A0A3Q0KV10_SCHMA Loading...

Smp_204740

AlphaFold DB , UniProt , Accession A0A3Q0KV10, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 659 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	46.5	Very low	48.1	Very low	230 Å²	230	172.7 Å²	172.7	100%	1.133	82%	0.818	S	S	*	*				0	142.2	0	-59.7	97.4	98.5	0	0	109.3
2	K	46.9	Very low	48.5	Very low	218 Å²	218	169.1 Å²	169.1	95%	0.948	82%	0.815	S	S	*	*			trans	-98.3	118.9	172.7	-68.7	-174.9	177.1	-176.5	0	109.6
3	R	56.4	Low	48	Very low	223 Å²	223	164.5 Å²	164.5	84%	0.842	81%	0.811	S	S	*	*			trans	-103.3	113.6	168.4	-76.2	-176	179.1	148.7	-0.5	108.9
4	K	49.1	Very low	48.2	Very low	195 Å²	195	159.2 Å²	159.2	85%	0.848	81%	0.807	S	S	*	*			trans	-78	135.6	153.6	-71	-170.2	175.5	-170.8	0	107.1
5	H	49.5	Very low	48.4	Very low	162 Å²	162	156.3 Å²	156.3	75%	0.75	80%	0.803	S	S	*	*			trans	-122.5	138.6	158.7	-104.5	-105.4	0	0	0	108.1
6	T	44	Very low	48.2	Very low	123 Å²	123	153.1 Å²	153.1	76%	0.755	81%	0.807	S	S	*	*			trans	-129.2	101	-175	52.6	0	0	0	0	108.1
7	E	51.4	Low	48.6	Very low	140 Å²	140	153.6 Å²	153.6	65%	0.654	81%	0.806	S	S	*	*			trans	-122.4	107.4	173.5	-63.1	-150.9	96.5	0	0	108.6
8	K	48.5	Very low	48.9	Very low	166 Å²	166	151.2 Å²	151.2	72%	0.722	80%	0.802	S	S	*	*				77.7	79.4	103.1	-71.5	168.7	-173.5	163.2	0	112.5	T10	K8-T10 PolarHBondContact O-N 3.36Å
9	S	39.1	Very low	48.7	Very low	111 Å²	111	150.9 Å²	150.9	78%	0.776	81%	0.806	S	S	*	*			trans	-55.4	124.2	158.8	179.1	0	0	0	0	109.2
10	T	52.2	Low	48.7	Very low	121 Å²	121	148.9 Å²	148.9	74%	0.742	81%	0.805	S	S	*	*			trans	-111.9	110.6	168.2	-60.1	0	0	0	0	106.9	K8 V12	K8-T10 PolarHBondContact O-N 3.36Å; T10-V12 PolarHBondContact O-N 2.97Å
11	Y	46	Very low	48.7	Very low	211 Å²	211	147 Å²	147	83%	0.827	80%	0.798	S	S	*	*			trans	-73.9	114.6	-175.3	-133.2	-101	0	0	0	109.8
12	V	52.8	Low	48.6	Very low	129 Å²	129	148.1 Å²	148.1	78%	0.782	79%	0.79	S	S	*	*			trans	-103.8	113.4	170.3	179.1	0	0	0	0	108	T10 A14	T10-V12 PolarHBondContact O-N 2.97Å; V12-A14 PolarHBondContact O-N 3.37Å
13	S	41.7	Very low	48.8	Very low	109 Å²	109	140 Å²	140	76%	0.762	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-72.3	118.3	-180	-57.8	0	0	0	0	111.5
14	A	50.9	Low	48.4	Very low	91 Å²	91	136.1 Å²	136.1	75%	0.752	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-89.4	148.4	164	0	0	0	0	0	110.5	V12	V12-A14 PolarHBondContact O-N 3.37Å
15	P	50.5	Low	48.6	Very low	115 Å²	115	132.5 Å²	132.5	75%	0.747	75%	0.753	S	S	*	*	P	Polyproline II helix	trans	-76	155.4	-174	31.1	-35.8	0	0	0	113.2	M17	P15-M17 PolarHBondContact O-N 3.31Å
16	A	45	Very low	48.7	Very low	106 Å²	106	128 Å²	128	88%	0.876	74%	0.74	S	S	*	*	P	Polyproline II helix	trans	-69.1	120.7	177.9	0	0	0	0	0	111.9
17	M	56.3	Low	49.2	Very low	161 Å²	161	128 Å²	128	79%	0.793	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-88	144.4	174.9	-72.6	-69.4	-77.9	0	0	111.6	P15	P15-M17 PolarHBondContact O-N 3.31Å
18	P	52.8	Low	49.5	Very low	111 Å²	111	126.2 Å²	126.2	72%	0.721	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-71.7	135.8	-175.9	28.6	-34.7	0	0	0	112.7	S20	P18-S20 PolarHBondContact O-N 3.27Å
19	T	46.2	Very low	50.1	Low	145 Å²	145	121.6 Å²	121.6	89%	0.89	72%	0.722	S	S	*	*	S	Bend	trans	-78.8	76.1	-174.8	53.7	0	0	0	0	112.7
20	S	49.2	Very low	51.4	Low	111 Å²	111	120.2 Å²	120.2	78%	0.776	71%	0.706	S	S	*	*	S	Bend	trans	-147.2	6	177	-160.6	0	0	0	0	117.6	P18	P18-S20 PolarHBondContact O-N 3.27Å
21	V	47.6	Very low	52.4	Low	109 Å²	109	120 Å²	120	66%	0.661	70%	0.701	S	S	*	*			trans	-138	113	166.7	-171.4	0	0	0	0	107.6
22	R	44.1	Very low	54	Low	254 Å²	254	117 Å²	117	96%	0.958	69%	0.692	S	S	*	*			trans	-144.6	33.8	-170.4	-150.5	179.3	-171.3	178.4	2.7	113.4
23	G	51.1	Low	55.4	Low	48 Å²	48	116.3 Å²	116.3	50%	0.495	68%	0.68	S	S	.	*	S	Bend	trans	-113.9	-63.2	173.9	0	0	0	0	0	111.4	L25	G23-L25 PolarHBondContact O-N 3.31Å
24	D	48.8	Very low	57.4	Low	140 Å²	140	116.2 Å²	116.2	75%	0.749	67%	0.671	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.4	42.6	-161.5	-40.2	-69.8	0	0	0	114.2
25	L	52	Low	59	Low	119 Å²	119	115.7 Å²	115.7	62%	0.623	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-135.3	-0.6	-178.6	-78.3	175.3	0	0	0	115.3	G23	G23-L25 PolarHBondContact O-N 3.31Å
26	S	53.3	Low	60.8	Low	69 Å²	69	116.7 Å²	116.7	48%	0.483	65%	0.649	S	S	.	*	S	Bend	trans	-73.4	-48	166.9	53.8	0	0	0	0	110.7	V28 S29 D30	S26-V28 VanDerWaalsContact C-N 3.25Å; S26-V28 PolarHBondContact O-N 3.21Å; S26-S29 CarbonylContact O-C 3.55Å; S26-S29 WeakPolarHBondContact O-CA 3.36Å; S26-S29 WeakPolarHBondContact O-CB 3.47Å; S26-S29 PolarHBondContact O-N 2.95Å; S26-D30 VanDerWaalsContact C-OD2 3.28Å; S26-D30 WeakPolarHBondContact CB-OD2 3.32Å; S26-D30 PolarHBondContact O-N 3.46Å
27	D	54.8	Low	62.8	Low	122 Å²	122	115.2 Å²	115.2	65%	0.652	63%	0.626	S	S	*	*	H	α-helix	trans	-41.3	-48.6	-179.8	-127.6	34.1	0	0	0	113.2	D30 D31	D27-D30 PolarHBondContact O-N 2.85Å; D27-D31 WeakPolarHBondContact O-CB 3.47Å; D27-D31 PolarHBondContact O-N 2.79Å
28	V	56.3	Low	64.4	Low	103 Å²	103	112.1 Å²	112.1	62%	0.624	62%	0.616	S	S	*	*	H	α-helix	trans	-76.5	-22.3	-177.5	-173.9	0	0	0	0	113.2	S26	S26-V28 VanDerWaalsContact C-N 3.25Å; S26-V28 PolarHBondContact O-N 3.21Å
29	S	62.1	Low	66.2	Low	68 Å²	68	112.4 Å²	112.4	48%	0.476	61%	0.608	S	S	.	*	H	α-helix	trans	-82.1	-41	172.1	-168.2	0	0	0	0	111	S26 F32 E33	S26-S29 CarbonylContact O-C 3.55Å; S26-S29 WeakPolarHBondContact O-CA 3.36Å; S26-S29 WeakPolarHBondContact O-CB 3.47Å; S26-S29 PolarHBondContact O-N 2.95Å; S29-F32 PolarHBondContact O-N 3.03Å; S29-E33 PolarHBondContact O-N 2.87Å
30	D	65.6	Low	68.3	Low	83 Å²	83	107.6 Å²	107.6	44%	0.444	58%	0.578	S	S	.	*	H	α-helix	trans	-66.6	-43.9	-177.8	-57.9	-26.6	0	0	0	109.8	S26 D27 F32 E33 D34	S26-D30 VanDerWaalsContact C-OD2 3.28Å; S26-D30 WeakPolarHBondContact CB-OD2 3.32Å; S26-D30 PolarHBondContact O-N 3.46Å; D27-D30 PolarHBondContact O-N 2.85Å; D30-F32 VanDerWaalsContact C-N 3.28Å; D30-F32 PolarHBondContact O-N 2.82Å; D30-E33 PolarHBondContact O-N 2.72Å; D30-D34 WeakPolarHBondContact O-CB 3.47Å; D30-D34 PolarHBondContact O-N 3.23Å
31	D	73.2	Confident	70.2	Confident	117 Å²	117	104.5 Å²	104.5	63%	0.626	56%	0.56	S	S	*	*	H	α-helix	trans	-52.7	-40.6	170.6	-99.2	-5.8	0	0	0	113.1	D27 T35	D27-D31 WeakPolarHBondContact O-CB 3.47Å; D27-D31 PolarHBondContact O-N 2.79Å; D31-T35 WeakPolarHBondContact O-CB 3.36Å; D31-T35 PolarHBondContact O-N 3.05Å; D31-T35 VanDerWaalsContact O-N 3.07Å; D31-T35 PolarHBondContact O-OG1 3.24Å
32	F	79.8	Confident	72.1	Confident	148 Å²	148	103.4 Å²	103.4	65%	0.649	55%	0.55	S	S	*	*	H	α-helix	trans	-76.3	-39.9	180	-177.6	-91	0	0	0	111.9	S29 D30 T35 Y36	S29-F32 PolarHBondContact O-N 3.03Å; D30-F32 VanDerWaalsContact C-N 3.28Å; D30-F32 PolarHBondContact O-N 2.82Å; F32-T35 PolarHBondContact O-N 3.35Å; F32-Y36 WeakPolarHBondContact O-CB 3.28Å; F32-Y36 PolarHBondContact O-N 3.05Å
33	E	82.5	Confident	74.3	Confident	113 Å²	113	95.9 Å²	95.9	53%	0.528	53%	0.528	S	S	.	.	H	α-helix	trans	-66.7	-40.9	177.1	-174.8	156.5	179.3	0	0	111.2	S29 D30 Y36 N37	S29-E33 PolarHBondContact O-N 2.87Å; D30-E33 PolarHBondContact O-N 2.72Å; E33-Y36 PolarHBondContact O-N 2.91Å; E33-N37 WeakPolarHBondContact CG-ND2 3.35Å; E33-N37 VanDerWaalsContact O-CB 3.28Å; E33-N37 WeakPolarHBondContact O-CB 3.48Å; E33-N37 PolarHBondContact O-N 3.37Å; E33-N37 PolarHBondContact O-ND2 3.27Å
34	D	83	Confident	76	Confident	108 Å²	108	99 Å²	99	58%	0.578	53%	0.529	S	S	*	.	H	α-helix	trans	-65.9	-37.5	172.7	-88.6	-5.1	0	0	0	112.7	D30 T38	D30-D34 WeakPolarHBondContact O-CB 3.47Å; D30-D34 PolarHBondContact O-N 3.23Å; D34-T38 VanDerWaalsContact O-CB 3.26Å; D34-T38 WeakPolarHBondContact O-CB 3.41Å; D34-T38 PolarHBondContact O-N 3.07Å; D34-T38 PolarHBondContact O-OG1 3.24Å
35	T	85.1	Confident	77.9	Confident	79 Å²	79	95.6 Å²	95.6	49%	0.485	51%	0.514	S	S	.	.	H	α-helix	trans	-61.5	-48.8	172.3	-61.9	0	0	0	0	111	D31 F32 T38 E39	D31-T35 WeakPolarHBondContact O-CB 3.36Å; D31-T35 PolarHBondContact O-N 3.05Å; D31-T35 VanDerWaalsContact O-N 3.07Å; D31-T35 PolarHBondContact O-OG1 3.24Å; F32-T35 PolarHBondContact O-N 3.35Å; T35-T38 WeakPolarHBondContact O-CB 3.45Å; T35-T38 PolarHBondContact O-N 2.91Å; T35-E39 PolarHBondContact O-N 3.4Å
36	Y	87.7	Confident	79.6	Confident	137 Å²	137	93.6 Å²	93.6	54%	0.537	50%	0.501	S	S	.	.	H	α-helix	trans	-63.9	-43.5	178.5	174.7	-99.4	0	0	0	112.4	F32 E33 T38 E39 V40	F32-Y36 WeakPolarHBondContact O-CB 3.28Å; F32-Y36 PolarHBondContact O-N 3.05Å; E33-Y36 PolarHBondContact O-N 2.91Å; Y36-T38 VanDerWaalsContact C-N 3.27Å; Y36-T38 PolarHBondContact O-N 2.94Å; Y36-E39 PolarHBondContact O-N 2.72Å; Y36-V40 HydrophobicContact CD1-CG2 4.33Å; Y36-V40 HydrophobicContact CE1-CG2 3.9Å; Y36-V40 HydrophobicContact CE2-CG2 4.14Å; Y36-V40 WeakPolarHBondContact O-CG2 3.48Å; Y36-V40 PolarHBondContact O-N 2.9Å
37	N	87.9	Confident	81.1	Confident	75 Å²	75	95.2 Å²	95.2	40%	0.401	50%	0.504	S	S	.	.	H	α-helix	trans	-62.4	-36.4	175.4	-74	-35.2	0	0	0	111.5	E33 V40 A41	E33-N37 WeakPolarHBondContact CG-ND2 3.35Å; E33-N37 VanDerWaalsContact O-CB 3.28Å; E33-N37 WeakPolarHBondContact O-CB 3.48Å; E33-N37 PolarHBondContact O-N 3.37Å; E33-N37 PolarHBondContact O-ND2 3.27Å; N37-V40 PolarHBondContact O-N 2.91Å; N37-A41 WeakPolarHBondContact O-CB 3.39Å; N37-A41 PolarHBondContact O-N 3.48Å
38	T	89.8	Confident	82.6	Confident	95 Å²	95	94.2 Å²	94.2	58%	0.583	50%	0.499	S	S	*	.	H	α-helix	trans	-67	-42.5	173.9	-60.6	0	0	0	0	112.2	D34 T35 Y36 A41 N42	D34-T38 VanDerWaalsContact O-CB 3.26Å; D34-T38 WeakPolarHBondContact O-CB 3.41Å; D34-T38 PolarHBondContact O-N 3.07Å; D34-T38 PolarHBondContact O-OG1 3.24Å; T35-T38 WeakPolarHBondContact O-CB 3.45Å; T35-T38 PolarHBondContact O-N 2.91Å; Y36-T38 VanDerWaalsContact C-N 3.27Å; Y36-T38 PolarHBondContact O-N 2.94Å; T38-A41 PolarHBondContact O-N 3.38Å; T38-N42 WeakPolarHBondContact O-CB 3.32Å; T38-N42 PolarHBondContact O-N 3.49Å
39	E	91.2	Very high	84	Confident	118 Å²	118	92.7 Å²	92.7	55%	0.551	49%	0.485	S	S	*	.	H	α-helix	trans	-62.4	-43.5	173.2	-73	-168	167.6	0	0	111.9	T35 Y36 A41 N42 I43	T35-E39 PolarHBondContact O-N 3.4Å; Y36-E39 PolarHBondContact O-N 2.72Å; E39-A41 PolarHBondContact O-N 3.46Å; E39-N42 WeakPolarHBondContact O-CB 3.36Å; E39-N42 PolarHBondContact O-N 3.42Å; E39-I43 WeakPolarHBondContact O-CG1 3.48Å; E39-I43 PolarHBondContact O-N 2.93Å
40	V	89	Confident	85	Confident	43 Å²	43	93.6 Å²	93.6	26%	0.261	48%	0.484	S	S	.	.	H	α-helix	trans	-62.1	-42.1	176.3	169.8	0	0	0	0	111.3	Y36 N37 I43 Q44	Y36-V40 HydrophobicContact CD1-CG2 4.33Å; Y36-V40 HydrophobicContact CE1-CG2 3.9Å; Y36-V40 HydrophobicContact CE2-CG2 4.14Å; Y36-V40 WeakPolarHBondContact O-CG2 3.48Å; Y36-V40 PolarHBondContact O-N 2.9Å; N37-V40 PolarHBondContact O-N 2.91Å; V40-I43 PolarHBondContact O-N 3.38Å; V40-Q44 VanDerWaalsContact CG1-NE2 3.34Å; V40-Q44 WeakPolarHBondContact O-CB 3.26Å; V40-Q44 VanDerWaalsContact O-CG 3.29Å; V40-Q44 WeakPolarHBondContact O-CG 3.29Å; V40-Q44 PolarHBondContact O-N 2.92Å
41	A	88.4	Confident	85.9	Confident	47 Å²	47	96.3 Å²	96.3	39%	0.388	50%	0.498	S	S	.	.	H	α-helix	trans	-66	-37.8	175.3	0	0	0	0	0	112.7	N37 T38 E39 Q44 T45	N37-A41 WeakPolarHBondContact O-CB 3.39Å; N37-A41 PolarHBondContact O-N 3.48Å; T38-A41 PolarHBondContact O-N 3.38Å; E39-A41 PolarHBondContact O-N 3.46Å; A41-Q44 PolarHBondContact O-N 3.25Å; A41-T45 WeakPolarHBondContact O-CG2 3.38Å; A41-T45 PolarHBondContact O-N 2.93Å; A41-T45 PolarHBondContact O-OG1 3.09Å
42	N	89.5	Confident	86.6	Confident	86 Å²	86	96.1 Å²	96.1	46%	0.46	50%	0.497	S	S	.	.	H	α-helix	trans	-63.6	-44.8	173.8	-170.8	5.7	0	0	0	111.1	T38 E39 Q44 T45 Q46	T38-N42 WeakPolarHBondContact O-CB 3.32Å; T38-N42 PolarHBondContact O-N 3.49Å; E39-N42 WeakPolarHBondContact O-CB 3.36Å; E39-N42 PolarHBondContact O-N 3.42Å; N42-Q44 PolarHBondContact O-N 2.92Å; N42-T45 PolarHBondContact O-N 3.39Å; N42-T45 PolarHBondContact O-OG1 2.97Å; N42-T45 VanDerWaalsContact O-OG1 3.04Å; N42-Q46 WeakPolarHBondContact O-CB 3.29Å; N42-Q46 VanDerWaalsContact O-CG 3.29Å; N42-Q46 WeakPolarHBondContact O-CG 3.48Å; N42-Q46 PolarHBondContact O-N 2.9Å; N42-Q46 PolarHBondContact OD1-NE2 3.15Å
43	I	88.5	Confident	86.7	Confident	95 Å²	95	95.8 Å²	95.8	49%	0.487	50%	0.495	S	S	.	.	H	α-helix	trans	-64.2	-41.1	175.9	-67.3	164.5	0	0	0	111.4	E39 V40 Q46 L47	E39-I43 WeakPolarHBondContact O-CG1 3.48Å; E39-I43 PolarHBondContact O-N 2.93Å; V40-I43 PolarHBondContact O-N 3.38Å; I43-Q46 PolarHBondContact O-N 3.39Å; I43-L47 HydrophobicContact CG2-CD1 4.18Å; I43-L47 WeakPolarHBondContact O-CG 3.44Å; I43-L47 PolarHBondContact O-N 3.04Å
44	Q	88.3	Confident	86.8	Confident	114 Å²	114	94.7 Å²	94.7	53%	0.533	50%	0.497	S	S	.	.	H	α-helix	trans	-62.5	-47.1	175.5	-74.4	174.4	18	0	0	111.8	V40 A41 N42 Q46 L47 D48	V40-Q44 VanDerWaalsContact CG1-NE2 3.34Å; V40-Q44 WeakPolarHBondContact O-CB 3.26Å; V40-Q44 VanDerWaalsContact O-CG 3.29Å; V40-Q44 WeakPolarHBondContact O-CG 3.29Å; V40-Q44 PolarHBondContact O-N 2.92Å; A41-Q44 PolarHBondContact O-N 3.25Å; N42-Q44 PolarHBondContact O-N 2.92Å; Q44-Q46 VanDerWaalsContact C-N 3.32Å; Q44-Q46 PolarHBondContact O-N 2.93Å; Q44-L47 WeakPolarHBondContact O-CB 3.47Å; Q44-L47 PolarHBondContact O-N 3.41Å; Q44-L47 VanDerWaalsContact O-N 3.15Å; Q44-D48 PolarHBondContact O-N 2.98Å
45	T	87.5	Confident	86.7	Confident	69 Å²	69	91.3 Å²	91.3	42%	0.423	48%	0.477	S	S	.	.	H	α-helix	trans	-67.8	-29.5	177.9	53.1	0	0	0	0	113	A41 N42 Q49	A41-T45 WeakPolarHBondContact O-CG2 3.38Å; A41-T45 PolarHBondContact O-N 2.93Å; A41-T45 PolarHBondContact O-OG1 3.09Å; N42-T45 PolarHBondContact O-N 3.39Å; N42-T45 PolarHBondContact O-OG1 2.97Å; N42-T45 VanDerWaalsContact O-OG1 3.04Å; T45-Q49 WeakPolarHBondContact O-CB 3.31Å; T45-Q49 WeakPolarHBondContact O-CG 3.18Å; T45-Q49 PolarHBondContact O-N 3.45Å; T45-Q49 PolarHBondContact O-NE2 3.38Å
46	Q	87.3	Confident	86.6	Confident	76 Å²	76	91.4 Å²	91.4	36%	0.355	48%	0.479	S	S	.	.	H	α-helix	trans	-67.9	-39.4	169.6	-73.5	174.1	34.9	0	0	112.3	N42 I43 Q44 Q49 L50	N42-Q46 WeakPolarHBondContact O-CB 3.29Å; N42-Q46 VanDerWaalsContact O-CG 3.29Å; N42-Q46 WeakPolarHBondContact O-CG 3.48Å; N42-Q46 PolarHBondContact O-N 2.9Å; N42-Q46 PolarHBondContact OD1-NE2 3.15Å; I43-Q46 PolarHBondContact O-N 3.39Å; Q44-Q46 VanDerWaalsContact C-N 3.32Å; Q44-Q46 PolarHBondContact O-N 2.93Å; Q46-Q49 PolarHBondContact O-N 3.44Å; Q46-L50 VanDerWaalsContact O-CG 3.31Å; Q46-L50 WeakPolarHBondContact O-CG 3.36Å; Q46-L50 PolarHBondContact O-N 3.28Å
47	L	85.3	Confident	86.5	Confident	104 Å²	104	89.3 Å²	89.3	55%	0.545	47%	0.474	S	S	.	.	H	α-helix	trans	-64.2	-45.2	174.2	-73.9	167.1	0	0	0	111.7	I43 Q44 Q49 L50 D51	I43-L47 HydrophobicContact CG2-CD1 4.18Å; I43-L47 WeakPolarHBondContact O-CG 3.44Å; I43-L47 PolarHBondContact O-N 3.04Å; Q44-L47 WeakPolarHBondContact O-CB 3.47Å; Q44-L47 PolarHBondContact O-N 3.41Å; Q44-L47 VanDerWaalsContact O-N 3.15Å; L47-Q49 VanDerWaalsContact C-N 3.32Å; L47-Q49 PolarHBondContact O-N 2.92Å; L47-L50 PolarHBondContact O-N 2.98Å; L47-L50 VanDerWaalsContact O-N 3.09Å; L47-D51 PolarHBondContact O-N 2.83Å
48	D	86.8	Confident	86.5	Confident	101 Å²	101	89.8 Å²	89.8	54%	0.54	47%	0.473	S	S	.	.	H	α-helix	trans	-62.9	-38.4	175	-75.5	-15.5	0	0	0	111.5	Q44 L50 D51 N52	Q44-D48 PolarHBondContact O-N 2.98Å; D48-L50 VanDerWaalsContact C-N 3.3Å; D48-L50 PolarHBondContact O-N 2.97Å; D48-D51 PolarHBondContact O-N 3.07Å; D48-N52 VanDerWaalsContact O-CB 3.28Å; D48-N52 WeakPolarHBondContact O-CB 3.28Å; D48-N52 PolarHBondContact O-N 3.2Å; D48-N52 PolarHBondContact O-ND2 3.5Å
49	Q	86.1	Confident	86.5	Confident	71 Å²	71	88.3 Å²	88.3	33%	0.332	46%	0.464	S	S	.	.	H	α-helix	trans	-64.2	-32.6	172.8	-78.3	171.1	52.5	0	0	112.9	T45 Q46 L47 K53 T54 H55	T45-Q49 WeakPolarHBondContact O-CB 3.31Å; T45-Q49 WeakPolarHBondContact O-CG 3.18Å; T45-Q49 PolarHBondContact O-N 3.45Å; T45-Q49 PolarHBondContact O-NE2 3.38Å; Q46-Q49 PolarHBondContact O-N 3.44Å; L47-Q49 VanDerWaalsContact C-N 3.32Å; L47-Q49 PolarHBondContact O-N 2.92Å; Q49-K53 CarbonylContact O-C 3.57Å; Q49-K53 PolarHBondContact O-N 2.96Å; Q49-K53 VanDerWaalsContact O-N 3.15Å; Q49-T54 PolarHBondContact O-N 2.8Å; Q49-H55 HydrophobicContact CB-CB 4.01Å; Q49-H55 PolarHBondContact O-N 3.15Å
50	L	82.5	Confident	86.6	Confident	87 Å²	87	87.6 Å²	87.6	46%	0.455	46%	0.459	S	S	.	.	H	α-helix	trans	-75	-43.2	176.7	-74.4	164.7	0	0	0	111.8	Q46 L47 D48 K53 H55	Q46-L50 VanDerWaalsContact O-CG 3.31Å; Q46-L50 WeakPolarHBondContact O-CG 3.36Å; Q46-L50 PolarHBondContact O-N 3.28Å; L47-L50 PolarHBondContact O-N 2.98Å; L47-L50 VanDerWaalsContact O-N 3.09Å; D48-L50 VanDerWaalsContact C-N 3.3Å; D48-L50 PolarHBondContact O-N 2.97Å; L50-K53 PolarHBondContact O-N 3.27Å; L50-K53 VanDerWaalsContact O-N 3.07Å; L50-H55 HydrophobicContact CD2-CB 3.67Å; L50-H55 HydrophobicContact CG-CB 3.97Å
51	D	85.3	Confident	86.8	Confident	139 Å²	139	89.5 Å²	89.5	74%	0.743	47%	0.467	S	S	*	.	H	α-helix	trans	-65.9	-42.3	177.5	-160.9	54.2	0	0	0	111.4	L47 D48 K53	L47-D51 PolarHBondContact O-N 2.83Å; D48-D51 PolarHBondContact O-N 3.07Å; D51-K53 PolarHBondContact O-N 2.8Å
52	N	86.4	Confident	87	Confident	113 Å²	113	93 Å²	93	60%	0.604	47%	0.47	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	-1.6	172	-69.5	-75	0	0	0	114	D48 T54	D48-N52 VanDerWaalsContact O-CB 3.28Å; D48-N52 WeakPolarHBondContact O-CB 3.28Å; D48-N52 PolarHBondContact O-N 3.2Å; D48-N52 PolarHBondContact O-ND2 3.5Å; N52-T54 PolarHBondContact O-N 3.22Å; N52-T54 PolarHBondContact O-OG1 2.96Å
53	K	82.1	Confident	87.2	Confident	141 Å²	141	90.2 Å²	90.2	61%	0.613	46%	0.461	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.8	24.9	179.4	-56.3	174.2	-173.9	169.5	0	114.9	Q49 L50 D51 F58	Q49-K53 CarbonylContact O-C 3.57Å; Q49-K53 PolarHBondContact O-N 2.96Å; Q49-K53 VanDerWaalsContact O-N 3.15Å; L50-K53 PolarHBondContact O-N 3.27Å; L50-K53 VanDerWaalsContact O-N 3.07Å; D51-K53 PolarHBondContact O-N 2.8Å; K53-F58 HydrophobicContact CB-CD1 4.21Å; K53-F58 HydrophobicContact CB-CE1 3.76Å; K53-F58 HydrophobicContact CB-CZ 4.41Å; K53-F58 HydrophobicContact CG-CE1 4.37Å; K53-F58 WeakPolarHBondContact O-CD1 3.46Å
54	T	85.1	Confident	87.6	Confident	91 Å²	91	91 Å²	91	56%	0.558	46%	0.463	S	S	*	.			trans	-100.6	-9.2	-177.8	-48.1	0	0	0	0	112.5	Q49 N52	Q49-T54 PolarHBondContact O-N 2.8Å; N52-T54 PolarHBondContact O-N 3.22Å; N52-T54 PolarHBondContact O-OG1 2.96Å
55	H	81.2	Confident	88	Confident	37 Å²	37	90.4 Å²	90.4	17%	0.171	46%	0.462	C	S	.	.			trans	-52.6	130.3	-179.8	-173.6	-92.2	0	0	0	112.4	Q49 L50 E57 F58 V59	Q49-H55 HydrophobicContact CB-CB 4.01Å; Q49-H55 PolarHBondContact O-N 3.15Å; L50-H55 HydrophobicContact CD2-CB 3.67Å; L50-H55 HydrophobicContact CG-CB 3.97Å; H55-E57 PolarHBondContact O-N 2.95Å; H55-F58 HydrophobicContact CB-CB 4.24Å; H55-F58 WeakPolarHBondContact O-CA 3.32Å; H55-F58 WeakPolarHBondContact O-CB 3.39Å; H55-F58 PolarHBondContact O-N 2.97Å; H55-V59 PolarHBondContact O-N 3.3Å
56	P	82.9	Confident	88.4	Confident	80 Å²	80	91.6 Å²	91.6	52%	0.519	46%	0.463	S	S	.	.	H	α-helix	trans	-59.9	-44.3	-165.4	19.6	-32.5	0	0	0	114	F58 V59 K60	P56-F58 VanDerWaalsContact C-N 3.31Å; P56-F58 PolarHBondContact O-N 2.78Å; P56-V59 PolarHBondContact O-N 3.24Å; P56-K60 WeakPolarHBondContact O-CB 3.41Å; P56-K60 PolarHBondContact O-N 2.83Å
57	E	84.9	Confident	88.9	Confident	93 Å²	93	91.8 Å²	91.8	44%	0.435	47%	0.469	S	S	.	.	H	α-helix	trans	-66.3	-31.6	176	-71.5	-60.8	148.8	0	0	112.5	H55 K60 I61	H55-E57 PolarHBondContact O-N 2.95Å; E57-K60 IonicContact OE1-NZ 3.43Å; E57-K60 PolarHBondContact OE1-NZ 3.43Å; E57-K60 IonicContact OE2-NZ 2.83Å; E57-K60 PolarHBondContact OE2-NZ 3.44Å; E57-I61 WeakPolarHBondContact O-CB 3.21Å; E57-I61 WeakPolarHBondContact O-CD1 3.24Å; E57-I61 WeakPolarHBondContact O-CG1 3.34Å; E57-I61 PolarHBondContact O-N 3.42Å
58	F	87.7	Confident	89.5	Confident	86 Å²	86	94.5 Å²	94.5	38%	0.377	47%	0.473	S	S	.	.	H	α-helix	trans	-68.1	-47	174.7	173.1	-91.7	0	0	0	110.5	K53 H55 P56 K60 I61 R62	K53-F58 HydrophobicContact CB-CD1 4.21Å; K53-F58 HydrophobicContact CB-CE1 3.76Å; K53-F58 HydrophobicContact CB-CZ 4.41Å; K53-F58 HydrophobicContact CG-CE1 4.37Å; K53-F58 WeakPolarHBondContact O-CD1 3.46Å; H55-F58 HydrophobicContact CB-CB 4.24Å; H55-F58 WeakPolarHBondContact O-CA 3.32Å; H55-F58 WeakPolarHBondContact O-CB 3.39Å; H55-F58 PolarHBondContact O-N 2.97Å; P56-F58 VanDerWaalsContact C-N 3.31Å; P56-F58 PolarHBondContact O-N 2.78Å; F58-K60 VanDerWaalsContact C-N 3.33Å; F58-K60 PolarHBondContact O-N 2.98Å; F58-I61 PolarHBondContact O-N 2.87Å; F58-R62 VanDerWaalsContact O-CB 3.24Å; F58-R62 WeakPolarHBondContact O-CB 3.27Å; F58-R62 PolarHBondContact O-N 2.99Å
59	V	90.6	Very high	90	Very high	64 Å²	64	97.1 Å²	97.1	39%	0.388	48%	0.476	S	S	.	.	H	α-helix	trans	-61	-42.7	178.8	175.5	0	0	0	0	111.1	H55 P56 R62 G63	H55-V59 PolarHBondContact O-N 3.3Å; P56-V59 PolarHBondContact O-N 3.24Å; V59-R62 PolarHBondContact O-N 3.44Å; V59-G63 PolarHBondContact O-N 2.99Å
60	K	93	Very high	90.5	Very high	103 Å²	103	97.1 Å²	97.1	45%	0.448	48%	0.484	S	S	.	.	H	α-helix	trans	-61.7	-54.1	175.9	174.3	178.5	149.4	-137.7	0	112.3	P56 E57 F58 R62 G63 E64	P56-K60 WeakPolarHBondContact O-CB 3.41Å; P56-K60 PolarHBondContact O-N 2.83Å; E57-K60 IonicContact OE1-NZ 3.43Å; E57-K60 PolarHBondContact OE1-NZ 3.43Å; E57-K60 IonicContact OE2-NZ 2.83Å; E57-K60 PolarHBondContact OE2-NZ 3.44Å; F58-K60 VanDerWaalsContact C-N 3.33Å; F58-K60 PolarHBondContact O-N 2.98Å; K60-R62 VanDerWaalsContact C-N 3.26Å; K60-R62 PolarHBondContact O-N 2.97Å; K60-G63 PolarHBondContact O-N 2.94Å; K60-G63 VanDerWaalsContact O-N 3.08Å; K60-E64 VanDerWaalsContact CE-OE1 3.3Å; K60-E64 WeakPolarHBondContact CE-OE1 3.48Å; K60-E64 WeakPolarHBondContact CG-OE1 3.41Å; K60-E64 WeakPolarHBondContact O-CG 3.3Å; K60-E64 PolarHBondContact O-N 2.7Å
61	I	93.4	Very high	91.2	Very high	83 Å²	83	98.7 Å²	98.7	43%	0.426	49%	0.489	S	S	.	.	H	α-helix	trans	-61.1	-36.6	178.5	-68	166.3	0	0	0	110.9	E57 F58 E64 I65	E57-I61 WeakPolarHBondContact O-CB 3.21Å; E57-I61 WeakPolarHBondContact O-CD1 3.24Å; E57-I61 WeakPolarHBondContact O-CG1 3.34Å; E57-I61 PolarHBondContact O-N 3.42Å; F58-I61 PolarHBondContact O-N 2.87Å; I61-E64 PolarHBondContact O-N 3.32Å; I61-I65 HydrophobicContact CG2-CD1 3.84Å; I61-I65 VanDerWaalsContact O-CG1 3.27Å; I61-I65 WeakPolarHBondContact O-CG1 3.36Å; I61-I65 PolarHBondContact O-N 3.4Å
62	R	91.7	Very high	91.8	Very high	120 Å²	120	94.8 Å²	94.8	45%	0.453	47%	0.466	S	S	.	.	H	α-helix	trans	-62.4	-43.9	174.5	-155.2	-166.1	99.9	-145.3	-5.1	111.4	F58 V59 K60 I65 E66	F58-R62 VanDerWaalsContact O-CB 3.24Å; F58-R62 WeakPolarHBondContact O-CB 3.27Å; F58-R62 PolarHBondContact O-N 2.99Å; V59-R62 PolarHBondContact O-N 3.44Å; K60-R62 VanDerWaalsContact C-N 3.26Å; K60-R62 PolarHBondContact O-N 2.97Å; R62-I65 PolarHBondContact O-N 3.11Å; R62-E66 IonicContact CZ-OE1 3.67Å; R62-E66 IonicContact NE-OE1 2.72Å; R62-E66 PolarHBondContact NE-OE1 3.38Å; R62-E66 IonicContact NH2-OE1 2.67Å; R62-E66 PolarHBondContact NH2-OE1 3.48Å; R62-E66 IonicContact NH2-OE2 3.21Å; R62-E66 PolarHBondContact NH2-OE2 3.44Å; R62-E66 WeakPolarHBondContact O-CB 3.36Å; R62-E66 WeakPolarHBondContact O-CG 3.29Å; R62-E66 PolarHBondContact O-N 2.65Å
63	G	94.6	Very high	92.3	Very high	27 Å²	27	96.4 Å²	96.4	28%	0.278	47%	0.468	S	S	.	.	H	α-helix	trans	-62.6	-44.7	174.5	0	0	0	0	0	112.9	V59 K60 I65 E66 T67	V59-G63 PolarHBondContact O-N 2.99Å; K60-G63 PolarHBondContact O-N 2.94Å; K60-G63 VanDerWaalsContact O-N 3.08Å; G63-I65 VanDerWaalsContact C-N 3.31Å; G63-I65 PolarHBondContact O-N 3.33Å; G63-E66 PolarHBondContact O-N 2.92Å; G63-T67 PolarHBondContact O-N 3.33Å; G63-T67 PolarHBondContact O-OG1 2.83Å; G63-T67 VanDerWaalsContact O-OG1 3.08Å
64	E	96.8	Very high	93.1	Very high	111 Å²	111	95.5 Å²	95.5	52%	0.519	47%	0.466	S	S	.	.	H	α-helix	trans	-59	-40.8	175.1	-70.1	171.4	-165.3	0	0	111.7	K60 I61 W68	K60-E64 VanDerWaalsContact CE-OE1 3.3Å; K60-E64 WeakPolarHBondContact CE-OE1 3.48Å; K60-E64 WeakPolarHBondContact CG-OE1 3.41Å; K60-E64 WeakPolarHBondContact O-CG 3.3Å; K60-E64 PolarHBondContact O-N 2.7Å; I61-E64 PolarHBondContact O-N 3.32Å; E64-W68 WeakPolarHBondContact O-CB 3.36Å; E64-W68 PolarHBondContact O-N 3.4Å
65	I	96.8	Very high	93.6	Very high	103 Å²	103	98.6 Å²	98.6	53%	0.528	47%	0.467	S	S	.	.	H	α-helix	trans	-69.6	-41	175.4	-68.3	167.1	0	0	0	111.9	I61 R62 G63 W68 Y69	I61-I65 HydrophobicContact CG2-CD1 3.84Å; I61-I65 VanDerWaalsContact O-CG1 3.27Å; I61-I65 WeakPolarHBondContact O-CG1 3.36Å; I61-I65 PolarHBondContact O-N 3.4Å; R62-I65 PolarHBondContact O-N 3.11Å; G63-I65 VanDerWaalsContact C-N 3.31Å; G63-I65 PolarHBondContact O-N 3.33Å; I65-W68 PolarHBondContact O-N 2.75Å; I65-Y69 VanDerWaalsContact O-CB 3.28Å; I65-Y69 WeakPolarHBondContact O-CB 3.28Å; I65-Y69 PolarHBondContact O-N 3.13Å
66	E	96.8	Very high	94.4	Very high	93 Å²	93	101.5 Å²	101.5	44%	0.435	48%	0.483	S	S	.	.	H	α-helix	trans	-62.8	-40.5	175.8	-78	172.1	-166.5	0	0	111.7	R62 G63 S70	R62-E66 IonicContact CZ-OE1 3.67Å; R62-E66 IonicContact NE-OE1 2.72Å; R62-E66 PolarHBondContact NE-OE1 3.38Å; R62-E66 IonicContact NH2-OE1 2.67Å; R62-E66 PolarHBondContact NH2-OE1 3.48Å; R62-E66 IonicContact NH2-OE2 3.21Å; R62-E66 PolarHBondContact NH2-OE2 3.44Å; R62-E66 WeakPolarHBondContact O-CB 3.36Å; R62-E66 WeakPolarHBondContact O-CG 3.29Å; R62-E66 PolarHBondContact O-N 2.65Å; G63-E66 PolarHBondContact O-N 2.92Å; E66-S70 WeakPolarHBondContact O-CB 3.35Å; E66-S70 PolarHBondContact O-N 3.41Å; E66-S70 VanDerWaalsContact O-N 3.13Å; E66-S70 PolarHBondContact O-OG 2.89Å
67	T	96.4	Very high	95.1	Very high	80 Å²	80	103.4 Å²	103.4	49%	0.491	49%	0.485	S	S	.	.	H	α-helix	trans	-63.6	-53.4	171.9	-58.3	0	0	0	0	111	G63 Y69 S70 E71	G63-T67 PolarHBondContact O-N 3.33Å; G63-T67 PolarHBondContact O-OG1 2.83Å; G63-T67 VanDerWaalsContact O-OG1 3.08Å; T67-Y69 VanDerWaalsContact C-N 3.31Å; T67-Y69 PolarHBondContact O-N 2.88Å; T67-S70 WeakPolarHBondContact O-CB 3.34Å; T67-S70 PolarHBondContact O-N 3.49Å; T67-E71 HydrophobicContact CG2-CG 4.43Å; T67-E71 PolarHBondContact O-N 3.22Å
68	W	97.6	Very high	95.7	Very high	161 Å²	161	103.2 Å²	103.2	61%	0.61	49%	0.486	S	S	*	.	H	α-helix	trans	-58.2	-41.2	-179.2	-178.1	89.2	0	0	0	112.8	E64 I65 S70 Q72	E64-W68 WeakPolarHBondContact O-CB 3.36Å; E64-W68 PolarHBondContact O-N 3.4Å; I65-W68 PolarHBondContact O-N 2.75Å; W68-S70 VanDerWaalsContact C-N 3.34Å; W68-Q72 HydrophobicContact CH2-CG 4.25Å; W68-Q72 HydrophobicContact CZ3-CB 4.49Å; W68-Q72 VanDerWaalsContact O-CB 3.25Å; W68-Q72 WeakPolarHBondContact O-CB 3.46Å; W68-Q72 PolarHBondContact O-N 2.92Å
69	Y	97.4	Very high	96.2	Very high	157 Å²	157	104.1 Å²	104.1	62%	0.616	49%	0.494	S	S	*	.	H	α-helix	trans	-64.8	-38.9	176.1	178.4	-108.6	0	0	0	112	I65 T67 K73	I65-Y69 VanDerWaalsContact O-CB 3.28Å; I65-Y69 WeakPolarHBondContact O-CB 3.28Å; I65-Y69 PolarHBondContact O-N 3.13Å; T67-Y69 VanDerWaalsContact C-N 3.31Å; T67-Y69 PolarHBondContact O-N 2.88Å; Y69-K73 WeakPolarHBondContact O-CB 3.37Å; Y69-K73 PolarHBondContact O-N 2.88Å
70	S	97.1	Very high	96.5	Very high	71 Å²	71	106.3 Å²	106.3	50%	0.497	50%	0.5	S	S	.	.	H	α-helix	trans	-67.5	-45.7	177.1	-58.9	0	0	0	0	111.9	E66 T67 W68 K73 Q74	E66-S70 WeakPolarHBondContact O-CB 3.35Å; E66-S70 PolarHBondContact O-N 3.41Å; E66-S70 VanDerWaalsContact O-N 3.13Å; E66-S70 PolarHBondContact O-OG 2.89Å; T67-S70 WeakPolarHBondContact O-CB 3.34Å; T67-S70 PolarHBondContact O-N 3.49Å; W68-S70 VanDerWaalsContact C-N 3.34Å; S70-K73 PolarHBondContact O-N 3.08Å; S70-Q74 PolarHBondContact O-N 2.99Å
71	E	97.6	Very high	96.7	Very high	119 Å²	119	106.4 Å²	106.4	56%	0.556	50%	0.502	S	S	*	.	H	α-helix	trans	-59.5	-46.3	173	-71.4	-177.7	174.4	0	0	111.6	T67 K73 Q74 R75	T67-E71 HydrophobicContact CG2-CG 4.43Å; T67-E71 PolarHBondContact O-N 3.22Å; E71-K73 VanDerWaalsContact C-N 3.33Å; E71-K73 PolarHBondContact O-N 3.39Å; E71-Q74 PolarHBondContact O-N 3.36Å; E71-R75 WeakPolarHBondContact O-CB 3.26Å; E71-R75 PolarHBondContact O-N 2.94Å
72	Q	97.8	Very high	96.9	Very high	58 Å²	58	107.5 Å²	107.5	27%	0.271	51%	0.505	S	S	.	.	H	α-helix	trans	-66.7	-34.8	-179.7	-177.4	58.2	23.7	0	0	111.8	W68 I76	W68-Q72 HydrophobicContact CH2-CG 4.25Å; W68-Q72 HydrophobicContact CZ3-CB 4.49Å; W68-Q72 VanDerWaalsContact O-CB 3.25Å; W68-Q72 WeakPolarHBondContact O-CB 3.46Å; W68-Q72 PolarHBondContact O-N 2.92Å; Q72-I76 HydrophobicContact CG-CD1 4.27Å; Q72-I76 WeakPolarHBondContact O-CD1 3.4Å; Q72-I76 VanDerWaalsContact O-CG1 3.25Å; Q72-I76 WeakPolarHBondContact O-CG1 3.49Å; Q72-I76 PolarHBondContact O-N 3.08Å
73	K	97.2	Very high	97.1	Very high	146 Å²	146	108.2 Å²	108.2	64%	0.635	51%	0.511	S	S	*	.	H	α-helix	trans	-63.7	-46.1	170.8	-176.2	-177	177.2	-173.2	0	111.6	Y69 S70 E71 I76 H77	Y69-K73 WeakPolarHBondContact O-CB 3.37Å; Y69-K73 PolarHBondContact O-N 2.88Å; S70-K73 PolarHBondContact O-N 3.08Å; E71-K73 VanDerWaalsContact C-N 3.33Å; E71-K73 PolarHBondContact O-N 3.39Å; K73-I76 PolarHBondContact O-N 3.24Å; K73-H77 PolarHBondContact O-N 3.14Å; K73-H77 VanDerWaalsContact O-N 3.07Å
74	Q	98.1	Very high	97.3	Very high	123 Å²	123	111.4 Å²	111.4	58%	0.575	52%	0.521	S	S	*	.	H	α-helix	trans	-62.3	-42.6	176.5	-172.1	-179.5	11.8	0	0	111.6	S70 E71 I76 H77 I78	S70-Q74 PolarHBondContact O-N 2.99Å; E71-Q74 PolarHBondContact O-N 3.36Å; Q74-I76 PolarHBondContact O-N 3.18Å; Q74-H77 WeakPolarHBondContact O-CB 3.11Å; Q74-H77 PolarHBondContact O-N 3.09Å; Q74-I78 HydrophobicContact CG-CD1 4.04Å; Q74-I78 WeakPolarHBondContact O-CG1 3.38Å; Q74-I78 PolarHBondContact O-N 3.43Å
75	R	96.9	Very high	97.3	Very high	156 Å²	156	110.5 Å²	110.5	59%	0.589	52%	0.52	S	S	*	.	H	α-helix	trans	-60.7	-42.5	176.2	-172.7	-177.8	-175.9	-174.8	4.9	112.5	E71 H77 L79	E71-R75 WeakPolarHBondContact O-CB 3.26Å; E71-R75 PolarHBondContact O-N 2.94Å; R75-H77 VanDerWaalsContact C-N 3.34Å; R75-L79 HydrophobicContact CG-CD1 4.14Å; R75-L79 WeakPolarHBondContact O-CB 3.3Å; R75-L79 VanDerWaalsContact O-CG 3.25Å; R75-L79 WeakPolarHBondContact O-CG 3.39Å; R75-L79 PolarHBondContact O-N 3.37Å
76	I	97	Very high	97.3	Very high	98 Å²	98	107.5 Å²	107.5	50%	0.503	51%	0.507	S	S	.	.	H	α-helix	trans	-63.8	-40.3	175.3	-71.1	165.6	0	0	0	110.8	Q72 K73 Q74 L79 H80	Q72-I76 HydrophobicContact CG-CD1 4.27Å; Q72-I76 WeakPolarHBondContact O-CD1 3.4Å; Q72-I76 VanDerWaalsContact O-CG1 3.25Å; Q72-I76 WeakPolarHBondContact O-CG1 3.49Å; Q72-I76 PolarHBondContact O-N 3.08Å; K73-I76 PolarHBondContact O-N 3.24Å; Q74-I76 PolarHBondContact O-N 3.18Å; I76-L79 PolarHBondContact O-N 2.87Å; I76-H80 WeakPolarHBondContact O-CB 3.3Å; I76-H80 PolarHBondContact O-N 3.42Å
77	H	98	Very high	97.3	Very high	120 Å²	120	107.8 Å²	107.8	56%	0.556	51%	0.51	S	S	*	.	H	α-helix	trans	-62.5	-49.8	177.2	-178.4	49.7	0	0	0	112.2	K73 Q74 R75 L79 H80 E81	K73-H77 PolarHBondContact O-N 3.14Å; K73-H77 VanDerWaalsContact O-N 3.07Å; Q74-H77 WeakPolarHBondContact O-CB 3.11Å; Q74-H77 PolarHBondContact O-N 3.09Å; R75-H77 VanDerWaalsContact C-N 3.34Å; H77-L79 VanDerWaalsContact C-N 3.34Å; H77-L79 PolarHBondContact O-N 3.06Å; H77-H80 WeakPolarHBondContact O-CB 3.29Å; H77-H80 PolarHBondContact O-N 2.66Å; H77-H80 VanDerWaalsContact O-N 3.1Å; H77-E81 PolarHBondContact O-N 2.96Å
78	I	97.7	Very high	97.3	Very high	89 Å²	89	111.6 Å²	111.6	46%	0.456	52%	0.517	S	S	.	.	H	α-helix	trans	-60.6	-41.6	176.9	-65.1	164.6	0	0	0	111.4	Q74 H80 E81 H82	Q74-I78 HydrophobicContact CG-CD1 4.04Å; Q74-I78 WeakPolarHBondContact O-CG1 3.38Å; Q74-I78 PolarHBondContact O-N 3.43Å; I78-H80 VanDerWaalsContact C-N 3.3Å; I78-H80 PolarHBondContact O-N 2.85Å; I78-E81 PolarHBondContact O-N 3.41Å; I78-H82 WeakPolarHBondContact O-CB 3.33Å; I78-H82 PolarHBondContact O-N 3.22Å
79	L	96.9	Very high	97.3	Very high	105 Å²	105	108 Å²	108	55%	0.55	50%	0.503	S	S	.	.	H	α-helix	trans	-66.3	-30.8	176.5	-74.9	170.5	0	0	0	112.9	R75 I76 H77 K83	R75-L79 HydrophobicContact CG-CD1 4.14Å; R75-L79 WeakPolarHBondContact O-CB 3.3Å; R75-L79 VanDerWaalsContact O-CG 3.25Å; R75-L79 WeakPolarHBondContact O-CG 3.39Å; R75-L79 PolarHBondContact O-N 3.37Å; I76-L79 PolarHBondContact O-N 2.87Å; H77-L79 VanDerWaalsContact C-N 3.34Å; H77-L79 PolarHBondContact O-N 3.06Å; L79-K83 VanDerWaalsContact O-CB 3.27Å; L79-K83 WeakPolarHBondContact O-CB 3.45Å; L79-K83 PolarHBondContact O-N 3.16Å
80	H	97.9	Very high	97.2	Very high	109 Å²	109	104.5 Å²	104.5	51%	0.505	49%	0.492	S	S	.	.	H	α-helix	trans	-72.4	-47.2	175.1	179.8	-94.2	0	0	0	111.5	I76 H77 I78 K83 L84	I76-H80 WeakPolarHBondContact O-CB 3.3Å; I76-H80 PolarHBondContact O-N 3.42Å; H77-H80 WeakPolarHBondContact O-CB 3.29Å; H77-H80 PolarHBondContact O-N 2.66Å; H77-H80 VanDerWaalsContact O-N 3.1Å; I78-H80 VanDerWaalsContact C-N 3.3Å; I78-H80 PolarHBondContact O-N 2.85Å; H80-K83 WeakPolarHBondContact O-CB 3.25Å; H80-K83 PolarHBondContact O-N 2.78Å; H80-L84 PolarHBondContact O-N 3.1Å
81	E	97.3	Very high	97.3	Very high	105 Å²	105	108.6 Å²	108.6	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-58.3	-54.5	176.3	-174.5	173.6	-135.7	0	0	111.6	H77 I78 K83 L84 D85	H77-E81 PolarHBondContact O-N 2.96Å; I78-E81 PolarHBondContact O-N 3.41Å; E81-K83 PolarHBondContact O-N 3.2Å; E81-K83 VanDerWaalsContact O-N 3.12Å; E81-L84 WeakPolarHBondContact O-CA 3.42Å; E81-L84 WeakPolarHBondContact O-CB 3.41Å; E81-L84 PolarHBondContact O-N 3.06Å; E81-D85 PolarHBondContact O-N 2.97Å
82	H	98	Very high	97.3	Very high	107 Å²	107	105.2 Å²	105.2	50%	0.495	49%	0.485	S	S	.	.	H	α-helix	trans	-58.3	-29.6	176.1	174.2	-93.4	0	0	0	113.5	I78 T86	I78-H82 WeakPolarHBondContact O-CB 3.33Å; I78-H82 PolarHBondContact O-N 3.22Å; H82-T86 VanDerWaalsContact O-CB 3.3Å; H82-T86 WeakPolarHBondContact O-CB 3.47Å; H82-T86 PolarHBondContact O-N 2.89Å; H82-T86 PolarHBondContact O-OG1 2.83Å
83	K	96.2	Very high	97.3	Very high	135 Å²	135	107.1 Å²	107.1	59%	0.587	49%	0.493	S	S	*	.	H	α-helix	trans	-72.3	-40.2	174.3	-175.5	-177.8	177	-172	0	111.5	L79 H80 E81 T86 I87	L79-K83 VanDerWaalsContact O-CB 3.27Å; L79-K83 WeakPolarHBondContact O-CB 3.45Å; L79-K83 PolarHBondContact O-N 3.16Å; H80-K83 WeakPolarHBondContact O-CB 3.25Å; H80-K83 PolarHBondContact O-N 2.78Å; E81-K83 PolarHBondContact O-N 3.2Å; E81-K83 VanDerWaalsContact O-N 3.12Å; K83-T86 PolarHBondContact O-N 3.17Å; K83-I87 HydrophobicContact CG-CD1 4.11Å; K83-I87 VanDerWaalsContact O-CG1 3.31Å; K83-I87 WeakPolarHBondContact O-CG1 3.39Å; K83-I87 PolarHBondContact O-N 2.89Å
84	L	97.4	Very high	97.3	Very high	93 Å²	93	106.2 Å²	106.2	49%	0.487	49%	0.491	S	S	.	.	H	α-helix	trans	-63.4	-48.4	173.1	-68.7	178.2	0	0	0	111.1	H80 E81 T86 I87 Y88	H80-L84 PolarHBondContact O-N 3.1Å; E81-L84 WeakPolarHBondContact O-CA 3.42Å; E81-L84 WeakPolarHBondContact O-CB 3.41Å; E81-L84 PolarHBondContact O-N 3.06Å; L84-T86 PolarHBondContact O-N 3.4Å; L84-I87 PolarHBondContact O-N 3.31Å; L84-I87 VanDerWaalsContact O-N 3.1Å; L84-Y88 WeakPolarHBondContact O-CB 3.43Å; L84-Y88 PolarHBondContact O-N 3.43Å
85	D	97.3	Very high	97.3	Very high	92 Å²	92	102 Å²	102	49%	0.492	48%	0.478	S	S	.	.	H	α-helix	trans	-56.4	-38.5	175.8	-74.5	-15.6	0	0	0	112.3	E81 R89	E81-D85 PolarHBondContact O-N 2.97Å; D85-R89 WeakPolarHBondContact O-CB 3.11Å; D85-R89 PolarHBondContact O-N 3.34Å
86	T	96.6	Very high	97.4	Very high	41 Å²	41	99 Å²	99	25%	0.252	47%	0.47	S	S	.	.	H	α-helix	trans	-67.8	-46	176.3	-67.5	0	0	0	0	111.8	H82 K83 L84 Y88 R89 E90	H82-T86 VanDerWaalsContact O-CB 3.3Å; H82-T86 WeakPolarHBondContact O-CB 3.47Å; H82-T86 PolarHBondContact O-N 2.89Å; H82-T86 PolarHBondContact O-OG1 2.83Å; K83-T86 PolarHBondContact O-N 3.17Å; L84-T86 PolarHBondContact O-N 3.4Å; T86-Y88 PolarHBondContact O-N 2.89Å; T86-R89 PolarHBondContact O-N 3.13Å; T86-R89 PolarHBondContact OG1-NH2 3.19Å; T86-E90 WeakPolarHBondContact O-CG 3.48Å; T86-E90 PolarHBondContact O-N 3.11Å; T86-E90 VanDerWaalsContact O-N 3.07Å
87	I	96.5	Very high	97.4	Very high	98 Å²	98	95.7 Å²	95.7	50%	0.503	46%	0.457	S	S	.	.	H	α-helix	trans	-61.7	-44.6	176	-68.8	163.6	0	0	0	110.7	K83 L84 E90 Y91	K83-I87 HydrophobicContact CG-CD1 4.11Å; K83-I87 VanDerWaalsContact O-CG1 3.31Å; K83-I87 WeakPolarHBondContact O-CG1 3.39Å; K83-I87 PolarHBondContact O-N 2.89Å; L84-I87 PolarHBondContact O-N 3.31Å; L84-I87 VanDerWaalsContact O-N 3.1Å; I87-E90 PolarHBondContact O-N 3.09Å; I87-Y91 WeakPolarHBondContact O-CB 3.35Å; I87-Y91 PolarHBondContact O-N 2.73Å
88	Y	97.3	Very high	97.3	Very high	160 Å²	160	93.5 Å²	93.5	63%	0.627	46%	0.455	S	S	*	.	H	α-helix	trans	-63.5	-45.6	179.8	-175.2	-100.2	0	0	0	112.1	L84 T86 E90 Y91 T92	L84-Y88 WeakPolarHBondContact O-CB 3.43Å; L84-Y88 PolarHBondContact O-N 3.43Å; T86-Y88 PolarHBondContact O-N 2.89Å; Y88-E90 PolarHBondContact O-N 2.85Å; Y88-Y91 WeakPolarHBondContact O-CB 3.39Å; Y88-Y91 PolarHBondContact O-N 3.07Å; Y88-T92 PolarHBondContact O-N 3.04Å; Y88-T92 PolarHBondContact O-OG1 2.93Å
89	R	97.1	Very high	97.4	Very high	86 Å²	86	94.8 Å²	94.8	33%	0.325	46%	0.462	S	S	.	.	H	α-helix	trans	-62.1	-43.3	177.2	178.6	-177	60.9	-112.3	3.1	112.8	D85 T86 T92 K93	D85-R89 WeakPolarHBondContact O-CB 3.11Å; D85-R89 PolarHBondContact O-N 3.34Å; T86-R89 PolarHBondContact O-N 3.13Å; T86-R89 PolarHBondContact OG1-NH2 3.19Å; R89-T92 PolarHBondContact O-N 2.74Å; R89-K93 WeakPolarHBondContact O-CG 3.45Å; R89-K93 PolarHBondContact O-N 2.92Å; R89-K93 VanDerWaalsContact O-N 3.15Å
90	E	96.5	Very high	97.4	Very high	84 Å²	84	96.3 Å²	96.3	39%	0.393	46%	0.461	S	S	.	.	H	α-helix	trans	-71.3	-34.5	177.2	-55.7	-41.6	118.3	0	0	111.7	T86 I87 Y88 K93 E94	T86-E90 WeakPolarHBondContact O-CG 3.48Å; T86-E90 PolarHBondContact O-N 3.11Å; T86-E90 VanDerWaalsContact O-N 3.07Å; I87-E90 PolarHBondContact O-N 3.09Å; Y88-E90 PolarHBondContact O-N 2.85Å; E90-K93 PolarHBondContact O-N 3.3Å; E90-K93 IonicContact OE1-NZ 2.8Å; E90-K93 PolarHBondContact OE1-NZ 2.87Å; E90-K93 VanDerWaalsContact OE2-CD 3.3Å; E90-K93 WeakPolarHBondContact OE2-CD 3.47Å; E90-K93 IonicContact OE2-NZ 2.72Å; E90-K93 PolarHBondContact OE2-NZ 3.37Å; E90-E94 WeakPolarHBondContact O-CB 3.5Å; E90-E94 PolarHBondContact O-N 2.8Å
91	Y	98.2	Very high	97.3	Very high	157 Å²	157	96.3 Å²	96.3	62%	0.616	47%	0.465	S	S	*	.	H	α-helix	trans	-58.8	-47.2	170	164	-96.7	0	0	0	112.4	I87 Y88 K93 E94 A95	I87-Y91 WeakPolarHBondContact O-CB 3.35Å; I87-Y91 PolarHBondContact O-N 2.73Å; Y88-Y91 WeakPolarHBondContact O-CB 3.39Å; Y88-Y91 PolarHBondContact O-N 3.07Å; Y91-K93 PolarHBondContact O-N 3.12Å; Y91-E94 PolarHBondContact O-N 3.31Å; Y91-A95 PolarHBondContact O-N 2.89Å
92	T	98	Very high	97.3	Very high	47 Å²	47	95.1 Å²	95.1	29%	0.288	47%	0.467	S	S	.	.	H	α-helix	trans	-62.9	-42.2	178.7	-59.2	0	0	0	0	111.8	Y88 R89 E94 A95 E96	Y88-T92 PolarHBondContact O-N 3.04Å; Y88-T92 PolarHBondContact O-OG1 2.93Å; R89-T92 PolarHBondContact O-N 2.74Å; T92-E94 VanDerWaalsContact C-N 3.33Å; T92-E94 PolarHBondContact O-N 2.89Å; T92-A95 PolarHBondContact O-N 3.44Å; T92-E96 WeakPolarHBondContact O-CG 3.22Å; T92-E96 PolarHBondContact O-N 3.14Å
93	K	97.8	Very high	97.3	Very high	98 Å²	98	94 Å²	94	43%	0.426	46%	0.462	S	S	.	.	H	α-helix	trans	-59.2	-42.4	174.6	-72	169.7	-178.5	172.1	0	112.7	R89 E90 Y91 A97	R89-K93 WeakPolarHBondContact O-CG 3.45Å; R89-K93 PolarHBondContact O-N 2.92Å; R89-K93 VanDerWaalsContact O-N 3.15Å; E90-K93 PolarHBondContact O-N 3.3Å; E90-K93 IonicContact OE1-NZ 2.8Å; E90-K93 PolarHBondContact OE1-NZ 2.87Å; E90-K93 VanDerWaalsContact OE2-CD 3.3Å; E90-K93 WeakPolarHBondContact OE2-CD 3.47Å; E90-K93 IonicContact OE2-NZ 2.72Å; E90-K93 PolarHBondContact OE2-NZ 3.37Å; Y91-K93 PolarHBondContact O-N 3.12Å; K93-A97 WeakPolarHBondContact O-CB 3.36Å; K93-A97 PolarHBondContact O-N 2.91Å
94	E	97.5	Very high	97.4	Very high	127 Å²	127	92.9 Å²	92.9	59%	0.593	46%	0.458	S	S	*	.	H	α-helix	trans	-68.6	-42.4	-179.6	-170.4	65.7	-168.6	0	0	111.2	E90 Y91 T92 A97 C98	E90-E94 WeakPolarHBondContact O-CB 3.5Å; E90-E94 PolarHBondContact O-N 2.8Å; Y91-E94 PolarHBondContact O-N 3.31Å; T92-E94 VanDerWaalsContact C-N 3.33Å; T92-E94 PolarHBondContact O-N 2.89Å; E94-A97 WeakPolarHBondContact O-CB 3.23Å; E94-A97 PolarHBondContact O-N 3.35Å; E94-A97 VanDerWaalsContact O-N 3.11Å; E94-C98 PolarHBondContact O-N 2.88Å
95	A	98.3	Very high	97.4	Very high	36 Å²	36	92.1 Å²	92.1	30%	0.298	45%	0.452	S	S	.	.	H	α-helix	trans	-59.3	-48.7	173.7	0	0	0	0	0	111.6	Y91 T92 A97 C98 D99	Y91-A95 PolarHBondContact O-N 2.89Å; T92-A95 PolarHBondContact O-N 3.44Å; A95-A97 PolarHBondContact O-N 3Å; A95-C98 PolarHBondContact O-N 2.89Å; A95-D99 PolarHBondContact O-N 2.87Å
96	E	98.2	Very high	97.5	Very high	93 Å²	93	92.1 Å²	92.1	44%	0.435	45%	0.448	S	S	.	.	H	α-helix	trans	-61.2	-32.2	174	-70	179.2	-163.6	0	0	113	T92 R100	T92-E96 WeakPolarHBondContact O-CG 3.22Å; T92-E96 PolarHBondContact O-N 3.14Å; E96-R100 VanDerWaalsContact C-NH2 3.34Å; E96-R100 WeakPolarHBondContact O-CB 3.45Å; E96-R100 VanDerWaalsContact O-CG 3.26Å; E96-R100 WeakPolarHBondContact O-CG 3.48Å; E96-R100 PolarHBondContact O-N 3.4Å; E96-R100 PolarHBondContact O-NE 3.39Å; E96-R100 IonicContact OE2-CZ 2.87Å; E96-R100 IonicContact OE2-NH1 2.7Å; E96-R100 PolarHBondContact OE2-NH1 2.89Å; E96-R100 IonicContact OE2-NH2 2.75Å
97	A	96.4	Very high	97.5	Very high	28 Å²	28	96.8 Å²	96.8	23%	0.231	46%	0.461	C	S	.	.	H	α-helix	trans	-68.9	-46.4	176.8	0	0	0	0	0	110.8	K93 E94 A95 D99 R100 D101	K93-A97 WeakPolarHBondContact O-CB 3.36Å; K93-A97 PolarHBondContact O-N 2.91Å; E94-A97 WeakPolarHBondContact O-CB 3.23Å; E94-A97 PolarHBondContact O-N 3.35Å; E94-A97 VanDerWaalsContact O-N 3.11Å; A95-A97 PolarHBondContact O-N 3Å; A97-D99 VanDerWaalsContact C-N 3.33Å; A97-D99 PolarHBondContact O-N 3.23Å; A97-R100 VanDerWaalsContact N-NH2 3.2Å; A97-R100 PolarHBondContact O-N 2.95Å; A97-D101 WeakPolarHBondContact O-CB 3.49Å; A97-D101 PolarHBondContact O-N 2.87Å
98	C	97.5	Very high	97.6	Very high	74 Å²	74	98 Å²	98	50%	0.5	46%	0.459	S	S	.	.	H	α-helix	trans	-57.4	-42.7	172.9	-73.2	0	0	0	0	112.5	E94 A95 D101 C102	E94-C98 PolarHBondContact O-N 2.88Å; A95-C98 PolarHBondContact O-N 2.89Å; C98-D101 PolarHBondContact O-N 2.97Å; C98-C102 WeakPolarHBondContact O-CB 3.32Å; C98-C102 PolarHBondContact O-N 2.97Å
99	D	97.7	Very high	97.7	Very high	115 Å²	115	93.8 Å²	93.8	62%	0.615	45%	0.447	S	S	*	.	H	α-helix	trans	-64.9	-43	176.7	-78.1	-19.4	0	0	0	112.2	A95 A97 C102 E103	A95-D99 PolarHBondContact O-N 2.87Å; A97-D99 VanDerWaalsContact C-N 3.33Å; A97-D99 PolarHBondContact O-N 3.23Å; D99-C102 PolarHBondContact O-N 2.91Å; D99-E103 PolarHBondContact O-N 3.25Å
100	R	97.3	Very high	97.7	Very high	137 Å²	137	94.9 Å²	94.9	52%	0.517	46%	0.456	S	S	.	.	H	α-helix	trans	-61.7	-44.8	175.5	-77.1	179.8	-67.6	-108.6	-2.3	111.9	E96 A97 H104	E96-R100 VanDerWaalsContact C-NH2 3.34Å; E96-R100 WeakPolarHBondContact O-CB 3.45Å; E96-R100 VanDerWaalsContact O-CG 3.26Å; E96-R100 WeakPolarHBondContact O-CG 3.48Å; E96-R100 PolarHBondContact O-N 3.4Å; E96-R100 PolarHBondContact O-NE 3.39Å; E96-R100 IonicContact OE2-CZ 2.87Å; E96-R100 IonicContact OE2-NH1 2.7Å; E96-R100 PolarHBondContact OE2-NH1 2.89Å; E96-R100 IonicContact OE2-NH2 2.75Å; A97-R100 VanDerWaalsContact N-NH2 3.2Å; A97-R100 PolarHBondContact O-N 2.95Å; R100-H104 VanDerWaalsContact O-CB 3.28Å; R100-H104 WeakPolarHBondContact O-CB 3.48Å; R100-H104 PolarHBondContact O-N 3.18Å
101	D	96.9	Very high	97.8	Very high	110 Å²	110	93.9 Å²	93.9	59%	0.588	46%	0.462	S	S	*	.	H	α-helix	trans	-70.4	-36.4	-179.9	-76.3	-6.9	0	0	0	111.9	A97 C98 H104 E105	A97-D101 WeakPolarHBondContact O-CB 3.49Å; A97-D101 PolarHBondContact O-N 2.87Å; C98-D101 PolarHBondContact O-N 2.97Å; D101-H104 PolarHBondContact O-N 3.08Å; D101-E105 WeakPolarHBondContact O-CB 3.19Å; D101-E105 PolarHBondContact O-N 2.86Å
102	C	97.4	Very high	97.8	Very high	79 Å²	79	93 Å²	93	53%	0.534	46%	0.458	S	S	.	.	H	α-helix	trans	-60.7	-51	172.8	-174.7	0	0	0	0	111.7	C98 D99 H104 E105 K106	C98-C102 WeakPolarHBondContact O-CB 3.32Å; C98-C102 PolarHBondContact O-N 2.97Å; D99-C102 PolarHBondContact O-N 2.91Å; C102-H104 VanDerWaalsContact C-N 3.3Å; C102-H104 PolarHBondContact O-N 3.11Å; C102-E105 PolarHBondContact O-N 3.47Å; C102-K106 WeakPolarHBondContact O-CB 3.3Å; C102-K106 PolarHBondContact O-N 3.28Å
103	E	98	Very high	97.8	Very high	83 Å²	83	94.1 Å²	94.1	39%	0.388	46%	0.462	S	S	.	.	H	α-helix	trans	-67.6	-29.2	176.3	-75.8	-62.3	127.7	0	0	112.8	D99 K106 R107	D99-E103 PolarHBondContact O-N 3.25Å; E103-K106 VanDerWaalsContact OE1-CD 3.22Å; E103-K106 WeakPolarHBondContact OE1-CD 3.44Å; E103-K106 WeakPolarHBondContact OE1-CE 3.43Å; E103-K106 IonicContact OE1-NZ 3.27Å; E103-K106 PolarHBondContact OE1-NZ 3.08Å; E103-K106 WeakPolarHBondContact OE2-CD 3.41Å; E103-K106 IonicContact OE2-NZ 2.99Å; E103-K106 PolarHBondContact OE2-NZ 3.04Å; E103-R107 VanDerWaalsContact O-CB 3.27Å; E103-R107 WeakPolarHBondContact O-CB 3.37Å; E103-R107 PolarHBondContact O-N 2.94Å; E103-R107 VanDerWaalsContact O-N 3.11Å; E103-R107 PolarHBondContact O-NH1 2.79Å
104	H	97.8	Very high	97.8	Very high	112 Å²	112	93.5 Å²	93.5	52%	0.519	47%	0.466	S	S	.	.	H	α-helix	trans	-67.6	-48.5	172.6	-179.3	-95.4	0	0	0	111.9	R100 D101 C102 R107 R108	R100-H104 VanDerWaalsContact O-CB 3.28Å; R100-H104 WeakPolarHBondContact O-CB 3.48Å; R100-H104 PolarHBondContact O-N 3.18Å; D101-H104 PolarHBondContact O-N 3.08Å; C102-H104 VanDerWaalsContact C-N 3.3Å; C102-H104 PolarHBondContact O-N 3.11Å; H104-R107 WeakPolarHBondContact O-CB 3.32Å; H104-R107 PolarHBondContact O-N 3.37Å; H104-R108 PolarHBondContact O-N 3.02Å
105	E	98	Very high	97.8	Very high	78 Å²	78	90.4 Å²	90.4	36%	0.364	46%	0.459	S	S	.	.	H	α-helix	trans	-66.3	-42.3	179.5	178.6	57.4	-165.4	0	0	111.9	D101 C102 R107 R108 I109	D101-E105 WeakPolarHBondContact O-CB 3.19Å; D101-E105 PolarHBondContact O-N 2.86Å; C102-E105 PolarHBondContact O-N 3.47Å; E105-R107 VanDerWaalsContact C-N 3.32Å; E105-R107 PolarHBondContact O-N 3.41Å; E105-R108 WeakPolarHBondContact O-CB 3.46Å; E105-R108 PolarHBondContact O-N 2.81Å; E105-R108 VanDerWaalsContact O-N 3.15Å; E105-R108 IonicContact OE1-CZ 3.12Å; E105-R108 IonicContact OE1-NE 3.96Å; E105-R108 PolarHBondContact OE1-NE 3.49Å; E105-R108 IonicContact OE1-NH2 2.7Å; E105-R108 PolarHBondContact OE1-NH2 3.19Å; E105-R108 WeakPolarHBondContact OE2-CD 3.42Å; E105-R108 IonicContact OE2-CZ 3.15Å; E105-R108 IonicContact OE2-NE 2.79Å; E105-R108 PolarHBondContact OE2-NE 3.07Å; E105-R108 IonicContact OE2-NH2 2.72Å; E105-I109 HydrophobicContact CG-CD1 4.09Å; E105-I109 WeakPolarHBondContact O-CG1 3.25Å; E105-I109 PolarHBondContact O-N 2.9Å
106	K	98.2	Very high	97.7	Very high	92 Å²	92	91.1 Å²	91.1	40%	0.4	46%	0.457	S	S	.	.	H	α-helix	trans	-52.9	-47.4	169.7	176.9	-169.1	176.4	-165.1	0	111.7	C102 E103 I109 Q110	C102-K106 WeakPolarHBondContact O-CB 3.3Å; C102-K106 PolarHBondContact O-N 3.28Å; E103-K106 VanDerWaalsContact OE1-CD 3.22Å; E103-K106 WeakPolarHBondContact OE1-CD 3.44Å; E103-K106 WeakPolarHBondContact OE1-CE 3.43Å; E103-K106 IonicContact OE1-NZ 3.27Å; E103-K106 PolarHBondContact OE1-NZ 3.08Å; E103-K106 WeakPolarHBondContact OE2-CD 3.41Å; E103-K106 IonicContact OE2-NZ 2.99Å; E103-K106 PolarHBondContact OE2-NZ 3.04Å; K106-I109 PolarHBondContact O-N 3.45Å; K106-Q110 VanDerWaalsContact O-CG 3.31Å; K106-Q110 WeakPolarHBondContact O-CG 3.48Å; K106-Q110 PolarHBondContact O-N 3.47Å
107	R	98.1	Very high	97.7	Very high	138 Å²	138	90.7 Å²	90.7	52%	0.521	46%	0.463	S	S	.	.	H	α-helix	trans	-67	-37.5	177.1	-167.5	-178.6	-57.8	102.2	8	112.3	E103 H104 E105 Q110 A111	E103-R107 VanDerWaalsContact O-CB 3.27Å; E103-R107 WeakPolarHBondContact O-CB 3.37Å; E103-R107 PolarHBondContact O-N 2.94Å; E103-R107 VanDerWaalsContact O-N 3.11Å; E103-R107 PolarHBondContact O-NH1 2.79Å; H104-R107 WeakPolarHBondContact O-CB 3.32Å; H104-R107 PolarHBondContact O-N 3.37Å; E105-R107 VanDerWaalsContact C-N 3.32Å; E105-R107 PolarHBondContact O-N 3.41Å; R107-Q110 PolarHBondContact O-N 2.97Å; R107-A111 WeakPolarHBondContact O-CB 3.42Å; R107-A111 PolarHBondContact O-N 2.76Å
108	R	98.2	Very high	97.7	Very high	123 Å²	123	94.3 Å²	94.3	46%	0.464	48%	0.476	S	S	.	.	H	α-helix	trans	-62.2	-44.9	174.5	-168.3	-161.8	67.6	73	0.2	111.5	H104 E105 A111 Y112	H104-R108 PolarHBondContact O-N 3.02Å; E105-R108 WeakPolarHBondContact O-CB 3.46Å; E105-R108 PolarHBondContact O-N 2.81Å; E105-R108 VanDerWaalsContact O-N 3.15Å; E105-R108 IonicContact OE1-CZ 3.12Å; E105-R108 IonicContact OE1-NE 3.96Å; E105-R108 PolarHBondContact OE1-NE 3.49Å; E105-R108 IonicContact OE1-NH2 2.7Å; E105-R108 PolarHBondContact OE1-NH2 3.19Å; E105-R108 WeakPolarHBondContact OE2-CD 3.42Å; E105-R108 IonicContact OE2-CZ 3.15Å; E105-R108 IonicContact OE2-NE 2.79Å; E105-R108 PolarHBondContact OE2-NE 3.07Å; E105-R108 IonicContact OE2-NH2 2.72Å; R108-A111 PolarHBondContact O-N 3.22Å; R108-Y112 WeakPolarHBondContact O-CB 3.45Å; R108-Y112 PolarHBondContact O-N 3.44Å
109	I	98.2	Very high	97.7	Very high	73 Å²	73	93.3 Å²	93.3	37%	0.374	46%	0.463	S	S	.	.	H	α-helix	trans	-65.3	-44.3	176.9	-67.5	166.8	0	0	0	110.5	E105 K106 A111 Y112 L113	E105-I109 HydrophobicContact CG-CD1 4.09Å; E105-I109 WeakPolarHBondContact O-CG1 3.25Å; E105-I109 PolarHBondContact O-N 2.9Å; K106-I109 PolarHBondContact O-N 3.45Å; I109-A111 PolarHBondContact O-N 2.98Å; I109-Y112 PolarHBondContact O-N 3.34Å; I109-L113 HydrophobicContact CG2-CD1 4.02Å; I109-L113 HydrophobicContact CG2-CG 4.41Å; I109-L113 WeakPolarHBondContact O-CG 3.27Å; I109-L113 PolarHBondContact O-N 3.36Å
110	Q	98.1	Very high	97.7	Very high	109 Å²	109	91.3 Å²	91.3	51%	0.509	45%	0.453	S	S	.	.	H	α-helix	trans	-58	-48.2	175.1	-75	172.9	-12.5	0	0	112	K106 R107 Y112 L113 V114	K106-Q110 VanDerWaalsContact O-CG 3.31Å; K106-Q110 WeakPolarHBondContact O-CG 3.48Å; K106-Q110 PolarHBondContact O-N 3.47Å; R107-Q110 PolarHBondContact O-N 2.97Å; Q110-Y112 VanDerWaalsContact C-N 3.34Å; Q110-Y112 PolarHBondContact O-N 3.12Å; Q110-L113 PolarHBondContact O-N 2.79Å; Q110-V114 WeakPolarHBondContact O-CG2 3.33Å; Q110-V114 PolarHBondContact O-N 2.84Å
111	A	97.6	Very high	97.6	Very high	62 Å²	62	90.6 Å²	90.6	51%	0.512	45%	0.453	S	S	.	.	H	α-helix	trans	-62.1	-39.5	177.6	0	0	0	0	0	112.7	R107 R108 I109 S115	R107-A111 WeakPolarHBondContact O-CB 3.42Å; R107-A111 PolarHBondContact O-N 2.76Å; R108-A111 PolarHBondContact O-N 3.22Å; I109-A111 PolarHBondContact O-N 2.98Å; A111-S115 WeakPolarHBondContact O-CB 3.3Å; A111-S115 PolarHBondContact O-N 2.99Å
112	Y	98.2	Very high	97.5	Very high	140 Å²	140	92.1 Å²	92.1	55%	0.549	45%	0.451	S	S	.	.	H	α-helix	trans	-62.8	-44.6	174.4	173.1	-103.5	0	0	0	112.3	R108 I109 Q110 S115 L116	R108-Y112 WeakPolarHBondContact O-CB 3.45Å; R108-Y112 PolarHBondContact O-N 3.44Å; I109-Y112 PolarHBondContact O-N 3.34Å; Q110-Y112 VanDerWaalsContact C-N 3.34Å; Q110-Y112 PolarHBondContact O-N 3.12Å; Y112-S115 PolarHBondContact O-N 3Å; Y112-L116 HydrophobicContact CE1-CD2 4.46Å; Y112-L116 WeakPolarHBondContact O-CB 3.44Å; Y112-L116 PolarHBondContact O-N 3.47Å
113	L	98.1	Very high	97.3	Very high	69 Å²	69	94.4 Å²	94.4	36%	0.361	45%	0.448	S	S	.	.	H	α-helix	trans	-65.7	-40.9	177.9	-70.1	173.8	0	0	0	112.2	I109 Q110 L116 C117	I109-L113 HydrophobicContact CG2-CD1 4.02Å; I109-L113 HydrophobicContact CG2-CG 4.41Å; I109-L113 WeakPolarHBondContact O-CG 3.27Å; I109-L113 PolarHBondContact O-N 3.36Å; Q110-L113 PolarHBondContact O-N 2.79Å; L113-L116 PolarHBondContact O-N 2.96Å; L113-C117 WeakPolarHBondContact O-CB 3.41Å; L113-C117 PolarHBondContact O-N 3.05Å; L113-C117 PolarHBondContact O-SG 3.16Å; L113-C117 VanDerWaalsContact O-SG 3.34Å
114	V	97.6	Very high	97	Very high	85 Å²	85	96.3 Å²	96.3	52%	0.515	46%	0.46	S	S	.	.	H	α-helix	trans	-59.6	-49.5	173.6	170.7	0	0	0	0	110.6	Q110 L116 C117 E118	Q110-V114 WeakPolarHBondContact O-CG2 3.33Å; Q110-V114 PolarHBondContact O-N 2.84Å; V114-L116 VanDerWaalsContact C-N 3.31Å; V114-L116 PolarHBondContact O-N 2.8Å; V114-C117 PolarHBondContact O-N 3.12Å; V114-E118 WeakPolarHBondContact O-CG 3.45Å; V114-E118 PolarHBondContact O-N 2.92Å
115	S	97.3	Very high	96.7	Very high	63 Å²	63	95.2 Å²	95.2	44%	0.441	46%	0.455	S	S	.	.	H	α-helix	trans	-61.7	-37.5	178.9	-170.2	0	0	0	0	112.9	A111 Y112 E119	A111-S115 WeakPolarHBondContact O-CB 3.3Å; A111-S115 PolarHBondContact O-N 2.99Å; Y112-S115 PolarHBondContact O-N 3Å; S115-E119 WeakPolarHBondContact O-CB 3.5Å; S115-E119 PolarHBondContact O-N 2.97Å
116	L	97.6	Very high	96.3	Very high	51 Å²	51	97.2 Å²	97.2	27%	0.267	47%	0.465	S	S	.	.	H	α-helix	trans	-65.7	-42.4	174.7	-179.4	60.1	0	0	0	112	Y112 L113 V114 E119 L120	Y112-L116 HydrophobicContact CE1-CD2 4.46Å; Y112-L116 WeakPolarHBondContact O-CB 3.44Å; Y112-L116 PolarHBondContact O-N 3.47Å; L113-L116 PolarHBondContact O-N 2.96Å; V114-L116 VanDerWaalsContact C-N 3.31Å; V114-L116 PolarHBondContact O-N 2.8Å; L116-E119 PolarHBondContact O-N 2.89Å; L116-L120 HydrophobicContact CD1-CD1 4.28Å; L116-L120 HydrophobicContact CD1-CG 4.35Å; L116-L120 HydrophobicContact CG-CD1 4.13Å; L116-L120 WeakPolarHBondContact O-CB 3.45Å; L116-L120 VanDerWaalsContact O-CG 3.3Å; L116-L120 WeakPolarHBondContact O-CG 3.42Å; L116-L120 PolarHBondContact O-N 2.75Å
117	C	97.5	Very high	95.8	Very high	83 Å²	83	96.5 Å²	96.5	56%	0.561	47%	0.465	S	S	*	.	H	α-helix	trans	-65.2	-41.6	175.6	-73	0	0	0	0	112.4	L113 V114 L120 K121	L113-C117 WeakPolarHBondContact O-CB 3.41Å; L113-C117 PolarHBondContact O-N 3.05Å; L113-C117 PolarHBondContact O-SG 3.16Å; L113-C117 VanDerWaalsContact O-SG 3.34Å; V114-C117 PolarHBondContact O-N 3.12Å; C117-L120 PolarHBondContact O-N 2.8Å; C117-K121 VanDerWaalsContact O-CB 3.29Å; C117-K121 WeakPolarHBondContact O-CB 3.24Å; C117-K121 PolarHBondContact O-N 3.37Å
118	E	97.2	Very high	95.2	Very high	105 Å²	105	95.6 Å²	95.6	49%	0.491	47%	0.465	S	S	.	.	H	α-helix	trans	-61.8	-42.4	173.7	-72.9	-179.4	170.6	0	0	112.1	V114 K121 R122	V114-E118 WeakPolarHBondContact O-CG 3.45Å; V114-E118 PolarHBondContact O-N 2.92Å; E118-K121 WeakPolarHBondContact O-CB 3.33Å; E118-K121 PolarHBondContact O-N 3.12Å; E118-R122 WeakPolarHBondContact O-CG 3.34Å; E118-R122 PolarHBondContact O-N 2.72Å
119	E	96.9	Very high	94.5	Very high	52 Å²	52	97.5 Å²	97.5	24%	0.243	48%	0.477	C	S	.	.	H	α-helix	trans	-69.7	-40.2	179	175.6	59.6	-171.5	0	0	112.5	S115 L116 K121 R122 R123	S115-E119 WeakPolarHBondContact O-CB 3.5Å; S115-E119 PolarHBondContact O-N 2.97Å; L116-E119 PolarHBondContact O-N 2.89Å; E119-K121 VanDerWaalsContact C-N 3.34Å; E119-R122 PolarHBondContact O-N 2.95Å; E119-R122 IonicContact OE2-CZ 2.79Å; E119-R122 VanDerWaalsContact OE2-CZ 3.27Å; E119-R122 IonicContact OE2-NE 2.62Å; E119-R122 PolarHBondContact OE2-NE 3.29Å; E119-R122 IonicContact OE2-NH2 2.78Å; E119-R122 PolarHBondContact OE2-NH2 2.84Å; E119-R123 VanDerWaalsContact CG-NH2 3.27Å; E119-R123 WeakPolarHBondContact O-CG 3.33Å; E119-R123 PolarHBondContact O-N 3.42Å; E119-R123 IonicContact OE1-CZ 3.95Å; E119-R123 IonicContact OE1-NE 3.6Å; E119-R123 PolarHBondContact OE1-NE 2.84Å; E119-R123 IonicContact OE1-NH2 3.64Å; E119-R123 PolarHBondContact OE1-NH2 3.14Å
120	L	96.7	Very high	93.2	Very high	74 Å²	74	98.3 Å²	98.3	39%	0.387	49%	0.489	S	S	.	.	H	α-helix	trans	-62.8	-41.6	171.9	-73.8	169.7	0	0	0	111.4	L116 C117 R123 L124	L116-L120 HydrophobicContact CD1-CD1 4.28Å; L116-L120 HydrophobicContact CD1-CG 4.35Å; L116-L120 HydrophobicContact CG-CD1 4.13Å; L116-L120 WeakPolarHBondContact O-CB 3.45Å; L116-L120 VanDerWaalsContact O-CG 3.3Å; L116-L120 WeakPolarHBondContact O-CG 3.42Å; L116-L120 PolarHBondContact O-N 2.75Å; C117-L120 PolarHBondContact O-N 2.8Å; L120-R123 PolarHBondContact O-N 2.86Å; L120-L124 WeakPolarHBondContact O-CG 2.97Å; L120-L124 PolarHBondContact O-N 2.94Å
121	K	96.4	Very high	91.7	Very high	122 Å²	122	98.4 Å²	98.4	53%	0.53	49%	0.491	S	S	.	.	H	α-helix	trans	-59.8	-48.7	173.4	179.2	-179.4	174.8	-176.9	0	111.6	C117 E118 E119 R123 L124 E125	C117-K121 VanDerWaalsContact O-CB 3.29Å; C117-K121 WeakPolarHBondContact O-CB 3.24Å; C117-K121 PolarHBondContact O-N 3.37Å; E118-K121 WeakPolarHBondContact O-CB 3.33Å; E118-K121 PolarHBondContact O-N 3.12Å; E119-K121 VanDerWaalsContact C-N 3.34Å; K121-R123 VanDerWaalsContact C-N 3.27Å; K121-R123 PolarHBondContact O-N 2.81Å; K121-L124 PolarHBondContact O-N 3.02Å; K121-E125 VanDerWaalsContact CE-CD 3.47Å; K121-E125 WeakPolarHBondContact CE-OE1 3.39Å; K121-E125 HydrophobicContact CG-CG 4.4Å; K121-E125 IonicContact NZ-OE1 3.85Å; K121-E125 WeakPolarHBondContact O-CB 3.27Å; K121-E125 WeakPolarHBondContact O-CG 3.37Å; K121-E125 PolarHBondContact O-N 2.97Å
122	R	95.2	Very high	89.5	Confident	142 Å²	142	101.5 Å²	101.5	54%	0.536	50%	0.495	S	S	.	.	H	α-helix	trans	-56.1	-40.1	176.2	-77.3	-166.3	-65.2	-117.5	3.3	112.5	E118 E119 H126	E118-R122 WeakPolarHBondContact O-CG 3.34Å; E118-R122 PolarHBondContact O-N 2.72Å; E119-R122 PolarHBondContact O-N 2.95Å; E119-R122 IonicContact OE2-CZ 2.79Å; E119-R122 VanDerWaalsContact OE2-CZ 3.27Å; E119-R122 IonicContact OE2-NE 2.62Å; E119-R122 PolarHBondContact OE2-NE 3.29Å; E119-R122 IonicContact OE2-NH2 2.78Å; E119-R122 PolarHBondContact OE2-NH2 2.84Å; R122-H126 WeakPolarHBondContact O-CB 3.5Å; R122-H126 PolarHBondContact O-N 2.85Å
123	R	92.8	Very high	87.4	Confident	127 Å²	127	102.4 Å²	102.4	48%	0.479	51%	0.509	S	S	.	.	H	α-helix	trans	-67.7	-48.4	176.8	-68.8	170.2	-167.5	175.1	4.5	111.8	E119 L120 K121 E125 H126 D127	E119-R123 VanDerWaalsContact CG-NH2 3.27Å; E119-R123 WeakPolarHBondContact O-CG 3.33Å; E119-R123 PolarHBondContact O-N 3.42Å; E119-R123 IonicContact OE1-CZ 3.95Å; E119-R123 IonicContact OE1-NE 3.6Å; E119-R123 PolarHBondContact OE1-NE 2.84Å; E119-R123 IonicContact OE1-NH2 3.64Å; E119-R123 PolarHBondContact OE1-NH2 3.14Å; L120-R123 PolarHBondContact O-N 2.86Å; K121-R123 VanDerWaalsContact C-N 3.27Å; K121-R123 PolarHBondContact O-N 2.81Å; R123-E125 VanDerWaalsContact C-N 3.26Å; R123-E125 PolarHBondContact O-N 3.13Å; R123-H126 WeakPolarHBondContact O-CB 3.26Å; R123-H126 PolarHBondContact O-N 3.4Å; R123-H126 VanDerWaalsContact O-N 3.1Å; R123-D127 WeakPolarHBondContact O-CB 2.82Å; R123-D127 PolarHBondContact O-N 3.21Å
124	L	90.9	Very high	85.1	Confident	123 Å²	123	104 Å²	104	64%	0.644	52%	0.521	S	S	*	.	H	α-helix	trans	-60.2	-36.1	176.2	-69.5	170.5	0	0	0	112.4	L120 K121 K128	L120-L124 WeakPolarHBondContact O-CG 2.97Å; L120-L124 PolarHBondContact O-N 2.94Å; K121-L124 PolarHBondContact O-N 3.02Å; L124-K128 VanDerWaalsContact O-CB 3.24Å; L124-K128 WeakPolarHBondContact O-CB 3.4Å; L124-K128 PolarHBondContact O-N 3.46Å
125	E	91.8	Very high	83.1	Confident	88 Å²	88	106.5 Å²	106.5	41%	0.411	54%	0.539	S	S	.	.	H	α-helix	trans	-79	-19.5	177.5	-70.2	171.5	165.9	0	0	113.7	K121 R123 K129	K121-E125 VanDerWaalsContact CE-CD 3.47Å; K121-E125 WeakPolarHBondContact CE-OE1 3.39Å; K121-E125 HydrophobicContact CG-CG 4.4Å; K121-E125 IonicContact NZ-OE1 3.85Å; K121-E125 WeakPolarHBondContact O-CB 3.27Å; K121-E125 WeakPolarHBondContact O-CG 3.37Å; K121-E125 PolarHBondContact O-N 2.97Å; R123-E125 VanDerWaalsContact C-N 3.26Å; R123-E125 PolarHBondContact O-N 3.13Å; E125-K129 WeakPolarHBondContact O-CD 3.25Å; E125-K129 WeakPolarHBondContact O-CE 3.28Å; E125-K129 VanDerWaalsContact O-CG 3.26Å; E125-K129 WeakPolarHBondContact O-CG 3.46Å
126	H	89	Confident	80.8	Confident	121 Å²	121	106.9 Å²	106.9	56%	0.56	54%	0.542	S	S	*	.	H	α-helix	trans	-76.2	-51.2	165.4	168.8	-85.2	0	0	0	110.5	R122 R123 K128 K129 S130	R122-H126 WeakPolarHBondContact O-CB 3.5Å; R122-H126 PolarHBondContact O-N 2.85Å; R123-H126 WeakPolarHBondContact O-CB 3.26Å; R123-H126 PolarHBondContact O-N 3.4Å; R123-H126 VanDerWaalsContact O-N 3.1Å; H126-K128 VanDerWaalsContact C-N 3.34Å; H126-K128 PolarHBondContact O-N 3.43Å; H126-K129 CarbonylContact O-C 3.6Å; H126-K129 WeakPolarHBondContact O-CA 3.38Å; H126-K129 WeakPolarHBondContact O-CB 3.49Å; H126-K129 PolarHBondContact O-N 3.25Å; H126-S130 PolarHBondContact O-N 3.41Å
127	D	88.4	Confident	78.9	Confident	76 Å²	76	108.3 Å²	108.3	41%	0.406	57%	0.569	S	S	.	*	H	α-helix	trans	-67.1	-36.3	-174.7	-63.6	-10.8	0	0	0	111	R123 K129 S130 I131	R123-D127 WeakPolarHBondContact O-CB 2.82Å; R123-D127 PolarHBondContact O-N 3.21Å; D127-K129 PolarHBondContact O-N 3Å; D127-S130 CarbonylContact O-C 3.5Å; D127-S130 WeakPolarHBondContact O-CA 3.29Å; D127-S130 WeakPolarHBondContact O-CB 3.44Å; D127-S130 PolarHBondContact O-N 2.98Å; D127-I131 WeakPolarHBondContact O-CD1 3.19Å; D127-I131 VanDerWaalsContact O-CG1 3.24Å; D127-I131 WeakPolarHBondContact O-CG1 3.27Å; D127-I131 PolarHBondContact O-N 3.01Å
128	K	85.7	Confident	76.5	Confident	119 Å²	119	111.3 Å²	111.3	52%	0.517	58%	0.58	S	S	.	*	H	α-helix	trans	-55	-49.2	168.7	-175.5	-177.6	-179.7	-174.7	0	112	L124 H126 S130 I131 E132	L124-K128 VanDerWaalsContact O-CB 3.24Å; L124-K128 WeakPolarHBondContact O-CB 3.4Å; L124-K128 PolarHBondContact O-N 3.46Å; H126-K128 VanDerWaalsContact C-N 3.34Å; H126-K128 PolarHBondContact O-N 3.43Å; K128-S130 PolarHBondContact O-N 2.99Å; K128-I131 PolarHBondContact O-N 3.4Å; K128-I131 VanDerWaalsContact O-N 3.07Å; K128-E132 WeakPolarHBondContact CE-OE1 3.41Å; K128-E132 WeakPolarHBondContact CE-OE2 3.43Å; K128-E132 IonicContact NZ-OE1 3.56Å; K128-E132 IonicContact NZ-OE2 3.95Å; K128-E132 PolarHBondContact O-N 3.1Å
129	K	83	Confident	74.4	Confident	164 Å²	164	113.4 Å²	113.4	71%	0.713	59%	0.593	S	S	*	*	H	α-helix	trans	-65.3	-23.4	177.4	-67.3	167.8	-169.9	164.4	0	112.6	E125 H126 D127	E125-K129 WeakPolarHBondContact O-CD 3.25Å; E125-K129 WeakPolarHBondContact O-CE 3.28Å; E125-K129 VanDerWaalsContact O-CG 3.26Å; E125-K129 WeakPolarHBondContact O-CG 3.46Å; H126-K129 CarbonylContact O-C 3.6Å; H126-K129 WeakPolarHBondContact O-CA 3.38Å; H126-K129 WeakPolarHBondContact O-CB 3.49Å; H126-K129 PolarHBondContact O-N 3.25Å; D127-K129 PolarHBondContact O-N 3Å
130	S	71.6	Confident	72.5	Confident	90 Å²	90	118 Å²	118	63%	0.629	62%	0.618	S	S	*	*	H	α-helix	trans	-85	-10.6	174.5	-169.2	0	0	0	0	114	H126 D127 K128	H126-S130 PolarHBondContact O-N 3.41Å; D127-S130 CarbonylContact O-C 3.5Å; D127-S130 WeakPolarHBondContact O-CA 3.29Å; D127-S130 WeakPolarHBondContact O-CB 3.44Å; D127-S130 PolarHBondContact O-N 2.98Å; K128-S130 PolarHBondContact O-N 2.99Å
131	I	65.8	Low	70.3	Confident	110 Å²	110	121.5 Å²	121.5	56%	0.564	63%	0.632	S	S	*	*	H	α-helix	trans	-102.6	-36.2	-177.5	-72.9	165.2	0	0	0	111.5	D127 K128 L133	D127-I131 WeakPolarHBondContact O-CD1 3.19Å; D127-I131 VanDerWaalsContact O-CG1 3.24Å; D127-I131 WeakPolarHBondContact O-CG1 3.27Å; D127-I131 PolarHBondContact O-N 3.01Å; K128-I131 PolarHBondContact O-N 3.4Å; K128-I131 VanDerWaalsContact O-N 3.07Å; I131-L133 VanDerWaalsContact C-N 3.35Å; I131-L133 PolarHBondContact O-N 2.75Å
132	E	52.8	Low	68.4	Low	128 Å²	128	124.1 Å²	124.1	60%	0.598	64%	0.644	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	67	-175.2	-69.2	178.9	-177.2	0	0	113.7	K128	K128-E132 WeakPolarHBondContact CE-OE1 3.41Å; K128-E132 WeakPolarHBondContact CE-OE2 3.43Å; K128-E132 IonicContact NZ-OE1 3.56Å; K128-E132 IonicContact NZ-OE2 3.95Å; K128-E132 PolarHBondContact O-N 3.1Å
133	L	53.9	Low	66.6	Low	158 Å²	158	122.9 Å²	122.9	83%	0.827	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134	12.8	169.7	-87.1	-177.1	0	0	0	116	I131	I131-L133 VanDerWaalsContact C-N 3.35Å; I131-L133 PolarHBondContact O-N 2.75Å
134	T	48	Very low	65.1	Low	102 Å²	102	122.2 Å²	122.2	63%	0.626	66%	0.655	S	S	*	*			trans	-126.6	119	170.9	-51	0	0	0	0	110	S136	T134-S136 VanDerWaalsContact C-N 3.29Å
135	P	55.6	Low	63.5	Low	138 Å²	138	120.4 Å²	120.4	90%	0.896	66%	0.658	S	S	*	*	S	Bend	trans	-78.7	-11.1	177.2	31.5	-34.9	0	0	0	113.5
136	S	50.3	Low	62	Low	72 Å²	72	123 Å²	123	50%	0.503	67%	0.673	S	S	.	*	S	Bend	trans	-76	120.4	164.9	-51.6	0	0	0	0	109.4	T134 D138	T134-S136 VanDerWaalsContact C-N 3.29Å; S136-D138 PolarHBondContact O-N 2.8Å
137	G	56.5	Low	60.7	Low	80 Å²	80	122.8 Å²	122.8	83%	0.825	68%	0.68	S	S	*	*			trans	-75.2	44	-176.4	0	0	0	0	0	115.2	I139	G137-I139 PolarHBondContact O-N 2.94Å
138	D	48.8	Very low	59.4	Low	147 Å²	147	130.5 Å²	130.5	79%	0.786	70%	0.704	S	S	*	*			trans	-74.1	99.4	-177.4	-70.9	-27.1	0	0	0	110.7	S136	S136-D138 PolarHBondContact O-N 2.8Å
139	I	53.1	Low	58.3	Low	149 Å²	149	134.3 Å²	134.3	76%	0.764	72%	0.72	S	S	*	*			trans	-69.1	138	-176.5	-158.4	73.5	0	0	0	111.2	G137	G137-I139 PolarHBondContact O-N 2.94Å
140	L	55.2	Low	56.9	Low	149 Å²	149	134.5 Å²	134.5	78%	0.78	73%	0.728	S	S	*	*			trans	59.5	66.3	162.9	-69.8	153.4	0	0	0	117.9
141	E	51.6	Low	56.8	Low	146 Å²	146	141.2 Å²	141.2	68%	0.682	74%	0.74	S	S	*	*			trans	-115.8	64.9	145.2	-150.3	-169.3	-158.8	0	0	113.2	K143	E141-K143 HydrophobicContact CG-CB 4.28Å; E141-K143 PolarHBondContact O-N 3.4Å; E141-K143 IonicContact OE1-NZ 3.39Å; E141-K143 PolarHBondContact OE1-NZ 3.05Å; E141-K143 IonicContact OE2-NZ 3.62Å; E141-K143 PolarHBondContact OE2-NZ 3.37Å
142	F	56.8	Low	56.1	Low	177 Å²	177	147 Å²	147	78%	0.776	75%	0.754	S	S	*	*			trans	-67.9	72.3	156.8	-91.4	-79.5	0	0	0	110	P144	F142-P144 VanDerWaalsContact O-CD 3.26Å; F142-P144 WeakPolarHBondContact O-CD 3.41Å; F142-P144 VanDerWaalsContact O-N 3.16Å
143	K	57.4	Low	56.3	Low	117 Å²	117	151.7 Å²	151.7	51%	0.509	77%	0.767	S	S	.	*			trans	-57.8	115	177.5	-153.3	-175.9	-142.2	75.8	0	108.5	E141 A145 I146	E141-K143 HydrophobicContact CG-CB 4.28Å; E141-K143 PolarHBondContact O-N 3.4Å; E141-K143 IonicContact OE1-NZ 3.39Å; E141-K143 PolarHBondContact OE1-NZ 3.05Å; E141-K143 IonicContact OE2-NZ 3.62Å; E141-K143 PolarHBondContact OE2-NZ 3.37Å; K143-A145 PolarHBondContact O-N 3.25Å; K143-I146 HydrophobicContact CD-CD1 4.47Å
144	P	59.9	Low	56.2	Low	113 Å²	113	148.9 Å²	148.9	73%	0.734	77%	0.766	S	S	*	*			trans	-56.5	126.6	-175.8	-27.2	35.8	0	0	0	110.6	F142 I146	F142-P144 VanDerWaalsContact O-CD 3.26Å; F142-P144 WeakPolarHBondContact O-CD 3.41Å; F142-P144 VanDerWaalsContact O-N 3.16Å; P144-I146 PolarHBondContact O-N 3.41Å; P144-I146 VanDerWaalsContact O-N 3.08Å
145	A	57.7	Low	56.3	Low	85 Å²	85	152.2 Å²	152.2	70%	0.702	78%	0.778	S	S	*	*			trans	-50.6	118.8	-168.4	0	0	0	0	0	111.3	K143 T147	K143-A145 PolarHBondContact O-N 3.25Å; A145-T147 VanDerWaalsContact C-N 3.26Å; A145-T147 PolarHBondContact O-N 3.17Å
146	I	59.9	Low	55.8	Low	142 Å²	142	148.7 Å²	148.7	73%	0.728	77%	0.767	S	S	*	*			trans	-72	83	-170.1	-58.5	179.5	0	0	0	109.8	K143 P144 R148	K143-I146 HydrophobicContact CD-CD1 4.47Å; P144-I146 PolarHBondContact O-N 3.41Å; P144-I146 VanDerWaalsContact O-N 3.08Å; I146-R148 PolarHBondContact O-N 2.94Å
147	T	63.1	Low	55.5	Low	117 Å²	117	148.9 Å²	148.9	72%	0.718	78%	0.78	S	S	*	*			trans	-74.2	97	178.8	47.1	0	0	0	0	109.9	A145 K149	A145-T147 VanDerWaalsContact C-N 3.26Å; A145-T147 PolarHBondContact O-N 3.17Å; T147-K149 PolarHBondContact O-N 2.8Å
148	R	61.3	Low	54.8	Low	237 Å²	237	151.8 Å²	151.8	89%	0.894	78%	0.782	S	S	*	*			trans	-59	101.2	166.7	-83.8	-176.1	157	106.3	-4.1	109.1	I146 L150	I146-R148 PolarHBondContact O-N 2.94Å; R148-L150 PolarHBondContact O-N 2.86Å
149	K	62.7	Low	54.5	Low	199 Å²	199	148.2 Å²	148.2	87%	0.865	78%	0.78	S	S	*	*			trans	-55	111.8	177.9	-78.4	-176.5	175.8	176	0	110.3	T147 R151	T147-K149 PolarHBondContact O-N 2.8Å; K149-R151 PolarHBondContact O-N 2.8Å
150	L	53.1	Low	53.9	Low	168 Å²	168	146.8 Å²	146.8	88%	0.88	78%	0.783	S	S	*	*			trans	-70.6	94.2	175.6	-170.1	73.4	0	0	0	109.7	R148 R152	R148-L150 PolarHBondContact O-N 2.86Å; L150-R152 PolarHBondContact O-N 3.03Å
151	R	68.7	Low	53.4	Low	231 Å²	231	142.4 Å²	142.4	87%	0.872	77%	0.774	S	S	*	*			trans	-63.3	108.4	176	-176.3	173.7	-178.9	136.1	-0.7	109.3	K149 R153	K149-R151 PolarHBondContact O-N 2.8Å; R151-R153 PolarHBondContact O-N 2.82Å
152	R	52.4	Low	52.8	Low	232 Å²	232	142.5 Å²	142.5	88%	0.875	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-55.5	123	168.1	-68.7	-178.7	-180	-91.6	-1.8	108.4	L150	L150-R152 PolarHBondContact O-N 3.03Å
153	R	55.8	Low	51.7	Low	227 Å²	227	139 Å²	139	86%	0.857	78%	0.781	S	S	*	*	P	Polyproline II helix	trans	-69	141.2	161.8	-61.2	-178.2	-172.7	-115.7	2.9	107.2	R151	R151-R153 PolarHBondContact O-N 2.82Å
154	A	51.5	Low	51	Low	98 Å²	98	141.8 Å²	141.8	81%	0.81	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-63	139.3	170	0	0	0	0	0	109.1
155	I	51.8	Low	49.9	Very low	173 Å²	173	139.6 Å²	139.6	89%	0.887	80%	0.798	S	S	*	*			trans	-113.8	118.3	178.6	-63.2	174.9	0	0	0	106.4
156	G	44.7	Very low	49	Very low	63 Å²	63	141.1 Å²	141.1	65%	0.649	80%	0.804	S	S	*	*			trans	76.2	140.4	-161.6	0	0	0	0	0	111.2
157	G	42.7	Very low	48.1	Very low	77 Å²	77	139.5 Å²	139.5	79%	0.794	81%	0.811	S	S	*	*			cis	94.5	80.1	3.6	0	0	0	0	0	113
158	V	41.8	Very low	46.9	Very low	141 Å²	141	138 Å²	138	86%	0.855	82%	0.819	S	S	*	*			trans	-138.9	138.9	138.7	-169.2	0	0	0	0	105.9
159	G	43.5	Very low	45.7	Very low	72 Å²	72	130 Å²	130	74%	0.742	81%	0.81	S	S	*	*			trans	-127.5	129.4	172.9	0	0	0	0	0	109.4
160	S	40.2	Very low	44.5	Very low	119 Å²	119	128.7 Å²	128.7	83%	0.832	81%	0.813	S	S	*	*			trans	62.3	137.2	-166.2	-150.9	0	0	0	0	113.1
161	G	44.1	Very low	43.7	Very low	57 Å²	57	128.4 Å²	128.4	59%	0.588	81%	0.812	S	S	*	*			cis	171.4	-169.1	2.4	0	0	0	0	0	108.6
162	V	39.3	Very low	42.2	Very low	148 Å²	148	124.3 Å²	124.3	90%	0.897	81%	0.812	S	S	*	*			trans	68.8	115	179.1	-171.5	0	0	0	0	115.1
163	S	33.9	Very low	41.4	Very low	103 Å²	103	118.7 Å²	118.7	72%	0.72	81%	0.809	S	S	*	*			trans	-84.7	153.4	169.8	52.8	0	0	0	0	112.6
164	I	42.2	Very low	40.3	Very low	176 Å²	176	112.8 Å²	112.8	90%	0.903	81%	0.809	S	S	*	*			trans	-148	141.5	134.9	-92.7	137.6	0	0	0	106.3
165	G	37.7	Very low	39.7	Very low	67 Å²	67	113.4 Å²	113.4	69%	0.691	81%	0.807	S	S	*	*			trans	-139.6	137.1	-175.7	0	0	0	0	0	113.6
166	S	39.7	Very low	39	Very low	117 Å²	117	112 Å²	112	82%	0.818	80%	0.801	S	S	*	*			trans	-166.2	113.9	156.6	-77.4	0	0	0	0	105.5
167	A	40.3	Very low	38.6	Very low	108 Å²	108	115.6 Å²	115.6	89%	0.893	81%	0.813	S	S	*	*				74.4	110.7	69.7	0	0	0	0	0	111.7
168	G	36.6	Very low	38.6	Very low	85 Å²	85	115.7 Å²	115.7	88%	0.876	81%	0.806	S	S	*	*			trans	149.8	66.5	-173.3	0	0	0	0	0	112.1
169	G	36	Very low	38.7	Very low	69 Å²	69	115.7 Å²	115.7	71%	0.711	80%	0.802	S	S	*	*			trans	-96.2	162.2	175.5	0	0	0	0	0	112.5
170	N	38.9	Very low	38.6	Very low	171 Å²	171	122.5 Å²	122.5	91%	0.914	81%	0.811	S	S	*	*			trans	-159.5	124	158.6	-105.5	-11.2	0	0	0	108.3
171	D	35.4	Very low	39.4	Very low	162 Å²	162	122.6 Å²	122.6	87%	0.866	80%	0.8	S	S	*	*			trans	-90.2	146.3	-177.2	-61.9	-75.8	0	0	0	112.4
172	V	37.8	Very low	39.4	Very low	145 Å²	145	128.7 Å²	128.7	88%	0.879	81%	0.806	S	S	*	*			trans	-133.5	110.7	158.9	-177.3	0	0	0	0	110.5
173	S	34.9	Very low	39.8	Very low	115 Å²	115	131.7 Å²	131.7	80%	0.804	80%	0.802	S	S	*	*			trans	-15.8	147.5	167.4	-51.9	0	0	0	0	120.6
174	A	33.6	Very low	40.8	Very low	103 Å²	103	129.3 Å²	129.3	85%	0.851	79%	0.793	S	S	*	*			trans	-87.6	156.8	166.4	0	0	0	0	0	112.9
175	S	38.2	Very low	41.1	Very low	110 Å²	110	126.5 Å²	126.5	77%	0.769	78%	0.78	S	S	*	*			trans	-151.6	138	170.5	61.2	0	0	0	0	113.7
176	N	36.9	Very low	41.9	Very low	145 Å²	145	129.1 Å²	129.1	78%	0.775	78%	0.778	S	S	*	*			trans	58.5	101	161.6	-68	-1.9	0	0	0	120.9
177	P	36.1	Very low	42.5	Very low	137 Å²	137	131.5 Å²	131.5	89%	0.89	78%	0.78	S	S	*	*			trans	-92.3	80.7	153.3	35.7	-28.4	0	0	0	110.7
178	A	43.1	Very low	42.7	Very low	79 Å²	79	132.6 Å²	132.6	65%	0.653	77%	0.77	S	S	*	*			trans	-146.7	86.9	-176.5	0	0	0	0	0	113.9
179	N	45.4	Very low	42.7	Very low	142 Å²	142	135 Å²	135	76%	0.759	77%	0.772	S	S	*	*			trans	-167.8	95.1	147.2	-119.1	-25	0	0	0	110.5
180	F	40.1	Very low	42.7	Very low	214 Å²	214	134.2 Å²	134.2	94%	0.939	76%	0.764	S	S	*	*			trans	-111.8	77.8	171.1	-137.6	-81.5	0	0	0	107.3
181	M	56.3	Low	42.9	Very low	121 Å²	121	132.6 Å²	132.6	60%	0.596	77%	0.766	S	S	*	*			trans	-69.3	132.2	-172.7	-157.3	71.4	83.5	0	0	110.7
182	Y	45.5	Very low	43.1	Very low	185 Å²	185	132 Å²	132	73%	0.725	76%	0.758	S	S	*	*			trans	-79.4	140.1	178.3	-176.8	-111.3	0	0	0	110.4	G184 D185	Y182-G184 PolarHBondContact O-N 3.36Å; Y182-D185 PolarHBondContact O-N 2.96Å
183	W	48.2	Very low	43.3	Very low	212 Å²	212	136.3 Å²	136.3	80%	0.803	76%	0.758	S	S	*	*	G	3₁₀ helix	trans	-63.2	-13.1	-174.4	-72.8	83.6	0	0	0	114.4
184	G	53.4	Low	43.5	Very low	52 Å²	52	136.2 Å²	136.2	54%	0.536	76%	0.755	S	S	.	*	G	3₁₀ helix	trans	-77.9	-17.8	176.6	0	0	0	0	0	115.9	Y182 L186	Y182-G184 PolarHBondContact O-N 3.36Å; G184-L186 VanDerWaalsContact C-N 3.26Å; G184-L186 PolarHBondContact O-N 2.84Å
185	D	49.8	Very low	43.8	Very low	117 Å²	117	139 Å²	139	63%	0.626	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-80.9	0.4	-177.2	-85.1	-31.7	0	0	0	114.1	Y182 L187	Y182-D185 PolarHBondContact O-N 2.96Å; D185-L187 VanDerWaalsContact C-N 3.31Å; D185-L187 PolarHBondContact O-N 2.87Å
186	L	54.1	Low	43.6	Very low	123 Å²	123	141.5 Å²	141.5	64%	0.644	76%	0.757	S	S	*	*			trans	-77	83.4	168.6	-94.1	68	0	0	0	110	G184 L188	G184-L186 VanDerWaalsContact C-N 3.26Å; G184-L186 PolarHBondContact O-N 2.84Å; L186-L188 VanDerWaalsContact C-N 3.35Å; L186-L188 PolarHBondContact O-N 3.1Å
187	L	52.2	Low	43.4	Very low	166 Å²	166	138.5 Å²	138.5	87%	0.869	75%	0.747	S	S	*	*			trans	-62.2	94.1	167.7	-75.1	174.6	0	0	0	110.4	D185	D185-L187 VanDerWaalsContact C-N 3.31Å; D185-L187 PolarHBondContact O-N 2.87Å
188	L	44.5	Very low	43.5	Very low	132 Å²	132	139.7 Å²	139.7	69%	0.691	75%	0.746	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	132.8	172.6	-117.7	65.4	0	0	0	110.3	L186	L186-L188 VanDerWaalsContact C-N 3.35Å; L186-L188 PolarHBondContact O-N 3.1Å
189	C	36.4	Very low	43.1	Very low	136 Å²	136	143.7 Å²	143.7	92%	0.919	76%	0.756	S	S	*	*	T	Hydrogen-bonded Turn	trans	64.9	54.3	170.8	-57.9	0	0	0	0	116.6
190	G	36.5	Very low	42.5	Very low	51 Å²	51	141.2 Å²	141.2	53%	0.526	75%	0.749	S	S	.	*			trans	-114.3	137	157.3	0	0	0	0	0	111.5	H192	G190-H192 PolarHBondContact O-N 2.98Å
191	S	42.1	Very low	42.5	Very low	137 Å²	137	137.3 Å²	137.3	96%	0.958	74%	0.744	S	S	*	*	S	Bend	trans	-77.3	36.3	-168.7	-50.4	0	0	0	0	116
192	H	40.4	Very low	41.4	Very low	151 Å²	151	142.9 Å²	142.9	70%	0.699	76%	0.758	S	S	*	*			trans	-140.8	118.8	171.1	67.7	93.6	0	0	0	112.3	G190	G190-H192 PolarHBondContact O-N 2.98Å
193	W	41.2	Very low	40.9	Very low	235 Å²	235	142.4 Å²	142.4	89%	0.89	77%	0.767	S	S	*	*			trans	-75.3	134	159	-76.2	91.1	0	0	0	108.7	M195	W193-M195 VanDerWaalsContact C-N 3.33Å; W193-M195 PolarHBondContact O-N 2.83Å
194	P	40.5	Very low	40.5	Very low	113 Å²	113	141.2 Å²	141.2	73%	0.734	77%	0.77	S	S	*	*			trans	-74.2	84.9	176.4	30.4	-34.3	0	0	0	110.7
195	M	38.8	Very low	39.4	Very low	160 Å²	160	147.6 Å²	147.6	79%	0.788	78%	0.783	S	S	*	*			trans	-74	137	163.8	-81	-68.1	151.5	0	0	110.1	W193 S197	W193-M195 VanDerWaalsContact C-N 3.33Å; W193-M195 PolarHBondContact O-N 2.83Å; M195-S197 PolarHBondContact O-N 2.95Å
196	N	33.3	Very low	38.7	Very low	164 Å²	164	147.1 Å²	147.1	88%	0.877	79%	0.789	S	S	*	*			trans	-67.4	90.4	-179.5	-92	-33.3	0	0	0	111.4	N198	N196-N198 PolarHBondContact O-N 3.25Å; N196-N198 VanDerWaalsContact O-N 3.12Å
197	S	34.5	Very low	37.6	Very low	82 Å²	82	147.4 Å²	147.4	57%	0.573	79%	0.792	S	S	*	*			trans	-88.7	61.7	-172.4	61.4	0	0	0	0	113.9	M195 L199 S200	M195-S197 PolarHBondContact O-N 2.95Å; S197-L199 PolarHBondContact O-N 3.12Å; S197-S200 WeakPolarHBondContact CB-OG 3.18Å; S197-S200 PolarHBondContact O-OG 3.41Å; S197-S200 PolarHBondContact OG-OG 2.92Å
198	N	37	Very low	36.8	Very low	161 Å²	161	144.8 Å²	144.8	86%	0.861	79%	0.787	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.2	33.1	167.5	-81.6	-12.5	0	0	0	113.4	N196	N196-N198 PolarHBondContact O-N 3.25Å; N196-N198 VanDerWaalsContact O-N 3.12Å
199	L	36.1	Very low	36.1	Very low	163 Å²	163	145 Å²	145	85%	0.853	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-151.9	45.2	176.8	-142.2	76.5	0	0	0	111.6	S197 T201	S197-L199 PolarHBondContact O-N 3.12Å; L199-T201 PolarHBondContact O-N 3.06Å
200	S	32	Very low	35.9	Very low	90 Å²	90	145.5 Å²	145.5	63%	0.629	78%	0.782	S	S	*	*			trans	-96.9	84.4	-175.6	-63.5	0	0	0	0	112.7	S197	S197-S200 WeakPolarHBondContact CB-OG 3.18Å; S197-S200 PolarHBondContact O-OG 3.41Å; S197-S200 PolarHBondContact OG-OG 2.92Å
201	T	39.5	Very low	35.6	Very low	133 Å²	133	147.6 Å²	147.6	82%	0.816	79%	0.789	S	S	*	*			trans	-124.6	103.4	166	52.4	0	0	0	0	112.9	L199	L199-T201 PolarHBondContact O-N 3.06Å
202	R	33.3	Very low	35.1	Very low	237 Å²	237	151.3 Å²	151.3	89%	0.894	78%	0.783	S	S	*	*			trans	64.2	89.7	143.8	-164	-177.1	-162	-117.2	3.6	117.9
203	L	35.2	Very low	34.6	Very low	175 Å²	175	150.5 Å²	150.5	92%	0.916	78%	0.784	S	S	*	*			trans	-149.3	120.9	130.2	-107.8	164.2	0	0	0	109
204	Q	39.4	Very low	33.9	Very low	188 Å²	188	145.5 Å²	145.5	88%	0.879	79%	0.785	S	S	*	*			trans	-87.8	138.6	177.7	-72.3	173.5	-62.8	0	0	109.7	S206	Q204-S206 PolarHBondContact O-N 2.82Å
205	K	31.8	Very low	33.4	Very low	185 Å²	185	145.9 Å²	145.9	80%	0.804	79%	0.786	S	S	*	*			trans	-89.3	105.1	177.3	-175.6	170.8	-179.2	173	0	110.5	N207	K205-N207 WeakPolarHBondContact CE-OD1 3.36Å
206	S	34.7	Very low	33.1	Very low	108 Å²	108	144.4 Å²	144.4	76%	0.755	79%	0.785	S	S	*	*			trans	-79.5	117.3	162.3	50.4	0	0	0	0	109.3	Q204	Q204-S206 PolarHBondContact O-N 2.82Å
207	N	29.9	Very low	33	Very low	129 Å²	129	144 Å²	144	69%	0.69	78%	0.782	S	S	*	*			trans	-81.4	128.2	166.7	-68.9	-18.5	0	0	0	109	K205	K205-N207 WeakPolarHBondContact CE-OD1 3.36Å
208	S	35.4	Very low	33	Very low	110 Å²	110	143.9 Å²	143.9	77%	0.769	79%	0.785	S	S	*	*			trans	-139.5	131.4	160.8	51.9	0	0	0	0	107.1
209	N	29.9	Very low	32.6	Very low	137 Å²	137	143.2 Å²	143.2	73%	0.733	78%	0.782	S	S	*	*			trans	-83.6	-174.5	-174.7	-65.2	-20.7	0	0	0	111.6
210	D	33.2	Very low	32.4	Very low	147 Å²	147	142.6 Å²	142.6	79%	0.786	78%	0.779	S	S	*	*			trans	83.5	117.8	153.4	-50.3	-42.6	0	0	0	117.7
211	S	29.6	Very low	32.6	Very low	94 Å²	94	146.4 Å²	146.4	66%	0.657	79%	0.792	S	S	*	*			trans	22.9	130.1	146	-55.1	0	0	0	0	119.7
212	Y	31.6	Very low	32.3	Very low	216 Å²	216	147.6 Å²	147.6	85%	0.847	79%	0.794	S	S	*	*				-165.9	164.8	86.6	-102.3	-70.7	0	0	0	113.5
213	N	30.2	Very low	32.4	Very low	133 Å²	133	144.8 Å²	144.8	71%	0.711	79%	0.791	S	S	*	*			trans	-52.5	155	-170.3	-57.7	-35	0	0	0	116.4	T215	N213-T215 PolarHBondContact O-N 2.98Å
214	S	26.3	Very low	32.5	Very low	130 Å²	130	144 Å²	144	91%	0.909	79%	0.788	S	S	*	*			trans	-54.3	122.3	154.6	-53.4	0	0	0	0	110.9
215	T	30.9	Very low	32.3	Very low	122 Å²	122	141.8 Å²	141.8	75%	0.748	79%	0.787	S	S	*	*			trans	-118.2	126.2	168.3	-63.6	0	0	0	0	109.1	N213 I217	N213-T215 PolarHBondContact O-N 2.98Å; T215-I217 PolarHBondContact O-N 3.47Å
216	V	31.3	Very low	32.5	Very low	129 Å²	129	140.3 Å²	140.3	78%	0.782	79%	0.788	S	S	*	*			trans	-67.7	121.1	174	175.6	0	0	0	0	108.7	A218	V216-A218 VanDerWaalsContact C-N 3.3Å; V216-A218 PolarHBondContact O-N 3.5Å
217	I	31.9	Very low	32.7	Very low	156 Å²	156	139.4 Å²	139.4	80%	0.8	78%	0.78	S	S	*	*			trans	-78.2	87.2	169.5	-57.2	-179.9	0	0	0	107.7	T215	T215-I217 PolarHBondContact O-N 3.47Å
218	A	33.2	Very low	32.9	Very low	79 Å²	79	140 Å²	140	65%	0.653	78%	0.781	S	S	*	*			trans	-81.2	132.7	161.8	0	0	0	0	0	108.6	V216 N220	V216-A218 VanDerWaalsContact C-N 3.3Å; V216-A218 PolarHBondContact O-N 3.5Å; A218-N220 PolarHBondContact O-N 3.49Å
219	N	29.4	Very low	32.9	Very low	146 Å²	146	142.9 Å²	142.9	78%	0.781	78%	0.783	S	S	*	*			trans	-69.2	125.2	172.6	-63.7	-24.4	0	0	0	109.4
220	N	31.1	Very low	33.1	Very low	151 Å²	151	141.4 Å²	141.4	81%	0.807	78%	0.783	S	S	*	*			trans	175	123.1	144.1	-88.6	-12.8	0	0	0	108.2	A218	A218-N220 PolarHBondContact O-N 3.49Å
221	N	36.5	Very low	33.2	Very low	169 Å²	169	140.1 Å²	140.1	90%	0.904	79%	0.786	S	S	*	*			trans	-170.5	95.8	161.7	-96.1	-19.2	0	0	0	107.3
222	D	33.6	Very low	33.5	Very low	158 Å²	158	140.3 Å²	140.3	85%	0.845	79%	0.787	S	S	*	*			trans	-73.2	129.8	158.8	-65	-70.4	0	0	0	108.5
223	E	36.4	Very low	33.7	Very low	179 Å²	179	136.3 Å²	136.3	84%	0.836	78%	0.78	S	S	*	*			trans	-177.2	157.9	141.2	-108.1	-174.8	143.7	0	0	111.7
224	N	36.5	Very low	34.2	Very low	158 Å²	158	136.6 Å²	136.6	85%	0.845	78%	0.781	S	S	*	*			trans	74.2	87.5	178	-51	-78.3	0	0	0	116.1
225	T	34.2	Very low	34.8	Very low	142 Å²	142	137.4 Å²	137.4	87%	0.871	77%	0.77	S	S	*	*			trans	-119.5	124	161.7	-61	0	0	0	0	109.2
226	D	36.4	Very low	35.2	Very low	154 Å²	154	138.2 Å²	138.2	82%	0.824	77%	0.77	S	S	*	*			trans	-172.4	159.5	163.3	-119.5	-18.1	0	0	0	109.5
227	P	39	Very low	35.6	Very low	89 Å²	89	139.5 Å²	139.5	58%	0.578	77%	0.768	S	S	*	*			cis	-134.5	170.5	-14.8	41.4	-26.9	0	0	0	114.2
228	I	34.2	Very low	36.1	Very low	140 Å²	140	137 Å²	137	72%	0.718	76%	0.761	S	S	*	*			trans	62.2	127	143.7	-71.5	163.7	0	0	0	117.4
229	Q	36	Very low	36.7	Very low	171 Å²	171	142.9 Å²	142.9	80%	0.799	77%	0.772	S	S	*	*				-173.7	150.4	51.6	-149	153.3	28.2	0	0	112.9
230	S	33.7	Very low	37.2	Very low	107 Å²	107	143.7 Å²	143.7	75%	0.748	77%	0.772	S	S	*	*			trans	61.9	143.8	158.9	-59.7	0	0	0	0	119
231	S	35.6	Very low	37.8	Very low	119 Å²	119	144.6 Å²	144.6	83%	0.832	78%	0.777	S	S	*	*			cis	-140.4	161	14.6	-57.6	0	0	0	0	111.9
232	S	35.5	Very low	37.9	Very low	99 Å²	99	143.2 Å²	143.2	69%	0.692	77%	0.769	S	S	*	*			trans	-84.2	161.5	-178	56.3	0	0	0	0	114.9
233	N	35.9	Very low	38.3	Very low	131 Å²	131	143.7 Å²	143.7	70%	0.701	77%	0.77	S	S	*	*				179.7	127.6	109.9	-86.7	-7.7	0	0	0	114.3
234	L	41.1	Very low	38.5	Very low	139 Å²	139	140.2 Å²	140.2	73%	0.728	77%	0.765	S	S	*	*			trans	52.2	141.2	139.8	-75.9	80	0	0	0	121.1
235	E	39.3	Very low	38.5	Very low	147 Å²	147	136.3 Å²	136.3	69%	0.687	76%	0.762	S	S	*	*			cis	-170.8	172.1	-17.8	-140.6	169.6	163.5	0	0	109.9
236	N	39.3	Very low	38.8	Very low	140 Å²	140	137.4 Å²	137.4	75%	0.749	76%	0.761	S	S	*	*			trans	71.4	142.5	172.5	-46.3	-48.7	0	0	0	116.6
237	E	39.4	Very low	39	Very low	155 Å²	155	135 Å²	135	72%	0.724	75%	0.754	S	S	*	*			cis	-158.2	128.1	-8.6	-117.3	-76.4	108.9	0	0	107.5
238	P	42.1	Very low	38.8	Very low	103 Å²	103	136 Å²	136	67%	0.669	76%	0.763	S	S	*	*			trans	-113.1	150.6	-176.4	38.5	-30.6	0	0	0	114.3
239	K	45	Very low	39.1	Very low	203 Å²	203	134.1 Å²	134.1	88%	0.883	76%	0.762	S	S	*	*			trans	-140.6	128.2	153.4	-71.9	-162.7	176.1	178.5	0	112.4
240	E	41.5	Very low	39	Very low	164 Å²	164	132.8 Å²	132.8	77%	0.766	76%	0.761	S	S	*	*			trans	-87.5	168.2	-179.3	-59.3	154	136.5	0	0	111.7
241	N	42.8	Very low	39.1	Very low	170 Å²	170	133.4 Å²	133.4	91%	0.909	76%	0.76	S	S	*	*				-166.7	124.3	125.7	-95	-48.3	0	0	0	109.4
242	D	38.5	Very low	39.1	Very low	140 Å²	140	135.7 Å²	135.7	75%	0.749	76%	0.759	S	S	*	*			trans	-74.6	170.8	178.3	-67.1	-72.6	0	0	0	113.8
243	I	42.8	Very low	38.9	Very low	167 Å²	167	135.1 Å²	135.1	86%	0.856	76%	0.756	S	S	*	*				-163.8	140.6	111.4	-97	155	0	0	0	111.9
244	S	39.6	Very low	38.9	Very low	106 Å²	106	134.3 Å²	134.3	74%	0.741	76%	0.76	S	S	*	*			trans	-59.7	160.4	-172.9	54.5	0	0	0	0	118.2
245	G	37.8	Very low	38.6	Very low	76 Å²	76	133.9 Å²	133.9	78%	0.784	76%	0.763	S	S	*	*			trans	-136.5	-45.1	179.1	0	0	0	0	0	119.6
246	I	40.5	Very low	38.1	Very low	165 Å²	165	136.4 Å²	136.4	85%	0.846	77%	0.772	S	S	*	*			trans	69.5	150.8	173.7	-70.4	174.6	0	0	0	117.5
247	P	39.9	Very low	37.7	Very low	105 Å²	105	138.9 Å²	138.9	68%	0.682	78%	0.779	S	S	*	*			trans	-136.1	-171.9	-153.7	44	-25.6	0	0	0	118.4
248	S	35.4	Very low	37.1	Very low	110 Å²	110	137.1 Å²	137.1	77%	0.769	78%	0.784	S	S	*	*			trans	77.1	133.6	154.1	-58.6	0	0	0	0	119.6
249	S	39.1	Very low	36.7	Very low	99 Å²	99	137.9 Å²	137.9	69%	0.692	79%	0.787	S	S	*	*				176.3	167.6	72.3	50.7	0	0	0	0	115.2
250	N	35.1	Very low	35.8	Very low	144 Å²	144	133.9 Å²	133.9	77%	0.77	79%	0.785	S	S	*	*			trans	73.1	84.7	149.9	-61	-16.3	0	0	0	123.3
251	T	35.3	Very low	35.4	Very low	119 Å²	119	133.6 Å²	133.6	73%	0.73	79%	0.788	S	S	*	*				35.9	131.5	106.4	-43.6	0	0	0	0	122.2
252	M	35.1	Very low	34.7	Very low	167 Å²	167	131.3 Å²	131.3	82%	0.823	79%	0.785	S	S	*	*			trans	149.9	138.8	139.2	-78	-92.6	96.2	0	0	109.6
253	S	32.1	Very low	34.5	Very low	88 Å²	88	130.6 Å²	130.6	62%	0.615	79%	0.791	S	S	*	*			cis	159.3	111.5	-26.9	49.3	0	0	0	0	108.6
254	S	35	Very low	33.8	Very low	114 Å²	114	128 Å²	128	80%	0.797	79%	0.788	S	S	*	*			trans	-172.8	119.4	160.4	42.3	0	0	0	0	110.9
255	V	34.8	Very low	33.6	Very low	130 Å²	130	131.3 Å²	131.3	79%	0.788	80%	0.796	S	S	*	*				83.5	106.4	94.3	170.5	0	0	0	0	115
256	F	28	Very low	33.3	Very low	200 Å²	200	132.4 Å²	132.4	88%	0.877	79%	0.792	S	S	*	*			trans	34.4	117	151	-69.3	-105.6	0	0	0	120.9
257	Q	32.1	Very low	33.1	Very low	191 Å²	191	131 Å²	131	89%	0.893	79%	0.791	S	S	*	*				-158.2	159.7	112.5	-142	157.3	11.4	0	0	113
258	S	27.3	Very low	32.9	Very low	118 Å²	118	131.8 Å²	131.8	83%	0.825	79%	0.794	S	S	*	*			trans	-79.6	128.6	-175.7	-43.7	0	0	0	0	113.1
259	T	32.8	Very low	32.8	Very low	120 Å²	120	131.7 Å²	131.7	74%	0.736	79%	0.793	S	S	*	*			trans	-142	136.2	164.9	38.5	0	0	0	0	112.4
260	S	27.2	Very low	32.7	Very low	119 Å²	119	131.5 Å²	131.5	83%	0.832	80%	0.798	S	S	*	*			trans	-72.2	130.1	164.7	51	0	0	0	0	110.1
261	L	32.3	Very low	32.8	Very low	158 Å²	158	129.5 Å²	129.5	83%	0.827	80%	0.795	S	S	*	*			trans	-122.3	96.2	177.4	-72.8	174	0	0	0	111.7	S263	L261-S263 PolarHBondContact O-N 3.37Å
262	S	27.7	Very low	32.9	Very low	122 Å²	122	129.9 Å²	129.9	85%	0.853	80%	0.797	S	S	*	*			trans	-75.6	111.4	158.8	52.5	0	0	0	0	109.3
263	S	33.5	Very low	33.1	Very low	124 Å²	124	127.6 Å²	127.6	87%	0.867	79%	0.793	S	S	*	*			trans	-87.4	114	174.7	42	0	0	0	0	111.2	L261	L261-S263 PolarHBondContact O-N 3.37Å
264	S	30	Very low	33.2	Very low	113 Å²	113	129.4 Å²	129.4	79%	0.79	80%	0.8	S	S	*	*			trans	-96.4	140.1	167.5	56.3	0	0	0	0	110.2
265	L	35.4	Very low	33.2	Very low	175 Å²	175	128.7 Å²	128.7	92%	0.916	80%	0.802	S	S	*	*			trans	-129	126.5	166.4	-143.9	72.4	0	0	0	111.9
266	S	31.1	Very low	33.1	Very low	100 Å²	100	128.4 Å²	128.4	70%	0.699	80%	0.8	S	S	*	*			trans	-47.6	149.8	-176.5	52.5	0	0	0	0	118.6
267	T	35.4	Very low	33.6	Very low	135 Å²	135	124.9 Å²	124.9	83%	0.828	80%	0.796	S	S	*	*				-144.3	120	125	37.4	0	0	0	0	112.2
268	T	35.5	Very low	33.7	Very low	121 Å²	121	120.4 Å²	120.4	74%	0.742	79%	0.785	S	S	*	*			trans	7.9	151.9	138.6	51.3	0	0	0	0	121.5
269	S	33.1	Very low	33.8	Very low	108 Å²	108	119.8 Å²	119.8	76%	0.755	78%	0.781	S	S	*	*			cis	168.8	120.1	-30.9	45.5	0	0	0	0	109.7
270	A	37.1	Very low	33.7	Very low	95 Å²	95	120.2 Å²	120.2	79%	0.785	78%	0.783	S	S	*	*			trans	-160.2	118.9	165	0	0	0	0	0	112.6
271	S	37.8	Very low	33.8	Very low	102 Å²	102	120.4 Å²	120.4	71%	0.713	78%	0.78	S	S	*	*			trans	12.7	133.4	135	56.4	0	0	0	0	119.2
272	T	37.4	Very low	33.8	Very low	127 Å²	127	118.7 Å²	118.7	78%	0.779	78%	0.776	S	S	*	*			cis	-163.9	-172.3	4.8	8.7	0	0	0	0	108.1
273	T	39	Very low	33.8	Very low	119 Å²	119	119.6 Å²	119.6	73%	0.73	78%	0.776	S	S	*	*			cis	-155.6	-170.6	20.9	-23.3	0	0	0	0	111.5
274	T	34.1	Very low	33.7	Very low	126 Å²	126	120.8 Å²	120.8	77%	0.773	77%	0.771	S	S	*	*			trans	-45.2	153.5	162.7	49.4	0	0	0	0	115
275	A	36.4	Very low	33.4	Very low	100 Å²	100	120.9 Å²	120.9	83%	0.826	77%	0.772	S	S	*	*			cis	-152.6	163.5	41.5	0	0	0	0	0	117.2
276	T	32.6	Very low	33.1	Very low	124 Å²	124	116.8 Å²	116.8	76%	0.761	76%	0.763	S	S	*	*			trans	-75.9	145.2	-170.1	-20.4	0	0	0	0	115.2
277	T	36.7	Very low	32.9	Very low	126 Å²	126	117.7 Å²	117.7	77%	0.773	77%	0.765	S	S	*	*				179.5	122	112.8	24.8	0	0	0	0	115.4
278	S	34.8	Very low	32.6	Very low	97 Å²	97	120.5 Å²	120.5	68%	0.678	77%	0.766	S	S	*	*			trans	24.6	117.8	144.5	57.1	0	0	0	0	123.6
279	S	30.9	Very low	32.5	Very low	105 Å²	105	121.6 Å²	121.6	73%	0.734	77%	0.767	S	S	*	*			trans	38.3	129.6	130.9	61.3	0	0	0	0	120.5
280	T	30.5	Very low	32.2	Very low	128 Å²	128	121.3 Å²	121.3	79%	0.785	77%	0.765	S	S	*	*				-166.1	158.5	66.3	-60.8	0	0	0	0	112.4	T282	T280-T282 PolarHBondContact O-N 3.41Å
281	T	28.2	Very low	32.1	Very low	124 Å²	124	123.8 Å²	123.8	76%	0.761	77%	0.771	S	S	*	*			trans	-57	117.6	-177.5	-47.4	0	0	0	0	116.2
282	T	32.4	Very low	31.8	Very low	121 Å²	121	124.4 Å²	124.4	74%	0.742	78%	0.775	S	S	*	*			trans	-145.2	128.1	152.6	-38.9	0	0	0	0	109.4	T280 I284	T280-T282 PolarHBondContact O-N 3.41Å; T282-I284 HydrophobicContact CG2-CD1 4.24Å; T282-I284 HydrophobicContact CG2-CG1 4.3Å
283	V	27.4	Very low	31.8	Very low	141 Å²	141	128.1 Å²	128.1	86%	0.855	78%	0.78	S	S	*	*			trans	-97.6	100.9	-175.9	-160	0	0	0	0	110.2
284	I	31.1	Very low	31.7	Very low	149 Å²	149	127.1 Å²	127.1	76%	0.764	78%	0.778	S	S	*	*			trans	-135.8	142.7	176.7	-60.4	-177.8	0	0	0	110.8	T282	T282-I284 HydrophobicContact CG2-CD1 4.24Å; T282-I284 HydrophobicContact CG2-CG1 4.3Å
285	S	25.2	Very low	31.6	Very low	116 Å²	116	129 Å²	129	81%	0.811	78%	0.784	S	S	*	*			trans	-71.4	135.7	-167.8	-39.4	0	0	0	0	116.8
286	A	28.2	Very low	32.3	Very low	89 Å²	89	130.5 Å²	130.5	74%	0.736	78%	0.777	S	S	*	*			trans	-168.6	112.4	141.7	0	0	0	0	0	108.3
287	T	27.9	Very low	32.3	Very low	119 Å²	119	134.1 Å²	134.1	73%	0.73	78%	0.782	S	S	*	*				69.5	108.6	76	-57.9	0	0	0	0	114
288	F	28.8	Very low	32.2	Very low	194 Å²	194	131.5 Å²	131.5	85%	0.851	78%	0.78	S	S	*	*			trans	-161.1	130.5	136.1	-90.4	-58.3	0	0	0	112.4
289	N	32	Very low	32.5	Very low	143 Å²	143	133.1 Å²	133.1	77%	0.765	79%	0.786	S	S	*	*			trans	25.9	154.3	151.3	-56.8	-10.3	0	0	0	123.7
290	S	28.2	Very low	32.9	Very low	102 Å²	102	134.9 Å²	134.9	71%	0.713	79%	0.787	S	S	*	*			cis	-179.4	109.6	-28.6	-178.1	0	0	0	0	109.5
291	T	35.5	Very low	33	Very low	147 Å²	147	133.1 Å²	133.1	90%	0.902	79%	0.793	S	S	*	*			trans	-165.5	142.6	149	-3.4	0	0	0	0	112.2
292	S	30.1	Very low	33.9	Very low	115 Å²	115	133.2 Å²	133.2	80%	0.804	79%	0.789	S	S	*	*			trans	-74.8	128.7	-163.1	-48.2	0	0	0	0	115.9
293	K	37.5	Very low	34.3	Very low	205 Å²	205	132.7 Å²	132.7	89%	0.891	78%	0.781	S	S	*	*			trans	-163.8	131.7	143.6	-103	150.9	-172.9	176.5	0	109.7
294	S	36.5	Very low	35.5	Very low	99 Å²	99	131.5 Å²	131.5	69%	0.692	78%	0.776	S	S	*	*			trans	-93.6	112.5	-169.5	54.7	0	0	0	0	113
295	N	33.6	Very low	36.4	Very low	165 Å²	165	131.8 Å²	131.8	88%	0.882	77%	0.773	S	S	*	*			trans	-86.4	115	169.9	-72.6	-27.3	0	0	0	110.2
296	I	49.5	Very low	37.3	Very low	132 Å²	132	131.2 Å²	131.2	68%	0.677	76%	0.76	S	S	*	*			trans	-96.8	-16.1	-169.3	-69.6	171.8	0	0	0	113.5	G298	I296-G298 PolarHBondContact O-N 2.96Å
297	F	34.5	Very low	38.6	Very low	199 Å²	199	129 Å²	129	87%	0.873	75%	0.747	S	S	*	*			trans	-97.7	23.9	-166.7	-73.7	-82.4	0	0	0	115.9
298	G	33.4	Very low	40.3	Very low	71 Å²	71	127 Å²	127	73%	0.732	74%	0.737	S	S	*	*	S	Bend	trans	-78	-19.3	-172.3	0	0	0	0	0	117	I296	I296-G298 PolarHBondContact O-N 2.96Å
299	T	41.3	Very low	41.5	Very low	131 Å²	131	123.1 Å²	123.1	80%	0.804	72%	0.724	S	S	*	*	S	Bend	trans	-143.7	33.8	-160	54.8	0	0	0	0	115.8
300	L	38.7	Very low	43	Very low	143 Å²	143	122.4 Å²	122.4	75%	0.749	72%	0.72	S	S	*	*			trans	-131.5	102.5	172.6	-70.4	175.4	0	0	0	111.6	L302	L300-L302 VanDerWaalsContact C-N 3.31Å; L300-L302 HydrophobicContact CB-CD1 4.34Å; L300-L302 HydrophobicContact CB-CG 4.47Å; L300-L302 PolarHBondContact O-N 2.93Å
301	G	33.6	Very low	44.6	Very low	90 Å²	90	121.2 Å²	121.2	93%	0.928	71%	0.712	S	S	*	*			trans	-76.1	76.5	174.4	0	0	0	0	0	112
302	L	45.6	Very low	45.8	Very low	126 Å²	126	120.8 Å²	120.8	66%	0.66	70%	0.699	S	S	*	*			trans	-126.4	136.3	-179.8	-62.5	174.6	0	0	0	109.9	L300	L300-L302 VanDerWaalsContact C-N 3.31Å; L300-L302 HydrophobicContact CB-CD1 4.34Å; L300-L302 HydrophobicContact CB-CG 4.47Å; L300-L302 PolarHBondContact O-N 2.93Å
303	N	40.9	Very low	47.4	Very low	111 Å²	111	119.8 Å²	119.8	59%	0.594	68%	0.684	S	S	*	*			trans	-67.8	130.8	-174.5	-87.9	-45.9	0	0	0	112	F305 D306	N303-F305 PolarHBondContact O-N 3.25Å; N303-D306 WeakPolarHBondContact CB-OD2 3.41Å; N303-D306 PolarHBondContact O-N 2.88Å
304	P	54.1	Low	48.5	Very low	115 Å²	115	115.1 Å²	115.1	75%	0.747	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.8	-0.4	174.9	30.4	-35.5	0	0	0	113.7
305	F	49.5	Very low	49.5	Very low	156 Å²	156	112.7 Å²	112.7	68%	0.684	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	-9.6	-179.4	-60.6	-70.3	0	0	0	114.1	N303 G307	N303-F305 PolarHBondContact O-N 3.25Å; F305-G307 PolarHBondContact O-N 2.92Å; F305-G307 VanDerWaalsContact O-N 3.11Å
306	D	43.9	Very low	50.5	Low	104 Å²	104	108.3 Å²	108.3	56%	0.556	64%	0.637	S	S	*	*			trans	-75	103.4	176.3	-83.1	-54.6	0	0	0	110.4	N303 S308 L309	N303-D306 WeakPolarHBondContact CB-OD2 3.41Å; N303-D306 PolarHBondContact O-N 2.88Å; D306-S308 PolarHBondContact O-N 2.9Å; D306-L309 PolarHBondContact O-N 3.48Å; D306-L309 VanDerWaalsContact O-N 3.1Å
307	G	56.2	Low	50.6	Low	43 Å²	43	107.9 Å²	107.9	44%	0.443	63%	0.633	S	S	.	*	H	α-helix	trans	-57.2	-10	-174.1	0	0	0	0	0	115.8	F305 S311	F305-G307 PolarHBondContact O-N 2.92Å; F305-G307 VanDerWaalsContact O-N 3.11Å; G307-S311 VanDerWaalsContact O-CB 3.27Å; G307-S311 WeakPolarHBondContact O-CB 3.25Å; G307-S311 PolarHBondContact O-N 2.81Å; G307-S311 PolarHBondContact O-OG 3.48Å
308	S	63.1	Low	51.5	Low	75 Å²	75	104.4 Å²	104.4	52%	0.524	62%	0.624	S	S	.	*	H	α-helix	trans	-55	-50.4	168.5	-178.1	0	0	0	0	112.1	D306 L310 S311 H312	D306-S308 PolarHBondContact O-N 2.9Å; S308-L310 PolarHBondContact O-N 3.26Å; S308-S311 PolarHBondContact O-N 2.94Å; S308-H312 PolarHBondContact O-CD2 2.9Å; S308-H312 VanDerWaalsContact O-CD2 3.24Å; S308-H312 PolarHBondContact O-N 3.03Å
309	L	54.4	Low	52	Low	113 Å²	113	107.4 Å²	107.4	59%	0.592	62%	0.623	S	S	*	*	H	α-helix	trans	-67.7	-41.1	-176.3	-170.8	149.2	0	0	0	111.3	D306 S311 H312 L313	D306-L309 PolarHBondContact O-N 3.48Å; D306-L309 VanDerWaalsContact O-N 3.1Å; L309-S311 VanDerWaalsContact C-N 3.33Å; L309-S311 PolarHBondContact O-N 3.48Å; L309-H312 PolarHBondContact O-N 2.89Å; L309-L313 VanDerWaalsContact O-CB 3.3Å; L309-L313 WeakPolarHBondContact O-CB 3.43Å; L309-L313 PolarHBondContact O-N 2.93Å
310	L	62.4	Low	51.7	Low	129 Å²	129	107.6 Å²	107.6	68%	0.675	62%	0.619	S	S	*	*	H	α-helix	trans	-63.4	-40.2	175.2	-156.7	82.9	0	0	0	111.5	S308 L313 L314	S308-L310 PolarHBondContact O-N 3.26Å; L310-L313 PolarHBondContact O-N 2.7Å; L310-L314 WeakPolarHBondContact O-CB 3.31Å; L310-L314 PolarHBondContact O-N 2.79Å
311	S	63	Low	51.6	Low	77 Å²	77	106.3 Å²	106.3	54%	0.538	62%	0.618	S	S	.	*	H	α-helix	trans	-64.6	-45	176.8	-60.1	0	0	0	0	111.8	G307 S308 L309 A315	G307-S311 VanDerWaalsContact O-CB 3.27Å; G307-S311 WeakPolarHBondContact O-CB 3.25Å; G307-S311 PolarHBondContact O-N 2.81Å; G307-S311 PolarHBondContact O-OG 3.48Å; S308-S311 PolarHBondContact O-N 2.94Å; L309-S311 VanDerWaalsContact C-N 3.33Å; L309-S311 PolarHBondContact O-N 3.48Å; S311-A315 WeakPolarHBondContact O-CB 3.22Å; S311-A315 PolarHBondContact O-N 3.24Å
312	H	59.4	Low	51.6	Low	137 Å²	137	107.6 Å²	107.6	63%	0.634	61%	0.612	S	S	*	*	H	α-helix	trans	-67	-38.5	177.1	-81.9	-67.7	0	0	0	112.6	S308 L309 S316	S308-H312 PolarHBondContact O-CD2 2.9Å; S308-H312 VanDerWaalsContact O-CD2 3.24Å; S308-H312 PolarHBondContact O-N 3.03Å; L309-H312 PolarHBondContact O-N 2.89Å; H312-S316 VanDerWaalsContact O-CB 3.27Å; H312-S316 WeakPolarHBondContact O-CB 3.46Å; H312-S316 PolarHBondContact O-N 3.34Å
313	L	63.9	Low	50.9	Low	95 Å²	95	109 Å²	109	50%	0.497	62%	0.62	S	S	.	*	H	α-helix	trans	-70.5	-42.1	178.5	-166.2	135	0	0	0	111.6	L309 L310 S316 M317	L309-L313 VanDerWaalsContact O-CB 3.3Å; L309-L313 WeakPolarHBondContact O-CB 3.43Å; L309-L313 PolarHBondContact O-N 2.93Å; L310-L313 PolarHBondContact O-N 2.7Å; L313-S316 WeakPolarHBondContact O-CB 3.4Å; L313-S316 PolarHBondContact O-N 2.93Å; L313-M317 HydrophobicContact CD2-CG 4.49Å; L313-M317 HydrophobicContact CD2-SD 3.66Å; L313-M317 WeakPolarHBondContact O-CG 3.32Å; L313-M317 PolarHBondContact O-N 3.29Å
314	L	61	Low	50.4	Low	106 Å²	106	108.2 Å²	108.2	56%	0.555	62%	0.623	S	S	*	*	H	α-helix	trans	-65.6	-37.9	174.5	-170.2	66.2	0	0	0	112.3	L310 N318	L310-L314 WeakPolarHBondContact O-CB 3.31Å; L310-L314 PolarHBondContact O-N 2.79Å; L314-N318 PolarHBondContact O-N 3.46Å; L314-N318 VanDerWaalsContact O-N 3.17Å
315	A	56.6	Low	49.2	Very low	49 Å²	49	108.6 Å²	108.6	41%	0.405	63%	0.628	S	S	.	*	H	α-helix	trans	-68.8	-34.2	172.9	0	0	0	0	0	112.8	S311 N319	S311-A315 WeakPolarHBondContact O-CB 3.22Å; S311-A315 PolarHBondContact O-N 3.24Å; A315-N319 PolarHBondContact O-ND2 2.92Å
316	S	55.7	Low	48	Very low	72 Å²	72	107 Å²	107	50%	0.503	64%	0.635	S	S	.	*	H	α-helix	trans	-67.8	-45.2	175.3	-171.2	0	0	0	0	111.4	H312 L313 N318 N319	H312-S316 VanDerWaalsContact O-CB 3.27Å; H312-S316 WeakPolarHBondContact O-CB 3.46Å; H312-S316 PolarHBondContact O-N 3.34Å; L313-S316 WeakPolarHBondContact O-CB 3.4Å; L313-S316 PolarHBondContact O-N 2.93Å; S316-N318 VanDerWaalsContact C-N 3.34Å; S316-N318 PolarHBondContact O-N 3.5Å; S316-N319 PolarHBondContact O-N 3.07Å
317	M	51.4	Low	47.2	Very low	123 Å²	123	107.3 Å²	107.3	61%	0.606	65%	0.646	S	S	*	*	H	α-helix	trans	-62.7	-37.1	177.2	-70.3	177.3	70.9	0	0	112.7	L313 N319	L313-M317 HydrophobicContact CD2-CG 4.49Å; L313-M317 HydrophobicContact CD2-SD 3.66Å; L313-M317 WeakPolarHBondContact O-CG 3.32Å; L313-M317 PolarHBondContact O-N 3.29Å; M317-N319 VanDerWaalsContact C-N 3.3Å; M317-N319 PolarHBondContact O-N 3.48Å
318	N	53	Low	46	Very low	126 Å²	126	113.6 Å²	113.6	67%	0.674	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	-12.9	178.4	-83.5	-6.8	0	0	0	115.1	L314 S316	L314-N318 PolarHBondContact O-N 3.46Å; L314-N318 VanDerWaalsContact O-N 3.17Å; S316-N318 VanDerWaalsContact C-N 3.34Å; S316-N318 PolarHBondContact O-N 3.5Å
319	N	44.8	Very low	44.2	Very low	135 Å²	135	115.3 Å²	115.3	72%	0.722	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92	-6	179.5	-79.2	-47.1	0	0	0	113.9	A315 S316 M317	A315-N319 PolarHBondContact O-ND2 2.92Å; S316-N319 PolarHBondContact O-N 3.07Å; M317-N319 VanDerWaalsContact C-N 3.3Å; M317-N319 PolarHBondContact O-N 3.48Å
320	N	35.5	Very low	43	Very low	134 Å²	134	116 Å²	116	72%	0.717	68%	0.68	S	S	*	*	S	Bend	trans	-124	72.2	-177.3	-78.3	-35	0	0	0	111.7
321	T	35.1	Very low	41.4	Very low	117 Å²	117	120.5 Å²	120.5	72%	0.718	69%	0.694	S	S	*	*			trans	-156.1	35.9	167.7	-8.3	0	0	0	0	115.3	L323	T321-L323 VanDerWaalsContact C-N 3.25Å; T321-L323 PolarHBondContact O-N 3.49Å
322	S	33.7	Very low	39.8	Very low	116 Å²	116	126.1 Å²	126.1	81%	0.811	71%	0.705	S	S	*	*			trans	-76.5	72.1	166.5	60.9	0	0	0	0	111.6
323	L	31.9	Very low	38.3	Very low	156 Å²	156	125.1 Å²	125.1	82%	0.817	71%	0.709	S	S	*	*	S	Bend	trans	-167.1	128.2	152.1	-128.6	70.2	0	0	0	113.3	T321	T321-L323 VanDerWaalsContact C-N 3.25Å; T321-L323 PolarHBondContact O-N 3.49Å
324	S	30.6	Very low	36.7	Very low	94 Å²	94	127.2 Å²	127.2	66%	0.657	72%	0.72	S	S	*	*			trans	6	118.8	156.7	56.8	0	0	0	0	121.7
325	S	27.3	Very low	35.3	Very low	124 Å²	124	126 Å²	126	87%	0.867	72%	0.721	S	S	*	*				63.4	79.7	123.6	-50.6	0	0	0	0	120.2
326	C	25.8	Very low	33.9	Very low	123 Å²	123	129.3 Å²	129.3	83%	0.831	74%	0.741	S	S	*	*			trans	-142.7	146.4	145	61.9	0	0	0	0	111.4
327	S	25.8	Very low	32.8	Very low	110 Å²	110	135.8 Å²	135.8	77%	0.769	76%	0.756	S	S	*	*			trans	-85.7	114.5	-169	-58.8	0	0	0	0	112.8
328	L	30.7	Very low	31.7	Very low	175 Å²	175	136.8 Å²	136.8	92%	0.916	76%	0.763	S	S	*	*			trans	-113.4	59.5	163.4	-74.7	177.3	0	0	0	111.7	N330	L328-N330 PolarHBondContact O-N 3.14Å
329	T	26.9	Very low	30.6	Very low	111 Å²	111	136.4 Å²	136.4	68%	0.681	77%	0.77	S	S	*	*			trans	-69.8	99.6	158.1	47.3	0	0	0	0	109.2
330	N	28.5	Very low	30	Very low	128 Å²	128	136.1 Å²	136.1	68%	0.684	77%	0.769	S	S	*	*			trans	-176.6	82	148.8	-95.4	-22.2	0	0	0	113.1	L328	L328-N330 PolarHBondContact O-N 3.14Å
331	F	28.9	Very low	30.1	Very low	222 Å²	222	135.7 Å²	135.7	97%	0.974	77%	0.771	S	S	*	*			trans	-131.1	59.9	147.7	-83	-71.3	0	0	0	109
332	Y	29.5	Very low	30.2	Very low	195 Å²	195	136 Å²	136	77%	0.765	78%	0.775	S	S	*	*			trans	-73.4	141.4	171	-92.7	-75.2	0	0	0	111.2	N334	Y332-N334 PolarHBondContact O-N 2.91Å
333	T	28.1	Very low	30.4	Very low	116 Å²	116	137.9 Å²	137.9	71%	0.712	78%	0.776	S	S	*	*			trans	-61.1	126.2	165.7	48.2	0	0	0	0	111.1
334	N	29.9	Very low	30.6	Very low	139 Å²	139	136.4 Å²	136.4	74%	0.743	77%	0.769	S	S	*	*			trans	-108.4	113.3	141.4	-82.7	-46.3	0	0	0	105.9	Y332	Y332-N334 PolarHBondContact O-N 2.91Å
335	S	31.1	Very low	30.8	Very low	80 Å²	80	139.7 Å²	139.7	56%	0.559	78%	0.777	S	S	*	*				66.9	105.9	63.4	-59	0	0	0	0	111.1	Y337	S335-Y337 PolarHBondContact O-N 3.12Å
336	S	27.5	Very low	31	Very low	120 Å²	120	140.8 Å²	140.8	84%	0.839	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-49	129.1	165.3	47.3	0	0	0	0	111.4
337	Y	31.9	Very low	31.5	Very low	208 Å²	208	140.4 Å²	140.4	82%	0.816	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-96.5	133.1	162.7	-86.4	-91.4	0	0	0	110.3	S335	S335-Y337 PolarHBondContact O-N 3.12Å
338	L	30.1	Very low	31.8	Very low	143 Å²	143	142 Å²	142	75%	0.749	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-84.1	135.1	-173.6	-177.2	72.5	0	0	0	110.4	N340	L338-N340 HydrophobicContact CD2-CB 4.15Å; L338-N340 HydrophobicContact CG-CB 4.13Å
339	S	29.5	Very low	32	Very low	118 Å²	118	137.2 Å²	137.2	83%	0.825	77%	0.771	S	S	*	*			trans	-113.5	71.4	167.8	63	0	0	0	0	110.6
340	N	32.2	Very low	32.3	Very low	130 Å²	130	139.3 Å²	139.3	70%	0.695	78%	0.777	S	S	*	*			trans	-105.5	132.4	167.5	-85.3	-0.9	0	0	0	109.4	L338	L338-N340 HydrophobicContact CD2-CB 4.15Å; L338-N340 HydrophobicContact CG-CB 4.13Å
341	T	38	Very low	32.6	Very low	124 Å²	124	140.8 Å²	140.8	76%	0.761	78%	0.784	S	S	*	*			trans	-74.3	146.9	175.8	46	0	0	0	0	111.5
342	P	36.2	Very low	32.8	Very low	124 Å²	124	136.6 Å²	136.6	81%	0.805	77%	0.772	S	S	*	*			trans	-92.8	111.7	179.3	34	-30.5	0	0	0	112
343	D	38.4	Very low	32.9	Very low	155 Å²	155	132.6 Å²	132.6	83%	0.829	77%	0.768	S	S	*	*			trans	-120.7	100.5	166.4	-87.6	-57.7	0	0	0	112
344	N	34.8	Very low	33.3	Very low	126 Å²	126	135 Å²	135	67%	0.674	78%	0.776	S	S	*	*			trans	-10.3	129.6	150.2	-179	24	0	0	0	117.7
345	I	35.6	Very low	33.4	Very low	162 Å²	162	132.1 Å²	132.1	83%	0.831	78%	0.78	S	S	*	*				-168.4	140.7	128.1	-98.7	151.6	0	0	0	110.1
346	N	31.7	Very low	33.6	Very low	147 Å²	147	131.9 Å²	131.9	79%	0.786	79%	0.789	S	S	*	*			trans	-97.8	136	174.9	-56.7	-83.4	0	0	0	110.8
347	S	35.9	Very low	34	Very low	116 Å²	116	132.5 Å²	132.5	81%	0.811	79%	0.788	S	S	*	*			trans	-161.2	148.4	142.5	-165.5	0	0	0	0	112
348	V	33.3	Very low	34	Very low	142 Å²	142	126.5 Å²	126.5	86%	0.861	78%	0.781	S	S	*	*			trans	-89.9	165.6	164.6	-66.5	0	0	0	0	110.5
349	G	34.9	Very low	34.2	Very low	76 Å²	76	127.4 Å²	127.4	78%	0.784	78%	0.784	S	S	*	*			trans	156.6	121.5	166.9	0	0	0	0	0	114.9
350	D	31.4	Very low	34.4	Very low	154 Å²	154	128.7 Å²	128.7	82%	0.824	78%	0.781	S	S	*	*			trans	-76.4	148.5	176.8	-52.5	-89.3	0	0	0	113.9
351	L	34.8	Very low	34.5	Very low	159 Å²	159	128.2 Å²	128.2	83%	0.832	79%	0.788	S	S	*	*			trans	-173.8	119	132.6	-120.6	51	0	0	0	109.3
352	L	33.5	Very low	34.3	Very low	135 Å²	135	126.8 Å²	126.8	71%	0.707	78%	0.783	S	S	*	*				75.9	109.7	69.5	-98.6	168.4	0	0	0	116.5
353	T	32.8	Very low	34.3	Very low	111 Å²	111	126.3 Å²	126.3	68%	0.681	78%	0.782	S	S	*	*			trans	71.5	153.3	146.1	36.3	0	0	0	0	123.2
354	N	35.5	Very low	34.2	Very low	166 Å²	166	125.8 Å²	125.8	89%	0.888	78%	0.779	S	S	*	*			trans	87.9	132.6	173.2	-51.1	-42.7	0	0	0	116.4
355	G	32.8	Very low	34.2	Very low	79 Å²	79	124.6 Å²	124.6	81%	0.814	78%	0.78	S	S	*	*			cis	162.5	139	-10.3	0	0	0	0	0	113.8
356	G	35.3	Very low	34.2	Very low	74 Å²	74	123.5 Å²	123.5	76%	0.763	78%	0.782	S	S	*	*			trans	103.4	151.1	170.9	0	0	0	0	0	116.7
357	V	34.7	Very low	34.1	Very low	133 Å²	133	121 Å²	121	81%	0.806	78%	0.781	S	S	*	*			cis	-172.7	126.7	-48.3	134.9	0	0	0	0	109.5
358	A	33.4	Very low	34	Very low	83 Å²	83	121.8 Å²	121.8	69%	0.686	78%	0.781	S	S	*	*			trans	53.9	167.8	162.5	0	0	0	0	0	118.7
359	M	33.6	Very low	34	Very low	162 Å²	162	119.2 Å²	119.2	80%	0.798	77%	0.774	S	S	*	*			cis	-130.7	126.6	6.2	-23.4	-82.1	152.8	0	0	107.8
360	N	32.6	Very low	34	Very low	144 Å²	144	121.9 Å²	121.9	77%	0.77	78%	0.775	S	S	*	*				56.6	98.6	80.6	-167	14.1	0	0	0	117.6
361	S	34.8	Very low	34.1	Very low	120 Å²	120	119 Å²	119	84%	0.839	77%	0.773	S	S	*	*				176.8	157.5	128.2	41.2	0	0	0	0	111.7
362	S	35.1	Very low	34.2	Very low	95 Å²	95	115.5 Å²	115.5	66%	0.664	77%	0.767	S	S	*	*				171.3	94.8	-57.8	175.2	0	0	0	0	110
363	C	35.2	Very low	34.2	Very low	114 Å²	114	115.6 Å²	115.6	77%	0.77	77%	0.773	S	S	*	*			trans	177.1	131.7	149	52.1	0	0	0	0	108.9
364	N	36	Very low	34.2	Very low	143 Å²	143	114.7 Å²	114.7	77%	0.765	78%	0.777	S	S	*	*			cis	70.3	127.4	43.4	-60.6	-3.8	0	0	0	112.4
365	S	35.7	Very low	34.3	Very low	101 Å²	101	111.8 Å²	111.8	71%	0.706	78%	0.776	S	S	*	*			cis	-152.2	-169.1	-7.9	-72	0	0	0	0	107.4
366	T	35.7	Very low	34.3	Very low	140 Å²	140	111.2 Å²	111.2	86%	0.859	77%	0.77	S	S	*	*			cis	-157.5	173.6	14.3	-38.7	0	0	0	0	108.6
367	A	30	Very low	34.3	Very low	93 Å²	93	115.3 Å²	115.3	77%	0.769	77%	0.773	S	S	*	*			trans	-142.5	145.1	177.6	0	0	0	0	0	115.1
368	V	33.9	Very low	34.4	Very low	134 Å²	134	116.1 Å²	116.1	81%	0.812	77%	0.772	S	S	*	*			trans	-156	131.1	163.9	-141.6	0	0	0	0	104.2
369	A	32.5	Very low	34.4	Very low	88 Å²	88	120.2 Å²	120.2	73%	0.727	78%	0.779	S	S	*	*			cis	66.9	143	44.8	0	0	0	0	0	112.1
370	V	34.7	Very low	34.9	Very low	131 Å²	131	118 Å²	118	79%	0.794	78%	0.777	S	S	*	*			cis	-151.9	151.7	16.2	-168.2	0	0	0	0	109.9
371	A	34.5	Very low	35.1	Very low	94 Å²	94	115.5 Å²	115.5	78%	0.777	77%	0.77	S	S	*	*			trans	61.3	170	155.4	0	0	0	0	0	121.1
372	A	36.2	Very low	35.2	Very low	86 Å²	86	117.1 Å²	117.1	71%	0.711	77%	0.769	S	S	*	*			cis	-170.4	170.1	-41.8	0	0	0	0	0	111.9
373	V	33.2	Very low	35.6	Very low	136 Å²	136	116.4 Å²	116.4	82%	0.824	78%	0.777	S	S	*	*			trans	64.4	100.2	157.3	-178	0	0	0	0	120.3
374	A	32.4	Very low	35.8	Very low	93 Å²	93	117.7 Å²	117.7	77%	0.769	78%	0.781	S	S	*	*				59.1	158.9	123.2	0	0	0	0	0	124.1
375	A	38.7	Very low	35.9	Very low	105 Å²	105	113.8 Å²	113.8	87%	0.868	78%	0.775	S	S	*	*			trans	62.4	135.6	-174.5	0	0	0	0	0	114.8
376	G	32.2	Very low	35.9	Very low	67 Å²	67	115.6 Å²	115.6	69%	0.691	78%	0.782	S	S	*	*			cis	117.6	122.9	0.1	0	0	0	0	0	111.8
377	L	34.2	Very low	35.9	Very low	159 Å²	159	116.5 Å²	116.5	83%	0.832	78%	0.78	S	S	*	*			trans	140.6	138.4	162.1	-80.6	168.5	0	0	0	113
378	I	37.8	Very low	35.9	Very low	151 Å²	151	115.3 Å²	115.3	77%	0.774	78%	0.777	S	S	*	*			trans	74	109.5	143.7	-65.5	166.4	0	0	0	119.7
379	M	33.2	Very low	36.1	Very low	169 Å²	169	117.2 Å²	117.2	83%	0.833	78%	0.781	S	S	*	*			trans	-83.5	-173.2	155.6	-63.3	-110.8	89.5	0	0	109.5
380	P	43.6	Very low	36.1	Very low	116 Å²	116	118 Å²	118	75%	0.753	78%	0.782	S	S	*	*			cis	-138.5	-164.7	3.6	43.2	-23.6	0	0	0	114.4
381	S	38.3	Very low	36.3	Very low	91 Å²	91	119.2 Å²	119.2	64%	0.636	78%	0.784	S	S	*	*				147.5	115.5	122.8	-165.9	0	0	0	0	116
382	N	37.1	Very low	36.4	Very low	153 Å²	153	122.4 Å²	122.4	82%	0.818	79%	0.788	S	S	*	*			trans	63.7	121.9	143.1	-62.3	-2.4	0	0	0	124
383	G	42.6	Very low	36.5	Very low	80 Å²	80	125.1 Å²	125.1	83%	0.825	79%	0.789	S	S	*	*			trans	-164.7	120.1	152.8	0	0	0	0	0	109
384	T	39.8	Very low	36.6	Very low	141 Å²	141	130.3 Å²	130.3	87%	0.865	79%	0.794	S	S	*	*			trans	-121.4	146	-155.1	49.3	0	0	0	0	116.5
385	G	38.1	Very low	36.7	Very low	61 Å²	61	133.8 Å²	133.8	63%	0.629	80%	0.798	S	S	*	*			trans	141.7	116.2	166.6	0	0	0	0	0	110.9
386	T	35.9	Very low	36.6	Very low	139 Å²	139	134 Å²	134	85%	0.853	79%	0.793	S	S	*	*			cis	54.3	130.3	47.2	79.9	0	0	0	0	112.3
387	I	35.5	Very low	37	Very low	159 Å²	159	136.8 Å²	136.8	82%	0.815	80%	0.8	S	S	*	*			cis	-138.9	151.8	15.5	-60.4	169.5	0	0	0	108.1
388	G	29.6	Very low	37.1	Very low	69 Å²	69	135.9 Å²	135.9	71%	0.711	80%	0.801	S	S	*	*			cis	123.5	61.7	-1.2	0	0	0	0	0	115.5
389	L	37.4	Very low	37.1	Very low	173 Å²	173	133.2 Å²	133.2	91%	0.906	80%	0.801	S	S	*	*			trans	-135	138.8	172.5	-81.1	179.9	0	0	0	113.3
390	S	34	Very low	37.3	Very low	106 Å²	106	129.1 Å²	129.1	74%	0.741	79%	0.794	S	S	*	*			trans	-98.7	158.2	178.1	-47	0	0	0	0	111.6
391	N	37.4	Very low	37.1	Very low	156 Å²	156	131.8 Å²	131.8	83%	0.834	80%	0.801	S	S	*	*			trans	-163.8	123.9	134.2	-104.7	-24.6	0	0	0	112.5
392	N	36.8	Very low	36.9	Very low	160 Å²	160	131.2 Å²	131.2	86%	0.856	81%	0.81	S	S	*	*			trans	-97.6	121.9	166.7	-77.4	-60.7	0	0	0	108.6
393	I	39.2	Very low	36.9	Very low	143 Å²	143	130.5 Å²	130.5	73%	0.733	82%	0.815	S	S	*	*			trans	-129.3	107.5	159.7	-61	-177.3	0	0	0	108.2
394	R	34.4	Very low	36.5	Very low	245 Å²	245	130.2 Å²	130.2	93%	0.925	81%	0.812	S	S	*	*			trans	-86.3	129	157.6	-71	-177.9	173.4	-144.7	1.1	107.7
395	L	35.1	Very low	36.4	Very low	166 Å²	166	131.4 Å²	131.4	87%	0.869	81%	0.812	S	S	*	*			trans	-147.4	127.2	156.7	-100.7	164.3	0	0	0	107.6
396	S	36.1	Very low	36.6	Very low	109 Å²	109	134.6 Å²	134.6	76%	0.762	82%	0.819	S	S	*	*			trans	-92.7	164.7	177.2	60.8	0	0	0	0	110.5
397	P	42	Very low	36.9	Very low	127 Å²	127	133.6 Å²	133.6	83%	0.825	82%	0.815	S	S	*	*			trans	-86.3	160.3	-162.4	35.2	-36.7	0	0	0	113.7
398	V	35.7	Very low	37	Very low	140 Å²	140	133.6 Å²	133.6	85%	0.848	82%	0.815	S	S	*	*			trans	-152.3	147	154.4	101	0	0	0	0	109.7
399	A	38.1	Very low	37.3	Very low	94 Å²	94	137.3 Å²	137.3	78%	0.777	82%	0.818	S	S	*	*			trans	35.4	137.9	163.3	0	0	0	0	0	119.6
400	A	36.7	Very low	37.1	Very low	84 Å²	84	135.8 Å²	135.8	69%	0.694	81%	0.811	S	S	*	*				-179.4	156.5	53.8	0	0	0	0	0	111.5
401	L	39.6	Very low	36.9	Very low	172 Å²	172	136.6 Å²	136.6	90%	0.901	81%	0.807	S	S	*	*			trans	46	100.4	149.6	-58.9	173.6	0	0	0	118.4
402	G	33.6	Very low	36.9	Very low	79 Å²	79	134.4 Å²	134.4	81%	0.814	80%	0.8	S	S	*	*			trans	-83.8	141.8	158.7	0	0	0	0	0	112.2
403	C	37.2	Very low	36.8	Very low	138 Å²	138	133.2 Å²	133.2	93%	0.932	79%	0.793	S	S	*	*			trans	-139.7	123.6	155.4	-94.1	0	0	0	0	106.9
404	G	35.4	Very low	36.7	Very low	73 Å²	73	133.8 Å²	133.8	75%	0.753	80%	0.798	S	S	*	*			trans	-99.8	154.3	174	0	0	0	0	0	111.3
405	L	36.5	Very low	36.8	Very low	166 Å²	166	129 Å²	129	87%	0.869	79%	0.791	S	S	*	*			trans	-165.9	113.9	148.2	-106.2	166.9	0	0	0	111.4
406	V	43.1	Very low	36.8	Very low	129 Å²	129	127 Å²	127	78%	0.782	79%	0.789	S	S	*	*			trans	22.4	134	141.4	-176.3	0	0	0	0	119.6
407	P	42.1	Very low	36.5	Very low	117 Å²	117	128.1 Å²	128.1	76%	0.76	79%	0.787	S	S	*	*			trans	-95.7	171.2	-166.4	39.9	-39.2	0	0	0	116
408	L	37.5	Very low	36.1	Very low	159 Å²	159	130.2 Å²	130.2	83%	0.832	79%	0.785	S	S	*	*			trans	-150	117.3	170.3	-148.6	73	0	0	0	115.4
409	L	36.3	Very low	36.1	Very low	147 Å²	147	127.9 Å²	127.9	77%	0.77	78%	0.775	S	S	*	*			trans	49.7	151.4	147.7	-87.8	65	0	0	0	125.1
410	N	31.7	Very low	35.9	Very low	142 Å²	142	128.9 Å²	128.9	76%	0.759	78%	0.776	S	S	*	*			trans	59.8	124.3	163.9	-82.6	-6.5	0	0	0	119.2
411	N	30.8	Very low	35.9	Very low	123 Å²	123	129.7 Å²	129.7	66%	0.658	78%	0.777	S	S	*	*			cis	78.9	101.1	43.7	-176.2	26.5	0	0	0	114.5
412	T	37.3	Very low	35.8	Very low	110 Å²	110	127.8 Å²	127.8	68%	0.675	77%	0.773	S	S	*	*				-175.6	134	119.8	20.9	0	0	0	0	115.3
413	N	33.9	Very low	35.8	Very low	134 Å²	134	129.7 Å²	129.7	72%	0.717	77%	0.773	S	S	*	*			trans	70.9	165.4	139.8	-59.9	-16	0	0	0	123.1
414	N	37.8	Very low	35.9	Very low	155 Å²	155	130.9 Å²	130.9	83%	0.829	77%	0.769	S	S	*	*			trans	74.9	98.2	176.2	-52	-23.8	0	0	0	114.5
415	N	36.3	Very low	35.9	Very low	145 Å²	145	139.1 Å²	139.1	78%	0.775	78%	0.777	S	S	*	*			cis	72.5	94.6	33.4	-172.1	36.2	0	0	0	116.4
416	C	34.8	Very low	35.7	Very low	125 Å²	125	141 Å²	141	85%	0.845	78%	0.778	S	S	*	*			trans	-161.5	163	132.5	46.3	0	0	0	0	110.6
417	N	30.2	Very low	35.1	Very low	132 Å²	132	146 Å²	146	71%	0.706	78%	0.783	S	S	*	*			trans	-121.8	174.9	-170.6	-91.4	-51.5	0	0	0	112.3
418	H	34.3	Very low	34.6	Very low	170 Å²	170	149.3 Å²	149.3	79%	0.787	78%	0.78	S	S	*	*			trans	84.7	146.1	164.3	-54.6	-60.8	0	0	0	117.8
419	S	34.3	Very low	34.6	Very low	91 Å²	91	151.2 Å²	151.2	64%	0.636	79%	0.785	S	S	*	*			cis	-168.4	154	-21.8	-102.7	0	0	0	0	110.2
420	S	35.3	Very low	35	Very low	115 Å²	115	150.1 Å²	150.1	80%	0.804	78%	0.776	S	S	*	*			trans	69.6	151.5	158.6	-53.7	0	0	0	0	119.2
421	S	35.1	Very low	35	Very low	101 Å²	101	151.3 Å²	151.3	71%	0.706	78%	0.782	S	S	*	*			cis	-172.9	116.6	-34.7	50.5	0	0	0	0	111.6
422	T	39.1	Very low	35.6	Very low	133 Å²	133	151.7 Å²	151.7	82%	0.816	79%	0.789	S	S	*	*			trans	-162.2	121.3	149.1	35.4	0	0	0	0	113.1	I424	T422-I424 PolarHBondContact O-N 3.24Å
423	S	32.9	Very low	35.7	Very low	119 Å²	119	150.6 Å²	150.6	83%	0.832	79%	0.791	S	S	*	*			trans	61.2	42.5	139.9	-53.7	0	0	0	0	122.1
424	I	40	Very low	36	Very low	163 Å²	163	150.2 Å²	150.2	84%	0.836	80%	0.796	S	S	*	*			trans	-83.7	111.2	158.5	-62.4	177.5	0	0	0	110	T422 K426	T422-I424 PolarHBondContact O-N 3.24Å; I424-K426 PolarHBondContact O-N 2.88Å
425	R	34	Very low	36	Very low	245 Å²	245	147.6 Å²	147.6	93%	0.925	79%	0.79	S	S	*	*			trans	-75.1	85.9	176.9	-91.5	-169.4	170.7	-166.2	-0.8	112.2	R427	R425-R427 VanDerWaalsContact C-N 3.34Å; R425-R427 PolarHBondContact O-N 3.31Å
426	K	31.9	Very low	36.1	Very low	205 Å²	205	145.2 Å²	145.2	89%	0.891	79%	0.79	S	S	*	*			trans	-70.1	78.9	174	-164.4	171.5	-171.8	172.1	0	111.9	I424 R428	I424-K426 PolarHBondContact O-N 2.88Å; K426-R428 PolarHBondContact O-N 3.4Å; K426-R428 VanDerWaalsContact O-N 3.12Å
427	R	32.2	Very low	36.3	Very low	234 Å²	234	146.7 Å²	146.7	88%	0.883	79%	0.785	S	S	*	*			trans	-83.2	87.3	-178.9	-158.9	179.6	111.3	136.1	1.3	112.1	R425 H429	R425-R427 VanDerWaalsContact C-N 3.34Å; R425-R427 PolarHBondContact O-N 3.31Å; R427-H429 PolarHBondContact O-N 3.24Å
428	R	31	Very low	36.9	Very low	187 Å²	187	147.2 Å²	147.2	71%	0.706	79%	0.787	S	S	*	*			trans	10	101.1	152.8	173.2	171.2	157.3	171.4	-5.1	114.9	K426 Q430	K426-R428 PolarHBondContact O-N 3.4Å; K426-R428 VanDerWaalsContact O-N 3.12Å; R428-Q430 HydrophobicContact CG-CB 4.32Å; R428-Q430 PolarHBondContact O-N 2.89Å
429	H	37	Very low	37.6	Very low	199 Å²	199	146.3 Å²	146.3	92%	0.921	79%	0.788	S	S	*	*			trans	-58.6	130	157.1	-75.6	-98	0	0	0	108.3	R427	R427-H429 PolarHBondContact O-N 3.24Å
430	Q	44.9	Very low	38.6	Very low	125 Å²	125	149.4 Å²	149.4	58%	0.584	80%	0.796	S	S	*	*			trans	-146.7	140.2	175.5	179.1	173.1	-14.5	0	0	107.2	R428 T432	R428-Q430 HydrophobicContact CG-CB 4.32Å; R428-Q430 PolarHBondContact O-N 2.89Å; Q430-T432 PolarHBondContact O-N 2.69Å
431	N	32.9	Very low	39.7	Very low	166 Å²	166	150.3 Å²	150.3	89%	0.888	79%	0.791	S	S	*	*			trans	-50.7	121.1	-176.2	-76.7	-17.5	0	0	0	112.4
432	T	42.9	Very low	41.4	Very low	132 Å²	132	149.2 Å²	149.2	81%	0.81	78%	0.777	S	S	*	*			trans	-127.1	129.6	159.8	44.3	0	0	0	0	106.6	Q430	Q430-T432 PolarHBondContact O-N 2.69Å
433	A	39.3	Very low	43.3	Very low	86 Å²	86	145.9 Å²	145.9	71%	0.711	76%	0.758	S	S	*	*			trans	-64.2	153.8	-173.2	0	0	0	0	0	112.3	S435	A433-S435 PolarHBondContact O-N 2.84Å
434	P	39.1	Very low	45.4	Very low	127 Å²	127	147.6 Å²	147.6	83%	0.825	75%	0.753	S	S	*	*			trans	-71.3	90.2	174.2	30.4	-34.5	0	0	0	110.2	A436	P434-A436 PolarHBondContact O-N 3.46Å
435	S	37.8	Very low	47.4	Very low	100 Å²	100	146.3 Å²	146.3	70%	0.699	74%	0.743	S	S	*	*			trans	-76.3	62.3	172.5	61.6	0	0	0	0	111.1	A433 Q437	A433-S435 PolarHBondContact O-N 2.84Å; S435-Q437 PolarHBondContact O-N 3.1Å
436	A	38.6	Very low	49.7	Very low	94 Å²	94	138.7 Å²	138.7	78%	0.777	72%	0.717	S	S	*	*			trans	-73.7	69.1	169.1	0	0	0	0	0	109.6	P434 L438	P434-A436 PolarHBondContact O-N 3.46Å; A436-L438 PolarHBondContact O-N 3.38Å
437	Q	39.6	Very low	52.1	Low	157 Å²	157	131.8 Å²	131.8	73%	0.734	69%	0.69	S	S	*	*			trans	-71.8	118.6	172.7	-72.4	-175.5	-77.3	0	0	109.3	S435 N439	S435-Q437 PolarHBondContact O-N 3.1Å; Q437-N439 PolarHBondContact O-N 3.11Å
438	L	42.4	Very low	54.7	Low	143 Å²	143	128.5 Å²	128.5	75%	0.749	68%	0.679	S	S	*	*			trans	-64.8	93.5	172.4	-73.7	164.3	0	0	0	109.6	A436 L440	A436-L438 PolarHBondContact O-N 3.38Å; L438-L440 PolarHBondContact O-N 3.07Å
439	N	49.9	Very low	57.2	Low	151 Å²	151	121.9 Å²	121.9	81%	0.807	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	41.4	173.9	-75.7	-56.8	0	0	0	112.5	Q437	Q437-N439 PolarHBondContact O-N 3.11Å
440	L	55.1	Low	59.5	Low	155 Å²	155	116.1 Å²	116.1	81%	0.812	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.7	-3.9	170	-93.2	79.1	0	0	0	112.6	L438	L438-L440 PolarHBondContact O-N 3.07Å
441	L	57.5	Low	61.6	Low	134 Å²	134	114 Å²	114	70%	0.702	63%	0.632	S	S	*	*	S	Bend	trans	-69.5	130.9	164.2	-80.7	78.5	0	0	0	108.9
442	L	71.3	Confident	64.2	Low	79 Å²	79	110.6 Å²	110.6	41%	0.414	62%	0.618	S	S	.	*	P	Polyproline II helix	trans	-59.4	151.6	160.6	-70.5	76.5	0	0	0	108.5	E444 E446 I447	L442-E444 PolarHBondContact O-N 2.92Å; L442-E446 HydrophobicContact CB-CB 4.05Å; L442-E446 HydrophobicContact CD2-CB 4.05Å; L442-I447 HydrophobicContact CB-CG1 3.94Å; L442-I447 VanDerWaalsContact O-CD1 3.29Å; L442-I447 WeakPolarHBondContact O-CD1 3.27Å
443	P	79	Confident	66.2	Low	63 Å²	63	109.5 Å²	109.5	41%	0.409	61%	0.605	S	S	.	*	P	Polyproline II helix	trans	-48.1	141.2	168.1	-27.2	35	0	0	0	111.7	H445 E446 I447	P443-H445 VanDerWaalsContact CB-CE1 3.43Å; P443-H445 WeakPolarHBondContact CB-CE1 3.37Å; P443-H445 WeakPolarHBondContact CB-ND1 3.3Å; P443-H445 PolarHBondContact O-N 3.11Å; P443-E446 HydrophobicContact CB-CG 4.42Å; P443-E446 WeakPolarHBondContact CD-OE2 3.47Å; P443-E446 WeakPolarHBondContact O-CA 3.31Å; P443-E446 WeakPolarHBondContact O-CB 3.41Å; P443-E446 PolarHBondContact O-N 2.91Å; P443-I447 PolarHBondContact O-N 3.07Å; P443-I447 VanDerWaalsContact O-N 3.12Å
444	E	77.5	Confident	68.3	Low	155 Å²	155	110 Å²	110	72%	0.724	60%	0.595	S	S	*	*	H	α-helix	trans	-53.2	-33.8	-174	-64.6	177.6	134.1	0	0	113.3	L442 I447 Y448	L442-E444 PolarHBondContact O-N 2.92Å; E444-I447 PolarHBondContact O-N 2.96Å; E444-Y448 WeakPolarHBondContact O-CD2 3.47Å; E444-Y448 PolarHBondContact O-N 3.42Å
445	H	80.8	Confident	70.5	Confident	136 Å²	136	110 Å²	110	63%	0.63	58%	0.584	S	S	*	*	H	α-helix	trans	-68.9	-32	176.9	71	-87.9	0	0	0	114	P443 A449	P443-H445 VanDerWaalsContact CB-CE1 3.43Å; P443-H445 WeakPolarHBondContact CB-CE1 3.37Å; P443-H445 WeakPolarHBondContact CB-ND1 3.3Å; P443-H445 PolarHBondContact O-N 3.11Å; H445-A449 PolarHBondContact O-N 3.48Å; H445-A449 VanDerWaalsContact O-N 3.11Å
446	E	83.3	Confident	72.7	Confident	84 Å²	84	114.2 Å²	114.2	39%	0.393	58%	0.584	S	S	.	*	H	α-helix	trans	-72.6	-40.2	172.1	-66.6	178	-166.4	0	0	110.1	L442 P443 Y448 A449 D450	L442-E446 HydrophobicContact CB-CB 4.05Å; L442-E446 HydrophobicContact CD2-CB 4.05Å; P443-E446 HydrophobicContact CB-CG 4.42Å; P443-E446 WeakPolarHBondContact CD-OE2 3.47Å; P443-E446 WeakPolarHBondContact O-CA 3.31Å; P443-E446 WeakPolarHBondContact O-CB 3.41Å; P443-E446 PolarHBondContact O-N 2.91Å; E446-Y448 VanDerWaalsContact C-N 3.32Å; E446-Y448 PolarHBondContact O-N 3.43Å; E446-A449 WeakPolarHBondContact O-CB 3.43Å; E446-A449 PolarHBondContact O-N 3.49Å; E446-A449 VanDerWaalsContact O-N 3.09Å; E446-D450 PolarHBondContact O-N 3.26Å
447	I	82.5	Confident	74.8	Confident	61 Å²	61	112.3 Å²	112.3	31%	0.313	57%	0.569	S	S	.	*	H	α-helix	trans	-57.8	-43.8	173.5	-60.6	178.2	0	0	0	111	L442 P443 E444 L451	L442-I447 HydrophobicContact CB-CG1 3.94Å; L442-I447 VanDerWaalsContact O-CD1 3.29Å; L442-I447 WeakPolarHBondContact O-CD1 3.27Å; P443-I447 PolarHBondContact O-N 3.07Å; P443-I447 VanDerWaalsContact O-N 3.12Å; E444-I447 PolarHBondContact O-N 2.96Å; I447-L451 HydrophobicContact CG2-CD1 3.93Å; I447-L451 HydrophobicContact CG2-CG 4.43Å; I447-L451 VanDerWaalsContact O-CB 3.3Å; I447-L451 WeakPolarHBondContact O-CB 3.27Å; I447-L451 VanDerWaalsContact O-CG 3.27Å; I447-L451 WeakPolarHBondContact O-CG 3.43Å; I447-L451 PolarHBondContact O-N 2.94Å
448	Y	85.8	Confident	76.6	Confident	165 Å²	165	108.7 Å²	108.7	65%	0.647	56%	0.56	S	S	*	*	H	α-helix	trans	-67.5	-34.3	175.4	-77.5	-62.5	0	0	0	113.4	E444 E446 T452	E444-Y448 WeakPolarHBondContact O-CD2 3.47Å; E444-Y448 PolarHBondContact O-N 3.42Å; E446-Y448 VanDerWaalsContact C-N 3.32Å; E446-Y448 PolarHBondContact O-N 3.43Å; Y448-T452 WeakPolarHBondContact O-CB 3.47Å; Y448-T452 PolarHBondContact O-N 3.15Å; Y448-T452 PolarHBondContact O-OG1 3.45Å
449	A	84.6	Confident	78	Confident	48 Å²	48	105.9 Å²	105.9	40%	0.397	55%	0.552	S	S	.	*	H	α-helix	trans	-66.1	-48.6	174.9	0	0	0	0	0	111.3	H445 E446 T452 I453	H445-A449 PolarHBondContact O-N 3.48Å; H445-A449 VanDerWaalsContact O-N 3.11Å; E446-A449 WeakPolarHBondContact O-CB 3.43Å; E446-A449 PolarHBondContact O-N 3.49Å; E446-A449 VanDerWaalsContact O-N 3.09Å; A449-T452 WeakPolarHBondContact O-CB 3.3Å; A449-T452 PolarHBondContact O-N 2.98Å; A449-T452 VanDerWaalsContact O-N 3.12Å; A449-I453 WeakPolarHBondContact O-CG1 3.3Å; A449-I453 PolarHBondContact O-N 2.98Å
450	D	84.3	Confident	78.4	Confident	78 Å²	78	106.9 Å²	106.9	42%	0.417	55%	0.55	S	S	.	.	H	α-helix	trans	-65.6	-42.3	178.4	-80	-7.7	0	0	0	111.9	E446 T452 I453 I454	E446-D450 PolarHBondContact O-N 3.26Å; D450-T452 PolarHBondContact O-N 2.9Å; D450-I453 PolarHBondContact O-N 2.9Å; D450-I453 VanDerWaalsContact O-N 3.14Å; D450-I454 WeakPolarHBondContact O-CB 3.21Å; D450-I454 VanDerWaalsContact O-CG1 3.22Å; D450-I454 WeakPolarHBondContact O-CG1 3.5Å; D450-I454 PolarHBondContact O-N 3.39Å
451	L	89.8	Confident	78.4	Confident	81 Å²	81	105.3 Å²	105.3	42%	0.424	55%	0.546	S	S	.	.	H	α-helix	trans	-55.9	-40.4	170.9	-80.2	168.9	0	0	0	111.8	I447 H455	I447-L451 HydrophobicContact CG2-CD1 3.93Å; I447-L451 HydrophobicContact CG2-CG 4.43Å; I447-L451 VanDerWaalsContact O-CB 3.3Å; I447-L451 WeakPolarHBondContact O-CB 3.27Å; I447-L451 VanDerWaalsContact O-CG 3.27Å; I447-L451 WeakPolarHBondContact O-CG 3.43Å; I447-L451 PolarHBondContact O-N 2.94Å; L451-H455 WeakPolarHBondContact O-CB 3.37Å; L451-H455 PolarHBondContact O-CD2 3.27Å; L451-H455 VanDerWaalsContact O-CD2 3.31Å; L451-H455 PolarHBondContact O-N 3.39Å
452	T	86.7	Confident	78.1	Confident	94 Å²	94	103.7 Å²	103.7	58%	0.577	55%	0.546	S	S	*	.	H	α-helix	trans	-67.8	-40	177.4	-57.8	0	0	0	0	111.7	Y448 A449 D450 R456	Y448-T452 WeakPolarHBondContact O-CB 3.47Å; Y448-T452 PolarHBondContact O-N 3.15Å; Y448-T452 PolarHBondContact O-OG1 3.45Å; A449-T452 WeakPolarHBondContact O-CB 3.3Å; A449-T452 PolarHBondContact O-N 2.98Å; A449-T452 VanDerWaalsContact O-N 3.12Å; D450-T452 PolarHBondContact O-N 2.9Å; T452-R456 VanDerWaalsContact O-CB 3.26Å; T452-R456 WeakPolarHBondContact O-CB 3.33Å; T452-R456 PolarHBondContact O-N 2.9Å
453	I	86.4	Confident	76.8	Confident	108 Å²	108	107 Å²	107	55%	0.554	56%	0.564	S	S	*	*	H	α-helix	trans	-65.4	-46.7	175.6	-67.9	164.8	0	0	0	110.6	A449 D450 R456 A457	A449-I453 WeakPolarHBondContact O-CG1 3.3Å; A449-I453 PolarHBondContact O-N 2.98Å; D450-I453 PolarHBondContact O-N 2.9Å; D450-I453 VanDerWaalsContact O-N 3.14Å; I453-R456 PolarHBondContact O-N 3.24Å; I453-A457 WeakPolarHBondContact O-CB 3.18Å; I453-A457 PolarHBondContact O-N 3.3Å
454	I	82.7	Confident	75.1	Confident	98 Å²	98	111.2 Å²	111.2	50%	0.503	58%	0.583	S	S	.	*	H	α-helix	trans	-61.7	-49.2	178.3	-68.3	164.2	0	0	0	110.4	D450 R456 A457 C458	D450-I454 WeakPolarHBondContact O-CB 3.21Å; D450-I454 VanDerWaalsContact O-CG1 3.22Å; D450-I454 WeakPolarHBondContact O-CG1 3.5Å; D450-I454 PolarHBondContact O-N 3.39Å; I454-R456 VanDerWaalsContact C-N 3.32Å; I454-R456 PolarHBondContact O-N 3.41Å; I454-A457 PolarHBondContact O-N 3.2Å; I454-C458 PolarHBondContact O-N 3.12Å; I454-C458 PolarHBondContact O-SG 3.35Å; I454-C458 VanDerWaalsContact O-SG 3.35Å
455	H	84.8	Confident	73.7	Confident	125 Å²	125	109.8 Å²	109.8	58%	0.579	59%	0.585	S	S	*	*	H	α-helix	trans	-57.4	-44.5	174.5	-92.5	-80.1	0	0	0	111.8	L451 A457 C458 S459	L451-H455 WeakPolarHBondContact O-CB 3.37Å; L451-H455 PolarHBondContact O-CD2 3.27Å; L451-H455 VanDerWaalsContact O-CD2 3.31Å; L451-H455 PolarHBondContact O-N 3.39Å; H455-A457 VanDerWaalsContact C-N 3.32Å; H455-A457 PolarHBondContact O-N 3.03Å; H455-C458 PolarHBondContact O-N 2.97Å; H455-S459 VanDerWaalsContact O-CB 3.3Å; H455-S459 WeakPolarHBondContact O-CB 3.44Å; H455-S459 PolarHBondContact O-N 3.18Å; H455-S459 PolarHBondContact O-OG 2.88Å; H455-S459 VanDerWaalsContact O-OG 3.14Å
456	R	85.1	Confident	71.7	Confident	189 Å²	189	110.9 Å²	110.9	71%	0.713	60%	0.596	S	S	*	*	H	α-helix	trans	-66.5	-31.3	179	-165.9	178.7	-170.5	-159	3.9	113.1	T452 I453 I454	T452-R456 VanDerWaalsContact O-CB 3.26Å; T452-R456 WeakPolarHBondContact O-CB 3.33Å; T452-R456 PolarHBondContact O-N 2.9Å; I453-R456 PolarHBondContact O-N 3.24Å; I454-R456 VanDerWaalsContact C-N 3.32Å; I454-R456 PolarHBondContact O-N 3.41Å
457	A	81	Confident	69.5	Low	55 Å²	55	110.9 Å²	110.9	46%	0.455	62%	0.618	S	S	.	*	H	α-helix	trans	-71.4	-53.3	173.2	0	0	0	0	0	111.2	I453 I454 H455 S459 K460 V461	I453-A457 WeakPolarHBondContact O-CB 3.18Å; I453-A457 PolarHBondContact O-N 3.3Å; I454-A457 PolarHBondContact O-N 3.2Å; H455-A457 VanDerWaalsContact C-N 3.32Å; H455-A457 PolarHBondContact O-N 3.03Å; A457-S459 PolarHBondContact O-N 2.98Å; A457-K460 WeakPolarHBondContact O-CB 3.39Å; A457-K460 PolarHBondContact O-N 2.89Å; A457-V461 PolarHBondContact O-N 2.67Å
458	C	77.7	Confident	67.5	Low	80 Å²	80	114.5 Å²	114.5	54%	0.541	64%	0.643	S	S	.	*	H	α-helix	trans	-60.6	-42.4	179.9	-65.3	0	0	0	0	112.5	I454 H455 K460 V461 S462	I454-C458 PolarHBondContact O-N 3.12Å; I454-C458 PolarHBondContact O-SG 3.35Å; I454-C458 VanDerWaalsContact O-SG 3.35Å; H455-C458 PolarHBondContact O-N 2.97Å; C458-K460 PolarHBondContact O-N 3.21Å; C458-V461 PolarHBondContact O-N 2.72Å; C458-V461 VanDerWaalsContact O-N 3.09Å; C458-S462 PolarHBondContact O-N 2.78Å
459	S	72.3	Confident	65.2	Low	84 Å²	84	111 Å²	111	59%	0.587	64%	0.643	S	S	*	*	H	α-helix	trans	-65	-18.2	176	-68	0	0	0	0	114.1	H455 A457	H455-S459 VanDerWaalsContact O-CB 3.3Å; H455-S459 WeakPolarHBondContact O-CB 3.44Å; H455-S459 PolarHBondContact O-N 3.18Å; H455-S459 PolarHBondContact O-OG 2.88Å; H455-S459 VanDerWaalsContact O-OG 3.14Å; A457-S459 PolarHBondContact O-N 2.98Å
460	K	58.1	Low	63.1	Low	173 Å²	173	116.2 Å²	116.2	75%	0.752	66%	0.661	S	S	*	*	H	α-helix	trans	-83.2	-22.6	172	-88	-169.9	167.1	-165.7	0	113.9	A457 C458	A457-K460 WeakPolarHBondContact O-CB 3.39Å; A457-K460 PolarHBondContact O-N 2.89Å; C458-K460 PolarHBondContact O-N 3.21Å
461	V	54.9	Low	60.9	Low	122 Å²	122	117.2 Å²	117.2	74%	0.739	67%	0.674	S	S	*	*	H	α-helix	trans	-84.8	-30.3	-178.4	178.4	0	0	0	0	112	A457 C458 N463	A457-V461 PolarHBondContact O-N 2.67Å; C458-V461 PolarHBondContact O-N 2.72Å; C458-V461 VanDerWaalsContact O-N 3.09Å; V461-N463 VanDerWaalsContact C-N 3.27Å; V461-N463 PolarHBondContact O-N 3.29Å; V461-N463 VanDerWaalsContact O-N 3.16Å
462	S	51	Low	58.5	Low	100 Å²	100	119.2 Å²	119.2	70%	0.699	70%	0.695	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.3	8.8	-170.5	-165.9	0	0	0	0	116.3	C458	C458-S462 PolarHBondContact O-N 2.78Å
463	N	44.8	Very low	56.1	Low	148 Å²	148	118.2 Å²	118.2	79%	0.791	70%	0.703	S	S	*	*	T	Hydrogen-bonded Turn	trans	-113.3	15.5	-166.3	-119.6	38.7	0	0	0	114.9	V461	V461-N463 VanDerWaalsContact C-N 3.27Å; V461-N463 PolarHBondContact O-N 3.29Å; V461-N463 VanDerWaalsContact O-N 3.16Å
464	N	42.2	Very low	54	Low	152 Å²	152	117.9 Å²	117.9	81%	0.813	71%	0.711	S	S	*	*			trans	-133.3	46.6	-169.3	-152.2	41.2	0	0	0	114.7
465	T	48.3	Very low	51.9	Low	124 Å²	124	124.1 Å²	124.1	76%	0.761	73%	0.728	S	S	*	*	S	Bend	trans	-137.2	114.9	167.7	53	0	0	0	0	111.7
466	N	40.3	Very low	49.6	Very low	160 Å²	160	126.7 Å²	126.7	86%	0.856	74%	0.737	S	S	*	*			trans	50.3	100.4	153.9	-56.9	-5.5	0	0	0	118.1
467	G	37.3	Very low	47.5	Very low	84 Å²	84	125.9 Å²	125.9	87%	0.866	74%	0.741	S	S	*	*			trans	-90.5	127.3	159.5	0	0	0	0	0	111.7
468	T	40.3	Very low	45.5	Very low	137 Å²	137	128.2 Å²	128.2	84%	0.84	75%	0.754	S	S	*	*			trans	-137.3	158.2	158.7	-13.7	0	0	0	0	109.7
469	S	37.3	Very low	43.6	Very low	91 Å²	91	129 Å²	129	64%	0.636	76%	0.761	S	S	*	*			trans	-68.7	169.6	-177.3	54.7	0	0	0	0	112.2
470	M	40	Very low	42.1	Very low	157 Å²	157	133.6 Å²	133.6	77%	0.773	77%	0.772	S	S	*	*			cis	-162.9	160.8	32.7	37.9	-166.4	70.8	0	0	114.8
471	S	38.7	Very low	41.1	Very low	100 Å²	100	131.7 Å²	131.7	70%	0.699	78%	0.775	S	S	*	*			trans	58.4	115.1	149.6	62.6	0	0	0	0	122.6
472	S	38.1	Very low	40.2	Very low	122 Å²	122	130.3 Å²	130.3	85%	0.853	78%	0.777	S	S	*	*			trans	45.3	135.4	133.8	61.3	0	0	0	0	122.6
473	G	36.4	Very low	39.7	Very low	73 Å²	73	131.6 Å²	131.6	75%	0.753	79%	0.786	S	S	*	*			cis	157.5	160	-8.2	0	0	0	0	0	115.8
474	S	42.4	Very low	39.3	Very low	102 Å²	102	131.9 Å²	131.9	71%	0.713	79%	0.787	S	S	*	*			trans	63.1	119.1	159.2	-87.6	0	0	0	0	122.4
475	R	38.7	Very low	39.3	Very low	229 Å²	229	131.8 Å²	131.8	86%	0.864	79%	0.787	S	S	*	*			trans	86.7	102.9	137	-61.5	167.1	-165	-136.5	1.1	120.3
476	K	36.9	Very low	38.9	Very low	178 Å²	178	130.4 Å²	130.4	77%	0.774	78%	0.783	S	S	*	*				6.3	139.6	125.2	-53.5	174.8	-179.1	-179.7	0	115.7
477	H	40.8	Very low	38.7	Very low	173 Å²	173	129.9 Å²	129.9	80%	0.801	78%	0.779	S	S	*	*				-174.2	159	77.1	-98.6	-83.5	0	0	0	114.3
478	S	38.7	Very low	38.9	Very low	103 Å²	103	134.7 Å²	134.7	72%	0.72	78%	0.779	S	S	*	*			trans	69	138.7	158.9	-148.2	0	0	0	0	120.7
479	S	37.2	Very low	38.9	Very low	98 Å²	98	133.6 Å²	133.6	69%	0.685	77%	0.772	S	S	*	*			trans	-75.9	162.1	161.2	50	0	0	0	0	111.6
480	H	41.6	Very low	39.5	Very low	179 Å²	179	135 Å²	135	83%	0.829	78%	0.779	S	S	*	*			trans	-157.9	164.4	136.7	-91.3	-53.2	0	0	0	111.9
481	T	37.5	Very low	39.4	Very low	133 Å²	133	134.1 Å²	134.1	82%	0.816	78%	0.778	S	S	*	*			trans	-83.9	155.6	-164	32.6	0	0	0	0	116.5
482	A	36.3	Very low	39.5	Very low	93 Å²	93	135.8 Å²	135.8	77%	0.769	78%	0.779	S	S	*	*			trans	-20.4	149.3	164.1	0	0	0	0	0	120.5
483	S	39.6	Very low	39.6	Very low	128 Å²	128	136.2 Å²	136.2	90%	0.895	78%	0.777	S	S	*	*			trans	-156.8	161.4	147.5	-83.1	0	0	0	0	111.5
484	N	37.4	Very low	39.8	Very low	153 Å²	153	137.1 Å²	137.1	82%	0.818	77%	0.771	S	S	*	*			trans	-92.6	177.1	-171.1	-94	-21.3	0	0	0	114
485	N	40.9	Very low	39.6	Very low	151 Å²	151	138.9 Å²	138.9	81%	0.807	77%	0.773	S	S	*	*			trans	77.2	148.1	161.4	-69.3	-7.7	0	0	0	116.6
486	S	41.1	Very low	39.5	Very low	95 Å²	95	134 Å²	134	66%	0.664	77%	0.768	S	S	*	*			cis	-161.6	156.1	-1.4	33.9	0	0	0	0	113.2
487	N	35.7	Very low	39.4	Very low	148 Å²	148	130.2 Å²	130.2	79%	0.791	77%	0.765	S	S	*	*			trans	39.2	121.3	144.6	-54.1	-10.7	0	0	0	120.6
488	H	40.3	Very low	39.2	Very low	186 Å²	186	130.3 Å²	130.3	86%	0.861	77%	0.765	S	S	*	*				-149	161.2	112.4	-123.8	-77.2	0	0	0	113.8
489	T	42.2	Very low	38.8	Very low	113 Å²	113	133.5 Å²	133.5	69%	0.693	77%	0.773	S	S	*	*			trans	-83.1	160.2	-158.8	45.8	0	0	0	0	117.2
490	P	48.1	Very low	38.5	Very low	120 Å²	120	134.9 Å²	134.9	78%	0.779	78%	0.782	S	S	*	*			trans	-93.8	173.9	175.6	39.8	-37	0	0	0	113.4
491	N	39.1	Very low	37.8	Very low	139 Å²	139	131.4 Å²	131.4	74%	0.743	78%	0.776	S	S	*	*			trans	-163.3	140.3	153.4	-139.3	-11.2	0	0	0	115.1
492	N	40.4	Very low	37.6	Very low	135 Å²	135	132.6 Å²	132.6	72%	0.722	78%	0.777	S	S	*	*			trans	47.9	155.9	151.9	-73.4	-20.7	0	0	0	122.1
493	T	40.7	Very low	37.6	Very low	132 Å²	132	133.6 Å²	133.6	81%	0.81	78%	0.779	S	S	*	*			cis	-140	172.7	13.8	-26.4	0	0	0	0	112.4
494	S	39.7	Very low	37.6	Very low	91 Å²	91	133 Å²	133	64%	0.636	77%	0.772	S	S	*	*			trans	-101.2	-173.3	-166.4	59.7	0	0	0	0	116.2
495	N	38.4	Very low	37.5	Very low	140 Å²	140	133.6 Å²	133.6	75%	0.749	77%	0.774	S	S	*	*			trans	107.1	102.1	162.1	-52.6	-10.6	0	0	0	113
496	T	36.5	Very low	37.4	Very low	125 Å²	125	132 Å²	132	77%	0.767	78%	0.775	S	S	*	*			cis	99.7	126.3	35.5	-154.1	0	0	0	0	114.7
497	S	35.2	Very low	37.2	Very low	100 Å²	100	133.7 Å²	133.7	70%	0.699	78%	0.784	S	S	*	*			trans	78	151.4	157.1	79.4	0	0	0	0	121.4
498	Q	36.5	Very low	37.1	Very low	175 Å²	175	131.7 Å²	131.7	82%	0.818	78%	0.781	S	S	*	*			trans	75.1	97.6	163.9	-53.8	-157.5	-12.8	0	0	120
499	L	30.4	Very low	37.1	Very low	170 Å²	170	131.1 Å²	131.1	89%	0.89	78%	0.784	S	S	*	*				20.6	114.9	115.3	-67	163.6	0	0	0	116.9
500	C	31.3	Very low	36.8	Very low	127 Å²	127	128.8 Å²	128.8	86%	0.858	78%	0.782	S	S	*	*				-161.8	148.4	124.5	-117.4	0	0	0	0	111.8
501	C	26.6	Very low	36.5	Very low	105 Å²	105	133 Å²	133	71%	0.709	79%	0.788	S	S	*	*			trans	-72.3	150.1	161.3	51.4	0	0	0	0	110.2
502	N	33.4	Very low	36.1	Very low	158 Å²	158	131.4 Å²	131.4	85%	0.845	79%	0.787	S	S	*	*			trans	-177	138.8	142.2	-93.5	-25.9	0	0	0	111.4
503	S	36.7	Very low	36.1	Very low	114 Å²	114	135.3 Å²	135.3	80%	0.797	79%	0.793	S	S	*	*			trans	-106	134.6	169.4	-54.3	0	0	0	0	110.3
504	P	40	Very low	35.8	Very low	116 Å²	116	137.1 Å²	137.1	75%	0.753	79%	0.793	S	S	*	*			trans	-95.8	128.3	151.2	32.9	-25.4	0	0	0	109
505	L	34.9	Very low	35.9	Very low	166 Å²	166	139.2 Å²	139.2	87%	0.869	80%	0.796	S	S	*	*				69.4	118.8	60.8	-69.3	164.6	0	0	0	113.3
506	S	37.4	Very low	35.9	Very low	116 Å²	116	138.6 Å²	138.6	81%	0.811	79%	0.793	S	S	*	*			trans	-74.2	172.2	-175.5	-36.6	0	0	0	0	113.4
507	P	38.7	Very low	36	Very low	132 Å²	132	138.3 Å²	138.3	86%	0.857	80%	0.795	S	S	*	*				-138.7	178.9	108.3	39.2	-28.4	0	0	0	115.2
508	S	33.3	Very low	36.1	Very low	106 Å²	106	137 Å²	137	74%	0.741	80%	0.797	S	S	*	*			trans	-85.4	153.4	-171.5	47.9	0	0	0	0	115.6
509	L	38.8	Very low	36.1	Very low	173 Å²	173	134.6 Å²	134.6	91%	0.906	80%	0.8	S	S	*	*			trans	179.4	139.7	131.4	-118.1	68.2	0	0	0	108.5
510	G	36.2	Very low	36.6	Very low	65 Å²	65	132.2 Å²	132.2	67%	0.67	80%	0.798	S	S	*	*			cis	143.7	101.2	-13.7	0	0	0	0	0	113.9
511	K	42.6	Very low	36.7	Very low	207 Å²	207	137.2 Å²	137.2	90%	0.9	80%	0.798	S	S	*	*			trans	-167.4	144.2	147.4	-108.5	160.4	-172	-178.9	0	113.9
512	C	30.8	Very low	37.3	Very low	107 Å²	107	140.2 Å²	140.2	72%	0.723	81%	0.807	S	S	*	*			trans	-54	169.3	-179.8	28	0	0	0	0	115.5
513	Y	39.6	Very low	37.3	Very low	217 Å²	217	138.5 Å²	138.5	85%	0.851	80%	0.802	S	S	*	*			cis	-147.6	161.1	36.3	30.1	-93.9	0	0	0	115.6
514	E	35.5	Very low	37.3	Very low	170 Å²	170	141.3 Å²	141.3	79%	0.794	80%	0.8	S	S	*	*			trans	-82.5	-177.9	174.9	-45.2	-170.5	96.6	0	0	110.1
515	D	40.8	Very low	36.9	Very low	134 Å²	134	141.9 Å²	141.9	72%	0.717	80%	0.796	S	S	*	*			cis	-134.4	140.8	39.9	-92.5	-72.2	0	0	0	112.1
516	N	39.1	Very low	37.2	Very low	127 Å²	127	139.7 Å²	139.7	68%	0.679	80%	0.795	S	S	*	*				78.9	141.3	71.9	-138	-4.5	0	0	0	111.7
517	C	37.6	Very low	37	Very low	119 Å²	119	142 Å²	142	80%	0.804	80%	0.798	S	S	*	*			cis	-155.6	174.4	16.1	-171.4	0	0	0	0	111.5
518	G	38	Very low	36.9	Very low	72 Å²	72	142.5 Å²	142.5	74%	0.742	80%	0.799	S	S	*	*			trans	110	61.4	145.3	0	0	0	0	0	119
519	S	36.6	Very low	37	Very low	125 Å²	125	142.2 Å²	142.2	87%	0.874	80%	0.797	S	S	*	*			trans	-79.8	141.7	162.1	-76.7	0	0	0	0	112.6
520	S	40.3	Very low	36.7	Very low	121 Å²	121	141.6 Å²	141.6	85%	0.846	79%	0.792	S	S	*	*			trans	-142.7	147	143.4	70.4	0	0	0	0	110.5
521	R	33.7	Very low	36.7	Very low	231 Å²	231	146.3 Å²	146.3	87%	0.872	80%	0.801	S	S	*	*			trans	-109.5	151.5	-178	-57.7	172.5	-179.1	169.3	-0.9	108.7
522	L	38.2	Very low	36.5	Very low	169 Å²	169	141.8 Å²	141.8	89%	0.885	79%	0.791	S	S	*	*				-173.9	156.7	114.6	-99.4	162.5	0	0	0	112.8
523	T	33.6	Very low	36.9	Very low	121 Å²	121	142.9 Å²	142.9	74%	0.742	80%	0.797	S	S	*	*			trans	-69.6	153.3	171.3	52.2	0	0	0	0	110.7
524	K	38.2	Very low	36.6	Very low	174 Å²	174	141 Å²	141	76%	0.757	79%	0.794	S	S	*	*				178.9	152.5	76.6	-175.4	168.5	-177.7	176.6	0	112.8
525	D	31.7	Very low	36.7	Very low	127 Å²	127	139.1 Å²	139.1	68%	0.679	80%	0.799	S	S	*	*			trans	-11.5	132.2	165.4	-20.7	-41.1	0	0	0	119.4
526	S	40.9	Very low	36.4	Very low	120 Å²	120	137.2 Å²	137.2	84%	0.839	80%	0.796	S	S	*	*				-176.9	147.5	126.4	-81.1	0	0	0	0	113
527	N	31.8	Very low	36.3	Very low	165 Å²	165	140.6 Å²	140.6	88%	0.882	81%	0.808	S	S	*	*			trans	-84.1	135.5	173.8	-52.6	-69.9	0	0	0	111.2
528	T	38.2	Very low	36.1	Very low	143 Å²	143	140.5 Å²	140.5	88%	0.877	81%	0.808	S	S	*	*			trans	-145.2	146.8	154.5	-48	0	0	0	0	111.1
529	S	34.5	Very low	36.2	Very low	100 Å²	100	145.8 Å²	145.8	70%	0.699	82%	0.817	S	S	*	*			trans	-81.5	161.6	-179.1	-172.7	0	0	0	0	113.7
530	M	32.3	Very low	36	Very low	160 Å²	160	143 Å²	143	79%	0.788	81%	0.808	S	S	*	*			trans	3.3	136.2	153.3	-58.2	-73.1	-162.3	0	0	118.7
531	N	36.7	Very low	35.8	Very low	163 Å²	163	143.1 Å²	143.1	87%	0.872	81%	0.809	S	S	*	*				-166.1	140.9	119.5	-99.1	-26.3	0	0	0	113.2
532	T	38.8	Very low	36.1	Very low	112 Å²	112	137.4 Å²	137.4	69%	0.687	80%	0.802	S	S	*	*			trans	-109.7	140.6	174.4	51.8	0	0	0	0	111.3
533	P	39.3	Very low	36.1	Very low	131 Å²	131	136 Å²	136	85%	0.851	80%	0.795	S	S	*	*			trans	-89.1	130.2	159.5	-6.5	25.7	0	0	0	111.3
534	F	32.5	Very low	36	Very low	178 Å²	178	135.1 Å²	135.1	78%	0.781	79%	0.794	S	S	*	*			trans	-80.7	159.6	166.3	-87.6	-104.4	0	0	0	111.3
535	S	38.4	Very low	35.9	Very low	129 Å²	129	136 Å²	136	90%	0.902	80%	0.798	S	S	*	*			trans	-145.1	135	146.8	-81.6	0	0	0	0	108.8
536	S	34.7	Very low	36.1	Very low	94 Å²	94	135 Å²	135	66%	0.657	80%	0.802	S	S	*	*			trans	-145.5	136.8	-165.9	56.9	0	0	0	0	111.7
537	H	36.7	Very low	35.6	Very low	199 Å²	199	134.1 Å²	134.1	92%	0.921	80%	0.796	S	S	*	*			trans	-136	143.8	171.5	-77.1	-3.1	0	0	0	109.2
538	S	32.6	Very low	35.7	Very low	116 Å²	116	133 Å²	133	81%	0.811	79%	0.794	S	S	*	*			trans	-152.3	121.5	-162.2	45.8	0	0	0	0	114.3
539	I	39.8	Very low	35.5	Very low	183 Å²	183	131 Å²	131	94%	0.938	79%	0.786	S	S	*	*			trans	-151.6	142.8	169.1	-53.3	-179.1	0	0	0	106
540	G	34.3	Very low	35.5	Very low	67 Å²	67	131.9 Å²	131.9	69%	0.691	79%	0.787	S	S	*	*			cis	169.9	160.7	-4.8	0	0	0	0	0	110.3
541	S	34.1	Very low	35.7	Very low	123 Å²	123	130.8 Å²	130.8	86%	0.86	79%	0.789	S	S	*	*			trans	-139.4	154.3	-176.3	-56.5	0	0	0	0	111.9
542	P	41.8	Very low	35.4	Very low	112 Å²	112	129.5 Å²	129.5	73%	0.727	78%	0.782	S	S	*	*				-150.7	156.8	118.6	37.3	-20.9	0	0	0	117.2
543	N	36.7	Very low	35.2	Very low	138 Å²	138	128.5 Å²	128.5	74%	0.738	78%	0.78	S	S	*	*			trans	37.2	133.2	141.5	-49	-11.2	0	0	0	121.1
544	S	32.3	Very low	35	Very low	103 Å²	103	127.4 Å²	127.4	72%	0.72	78%	0.775	S	S	*	*			cis	81.5	97.8	36	-59.3	0	0	0	0	117.5
545	F	36.8	Very low	35.3	Very low	192 Å²	192	126.4 Å²	126.4	84%	0.842	78%	0.777	S	S	*	*			trans	-158.4	132.1	154.8	-69.5	-61.4	0	0	0	106.9
546	S	34.3	Very low	35.2	Very low	108 Å²	108	125.9 Å²	125.9	76%	0.755	77%	0.769	S	S	*	*				64	136.4	74.5	-56.1	0	0	0	0	114.4
547	S	30.7	Very low	35.3	Very low	101 Å²	101	132.2 Å²	132.2	71%	0.706	78%	0.778	S	S	*	*			cis	-179.8	177.4	-11.7	45.2	0	0	0	0	110.3
548	V	33.6	Very low	35.3	Very low	141 Å²	141	128.6 Å²	128.6	86%	0.855	77%	0.77	S	S	*	*			trans	96.6	151.1	161.4	-37.6	0	0	0	0	122.1
549	S	34	Very low	35.3	Very low	100 Å²	100	126.3 Å²	126.3	70%	0.699	77%	0.765	S	S	*	*			trans	-84.9	-174.7	-176.9	40.8	0	0	0	0	113.1
550	V	34.5	Very low	35.2	Very low	120 Å²	120	122.5 Å²	122.5	73%	0.727	76%	0.761	S	S	*	*			cis	-163.8	-178.6	35.6	-142.1	0	0	0	0	112.2
551	V	38.2	Very low	35	Very low	136 Å²	136	130.8 Å²	130.8	82%	0.824	77%	0.771	S	S	*	*			trans	65.4	154.6	157.9	-66.3	0	0	0	0	120.6
552	D	30.3	Very low	35	Very low	136 Å²	136	131.1 Å²	131.1	73%	0.727	77%	0.769	S	S	*	*			cis	-168.5	160.2	-29.4	-179.2	32	0	0	0	110.3
553	S	34	Very low	34.7	Very low	92 Å²	92	132.5 Å²	132.5	64%	0.643	78%	0.775	S	S	*	*			trans	34	119.3	156.5	-69.4	0	0	0	0	119.7
554	S	36	Very low	34.6	Very low	108 Å²	108	129.3 Å²	129.3	76%	0.755	78%	0.775	S	S	*	*				178.4	-169	68	51.9	0	0	0	0	109.9
555	L	38.5	Very low	34.8	Very low	157 Å²	157	132.5 Å²	132.5	82%	0.822	78%	0.782	S	S	*	*			cis	-151.5	-151.2	11.3	-163.4	46.8	0	0	0	110.7
556	T	34.8	Very low	34.7	Very low	117 Å²	117	126.4 Å²	126.4	72%	0.718	77%	0.773	S	S	*	*			trans	-122.4	148.1	-166.4	58.1	0	0	0	0	115.3
557	R	37.3	Very low	34.7	Very low	227 Å²	227	129.2 Å²	129.2	86%	0.857	77%	0.774	S	S	*	*				-178.7	137.2	123.4	-106.8	171.1	150.3	-117.6	-2.7	117.3
558	T	37.9	Very low	35	Very low	123 Å²	123	131.8 Å²	131.8	76%	0.755	78%	0.778	S	S	*	*			trans	-3.1	155.3	145.3	57	0	0	0	0	121.2
559	G	31.7	Very low	34.9	Very low	69 Å²	69	128.2 Å²	128.2	71%	0.711	77%	0.77	S	S	*	*			cis	143.1	154.2	1.3	0	0	0	0	0	114.2
560	A	36.8	Very low	34.9	Very low	102 Å²	102	130 Å²	130	84%	0.843	78%	0.777	S	S	*	*			trans	71	143.9	-177.4	0	0	0	0	0	117.1
561	R	30.6	Very low	34.9	Very low	241 Å²	241	132.7 Å²	132.7	91%	0.909	79%	0.787	S	S	*	*			cis	94.9	105.5	13.5	-76.9	-171.7	147.2	-147	-2.4	118.6
562	T	35.2	Very low	34.8	Very low	131 Å²	131	131 Å²	131	80%	0.804	78%	0.781	S	S	*	*			trans	176.5	118.4	144.1	33.3	0	0	0	0	107.6
563	T	34.1	Very low	34.8	Very low	141 Å²	141	129.8 Å²	129.8	87%	0.865	78%	0.784	S	S	*	*				79.7	115.9	62.8	60	0	0	0	0	116.9
564	G	35.6	Very low	34.8	Very low	71 Å²	71	133.6 Å²	133.6	73%	0.732	79%	0.793	S	S	*	*			trans	144.4	142.3	168.5	0	0	0	0	0	112.7
565	I	36.6	Very low	34.6	Very low	170 Å²	170	135.5 Å²	135.5	87%	0.872	80%	0.795	S	S	*	*			cis	176.9	139.6	-28.7	-102.8	157.5	0	0	0	105.5
566	G	34.2	Very low	34.3	Very low	64 Å²	64	135.5 Å²	135.5	66%	0.66	80%	0.796	S	S	*	*			trans	81.6	163	171.7	0	0	0	0	0	116.7
567	H	34.2	Very low	34.3	Very low	166 Å²	166	136.6 Å²	136.6	77%	0.769	79%	0.793	S	S	*	*			cis	-165.8	140.5	-11.7	-120.4	-79.6	0	0	0	109.5
568	I	37.5	Very low	34.2	Very low	156 Å²	156	130.9 Å²	130.9	80%	0.8	79%	0.785	S	S	*	*			trans	63.4	139.7	158.2	-57	156.9	0	0	0	116.4
569	G	30.8	Very low	34	Very low	65 Å²	65	132.9 Å²	132.9	67%	0.67	79%	0.791	S	S	*	*			cis	133.6	70.7	-1.1	0	0	0	0	0	113.1
570	T	35.2	Very low	34.4	Very low	139 Å²	139	134.4 Å²	134.4	85%	0.853	79%	0.787	S	S	*	*			trans	-139.7	138.2	174.8	37.3	0	0	0	0	111.7
571	N	34.3	Very low	35	Very low	176 Å²	176	135 Å²	135	94%	0.941	78%	0.784	S	S	*	*			trans	-87.9	136.4	176.1	-67.3	-40	0	0	0	110.8
572	S	35.3	Very low	36.6	Very low	100 Å²	100	128 Å²	128	70%	0.699	77%	0.765	S	S	*	*			trans	-145.5	134.9	157.2	59	0	0	0	0	110.4
573	S	30.2	Very low	39	Very low	111 Å²	111	124.8 Å²	124.8	78%	0.776	75%	0.748	S	S	*	*			trans	-79.5	127.3	-175	-173.6	0	0	0	0	110.9
574	M	33.5	Very low	41.8	Very low	172 Å²	172	118.3 Å²	118.3	85%	0.847	71%	0.708	S	S	*	*			trans	-114.1	57.9	177.4	-74.7	-68.1	157.3	0	0	111.4	N576	M574-N576 VanDerWaalsContact C-N 3.34Å; M574-N576 PolarHBondContact O-N 2.85Å
575	N	33.2	Very low	44.6	Very low	148 Å²	148	120 Å²	120	79%	0.791	69%	0.692	S	S	*	*			trans	-87.6	72.2	170.2	-171.5	25.4	0	0	0	111.1
576	N	32.4	Very low	47.4	Very low	157 Å²	157	113.6 Å²	113.6	84%	0.84	66%	0.659	S	S	*	*			trans	-160.1	93.8	164.4	-120.6	-20.2	0	0	0	110.6	M574	M574-N576 VanDerWaalsContact C-N 3.34Å; M574-N576 PolarHBondContact O-N 2.85Å
577	Q	34.7	Very low	50.2	Low	140 Å²	140	115.3 Å²	115.3	65%	0.654	65%	0.653	S	S	*	*			trans	-112	136.8	156	-97.8	-166.3	-31.8	0	0	107.7	N579	Q577-N579 PolarHBondContact O-N 3.38Å
578	P	33.9	Very low	52.9	Low	107 Å²	107	113.3 Å²	113.3	70%	0.695	65%	0.648	S	S	*	*			trans	-65.1	132.2	176.1	27.9	-33.5	0	0	0	109.5	T580	P578-T580 PolarHBondContact O-N 2.91Å
579	N	33.2	Very low	55.5	Low	164 Å²	164	107.8 Å²	107.8	88%	0.877	63%	0.629	S	S	*	*			trans	-67.2	81	157.9	-78.8	-23.7	0	0	0	107.9	Q577 S581	Q577-N579 PolarHBondContact O-N 3.38Å; N579-S581 PolarHBondContact O-N 3.32Å
580	T	40.1	Very low	58.6	Low	101 Å²	101	109.3 Å²	109.3	62%	0.62	62%	0.615	S	S	*	*			trans	-57.2	121.2	152.1	46.5	0	0	0	0	105.8	P578 L582	P578-T580 PolarHBondContact O-N 2.91Å; T580-L582 WeakPolarHBondContact O-CD1 3.27Å; T580-L582 PolarHBondContact O-N 3.46Å
581	S	49.8	Very low	61.5	Low	114 Å²	114	102.7 Å²	102.7	80%	0.797	57%	0.574	S	S	*	*			trans	-67.2	88.6	-179.8	38.5	0	0	0	0	108.5	N579 S583	N579-S581 PolarHBondContact O-N 3.32Å; S581-S583 VanDerWaalsContact C-N 3.27Å; S581-S583 PolarHBondContact O-N 3.42Å
582	L	64.8	Low	64.3	Low	96 Å²	96	97 Å²	97	50%	0.503	54%	0.54	S	S	.	.			trans	-59.6	98.2	170.6	-96.3	71.9	0	0	0	106.8	T580 I584	T580-L582 WeakPolarHBondContact O-CD1 3.27Å; T580-L582 PolarHBondContact O-N 3.46Å; L582-I584 HydrophobicContact CB-CD1 4.03Å; L582-I584 HydrophobicContact CB-CG1 4.13Å; L582-I584 HydrophobicContact CD2-CD1 4.33Å; L582-I584 WeakPolarHBondContact O-CG1 3.5Å; L582-I584 PolarHBondContact O-N 2.87Å
583	S	84.8	Confident	67	Low	63 Å²	63	93 Å²	93	44%	0.441	51%	0.512	S	S	.	.			trans	-68.6	98.2	176.2	46.3	0	0	0	0	107	S581 W585 G594	S581-S583 VanDerWaalsContact C-N 3.27Å; S581-S583 PolarHBondContact O-N 3.42Å; S583-W585 VanDerWaalsContact O-CE3 3.31Å; S583-W585 WeakPolarHBondContact O-CZ3 3.43Å; S583-G594 PolarHBondContact O-N 3.04Å
584	I	93.3	Very high	69.8	Low	5 Å²	5	88.9 Å²	88.9	3%	0.026	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	121.2	-178.7	-61.2	173.2	0	0	0	108.3	L582 L591 Y592 C593 V643 L646 K647	L582-I584 HydrophobicContact CB-CD1 4.03Å; L582-I584 HydrophobicContact CB-CG1 4.13Å; L582-I584 HydrophobicContact CD2-CD1 4.33Å; L582-I584 WeakPolarHBondContact O-CG1 3.5Å; L582-I584 PolarHBondContact O-N 2.87Å; I584-L591 HydrophobicContact CG2-CD1 3.95Å; I584-Y592 VanDerWaalsContact CA-O 3.26Å; I584-Y592 WeakPolarHBondContact CA-O 3.48Å; I584-C593 HydrophobicContact CG1-CB 4.13Å; I584-V643 HydrophobicContact CG2-CG1 4.42Å; I584-L646 HydrophobicContact CD1-CB 3.84Å; I584-L646 HydrophobicContact CG2-CB 3.94Å; I584-L646 HydrophobicContact CG2-CD1 4.16Å; I584-K647 HydrophobicContact CB-CG 4.15Å; I584-K647 WeakPolarHBondContact O-CE 3.43Å
585	W	94.4	Very high	72.4	Confident	105 Å²	105	90.5 Å²	90.5	40%	0.398	49%	0.492	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	168.7	178.1	69.2	100.1	0	0	0	110.6	S583 Y592	S583-W585 VanDerWaalsContact O-CE3 3.31Å; S583-W585 WeakPolarHBondContact O-CZ3 3.43Å; W585-Y592 HydrophobicContact CD2-CG 4.32Å; W585-Y592 VanDerWaalsContact CE2-CB 3.49Å; W585-Y592 AromaticContact CE2-CG 3.72Å; W585-Y592 HydrophobicContact CH2-CG 4.46Å; W585-Y592 AromaticContact CZ2-CD1 3.96Å; W585-Y592 HydrophobicContact CZ2-CD1 3.96Å; W585-Y592 AromaticContact CZ2-CG 3.83Å; W585-Y592 HydrophobicContact CZ2-CG 3.83Å; W585-Y592 PolarHBondContact N-O 2.99Å; W585-Y592 VanDerWaalsContact N-O 3.13Å; W585-Y592 AromaticContact NE1-CD2 3.75Å; W585-Y592 AromaticContact NE1-CG 3.82Å; W585-Y592 PolarHBondContact O-N 3.39Å
586	I	95.6	Very high	75.1	Confident	36 Å²	36	89 Å²	89	19%	0.185	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	134	170.6	-67.6	169.2	0	0	0	107.6	R590 L591 I623 G624 I628 V643	I586-R590 VanDerWaalsContact CA-O 3.27Å; I586-R590 WeakPolarHBondContact CA-O 3.41Å; I586-L591 HydrophobicContact CG1-CD1 3.89Å; I586-I623 HydrophobicContact CB-CG2 4.39Å; I586-I623 HydrophobicContact CD1-CG2 3.78Å; I586-I623 HydrophobicContact CG1-CG2 3.97Å; I586-I623 HydrophobicContact CG2-CG2 3.52Å; I586-G624 WeakPolarHBondContact CD1-O 3.39Å; I586-I628 HydrophobicContact CD1-CG2 4.1Å; I586-V643 HydrophobicContact CD1-CG2 3.35Å; I586-V643 HydrophobicContact CG1-CG2 3.68Å
587	D	92.7	Very high	78	Confident	100 Å²	100	85.3 Å²	85.3	54%	0.535	46%	0.464	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	148	172.2	-169.6	18.6	0	0	0	109.9	G589 R590 Y592	D587-G589 PolarHBondContact O-N 2.92Å; D587-R590 PolarHBondContact N-O 2.6Å; D587-R590 WeakPolarHBondContact O-CA 3.41Å; D587-R590 WeakPolarHBondContact O-CB 3.37Å; D587-R590 PolarHBondContact O-N 3.02Å; D587-Y592 HydrophobicContact CB-CD2 4.38Å; D587-Y592 HydrophobicContact CB-CE2 4.08Å
588	D	91.7	Very high	80.8	Confident	125 Å²	125	79.3 Å²	79.3	67%	0.668	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	40.1	40.8	-172.4	-168.6	42.2	0	0	0	114.8	R590	D588-R590 PolarHBondContact O-N 3.46Å; D588-R590 IonicContact OD2-NE 2.95Å; D588-R590 IonicContact OD2-NH2 2.78Å
589	G	92.4	Very high	83.7	Confident	39 Å²	39	80 Å²	80	40%	0.402	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.9	19.4	-178.3	0	0	0	0	0	115.1	D587 I623	D587-G589 PolarHBondContact O-N 2.92Å; G589-I623 WeakPolarHBondContact O-CB 3.42Å; G589-I623 VanDerWaalsContact O-CD1 3.25Å; G589-I623 WeakPolarHBondContact O-CD1 3.44Å
590	R	94.9	Very high	86.7	Confident	98 Å²	98	76.7 Å²	76.7	37%	0.37	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	144	177.6	-57.2	170.5	-167.3	-158.5	0.5	110.3	I586 D587 D588 Y592 Y598	I586-R590 VanDerWaalsContact CA-O 3.27Å; I586-R590 WeakPolarHBondContact CA-O 3.41Å; D587-R590 PolarHBondContact N-O 2.6Å; D587-R590 WeakPolarHBondContact O-CA 3.41Å; D587-R590 WeakPolarHBondContact O-CB 3.37Å; D587-R590 PolarHBondContact O-N 3.02Å; D588-R590 PolarHBondContact O-N 3.46Å; D588-R590 IonicContact OD2-NE 2.95Å; D588-R590 IonicContact OD2-NH2 2.78Å; R590-Y592 HydrophobicContact CB-CD2 4.48Å; R590-Y592 HydrophobicContact CB-CE2 3.84Å; R590-Y598 CarbonylContact C-O 3.48Å; R590-Y598 WeakPolarHBondContact CA-O 3.26Å
591	L	95.5	Very high	89.3	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91	121.2	173.2	177.5	75.8	0	0	0	109.2	I584 I586 C597 Y598 I623 I628 L646 I653	I584-L591 HydrophobicContact CG2-CD1 3.95Å; I586-L591 HydrophobicContact CG1-CD1 3.89Å; L591-C597 CarbonylContact O-C 3.46Å; L591-C597 VanDerWaalsContact O-CA 3.31Å; L591-C597 WeakPolarHBondContact O-CA 3.34Å; L591-Y598 HydrophobicContact CD2-CD2 3.98Å; L591-Y598 HydrophobicContact CG-CD2 4.39Å; L591-Y598 PolarHBondContact N-O 2.86Å; L591-Y598 PolarHBondContact O-N 3.47Å; L591-I623 HydrophobicContact CB-CD1 4.32Å; L591-I628 HydrophobicContact CB-CG2 4.32Å; L591-I628 HydrophobicContact CD1-CG2 4.09Å; L591-I628 HydrophobicContact CD2-CD1 3.91Å; L591-I628 HydrophobicContact CD2-CG2 4.24Å; L591-I628 HydrophobicContact CG-CG2 4.46Å; L591-L646 HydrophobicContact CD1-CD1 4.12Å; L591-L646 HydrophobicContact CD2-CD1 4.29Å; L591-I653 HydrophobicContact CD2-CD1 4.01Å; L591-I653 HydrophobicContact CD2-CG2 4.3Å
592	Y	94.8	Very high	91.4	Very high	57 Å²	57	70.2 Å²	70.2	22%	0.224	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	140.3	170	-67.5	-97.3	0	0	0	109.5	I584 W585 D587 R590 K596 C597	I584-Y592 VanDerWaalsContact CA-O 3.26Å; I584-Y592 WeakPolarHBondContact CA-O 3.48Å; W585-Y592 HydrophobicContact CD2-CG 4.32Å; W585-Y592 VanDerWaalsContact CE2-CB 3.49Å; W585-Y592 AromaticContact CE2-CG 3.72Å; W585-Y592 HydrophobicContact CH2-CG 4.46Å; W585-Y592 AromaticContact CZ2-CD1 3.96Å; W585-Y592 HydrophobicContact CZ2-CD1 3.96Å; W585-Y592 AromaticContact CZ2-CG 3.83Å; W585-Y592 HydrophobicContact CZ2-CG 3.83Å; W585-Y592 PolarHBondContact N-O 2.99Å; W585-Y592 VanDerWaalsContact N-O 3.13Å; W585-Y592 AromaticContact NE1-CD2 3.75Å; W585-Y592 AromaticContact NE1-CG 3.82Å; W585-Y592 PolarHBondContact O-N 3.39Å; D587-Y592 HydrophobicContact CB-CD2 4.38Å; D587-Y592 HydrophobicContact CB-CE2 4.08Å; R590-Y592 HydrophobicContact CB-CD2 4.48Å; R590-Y592 HydrophobicContact CB-CE2 3.84Å; Y592-K596 CarbonylContact C-O 3.56Å; Y592-K596 WeakPolarHBondContact CA-O 3.49Å; Y592-C597 HydrophobicContact CD1-CB 4.11Å; Y592-C597 HydrophobicContact CE1-CB 3.96Å
593	C	91.9	Very high	92.9	Very high	16 Å²	16	67.4 Å²	67.4	11%	0.108	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.3	89.9	-178.5	178	0	0	0	0	109.3	I584 H595 K596 Y598	I584-C593 HydrophobicContact CG1-CB 4.13Å; C593-H595 PolarHBondContact O-N 3.46Å; C593-K596 PolarHBondContact N-O 3.04Å; C593-K596 PolarHBondContact O-N 2.95Å; C593-K596 VanDerWaalsContact O-N 3.14Å; C593-Y598 HydrophobicContact CB-CE2 4.01Å
594	G	88.5	Confident	93.3	Very high	23 Å²	23	64.4 Å²	64.4	24%	0.237	35%	0.346	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.1	-129.8	-161	0	0	0	0	0	109.7	S583 K596	S583-G594 PolarHBondContact O-N 3.04Å; G594-K596 VanDerWaalsContact C-N 3.28Å; G594-K596 PolarHBondContact O-N 3Å
595	H	87.7	Confident	93.3	Very high	207 Å²	207	64.9 Å²	64.9	96%	0.958	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	5	177.7	-55.7	-75.4	0	0	0	114.9	C593	C593-H595 PolarHBondContact O-N 3.46Å
596	K	91.2	Very high	93.3	Very high	116 Å²	116	60 Å²	60	50%	0.504	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	129.1	178.3	-58.7	-173.6	-170.8	-58.2	0	110.3	Y592 C593 G594 Y598	Y592-K596 CarbonylContact C-O 3.56Å; Y592-K596 WeakPolarHBondContact CA-O 3.49Å; C593-K596 PolarHBondContact N-O 3.04Å; C593-K596 PolarHBondContact O-N 2.95Å; C593-K596 VanDerWaalsContact O-N 3.14Å; G594-K596 VanDerWaalsContact C-N 3.28Å; G594-K596 PolarHBondContact O-N 3Å; K596-Y598 HydrophobicContact CB-CE2 4.02Å; K596-Y598 WeakPolarHBondContact CD-OH 3.42Å
597	C	91.6	Very high	93.1	Very high	80 Å²	80	61.7 Å²	61.7	54%	0.541	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	145.8	167	62.5	0	0	0	0	110.7	L591 Y592	L591-C597 CarbonylContact O-C 3.46Å; L591-C597 VanDerWaalsContact O-CA 3.31Å; L591-C597 WeakPolarHBondContact O-CA 3.34Å; Y592-C597 HydrophobicContact CD1-CB 4.11Å; Y592-C597 HydrophobicContact CE1-CB 3.96Å
598	Y	95.1	Very high	92.8	Very high	14 Å²	14	57.6 Å²	57.6	6%	0.055	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	138.4	174.3	-51.4	-91.3	0	0	0	109.6	R590 L591 C593 K596 V604 I620 I623 I653 W654 P655	R590-Y598 CarbonylContact C-O 3.48Å; R590-Y598 WeakPolarHBondContact CA-O 3.26Å; L591-Y598 HydrophobicContact CD2-CD2 3.98Å; L591-Y598 HydrophobicContact CG-CD2 4.39Å; L591-Y598 PolarHBondContact N-O 2.86Å; L591-Y598 PolarHBondContact O-N 3.47Å; C593-Y598 HydrophobicContact CB-CE2 4.01Å; K596-Y598 HydrophobicContact CB-CE2 4.02Å; K596-Y598 WeakPolarHBondContact CD-OH 3.42Å; Y598-V604 HydrophobicContact CD1-CG1 3.73Å; Y598-V604 HydrophobicContact CE1-CG1 4.01Å; Y598-I620 HydrophobicContact CG-CD1 4.4Å; Y598-I623 WeakPolarHBondContact O-CD1 3.46Å; Y598-I653 HydrophobicContact CE2-CG2 4.3Å; Y598-I653 PolarHBondContact OH-O 3.44Å; Y598-W654 WeakPolarHBondContact OH-CA 3.26Å; Y598-P655 HydrophobicContact CE1-CB 4.3Å; Y598-P655 WeakPolarHBondContact OH-CD 3.36Å
599	Q	94.7	Very high	92.2	Very high	121 Å²	121	59.8 Å²	59.8	57%	0.565	32%	0.318	S	S	*	.			trans	-117.5	167	179.8	64.7	-174.9	10.9	0	0	111	G601 A602	Q599-G601 PolarHBondContact O-N 3.15Å; Q599-A602 WeakPolarHBondContact O-CB 3.18Å; Q599-A602 PolarHBondContact O-N 3.23Å
600	I	95.6	Very high	91.2	Very high	95 Å²	95	62 Å²	62	49%	0.487	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	135.6	171.8	-60	175.3	0	0	0	109.2	I623	I600-I623 HydrophobicContact CG1-CB 4.4Å; I600-I623 HydrophobicContact CG1-CD1 4.3Å; I600-I623 HydrophobicContact CG1-CG1 4.05Å
601	G	94.6	Very high	89.6	Confident	51 Å²	51	61.4 Å²	61.4	53%	0.526	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	90.5	-18	-173.1	0	0	0	0	0	115.1	Q599 S603 I620	Q599-G601 PolarHBondContact O-N 3.15Å; G601-S603 PolarHBondContact O-N 3.47Å; G601-I620 PolarHBondContact N-O 2.93Å
602	A	94.3	Very high	87.8	Confident	27 Å²	27	64 Å²	64	22%	0.223	36%	0.362	C	S	.	.			trans	-62.4	131.8	178.6	0	0	0	0	0	111.4	Q599 T619 I620	Q599-A602 WeakPolarHBondContact O-CB 3.18Å; Q599-A602 PolarHBondContact O-N 3.23Å; A602-T619 CarbonylContact O-C 3.59Å; A602-T619 WeakPolarHBondContact O-CA 3.31Å; A602-I620 PolarHBondContact O-N 3.36Å
603	S	95.1	Very high	86	Confident	37 Å²	37	67 Å²	67	26%	0.259	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	130.4	173.3	-166.7	0	0	0	0	110.6	G601 G618 N656	G601-S603 PolarHBondContact O-N 3.47Å; S603-G618 CarbonylContact C-O 3.52Å; S603-G618 VanDerWaalsContact CA-O 3.27Å; S603-G618 WeakPolarHBondContact CA-O 3.37Å; S603-G618 PolarHBondContact OG-O 3.02Å; S603-N656 PolarHBondContact O-N 3.06Å; S603-N656 WeakPolarHBondContact OG-CB 3.45Å; S603-N656 PolarHBondContact OG-ND2 3.41Å
604	V	94.6	Very high	85.2	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	151.8	-171.6	-69	0	0	0	0	110.6	Y598 T617 G618 I620 I630 I653 W654	Y598-V604 HydrophobicContact CD1-CG1 3.73Å; Y598-V604 HydrophobicContact CE1-CG1 4.01Å; V604-T617 WeakPolarHBondContact O-CA 3.5Å; V604-G618 PolarHBondContact N-O 3.43Å; V604-G618 PolarHBondContact O-N 2.74Å; V604-I620 HydrophobicContact CG1-CD1 4.1Å; V604-I620 HydrophobicContact CG1-CG1 4.17Å; V604-I620 HydrophobicContact CG2-CD1 4.49Å; V604-I620 HydrophobicContact CG2-CG1 3.79Å; V604-I630 HydrophobicContact CG2-CD1 3.94Å; V604-I630 HydrophobicContact CG2-CG1 4.18Å; V604-I630 HydrophobicContact CG2-CG2 4.09Å; V604-I653 HydrophobicContact CB-CD1 4.12Å; V604-I653 HydrophobicContact CB-CG1 4.02Å; V604-I653 HydrophobicContact CG1-CD1 4.12Å; V604-I653 HydrophobicContact CG1-CG1 4.2Å; V604-I653 HydrophobicContact CG2-CD1 4.19Å; V604-W654 WeakPolarHBondContact CA-O 3.37Å
605	I	93.5	Very high	85.1	Confident	16 Å²	16	76.6 Å²	76.6	8%	0.082	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	127.6	163.7	-62.1	162.6	0	0	0	106.4	R615 T617 I653 W654 N656	I605-R615 HydrophobicContact CG2-CG 4.26Å; I605-T617 HydrophobicContact CG1-CG2 3.98Å; I605-I653 WeakPolarHBondContact O-CA 3.28Å; I605-W654 HydrophobicContact CB-CG 4.45Å; I605-W654 HydrophobicContact CG2-CZ2 3.96Å; I605-W654 PolarHBondContact N-O 3.43Å; I605-W654 PolarHBondContact O-N 2.98Å; I605-W654 VanDerWaalsContact O-N 3.08Å; I605-N656 HydrophobicContact CD1-CB 4.46Å; I605-N656 HydrophobicContact CG1-CB 4.08Å
606	L	92.9	Very high	85.2	Confident	1 Å²	1	67.1 Å²	67.1	1%	0.005	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	138.4	166.9	-172.2	82.7	0	0	0	108.3	R615 C616 I630 V641 L646 Y651 A652 I653	L606-R615 CarbonylContact O-C 3.58Å; L606-R615 VanDerWaalsContact O-CA 3.3Å; L606-R615 WeakPolarHBondContact O-CA 3.45Å; L606-C616 PolarHBondContact N-O 3.06Å; L606-C616 PolarHBondContact O-N 2.89Å; L606-I630 HydrophobicContact CB-CD1 3.99Å; L606-I630 HydrophobicContact CD1-CD1 4.05Å; L606-I630 HydrophobicContact CD2-CD1 4.41Å; L606-I630 HydrophobicContact CG-CD1 4.38Å; L606-V641 HydrophobicContact CD1-CG2 3.97Å; L606-V641 HydrophobicContact CD2-CG2 3.49Å; L606-V641 VanDerWaalsContact CD2-CG2 3.49Å; L606-V641 HydrophobicContact CG-CG2 4.39Å; L606-L646 HydrophobicContact CD1-CD2 4.32Å; L606-Y651 HydrophobicContact CD1-CD1 4.46Å; L606-Y651 HydrophobicContact CD1-CG 4.32Å; L606-Y651 HydrophobicContact CD2-CD1 3.73Å; L606-Y651 HydrophobicContact CD2-CE1 4.17Å; L606-Y651 HydrophobicContact CD2-CG 4.24Å; L606-Y651 HydrophobicContact CG-CD1 3.98Å; L606-Y651 HydrophobicContact CG-CG 4.33Å; L606-A652 WeakPolarHBondContact CA-O 3.35Å; L606-I653 HydrophobicContact CD1-CB 4.35Å
607	E	91.4	Very high	85.3	Confident	73 Å²	73	63.6 Å²	63.6	34%	0.341	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	123.2	175.2	-163.6	165.9	107.3	0	0	110.4	R615 Y651 A652 W654	E607-R615 HydrophobicContact CB-CG 4.3Å; E607-R615 HydrophobicContact CG-CB 4.17Å; E607-R615 HydrophobicContact CG-CG 4.02Å; E607-R615 WeakPolarHBondContact OE2-CD 3.39Å; E607-R615 IonicContact OE2-CZ 3.86Å; E607-R615 IonicContact OE2-NE 3.18Å; E607-R615 PolarHBondContact OE2-NE 2.88Å; E607-Y651 CarbonylContact O-C 3.55Å; E607-Y651 VanDerWaalsContact O-CA 3.29Å; E607-Y651 WeakPolarHBondContact O-CA 3.32Å; E607-A652 PolarHBondContact N-O 3.49Å; E607-A652 PolarHBondContact O-N 2.98Å; E607-W654 HydrophobicContact CB-CH2 3.36Å; E607-W654 HydrophobicContact CB-CZ2 3.93Å; E607-W654 HydrophobicContact CB-CZ3 4.04Å; E607-W654 VanDerWaalsContact CD-CH2 3.49Å; E607-W654 HydrophobicContact CG-CH2 4.03Å; E607-W654 WeakPolarHBondContact OE2-CZ2 3.2Å
608	G	87.9	Confident	85.4	Confident	13 Å²	13	59.8 Å²	59.8	13%	0.134	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	133.3	173.9	0	0	0	0	0	111.7	H614 R650	G608-H614 PolarHBondContact N-O 3Å; G608-H614 VanDerWaalsContact N-O 3.1Å; G608-R650 WeakPolarHBondContact CA-O 3.42Å
609	R	78.5	Confident	85.4	Confident	172 Å²	172	61.7 Å²	61.7	65%	0.649	36%	0.356	S	S	*	.	S	Bend	trans	-82.3	-17.1	-175.5	-164.3	166.9	175.5	108.5	-8.8	113.6	G611 G649 R650	R609-G611 PolarHBondContact O-N 3.43Å; R609-G649 VanDerWaalsContact CB-O 3.29Å; R609-G649 WeakPolarHBondContact CB-O 3.18Å; R609-G649 WeakPolarHBondContact CD-O 3.49Å; R609-R650 PolarHBondContact N-O 2.93Å
610	D	72	Confident	85.5	Confident	86 Å²	86	56 Å²	56	46%	0.46	33%	0.329	S	S	.	.	S	Bend	trans	-82.8	40.4	-171.4	-58	-27.6	0	0	0	114.1	S612 R650	D610-S612 PolarHBondContact O-N 2.96Å; D610-S612 PolarHBondContact O-OG 3.11Å; D610-S612 VanDerWaalsContact O-OG 3.13Å; D610-R650 WeakPolarHBondContact OD2-CD 3.22Å; D610-R650 IonicContact OD2-CZ 3.29Å; D610-R650 IonicContact OD2-NE 2.6Å; D610-R650 IonicContact OD2-NH1 2.83Å; D610-R650 PolarHBondContact OD2-NH1 3.05Å
611	G	60.8	Low	85.5	Confident	85 Å²	85	53.3 Å²	53.3	88%	0.876	32%	0.321	S	S	*	.	S	Bend	trans	62.1	-5.8	174.2	0	0	0	0	0	117.3	R609	R609-G611 PolarHBondContact O-N 3.43Å
612	S	56.7	Low	85.6	Confident	54 Å²	54	53.6 Å²	53.6	38%	0.378	32%	0.315	S	S	.	.	S	Bend	trans	-91.5	149.8	-178	36.4	0	0	0	0	110.3	D610 H614	D610-S612 PolarHBondContact O-N 2.96Å; D610-S612 PolarHBondContact O-OG 3.11Å; D610-S612 VanDerWaalsContact O-OG 3.13Å; S612-H614 PolarHBondContact O-N 3.19Å; S612-H614 PolarHBondContact OG-CD2 3.35Å
613	S	57.3	Low	85.7	Confident	121 Å²	121	53.3 Å²	53.3	85%	0.846	31%	0.31	S	S	*	.	S	Bend	trans	-74.9	40	-170.3	-154.7	0	0	0	0	114.1	R615	S613-R615 PolarHBondContact O-N 2.76Å; S613-R615 VanDerWaalsContact O-N 3.11Å
614	H	75.8	Confident	85.7	Confident	104 Å²	104	52.8 Å²	52.8	48%	0.481	31%	0.31	S	S	.	.			trans	-86.8	44.8	177.7	-58.3	-44.5	0	0	0	111.6	G608 S612 Y651	G608-H614 PolarHBondContact N-O 3Å; G608-H614 VanDerWaalsContact N-O 3.1Å; S612-H614 PolarHBondContact O-N 3.19Å; S612-H614 PolarHBondContact OG-CD2 3.35Å; H614-Y651 HydrophobicContact CB-CE1 4.15Å
615	R	86.6	Confident	85.6	Confident	135 Å²	135	59.3 Å²	59.3	51%	0.509	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92	118.3	166	-170.1	-178.5	-169.3	-97.2	4.6	108.6	I605 L606 E607 S613	I605-R615 HydrophobicContact CG2-CG 4.26Å; L606-R615 CarbonylContact O-C 3.58Å; L606-R615 VanDerWaalsContact O-CA 3.3Å; L606-R615 WeakPolarHBondContact O-CA 3.45Å; E607-R615 HydrophobicContact CB-CG 4.3Å; E607-R615 HydrophobicContact CG-CB 4.17Å; E607-R615 HydrophobicContact CG-CG 4.02Å; E607-R615 WeakPolarHBondContact OE2-CD 3.39Å; E607-R615 IonicContact OE2-CZ 3.86Å; E607-R615 IonicContact OE2-NE 3.18Å; E607-R615 PolarHBondContact OE2-NE 2.88Å; S613-R615 PolarHBondContact O-N 2.76Å; S613-R615 VanDerWaalsContact O-N 3.11Å
616	C	88.4	Confident	85.7	Confident	9 Å²	9	63.5 Å²	63.5	6%	0.061	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	124.2	176.3	63.1	0	0	0	0	113.1	L606 R632	L606-C616 PolarHBondContact N-O 3.06Å; L606-C616 PolarHBondContact O-N 2.89Å; C616-R632 HydrophobicContact CB-CG 3.99Å
617	T	92.9	Very high	85.8	Confident	41 Å²	41	64.7 Å²	64.7	25%	0.252	38%	0.375	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	141	166.6	-46.1	0	0	0	0	109.2	V604 I605 R632 C633 N656	V604-T617 WeakPolarHBondContact O-CA 3.5Å; I605-T617 HydrophobicContact CG1-CG2 3.98Å; T617-R632 WeakPolarHBondContact O-CA 3.33Å; T617-C633 PolarHBondContact O-N 2.8Å; T617-N656 HydrophobicContact CG2-CB 4.23Å; T617-N656 WeakPolarHBondContact CG2-ND2 2.77Å
618	G	94.1	Very high	86	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167.1	-167.9	-178.7	0	0	0	0	0	113.9	S603 V604 R631	S603-G618 CarbonylContact C-O 3.52Å; S603-G618 VanDerWaalsContact CA-O 3.27Å; S603-G618 WeakPolarHBondContact CA-O 3.37Å; S603-G618 PolarHBondContact OG-O 3.02Å; V604-G618 PolarHBondContact N-O 3.43Å; V604-G618 PolarHBondContact O-N 2.74Å; G618-R631 CarbonylContact C-O 3.57Å; G618-R631 WeakPolarHBondContact CA-O 3.34Å
619	T	96.2	Very high	86.4	Confident	54 Å²	54	60.8 Å²	60.8	33%	0.331	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	144.8	165.3	53.5	0	0	0	0	110.3	A602 A621 I630 R631	A602-T619 CarbonylContact O-C 3.59Å; A602-T619 WeakPolarHBondContact O-CA 3.31Å; T619-A621 PolarHBondContact O-N 3.28Å; T619-A621 VanDerWaalsContact O-N 3.12Å; T619-I630 CarbonylContact O-C 3.56Å; T619-I630 WeakPolarHBondContact O-CA 3.27Å; T619-R631 PolarHBondContact N-O 3.18Å; T619-R631 PolarHBondContact O-N 3.08Å
620	I	96.5	Very high	87.2	Confident	1 Å²	1	52.6 Å²	52.6	1%	0.005	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.7	111.4	174.9	-57.1	-178.4	0	0	0	108.5	Y598 G601 A602 V604 I623 A629 I630	Y598-I620 HydrophobicContact CG-CD1 4.4Å; G601-I620 PolarHBondContact N-O 2.93Å; A602-I620 PolarHBondContact O-N 3.36Å; V604-I620 HydrophobicContact CG1-CD1 4.1Å; V604-I620 HydrophobicContact CG1-CG1 4.17Å; V604-I620 HydrophobicContact CG2-CD1 4.49Å; V604-I620 HydrophobicContact CG2-CG1 3.79Å; I620-I623 HydrophobicContact CG2-CD1 3.95Å; I620-I623 HydrophobicContact CG2-CG1 3.53Å; I620-A629 CarbonylContact C-O 3.59Å; I620-I630 HydrophobicContact CG1-CG1 4.48Å
621	A	96.3	Very high	88.4	Confident	40 Å²	40	53.8 Å²	53.8	33%	0.331	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	-32.3	-176.5	0	0	0	0	0	112.9	T619 A629 R631 I638	T619-A621 PolarHBondContact O-N 3.28Å; T619-A621 VanDerWaalsContact O-N 3.12Å; A621-A629 PolarHBondContact N-O 3.37Å; A621-R631 HydrophobicContact CB-CB 4.1Å; A621-I638 HydrophobicContact CB-CD1 4.26Å
622	S	96.4	Very high	90	Very high	56 Å²	56	53.5 Å²	53.5	39%	0.392	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.9	151.5	169.9	63.4	0	0	0	0	111.1	A629	S622-A629 PolarHBondContact N-O 3.27Å; S622-A629 PolarHBondContact O-N 3.34Å; S622-A629 WeakPolarHBondContact OG-CB 3.39Å
623	I	96.7	Very high	91.6	Very high	21 Å²	21	54.6 Å²	54.6	11%	0.108	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	116.7	172.2	-63.8	177.6	0	0	0	106.3	I586 G589 L591 Y598 I600 I620 I628	I586-I623 HydrophobicContact CB-CG2 4.39Å; I586-I623 HydrophobicContact CD1-CG2 3.78Å; I586-I623 HydrophobicContact CG1-CG2 3.97Å; I586-I623 HydrophobicContact CG2-CG2 3.52Å; G589-I623 WeakPolarHBondContact O-CB 3.42Å; G589-I623 VanDerWaalsContact O-CD1 3.25Å; G589-I623 WeakPolarHBondContact O-CD1 3.44Å; L591-I623 HydrophobicContact CB-CD1 4.32Å; Y598-I623 WeakPolarHBondContact O-CD1 3.46Å; I600-I623 HydrophobicContact CG1-CB 4.4Å; I600-I623 HydrophobicContact CG1-CD1 4.3Å; I600-I623 HydrophobicContact CG1-CG1 4.05Å; I620-I623 HydrophobicContact CG2-CD1 3.95Å; I620-I623 HydrophobicContact CG2-CG1 3.53Å; I623-I628 HydrophobicContact CG1-CG2 4.22Å; I623-I628 HydrophobicContact CG2-CG2 4.4Å
624	G	94	Very high	93.1	Very high	27 Å²	27	53.4 Å²	53.4	28%	0.278	29%	0.293	S	S	.	.			trans	-92.6	-169.2	178.1	0	0	0	0	0	111.7	I586 D627	I586-G624 WeakPolarHBondContact CD1-O 3.39Å; G624-D627 WeakPolarHBondContact CA-O 3.49Å; G624-D627 PolarHBondContact N-O 2.96Å
625	V	93.2	Very high	93.8	Very high	137 Å²	137	52.5 Å²	52.5	83%	0.83	29%	0.291	S	S	*	.	S	Bend	trans	-72.8	-35.1	-179.2	-178.1	0	0	0	0	112.2
626	Q	94.7	Very high	94	Very high	103 Å²	103	52.5 Å²	52.5	48%	0.481	30%	0.297	S	S	.	.	S	Bend	trans	-134.9	8.2	-173.7	-170.3	59.1	3.7	0	0	112.4	T642 V643	Q626-T642 CarbonylContact O-C 3.55Å; Q626-T642 VanDerWaalsContact O-CA 3.32Å; Q626-T642 WeakPolarHBondContact O-CA 3.38Å; Q626-T642 WeakPolarHBondContact O-CB 3.42Å; Q626-V643 PolarHBondContact O-N 3.17Å
627	D	95.8	Very high	94.3	Very high	26 Å²	26	53.3 Å²	53.3	14%	0.139	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.2	157.4	-177.6	79.5	-67.9	0	0	0	113.2	G624 R640 V641 T642	G624-D627 WeakPolarHBondContact CA-O 3.49Å; G624-D627 PolarHBondContact N-O 2.96Å; D627-R640 VanDerWaalsContact CG-NH2 3.27Å; D627-R640 IonicContact OD1-NH2 3.89Å; D627-R640 PolarHBondContact OD1-NH2 3.4Å; D627-R640 VanDerWaalsContact OD1-NH2 3.12Å; D627-R640 IonicContact OD2-CZ 2.66Å; D627-R640 IonicContact OD2-NE 3.82Å; D627-R640 PolarHBondContact OD2-NE 2.91Å; D627-R640 IonicContact OD2-NH2 3.92Å; D627-R640 PolarHBondContact OD2-NH2 3.5Å; D627-V641 CarbonylContact C-O 3.55Å; D627-V641 VanDerWaalsContact CA-O 3.28Å; D627-V641 WeakPolarHBondContact CA-O 3.43Å; D627-V641 WeakPolarHBondContact CB-O 3.24Å; D627-T642 HydrophobicContact CB-CG2 4.37Å
628	I	96.1	Very high	94.3	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.005	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	145.5	170.2	63.9	176.8	0	0	0	109.8	I586 L591 I623 I630 R640 V641 L646 I653	I586-I628 HydrophobicContact CD1-CG2 4.1Å; L591-I628 HydrophobicContact CB-CG2 4.32Å; L591-I628 HydrophobicContact CD1-CG2 4.09Å; L591-I628 HydrophobicContact CD2-CD1 3.91Å; L591-I628 HydrophobicContact CD2-CG2 4.24Å; L591-I628 HydrophobicContact CG-CG2 4.46Å; I623-I628 HydrophobicContact CG1-CG2 4.22Å; I623-I628 HydrophobicContact CG2-CG2 4.4Å; I628-I630 HydrophobicContact CD1-CD1 4.01Å; I628-I630 HydrophobicContact CD1-CG1 4.3Å; I628-R640 VanDerWaalsContact O-CA 3.32Å; I628-R640 WeakPolarHBondContact O-CA 3.42Å; I628-V641 HydrophobicContact CG1-CB 4.07Å; I628-V641 PolarHBondContact N-O 2.9Å; I628-V641 PolarHBondContact O-N 2.96Å; I628-L646 HydrophobicContact CD1-CD1 4.01Å; I628-I653 HydrophobicContact CD1-CD1 3.74Å
629	A	96	Very high	94.2	Very high	4 Å²	4	56.6 Å²	56.6	3%	0.033	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	119.3	172.3	0	0	0	0	0	109.4	I620 A621 S622 I638 C639 R640	I620-A629 CarbonylContact C-O 3.59Å; A621-A629 PolarHBondContact N-O 3.37Å; S622-A629 PolarHBondContact N-O 3.27Å; S622-A629 PolarHBondContact O-N 3.34Å; S622-A629 WeakPolarHBondContact OG-CB 3.39Å; A629-I638 HydrophobicContact CB-CG2 3.81Å; A629-C639 CarbonylContact C-O 3.56Å; A629-C639 WeakPolarHBondContact CA-O 3.4Å; A629-R640 HydrophobicContact CB-CG 4.24Å
630	I	95.8	Very high	94.1	Very high	0 Å²	0	62 Å²	62	0%	0	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	121.9	178.1	-59.6	172.5	0	0	0	108.3	V604 L606 T619 I620 I628 R632 I638 C639 I653	V604-I630 HydrophobicContact CG2-CD1 3.94Å; V604-I630 HydrophobicContact CG2-CG1 4.18Å; V604-I630 HydrophobicContact CG2-CG2 4.09Å; L606-I630 HydrophobicContact CB-CD1 3.99Å; L606-I630 HydrophobicContact CD1-CD1 4.05Å; L606-I630 HydrophobicContact CD2-CD1 4.41Å; L606-I630 HydrophobicContact CG-CD1 4.38Å; T619-I630 CarbonylContact O-C 3.56Å; T619-I630 WeakPolarHBondContact O-CA 3.27Å; I620-I630 HydrophobicContact CG1-CG1 4.48Å; I628-I630 HydrophobicContact CD1-CD1 4.01Å; I628-I630 HydrophobicContact CD1-CG1 4.3Å; I630-R632 PolarHBondContact O-N 3.39Å; I630-I638 WeakPolarHBondContact O-CA 3.41Å; I630-C639 PolarHBondContact N-O 3.3Å; I630-C639 PolarHBondContact O-N 2.96Å; I630-I653 HydrophobicContact CD1-CD1 4.17Å
631	R	96.1	Very high	93.9	Very high	111 Å²	111	61.9 Å²	61.9	42%	0.419	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.7	112.6	170	-175.1	177	-63.2	-83.3	11	109.2	G618 T619 A621 H636 G637 I638	G618-R631 CarbonylContact C-O 3.57Å; G618-R631 WeakPolarHBondContact CA-O 3.34Å; T619-R631 PolarHBondContact N-O 3.18Å; T619-R631 PolarHBondContact O-N 3.08Å; A621-R631 HydrophobicContact CB-CB 4.1Å; R631-H636 HydrophobicContact CG-CB 4.49Å; R631-H636 WeakPolarHBondContact CG-O 3.42Å; R631-H636 PolarHBondContact NH1-O 2.99Å; R631-G637 WeakPolarHBondContact CA-O 3.46Å; R631-I638 HydrophobicContact CB-CD1 3.76Å; R631-I638 HydrophobicContact CG-CD1 4.03Å
632	R	93.6	Very high	93.8	Very high	78 Å²	78	62.3 Å²	62.3	29%	0.294	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	141.4	178	-69.1	162	50.7	108.3	-7.1	111.3	C616 T617 I630 D635 H636 G637	C616-R632 HydrophobicContact CB-CG 3.99Å; T617-R632 WeakPolarHBondContact O-CA 3.33Å; I630-R632 PolarHBondContact O-N 3.39Å; R632-D635 VanDerWaalsContact CB-OD1 3.23Å; R632-D635 WeakPolarHBondContact CB-OD1 3.3Å; R632-D635 IonicContact CZ-OD1 3.4Å; R632-D635 IonicContact CZ-OD2 2.7Å; R632-D635 VanDerWaalsContact NE-CG 3.31Å; R632-D635 IonicContact NE-OD1 3.16Å; R632-D635 PolarHBondContact NE-OD1 3.06Å; R632-D635 IonicContact NE-OD2 2.76Å; R632-D635 PolarHBondContact NE-OD2 3.37Å; R632-D635 IonicContact NH2-OD1 3.62Å; R632-D635 IonicContact NH2-OD2 2.65Å; R632-D635 PolarHBondContact NH2-OD2 2.72Å; R632-H636 VanDerWaalsContact O-CA 3.24Å; R632-H636 WeakPolarHBondContact O-CA 3.41Å; R632-H636 PolarHBondContact O-N 2.7Å; R632-G637 WeakPolarHBondContact CB-O 3.26Å; R632-G637 PolarHBondContact N-O 2.8Å
633	C	90.6	Very high	93.7	Very high	78 Å²	78	59.9 Å²	59.9	53%	0.527	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.3	-23.1	174.8	-67.4	0	0	0	0	113.5	T617	T617-C633 PolarHBondContact O-N 2.8Å
634	S	89.1	Confident	93.5	Very high	96 Å²	96	64.1 Å²	64.1	67%	0.671	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.3	-29.5	-171.3	48	0	0	0	0	115
635	D	91.6	Very high	93.4	Very high	85 Å²	85	65.1 Å²	65.1	46%	0.455	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-145.3	7.2	-173.5	55.5	14.2	0	0	0	113.2	R632 G637	R632-D635 VanDerWaalsContact CB-OD1 3.23Å; R632-D635 WeakPolarHBondContact CB-OD1 3.3Å; R632-D635 IonicContact CZ-OD1 3.4Å; R632-D635 IonicContact CZ-OD2 2.7Å; R632-D635 VanDerWaalsContact NE-CG 3.31Å; R632-D635 IonicContact NE-OD1 3.16Å; R632-D635 PolarHBondContact NE-OD1 3.06Å; R632-D635 IonicContact NE-OD2 2.76Å; R632-D635 PolarHBondContact NE-OD2 3.37Å; R632-D635 IonicContact NH2-OD1 3.62Å; R632-D635 IonicContact NH2-OD2 2.65Å; R632-D635 PolarHBondContact NH2-OD2 2.72Å; D635-G637 PolarHBondContact O-N 2.99Å; D635-G637 WeakPolarHBondContact OD1-CA 3.29Å; D635-G637 PolarHBondContact OD1-N 3.39Å
636	H	90.7	Very high	93.4	Very high	134 Å²	134	58.9 Å²	58.9	62%	0.62	30%	0.298	S	S	*	.			trans	54.3	13	-170.5	-55.8	-54.5	0	0	0	115.3	R631 R632	R631-H636 HydrophobicContact CG-CB 4.49Å; R631-H636 WeakPolarHBondContact CG-O 3.42Å; R631-H636 PolarHBondContact NH1-O 2.99Å; R632-H636 VanDerWaalsContact O-CA 3.24Å; R632-H636 WeakPolarHBondContact O-CA 3.41Å; R632-H636 PolarHBondContact O-N 2.7Å
637	G	93.1	Very high	93.3	Very high	26 Å²	26	60.4 Å²	60.4	27%	0.268	30%	0.303	S	S	.	.			trans	-68.3	152.4	178.7	0	0	0	0	0	112.5	R631 R632 D635	R631-G637 WeakPolarHBondContact CA-O 3.46Å; R632-G637 WeakPolarHBondContact CB-O 3.26Å; R632-G637 PolarHBondContact N-O 2.8Å; D635-G637 PolarHBondContact O-N 2.99Å; D635-G637 WeakPolarHBondContact OD1-CA 3.29Å; D635-G637 PolarHBondContact OD1-N 3.39Å
638	I	93.7	Very high	93	Very high	81 Å²	81	64.8 Å²	64.8	42%	0.415	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	113.7	178.2	-56.6	-57.2	0	0	0	109.9	A621 A629 I630 R631 R640	A621-I638 HydrophobicContact CB-CD1 4.26Å; A629-I638 HydrophobicContact CB-CG2 3.81Å; I630-I638 WeakPolarHBondContact O-CA 3.41Å; R631-I638 HydrophobicContact CB-CD1 3.76Å; R631-I638 HydrophobicContact CG-CD1 4.03Å; I638-R640 HydrophobicContact CG2-CG 4.07Å
639	C	91.4	Very high	92.6	Very high	29 Å²	29	66.2 Å²	66.2	20%	0.196	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	128.4	163.9	-177.1	0	0	0	0	108.6	A629 I630	A629-C639 CarbonylContact C-O 3.56Å; A629-C639 WeakPolarHBondContact CA-O 3.4Å; I630-C639 PolarHBondContact N-O 3.3Å; I630-C639 PolarHBondContact O-N 2.96Å
640	R	94	Very high	92.3	Very high	167 Å²	167	71.7 Å²	71.7	63%	0.63	36%	0.357	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-108.1	132.4	171.4	-65.3	-176.9	74.4	170.2	3	109.6	D627 I628 A629 I638	D627-R640 VanDerWaalsContact CG-NH2 3.27Å; D627-R640 IonicContact OD1-NH2 3.89Å; D627-R640 PolarHBondContact OD1-NH2 3.4Å; D627-R640 VanDerWaalsContact OD1-NH2 3.12Å; D627-R640 IonicContact OD2-CZ 2.66Å; D627-R640 IonicContact OD2-NE 3.82Å; D627-R640 PolarHBondContact OD2-NE 2.91Å; D627-R640 IonicContact OD2-NH2 3.92Å; D627-R640 PolarHBondContact OD2-NH2 3.5Å; I628-R640 VanDerWaalsContact O-CA 3.32Å; I628-R640 WeakPolarHBondContact O-CA 3.42Å; A629-R640 HydrophobicContact CB-CG 4.24Å; I638-R640 HydrophobicContact CG2-CG 4.07Å
641	V	93.3	Very high	92.1	Very high	0 Å²	0	74.1 Å²	74.1	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	128.4	-179.3	-168.8	0	0	0	0	108.5	L606 D627 I628 Q645 L646 Y651	L606-V641 HydrophobicContact CD1-CG2 3.97Å; L606-V641 HydrophobicContact CD2-CG2 3.49Å; L606-V641 VanDerWaalsContact CD2-CG2 3.49Å; L606-V641 HydrophobicContact CG-CG2 4.39Å; D627-V641 CarbonylContact C-O 3.55Å; D627-V641 VanDerWaalsContact CA-O 3.28Å; D627-V641 WeakPolarHBondContact CA-O 3.43Å; D627-V641 WeakPolarHBondContact CB-O 3.24Å; I628-V641 HydrophobicContact CG1-CB 4.07Å; I628-V641 PolarHBondContact N-O 2.9Å; I628-V641 PolarHBondContact O-N 2.96Å; V641-Q645 HydrophobicContact CG1-CB 4.07Å; V641-L646 HydrophobicContact CG1-CD2 3.99Å; V641-L646 HydrophobicContact CG1-CG 3.87Å; V641-Y651 HydrophobicContact CG1-CD2 3.58Å; V641-Y651 HydrophobicContact CG1-CE2 4.19Å; V641-Y651 HydrophobicContact CG1-CG 4.1Å
642	T	94.8	Very high	91.8	Very high	49 Å²	49	70.9 Å²	70.9	30%	0.301	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	150.8	177.7	72.1	0	0	0	0	111.3	Q626 D627 Q644 Q645 L646	Q626-T642 CarbonylContact O-C 3.55Å; Q626-T642 VanDerWaalsContact O-CA 3.32Å; Q626-T642 WeakPolarHBondContact O-CA 3.38Å; Q626-T642 WeakPolarHBondContact O-CB 3.42Å; D627-T642 HydrophobicContact CB-CG2 4.37Å; T642-Q644 PolarHBondContact O-N 2.98Å; T642-Q645 PolarHBondContact O-N 2.62Å; T642-Q645 WeakPolarHBondContact OG1-CG 3.45Å; T642-Q645 PolarHBondContact OG1-N 2.81Å; T642-Q645 VanDerWaalsContact OG1-N 3.08Å; T642-L646 PolarHBondContact O-N 2.92Å; T642-L646 VanDerWaalsContact O-N 3.11Å
643	V	94	Very high	91.8	Very high	4 Å²	4	67.8 Å²	67.8	2%	0.024	35%	0.353	C	S	.	.	H	α-helix	trans	-54.1	-34.5	170.8	172.5	0	0	0	0	110.6	I584 I586 Q626 L646 K647	I584-V643 HydrophobicContact CG2-CG1 4.42Å; I586-V643 HydrophobicContact CD1-CG2 3.35Å; I586-V643 HydrophobicContact CG1-CG2 3.68Å; Q626-V643 PolarHBondContact O-N 3.17Å; V643-L646 PolarHBondContact O-N 2.9Å; V643-K647 HydrophobicContact CG1-CD 4.39Å; V643-K647 HydrophobicContact CG1-CG 4.41Å; V643-K647 WeakPolarHBondContact O-CB 2.81Å; V643-K647 WeakPolarHBondContact O-CG 3.5Å; V643-K647 PolarHBondContact O-N 2.9Å
644	Q	92.4	Very high	91.8	Very high	110 Å²	110	68.2 Å²	68.2	51%	0.514	34%	0.344	S	S	.	.	H	α-helix	trans	-67.8	-40.5	176.3	-170.9	171.3	2.3	0	0	112.9	T642 L646 K647 Q648	T642-Q644 PolarHBondContact O-N 2.98Å; Q644-L646 VanDerWaalsContact C-N 3.31Å; Q644-L646 PolarHBondContact O-N 3.1Å; Q644-K647 PolarHBondContact O-N 3.24Å; Q644-Q648 VanDerWaalsContact O-CB 3.3Å; Q644-Q648 WeakPolarHBondContact O-CB 3.44Å; Q644-Q648 WeakPolarHBondContact O-CG 3.24Å; Q644-Q648 PolarHBondContact O-N 2.79Å
645	Q	92.4	Very high	91.9	Very high	49 Å²	49	66.4 Å²	66.4	23%	0.229	33%	0.33	C	S	.	.	H	α-helix	trans	-64.5	-36.2	174.4	-73.4	165.7	-24	0	0	112	V641 T642 G649 R650 Y651	V641-Q645 HydrophobicContact CG1-CB 4.07Å; T642-Q645 PolarHBondContact O-N 2.62Å; T642-Q645 WeakPolarHBondContact OG1-CG 3.45Å; T642-Q645 PolarHBondContact OG1-N 2.81Å; T642-Q645 VanDerWaalsContact OG1-N 3.08Å; Q645-G649 PolarHBondContact O-N 3.3Å; Q645-R650 HydrophobicContact CB-CB 4.44Å; Q645-R650 WeakPolarHBondContact O-CB 3.5Å; Q645-R650 PolarHBondContact O-N 3.04Å; Q645-Y651 HydrophobicContact CB-CD2 4.11Å; Q645-Y651 HydrophobicContact CB-CE2 4.45Å
646	L	92.7	Very high	91.7	Very high	5 Å²	5	64.5 Å²	64.5	3%	0.026	32%	0.319	C	S	.	.	H	α-helix	trans	-67.6	-48.6	173.2	-66.6	170.5	0	0	0	111.4	I584 L591 L606 I628 V641 T642 V643 Q644 Q648 G649 I653	I584-L646 HydrophobicContact CD1-CB 3.84Å; I584-L646 HydrophobicContact CG2-CB 3.94Å; I584-L646 HydrophobicContact CG2-CD1 4.16Å; L591-L646 HydrophobicContact CD1-CD1 4.12Å; L591-L646 HydrophobicContact CD2-CD1 4.29Å; L606-L646 HydrophobicContact CD1-CD2 4.32Å; I628-L646 HydrophobicContact CD1-CD1 4.01Å; V641-L646 HydrophobicContact CG1-CD2 3.99Å; V641-L646 HydrophobicContact CG1-CG 3.87Å; T642-L646 PolarHBondContact O-N 2.92Å; T642-L646 VanDerWaalsContact O-N 3.11Å; V643-L646 PolarHBondContact O-N 2.9Å; Q644-L646 VanDerWaalsContact C-N 3.31Å; Q644-L646 PolarHBondContact O-N 3.1Å; L646-Q648 PolarHBondContact O-N 3.3Å; L646-G649 PolarHBondContact O-N 2.89Å; L646-I653 HydrophobicContact CD2-CG2 4.27Å
647	K	91.7	Very high	91	Very high	136 Å²	136	67.1 Å²	67.1	59%	0.591	33%	0.329	S	S	*	.	H	α-helix	trans	-56.9	-35.3	174.5	-77.8	-174.9	177.6	-169.4	0	112.8	I584 V643 Q644 G649	I584-K647 HydrophobicContact CB-CG 4.15Å; I584-K647 WeakPolarHBondContact O-CE 3.43Å; V643-K647 HydrophobicContact CG1-CD 4.39Å; V643-K647 HydrophobicContact CG1-CG 4.41Å; V643-K647 WeakPolarHBondContact O-CB 2.81Å; V643-K647 WeakPolarHBondContact O-CG 3.5Å; V643-K647 PolarHBondContact O-N 2.9Å; Q644-K647 PolarHBondContact O-N 3.24Å; K647-G649 PolarHBondContact O-N 2.98Å
648	Q	89.1	Confident	89.3	Confident	117 Å²	117	70.4 Å²	70.4	55%	0.547	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-1.8	176.8	-73.5	170.9	-20.2	0	0	113.8	Q644 L646 R650	Q644-Q648 VanDerWaalsContact O-CB 3.3Å; Q644-Q648 WeakPolarHBondContact O-CB 3.44Å; Q644-Q648 WeakPolarHBondContact O-CG 3.24Å; Q644-Q648 PolarHBondContact O-N 2.79Å; L646-Q648 PolarHBondContact O-N 3.3Å; Q648-R650 HydrophobicContact CB-CG 4.05Å; Q648-R650 PolarHBondContact O-N 3.07Å
649	G	88.8	Confident	86.4	Confident	32 Å²	32	79.1 Å²	79.1	33%	0.33	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	67.8	9.7	-177.8	0	0	0	0	0	115	R609 Q645 L646 K647 Y651	R609-G649 VanDerWaalsContact CB-O 3.29Å; R609-G649 WeakPolarHBondContact CB-O 3.18Å; R609-G649 WeakPolarHBondContact CD-O 3.49Å; Q645-G649 PolarHBondContact O-N 3.3Å; L646-G649 PolarHBondContact O-N 2.89Å; K647-G649 PolarHBondContact O-N 2.98Å; G649-Y651 PolarHBondContact O-N 3.29Å
650	R	88.6	Confident	86.2	Confident	118 Å²	118	81.6 Å²	81.6	45%	0.445	40%	0.396	S	S	.	.	S	Bend	trans	-64.3	-33.3	178.2	-70.1	-103.9	-85.1	157	-8.6	111.4	G608 R609 D610 Q645 Q648	G608-R650 WeakPolarHBondContact CA-O 3.42Å; R609-R650 PolarHBondContact N-O 2.93Å; D610-R650 WeakPolarHBondContact OD2-CD 3.22Å; D610-R650 IonicContact OD2-CZ 3.29Å; D610-R650 IonicContact OD2-NE 2.6Å; D610-R650 IonicContact OD2-NH1 2.83Å; D610-R650 PolarHBondContact OD2-NH1 3.05Å; Q645-R650 HydrophobicContact CB-CB 4.44Å; Q645-R650 WeakPolarHBondContact O-CB 3.5Å; Q645-R650 PolarHBondContact O-N 3.04Å; Q648-R650 HydrophobicContact CB-CG 4.05Å; Q648-R650 PolarHBondContact O-N 3.07Å
651	Y	92	Very high	85.7	Confident	51 Å²	51	77.1 Å²	77.1	20%	0.2	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	148.1	164.1	-57.3	-89.9	0	0	0	110.1	L606 E607 H614 V641 Q645 G649	L606-Y651 HydrophobicContact CD1-CD1 4.46Å; L606-Y651 HydrophobicContact CD1-CG 4.32Å; L606-Y651 HydrophobicContact CD2-CD1 3.73Å; L606-Y651 HydrophobicContact CD2-CE1 4.17Å; L606-Y651 HydrophobicContact CD2-CG 4.24Å; L606-Y651 HydrophobicContact CG-CD1 3.98Å; L606-Y651 HydrophobicContact CG-CG 4.33Å; E607-Y651 CarbonylContact O-C 3.55Å; E607-Y651 VanDerWaalsContact O-CA 3.29Å; E607-Y651 WeakPolarHBondContact O-CA 3.32Å; H614-Y651 HydrophobicContact CB-CE1 4.15Å; V641-Y651 HydrophobicContact CG1-CD2 3.58Å; V641-Y651 HydrophobicContact CG1-CE2 4.19Å; V641-Y651 HydrophobicContact CG1-CG 4.1Å; Q645-Y651 HydrophobicContact CB-CD2 4.11Å; Q645-Y651 HydrophobicContact CB-CE2 4.45Å; G649-Y651 PolarHBondContact O-N 3.29Å
652	A	90.7	Very high	85.3	Confident	43 Å²	43	81.4 Å²	81.4	36%	0.355	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	153	167.3	0	0	0	0	0	110.1	L606 E607 W654	L606-A652 WeakPolarHBondContact CA-O 3.35Å; E607-A652 PolarHBondContact N-O 3.49Å; E607-A652 PolarHBondContact O-N 2.98Å; A652-W654 HydrophobicContact CB-CE3 4.21Å; A652-W654 HydrophobicContact CB-CZ3 3.68Å
653	I	92.7	Very high	84.8	Confident	13 Å²	13	83.3 Å²	83.3	7%	0.067	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	132.6	-175.4	-169.8	172.2	0	0	0	111.4	L591 Y598 V604 I605 L606 I628 I630 L646	L591-I653 HydrophobicContact CD2-CD1 4.01Å; L591-I653 HydrophobicContact CD2-CG2 4.3Å; Y598-I653 HydrophobicContact CE2-CG2 4.3Å; Y598-I653 PolarHBondContact OH-O 3.44Å; V604-I653 HydrophobicContact CB-CD1 4.12Å; V604-I653 HydrophobicContact CB-CG1 4.02Å; V604-I653 HydrophobicContact CG1-CD1 4.12Å; V604-I653 HydrophobicContact CG1-CG1 4.2Å; V604-I653 HydrophobicContact CG2-CD1 4.19Å; I605-I653 WeakPolarHBondContact O-CA 3.28Å; L606-I653 HydrophobicContact CD1-CB 4.35Å; I628-I653 HydrophobicContact CD1-CD1 3.74Å; I630-I653 HydrophobicContact CD1-CD1 4.17Å; L646-I653 HydrophobicContact CD2-CG2 4.27Å
654	W	91.2	Very high	84.2	Confident	87 Å²	87	88.3 Å²	88.3	33%	0.33	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	156.2	176.4	49.2	91.7	0	0	0	111.9	Y598 V604 I605 E607 A652 N656	Y598-W654 WeakPolarHBondContact OH-CA 3.26Å; V604-W654 WeakPolarHBondContact CA-O 3.37Å; I605-W654 HydrophobicContact CB-CG 4.45Å; I605-W654 HydrophobicContact CG2-CZ2 3.96Å; I605-W654 PolarHBondContact N-O 3.43Å; I605-W654 PolarHBondContact O-N 2.98Å; I605-W654 VanDerWaalsContact O-N 3.08Å; E607-W654 HydrophobicContact CB-CH2 3.36Å; E607-W654 HydrophobicContact CB-CZ2 3.93Å; E607-W654 HydrophobicContact CB-CZ3 4.04Å; E607-W654 VanDerWaalsContact CD-CH2 3.49Å; E607-W654 HydrophobicContact CG-CH2 4.03Å; E607-W654 WeakPolarHBondContact OE2-CZ2 3.2Å; A652-W654 HydrophobicContact CB-CE3 4.21Å; A652-W654 HydrophobicContact CB-CZ3 3.68Å; W654-N656 PolarHBondContact O-N 3.17Å
655	P	91.6	Very high	83.7	Confident	59 Å²	59	86.8 Å²	86.8	38%	0.383	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.4	134.4	176.3	27.1	-35.6	0	0	0	110.3	Y598 K657	Y598-P655 HydrophobicContact CE1-CB 4.3Å; Y598-P655 WeakPolarHBondContact OH-CD 3.36Å; P655-K657 PolarHBondContact O-N 3.06Å
656	N	86.2	Confident	83	Confident	44 Å²	44	89.5 Å²	89.5	24%	0.235	45%	0.445	C	S	.	.			trans	-78.5	105.7	168.8	-177.1	41	0	0	0	108.3	S603 I605 T617 W654 S658	S603-N656 PolarHBondContact O-N 3.06Å; S603-N656 WeakPolarHBondContact OG-CB 3.45Å; S603-N656 PolarHBondContact OG-ND2 3.41Å; I605-N656 HydrophobicContact CD1-CB 4.46Å; I605-N656 HydrophobicContact CG1-CB 4.08Å; T617-N656 HydrophobicContact CG2-CB 4.23Å; T617-N656 WeakPolarHBondContact CG2-ND2 2.77Å; W654-N656 PolarHBondContact O-N 3.17Å; N656-S658 PolarHBondContact O-N 2.87Å; N656-S658 VanDerWaalsContact O-N 3.16Å
657	K	75.9	Confident	82.3	Confident	189 Å²	189	96 Å²	96	82%	0.822	48%	0.477	S	S	*	.			trans	-78.8	90.4	167.2	-69.3	-171.9	178.7	-172.5	0	108.5	P655	P655-K657 PolarHBondContact O-N 3.06Å
658	S	58.7	Low	81.5	Confident	95 Å²	95	92.7 Å²	92.7	66%	0.664	47%	0.468	S	S	*	.			trans	-71.4	121.5	154.7	51.3	0	0	0	0	108.1	N656	N656-S658 PolarHBondContact O-N 2.87Å; N656-S658 VanDerWaalsContact O-N 3.16Å
659	E	32.7	Very low	80.8	Confident	264 Å²	264	90.5 Å²	90.5	100%	1.234	46%	0.46	S	S	*	.			trans	-69.5	0	161.8	-62.6	179.5	131.2	0	0	110.6

Retrieved 659 of 659 residues in 335.9 ms (Link to these results)

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