A0A087YK66_POEFO Loading...

Cysteine-rich protein 2-binding protein

Component of the ATAC complex, a complex with histone acetyltransferase activity on histones H3 and H4. May function as a scaffold for the ATAC complex to promote ATAC complex stability. Has also weak histone acetyltransferase activity toward histone H4. Required for the normal progression through G1 and G2/M phases of the cell cycle.

AlphaFold DB , UniProt , Accession A0A087YK66, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 762 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33	Very low	30.5	Very low	227 Å²	227	129.3 Å²	129.3	100%	1.118	87%	0.865	S	S	*	*				0	104.5	0	-78.9	176.8	164	0	0	106.3
2	D	32.9	Very low	30.6	Very low	161 Å²	161	134.4 Å²	134.4	86%	0.861	87%	0.867	S	S	*	*			trans	-143.3	161.5	-148	-60.4	-82.4	0	0	0	113.1
3	G	31.5	Very low	30.5	Very low	79 Å²	79	128.8 Å²	128.8	81%	0.814	85%	0.849	S	S	*	*			trans	78.4	91.8	137.9	0	0	0	0	0	117.5
4	G	32.5	Very low	30.5	Very low	87 Å²	87	133.9 Å²	133.9	90%	0.897	86%	0.855	S	S	*	*			trans	-92	174.8	148.4	0	0	0	0	0	111.1
5	G	31.1	Very low	30.4	Very low	86 Å²	86	133.4 Å²	133.4	89%	0.887	85%	0.849	S	S	*	*			trans	170.7	142.4	173.9	0	0	0	0	0	110.9
6	A	31.8	Very low	30.5	Very low	111 Å²	111	137.4 Å²	137.4	92%	0.917	85%	0.854	S	S	*	*			trans	-132	154.2	177.9	0	0	0	0	0	109.8
7	G	29.5	Very low	30.4	Very low	66 Å²	66	133.4 Å²	133.4	68%	0.68	85%	0.845	S	S	*	*			trans	170.8	119	174.2	0	0	0	0	0	113.3
8	E	30.2	Very low	30.3	Very low	206 Å²	206	136.7 Å²	136.7	96%	0.963	85%	0.848	S	S	*	*			trans	32.9	148.6	139.2	-53.5	-178.3	122.7	0	0	122.1
9	G	27.8	Very low	30.2	Very low	74 Å²	74	136.7 Å²	136.7	76%	0.763	85%	0.848	S	S	*	*			trans	148.7	73.8	148.6	0	0	0	0	0	119.3
10	L	28.2	Very low	29.9	Very low	161 Å²	161	136.6 Å²	136.6	84%	0.843	84%	0.84	S	S	*	*			trans	40.8	137	139.8	-70.6	165.6	0	0	0	123.9
11	E	27.5	Very low	29.7	Very low	164 Å²	164	138.4 Å²	138.4	77%	0.766	84%	0.844	S	S	*	*			trans	75.4	143.5	142.6	-97.9	170.5	150.2	0	0	122.8
12	E	31.1	Very low	29.4	Very low	191 Å²	191	134.2 Å²	134.2	89%	0.893	83%	0.825	S	S	*	*			trans	57.6	142.5	167.5	-57.8	-175.2	168.7	0	0	117.9
13	G	30	Very low	29.1	Very low	61 Å²	61	132.1 Å²	132.1	63%	0.629	82%	0.817	S	S	*	*			cis	157.3	44	1.1	0	0	0	0	0	112.5	V15	G13-V15 PolarHBondContact O-N 2.71Å
14	E	29.4	Very low	28.8	Very low	200 Å²	200	136.8 Å²	136.8	94%	0.935	82%	0.818	S	S	*	*			trans	-67.3	95.6	-166.9	-72.1	-172.2	130.8	0	0	114.5
15	V	30.3	Very low	28.7	Very low	127 Å²	127	136.3 Å²	136.3	77%	0.77	80%	0.801	S	S	*	*			trans	-9.7	128.4	130.3	-171.9	0	0	0	0	115.5	G13	G13-V15 PolarHBondContact O-N 2.71Å
16	E	31.2	Very low	28.6	Very low	198 Å²	198	141.9 Å²	141.9	93%	0.925	80%	0.804	S	S	*	*			trans	-132.5	150	135.1	-101.2	-178.6	-178.7	0	0	107.3
17	G	28.1	Very low	28.4	Very low	68 Å²	68	142.3 Å²	142.3	70%	0.701	79%	0.791	S	S	*	*			trans	-151.6	-178.8	-166.1	0	0	0	0	0	114.9
18	E	29.5	Very low	28.3	Very low	194 Å²	194	147.2 Å²	147.2	91%	0.907	80%	0.796	S	S	*	*			trans	-123.5	93.4	177.6	-94.4	-177.5	157.8	0	0	112.3
19	T	28.1	Very low	28	Very low	136 Å²	136	146.3 Å²	146.3	83%	0.834	79%	0.792	S	S	*	*			trans	25.3	121.1	146.6	15.1	0	0	0	0	121.4
20	L	25	Very low	28	Very low	135 Å²	135	149.6 Å²	149.6	71%	0.707	79%	0.792	S	S	*	*			trans	-69.1	157.2	146.4	-67.4	86	0	0	0	111	I22	L20-I22 HydrophobicContact CD2-CD1 3.92Å; L20-I22 HydrophobicContact CD2-CG1 4.36Å
21	L	24.3	Very low	28	Very low	174 Å²	174	150 Å²	150	91%	0.911	79%	0.794	S	S	*	*				-135.4	148.1	129.5	-78.8	-178.7	0	0	0	110.2
22	I	27	Very low	28	Very low	139 Å²	139	147.1 Å²	147.1	71%	0.713	79%	0.792	S	S	*	*			trans	-114.2	-169.2	173.2	-66.8	167	0	0	0	106.2	L20	L20-I22 HydrophobicContact CD2-CD1 3.92Å; L20-I22 HydrophobicContact CD2-CG1 4.36Å
23	V	27.5	Very low	28	Very low	117 Å²	117	145.4 Å²	145.4	71%	0.709	78%	0.784	S	S	*	*			trans	88.3	124.2	170.7	-178.3	0	0	0	0	112.6
24	E	25.8	Very low	27.8	Very low	177 Å²	177	147.9 Å²	147.9	83%	0.827	78%	0.783	S	S	*	*			cis	-149.8	-173.7	-1.8	-133	153.5	-150.1	0	0	112
25	S	29.2	Very low	27.8	Very low	78 Å²	78	146.8 Å²	146.8	55%	0.545	78%	0.777	S	S	.	*			trans	-84.9	162.1	177.4	48.2	0	0	0	0	113.8	D27	S25-D27 VanDerWaalsContact CB-OD2 3.27Å; S25-D27 WeakPolarHBondContact CB-OD2 3.14Å; S25-D27 PolarHBondContact OG-OD2 2.7Å
26	E	29.1	Very low	27.8	Very low	203 Å²	203	146.2 Å²	146.2	95%	0.949	78%	0.779	S	S	*	*			trans	-120.4	150.1	140.1	-75.8	-167.5	126.9	0	0	107.6
27	D	28	Very low	27.7	Very low	120 Å²	120	140.4 Å²	140.4	64%	0.642	77%	0.773	S	S	*	*			trans	-128.4	155.6	-143.2	-97.6	-70.2	0	0	0	115	S25	S25-D27 VanDerWaalsContact CB-OD2 3.27Å; S25-D27 WeakPolarHBondContact CB-OD2 3.14Å; S25-D27 PolarHBondContact OG-OD2 2.7Å
28	Q	26.5	Very low	27.7	Very low	169 Å²	169	144.1 Å²	144.1	79%	0.79	78%	0.776	S	S	*	*			trans	64.5	118	140	-168.2	158.4	80.7	0	0	119.9
29	E	25.6	Very low	27.9	Very low	187 Å²	187	139.2 Å²	139.2	87%	0.874	76%	0.763	S	S	*	*				-158.9	131.9	99.2	-102.9	-176.6	-175.2	0	0	111.9
30	D	26.5	Very low	28.1	Very low	143 Å²	143	139.4 Å²	139.4	77%	0.765	76%	0.758	S	S	*	*			trans	-77.7	152.1	160	-84.4	-61.3	0	0	0	109.2
31	L	28.5	Very low	28.3	Very low	170 Å²	170	138.8 Å²	138.8	89%	0.89	76%	0.76	S	S	*	*				179.7	174.6	117.5	-96.5	169.5	0	0	0	112.7
32	S	28.3	Very low	28.8	Very low	103 Å²	103	135.6 Å²	135.6	72%	0.72	75%	0.753	S	S	*	*			trans	-114.2	171.9	-162.3	56.5	0	0	0	0	114.7
33	H	29.8	Very low	29	Very low	155 Å²	155	136 Å²	136	72%	0.718	76%	0.757	S	S	*	*			trans	90.7	102.7	145.8	-142.4	29.5	0	0	0	119.2
34	D	26.4	Very low	29.2	Very low	113 Å²	113	139.1 Å²	139.1	60%	0.604	77%	0.768	S	S	*	*				74.6	145.8	129.2	-79.6	39.9	0	0	0	124.5
35	Q	29.2	Very low	29.4	Very low	177 Å²	177	133.9 Å²	133.9	83%	0.827	76%	0.762	S	S	*	*			trans	68.9	147	162.4	-66.9	162	84.7	0	0	117.9
36	S	30	Very low	29.9	Very low	114 Å²	114	139.7 Å²	139.7	80%	0.797	78%	0.78	S	S	*	*			cis	-165.9	145.9	-27.4	50.1	0	0	0	0	107.2
37	G	29.6	Very low	30	Very low	77 Å²	77	138 Å²	138	79%	0.794	78%	0.778	S	S	*	*			trans	-173.6	29.8	-167.4	0	0	0	0	0	119.8
38	D	26.8	Very low	30.5	Very low	145 Å²	145	137.4 Å²	137.4	78%	0.775	79%	0.789	S	S	*	*			trans	42.5	119.3	156.8	-102	-46.9	0	0	0	122.3
39	S	34.2	Very low	30.7	Very low	91 Å²	91	137.4 Å²	137.4	64%	0.636	80%	0.795	S	S	*	*				64.5	141.3	120.6	-68.1	0	0	0	0	122
40	L	32.3	Very low	30.9	Very low	140 Å²	140	131.5 Å²	131.5	73%	0.733	78%	0.784	S	S	*	*			cis	-164.4	156.8	1.5	-118.1	166.7	0	0	0	111.8
41	T	30.1	Very low	31	Very low	122 Å²	122	127.7 Å²	127.7	75%	0.748	78%	0.778	S	S	*	*			trans	66	138.2	161.4	58.9	0	0	0	0	119.9
42	S	35.1	Very low	31.7	Very low	107 Å²	107	127.7 Å²	127.7	75%	0.748	77%	0.767	S	S	*	*			cis	-164.5	144.9	-14.2	49.7	0	0	0	0	111.7
43	D	30.2	Very low	32.1	Very low	149 Å²	149	126.4 Å²	126.4	80%	0.797	76%	0.762	S	S	*	*			trans	-80.6	161.4	-171.2	-44.7	-93.4	0	0	0	115.4
44	L	32.4	Very low	32.8	Very low	182 Å²	182	121.4 Å²	121.4	95%	0.953	74%	0.744	S	S	*	*				-170.8	128.6	124.6	-75.4	-162.2	0	0	0	106.6
45	G	29.1	Very low	33.8	Very low	67 Å²	67	124.2 Å²	124.2	69%	0.691	75%	0.754	S	S	*	*			cis	167.8	131.3	-4.8	0	0	0	0	0	107.5
46	E	40.7	Very low	35.2	Very low	200 Å²	200	122 Å²	122	94%	0.935	75%	0.748	S	S	*	*			trans	-89.9	118.3	177.3	-74.3	-167.5	115.2	0	0	111
47	D	29.7	Very low	37.3	Very low	168 Å²	168	117.5 Å²	117.5	90%	0.898	71%	0.714	S	S	*	*			trans	-121.9	124.3	167.6	-84.3	-55.4	0	0	0	109.7
48	A	39	Very low	39.8	Very low	107 Å²	107	115.4 Å²	115.4	88%	0.884	69%	0.687	S	S	*	*			trans	-133.2	60.8	-175.1	0	0	0	0	0	112.4
49	D	30.9	Very low	42.5	Very low	168 Å²	168	108.6 Å²	108.6	90%	0.898	65%	0.651	S	S	*	*			trans	-149	173.7	167.2	-165.4	19.5	0	0	0	112.4
50	G	29.1	Very low	45	Very low	63 Å²	63	106.3 Å²	106.3	65%	0.649	63%	0.629	S	S	*	*	S	Bend	trans	93.8	21.4	130.4	0	0	0	0	0	120
51	G	30.4	Very low	47.6	Very low	63 Å²	63	99.7 Å²	99.7	65%	0.649	59%	0.594	S	S	*	*			trans	80.1	122.8	153.2	0	0	0	0	0	118.9	A53	G51-A53 PolarHBondContact O-N 3.38Å
52	W	42.8	Very low	50.2	Low	171 Å²	171	97.5 Å²	97.5	65%	0.648	58%	0.577	S	S	*	*			trans	-76.5	64.5	166.8	-72.6	71.8	0	0	0	111.2	C54 R193	W52-C54 PolarHBondContact O-N 3.06Å; W52-C54 VanDerWaalsContact O-N 3.11Å; W52-R193 VanDerWaalsContact CZ2-NH2 3.34Å
53	A	36.7	Very low	52.5	Low	75 Å²	75	98.5 Å²	98.5	62%	0.62	57%	0.565	S	S	*	*			trans	-83.3	81.1	-168.5	0	0	0	0	0	113.5	G51 E55	G51-A53 PolarHBondContact O-N 3.38Å; A53-E55 VanDerWaalsContact C-N 3.25Å; A53-E55 PolarHBondContact O-N 3.07Å
54	C	43.8	Very low	55.2	Low	51 Å²	51	93.4 Å²	93.4	35%	0.345	54%	0.541	S	S	.	.	S	Bend	trans	64.9	-25.6	157.8	-162.3	0	0	0	0	120.1	W52 D56 K82	W52-C54 PolarHBondContact O-N 3.06Å; W52-C54 VanDerWaalsContact O-N 3.11Å; C54-D56 PolarHBondContact O-N 3.14Å; C54-K82 PolarHBondContact SG-NZ 3.07Å
55	E	47.5	Very low	57.6	Low	172 Å²	172	89.7 Å²	89.7	80%	0.804	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-28.8	-166.9	-64.7	-170.7	149.6	0	0	114.5	A53 M57	A53-E55 VanDerWaalsContact C-N 3.25Å; A53-E55 PolarHBondContact O-N 3.07Å; E55-M57 PolarHBondContact O-N 2.79Å; E55-M57 VanDerWaalsContact O-N 3.1Å
56	D	59.8	Low	60.2	Low	130 Å²	130	93.4 Å²	93.4	70%	0.695	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.2	-4.3	-178.8	-94.2	-11.1	0	0	0	115.7	C54 S58	C54-D56 PolarHBondContact O-N 3.14Å; D56-S58 PolarHBondContact O-N 3.19Å; D56-S58 VanDerWaalsContact O-N 3.16Å
57	M	73.9	Confident	62.3	Low	20 Å²	20	89.5 Å²	89.5	10%	0.099	49%	0.492	C	S	.	.			trans	-63.9	120.3	176	-69.1	-135.3	-54.3	0	0	110.1	E55 P69 A70 G83	E55-M57 PolarHBondContact O-N 2.79Å; E55-M57 VanDerWaalsContact O-N 3.1Å; M57-P69 CarbonylContact O-C 3.45Å; M57-A70 HydrophobicContact CB-CB 3.91Å; M57-A70 VanDerWaalsContact O-CB 3.27Å; M57-A70 WeakPolarHBondContact O-CB 3.43Å; M57-A70 PolarHBondContact O-N 3.21Å; M57-G83 PolarHBondContact SD-N 3.39Å
58	S	81.6	Confident	64.8	Low	33 Å²	33	82.5 Å²	82.5	23%	0.231	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	146.6	177.4	53	0	0	0	0	112.1	D56 V68 N85	D56-S58 PolarHBondContact O-N 3.19Å; D56-S58 VanDerWaalsContact O-N 3.16Å; S58-V68 WeakPolarHBondContact CA-O 3.42Å; S58-N85 PolarHBondContact O-ND2 2.83Å; S58-N85 VanDerWaalsContact O-ND2 3.14Å
59	F	84.3	Confident	67	Low	2 Å²	2	79.8 Å²	79.8	1%	0.009	43%	0.429	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	136.6	-177.3	-63.4	-89.3	0	0	0	110.1	W67 V68 A70 L73 P78 N85 F87 F89 F102	F59-W67 CarbonylContact O-C 3.58Å; F59-W67 WeakPolarHBondContact O-CA 3.46Å; F59-V68 PolarHBondContact N-O 3.05Å; F59-V68 PolarHBondContact O-N 3.12Å; F59-A70 HydrophobicContact CE2-CB 4.07Å; F59-L73 HydrophobicContact CD2-CD1 3.83Å; F59-L73 HydrophobicContact CE2-CD1 3.77Å; F59-P78 HydrophobicContact CE1-CG 3.61Å; F59-P78 HydrophobicContact CE2-CG 4.41Å; F59-P78 HydrophobicContact CZ-CG 3.51Å; F59-N85 HydrophobicContact CE1-CB 4.31Å; F59-F87 HydrophobicContact CD1-CB 4.45Å; F59-F87 HydrophobicContact CE1-CB 4.41Å; F59-F87 HydrophobicContact CE1-CD2 4Å; F59-F89 HydrophobicContact CB-CB 4.14Å; F59-F89 HydrophobicContact CB-CD1 3.67Å; F59-F89 HydrophobicContact CB-CE1 4.16Å; F59-F89 HydrophobicContact CB-CG 3.9Å; F59-F102 HydrophobicContact CD1-CD1 4.41Å; F59-F102 HydrophobicContact CD1-CE1 4.12Å; F59-F102 HydrophobicContact CE1-CE1 4.37Å; F59-F102 HydrophobicContact CG-CE1 4.23Å
60	Y	85.4	Confident	69.2	Low	43 Å²	43	72.3 Å²	72.3	17%	0.169	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	122.6	-178.6	-177.2	-96.4	0	0	0	110.8	H65 W67 P199	Y60-H65 AromaticContact CE1-ND1 3.79Å; Y60-H65 HydrophobicContact CE2-CB 4.37Å; Y60-H65 WeakPolarHBondContact CE2-O 2.84Å; Y60-H65 AromaticContact CZ-ND1 3.65Å; Y60-H65 VanDerWaalsContact OH-CB 3.3Å; Y60-H65 WeakPolarHBondContact OH-CB 3.38Å; Y60-H65 PolarHBondContact OH-ND1 2.82Å; Y60-W67 HydrophobicContact CD2-CD2 4.02Å; Y60-W67 AromaticContact CD2-CE2 3.74Å; Y60-W67 HydrophobicContact CD2-CG 4.28Å; Y60-W67 HydrophobicContact CD2-CZ2 4.14Å; Y60-W67 AromaticContact CD2-NE1 3.83Å; Y60-P199 HydrophobicContact CD1-CB 3.49Å; Y60-P199 VanDerWaalsContact CD1-CB 3.49Å; Y60-P199 HydrophobicContact CD1-CG 3.49Å; Y60-P199 VanDerWaalsContact CD1-CG 3.49Å; Y60-P199 HydrophobicContact CD2-CB 4.22Å; Y60-P199 HydrophobicContact CD2-CG 3.59Å; Y60-P199 HydrophobicContact CE1-CB 3.44Å; Y60-P199 VanDerWaalsContact CE1-CB 3.44Å; Y60-P199 HydrophobicContact CE1-CG 3.88Å; Y60-P199 HydrophobicContact CE2-CB 4.17Å; Y60-P199 HydrophobicContact CE2-CG 3.97Å; Y60-P199 HydrophobicContact CG-CB 3.85Å; Y60-P199 HydrophobicContact CG-CG 3.28Å
61	C	86.9	Confident	71.3	Confident	0 Å²	0	73.1 Å²	73.1	0%	0	40%	0.399	C	S	.	.	B	Isolated β-bridge	trans	-79.4	122.8	-179.3	-179.2	0	0	0	0	111.8	R63 C64 H65 K66 F89 C91	C61-R63 PolarHBondContact O-N 2.9Å; C61-C64 VanDerWaalsContact CB-SG 3.53Å; C61-H65 WeakPolarHBondContact O-CA 3.49Å; C61-H65 PolarHBondContact O-N 2.74Å; C61-K66 PolarHBondContact N-O 2.75Å; C61-F89 WeakPolarHBondContact CA-O 3.42Å; C61-F89 HydrophobicContact CB-CD1 4.05Å; C61-F89 HydrophobicContact CB-CE1 4.21Å; C61-C91 HydrophobicContact CB-CB 4.44Å; C61-C91 PolarHBondContact SG-N 3.2Å; C61-C91 VanDerWaalsContact SG-N 3.44Å
62	D	85.3	Confident	73.5	Confident	76 Å²	76	76.5 Å²	76.5	41%	0.406	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63	-22.4	-177.7	-165.9	71.8	0	0	0	113.9	K88 F89 L90	D62-K88 HydrophobicContact CB-CG 4.45Å; D62-K88 WeakPolarHBondContact OD1-CE 3.3Å; D62-K88 IonicContact OD1-NZ 3.17Å; D62-K88 WeakPolarHBondContact OD2-CE 3.19Å; D62-K88 IonicContact OD2-NZ 2.71Å; D62-K88 PolarHBondContact OD2-NZ 3.48Å; D62-F89 PolarHBondContact N-O 2.86Å; D62-L90 HydrophobicContact CB-CD2 3.84Å
63	R	83.6	Confident	75.1	Confident	128 Å²	128	69.5 Å²	69.5	48%	0.483	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.8	-36.3	-178.4	-85.1	-177.8	175.7	-168.6	-3.7	115.1	C61 L90 C94 E96	C61-R63 PolarHBondContact O-N 2.9Å; R63-L90 HydrophobicContact CB-CD2 4.04Å; R63-L90 HydrophobicContact CG-CD2 3.73Å; R63-C94 HydrophobicContact CB-CB 3.74Å; R63-C94 WeakPolarHBondContact CD-O 2.96Å; R63-C94 PolarHBondContact NH1-O 3.25Å; R63-E96 IonicContact CZ-OE1 3.54Å; R63-E96 IonicContact NH1-OE1 3.99Å; R63-E96 PolarHBondContact NH1-OE1 2.62Å; R63-E96 IonicContact NH2-OE1 3.55Å; R63-E96 PolarHBondContact NH2-OE1 2.9Å
64	C	85.9	Confident	76.7	Confident	43 Å²	43	75.7 Å²	75.7	29%	0.291	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	0.8	-178.2	68.3	0	0	0	0	114.7	C61 K66 C94	C61-C64 VanDerWaalsContact CB-SG 3.53Å; C64-K66 PolarHBondContact O-N 3.25Å; C64-C94 VanDerWaalsContact CB-SG 3.56Å
65	H	82.7	Confident	77.8	Confident	104 Å²	104	75.3 Å²	75.3	48%	0.481	39%	0.385	S	S	.	.			trans	57.5	19.8	174.8	-59.2	-69.6	0	0	0	115.3	Y60 C61	Y60-H65 AromaticContact CE1-ND1 3.79Å; Y60-H65 HydrophobicContact CE2-CB 4.37Å; Y60-H65 WeakPolarHBondContact CE2-O 2.84Å; Y60-H65 AromaticContact CZ-ND1 3.65Å; Y60-H65 VanDerWaalsContact OH-CB 3.3Å; Y60-H65 WeakPolarHBondContact OH-CB 3.38Å; Y60-H65 PolarHBondContact OH-ND1 2.82Å; C61-H65 WeakPolarHBondContact O-CA 3.49Å; C61-H65 PolarHBondContact O-N 2.74Å
66	K	83.5	Confident	78.7	Confident	145 Å²	145	74.5 Å²	74.5	63%	0.63	39%	0.386	S	S	*	.			trans	-99.1	146.9	176.1	-69	177.1	-177.8	-176.7	0	111	C61 C64	C61-K66 PolarHBondContact N-O 2.75Å; C64-K66 PolarHBondContact O-N 3.25Å
67	W	84.8	Confident	79.2	Confident	117 Å²	117	72.9 Å²	72.9	44%	0.443	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	135.4	164.8	-66.5	96.5	0	0	0	109.7	F59 Y60 P199	F59-W67 CarbonylContact O-C 3.58Å; F59-W67 WeakPolarHBondContact O-CA 3.46Å; Y60-W67 HydrophobicContact CD2-CD2 4.02Å; Y60-W67 AromaticContact CD2-CE2 3.74Å; Y60-W67 HydrophobicContact CD2-CG 4.28Å; Y60-W67 HydrophobicContact CD2-CZ2 4.14Å; Y60-W67 AromaticContact CD2-NE1 3.83Å; W67-P199 HydrophobicContact CH2-CG 3.91Å; W67-P199 HydrophobicContact CZ2-CG 3.7Å
68	V	83.9	Confident	79.2	Confident	22 Å²	22	73.2 Å²	73.2	13%	0.133	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	118.3	173.2	-178.9	0	0	0	0	107.5	S58 F59 Q72 L73 F89 C91	S58-V68 WeakPolarHBondContact CA-O 3.42Å; F59-V68 PolarHBondContact N-O 3.05Å; F59-V68 PolarHBondContact O-N 3.12Å; V68-Q72 HydrophobicContact CG1-CB 4.02Å; V68-L73 HydrophobicContact CG1-CD2 3.99Å; V68-F89 HydrophobicContact CB-CE1 3.87Å; V68-F89 HydrophobicContact CB-CZ 4.32Å; V68-F89 HydrophobicContact CG2-CE1 3.81Å; V68-F89 HydrophobicContact CG2-CZ 4.38Å; V68-C91 HydrophobicContact CG2-CB 4.47Å
69	P	84.1	Confident	79.1	Confident	49 Å²	49	71.8 Å²	71.8	32%	0.318	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.6	148.8	173.2	-23.6	34.3	0	0	0	111.9	M57 G71 Q72	M57-P69 CarbonylContact O-C 3.45Å; P69-G71 PolarHBondContact O-N 2.95Å; P69-Q72 HydrophobicContact CB-CG 4.32Å; P69-Q72 HydrophobicContact CG-CG 4.39Å; P69-Q72 PolarHBondContact O-N 3.44Å
70	A	77.1	Confident	79	Confident	12 Å²	12	77.8 Å²	77.8	10%	0.099	39%	0.392	C	S	.	.	G	3₁₀ helix	trans	-61.4	-32.3	-177.8	0	0	0	0	0	112.6	M57 F59 Q72 L73	M57-A70 HydrophobicContact CB-CB 3.91Å; M57-A70 VanDerWaalsContact O-CB 3.27Å; M57-A70 WeakPolarHBondContact O-CB 3.43Å; M57-A70 PolarHBondContact O-N 3.21Å; F59-A70 HydrophobicContact CE2-CB 4.07Å; A70-Q72 PolarHBondContact O-N 3.02Å; A70-L73 WeakPolarHBondContact O-CB 3.4Å; A70-L73 WeakPolarHBondContact O-CG 3.46Å; A70-L73 PolarHBondContact O-N 3.37Å
71	G	73.8	Confident	79	Confident	80 Å²	80	75.9 Å²	75.9	83%	0.825	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-72.3	-3.7	173.2	0	0	0	0	0	115.3	P69	P69-G71 PolarHBondContact O-N 2.95Å
72	Q	75.6	Confident	78.8	Confident	133 Å²	133	79.6 Å²	79.6	62%	0.621	40%	0.401	S	S	*	.	G	3₁₀ helix	trans	-107.9	2.2	175	-63.1	-175.6	4.2	0	0	113.1	V68 P69 A70	V68-Q72 HydrophobicContact CG1-CB 4.02Å; P69-Q72 HydrophobicContact CB-CG 4.32Å; P69-Q72 HydrophobicContact CG-CG 4.39Å; P69-Q72 PolarHBondContact O-N 3.44Å; A70-Q72 PolarHBondContact O-N 3.02Å
73	L	77.6	Confident	78.6	Confident	24 Å²	24	76.3 Å²	76.3	13%	0.126	39%	0.385	C	S	.	.			trans	-71.6	148.3	172.7	-61	177	0	0	0	110.8	F59 V68 A70 F89 E100 F102	F59-L73 HydrophobicContact CD2-CD1 3.83Å; F59-L73 HydrophobicContact CE2-CD1 3.77Å; V68-L73 HydrophobicContact CG1-CD2 3.99Å; A70-L73 WeakPolarHBondContact O-CB 3.4Å; A70-L73 WeakPolarHBondContact O-CG 3.46Å; A70-L73 PolarHBondContact O-N 3.37Å; L73-F89 HydrophobicContact CD2-CE1 4.42Å; L73-F89 HydrophobicContact CD2-CE2 3.76Å; L73-F89 HydrophobicContact CD2-CZ 3.55Å; L73-E100 WeakPolarHBondContact CA-OE2 3.29Å; L73-F102 HydrophobicContact CD1-CE1 4.24Å; L73-F102 HydrophobicContact CD1-CZ 3.81Å; L73-F102 HydrophobicContact CD2-CE1 4.48Å; L73-F102 HydrophobicContact CD2-CZ 3.97Å; L73-F102 HydrophobicContact CG-CZ 4.43Å
74	R	69.6	Low	78.8	Confident	205 Å²	205	70.2 Å²	70.2	77%	0.774	36%	0.362	S	S	*	.	S	Bend	trans	-103.6	2.8	179.5	-63.3	-175.2	175.8	-176.2	-1.8	113.7	E100	R74-E100 PolarHBondContact N-OE1 2.68Å; R74-E100 PolarHBondContact N-OE2 3.31Å
75	G	67.3	Low	78.7	Confident	44 Å²	44	68.8 Å²	68.8	45%	0.454	35%	0.351	S	S	.	.	S	Bend	trans	-126.3	178.6	174.5	0	0	0	0	0	113
76	D	66.1	Low	79	Confident	154 Å²	154	64.1 Å²	64.1	82%	0.824	33%	0.33	S	S	*	.			trans	-58	148.7	177.6	-63.5	-47.3	0	0	0	112.4
77	Q	69.4	Low	79.1	Confident	96 Å²	96	57.8 Å²	57.8	45%	0.449	30%	0.302	S	S	.	.			trans	-62.2	127.5	176.7	-68.1	-171.3	5	0	0	110.2	S79	Q77-S79 PolarHBondContact O-N 2.91Å; Q77-S79 VanDerWaalsContact O-N 3.07Å
78	P	74.6	Confident	79.2	Confident	27 Å²	27	56 Å²	56	18%	0.175	30%	0.297	C	S	.	.	S	Bend	trans	-70.7	-8.1	-174.9	31.3	-39.1	0	0	0	113.4	F59 F87 F102	F59-P78 HydrophobicContact CE1-CG 3.61Å; F59-P78 HydrophobicContact CE2-CG 4.41Å; F59-P78 HydrophobicContact CZ-CG 3.51Å; P78-F87 HydrophobicContact CB-CD1 3.91Å; P78-F87 HydrophobicContact CB-CD2 4.31Å; P78-F87 HydrophobicContact CB-CE1 3.76Å; P78-F87 HydrophobicContact CB-CE2 4.22Å; P78-F87 HydrophobicContact CB-CG 4.18Å; P78-F87 HydrophobicContact CB-CZ 3.93Å; P78-F87 HydrophobicContact CG-CD2 4.19Å; P78-F87 HydrophobicContact CG-CE2 4.29Å; P78-F87 HydrophobicContact CG-CG 4.34Å; P78-F87 HydrophobicContact CG-CZ 4.49Å; P78-F87 WeakPolarHBondContact O-CE1 3.44Å; P78-F87 WeakPolarHBondContact O-CZ 3.16Å; P78-F102 HydrophobicContact CB-CB 3.91Å; P78-F102 HydrophobicContact CB-CD1 3.79Å; P78-F102 HydrophobicContact CB-CD2 4.2Å; P78-F102 HydrophobicContact CB-CE1 4.34Å; P78-F102 HydrophobicContact CB-CG 3.71Å; P78-F102 HydrophobicContact CG-CD1 3.65Å; P78-F102 HydrophobicContact CG-CE1 3.78Å; P78-F102 HydrophobicContact CG-CG 4.08Å; P78-F102 HydrophobicContact CG-CZ 4.35Å
79	S	80.4	Confident	79.4	Confident	4 Å²	4	54.9 Å²	54.9	3%	0.028	29%	0.291	C	S	.	.			trans	-141.6	138	175.1	-169.3	0	0	0	0	112.3	Q77 L81 D84 F147	Q77-S79 PolarHBondContact O-N 2.91Å; Q77-S79 VanDerWaalsContact O-N 3.07Å; S79-L81 VanDerWaalsContact C-N 3.34Å; S79-L81 PolarHBondContact OG-N 2.83Å; S79-L81 VanDerWaalsContact OG-N 3.08Å; S79-L81 PolarHBondContact OG-O 2.93Å; S79-D84 WeakPolarHBondContact CB-OD2 3.34Å; S79-D84 WeakPolarHBondContact OG-CB 3.5Å; S79-D84 PolarHBondContact OG-OD2 2.96Å; S79-F147 WeakPolarHBondContact OG-CE1 3.45Å; S79-F147 WeakPolarHBondContact OG-CZ 3.23Å
80	Y	81.7	Confident	79.5	Confident	127 Å²	127	54.2 Å²	54.2	50%	0.498	28%	0.284	S	S	.	.	S	Bend	trans	-83.9	-10.9	167.1	62.6	-93.5	0	0	0	112.5	H144 F147	Y80-H144 AromaticContact CE2-CD2 3.74Å; Y80-H144 AromaticContact CZ-CD2 3.99Å; Y80-H144 PolarHBondContact OH-CD2 3.31Å; Y80-F147 HydrophobicContact CD1-CD1 4.46Å; Y80-F147 HydrophobicContact CD1-CD2 4.42Å; Y80-F147 HydrophobicContact CD1-CE1 4.35Å; Y80-F147 HydrophobicContact CD1-CE2 4.31Å; Y80-F147 HydrophobicContact CD1-CZ 4.3Å; Y80-F147 HydrophobicContact CE1-CB 4.09Å; Y80-F147 AromaticContact CE1-CD1 3.64Å; Y80-F147 HydrophobicContact CE1-CD1 3.64Å; Y80-F147 AromaticContact CE1-CD2 3.67Å; Y80-F147 HydrophobicContact CE1-CD2 3.67Å; Y80-F147 AromaticContact CE1-CE1 3.96Å; Y80-F147 HydrophobicContact CE1-CE1 3.96Å; Y80-F147 AromaticContact CE1-CE2 4Å; Y80-F147 HydrophobicContact CE1-CE2 4Å; Y80-F147 AromaticContact CE1-CG 3.5Å; Y80-F147 HydrophobicContact CE1-CG 3.5Å; Y80-F147 HydrophobicContact CE1-CZ 4.15Å; Y80-F147 AromaticContact CZ-CD1 3.69Å; Y80-F147 AromaticContact CZ-CG 3.8Å; Y80-F147 VanDerWaalsContact OH-CB 3.29Å; Y80-F147 WeakPolarHBondContact OH-CB 3.42Å
81	L	85.3	Confident	80	Confident	4 Å²	4	54.1 Å²	54.1	2%	0.021	28%	0.283	C	S	.	.	S	Bend	trans	-86.1	127	176.2	-63.8	-178.1	0	0	0	109.8	S79 D84 F140 F147 L148	S79-L81 VanDerWaalsContact C-N 3.34Å; S79-L81 PolarHBondContact OG-N 2.83Å; S79-L81 VanDerWaalsContact OG-N 3.08Å; S79-L81 PolarHBondContact OG-O 2.93Å; L81-D84 HydrophobicContact CB-CB 4.05Å; L81-D84 WeakPolarHBondContact O-CB 3.2Å; L81-D84 PolarHBondContact O-N 2.92Å; L81-F140 HydrophobicContact CD2-CE1 4.2Å; L81-F140 HydrophobicContact CD2-CZ 3.73Å; L81-F147 HydrophobicContact CB-CE1 4.47Å; L81-F147 HydrophobicContact CD1-CD1 3.83Å; L81-F147 HydrophobicContact CD1-CE1 3.9Å; L81-F147 HydrophobicContact CG-CD1 4.19Å; L81-F147 HydrophobicContact CG-CE1 4Å; L81-L148 HydrophobicContact CD1-CD1 4.23Å; L81-L148 HydrophobicContact CD1-CD2 3.57Å; L81-L148 HydrophobicContact CD1-CG 3.89Å
82	K	82.8	Confident	80.5	Confident	78 Å²	78	51.3 Å²	51.3	34%	0.339	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	138.6	177	-59.3	-57.8	-177	-178.6	0	109.7	C54 Y118 N119 L122	C54-K82 PolarHBondContact SG-NZ 3.07Å; K82-Y118 HydrophobicContact CB-CE1 4.01Å; K82-Y118 WeakPolarHBondContact O-CD1 3.49Å; K82-N119 PolarHBondContact N-OD1 2.96Å; K82-N119 PolarHBondContact O-ND2 2.94Å; K82-L122 HydrophobicContact CB-CD1 3.64Å; K82-L122 HydrophobicContact CG-CD1 3.96Å
83	G	80.6	Confident	80.9	Confident	7 Å²	7	51.8 Å²	51.8	7%	0.072	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	4.7	180	0	0	0	0	0	116.4	M57 N85 P194	M57-G83 PolarHBondContact SD-N 3.39Å; G83-N85 PolarHBondContact O-N 2.89Å; G83-P194 VanDerWaalsContact CA-CB 3.46Å
84	D	87.1	Confident	81.2	Confident	0 Å²	0	52 Å²	52	0%	0	26%	0.26	C	S	.	.			trans	-91.3	78	-175.9	-177.9	25.5	0	0	0	112.3	S79 L81 F86 F87 R104 L115 F147	S79-D84 WeakPolarHBondContact CB-OD2 3.34Å; S79-D84 WeakPolarHBondContact OG-CB 3.5Å; S79-D84 PolarHBondContact OG-OD2 2.96Å; L81-D84 HydrophobicContact CB-CB 4.05Å; L81-D84 WeakPolarHBondContact O-CB 3.2Å; L81-D84 PolarHBondContact O-N 2.92Å; D84-F86 VanDerWaalsContact C-N 3.33Å; D84-F86 PolarHBondContact O-N 3.24Å; D84-F87 WeakPolarHBondContact O-CE2 3.41Å; D84-R104 IonicContact OD1-CZ 2.75Å; D84-R104 IonicContact OD1-NH2 2.62Å; D84-R104 PolarHBondContact OD1-NH2 3.47Å; D84-R104 IonicContact OD2-CZ 3.77Å; D84-R104 IonicContact OD2-NH1 3.34Å; D84-R104 IonicContact OD2-NH2 3.69Å; D84-R104 PolarHBondContact OD2-NH2 3.46Å; D84-L115 HydrophobicContact CB-CD1 4.24Å; D84-L115 HydrophobicContact CB-CD2 3.99Å; D84-F147 VanDerWaalsContact OD2-CE1 3.29Å; D84-F147 WeakPolarHBondContact OD2-CE1 3.42Å
85	N	85.4	Confident	81.9	Confident	12 Å²	12	43.4 Å²	43.4	6%	0.064	23%	0.232	C	C	.	.			trans	-91.7	22.8	177.8	79.9	-19.1	0	0	0	114.6	S58 F59 G83 F87 L197	S58-N85 PolarHBondContact O-ND2 2.83Å; S58-N85 VanDerWaalsContact O-ND2 3.14Å; F59-N85 HydrophobicContact CE1-CB 4.31Å; G83-N85 PolarHBondContact O-N 2.89Å; N85-F87 VanDerWaalsContact C-N 3.25Å; N85-F87 PolarHBondContact O-N 2.75Å; N85-L197 WeakPolarHBondContact OD1-CB 3.47Å; N85-L197 PolarHBondContact OD1-N 2.94Å
86	F	87.7	Confident	82.4	Confident	6 Å²	6	49 Å²	49	3%	0.026	25%	0.246	C	C	.	.			trans	-83.2	61.5	-177.2	-67.3	-75.5	0	0	0	113.5	D84 R104 L105 L107 Q111 L115 P195 L197	D84-F86 VanDerWaalsContact C-N 3.33Å; D84-F86 PolarHBondContact O-N 3.24Å; F86-R104 WeakPolarHBondContact O-CD 3.29Å; F86-L105 HydrophobicContact CB-CB 4.34Å; F86-L105 VanDerWaalsContact O-CB 3.31Å; F86-L105 WeakPolarHBondContact O-CB 3.16Å; F86-L105 PolarHBondContact O-N 3.08Å; F86-L107 HydrophobicContact CB-CD2 3.49Å; F86-L107 VanDerWaalsContact CB-CD2 3.49Å; F86-L107 HydrophobicContact CD1-CD2 4.06Å; F86-L107 HydrophobicContact CD2-CD2 3.6Å; F86-L107 HydrophobicContact CE2-CD2 4.42Å; F86-L107 HydrophobicContact CG-CD2 3.39Å; F86-Q111 HydrophobicContact CE1-CG 4.37Å; F86-Q111 HydrophobicContact CE2-CG 4.44Å; F86-Q111 HydrophobicContact CZ-CG 4.02Å; F86-L115 HydrophobicContact CD2-CD1 4.23Å; F86-L115 HydrophobicContact CE2-CD1 4.45Å; F86-P195 HydrophobicContact CE2-CB 4.21Å; F86-P195 HydrophobicContact CE2-CG 4Å; F86-P195 WeakPolarHBondContact CE2-O 3.48Å; F86-P195 HydrophobicContact CZ-CB 4.11Å; F86-P195 HydrophobicContact CZ-CG 4.41Å; F86-P195 WeakPolarHBondContact CZ-O 3.06Å; F86-L197 HydrophobicContact CD1-CD1 3.93Å; F86-L197 HydrophobicContact CE1-CB 4.34Å; F86-L197 HydrophobicContact CE1-CD1 4.18Å
87	F	86.8	Confident	83	Confident	12 Å²	12	48.2 Å²	48.2	5%	0.053	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	140.2	177.9	-64	-97.1	0	0	0	110.2	F59 P78 D84 N85 F102 E103 R104 F147	F59-F87 HydrophobicContact CD1-CB 4.45Å; F59-F87 HydrophobicContact CE1-CB 4.41Å; F59-F87 HydrophobicContact CE1-CD2 4Å; P78-F87 HydrophobicContact CB-CD1 3.91Å; P78-F87 HydrophobicContact CB-CD2 4.31Å; P78-F87 HydrophobicContact CB-CE1 3.76Å; P78-F87 HydrophobicContact CB-CE2 4.22Å; P78-F87 HydrophobicContact CB-CG 4.18Å; P78-F87 HydrophobicContact CB-CZ 3.93Å; P78-F87 HydrophobicContact CG-CD2 4.19Å; P78-F87 HydrophobicContact CG-CE2 4.29Å; P78-F87 HydrophobicContact CG-CG 4.34Å; P78-F87 HydrophobicContact CG-CZ 4.49Å; P78-F87 WeakPolarHBondContact O-CE1 3.44Å; P78-F87 WeakPolarHBondContact O-CZ 3.16Å; D84-F87 WeakPolarHBondContact O-CE2 3.41Å; N85-F87 VanDerWaalsContact C-N 3.25Å; N85-F87 PolarHBondContact O-N 2.75Å; F87-F102 HydrophobicContact CB-CB 4.46Å; F87-F102 HydrophobicContact CB-CD1 4.27Å; F87-F102 HydrophobicContact CD1-CB 4.04Å; F87-E103 CarbonylContact C-O 3.56Å; F87-E103 WeakPolarHBondContact CA-O 3.14Å; F87-R104 HydrophobicContact CD1-CB 4.3Å; F87-R104 HydrophobicContact CE1-CB 4.08Å; F87-R104 VanDerWaalsContact CE1-CD 3.45Å; F87-R104 HydrophobicContact CE1-CG 4.35Å; F87-F147 HydrophobicContact CZ-CZ 4.33Å
88	K	85.4	Confident	83.4	Confident	79 Å²	79	45.8 Å²	45.8	34%	0.343	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	122.4	161.5	-172.2	-174.5	-174.9	-173.5	0	107	D62 F102 E103 L105	D62-K88 HydrophobicContact CB-CG 4.45Å; D62-K88 WeakPolarHBondContact OD1-CE 3.3Å; D62-K88 IonicContact OD1-NZ 3.17Å; D62-K88 WeakPolarHBondContact OD2-CE 3.19Å; D62-K88 IonicContact OD2-NZ 2.71Å; D62-K88 PolarHBondContact OD2-NZ 3.48Å; K88-F102 WeakPolarHBondContact O-CA 3.35Å; K88-E103 HydrophobicContact CB-CB 4.21Å; K88-E103 PolarHBondContact N-O 3.47Å; K88-E103 PolarHBondContact O-N 3.09Å; K88-L105 HydrophobicContact CB-CD2 4.14Å
89	F	88.1	Confident	83.7	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	139	-171.3	169.7	-119.5	0	0	0	111.5	F59 C61 D62 V68 L73 C91 E100 S101 F102	F59-F89 HydrophobicContact CB-CB 4.14Å; F59-F89 HydrophobicContact CB-CD1 3.67Å; F59-F89 HydrophobicContact CB-CE1 4.16Å; F59-F89 HydrophobicContact CB-CG 3.9Å; C61-F89 WeakPolarHBondContact CA-O 3.42Å; C61-F89 HydrophobicContact CB-CD1 4.05Å; C61-F89 HydrophobicContact CB-CE1 4.21Å; D62-F89 PolarHBondContact N-O 2.86Å; V68-F89 HydrophobicContact CB-CE1 3.87Å; V68-F89 HydrophobicContact CB-CZ 4.32Å; V68-F89 HydrophobicContact CG2-CE1 3.81Å; V68-F89 HydrophobicContact CG2-CZ 4.38Å; L73-F89 HydrophobicContact CD2-CE1 4.42Å; L73-F89 HydrophobicContact CD2-CE2 3.76Å; L73-F89 HydrophobicContact CD2-CZ 3.55Å; F89-C91 HydrophobicContact CE1-CB 3.83Å; F89-C91 HydrophobicContact CZ-CB 3.67Å; F89-E100 HydrophobicContact CE2-CB 4.14Å; F89-E100 HydrophobicContact CE2-CG 4Å; F89-E100 HydrophobicContact CZ-CG 4.38Å; F89-S101 WeakPolarHBondContact CA-O 3.31Å; F89-F102 HydrophobicContact CB-CD1 4.35Å; F89-F102 HydrophobicContact CB-CE1 4.44Å; F89-F102 AromaticContact CD2-CD1 3.72Å; F89-F102 HydrophobicContact CD2-CD1 3.72Å; F89-F102 AromaticContact CD2-CE1 3.25Å; F89-F102 HydrophobicContact CD2-CE1 3.25Å; F89-F102 HydrophobicContact CD2-CE2 4.39Å; F89-F102 HydrophobicContact CD2-CG 4.47Å; F89-F102 AromaticContact CD2-CZ 3.63Å; F89-F102 HydrophobicContact CD2-CZ 3.63Å; F89-F102 AromaticContact CE2-CE1 3.67Å; F89-F102 HydrophobicContact CE2-CE1 3.67Å; F89-F102 HydrophobicContact CE2-CE2 4.36Å; F89-F102 AromaticContact CE2-CZ 3.57Å; F89-F102 HydrophobicContact CE2-CZ 3.57Å; F89-F102 HydrophobicContact CG-CD1 4.42Å; F89-F102 HydrophobicContact CG-CE1 4.07Å
90	L	86.8	Confident	84	Confident	34 Å²	34	53.2 Å²	53.2	18%	0.178	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	125.8	163.3	-62.9	174.3	0	0	0	108.3	D62 R63 E100 S101	D62-L90 HydrophobicContact CB-CD2 3.84Å; R63-L90 HydrophobicContact CB-CD2 4.04Å; R63-L90 HydrophobicContact CG-CD2 3.73Å; L90-E100 WeakPolarHBondContact O-CA 3.19Å; L90-S101 WeakPolarHBondContact CB-OG 3.49Å; L90-S101 PolarHBondContact N-O 3.46Å; L90-S101 PolarHBondContact O-N 3.35Å; L90-S101 VanDerWaalsContact O-N 3.12Å
91	C	87.3	Confident	84.1	Confident	11 Å²	11	49.6 Å²	49.6	7%	0.074	27%	0.265	C	S	.	.			trans	-76.2	158.2	176.2	67.9	0	0	0	0	111.7	C61 V68 F89 N93 C94 S95	C61-C91 HydrophobicContact CB-CB 4.44Å; C61-C91 PolarHBondContact SG-N 3.2Å; C61-C91 VanDerWaalsContact SG-N 3.44Å; V68-C91 HydrophobicContact CG2-CB 4.47Å; F89-C91 HydrophobicContact CE1-CB 3.83Å; F89-C91 HydrophobicContact CZ-CB 3.67Å; C91-N93 PolarHBondContact O-N 3.45Å; C91-C94 PolarHBondContact O-N 3.17Å; C91-S95 PolarHBondContact O-N 3.19Å
92	C	85	Confident	84.1	Confident	20 Å²	20	52.2 Å²	52.2	14%	0.135	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-50.3	-41.1	177.6	42.3	0	0	0	0	113.2	C94 S95 G98 E100	C92-C94 PolarHBondContact O-N 3.18Å; C92-C94 VanDerWaalsContact O-N 3.14Å; C92-S95 PolarHBondContact O-N 3.19Å; C92-G98 WeakPolarHBondContact CA-O 3.37Å; C92-G98 WeakPolarHBondContact CB-O 3.27Å; C92-E100 HydrophobicContact CB-CG 4.07Å; C92-E100 PolarHBondContact SG-OE1 3.2Å
93	N	83.1	Confident	84.2	Confident	144 Å²	144	54.5 Å²	54.5	77%	0.77	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-68.7	-5.8	177.4	-66	2.2	0	0	0	115.1	C91	C91-N93 PolarHBondContact O-N 3.45Å
94	C	84.3	Confident	84.4	Confident	28 Å²	28	57.4 Å²	57.4	19%	0.189	30%	0.298	C	S	.	.	G	3₁₀ helix	trans	-123.9	-1.1	-179.3	-70.7	0	0	0	0	113.3	R63 C64 C91 C92	R63-C94 HydrophobicContact CB-CB 3.74Å; R63-C94 WeakPolarHBondContact CD-O 2.96Å; R63-C94 PolarHBondContact NH1-O 3.25Å; C64-C94 VanDerWaalsContact CB-SG 3.56Å; C91-C94 PolarHBondContact O-N 3.17Å; C92-C94 PolarHBondContact O-N 3.18Å; C92-C94 VanDerWaalsContact O-N 3.14Å
95	S	84.7	Confident	84.3	Confident	25 Å²	25	60.6 Å²	60.6	18%	0.175	31%	0.314	C	S	.	.			trans	-95.4	134.4	179.6	-174.9	0	0	0	0	109.9	C91 C92 D97 G98 K99	C91-S95 PolarHBondContact O-N 3.19Å; C92-S95 PolarHBondContact O-N 3.19Å; S95-D97 PolarHBondContact O-N 2.95Å; S95-G98 PolarHBondContact O-N 2.97Å; S95-K99 WeakPolarHBondContact CB-O 3.49Å; S95-K99 PolarHBondContact OG-O 2.65Å
96	E	77.6	Confident	84.4	Confident	161 Å²	161	70 Å²	70	75%	0.752	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.3	-28	179	-77.3	141.1	-118.8	0	0	112.1	R63 G98	R63-E96 IonicContact CZ-OE1 3.54Å; R63-E96 IonicContact NH1-OE1 3.99Å; R63-E96 PolarHBondContact NH1-OE1 2.62Å; R63-E96 IonicContact NH2-OE1 3.55Å; R63-E96 PolarHBondContact NH2-OE1 2.9Å; E96-G98 VanDerWaalsContact C-N 3.32Å
97	D	79.4	Confident	84.4	Confident	137 Å²	137	69.9 Å²	69.9	73%	0.733	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	0.4	173.6	-63	-56.5	0	0	0	113.7	S95 K99	S95-D97 PolarHBondContact O-N 2.95Å; D97-K99 HydrophobicContact CB-CB 4.46Å; D97-K99 PolarHBondContact O-N 2.79Å
98	G	76.8	Confident	84.6	Confident	46 Å²	46	72.8 Å²	72.8	47%	0.474	37%	0.367	S	S	.	.	S	Bend	trans	66.1	1.8	-171.8	0	0	0	0	0	115.2	C92 S95 E96	C92-G98 WeakPolarHBondContact CA-O 3.37Å; C92-G98 WeakPolarHBondContact CB-O 3.27Å; S95-G98 PolarHBondContact O-N 2.97Å; E96-G98 VanDerWaalsContact C-N 3.32Å
99	K	81.4	Confident	84.9	Confident	155 Å²	155	71.5 Å²	71.5	67%	0.674	36%	0.36	S	S	*	.			trans	-99.9	143	-176.9	-68.2	172.4	-174.4	171.8	0	111.9	S95 D97	S95-K99 WeakPolarHBondContact CB-O 3.49Å; S95-K99 PolarHBondContact OG-O 2.65Å; D97-K99 HydrophobicContact CB-CB 4.46Å; D97-K99 PolarHBondContact O-N 2.79Å
100	E	86.1	Confident	85	Confident	32 Å²	32	75.1 Å²	75.1	15%	0.15	38%	0.377	C	S	.	.			trans	-69.2	139.6	173.1	-74.7	161.8	-160.8	0	0	111.1	L73 R74 F89 L90 C92 F102	L73-E100 WeakPolarHBondContact CA-OE2 3.29Å; R74-E100 PolarHBondContact N-OE1 2.68Å; R74-E100 PolarHBondContact N-OE2 3.31Å; F89-E100 HydrophobicContact CE2-CB 4.14Å; F89-E100 HydrophobicContact CE2-CG 4Å; F89-E100 HydrophobicContact CZ-CG 4.38Å; L90-E100 WeakPolarHBondContact O-CA 3.19Å; C92-E100 HydrophobicContact CB-CG 4.07Å; C92-E100 PolarHBondContact SG-OE1 3.2Å; E100-F102 HydrophobicContact CB-CE2 4.12Å
101	S	83.9	Confident	85.2	Confident	50 Å²	50	75.7 Å²	75.7	35%	0.35	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	135.2	179.5	77.5	0	0	0	0	111.7	F89 L90	F89-S101 WeakPolarHBondContact CA-O 3.31Å; L90-S101 WeakPolarHBondContact CB-OG 3.49Å; L90-S101 PolarHBondContact N-O 3.46Å; L90-S101 PolarHBondContact O-N 3.35Å; L90-S101 VanDerWaalsContact O-N 3.12Å
102	F	85.8	Confident	85.4	Confident	59 Å²	59	75.2 Å²	75.2	26%	0.259	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	116.7	179.3	-58.3	-89.8	0	0	0	110.7	F59 L73 P78 F87 K88 F89 E100	F59-F102 HydrophobicContact CD1-CD1 4.41Å; F59-F102 HydrophobicContact CD1-CE1 4.12Å; F59-F102 HydrophobicContact CE1-CE1 4.37Å; F59-F102 HydrophobicContact CG-CE1 4.23Å; L73-F102 HydrophobicContact CD1-CE1 4.24Å; L73-F102 HydrophobicContact CD1-CZ 3.81Å; L73-F102 HydrophobicContact CD2-CE1 4.48Å; L73-F102 HydrophobicContact CD2-CZ 3.97Å; L73-F102 HydrophobicContact CG-CZ 4.43Å; P78-F102 HydrophobicContact CB-CB 3.91Å; P78-F102 HydrophobicContact CB-CD1 3.79Å; P78-F102 HydrophobicContact CB-CD2 4.2Å; P78-F102 HydrophobicContact CB-CE1 4.34Å; P78-F102 HydrophobicContact CB-CG 3.71Å; P78-F102 HydrophobicContact CG-CD1 3.65Å; P78-F102 HydrophobicContact CG-CE1 3.78Å; P78-F102 HydrophobicContact CG-CG 4.08Å; P78-F102 HydrophobicContact CG-CZ 4.35Å; F87-F102 HydrophobicContact CB-CB 4.46Å; F87-F102 HydrophobicContact CB-CD1 4.27Å; F87-F102 HydrophobicContact CD1-CB 4.04Å; K88-F102 WeakPolarHBondContact O-CA 3.35Å; F89-F102 HydrophobicContact CB-CD1 4.35Å; F89-F102 HydrophobicContact CB-CE1 4.44Å; F89-F102 AromaticContact CD2-CD1 3.72Å; F89-F102 HydrophobicContact CD2-CD1 3.72Å; F89-F102 AromaticContact CD2-CE1 3.25Å; F89-F102 HydrophobicContact CD2-CE1 3.25Å; F89-F102 HydrophobicContact CD2-CE2 4.39Å; F89-F102 HydrophobicContact CD2-CG 4.47Å; F89-F102 AromaticContact CD2-CZ 3.63Å; F89-F102 HydrophobicContact CD2-CZ 3.63Å; F89-F102 AromaticContact CE2-CE1 3.67Å; F89-F102 HydrophobicContact CE2-CE1 3.67Å; F89-F102 HydrophobicContact CE2-CE2 4.36Å; F89-F102 AromaticContact CE2-CZ 3.57Å; F89-F102 HydrophobicContact CE2-CZ 3.57Å; F89-F102 HydrophobicContact CG-CD1 4.42Å; F89-F102 HydrophobicContact CG-CE1 4.07Å; E100-F102 HydrophobicContact CB-CE2 4.12Å
103	E	84.6	Confident	85.8	Confident	127 Å²	127	74.2 Å²	74.2	59%	0.593	37%	0.369	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.3	126.1	171.8	179	-169.9	-169.2	0	0	109.4	F87 K88 L105	F87-E103 CarbonylContact C-O 3.56Å; F87-E103 WeakPolarHBondContact CA-O 3.14Å; K88-E103 HydrophobicContact CB-CB 4.21Å; K88-E103 PolarHBondContact N-O 3.47Å; K88-E103 PolarHBondContact O-N 3.09Å; E103-L105 PolarHBondContact O-N 3.27Å
104	R	85.2	Confident	86.2	Confident	68 Å²	68	68.2 Å²	68.2	26%	0.257	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	119.1	-174.4	-178.6	59.7	-178.7	-106	24.6	111.9	D84 F86 F87 F147	D84-R104 IonicContact OD1-CZ 2.75Å; D84-R104 IonicContact OD1-NH2 2.62Å; D84-R104 PolarHBondContact OD1-NH2 3.47Å; D84-R104 IonicContact OD2-CZ 3.77Å; D84-R104 IonicContact OD2-NH1 3.34Å; D84-R104 IonicContact OD2-NH2 3.69Å; D84-R104 PolarHBondContact OD2-NH2 3.46Å; F86-R104 WeakPolarHBondContact O-CD 3.29Å; F87-R104 HydrophobicContact CD1-CB 4.3Å; F87-R104 HydrophobicContact CE1-CB 4.08Å; F87-R104 VanDerWaalsContact CE1-CD 3.45Å; F87-R104 HydrophobicContact CE1-CG 4.35Å; R104-F147 PolarHBondContact NH1-O 2.96Å
105	L	86.1	Confident	86.5	Confident	66 Å²	66	66.9 Å²	66.9	35%	0.346	33%	0.328	S	S	.	.			trans	-73.7	143.8	174.8	-61.6	173.8	0	0	0	111.4	F86 K88 E103 L107 L197	F86-L105 HydrophobicContact CB-CB 4.34Å; F86-L105 VanDerWaalsContact O-CB 3.31Å; F86-L105 WeakPolarHBondContact O-CB 3.16Å; F86-L105 PolarHBondContact O-N 3.08Å; K88-L105 HydrophobicContact CB-CD2 4.14Å; E103-L105 PolarHBondContact O-N 3.27Å; L105-L107 PolarHBondContact O-N 3.14Å; L105-L197 HydrophobicContact CD1-CD1 3.65Å
106	R	85.7	Confident	86.9	Confident	209 Å²	209	65.7 Å²	65.7	79%	0.789	32%	0.319	S	S	*	.			trans	-76.5	103.8	-177.1	175	171.8	161.3	159.7	-10.3	111.7
107	L	88.8	Confident	87.5	Confident	5 Å²	5	58 Å²	58	3%	0.026	28%	0.284	C	S	.	.			trans	-61.4	144.2	179.3	-59.1	-175.1	0	0	0	114.3	F86 L105 Q111 V112 L115 L148 R152	F86-L107 HydrophobicContact CB-CD2 3.49Å; F86-L107 VanDerWaalsContact CB-CD2 3.49Å; F86-L107 HydrophobicContact CD1-CD2 4.06Å; F86-L107 HydrophobicContact CD2-CD2 3.6Å; F86-L107 HydrophobicContact CE2-CD2 4.42Å; F86-L107 HydrophobicContact CG-CD2 3.39Å; L105-L107 PolarHBondContact O-N 3.14Å; L107-Q111 HydrophobicContact CB-CB 4.46Å; L107-Q111 HydrophobicContact CD2-CB 4.18Å; L107-V112 HydrophobicContact CB-CG2 3.66Å; L107-V112 HydrophobicContact CD1-CG2 3.73Å; L107-V112 HydrophobicContact CG-CG2 4.37Å; L107-L115 HydrophobicContact CD1-CD1 3.81Å; L107-L148 HydrophobicContact CD1-CD2 3.75Å; L107-R152 PolarHBondContact O-NH1 3.47Å
108	T	90.9	Very high	88	Confident	73 Å²	73	52.4 Å²	52.4	45%	0.448	25%	0.252	S	S	.	.			trans	-77.2	158.6	160.9	66.5	0	0	0	0	110.8	Q110 Q111 V112	T108-Q110 VanDerWaalsContact C-N 3.25Å; T108-Q110 PolarHBondContact O-N 3.16Å; T108-Q111 PolarHBondContact O-N 3.27Å; T108-Q111 VanDerWaalsContact OG1-CD 3.26Å; T108-Q111 WeakPolarHBondContact OG1-CG 3.4Å; T108-Q111 PolarHBondContact OG1-N 3.1Å; T108-Q111 PolarHBondContact OG1-OE1 3.47Å; T108-V112 WeakPolarHBondContact O-CG2 3.39Å; T108-V112 PolarHBondContact O-N 3.2Å
109	W	90.9	Very high	88.7	Confident	51 Å²	51	50.8 Å²	50.8	19%	0.193	23%	0.233	C	C	.	.	H	α-helix	trans	-62.1	-32	176.7	-79.2	111.1	0	0	0	113.2	V112 V113 I141 W145 L149 W158 T161 V162 C165	W109-V112 HydrophobicContact CE3-CG1 4.38Å; W109-V112 HydrophobicContact CZ3-CG1 4.5Å; W109-V112 PolarHBondContact O-N 2.79Å; W109-V113 WeakPolarHBondContact O-CG2 3.33Å; W109-V113 PolarHBondContact O-N 3.18Å; W109-I141 HydrophobicContact CZ3-CG2 4.39Å; W109-W145 AromaticContact CH2-CH2 3.87Å; W109-W145 HydrophobicContact CH2-CH2 3.87Å; W109-W145 AromaticContact CH2-CZ3 3.86Å; W109-W145 HydrophobicContact CH2-CZ3 3.86Å; W109-W145 HydrophobicContact CZ2-CH2 4.42Å; W109-L149 HydrophobicContact CH2-CD1 3.71Å; W109-L149 HydrophobicContact CZ2-CD1 4.35Å; W109-L149 HydrophobicContact CZ3-CD1 3.95Å; W109-W158 HydrophobicContact CH2-CB 4.12Å; W109-W158 HydrophobicContact CZ2-CB 4.45Å; W109-T161 HydrophobicContact CD2-CG2 3.97Å; W109-T161 HydrophobicContact CG-CG2 3.83Å; W109-V162 HydrophobicContact CE3-CG2 4.19Å; W109-V162 HydrophobicContact CZ3-CG2 3.93Å; W109-C165 WeakPolarHBondContact CB-SG 3.27Å
110	Q	90.9	Very high	89.1	Confident	76 Å²	76	43.6 Å²	43.6	36%	0.355	20%	0.201	S	C	.	.	H	α-helix	trans	-63	-48.4	174.5	-177.3	-178.8	-11.3	0	0	111.5	T108 V112 V113 M114 F173	T108-Q110 VanDerWaalsContact C-N 3.25Å; T108-Q110 PolarHBondContact O-N 3.16Å; Q110-V112 VanDerWaalsContact C-N 3.33Å; Q110-V112 PolarHBondContact O-N 2.91Å; Q110-V113 PolarHBondContact O-N 3.13Å; Q110-M114 HydrophobicContact CG-SD 4.03Å; Q110-M114 WeakPolarHBondContact O-CB 3.43Å; Q110-M114 WeakPolarHBondContact O-CG 3.44Å; Q110-M114 PolarHBondContact O-N 3.41Å; Q110-F173 VanDerWaalsContact NE2-CD2 3.28Å
111	Q	90.6	Very high	89.2	Confident	47 Å²	47	43.6 Å²	43.6	22%	0.22	21%	0.205	C	C	.	.	H	α-helix	trans	-61.3	-40.8	176.4	-72.3	154.7	-37.7	0	0	111.9	F86 L107 T108 V113 M114 L115 P195	F86-Q111 HydrophobicContact CE1-CG 4.37Å; F86-Q111 HydrophobicContact CE2-CG 4.44Å; F86-Q111 HydrophobicContact CZ-CG 4.02Å; L107-Q111 HydrophobicContact CB-CB 4.46Å; L107-Q111 HydrophobicContact CD2-CB 4.18Å; T108-Q111 PolarHBondContact O-N 3.27Å; T108-Q111 VanDerWaalsContact OG1-CD 3.26Å; T108-Q111 WeakPolarHBondContact OG1-CG 3.4Å; T108-Q111 PolarHBondContact OG1-N 3.1Å; T108-Q111 PolarHBondContact OG1-OE1 3.47Å; Q111-V113 PolarHBondContact O-N 2.79Å; Q111-M114 PolarHBondContact O-N 2.98Å; Q111-L115 WeakPolarHBondContact O-CB 3.28Å; Q111-L115 WeakPolarHBondContact O-CG 3.27Å; Q111-L115 PolarHBondContact O-N 2.99Å; Q111-P195 HydrophobicContact CG-CB 4.4Å
112	V	92	Very high	89.2	Confident	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-60.6	-44.5	176	170	0	0	0	0	111.9	L107 T108 W109 Q110 A116 I141 L148 L149	L107-V112 HydrophobicContact CB-CG2 3.66Å; L107-V112 HydrophobicContact CD1-CG2 3.73Å; L107-V112 HydrophobicContact CG-CG2 4.37Å; T108-V112 WeakPolarHBondContact O-CG2 3.39Å; T108-V112 PolarHBondContact O-N 3.2Å; W109-V112 HydrophobicContact CE3-CG1 4.38Å; W109-V112 HydrophobicContact CZ3-CG1 4.5Å; W109-V112 PolarHBondContact O-N 2.79Å; Q110-V112 VanDerWaalsContact C-N 3.33Å; Q110-V112 PolarHBondContact O-N 2.91Å; V112-A116 WeakPolarHBondContact O-CB 3.27Å; V112-A116 PolarHBondContact O-N 3.1Å; V112-I141 HydrophobicContact CG1-CD1 3.97Å; V112-I141 HydrophobicContact CG1-CG1 3.92Å; V112-I141 HydrophobicContact CG1-CG2 3.95Å; V112-L148 HydrophobicContact CG1-CD1 4.35Å; V112-L148 HydrophobicContact CG2-CB 4.43Å; V112-L149 HydrophobicContact CG2-CD2 3.91Å; V112-L149 HydrophobicContact CG2-CG 4.35Å
113	V	92.9	Very high	89.1	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-70.1	-41.3	178.4	174.7	0	0	0	0	111.4	W109 Q110 Q111 A116 M117 I137 I141 V162 C165 L166 F174	W109-V113 WeakPolarHBondContact O-CG2 3.33Å; W109-V113 PolarHBondContact O-N 3.18Å; Q110-V113 PolarHBondContact O-N 3.13Å; Q111-V113 PolarHBondContact O-N 2.79Å; V113-A116 PolarHBondContact O-N 3.21Å; V113-M117 HydrophobicContact CG1-CG 4.38Å; V113-M117 HydrophobicContact CG1-SD 3.9Å; V113-M117 WeakPolarHBondContact O-CG 3.44Å; V113-M117 PolarHBondContact O-N 2.9Å; V113-I137 HydrophobicContact CG1-CG2 4.34Å; V113-I141 HydrophobicContact CG2-CD1 4.04Å; V113-V162 HydrophobicContact CG2-CB 4.5Å; V113-V162 HydrophobicContact CG2-CG1 3.94Å; V113-V162 HydrophobicContact CG2-CG2 4.38Å; V113-C165 HydrophobicContact CG2-CB 4.49Å; V113-L166 HydrophobicContact CG1-CD2 3.63Å; V113-L166 HydrophobicContact CG1-CG 4.12Å; V113-F174 HydrophobicContact CB-CZ 4.08Å; V113-F174 HydrophobicContact CG1-CE1 3.74Å; V113-F174 HydrophobicContact CG1-CE2 4.37Å; V113-F174 HydrophobicContact CG1-CZ 3.63Å
114	M	90.9	Very high	88.6	Confident	18 Å²	18	43.6 Å²	43.6	9%	0.089	22%	0.218	C	C	.	.	H	α-helix	trans	-63	-45	176	-71.7	178.7	70.3	0	0	112.4	Q110 Q111 A116 M117 Y118 F173 F174 L189 P195	Q110-M114 HydrophobicContact CG-SD 4.03Å; Q110-M114 WeakPolarHBondContact O-CB 3.43Å; Q110-M114 WeakPolarHBondContact O-CG 3.44Å; Q110-M114 PolarHBondContact O-N 3.41Å; Q111-M114 PolarHBondContact O-N 2.98Å; M114-A116 VanDerWaalsContact C-N 3.35Å; M114-A116 PolarHBondContact O-N 2.94Å; M114-M117 PolarHBondContact O-N 2.84Å; M114-Y118 VanDerWaalsContact O-CB 3.26Å; M114-Y118 WeakPolarHBondContact O-CB 3.39Å; M114-Y118 PolarHBondContact O-N 3.36Å; M114-F173 HydrophobicContact CE-CD1 3.73Å; M114-F173 HydrophobicContact CE-CE1 4.36Å; M114-F173 HydrophobicContact SD-CB 4.42Å; M114-F173 HydrophobicContact SD-CD1 3.8Å; M114-F173 HydrophobicContact SD-CE1 4.41Å; M114-F173 HydrophobicContact SD-CG 4.25Å; M114-F174 HydrophobicContact CG-CE1 3.71Å; M114-F174 HydrophobicContact CG-CZ 3.73Å; M114-L189 HydrophobicContact CG-CD2 4.24Å; M114-P195 HydrophobicContact CB-CB 4.28Å; M114-P195 HydrophobicContact CB-CG 3.83Å; M114-P195 HydrophobicContact CE-CB 3.94Å; M114-P195 HydrophobicContact SD-CB 4.14Å
115	L	91	Very high	87.9	Confident	0 Å²	0	44.3 Å²	44.3	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-62.7	-41	175.4	-74.3	171	0	0	0	111.9	D84 F86 L107 Q111 Y118 N119 L148 P195	D84-L115 HydrophobicContact CB-CD1 4.24Å; D84-L115 HydrophobicContact CB-CD2 3.99Å; F86-L115 HydrophobicContact CD2-CD1 4.23Å; F86-L115 HydrophobicContact CE2-CD1 4.45Å; L107-L115 HydrophobicContact CD1-CD1 3.81Å; Q111-L115 WeakPolarHBondContact O-CB 3.28Å; Q111-L115 WeakPolarHBondContact O-CG 3.27Å; Q111-L115 PolarHBondContact O-N 2.99Å; L115-Y118 PolarHBondContact O-N 2.91Å; L115-N119 PolarHBondContact O-N 3.4Å; L115-N119 PolarHBondContact O-ND2 3.1Å; L115-L148 HydrophobicContact CB-CD2 4.48Å; L115-L148 HydrophobicContact CD1-CD2 4.1Å; L115-P195 HydrophobicContact CD2-CG 3.92Å; L115-P195 HydrophobicContact CG-CG 3.79Å
116	A	92.6	Very high	87.3	Confident	0 Å²	0	42.4 Å²	42.4	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-49.6	176.6	0	0	0	0	0	112	V112 V113 M114 Y118 N119 L120 I137 F140 I141	V112-A116 WeakPolarHBondContact O-CB 3.27Å; V112-A116 PolarHBondContact O-N 3.1Å; V113-A116 PolarHBondContact O-N 3.21Å; M114-A116 VanDerWaalsContact C-N 3.35Å; M114-A116 PolarHBondContact O-N 2.94Å; A116-Y118 VanDerWaalsContact C-N 3.34Å; A116-Y118 PolarHBondContact O-N 3.27Å; A116-N119 PolarHBondContact O-N 2.88Å; A116-L120 WeakPolarHBondContact O-CB 3.41Å; A116-L120 VanDerWaalsContact O-CG 3.27Å; A116-L120 WeakPolarHBondContact O-CG 3.15Å; A116-L120 PolarHBondContact O-N 2.95Å; A116-I137 HydrophobicContact CB-CG2 4.42Å; A116-F140 HydrophobicContact CB-CD1 3.5Å; A116-F140 HydrophobicContact CB-CE1 4.01Å; A116-F140 HydrophobicContact CB-CG 4.25Å; A116-I141 HydrophobicContact CB-CD1 4.18Å; A116-I141 HydrophobicContact CB-CG1 3.74Å
117	M	91.1	Very high	87	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67.8	-32	179.2	-66.5	178.9	76.6	0	0	113.2	V113 M114 S121 I137 L166 F174 W187 K188 L189	V113-M117 HydrophobicContact CG1-CG 4.38Å; V113-M117 HydrophobicContact CG1-SD 3.9Å; V113-M117 WeakPolarHBondContact O-CG 3.44Å; V113-M117 PolarHBondContact O-N 2.9Å; M114-M117 PolarHBondContact O-N 2.84Å; M117-S121 PolarHBondContact O-N 3.29Å; M117-I137 HydrophobicContact CE-CD1 3.92Å; M117-I137 HydrophobicContact CG-CD1 3.68Å; M117-I137 HydrophobicContact CG-CG1 4.08Å; M117-I137 HydrophobicContact CG-CG2 4.23Å; M117-I137 HydrophobicContact SD-CD1 3.76Å; M117-L166 HydrophobicContact SD-CD2 3.73Å; M117-F174 HydrophobicContact CE-CD1 4.31Å; M117-F174 HydrophobicContact SD-CD1 3.55Å; M117-F174 VanDerWaalsContact SD-CD1 3.55Å; M117-F174 HydrophobicContact SD-CE1 3.72Å; M117-W187 HydrophobicContact CE-CB 3.9Å; M117-W187 WeakPolarHBondContact CE-O 3.19Å; M117-K188 VanDerWaalsContact CE-C 3.41Å; M117-L189 HydrophobicContact CB-CD1 3.78Å; M117-L189 HydrophobicContact CB-CD2 4.44Å; M117-L189 HydrophobicContact CB-CG 3.75Å; M117-L189 HydrophobicContact CE-CG 4.46Å
118	Y	90.6	Very high	86.5	Confident	18 Å²	18	46.4 Å²	46.4	7%	0.071	25%	0.248	C	C	.	.	H	α-helix	trans	-69.3	-43.1	175.2	177.7	-108	0	0	0	111.5	K82 M114 L115 A116 S121 L122 P194	K82-Y118 HydrophobicContact CB-CE1 4.01Å; K82-Y118 WeakPolarHBondContact O-CD1 3.49Å; M114-Y118 VanDerWaalsContact O-CB 3.26Å; M114-Y118 WeakPolarHBondContact O-CB 3.39Å; M114-Y118 PolarHBondContact O-N 3.36Å; L115-Y118 PolarHBondContact O-N 2.91Å; A116-Y118 VanDerWaalsContact C-N 3.34Å; A116-Y118 PolarHBondContact O-N 3.27Å; Y118-S121 PolarHBondContact O-N 2.97Å; Y118-S121 PolarHBondContact O-OG 2.86Å; Y118-L122 HydrophobicContact CD1-CD1 4.33Å; Y118-L122 HydrophobicContact CE1-CD1 3.79Å; Y118-L122 WeakPolarHBondContact O-CG 3.45Å; Y118-L122 PolarHBondContact O-N 3.42Å; Y118-P194 HydrophobicContact CD1-CB 3.9Å; Y118-P194 HydrophobicContact CE1-CB 3.9Å; Y118-P194 HydrophobicContact CE1-CG 4.16Å; Y118-P194 HydrophobicContact CG-CB 4.25Å
119	N	89.9	Confident	86.2	Confident	13 Å²	13	44.1 Å²	44.1	7%	0.07	24%	0.239	C	C	.	.	H	α-helix	trans	-70.2	-36.8	176.3	-75	-100.5	0	0	0	111.5	K82 L115 A116 S121 L122 E123 F140	K82-N119 PolarHBondContact N-OD1 2.96Å; K82-N119 PolarHBondContact O-ND2 2.94Å; L115-N119 PolarHBondContact O-N 3.4Å; L115-N119 PolarHBondContact O-ND2 3.1Å; A116-N119 PolarHBondContact O-N 2.88Å; N119-S121 VanDerWaalsContact C-N 3.26Å; N119-S121 PolarHBondContact O-N 3.11Å; N119-L122 PolarHBondContact O-N 3Å; N119-L122 VanDerWaalsContact O-N 3.13Å; N119-E123 PolarHBondContact O-N 2.86Å; N119-F140 HydrophobicContact CB-CE1 4.41Å; N119-F140 HydrophobicContact CB-CE2 3.88Å; N119-F140 HydrophobicContact CB-CZ 3.51Å
120	L	90.1	Very high	86.1	Confident	3 Å²	3	41.9 Å²	41.9	2%	0.016	23%	0.23	C	C	.	.	H	α-helix	trans	-62.3	-28.7	171.1	-74.1	169	0	0	0	113.4	A116 E123 G124 F131 D136 I137 F140	A116-L120 WeakPolarHBondContact O-CB 3.41Å; A116-L120 VanDerWaalsContact O-CG 3.27Å; A116-L120 WeakPolarHBondContact O-CG 3.15Å; A116-L120 PolarHBondContact O-N 2.95Å; L120-E123 PolarHBondContact O-N 3.33Å; L120-G124 PolarHBondContact O-N 3.26Å; L120-F131 HydrophobicContact CB-CD1 3.95Å; L120-F131 HydrophobicContact CB-CE1 3.71Å; L120-F131 HydrophobicContact CB-CE2 4.36Å; L120-F131 HydrophobicContact CB-CG 4.39Å; L120-F131 HydrophobicContact CB-CZ 3.95Å; L120-F131 HydrophobicContact CD1-CD1 4.43Å; L120-F131 HydrophobicContact CD1-CG 4.46Å; L120-F131 WeakPolarHBondContact O-CE1 3.37Å; L120-F131 WeakPolarHBondContact O-CZ 3.34Å; L120-D136 HydrophobicContact CD1-CB 4.4Å; L120-I137 HydrophobicContact CD1-CG1 4.21Å; L120-F140 HydrophobicContact CD1-CB 4.1Å; L120-F140 HydrophobicContact CD1-CG 4.44Å; L120-F140 HydrophobicContact CD2-CB 4.35Å; L120-F140 HydrophobicContact CD2-CD2 3.83Å; L120-F140 HydrophobicContact CD2-CG 4.44Å; L120-F140 HydrophobicContact CG-CB 4.29Å; L120-F140 HydrophobicContact CG-CD2 3.84Å; L120-F140 HydrophobicContact CG-CE2 4.5Å; L120-F140 HydrophobicContact CG-CG 4.2Å
121	S	88.3	Confident	86.2	Confident	32 Å²	32	38.4 Å²	38.4	22%	0.224	21%	0.214	C	C	.	.	H	α-helix	trans	-74.7	-28.4	173.9	80.1	0	0	0	0	113	M117 Y118 N119 G124 N192	M117-S121 PolarHBondContact O-N 3.29Å; Y118-S121 PolarHBondContact O-N 2.97Å; Y118-S121 PolarHBondContact O-OG 2.86Å; N119-S121 VanDerWaalsContact C-N 3.26Å; N119-S121 PolarHBondContact O-N 3.11Å; S121-G124 PolarHBondContact O-N 2.7Å; S121-N192 VanDerWaalsContact OG-CG 3.26Å; S121-N192 PolarHBondContact OG-ND2 3.29Å; S121-N192 PolarHBondContact OG-OD1 3.47Å
122	L	84.6	Confident	86.3	Confident	90 Å²	90	40.4 Å²	40.4	47%	0.471	22%	0.22	S	C	.	.	H	α-helix	trans	-78.1	-28.8	170.8	-59.8	174.9	0	0	0	112.6	K82 Y118 N119 G124	K82-L122 HydrophobicContact CB-CD1 3.64Å; K82-L122 HydrophobicContact CG-CD1 3.96Å; Y118-L122 HydrophobicContact CD1-CD1 4.33Å; Y118-L122 HydrophobicContact CE1-CD1 3.79Å; Y118-L122 WeakPolarHBondContact O-CG 3.45Å; Y118-L122 PolarHBondContact O-N 3.42Å; N119-L122 PolarHBondContact O-N 3Å; N119-L122 VanDerWaalsContact O-N 3.13Å; L122-G124 PolarHBondContact O-N 2.78Å
123	E	84	Confident	86.3	Confident	89 Å²	89	43.8 Å²	43.8	42%	0.416	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-17.2	168.5	-73.2	176.7	-156.9	0	0	111.9	N119 L120 T125 F140 R143	N119-E123 PolarHBondContact O-N 2.86Å; L120-E123 PolarHBondContact O-N 3.33Å; E123-T125 HydrophobicContact CB-CG2 4.34Å; E123-T125 PolarHBondContact O-N 3.06Å; E123-T125 VanDerWaalsContact O-N 3.12Å; E123-F140 WeakPolarHBondContact OE1-CE2 3.33Å; E123-R143 IonicContact OE2-NH2 2.79Å
124	G	73.5	Confident	86.1	Confident	58 Å²	58	49 Å²	49	60%	0.598	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.6	-4.1	-179.9	0	0	0	0	0	115	L120 S121 L122 G126	L120-G124 PolarHBondContact O-N 3.26Å; S121-G124 PolarHBondContact O-N 2.7Å; L122-G124 PolarHBondContact O-N 2.78Å; G124-G126 PolarHBondContact O-N 3.34Å
125	T	69.6	Low	86.2	Confident	83 Å²	83	52 Å²	52	51%	0.509	27%	0.269	S	S	.	.			trans	-81.6	65.2	-170.3	57.1	0	0	0	0	113.3	E123 F131	E123-T125 HydrophobicContact CB-CG2 4.34Å; E123-T125 PolarHBondContact O-N 3.06Å; E123-T125 VanDerWaalsContact O-N 3.12Å; T125-F131 WeakPolarHBondContact O-CD1 3.08Å; T125-F131 VanDerWaalsContact O-CE1 3.27Å; T125-F131 WeakPolarHBondContact O-CE1 3.44Å
126	G	75.1	Confident	86.2	Confident	26 Å²	26	54.3 Å²	54.3	27%	0.268	28%	0.281	S	S	.	.	S	Bend	trans	-156.5	142.6	178.9	0	0	0	0	0	114.5	G124 Q128 G129 Y130	G124-G126 PolarHBondContact O-N 3.34Å; G126-Q128 PolarHBondContact O-N 3.15Å; G126-G129 PolarHBondContact O-N 3.07Å; G126-G129 VanDerWaalsContact O-N 3.15Å; G126-Y130 CarbonylContact C-O 3.6Å; G126-Y130 VanDerWaalsContact CA-O 3.26Å; G126-Y130 WeakPolarHBondContact CA-O 3.14Å
127	R	79.4	Confident	86.2	Confident	149 Å²	149	54.3 Å²	54.3	56%	0.562	28%	0.281	S	S	*	.	B	Isolated β-bridge	trans	-65.9	106.5	178.3	-70.7	-172.2	178.5	172.1	-4.6	109.3	G129 Y130 F181 W186	R127-G129 PolarHBondContact O-N 3.41Å; R127-G129 VanDerWaalsContact O-N 3.11Å; R127-Y130 PolarHBondContact N-O 3.44Å; R127-Y130 WeakPolarHBondContact O-CB 3.48Å; R127-Y130 PolarHBondContact O-N 2.89Å; R127-F181 HydrophobicContact CB-CE1 4.33Å; R127-F181 HydrophobicContact CB-CZ 4.22Å; R127-W186 HydrophobicContact CB-CZ3 4.11Å; R127-W186 VanDerWaalsContact CD-CH2 3.5Å; R127-W186 HydrophobicContact CG-CH2 3.98Å; R127-W186 HydrophobicContact CG-CZ3 3.99Å
128	Q	78.4	Confident	86.3	Confident	149 Å²	149	54.3 Å²	54.3	70%	0.696	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.7	29.1	-172.2	-55.3	177.4	-2	0	0	113.1	G126 K188	G126-Q128 PolarHBondContact O-N 3.15Å; Q128-K188 PolarHBondContact O-NZ 3.46Å
129	G	83.1	Confident	86.4	Confident	25 Å²	25	55.3 Å²	55.3	26%	0.258	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	14.6	-174	0	0	0	0	0	115.5	G126 R127 F131 K188	G126-G129 PolarHBondContact O-N 3.07Å; G126-G129 VanDerWaalsContact O-N 3.15Å; R127-G129 PolarHBondContact O-N 3.41Å; R127-G129 VanDerWaalsContact O-N 3.11Å; G129-F131 WeakPolarHBondContact O-CE2 3.41Å; G129-K188 WeakPolarHBondContact O-CB 3.48Å; G129-K188 WeakPolarHBondContact O-CD 3.41Å; G129-K188 VanDerWaalsContact O-CG 3.24Å; G129-K188 WeakPolarHBondContact O-CG 3.48Å
130	Y	89.8	Confident	86.5	Confident	4 Å²	4	54.8 Å²	54.8	2%	0.016	29%	0.29	C	S	.	.	B	Isolated β-bridge	trans	-93	142.1	164.9	-72.3	-93.8	0	0	0	111.6	G126 R127 R175 E180 F181 W186 W187 K188	G126-Y130 CarbonylContact C-O 3.6Å; G126-Y130 VanDerWaalsContact CA-O 3.26Å; G126-Y130 WeakPolarHBondContact CA-O 3.14Å; R127-Y130 PolarHBondContact N-O 3.44Å; R127-Y130 WeakPolarHBondContact O-CB 3.48Å; R127-Y130 PolarHBondContact O-N 2.89Å; Y130-R175 HydrophobicContact CE1-CG 4.47Å; Y130-R175 WeakPolarHBondContact OH-CD 3.42Å; Y130-E180 WeakPolarHBondContact CE2-OE2 3.38Å; Y130-E180 PolarHBondContact OH-OE1 2.88Å; Y130-E180 PolarHBondContact OH-OE2 3.5Å; Y130-F181 HydrophobicContact CD1-CE2 4.32Å; Y130-F181 AromaticContact CD2-CE2 3.61Å; Y130-F181 HydrophobicContact CD2-CE2 3.61Å; Y130-F181 AromaticContact CD2-CZ 3.94Å; Y130-F181 HydrophobicContact CD2-CZ 3.94Å; Y130-F181 HydrophobicContact CE2-CE2 4.18Å; Y130-F181 AromaticContact CG-CE2 3.68Å; Y130-F181 HydrophobicContact CG-CE2 3.68Å; Y130-F181 HydrophobicContact CG-CZ 4.34Å; Y130-W186 HydrophobicContact CD1-CB 4.36Å; Y130-W187 WeakPolarHBondContact CA-O 3.4Å; Y130-W187 VanDerWaalsContact CD1-C 3.49Å; Y130-K188 HydrophobicContact CD1-CB 3.41Å; Y130-K188 VanDerWaalsContact CD1-CB 3.41Å; Y130-K188 HydrophobicContact CD2-CB 4.19Å; Y130-K188 HydrophobicContact CD2-CD 3.84Å; Y130-K188 HydrophobicContact CE1-CB 3.4Å; Y130-K188 VanDerWaalsContact CE1-CB 3.4Å; Y130-K188 HydrophobicContact CE1-CD 4.37Å; Y130-K188 HydrophobicContact CE2-CB 4.22Å; Y130-K188 HydrophobicContact CE2-CD 3.67Å; Y130-K188 HydrophobicContact CG-CB 3.81Å; Y130-K188 HydrophobicContact CG-CD 4.29Å
131	F	92.8	Very high	86.7	Confident	3 Å²	3	54.6 Å²	54.6	1%	0.013	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	145	-178.6	-49.6	-80.6	0	0	0	109.9	L120 T125 G129 D136 I137 W187	L120-F131 HydrophobicContact CB-CD1 3.95Å; L120-F131 HydrophobicContact CB-CE1 3.71Å; L120-F131 HydrophobicContact CB-CE2 4.36Å; L120-F131 HydrophobicContact CB-CG 4.39Å; L120-F131 HydrophobicContact CB-CZ 3.95Å; L120-F131 HydrophobicContact CD1-CD1 4.43Å; L120-F131 HydrophobicContact CD1-CG 4.46Å; L120-F131 WeakPolarHBondContact O-CE1 3.37Å; L120-F131 WeakPolarHBondContact O-CZ 3.34Å; T125-F131 WeakPolarHBondContact O-CD1 3.08Å; T125-F131 VanDerWaalsContact O-CE1 3.27Å; T125-F131 WeakPolarHBondContact O-CE1 3.44Å; G129-F131 WeakPolarHBondContact O-CE2 3.41Å; F131-D136 HydrophobicContact CB-CB 4.06Å; F131-I137 HydrophobicContact CB-CD1 4.28Å; F131-I137 HydrophobicContact CB-CG1 3.95Å; F131-W187 PolarHBondContact N-O 2.67Å; F131-W187 PolarHBondContact O-N 3.28Å
132	R	91.9	Very high	86.8	Confident	89 Å²	89	54 Å²	54	34%	0.336	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	127.5	172.9	-62.1	178.4	58	118.6	-10.8	109.7	K134 E135 D136 I137 G185 W186	R132-K134 PolarHBondContact O-N 3.35Å; R132-K134 VanDerWaalsContact O-N 3.16Å; R132-E135 HydrophobicContact CB-CB 4.2Å; R132-E135 VanDerWaalsContact CB-OE2 3.28Å; R132-E135 WeakPolarHBondContact CB-OE2 3.45Å; R132-E135 IonicContact CZ-OE1 2.68Å; R132-E135 IonicContact CZ-OE2 2.73Å; R132-E135 IonicContact NE-OE1 3.67Å; R132-E135 IonicContact NE-OE2 3.11Å; R132-E135 PolarHBondContact NE-OE2 2.86Å; R132-E135 VanDerWaalsContact NH2-CD 3.29Å; R132-E135 IonicContact NH2-OE1 2.69Å; R132-E135 PolarHBondContact NH2-OE1 3.49Å; R132-E135 IonicContact NH2-OE2 3.52Å; R132-E135 PolarHBondContact NH2-OE2 3.45Å; R132-D136 PolarHBondContact N-OD2 2.92Å; R132-D136 WeakPolarHBondContact O-CB 3.33Å; R132-D136 PolarHBondContact O-N 3.49Å; R132-I137 PolarHBondContact O-N 3.46Å; R132-G185 WeakPolarHBondContact CA-O 3.48Å; R132-W186 HydrophobicContact CG-CD2 3.99Å; R132-W186 HydrophobicContact CG-CE3 3.79Å; R132-W186 HydrophobicContact CG-CH2 3.55Å; R132-W186 HydrophobicContact CG-CZ2 3.76Å; R132-W186 HydrophobicContact CG-CZ3 3.57Å
133	W	91.8	Very high	87.1	Confident	71 Å²	71	56.9 Å²	56.9	27%	0.269	29%	0.293	S	S	.	.	I	π-helix	trans	-61.5	-30.4	-173.3	73.4	-82.9	0	0	0	114.4	C138 W159 A163 L166 G185	W133-C138 WeakPolarHBondContact O-CB 3.35Å; W133-C138 PolarHBondContact O-N 3.45Å; W133-C138 PolarHBondContact O-SG 3.01Å; W133-W159 HydrophobicContact CZ3-CB 4.31Å; W133-A163 HydrophobicContact CD2-CB 4.43Å; W133-A163 HydrophobicContact CE3-CB 3.99Å; W133-A163 HydrophobicContact CH2-CB 4.26Å; W133-A163 HydrophobicContact CZ3-CB 3.91Å; W133-L166 HydrophobicContact CB-CD1 3.5Å; W133-G185 PolarHBondContact N-O 3.05Å
134	K	90.3	Very high	87.3	Confident	108 Å²	108	54.3 Å²	54.3	47%	0.47	28%	0.281	S	S	.	.	I	π-helix	trans	-94.1	-48.9	-175.1	-174.9	-168.8	174.2	-160.7	0	111.3	R132 C138 W159	R132-K134 PolarHBondContact O-N 3.35Å; R132-K134 VanDerWaalsContact O-N 3.16Å; K134-C138 WeakPolarHBondContact O-CB 3.39Å; K134-W159 HydrophobicContact CG-CE3 3.99Å; K134-W159 HydrophobicContact CG-CZ3 3.79Å; K134-W159 WeakPolarHBondContact O-CZ3 3.02Å
135	E	91.4	Very high	88.1	Confident	82 Å²	82	52 Å²	52	38%	0.383	25%	0.254	S	S	.	.	I	π-helix	trans	-75.5	-35.9	-176.1	-64	77.8	-175	0	0	112.3	R132 A139	R132-E135 HydrophobicContact CB-CB 4.2Å; R132-E135 VanDerWaalsContact CB-OE2 3.28Å; R132-E135 WeakPolarHBondContact CB-OE2 3.45Å; R132-E135 IonicContact CZ-OE1 2.68Å; R132-E135 IonicContact CZ-OE2 2.73Å; R132-E135 IonicContact NE-OE1 3.67Å; R132-E135 IonicContact NE-OE2 3.11Å; R132-E135 PolarHBondContact NE-OE2 2.86Å; R132-E135 VanDerWaalsContact NH2-CD 3.29Å; R132-E135 IonicContact NH2-OE1 2.69Å; R132-E135 PolarHBondContact NH2-OE1 3.49Å; R132-E135 IonicContact NH2-OE2 3.52Å; R132-E135 PolarHBondContact NH2-OE2 3.45Å; E135-A139 WeakPolarHBondContact O-CB 3.34Å
136	D	92	Very high	88.8	Confident	48 Å²	48	54.2 Å²	54.2	26%	0.257	26%	0.263	S	S	.	.	I	π-helix	trans	-106.3	-61.8	-174.5	-47.4	-33.6	0	0	0	111.3	L120 F131 R132 A139 F140	L120-D136 HydrophobicContact CD1-CB 4.4Å; F131-D136 HydrophobicContact CB-CB 4.06Å; R132-D136 PolarHBondContact N-OD2 2.92Å; R132-D136 WeakPolarHBondContact O-CB 3.33Å; R132-D136 PolarHBondContact O-N 3.49Å; D136-A139 PolarHBondContact O-N 2.94Å; D136-F140 WeakPolarHBondContact O-CB 3.47Å; D136-F140 PolarHBondContact O-N 3.4Å
137	I	92.8	Very high	89.3	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	26%	0.261	C	S	.	.	I	π-helix	trans	-65.3	-48.3	-172.2	-53.5	178.7	0	0	0	110.8	V113 A116 M117 L120 F131 R132 F140 I141 V162 L166 W187	V113-I137 HydrophobicContact CG1-CG2 4.34Å; A116-I137 HydrophobicContact CB-CG2 4.42Å; M117-I137 HydrophobicContact CE-CD1 3.92Å; M117-I137 HydrophobicContact CG-CD1 3.68Å; M117-I137 HydrophobicContact CG-CG1 4.08Å; M117-I137 HydrophobicContact CG-CG2 4.23Å; M117-I137 HydrophobicContact SD-CD1 3.76Å; L120-I137 HydrophobicContact CD1-CG1 4.21Å; F131-I137 HydrophobicContact CB-CD1 4.28Å; F131-I137 HydrophobicContact CB-CG1 3.95Å; R132-I137 PolarHBondContact O-N 3.46Å; I137-F140 PolarHBondContact O-N 3.13Å; I137-I141 HydrophobicContact CG2-CD1 4.02Å; I137-I141 WeakPolarHBondContact O-CG1 3.47Å; I137-I141 PolarHBondContact O-N 3.24Å; I137-I141 VanDerWaalsContact O-N 3.07Å; I137-V162 HydrophobicContact CG2-CG1 4.29Å; I137-L166 HydrophobicContact CD1-CD1 4.22Å; I137-L166 HydrophobicContact CD1-CD2 4.32Å; I137-W187 HydrophobicContact CD1-CB 4.2Å
138	C	92.9	Very high	89.6	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-67.9	-34.5	175.3	-72.6	0	0	0	0	112.3	W133 K134 I141 G142 W158 W159	W133-C138 WeakPolarHBondContact O-CB 3.35Å; W133-C138 PolarHBondContact O-N 3.45Å; W133-C138 PolarHBondContact O-SG 3.01Å; K134-C138 WeakPolarHBondContact O-CB 3.39Å; C138-I141 PolarHBondContact O-N 3.41Å; C138-G142 WeakPolarHBondContact O-CA 3.26Å; C138-G142 PolarHBondContact O-N 3.34Å; C138-W158 HydrophobicContact CB-CH2 3.72Å; C138-W158 HydrophobicContact CB-CZ3 3.81Å; C138-W158 VanDerWaalsContact O-CH2 3.32Å; C138-W158 WeakPolarHBondContact O-CH2 3.43Å; C138-W159 HydrophobicContact CB-CD2 4.35Å; C138-W159 HydrophobicContact CB-CE3 3.38Å; C138-W159 HydrophobicContact CB-CH2 4.24Å; C138-W159 HydrophobicContact CB-CZ3 3.33Å
139	A	92.6	Very high	89.8	Confident	40 Å²	40	42 Å²	42	33%	0.331	21%	0.205	S	C	.	.	H	α-helix	trans	-64.9	-42	174.9	0	0	0	0	0	111.9	E135 D136 G142 R143	E135-A139 WeakPolarHBondContact O-CB 3.34Å; D136-A139 PolarHBondContact O-N 2.94Å; A139-G142 CarbonylContact O-C 3.43Å; A139-G142 WeakPolarHBondContact O-CA 3.35Å; A139-G142 PolarHBondContact O-N 2.91Å; A139-G142 VanDerWaalsContact O-N 3.15Å; A139-R143 WeakPolarHBondContact O-CG 3.27Å; A139-R143 PolarHBondContact O-N 3.25Å
140	F	93	Very high	89.8	Confident	1 Å²	1	42.3 Å²	42.3	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-59.7	-49.4	174.2	-172.4	-78.6	0	0	0	111.9	L81 A116 N119 L120 E123 D136 I137 G142 R143 H144	L81-F140 HydrophobicContact CD2-CE1 4.2Å; L81-F140 HydrophobicContact CD2-CZ 3.73Å; A116-F140 HydrophobicContact CB-CD1 3.5Å; A116-F140 HydrophobicContact CB-CE1 4.01Å; A116-F140 HydrophobicContact CB-CG 4.25Å; N119-F140 HydrophobicContact CB-CE1 4.41Å; N119-F140 HydrophobicContact CB-CE2 3.88Å; N119-F140 HydrophobicContact CB-CZ 3.51Å; L120-F140 HydrophobicContact CD1-CB 4.1Å; L120-F140 HydrophobicContact CD1-CG 4.44Å; L120-F140 HydrophobicContact CD2-CB 4.35Å; L120-F140 HydrophobicContact CD2-CD2 3.83Å; L120-F140 HydrophobicContact CD2-CG 4.44Å; L120-F140 HydrophobicContact CG-CB 4.29Å; L120-F140 HydrophobicContact CG-CD2 3.84Å; L120-F140 HydrophobicContact CG-CE2 4.5Å; L120-F140 HydrophobicContact CG-CG 4.2Å; E123-F140 WeakPolarHBondContact OE1-CE2 3.33Å; D136-F140 WeakPolarHBondContact O-CB 3.47Å; D136-F140 PolarHBondContact O-N 3.4Å; I137-F140 PolarHBondContact O-N 3.13Å; F140-G142 PolarHBondContact O-N 2.84Å; F140-R143 PolarHBondContact O-N 3.36Å; F140-H144 AromaticContact CD1-ND1 3.45Å; F140-H144 WeakPolarHBondContact CD1-ND1 3.39Å; F140-H144 AromaticContact CD2-CE1 3.86Å; F140-H144 AromaticContact CD2-ND1 3.79Å; F140-H144 HydrophobicContact CE1-CB 4.48Å; F140-H144 AromaticContact CE1-CE1 3.97Å; F140-H144 AromaticContact CE1-ND1 3.15Å; F140-H144 WeakPolarHBondContact CE1-ND1 3.46Å; F140-H144 AromaticContact CE2-CE1 3.48Å; F140-H144 VanDerWaalsContact CE2-CE1 3.48Å; F140-H144 WeakPolarHBondContact CE2-CE1 3.43Å; F140-H144 AromaticContact CE2-ND1 3.52Å; F140-H144 AromaticContact CG-ND1 3.76Å; F140-H144 AromaticContact CZ-CE1 3.54Å; F140-H144 AromaticContact CZ-ND1 3.19Å; F140-H144 WeakPolarHBondContact CZ-ND1 3.31Å; F140-H144 PolarHBondContact O-N 3.36Å; F140-H144 PolarHBondContact O-ND1 3.12Å
141	I	92.9	Very high	89.1	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.4	-32.2	175.4	-64.2	166	0	0	0	110.9	W109 V112 V113 A116 I137 C138 W145 W158 V162	W109-I141 HydrophobicContact CZ3-CG2 4.39Å; V112-I141 HydrophobicContact CG1-CD1 3.97Å; V112-I141 HydrophobicContact CG1-CG1 3.92Å; V112-I141 HydrophobicContact CG1-CG2 3.95Å; V113-I141 HydrophobicContact CG2-CD1 4.04Å; A116-I141 HydrophobicContact CB-CD1 4.18Å; A116-I141 HydrophobicContact CB-CG1 3.74Å; I137-I141 HydrophobicContact CG2-CD1 4.02Å; I137-I141 WeakPolarHBondContact O-CG1 3.47Å; I137-I141 PolarHBondContact O-N 3.24Å; I137-I141 VanDerWaalsContact O-N 3.07Å; C138-I141 PolarHBondContact O-N 3.41Å; I141-W145 HydrophobicContact CG2-CE3 4.26Å; I141-W145 VanDerWaalsContact O-CA 3.27Å; I141-W145 WeakPolarHBondContact O-CA 3.31Å; I141-W145 WeakPolarHBondContact O-CB 3.45Å; I141-W145 PolarHBondContact O-N 3.5Å; I141-W145 VanDerWaalsContact O-N 3.1Å; I141-W158 HydrophobicContact CG2-CZ3 4.26Å; I141-V162 HydrophobicContact CD1-CG1 4.32Å; I141-V162 HydrophobicContact CD1-CG2 3.92Å
142	G	90.3	Very high	88.5	Confident	19 Å²	19	54.1 Å²	54.1	20%	0.196	27%	0.266	C	S	.	.	H	α-helix	trans	-67.5	-42.2	176.3	0	0	0	0	0	113.4	C138 A139 F140 K154	C138-G142 WeakPolarHBondContact O-CA 3.26Å; C138-G142 PolarHBondContact O-N 3.34Å; A139-G142 CarbonylContact O-C 3.43Å; A139-G142 WeakPolarHBondContact O-CA 3.35Å; A139-G142 PolarHBondContact O-N 2.91Å; A139-G142 VanDerWaalsContact O-N 3.15Å; F140-G142 PolarHBondContact O-N 2.84Å; G142-K154 PolarHBondContact O-NZ 3.41Å
143	R	91	Very high	88.1	Confident	150 Å²	150	59 Å²	59	57%	0.566	29%	0.29	S	S	*	.	H	α-helix	trans	-62.7	-58.3	171.9	-73.6	-171.6	-82.4	156.4	-5.7	110.3	E123 A139 F140 W145	E123-R143 IonicContact OE2-NH2 2.79Å; A139-R143 WeakPolarHBondContact O-CG 3.27Å; A139-R143 PolarHBondContact O-N 3.25Å; F140-R143 PolarHBondContact O-N 3.36Å; R143-W145 VanDerWaalsContact C-N 3.26Å; R143-W145 PolarHBondContact O-N 3.41Å
144	H	89.5	Confident	87.7	Confident	35 Å²	35	61 Å²	61	16%	0.162	30%	0.3	C	S	.	.	S	Bend	trans	-87.3	18.1	-171.9	-55.3	126.9	0	0	0	114.3	Y80 F140 N146 F147 L148	Y80-H144 AromaticContact CE2-CD2 3.74Å; Y80-H144 AromaticContact CZ-CD2 3.99Å; Y80-H144 PolarHBondContact OH-CD2 3.31Å; F140-H144 AromaticContact CD1-ND1 3.45Å; F140-H144 WeakPolarHBondContact CD1-ND1 3.39Å; F140-H144 AromaticContact CD2-CE1 3.86Å; F140-H144 AromaticContact CD2-ND1 3.79Å; F140-H144 HydrophobicContact CE1-CB 4.48Å; F140-H144 AromaticContact CE1-CE1 3.97Å; F140-H144 AromaticContact CE1-ND1 3.15Å; F140-H144 WeakPolarHBondContact CE1-ND1 3.46Å; F140-H144 AromaticContact CE2-CE1 3.48Å; F140-H144 VanDerWaalsContact CE2-CE1 3.48Å; F140-H144 WeakPolarHBondContact CE2-CE1 3.43Å; F140-H144 AromaticContact CE2-ND1 3.52Å; F140-H144 AromaticContact CG-ND1 3.76Å; F140-H144 AromaticContact CZ-CE1 3.54Å; F140-H144 AromaticContact CZ-ND1 3.19Å; F140-H144 WeakPolarHBondContact CZ-ND1 3.31Å; F140-H144 PolarHBondContact O-N 3.36Å; F140-H144 PolarHBondContact O-ND1 3.12Å; H144-N146 PolarHBondContact O-N 3.41Å; H144-F147 PolarHBondContact O-N 2.82Å; H144-L148 HydrophobicContact CB-CD1 3.82Å; H144-L148 HydrophobicContact CB-CG 4.34Å; H144-L148 PolarHBondContact O-N 3.45Å
145	W	88.6	Confident	87.3	Confident	9 Å²	9	59.5 Å²	59.5	3%	0.034	30%	0.3	C	S	.	.	H	α-helix	trans	-55.9	-51.6	-170.5	-179.3	-82.7	0	0	0	113.9	W109 I141 R143 F147 L148 L149 R152 K154 W158	W109-W145 AromaticContact CH2-CH2 3.87Å; W109-W145 HydrophobicContact CH2-CH2 3.87Å; W109-W145 AromaticContact CH2-CZ3 3.86Å; W109-W145 HydrophobicContact CH2-CZ3 3.86Å; W109-W145 HydrophobicContact CZ2-CH2 4.42Å; I141-W145 HydrophobicContact CG2-CE3 4.26Å; I141-W145 VanDerWaalsContact O-CA 3.27Å; I141-W145 WeakPolarHBondContact O-CA 3.31Å; I141-W145 WeakPolarHBondContact O-CB 3.45Å; I141-W145 PolarHBondContact O-N 3.5Å; I141-W145 VanDerWaalsContact O-N 3.1Å; R143-W145 VanDerWaalsContact C-N 3.26Å; R143-W145 PolarHBondContact O-N 3.41Å; W145-F147 PolarHBondContact O-N 3.24Å; W145-L148 PolarHBondContact O-N 3.38Å; W145-L149 HydrophobicContact CD2-CD1 3.79Å; W145-L149 HydrophobicContact CE3-CD1 3.61Å; W145-L149 HydrophobicContact CH2-CD1 3.66Å; W145-L149 HydrophobicContact CZ2-CD1 3.82Å; W145-L149 HydrophobicContact CZ3-CD1 3.55Å; W145-L149 WeakPolarHBondContact O-CB 3.41Å; W145-L149 PolarHBondContact O-N 3.28Å; W145-R152 HydrophobicContact CZ2-CB 4.39Å; W145-R152 PolarHBondContact NE1-O 3.09Å; W145-K154 VanDerWaalsContact CB-CE 3.44Å; W145-K154 HydrophobicContact CD2-CD 4.07Å; W145-K154 HydrophobicContact CD2-CG 3.56Å; W145-K154 HydrophobicContact CE3-CD 4.32Å; W145-K154 HydrophobicContact CE3-CG 3.87Å; W145-K154 HydrophobicContact CG-CD 4.28Å; W145-K154 HydrophobicContact CG-CG 4.13Å; W145-K154 HydrophobicContact CH2-CB 4.39Å; W145-K154 HydrophobicContact CH2-CG 3.86Å; W145-K154 HydrophobicContact CZ2-CB 4.19Å; W145-K154 HydrophobicContact CZ2-CG 3.55Å; W145-K154 HydrophobicContact CZ3-CG 4Å; W145-W158 HydrophobicContact CH2-CB 4.07Å; W145-W158 HydrophobicContact CH2-CD2 4.42Å; W145-W158 HydrophobicContact CH2-CG 4.02Å; W145-W158 HydrophobicContact CZ3-CB 4.24Å; W145-W158 AromaticContact CZ3-CD2 3.75Å; W145-W158 HydrophobicContact CZ3-CD2 3.75Å; W145-W158 HydrophobicContact CZ3-CE3 4.05Å; W145-W158 AromaticContact CZ3-CG 3.83Å; W145-W158 HydrophobicContact CZ3-CG 3.83Å
146	N	85.9	Confident	86.7	Confident	131 Å²	131	61.2 Å²	61.2	70%	0.701	32%	0.321	S	S	*	.	H	α-helix	trans	-63.1	-27.4	-175.1	-64.3	-5.3	0	0	0	111.7	H144 G150	H144-N146 PolarHBondContact O-N 3.41Å; N146-G150 WeakPolarHBondContact O-CA 3.32Å; N146-G150 PolarHBondContact O-N 3.33Å; N146-G150 VanDerWaalsContact O-N 3.17Å
147	F	85.1	Confident	86.4	Confident	50 Å²	50	62.8 Å²	62.8	22%	0.219	33%	0.333	C	S	.	.	H	α-helix	trans	-84.2	-48.9	179.4	-176.5	-105.3	0	0	0	112.2	S79 Y80 L81 D84 F87 R104 H144 W145	S79-F147 WeakPolarHBondContact OG-CE1 3.45Å; S79-F147 WeakPolarHBondContact OG-CZ 3.23Å; Y80-F147 HydrophobicContact CD1-CD1 4.46Å; Y80-F147 HydrophobicContact CD1-CD2 4.42Å; Y80-F147 HydrophobicContact CD1-CE1 4.35Å; Y80-F147 HydrophobicContact CD1-CE2 4.31Å; Y80-F147 HydrophobicContact CD1-CZ 4.3Å; Y80-F147 HydrophobicContact CE1-CB 4.09Å; Y80-F147 AromaticContact CE1-CD1 3.64Å; Y80-F147 HydrophobicContact CE1-CD1 3.64Å; Y80-F147 AromaticContact CE1-CD2 3.67Å; Y80-F147 HydrophobicContact CE1-CD2 3.67Å; Y80-F147 AromaticContact CE1-CE1 3.96Å; Y80-F147 HydrophobicContact CE1-CE1 3.96Å; Y80-F147 AromaticContact CE1-CE2 4Å; Y80-F147 HydrophobicContact CE1-CE2 4Å; Y80-F147 AromaticContact CE1-CG 3.5Å; Y80-F147 HydrophobicContact CE1-CG 3.5Å; Y80-F147 HydrophobicContact CE1-CZ 4.15Å; Y80-F147 AromaticContact CZ-CD1 3.69Å; Y80-F147 AromaticContact CZ-CG 3.8Å; Y80-F147 VanDerWaalsContact OH-CB 3.29Å; Y80-F147 WeakPolarHBondContact OH-CB 3.42Å; L81-F147 HydrophobicContact CB-CE1 4.47Å; L81-F147 HydrophobicContact CD1-CD1 3.83Å; L81-F147 HydrophobicContact CD1-CE1 3.9Å; L81-F147 HydrophobicContact CG-CD1 4.19Å; L81-F147 HydrophobicContact CG-CE1 4Å; D84-F147 VanDerWaalsContact OD2-CE1 3.29Å; D84-F147 WeakPolarHBondContact OD2-CE1 3.42Å; F87-F147 HydrophobicContact CZ-CZ 4.33Å; R104-F147 PolarHBondContact NH1-O 2.96Å; H144-F147 PolarHBondContact O-N 2.82Å; W145-F147 PolarHBondContact O-N 3.24Å
148	L	85	Confident	86.2	Confident	4 Å²	4	63.5 Å²	63.5	2%	0.021	34%	0.335	C	S	.	.	H	α-helix	trans	-72.3	-29.5	-178.9	-74.7	166.7	0	0	0	113.9	L81 L107 V112 L115 H144 W145	L81-L148 HydrophobicContact CD1-CD1 4.23Å; L81-L148 HydrophobicContact CD1-CD2 3.57Å; L81-L148 HydrophobicContact CD1-CG 3.89Å; L107-L148 HydrophobicContact CD1-CD2 3.75Å; V112-L148 HydrophobicContact CG1-CD1 4.35Å; V112-L148 HydrophobicContact CG2-CB 4.43Å; L115-L148 HydrophobicContact CB-CD2 4.48Å; L115-L148 HydrophobicContact CD1-CD2 4.1Å; H144-L148 HydrophobicContact CB-CD1 3.82Å; H144-L148 HydrophobicContact CB-CG 4.34Å; H144-L148 PolarHBondContact O-N 3.45Å; W145-L148 PolarHBondContact O-N 3.38Å
149	L	83.6	Confident	86.1	Confident	12 Å²	12	68.2 Å²	68.2	6%	0.063	35%	0.353	C	S	.	.	H	α-helix	trans	-125.7	-3.3	-171.1	-68.7	169.6	0	0	0	113.9	W109 V112 W145 R152	W109-L149 HydrophobicContact CH2-CD1 3.71Å; W109-L149 HydrophobicContact CZ2-CD1 4.35Å; W109-L149 HydrophobicContact CZ3-CD1 3.95Å; V112-L149 HydrophobicContact CG2-CD2 3.91Å; V112-L149 HydrophobicContact CG2-CG 4.35Å; W145-L149 HydrophobicContact CD2-CD1 3.79Å; W145-L149 HydrophobicContact CE3-CD1 3.61Å; W145-L149 HydrophobicContact CH2-CD1 3.66Å; W145-L149 HydrophobicContact CZ2-CD1 3.82Å; W145-L149 HydrophobicContact CZ3-CD1 3.55Å; W145-L149 WeakPolarHBondContact O-CB 3.41Å; W145-L149 PolarHBondContact O-N 3.28Å; L149-R152 HydrophobicContact CB-CB 4.24Å; L149-R152 VanDerWaalsContact CD2-NH1 3.3Å; L149-R152 WeakPolarHBondContact O-CB 3.49Å; L149-R152 VanDerWaalsContact O-CD 3.28Å; L149-R152 WeakPolarHBondContact O-CD 3.5Å; L149-R152 VanDerWaalsContact O-CG 3.27Å; L149-R152 WeakPolarHBondContact O-CG 3.5Å; L149-R152 PolarHBondContact O-N 2.81Å
150	G	81.9	Confident	85.8	Confident	32 Å²	32	70.2 Å²	70.2	33%	0.33	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.3	-144.2	179.3	0	0	0	0	0	112.8	N146 R152	N146-G150 WeakPolarHBondContact O-CA 3.32Å; N146-G150 PolarHBondContact O-N 3.33Å; N146-G150 VanDerWaalsContact O-N 3.17Å; G150-R152 PolarHBondContact O-N 2.69Å
151	N	76.4	Confident	85.8	Confident	178 Å²	178	72.4 Å²	72.4	95%	0.952	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.8	20.9	-178.4	-64.4	-16.4	0	0	0	114.9	K153	N151-K153 PolarHBondContact O-N 2.87Å
152	R	80.6	Confident	85.8	Confident	78 Å²	78	72.4 Å²	72.4	29%	0.294	38%	0.378	S	S	.	.			trans	-71.7	121.8	173	-79	171.7	143.6	159	-10.8	110	L107 W145 L149 G150	L107-R152 PolarHBondContact O-NH1 3.47Å; W145-R152 HydrophobicContact CZ2-CB 4.39Å; W145-R152 PolarHBondContact NE1-O 3.09Å; L149-R152 HydrophobicContact CB-CB 4.24Å; L149-R152 VanDerWaalsContact CD2-NH1 3.3Å; L149-R152 WeakPolarHBondContact O-CB 3.49Å; L149-R152 VanDerWaalsContact O-CD 3.28Å; L149-R152 WeakPolarHBondContact O-CD 3.5Å; L149-R152 VanDerWaalsContact O-CG 3.27Å; L149-R152 WeakPolarHBondContact O-CG 3.5Å; L149-R152 PolarHBondContact O-N 2.81Å; G150-R152 PolarHBondContact O-N 2.69Å
153	K	82.6	Confident	85.8	Confident	192 Å²	192	72.8 Å²	72.8	84%	0.835	38%	0.38	S	S	*	.			trans	-66.1	135.3	173.3	-63.1	-174.3	178	-175.3	0	110.8	N151 T155	N151-K153 PolarHBondContact O-N 2.87Å; K153-T155 PolarHBondContact O-N 3.01Å; K153-T155 VanDerWaalsContact O-N 3.13Å
154	K	83.4	Confident	85.7	Confident	111 Å²	111	67.2 Å²	67.2	48%	0.483	37%	0.369	S	S	.	.			trans	-63.7	106.7	173.8	-73.8	178.6	175.1	179	0	109.7	G142 W145	G142-K154 PolarHBondContact O-NZ 3.41Å; W145-K154 VanDerWaalsContact CB-CE 3.44Å; W145-K154 HydrophobicContact CD2-CD 4.07Å; W145-K154 HydrophobicContact CD2-CG 3.56Å; W145-K154 HydrophobicContact CE3-CD 4.32Å; W145-K154 HydrophobicContact CE3-CG 3.87Å; W145-K154 HydrophobicContact CG-CD 4.28Å; W145-K154 HydrophobicContact CG-CG 4.13Å; W145-K154 HydrophobicContact CH2-CB 4.39Å; W145-K154 HydrophobicContact CH2-CG 3.86Å; W145-K154 HydrophobicContact CZ2-CB 4.19Å; W145-K154 HydrophobicContact CZ2-CG 3.55Å; W145-K154 HydrophobicContact CZ3-CG 4Å
155	T	82.6	Confident	85.8	Confident	77 Å²	77	66.9 Å²	66.9	47%	0.472	37%	0.37	S	S	.	.			trans	-82.6	142.8	175.9	52.3	0	0	0	0	110.8	K153 T157 W158	K153-T155 PolarHBondContact O-N 3.01Å; K153-T155 VanDerWaalsContact O-N 3.13Å; T155-T157 PolarHBondContact O-N 2.95Å; T155-W158 WeakPolarHBondContact O-CB 3.41Å; T155-W158 PolarHBondContact O-N 3.13Å
156	S	77.6	Confident	85.9	Confident	118 Å²	118	66.5 Å²	66.5	83%	0.825	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	-23.4	-177.6	50.7	0	0	0	0	114.5
157	T	85.6	Confident	86.1	Confident	81 Å²	81	63.8 Å²	63.8	50%	0.497	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	13.1	177.9	66.9	0	0	0	0	114.7	T155 W159 S160 T161	T155-T157 PolarHBondContact O-N 2.95Å; T157-W159 VanDerWaalsContact C-N 3.35Å; T157-W159 PolarHBondContact O-N 3.08Å; T157-S160 PolarHBondContact O-N 2.93Å; T157-T161 PolarHBondContact O-N 3.34Å; T157-T161 PolarHBondContact O-OG1 3.3Å; T157-T161 VanDerWaalsContact O-OG1 3.13Å
158	W	89.5	Confident	86.3	Confident	16 Å²	16	65.9 Å²	65.9	6%	0.061	38%	0.377	C	S	.	.	H	α-helix	trans	-64.8	-38.3	-177.3	76.6	-108.8	0	0	0	112.2	W109 C138 I141 W145 T155 S160 T161 V162	W109-W158 HydrophobicContact CH2-CB 4.12Å; W109-W158 HydrophobicContact CZ2-CB 4.45Å; C138-W158 HydrophobicContact CB-CH2 3.72Å; C138-W158 HydrophobicContact CB-CZ3 3.81Å; C138-W158 VanDerWaalsContact O-CH2 3.32Å; C138-W158 WeakPolarHBondContact O-CH2 3.43Å; I141-W158 HydrophobicContact CG2-CZ3 4.26Å; W145-W158 HydrophobicContact CH2-CB 4.07Å; W145-W158 HydrophobicContact CH2-CD2 4.42Å; W145-W158 HydrophobicContact CH2-CG 4.02Å; W145-W158 HydrophobicContact CZ3-CB 4.24Å; W145-W158 AromaticContact CZ3-CD2 3.75Å; W145-W158 HydrophobicContact CZ3-CD2 3.75Å; W145-W158 HydrophobicContact CZ3-CE3 4.05Å; W145-W158 AromaticContact CZ3-CG 3.83Å; W145-W158 HydrophobicContact CZ3-CG 3.83Å; T155-W158 WeakPolarHBondContact O-CB 3.41Å; T155-W158 PolarHBondContact O-N 3.13Å; W158-S160 VanDerWaalsContact C-N 3.33Å; W158-S160 PolarHBondContact O-N 3.47Å; W158-T161 WeakPolarHBondContact O-CA 3.35Å; W158-T161 VanDerWaalsContact O-CB 3.23Å; W158-T161 WeakPolarHBondContact O-CB 3.41Å; W158-T161 PolarHBondContact O-N 2.93Å; W158-V162 HydrophobicContact CE3-CG2 4.07Å; W158-V162 HydrophobicContact CZ3-CG2 4.12Å; W158-V162 PolarHBondContact O-N 2.96Å; W158-V162 VanDerWaalsContact O-N 3.15Å
159	W	90.4	Very high	86.2	Confident	98 Å²	98	66 Å²	66	37%	0.371	38%	0.38	S	S	.	.	H	α-helix	trans	-53.1	-46.6	172.6	-56.8	84.6	0	0	0	112.4	W133 K134 C138 T157 T161 V162 A163	W133-W159 HydrophobicContact CZ3-CB 4.31Å; K134-W159 HydrophobicContact CG-CE3 3.99Å; K134-W159 HydrophobicContact CG-CZ3 3.79Å; K134-W159 WeakPolarHBondContact O-CZ3 3.02Å; C138-W159 HydrophobicContact CB-CD2 4.35Å; C138-W159 HydrophobicContact CB-CE3 3.38Å; C138-W159 HydrophobicContact CB-CH2 4.24Å; C138-W159 HydrophobicContact CB-CZ3 3.33Å; T157-W159 VanDerWaalsContact C-N 3.35Å; T157-W159 PolarHBondContact O-N 3.08Å; W159-T161 PolarHBondContact O-N 2.93Å; W159-V162 PolarHBondContact O-N 3.45Å; W159-V162 VanDerWaalsContact O-N 3.17Å; W159-A163 PolarHBondContact O-N 3.15Å
160	S	87.5	Confident	86.2	Confident	82 Å²	82	67.1 Å²	67.1	57%	0.573	39%	0.388	S	S	*	.	H	α-helix	trans	-64.3	-22.8	176.8	-44.5	0	0	0	0	113	T157 W158 G164	T157-S160 PolarHBondContact O-N 2.93Å; W158-S160 VanDerWaalsContact C-N 3.33Å; W158-S160 PolarHBondContact O-N 3.47Å; S160-G164 PolarHBondContact O-N 3.17Å; S160-G164 VanDerWaalsContact O-N 3.07Å
161	T	91.5	Very high	86.1	Confident	47 Å²	47	70 Å²	70	29%	0.288	40%	0.401	S	S	.	.	H	α-helix	trans	-78.2	-38.5	176	-46.3	0	0	0	0	110.9	W109 T157 W158 W159 G164 C165	W109-T161 HydrophobicContact CD2-CG2 3.97Å; W109-T161 HydrophobicContact CG-CG2 3.83Å; T157-T161 PolarHBondContact O-N 3.34Å; T157-T161 PolarHBondContact O-OG1 3.3Å; T157-T161 VanDerWaalsContact O-OG1 3.13Å; W158-T161 WeakPolarHBondContact O-CA 3.35Å; W158-T161 VanDerWaalsContact O-CB 3.23Å; W158-T161 WeakPolarHBondContact O-CB 3.41Å; W158-T161 PolarHBondContact O-N 2.93Å; W159-T161 PolarHBondContact O-N 2.93Å; T161-G164 PolarHBondContact O-N 3.36Å; T161-C165 WeakPolarHBondContact O-CB 3.16Å; T161-C165 PolarHBondContact O-N 3.41Å; T161-C165 PolarHBondContact O-SG 3.18Å; T161-C165 VanDerWaalsContact O-SG 3.41Å
162	V	92.8	Very high	86.5	Confident	0 Å²	0	64.1 Å²	64.1	0%	0	38%	0.377	C	S	.	.	H	α-helix	trans	-62.9	-49.1	172	173.8	0	0	0	0	110.8	W109 V113 I137 I141 W158 W159 G164 C165 L166	W109-V162 HydrophobicContact CE3-CG2 4.19Å; W109-V162 HydrophobicContact CZ3-CG2 3.93Å; V113-V162 HydrophobicContact CG2-CB 4.5Å; V113-V162 HydrophobicContact CG2-CG1 3.94Å; V113-V162 HydrophobicContact CG2-CG2 4.38Å; I137-V162 HydrophobicContact CG2-CG1 4.29Å; I141-V162 HydrophobicContact CD1-CG1 4.32Å; I141-V162 HydrophobicContact CD1-CG2 3.92Å; W158-V162 HydrophobicContact CE3-CG2 4.07Å; W158-V162 HydrophobicContact CZ3-CG2 4.12Å; W158-V162 PolarHBondContact O-N 2.96Å; W158-V162 VanDerWaalsContact O-N 3.15Å; W159-V162 PolarHBondContact O-N 3.45Å; W159-V162 VanDerWaalsContact O-N 3.17Å; V162-G164 PolarHBondContact O-N 2.97Å; V162-C165 PolarHBondContact O-N 3.21Å; V162-C165 VanDerWaalsContact O-N 3.16Å; V162-L166 HydrophobicContact CG1-CD1 4.18Å; V162-L166 PolarHBondContact O-N 2.99Å
163	A	89.9	Confident	86.7	Confident	27 Å²	27	64.4 Å²	64.4	22%	0.223	38%	0.38	C	S	.	.	H	α-helix	trans	-56.8	-46.5	175.5	0	0	0	0	0	112.2	W133 W159 C165 L166 S167	W133-A163 HydrophobicContact CD2-CB 4.43Å; W133-A163 HydrophobicContact CE3-CB 3.99Å; W133-A163 HydrophobicContact CH2-CB 4.26Å; W133-A163 HydrophobicContact CZ3-CB 3.91Å; W159-A163 PolarHBondContact O-N 3.15Å; A163-C165 VanDerWaalsContact C-N 3.34Å; A163-C165 PolarHBondContact O-N 2.94Å; A163-L166 PolarHBondContact O-N 3.02Å; A163-S167 PolarHBondContact O-N 3.31Å; A163-S167 PolarHBondContact O-OG 3.1Å
164	G	89.7	Confident	87.1	Confident	33 Å²	33	55.2 Å²	55.2	34%	0.34	34%	0.341	S	S	.	.	H	α-helix	trans	-61.8	-36.9	176.2	0	0	0	0	0	113.8	S160 T161 V162 V168	S160-G164 PolarHBondContact O-N 3.17Å; S160-G164 VanDerWaalsContact O-N 3.07Å; T161-G164 PolarHBondContact O-N 3.36Å; V162-G164 PolarHBondContact O-N 2.97Å; G164-V168 WeakPolarHBondContact O-CB 3.32Å; G164-V168 VanDerWaalsContact O-CG2 3.29Å; G164-V168 WeakPolarHBondContact O-CG2 3.41Å; G164-V168 PolarHBondContact O-N 3.31Å
165	C	91.9	Very high	87.4	Confident	29 Å²	29	56.1 Å²	56.1	20%	0.196	34%	0.341	C	S	.	.	H	α-helix	trans	-68.9	-36.2	174.8	-76.5	0	0	0	0	113.1	W109 V113 T161 V162 A163 G169 F174	W109-C165 WeakPolarHBondContact CB-SG 3.27Å; V113-C165 HydrophobicContact CG2-CB 4.49Å; T161-C165 WeakPolarHBondContact O-CB 3.16Å; T161-C165 PolarHBondContact O-N 3.41Å; T161-C165 PolarHBondContact O-SG 3.18Å; T161-C165 VanDerWaalsContact O-SG 3.41Å; V162-C165 PolarHBondContact O-N 3.21Å; V162-C165 VanDerWaalsContact O-N 3.16Å; A163-C165 VanDerWaalsContact C-N 3.34Å; A163-C165 PolarHBondContact O-N 2.94Å; C165-G169 PolarHBondContact O-N 2.85Å; C165-F174 WeakPolarHBondContact O-CE2 3.34Å
166	L	91.2	Very high	87.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-63.7	-47.6	174.1	-72.1	165.7	0	0	0	111.2	V113 M117 W133 I137 V162 A163 S170 F174 W187	V113-L166 HydrophobicContact CG1-CD2 3.63Å; V113-L166 HydrophobicContact CG1-CG 4.12Å; M117-L166 HydrophobicContact SD-CD2 3.73Å; W133-L166 HydrophobicContact CB-CD1 3.5Å; I137-L166 HydrophobicContact CD1-CD1 4.22Å; I137-L166 HydrophobicContact CD1-CD2 4.32Å; V162-L166 HydrophobicContact CG1-CD1 4.18Å; V162-L166 PolarHBondContact O-N 2.99Å; A163-L166 PolarHBondContact O-N 3.02Å; L166-S170 PolarHBondContact O-N 2.72Å; L166-F174 HydrophobicContact CD2-CB 4.26Å; L166-F174 HydrophobicContact CD2-CD1 3.98Å; L166-F174 HydrophobicContact CD2-CD2 4.09Å; L166-F174 HydrophobicContact CD2-CE1 4.35Å; L166-F174 HydrophobicContact CD2-CE2 4.44Å; L166-F174 HydrophobicContact CD2-CG 3.84Å; L166-W187 HydrophobicContact CB-CD2 3.93Å; L166-W187 HydrophobicContact CB-CE3 4.04Å; L166-W187 HydrophobicContact CB-CH2 4.18Å; L166-W187 HydrophobicContact CB-CZ2 4.06Å; L166-W187 HydrophobicContact CB-CZ3 4.16Å; L166-W187 HydrophobicContact CD1-CD2 4.3Å; L166-W187 HydrophobicContact CD1-CG 4.08Å; L166-W187 HydrophobicContact CD2-CB 4.2Å; L166-W187 HydrophobicContact CD2-CD2 4.19Å; L166-W187 HydrophobicContact CD2-CE3 4.35Å; L166-W187 HydrophobicContact CD2-CG 4.13Å; L166-W187 HydrophobicContact CG-CD2 4.37Å; L166-W187 HydrophobicContact CG-CG 4.49Å; L166-W187 WeakPolarHBondContact O-CZ3 3.34Å
167	S	90	Very high	88.3	Confident	74 Å²	74	48.8 Å²	48.8	52%	0.517	29%	0.293	S	S	.	.	H	α-helix	trans	-63.2	-46.1	177.1	-55.7	0	0	0	0	113.1	A163 S170	A163-S167 PolarHBondContact O-N 3.31Å; A163-S167 PolarHBondContact O-OG 3.1Å; S167-S170 PolarHBondContact O-N 3Å
168	V	88.5	Confident	88.4	Confident	94 Å²	94	46.7 Å²	46.7	57%	0.57	28%	0.283	S	S	*	.	H	α-helix	trans	-73.8	-26.7	-178.3	173.3	0	0	0	0	112.5	G164 S170 T220	G164-V168 WeakPolarHBondContact O-CB 3.32Å; G164-V168 VanDerWaalsContact O-CG2 3.29Å; G164-V168 WeakPolarHBondContact O-CG2 3.41Å; G164-V168 PolarHBondContact O-N 3.31Å; V168-S170 VanDerWaalsContact C-N 3.29Å; V168-T220 HydrophobicContact CG1-CG2 4.33Å; V168-T220 HydrophobicContact CG2-CG2 4.29Å
169	G	82.3	Confident	88	Confident	8 Å²	8	55 Å²	55	8%	0.082	32%	0.323	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	3.6	174.9	0	0	0	0	0	114.6	C165 A172 F173 F174	C165-G169 PolarHBondContact O-N 2.85Å; G169-A172 PolarHBondContact O-N 2.95Å; G169-F173 PolarHBondContact O-N 3.31Å; G169-F174 PolarHBondContact O-N 3.2Å; G169-F174 VanDerWaalsContact O-N 3.15Å
170	S	83.8	Confident	87.7	Confident	34 Å²	34	55 Å²	55	24%	0.238	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.7	138.3	178.4	-177.6	0	0	0	0	111.2	L166 S167 V168 F174	L166-S170 PolarHBondContact O-N 2.72Å; S167-S170 PolarHBondContact O-N 3Å; V168-S170 VanDerWaalsContact C-N 3.29Å; S170-F174 WeakPolarHBondContact CA-O 3.48Å; S170-F174 WeakPolarHBondContact CB-O 3.47Å; S170-F174 PolarHBondContact OG-O 3.24Å
171	P	81.4	Confident	87.5	Confident	94 Å²	94	53.7 Å²	53.7	61%	0.61	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	cis	-91.3	13.4	-1.3	37.9	-36.5	0	0	0	113.8	F174 V190	P171-F174 WeakPolarHBondContact CA-O 3.31Å; P171-V190 WeakPolarHBondContact O-CG2 3.2Å
172	A	83.4	Confident	86.9	Confident	53 Å²	53	54.7 Å²	54.7	44%	0.438	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.3	-34.1	-170.2	0	0	0	0	0	114.8	G169 I218	G169-A172 PolarHBondContact O-N 2.95Å; A172-I218 HydrophobicContact CB-CD1 3.99Å
173	F	84.7	Confident	86.4	Confident	84 Å²	84	59 Å²	59	37%	0.368	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-128.4	-34.1	-178.5	-58.7	-84	0	0	0	112	Q110 M114 G169 V190	Q110-F173 VanDerWaalsContact NE2-CD2 3.28Å; M114-F173 HydrophobicContact CE-CD1 3.73Å; M114-F173 HydrophobicContact CE-CE1 4.36Å; M114-F173 HydrophobicContact SD-CB 4.42Å; M114-F173 HydrophobicContact SD-CD1 3.8Å; M114-F173 HydrophobicContact SD-CE1 4.41Å; M114-F173 HydrophobicContact SD-CG 4.25Å; G169-F173 PolarHBondContact O-N 3.31Å; F173-V190 PolarHBondContact O-N 3.29Å
174	F	91.6	Very high	86.2	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	140.7	-177.5	-46	-61.2	0	0	0	110.9	V113 M114 M117 C165 L166 G169 S170 P171 W187 K188 L189 V190	V113-F174 HydrophobicContact CB-CZ 4.08Å; V113-F174 HydrophobicContact CG1-CE1 3.74Å; V113-F174 HydrophobicContact CG1-CE2 4.37Å; V113-F174 HydrophobicContact CG1-CZ 3.63Å; M114-F174 HydrophobicContact CG-CE1 3.71Å; M114-F174 HydrophobicContact CG-CZ 3.73Å; M117-F174 HydrophobicContact CE-CD1 4.31Å; M117-F174 HydrophobicContact SD-CD1 3.55Å; M117-F174 VanDerWaalsContact SD-CD1 3.55Å; M117-F174 HydrophobicContact SD-CE1 3.72Å; C165-F174 WeakPolarHBondContact O-CE2 3.34Å; L166-F174 HydrophobicContact CD2-CB 4.26Å; L166-F174 HydrophobicContact CD2-CD1 3.98Å; L166-F174 HydrophobicContact CD2-CD2 4.09Å; L166-F174 HydrophobicContact CD2-CE1 4.35Å; L166-F174 HydrophobicContact CD2-CE2 4.44Å; L166-F174 HydrophobicContact CD2-CG 3.84Å; G169-F174 PolarHBondContact O-N 3.2Å; G169-F174 VanDerWaalsContact O-N 3.15Å; S170-F174 WeakPolarHBondContact CA-O 3.48Å; S170-F174 WeakPolarHBondContact CB-O 3.47Å; S170-F174 PolarHBondContact OG-O 3.24Å; P171-F174 WeakPolarHBondContact CA-O 3.31Å; F174-W187 HydrophobicContact CB-CE3 4.08Å; F174-W187 HydrophobicContact CB-CZ3 4.48Å; F174-K188 CarbonylContact C-O 3.57Å; F174-K188 WeakPolarHBondContact CA-O 3.29Å; F174-L189 HydrophobicContact CD1-CD2 4.02Å; F174-L189 HydrophobicContact CE1-CD2 3.95Å; F174-V190 VanDerWaalsContact C-CG2 3.45Å
175	R	90.3	Very high	86.2	Confident	130 Å²	130	62.5 Å²	62.5	49%	0.491	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	135.8	170.6	-174.5	176.6	-68.3	-177.1	2.5	108.6	Y130 W187 K188 V190	Y130-R175 HydrophobicContact CE1-CG 4.47Å; Y130-R175 WeakPolarHBondContact OH-CD 3.42Å; R175-W187 VanDerWaalsContact O-CA 3.3Å; R175-W187 WeakPolarHBondContact O-CA 3.49Å; R175-K188 PolarHBondContact N-O 3.15Å; R175-K188 PolarHBondContact O-N 2.86Å; R175-V190 HydrophobicContact CB-CG2 3.96Å
176	S	91.4	Very high	86.1	Confident	41 Å²	41	61.8 Å²	61.8	29%	0.287	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	129	171.8	-169.8	0	0	0	0	110.3	A178 W186	S176-A178 PolarHBondContact O-N 3.48Å; S176-W186 WeakPolarHBondContact CA-O 3.31Å
177	G	86.9	Confident	86.2	Confident	0 Å²	0	63.1 Å²	63.1	0%	0	37%	0.366	C	S	.	.			trans	-84.6	10.4	174.8	0	0	0	0	0	113.6	Q179 E180 F181 W186	G177-Q179 PolarHBondContact O-N 3.18Å; G177-E180 PolarHBondContact O-N 2.95Å; G177-F181 WeakPolarHBondContact O-CD2 3.28Å; G177-F181 PolarHBondContact O-N 3.38Å; G177-W186 PolarHBondContact N-O 2.96Å
178	A	87.8	Confident	86.3	Confident	36 Å²	36	63.4 Å²	63.4	30%	0.298	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.4	-28.6	-174.9	0	0	0	0	0	113.7	S176 G182 E183	S176-A178 PolarHBondContact O-N 3.48Å; A178-G182 CarbonylContact O-C 3.59Å; A178-G182 WeakPolarHBondContact O-CA 3.29Å; A178-G182 PolarHBondContact O-N 3.26Å; A178-E183 WeakPolarHBondContact CA-O 3.3Å
179	Q	81.2	Confident	86.4	Confident	191 Å²	191	59.6 Å²	59.6	89%	0.893	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-25.4	173.9	-171.9	173.7	3.1	0	0	112.8	G177	G177-Q179 PolarHBondContact O-N 3.18Å
180	E	83	Confident	86.6	Confident	97 Å²	97	61.7 Å²	61.7	45%	0.453	35%	0.346	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-32.1	-177.9	-64.7	175.2	-163	0	0	112.1	Y130 G177	Y130-E180 WeakPolarHBondContact CE2-OE2 3.38Å; Y130-E180 PolarHBondContact OH-OE1 2.88Å; Y130-E180 PolarHBondContact OH-OE2 3.5Å; G177-E180 PolarHBondContact O-N 2.95Å
181	F	83.7	Confident	86.5	Confident	55 Å²	55	66.3 Å²	66.3	24%	0.241	36%	0.363	C	S	.	.	S	Bend	trans	-111.4	-1.2	-178.8	-58.9	-69.9	0	0	0	114.5	R127 Y130 G177 E183 W186	R127-F181 HydrophobicContact CB-CE1 4.33Å; R127-F181 HydrophobicContact CB-CZ 4.22Å; Y130-F181 HydrophobicContact CD1-CE2 4.32Å; Y130-F181 AromaticContact CD2-CE2 3.61Å; Y130-F181 HydrophobicContact CD2-CE2 3.61Å; Y130-F181 AromaticContact CD2-CZ 3.94Å; Y130-F181 HydrophobicContact CD2-CZ 3.94Å; Y130-F181 HydrophobicContact CE2-CE2 4.18Å; Y130-F181 AromaticContact CG-CE2 3.68Å; Y130-F181 HydrophobicContact CG-CE2 3.68Å; Y130-F181 HydrophobicContact CG-CZ 4.34Å; G177-F181 WeakPolarHBondContact O-CD2 3.28Å; G177-F181 PolarHBondContact O-N 3.38Å; F181-E183 PolarHBondContact O-N 3.34Å; F181-W186 HydrophobicContact CB-CG 4.49Å; F181-W186 HydrophobicContact CD2-CB 3.81Å; F181-W186 AromaticContact CD2-CD1 3.96Å; F181-W186 HydrophobicContact CD2-CD2 4.27Å; F181-W186 AromaticContact CD2-CG 3.73Å; F181-W186 HydrophobicContact CD2-CG 3.73Å; F181-W186 HydrophobicContact CE2-CB 4.26Å; F181-W186 HydrophobicContact CE2-CG 4.37Å; F181-W186 HydrophobicContact CG-CG 4.31Å
182	G	78.4	Confident	86.4	Confident	68 Å²	68	65.6 Å²	65.6	70%	0.701	35%	0.354	S	S	*	.	S	Bend	trans	67.4	-17	-173	0	0	0	0	0	115.5	A178	A178-G182 CarbonylContact O-C 3.59Å; A178-G182 WeakPolarHBondContact O-CA 3.29Å; A178-G182 PolarHBondContact O-N 3.26Å
183	E	84.2	Confident	86.1	Confident	92 Å²	92	69.3 Å²	69.3	43%	0.43	36%	0.357	S	S	.	.	S	Bend	trans	-97.9	131.4	-179.8	-65.8	-173.1	146.8	0	0	112.9	A178 F181 G185 W186	A178-E183 WeakPolarHBondContact CA-O 3.3Å; F181-E183 PolarHBondContact O-N 3.34Å; E183-G185 PolarHBondContact O-N 2.96Å; E183-W186 PolarHBondContact OE2-NE1 3.03Å
184	P	85.1	Confident	85.6	Confident	119 Å²	119	67 Å²	67	77%	0.773	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	125	173.3	30.1	-33.7	0	0	0	111.6
185	G	88.4	Confident	84.9	Confident	13 Å²	13	67.6 Å²	67.6	13%	0.134	35%	0.354	C	S	.	.	T	Hydrogen-bonded Turn	trans	135.3	-4.6	169.5	0	0	0	0	0	116.3	R132 W133 E183	R132-G185 WeakPolarHBondContact CA-O 3.48Å; W133-G185 PolarHBondContact N-O 3.05Å; E183-G185 PolarHBondContact O-N 2.96Å
186	W	91.6	Very high	84.1	Confident	14 Å²	14	66 Å²	66	5%	0.053	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.5	132.8	171.7	-63.8	98.4	0	0	0	111.1	R127 Y130 R132 S176 G177 F181 E183	R127-W186 HydrophobicContact CB-CZ3 4.11Å; R127-W186 VanDerWaalsContact CD-CH2 3.5Å; R127-W186 HydrophobicContact CG-CH2 3.98Å; R127-W186 HydrophobicContact CG-CZ3 3.99Å; Y130-W186 HydrophobicContact CD1-CB 4.36Å; R132-W186 HydrophobicContact CG-CD2 3.99Å; R132-W186 HydrophobicContact CG-CE3 3.79Å; R132-W186 HydrophobicContact CG-CH2 3.55Å; R132-W186 HydrophobicContact CG-CZ2 3.76Å; R132-W186 HydrophobicContact CG-CZ3 3.57Å; S176-W186 WeakPolarHBondContact CA-O 3.31Å; G177-W186 PolarHBondContact N-O 2.96Å; F181-W186 HydrophobicContact CB-CG 4.49Å; F181-W186 HydrophobicContact CD2-CB 3.81Å; F181-W186 AromaticContact CD2-CD1 3.96Å; F181-W186 HydrophobicContact CD2-CD2 4.27Å; F181-W186 AromaticContact CD2-CG 3.73Å; F181-W186 HydrophobicContact CD2-CG 3.73Å; F181-W186 HydrophobicContact CE2-CB 4.26Å; F181-W186 HydrophobicContact CE2-CG 4.37Å; F181-W186 HydrophobicContact CG-CG 4.31Å; E183-W186 PolarHBondContact OE2-NE1 3.03Å
187	W	93.2	Very high	83.2	Confident	28 Å²	28	65.5 Å²	65.5	11%	0.106	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	143.6	-179.7	-61.8	86.5	0	0	0	113	M117 Y130 F131 I137 L166 F174 R175	M117-W187 HydrophobicContact CE-CB 3.9Å; M117-W187 WeakPolarHBondContact CE-O 3.19Å; Y130-W187 WeakPolarHBondContact CA-O 3.4Å; Y130-W187 VanDerWaalsContact CD1-C 3.49Å; F131-W187 PolarHBondContact N-O 2.67Å; F131-W187 PolarHBondContact O-N 3.28Å; I137-W187 HydrophobicContact CD1-CB 4.2Å; L166-W187 HydrophobicContact CB-CD2 3.93Å; L166-W187 HydrophobicContact CB-CE3 4.04Å; L166-W187 HydrophobicContact CB-CH2 4.18Å; L166-W187 HydrophobicContact CB-CZ2 4.06Å; L166-W187 HydrophobicContact CB-CZ3 4.16Å; L166-W187 HydrophobicContact CD1-CD2 4.3Å; L166-W187 HydrophobicContact CD1-CG 4.08Å; L166-W187 HydrophobicContact CD2-CB 4.2Å; L166-W187 HydrophobicContact CD2-CD2 4.19Å; L166-W187 HydrophobicContact CD2-CE3 4.35Å; L166-W187 HydrophobicContact CD2-CG 4.13Å; L166-W187 HydrophobicContact CG-CD2 4.37Å; L166-W187 HydrophobicContact CG-CG 4.49Å; L166-W187 WeakPolarHBondContact O-CZ3 3.34Å; F174-W187 HydrophobicContact CB-CE3 4.08Å; F174-W187 HydrophobicContact CB-CZ3 4.48Å; R175-W187 VanDerWaalsContact O-CA 3.3Å; R175-W187 WeakPolarHBondContact O-CA 3.49Å
188	K	92.1	Very high	82.2	Confident	80 Å²	80	75.9 Å²	75.9	35%	0.348	39%	0.392	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	152.6	179.1	179.1	166.1	-177.2	178.1	0	111.1	M117 Q128 G129 Y130 F174 R175	M117-K188 VanDerWaalsContact CE-C 3.41Å; Q128-K188 PolarHBondContact O-NZ 3.46Å; G129-K188 WeakPolarHBondContact O-CB 3.48Å; G129-K188 WeakPolarHBondContact O-CD 3.41Å; G129-K188 VanDerWaalsContact O-CG 3.24Å; G129-K188 WeakPolarHBondContact O-CG 3.48Å; Y130-K188 HydrophobicContact CD1-CB 3.41Å; Y130-K188 VanDerWaalsContact CD1-CB 3.41Å; Y130-K188 HydrophobicContact CD2-CB 4.19Å; Y130-K188 HydrophobicContact CD2-CD 3.84Å; Y130-K188 HydrophobicContact CE1-CB 3.4Å; Y130-K188 VanDerWaalsContact CE1-CB 3.4Å; Y130-K188 HydrophobicContact CE1-CD 4.37Å; Y130-K188 HydrophobicContact CE2-CB 4.22Å; Y130-K188 HydrophobicContact CE2-CD 3.67Å; Y130-K188 HydrophobicContact CG-CB 3.81Å; Y130-K188 HydrophobicContact CG-CD 4.29Å; F174-K188 CarbonylContact C-O 3.57Å; F174-K188 WeakPolarHBondContact CA-O 3.29Å; R175-K188 PolarHBondContact N-O 3.15Å; R175-K188 PolarHBondContact O-N 2.86Å
189	L	89.8	Confident	80.8	Confident	14 Å²	14	76.2 Å²	76.2	7%	0.073	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	131.9	170.2	-83	169.9	0	0	0	110.1	M114 M117 F174	M114-L189 HydrophobicContact CG-CD2 4.24Å; M117-L189 HydrophobicContact CB-CD1 3.78Å; M117-L189 HydrophobicContact CB-CD2 4.44Å; M117-L189 HydrophobicContact CB-CG 3.75Å; M117-L189 HydrophobicContact CE-CG 4.46Å; F174-L189 HydrophobicContact CD1-CD2 4.02Å; F174-L189 HydrophobicContact CE1-CD2 3.95Å
190	V	86.4	Confident	79.2	Confident	53 Å²	53	73.8 Å²	73.8	32%	0.321	38%	0.384	S	S	.	.	S	Bend	trans	-70.3	-34.3	-177.5	174.2	0	0	0	0	111.9	P171 F173 F174 R175	P171-V190 WeakPolarHBondContact O-CG2 3.2Å; F173-V190 PolarHBondContact O-N 3.29Å; F174-V190 VanDerWaalsContact C-CG2 3.45Å; R175-V190 HydrophobicContact CB-CG2 3.96Å
191	Q	81.4	Confident	77.1	Confident	130 Å²	130	71.5 Å²	71.5	61%	0.607	39%	0.387	S	S	*	.	S	Bend	trans	-125.5	128.2	166.2	-61.2	-178.7	7.7	0	0	106.6	R193	Q191-R193 PolarHBondContact O-N 2.92Å
192	N	79.4	Confident	74.7	Confident	80 Å²	80	75.6 Å²	75.6	43%	0.428	41%	0.411	S	S	.	.			trans	-80.7	59	-180	-162.3	34.7	0	0	0	111.6	S121	S121-N192 VanDerWaalsContact OG-CG 3.26Å; S121-N192 PolarHBondContact OG-ND2 3.29Å; S121-N192 PolarHBondContact OG-OD1 3.47Å
193	R	76.9	Confident	72.5	Confident	131 Å²	131	80 Å²	80	49%	0.494	41%	0.411	S	S	.	.			trans	-122.7	139.4	179.6	-74.2	179.9	166.2	158.6	-3.7	109.8	W52 Q191	W52-R193 VanDerWaalsContact CZ2-NH2 3.34Å; Q191-R193 PolarHBondContact O-N 2.92Å
194	P	74.6	Confident	69.9	Low	35 Å²	35	81.2 Å²	81.2	23%	0.227	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-69.2	151.7	178.6	29.4	-34	0	0	0	111.4	G83 Y118 T196	G83-P194 VanDerWaalsContact CA-CB 3.46Å; Y118-P194 HydrophobicContact CD1-CB 3.9Å; Y118-P194 HydrophobicContact CE1-CB 3.9Å; Y118-P194 HydrophobicContact CE1-CG 4.16Å; Y118-P194 HydrophobicContact CG-CB 4.25Å; P194-T196 PolarHBondContact O-N 3.16Å
195	P	77.9	Confident	67.5	Low	12 Å²	12	80.8 Å²	80.8	8%	0.078	43%	0.43	C	S	.	.	P	Polyproline II helix	trans	-66.9	119.9	174.6	26.6	-30.9	0	0	0	109.9	F86 Q111 M114 L115	F86-P195 HydrophobicContact CE2-CB 4.21Å; F86-P195 HydrophobicContact CE2-CG 4Å; F86-P195 WeakPolarHBondContact CE2-O 3.48Å; F86-P195 HydrophobicContact CZ-CB 4.11Å; F86-P195 HydrophobicContact CZ-CG 4.41Å; F86-P195 WeakPolarHBondContact CZ-O 3.06Å; Q111-P195 HydrophobicContact CG-CB 4.4Å; M114-P195 HydrophobicContact CB-CB 4.28Å; M114-P195 HydrophobicContact CB-CG 3.83Å; M114-P195 HydrophobicContact CE-CB 3.94Å; M114-P195 HydrophobicContact SD-CB 4.14Å; L115-P195 HydrophobicContact CD2-CG 3.92Å; L115-P195 HydrophobicContact CG-CG 3.79Å
196	T	73.4	Confident	64.7	Low	96 Å²	96	86 Å²	86	59%	0.589	46%	0.459	S	S	*	.	P	Polyproline II helix	trans	-92.2	137	-176.2	46.6	0	0	0	0	113.3	P194	P194-T196 PolarHBondContact O-N 3.16Å
197	L	71.8	Confident	62.1	Low	31 Å²	31	95.7 Å²	95.7	16%	0.162	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-58.4	133.1	165.1	-173	73.6	0	0	0	110.5	N85 F86 L105	N85-L197 WeakPolarHBondContact OD1-CB 3.47Å; N85-L197 PolarHBondContact OD1-N 2.94Å; F86-L197 HydrophobicContact CD1-CD1 3.93Å; F86-L197 HydrophobicContact CE1-CB 4.34Å; F86-L197 HydrophobicContact CE1-CD1 4.18Å; L105-L197 HydrophobicContact CD1-CD1 3.65Å
198	R	65.9	Low	59.1	Low	218 Å²	218	100.5 Å²	100.5	82%	0.823	54%	0.535	S	S	*	.			trans	-115.4	111.6	166.2	-73.5	-173.6	172.7	-179	-2.4	108.9
199	P	58.1	Low	56.2	Low	43 Å²	43	106.2 Å²	106.2	28%	0.279	56%	0.559	S	S	.	*			trans	-64.1	141	178.5	-21.8	32.7	0	0	0	112.6	Y60 W67 G201	Y60-P199 HydrophobicContact CD1-CB 3.49Å; Y60-P199 VanDerWaalsContact CD1-CB 3.49Å; Y60-P199 HydrophobicContact CD1-CG 3.49Å; Y60-P199 VanDerWaalsContact CD1-CG 3.49Å; Y60-P199 HydrophobicContact CD2-CB 4.22Å; Y60-P199 HydrophobicContact CD2-CG 3.59Å; Y60-P199 HydrophobicContact CE1-CB 3.44Å; Y60-P199 VanDerWaalsContact CE1-CB 3.44Å; Y60-P199 HydrophobicContact CE1-CG 3.88Å; Y60-P199 HydrophobicContact CE2-CB 4.17Å; Y60-P199 HydrophobicContact CE2-CG 3.97Å; Y60-P199 HydrophobicContact CG-CB 3.85Å; Y60-P199 HydrophobicContact CG-CG 3.28Å; W67-P199 HydrophobicContact CH2-CG 3.91Å; W67-P199 HydrophobicContact CZ2-CG 3.7Å; P199-G201 PolarHBondContact O-N 3.37Å; P199-G201 VanDerWaalsContact O-N 3.09Å
200	D	48.5	Very low	53.3	Low	140 Å²	140	110 Å²	110	75%	0.749	59%	0.592	S	S	*	*			trans	-77.6	87.4	172.4	-112.8	-54.7	0	0	0	109.3	D202 K203	D200-D202 PolarHBondContact O-N 3.43Å; D200-K203 IonicContact OD1-NZ 2.7Å; D200-K203 PolarHBondContact OD1-NZ 2.92Å
201	G	39	Very low	50.7	Low	50 Å²	50	113 Å²	113	52%	0.515	61%	0.611	S	S	.	*			trans	-63.4	130	173	0	0	0	0	0	112.1	P199	P199-G201 PolarHBondContact O-N 3.37Å; P199-G201 VanDerWaalsContact O-N 3.09Å
202	D	31.9	Very low	48.2	Very low	140 Å²	140	118.1 Å²	118.1	75%	0.749	63%	0.625	S	S	*	*			trans	37.5	120.9	169.8	-88.6	-58.1	0	0	0	120.7	D200	D200-D202 PolarHBondContact O-N 3.43Å
203	K	32.4	Very low	45.7	Very low	161 Å²	161	120 Å²	120	70%	0.7	64%	0.641	S	S	*	*			trans	-139.1	53.9	162.9	-64.5	-171.7	-170.4	63.9	0	113	D200	D200-K203 IonicContact OD1-NZ 2.7Å; D200-K203 PolarHBondContact OD1-NZ 2.92Å
204	S	30.3	Very low	43.4	Very low	117 Å²	117	119.5 Å²	119.5	82%	0.818	66%	0.655	S	S	*	*			trans	-76	149	154.2	-167.7	0	0	0	0	110.1
205	S	34.8	Very low	41.4	Very low	111 Å²	111	126 Å²	126	78%	0.776	69%	0.687	S	S	*	*	S	Bend	trans	-109.6	97.8	-148.3	61.3	0	0	0	0	117
206	T	28.4	Very low	39	Very low	122 Å²	122	130.8 Å²	130.8	75%	0.748	71%	0.712	S	S	*	*			trans	-123.4	135.5	140.3	54.6	0	0	0	0	109.4	T208	T206-T208 VanDerWaalsContact C-N 3.28Å; T206-T208 PolarHBondContact O-N 2.97Å
207	K	38.6	Very low	37.2	Very low	218 Å²	218	130.4 Å²	130.4	95%	0.948	71%	0.711	S	S	*	*			trans	-85	63.1	-169.6	-76.7	-176.7	177.5	171.2	0	112.9
208	T	29.6	Very low	35.2	Very low	129 Å²	129	133.3 Å²	133.3	79%	0.791	73%	0.726	S	S	*	*			trans	-102.1	125.5	173.9	-44.5	0	0	0	0	108.9	T206	T206-T208 VanDerWaalsContact C-N 3.28Å; T206-T208 PolarHBondContact O-N 2.97Å
209	K	32	Very low	33.6	Very low	200 Å²	200	129.3 Å²	129.3	87%	0.87	72%	0.719	S	S	*	*			trans	-119.3	95.4	-163.6	-162.4	-175.5	-176.8	-168.8	0	113.3
210	A	27.6	Very low	32.2	Very low	93 Å²	93	131.8 Å²	131.8	77%	0.769	73%	0.734	S	S	*	*			trans	-109.6	126.8	157.7	0	0	0	0	0	107.6
211	T	31.4	Very low	31.3	Very low	117 Å²	117	131.7 Å²	131.7	72%	0.718	74%	0.738	S	S	*	*			cis	84.4	89.5	48.6	-55.5	0	0	0	0	112.2
212	R	29.4	Very low	31.1	Very low	237 Å²	237	138.6 Å²	138.6	89%	0.894	76%	0.757	S	S	*	*			trans	-109.9	153.7	152.5	-87.4	-175.3	171.9	-179.7	-2.5	107.9
213	P	26.9	Very low	31.6	Very low	119 Å²	119	135.6 Å²	135.6	77%	0.773	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-71.1	151.6	-165	28	-36.1	0	0	0	113.6
214	P	29.3	Very low	31.4	Very low	121 Å²	121	136 Å²	136	79%	0.786	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-77.2	139.9	172.4	32.6	-33.2	0	0	0	111.3
215	L	31.5	Very low	31.6	Very low	170 Å²	170	141.6 Å²	141.6	89%	0.89	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-101.5	150.8	156.7	-70.2	170.8	0	0	0	108.2
216	D	28.4	Very low	31.5	Very low	114 Å²	114	145.8 Å²	145.8	61%	0.61	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-73.5	143.9	-166.8	-74.9	-68.2	0	0	0	114.5	I218 R536	D216-I218 PolarHBondContact O-N 2.76Å; D216-R536 IonicContact OD1-NH2 2.65Å; D216-R536 PolarHBondContact OD1-NH2 3.03Å
217	P	35.2	Very low	31.9	Very low	87 Å²	87	151.9 Å²	151.9	57%	0.565	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-79.1	121.2	178.5	31.4	-32.4	0	0	0	111	I219	P217-I219 PolarHBondContact O-N 2.97Å
218	I	29.6	Very low	31.8	Very low	92 Å²	92	144.2 Å²	144.2	47%	0.472	77%	0.767	S	S	.	*	P	Polyproline II helix	trans	-59.3	132.5	167.9	-66.2	170.1	0	0	0	109.4	A172 D216 T220	A172-I218 HydrophobicContact CB-CD1 3.99Å; D216-I218 PolarHBondContact O-N 2.76Å; I218-T220 PolarHBondContact O-N 3.08Å
219	I	31.9	Very low	32.4	Very low	134 Å²	134	143.5 Å²	143.5	69%	0.687	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-64.2	130	-179.2	-60.9	171.4	0	0	0	109.4	P217	P217-I219 PolarHBondContact O-N 2.97Å
220	T	30.5	Very low	33.2	Very low	95 Å²	95	141.7 Å²	141.7	58%	0.583	76%	0.762	S	S	*	*			trans	-123.4	126.3	169.7	42	0	0	0	0	109.5	V168 I218	V168-T220 HydrophobicContact CG1-CG2 4.33Å; V168-T220 HydrophobicContact CG2-CG2 4.29Å; I218-T220 PolarHBondContact O-N 3.08Å
221	V	29.1	Very low	34.8	Very low	139 Å²	139	142 Å²	142	84%	0.842	75%	0.751	S	S	*	*			trans	-61.3	142.1	-174.3	-179.6	0	0	0	0	111.1	G223	V221-G223 PolarHBondContact O-N 3.21Å
222	E	34.3	Very low	35.9	Very low	195 Å²	195	141.3 Å²	141.3	91%	0.911	75%	0.749	S	S	*	*	S	Bend	trans	-58.8	134.8	178.7	-70.8	-151.9	102.2	0	0	112.7
223	G	41.5	Very low	37.2	Very low	76 Å²	76	135 Å²	135	78%	0.784	74%	0.736	S	S	*	*			trans	159.9	-15.4	177.2	0	0	0	0	0	115.9	V221	V221-G223 PolarHBondContact O-N 3.21Å
224	L	29	Very low	38.6	Very low	170 Å²	170	132 Å²	132	89%	0.89	71%	0.711	S	S	*	*			trans	-93.7	126.8	-174.8	-149.8	69	0	0	0	113.9	K226	L224-K226 PolarHBondContact O-N 3.23Å
225	R	34.7	Very low	39.9	Very low	235 Å²	235	130 Å²	130	89%	0.887	70%	0.695	S	S	*	*			trans	-62.5	108.9	-167.7	-59.1	168.9	-177.9	146.4	-1.5	114	R227	R225-R227 PolarHBondContact O-N 3.07Å
226	K	33.7	Very low	41.2	Very low	199 Å²	199	124.9 Å²	124.9	87%	0.865	68%	0.676	S	S	*	*			trans	-74.6	113.8	160.4	-76.2	172	-179.2	161	0	109.8	L224 G228	L224-K226 PolarHBondContact O-N 3.23Å; K226-G228 VanDerWaalsContact C-N 3.32Å; K226-G228 PolarHBondContact O-N 3.05Å
227	R	35.4	Very low	43	Very low	250 Å²	250	125.4 Å²	125.4	94%	0.943	68%	0.677	S	S	*	*			trans	-78.4	76.7	174.4	-83.1	-174.3	-85.4	-177.1	-6.5	111.3	R225	R225-R227 PolarHBondContact O-N 3.07Å
228	G	37.3	Very low	44.5	Very low	57 Å²	57	125.3 Å²	125.3	59%	0.588	67%	0.669	S	S	*	*			trans	-75.3	148.2	153.9	0	0	0	0	0	109.9	K226 R230	K226-G228 VanDerWaalsContact C-N 3.32Å; K226-G228 PolarHBondContact O-N 3.05Å; G228-R230 PolarHBondContact O-N 2.99Å
229	A	42.3	Very low	46.2	Very low	114 Å²	114	125.6 Å²	125.6	94%	0.942	67%	0.671	S	S	*	*			trans	-67	117.9	174.9	0	0	0	0	0	109.8
230	R	47.8	Very low	48.2	Very low	162 Å²	162	127.3 Å²	127.3	61%	0.611	67%	0.673	S	S	*	*			trans	-127.2	154.2	174.4	-72.2	-162.4	-178	-164.7	4.2	110.6	G228 E234	G228-R230 PolarHBondContact O-N 2.99Å; R230-E234 WeakPolarHBondContact CD-OE1 3.24Å; R230-E234 IonicContact CZ-OE1 2.72Å; R230-E234 IonicContact NE-OE1 3.2Å; R230-E234 IonicContact NH1-OE1 3.92Å; R230-E234 PolarHBondContact NH1-OE1 3.42Å
231	N	60.8	Low	50.2	Low	98 Å²	98	127 Å²	127	52%	0.524	67%	0.665	S	S	.	*			trans	-59.6	133.1	-175.1	-172.8	-20.9	0	0	0	111.1	V233 E234 N235	N231-V233 PolarHBondContact O-N 3Å; N231-V233 PolarHBondContact OD1-N 3.06Å; N231-E234 HydrophobicContact CB-CB 4.38Å; N231-E234 WeakPolarHBondContact O-CB 3.26Å; N231-E234 PolarHBondContact O-N 3.27Å; N231-E234 VanDerWaalsContact O-N 3.15Å; N231-N235 PolarHBondContact O-N 2.92Å; N231-N235 PolarHBondContact O-ND2 3.39Å
232	P	55.8	Low	52.4	Low	104 Å²	104	127.6 Å²	127.6	68%	0.675	66%	0.657	S	S	*	*	H	α-helix	trans	-53.1	-35.1	177.8	-30.4	36.8	0	0	0	114.5	N235 A236	P232-N235 PolarHBondContact O-N 2.91Å; P232-A236 PolarHBondContact O-N 3.23Å
233	V	56	Low	54.2	Low	103 Å²	103	126.4 Å²	126.4	62%	0.624	64%	0.644	S	S	*	*	H	α-helix	trans	-64.7	-41.8	179.7	-176.4	0	0	0	0	111.7	N231 N235 A236 M237	N231-V233 PolarHBondContact O-N 3Å; N231-V233 PolarHBondContact OD1-N 3.06Å; V233-N235 VanDerWaalsContact C-N 3.35Å; V233-N235 PolarHBondContact O-N 3.41Å; V233-A236 PolarHBondContact O-N 3.16Å; V233-M237 WeakPolarHBondContact O-CB 3.3Å; V233-M237 PolarHBondContact O-N 3.41Å
234	E	57.3	Low	55.7	Low	56 Å²	56	126.3 Å²	126.3	26%	0.262	63%	0.631	S	S	.	*	H	α-helix	trans	-63.6	-41.7	178.7	-164.9	-157.1	140.6	0	0	111.3	R230 N231 M237 Q238	R230-E234 WeakPolarHBondContact CD-OE1 3.24Å; R230-E234 IonicContact CZ-OE1 2.72Å; R230-E234 IonicContact NE-OE1 3.2Å; R230-E234 IonicContact NH1-OE1 3.92Å; R230-E234 PolarHBondContact NH1-OE1 3.42Å; N231-E234 HydrophobicContact CB-CB 4.38Å; N231-E234 WeakPolarHBondContact O-CB 3.26Å; N231-E234 PolarHBondContact O-N 3.27Å; N231-E234 VanDerWaalsContact O-N 3.15Å; E234-M237 PolarHBondContact O-N 3.37Å; E234-Q238 WeakPolarHBondContact O-CG 3.42Å; E234-Q238 PolarHBondContact O-N 3.16Å; E234-Q238 PolarHBondContact OE1-NE2 2.85Å
235	N	56.3	Low	57.6	Low	81 Å²	81	125.8 Å²	125.8	43%	0.433	62%	0.617	S	S	.	*	H	α-helix	trans	-64.6	-41	175.4	-73.2	-89.6	0	0	0	111.8	N231 P232 V233 L239	N231-N235 PolarHBondContact O-N 2.92Å; N231-N235 PolarHBondContact O-ND2 3.39Å; P232-N235 PolarHBondContact O-N 2.91Å; V233-N235 VanDerWaalsContact C-N 3.35Å; V233-N235 PolarHBondContact O-N 3.41Å; N235-L239 VanDerWaalsContact O-CB 3.31Å; N235-L239 WeakPolarHBondContact O-CB 3.5Å; N235-L239 PolarHBondContact O-N 2.73Å
236	A	58.1	Low	59.5	Low	61 Å²	61	118.2 Å²	118.2	50%	0.504	60%	0.597	S	S	.	*	H	α-helix	trans	-64.9	-40.1	176.6	0	0	0	0	0	111.9	P232 V233 L239 K240	P232-A236 PolarHBondContact O-N 3.23Å; V233-A236 PolarHBondContact O-N 3.16Å; A236-L239 PolarHBondContact O-N 2.93Å; A236-K240 PolarHBondContact O-N 3.36Å
237	M	66.5	Low	61.4	Low	126 Å²	126	113 Å²	113	62%	0.621	58%	0.576	S	S	*	*	H	α-helix	trans	-65	-48.9	177.2	-168.2	163.2	67.4	0	0	111.7	V233 E234 L239 K240 E241	V233-M237 WeakPolarHBondContact O-CB 3.3Å; V233-M237 PolarHBondContact O-N 3.41Å; E234-M237 PolarHBondContact O-N 3.37Å; M237-L239 VanDerWaalsContact C-N 3.27Å; M237-L239 PolarHBondContact O-N 2.72Å; M237-K240 PolarHBondContact O-N 3.33Å; M237-E241 WeakPolarHBondContact O-CB 3.45Å; M237-E241 PolarHBondContact O-N 3.05Å
238	Q	67.4	Low	63	Low	84 Å²	84	106.5 Å²	106.5	39%	0.393	56%	0.556	S	S	.	*	H	α-helix	trans	-62.2	-32.3	174.3	-71.6	169.8	18.4	0	0	112.6	E234 K242	E234-Q238 WeakPolarHBondContact O-CG 3.42Å; E234-Q238 PolarHBondContact O-N 3.16Å; E234-Q238 PolarHBondContact OE1-NE2 2.85Å; Q238-K242 WeakPolarHBondContact O-CB 3.37Å; Q238-K242 PolarHBondContact O-N 2.84Å
239	L	63.9	Low	64.6	Low	99 Å²	99	106 Å²	106	52%	0.518	55%	0.546	S	S	.	.	H	α-helix	trans	-71.3	-38	175.1	-162.5	76.4	0	0	0	112.1	N235 A236 M237 R243	N235-L239 VanDerWaalsContact O-CB 3.31Å; N235-L239 WeakPolarHBondContact O-CB 3.5Å; N235-L239 PolarHBondContact O-N 2.73Å; A236-L239 PolarHBondContact O-N 2.93Å; M237-L239 VanDerWaalsContact C-N 3.27Å; M237-L239 PolarHBondContact O-N 2.72Å; L239-R243 WeakPolarHBondContact O-CB 3.22Å; L239-R243 VanDerWaalsContact O-CG 3.3Å; L239-R243 WeakPolarHBondContact O-CG 3.3Å; L239-R243 PolarHBondContact O-N 2.85Å; L239-R243 VanDerWaalsContact O-N 3.08Å
240	K	74.8	Confident	66.2	Low	169 Å²	169	106.7 Å²	106.7	74%	0.735	53%	0.528	S	S	*	.	H	α-helix	trans	-64.9	-48.5	173.6	-173.5	-177	179.1	-174	0	110.6	A236 M237 R243 S244	A236-K240 PolarHBondContact O-N 3.36Å; M237-K240 PolarHBondContact O-N 3.33Å; K240-R243 PolarHBondContact O-N 2.83Å; K240-S244 PolarHBondContact O-N 3.03Å
241	E	71.9	Confident	67.5	Low	88 Å²	88	102.3 Å²	102.3	41%	0.411	52%	0.517	S	S	.	.	H	α-helix	trans	-60.3	-47.9	177.5	-170.3	-166.4	168.6	0	0	111.8	M237 R243 S244 R245	M237-E241 WeakPolarHBondContact O-CB 3.45Å; M237-E241 PolarHBondContact O-N 3.05Å; E241-R243 VanDerWaalsContact C-N 3.29Å; E241-R243 PolarHBondContact O-N 3.15Å; E241-S244 WeakPolarHBondContact O-CA 3.48Å; E241-S244 VanDerWaalsContact O-CB 3.27Å; E241-S244 WeakPolarHBondContact O-CB 3.3Å; E241-S244 PolarHBondContact O-N 3.25Å; E241-R245 PolarHBondContact O-N 3.43Å; E241-R245 IonicContact OE1-CZ 3.32Å; E241-R245 VanDerWaalsContact OE1-CZ 3.24Å; E241-R245 IonicContact OE1-NE 3.63Å; E241-R245 PolarHBondContact OE1-NE 3.11Å; E241-R245 IonicContact OE1-NH2 3.51Å; E241-R245 PolarHBondContact OE1-NH2 3.15Å
242	K	75.8	Confident	68.3	Low	153 Å²	153	101.8 Å²	101.8	67%	0.665	51%	0.513	S	S	*	.	H	α-helix	trans	-63.7	-34.7	178.9	-171.5	158.6	-172	155	0	112.4	Q238 T246	Q238-K242 WeakPolarHBondContact O-CB 3.37Å; Q238-K242 PolarHBondContact O-N 2.84Å; K242-T246 WeakPolarHBondContact O-CG2 3.41Å; K242-T246 PolarHBondContact O-N 2.83Å; K242-T246 PolarHBondContact O-OG1 3.2Å; K242-T246 VanDerWaalsContact O-OG1 3.09Å
243	R	72.7	Confident	69.4	Low	170 Å²	170	105.7 Å²	105.7	64%	0.642	51%	0.514	S	S	*	.	H	α-helix	trans	-63.8	-45.5	170	-76	175.3	-177.7	-170.6	1.5	111.3	L239 K240 E241 T246 Q247	L239-R243 WeakPolarHBondContact O-CB 3.22Å; L239-R243 VanDerWaalsContact O-CG 3.3Å; L239-R243 WeakPolarHBondContact O-CG 3.3Å; L239-R243 PolarHBondContact O-N 2.85Å; L239-R243 VanDerWaalsContact O-N 3.08Å; K240-R243 PolarHBondContact O-N 2.83Å; E241-R243 VanDerWaalsContact C-N 3.29Å; E241-R243 PolarHBondContact O-N 3.15Å; R243-T246 WeakPolarHBondContact CA-OG1 3.48Å; R243-T246 CarbonylContact O-C 3.58Å; R243-T246 PolarHBondContact O-N 2.94Å; R243-T246 PolarHBondContact O-OG1 2.96Å; R243-Q247 PolarHBondContact O-N 2.88Å
244	S	71.6	Confident	70.4	Confident	74 Å²	74	107.8 Å²	107.8	52%	0.517	51%	0.511	S	S	.	.	H	α-helix	trans	-55.1	-55.4	177.2	-155.2	0	0	0	0	111.8	K240 E241 T246 Q247 E248	K240-S244 PolarHBondContact O-N 3.03Å; E241-S244 WeakPolarHBondContact O-CA 3.48Å; E241-S244 VanDerWaalsContact O-CB 3.27Å; E241-S244 WeakPolarHBondContact O-CB 3.3Å; E241-S244 PolarHBondContact O-N 3.25Å; S244-T246 VanDerWaalsContact C-N 3.25Å; S244-T246 PolarHBondContact O-N 2.86Å; S244-Q247 WeakPolarHBondContact O-CA 3.36Å; S244-Q247 WeakPolarHBondContact O-CB 3.24Å; S244-Q247 PolarHBondContact O-N 3.16Å; S244-E248 WeakPolarHBondContact O-CB 3.32Å; S244-E248 PolarHBondContact O-N 2.86Å
245	R	70.1	Confident	71.2	Confident	158 Å²	158	107.7 Å²	107.7	60%	0.596	52%	0.52	S	S	*	.	H	α-helix	trans	-58.5	-34.3	178.5	-63.6	-179.2	-175.3	-131.4	9.7	112.7	E241 A249	E241-R245 PolarHBondContact O-N 3.43Å; E241-R245 IonicContact OE1-CZ 3.32Å; E241-R245 VanDerWaalsContact OE1-CZ 3.24Å; E241-R245 IonicContact OE1-NE 3.63Å; E241-R245 PolarHBondContact OE1-NE 3.11Å; E241-R245 IonicContact OE1-NH2 3.51Å; E241-R245 PolarHBondContact OE1-NH2 3.15Å; R245-A249 VanDerWaalsContact O-CB 3.28Å; R245-A249 WeakPolarHBondContact O-CB 2.92Å; R245-A249 PolarHBondContact O-N 2.95Å; R245-A249 VanDerWaalsContact O-N 3.11Å
246	T	74.3	Confident	72	Confident	76 Å²	76	109.8 Å²	109.8	47%	0.466	53%	0.527	S	S	.	.	H	α-helix	trans	-79.6	-12.4	175.1	57.9	0	0	0	0	115.1	K242 R243 S244 K250	K242-T246 WeakPolarHBondContact O-CG2 3.41Å; K242-T246 PolarHBondContact O-N 2.83Å; K242-T246 PolarHBondContact O-OG1 3.2Å; K242-T246 VanDerWaalsContact O-OG1 3.09Å; R243-T246 WeakPolarHBondContact CA-OG1 3.48Å; R243-T246 CarbonylContact O-C 3.58Å; R243-T246 PolarHBondContact O-N 2.94Å; R243-T246 PolarHBondContact O-OG1 2.96Å; S244-T246 VanDerWaalsContact C-N 3.25Å; S244-T246 PolarHBondContact O-N 2.86Å; T246-K250 WeakPolarHBondContact O-CD 3.18Å; T246-K250 WeakPolarHBondContact O-CG 3.43Å
247	Q	72.5	Confident	72.7	Confident	91 Å²	91	114.9 Å²	114.9	43%	0.425	54%	0.538	S	S	.	.	H	α-helix	trans	-90.1	-50.3	174.1	-176.6	54.8	40.9	0	0	109.4	R243 S244 A249 K250 D251	R243-Q247 PolarHBondContact O-N 2.88Å; S244-Q247 WeakPolarHBondContact O-CA 3.36Å; S244-Q247 WeakPolarHBondContact O-CB 3.24Å; S244-Q247 PolarHBondContact O-N 3.16Å; Q247-A249 VanDerWaalsContact C-N 3.32Å; Q247-A249 PolarHBondContact O-N 3.34Å; Q247-K250 CarbonylContact O-C 3.46Å; Q247-K250 WeakPolarHBondContact O-CA 3.49Å; Q247-K250 WeakPolarHBondContact O-CB 3.41Å; Q247-K250 PolarHBondContact O-N 2.75Å; Q247-D251 WeakPolarHBondContact CG-OD2 3.36Å; Q247-D251 PolarHBondContact NE2-OD1 3.34Å; Q247-D251 PolarHBondContact NE2-OD2 2.9Å; Q247-D251 PolarHBondContact O-N 3.02Å
248	E	70.3	Confident	72.9	Confident	113 Å²	113	114.2 Å²	114.2	53%	0.528	53%	0.533	S	S	.	.	H	α-helix	trans	-46.7	-50.6	168.4	-179.1	178.8	-160.2	0	0	112.3	S244 K250 D251 I252	S244-E248 WeakPolarHBondContact O-CB 3.32Å; S244-E248 PolarHBondContact O-N 2.86Å; E248-K250 PolarHBondContact O-N 3.1Å; E248-K250 VanDerWaalsContact O-N 3.17Å; E248-D251 PolarHBondContact O-N 3.37Å; E248-D251 VanDerWaalsContact O-N 3.14Å; E248-I252 HydrophobicContact CG-CD1 4.04Å; E248-I252 WeakPolarHBondContact O-CB 3.37Å; E248-I252 VanDerWaalsContact O-CG1 3.3Å; E248-I252 WeakPolarHBondContact O-CG1 3.13Å; E248-I252 PolarHBondContact O-N 2.91Å
249	A	70.3	Confident	72.7	Confident	45 Å²	45	114.1 Å²	114.1	37%	0.372	55%	0.547	S	S	.	.	H	α-helix	trans	-66.7	-14.1	176.8	0	0	0	0	0	115.1	R245 Q247 R253	R245-A249 VanDerWaalsContact O-CB 3.28Å; R245-A249 WeakPolarHBondContact O-CB 2.92Å; R245-A249 PolarHBondContact O-N 2.95Å; R245-A249 VanDerWaalsContact O-N 3.11Å; Q247-A249 VanDerWaalsContact C-N 3.32Å; Q247-A249 PolarHBondContact O-N 3.34Å; A249-R253 VanDerWaalsContact O-CD 3.29Å; A249-R253 WeakPolarHBondContact O-CD 3.48Å; A249-R253 VanDerWaalsContact O-CG 3.3Å; A249-R253 WeakPolarHBondContact O-CG 3.44Å
250	K	75.6	Confident	72.5	Confident	130 Å²	130	113.8 Å²	113.8	57%	0.565	56%	0.559	S	S	*	*	H	α-helix	trans	-89.8	-39.3	169.4	-70.5	171.9	-179	179	0	111.5	T246 Q247 E248 R253 R254	T246-K250 WeakPolarHBondContact O-CD 3.18Å; T246-K250 WeakPolarHBondContact O-CG 3.43Å; Q247-K250 CarbonylContact O-C 3.46Å; Q247-K250 WeakPolarHBondContact O-CA 3.49Å; Q247-K250 WeakPolarHBondContact O-CB 3.41Å; Q247-K250 PolarHBondContact O-N 2.75Å; E248-K250 PolarHBondContact O-N 3.1Å; E248-K250 VanDerWaalsContact O-N 3.17Å; K250-R253 CarbonylContact O-C 3.07Å; K250-R253 PolarHBondContact O-N 2.7Å; K250-R254 WeakPolarHBondContact O-CB 3.13Å; K250-R254 PolarHBondContact O-N 2.91Å
251	D	74.8	Confident	71.4	Confident	70 Å²	70	108.8 Å²	108.8	37%	0.374	56%	0.555	S	S	.	*	H	α-helix	trans	-72.6	-32.7	-177.5	-62	-31.8	0	0	0	111.1	Q247 E248 R254 A255	Q247-D251 WeakPolarHBondContact CG-OD2 3.36Å; Q247-D251 PolarHBondContact NE2-OD1 3.34Å; Q247-D251 PolarHBondContact NE2-OD2 2.9Å; Q247-D251 PolarHBondContact O-N 3.02Å; E248-D251 PolarHBondContact O-N 3.37Å; E248-D251 VanDerWaalsContact O-N 3.14Å; D251-R254 WeakPolarHBondContact O-CB 3.33Å; D251-R254 PolarHBondContact O-N 2.98Å; D251-A255 WeakPolarHBondContact O-CB 3.5Å; D251-A255 PolarHBondContact O-N 3.17Å
252	I	78.3	Confident	69.9	Low	86 Å²	86	107.9 Å²	107.9	44%	0.441	57%	0.569	S	S	.	*	H	α-helix	trans	-59.8	-47.3	165.9	-68.4	165.3	0	0	0	111	E248 R254 A255 Q256	E248-I252 HydrophobicContact CG-CD1 4.04Å; E248-I252 WeakPolarHBondContact O-CB 3.37Å; E248-I252 VanDerWaalsContact O-CG1 3.3Å; E248-I252 WeakPolarHBondContact O-CG1 3.13Å; E248-I252 PolarHBondContact O-N 2.91Å; I252-R254 VanDerWaalsContact C-N 3.32Å; I252-R254 PolarHBondContact O-N 3.17Å; I252-A255 PolarHBondContact O-N 3.38Å; I252-Q256 HydrophobicContact CG2-CG 4.49Å; I252-Q256 WeakPolarHBondContact O-CB 3.45Å; I252-Q256 VanDerWaalsContact O-CG 3.27Å; I252-Q256 WeakPolarHBondContact O-CG 3.36Å; I252-Q256 PolarHBondContact O-N 3.15Å
253	R	79.3	Confident	67.8	Low	186 Å²	186	104.2 Å²	104.2	70%	0.702	57%	0.574	S	S	*	*	H	α-helix	trans	-67.4	-31.9	178.9	-72.2	175.3	180	-176.8	-1.8	112.8	A249 K250 K257	A249-R253 VanDerWaalsContact O-CD 3.29Å; A249-R253 WeakPolarHBondContact O-CD 3.48Å; A249-R253 VanDerWaalsContact O-CG 3.3Å; A249-R253 WeakPolarHBondContact O-CG 3.44Å; K250-R253 CarbonylContact O-C 3.07Å; K250-R253 PolarHBondContact O-N 2.7Å; R253-K257 WeakPolarHBondContact O-CB 2.93Å; R253-K257 PolarHBondContact O-N 3.08Å; R253-K257 VanDerWaalsContact O-N 3.1Å
254	R	77.1	Confident	66	Low	147 Å²	147	107.3 Å²	107.3	56%	0.555	59%	0.588	S	S	*	*	H	α-helix	trans	-63.1	-55.9	170.1	170.3	-174.5	-73	-77.3	4.8	110	K250 D251 I252 Q256 K257 E258	K250-R254 WeakPolarHBondContact O-CB 3.13Å; K250-R254 PolarHBondContact O-N 2.91Å; D251-R254 WeakPolarHBondContact O-CB 3.33Å; D251-R254 PolarHBondContact O-N 2.98Å; I252-R254 VanDerWaalsContact C-N 3.32Å; I252-R254 PolarHBondContact O-N 3.17Å; R254-Q256 VanDerWaalsContact C-N 3.29Å; R254-Q256 PolarHBondContact O-N 2.64Å; R254-K257 CarbonylContact O-C 3.6Å; R254-K257 PolarHBondContact O-N 3.01Å; R254-E258 WeakPolarHBondContact CD-OE1 3.48Å; R254-E258 HydrophobicContact CG-CG 4.35Å; R254-E258 WeakPolarHBondContact CG-OE1 3.49Å; R254-E258 WeakPolarHBondContact CG-OE2 3.27Å; R254-E258 IonicContact CZ-OE1 3.71Å; R254-E258 IonicContact NH1-OE1 2.87Å; R254-E258 PolarHBondContact NH1-OE1 3.46Å; R254-E258 WeakPolarHBondContact O-CG 3.4Å; R254-E258 PolarHBondContact O-N 3.33Å
255	A	72.6	Confident	64.3	Low	55 Å²	55	108.4 Å²	108.4	46%	0.455	60%	0.602	S	S	.	*	H	α-helix	trans	-59.1	-39.6	-179.5	0	0	0	0	0	112.2	D251 I252 E258 A259	D251-A255 WeakPolarHBondContact O-CB 3.5Å; D251-A255 PolarHBondContact O-N 3.17Å; I252-A255 PolarHBondContact O-N 3.38Å; A255-E258 PolarHBondContact O-N 2.79Å; A255-A259 VanDerWaalsContact O-CB 3.25Å; A255-A259 WeakPolarHBondContact O-CB 3.45Å; A255-A259 PolarHBondContact O-N 3.23Å
256	Q	73.9	Confident	62.4	Low	124 Å²	124	108.7 Å²	108.7	58%	0.579	62%	0.615	S	S	*	*	H	α-helix	trans	-62.7	-40.2	173.1	-74.6	171.1	-22.8	0	0	112.6	I252 R254 A260	I252-Q256 HydrophobicContact CG2-CG 4.49Å; I252-Q256 WeakPolarHBondContact O-CB 3.45Å; I252-Q256 VanDerWaalsContact O-CG 3.27Å; I252-Q256 WeakPolarHBondContact O-CG 3.36Å; I252-Q256 PolarHBondContact O-N 3.15Å; R254-Q256 VanDerWaalsContact C-N 3.29Å; R254-Q256 PolarHBondContact O-N 2.64Å; Q256-A260 VanDerWaalsContact O-CB 3.31Å; Q256-A260 WeakPolarHBondContact O-CB 3.43Å; Q256-A260 PolarHBondContact O-N 3.06Å
257	K	72.4	Confident	60.6	Low	169 Å²	169	116 Å²	116	74%	0.735	63%	0.634	S	S	*	*	H	α-helix	trans	-72	-35.8	176.7	-172.1	174.6	-179	-179.8	0	112.6	R253 R254 G261	R253-K257 WeakPolarHBondContact O-CB 2.93Å; R253-K257 PolarHBondContact O-N 3.08Å; R253-K257 VanDerWaalsContact O-N 3.1Å; R254-K257 CarbonylContact O-C 3.6Å; R254-K257 PolarHBondContact O-N 3.01Å; K257-G261 PolarHBondContact O-N 3.27Å
258	E	71.1	Confident	58.8	Low	111 Å²	111	117.6 Å²	117.6	52%	0.519	66%	0.655	S	S	.	*	H	α-helix	trans	-71.1	-39	176.8	-72.4	163.8	-175.2	0	0	110.6	R254 A255 G261	R254-E258 WeakPolarHBondContact CD-OE1 3.48Å; R254-E258 HydrophobicContact CG-CG 4.35Å; R254-E258 WeakPolarHBondContact CG-OE1 3.49Å; R254-E258 WeakPolarHBondContact CG-OE2 3.27Å; R254-E258 IonicContact CZ-OE1 3.71Å; R254-E258 IonicContact NH1-OE1 2.87Å; R254-E258 PolarHBondContact NH1-OE1 3.46Å; R254-E258 WeakPolarHBondContact O-CG 3.4Å; R254-E258 PolarHBondContact O-N 3.33Å; A255-E258 PolarHBondContact O-N 2.79Å; E258-G261 PolarHBondContact O-N 2.83Å
259	A	64	Low	57.1	Low	83 Å²	83	116.7 Å²	116.7	69%	0.686	67%	0.667	S	S	*	*	H	α-helix	trans	-65.3	-38.1	171.7	0	0	0	0	0	113.2	A255 G261	A255-A259 VanDerWaalsContact O-CB 3.25Å; A255-A259 WeakPolarHBondContact O-CB 3.45Å; A255-A259 PolarHBondContact O-N 3.23Å; A259-G261 VanDerWaalsContact C-N 3.26Å; A259-G261 PolarHBondContact O-N 3.47Å
260	A	59.3	Low	55.3	Low	92 Å²	92	120 Å²	120	76%	0.76	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-8.8	177.8	0	0	0	0	0	114.5	Q256	Q256-A260 VanDerWaalsContact O-CB 3.31Å; Q256-A260 WeakPolarHBondContact O-CB 3.43Å; Q256-A260 PolarHBondContact O-N 3.06Å
261	G	51	Low	53.2	Low	64 Å²	64	119 Å²	119	66%	0.66	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.4	1.7	-179.1	0	0	0	0	0	115.4	K257 E258 A259 G263	K257-G261 PolarHBondContact O-N 3.27Å; E258-G261 PolarHBondContact O-N 2.83Å; A259-G261 VanDerWaalsContact C-N 3.26Å; A259-G261 PolarHBondContact O-N 3.47Å; G261-G263 VanDerWaalsContact C-N 3.32Å; G261-G263 PolarHBondContact O-N 3.28Å
262	G	40.2	Very low	51.1	Low	69 Å²	69	122 Å²	122	71%	0.711	72%	0.718	S	S	*	*			trans	-83.2	42.1	-166.3	0	0	0	0	0	117
263	G	33.5	Very low	49.2	Very low	75 Å²	75	123.3 Å²	123.3	77%	0.773	73%	0.732	S	S	*	*			trans	-99.8	86.5	-176.4	0	0	0	0	0	115.1	G261	G261-G263 VanDerWaalsContact C-N 3.32Å; G261-G263 PolarHBondContact O-N 3.28Å
264	Y	35.1	Very low	46.7	Very low	235 Å²	235	120.5 Å²	120.5	92%	0.922	74%	0.735	S	S	*	*			trans	57.8	88.7	159.4	-129.2	-88.8	0	0	0	119.1
265	A	34.3	Very low	44.3	Very low	98 Å²	98	122 Å²	122	81%	0.81	75%	0.746	S	S	*	*			trans	-158.4	89.3	154.4	0	0	0	0	0	113.1
266	D	31.5	Very low	42	Very low	164 Å²	164	127 Å²	127	88%	0.877	76%	0.764	S	S	*	*			trans	55.4	159.1	154.7	-142.6	-1.1	0	0	0	122.5
267	R	36.1	Very low	39.6	Very low	228 Å²	228	124.4 Å²	124.4	86%	0.86	77%	0.77	S	S	*	*			trans	-130.6	129.3	174.6	-85.1	178.1	162.1	-178.1	-3.7	110
268	S	34.9	Very low	37.5	Very low	125 Å²	125	122.8 Å²	122.8	87%	0.874	78%	0.775	S	S	*	*			trans	-160.8	134.6	141.4	-93.7	0	0	0	0	115.9
269	A	33.8	Very low	35.3	Very low	94 Å²	94	122.5 Å²	122.5	78%	0.777	79%	0.785	S	S	*	*			trans	45.8	116.1	148.2	0	0	0	0	0	122.3
270	S	32.5	Very low	33.6	Very low	116 Å²	116	130 Å²	130	81%	0.811	80%	0.795	S	S	*	*				47.8	118.9	121.1	-152.2	0	0	0	0	118.8
271	S	30.8	Very low	32.1	Very low	108 Å²	108	130.1 Å²	130.1	76%	0.755	79%	0.79	S	S	*	*				-176.9	171.5	59.9	44	0	0	0	0	111.7
272	T	32.6	Very low	31	Very low	133 Å²	133	132.8 Å²	132.8	82%	0.816	80%	0.799	S	S	*	*			trans	-115.7	151.3	165.4	64.3	0	0	0	0	109.3
273	P	36.5	Very low	30.3	Very low	113 Å²	113	133.4 Å²	133.4	73%	0.734	80%	0.797	S	S	*	*				-151.9	146.8	95.1	38	-19.6	0	0	0	117.8
274	V	27.2	Very low	30.1	Very low	127 Å²	127	140 Å²	140	77%	0.77	80%	0.799	S	S	*	*				49.1	95.3	129.2	-170.5	0	0	0	0	120.6
275	K	27.1	Very low	29.7	Very low	179 Å²	179	138.7 Å²	138.7	78%	0.778	79%	0.792	S	S	*	*				72.8	145.9	115.5	-159.2	-172.2	178.1	-175.1	0	121.6
276	L	24.8	Very low	29.4	Very low	160 Å²	160	142.6 Å²	142.6	84%	0.838	79%	0.794	S	S	*	*			trans	76.2	134.5	161.4	-85.6	148.1	0	0	0	119.5
277	G	23.9	Very low	29.2	Very low	69 Å²	69	141.7 Å²	141.7	71%	0.711	79%	0.789	S	S	*	*			trans	149.5	84.6	150	0	0	0	0	0	119.8
278	V	27.1	Very low	28.9	Very low	136 Å²	136	138.3 Å²	138.3	82%	0.824	79%	0.787	S	S	*	*			trans	38.5	104.7	139.1	-171.8	0	0	0	0	120.8
279	S	25.1	Very low	28.5	Very low	104 Å²	104	137.9 Å²	137.9	73%	0.727	78%	0.779	S	S	*	*				37.7	147.9	123.3	-48	0	0	0	0	124.5
280	R	28.7	Very low	28.4	Very low	242 Å²	242	140.8 Å²	140.8	91%	0.913	78%	0.78	S	S	*	*			trans	76.3	150.8	157.3	-75.2	174.4	150.9	170.1	-9.2	116.5
281	S	27.6	Very low	28.4	Very low	94 Å²	94	141.7 Å²	141.7	66%	0.657	77%	0.772	S	S	*	*			cis	-170.3	160.1	-12.1	45.4	0	0	0	0	112.2
282	S	27.4	Very low	28.4	Very low	120 Å²	120	145.5 Å²	145.5	84%	0.839	77%	0.77	S	S	*	*			trans	67.6	167.4	161.8	-65.9	0	0	0	0	118.1
283	A	26.1	Very low	28.1	Very low	82 Å²	82	142.7 Å²	142.7	68%	0.678	77%	0.767	S	S	*	*				176.2	142.1	-53	0	0	0	0	0	111
284	R	28.5	Very low	27.8	Very low	214 Å²	214	145.5 Å²	145.5	81%	0.808	77%	0.77	S	S	*	*			trans	72.5	132.2	156	-75.2	179.4	168.5	-179.5	-3.5	121.2
285	R	28.2	Very low	27.9	Very low	206 Å²	206	145.8 Å²	145.8	78%	0.777	77%	0.772	S	S	*	*			trans	76.6	151.5	149	-72.4	174.3	172.9	175.7	-5.6	115.9
286	Q	26.3	Very low	28.1	Very low	180 Å²	180	144.1 Å²	144.1	84%	0.841	78%	0.777	S	S	*	*			cis	-146.4	156.5	24.1	-151.5	153.3	-15.6	0	0	113.9
287	D	27.3	Very low	28.3	Very low	145 Å²	145	142.8 Å²	142.8	78%	0.775	77%	0.77	S	S	*	*			trans	-87.7	162.2	177.5	-52.5	-87.1	0	0	0	113.8
288	L	29.5	Very low	28.5	Very low	158 Å²	158	147.8 Å²	147.8	83%	0.827	77%	0.773	S	S	*	*			trans	-171.5	126.9	140.9	-88.9	171.8	0	0	0	106.4
289	V	28.4	Very low	28.6	Very low	115 Å²	115	146.2 Å²	146.2	70%	0.697	77%	0.768	S	S	*	*				76.9	122.4	59.5	165.8	0	0	0	0	111.5
290	L	31.7	Very low	29.2	Very low	155 Å²	155	145.9 Å²	145.9	81%	0.812	77%	0.765	S	S	*	*			cis	-154.6	-165.7	-0.2	-106.2	173.9	0	0	0	107.8
291	E	32.4	Very low	29.2	Very low	135 Å²	135	142.5 Å²	142.5	63%	0.631	76%	0.764	S	S	*	*			cis	-152.6	-118.2	13.3	-152.2	-161.9	43.7	0	0	115.6
292	R	29.6	Very low	29.3	Very low	189 Å²	189	143.5 Å²	143.5	71%	0.713	77%	0.771	S	S	*	*			trans	-72.6	164.9	-175.2	-69.4	167.1	168.4	107	-4.2	114.7
293	G	26.8	Very low	29.7	Very low	73 Å²	73	142.8 Å²	142.8	75%	0.753	77%	0.766	S	S	*	*			cis	161.5	177.4	7.2	0	0	0	0	0	110.2
294	E	29.2	Very low	30.1	Very low	172 Å²	172	144.3 Å²	144.3	80%	0.804	77%	0.772	S	S	*	*			cis	-144.1	-115.9	-4.8	-60.6	-163.7	163.6	0	0	112.4
295	V	30.8	Very low	30.2	Very low	134 Å²	134	140.3 Å²	140.3	81%	0.812	77%	0.767	S	S	*	*			trans	-104.2	171.4	-179.2	-111.1	0	0	0	0	112.7
296	V	31.3	Very low	30.5	Very low	144 Å²	144	140.1 Å²	140.1	87%	0.873	77%	0.766	S	S	*	*			cis	-151.8	-146.8	46.2	-145.7	0	0	0	0	113.4
297	D	29.1	Very low	30.8	Very low	131 Å²	131	137.4 Å²	137.4	70%	0.701	76%	0.762	S	S	*	*			trans	-128.9	166.5	-148.6	-146.4	-12.6	0	0	0	116.8
298	F	27.8	Very low	31.8	Very low	175 Å²	175	136.6 Å²	136.6	77%	0.768	76%	0.764	S	S	*	*			trans	46.4	134.8	162.4	-89.4	-77.3	0	0	0	125.7
299	S	29.4	Very low	32	Very low	102 Å²	102	136.9 Å²	136.9	71%	0.713	77%	0.766	S	S	*	*			trans	67.6	161.2	145.3	-79.7	0	0	0	0	122.1
300	S	36.1	Very low	32	Very low	97 Å²	97	138.7 Å²	138.7	68%	0.678	78%	0.778	S	S	*	*			cis	-173.8	161.6	-29.1	-88.8	0	0	0	0	110.5
301	L	30.3	Very low	32.1	Very low	171 Å²	171	136.5 Å²	136.5	90%	0.895	78%	0.775	S	S	*	*			trans	71.4	164.7	171.3	-46.3	-176.9	0	0	0	116.4
302	S	28.4	Very low	32.7	Very low	115 Å²	115	135.9 Å²	135.9	80%	0.804	78%	0.783	S	S	*	*			cis	-147	-174.4	10	-159.4	0	0	0	0	114.1
303	S	37.3	Very low	32.8	Very low	105 Å²	105	132.2 Å²	132.2	73%	0.734	79%	0.786	S	S	*	*			trans	-133.8	167.4	-159.9	58.9	0	0	0	0	116.7
304	S	32.8	Very low	33.5	Very low	114 Å²	114	134.7 Å²	134.7	80%	0.797	79%	0.789	S	S	*	*			trans	-163.1	150.3	159.8	-25.4	0	0	0	0	110.4
305	D	32.2	Very low	33.7	Very low	130 Å²	130	131.7 Å²	131.7	70%	0.695	79%	0.787	S	S	*	*			cis	-160.4	153.1	-8.8	-136.3	-18.9	0	0	0	115
306	R	34.3	Very low	34.3	Very low	203 Å²	203	131.3 Å²	131.3	77%	0.766	79%	0.787	S	S	*	*			trans	40.1	119	148.4	-80.6	164	173.2	-177.6	-4.1	124
307	T	32.3	Very low	34.3	Very low	123 Å²	123	129.6 Å²	129.6	76%	0.755	78%	0.782	S	S	*	*				85.1	162.9	67.1	62.9	0	0	0	0	115.9
308	P	47.8	Very low	35.2	Very low	127 Å²	127	128.1 Å²	128.1	83%	0.825	78%	0.779	S	S	*	*			cis	-133.5	-157.1	1	38.1	-15.4	0	0	0	115.8
309	L	34.1	Very low	35.3	Very low	165 Å²	165	126.3 Å²	126.3	86%	0.864	78%	0.777	S	S	*	*			trans	-117.7	157.5	-176.1	-66.2	161.1	0	0	0	113.7
310	T	29.1	Very low	35.2	Very low	153 Å²	153	130 Å²	130	94%	0.939	78%	0.781	S	S	*	*			trans	-172.5	166.2	143.6	17.3	0	0	0	0	115.5
311	S	32.9	Very low	35.1	Very low	109 Å²	109	130.5 Å²	130.5	76%	0.762	79%	0.785	S	S	*	*			trans	-119.4	-177.9	170.4	63.4	0	0	0	0	109.4
312	P	45.8	Very low	35	Very low	122 Å²	122	125.9 Å²	125.9	79%	0.792	78%	0.778	S	S	*	*			cis	-141.3	-155.7	20.1	44.7	-22.6	0	0	0	116.2
313	S	30.8	Very low	35.9	Very low	111 Å²	111	127.2 Å²	127.2	78%	0.776	78%	0.784	S	S	*	*			trans	-66.7	164.8	-177.3	-37	0	0	0	0	115.9
314	P	42	Very low	35.5	Very low	125 Å²	125	125.8 Å²	125.8	81%	0.812	79%	0.786	S	S	*	*				-151.7	176.6	90.6	42.3	-25.4	0	0	0	117.1
315	S	32.1	Very low	35.4	Very low	110 Å²	110	127 Å²	127	77%	0.769	79%	0.788	S	S	*	*			trans	-85.4	172.2	163	-30.6	0	0	0	0	110.6
316	P	44.3	Very low	36.1	Very low	126 Å²	126	126.4 Å²	126.4	82%	0.818	79%	0.792	S	S	*	*			cis	-146.5	-172.6	41.2	42.7	-20.8	0	0	0	117.7
317	S	31.2	Very low	35.9	Very low	107 Å²	107	121 Å²	121	75%	0.748	79%	0.79	S	S	*	*			trans	-75.8	-173.4	166.3	-35.2	0	0	0	0	112.2
318	P	48.3	Very low	36	Very low	101 Å²	101	120.6 Å²	120.6	66%	0.656	79%	0.793	S	S	*	*			cis	-142.1	-166.3	6.6	43.9	-23.3	0	0	0	116.9
319	D	28.8	Very low	35.4	Very low	136 Å²	136	123.1 Å²	123.1	73%	0.727	79%	0.793	S	S	*	*			trans	68.2	149.9	153.2	-62.2	-18.9	0	0	0	120.1
320	F	28.9	Very low	35.3	Very low	181 Å²	181	121 Å²	121	79%	0.794	79%	0.793	S	S	*	*			cis	-155.2	173.1	-5	-143.6	-119.9	0	0	0	111.6
321	S	32.9	Very low	35.5	Very low	107 Å²	107	118.4 Å²	118.4	75%	0.748	79%	0.786	S	S	*	*			trans	77.4	132.7	160.5	-57	0	0	0	0	121.6
322	G	29.4	Very low	35.8	Very low	74 Å²	74	119.8 Å²	119.8	76%	0.763	79%	0.79	S	S	*	*			trans	-96.1	-142.9	160.5	0	0	0	0	0	111.9
323	P	45.5	Very low	35.7	Very low	142 Å²	142	119.1 Å²	119.1	92%	0.922	79%	0.786	S	S	*	*			cis	-133.9	-178.5	12.4	43.2	-26.7	0	0	0	115.6
324	G	29.3	Very low	35.9	Very low	75 Å²	75	119.3 Å²	119.3	77%	0.773	79%	0.787	S	S	*	*			trans	151.9	104	163.3	0	0	0	0	0	116.1
325	T	30.6	Very low	35.7	Very low	139 Å²	139	120.7 Å²	120.7	85%	0.853	79%	0.787	S	S	*	*			trans	-110.7	-177.8	175.9	56.7	0	0	0	0	110
326	P	47.5	Very low	35.7	Very low	118 Å²	118	123.3 Å²	123.3	77%	0.766	79%	0.792	S	S	*	*			cis	-142.6	-163.3	8.7	44.5	-24.1	0	0	0	117
327	A	29.9	Very low	35.2	Very low	89 Å²	89	122.1 Å²	122.1	74%	0.736	79%	0.786	S	S	*	*			trans	83.5	133.5	163.9	0	0	0	0	0	118.4
328	S	34.3	Very low	35.3	Very low	115 Å²	115	126.2 Å²	126.2	80%	0.804	79%	0.793	S	S	*	*			cis	-154.7	161.2	-7.8	-105.3	0	0	0	0	113.4
329	H	35.1	Very low	34.7	Very low	181 Å²	181	125.1 Å²	125.1	84%	0.838	79%	0.793	S	S	*	*			trans	-82.8	155.4	-161.5	-55.5	-103.8	0	0	0	116.9
330	S	32.2	Very low	35.2	Very low	121 Å²	121	126.2 Å²	126.2	85%	0.846	80%	0.799	S	S	*	*				166	168.2	107.8	50	0	0	0	0	112.9
331	A	33	Very low	35.3	Very low	98 Å²	98	124.3 Å²	124.3	81%	0.81	80%	0.796	S	S	*	*				-153.9	155.6	-60.4	0	0	0	0	0	110.3
332	T	40.8	Very low	35.5	Very low	137 Å²	137	126.9 Å²	126.9	84%	0.84	80%	0.8	S	S	*	*			trans	-86.6	-178.4	-179.5	32.6	0	0	0	0	111.5
333	P	42.7	Very low	36.2	Very low	108 Å²	108	128.7 Å²	128.7	70%	0.701	80%	0.798	S	S	*	*			cis	-151.3	168.7	28	45.4	-24	0	0	0	121.7
334	S	34.4	Very low	35.4	Very low	115 Å²	115	129.8 Å²	129.8	80%	0.804	80%	0.796	S	S	*	*			trans	-80.7	161.6	156.3	-50.2	0	0	0	0	111.1
335	L	37.8	Very low	35.5	Very low	154 Å²	154	130.7 Å²	130.7	81%	0.806	80%	0.796	S	S	*	*			trans	-138.4	146.7	172.5	-75.6	176.7	0	0	0	113.5
336	L	32.7	Very low	35.4	Very low	166 Å²	166	132.4 Å²	132.4	87%	0.869	80%	0.797	S	S	*	*			trans	74.6	154.9	173.4	-48.5	-171.5	0	0	0	116.8
337	S	34.7	Very low	35.3	Very low	100 Å²	100	131.5 Å²	131.5	70%	0.699	79%	0.791	S	S	*	*			trans	-154	171.2	-132.7	49.9	0	0	0	0	114.9	A339	S337-A339 VanDerWaalsContact C-N 3.28Å; S337-A339 PolarHBondContact O-N 3.12Å
338	E	33.3	Very low	35.5	Very low	194 Å²	194	133.4 Å²	133.4	91%	0.907	80%	0.796	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	51.9	-164.3	-159.7	165.7	-161.6	0	0	115.1
339	A	35.4	Very low	35.1	Very low	78 Å²	78	136.7 Å²	136.7	65%	0.645	80%	0.798	S	S	*	*	T	Hydrogen-bonded Turn	trans	-120.1	-17.5	-178.1	0	0	0	0	0	115.2	S337 L341	S337-A339 VanDerWaalsContact C-N 3.28Å; S337-A339 PolarHBondContact O-N 3.12Å; A339-L341 PolarHBondContact O-N 3.07Å
340	D	39.3	Very low	34.8	Very low	159 Å²	159	132.4 Å²	132.4	85%	0.85	79%	0.794	S	S	*	*	S	Bend	trans	-87.6	24.4	-177.3	-64.2	-38.3	0	0	0	113.8
341	L	31.6	Very low	34.6	Very low	140 Å²	140	133.5 Å²	133.5	73%	0.733	79%	0.79	S	S	*	*			trans	-133	105.6	176.7	-58.4	173.5	0	0	0	106.6	A339	A339-L341 PolarHBondContact O-N 3.07Å
342	I	36.2	Very low	34.4	Very low	162 Å²	162	137.7 Å²	137.7	83%	0.831	79%	0.79	S	S	*	*				-163.8	148.9	77.6	-89.8	160.7	0	0	0	108.6
343	P	44.1	Very low	34	Very low	111 Å²	111	139.2 Å²	139.2	72%	0.721	79%	0.787	S	S	*	*			trans	-87.7	167.2	-176.9	36.7	-38.3	0	0	0	113.5
344	D	29.3	Very low	33.4	Very low	165 Å²	165	141 Å²	141	88%	0.882	79%	0.791	S	S	*	*			trans	-157.6	164.2	139.7	-127.9	-32.9	0	0	0	115.1
345	A	30.7	Very low	33.1	Very low	94 Å²	94	142.5 Å²	142.5	78%	0.777	79%	0.79	S	S	*	*			trans	60.9	112.1	165.6	0	0	0	0	0	121.9
346	M	29.5	Very low	32.8	Very low	176 Å²	176	144.4 Å²	144.4	87%	0.867	80%	0.795	S	S	*	*			trans	-115	171.7	151.8	-93.5	-178.2	59.6	0	0	108.3
347	P	44.9	Very low	32.7	Very low	98 Å²	98	145.1 Å²	145.1	64%	0.636	79%	0.793	S	S	*	*			cis	-125.5	-161	-35.9	36.4	-17.2	0	0	0	110.2
348	P	33	Very low	32.6	Very low	130 Å²	130	148.3 Å²	148.3	84%	0.844	80%	0.802	S	S	*	*				-147.1	-155.1	99.7	40	-22.3	0	0	0	114.2
349	Q	27.4	Very low	32.3	Very low	184 Å²	184	147 Å²	147	86%	0.86	80%	0.796	S	S	*	*			trans	-124.2	150.4	-165.3	-57.5	171.1	-61.3	0	0	114.2
350	A	28.4	Very low	32	Very low	90 Å²	90	149.9 Å²	149.9	74%	0.744	81%	0.806	S	S	*	*			trans	72.5	146	148.8	0	0	0	0	0	121.7
351	L	28.3	Very low	31.6	Very low	144 Å²	144	151 Å²	151	75%	0.754	81%	0.806	S	S	*	*			trans	64.9	137.6	168.2	-59.8	163.7	0	0	0	115.4
352	F	28.1	Very low	31.4	Very low	186 Å²	186	147.5 Å²	147.5	82%	0.816	80%	0.803	S	S	*	*			cis	-137.3	-174.4	20.1	-86.7	-82.9	0	0	0	112.7
353	H	33.3	Very low	31.2	Very low	170 Å²	170	148.4 Å²	148.4	79%	0.787	81%	0.806	S	S	*	*			trans	-78.1	154.2	163.1	-81.1	-100.2	0	0	0	111.1
354	D	29.7	Very low	30.4	Very low	145 Å²	145	151 Å²	151	78%	0.775	81%	0.812	S	S	*	*				179.3	143.9	111.1	-79.4	-13	0	0	0	110.3
355	D	28	Very low	30.4	Very low	147 Å²	147	150 Å²	150	79%	0.786	81%	0.807	S	S	*	*			trans	1.6	160.2	150.7	-48.5	-24.4	0	0	0	120.4
356	E	31.2	Very low	30.9	Very low	194 Å²	194	151.2 Å²	151.2	91%	0.907	81%	0.806	S	S	*	*			cis	-139.2	173.6	27.7	-68.4	179.8	100.5	0	0	114.8
357	E	31	Very low	30.7	Very low	180 Å²	180	145.9 Å²	145.9	84%	0.841	80%	0.797	S	S	*	*			trans	-71	159	167.9	-59.2	171.5	119.9	0	0	113.1
358	L	31.3	Very low	29.8	Very low	168 Å²	168	150.4 Å²	150.4	88%	0.88	81%	0.812	S	S	*	*				-160.2	124.5	123.7	-157.3	67.5	0	0	0	112.2
359	E	28.4	Very low	29.6	Very low	166 Å²	166	153.1 Å²	153.1	78%	0.776	81%	0.813	S	S	*	*			trans	-88.2	161.4	167.3	-61.3	-170.9	127.3	0	0	111.5
360	T	29.6	Very low	29.7	Very low	139 Å²	139	155.3 Å²	155.3	85%	0.853	82%	0.815	S	S	*	*			trans	-142	119.4	157.4	26.1	0	0	0	0	112.1
361	E	29	Very low	29.7	Very low	183 Å²	183	157.9 Å²	157.9	86%	0.855	82%	0.815	S	S	*	*			trans	-72.7	169	167.8	-60.6	175.5	99.9	0	0	111.1
362	G	28.4	Very low	30.2	Very low	65 Å²	65	156.3 Å²	156.3	67%	0.67	81%	0.814	S	S	*	*			cis	153.5	162.6	-6.1	0	0	0	0	0	112.9
363	M	32	Very low	30.5	Very low	182 Å²	182	153.4 Å²	153.4	90%	0.897	81%	0.814	S	S	*	*			trans	67.8	162.2	169.1	-56.1	-153.9	177.6	0	0	116.2
364	I	27.1	Very low	30.5	Very low	165 Å²	165	151.6 Å²	151.6	85%	0.846	82%	0.817	S	S	*	*			cis	-136.1	152.6	25.9	-59.4	165.1	0	0	0	112.4
365	D	29.3	Very low	30.5	Very low	145 Å²	145	150.2 Å²	150.2	78%	0.775	82%	0.819	S	S	*	*			trans	-83.9	-165.6	179.2	-137.2	35	0	0	0	111.7
366	P	40.3	Very low	30.6	Very low	118 Å²	118	147.9 Å²	147.9	77%	0.766	82%	0.82	S	S	*	*			cis	-129.8	176.7	6.6	43.1	-24.7	0	0	0	117.6
367	G	26.1	Very low	30.7	Very low	64 Å²	64	143 Å²	143	66%	0.66	81%	0.807	S	S	*	*			trans	-100.9	-167	-175.3	0	0	0	0	0	117.5
368	M	27	Very low	30.7	Very low	194 Å²	194	145.1 Å²	145.1	96%	0.956	81%	0.807	S	S	*	*			trans	-159.9	151.9	165.9	-148.2	69.4	176.2	0	0	110.7
369	E	28	Very low	30.5	Very low	187 Å²	187	146.4 Å²	146.4	87%	0.874	81%	0.806	S	S	*	*			trans	-86.9	152	-178.2	-55.7	177.1	111.8	0	0	114
370	Y	29	Very low	30.4	Very low	229 Å²	229	146.7 Å²	146.7	90%	0.898	81%	0.805	S	S	*	*			trans	-157.5	159.6	136.6	-141.5	-107.5	0	0	0	114.9
371	L	28.8	Very low	30.1	Very low	144 Å²	144	147.1 Å²	147.1	75%	0.754	80%	0.801	S	S	*	*			trans	-107.2	167.1	-176.4	-84.7	169.2	0	0	0	112.4
372	P	38.6	Very low	29.8	Very low	112 Å²	112	149.6 Å²	149.6	73%	0.727	80%	0.802	S	S	*	*			trans	-77.5	156.2	-163.6	29.9	-36.8	0	0	0	115.8
373	P	35	Very low	30.8	Very low	124 Å²	124	151.4 Å²	151.4	81%	0.805	80%	0.802	S	S	*	*			trans	-81.4	165.7	-176.3	33.2	-36.6	0	0	0	115.1
374	P	33.6	Very low	30.7	Very low	133 Å²	133	148.8 Å²	148.8	86%	0.864	80%	0.799	S	S	*	*			trans	-115.1	-168.7	-157.9	43.3	-34.1	0	0	0	115.8
375	S	28.3	Very low	30.7	Very low	116 Å²	116	149.2 Å²	149.2	81%	0.811	80%	0.797	S	S	*	*			trans	-106.4	153.9	-173.7	59.6	0	0	0	0	114.8
376	A	31.1	Very low	30.5	Very low	97 Å²	97	148 Å²	148	80%	0.802	80%	0.795	S	S	*	*			trans	174	154	155	0	0	0	0	0	112
377	S	32.1	Very low	29.8	Very low	91 Å²	91	149.1 Å²	149.1	64%	0.636	79%	0.794	S	S	*	*			cis	-174.3	177.4	-20.8	63.6	0	0	0	0	111.7
378	R	32.5	Very low	29.8	Very low	225 Å²	225	153.4 Å²	153.4	85%	0.849	80%	0.801	S	S	*	*			trans	77.6	143.7	162	-69.1	163.6	176.2	-168.3	-2.9	115.9
379	K	26.6	Very low	29.6	Very low	195 Å²	195	151.8 Å²	151.8	85%	0.848	79%	0.788	S	S	*	*			cis	-149	165.6	17.7	-102.6	141.9	177.7	-178	0	108.1
380	K	25.6	Very low	29.4	Very low	173 Å²	173	153.5 Å²	153.5	75%	0.752	79%	0.787	S	S	*	*			cis	-170.4	154.8	-15.5	-164.6	-161.2	172.1	-169.3	0	109.3
381	L	24.2	Very low	29.1	Very low	148 Å²	148	149.3 Å²	149.3	78%	0.775	78%	0.775	S	S	*	*			trans	78.5	167.2	157.7	-86	166.4	0	0	0	121.9
382	R	22.9	Very low	29	Very low	234 Å²	234	147.3 Å²	147.3	88%	0.883	77%	0.773	S	S	*	*			trans	-157.4	-172.5	-154.6	-135.7	-167.1	-172.6	-176.9	4.5	111.3
383	P	49.1	Very low	28.2	Very low	103 Å²	103	150.2 Å²	150.2	67%	0.669	78%	0.777	S	S	*	*				-110	-168.9	-124.5	44.9	-29.3	0	0	0	115.4
384	P	30.4	Very low	27.8	Very low	128 Å²	128	148.5 Å²	148.5	83%	0.831	77%	0.768	S	S	*	*			trans	-134	-166.8	136.8	38.5	-25.7	0	0	0	114
385	Q	26.7	Very low	27.7	Very low	173 Å²	173	151 Å²	151	81%	0.808	77%	0.768	S	S	*	*			trans	-130.4	162.8	-168	-64.4	179.6	-74.4	0	0	115.1
386	T	25.6	Very low	27.6	Very low	120 Å²	120	154.3 Å²	154.3	74%	0.736	77%	0.771	S	S	*	*			trans	80.1	141.5	142.1	35.7	0	0	0	0	124.4
387	L	24.6	Very low	27.4	Very low	142 Å²	142	155.7 Å²	155.7	74%	0.743	76%	0.764	S	S	*	*			trans	84.7	121.1	149.9	-67.9	150.3	0	0	0	122.1
388	I	26	Very low	27.2	Very low	154 Å²	154	158 Å²	158	79%	0.79	77%	0.77	S	S	*	*			trans	64	139	139.8	-60.3	172.7	0	0	0	116.5
389	K	22	Very low	26.9	Very low	160 Å²	160	151.7 Å²	151.7	70%	0.696	77%	0.765	S	S	*	*			cis	-143.6	-150.9	33	-153.2	-162.3	164.1	-156.8	0	113.1	E391	K389-E391 WeakPolarHBondContact CE-OE1 3.33Å; K389-E391 IonicContact NZ-OE1 2.78Å; K389-E391 PolarHBondContact NZ-OE1 2.95Å; K389-E391 IonicContact NZ-OE2 2.61Å; K389-E391 PolarHBondContact NZ-OE2 3.42Å
390	R	24.3	Very low	26.9	Very low	223 Å²	223	151.3 Å²	151.3	84%	0.842	77%	0.767	S	S	*	*			trans	-151.7	134	-169.4	165.8	-167	-178.3	177.7	1.8	110.1
391	E	23.8	Very low	27.1	Very low	141 Å²	141	152.5 Å²	152.5	66%	0.659	78%	0.775	S	S	*	*			trans	-178.1	122	163	-98.1	115.8	-140.9	0	0	104.3	K389	K389-E391 WeakPolarHBondContact CE-OE1 3.33Å; K389-E391 IonicContact NZ-OE1 2.78Å; K389-E391 PolarHBondContact NZ-OE1 2.95Å; K389-E391 IonicContact NZ-OE2 2.61Å; K389-E391 PolarHBondContact NZ-OE2 3.42Å
392	S	26.4	Very low	27.2	Very low	101 Å²	101	153.5 Å²	153.5	71%	0.706	78%	0.775	S	S	*	*				71.1	146.5	78.3	67.5	0	0	0	0	113.7
393	E	22.3	Very low	27.5	Very low	173 Å²	173	150.2 Å²	150.2	81%	0.808	76%	0.763	S	S	*	*			cis	-146.8	166.3	26.6	-63.5	169.4	124.2	0	0	114.9
394	S	26.3	Very low	26.3	Very low	88 Å²	88	153.2 Å²	153.2	62%	0.615	77%	0.766	S	S	*	*			trans	48.5	118.6	136.4	65.8	0	0	0	0	122.7
395	E	30.2	Very low	26.2	Very low	187 Å²	187	154.5 Å²	154.5	87%	0.874	76%	0.761	S	S	*	*				88	157.3	84	-75.4	170.1	157.9	0	0	114
396	E	27.3	Very low	26.2	Very low	185 Å²	185	154.9 Å²	154.9	86%	0.864	76%	0.762	S	S	*	*			cis	-97.3	-121.9	5.2	-57.4	179.7	73.4	0	0	112.8
397	D	26.7	Very low	26.8	Very low	125 Å²	125	155 Å²	155	67%	0.668	77%	0.765	S	S	*	*			cis	-155.3	155.3	5.8	178.1	42.2	0	0	0	112.3
398	N	27.4	Very low	26.9	Very low	141 Å²	141	152.5 Å²	152.5	75%	0.754	77%	0.765	S	S	*	*			trans	50.6	141.8	164.7	-92.6	-69.2	0	0	0	122.8
399	A	26.1	Very low	26.9	Very low	91 Å²	91	151 Å²	151	75%	0.752	77%	0.768	S	S	*	*			trans	-148.8	164.7	-175	0	0	0	0	0	112.9
400	H	27.9	Very low	27	Very low	188 Å²	188	150.1 Å²	150.1	87%	0.87	78%	0.78	S	S	*	*			trans	-159.7	111.2	163.9	-124.6	-37.7	0	0	0	113
401	E	29.1	Very low	27.1	Very low	198 Å²	198	143 Å²	143	93%	0.925	78%	0.776	S	S	*	*			trans	-149.7	162.1	150	-85.9	-151.3	146.6	0	0	107.5
402	E	26.8	Very low	27.2	Very low	169 Å²	169	146.1 Å²	146.1	79%	0.79	79%	0.791	S	S	*	*			trans	-134.6	133.6	-179.5	-139.3	-161	-110.9	0	0	113.6
403	R	27.6	Very low	27.4	Very low	165 Å²	165	145.7 Å²	145.7	62%	0.623	79%	0.794	S	S	*	*			trans	76.8	108.2	142.8	-155.1	178.4	-177	-167.2	0.5	120.3
404	F	24.9	Very low	28.1	Very low	165 Å²	165	143.2 Å²	143.2	72%	0.724	79%	0.793	S	S	*	*				-159.7	-176.9	96.8	-115.3	-78.2	0	0	0	112.1
405	E	27.4	Very low	29.3	Very low	155 Å²	155	144.7 Å²	144.7	72%	0.724	80%	0.8	S	S	*	*			trans	-100.5	165.9	-144.2	-66.6	167.8	154.6	0	0	117
406	H	27.7	Very low	30.2	Very low	181 Å²	181	141.1 Å²	141.1	84%	0.838	79%	0.793	S	S	*	*			trans	-104.5	161.7	-179.2	-112.1	-54.4	0	0	0	111.1
407	P	37.7	Very low	30	Very low	123 Å²	123	140.1 Å²	140.1	80%	0.799	79%	0.788	S	S	*	*				-150.8	143.9	92.6	36.4	-17.3	0	0	0	118.5
408	A	26.9	Very low	30	Very low	89 Å²	89	143.7 Å²	143.7	74%	0.736	79%	0.792	S	S	*	*			trans	39.7	122.8	141.7	0	0	0	0	0	123.3
409	S	26.8	Very low	30	Very low	124 Å²	124	147.5 Å²	147.5	87%	0.867	80%	0.796	S	S	*	*				-168.9	170.2	97.9	47.6	0	0	0	0	111.7
410	C	23.9	Very low	30.1	Very low	140 Å²	140	149.2 Å²	149.2	95%	0.946	80%	0.797	S	S	*	*			trans	-100.1	163	-167.6	-53.3	0	0	0	0	113.8
411	G	25.7	Very low	30.1	Very low	74 Å²	74	145.4 Å²	145.4	76%	0.763	80%	0.798	S	S	*	*			trans	168.5	53.2	168.3	0	0	0	0	0	120.8
412	E	26.9	Very low	30.2	Very low	206 Å²	206	143.7 Å²	143.7	96%	0.963	79%	0.79	S	S	*	*			trans	54.2	-178.3	156.9	-64	-168.9	109.4	0	0	120.5
413	A	29.3	Very low	30.4	Very low	93 Å²	93	147.7 Å²	147.7	77%	0.769	80%	0.798	S	S	*	*			trans	-144.1	-162.7	-160.7	0	0	0	0	0	112.7
414	P	36.9	Very low	30.6	Very low	120 Å²	120	150.6 Å²	150.6	78%	0.779	81%	0.809	S	S	*	*				-118.6	176.5	-116.7	25.7	-2	0	0	0	115.4
415	P	52.8	Low	30.9	Very low	120 Å²	120	153.9 Å²	153.9	78%	0.779	82%	0.817	S	S	*	*			trans	-86.1	175.6	-173.5	38.6	-39.4	0	0	0	113.1
416	P	47.5	Very low	31	Very low	111 Å²	111	155 Å²	155	72%	0.721	82%	0.824	S	S	*	*				-151.8	164.5	100.7	36.4	-18.6	0	0	0	115.7
417	E	24.2	Very low	31.1	Very low	164 Å²	164	153.8 Å²	153.8	77%	0.766	82%	0.824	S	S	*	*				175.8	158.5	114.3	-96	-79	76.7	0	0	114.3
418	R	26.2	Very low	30.7	Very low	200 Å²	200	156.6 Å²	156.6	76%	0.755	83%	0.831	S	S	*	*			trans	-78.1	142.5	-161.5	-72.7	158.8	160.5	177.7	-3.2	117.8
419	R	26.9	Very low	31	Very low	221 Å²	221	160.6 Å²	160.6	83%	0.834	84%	0.835	S	S	*	*				79.7	128.9	125.4	-79	-179.3	172.8	-167.7	-3.9	123.1
420	V	29.2	Very low	31.2	Very low	128 Å²	128	162.6 Å²	162.6	78%	0.776	84%	0.835	S	S	*	*			trans	80.6	114.7	136.2	174.8	0	0	0	0	118.7
421	A	27.9	Very low	31.5	Very low	108 Å²	108	165 Å²	165	89%	0.893	83%	0.83	S	S	*	*			trans	-137.7	117.3	145.1	0	0	0	0	0	108.5
422	E	30.9	Very low	32	Very low	162 Å²	162	167.4 Å²	167.4	76%	0.757	83%	0.832	S	S	*	*			trans	-102.2	134.5	177.5	179.8	-171.1	-174.2	0	0	109.7
423	R	31.1	Very low	32.3	Very low	253 Å²	253	165.8 Å²	165.8	96%	0.955	83%	0.83	S	S	*	*			trans	-159.5	129	159.9	-110.7	153.5	-161.8	-150.7	1.9	113.3
424	R	32.6	Very low	32.6	Very low	225 Å²	225	164.6 Å²	164.6	85%	0.849	83%	0.826	S	S	*	*			trans	-73.4	156	-179.7	-61.3	168.3	170	179	-6.5	112.8
425	R	29.9	Very low	32.5	Very low	235 Å²	235	163.7 Å²	163.7	89%	0.887	83%	0.829	S	S	*	*			trans	-153.1	105.4	138.9	-116.3	174.2	-172.9	-175.9	1.4	113.9
426	M	29.6	Very low	31.9	Very low	177 Å²	177	162.9 Å²	162.9	87%	0.872	83%	0.827	S	S	*	*			trans	47.5	134.7	142.3	-55.3	-177.3	75.4	0	0	121.7
427	N	29.3	Very low	31.8	Very low	156 Å²	156	163.7 Å²	163.7	83%	0.834	83%	0.832	S	S	*	*			trans	-69.7	148.8	171.1	-67.3	-1.9	0	0	0	113
428	L	30.4	Very low	32.7	Very low	182 Å²	182	166.7 Å²	166.7	95%	0.953	84%	0.836	S	S	*	*			trans	-138.7	156.3	134.8	-106.6	154.3	0	0	0	107.4
429	Q	32.2	Very low	33.7	Very low	174 Å²	174	162.8 Å²	162.8	81%	0.813	84%	0.836	S	S	*	*			trans	-132.9	126.2	-150.9	-177.9	176.7	28	0	0	112.8
430	D	31.8	Very low	34.8	Very low	165 Å²	165	158.5 Å²	158.5	88%	0.882	84%	0.835	S	S	*	*			trans	-141.5	165	163.8	-117.3	-43.5	0	0	0	111.4
431	K	30.1	Very low	36.2	Very low	192 Å²	192	159.1 Å²	159.1	84%	0.835	84%	0.838	S	S	*	*			trans	-104.8	169.9	-165	-69.3	174.4	-178.8	170.9	0	113.5
432	P	36.5	Very low	37.9	Very low	124 Å²	124	158.7 Å²	158.7	81%	0.805	83%	0.829	S	S	*	*			cis	-125	147.9	-27.2	32.9	-17.4	0	0	0	112.7
433	D	32.5	Very low	39.7	Very low	172 Å²	172	155.7 Å²	155.7	92%	0.92	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-77.2	148.6	-177.5	-116.5	-40.8	0	0	0	114.9
434	G	35.3	Very low	41.8	Very low	67 Å²	67	147.2 Å²	147.2	69%	0.691	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-77.7	144.1	-179.3	0	0	0	0	0	113.6	S436	G434-S436 PolarHBondContact O-N 3.02Å
435	A	36.3	Very low	44.1	Very low	102 Å²	102	138.9 Å²	138.9	84%	0.843	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-68.4	127.3	-178.2	0	0	0	0	0	113
436	S	40.1	Very low	46.4	Very low	103 Å²	103	132.7 Å²	132.7	72%	0.72	77%	0.765	S	S	*	*	P	Polyproline II helix	trans	-57.9	134.9	172.7	57.7	0	0	0	0	112	G434 R438	G434-S436 PolarHBondContact O-N 3.02Å; S436-R438 PolarHBondContact O-N 3.21Å
437	P	44.8	Very low	48.6	Very low	128 Å²	128	132.5 Å²	132.5	83%	0.831	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-57.4	133.2	178.5	-25.6	34.7	0	0	0	112.9
438	R	44	Very low	51.1	Low	227 Å²	227	129.1 Å²	129.1	86%	0.857	74%	0.735	S	S	*	*	P	Polyproline II helix	trans	-68.3	143.5	172	-70.4	179.7	174.9	175.4	-1.5	110.1	S436 V440	S436-R438 PolarHBondContact O-N 3.21Å; R438-V440 PolarHBondContact O-N 3.36Å
439	P	46.5	Very low	53.6	Low	117 Å²	117	120.8 Å²	120.8	76%	0.76	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-63.7	125.4	178.5	26	-34.1	0	0	0	111	V441	P439-V441 PolarHBondContact O-N 3.24Å
440	V	49.8	Very low	56	Low	131 Å²	131	120.8 Å²	120.8	79%	0.794	68%	0.684	S	S	*	*			trans	-74.8	105.8	178.8	-179.4	0	0	0	0	109.3	R438 S442	R438-V440 PolarHBondContact O-N 3.36Å; V440-S442 PolarHBondContact O-N 3.21Å; V440-S442 VanDerWaalsContact O-N 3.1Å
441	V	59.1	Low	58.5	Low	141 Å²	141	116.4 Å²	116.4	86%	0.855	66%	0.66	S	S	*	*			trans	-80.4	90.3	179.4	-176.7	0	0	0	0	109.9	P439	P439-V441 PolarHBondContact O-N 3.24Å
442	S	63.4	Low	61.2	Low	99 Å²	99	109.6 Å²	109.6	69%	0.692	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-73.5	147.5	175.9	-62.1	0	0	0	0	112.8	V440	V440-S442 PolarHBondContact O-N 3.21Å; V440-S442 VanDerWaalsContact O-N 3.1Å
443	A	67.5	Low	63.6	Low	100 Å²	100	104.7 Å²	104.7	83%	0.826	60%	0.6	S	S	*	*	P	Polyproline II helix	trans	-77.3	127.9	176.5	0	0	0	0	0	111.8	S445	A443-S445 PolarHBondContact O-N 3.44Å
444	L	75.6	Confident	66.1	Low	75 Å²	75	105.9 Å²	105.9	39%	0.393	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-56.6	130.4	176	-76	166	0	0	0	112.4	E448 L452	L444-E448 HydrophobicContact CD2-CB 3.96Å; L444-L452 HydrophobicContact CD1-CD1 3.97Å; L444-L452 HydrophobicContact CD2-CD1 3.77Å
445	S	80.3	Confident	68.5	Low	50 Å²	50	110.6 Å²	110.6	35%	0.35	59%	0.588	S	S	.	*	P	Polyproline II helix	trans	-73.7	167.2	176.5	71.4	0	0	0	0	113.4	A443 Y447 E448 E449	A443-S445 PolarHBondContact O-N 3.44Å; S445-Y447 PolarHBondContact O-N 3.17Å; S445-E448 WeakPolarHBondContact CB-OE2 3.08Å; S445-E448 PolarHBondContact N-OE2 3Å; S445-E448 PolarHBondContact O-N 3.44Å; S445-E448 WeakPolarHBondContact OG-CG 3.35Å; S445-E448 PolarHBondContact OG-N 3.38Å; S445-E448 PolarHBondContact OG-OE2 2.98Å; S445-E449 WeakPolarHBondContact O-CB 3.25Å; S445-E449 PolarHBondContact O-N 3.25Å
446	L	78.9	Confident	70.9	Confident	105 Å²	105	107 Å²	107	55%	0.55	56%	0.555	S	S	.	*	H	α-helix	trans	-57.4	-33.6	173.9	-65.9	173	0	0	0	113.2	R450 R483	L446-R450 WeakPolarHBondContact O-CD 3.36Å; L446-R450 VanDerWaalsContact O-CG 3.29Å; L446-R450 WeakPolarHBondContact O-CG 3.18Å; L446-R450 PolarHBondContact O-N 3.36Å; L446-R483 VanDerWaalsContact CD2-CZ 3.42Å; L446-R483 VanDerWaalsContact CD2-NE 3.29Å
447	Y	75.6	Confident	73.1	Confident	172 Å²	172	105.3 Å²	105.3	68%	0.675	54%	0.537	S	S	*	.	H	α-helix	trans	-77.4	-49.9	-178.3	178.8	-94.2	0	0	0	111	S445 E449 R450 L451	S445-Y447 PolarHBondContact O-N 3.17Å; Y447-E449 VanDerWaalsContact C-N 3.3Å; Y447-E449 PolarHBondContact O-N 2.85Å; Y447-R450 PolarHBondContact O-N 3.41Å; Y447-L451 HydrophobicContact CE1-CD2 4.16Å; Y447-L451 WeakPolarHBondContact O-CB 3.44Å; Y447-L451 PolarHBondContact O-N 2.93Å
448	E	81.4	Confident	75	Confident	86 Å²	86	102 Å²	102	40%	0.402	53%	0.527	S	S	.	.	H	α-helix	trans	-61.5	-38.7	178.5	-65.6	160.6	118.4	0	0	111.8	L444 S445 L451 L452	L444-E448 HydrophobicContact CD2-CB 3.96Å; S445-E448 WeakPolarHBondContact CB-OE2 3.08Å; S445-E448 PolarHBondContact N-OE2 3Å; S445-E448 PolarHBondContact O-N 3.44Å; S445-E448 WeakPolarHBondContact OG-CG 3.35Å; S445-E448 PolarHBondContact OG-N 3.38Å; S445-E448 PolarHBondContact OG-OE2 2.98Å; E448-L451 PolarHBondContact O-N 3.5Å; E448-L452 VanDerWaalsContact O-CB 3.26Å; E448-L452 WeakPolarHBondContact O-CB 3.38Å; E448-L452 VanDerWaalsContact O-CG 3.24Å; E448-L452 WeakPolarHBondContact O-CG 3.4Å; E448-L452 PolarHBondContact O-N 3.42Å
449	E	83.6	Confident	76.9	Confident	7 Å²	7	94.2 Å²	94.2	3%	0.033	51%	0.507	C	S	.	.	H	α-helix	trans	-63.6	-40.4	176.2	176.8	153.5	-139	0	0	112.6	S445 Y447 L453 L476 R479 R483	S445-E449 WeakPolarHBondContact O-CB 3.25Å; S445-E449 PolarHBondContact O-N 3.25Å; Y447-E449 VanDerWaalsContact C-N 3.3Å; Y447-E449 PolarHBondContact O-N 2.85Å; E449-L453 WeakPolarHBondContact O-CB 3.48Å; E449-L453 PolarHBondContact O-N 2.94Å; E449-L453 VanDerWaalsContact O-N 3.07Å; E449-L476 HydrophobicContact CG-CD2 4.11Å; E449-L476 WeakPolarHBondContact OE1-CD2 3.02Å; E449-R479 WeakPolarHBondContact OE1-CB 3.38Å; E449-R479 WeakPolarHBondContact OE1-CD 3.39Å; E449-R483 IonicContact OE2-CZ 3.14Å; E449-R483 IonicContact OE2-NH1 2.8Å; E449-R483 PolarHBondContact OE2-NH1 2.76Å; E449-R483 IonicContact OE2-NH2 2.69Å; E449-R483 PolarHBondContact OE2-NH2 2.8Å
450	R	83.3	Confident	78.5	Confident	173 Å²	173	93 Å²	93	65%	0.653	50%	0.499	S	S	*	.	H	α-helix	trans	-66.6	-42.2	173.5	-72.1	171.8	178.9	-166.5	-1.2	111.6	L446 Y447 L453 R454	L446-R450 WeakPolarHBondContact O-CD 3.36Å; L446-R450 VanDerWaalsContact O-CG 3.29Å; L446-R450 WeakPolarHBondContact O-CG 3.18Å; L446-R450 PolarHBondContact O-N 3.36Å; Y447-R450 PolarHBondContact O-N 3.41Å; R450-L453 PolarHBondContact O-N 3.21Å; R450-R454 PolarHBondContact O-N 2.82Å
451	L	84.3	Confident	79.8	Confident	74 Å²	74	93.5 Å²	93.5	39%	0.387	50%	0.496	S	S	.	.	H	α-helix	trans	-66.8	-41.9	178.9	-177.8	60.1	0	0	0	112	Y447 E448 R454 R455	Y447-L451 HydrophobicContact CE1-CD2 4.16Å; Y447-L451 WeakPolarHBondContact O-CB 3.44Å; Y447-L451 PolarHBondContact O-N 2.93Å; E448-L451 PolarHBondContact O-N 3.5Å; L451-R454 PolarHBondContact O-N 2.59Å; L451-R455 HydrophobicContact CD1-CG 4.46Å; L451-R455 WeakPolarHBondContact O-CB 3.35Å; L451-R455 VanDerWaalsContact O-CG 3.28Å; L451-R455 WeakPolarHBondContact O-CG 3.49Å; L451-R455 PolarHBondContact O-N 3.24Å
452	L	86.1	Confident	80.6	Confident	49 Å²	49	89 Å²	89	26%	0.257	47%	0.474	S	S	.	.	H	α-helix	trans	-63.9	-41.2	175.1	-77.4	165.7	0	0	0	111.9	L444 E448 R455 L456 L476	L444-L452 HydrophobicContact CD1-CD1 3.97Å; L444-L452 HydrophobicContact CD2-CD1 3.77Å; E448-L452 VanDerWaalsContact O-CB 3.26Å; E448-L452 WeakPolarHBondContact O-CB 3.38Å; E448-L452 VanDerWaalsContact O-CG 3.24Å; E448-L452 WeakPolarHBondContact O-CG 3.4Å; E448-L452 PolarHBondContact O-N 3.42Å; L452-R455 PolarHBondContact O-N 3.44Å; L452-L456 WeakPolarHBondContact O-CB 3.24Å; L452-L456 VanDerWaalsContact O-CG 3.26Å; L452-L456 WeakPolarHBondContact O-CG 3.26Å; L452-L456 PolarHBondContact O-N 3.05Å; L452-L476 HydrophobicContact CB-CD1 3.75Å
453	L	86.5	Confident	81.3	Confident	20 Å²	20	85.5 Å²	85.5	11%	0.105	45%	0.447	C	S	.	.	H	α-helix	trans	-61.6	-51.4	174.5	-179.1	56.4	0	0	0	110.9	E449 R450 R455 L456 D457 R473 L476 L477	E449-L453 WeakPolarHBondContact O-CB 3.48Å; E449-L453 PolarHBondContact O-N 2.94Å; E449-L453 VanDerWaalsContact O-N 3.07Å; R450-L453 PolarHBondContact O-N 3.21Å; L453-R455 VanDerWaalsContact C-N 3.31Å; L453-R455 PolarHBondContact O-N 2.81Å; L453-L456 WeakPolarHBondContact O-CB 3.29Å; L453-L456 PolarHBondContact O-N 3.35Å; L453-D457 PolarHBondContact O-N 2.94Å; L453-R473 HydrophobicContact CD1-CG 4.12Å; L453-L476 HydrophobicContact CB-CB 4.41Å; L453-L476 HydrophobicContact CB-CD1 4.17Å; L453-L476 HydrophobicContact CD1-CB 4.38Å; L453-L477 HydrophobicContact CD1-CD2 3.99Å; L453-L477 HydrophobicContact CD1-CG 3.98Å; L453-L477 HydrophobicContact CD2-CD2 4.03Å
454	R	85.9	Confident	81.7	Confident	197 Å²	197	83.6 Å²	83.6	74%	0.743	43%	0.431	S	S	*	.	H	α-helix	trans	-57	-40.7	176.5	-175.7	-179.7	-75.3	-177.2	-5.5	112.6	R450 L451 G458	R450-R454 PolarHBondContact O-N 2.82Å; L451-R454 PolarHBondContact O-N 2.59Å; R454-G458 PolarHBondContact O-N 3Å
455	R	85.6	Confident	81.9	Confident	167 Å²	167	85.4 Å²	85.4	63%	0.63	45%	0.445	S	S	*	.	H	α-helix	trans	-67.1	-35.3	175.7	-75.1	175.9	67.9	-172.8	2.6	113.1	L451 L452 L453	L451-R455 HydrophobicContact CD1-CG 4.46Å; L451-R455 WeakPolarHBondContact O-CB 3.35Å; L451-R455 VanDerWaalsContact O-CG 3.28Å; L451-R455 WeakPolarHBondContact O-CG 3.49Å; L451-R455 PolarHBondContact O-N 3.24Å; L452-R455 PolarHBondContact O-N 3.44Å; L453-R455 VanDerWaalsContact C-N 3.31Å; L453-R455 PolarHBondContact O-N 2.81Å
456	L	86.2	Confident	82.2	Confident	26 Å²	26	85.7 Å²	85.7	14%	0.136	45%	0.445	C	S	.	.	H	α-helix	trans	-71	-42.4	175.2	-74.9	165.8	0	0	0	111.5	L452 L453 G458 C459 L463 A469 L472 R473 L476	L452-L456 WeakPolarHBondContact O-CB 3.24Å; L452-L456 VanDerWaalsContact O-CG 3.26Å; L452-L456 WeakPolarHBondContact O-CG 3.26Å; L452-L456 PolarHBondContact O-N 3.05Å; L453-L456 WeakPolarHBondContact O-CB 3.29Å; L453-L456 PolarHBondContact O-N 3.35Å; L456-G458 VanDerWaalsContact C-N 3.33Å; L456-G458 PolarHBondContact O-N 3.3Å; L456-C459 PolarHBondContact O-N 3.21Å; L456-C459 VanDerWaalsContact O-N 3.12Å; L456-L463 HydrophobicContact CB-CD2 4.42Å; L456-L463 HydrophobicContact CD2-CD2 4.22Å; L456-L463 VanDerWaalsContact O-CD1 3.22Å; L456-L463 WeakPolarHBondContact O-CD1 3.43Å; L456-A469 HydrophobicContact CD2-CB 4Å; L456-L472 HydrophobicContact CD1-CB 4.5Å; L456-L472 HydrophobicContact CD1-CD2 4.07Å; L456-L472 HydrophobicContact CD1-CG 3.99Å; L456-R473 HydrophobicContact CD1-CB 4.22Å; L456-L476 HydrophobicContact CD1-CD1 4.1Å
457	D	85.8	Confident	82.4	Confident	67 Å²	67	84.8 Å²	84.8	36%	0.358	45%	0.446	S	S	.	.	H	α-helix	trans	-62.2	-39.5	176.1	-69.4	-42.2	0	0	0	112	L453 C459 R473	L453-D457 PolarHBondContact O-N 2.94Å; D457-C459 PolarHBondContact O-N 3.47Å; D457-C459 VanDerWaalsContact O-N 3.16Å; D457-R473 IonicContact OD1-CZ 2.93Å; D457-R473 IonicContact OD1-NE 3.17Å; D457-R473 PolarHBondContact OD1-NE 2.95Å; D457-R473 IonicContact OD1-NH2 2.73Å; D457-R473 PolarHBondContact OD1-NH2 2.98Å
458	G	85.2	Confident	82.8	Confident	60 Å²	60	83.5 Å²	83.5	62%	0.619	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.2	4.3	173.2	0	0	0	0	0	115.8	R454 L456	R454-G458 PolarHBondContact O-N 3Å; L456-G458 VanDerWaalsContact C-N 3.33Å; L456-G458 PolarHBondContact O-N 3.3Å
459	C	83.8	Confident	82.8	Confident	63 Å²	63	80 Å²	80	43%	0.426	43%	0.431	S	S	.	.			trans	-131.4	62.2	-177.2	-77.6	0	0	0	0	112.6	L456 D457 L461 A462 L463	L456-C459 PolarHBondContact O-N 3.21Å; L456-C459 VanDerWaalsContact O-N 3.12Å; D457-C459 PolarHBondContact O-N 3.47Å; D457-C459 VanDerWaalsContact O-N 3.16Å; C459-L461 VanDerWaalsContact C-N 3.28Å; C459-L461 PolarHBondContact O-N 3.09Å; C459-A462 HydrophobicContact CB-CB 4.07Å; C459-A462 PolarHBondContact O-N 3.42Å; C459-A462 VanDerWaalsContact O-N 3.12Å; C459-L463 PolarHBondContact O-N 2.88Å
460	P	79.9	Confident	82.8	Confident	91 Å²	91	84 Å²	84	59%	0.591	45%	0.449	S	S	*	.	H	α-helix	trans	-60.1	-32.3	-175.2	24	-34.5	0	0	0	113.9	L463 A464	P460-L463 PolarHBondContact O-N 3.31Å; P460-A464 WeakPolarHBondContact O-CB 2.98Å; P460-A464 PolarHBondContact O-N 3.21Å
461	L	77.6	Confident	83	Confident	142 Å²	142	84.4 Å²	84.4	74%	0.743	45%	0.45	S	S	*	.	H	α-helix	trans	-65.3	-45.8	174.3	-82.1	150.2	0	0	0	112.5	C459 L463 A464 V465	C459-L461 VanDerWaalsContact C-N 3.28Å; C459-L461 PolarHBondContact O-N 3.09Å; L461-L463 VanDerWaalsContact C-N 3.3Å; L461-L463 PolarHBondContact O-N 3.3Å; L461-A464 PolarHBondContact O-N 2.6Å; L461-A464 VanDerWaalsContact O-N 3.15Å; L461-V465 WeakPolarHBondContact O-CG2 3.2Å; L461-V465 PolarHBondContact O-N 3.4Å
462	A	75.1	Confident	83.1	Confident	47 Å²	47	84.1 Å²	84.1	39%	0.388	45%	0.449	S	S	.	.	H	α-helix	trans	-65.2	-37.1	177.1	0	0	0	0	0	111.5	C459 T466	C459-A462 HydrophobicContact CB-CB 4.07Å; C459-A462 PolarHBondContact O-N 3.42Å; C459-A462 VanDerWaalsContact O-N 3.12Å; A462-T466 PolarHBondContact O-N 3.04Å; A462-T466 VanDerWaalsContact O-N 3.07Å; A462-T466 PolarHBondContact O-OG1 3.15Å
463	L	79.6	Confident	83.2	Confident	24 Å²	24	86.1 Å²	86.1	13%	0.126	45%	0.453	C	S	.	.	H	α-helix	trans	-62.7	-44.9	169.9	-71.2	177.7	0	0	0	111.9	L456 C459 P460 L461 A469 K470 R473	L456-L463 HydrophobicContact CB-CD2 4.42Å; L456-L463 HydrophobicContact CD2-CD2 4.22Å; L456-L463 VanDerWaalsContact O-CD1 3.22Å; L456-L463 WeakPolarHBondContact O-CD1 3.43Å; C459-L463 PolarHBondContact O-N 2.88Å; P460-L463 PolarHBondContact O-N 3.31Å; L461-L463 VanDerWaalsContact C-N 3.3Å; L461-L463 PolarHBondContact O-N 3.3Å; L463-A469 HydrophobicContact CD2-CB 4.01Å; L463-K470 WeakPolarHBondContact O-CE 3.4Å; L463-K470 WeakPolarHBondContact O-CG 3.44Å; L463-R473 HydrophobicContact CD2-CB 4.03Å; L463-R473 HydrophobicContact CD2-CG 4.46Å
464	A	75.8	Confident	83.2	Confident	60 Å²	60	93.7 Å²	93.7	50%	0.496	48%	0.48	S	S	.	.	H	α-helix	trans	-61.1	-46.9	-178.8	0	0	0	0	0	112.1	P460 L461 K470	P460-A464 WeakPolarHBondContact O-CB 2.98Å; P460-A464 PolarHBondContact O-N 3.21Å; L461-A464 PolarHBondContact O-N 2.6Å; L461-A464 VanDerWaalsContact O-N 3.15Å; A464-K470 WeakPolarHBondContact O-CE 3.36Å; A464-K470 PolarHBondContact O-NZ 3.32Å
465	V	79.8	Confident	83.3	Confident	113 Å²	113	90.3 Å²	90.3	69%	0.685	47%	0.471	S	S	*	.	H	α-helix	trans	-77.5	-40.9	-174	177.1	0	0	0	0	113	L461 P467	L461-V465 WeakPolarHBondContact O-CG2 3.2Å; L461-V465 PolarHBondContact O-N 3.4Å; V465-P467 WeakPolarHBondContact O-CD 3.38Å
466	T	87	Confident	83.4	Confident	57 Å²	57	82.5 Å²	82.5	35%	0.35	44%	0.442	S	S	.	.			trans	-104.1	115.1	-167.8	68.2	0	0	0	0	113.8	A462 H468 A469 K470	A462-T466 PolarHBondContact O-N 3.04Å; A462-T466 VanDerWaalsContact O-N 3.07Å; A462-T466 PolarHBondContact O-OG1 3.15Å; T466-H468 PolarHBondContact O-N 2.95Å; T466-A469 PolarHBondContact O-N 3.19Å; T466-A469 WeakPolarHBondContact OG1-CB 3.48Å; T466-K470 PolarHBondContact O-N 2.86Å
467	P	83.4	Confident	83.5	Confident	86 Å²	86	84.5 Å²	84.5	56%	0.558	45%	0.452	S	S	*	.	H	α-helix	trans	-60.4	-29.8	177.2	-25.4	35.5	0	0	0	113.5	V465 K470 R471	V465-P467 WeakPolarHBondContact O-CD 3.38Å; P467-K470 PolarHBondContact O-N 3.49Å; P467-R471 WeakPolarHBondContact O-CB 3.35Å; P467-R471 PolarHBondContact O-N 3.13Å
468	H	82.4	Confident	83.5	Confident	144 Å²	144	85.3 Å²	85.3	67%	0.667	46%	0.459	S	S	*	.	H	α-helix	trans	-67.7	-39.6	176.9	-63.3	-81	0	0	0	112.5	T466 R471 L472	T466-H468 PolarHBondContact O-N 2.95Å; H468-R471 PolarHBondContact O-N 3.3Å; H468-L472 WeakPolarHBondContact O-CB 3.47Å; H468-L472 PolarHBondContact O-N 3.14Å
469	A	83	Confident	83.6	Confident	13 Å²	13	85.8 Å²	85.8	11%	0.107	44%	0.442	C	S	.	.	H	α-helix	trans	-69	-39.9	174	0	0	0	0	0	111.7	L456 L463 T466 R471 L472 R473	L456-A469 HydrophobicContact CD2-CB 4Å; L463-A469 HydrophobicContact CD2-CB 4.01Å; T466-A469 PolarHBondContact O-N 3.19Å; T466-A469 WeakPolarHBondContact OG1-CB 3.48Å; A469-R471 VanDerWaalsContact C-N 3.3Å; A469-R471 PolarHBondContact O-N 3Å; A469-L472 PolarHBondContact O-N 2.9Å; A469-R473 WeakPolarHBondContact O-CB 3.45Å; A469-R473 PolarHBondContact O-N 3.45Å
470	K	83.6	Confident	83.7	Confident	91 Å²	91	86.1 Å²	86.1	40%	0.396	44%	0.437	S	S	.	.	H	α-helix	trans	-55.3	-45.7	170.6	-60.9	-178.8	-170.5	175.2	0	111.2	L463 A464 T466 P467 R474	L463-K470 WeakPolarHBondContact O-CE 3.4Å; L463-K470 WeakPolarHBondContact O-CG 3.44Å; A464-K470 WeakPolarHBondContact O-CE 3.36Å; A464-K470 PolarHBondContact O-NZ 3.32Å; T466-K470 PolarHBondContact O-N 2.86Å; P467-K470 PolarHBondContact O-N 3.49Å; K470-R474 WeakPolarHBondContact O-CB 3.49Å; K470-R474 VanDerWaalsContact O-CG 3.29Å; K470-R474 WeakPolarHBondContact O-CG 3.34Å; K470-R474 PolarHBondContact O-N 3.22Å; K470-R474 VanDerWaalsContact O-N 3.1Å
471	R	86.4	Confident	83.7	Confident	181 Å²	181	83.6 Å²	83.6	68%	0.683	42%	0.424	S	S	*	.	H	α-helix	trans	-67.3	-42.8	179.3	-168.4	-176.9	-66.1	-169	0.2	112.1	P467 H468 A469 K475	P467-R471 WeakPolarHBondContact O-CB 3.35Å; P467-R471 PolarHBondContact O-N 3.13Å; H468-R471 PolarHBondContact O-N 3.3Å; A469-R471 VanDerWaalsContact C-N 3.3Å; A469-R471 PolarHBondContact O-N 3Å; R471-K475 WeakPolarHBondContact O-CB 3.28Å; R471-K475 PolarHBondContact O-N 2.82Å
472	L	86.6	Confident	83.9	Confident	69 Å²	69	80.5 Å²	80.5	36%	0.361	41%	0.405	S	S	.	.	H	α-helix	trans	-63.8	-51.3	176.8	-179.7	58.3	0	0	0	111	L456 H468 A469 R474 K475 L476	L456-L472 HydrophobicContact CD1-CB 4.5Å; L456-L472 HydrophobicContact CD1-CD2 4.07Å; L456-L472 HydrophobicContact CD1-CG 3.99Å; H468-L472 WeakPolarHBondContact O-CB 3.47Å; H468-L472 PolarHBondContact O-N 3.14Å; A469-L472 PolarHBondContact O-N 2.9Å; L472-R474 VanDerWaalsContact C-N 3.33Å; L472-R474 PolarHBondContact O-N 3.49Å; L472-K475 CarbonylContact O-C 3.54Å; L472-K475 WeakPolarHBondContact O-CA 3.38Å; L472-K475 WeakPolarHBondContact O-CB 3.4Å; L472-K475 PolarHBondContact O-N 3.27Å; L472-L476 HydrophobicContact CD1-CD2 3.97Å; L472-L476 HydrophobicContact CD1-CG 4.17Å; L472-L476 HydrophobicContact CG-CG 4.4Å; L472-L476 WeakPolarHBondContact O-CG 3.33Å; L472-L476 PolarHBondContact O-N 3.24Å
473	R	87.4	Confident	84.2	Confident	90 Å²	90	82.7 Å²	82.7	34%	0.34	40%	0.403	S	S	.	.	H	α-helix	trans	-53.1	-48.4	176.2	-176.3	179.9	-176.7	-111.7	-0.8	111.7	L453 L456 D457 L463 A469 K475 L476 L477	L453-R473 HydrophobicContact CD1-CG 4.12Å; L456-R473 HydrophobicContact CD1-CB 4.22Å; D457-R473 IonicContact OD1-CZ 2.93Å; D457-R473 IonicContact OD1-NE 3.17Å; D457-R473 PolarHBondContact OD1-NE 2.95Å; D457-R473 IonicContact OD1-NH2 2.73Å; D457-R473 PolarHBondContact OD1-NH2 2.98Å; L463-R473 HydrophobicContact CD2-CB 4.03Å; L463-R473 HydrophobicContact CD2-CG 4.46Å; A469-R473 WeakPolarHBondContact O-CB 3.45Å; A469-R473 PolarHBondContact O-N 3.45Å; R473-K475 VanDerWaalsContact C-N 3.32Å; R473-K475 PolarHBondContact O-N 2.8Å; R473-L476 PolarHBondContact O-N 3.03Å; R473-L477 HydrophobicContact CG-CD1 3.99Å; R473-L477 HydrophobicContact CG-CG 4.48Å; R473-L477 WeakPolarHBondContact O-CB 3.37Å; R473-L477 WeakPolarHBondContact O-CG 3.37Å; R473-L477 PolarHBondContact O-N 2.79Å
474	R	87.9	Confident	83.9	Confident	180 Å²	180	88.2 Å²	88.2	68%	0.679	43%	0.428	S	S	*	.	H	α-helix	trans	-58.6	-41	174.6	-73.3	173.9	-179.2	-175.7	0.1	112.3	K470 L472 V478	K470-R474 WeakPolarHBondContact O-CB 3.49Å; K470-R474 VanDerWaalsContact O-CG 3.29Å; K470-R474 WeakPolarHBondContact O-CG 3.34Å; K470-R474 PolarHBondContact O-N 3.22Å; K470-R474 VanDerWaalsContact O-N 3.1Å; L472-R474 VanDerWaalsContact C-N 3.33Å; L472-R474 PolarHBondContact O-N 3.49Å; R474-V478 WeakPolarHBondContact O-CB 3.38Å; R474-V478 VanDerWaalsContact O-CG2 3.31Å; R474-V478 WeakPolarHBondContact O-CG2 3.23Å; R474-V478 PolarHBondContact O-N 3.21Å
475	K	87.8	Confident	83.9	Confident	125 Å²	125	91.9 Å²	91.9	54%	0.543	43%	0.429	S	S	.	.	H	α-helix	trans	-64.5	-42.5	176.6	-170.6	177.9	-178.8	-180	0	112.2	R471 L472 R473 R479	R471-K475 WeakPolarHBondContact O-CB 3.28Å; R471-K475 PolarHBondContact O-N 2.82Å; L472-K475 CarbonylContact O-C 3.54Å; L472-K475 WeakPolarHBondContact O-CA 3.38Å; L472-K475 WeakPolarHBondContact O-CB 3.4Å; L472-K475 PolarHBondContact O-N 3.27Å; R473-K475 VanDerWaalsContact C-N 3.32Å; R473-K475 PolarHBondContact O-N 2.8Å; K475-R479 WeakPolarHBondContact O-CG 3.24Å; K475-R479 PolarHBondContact O-N 2.8Å
476	L	88.1	Confident	83.6	Confident	4 Å²	4	89.5 Å²	89.5	2%	0.021	43%	0.428	C	S	.	.	H	α-helix	trans	-68.8	-41.3	177.4	-54.7	-168.3	0	0	0	111.4	E449 L452 L453 L456 L472 R473 R479 H480	E449-L476 HydrophobicContact CG-CD2 4.11Å; E449-L476 WeakPolarHBondContact OE1-CD2 3.02Å; L452-L476 HydrophobicContact CB-CD1 3.75Å; L453-L476 HydrophobicContact CB-CB 4.41Å; L453-L476 HydrophobicContact CB-CD1 4.17Å; L453-L476 HydrophobicContact CD1-CB 4.38Å; L456-L476 HydrophobicContact CD1-CD1 4.1Å; L472-L476 HydrophobicContact CD1-CD2 3.97Å; L472-L476 HydrophobicContact CD1-CG 4.17Å; L472-L476 HydrophobicContact CG-CG 4.4Å; L472-L476 WeakPolarHBondContact O-CG 3.33Å; L472-L476 PolarHBondContact O-N 3.24Å; R473-L476 PolarHBondContact O-N 3.03Å; L476-R479 PolarHBondContact O-N 3.37Å; L476-H480 WeakPolarHBondContact O-CB 3.34Å; L476-H480 PolarHBondContact O-N 3.28Å
477	L	87.5	Confident	83	Confident	67 Å²	67	90.9 Å²	90.9	35%	0.351	43%	0.433	S	S	.	.	H	α-helix	trans	-60.2	-45.5	174.1	-73.8	168.8	0	0	0	112	L453 R473 R479 H480 A481	L453-L477 HydrophobicContact CD1-CD2 3.99Å; L453-L477 HydrophobicContact CD1-CG 3.98Å; L453-L477 HydrophobicContact CD2-CD2 4.03Å; R473-L477 HydrophobicContact CG-CD1 3.99Å; R473-L477 HydrophobicContact CG-CG 4.48Å; R473-L477 WeakPolarHBondContact O-CB 3.37Å; R473-L477 WeakPolarHBondContact O-CG 3.37Å; R473-L477 PolarHBondContact O-N 2.79Å; L477-R479 VanDerWaalsContact C-N 3.34Å; L477-R479 PolarHBondContact O-N 3.31Å; L477-H480 PolarHBondContact O-N 2.73Å; L477-A481 WeakPolarHBondContact O-CB 2.96Å; L477-A481 PolarHBondContact O-N 3.47Å
478	V	86.6	Confident	82.6	Confident	85 Å²	85	91.9 Å²	91.9	52%	0.515	44%	0.439	S	S	.	.	H	α-helix	trans	-64.2	-37.3	175.6	169.5	0	0	0	0	111.7	R474 K482	R474-V478 WeakPolarHBondContact O-CB 3.38Å; R474-V478 VanDerWaalsContact O-CG2 3.31Å; R474-V478 WeakPolarHBondContact O-CG2 3.23Å; R474-V478 PolarHBondContact O-N 3.21Å; V478-K482 WeakPolarHBondContact O-CB 3.14Å; V478-K482 WeakPolarHBondContact O-CG 3.44Å; V478-K482 PolarHBondContact O-N 2.92Å
479	R	87.4	Confident	82.4	Confident	69 Å²	69	87.1 Å²	87.1	26%	0.26	42%	0.418	S	S	.	.	H	α-helix	trans	-68.2	-38.5	174	-79.4	-172.6	158.2	-173.9	-10.2	112.7	E449 K475 L476 L477 R483 L489	E449-R479 WeakPolarHBondContact OE1-CB 3.38Å; E449-R479 WeakPolarHBondContact OE1-CD 3.39Å; K475-R479 WeakPolarHBondContact O-CG 3.24Å; K475-R479 PolarHBondContact O-N 2.8Å; L476-R479 PolarHBondContact O-N 3.37Å; L477-R479 VanDerWaalsContact C-N 3.34Å; L477-R479 PolarHBondContact O-N 3.31Å; R479-R483 WeakPolarHBondContact O-CG 3.47Å; R479-R483 PolarHBondContact O-N 3.19Å; R479-L489 HydrophobicContact CB-CD1 4.28Å; R479-L489 HydrophobicContact CB-CD2 4.21Å; R479-L489 HydrophobicContact CG-CD1 3.96Å; R479-L489 HydrophobicContact CG-CD2 3.97Å
480	H	84.2	Confident	82	Confident	70 Å²	70	92.5 Å²	92.5	32%	0.324	45%	0.445	S	S	.	.	H	α-helix	trans	-63.1	-53.3	175.1	-174.9	71.4	0	0	0	110.8	L476 L477 K482 R483 Q484	L476-H480 WeakPolarHBondContact O-CB 3.34Å; L476-H480 PolarHBondContact O-N 3.28Å; L477-H480 PolarHBondContact O-N 2.73Å; H480-K482 VanDerWaalsContact C-N 3.33Å; H480-K482 PolarHBondContact O-N 2.69Å; H480-R483 PolarHBondContact O-N 3.43Å; H480-R483 VanDerWaalsContact O-N 3.11Å; H480-Q484 PolarHBondContact CD2-OE1 3.11Å; H480-Q484 VanDerWaalsContact CD2-OE1 3.24Å; H480-Q484 PolarHBondContact NE2-NE2 3.07Å; H480-Q484 WeakPolarHBondContact O-CG 3.45Å; H480-Q484 PolarHBondContact O-N 2.78Å
481	A	80.7	Confident	81.6	Confident	38 Å²	38	91.5 Å²	91.5	31%	0.314	44%	0.444	S	S	.	.	H	α-helix	trans	-59.3	-40.1	177.3	0	0	0	0	0	112.7	L477 Q484 R485	L477-A481 WeakPolarHBondContact O-CB 2.96Å; L477-A481 PolarHBondContact O-N 3.47Å; A481-Q484 PolarHBondContact O-N 2.66Å; A481-R485 WeakPolarHBondContact O-CG 3.49Å; A481-R485 PolarHBondContact O-N 3.01Å; A481-R485 VanDerWaalsContact O-N 3.11Å
482	K	81.9	Confident	80.9	Confident	77 Å²	77	88 Å²	88	34%	0.335	44%	0.437	S	S	.	.	H	α-helix	trans	-60.7	-46.7	173.1	-82.7	-166.8	170.5	-156.1	0	112.3	V478 H480 R485 G486 L487 L489	V478-K482 WeakPolarHBondContact O-CB 3.14Å; V478-K482 WeakPolarHBondContact O-CG 3.44Å; V478-K482 PolarHBondContact O-N 2.92Å; H480-K482 VanDerWaalsContact C-N 3.33Å; H480-K482 PolarHBondContact O-N 2.69Å; K482-R485 CarbonylContact O-C 3.6Å; K482-R485 PolarHBondContact O-N 3.22Å; K482-G486 PolarHBondContact O-N 2.9Å; K482-L487 HydrophobicContact CB-CB 4.11Å; K482-L487 HydrophobicContact CG-CB 4.14Å; K482-L487 HydrophobicContact CG-CD1 4.33Å; K482-L487 PolarHBondContact O-N 2.92Å; K482-L489 HydrophobicContact CB-CD2 3.63Å; K482-L489 HydrophobicContact CD-CD2 3.95Å; K482-L489 HydrophobicContact CG-CD2 4.41Å
483	R	80.9	Confident	80	Confident	94 Å²	94	90.6 Å²	90.6	36%	0.355	45%	0.452	S	S	.	.	H	α-helix	trans	-66.3	-35.8	177.7	-69.6	-161.1	-164	95.8	-11.1	113.1	L446 E449 R479 H480 R485 G486	L446-R483 VanDerWaalsContact CD2-CZ 3.42Å; L446-R483 VanDerWaalsContact CD2-NE 3.29Å; E449-R483 IonicContact OE2-CZ 3.14Å; E449-R483 IonicContact OE2-NH1 2.8Å; E449-R483 PolarHBondContact OE2-NH1 2.76Å; E449-R483 IonicContact OE2-NH2 2.69Å; E449-R483 PolarHBondContact OE2-NH2 2.8Å; R479-R483 WeakPolarHBondContact O-CG 3.47Å; R479-R483 PolarHBondContact O-N 3.19Å; H480-R483 PolarHBondContact O-N 3.43Å; H480-R483 VanDerWaalsContact O-N 3.11Å; R483-R485 VanDerWaalsContact C-N 3.26Å; R483-R485 PolarHBondContact O-N 3.31Å; R483-G486 PolarHBondContact O-N 3Å
484	Q	74.8	Confident	79.3	Confident	139 Å²	139	92.6 Å²	92.6	65%	0.65	46%	0.459	S	S	*	.	H	α-helix	trans	-60.7	-36.3	173.1	-73.5	174.2	-59.2	0	0	112	H480 A481 G486	H480-Q484 PolarHBondContact CD2-OE1 3.11Å; H480-Q484 VanDerWaalsContact CD2-OE1 3.24Å; H480-Q484 PolarHBondContact NE2-NE2 3.07Å; H480-Q484 WeakPolarHBondContact O-CG 3.45Å; H480-Q484 PolarHBondContact O-N 2.78Å; A481-Q484 PolarHBondContact O-N 2.66Å; Q484-G486 VanDerWaalsContact C-N 3.34Å
485	R	74.6	Confident	78.4	Confident	137 Å²	137	86.5 Å²	86.5	52%	0.517	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	16.3	176.2	-60.1	-176.2	-171.4	-151.4	3	114.2	A481 K482 R483 L487 H636 D637	A481-R485 WeakPolarHBondContact O-CG 3.49Å; A481-R485 PolarHBondContact O-N 3.01Å; A481-R485 VanDerWaalsContact O-N 3.11Å; K482-R485 CarbonylContact O-C 3.6Å; K482-R485 PolarHBondContact O-N 3.22Å; R483-R485 VanDerWaalsContact C-N 3.26Å; R483-R485 PolarHBondContact O-N 3.31Å; R485-L487 HydrophobicContact CB-CD1 4.21Å; R485-L487 HydrophobicContact CB-CG 4.05Å; R485-L487 PolarHBondContact O-N 2.84Å; R485-H636 PolarHBondContact O-CE1 2.85Å; R485-H636 VanDerWaalsContact O-CE1 3.29Å; R485-D637 IonicContact NH1-OD2 3.75Å; R485-D637 PolarHBondContact NH1-OD2 2.9Å; R485-D637 VanDerWaalsContact NH1-OD2 3.15Å
486	G	73.9	Confident	77.6	Confident	64 Å²	64	84.1 Å²	84.1	66%	0.66	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.1	4.4	-178.1	0	0	0	0	0	116.1	K482 R483 Q484	K482-G486 PolarHBondContact O-N 2.9Å; R483-G486 PolarHBondContact O-N 3Å; Q484-G486 VanDerWaalsContact C-N 3.34Å
487	L	73.6	Confident	76.7	Confident	86 Å²	86	87.1 Å²	87.1	45%	0.45	46%	0.464	S	S	.	.	P	Polyproline II helix	trans	-74.9	137	-171.7	-65.4	176.4	0	0	0	111.7	K482 R485 L489	K482-L487 HydrophobicContact CB-CB 4.11Å; K482-L487 HydrophobicContact CG-CB 4.14Å; K482-L487 HydrophobicContact CG-CD1 4.33Å; K482-L487 PolarHBondContact O-N 2.92Å; R485-L487 HydrophobicContact CB-CD1 4.21Å; R485-L487 HydrophobicContact CB-CG 4.05Å; R485-L487 PolarHBondContact O-N 2.84Å; L487-L489 PolarHBondContact O-N 3.21Å
488	P	75.1	Confident	75.7	Confident	106 Å²	106	85.8 Å²	85.8	69%	0.688	46%	0.463	S	S	*	.	P	Polyproline II helix	trans	-62.5	138.5	176.4	25.9	-33.8	0	0	0	111.3
489	L	79.6	Confident	74.9	Confident	44 Å²	44	84.1 Å²	84.1	23%	0.23	46%	0.458	C	S	.	.	P	Polyproline II helix	trans	-76.3	141	168.2	-58.6	-170.5	0	0	0	109.1	R479 K482 L487 D491	R479-L489 HydrophobicContact CB-CD1 4.28Å; R479-L489 HydrophobicContact CB-CD2 4.21Å; R479-L489 HydrophobicContact CG-CD1 3.96Å; R479-L489 HydrophobicContact CG-CD2 3.97Å; K482-L489 HydrophobicContact CB-CD2 3.63Å; K482-L489 HydrophobicContact CD-CD2 3.95Å; K482-L489 HydrophobicContact CG-CD2 4.41Å; L487-L489 PolarHBondContact O-N 3.21Å; L489-D491 PolarHBondContact O-N 3.22Å
490	L	73.4	Confident	74	Confident	127 Å²	127	86.3 Å²	86.3	67%	0.665	47%	0.474	S	S	*	.	P	Polyproline II helix	trans	-68.1	119.2	172	-178	63.8	0	0	0	108.6	I492	L490-I492 HydrophobicContact CD2-CG1 4.46Å; L490-I492 HydrophobicContact CG-CG1 4.3Å
491	D	74.9	Confident	73.2	Confident	70 Å²	70	87.8 Å²	87.8	37%	0.374	49%	0.492	S	S	.	.			trans	-120.7	105.5	176.7	176.6	-16.7	0	0	0	105.2	L489 D493 R494 A495	L489-D491 PolarHBondContact O-N 3.22Å; D491-D493 PolarHBondContact OD1-N 3.42Å; D491-R494 HydrophobicContact CB-CB 4.02Å; D491-R494 WeakPolarHBondContact OD1-CB 3.23Å; D491-R494 PolarHBondContact OD1-N 2.95Å; D491-R494 VanDerWaalsContact OD2-CB 3.29Å; D491-R494 WeakPolarHBondContact OD2-CB 3.41Å; D491-A495 VanDerWaalsContact O-CB 3.24Å; D491-A495 WeakPolarHBondContact O-CB 3.21Å; D491-A495 PolarHBondContact O-N 3.17Å
492	I	71.3	Confident	72.3	Confident	108 Å²	108	92.8 Å²	92.8	55%	0.554	51%	0.513	S	S	*	.	H	α-helix	trans	-72	-41.6	-172.2	-63.4	175.1	0	0	0	109.2	L490 R494 A495 V496	L490-I492 HydrophobicContact CD2-CG1 4.46Å; L490-I492 HydrophobicContact CG-CG1 4.3Å; I492-R494 PolarHBondContact O-N 3.29Å; I492-A495 PolarHBondContact O-N 3.5Å; I492-V496 HydrophobicContact CG2-CG2 4.08Å; I492-V496 WeakPolarHBondContact O-CB 3.36Å; I492-V496 VanDerWaalsContact O-CG2 3.3Å; I492-V496 WeakPolarHBondContact O-CG2 3.16Å; I492-V496 PolarHBondContact O-N 3.18Å
493	D	68.3	Low	71.1	Confident	123 Å²	123	93.4 Å²	93.4	66%	0.658	52%	0.523	S	S	*	.	H	α-helix	trans	-65.6	-40.9	-177.8	-51.3	-70.5	0	0	0	110.9	D491 S497	D491-D493 PolarHBondContact OD1-N 3.42Å; D493-S497 WeakPolarHBondContact O-CB 3.27Å; D493-S497 PolarHBondContact O-N 2.92Å; D493-S497 PolarHBondContact O-OG 2.91Å
494	R	72.1	Confident	69.5	Low	132 Å²	132	91.8 Å²	91.8	50%	0.498	54%	0.536	S	S	.	.	H	α-helix	trans	-68	-38.8	171.1	-179	175.6	162.6	-155.7	-9.2	113	D491 I492 A498 Y524	D491-R494 HydrophobicContact CB-CB 4.02Å; D491-R494 WeakPolarHBondContact OD1-CB 3.23Å; D491-R494 PolarHBondContact OD1-N 2.95Å; D491-R494 VanDerWaalsContact OD2-CB 3.29Å; D491-R494 WeakPolarHBondContact OD2-CB 3.41Å; I492-R494 PolarHBondContact O-N 3.29Å; R494-A498 VanDerWaalsContact O-CB 3.31Å; R494-A498 WeakPolarHBondContact O-CB 3.3Å; R494-A498 PolarHBondContact O-N 3.11Å; R494-Y524 PolarHBondContact NE-OH 3.45Å
495	A	70.3	Confident	68.2	Low	51 Å²	51	88.7 Å²	88.7	42%	0.421	54%	0.541	S	S	.	.	H	α-helix	trans	-66.6	-43.7	178	0	0	0	0	0	111.9	D491 I492 A498 A499	D491-A495 VanDerWaalsContact O-CB 3.24Å; D491-A495 WeakPolarHBondContact O-CB 3.21Å; D491-A495 PolarHBondContact O-N 3.17Å; I492-A495 PolarHBondContact O-N 3.5Å; A495-A498 PolarHBondContact O-N 3.3Å; A495-A499 WeakPolarHBondContact O-CB 3.44Å; A495-A499 PolarHBondContact O-N 3.12Å
496	V	69.6	Low	66.8	Low	75 Å²	75	88.1 Å²	88.1	46%	0.455	55%	0.547	S	S	.	.	H	α-helix	trans	-65.5	-44.7	174	170.8	0	0	0	0	110.4	I492 A498 A499 L500	I492-V496 HydrophobicContact CG2-CG2 4.08Å; I492-V496 WeakPolarHBondContact O-CB 3.36Å; I492-V496 VanDerWaalsContact O-CG2 3.3Å; I492-V496 WeakPolarHBondContact O-CG2 3.16Å; I492-V496 PolarHBondContact O-N 3.18Å; V496-A498 VanDerWaalsContact C-N 3.31Å; V496-A498 PolarHBondContact O-N 2.94Å; V496-A499 PolarHBondContact O-N 3.05Å; V496-A499 VanDerWaalsContact O-N 3.16Å; V496-L500 HydrophobicContact CG1-CD1 3.75Å; V496-L500 HydrophobicContact CG1-CG 4.17Å; V496-L500 WeakPolarHBondContact O-CB 3.39Å; V496-L500 VanDerWaalsContact O-CG 3.31Å; V496-L500 WeakPolarHBondContact O-CG 3.44Å; V496-L500 PolarHBondContact O-N 3.33Å
497	S	69.3	Low	64.8	Low	68 Å²	68	95 Å²	95	48%	0.476	55%	0.554	S	S	.	*	H	α-helix	trans	-60.2	-40.1	176.1	-61.4	0	0	0	0	112.3	D493 S501	D493-S497 WeakPolarHBondContact O-CB 3.27Å; D493-S497 PolarHBondContact O-N 2.92Å; D493-S497 PolarHBondContact O-OG 2.91Å; S497-S501 VanDerWaalsContact O-CB 3.31Å; S497-S501 WeakPolarHBondContact O-CB 3.33Å; S497-S501 PolarHBondContact O-N 2.89Å; S497-S501 PolarHBondContact O-OG 2.76Å
498	A	67.6	Low	62.8	Low	39 Å²	39	94.9 Å²	94.9	32%	0.322	57%	0.574	S	S	.	*	H	α-helix	trans	-67.4	-40.9	174.6	0	0	0	0	0	112.3	R494 A495 V496 S501 L502	R494-A498 VanDerWaalsContact O-CB 3.31Å; R494-A498 WeakPolarHBondContact O-CB 3.3Å; R494-A498 PolarHBondContact O-N 3.11Å; A495-A498 PolarHBondContact O-N 3.3Å; V496-A498 VanDerWaalsContact C-N 3.31Å; V496-A498 PolarHBondContact O-N 2.94Å; A498-S501 PolarHBondContact O-N 3.39Å; A498-L502 WeakPolarHBondContact O-CG 3.26Å; A498-L502 PolarHBondContact O-N 3.24Å; A498-L502 VanDerWaalsContact O-N 3.09Å
499	A	70.3	Confident	60.7	Low	50 Å²	50	96.6 Å²	96.6	41%	0.413	58%	0.583	S	S	.	*	H	α-helix	trans	-65.5	-44.5	176.1	0	0	0	0	0	112.2	A495 V496 S501 L502 V503	A495-A499 WeakPolarHBondContact O-CB 3.44Å; A495-A499 PolarHBondContact O-N 3.12Å; V496-A499 PolarHBondContact O-N 3.05Å; V496-A499 VanDerWaalsContact O-N 3.16Å; A499-S501 VanDerWaalsContact C-N 3.31Å; A499-S501 PolarHBondContact O-N 3.46Å; A499-L502 WeakPolarHBondContact O-CB 3.44Å; A499-L502 PolarHBondContact O-N 3.27Å; A499-L502 VanDerWaalsContact O-N 3.08Å; A499-V503 WeakPolarHBondContact O-CG2 3.42Å; A499-V503 PolarHBondContact O-N 3.41Å
500	L	68.3	Low	58.5	Low	115 Å²	115	103.7 Å²	103.7	60%	0.602	62%	0.615	S	S	*	*	H	α-helix	trans	-62.9	-38.4	174.6	-68.9	173	0	0	0	111.4	V496 L502 V503 G504	V496-L500 HydrophobicContact CG1-CD1 3.75Å; V496-L500 HydrophobicContact CG1-CG 4.17Å; V496-L500 WeakPolarHBondContact O-CB 3.39Å; V496-L500 VanDerWaalsContact O-CG 3.31Å; V496-L500 WeakPolarHBondContact O-CG 3.44Å; V496-L500 PolarHBondContact O-N 3.33Å; L500-L502 PolarHBondContact O-N 3.09Å; L500-V503 PolarHBondContact O-N 3.21Å; L500-G504 PolarHBondContact O-N 3Å
501	S	67.2	Low	56.3	Low	100 Å²	100	107.3 Å²	107.3	70%	0.699	63%	0.628	S	S	*	*	H	α-helix	trans	-65.2	-24.5	173.6	-58.9	0	0	0	0	113.5	S497 A498 A499	S497-S501 VanDerWaalsContact O-CB 3.31Å; S497-S501 WeakPolarHBondContact O-CB 3.33Å; S497-S501 PolarHBondContact O-N 2.89Å; S497-S501 PolarHBondContact O-OG 2.76Å; A498-S501 PolarHBondContact O-N 3.39Å; A499-S501 VanDerWaalsContact C-N 3.31Å; A499-S501 PolarHBondContact O-N 3.46Å
502	L	61.3	Low	54.1	Low	144 Å²	144	108.2 Å²	108.2	75%	0.754	65%	0.645	S	S	*	*	H	α-helix	trans	-84.4	-34.6	173.9	-76.8	161	0	0	0	112.4	A498 A499 L500	A498-L502 WeakPolarHBondContact O-CG 3.26Å; A498-L502 PolarHBondContact O-N 3.24Å; A498-L502 VanDerWaalsContact O-N 3.09Å; A499-L502 WeakPolarHBondContact O-CB 3.44Å; A499-L502 PolarHBondContact O-N 3.27Å; A499-L502 VanDerWaalsContact O-N 3.08Å; L500-L502 PolarHBondContact O-N 3.09Å
503	V	57.7	Low	51.8	Low	90 Å²	90	111.1 Å²	111.1	55%	0.545	66%	0.656	S	S	.	*	H	α-helix	trans	-79.8	-31.4	179.6	173.6	0	0	0	0	112.4	A499 L500 G505 I506	A499-V503 WeakPolarHBondContact O-CG2 3.42Å; A499-V503 PolarHBondContact O-N 3.41Å; L500-V503 PolarHBondContact O-N 3.21Å; V503-G505 PolarHBondContact O-N 3.18Å; V503-I506 PolarHBondContact O-N 3.01Å; V503-I506 VanDerWaalsContact O-N 3.1Å
504	G	46.9	Very low	50.1	Low	60 Å²	60	110.1 Å²	110.1	62%	0.619	66%	0.657	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.8	-6.3	-179.6	0	0	0	0	0	115.9	L500 I506	L500-G504 PolarHBondContact O-N 3Å; G504-I506 VanDerWaalsContact C-N 3.32Å
505	G	46.4	Very low	47.9	Very low	73 Å²	73	115.6 Å²	115.6	75%	0.753	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	-2.8	171.7	0	0	0	0	0	115.3	V503	V503-G505 PolarHBondContact O-N 3.18Å
506	I	46.3	Very low	45.9	Very low	125 Å²	125	118.9 Å²	118.9	64%	0.641	69%	0.694	S	S	*	*	S	Bend	trans	-104.3	-24.1	-170.3	-62.4	175.7	0	0	0	113.3	V503 G504	V503-I506 PolarHBondContact O-N 3.01Å; V503-I506 VanDerWaalsContact O-N 3.1Å; G504-I506 VanDerWaalsContact C-N 3.32Å
507	Y	32	Very low	44.3	Very low	209 Å²	209	122.7 Å²	122.7	82%	0.82	72%	0.718	S	S	*	*			trans	-123.9	100.6	176.4	-73.3	-83.1	0	0	0	111
508	G	30.4	Very low	42.3	Very low	84 Å²	84	122.8 Å²	122.8	87%	0.866	73%	0.729	S	S	*	*			trans	-91.2	119.2	172.6	0	0	0	0	0	111.5
509	T	31.1	Very low	40.7	Very low	142 Å²	142	125.1 Å²	125.1	87%	0.871	76%	0.757	S	S	*	*			trans	-122.5	140.1	159	40.8	0	0	0	0	108
510	Q	34	Very low	38.8	Very low	193 Å²	193	127.2 Å²	127.2	90%	0.902	78%	0.775	S	S	*	*			trans	-83.5	142.1	-176.2	-62.1	176.1	6.6	0	0	110.7
511	E	27.2	Very low	37.1	Very low	203 Å²	203	131.6 Å²	131.6	95%	0.949	79%	0.789	S	S	*	*			trans	-148.4	156.9	134.8	-113.7	165.5	-155.1	0	0	108
512	A	28.4	Very low	35.3	Very low	89 Å²	89	130.4 Å²	130.4	74%	0.736	79%	0.792	S	S	*	*			trans	-117.6	179.8	-163.2	0	0	0	0	0	113.2
513	E	23.6	Very low	33.8	Very low	168 Å²	168	132 Å²	132	79%	0.785	79%	0.793	S	S	*	*			trans	68.6	157	-178.2	-63	-59.8	108.9	0	0	115.5
514	P	32.2	Very low	32.3	Very low	103 Å²	103	135.3 Å²	135.3	67%	0.669	80%	0.797	S	S	*	*				-122.7	166.3	-69.3	28.1	-11.6	0	0	0	113.5	P516	P514-P516 WeakPolarHBondContact O-CD 3.45Å
515	R	26.8	Very low	31.5	Very low	246 Å²	246	138.3 Å²	138.3	93%	0.928	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-74.3	139.9	-179.7	-73.3	179.1	174.6	153.3	0.5	113.6
516	P	28.4	Very low	30.8	Very low	120 Å²	120	139.9 Å²	139.9	78%	0.779	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-91.3	157.5	137.1	-12.1	29.9	0	0	0	111.7	P514	P514-P516 WeakPolarHBondContact O-CD 3.45Å
517	V	34.3	Very low	30.1	Very low	156 Å²	156	136.7 Å²	136.7	95%	0.945	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-85.4	125.6	179.5	176.6	0	0	0	0	110.8
518	G	27	Very low	30.5	Very low	69 Å²	69	131.1 Å²	131.1	71%	0.711	78%	0.783	S	S	*	*			trans	-169.3	86.8	178.3	0	0	0	0	0	113.1	A520	G518-A520 PolarHBondContact O-N 2.66Å
519	G	35.3	Very low	31	Very low	88 Å²	88	133.9 Å²	133.9	91%	0.907	77%	0.773	S	S	*	*			trans	-81.1	92.9	-172.1	0	0	0	0	0	114.7
520	A	29.8	Very low	31.4	Very low	95 Å²	95	131.8 Å²	131.8	79%	0.785	75%	0.753	S	S	*	*			trans	-132.5	68	174.6	0	0	0	0	0	113.1	G518 G522	G518-A520 PolarHBondContact O-N 2.66Å; A520-G522 PolarHBondContact O-N 2.84Å
521	K	31.9	Very low	31.6	Very low	207 Å²	207	128.6 Å²	128.6	90%	0.9	74%	0.738	S	S	*	*			trans	-68.1	96.3	163.8	-90.5	-167.1	173.6	-174.7	0	109	K523	K521-K523 VanDerWaalsContact C-N 3.32Å; K521-K523 PolarHBondContact O-N 2.52Å
522	G	29.6	Very low	33	Very low	75 Å²	75	126.3 Å²	126.3	77%	0.773	72%	0.721	S	S	*	*			trans	-61	86.1	177.1	0	0	0	0	0	112.3	A520 Y524	A520-G522 PolarHBondContact O-N 2.84Å; G522-Y524 PolarHBondContact O-N 3.44Å
523	K	29.4	Very low	34.3	Very low	176 Å²	176	124.7 Å²	124.7	77%	0.765	70%	0.699	S	S	*	*			trans	-68	126.5	164.4	-65.7	-179	-178.8	177.9	0	107.7	K521 C525	K521-K523 VanDerWaalsContact C-N 3.32Å; K521-K523 PolarHBondContact O-N 2.52Å; K523-C525 VanDerWaalsContact C-N 3.33Å; K523-C525 PolarHBondContact O-N 3.17Å
524	Y	27.6	Very low	35.8	Very low	161 Å²	161	118.1 Å²	118.1	63%	0.631	67%	0.669	S	S	*	*			trans	-67	98.8	160	-70.8	-60.6	0	0	0	108	R494 G522 T526	R494-Y524 PolarHBondContact NE-OH 3.45Å; G522-Y524 PolarHBondContact O-N 3.44Å; Y524-T526 VanDerWaalsContact C-N 3.26Å; Y524-T526 PolarHBondContact O-N 3.34Å
525	C	29.3	Very low	37.1	Very low	122 Å²	122	117.1 Å²	117.1	82%	0.824	66%	0.659	S	S	*	*			trans	-77.1	77.2	176.7	-87.3	0	0	0	0	110.8	K523	K523-C525 VanDerWaalsContact C-N 3.33Å; K523-C525 PolarHBondContact O-N 3.17Å
526	T	32.2	Very low	38.6	Very low	106 Å²	106	110.6 Å²	110.6	65%	0.65	63%	0.634	S	S	*	*	S	Bend	trans	-83	162.9	141.6	54.7	0	0	0	0	108.9	Y524 S528	Y524-T526 VanDerWaalsContact C-N 3.26Å; Y524-T526 PolarHBondContact O-N 3.34Å; T526-S528 PolarHBondContact O-N 3.12Å; T526-S528 VanDerWaalsContact O-N 3.15Å
527	S	32.2	Very low	39.8	Very low	58 Å²	58	106.4 Å²	106.4	41%	0.406	60%	0.603	S	S	.	*			trans	-70.1	111.5	-164.5	-26.1	0	0	0	0	112.7	Q529 E530	S527-Q529 PolarHBondContact O-N 3.46Å; S527-E530 WeakPolarHBondContact CB-OE1 3.49Å; S527-E530 PolarHBondContact O-N 3.16Å; S527-E530 VanDerWaalsContact OG-CD 3.26Å; S527-E530 PolarHBondContact OG-OE1 2.92Å; S527-E530 PolarHBondContact OG-OE2 3.27Å
528	S	39.9	Very low	40.9	Very low	93 Å²	93	103.8 Å²	103.8	65%	0.65	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	10.3	-179.1	-177.8	0	0	0	0	115	T526 R532	T526-S528 PolarHBondContact O-N 3.12Å; T526-S528 VanDerWaalsContact O-N 3.15Å; S528-R532 PolarHBondContact O-NE 3.01Å; S528-R532 VanDerWaalsContact O-NE 3.08Å; S528-R532 PolarHBondContact O-NH2 3.02Å
529	Q	40.5	Very low	41.9	Very low	141 Å²	141	105 Å²	105	66%	0.659	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.1	-40.1	173.9	-86.1	179.5	-125.6	0	0	113.7	S527 Q531 R532	S527-Q529 PolarHBondContact O-N 3.46Å; Q529-Q531 PolarHBondContact O-N 2.91Å; Q529-R532 PolarHBondContact O-N 2.9Å
530	E	39.2	Very low	42.2	Very low	99 Å²	99	105 Å²	105	46%	0.463	56%	0.56	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.4	-48.8	-172.6	-72.2	144.4	-146.3	0	0	112.3	S527 R532 I533	S527-E530 WeakPolarHBondContact CB-OE1 3.49Å; S527-E530 PolarHBondContact O-N 3.16Å; S527-E530 VanDerWaalsContact OG-CD 3.26Å; S527-E530 PolarHBondContact OG-OE1 2.92Å; S527-E530 PolarHBondContact OG-OE2 3.27Å; E530-R532 PolarHBondContact O-N 3.09Å; E530-I533 PolarHBondContact O-N 3.04Å; E530-I533 VanDerWaalsContact O-N 3.12Å
531	Q	39.4	Very low	42.9	Very low	126 Å²	126	104.4 Å²	104.4	59%	0.589	55%	0.547	S	S	*	.	H	α-helix	trans	-56	-31.1	-178.7	-67.3	-178.1	-42.4	0	0	113.7	Q529 I533 L534 D535	Q529-Q531 PolarHBondContact O-N 2.91Å; Q531-I533 VanDerWaalsContact C-N 3.25Å; Q531-I533 PolarHBondContact O-N 2.98Å; Q531-L534 PolarHBondContact O-N 2.76Å; Q531-D535 PolarHBondContact O-N 3.07Å; Q531-D535 VanDerWaalsContact O-N 3.07Å
532	R	55.9	Low	43.1	Very low	155 Å²	155	98.8 Å²	98.8	59%	0.585	53%	0.534	S	S	*	.	H	α-helix	trans	-68.8	-17.9	-177.4	-86	-177.8	-79.3	163.3	-8.2	114.5	S528 Q529 E530	S528-R532 PolarHBondContact O-NE 3.01Å; S528-R532 VanDerWaalsContact O-NE 3.08Å; S528-R532 PolarHBondContact O-NH2 3.02Å; Q529-R532 PolarHBondContact O-N 2.9Å; E530-R532 PolarHBondContact O-N 3.09Å
533	I	56	Low	43.2	Very low	55 Å²	55	99.6 Å²	99.6	28%	0.282	53%	0.528	S	S	.	.	H	α-helix	trans	-75.4	-52	175.5	-55.8	-179.9	0	0	0	108.9	E530 Q531 D535 R536 F537 E647	E530-I533 PolarHBondContact O-N 3.04Å; E530-I533 VanDerWaalsContact O-N 3.12Å; Q531-I533 VanDerWaalsContact C-N 3.25Å; Q531-I533 PolarHBondContact O-N 2.98Å; I533-D535 PolarHBondContact O-N 2.9Å; I533-R536 WeakPolarHBondContact O-CB 3.38Å; I533-R536 PolarHBondContact O-N 2.59Å; I533-F537 HydrophobicContact CG2-CE2 4.02Å; I533-F537 WeakPolarHBondContact O-CD2 3.36Å; I533-E647 HydrophobicContact CD1-CG 4.45Å
534	L	54.2	Low	43.4	Very low	29 Å²	29	101.3 Å²	101.3	15%	0.152	53%	0.529	C	S	.	.	H	α-helix	trans	-61.9	-39.8	178.3	-65	178.1	0	0	0	112.7	Q531 R536 F537 Q538 I628 S646 L649	Q531-L534 PolarHBondContact O-N 2.76Å; L534-R536 PolarHBondContact O-N 2.95Å; L534-F537 PolarHBondContact O-N 3.43Å; L534-Q538 WeakPolarHBondContact O-CG 3.41Å; L534-Q538 PolarHBondContact O-N 3.45Å; L534-I628 HydrophobicContact CD2-CB 3.8Å; L534-I628 HydrophobicContact CD2-CG1 3.88Å; L534-I628 HydrophobicContact CD2-CG2 3.92Å; L534-S646 WeakPolarHBondContact CD2-OG 3.19Å; L534-S646 WeakPolarHBondContact CG-OG 3.37Å; L534-L649 HydrophobicContact CD2-CD1 3.74Å
535	D	59	Low	43.9	Very low	83 Å²	83	100.2 Å²	100.2	44%	0.444	54%	0.542	S	S	.	.	H	α-helix	trans	-54.6	-35.9	176.3	-70.3	-21.4	0	0	0	112.9	Q531 I533 F537 T539	Q531-D535 PolarHBondContact O-N 3.07Å; Q531-D535 VanDerWaalsContact O-N 3.07Å; I533-D535 PolarHBondContact O-N 2.9Å; D535-F537 VanDerWaalsContact C-N 3.29Å; D535-F537 PolarHBondContact O-N 3.44Å; D535-T539 WeakPolarHBondContact O-CB 3.49Å; D535-T539 VanDerWaalsContact O-CG2 3.3Å; D535-T539 WeakPolarHBondContact O-CG2 3.41Å; D535-T539 PolarHBondContact O-N 2.85Å; D535-T539 PolarHBondContact O-OG1 3Å
536	R	59.6	Low	44.2	Very low	109 Å²	109	98.1 Å²	98.1	41%	0.411	54%	0.541	S	S	.	.	H	α-helix	trans	-61.8	-37.3	177.3	-179.8	-176.4	173.7	-169.4	-4.1	111.8	D216 I533 L534 T539	D216-R536 IonicContact OD1-NH2 2.65Å; D216-R536 PolarHBondContact OD1-NH2 3.03Å; I533-R536 WeakPolarHBondContact O-CB 3.38Å; I533-R536 PolarHBondContact O-N 2.59Å; L534-R536 PolarHBondContact O-N 2.95Å; R536-T539 PolarHBondContact O-OG1 2.89Å
537	F	53.6	Low	44.3	Very low	31 Å²	31	98.7 Å²	98.7	14%	0.136	55%	0.545	C	S	.	.	H	α-helix	trans	-95.1	-24.3	-174.8	-57.3	-82.9	0	0	0	113.1	I533 L534 D535 S540 P572 P625 L649 Q650	I533-F537 HydrophobicContact CG2-CE2 4.02Å; I533-F537 WeakPolarHBondContact O-CD2 3.36Å; L534-F537 PolarHBondContact O-N 3.43Å; D535-F537 VanDerWaalsContact C-N 3.29Å; D535-F537 PolarHBondContact O-N 3.44Å; F537-S540 PolarHBondContact O-OG 3.32Å; F537-P572 HydrophobicContact CE1-CG 4.39Å; F537-P625 HydrophobicContact CB-CB 4.14Å; F537-P625 HydrophobicContact CB-CG 3.43Å; F537-P625 VanDerWaalsContact CB-CG 3.43Å; F537-L649 HydrophobicContact CB-CD1 4.03Å; F537-L649 HydrophobicContact CD1-CB 3.97Å; F537-L649 HydrophobicContact CD2-CB 3.74Å; F537-L649 HydrophobicContact CD2-CD1 3.41Å; F537-L649 VanDerWaalsContact CD2-CD1 3.41Å; F537-L649 HydrophobicContact CD2-CG 4.22Å; F537-L649 HydrophobicContact CE1-CB 3.82Å; F537-L649 WeakPolarHBondContact CE1-O 3.31Å; F537-L649 HydrophobicContact CE2-CB 3.58Å; F537-L649 HydrophobicContact CE2-CD1 3.97Å; F537-L649 HydrophobicContact CE2-CG 4.43Å; F537-L649 HydrophobicContact CG-CB 3.94Å; F537-L649 HydrophobicContact CG-CD1 3.81Å; F537-L649 HydrophobicContact CG-CG 4.45Å; F537-L649 HydrophobicContact CZ-CB 3.62Å; F537-Q650 HydrophobicContact CZ-CG 4.12Å
538	Q	57.5	Low	44.5	Very low	102 Å²	102	104.3 Å²	104.3	48%	0.477	56%	0.564	S	S	.	*	H	α-helix	trans	-77.2	-24.3	177.1	-70.2	-178.2	13.9	0	0	113.5	L534 S540 P625	L534-Q538 WeakPolarHBondContact O-CG 3.41Å; L534-Q538 PolarHBondContact O-N 3.45Å; Q538-S540 VanDerWaalsContact C-N 3.32Å; Q538-S540 PolarHBondContact O-N 2.84Å; Q538-P625 HydrophobicContact CG-CB 3.62Å
539	T	46.7	Very low	44.5	Very low	95 Å²	95	107.7 Å²	107.7	58%	0.583	57%	0.57	S	S	*	*	G	3₁₀ helix	trans	-77.7	-7.7	-174	39.7	0	0	0	0	115.2	D535 R536 S543	D535-T539 WeakPolarHBondContact O-CB 3.49Å; D535-T539 VanDerWaalsContact O-CG2 3.3Å; D535-T539 WeakPolarHBondContact O-CG2 3.41Å; D535-T539 PolarHBondContact O-N 2.85Å; D535-T539 PolarHBondContact O-OG1 3Å; R536-T539 PolarHBondContact O-OG1 2.89Å; T539-S543 PolarHBondContact O-OG 2.96Å
540	S	43.4	Very low	44.5	Very low	86 Å²	86	111.8 Å²	111.8	60%	0.601	58%	0.579	S	S	*	*	G	3₁₀ helix	trans	-76.6	-30.4	-174	57.2	0	0	0	0	114.9	F537 Q538 S542	F537-S540 PolarHBondContact O-OG 3.32Å; Q538-S540 VanDerWaalsContact C-N 3.32Å; Q538-S540 PolarHBondContact O-N 2.84Å; S540-S542 PolarHBondContact O-N 3.26Å
541	V	42.9	Very low	44.7	Very low	83 Å²	83	112.6 Å²	112.6	50%	0.503	60%	0.596	S	S	.	*	G	3₁₀ helix	trans	-88	6.8	-161.7	-164	0	0	0	0	114.2
542	S	37	Very low	45.3	Very low	89 Å²	89	110 Å²	110	62%	0.622	59%	0.588	S	S	*	*	G	3₁₀ helix	trans	-145	10.7	-176.9	-64.6	0	0	0	0	116.4	S540 R544	S540-S542 PolarHBondContact O-N 3.26Å; S542-R544 VanDerWaalsContact C-N 3.34Å; S542-R544 PolarHBondContact O-N 3.01Å; S542-R544 VanDerWaalsContact O-N 3.16Å
543	S	31.7	Very low	45.7	Very low	93 Å²	93	105.3 Å²	105.3	65%	0.65	58%	0.579	S	S	*	*			trans	-90.4	49.8	-175.4	-63.6	0	0	0	0	114.2	T539	T539-S543 PolarHBondContact O-OG 2.96Å
544	R	33.5	Very low	46.1	Very low	211 Å²	211	109.9 Å²	109.9	80%	0.796	60%	0.597	S	S	*	*			trans	-106.6	112.5	163.5	-79.2	-167.9	178.8	-165.4	0.9	109.6	S542 G546	S542-R544 VanDerWaalsContact C-N 3.34Å; S542-R544 PolarHBondContact O-N 3.01Å; S542-R544 VanDerWaalsContact O-N 3.16Å; R544-G546 PolarHBondContact O-N 3.4Å
545	P	37.6	Very low	46.4	Very low	138 Å²	138	116.8 Å²	116.8	90%	0.896	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.1	125.2	173.4	-18.9	31.6	0	0	0	110.4
546	G	36.2	Very low	46.5	Very low	79 Å²	79	116.5 Å²	116.5	81%	0.814	62%	0.617	S	S	*	*	T	Hydrogen-bonded Turn	trans	121.4	-25	173.6	0	0	0	0	0	115.7	R544 Q548	R544-G546 PolarHBondContact O-N 3.4Å; G546-Q548 PolarHBondContact O-N 3.33Å
547	V	35.3	Very low	46.5	Very low	118 Å²	118	119.9 Å²	119.9	72%	0.715	63%	0.63	S	S	*	*			trans	-82	109.7	173.3	-176.3	0	0	0	0	109	Q549	V547-Q549 PolarHBondContact O-N 2.98Å
548	Q	35.6	Very low	46.6	Very low	176 Å²	176	123.7 Å²	123.7	82%	0.822	65%	0.651	S	S	*	*			trans	-53.8	129.2	169	-73.6	177.3	-27.7	0	0	109.6	G546 R550	G546-Q548 PolarHBondContact O-N 3.33Å; Q548-R550 VanDerWaalsContact C-N 3.29Å; Q548-R550 PolarHBondContact O-N 3.28Å
549	Q	38.8	Very low	46.6	Very low	164 Å²	164	123.7 Å²	123.7	77%	0.766	65%	0.653	S	S	*	*			trans	-65.3	96.4	161.7	-78.4	-164.6	-14	0	0	108.2	V547 S551	V547-Q549 PolarHBondContact O-N 2.98Å; Q549-S551 PolarHBondContact O-N 2.81Å
550	R	40.6	Very low	47	Very low	226 Å²	226	120.9 Å²	120.9	85%	0.853	64%	0.642	S	S	*	*			trans	-47	129.2	162.1	-87.1	-177.2	163.6	-179.8	-4.7	107.4	Q548 V552	Q548-R550 VanDerWaalsContact C-N 3.29Å; Q548-R550 PolarHBondContact O-N 3.28Å; R550-V552 PolarHBondContact O-N 3.46Å
551	S	43.6	Very low	47.4	Very low	116 Å²	116	119.8 Å²	119.8	81%	0.811	64%	0.638	S	S	*	*			trans	-56.8	101.7	-175.8	50.2	0	0	0	0	110.4	Q549 S553	Q549-S551 PolarHBondContact O-N 2.81Å; S551-S553 PolarHBondContact O-N 2.9Å
552	V	52.8	Low	47.8	Very low	71 Å²	71	120.6 Å²	120.6	43%	0.43	64%	0.637	S	S	.	*			trans	-57.6	112.2	177.5	-89	0	0	0	0	108.8	R550 H556 R557	R550-V552 PolarHBondContact O-N 3.46Å; V552-H556 HydrophobicContact CB-CB 4.32Å; V552-H556 HydrophobicContact CG1-CB 4.39Å; V552-R557 PolarHBondContact O-NH2 3.19Å
553	S	63.7	Low	48.6	Very low	57 Å²	57	118.8 Å²	118.8	40%	0.399	63%	0.632	S	S	.	*			trans	-57.2	157.8	-175	66.7	0	0	0	0	110.7	S551 W555 H556 R557	S551-S553 PolarHBondContact O-N 2.9Å; S553-W555 PolarHBondContact O-N 3.11Å; S553-H556 PolarHBondContact O-N 2.9Å; S553-H556 PolarHBondContact OG-N 3.14Å; S553-H556 PolarHBondContact OG-ND1 3.38Å; S553-R557 PolarHBondContact O-N 2.82Å
554	F	65.7	Low	49.7	Very low	151 Å²	151	115.9 Å²	115.9	66%	0.662	62%	0.617	S	S	*	*	H	α-helix	trans	-53.4	-39.9	176.7	179.6	-102.1	0	0	0	111.5	R557 L558	F554-R557 WeakPolarHBondContact O-CB 3.5Å; F554-R557 PolarHBondContact O-N 3.23Å; F554-R557 VanDerWaalsContact O-N 3.15Å; F554-L558 HydrophobicContact CE1-CD2 3.99Å; F554-L558 HydrophobicContact CZ-CD2 4.43Å; F554-L558 WeakPolarHBondContact O-CB 3.3Å; F554-L558 PolarHBondContact O-N 3.36Å
555	W	59.2	Low	51	Low	174 Å²	174	107.1 Å²	107.1	66%	0.659	59%	0.586	S	S	*	*	H	α-helix	trans	-58.2	-48.2	171.8	-92	110	0	0	0	113.9	S553 R557 L558 M559	S553-W555 PolarHBondContact O-N 3.11Å; W555-R557 PolarHBondContact O-N 2.92Å; W555-L558 PolarHBondContact O-N 2.89Å; W555-M559 HydrophobicContact CE3-CG 3.52Å; W555-M559 HydrophobicContact CE3-SD 4.45Å; W555-M559 HydrophobicContact CZ3-CG 3.67Å; W555-M559 HydrophobicContact CZ3-SD 4Å; W555-M559 WeakPolarHBondContact O-CB 3.39Å; W555-M559 PolarHBondContact O-N 3.17Å
556	H	61.5	Low	52.5	Low	77 Å²	77	105.3 Å²	105.3	36%	0.356	57%	0.568	S	S	.	*	H	α-helix	trans	-65.3	-25.3	175	-84.5	43.5	0	0	0	113.3	V552 S553 G560 A561	V552-H556 HydrophobicContact CB-CB 4.32Å; V552-H556 HydrophobicContact CG1-CB 4.39Å; S553-H556 PolarHBondContact O-N 2.9Å; S553-H556 PolarHBondContact OG-N 3.14Å; S553-H556 PolarHBondContact OG-ND1 3.38Å; H556-G560 CarbonylContact O-C 3.58Å; H556-G560 WeakPolarHBondContact O-CA 3.44Å; H556-G560 PolarHBondContact O-N 2.96Å; H556-G560 VanDerWaalsContact O-N 3.13Å; H556-A561 PolarHBondContact O-N 2.88Å
557	R	60.4	Low	54.4	Low	181 Å²	181	106 Å²	106	68%	0.683	55%	0.55	S	S	*	*	H	α-helix	trans	-81.6	-32.6	177	-153.5	175.2	-53.9	177.6	7.6	112.6	V552 S553 F554 W555	V552-R557 PolarHBondContact O-NH2 3.19Å; S553-R557 PolarHBondContact O-N 2.82Å; F554-R557 WeakPolarHBondContact O-CB 3.5Å; F554-R557 PolarHBondContact O-N 3.23Å; F554-R557 VanDerWaalsContact O-N 3.15Å; W555-R557 PolarHBondContact O-N 2.92Å
558	L	55	Low	56.8	Low	110 Å²	110	105 Å²	105	58%	0.576	54%	0.541	S	S	*	.	H	α-helix	trans	-80.8	-39.7	178.2	-174	65.6	0	0	0	112.2	F554 W555	F554-L558 HydrophobicContact CE1-CD2 3.99Å; F554-L558 HydrophobicContact CZ-CD2 4.43Å; F554-L558 WeakPolarHBondContact O-CB 3.3Å; F554-L558 PolarHBondContact O-N 3.36Å; W555-L558 PolarHBondContact O-N 2.89Å
559	M	57.3	Low	59.3	Low	103 Å²	103	98.3 Å²	98.3	51%	0.507	51%	0.511	S	S	.	.	S	Bend	trans	-95.8	-3.6	-179	-62.8	-66	-77	0	0	113.8	W555 K662	W555-M559 HydrophobicContact CE3-CG 3.52Å; W555-M559 HydrophobicContact CE3-SD 4.45Å; W555-M559 HydrophobicContact CZ3-CG 3.67Å; W555-M559 HydrophobicContact CZ3-SD 4Å; W555-M559 WeakPolarHBondContact O-CB 3.39Å; W555-M559 PolarHBondContact O-N 3.17Å; M559-K662 WeakPolarHBondContact O-CD 3.49Å; M559-K662 PolarHBondContact O-NZ 2.88Å
560	G	54.5	Low	61.7	Low	35 Å²	35	97.4 Å²	97.4	36%	0.361	50%	0.504	S	S	.	.			trans	72.1	146.1	-168.3	0	0	0	0	0	112.9	H556 E562 K662	H556-G560 CarbonylContact O-C 3.58Å; H556-G560 WeakPolarHBondContact O-CA 3.44Å; H556-G560 PolarHBondContact O-N 2.96Å; H556-G560 VanDerWaalsContact O-N 3.13Å; G560-E562 PolarHBondContact O-N 3.11Å; G560-K662 PolarHBondContact O-NZ 3.41Å
561	A	53.2	Low	64	Low	63 Å²	63	86.8 Å²	86.8	52%	0.521	46%	0.464	S	S	.	.			trans	-66.8	131.8	-176.8	0	0	0	0	0	112.2	H556	H556-A561 PolarHBondContact O-N 2.88Å
562	E	50.9	Low	66.2	Low	101 Å²	101	84.1 Å²	84.1	47%	0.472	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-56.1	-53.3	-177.6	-59.5	-58	134.6	0	0	112.8	G560 G564 L565 K662	G560-E562 PolarHBondContact O-N 3.11Å; E562-G564 PolarHBondContact O-N 3.19Å; E562-L565 PolarHBondContact O-N 3.44Å; E562-K662 VanDerWaalsContact CD-NZ 3.35Å; E562-K662 IonicContact OE1-NZ 3.42Å; E562-K662 PolarHBondContact OE1-NZ 3.14Å; E562-K662 IonicContact OE2-NZ 3.57Å
563	G	52.6	Low	67.8	Low	50 Å²	50	85.8 Å²	85.8	52%	0.515	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-69.6	15.9	-166.5	0	0	0	0	0	117.1	Q567	G563-Q567 PolarHBondContact O-NE2 3.29Å
564	G	56.4	Low	69	Low	33 Å²	33	85 Å²	85	34%	0.34	44%	0.437	S	S	.	.	G	3₁₀ helix	trans	-91.8	-15.9	174.4	0	0	0	0	0	114.8	E562 R624	E562-G564 PolarHBondContact O-N 3.19Å; G564-R624 PolarHBondContact O-NH1 3.37Å
565	L	60.8	Low	70.2	Confident	26 Å²	26	80.6 Å²	80.6	14%	0.136	43%	0.428	C	S	.	.	S	Bend	trans	-89.1	-44.7	-175.9	-82.3	158.8	0	0	0	113.1	E562 Q567 P580 R624 L659	E562-L565 PolarHBondContact O-N 3.44Å; L565-Q567 PolarHBondContact O-N 2.85Å; L565-Q567 VanDerWaalsContact O-N 3.16Å; L565-P580 WeakPolarHBondContact O-CB 3.46Å; L565-R624 PolarHBondContact O-NH1 3.42Å; L565-R624 PolarHBondContact O-NH2 2.89Å; L565-L659 HydrophobicContact CD2-CD1 3.68Å
566	D	67.4	Low	71.6	Confident	100 Å²	100	80.4 Å²	80.4	54%	0.535	43%	0.427	S	S	.	.	S	Bend	trans	-76.3	-1.3	-174.8	-52.9	-64.6	0	0	0	114.5	F581	D566-F581 WeakPolarHBondContact OD1-CE2 3.37Å
567	Q	77.4	Confident	73.1	Confident	93 Å²	93	82.6 Å²	82.6	44%	0.435	44%	0.44	S	S	.	.	S	Bend	trans	-78.1	135	176.2	-62.4	-174.4	36.6	0	0	111.9	G563 L565 R624	G563-Q567 PolarHBondContact O-NE2 3.29Å; L565-Q567 PolarHBondContact O-N 2.85Å; L565-Q567 VanDerWaalsContact O-N 3.16Å; Q567-R624 PolarHBondContact O-NH1 3.33Å; Q567-R624 PolarHBondContact O-NH2 2.87Å
568	N	86.3	Confident	74.6	Confident	99 Å²	99	74.6 Å²	74.6	53%	0.529	41%	0.411	S	S	.	.			trans	-61.3	149.4	165.3	-66.2	2.9	0	0	0	110.8	I577 L578 P580	N568-I577 HydrophobicContact CB-CG2 3.87Å; N568-L578 CarbonylContact C-O 3.56Å; N568-L578 VanDerWaalsContact CA-O 3.23Å; N568-L578 WeakPolarHBondContact CA-O 3.4Å; N568-L578 WeakPolarHBondContact CB-O 3.37Å; N568-P580 VanDerWaalsContact OD1-CD 3.3Å; N568-P580 WeakPolarHBondContact OD1-CD 3.39Å
569	I	87.9	Confident	76.3	Confident	34 Å²	34	76.7 Å²	76.7	17%	0.174	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	133.9	177.2	-51.5	169.1	0	0	0	108.5	L578 R624	I569-L578 HydrophobicContact CB-CB 4.37Å; I569-L578 PolarHBondContact N-O 2.81Å; I569-L578 WeakPolarHBondContact O-CB 3.47Å; I569-L578 PolarHBondContact O-N 2.94Å; I569-R624 HydrophobicContact CD1-CG 3.66Å
570	K	87.8	Confident	77.7	Confident	145 Å²	145	73 Å²	73	63%	0.63	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.7	124.5	165	-168.5	-178	-179.8	-176.5	0	109.3	A575 R576	K570-A575 WeakPolarHBondContact CE-O 3.44Å; K570-R576 WeakPolarHBondContact CA-O 3Å
571	S	90.1	Very high	79.5	Confident	3 Å²	3	72.7 Å²	72.7	2%	0.021	39%	0.388	C	S	.	.			trans	-66.7	132.8	175.2	175.9	0	0	0	0	111.4	Y573 T574 A575 R576 D653	S571-Y573 VanDerWaalsContact C-N 3.29Å; S571-Y573 PolarHBondContact OG-N 2.97Å; S571-Y573 VanDerWaalsContact OG-N 3.12Å; S571-T574 WeakPolarHBondContact CB-OG1 3.43Å; S571-T574 PolarHBondContact OG-N 3.14Å; S571-T574 PolarHBondContact OG-OG1 3.43Å; S571-A575 VanDerWaalsContact O-CA 3.25Å; S571-A575 WeakPolarHBondContact O-CA 3.29Å; S571-A575 PolarHBondContact O-N 3.32Å; S571-R576 PolarHBondContact N-O 3.26Å; S571-D653 WeakPolarHBondContact CB-OD1 3.45Å; S571-D653 WeakPolarHBondContact CB-OD2 3.3Å; S571-D653 PolarHBondContact OG-OD2 2.8Å
572	P	88.6	Confident	81.5	Confident	61 Å²	61	71.7 Å²	71.7	40%	0.396	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-23.5	169	-18.2	32.1	0	0	0	113.9	F537	F537-P572 HydrophobicContact CE1-CG 4.39Å
573	Y	87.6	Confident	83.6	Confident	106 Å²	106	71.2 Å²	71.2	42%	0.416	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-50.4	-175.4	-172.8	-97.2	0	0	0	112.7	S571 Q650 F654 P672 D673	S571-Y573 VanDerWaalsContact C-N 3.29Å; S571-Y573 PolarHBondContact OG-N 2.97Å; S571-Y573 VanDerWaalsContact OG-N 3.12Å; Y573-Q650 WeakPolarHBondContact CB-O 3.47Å; Y573-Q650 PolarHBondContact N-O 3.04Å; Y573-F654 AromaticContact CD1-CE2 3.76Å; Y573-F654 HydrophobicContact CD1-CE2 3.76Å; Y573-F654 HydrophobicContact CE1-CE2 4.01Å; Y573-F654 HydrophobicContact CE1-CZ 4.44Å; Y573-P672 HydrophobicContact CE1-CB 4.44Å; Y573-P672 HydrophobicContact CE1-CG 3.93Å; Y573-D673 PolarHBondContact OH-OD2 3.38Å
574	T	89.4	Confident	85.6	Confident	40 Å²	40	74.1 Å²	74.1	25%	0.245	36%	0.363	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.9	-8.6	-176.3	67.9	0	0	0	0	113.6	S571 R576 D653 F654	S571-T574 WeakPolarHBondContact CB-OG1 3.43Å; S571-T574 PolarHBondContact OG-N 3.14Å; S571-T574 PolarHBondContact OG-OG1 3.43Å; T574-R576 PolarHBondContact O-N 2.86Å; T574-R576 VanDerWaalsContact OG1-CB 3.27Å; T574-R576 WeakPolarHBondContact OG1-CB 3.44Å; T574-R576 WeakPolarHBondContact OG1-CG 3.5Å; T574-R576 PolarHBondContact OG1-N 2.81Å; T574-R576 VanDerWaalsContact OG1-N 3.09Å; T574-D653 HydrophobicContact CG2-CB 4.35Å; T574-D653 VanDerWaalsContact CG2-CG 3.47Å; T574-D653 WeakPolarHBondContact CG2-OD1 3.3Å; T574-D653 WeakPolarHBondContact CG2-OD2 3.44Å; T574-D653 PolarHBondContact OG1-OD1 3.41Å; T574-D653 PolarHBondContact OG1-OD2 2.69Å; T574-F654 HydrophobicContact CG2-CE2 3.89Å; T574-F654 HydrophobicContact CG2-CZ 4.21Å
575	A	89.6	Confident	87.4	Confident	58 Å²	58	72.8 Å²	72.8	48%	0.479	35%	0.348	S	S	.	.			trans	56.8	3.6	-165.3	0	0	0	0	0	115.9	K570 S571	K570-A575 WeakPolarHBondContact CE-O 3.44Å; S571-A575 VanDerWaalsContact O-CA 3.25Å; S571-A575 WeakPolarHBondContact O-CA 3.29Å; S571-A575 PolarHBondContact O-N 3.32Å
576	R	89.6	Confident	88.9	Confident	170 Å²	170	77.3 Å²	77.3	64%	0.642	37%	0.367	S	S	*	.			trans	-68.3	152.3	-178.4	-66.2	173.5	176.3	-172.1	-2.8	111.8	K570 S571 T574	K570-R576 WeakPolarHBondContact CA-O 3Å; S571-R576 PolarHBondContact N-O 3.26Å; T574-R576 PolarHBondContact O-N 2.86Å; T574-R576 VanDerWaalsContact OG1-CB 3.27Å; T574-R576 WeakPolarHBondContact OG1-CB 3.44Å; T574-R576 WeakPolarHBondContact OG1-CG 3.5Å; T574-R576 PolarHBondContact OG1-N 2.81Å; T574-R576 VanDerWaalsContact OG1-N 3.09Å
577	I	91.5	Very high	90.1	Very high	124 Å²	124	79.8 Å²	79.8	64%	0.636	38%	0.375	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.9	107.9	171.7	-58.1	178.1	0	0	0	108.3	N568	N568-I577 HydrophobicContact CB-CG2 3.87Å
578	L	91.8	Very high	90.7	Very high	12 Å²	12	76.4 Å²	76.4	6%	0.063	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	130.2	178.6	-59.2	177	0	0	0	110.2	N568 I569 Y622 P652 D653	N568-L578 CarbonylContact C-O 3.56Å; N568-L578 VanDerWaalsContact CA-O 3.23Å; N568-L578 WeakPolarHBondContact CA-O 3.4Å; N568-L578 WeakPolarHBondContact CB-O 3.37Å; I569-L578 HydrophobicContact CB-CB 4.37Å; I569-L578 PolarHBondContact N-O 2.81Å; I569-L578 WeakPolarHBondContact O-CB 3.47Å; I569-L578 PolarHBondContact O-N 2.94Å; L578-Y622 HydrophobicContact CB-CD2 3.69Å; L578-Y622 HydrophobicContact CB-CE2 3.76Å; L578-Y622 HydrophobicContact CB-CG 4.34Å; L578-Y622 HydrophobicContact CD1-CD1 4.06Å; L578-Y622 HydrophobicContact CD1-CD2 4.07Å; L578-Y622 HydrophobicContact CD1-CE1 4.44Å; L578-Y622 HydrophobicContact CD1-CE2 4.46Å; L578-Y622 HydrophobicContact CD1-CG 3.84Å; L578-Y622 HydrophobicContact CD2-CD2 4.45Å; L578-Y622 HydrophobicContact CD2-CE1 4.15Å; L578-Y622 HydrophobicContact CD2-CE2 4.03Å; L578-Y622 HydrophobicContact CG-CD2 4.28Å; L578-Y622 HydrophobicContact CG-CE2 4.29Å; L578-P652 HydrophobicContact CD1-CB 4.16Å; L578-P652 HydrophobicContact CD1-CG 4.03Å; L578-D653 HydrophobicContact CD1-CB 4.48Å; L578-D653 HydrophobicContact CD2-CB 4.31Å
579	K	91.1	Very high	90.9	Very high	154 Å²	154	75.7 Å²	75.7	67%	0.67	35%	0.351	S	S	*	.			trans	-61.7	154.6	171.4	-71	-177	178.7	-179.9	0	110.6	F581 Y622	K579-F581 VanDerWaalsContact C-N 3.26Å; K579-F581 PolarHBondContact O-N 3.03Å; K579-Y622 WeakPolarHBondContact O-CD2 3.46Å
580	P	87.1	Confident	91.1	Very high	25 Å²	25	74.1 Å²	74.1	16%	0.162	34%	0.343	C	S	.	.	S	Bend	trans	-62.8	-34.2	-174.6	22.4	-34.1	0	0	0	113.6	L565 N568 C621 R624	L565-P580 WeakPolarHBondContact O-CB 3.46Å; N568-P580 VanDerWaalsContact OD1-CD 3.3Å; N568-P580 WeakPolarHBondContact OD1-CD 3.39Å; P580-C621 WeakPolarHBondContact O-CB 3.42Å; P580-R624 VanDerWaalsContact CA-NH2 3.26Å; P580-R624 PolarHBondContact O-NH2 3.38Å
581	F	93.1	Very high	91.3	Very high	30 Å²	30	71.3 Å²	71.3	13%	0.132	34%	0.335	C	S	.	.			trans	-121.5	145	176.2	-51.4	-80.7	0	0	0	110	D566 K579 R584 D619 Y620	D566-F581 WeakPolarHBondContact OD1-CE2 3.37Å; K579-F581 VanDerWaalsContact C-N 3.26Å; K579-F581 PolarHBondContact O-N 3.03Å; F581-R584 HydrophobicContact CB-CG 4.05Å; F581-R584 HydrophobicContact CD1-CG 4.17Å; F581-R584 HydrophobicContact CD2-CG 4.35Å; F581-R584 HydrophobicContact CG-CG 3.92Å; F581-R584 VanDerWaalsContact CZ-CZ 3.5Å; F581-D619 HydrophobicContact CD1-CB 3.92Å; F581-D619 HydrophobicContact CE1-CB 3.93Å; F581-Y620 CarbonylContact C-O 3.59Å; F581-Y620 WeakPolarHBondContact CA-O 3.42Å
582	I	94.9	Very high	91.5	Very high	41 Å²	41	73.8 Å²	73.8	21%	0.21	35%	0.345	C	S	.	.	S	Bend	trans	-82.4	-46.5	167.8	-59.1	157.7	0	0	0	108.9	Y620 Y622 V656 F698 H702	I582-Y620 PolarHBondContact N-O 3.04Å; I582-Y622 HydrophobicContact CD1-CD1 3.91Å; I582-Y622 HydrophobicContact CD1-CD2 4.44Å; I582-Y622 HydrophobicContact CD1-CE1 3.91Å; I582-Y622 HydrophobicContact CD1-CE2 4.43Å; I582-Y622 HydrophobicContact CD1-CG 4.21Å; I582-Y622 HydrophobicContact CG1-CD1 4.09Å; I582-Y622 HydrophobicContact CG1-CD2 3.94Å; I582-Y622 HydrophobicContact CG1-CE1 3.77Å; I582-Y622 HydrophobicContact CG1-CE2 3.58Å; I582-Y622 HydrophobicContact CG1-CG 4.2Å; I582-V656 HydrophobicContact CD1-CB 4Å; I582-V656 HydrophobicContact CD1-CG2 3.83Å; I582-F698 HydrophobicContact CG2-CE1 4.09Å; I582-F698 HydrophobicContact CG2-CZ 4.01Å; I582-H702 WeakPolarHBondContact CG2-ND1 3.26Å
583	R	94.8	Very high	91.6	Very high	92 Å²	92	71 Å²	71	35%	0.347	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	146.7	175.3	175.6	175.7	179	174.8	0.6	108.5	E587 Y620 F698	R583-E587 IonicContact NH2-OE2 2.61Å; R583-Y620 HydrophobicContact CB-CD2 4.02Å; R583-Y620 HydrophobicContact CG-CD2 4.24Å; R583-Y620 PolarHBondContact N-O 3.48Å; R583-Y620 PolarHBondContact O-N 2.83Å; R583-F698 HydrophobicContact CB-CE1 3.83Å; R583-F698 HydrophobicContact CB-CE2 4.26Å; R583-F698 HydrophobicContact CB-CZ 3.51Å; R583-F698 HydrophobicContact CG-CZ 4.23Å
584	R	94.4	Very high	91.8	Very high	110 Å²	110	73 Å²	73	42%	0.415	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	133.5	161.3	-49.3	-170.3	83.6	156.7	11	107.1	F581 F586 P617 D619	F581-R584 HydrophobicContact CB-CG 4.05Å; F581-R584 HydrophobicContact CD1-CG 4.17Å; F581-R584 HydrophobicContact CD2-CG 4.35Å; F581-R584 HydrophobicContact CG-CG 3.92Å; F581-R584 VanDerWaalsContact CZ-CZ 3.5Å; R584-F586 HydrophobicContact CB-CE2 3.92Å; R584-P617 HydrophobicContact CB-CB 4.31Å; R584-D619 WeakPolarHBondContact CB-OD1 3.45Å; R584-D619 VanDerWaalsContact CG-OD1 3.3Å; R584-D619 WeakPolarHBondContact CG-OD1 3.27Å; R584-D619 IonicContact CZ-OD1 3.91Å; R584-D619 IonicContact CZ-OD2 3.84Å; R584-D619 IonicContact NE-OD1 3.7Å; R584-D619 PolarHBondContact NE-OD1 3.15Å; R584-D619 IonicContact NE-OD2 2.73Å; R584-D619 IonicContact NH2-OD1 2.92Å; R584-D619 PolarHBondContact NH2-OD1 3.41Å; R584-D619 IonicContact NH2-OD2 2.85Å; R584-D619 PolarHBondContact NH2-OD2 2.96Å
585	D	93.9	Very high	92	Very high	5 Å²	5	74.4 Å²	74.4	3%	0.027	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	109.6	-171.2	174.8	-2.3	0	0	0	109.9	E587 S588 P617 I618 Y620	D585-E587 PolarHBondContact OD1-N 2.8Å; D585-S588 PolarHBondContact OD1-N 3.45Å; D585-S588 PolarHBondContact OD1-OG 2.97Å; D585-S588 VanDerWaalsContact OD2-CB 3.23Å; D585-S588 WeakPolarHBondContact OD2-CB 3.4Å; D585-S588 PolarHBondContact OD2-OG 2.65Å; D585-P617 CarbonylContact O-C 3.57Å; D585-P617 VanDerWaalsContact O-CA 3.26Å; D585-P617 WeakPolarHBondContact O-CA 3.45Å; D585-I618 HydrophobicContact CB-CB 4.32Å; D585-I618 WeakPolarHBondContact CB-O 3.25Å; D585-I618 PolarHBondContact N-O 3.3Å; D585-I618 PolarHBondContact O-N 3.1Å; D585-Y620 HydrophobicContact CB-CD2 4.4Å; D585-Y620 HydrophobicContact CB-CE2 3.7Å
586	F	92.8	Very high	92	Very high	122 Å²	122	74.4 Å²	74.4	54%	0.535	33%	0.331	S	S	.	.	S	Bend	trans	-99	-1.3	-179.8	-63.1	-94.5	0	0	0	112.5	R584 R589 P617	R584-F586 HydrophobicContact CB-CE2 3.92Å; F586-R589 PolarHBondContact O-NH1 3.36Å; F586-R589 PolarHBondContact O-NH2 3.14Å; F586-P617 HydrophobicContact CD1-CB 3.88Å; F586-P617 HydrophobicContact CD1-CG 4.35Å; F586-P617 HydrophobicContact CD2-CB 4.2Å; F586-P617 HydrophobicContact CE1-CB 3.73Å; F586-P617 HydrophobicContact CE1-CG 3.74Å; F586-P617 HydrophobicContact CE2-CB 4.05Å; F586-P617 HydrophobicContact CE2-CG 4.47Å; F586-P617 HydrophobicContact CG-CB 4.13Å; F586-P617 HydrophobicContact CZ-CB 3.81Å; F586-P617 HydrophobicContact CZ-CG 3.8Å
587	E	91.9	Very high	92.1	Very high	152 Å²	152	68.3 Å²	68.3	71%	0.71	32%	0.317	S	S	*	.	S	Bend	trans	-99.3	-41.8	-172.7	-67.3	153.7	-156.1	0	0	111.4	R583 D585 R589	R583-E587 IonicContact NH2-OE2 2.61Å; D585-E587 PolarHBondContact OD1-N 2.8Å; E587-R589 VanDerWaalsContact C-NH1 3.3Å; E587-R589 PolarHBondContact O-N 3.14Å; E587-R589 PolarHBondContact O-NH1 3.09Å; E587-R589 VanDerWaalsContact O-NH1 3.16Å
588	S	90.7	Very high	92.1	Very high	21 Å²	21	68 Å²	68	15%	0.147	31%	0.313	C	S	.	.			trans	-59.3	121.3	-176.1	-76.2	0	0	0	0	112.3	D585 P590 A693	D585-S588 PolarHBondContact OD1-N 3.45Å; D585-S588 PolarHBondContact OD1-OG 2.97Å; D585-S588 VanDerWaalsContact OD2-CB 3.23Å; D585-S588 WeakPolarHBondContact OD2-CB 3.4Å; D585-S588 PolarHBondContact OD2-OG 2.65Å; S588-P590 VanDerWaalsContact C-CD 3.49Å; S588-P590 WeakPolarHBondContact O-CD 3.38Å; S588-A693 PolarHBondContact OG-O 3.48Å
589	R	89.9	Confident	92.2	Very high	84 Å²	84	72.3 Å²	72.3	32%	0.317	34%	0.335	S	S	.	.			trans	-118.7	80.6	171.3	-65.8	-59.9	176.5	-66.1	-8.5	111.2	F586 E587 R594 D615	F586-R589 PolarHBondContact O-NH1 3.36Å; F586-R589 PolarHBondContact O-NH2 3.14Å; E587-R589 VanDerWaalsContact C-NH1 3.3Å; E587-R589 PolarHBondContact O-N 3.14Å; E587-R589 PolarHBondContact O-NH1 3.09Å; E587-R589 VanDerWaalsContact O-NH1 3.16Å; R589-R594 HydrophobicContact CB-CG 4.32Å; R589-R594 PolarHBondContact O-NE 2.89Å; R589-R594 PolarHBondContact O-NH2 3.05Å; R589-R594 VanDerWaalsContact O-NH2 3.08Å; R589-D615 IonicContact CZ-OD2 2.8Å; R589-D615 IonicContact NE-OD2 3.67Å; R589-D615 PolarHBondContact NE-OD2 3.21Å; R589-D615 IonicContact NH2-OD2 3.53Å
590	P	93.1	Very high	92.1	Very high	2 Å²	2	68.6 Å²	68.6	1%	0.013	32%	0.317	C	S	.	.			trans	-61.7	163.2	169	22	-31.1	0	0	0	112.9	S588 K592 L593 R594 I618 W690 A693	S588-P590 VanDerWaalsContact C-CD 3.49Å; S588-P590 WeakPolarHBondContact O-CD 3.38Å; P590-K592 PolarHBondContact O-N 3.29Å; P590-L593 HydrophobicContact CG-CB 4.43Å; P590-L593 HydrophobicContact CG-CD1 4.25Å; P590-L593 HydrophobicContact CG-CG 4.1Å; P590-L593 PolarHBondContact O-N 3.27Å; P590-R594 PolarHBondContact O-N 2.76Å; P590-R594 VanDerWaalsContact O-N 3.16Å; P590-I618 HydrophobicContact CG-CD1 4.16Å; P590-W690 HydrophobicContact CB-CE3 4.39Å; P590-W690 HydrophobicContact CG-CD2 4.3Å; P590-W690 HydrophobicContact CG-CE3 3.54Å; P590-W690 HydrophobicContact CG-CZ3 3.94Å; P590-A693 HydrophobicContact CB-CB 3.69Å; P590-A693 HydrophobicContact CG-CB 4.24Å
591	L	92.4	Very high	92.3	Very high	86 Å²	86	69.2 Å²	69.2	45%	0.45	32%	0.324	S	S	.	.	H	α-helix	trans	-53.1	-39.8	-177.8	-175.9	150.4	0	0	0	112.5	L593 R594 L595	L591-L593 VanDerWaalsContact C-N 3.32Å; L591-L593 PolarHBondContact O-N 2.9Å; L591-R594 PolarHBondContact O-N 2.62Å; L591-L595 WeakPolarHBondContact O-CB 3.41Å; L591-L595 PolarHBondContact O-N 3.3Å
592	K	92.4	Very high	92.3	Very high	55 Å²	55	74.1 Å²	74.1	24%	0.239	35%	0.345	C	S	.	.	H	α-helix	trans	-61.3	-37.4	176.8	-164.9	58.7	168.8	-147.9	0	113.5	P590 L596 E689 W690	P590-K592 PolarHBondContact O-N 3.29Å; K592-L596 HydrophobicContact CG-CD1 4.15Å; K592-L596 WeakPolarHBondContact O-CB 3.43Å; K592-L596 WeakPolarHBondContact O-CD1 3.39Å; K592-L596 WeakPolarHBondContact O-CG 3.5Å; K592-L596 PolarHBondContact O-N 2.72Å; K592-E689 HydrophobicContact CB-CB 3.92Å; K592-E689 HydrophobicContact CD-CB 4.17Å; K592-E689 WeakPolarHBondContact CD-OE2 3.17Å; K592-E689 VanDerWaalsContact CE-OE2 3.26Å; K592-E689 WeakPolarHBondContact CE-OE2 3.25Å; K592-E689 HydrophobicContact CG-CB 4.34Å; K592-E689 PolarHBondContact N-O 3.37Å; K592-E689 IonicContact NZ-OE1 3.46Å; K592-E689 PolarHBondContact NZ-OE1 3Å; K592-E689 IonicContact NZ-OE2 3.24Å; K592-E689 PolarHBondContact NZ-OE2 3.46Å; K592-W690 HydrophobicContact CB-CD2 4.35Å; K592-W690 HydrophobicContact CB-CZ2 4.08Å; K592-W690 HydrophobicContact CG-CZ2 3.91Å
593	L	91.4	Very high	92.1	Very high	3 Å²	3	75.9 Å²	75.9	2%	0.016	36%	0.36	C	S	.	.	H	α-helix	trans	-75.7	-38.7	179.6	-70.1	-170.5	0	0	0	112.2	P590 L591 L596 A597 Y660 W690	P590-L593 HydrophobicContact CG-CB 4.43Å; P590-L593 HydrophobicContact CG-CD1 4.25Å; P590-L593 HydrophobicContact CG-CG 4.1Å; P590-L593 PolarHBondContact O-N 3.27Å; L591-L593 VanDerWaalsContact C-N 3.32Å; L591-L593 PolarHBondContact O-N 2.9Å; L593-L596 HydrophobicContact CD2-CD1 4.3Å; L593-L596 PolarHBondContact O-N 3.04Å; L593-A597 PolarHBondContact O-N 3.18Å; L593-Y660 HydrophobicContact CD1-CD2 4.02Å; L593-Y660 HydrophobicContact CD1-CE2 3.67Å; L593-Y660 HydrophobicContact CD2-CD1 4.41Å; L593-Y660 HydrophobicContact CD2-CD2 4.07Å; L593-Y660 HydrophobicContact CD2-CE1 3.94Å; L593-Y660 HydrophobicContact CD2-CE2 3.54Å; L593-Y660 HydrophobicContact CD2-CG 4.46Å; L593-Y660 VanDerWaalsContact CD2-CZ 3.47Å; L593-Y660 HydrophobicContact CG-CE2 4.26Å; L593-W690 HydrophobicContact CD1-CH2 4.36Å; L593-W690 HydrophobicContact CD1-CZ3 4Å; L593-W690 HydrophobicContact CD2-CH2 3.56Å; L593-W690 HydrophobicContact CD2-CZ2 4.43Å; L593-W690 HydrophobicContact CD2-CZ3 4.04Å; L593-W690 HydrophobicContact CG-CH2 3.82Å; L593-W690 HydrophobicContact CG-CZ3 3.79Å
594	R	91.8	Very high	91.9	Very high	147 Å²	147	74.8 Å²	74.8	56%	0.555	36%	0.358	S	S	*	.	H	α-helix	trans	-58.4	-51.3	173.4	-59.3	-177.5	-162.1	-155	-1.5	110.9	R589 P590 L591 L596 A597 E598	R589-R594 HydrophobicContact CB-CG 4.32Å; R589-R594 PolarHBondContact O-NE 2.89Å; R589-R594 PolarHBondContact O-NH2 3.05Å; R589-R594 VanDerWaalsContact O-NH2 3.08Å; P590-R594 PolarHBondContact O-N 2.76Å; P590-R594 VanDerWaalsContact O-N 3.16Å; L591-R594 PolarHBondContact O-N 2.62Å; R594-L596 VanDerWaalsContact C-N 3.3Å; R594-L596 PolarHBondContact O-N 3.2Å; R594-A597 WeakPolarHBondContact O-CB 3.41Å; R594-A597 PolarHBondContact O-N 3.47Å; R594-E598 VanDerWaalsContact C-OE1 3.32Å; R594-E598 VanDerWaalsContact O-CG 3.31Å; R594-E598 WeakPolarHBondContact O-CG 3.42Å; R594-E598 PolarHBondContact O-N 3.38Å
595	L	93.2	Very high	91.6	Very high	69 Å²	69	77.7 Å²	77.7	36%	0.361	37%	0.369	S	S	.	.	H	α-helix	trans	-59.6	-36.6	176	-178.5	61.5	0	0	0	113	L591 I599	L591-L595 WeakPolarHBondContact O-CB 3.41Å; L591-L595 PolarHBondContact O-N 3.3Å; L595-I599 HydrophobicContact CD1-CD1 4.01Å; L595-I599 HydrophobicContact CD1-CG1 4.36Å; L595-I599 HydrophobicContact CG-CD1 3.92Å; L595-I599 WeakPolarHBondContact O-CB 3.23Å; L595-I599 WeakPolarHBondContact O-CD1 3.41Å; L595-I599 WeakPolarHBondContact O-CG1 3.45Å; L595-I599 PolarHBondContact O-N 3.32Å
596	L	90.6	Very high	91.5	Very high	58 Å²	58	83.2 Å²	83.2	30%	0.304	40%	0.404	S	S	.	.	H	α-helix	trans	-71.5	-33.8	175.4	-76.6	169	0	0	0	112.7	K592 L593 R594 R600	K592-L596 HydrophobicContact CG-CD1 4.15Å; K592-L596 WeakPolarHBondContact O-CB 3.43Å; K592-L596 WeakPolarHBondContact O-CD1 3.39Å; K592-L596 WeakPolarHBondContact O-CG 3.5Å; K592-L596 PolarHBondContact O-N 2.72Å; L593-L596 HydrophobicContact CD2-CD1 4.3Å; L593-L596 PolarHBondContact O-N 3.04Å; R594-L596 VanDerWaalsContact C-N 3.3Å; R594-L596 PolarHBondContact O-N 3.2Å; L596-R600 WeakPolarHBondContact O-CB 3.5Å; L596-R600 VanDerWaalsContact O-CG 3.25Å; L596-R600 WeakPolarHBondContact O-CG 3.4Å; L596-R600 PolarHBondContact O-N 3.21Å
597	A	90.6	Very high	91.4	Very high	43 Å²	43	81 Å²	81	36%	0.355	40%	0.397	S	S	.	.	H	α-helix	trans	-68.2	-45.7	172.4	0	0	0	0	0	111.3	L593 R594 I599 R600 A601	L593-A597 PolarHBondContact O-N 3.18Å; R594-A597 WeakPolarHBondContact O-CB 3.41Å; R594-A597 PolarHBondContact O-N 3.47Å; A597-I599 VanDerWaalsContact C-N 3.35Å; A597-I599 PolarHBondContact O-N 2.94Å; A597-R600 PolarHBondContact O-N 3.1Å; A597-R600 VanDerWaalsContact O-N 3.12Å; A597-A601 WeakPolarHBondContact O-CB 3.28Å; A597-A601 PolarHBondContact O-N 2.9Å
598	E	92.8	Very high	91.1	Very high	117 Å²	117	79.5 Å²	79.5	55%	0.547	40%	0.4	S	S	.	.	H	α-helix	trans	-54.8	-47.7	173.1	-68.8	156.4	-142.1	0	0	111.5	R594 R600 A601 F602	R594-E598 VanDerWaalsContact C-OE1 3.32Å; R594-E598 VanDerWaalsContact O-CG 3.31Å; R594-E598 WeakPolarHBondContact O-CG 3.42Å; R594-E598 PolarHBondContact O-N 3.38Å; E598-R600 VanDerWaalsContact C-N 3.33Å; E598-R600 PolarHBondContact O-N 3.24Å; E598-A601 PolarHBondContact O-N 2.88Å; E598-F602 WeakPolarHBondContact O-CB 3.05Å; E598-F602 PolarHBondContact O-N 2.85Å
599	I	93.1	Very high	91.2	Very high	103 Å²	103	85.3 Å²	85.3	53%	0.528	43%	0.43	S	S	.	.	H	α-helix	trans	-65.4	-32.9	177.8	-70.9	166.8	0	0	0	112.3	L595 A597 P603	L595-I599 HydrophobicContact CD1-CD1 4.01Å; L595-I599 HydrophobicContact CD1-CG1 4.36Å; L595-I599 HydrophobicContact CG-CD1 3.92Å; L595-I599 WeakPolarHBondContact O-CB 3.23Å; L595-I599 WeakPolarHBondContact O-CD1 3.41Å; L595-I599 WeakPolarHBondContact O-CG1 3.45Å; L595-I599 PolarHBondContact O-N 3.32Å; A597-I599 VanDerWaalsContact C-N 3.35Å; A597-I599 PolarHBondContact O-N 2.94Å; I599-P603 WeakPolarHBondContact O-CD 3.33Å
600	R	90.2	Very high	91.2	Very high	76 Å²	76	84.9 Å²	84.9	29%	0.287	43%	0.429	S	S	.	.	H	α-helix	trans	-73.3	-36.4	174.5	-76.5	170.4	179.2	163.3	1.2	112.8	L596 A597 E598 P603 H604 W610 D615	L596-R600 WeakPolarHBondContact O-CB 3.5Å; L596-R600 VanDerWaalsContact O-CG 3.25Å; L596-R600 WeakPolarHBondContact O-CG 3.4Å; L596-R600 PolarHBondContact O-N 3.21Å; A597-R600 PolarHBondContact O-N 3.1Å; A597-R600 VanDerWaalsContact O-N 3.12Å; E598-R600 VanDerWaalsContact C-N 3.33Å; E598-R600 PolarHBondContact O-N 3.24Å; R600-P603 WeakPolarHBondContact O-CD 3.29Å; R600-H604 PolarHBondContact O-CE1 3.13Å; R600-H604 PolarHBondContact O-ND1 3.42Å; R600-W610 HydrophobicContact CB-CH2 4.46Å; R600-D615 IonicContact NH1-OD1 2.62Å
601	A	90.9	Very high	90.9	Very high	37 Å²	37	90.3 Å²	90.3	31%	0.306	46%	0.462	S	S	.	.	H	α-helix	trans	-77.5	-32.4	179.5	0	0	0	0	0	112.5	A597 E598 P603 H604 R605 W610	A597-A601 WeakPolarHBondContact O-CB 3.28Å; A597-A601 PolarHBondContact O-N 2.9Å; E598-A601 PolarHBondContact O-N 2.88Å; A601-P603 VanDerWaalsContact C-CD 3.49Å; A601-H604 CarbonylContact O-C 3.6Å; A601-H604 WeakPolarHBondContact O-CA 3.48Å; A601-H604 PolarHBondContact O-N 3.4Å; A601-R605 PolarHBondContact O-N 3.33Å; A601-R605 VanDerWaalsContact O-N 3.14Å; A601-W610 HydrophobicContact CB-CH2 3.99Å; A601-W610 HydrophobicContact CB-CZ3 3.76Å
602	F	92.3	Very high	90.6	Very high	133 Å²	133	90.3 Å²	90.3	58%	0.583	47%	0.467	S	S	*	.	G	3₁₀ helix	trans	-53.2	-39.9	-173.9	-177.8	-97.5	0	0	0	115.8	E598 H604 R605	E598-F602 WeakPolarHBondContact O-CB 3.05Å; E598-F602 PolarHBondContact O-N 2.85Å; F602-H604 VanDerWaalsContact C-N 3.32Å; F602-R605 WeakPolarHBondContact O-CD 3.44Å; F602-R605 WeakPolarHBondContact O-CG 3.48Å; F602-R605 PolarHBondContact O-NH1 2.84Å
603	P	91.9	Very high	90.2	Very high	79 Å²	79	94 Å²	94	51%	0.513	49%	0.485	S	S	.	.	G	3₁₀ helix	trans	-66.9	-31.8	174	-20.3	33.8	0	0	0	113.6	I599 R600 A601	I599-P603 WeakPolarHBondContact O-CD 3.33Å; R600-P603 WeakPolarHBondContact O-CD 3.29Å; A601-P603 VanDerWaalsContact C-CD 3.49Å
604	H	89.8	Confident	89.8	Confident	69 Å²	69	99.4 Å²	99.4	32%	0.319	52%	0.52	S	S	.	.	G	3₁₀ helix	trans	-96.2	5.9	-171.9	-49	100.9	0	0	0	113.1	R600 A601 F602 T606 D607 W610	R600-H604 PolarHBondContact O-CE1 3.13Å; R600-H604 PolarHBondContact O-ND1 3.42Å; A601-H604 CarbonylContact O-C 3.6Å; A601-H604 WeakPolarHBondContact O-CA 3.48Å; A601-H604 PolarHBondContact O-N 3.4Å; F602-H604 VanDerWaalsContact C-N 3.32Å; H604-T606 PolarHBondContact O-N 3.01Å; H604-D607 WeakPolarHBondContact O-CB 3.34Å; H604-D607 PolarHBondContact O-N 3.31Å; H604-W610 HydrophobicContact CB-CB 3.91Å; H604-W610 HydrophobicContact CB-CD2 3.44Å; H604-W610 VanDerWaalsContact CB-CD2 3.44Å; H604-W610 HydrophobicContact CB-CE3 3.87Å; H604-W610 HydrophobicContact CB-CG 3.44Å; H604-W610 VanDerWaalsContact CB-CG 3.44Å; H604-W610 AromaticContact CD2-CD1 3.47Å; H604-W610 VanDerWaalsContact CD2-CD1 3.47Å; H604-W610 AromaticContact CD2-NE1 3.54Å; H604-W610 AromaticContact CE1-CE2 3.86Å; H604-W610 AromaticContact CE1-NE1 3.57Å; H604-W610 AromaticContact CG-CD1 3.5Å; H604-W610 AromaticContact CG-CD2 3.65Å; H604-W610 AromaticContact CG-CE2 3.5Å; H604-W610 AromaticContact CG-CG 3.65Å; H604-W610 AromaticContact CG-NE1 3.41Å; H604-W610 AromaticContact ND1-CD2 3.91Å; H604-W610 AromaticContact ND1-CE2 3.33Å; H604-W610 VanDerWaalsContact ND1-CE2 3.33Å; H604-W610 AromaticContact ND1-CZ2 3.52Å; H604-W610 AromaticContact ND1-NE1 3.43Å; H604-W610 PolarHBondContact ND1-NE1 3.41Å; H604-W610 AromaticContact NE2-NE1 3.66Å
605	R	89	Confident	89.5	Confident	170 Å²	170	94.3 Å²	94.3	64%	0.642	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-2.8	-178.7	73.6	-176.7	-176.1	-83.5	-3.2	116.3	A601 F602	A601-R605 PolarHBondContact O-N 3.33Å; A601-R605 VanDerWaalsContact O-N 3.14Å; F602-R605 WeakPolarHBondContact O-CD 3.44Å; F602-R605 WeakPolarHBondContact O-CG 3.48Å; F602-R605 PolarHBondContact O-NH1 2.84Å
606	T	91	Very high	89.3	Confident	122 Å²	122	92 Å²	92	75%	0.748	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.8	2.1	176.7	51.9	0	0	0	0	112.7	H604	H604-T606 PolarHBondContact O-N 3.01Å
607	D	91.2	Very high	89.5	Confident	75 Å²	75	90.1 Å²	90.1	40%	0.401	49%	0.486	S	S	.	.			trans	-111.1	106.1	-177.5	-175.6	-9.5	0	0	0	108.3	H604 D609 W610	H604-D607 WeakPolarHBondContact O-CB 3.34Å; H604-D607 PolarHBondContact O-N 3.31Å; D607-D609 VanDerWaalsContact C-N 3.31Å; D607-D609 PolarHBondContact OD1-N 3Å; D607-W610 HydrophobicContact CB-CB 4.07Å
608	P	86	Confident	89.7	Confident	120 Å²	120	88.1 Å²	88.1	78%	0.779	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75	-20.4	-175.1	32	-35.6	0	0	0	113.1	W610	P608-W610 VanDerWaalsContact C-N 3.34Å
609	D	90.8	Very high	89.9	Confident	144 Å²	144	82.9 Å²	82.9	77%	0.77	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-6.3	-179.2	-62.9	-39.1	0	0	0	111.9	D607 T611	D607-D609 VanDerWaalsContact C-N 3.31Å; D607-D609 PolarHBondContact OD1-N 3Å; D609-T611 PolarHBondContact O-N 2.88Å
610	W	90.8	Very high	90	Very high	75 Å²	75	78 Å²	78	28%	0.284	42%	0.42	S	S	.	.			trans	-72	117.7	-179.5	-176.3	81.8	0	0	0	112.6	R600 A601 H604 D607 P608 P612	R600-W610 HydrophobicContact CB-CH2 4.46Å; A601-W610 HydrophobicContact CB-CH2 3.99Å; A601-W610 HydrophobicContact CB-CZ3 3.76Å; H604-W610 HydrophobicContact CB-CB 3.91Å; H604-W610 HydrophobicContact CB-CD2 3.44Å; H604-W610 VanDerWaalsContact CB-CD2 3.44Å; H604-W610 HydrophobicContact CB-CE3 3.87Å; H604-W610 HydrophobicContact CB-CG 3.44Å; H604-W610 VanDerWaalsContact CB-CG 3.44Å; H604-W610 AromaticContact CD2-CD1 3.47Å; H604-W610 VanDerWaalsContact CD2-CD1 3.47Å; H604-W610 AromaticContact CD2-NE1 3.54Å; H604-W610 AromaticContact CE1-CE2 3.86Å; H604-W610 AromaticContact CE1-NE1 3.57Å; H604-W610 AromaticContact CG-CD1 3.5Å; H604-W610 AromaticContact CG-CD2 3.65Å; H604-W610 AromaticContact CG-CE2 3.5Å; H604-W610 AromaticContact CG-CG 3.65Å; H604-W610 AromaticContact CG-NE1 3.41Å; H604-W610 AromaticContact ND1-CD2 3.91Å; H604-W610 AromaticContact ND1-CE2 3.33Å; H604-W610 VanDerWaalsContact ND1-CE2 3.33Å; H604-W610 AromaticContact ND1-CZ2 3.52Å; H604-W610 AromaticContact ND1-NE1 3.43Å; H604-W610 PolarHBondContact ND1-NE1 3.41Å; H604-W610 AromaticContact NE2-NE1 3.66Å; D607-W610 HydrophobicContact CB-CB 4.07Å; P608-W610 VanDerWaalsContact C-N 3.34Å; W610-P612 HydrophobicContact CH2-CB 3.69Å; W610-P612 HydrophobicContact CZ2-CB 4.25Å; W610-P612 HydrophobicContact CZ3-CB 4.05Å
611	T	87.5	Confident	90.3	Very high	116 Å²	116	74.4 Å²	74.4	71%	0.712	41%	0.407	S	S	*	.			trans	-107.7	138.1	169.7	49.8	0	0	0	0	110.9	D609	D609-T611 PolarHBondContact O-N 2.88Å
612	P	84.6	Confident	90.5	Very high	86 Å²	86	74.3 Å²	74.3	56%	0.558	40%	0.398	S	S	*	.	P	Polyproline II helix	trans	-70.4	145.2	178.5	27.9	-34.2	0	0	0	112	W610	W610-P612 HydrophobicContact CH2-CB 3.69Å; W610-P612 HydrophobicContact CZ2-CB 4.25Å; W610-P612 HydrophobicContact CZ3-CB 4.05Å
613	E	84.6	Confident	90.6	Very high	132 Å²	132	68.1 Å²	68.1	62%	0.617	37%	0.372	S	S	*	.	P	Polyproline II helix	trans	-53.5	140.8	166.7	-72.7	-171.1	161.6	0	0	111	D615 R661	E613-D615 PolarHBondContact O-N 3.17Å; E613-R661 IonicContact OE2-NH2 2.7Å
614	P	84.1	Confident	90.6	Very high	117 Å²	117	65 Å²	65	76%	0.76	35%	0.35	S	S	*	.	P	Polyproline II helix	trans	-60.3	136.1	176	24.7	-33.6	0	0	0	111.6
615	D	84.8	Confident	90.6	Very high	40 Å²	40	63.2 Å²	63.2	21%	0.214	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-64.5	137.9	178.1	-98.2	-38.3	0	0	0	111.7	R589 R600 E613	R589-D615 IonicContact CZ-OD2 2.8Å; R589-D615 IonicContact NE-OD2 3.67Å; R589-D615 PolarHBondContact NE-OD2 3.21Å; R589-D615 IonicContact NH2-OD2 3.53Å; R600-D615 IonicContact NH1-OD1 2.62Å; E613-D615 PolarHBondContact O-N 3.17Å
616	A	89.9	Confident	90.5	Very high	21 Å²	21	59.4 Å²	59.4	17%	0.174	34%	0.336	C	S	.	.	P	Polyproline II helix	trans	-72.5	148.4	170.3	0	0	0	0	0	110.6	Y660 R661	A616-Y660 HydrophobicContact CB-CE2 4.02Å; A616-Y660 WeakPolarHBondContact O-CE2 3.09Å; A616-R661 HydrophobicContact CB-CG 3.49Å; A616-R661 VanDerWaalsContact CB-CG 3.49Å
617	P	93.9	Very high	90.5	Very high	17 Å²	17	53.8 Å²	53.8	11%	0.11	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-67.3	160.5	177.7	27.9	-34.6	0	0	0	112.5	R584 D585 F586 D619	R584-P617 HydrophobicContact CB-CB 4.31Å; D585-P617 CarbonylContact O-C 3.57Å; D585-P617 VanDerWaalsContact O-CA 3.26Å; D585-P617 WeakPolarHBondContact O-CA 3.45Å; F586-P617 HydrophobicContact CD1-CB 3.88Å; F586-P617 HydrophobicContact CD1-CG 4.35Å; F586-P617 HydrophobicContact CD2-CB 4.2Å; F586-P617 HydrophobicContact CE1-CB 3.73Å; F586-P617 HydrophobicContact CE1-CG 3.74Å; F586-P617 HydrophobicContact CE2-CB 4.05Å; F586-P617 HydrophobicContact CE2-CG 4.47Å; F586-P617 HydrophobicContact CG-CB 4.13Å; F586-P617 HydrophobicContact CZ-CB 3.81Å; F586-P617 HydrophobicContact CZ-CG 3.8Å; P617-D619 WeakPolarHBondContact CG-OD1 3.13Å
618	I	95.4	Very high	90.6	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	112.7	156.2	-57	-177.4	0	0	0	107.2	D585 P590 Y620 A658 L659 Y660 V665 W690 I695	D585-I618 HydrophobicContact CB-CB 4.32Å; D585-I618 WeakPolarHBondContact CB-O 3.25Å; D585-I618 PolarHBondContact N-O 3.3Å; D585-I618 PolarHBondContact O-N 3.1Å; P590-I618 HydrophobicContact CG-CD1 4.16Å; I618-Y620 HydrophobicContact CB-CE2 4.44Å; I618-Y620 HydrophobicContact CG2-CE2 3.98Å; I618-A658 HydrophobicContact CG2-CB 4.31Å; I618-L659 CarbonylContact C-O 3.58Å; I618-L659 WeakPolarHBondContact CA-O 2.74Å; I618-Y660 HydrophobicContact CG1-CD2 4.44Å; I618-V665 HydrophobicContact CG2-CG2 4.46Å; I618-W690 HydrophobicContact CD1-CE3 4.25Å; I618-W690 HydrophobicContact CD1-CZ3 4.19Å; I618-W690 HydrophobicContact CG1-CZ3 4.44Å; I618-I695 HydrophobicContact CD1-CD1 3.89Å; I618-I695 HydrophobicContact CD1-CG1 4.39Å
619	D	95.4	Very high	90.9	Very high	7 Å²	7	48 Å²	48	4%	0.037	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	112.5	-176.4	-76.4	-24.6	0	0	0	110.1	F581 R584 P617 L659	F581-D619 HydrophobicContact CD1-CB 3.92Å; F581-D619 HydrophobicContact CE1-CB 3.93Å; R584-D619 WeakPolarHBondContact CB-OD1 3.45Å; R584-D619 VanDerWaalsContact CG-OD1 3.3Å; R584-D619 WeakPolarHBondContact CG-OD1 3.27Å; R584-D619 IonicContact CZ-OD1 3.91Å; R584-D619 IonicContact CZ-OD2 3.84Å; R584-D619 IonicContact NE-OD1 3.7Å; R584-D619 PolarHBondContact NE-OD1 3.15Å; R584-D619 IonicContact NE-OD2 2.73Å; R584-D619 IonicContact NH2-OD1 2.92Å; R584-D619 PolarHBondContact NH2-OD1 3.41Å; R584-D619 IonicContact NH2-OD2 2.85Å; R584-D619 PolarHBondContact NH2-OD2 2.96Å; P617-D619 WeakPolarHBondContact CG-OD1 3.13Å; D619-L659 HydrophobicContact CB-CB 4.35Å; D619-L659 PolarHBondContact N-O 3.25Å; D619-L659 PolarHBondContact O-N 3.28Å
620	Y	96.9	Very high	91	Very high	1 Å²	1	43.7 Å²	43.7	0%	0.004	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	120.7	172	-57.8	-93.3	0	0	0	108.4	F581 I582 R583 D585 I618 V656 V657 A658 I695 F698 M699	F581-Y620 CarbonylContact C-O 3.59Å; F581-Y620 WeakPolarHBondContact CA-O 3.42Å; I582-Y620 PolarHBondContact N-O 3.04Å; R583-Y620 HydrophobicContact CB-CD2 4.02Å; R583-Y620 HydrophobicContact CG-CD2 4.24Å; R583-Y620 PolarHBondContact N-O 3.48Å; R583-Y620 PolarHBondContact O-N 2.83Å; D585-Y620 HydrophobicContact CB-CD2 4.4Å; D585-Y620 HydrophobicContact CB-CE2 3.7Å; I618-Y620 HydrophobicContact CB-CE2 4.44Å; I618-Y620 HydrophobicContact CG2-CE2 3.98Å; Y620-V656 HydrophobicContact CD1-CG2 4.1Å; Y620-V657 WeakPolarHBondContact CA-O 3.08Å; Y620-A658 HydrophobicContact CD1-CB 3.92Å; Y620-A658 HydrophobicContact CE1-CB 3.92Å; Y620-I695 HydrophobicContact CE1-CG2 3.78Å; Y620-I695 WeakPolarHBondContact OH-CA 3.45Å; Y620-F698 AromaticContact CD1-CD1 3.48Å; Y620-F698 HydrophobicContact CD1-CD1 3.48Å; Y620-F698 VanDerWaalsContact CD1-CD1 3.48Å; Y620-F698 AromaticContact CD1-CE1 3.92Å; Y620-F698 HydrophobicContact CD1-CE1 3.92Å; Y620-F698 HydrophobicContact CD2-CD1 4.02Å; Y620-F698 HydrophobicContact CD2-CE1 4.06Å; Y620-F698 HydrophobicContact CE1-CB 4.32Å; Y620-F698 AromaticContact CE1-CD1 3.63Å; Y620-F698 HydrophobicContact CE1-CD1 3.63Å; Y620-F698 HydrophobicContact CE1-CE1 4.47Å; Y620-F698 HydrophobicContact CE1-CG 4.36Å; Y620-F698 HydrophobicContact CE2-CD1 4.16Å; Y620-F698 AromaticContact CG-CD1 3.67Å; Y620-F698 HydrophobicContact CG-CD1 3.67Å; Y620-F698 AromaticContact CG-CE1 3.68Å; Y620-F698 HydrophobicContact CG-CE1 3.68Å; Y620-F698 AromaticContact CZ-CD1 3.98Å; Y620-M699 HydrophobicContact CD1-CG 4.35Å; Y620-M699 HydrophobicContact CE1-CG 4.32Å
621	C	95.2	Very high	91.2	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	158.9	-176.4	59.5	0	0	0	0	111.1	P580 H627 V657	P580-C621 WeakPolarHBondContact O-CB 3.42Å; C621-H627 PolarHBondContact SG-CE1 2.79Å; C621-V657 PolarHBondContact N-O 3.35Å; C621-V657 PolarHBondContact O-N 3.37Å; C621-V657 PolarHBondContact SG-O 3.06Å; C621-V657 VanDerWaalsContact SG-O 3.36Å
622	Y	95.8	Very high	91.5	Very high	35 Å²	35	36.1 Å²	36.1	14%	0.137	21%	0.21	C	C	.	.			trans	-68.4	157.9	172.9	-57.7	-76.8	0	0	0	110.9	L578 K579 I582 R624 P652 S655 H702	L578-Y622 HydrophobicContact CB-CD2 3.69Å; L578-Y622 HydrophobicContact CB-CE2 3.76Å; L578-Y622 HydrophobicContact CB-CG 4.34Å; L578-Y622 HydrophobicContact CD1-CD1 4.06Å; L578-Y622 HydrophobicContact CD1-CD2 4.07Å; L578-Y622 HydrophobicContact CD1-CE1 4.44Å; L578-Y622 HydrophobicContact CD1-CE2 4.46Å; L578-Y622 HydrophobicContact CD1-CG 3.84Å; L578-Y622 HydrophobicContact CD2-CD2 4.45Å; L578-Y622 HydrophobicContact CD2-CE1 4.15Å; L578-Y622 HydrophobicContact CD2-CE2 4.03Å; L578-Y622 HydrophobicContact CG-CD2 4.28Å; L578-Y622 HydrophobicContact CG-CE2 4.29Å; K579-Y622 WeakPolarHBondContact O-CD2 3.46Å; I582-Y622 HydrophobicContact CD1-CD1 3.91Å; I582-Y622 HydrophobicContact CD1-CD2 4.44Å; I582-Y622 HydrophobicContact CD1-CE1 3.91Å; I582-Y622 HydrophobicContact CD1-CE2 4.43Å; I582-Y622 HydrophobicContact CD1-CG 4.21Å; I582-Y622 HydrophobicContact CG1-CD1 4.09Å; I582-Y622 HydrophobicContact CG1-CD2 3.94Å; I582-Y622 HydrophobicContact CG1-CE1 3.77Å; I582-Y622 HydrophobicContact CG1-CE2 3.58Å; I582-Y622 HydrophobicContact CG1-CG 4.2Å; Y622-R624 PolarHBondContact O-N 2.73Å; Y622-P652 VanDerWaalsContact CD1-O 3.23Å; Y622-P652 WeakPolarHBondContact CD1-O 3.4Å; Y622-S655 WeakPolarHBondContact CD1-O 3.22Å; Y622-H702 AromaticContact CE1-CE1 3.89Å; Y622-H702 AromaticContact CE1-NE2 3.61Å
623	V	94.2	Very high	91.8	Very high	4 Å²	4	34.7 Å²	34.7	2%	0.024	21%	0.206	C	C	.	.			trans	-62.5	135.6	-179	70.6	0	0	0	0	112.2	I628 L649 P652 S655 V657 F669	V623-I628 HydrophobicContact CG2-CD1 3.49Å; V623-I628 VanDerWaalsContact CG2-CD1 3.49Å; V623-I628 HydrophobicContact CG2-CG1 4.48Å; V623-L649 HydrophobicContact CG1-CD2 4.16Å; V623-L649 HydrophobicContact CG2-CD2 4.03Å; V623-P652 HydrophobicContact CG1-CB 3.96Å; V623-S655 WeakPolarHBondContact CB-OG 3.19Å; V623-S655 VanDerWaalsContact CG1-OG 3.24Å; V623-S655 WeakPolarHBondContact CG1-OG 3.17Å; V623-S655 PolarHBondContact N-OG 2.8Å; V623-V657 HydrophobicContact CB-CG2 4.17Å; V623-V657 HydrophobicContact CG2-CG2 4.3Å; V623-F669 HydrophobicContact CB-CE1 3.76Å; V623-F669 HydrophobicContact CB-CZ 4.3Å; V623-F669 HydrophobicContact CG1-CE1 4.13Å; V623-F669 HydrophobicContact CG2-CE1 3.72Å; V623-F669 HydrophobicContact CG2-CZ 3.86Å
624	R	91.3	Very high	92.2	Very high	14 Å²	14	29.6 Å²	29.6	5%	0.053	18%	0.182	C	C	.	.			trans	-127.7	157.3	177.6	-63.5	177.4	-167.7	-102.1	-12.6	109.9	G564 L565 Q567 I569 P580 Y622 N626 H627	G564-R624 PolarHBondContact O-NH1 3.37Å; L565-R624 PolarHBondContact O-NH1 3.42Å; L565-R624 PolarHBondContact O-NH2 2.89Å; Q567-R624 PolarHBondContact O-NH1 3.33Å; Q567-R624 PolarHBondContact O-NH2 2.87Å; I569-R624 HydrophobicContact CD1-CG 3.66Å; P580-R624 VanDerWaalsContact CA-NH2 3.26Å; P580-R624 PolarHBondContact O-NH2 3.38Å; Y622-R624 PolarHBondContact O-N 2.73Å; R624-N626 WeakPolarHBondContact CB-OD1 3.48Å; R624-N626 PolarHBondContact O-N 2.88Å; R624-N626 VanDerWaalsContact O-N 3.14Å; R624-H627 PolarHBondContact N-ND1 2.61Å; R624-H627 WeakPolarHBondContact O-CB 3.33Å; R624-H627 PolarHBondContact O-N 2.84Å
625	P	89.7	Confident	92.6	Very high	30 Å²	30	24 Å²	24	20%	0.195	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-20.2	-174.6	-24.1	36.6	0	0	0	115	F537 Q538 L649	F537-P625 HydrophobicContact CB-CB 4.14Å; F537-P625 HydrophobicContact CB-CG 3.43Å; F537-P625 VanDerWaalsContact CB-CG 3.43Å; Q538-P625 HydrophobicContact CG-CB 3.62Å; P625-L649 HydrophobicContact CB-CD1 4.29Å; P625-L649 HydrophobicContact CG-CD1 4.28Å; P625-L649 HydrophobicContact CG-CD2 4.13Å
626	N	87.1	Confident	92.7	Very high	90 Å²	90	25.2 Å²	25.2	48%	0.481	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-77.9	-17.5	171.7	62.2	-46.8	0	0	0	113.2	R624	R624-N626 WeakPolarHBondContact CB-OD1 3.48Å; R624-N626 PolarHBondContact O-N 2.88Å; R624-N626 VanDerWaalsContact O-N 3.14Å
627	H	92.1	Very high	92.6	Very high	5 Å²	5	28.9 Å²	28.9	2%	0.023	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-33.7	178	-55.8	167	0	0	0	111.5	C621 R624 S630 V631 V657	C621-H627 PolarHBondContact SG-CE1 2.79Å; R624-H627 PolarHBondContact N-ND1 2.61Å; R624-H627 WeakPolarHBondContact O-CB 3.33Å; R624-H627 PolarHBondContact O-N 2.84Å; H627-S630 PolarHBondContact O-N 2.99Å; H627-S630 VanDerWaalsContact O-N 3.11Å; H627-V631 HydrophobicContact CB-CG2 4.43Å; H627-V631 WeakPolarHBondContact O-CG2 3.47Å; H627-V631 PolarHBondContact O-N 2.83Å; H627-V657 HydrophobicContact CB-CG1 4.34Å; H627-V657 HydrophobicContact CB-CG2 4.5Å
628	I	93.3	Very high	92.3	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-55.2	-43.4	-173.1	-54.8	-57.9	0	0	0	114.3	L534 V623 S630 V631 N632 L649	L534-I628 HydrophobicContact CD2-CB 3.8Å; L534-I628 HydrophobicContact CD2-CG1 3.88Å; L534-I628 HydrophobicContact CD2-CG2 3.92Å; V623-I628 HydrophobicContact CG2-CD1 3.49Å; V623-I628 VanDerWaalsContact CG2-CD1 3.49Å; V623-I628 HydrophobicContact CG2-CG1 4.48Å; I628-S630 VanDerWaalsContact C-N 3.3Å; I628-S630 PolarHBondContact O-N 2.87Å; I628-V631 PolarHBondContact O-N 2.92Å; I628-N632 WeakPolarHBondContact O-CB 3.4Å; I628-N632 PolarHBondContact O-N 2.86Å; I628-N632 PolarHBondContact O-OD1 2.83Å; I628-L649 HydrophobicContact CD1-CD2 4.21Å; I628-L649 HydrophobicContact CD1-CG 4.16Å; I628-L649 HydrophobicContact CG1-CD1 3.92Å; I628-L649 HydrophobicContact CG1-CD2 4.08Å; I628-L649 HydrophobicContact CG1-CG 4.03Å
629	P	91.4	Very high	92	Very high	73 Å²	73	32.9 Å²	32.9	47%	0.474	19%	0.189	S	C	.	.	H	α-helix	trans	-59	-39.6	178.2	-25.7	35.9	0	0	0	113.3	A633	P629-A633 WeakPolarHBondContact O-CB 3.17Å; P629-A633 PolarHBondContact O-N 3.12Å; P629-A633 VanDerWaalsContact O-N 3.17Å
630	S	92.9	Very high	91.5	Very high	54 Å²	54	34.6 Å²	34.6	38%	0.378	20%	0.195	S	C	.	.	H	α-helix	trans	-73.7	-40.3	177.2	-57.5	0	0	0	0	112	H627 I628 A633 M634	H627-S630 PolarHBondContact O-N 2.99Å; H627-S630 VanDerWaalsContact O-N 3.11Å; I628-S630 VanDerWaalsContact C-N 3.3Å; I628-S630 PolarHBondContact O-N 2.87Å; S630-A633 PolarHBondContact O-N 2.92Å; S630-M634 WeakPolarHBondContact O-CG 3.06Å; S630-M634 PolarHBondContact O-N 2.89Å
631	V	95.1	Very high	90.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	22%	0.223	C	C	.	.	H	α-helix	trans	-60.8	-51.3	175.2	165.3	0	0	0	0	110.8	H627 I628 A633 M634 C635 L645 V664 F667 F669	H627-V631 HydrophobicContact CB-CG2 4.43Å; H627-V631 WeakPolarHBondContact O-CG2 3.47Å; H627-V631 PolarHBondContact O-N 2.83Å; I628-V631 PolarHBondContact O-N 2.92Å; V631-A633 VanDerWaalsContact C-N 3.31Å; V631-A633 PolarHBondContact O-N 3.36Å; V631-M634 WeakPolarHBondContact O-CB 3.45Å; V631-M634 PolarHBondContact O-N 2.86Å; V631-M634 VanDerWaalsContact O-N 3.14Å; V631-C635 PolarHBondContact O-N 2.96Å; V631-C635 PolarHBondContact O-SG 2.87Å; V631-C635 VanDerWaalsContact O-SG 3.41Å; V631-L645 HydrophobicContact CG1-CB 4.19Å; V631-L645 HydrophobicContact CG1-CD1 3.75Å; V631-L645 HydrophobicContact CG1-CG 4.3Å; V631-V664 HydrophobicContact CG2-CG1 4.3Å; V631-F667 HydrophobicContact CB-CD1 4.35Å; V631-F667 HydrophobicContact CB-CE1 4.38Å; V631-F667 HydrophobicContact CG1-CD1 4.13Å; V631-F667 HydrophobicContact CG1-CD2 4.32Å; V631-F667 HydrophobicContact CG1-CE1 4.04Å; V631-F667 HydrophobicContact CG1-CE2 4.23Å; V631-F667 HydrophobicContact CG1-CG 4.26Å; V631-F667 HydrophobicContact CG1-CZ 4.1Å; V631-F667 HydrophobicContact CG2-CB 4.46Å; V631-F667 HydrophobicContact CG2-CD1 3.88Å; V631-F667 HydrophobicContact CG2-CE1 4.39Å; V631-F667 HydrophobicContact CG2-CG 4.23Å; V631-F669 HydrophobicContact CG1-CE2 3.71Å; V631-F669 HydrophobicContact CG1-CZ 4.16Å
632	N	93.5	Very high	90.2	Very high	31 Å²	31	42.6 Å²	42.6	17%	0.166	26%	0.261	C	S	.	.	H	α-helix	trans	-62.5	-37.4	178.9	-70.4	2.7	0	0	0	111.8	I628 C635 H636 D644 L645	I628-N632 WeakPolarHBondContact O-CB 3.4Å; I628-N632 PolarHBondContact O-N 2.86Å; I628-N632 PolarHBondContact O-OD1 2.83Å; N632-C635 WeakPolarHBondContact O-CB 3.32Å; N632-C635 PolarHBondContact O-N 2.88Å; N632-H636 WeakPolarHBondContact O-CB 3.44Å; N632-H636 PolarHBondContact O-N 3.38Å; N632-D644 PolarHBondContact ND2-OD1 2.9Å; N632-L645 PolarHBondContact OD1-N 2.83Å
633	A	91.3	Very high	89.8	Confident	57 Å²	57	41.8 Å²	41.8	47%	0.471	26%	0.26	S	S	.	.	H	α-helix	trans	-64.4	-42.1	173.7	0	0	0	0	0	112.3	P629 S630 V631 C635 H636 D637	P629-A633 WeakPolarHBondContact O-CB 3.17Å; P629-A633 PolarHBondContact O-N 3.12Å; P629-A633 VanDerWaalsContact O-N 3.17Å; S630-A633 PolarHBondContact O-N 2.92Å; V631-A633 VanDerWaalsContact C-N 3.31Å; V631-A633 PolarHBondContact O-N 3.36Å; A633-C635 VanDerWaalsContact C-N 3.35Å; A633-H636 PolarHBondContact O-N 2.77Å; A633-D637 PolarHBondContact O-N 2.75Å
634	M	93.4	Very high	89.6	Confident	24 Å²	24	44.2 Å²	44.2	12%	0.118	27%	0.272	C	S	.	.	H	α-helix	trans	-64.4	-37.5	173	-73.4	176.4	67.9	0	0	112.3	S630 V631 S638 V664 F667 L685 H687	S630-M634 WeakPolarHBondContact O-CG 3.06Å; S630-M634 PolarHBondContact O-N 2.89Å; V631-M634 WeakPolarHBondContact O-CB 3.45Å; V631-M634 PolarHBondContact O-N 2.86Å; V631-M634 VanDerWaalsContact O-N 3.14Å; M634-S638 WeakPolarHBondContact O-CB 3.28Å; M634-S638 PolarHBondContact O-N 3.06Å; M634-S638 PolarHBondContact O-OG 3.04Å; M634-V664 HydrophobicContact SD-CB 4.03Å; M634-V664 HydrophobicContact SD-CG1 3.7Å; M634-F667 HydrophobicContact CB-CE1 3.85Å; M634-F667 HydrophobicContact CB-CZ 4.49Å; M634-F667 HydrophobicContact CE-CD1 4.36Å; M634-F667 HydrophobicContact CE-CE1 4.05Å; M634-F667 HydrophobicContact SD-CD1 4.42Å; M634-F667 HydrophobicContact SD-CE1 4.15Å; M634-L685 HydrophobicContact CB-CD2 3.99Å; M634-L685 HydrophobicContact CE-CD2 4.08Å; M634-L685 HydrophobicContact CE-CG 4.4Å; M634-H687 HydrophobicContact CE-CB 4.14Å
635	C	92	Very high	89.6	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	27%	0.272	C	S	.	.	H	α-helix	trans	-64	-45.9	174	-72.4	0	0	0	0	112.3	V631 N632 A633 D637 S638 F639 V643 F667	V631-C635 PolarHBondContact O-N 2.96Å; V631-C635 PolarHBondContact O-SG 2.87Å; V631-C635 VanDerWaalsContact O-SG 3.41Å; N632-C635 WeakPolarHBondContact O-CB 3.32Å; N632-C635 PolarHBondContact O-N 2.88Å; A633-C635 VanDerWaalsContact C-N 3.35Å; C635-D637 VanDerWaalsContact C-N 3.29Å; C635-D637 PolarHBondContact O-N 2.74Å; C635-S638 PolarHBondContact O-N 2.97Å; C635-F639 HydrophobicContact CB-CD2 4.04Å; C635-F639 WeakPolarHBondContact O-CB 3.36Å; C635-F639 PolarHBondContact O-N 2.84Å; C635-V643 HydrophobicContact CB-CB 3.85Å; C635-V643 HydrophobicContact CB-CG1 3.7Å; C635-F667 WeakPolarHBondContact SG-CZ 3.46Å
636	H	87.9	Confident	89.7	Confident	66 Å²	66	42.5 Å²	42.5	31%	0.306	26%	0.263	S	S	.	.	H	α-helix	trans	-57.5	-41.6	177.7	175.6	-79.3	0	0	0	112.3	R485 N632 A633	R485-H636 PolarHBondContact O-CE1 2.85Å; R485-H636 VanDerWaalsContact O-CE1 3.29Å; N632-H636 WeakPolarHBondContact O-CB 3.44Å; N632-H636 PolarHBondContact O-N 3.38Å; A633-H636 PolarHBondContact O-N 2.77Å
637	D	87.3	Confident	89.7	Confident	97 Å²	97	43.7 Å²	43.7	52%	0.519	27%	0.266	S	S	.	.	H	α-helix	trans	-87.9	-9	-177.9	-85.4	29.8	0	0	0	114.1	R485 A633 C635	R485-D637 IonicContact NH1-OD2 3.75Å; R485-D637 PolarHBondContact NH1-OD2 2.9Å; R485-D637 VanDerWaalsContact NH1-OD2 3.15Å; A633-D637 PolarHBondContact O-N 2.75Å; C635-D637 VanDerWaalsContact C-N 3.29Å; C635-D637 PolarHBondContact O-N 2.74Å
638	S	87.6	Confident	89.7	Confident	50 Å²	50	43.6 Å²	43.6	35%	0.35	27%	0.265	S	S	.	.	H	α-helix	trans	-125.5	-6.6	-176.2	-46	0	0	0	0	115.9	M634 C635	M634-S638 WeakPolarHBondContact O-CB 3.28Å; M634-S638 PolarHBondContact O-N 3.06Å; M634-S638 PolarHBondContact O-OG 3.04Å; C635-S638 PolarHBondContact O-N 2.97Å
639	F	87.9	Confident	89.6	Confident	53 Å²	53	44 Å²	44	23%	0.232	27%	0.267	C	S	.	.	S	Bend	trans	-132.2	-91.9	177.4	-59.9	-61	0	0	0	110	C635 F667 F683 L685	C635-F639 HydrophobicContact CB-CD2 4.04Å; C635-F639 WeakPolarHBondContact O-CB 3.36Å; C635-F639 PolarHBondContact O-N 2.84Å; F639-F667 HydrophobicContact CE2-CZ 4.48Å; F639-F683 AromaticContact CD2-CD1 3.96Å; F639-F683 HydrophobicContact CD2-CD1 3.96Å; F639-F683 HydrophobicContact CD2-CE1 4.27Å; F639-F683 AromaticContact CE2-CD1 3.78Å; F639-F683 HydrophobicContact CE2-CD1 3.78Å; F639-F683 HydrophobicContact CZ-CD1 4.29Å; F639-L685 HydrophobicContact CE2-CB 4.26Å; F639-L685 HydrophobicContact CE2-CD2 4.16Å; F639-L685 HydrophobicContact CZ-CB 4.1Å; F639-L685 HydrophobicContact CZ-CD1 4.3Å
640	W	85.8	Confident	89.5	Confident	43 Å²	43	44 Å²	44	16%	0.163	26%	0.261	C	S	.	.			trans	-150.8	155.3	177.9	56.8	87.6	0	0	0	110.8	V643 F683 Y741 Y744	W640-V643 HydrophobicContact CD2-CG2 4.19Å; W640-V643 HydrophobicContact CG-CG2 4.16Å; W640-V643 HydrophobicContact CZ2-CG2 4.26Å; W640-V643 VanDerWaalsContact NE1-CG2 3.35Å; W640-F683 HydrophobicContact CH2-CE1 4.32Å; W640-F683 HydrophobicContact CZ2-CE1 4.34Å; W640-F683 HydrophobicContact CZ2-CZ 4.39Å; W640-Y741 HydrophobicContact CH2-CE1 4.46Å; W640-Y741 AromaticContact CZ3-CD1 3.93Å; W640-Y741 HydrophobicContact CZ3-CD1 3.93Å; W640-Y741 AromaticContact CZ3-CE1 3.98Å; W640-Y741 HydrophobicContact CZ3-CE1 3.98Å; W640-Y744 HydrophobicContact CD2-CD1 4.31Å; W640-Y744 HydrophobicContact CD2-CD2 4.34Å; W640-Y744 AromaticContact CD2-CG 3.88Å; W640-Y744 HydrophobicContact CD2-CG 3.88Å; W640-Y744 AromaticContact CE2-CD1 3.78Å; W640-Y744 AromaticContact CE2-CG 3.74Å; W640-Y744 HydrophobicContact CE3-CD2 4.22Å; W640-Y744 HydrophobicContact CE3-CG 4.16Å; W640-Y744 HydrophobicContact CG-CG 4.4Å; W640-Y744 AromaticContact CH2-CD2 3.84Å; W640-Y744 HydrophobicContact CH2-CD2 3.84Å; W640-Y744 AromaticContact CH2-CE2 3.89Å; W640-Y744 HydrophobicContact CH2-CE2 3.89Å; W640-Y744 HydrophobicContact CH2-CG 4.27Å; W640-Y744 HydrophobicContact CZ2-CD1 4.04Å; W640-Y744 AromaticContact CZ2-CD2 3.92Å; W640-Y744 HydrophobicContact CZ2-CD2 3.92Å; W640-Y744 HydrophobicContact CZ2-CE1 4.07Å; W640-Y744 AromaticContact CZ2-CE2 3.93Å; W640-Y744 HydrophobicContact CZ2-CE2 3.93Å; W640-Y744 AromaticContact CZ2-CG 3.96Å; W640-Y744 HydrophobicContact CZ2-CG 3.96Å; W640-Y744 AromaticContact CZ2-CZ 3.99Å; W640-Y744 AromaticContact CZ3-CD2 3.99Å; W640-Y744 HydrophobicContact CZ3-CD2 3.99Å; W640-Y744 HydrophobicContact CZ3-CE2 4.46Å; W640-Y744 HydrophobicContact CZ3-CG 4.36Å; W640-Y744 AromaticContact NE1-CD1 3.77Å
641	P	82.4	Confident	89.4	Confident	91 Å²	91	43 Å²	43	59%	0.591	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-65.5	145.7	178.6	27	-35.7	0	0	0	112
642	G	81.7	Confident	89.3	Confident	78 Å²	78	43.1 Å²	43.1	80%	0.804	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.8	6.3	177	0	0	0	0	0	115.8	D644	G642-D644 PolarHBondContact O-N 3.44Å
643	V	88.1	Confident	89.3	Confident	18 Å²	18	41.9 Å²	41.9	11%	0.109	24%	0.244	C	C	.	.			trans	-69.7	123.1	167.6	177.2	0	0	0	0	110.1	C635 W640 L645 F683	C635-V643 HydrophobicContact CB-CB 3.85Å; C635-V643 HydrophobicContact CB-CG1 3.7Å; W640-V643 HydrophobicContact CD2-CG2 4.19Å; W640-V643 HydrophobicContact CG-CG2 4.16Å; W640-V643 HydrophobicContact CZ2-CG2 4.26Å; W640-V643 VanDerWaalsContact NE1-CG2 3.35Å; V643-L645 HydrophobicContact CG1-CD2 3.68Å; V643-L645 HydrophobicContact CG1-CG 3.98Å; V643-F683 HydrophobicContact CG1-CE1 3.94Å; V643-F683 HydrophobicContact CG1-CE2 4.49Å; V643-F683 HydrophobicContact CG1-CZ 3.85Å; V643-F683 HydrophobicContact CG2-CE1 4.33Å; V643-F683 HydrophobicContact CG2-CZ 4.45Å
644	D	89.5	Confident	89.5	Confident	54 Å²	54	40.1 Å²	40.1	29%	0.289	23%	0.225	S	C	.	.			trans	-123.6	119.3	170.4	179.6	14.9	0	0	0	110.1	N632 G642 S646	N632-D644 PolarHBondContact ND2-OD1 2.9Å; G642-D644 PolarHBondContact O-N 3.44Å; D644-S646 VanDerWaalsContact OD1-CB 3.23Å; D644-S646 WeakPolarHBondContact OD1-CB 3.43Å; D644-S646 PolarHBondContact OD1-N 3.39Å; D644-S646 PolarHBondContact OD1-OG 2.63Å; D644-S646 PolarHBondContact OD2-OG 3.07Å
645	L	91.8	Very high	89.6	Confident	8 Å²	8	39 Å²	39	4%	0.042	22%	0.22	C	C	.	.			trans	-100.7	17.1	179.1	-53.7	-169.7	0	0	0	113	V631 N632 V643 E647 C648 F667 F669 F683	V631-L645 HydrophobicContact CG1-CB 4.19Å; V631-L645 HydrophobicContact CG1-CD1 3.75Å; V631-L645 HydrophobicContact CG1-CG 4.3Å; N632-L645 PolarHBondContact OD1-N 2.83Å; V643-L645 HydrophobicContact CG1-CD2 3.68Å; V643-L645 HydrophobicContact CG1-CG 3.98Å; L645-E647 PolarHBondContact O-N 3.04Å; L645-E647 VanDerWaalsContact O-N 3.12Å; L645-C648 WeakPolarHBondContact O-CB 3.33Å; L645-C648 PolarHBondContact O-N 3.26Å; L645-F667 HydrophobicContact CD1-CE2 4.17Å; L645-F669 HydrophobicContact CB-CE2 4.5Å; L645-F669 HydrophobicContact CD1-CD2 3.57Å; L645-F669 HydrophobicContact CD1-CE2 3.65Å; L645-F683 HydrophobicContact CD1-CB 4.08Å; L645-F683 HydrophobicContact CD1-CD2 3.99Å; L645-F683 HydrophobicContact CD1-CG 4Å; L645-F683 HydrophobicContact CD2-CD2 3.46Å; L645-F683 VanDerWaalsContact CD2-CD2 3.46Å; L645-F683 HydrophobicContact CD2-CE2 3.42Å; L645-F683 VanDerWaalsContact CD2-CE2 3.42Å; L645-F683 HydrophobicContact CD2-CG 4.18Å; L645-F683 HydrophobicContact CD2-CZ 4.09Å; L645-F683 HydrophobicContact CG-CD2 4.43Å
646	S	91.6	Very high	89.9	Confident	1 Å²	1	39 Å²	39	1%	0.007	22%	0.22	C	C	.	.	G	3₁₀ helix	trans	-54.2	-28.2	173.4	-63.3	0	0	0	0	113.4	L534 D644 C648 L649	L534-S646 WeakPolarHBondContact CD2-OG 3.19Å; L534-S646 WeakPolarHBondContact CG-OG 3.37Å; D644-S646 VanDerWaalsContact OD1-CB 3.23Å; D644-S646 WeakPolarHBondContact OD1-CB 3.43Å; D644-S646 PolarHBondContact OD1-N 3.39Å; D644-S646 PolarHBondContact OD1-OG 2.63Å; D644-S646 PolarHBondContact OD2-OG 3.07Å; S646-C648 VanDerWaalsContact C-N 3.29Å; S646-C648 PolarHBondContact O-N 3.36Å; S646-L649 WeakPolarHBondContact O-CB 3.48Å; S646-L649 WeakPolarHBondContact O-CG 3.35Å; S646-L649 PolarHBondContact O-N 2.73Å
647	E	88.2	Confident	90.3	Very high	115 Å²	115	35.8 Å²	35.8	54%	0.537	21%	0.205	S	C	.	.	G	3₁₀ helix	trans	-68.7	-24.4	178.5	-62.1	-162.4	155.2	0	0	113.6	I533 L645 L649 Q650	I533-E647 HydrophobicContact CD1-CG 4.45Å; L645-E647 PolarHBondContact O-N 3.04Å; L645-E647 VanDerWaalsContact O-N 3.12Å; E647-L649 PolarHBondContact O-N 3.15Å; E647-Q650 WeakPolarHBondContact O-CB 3.44Å; E647-Q650 WeakPolarHBondContact O-CG 3.41Å; E647-Q650 PolarHBondContact O-N 3.44Å; E647-Q650 VanDerWaalsContact O-N 3.09Å; E647-Q650 PolarHBondContact O-NE2 3.12Å
648	C	90.8	Very high	90.8	Very high	3 Å²	3	31.2 Å²	31.2	2%	0.02	18%	0.18	C	C	.	.	G	3₁₀ helix	trans	-68	-14.5	178.6	-57.8	0	0	0	0	113.2	L645 S646 Q650 Y651 F669	L645-C648 WeakPolarHBondContact O-CB 3.33Å; L645-C648 PolarHBondContact O-N 3.26Å; S646-C648 VanDerWaalsContact C-N 3.29Å; S646-C648 PolarHBondContact O-N 3.36Å; C648-Q650 PolarHBondContact O-N 3.47Å; C648-Y651 HydrophobicContact CB-CE2 4.06Å; C648-Y651 PolarHBondContact O-N 3.22Å; C648-Y651 PolarHBondContact SG-OH 3.12Å; C648-Y651 VanDerWaalsContact SG-OH 3.33Å; C648-F669 HydrophobicContact CB-CD1 3.44Å; C648-F669 VanDerWaalsContact CB-CD1 3.44Å; C648-F669 HydrophobicContact CB-CE1 3.6Å; C648-F669 HydrophobicContact CB-CG 4.24Å
649	L	91.2	Very high	91.1	Very high	8 Å²	8	29 Å²	29	4%	0.042	17%	0.165	C	C	.	.	G	3₁₀ helix	trans	-64	-12.8	169.8	-64	172	0	0	0	113.1	L534 F537 V623 P625 I628 S646 E647	L534-L649 HydrophobicContact CD2-CD1 3.74Å; F537-L649 HydrophobicContact CB-CD1 4.03Å; F537-L649 HydrophobicContact CD1-CB 3.97Å; F537-L649 HydrophobicContact CD2-CB 3.74Å; F537-L649 HydrophobicContact CD2-CD1 3.41Å; F537-L649 VanDerWaalsContact CD2-CD1 3.41Å; F537-L649 HydrophobicContact CD2-CG 4.22Å; F537-L649 HydrophobicContact CE1-CB 3.82Å; F537-L649 WeakPolarHBondContact CE1-O 3.31Å; F537-L649 HydrophobicContact CE2-CB 3.58Å; F537-L649 HydrophobicContact CE2-CD1 3.97Å; F537-L649 HydrophobicContact CE2-CG 4.43Å; F537-L649 HydrophobicContact CG-CB 3.94Å; F537-L649 HydrophobicContact CG-CD1 3.81Å; F537-L649 HydrophobicContact CG-CG 4.45Å; F537-L649 HydrophobicContact CZ-CB 3.62Å; V623-L649 HydrophobicContact CG1-CD2 4.16Å; V623-L649 HydrophobicContact CG2-CD2 4.03Å; P625-L649 HydrophobicContact CB-CD1 4.29Å; P625-L649 HydrophobicContact CG-CD1 4.28Å; P625-L649 HydrophobicContact CG-CD2 4.13Å; I628-L649 HydrophobicContact CD1-CD2 4.21Å; I628-L649 HydrophobicContact CD1-CG 4.16Å; I628-L649 HydrophobicContact CG1-CD1 3.92Å; I628-L649 HydrophobicContact CG1-CD2 4.08Å; I628-L649 HydrophobicContact CG1-CG 4.03Å; S646-L649 WeakPolarHBondContact O-CB 3.48Å; S646-L649 WeakPolarHBondContact O-CG 3.35Å; S646-L649 PolarHBondContact O-N 2.73Å; E647-L649 PolarHBondContact O-N 3.15Å
650	Q	89.4	Confident	91.4	Very high	74 Å²	74	27.3 Å²	27.3	35%	0.346	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-75.8	-33	175.3	-65.9	175.1	101	0	0	113	F537 Y573 E647 C648 P652	F537-Q650 HydrophobicContact CZ-CG 4.12Å; Y573-Q650 WeakPolarHBondContact CB-O 3.47Å; Y573-Q650 PolarHBondContact N-O 3.04Å; E647-Q650 WeakPolarHBondContact O-CB 3.44Å; E647-Q650 WeakPolarHBondContact O-CG 3.41Å; E647-Q650 PolarHBondContact O-N 3.44Å; E647-Q650 VanDerWaalsContact O-N 3.09Å; E647-Q650 PolarHBondContact O-NE2 3.12Å; C648-Q650 PolarHBondContact O-N 3.47Å; Q650-P652 VanDerWaalsContact C-CD 3.41Å; Q650-P652 WeakPolarHBondContact O-CD 3.49Å
651	Y	91	Very high	91.5	Very high	32 Å²	32	31.1 Å²	31.1	13%	0.125	17%	0.171	C	C	.	.	S	Bend	trans	-127.3	56.2	-173.6	44.9	-94.4	0	0	0	111.5	C648 D653 F654 M670 V671	C648-Y651 HydrophobicContact CB-CE2 4.06Å; C648-Y651 PolarHBondContact O-N 3.22Å; C648-Y651 PolarHBondContact SG-OH 3.12Å; C648-Y651 VanDerWaalsContact SG-OH 3.33Å; Y651-D653 PolarHBondContact O-N 2.84Å; Y651-D653 VanDerWaalsContact O-N 3.14Å; Y651-F654 PolarHBondContact O-N 3.16Å; Y651-F654 VanDerWaalsContact O-N 3.09Å; Y651-M670 WeakPolarHBondContact CD2-O 3.35Å; Y651-M670 WeakPolarHBondContact CE2-O 3.5Å; Y651-V671 HydrophobicContact CE2-CG2 4.44Å
652	P	93.2	Very high	91.6	Very high	3 Å²	3	30.2 Å²	30.2	2%	0.019	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-65.7	-20.7	-167.9	28.8	-36.8	0	0	0	114.2	L578 Y622 V623 Q650 F654 S655	L578-P652 HydrophobicContact CD1-CB 4.16Å; L578-P652 HydrophobicContact CD1-CG 4.03Å; Y622-P652 VanDerWaalsContact CD1-O 3.23Å; Y622-P652 WeakPolarHBondContact CD1-O 3.4Å; V623-P652 HydrophobicContact CG1-CB 3.96Å; Q650-P652 VanDerWaalsContact C-CD 3.41Å; Q650-P652 WeakPolarHBondContact O-CD 3.49Å; P652-F654 PolarHBondContact O-N 3.49Å; P652-S655 PolarHBondContact O-N 2.68Å; P652-S655 PolarHBondContact O-OG 2.72Å
653	D	93.3	Very high	92	Very high	5 Å²	5	31 Å²	31	3%	0.027	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-58	-39.3	173.8	-34.5	-117.2	0	0	0	111	S571 T574 L578 Y651 S655 T706	S571-D653 WeakPolarHBondContact CB-OD1 3.45Å; S571-D653 WeakPolarHBondContact CB-OD2 3.3Å; S571-D653 PolarHBondContact OG-OD2 2.8Å; T574-D653 HydrophobicContact CG2-CB 4.35Å; T574-D653 VanDerWaalsContact CG2-CG 3.47Å; T574-D653 WeakPolarHBondContact CG2-OD1 3.3Å; T574-D653 WeakPolarHBondContact CG2-OD2 3.44Å; T574-D653 PolarHBondContact OG1-OD1 3.41Å; T574-D653 PolarHBondContact OG1-OD2 2.69Å; L578-D653 HydrophobicContact CD1-CB 4.48Å; L578-D653 HydrophobicContact CD2-CB 4.31Å; Y651-D653 PolarHBondContact O-N 2.84Å; Y651-D653 VanDerWaalsContact O-N 3.14Å; D653-S655 PolarHBondContact O-N 3.42Å; D653-S655 VanDerWaalsContact O-N 3.14Å; D653-T706 HydrophobicContact CB-CG2 4.4Å
654	F	94.9	Very high	92.4	Very high	19 Å²	19	30.7 Å²	30.7	8%	0.083	15%	0.145	C	C	.	.	G	3₁₀ helix	trans	-90	35.9	-175.5	-50.8	-85.9	0	0	0	111.3	Y573 T574 Y651 P652 M670 P672 L703 T706 C707	Y573-F654 AromaticContact CD1-CE2 3.76Å; Y573-F654 HydrophobicContact CD1-CE2 3.76Å; Y573-F654 HydrophobicContact CE1-CE2 4.01Å; Y573-F654 HydrophobicContact CE1-CZ 4.44Å; T574-F654 HydrophobicContact CG2-CE2 3.89Å; T574-F654 HydrophobicContact CG2-CZ 4.21Å; Y651-F654 PolarHBondContact O-N 3.16Å; Y651-F654 VanDerWaalsContact O-N 3.09Å; P652-F654 PolarHBondContact O-N 3.49Å; F654-M670 HydrophobicContact CB-CB 4.39Å; F654-M670 HydrophobicContact CB-CE 4.32Å; F654-M670 WeakPolarHBondContact CB-O 3.31Å; F654-M670 HydrophobicContact CD1-CE 3.9Å; F654-M670 PolarHBondContact O-N 2.95Å; F654-P672 HydrophobicContact CD1-CB 4.23Å; F654-P672 HydrophobicContact CD2-CB 4.28Å; F654-P672 HydrophobicContact CD2-CG 3.82Å; F654-P672 HydrophobicContact CE1-CB 4.16Å; F654-P672 HydrophobicContact CE2-CB 4.2Å; F654-P672 HydrophobicContact CE2-CG 3.94Å; F654-P672 HydrophobicContact CG-CB 4.29Å; F654-P672 HydrophobicContact CG-CG 4.15Å; F654-P672 HydrophobicContact CZ-CB 4.14Å; F654-P672 HydrophobicContact CZ-CG 4.38Å; F654-L703 WeakPolarHBondContact O-CD2 3.27Å; F654-T706 HydrophobicContact CD1-CG2 3.61Å; F654-T706 HydrophobicContact CE1-CG2 3.74Å; F654-T706 HydrophobicContact CG-CG2 4.33Å; F654-C707 VanDerWaalsContact CD1-SG 3.54Å; F654-C707 WeakPolarHBondContact CE1-SG 3.46Å
655	S	96.3	Very high	92.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	149.1	-178.1	78.5	0	0	0	0	111.8	Y622 V623 P652 D653 G668	Y622-S655 WeakPolarHBondContact CD1-O 3.22Å; V623-S655 WeakPolarHBondContact CB-OG 3.19Å; V623-S655 VanDerWaalsContact CG1-OG 3.24Å; V623-S655 WeakPolarHBondContact CG1-OG 3.17Å; V623-S655 PolarHBondContact N-OG 2.8Å; P652-S655 PolarHBondContact O-N 2.68Å; P652-S655 PolarHBondContact O-OG 2.72Å; D653-S655 PolarHBondContact O-N 3.42Å; D653-S655 VanDerWaalsContact O-N 3.14Å; S655-G668 WeakPolarHBondContact CA-O 3.39Å
656	V	97.4	Very high	92.9	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	133.2	172.2	53	0	0	0	0	109.3	I582 Y620 F667 G668 M699 L703	I582-V656 HydrophobicContact CD1-CB 4Å; I582-V656 HydrophobicContact CD1-CG2 3.83Å; Y620-V656 HydrophobicContact CD1-CG2 4.1Å; V656-F667 CarbonylContact O-C 3.58Å; V656-F667 WeakPolarHBondContact O-CA 3.16Å; V656-G668 PolarHBondContact N-O 3.01Å; V656-G668 PolarHBondContact O-N 3.23Å; V656-M699 HydrophobicContact CB-CG 4.38Å; V656-M699 HydrophobicContact CG1-CB 3.63Å; V656-M699 HydrophobicContact CG1-CG 3.61Å; V656-M699 HydrophobicContact CG1-SD 4.06Å; V656-M699 HydrophobicContact CG2-CG 3.82Å; V656-M699 HydrophobicContact CG2-SD 4.37Å; V656-L703 HydrophobicContact CG1-CD1 4.48Å; V656-L703 HydrophobicContact CG1-CD2 4.35Å; V656-L703 HydrophobicContact CG1-CG 4.21Å
657	V	97.4	Very high	93.2	Very high	0 Å²	0	27.8 Å²	27.8	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	119.9	174.9	-175.8	0	0	0	0	107.1	Y620 C621 V623 H627 L659 V664 F667 F669	Y620-V657 WeakPolarHBondContact CA-O 3.08Å; C621-V657 PolarHBondContact N-O 3.35Å; C621-V657 PolarHBondContact O-N 3.37Å; C621-V657 PolarHBondContact SG-O 3.06Å; C621-V657 VanDerWaalsContact SG-O 3.36Å; V623-V657 HydrophobicContact CB-CG2 4.17Å; V623-V657 HydrophobicContact CG2-CG2 4.3Å; H627-V657 HydrophobicContact CB-CG1 4.34Å; H627-V657 HydrophobicContact CB-CG2 4.5Å; V657-L659 HydrophobicContact CG1-CD2 3.81Å; V657-L659 HydrophobicContact CG1-CG 4.44Å; V657-V664 HydrophobicContact CG1-CG1 3.88Å; V657-V664 HydrophobicContact CG1-CG2 4.11Å; V657-F667 HydrophobicContact CG2-CB 4.36Å; V657-F669 HydrophobicContact CG2-CZ 4.48Å
658	A	97.3	Very high	93.7	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	122.7	173.2	0	0	0	0	0	109.1	I618 Y620 V665 G666 I695 M699	I618-A658 HydrophobicContact CG2-CB 4.31Å; Y620-A658 HydrophobicContact CD1-CB 3.92Å; Y620-A658 HydrophobicContact CE1-CB 3.92Å; A658-V665 HydrophobicContact CB-CG2 3.95Å; A658-V665 WeakPolarHBondContact O-CG2 3.21Å; A658-V665 PolarHBondContact O-N 2.91Å; A658-G666 PolarHBondContact N-O 2.93Å; A658-G666 PolarHBondContact O-N 3.06Å; A658-I695 HydrophobicContact CB-CG2 3.75Å; A658-M699 HydrophobicContact CB-SD 4.36Å
659	L	94.9	Very high	94	Very high	4 Å²	4	22.1 Å²	22.1	2%	0.021	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	146.1	177.3	-56	179.7	0	0	0	110.3	L565 I618 D619 V657 V663 V664	L565-L659 HydrophobicContact CD2-CD1 3.68Å; I618-L659 CarbonylContact C-O 3.58Å; I618-L659 WeakPolarHBondContact CA-O 2.74Å; D619-L659 HydrophobicContact CB-CB 4.35Å; D619-L659 PolarHBondContact N-O 3.25Å; D619-L659 PolarHBondContact O-N 3.28Å; V657-L659 HydrophobicContact CG1-CD2 3.81Å; V657-L659 HydrophobicContact CG1-CG 4.44Å; L659-V663 CarbonylContact C-O 3.55Å; L659-V663 VanDerWaalsContact CA-O 3.28Å; L659-V663 WeakPolarHBondContact CA-O 3.48Å; L659-V664 HydrophobicContact CD2-CB 4.31Å; L659-V664 HydrophobicContact CD2-CG2 3.69Å
660	Y	92.9	Very high	94.1	Very high	18 Å²	18	21.8 Å²	21.8	7%	0.071	10%	0.101	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	116.7	157	178.9	-96.7	0	0	0	108.9	L593 A616 I618 K662 V663 W690	L593-Y660 HydrophobicContact CD1-CD2 4.02Å; L593-Y660 HydrophobicContact CD1-CE2 3.67Å; L593-Y660 HydrophobicContact CD2-CD1 4.41Å; L593-Y660 HydrophobicContact CD2-CD2 4.07Å; L593-Y660 HydrophobicContact CD2-CE1 3.94Å; L593-Y660 HydrophobicContact CD2-CE2 3.54Å; L593-Y660 HydrophobicContact CD2-CG 4.46Å; L593-Y660 VanDerWaalsContact CD2-CZ 3.47Å; L593-Y660 HydrophobicContact CG-CE2 4.26Å; A616-Y660 HydrophobicContact CB-CE2 4.02Å; A616-Y660 WeakPolarHBondContact O-CE2 3.09Å; I618-Y660 HydrophobicContact CG1-CD2 4.44Å; Y660-K662 VanDerWaalsContact C-N 3.3Å; Y660-K662 PolarHBondContact O-N 3.2Å; Y660-V663 PolarHBondContact N-O 3.34Å; Y660-V663 PolarHBondContact O-N 3.21Å; Y660-W690 VanDerWaalsContact CB-CH2 3.43Å; Y660-W690 AromaticContact CD1-CH2 3.78Å; Y660-W690 HydrophobicContact CD1-CH2 3.78Å; Y660-W690 AromaticContact CD2-CH2 3.89Å; Y660-W690 HydrophobicContact CD2-CH2 3.89Å; Y660-W690 HydrophobicContact CD2-CZ3 4.01Å; Y660-W690 HydrophobicContact CE1-CH2 4.5Å; Y660-W690 AromaticContact CG-CH2 3.42Å; Y660-W690 HydrophobicContact CG-CH2 3.42Å; Y660-W690 VanDerWaalsContact CG-CH2 3.42Å; Y660-W690 HydrophobicContact CG-CZ2 4.44Å; Y660-W690 AromaticContact CG-CZ3 3.88Å; Y660-W690 HydrophobicContact CG-CZ3 3.88Å
661	R	88.1	Confident	94.3	Very high	122 Å²	122	20.3 Å²	20.3	46%	0.46	10%	0.097	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.3	-85.6	-165.1	-61.2	-177.4	175.5	-165.3	-4.3	111.7	E613 A616	E613-R661 IonicContact OE2-NH2 2.7Å; A616-R661 HydrophobicContact CB-CG 3.49Å; A616-R661 VanDerWaalsContact CB-CG 3.49Å
662	K	85.1	Confident	94.1	Very high	73 Å²	73	19.2 Å²	19.2	32%	0.317	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-134.8	6.6	177.4	-60.6	-175.1	-175.6	174.7	0	114.1	M559 G560 E562 Y660	M559-K662 WeakPolarHBondContact O-CD 3.49Å; M559-K662 PolarHBondContact O-NZ 2.88Å; G560-K662 PolarHBondContact O-NZ 3.41Å; E562-K662 VanDerWaalsContact CD-NZ 3.35Å; E562-K662 IonicContact OE1-NZ 3.42Å; E562-K662 PolarHBondContact OE1-NZ 3.14Å; E562-K662 IonicContact OE2-NZ 3.57Å; Y660-K662 VanDerWaalsContact C-N 3.3Å; Y660-K662 PolarHBondContact O-N 3.2Å
663	V	90.6	Very high	93.7	Very high	95 Å²	95	22.2 Å²	22.2	58%	0.576	11%	0.11	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-94.2	129.4	178.2	-179.2	0	0	0	0	108.7	L659 Y660 V665	L659-V663 CarbonylContact C-O 3.55Å; L659-V663 VanDerWaalsContact CA-O 3.28Å; L659-V663 WeakPolarHBondContact CA-O 3.48Å; Y660-V663 PolarHBondContact N-O 3.34Å; Y660-V663 PolarHBondContact O-N 3.21Å; V663-V665 HydrophobicContact CG1-CG1 4.43Å; V663-V665 PolarHBondContact O-N 3.03Å
664	V	95.3	Very high	93.3	Very high	11 Å²	11	25.8 Å²	25.8	7%	0.067	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70	121.8	170	-178	0	0	0	0	108.7	V631 M634 V657 L659 F667	V631-V664 HydrophobicContact CG2-CG1 4.3Å; M634-V664 HydrophobicContact SD-CB 4.03Å; M634-V664 HydrophobicContact SD-CG1 3.7Å; V657-V664 HydrophobicContact CG1-CG1 3.88Å; V657-V664 HydrophobicContact CG1-CG2 4.11Å; L659-V664 HydrophobicContact CD2-CB 4.31Å; L659-V664 HydrophobicContact CD2-CG2 3.69Å; V664-F667 HydrophobicContact CG1-CD1 4.23Å
665	V	96.1	Very high	92.7	Very high	1 Å²	1	30.2 Å²	30.2	1%	0.006	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	-15.9	179.6	-58.3	0	0	0	0	112.7	I618 A658 V663 H687 W690 I695	I618-V665 HydrophobicContact CG2-CG2 4.46Å; A658-V665 HydrophobicContact CB-CG2 3.95Å; A658-V665 WeakPolarHBondContact O-CG2 3.21Å; A658-V665 PolarHBondContact O-N 2.91Å; V663-V665 HydrophobicContact CG1-CG1 4.43Å; V663-V665 PolarHBondContact O-N 3.03Å; V665-H687 WeakPolarHBondContact O-CB 3.47Å; V665-H687 PolarHBondContact O-N 3.04Å; V665-W690 HydrophobicContact CB-CB 4.36Å; V665-W690 HydrophobicContact CB-CD2 3.65Å; V665-W690 HydrophobicContact CB-CE3 3.9Å; V665-W690 HydrophobicContact CB-CG 3.82Å; V665-W690 HydrophobicContact CG1-CD2 3.57Å; V665-W690 VanDerWaalsContact CG1-CE2 3.47Å; V665-W690 HydrophobicContact CG1-CE3 3.82Å; V665-W690 HydrophobicContact CG1-CG 4.15Å; V665-W690 HydrophobicContact CG1-CH2 3.99Å; V665-W690 HydrophobicContact CG1-CZ2 3.71Å; V665-W690 HydrophobicContact CG1-CZ3 4.03Å; V665-W690 HydrophobicContact CG2-CD2 4.24Å; V665-W690 HydrophobicContact CG2-CE3 3.98Å; V665-I695 HydrophobicContact CG2-CD1 4.38Å
666	G	96.9	Very high	91.8	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-170.2	167.4	169.7	0	0	0	0	0	112.2	A658 L685	A658-G666 PolarHBondContact N-O 2.93Å; A658-G666 PolarHBondContact O-N 3.06Å; G666-L685 CarbonylContact C-O 3.55Å; G666-L685 WeakPolarHBondContact CA-O 3.13Å
667	F	97.9	Very high	91.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	158.9	173.4	55	-95.5	0	0	0	111.5	V631 M634 C635 F639 L645 V656 V657 V664 F669 F683 L685 M699	V631-F667 HydrophobicContact CB-CD1 4.35Å; V631-F667 HydrophobicContact CB-CE1 4.38Å; V631-F667 HydrophobicContact CG1-CD1 4.13Å; V631-F667 HydrophobicContact CG1-CD2 4.32Å; V631-F667 HydrophobicContact CG1-CE1 4.04Å; V631-F667 HydrophobicContact CG1-CE2 4.23Å; V631-F667 HydrophobicContact CG1-CG 4.26Å; V631-F667 HydrophobicContact CG1-CZ 4.1Å; V631-F667 HydrophobicContact CG2-CB 4.46Å; V631-F667 HydrophobicContact CG2-CD1 3.88Å; V631-F667 HydrophobicContact CG2-CE1 4.39Å; V631-F667 HydrophobicContact CG2-CG 4.23Å; M634-F667 HydrophobicContact CB-CE1 3.85Å; M634-F667 HydrophobicContact CB-CZ 4.49Å; M634-F667 HydrophobicContact CE-CD1 4.36Å; M634-F667 HydrophobicContact CE-CE1 4.05Å; M634-F667 HydrophobicContact SD-CD1 4.42Å; M634-F667 HydrophobicContact SD-CE1 4.15Å; C635-F667 WeakPolarHBondContact SG-CZ 3.46Å; F639-F667 HydrophobicContact CE2-CZ 4.48Å; L645-F667 HydrophobicContact CD1-CE2 4.17Å; V656-F667 CarbonylContact O-C 3.58Å; V656-F667 WeakPolarHBondContact O-CA 3.16Å; V657-F667 HydrophobicContact CG2-CB 4.36Å; V664-F667 HydrophobicContact CG1-CD1 4.23Å; F667-F669 HydrophobicContact CB-CE2 3.92Å; F667-F669 HydrophobicContact CB-CZ 4.49Å; F667-F669 AromaticContact CD2-CD2 3.61Å; F667-F669 HydrophobicContact CD2-CD2 3.61Å; F667-F669 AromaticContact CD2-CE2 3.43Å; F667-F669 HydrophobicContact CD2-CE2 3.43Å; F667-F669 VanDerWaalsContact CD2-CE2 3.43Å; F667-F669 HydrophobicContact CE2-CD2 4.25Å; F667-F669 HydrophobicContact CE2-CE2 4.17Å; F667-F669 HydrophobicContact CG-CD2 4.41Å; F667-F669 AromaticContact CG-CE2 3.84Å; F667-F669 HydrophobicContact CG-CE2 3.84Å; F667-F683 HydrophobicContact CE2-CB 4.25Å; F667-L685 HydrophobicContact CD2-CB 4.44Å; F667-L685 HydrophobicContact CE1-CB 4.02Å; F667-L685 HydrophobicContact CE1-CD2 3.85Å; F667-L685 HydrophobicContact CE1-CG 4.42Å; F667-L685 HydrophobicContact CE2-CB 3.89Å; F667-L685 HydrophobicContact CZ-CB 3.65Å; F667-L685 HydrophobicContact CZ-CD2 3.68Å; F667-L685 HydrophobicContact CZ-CG 4.28Å; F667-L685 PolarHBondContact N-O 3.02Å; F667-L685 PolarHBondContact O-N 3.09Å; F667-M699 VanDerWaalsContact C-SD 3.57Å
668	G	97.3	Very high	90.9	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	134.2	170.2	0	0	0	0	0	110.2	S655 V656 F683	S655-G668 WeakPolarHBondContact CA-O 3.39Å; V656-G668 PolarHBondContact N-O 3.01Å; V656-G668 PolarHBondContact O-N 3.23Å; G668-F683 CarbonylContact C-O 3.44Å; G668-F683 WeakPolarHBondContact CA-O 3.32Å
669	F	96.7	Very high	90.8	Very high	0 Å²	0	45.2 Å²	45.2	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	135.4	179.2	-67.2	-74	0	0	0	110.1	V623 V631 L645 C648 V657 F667 I681 S682 F683	V623-F669 HydrophobicContact CB-CE1 3.76Å; V623-F669 HydrophobicContact CB-CZ 4.3Å; V623-F669 HydrophobicContact CG1-CE1 4.13Å; V623-F669 HydrophobicContact CG2-CE1 3.72Å; V623-F669 HydrophobicContact CG2-CZ 3.86Å; V631-F669 HydrophobicContact CG1-CE2 3.71Å; V631-F669 HydrophobicContact CG1-CZ 4.16Å; L645-F669 HydrophobicContact CB-CE2 4.5Å; L645-F669 HydrophobicContact CD1-CD2 3.57Å; L645-F669 HydrophobicContact CD1-CE2 3.65Å; C648-F669 HydrophobicContact CB-CD1 3.44Å; C648-F669 VanDerWaalsContact CB-CD1 3.44Å; C648-F669 HydrophobicContact CB-CE1 3.6Å; C648-F669 HydrophobicContact CB-CG 4.24Å; V657-F669 HydrophobicContact CG2-CZ 4.48Å; F667-F669 HydrophobicContact CB-CE2 3.92Å; F667-F669 HydrophobicContact CB-CZ 4.49Å; F667-F669 AromaticContact CD2-CD2 3.61Å; F667-F669 HydrophobicContact CD2-CD2 3.61Å; F667-F669 AromaticContact CD2-CE2 3.43Å; F667-F669 HydrophobicContact CD2-CE2 3.43Å; F667-F669 VanDerWaalsContact CD2-CE2 3.43Å; F667-F669 HydrophobicContact CE2-CD2 4.25Å; F667-F669 HydrophobicContact CE2-CE2 4.17Å; F667-F669 HydrophobicContact CG-CD2 4.41Å; F667-F669 AromaticContact CG-CE2 3.84Å; F667-F669 HydrophobicContact CG-CE2 3.84Å; F669-I681 CarbonylContact O-C 3.57Å; F669-S682 PolarHBondContact O-N 3.06Å; F669-S682 PolarHBondContact O-OG 3.43Å; F669-F683 HydrophobicContact CD2-CB 4.46Å; F669-F683 PolarHBondContact N-O 2.96Å; F669-F683 PolarHBondContact O-N 3.01Å
670	M	94.6	Very high	90.8	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	132.4	177.6	-173.2	172.4	60.9	0	0	109.5	Y651 F654 P672 A679 Y680 I681 L703 C707 V712	Y651-M670 WeakPolarHBondContact CD2-O 3.35Å; Y651-M670 WeakPolarHBondContact CE2-O 3.5Å; F654-M670 HydrophobicContact CB-CB 4.39Å; F654-M670 HydrophobicContact CB-CE 4.32Å; F654-M670 WeakPolarHBondContact CB-O 3.31Å; F654-M670 HydrophobicContact CD1-CE 3.9Å; F654-M670 PolarHBondContact O-N 2.95Å; M670-P672 WeakPolarHBondContact O-CD 3.41Å; M670-A679 HydrophobicContact CE-CB 4.43Å; M670-A679 HydrophobicContact CG-CB 4.06Å; M670-A679 HydrophobicContact SD-CB 3.76Å; M670-Y680 CarbonylContact C-O 3.52Å; M670-Y680 VanDerWaalsContact CA-O 3.32Å; M670-Y680 WeakPolarHBondContact CA-O 3.44Å; M670-Y680 WeakPolarHBondContact CG-O 3.47Å; M670-I681 HydrophobicContact CB-CG1 4.43Å; M670-I681 HydrophobicContact CG-CG1 4.14Å; M670-I681 HydrophobicContact SD-CG1 4.08Å; M670-L703 HydrophobicContact CB-CD1 4.46Å; M670-L703 HydrophobicContact CB-CD2 4.02Å; M670-L703 HydrophobicContact CE-CB 4.11Å; M670-L703 HydrophobicContact CE-CD2 4.47Å; M670-L703 WeakPolarHBondContact CE-O 3.49Å; M670-L703 HydrophobicContact SD-CB 4.23Å; M670-C707 HydrophobicContact CE-CB 3.82Å; M670-C707 WeakPolarHBondContact CE-SG 3.37Å; M670-C707 HydrophobicContact SD-CB 4.49Å; M670-V712 HydrophobicContact SD-CG1 4.17Å
671	V	92.5	Very high	91	Very high	43 Å²	43	47.1 Å²	47.1	26%	0.261	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	114.4	171.4	-177	0	0	0	0	107	Y651 V674 Y680	Y651-V671 HydrophobicContact CE2-CG2 4.44Å; V671-V674 HydrophobicContact CB-CG2 3.98Å; V671-V674 HydrophobicContact CG1-CG2 3.73Å; V671-Y680 PolarHBondContact N-O 2.69Å; V671-Y680 PolarHBondContact O-N 2.8Å
672	P	86.8	Confident	91.2	Very high	9 Å²	9	42.5 Å²	42.5	6%	0.058	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	154.2	170.5	33.1	-36.1	0	0	0	110	Y573 F654 M670 V674	Y573-P672 HydrophobicContact CE1-CB 4.44Å; Y573-P672 HydrophobicContact CE1-CG 3.93Å; F654-P672 HydrophobicContact CD1-CB 4.23Å; F654-P672 HydrophobicContact CD2-CB 4.28Å; F654-P672 HydrophobicContact CD2-CG 3.82Å; F654-P672 HydrophobicContact CE1-CB 4.16Å; F654-P672 HydrophobicContact CE2-CB 4.2Å; F654-P672 HydrophobicContact CE2-CG 3.94Å; F654-P672 HydrophobicContact CG-CB 4.29Å; F654-P672 HydrophobicContact CG-CG 4.15Å; F654-P672 HydrophobicContact CZ-CB 4.14Å; F654-P672 HydrophobicContact CZ-CG 4.38Å; M670-P672 WeakPolarHBondContact O-CD 3.41Å; P672-V674 PolarHBondContact O-N 2.97Å
673	D	85.4	Confident	91.7	Very high	66 Å²	66	40.9 Å²	40.9	35%	0.353	21%	0.207	S	C	.	.	E	Extended strand (participates in β ladder)	trans	62.3	40	166	-63.3	-74.7	0	0	0	115.4	Y573 K675 E678 K710	Y573-D673 PolarHBondContact OH-OD2 3.38Å; D673-K675 VanDerWaalsContact C-N 3.28Å; D673-E678 WeakPolarHBondContact CA-O 3.26Å; D673-E678 PolarHBondContact N-O 3.32Å; D673-K710 IonicContact OD1-NZ 3.88Å; D673-K710 PolarHBondContact OD1-NZ 3.08Å; D673-K710 IonicContact OD2-NZ 3.57Å; D673-K710 PolarHBondContact OD2-NZ 2.85Å
674	V	84.7	Confident	92	Very high	80 Å²	80	37.8 Å²	37.8	49%	0.485	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	-31	170.3	175.8	0	0	0	0	111.3	V671 P672 E678	V671-V674 HydrophobicContact CB-CG2 3.98Å; V671-V674 HydrophobicContact CG1-CG2 3.73Å; P672-V674 PolarHBondContact O-N 2.97Å; V674-E678 PolarHBondContact N-O 2.91Å
675	K	82.9	Confident	92	Very high	113 Å²	113	37.8 Å²	37.8	49%	0.491	19%	0.187	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	168.5	154.7	-51.4	-164.4	-164.9	83.6	0	108.1	D673 S677 E678	D673-K675 VanDerWaalsContact C-N 3.28Å; K675-S677 PolarHBondContact O-N 2.85Å; K675-E678 HydrophobicContact CB-CB 3.99Å; K675-E678 HydrophobicContact CB-CG 4.06Å; K675-E678 WeakPolarHBondContact CD-OE1 3.37Å; K675-E678 HydrophobicContact CG-CB 4.42Å; K675-E678 HydrophobicContact CG-CG 4.4Å; K675-E678 WeakPolarHBondContact CG-OE2 3.46Å; K675-E678 IonicContact NZ-OE1 3.71Å; K675-E678 PolarHBondContact NZ-OE1 2.95Å; K675-E678 IonicContact NZ-OE2 3.66Å; K675-E678 PolarHBondContact NZ-OE2 3.07Å; K675-E678 PolarHBondContact O-N 3.45Å
676	Y	76.6	Confident	92	Very high	232 Å²	232	38.5 Å²	38.5	91%	0.91	19%	0.191	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.8	-30.6	-177.2	-64.4	-74.3	0	0	0	115.3
677	S	85.7	Confident	91.9	Very high	69 Å²	69	41.6 Å²	41.6	48%	0.483	21%	0.206	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119.8	15.3	179	60.5	0	0	0	0	113.6	K675 K710 D711	K675-S677 PolarHBondContact O-N 2.85Å; S677-K710 CarbonylContact O-C 3.51Å; S677-K710 WeakPolarHBondContact O-CA 3.37Å; S677-K710 WeakPolarHBondContact O-CB 3.25Å; S677-D711 PolarHBondContact O-N 2.99Å
678	E	91	Very high	91.7	Very high	13 Å²	13	45.1 Å²	45.1	6%	0.061	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	131.4	-172.7	-65.8	-178.7	-165.5	0	0	113.3	D673 V674 K675 D711 R759	D673-E678 WeakPolarHBondContact CA-O 3.26Å; D673-E678 PolarHBondContact N-O 3.32Å; V674-E678 PolarHBondContact N-O 2.91Å; K675-E678 HydrophobicContact CB-CB 3.99Å; K675-E678 HydrophobicContact CB-CG 4.06Å; K675-E678 WeakPolarHBondContact CD-OE1 3.37Å; K675-E678 HydrophobicContact CG-CB 4.42Å; K675-E678 HydrophobicContact CG-CG 4.4Å; K675-E678 WeakPolarHBondContact CG-OE2 3.46Å; K675-E678 IonicContact NZ-OE1 3.71Å; K675-E678 PolarHBondContact NZ-OE1 2.95Å; K675-E678 IonicContact NZ-OE2 3.66Å; K675-E678 PolarHBondContact NZ-OE2 3.07Å; K675-E678 PolarHBondContact O-N 3.45Å; E678-D711 WeakPolarHBondContact CA-O 3.22Å; E678-D711 HydrophobicContact CG-CB 4.12Å; E678-R759 IonicContact OE1-CZ 3.87Å; E678-R759 IonicContact OE1-NH2 2.9Å; E678-R759 PolarHBondContact OE1-NH2 2.84Å
679	A	93.8	Very high	91.5	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	150	165	0	0	0	0	0	110.4	M670 C707 D711 T713	M670-A679 HydrophobicContact CE-CB 4.43Å; M670-A679 HydrophobicContact CG-CB 4.06Å; M670-A679 HydrophobicContact SD-CB 3.76Å; A679-C707 HydrophobicContact CB-CB 4.08Å; A679-D711 PolarHBondContact N-O 2.88Å; A679-T713 PolarHBondContact O-N 2.82Å; A679-T713 PolarHBondContact O-OG1 2.87Å
680	Y	95.9	Very high	91.4	Very high	55 Å²	55	49.2 Å²	49.2	22%	0.216	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	117.8	-177.2	179.8	-108.1	0	0	0	111.5	M670 V671 S682 T713 H715	M670-Y680 CarbonylContact C-O 3.52Å; M670-Y680 VanDerWaalsContact CA-O 3.32Å; M670-Y680 WeakPolarHBondContact CA-O 3.44Å; M670-Y680 WeakPolarHBondContact CG-O 3.47Å; V671-Y680 PolarHBondContact N-O 2.69Å; V671-Y680 PolarHBondContact O-N 2.8Å; Y680-S682 PolarHBondContact O-N 3.36Å; Y680-S682 VanDerWaalsContact O-N 3.12Å; Y680-T713 CarbonylContact C-O 3.54Å; Y680-T713 WeakPolarHBondContact CA-O 3.4Å; Y680-T713 WeakPolarHBondContact CD2-O 3.35Å; Y680-H715 AromaticContact CE2-ND1 3.37Å; Y680-H715 WeakPolarHBondContact CE2-ND1 3.46Å; Y680-H715 AromaticContact CZ-ND1 3.53Å; Y680-H715 PolarHBondContact OH-ND1 3.39Å
681	I	96.3	Very high	91.4	Very high	7 Å²	7	54 Å²	54	4%	0.036	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.6	105.5	172.6	-56.7	179.4	0	0	0	107.4	F669 M670 L684 L703 V712 T713 L714 F731	F669-I681 CarbonylContact O-C 3.57Å; M670-I681 HydrophobicContact CB-CG1 4.43Å; M670-I681 HydrophobicContact CG-CG1 4.14Å; M670-I681 HydrophobicContact SD-CG1 4.08Å; I681-L684 HydrophobicContact CG2-CB 4.24Å; I681-L703 HydrophobicContact CG2-CD1 4.4Å; I681-V712 HydrophobicContact CD1-CG1 3.79Å; I681-V712 HydrophobicContact CG1-CG1 3.83Å; I681-T713 PolarHBondContact N-O 2.73Å; I681-L714 HydrophobicContact CB-CB 4.1Å; I681-L714 HydrophobicContact CD1-CD2 4.25Å; I681-F731 HydrophobicContact CD1-CZ 4.25Å
682	S	93.7	Very high	91.3	Very high	26 Å²	26	62.2 Å²	62.2	18%	0.182	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	-41.5	-172.4	56.1	0	0	0	0	112.6	F669 Y680	F669-S682 PolarHBondContact O-N 3.06Å; F669-S682 PolarHBondContact O-OG 3.43Å; Y680-S682 PolarHBondContact O-N 3.36Å; Y680-S682 VanDerWaalsContact O-N 3.12Å
683	F	95.2	Very high	91.6	Very high	39 Å²	39	62.5 Å²	62.5	17%	0.171	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	133.9	177.7	-67.4	-88.4	0	0	0	110.5	F639 W640 V643 L645 F667 G668 F669	F639-F683 AromaticContact CD2-CD1 3.96Å; F639-F683 HydrophobicContact CD2-CD1 3.96Å; F639-F683 HydrophobicContact CD2-CE1 4.27Å; F639-F683 AromaticContact CE2-CD1 3.78Å; F639-F683 HydrophobicContact CE2-CD1 3.78Å; F639-F683 HydrophobicContact CZ-CD1 4.29Å; W640-F683 HydrophobicContact CH2-CE1 4.32Å; W640-F683 HydrophobicContact CZ2-CE1 4.34Å; W640-F683 HydrophobicContact CZ2-CZ 4.39Å; V643-F683 HydrophobicContact CG1-CE1 3.94Å; V643-F683 HydrophobicContact CG1-CE2 4.49Å; V643-F683 HydrophobicContact CG1-CZ 3.85Å; V643-F683 HydrophobicContact CG2-CE1 4.33Å; V643-F683 HydrophobicContact CG2-CZ 4.45Å; L645-F683 HydrophobicContact CD1-CB 4.08Å; L645-F683 HydrophobicContact CD1-CD2 3.99Å; L645-F683 HydrophobicContact CD1-CG 4Å; L645-F683 HydrophobicContact CD2-CD2 3.46Å; L645-F683 VanDerWaalsContact CD2-CD2 3.46Å; L645-F683 HydrophobicContact CD2-CE2 3.42Å; L645-F683 VanDerWaalsContact CD2-CE2 3.42Å; L645-F683 HydrophobicContact CD2-CG 4.18Å; L645-F683 HydrophobicContact CD2-CZ 4.09Å; L645-F683 HydrophobicContact CG-CD2 4.43Å; F667-F683 HydrophobicContact CE2-CB 4.25Å; G668-F683 CarbonylContact C-O 3.44Å; G668-F683 WeakPolarHBondContact CA-O 3.32Å; F669-F683 HydrophobicContact CD2-CB 4.46Å; F669-F683 PolarHBondContact N-O 2.96Å; F669-F683 PolarHBondContact O-N 3.01Å
684	L	96.3	Very high	92	Very high	30 Å²	30	61.3 Å²	61.3	16%	0.157	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	124.6	172.4	-174.2	75.3	0	0	0	109.1	I681 M699 I700 Y726	I681-L684 HydrophobicContact CG2-CB 4.24Å; L684-M699 HydrophobicContact CD1-CB 4.07Å; L684-M699 HydrophobicContact CD1-CE 3.93Å; L684-I700 HydrophobicContact CD1-CG1 4.49Å; L684-I700 HydrophobicContact CD2-CD1 3.7Å; L684-I700 HydrophobicContact CD2-CG1 3.5Å; L684-Y726 HydrophobicContact CD2-CE1 3.95Å
685	L	96.1	Very high	92.5	Very high	11 Å²	11	57.5 Å²	57.5	6%	0.058	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	134.3	-178.1	-174.1	62.3	0	0	0	111.4	M634 F639 G666 F667	M634-L685 HydrophobicContact CB-CD2 3.99Å; M634-L685 HydrophobicContact CE-CD2 4.08Å; M634-L685 HydrophobicContact CE-CG 4.4Å; F639-L685 HydrophobicContact CE2-CB 4.26Å; F639-L685 HydrophobicContact CE2-CD2 4.16Å; F639-L685 HydrophobicContact CZ-CB 4.1Å; F639-L685 HydrophobicContact CZ-CD1 4.3Å; G666-L685 CarbonylContact C-O 3.55Å; G666-L685 WeakPolarHBondContact CA-O 3.13Å; F667-L685 HydrophobicContact CD2-CB 4.44Å; F667-L685 HydrophobicContact CE1-CB 4.02Å; F667-L685 HydrophobicContact CE1-CD2 3.85Å; F667-L685 HydrophobicContact CE1-CG 4.42Å; F667-L685 HydrophobicContact CE2-CB 3.89Å; F667-L685 HydrophobicContact CZ-CB 3.65Å; F667-L685 HydrophobicContact CZ-CD2 3.68Å; F667-L685 HydrophobicContact CZ-CG 4.28Å; F667-L685 PolarHBondContact N-O 3.02Å; F667-L685 PolarHBondContact O-N 3.09Å
686	V	96.4	Very high	93.2	Very high	15 Å²	15	52.8 Å²	52.8	9%	0.091	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	132.3	162.2	179.3	0	0	0	0	107.4	W690 R691 I695 M699	V686-W690 HydrophobicContact CG1-CB 4Å; V686-R691 HydrophobicContact CB-CG 4.1Å; V686-R691 HydrophobicContact CG1-CG 3.9Å; V686-R691 PolarHBondContact O-NE 3.44Å; V686-R691 PolarHBondContact O-NH2 3.41Å; V686-I695 HydrophobicContact CG1-CB 4.39Å; V686-I695 HydrophobicContact CG1-CD1 4.43Å; V686-I695 HydrophobicContact CG2-CB 4.28Å; V686-I695 HydrophobicContact CG2-CG2 4.13Å; V686-M699 HydrophobicContact CG2-CE 3.44Å; V686-M699 VanDerWaalsContact CG2-CE 3.44Å
687	H	94.9	Very high	94.1	Very high	66 Å²	66	44.9 Å²	44.9	31%	0.306	23%	0.234	S	C	.	.			trans	-56.7	135.7	177.7	-173.6	-98.7	0	0	0	110	M634 V665 E689 W690 R691	M634-H687 HydrophobicContact CE-CB 4.14Å; V665-H687 WeakPolarHBondContact O-CB 3.47Å; V665-H687 PolarHBondContact O-N 3.04Å; H687-E689 VanDerWaalsContact C-N 3.27Å; H687-E689 IonicContact CE1-OE2 3.41Å; H687-E689 PolarHBondContact CE1-OE2 3.34Å; H687-E689 IonicContact ND1-OE2 2.7Å; H687-E689 PolarHBondContact O-N 3.46Å; H687-E689 VanDerWaalsContact O-N 3.08Å; H687-W690 HydrophobicContact CB-CG 4.45Å; H687-W690 AromaticContact CG-CD1 3.99Å; H687-W690 AromaticContact ND1-CD1 3.53Å; H687-W690 WeakPolarHBondContact O-CA 3.49Å; H687-W690 PolarHBondContact O-N 3.41Å; H687-R691 PolarHBondContact O-N 3.44Å
688	P	92.9	Very high	94.6	Very high	74 Å²	74	43.1 Å²	43.1	48%	0.481	22%	0.217	S	C	.	.	G	3₁₀ helix	trans	-50.5	-41.1	-170.2	-31.8	36.9	0	0	0	115.4	W690 R691	P688-W690 PolarHBondContact O-N 3.12Å; P688-R691 PolarHBondContact O-N 3.47Å
689	E	93.7	Very high	94.9	Very high	67 Å²	67	42.5 Å²	42.5	31%	0.313	22%	0.215	S	C	.	.	G	3₁₀ helix	trans	-70.8	-12.5	179.8	-49.2	-179.8	120.7	0	0	114.4	K592 H687	K592-E689 HydrophobicContact CB-CB 3.92Å; K592-E689 HydrophobicContact CD-CB 4.17Å; K592-E689 WeakPolarHBondContact CD-OE2 3.17Å; K592-E689 VanDerWaalsContact CE-OE2 3.26Å; K592-E689 WeakPolarHBondContact CE-OE2 3.25Å; K592-E689 HydrophobicContact CG-CB 4.34Å; K592-E689 PolarHBondContact N-O 3.37Å; K592-E689 IonicContact NZ-OE1 3.46Å; K592-E689 PolarHBondContact NZ-OE1 3Å; K592-E689 IonicContact NZ-OE2 3.24Å; K592-E689 PolarHBondContact NZ-OE2 3.46Å; H687-E689 VanDerWaalsContact C-N 3.27Å; H687-E689 IonicContact CE1-OE2 3.41Å; H687-E689 PolarHBondContact CE1-OE2 3.34Å; H687-E689 IonicContact ND1-OE2 2.7Å; H687-E689 PolarHBondContact O-N 3.46Å; H687-E689 VanDerWaalsContact O-N 3.08Å
690	W	94.6	Very high	95.1	Very high	19 Å²	19	42.5 Å²	42.5	7%	0.072	22%	0.215	C	C	.	.	G	3₁₀ helix	trans	-106.9	2.3	-178.5	-62.6	78.1	0	0	0	113	P590 K592 L593 I618 Y660 V665 V686 H687 P688 I695	P590-W690 HydrophobicContact CB-CE3 4.39Å; P590-W690 HydrophobicContact CG-CD2 4.3Å; P590-W690 HydrophobicContact CG-CE3 3.54Å; P590-W690 HydrophobicContact CG-CZ3 3.94Å; K592-W690 HydrophobicContact CB-CD2 4.35Å; K592-W690 HydrophobicContact CB-CZ2 4.08Å; K592-W690 HydrophobicContact CG-CZ2 3.91Å; L593-W690 HydrophobicContact CD1-CH2 4.36Å; L593-W690 HydrophobicContact CD1-CZ3 4Å; L593-W690 HydrophobicContact CD2-CH2 3.56Å; L593-W690 HydrophobicContact CD2-CZ2 4.43Å; L593-W690 HydrophobicContact CD2-CZ3 4.04Å; L593-W690 HydrophobicContact CG-CH2 3.82Å; L593-W690 HydrophobicContact CG-CZ3 3.79Å; I618-W690 HydrophobicContact CD1-CE3 4.25Å; I618-W690 HydrophobicContact CD1-CZ3 4.19Å; I618-W690 HydrophobicContact CG1-CZ3 4.44Å; Y660-W690 VanDerWaalsContact CB-CH2 3.43Å; Y660-W690 AromaticContact CD1-CH2 3.78Å; Y660-W690 HydrophobicContact CD1-CH2 3.78Å; Y660-W690 AromaticContact CD2-CH2 3.89Å; Y660-W690 HydrophobicContact CD2-CH2 3.89Å; Y660-W690 HydrophobicContact CD2-CZ3 4.01Å; Y660-W690 HydrophobicContact CE1-CH2 4.5Å; Y660-W690 AromaticContact CG-CH2 3.42Å; Y660-W690 HydrophobicContact CG-CH2 3.42Å; Y660-W690 VanDerWaalsContact CG-CH2 3.42Å; Y660-W690 HydrophobicContact CG-CZ2 4.44Å; Y660-W690 AromaticContact CG-CZ3 3.88Å; Y660-W690 HydrophobicContact CG-CZ3 3.88Å; V665-W690 HydrophobicContact CB-CB 4.36Å; V665-W690 HydrophobicContact CB-CD2 3.65Å; V665-W690 HydrophobicContact CB-CE3 3.9Å; V665-W690 HydrophobicContact CB-CG 3.82Å; V665-W690 HydrophobicContact CG1-CD2 3.57Å; V665-W690 VanDerWaalsContact CG1-CE2 3.47Å; V665-W690 HydrophobicContact CG1-CE3 3.82Å; V665-W690 HydrophobicContact CG1-CG 4.15Å; V665-W690 HydrophobicContact CG1-CH2 3.99Å; V665-W690 HydrophobicContact CG1-CZ2 3.71Å; V665-W690 HydrophobicContact CG1-CZ3 4.03Å; V665-W690 HydrophobicContact CG2-CD2 4.24Å; V665-W690 HydrophobicContact CG2-CE3 3.98Å; V686-W690 HydrophobicContact CG1-CB 4Å; H687-W690 HydrophobicContact CB-CG 4.45Å; H687-W690 AromaticContact CG-CD1 3.99Å; H687-W690 AromaticContact ND1-CD1 3.53Å; H687-W690 WeakPolarHBondContact O-CA 3.49Å; H687-W690 PolarHBondContact O-N 3.41Å; P688-W690 PolarHBondContact O-N 3.12Å; W690-I695 HydrophobicContact CB-CD1 4.03Å; W690-I695 HydrophobicContact CE3-CD1 4.38Å; W690-I695 WeakPolarHBondContact O-CD1 3.34Å
691	R	93.1	Very high	95.1	Very high	101 Å²	101	45.6 Å²	45.6	38%	0.381	23%	0.227	S	C	.	.			trans	-73.6	165.9	176.3	-63	179.7	-173.5	175.9	2.8	111.3	V686 H687 P688	V686-R691 HydrophobicContact CB-CG 4.1Å; V686-R691 HydrophobicContact CG1-CG 3.9Å; V686-R691 PolarHBondContact O-NE 3.44Å; V686-R691 PolarHBondContact O-NH2 3.41Å; H687-R691 PolarHBondContact O-N 3.44Å; P688-R691 PolarHBondContact O-N 3.47Å
692	R	91.4	Very high	95.1	Very high	214 Å²	214	46.2 Å²	46.2	81%	0.808	23%	0.229	S	C	*	.	S	Bend	trans	63.4	31.7	-179.4	-52.1	-176	-64.7	-103.7	0.2	115.1
693	A	93	Very high	95.1	Very high	15 Å²	15	45 Å²	45	12%	0.124	22%	0.221	C	C	.	.	S	Bend	trans	-141.9	52.1	175.7	0	0	0	0	0	112.1	S588 P590 I695	S588-A693 PolarHBondContact OG-O 3.48Å; P590-A693 HydrophobicContact CB-CB 3.69Å; P590-A693 HydrophobicContact CG-CB 4.24Å; A693-I695 WeakPolarHBondContact O-CG1 3.43Å; A693-I695 PolarHBondContact O-N 2.92Å
694	G	93.6	Very high	95.1	Very high	41 Å²	41	43.3 Å²	43.3	42%	0.423	21%	0.214	S	C	.	.	S	Bend	trans	70.2	-26.8	173.8	0	0	0	0	0	117.6	G696 T697 F698	G694-G696 PolarHBondContact O-N 2.84Å; G694-T697 WeakPolarHBondContact O-CA 3.34Å; G694-T697 WeakPolarHBondContact O-CB 3.27Å; G694-T697 PolarHBondContact O-N 2.9Å; G694-F698 PolarHBondContact O-N 2.91Å
695	I	96.4	Very high	94.9	Very high	1 Å²	1	45.2 Å²	45.2	1%	0.005	22%	0.222	C	C	.	.	H	α-helix	trans	-49.7	-53	-169.1	-45.7	-173.4	0	0	0	113.2	I618 Y620 A658 V665 V686 W690 A693 T697 F698 M699	I618-I695 HydrophobicContact CD1-CD1 3.89Å; I618-I695 HydrophobicContact CD1-CG1 4.39Å; Y620-I695 HydrophobicContact CE1-CG2 3.78Å; Y620-I695 WeakPolarHBondContact OH-CA 3.45Å; A658-I695 HydrophobicContact CB-CG2 3.75Å; V665-I695 HydrophobicContact CG2-CD1 4.38Å; V686-I695 HydrophobicContact CG1-CB 4.39Å; V686-I695 HydrophobicContact CG1-CD1 4.43Å; V686-I695 HydrophobicContact CG2-CB 4.28Å; V686-I695 HydrophobicContact CG2-CG2 4.13Å; W690-I695 HydrophobicContact CB-CD1 4.03Å; W690-I695 HydrophobicContact CE3-CD1 4.38Å; W690-I695 WeakPolarHBondContact O-CD1 3.34Å; A693-I695 WeakPolarHBondContact O-CG1 3.43Å; A693-I695 PolarHBondContact O-N 2.92Å; I695-T697 VanDerWaalsContact C-N 3.33Å; I695-T697 PolarHBondContact O-N 2.87Å; I695-F698 PolarHBondContact O-N 3.44Å; I695-M699 HydrophobicContact CG2-CE 4.31Å; I695-M699 HydrophobicContact CG2-SD 4.47Å; I695-M699 WeakPolarHBondContact O-CG 3.25Å; I695-M699 PolarHBondContact O-N 3.43Å
696	G	95.8	Very high	94.7	Very high	14 Å²	14	46.4 Å²	46.4	14%	0.144	23%	0.23	C	C	.	.	H	α-helix	trans	-63.6	-37.8	179	0	0	0	0	0	113	G694 M699 I700	G694-G696 PolarHBondContact O-N 2.84Å; G696-M699 PolarHBondContact O-N 3.38Å; G696-I700 VanDerWaalsContact O-CG1 3.31Å; G696-I700 WeakPolarHBondContact O-CG1 3.5Å; G696-I700 PolarHBondContact O-N 3.23Å
697	T	96.1	Very high	94.2	Very high	65 Å²	65	46 Å²	46	40%	0.399	23%	0.227	S	C	.	.	H	α-helix	trans	-61.8	-49.4	175.7	-44.8	0	0	0	0	110.8	G694 I695 M699 I700 Y701 L725 F729	G694-T697 WeakPolarHBondContact O-CA 3.34Å; G694-T697 WeakPolarHBondContact O-CB 3.27Å; G694-T697 PolarHBondContact O-N 2.9Å; I695-T697 VanDerWaalsContact C-N 3.33Å; I695-T697 PolarHBondContact O-N 2.87Å; T697-M699 PolarHBondContact O-N 2.97Å; T697-I700 PolarHBondContact O-N 3.46Å; T697-Y701 WeakPolarHBondContact O-CB 3.37Å; T697-Y701 PolarHBondContact O-N 2.97Å; T697-L725 HydrophobicContact CG2-CD1 4.46Å; T697-F729 HydrophobicContact CG2-CE2 3.74Å; T697-F729 HydrophobicContact CG2-CZ 3.64Å; T697-F729 VanDerWaalsContact O-CZ 3.23Å; T697-F729 WeakPolarHBondContact O-CZ 3.48Å
698	F	97	Very high	93.6	Very high	32 Å²	32	49.4 Å²	49.4	14%	0.14	25%	0.245	C	C	.	.	H	α-helix	trans	-64.9	-39.2	179.1	-176.5	-98.7	0	0	0	112.4	I582 R583 Y620 G694 I695 Y701 H702	I582-F698 HydrophobicContact CG2-CE1 4.09Å; I582-F698 HydrophobicContact CG2-CZ 4.01Å; R583-F698 HydrophobicContact CB-CE1 3.83Å; R583-F698 HydrophobicContact CB-CE2 4.26Å; R583-F698 HydrophobicContact CB-CZ 3.51Å; R583-F698 HydrophobicContact CG-CZ 4.23Å; Y620-F698 AromaticContact CD1-CD1 3.48Å; Y620-F698 HydrophobicContact CD1-CD1 3.48Å; Y620-F698 VanDerWaalsContact CD1-CD1 3.48Å; Y620-F698 AromaticContact CD1-CE1 3.92Å; Y620-F698 HydrophobicContact CD1-CE1 3.92Å; Y620-F698 HydrophobicContact CD2-CD1 4.02Å; Y620-F698 HydrophobicContact CD2-CE1 4.06Å; Y620-F698 HydrophobicContact CE1-CB 4.32Å; Y620-F698 AromaticContact CE1-CD1 3.63Å; Y620-F698 HydrophobicContact CE1-CD1 3.63Å; Y620-F698 HydrophobicContact CE1-CE1 4.47Å; Y620-F698 HydrophobicContact CE1-CG 4.36Å; Y620-F698 HydrophobicContact CE2-CD1 4.16Å; Y620-F698 AromaticContact CG-CD1 3.67Å; Y620-F698 HydrophobicContact CG-CD1 3.67Å; Y620-F698 AromaticContact CG-CE1 3.68Å; Y620-F698 HydrophobicContact CG-CE1 3.68Å; Y620-F698 AromaticContact CZ-CD1 3.98Å; G694-F698 PolarHBondContact O-N 2.91Å; I695-F698 PolarHBondContact O-N 3.44Å; F698-Y701 PolarHBondContact O-N 3.47Å; F698-H702 WeakPolarHBondContact O-CB 3.31Å; F698-H702 PolarHBondContact O-N 2.9Å
699	M	97.4	Very high	93.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.6	-44.7	176.8	-69.6	-167.3	-53.4	0	0	112.4	Y620 V656 A658 F667 L684 V686 I695 G696 T697 H702 L703	Y620-M699 HydrophobicContact CD1-CG 4.35Å; Y620-M699 HydrophobicContact CE1-CG 4.32Å; V656-M699 HydrophobicContact CB-CG 4.38Å; V656-M699 HydrophobicContact CG1-CB 3.63Å; V656-M699 HydrophobicContact CG1-CG 3.61Å; V656-M699 HydrophobicContact CG1-SD 4.06Å; V656-M699 HydrophobicContact CG2-CG 3.82Å; V656-M699 HydrophobicContact CG2-SD 4.37Å; A658-M699 HydrophobicContact CB-SD 4.36Å; F667-M699 VanDerWaalsContact C-SD 3.57Å; L684-M699 HydrophobicContact CD1-CB 4.07Å; L684-M699 HydrophobicContact CD1-CE 3.93Å; V686-M699 HydrophobicContact CG2-CE 3.44Å; V686-M699 VanDerWaalsContact CG2-CE 3.44Å; I695-M699 HydrophobicContact CG2-CE 4.31Å; I695-M699 HydrophobicContact CG2-SD 4.47Å; I695-M699 WeakPolarHBondContact O-CG 3.25Å; I695-M699 PolarHBondContact O-N 3.43Å; G696-M699 PolarHBondContact O-N 3.38Å; T697-M699 PolarHBondContact O-N 2.97Å; M699-H702 PolarHBondContact O-N 3.36Å; M699-L703 WeakPolarHBondContact O-CG 3.19Å; M699-L703 PolarHBondContact O-N 3.48Å; M699-L703 VanDerWaalsContact O-N 3.12Å
700	I	96.4	Very high	92.9	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-62.9	-47.4	176	-68	165.3	0	0	0	110.6	L684 G696 T697 H702 L703 I704 L725 Y726 F729 F731	L684-I700 HydrophobicContact CD1-CG1 4.49Å; L684-I700 HydrophobicContact CD2-CD1 3.7Å; L684-I700 HydrophobicContact CD2-CG1 3.5Å; G696-I700 VanDerWaalsContact O-CG1 3.31Å; G696-I700 WeakPolarHBondContact O-CG1 3.5Å; G696-I700 PolarHBondContact O-N 3.23Å; T697-I700 PolarHBondContact O-N 3.46Å; I700-H702 PolarHBondContact O-N 3.44Å; I700-L703 PolarHBondContact O-N 3.16Å; I700-I704 HydrophobicContact CG2-CD1 3.45Å; I700-I704 VanDerWaalsContact CG2-CD1 3.45Å; I700-I704 HydrophobicContact CG2-CG1 4.29Å; I700-I704 WeakPolarHBondContact O-CB 3.2Å; I700-I704 VanDerWaalsContact O-CG1 3.27Å; I700-I704 WeakPolarHBondContact O-CG1 3.39Å; I700-I704 PolarHBondContact O-N 3.08Å; I700-L725 HydrophobicContact CD1-CD2 3.58Å; I700-L725 HydrophobicContact CD1-CG 3.73Å; I700-Y726 HydrophobicContact CD1-CD1 3.87Å; I700-Y726 HydrophobicContact CD1-CE1 3.66Å; I700-Y726 HydrophobicContact CG1-CE1 4.35Å; I700-F729 HydrophobicContact CB-CD2 4.13Å; I700-F729 HydrophobicContact CB-CE2 3.81Å; I700-F729 HydrophobicContact CB-CZ 4.09Å; I700-F729 HydrophobicContact CD1-CD2 4.29Å; I700-F729 HydrophobicContact CD1-CE2 4.26Å; I700-F729 HydrophobicContact CG2-CB 4.35Å; I700-F729 HydrophobicContact CG2-CD1 3.94Å; I700-F729 HydrophobicContact CG2-CD2 3.5Å; I700-F729 HydrophobicContact CG2-CE1 4.09Å; I700-F729 HydrophobicContact CG2-CE2 3.67Å; I700-F729 HydrophobicContact CG2-CG 3.65Å; I700-F729 HydrophobicContact CG2-CZ 3.97Å; I700-F731 HydrophobicContact CG2-CE2 4.3Å
701	Y	96.1	Very high	92.9	Very high	121 Å²	121	48.3 Å²	48.3	48%	0.475	25%	0.251	S	S	.	.	H	α-helix	trans	-54.2	-50	176.1	173.1	-91.5	0	0	0	111.9	T697 F698 L703 I704 Q705	T697-Y701 WeakPolarHBondContact O-CB 3.37Å; T697-Y701 PolarHBondContact O-N 2.97Å; F698-Y701 PolarHBondContact O-N 3.47Å; Y701-L703 PolarHBondContact O-N 2.78Å; Y701-I704 PolarHBondContact O-N 2.89Å; Y701-Q705 HydrophobicContact CD1-CG 4.38Å; Y701-Q705 HydrophobicContact CD2-CG 4.32Å; Y701-Q705 HydrophobicContact CE1-CG 4.06Å; Y701-Q705 HydrophobicContact CE2-CG 4.02Å; Y701-Q705 VanDerWaalsContact O-CG 3.31Å; Y701-Q705 WeakPolarHBondContact O-CG 3.42Å; Y701-Q705 PolarHBondContact O-N 3.37Å
702	H	96.3	Very high	93.1	Very high	19 Å²	19	43.5 Å²	43.5	9%	0.088	23%	0.233	C	C	.	.	H	α-helix	trans	-62.4	-44.3	-178.9	173.8	64.8	0	0	0	112.6	I582 Y622 F698 M699 I700 Q705 T706	I582-H702 WeakPolarHBondContact CG2-ND1 3.26Å; Y622-H702 AromaticContact CE1-CE1 3.89Å; Y622-H702 AromaticContact CE1-NE2 3.61Å; F698-H702 WeakPolarHBondContact O-CB 3.31Å; F698-H702 PolarHBondContact O-N 2.9Å; M699-H702 PolarHBondContact O-N 3.36Å; I700-H702 PolarHBondContact O-N 3.44Å; H702-Q705 PolarHBondContact O-N 3.27Å; H702-T706 PolarHBondContact O-N 2.94Å; H702-T706 PolarHBondContact O-OG1 2.91Å
703	L	95.3	Very high	93.3	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-61.6	-47.2	177.3	-67.5	173.9	0	0	0	110.9	F654 V656 M670 I681 M699 I700 Y701 Q705 T706 C707	F654-L703 WeakPolarHBondContact O-CD2 3.27Å; V656-L703 HydrophobicContact CG1-CD1 4.48Å; V656-L703 HydrophobicContact CG1-CD2 4.35Å; V656-L703 HydrophobicContact CG1-CG 4.21Å; M670-L703 HydrophobicContact CB-CD1 4.46Å; M670-L703 HydrophobicContact CB-CD2 4.02Å; M670-L703 HydrophobicContact CE-CB 4.11Å; M670-L703 HydrophobicContact CE-CD2 4.47Å; M670-L703 WeakPolarHBondContact CE-O 3.49Å; M670-L703 HydrophobicContact SD-CB 4.23Å; I681-L703 HydrophobicContact CG2-CD1 4.4Å; M699-L703 WeakPolarHBondContact O-CG 3.19Å; M699-L703 PolarHBondContact O-N 3.48Å; M699-L703 VanDerWaalsContact O-N 3.12Å; I700-L703 PolarHBondContact O-N 3.16Å; Y701-L703 PolarHBondContact O-N 2.78Å; L703-Q705 PolarHBondContact O-N 2.93Å; L703-T706 WeakPolarHBondContact O-CB 3.38Å; L703-T706 PolarHBondContact O-N 2.99Å; L703-C707 PolarHBondContact O-N 2.84Å
704	I	94.3	Very high	93.5	Very high	5 Å²	5	32.8 Å²	32.8	3%	0.026	19%	0.19	C	C	.	.	H	α-helix	trans	-59	-42.5	177.8	-71.2	168.1	0	0	0	112.2	I700 Y701 T706 C707 V712 F729 F731 L760 R762	I700-I704 HydrophobicContact CG2-CD1 3.45Å; I700-I704 VanDerWaalsContact CG2-CD1 3.45Å; I700-I704 HydrophobicContact CG2-CG1 4.29Å; I700-I704 WeakPolarHBondContact O-CB 3.2Å; I700-I704 VanDerWaalsContact O-CG1 3.27Å; I700-I704 WeakPolarHBondContact O-CG1 3.39Å; I700-I704 PolarHBondContact O-N 3.08Å; Y701-I704 PolarHBondContact O-N 2.89Å; I704-T706 VanDerWaalsContact C-N 3.27Å; I704-T706 PolarHBondContact O-N 2.66Å; I704-C707 CarbonylContact O-C 3.59Å; I704-C707 PolarHBondContact O-N 2.77Å; I704-V712 HydrophobicContact CG1-CG1 4.45Å; I704-V712 HydrophobicContact CG1-CG2 4.39Å; I704-F729 HydrophobicContact CD1-CB 4.34Å; I704-F729 HydrophobicContact CD1-CD1 3.76Å; I704-F729 HydrophobicContact CD1-CE1 4.4Å; I704-F729 HydrophobicContact CD1-CG 4.2Å; I704-F731 HydrophobicContact CD1-CE2 3.93Å; I704-F731 HydrophobicContact CD1-CZ 4.32Å; I704-L760 HydrophobicContact CD1-CD2 3.68Å; I704-L760 HydrophobicContact CG1-CD2 4.09Å; I704-L760 HydrophobicContact CG2-CD2 4.11Å; I704-R762 VanDerWaalsContact CG2-NH1 3.33Å; I704-R762 PolarHBondContact O-NH1 3.25Å
705	Q	93.1	Very high	93.6	Very high	70 Å²	70	33.1 Å²	33.1	33%	0.327	18%	0.18	S	C	.	.	H	α-helix	trans	-75.6	-14.5	178	-59.2	-64.5	48.9	0	0	113.3	Y701 H702 L703 R762	Y701-Q705 HydrophobicContact CD1-CG 4.38Å; Y701-Q705 HydrophobicContact CD2-CG 4.32Å; Y701-Q705 HydrophobicContact CE1-CG 4.06Å; Y701-Q705 HydrophobicContact CE2-CG 4.02Å; Y701-Q705 VanDerWaalsContact O-CG 3.31Å; Y701-Q705 WeakPolarHBondContact O-CG 3.42Å; Y701-Q705 PolarHBondContact O-N 3.37Å; H702-Q705 PolarHBondContact O-N 3.27Å; L703-Q705 PolarHBondContact O-N 2.93Å; Q705-R762 VanDerWaalsContact OE1-NH2 3.14Å
706	T	90.1	Very high	93.5	Very high	36 Å²	36	33.2 Å²	33.2	22%	0.221	18%	0.181	C	C	.	.	H	α-helix	trans	-81.7	-24.1	173.2	-52.6	0	0	0	0	111.8	D653 F654 H702 L703 I704	D653-T706 HydrophobicContact CB-CG2 4.4Å; F654-T706 HydrophobicContact CD1-CG2 3.61Å; F654-T706 HydrophobicContact CE1-CG2 3.74Å; F654-T706 HydrophobicContact CG-CG2 4.33Å; H702-T706 PolarHBondContact O-N 2.94Å; H702-T706 PolarHBondContact O-OG1 2.91Å; L703-T706 WeakPolarHBondContact O-CB 3.38Å; L703-T706 PolarHBondContact O-N 2.99Å; I704-T706 VanDerWaalsContact C-N 3.27Å; I704-T706 PolarHBondContact O-N 2.66Å
707	C	86.3	Confident	93.3	Very high	5 Å²	5	33.1 Å²	33.1	3%	0.034	18%	0.178	C	C	.	.	T	Hydrogen-bonded Turn	trans	-112.1	53.8	171.7	-80	0	0	0	0	112.7	F654 M670 A679 L703 I704 K710	F654-C707 VanDerWaalsContact CD1-SG 3.54Å; F654-C707 WeakPolarHBondContact CE1-SG 3.46Å; M670-C707 HydrophobicContact CE-CB 3.82Å; M670-C707 WeakPolarHBondContact CE-SG 3.37Å; M670-C707 HydrophobicContact SD-CB 4.49Å; A679-C707 HydrophobicContact CB-CB 4.08Å; L703-C707 PolarHBondContact O-N 2.84Å; I704-C707 CarbonylContact O-C 3.59Å; I704-C707 PolarHBondContact O-N 2.77Å; C707-K710 HydrophobicContact CB-CB 4.48Å; C707-K710 PolarHBondContact O-N 3.41Å
708	M	82.4	Confident	93.1	Very high	138 Å²	138	31.6 Å²	31.6	68%	0.68	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	140.7	166.8	-69	178	70.1	0	0	110.9
709	G	83.6	Confident	92.8	Very high	63 Å²	63	34.1 Å²	34.1	65%	0.649	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	73.8	21.2	-177.6	0	0	0	0	0	115.2
710	K	89.5	Confident	92.5	Very high	47 Å²	47	37 Å²	37	20%	0.204	21%	0.209	C	C	.	.	S	Bend	trans	-136.6	144.1	171.8	-61.5	-171.5	-173.5	-173.4	0	110.7	D673 S677 C707 V712	D673-K710 IonicContact OD1-NZ 3.88Å; D673-K710 PolarHBondContact OD1-NZ 3.08Å; D673-K710 IonicContact OD2-NZ 3.57Å; D673-K710 PolarHBondContact OD2-NZ 2.85Å; S677-K710 CarbonylContact O-C 3.51Å; S677-K710 WeakPolarHBondContact O-CA 3.37Å; S677-K710 WeakPolarHBondContact O-CB 3.25Å; C707-K710 HydrophobicContact CB-CB 4.48Å; C707-K710 PolarHBondContact O-N 3.41Å; K710-V712 PolarHBondContact O-N 3.22Å
711	D	94.3	Very high	92.1	Very high	27 Å²	27	42 Å²	42	14%	0.144	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.1	132.4	166.5	-83.4	-1.7	0	0	0	109.2	S677 E678 A679 R759 L760 R761 R762	S677-D711 PolarHBondContact O-N 2.99Å; E678-D711 WeakPolarHBondContact CA-O 3.22Å; E678-D711 HydrophobicContact CG-CB 4.12Å; A679-D711 PolarHBondContact N-O 2.88Å; D711-R759 HydrophobicContact CB-CG 4.25Å; D711-R759 WeakPolarHBondContact OD2-CD 3.49Å; D711-R759 IonicContact OD2-CZ 3.57Å; D711-R759 IonicContact OD2-NE 2.66Å; D711-R759 PolarHBondContact OD2-NE 3.38Å; D711-R759 IonicContact OD2-NH2 2.88Å; D711-L760 WeakPolarHBondContact CA-O 3.14Å; D711-R761 VanDerWaalsContact OD1-CA 3.25Å; D711-R761 WeakPolarHBondContact OD1-CA 3.48Å; D711-R762 PolarHBondContact OD1-N 3.29Å
712	V	96	Very high	91.9	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.8	175.8	-175.5	0	0	0	0	108.8	M670 I681 I704 K710 F731 R759 L760	M670-V712 HydrophobicContact SD-CG1 4.17Å; I681-V712 HydrophobicContact CD1-CG1 3.79Å; I681-V712 HydrophobicContact CG1-CG1 3.83Å; I704-V712 HydrophobicContact CG1-CG1 4.45Å; I704-V712 HydrophobicContact CG1-CG2 4.39Å; K710-V712 PolarHBondContact O-N 3.22Å; V712-F731 HydrophobicContact CB-CE1 4.35Å; V712-F731 HydrophobicContact CB-CZ 4.29Å; V712-F731 HydrophobicContact CG1-CE1 4.1Å; V712-F731 HydrophobicContact CG1-CZ 3.87Å; V712-F731 VanDerWaalsContact O-CE1 3.32Å; V712-F731 WeakPolarHBondContact O-CE1 3.25Å; V712-R759 WeakPolarHBondContact O-CA 3.26Å; V712-L760 HydrophobicContact CB-CB 4.4Å; V712-L760 PolarHBondContact N-O 3.07Å; V712-L760 PolarHBondContact O-N 3.18Å
713	T	96.3	Very high	91.7	Very high	3 Å²	3	38.7 Å²	38.7	2%	0.018	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	150.9	-173.9	58.3	0	0	0	0	111.6	A679 Y680 I681 F757 L758 R759	A679-T713 PolarHBondContact O-N 2.82Å; A679-T713 PolarHBondContact O-OG1 2.87Å; Y680-T713 CarbonylContact C-O 3.54Å; Y680-T713 WeakPolarHBondContact CA-O 3.4Å; Y680-T713 WeakPolarHBondContact CD2-O 3.35Å; I681-T713 PolarHBondContact N-O 2.73Å; T713-F757 HydrophobicContact CG2-CE2 4.23Å; T713-F757 HydrophobicContact CG2-CZ 3.68Å; T713-L758 CarbonylContact C-O 3.54Å; T713-L758 VanDerWaalsContact CA-O 3.3Å; T713-L758 WeakPolarHBondContact CA-O 3.46Å; T713-R759 HydrophobicContact CG2-CB 4.14Å; T713-R759 HydrophobicContact CG2-CG 3.89Å
714	L	96.6	Very high	91.6	Very high	2 Å²	2	44.4 Å²	44.4	1%	0.01	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	154.6	173.9	69.1	90	0	0	0	112.6	I681 V716 Y726 F731 L758	I681-L714 HydrophobicContact CB-CB 4.1Å; I681-L714 HydrophobicContact CD1-CD2 4.25Å; L714-V716 HydrophobicContact CD1-CB 3.73Å; L714-V716 HydrophobicContact CD1-CG1 3.71Å; L714-Y726 HydrophobicContact CD1-CD2 4.2Å; L714-Y726 HydrophobicContact CD1-CE2 3.97Å; L714-Y726 HydrophobicContact CD2-CD1 3.62Å; L714-Y726 HydrophobicContact CD2-CD2 4.48Å; L714-Y726 HydrophobicContact CD2-CE1 3.54Å; L714-Y726 HydrophobicContact CD2-CE2 4.41Å; L714-Y726 HydrophobicContact CD2-CG 4.12Å; L714-F731 HydrophobicContact CD2-CD1 4.09Å; L714-F731 HydrophobicContact CD2-CE1 3.66Å; L714-F731 HydrophobicContact CD2-CZ 3.92Å; L714-F731 HydrophobicContact CG-CD1 4.49Å; L714-F731 HydrophobicContact CG-CE1 4.27Å; L714-L758 HydrophobicContact CD1-CB 4.29Å; L714-L758 HydrophobicContact CD1-CD1 4.07Å; L714-L758 HydrophobicContact CD1-CG 4.2Å; L714-L758 HydrophobicContact CG-CB 4.22Å; L714-L758 PolarHBondContact N-O 3.07Å; L714-L758 PolarHBondContact O-N 3.42Å
715	H	95.4	Very high	91.6	Very high	47 Å²	47	46.2 Å²	46.2	22%	0.218	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	137.8	166	-68.1	95.2	0	0	0	110.5	Y680 F740 F756 F757	Y680-H715 AromaticContact CE2-ND1 3.37Å; Y680-H715 WeakPolarHBondContact CE2-ND1 3.46Å; Y680-H715 AromaticContact CZ-ND1 3.53Å; Y680-H715 PolarHBondContact OH-ND1 3.39Å; H715-F740 HydrophobicContact CB-CE1 3.95Å; H715-F740 HydrophobicContact CB-CE2 4.31Å; H715-F740 HydrophobicContact CB-CZ 3.68Å; H715-F740 AromaticContact CD2-CD2 3.97Å; H715-F740 AromaticContact CD2-CE2 3.33Å; H715-F740 WeakPolarHBondContact CD2-CE2 3.34Å; H715-F740 AromaticContact CD2-CZ 3.62Å; H715-F740 AromaticContact CE1-CE2 3.85Å; H715-F740 AromaticContact CG-CE2 3.63Å; H715-F740 AromaticContact CG-CZ 3.39Å; H715-F740 AromaticContact ND1-CE2 3.93Å; H715-F740 AromaticContact ND1-CZ 3.69Å; H715-F740 AromaticContact NE2-CE2 3.48Å; H715-F740 WeakPolarHBondContact NE2-CE2 3.46Å; H715-F756 WeakPolarHBondContact CA-O 3.42Å; H715-F757 AromaticContact CD2-CD2 3.9Å; H715-F757 AromaticContact CE1-CD2 3.65Å; H715-F757 AromaticContact NE2-CD2 3.49Å; H715-F757 WeakPolarHBondContact NE2-CD2 3.3Å
716	V	94.7	Very high	91.7	Very high	3 Å²	3	43.6 Å²	43.6	2%	0.018	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	130.3	-179	52.8	0	0	0	0	110.8	L714 A718 N720 M723 Y726 A755 F756 L758	L714-V716 HydrophobicContact CD1-CB 3.73Å; L714-V716 HydrophobicContact CD1-CG1 3.71Å; V716-A718 PolarHBondContact O-N 3.28Å; V716-N720 HydrophobicContact CG2-CB 3.58Å; V716-M723 HydrophobicContact CB-SD 4.4Å; V716-M723 HydrophobicContact CG1-SD 3.46Å; V716-M723 WeakPolarHBondContact CG1-SD 3.3Å; V716-M723 HydrophobicContact CG2-SD 3.99Å; V716-Y726 HydrophobicContact CB-CE2 4.15Å; V716-Y726 HydrophobicContact CG1-CD2 4.5Å; V716-Y726 HydrophobicContact CG2-CD2 4.43Å; V716-Y726 HydrophobicContact CG2-CE2 3.9Å; V716-A755 CarbonylContact O-C 3.6Å; V716-A755 VanDerWaalsContact O-CA 3.25Å; V716-A755 WeakPolarHBondContact O-CA 3.33Å; V716-F756 HydrophobicContact CG1-CB 4.17Å; V716-F756 PolarHBondContact N-O 2.91Å; V716-F756 PolarHBondContact O-N 2.7Å; V716-L758 HydrophobicContact CG1-CD1 3.78Å; V716-L758 HydrophobicContact CG1-CG 3.84Å
717	S	93	Very high	91.9	Very high	12 Å²	12	48.2 Å²	48.2	8%	0.084	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56	136.2	174.5	177	0	0	0	0	111.5	S719 N720 Y741 C752 H754	S717-S719 PolarHBondContact O-N 3.18Å; S717-S719 VanDerWaalsContact O-N 3.08Å; S717-N720 WeakPolarHBondContact O-CB 3.46Å; S717-N720 PolarHBondContact O-N 2.9Å; S717-Y741 PolarHBondContact N-OH 3.31Å; S717-C752 PolarHBondContact OG-O 3.28Å; S717-H754 WeakPolarHBondContact CA-O 3.42Å
718	A	90.8	Very high	92.3	Very high	33 Å²	33	56.7 Å²	56.7	27%	0.273	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-21.1	-173.2	0	0	0	0	0	114.3	V716 Y736 H754 F756	V716-A718 PolarHBondContact O-N 3.28Å; A718-Y736 HydrophobicContact CB-CE2 3.92Å; A718-H754 PolarHBondContact N-O 3.3Å; A718-F756 HydrophobicContact CB-CD2 4.08Å; A718-F756 HydrophobicContact CB-CE2 3.78Å
719	S	90.9	Very high	92.9	Very high	85 Å²	85	52.3 Å²	52.3	59%	0.594	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	11.1	175.1	66.9	0	0	0	0	114.2	S717 C752	S717-S719 PolarHBondContact O-N 3.18Å; S717-S719 VanDerWaalsContact O-N 3.08Å; S719-C752 WeakPolarHBondContact OG-CB 3.37Å
720	N	90.8	Very high	93.5	Very high	60 Å²	60	51.1 Å²	51.1	32%	0.321	28%	0.282	S	S	.	.			trans	-80.8	122.8	-174.8	-170	-26.8	0	0	0	111.7	V716 S717 A722 M723	V716-N720 HydrophobicContact CG2-CB 3.58Å; S717-N720 WeakPolarHBondContact O-CB 3.46Å; S717-N720 PolarHBondContact O-N 2.9Å; N720-A722 PolarHBondContact O-N 3.14Å; N720-A722 VanDerWaalsContact OD1-CB 3.25Å; N720-A722 WeakPolarHBondContact OD1-CB 3.39Å; N720-A722 PolarHBondContact OD1-N 3.31Å; N720-M723 WeakPolarHBondContact O-CG 3.31Å; N720-M723 PolarHBondContact O-N 2.92Å; N720-M723 VanDerWaalsContact O-N 3.13Å
721	P	89.3	Confident	93.8	Very high	105 Å²	105	49.4 Å²	49.4	68%	0.682	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-10.4	178.5	27	-36.1	0	0	0	114.3	M723	P721-M723 VanDerWaalsContact C-N 3.26Å; P721-M723 PolarHBondContact O-N 2.84Å
722	A	91.8	Very high	93.9	Very high	22 Å²	22	55.7 Å²	55.7	18%	0.182	30%	0.301	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-8.8	173.4	0	0	0	0	0	114.3	N720 L724 L725 Y726	N720-A722 PolarHBondContact O-N 3.14Å; N720-A722 VanDerWaalsContact OD1-CB 3.25Å; N720-A722 WeakPolarHBondContact OD1-CB 3.39Å; N720-A722 PolarHBondContact OD1-N 3.31Å; A722-L724 VanDerWaalsContact C-N 3.28Å; A722-L724 PolarHBondContact O-N 3.06Å; A722-L725 WeakPolarHBondContact O-CA 3.17Å; A722-L725 VanDerWaalsContact O-CB 3.31Å; A722-L725 WeakPolarHBondContact O-CB 3.37Å; A722-L725 PolarHBondContact O-N 2.88Å; A722-Y726 HydrophobicContact CB-CD2 4.36Å; A722-Y726 HydrophobicContact CB-CE2 3.78Å; A722-Y726 VanDerWaalsContact O-CD2 3.26Å; A722-Y726 WeakPolarHBondContact O-CD2 3.44Å; A722-Y726 PolarHBondContact O-N 3.42Å
723	M	92.1	Very high	93.9	Very high	49 Å²	49	58.5 Å²	58.5	24%	0.241	32%	0.324	C	S	.	.	H	α-helix	trans	-51.3	-45.4	176.9	-74.7	-65.4	-71.2	0	0	112.7	V716 N720 P721 L725 Y726 Q727 F756 L758	V716-M723 HydrophobicContact CB-SD 4.4Å; V716-M723 HydrophobicContact CG1-SD 3.46Å; V716-M723 WeakPolarHBondContact CG1-SD 3.3Å; V716-M723 HydrophobicContact CG2-SD 3.99Å; N720-M723 WeakPolarHBondContact O-CG 3.31Å; N720-M723 PolarHBondContact O-N 2.92Å; N720-M723 VanDerWaalsContact O-N 3.13Å; P721-M723 VanDerWaalsContact C-N 3.26Å; P721-M723 PolarHBondContact O-N 2.84Å; M723-L725 PolarHBondContact O-N 3.43Å; M723-Y726 PolarHBondContact O-N 3.12Å; M723-Q727 PolarHBondContact O-N 2.87Å; M723-F756 HydrophobicContact CE-CB 4.26Å; M723-F756 HydrophobicContact CE-CD2 3.53Å; M723-F756 HydrophobicContact CE-CE2 4.03Å; M723-F756 HydrophobicContact CE-CG 3.94Å; M723-F756 HydrophobicContact SD-CD2 4.1Å; M723-L758 HydrophobicContact CE-CD2 4.3Å; M723-L758 HydrophobicContact SD-CD1 4.26Å
724	L	92.2	Very high	93.8	Very high	120 Å²	120	61.7 Å²	61.7	63%	0.628	34%	0.339	S	S	*	.	H	α-helix	trans	-66.7	-23	176.8	-64.8	174.6	0	0	0	113.5	A722 K728	A722-L724 VanDerWaalsContact C-N 3.28Å; A722-L724 PolarHBondContact O-N 3.06Å; L724-K728 VanDerWaalsContact O-CG 3.29Å; L724-K728 WeakPolarHBondContact O-CG 3.38Å; L724-K728 PolarHBondContact O-N 2.88Å
725	L	94.6	Very high	93.8	Very high	44 Å²	44	67 Å²	67	23%	0.23	36%	0.363	C	S	.	.	H	α-helix	trans	-76.7	-44.5	174.4	-179.7	60.9	0	0	0	110.4	T697 I700 A722 M723 K728 F729	T697-L725 HydrophobicContact CG2-CD1 4.46Å; I700-L725 HydrophobicContact CD1-CD2 3.58Å; I700-L725 HydrophobicContact CD1-CG 3.73Å; A722-L725 WeakPolarHBondContact O-CA 3.17Å; A722-L725 VanDerWaalsContact O-CB 3.31Å; A722-L725 WeakPolarHBondContact O-CB 3.37Å; A722-L725 PolarHBondContact O-N 2.88Å; M723-L725 PolarHBondContact O-N 3.43Å; L725-K728 PolarHBondContact O-N 3.22Å; L725-F729 HydrophobicContact CD1-CD2 4.38Å; L725-F729 HydrophobicContact CD1-CE2 4.07Å; L725-F729 WeakPolarHBondContact O-CD2 3.44Å; L725-F729 PolarHBondContact O-N 3.16Å
726	Y	95.9	Very high	93.8	Very high	14 Å²	14	70 Å²	70	6%	0.055	37%	0.373	C	S	.	.	H	α-helix	trans	-64.3	-42.7	176	-58	-52.3	0	0	0	111.7	L684 I700 L714 V716 A722 M723 K728 F729 G730 F731 L758	L684-Y726 HydrophobicContact CD2-CE1 3.95Å; I700-Y726 HydrophobicContact CD1-CD1 3.87Å; I700-Y726 HydrophobicContact CD1-CE1 3.66Å; I700-Y726 HydrophobicContact CG1-CE1 4.35Å; L714-Y726 HydrophobicContact CD1-CD2 4.2Å; L714-Y726 HydrophobicContact CD1-CE2 3.97Å; L714-Y726 HydrophobicContact CD2-CD1 3.62Å; L714-Y726 HydrophobicContact CD2-CD2 4.48Å; L714-Y726 HydrophobicContact CD2-CE1 3.54Å; L714-Y726 HydrophobicContact CD2-CE2 4.41Å; L714-Y726 HydrophobicContact CD2-CG 4.12Å; V716-Y726 HydrophobicContact CB-CE2 4.15Å; V716-Y726 HydrophobicContact CG1-CD2 4.5Å; V716-Y726 HydrophobicContact CG2-CD2 4.43Å; V716-Y726 HydrophobicContact CG2-CE2 3.9Å; A722-Y726 HydrophobicContact CB-CD2 4.36Å; A722-Y726 HydrophobicContact CB-CE2 3.78Å; A722-Y726 VanDerWaalsContact O-CD2 3.26Å; A722-Y726 WeakPolarHBondContact O-CD2 3.44Å; A722-Y726 PolarHBondContact O-N 3.42Å; M723-Y726 PolarHBondContact O-N 3.12Å; Y726-K728 VanDerWaalsContact C-N 3.27Å; Y726-K728 PolarHBondContact O-N 2.89Å; Y726-F729 WeakPolarHBondContact O-CA 3.4Å; Y726-F729 WeakPolarHBondContact O-CB 3.37Å; Y726-F729 PolarHBondContact O-N 2.95Å; Y726-G730 PolarHBondContact O-N 3.32Å; Y726-F731 WeakPolarHBondContact O-CB 3.49Å; Y726-F731 WeakPolarHBondContact O-CD2 3.43Å; Y726-F731 PolarHBondContact O-N 2.78Å; Y726-L758 HydrophobicContact CD2-CD1 3.91Å; Y726-L758 HydrophobicContact CG-CD1 4.04Å
727	Q	94.3	Very high	93.8	Very high	133 Å²	133	71.5 Å²	71.5	62%	0.621	38%	0.381	S	S	*	.	H	α-helix	trans	-57.4	-39.7	175.4	-170.6	-179.5	6.1	0	0	112.2	M723 F729 G730	M723-Q727 PolarHBondContact O-N 2.87Å; Q727-F729 PolarHBondContact O-N 2.92Å; Q727-G730 PolarHBondContact O-N 2.92Å
728	K	94.6	Very high	93.8	Very high	183 Å²	183	76.2 Å²	76.2	80%	0.796	41%	0.405	S	S	*	.	H	α-helix	trans	-66.7	-18.5	174.8	-76.6	179.5	179.1	-163.5	0	114.5	L724 L725 Y726 G730	L724-K728 VanDerWaalsContact O-CG 3.29Å; L724-K728 WeakPolarHBondContact O-CG 3.38Å; L724-K728 PolarHBondContact O-N 2.88Å; L725-K728 PolarHBondContact O-N 3.22Å; Y726-K728 VanDerWaalsContact C-N 3.27Å; Y726-K728 PolarHBondContact O-N 2.89Å; K728-G730 VanDerWaalsContact C-N 3.35Å
729	F	95.1	Very high	93.7	Very high	46 Å²	46	78.9 Å²	78.9	20%	0.202	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.2	4.5	170.2	-85.6	-77.5	0	0	0	113.5	T697 I700 I704 L725 Y726 Q727 F731 L760	T697-F729 HydrophobicContact CG2-CE2 3.74Å; T697-F729 HydrophobicContact CG2-CZ 3.64Å; T697-F729 VanDerWaalsContact O-CZ 3.23Å; T697-F729 WeakPolarHBondContact O-CZ 3.48Å; I700-F729 HydrophobicContact CB-CD2 4.13Å; I700-F729 HydrophobicContact CB-CE2 3.81Å; I700-F729 HydrophobicContact CB-CZ 4.09Å; I700-F729 HydrophobicContact CD1-CD2 4.29Å; I700-F729 HydrophobicContact CD1-CE2 4.26Å; I700-F729 HydrophobicContact CG2-CB 4.35Å; I700-F729 HydrophobicContact CG2-CD1 3.94Å; I700-F729 HydrophobicContact CG2-CD2 3.5Å; I700-F729 HydrophobicContact CG2-CE1 4.09Å; I700-F729 HydrophobicContact CG2-CE2 3.67Å; I700-F729 HydrophobicContact CG2-CG 3.65Å; I700-F729 HydrophobicContact CG2-CZ 3.97Å; I704-F729 HydrophobicContact CD1-CB 4.34Å; I704-F729 HydrophobicContact CD1-CD1 3.76Å; I704-F729 HydrophobicContact CD1-CE1 4.4Å; I704-F729 HydrophobicContact CD1-CG 4.2Å; L725-F729 HydrophobicContact CD1-CD2 4.38Å; L725-F729 HydrophobicContact CD1-CE2 4.07Å; L725-F729 WeakPolarHBondContact O-CD2 3.44Å; L725-F729 PolarHBondContact O-N 3.16Å; Y726-F729 WeakPolarHBondContact O-CA 3.4Å; Y726-F729 WeakPolarHBondContact O-CB 3.37Å; Y726-F729 PolarHBondContact O-N 2.95Å; Q727-F729 PolarHBondContact O-N 2.92Å; F729-F731 HydrophobicContact CB-CD2 3.76Å; F729-F731 HydrophobicContact CB-CE2 3.91Å; F729-L760 WeakPolarHBondContact O-CD1 3.42Å
730	G	95.3	Very high	93.7	Very high	39 Å²	39	76.7 Å²	76.7	40%	0.402	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.5	8.3	-179.4	0	0	0	0	0	114.8	Y726 Q727 K728 K732	Y726-G730 PolarHBondContact O-N 3.32Å; Q727-G730 PolarHBondContact O-N 2.92Å; K728-G730 VanDerWaalsContact C-N 3.35Å; G730-K732 PolarHBondContact O-N 2.8Å
731	F	96.8	Very high	93.6	Very high	10 Å²	10	74.9 Å²	74.9	4%	0.044	38%	0.383	C	S	.	.			trans	-63.8	128.9	172.3	-75.6	-96.5	0	0	0	110.3	I681 I700 I704 V712 L714 Y726 F729 L758 L760	I681-F731 HydrophobicContact CD1-CZ 4.25Å; I700-F731 HydrophobicContact CG2-CE2 4.3Å; I704-F731 HydrophobicContact CD1-CE2 3.93Å; I704-F731 HydrophobicContact CD1-CZ 4.32Å; V712-F731 HydrophobicContact CB-CE1 4.35Å; V712-F731 HydrophobicContact CB-CZ 4.29Å; V712-F731 HydrophobicContact CG1-CE1 4.1Å; V712-F731 HydrophobicContact CG1-CZ 3.87Å; V712-F731 VanDerWaalsContact O-CE1 3.32Å; V712-F731 WeakPolarHBondContact O-CE1 3.25Å; L714-F731 HydrophobicContact CD2-CD1 4.09Å; L714-F731 HydrophobicContact CD2-CE1 3.66Å; L714-F731 HydrophobicContact CD2-CZ 3.92Å; L714-F731 HydrophobicContact CG-CD1 4.49Å; L714-F731 HydrophobicContact CG-CE1 4.27Å; Y726-F731 WeakPolarHBondContact O-CB 3.49Å; Y726-F731 WeakPolarHBondContact O-CD2 3.43Å; Y726-F731 PolarHBondContact O-N 2.78Å; F729-F731 HydrophobicContact CB-CD2 3.76Å; F729-F731 HydrophobicContact CB-CE2 3.91Å; F731-L758 HydrophobicContact CB-CB 4.16Å; F731-L758 HydrophobicContact CB-CD1 4.23Å; F731-L758 HydrophobicContact CD1-CB 4.01Å; F731-L760 HydrophobicContact CD1-CB 3.74Å; F731-L760 HydrophobicContact CD2-CB 4.11Å; F731-L760 HydrophobicContact CE1-CB 3.76Å; F731-L760 HydrophobicContact CE2-CB 4.15Å; F731-L760 HydrophobicContact CE2-CD2 4.16Å; F731-L760 HydrophobicContact CG-CB 3.91Å; F731-L760 HydrophobicContact CZ-CB 3.97Å; F731-L760 HydrophobicContact CZ-CD2 4.36Å
732	K	96.6	Very high	93.5	Very high	159 Å²	159	72.7 Å²	72.7	69%	0.691	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	143.4	173.6	-61.6	-176.9	-179.2	-177.7	0	109.3	G730 L758 R759	G730-K732 PolarHBondContact O-N 2.8Å; K732-L758 CarbonylContact O-C 3.51Å; K732-L758 VanDerWaalsContact O-CA 3.3Å; K732-L758 WeakPolarHBondContact O-CA 3.29Å; K732-R759 PolarHBondContact N-O 3.36Å; K732-R759 PolarHBondContact O-N 3.16Å
733	A	95.3	Very high	93.1	Very high	59 Å²	59	78.4 Å²	78.4	49%	0.488	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	129.2	170	0	0	0	0	0	109.3	F756 L758	A733-F756 HydrophobicContact CB-CD1 4.12Å; A733-L758 HydrophobicContact CB-CD2 3.62Å
734	E	94.6	Very high	92.7	Very high	71 Å²	71	79.8 Å²	79.8	33%	0.332	39%	0.39	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	-29.8	176.6	-67.1	-172.3	140.9	0	0	112.2	F757 R759 R761	E734-F757 HydrophobicContact CB-CD1 4.21Å; E734-F757 PolarHBondContact N-O 3.22Å; E734-R759 VanDerWaalsContact CD-NH1 3.31Å; E734-R759 HydrophobicContact CG-CB 4.22Å; E734-R759 WeakPolarHBondContact OE1-CD 3.5Å; E734-R759 IonicContact OE1-NH1 2.73Å; E734-R759 PolarHBondContact OE1-NH1 2.86Å; E734-R759 VanDerWaalsContact OE2-CB 3.31Å; E734-R759 WeakPolarHBondContact OE2-CB 3.36Å; E734-R759 WeakPolarHBondContact OE2-CD 3.39Å; E734-R759 IonicContact OE2-CZ 3.54Å; E734-R759 IonicContact OE2-NE 3.28Å; E734-R759 IonicContact OE2-NH1 3.18Å; E734-R759 PolarHBondContact OE2-NH1 2.76Å; E734-R761 IonicContact OE1-CZ 2.72Å; E734-R761 IonicContact OE1-NE 3.15Å; E734-R761 PolarHBondContact OE1-NE 3.08Å; E734-R761 IonicContact OE1-NH2 3.46Å; E734-R761 PolarHBondContact OE1-NH2 2.89Å
735	E	95.6	Very high	92.3	Very high	113 Å²	113	75.5 Å²	75.5	53%	0.528	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	147.2	178.5	-164.2	178.6	175.2	0	0	111.1	I737 F756 F757	E735-I737 HydrophobicContact CB-CG1 4.32Å; E735-I737 HydrophobicContact CG-CG1 3.84Å; E735-F756 WeakPolarHBondContact O-CA 3.31Å; E735-F757 HydrophobicContact CB-CB 4.08Å; E735-F757 PolarHBondContact O-N 3.43Å
736	Y	96.1	Very high	91.5	Very high	109 Å²	109	77.4 Å²	77.4	43%	0.427	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	110.8	168.7	177.4	-107.2	0	0	0	108.9	A718 L738 H754 F756	A718-Y736 HydrophobicContact CB-CE2 3.92Å; Y736-L738 HydrophobicContact CD1-CD2 4.41Å; Y736-L738 HydrophobicContact CE1-CD2 3.65Å; Y736-L738 HydrophobicContact CE1-CG 4.48Å; Y736-H754 HydrophobicContact CE2-CB 3.95Å; Y736-H754 WeakPolarHBondContact OH-CB 3.23Å; Y736-H754 PolarHBondContact OH-CD2 2.99Å; Y736-F756 AromaticContact CD2-CD1 3.74Å; Y736-F756 HydrophobicContact CD2-CD1 3.74Å; Y736-F756 HydrophobicContact CD2-CD2 4.36Å; Y736-F756 AromaticContact CD2-CE1 3.44Å; Y736-F756 HydrophobicContact CD2-CE1 3.44Å; Y736-F756 VanDerWaalsContact CD2-CE1 3.44Å; Y736-F756 HydrophobicContact CD2-CE2 4.1Å; Y736-F756 HydrophobicContact CD2-CG 4.19Å; Y736-F756 AromaticContact CD2-CZ 3.63Å; Y736-F756 HydrophobicContact CD2-CZ 3.63Å; Y736-F756 HydrophobicContact CE2-CE1 4.24Å; Y736-F756 HydrophobicContact CE2-CE2 4.21Å; Y736-F756 AromaticContact CE2-CZ 3.97Å; Y736-F756 HydrophobicContact CE2-CZ 3.97Å; Y736-F756 HydrophobicContact CG-CD1 4.43Å; Y736-F756 HydrophobicContact CG-CE1 4.1Å
737	I	94.3	Very high	90.6	Very high	36 Å²	36	82.6 Å²	82.6	19%	0.185	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	113.1	-169.4	-52.5	176.8	0	0	0	109	E735 F740 H754 A755 F757	E735-I737 HydrophobicContact CB-CG1 4.32Å; E735-I737 HydrophobicContact CG-CG1 3.84Å; I737-F740 HydrophobicContact CB-CB 4.48Å; I737-F740 HydrophobicContact CD1-CD2 4.33Å; I737-F740 HydrophobicContact CG2-CB 4.12Å; I737-F740 HydrophobicContact CG2-CD2 4.11Å; I737-H754 WeakPolarHBondContact O-CA 3.46Å; I737-A755 PolarHBondContact N-O 3.2Å; I737-A755 PolarHBondContact O-N 2.95Å; I737-F757 HydrophobicContact CD1-CB 4.18Å
738	L	92.5	Very high	89.9	Confident	110 Å²	110	83.9 Å²	83.9	58%	0.576	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	148.9	171	-63.5	175	0	0	0	110.7	Y736 F740	Y736-L738 HydrophobicContact CD1-CD2 4.41Å; Y736-L738 HydrophobicContact CE1-CD2 3.65Å; Y736-L738 HydrophobicContact CE1-CG 4.48Å; L738-F740 PolarHBondContact O-N 2.9Å
739	D	89.4	Confident	89.3	Confident	89 Å²	89	76.7 Å²	76.7	48%	0.476	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.3	24.6	170.4	-48.8	-17.9	0	0	0	116.8	Y741 D742 R753 H754	D739-Y741 PolarHBondContact O-N 3.42Å; D739-D742 WeakPolarHBondContact CA-OD1 3.45Å; D739-D742 HydrophobicContact CB-CB 4.37Å; D739-D742 WeakPolarHBondContact CB-OD1 3.31Å; D739-D742 PolarHBondContact O-N 3.01Å; D739-R753 CarbonylContact C-O 3.4Å; D739-H754 PolarHBondContact N-ND1 2.62Å; D739-H754 IonicContact OD1-CE1 2.66Å; D739-H754 PolarHBondContact OD1-CE1 3.25Å; D739-H754 IonicContact OD1-ND1 3.7Å; D739-H754 PolarHBondContact OD1-ND1 3Å
740	F	89.9	Confident	88.6	Confident	39 Å²	39	80.5 Å²	80.5	17%	0.171	43%	0.429	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-36.1	-179.1	-178.8	-89.3	0	0	0	113.3	H715 I737 L738 K743 R753 A755	H715-F740 HydrophobicContact CB-CE1 3.95Å; H715-F740 HydrophobicContact CB-CE2 4.31Å; H715-F740 HydrophobicContact CB-CZ 3.68Å; H715-F740 AromaticContact CD2-CD2 3.97Å; H715-F740 AromaticContact CD2-CE2 3.33Å; H715-F740 WeakPolarHBondContact CD2-CE2 3.34Å; H715-F740 AromaticContact CD2-CZ 3.62Å; H715-F740 AromaticContact CE1-CE2 3.85Å; H715-F740 AromaticContact CG-CE2 3.63Å; H715-F740 AromaticContact CG-CZ 3.39Å; H715-F740 AromaticContact ND1-CE2 3.93Å; H715-F740 AromaticContact ND1-CZ 3.69Å; H715-F740 AromaticContact NE2-CE2 3.48Å; H715-F740 WeakPolarHBondContact NE2-CE2 3.46Å; I737-F740 HydrophobicContact CB-CB 4.48Å; I737-F740 HydrophobicContact CD1-CD2 4.33Å; I737-F740 HydrophobicContact CG2-CB 4.12Å; I737-F740 HydrophobicContact CG2-CD2 4.11Å; L738-F740 PolarHBondContact O-N 2.9Å; F740-K743 WeakPolarHBondContact O-CE 3.42Å; F740-R753 PolarHBondContact N-O 3.31Å; F740-R753 VanDerWaalsContact N-O 3.09Å; F740-A755 HydrophobicContact CB-CB 3.75Å; F740-A755 HydrophobicContact CD1-CB 3.89Å; F740-A755 HydrophobicContact CD2-CB 4.37Å; F740-A755 HydrophobicContact CG-CB 3.75Å
741	Y	88.8	Confident	88.1	Confident	22 Å²	22	83.6 Å²	83.6	9%	0.086	43%	0.434	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	-0.6	-177.6	-61.7	-83.2	0	0	0	114.7	W640 S717 D739 K743 Y744 Y745 R753 A755	W640-Y741 HydrophobicContact CH2-CE1 4.46Å; W640-Y741 AromaticContact CZ3-CD1 3.93Å; W640-Y741 HydrophobicContact CZ3-CD1 3.93Å; W640-Y741 AromaticContact CZ3-CE1 3.98Å; W640-Y741 HydrophobicContact CZ3-CE1 3.98Å; S717-Y741 PolarHBondContact N-OH 3.31Å; D739-Y741 PolarHBondContact O-N 3.42Å; Y741-K743 PolarHBondContact O-N 2.89Å; Y741-Y744 AromaticContact CD1-CD2 3.92Å; Y741-Y744 HydrophobicContact CD1-CD2 3.92Å; Y741-Y744 HydrophobicContact CD1-CE2 4.41Å; Y741-Y744 PolarHBondContact O-N 2.61Å; Y741-Y745 VanDerWaalsContact CB-CE2 3.41Å; Y741-Y745 HydrophobicContact CD1-CE2 4.4Å; Y741-Y745 HydrophobicContact CD2-CE2 4.49Å; Y741-Y745 HydrophobicContact CG-CD2 4.49Å; Y741-Y745 AromaticContact CG-CE2 3.9Å; Y741-Y745 HydrophobicContact CG-CE2 3.9Å; Y741-Y745 PolarHBondContact O-N 3.13Å; Y741-R753 WeakPolarHBondContact CD2-O 3.31Å; Y741-R753 PolarHBondContact N-O 3.37Å; Y741-A755 HydrophobicContact CD2-CB 4.46Å; Y741-A755 HydrophobicContact CE2-CB 3.75Å
742	D	87	Confident	87.7	Confident	59 Å²	59	84.7 Å²	84.7	32%	0.316	44%	0.442	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-26.5	-176.9	-81.5	58.5	0	0	0	114.3	D739 Y744 R753	D739-D742 WeakPolarHBondContact CA-OD1 3.45Å; D739-D742 HydrophobicContact CB-CB 4.37Å; D739-D742 WeakPolarHBondContact CB-OD1 3.31Å; D739-D742 PolarHBondContact O-N 3.01Å; D742-Y744 PolarHBondContact O-N 2.78Å; D742-R753 WeakPolarHBondContact OD1-CB 3.23Å; D742-R753 WeakPolarHBondContact OD1-CD 3.41Å; D742-R753 WeakPolarHBondContact OD1-CG 3.37Å; D742-R753 WeakPolarHBondContact OD2-CD 3.4Å; D742-R753 IonicContact OD2-CZ 2.69Å; D742-R753 IonicContact OD2-NE 3.01Å; D742-R753 IonicContact OD2-NH1 2.66Å; D742-R753 PolarHBondContact OD2-NH1 3.3Å
743	K	84.4	Confident	87.3	Confident	143 Å²	143	80.3 Å²	80.3	62%	0.622	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-9.4	172.4	51.9	168	165.9	166.2	0	114.3	F740 Y741	F740-K743 WeakPolarHBondContact O-CE 3.42Å; Y741-K743 PolarHBondContact O-N 2.89Å
744	Y	84	Confident	87.2	Confident	78 Å²	78	80 Å²	80	31%	0.306	41%	0.409	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.8	-38	-175.7	-54	-50.8	0	0	0	112.8	W640 Y741 D742	W640-Y744 HydrophobicContact CD2-CD1 4.31Å; W640-Y744 HydrophobicContact CD2-CD2 4.34Å; W640-Y744 AromaticContact CD2-CG 3.88Å; W640-Y744 HydrophobicContact CD2-CG 3.88Å; W640-Y744 AromaticContact CE2-CD1 3.78Å; W640-Y744 AromaticContact CE2-CG 3.74Å; W640-Y744 HydrophobicContact CE3-CD2 4.22Å; W640-Y744 HydrophobicContact CE3-CG 4.16Å; W640-Y744 HydrophobicContact CG-CG 4.4Å; W640-Y744 AromaticContact CH2-CD2 3.84Å; W640-Y744 HydrophobicContact CH2-CD2 3.84Å; W640-Y744 AromaticContact CH2-CE2 3.89Å; W640-Y744 HydrophobicContact CH2-CE2 3.89Å; W640-Y744 HydrophobicContact CH2-CG 4.27Å; W640-Y744 HydrophobicContact CZ2-CD1 4.04Å; W640-Y744 AromaticContact CZ2-CD2 3.92Å; W640-Y744 HydrophobicContact CZ2-CD2 3.92Å; W640-Y744 HydrophobicContact CZ2-CE1 4.07Å; W640-Y744 AromaticContact CZ2-CE2 3.93Å; W640-Y744 HydrophobicContact CZ2-CE2 3.93Å; W640-Y744 AromaticContact CZ2-CG 3.96Å; W640-Y744 HydrophobicContact CZ2-CG 3.96Å; W640-Y744 AromaticContact CZ2-CZ 3.99Å; W640-Y744 AromaticContact CZ3-CD2 3.99Å; W640-Y744 HydrophobicContact CZ3-CD2 3.99Å; W640-Y744 HydrophobicContact CZ3-CE2 4.46Å; W640-Y744 HydrophobicContact CZ3-CG 4.36Å; W640-Y744 AromaticContact NE1-CD1 3.77Å; Y741-Y744 AromaticContact CD1-CD2 3.92Å; Y741-Y744 HydrophobicContact CD1-CD2 3.92Å; Y741-Y744 HydrophobicContact CD1-CE2 4.41Å; Y741-Y744 PolarHBondContact O-N 2.61Å; D742-Y744 PolarHBondContact O-N 2.78Å
745	Y	82.5	Confident	87.3	Confident	29 Å²	29	76.6 Å²	76.6	11%	0.114	39%	0.394	C	S	.	.	S	Bend	trans	-84.6	145.8	177.7	-66.2	-42.6	0	0	0	112.3	Y741 E751	Y741-Y745 VanDerWaalsContact CB-CE2 3.41Å; Y741-Y745 HydrophobicContact CD1-CE2 4.4Å; Y741-Y745 HydrophobicContact CD2-CE2 4.49Å; Y741-Y745 HydrophobicContact CG-CD2 4.49Å; Y741-Y745 AromaticContact CG-CE2 3.9Å; Y741-Y745 HydrophobicContact CG-CE2 3.9Å; Y741-Y745 PolarHBondContact O-N 3.13Å; Y745-E751 HydrophobicContact CD2-CB 4.39Å; Y745-E751 HydrophobicContact CE1-CB 4.43Å; Y745-E751 HydrophobicContact CE2-CB 3.94Å; Y745-E751 PolarHBondContact OH-OE2 2.96Å; Y745-E751 VanDerWaalsContact OH-OE2 3.06Å
746	P	79	Confident	87.3	Confident	85 Å²	85	73.9 Å²	73.9	55%	0.552	38%	0.38	S	S	*	.			trans	-58.3	150.7	166.8	-23.4	34.1	0	0	0	112.1	D748 S749	P746-D748 PolarHBondContact O-N 3.26Å; P746-D748 VanDerWaalsContact O-N 3.13Å; P746-S749 WeakPolarHBondContact O-CB 3.2Å; P746-S749 PolarHBondContact O-N 3Å
747	V	76.6	Confident	87.3	Confident	123 Å²	123	70.2 Å²	70.2	75%	0.745	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-32.6	178	-176.3	0	0	0	0	112.1	S749 R753	V747-S749 VanDerWaalsContact C-N 3.29Å; V747-S749 PolarHBondContact O-N 3.43Å; V747-R753 PolarHBondContact O-NH2 3.31Å
748	D	80.3	Confident	87.5	Confident	159 Å²	159	68.7 Å²	68.7	85%	0.85	36%	0.359	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	5	178.7	-49.9	-34.5	0	0	0	113.8	P746	P746-D748 PolarHBondContact O-N 3.26Å; P746-D748 VanDerWaalsContact O-N 3.13Å
749	S	81	Confident	87.6	Confident	32 Å²	32	65.7 Å²	65.7	22%	0.224	34%	0.34	C	S	.	.			trans	-72.3	136.2	-177.4	-172.8	0	0	0	0	112.4	P746 V747 E751	P746-S749 WeakPolarHBondContact O-CB 3.2Å; P746-S749 PolarHBondContact O-N 3Å; V747-S749 VanDerWaalsContact C-N 3.29Å; V747-S749 PolarHBondContact O-N 3.43Å; S749-E751 PolarHBondContact OG-N 2.89Å
750	S	81.4	Confident	87.9	Confident	126 Å²	126	62.3 Å²	62.3	88%	0.881	32%	0.321	S	S	*	.			trans	-91.1	5.5	173.3	63.2	0	0	0	0	114
751	E	84.8	Confident	88	Confident	105 Å²	105	68.8 Å²	68.8	49%	0.491	35%	0.345	S	S	.	.	S	Bend	trans	-81.5	152.6	177.2	-62.5	-156.3	177.5	0	0	112.4	Y745 S749 R753	Y745-E751 HydrophobicContact CD2-CB 4.39Å; Y745-E751 HydrophobicContact CE1-CB 4.43Å; Y745-E751 HydrophobicContact CE2-CB 3.94Å; Y745-E751 PolarHBondContact OH-OE2 2.96Å; Y745-E751 VanDerWaalsContact OH-OE2 3.06Å; S749-E751 PolarHBondContact OG-N 2.89Å; E751-R753 PolarHBondContact O-N 3.06Å
752	C	87.1	Confident	87.6	Confident	33 Å²	33	75 Å²	75	22%	0.223	37%	0.368	C	S	.	.			trans	-72	117.9	-176.6	-174.1	0	0	0	0	111.6	S717 S719	S717-C752 PolarHBondContact OG-O 3.28Å; S719-C752 WeakPolarHBondContact OG-CB 3.37Å
753	R	89.4	Confident	87.6	Confident	67 Å²	67	75.8 Å²	75.8	25%	0.253	37%	0.371	S	S	.	.			trans	-74.2	-24.6	-175.7	-74.2	168.1	-167	-132.9	5.7	114.6	D739 F740 Y741 D742 V747 E751	D739-R753 CarbonylContact C-O 3.4Å; F740-R753 PolarHBondContact N-O 3.31Å; F740-R753 VanDerWaalsContact N-O 3.09Å; Y741-R753 WeakPolarHBondContact CD2-O 3.31Å; Y741-R753 PolarHBondContact N-O 3.37Å; D742-R753 WeakPolarHBondContact OD1-CB 3.23Å; D742-R753 WeakPolarHBondContact OD1-CD 3.41Å; D742-R753 WeakPolarHBondContact OD1-CG 3.37Å; D742-R753 WeakPolarHBondContact OD2-CD 3.4Å; D742-R753 IonicContact OD2-CZ 2.69Å; D742-R753 IonicContact OD2-NE 3.01Å; D742-R753 IonicContact OD2-NH1 2.66Å; D742-R753 PolarHBondContact OD2-NH1 3.3Å; V747-R753 PolarHBondContact O-NH2 3.31Å; E751-R753 PolarHBondContact O-N 3.06Å
754	H	92.8	Very high	87.8	Confident	52 Å²	52	72.2 Å²	72.2	24%	0.241	36%	0.357	C	S	.	.			trans	-89.2	149.1	-173.7	-40	-43.1	0	0	0	111.1	S717 A718 Y736 I737 D739	S717-H754 WeakPolarHBondContact CA-O 3.42Å; A718-H754 PolarHBondContact N-O 3.3Å; Y736-H754 HydrophobicContact CE2-CB 3.95Å; Y736-H754 WeakPolarHBondContact OH-CB 3.23Å; Y736-H754 PolarHBondContact OH-CD2 2.99Å; I737-H754 WeakPolarHBondContact O-CA 3.46Å; D739-H754 PolarHBondContact N-ND1 2.62Å; D739-H754 IonicContact OD1-CE1 2.66Å; D739-H754 PolarHBondContact OD1-CE1 3.25Å; D739-H754 IonicContact OD1-ND1 3.7Å; D739-H754 PolarHBondContact OD1-ND1 3Å
755	A	95.7	Very high	88	Confident	0 Å²	0	71.9 Å²	71.9	0%	0	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	145.3	-179	0	0	0	0	0	111.8	V716 I737 F740 Y741	V716-A755 CarbonylContact O-C 3.6Å; V716-A755 VanDerWaalsContact O-CA 3.25Å; V716-A755 WeakPolarHBondContact O-CA 3.33Å; I737-A755 PolarHBondContact N-O 3.2Å; I737-A755 PolarHBondContact O-N 2.95Å; F740-A755 HydrophobicContact CB-CB 3.75Å; F740-A755 HydrophobicContact CD1-CB 3.89Å; F740-A755 HydrophobicContact CD2-CB 4.37Å; F740-A755 HydrophobicContact CG-CB 3.75Å; Y741-A755 HydrophobicContact CD2-CB 4.46Å; Y741-A755 HydrophobicContact CE2-CB 3.75Å
756	F	96.4	Very high	88.3	Confident	56 Å²	56	74.4 Å²	74.4	25%	0.246	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	135.8	156	-68.8	-79.5	0	0	0	109.3	H715 V716 A718 M723 A733 E735 Y736 L758	H715-F756 WeakPolarHBondContact CA-O 3.42Å; V716-F756 HydrophobicContact CG1-CB 4.17Å; V716-F756 PolarHBondContact N-O 2.91Å; V716-F756 PolarHBondContact O-N 2.7Å; A718-F756 HydrophobicContact CB-CD2 4.08Å; A718-F756 HydrophobicContact CB-CE2 3.78Å; M723-F756 HydrophobicContact CE-CB 4.26Å; M723-F756 HydrophobicContact CE-CD2 3.53Å; M723-F756 HydrophobicContact CE-CE2 4.03Å; M723-F756 HydrophobicContact CE-CG 3.94Å; M723-F756 HydrophobicContact SD-CD2 4.1Å; A733-F756 HydrophobicContact CB-CD1 4.12Å; E735-F756 WeakPolarHBondContact O-CA 3.31Å; Y736-F756 AromaticContact CD2-CD1 3.74Å; Y736-F756 HydrophobicContact CD2-CD1 3.74Å; Y736-F756 HydrophobicContact CD2-CD2 4.36Å; Y736-F756 AromaticContact CD2-CE1 3.44Å; Y736-F756 HydrophobicContact CD2-CE1 3.44Å; Y736-F756 VanDerWaalsContact CD2-CE1 3.44Å; Y736-F756 HydrophobicContact CD2-CE2 4.1Å; Y736-F756 HydrophobicContact CD2-CG 4.19Å; Y736-F756 AromaticContact CD2-CZ 3.63Å; Y736-F756 HydrophobicContact CD2-CZ 3.63Å; Y736-F756 HydrophobicContact CE2-CE1 4.24Å; Y736-F756 HydrophobicContact CE2-CE2 4.21Å; Y736-F756 AromaticContact CE2-CZ 3.97Å; Y736-F756 HydrophobicContact CE2-CZ 3.97Å; Y736-F756 HydrophobicContact CG-CD1 4.43Å; Y736-F756 HydrophobicContact CG-CE1 4.1Å; F756-L758 HydrophobicContact CB-CD2 3.76Å; F756-L758 HydrophobicContact CB-CG 4.45Å
757	F	96.8	Very high	88.9	Confident	31 Å²	31	73.8 Å²	73.8	14%	0.136	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	118.5	160.5	179.1	-111.6	0	0	0	108.1	T713 H715 E734 E735 I737	T713-F757 HydrophobicContact CG2-CE2 4.23Å; T713-F757 HydrophobicContact CG2-CZ 3.68Å; H715-F757 AromaticContact CD2-CD2 3.9Å; H715-F757 AromaticContact CE1-CD2 3.65Å; H715-F757 AromaticContact NE2-CD2 3.49Å; H715-F757 WeakPolarHBondContact NE2-CD2 3.3Å; E734-F757 HydrophobicContact CB-CD1 4.21Å; E734-F757 PolarHBondContact N-O 3.22Å; E735-F757 HydrophobicContact CB-CB 4.08Å; E735-F757 PolarHBondContact O-N 3.43Å; I737-F757 HydrophobicContact CD1-CB 4.18Å
758	L	97	Very high	89.7	Confident	5 Å²	5	70.5 Å²	70.5	3%	0.026	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	139.8	179.1	-50.5	-172.5	0	0	0	110.6	T713 L714 V716 M723 Y726 F731 K732 A733 F756	T713-L758 CarbonylContact C-O 3.54Å; T713-L758 VanDerWaalsContact CA-O 3.3Å; T713-L758 WeakPolarHBondContact CA-O 3.46Å; L714-L758 HydrophobicContact CD1-CB 4.29Å; L714-L758 HydrophobicContact CD1-CD1 4.07Å; L714-L758 HydrophobicContact CD1-CG 4.2Å; L714-L758 HydrophobicContact CG-CB 4.22Å; L714-L758 PolarHBondContact N-O 3.07Å; L714-L758 PolarHBondContact O-N 3.42Å; V716-L758 HydrophobicContact CG1-CD1 3.78Å; V716-L758 HydrophobicContact CG1-CG 3.84Å; M723-L758 HydrophobicContact CE-CD2 4.3Å; M723-L758 HydrophobicContact SD-CD1 4.26Å; Y726-L758 HydrophobicContact CD2-CD1 3.91Å; Y726-L758 HydrophobicContact CG-CD1 4.04Å; F731-L758 HydrophobicContact CB-CB 4.16Å; F731-L758 HydrophobicContact CB-CD1 4.23Å; F731-L758 HydrophobicContact CD1-CB 4.01Å; K732-L758 CarbonylContact O-C 3.51Å; K732-L758 VanDerWaalsContact O-CA 3.3Å; K732-L758 WeakPolarHBondContact O-CA 3.29Å; A733-L758 HydrophobicContact CB-CD2 3.62Å; F756-L758 HydrophobicContact CB-CD2 3.76Å; F756-L758 HydrophobicContact CB-CG 4.45Å
759	R	95.8	Very high	90.4	Very high	46 Å²	46	64.1 Å²	64.1	17%	0.174	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	133.6	170.4	-176	-173.8	-100.2	142	-16.3	110.5	E678 D711 V712 T713 K732 E734 R761	E678-R759 IonicContact OE1-CZ 3.87Å; E678-R759 IonicContact OE1-NH2 2.9Å; E678-R759 PolarHBondContact OE1-NH2 2.84Å; D711-R759 HydrophobicContact CB-CG 4.25Å; D711-R759 WeakPolarHBondContact OD2-CD 3.49Å; D711-R759 IonicContact OD2-CZ 3.57Å; D711-R759 IonicContact OD2-NE 2.66Å; D711-R759 PolarHBondContact OD2-NE 3.38Å; D711-R759 IonicContact OD2-NH2 2.88Å; V712-R759 WeakPolarHBondContact O-CA 3.26Å; T713-R759 HydrophobicContact CG2-CB 4.14Å; T713-R759 HydrophobicContact CG2-CG 3.89Å; K732-R759 PolarHBondContact N-O 3.36Å; K732-R759 PolarHBondContact O-N 3.16Å; E734-R759 VanDerWaalsContact CD-NH1 3.31Å; E734-R759 HydrophobicContact CG-CB 4.22Å; E734-R759 WeakPolarHBondContact OE1-CD 3.5Å; E734-R759 IonicContact OE1-NH1 2.73Å; E734-R759 PolarHBondContact OE1-NH1 2.86Å; E734-R759 VanDerWaalsContact OE2-CB 3.31Å; E734-R759 WeakPolarHBondContact OE2-CB 3.36Å; E734-R759 WeakPolarHBondContact OE2-CD 3.39Å; E734-R759 IonicContact OE2-CZ 3.54Å; E734-R759 IonicContact OE2-NE 3.28Å; E734-R759 IonicContact OE2-NH1 3.18Å; E734-R759 PolarHBondContact OE2-NH1 2.76Å; R759-R761 HydrophobicContact CG-CG 4.07Å
760	L	95.6	Very high	91.1	Very high	18 Å²	18	66.6 Å²	66.6	9%	0.094	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	116.6	159.9	170.8	62.2	0	0	0	107.1	I704 D711 V712 F729 F731 R762	I704-L760 HydrophobicContact CD1-CD2 3.68Å; I704-L760 HydrophobicContact CG1-CD2 4.09Å; I704-L760 HydrophobicContact CG2-CD2 4.11Å; D711-L760 WeakPolarHBondContact CA-O 3.14Å; V712-L760 HydrophobicContact CB-CB 4.4Å; V712-L760 PolarHBondContact N-O 3.07Å; V712-L760 PolarHBondContact O-N 3.18Å; F729-L760 WeakPolarHBondContact O-CD1 3.42Å; F731-L760 HydrophobicContact CD1-CB 3.74Å; F731-L760 HydrophobicContact CD2-CB 4.11Å; F731-L760 HydrophobicContact CE1-CB 3.76Å; F731-L760 HydrophobicContact CE2-CB 4.15Å; F731-L760 HydrophobicContact CE2-CD2 4.16Å; F731-L760 HydrophobicContact CG-CB 3.91Å; F731-L760 HydrophobicContact CZ-CB 3.97Å; F731-L760 HydrophobicContact CZ-CD2 4.36Å; L760-R762 HydrophobicContact CG-CG 4.46Å
761	R	91.8	Very high	92	Very high	175 Å²	175	61.7 Å²	61.7	66%	0.66	26%	0.26	S	S	*	.			trans	-84.9	143.1	176.3	-66.6	-179.6	-170.3	-170.2	2.9	110.7	D711 E734 R759	D711-R761 VanDerWaalsContact OD1-CA 3.25Å; D711-R761 WeakPolarHBondContact OD1-CA 3.48Å; E734-R761 IonicContact OE1-CZ 2.72Å; E734-R761 IonicContact OE1-NE 3.15Å; E734-R761 PolarHBondContact OE1-NE 3.08Å; E734-R761 IonicContact OE1-NH2 3.46Å; E734-R761 PolarHBondContact OE1-NH2 2.89Å; R759-R761 HydrophobicContact CG-CG 4.07Å
762	R	80.3	Confident	92.6	Very high	152 Å²	152	57.7 Å²	57.7	57%	0.574	24%	0.239	S	C	*	.			trans	-147.3	0	-176.6	-85.8	-167.2	155.2	-153	-12.1	113.4	I704 Q705 D711 L760	I704-R762 VanDerWaalsContact CG2-NH1 3.33Å; I704-R762 PolarHBondContact O-NH1 3.25Å; Q705-R762 VanDerWaalsContact OE1-NH2 3.14Å; D711-R762 PolarHBondContact OD1-N 3.29Å; L760-R762 HydrophobicContact CG-CG 4.46Å

Retrieved 762 of 762 residues in 787.8 ms (Link to these results)

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