S	S	.	.	H	α-helix	trans	-61.4	-40.1	175.7	-80.4	-91.4	0	0	0	112.2	V166 D167 K174 A175	V166-H171 VanDerWaalsContact CG1-CD2 3.48Å; V166-H171 WeakPolarHBondContact CG1-CD2 3.33Å; D167-H171 PolarHBondContact O-CD2 3.23Å; D167-H171 VanDerWaalsContact O-CD2 3.3Å; D167-H171 PolarHBondContact O-N 3.5Å; H171-K174 PolarHBondContact O-N 3.29Å; H171-A175 VanDerWaalsContact O-CB 3.22Å; H171-A175 WeakPolarHBondContact O-CB 3.16Å; H171-A175 PolarHBondContact O-N 2.92Å
172	L	86.9	Confident	79.5	Confident	31 Å²	31	87.8 Å²	87.8	16%	0.162	44%	0.438	C	S	.	.	H	α-helix	trans	-66.5	-36.2	174.1	-72.4	169	0	0	0	112.6	A73 V168 H169 E170 K176	A73-L172 HydrophobicContact CB-CD1 3.64Å; V168-L172 HydrophobicContact CG1-CD1 3.98Å; V168-L172 HydrophobicContact CG1-CG 4.31Å; V168-L172 WeakPolarHBondContact O-CB 3.32Å; V168-L172 WeakPolarHBondContact O-CD1 3.37Å; V168-L172 WeakPolarHBondContact O-CG 3.43Å; V168-L172 PolarHBondContact O-N 3.03Å; H169-L172 PolarHBondContact O-N 3.09Å; E170-L172 VanDerWaalsContact C-N 3.33Å; E170-L172 PolarHBondContact O-N 3.33Å; L172-K176 VanDerWaalsContact O-CG 3.29Å; L172-K176 WeakPolarHBondContact O-CG 3.11Å; L172-K176 PolarHBondContact O-N 3.46Å
173	A	86.7	Confident	81.1	Confident	52 Å²	52	90.2 Å²	90.2	43%	0.43	43%	0.434	S	S	.	.	H	α-helix	trans	-67	-45.7	175.8	0	0	0	0	0	111	H169 E170 K176 A177	H169-A173 WeakPolarHBondContact O-CB 3.4Å; H169-A173 PolarHBondContact O-N 3.12Å; E170-A173 PolarHBondContact O-N 3.46Å; E170-A173 VanDerWaalsContact O-N 3.16Å; A173-K176 PolarHBondContact O-N 3.18Å; A173-A177 PolarHBondContact O-N 2.85Å
174	K	88	Confident	82.7	Confident	106 Å²	106	85.1 Å²	85.1	46%	0.461	41%	0.414	S	S	.	.	H	α-helix	trans	-58.2	-47.7	173.1	-72.3	173.5	-179.1	165.5	0	111.3	E170 H171 K176 A177 V178	E170-K174 VanDerWaalsContact CD-NZ 3.32Å; E170-K174 HydrophobicContact CG-CD 4.44Å; E170-K174 WeakPolarHBondContact O-CG 3.48Å; E170-K174 PolarHBondContact O-N 2.63Å; E170-K174 WeakPolarHBondContact OE1-CE 3.34Å; E170-K174 IonicContact OE1-NZ 3.43Å; E170-K174 PolarHBondContact OE1-NZ 3.16Å; E170-K174 IonicContact OE2-NZ 3.04Å; H171-K174 PolarHBondContact O-N 3.29Å; K174-K176 PolarHBondContact O-N 3Å; K174-A177 WeakPolarHBondContact O-CB 3.43Å; K174-A177 PolarHBondContact O-N 3.45Å; K174-A177 VanDerWaalsContact O-N 3.15Å; K174-V178 WeakPolarHBondContact O-CG2 3.35Å; K174-V178 PolarHBondContact O-N 3.4Å
175	A	86.5	Confident	84.3	Confident	13 Å²	13	78 Å²	78	11%	0.107	40%	0.396	C	S	.	.	H	α-helix	trans	-55.5	-48.1	176.3	0	0	0	0	0	112.7	L76 H171 A177 V178 Q179	L76-A175 HydrophobicContact CD1-CB 3.44Å; L76-A175 VanDerWaalsContact CD1-CB 3.44Å; L76-A175 HydrophobicContact CD2-CB 3.93Å; L76-A175 HydrophobicContact CG-CB 3.63Å; H171-A175 VanDerWaalsContact O-CB 3.22Å; H171-A175 WeakPolarHBondContact O-CB 3.16Å; H171-A175 PolarHBondContact O-N 2.92Å; A175-A177 VanDerWaalsContact C-N 3.34Å; A175-A177 PolarHBondContact O-N 3.22Å; A175-V178 PolarHBondContact O-N 3.02Å; A175-Q179 WeakPolarHBondContact O-CG 3.5Å; A175-Q179 PolarHBondContact O-N 3.39Å
176	K	89.9	Confident	85.7	Confident	116 Å²	116	73.2 Å²	73.2	50%	0.504	37%	0.373	S	S	.	.	H	α-helix	trans	-62.9	-40	176.6	-73.6	172	-175.7	174.2	0	112.1	L172 A173 K174 Q179 Q180	L172-K176 VanDerWaalsContact O-CG 3.29Å; L172-K176 WeakPolarHBondContact O-CG 3.11Å; L172-K176 PolarHBondContact O-N 3.46Å; A173-K176 PolarHBondContact O-N 3.18Å; K174-K176 PolarHBondContact O-N 3Å; K176-Q179 PolarHBondContact O-N 3.09Å; K176-Q180 WeakPolarHBondContact O-CG 3.15Å; K176-Q180 PolarHBondContact O-N 3.24Å
177	A	88.1	Confident	86.9	Confident	28 Å²	28	71.5 Å²	71.5	23%	0.231	36%	0.361	C	S	.	.	H	α-helix	trans	-63.1	-45.3	177.3	0	0	0	0	0	111.3	A173 K174 A175 Q179 Q180 Q181	A173-A177 PolarHBondContact O-N 2.85Å; K174-A177 WeakPolarHBondContact O-CB 3.43Å; K174-A177 PolarHBondContact O-N 3.45Å; K174-A177 VanDerWaalsContact O-N 3.15Å; A175-A177 VanDerWaalsContact C-N 3.34Å; A175-A177 PolarHBondContact O-N 3.22Å; A177-Q179 PolarHBondContact O-N 3.48Å; A177-Q180 PolarHBondContact O-N 3.49Å; A177-Q181 VanDerWaalsContact O-CG 3.31Å; A177-Q181 WeakPolarHBondContact O-CG 3.43Å; A177-Q181 PolarHBondContact O-N 3.08Å
178	V	89.9	Confident	87.5	Confident	61 Å²	61	71.3 Å²	71.3	37%	0.37	36%	0.359	S	S	.	.	H	α-helix	trans	-60.2	-45	175.9	172.5	0	0	0	0	111.1	K174 A175 Q180 Q181 L182	K174-V178 WeakPolarHBondContact O-CG2 3.35Å; K174-V178 PolarHBondContact O-N 3.4Å; A175-V178 PolarHBondContact O-N 3.02Å; V178-Q180 VanDerWaalsContact C-N 3.3Å; V178-Q180 PolarHBondContact O-N 3Å; V178-Q181 PolarHBondContact O-N 2.65Å; V178-L182 HydrophobicContact CG1-CD1 4.07Å; V178-L182 HydrophobicContact CG1-CG 4.41Å; V178-L182 WeakPolarHBondContact O-CG 3.49Å; V178-L182 PolarHBondContact O-N 3.19Å
179	Q	87.9	Confident	87.8	Confident	60 Å²	60	69.5 Å²	69.5	28%	0.28	35%	0.348	S	S	.	.	H	α-helix	trans	-59	-41.3	176	-73.5	-176.1	-28.3	0	0	112.4	L76 A175 K176 A177 R183	L76-Q179 HydrophobicContact CD2-CG 4.05Å; A175-Q179 WeakPolarHBondContact O-CG 3.5Å; A175-Q179 PolarHBondContact O-N 3.39Å; K176-Q179 PolarHBondContact O-N 3.09Å; A177-Q179 PolarHBondContact O-N 3.48Å; Q179-R183 WeakPolarHBondContact O-CB 3.49Å; Q179-R183 PolarHBondContact O-N 2.78Å
180	Q	89.2	Confident	88	Confident	66 Å²	66	63.8 Å²	63.8	31%	0.308	33%	0.327	S	S	.	.	H	α-helix	trans	-68.6	-40.5	177.9	-72.9	173.2	-24.2	0	0	112	T48 K176 A177 V178 R183 L184	T48-Q180 HydrophobicContact CG2-CB 4.05Å; T48-Q180 HydrophobicContact CG2-CG 4.31Å; K176-Q180 WeakPolarHBondContact O-CG 3.15Å; K176-Q180 PolarHBondContact O-N 3.24Å; A177-Q180 PolarHBondContact O-N 3.49Å; V178-Q180 VanDerWaalsContact C-N 3.3Å; V178-Q180 PolarHBondContact O-N 3Å; Q180-R183 PolarHBondContact O-N 3.11Å; Q180-L184 WeakPolarHBondContact O-CB 3.33Å; Q180-L184 PolarHBondContact O-N 3.46Å
181	Q	89.8	Confident	88.2	Confident	131 Å²	131	61.8 Å²	61.8	61%	0.612	32%	0.322	S	S	*	.	H	α-helix	trans	-62.7	-45.2	175.8	-73	170.9	-13.6	0	0	111.6	A177 V178 R183 L184 S185	A177-Q181 VanDerWaalsContact O-CG 3.31Å; A177-Q181 WeakPolarHBondContact O-CG 3.43Å; A177-Q181 PolarHBondContact O-N 3.08Å; V178-Q181 PolarHBondContact O-N 2.65Å; Q181-R183 PolarHBondContact O-N 3.03Å; Q181-L184 PolarHBondContact O-N 3.29Å; Q181-S185 WeakPolarHBondContact O-CB 3.26Å; Q181-S185 PolarHBondContact O-N 2.87Å
182	L	88.6	Confident	88.4	Confident	54 Å²	54	59.8 Å²	59.8	28%	0.283	31%	0.31	S	S	.	.	H	α-helix	trans	-61.7	-43.5	175.8	-71.9	174.4	0	0	0	111.8	V178 L184 S185 E186	V178-L182 HydrophobicContact CG1-CD1 4.07Å; V178-L182 HydrophobicContact CG1-CG 4.41Å; V178-L182 WeakPolarHBondContact O-CG 3.49Å; V178-L182 PolarHBondContact O-N 3.19Å; L182-L184 VanDerWaalsContact C-N 3.35Å; L182-L184 PolarHBondContact O-N 3.08Å; L182-S185 WeakPolarHBondContact O-CB 3.41Å; L182-S185 PolarHBondContact O-N 3.31Å; L182-E186 WeakPolarHBondContact O-CG 3.34Å; L182-E186 PolarHBondContact O-N 3.12Å
183	R	89.2	Confident	88.4	Confident	130 Å²	130	59.7 Å²	59.7	49%	0.491	31%	0.31	S	S	.	.	H	α-helix	trans	-61.2	-42.6	175.7	179.6	178.9	172	169.6	-1.7	112	S44 Q179 Q180 Q181 E186 Q187	S44-R183 PolarHBondContact OG-NH2 3.49Å; Q179-R183 WeakPolarHBondContact O-CB 3.49Å; Q179-R183 PolarHBondContact O-N 2.78Å; Q180-R183 PolarHBondContact O-N 3.11Å; Q181-R183 PolarHBondContact O-N 3.03Å; R183-E186 PolarHBondContact O-N 3.12Å; R183-Q187 WeakPolarHBondContact O-CG 3.45Å; R183-Q187 PolarHBondContact O-N 3.46Å
184	L	89.2	Confident	88.3	Confident	43 Å²	43	63.5 Å²	63.5	23%	0.225	31%	0.313	C	S	.	.	H	α-helix	trans	-63.5	-45.5	177	-177.6	66.8	0	0	0	110.9	I41 I45 Q180 Q181 L182 E186 Q187 L188 L247	I41-L184 HydrophobicContact CG2-CD1 4.39Å; I45-L184 HydrophobicContact CD1-CD1 4.06Å; I45-L184 HydrophobicContact CG1-CD1 4.22Å; Q180-L184 WeakPolarHBondContact O-CB 3.33Å; Q180-L184 PolarHBondContact O-N 3.46Å; Q181-L184 PolarHBondContact O-N 3.29Å; L182-L184 VanDerWaalsContact C-N 3.35Å; L182-L184 PolarHBondContact O-N 3.08Å; L184-E186 VanDerWaalsContact C-N 3.33Å; L184-E186 PolarHBondContact O-N 3.11Å; L184-Q187 PolarHBondContact O-N 3.43Å; L184-L188 HydrophobicContact CG-CD1 4.23Å; L184-L188 WeakPolarHBondContact O-CG 3.44Å; L184-L188 PolarHBondContact O-N 3.03Å; L184-L247 HydrophobicContact CD2-CD2 3.91Å
185	S	89.1	Confident	88.4	Confident	58 Å²	58	61.6 Å²	61.6	41%	0.406	31%	0.305	S	S	.	.	H	α-helix	trans	-56.8	-44.7	175.3	174.3	0	0	0	0	112	Q181 L182 Q187 L188 L189	Q181-S185 WeakPolarHBondContact O-CB 3.26Å; Q181-S185 PolarHBondContact O-N 2.87Å; L182-S185 WeakPolarHBondContact O-CB 3.41Å; L182-S185 PolarHBondContact O-N 3.31Å; S185-Q187 PolarHBondContact O-N 3.07Å; S185-L188 PolarHBondContact O-N 2.9Å; S185-L189 WeakPolarHBondContact O-CB 3.48Å; S185-L189 PolarHBondContact O-N 3.24Å
186	E	87.4	Confident	88.5	Confident	73 Å²	73	61.2 Å²	61.2	34%	0.341	30%	0.301	S	S	.	.	H	α-helix	trans	-62	-41.1	175.5	-75	167.9	-164.8	0	0	113.1	L182 R183 L184 L189 G190 R415	L182-E186 WeakPolarHBondContact O-CG 3.34Å; L182-E186 PolarHBondContact O-N 3.12Å; R183-E186 PolarHBondContact O-N 3.12Å; L184-E186 VanDerWaalsContact C-N 3.33Å; L184-E186 PolarHBondContact O-N 3.11Å; E186-L189 PolarHBondContact O-N 3.48Å; E186-G190 PolarHBondContact O-N 3.25Å; E186-R415 IonicContact OE1-CZ 3.09Å; E186-R415 IonicContact OE1-NH1 3.39Å; E186-R415 IonicContact OE1-NH2 3.97Å; E186-R415 PolarHBondContact OE1-NH2 2.97Å
187	Q	89.5	Confident	88.3	Confident	36 Å²	36	65 Å²	65	17%	0.168	31%	0.312	C	S	.	.	H	α-helix	trans	-66.3	-40.9	177.9	-73.5	176.1	-22.3	0	0	111.7	I41 R183 L184 S185 G190 A191	I41-Q187 HydrophobicContact CD1-CB 4.12Å; I41-Q187 HydrophobicContact CG1-CB 3.89Å; I41-Q187 HydrophobicContact CG1-CG 4.2Å; R183-Q187 WeakPolarHBondContact O-CG 3.45Å; R183-Q187 PolarHBondContact O-N 3.46Å; L184-Q187 PolarHBondContact O-N 3.43Å; S185-Q187 PolarHBondContact O-N 3.07Å; Q187-G190 PolarHBondContact O-N 2.97Å; Q187-A191 PolarHBondContact O-N 3.48Å
188	L	88.8	Confident	88.4	Confident	79 Å²	79	67.9 Å²	67.9	41%	0.414	32%	0.323	S	S	.	.	H	α-helix	trans	-65.6	-43	175.6	-69.3	172.4	0	0	0	111.6	L184 S185 G190 A191 R192 L243	L184-L188 HydrophobicContact CG-CD1 4.23Å; L184-L188 WeakPolarHBondContact O-CG 3.44Å; L184-L188 PolarHBondContact O-N 3.03Å; S185-L188 PolarHBondContact O-N 2.9Å; L188-G190 VanDerWaalsContact C-N 3.33Å; L188-G190 PolarHBondContact O-N 3.3Å; L188-A191 WeakPolarHBondContact O-CB 3.44Å; L188-A191 PolarHBondContact O-N 3.3Å; L188-R192 PolarHBondContact O-N 2.79Å; L188-L243 HydrophobicContact CD2-CD2 4.34Å
189	L	88.7	Confident	88.3	Confident	17 Å²	17	66.9 Å²	66.9	9%	0.089	32%	0.315	C	S	.	.	H	α-helix	trans	-59.9	-44.1	173.1	-177.6	57.9	0	0	0	111.3	S185 E186 A191 R192 I193 L408 L412	S185-L189 WeakPolarHBondContact O-CB 3.48Å; S185-L189 PolarHBondContact O-N 3.24Å; E186-L189 PolarHBondContact O-N 3.48Å; L189-A191 PolarHBondContact O-N 2.91Å; L189-R192 PolarHBondContact O-N 3.46Å; L189-I193 HydrophobicContact CG-CD1 4.33Å; L189-I193 WeakPolarHBondContact O-CG1 3.39Å; L189-I193 PolarHBondContact O-N 3.4Å; L189-L408 HydrophobicContact CD1-CB 3.85Å; L189-L408 HydrophobicContact CD1-CD1 4.11Å; L189-L408 HydrophobicContact CD1-CD2 3.72Å; L189-L408 HydrophobicContact CD1-CG 4.09Å; L189-L412 HydrophobicContact CD2-CB 3.97Å; L189-L412 HydrophobicContact CD2-CD1 4.05Å
190	G	86.4	Confident	88.3	Confident	22 Å²	22	66 Å²	66	23%	0.227	31%	0.312	C	S	.	.	H	α-helix	trans	-61.8	-39.6	174.7	0	0	0	0	0	113.2	E186 Q187 L188 I193 R194	E186-G190 PolarHBondContact O-N 3.25Å; Q187-G190 PolarHBondContact O-N 2.97Å; L188-G190 VanDerWaalsContact C-N 3.33Å; L188-G190 PolarHBondContact O-N 3.3Å; G190-I193 PolarHBondContact O-N 2.95Å; G190-R194 WeakPolarHBondContact O-CG 3.37Å; G190-R194 PolarHBondContact O-N 2.9Å; G190-R194 VanDerWaalsContact O-N 3.15Å
191	A	87.6	Confident	88.2	Confident	23 Å²	23	67.4 Å²	67.4	19%	0.19	32%	0.321	C	S	.	.	H	α-helix	trans	-62.4	-47	173.8	0	0	0	0	0	111.1	Q187 L188 L189 I193 R194 F195	Q187-A191 PolarHBondContact O-N 3.48Å; L188-A191 WeakPolarHBondContact O-CB 3.44Å; L188-A191 PolarHBondContact O-N 3.3Å; L189-A191 PolarHBondContact O-N 2.91Å; A191-I193 VanDerWaalsContact C-N 3.3Å; A191-I193 PolarHBondContact O-N 2.98Å; A191-R194 WeakPolarHBondContact O-CB 3.37Å; A191-R194 PolarHBondContact O-N 2.8Å; A191-R194 VanDerWaalsContact O-N 3.09Å; A191-F195 HydrophobicContact CB-CE2 4.43Å; A191-F195 WeakPolarHBondContact O-CD2 3.4Å; A191-F195 PolarHBondContact O-N 3.26Å
192	R	88.9	Confident	88.2	Confident	56 Å²	56	63.5 Å²	63.5	21%	0.211	31%	0.311	C	S	.	.	H	α-helix	trans	-56.1	-43.2	174.9	176.2	59.3	-167.9	77.5	-0.2	111.9	L188 L189 R194 F195 Q196 D401 L408	L188-R192 PolarHBondContact O-N 2.79Å; L189-R192 PolarHBondContact O-N 3.46Å; R192-R194 VanDerWaalsContact C-N 3.31Å; R192-R194 PolarHBondContact O-N 3.18Å; R192-F195 WeakPolarHBondContact O-CB 3.45Å; R192-F195 PolarHBondContact O-N 2.96Å; R192-Q196 VanDerWaalsContact CZ-OE1 3.26Å; R192-Q196 PolarHBondContact O-N 3.09Å; R192-D401 IonicContact CZ-OD2 2.63Å; R192-D401 IonicContact NH2-OD1 3.97Å; R192-D401 PolarHBondContact NH2-OD1 3.12Å; R192-D401 IonicContact NH2-OD2 2.87Å; R192-D401 PolarHBondContact NH2-OD2 3.37Å; R192-L408 HydrophobicContact CG-CD1 3.79Å
193	I	86.5	Confident	88.2	Confident	30 Å²	30	61.5 Å²	61.5	15%	0.154	30%	0.301	C	S	.	.	H	α-helix	trans	-61.1	-40.9	177.7	-72.7	161.9	0	0	0	111.6	L189 G190 A191 F195 Q196 Y405 L409 L412	L189-I193 HydrophobicContact CG-CD1 4.33Å; L189-I193 WeakPolarHBondContact O-CG1 3.39Å; L189-I193 PolarHBondContact O-N 3.4Å; G190-I193 PolarHBondContact O-N 2.95Å; A191-I193 VanDerWaalsContact C-N 3.3Å; A191-I193 PolarHBondContact O-N 2.98Å; I193-F195 VanDerWaalsContact C-N 3.33Å; I193-F195 PolarHBondContact O-N 2.77Å; I193-Q196 VanDerWaalsContact O-CB 3.29Å; I193-Q196 WeakPolarHBondContact O-CB 3.27Å; I193-Q196 PolarHBondContact O-N 3.01Å; I193-Y405 HydrophobicContact CB-CE2 4.13Å; I193-Y405 HydrophobicContact CG1-CE2 3.96Å; I193-Y405 HydrophobicContact CG2-CE2 3.96Å; I193-L409 HydrophobicContact CD1-CD2 3.85Å; I193-L409 HydrophobicContact CG1-CD2 4.07Å; I193-L409 HydrophobicContact CG2-CD2 4.19Å; I193-L412 HydrophobicContact CD1-CD2 3.45Å; I193-L412 VanDerWaalsContact CD1-CD2 3.45Å
194	R	86.1	Confident	88.2	Confident	132 Å²	132	58.5 Å²	58.5	50%	0.498	29%	0.292	S	S	.	.	H	α-helix	trans	-65.7	-36.1	176.4	-67	171.6	-175.9	-142.8	0.2	112.4	L33 G190 A191 R192 Q196 R197	L33-R194 PolarHBondContact O-NH1 2.76Å; G190-R194 WeakPolarHBondContact O-CG 3.37Å; G190-R194 PolarHBondContact O-N 2.9Å; G190-R194 VanDerWaalsContact O-N 3.15Å; A191-R194 WeakPolarHBondContact O-CB 3.37Å; A191-R194 PolarHBondContact O-N 2.8Å; A191-R194 VanDerWaalsContact O-N 3.09Å; R192-R194 VanDerWaalsContact C-N 3.31Å; R192-R194 PolarHBondContact O-N 3.18Å; R194-Q196 PolarHBondContact O-N 3.19Å; R194-R197 PolarHBondContact O-N 3.36Å
195	F	88.4	Confident	88.1	Confident	65 Å²	65	61.4 Å²	61.4	29%	0.285	31%	0.307	S	S	.	.	H	α-helix	trans	-61	-26.3	174.8	-78.7	-64.8	0	0	0	113.4	A191 R192 I193 R197 I198 L199 M236 M240	A191-F195 HydrophobicContact CB-CE2 4.43Å; A191-F195 WeakPolarHBondContact O-CD2 3.4Å; A191-F195 PolarHBondContact O-N 3.26Å; R192-F195 WeakPolarHBondContact O-CB 3.45Å; R192-F195 PolarHBondContact O-N 2.96Å; I193-F195 VanDerWaalsContact C-N 3.33Å; I193-F195 PolarHBondContact O-N 2.77Å; F195-R197 PolarHBondContact O-N 3.21Å; F195-I198 HydrophobicContact CD1-CD1 4.03Å; F195-I198 HydrophobicContact CE1-CD1 4.38Å; F195-I198 PolarHBondContact O-N 3.19Å; F195-L199 PolarHBondContact O-N 3.34Å; F195-M236 HydrophobicContact CE1-CE 3.71Å; F195-M236 HydrophobicContact CE1-SD 3.43Å; F195-M236 WeakPolarHBondContact CE1-SD 3.45Å; F195-M236 HydrophobicContact CZ-CE 4.37Å; F195-M236 HydrophobicContact CZ-CG 4.43Å; F195-M236 HydrophobicContact CZ-SD 3.89Å; F195-M240 HydrophobicContact CZ-SD 4.07Å
196	Q	89.1	Confident	88	Confident	5 Å²	5	59.3 Å²	59.3	2%	0.023	29%	0.293	C	S	.	.	H	α-helix	trans	-56	-39.2	179.9	-164.5	66.6	17.9	0	0	112.2	R192 I193 R194 L199 N200 D401 D402 Y405	R192-Q196 VanDerWaalsContact CZ-OE1 3.26Å; R192-Q196 PolarHBondContact O-N 3.09Å; I193-Q196 VanDerWaalsContact O-CB 3.29Å; I193-Q196 WeakPolarHBondContact O-CB 3.27Å; I193-Q196 PolarHBondContact O-N 3.01Å; R194-Q196 PolarHBondContact O-N 3.19Å; Q196-L199 WeakPolarHBondContact O-CB 3.4Å; Q196-L199 PolarHBondContact O-N 3.47Å; Q196-N200 PolarHBondContact O-N 2.85Å; Q196-D401 PolarHBondContact NE2-OD1 3.39Å; Q196-D401 PolarHBondContact OE1-OD1 3.27Å; Q196-D402 PolarHBondContact NE2-OD1 2.96Å; Q196-Y405 HydrophobicContact CB-CD2 3.91Å; Q196-Y405 HydrophobicContact CB-CE2 3.71Å; Q196-Y405 HydrophobicContact CB-CG 4.42Å; Q196-Y405 HydrophobicContact CG-CD1 3.89Å; Q196-Y405 HydrophobicContact CG-CD2 3.8Å; Q196-Y405 HydrophobicContact CG-CE1 3.98Å; Q196-Y405 HydrophobicContact CG-CE2 3.9Å; Q196-Y405 HydrophobicContact CG-CG 3.79Å
197	R	87	Confident	87.9	Confident	195 Å²	195	58.3 Å²	58.3	74%	0.736	29%	0.286	S	S	*	.	H	α-helix	trans	-67.3	-39.4	178.8	-176.6	170.4	179.9	174.1	-0.9	112.1	R194 F195 L199 N200 L201	R194-R197 PolarHBondContact O-N 3.36Å; F195-R197 PolarHBondContact O-N 3.21Å; R197-L199 VanDerWaalsContact C-N 3.33Å; R197-N200 PolarHBondContact O-N 2.95Å; R197-L201 HydrophobicContact CG-CD1 4.37Å; R197-L201 WeakPolarHBondContact O-CG 3.04Å; R197-L201 PolarHBondContact O-N 3.15Å; R197-L201 VanDerWaalsContact O-N 3.09Å
198	I	88.4	Confident	87.5	Confident	90 Å²	90	58.4 Å²	58.4	46%	0.462	30%	0.297	S	S	.	.	H	α-helix	trans	-65.1	-43.4	178.2	-60.6	173.7	0	0	0	109.5	F195 N200 L201 A202	F195-I198 HydrophobicContact CD1-CD1 4.03Å; F195-I198 HydrophobicContact CE1-CD1 4.38Å; F195-I198 PolarHBondContact O-N 3.19Å; I198-N200 PolarHBondContact O-N 3.48Å; I198-L201 PolarHBondContact O-N 3.01Å; I198-A202 PolarHBondContact O-N 3.15Å
199	L	87.9	Confident	87.2	Confident	39 Å²	39	58.7 Å²	58.7	20%	0.204	31%	0.305	C	S	.	.	H	α-helix	trans	-58.3	-48.3	176.3	-178.6	67.8	0	0	0	111.9	F195 Q196 R197 L201 A202 N203 F399	F195-L199 PolarHBondContact O-N 3.34Å; Q196-L199 WeakPolarHBondContact O-CB 3.4Å; Q196-L199 PolarHBondContact O-N 3.47Å; R197-L199 VanDerWaalsContact C-N 3.33Å; L199-L201 VanDerWaalsContact C-N 3.29Å; L199-L201 PolarHBondContact O-N 3.35Å; L199-A202 WeakPolarHBondContact O-CB 3.39Å; L199-A202 PolarHBondContact O-N 3.41Å; L199-A202 VanDerWaalsContact O-N 3.1Å; L199-N203 PolarHBondContact O-N 3.23Å; L199-N203 VanDerWaalsContact O-N 3.07Å; L199-N203 PolarHBondContact O-ND2 3.41Å; L199-F399 HydrophobicContact CD1-CB 4.19Å; L199-F399 HydrophobicContact CD1-CD1 3.61Å; L199-F399 HydrophobicContact CD1-CE1 4.4Å; L199-F399 HydrophobicContact CD1-CG 4.27Å; L199-F399 HydrophobicContact CD2-CD1 3.52Å; L199-F399 HydrophobicContact CD2-CE1 3.81Å; L199-F399 HydrophobicContact CG-CD1 4.05Å
200	N	88.2	Confident	87.2	Confident	41 Å²	41	61 Å²	61	22%	0.219	33%	0.327	C	S	.	.	H	α-helix	trans	-63.6	-33.3	178.1	-71.5	-9.8	0	0	0	113.1	Q196 R197 I198 Q204	Q196-N200 PolarHBondContact O-N 2.85Å; R197-N200 PolarHBondContact O-N 2.95Å; I198-N200 PolarHBondContact O-N 3.48Å; N200-Q204 PolarHBondContact O-NE2 3.16Å
201	L	88.3	Confident	87.2	Confident	96 Å²	96	64.3 Å²	64.3	50%	0.503	33%	0.333	S	S	.	.	H	α-helix	trans	-72.5	-35.7	173.5	-71.6	171.9	0	0	0	112	R197 I198 L199 N203 Q204	R197-L201 HydrophobicContact CG-CD1 4.37Å; R197-L201 WeakPolarHBondContact O-CG 3.04Å; R197-L201 PolarHBondContact O-N 3.15Å; R197-L201 VanDerWaalsContact O-N 3.09Å; I198-L201 PolarHBondContact O-N 3.01Å; L199-L201 VanDerWaalsContact C-N 3.29Å; L199-L201 PolarHBondContact O-N 3.35Å; L201-N203 VanDerWaalsContact C-N 3.3Å; L201-N203 PolarHBondContact O-N 3.28Å; L201-Q204 WeakPolarHBondContact O-CB 3.49Å; L201-Q204 PolarHBondContact O-N 3.33Å; L201-Q204 VanDerWaalsContact O-N 3.11Å
202	A	88.5	Confident	87.1	Confident	49 Å²	49	68.4 Å²	68.4	41%	0.405	34%	0.343	S	S	.	.	H	α-helix	trans	-62.5	-39	175.6	0	0	0	0	0	111.5	I198 L199 Q204 L205	I198-A202 PolarHBondContact O-N 3.15Å; L199-A202 WeakPolarHBondContact O-CB 3.39Å; L199-A202 PolarHBondContact O-N 3.41Å; L199-A202 VanDerWaalsContact O-N 3.1Å; A202-Q204 PolarHBondContact O-N 3.37Å; A202-Q204 VanDerWaalsContact O-N 3.12Å; A202-L205 WeakPolarHBondContact O-CB 3.13Å; A202-L205 WeakPolarHBondContact O-CG 3.41Å; A202-L205 PolarHBondContact O-N 2.93Å; A202-L205 VanDerWaalsContact O-N 3.14Å
203	N	89.1	Confident	87.1	Confident	13 Å²	13	70.3 Å²	70.3	7%	0.07	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-13.8	175.6	-66.2	-28	0	0	0	114	L199 L201 Y375 F399	L199-N203 PolarHBondContact O-N 3.23Å; L199-N203 VanDerWaalsContact O-N 3.07Å; L199-N203 PolarHBondContact O-ND2 3.41Å; L201-N203 VanDerWaalsContact C-N 3.3Å; L201-N203 PolarHBondContact O-N 3.28Å; N203-Y375 HydrophobicContact CB-CE2 3.63Å; N203-Y375 WeakPolarHBondContact CB-OH 3.2Å; N203-Y375 PolarHBondContact ND2-OH 3.07Å; N203-F399 PolarHBondContact ND2-O 3.45Å; N203-F399 PolarHBondContact OD1-N 2.86Å; N203-F399 VanDerWaalsContact OD1-N 3.15Å
204	Q	88.9	Confident	87.3	Confident	67 Å²	67	75 Å²	75	31%	0.313	38%	0.379	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.6	-4.4	178.7	-66.6	171.5	33.4	0	0	113.2	N200 L201 A202 Y375 V378	N200-Q204 PolarHBondContact O-NE2 3.16Å; L201-Q204 WeakPolarHBondContact O-CB 3.49Å; L201-Q204 PolarHBondContact O-N 3.33Å; L201-Q204 VanDerWaalsContact O-N 3.11Å; A202-Q204 PolarHBondContact O-N 3.37Å; A202-Q204 VanDerWaalsContact O-N 3.12Å; Q204-Y375 HydrophobicContact CG-CD2 3.58Å; Q204-Y375 HydrophobicContact CG-CE2 4.23Å; Q204-Y375 HydrophobicContact CG-CG 4.18Å; Q204-V378 WeakPolarHBondContact O-CG2 3.47Å; Q204-V378 PolarHBondContact O-N 2.77Å
205	L	87.9	Confident	87.4	Confident	103 Å²	103	71.1 Å²	71.1	54%	0.539	37%	0.368	S	S	.	.	S	Bend	trans	-61.2	151.2	-178	-72.2	173.4	0	0	0	112	A202	A202-L205 WeakPolarHBondContact O-CB 3.13Å; A202-L205 WeakPolarHBondContact O-CG 3.41Å; A202-L205 PolarHBondContact O-N 2.93Å; A202-L205 VanDerWaalsContact O-N 3.14Å
206	P	87.1	Confident	87.5	Confident	15 Å²	15	70.6 Å²	70.6	10%	0.097	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-58	145.1	174.7	-16.6	25.2	0	0	0	111.8	Y211 R212 L215 V378	P206-Y211 HydrophobicContact CB-CD1 3.79Å; P206-Y211 HydrophobicContact CB-CE1 3.85Å; P206-R212 HydrophobicContact CB-CG 4.06Å; P206-R212 VanDerWaalsContact O-CZ 3.26Å; P206-R212 PolarHBondContact O-NE 2.99Å; P206-R212 PolarHBondContact O-NH2 3.19Å; P206-L215 HydrophobicContact CB-CD2 4.47Å; P206-L215 HydrophobicContact CG-CD2 3.61Å; P206-V378 HydrophobicContact CB-CB 4.21Å; P206-V378 HydrophobicContact CB-CG1 4.29Å; P206-V378 HydrophobicContact CG-CB 3.84Å; P206-V378 HydrophobicContact CG-CG1 3.9Å; P206-V378 HydrophobicContact CG-CG2 4.46Å
207	R	83.8	Confident	87.6	Confident	52 Å²	52	74.5 Å²	74.5	20%	0.196	40%	0.401	C	S	.	.	P	Polyproline II helix	trans	-98	149.8	179.8	-53	-169.3	179.8	-170.4	-1.7	111.8	Y377 D395 E397	R207-Y377 HydrophobicContact CG-CD2 3.79Å; R207-Y377 HydrophobicContact CG-CE2 3.95Å; R207-Y377 VanDerWaalsContact CZ-CE1 3.42Å; R207-D395 IonicContact CZ-OD1 2.67Å; R207-D395 IonicContact CZ-OD2 3.21Å; R207-D395 IonicContact NH1-OD1 3.18Å; R207-D395 PolarHBondContact NH1-OD1 3.13Å; R207-D395 IonicContact NH1-OD2 3.72Å; R207-D395 PolarHBondContact NH1-OD2 2.83Å; R207-D395 IonicContact NH2-OD1 3.59Å; R207-D395 IonicContact NH2-OD2 3.12Å; R207-D395 PolarHBondContact NH2-OD2 2.54Å; R207-E397 WeakPolarHBondContact CB-OE2 3.43Å; R207-E397 WeakPolarHBondContact CD-OE2 3.18Å; R207-E397 WeakPolarHBondContact CG-OE2 3.4Å; R207-E397 IonicContact NE-OE2 3.46Å
208	G	81.7	Confident	87.7	Confident	38 Å²	38	69 Å²	69	39%	0.392	40%	0.397	S	S	.	.	S	Bend	trans	74.5	136.9	179.5	0	0	0	0	0	114.5	A210 R212	G208-A210 PolarHBondContact O-N 3.4Å; G208-R212 WeakPolarHBondContact O-CG 3.5Å; G208-R212 PolarHBondContact O-N 3.24Å
209	S	83.7	Confident	87.8	Confident	84 Å²	84	68.4 Å²	68.4	59%	0.587	39%	0.392	S	S	*	.	H	α-helix	trans	-61.4	-44	-177.8	-165.3	0	0	0	0	112.7	Y211 R212 D213	S209-Y211 PolarHBondContact O-N 2.82Å; S209-R212 WeakPolarHBondContact O-CB 3.4Å; S209-R212 PolarHBondContact O-N 3.47Å; S209-D213 PolarHBondContact O-N 3.39Å
210	A	87.7	Confident	87.7	Confident	67 Å²	67	72.6 Å²	72.6	55%	0.554	42%	0.422	S	S	*	.	H	α-helix	trans	-61.6	-45.1	-175.4	0	0	0	0	0	112.6	G208 R212 D213 E214	G208-A210 PolarHBondContact O-N 3.4Å; A210-R212 VanDerWaalsContact C-N 3.33Å; A210-R212 PolarHBondContact O-N 3.22Å; A210-D213 PolarHBondContact O-N 2.85Å; A210-E214 WeakPolarHBondContact O-CG 3.39Å; A210-E214 PolarHBondContact O-N 3.45Å
211	Y	86.4	Confident	87.8	Confident	91 Å²	91	72.6 Å²	72.6	36%	0.357	43%	0.431	S	S	.	.	H	α-helix	trans	-67.1	-34.5	178.4	-179.7	-119.6	0	0	0	112.2	P206 S209 E214 L215 V378	P206-Y211 HydrophobicContact CB-CD1 3.79Å; P206-Y211 HydrophobicContact CB-CE1 3.85Å; S209-Y211 PolarHBondContact O-N 2.82Å; Y211-E214 PolarHBondContact O-N 2.98Å; Y211-L215 WeakPolarHBondContact O-CB 3.46Å; Y211-L215 PolarHBondContact O-N 2.98Å; Y211-V378 HydrophobicContact CE1-CG1 4.17Å
212	R	86.4	Confident	87.9	Confident	108 Å²	108	69.4 Å²	69.4	41%	0.408	42%	0.415	S	S	.	.	H	α-helix	trans	-62.5	-44	172.8	-68.9	169.7	-177	174.6	4.4	111.3	P206 G208 S209 A210 L215 I216	P206-R212 HydrophobicContact CB-CG 4.06Å; P206-R212 VanDerWaalsContact O-CZ 3.26Å; P206-R212 PolarHBondContact O-NE 2.99Å; P206-R212 PolarHBondContact O-NH2 3.19Å; G208-R212 WeakPolarHBondContact O-CG 3.5Å; G208-R212 PolarHBondContact O-N 3.24Å; S209-R212 WeakPolarHBondContact O-CB 3.4Å; S209-R212 PolarHBondContact O-N 3.47Å; A210-R212 VanDerWaalsContact C-N 3.33Å; A210-R212 PolarHBondContact O-N 3.22Å; R212-L215 PolarHBondContact O-N 3.39Å; R212-I216 WeakPolarHBondContact O-CB 3.09Å; R212-I216 WeakPolarHBondContact O-CD1 3.49Å; R212-I216 WeakPolarHBondContact O-CG1 3.4Å; R212-I216 PolarHBondContact O-N 2.86Å
213	D	88.7	Confident	88	Confident	96 Å²	96	74.5 Å²	74.5	51%	0.513	43%	0.428	S	S	.	.	H	α-helix	trans	-66	-41.8	179.9	-65.4	-36.3	0	0	0	111.6	S209 A210 I216 A217	S209-D213 PolarHBondContact O-N 3.39Å; A210-D213 PolarHBondContact O-N 2.85Å; D213-I216 PolarHBondContact O-N 3.14Å; D213-A217 WeakPolarHBondContact O-CB 3.2Å; D213-A217 PolarHBondContact O-N 3.22Å
214	E	90.4	Very high	88.1	Confident	129 Å²	129	77.2 Å²	77.2	60%	0.603	45%	0.452	S	S	*	.	H	α-helix	trans	-60.2	-44.5	172.6	-73.2	176.3	-170	0	0	112.1	A210 Y211 I216 A217 A218	A210-E214 WeakPolarHBondContact O-CG 3.39Å; A210-E214 PolarHBondContact O-N 3.45Å; Y211-E214 PolarHBondContact O-N 2.98Å; E214-I216 PolarHBondContact O-N 3.42Å; E214-A217 PolarHBondContact O-N 3.18Å; E214-A218 WeakPolarHBondContact O-CB 3.14Å; E214-A218 PolarHBondContact O-N 3.11Å
215	L	88.6	Confident	88.2	Confident	50 Å²	50	80.3 Å²	80.3	26%	0.262	46%	0.464	S	S	.	.	H	α-helix	trans	-63.8	-42	178.5	-171	72.6	0	0	0	111.7	P206 Y211 R212 A217 A218 E219 L222	P206-L215 HydrophobicContact CB-CD2 4.47Å; P206-L215 HydrophobicContact CG-CD2 3.61Å; Y211-L215 WeakPolarHBondContact O-CB 3.46Å; Y211-L215 PolarHBondContact O-N 2.98Å; R212-L215 PolarHBondContact O-N 3.39Å; L215-A217 VanDerWaalsContact C-N 3.32Å; L215-A218 PolarHBondContact O-N 3.23Å; L215-E219 PolarHBondContact O-N 3.32Å; L215-E219 VanDerWaalsContact O-N 3.13Å; L215-L222 HydrophobicContact CD2-CD2 4.02Å; L215-L222 HydrophobicContact CG-CD2 3.81Å
216	I	89.7	Confident	88.3	Confident	55 Å²	55	79.2 Å²	79.2	28%	0.282	46%	0.458	S	S	.	.	H	α-helix	trans	-65.5	-37	176.8	-68.7	165.3	0	0	0	111.3	R212 D213 E214 L222 K223 I226	R212-I216 WeakPolarHBondContact O-CB 3.09Å; R212-I216 WeakPolarHBondContact O-CD1 3.49Å; R212-I216 WeakPolarHBondContact O-CG1 3.4Å; R212-I216 PolarHBondContact O-N 2.86Å; D213-I216 PolarHBondContact O-N 3.14Å; E214-I216 PolarHBondContact O-N 3.42Å; I216-L222 HydrophobicContact CG1-CD2 4.29Å; I216-K223 HydrophobicContact CG2-CB 4.01Å; I216-K223 HydrophobicContact CG2-CG 4.43Å; I216-I226 HydrophobicContact CD1-CD1 3.82Å; I216-I226 HydrophobicContact CG1-CD1 3.74Å
217	A	90.5	Very high	88.5	Confident	86 Å²	86	82.2 Å²	82.2	71%	0.711	48%	0.48	S	S	*	.	H	α-helix	trans	-71.6	-33.7	176	0	0	0	0	0	112.5	D213 E214 L215	D213-A217 WeakPolarHBondContact O-CB 3.2Å; D213-A217 PolarHBondContact O-N 3.22Å; E214-A217 PolarHBondContact O-N 3.18Å; L215-A217 VanDerWaalsContact C-N 3.32Å
218	A	90.6	Very high	88.9	Confident	79 Å²	79	86.7 Å²	86.7	65%	0.653	50%	0.5	S	S	*	.	H	α-helix	trans	-74.8	-38.1	-178.2	0	0	0	0	0	113.7	E214 L215 P220	E214-A218 WeakPolarHBondContact O-CB 3.14Å; E214-A218 PolarHBondContact O-N 3.11Å; L215-A218 PolarHBondContact O-N 3.23Å; A218-P220 WeakPolarHBondContact O-CD 3.34Å
219	E	90	Very high	89.3	Confident	78 Å²	78	88.6 Å²	88.6	36%	0.364	51%	0.507	S	S	.	.	S	Bend	trans	-101.8	107.3	-177.1	-169.7	-171.1	156.3	0	0	112.4	L215 G221 L222 K225	L215-E219 PolarHBondContact O-N 3.32Å; L215-E219 VanDerWaalsContact O-N 3.13Å; E219-G221 PolarHBondContact O-N 2.88Å; E219-G221 VanDerWaalsContact O-N 3.12Å; E219-L222 HydrophobicContact CB-CB 3.92Å; E219-L222 HydrophobicContact CB-CD2 4.35Å; E219-L222 HydrophobicContact CG-CB 4.14Å; E219-L222 PolarHBondContact O-N 2.79Å; E219-K225 IonicContact OE1-NZ 3.95Å; E219-K225 PolarHBondContact OE1-NZ 3.43Å
220	P	85.9	Confident	89.6	Confident	127 Å²	127	89 Å²	89	83%	0.825	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.2	114.3	175	27.7	-32.8	0	0	0	110.3	A218	A218-P220 WeakPolarHBondContact O-CD 3.34Å
221	G	89.1	Confident	89.8	Confident	41 Å²	41	88.3 Å²	88.3	42%	0.423	49%	0.49	S	S	.	.	T	Hydrogen-bonded Turn	trans	113.7	-17.9	179.8	0	0	0	0	0	114.4	E219 K223 A224 K225	E219-G221 PolarHBondContact O-N 2.88Å; E219-G221 VanDerWaalsContact O-N 3.12Å; G221-K223 VanDerWaalsContact C-N 3.31Å; G221-K223 PolarHBondContact O-N 3.22Å; G221-A224 PolarHBondContact O-N 3.02Å; G221-A224 VanDerWaalsContact O-N 3.13Å; G221-K225 PolarHBondContact O-N 3Å
222	L	90.1	Very high	90	Very high	29 Å²	29	84.6 Å²	84.6	15%	0.152	48%	0.479	C	S	.	.	H	α-helix	trans	-60.2	-41.4	177.3	-179.5	58.2	0	0	0	111.7	L215 I216 E219 A224 K225 I226	L215-L222 HydrophobicContact CD2-CD2 4.02Å; L215-L222 HydrophobicContact CG-CD2 3.81Å; I216-L222 HydrophobicContact CG1-CD2 4.29Å; E219-L222 HydrophobicContact CB-CB 3.92Å; E219-L222 HydrophobicContact CB-CD2 4.35Å; E219-L222 HydrophobicContact CG-CB 4.14Å; E219-L222 PolarHBondContact O-N 2.79Å; L222-A224 VanDerWaalsContact C-N 3.28Å; L222-A224 PolarHBondContact O-N 3.34Å; L222-K225 WeakPolarHBondContact O-CB 3.29Å; L222-K225 PolarHBondContact O-N 3.09Å; L222-K225 VanDerWaalsContact O-N 3.12Å; L222-I226 HydrophobicContact CD1-CD1 4.2Å; L222-I226 HydrophobicContact CD1-CG1 4.23Å; L222-I226 HydrophobicContact CG-CD1 3.88Å; L222-I226 HydrophobicContact CG-CG1 4.37Å; L222-I226 WeakPolarHBondContact O-CG1 3.24Å; L222-I226 PolarHBondContact O-N 3.24Å
223	K	90.8	Very high	90.1	Very high	156 Å²	156	82.9 Å²	82.9	68%	0.678	48%	0.48	S	S	*	.	H	α-helix	trans	-55	-41.2	175.1	-170.7	174	-179.2	174.2	0	113	I216 G221 S227	I216-K223 HydrophobicContact CG2-CB 4.01Å; I216-K223 HydrophobicContact CG2-CG 4.43Å; G221-K223 VanDerWaalsContact C-N 3.31Å; G221-K223 PolarHBondContact O-N 3.22Å; K223-S227 WeakPolarHBondContact O-CB 3.42Å; K223-S227 PolarHBondContact O-N 2.8Å
224	A	92.7	Very high	90.2	Very high	70 Å²	70	79.4 Å²	79.4	58%	0.579	46%	0.463	S	S	*	.	H	α-helix	trans	-69.4	-40.2	178.4	0	0	0	0	0	111.7	G221 L222 S227 K228	G221-A224 PolarHBondContact O-N 3.02Å; G221-A224 VanDerWaalsContact O-N 3.13Å; L222-A224 VanDerWaalsContact C-N 3.28Å; L222-A224 PolarHBondContact O-N 3.34Å; A224-S227 PolarHBondContact O-N 3.37Å; A224-K228 PolarHBondContact O-N 2.83Å
225	K	91.1	Very high	90.3	Very high	132 Å²	132	79 Å²	79	57%	0.574	46%	0.46	S	S	*	.	H	α-helix	trans	-62.5	-43.6	174	-66.8	175.8	-176.5	165.9	0	111.8	E219 G221 L222 S227 K228 C229	E219-K225 IonicContact OE1-NZ 3.95Å; E219-K225 PolarHBondContact OE1-NZ 3.43Å; G221-K225 PolarHBondContact O-N 3Å; L222-K225 WeakPolarHBondContact O-CB 3.29Å; L222-K225 PolarHBondContact O-N 3.09Å; L222-K225 VanDerWaalsContact O-N 3.12Å; K225-S227 VanDerWaalsContact C-N 3.35Å; K225-K228 PolarHBondContact O-N 3.43Å; K225-C229 WeakPolarHBondContact O-CB 3.37Å; K225-C229 PolarHBondContact O-N 3.41Å
226	I	89.3	Confident	90.3	Very high	80 Å²	80	78.4 Å²	78.4	41%	0.41	46%	0.456	S	S	.	.	H	α-helix	trans	-61.5	-44.4	175.9	-68.1	169.4	0	0	0	110.4	I216 L222 K228 C229 H230	I216-I226 HydrophobicContact CD1-CD1 3.82Å; I216-I226 HydrophobicContact CG1-CD1 3.74Å; L222-I226 HydrophobicContact CD1-CD1 4.2Å; L222-I226 HydrophobicContact CD1-CG1 4.23Å; L222-I226 HydrophobicContact CG-CD1 3.88Å; L222-I226 HydrophobicContact CG-CG1 4.37Å; L222-I226 WeakPolarHBondContact O-CG1 3.24Å; L222-I226 PolarHBondContact O-N 3.24Å; I226-K228 PolarHBondContact O-N 3.03Å; I226-C229 WeakPolarHBondContact O-CB 3.42Å; I226-C229 PolarHBondContact O-N 3.27Å; I226-H230 PolarHBondContact O-N 3.21Å
227	S	91.1	Very high	90.4	Very high	79 Å²	79	78 Å²	78	55%	0.552	45%	0.454	S	S	*	.	H	α-helix	trans	-62.8	-41.4	176.4	-178	0	0	0	0	112.4	K223 A224 K225 H230 S231	K223-S227 WeakPolarHBondContact O-CB 3.42Å; K223-S227 PolarHBondContact O-N 2.8Å; A224-S227 PolarHBondContact O-N 3.37Å; K225-S227 VanDerWaalsContact C-N 3.35Å; S227-H230 PolarHBondContact O-N 2.96Å; S227-S231 WeakPolarHBondContact O-CB 3.42Å; S227-S231 PolarHBondContact O-N 3.27Å
228	K	92.3	Very high	90.4	Very high	145 Å²	145	74.7 Å²	74.7	63%	0.63	43%	0.425	S	S	*	.	H	α-helix	trans	-60.4	-45.1	172.7	-173.6	178.9	179.3	-179.2	0	110.8	A224 K225 I226 S231 A232	A224-K228 PolarHBondContact O-N 2.83Å; K225-K228 PolarHBondContact O-N 3.43Å; I226-K228 PolarHBondContact O-N 3.03Å; K228-S231 PolarHBondContact O-N 3.35Å; K228-A232 WeakPolarHBondContact O-CB 3.46Å; K228-A232 PolarHBondContact O-N 3.34Å
229	C	90	Very high	90.5	Very high	78 Å²	78	73.5 Å²	73.5	53%	0.527	41%	0.405	S	S	.	.	H	α-helix	trans	-60.4	-48.9	177	-173.7	0	0	0	0	111.8	K225 I226 S231 A232 V233	K225-C229 WeakPolarHBondContact O-CB 3.37Å; K225-C229 PolarHBondContact O-N 3.41Å; I226-C229 WeakPolarHBondContact O-CB 3.42Å; I226-C229 PolarHBondContact O-N 3.27Å; C229-S231 PolarHBondContact O-N 2.92Å; C229-A232 WeakPolarHBondContact O-CB 3.19Å; C229-A232 PolarHBondContact O-N 3.38Å; C229-A232 VanDerWaalsContact O-N 3.11Å; C229-V233 WeakPolarHBondContact O-CG2 3.36Å; C229-V233 PolarHBondContact O-N 3.29Å
230	H	90.1	Very high	90.6	Very high	93 Å²	93	74.3 Å²	74.3	43%	0.431	41%	0.41	S	S	.	.	H	α-helix	trans	-57.6	-49	176	179.3	-79.1	0	0	0	111.3	I226 S227 A232 V233 S234	I226-H230 PolarHBondContact O-N 3.21Å; S227-H230 PolarHBondContact O-N 2.96Å; H230-A232 PolarHBondContact O-N 3.26Å; H230-V233 PolarHBondContact O-N 2.96Å; H230-S234 PolarHBondContact CE1-OG 2.95Å; H230-S234 PolarHBondContact O-N 2.94Å; H230-S234 PolarHBondContact O-OG 3.49Å
231	S	91.2	Very high	90.9	Very high	52 Å²	52	68.5 Å²	68.5	36%	0.364	37%	0.372	S	S	.	.	H	α-helix	trans	-58.6	-38	176.8	179.9	0	0	0	0	112.2	S227 K228 C229 K235	S227-S231 WeakPolarHBondContact O-CB 3.42Å; S227-S231 PolarHBondContact O-N 3.27Å; K228-S231 PolarHBondContact O-N 3.35Å; C229-S231 PolarHBondContact O-N 2.92Å; S231-K235 VanDerWaalsContact O-CG 3.27Å; S231-K235 WeakPolarHBondContact O-CG 3.36Å; S231-K235 PolarHBondContact O-N 2.64Å
232	A	90.9	Very high	91	Very high	14 Å²	14	68.3 Å²	68.3	12%	0.116	37%	0.367	C	S	.	.	H	α-helix	trans	-66.1	-54.6	177.5	0	0	0	0	0	110.2	W31 K228 C229 H230 S234 K235 M236	W31-A232 HydrophobicContact CD2-CB 4.13Å; W31-A232 HydrophobicContact CE3-CB 4.25Å; W31-A232 VanDerWaalsContact CH2-CA 3.48Å; W31-A232 HydrophobicContact CH2-CB 3.37Å; W31-A232 WeakPolarHBondContact CH2-O 3.3Å; W31-A232 HydrophobicContact CZ2-CB 3.13Å; W31-A232 HydrophobicContact CZ3-CB 3.89Å; K228-A232 WeakPolarHBondContact O-CB 3.46Å; K228-A232 PolarHBondContact O-N 3.34Å; C229-A232 WeakPolarHBondContact O-CB 3.19Å; C229-A232 PolarHBondContact O-N 3.38Å; C229-A232 VanDerWaalsContact O-N 3.11Å; H230-A232 PolarHBondContact O-N 3.26Å; A232-S234 VanDerWaalsContact C-N 3.28Å; A232-S234 PolarHBondContact O-N 2.93Å; A232-K235 WeakPolarHBondContact O-CA 3.46Å; A232-K235 WeakPolarHBondContact O-CB 3.44Å; A232-K235 PolarHBondContact O-N 2.82Å; A232-M236 PolarHBondContact O-N 3.22Å
233	V	89.2	Confident	91	Very high	72 Å²	72	68.3 Å²	68.3	44%	0.436	37%	0.367	S	S	.	.	H	α-helix	trans	-55.2	-42.2	177.6	174.9	0	0	0	0	112	C229 H230 K235 M236 L237	C229-V233 WeakPolarHBondContact O-CG2 3.36Å; C229-V233 PolarHBondContact O-N 3.29Å; H230-V233 PolarHBondContact O-N 2.96Å; V233-K235 PolarHBondContact O-N 3.41Å; V233-M236 HydrophobicContact CG1-CE 4.46Å; V233-M236 PolarHBondContact O-N 2.84Å; V233-L237 PolarHBondContact O-N 3.22Å
234	S	91	Very high	91	Very high	23 Å²	23	63.3 Å²	63.3	16%	0.161	35%	0.346	C	S	.	.	H	α-helix	trans	-61.8	-41.4	174.9	-57.5	0	0	0	0	112.7	H230 A232 L237 D238	H230-S234 PolarHBondContact CE1-OG 2.95Å; H230-S234 PolarHBondContact O-N 2.94Å; H230-S234 PolarHBondContact O-OG 3.49Å; A232-S234 VanDerWaalsContact C-N 3.28Å; A232-S234 PolarHBondContact O-N 2.93Å; S234-L237 PolarHBondContact O-N 3.21Å; S234-D238 PolarHBondContact O-N 3.26Å
235	K	91.5	Very high	90.9	Very high	120 Å²	120	61.4 Å²	61.4	52%	0.522	33%	0.326	S	S	.	.	H	α-helix	trans	-64.4	-40.1	175.9	-74.8	172.6	-176.6	-178.3	0	112.2	S231 A232 V233 L237 D238 E239	S231-K235 VanDerWaalsContact O-CG 3.27Å; S231-K235 WeakPolarHBondContact O-CG 3.36Å; S231-K235 PolarHBondContact O-N 2.64Å; A232-K235 WeakPolarHBondContact O-CA 3.46Å; A232-K235 WeakPolarHBondContact O-CB 3.44Å; A232-K235 PolarHBondContact O-N 2.82Å; V233-K235 PolarHBondContact O-N 3.41Å; K235-L237 VanDerWaalsContact C-N 3.34Å; K235-D238 WeakPolarHBondContact O-CB 3.5Å; K235-D238 PolarHBondContact O-N 3.29Å; K235-E239 WeakPolarHBondContact O-CG 3.38Å; K235-E239 PolarHBondContact O-N 3.36Å
236	M	89.2	Confident	90.9	Very high	38 Å²	38	57.6 Å²	57.6	19%	0.187	31%	0.311	C	S	.	.	H	α-helix	trans	-64.6	-40.8	176.5	176.5	-175.2	81.7	0	0	111.5	W31 F195 A232 V233 E239 M240	W31-M236 HydrophobicContact CH2-CB 3.88Å; W31-M236 HydrophobicContact CZ3-CB 4.49Å; F195-M236 HydrophobicContact CE1-CE 3.71Å; F195-M236 HydrophobicContact CE1-SD 3.43Å; F195-M236 WeakPolarHBondContact CE1-SD 3.45Å; F195-M236 HydrophobicContact CZ-CE 4.37Å; F195-M236 HydrophobicContact CZ-CG 4.43Å; F195-M236 HydrophobicContact CZ-SD 3.89Å; A232-M236 PolarHBondContact O-N 3.22Å; V233-M236 HydrophobicContact CG1-CE 4.46Å; V233-M236 PolarHBondContact O-N 2.84Å; M236-E239 PolarHBondContact O-N 3.34Å; M236-M240 WeakPolarHBondContact O-CG 3.34Å; M236-M240 PolarHBondContact O-N 2.83Å
237	L	91.2	Very high	90.9	Very high	45 Å²	45	56.8 Å²	56.8	24%	0.236	31%	0.307	C	S	.	.	H	α-helix	trans	-61.8	-43.9	172.8	-178.5	59.4	0	0	0	111.4	V233 S234 K235 E239 M240 L241 Y305	V233-L237 PolarHBondContact O-N 3.22Å; S234-L237 PolarHBondContact O-N 3.21Å; K235-L237 VanDerWaalsContact C-N 3.34Å; L237-E239 VanDerWaalsContact C-N 3.29Å; L237-E239 PolarHBondContact O-N 3.12Å; L237-M240 PolarHBondContact O-N 3.28Å; L237-L241 HydrophobicContact CD1-CD1 4.37Å; L237-L241 HydrophobicContact CD1-CG 4.43Å; L237-L241 HydrophobicContact CG-CD1 4.14Å; L237-L241 WeakPolarHBondContact O-CG 3.28Å; L237-L241 PolarHBondContact O-N 2.83Å; L237-Y305 HydrophobicContact CD2-CD1 3.36Å; L237-Y305 HydrophobicContact CD2-CD2 3.96Å; L237-Y305 HydrophobicContact CD2-CE1 3.74Å; L237-Y305 HydrophobicContact CD2-CE2 4.29Å; L237-Y305 HydrophobicContact CD2-CG 3.49Å; L237-Y305 VanDerWaalsContact CD2-CG 3.49Å; L237-Y305 HydrophobicContact CG-CD1 4.03Å; L237-Y305 HydrophobicContact CG-CE1 4.09Å
238	D	91.7	Very high	90.9	Very high	18 Å²	18	54 Å²	54	10%	0.096	29%	0.285	C	S	.	.	H	α-helix	trans	-58.6	-39.4	174.2	-77.2	-31.3	0	0	0	112.4	S234 K235 A242 R298 C299 Y305	S234-D238 PolarHBondContact O-N 3.26Å; K235-D238 WeakPolarHBondContact O-CB 3.5Å; K235-D238 PolarHBondContact O-N 3.29Å; D238-A242 WeakPolarHBondContact O-CB 3.41Å; D238-A242 PolarHBondContact O-N 3.27Å; D238-R298 HydrophobicContact CB-CG 4.35Å; D238-R298 WeakPolarHBondContact OD1-CA 3.48Å; D238-C299 PolarHBondContact OD1-N 3.22Å; D238-C299 PolarHBondContact OD2-N 3.02Å; D238-C299 PolarHBondContact OD2-SG 2.98Å; D238-C299 VanDerWaalsContact OD2-SG 3.34Å; D238-Y305 PolarHBondContact OD1-OH 2.94Å
239	E	92.2	Very high	90.8	Very high	53 Å²	53	49.1 Å²	49.1	25%	0.248	27%	0.269	C	S	.	.	H	α-helix	trans	-68.7	-38.7	176.3	-75.5	175.2	-174.1	0	0	112.4	L35 I38 K235 M236 L237 A242 L243	L35-E239 VanDerWaalsContact CD1-OE1 3.29Å; L35-E239 WeakPolarHBondContact CD1-OE1 3.48Å; I38-E239 HydrophobicContact CD1-CB 4.35Å; I38-E239 WeakPolarHBondContact CD1-OE2 3.26Å; I38-E239 HydrophobicContact CG2-CB 4.38Å; K235-E239 WeakPolarHBondContact O-CG 3.38Å; K235-E239 PolarHBondContact O-N 3.36Å; M236-E239 PolarHBondContact O-N 3.34Å; L237-E239 VanDerWaalsContact C-N 3.29Å; L237-E239 PolarHBondContact O-N 3.12Å; E239-A242 PolarHBondContact O-N 2.6Å; E239-L243 PolarHBondContact O-N 2.89Å
240	M	91.4	Very high	90.7	Very high	95 Å²	95	49.8 Å²	49.8	47%	0.468	26%	0.261	S	S	.	.	H	α-helix	trans	-66.1	-42.4	174.8	-70.2	-179.8	71.8	0	0	111.7	F195 M236 L237 A242 L243 E244	F195-M240 HydrophobicContact CZ-SD 4.07Å; M236-M240 WeakPolarHBondContact O-CG 3.34Å; M236-M240 PolarHBondContact O-N 2.83Å; L237-M240 PolarHBondContact O-N 3.28Å; M240-A242 VanDerWaalsContact C-N 3.3Å; M240-A242 PolarHBondContact O-N 2.86Å; M240-L243 WeakPolarHBondContact O-CB 3.37Å; M240-L243 PolarHBondContact O-N 2.95Å; M240-E244 WeakPolarHBondContact O-CB 3.41Å; M240-E244 PolarHBondContact O-N 3.34Å
241	L	92	Very high	90.5	Very high	5 Å²	5	47.4 Å²	47.4	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-65.4	-34.6	174.8	-70	169.5	0	0	0	111.7	L237 E244 D245 R297 Y305 L308 L309 L312	L237-L241 HydrophobicContact CD1-CD1 4.37Å; L237-L241 HydrophobicContact CD1-CG 4.43Å; L237-L241 HydrophobicContact CG-CD1 4.14Å; L237-L241 WeakPolarHBondContact O-CG 3.28Å; L237-L241 PolarHBondContact O-N 2.83Å; L241-E244 WeakPolarHBondContact CD2-OE2 3.36Å; L241-D245 WeakPolarHBondContact O-CB 3.35Å; L241-D245 PolarHBondContact O-N 2.96Å; L241-R297 WeakPolarHBondContact CD1-O 3.43Å; L241-Y305 HydrophobicContact CD1-CD1 4.09Å; L241-Y305 HydrophobicContact CD1-CE1 4.01Å; L241-L308 HydrophobicContact CD1-CD2 4.02Å; L241-L309 HydrophobicContact CD2-CD2 3.94Å; L241-L312 HydrophobicContact CD2-CD1 3.91Å
242	A	91.5	Very high	90.3	Very high	37 Å²	37	48.1 Å²	48.1	31%	0.306	25%	0.254	S	S	.	.	H	α-helix	trans	-68.5	-37.7	173.4	0	0	0	0	0	112.4	D238 E239 M240 M246	D238-A242 WeakPolarHBondContact O-CB 3.41Å; D238-A242 PolarHBondContact O-N 3.27Å; E239-A242 PolarHBondContact O-N 2.6Å; M240-A242 VanDerWaalsContact C-N 3.3Å; M240-A242 PolarHBondContact O-N 2.86Å; A242-M246 WeakPolarHBondContact O-CB 3.11Å; A242-M246 PolarHBondContact O-N 3.34Å
243	L	90.9	Very high	90.1	Very high	30 Å²	30	53.5 Å²	53.5	16%	0.157	28%	0.277	C	S	.	.	H	α-helix	trans	-64.6	-45.6	173.6	175.9	61.7	0	0	0	111.1	I41 I45 L188 E239 M240 M246 L247	I41-L243 HydrophobicContact CG2-CD1 3.96Å; I41-L243 HydrophobicContact CG2-CD2 4.47Å; I45-L243 HydrophobicContact CD1-CD1 3.41Å; I45-L243 VanDerWaalsContact CD1-CD1 3.41Å; L188-L243 HydrophobicContact CD2-CD2 4.34Å; E239-L243 PolarHBondContact O-N 2.89Å; M240-L243 WeakPolarHBondContact O-CB 3.37Å; M240-L243 PolarHBondContact O-N 2.95Å; L243-M246 WeakPolarHBondContact O-CB 3.28Å; L243-M246 PolarHBondContact O-N 2.99Å; L243-L247 HydrophobicContact CD1-CD1 4.4Å; L243-L247 HydrophobicContact CD1-CG 4.32Å; L243-L247 HydrophobicContact CG-CD1 4.28Å; L243-L247 WeakPolarHBondContact O-CG 3.47Å; L243-L247 PolarHBondContact O-N 2.87Å
244	E	91.1	Very high	90.1	Very high	51 Å²	51	50.3 Å²	50.3	24%	0.238	26%	0.258	C	S	.	.	H	α-helix	trans	-57.3	-50.2	175.5	179.6	-178.6	-169.2	0	0	111.3	M240 L241 M246 L247 F248	M240-E244 WeakPolarHBondContact O-CB 3.41Å; M240-E244 PolarHBondContact O-N 3.34Å; L241-E244 WeakPolarHBondContact CD2-OE2 3.36Å; E244-M246 VanDerWaalsContact C-N 3.26Å; E244-M246 PolarHBondContact O-N 3.48Å; E244-L247 PolarHBondContact O-N 3.46Å; E244-L247 VanDerWaalsContact O-N 3.13Å; E244-F248 HydrophobicContact CG-CD2 3.86Å; E244-F248 HydrophobicContact CG-CE2 3.31Å; E244-F248 HydrophobicContact CG-CZ 3.82Å; E244-F248 WeakPolarHBondContact O-CD2 3.35Å; E244-F248 PolarHBondContact O-N 3.18Å; E244-F248 VanDerWaalsContact OE1-CE2 3.3Å; E244-F248 WeakPolarHBondContact OE1-CE2 3.45Å
245	D	90.7	Very high	90	Very high	29 Å²	29	51.2 Å²	51.2	16%	0.155	26%	0.262	C	S	.	.	H	α-helix	trans	-58.4	-40.1	177.5	-161.2	57.2	0	0	0	112.1	L241 S249 S258 T259 R297	L241-D245 WeakPolarHBondContact O-CB 3.35Å; L241-D245 PolarHBondContact O-N 2.96Å; D245-S249 WeakPolarHBondContact O-CB 3.49Å; D245-S249 PolarHBondContact O-N 3.02Å; D245-S258 WeakPolarHBondContact OD1-CA 3.26Å; D245-T259 WeakPolarHBondContact OD1-CB 3.45Å; D245-T259 PolarHBondContact OD1-N 2.85Å; D245-T259 PolarHBondContact OD1-OG1 3.27Å; D245-T259 WeakPolarHBondContact OD2-CB 3.43Å; D245-T259 PolarHBondContact OD2-OG1 3.46Å; D245-R297 IonicContact OD1-CZ 2.96Å; D245-R297 IonicContact OD1-NH1 2.93Å; D245-R297 PolarHBondContact OD1-NH1 2.93Å
246	M	90.2	Very high	89.8	Confident	53 Å²	53	50.7 Å²	50.7	26%	0.261	27%	0.265	S	S	.	.	H	α-helix	trans	-65.1	-44.7	176.5	-173.5	177.5	-57.7	0	0	111.7	V42 I45 A242 L243 E244 S249 R250	V42-M246 HydrophobicContact CG1-CE 4.15Å; V42-M246 HydrophobicContact CG2-CE 4.36Å; I45-M246 HydrophobicContact CB-SD 4.15Å; I45-M246 HydrophobicContact CG2-CG 3.96Å; I45-M246 HydrophobicContact CG2-SD 3.35Å; I45-M246 WeakPolarHBondContact CG2-SD 3.25Å; A242-M246 WeakPolarHBondContact O-CB 3.11Å; A242-M246 PolarHBondContact O-N 3.34Å; L243-M246 WeakPolarHBondContact O-CB 3.28Å; L243-M246 PolarHBondContact O-N 2.99Å; E244-M246 VanDerWaalsContact C-N 3.26Å; E244-M246 PolarHBondContact O-N 3.48Å; M246-S249 PolarHBondContact O-N 3.23Å; M246-S249 PolarHBondContact O-OG 2.86Å; M246-R250 WeakPolarHBondContact O-CD 3.41Å; M246-R250 WeakPolarHBondContact O-CG 3.47Å
247	L	90	Very high	89.7	Confident	63 Å²	63	49.8 Å²	49.8	33%	0.33	26%	0.261	S	S	.	.	H	α-helix	trans	-62	-45.6	178.3	-69.9	173.6	0	0	0	111.1	I45 L184 L243 E244 S249 R250	I45-L247 HydrophobicContact CD1-CD2 4.46Å; L184-L247 HydrophobicContact CD2-CD2 3.91Å; L243-L247 HydrophobicContact CD1-CD1 4.4Å; L243-L247 HydrophobicContact CD1-CG 4.32Å; L243-L247 HydrophobicContact CG-CD1 4.28Å; L243-L247 WeakPolarHBondContact O-CG 3.47Å; L243-L247 PolarHBondContact O-N 2.87Å; E244-L247 PolarHBondContact O-N 3.46Å; E244-L247 VanDerWaalsContact O-N 3.13Å; L247-S249 PolarHBondContact O-N 3.04Å; L247-R250 PolarHBondContact O-N 2.78Å
248	F	91.3	Very high	89.5	Confident	19 Å²	19	47.6 Å²	47.6	8%	0.083	25%	0.25	C	C	.	.	H	α-helix	trans	-63.4	-39.2	176.1	-67	-31.3	0	0	0	113.1	E244 R250 D251 T254 V255 L257 F316	E244-F248 HydrophobicContact CG-CD2 3.86Å; E244-F248 HydrophobicContact CG-CE2 3.31Å; E244-F248 HydrophobicContact CG-CZ 3.82Å; E244-F248 WeakPolarHBondContact O-CD2 3.35Å; E244-F248 PolarHBondContact O-N 3.18Å; E244-F248 VanDerWaalsContact OE1-CE2 3.3Å; E244-F248 WeakPolarHBondContact OE1-CE2 3.45Å; F248-R250 PolarHBondContact O-N 3.35Å; F248-D251 PolarHBondContact O-N 3.47Å; F248-T254 HydrophobicContact CD1-CG2 4.08Å; F248-T254 HydrophobicContact CE1-CG2 4.39Å; F248-T254 CarbonylContact O-C 3.28Å; F248-T254 PolarHBondContact O-OG1 2.91Å; F248-V255 VanDerWaalsContact O-CA 3.3Å; F248-V255 WeakPolarHBondContact O-CA 3.47Å; F248-V255 PolarHBondContact O-N 2.58Å; F248-L257 HydrophobicContact CB-CB 4.44Å; F248-L257 HydrophobicContact CD2-CB 3.85Å; F248-L257 HydrophobicContact CE1-CD1 4.3Å; F248-L257 HydrophobicContact CE2-CB 4.16Å; F248-L257 HydrophobicContact CG-CB 4.05Å; F248-L257 HydrophobicContact CZ-CD1 4.33Å; F248-F316 AromaticContact CE1-CD2 3.6Å; F248-F316 HydrophobicContact CE1-CD2 3.6Å; F248-F316 AromaticContact CE1-CE2 3.57Å; F248-F316 HydrophobicContact CE1-CE2 3.57Å; F248-F316 AromaticContact CZ-CD2 3.61Å; F248-F316 HydrophobicContact CZ-CD2 3.61Å; F248-F316 AromaticContact CZ-CE2 3.97Å; F248-F316 HydrophobicContact CZ-CE2 3.97Å; F248-F316 HydrophobicContact CZ-CG 4.25Å
249	S	89.9	Confident	89	Confident	43 Å²	43	48.6 Å²	48.6	30%	0.301	26%	0.256	S	S	.	.	H	α-helix	trans	-63.1	-16.9	-179.7	72.7	0	0	0	0	114.2	D245 M246 L247 T260	D245-S249 WeakPolarHBondContact O-CB 3.49Å; D245-S249 PolarHBondContact O-N 3.02Å; M246-S249 PolarHBondContact O-N 3.23Å; M246-S249 PolarHBondContact O-OG 2.86Å; L247-S249 PolarHBondContact O-N 3.04Å; S249-T260 VanDerWaalsContact CB-OG1 3.25Å; S249-T260 WeakPolarHBondContact CB-OG1 3.4Å
250	R	86.7	Confident	87.9	Confident	93 Å²	93	49.6 Å²	49.6	35%	0.351	27%	0.266	S	S	.	.	H	α-helix	trans	-99.1	-17.8	-172.2	-74	162.1	171.8	-107.1	0.4	113.8	I45 T48 M246 L247 F248	I45-R250 VanDerWaalsContact C-NH2 3.33Å; I45-R250 VanDerWaalsContact CG2-NH1 3.28Å; I45-R250 VanDerWaalsContact CG2-NH2 3.31Å; I45-R250 PolarHBondContact O-NH1 3.49Å; I45-R250 PolarHBondContact O-NH2 3.23Å; T48-R250 PolarHBondContact O-NH1 3.43Å; T48-R250 VanDerWaalsContact O-NH1 3.08Å; T48-R250 PolarHBondContact OG1-NH1 3.08Å; M246-R250 WeakPolarHBondContact O-CD 3.41Å; M246-R250 WeakPolarHBondContact O-CG 3.47Å; L247-R250 PolarHBondContact O-N 2.78Å; F248-R250 PolarHBondContact O-N 3.35Å
251	D	86.6	Confident	86.3	Confident	42 Å²	42	45.4 Å²	45.4	23%	0.225	25%	0.247	C	C	.	.	S	Bend	trans	-107.9	123.1	-179.1	167.8	49.9	0	0	0	109.2	F248 E253 T254 V255 Y319	F248-D251 PolarHBondContact O-N 3.47Å; D251-E253 PolarHBondContact O-N 3.45Å; D251-T254 WeakPolarHBondContact CB-OG1 3.4Å; D251-T254 CarbonylContact O-C 3.6Å; D251-T254 PolarHBondContact O-N 2.78Å; D251-T254 VanDerWaalsContact O-N 3.17Å; D251-T254 WeakPolarHBondContact OD2-CG2 3.31Å; D251-T254 PolarHBondContact OD2-N 3.11Å; D251-T254 PolarHBondContact OD2-OG1 3.33Å; D251-V255 PolarHBondContact O-N 3.34Å; D251-Y319 PolarHBondContact OD2-OH 2.92Å
252	P	87	Confident	84.3	Confident	68 Å²	68	47.1 Å²	47.1	44%	0.442	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62	-26.6	-175.8	24.2	-35.1	0	0	0	113.7	L52 V255	L52-P252 HydrophobicContact CD1-CG 3.75Å; L52-P252 HydrophobicContact CD2-CG 3.82Å; L52-P252 HydrophobicContact CG-CG 4.34Å; P252-V255 WeakPolarHBondContact O-CG1 3.32Å
253	E	87.4	Confident	82.2	Confident	127 Å²	127	48.9 Å²	48.9	59%	0.593	27%	0.267	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-28.8	179.3	-65.9	175.1	-169.3	0	0	111.8	D251 Y319	D251-E253 PolarHBondContact O-N 3.45Å; E253-Y319 HydrophobicContact CB-CD2 4.06Å; E253-Y319 HydrophobicContact CB-CE2 3.63Å; E253-Y319 WeakPolarHBondContact OE2-CE2 3.49Å
254	T	89.4	Confident	79.7	Confident	4 Å²	4	50.7 Å²	50.7	3%	0.025	29%	0.286	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.4	-0.4	-179.1	53.8	0	0	0	0	114.5	F248 D251 N256 L257 Y319	F248-T254 HydrophobicContact CD1-CG2 4.08Å; F248-T254 HydrophobicContact CE1-CG2 4.39Å; F248-T254 CarbonylContact O-C 3.28Å; F248-T254 PolarHBondContact O-OG1 2.91Å; D251-T254 WeakPolarHBondContact CB-OG1 3.4Å; D251-T254 CarbonylContact O-C 3.6Å; D251-T254 PolarHBondContact O-N 2.78Å; D251-T254 VanDerWaalsContact O-N 3.17Å; D251-T254 WeakPolarHBondContact OD2-CG2 3.31Å; D251-T254 PolarHBondContact OD2-N 3.11Å; D251-T254 PolarHBondContact OD2-OG1 3.33Å; T254-N256 PolarHBondContact O-N 2.96Å; T254-L257 HydrophobicContact CG2-CD1 4.24Å; T254-L257 WeakPolarHBondContact O-CA 3.43Å; T254-L257 VanDerWaalsContact O-CB 3.28Å; T254-L257 WeakPolarHBondContact O-CB 3.37Å; T254-L257 PolarHBondContact O-N 3.42Å; T254-Y319 HydrophobicContact CG2-CD1 3.47Å; T254-Y319 VanDerWaalsContact CG2-CD1 3.47Å; T254-Y319 HydrophobicContact CG2-CD2 3.57Å; T254-Y319 HydrophobicContact CG2-CE1 3.39Å; T254-Y319 HydrophobicContact CG2-CE2 3.5Å; T254-Y319 VanDerWaalsContact CG2-CE2 3.5Å; T254-Y319 HydrophobicContact CG2-CG 3.53Å
255	V	88.4	Confident	77.3	Confident	43 Å²	43	51.8 Å²	51.8	26%	0.261	30%	0.296	S	S	.	.	G	3₁₀ helix	trans	-55	-32.3	-178.7	73.6	0	0	0	0	113	F248 D251 P252 L257 S258	F248-V255 VanDerWaalsContact O-CA 3.3Å; F248-V255 WeakPolarHBondContact O-CA 3.47Å; F248-V255 PolarHBondContact O-N 2.58Å; D251-V255 PolarHBondContact O-N 3.34Å; P252-V255 WeakPolarHBondContact O-CG1 3.32Å; V255-L257 PolarHBondContact O-N 2.94Å; V255-S258 WeakPolarHBondContact O-CB 3.19Å; V255-S258 PolarHBondContact O-N 3.47Å; V255-S258 PolarHBondContact O-OG 3.39Å
256	N	87.3	Confident	74.6	Confident	109 Å²	109	54.9 Å²	54.9	58%	0.583	31%	0.309	S	S	*	.	G	3₁₀ helix	trans	-65.7	-23.8	176.7	-63.3	-26.9	0	0	0	113	T254 S258	T254-N256 PolarHBondContact O-N 2.96Å; N256-S258 VanDerWaalsContact C-N 3.33Å
257	L	87.8	Confident	71.7	Confident	18 Å²	18	61.4 Å²	61.4	9%	0.094	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-81.6	-13.9	174.2	-55.2	178.2	0	0	0	112.3	F248 T254 V255 L293 R297 A315 F316	F248-L257 HydrophobicContact CB-CB 4.44Å; F248-L257 HydrophobicContact CD2-CB 3.85Å; F248-L257 HydrophobicContact CE1-CD1 4.3Å; F248-L257 HydrophobicContact CE2-CB 4.16Å; F248-L257 HydrophobicContact CG-CB 4.05Å; F248-L257 HydrophobicContact CZ-CD1 4.33Å; T254-L257 HydrophobicContact CG2-CD1 4.24Å; T254-L257 WeakPolarHBondContact O-CA 3.43Å; T254-L257 VanDerWaalsContact O-CB 3.28Å; T254-L257 WeakPolarHBondContact O-CB 3.37Å; T254-L257 PolarHBondContact O-N 3.42Å; V255-L257 PolarHBondContact O-N 2.94Å; L257-L293 HydrophobicContact CB-CD1 4.37Å; L257-L293 HydrophobicContact CD2-CD1 3.97Å; L257-R297 VanDerWaalsContact O-CZ 3.26Å; L257-R297 PolarHBondContact O-NH1 3.45Å; L257-R297 PolarHBondContact O-NH2 2.89Å; L257-A315 HydrophobicContact CD2-CB 3.78Å; L257-F316 HydrophobicContact CD1-CB 4.33Å; L257-F316 HydrophobicContact CD1-CD2 3.85Å
258	S	86	Confident	69.1	Low	0 Å²	0	69.4 Å²	69.4	0%	0	36%	0.362	C	S	.	.	S	Bend	trans	-83.8	147	177.4	79.4	0	0	0	0	112.5	D245 V255 N256 T260 G261 S262	D245-S258 WeakPolarHBondContact OD1-CA 3.26Å; V255-S258 WeakPolarHBondContact O-CB 3.19Å; V255-S258 PolarHBondContact O-N 3.47Å; V255-S258 PolarHBondContact O-OG 3.39Å; N256-S258 VanDerWaalsContact C-N 3.33Å; S258-T260 PolarHBondContact O-N 2.97Å; S258-T260 PolarHBondContact OG-OG1 2.91Å; S258-T260 VanDerWaalsContact OG-OG1 3.12Å; S258-G261 PolarHBondContact O-N 3.08Å; S258-G261 PolarHBondContact OG-N 2.97Å; S258-S262 PolarHBondContact O-N 2.95Å
259	T	81.3	Confident	66.6	Low	38 Å²	38	72.5 Å²	72.5	23%	0.233	38%	0.383	C	S	.	.	H	α-helix	trans	-63.3	-33	174.4	-45.1	0	0	0	0	111	D245 K295 R297	D245-T259 WeakPolarHBondContact OD1-CB 3.45Å; D245-T259 PolarHBondContact OD1-N 2.85Å; D245-T259 PolarHBondContact OD1-OG1 3.27Å; D245-T259 WeakPolarHBondContact OD2-CB 3.43Å; D245-T259 PolarHBondContact OD2-OG1 3.46Å; T259-K295 WeakPolarHBondContact CG2-O 3.37Å; T259-R297 PolarHBondContact OG1-NE 3.3Å
260	T	69.1	Low	63.7	Low	75 Å²	75	79.6 Å²	79.6	46%	0.46	41%	0.408	S	S	.	.	H	α-helix	trans	-71.5	-35.7	176.7	46	0	0	0	0	112.9	S249 S258 T263	S249-T260 VanDerWaalsContact CB-OG1 3.25Å; S249-T260 WeakPolarHBondContact CB-OG1 3.4Å; S258-T260 PolarHBondContact O-N 2.97Å; S258-T260 PolarHBondContact OG-OG1 2.91Å; S258-T260 VanDerWaalsContact OG-OG1 3.12Å; T260-T263 PolarHBondContact O-N 3.15Å; T260-T263 PolarHBondContact O-OG1 3.38Å
261	G	57.4	Low	60.8	Low	7 Å²	7	84.1 Å²	84.1	7%	0.072	43%	0.43	C	S	.	.	H	α-helix	trans	-64.4	-43	-179.1	0	0	0	0	0	112.6	S258 T263 A264 V265	S258-G261 PolarHBondContact O-N 3.08Å; S258-G261 PolarHBondContact OG-N 2.97Å; G261-T263 VanDerWaalsContact C-N 3.26Å; G261-T263 PolarHBondContact O-N 3.43Å; G261-A264 PolarHBondContact O-N 3.36Å; G261-A264 VanDerWaalsContact O-N 3.09Å; G261-V265 PolarHBondContact O-N 2.99Å
262	S	51	Low	58.2	Low	40 Å²	40	88.7 Å²	88.7	28%	0.28	46%	0.455	S	S	.	.	H	α-helix	trans	-58.2	-35.9	176.8	-60	0	0	0	0	112.7	S258 A264 E266	S258-S262 PolarHBondContact O-N 2.95Å; S262-A264 VanDerWaalsContact C-N 3.34Å; S262-A264 PolarHBondContact O-N 2.67Å; S262-E266 PolarHBondContact O-N 3.46Å
263	T	46.3	Very low	55.5	Low	74 Å²	74	93 Å²	93	45%	0.454	47%	0.474	S	S	.	.	H	α-helix	trans	-72.8	-22.9	179.1	66.9	0	0	0	0	114.3	T260 G261 K267	T260-T263 PolarHBondContact O-N 3.15Å; T260-T263 PolarHBondContact O-OG1 3.38Å; G261-T263 VanDerWaalsContact C-N 3.26Å; G261-T263 PolarHBondContact O-N 3.43Å; T263-K267 WeakPolarHBondContact O-CG 3.41Å; T263-K267 PolarHBondContact O-N 3.37Å; T263-K267 VanDerWaalsContact O-N 3.16Å
264	A	38.9	Very low	52.8	Low	69 Å²	69	94.7 Å²	94.7	57%	0.57	48%	0.484	S	S	*	.	H	α-helix	trans	-77.4	-32.1	178.8	0	0	0	0	0	112	G261 S262	G261-A264 PolarHBondContact O-N 3.36Å; G261-A264 VanDerWaalsContact O-N 3.09Å; S262-A264 VanDerWaalsContact C-N 3.34Å; S262-A264 PolarHBondContact O-N 2.67Å
265	V	41.3	Very low	49.9	Very low	73 Å²	73	102.3 Å²	102.3	44%	0.442	53%	0.525	S	S	.	.	H	α-helix	trans	-76.4	-42.8	174.9	-175.9	0	0	0	0	110.4	G261 K267 R268	G261-V265 PolarHBondContact O-N 2.99Å; V265-K267 PolarHBondContact O-N 3.18Å; V265-R268 PolarHBondContact O-N 2.94Å
266	E	33.7	Very low	47.1	Very low	94 Å²	94	106.9 Å²	106.9	44%	0.439	55%	0.553	S	S	.	*	H	α-helix	trans	-72	-21.7	-179.9	-122.3	172.1	-174.4	0	0	113.9	S262 R268 T269 K295	S262-E266 PolarHBondContact O-N 3.46Å; E266-R268 PolarHBondContact O-N 3.42Å; E266-T269 CarbonylContact O-C 3.16Å; E266-T269 WeakPolarHBondContact O-CA 3.39Å; E266-T269 PolarHBondContact O-N 2.94Å; E266-K295 IonicContact OE1-NZ 3.97Å; E266-K295 PolarHBondContact OE1-NZ 2.79Å; E266-K295 IonicContact OE2-NZ 3.71Å; E266-K295 PolarHBondContact OE2-NZ 3.36Å
267	K	29	Very low	44.5	Very low	190 Å²	190	108.2 Å²	108.2	83%	0.826	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-9.7	173.2	-89.9	-177.2	-178	176.5	0	113.9	T263 V265	T263-K267 WeakPolarHBondContact O-CG 3.41Å; T263-K267 PolarHBondContact O-N 3.37Å; T263-K267 VanDerWaalsContact O-N 3.16Å; V265-K267 PolarHBondContact O-N 3.18Å
268	R	34.5	Very low	42.1	Very low	232 Å²	232	114.1 Å²	114.1	88%	0.875	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.2	-15.1	166.6	-73.9	-176	153.4	179.9	-5.7	113.2	V265 E266	V265-R268 PolarHBondContact O-N 2.94Å; E266-R268 PolarHBondContact O-N 3.42Å
269	T	40.2	Very low	39.5	Very low	83 Å²	83	119.3 Å²	119.3	51%	0.509	62%	0.623	S	S	.	*	S	Bend	trans	-136.4	102.1	-176.1	42.1	0	0	0	0	110.9	E266	E266-T269 CarbonylContact O-C 3.16Å; E266-T269 WeakPolarHBondContact O-CA 3.39Å; E266-T269 PolarHBondContact O-N 2.94Å
270	K	28.9	Very low	37.2	Very low	193 Å²	193	124.7 Å²	124.7	84%	0.839	65%	0.65	S	S	*	*			trans	94.6	91.1	161.3	-53.7	174.9	-177.3	172.9	0	116.2
271	K	25.8	Very low	35.5	Very low	187 Å²	187	125 Å²	125	81%	0.813	66%	0.66	S	S	*	*			trans	-59.8	140.7	146.7	-165	-176.2	-179.7	-176.4	0	108.4
272	D	31.1	Very low	34.3	Very low	139 Å²	139	130.3 Å²	130.3	74%	0.743	69%	0.692	S	S	*	*			trans	73.6	97.5	172.6	-48.5	-37.5	0	0	0	116.3
273	D	31.4	Very low	33.5	Very low	159 Å²	159	134.5 Å²	134.5	85%	0.85	71%	0.711	S	S	*	*				-170	147.7	109.2	-139	-20.2	0	0	0	112.2
274	M	29.4	Very low	32.9	Very low	162 Å²	162	139.2 Å²	139.2	80%	0.798	73%	0.733	S	S	*	*			trans	-93.8	143.2	-175.5	-72.4	-111.7	-84.6	0	0	111
275	N	30.2	Very low	32.8	Very low	164 Å²	164	142.5 Å²	142.5	88%	0.877	74%	0.741	S	S	*	*			trans	53	91.4	166.3	-85.3	-11	0	0	0	116.2
276	T	29.7	Very low	32.6	Very low	138 Å²	138	148.1 Å²	148.1	85%	0.847	76%	0.763	S	S	*	*			trans	-114.3	110.4	160.3	-26.9	0	0	0	0	110
277	D	32.4	Very low	32.6	Very low	137 Å²	137	149.5 Å²	149.5	73%	0.733	77%	0.773	S	S	*	*			trans	-55.3	152	165.7	-168.3	9.4	0	0	0	110.6	T279	D277-T279 VanDerWaalsContact C-N 3.3Å; D277-T279 PolarHBondContact O-N 3.43Å
278	L	36.5	Very low	33.3	Very low	143 Å²	143	145.3 Å²	145.3	75%	0.749	77%	0.774	S	S	*	*	S	Bend	trans	-76.1	75	-167.5	-152.5	83.5	0	0	0	110.6
279	T	30.8	Very low	33.9	Very low	109 Å²	109	141.9 Å²	141.9	67%	0.669	77%	0.773	S	S	*	*			trans	-137.4	109.4	167.3	57	0	0	0	0	110.5	D277 A281	D277-T279 VanDerWaalsContact C-N 3.3Å; D277-T279 PolarHBondContact O-N 3.43Å; T279-A281 PolarHBondContact O-N 3.49Å
280	D	34.7	Very low	34.5	Very low	150 Å²	150	143.8 Å²	143.8	80%	0.802	78%	0.776	S	S	*	*			trans	33.4	86.4	145.5	-154.5	18.3	0	0	0	116.6
281	A	31.6	Very low	36	Very low	82 Å²	82	138.9 Å²	138.9	68%	0.678	76%	0.762	S	S	*	*			trans	-104.2	85.6	167	0	0	0	0	0	109.1	T279 D283	T279-A281 PolarHBondContact O-N 3.49Å; A281-D283 PolarHBondContact O-N 2.89Å
282	T	33.3	Very low	37.9	Very low	119 Å²	119	138 Å²	138	73%	0.73	76%	0.758	S	S	*	*			trans	-64.1	88.7	153.1	44.8	0	0	0	0	108.3
283	D	34.3	Very low	40	Very low	128 Å²	128	132.1 Å²	132.1	68%	0.684	73%	0.727	S	S	*	*			trans	-118	111.8	158.9	-89.7	-29.2	0	0	0	107.8	A281 D285 K292	A281-D283 PolarHBondContact O-N 2.89Å; D283-D285 PolarHBondContact O-N 3.01Å; D283-K292 PolarHBondContact O-NZ 2.8Å
284	D	34.3	Very low	42.1	Very low	173 Å²	173	126.5 Å²	126.5	93%	0.925	70%	0.699	S	S	*	*			trans	-59.2	106.4	166.7	-72.6	-44.4	0	0	0	108.6
285	D	34.8	Very low	44.2	Very low	138 Å²	138	125 Å²	125	74%	0.738	69%	0.688	S	S	*	*			trans	-136.3	120.9	164.1	-144.5	-18.1	0	0	0	108.3	D283 N287	D283-D285 PolarHBondContact O-N 3.01Å; D285-N287 VanDerWaalsContact C-N 3.29Å; D285-N287 PolarHBondContact O-N 2.96Å
286	E	37.6	Very low	46.5	Very low	190 Å²	190	123.4 Å²	123.4	89%	0.888	67%	0.673	S	S	*	*			trans	-74.1	68.9	-167.2	-65.5	-173.8	155	0	0	112.2
287	N	34.4	Very low	49	Very low	123 Å²	123	117.4 Å²	117.4	66%	0.658	64%	0.635	S	S	*	*			trans	-126.4	82.8	160.1	-107.9	-25.9	0	0	0	109.4	D285 N289 E290	D285-N287 VanDerWaalsContact C-N 3.29Å; D285-N287 PolarHBondContact O-N 2.96Å; N287-N289 PolarHBondContact O-N 3.13Å; N287-E290 PolarHBondContact O-N 2.78Å
288	A	43.1	Very low	51.3	Low	103 Å²	103	118 Å²	118	85%	0.851	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.7	7.1	-168	0	0	0	0	0	116.5
289	N	47.3	Very low	53.2	Low	159 Å²	159	115.7 Å²	115.7	85%	0.85	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.7	1.9	-177.5	-71.2	-33.2	0	0	0	114.6	N287	N287-N289 PolarHBondContact O-N 3.13Å
290	E	53.6	Low	55.4	Low	124 Å²	124	112 Å²	112	58%	0.579	60%	0.598	S	S	*	*			trans	-92.4	109.1	175.5	-71.8	-173.1	-179.8	0	0	110.9	N287 K292	N287-E290 PolarHBondContact O-N 2.78Å; E290-K292 PolarHBondContact O-N 2.91Å; E290-K292 VanDerWaalsContact O-N 3.07Å
291	V	60.5	Low	57.7	Low	90 Å²	90	108.1 Å²	108.1	55%	0.545	58%	0.582	S	S	.	*			trans	-68.9	106.1	170	-175	0	0	0	0	108.1	L293 A315	V291-L293 VanDerWaalsContact C-N 3.3Å; V291-L293 HydrophobicContact CG1-CD2 4.19Å; V291-L293 HydrophobicContact CG1-CG 4.06Å; V291-L293 PolarHBondContact O-N 2.96Å; V291-A315 HydrophobicContact CG1-CB 3.85Å
292	K	64.5	Low	59.9	Low	167 Å²	167	109.3 Å²	109.3	73%	0.726	58%	0.577	S	S	*	*			trans	-66.8	85.7	176.2	-67.8	-177.3	-179	178	0	110.1	D283 E290	D283-K292 PolarHBondContact O-NZ 2.8Å; E290-K292 PolarHBondContact O-N 2.91Å; E290-K292 VanDerWaalsContact O-N 3.07Å
293	L	74.5	Confident	62.2	Low	17 Å²	17	109.5 Å²	109.5	9%	0.089	57%	0.573	C	S	.	*			trans	-81.8	145.5	177.1	-73.9	170	0	0	0	111.7	L257 V291 K295 L312 A315	L257-L293 HydrophobicContact CB-CD1 4.37Å; L257-L293 HydrophobicContact CD2-CD1 3.97Å; V291-L293 VanDerWaalsContact C-N 3.3Å; V291-L293 HydrophobicContact CG1-CD2 4.19Å; V291-L293 HydrophobicContact CG1-CG 4.06Å; V291-L293 PolarHBondContact O-N 2.96Å; L293-K295 PolarHBondContact O-N 3.19Å; L293-L312 HydrophobicContact CD1-CD2 4.39Å; L293-L312 HydrophobicContact CD2-CD2 3.99Å; L293-A315 HydrophobicContact CD1-CB 4.13Å; L293-A315 HydrophobicContact CD2-CB 3.81Å; L293-A315 HydrophobicContact CG-CB 4.32Å
294	P	75.8	Confident	64.8	Low	40 Å²	40	108.6 Å²	108.6	26%	0.26	56%	0.563	S	S	.	*			trans	-63.7	129.3	179.6	24.8	-34.3	0	0	0	111.9	K296 R297 L308	P294-K296 VanDerWaalsContact C-N 3.34Å; P294-K296 PolarHBondContact O-N 3.2Å; P294-R297 WeakPolarHBondContact O-CG 3.4Å; P294-R297 PolarHBondContact O-NE 2.76Å; P294-L308 HydrophobicContact CB-CD1 4.31Å; P294-L308 HydrophobicContact CG-CD1 3.27Å
295	K	74.4	Confident	67.4	Low	130 Å²	130	100.7 Å²	100.7	57%	0.565	52%	0.521	S	S	*	.	S	Bend	trans	-68.9	-29.6	179.4	-64.4	-178.1	177.9	-179.1	0	112.6	T259 E266 L293	T259-K295 WeakPolarHBondContact CG2-O 3.37Å; E266-K295 IonicContact OE1-NZ 3.97Å; E266-K295 PolarHBondContact OE1-NZ 2.79Å; E266-K295 IonicContact OE2-NZ 3.71Å; E266-K295 PolarHBondContact OE2-NZ 3.36Å; L293-K295 PolarHBondContact O-N 3.19Å
296	K	78	Confident	70	Confident	132 Å²	132	97.7 Å²	97.7	57%	0.574	51%	0.51	S	S	*	.			trans	-99.1	104.2	176.6	-173.2	-178.5	177.8	-176.6	0	110.3	P294 R298 L300	P294-K296 VanDerWaalsContact C-N 3.34Å; P294-K296 PolarHBondContact O-N 3.2Å; K296-R298 WeakPolarHBondContact CE-O 3.29Å; K296-L300 HydrophobicContact CD-CD2 4.43Å; K296-L300 HydrophobicContact CG-CD2 4.48Å
297	R	81.6	Confident	72.5	Confident	11 Å²	11	93.3 Å²	93.3	4%	0.042	49%	0.493	C	S	.	.			trans	-104.8	0.9	178.9	-54.6	-171.8	-178.2	179	1.6	114.4	L241 D245 L257 T259 P294 L308 L312	L241-R297 WeakPolarHBondContact CD1-O 3.43Å; D245-R297 IonicContact OD1-CZ 2.96Å; D245-R297 IonicContact OD1-NH1 2.93Å; D245-R297 PolarHBondContact OD1-NH1 2.93Å; L257-R297 VanDerWaalsContact O-CZ 3.26Å; L257-R297 PolarHBondContact O-NH1 3.45Å; L257-R297 PolarHBondContact O-NH2 2.89Å; T259-R297 PolarHBondContact OG1-NE 3.3Å; P294-R297 WeakPolarHBondContact O-CG 3.4Å; P294-R297 PolarHBondContact O-NE 2.76Å; R297-L308 HydrophobicContact CB-CD2 4.03Å; R297-L308 HydrophobicContact CG-CD1 4.14Å; R297-L312 VanDerWaalsContact CZ-CD2 3.49Å
298	R	81	Confident	75.2	Confident	151 Å²	151	87.8 Å²	87.8	57%	0.57	46%	0.463	S	S	*	.	S	Bend	trans	-130.9	155.1	-169.5	-67.9	175.6	-70.1	174.4	-3.2	113.4	D238 K296 L300	D238-R298 HydrophobicContact CB-CG 4.35Å; D238-R298 WeakPolarHBondContact OD1-CA 3.48Å; K296-R298 WeakPolarHBondContact CE-O 3.29Å; R298-L300 VanDerWaalsContact C-N 3.27Å; R298-L300 PolarHBondContact O-N 2.85Å
299	C	77.7	Confident	77.5	Confident	93 Å²	93	86.5 Å²	86.5	63%	0.628	44%	0.442	S	S	*	.	S	Bend	trans	50.9	50.3	178.4	-57.7	0	0	0	0	111.1	D238 Y305	D238-C299 PolarHBondContact OD1-N 3.22Å; D238-C299 PolarHBondContact OD2-N 3.02Å; D238-C299 PolarHBondContact OD2-SG 2.98Å; D238-C299 VanDerWaalsContact OD2-SG 3.34Å; C299-Y305 PolarHBondContact N-OH 3.46Å
300	L	76.5	Confident	79.6	Confident	33 Å²	33	85 Å²	85	17%	0.173	43%	0.43	C	S	.	.			trans	-91.1	162.9	178.9	-69.1	158.4	0	0	0	110.5	K296 R298 K304 Y305 L308	K296-L300 HydrophobicContact CD-CD2 4.43Å; K296-L300 HydrophobicContact CG-CD2 4.48Å; R298-L300 VanDerWaalsContact C-N 3.27Å; R298-L300 PolarHBondContact O-N 2.85Å; L300-K304 HydrophobicContact CB-CB 4.14Å; L300-K304 HydrophobicContact CD2-CB 4.25Å; L300-K304 HydrophobicContact CD2-CD 4.32Å; L300-Y305 HydrophobicContact CB-CD1 4.24Å; L300-Y305 HydrophobicContact CB-CD2 4.2Å; L300-Y305 HydrophobicContact CB-CE1 3.94Å; L300-Y305 HydrophobicContact CB-CE2 3.91Å; L300-Y305 HydrophobicContact CB-CG 4.36Å; L300-Y305 HydrophobicContact CD1-CD1 4.1Å; L300-Y305 HydrophobicContact CD1-CE1 4.05Å; L300-Y305 HydrophobicContact CG-CE1 4.45Å; L300-Y305 PolarHBondContact N-OH 2.87Å; L300-Y305 VanDerWaalsContact N-OH 3.09Å; L300-Y305 VanDerWaalsContact O-CE2 3.26Å; L300-Y305 WeakPolarHBondContact O-CE2 3.41Å; L300-L308 HydrophobicContact CD1-CB 4.48Å; L300-L308 HydrophobicContact CD1-CD2 3.45Å; L300-L308 VanDerWaalsContact CD1-CD2 3.45Å
301	S	82.4	Confident	81.4	Confident	68 Å²	68	84 Å²	84	48%	0.476	43%	0.425	S	S	.	.			trans	-66.3	153.6	164.7	-169.9	0	0	0	0	109.4	D303 K304 Y305	S301-D303 VanDerWaalsContact C-N 3.31Å; S301-D303 PolarHBondContact O-N 2.9Å; S301-K304 WeakPolarHBondContact O-CB 3.44Å; S301-K304 PolarHBondContact O-N 2.59Å; S301-Y305 WeakPolarHBondContact O-CD2 3.43Å; S301-Y305 PolarHBondContact O-N 2.76Å
302	L	77.8	Confident	82.9	Confident	106 Å²	106	80 Å²	80	56%	0.555	40%	0.4	S	S	*	.	H	α-helix	trans	-52.2	-48.4	-176.5	-174.2	63.1	0	0	0	112.3	K304 Y305	L302-K304 VanDerWaalsContact C-N 3.26Å; L302-K304 PolarHBondContact O-N 2.99Å; L302-Y305 PolarHBondContact O-N 3.35Å
303	D	82.8	Confident	84.2	Confident	124 Å²	124	76.8 Å²	76.8	66%	0.663	39%	0.388	S	S	*	.	H	α-helix	trans	-63	-33.6	-178.3	-51	-46.8	0	0	0	112.5	S301 Y305 S306	S301-D303 VanDerWaalsContact C-N 3.31Å; S301-D303 PolarHBondContact O-N 2.9Å; D303-Y305 VanDerWaalsContact C-N 3.28Å; D303-Y305 PolarHBondContact O-N 3.02Å; D303-S306 PolarHBondContact O-N 2.92Å
304	K	87.6	Confident	85.2	Confident	108 Å²	108	79.5 Å²	79.5	47%	0.47	41%	0.408	S	S	.	.	H	α-helix	trans	-73.2	-19.3	-178.2	-64.6	-172.4	178.3	-168.4	0	113.2	L300 S301 L302 S306 L308	L300-K304 HydrophobicContact CB-CB 4.14Å; L300-K304 HydrophobicContact CD2-CB 4.25Å; L300-K304 HydrophobicContact CD2-CD 4.32Å; S301-K304 WeakPolarHBondContact O-CB 3.44Å; S301-K304 PolarHBondContact O-N 2.59Å; L302-K304 VanDerWaalsContact C-N 3.26Å; L302-K304 PolarHBondContact O-N 2.99Å; K304-S306 VanDerWaalsContact C-N 3.33Å; K304-L308 WeakPolarHBondContact O-CB 3.24Å; K304-L308 PolarHBondContact O-N 2.7Å
305	Y	89.4	Confident	86	Confident	8 Å²	8	78.2 Å²	78.2	3%	0.031	40%	0.401	C	S	.	.	H	α-helix	trans	-69	-34.4	174.4	-75.3	-71.1	0	0	0	111.7	L237 D238 L241 C299 L300 S301 L302 D303 L308 L309	L237-Y305 HydrophobicContact CD2-CD1 3.36Å; L237-Y305 HydrophobicContact CD2-CD2 3.96Å; L237-Y305 HydrophobicContact CD2-CE1 3.74Å; L237-Y305 HydrophobicContact CD2-CE2 4.29Å; L237-Y305 HydrophobicContact CD2-CG 3.49Å; L237-Y305 VanDerWaalsContact CD2-CG 3.49Å; L237-Y305 HydrophobicContact CG-CD1 4.03Å; L237-Y305 HydrophobicContact CG-CE1 4.09Å; D238-Y305 PolarHBondContact OD1-OH 2.94Å; L241-Y305 HydrophobicContact CD1-CD1 4.09Å; L241-Y305 HydrophobicContact CD1-CE1 4.01Å; C299-Y305 PolarHBondContact N-OH 3.46Å; L300-Y305 HydrophobicContact CB-CD1 4.24Å; L300-Y305 HydrophobicContact CB-CD2 4.2Å; L300-Y305 HydrophobicContact CB-CE1 3.94Å; L300-Y305 HydrophobicContact CB-CE2 3.91Å; L300-Y305 HydrophobicContact CB-CG 4.36Å; L300-Y305 HydrophobicContact CD1-CD1 4.1Å; L300-Y305 HydrophobicContact CD1-CE1 4.05Å; L300-Y305 HydrophobicContact CG-CE1 4.45Å; L300-Y305 PolarHBondContact N-OH 2.87Å; L300-Y305 VanDerWaalsContact N-OH 3.09Å; L300-Y305 VanDerWaalsContact O-CE2 3.26Å; L300-Y305 WeakPolarHBondContact O-CE2 3.41Å; S301-Y305 WeakPolarHBondContact O-CD2 3.43Å; S301-Y305 PolarHBondContact O-N 2.76Å; L302-Y305 PolarHBondContact O-N 3.35Å; D303-Y305 VanDerWaalsContact C-N 3.28Å; D303-Y305 PolarHBondContact O-N 3.02Å; Y305-L308 PolarHBondContact O-N 3.28Å; Y305-L309 WeakPolarHBondContact O-CB 3.41Å; Y305-L309 WeakPolarHBondContact O-CG 3.1Å; Y305-L309 PolarHBondContact O-N 3.24Å
306	S	89.5	Confident	86.9	Confident	75 Å²	75	74.7 Å²	74.7	52%	0.524	39%	0.386	S	S	.	.	H	α-helix	trans	-61.4	-53.9	179.4	-170.7	0	0	0	0	110.7	D303 K304 L308 L309 E310	D303-S306 PolarHBondContact O-N 2.92Å; K304-S306 VanDerWaalsContact C-N 3.33Å; S306-L308 VanDerWaalsContact C-N 3.3Å; S306-L308 PolarHBondContact O-N 3.4Å; S306-L309 PolarHBondContact O-N 3.42Å; S306-E310 PolarHBondContact O-N 2.93Å
307	D	89.9	Confident	87.7	Confident	97 Å²	97	70.2 Å²	70.2	52%	0.519	37%	0.369	S	S	.	.	H	α-helix	trans	-61.7	-39.8	-180	-57.3	-22.9	0	0	0	111.6	E310 Q311	D307-E310 PolarHBondContact O-N 3.28Å; D307-Q311 VanDerWaalsContact O-CG 3.31Å; D307-Q311 WeakPolarHBondContact O-CG 3.15Å; D307-Q311 PolarHBondContact O-N 3.47Å
308	L	90.3	Very high	88.3	Confident	8 Å²	8	73.6 Å²	73.6	4%	0.042	39%	0.393	C	S	.	.	H	α-helix	trans	-60.4	-49.8	176	173.3	67.6	0	0	0	111.6	L241 P294 R297 L300 K304 Y305 S306 E310 Q311 L312	L241-L308 HydrophobicContact CD1-CD2 4.02Å; P294-L308 HydrophobicContact CB-CD1 4.31Å; P294-L308 HydrophobicContact CG-CD1 3.27Å; R297-L308 HydrophobicContact CB-CD2 4.03Å; R297-L308 HydrophobicContact CG-CD1 4.14Å; L300-L308 HydrophobicContact CD1-CB 4.48Å; L300-L308 HydrophobicContact CD1-CD2 3.45Å; L300-L308 VanDerWaalsContact CD1-CD2 3.45Å; K304-L308 WeakPolarHBondContact O-CB 3.24Å; K304-L308 PolarHBondContact O-N 2.7Å; Y305-L308 PolarHBondContact O-N 3.28Å; S306-L308 VanDerWaalsContact C-N 3.3Å; S306-L308 PolarHBondContact O-N 3.4Å; L308-E310 VanDerWaalsContact C-N 3.3Å; L308-E310 PolarHBondContact O-N 3.38Å; L308-Q311 PolarHBondContact O-N 3.49Å; L308-L312 HydrophobicContact CD1-CD1 3.95Å; L308-L312 HydrophobicContact CD1-CG 4.09Å; L308-L312 HydrophobicContact CD2-CD1 4.45Å; L308-L312 HydrophobicContact CG-CD1 3.89Å; L308-L312 HydrophobicContact CG-CG 4.39Å; L308-L312 VanDerWaalsContact O-CG 3.31Å; L308-L312 WeakPolarHBondContact O-CG 3.35Å; L308-L312 PolarHBondContact O-N 3.04Å
309	L	91.4	Very high	89	Confident	76 Å²	76	69.2 Å²	69.2	40%	0.398	38%	0.377	S	S	.	.	H	α-helix	trans	-64.9	-37	-177.6	-72.8	171.1	0	0	0	111.4	L241 Y305 S306 H313	L241-L309 HydrophobicContact CD2-CD2 3.94Å; Y305-L309 WeakPolarHBondContact O-CB 3.41Å; Y305-L309 WeakPolarHBondContact O-CG 3.1Å; Y305-L309 PolarHBondContact O-N 3.24Å; S306-L309 PolarHBondContact O-N 3.42Å; L309-H313 VanDerWaalsContact O-CB 3.24Å; L309-H313 WeakPolarHBondContact O-CB 3.33Å; L309-H313 PolarHBondContact O-N 2.93Å
310	E	91.6	Very high	89.8	Confident	128 Å²	128	68.7 Å²	68.7	60%	0.598	36%	0.361	S	S	*	.	H	α-helix	trans	-64.3	-46.9	174.8	-172.5	168.2	-169.7	0	0	111.3	S306 D307 L308 L312 H313 S314	S306-E310 PolarHBondContact O-N 2.93Å; D307-E310 PolarHBondContact O-N 3.28Å; L308-E310 VanDerWaalsContact C-N 3.3Å; L308-E310 PolarHBondContact O-N 3.38Å; E310-L312 PolarHBondContact O-N 3.29Å; E310-H313 PolarHBondContact O-N 2.71Å; E310-S314 WeakPolarHBondContact O-CB 3.21Å; E310-S314 PolarHBondContact O-N 3.46Å; E310-S314 PolarHBondContact O-OG 3.31Å; E310-S314 VanDerWaalsContact O-OG 3.13Å
311	Q	91.8	Very high	90.6	Very high	101 Å²	101	69.2 Å²	69.2	47%	0.472	36%	0.364	S	S	.	.	H	α-helix	trans	-60.6	-45	176.2	-73	177.9	-4.8	0	0	112.8	D307 L308 S314 A315	D307-Q311 VanDerWaalsContact O-CG 3.31Å; D307-Q311 WeakPolarHBondContact O-CG 3.15Å; D307-Q311 PolarHBondContact O-N 3.47Å; L308-Q311 PolarHBondContact O-N 3.49Å; Q311-S314 PolarHBondContact O-N 3.35Å; Q311-A315 WeakPolarHBondContact O-CB 3.38Å; Q311-A315 PolarHBondContact O-N 3.36Å
312	L	91.4	Very high	91.2	Very high	6 Å²	6	72.3 Å²	72.3	3%	0.031	37%	0.371	C	S	.	.	H	α-helix	trans	-63.5	-44.4	177.4	-70.5	173.9	0	0	0	111.3	L241 L293 R297 L308 E310 A315 F316	L241-L312 HydrophobicContact CD2-CD1 3.91Å; L293-L312 HydrophobicContact CD1-CD2 4.39Å; L293-L312 HydrophobicContact CD2-CD2 3.99Å; R297-L312 VanDerWaalsContact CZ-CD2 3.49Å; L308-L312 HydrophobicContact CD1-CD1 3.95Å; L308-L312 HydrophobicContact CD1-CG 4.09Å; L308-L312 HydrophobicContact CD2-CD1 4.45Å; L308-L312 HydrophobicContact CG-CD1 3.89Å; L308-L312 HydrophobicContact CG-CG 4.39Å; L308-L312 VanDerWaalsContact O-CG 3.31Å; L308-L312 WeakPolarHBondContact O-CG 3.35Å; L308-L312 PolarHBondContact O-N 3.04Å; E310-L312 PolarHBondContact O-N 3.29Å; L312-A315 PolarHBondContact O-N 3.03Å; L312-F316 WeakPolarHBondContact O-CB 3.21Å; L312-F316 PolarHBondContact O-N 3.46Å
313	H	93	Very high	91.9	Very high	101 Å²	101	68.4 Å²	68.4	47%	0.468	35%	0.353	S	S	.	.	H	α-helix	trans	-60.2	-50.2	177.1	-175.2	73	0	0	0	111.3	L309 E310 A315 F316 V317 R320	L309-H313 VanDerWaalsContact O-CB 3.24Å; L309-H313 WeakPolarHBondContact O-CB 3.33Å; L309-H313 PolarHBondContact O-N 2.93Å; E310-H313 PolarHBondContact O-N 2.71Å; H313-A315 VanDerWaalsContact C-N 3.27Å; H313-A315 PolarHBondContact O-N 2.95Å; H313-F316 PolarHBondContact O-N 2.83Å; H313-V317 VanDerWaalsContact O-CG2 3.3Å; H313-V317 WeakPolarHBondContact O-CG2 3.45Å; H313-V317 PolarHBondContact O-N 3.02Å; H313-R320 PolarHBondContact CE1-NH1 3.49Å
314	S	94.3	Very high	92.4	Very high	73 Å²	73	65.7 Å²	65.7	51%	0.51	34%	0.338	S	S	.	.	H	α-helix	trans	-58.2	-38.6	178.6	-66.9	0	0	0	0	112.6	E310 Q311	E310-S314 WeakPolarHBondContact O-CB 3.21Å; E310-S314 PolarHBondContact O-N 3.46Å; E310-S314 PolarHBondContact O-OG 3.31Å; E310-S314 VanDerWaalsContact O-OG 3.13Å; Q311-S314 PolarHBondContact O-N 3.35Å
315	A	93	Very high	92.6	Very high	13 Å²	13	63.8 Å²	63.8	11%	0.107	33%	0.331	C	S	.	.	H	α-helix	trans	-70.1	-30.7	176.2	0	0	0	0	0	113.3	L257 V291 L293 Q311 L312 H313 P318	L257-A315 HydrophobicContact CD2-CB 3.78Å; V291-A315 HydrophobicContact CG1-CB 3.85Å; L293-A315 HydrophobicContact CD1-CB 4.13Å; L293-A315 HydrophobicContact CD2-CB 3.81Å; L293-A315 HydrophobicContact CG-CB 4.32Å; Q311-A315 WeakPolarHBondContact O-CB 3.38Å; Q311-A315 PolarHBondContact O-N 3.36Å; L312-A315 PolarHBondContact O-N 3.03Å; H313-A315 VanDerWaalsContact C-N 3.27Å; H313-A315 PolarHBondContact O-N 2.95Å; A315-P318 WeakPolarHBondContact O-CD 3.36Å
316	F	94.4	Very high	92.7	Very high	56 Å²	56	68.3 Å²	68.3	25%	0.246	35%	0.352	C	S	.	.	H	α-helix	trans	-82.5	-24.5	-179.6	-179.5	-113	0	0	0	113.9	F248 L257 L312 H313 Y319 R320	F248-F316 AromaticContact CE1-CD2 3.6Å; F248-F316 HydrophobicContact CE1-CD2 3.6Å; F248-F316 AromaticContact CE1-CE2 3.57Å; F248-F316 HydrophobicContact CE1-CE2 3.57Å; F248-F316 AromaticContact CZ-CD2 3.61Å; F248-F316 HydrophobicContact CZ-CD2 3.61Å; F248-F316 AromaticContact CZ-CE2 3.97Å; F248-F316 HydrophobicContact CZ-CE2 3.97Å; F248-F316 HydrophobicContact CZ-CG 4.25Å; L257-F316 HydrophobicContact CD1-CB 4.33Å; L257-F316 HydrophobicContact CD1-CD2 3.85Å; L312-F316 WeakPolarHBondContact O-CB 3.21Å; L312-F316 PolarHBondContact O-N 3.46Å; H313-F316 PolarHBondContact O-N 2.83Å; F316-Y319 AromaticContact CD2-CD1 3.99Å; F316-Y319 HydrophobicContact CD2-CD1 3.99Å; F316-Y319 AromaticContact CE2-CD1 3.37Å; F316-Y319 HydrophobicContact CE2-CD1 3.37Å; F316-Y319 AromaticContact CE2-CE1 3.82Å; F316-Y319 HydrophobicContact CE2-CE1 3.82Å; F316-Y319 HydrophobicContact CE2-CG 4.47Å; F316-Y319 HydrophobicContact CZ-CD1 4.05Å; F316-Y319 HydrophobicContact CZ-CE1 4.35Å; F316-Y319 PolarHBondContact O-N 3.26Å; F316-R320 HydrophobicContact CD1-CB 4.06Å; F316-R320 HydrophobicContact CE1-CB 3.75Å; F316-R320 HydrophobicContact CE1-CG 4.08Å; F316-R320 HydrophobicContact CZ-CB 4.15Å; F316-R320 PolarHBondContact O-N 3.02Å
317	V	94.4	Very high	92.8	Very high	38 Å²	38	71.9 Å²	71.9	23%	0.23	35%	0.354	C	S	.	.	H	α-helix	trans	-51	-46.3	-177	162.6	0	0	0	0	114.1	H313 R320 N321	H313-V317 VanDerWaalsContact O-CG2 3.3Å; H313-V317 WeakPolarHBondContact O-CG2 3.45Å; H313-V317 PolarHBondContact O-N 3.02Å; V317-R320 PolarHBondContact O-N 3.01Å; V317-N321 WeakPolarHBondContact O-CB 3.38Å; V317-N321 PolarHBondContact O-N 2.68Å; V317-N321 PolarHBondContact O-OD1 2.87Å
318	P	94.5	Very high	92.6	Very high	82 Å²	82	70.1 Å²	70.1	53%	0.532	34%	0.34	S	S	.	.	H	α-helix	trans	-60.2	-50.7	-179.4	-24.7	35.2	0	0	0	112.6	A315 R320 N321 E322	A315-P318 WeakPolarHBondContact O-CD 3.36Å; P318-R320 PolarHBondContact O-N 3.22Å; P318-N321 PolarHBondContact O-N 3.27Å; P318-E322 PolarHBondContact O-N 3.09Å
319	Y	94.4	Very high	92.5	Very high	60 Å²	60	74 Å²	74	24%	0.235	36%	0.358	C	S	.	.	H	α-helix	trans	-60.7	-44.4	177.9	170.1	-94.4	0	0	0	111.9	D251 E253 T254 F316 N321 E322 S323	D251-Y319 PolarHBondContact OD2-OH 2.92Å; E253-Y319 HydrophobicContact CB-CD2 4.06Å; E253-Y319 HydrophobicContact CB-CE2 3.63Å; E253-Y319 WeakPolarHBondContact OE2-CE2 3.49Å; T254-Y319 HydrophobicContact CG2-CD1 3.47Å; T254-Y319 VanDerWaalsContact CG2-CD1 3.47Å; T254-Y319 HydrophobicContact CG2-CD2 3.57Å; T254-Y319 HydrophobicContact CG2-CE1 3.39Å; T254-Y319 HydrophobicContact CG2-CE2 3.5Å; T254-Y319 VanDerWaalsContact CG2-CE2 3.5Å; T254-Y319 HydrophobicContact CG2-CG 3.53Å; F316-Y319 AromaticContact CD2-CD1 3.99Å; F316-Y319 HydrophobicContact CD2-CD1 3.99Å; F316-Y319 AromaticContact CE2-CD1 3.37Å; F316-Y319 HydrophobicContact CE2-CD1 3.37Å; F316-Y319 AromaticContact CE2-CE1 3.82Å; F316-Y319 HydrophobicContact CE2-CE1 3.82Å; F316-Y319 HydrophobicContact CE2-CG 4.47Å; F316-Y319 HydrophobicContact CZ-CD1 4.05Å; F316-Y319 HydrophobicContact CZ-CE1 4.35Å; F316-Y319 PolarHBondContact O-N 3.26Å; Y319-N321 VanDerWaalsContact C-N 3.29Å; Y319-N321 PolarHBondContact O-N 2.87Å; Y319-E322 PolarHBondContact O-N 3.37Å; Y319-S323 VanDerWaalsContact O-CB 3.27Å; Y319-S323 WeakPolarHBondContact O-CB 3.37Å; Y319-S323 PolarHBondContact O-N 3.39Å; Y319-S323 PolarHBondContact O-OG 2.79Å
320	R	94.4	Very high	92.3	Very high	81 Å²	81	75.5 Å²	75.5	31%	0.306	36%	0.362	S	S	.	.	H	α-helix	trans	-56.2	-46.8	176	-178.9	-160.2	66.8	-159.9	-1.4	110.8	H313 F316 V317 P318 L324	H313-R320 PolarHBondContact CE1-NH1 3.49Å; F316-R320 HydrophobicContact CD1-CB 4.06Å; F316-R320 HydrophobicContact CE1-CB 3.75Å; F316-R320 HydrophobicContact CE1-CG 4.08Å; F316-R320 HydrophobicContact CZ-CB 4.15Å; F316-R320 PolarHBondContact O-N 3.02Å; V317-R320 PolarHBondContact O-N 3.01Å; P318-R320 PolarHBondContact O-N 3.22Å; R320-L324 HydrophobicContact CG-CD1 3.93Å; R320-L324 HydrophobicContact CG-CG 4.41Å; R320-L324 WeakPolarHBondContact O-CB 3.46Å; R320-L324 WeakPolarHBondContact O-CG 3.5Å; R320-L324 PolarHBondContact O-N 3.22Å
321	N	95.1	Very high	91.9	Very high	44 Å²	44	72.9 Å²	72.9	24%	0.235	36%	0.355	C	S	.	.	H	α-helix	trans	-66.6	-46.1	-176.4	-72.2	-0.7	0	0	0	111.6	V317 P318 Y319 L324 E325 L351	V317-N321 WeakPolarHBondContact O-CB 3.38Å; V317-N321 PolarHBondContact O-N 2.68Å; V317-N321 PolarHBondContact O-OD1 2.87Å; P318-N321 PolarHBondContact O-N 3.27Å; Y319-N321 VanDerWaalsContact C-N 3.29Å; Y319-N321 PolarHBondContact O-N 2.87Å; N321-L324 PolarHBondContact O-N 2.87Å; N321-E325 WeakPolarHBondContact O-CB 3.36Å; N321-E325 PolarHBondContact O-N 3.49Å; N321-L351 HydrophobicContact CB-CD1 3.92Å; N321-L351 HydrophobicContact CB-CD2 4.05Å
322	E	94	Very high	91.3	Very high	134 Å²	134	72.8 Å²	72.8	63%	0.626	35%	0.35	S	S	*	.	H	α-helix	trans	-60	-46.3	176	-178.6	175.7	-175.1	0	0	111.5	P318 Y319 L324 E325 H326	P318-E322 PolarHBondContact O-N 3.09Å; Y319-E322 PolarHBondContact O-N 3.37Å; E322-L324 PolarHBondContact O-N 3.36Å; E322-E325 PolarHBondContact O-N 3.36Å; E322-H326 WeakPolarHBondContact O-CB 3.5Å; E322-H326 PolarHBondContact O-N 3.38Å
323	S	93	Very high	90.7	Very high	24 Å²	24	78.4 Å²	78.4	17%	0.168	38%	0.378	C	S	.	.	H	α-helix	trans	-62	-44.5	177.5	-67.3	0	0	0	0	112.3	Y319 H326 W327	Y319-S323 VanDerWaalsContact O-CB 3.27Å; Y319-S323 WeakPolarHBondContact O-CB 3.37Å; Y319-S323 PolarHBondContact O-N 3.39Å; Y319-S323 PolarHBondContact O-OG 2.79Å; S323-H326 PolarHBondContact O-N 2.84Å; S323-W327 PolarHBondContact O-N 3.31Å
324	L	93	Very high	90	Very high	66 Å²	66	78.1 Å²	78.1	35%	0.346	38%	0.383	S	S	.	.	H	α-helix	trans	-63.1	-43.9	178.7	-77.3	174	0	0	0	111.6	R320 N321 E322 Y328 I350 L351 I354	R320-L324 HydrophobicContact CG-CD1 3.93Å; R320-L324 HydrophobicContact CG-CG 4.41Å; R320-L324 WeakPolarHBondContact O-CB 3.46Å; R320-L324 WeakPolarHBondContact O-CG 3.5Å; R320-L324 PolarHBondContact O-N 3.22Å; N321-L324 PolarHBondContact O-N 2.87Å; E322-L324 PolarHBondContact O-N 3.36Å; L324-Y328 WeakPolarHBondContact O-CB 3.38Å; L324-Y328 PolarHBondContact O-N 2.7Å; L324-I350 HydrophobicContact CB-CG2 4.32Å; L324-L351 HydrophobicContact CB-CD2 4.48Å; L324-L351 HydrophobicContact CD1-CD2 4.36Å; L324-I354 HydrophobicContact CD1-CD1 4.03Å
325	E	91.7	Very high	88.7	Confident	68 Å²	68	79.1 Å²	79.1	32%	0.318	38%	0.382	S	S	.	.	H	α-helix	trans	-62.8	-47.8	177.4	-173.3	163	-140	0	0	111	N321 E322 W327 Y328 E329 N349	N321-E325 WeakPolarHBondContact O-CB 3.36Å; N321-E325 PolarHBondContact O-N 3.49Å; E322-E325 PolarHBondContact O-N 3.36Å; E325-W327 PolarHBondContact O-N 3.32Å; E325-Y328 PolarHBondContact O-N 3.22Å; E325-E329 WeakPolarHBondContact O-CB 3.41Å; E325-E329 WeakPolarHBondContact O-CG 3.48Å; E325-E329 PolarHBondContact O-N 2.94Å; E325-N349 PolarHBondContact OE1-ND2 3.47Å
326	H	91.5	Very high	87.5	Confident	103 Å²	103	83.7 Å²	83.7	48%	0.477	40%	0.404	S	S	.	.	H	α-helix	trans	-55.7	-51.3	177.7	-179	77.5	0	0	0	112.7	E322 S323 K330	E322-H326 WeakPolarHBondContact O-CB 3.5Å; E322-H326 PolarHBondContact O-N 3.38Å; S323-H326 PolarHBondContact O-N 2.84Å; H326-K330 VanDerWaalsContact O-CB 3.31Å; H326-K330 WeakPolarHBondContact O-CB 3.44Å; H326-K330 PolarHBondContact O-N 3.24Å
327	W	90.8	Very high	85.9	Confident	151 Å²	151	89.6 Å²	89.6	57%	0.572	43%	0.43	S	S	*	.	H	α-helix	trans	-73.3	-31.9	-177.6	-74.2	111.1	0	0	0	113.1	S323 E325 K330 T331	S323-W327 PolarHBondContact O-N 3.31Å; E325-W327 PolarHBondContact O-N 3.32Å; W327-K330 HydrophobicContact CE3-CD 3.99Å; W327-K330 HydrophobicContact CZ3-CD 3.8Å; W327-T331 WeakPolarHBondContact O-CB 3.48Å; W327-T331 PolarHBondContact O-N 3.46Å; W327-T331 PolarHBondContact O-OG1 3.13Å
328	Y	87.6	Confident	84.2	Confident	59 Å²	59	92.3 Å²	92.3	23%	0.231	45%	0.45	C	S	.	.	H	α-helix	trans	-64.9	-48.7	173.8	-178.4	-105.8	0	0	0	111.2	L324 E325 K330 T331 R332 F348 I350	L324-Y328 WeakPolarHBondContact O-CB 3.38Å; L324-Y328 PolarHBondContact O-N 2.7Å; E325-Y328 PolarHBondContact O-N 3.22Å; Y328-K330 PolarHBondContact O-N 3.3Å; Y328-T331 PolarHBondContact O-N 3.37Å; Y328-R332 VanDerWaalsContact O-CB 3.24Å; Y328-R332 WeakPolarHBondContact O-CB 3.4Å; Y328-R332 PolarHBondContact O-N 3.02Å; Y328-F348 PolarHBondContact OH-O 3.47Å; Y328-I350 HydrophobicContact CD1-CB 3.87Å; Y328-I350 HydrophobicContact CD1-CG2 4.15Å; Y328-I350 HydrophobicContact CD2-CB 3.82Å; Y328-I350 HydrophobicContact CD2-CD1 4.08Å; Y328-I350 HydrophobicContact CD2-CG1 4.13Å; Y328-I350 HydrophobicContact CE1-CB 4.24Å; Y328-I350 HydrophobicContact CE2-CB 4.21Å; Y328-I350 HydrophobicContact CE2-CD1 4.17Å; Y328-I350 HydrophobicContact CG-CB 3.62Å; Y328-I350 HydrophobicContact CG-CG1 4.33Å; Y328-I350 HydrophobicContact CG-CG2 3.96Å
329	E	87	Confident	82.3	Confident	89 Å²	89	91.4 Å²	91.4	42%	0.416	45%	0.446	S	S	.	.	H	α-helix	trans	-61	-45.6	176.8	-71.1	-173.7	160.9	0	0	111.6	E325 T331 R332 M333	E325-E329 WeakPolarHBondContact O-CB 3.41Å; E325-E329 WeakPolarHBondContact O-CG 3.48Å; E325-E329 PolarHBondContact O-N 2.94Å; E329-T331 PolarHBondContact O-N 3.01Å; E329-R332 PolarHBondContact O-N 2.7Å; E329-M333 VanDerWaalsContact O-CG 3.24Å; E329-M333 WeakPolarHBondContact O-CG 3.36Å; E329-M333 PolarHBondContact O-N 3.34Å
330	K	86.6	Confident	80.4	Confident	108 Å²	108	97.5 Å²	97.5	47%	0.47	48%	0.476	S	S	.	.	H	α-helix	trans	-60.8	-45.9	179.3	-170.3	171.2	-176.1	172.8	0	112.6	H326 W327 Y328 R332 M333 V334	H326-K330 VanDerWaalsContact O-CB 3.31Å; H326-K330 WeakPolarHBondContact O-CB 3.44Å; H326-K330 PolarHBondContact O-N 3.24Å; W327-K330 HydrophobicContact CE3-CD 3.99Å; W327-K330 HydrophobicContact CZ3-CD 3.8Å; Y328-K330 PolarHBondContact O-N 3.3Å; K330-R332 VanDerWaalsContact C-N 3.35Å; K330-M333 PolarHBondContact O-N 2.95Å; K330-V334 WeakPolarHBondContact O-CG2 3.26Å; K330-V334 PolarHBondContact O-N 2.8Å
331	T	84.2	Confident	78.7	Confident	74 Å²	74	101.4 Å²	101.4	45%	0.454	50%	0.495	S	S	.	.	H	α-helix	trans	-68.4	-37.2	179.1	-51.1	0	0	0	0	111.2	W327 Y328 E329 V334 N335	W327-T331 WeakPolarHBondContact O-CB 3.48Å; W327-T331 PolarHBondContact O-N 3.46Å; W327-T331 PolarHBondContact O-OG1 3.13Å; Y328-T331 PolarHBondContact O-N 3.37Å; E329-T331 PolarHBondContact O-N 3.01Å; T331-V334 PolarHBondContact O-N 3.05Å; T331-N335 PolarHBondContact O-N 2.99Å
332	R	79.7	Confident	76.6	Confident	98 Å²	98	106.4 Å²	106.4	37%	0.37	52%	0.522	S	S	.	.	H	α-helix	trans	-61	-46.7	174	-173.3	-179.7	67.4	-172.1	-3.7	111.6	Y328 E329 K330 V334 N335 I336	Y328-R332 VanDerWaalsContact O-CB 3.24Å; Y328-R332 WeakPolarHBondContact O-CB 3.4Å; Y328-R332 PolarHBondContact O-N 3.02Å; E329-R332 PolarHBondContact O-N 2.7Å; K330-R332 VanDerWaalsContact C-N 3.35Å; R332-V334 VanDerWaalsContact C-N 3.25Å; R332-V334 PolarHBondContact O-N 2.85Å; R332-N335 PolarHBondContact O-N 2.9Å; R332-I336 HydrophobicContact CG-CD1 4.16Å; R332-I336 HydrophobicContact CG-CG1 4.45Å; R332-I336 VanDerWaalsContact O-CG1 3.26Å; R332-I336 WeakPolarHBondContact O-CG1 3.41Å; R332-I336 PolarHBondContact O-N 3.08Å
333	M	78.8	Confident	74.8	Confident	125 Å²	125	108.2 Å²	108.2	62%	0.616	53%	0.528	S	S	*	.	H	α-helix	trans	-62.8	-31.1	179.7	-66.9	-60.9	-74.9	0	0	113.1	E329 K330 I336	E329-M333 VanDerWaalsContact O-CG 3.24Å; E329-M333 WeakPolarHBondContact O-CG 3.36Å; E329-M333 PolarHBondContact O-N 3.34Å; K330-M333 PolarHBondContact O-N 2.95Å; M333-I336 HydrophobicContact SD-CD1 4.21Å
334	V	77.2	Confident	73.1	Confident	94 Å²	94	110.5 Å²	110.5	57%	0.57	54%	0.544	S	S	*	.	H	α-helix	trans	-72.2	-44.8	173.9	174.7	0	0	0	0	110.9	K330 T331 R332 I336	K330-V334 WeakPolarHBondContact O-CG2 3.26Å; K330-V334 PolarHBondContact O-N 2.8Å; T331-V334 PolarHBondContact O-N 3.05Å; R332-V334 VanDerWaalsContact C-N 3.25Å; R332-V334 PolarHBondContact O-N 2.85Å; V334-I336 PolarHBondContact O-N 3.42Å
335	N	68.4	Low	71.3	Confident	94 Å²	94	110.3 Å²	110.3	50%	0.503	56%	0.558	S	S	.	*	H	α-helix	trans	-76.5	-21.1	-174.2	-70.6	-2.4	0	0	0	114.7	T331 R332 K337 S338	T331-N335 PolarHBondContact O-N 2.99Å; R332-N335 PolarHBondContact O-N 2.9Å; N335-K337 PolarHBondContact O-N 3.27Å; N335-K337 VanDerWaalsContact O-N 3.16Å; N335-S338 PolarHBondContact O-N 3.36Å; N335-S338 VanDerWaalsContact O-N 3.13Å
336	I	66.1	Low	69.7	Low	109 Å²	109	113.1 Å²	113.1	56%	0.559	57%	0.57	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57	-30.9	178.5	-76	163.4	0	0	0	111.9	R332 M333 V334	R332-I336 HydrophobicContact CG-CD1 4.16Å; R332-I336 HydrophobicContact CG-CG1 4.45Å; R332-I336 VanDerWaalsContact O-CG1 3.26Å; R332-I336 WeakPolarHBondContact O-CG1 3.41Å; R332-I336 PolarHBondContact O-N 3.08Å; M333-I336 HydrophobicContact SD-CD1 4.21Å; V334-I336 PolarHBondContact O-N 3.42Å
337	K	61	Low	68.3	Low	181 Å²	181	115.4 Å²	115.4	79%	0.787	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.9	-22	-179	-65.5	-173.6	179.3	-175.7	0	114	N335	N335-K337 PolarHBondContact O-N 3.27Å; N335-K337 VanDerWaalsContact O-N 3.16Å
338	S	59.8	Low	67.3	Low	95 Å²	95	114.2 Å²	114.2	66%	0.664	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-98.5	-6.6	-171	-57.1	0	0	0	0	114.1	N335	N335-S338 PolarHBondContact O-N 3.36Å; N335-S338 VanDerWaalsContact O-N 3.13Å
339	S	54.7	Low	67.2	Low	63 Å²	63	113.4 Å²	113.4	44%	0.441	58%	0.579	S	S	.	*			trans	-129.6	97.1	179.8	-157.9	0	0	0	0	110.9	K341	S339-K341 PolarHBondContact O-N 2.9Å
340	H	54.6	Low	67.2	Low	187 Å²	187	110.6 Å²	110.6	87%	0.866	57%	0.567	S	S	*	*			trans	-65.9	9.4	170.4	-71.7	-73.7	0	0	0	114
341	K	58.9	Low	67.5	Low	163 Å²	163	107 Å²	107	71%	0.709	55%	0.553	S	S	*	*	S	Bend	trans	-108.8	119.5	178.2	-71.4	-176.7	179.7	174.5	0	109.8	S339 F343	S339-K341 PolarHBondContact O-N 2.9Å; K341-F343 VanDerWaalsContact C-N 3.26Å; K341-F343 WeakPolarHBondContact O-CD2 3.35Å; K341-F343 PolarHBondContact O-N 3.18Å
342	D	50	Low	67.8	Low	150 Å²	150	109.8 Å²	109.8	80%	0.802	56%	0.558	S	S	*	*			trans	-42.1	64.7	-179.3	-59	-47	0	0	0	117.2	S344	D342-S344 PolarHBondContact O-N 3.03Å; D342-S344 VanDerWaalsContact O-N 3.13Å
343	F	56.8	Low	68.3	Low	171 Å²	171	108.2 Å²	108.2	75%	0.75	56%	0.555	S	S	*	*	G	3₁₀ helix	trans	-77.5	21.7	165.3	-79.1	-77.3	0	0	0	112.7	K341 G345 F346	K341-F343 VanDerWaalsContact C-N 3.26Å; K341-F343 WeakPolarHBondContact O-CD2 3.35Å; K341-F343 PolarHBondContact O-N 3.18Å; F343-G345 PolarHBondContact O-N 3.36Å; F343-G345 VanDerWaalsContact O-N 3.1Å; F343-F346 PolarHBondContact O-N 3.46Å
344	S	57	Low	68.9	Low	72 Å²	72	105.2 Å²	105.2	50%	0.503	54%	0.541	S	S	.	.	G	3₁₀ helix	trans	-61	-8.1	163.9	60	0	0	0	0	112.4	D342 F346 E347	D342-S344 PolarHBondContact O-N 3.03Å; D342-S344 VanDerWaalsContact O-N 3.13Å; S344-F346 PolarHBondContact O-N 2.89Å; S344-E347 WeakPolarHBondContact O-CG 3.43Å
345	G	55.7	Low	69.6	Low	63 Å²	63	105.7 Å²	105.7	65%	0.649	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-67.6	-13.9	176.1	0	0	0	0	0	115.8	F343	F343-G345 PolarHBondContact O-N 3.36Å; F343-G345 VanDerWaalsContact O-N 3.1Å
346	F	56.4	Low	70.6	Confident	127 Å²	127	110 Å²	110	56%	0.557	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-117.2	43.8	-178	-108	-89.8	0	0	0	112.5	F343 S344 F348 Q353	F343-F346 PolarHBondContact O-N 3.46Å; S344-F346 PolarHBondContact O-N 2.89Å; F346-F348 PolarHBondContact O-N 3.15Å; F346-Q353 HydrophobicContact CE1-CG 4.34Å
347	E	62.7	Low	71.7	Confident	150 Å²	150	108.4 Å²	108.4	70%	0.701	55%	0.546	S	S	*	.			trans	-65.3	6	-179	-41.4	-170.5	140.6	0	0	115.4	S344	S344-E347 WeakPolarHBondContact O-CG 3.43Å
348	F	70.2	Confident	73.2	Confident	126 Å²	126	103.3 Å²	103.3	55%	0.553	53%	0.527	S	S	*	.	S	Bend	trans	-77	144	-177.7	-61.8	-68.6	0	0	0	111.8	Y328 F346 I350 K352	Y328-F348 PolarHBondContact OH-O 3.47Å; F346-F348 PolarHBondContact O-N 3.15Å; F348-I350 PolarHBondContact O-N 3.4Å; F348-K352 HydrophobicContact CB-CB 4.43Å; F348-K352 HydrophobicContact CD1-CD 4.48Å
349	N	84.4	Confident	74.8	Confident	43 Å²	43	103.1 Å²	103.1	23%	0.23	53%	0.526	C	S	.	.			trans	-52.1	135.2	164	-178.7	-39.4	0	0	0	109.3	E325 L351 K352 Q353	E325-N349 PolarHBondContact OE1-ND2 3.47Å; N349-L351 PolarHBondContact O-N 2.92Å; N349-L351 VanDerWaalsContact O-N 3.13Å; N349-L351 WeakPolarHBondContact OD1-CB 3.35Å; N349-L351 WeakPolarHBondContact OD1-CG 3.4Å; N349-L351 PolarHBondContact OD1-N 2.97Å; N349-K352 HydrophobicContact CB-CD 4.26Å; N349-K352 HydrophobicContact CB-CG 4.18Å; N349-K352 WeakPolarHBondContact O-CA 3.39Å; N349-K352 WeakPolarHBondContact O-CB 3.45Å; N349-K352 PolarHBondContact O-N 3.29Å; N349-Q353 PolarHBondContact O-N 3.12Å; N349-Q353 VanDerWaalsContact O-N 3.13Å
350	I	88.7	Confident	76.6	Confident	30 Å²	30	103.4 Å²	103.4	15%	0.154	52%	0.523	C	S	.	.	H	α-helix	trans	-50.8	-36.6	178.5	-175.6	58.3	0	0	0	112.7	L324 Y328 F348 Q353 I354	L324-I350 HydrophobicContact CB-CG2 4.32Å; Y328-I350 HydrophobicContact CD1-CB 3.87Å; Y328-I350 HydrophobicContact CD1-CG2 4.15Å; Y328-I350 HydrophobicContact CD2-CB 3.82Å; Y328-I350 HydrophobicContact CD2-CD1 4.08Å; Y328-I350 HydrophobicContact CD2-CG1 4.13Å; Y328-I350 HydrophobicContact CE1-CB 4.24Å; Y328-I350 HydrophobicContact CE2-CB 4.21Å; Y328-I350 HydrophobicContact CE2-CD1 4.17Å; Y328-I350 HydrophobicContact CG-CB 3.62Å; Y328-I350 HydrophobicContact CG-CG1 4.33Å; Y328-I350 HydrophobicContact CG-CG2 3.96Å; F348-I350 PolarHBondContact O-N 3.4Å; I350-Q353 WeakPolarHBondContact O-CB 3.41Å; I350-Q353 PolarHBondContact O-N 3.41Å; I350-I354 HydrophobicContact CG1-CD1 4.11Å; I350-I354 WeakPolarHBondContact O-CG1 3.37Å; I350-I354 PolarHBondContact O-N 3.02Å
351	L	92	Very high	78.3	Confident	32 Å²	32	102.9 Å²	102.9	17%	0.168	51%	0.513	C	S	.	.	H	α-helix	trans	-65	-41.6	177.7	-58.6	177.5	0	0	0	111.5	N321 L324 N349 Q353 I354 D355	N321-L351 HydrophobicContact CB-CD1 3.92Å; N321-L351 HydrophobicContact CB-CD2 4.05Å; L324-L351 HydrophobicContact CB-CD2 4.48Å; L324-L351 HydrophobicContact CD1-CD2 4.36Å; N349-L351 PolarHBondContact O-N 2.92Å; N349-L351 VanDerWaalsContact O-N 3.13Å; N349-L351 WeakPolarHBondContact OD1-CB 3.35Å; N349-L351 WeakPolarHBondContact OD1-CG 3.4Å; N349-L351 PolarHBondContact OD1-N 2.97Å; L351-Q353 VanDerWaalsContact C-N 3.29Å; L351-Q353 PolarHBondContact O-N 3.19Å; L351-I354 PolarHBondContact O-N 3.41Å; L351-D355 WeakPolarHBondContact O-CB 3.4Å; L351-D355 VanDerWaalsContact O-CG 3.28Å; L351-D355 PolarHBondContact O-N 3.25Å
352	K	90.8	Very high	79.9	Confident	132 Å²	132	99.8 Å²	99.8	57%	0.574	50%	0.504	S	S	*	.	H	α-helix	trans	-64.8	-35.5	175.2	-66.8	-179.6	-179.5	177.4	0	111.7	F348 N349 D355 Y356	F348-K352 HydrophobicContact CB-CB 4.43Å; F348-K352 HydrophobicContact CD1-CD 4.48Å; N349-K352 HydrophobicContact CB-CD 4.26Å; N349-K352 HydrophobicContact CB-CG 4.18Å; N349-K352 WeakPolarHBondContact O-CA 3.39Å; N349-K352 WeakPolarHBondContact O-CB 3.45Å; N349-K352 PolarHBondContact O-N 3.29Å; K352-D355 PolarHBondContact O-N 3.01Å; K352-Y356 VanDerWaalsContact O-CB 3.31Å; K352-Y356 WeakPolarHBondContact O-CB 3.31Å; K352-Y356 PolarHBondContact O-N 3.35Å
353	Q	89.4	Confident	81.8	Confident	66 Å²	66	101.1 Å²	101.1	31%	0.308	50%	0.498	S	S	.	.	H	α-helix	trans	-67	-42.9	174.9	-174	179.7	7.2	0	0	111.2	F346 N349 I350 L351 Y356 V357	F346-Q353 HydrophobicContact CE1-CG 4.34Å; N349-Q353 PolarHBondContact O-N 3.12Å; N349-Q353 VanDerWaalsContact O-N 3.13Å; I350-Q353 WeakPolarHBondContact O-CB 3.41Å; I350-Q353 PolarHBondContact O-N 3.41Å; L351-Q353 VanDerWaalsContact C-N 3.29Å; L351-Q353 PolarHBondContact O-N 3.19Å; Q353-Y356 PolarHBondContact O-N 2.98Å; Q353-V357 WeakPolarHBondContact O-CG2 3.47Å; Q353-V357 PolarHBondContact O-N 3.3Å
354	I	91.2	Very high	83.4	Confident	61 Å²	61	95.5 Å²	95.5	31%	0.313	48%	0.475	S	S	.	.	H	α-helix	trans	-60.5	-47.8	173.9	-68.9	166	0	0	0	110.1	L324 I350 L351 Y356 V357 L358	L324-I354 HydrophobicContact CD1-CD1 4.03Å; I350-I354 HydrophobicContact CG1-CD1 4.11Å; I350-I354 WeakPolarHBondContact O-CG1 3.37Å; I350-I354 PolarHBondContact O-N 3.02Å; L351-I354 PolarHBondContact O-N 3.41Å; I354-Y356 VanDerWaalsContact C-N 3.33Å; I354-Y356 PolarHBondContact O-N 3.06Å; I354-V357 PolarHBondContact O-N 3.2Å; I354-L358 HydrophobicContact CG2-CD1 3.62Å; I354-L358 HydrophobicContact CG2-CG 4.18Å; I354-L358 WeakPolarHBondContact O-CB 3.31Å; I354-L358 VanDerWaalsContact O-CG 3.29Å; I354-L358 WeakPolarHBondContact O-CG 3.37Å; I354-L358 PolarHBondContact O-N 2.78Å
355	D	92.1	Very high	85	Confident	105 Å²	105	98.9 Å²	98.9	56%	0.561	48%	0.477	S	S	*	.	H	α-helix	trans	-61.7	-39.6	178.9	-71.4	-24.8	0	0	0	112.3	L351 K352 L358 S359	L351-D355 WeakPolarHBondContact O-CB 3.4Å; L351-D355 VanDerWaalsContact O-CG 3.28Å; L351-D355 PolarHBondContact O-N 3.25Å; K352-D355 PolarHBondContact O-N 3.01Å; D355-L358 CarbonylContact O-C 3.44Å; D355-L358 PolarHBondContact O-N 3.32Å; D355-S359 PolarHBondContact O-N 3.37Å
356	Y	90.8	Very high	86.7	Confident	183 Å²	183	102.5 Å²	102.5	72%	0.718	47%	0.471	S	S	*	.	H	α-helix	trans	-64	-42.1	174.8	178.5	-100.1	0	0	0	112.1	K352 Q353 I354 L358 S359	K352-Y356 VanDerWaalsContact O-CB 3.31Å; K352-Y356 WeakPolarHBondContact O-CB 3.31Å; K352-Y356 PolarHBondContact O-N 3.35Å; Q353-Y356 PolarHBondContact O-N 2.98Å; I354-Y356 VanDerWaalsContact C-N 3.33Å; I354-Y356 PolarHBondContact O-N 3.06Å; Y356-L358 VanDerWaalsContact C-N 3.34Å; Y356-S359 PolarHBondContact O-N 2.85Å; Y356-S359 PolarHBondContact O-OG 3.45Å
357	V	89.3	Confident	88.2	Confident	77 Å²	77	103.2 Å²	103.2	47%	0.467	47%	0.47	S	S	.	.	H	α-helix	trans	-66.3	-40.5	174.6	172.7	0	0	0	0	110.6	Q353 I354 S359 L364	Q353-V357 WeakPolarHBondContact O-CG2 3.47Å; Q353-V357 PolarHBondContact O-N 3.3Å; I354-V357 PolarHBondContact O-N 3.2Å; V357-S359 VanDerWaalsContact C-N 3.27Å; V357-S359 PolarHBondContact O-N 3.18Å; V357-L364 HydrophobicContact CG1-CD1 4.21Å; V357-L364 WeakPolarHBondContact O-CD1 3.44Å
358	L	91.3	Very high	89.5	Confident	73 Å²	73	97.5 Å²	97.5	38%	0.382	45%	0.446	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-0.7	-179.7	-68	-179.8	0	0	0	114.2	I354 D355 Y356 R361 L364	I354-L358 HydrophobicContact CG2-CD1 3.62Å; I354-L358 HydrophobicContact CG2-CG 4.18Å; I354-L358 WeakPolarHBondContact O-CB 3.31Å; I354-L358 VanDerWaalsContact O-CG 3.29Å; I354-L358 WeakPolarHBondContact O-CG 3.37Å; I354-L358 PolarHBondContact O-N 2.78Å; D355-L358 CarbonylContact O-C 3.44Å; D355-L358 PolarHBondContact O-N 3.32Å; Y356-L358 VanDerWaalsContact C-N 3.34Å; L358-R361 WeakPolarHBondContact O-CG 3.33Å; L358-R361 PolarHBondContact O-NE 3.06Å; L358-L364 HydrophobicContact CD2-CD1 4.39Å
359	S	93.3	Very high	90.5	Very high	92 Å²	92	92.1 Å²	92.1	64%	0.643	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-31.8	176.7	71.3	0	0	0	0	112.1	D355 Y356 V357	D355-S359 PolarHBondContact O-N 3.37Å; Y356-S359 PolarHBondContact O-N 2.85Å; Y356-S359 PolarHBondContact O-OG 3.45Å; V357-S359 VanDerWaalsContact C-N 3.27Å; V357-S359 PolarHBondContact O-N 3.18Å
360	D	91.9	Very high	90.5	Very high	69 Å²	69	91 Å²	91	37%	0.369	42%	0.417	S	S	.	.			trans	-104.3	63.3	178	-171.3	2.3	0	0	0	111.3	D362 R363 L364	D360-D362 VanDerWaalsContact C-N 3.25Å; D360-D362 PolarHBondContact O-N 3.49Å; D360-R363 HydrophobicContact CB-CB 4.39Å; D360-R363 PolarHBondContact O-N 3.34Å; D360-R363 WeakPolarHBondContact OD1-CB 3.24Å; D360-R363 PolarHBondContact OD1-N 3.28Å; D360-R363 VanDerWaalsContact OD1-N 3.12Å; D360-R363 WeakPolarHBondContact OD2-CB 3.27Å; D360-R363 WeakPolarHBondContact OD2-CD 3.17Å; D360-L364 PolarHBondContact O-N 3.43Å
361	R	91.1	Very high	90.2	Very high	176 Å²	176	91.3 Å²	91.3	66%	0.664	42%	0.417	S	S	*	.	H	α-helix	trans	-62.7	-33.2	-178.8	-58.1	-169.4	179	-174.2	-2.3	112.5	L358 L364 R365	L358-R361 WeakPolarHBondContact O-CG 3.33Å; L358-R361 PolarHBondContact O-NE 3.06Å; R361-L364 PolarHBondContact O-N 3.49Å; R361-R365 WeakPolarHBondContact O-CB 3.33Å; R361-R365 PolarHBondContact O-N 3.25Å
362	D	91.6	Very high	89.6	Confident	98 Å²	98	93.5 Å²	93.5	52%	0.524	42%	0.423	S	S	.	.	H	α-helix	trans	-65.6	-43	-179	-69.4	-39.5	0	0	0	111.6	D360 L364 R365 R366	D360-D362 VanDerWaalsContact C-N 3.25Å; D360-D362 PolarHBondContact O-N 3.49Å; D362-L364 VanDerWaalsContact C-N 3.35Å; D362-R365 PolarHBondContact O-N 3.18Å; D362-R366 WeakPolarHBondContact O-CB 3.5Å; D362-R366 VanDerWaalsContact O-CG 3.27Å; D362-R366 WeakPolarHBondContact O-CG 3.3Å; D362-R366 PolarHBondContact O-N 3.48Å
363	R	91	Very high	88.9	Confident	177 Å²	177	88.6 Å²	88.6	67%	0.668	41%	0.406	S	S	*	.	H	α-helix	trans	-62.6	-42.4	173.3	179.9	-175.9	171.5	-154.4	-2.1	111.9	D360 R366 R367	D360-R363 HydrophobicContact CB-CB 4.39Å; D360-R363 PolarHBondContact O-N 3.34Å; D360-R363 WeakPolarHBondContact OD1-CB 3.24Å; D360-R363 PolarHBondContact OD1-N 3.28Å; D360-R363 VanDerWaalsContact OD1-N 3.12Å; D360-R363 WeakPolarHBondContact OD2-CB 3.27Å; D360-R363 WeakPolarHBondContact OD2-CD 3.17Å; R363-R366 PolarHBondContact O-N 2.71Å; R363-R367 PolarHBondContact O-N 2.81Å
364	L	90.2	Very high	88.2	Confident	53 Å²	53	93.5 Å²	93.5	28%	0.277	43%	0.434	S	S	.	.	H	α-helix	trans	-63.1	-43.6	177.9	-67	177	0	0	0	111.5	V357 L358 D360 R361 D362 R367 T368	V357-L364 HydrophobicContact CG1-CD1 4.21Å; V357-L364 WeakPolarHBondContact O-CD1 3.44Å; L358-L364 HydrophobicContact CD2-CD1 4.39Å; D360-L364 PolarHBondContact O-N 3.43Å; R361-L364 PolarHBondContact O-N 3.49Å; D362-L364 VanDerWaalsContact C-N 3.35Å; L364-R367 WeakPolarHBondContact O-CB 3.31Å; L364-R367 PolarHBondContact O-N 3.23Å; L364-T368 PolarHBondContact O-N 3.48Å
365	R	91.7	Very high	87.6	Confident	143 Å²	143	92 Å²	92	54%	0.54	42%	0.424	S	S	.	.	H	α-helix	trans	-63.2	-46.7	176	-176.2	179.9	175.6	-168.5	-1.2	111.9	R361 D362 R367 T368 Q369	R361-R365 WeakPolarHBondContact O-CB 3.33Å; R361-R365 PolarHBondContact O-N 3.25Å; D362-R365 PolarHBondContact O-N 3.18Å; R365-R367 PolarHBondContact O-N 2.91Å; R365-T368 PolarHBondContact O-N 3.49Å; R365-T368 PolarHBondContact O-OG1 3.25Å; R365-Q369 VanDerWaalsContact NE-NE2 3.18Å; R365-Q369 WeakPolarHBondContact O-CG 3.09Å; R365-Q369 PolarHBondContact O-N 3.33Å
366	R	90.9	Very high	87.1	Confident	139 Å²	139	89.7 Å²	89.7	53%	0.525	42%	0.417	S	S	.	.	H	α-helix	trans	-58.7	-36.9	176.3	-74.1	175.7	-170.8	141.9	6.2	111.7	D362 R363 T368 Q369 I394	D362-R366 WeakPolarHBondContact O-CB 3.5Å; D362-R366 VanDerWaalsContact O-CG 3.27Å; D362-R366 WeakPolarHBondContact O-CG 3.3Å; D362-R366 PolarHBondContact O-N 3.48Å; R363-R366 PolarHBondContact O-N 2.71Å; R366-T368 VanDerWaalsContact C-N 3.27Å; R366-T368 PolarHBondContact O-N 2.93Å; R366-Q369 PolarHBondContact O-N 3.12Å; R366-Q369 VanDerWaalsContact O-N 3.08Å; R366-I394 HydrophobicContact CG-CD1 4.3Å
367	R	87.7	Confident	86.8	Confident	142 Å²	142	82.7 Å²	82.7	54%	0.536	39%	0.389	S	S	.	.	H	α-helix	trans	-61.2	-35.3	176.2	-169.5	176.6	69.5	162	2.5	112.4	R363 L364 R365 Q369 R372	R363-R367 PolarHBondContact O-N 2.81Å; L364-R367 WeakPolarHBondContact O-CB 3.31Å; L364-R367 PolarHBondContact O-N 3.23Å; R365-R367 PolarHBondContact O-N 2.91Å; R367-Q369 VanDerWaalsContact C-N 3.31Å; R367-R372 PolarHBondContact O-NH2 3.32Å
368	T	90.3	Very high	86.5	Confident	30 Å²	30	82.1 Å²	82.1	18%	0.184	39%	0.386	C	S	.	.	H	α-helix	trans	-79.8	-11	176.3	55.7	0	0	0	0	114	L364 R365 R366 F399 D400	L364-T368 PolarHBondContact O-N 3.48Å; R365-T368 PolarHBondContact O-N 3.49Å; R365-T368 PolarHBondContact O-OG1 3.25Å; R366-T368 VanDerWaalsContact C-N 3.27Å; R366-T368 PolarHBondContact O-N 2.93Å; T368-F399 HydrophobicContact CG2-CD2 4.27Å; T368-F399 HydrophobicContact CG2-CE2 3.86Å; T368-F399 HydrophobicContact CG2-CZ 4.37Å; T368-F399 CarbonylContact O-C 3.49Å; T368-F399 WeakPolarHBondContact O-CA 3.38Å; T368-D400 WeakPolarHBondContact CA-O 3.46Å; T368-D400 PolarHBondContact O-N 3.49Å
369	Q	90.4	Very high	86.1	Confident	13 Å²	13	81 Å²	81	6%	0.061	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.9	7.5	-176.8	-74.2	174.7	-27	0	0	113	R365 R366 R367 I394 D395 E396	R365-Q369 VanDerWaalsContact NE-NE2 3.18Å; R365-Q369 WeakPolarHBondContact O-CG 3.09Å; R365-Q369 PolarHBondContact O-N 3.33Å; R366-Q369 PolarHBondContact O-N 3.12Å; R366-Q369 VanDerWaalsContact O-N 3.08Å; R367-Q369 VanDerWaalsContact C-N 3.31Å; Q369-I394 HydrophobicContact CB-CG2 3.89Å; Q369-D395 WeakPolarHBondContact CB-O 3.43Å; Q369-D395 VanDerWaalsContact CG-O 3.31Å; Q369-D395 WeakPolarHBondContact CG-O 3.16Å; Q369-D395 PolarHBondContact O-N 3.32Å; Q369-E396 PolarHBondContact NE2-O 3.32Å; Q369-E396 VanDerWaalsContact NE2-O 3.12Å
370	V	85.9	Confident	85.5	Confident	21 Å²	21	77.8 Å²	77.8	13%	0.127	37%	0.367	C	S	.	.	B	Isolated β-bridge	trans	-91.7	119.8	174.9	179.9	0	0	0	0	108.8	R372	V370-R372 PolarHBondContact O-N 3.37Å; V370-R372 PolarHBondContact O-NH1 2.68Å
371	K	82.1	Confident	84.5	Confident	36 Å²	36	77.9 Å²	77.9	16%	0.157	37%	0.371	C	S	.	.			trans	-70.4	116.4	177.9	-176	179.1	-179.4	179.4	0	110.6	Y375 E380 A388 I398	K371-Y375 WeakPolarHBondContact CE-O 3.29Å; K371-Y375 PolarHBondContact NZ-O 3.02Å; K371-E380 IonicContact NZ-OE1 2.95Å; K371-E380 PolarHBondContact NZ-OE1 3.48Å; K371-A388 HydrophobicContact CD-CB 4.41Å; K371-I398 HydrophobicContact CB-CD1 4.41Å; K371-I398 HydrophobicContact CD-CD1 4.46Å
372	R	78.5	Confident	83.5	Confident	78 Å²	78	74 Å²	74	29%	0.294	37%	0.371	S	S	.	.			trans	-106.5	-25.3	179.6	-60.1	-178	-178.4	80.5	8.1	113.9	R367 V370 D400	R367-R372 PolarHBondContact O-NH2 3.32Å; V370-R372 PolarHBondContact O-N 3.37Å; V370-R372 PolarHBondContact O-NH1 2.68Å; R372-D400 WeakPolarHBondContact CB-OD2 3.29Å; R372-D400 IonicContact CZ-OD1 2.68Å; R372-D400 PolarHBondContact N-OD2 2.83Å; R372-D400 PolarHBondContact NH1-O 3.3Å; R372-D400 IonicContact NH1-OD1 3.19Å; R372-D400 PolarHBondContact NH1-OD1 3.33Å
373	S	75.6	Confident	81.9	Confident	29 Å²	29	77.5 Å²	77.5	20%	0.203	38%	0.384	C	S	.	.	S	Bend	trans	-103.8	149.9	-174.7	42.6	0	0	0	0	113.6	Y375	S373-Y375 VanDerWaalsContact C-N 3.34Å; S373-Y375 PolarHBondContact O-N 3.33Å; S373-Y375 WeakPolarHBondContact OG-CD1 3.39Å; S373-Y375 WeakPolarHBondContact OG-CE1 3.38Å
374	D	75.5	Confident	80.4	Confident	169 Å²	169	70.6 Å²	70.6	90%	0.904	36%	0.363	S	S	*	.			trans	-80.1	73.9	-177.1	-67.6	-37.2	0	0	0	111.2
375	Y	78.2	Confident	78.8	Confident	28 Å²	28	75 Å²	75	11%	0.11	38%	0.376	C	S	.	.			trans	-128.9	157.9	169.1	65.9	-94.1	0	0	0	111.5	N203 Q204 K371 S373 I398	N203-Y375 HydrophobicContact CB-CE2 3.63Å; N203-Y375 WeakPolarHBondContact CB-OH 3.2Å; N203-Y375 PolarHBondContact ND2-OH 3.07Å; Q204-Y375 HydrophobicContact CG-CD2 3.58Å; Q204-Y375 HydrophobicContact CG-CE2 4.23Å; Q204-Y375 HydrophobicContact CG-CG 4.18Å; K371-Y375 WeakPolarHBondContact CE-O 3.29Å; K371-Y375 PolarHBondContact NZ-O 3.02Å; S373-Y375 VanDerWaalsContact C-N 3.34Å; S373-Y375 PolarHBondContact O-N 3.33Å; S373-Y375 WeakPolarHBondContact OG-CD1 3.39Å; S373-Y375 WeakPolarHBondContact OG-CE1 3.38Å; Y375-I398 WeakPolarHBondContact OH-CG2 3.44Å
376	S	81.8	Confident	77.2	Confident	58 Å²	58	74.9 Å²	74.9	41%	0.406	39%	0.386	S	S	.	.			trans	-113	140.2	173.3	58	0	0	0	0	110.4	E380	S376-E380 WeakPolarHBondContact CA-OE2 3.45Å; S376-E380 WeakPolarHBondContact CB-OE2 3.46Å
377	Y	84.2	Confident	75.5	Confident	35 Å²	35	73 Å²	73	14%	0.137	39%	0.386	C	S	.	.			trans	-85.9	157.3	170.8	63.5	-90.2	0	0	0	110.9	R207 G379 E380 P381	R207-Y377 HydrophobicContact CG-CD2 3.79Å; R207-Y377 HydrophobicContact CG-CE2 3.95Å; R207-Y377 VanDerWaalsContact CZ-CE1 3.42Å; Y377-G379 PolarHBondContact O-N 3.47Å; Y377-E380 HydrophobicContact CD1-CB 3.84Å; Y377-E380 HydrophobicContact CD1-CG 3.98Å; Y377-E380 HydrophobicContact CD2-CB 3.94Å; Y377-E380 HydrophobicContact CE1-CB 3.62Å; Y377-E380 HydrophobicContact CE1-CG 3.43Å; Y377-E380 VanDerWaalsContact CE1-CG 3.43Å; Y377-E380 WeakPolarHBondContact CE1-OE1 3.42Å; Y377-E380 VanDerWaalsContact CE2-CA 3.42Å; Y377-E380 HydrophobicContact CE2-CB 3.72Å; Y377-E380 HydrophobicContact CE2-CG 4.34Å; Y377-E380 HydrophobicContact CG-CB 4.01Å; Y377-E380 WeakPolarHBondContact O-CB 3.34Å; Y377-E380 PolarHBondContact O-N 3.04Å; Y377-E380 VanDerWaalsContact O-N 3.16Å; Y377-P381 WeakPolarHBondContact OH-CD 3.3Å
378	V	83.9	Confident	73.9	Confident	65 Å²	65	67.5 Å²	67.5	39%	0.394	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	122.7	179.4	-180	0	0	0	0	109.9	Q204 P206 Y211	Q204-V378 WeakPolarHBondContact O-CG2 3.47Å; Q204-V378 PolarHBondContact O-N 2.77Å; P206-V378 HydrophobicContact CB-CB 4.21Å; P206-V378 HydrophobicContact CB-CG1 4.29Å; P206-V378 HydrophobicContact CG-CB 3.84Å; P206-V378 HydrophobicContact CG-CG1 3.9Å; P206-V378 HydrophobicContact CG-CG2 4.46Å; Y211-V378 HydrophobicContact CE1-CG1 4.17Å
379	G	82.2	Confident	72.1	Confident	49 Å²	49	72.6 Å²	72.6	51%	0.505	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	91.4	4.6	-176.6	0	0	0	0	0	114.7	Y377 P381	Y377-G379 PolarHBondContact O-N 3.47Å; G379-P381 WeakPolarHBondContact O-CD 3.25Å
380	E	80.2	Confident	70.5	Confident	25 Å²	25	76.5 Å²	76.5	12%	0.117	41%	0.412	C	S	.	.			trans	-58.2	120	176.8	-173.9	173.8	-137.4	0	0	111.2	K371 S376 Y377 S382 S384	K371-E380 IonicContact NZ-OE1 2.95Å; K371-E380 PolarHBondContact NZ-OE1 3.48Å; S376-E380 WeakPolarHBondContact CA-OE2 3.45Å; S376-E380 WeakPolarHBondContact CB-OE2 3.46Å; Y377-E380 HydrophobicContact CD1-CB 3.84Å; Y377-E380 HydrophobicContact CD1-CG 3.98Å; Y377-E380 HydrophobicContact CD2-CB 3.94Å; Y377-E380 HydrophobicContact CE1-CB 3.62Å; Y377-E380 HydrophobicContact CE1-CG 3.43Å; Y377-E380 VanDerWaalsContact CE1-CG 3.43Å; Y377-E380 WeakPolarHBondContact CE1-OE1 3.42Å; Y377-E380 VanDerWaalsContact CE2-CA 3.42Å; Y377-E380 HydrophobicContact CE2-CB 3.72Å; Y377-E380 HydrophobicContact CE2-CG 4.34Å; Y377-E380 HydrophobicContact CG-CB 4.01Å; Y377-E380 WeakPolarHBondContact O-CB 3.34Å; Y377-E380 PolarHBondContact O-N 3.04Å; Y377-E380 VanDerWaalsContact O-N 3.16Å; E380-S382 PolarHBondContact O-N 3.27Å; E380-S384 WeakPolarHBondContact CG-OG 3.39Å
381	P	72.5	Confident	69.4	Low	72 Å²	72	81.2 Å²	81.2	47%	0.468	44%	0.437	S	S	.	.			trans	-66.3	133.5	177.9	26.7	-31.7	0	0	0	108.9	Y377 G379 Q383 S384	Y377-P381 WeakPolarHBondContact OH-CD 3.3Å; G379-P381 WeakPolarHBondContact O-CD 3.25Å; P381-Q383 PolarHBondContact O-N 3.46Å; P381-S384 PolarHBondContact O-N 3.04Å; P381-S384 PolarHBondContact O-OG 3.31Å
382	S	69.2	Low	68.5	Low	94 Å²	94	87.5 Å²	87.5	66%	0.657	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-22.7	-174.2	-52.7	0	0	0	0	114.1	E380	E380-S382 PolarHBondContact O-N 3.27Å
383	Q	58.3	Low	68.2	Low	172 Å²	172	86.8 Å²	86.8	80%	0.804	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.9	-28.1	177.2	-68.2	178.3	-12.5	0	0	113.7	P381 R385	P381-Q383 PolarHBondContact O-N 3.46Å; Q383-R385 PolarHBondContact O-N 3.39Å
384	S	58.5	Low	68.4	Low	32 Å²	32	89.5 Å²	89.5	22%	0.224	48%	0.482	C	S	.	.	H	α-helix	trans	-75.2	-10.3	-179	60.2	0	0	0	0	114.2	E380 P381 D386 A388	E380-S384 WeakPolarHBondContact CG-OG 3.39Å; P381-S384 PolarHBondContact O-N 3.04Å; P381-S384 PolarHBondContact O-OG 3.31Å; S384-D386 VanDerWaalsContact C-N 3.34Å; S384-D386 PolarHBondContact O-N 3.46Å; S384-A388 PolarHBondContact O-N 3.05Å
385	R	57.7	Low	68.9	Low	144 Å²	144	82.7 Å²	82.7	54%	0.543	45%	0.446	S	S	.	.	H	α-helix	trans	-69	-30.9	-179.1	-67.6	-176.2	175.5	-173.9	-1.3	113.5	Q383	Q383-R385 PolarHBondContact O-N 3.39Å
386	D	57.4	Low	69.3	Low	141 Å²	141	88.3 Å²	88.3	75%	0.754	47%	0.473	S	S	*	.	H	α-helix	trans	-78.1	-31.3	-178.3	-71.8	-28.1	0	0	0	111.5	S384	S384-D386 VanDerWaalsContact C-N 3.34Å; S384-D386 PolarHBondContact O-N 3.46Å
387	D	55.3	Low	69.6	Low	99 Å²	99	90.8 Å²	90.8	53%	0.529	48%	0.479	S	S	.	.	H	α-helix	trans	-78.8	-27.9	178.7	-66.1	-32.3	0	0	0	112.9	K389 N390 V393	D387-K389 PolarHBondContact O-N 2.91Å; D387-N390 PolarHBondContact O-N 2.82Å; D387-V393 HydrophobicContact CB-CG2 4.24Å; D387-V393 VanDerWaalsContact O-CG2 3.24Å; D387-V393 WeakPolarHBondContact O-CG2 3.28Å
388	A	53.6	Low	69.8	Low	28 Å²	28	89.4 Å²	89.4	23%	0.231	47%	0.474	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	-8.5	-177.4	0	0	0	0	0	115.3	K371 S384	K371-A388 HydrophobicContact CD-CB 4.41Å; S384-A388 PolarHBondContact O-N 3.05Å
389	K	54	Low	70.1	Confident	137 Å²	137	90.6 Å²	90.6	60%	0.596	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.4	-7.1	175.8	-69.7	-171.9	178.3	-179.6	0	114.1	D387	D387-K389 PolarHBondContact O-N 2.91Å
390	N	56.4	Low	70.4	Confident	94 Å²	94	88.2 Å²	88.2	50%	0.503	45%	0.449	S	S	.	.	S	Bend	trans	-88	126.3	172.5	-73.5	-26.1	0	0	0	109.1	D387 E392 V393	D387-N390 PolarHBondContact O-N 2.82Å; N390-E392 HydrophobicContact CB-CB 4.44Å; N390-E392 PolarHBondContact O-N 3.31Å; N390-V393 HydrophobicContact CB-CG2 4.44Å; N390-V393 PolarHBondContact O-N 3Å; N390-V393 VanDerWaalsContact O-N 3.13Å
391	D	61.4	Low	70.9	Confident	120 Å²	120	87.7 Å²	87.7	64%	0.642	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-2.5	171.1	-64.8	-40.8	0	0	0	113.2
392	E	63.8	Low	71.6	Confident	168 Å²	168	85.6 Å²	85.6	79%	0.785	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-13.6	-178	-60.6	180	179.9	0	0	113.5	N390 I394	N390-E392 HydrophobicContact CB-CB 4.44Å; N390-E392 PolarHBondContact O-N 3.31Å; E392-I394 PolarHBondContact O-N 3.05Å; E392-I394 VanDerWaalsContact O-N 3.11Å
393	V	71.5	Confident	72.3	Confident	63 Å²	63	82.5 Å²	82.5	38%	0.382	41%	0.408	S	S	.	.			trans	-79.7	99.7	178.2	-175	0	0	0	0	109.2	D387 N390	D387-V393 HydrophobicContact CB-CG2 4.24Å; D387-V393 VanDerWaalsContact O-CG2 3.24Å; D387-V393 WeakPolarHBondContact O-CG2 3.28Å; N390-V393 HydrophobicContact CB-CG2 4.44Å; N390-V393 PolarHBondContact O-N 3Å; N390-V393 VanDerWaalsContact O-N 3.13Å
394	I	81.5	Confident	73.7	Confident	86 Å²	86	78.9 Å²	78.9	44%	0.441	39%	0.39	S	S	.	.	B	Isolated β-bridge	trans	-83.8	127.6	174.5	-59.4	174.2	0	0	0	108.6	R366 Q369 E392	R366-I394 HydrophobicContact CG-CD1 4.3Å; Q369-I394 HydrophobicContact CB-CG2 3.89Å; E392-I394 PolarHBondContact O-N 3.05Å; E392-I394 VanDerWaalsContact O-N 3.11Å
395	D	84.9	Confident	75.1	Confident	26 Å²	26	79.9 Å²	79.9	14%	0.139	39%	0.389	C	S	.	.			trans	-119.2	111.2	177.7	-165.4	-23.4	0	0	0	111	R207 Q369 E397 I398	R207-D395 IonicContact CZ-OD1 2.67Å; R207-D395 IonicContact CZ-OD2 3.21Å; R207-D395 IonicContact NH1-OD1 3.18Å; R207-D395 PolarHBondContact NH1-OD1 3.13Å; R207-D395 IonicContact NH1-OD2 3.72Å; R207-D395 PolarHBondContact NH1-OD2 2.83Å; R207-D395 IonicContact NH2-OD1 3.59Å; R207-D395 IonicContact NH2-OD2 3.12Å; R207-D395 PolarHBondContact NH2-OD2 2.54Å; Q369-D395 WeakPolarHBondContact CB-O 3.43Å; Q369-D395 VanDerWaalsContact CG-O 3.31Å; Q369-D395 WeakPolarHBondContact CG-O 3.16Å; Q369-D395 PolarHBondContact O-N 3.32Å; D395-E397 VanDerWaalsContact C-N 3.26Å; D395-E397 PolarHBondContact O-N 2.99Å; D395-E397 PolarHBondContact OD1-N 3.13Å; D395-I398 HydrophobicContact CB-CB 4.24Å; D395-I398 HydrophobicContact CB-CD1 3.8Å; D395-I398 HydrophobicContact CB-CG1 4.06Å; D395-I398 PolarHBondContact O-N 2.78Å; D395-I398 WeakPolarHBondContact OD2-CD1 3.3Å
396	E	87.4	Confident	76.5	Confident	146 Å²	146	74.4 Å²	74.4	68%	0.682	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.3	-24.5	-171.3	-65.1	-175.4	-179.1	0	0	114.3	Q369	Q369-E396 PolarHBondContact NE2-O 3.32Å; Q369-E396 VanDerWaalsContact NE2-O 3.12Å
397	E	86.7	Confident	77.9	Confident	111 Å²	111	73.3 Å²	73.3	52%	0.519	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-3	-177.2	-64.1	-166.8	164.4	0	0	113.4	R207 D395	R207-E397 WeakPolarHBondContact CB-OE2 3.43Å; R207-E397 WeakPolarHBondContact CD-OE2 3.18Å; R207-E397 WeakPolarHBondContact CG-OE2 3.4Å; R207-E397 IonicContact NE-OE2 3.46Å; D395-E397 VanDerWaalsContact C-N 3.26Å; D395-E397 PolarHBondContact O-N 2.99Å; D395-E397 PolarHBondContact OD1-N 3.13Å
398	I	88.9	Confident	79.3	Confident	6 Å²	6	69.5 Å²	69.5	3%	0.031	34%	0.34	C	S	.	.			trans	-100.5	144.7	-179.3	-66.9	178.9	0	0	0	110.8	K371 Y375 D395 D400	K371-I398 HydrophobicContact CB-CD1 4.41Å; K371-I398 HydrophobicContact CD-CD1 4.46Å; Y375-I398 WeakPolarHBondContact OH-CG2 3.44Å; D395-I398 HydrophobicContact CB-CB 4.24Å; D395-I398 HydrophobicContact CB-CD1 3.8Å; D395-I398 HydrophobicContact CB-CG1 4.06Å; D395-I398 PolarHBondContact O-N 2.78Å; D395-I398 WeakPolarHBondContact OD2-CD1 3.3Å; I398-D400 HydrophobicContact CG2-CB 4.08Å
399	F	90.6	Very high	80.9	Confident	89 Å²	89	69.8 Å²	69.8	39%	0.39	34%	0.337	S	S	.	.			trans	-122	112.9	161.9	-177.6	-82.9	0	0	0	109.8	L199 N203 T368 D401	L199-F399 HydrophobicContact CD1-CB 4.19Å; L199-F399 HydrophobicContact CD1-CD1 3.61Å; L199-F399 HydrophobicContact CD1-CE1 4.4Å; L199-F399 HydrophobicContact CD1-CG 4.27Å; L199-F399 HydrophobicContact CD2-CD1 3.52Å; L199-F399 HydrophobicContact CD2-CE1 3.81Å; L199-F399 HydrophobicContact CG-CD1 4.05Å; N203-F399 PolarHBondContact ND2-O 3.45Å; N203-F399 PolarHBondContact OD1-N 2.86Å; N203-F399 VanDerWaalsContact OD1-N 3.15Å; T368-F399 HydrophobicContact CG2-CD2 4.27Å; T368-F399 HydrophobicContact CG2-CE2 3.86Å; T368-F399 HydrophobicContact CG2-CZ 4.37Å; T368-F399 CarbonylContact O-C 3.49Å; T368-F399 WeakPolarHBondContact O-CA 3.38Å; F399-D401 HydrophobicContact CE1-CB 3.83Å; F399-D401 HydrophobicContact CZ-CB 4.16Å
400	D	89.5	Confident	82.3	Confident	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.32	C	S	.	.			trans	-127.5	110.1	-178.9	-177.4	-37.9	0	0	0	109	T368 R372 I398 D402	T368-D400 WeakPolarHBondContact CA-O 3.46Å; T368-D400 PolarHBondContact O-N 3.49Å; R372-D400 WeakPolarHBondContact CB-OD2 3.29Å; R372-D400 IonicContact CZ-OD1 2.68Å; R372-D400 PolarHBondContact N-OD2 2.83Å; R372-D400 PolarHBondContact NH1-O 3.3Å; R372-D400 IonicContact NH1-OD1 3.19Å; R372-D400 PolarHBondContact NH1-OD1 3.33Å; I398-D400 HydrophobicContact CG2-CB 4.08Å; D400-D402 WeakPolarHBondContact OD1-CB 3.33Å; D400-D402 PolarHBondContact OD1-N 3.3Å; D400-D402 VanDerWaalsContact OD1-N 3.16Å
401	D	89.3	Confident	83.4	Confident	13 Å²	13	66.5 Å²	66.5	7%	0.07	32%	0.318	C	S	.	.			trans	-119.1	34.8	177.3	70.5	-16	0	0	0	112.4	R192 Q196 F399 D403 F404 Y405	R192-D401 IonicContact CZ-OD2 2.63Å; R192-D401 IonicContact NH2-OD1 3.97Å; R192-D401 PolarHBondContact NH2-OD1 3.12Å; R192-D401 IonicContact NH2-OD2 2.87Å; R192-D401 PolarHBondContact NH2-OD2 3.37Å; Q196-D401 PolarHBondContact NE2-OD1 3.39Å; Q196-D401 PolarHBondContact OE1-OD1 3.27Å; F399-D401 HydrophobicContact CE1-CB 3.83Å; F399-D401 HydrophobicContact CZ-CB 4.16Å; D401-D403 PolarHBondContact O-N 3.39Å; D401-D403 VanDerWaalsContact O-N 3.15Å; D401-F404 HydrophobicContact CB-CB 4.43Å; D401-F404 PolarHBondContact O-N 2.85Å; D401-Y405 PolarHBondContact O-N 2.88Å
402	D	87	Confident	84.4	Confident	28 Å²	28	63.4 Å²	63.4	15%	0.15	30%	0.301	C	S	.	.	H	α-helix	trans	-58.7	-28.2	-175.2	-81.1	-13.4	0	0	0	113.4	Q196 D400 E406	Q196-D402 PolarHBondContact NE2-OD1 2.96Å; D400-D402 WeakPolarHBondContact OD1-CB 3.33Å; D400-D402 PolarHBondContact OD1-N 3.3Å; D400-D402 VanDerWaalsContact OD1-N 3.16Å; D402-E406 WeakPolarHBondContact O-CB 3.33Å; D402-E406 VanDerWaalsContact O-CG 3.29Å; D402-E406 WeakPolarHBondContact O-CG 3.01Å; D402-E406 PolarHBondContact O-N 2.92Å
403	D	84.7	Confident	85.2	Confident	29 Å²	29	57.4 Å²	57.4	16%	0.155	27%	0.274	C	S	.	.	H	α-helix	trans	-62.6	-50.5	170.2	15.1	41.3	0	0	0	112.1	D401 Y405 E406 Q407 R440	D401-D403 PolarHBondContact O-N 3.39Å; D401-D403 VanDerWaalsContact O-N 3.15Å; D403-Y405 VanDerWaalsContact C-N 3.33Å; D403-E406 PolarHBondContact O-N 3.31Å; D403-Q407 WeakPolarHBondContact O-CG 3.5Å; D403-Q407 PolarHBondContact O-N 3.42Å; D403-R440 VanDerWaalsContact CG-NH2 3.26Å; D403-R440 IonicContact OD2-CZ 3.33Å; D403-R440 IonicContact OD2-NH2 2.71Å; D403-R440 PolarHBondContact OD2-NH2 2.95Å
404	F	87.4	Confident	85.5	Confident	97 Å²	97	59.5 Å²	59.5	43%	0.425	28%	0.279	S	S	.	.	H	α-helix	trans	-66.7	-43	-175.5	-179.6	-118.7	0	0	0	109.7	D401 E406 Q407 L408	D401-F404 HydrophobicContact CB-CB 4.43Å; D401-F404 PolarHBondContact O-N 2.85Å; F404-E406 VanDerWaalsContact C-N 3.32Å; F404-E406 PolarHBondContact O-N 3.41Å; F404-Q407 WeakPolarHBondContact O-CB 3.46Å; F404-Q407 PolarHBondContact O-N 3.46Å; F404-Q407 VanDerWaalsContact O-N 3.08Å; F404-L408 HydrophobicContact CD1-CD1 4.08Å; F404-L408 HydrophobicContact CD1-CG 4.47Å; F404-L408 HydrophobicContact CE1-CD1 3.65Å; F404-L408 HydrophobicContact CE1-CD2 4.4Å; F404-L408 HydrophobicContact CE1-CG 4.13Å; F404-L408 HydrophobicContact CE2-CD2 4.08Å; F404-L408 HydrophobicContact CE2-CG 4.25Å; F404-L408 HydrophobicContact CZ-CD1 3.96Å; F404-L408 HydrophobicContact CZ-CD2 3.83Å; F404-L408 HydrophobicContact CZ-CG 4Å; F404-L408 WeakPolarHBondContact O-CG 3.15Å; F404-L408 PolarHBondContact O-N 3.13Å
405	Y	88.6	Confident	85.1	Confident	53 Å²	53	58 Å²	58	21%	0.208	27%	0.268	C	S	.	.	H	α-helix	trans	-56.8	-43.7	171.9	174.7	-112.4	0	0	0	112.5	I193 Q196 D401 D403 Q407 L408 L409	I193-Y405 HydrophobicContact CB-CE2 4.13Å; I193-Y405 HydrophobicContact CG1-CE2 3.96Å; I193-Y405 HydrophobicContact CG2-CE2 3.96Å; Q196-Y405 HydrophobicContact CB-CD2 3.91Å; Q196-Y405 HydrophobicContact CB-CE2 3.71Å; Q196-Y405 HydrophobicContact CB-CG 4.42Å; Q196-Y405 HydrophobicContact CG-CD1 3.89Å; Q196-Y405 HydrophobicContact CG-CD2 3.8Å; Q196-Y405 HydrophobicContact CG-CE1 3.98Å; Q196-Y405 HydrophobicContact CG-CE2 3.9Å; Q196-Y405 HydrophobicContact CG-CG 3.79Å; D401-Y405 PolarHBondContact O-N 2.88Å; D403-Y405 VanDerWaalsContact C-N 3.33Å; Y405-Q407 VanDerWaalsContact C-N 3.35Å; Y405-Q407 PolarHBondContact O-N 3.16Å; Y405-L408 PolarHBondContact O-N 3.46Å; Y405-L409 HydrophobicContact CD1-CD1 4.07Å; Y405-L409 HydrophobicContact CD2-CG 4.49Å; Y405-L409 HydrophobicContact CE1-CD1 3.45Å; Y405-L409 VanDerWaalsContact CE1-CD1 3.45Å; Y405-L409 HydrophobicContact CE1-CG 4.16Å; Y405-L409 HydrophobicContact CE2-CD1 4.21Å; Y405-L409 HydrophobicContact CE2-CD2 4.21Å; Y405-L409 HydrophobicContact CE2-CG 4.04Å; Y405-L409 WeakPolarHBondContact O-CG 3.42Å; Y405-L409 PolarHBondContact O-N 3.44Å
406	E	86.5	Confident	84.4	Confident	29 Å²	29	59.9 Å²	59.9	14%	0.136	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-40.7	173.9	-80.6	-174.9	-177.1	0	0	112.3	D402 D403 F404 L409 R410	D402-E406 WeakPolarHBondContact O-CB 3.33Å; D402-E406 VanDerWaalsContact O-CG 3.29Å; D402-E406 WeakPolarHBondContact O-CG 3.01Å; D402-E406 PolarHBondContact O-N 2.92Å; D403-E406 PolarHBondContact O-N 3.31Å; F404-E406 VanDerWaalsContact C-N 3.32Å; F404-E406 PolarHBondContact O-N 3.41Å; E406-L409 PolarHBondContact O-N 3.34Å; E406-R410 VanDerWaalsContact O-CG 3.24Å; E406-R410 WeakPolarHBondContact O-CG 3.22Å; E406-R410 PolarHBondContact O-N 3.42Å
407	Q	86.4	Confident	83.4	Confident	117 Å²	117	53.9 Å²	53.9	55%	0.547	26%	0.256	S	S	.	.	H	α-helix	trans	-61.4	-45.4	175.8	-71.6	173.5	1	0	0	111.6	D403 F404 Y405 L409 R410 E411	D403-Q407 WeakPolarHBondContact O-CG 3.5Å; D403-Q407 PolarHBondContact O-N 3.42Å; F404-Q407 WeakPolarHBondContact O-CB 3.46Å; F404-Q407 PolarHBondContact O-N 3.46Å; F404-Q407 VanDerWaalsContact O-N 3.08Å; Y405-Q407 VanDerWaalsContact C-N 3.35Å; Y405-Q407 PolarHBondContact O-N 3.16Å; Q407-L409 VanDerWaalsContact C-N 3.32Å; Q407-L409 PolarHBondContact O-N 3.21Å; Q407-R410 WeakPolarHBondContact O-CB 3.11Å; Q407-R410 PolarHBondContact O-N 3.07Å; Q407-R410 VanDerWaalsContact O-N 3.13Å; Q407-E411 PolarHBondContact O-N 3.32Å
408	L	86.2	Confident	82.3	Confident	19 Å²	19	51.5 Å²	51.5	10%	0.099	26%	0.262	C	S	.	.	H	α-helix	trans	-60.5	-40.5	175.9	-68.7	-176.7	0	0	0	112.4	L189 R192 F404 Y405 R410 E411 L412	L189-L408 HydrophobicContact CD1-CB 3.85Å; L189-L408 HydrophobicContact CD1-CD1 4.11Å; L189-L408 HydrophobicContact CD1-CD2 3.72Å; L189-L408 HydrophobicContact CD1-CG 4.09Å; R192-L408 HydrophobicContact CG-CD1 3.79Å; F404-L408 HydrophobicContact CD1-CD1 4.08Å; F404-L408 HydrophobicContact CD1-CG 4.47Å; F404-L408 HydrophobicContact CE1-CD1 3.65Å; F404-L408 HydrophobicContact CE1-CD2 4.4Å; F404-L408 HydrophobicContact CE1-CG 4.13Å; F404-L408 HydrophobicContact CE2-CD2 4.08Å; F404-L408 HydrophobicContact CE2-CG 4.25Å; F404-L408 HydrophobicContact CZ-CD1 3.96Å; F404-L408 HydrophobicContact CZ-CD2 3.83Å; F404-L408 HydrophobicContact CZ-CG 4Å; F404-L408 WeakPolarHBondContact O-CG 3.15Å; F404-L408 PolarHBondContact O-N 3.13Å; Y405-L408 PolarHBondContact O-N 3.46Å; L408-R410 VanDerWaalsContact C-N 3.34Å; L408-E411 PolarHBondContact O-N 3.43Å; L408-L412 WeakPolarHBondContact O-CB 3.4Å; L408-L412 PolarHBondContact O-N 3.41Å
409	L	86.6	Confident	80.7	Confident	34 Å²	34	54.8 Å²	54.8	18%	0.178	28%	0.28	C	S	.	.	H	α-helix	trans	-64.4	-40	174.5	-74.9	178.8	0	0	0	112.1	I193 Y405 E406 Q407 L412 I413	I193-L409 HydrophobicContact CD1-CD2 3.85Å; I193-L409 HydrophobicContact CG1-CD2 4.07Å; I193-L409 HydrophobicContact CG2-CD2 4.19Å; Y405-L409 HydrophobicContact CD1-CD1 4.07Å; Y405-L409 HydrophobicContact CD2-CG 4.49Å; Y405-L409 HydrophobicContact CE1-CD1 3.45Å; Y405-L409 VanDerWaalsContact CE1-CD1 3.45Å; Y405-L409 HydrophobicContact CE1-CG 4.16Å; Y405-L409 HydrophobicContact CE2-CD1 4.21Å; Y405-L409 HydrophobicContact CE2-CD2 4.21Å; Y405-L409 HydrophobicContact CE2-CG 4.04Å; Y405-L409 WeakPolarHBondContact O-CG 3.42Å; Y405-L409 PolarHBondContact O-N 3.44Å; E406-L409 PolarHBondContact O-N 3.34Å; Q407-L409 VanDerWaalsContact C-N 3.32Å; Q407-L409 PolarHBondContact O-N 3.21Å; L409-L412 PolarHBondContact O-N 3.04Å; L409-I413 WeakPolarHBondContact O-CB 3.33Å; L409-I413 WeakPolarHBondContact O-CD1 3.5Å; L409-I413 WeakPolarHBondContact O-CG1 3.07Å; L409-I413 PolarHBondContact O-N 3.4Å
410	R	82.9	Confident	78.8	Confident	66 Å²	66	52.5 Å²	52.5	25%	0.249	27%	0.274	C	S	.	.	H	α-helix	trans	-63.2	-49.4	176.1	-68.5	179.1	-174.4	-162.2	8.2	110.4	E406 Q407 L408 L412 I413 H414 L433	E406-R410 VanDerWaalsContact O-CG 3.24Å; E406-R410 WeakPolarHBondContact O-CG 3.22Å; E406-R410 PolarHBondContact O-N 3.42Å; Q407-R410 WeakPolarHBondContact O-CB 3.11Å; Q407-R410 PolarHBondContact O-N 3.07Å; Q407-R410 VanDerWaalsContact O-N 3.13Å; L408-R410 VanDerWaalsContact C-N 3.34Å; R410-L412 VanDerWaalsContact C-N 3.33Å; R410-L412 PolarHBondContact O-N 3.28Å; R410-I413 PolarHBondContact O-N 3.16Å; R410-H414 WeakPolarHBondContact O-CB 3.35Å; R410-H414 PolarHBondContact O-CD2 3.27Å; R410-H414 PolarHBondContact O-N 2.95Å; R410-L433 HydrophobicContact CB-CD1 4.29Å; R410-L433 VanDerWaalsContact CD-CD1 3.49Å; R410-L433 HydrophobicContact CG-CD1 3.38Å
411	E	80.4	Confident	77.3	Confident	97 Å²	97	59 Å²	59	45%	0.453	31%	0.314	S	S	.	.	H	α-helix	trans	-57.2	-46.7	177.6	-171.8	-174.4	158.9	0	0	111.3	Q407 L408 I413 H414 R415	Q407-E411 PolarHBondContact O-N 3.32Å; L408-E411 PolarHBondContact O-N 3.43Å; E411-I413 VanDerWaalsContact C-N 3.35Å; E411-I413 PolarHBondContact O-N 2.78Å; E411-H414 PolarHBondContact O-N 3.05Å; E411-R415 HydrophobicContact CG-CG 4.42Å; E411-R415 WeakPolarHBondContact O-CB 3.08Å; E411-R415 VanDerWaalsContact O-CG 3.26Å; E411-R415 WeakPolarHBondContact O-CG 3.46Å; E411-R415 PolarHBondContact O-N 3.47Å
412	L	82.4	Confident	75.8	Confident	55 Å²	55	61.7 Å²	61.7	29%	0.288	33%	0.328	S	S	.	.	H	α-helix	trans	-59.7	-45.2	176.6	-178.2	66.9	0	0	0	111.9	L189 I193 L408 L409 R410 S416	L189-L412 HydrophobicContact CD2-CB 3.97Å; L189-L412 HydrophobicContact CD2-CD1 4.05Å; I193-L412 HydrophobicContact CD1-CD2 3.45Å; I193-L412 VanDerWaalsContact CD1-CD2 3.45Å; L408-L412 WeakPolarHBondContact O-CB 3.4Å; L408-L412 PolarHBondContact O-N 3.41Å; L409-L412 PolarHBondContact O-N 3.04Å; R410-L412 VanDerWaalsContact C-N 3.33Å; R410-L412 PolarHBondContact O-N 3.28Å; L412-S416 WeakPolarHBondContact O-CB 3.42Å; L412-S416 PolarHBondContact O-N 3.19Å; L412-S416 PolarHBondContact O-OG 2.89Å
413	I	80.2	Confident	74.9	Confident	41 Å²	41	65 Å²	65	21%	0.21	35%	0.351	C	S	.	.	H	α-helix	trans	-62.1	-55.5	177.6	-69.3	165.1	0	0	0	109	L409 R410 E411 R415 S416 T417 Q429	L409-I413 WeakPolarHBondContact O-CB 3.33Å; L409-I413 WeakPolarHBondContact O-CD1 3.5Å; L409-I413 WeakPolarHBondContact O-CG1 3.07Å; L409-I413 PolarHBondContact O-N 3.4Å; R410-I413 PolarHBondContact O-N 3.16Å; E411-I413 VanDerWaalsContact C-N 3.35Å; E411-I413 PolarHBondContact O-N 2.78Å; I413-R415 VanDerWaalsContact C-N 3.29Å; I413-R415 PolarHBondContact O-N 3.09Å; I413-S416 CarbonylContact O-C 3.56Å; I413-S416 WeakPolarHBondContact O-CA 3.44Å; I413-S416 WeakPolarHBondContact O-CB 3.48Å; I413-S416 PolarHBondContact O-N 2.84Å; I413-S416 PolarHBondContact O-OG 3.23Å; I413-T417 PolarHBondContact O-N 3.25Å; I413-T417 PolarHBondContact O-OG1 3.17Å; I413-Q429 HydrophobicContact CG2-CB 4.16Å; I413-Q429 HydrophobicContact CG2-CG 4.4Å
414	H	77	Confident	74.4	Confident	107 Å²	107	69.5 Å²	69.5	50%	0.495	38%	0.375	S	S	.	.	H	α-helix	trans	-54.3	-43.3	-179.9	-75.9	-67.5	0	0	0	112.6	R410 E411 S416 T417 G418	R410-H414 WeakPolarHBondContact O-CB 3.35Å; R410-H414 PolarHBondContact O-CD2 3.27Å; R410-H414 PolarHBondContact O-N 2.95Å; E411-H414 PolarHBondContact O-N 3.05Å; H414-S416 VanDerWaalsContact C-N 3.34Å; H414-S416 PolarHBondContact O-N 3.07Å; H414-T417 PolarHBondContact O-N 3.28Å; H414-G418 PolarHBondContact O-N 2.99Å
415	R	74.6	Confident	73.5	Confident	56 Å²	56	67.2 Å²	67.2	21%	0.211	37%	0.368	C	S	.	.	H	α-helix	trans	-64.7	-36.1	175.7	-71.3	-179.1	69.4	-124.4	-13.7	112.6	E186 E411 I413 N419	E186-R415 IonicContact OE1-CZ 3.09Å; E186-R415 IonicContact OE1-NH1 3.39Å; E186-R415 IonicContact OE1-NH2 3.97Å; E186-R415 PolarHBondContact OE1-NH2 2.97Å; E411-R415 HydrophobicContact CG-CG 4.42Å; E411-R415 WeakPolarHBondContact O-CB 3.08Å; E411-R415 VanDerWaalsContact O-CG 3.26Å; E411-R415 WeakPolarHBondContact O-CG 3.46Å; E411-R415 PolarHBondContact O-N 3.47Å; I413-R415 VanDerWaalsContact C-N 3.29Å; I413-R415 PolarHBondContact O-N 3.09Å; R415-N419 PolarHBondContact O-OD1 3.43Å
416	S	69.8	Low	72.3	Confident	65 Å²	65	70.1 Å²	70.1	46%	0.455	38%	0.384	S	S	.	.	H	α-helix	trans	-74.2	-29.1	173.3	74.8	0	0	0	0	113.2	L412 I413 H414	L412-S416 WeakPolarHBondContact O-CB 3.42Å; L412-S416 PolarHBondContact O-N 3.19Å; L412-S416 PolarHBondContact O-OG 2.89Å; I413-S416 CarbonylContact O-C 3.56Å; I413-S416 WeakPolarHBondContact O-CA 3.44Å; I413-S416 WeakPolarHBondContact O-CB 3.48Å; I413-S416 PolarHBondContact O-N 2.84Å; I413-S416 PolarHBondContact O-OG 3.23Å; H414-S416 VanDerWaalsContact C-N 3.34Å; H414-S416 PolarHBondContact O-N 3.07Å
417	T	66.4	Low	71.5	Confident	19 Å²	19	70.6 Å²	70.6	12%	0.117	40%	0.397	C	S	.	.	H	α-helix	trans	-78.9	-32.7	-179.5	-39.7	0	0	0	0	112.6	I413 H414 N419 C420 Q426 Q429	I413-T417 PolarHBondContact O-N 3.25Å; I413-T417 PolarHBondContact O-OG1 3.17Å; H414-T417 PolarHBondContact O-N 3.28Å; T417-N419 PolarHBondContact O-N 3.44Å; T417-C420 PolarHBondContact O-N 3.35Å; T417-Q426 HydrophobicContact CG2-CB 4.41Å; T417-Q426 HydrophobicContact CG2-CG 4.19Å; T417-Q429 VanDerWaalsContact CG2-OE1 3.25Å; T417-Q429 PolarHBondContact OG1-OE1 3.19Å
418	G	63.2	Low	70.9	Confident	61 Å²	61	74 Å²	74	63%	0.629	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-16.5	177.2	0	0	0	0	0	113.6	H414	H414-G418 PolarHBondContact O-N 2.99Å
419	N	55.4	Low	69.9	Low	76 Å²	76	75 Å²	75	41%	0.406	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.5	-9.2	175.5	-68	68.7	0	0	0	114.2	D80 R82 R415 T417	D80-N419 PolarHBondContact OD1-ND2 3.4Å; R82-N419 WeakPolarHBondContact CD-OD1 3.42Å; R82-N419 PolarHBondContact NE-ND2 3.31Å; R82-N419 PolarHBondContact NH1-OD1 3.28Å; R415-N419 PolarHBondContact O-OD1 3.43Å; T417-N419 PolarHBondContact O-N 3.44Å
420	C	50.9	Low	69	Low	41 Å²	41	80.8 Å²	80.8	28%	0.277	43%	0.428	S	S	.	.			trans	-105.6	101.8	-176.8	-166	0	0	0	0	110.2	T417 D422 V425	T417-C420 PolarHBondContact O-N 3.35Å; C420-D422 PolarHBondContact O-N 2.96Å; C420-V425 VanDerWaalsContact SG-CB 3.53Å
421	T	56.5	Low	68.4	Low	137 Å²	137	79.6 Å²	79.6	84%	0.84	43%	0.432	S	S	*	.			trans	-74.5	-3.6	176.1	52.9	0	0	0	0	113.6	P423	T421-P423 VanDerWaalsContact O-CD 3.28Å; T421-P423 WeakPolarHBondContact O-CD 3.39Å
422	D	59.3	Low	68.1	Low	69 Å²	69	81 Å²	81	37%	0.369	44%	0.437	S	S	.	.			trans	-84.2	112.9	-177.2	-173.5	-9.5	0	0	0	111.4	C420 L424 V425 Q426	C420-D422 PolarHBondContact O-N 2.96Å; D422-L424 PolarHBondContact O-N 3.25Å; D422-L424 VanDerWaalsContact O-N 3.11Å; D422-L424 WeakPolarHBondContact OD1-CB 3.43Å; D422-L424 PolarHBondContact OD1-N 2.9Å; D422-V425 HydrophobicContact CB-CG2 4.17Å; D422-V425 PolarHBondContact O-N 3.44Å; D422-V425 VanDerWaalsContact O-N 3.12Å; D422-Q426 PolarHBondContact O-N 2.97Å
423	P	68.2	Low	67.5	Low	96 Å²	96	79.2 Å²	79.2	62%	0.623	43%	0.428	S	S	*	.	H	α-helix	trans	-57.2	-27.7	-179.8	-24.6	35.5	0	0	0	113.9	T421 G427	T421-P423 VanDerWaalsContact O-CD 3.28Å; T421-P423 WeakPolarHBondContact O-CD 3.39Å; P423-G427 PolarHBondContact O-N 2.95Å
424	L	74.6	Confident	67	Low	124 Å²	124	79.9 Å²	79.9	65%	0.649	43%	0.43	S	S	*	.	H	α-helix	trans	-69.9	-37.8	-179.8	-72.4	160.4	0	0	0	111.9	D422 R428	D422-L424 PolarHBondContact O-N 3.25Å; D422-L424 VanDerWaalsContact O-N 3.11Å; D422-L424 WeakPolarHBondContact OD1-CB 3.43Å; D422-L424 PolarHBondContact OD1-N 2.9Å; L424-R428 WeakPolarHBondContact O-CG 3.21Å; L424-R428 PolarHBondContact O-N 2.93Å; L424-R428 VanDerWaalsContact O-N 3.11Å
425	V	67.8	Low	66.6	Low	49 Å²	49	80.4 Å²	80.4	30%	0.297	43%	0.431	S	S	.	.	H	α-helix	trans	-72	-43.3	177.3	179.1	0	0	0	0	109.8	C420 D422 G427 R428 Q429	C420-V425 VanDerWaalsContact SG-CB 3.53Å; D422-V425 HydrophobicContact CB-CG2 4.17Å; D422-V425 PolarHBondContact O-N 3.44Å; D422-V425 VanDerWaalsContact O-N 3.12Å; V425-G427 VanDerWaalsContact C-N 3.32Å; V425-G427 PolarHBondContact O-N 3.06Å; V425-R428 PolarHBondContact O-N 2.92Å; V425-Q429 WeakPolarHBondContact O-CG 3.35Å; V425-Q429 PolarHBondContact O-N 3.38Å
426	Q	63.8	Low	66.1	Low	115 Å²	115	79.2 Å²	79.2	54%	0.537	43%	0.429	S	S	.	.	H	α-helix	trans	-57.7	-44.5	173.4	-167.7	-179.9	6.4	0	0	111.1	T417 D422 R428 Q429 W430	T417-Q426 HydrophobicContact CG2-CB 4.41Å; T417-Q426 HydrophobicContact CG2-CG 4.19Å; D422-Q426 PolarHBondContact O-N 2.97Å; Q426-R428 PolarHBondContact O-N 3.41Å; Q426-Q429 PolarHBondContact O-N 3.23Å; Q426-W430 WeakPolarHBondContact O-CB 3.48Å; Q426-W430 PolarHBondContact O-N 3Å
427	G	68.7	Low	65.7	Low	39 Å²	39	81.9 Å²	81.9	40%	0.402	43%	0.429	S	S	.	.	H	α-helix	trans	-62	-41.9	176.4	0	0	0	0	0	113.7	P423 V425 Q429 A431	P423-G427 PolarHBondContact O-N 2.95Å; V425-G427 VanDerWaalsContact C-N 3.32Å; V425-G427 PolarHBondContact O-N 3.06Å; G427-Q429 VanDerWaalsContact C-N 3.33Å; G427-Q429 PolarHBondContact O-N 3.46Å; G427-A431 WeakPolarHBondContact O-CB 3.27Å; G427-A431 PolarHBondContact O-N 3.22Å
428	R	74.6	Confident	65.2	Low	188 Å²	188	84 Å²	84	71%	0.709	44%	0.441	S	S	*	.	H	α-helix	trans	-64.6	-37	174.9	-72.2	178.7	-167.9	-136.5	4.2	112.1	L424 V425 Q426 K432	L424-R428 WeakPolarHBondContact O-CG 3.21Å; L424-R428 PolarHBondContact O-N 2.93Å; L424-R428 VanDerWaalsContact O-N 3.11Å; V425-R428 PolarHBondContact O-N 2.92Å; Q426-R428 PolarHBondContact O-N 3.41Å; R428-K432 WeakPolarHBondContact O-CG 3.46Å; R428-K432 PolarHBondContact O-N 3.41Å; R428-K432 VanDerWaalsContact O-N 3.09Å
429	Q	64.4	Low	65	Low	39 Å²	39	87.7 Å²	87.7	18%	0.182	44%	0.44	C	S	.	.	H	α-helix	trans	-77.5	-38.5	179.8	-69.6	-179.4	-3.8	0	0	112.3	I413 T417 V425 Q426 G427 A431 K432 L433	I413-Q429 HydrophobicContact CG2-CB 4.16Å; I413-Q429 HydrophobicContact CG2-CG 4.4Å; T417-Q429 VanDerWaalsContact CG2-OE1 3.25Å; T417-Q429 PolarHBondContact OG1-OE1 3.19Å; V425-Q429 WeakPolarHBondContact O-CG 3.35Å; V425-Q429 PolarHBondContact O-N 3.38Å; Q426-Q429 PolarHBondContact O-N 3.23Å; G427-Q429 VanDerWaalsContact C-N 3.33Å; G427-Q429 PolarHBondContact O-N 3.46Å; Q429-A431 VanDerWaalsContact C-N 3.26Å; Q429-A431 PolarHBondContact O-N 3.13Å; Q429-K432 CarbonylContact O-C 3.57Å; Q429-K432 WeakPolarHBondContact O-CA 3.12Å; Q429-K432 WeakPolarHBondContact O-CB 3.32Å; Q429-K432 PolarHBondContact O-N 3.39Å; Q429-L433 PolarHBondContact O-N 2.83Å
430	W	67.9	Low	65	Low	156 Å²	156	90.1 Å²	90.1	59%	0.591	44%	0.444	S	S	*	.	H	α-helix	trans	-59.9	-39	169.5	-166.7	91.8	0	0	0	111	Q426 K432 L433 Q434	Q426-W430 WeakPolarHBondContact O-CB 3.48Å; Q426-W430 PolarHBondContact O-N 3Å; W430-K432 PolarHBondContact O-N 2.9Å; W430-L433 WeakPolarHBondContact O-CB 3.31Å; W430-L433 PolarHBondContact O-N 2.89Å; W430-Q434 HydrophobicContact CD2-CG 3.9Å; W430-Q434 HydrophobicContact CE3-CG 3.58Å; W430-Q434 HydrophobicContact CH2-CG 3.76Å; W430-Q434 HydrophobicContact CZ2-CG 4.06Å; W430-Q434 HydrophobicContact CZ3-CG 3.51Å; W430-Q434 WeakPolarHBondContact O-CB 3.45Å; W430-Q434 WeakPolarHBondContact O-CG 3.38Å; W430-Q434 PolarHBondContact O-N 3.34Å
431	A	71.2	Confident	65	Low	41 Å²	41	97 Å²	97	34%	0.339	47%	0.469	S	S	.	.	H	α-helix	trans	-63.4	-36.8	170.8	0	0	0	0	0	112.9	G427 Q429 K435	G427-A431 WeakPolarHBondContact O-CB 3.27Å; G427-A431 PolarHBondContact O-N 3.22Å; Q429-A431 VanDerWaalsContact C-N 3.26Å; Q429-A431 PolarHBondContact O-N 3.13Å; A431-K435 WeakPolarHBondContact O-CB 3.36Å; A431-K435 VanDerWaalsContact O-CG 3.26Å; A431-K435 WeakPolarHBondContact O-CG 3.38Å; A431-K435 PolarHBondContact O-N 3Å
432	K	73.2	Confident	64.7	Low	126 Å²	126	99.4 Å²	99.4	55%	0.548	46%	0.463	S	S	.	.	H	α-helix	trans	-64.7	-43.3	171.2	-71.9	176.7	-178.5	-179.9	0	111.3	R428 Q429 W430 K435 L436	R428-K432 WeakPolarHBondContact O-CG 3.46Å; R428-K432 PolarHBondContact O-N 3.41Å; R428-K432 VanDerWaalsContact O-N 3.09Å; Q429-K432 CarbonylContact O-C 3.57Å; Q429-K432 WeakPolarHBondContact O-CA 3.12Å; Q429-K432 WeakPolarHBondContact O-CB 3.32Å; Q429-K432 PolarHBondContact O-N 3.39Å; W430-K432 PolarHBondContact O-N 2.9Å; K432-K435 WeakPolarHBondContact O-CB 3.48Å; K432-K435 PolarHBondContact O-N 2.91Å; K432-L436 PolarHBondContact O-N 3.49Å
433	L	69.4	Low	64.4	Low	18 Å²	18	103.4 Å²	103.4	9%	0.094	48%	0.477	C	S	.	.	H	α-helix	trans	-62.1	-45.1	177.2	-177.2	62.7	0	0	0	111.8	R410 Q429 W430 K435 L436 R437	R410-L433 HydrophobicContact CB-CD1 4.29Å; R410-L433 VanDerWaalsContact CD-CD1 3.49Å; R410-L433 HydrophobicContact CG-CD1 3.38Å; Q429-L433 PolarHBondContact O-N 2.83Å; W430-L433 WeakPolarHBondContact O-CB 3.31Å; W430-L433 PolarHBondContact O-N 2.89Å; L433-K435 VanDerWaalsContact C-N 3.33Å; L433-K435 PolarHBondContact O-N 3.43Å; L433-L436 WeakPolarHBondContact O-CB 3.37Å; L433-L436 PolarHBondContact O-N 3.16Å; L433-R437 WeakPolarHBondContact O-CG 3.22Å; L433-R437 PolarHBondContact O-N 2.73Å
434	Q	70.6	Confident	63.5	Low	55 Å²	55	104 Å²	104	26%	0.257	48%	0.479	S	S	.	.	H	α-helix	trans	-62	-39.9	173.3	-72.7	-62.5	-15.5	0	0	111.7	W430 L436 R437 T438	W430-Q434 HydrophobicContact CD2-CG 3.9Å; W430-Q434 HydrophobicContact CE3-CG 3.58Å; W430-Q434 HydrophobicContact CH2-CG 3.76Å; W430-Q434 HydrophobicContact CZ2-CG 4.06Å; W430-Q434 HydrophobicContact CZ3-CG 3.51Å; W430-Q434 WeakPolarHBondContact O-CB 3.45Å; W430-Q434 WeakPolarHBondContact O-CG 3.38Å; W430-Q434 PolarHBondContact O-N 3.34Å; Q434-L436 PolarHBondContact O-N 2.98Å; Q434-R437 WeakPolarHBondContact O-CB 3.35Å; Q434-R437 PolarHBondContact O-N 2.74Å; Q434-R437 VanDerWaalsContact O-N 3.14Å; Q434-T438 WeakPolarHBondContact O-CG2 3.5Å; Q434-T438 PolarHBondContact O-N 2.99Å; Q434-T438 PolarHBondContact O-OG1 3.13Å
435	K	67.9	Low	62.6	Low	119 Å²	119	102.6 Å²	102.6	52%	0.517	48%	0.475	S	S	.	.	H	α-helix	trans	-61.1	-42.8	174.4	-76.3	173.6	-176.4	-177.6	0	111.8	A431 K432 L433 R437 T438 K439	A431-K435 WeakPolarHBondContact O-CB 3.36Å; A431-K435 VanDerWaalsContact O-CG 3.26Å; A431-K435 WeakPolarHBondContact O-CG 3.38Å; A431-K435 PolarHBondContact O-N 3Å; K432-K435 WeakPolarHBondContact O-CB 3.48Å; K432-K435 PolarHBondContact O-N 2.91Å; L433-K435 VanDerWaalsContact C-N 3.33Å; L433-K435 PolarHBondContact O-N 3.43Å; K435-R437 VanDerWaalsContact C-N 3.34Å; K435-R437 PolarHBondContact O-N 2.89Å; K435-T438 WeakPolarHBondContact CA-OG1 3.5Å; K435-T438 PolarHBondContact O-N 3.08Å; K435-T438 PolarHBondContact O-OG1 3.1Å; K435-K439 WeakPolarHBondContact O-CG 3.41Å; K435-K439 PolarHBondContact O-N 3.3Å; K435-K439 VanDerWaalsContact O-N 3.08Å
436	L	64	Low	62	Low	31 Å²	31	104.7 Å²	104.7	16%	0.162	48%	0.484	C	S	.	.	H	α-helix	trans	-58.6	-44.4	172.4	-66.6	171.3	0	0	0	111.1	K432 L433 Q434 T438 K439	K432-L436 PolarHBondContact O-N 3.49Å; L433-L436 WeakPolarHBondContact O-CB 3.37Å; L433-L436 PolarHBondContact O-N 3.16Å; Q434-L436 PolarHBondContact O-N 2.98Å; L436-T438 PolarHBondContact O-N 2.81Å; L436-K439 PolarHBondContact O-N 3.23Å
437	R	61.2	Low	61.6	Low	121 Å²	121	110.1 Å²	110.1	46%	0.457	50%	0.5	S	S	.	.	H	α-helix	trans	-59.2	-41.9	174.2	-66.6	172.3	113.4	149.6	1.4	112.8	L433 Q434 K435 K441	L433-R437 WeakPolarHBondContact O-CG 3.22Å; L433-R437 PolarHBondContact O-N 2.73Å; Q434-R437 WeakPolarHBondContact O-CB 3.35Å; Q434-R437 PolarHBondContact O-N 2.74Å; Q434-R437 VanDerWaalsContact O-N 3.14Å; K435-R437 VanDerWaalsContact C-N 3.34Å; K435-R437 PolarHBondContact O-N 2.89Å; R437-K441 PolarHBondContact O-N 3.47Å
438	T	56.7	Low	61.1	Low	62 Å²	62	114.8 Å²	114.8	38%	0.38	51%	0.506	S	S	.	.	H	α-helix	trans	-73	-29.5	-177.7	61	0	0	0	0	113.7	Q434 K435 L436 R440 K441 R442	Q434-T438 WeakPolarHBondContact O-CG2 3.5Å; Q434-T438 PolarHBondContact O-N 2.99Å; Q434-T438 PolarHBondContact O-OG1 3.13Å; K435-T438 WeakPolarHBondContact CA-OG1 3.5Å; K435-T438 PolarHBondContact O-N 3.08Å; K435-T438 PolarHBondContact O-OG1 3.1Å; L436-T438 PolarHBondContact O-N 2.81Å; T438-R440 PolarHBondContact O-N 3.37Å; T438-K441 PolarHBondContact O-N 2.87Å; T438-R442 WeakPolarHBondContact O-CG 3.41Å; T438-R442 PolarHBondContact O-N 3.16Å
439	K	58.2	Low	60.2	Low	140 Å²	140	109.8 Å²	109.8	61%	0.609	51%	0.505	S	S	*	.	H	α-helix	trans	-62.5	-41.6	177.4	-74.5	-176.8	-179.3	-173.8	0	111.6	K435 L436 R442	K435-K439 WeakPolarHBondContact O-CG 3.41Å; K435-K439 PolarHBondContact O-N 3.3Å; K435-K439 VanDerWaalsContact O-N 3.08Å; L436-K439 PolarHBondContact O-N 3.23Å; K439-R442 PolarHBondContact O-N 3.13Å
440	R	55.3	Low	60	Low	127 Å²	127	113.5 Å²	113.5	48%	0.479	54%	0.535	S	S	.	.	H	α-helix	trans	-66	-38.3	171.8	-95.5	-174.9	167.3	-137.8	-13	114	D403 T438 R442	D403-R440 VanDerWaalsContact CG-NH2 3.26Å; D403-R440 IonicContact OD2-CZ 3.33Å; D403-R440 IonicContact OD2-NH2 2.71Å; D403-R440 PolarHBondContact OD2-NH2 2.95Å; T438-R440 PolarHBondContact O-N 3.37Å; R440-R442 VanDerWaalsContact C-N 3.26Å; R440-R442 PolarHBondContact O-N 2.8Å
441	K	52.3	Low	59.5	Low	184 Å²	184	115.2 Å²	115.2	80%	0.8	55%	0.546	S	S	*	.	H	α-helix	trans	-74.4	-15.6	178.7	-71.4	-163.5	-179.3	-172.6	0	113.5	R437 T438 K443	R437-K441 PolarHBondContact O-N 3.47Å; T438-K441 PolarHBondContact O-N 2.87Å; K441-K443 PolarHBondContact O-N 3.43Å
442	R	50.5	Low	59	Low	188 Å²	188	115.3 Å²	115.3	71%	0.709	55%	0.551	S	S	*	*			trans	-75.3	65.9	165.8	-70.4	178.2	-173.7	173	2.8	109.5	T438 K439 R440 T444	T438-R442 WeakPolarHBondContact O-CG 3.41Å; T438-R442 PolarHBondContact O-N 3.16Å; K439-R442 PolarHBondContact O-N 3.13Å; R440-R442 VanDerWaalsContact C-N 3.26Å; R440-R442 PolarHBondContact O-N 2.8Å; R442-T444 PolarHBondContact O-N 2.94Å
443	K	51.1	Low	58.4	Low	154 Å²	154	119.1 Å²	119.1	67%	0.67	56%	0.562	S	S	*	*			trans	-45.5	130.4	139.1	-70.7	-174.4	178.9	-168.8	0	104.6	K441 V445	K441-K443 PolarHBondContact O-N 3.43Å; K443-V445 HydrophobicContact CB-CG2 3.67Å; K443-V445 PolarHBondContact O-N 3.24Å
444	T	50.5	Low	58	Low	108 Å²	108	121 Å²	121	66%	0.663	58%	0.581	S	S	*	*			trans	-68.4	68.6	161.7	-59.6	0	0	0	0	105.8	R442 D446	R442-T444 PolarHBondContact O-N 2.94Å; T444-D446 PolarHBondContact O-N 3.44Å; T444-D446 VanDerWaalsContact O-N 3.11Å
445	V	56.1	Low	57.9	Low	95 Å²	95	125.8 Å²	125.8	58%	0.576	61%	0.606	S	S	*	*			trans	-57.3	117.2	163.8	-179.4	0	0	0	0	102.4	K443 R447	K443-V445 HydrophobicContact CB-CG2 3.67Å; K443-V445 PolarHBondContact O-N 3.24Å; V445-R447 PolarHBondContact O-N 3Å
446	D	54.3	Low	58.1	Low	92 Å²	92	130.3 Å²	130.3	49%	0.492	62%	0.62	S	S	.	*			trans	-45.7	105.4	-179.7	-174.2	7.6	0	0	0	109.1	T444 R448 A449	T444-D446 PolarHBondContact O-N 3.44Å; T444-D446 VanDerWaalsContact O-N 3.11Å; D446-R448 PolarHBondContact O-N 2.94Å; D446-R448 WeakPolarHBondContact OD1-CB 3.46Å; D446-R448 PolarHBondContact OD1-N 3.19Å; D446-A449 PolarHBondContact O-N 3.08Å; D446-A449 VanDerWaalsContact O-N 3.09Å
447	R	55.5	Low	58.7	Low	229 Å²	229	138 Å²	138	86%	0.864	65%	0.648	S	S	*	*	G	3₁₀ helix	trans	-66.5	-2.2	-176.5	-72.8	-176.1	65.7	-172.9	0.1	111.6	V445 A449	V445-R447 PolarHBondContact O-N 3Å; R447-A449 PolarHBondContact O-N 3.35Å; R447-A449 VanDerWaalsContact O-N 3.14Å
448	R	58.6	Low	59.7	Low	138 Å²	138	139.6 Å²	139.6	52%	0.521	66%	0.66	S	S	.	*	G	3₁₀ helix	trans	-65	0.2	164.6	-98.3	169.7	142	-178.2	-13.6	114.5	D446 S450 G452 R453	D446-R448 PolarHBondContact O-N 2.94Å; D446-R448 WeakPolarHBondContact OD1-CB 3.46Å; D446-R448 PolarHBondContact OD1-N 3.19Å; R448-S450 VanDerWaalsContact C-N 3.25Å; R448-S450 PolarHBondContact O-N 3.38Å; R448-G452 WeakPolarHBondContact CD-O 3Å; R448-G452 VanDerWaalsContact CG-O 3.3Å; R448-G452 WeakPolarHBondContact CG-O 3.44Å; R448-G452 VanDerWaalsContact CZ-O 3.29Å; R448-G452 PolarHBondContact NE-O 3Å; R448-G452 PolarHBondContact NH2-O 3.36Å; R448-R453 PolarHBondContact O-N 3.48Å
449	A	56.3	Low	61	Low	83 Å²	83	140.4 Å²	140.4	69%	0.686	67%	0.665	S	S	*	*	G	3₁₀ helix	trans	-62	-22	174.9	0	0	0	0	0	115	D446 R447	D446-A449 PolarHBondContact O-N 3.08Å; D446-A449 VanDerWaalsContact O-N 3.09Å; R447-A449 PolarHBondContact O-N 3.35Å; R447-A449 VanDerWaalsContact O-N 3.14Å
450	S	59.3	Low	62.4	Low	117 Å²	117	138.8 Å²	138.8	82%	0.818	66%	0.662	S	S	*	*	S	Bend	trans	-102.9	-16.7	177	60.7	0	0	0	0	115.5	R448	R448-S450 VanDerWaalsContact C-N 3.25Å; R448-S450 PolarHBondContact O-N 3.38Å
451	K	58.3	Low	64	Low	192 Å²	192	137.7 Å²	137.7	84%	0.835	67%	0.674	S	S	*	*	S	Bend	trans	-164.6	118.7	170.9	-147.5	168.9	179.8	176.5	0	110.9
452	G	60.6	Low	65.7	Low	43 Å²	43	138.1 Å²	138.1	44%	0.443	68%	0.676	S	S	.	*			trans	96.5	38.5	173.9	0	0	0	0	0	115.8	R448 A454	R448-G452 WeakPolarHBondContact CD-O 3Å; R448-G452 VanDerWaalsContact CG-O 3.3Å; R448-G452 WeakPolarHBondContact CG-O 3.44Å; R448-G452 VanDerWaalsContact CZ-O 3.29Å; R448-G452 PolarHBondContact NE-O 3Å; R448-G452 PolarHBondContact NH2-O 3.36Å; G452-A454 PolarHBondContact O-N 2.65Å
453	R	60.1	Low	67.3	Low	206 Å²	206	134 Å²	134	78%	0.777	67%	0.667	S	S	*	*			trans	-36.6	130	173.1	-56.3	174.2	92.5	177.3	6.8	112	R448 I455	R448-R453 PolarHBondContact O-N 3.48Å; R453-I455 PolarHBondContact O-N 3.42Å
454	A	60.9	Low	68.9	Low	58 Å²	58	130.2 Å²	130.2	48%	0.479	66%	0.657	S	S	.	*			trans	-63.9	115.2	159.3	0	0	0	0	0	107.4	G452 R456	G452-A454 PolarHBondContact O-N 2.65Å; A454-R456 PolarHBondContact O-N 3.33Å; A454-R456 VanDerWaalsContact O-N 3.13Å
455	I	68.9	Low	70.5	Confident	154 Å²	154	132.1 Å²	132.1	79%	0.79	66%	0.663	S	S	*	*			trans	-67.6	113.3	174.5	-59.8	175.1	0	0	0	106.3	R453 Y457	R453-I455 PolarHBondContact O-N 3.42Å; I455-Y457 PolarHBondContact O-N 2.93Å
456	R	71.3	Confident	72	Confident	215 Å²	215	135.2 Å²	135.2	81%	0.811	67%	0.669	S	S	*	*			trans	-72.6	112.2	166.7	-66.9	-173.9	-177.3	-177.8	-0.7	107.2	A454 H458	A454-R456 PolarHBondContact O-N 3.33Å; A454-R456 VanDerWaalsContact O-N 3.13Å; R456-H458 PolarHBondContact O-N 2.86Å
457	Y	77.1	Confident	73.4	Confident	192 Å²	192	137.4 Å²	137.4	75%	0.753	68%	0.678	S	S	*	*			trans	-76.4	91.5	178	-175	-110.8	0	0	0	109.1	I455 V459	I455-Y457 PolarHBondContact O-N 2.93Å; Y457-V459 HydrophobicContact CD1-CG2 3.71Å; Y457-V459 HydrophobicContact CE1-CB 4.39Å; Y457-V459 HydrophobicContact CE1-CG2 3.07Å
458	H	82.3	Confident	74.8	Confident	154 Å²	154	130.6 Å²	130.6	71%	0.713	67%	0.67	S	S	*	*			trans	-90.5	110.6	164	-84.3	-79.7	0	0	0	108.5	R456 I460	R456-H458 PolarHBondContact O-N 2.86Å; H458-I460 PolarHBondContact O-N 3.13Å; H458-I460 VanDerWaalsContact O-N 3.12Å
459	V	84.3	Confident	76.1	Confident	80 Å²	80	130.3 Å²	130.3	49%	0.485	69%	0.687	S	S	.	*			trans	-66.2	110.6	173.7	-178.3	0	0	0	0	108.7	Y457 S461 V464	Y457-V459 HydrophobicContact CD1-CG2 3.71Å; Y457-V459 HydrophobicContact CE1-CB 4.39Å; Y457-V459 HydrophobicContact CE1-CG2 3.07Å; V459-S461 PolarHBondContact O-N 2.92Å; V459-V464 HydrophobicContact CG1-CG2 3.17Å
460	I	86.7	Confident	77.3	Confident	105 Å²	105	131.7 Å²	131.7	54%	0.538	68%	0.681	S	S	.	*			trans	-78.2	104.5	167.4	-60.1	172.8	0	0	0	106.7	H458 K462 L463 V464	H458-I460 PolarHBondContact O-N 3.13Å; H458-I460 VanDerWaalsContact O-N 3.12Å; I460-K462 HydrophobicContact CG2-CB 4.46Å; I460-K462 PolarHBondContact O-N 3.02Å; I460-K462 VanDerWaalsContact O-N 3.08Å; I460-L463 HydrophobicContact CB-CB 4.4Å; I460-L463 HydrophobicContact CB-CD1 4.14Å; I460-L463 HydrophobicContact CB-CG 4.35Å; I460-L463 HydrophobicContact CD1-CD1 4.05Å; I460-L463 HydrophobicContact CG2-CB 4.48Å; I460-L463 HydrophobicContact CG2-CD1 4.1Å; I460-L463 HydrophobicContact CG2-CG 4.05Å; I460-L463 PolarHBondContact O-N 3.47Å; I460-V464 PolarHBondContact O-N 3.29Å
461	S	88.6	Confident	78.3	Confident	104 Å²	104	131.2 Å²	131.2	73%	0.727	67%	0.67	S	S	*	*	G	3₁₀ helix	trans	-49.3	-39.6	-174.5	-175.9	0	0	0	0	113.5	V459 L463 V464	V459-S461 PolarHBondContact O-N 2.92Å; S461-L463 PolarHBondContact O-N 2.91Å; S461-V464 PolarHBondContact O-N 3.46Å
462	K	87.9	Confident	79.4	Confident	193 Å²	193	132.1 Å²	132.1	84%	0.839	67%	0.668	S	S	*	*	G	3₁₀ helix	trans	-64.9	-17.8	178.2	-63.9	-177.7	-179.2	179	0	115.1	I460	I460-K462 HydrophobicContact CG2-CB 4.46Å; I460-K462 PolarHBondContact O-N 3.02Å; I460-K462 VanDerWaalsContact O-N 3.08Å
463	L	84.1	Confident	80.2	Confident	102 Å²	102	132.8 Å²	132.8	53%	0.534	67%	0.665	S	S	.	*	G	3₁₀ helix	trans	-106.1	-4.6	-177.8	-63.9	177.9	0	0	0	113	I460 S461 N465 F466	I460-L463 HydrophobicContact CB-CB 4.4Å; I460-L463 HydrophobicContact CB-CD1 4.14Å; I460-L463 HydrophobicContact CB-CG 4.35Å; I460-L463 HydrophobicContact CD1-CD1 4.05Å; I460-L463 HydrophobicContact CG2-CB 4.48Å; I460-L463 HydrophobicContact CG2-CD1 4.1Å; I460-L463 HydrophobicContact CG2-CG 4.05Å; I460-L463 PolarHBondContact O-N 3.47Å; S461-L463 PolarHBondContact O-N 2.91Å; L463-N465 PolarHBondContact O-N 3.43Å; L463-F466 HydrophobicContact CD2-CG 4.41Å; L463-F466 WeakPolarHBondContact O-CB 3.36Å; L463-F466 PolarHBondContact O-N 3.5Å; L463-F466 VanDerWaalsContact O-N 3.17Å
464	V	84.3	Confident	81.3	Confident	74 Å²	74	133.4 Å²	133.4	45%	0.448	67%	0.673	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.5	125.9	175	-177.1	0	0	0	0	108.3	V459 I460 S461 F466	V459-V464 HydrophobicContact CG1-CG2 3.17Å; I460-V464 PolarHBondContact O-N 3.29Å; S461-V464 PolarHBondContact O-N 3.46Å; V464-F466 PolarHBondContact O-N 2.91Å
465	N	85.8	Confident	82.4	Confident	149 Å²	149	133.2 Å²	133.2	80%	0.797	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.5	20.1	-175.5	-54.2	-26.9	0	0	0	115.4	L463 M467	L463-N465 PolarHBondContact O-N 3.43Å; N465-M467 PolarHBondContact O-N 3.34Å
466	F	86.6	Confident	83	Confident	160 Å²	160	129.5 Å²	129.5	70%	0.702	65%	0.651	S	S	*	*			trans	-62.2	-27.3	176.4	-176.4	-101	0	0	0	113.1	L463 V464	L463-F466 HydrophobicContact CD2-CG 4.41Å; L463-F466 WeakPolarHBondContact O-CB 3.36Å; L463-F466 PolarHBondContact O-N 3.5Å; L463-F466 VanDerWaalsContact O-N 3.17Å; V464-F466 PolarHBondContact O-N 2.91Å
467	M	84.8	Confident	83.6	Confident	138 Å²	138	124.5 Å²	124.5	68%	0.68	64%	0.64	S	S	*	*	S	Bend	trans	-115	150.2	177	-64.2	-177	75.3	0	0	110.9	N465	N465-M467 PolarHBondContact O-N 3.34Å
468	A	84.5	Confident	84	Confident	85 Å²	85	121.8 Å²	121.8	70%	0.702	64%	0.639	S	S	*	*			trans	-58.3	136.7	168.2	0	0	0	0	0	109.8	I470	A468-I470 PolarHBondContact O-N 2.91Å
469	P	84.5	Confident	84.1	Confident	133 Å²	133	116.2 Å²	116.2	86%	0.864	62%	0.619	S	S	*	*			trans	-54.5	122.2	-179.8	-25.8	33.8	0	0	0	111.5
470	I	82.3	Confident	83.9	Confident	112 Å²	112	114.9 Å²	114.9	57%	0.574	61%	0.605	S	S	*	*			trans	-87.6	115.7	172.7	-58.2	171	0	0	0	106.9	A468 R472	A468-I470 PolarHBondContact O-N 2.91Å; I470-R472 HydrophobicContact CG2-CG 4.28Å; I470-R472 PolarHBondContact O-N 3.17Å
471	D	80.6	Confident	83.7	Confident	106 Å²	106	115.5 Å²	115.5	57%	0.567	61%	0.609	S	S	*	*			trans	-68.4	105.4	173.5	-170.4	2.7	0	0	0	109.9	C473 R480	D471-C473 VanDerWaalsContact C-N 3.33Å; D471-C473 WeakPolarHBondContact OD1-CB 3.49Å; D471-C473 PolarHBondContact OD1-N 3.25Å; D471-R480 IonicContact OD2-CZ 3.06Å; D471-R480 IonicContact OD2-NH1 2.78Å; D471-R480 PolarHBondContact OD2-NH1 2.7Å; D471-R480 IonicContact OD2-NH2 3.32Å; D471-R480 PolarHBondContact OD2-NH2 2.98Å
472	R	80.4	Confident	83.5	Confident	212 Å²	212	113.4 Å²	113.4	80%	0.8	60%	0.599	S	S	*	*			trans	-95.1	9.8	175.6	-61.2	-174	-177.4	-146.8	0.6	112.1	I470 K474	I470-R472 HydrophobicContact CG2-CG 4.28Å; I470-R472 PolarHBondContact O-N 3.17Å; R472-K474 PolarHBondContact O-N 2.92Å; R472-K474 VanDerWaalsContact O-N 3.14Å
473	C	79.2	Confident	83.1	Confident	57 Å²	57	109.8 Å²	109.8	39%	0.385	58%	0.583	S	S	.	*			trans	-67	114.7	-177.2	-164.2	0	0	0	0	110	D471 M475 R480	D471-C473 VanDerWaalsContact C-N 3.33Å; D471-C473 WeakPolarHBondContact OD1-CB 3.49Å; D471-C473 PolarHBondContact OD1-N 3.25Å; C473-M475 PolarHBondContact O-N 3.31Å; C473-M475 VanDerWaalsContact SG-CB 3.58Å; C473-R480 PolarHBondContact O-NH2 2.88Å
474	K	81.7	Confident	82.9	Confident	218 Å²	218	111.2 Å²	111.2	95%	0.948	59%	0.585	S	S	*	*			trans	-69.9	-9.4	174.8	-64.8	-175.6	178.2	-178.3	0	113.2	R472	R472-K474 PolarHBondContact O-N 2.92Å; R472-K474 VanDerWaalsContact O-N 3.14Å
475	M	83.6	Confident	82.7	Confident	55 Å²	55	111.1 Å²	111.1	27%	0.271	58%	0.584	S	S	.	*	S	Bend	trans	-78.9	135.6	-178.7	-154	165.4	76.1	0	0	109.1	C473 A479 R480 K483	C473-M475 PolarHBondContact O-N 3.31Å; C473-M475 VanDerWaalsContact SG-CB 3.58Å; M475-A479 VanDerWaalsContact CE-C 3.48Å; M475-A479 HydrophobicContact CE-CB 4.38Å; M475-A479 WeakPolarHBondContact CE-O 3.33Å; M475-A479 HydrophobicContact CG-CB 3.63Å; M475-A479 HydrophobicContact SD-CB 4.21Å; M475-R480 HydrophobicContact CB-CG 4.21Å; M475-R480 HydrophobicContact CE-CB 3.91Å; M475-R480 HydrophobicContact CE-CG 3.3Å; M475-R480 HydrophobicContact CG-CG 4.49Å; M475-R480 PolarHBondContact O-NE 3.13Å; M475-R480 PolarHBondContact O-NH2 3.35Å; M475-K483 HydrophobicContact CE-CD 3.78Å; M475-K483 HydrophobicContact CE-CG 4.32Å; M475-K483 HydrophobicContact SD-CD 4.22Å; M475-K483 PolarHBondContact SD-NZ 3.43Å
476	S	83.1	Confident	82.4	Confident	75 Å²	75	106.8 Å²	106.8	52%	0.524	57%	0.566	S	S	.	*			trans	-61.8	152.7	175	59	0	0	0	0	110.8	D478 A479 R480	S476-D478 PolarHBondContact O-N 3.04Å; S476-A479 PolarHBondContact O-N 3.49Å; S476-A479 VanDerWaalsContact O-N 3.12Å; S476-R480 PolarHBondContact O-N 3.13Å
477	D	83.6	Confident	81.9	Confident	110 Å²	110	103.6 Å²	103.6	59%	0.588	56%	0.555	S	S	*	*	H	α-helix	trans	-59.3	-36.8	-178	-68.1	-29.7	0	0	0	111.7	A479 R480 L481	D477-A479 PolarHBondContact O-N 3.49Å; D477-R480 WeakPolarHBondContact O-CB 3.4Å; D477-R480 PolarHBondContact O-N 3.1Å; D477-R480 VanDerWaalsContact O-N 3.16Å; D477-R480 IonicContact OD1-CZ 2.71Å; D477-R480 IonicContact OD1-NE 3.79Å; D477-R480 IonicContact OD1-NH1 3.78Å; D477-R480 PolarHBondContact OD1-NH1 3.4Å; D477-R480 IonicContact OD1-NH2 3.28Å; D477-R480 PolarHBondContact OD1-NH2 2.86Å; D477-L481 WeakPolarHBondContact O-CB 3.43Å; D477-L481 PolarHBondContact O-N 3.4Å
478	D	84.4	Confident	81.3	Confident	136 Å²	136	101.8 Å²	101.8	73%	0.727	55%	0.548	S	S	*	.	H	α-helix	trans	-61.6	-44.7	174.4	-90	-4	0	0	0	112.9	S476 R480 L481 A482	S476-D478 PolarHBondContact O-N 3.04Å; D478-R480 PolarHBondContact O-N 3.18Å; D478-L481 PolarHBondContact O-N 3.03Å; D478-A482 VanDerWaalsContact O-CB 3.32Å; D478-A482 WeakPolarHBondContact O-CB 3.31Å; D478-A482 PolarHBondContact O-N 3.23Å
479	A	84.7	Confident	80.3	Confident	37 Å²	37	102.5 Å²	102.5	31%	0.306	54%	0.54	S	S	.	.	H	α-helix	trans	-68	-27.4	177.5	0	0	0	0	0	111.9	M475 S476 D477 K483	M475-A479 VanDerWaalsContact CE-C 3.48Å; M475-A479 HydrophobicContact CE-CB 4.38Å; M475-A479 WeakPolarHBondContact CE-O 3.33Å; M475-A479 HydrophobicContact CG-CB 3.63Å; M475-A479 HydrophobicContact SD-CB 4.21Å; S476-A479 PolarHBondContact O-N 3.49Å; S476-A479 VanDerWaalsContact O-N 3.12Å; D477-A479 PolarHBondContact O-N 3.49Å; A479-K483 PolarHBondContact O-N 3.16Å
480	R	80.3	Confident	79	Confident	51 Å²	51	103.2 Å²	103.2	19%	0.192	53%	0.529	C	S	.	.	H	α-helix	trans	-70.7	-51.4	171.4	-72.2	-177.5	-128.1	154.3	-5.7	110.9	D471 C473 M475 S476 D477 D478 A482 K483 F484	D471-R480 IonicContact OD2-CZ 3.06Å; D471-R480 IonicContact OD2-NH1 2.78Å; D471-R480 PolarHBondContact OD2-NH1 2.7Å; D471-R480 IonicContact OD2-NH2 3.32Å; D471-R480 PolarHBondContact OD2-NH2 2.98Å; C473-R480 PolarHBondContact O-NH2 2.88Å; M475-R480 HydrophobicContact CB-CG 4.21Å; M475-R480 HydrophobicContact CE-CB 3.91Å; M475-R480 HydrophobicContact CE-CG 3.3Å; M475-R480 HydrophobicContact CG-CG 4.49Å; M475-R480 PolarHBondContact O-NE 3.13Å; M475-R480 PolarHBondContact O-NH2 3.35Å; S476-R480 PolarHBondContact O-N 3.13Å; D477-R480 WeakPolarHBondContact O-CB 3.4Å; D477-R480 PolarHBondContact O-N 3.1Å; D477-R480 VanDerWaalsContact O-N 3.16Å; D477-R480 IonicContact OD1-CZ 2.71Å; D477-R480 IonicContact OD1-NE 3.79Å; D477-R480 IonicContact OD1-NH1 3.78Å; D477-R480 PolarHBondContact OD1-NH1 3.4Å; D477-R480 IonicContact OD1-NH2 3.28Å; D477-R480 PolarHBondContact OD1-NH2 2.86Å; D478-R480 PolarHBondContact O-N 3.18Å; R480-A482 PolarHBondContact O-N 2.81Å; R480-K483 WeakPolarHBondContact O-CA 3.24Å; R480-K483 WeakPolarHBondContact O-CB 3.24Å; R480-K483 PolarHBondContact O-N 2.92Å; R480-F484 HydrophobicContact CB-CD2 4.47Å; R480-F484 HydrophobicContact CB-CE2 4.45Å; R480-F484 WeakPolarHBondContact O-CD2 3.49Å; R480-F484 PolarHBondContact O-N 2.73Å
481	L	83.4	Confident	77.7	Confident	118 Å²	118	104 Å²	104	62%	0.618	53%	0.53	S	S	*	.	H	α-helix	trans	-56.8	-42.7	179	-154.8	96.7	0	0	0	110.5	D477 D478 K483 F484 V485	D477-L481 WeakPolarHBondContact O-CB 3.43Å; D477-L481 PolarHBondContact O-N 3.4Å; D478-L481 PolarHBondContact O-N 3.03Å; L481-K483 VanDerWaalsContact C-N 3.34Å; L481-K483 PolarHBondContact O-N 3.01Å; L481-F484 PolarHBondContact O-N 3.18Å; L481-V485 WeakPolarHBondContact O-CB 3.41Å; L481-V485 VanDerWaalsContact O-CG2 3.26Å; L481-V485 WeakPolarHBondContact O-CG2 3.35Å; L481-V485 PolarHBondContact O-N 3.35Å
482	A	82.9	Confident	76.5	Confident	61 Å²	61	102.4 Å²	102.4	50%	0.504	53%	0.527	S	S	.	.	H	α-helix	trans	-60.1	-40	175.3	0	0	0	0	0	112.8	D478 R480 S486	D478-A482 VanDerWaalsContact O-CB 3.32Å; D478-A482 WeakPolarHBondContact O-CB 3.31Å; D478-A482 PolarHBondContact O-N 3.23Å; R480-A482 PolarHBondContact O-N 2.81Å; A482-S486 VanDerWaalsContact O-CB 3.31Å; A482-S486 WeakPolarHBondContact O-CB 3.18Å; A482-S486 PolarHBondContact O-N 3.49Å; A482-S486 PolarHBondContact O-OG 3.32Å
483	K	79.8	Confident	75.4	Confident	117 Å²	117	98.2 Å²	98.2	51%	0.509	52%	0.521	S	S	.	.	H	α-helix	trans	-66.5	-45.3	173.6	-82.3	-169.6	-172.3	168.8	0	112.1	M475 A479 R480 L481 S486 I487	M475-K483 HydrophobicContact CE-CD 3.78Å; M475-K483 HydrophobicContact CE-CG 4.32Å; M475-K483 HydrophobicContact SD-CD 4.22Å; M475-K483 PolarHBondContact SD-NZ 3.43Å; A479-K483 PolarHBondContact O-N 3.16Å; R480-K483 WeakPolarHBondContact O-CA 3.24Å; R480-K483 WeakPolarHBondContact O-CB 3.24Å; R480-K483 PolarHBondContact O-N 2.92Å; L481-K483 VanDerWaalsContact C-N 3.34Å; L481-K483 PolarHBondContact O-N 3.01Å; K483-S486 WeakPolarHBondContact CA-OG 3.16Å; K483-S486 PolarHBondContact O-N 3.24Å; K483-S486 PolarHBondContact O-OG 3.15Å; K483-I487 VanDerWaalsContact O-CG1 3.3Å; K483-I487 WeakPolarHBondContact O-CG1 3.39Å; K483-I487 PolarHBondContact O-N 2.68Å
484	F	80	Confident	74	Confident	131 Å²	131	104.6 Å²	104.6	58%	0.575	54%	0.537	S	S	*	.	H	α-helix	trans	-60.1	-48.8	177.8	-79.5	-71.7	0	0	0	111.3	R480 L481 S486 I487 D488	R480-F484 HydrophobicContact CB-CD2 4.47Å; R480-F484 HydrophobicContact CB-CE2 4.45Å; R480-F484 WeakPolarHBondContact O-CD2 3.49Å; R480-F484 PolarHBondContact O-N 2.73Å; L481-F484 PolarHBondContact O-N 3.18Å; F484-S486 VanDerWaalsContact C-N 3.27Å; F484-S486 PolarHBondContact O-N 3.41Å; F484-I487 PolarHBondContact O-N 3.47Å; F484-D488 PolarHBondContact O-N 2.63Å
485	V	80.6	Confident	72.2	Confident	72 Å²	72	102.1 Å²	102.1	44%	0.436	53%	0.529	S	S	.	.	H	α-helix	trans	-57.7	-41.5	174.5	172.7	0	0	0	0	111.1	L481 I487 L489	L481-V485 WeakPolarHBondContact O-CB 3.41Å; L481-V485 VanDerWaalsContact O-CG2 3.26Å; L481-V485 WeakPolarHBondContact O-CG2 3.35Å; L481-V485 PolarHBondContact O-N 3.35Å; V485-I487 VanDerWaalsContact C-N 3.31Å; V485-I487 PolarHBondContact O-N 3.15Å; V485-L489 HydrophobicContact CG1-CD1 3.62Å; V485-L489 HydrophobicContact CG1-CG 4.35Å; V485-L489 VanDerWaalsContact O-CB 3.29Å; V485-L489 WeakPolarHBondContact O-CB 3.26Å; V485-L489 WeakPolarHBondContact O-CD1 3.42Å; V485-L489 WeakPolarHBondContact O-CG 2.81Å; V485-L489 PolarHBondContact O-N 3.29Å
486	S	79	Confident	70.5	Confident	58 Å²	58	105.1 Å²	105.1	41%	0.406	55%	0.552	S	S	.	*	H	α-helix	trans	-68.1	-26.9	177.7	78.8	0	0	0	0	114.4	A482 K483 F484 K490	A482-S486 VanDerWaalsContact O-CB 3.31Å; A482-S486 WeakPolarHBondContact O-CB 3.18Å; A482-S486 PolarHBondContact O-N 3.49Å; A482-S486 PolarHBondContact O-OG 3.32Å; K483-S486 WeakPolarHBondContact CA-OG 3.16Å; K483-S486 PolarHBondContact O-N 3.24Å; K483-S486 PolarHBondContact O-OG 3.15Å; F484-S486 VanDerWaalsContact C-N 3.27Å; F484-S486 PolarHBondContact O-N 3.41Å; S486-K490 WeakPolarHBondContact O-CB 3.4Å; S486-K490 PolarHBondContact O-N 3.38Å
487	I	77.5	Confident	68.6	Low	94 Å²	94	105.3 Å²	105.3	48%	0.482	56%	0.558	S	S	.	*	H	α-helix	trans	-79.7	-47.9	177.5	-70.2	165.9	0	0	0	109.3	K483 F484 V485 L489 K490 E491	K483-I487 VanDerWaalsContact O-CG1 3.3Å; K483-I487 WeakPolarHBondContact O-CG1 3.39Å; K483-I487 PolarHBondContact O-N 2.68Å; F484-I487 PolarHBondContact O-N 3.47Å; V485-I487 VanDerWaalsContact C-N 3.31Å; V485-I487 PolarHBondContact O-N 3.15Å; I487-L489 VanDerWaalsContact C-N 3.3Å; I487-L489 PolarHBondContact O-N 3.16Å; I487-K490 CarbonylContact O-C 3.54Å; I487-K490 WeakPolarHBondContact O-CA 3.26Å; I487-K490 WeakPolarHBondContact O-CB 3.47Å; I487-K490 PolarHBondContact O-N 3.31Å; I487-E491 PolarHBondContact O-N 3.49Å
488	D	71.4	Confident	66.6	Low	100 Å²	100	106.9 Å²	106.9	54%	0.535	57%	0.571	S	S	.	*	H	α-helix	trans	-61.4	-40	179	-68.4	-14.8	0	0	0	111.2	F484 K490 E491 S492	F484-D488 PolarHBondContact O-N 2.63Å; D488-K490 VanDerWaalsContact C-N 3.34Å; D488-K490 PolarHBondContact O-N 3.1Å; D488-E491 PolarHBondContact O-N 2.93Å; D488-S492 PolarHBondContact O-N 2.89Å
489	L	62.6	Low	64.5	Low	100 Å²	100	109.1 Å²	109.1	52%	0.524	58%	0.577	S	S	.	*	H	α-helix	trans	-65.2	-35.1	173.3	-73.3	165.5	0	0	0	112.6	V485 I487 E491 S492 D493	V485-L489 HydrophobicContact CG1-CD1 3.62Å; V485-L489 HydrophobicContact CG1-CG 4.35Å; V485-L489 VanDerWaalsContact O-CB 3.29Å; V485-L489 WeakPolarHBondContact O-CB 3.26Å; V485-L489 WeakPolarHBondContact O-CD1 3.42Å; V485-L489 WeakPolarHBondContact O-CG 2.81Å; V485-L489 PolarHBondContact O-N 3.29Å; I487-L489 VanDerWaalsContact C-N 3.3Å; I487-L489 PolarHBondContact O-N 3.16Å; L489-E491 VanDerWaalsContact C-N 3.28Å; L489-E491 PolarHBondContact O-N 3.43Å; L489-S492 PolarHBondContact O-OG 3.49Å; L489-D493 PolarHBondContact O-N 3.15Å
490	K	58.2	Low	62.2	Low	147 Å²	147	116.1 Å²	116.1	64%	0.639	60%	0.604	S	S	*	*	H	α-helix	trans	-72.7	-21.5	175.3	-95.3	-175.4	174.2	-179.9	0	113.4	S486 I487 D488	S486-K490 WeakPolarHBondContact O-CB 3.4Å; S486-K490 PolarHBondContact O-N 3.38Å; I487-K490 CarbonylContact O-C 3.54Å; I487-K490 WeakPolarHBondContact O-CA 3.26Å; I487-K490 WeakPolarHBondContact O-CB 3.47Å; I487-K490 PolarHBondContact O-N 3.31Å; D488-K490 VanDerWaalsContact C-N 3.34Å; D488-K490 PolarHBondContact O-N 3.1Å
491	E	54	Low	60.7	Low	128 Å²	128	124 Å²	124	60%	0.598	66%	0.658	S	S	*	*	H	α-helix	trans	-86.4	-35.4	177.3	-157.4	157.3	-151	0	0	111.1	I487 D488 L489 D493 R494	I487-E491 PolarHBondContact O-N 3.49Å; D488-E491 PolarHBondContact O-N 2.93Å; L489-E491 VanDerWaalsContact C-N 3.28Å; L489-E491 PolarHBondContact O-N 3.43Å; E491-D493 VanDerWaalsContact C-N 3.29Å; E491-D493 PolarHBondContact O-N 3.18Å; E491-R494 PolarHBondContact O-N 3.36Å
492	S	56.2	Low	59.5	Low	73 Å²	73	124.3 Å²	124.3	51%	0.51	66%	0.66	S	S	.	*	H	α-helix	trans	-62.9	-34	170.5	60.1	0	0	0	0	113.1	D488 L489 R494	D488-S492 PolarHBondContact O-N 2.89Å; L489-S492 PolarHBondContact O-OG 3.49Å; S492-R494 PolarHBondContact O-N 3.23Å
493	D	56.8	Low	58.3	Low	125 Å²	125	127.6 Å²	127.6	67%	0.668	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.8	-9.9	179.6	-75	-11.4	0	0	0	113.7	L489 E491 H495	L489-D493 PolarHBondContact O-N 3.15Å; E491-D493 VanDerWaalsContact C-N 3.29Å; E491-D493 PolarHBondContact O-N 3.18Å; D493-H495 VanDerWaalsContact C-N 3.34Å
494	R	49.4	Very low	57.1	Low	190 Å²	190	128.2 Å²	128.2	72%	0.717	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	3.1	179.7	-85.3	-163.4	-93.5	-159.2	1.4	115.2	E491 S492	E491-R494 PolarHBondContact O-N 3.36Å; S492-R494 PolarHBondContact O-N 3.23Å
495	H	43.6	Very low	55.8	Low	167 Å²	167	128 Å²	128	77%	0.773	68%	0.683	S	S	*	*			trans	-138.5	76.8	169.9	-77.9	-68.4	0	0	0	113.5	D493 A497	D493-H495 VanDerWaalsContact C-N 3.34Å; H495-A497 VanDerWaalsContact C-N 3.32Å; H495-A497 PolarHBondContact O-N 3.33Å
496	P	48.1	Very low	54.2	Low	117 Å²	117	131.5 Å²	131.5	76%	0.76	70%	0.698	S	S	*	*			trans	-76.5	96.3	145.9	30	-22.3	0	0	0	106.8	V498	P496-V498 PolarHBondContact O-N 3.34Å
497	A	43.6	Very low	52.6	Low	79 Å²	79	136.4 Å²	136.4	65%	0.653	72%	0.718	S	S	*	*			trans	-54.8	132.9	169.7	0	0	0	0	0	109.9	H495 Q499	H495-A497 VanDerWaalsContact C-N 3.32Å; H495-A497 PolarHBondContact O-N 3.33Å; A497-Q499 PolarHBondContact O-N 3.31Å; A497-Q499 VanDerWaalsContact O-N 3.09Å
498	V	41.8	Very low	50.8	Low	143 Å²	143	139.4 Å²	139.4	87%	0.867	74%	0.735	S	S	*	*			trans	-45.3	111.1	161.5	177.4	0	0	0	0	108.3	P496	P496-V498 PolarHBondContact O-N 3.34Å
499	Q	41.6	Very low	49.2	Very low	183 Å²	183	142.5 Å²	142.5	86%	0.855	75%	0.75	S	S	*	*			trans	-123.8	111.2	164	-82.7	-169.8	-17.6	0	0	109.2	A497	A497-Q499 PolarHBondContact O-N 3.31Å; A497-Q499 VanDerWaalsContact O-N 3.09Å
500	E	34.7	Very low	48.1	Very low	184 Å²	184	146 Å²	146	86%	0.86	77%	0.769	S	S	*	*			trans	-32.1	132.1	165.3	-63.1	166.8	150.8	0	0	114.5
501	T	49.1	Very low	47.2	Very low	216 Å²	216	145.9 Å²	145.9	100%	1.325	78%	0.781	S	S	*	*			trans	-143.9	0	134.1	53.5	0	0	0	0	109.2

Retrieved 501 of 501 residues in 1858.7 ms (Link to these results)

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