A0A087XIP2_POEFO Loading...

Muscarinic acetylcholine receptor

The muscarinic acetylcholine receptor mediates various cellular responses, including inhibition of adenylate cyclase, breakdown of phosphoinositides and modulation of potassium channels through the action of G proteins.

AlphaFold DB , UniProt , Accession A0A087XIP2, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 433 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	S	34.8	Very low	37	Very low	181 Å²	181	133.1 Å²	133.1	100%	1.266	84%	0.844	S	S	*	*				0	120.1	0	26.2	0	0	0	0	108.1
2	G	38.4	Very low	37.6	Very low	81 Å²	81	135.7 Å²	135.7	84%	0.835	83%	0.833	S	S	*	*			cis	132.7	109.8	-2.8	0	0	0	0	0	111.2
3	S	30	Very low	38.1	Very low	119 Å²	119	133 Å²	133	83%	0.832	82%	0.823	S	S	*	*			trans	-155.1	110.9	168.7	-170.4	0	0	0	0	108.9
4	L	42.2	Very low	38.9	Very low	179 Å²	179	135.1 Å²	135.1	94%	0.937	83%	0.827	S	S	*	*			trans	-86.8	135.7	155.6	-82.8	74.1	0	0	0	106.2
5	G	35.9	Very low	39.7	Very low	63 Å²	63	132.1 Å²	132.1	65%	0.649	80%	0.802	S	S	*	*			trans	-172.7	125.7	175.6	0	0	0	0	0	113.1
6	N	35.1	Very low	40.6	Very low	166 Å²	166	130.4 Å²	130.4	89%	0.888	80%	0.798	S	S	*	*			trans	56.1	73.6	158.5	-58.2	-1.8	0	0	0	117.3
7	Q	36.1	Very low	41.4	Very low	192 Å²	192	126.2 Å²	126.2	90%	0.897	77%	0.774	S	S	*	*			trans	-126.3	70.6	149.9	-169.6	163.3	86	0	0	108.1
8	S	36.8	Very low	42.1	Very low	107 Å²	107	127.4 Å²	127.4	75%	0.748	78%	0.776	S	S	*	*			trans	-152.8	12.1	-167.8	-47.8	0	0	0	0	114.3
9	A	37.6	Very low	42.3	Very low	80 Å²	80	130.6 Å²	130.6	66%	0.661	78%	0.781	S	S	*	*	S	Bend	trans	-92	-35.7	-176	0	0	0	0	0	113.4	L11	A9-L11 VanDerWaalsContact C-N 3.29Å; A9-L11 PolarHBondContact O-N 3.25Å; A9-L11 VanDerWaalsContact O-N 3.16Å
10	D	38.8	Very low	42.9	Very low	143 Å²	143	128 Å²	128	77%	0.765	77%	0.769	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	17.9	-163.8	-48.5	-54.3	0	0	0	114.8
11	L	41.8	Very low	43.4	Very low	153 Å²	153	128.4 Å²	128.4	80%	0.801	77%	0.773	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.8	-1.7	-174.3	-135.4	87.7	0	0	0	114.9	A9	A9-L11 VanDerWaalsContact C-N 3.29Å; A9-L11 PolarHBondContact O-N 3.25Å; A9-L11 VanDerWaalsContact O-N 3.16Å
12	F	43.7	Very low	44.3	Very low	164 Å²	164	126.1 Å²	126.1	72%	0.719	75%	0.746	S	S	*	*	S	Bend	trans	-128.8	53.5	-172.2	-80.3	-77.3	0	0	0	113
13	S	44	Very low	45.1	Very low	101 Å²	101	128.3 Å²	128.3	71%	0.706	75%	0.749	S	S	*	*			trans	-139.1	16	-177.4	-53.1	0	0	0	0	116.1
14	N	49.2	Very low	46.3	Very low	163 Å²	163	126.8 Å²	126.8	87%	0.872	74%	0.738	S	S	*	*			trans	-133.6	63.1	169.5	-90	-40.5	0	0	0	110.8
15	I	51.3	Low	46.9	Very low	89 Å²	89	124.1 Å²	124.1	46%	0.456	73%	0.729	S	S	.	*			trans	-97	111	165.4	-55.1	178.2	0	0	0	107.1	C17 C27	I15-C17 VanDerWaalsContact CG2-SG 3.59Å; I15-C17 PolarHBondContact O-N 3.34Å; I15-C27 HydrophobicContact CG2-CB 3.92Å
16	S	54.6	Low	47.7	Very low	106 Å²	106	126.1 Å²	126.1	74%	0.741	73%	0.733	S	S	*	*			trans	-92.2	91.8	175.3	-168.1	0	0	0	0	109.7
17	C	52.8	Low	48.7	Very low	58 Å²	58	121.2 Å²	121.2	39%	0.392	71%	0.711	S	S	.	*			trans	-87.3	120.9	170.3	-50.4	0	0	0	0	108.6	I15 T25 C27	I15-C17 VanDerWaalsContact CG2-SG 3.59Å; I15-C17 PolarHBondContact O-N 3.34Å; C17-T25 HydrophobicContact CB-CG2 4.34Å; C17-C27 HydrophobicContact CB-CB 4.22Å; C17-C27 WeakPolarHBondContact CB-SG 3.2Å; C17-C27 WeakPolarHBondContact SG-CB 3.46Å; C17-C27 CovalentContact SG-SG 2.04Å; C17-C27 PolarHBondContact SG-SG 2.98Å
18	N	54.3	Low	49.8	Very low	149 Å²	149	116.4 Å²	116.4	80%	0.797	70%	0.699	S	S	*	*			trans	-89.2	120.5	180	-159.2	31.6	0	0	0	110	S20	N18-S20 PolarHBondContact O-N 2.87Å; N18-S20 VanDerWaalsContact O-N 3.13Å
19	E	46.4	Very low	50.8	Low	187 Å²	187	118.1 Å²	118.1	87%	0.874	70%	0.699	S	S	*	*			trans	-82.3	92.3	-173.7	-170.2	171.6	-158	0	0	111.7
20	S	53.7	Low	51.8	Low	79 Å²	79	118 Å²	118	55%	0.552	69%	0.692	S	S	*	*			trans	-90.5	130.1	169.5	52.9	0	0	0	0	111	N18 N22	N18-S20 PolarHBondContact O-N 2.87Å; N18-S20 VanDerWaalsContact O-N 3.13Å; S20-N22 PolarHBondContact O-N 3.27Å
21	T	54.3	Low	52.9	Low	136 Å²	136	116 Å²	116	83%	0.834	68%	0.681	S	S	*	*	S	Bend	trans	-77.6	49.8	-169.4	34.1	0	0	0	0	114.8
22	N	52.5	Low	53.7	Low	134 Å²	134	115.2 Å²	115.2	72%	0.717	68%	0.678	S	S	*	*	S	Bend	trans	-155	84	163.2	-94.3	-44	0	0	0	112	S20 S24	S20-N22 PolarHBondContact O-N 3.27Å; N22-S24 PolarHBondContact O-N 3.47Å; N22-S24 PolarHBondContact O-OG 2.85Å
23	S	56.3	Low	54.6	Low	126 Å²	126	112.9 Å²	112.9	88%	0.881	67%	0.672	S	S	*	*	S	Bend	trans	40.3	45.6	151.7	67.9	0	0	0	0	119
24	S	54.8	Low	55.4	Low	88 Å²	88	110.8 Å²	110.8	62%	0.615	66%	0.662	S	S	*	*			trans	-160.6	95.5	163.4	44.3	0	0	0	0	112.4	N22 S26	N22-S24 PolarHBondContact O-N 3.47Å; N22-S24 PolarHBondContact O-OG 2.85Å; S24-S26 PolarHBondContact O-N 3.23Å; S24-S26 VanDerWaalsContact O-N 3.15Å
25	T	54.4	Low	56	Low	122 Å²	122	111.1 Å²	111.1	75%	0.748	65%	0.651	S	S	*	*			trans	-79.1	97.5	-177.9	-44.5	0	0	0	0	111.8	C17 C27	C17-T25 HydrophobicContact CB-CG2 4.34Å; T25-C27 PolarHBondContact O-N 3.29Å
26	S	53.8	Low	56.6	Low	105 Å²	105	109.3 Å²	109.3	73%	0.734	65%	0.646	S	S	*	*			trans	-92.2	87	174.5	46.8	0	0	0	0	112	S24	S24-S26 PolarHBondContact O-N 3.23Å; S24-S26 VanDerWaalsContact O-N 3.15Å
27	C	56.4	Low	57.2	Low	63 Å²	63	109.4 Å²	109.4	43%	0.426	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-81.2	116.4	170.1	-55.4	0	0	0	0	110.2	I15 C17 T25	I15-C27 HydrophobicContact CG2-CB 3.92Å; C17-C27 HydrophobicContact CB-CB 4.22Å; C17-C27 WeakPolarHBondContact CB-SG 3.2Å; C17-C27 WeakPolarHBondContact SG-CB 3.46Å; C17-C27 CovalentContact SG-SG 2.04Å; C17-C27 PolarHBondContact SG-SG 2.98Å; T25-C27 PolarHBondContact O-N 3.29Å
28	S	57.8	Low	58.1	Low	92 Å²	92	110.1 Å²	110.1	64%	0.643	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-78.9	132.5	172.7	41.4	0	0	0	0	111.4
29	L	58.8	Low	59	Low	142 Å²	142	110.9 Å²	110.9	74%	0.743	63%	0.632	S	S	*	*	P	Polyproline II helix	trans	-69.7	143.7	164.9	-78.8	160.5	0	0	0	109.4	D31	L29-D31 PolarHBondContact O-N 2.92Å
30	P	58.4	Low	60.3	Low	78 Å²	78	109.5 Å²	109.5	51%	0.506	62%	0.62	S	S	.	*	P	Polyproline II helix	trans	-62.6	130.5	172.8	27	-33.7	0	0	0	109.8	N32	P30-N32 PolarHBondContact O-N 3.29Å
31	D	60.8	Low	61.7	Low	102 Å²	102	110.5 Å²	110.5	55%	0.545	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-64.7	116.6	-167.9	-143.7	-41.6	0	0	0	111.6	L29 N33 A34	L29-D31 PolarHBondContact O-N 2.92Å; D31-N33 PolarHBondContact O-N 3.37Å; D31-N33 PolarHBondContact OD1-ND2 3.13Å; D31-A34 PolarHBondContact O-N 3.02Å
32	N	59.6	Low	63.2	Low	136 Å²	136	108.1 Å²	108.1	73%	0.727	60%	0.6	S	S	*	*	H	α-helix	trans	-57.2	-25.2	178.7	-77	-50.9	0	0	0	111.9	P30 S36	P30-N32 PolarHBondContact O-N 3.29Å; N32-S36 PolarHBondContact O-N 2.9Å
33	N	61.9	Low	64.9	Low	114 Å²	114	106.6 Å²	106.6	61%	0.61	59%	0.591	S	S	*	*	H	α-helix	trans	-62.2	-39.4	176.4	-63.8	-55.2	0	0	0	112.6	D31 S36 E37	D31-N33 PolarHBondContact O-N 3.37Å; D31-N33 PolarHBondContact OD1-ND2 3.13Å; N33-S36 VanDerWaalsContact O-CB 3.32Å; N33-S36 WeakPolarHBondContact O-CB 3.4Å; N33-S36 PolarHBondContact O-N 3.01Å; N33-E37 PolarHBondContact O-N 3.12Å
34	A	61.3	Low	66.4	Low	58 Å²	58	106.2 Å²	106.2	48%	0.479	58%	0.575	S	S	.	*	H	α-helix	trans	-66.6	-41.3	-177.9	0	0	0	0	0	112.5	D31 S36 S38	D31-A34 PolarHBondContact O-N 3.02Å; A34-S36 VanDerWaalsContact C-N 3.29Å; A34-S36 PolarHBondContact O-N 3.43Å; A34-S38 VanDerWaalsContact O-CB 3.31Å; A34-S38 WeakPolarHBondContact O-CB 3.37Å; A34-S38 PolarHBondContact O-N 3.47Å
35	W	60.9	Low	68.1	Low	169 Å²	169	106 Å²	106	64%	0.64	57%	0.565	S	S	*	*	H	α-helix	trans	-65.8	-32.9	174.2	-65.1	98.4	0	0	0	112.5	R39	W35-R39 WeakPolarHBondContact O-CB 3.39Å; W35-R39 PolarHBondContact O-N 3.11Å
36	S	64.4	Low	69.8	Low	52 Å²	52	106.6 Å²	106.6	36%	0.364	56%	0.558	S	S	.	*	H	α-helix	trans	-68.5	-53.1	175.5	-157.3	0	0	0	0	110.9	N32 N33 A34 S38 R39 Y40	N32-S36 PolarHBondContact O-N 2.9Å; N33-S36 VanDerWaalsContact O-CB 3.32Å; N33-S36 WeakPolarHBondContact O-CB 3.4Å; N33-S36 PolarHBondContact O-N 3.01Å; A34-S36 VanDerWaalsContact C-N 3.29Å; A34-S36 PolarHBondContact O-N 3.43Å; S36-S38 PolarHBondContact O-N 3.37Å; S36-R39 PolarHBondContact O-N 3.39Å; S36-R39 VanDerWaalsContact O-N 3.14Å; S36-Y40 WeakPolarHBondContact O-CD2 3.41Å; S36-Y40 PolarHBondContact O-N 2.96Å; S36-Y40 WeakPolarHBondContact OG-CE2 3.48Å
37	E	68.3	Low	71.6	Confident	108 Å²	108	108 Å²	108	51%	0.505	55%	0.551	S	S	.	*	H	α-helix	trans	-60	-45.5	-179.3	-166.4	-165.3	140	0	0	112.4	N33 R39 Y40 K41	N33-E37 PolarHBondContact O-N 3.12Å; E37-R39 VanDerWaalsContact C-N 3.3Å; E37-R39 PolarHBondContact O-N 3.45Å; E37-Y40 PolarHBondContact O-N 3.45Å; E37-K41 HydrophobicContact CG-CD 4.42Å; E37-K41 PolarHBondContact O-N 3.23Å; E37-K41 WeakPolarHBondContact OE1-CE 3.39Å; E37-K41 IonicContact OE1-NZ 2.62Å; E37-K41 PolarHBondContact OE1-NZ 2.94Å
38	S	71.3	Confident	73.3	Confident	72 Å²	72	107.5 Å²	107.5	50%	0.503	54%	0.544	S	S	.	.	H	α-helix	trans	-58.3	-41.1	175.5	178	0	0	0	0	112.2	A34 S36 T42	A34-S38 VanDerWaalsContact O-CB 3.31Å; A34-S38 WeakPolarHBondContact O-CB 3.37Å; A34-S38 PolarHBondContact O-N 3.47Å; S36-S38 PolarHBondContact O-N 3.37Å; S38-T42 WeakPolarHBondContact O-CB 3.3Å; S38-T42 PolarHBondContact O-N 3.23Å; S38-T42 PolarHBondContact O-OG1 2.94Å
39	R	72.9	Confident	75	Confident	165 Å²	165	104.6 Å²	104.6	62%	0.623	53%	0.526	S	S	*	.	H	α-helix	trans	-69.8	-40.8	178.5	-170.5	174.8	-63.2	153.9	5	112.3	W35 S36 E37 T42 L43	W35-R39 WeakPolarHBondContact O-CB 3.39Å; W35-R39 PolarHBondContact O-N 3.11Å; S36-R39 PolarHBondContact O-N 3.39Å; S36-R39 VanDerWaalsContact O-N 3.14Å; E37-R39 VanDerWaalsContact C-N 3.3Å; E37-R39 PolarHBondContact O-N 3.45Å; R39-T42 PolarHBondContact O-N 3.02Å; R39-L43 HydrophobicContact CG-CD1 4.22Å; R39-L43 VanDerWaalsContact O-CG 3.32Å; R39-L43 WeakPolarHBondContact O-CG 3.35Å; R39-L43 PolarHBondContact O-N 3.27Å
40	Y	74	Confident	76.6	Confident	159 Å²	159	102.3 Å²	102.3	62%	0.624	51%	0.514	S	S	*	.	H	α-helix	trans	-62.1	-48.2	174.5	-75.9	-62.5	0	0	0	111.7	S36 E37 T42 L43 E44	S36-Y40 WeakPolarHBondContact O-CD2 3.41Å; S36-Y40 PolarHBondContact O-N 2.96Å; S36-Y40 WeakPolarHBondContact OG-CE2 3.48Å; E37-Y40 PolarHBondContact O-N 3.45Å; Y40-T42 VanDerWaalsContact C-N 3.31Å; Y40-T42 PolarHBondContact O-N 3.28Å; Y40-L43 PolarHBondContact O-N 3Å; Y40-E44 WeakPolarHBondContact O-CB 3.35Å; Y40-E44 PolarHBondContact O-N 2.89Å
41	K	83	Confident	78.4	Confident	100 Å²	100	101.6 Å²	101.6	44%	0.435	51%	0.508	S	S	.	.	H	α-helix	trans	-58.7	-40.4	175.9	-74.8	174.4	171.6	173	0	112.6	E37 E44 M45	E37-K41 HydrophobicContact CG-CD 4.42Å; E37-K41 PolarHBondContact O-N 3.23Å; E37-K41 WeakPolarHBondContact OE1-CE 3.39Å; E37-K41 IonicContact OE1-NZ 2.62Å; E37-K41 PolarHBondContact OE1-NZ 2.94Å; K41-E44 PolarHBondContact O-N 3.01Å; K41-M45 WeakPolarHBondContact O-CB 3.5Å; K41-M45 VanDerWaalsContact O-CG 3.26Å; K41-M45 WeakPolarHBondContact O-CG 3.34Å; K41-M45 PolarHBondContact O-N 3.42Å
42	T	85.4	Confident	79.9	Confident	85 Å²	85	98.4 Å²	98.4	52%	0.521	49%	0.492	S	S	.	.	H	α-helix	trans	-63.8	-43.1	176.3	-55.9	0	0	0	0	112.1	S38 R39 Y40 F46	S38-T42 WeakPolarHBondContact O-CB 3.3Å; S38-T42 PolarHBondContact O-N 3.23Å; S38-T42 PolarHBondContact O-OG1 2.94Å; R39-T42 PolarHBondContact O-N 3.02Å; Y40-T42 VanDerWaalsContact C-N 3.31Å; Y40-T42 PolarHBondContact O-N 3.28Å; T42-F46 WeakPolarHBondContact O-CB 3.44Å; T42-F46 PolarHBondContact O-N 3.46Å
43	L	88.1	Confident	81.5	Confident	103 Å²	103	93.3 Å²	93.3	54%	0.539	47%	0.472	S	S	.	.	H	α-helix	trans	-69.2	-37.2	177.5	-70.3	170.2	0	0	0	112.2	R39 Y40 F46 F47	R39-L43 HydrophobicContact CG-CD1 4.22Å; R39-L43 VanDerWaalsContact O-CG 3.32Å; R39-L43 WeakPolarHBondContact O-CG 3.35Å; R39-L43 PolarHBondContact O-N 3.27Å; Y40-L43 PolarHBondContact O-N 3Å; L43-F46 PolarHBondContact O-N 3.35Å; L43-F47 WeakPolarHBondContact O-CB 3.45Å; L43-F47 PolarHBondContact O-N 3.01Å
44	E	88.5	Confident	83.1	Confident	118 Å²	118	90.9 Å²	90.9	55%	0.551	46%	0.464	S	S	*	.	H	α-helix	trans	-62.6	-50.6	174	-179.3	177.4	-168.8	0	0	111.3	Y40 K41 F46 F47 I48	Y40-E44 WeakPolarHBondContact O-CB 3.35Å; Y40-E44 PolarHBondContact O-N 2.89Å; K41-E44 PolarHBondContact O-N 3.01Å; E44-F46 VanDerWaalsContact C-N 3.32Å; E44-F46 PolarHBondContact O-N 3.35Å; E44-F47 PolarHBondContact O-N 2.85Å; E44-F47 VanDerWaalsContact O-N 3.14Å; E44-I48 HydrophobicContact CG-CD1 3.87Å; E44-I48 WeakPolarHBondContact O-CG1 3.25Å; E44-I48 PolarHBondContact O-N 2.96Å
45	M	89	Confident	84.7	Confident	82 Å²	82	92.6 Å²	92.6	40%	0.404	46%	0.464	S	S	.	.	H	α-helix	trans	-57.5	-43.4	175	-73	170.3	172.7	0	0	112.1	K41 I48 A49	K41-M45 WeakPolarHBondContact O-CB 3.5Å; K41-M45 VanDerWaalsContact O-CG 3.26Å; K41-M45 WeakPolarHBondContact O-CG 3.34Å; K41-M45 PolarHBondContact O-N 3.42Å; M45-I48 PolarHBondContact O-N 2.92Å; M45-A49 VanDerWaalsContact O-CB 3.31Å; M45-A49 WeakPolarHBondContact O-CB 3.41Å; M45-A49 PolarHBondContact O-N 3.05Å
46	F	90.8	Very high	86.4	Confident	136 Å²	136	85 Å²	85	60%	0.596	44%	0.436	S	S	*	.	H	α-helix	trans	-62.7	-42.2	175.6	178	-97.2	0	0	0	112.3	T42 L43 E44 A49 L50	T42-F46 WeakPolarHBondContact O-CB 3.44Å; T42-F46 PolarHBondContact O-N 3.46Å; L43-F46 PolarHBondContact O-N 3.35Å; E44-F46 VanDerWaalsContact C-N 3.32Å; E44-F46 PolarHBondContact O-N 3.35Å; F46-A49 PolarHBondContact O-N 3.42Å; F46-L50 HydrophobicContact CE1-CD1 3.95Å; F46-L50 HydrophobicContact CZ-CD1 4.05Å; F46-L50 WeakPolarHBondContact O-CB 3.32Å; F46-L50 PolarHBondContact O-N 3.42Å
47	F	92.7	Very high	87.9	Confident	133 Å²	133	89.2 Å²	89.2	58%	0.583	45%	0.449	S	S	*	.	H	α-helix	trans	-66.3	-43.6	177.6	-172.5	-100.1	0	0	0	112	L43 E44 A49 L50 V51	L43-F47 WeakPolarHBondContact O-CB 3.45Å; L43-F47 PolarHBondContact O-N 3.01Å; E44-F47 PolarHBondContact O-N 2.85Å; E44-F47 VanDerWaalsContact O-N 3.14Å; F47-A49 VanDerWaalsContact C-N 3.34Å; F47-A49 PolarHBondContact O-N 2.98Å; F47-L50 PolarHBondContact O-N 3.22Å; F47-V51 HydrophobicContact CD1-CG2 4.1Å; F47-V51 HydrophobicContact CE1-CG2 3.75Å; F47-V51 HydrophobicContact CE2-CG2 4.2Å; F47-V51 HydrophobicContact CG-CG2 4.48Å; F47-V51 HydrophobicContact CZ-CG2 3.8Å; F47-V51 WeakPolarHBondContact O-CB 3.45Å; F47-V51 WeakPolarHBondContact O-CG2 3.48Å; F47-V51 PolarHBondContact O-N 3.12Å
48	I	91.7	Very high	89.3	Confident	53 Å²	53	88.6 Å²	88.6	27%	0.272	45%	0.452	S	S	.	.	H	α-helix	trans	-60.1	-44.2	174.4	-68.6	167.3	0	0	0	110.7	E44 M45 T52 I106	E44-I48 HydrophobicContact CG-CD1 3.87Å; E44-I48 WeakPolarHBondContact O-CG1 3.25Å; E44-I48 PolarHBondContact O-N 2.96Å; M45-I48 PolarHBondContact O-N 2.92Å; I48-T52 VanDerWaalsContact O-CB 3.32Å; I48-T52 WeakPolarHBondContact O-CB 3.45Å; I48-T52 PolarHBondContact O-N 3.26Å; I48-T52 PolarHBondContact O-OG1 3.32Å; I48-I106 HydrophobicContact CD1-CG2 4.49Å; I48-I106 HydrophobicContact CG2-CG2 4.03Å
49	A	92	Very high	90.5	Very high	32 Å²	32	86.6 Å²	86.6	26%	0.264	44%	0.437	S	S	.	.	H	α-helix	trans	-61.8	-44.8	176.8	0	0	0	0	0	112.2	M45 F46 F47 G53 I107	M45-A49 VanDerWaalsContact O-CB 3.31Å; M45-A49 WeakPolarHBondContact O-CB 3.41Å; M45-A49 PolarHBondContact O-N 3.05Å; F46-A49 PolarHBondContact O-N 3.42Å; F47-A49 VanDerWaalsContact C-N 3.34Å; F47-A49 PolarHBondContact O-N 2.98Å; A49-G53 WeakPolarHBondContact O-CA 3.35Å; A49-G53 PolarHBondContact O-N 2.89Å; A49-I107 HydrophobicContact CB-CD1 3.63Å
50	L	94.1	Very high	91.7	Very high	94 Å²	94	80 Å²	80	49%	0.492	42%	0.415	S	S	.	.	H	α-helix	trans	-67.1	-44.3	179.7	-173.7	152.4	0	0	0	111.8	F46 F47 S54	F46-L50 HydrophobicContact CE1-CD1 3.95Å; F46-L50 HydrophobicContact CZ-CD1 4.05Å; F46-L50 WeakPolarHBondContact O-CB 3.32Å; F46-L50 PolarHBondContact O-N 3.42Å; F47-L50 PolarHBondContact O-N 3.22Å; L50-S54 VanDerWaalsContact O-CB 3.26Å; L50-S54 WeakPolarHBondContact O-CB 3.4Å; L50-S54 PolarHBondContact O-N 2.97Å; L50-S54 PolarHBondContact O-OG 3.3Å
51	V	94.8	Very high	92.8	Very high	63 Å²	63	75 Å²	75	38%	0.382	40%	0.401	S	S	.	.	H	α-helix	trans	-67.2	-48.8	178.1	171.3	0	0	0	0	111.2	F47 S54 L55	F47-V51 HydrophobicContact CD1-CG2 4.1Å; F47-V51 HydrophobicContact CE1-CG2 3.75Å; F47-V51 HydrophobicContact CE2-CG2 4.2Å; F47-V51 HydrophobicContact CG-CG2 4.48Å; F47-V51 HydrophobicContact CZ-CG2 3.8Å; F47-V51 WeakPolarHBondContact O-CB 3.45Å; F47-V51 WeakPolarHBondContact O-CG2 3.48Å; F47-V51 PolarHBondContact O-N 3.12Å; V51-S54 PolarHBondContact O-N 3.04Å; V51-S54 PolarHBondContact O-OG 3.13Å; V51-S54 VanDerWaalsContact O-OG 3.07Å; V51-L55 WeakPolarHBondContact O-CB 3.34Å; V51-L55 PolarHBondContact O-N 3.14Å
52	T	92.6	Very high	93.5	Very high	34 Å²	34	71.7 Å²	71.7	21%	0.209	40%	0.396	C	S	.	.	H	α-helix	trans	-73	-36.9	-176.3	-40.9	0	0	0	0	111.6	I48 L55 S56 T103	I48-T52 VanDerWaalsContact O-CB 3.32Å; I48-T52 WeakPolarHBondContact O-CB 3.45Å; I48-T52 PolarHBondContact O-N 3.26Å; I48-T52 PolarHBondContact O-OG1 3.32Å; T52-L55 PolarHBondContact O-N 2.66Å; T52-S56 WeakPolarHBondContact O-CB 3.31Å; T52-S56 PolarHBondContact O-N 3.31Å; T52-T103 WeakPolarHBondContact CB-OG1 3.24Å; T52-T103 WeakPolarHBondContact CG2-OG1 3.33Å
53	G	93.8	Very high	94	Very high	30 Å²	30	68.9 Å²	68.9	31%	0.309	38%	0.377	S	S	.	.	H	α-helix	trans	-66.2	-39.5	174.2	0	0	0	0	0	113.4	A49 S56 F57	A49-G53 WeakPolarHBondContact O-CA 3.35Å; A49-G53 PolarHBondContact O-N 2.89Å; G53-S56 WeakPolarHBondContact O-CB 3.44Å; G53-F57 WeakPolarHBondContact O-CB 3.36Å; G53-F57 PolarHBondContact O-N 3.01Å
54	S	95.3	Very high	94.5	Very high	63 Å²	63	67.4 Å²	67.4	44%	0.441	37%	0.369	S	S	.	.	H	α-helix	trans	-71.5	-37.4	174.6	58	0	0	0	0	112.5	L50 V51 F57 V58	L50-S54 VanDerWaalsContact O-CB 3.26Å; L50-S54 WeakPolarHBondContact O-CB 3.4Å; L50-S54 PolarHBondContact O-N 2.97Å; L50-S54 PolarHBondContact O-OG 3.3Å; V51-S54 PolarHBondContact O-N 3.04Å; V51-S54 PolarHBondContact O-OG 3.13Å; V51-S54 VanDerWaalsContact O-OG 3.07Å; S54-F57 PolarHBondContact O-N 2.95Å; S54-V58 WeakPolarHBondContact O-CG2 3.45Å; S54-V58 PolarHBondContact O-N 3.33Å
55	L	95.8	Very high	94.9	Very high	94 Å²	94	67 Å²	67	49%	0.492	37%	0.37	S	S	.	.	H	α-helix	trans	-63.1	-43.3	172.3	-178.5	61.2	0	0	0	111.9	V51 T52 V58 T59 M99	V51-L55 WeakPolarHBondContact O-CB 3.34Å; V51-L55 PolarHBondContact O-N 3.14Å; T52-L55 PolarHBondContact O-N 2.66Å; L55-V58 PolarHBondContact O-N 3.3Å; L55-T59 VanDerWaalsContact O-CB 3.3Å; L55-T59 WeakPolarHBondContact O-CB 3.36Å; L55-T59 PolarHBondContact O-N 2.84Å; L55-T59 PolarHBondContact O-OG1 3.09Å; L55-M99 HydrophobicContact CG-CE 4.43Å; L55-M99 HydrophobicContact CG-SD 4.45Å
56	S	96.3	Very high	95.2	Very high	8 Å²	8	65.8 Å²	65.8	6%	0.056	37%	0.367	C	S	.	.	H	α-helix	trans	-55.6	-53.3	171.9	168.9	0	0	0	0	110.9	T52 G53 V58 T59 V60 G95 N100	T52-S56 WeakPolarHBondContact O-CB 3.31Å; T52-S56 PolarHBondContact O-N 3.31Å; G53-S56 WeakPolarHBondContact O-CB 3.44Å; S56-V58 PolarHBondContact O-N 2.98Å; S56-T59 PolarHBondContact O-N 2.95Å; S56-T59 VanDerWaalsContact O-N 3.16Å; S56-V60 WeakPolarHBondContact O-CB 3.25Å; S56-V60 VanDerWaalsContact O-CG2 3.31Å; S56-V60 WeakPolarHBondContact O-CG2 3.48Å; S56-V60 PolarHBondContact O-N 3.34Å; S56-G95 PolarHBondContact OG-O 3.11Å; S56-N100 PolarHBondContact OG-ND2 3.45Å; S56-N100 PolarHBondContact OG-OD1 2.93Å
57	F	96.3	Very high	95.4	Very high	142 Å²	142	61.2 Å²	61.2	62%	0.623	35%	0.348	S	S	*	.	H	α-helix	trans	-58.4	-43.7	177.6	178.8	-97.5	0	0	0	113.6	G53 S54 T61	G53-F57 WeakPolarHBondContact O-CB 3.36Å; G53-F57 PolarHBondContact O-N 3.01Å; S54-F57 PolarHBondContact O-N 2.95Å; F57-T61 VanDerWaalsContact O-CB 3.27Å; F57-T61 WeakPolarHBondContact O-CB 3.34Å; F57-T61 PolarHBondContact O-N 3.27Å; F57-T61 PolarHBondContact O-OG1 3.29Å
58	V	97.3	Very high	95.5	Very high	95 Å²	95	59 Å²	59	58%	0.576	34%	0.342	S	S	*	.	H	α-helix	trans	-65.5	-40.8	176.4	170	0	0	0	0	111.3	S54 L55 S56 G62	S54-V58 WeakPolarHBondContact O-CG2 3.45Å; S54-V58 PolarHBondContact O-N 3.33Å; L55-V58 PolarHBondContact O-N 3.3Å; S56-V58 PolarHBondContact O-N 2.98Å; V58-G62 PolarHBondContact O-N 3.36Å
59	T	96.6	Very high	95.6	Very high	29 Å²	29	59.2 Å²	59.2	18%	0.178	35%	0.348	C	S	.	.	H	α-helix	trans	-65.2	-45.3	179.3	-59.9	0	0	0	0	111.2	L55 S56 N63 M99	L55-T59 VanDerWaalsContact O-CB 3.3Å; L55-T59 WeakPolarHBondContact O-CB 3.36Å; L55-T59 PolarHBondContact O-N 2.84Å; L55-T59 PolarHBondContact O-OG1 3.09Å; S56-T59 PolarHBondContact O-N 2.95Å; S56-T59 VanDerWaalsContact O-N 3.16Å; T59-N63 WeakPolarHBondContact O-CB 3.38Å; T59-N63 PolarHBondContact O-N 3.37Å; T59-N63 VanDerWaalsContact O-N 3.14Å; T59-N63 PolarHBondContact O-ND2 3.18Å; T59-M99 HydrophobicContact CG2-CE 4.28Å
60	V	97.2	Very high	95.7	Very high	28 Å²	28	58.3 Å²	58.3	17%	0.17	34%	0.339	C	S	.	.	H	α-helix	trans	-63.8	-50.2	176.5	170.4	0	0	0	0	110.7	S56 N63 I64 L92 V96	S56-V60 WeakPolarHBondContact O-CB 3.25Å; S56-V60 VanDerWaalsContact O-CG2 3.31Å; S56-V60 WeakPolarHBondContact O-CG2 3.48Å; S56-V60 PolarHBondContact O-N 3.34Å; V60-N63 PolarHBondContact O-N 2.86Å; V60-I64 HydrophobicContact CG1-CD1 3.71Å; V60-I64 WeakPolarHBondContact O-CB 3.35Å; V60-I64 VanDerWaalsContact O-CG1 3.24Å; V60-I64 WeakPolarHBondContact O-CG1 3.49Å; V60-I64 PolarHBondContact O-N 3.05Å; V60-L92 HydrophobicContact CB-CD1 4.21Å; V60-L92 HydrophobicContact CG1-CD1 3.86Å; V60-L92 HydrophobicContact CG2-CD1 4.26Å; V60-V96 HydrophobicContact CG1-CG2 4.27Å; V60-V96 HydrophobicContact CG2-CG2 3.66Å
61	T	97.6	Very high	95.5	Very high	52 Å²	52	61.4 Å²	61.4	32%	0.319	35%	0.348	S	S	.	.	H	α-helix	trans	-64.1	-45.2	-178.3	-56.4	0	0	0	0	111.7	F57 I64 L65	F57-T61 VanDerWaalsContact O-CB 3.27Å; F57-T61 WeakPolarHBondContact O-CB 3.34Å; F57-T61 PolarHBondContact O-N 3.27Å; F57-T61 PolarHBondContact O-OG1 3.29Å; T61-I64 PolarHBondContact O-N 2.93Å; T61-L65 HydrophobicContact CG2-CD1 4.11Å; T61-L65 VanDerWaalsContact O-CG 3.3Å; T61-L65 WeakPolarHBondContact O-CG 3.15Å; T61-L65 PolarHBondContact O-N 3.24Å
62	G	97.3	Very high	95.4	Very high	32 Å²	32	64.2 Å²	64.2	33%	0.33	37%	0.365	S	S	.	.	H	α-helix	trans	-61	-46.9	179.2	0	0	0	0	0	112.6	V58 L65 V66	V58-G62 PolarHBondContact O-N 3.36Å; G62-L65 PolarHBondContact O-N 3.3Å; G62-V66 WeakPolarHBondContact O-CG2 3.38Å; G62-V66 PolarHBondContact O-N 3.32Å
63	N	97.3	Very high	95.3	Very high	26 Å²	26	66.1 Å²	66.1	14%	0.139	37%	0.374	C	S	.	.	H	α-helix	trans	-69.7	-36.9	179.7	-75.4	-57.2	0	0	0	112.8	T59 V60 L65 V66 M67 A88 D91 L92	T59-N63 WeakPolarHBondContact O-CB 3.38Å; T59-N63 PolarHBondContact O-N 3.37Å; T59-N63 VanDerWaalsContact O-N 3.14Å; T59-N63 PolarHBondContact O-ND2 3.18Å; V60-N63 PolarHBondContact O-N 2.86Å; N63-L65 VanDerWaalsContact C-N 3.34Å; N63-L65 PolarHBondContact O-N 3.24Å; N63-V66 PolarHBondContact O-N 2.84Å; N63-M67 VanDerWaalsContact O-CG 3.31Å; N63-M67 WeakPolarHBondContact O-CG 3.11Å; N63-M67 PolarHBondContact O-N 2.76Å; N63-A88 HydrophobicContact CB-CB 4.2Å; N63-A88 WeakPolarHBondContact OD1-CA 3.3Å; N63-D91 WeakPolarHBondContact ND2-CB 3.47Å; N63-L92 HydrophobicContact CB-CB 4.14Å
64	I	97.4	Very high	94.9	Very high	71 Å²	71	74.8 Å²	74.8	36%	0.364	40%	0.397	S	S	.	.	H	α-helix	trans	-59.4	-44.5	170.4	-71.9	168.9	0	0	0	110.8	V60 T61 V66 M67 L68 L92	V60-I64 HydrophobicContact CG1-CD1 3.71Å; V60-I64 WeakPolarHBondContact O-CB 3.35Å; V60-I64 VanDerWaalsContact O-CG1 3.24Å; V60-I64 WeakPolarHBondContact O-CG1 3.49Å; V60-I64 PolarHBondContact O-N 3.05Å; T61-I64 PolarHBondContact O-N 2.93Å; I64-V66 PolarHBondContact O-N 3.24Å; I64-M67 PolarHBondContact O-N 3.25Å; I64-L68 HydrophobicContact CG2-CD1 3.71Å; I64-L68 HydrophobicContact CG2-CG 4.18Å; I64-L68 WeakPolarHBondContact O-CB 3.46Å; I64-L68 VanDerWaalsContact O-CG 3.25Å; I64-L68 WeakPolarHBondContact O-CG 3.47Å; I64-L68 PolarHBondContact O-N 3.06Å; I64-L92 HydrophobicContact CD1-CD1 4.18Å; I64-L92 HydrophobicContact CG1-CD1 3.93Å; I64-L92 HydrophobicContact CG1-CD2 4.26Å
65	L	96.6	Very high	94.3	Very high	109 Å²	109	79 Å²	79	57%	0.571	41%	0.41	S	S	*	.	H	α-helix	trans	-63.2	-39.9	177.1	-71.7	170.1	0	0	0	112.5	T61 G62 N63 L68 S69	T61-L65 HydrophobicContact CG2-CD1 4.11Å; T61-L65 VanDerWaalsContact O-CG 3.3Å; T61-L65 WeakPolarHBondContact O-CG 3.15Å; T61-L65 PolarHBondContact O-N 3.24Å; G62-L65 PolarHBondContact O-N 3.3Å; N63-L65 VanDerWaalsContact C-N 3.34Å; N63-L65 PolarHBondContact O-N 3.24Å; L65-L68 PolarHBondContact O-N 2.91Å; L65-S69 WeakPolarHBondContact O-CB 3.31Å; L65-S69 PolarHBondContact O-N 3.47Å
66	V	95.5	Very high	93.6	Very high	58 Å²	58	77.4 Å²	77.4	35%	0.352	40%	0.402	S	S	.	.	H	α-helix	trans	-60.3	-51.8	172.9	171.5	0	0	0	0	110.6	G62 N63 I64 L68 S69 I70 A88	G62-V66 WeakPolarHBondContact O-CG2 3.38Å; G62-V66 PolarHBondContact O-N 3.32Å; N63-V66 PolarHBondContact O-N 2.84Å; I64-V66 PolarHBondContact O-N 3.24Å; V66-L68 VanDerWaalsContact C-N 3.35Å; V66-L68 PolarHBondContact O-N 3.36Å; V66-S69 PolarHBondContact O-N 3.5Å; V66-S69 PolarHBondContact O-OG 3.4Å; V66-I70 HydrophobicContact CG1-CD1 4.01Å; V66-I70 WeakPolarHBondContact O-CG1 3.24Å; V66-I70 PolarHBondContact O-N 3.31Å; V66-A88 HydrophobicContact CB-CB 4.19Å; V66-A88 HydrophobicContact CG1-CB 3.88Å
67	M	95	Very high	93	Very high	40 Å²	40	80.5 Å²	80.5	20%	0.197	42%	0.415	C	S	.	.	H	α-helix	trans	-59	-43.2	178.6	-69.8	173.3	70.7	0	0	112.4	N63 I64 K71 F85 A88 C89 L92	N63-M67 VanDerWaalsContact O-CG 3.31Å; N63-M67 WeakPolarHBondContact O-CG 3.11Å; N63-M67 PolarHBondContact O-N 2.76Å; I64-M67 PolarHBondContact O-N 3.25Å; M67-K71 VanDerWaalsContact O-CB 3.31Å; M67-K71 WeakPolarHBondContact O-CB 3.48Å; M67-K71 PolarHBondContact O-N 3.41Å; M67-K71 VanDerWaalsContact O-N 3.09Å; M67-F85 HydrophobicContact CB-CD2 4.16Å; M67-F85 HydrophobicContact CB-CE2 3.78Å; M67-F85 HydrophobicContact CE-CE1 4.39Å; M67-F85 HydrophobicContact CE-CE2 4.07Å; M67-F85 HydrophobicContact CE-CZ 3.75Å; M67-F85 HydrophobicContact CG-CD2 4.05Å; M67-F85 HydrophobicContact CG-CE2 3.88Å; M67-F85 HydrophobicContact CG-CZ 4.45Å; M67-A88 HydrophobicContact CG-CB 3.75Å; M67-A88 HydrophobicContact SD-CB 4.44Å; M67-C89 VanDerWaalsContact CE-SG 3.59Å; M67-L92 HydrophobicContact SD-CD2 3.81Å
68	L	95.1	Very high	92.6	Very high	87 Å²	87	75.4 Å²	75.4	46%	0.455	40%	0.396	S	S	.	.	H	α-helix	trans	-65.4	-42.2	177.2	-73	174.5	0	0	0	112	I64 L65 V66 I70 K71 V72	I64-L68 HydrophobicContact CG2-CD1 3.71Å; I64-L68 HydrophobicContact CG2-CG 4.18Å; I64-L68 WeakPolarHBondContact O-CB 3.46Å; I64-L68 VanDerWaalsContact O-CG 3.25Å; I64-L68 WeakPolarHBondContact O-CG 3.47Å; I64-L68 PolarHBondContact O-N 3.06Å; L65-L68 PolarHBondContact O-N 2.91Å; V66-L68 VanDerWaalsContact C-N 3.35Å; V66-L68 PolarHBondContact O-N 3.36Å; L68-I70 VanDerWaalsContact C-N 3.31Å; L68-I70 PolarHBondContact O-N 2.8Å; L68-K71 PolarHBondContact O-N 3.32Å; L68-V72 WeakPolarHBondContact O-CB 3.27Å; L68-V72 WeakPolarHBondContact O-CG2 3.4Å; L68-V72 PolarHBondContact O-N 3.24Å
69	S	94.7	Very high	92.1	Very high	56 Å²	56	72.1 Å²	72.1	39%	0.392	38%	0.376	S	S	.	.	H	α-helix	trans	-59.6	-41.1	-179.3	74.9	0	0	0	0	112.6	L65 V66 N73	L65-S69 WeakPolarHBondContact O-CB 3.31Å; L65-S69 PolarHBondContact O-N 3.47Å; V66-S69 PolarHBondContact O-N 3.5Å; V66-S69 PolarHBondContact O-OG 3.4Å; S69-N73 WeakPolarHBondContact O-CB 3.4Å; S69-N73 PolarHBondContact O-N 3.4Å
70	I	92.8	Very high	91.6	Very high	13 Å²	13	72.4 Å²	72.4	7%	0.067	38%	0.376	C	S	.	.	H	α-helix	trans	-74.7	-34	178.8	-60.3	163.9	0	0	0	111.1	V66 L68 Q77 N81 L84 F85	V66-I70 HydrophobicContact CG1-CD1 4.01Å; V66-I70 WeakPolarHBondContact O-CG1 3.24Å; V66-I70 PolarHBondContact O-N 3.31Å; L68-I70 VanDerWaalsContact C-N 3.31Å; L68-I70 PolarHBondContact O-N 2.8Å; I70-Q77 WeakPolarHBondContact O-CG 3.34Å; I70-Q77 PolarHBondContact O-NE2 3.29Å; I70-N81 HydrophobicContact CD1-CB 4.33Å; I70-N81 HydrophobicContact CG1-CB 4.38Å; I70-N81 HydrophobicContact CG2-CB 4.37Å; I70-L84 HydrophobicContact CD1-CB 4.5Å; I70-F85 HydrophobicContact CB-CD2 4.48Å; I70-F85 HydrophobicContact CD1-CB 4.12Å; I70-F85 HydrophobicContact CG2-CD2 4.49Å
71	K	90.2	Very high	91.3	Very high	159 Å²	159	72.6 Å²	72.6	69%	0.691	38%	0.376	S	S	*	.	H	α-helix	trans	-73.6	-41.1	178.6	-170.2	173.5	-177.8	178.8	0	112.6	M67 L68	M67-K71 VanDerWaalsContact O-CB 3.31Å; M67-K71 WeakPolarHBondContact O-CB 3.48Å; M67-K71 PolarHBondContact O-N 3.41Å; M67-K71 VanDerWaalsContact O-N 3.09Å; L68-K71 PolarHBondContact O-N 3.32Å
72	V	93.8	Very high	91	Very high	122 Å²	122	74.1 Å²	74.1	74%	0.739	38%	0.377	S	S	*	.	H	α-helix	trans	-76.4	-47.8	-179.8	173.5	0	0	0	0	111.3	L68 R74	L68-V72 WeakPolarHBondContact O-CB 3.27Å; L68-V72 WeakPolarHBondContact O-CG2 3.4Å; L68-V72 PolarHBondContact O-N 3.24Å; V72-R74 PolarHBondContact O-N 2.85Å
73	N	90.3	Very high	90.8	Very high	74 Å²	74	72.7 Å²	72.7	40%	0.396	36%	0.361	S	S	.	.			trans	-89.6	99.5	-175.7	-169.7	-13.8	0	0	0	111.9	S69 H75 L76	S69-N73 WeakPolarHBondContact O-CB 3.4Å; S69-N73 PolarHBondContact O-N 3.4Å; N73-H75 PolarHBondContact O-N 3.21Å; N73-H75 VanDerWaalsContact O-N 3.11Å; N73-H75 VanDerWaalsContact OD1-CB 3.24Å; N73-H75 WeakPolarHBondContact OD1-CB 3.29Å; N73-H75 PolarHBondContact OD1-N 2.92Å; N73-L76 HydrophobicContact CB-CB 4.3Å; N73-L76 HydrophobicContact CB-CD1 3.96Å; N73-L76 HydrophobicContact CB-CG 3.97Å; N73-L76 WeakPolarHBondContact O-CA 3.37Å; N73-L76 WeakPolarHBondContact O-CB 3.37Å; N73-L76 PolarHBondContact O-N 3.42Å
74	R	84.4	Confident	90.5	Very high	212 Å²	212	75.3 Å²	75.3	80%	0.8	38%	0.375	S	S	*	.	G	3₁₀ helix	trans	-59	-21.9	176.7	-169.4	168.3	-175.9	161.4	2.8	114.3	V72 L76 Q77	V72-R74 PolarHBondContact O-N 2.85Å; R74-L76 VanDerWaalsContact C-N 3.28Å; R74-Q77 PolarHBondContact O-N 3.07Å
75	H	82.2	Confident	90.4	Very high	153 Å²	153	75 Å²	75	71%	0.708	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-71.1	-24.2	172.3	-166.4	-69	0	0	0	112.3	N73 Q77	N73-H75 PolarHBondContact O-N 3.21Å; N73-H75 VanDerWaalsContact O-N 3.11Å; N73-H75 VanDerWaalsContact OD1-CB 3.24Å; N73-H75 WeakPolarHBondContact OD1-CB 3.29Å; N73-H75 PolarHBondContact OD1-N 2.92Å; H75-Q77 VanDerWaalsContact C-N 3.32Å
76	L	82.9	Confident	90.4	Very high	60 Å²	60	70 Å²	70	31%	0.314	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-87.3	6	177.1	-61.4	-178.2	0	0	0	113.3	N73 R74 T78 N81	N73-L76 HydrophobicContact CB-CB 4.3Å; N73-L76 HydrophobicContact CB-CD1 3.96Å; N73-L76 HydrophobicContact CB-CG 3.97Å; N73-L76 WeakPolarHBondContact O-CA 3.37Å; N73-L76 WeakPolarHBondContact O-CB 3.37Å; N73-L76 PolarHBondContact O-N 3.42Å; R74-L76 VanDerWaalsContact C-N 3.28Å; L76-T78 PolarHBondContact O-N 3.07Å; L76-N81 WeakPolarHBondContact O-CB 3.45Å; L76-N81 PolarHBondContact O-ND2 3.16Å
77	Q	83.2	Confident	90.3	Very high	72 Å²	72	68.2 Å²	68.2	34%	0.336	33%	0.334	S	S	.	.			trans	-82.5	47.1	178.3	-66.2	177.5	-4.2	0	0	112	I70 R74 H75	I70-Q77 WeakPolarHBondContact O-CG 3.34Å; I70-Q77 PolarHBondContact O-NE2 3.29Å; R74-Q77 PolarHBondContact O-N 3.07Å; H75-Q77 VanDerWaalsContact C-N 3.32Å
78	T	87.5	Confident	90.4	Very high	35 Å²	35	66.4 Å²	66.4	22%	0.215	33%	0.325	C	S	.	.			trans	-81.5	159.7	176.2	77.8	0	0	0	0	110.8	L76 N80 N81 Y82	L76-T78 PolarHBondContact O-N 3.07Å; T78-N80 PolarHBondContact O-N 3.4Å; T78-N81 PolarHBondContact O-N 2.95Å; T78-N81 VanDerWaalsContact O-N 3.07Å; T78-N81 VanDerWaalsContact OG1-CG 3.27Å; T78-N81 PolarHBondContact OG1-N 3.31Å; T78-N81 PolarHBondContact OG1-OD1 3.23Å; T78-Y82 WeakPolarHBondContact O-CD2 3.4Å; T78-Y82 PolarHBondContact O-N 3.09Å
79	V	85.8	Confident	90.5	Very high	27 Å²	27	63.7 Å²	63.7	16%	0.164	31%	0.313	C	S	.	.	H	α-helix	trans	-67	-20.8	-177.8	-158.6	0	0	0	0	112.6	R157 T159 A162	V79-R157 HydrophobicContact CB-CG 4.29Å; V79-R157 HydrophobicContact CG1-CG 3.84Å; V79-R157 HydrophobicContact CG2-CG 4.42Å; V79-R157 PolarHBondContact O-NH2 3.03Å; V79-T159 HydrophobicContact CG2-CG2 3.95Å; V79-A162 HydrophobicContact CG1-CB 3.34Å
80	N	86.3	Confident	90.6	Very high	35 Å²	35	61 Å²	61	19%	0.187	30%	0.295	C	S	.	.	H	α-helix	trans	-71.6	-44	171.4	-69.9	-14.9	0	0	0	110.8	T78 Y82 F83 L84 R157	T78-N80 PolarHBondContact O-N 3.4Å; N80-Y82 VanDerWaalsContact C-N 3.26Å; N80-Y82 PolarHBondContact O-N 3.1Å; N80-F83 WeakPolarHBondContact O-CB 3.32Å; N80-F83 PolarHBondContact O-N 3.27Å; N80-L84 PolarHBondContact O-N 3.15Å; N80-R157 VanDerWaalsContact OD1-CZ 3.28Å; N80-R157 PolarHBondContact OD1-NH1 3.07Å; N80-R157 PolarHBondContact OD1-NH2 3.4Å
81	N	91.8	Very high	90.7	Very high	31 Å²	31	62.9 Å²	62.9	17%	0.166	31%	0.305	C	S	.	.	H	α-helix	trans	-72.5	-21.4	-173.2	-62.9	2.5	0	0	0	112	I70 L76 T78 F83 L84 F85	I70-N81 HydrophobicContact CD1-CB 4.33Å; I70-N81 HydrophobicContact CG1-CB 4.38Å; I70-N81 HydrophobicContact CG2-CB 4.37Å; L76-N81 WeakPolarHBondContact O-CB 3.45Å; L76-N81 PolarHBondContact O-ND2 3.16Å; T78-N81 PolarHBondContact O-N 2.95Å; T78-N81 VanDerWaalsContact O-N 3.07Å; T78-N81 VanDerWaalsContact OG1-CG 3.27Å; T78-N81 PolarHBondContact OG1-N 3.31Å; T78-N81 PolarHBondContact OG1-OD1 3.23Å; N81-F83 VanDerWaalsContact C-N 3.33Å; N81-L84 PolarHBondContact O-N 3.11Å; N81-F85 WeakPolarHBondContact O-CB 3.35Å; N81-F85 PolarHBondContact O-N 3.46Å
82	Y	91.4	Very high	91	Very high	84 Å²	84	56.9 Å²	56.9	33%	0.329	28%	0.28	S	S	.	.	H	α-helix	trans	-62.3	-35.9	166.1	-86	-79.5	0	0	0	113.2	T78 N80 S86 T159 I166	T78-Y82 WeakPolarHBondContact O-CD2 3.4Å; T78-Y82 PolarHBondContact O-N 3.09Å; N80-Y82 VanDerWaalsContact C-N 3.26Å; N80-Y82 PolarHBondContact O-N 3.1Å; Y82-S86 PolarHBondContact O-N 3.48Å; Y82-S86 VanDerWaalsContact O-N 3.17Å; Y82-T159 HydrophobicContact CD2-CG2 3.94Å; Y82-T159 HydrophobicContact CE2-CG2 3.61Å; Y82-I166 WeakPolarHBondContact O-CD1 3.4Å
83	F	91.6	Very high	91.2	Very high	2 Å²	2	53.3 Å²	53.3	1%	0.009	26%	0.256	C	S	.	.	H	α-helix	trans	-72.4	-41.5	174.1	-60.5	-51	0	0	0	111.3	N80 N81 F85 S86 L87 I138 I139 D142 R157 A162 M165 I166	N80-F83 WeakPolarHBondContact O-CB 3.32Å; N80-F83 PolarHBondContact O-N 3.27Å; N81-F83 VanDerWaalsContact C-N 3.33Å; F83-F85 VanDerWaalsContact C-N 3.27Å; F83-F85 PolarHBondContact O-N 2.99Å; F83-S86 PolarHBondContact O-N 3.25Å; F83-L87 PolarHBondContact O-N 3.07Å; F83-I138 HydrophobicContact CD1-CG2 3.99Å; F83-I138 HydrophobicContact CE1-CG2 3.38Å; F83-I138 HydrophobicContact CE2-CG2 3.96Å; F83-I138 HydrophobicContact CZ-CG2 3.36Å; F83-I139 HydrophobicContact CB-CD1 3.74Å; F83-I139 HydrophobicContact CB-CG1 3.53Å; F83-I139 HydrophobicContact CD2-CG1 3.93Å; F83-I139 HydrophobicContact CG-CG1 3.93Å; F83-D142 HydrophobicContact CE2-CB 4.43Å; F83-R157 VanDerWaalsContact CE2-NH2 3.32Å; F83-A162 HydrophobicContact CE1-CB 3.82Å; F83-A162 HydrophobicContact CE2-CB 4.44Å; F83-A162 HydrophobicContact CZ-CB 3.7Å; F83-M165 HydrophobicContact CE1-CB 4.42Å; F83-I166 HydrophobicContact CD1-CD1 3.75Å; F83-I166 HydrophobicContact CD1-CG1 3.59Å; F83-I166 HydrophobicContact CE1-CD1 4.17Å; F83-I166 HydrophobicContact CE1-CG1 3.86Å
84	L	92.9	Very high	91.4	Very high	81 Å²	81	51.5 Å²	51.5	42%	0.424	25%	0.246	S	C	.	.	H	α-helix	trans	-59.9	-37.2	173.2	-60.8	179.4	0	0	0	112.3	I70 N80 N81 L87 A88	I70-L84 HydrophobicContact CD1-CB 4.5Å; N80-L84 PolarHBondContact O-N 3.15Å; N81-L84 PolarHBondContact O-N 3.11Å; L84-L87 HydrophobicContact CD2-CD1 4.36Å; L84-L87 PolarHBondContact O-N 3.44Å; L84-A88 PolarHBondContact O-N 2.97Å
85	F	94.7	Very high	92	Very high	65 Å²	65	41.4 Å²	41.4	29%	0.285	21%	0.208	S	C	.	.	H	α-helix	trans	-63.5	-39.9	173	-174.9	-87.3	0	0	0	111.9	M67 I70 N81 F83 A88 C89	M67-F85 HydrophobicContact CB-CD2 4.16Å; M67-F85 HydrophobicContact CB-CE2 3.78Å; M67-F85 HydrophobicContact CE-CE1 4.39Å; M67-F85 HydrophobicContact CE-CE2 4.07Å; M67-F85 HydrophobicContact CE-CZ 3.75Å; M67-F85 HydrophobicContact CG-CD2 4.05Å; M67-F85 HydrophobicContact CG-CE2 3.88Å; M67-F85 HydrophobicContact CG-CZ 4.45Å; I70-F85 HydrophobicContact CB-CD2 4.48Å; I70-F85 HydrophobicContact CD1-CB 4.12Å; I70-F85 HydrophobicContact CG2-CD2 4.49Å; N81-F85 WeakPolarHBondContact O-CB 3.35Å; N81-F85 PolarHBondContact O-N 3.46Å; F83-F85 VanDerWaalsContact C-N 3.27Å; F83-F85 PolarHBondContact O-N 2.99Å; F85-A88 PolarHBondContact O-N 3.28Å; F85-C89 PolarHBondContact O-N 2.67Å; F85-C89 PolarHBondContact O-SG 2.83Å
86	S	95.6	Very high	92.6	Very high	5 Å²	5	36.9 Å²	36.9	4%	0.035	19%	0.191	C	C	.	.	H	α-helix	trans	-69.1	-32.2	175.8	-172.6	0	0	0	0	113.5	Y82 F83 A90 N135 I166 W170	Y82-S86 PolarHBondContact O-N 3.48Å; Y82-S86 VanDerWaalsContact O-N 3.17Å; F83-S86 PolarHBondContact O-N 3.25Å; S86-A90 PolarHBondContact O-N 2.92Å; S86-N135 PolarHBondContact OG-ND2 3.46Å; S86-N135 PolarHBondContact OG-OD1 2.92Å; S86-I166 WeakPolarHBondContact OG-CG2 3.46Å; S86-W170 PolarHBondContact OG-NE1 3.39Å
87	L	94.3	Very high	93.1	Very high	19 Å²	19	39 Å²	39	10%	0.099	20%	0.198	C	C	.	.	H	α-helix	trans	-65.7	-50.8	171.8	-66.7	172.2	0	0	0	109.9	F83 L84 C89 A90 D91 S132 N135 L136 I139	F83-L87 PolarHBondContact O-N 3.07Å; L84-L87 HydrophobicContact CD2-CD1 4.36Å; L84-L87 PolarHBondContact O-N 3.44Å; L87-C89 PolarHBondContact O-N 2.9Å; L87-C89 VanDerWaalsContact O-N 3.15Å; L87-A90 WeakPolarHBondContact O-CA 3.41Å; L87-A90 WeakPolarHBondContact O-CB 3.48Å; L87-A90 PolarHBondContact O-N 3.28Å; L87-D91 VanDerWaalsContact O-CG 3.25Å; L87-D91 PolarHBondContact O-N 2.98Å; L87-S132 WeakPolarHBondContact CD2-OG 3.27Å; L87-N135 HydrophobicContact CD2-CB 3.62Å; L87-N135 HydrophobicContact CG-CB 4.23Å; L87-L136 HydrophobicContact CD1-CD2 3.67Å; L87-L136 HydrophobicContact CD1-CG 4.41Å; L87-L136 HydrophobicContact CD2-CD2 4.04Å; L87-L136 HydrophobicContact CD2-CG 3.87Å; L87-I139 HydrophobicContact CD1-CD1 3.68Å
88	A	96.9	Very high	93.6	Very high	2 Å²	2	35.9 Å²	35.9	2%	0.017	18%	0.184	C	C	.	.	H	α-helix	trans	-57.4	-33.5	177	0	0	0	0	0	113.1	N63 V66 M67 L84 F85 L92	N63-A88 HydrophobicContact CB-CB 4.2Å; N63-A88 WeakPolarHBondContact OD1-CA 3.3Å; V66-A88 HydrophobicContact CB-CB 4.19Å; V66-A88 HydrophobicContact CG1-CB 3.88Å; M67-A88 HydrophobicContact CG-CB 3.75Å; M67-A88 HydrophobicContact SD-CB 4.44Å; L84-A88 PolarHBondContact O-N 2.97Å; F85-A88 PolarHBondContact O-N 3.28Å; A88-L92 WeakPolarHBondContact O-CB 3.3Å; A88-L92 PolarHBondContact O-N 3.15Å
89	C	96.7	Very high	93.9	Very high	31 Å²	31	36.3 Å²	36.3	21%	0.209	18%	0.184	C	C	.	.	H	α-helix	trans	-63.7	-42.6	169.8	-71.6	0	0	0	0	113.3	M67 F85 L87 I93	M67-C89 VanDerWaalsContact CE-SG 3.59Å; F85-C89 PolarHBondContact O-N 2.67Å; F85-C89 PolarHBondContact O-SG 2.83Å; L87-C89 PolarHBondContact O-N 2.9Å; L87-C89 VanDerWaalsContact O-N 3.15Å; C89-I93 WeakPolarHBondContact O-CD1 3.24Å; C89-I93 VanDerWaalsContact O-CG1 3.29Å; C89-I93 WeakPolarHBondContact O-CG1 3.41Å; C89-I93 PolarHBondContact O-N 3.07Å
90	A	96.6	Very high	94.2	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.191	C	C	.	.	H	α-helix	trans	-69.3	-48.8	179.1	0	0	0	0	0	111.3	S86 L87 L92 I93 I94 V128 W170	S86-A90 PolarHBondContact O-N 2.92Å; L87-A90 WeakPolarHBondContact O-CA 3.41Å; L87-A90 WeakPolarHBondContact O-CB 3.48Å; L87-A90 PolarHBondContact O-N 3.28Å; A90-L92 VanDerWaalsContact C-N 3.26Å; A90-L92 PolarHBondContact O-N 3.43Å; A90-I93 PolarHBondContact O-N 3.17Å; A90-I94 PolarHBondContact O-N 3.37Å; A90-V128 HydrophobicContact CB-CG1 3.7Å; A90-V128 VanDerWaalsContact O-CG1 3.24Å; A90-V128 WeakPolarHBondContact O-CG1 3.39Å; A90-W170 HydrophobicContact CB-CH2 3.98Å; A90-W170 HydrophobicContact CB-CZ2 3.92Å
91	D	96.1	Very high	94.5	Very high	52 Å²	52	38 Å²	38	28%	0.278	19%	0.192	S	C	.	.	H	α-helix	trans	-65.5	-30.9	-179.4	-55.3	-30.3	0	0	0	111.3	N63 L87 G95	N63-D91 WeakPolarHBondContact ND2-CB 3.47Å; L87-D91 VanDerWaalsContact O-CG 3.25Å; L87-D91 PolarHBondContact O-N 2.98Å; D91-G95 PolarHBondContact O-N 3.36Å
92	L	96.9	Very high	94.5	Very high	32 Å²	32	42.5 Å²	42.5	17%	0.168	21%	0.208	C	C	.	.	H	α-helix	trans	-65.8	-41.7	169.4	179.3	63.3	0	0	0	112.5	V60 N63 I64 M67 A88 A90 G95 V96	V60-L92 HydrophobicContact CB-CD1 4.21Å; V60-L92 HydrophobicContact CG1-CD1 3.86Å; V60-L92 HydrophobicContact CG2-CD1 4.26Å; N63-L92 HydrophobicContact CB-CB 4.14Å; I64-L92 HydrophobicContact CD1-CD1 4.18Å; I64-L92 HydrophobicContact CG1-CD1 3.93Å; I64-L92 HydrophobicContact CG1-CD2 4.26Å; M67-L92 HydrophobicContact SD-CD2 3.81Å; A88-L92 WeakPolarHBondContact O-CB 3.3Å; A88-L92 PolarHBondContact O-N 3.15Å; A90-L92 VanDerWaalsContact C-N 3.26Å; A90-L92 PolarHBondContact O-N 3.43Å; L92-G95 PolarHBondContact O-N 2.98Å; L92-V96 HydrophobicContact CD1-CG2 3.89Å; L92-V96 HydrophobicContact CG-CG2 4.36Å; L92-V96 WeakPolarHBondContact O-CB 3.31Å; L92-V96 VanDerWaalsContact O-CG2 3.3Å; L92-V96 WeakPolarHBondContact O-CG2 3.43Å; L92-V96 PolarHBondContact O-N 3.23Å
93	I	96.6	Very high	94.5	Very high	48 Å²	48	39.2 Å²	39.2	25%	0.246	20%	0.196	C	C	.	.	H	α-helix	trans	-67.3	-41.1	178.2	-69	162.5	0	0	0	110.5	C89 A90 V96 F97 L124 V128 W170	C89-I93 WeakPolarHBondContact O-CD1 3.24Å; C89-I93 VanDerWaalsContact O-CG1 3.29Å; C89-I93 WeakPolarHBondContact O-CG1 3.41Å; C89-I93 PolarHBondContact O-N 3.07Å; A90-I93 PolarHBondContact O-N 3.17Å; I93-V96 PolarHBondContact O-N 3.01Å; I93-F97 HydrophobicContact CG2-CD2 4.03Å; I93-F97 WeakPolarHBondContact O-CB 3.5Å; I93-F97 WeakPolarHBondContact O-CD2 3.04Å; I93-F97 PolarHBondContact O-N 2.99Å; I93-L124 HydrophobicContact CG2-CD1 4.05Å; I93-L124 HydrophobicContact CG2-CD2 4.12Å; I93-L124 HydrophobicContact CG2-CG 4.14Å; I93-V128 HydrophobicContact CB-CG1 4.14Å; I93-V128 HydrophobicContact CB-CG2 4.38Å; I93-V128 HydrophobicContact CG2-CB 4.49Å; I93-V128 HydrophobicContact CG2-CG1 4.21Å; I93-V128 HydrophobicContact CG2-CG2 3.7Å; I93-W170 HydrophobicContact CD1-CH2 4.05Å
94	I	95.6	Very high	94.5	Very high	36 Å²	36	42 Å²	42	19%	0.185	21%	0.213	C	C	.	.	I	π-helix	trans	-62.3	-44.6	173.6	-67.1	168.6	0	0	0	110.7	A90 S98 M99 V128	A90-I94 PolarHBondContact O-N 3.37Å; I94-S98 WeakPolarHBondContact O-CA 3.35Å; I94-S98 WeakPolarHBondContact O-CB 3.4Å; I94-S98 PolarHBondContact O-N 2.79Å; I94-M99 PolarHBondContact O-N 3.48Å; I94-V128 HydrophobicContact CD1-CG1 3.97Å; I94-V128 HydrophobicContact CG1-CB 4.41Å; I94-V128 HydrophobicContact CG1-CG1 3.74Å
95	G	95.3	Very high	94.4	Very high	0 Å²	0	40.7 Å²	40.7	0%	0	20%	0.203	C	C	.	.	I	π-helix	trans	-64.9	-41.1	177.5	0	0	0	0	0	114.1	S56 D91 L92 N100	S56-G95 PolarHBondContact OG-O 3.11Å; D91-G95 PolarHBondContact O-N 3.36Å; L92-G95 PolarHBondContact O-N 2.98Å; G95-N100 PolarHBondContact O-ND2 3.29Å
96	V	95	Very high	94.2	Very high	57 Å²	57	40.7 Å²	40.7	35%	0.345	21%	0.205	S	C	.	.	I	π-helix	trans	-77.1	-43.7	-179.6	173.3	0	0	0	0	112.3	V60 L92 I93 N100	V60-V96 HydrophobicContact CG1-CG2 4.27Å; V60-V96 HydrophobicContact CG2-CG2 3.66Å; L92-V96 HydrophobicContact CD1-CG2 3.89Å; L92-V96 HydrophobicContact CG-CG2 4.36Å; L92-V96 WeakPolarHBondContact O-CB 3.31Å; L92-V96 VanDerWaalsContact O-CG2 3.3Å; L92-V96 WeakPolarHBondContact O-CG2 3.43Å; L92-V96 PolarHBondContact O-N 3.23Å; I93-V96 PolarHBondContact O-N 3.01Å; V96-N100 PolarHBondContact O-ND2 3.44Å
97	F	94.3	Very high	93.8	Very high	104 Å²	104	43.3 Å²	43.3	46%	0.456	22%	0.219	S	C	.	.	I	π-helix	trans	-103.1	-60.3	-172.4	-62.7	-81.1	0	0	0	111.9	I93 N100 L101 L124	I93-F97 HydrophobicContact CG2-CD2 4.03Å; I93-F97 WeakPolarHBondContact O-CB 3.5Å; I93-F97 WeakPolarHBondContact O-CD2 3.04Å; I93-F97 PolarHBondContact O-N 2.99Å; F97-N100 PolarHBondContact O-N 2.73Å; F97-L101 WeakPolarHBondContact O-CB 3.42Å; F97-L101 WeakPolarHBondContact O-CG 3.29Å; F97-L101 PolarHBondContact O-N 3.4Å; F97-L124 HydrophobicContact CB-CD2 4Å; F97-L124 HydrophobicContact CD2-CD2 4.4Å; F97-L124 HydrophobicContact CG-CD2 4.15Å
98	S	93.6	Very high	93.5	Very high	7 Å²	7	46 Å²	46	5%	0.049	24%	0.235	C	C	.	.	I	π-helix	trans	-63.2	-49.4	-170.6	-53.7	0	0	0	0	113.4	I94 N100 Y102 D125	I94-S98 WeakPolarHBondContact O-CA 3.35Å; I94-S98 WeakPolarHBondContact O-CB 3.4Å; I94-S98 PolarHBondContact O-N 2.79Å; S98-N100 VanDerWaalsContact C-N 3.33Å; S98-N100 PolarHBondContact O-N 3.23Å; S98-Y102 WeakPolarHBondContact O-CB 3.43Å; S98-Y102 PolarHBondContact O-N 2.98Å; S98-D125 WeakPolarHBondContact CB-OD1 3.4Å; S98-D125 PolarHBondContact OG-OD1 2.84Å
99	M	93.3	Very high	93	Very high	44 Å²	44	49 Å²	49	22%	0.217	27%	0.266	C	S	.	.	H	α-helix	trans	-60.9	-41.9	180	-70.1	-173.2	176.3	0	0	112	L55 T59 I94 T103	L55-M99 HydrophobicContact CG-CE 4.43Å; L55-M99 HydrophobicContact CG-SD 4.45Å; T59-M99 HydrophobicContact CG2-CE 4.28Å; I94-M99 PolarHBondContact O-N 3.48Å; M99-T103 WeakPolarHBondContact O-CB 3.39Å; M99-T103 PolarHBondContact O-N 2.77Å; M99-T103 PolarHBondContact O-OG1 3.49Å
100	N	92.8	Very high	92.6	Very high	59 Å²	59	49.8 Å²	49.8	32%	0.316	27%	0.272	S	S	.	.	H	α-helix	trans	-76.2	-39.4	-176.4	-60.1	-53.8	0	0	0	112	S56 G95 V96 F97 S98 T103 V104	S56-N100 PolarHBondContact OG-ND2 3.45Å; S56-N100 PolarHBondContact OG-OD1 2.93Å; G95-N100 PolarHBondContact O-ND2 3.29Å; V96-N100 PolarHBondContact O-ND2 3.44Å; F97-N100 PolarHBondContact O-N 2.73Å; S98-N100 VanDerWaalsContact C-N 3.33Å; S98-N100 PolarHBondContact O-N 3.23Å; N100-T103 WeakPolarHBondContact O-CB 3.48Å; N100-T103 PolarHBondContact O-N 2.86Å; N100-V104 WeakPolarHBondContact O-CG2 3.31Å; N100-V104 PolarHBondContact O-N 3.41Å
101	L	92.9	Very high	92.4	Very high	39 Å²	39	50.6 Å²	50.6	20%	0.204	28%	0.276	C	S	.	.	H	α-helix	trans	-66.9	-39.8	174.5	-70.3	170.2	0	0	0	112	F97 V104 Y105 W111 L113 W121	F97-L101 WeakPolarHBondContact O-CB 3.42Å; F97-L101 WeakPolarHBondContact O-CG 3.29Å; F97-L101 PolarHBondContact O-N 3.4Å; L101-V104 PolarHBondContact O-N 2.9Å; L101-Y105 PolarHBondContact O-N 3.18Å; L101-W111 HydrophobicContact CB-CH2 4.35Å; L101-W111 HydrophobicContact CD2-CH2 4.38Å; L101-L113 HydrophobicContact CD2-CD1 3.55Å; L101-W121 HydrophobicContact CB-CD2 4.31Å; L101-W121 HydrophobicContact CB-CG 4.29Å; L101-W121 HydrophobicContact CD1-CB 4.02Å; L101-W121 HydrophobicContact CD1-CG 3.74Å
102	Y	91.8	Very high	92	Very high	125 Å²	125	51.8 Å²	51.8	49%	0.49	29%	0.286	S	S	.	.	H	α-helix	trans	-64	-40.4	172.6	-170.6	-105	0	0	0	112	S98 V104 Y105 I106 W121	S98-Y102 WeakPolarHBondContact O-CB 3.43Å; S98-Y102 PolarHBondContact O-N 2.98Å; Y102-V104 VanDerWaalsContact C-N 3.34Å; Y102-V104 PolarHBondContact O-N 2.94Å; Y102-Y105 WeakPolarHBondContact O-CB 3.44Å; Y102-Y105 PolarHBondContact O-N 2.94Å; Y102-I106 HydrophobicContact CD1-CG1 4.11Å; Y102-I106 HydrophobicContact CE1-CD1 4.21Å; Y102-I106 HydrophobicContact CE1-CG1 3.78Å; Y102-I106 HydrophobicContact CE2-CD1 4.42Å; Y102-I106 HydrophobicContact CE2-CG1 4.47Å; Y102-I106 WeakPolarHBondContact O-CG1 3.46Å; Y102-I106 PolarHBondContact O-N 2.89Å; Y102-W121 HydrophobicContact CD2-CH2 4.02Å; Y102-W121 HydrophobicContact CD2-CZ2 4.21Å
103	T	91.7	Very high	91.5	Very high	15 Å²	15	54 Å²	54	9%	0.092	30%	0.298	C	S	.	.	H	α-helix	trans	-59.3	-43.7	174.7	-59.2	0	0	0	0	111.5	T52 M99 N100 I106 I107	T52-T103 WeakPolarHBondContact CB-OG1 3.24Å; T52-T103 WeakPolarHBondContact CG2-OG1 3.33Å; M99-T103 WeakPolarHBondContact O-CB 3.39Å; M99-T103 PolarHBondContact O-N 2.77Å; M99-T103 PolarHBondContact O-OG1 3.49Å; N100-T103 WeakPolarHBondContact O-CB 3.48Å; N100-T103 PolarHBondContact O-N 2.86Å; T103-I106 PolarHBondContact O-N 3.39Å; T103-I107 HydrophobicContact CG2-CD1 3.6Å; T103-I107 HydrophobicContact CG2-CG1 4.4Å; T103-I107 VanDerWaalsContact O-CG1 3.28Å; T103-I107 WeakPolarHBondContact O-CG1 3.39Å; T103-I107 PolarHBondContact O-N 3.39Å
104	V	91.1	Very high	91.2	Very high	60 Å²	60	53.1 Å²	53.1	36%	0.364	30%	0.3	S	S	.	.	H	α-helix	trans	-61.9	-45.4	175.4	171.3	0	0	0	0	111.3	N100 L101 Y102 I106 I107 V108 P112	N100-V104 WeakPolarHBondContact O-CG2 3.31Å; N100-V104 PolarHBondContact O-N 3.41Å; L101-V104 PolarHBondContact O-N 2.9Å; Y102-V104 VanDerWaalsContact C-N 3.34Å; Y102-V104 PolarHBondContact O-N 2.94Å; V104-I106 PolarHBondContact O-N 3.4Å; V104-I107 PolarHBondContact O-N 2.87Å; V104-V108 HydrophobicContact CG1-CG2 4.13Å; V104-V108 WeakPolarHBondContact O-CB 3.46Å; V104-V108 VanDerWaalsContact O-CG2 3.29Å; V104-V108 WeakPolarHBondContact O-CG2 3.35Å; V104-V108 PolarHBondContact O-N 2.83Å; V104-P112 HydrophobicContact CG1-CG 4.24Å
105	Y	90.8	Very high	90.8	Very high	54 Å²	54	54.7 Å²	54.7	21%	0.212	31%	0.313	C	S	.	.	H	α-helix	trans	-58.2	-45.1	177.8	179.5	-115.9	0	0	0	112.6	L101 Y102 G109 W111 C198	L101-Y105 PolarHBondContact O-N 3.18Å; Y102-Y105 WeakPolarHBondContact O-CB 3.44Å; Y102-Y105 PolarHBondContact O-N 2.94Å; Y105-G109 PolarHBondContact O-N 2.91Å; Y105-W111 HydrophobicContact CD2-CB 3.94Å; Y105-W111 AromaticContact CD2-CE3 3.97Å; Y105-W111 HydrophobicContact CD2-CE3 3.97Å; Y105-W111 HydrophobicContact CE2-CB 4.03Å; Y105-W111 HydrophobicContact CG-CE3 4.32Å; Y105-C198 HydrophobicContact CE2-CB 4.42Å
106	I	89.4	Confident	90.5	Very high	65 Å²	65	60 Å²	60	33%	0.333	35%	0.345	S	S	.	.	H	α-helix	trans	-68.2	-40.8	179.3	-64.3	-63.7	0	0	0	112.1	I48 Y102 T103 V104	I48-I106 HydrophobicContact CD1-CG2 4.49Å; I48-I106 HydrophobicContact CG2-CG2 4.03Å; Y102-I106 HydrophobicContact CD1-CG1 4.11Å; Y102-I106 HydrophobicContact CE1-CD1 4.21Å; Y102-I106 HydrophobicContact CE1-CG1 3.78Å; Y102-I106 HydrophobicContact CE2-CD1 4.42Å; Y102-I106 HydrophobicContact CE2-CG1 4.47Å; Y102-I106 WeakPolarHBondContact O-CG1 3.46Å; Y102-I106 PolarHBondContact O-N 2.89Å; T103-I106 PolarHBondContact O-N 3.39Å; V104-I106 PolarHBondContact O-N 3.4Å
107	I	88.3	Confident	90.4	Very high	61 Å²	61	60.2 Å²	60.2	31%	0.313	35%	0.346	S	S	.	.	H	α-helix	trans	-71.3	-39.2	-179.9	-66.9	168.2	0	0	0	111.8	A49 T103 V104 G109	A49-I107 HydrophobicContact CB-CD1 3.63Å; T103-I107 HydrophobicContact CG2-CD1 3.6Å; T103-I107 HydrophobicContact CG2-CG1 4.4Å; T103-I107 VanDerWaalsContact O-CG1 3.28Å; T103-I107 WeakPolarHBondContact O-CG1 3.39Å; T103-I107 PolarHBondContact O-N 3.39Å; V104-I107 PolarHBondContact O-N 2.87Å; I107-G109 VanDerWaalsContact C-N 3.32Å
108	V	88.8	Confident	90.2	Very high	74 Å²	74	55.3 Å²	55.3	45%	0.448	33%	0.325	S	S	.	.	H	α-helix	trans	-79.9	-16.2	-179.4	177.5	0	0	0	0	111.9	V104 S110 P112	V104-V108 HydrophobicContact CG1-CG2 4.13Å; V104-V108 WeakPolarHBondContact O-CB 3.46Å; V104-V108 VanDerWaalsContact O-CG2 3.29Å; V104-V108 WeakPolarHBondContact O-CG2 3.35Å; V104-V108 PolarHBondContact O-N 2.83Å; V108-S110 PolarHBondContact O-N 3.12Å; V108-S110 VanDerWaalsContact O-N 3.1Å; V108-P112 HydrophobicContact CG1-CG 4.35Å
109	G	85.3	Confident	90.1	Very high	65 Å²	65	55.7 Å²	55.7	67%	0.67	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.9	6.9	-177.3	0	0	0	0	0	114.2	Y105 I107	Y105-G109 PolarHBondContact O-N 2.91Å; I107-G109 VanDerWaalsContact C-N 3.32Å
110	S	88.7	Confident	90.1	Very high	48 Å²	48	58.8 Å²	58.8	34%	0.336	34%	0.343	S	S	.	.	S	Bend	trans	-162.4	168.2	179.7	58.2	0	0	0	0	109.3	V108 P112 G196	V108-S110 PolarHBondContact O-N 3.12Å; V108-S110 VanDerWaalsContact O-N 3.1Å; S110-P112 VanDerWaalsContact O-CD 3.27Å; S110-P112 WeakPolarHBondContact O-CD 3.46Å; S110-G196 CarbonylContact C-O 3.42Å; S110-G196 WeakPolarHBondContact CA-O 3.48Å; S110-G196 WeakPolarHBondContact CB-O 3.49Å
111	W	91.4	Very high	90.2	Very high	18 Å²	18	56.9 Å²	56.9	7%	0.068	33%	0.331	C	S	.	.			trans	-96.2	105.6	-178.2	-176.9	-94.4	0	0	0	112.3	L101 Y105 L113 G114 V117 C118 W121 G196 C198	L101-W111 HydrophobicContact CB-CH2 4.35Å; L101-W111 HydrophobicContact CD2-CH2 4.38Å; Y105-W111 HydrophobicContact CD2-CB 3.94Å; Y105-W111 AromaticContact CD2-CE3 3.97Å; Y105-W111 HydrophobicContact CD2-CE3 3.97Å; Y105-W111 HydrophobicContact CE2-CB 4.03Å; Y105-W111 HydrophobicContact CG-CE3 4.32Å; W111-L113 HydrophobicContact CH2-CD1 4.19Å; W111-L113 HydrophobicContact CZ2-CB 3.89Å; W111-L113 HydrophobicContact CZ2-CD1 4Å; W111-L113 HydrophobicContact CZ2-CG 4.4Å; W111-G114 PolarHBondContact NE1-O 3.03Å; W111-V117 HydrophobicContact CZ2-CB 4.25Å; W111-V117 HydrophobicContact CZ2-CG1 4.08Å; W111-C118 HydrophobicContact CD2-CB 4.31Å; W111-C118 HydrophobicContact CG-CB 4.46Å; W111-C118 HydrophobicContact CZ2-CB 4.13Å; W111-W121 HydrophobicContact CE3-CE3 4.25Å; W111-W121 HydrophobicContact CE3-CZ3 4.2Å; W111-W121 HydrophobicContact CH2-CB 4.24Å; W111-W121 AromaticContact CH2-CD2 3.88Å; W111-W121 HydrophobicContact CH2-CD2 3.88Å; W111-W121 AromaticContact CH2-CE3 3.42Å; W111-W121 HydrophobicContact CH2-CE3 3.42Å; W111-W121 VanDerWaalsContact CH2-CE3 3.42Å; W111-W121 HydrophobicContact CH2-CG 4.22Å; W111-W121 HydrophobicContact CH2-CZ3 4.14Å; W111-W121 HydrophobicContact CZ2-CE3 4.31Å; W111-W121 HydrophobicContact CZ3-CD2 4.1Å; W111-W121 AromaticContact CZ3-CE3 3.38Å; W111-W121 HydrophobicContact CZ3-CE3 3.38Å; W111-W121 HydrophobicContact CZ3-CH2 4.48Å; W111-W121 AromaticContact CZ3-CZ3 3.6Å; W111-W121 HydrophobicContact CZ3-CZ3 3.6Å; W111-G196 PolarHBondContact N-O 2.94Å; W111-C198 HydrophobicContact CB-CB 3.96Å; W111-C198 HydrophobicContact CD2-CB 3.81Å; W111-C198 HydrophobicContact CE3-CB 3.89Å; W111-C198 HydrophobicContact CG-CB 3.84Å
112	P	88.4	Confident	90.2	Very high	77 Å²	77	55.6 Å²	55.6	50%	0.5	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-15.3	-173.7	34.7	-36.3	0	0	0	114	V104 V108 S110 G114	V104-P112 HydrophobicContact CG1-CG 4.24Å; V108-P112 HydrophobicContact CG1-CG 4.35Å; S110-P112 VanDerWaalsContact O-CD 3.27Å; S110-P112 WeakPolarHBondContact O-CD 3.46Å; P112-G114 VanDerWaalsContact C-N 3.26Å; P112-G114 PolarHBondContact O-N 3.01Å
113	L	87.4	Confident	90.3	Very high	79 Å²	79	49.9 Å²	49.9	41%	0.414	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	6.2	-170.5	-56.8	175	0	0	0	113.9	L101 W111 V117	L101-L113 HydrophobicContact CD2-CD1 3.55Å; W111-L113 HydrophobicContact CH2-CD1 4.19Å; W111-L113 HydrophobicContact CZ2-CB 3.89Å; W111-L113 HydrophobicContact CZ2-CD1 4Å; W111-L113 HydrophobicContact CZ2-CG 4.4Å; L113-V117 HydrophobicContact CB-CB 3.87Å; L113-V117 HydrophobicContact CB-CG1 3.95Å; L113-V117 HydrophobicContact CB-CG2 4.3Å; L113-V117 HydrophobicContact CD1-CG1 4.09Å; L113-V117 WeakPolarHBondContact O-CB 3.37Å; L113-V117 WeakPolarHBondContact O-CG2 3.34Å
114	G	89.2	Confident	90.4	Very high	28 Å²	28	52 Å²	52	29%	0.289	31%	0.314	S	S	.	.	H	α-helix	trans	74.1	168.7	178.9	0	0	0	0	0	115	W111 P112 V116 V117 C118	W111-G114 PolarHBondContact NE1-O 3.03Å; P112-G114 VanDerWaalsContact C-N 3.26Å; P112-G114 PolarHBondContact O-N 3.01Å; G114-V116 PolarHBondContact O-N 2.86Å; G114-V117 PolarHBondContact O-N 2.78Å; G114-C118 PolarHBondContact O-N 3.5Å
115	P	87.3	Confident	90.6	Very high	70 Å²	70	51.1 Å²	51.1	46%	0.455	31%	0.307	S	S	.	.	H	α-helix	trans	-65	-39.1	-167.8	23.7	-33.7	0	0	0	113.7	V117 C118 D119 R191	P115-V117 VanDerWaalsContact C-N 3.34Å; P115-V117 PolarHBondContact O-N 3Å; P115-C118 WeakPolarHBondContact O-CB 3.49Å; P115-C118 PolarHBondContact O-N 2.89Å; P115-D119 VanDerWaalsContact O-CG 3.22Å; P115-D119 PolarHBondContact O-N 2.94Å; P115-R191 VanDerWaalsContact CB-CZ 3.43Å
116	V	89.2	Confident	90.7	Very high	112 Å²	112	52.1 Å²	52.1	68%	0.679	31%	0.311	S	S	*	.	H	α-helix	trans	-64.6	-38.2	-177.6	-178.1	0	0	0	0	111.8	G114 L120	G114-V116 PolarHBondContact O-N 2.86Å; V116-L120 WeakPolarHBondContact O-CB 3.42Å; V116-L120 PolarHBondContact O-N 3.14Å; V116-L120 VanDerWaalsContact O-N 3.07Å
117	V	92.1	Very high	91	Very high	60 Å²	60	49.6 Å²	49.6	36%	0.364	30%	0.298	S	S	.	.	H	α-helix	trans	-75.2	-32.8	178.3	-170	0	0	0	0	110.9	W111 L113 G114 P115 W121	W111-V117 HydrophobicContact CZ2-CB 4.25Å; W111-V117 HydrophobicContact CZ2-CG1 4.08Å; L113-V117 HydrophobicContact CB-CB 3.87Å; L113-V117 HydrophobicContact CB-CG1 3.95Å; L113-V117 HydrophobicContact CB-CG2 4.3Å; L113-V117 HydrophobicContact CD1-CG1 4.09Å; L113-V117 WeakPolarHBondContact O-CB 3.37Å; L113-V117 WeakPolarHBondContact O-CG2 3.34Å; G114-V117 PolarHBondContact O-N 2.78Å; P115-V117 VanDerWaalsContact C-N 3.34Å; P115-V117 PolarHBondContact O-N 3Å; V117-W121 WeakPolarHBondContact O-CB 3.5Å; V117-W121 PolarHBondContact O-N 3.44Å
118	C	91.8	Very high	91.4	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.007	28%	0.284	C	S	.	.	H	α-helix	trans	-58.9	-53.3	170.5	171	0	0	0	0	110.9	W111 G114 P115 L120 W121 L122 C198	W111-C118 HydrophobicContact CD2-CB 4.31Å; W111-C118 HydrophobicContact CG-CB 4.46Å; W111-C118 HydrophobicContact CZ2-CB 4.13Å; G114-C118 PolarHBondContact O-N 3.5Å; P115-C118 WeakPolarHBondContact O-CB 3.49Å; P115-C118 PolarHBondContact O-N 2.89Å; C118-L120 VanDerWaalsContact C-N 3.34Å; C118-L120 PolarHBondContact O-N 3.41Å; C118-W121 PolarHBondContact O-N 3.24Å; C118-L122 WeakPolarHBondContact O-CB 3.09Å; C118-L122 WeakPolarHBondContact O-CG 3.38Å; C118-L122 PolarHBondContact O-N 3.28Å; C118-C198 VanDerWaalsContact CA-SG 3.51Å; C118-C198 HydrophobicContact CB-CB 3.96Å; C118-C198 WeakPolarHBondContact CB-SG 3.48Å; C118-C198 WeakPolarHBondContact SG-CA 3.43Å; C118-C198 WeakPolarHBondContact SG-CB 3.19Å; C118-C198 CovalentContact SG-SG 2.03Å; C118-C198 PolarHBondContact SG-SG 3.33Å
119	D	90.8	Very high	91.6	Very high	16 Å²	16	46 Å²	46	9%	0.086	28%	0.282	C	S	.	.	H	α-helix	trans	-63.4	-40.7	-177.1	-59.7	-9.6	0	0	0	111.9	P115 A123 L182 Q185 R191	P115-D119 VanDerWaalsContact O-CG 3.22Å; P115-D119 PolarHBondContact O-N 2.94Å; D119-A123 WeakPolarHBondContact O-CB 3.47Å; D119-A123 PolarHBondContact O-N 3.19Å; D119-L182 HydrophobicContact CB-CD2 3.91Å; D119-Q185 PolarHBondContact OD2-NE2 3.4Å; D119-Q185 PolarHBondContact OD2-OE1 3.49Å; D119-R191 IonicContact OD1-CZ 2.77Å; D119-R191 VanDerWaalsContact OD1-CZ 3.28Å; D119-R191 IonicContact OD1-NH1 2.74Å; D119-R191 PolarHBondContact OD1-NH1 3.38Å; D119-R191 IonicContact OD1-NH2 3.28Å; D119-R191 PolarHBondContact OD1-NH2 2.9Å; D119-R191 IonicContact OD2-CZ 2.73Å; D119-R191 IonicContact OD2-NH1 2.71Å; D119-R191 PolarHBondContact OD2-NH1 2.71Å; D119-R191 IonicContact OD2-NH2 3.77Å
120	L	92.7	Very high	92	Very high	108 Å²	108	43.9 Å²	43.9	57%	0.565	26%	0.255	S	S	*	.	H	α-helix	trans	-67.7	-39.1	176.9	-179	61.3	0	0	0	112.3	V116 C118 L124	V116-L120 WeakPolarHBondContact O-CB 3.42Å; V116-L120 PolarHBondContact O-N 3.14Å; V116-L120 VanDerWaalsContact O-N 3.07Å; C118-L120 VanDerWaalsContact C-N 3.34Å; C118-L120 PolarHBondContact O-N 3.41Å; L120-L124 WeakPolarHBondContact O-CB 3.21Å; L120-L124 PolarHBondContact O-N 2.93Å
121	W	94.8	Very high	92.3	Very high	19 Å²	19	41.6 Å²	41.6	7%	0.072	24%	0.239	C	C	.	.	H	α-helix	trans	-65.9	-48.9	175.6	166.2	49.5	0	0	0	111.6	L101 Y102 W111 V117 C118 A123 L124 D125 C198	L101-W121 HydrophobicContact CB-CD2 4.31Å; L101-W121 HydrophobicContact CB-CG 4.29Å; L101-W121 HydrophobicContact CD1-CB 4.02Å; L101-W121 HydrophobicContact CD1-CG 3.74Å; Y102-W121 HydrophobicContact CD2-CH2 4.02Å; Y102-W121 HydrophobicContact CD2-CZ2 4.21Å; W111-W121 HydrophobicContact CE3-CE3 4.25Å; W111-W121 HydrophobicContact CE3-CZ3 4.2Å; W111-W121 HydrophobicContact CH2-CB 4.24Å; W111-W121 AromaticContact CH2-CD2 3.88Å; W111-W121 HydrophobicContact CH2-CD2 3.88Å; W111-W121 AromaticContact CH2-CE3 3.42Å; W111-W121 HydrophobicContact CH2-CE3 3.42Å; W111-W121 VanDerWaalsContact CH2-CE3 3.42Å; W111-W121 HydrophobicContact CH2-CG 4.22Å; W111-W121 HydrophobicContact CH2-CZ3 4.14Å; W111-W121 HydrophobicContact CZ2-CE3 4.31Å; W111-W121 HydrophobicContact CZ3-CD2 4.1Å; W111-W121 AromaticContact CZ3-CE3 3.38Å; W111-W121 HydrophobicContact CZ3-CE3 3.38Å; W111-W121 HydrophobicContact CZ3-CH2 4.48Å; W111-W121 AromaticContact CZ3-CZ3 3.6Å; W111-W121 HydrophobicContact CZ3-CZ3 3.6Å; V117-W121 WeakPolarHBondContact O-CB 3.5Å; V117-W121 PolarHBondContact O-N 3.44Å; C118-W121 PolarHBondContact O-N 3.24Å; W121-A123 VanDerWaalsContact C-N 3.32Å; W121-A123 PolarHBondContact O-N 3.19Å; W121-L124 PolarHBondContact O-N 2.86Å; W121-D125 WeakPolarHBondContact O-CB 3.47Å; W121-D125 PolarHBondContact O-N 3.16Å; W121-C198 HydrophobicContact CZ3-CB 4.35Å; W121-C198 VanDerWaalsContact CZ3-SG 3.56Å
122	L	92.8	Very high	92.4	Very high	13 Å²	13	41.4 Å²	41.4	7%	0.068	24%	0.241	C	C	.	.	H	α-helix	trans	-60.7	-41.8	176.6	-69.2	171.3	0	0	0	111.5	C118 Y126 I181 I200	C118-L122 WeakPolarHBondContact O-CB 3.09Å; C118-L122 WeakPolarHBondContact O-CG 3.38Å; C118-L122 PolarHBondContact O-N 3.28Å; L122-Y126 WeakPolarHBondContact O-CB 3.32Å; L122-Y126 WeakPolarHBondContact O-CD2 3.44Å; L122-Y126 PolarHBondContact O-N 3.18Å; L122-Y126 VanDerWaalsContact O-N 3.1Å; L122-I181 HydrophobicContact CB-CG2 4.38Å; L122-I200 HydrophobicContact CB-CG1 4.17Å; L122-I200 HydrophobicContact CD1-CG1 3.93Å; L122-I200 HydrophobicContact CD2-CG1 4.35Å; L122-I200 HydrophobicContact CG-CG1 4.39Å
123	A	94	Very high	92.7	Very high	4 Å²	4	40 Å²	40	3%	0.033	23%	0.231	C	C	.	.	H	α-helix	trans	-61.9	-44.7	174.1	0	0	0	0	0	112	D119 W121 V127 A178 I181 L182	D119-A123 WeakPolarHBondContact O-CB 3.47Å; D119-A123 PolarHBondContact O-N 3.19Å; W121-A123 VanDerWaalsContact C-N 3.32Å; W121-A123 PolarHBondContact O-N 3.19Å; A123-V127 VanDerWaalsContact O-CB 3.26Å; A123-V127 WeakPolarHBondContact O-CB 3.19Å; A123-V127 WeakPolarHBondContact O-CG2 3.26Å; A123-V127 PolarHBondContact O-N 3.29Å; A123-V127 VanDerWaalsContact O-N 3.07Å; A123-A178 HydrophobicContact CB-CB 4.41Å; A123-I181 HydrophobicContact CB-CB 4.35Å; A123-I181 HydrophobicContact CB-CG2 4.14Å; A123-L182 HydrophobicContact CB-CD2 4.26Å; A123-L182 HydrophobicContact CB-CG 4.26Å
124	L	95.1	Very high	92.9	Very high	61 Å²	61	38.5 Å²	38.5	32%	0.319	22%	0.222	S	C	.	.	H	α-helix	trans	-61.5	-50.2	177	-178.7	65.7	0	0	0	111.5	I93 F97 L120 W121 V127 V128	I93-L124 HydrophobicContact CG2-CD1 4.05Å; I93-L124 HydrophobicContact CG2-CD2 4.12Å; I93-L124 HydrophobicContact CG2-CG 4.14Å; F97-L124 HydrophobicContact CB-CD2 4Å; F97-L124 HydrophobicContact CD2-CD2 4.4Å; F97-L124 HydrophobicContact CG-CD2 4.15Å; L120-L124 WeakPolarHBondContact O-CB 3.21Å; L120-L124 PolarHBondContact O-N 2.93Å; W121-L124 PolarHBondContact O-N 2.86Å; L124-V127 PolarHBondContact O-N 2.95Å; L124-V128 HydrophobicContact CD1-CG2 3.8Å; L124-V128 HydrophobicContact CG-CG2 4.22Å; L124-V128 WeakPolarHBondContact O-CB 3.33Å; L124-V128 WeakPolarHBondContact O-CG2 3.31Å; L124-V128 PolarHBondContact O-N 3.38Å
125	D	95	Very high	93.1	Very high	40 Å²	40	37.1 Å²	37.1	21%	0.214	21%	0.208	C	C	.	.	H	α-helix	trans	-62.1	-48.3	-175.1	-168.8	53.8	0	0	0	111.9	S98 W121 V128 S129	S98-D125 WeakPolarHBondContact CB-OD1 3.4Å; S98-D125 PolarHBondContact OG-OD1 2.84Å; W121-D125 WeakPolarHBondContact O-CB 3.47Å; W121-D125 PolarHBondContact O-N 3.16Å; D125-V128 PolarHBondContact O-N 2.93Å; D125-S129 WeakPolarHBondContact O-CB 3.36Å; D125-S129 PolarHBondContact O-N 3.21Å
126	Y	93.1	Very high	93.2	Very high	76 Å²	76	37.3 Å²	37.3	30%	0.298	21%	0.205	S	C	.	.	H	α-helix	trans	-66.8	-39.9	178.4	-83	-111.6	0	0	0	112.3	L122 N130 W177 I181 I200	L122-Y126 WeakPolarHBondContact O-CB 3.32Å; L122-Y126 WeakPolarHBondContact O-CD2 3.44Å; L122-Y126 PolarHBondContact O-N 3.18Å; L122-Y126 VanDerWaalsContact O-N 3.1Å; Y126-N130 WeakPolarHBondContact O-CB 3.47Å; Y126-N130 PolarHBondContact O-N 3.34Å; Y126-W177 HydrophobicContact CD1-CD2 4.11Å; Y126-W177 AromaticContact CD1-CE3 3.62Å; Y126-W177 HydrophobicContact CD1-CE3 3.62Å; Y126-W177 AromaticContact CD1-CH2 3.87Å; Y126-W177 HydrophobicContact CD1-CH2 3.87Å; Y126-W177 HydrophobicContact CD1-CZ2 4.32Å; Y126-W177 AromaticContact CD1-CZ3 3.49Å; Y126-W177 HydrophobicContact CD1-CZ3 3.49Å; Y126-W177 VanDerWaalsContact CD1-CZ3 3.49Å; Y126-W177 HydrophobicContact CE1-CH2 4.25Å; Y126-W177 AromaticContact CE1-CZ3 3.98Å; Y126-W177 HydrophobicContact CE1-CZ3 3.98Å; Y126-W177 HydrophobicContact CG-CE3 4.25Å; Y126-I181 HydrophobicContact CG-CD1 4.16Å; Y126-I200 HydrophobicContact CD1-CD1 4.04Å; Y126-I200 HydrophobicContact CD2-CD1 3.79Å; Y126-I200 HydrophobicContact CE1-CD1 3.74Å; Y126-I200 HydrophobicContact CE2-CD1 3.49Å; Y126-I200 VanDerWaalsContact CE2-CD1 3.49Å; Y126-I200 HydrophobicContact CG-CD1 4.06Å; Y126-I200 VanDerWaalsContact CZ-CD1 3.45Å
127	V	94.9	Very high	93.3	Very high	11 Å²	11	32.5 Å²	32.5	7%	0.067	18%	0.175	C	C	.	.	H	α-helix	trans	-62.3	-45.5	175.1	167.8	0	0	0	0	111.4	A123 L124 A131 S173 F174 W177 A178	A123-V127 VanDerWaalsContact O-CB 3.26Å; A123-V127 WeakPolarHBondContact O-CB 3.19Å; A123-V127 WeakPolarHBondContact O-CG2 3.26Å; A123-V127 PolarHBondContact O-N 3.29Å; A123-V127 VanDerWaalsContact O-N 3.07Å; L124-V127 PolarHBondContact O-N 2.95Å; V127-A131 VanDerWaalsContact O-CB 3.26Å; V127-A131 WeakPolarHBondContact O-CB 3.3Å; V127-A131 PolarHBondContact O-N 2.96Å; V127-S173 WeakPolarHBondContact O-CB 3.49Å; V127-F174 HydrophobicContact CG1-CB 4.16Å; V127-F174 HydrophobicContact CG1-CD2 4.39Å; V127-F174 HydrophobicContact CG2-CD2 4.42Å; V127-W177 HydrophobicContact CG2-CB 3.7Å; V127-A178 HydrophobicContact CG2-CB 3.98Å
128	V	96.1	Very high	93.2	Very high	1 Å²	1	30.6 Å²	30.6	1%	0.006	16%	0.163	C	C	.	.	H	α-helix	trans	-72.7	-42.4	-175.5	176.3	0	0	0	0	111.1	A90 I93 I94 L124 D125 A131 S132 W170	A90-V128 HydrophobicContact CB-CG1 3.7Å; A90-V128 VanDerWaalsContact O-CG1 3.24Å; A90-V128 WeakPolarHBondContact O-CG1 3.39Å; I93-V128 HydrophobicContact CB-CG1 4.14Å; I93-V128 HydrophobicContact CB-CG2 4.38Å; I93-V128 HydrophobicContact CG2-CB 4.49Å; I93-V128 HydrophobicContact CG2-CG1 4.21Å; I93-V128 HydrophobicContact CG2-CG2 3.7Å; I94-V128 HydrophobicContact CD1-CG1 3.97Å; I94-V128 HydrophobicContact CG1-CB 4.41Å; I94-V128 HydrophobicContact CG1-CG1 3.74Å; L124-V128 HydrophobicContact CD1-CG2 3.8Å; L124-V128 HydrophobicContact CG-CG2 4.22Å; L124-V128 WeakPolarHBondContact O-CB 3.33Å; L124-V128 WeakPolarHBondContact O-CG2 3.31Å; L124-V128 PolarHBondContact O-N 3.38Å; D125-V128 PolarHBondContact O-N 2.93Å; V128-A131 PolarHBondContact O-N 2.84Å; V128-S132 PolarHBondContact O-N 3.31Å; V128-W170 HydrophobicContact CG1-CH2 4.2Å; V128-W170 HydrophobicContact CG2-CH2 4.29Å; V128-W170 HydrophobicContact CG2-CZ3 3.96Å
129	S	93.9	Very high	93.2	Very high	59 Å²	59	32.3 Å²	32.3	41%	0.413	17%	0.171	S	C	.	.	H	α-helix	trans	-59.5	-48.7	173.7	-178.3	0	0	0	0	111.3	D125 A131 S132 V133	D125-S129 WeakPolarHBondContact O-CB 3.36Å; D125-S129 PolarHBondContact O-N 3.21Å; S129-A131 VanDerWaalsContact C-N 3.32Å; S129-A131 PolarHBondContact O-N 2.86Å; S129-S132 WeakPolarHBondContact O-CB 3.29Å; S129-S132 PolarHBondContact O-N 3.49Å; S129-S132 VanDerWaalsContact O-N 3.14Å; S129-V133 PolarHBondContact O-N 3.03Å
130	N	93.3	Very high	93.1	Very high	20 Å²	20	32.5 Å²	32.5	11%	0.107	17%	0.174	C	C	.	.	H	α-helix	trans	-62.7	-37.9	175.3	-168.1	101.9	0	0	0	112	Y126 S132 V133 M134 S173 W177	Y126-N130 WeakPolarHBondContact O-CB 3.47Å; Y126-N130 PolarHBondContact O-N 3.34Å; N130-S132 VanDerWaalsContact C-N 3.33Å; N130-S132 PolarHBondContact O-N 2.95Å; N130-V133 PolarHBondContact O-N 3.25Å; N130-M134 WeakPolarHBondContact O-CB 3.47Å; N130-M134 VanDerWaalsContact O-CG 3.28Å; N130-M134 WeakPolarHBondContact O-CG 3.41Å; N130-M134 PolarHBondContact O-N 2.8Å; N130-S173 WeakPolarHBondContact ND2-CB 3.45Å; N130-S173 PolarHBondContact ND2-OG 3.03Å; N130-W177 PolarHBondContact OD1-NE1 3.28Å
131	A	94.8	Very high	92.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.7	-36.1	175	0	0	0	0	0	112.2	V127 V128 S129 N135 W170 S173	V127-A131 VanDerWaalsContact O-CB 3.26Å; V127-A131 WeakPolarHBondContact O-CB 3.3Å; V127-A131 PolarHBondContact O-N 2.96Å; V128-A131 PolarHBondContact O-N 2.84Å; S129-A131 VanDerWaalsContact C-N 3.32Å; S129-A131 PolarHBondContact O-N 2.86Å; A131-N135 WeakPolarHBondContact O-CB 3.34Å; A131-N135 PolarHBondContact O-N 3.32Å; A131-N135 PolarHBondContact O-ND2 3.23Å; A131-W170 HydrophobicContact CB-CD2 3.79Å; A131-W170 HydrophobicContact CB-CE3 3.78Å; A131-W170 HydrophobicContact CB-CG 4.32Å; A131-W170 HydrophobicContact CB-CH2 4.34Å; A131-W170 HydrophobicContact CB-CZ2 4.35Å; A131-W170 HydrophobicContact CB-CZ3 4.07Å; A131-S173 VanDerWaalsContact CA-OG 3.3Å; A131-S173 WeakPolarHBondContact CA-OG 3.18Å; A131-S173 PolarHBondContact N-OG 3.22Å
132	S	94.7	Very high	92.6	Very high	15 Å²	15	30.4 Å²	30.4	11%	0.105	16%	0.162	C	C	.	.	H	α-helix	trans	-63.9	-49.8	172.9	-166.6	0	0	0	0	110.9	L87 V128 S129 N130 M134 N135 L136	L87-S132 WeakPolarHBondContact CD2-OG 3.27Å; V128-S132 PolarHBondContact O-N 3.31Å; S129-S132 WeakPolarHBondContact O-CB 3.29Å; S129-S132 PolarHBondContact O-N 3.49Å; S129-S132 VanDerWaalsContact O-N 3.14Å; N130-S132 VanDerWaalsContact C-N 3.33Å; N130-S132 PolarHBondContact O-N 2.95Å; S132-M134 VanDerWaalsContact C-N 3.33Å; S132-M134 PolarHBondContact O-N 2.98Å; S132-N135 PolarHBondContact O-N 3.48Å; S132-N135 VanDerWaalsContact O-N 3.12Å; S132-L136 WeakPolarHBondContact O-CG 3.37Å; S132-L136 PolarHBondContact O-N 3.37Å
133	V	92.7	Very high	92.3	Very high	47 Å²	47	32.6 Å²	32.6	29%	0.285	17%	0.169	S	C	.	.	H	α-helix	trans	-56.9	-43.3	175	175	0	0	0	0	112.1	S129 N130 L136 L137 P220	S129-V133 PolarHBondContact O-N 3.03Å; N130-V133 PolarHBondContact O-N 3.25Å; V133-L136 PolarHBondContact O-N 3.04Å; V133-L137 HydrophobicContact CG1-CD1 4.33Å; V133-L137 PolarHBondContact O-N 2.9Å; V133-P220 HydrophobicContact CG1-CB 3.67Å; V133-P220 HydrophobicContact CG1-CG 4.33Å
134	M	92.1	Very high	91.9	Very high	47 Å²	47	35.7 Å²	35.7	23%	0.232	18%	0.18	C	C	.	.	H	α-helix	trans	-67.3	-35.4	177.4	-72.8	-63.7	-61.5	0	0	112.9	N130 S132 L137 I138 A169 L172	N130-M134 WeakPolarHBondContact O-CB 3.47Å; N130-M134 VanDerWaalsContact O-CG 3.28Å; N130-M134 WeakPolarHBondContact O-CG 3.41Å; N130-M134 PolarHBondContact O-N 2.8Å; S132-M134 VanDerWaalsContact C-N 3.33Å; S132-M134 PolarHBondContact O-N 2.98Å; M134-L137 WeakPolarHBondContact O-CB 3.47Å; M134-L137 PolarHBondContact O-N 3.4Å; M134-L137 HydrophobicContact SD-CD1 3.82Å; M134-I138 WeakPolarHBondContact O-CD1 3.24Å; M134-I138 WeakPolarHBondContact O-CG1 3.48Å; M134-I138 PolarHBondContact O-N 2.92Å; M134-A169 HydrophobicContact CB-CB 3.8Å; M134-L172 HydrophobicContact CE-CD2 4.12Å
135	N	93.4	Very high	91.3	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.179	C	C	.	.	H	α-helix	trans	-67.1	-41.6	172.3	-85.4	-77.5	0	0	0	111.7	S86 L87 A131 S132 I138 I139	S86-N135 PolarHBondContact OG-ND2 3.46Å; S86-N135 PolarHBondContact OG-OD1 2.92Å; L87-N135 HydrophobicContact CD2-CB 3.62Å; L87-N135 HydrophobicContact CG-CB 4.23Å; A131-N135 WeakPolarHBondContact O-CB 3.34Å; A131-N135 PolarHBondContact O-N 3.32Å; A131-N135 PolarHBondContact O-ND2 3.23Å; S132-N135 PolarHBondContact O-N 3.48Å; S132-N135 VanDerWaalsContact O-N 3.12Å; N135-I138 PolarHBondContact O-N 2.95Å; N135-I139 WeakPolarHBondContact O-CG1 3.4Å; N135-I139 PolarHBondContact O-N 3.47Å
136	L	90.7	Very high	90.7	Very high	73 Å²	73	34.6 Å²	34.6	38%	0.382	17%	0.172	S	C	.	.	H	α-helix	trans	-62.3	-40.9	174.2	-66.6	170.4	0	0	0	111.9	L87 S132 V133 I139 S140 M224	L87-L136 HydrophobicContact CD1-CD2 3.67Å; L87-L136 HydrophobicContact CD1-CG 4.41Å; L87-L136 HydrophobicContact CD2-CD2 4.04Å; L87-L136 HydrophobicContact CD2-CG 3.87Å; S132-L136 WeakPolarHBondContact O-CG 3.37Å; S132-L136 PolarHBondContact O-N 3.37Å; V133-L136 PolarHBondContact O-N 3.04Å; L136-I139 PolarHBondContact O-N 3.5Å; L136-S140 PolarHBondContact O-N 2.91Å; L136-S140 PolarHBondContact O-OG 3.35Å; L136-M224 HydrophobicContact CB-CE 3.49Å; L136-M224 VanDerWaalsContact CB-CE 3.49Å
137	L	90.9	Very high	90.1	Very high	12 Å²	12	32.8 Å²	32.8	6%	0.063	17%	0.169	C	C	.	.	H	α-helix	trans	-57.7	-46.3	171.6	-86.7	164.6	0	0	0	112	V133 M134 I139 S140 F141 P220 I223 M224	V133-L137 HydrophobicContact CG1-CD1 4.33Å; V133-L137 PolarHBondContact O-N 2.9Å; M134-L137 WeakPolarHBondContact O-CB 3.47Å; M134-L137 PolarHBondContact O-N 3.4Å; M134-L137 HydrophobicContact SD-CD1 3.82Å; L137-I139 PolarHBondContact O-N 3.22Å; L137-S140 PolarHBondContact O-N 2.91Å; L137-F141 HydrophobicContact CD2-CE2 4.45Å; L137-F141 VanDerWaalsContact O-CD2 3.29Å; L137-F141 WeakPolarHBondContact O-CD2 3.38Å; L137-F141 PolarHBondContact O-N 2.77Å; L137-P220 HydrophobicContact CD1-CB 4.09Å; L137-I223 HydrophobicContact CD2-CB 4Å; L137-I223 HydrophobicContact CD2-CG2 3.52Å; L137-M224 HydrophobicContact CB-SD 4.36Å; L137-M224 HydrophobicContact CD2-CG 3.65Å; L137-M224 HydrophobicContact CD2-SD 3.7Å; L137-M224 HydrophobicContact CG-CG 4Å; L137-M224 HydrophobicContact CG-SD 3.9Å
138	I	90.5	Very high	89.4	Confident	19 Å²	19	34.7 Å²	34.7	10%	0.097	18%	0.181	C	C	.	.	H	α-helix	trans	-62.3	-41.6	177.8	-74	162.9	0	0	0	111.6	F83 M134 N135 S140 F141 D142 M165 A169	F83-I138 HydrophobicContact CD1-CG2 3.99Å; F83-I138 HydrophobicContact CE1-CG2 3.38Å; F83-I138 HydrophobicContact CE2-CG2 3.96Å; F83-I138 HydrophobicContact CZ-CG2 3.36Å; M134-I138 WeakPolarHBondContact O-CD1 3.24Å; M134-I138 WeakPolarHBondContact O-CG1 3.48Å; M134-I138 PolarHBondContact O-N 2.92Å; N135-I138 PolarHBondContact O-N 2.95Å; I138-S140 VanDerWaalsContact C-N 3.35Å; I138-S140 PolarHBondContact O-N 3.32Å; I138-F141 PolarHBondContact O-N 3.37Å; I138-D142 WeakPolarHBondContact O-CB 3.44Å; I138-D142 PolarHBondContact O-N 3.01Å; I138-M165 HydrophobicContact CD1-CB 4.27Å; I138-M165 WeakPolarHBondContact CD1-O 3.43Å; I138-M165 HydrophobicContact CG1-CE 4.3Å; I138-M165 HydrophobicContact CG2-CB 4.44Å; I138-M165 HydrophobicContact CG2-CE 3.7Å; I138-A169 HydrophobicContact CD1-CB 3.8Å
139	I	91.1	Very high	88.7	Confident	37 Å²	37	40.4 Å²	40.4	19%	0.19	21%	0.205	C	C	.	.	H	α-helix	trans	-60.7	-44.5	174.2	-66.8	163.8	0	0	0	110.6	F83 L87 N135 L136 L137 D142 R143	F83-I139 HydrophobicContact CB-CD1 3.74Å; F83-I139 HydrophobicContact CB-CG1 3.53Å; F83-I139 HydrophobicContact CD2-CG1 3.93Å; F83-I139 HydrophobicContact CG-CG1 3.93Å; L87-I139 HydrophobicContact CD1-CD1 3.68Å; N135-I139 WeakPolarHBondContact O-CG1 3.4Å; N135-I139 PolarHBondContact O-N 3.47Å; L136-I139 PolarHBondContact O-N 3.5Å; L137-I139 PolarHBondContact O-N 3.22Å; I139-D142 PolarHBondContact O-N 3.08Å; I139-R143 HydrophobicContact CG2-CG 4.43Å; I139-R143 WeakPolarHBondContact O-CB 3.27Å; I139-R143 WeakPolarHBondContact O-CG 3.08Å; I139-R143 PolarHBondContact O-N 3Å
140	S	89.2	Confident	87.9	Confident	21 Å²	21	40 Å²	40	15%	0.147	20%	0.201	C	C	.	.	H	α-helix	trans	-62.8	-44.2	177.5	-68.2	0	0	0	0	112.6	L136 L137 I138 R143 Y144 M224	L136-S140 PolarHBondContact O-N 2.91Å; L136-S140 PolarHBondContact O-OG 3.35Å; L137-S140 PolarHBondContact O-N 2.91Å; I138-S140 VanDerWaalsContact C-N 3.35Å; I138-S140 PolarHBondContact O-N 3.32Å; S140-R143 PolarHBondContact O-N 2.96Å; S140-Y144 WeakPolarHBondContact O-CB 3.49Å; S140-Y144 PolarHBondContact O-N 2.81Å; S140-M224 PolarHBondContact OG-SD 3.38Å
141	F	87.4	Confident	87.1	Confident	80 Å²	80	43.5 Å²	43.5	35%	0.351	22%	0.22	S	C	.	.	H	α-helix	trans	-63.2	-43.3	174.3	-84.3	-67.6	0	0	0	112.4	L137 I138 Y144 F145 I223 L227	L137-F141 HydrophobicContact CD2-CE2 4.45Å; L137-F141 VanDerWaalsContact O-CD2 3.29Å; L137-F141 WeakPolarHBondContact O-CD2 3.38Å; L137-F141 PolarHBondContact O-N 2.77Å; I138-F141 PolarHBondContact O-N 3.37Å; F141-Y144 PolarHBondContact O-N 3.47Å; F141-F145 HydrophobicContact CB-CD2 4.49Å; F141-F145 HydrophobicContact CB-CE2 4.33Å; F141-F145 HydrophobicContact CD1-CE2 4.15Å; F141-F145 WeakPolarHBondContact O-CD2 3.26Å; F141-F145 PolarHBondContact O-N 2.88Å; F141-I223 HydrophobicContact CE2-CG2 4.06Å; F141-I223 HydrophobicContact CZ-CG2 3.97Å; F141-L227 HydrophobicContact CD1-CD1 3.93Å; F141-L227 HydrophobicContact CD1-CD2 3.78Å; F141-L227 HydrophobicContact CD2-CD1 3.8Å; F141-L227 HydrophobicContact CE1-CD1 3.91Å; F141-L227 HydrophobicContact CE1-CD2 3.75Å; F141-L227 HydrophobicContact CE1-CG 4.35Å; F141-L227 HydrophobicContact CE2-CD1 3.78Å; F141-L227 HydrophobicContact CG-CD1 3.87Å; F141-L227 HydrophobicContact CG-CD2 4.47Å; F141-L227 HydrophobicContact CZ-CD1 3.83Å; F141-L227 HydrophobicContact CZ-CD2 4.41Å
142	D	88	Confident	86.3	Confident	3 Å²	3	48 Å²	48	2%	0.016	25%	0.248	C	C	.	.	H	α-helix	trans	-59.7	-48.6	175.7	168.8	73.1	0	0	0	112.1	F83 I138 I139 Y144 F145 C146 Y153 R157	F83-D142 HydrophobicContact CE2-CB 4.43Å; I138-D142 WeakPolarHBondContact O-CB 3.44Å; I138-D142 PolarHBondContact O-N 3.01Å; I139-D142 PolarHBondContact O-N 3.08Å; D142-Y144 VanDerWaalsContact C-N 3.32Å; D142-Y144 PolarHBondContact O-N 2.99Å; D142-F145 PolarHBondContact O-N 3.5Å; D142-C146 WeakPolarHBondContact O-CB 3.3Å; D142-C146 PolarHBondContact O-N 3.48Å; D142-C146 PolarHBondContact O-SG 2.96Å; D142-Y153 WeakPolarHBondContact OD1-CE1 3.27Å; D142-R157 WeakPolarHBondContact OD1-CD 3.09Å; D142-R157 IonicContact OD1-CZ 3.8Å; D142-R157 IonicContact OD1-NE 3.07Å; D142-R157 PolarHBondContact OD1-NE 3.01Å; D142-R157 IonicContact OD1-NH1 3.73Å; D142-R157 PolarHBondContact OD1-NH1 3.48Å; D142-R157 IonicContact OD1-NH2 2.93Å; D142-R157 IonicContact OD2-CZ 2.67Å; D142-R157 VanDerWaalsContact OD2-CZ 3.28Å; D142-R157 IonicContact OD2-NH1 3.48Å; D142-R157 PolarHBondContact OD2-NH1 2.87Å; D142-R157 IonicContact OD2-NH2 3.28Å; D142-R157 PolarHBondContact OD2-NH2 2.92Å
143	R	86.8	Confident	85.7	Confident	59 Å²	59	50 Å²	50	22%	0.223	25%	0.253	C	S	.	.	H	α-helix	trans	-59.6	-44.2	176.3	-73.5	-55.3	-151.8	-172.6	7.2	111	I139 S140 C146 V147 I231 D379	I139-R143 HydrophobicContact CG2-CG 4.43Å; I139-R143 WeakPolarHBondContact O-CB 3.27Å; I139-R143 WeakPolarHBondContact O-CG 3.08Å; I139-R143 PolarHBondContact O-N 3Å; S140-R143 PolarHBondContact O-N 2.96Å; R143-C146 PolarHBondContact O-N 3.01Å; R143-V147 WeakPolarHBondContact O-CB 3.33Å; R143-V147 VanDerWaalsContact O-CG2 3.31Å; R143-V147 WeakPolarHBondContact O-CG2 3.29Å; R143-V147 PolarHBondContact O-N 3.46Å; R143-I231 HydrophobicContact CB-CD1 4Å; R143-D379 IonicContact CZ-OD1 2.95Å; R143-D379 PolarHBondContact NH1-O 3.42Å; R143-D379 PolarHBondContact NH2-O 3.32Å; R143-D379 IonicContact NH2-OD1 3.9Å; R143-D379 PolarHBondContact NH2-OD1 2.96Å
144	Y	85.6	Confident	84.9	Confident	69 Å²	69	50.2 Å²	50.2	27%	0.271	26%	0.256	S	S	.	.	H	α-helix	trans	-59.9	-46.3	176.1	173.5	-106.1	0	0	0	112.6	S140 F141 D142 V147 T148 L227 N230 I231	S140-Y144 WeakPolarHBondContact O-CB 3.49Å; S140-Y144 PolarHBondContact O-N 2.81Å; F141-Y144 PolarHBondContact O-N 3.47Å; D142-Y144 VanDerWaalsContact C-N 3.32Å; D142-Y144 PolarHBondContact O-N 2.99Å; Y144-V147 PolarHBondContact O-N 2.95Å; Y144-T148 HydrophobicContact CD2-CG2 3.98Å; Y144-T148 HydrophobicContact CE1-CG2 4.44Å; Y144-T148 HydrophobicContact CE2-CG2 3.54Å; Y144-T148 WeakPolarHBondContact O-CB 3.33Å; Y144-T148 WeakPolarHBondContact O-CG2 3.29Å; Y144-T148 PolarHBondContact O-N 2.95Å; Y144-T148 PolarHBondContact O-OG1 2.88Å; Y144-L227 HydrophobicContact CD1-CD2 4.27Å; Y144-L227 HydrophobicContact CG-CD2 4.14Å; Y144-N230 HydrophobicContact CD2-CB 4.11Å; Y144-N230 HydrophobicContact CE2-CB 3.89Å; Y144-I231 HydrophobicContact CD2-CG1 4.37Å
145	F	83.6	Confident	84	Confident	65 Å²	65	53.3 Å²	53.3	29%	0.285	28%	0.277	S	S	.	.	H	α-helix	trans	-70.5	-35.4	178.2	-70.7	-54.8	0	0	0	113.3	F141 D142 T148 K149 Y153	F141-F145 HydrophobicContact CB-CD2 4.49Å; F141-F145 HydrophobicContact CB-CE2 4.33Å; F141-F145 HydrophobicContact CD1-CE2 4.15Å; F141-F145 WeakPolarHBondContact O-CD2 3.26Å; F141-F145 PolarHBondContact O-N 2.88Å; D142-F145 PolarHBondContact O-N 3.5Å; F145-T148 WeakPolarHBondContact CA-OG1 3.44Å; F145-T148 PolarHBondContact O-OG1 3.32Å; F145-K149 PolarHBondContact O-N 2.9Å; F145-Y153 HydrophobicContact CB-CD1 3.53Å; F145-Y153 HydrophobicContact CB-CD2 3.65Å; F145-Y153 HydrophobicContact CB-CE1 3.5Å; F145-Y153 VanDerWaalsContact CB-CE1 3.5Å; F145-Y153 HydrophobicContact CB-CE2 3.62Å; F145-Y153 HydrophobicContact CB-CG 3.6Å; F145-Y153 AromaticContact CD2-CE2 3.93Å; F145-Y153 HydrophobicContact CD2-CE2 3.93Å; F145-Y153 AromaticContact CD2-CZ 3.93Å; F145-Y153 HydrophobicContact CG-CD2 4.2Å; F145-Y153 AromaticContact CG-CE2 3.93Å; F145-Y153 HydrophobicContact CG-CE2 3.93Å
146	C	81.8	Confident	83.2	Confident	12 Å²	12	63.4 Å²	63.4	8%	0.081	32%	0.315	C	S	.	.	H	α-helix	trans	-60	-44.9	171.2	-73.5	0	0	0	0	111.9	D142 R143 P150	D142-C146 WeakPolarHBondContact O-CB 3.3Å; D142-C146 PolarHBondContact O-N 3.48Å; D142-C146 PolarHBondContact O-SG 2.96Å; R143-C146 PolarHBondContact O-N 3.01Å; C146-P150 WeakPolarHBondContact O-CA 3.42Å
147	V	80.9	Confident	82.7	Confident	39 Å²	39	62.2 Å²	62.2	24%	0.236	31%	0.306	C	S	.	.	H	α-helix	trans	-71.6	-40.5	-179.2	170.9	0	0	0	0	112.1	R143 Y144 A234 R238	R143-V147 WeakPolarHBondContact O-CB 3.33Å; R143-V147 VanDerWaalsContact O-CG2 3.31Å; R143-V147 WeakPolarHBondContact O-CG2 3.29Å; R143-V147 PolarHBondContact O-N 3.46Å; Y144-V147 PolarHBondContact O-N 2.95Å; V147-A234 HydrophobicContact CG1-CB 3.56Å; V147-R238 PolarHBondContact O-NH2 3.39Å
148	T	80.9	Confident	82.5	Confident	50 Å²	50	64.6 Å²	64.6	31%	0.307	32%	0.321	S	S	.	.	H	α-helix	trans	-79.2	-37.9	-177.6	53.2	0	0	0	0	113.7	Y144 F145 P150	Y144-T148 HydrophobicContact CD2-CG2 3.98Å; Y144-T148 HydrophobicContact CE1-CG2 4.44Å; Y144-T148 HydrophobicContact CE2-CG2 3.54Å; Y144-T148 WeakPolarHBondContact O-CB 3.33Å; Y144-T148 WeakPolarHBondContact O-CG2 3.29Å; Y144-T148 PolarHBondContact O-N 2.95Å; Y144-T148 PolarHBondContact O-OG1 2.88Å; F145-T148 WeakPolarHBondContact CA-OG1 3.44Å; F145-T148 PolarHBondContact O-OG1 3.32Å; T148-P150 VanDerWaalsContact O-CD 3.29Å; T148-P150 WeakPolarHBondContact O-CD 3.37Å
149	K	80.4	Confident	82.3	Confident	121 Å²	121	66.6 Å²	66.6	53%	0.526	33%	0.334	S	S	.	.	S	Bend	trans	-121.9	58	-174.9	-62.4	179.7	-178.3	176.7	0	112.4	F145 L151 T152 Y153	F145-K149 PolarHBondContact O-N 2.9Å; K149-L151 VanDerWaalsContact C-N 3.25Å; K149-L151 PolarHBondContact O-N 3.17Å; K149-T152 PolarHBondContact O-N 3.16Å; K149-T152 VanDerWaalsContact O-N 3.15Å; K149-Y153 PolarHBondContact O-N 2.87Å
150	P	76.6	Confident	82.2	Confident	50 Å²	50	73.5 Å²	73.5	33%	0.325	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-14.8	-163.2	26.3	-37.2	0	0	0	116.4	C146 T148	C146-P150 WeakPolarHBondContact O-CA 3.42Å; T148-P150 VanDerWaalsContact O-CD 3.29Å; T148-P150 WeakPolarHBondContact O-CD 3.37Å
151	L	77.3	Confident	82.2	Confident	94 Å²	94	77.8 Å²	77.8	49%	0.492	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.7	-20.5	178.8	-59.6	179.2	0	0	0	113.6	K149 T155 I372 T374	K149-L151 VanDerWaalsContact C-N 3.25Å; K149-L151 PolarHBondContact O-N 3.17Å; L151-T155 PolarHBondContact O-OG1 2.86Å; L151-T155 VanDerWaalsContact O-OG1 3.06Å; L151-I372 HydrophobicContact CD2-CG2 4.1Å; L151-T374 HydrophobicContact CD2-CG2 4.45Å
152	T	78.3	Confident	82.3	Confident	96 Å²	96	74.1 Å²	74.1	59%	0.589	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.4	-28.6	-167.1	-44	0	0	0	0	113	K149 T155	K149-T152 PolarHBondContact O-N 3.16Å; K149-T152 VanDerWaalsContact O-N 3.15Å; T152-T155 PolarHBondContact O-OG1 2.74Å
153	Y	80.5	Confident	82.5	Confident	56 Å²	56	75.5 Å²	75.5	22%	0.22	38%	0.381	C	S	.	.	S	Bend	trans	-84.4	-48.8	-179.3	-174.3	-99.6	0	0	0	113.1	D142 F145 K149 T155 R156 R157	D142-Y153 WeakPolarHBondContact OD1-CE1 3.27Å; F145-Y153 HydrophobicContact CB-CD1 3.53Å; F145-Y153 HydrophobicContact CB-CD2 3.65Å; F145-Y153 HydrophobicContact CB-CE1 3.5Å; F145-Y153 VanDerWaalsContact CB-CE1 3.5Å; F145-Y153 HydrophobicContact CB-CE2 3.62Å; F145-Y153 HydrophobicContact CB-CG 3.6Å; F145-Y153 AromaticContact CD2-CE2 3.93Å; F145-Y153 HydrophobicContact CD2-CE2 3.93Å; F145-Y153 AromaticContact CD2-CZ 3.93Å; F145-Y153 HydrophobicContact CG-CD2 4.2Å; F145-Y153 AromaticContact CG-CE2 3.93Å; F145-Y153 HydrophobicContact CG-CE2 3.93Å; K149-Y153 PolarHBondContact O-N 2.87Å; Y153-T155 PolarHBondContact O-N 3.16Å; Y153-T155 VanDerWaalsContact O-N 3.1Å; Y153-R156 PolarHBondContact O-N 2.89Å; Y153-R156 VanDerWaalsContact O-N 3.09Å; Y153-R157 PolarHBondContact O-N 2.78Å
154	P	76.7	Confident	82.8	Confident	52 Å²	52	78.2 Å²	78.2	34%	0.338	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-26.1	179.3	-24.2	35.7	0	0	0	113.8
155	T	74.1	Confident	83.2	Confident	112 Å²	112	78.5 Å²	78.5	69%	0.687	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.3	-16.7	-179.9	43.4	0	0	0	0	114.3	L151 T152 Y153	L151-T155 PolarHBondContact O-OG1 2.86Å; L151-T155 VanDerWaalsContact O-OG1 3.06Å; T152-T155 PolarHBondContact O-OG1 2.74Å; Y153-T155 PolarHBondContact O-N 3.16Å; Y153-T155 VanDerWaalsContact O-N 3.1Å
156	R	76.9	Confident	83.7	Confident	212 Å²	212	76.5 Å²	76.5	80%	0.8	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.8	-17.8	170	-71.3	-172.2	71.6	172.5	1.7	113.3	Y153	Y153-R156 PolarHBondContact O-N 2.89Å; Y153-R156 VanDerWaalsContact O-N 3.09Å
157	R	79.9	Confident	84.4	Confident	47 Å²	47	77.9 Å²	77.9	18%	0.177	41%	0.408	C	S	.	.			trans	-72.9	126.4	-178.6	-177.6	169.8	174.6	-149.1	-0.9	110.9	V79 N80 F83 D142 Y153	V79-R157 HydrophobicContact CB-CG 4.29Å; V79-R157 HydrophobicContact CG1-CG 3.84Å; V79-R157 HydrophobicContact CG2-CG 4.42Å; V79-R157 PolarHBondContact O-NH2 3.03Å; N80-R157 VanDerWaalsContact OD1-CZ 3.28Å; N80-R157 PolarHBondContact OD1-NH1 3.07Å; N80-R157 PolarHBondContact OD1-NH2 3.4Å; F83-R157 VanDerWaalsContact CE2-NH2 3.32Å; D142-R157 WeakPolarHBondContact OD1-CD 3.09Å; D142-R157 IonicContact OD1-CZ 3.8Å; D142-R157 IonicContact OD1-NE 3.07Å; D142-R157 PolarHBondContact OD1-NE 3.01Å; D142-R157 IonicContact OD1-NH1 3.73Å; D142-R157 PolarHBondContact OD1-NH1 3.48Å; D142-R157 IonicContact OD1-NH2 2.93Å; D142-R157 IonicContact OD2-CZ 2.67Å; D142-R157 VanDerWaalsContact OD2-CZ 3.28Å; D142-R157 IonicContact OD2-NH1 3.48Å; D142-R157 PolarHBondContact OD2-NH1 2.87Å; D142-R157 IonicContact OD2-NH2 3.28Å; D142-R157 PolarHBondContact OD2-NH2 2.92Å; Y153-R157 PolarHBondContact O-N 2.78Å
158	T	86.7	Confident	85.1	Confident	63 Å²	63	78.6 Å²	78.6	39%	0.387	42%	0.419	S	S	.	.			trans	-131.1	156.6	178.2	63.1	0	0	0	0	110.8	K160 M161 A162	T158-K160 VanDerWaalsContact C-N 3.27Å; T158-K160 PolarHBondContact O-N 3.36Å; T158-M161 PolarHBondContact O-N 3.47Å; T158-M161 VanDerWaalsContact O-N 3.16Å; T158-M161 WeakPolarHBondContact OG1-CG 3.26Å; T158-M161 PolarHBondContact OG1-N 3.38Å; T158-A162 PolarHBondContact O-N 3.06Å; T158-A162 VanDerWaalsContact O-N 3.11Å
159	T	85.6	Confident	85.7	Confident	60 Å²	60	76.4 Å²	76.4	37%	0.368	41%	0.405	S	S	.	.	H	α-helix	trans	-58.2	-38.5	175.7	49.4	0	0	0	0	112.3	V79 Y82 M161 A162 G163	V79-T159 HydrophobicContact CG2-CG2 3.95Å; Y82-T159 HydrophobicContact CD2-CG2 3.94Å; Y82-T159 HydrophobicContact CE2-CG2 3.61Å; T159-M161 PolarHBondContact O-N 2.91Å; T159-A162 PolarHBondContact O-N 2.89Å; T159-G163 PolarHBondContact O-N 2.98Å
160	K	88.4	Confident	86.5	Confident	183 Å²	183	73.5 Å²	73.5	80%	0.796	39%	0.391	S	S	*	.	H	α-helix	trans	-58.4	-45	174.5	-66.5	-170.3	177	-171.6	0	112.4	T158 G163 L164	T158-K160 VanDerWaalsContact C-N 3.27Å; T158-K160 PolarHBondContact O-N 3.36Å; K160-G163 PolarHBondContact O-N 3.49Å; K160-L164 PolarHBondContact O-N 2.91Å
161	M	89.4	Confident	87.4	Confident	110 Å²	110	75.9 Å²	75.9	54%	0.542	40%	0.4	S	S	.	.	H	α-helix	trans	-68	-38.1	178.8	-70.9	-67.3	175.3	0	0	112.1	T158 T159 L164 M165	T158-M161 PolarHBondContact O-N 3.47Å; T158-M161 VanDerWaalsContact O-N 3.16Å; T158-M161 WeakPolarHBondContact OG1-CG 3.26Å; T158-M161 PolarHBondContact OG1-N 3.38Å; T159-M161 PolarHBondContact O-N 2.91Å; M161-L164 PolarHBondContact O-N 3.35Å; M161-M165 WeakPolarHBondContact O-CG 3.26Å; M161-M165 PolarHBondContact O-N 2.89Å
162	A	90.5	Very high	88.2	Confident	3 Å²	3	75.2 Å²	75.2	3%	0.025	40%	0.397	C	S	.	.	H	α-helix	trans	-65.9	-40.1	174.1	0	0	0	0	0	112.5	V79 F83 T158 T159 L164 M165 I166	V79-A162 HydrophobicContact CG1-CB 3.34Å; F83-A162 HydrophobicContact CE1-CB 3.82Å; F83-A162 HydrophobicContact CE2-CB 4.44Å; F83-A162 HydrophobicContact CZ-CB 3.7Å; T158-A162 PolarHBondContact O-N 3.06Å; T158-A162 VanDerWaalsContact O-N 3.11Å; T159-A162 PolarHBondContact O-N 2.89Å; A162-L164 VanDerWaalsContact C-N 3.29Å; A162-L164 PolarHBondContact O-N 3.46Å; A162-M165 PolarHBondContact O-N 3.48Å; A162-I166 WeakPolarHBondContact O-CD1 3.5Å; A162-I166 VanDerWaalsContact O-CG1 3.27Å; A162-I166 WeakPolarHBondContact O-CG1 3.28Å; A162-I166 PolarHBondContact O-N 3.49Å
163	G	91.8	Very high	89	Confident	32 Å²	32	70.6 Å²	70.6	33%	0.33	37%	0.369	S	S	.	.	H	α-helix	trans	-58.4	-39.7	171.8	0	0	0	0	0	112.8	T159 K160 A167	T159-G163 PolarHBondContact O-N 2.98Å; K160-G163 PolarHBondContact O-N 3.49Å; G163-A167 WeakPolarHBondContact O-CB 3.31Å; G163-A167 PolarHBondContact O-N 3.43Å
164	L	93.4	Very high	89.7	Confident	116 Å²	116	73.6 Å²	73.6	61%	0.607	38%	0.383	S	S	*	.	H	α-helix	trans	-66.8	-40.8	174.1	-173.9	66.6	0	0	0	112.4	K160 M161 A162 A167 A168	K160-L164 PolarHBondContact O-N 2.91Å; M161-L164 PolarHBondContact O-N 3.35Å; A162-L164 VanDerWaalsContact C-N 3.29Å; A162-L164 PolarHBondContact O-N 3.46Å; L164-A167 PolarHBondContact O-N 3.42Å; L164-A168 WeakPolarHBondContact O-CB 3.41Å; L164-A168 PolarHBondContact O-N 2.86Å
165	M	92.8	Very high	90.4	Very high	75 Å²	75	76.1 Å²	76.1	37%	0.369	39%	0.392	S	S	.	.	H	α-helix	trans	-65.2	-40.2	176	-68.8	175.2	78.5	0	0	112.1	F83 I138 M161 A162 A168 A169	F83-M165 HydrophobicContact CE1-CB 4.42Å; I138-M165 HydrophobicContact CD1-CB 4.27Å; I138-M165 WeakPolarHBondContact CD1-O 3.43Å; I138-M165 HydrophobicContact CG1-CE 4.3Å; I138-M165 HydrophobicContact CG2-CB 4.44Å; I138-M165 HydrophobicContact CG2-CE 3.7Å; M161-M165 WeakPolarHBondContact O-CG 3.26Å; M161-M165 PolarHBondContact O-N 2.89Å; A162-M165 PolarHBondContact O-N 3.48Å; M165-A168 PolarHBondContact O-N 2.89Å; M165-A169 PolarHBondContact O-N 2.92Å
166	I	95.4	Very high	91.2	Very high	23 Å²	23	75.3 Å²	75.3	12%	0.118	38%	0.383	C	S	.	.	H	α-helix	trans	-60.8	-52.7	172.6	-69.8	160.8	0	0	0	109.8	Y82 F83 S86 A162 A168 A169 W170	Y82-I166 WeakPolarHBondContact O-CD1 3.4Å; F83-I166 HydrophobicContact CD1-CD1 3.75Å; F83-I166 HydrophobicContact CD1-CG1 3.59Å; F83-I166 HydrophobicContact CE1-CD1 4.17Å; F83-I166 HydrophobicContact CE1-CG1 3.86Å; S86-I166 WeakPolarHBondContact OG-CG2 3.46Å; A162-I166 WeakPolarHBondContact O-CD1 3.5Å; A162-I166 VanDerWaalsContact O-CG1 3.27Å; A162-I166 WeakPolarHBondContact O-CG1 3.28Å; A162-I166 PolarHBondContact O-N 3.49Å; I166-A168 VanDerWaalsContact C-N 3.29Å; I166-A168 PolarHBondContact O-N 3.12Å; I166-A169 WeakPolarHBondContact O-CB 3.02Å; I166-A169 PolarHBondContact O-N 2.93Å; I166-A169 VanDerWaalsContact O-N 3.08Å; I166-W170 VanDerWaalsContact O-CD1 3.29Å; I166-W170 PolarHBondContact O-N 3.38Å
167	A	95.6	Very high	91.9	Very high	41 Å²	41	66.5 Å²	66.5	34%	0.339	35%	0.35	S	S	.	.	H	α-helix	trans	-58	-41.6	179.2	0	0	0	0	0	112	G163 L164 A169 W170 I171	G163-A167 WeakPolarHBondContact O-CB 3.31Å; G163-A167 PolarHBondContact O-N 3.43Å; L164-A167 PolarHBondContact O-N 3.42Å; A167-A169 PolarHBondContact O-N 2.92Å; A167-W170 PolarHBondContact O-N 3.14Å; A167-I171 WeakPolarHBondContact O-CB 3.4Å; A167-I171 WeakPolarHBondContact O-CD1 3.43Å; A167-I171 WeakPolarHBondContact O-CG1 3.34Å; A167-I171 PolarHBondContact O-N 3.23Å
168	A	95	Very high	92.4	Very high	55 Å²	55	64.4 Å²	64.4	46%	0.455	34%	0.343	S	S	.	.	H	α-helix	trans	-63.2	-39.2	175.1	0	0	0	0	0	112.8	L164 M165 I166 L172	L164-A168 WeakPolarHBondContact O-CB 3.41Å; L164-A168 PolarHBondContact O-N 2.86Å; M165-A168 PolarHBondContact O-N 2.89Å; I166-A168 VanDerWaalsContact C-N 3.29Å; I166-A168 PolarHBondContact O-N 3.12Å; A168-L172 WeakPolarHBondContact O-CB 3.46Å; A168-L172 PolarHBondContact O-N 2.71Å
169	A	94.7	Very high	92.6	Very high	3 Å²	3	63.7 Å²	63.7	3%	0.025	34%	0.339	C	S	.	.	H	α-helix	trans	-63.4	-44.5	174.8	0	0	0	0	0	112.3	M134 I138 M165 I166 A167 S173	M134-A169 HydrophobicContact CB-CB 3.8Å; I138-A169 HydrophobicContact CD1-CB 3.8Å; M165-A169 PolarHBondContact O-N 2.92Å; I166-A169 WeakPolarHBondContact O-CB 3.02Å; I166-A169 PolarHBondContact O-N 2.93Å; I166-A169 VanDerWaalsContact O-N 3.08Å; A167-A169 PolarHBondContact O-N 2.92Å; A169-S173 VanDerWaalsContact O-CB 3.31Å; A169-S173 WeakPolarHBondContact O-CB 3.48Å; A169-S173 PolarHBondContact O-N 3.38Å; A169-S173 PolarHBondContact O-OG 2.87Å
170	W	96.8	Very high	92.7	Very high	61 Å²	61	62.6 Å²	62.6	23%	0.231	34%	0.336	C	S	.	.	H	α-helix	trans	-64.6	-47.6	175.6	-80	96.2	0	0	0	112.2	S86 A90 I93 V128 A131 I166 A167 S173 F174	S86-W170 PolarHBondContact OG-NE1 3.39Å; A90-W170 HydrophobicContact CB-CH2 3.98Å; A90-W170 HydrophobicContact CB-CZ2 3.92Å; I93-W170 HydrophobicContact CD1-CH2 4.05Å; V128-W170 HydrophobicContact CG1-CH2 4.2Å; V128-W170 HydrophobicContact CG2-CH2 4.29Å; V128-W170 HydrophobicContact CG2-CZ3 3.96Å; A131-W170 HydrophobicContact CB-CD2 3.79Å; A131-W170 HydrophobicContact CB-CE3 3.78Å; A131-W170 HydrophobicContact CB-CG 4.32Å; A131-W170 HydrophobicContact CB-CH2 4.34Å; A131-W170 HydrophobicContact CB-CZ2 4.35Å; A131-W170 HydrophobicContact CB-CZ3 4.07Å; I166-W170 VanDerWaalsContact O-CD1 3.29Å; I166-W170 PolarHBondContact O-N 3.38Å; A167-W170 PolarHBondContact O-N 3.14Å; W170-S173 PolarHBondContact O-N 2.9Å; W170-F174 WeakPolarHBondContact O-CB 3.23Å; W170-F174 PolarHBondContact O-N 3.48Å
171	I	96.6	Very high	92.7	Very high	100 Å²	100	54.5 Å²	54.5	51%	0.513	30%	0.302	S	S	.	.	H	α-helix	trans	-63.3	-44.2	180	-69.9	165.1	0	0	0	111.1	A167 F174 I175	A167-I171 WeakPolarHBondContact O-CB 3.4Å; A167-I171 WeakPolarHBondContact O-CD1 3.43Å; A167-I171 WeakPolarHBondContact O-CG1 3.34Å; A167-I171 PolarHBondContact O-N 3.23Å; I171-F174 PolarHBondContact O-N 3.12Å; I171-I175 HydrophobicContact CG2-CD1 3.66Å; I171-I175 HydrophobicContact CG2-CG1 4.43Å; I171-I175 WeakPolarHBondContact O-CB 3.3Å; I171-I175 VanDerWaalsContact O-CG1 3.3Å; I171-I175 WeakPolarHBondContact O-CG1 3.48Å; I171-I175 PolarHBondContact O-N 2.92Å
172	L	93.4	Very high	92.5	Very high	79 Å²	79	52.1 Å²	52.1	41%	0.414	29%	0.291	S	S	.	.	H	α-helix	trans	-64.9	-41.5	177.3	-177.9	59.3	0	0	0	111.5	M134 A168 F174 I175 L176	M134-L172 HydrophobicContact CE-CD2 4.12Å; A168-L172 WeakPolarHBondContact O-CB 3.46Å; A168-L172 PolarHBondContact O-N 2.71Å; L172-F174 VanDerWaalsContact C-N 3.34Å; L172-F174 PolarHBondContact O-N 2.96Å; L172-I175 PolarHBondContact O-N 2.91Å; L172-L176 HydrophobicContact CD1-CD1 4.02Å; L172-L176 HydrophobicContact CD1-CG 4.11Å; L172-L176 HydrophobicContact CG-CD1 3.91Å; L172-L176 HydrophobicContact CG-CG 4.44Å; L172-L176 WeakPolarHBondContact O-CB 3.33Å; L172-L176 VanDerWaalsContact O-CG 3.23Å; L172-L176 WeakPolarHBondContact O-CG 3.13Å; L172-L176 PolarHBondContact O-N 3.24Å
173	S	94.7	Very high	92.3	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62.3	-42.4	175.6	-55.6	0	0	0	0	111.7	V127 N130 A131 A169 W170 W177	V127-S173 WeakPolarHBondContact O-CB 3.49Å; N130-S173 WeakPolarHBondContact ND2-CB 3.45Å; N130-S173 PolarHBondContact ND2-OG 3.03Å; A131-S173 VanDerWaalsContact CA-OG 3.3Å; A131-S173 WeakPolarHBondContact CA-OG 3.18Å; A131-S173 PolarHBondContact N-OG 3.22Å; A169-S173 VanDerWaalsContact O-CB 3.31Å; A169-S173 WeakPolarHBondContact O-CB 3.48Å; A169-S173 PolarHBondContact O-N 3.38Å; A169-S173 PolarHBondContact O-OG 2.87Å; W170-S173 PolarHBondContact O-N 2.9Å; S173-W177 PolarHBondContact O-N 2.89Å; S173-W177 VanDerWaalsContact O-N 3.15Å
174	F	94.6	Very high	91.9	Very high	119 Å²	119	60.5 Å²	60.5	52%	0.522	32%	0.315	S	S	.	.	H	α-helix	trans	-60.7	-51.7	175	-177.2	-95.8	0	0	0	111.8	V127 W170 I171 L172 L176 W177 A178 P179	V127-F174 HydrophobicContact CG1-CB 4.16Å; V127-F174 HydrophobicContact CG1-CD2 4.39Å; V127-F174 HydrophobicContact CG2-CD2 4.42Å; W170-F174 WeakPolarHBondContact O-CB 3.23Å; W170-F174 PolarHBondContact O-N 3.48Å; I171-F174 PolarHBondContact O-N 3.12Å; L172-F174 VanDerWaalsContact C-N 3.34Å; L172-F174 PolarHBondContact O-N 2.96Å; F174-L176 VanDerWaalsContact C-N 3.31Å; F174-L176 PolarHBondContact O-N 3.34Å; F174-W177 PolarHBondContact O-N 2.87Å; F174-A178 HydrophobicContact CD2-CB 3.77Å; F174-A178 HydrophobicContact CE1-CB 4.48Å; F174-A178 HydrophobicContact CE2-CB 3.56Å; F174-A178 HydrophobicContact CG-CB 4.33Å; F174-A178 HydrophobicContact CZ-CB 3.95Å; F174-A178 WeakPolarHBondContact O-CB 3.3Å; F174-A178 PolarHBondContact O-N 3.36Å; F174-P179 WeakPolarHBondContact O-CD 3.35Å
175	I	93	Very high	91.2	Very high	104 Å²	104	56.9 Å²	56.9	53%	0.533	30%	0.296	S	S	.	.	H	α-helix	trans	-63.6	-34.5	-178.2	-69.4	169.7	0	0	0	112.3	I171 L172 P179	I171-I175 HydrophobicContact CG2-CD1 3.66Å; I171-I175 HydrophobicContact CG2-CG1 4.43Å; I171-I175 WeakPolarHBondContact O-CB 3.3Å; I171-I175 VanDerWaalsContact O-CG1 3.3Å; I171-I175 WeakPolarHBondContact O-CG1 3.48Å; I171-I175 PolarHBondContact O-N 2.92Å; L172-I175 PolarHBondContact O-N 2.91Å; I175-P179 WeakPolarHBondContact O-CD 3.2Å; I175-P179 WeakPolarHBondContact O-CG 3.43Å
176	L	89.6	Confident	90.7	Very high	95 Å²	95	60.9 Å²	60.9	50%	0.497	31%	0.311	S	S	.	.	H	α-helix	trans	-71.8	-42.7	178	-72.7	170	0	0	0	112.9	L172 F174 A180	L172-L176 HydrophobicContact CD1-CD1 4.02Å; L172-L176 HydrophobicContact CD1-CG 4.11Å; L172-L176 HydrophobicContact CG-CD1 3.91Å; L172-L176 HydrophobicContact CG-CG 4.44Å; L172-L176 WeakPolarHBondContact O-CB 3.33Å; L172-L176 VanDerWaalsContact O-CG 3.23Å; L172-L176 WeakPolarHBondContact O-CG 3.13Å; L172-L176 PolarHBondContact O-N 3.24Å; F174-L176 VanDerWaalsContact C-N 3.31Å; F174-L176 PolarHBondContact O-N 3.34Å; L176-A180 VanDerWaalsContact O-CB 3.3Å; L176-A180 WeakPolarHBondContact O-CB 3.08Å
177	W	91	Very high	89.9	Confident	27 Å²	27	65.9 Å²	65.9	10%	0.102	34%	0.337	C	S	.	.	H	α-helix	trans	-103.7	-46.2	-169.4	-69.3	104.7	0	0	0	114.9	Y126 V127 N130 S173 F174 A180 I181 F202 A216	Y126-W177 HydrophobicContact CD1-CD2 4.11Å; Y126-W177 AromaticContact CD1-CE3 3.62Å; Y126-W177 HydrophobicContact CD1-CE3 3.62Å; Y126-W177 AromaticContact CD1-CH2 3.87Å; Y126-W177 HydrophobicContact CD1-CH2 3.87Å; Y126-W177 HydrophobicContact CD1-CZ2 4.32Å; Y126-W177 AromaticContact CD1-CZ3 3.49Å; Y126-W177 HydrophobicContact CD1-CZ3 3.49Å; Y126-W177 VanDerWaalsContact CD1-CZ3 3.49Å; Y126-W177 HydrophobicContact CE1-CH2 4.25Å; Y126-W177 AromaticContact CE1-CZ3 3.98Å; Y126-W177 HydrophobicContact CE1-CZ3 3.98Å; Y126-W177 HydrophobicContact CG-CE3 4.25Å; V127-W177 HydrophobicContact CG2-CB 3.7Å; N130-W177 PolarHBondContact OD1-NE1 3.28Å; S173-W177 PolarHBondContact O-N 2.89Å; S173-W177 VanDerWaalsContact O-N 3.15Å; F174-W177 PolarHBondContact O-N 2.87Å; W177-A180 PolarHBondContact O-N 2.65Å; W177-I181 HydrophobicContact CB-CD1 4.39Å; W177-I181 HydrophobicContact CE3-CD1 4.23Å; W177-I181 WeakPolarHBondContact O-CB 3.25Å; W177-I181 WeakPolarHBondContact O-CG1 3.45Å; W177-I181 PolarHBondContact O-N 3.48Å; W177-F202 HydrophobicContact CE3-CZ 4.37Å; W177-F202 HydrophobicContact CZ3-CE2 4.49Å; W177-F202 HydrophobicContact CZ3-CZ 4.04Å; W177-A216 HydrophobicContact CH2-CB 3.84Å; W177-A216 HydrophobicContact CZ2-CB 3.5Å; W177-A216 VanDerWaalsContact CZ2-CB 3.5Å
178	A	91.9	Very high	89	Confident	4 Å²	4	67.3 Å²	67.3	3%	0.033	34%	0.341	C	S	.	.	H	α-helix	trans	-65.5	-46.7	-174	0	0	0	0	0	112.5	A123 V127 F174 A180 I181 L182	A123-A178 HydrophobicContact CB-CB 4.41Å; V127-A178 HydrophobicContact CG2-CB 3.98Å; F174-A178 HydrophobicContact CD2-CB 3.77Å; F174-A178 HydrophobicContact CE1-CB 4.48Å; F174-A178 HydrophobicContact CE2-CB 3.56Å; F174-A178 HydrophobicContact CG-CB 4.33Å; F174-A178 HydrophobicContact CZ-CB 3.95Å; F174-A178 WeakPolarHBondContact O-CB 3.3Å; F174-A178 PolarHBondContact O-N 3.36Å; A178-A180 PolarHBondContact O-N 3.33Å; A178-I181 PolarHBondContact O-N 3.26Å; A178-L182 VanDerWaalsContact O-CB 3.26Å; A178-L182 WeakPolarHBondContact O-CB 3.17Å; A178-L182 WeakPolarHBondContact O-CG 3.22Å; A178-L182 PolarHBondContact O-N 3.02Å
179	P	90.4	Very high	88.1	Confident	47 Å²	47	67 Å²	67	31%	0.305	34%	0.344	S	S	.	.	H	α-helix	trans	-61	-41.3	172.1	-25.1	35.2	0	0	0	113.2	F174 I175 I181 F183	F174-P179 WeakPolarHBondContact O-CD 3.35Å; I175-P179 WeakPolarHBondContact O-CD 3.2Å; I175-P179 WeakPolarHBondContact O-CG 3.43Å; P179-I181 PolarHBondContact O-N 2.86Å; P179-F183 HydrophobicContact CB-CD2 4.07Å; P179-F183 WeakPolarHBondContact O-CB 3.37Å; P179-F183 PolarHBondContact O-N 3.25Å
180	A	87.3	Confident	87.2	Confident	37 Å²	37	73.6 Å²	73.6	31%	0.306	37%	0.374	S	S	.	.	H	α-helix	trans	-66.1	-35.5	-178.7	0	0	0	0	0	112.8	L176 W177 A178 W184 F202	L176-A180 VanDerWaalsContact O-CB 3.3Å; L176-A180 WeakPolarHBondContact O-CB 3.08Å; W177-A180 PolarHBondContact O-N 2.65Å; A178-A180 PolarHBondContact O-N 3.33Å; A180-W184 WeakPolarHBondContact O-CB 3.43Å; A180-F202 HydrophobicContact CB-CE1 4.19Å; A180-F202 WeakPolarHBondContact O-CD1 3.21Å; A180-F202 WeakPolarHBondContact O-CE1 3.21Å
181	I	87.8	Confident	86.2	Confident	14 Å²	14	74 Å²	74	7%	0.072	38%	0.375	C	S	.	.	H	α-helix	trans	-79.1	-46.9	177.2	-68.1	166.4	0	0	0	110.6	L122 A123 Y126 W177 A178 P179 I200 F202	L122-I181 HydrophobicContact CB-CG2 4.38Å; A123-I181 HydrophobicContact CB-CB 4.35Å; A123-I181 HydrophobicContact CB-CG2 4.14Å; Y126-I181 HydrophobicContact CG-CD1 4.16Å; W177-I181 HydrophobicContact CB-CD1 4.39Å; W177-I181 HydrophobicContact CE3-CD1 4.23Å; W177-I181 WeakPolarHBondContact O-CB 3.25Å; W177-I181 WeakPolarHBondContact O-CG1 3.45Å; W177-I181 PolarHBondContact O-N 3.48Å; A178-I181 PolarHBondContact O-N 3.26Å; P179-I181 PolarHBondContact O-N 2.86Å; I181-I200 HydrophobicContact CD1-CD1 3.73Å; I181-I200 HydrophobicContact CD1-CG1 4.47Å; I181-I200 HydrophobicContact CG1-CD1 4.01Å; I181-I200 HydrophobicContact CG1-CG1 4.42Å; I181-I200 HydrophobicContact CG1-CG2 4.34Å; I181-F202 HydrophobicContact CG1-CE1 3.81Å; I181-F202 HydrophobicContact CG1-CZ 4.24Å
182	L	87.1	Confident	85.4	Confident	60 Å²	60	73 Å²	73	31%	0.314	37%	0.374	S	S	.	.	H	α-helix	trans	-76.9	-41.2	-172.1	-62.2	175	0	0	0	113.7	D119 A123 A178 Q185	D119-L182 HydrophobicContact CB-CD2 3.91Å; A123-L182 HydrophobicContact CB-CD2 4.26Å; A123-L182 HydrophobicContact CB-CG 4.26Å; A178-L182 VanDerWaalsContact O-CB 3.26Å; A178-L182 WeakPolarHBondContact O-CB 3.17Å; A178-L182 WeakPolarHBondContact O-CG 3.22Å; A178-L182 PolarHBondContact O-N 3.02Å; L182-Q185 PolarHBondContact O-NE2 2.93Å
183	F	85.8	Confident	84.9	Confident	123 Å²	123	69.9 Å²	69.9	54%	0.539	36%	0.358	S	S	.	.	S	Bend	trans	-85.4	-14.8	-175.5	-71	-72	0	0	0	114.6	P179 Q185 F186 I187	P179-F183 HydrophobicContact CB-CD2 4.07Å; P179-F183 WeakPolarHBondContact O-CB 3.37Å; P179-F183 PolarHBondContact O-N 3.25Å; F183-Q185 VanDerWaalsContact C-N 3.31Å; F183-Q185 PolarHBondContact O-N 3.37Å; F183-F186 HydrophobicContact CD1-CD2 4.36Å; F183-F186 WeakPolarHBondContact O-CB 3.36Å; F183-F186 PolarHBondContact O-N 3.34Å; F183-I187 PolarHBondContact O-N 2.93Å; F183-I187 VanDerWaalsContact O-N 3.13Å
184	W	82.2	Confident	84.3	Confident	87 Å²	87	72.9 Å²	72.9	33%	0.33	38%	0.378	S	S	.	.	H	α-helix	trans	-58.7	-39.9	-175.7	-169.2	-93.8	0	0	0	113.4	A180 F186 I187 V188 F202	A180-W184 WeakPolarHBondContact O-CB 3.43Å; W184-F186 PolarHBondContact O-N 3.15Å; W184-I187 PolarHBondContact O-N 3.38Å; W184-I187 VanDerWaalsContact O-N 3.11Å; W184-V188 PolarHBondContact O-N 2.98Å; W184-F202 HydrophobicContact CB-CD1 4.45Å; W184-F202 HydrophobicContact CD2-CB 3.72Å; W184-F202 HydrophobicContact CD2-CD1 4.46Å; W184-F202 HydrophobicContact CE3-CB 4.29Å; W184-F202 HydrophobicContact CG-CB 3.99Å; W184-F202 HydrophobicContact CG-CD1 4.34Å; W184-F202 HydrophobicContact CZ2-CB 4.01Å
185	Q	79.9	Confident	83.5	Confident	41 Å²	41	72.6 Å²	72.6	19%	0.192	40%	0.397	C	S	.	.	H	α-helix	trans	-62.9	-27.5	176.8	67.1	-165.4	-48.6	0	0	113.3	D119 L182 F183 G189 Q190	D119-Q185 PolarHBondContact OD2-NE2 3.4Å; D119-Q185 PolarHBondContact OD2-OE1 3.49Å; L182-Q185 PolarHBondContact O-NE2 2.93Å; F183-Q185 VanDerWaalsContact C-N 3.31Å; F183-Q185 PolarHBondContact O-N 3.37Å; Q185-G189 PolarHBondContact O-N 2.94Å; Q185-Q190 PolarHBondContact O-N 2.87Å
186	F	81.1	Confident	82.8	Confident	158 Å²	158	69 Å²	69	69%	0.693	39%	0.386	S	S	*	.	H	α-helix	trans	-80.7	-31.2	174.5	-61	-91.7	0	0	0	112.2	F183 W184 G189	F183-F186 HydrophobicContact CD1-CD2 4.36Å; F183-F186 WeakPolarHBondContact O-CB 3.36Å; F183-F186 PolarHBondContact O-N 3.34Å; W184-F186 PolarHBondContact O-N 3.15Å; F186-G189 PolarHBondContact O-N 3.31Å
187	I	78.3	Confident	82.7	Confident	128 Å²	128	69.2 Å²	69.2	66%	0.656	39%	0.385	S	S	*	.	H	α-helix	trans	-70.6	-40.3	175.3	-64.1	168.6	0	0	0	110.9	F183 W184 G189	F183-I187 PolarHBondContact O-N 2.93Å; F183-I187 VanDerWaalsContact O-N 3.13Å; W184-I187 PolarHBondContact O-N 3.38Å; W184-I187 VanDerWaalsContact O-N 3.11Å; I187-G189 VanDerWaalsContact C-N 3.34Å
188	V	76.9	Confident	82.6	Confident	71 Å²	71	68.4 Å²	68.4	43%	0.43	38%	0.383	S	S	.	.	H	α-helix	trans	-79	-19.3	175.5	178.9	0	0	0	0	111.9	W184 Q190	W184-V188 PolarHBondContact O-N 2.98Å; V188-Q190 PolarHBondContact O-N 3.07Å; V188-Q190 VanDerWaalsContact O-N 3.16Å
189	G	75.9	Confident	82.3	Confident	50 Å²	50	72.1 Å²	72.1	52%	0.515	40%	0.397	S	S	.	.	S	Bend	trans	71	0.5	-179.8	0	0	0	0	0	115	Q185 F186 I187	Q185-G189 PolarHBondContact O-N 2.94Å; F186-G189 PolarHBondContact O-N 3.31Å; I187-G189 VanDerWaalsContact C-N 3.34Å
190	Q	76	Confident	82	Confident	140 Å²	140	70.3 Å²	70.3	65%	0.654	38%	0.384	S	S	*	.	S	Bend	trans	-147.2	142.6	179.5	-72.4	-60.2	-34.4	0	0	110.3	Q185 V188 Q201	Q185-Q190 PolarHBondContact O-N 2.87Å; V188-Q190 PolarHBondContact O-N 3.07Å; V188-Q190 VanDerWaalsContact O-N 3.16Å; Q190-Q201 PolarHBondContact O-NE2 2.91Å
191	R	77.2	Confident	81.6	Confident	70 Å²	70	69.6 Å²	69.6	26%	0.264	37%	0.374	S	S	.	.			trans	-89.2	111.9	171.8	-173.9	-174.4	-172.7	89.1	1.9	109.3	P115 D119 V193	P115-R191 VanDerWaalsContact CB-CZ 3.43Å; D119-R191 IonicContact OD1-CZ 2.77Å; D119-R191 VanDerWaalsContact OD1-CZ 3.28Å; D119-R191 IonicContact OD1-NH1 2.74Å; D119-R191 PolarHBondContact OD1-NH1 3.38Å; D119-R191 IonicContact OD1-NH2 3.28Å; D119-R191 PolarHBondContact OD1-NH2 2.9Å; D119-R191 IonicContact OD2-CZ 2.73Å; D119-R191 IonicContact OD2-NH1 2.71Å; D119-R191 PolarHBondContact OD2-NH1 2.71Å; D119-R191 IonicContact OD2-NH2 3.77Å; R191-V193 HydrophobicContact CG-CB 4.3Å
192	T	79.7	Confident	81.2	Confident	80 Å²	80	69.4 Å²	69.4	49%	0.491	37%	0.373	S	S	.	.			trans	-94.3	13.1	-180	61.7	0	0	0	0	113.8	Y199 Q201	T192-Y199 PolarHBondContact O-OH 2.66Å; T192-Q201 VanDerWaalsContact OG1-CG 3.25Å; T192-Q201 WeakPolarHBondContact OG1-CG 3.32Å; T192-Q201 PolarHBondContact OG1-NE2 2.94Å
193	V	81.9	Confident	80.8	Confident	12 Å²	12	69 Å²	69	7%	0.073	37%	0.371	C	S	.	.	S	Bend	trans	-93.4	122.6	173.4	-179.4	0	0	0	0	108	R191 Y199 Q201	R191-V193 HydrophobicContact CG-CB 4.3Å; V193-Y199 HydrophobicContact CB-CE1 4.47Å; V193-Y199 HydrophobicContact CG1-CD1 4.08Å; V193-Y199 HydrophobicContact CG1-CE1 3.83Å; V193-Y199 HydrophobicContact CG2-CD2 4.28Å; V193-Y199 HydrophobicContact CG2-CE1 4.49Å; V193-Y199 HydrophobicContact CG2-CE2 3.91Å; V193-Q201 HydrophobicContact CG2-CB 4.16Å; V193-Q201 HydrophobicContact CG2-CG 4.42Å
194	P	81.8	Confident	80.4	Confident	64 Å²	64	66.2 Å²	66.2	42%	0.416	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-70.5	158.6	-175.7	29.8	-34.7	0	0	0	112.6	G196 E197 Y199	P194-G196 PolarHBondContact O-N 2.89Å; P194-E197 HydrophobicContact CG-CB 4.05Å; P194-E197 HydrophobicContact CG-CG 4.01Å; P194-E197 VanDerWaalsContact CG-OE2 3.32Å; P194-E197 WeakPolarHBondContact CG-OE2 3.33Å; P194-E197 PolarHBondContact O-N 3.03Å; P194-Y199 WeakPolarHBondContact CD-OH 3.39Å
195	A	77.9	Confident	80.4	Confident	112 Å²	112	66.1 Å²	66.1	93%	0.926	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67	121.2	176.1	0	0	0	0	0	110.4
196	G	80.2	Confident	80.6	Confident	29 Å²	29	69.1 Å²	69.1	30%	0.299	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	106.4	-12.2	-177.6	0	0	0	0	0	114.6	S110 W111 P194	S110-G196 CarbonylContact C-O 3.42Å; S110-G196 WeakPolarHBondContact CA-O 3.48Å; S110-G196 WeakPolarHBondContact CB-O 3.49Å; W111-G196 PolarHBondContact N-O 2.94Å; P194-G196 PolarHBondContact O-N 2.89Å
197	E	86.3	Confident	80.8	Confident	100 Å²	100	65 Å²	65	47%	0.467	39%	0.391	S	S	.	.			trans	-107.7	156.2	173.4	-62.7	-173.2	167.7	0	0	111.6	P194 Y199	P194-E197 HydrophobicContact CG-CB 4.05Å; P194-E197 HydrophobicContact CG-CG 4.01Å; P194-E197 VanDerWaalsContact CG-OE2 3.32Å; P194-E197 WeakPolarHBondContact CG-OE2 3.33Å; P194-E197 PolarHBondContact O-N 3.03Å; E197-Y199 HydrophobicContact CB-CD1 4.16Å; E197-Y199 HydrophobicContact CB-CE1 4.15Å; E197-Y199 WeakPolarHBondContact OE2-CE1 3.16Å
198	C	88.4	Confident	81.1	Confident	10 Å²	10	61.1 Å²	61.1	7%	0.068	37%	0.373	C	S	.	.			trans	-136.7	101.9	175.2	-176.6	0	0	0	0	111.5	Y105 W111 C118 W121	Y105-C198 HydrophobicContact CE2-CB 4.42Å; W111-C198 HydrophobicContact CB-CB 3.96Å; W111-C198 HydrophobicContact CD2-CB 3.81Å; W111-C198 HydrophobicContact CE3-CB 3.89Å; W111-C198 HydrophobicContact CG-CB 3.84Å; C118-C198 VanDerWaalsContact CA-SG 3.51Å; C118-C198 HydrophobicContact CB-CB 3.96Å; C118-C198 WeakPolarHBondContact CB-SG 3.48Å; C118-C198 WeakPolarHBondContact SG-CA 3.43Å; C118-C198 WeakPolarHBondContact SG-CB 3.19Å; C118-C198 CovalentContact SG-SG 2.03Å; C118-C198 PolarHBondContact SG-SG 3.33Å; W121-C198 HydrophobicContact CZ3-CB 4.35Å; W121-C198 VanDerWaalsContact CZ3-SG 3.56Å
199	Y	86	Confident	81.6	Confident	82 Å²	82	59.9 Å²	59.9	32%	0.322	37%	0.366	S	S	.	.			trans	-147.9	163.2	175	64	-94.3	0	0	0	110.8	T192 V193 P194 E197 Q201	T192-Y199 PolarHBondContact O-OH 2.66Å; V193-Y199 HydrophobicContact CB-CE1 4.47Å; V193-Y199 HydrophobicContact CG1-CD1 4.08Å; V193-Y199 HydrophobicContact CG1-CE1 3.83Å; V193-Y199 HydrophobicContact CG2-CD2 4.28Å; V193-Y199 HydrophobicContact CG2-CE1 4.49Å; V193-Y199 HydrophobicContact CG2-CE2 3.91Å; P194-Y199 WeakPolarHBondContact CD-OH 3.39Å; E197-Y199 HydrophobicContact CB-CD1 4.16Å; E197-Y199 HydrophobicContact CB-CE1 4.15Å; E197-Y199 WeakPolarHBondContact OE2-CE1 3.16Å; Y199-Q201 PolarHBondContact O-N 2.94Å
200	I	84.3	Confident	82.1	Confident	8 Å²	8	64 Å²	64	4%	0.041	37%	0.37	C	S	.	.			trans	-76.2	121.2	-177.6	-64.4	176.6	0	0	0	110.7	L122 Y126 I181 F202 L203	L122-I200 HydrophobicContact CB-CG1 4.17Å; L122-I200 HydrophobicContact CD1-CG1 3.93Å; L122-I200 HydrophobicContact CD2-CG1 4.35Å; L122-I200 HydrophobicContact CG-CG1 4.39Å; Y126-I200 HydrophobicContact CD1-CD1 4.04Å; Y126-I200 HydrophobicContact CD2-CD1 3.79Å; Y126-I200 HydrophobicContact CE1-CD1 3.74Å; Y126-I200 HydrophobicContact CE2-CD1 3.49Å; Y126-I200 VanDerWaalsContact CE2-CD1 3.49Å; Y126-I200 HydrophobicContact CG-CD1 4.06Å; Y126-I200 VanDerWaalsContact CZ-CD1 3.45Å; I181-I200 HydrophobicContact CD1-CD1 3.73Å; I181-I200 HydrophobicContact CD1-CG1 4.47Å; I181-I200 HydrophobicContact CG1-CD1 4.01Å; I181-I200 HydrophobicContact CG1-CG1 4.42Å; I181-I200 HydrophobicContact CG1-CG2 4.34Å; I200-F202 HydrophobicContact CG2-CD1 3.47Å; I200-F202 VanDerWaalsContact CG2-CD1 3.47Å; I200-F202 HydrophobicContact CG2-CD2 3.99Å; I200-F202 HydrophobicContact CG2-CE1 3.35Å; I200-F202 HydrophobicContact CG2-CE2 3.89Å; I200-F202 HydrophobicContact CG2-CG 3.79Å; I200-F202 HydrophobicContact CG2-CZ 3.57Å; I200-F202 PolarHBondContact O-N 3.4Å; I200-L203 HydrophobicContact CB-CB 4.42Å; I200-L203 HydrophobicContact CB-CD1 3.95Å; I200-L203 HydrophobicContact CB-CG 4.01Å; I200-L203 HydrophobicContact CD1-CD1 4.13Å; I200-L203 HydrophobicContact CG2-CD1 4.34Å; I200-L203 HydrophobicContact CG2-CG 3.96Å; I200-L203 PolarHBondContact O-N 3.38Å; I200-L203 VanDerWaalsContact O-N 3.07Å
201	Q	79.9	Confident	82.7	Confident	22 Å²	22	59.1 Å²	59.1	10%	0.103	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	-55.4	-44.2	-174.5	-166.8	180	3.5	0	0	114	Q190 T192 V193 Y199 L203 S204	Q190-Q201 PolarHBondContact O-NE2 2.91Å; T192-Q201 VanDerWaalsContact OG1-CG 3.25Å; T192-Q201 WeakPolarHBondContact OG1-CG 3.32Å; T192-Q201 PolarHBondContact OG1-NE2 2.94Å; V193-Q201 HydrophobicContact CG2-CB 4.16Å; V193-Q201 HydrophobicContact CG2-CG 4.42Å; Y199-Q201 PolarHBondContact O-N 2.94Å; Q201-L203 VanDerWaalsContact C-N 3.27Å; Q201-L203 PolarHBondContact O-N 2.56Å; Q201-S204 VanDerWaalsContact O-CB 3.31Å; Q201-S204 WeakPolarHBondContact O-CB 3.43Å; Q201-S204 PolarHBondContact O-N 2.9Å; Q201-S204 PolarHBondContact O-OG 2.92Å
202	F	78.6	Confident	83.1	Confident	10 Å²	10	57.5 Å²	57.5	4%	0.044	36%	0.355	C	S	.	.	G	3₁₀ helix	trans	-69.7	-21	-178.4	65.9	-109.9	0	0	0	114	W177 A180 I181 W184 I200 S204 N205 V208 T212	W177-F202 HydrophobicContact CE3-CZ 4.37Å; W177-F202 HydrophobicContact CZ3-CE2 4.49Å; W177-F202 HydrophobicContact CZ3-CZ 4.04Å; A180-F202 HydrophobicContact CB-CE1 4.19Å; A180-F202 WeakPolarHBondContact O-CD1 3.21Å; A180-F202 WeakPolarHBondContact O-CE1 3.21Å; I181-F202 HydrophobicContact CG1-CE1 3.81Å; I181-F202 HydrophobicContact CG1-CZ 4.24Å; W184-F202 HydrophobicContact CB-CD1 4.45Å; W184-F202 HydrophobicContact CD2-CB 3.72Å; W184-F202 HydrophobicContact CD2-CD1 4.46Å; W184-F202 HydrophobicContact CE3-CB 4.29Å; W184-F202 HydrophobicContact CG-CB 3.99Å; W184-F202 HydrophobicContact CG-CD1 4.34Å; W184-F202 HydrophobicContact CZ2-CB 4.01Å; I200-F202 HydrophobicContact CG2-CD1 3.47Å; I200-F202 VanDerWaalsContact CG2-CD1 3.47Å; I200-F202 HydrophobicContact CG2-CD2 3.99Å; I200-F202 HydrophobicContact CG2-CE1 3.35Å; I200-F202 HydrophobicContact CG2-CE2 3.89Å; I200-F202 HydrophobicContact CG2-CG 3.79Å; I200-F202 HydrophobicContact CG2-CZ 3.57Å; I200-F202 PolarHBondContact O-N 3.4Å; F202-S204 PolarHBondContact O-N 2.77Å; F202-N205 PolarHBondContact O-N 3.24Å; F202-V208 HydrophobicContact CB-CG1 4.29Å; F202-V208 HydrophobicContact CD2-CG1 3.93Å; F202-T212 HydrophobicContact CE2-CG2 4.05Å
203	L	78.8	Confident	83.4	Confident	53 Å²	53	55.4 Å²	55.4	28%	0.277	35%	0.345	S	S	.	.	G	3₁₀ helix	trans	-75.6	-0.5	175.2	-62	-177.4	0	0	0	113.2	I200 Q201 N205 T209 T212	I200-L203 HydrophobicContact CB-CB 4.42Å; I200-L203 HydrophobicContact CB-CD1 3.95Å; I200-L203 HydrophobicContact CB-CG 4.01Å; I200-L203 HydrophobicContact CD1-CD1 4.13Å; I200-L203 HydrophobicContact CG2-CD1 4.34Å; I200-L203 HydrophobicContact CG2-CG 3.96Å; I200-L203 PolarHBondContact O-N 3.38Å; I200-L203 VanDerWaalsContact O-N 3.07Å; Q201-L203 VanDerWaalsContact C-N 3.27Å; Q201-L203 PolarHBondContact O-N 2.56Å; L203-N205 VanDerWaalsContact C-N 3.3Å; L203-T209 VanDerWaalsContact CA-OG1 3.23Å; L203-T209 WeakPolarHBondContact CA-OG1 3.26Å; L203-T209 HydrophobicContact CD2-CG2 4.21Å; L203-T209 PolarHBondContact O-OG1 3.48Å; L203-T212 WeakPolarHBondContact CD2-OG1 3.38Å
204	S	76.8	Confident	83.7	Confident	63 Å²	63	58.4 Å²	58.4	44%	0.441	36%	0.36	S	S	.	.	G	3₁₀ helix	trans	-72.2	-22.8	169.1	-41.2	0	0	0	0	112.6	Q201 F202	Q201-S204 VanDerWaalsContact O-CB 3.31Å; Q201-S204 WeakPolarHBondContact O-CB 3.43Å; Q201-S204 PolarHBondContact O-N 2.9Å; Q201-S204 PolarHBondContact O-OG 2.92Å; F202-S204 PolarHBondContact O-N 2.77Å
205	N	82.8	Confident	83.7	Confident	86 Å²	86	58.3 Å²	58.3	46%	0.46	37%	0.365	S	S	.	.	S	Bend	trans	-94.5	112.9	178.5	-177.2	-45.9	0	0	0	109.6	F202 L203 A207 V208 T209	F202-N205 PolarHBondContact O-N 3.24Å; L203-N205 VanDerWaalsContact C-N 3.3Å; N205-A207 PolarHBondContact O-N 3.22Å; N205-A207 VanDerWaalsContact O-N 3.12Å; N205-A207 WeakPolarHBondContact OD1-CB 3.3Å; N205-A207 PolarHBondContact OD1-N 3.18Å; N205-V208 HydrophobicContact CB-CB 4.21Å; N205-V208 HydrophobicContact CB-CG2 3.97Å; N205-V208 PolarHBondContact O-N 3.23Å; N205-V208 PolarHBondContact OD1-N 3.43Å; N205-T209 PolarHBondContact O-N 2.9Å; N205-T209 PolarHBondContact O-OG1 3.35Å
206	P	84.6	Confident	83.8	Confident	103 Å²	103	54.3 Å²	54.3	67%	0.669	33%	0.332	S	S	*	.	H	α-helix	trans	-62.1	-27.4	-171.3	23.9	-34.1	0	0	0	113.9	F210	P206-F210 VanDerWaalsContact O-CB 3.26Å; P206-F210 WeakPolarHBondContact O-CB 3.36Å; P206-F210 PolarHBondContact O-N 2.88Å
207	A	85.3	Confident	84	Confident	73 Å²	73	58.9 Å²	58.9	60%	0.603	34%	0.344	S	S	*	.	H	α-helix	trans	-71	-38.8	175.2	0	0	0	0	0	111.8	N205 G211	N205-A207 PolarHBondContact O-N 3.22Å; N205-A207 VanDerWaalsContact O-N 3.12Å; N205-A207 WeakPolarHBondContact OD1-CB 3.3Å; N205-A207 PolarHBondContact OD1-N 3.18Å; A207-G211 PolarHBondContact O-N 2.88Å
208	V	83.5	Confident	84	Confident	45 Å²	45	60.2 Å²	60.2	27%	0.273	35%	0.346	S	S	.	.	H	α-helix	trans	-70.7	-41.3	174.8	-176	0	0	0	0	110.2	F202 N205 F210 G211 T212	F202-V208 HydrophobicContact CB-CG1 4.29Å; F202-V208 HydrophobicContact CD2-CG1 3.93Å; N205-V208 HydrophobicContact CB-CB 4.21Å; N205-V208 HydrophobicContact CB-CG2 3.97Å; N205-V208 PolarHBondContact O-N 3.23Å; N205-V208 PolarHBondContact OD1-N 3.43Å; V208-F210 VanDerWaalsContact C-N 3.34Å; V208-F210 PolarHBondContact O-N 3.48Å; V208-G211 PolarHBondContact O-N 3.1Å; V208-T212 HydrophobicContact CG1-CG2 4.19Å; V208-T212 WeakPolarHBondContact O-CB 3.4Å; V208-T212 WeakPolarHBondContact O-CG2 3.31Å; V208-T212 PolarHBondContact O-N 3.29Å; V208-T212 PolarHBondContact O-OG1 2.9Å
209	T	87.2	Confident	83.9	Confident	46 Å²	46	64.2 Å²	64.2	28%	0.282	37%	0.366	S	S	.	.	H	α-helix	trans	-59.5	-42.9	174.6	-53.4	0	0	0	0	111.8	L203 N205 T212 A213	L203-T209 VanDerWaalsContact CA-OG1 3.23Å; L203-T209 WeakPolarHBondContact CA-OG1 3.26Å; L203-T209 HydrophobicContact CD2-CG2 4.21Å; L203-T209 PolarHBondContact O-OG1 3.48Å; N205-T209 PolarHBondContact O-N 2.9Å; N205-T209 PolarHBondContact O-OG1 3.35Å; T209-T212 WeakPolarHBondContact CA-OG1 3.33Å; T209-T212 PolarHBondContact O-OG1 2.86Å; T209-A213 WeakPolarHBondContact O-CB 3.44Å; T209-A213 PolarHBondContact O-N 2.98Å
210	F	88	Confident	83.8	Confident	137 Å²	137	60.8 Å²	60.8	60%	0.601	35%	0.354	S	S	*	.	H	α-helix	trans	-69.7	-45.4	178.2	-172.1	-111.4	0	0	0	112	P206 V208 A213 I214	P206-F210 VanDerWaalsContact O-CB 3.26Å; P206-F210 WeakPolarHBondContact O-CB 3.36Å; P206-F210 PolarHBondContact O-N 2.88Å; V208-F210 VanDerWaalsContact C-N 3.34Å; V208-F210 PolarHBondContact O-N 3.48Å; F210-A213 PolarHBondContact O-N 3.37Å; F210-I214 HydrophobicContact CD1-CD1 3.84Å; F210-I214 HydrophobicContact CE1-CD1 3.47Å; F210-I214 VanDerWaalsContact CE1-CD1 3.47Å; F210-I214 HydrophobicContact CE2-CD1 4.36Å; F210-I214 HydrophobicContact CG-CD1 4.43Å; F210-I214 HydrophobicContact CZ-CD1 3.77Å; F210-I214 WeakPolarHBondContact O-CG1 3.45Å; F210-I214 PolarHBondContact O-N 3.46Å
211	G	86.8	Confident	84	Confident	37 Å²	37	63.5 Å²	63.5	38%	0.381	37%	0.37	S	S	.	.	H	α-helix	trans	-63.5	-42	176.8	0	0	0	0	0	113.1	A207 V208 I214 A215	A207-G211 PolarHBondContact O-N 2.88Å; V208-G211 PolarHBondContact O-N 3.1Å; G211-I214 PolarHBondContact O-N 3.49Å; G211-A215 PolarHBondContact O-N 3.4Å; G211-A215 VanDerWaalsContact O-N 3.14Å
212	T	85.7	Confident	84.6	Confident	36 Å²	36	66.7 Å²	66.7	22%	0.221	39%	0.391	C	S	.	.	H	α-helix	trans	-69	-41.7	176.1	50.6	0	0	0	0	111.4	F202 L203 V208 T209 I214 A215 A216	F202-T212 HydrophobicContact CE2-CG2 4.05Å; L203-T212 WeakPolarHBondContact CD2-OG1 3.38Å; V208-T212 HydrophobicContact CG1-CG2 4.19Å; V208-T212 WeakPolarHBondContact O-CB 3.4Å; V208-T212 WeakPolarHBondContact O-CG2 3.31Å; V208-T212 PolarHBondContact O-N 3.29Å; V208-T212 PolarHBondContact O-OG1 2.9Å; T209-T212 WeakPolarHBondContact CA-OG1 3.33Å; T209-T212 PolarHBondContact O-OG1 2.86Å; T212-I214 VanDerWaalsContact C-N 3.34Å; T212-I214 PolarHBondContact O-N 2.9Å; T212-A215 PolarHBondContact O-N 3.36Å; T212-A216 WeakPolarHBondContact O-CB 3.32Å; T212-A216 PolarHBondContact O-N 2.85Å
213	A	87.3	Confident	85	Confident	35 Å²	35	69 Å²	69	29%	0.289	40%	0.404	S	S	.	.	H	α-helix	trans	-59	-41.2	173.2	0	0	0	0	0	112.8	T209 F210 F217 Y218	T209-A213 WeakPolarHBondContact O-CB 3.44Å; T209-A213 PolarHBondContact O-N 2.98Å; F210-A213 PolarHBondContact O-N 3.37Å; A213-F217 WeakPolarHBondContact O-CB 3.28Å; A213-F217 PolarHBondContact O-N 3.02Å; A213-Y218 HydrophobicContact CB-CE2 4.45Å; A213-Y218 WeakPolarHBondContact O-CD2 3.39Å; A213-Y218 PolarHBondContact O-N 3.4Å
214	I	88	Confident	85.5	Confident	75 Å²	75	68.8 Å²	68.8	39%	0.385	40%	0.401	S	S	.	.	I	π-helix	trans	-60.1	-48.9	175.2	-73.8	170.8	0	0	0	111.3	F210 G211 T212 Y218 L219	F210-I214 HydrophobicContact CD1-CD1 3.84Å; F210-I214 HydrophobicContact CE1-CD1 3.47Å; F210-I214 VanDerWaalsContact CE1-CD1 3.47Å; F210-I214 HydrophobicContact CE2-CD1 4.36Å; F210-I214 HydrophobicContact CG-CD1 4.43Å; F210-I214 HydrophobicContact CZ-CD1 3.77Å; F210-I214 WeakPolarHBondContact O-CG1 3.45Å; F210-I214 PolarHBondContact O-N 3.46Å; G211-I214 PolarHBondContact O-N 3.49Å; T212-I214 VanDerWaalsContact C-N 3.34Å; T212-I214 PolarHBondContact O-N 2.9Å; I214-Y218 HydrophobicContact CG1-CD2 4.31Å; I214-L219 WeakPolarHBondContact O-CB 3.19Å; I214-L219 PolarHBondContact O-N 2.92Å
215	A	80.9	Confident	86	Confident	62 Å²	62	69.1 Å²	69.1	51%	0.512	40%	0.401	S	S	.	.	I	π-helix	trans	-70.1	-37.7	-178.7	0	0	0	0	0	113.4	G211 T212 P220	G211-A215 PolarHBondContact O-N 3.4Å; G211-A215 VanDerWaalsContact O-N 3.14Å; T212-A215 PolarHBondContact O-N 3.36Å; A215-P220 WeakPolarHBondContact O-CD 3.44Å
216	A	81.4	Confident	86.3	Confident	28 Å²	28	68.6 Å²	68.6	23%	0.231	40%	0.401	C	S	.	.	I	π-helix	trans	-84.9	-38.2	-172.6	0	0	0	0	0	114.3	W177 T212 P220	W177-A216 HydrophobicContact CH2-CB 3.84Å; W177-A216 HydrophobicContact CZ2-CB 3.5Å; W177-A216 VanDerWaalsContact CZ2-CB 3.5Å; T212-A216 WeakPolarHBondContact O-CB 3.32Å; T212-A216 PolarHBondContact O-N 2.85Å; A216-P220 WeakPolarHBondContact O-CG 3.02Å
217	F	83	Confident	86.4	Confident	125 Å²	125	64.2 Å²	64.2	55%	0.548	37%	0.372	S	S	.	.	I	π-helix	trans	-115	-60.7	-170.3	-178.7	-100.3	0	0	0	111.3	A213 L219 P220 V221	A213-F217 WeakPolarHBondContact O-CB 3.28Å; A213-F217 PolarHBondContact O-N 3.02Å; F217-L219 PolarHBondContact O-N 2.92Å; F217-P220 WeakPolarHBondContact O-CD 3.29Å; F217-V221 HydrophobicContact CD2-CG2 4.37Å; F217-V221 HydrophobicContact CE1-CG2 4.48Å; F217-V221 HydrophobicContact CE2-CG2 4.2Å; F217-V221 HydrophobicContact CZ-CG2 4.25Å; F217-V221 WeakPolarHBondContact O-CB 3.04Å; F217-V221 WeakPolarHBondContact O-CG2 3.38Å; F217-V221 PolarHBondContact O-N 3.04Å
218	Y	87.6	Confident	86.5	Confident	129 Å²	129	68.8 Å²	68.8	51%	0.506	37%	0.374	S	S	.	.	I	π-helix	trans	-65.1	-43.8	-173	-67.4	-85.4	0	0	0	112.5	A213 I214 V221 V222	A213-Y218 HydrophobicContact CB-CE2 4.45Å; A213-Y218 WeakPolarHBondContact O-CD2 3.39Å; A213-Y218 PolarHBondContact O-N 3.4Å; I214-Y218 HydrophobicContact CG1-CD2 4.31Å; Y218-V221 PolarHBondContact O-N 2.93Å; Y218-V222 WeakPolarHBondContact O-CB 3.33Å; Y218-V222 VanDerWaalsContact O-CG2 3.26Å; Y218-V222 WeakPolarHBondContact O-CG2 3.5Å; Y218-V222 PolarHBondContact O-N 3.07Å
219	L	86.5	Confident	86.6	Confident	93 Å²	93	70.6 Å²	70.6	49%	0.487	38%	0.382	S	S	.	.	H	α-helix	trans	-63.8	-49.2	-179.8	178.7	153	0	0	0	112.3	I214 F217 V221 V222 I223	I214-L219 WeakPolarHBondContact O-CB 3.19Å; I214-L219 PolarHBondContact O-N 2.92Å; F217-L219 PolarHBondContact O-N 2.92Å; L219-V221 PolarHBondContact O-N 3.45Å; L219-V222 PolarHBondContact O-N 3.46Å; L219-I223 HydrophobicContact CD2-CD1 3.63Å; L219-I223 HydrophobicContact CG-CD1 4.19Å; L219-I223 WeakPolarHBondContact O-CG1 3.35Å; L219-I223 PolarHBondContact O-N 3.27Å
220	P	84	Confident	86.5	Confident	11 Å²	11	71.4 Å²	71.4	7%	0.071	39%	0.385	C	S	.	.	H	α-helix	trans	-58.3	-44.2	171	-32.2	40.9	0	0	0	114.1	V133 L137 A215 A216 F217 V222 I223 M224	V133-P220 HydrophobicContact CG1-CB 3.67Å; V133-P220 HydrophobicContact CG1-CG 4.33Å; L137-P220 HydrophobicContact CD1-CB 4.09Å; A215-P220 WeakPolarHBondContact O-CD 3.44Å; A216-P220 WeakPolarHBondContact O-CG 3.02Å; F217-P220 WeakPolarHBondContact O-CD 3.29Å; P220-V222 PolarHBondContact O-N 2.91Å; P220-I223 PolarHBondContact O-N 3.07Å; P220-M224 WeakPolarHBondContact O-CB 3.27Å; P220-M224 WeakPolarHBondContact O-CG 3.36Å; P220-M224 PolarHBondContact O-N 2.9Å
221	V	88.4	Confident	86.3	Confident	65 Å²	65	66.4 Å²	66.4	39%	0.394	36%	0.364	S	S	.	.	H	α-helix	trans	-63.4	-40.9	179.3	168.7	0	0	0	0	111.8	F217 Y218 L219 M224 T225	F217-V221 HydrophobicContact CD2-CG2 4.37Å; F217-V221 HydrophobicContact CE1-CG2 4.48Å; F217-V221 HydrophobicContact CE2-CG2 4.2Å; F217-V221 HydrophobicContact CZ-CG2 4.25Å; F217-V221 WeakPolarHBondContact O-CB 3.04Å; F217-V221 WeakPolarHBondContact O-CG2 3.38Å; F217-V221 PolarHBondContact O-N 3.04Å; Y218-V221 PolarHBondContact O-N 2.93Å; L219-V221 PolarHBondContact O-N 3.45Å; V221-M224 PolarHBondContact O-N 3.42Å; V221-T225 VanDerWaalsContact O-CB 3.31Å; V221-T225 WeakPolarHBondContact O-CB 3.33Å; V221-T225 PolarHBondContact O-N 3.04Å; V221-T225 PolarHBondContact O-OG1 2.86Å
222	V	90.7	Very high	86.1	Confident	89 Å²	89	66.6 Å²	66.6	54%	0.539	36%	0.359	S	S	.	.	H	α-helix	trans	-65	-46.6	175.8	168.1	0	0	0	0	111	Y218 L219 P220 M224 T225 V226	Y218-V222 WeakPolarHBondContact O-CB 3.33Å; Y218-V222 VanDerWaalsContact O-CG2 3.26Å; Y218-V222 WeakPolarHBondContact O-CG2 3.5Å; Y218-V222 PolarHBondContact O-N 3.07Å; L219-V222 PolarHBondContact O-N 3.46Å; P220-V222 PolarHBondContact O-N 2.91Å; V222-M224 PolarHBondContact O-N 2.92Å; V222-T225 PolarHBondContact O-N 3.46Å; V222-V226 HydrophobicContact CG1-CG2 4.44Å; V222-V226 WeakPolarHBondContact O-CB 3.39Å; V222-V226 WeakPolarHBondContact O-CG2 3.48Å; V222-V226 PolarHBondContact O-N 2.95Å
223	I	88.6	Confident	86	Confident	59 Å²	59	69.2 Å²	69.2	30%	0.303	37%	0.371	S	S	.	.	H	α-helix	trans	-60.9	-45.5	177.5	-66.6	169.6	0	0	0	110.5	L137 F141 L219 P220 T225 V226 L227	L137-I223 HydrophobicContact CD2-CB 4Å; L137-I223 HydrophobicContact CD2-CG2 3.52Å; F141-I223 HydrophobicContact CE2-CG2 4.06Å; F141-I223 HydrophobicContact CZ-CG2 3.97Å; L219-I223 HydrophobicContact CD2-CD1 3.63Å; L219-I223 HydrophobicContact CG-CD1 4.19Å; L219-I223 WeakPolarHBondContact O-CG1 3.35Å; L219-I223 PolarHBondContact O-N 3.27Å; P220-I223 PolarHBondContact O-N 3.07Å; I223-T225 PolarHBondContact O-N 2.76Å; I223-V226 PolarHBondContact O-N 2.88Å; I223-L227 HydrophobicContact CG2-CD1 3.87Å; I223-L227 HydrophobicContact CG2-CG 4.36Å; I223-L227 WeakPolarHBondContact O-CB 3.21Å; I223-L227 VanDerWaalsContact O-CG 3.29Å; I223-L227 WeakPolarHBondContact O-CG 3.33Å; I223-L227 PolarHBondContact O-N 2.94Å
224	M	88	Confident	85.6	Confident	47 Å²	47	68.5 Å²	68.5	23%	0.232	37%	0.366	C	S	.	.	H	α-helix	trans	-59.5	-45.7	176.4	-75.1	-67.7	-101.3	0	0	112.3	L136 L137 S140 P220 V221 V222 L227 Y228	L136-M224 HydrophobicContact CB-CE 3.49Å; L136-M224 VanDerWaalsContact CB-CE 3.49Å; L137-M224 HydrophobicContact CB-SD 4.36Å; L137-M224 HydrophobicContact CD2-CG 3.65Å; L137-M224 HydrophobicContact CD2-SD 3.7Å; L137-M224 HydrophobicContact CG-CG 4Å; L137-M224 HydrophobicContact CG-SD 3.9Å; S140-M224 PolarHBondContact OG-SD 3.38Å; P220-M224 WeakPolarHBondContact O-CB 3.27Å; P220-M224 WeakPolarHBondContact O-CG 3.36Å; P220-M224 PolarHBondContact O-N 2.9Å; V221-M224 PolarHBondContact O-N 3.42Å; V222-M224 PolarHBondContact O-N 2.92Å; M224-L227 PolarHBondContact O-N 3.47Å; M224-Y228 VanDerWaalsContact O-CB 3.3Å; M224-Y228 WeakPolarHBondContact O-CB 3.39Å; M224-Y228 PolarHBondContact O-N 3.14Å
225	T	88.4	Confident	85.2	Confident	71 Å²	71	67.5 Å²	67.5	44%	0.436	37%	0.365	S	S	.	.	H	α-helix	trans	-63	-46	179.2	-58.9	0	0	0	0	111.1	V221 V222 I223 Y228 I229	V221-T225 VanDerWaalsContact O-CB 3.31Å; V221-T225 WeakPolarHBondContact O-CB 3.33Å; V221-T225 PolarHBondContact O-N 3.04Å; V221-T225 PolarHBondContact O-OG1 2.86Å; V222-T225 PolarHBondContact O-N 3.46Å; I223-T225 PolarHBondContact O-N 2.76Å; T225-Y228 PolarHBondContact O-N 3.43Å; T225-I229 HydrophobicContact CG2-CD1 3.85Å; T225-I229 WeakPolarHBondContact O-CB 3.48Å; T225-I229 VanDerWaalsContact O-CG1 3.25Å; T225-I229 WeakPolarHBondContact O-CG1 3.34Å; T225-I229 PolarHBondContact O-N 3.43Å
226	V	89.3	Confident	85	Confident	75 Å²	75	73.5 Å²	73.5	46%	0.455	37%	0.374	S	S	.	.	H	α-helix	trans	-64.1	-41.7	177.3	171	0	0	0	0	111.6	V222 I223 N230	V222-V226 HydrophobicContact CG1-CG2 4.44Å; V222-V226 WeakPolarHBondContact O-CB 3.39Å; V222-V226 WeakPolarHBondContact O-CG2 3.48Å; V222-V226 PolarHBondContact O-N 2.95Å; I223-V226 PolarHBondContact O-N 2.88Å; V226-N230 WeakPolarHBondContact CG1-ND2 3.06Å; V226-N230 WeakPolarHBondContact O-CB 3.35Å; V226-N230 PolarHBondContact O-N 3.37Å; V226-N230 PolarHBondContact O-ND2 3.44Å
227	L	85.1	Confident	84.5	Confident	11 Å²	11	75.3 Å²	75.3	6%	0.058	39%	0.385	C	S	.	.	H	α-helix	trans	-63.7	-45.9	174.9	-73	172	0	0	0	111.7	F141 Y144 I223 M224 N230 I231	F141-L227 HydrophobicContact CD1-CD1 3.93Å; F141-L227 HydrophobicContact CD1-CD2 3.78Å; F141-L227 HydrophobicContact CD2-CD1 3.8Å; F141-L227 HydrophobicContact CE1-CD1 3.91Å; F141-L227 HydrophobicContact CE1-CD2 3.75Å; F141-L227 HydrophobicContact CE1-CG 4.35Å; F141-L227 HydrophobicContact CE2-CD1 3.78Å; F141-L227 HydrophobicContact CG-CD1 3.87Å; F141-L227 HydrophobicContact CG-CD2 4.47Å; F141-L227 HydrophobicContact CZ-CD1 3.83Å; F141-L227 HydrophobicContact CZ-CD2 4.41Å; Y144-L227 HydrophobicContact CD1-CD2 4.27Å; Y144-L227 HydrophobicContact CG-CD2 4.14Å; I223-L227 HydrophobicContact CG2-CD1 3.87Å; I223-L227 HydrophobicContact CG2-CG 4.36Å; I223-L227 WeakPolarHBondContact O-CB 3.21Å; I223-L227 VanDerWaalsContact O-CG 3.29Å; I223-L227 WeakPolarHBondContact O-CG 3.33Å; I223-L227 PolarHBondContact O-N 2.94Å; M224-L227 PolarHBondContact O-N 3.47Å; L227-N230 PolarHBondContact O-N 3.02Å; L227-I231 WeakPolarHBondContact O-CD1 3.35Å; L227-I231 VanDerWaalsContact O-CG1 3.26Å; L227-I231 WeakPolarHBondContact O-CG1 3.35Å; L227-I231 PolarHBondContact O-N 3.34Å
228	Y	87.6	Confident	83.6	Confident	168 Å²	168	75.8 Å²	75.8	66%	0.659	38%	0.383	S	S	*	.	H	α-helix	trans	-63.8	-43.3	179.8	-174	-104.9	0	0	0	112.2	M224 T225 N230 I231 S232	M224-Y228 VanDerWaalsContact O-CB 3.3Å; M224-Y228 WeakPolarHBondContact O-CB 3.39Å; M224-Y228 PolarHBondContact O-N 3.14Å; T225-Y228 PolarHBondContact O-N 3.43Å; Y228-N230 PolarHBondContact O-N 3Å; Y228-I231 PolarHBondContact O-N 3.23Å; Y228-S232 WeakPolarHBondContact O-CB 3.26Å; Y228-S232 PolarHBondContact O-N 3.05Å
229	I	86.8	Confident	82.4	Confident	83 Å²	83	74.5 Å²	74.5	43%	0.426	39%	0.389	S	S	.	.	H	α-helix	trans	-57.3	-50.6	172.2	-71.4	167.1	0	0	0	110	T225 I231 S232 L233	T225-I229 HydrophobicContact CG2-CD1 3.85Å; T225-I229 WeakPolarHBondContact O-CB 3.48Å; T225-I229 VanDerWaalsContact O-CG1 3.25Å; T225-I229 WeakPolarHBondContact O-CG1 3.34Å; T225-I229 PolarHBondContact O-N 3.43Å; I229-I231 PolarHBondContact O-N 2.73Å; I229-S232 PolarHBondContact O-N 2.86Å; I229-S232 VanDerWaalsContact O-N 3.12Å; I229-S232 PolarHBondContact O-OG 3.41Å; I229-L233 HydrophobicContact CG2-CD1 3.81Å; I229-L233 HydrophobicContact CG2-CG 4.29Å; I229-L233 WeakPolarHBondContact O-CG 3.31Å; I229-L233 PolarHBondContact O-N 3.41Å
230	N	84.9	Confident	81.2	Confident	64 Å²	64	74.3 Å²	74.3	34%	0.342	40%	0.395	S	S	.	.	H	α-helix	trans	-61.5	-40.2	179.6	-80.7	-52.7	0	0	0	113.3	Y144 V226 L227 Y228 L233 A234	Y144-N230 HydrophobicContact CD2-CB 4.11Å; Y144-N230 HydrophobicContact CE2-CB 3.89Å; V226-N230 WeakPolarHBondContact CG1-ND2 3.06Å; V226-N230 WeakPolarHBondContact O-CB 3.35Å; V226-N230 PolarHBondContact O-N 3.37Å; V226-N230 PolarHBondContact O-ND2 3.44Å; L227-N230 PolarHBondContact O-N 3.02Å; Y228-N230 PolarHBondContact O-N 3Å; N230-L233 PolarHBondContact O-N 2.03Å; N230-A234 VanDerWaalsContact O-CB 3.27Å; N230-A234 WeakPolarHBondContact O-CB 3.41Å; N230-A234 PolarHBondContact O-N 3.4Å
231	I	84.1	Confident	79.9	Confident	32 Å²	32	82.5 Å²	82.5	16%	0.164	43%	0.43	C	S	.	.	H	α-helix	trans	-61.2	-45.4	172.9	-69.7	161.8	0	0	0	110.3	R143 Y144 L227 Y228 I229 A234 S235	R143-I231 HydrophobicContact CB-CD1 4Å; Y144-I231 HydrophobicContact CD2-CG1 4.37Å; L227-I231 WeakPolarHBondContact O-CD1 3.35Å; L227-I231 VanDerWaalsContact O-CG1 3.26Å; L227-I231 WeakPolarHBondContact O-CG1 3.35Å; L227-I231 PolarHBondContact O-N 3.34Å; Y228-I231 PolarHBondContact O-N 3.23Å; I229-I231 PolarHBondContact O-N 2.73Å; I231-A234 PolarHBondContact O-N 3.3Å; I231-S235 VanDerWaalsContact O-CB 3.31Å; I231-S235 WeakPolarHBondContact O-CB 3.46Å; I231-S235 PolarHBondContact O-N 2.99Å
232	S	81.9	Confident	78.4	Confident	40 Å²	40	87.2 Å²	87.2	28%	0.28	45%	0.447	S	S	.	.	H	α-helix	trans	-64.7	-41.1	-179.9	84.1	0	0	0	0	112.5	Y228 I229 S235 R236	Y228-S232 WeakPolarHBondContact O-CB 3.26Å; Y228-S232 PolarHBondContact O-N 3.05Å; I229-S232 PolarHBondContact O-N 2.86Å; I229-S232 VanDerWaalsContact O-N 3.12Å; I229-S232 PolarHBondContact O-OG 3.41Å; S232-S235 PolarHBondContact O-N 3.49Å; S232-R236 WeakPolarHBondContact O-CB 3.44Å; S232-R236 VanDerWaalsContact O-CG 3.29Å; S232-R236 WeakPolarHBondContact O-CG 3.44Å; S232-R236 PolarHBondContact O-N 3.42Å
233	L	83.9	Confident	76.1	Confident	91 Å²	91	91.4 Å²	91.4	48%	0.476	46%	0.458	S	S	.	.	H	α-helix	trans	-67.2	-44.3	176.6	-70.6	174.1	0	0	0	111.4	I229 N230 S235 R236 S237	I229-L233 HydrophobicContact CG2-CD1 3.81Å; I229-L233 HydrophobicContact CG2-CG 4.29Å; I229-L233 WeakPolarHBondContact O-CG 3.31Å; I229-L233 PolarHBondContact O-N 3.41Å; N230-L233 PolarHBondContact O-N 2.03Å; L233-S235 VanDerWaalsContact C-N 3.33Å; L233-S235 PolarHBondContact O-N 2.86Å; L233-R236 PolarHBondContact O-N 2.97Å; L233-S237 VanDerWaalsContact O-CB 3.27Å; L233-S237 WeakPolarHBondContact O-CB 3.43Å; L233-S237 PolarHBondContact O-N 2.95Å; L233-S237 PolarHBondContact O-OG 2.92Å
234	A	78.6	Confident	74.3	Confident	21 Å²	21	94 Å²	94	17%	0.174	48%	0.479	C	S	.	.	H	α-helix	trans	-63.8	-39.3	176.7	0	0	0	0	0	111.7	V147 N230 I231 S237 R238	V147-A234 HydrophobicContact CG1-CB 3.56Å; N230-A234 VanDerWaalsContact O-CB 3.27Å; N230-A234 WeakPolarHBondContact O-CB 3.41Å; N230-A234 PolarHBondContact O-N 3.4Å; I231-A234 PolarHBondContact O-N 3.3Å; A234-S237 PolarHBondContact O-N 3.37Å; A234-R238 WeakPolarHBondContact O-CG 3.26Å; A234-R238 PolarHBondContact O-N 2.82Å
235	S	79.5	Confident	72.5	Confident	53 Å²	53	100.2 Å²	100.2	37%	0.371	51%	0.507	S	S	.	.	H	α-helix	trans	-63.3	-54.6	173.8	179.9	0	0	0	0	112.1	I231 S232 L233 S237 R238 V239	I231-S235 VanDerWaalsContact O-CB 3.31Å; I231-S235 WeakPolarHBondContact O-CB 3.46Å; I231-S235 PolarHBondContact O-N 2.99Å; S232-S235 PolarHBondContact O-N 3.49Å; L233-S235 VanDerWaalsContact C-N 3.33Å; L233-S235 PolarHBondContact O-N 2.86Å; S235-S237 PolarHBondContact O-N 3.28Å; S235-R238 WeakPolarHBondContact O-CB 3.38Å; S235-R238 PolarHBondContact O-N 3.46Å; S235-V239 PolarHBondContact O-N 3.25Å; S235-V239 VanDerWaalsContact O-N 3.16Å
236	R	77.3	Confident	70.3	Confident	188 Å²	188	106.7 Å²	106.7	71%	0.709	53%	0.529	S	S	*	.	H	α-helix	trans	-55	-37.7	176.1	-73.5	175	178.7	-134.4	0.7	112.2	S232 L233 R238 V239 S240	S232-R236 WeakPolarHBondContact O-CB 3.44Å; S232-R236 VanDerWaalsContact O-CG 3.29Å; S232-R236 WeakPolarHBondContact O-CG 3.44Å; S232-R236 PolarHBondContact O-N 3.42Å; L233-R236 PolarHBondContact O-N 2.97Å; R236-R238 VanDerWaalsContact C-N 3.28Å; R236-R238 PolarHBondContact O-N 2.71Å; R236-V239 PolarHBondContact O-N 3.14Å; R236-S240 WeakPolarHBondContact O-CB 3.32Å; R236-S240 PolarHBondContact O-N 2.93Å
237	S	70.9	Confident	68.2	Low	66 Å²	66	112.4 Å²	112.4	46%	0.462	55%	0.548	S	S	.	.	H	α-helix	trans	-66.8	-22.6	176.8	-61.2	0	0	0	0	114.4	L233 A234 S235 K241	L233-S237 VanDerWaalsContact O-CB 3.27Å; L233-S237 WeakPolarHBondContact O-CB 3.43Å; L233-S237 PolarHBondContact O-N 2.95Å; L233-S237 PolarHBondContact O-OG 2.92Å; A234-S237 PolarHBondContact O-N 3.37Å; S235-S237 PolarHBondContact O-N 3.28Å; S237-K241 WeakPolarHBondContact O-CG 3.32Å
238	R	63.6	Low	66.4	Low	135 Å²	135	120.5 Å²	120.5	51%	0.509	59%	0.586	S	S	.	*	H	α-helix	trans	-81.4	-43.7	171.2	-60	-76.7	-165.9	-106.3	-3.3	110.8	V147 A234 S235 R236 K241	V147-R238 PolarHBondContact O-NH2 3.39Å; A234-R238 WeakPolarHBondContact O-CG 3.26Å; A234-R238 PolarHBondContact O-N 2.82Å; S235-R238 WeakPolarHBondContact O-CB 3.38Å; S235-R238 PolarHBondContact O-N 3.46Å; R236-R238 VanDerWaalsContact C-N 3.28Å; R236-R238 PolarHBondContact O-N 2.71Å; R238-K241 PolarHBondContact O-N 2.74Å
239	V	62.8	Low	64.3	Low	103 Å²	103	122 Å²	122	62%	0.624	60%	0.596	S	S	*	*	H	α-helix	trans	-63.5	-44.6	-179.9	178.6	0	0	0	0	111.5	S235 R236 K241 H242	S235-V239 PolarHBondContact O-N 3.25Å; S235-V239 VanDerWaalsContact O-N 3.16Å; R236-V239 PolarHBondContact O-N 3.14Å; V239-K241 VanDerWaalsContact C-N 3.28Å; V239-K241 PolarHBondContact O-N 3.5Å; V239-H242 PolarHBondContact O-N 3.32Å
240	S	60.2	Low	62.2	Low	88 Å²	88	127.7 Å²	127.7	62%	0.615	62%	0.617	S	S	*	*	H	α-helix	trans	-58.1	-39.2	179	-170.3	0	0	0	0	112.4	R236 H242 K243	R236-S240 WeakPolarHBondContact O-CB 3.32Å; R236-S240 PolarHBondContact O-N 2.93Å; S240-H242 PolarHBondContact O-N 2.79Å; S240-K243 WeakPolarHBondContact O-CB 3.36Å; S240-K243 PolarHBondContact O-N 3.47Å
241	K	57.8	Low	60	Low	184 Å²	184	128 Å²	128	80%	0.8	64%	0.635	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-5.7	176.1	-68.3	-174.3	179.9	-168	0	114.6	S237 R238 V239	S237-K241 WeakPolarHBondContact O-CG 3.32Å; R238-K241 PolarHBondContact O-N 2.74Å; V239-K241 VanDerWaalsContact C-N 3.28Å; V239-K241 PolarHBondContact O-N 3.5Å
242	H	55.8	Low	58.2	Low	164 Å²	164	134.4 Å²	134.4	76%	0.759	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	-1.9	175.8	-112	-59.9	0	0	0	114	V239 S240 P244	V239-H242 PolarHBondContact O-N 3.32Å; S240-H242 PolarHBondContact O-N 2.79Å; H242-P244 WeakPolarHBondContact O-CD 3.19Å
243	K	44.2	Very low	56.5	Low	176 Å²	176	141.7 Å²	141.7	77%	0.765	70%	0.695	S	S	*	*	S	Bend	trans	-66.8	116.6	169.1	-167.7	176	-173.7	178.7	0	108.1	S240 E245	S240-K243 WeakPolarHBondContact O-CB 3.36Å; S240-K243 PolarHBondContact O-N 3.47Å; K243-E245 PolarHBondContact O-N 3.27Å
244	P	48.8	Very low	54.5	Low	113 Å²	113	142.6 Å²	142.6	73%	0.734	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-65.9	135.9	-179.1	27.2	-33.7	0	0	0	109.7	H242 K246	H242-P244 WeakPolarHBondContact O-CD 3.19Å; P244-K246 PolarHBondContact O-N 2.99Å
245	E	50.2	Low	53.1	Low	179 Å²	179	147.2 Å²	147.2	84%	0.836	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-55.4	123.8	166.1	-69.1	-179.8	113.2	0	0	108.6	K243 K247	K243-E245 PolarHBondContact O-N 3.27Å; E245-K247 VanDerWaalsContact C-N 3.32Å; E245-K247 PolarHBondContact O-N 3.27Å
246	K	43.6	Very low	51.2	Low	207 Å²	207	152 Å²	152	90%	0.9	76%	0.756	S	S	*	*			trans	-63.7	101.3	162.1	-78.5	-172.7	175	-176.1	0	106.1	P244 E248	P244-K246 PolarHBondContact O-N 2.99Å; K246-E248 VanDerWaalsContact C-N 3.33Å; K246-E248 PolarHBondContact O-N 3Å
247	K	44.2	Very low	49.5	Very low	194 Å²	194	150.8 Å²	150.8	84%	0.843	76%	0.762	S	S	*	*			trans	-58.7	99.3	170	-77.9	-170.5	174.6	-175.2	0	108.5	E245 K249	E245-K247 VanDerWaalsContact C-N 3.32Å; E245-K247 PolarHBondContact O-N 3.27Å; K247-K249 PolarHBondContact O-N 3.13Å; K247-K249 VanDerWaalsContact O-N 3.12Å
248	E	47.9	Very low	48.3	Very low	182 Å²	182	155.3 Å²	155.3	85%	0.85	78%	0.781	S	S	*	*			trans	-60.3	114.4	173.9	-171.7	168.1	-130.2	0	0	108.2	K246 K250	K246-E248 VanDerWaalsContact C-N 3.33Å; K246-E248 PolarHBondContact O-N 3Å; E248-K250 PolarHBondContact O-N 2.93Å
249	K	43.5	Very low	47.1	Very low	200 Å²	200	159 Å²	159	87%	0.87	80%	0.8	S	S	*	*			trans	-71.1	102.2	-179.7	-70.2	-176.3	179	-179.1	0	107.6	K247 G251	K247-K249 PolarHBondContact O-N 3.13Å; K247-K249 VanDerWaalsContact O-N 3.12Å; K249-G251 PolarHBondContact O-N 3.18Å
250	K	43.3	Very low	46.1	Very low	202 Å²	202	158.2 Å²	158.2	88%	0.878	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-49.2	116.2	170.2	-71	-170.3	175.4	-172.9	0	108.8	E248 I252	E248-K250 PolarHBondContact O-N 2.93Å; K250-I252 PolarHBondContact O-N 3.46Å
251	G	38.5	Very low	45.1	Very low	69 Å²	69	161 Å²	161	71%	0.711	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-63.7	127.9	-173.7	0	0	0	0	0	111.8	K249 K253	K249-G251 PolarHBondContact O-N 3.18Å; G251-K253 PolarHBondContact O-N 2.75Å
252	I	45.8	Very low	44	Very low	168 Å²	168	160.8 Å²	160.8	86%	0.862	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-74.5	116.2	168.3	-61.4	172.9	0	0	0	106.9	K250	K250-I252 PolarHBondContact O-N 3.46Å
253	K	46.1	Very low	43.2	Very low	192 Å²	192	158.8 Å²	158.8	84%	0.835	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-80.4	126.8	172.4	-66.9	-174.7	177.9	-175.2	0	109.6	G251	G251-K253 PolarHBondContact O-N 2.75Å
254	P	42.9	Very low	42.7	Very low	110 Å²	110	158.1 Å²	158.1	71%	0.714	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-76.1	151	162.9	32.7	-33.2	0	0	0	110.5
255	P	48.5	Very low	42	Very low	118 Å²	118	159.2 Å²	159.2	77%	0.766	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-90.4	139.3	176.5	34.6	-32.7	0	0	0	112.6
256	N	39	Very low	41.1	Very low	155 Å²	155	156.1 Å²	156.1	83%	0.829	78%	0.781	S	S	*	*			trans	-145.3	109.9	156.6	-76.4	-54.3	0	0	0	104.6
257	L	41.1	Very low	40.6	Very low	162 Å²	162	151.5 Å²	151.5	85%	0.848	77%	0.767	S	S	*	*				73.3	71.6	56.9	-156.4	83.4	0	0	0	114
258	L	47	Very low	40.2	Very low	161 Å²	161	147.9 Å²	147.9	84%	0.843	76%	0.757	S	S	*	*			trans	38.9	109	134.7	-162.1	82	0	0	0	119.1
259	K	36.9	Very low	39.5	Very low	213 Å²	213	145.1 Å²	145.1	93%	0.926	75%	0.748	S	S	*	*			trans	-141.7	155.6	131.2	-150.9	167.5	-175.4	178.6	0	110.3
260	S	42.2	Very low	38.9	Very low	86 Å²	86	141.5 Å²	141.5	60%	0.601	74%	0.738	S	S	*	*			trans	-124.8	152.5	-162.5	-171.9	0	0	0	0	112.5
261	H	39.6	Very low	38.3	Very low	146 Å²	146	138 Å²	138	68%	0.676	73%	0.734	S	S	*	*			trans	53.1	128.2	160.8	-83.8	-137.2	0	0	0	119.9
262	M	35.8	Very low	37.9	Very low	179 Å²	179	139.8 Å²	139.8	88%	0.882	74%	0.735	S	S	*	*				-148.7	161.9	121.1	-99.7	-80.8	82.5	0	0	108.7
263	I	38.5	Very low	38	Very low	123 Å²	123	136.7 Å²	136.7	63%	0.631	73%	0.726	S	S	*	*			trans	-134.4	160.3	-165	-71.8	174.7	0	0	0	109.8
264	K	32.3	Very low	37.1	Very low	161 Å²	161	136.4 Å²	136.4	70%	0.7	73%	0.727	S	S	*	*			trans	94.5	127.5	152.1	-112.7	-176.8	175.7	-136.4	0	120.1
265	Q	34.3	Very low	36.6	Very low	137 Å²	137	136.1 Å²	136.1	64%	0.64	74%	0.735	S	S	*	*				66.4	152.2	128.9	-87.6	-178.5	-32	0	0	120.6
266	N	31.8	Very low	35.7	Very low	113 Å²	113	135.9 Å²	135.9	60%	0.604	74%	0.736	S	S	*	*			cis	-158.7	158.8	-12.1	-146.6	29.6	0	0	0	112.6
267	N	34.4	Very low	36.1	Very low	111 Å²	111	134.1 Å²	134.1	59%	0.594	73%	0.733	S	S	*	*			trans	44.3	123.5	139.6	-79.1	26.2	0	0	0	124.5
268	N	34.3	Very low	35.5	Very low	118 Å²	118	137.5 Å²	137.5	63%	0.631	73%	0.734	S	S	*	*				98	134.4	112.2	-76	26.4	0	0	0	124
269	N	33.1	Very low	34.9	Very low	124 Å²	124	135.3 Å²	135.3	66%	0.663	73%	0.733	S	S	*	*			trans	70.4	149.2	137.9	-66.1	39.2	0	0	0	118.5
270	D	31.8	Very low	34.7	Very low	124 Å²	124	131.3 Å²	131.3	66%	0.663	73%	0.726	S	S	*	*			cis	-159.1	160.8	-8.8	-131.1	-49.1	0	0	0	114.2
271	T	31	Very low	35	Very low	128 Å²	128	132.4 Å²	132.4	79%	0.785	73%	0.731	S	S	*	*			trans	66.5	148.9	142.7	-69.1	0	0	0	0	122.3
272	S	29.5	Very low	34.8	Very low	107 Å²	107	134.4 Å²	134.4	75%	0.748	74%	0.738	S	S	*	*			trans	-91.2	-164.1	-177.3	-137.3	0	0	0	0	111.1
273	P	48.3	Very low	34.8	Very low	102 Å²	102	130.5 Å²	130.5	66%	0.662	73%	0.734	S	S	*	*			cis	-147.2	-171.4	14.7	45.7	-24.6	0	0	0	119.2
274	Q	27.6	Very low	34.3	Very low	186 Å²	186	129.5 Å²	129.5	87%	0.869	74%	0.738	S	S	*	*			trans	96.3	156.4	144.4	-87.3	-169.7	23.7	0	0	122.9
275	A	32.3	Very low	34.5	Very low	105 Å²	105	129.2 Å²	129.2	87%	0.868	74%	0.743	S	S	*	*			trans	85.8	129.1	169.8	0	0	0	0	0	119.8
276	S	30.1	Very low	34.3	Very low	113 Å²	113	129.1 Å²	129.1	79%	0.79	75%	0.747	S	S	*	*			trans	-141.1	162.8	169.4	-145.9	0	0	0	0	105.9
277	P	47.1	Very low	34.4	Very low	118 Å²	118	127.8 Å²	127.8	77%	0.766	75%	0.747	S	S	*	*				-156.1	153.6	67.3	41.3	-20	0	0	0	119.2
278	R	28.9	Very low	34.3	Very low	232 Å²	232	127.7 Å²	127.7	88%	0.875	75%	0.751	S	S	*	*			trans	54.8	112.8	130	-169	-175	-166	173.5	5.3	121.1
279	S	32.7	Very low	34.2	Very low	116 Å²	116	127.7 Å²	127.7	81%	0.811	76%	0.755	S	S	*	*				-155.9	157.1	119.9	50.3	0	0	0	0	112
280	T	32.6	Very low	34	Very low	128 Å²	128	127.5 Å²	127.5	79%	0.785	76%	0.758	S	S	*	*			trans	-147.4	-179.6	-178.4	64.2	0	0	0	0	107
281	P	49.5	Very low	34	Very low	109 Å²	109	125.2 Å²	125.2	71%	0.708	76%	0.757	S	S	*	*			cis	-130.2	-151.3	2.3	34.1	-7.9	0	0	0	111
282	K	34.9	Very low	33.9	Very low	188 Å²	188	126.7 Å²	126.7	82%	0.817	76%	0.759	S	S	*	*			cis	-166.7	141.4	12.2	-151.9	170.1	-169.4	178.4	0	112.4
283	A	35.6	Very low	33.9	Very low	98 Å²	98	128.8 Å²	128.8	81%	0.81	76%	0.762	S	S	*	*			trans	53.6	157.2	150.9	0	0	0	0	0	120.3
284	S	28.2	Very low	32.9	Very low	102 Å²	102	126.8 Å²	126.8	71%	0.713	76%	0.76	S	S	*	*			cis	-138.4	135	3	44.8	0	0	0	0	110.2
285	L	37	Very low	33	Very low	154 Å²	154	124 Å²	124	81%	0.806	76%	0.755	S	S	*	*				67.2	128.9	81.2	-137.6	82	0	0	0	111.6
286	D	30.4	Very low	32.9	Very low	135 Å²	135	127.9 Å²	127.9	72%	0.722	75%	0.752	S	S	*	*			cis	-175.7	179.6	-15.5	-108	-29.8	0	0	0	106.7
287	S	34.2	Very low	32.8	Very low	86 Å²	86	130.3 Å²	130.3	60%	0.601	76%	0.757	S	S	*	*			cis	-161.7	150.8	-41.1	-115.5	0	0	0	0	108.8
288	T	30.6	Very low	31.9	Very low	109 Å²	109	128 Å²	128	67%	0.669	75%	0.754	S	S	*	*				27.9	134.3	125.2	-27.1	0	0	0	0	118
289	T	33.1	Very low	31.7	Very low	118 Å²	118	125.6 Å²	125.6	72%	0.724	75%	0.753	S	S	*	*				-174.9	130.5	69.4	-45.1	0	0	0	0	107.5
290	T	28.9	Very low	31.6	Very low	119 Å²	119	125.5 Å²	125.5	73%	0.73	75%	0.747	S	S	*	*				46.7	146.5	80.5	29.3	0	0	0	0	115.4
291	A	30.7	Very low	31.3	Very low	77 Å²	77	127.6 Å²	127.6	64%	0.636	75%	0.748	S	S	*	*			cis	-164.7	-160.7	-7	0	0	0	0	0	109.6
292	L	30.5	Very low	30.2	Very low	159 Å²	159	131.1 Å²	131.1	83%	0.832	76%	0.755	S	S	*	*			trans	78.4	153.6	161	-56.6	166.3	0	0	0	118.1
293	D	29	Very low	29.8	Very low	151 Å²	151	131.3 Å²	131.3	81%	0.807	76%	0.759	S	S	*	*			cis	-165	162	-38.9	-146.3	-25.1	0	0	0	111
294	G	27.6	Very low	29.4	Very low	59 Å²	59	135.8 Å²	135.8	61%	0.608	76%	0.76	S	S	*	*			trans	71.8	-178.3	162.2	0	0	0	0	0	120.1
295	V	29.1	Very low	30.7	Very low	128 Å²	128	135.7 Å²	135.7	78%	0.776	76%	0.757	S	S	*	*				-170.6	136.1	-72.6	138.7	0	0	0	0	112.3
296	K	29.8	Very low	31.5	Very low	186 Å²	186	133.8 Å²	133.8	81%	0.809	75%	0.754	S	S	*	*			trans	69.2	112.7	161.9	-76.4	165.9	-176.6	176.6	0	123.7
297	N	29.3	Very low	31.4	Very low	165 Å²	165	135.7 Å²	135.7	88%	0.882	76%	0.758	S	S	*	*				37.6	118.8	125.8	-55.1	15.7	0	0	0	124.1
298	G	27.8	Very low	31.3	Very low	68 Å²	68	135.9 Å²	135.9	70%	0.701	77%	0.765	S	S	*	*			trans	175.1	152.1	158.4	0	0	0	0	0	109.7
299	Q	25.1	Very low	31.2	Very low	183 Å²	183	138.9 Å²	138.9	86%	0.855	77%	0.771	S	S	*	*			cis	80.6	137.5	6.4	-58.2	-176	-108.6	0	0	117.9
300	V	28.7	Very low	31	Very low	114 Å²	114	136.9 Å²	136.9	69%	0.691	77%	0.767	S	S	*	*			cis	-103.8	-124.1	-1.2	-152.1	0	0	0	0	112.4
301	E	26.2	Very low	31.1	Very low	171 Å²	171	137.9 Å²	137.9	80%	0.799	77%	0.767	S	S	*	*			cis	-155.6	-169.6	-1.5	-154.2	67.6	-90.4	0	0	109.1
302	E	28.1	Very low	31	Very low	183 Å²	183	144.8 Å²	144.8	86%	0.855	78%	0.777	S	S	*	*			trans	-135.6	142.1	-172.2	178.1	177.5	110.2	0	0	116.2
303	Q	25.2	Very low	31	Very low	193 Å²	193	144.9 Å²	144.9	90%	0.902	77%	0.772	S	S	*	*			trans	-162.4	161.6	157.2	-123.1	172.9	-5.6	0	0	116.5
304	K	28.1	Very low	32	Very low	191 Å²	191	143.9 Å²	143.9	83%	0.83	77%	0.774	S	S	*	*			trans	-168.3	176	-171	-158.2	-145.6	175.3	-175.4	0	108.7
305	P	55.6	Low	32.2	Very low	100 Å²	100	145.6 Å²	145.6	65%	0.649	78%	0.777	S	S	*	*			cis	-114.3	-147.7	-25.5	44.8	-29.2	0	0	0	111
306	P	53.1	Low	33.2	Very low	115 Å²	115	145.3 Å²	145.3	75%	0.747	78%	0.778	S	S	*	*			cis	-118.9	-152.1	-12.5	28.1	-1.5	0	0	0	112.1
307	Q	27.8	Very low	33.1	Very low	175 Å²	175	147.3 Å²	147.3	82%	0.818	78%	0.78	S	S	*	*			cis	-136.1	178.9	8.9	-72.6	-175.7	-31.1	0	0	109.6
308	A	32.1	Very low	32.8	Very low	90 Å²	90	147.8 Å²	147.8	74%	0.744	78%	0.782	S	S	*	*			cis	80.9	135.4	22.4	0	0	0	0	0	116.7
309	E	28.5	Very low	32.9	Very low	171 Å²	171	148.7 Å²	148.7	80%	0.799	78%	0.782	S	S	*	*			cis	-165.7	-171.5	-10.6	-145.3	-129.5	82.7	0	0	113.7
310	A	30.2	Very low	32.9	Very low	77 Å²	77	148.3 Å²	148.3	64%	0.636	78%	0.781	S	S	*	*			trans	70.3	166.8	164	0	0	0	0	0	118.7
311	L	30.9	Very low	32.9	Very low	139 Å²	139	151.2 Å²	151.2	73%	0.728	79%	0.787	S	S	*	*			cis	-172.1	174	-24.2	-127.3	58.5	0	0	0	108.3
312	R	27.5	Very low	33	Very low	222 Å²	222	150.2 Å²	150.2	84%	0.838	78%	0.782	S	S	*	*			cis	-148.7	146.5	5.9	-68.1	-169.9	175.2	-168.4	-2.5	113.5
313	H	32.3	Very low	33	Very low	161 Å²	161	149 Å²	149	75%	0.745	77%	0.774	S	S	*	*			trans	4	159.1	130.8	-74.9	-55.4	0	0	0	125.1
314	P	48.8	Very low	32.9	Very low	130 Å²	130	147.9 Å²	147.9	84%	0.844	77%	0.769	S	S	*	*			cis	-140.5	-177.8	47.1	41.7	-21.5	0	0	0	120.8
315	S	31.1	Very low	32.7	Very low	95 Å²	95	144.6 Å²	144.6	66%	0.664	77%	0.77	S	S	*	*			trans	-119.4	-150.8	-168.2	-29.8	0	0	0	0	111.4
316	P	51.5	Low	31.2	Very low	122 Å²	122	144.1 Å²	144.1	79%	0.792	77%	0.769	S	S	*	*			cis	-127	-145.5	3.9	33.5	-6.4	0	0	0	111.8
317	R	26.3	Very low	30	Very low	229 Å²	229	145.5 Å²	145.5	86%	0.864	77%	0.77	S	S	*	*			cis	-164.9	138.6	1.7	-167.3	-173.7	-178.8	-169.7	0.2	111.5
318	L	25	Very low	29.8	Very low	174 Å²	174	144.1 Å²	144.1	91%	0.911	77%	0.768	S	S	*	*			trans	-178.8	162.7	142.3	-103.9	162.5	0	0	0	111.5
319	A	28	Very low	29.4	Very low	87 Å²	87	144.2 Å²	144.2	72%	0.719	76%	0.763	S	S	*	*			trans	-161.8	165.3	-162.4	0	0	0	0	0	115.8
320	Q	26.8	Very low	29.3	Very low	175 Å²	175	141.3 Å²	141.3	82%	0.818	76%	0.762	S	S	*	*			trans	178.9	134.8	149.7	-95.8	173.9	-56.8	0	0	107
321	E	28.4	Very low	29.2	Very low	175 Å²	175	144.5 Å²	144.5	82%	0.818	77%	0.774	S	S	*	*				79.4	153.3	55.1	-75.1	-171.5	112.4	0	0	115.8
322	E	28.4	Very low	28.9	Very low	150 Å²	150	142 Å²	142	70%	0.701	77%	0.773	S	S	*	*				-153.4	164.8	-72.5	-146.1	-153.3	116.1	0	0	111.2
323	K	26.6	Very low	28.8	Very low	159 Å²	159	141.2 Å²	141.2	69%	0.691	78%	0.776	S	S	*	*			trans	79.7	177.4	149.5	-119.2	178.7	-161.2	79.3	0	123.5
324	E	23.5	Very low	28.7	Very low	168 Å²	168	140.7 Å²	140.7	79%	0.785	78%	0.777	S	S	*	*			trans	-114.4	164.3	-152.8	-51.3	151.8	85.9	0	0	113.4
325	S	23.5	Very low	28.9	Very low	123 Å²	123	139.9 Å²	139.9	86%	0.86	77%	0.772	S	S	*	*				179.8	-170.6	124.8	-162.3	0	0	0	0	111.2
326	S	25.9	Very low	29.5	Very low	89 Å²	89	140.7 Å²	140.7	62%	0.622	78%	0.775	S	S	*	*			trans	-145.5	165.1	-156	62.2	0	0	0	0	117.1
327	N	27.1	Very low	28.3	Very low	145 Å²	145	141.3 Å²	141.3	78%	0.775	78%	0.777	S	S	*	*			trans	87	115.8	154.5	-59.1	-17.1	0	0	0	122.3
328	D	23.7	Very low	28.2	Very low	145 Å²	145	138.2 Å²	138.2	78%	0.775	77%	0.772	S	S	*	*				97	135.7	125.5	-110.6	-54.2	0	0	0	126.3
329	S	23.6	Very low	28.9	Very low	92 Å²	92	134.4 Å²	134.4	64%	0.643	76%	0.757	S	S	*	*			trans	56.7	105.5	147.1	-77.1	0	0	0	0	125.5
330	S	26.8	Very low	28.8	Very low	111 Å²	111	139.1 Å²	139.1	78%	0.776	76%	0.762	S	S	*	*				65.5	128.9	110.3	-56	0	0	0	0	123.4
331	T	26.7	Very low	28.8	Very low	144 Å²	144	134.3 Å²	134.3	88%	0.883	75%	0.752	S	S	*	*			trans	-156.2	150.1	151.6	-73.9	0	0	0	0	108.5
332	A	25.8	Very low	28.6	Very low	85 Å²	85	133.3 Å²	133.3	70%	0.702	75%	0.753	S	S	*	*			trans	-153.5	166.2	-172.9	0	0	0	0	0	114.2
333	F	24.3	Very low	28.7	Very low	207 Å²	207	130 Å²	130	91%	0.908	75%	0.746	S	S	*	*			trans	-141.2	155.5	170.2	-107.1	-81.5	0	0	0	112
334	I	30.1	Very low	28.7	Very low	149 Å²	149	130.9 Å²	130.9	76%	0.764	75%	0.752	S	S	*	*			trans	-165.9	-178.1	-160.8	14.2	169.9	0	0	0	109.6
335	P	54.3	Low	28.8	Very low	114 Å²	114	126.7 Å²	126.7	74%	0.74	75%	0.746	S	S	*	*			cis	-112.5	-109.8	-21.5	37.2	-18.5	0	0	0	108.1
336	P	43.1	Very low	28.8	Very low	111 Å²	111	127.5 Å²	127.5	72%	0.721	75%	0.746	S	S	*	*			cis	-104.6	-169.6	-25.1	46	-34.1	0	0	0	111.1
337	T	25.5	Very low	28.7	Very low	135 Å²	135	127.9 Å²	127.9	83%	0.828	75%	0.749	S	S	*	*			cis	-140.1	152.6	-2.2	-36.9	0	0	0	0	109.5
338	E	24.8	Very low	28.6	Very low	165 Å²	165	129 Å²	129	77%	0.771	75%	0.75	S	S	*	*			trans	-96.7	-166.4	179	-128.2	-153.6	-119.2	0	0	111.3	K340	E338-K340 PolarHBondContact OE2-N 3.01Å
339	P	40.6	Very low	28.5	Very low	93 Å²	93	130.5 Å²	130.5	60%	0.604	75%	0.75	S	S	*	*			cis	-148.5	-178.6	22.9	48.5	-28.4	0	0	0	121
340	K	26.1	Very low	28.5	Very low	186 Å²	186	136.8 Å²	136.8	81%	0.809	76%	0.759	S	S	*	*			trans	79.9	142.5	154.7	-72.4	166.7	-173	176.9	0	119.3	E338	E338-K340 PolarHBondContact OE2-N 3.01Å
341	A	25.7	Very low	28.3	Very low	75 Å²	75	137.3 Å²	137.3	62%	0.62	76%	0.758	S	S	*	*			cis	-167	154.8	-6.3	0	0	0	0	0	114.3
342	N	25.4	Very low	28.1	Very low	154 Å²	154	136.3 Å²	136.3	82%	0.824	75%	0.752	S	S	*	*			trans	62	151.5	152.7	-61.8	14	0	0	0	119.8
343	S	28.7	Very low	28	Very low	80 Å²	80	138.9 Å²	138.9	56%	0.559	76%	0.759	S	S	*	*			cis	-167.7	148.5	-17.8	-106	0	0	0	0	109.9
344	E	26.7	Very low	28	Very low	177 Å²	177	133.3 Å²	133.3	83%	0.827	75%	0.745	S	S	*	*			trans	46.3	147.3	142.8	-71.2	152	115.6	0	0	122.5
345	A	26	Very low	27.8	Very low	80 Å²	80	133.5 Å²	133.5	66%	0.661	75%	0.748	S	S	*	*			cis	-164.2	161.2	-6.1	0	0	0	0	0	112.8
346	T	23.9	Very low	26.5	Very low	140 Å²	140	133.9 Å²	133.9	86%	0.859	75%	0.753	S	S	*	*			trans	31.4	142.4	133.9	-50.3	0	0	0	0	121.2
347	S	23.6	Very low	25.8	Very low	98 Å²	98	133.2 Å²	133.2	69%	0.685	76%	0.757	S	S	*	*			cis	178.8	148.7	-19.2	175.3	0	0	0	0	108.3
348	E	24.8	Very low	25.8	Very low	169 Å²	169	134.4 Å²	134.4	79%	0.79	76%	0.758	S	S	*	*				166.3	154.4	126.5	-83.5	-121.2	100.7	0	0	116
349	K	22.6	Very low	26.1	Very low	176 Å²	176	132.9 Å²	132.9	77%	0.765	76%	0.76	S	S	*	*			trans	-50.6	168.4	174.9	-80.1	162.1	178.2	159.8	0	115.9
350	R	22.3	Very low	25.5	Very low	223 Å²	223	137.9 Å²	137.9	84%	0.842	77%	0.772	S	S	*	*			cis	-159.7	145.8	1.4	-141.4	179	-177.3	173.5	-0.6	107.3
351	T	23.1	Very low	25.7	Very low	123 Å²	123	137.7 Å²	137.7	76%	0.755	78%	0.776	S	S	*	*				171	159.4	87.7	-63.1	0	0	0	0	109.7
352	T	21.6	Very low	26	Very low	122 Å²	122	139.4 Å²	139.4	75%	0.748	78%	0.775	S	S	*	*			trans	-59.3	148.1	-178.9	47.6	0	0	0	0	117
353	T	24.8	Very low	26.7	Very low	139 Å²	139	138.5 Å²	138.5	85%	0.853	78%	0.777	S	S	*	*				-166.6	163.5	115	-69.8	0	0	0	0	109.3
354	S	23.5	Very low	27	Very low	90 Å²	90	139 Å²	139	63%	0.629	78%	0.781	S	S	*	*			trans	-92.4	-177.8	-165.6	64.2	0	0	0	0	116.2
355	N	27	Very low	27.6	Very low	154 Å²	154	134 Å²	134	82%	0.824	77%	0.766	S	S	*	*			trans	99.6	143.2	160.9	-56.6	-12.9	0	0	0	117.7
356	S	27.2	Very low	28.5	Very low	121 Å²	121	142.4 Å²	142.4	85%	0.846	78%	0.78	S	S	*	*			trans	-79.8	142.7	-165.4	40.9	0	0	0	0	113.5	L358	S356-L358 PolarHBondContact O-N 2.92Å
357	A	27.9	Very low	29.1	Very low	97 Å²	97	146 Å²	146	80%	0.802	78%	0.778	S	S	*	*			trans	-74.7	111.9	-170.2	0	0	0	0	0	113.4	T359	A357-T359 PolarHBondContact O-N 3.42Å
358	L	26	Very low	29.9	Very low	161 Å²	161	144.3 Å²	144.3	84%	0.843	77%	0.767	S	S	*	*			trans	-62.2	114.8	161.7	175.9	68.7	0	0	0	110.2	S356 K360	S356-L358 PolarHBondContact O-N 2.92Å; L358-K360 PolarHBondContact O-N 3.02Å
359	T	31.1	Very low	30.3	Very low	133 Å²	133	145.8 Å²	145.8	82%	0.816	77%	0.771	S	S	*	*			trans	-66.5	101.8	178.2	-48.2	0	0	0	0	111.2	A357 M361	A357-T359 PolarHBondContact O-N 3.42Å; T359-M361 PolarHBondContact O-N 3.1Å
360	K	27.5	Very low	31.3	Very low	198 Å²	198	142.9 Å²	142.9	86%	0.861	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-58.7	122.8	-179.2	-67.5	178.9	178.5	176.2	0	111.7	L358	L358-K360 PolarHBondContact O-N 3.02Å
361	M	29.9	Very low	32	Very low	181 Å²	181	139.7 Å²	139.7	89%	0.892	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-72.5	131.6	168.3	-68.1	-178.8	72.9	0	0	110.6	T359	T359-M361 PolarHBondContact O-N 3.1Å
362	N	31.8	Very low	33.1	Very low	112 Å²	112	137.6 Å²	137.6	60%	0.599	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-78.8	120.8	172.8	178.7	-19.5	0	0	0	110	S364	N362-S364 PolarHBondContact O-N 2.77Å; N362-S364 VanDerWaalsContact O-N 3.14Å; N362-S364 WeakPolarHBondContact OD1-CB 3.46Å; N362-S364 PolarHBondContact OD1-N 3.31Å; N362-S364 VanDerWaalsContact OD1-N 3.13Å; N362-S364 PolarHBondContact OD1-OG 3.29Å
363	P	39.9	Very low	33.9	Very low	134 Å²	134	134.9 Å²	134.9	87%	0.87	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.9	3.3	-171.5	31.3	-36.9	0	0	0	115.3
364	S	36.4	Very low	34.9	Very low	90 Å²	90	131.8 Å²	131.8	63%	0.629	70%	0.702	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	5.2	-170.5	63.1	0	0	0	0	116.4	N362 R366	N362-S364 PolarHBondContact O-N 2.77Å; N362-S364 VanDerWaalsContact O-N 3.14Å; N362-S364 WeakPolarHBondContact OD1-CB 3.46Å; N362-S364 PolarHBondContact OD1-N 3.31Å; N362-S364 VanDerWaalsContact OD1-N 3.13Å; N362-S364 PolarHBondContact OD1-OG 3.29Å; S364-R366 PolarHBondContact O-N 3.42Å
365	S	38.3	Very low	35.8	Very low	73 Å²	73	135.2 Å²	135.2	51%	0.51	71%	0.705	S	S	.	*			trans	-91.1	95.2	-171.4	67.7	0	0	0	0	114.9	W367	S365-W367 VanDerWaalsContact C-N 3.31Å; S365-W367 PolarHBondContact O-N 3.27Å; S365-W367 PolarHBondContact OG-NE1 3.07Å
366	R	45.4	Very low	36.3	Very low	256 Å²	256	134.7 Å²	134.7	97%	0.966	70%	0.698	S	S	*	*			trans	-74.5	72.6	173.9	-67.4	-173.8	178.2	-170	0.1	112.4	S364	S364-R366 PolarHBondContact O-N 3.42Å
367	W	36.6	Very low	36.8	Very low	215 Å²	215	132.3 Å²	132.3	81%	0.814	69%	0.685	S	S	*	*			trans	-75.1	139.9	174.5	-68	91.6	0	0	0	112.7	S365	S365-W367 VanDerWaalsContact C-N 3.31Å; S365-W367 PolarHBondContact O-N 3.27Å; S365-W367 PolarHBondContact OG-NE1 3.07Å
368	S	39.4	Very low	38	Very low	64 Å²	64	130.3 Å²	130.3	45%	0.448	67%	0.674	S	S	.	*			trans	-61.1	134.6	169.1	-53.2	0	0	0	0	110.9	I370	S368-I370 PolarHBondContact O-N 3.22Å
369	K	34.2	Very low	38.7	Very low	200 Å²	200	128.3 Å²	128.3	87%	0.87	66%	0.664	S	S	*	*			trans	-68	94.8	173	-78.2	-177.5	175.4	175.8	0	110.4	K371	K369-K371 PolarHBondContact O-N 3.34Å
370	I	42.4	Very low	39.1	Very low	114 Å²	114	126.7 Å²	126.7	59%	0.585	65%	0.647	S	S	*	*			trans	-70.5	97.3	174.5	-54.2	176.6	0	0	0	108.7	S368 I372 I385	S368-I370 PolarHBondContact O-N 3.22Å; I370-I372 HydrophobicContact CG2-CG1 3.97Å; I370-I372 PolarHBondContact O-N 2.67Å; I370-I385 HydrophobicContact CG2-CG2 4.45Å
371	K	37.5	Very low	39.8	Very low	156 Å²	156	120.9 Å²	120.9	68%	0.678	63%	0.631	S	S	*	*			trans	-88.5	87.6	174.9	-169	-179.6	-179	-177.8	0	109.4	K369 V373	K369-K371 PolarHBondContact O-N 3.34Å; K371-V373 HydrophobicContact CD-CG2 4.45Å; K371-V373 HydrophobicContact CG-CG2 4.14Å; K371-V373 PolarHBondContact O-N 2.91Å
372	I	46.3	Very low	40.4	Very low	80 Å²	80	116.8 Å²	116.8	41%	0.41	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-64.9	119.4	173.1	-53.5	178.6	0	0	0	108.3	L151 I370	L151-I372 HydrophobicContact CD2-CG2 4.1Å; I370-I372 HydrophobicContact CG2-CG1 3.97Å; I370-I372 PolarHBondContact O-N 2.67Å
373	V	39.8	Very low	40.8	Very low	64 Å²	64	115.8 Å²	115.8	39%	0.388	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-113.9	100.4	175.8	-178.5	0	0	0	0	108.6	K371 K375	K371-V373 HydrophobicContact CD-CG2 4.45Å; K371-V373 HydrophobicContact CG-CG2 4.14Å; K371-V373 PolarHBondContact O-N 2.91Å; V373-K375 PolarHBondContact O-N 3.4Å
374	T	45.7	Very low	40.9	Very low	75 Å²	75	112 Å²	112	46%	0.46	59%	0.59	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-68.5	112.3	165.7	47.5	0	0	0	0	109	L151 T383	L151-T374 HydrophobicContact CD2-CG2 4.45Å; T374-T383 HydrophobicContact CG2-CG2 3.74Å
375	K	40.6	Very low	41.2	Very low	162 Å²	162	113.5 Å²	113.5	70%	0.704	59%	0.589	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-99.1	119.3	165.8	-92.8	-168.7	172.1	-175.2	0	108.5	V373 I382	V373-K375 PolarHBondContact O-N 3.4Å; K375-I382 PolarHBondContact N-O 2.98Å
376	Q	39.5	Very low	41.1	Very low	143 Å²	143	117.1 Å²	117.1	67%	0.668	60%	0.599	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-76.9	135.2	167.1	-175.7	173.3	-3.6	0	0	109.1	G378	Q376-G378 VanDerWaalsContact CG-O 3.24Å; Q376-G378 WeakPolarHBondContact CG-O 3.43Å; Q376-G378 PolarHBondContact NE2-O 3.44Å
377	A	35.8	Very low	40.8	Very low	70 Å²	70	111 Å²	111	58%	0.579	58%	0.584	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-131	87.7	174.5	0	0	0	0	0	107.8
378	G	54.4	Low	40.9	Very low	55 Å²	55	105.3 Å²	105.3	57%	0.567	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	66.3	-132.9	-171.2	0	0	0	0	0	112.5	Q376 E380	Q376-G378 VanDerWaalsContact CG-O 3.24Å; Q376-G378 WeakPolarHBondContact CG-O 3.43Å; Q376-G378 PolarHBondContact NE2-O 3.44Å; G378-E380 PolarHBondContact O-N 2.84Å
379	D	41.3	Very low	40.8	Very low	119 Å²	119	107.2 Å²	107.2	64%	0.636	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-7.8	-172.9	-84.9	-71.7	0	0	0	115.7	R143	R143-D379 IonicContact CZ-OD1 2.95Å; R143-D379 PolarHBondContact NH1-O 3.42Å; R143-D379 PolarHBondContact NH2-O 3.32Å; R143-D379 IonicContact NH2-OD1 3.9Å; R143-D379 PolarHBondContact NH2-OD1 2.96Å
380	E	38.5	Very low	41	Very low	99 Å²	99	102.8 Å²	102.8	46%	0.463	58%	0.575	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-103.6	141.4	176	-73.3	-158.3	126.1	0	0	113.6	G378 I382	G378-E380 PolarHBondContact O-N 2.84Å; E380-I382 HydrophobicContact CB-CG1 4.5Å
381	C	41.7	Very low	40.8	Very low	77 Å²	77	104.2 Å²	104.2	52%	0.52	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-96.3	101.3	175.3	-60.1	0	0	0	0	110
382	I	43.1	Very low	40.9	Very low	95 Å²	95	105.9 Å²	105.9	49%	0.487	60%	0.599	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.4	119	-179.9	-56.6	179.5	0	0	0	110.4	K375 E380	K375-I382 PolarHBondContact N-O 2.98Å; E380-I382 HydrophobicContact CB-CG1 4.5Å
383	T	40.6	Very low	40.3	Very low	91 Å²	91	105.5 Å²	105.5	56%	0.558	61%	0.614	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-85	116.4	172.2	21.9	0	0	0	0	110.9	T374	T374-T383 HydrophobicContact CG2-CG2 3.74Å
384	A	40.7	Very low	39.9	Very low	54 Å²	54	107.5 Å²	107.5	45%	0.446	64%	0.637	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.9	136.8	167.5	0	0	0	0	0	110.2
385	I	43.8	Very low	39.2	Very low	121 Å²	121	113.1 Å²	113.1	62%	0.621	66%	0.658	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-110.6	106.6	173.8	-56.5	176.2	0	0	0	107.6	I370 I387	I370-I385 HydrophobicContact CG2-CG2 4.45Å; I385-I387 HydrophobicContact CG2-CG1 4.27Å
386	E	36.1	Very low	39.3	Very low	150 Å²	150	116.9 Å²	116.9	70%	0.701	67%	0.668	S	S	*	*			trans	-104.9	124.6	174.2	-171.8	167.2	-154.8	0	0	109.3
387	I	38.8	Very low	38.9	Very low	127 Å²	127	122.1 Å²	122.1	65%	0.651	68%	0.682	S	S	*	*			trans	-104.3	101.3	-176.7	-55.9	176.9	0	0	0	108.2	I385	I385-I387 HydrophobicContact CG2-CG1 4.27Å
388	V	38.9	Very low	39.3	Very low	96 Å²	96	124.1 Å²	124.1	58%	0.582	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-74.8	127.5	174.9	-174.5	0	0	0	0	109.1
389	P	37.5	Very low	38.2	Very low	103 Å²	103	129 Å²	129	67%	0.669	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-69.7	149	174.5	29.5	-34.3	0	0	0	111.1
390	P	37.6	Very low	38	Very low	107 Å²	107	129.2 Å²	129.2	70%	0.695	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-67.2	144.7	174	29.6	-34.4	0	0	0	111.1
391	V	39.4	Very low	38.3	Very low	145 Å²	145	129.4 Å²	129.4	88%	0.879	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-67.4	138.6	178.3	179.7	0	0	0	0	110.3
392	E	38.3	Very low	38.5	Very low	191 Å²	191	130.4 Å²	130.4	89%	0.893	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-76.1	138	177.4	-65.2	-171.6	134.7	0	0	112.1
393	G	33.4	Very low	38.8	Very low	71 Å²	71	136.2 Å²	136.2	73%	0.732	74%	0.738	S	S	*	*			trans	-157.6	151.2	171.3	0	0	0	0	0	108.1
394	A	33.3	Very low	39.2	Very low	106 Å²	106	136.3 Å²	136.3	88%	0.876	74%	0.74	S	S	*	*			trans	-52.2	152.5	-175.2	0	0	0	0	0	112.5
395	E	30.6	Very low	39.6	Very low	193 Å²	193	140.6 Å²	140.6	90%	0.902	75%	0.745	S	S	*	*			cis	-155.8	166.6	49.3	-161.9	174.6	177.4	0	0	113.7
396	R	42.1	Very low	40	Very low	241 Å²	241	138.6 Å²	138.6	91%	0.909	74%	0.738	S	S	*	*			trans	-81.4	123.7	-177.1	-68.9	-175.5	178.7	-164.6	1.9	113
397	R	30.6	Very low	40.9	Very low	254 Å²	254	135.5 Å²	135.5	96%	0.958	73%	0.729	S	S	*	*			trans	-157.4	156	142.2	-113	163.8	-177.3	168.9	1.1	111.5
398	S	44.8	Very low	41.8	Very low	112 Å²	112	132.5 Å²	132.5	78%	0.783	72%	0.724	S	S	*	*			trans	-117.7	112.3	-154.2	50.3	0	0	0	0	114.4
399	I	31.6	Very low	42.8	Very low	158 Å²	158	136.1 Å²	136.1	81%	0.81	73%	0.727	S	S	*	*			trans	-140.2	142.3	171.8	-67.2	-172.8	0	0	0	107.7
400	P	37	Very low	43.9	Very low	123 Å²	123	138.2 Å²	138.2	80%	0.799	73%	0.725	S	S	*	*			trans	-77.4	146.4	-154.9	27.5	-36.1	0	0	0	116.8
401	I	45.3	Very low	45.5	Very low	103 Å²	103	139.8 Å²	139.8	53%	0.528	72%	0.722	S	S	.	*			trans	-109.1	93	-174.5	-52.8	174.4	0	0	0	111.4	R405	I401-R405 HydrophobicContact CG2-CG 4.12Å
402	S	44.7	Very low	46.8	Very low	98 Å²	98	134.8 Å²	134.8	69%	0.685	70%	0.695	S	S	*	*	S	Bend	trans	-118.1	-17.8	179.1	62.9	0	0	0	0	116.3
403	R	49.5	Very low	48.2	Very low	216 Å²	216	129.1 Å²	129.1	82%	0.815	68%	0.677	S	S	*	*	S	Bend	trans	-111.9	-34.4	-176.6	-75.4	-174.7	169.4	179.2	-3	117.9	R405	R403-R405 PolarHBondContact O-N 2.83Å
404	P	50.1	Low	50.2	Low	93 Å²	93	130 Å²	130	60%	0.604	66%	0.664	S	S	*	*	H	α-helix	trans	-67.1	-36.4	-177.6	-24.4	34.8	0	0	0	115	T406 V407	P404-T406 VanDerWaalsContact C-N 3.28Å; P404-T406 PolarHBondContact O-N 3.41Å; P404-V407 PolarHBondContact O-N 3.46Å
405	R	48.3	Very low	52	Low	145 Å²	145	127.7 Å²	127.7	55%	0.547	65%	0.645	S	S	.	*	H	α-helix	trans	-63.6	-29.6	-172.6	-76.7	176.1	166.4	161.1	-6	113.5	I401 R403 R409	I401-R405 HydrophobicContact CG2-CG 4.12Å; R403-R405 PolarHBondContact O-N 2.83Å; R405-R409 WeakPolarHBondContact O-CB 3.48Å; R405-R409 WeakPolarHBondContact O-CD 3.37Å; R405-R409 WeakPolarHBondContact O-CG 3.17Å; R405-R409 PolarHBondContact O-N 3.03Å; R405-R409 VanDerWaalsContact O-N 3.12Å
406	T	51.2	Low	54	Low	79 Å²	79	126.6 Å²	126.6	49%	0.485	63%	0.632	S	S	.	*	H	α-helix	trans	-70.2	-36.8	-176.8	-46.6	0	0	0	0	112.4	P404 K410	P404-T406 VanDerWaalsContact C-N 3.28Å; P404-T406 PolarHBondContact O-N 3.41Å; T406-K410 PolarHBondContact O-N 2.96Å
407	V	55.7	Low	55.4	Low	84 Å²	84	118.2 Å²	118.2	51%	0.509	61%	0.61	S	S	.	*	H	α-helix	trans	-71	-48.9	-179.4	-179.4	0	0	0	0	110.7	P404 R409 K410 F411	P404-V407 PolarHBondContact O-N 3.46Å; V407-R409 VanDerWaalsContact C-N 3.31Å; V407-R409 PolarHBondContact O-N 3.46Å; V407-K410 PolarHBondContact O-N 3.11Å; V407-K410 VanDerWaalsContact O-N 3.11Å; V407-F411 HydrophobicContact CG1-CD2 3.83Å; V407-F411 HydrophobicContact CG1-CE2 3.59Å; V407-F411 WeakPolarHBondContact O-CD2 3.23Å; V407-F411 PolarHBondContact O-N 3.29Å
408	A	57.8	Low	57.3	Low	65 Å²	65	111.2 Å²	111.2	54%	0.537	59%	0.589	S	S	.	*	H	α-helix	trans	-59.3	-40.4	175.6	0	0	0	0	0	112.2	F411 A412	A408-F411 PolarHBondContact O-N 2.97Å; A408-A412 WeakPolarHBondContact O-CB 3.25Å; A408-A412 PolarHBondContact O-N 3.16Å
409	R	59.6	Low	58.8	Low	171 Å²	171	110 Å²	110	65%	0.645	58%	0.576	S	S	*	*	H	α-helix	trans	-63.2	-40	173.6	-75.4	171.5	179.8	173.5	-2.4	112.6	R405 V407 S413	R405-R409 WeakPolarHBondContact O-CB 3.48Å; R405-R409 WeakPolarHBondContact O-CD 3.37Å; R405-R409 WeakPolarHBondContact O-CG 3.17Å; R405-R409 PolarHBondContact O-N 3.03Å; R405-R409 VanDerWaalsContact O-N 3.12Å; V407-R409 VanDerWaalsContact C-N 3.31Å; V407-R409 PolarHBondContact O-N 3.46Å; R409-S413 VanDerWaalsContact O-CB 3.3Å; R409-S413 WeakPolarHBondContact O-CB 3.37Å; R409-S413 PolarHBondContact O-N 3.39Å
410	K	61.5	Low	60.8	Low	147 Å²	147	109.1 Å²	109.1	64%	0.639	57%	0.567	S	S	*	*	H	α-helix	trans	-61.9	-49.8	173.9	-85.2	-167.9	173.7	-173.7	0	111.6	T406 V407 A412 S413 I414	T406-K410 PolarHBondContact O-N 2.96Å; V407-K410 PolarHBondContact O-N 3.11Å; V407-K410 VanDerWaalsContact O-N 3.11Å; K410-A412 PolarHBondContact O-N 3.16Å; K410-S413 WeakPolarHBondContact O-CB 3.34Å; K410-S413 PolarHBondContact O-N 3.14Å; K410-S413 VanDerWaalsContact O-N 3.13Å; K410-I414 WeakPolarHBondContact O-CG1 3.35Å; K410-I414 PolarHBondContact O-N 3.35Å
411	F	71	Confident	62.6	Low	141 Å²	141	111.2 Å²	111.2	62%	0.618	56%	0.559	S	S	*	*	H	α-helix	trans	-62.3	-42.8	178	-75.7	-66.7	0	0	0	112.8	V407 A408 S413 I414 A415	V407-F411 HydrophobicContact CG1-CD2 3.83Å; V407-F411 HydrophobicContact CG1-CE2 3.59Å; V407-F411 WeakPolarHBondContact O-CD2 3.23Å; V407-F411 PolarHBondContact O-N 3.29Å; A408-F411 PolarHBondContact O-N 2.97Å; F411-S413 VanDerWaalsContact C-N 3.28Å; F411-S413 PolarHBondContact O-N 3.38Å; F411-I414 PolarHBondContact O-N 2.99Å; F411-A415 WeakPolarHBondContact O-CB 3.14Å; F411-A415 PolarHBondContact O-N 2.71Å
412	A	66.7	Low	64.2	Low	39 Å²	39	113.8 Å²	113.8	32%	0.322	57%	0.566	S	S	.	*	H	α-helix	trans	-66.3	-27.6	174.7	0	0	0	0	0	113.1	A408 K410 R416	A408-A412 WeakPolarHBondContact O-CB 3.25Å; A408-A412 PolarHBondContact O-N 3.16Å; K410-A412 PolarHBondContact O-N 3.16Å; A412-R416 WeakPolarHBondContact O-CB 3.37Å; A412-R416 WeakPolarHBondContact O-CG 3.33Å; A412-R416 PolarHBondContact O-N 3.31Å; A412-R416 PolarHBondContact O-NE 2.73Å
413	S	67.9	Low	65.7	Low	73 Å²	73	118.2 Å²	118.2	51%	0.51	57%	0.568	S	S	.	*	H	α-helix	trans	-70.6	-47.7	171.7	-170.4	0	0	0	0	111.3	R409 K410 F411 A415 R416 S417	R409-S413 VanDerWaalsContact O-CB 3.3Å; R409-S413 WeakPolarHBondContact O-CB 3.37Å; R409-S413 PolarHBondContact O-N 3.39Å; K410-S413 WeakPolarHBondContact O-CB 3.34Å; K410-S413 PolarHBondContact O-N 3.14Å; K410-S413 VanDerWaalsContact O-N 3.13Å; F411-S413 VanDerWaalsContact C-N 3.28Å; F411-S413 PolarHBondContact O-N 3.38Å; S413-A415 PolarHBondContact O-N 3.44Å; S413-R416 PolarHBondContact O-N 2.86Å; S413-S417 PolarHBondContact O-N 3.02Å
414	I	73.9	Confident	66.9	Low	89 Å²	89	113.3 Å²	113.3	46%	0.456	55%	0.554	S	S	.	*	H	α-helix	trans	-60.9	-44.6	177.3	-65.9	162.4	0	0	0	111	K410 F411 R416 S417 Q418	K410-I414 WeakPolarHBondContact O-CG1 3.35Å; K410-I414 PolarHBondContact O-N 3.35Å; F411-I414 PolarHBondContact O-N 2.99Å; I414-R416 VanDerWaalsContact C-N 3.34Å; I414-R416 PolarHBondContact O-N 3.3Å; I414-S417 PolarHBondContact O-N 3.25Å; I414-S417 PolarHBondContact O-OG 3.2Å; I414-Q418 VanDerWaalsContact O-CG 3.32Å; I414-Q418 WeakPolarHBondContact O-CG 3.32Å; I414-Q418 PolarHBondContact O-N 2.92Å
415	A	72.8	Confident	68	Low	57 Å²	57	114 Å²	114	47%	0.471	55%	0.55	S	S	.	*	H	α-helix	trans	-59.8	-43.9	176.4	0	0	0	0	0	112	F411 S413 Q418 V419	F411-A415 WeakPolarHBondContact O-CB 3.14Å; F411-A415 PolarHBondContact O-N 2.71Å; S413-A415 PolarHBondContact O-N 3.44Å; A415-Q418 PolarHBondContact O-N 3.46Å; A415-V419 WeakPolarHBondContact O-CG2 3.43Å; A415-V419 PolarHBondContact O-N 3.49Å
416	R	72.3	Confident	69.1	Low	170 Å²	170	109.4 Å²	109.4	64%	0.642	54%	0.544	S	S	*	.	H	α-helix	trans	-68.6	-34.7	177.1	-76.8	177.4	-72.4	-155.6	3.2	112.9	A412 S413 I414 K420	A412-R416 WeakPolarHBondContact O-CB 3.37Å; A412-R416 WeakPolarHBondContact O-CG 3.33Å; A412-R416 PolarHBondContact O-N 3.31Å; A412-R416 PolarHBondContact O-NE 2.73Å; S413-R416 PolarHBondContact O-N 2.86Å; I414-R416 VanDerWaalsContact C-N 3.34Å; I414-R416 PolarHBondContact O-N 3.3Å; R416-K420 WeakPolarHBondContact O-CB 3.31Å; R416-K420 PolarHBondContact O-N 3.06Å
417	S	71.5	Confident	69.9	Low	65 Å²	65	108.6 Å²	108.6	46%	0.455	55%	0.545	S	S	.	.	H	α-helix	trans	-67.6	-40.7	174.7	77.7	0	0	0	0	111.6	S413 I414 K420 R421	S413-S417 PolarHBondContact O-N 3.02Å; I414-S417 PolarHBondContact O-N 3.25Å; I414-S417 PolarHBondContact O-OG 3.2Å; S417-K420 PolarHBondContact O-N 2.9Å; S417-R421 WeakPolarHBondContact O-CB 3.26Å; S417-R421 PolarHBondContact O-N 2.98Å
418	Q	70.3	Confident	70.4	Confident	107 Å²	107	114 Å²	114	50%	0.5	56%	0.556	S	S	.	*	H	α-helix	trans	-62.4	-43.8	174.7	-68.4	-69.1	1.2	0	0	112.4	I414 A415 R421 K422	I414-Q418 VanDerWaalsContact O-CG 3.32Å; I414-Q418 WeakPolarHBondContact O-CG 3.32Å; I414-Q418 PolarHBondContact O-N 2.92Å; A415-Q418 PolarHBondContact O-N 3.46Å; Q418-R421 PolarHBondContact O-N 3.12Å; Q418-K422 PolarHBondContact O-N 3.32Å
419	V	76.4	Confident	70.6	Confident	86 Å²	86	117.1 Å²	117.1	52%	0.521	56%	0.559	S	S	.	*	H	α-helix	trans	-63.8	-42.6	174.9	172.5	0	0	0	0	111.6	A415 K422 R423	A415-V419 WeakPolarHBondContact O-CG2 3.43Å; A415-V419 PolarHBondContact O-N 3.49Å; V419-K422 PolarHBondContact O-N 3.01Å; V419-R423 PolarHBondContact O-N 3.23Å
420	K	72.9	Confident	70.8	Confident	141 Å²	141	117.5 Å²	117.5	61%	0.613	57%	0.566	S	S	*	*	H	α-helix	trans	-62.8	-42	175.8	-169	173.7	-178.1	178.7	0	111.4	R416 S417 R423 Q424	R416-K420 WeakPolarHBondContact O-CB 3.31Å; R416-K420 PolarHBondContact O-N 3.06Å; S417-K420 PolarHBondContact O-N 2.9Å; K420-R423 PolarHBondContact O-N 3.04Å; K420-Q424 WeakPolarHBondContact O-CG 3.47Å; K420-Q424 PolarHBondContact O-N 3.46Å
421	R	75.5	Confident	70.5	Confident	167 Å²	167	119.1 Å²	119.1	63%	0.63	57%	0.573	S	S	*	*	H	α-helix	trans	-65.6	-43.5	178.2	-150.2	174.7	-165.7	-178.5	3.7	111.8	S417 Q418 Q424 M425	S417-R421 WeakPolarHBondContact O-CB 3.26Å; S417-R421 PolarHBondContact O-N 2.98Å; Q418-R421 PolarHBondContact O-N 3.12Å; R421-Q424 PolarHBondContact O-N 2.89Å; R421-M425 WeakPolarHBondContact O-CG 3.39Å; R421-M425 PolarHBondContact O-N 2.62Å
422	K	77.6	Confident	69.7	Low	156 Å²	156	118.7 Å²	118.7	68%	0.678	58%	0.581	S	S	*	*	H	α-helix	trans	-60.4	-44.6	172.5	-78.9	-161.1	172.5	-164.5	0	112.5	Q418 V419 Q424 M425 A426	Q418-K422 PolarHBondContact O-N 3.32Å; V419-K422 PolarHBondContact O-N 3.01Å; K422-Q424 VanDerWaalsContact C-N 3.31Å; K422-Q424 PolarHBondContact O-N 3.19Å; K422-M425 PolarHBondContact O-N 3.18Å; K422-A426 PolarHBondContact O-N 3.43Å
423	R	77.8	Confident	68.6	Low	192 Å²	192	124.3 Å²	124.3	73%	0.725	62%	0.619	S	S	*	*	H	α-helix	trans	-61.3	-37.7	174.5	-75.3	-174.6	175.7	-169.3	-1.6	112.5	V419 K420 A427	V419-R423 PolarHBondContact O-N 3.23Å; K420-R423 PolarHBondContact O-N 3.04Å; R423-A427 VanDerWaalsContact O-CB 3.25Å; R423-A427 WeakPolarHBondContact O-CB 3.31Å; R423-A427 PolarHBondContact O-N 3.36Å
424	Q	73.6	Confident	68.7	Low	113 Å²	113	126.9 Å²	126.9	53%	0.528	62%	0.624	S	S	.	*	H	α-helix	trans	-70.8	-30.2	176.8	-75.6	177.9	-52.5	0	0	113.8	K420 R421 K422 R428	K420-Q424 WeakPolarHBondContact O-CG 3.47Å; K420-Q424 PolarHBondContact O-N 3.46Å; R421-Q424 PolarHBondContact O-N 2.89Å; K422-Q424 VanDerWaalsContact C-N 3.31Å; K422-Q424 PolarHBondContact O-N 3.19Å; Q424-R428 WeakPolarHBondContact O-CG 3.09Å; Q424-R428 PolarHBondContact O-N 3.05Å
425	M	72.5	Confident	68.4	Low	107 Å²	107	128.9 Å²	128.9	53%	0.527	63%	0.633	S	S	.	*	H	α-helix	trans	-74.1	-46.6	173.5	-64.8	-169.7	-52.3	0	0	111.1	R421 K422 A427 R428 E429	R421-M425 WeakPolarHBondContact O-CG 3.39Å; R421-M425 PolarHBondContact O-N 2.62Å; K422-M425 PolarHBondContact O-N 3.18Å; M425-A427 PolarHBondContact O-N 3.03Å; M425-R428 WeakPolarHBondContact O-CA 3.32Å; M425-R428 WeakPolarHBondContact O-CB 3.4Å; M425-R428 PolarHBondContact O-N 2.73Å; M425-E429 PolarHBondContact O-N 3.44Å
426	A	71.5	Confident	68.2	Low	49 Å²	49	132.9 Å²	132.9	41%	0.405	64%	0.642	S	S	.	*	H	α-helix	trans	-59.7	-32	174.1	0	0	0	0	0	113.6	K422 R428 E429 K430	K422-A426 PolarHBondContact O-N 3.43Å; A426-R428 VanDerWaalsContact C-N 3.34Å; A426-E429 WeakPolarHBondContact CA-OE2 3.1Å; A426-K430 PolarHBondContact O-N 3.13Å
427	A	68.7	Low	67.9	Low	61 Å²	61	130.7 Å²	130.7	50%	0.504	64%	0.642	S	S	.	*	H	α-helix	trans	-78.4	-12.5	173.9	0	0	0	0	0	114.3	R423 M425	R423-A427 VanDerWaalsContact O-CB 3.25Å; R423-A427 WeakPolarHBondContact O-CB 3.31Å; R423-A427 PolarHBondContact O-N 3.36Å; M425-A427 PolarHBondContact O-N 3.03Å
428	R	66.2	Low	67.7	Low	197 Å²	197	134.8 Å²	134.8	74%	0.743	65%	0.654	S	S	*	*	H	α-helix	trans	-88.8	-38.5	169	-81	-178.6	168.4	-165	-5.4	111.6	Q424 M425 A426 K430 K431	Q424-R428 WeakPolarHBondContact O-CG 3.09Å; Q424-R428 PolarHBondContact O-N 3.05Å; M425-R428 WeakPolarHBondContact O-CA 3.32Å; M425-R428 WeakPolarHBondContact O-CB 3.4Å; M425-R428 PolarHBondContact O-N 2.73Å; A426-R428 VanDerWaalsContact C-N 3.34Å; R428-K430 VanDerWaalsContact C-N 3.31Å; R428-K430 PolarHBondContact O-N 2.04Å; R428-K431 PolarHBondContact O-N 2.83Å
429	E	62.6	Low	67.5	Low	131 Å²	131	136.7 Å²	136.7	61%	0.612	66%	0.664	S	S	*	*	H	α-helix	trans	-58	-44.9	174	-68.7	165.5	148.9	0	0	110.4	M425 A426 K431 V432 S433	M425-E429 PolarHBondContact O-N 3.44Å; A426-E429 WeakPolarHBondContact CA-OE2 3.1Å; E429-K431 PolarHBondContact O-N 3.15Å; E429-V432 PolarHBondContact O-N 3.42Å; E429-V432 VanDerWaalsContact O-N 3.12Å; E429-S433 PolarHBondContact O-N 2.97Å
430	K	62.8	Low	66.9	Low	179 Å²	179	140.3 Å²	140.3	78%	0.778	67%	0.674	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	20.6	171.1	-66.9	-165.5	172.2	-157.6	0	116.2	A426 R428	A426-K430 PolarHBondContact O-N 3.13Å; R428-K430 VanDerWaalsContact C-N 3.31Å; R428-K430 PolarHBondContact O-N 2.04Å
431	K	55.9	Low	66.4	Low	181 Å²	181	140.2 Å²	140.2	79%	0.787	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.9	7.2	170.3	-83.8	-159.2	169.2	-158.6	0	112.7	R428 E429	R428-K431 PolarHBondContact O-N 2.83Å; E429-K431 PolarHBondContact O-N 3.15Å
432	V	54.3	Low	65.7	Low	132 Å²	132	138 Å²	138	80%	0.8	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.6	-18.2	-179.6	179.7	0	0	0	0	110.7	E429	E429-V432 PolarHBondContact O-N 3.42Å; E429-V432 VanDerWaalsContact O-N 3.12Å
433	S	44.4	Very low	64.6	Low	158 Å²	158	136.4 Å²	136.4	100%	1.105	68%	0.683	S	S	*	*			trans	-98.7	0	144.5	-52.3	0	0	0	0	109.7	E429	E429-S433 PolarHBondContact O-N 2.97Å

Retrieved 433 of 433 residues in 534.1 ms (Link to these results)

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