A0A087XSQ9_POEFO Loading...

Zinc finger protein 827

As part of a ribonucleoprotein complex composed at least of HNRNPK, HNRNPL and the circular RNA circZNF827 that nucleates the complex on chromatin, may negatively regulate the transcription of genes involved in neuronal differentiation. Could also recruit the nucleosome remodeling and histone deacetylase/NuRD complex to telomeric regions of chromosomes to regulate chromatin remodeling as part of telomere maintenance.

AlphaFold DB , UniProt , Accession A0A087XSQ9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,097 aa.

						>A0A087XSQ9_POEFO|A0A087XSQ9
EEEGWFGNASDTRSDSSSFGDTQDELLLHRASSPEDQSGICGGSVDHDTCGGESSLGCPTPVHRASLELLGLDGSTFSAQDTLSSVVSSLYGEAASRALGKPLSSNLRRLLEAGSLKLDGGEVLGRSSRGNAGGESPPIALAPPLTLSPSSHHAQQLSALARKLQEPLDPFNSVTPTNGSGFVWAGVADKWPPASCSTPCGSSLSPDSAIQKLKAAANAVLQDNGGSRGDDVVRFDAFNSPFSPQSASSTLAALSKKVSERTQGSSTASTVSDHQTSASSFLSLVSITTSSAALLKEVAARAAGNLLAEKKDGSPLSTVGVLQEDVKPLLDKNQKAPTPTTPTQSLELLLPSTPKGRGKPNNQAGSPEDGGKPFQCPVCGLVIKRKSYWKRHMVIHTGLKSHQCPLCPFRCARKDNLKSHMKVHQHQDRGETFQCELCPFTSSRHFSLKLHMRCHQHFPRTDVKVKEEPTTDTEGEGSLLGDGSTNDLRAAEASPLQAEAQQQTSPPNEASSNHVHVKEEPQERDLSVLSPFSICRDRPGSSTNSLDLPGVGIGVGMRSSPSGPTTASLFSPDITTKTATDLLMKLSAANQRESLKSPFHLKEEPKVEETPSPRPSSQCQSQDGPTGAAASAAMESLKPREGSPMAKNSLLSQDINVKVASELLIKLSENSKDAQYQKVKVKAEPMEVDPPPAERTPPASHLLTFSTLGASEKNEPMSNLPETLACPQKDLFSQDISVKMASELLFKLSEKVSKANNHKDSNMVGINSSSSFLDECFRQSPFNSRSKSSSPAETVRHGGVSPPYSEKDDGEPGNGLAQWKLHEQLFPCPVCGKVFGRQQTLSRHLSLHTGLNKICKMCPYAAKCRANLNQHLTIHSVKLVQTDAEQIVSAVTADSSERKNCPYYYSCHVCGFQTELNAQFVSHMSLHVDKEQWMFSLCCSVCDYVCMEESDMKSHISTGHAGLNSRSPLSETKSTSSSLSALSDSLNSLEGGDVAHGNEELKNLLAPPSSAGSQASCGSHSGSGTEDKSDKGFECVFCNFVCKTRSMYERHLQIHLITRMFECDVCHKFLKTPEQLLEHKKCHTVPSGGLKATNGHW
					

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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	E	34.6	Very low	29.1	Very low	219 Å²	219	120.5 Å²	120.5	100%	1.023	64%	0.639	S	S	*	*				0	51	0	-54.6	-178.3	-160	0	0	108.8
2	E	30.1	Very low	29	Very low	157 Å²	157	120.3 Å²	120.3	73%	0.734	65%	0.646	S	S	*	*				81.9	112.5	64.3	-75	147.8	158.2	0	0	110.4
3	E	29.8	Very low	29.1	Very low	190 Å²	190	127.8 Å²	127.8	89%	0.888	66%	0.659	S	S	*	*				78.8	150.1	79.3	-75.2	-174.7	170.8	0	0	112.2
4	G	29.4	Very low	29	Very low	73 Å²	73	124.2 Å²	124.2	75%	0.753	65%	0.651	S	S	*	*			cis	-125.4	166.6	13.7	0	0	0	0	0	116.8
5	W	29.7	Very low	29.1	Very low	230 Å²	230	125.3 Å²	125.3	87%	0.871	66%	0.658	S	S	*	*			trans	-98.9	176.2	169.8	-121.8	20.4	0	0	0	109.7
6	F	28.8	Very low	29	Very low	140 Å²	140	124.6 Å²	124.6	61%	0.614	67%	0.667	S	S	*	*			trans	74.8	175.6	160.7	-77.1	-59.9	0	0	0	120.3	N8	F6-N8 VanDerWaalsContact CD1-ND2 3.29Å; F6-N8 WeakPolarHBondContact CD1-ND2 3.42Å; F6-N8 WeakPolarHBondContact CD1-OD1 3.37Å
7	G	27.6	Very low	29.1	Very low	36 Å²	36	124 Å²	124	37%	0.371	68%	0.675	S	S	.	*			trans	103.5	60.2	-163.8	0	0	0	0	0	112.2
8	N	25.8	Very low	29.1	Very low	91 Å²	91	123.4 Å²	123.4	49%	0.487	68%	0.681	S	S	.	*				49.9	133.9	58.7	-70.2	-11.4	0	0	0	113.4	F6 P495	F6-N8 VanDerWaalsContact CD1-ND2 3.29Å; F6-N8 WeakPolarHBondContact CD1-ND2 3.42Å; F6-N8 WeakPolarHBondContact CD1-OD1 3.37Å; N8-P495 VanDerWaalsContact O-CA 3.31Å; N8-P495 WeakPolarHBondContact O-CA 3.4Å; N8-P495 WeakPolarHBondContact O-CB 3.27Å
9	A	27.5	Very low	29.2	Very low	64 Å²	64	126.6 Å²	126.6	53%	0.529	69%	0.688	S	S	.	*			cis	-164.2	-160.3	-19.4	0	0	0	0	0	107.8	S494	A9-S494 WeakPolarHBondContact CB-OG 3.46Å; A9-S494 PolarHBondContact N-OG 2.93Å; A9-S494 VanDerWaalsContact N-OG 3.15Å
10	S	27.8	Very low	29.2	Very low	54 Å²	54	123.8 Å²	123.8	38%	0.378	69%	0.689	S	S	.	*			trans	72.6	148.5	147.5	-65.6	0	0	0	0	121.1
11	D	29.4	Very low	29.4	Very low	72 Å²	72	123.4 Å²	123.4	39%	0.385	69%	0.686	S	S	.	*			cis	-168.3	144.8	-25.4	-119.4	-59.6	0	0	0	111.7	R64	D11-R64 PolarHBondContact O-NH1 2.99Å
12	T	27.8	Very low	29.4	Very low	117 Å²	117	119 Å²	119	72%	0.718	67%	0.674	S	S	*	*			trans	56.8	174	162.9	74.2	0	0	0	0	117.5
13	R	29.7	Very low	29.3	Very low	218 Å²	218	118 Å²	118	82%	0.823	67%	0.67	S	S	*	*			cis	-150.5	166.2	-4.8	-147.3	-177.1	162.6	117.8	-4.1	111.1
14	S	27.5	Very low	29.3	Very low	78 Å²	78	114.1 Å²	114.1	55%	0.545	66%	0.655	S	S	.	*			trans	4.2	124.9	151.2	-72.7	0	0	0	0	120.3
15	D	30.9	Very low	29.3	Very low	140 Å²	140	118.6 Å²	118.6	75%	0.749	66%	0.656	S	S	*	*				83.4	96	79.7	-61.7	-58.7	0	0	0	114.4
16	S	28.3	Very low	29.2	Very low	115 Å²	115	112.9 Å²	112.9	80%	0.804	64%	0.642	S	S	*	*			trans	-168.5	130.8	134.2	27.1	0	0	0	0	107.6
17	S	29.9	Very low	29.4	Very low	114 Å²	114	113.2 Å²	113.2	80%	0.797	65%	0.65	S	S	*	*			cis	79.4	66.2	17	96.6	0	0	0	0	116.9
18	S	29.6	Very low	29.3	Very low	113 Å²	113	119.7 Å²	119.7	79%	0.79	68%	0.675	S	S	*	*			trans	-161.9	127.2	133.2	-151.6	0	0	0	0	107.5
19	F	30.3	Very low	29.4	Very low	185 Å²	185	124.4 Å²	124.4	81%	0.811	69%	0.693	S	S	*	*				72.5	151	64.6	-109.2	-93.7	0	0	0	114.6	D21	F19-D21 HydrophobicContact CD1-CB 3.88Å; F19-D21 HydrophobicContact CE1-CB 4.25Å; F19-D21 WeakPolarHBondContact CE1-OD2 3.45Å
20	G	30.1	Very low	29.3	Very low	69 Å²	69	132.9 Å²	132.9	71%	0.711	71%	0.712	S	S	*	*			trans	112.4	84.2	-159.1	0	0	0	0	0	109.9
21	D	33.9	Very low	29.2	Very low	116 Å²	116	134.3 Å²	134.3	62%	0.62	73%	0.726	S	S	*	*			cis	65.8	106.9	21.1	-153.4	-12.2	0	0	0	113.4	F19	F19-D21 HydrophobicContact CD1-CB 3.88Å; F19-D21 HydrophobicContact CE1-CB 4.25Å; F19-D21 WeakPolarHBondContact CE1-OD2 3.45Å
22	T	32.6	Very low	29	Very low	127 Å²	127	136.6 Å²	136.6	78%	0.779	75%	0.748	S	S	*	*			trans	-153.2	132	167.9	50.6	0	0	0	0	111.4
23	Q	29.7	Very low	29.1	Very low	137 Å²	137	136.5 Å²	136.5	64%	0.64	75%	0.752	S	S	*	*			cis	-160.9	173	-27.1	-132.2	-172.4	-57.4	0	0	110.8
24	D	29.4	Very low	29.7	Very low	107 Å²	107	130.6 Å²	130.6	57%	0.572	74%	0.742	S	S	*	*			trans	2.6	154	137.1	-71.9	-57.7	0	0	0	119.3	L26	D24-L26 HydrophobicContact CB-CD1 4.2Å
25	E	28.6	Very low	29.7	Very low	168 Å²	168	135.1 Å²	135.1	79%	0.785	76%	0.755	S	S	*	*				-159.4	156.1	71.4	-77.3	-101	144.6	0	0	112.2
26	L	28.8	Very low	29.6	Very low	109 Å²	109	134.8 Å²	134.8	57%	0.571	75%	0.753	S	S	*	*			cis	-160.3	-178.1	-28.3	-159.9	109.6	0	0	0	108.3	D24	D24-L26 HydrophobicContact CB-CD1 4.2Å
27	L	31.1	Very low	29.6	Very low	148 Å²	148	136.4 Å²	136.4	78%	0.775	75%	0.748	S	S	*	*			trans	-71.4	149.3	175.5	-61.3	162.6	0	0	0	112.4
28	L	26.6	Very low	29.6	Very low	172 Å²	172	136.8 Å²	136.8	90%	0.901	75%	0.751	S	S	*	*				-175.7	154.5	122.8	-102.6	166.9	0	0	0	112.1
29	H	27.3	Very low	29.6	Very low	189 Å²	189	134.6 Å²	134.6	88%	0.875	75%	0.745	S	S	*	*			trans	-153	91.8	178.1	-145.1	-2.4	0	0	0	111.3
30	R	26.6	Very low	29.6	Very low	243 Å²	243	133.3 Å²	133.3	92%	0.917	75%	0.745	S	S	*	*			trans	-159.2	122.5	156.3	-154.6	145.9	-166.1	169.7	4.9	115.7
31	A	24.6	Very low	29.6	Very low	83 Å²	83	136.1 Å²	136.1	69%	0.686	75%	0.753	S	S	*	*			trans	66.6	135.8	145	0	0	0	0	0	122.8
32	S	26.4	Very low	29.3	Very low	120 Å²	120	134.4 Å²	134.4	84%	0.839	76%	0.762	S	S	*	*			trans	82.8	120	143.4	-59.4	0	0	0	0	121.8
33	S	28.8	Very low	29.1	Very low	116 Å²	116	132.3 Å²	132.3	81%	0.811	77%	0.766	S	S	*	*			trans	-53.7	174.5	150	-106.9	0	0	0	0	113.9
34	P	42	Very low	29.1	Very low	93 Å²	93	130.9 Å²	130.9	60%	0.604	77%	0.771	S	S	*	*			cis	-136.5	-171.3	11.4	37.6	-16.7	0	0	0	116.5
35	E	28.6	Very low	29.2	Very low	174 Å²	174	131.3 Å²	131.3	81%	0.813	78%	0.777	S	S	*	*			trans	72.7	107.2	139.8	-83	148.4	-153.9	0	0	122.9
36	D	28.2	Very low	29.3	Very low	133 Å²	133	129.9 Å²	129.9	71%	0.711	78%	0.775	S	S	*	*				93.6	144.5	116	-131.7	-5.8	0	0	0	123.7
37	Q	29.1	Very low	29.5	Very low	149 Å²	149	131.8 Å²	131.8	70%	0.696	78%	0.781	S	S	*	*			trans	20.4	121.4	161.1	-82.9	160.6	85.1	0	0	124.2
38	S	29.3	Very low	29.4	Very low	122 Å²	122	130.7 Å²	130.7	85%	0.853	78%	0.776	S	S	*	*				82	155	126.7	81.7	0	0	0	0	121.6
39	G	29.4	Very low	29.7	Very low	66 Å²	66	129.1 Å²	129.1	68%	0.68	77%	0.774	S	S	*	*			trans	117	81.5	142.4	0	0	0	0	0	120.7
40	I	31.2	Very low	29.9	Very low	158 Å²	158	126.3 Å²	126.3	81%	0.81	77%	0.773	S	S	*	*				49.5	114	125.5	-64.1	174.9	0	0	0	120.4
41	C	28.4	Very low	30	Very low	129 Å²	129	118.6 Å²	118.6	87%	0.872	77%	0.77	S	S	*	*			trans	53.5	131.8	141.4	-60.6	0	0	0	0	124.1
42	G	27.8	Very low	30.2	Very low	79 Å²	79	118.5 Å²	118.5	81%	0.814	78%	0.777	S	S	*	*				131.1	115.4	111.7	0	0	0	0	0	120.1
43	G	28.3	Very low	30.4	Very low	83 Å²	83	122.1 Å²	122.1	86%	0.856	78%	0.781	S	S	*	*			trans	75.8	180	159	0	0	0	0	0	117.3
44	S	29.6	Very low	30.5	Very low	108 Å²	108	121.8 Å²	121.8	76%	0.755	78%	0.778	S	S	*	*			cis	-169	118.4	-19.8	-165.9	0	0	0	0	112.6
45	V	31.7	Very low	29.9	Very low	115 Å²	115	122.2 Å²	122.2	70%	0.697	78%	0.783	S	S	*	*			trans	71	131.5	130.8	174.1	0	0	0	0	121.9
46	D	31.4	Very low	30	Very low	139 Å²	139	122.3 Å²	122.3	74%	0.743	79%	0.788	S	S	*	*			trans	67.3	159.3	148.5	-70.7	6.8	0	0	0	123.2
47	H	32.1	Very low	29.9	Very low	148 Å²	148	119.7 Å²	119.7	69%	0.685	79%	0.793	S	S	*	*			cis	-162.2	172.5	-28.5	-139	-99.2	0	0	0	110.1
48	D	30.8	Very low	30.2	Very low	126 Å²	126	118.8 Å²	118.8	67%	0.674	80%	0.801	S	S	*	*			trans	8.2	151.9	160.9	-71.6	-30.2	0	0	0	123.2
49	T	31.7	Very low	30.8	Very low	139 Å²	139	118.6 Å²	118.6	85%	0.853	80%	0.797	S	S	*	*				-173.9	165.1	82.2	-61.7	0	0	0	0	113.9
50	C	32.2	Very low	31	Very low	129 Å²	129	122 Å²	122	87%	0.872	81%	0.805	S	S	*	*			trans	-88.5	167.4	-169.8	-53.1	0	0	0	0	118.4
51	G	27.5	Very low	31.1	Very low	82 Å²	82	120.3 Å²	120.3	85%	0.845	81%	0.805	S	S	*	*			trans	126.8	141.2	149	0	0	0	0	0	115.8
52	G	30.7	Very low	31.4	Very low	80 Å²	80	120.6 Å²	120.6	83%	0.825	80%	0.802	S	S	*	*			cis	145.3	100.9	-17.2	0	0	0	0	0	115.2
53	E	29.8	Very low	31.6	Very low	197 Å²	197	125.8 Å²	125.8	92%	0.921	80%	0.804	S	S	*	*			trans	-152.2	-168	170.6	61.7	-174.8	104.7	0	0	114.3
54	S	31.6	Very low	31.6	Very low	109 Å²	109	129.9 Å²	129.9	76%	0.762	79%	0.794	S	S	*	*			trans	-126	166.6	-138	-58.4	0	0	0	0	118.4
55	S	28.3	Very low	31.7	Very low	101 Å²	101	128.9 Å²	128.9	71%	0.706	79%	0.792	S	S	*	*			trans	93.2	111.4	146.4	-66.5	0	0	0	0	122.2
56	L	31	Very low	31.8	Very low	177 Å²	177	128.2 Å²	128.2	93%	0.927	79%	0.793	S	S	*	*				58.4	132.1	123.6	-56.9	173	0	0	0	121.7
57	G	27.1	Very low	31.8	Very low	78 Å²	78	129 Å²	129	80%	0.804	80%	0.796	S	S	*	*			trans	122.6	86.6	135.3	0	0	0	0	0	118.8
58	C	34.3	Very low	31.7	Very low	129 Å²	129	129.8 Å²	129.8	87%	0.872	80%	0.8	S	S	*	*			trans	-86.9	165.6	148.9	-60.6	0	0	0	0	108.9
59	P	42.4	Very low	31.6	Very low	119 Å²	119	130.6 Å²	130.6	77%	0.773	80%	0.804	S	S	*	*			cis	-138.3	-175.2	16	43.3	-25.5	0	0	0	115.9
60	T	32.3	Very low	31.5	Very low	136 Å²	136	131.9 Å²	131.9	83%	0.834	80%	0.804	S	S	*	*			trans	-103.9	140.9	167.3	41.5	0	0	0	0	112.5
61	P	34.2	Very low	31.3	Very low	124 Å²	124	129 Å²	129	81%	0.805	80%	0.796	S	S	*	*			trans	-100.8	171.1	165.3	37.6	-31.7	0	0	0	112.7
62	V	35.5	Very low	31.5	Very low	134 Å²	134	132.4 Å²	132.4	81%	0.812	79%	0.794	S	S	*	*			trans	-110	151	173.6	171.8	0	0	0	0	108.7
63	H	30.3	Very low	31.4	Very low	188 Å²	188	135.6 Å²	135.6	87%	0.87	79%	0.793	S	S	*	*			trans	-177.6	165.8	135.1	-111.7	-101.7	0	0	0	113.3
64	R	29.5	Very low	31.5	Very low	169 Å²	169	129.3 Å²	129.3	64%	0.638	78%	0.781	S	S	*	*			trans	-108.5	158.1	174.2	-165.3	169.2	178.3	152.7	-4	109.4	D11	D11-R64 PolarHBondContact O-NH1 2.99Å
65	A	32.1	Very low	31.3	Very low	87 Å²	87	129.3 Å²	129.3	72%	0.719	78%	0.781	S	S	*	*			trans	-69.1	173.6	-170.5	0	0	0	0	0	114.3
66	S	33.4	Very low	31.3	Very low	101 Å²	101	130.2 Å²	130.2	71%	0.706	78%	0.782	S	S	*	*			cis	-157.5	165.1	27.1	-56.7	0	0	0	0	114.5
67	L	30.9	Very low	31	Very low	157 Å²	157	131.2 Å²	131.2	82%	0.822	78%	0.779	S	S	*	*			trans	43.9	137.2	139.5	-69.7	165.3	0	0	0	120.3
68	E	29.9	Very low	30.9	Very low	164 Å²	164	133.5 Å²	133.5	77%	0.766	78%	0.783	S	S	*	*			cis	-142.3	136	3.3	-95.4	178.9	175.3	0	0	108.2
69	L	29.4	Very low	30.4	Very low	143 Å²	143	131.4 Å²	131.4	75%	0.749	78%	0.775	S	S	*	*				96	124.3	78.7	-153.4	88	0	0	0	114.7
70	L	30	Very low	29.9	Very low	165 Å²	165	134.4 Å²	134.4	86%	0.864	78%	0.779	S	S	*	*			trans	78.7	144.4	170.5	-48.7	-176.1	0	0	0	120.1
71	G	27.4	Very low	29.4	Very low	68 Å²	68	135.4 Å²	135.4	70%	0.701	78%	0.779	S	S	*	*			trans	99.9	75.6	170.3	0	0	0	0	0	115.5
72	L	32.3	Very low	30.1	Very low	154 Å²	154	135.3 Å²	135.3	81%	0.806	78%	0.777	S	S	*	*				75.7	116.4	90.8	-70.8	175.5	0	0	0	116.6
73	D	28.5	Very low	29.5	Very low	147 Å²	147	137.6 Å²	137.6	79%	0.786	78%	0.783	S	S	*	*			trans	70.7	141.9	139.8	-50.2	-18.3	0	0	0	123.5
74	G	31.8	Very low	29.8	Very low	66 Å²	66	134.4 Å²	134.4	68%	0.68	78%	0.782	S	S	*	*			trans	76.9	112.8	160.3	0	0	0	0	0	116.1
75	S	26.8	Very low	29.7	Very low	109 Å²	109	131.8 Å²	131.8	76%	0.762	79%	0.79	S	S	*	*				44.8	113.4	59.5	95	0	0	0	0	111.6
76	T	28.9	Very low	30	Very low	119 Å²	119	133.6 Å²	133.6	73%	0.73	79%	0.792	S	S	*	*				-168.2	178.8	54.3	28.7	0	0	0	0	112.6
77	F	25.2	Very low	29.8	Very low	198 Å²	198	135 Å²	135	87%	0.868	80%	0.796	S	S	*	*			trans	-1.1	134.9	159.7	-58.1	-77.8	0	0	0	119.5
78	S	24.5	Very low	29.8	Very low	126 Å²	126	132.7 Å²	132.7	88%	0.881	79%	0.792	S	S	*	*				177.2	176.9	97.8	-160.4	0	0	0	0	112.3
79	A	24.3	Very low	29.9	Very low	86 Å²	86	129.8 Å²	129.8	71%	0.711	79%	0.79	S	S	*	*			trans	-72.2	135.9	-171	0	0	0	0	0	115.1
80	Q	31.7	Very low	30	Very low	182 Å²	182	129.7 Å²	129.7	85%	0.85	79%	0.79	S	S	*	*				-3.6	118.8	126.4	177	-177.2	4	0	0	116.2
81	D	21.9	Very low	30	Very low	156 Å²	156	132.7 Å²	132.7	83%	0.834	79%	0.791	S	S	*	*			trans	-152.2	157.9	146.2	-129.2	-30.4	0	0	0	110.7
82	T	48.9	Very low	30.2	Very low	123 Å²	123	132.8 Å²	132.8	76%	0.755	79%	0.793	S	S	*	*			trans	-133.8	135.9	-174.1	54.3	0	0	0	0	113.3
83	L	23	Very low	30	Very low	182 Å²	182	134.7 Å²	134.7	95%	0.953	80%	0.797	S	S	*	*			trans	-122.9	141.9	172.8	-70.2	178.4	0	0	0	111.8
84	S	35.1	Very low	30.1	Very low	121 Å²	121	132 Å²	132	85%	0.846	80%	0.796	S	S	*	*			trans	-115.6	129.3	160.5	174.5	0	0	0	0	107.7
85	S	27	Very low	30	Very low	113 Å²	113	133.3 Å²	133.3	79%	0.79	80%	0.8	S	S	*	*			trans	-160.8	144.8	159.5	-144.9	0	0	0	0	112.7
86	V	39.5	Very low	30.3	Very low	126 Å²	126	133.3 Å²	133.3	76%	0.764	80%	0.8	S	S	*	*	S	Bend	trans	-80.5	157.7	157	172.4	0	0	0	0	107.8	S88	V86-S88 PolarHBondContact O-N 3.4Å
87	V	28.4	Very low	30.2	Very low	130 Å²	130	139.2 Å²	139.2	79%	0.788	81%	0.809	S	S	*	*	S	Bend	trans	-8.2	103.8	170.3	-173.7	0	0	0	0	116.4
88	S	32	Very low	30.4	Very low	108 Å²	108	134.2 Å²	134.2	76%	0.755	80%	0.804	S	S	*	*			trans	50.5	108.7	146.8	-51.6	0	0	0	0	120.7	V86	V86-S88 PolarHBondContact O-N 3.4Å
89	S	30.4	Very low	30.8	Very low	103 Å²	103	137 Å²	137	72%	0.72	81%	0.808	S	S	*	*				145.9	128.2	108.1	-156.4	0	0	0	0	116.5
90	L	31.7	Very low	31	Very low	142 Å²	142	136.7 Å²	136.7	74%	0.743	81%	0.813	S	S	*	*			trans	73.1	121.5	155.2	-65	159.1	0	0	0	123.3
91	Y	30.9	Very low	31.3	Very low	227 Å²	227	137.7 Å²	137.7	89%	0.89	82%	0.815	S	S	*	*			trans	61.1	125.2	149.3	-80.9	-101	0	0	0	124.2
92	G	30.5	Very low	32.2	Very low	71 Å²	71	136.1 Å²	136.1	73%	0.732	81%	0.813	S	S	*	*				120.8	64.7	124.4	0	0	0	0	0	125.3
93	E	29.5	Very low	31.4	Very low	194 Å²	194	138.8 Å²	138.8	91%	0.907	82%	0.822	S	S	*	*				60.8	124.2	128.7	-161.5	157.7	-165.6	0	0	126.6
94	A	30.5	Very low	32.1	Very low	91 Å²	91	134.7 Å²	134.7	75%	0.752	81%	0.808	S	S	*	*			trans	87.2	129.4	140.3	0	0	0	0	0	128.4
95	A	30.1	Very low	32.5	Very low	92 Å²	92	133.3 Å²	133.3	76%	0.76	80%	0.799	S	S	*	*			trans	102.4	107.5	130.7	0	0	0	0	0	126.7
96	S	31.3	Very low	33	Very low	109 Å²	109	133.9 Å²	133.9	76%	0.762	79%	0.793	S	S	*	*				85.4	106.8	123.7	-65.1	0	0	0	0	127.4
97	R	28.3	Very low	33.2	Very low	243 Å²	243	134.7 Å²	134.7	92%	0.917	79%	0.792	S	S	*	*			trans	38.8	131.3	131.6	-65.8	179.1	170.3	134.6	-2.3	123.9
98	A	29.3	Very low	33.9	Very low	93 Å²	93	138.3 Å²	138.3	77%	0.769	79%	0.792	S	S	*	*				167	150.3	108.2	0	0	0	0	0	117.2
99	L	31.7	Very low	34.7	Very low	184 Å²	184	142.5 Å²	142.5	96%	0.963	79%	0.791	S	S	*	*			trans	40.7	136.5	155.9	-92	71.1	0	0	0	123.7
100	G	30	Very low	35.4	Very low	80 Å²	80	144.3 Å²	144.3	83%	0.825	79%	0.792	S	S	*	*			trans	152.7	130.3	152.5	0	0	0	0	0	116.5
101	K	38.2	Very low	36	Very low	203 Å²	203	144.8 Å²	144.8	88%	0.883	80%	0.795	S	S	*	*			trans	-104.6	152.7	169.4	-80.7	-178.8	179.1	176.2	0	110.7
102	P	39.2	Very low	36.5	Very low	124 Å²	124	142 Å²	142	81%	0.805	79%	0.79	S	S	*	*			trans	-80.4	154.7	-165	31.8	-37	0	0	0	114.9
103	L	32	Very low	36.9	Very low	178 Å²	178	143.4 Å²	143.4	93%	0.932	79%	0.794	S	S	*	*			trans	-116.5	173.5	170.9	-72.8	175.2	0	0	0	112.1
104	S	37.6	Very low	36.8	Very low	96 Å²	96	137.7 Å²	137.7	67%	0.671	79%	0.787	S	S	*	*			trans	-90.5	162.7	-145.2	63.5	0	0	0	0	117.2	N106	S104-N106 VanDerWaalsContact C-N 3.25Å; S104-N106 PolarHBondContact O-N 2.73Å
105	S	44.3	Very low	36.9	Very low	93 Å²	93	138.8 Å²	138.8	65%	0.65	79%	0.789	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	7.4	-161.7	53.2	0	0	0	0	117.5
106	N	38.3	Very low	36.9	Very low	125 Å²	125	142.3 Å²	142.3	67%	0.668	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.2	-25.4	178.5	-79.9	-27.1	0	0	0	113.4	S104	S104-N106 VanDerWaalsContact C-N 3.25Å; S104-N106 PolarHBondContact O-N 2.73Å
107	L	42.6	Very low	36.7	Very low	142 Å²	142	145.9 Å²	145.9	74%	0.743	80%	0.796	S	S	*	*	S	Bend	trans	-76.9	-29.3	-178.2	-149.2	75.3	0	0	0	113.3	R109	L107-R109 VanDerWaalsContact C-N 3.31Å; L107-R109 PolarHBondContact O-N 3.5Å
108	R	44.5	Very low	36.8	Very low	206 Å²	206	142.3 Å²	142.3	78%	0.777	79%	0.794	S	S	*	*	G	3₁₀ helix	trans	-68.9	-24.1	-178.3	180	164.3	-81.5	-162.4	-5.6	113.5	L110	R108-L110 VanDerWaalsContact C-N 3.34Å; R108-L110 PolarHBondContact O-N 3.35Å
109	R	48.7	Very low	36.9	Very low	196 Å²	196	144.9 Å²	144.9	74%	0.74	80%	0.796	S	S	*	*	G	3₁₀ helix	trans	-90.6	10.7	-177	-147.3	-178.6	-63.2	142	8.8	114.7	L107	L107-R109 VanDerWaalsContact C-N 3.31Å; L107-R109 PolarHBondContact O-N 3.5Å
110	L	44.7	Very low	36.9	Very low	141 Å²	141	139.5 Å²	139.5	74%	0.738	79%	0.785	S	S	*	*	G	3₁₀ helix	trans	-103.8	6.6	174.3	-85.8	164.3	0	0	0	113.4	R108	R108-L110 VanDerWaalsContact C-N 3.34Å; R108-L110 PolarHBondContact O-N 3.35Å
111	L	44.7	Very low	36.9	Very low	153 Å²	153	139.6 Å²	139.6	80%	0.801	79%	0.786	S	S	*	*	S	Bend	trans	-122	1.5	-175.5	-71.3	170.5	0	0	0	114.9
112	E	41.8	Very low	36.6	Very low	169 Å²	169	139 Å²	139	79%	0.79	79%	0.786	S	S	*	*	S	Bend	trans	-124.8	50.4	-177.6	-66.3	-179.4	114.4	0	0	111.5
113	A	37	Very low	36.1	Very low	100 Å²	100	138.7 Å²	138.7	83%	0.826	78%	0.781	S	S	*	*			trans	-143.7	52.6	-177.1	0	0	0	0	0	113.4
114	G	29	Very low	36.1	Very low	74 Å²	74	138.4 Å²	138.4	76%	0.763	78%	0.78	S	S	*	*			trans	162.3	142.1	169.7	0	0	0	0	0	112.6
115	S	32.2	Very low	35.7	Very low	113 Å²	113	137.5 Å²	137.5	79%	0.79	79%	0.786	S	S	*	*			cis	-156.1	173	-16.4	-155.9	0	0	0	0	111.2
116	L	29.6	Very low	35	Very low	166 Å²	166	144.5 Å²	144.5	87%	0.869	80%	0.798	S	S	*	*			trans	-21.1	141.4	173	-58.8	166.1	0	0	0	117.7
117	K	27.1	Very low	34.6	Very low	184 Å²	184	143.8 Å²	143.8	80%	0.8	80%	0.803	S	S	*	*			trans	-109.9	133.1	159.6	-174.6	-179.2	178.7	-171.1	0	110
118	L	31.3	Very low	34	Very low	168 Å²	168	142.2 Å²	142.2	88%	0.88	80%	0.803	S	S	*	*			trans	-128	177.4	159.7	-84.9	173.2	0	0	0	108.7
119	D	30.9	Very low	33.4	Very low	148 Å²	148	144.5 Å²	144.5	79%	0.791	81%	0.812	S	S	*	*			trans	-111.4	166.2	-150	-149.2	-90.6	0	0	0	116
120	G	32.2	Very low	32.5	Very low	71 Å²	71	139 Å²	139	73%	0.732	82%	0.817	S	S	*	*			trans	90.5	124.7	160.8	0	0	0	0	0	118.8
121	G	29.4	Very low	31.8	Very low	82 Å²	82	140.2 Å²	140.2	85%	0.845	82%	0.824	S	S	*	*			trans	142.1	130.3	162.8	0	0	0	0	0	115.4
122	E	31	Very low	31.2	Very low	190 Å²	190	137.3 Å²	137.3	89%	0.888	82%	0.822	S	S	*	*			trans	-105.1	177.7	-174.9	-74.4	-166.2	95.4	0	0	115.2
123	V	30	Very low	30.6	Very low	117 Å²	117	133.3 Å²	133.3	71%	0.709	83%	0.827	S	S	*	*			trans	103.4	100	150.5	-169	0	0	0	0	118.5
124	L	31.8	Very low	30.4	Very low	173 Å²	173	131.9 Å²	131.9	91%	0.906	82%	0.822	S	S	*	*			trans	53.5	133.4	144.9	-60.2	170.6	0	0	0	122.3
125	G	29.2	Very low	30.5	Very low	77 Å²	77	138 Å²	138	79%	0.794	83%	0.83	S	S	*	*			trans	142.7	89.8	135.4	0	0	0	0	0	120.7
126	R	29.8	Very low	30.5	Very low	239 Å²	239	138.1 Å²	138.1	90%	0.902	83%	0.831	S	S	*	*			trans	29.7	111.4	147.4	-75.2	-178	166	-167.7	-3.9	122
127	S	28.4	Very low	31.3	Very low	110 Å²	110	135.9 Å²	135.9	77%	0.769	83%	0.826	S	S	*	*				59.5	133.3	111.8	-50.7	0	0	0	0	124.2
128	S	30.5	Very low	32.2	Very low	109 Å²	109	132 Å²	132	76%	0.762	82%	0.82	S	S	*	*			trans	94.8	117.9	138.4	-71.6	0	0	0	0	122.8
129	R	32.5	Very low	32.2	Very low	254 Å²	254	131.7 Å²	131.7	96%	0.958	82%	0.818	S	S	*	*				36.6	127.4	129.4	-70.8	178.1	162.9	-176.4	-5.2	120.5
130	G	29.5	Very low	32.2	Very low	82 Å²	82	128.8 Å²	128.8	85%	0.845	81%	0.814	S	S	*	*			trans	-168	147.8	154.4	0	0	0	0	0	111.2
131	N	30.1	Very low	32.1	Very low	165 Å²	165	133.7 Å²	133.7	88%	0.882	82%	0.823	S	S	*	*			trans	-147.1	164.8	-179.2	-174.4	38.6	0	0	0	111.5
132	A	32.3	Very low	32	Very low	93 Å²	93	134.6 Å²	134.6	77%	0.769	82%	0.822	S	S	*	*			trans	70.3	148.2	175.5	0	0	0	0	0	116.1
133	G	29.6	Very low	32.8	Very low	85 Å²	85	131.4 Å²	131.4	88%	0.876	82%	0.818	S	S	*	*			trans	-131.3	-172.7	-177.8	0	0	0	0	0	112.6
134	G	31.4	Very low	33.4	Very low	70 Å²	70	131.4 Å²	131.4	72%	0.722	82%	0.82	S	S	*	*			trans	169.3	107.2	177.9	0	0	0	0	0	112.9
135	E	32	Very low	33.2	Very low	203 Å²	203	130.4 Å²	130.4	95%	0.949	82%	0.815	S	S	*	*			trans	56.9	154.2	148.5	-51.8	-169.2	111.5	0	0	121.4
136	S	32.8	Very low	33.2	Very low	114 Å²	114	133.4 Å²	133.4	80%	0.797	82%	0.818	S	S	*	*			trans	-99.2	-168.9	-158	-46	0	0	0	0	113.8
137	P	46.3	Very low	33.1	Very low	119 Å²	119	129.5 Å²	129.5	77%	0.773	81%	0.814	S	S	*	*				-117	-152.5	-58	35.9	-16.3	0	0	0	109.1
138	P	46.2	Very low	33.1	Very low	103 Å²	103	129.8 Å²	129.8	67%	0.669	82%	0.816	S	S	*	*			cis	-140.9	177.3	-2.3	45.6	-26.9	0	0	0	118.7
139	I	30.4	Very low	33.5	Very low	162 Å²	162	131 Å²	131	83%	0.831	82%	0.821	S	S	*	*			trans	66	108	155.9	-65.8	153.5	0	0	0	119.5
140	A	29.8	Very low	33.5	Very low	87 Å²	87	123.9 Å²	123.9	72%	0.719	81%	0.811	S	S	*	*				171.2	125.2	111	0	0	0	0	0	115.6
141	L	30.6	Very low	33.7	Very low	174 Å²	174	125.8 Å²	125.8	91%	0.911	81%	0.811	S	S	*	*			trans	50.5	98.2	147	-61.9	170.9	0	0	0	122.7
142	A	27.6	Very low	34	Very low	101 Å²	101	126.6 Å²	126.6	84%	0.835	81%	0.809	S	S	*	*			trans	-173	141.3	136.4	0	0	0	0	0	112.8
143	P	47.8	Very low	34	Very low	122 Å²	122	130 Å²	130	79%	0.792	81%	0.809	S	S	*	*			trans	-111.7	149.6	165.6	38.1	-29.4	0	0	0	112.3
144	P	43.6	Very low	33.7	Very low	117 Å²	117	129.6 Å²	129.6	76%	0.76	80%	0.797	S	S	*	*				-152.1	152.7	86.2	37.9	-18.6	0	0	0	118.7
145	L	27.2	Very low	33.7	Very low	153 Å²	153	134.1 Å²	134.1	80%	0.801	80%	0.8	S	S	*	*			trans	49.9	110.3	143.7	-60	174.9	0	0	0	122.8
146	T	29	Very low	33.8	Very low	139 Å²	139	131.8 Å²	131.8	85%	0.853	79%	0.789	S	S	*	*				-176.2	112.7	125.6	21.1	0	0	0	0	107.4
147	L	28.3	Very low	33.6	Very low	157 Å²	157	133.2 Å²	133.2	82%	0.822	79%	0.787	S	S	*	*				73.2	81	69.2	-71.5	-177	0	0	0	116.5
148	S	27.6	Very low	33	Very low	117 Å²	117	132.7 Å²	132.7	82%	0.818	79%	0.786	S	S	*	*			trans	-154.4	146.7	140.8	-75.2	0	0	0	0	106.7
149	P	40.1	Very low	32.4	Very low	133 Å²	133	131.6 Å²	131.6	86%	0.864	79%	0.786	S	S	*	*				-152	-169	102.1	41.2	-23.6	0	0	0	113.9
150	S	31.3	Very low	32.3	Very low	106 Å²	106	131.9 Å²	131.9	74%	0.741	79%	0.788	S	S	*	*			trans	-119.9	178.2	172.5	66.9	0	0	0	0	112
151	S	32.9	Very low	32.3	Very low	122 Å²	122	131.9 Å²	131.9	85%	0.853	79%	0.788	S	S	*	*			trans	75.6	179.5	169.5	81.9	0	0	0	0	116.9
152	H	37.1	Very low	32.5	Very low	182 Å²	182	134.2 Å²	134.2	84%	0.843	79%	0.785	S	S	*	*			trans	-145.9	167.1	-137.3	-151.2	-101.8	0	0	0	112.4
153	H	31.8	Very low	32.6	Very low	163 Å²	163	138 Å²	138	76%	0.755	78%	0.782	S	S	*	*			trans	82.8	90.6	161.7	-161.2	-86.6	0	0	0	119.7
154	A	23.7	Very low	31.7	Very low	77 Å²	77	138.4 Å²	138.4	64%	0.636	78%	0.777	S	S	*	*			trans	50.9	114.9	136.4	0	0	0	0	0	122
155	Q	31.3	Very low	30.9	Very low	166 Å²	166	141.4 Å²	141.4	78%	0.776	78%	0.781	S	S	*	*				-161.5	129.5	121.4	-102.3	-178.7	-61.2	0	0	108.3
156	Q	34.4	Very low	30.8	Very low	153 Å²	153	141.9 Å²	141.9	72%	0.715	78%	0.779	S	S	*	*				59.6	135.9	93.7	-69.8	-173.5	-42.2	0	0	115.2
157	L	29.2	Very low	31.4	Very low	144 Å²	144	139.7 Å²	139.7	75%	0.754	77%	0.767	S	S	*	*			cis	-170.7	171	-18.6	-125.7	176.8	0	0	0	108.3
158	S	32.9	Very low	31.4	Very low	109 Å²	109	139.3 Å²	139.3	76%	0.762	77%	0.765	S	S	*	*			trans	71.4	150.3	158.5	-66.6	0	0	0	0	119.1
159	A	33.2	Very low	31.2	Very low	80 Å²	80	140.6 Å²	140.6	66%	0.661	76%	0.763	S	S	*	*			cis	-167.8	-179.9	-16.1	0	0	0	0	0	111.5
160	L	29.6	Very low	31.1	Very low	167 Å²	167	138.7 Å²	138.7	87%	0.874	75%	0.75	S	S	*	*			trans	77.2	104.5	166.7	-47.6	-178	0	0	0	115.2
161	A	30	Very low	30.8	Very low	87 Å²	87	141.9 Å²	141.9	72%	0.719	75%	0.751	S	S	*	*			cis	95.3	157.8	15.9	0	0	0	0	0	117.3
162	R	34.2	Very low	30.5	Very low	223 Å²	223	142.1 Å²	142.1	84%	0.842	74%	0.743	S	S	*	*			trans	75.9	147	-174.2	-43.3	-177.9	84.8	155.1	6	113.3
163	K	30.9	Very low	29.8	Very low	182 Å²	182	137.9 Å²	137.9	79%	0.791	73%	0.734	S	S	*	*			cis	-110.1	158.1	3.3	-85.9	-177	175.2	-172.6	0	111.1
164	L	28.4	Very low	29.7	Very low	130 Å²	130	136.6 Å²	136.6	68%	0.681	74%	0.738	S	S	*	*			cis	69.3	96.8	27.5	-81	172.5	0	0	0	117.3
165	Q	25.3	Very low	29.7	Very low	180 Å²	180	138.8 Å²	138.8	84%	0.841	74%	0.743	S	S	*	*			trans	-156	114.5	131.6	-155.7	134	-24.1	0	0	113.4
166	E	25.8	Very low	30.3	Very low	162 Å²	162	136 Å²	136	76%	0.757	74%	0.739	S	S	*	*			trans	-84	176.8	153.8	-98	-95	139.9	0	0	108.6
167	P	42.3	Very low	29.9	Very low	94 Å²	94	134.7 Å²	134.7	61%	0.61	74%	0.742	S	S	*	*			cis	-139.5	-157.9	8.8	31.6	-5.6	0	0	0	114.1
168	L	26.6	Very low	29.8	Very low	149 Å²	149	135.9 Å²	135.9	78%	0.78	75%	0.749	S	S	*	*			trans	82.2	97.9	149.9	-70.8	166.8	0	0	0	120.5
169	D	25.2	Very low	29.5	Very low	143 Å²	143	134.6 Å²	134.6	77%	0.765	75%	0.753	S	S	*	*				11.5	161	97.7	-93	-55.8	0	0	0	119.5
170	P	37.5	Very low	29.2	Very low	93 Å²	93	137 Å²	137	60%	0.604	77%	0.765	S	S	*	*			cis	-146.6	-178.6	23.3	30.1	-4.1	0	0	0	119.1
171	F	25.1	Very low	29.1	Very low	173 Å²	173	132.1 Å²	132.1	76%	0.759	76%	0.755	S	S	*	*			trans	88.2	130	139.7	-80.8	-47.4	0	0	0	124
172	N	25.7	Very low	28.8	Very low	127 Å²	127	137.8 Å²	137.8	68%	0.679	76%	0.764	S	S	*	*			trans	57.8	118.5	140.3	-68	-28.3	0	0	0	120
173	S	23.1	Very low	28.5	Very low	94 Å²	94	132.5 Å²	132.5	66%	0.657	76%	0.757	S	S	*	*			cis	83.6	171.3	47.9	86.5	0	0	0	0	114.1
174	V	28.6	Very low	28.4	Very low	136 Å²	136	135.7 Å²	135.7	82%	0.824	76%	0.764	S	S	*	*			trans	81.9	122.6	-175.5	-173.3	0	0	0	0	116
175	T	25.5	Very low	28.3	Very low	123 Å²	123	134.4 Å²	134.4	76%	0.755	77%	0.772	S	S	*	*			trans	-105.2	-172.4	168.4	54.4	0	0	0	0	108.6
176	P	44	Very low	28.4	Very low	107 Å²	107	129.2 Å²	129.2	70%	0.695	77%	0.767	S	S	*	*			cis	-122.7	-149.3	-44.8	30.7	-11.3	0	0	0	110.2
177	T	24.4	Very low	28.6	Very low	126 Å²	126	128 Å²	128	77%	0.773	77%	0.77	S	S	*	*			trans	108	136.9	154.4	70.7	0	0	0	0	120
178	N	26.8	Very low	28.1	Very low	168 Å²	168	127.7 Å²	127.7	90%	0.898	78%	0.776	S	S	*	*			trans	-12.8	132.9	167.5	-53.7	-12.9	0	0	0	119.3
179	G	26.5	Very low	28.2	Very low	82 Å²	82	126.4 Å²	126.4	85%	0.845	77%	0.77	S	S	*	*			trans	-158.1	128.3	166.2	0	0	0	0	0	113.1
180	S	27.7	Very low	28.4	Very low	130 Å²	130	127.4 Å²	127.4	91%	0.909	77%	0.767	S	S	*	*			trans	-86	153.1	-178	51.9	0	0	0	0	114.7
181	G	26.9	Very low	27.7	Very low	66 Å²	66	134.1 Å²	134.1	68%	0.68	78%	0.781	S	S	*	*			trans	141.4	137.8	168.6	0	0	0	0	0	111.2
182	F	25.3	Very low	29.5	Very low	206 Å²	206	130.9 Å²	130.9	90%	0.904	78%	0.777	S	S	*	*			cis	56.9	131.8	38	-74.8	-96.1	0	0	0	114.7
183	V	28	Very low	31	Very low	112 Å²	112	130 Å²	130	68%	0.679	78%	0.778	S	S	*	*			cis	-169.4	149.9	-24.6	112.2	0	0	0	0	109.5
184	W	27.4	Very low	31.4	Very low	248 Å²	248	130 Å²	130	94%	0.939	78%	0.784	S	S	*	*			trans	41.9	122.4	160.6	-80.2	47.2	0	0	0	123
185	A	26.9	Very low	31.5	Very low	103 Å²	103	128.3 Å²	128.3	85%	0.851	78%	0.778	S	S	*	*				-168.1	143.4	115.9	0	0	0	0	0	106.6
186	G	27	Very low	31.5	Very low	72 Å²	72	128.2 Å²	128.2	74%	0.742	78%	0.781	S	S	*	*			cis	122.2	157.5	46.2	0	0	0	0	0	107.3
187	V	30.8	Very low	30.7	Very low	137 Å²	137	128.5 Å²	128.5	83%	0.83	79%	0.785	S	S	*	*			cis	-164.9	150.7	-2.3	137.1	0	0	0	0	108.1
188	A	31.7	Very low	31.1	Very low	87 Å²	87	129 Å²	129	72%	0.719	79%	0.788	S	S	*	*			trans	65.6	163.8	167.1	0	0	0	0	0	117.1
189	D	29	Very low	32.1	Very low	122 Å²	122	126.4 Å²	126.4	65%	0.652	78%	0.781	S	S	*	*			cis	-162.3	170.9	1	-131.6	5.8	0	0	0	108.2
190	K	29.1	Very low	32.1	Very low	164 Å²	164	128.9 Å²	128.9	71%	0.713	78%	0.783	S	S	*	*			cis	-156.1	-168.5	-9.4	-147.6	170.2	-150.8	71.9	0	110.2
191	W	22.6	Very low	32.1	Very low	234 Å²	234	126 Å²	126	89%	0.886	77%	0.774	S	S	*	*			trans	-147.8	-173.8	-174.7	-99.1	40	0	0	0	108.6
192	P	63.3	Low	32.2	Very low	105 Å²	105	128.5 Å²	128.5	68%	0.682	78%	0.781	S	S	*	*			cis	-119.4	-110.3	-22.6	21.7	4.7	0	0	0	109.7
193	P	55.8	Low	32.4	Very low	109 Å²	109	123.7 Å²	123.7	71%	0.708	77%	0.774	S	S	*	*			cis	-133.9	-178.6	-43.2	39	-20.4	0	0	0	117.1
194	A	32.3	Very low	32.3	Very low	93 Å²	93	126 Å²	126	77%	0.769	78%	0.781	S	S	*	*			trans	74.5	143.7	144.5	0	0	0	0	0	122.1
195	S	30.2	Very low	32.4	Very low	100 Å²	100	119.6 Å²	119.6	70%	0.699	77%	0.774	S	S	*	*			cis	-171.5	141.7	-11.5	49.5	0	0	0	0	115.6
196	C	26.8	Very low	33.1	Very low	122 Å²	122	119.9 Å²	119.9	82%	0.824	77%	0.767	S	S	*	*			trans	63.3	160.7	147.2	-57.9	0	0	0	0	119.7
197	S	26.4	Very low	33.1	Very low	113 Å²	113	123.2 Å²	123.2	79%	0.79	77%	0.768	S	S	*	*			cis	-146.3	162.1	14.4	-46.6	0	0	0	0	114
198	T	31.7	Very low	33	Very low	135 Å²	135	121.2 Å²	121.2	83%	0.828	76%	0.76	S	S	*	*			trans	-134.5	173.1	160.3	54.2	0	0	0	0	109.6
199	P	49.4	Very low	32.8	Very low	114 Å²	114	121.5 Å²	121.5	74%	0.74	76%	0.762	S	S	*	*				-151.9	159.1	116.6	38.1	-21.5	0	0	0	117.5
200	C	26.4	Very low	32.7	Very low	134 Å²	134	122.2 Å²	122.2	91%	0.905	77%	0.765	S	S	*	*			trans	50	140.5	149.3	-63.3	0	0	0	0	122.9
201	G	27.6	Very low	32.8	Very low	70 Å²	70	121.9 Å²	121.9	72%	0.722	77%	0.766	S	S	*	*			cis	160.4	135.4	-11	0	0	0	0	0	116.6
202	S	28.1	Very low	33.4	Very low	118 Å²	118	119.6 Å²	119.6	83%	0.825	76%	0.762	S	S	*	*			trans	-174.2	106.4	156.6	-77.9	0	0	0	0	106.4
203	S	29.7	Very low	31.8	Very low	106 Å²	106	122 Å²	122	74%	0.741	77%	0.768	S	S	*	*				58.3	117.6	81.6	-156.5	0	0	0	0	111.6
204	L	26.8	Very low	30.5	Very low	160 Å²	160	126.1 Å²	126.1	84%	0.838	78%	0.775	S	S	*	*			cis	-140.6	160.6	43.9	-76	159.1	0	0	0	115.6
205	S	29.3	Very low	30.4	Very low	113 Å²	113	126.5 Å²	126.5	79%	0.79	78%	0.778	S	S	*	*			trans	-157.6	152.5	154.5	-68.4	0	0	0	0	106.7
206	P	41.9	Very low	30.2	Very low	109 Å²	109	126.4 Å²	126.4	71%	0.708	78%	0.783	S	S	*	*				-157.3	-176.3	100.2	41.8	-23	0	0	0	116
207	D	26	Very low	30.2	Very low	143 Å²	143	125 Å²	125	77%	0.765	78%	0.781	S	S	*	*			trans	68.5	146.7	148.8	-86.2	-58.6	0	0	0	121
208	S	29.7	Very low	30.3	Very low	95 Å²	95	127.2 Å²	127.2	66%	0.664	78%	0.784	S	S	*	*			cis	-148.4	157.7	-7.6	-150.7	0	0	0	0	112.1
209	A	26.2	Very low	30.2	Very low	92 Å²	92	125.1 Å²	125.1	76%	0.76	78%	0.78	S	S	*	*			trans	-130.6	120.5	172.1	0	0	0	0	0	110.2
210	I	27.6	Very low	29.3	Very low	138 Å²	138	125.5 Å²	125.5	71%	0.708	78%	0.78	S	S	*	*			trans	-152	116	170.6	-107.2	148.5	0	0	0	112.5
211	Q	32.1	Very low	29.5	Very low	157 Å²	157	125.3 Å²	125.3	73%	0.734	77%	0.77	S	S	*	*			trans	45.5	124.8	139.7	-48.2	170	12.8	0	0	121.2
212	K	35	Very low	29.6	Very low	185 Å²	185	129.6 Å²	129.6	80%	0.804	77%	0.771	S	S	*	*				-174.4	140.1	104.3	-96.6	155.4	-174.6	173.8	0	113.6
213	L	29.3	Very low	29.6	Very low	155 Å²	155	130.3 Å²	130.3	81%	0.812	77%	0.765	S	S	*	*			trans	37.8	128.7	143.9	-52.2	170.2	0	0	0	119.4
214	K	28.3	Very low	29.7	Very low	197 Å²	197	132.4 Å²	132.4	86%	0.857	77%	0.768	S	S	*	*			cis	79	117.6	26.9	-160.7	-179.7	-178.2	179.6	0	116
215	A	30.8	Very low	29.7	Very low	100 Å²	100	128.4 Å²	128.4	83%	0.826	77%	0.765	S	S	*	*			trans	66.9	152.6	177.5	0	0	0	0	0	115.1
216	A	26.3	Very low	29.9	Very low	98 Å²	98	126.8 Å²	126.8	81%	0.81	77%	0.766	S	S	*	*			cis	-124.6	-151.2	0.4	0	0	0	0	0	109.4
217	A	25.7	Very low	29.3	Very low	94 Å²	94	126.9 Å²	126.9	78%	0.777	77%	0.77	S	S	*	*			cis	-154.8	-158.6	4.7	0	0	0	0	0	111.1
218	N	28.7	Very low	29.7	Very low	159 Å²	159	131.5 Å²	131.5	85%	0.85	78%	0.777	S	S	*	*			trans	-153	169.8	170.5	-115.6	-34.9	0	0	0	108.3
219	A	29.9	Very low	29.8	Very low	91 Å²	91	130.3 Å²	130.3	75%	0.752	78%	0.779	S	S	*	*			trans	74.5	158.3	158.9	0	0	0	0	0	116.7
220	V	30.9	Very low	30.1	Very low	121 Å²	121	133 Å²	133	73%	0.733	78%	0.781	S	S	*	*			cis	-161.8	150.1	-8.5	106.8	0	0	0	0	112.5
221	L	29.2	Very low	30.2	Very low	131 Å²	131	133.6 Å²	133.6	69%	0.686	79%	0.785	S	S	*	*			trans	24.9	140.1	154.3	-59.3	164.2	0	0	0	124.5
222	Q	29.8	Very low	30.1	Very low	160 Å²	160	131.5 Å²	131.5	75%	0.748	78%	0.783	S	S	*	*			trans	74.5	157.4	140.4	-71.5	168.6	144.9	0	0	118.2
223	D	28.4	Very low	29.9	Very low	132 Å²	132	128.6 Å²	128.6	71%	0.706	78%	0.781	S	S	*	*			cis	-142.5	178.2	17.8	-151.3	-1.7	0	0	0	116
224	N	31	Very low	29.9	Very low	151 Å²	151	131.6 Å²	131.6	81%	0.807	78%	0.781	S	S	*	*			trans	-53.3	163.2	-176.2	-76.2	-82.7	0	0	0	119
225	G	28.6	Very low	29.9	Very low	75 Å²	75	131.3 Å²	131.3	77%	0.773	78%	0.78	S	S	*	*			trans	162.1	109	144	0	0	0	0	0	119.2
226	G	32	Very low	29.7	Very low	79 Å²	79	133.9 Å²	133.9	81%	0.814	78%	0.78	S	S	*	*			trans	72.6	135.8	160.6	0	0	0	0	0	117.2
227	S	29.1	Very low	29.9	Very low	112 Å²	112	133.6 Å²	133.6	78%	0.783	78%	0.778	S	S	*	*			cis	85.9	105.9	5.5	-151.3	0	0	0	0	119.3
228	R	35.3	Very low	29.9	Very low	240 Å²	240	138.1 Å²	138.1	91%	0.906	78%	0.78	S	S	*	*			trans	79.2	154.5	154.1	-70.1	176.2	153.7	-148.5	-9.7	121.5
229	G	32.6	Very low	29.8	Very low	70 Å²	70	137.5 Å²	137.5	72%	0.722	78%	0.777	S	S	*	*			trans	105.2	90.2	178.3	0	0	0	0	0	112.3
230	D	31	Very low	29.6	Very low	149 Å²	149	138.8 Å²	138.8	80%	0.797	78%	0.781	S	S	*	*			cis	79.7	97.4	40.3	-75.1	-57.1	0	0	0	116.8
231	D	30.4	Very low	30	Very low	149 Å²	149	138.1 Å²	138.1	80%	0.797	78%	0.779	S	S	*	*				98	151.2	124.9	-143	5.3	0	0	0	123.6
232	V	30.6	Very low	30	Very low	113 Å²	113	141.8 Å²	141.8	69%	0.685	79%	0.79	S	S	*	*			trans	74.7	86.2	161.6	-160.3	0	0	0	0	122.5
233	V	31	Very low	29.8	Very low	125 Å²	125	139.4 Å²	139.4	76%	0.758	79%	0.791	S	S	*	*				41.5	122.2	121.7	-176.4	0	0	0	0	121.7
234	R	28.3	Very low	30.9	Very low	218 Å²	218	137.8 Å²	137.8	82%	0.823	79%	0.787	S	S	*	*				-179.2	135.2	106	-169.1	165.7	-70.4	153.9	3.2	115
235	F	28.3	Very low	30.8	Very low	191 Å²	191	139.2 Å²	139.2	84%	0.838	79%	0.789	S	S	*	*			trans	25.5	132.5	163.7	-81.8	-81.7	0	0	0	121.8
236	D	27	Very low	30.7	Very low	154 Å²	154	140.8 Å²	140.8	82%	0.824	79%	0.788	S	S	*	*				-173	173.4	92.1	-133.7	-40.2	0	0	0	115
237	A	29.6	Very low	30.4	Very low	92 Å²	92	141.1 Å²	141.1	76%	0.76	78%	0.783	S	S	*	*			trans	71.8	169.6	157.8	0	0	0	0	0	121.9
238	F	26.5	Very low	30.3	Very low	189 Å²	189	140.6 Å²	140.6	83%	0.829	78%	0.78	S	S	*	*			trans	-118.5	157.2	-158.1	-106.6	-104.3	0	0	0	115.4
239	N	26.3	Very low	30.1	Very low	145 Å²	145	133.9 Å²	133.9	78%	0.775	77%	0.769	S	S	*	*			trans	59.5	103.5	155.7	-70.4	-16.8	0	0	0	121.2
240	S	25.8	Very low	30.1	Very low	119 Å²	119	137.2 Å²	137.2	83%	0.832	78%	0.776	S	S	*	*				-169.6	128.7	119.9	-165.6	0	0	0	0	113.4
241	P	40.1	Very low	30.1	Very low	106 Å²	106	137.6 Å²	137.6	69%	0.688	78%	0.777	S	S	*	*			trans	-104.1	162.9	173.1	38.5	-32.5	0	0	0	113
242	F	28.9	Very low	30.2	Very low	209 Å²	209	134.9 Å²	134.9	92%	0.917	78%	0.776	S	S	*	*			cis	-162.3	128.2	-13.4	-130.1	-64.8	0	0	0	108.8
243	S	25	Very low	30.3	Very low	110 Å²	110	133.5 Å²	133.5	77%	0.769	78%	0.776	S	S	*	*			trans	177.7	151.5	166.7	-171.3	0	0	0	0	110.5
244	P	52.7	Low	30.2	Very low	98 Å²	98	135 Å²	135	64%	0.636	78%	0.779	S	S	*	*			cis	-118.8	-148.5	-23.3	31.3	-10	0	0	0	110.2
245	Q	27.1	Very low	30.1	Very low	181 Å²	181	129.6 Å²	129.6	85%	0.846	77%	0.774	S	S	*	*			trans	69.2	156.9	166.1	-70.1	173.3	-57.4	0	0	116.5
246	S	27.3	Very low	30.4	Very low	108 Å²	108	130.2 Å²	130.2	76%	0.755	78%	0.777	S	S	*	*			cis	-162.4	-171.6	-19.8	53.2	0	0	0	0	110.8
247	A	25.8	Very low	30.6	Very low	85 Å²	85	132.4 Å²	132.4	70%	0.702	78%	0.779	S	S	*	*			trans	-60.9	176.3	169.8	0	0	0	0	0	113.1
248	S	26.6	Very low	30.5	Very low	102 Å²	102	133.8 Å²	133.8	71%	0.713	78%	0.777	S	S	*	*			cis	-168.1	169.3	17.7	-151.2	0	0	0	0	114.2
249	S	30.5	Very low	30.8	Very low	98 Å²	98	128.6 Å²	128.6	69%	0.685	77%	0.765	S	S	*	*			trans	55.5	102.8	140.7	-55.3	0	0	0	0	123.1
250	T	34.2	Very low	31	Very low	141 Å²	141	125.8 Å²	125.8	87%	0.865	75%	0.747	S	S	*	*				-149.3	112.5	127	0.6	0	0	0	0	106.6
251	L	31.1	Very low	31.5	Very low	156 Å²	156	127 Å²	127	82%	0.817	73%	0.733	S	S	*	*				66.2	120.7	51.5	-133.5	-172.7	0	0	0	112.5
252	A	31.9	Very low	31.1	Very low	93 Å²	93	125.7 Å²	125.7	77%	0.769	72%	0.723	S	S	*	*			trans	67.6	145.9	179.9	0	0	0	0	0	116.7
253	A	32.3	Very low	31.2	Very low	84 Å²	84	124.5 Å²	124.5	69%	0.694	72%	0.721	S	S	*	*			cis	-158.8	150.8	-20.6	0	0	0	0	0	112
254	L	29.9	Very low	31.6	Very low	156 Å²	156	122.3 Å²	122.3	82%	0.817	72%	0.716	S	S	*	*			trans	32.5	108.9	140.7	-57.4	175	0	0	0	120.2
255	S	26.2	Very low	30.7	Very low	104 Å²	104	123.2 Å²	123.2	73%	0.727	72%	0.724	S	S	*	*				51.6	106.6	113.3	-49.8	0	0	0	0	119.9
256	K	33.4	Very low	31.2	Very low	204 Å²	204	118.9 Å²	118.9	89%	0.887	71%	0.714	S	S	*	*				-176.7	128.1	119.9	-104.5	173	-179.1	-173.4	0	112.5
257	K	31.9	Very low	31.4	Very low	201 Å²	201	119.3 Å²	119.3	87%	0.874	71%	0.712	S	S	*	*				-151.5	138.4	115.2	-130.5	-172.8	178.4	-170.7	0	112.1
258	V	27.6	Very low	31.9	Very low	120 Å²	120	119.6 Å²	119.6	73%	0.727	71%	0.714	S	S	*	*			trans	-87.2	-179.2	160.9	170	0	0	0	0	107.3
259	S	32.7	Very low	32.3	Very low	80 Å²	80	119.8 Å²	119.8	56%	0.559	72%	0.716	S	S	*	*			trans	92.9	131.3	175.5	-54.4	0	0	0	0	114.5
260	E	30.4	Very low	32.4	Very low	87 Å²	87	121.2 Å²	121.2	41%	0.407	72%	0.721	S	S	.	*			cis	-166.9	-179.1	-4.6	-124.9	145.4	-135.8	0	0	114.9	E687 V688	E260-E687 WeakPolarHBondContact OE2-CA 3.35Å; E260-E687 PolarHBondContact OE2-N 2.82Å; E260-V688 PolarHBondContact OE1-N 3.14Å
261	R	35.4	Very low	32.2	Very low	145 Å²	145	120.7 Å²	120.7	55%	0.547	72%	0.717	S	S	.	*			trans	0.3	138.3	143.3	-121.1	159.4	-77.5	175.9	-1.9	115.4	M686 E687	R261-M686 WeakPolarHBondContact CD-O 3.49Å; R261-M686 PolarHBondContact NH1-O 3.41Å; R261-E687 PolarHBondContact NH1-O 2.73Å; R261-E687 PolarHBondContact NH2-O 3.07Å
262	T	31.7	Very low	32	Very low	78 Å²	78	117.8 Å²	117.8	48%	0.479	71%	0.71	S	S	.	*			cis	-161.5	147.1	48.6	-38.5	0	0	0	0	112.3	P685	T262-P685 VanDerWaalsContact OG1-CA 3.27Å; T262-P685 WeakPolarHBondContact OG1-CA 3.35Å
263	Q	31.6	Very low	31.8	Very low	184 Å²	184	120.5 Å²	120.5	86%	0.86	71%	0.711	S	S	*	*			trans	-76.5	172	163.3	-66.1	158.7	-13.3	0	0	109.6
264	G	33.1	Very low	31.7	Very low	64 Å²	64	124.4 Å²	124.4	66%	0.66	72%	0.715	S	S	*	*			cis	153.3	-177.7	1	0	0	0	0	0	109.7
265	S	34.3	Very low	31.7	Very low	117 Å²	117	125.4 Å²	125.4	82%	0.818	72%	0.715	S	S	*	*			trans	64.9	154.8	173.8	-84	0	0	0	0	117.4
266	S	37.9	Very low	31.7	Very low	89 Å²	89	126.7 Å²	126.7	62%	0.622	72%	0.719	S	S	*	*			cis	-163	175.7	-14.7	48.7	0	0	0	0	107.5
267	T	31	Very low	31.7	Very low	118 Å²	118	122.5 Å²	122.5	72%	0.724	72%	0.715	S	S	*	*			cis	-146.2	131	27	49.4	0	0	0	0	110.7
268	A	36.3	Very low	31.6	Very low	91 Å²	91	117.6 Å²	117.6	75%	0.752	71%	0.712	S	S	*	*				81.8	144.8	100.3	0	0	0	0	0	114.3
269	S	34.7	Very low	31.7	Very low	106 Å²	106	117 Å²	117	74%	0.741	71%	0.713	S	S	*	*			cis	-172.4	158	8.3	20.6	0	0	0	0	109
270	T	33.4	Very low	31.8	Very low	128 Å²	128	117.5 Å²	117.5	79%	0.785	72%	0.717	S	S	*	*			cis	-172.1	-176.1	-10.3	25.1	0	0	0	0	108.4
271	V	30.1	Very low	31.6	Very low	129 Å²	129	123.1 Å²	123.1	78%	0.782	74%	0.74	S	S	*	*			trans	103.5	138.4	155.8	-170.1	0	0	0	0	118
272	S	27.2	Very low	31.5	Very low	96 Å²	96	124 Å²	124	67%	0.671	76%	0.755	S	S	*	*			trans	73	109.9	162.9	45.8	0	0	0	0	122.1
273	D	27.6	Very low	31.4	Very low	150 Å²	150	125.5 Å²	125.5	80%	0.802	77%	0.769	S	S	*	*			trans	93.2	145.9	130	-76.5	-68.7	0	0	0	124.2
274	H	30.1	Very low	31.4	Very low	166 Å²	166	123.9 Å²	123.9	77%	0.769	77%	0.765	S	S	*	*			trans	-79.4	135.4	-171	-61.4	-89.9	0	0	0	111.3
275	Q	28.4	Very low	31.1	Very low	177 Å²	177	126.7 Å²	126.7	83%	0.827	77%	0.769	S	S	*	*				83	142.5	52.2	-162.7	169.1	21.2	0	0	114.2
276	T	26.6	Very low	30.8	Very low	130 Å²	130	126.4 Å²	126.4	80%	0.798	77%	0.767	S	S	*	*			trans	-129.3	172.5	-144.6	46.1	0	0	0	0	115.8
277	S	34	Very low	30.5	Very low	117 Å²	117	130.2 Å²	130.2	82%	0.818	78%	0.779	S	S	*	*			trans	-51.6	145.6	178.7	54.1	0	0	0	0	119
278	A	29.7	Very low	30.4	Very low	98 Å²	98	130.3 Å²	130.3	81%	0.81	78%	0.779	S	S	*	*			trans	-169.2	157.7	155.3	0	0	0	0	0	109.7
279	S	30.5	Very low	30	Very low	106 Å²	106	132.1 Å²	132.1	74%	0.741	78%	0.782	S	S	*	*			cis	-168.8	166.7	-20.6	53.8	0	0	0	0	110.9
280	S	34.6	Very low	29.6	Very low	92 Å²	92	132.9 Å²	132.9	64%	0.643	79%	0.787	S	S	*	*			trans	42.5	137.9	150.5	-60.8	0	0	0	0	123.7
281	F	25.9	Very low	29.4	Very low	204 Å²	204	132 Å²	132	90%	0.895	79%	0.786	S	S	*	*				-167.2	178.6	96.3	-96	-66.3	0	0	0	111.4
282	L	33.1	Very low	29.2	Very low	164 Å²	164	130.6 Å²	130.6	86%	0.859	79%	0.788	S	S	*	*			trans	-127.7	154.8	-153.9	-66.2	168.6	0	0	0	116.4
283	S	30.4	Very low	29.3	Very low	109 Å²	109	130.6 Å²	130.6	76%	0.762	79%	0.793	S	S	*	*				109.6	151.5	130	-138.8	0	0	0	0	122.1
284	L	29.8	Very low	29.5	Very low	150 Å²	150	130.7 Å²	130.7	79%	0.785	79%	0.793	S	S	*	*			trans	82	94	160	-57.9	-177.6	0	0	0	123.6
285	V	27.1	Very low	29.5	Very low	123 Å²	123	129.5 Å²	129.5	75%	0.745	79%	0.792	S	S	*	*				53.8	109.7	119.4	-176.2	0	0	0	0	122
286	S	29.3	Very low	29.5	Very low	112 Å²	112	129.7 Å²	129.7	78%	0.783	79%	0.79	S	S	*	*			trans	33.7	119.6	133.2	-47.9	0	0	0	0	123.4
287	I	31.6	Very low	29.8	Very low	168 Å²	168	131.6 Å²	131.6	86%	0.862	79%	0.79	S	S	*	*			trans	-134	158.9	151.2	-64.4	-174.6	0	0	0	110.5
288	T	28.5	Very low	29.6	Very low	120 Å²	120	132.1 Å²	132.1	74%	0.736	79%	0.788	S	S	*	*			trans	-76.4	151.6	-157.3	53.1	0	0	0	0	119.6
289	T	27.3	Very low	29.5	Very low	130 Å²	130	132.3 Å²	132.3	80%	0.798	79%	0.789	S	S	*	*			trans	9.5	138.3	143.6	62.8	0	0	0	0	121.3
290	S	26.5	Very low	29.4	Very low	122 Å²	122	131.7 Å²	131.7	85%	0.853	79%	0.791	S	S	*	*				169.3	-171.5	111.3	-161.9	0	0	0	0	111.5
291	S	28.3	Very low	29.3	Very low	109 Å²	109	139.1 Å²	139.1	76%	0.762	80%	0.804	S	S	*	*			trans	-119	152.7	-161.3	-57.3	0	0	0	0	116.4
292	A	26.3	Very low	29.3	Very low	99 Å²	99	134 Å²	134	82%	0.818	80%	0.8	S	S	*	*			trans	76.1	160.9	149.6	0	0	0	0	0	120.3
293	A	29.8	Very low	29.1	Very low	96 Å²	96	131 Å²	131	79%	0.793	80%	0.799	S	S	*	*			trans	65.4	162.6	178.7	0	0	0	0	0	117.1
294	L	32.5	Very low	28.9	Very low	153 Å²	153	129.7 Å²	129.7	80%	0.801	80%	0.803	S	S	*	*				-171	145.7	-58.9	-113.2	170	0	0	0	108.2
295	L	29.7	Very low	29.1	Very low	141 Å²	141	129.7 Å²	129.7	74%	0.738	80%	0.804	S	S	*	*			trans	71.2	125.5	161.7	-60	167.3	0	0	0	120.7
296	K	28.4	Very low	29.2	Very low	180 Å²	180	130 Å²	130	78%	0.783	80%	0.801	S	S	*	*			trans	59.7	120.9	143.5	-61.1	-179.7	177.4	-175.2	0	118.9
297	E	32.1	Very low	29.3	Very low	170 Å²	170	132.3 Å²	132.3	79%	0.794	80%	0.803	S	S	*	*			cis	83.5	137.4	43.1	-162	-166	177.4	0	0	114.1
298	V	30.3	Very low	29.3	Very low	129 Å²	129	128.1 Å²	128.1	78%	0.782	79%	0.793	S	S	*	*			trans	96.5	123	169.4	-172.5	0	0	0	0	118.1
299	A	26.8	Very low	29.4	Very low	102 Å²	102	130 Å²	130	84%	0.843	79%	0.794	S	S	*	*			trans	87	133.3	158.4	0	0	0	0	0	120.9
300	A	29.8	Very low	29.5	Very low	93 Å²	93	130.7 Å²	130.7	77%	0.769	79%	0.786	S	S	*	*			trans	-142.5	158.5	169.6	0	0	0	0	0	108.7
301	R	31.4	Very low	29.6	Very low	247 Å²	247	132.1 Å²	132.1	93%	0.932	78%	0.776	S	S	*	*			trans	-179.3	124.4	150.9	-108.7	163.8	-178.9	163.2	-0.1	115.1
302	A	27	Very low	29.5	Very low	98 Å²	98	133.1 Å²	133.1	81%	0.81	77%	0.773	S	S	*	*			trans	-170.4	116	139.2	0	0	0	0	0	105.4
303	A	28.1	Very low	29.6	Very low	100 Å²	100	132.3 Å²	132.3	83%	0.826	77%	0.774	S	S	*	*			cis	79.9	116.1	26.4	0	0	0	0	0	114.2
304	G	26.4	Very low	29.5	Very low	82 Å²	82	133.4 Å²	133.4	85%	0.845	78%	0.776	S	S	*	*			trans	139	124.2	-178	0	0	0	0	0	113.6
305	N	33.2	Very low	30.3	Very low	150 Å²	150	131.1 Å²	131.1	80%	0.802	77%	0.771	S	S	*	*			cis	-174.5	-179.8	-43.5	-176.3	19.9	0	0	0	106.9
306	L	30	Very low	30.1	Very low	130 Å²	130	131.8 Å²	131.8	68%	0.681	77%	0.774	S	S	*	*			trans	101	112.7	158.5	-51.5	179.9	0	0	0	120
307	L	31.5	Very low	30	Very low	160 Å²	160	127.7 Å²	127.7	84%	0.838	77%	0.768	S	S	*	*				53.3	152.9	122.4	-54.9	177.2	0	0	0	121.7
308	A	32	Very low	29.7	Very low	79 Å²	79	125.5 Å²	125.5	65%	0.653	77%	0.766	S	S	*	*			cis	-174.6	173.6	-20.9	0	0	0	0	0	110.9
309	E	29.7	Very low	29.7	Very low	159 Å²	159	126.6 Å²	126.6	74%	0.743	77%	0.773	S	S	*	*			trans	69.2	162	170.5	-62.2	-144.1	104	0	0	117.4
310	K	29.5	Very low	29.9	Very low	145 Å²	145	124.5 Å²	124.5	63%	0.63	76%	0.761	S	S	*	*			cis	-156	150.3	4.4	-141.1	178.4	-172.6	70.7	0	113.8
311	K	29.6	Very low	29.9	Very low	152 Å²	152	126.7 Å²	126.7	66%	0.661	77%	0.765	S	S	*	*			trans	51.7	144	141.9	-97.4	-178.5	149.3	-74.4	0	126.3
312	D	26.2	Very low	29.8	Very low	131 Å²	131	121.4 Å²	121.4	70%	0.701	76%	0.755	S	S	*	*			trans	69.5	138.8	142.8	-57.5	-24.7	0	0	0	123.6
313	G	28	Very low	30	Very low	81 Å²	81	123.5 Å²	123.5	84%	0.835	75%	0.748	S	S	*	*			trans	134.4	115.2	148	0	0	0	0	0	119.5
314	S	27.2	Very low	30.1	Very low	120 Å²	120	125.8 Å²	125.8	84%	0.839	74%	0.741	S	S	*	*			trans	-156.9	173.5	164	-136.2	0	0	0	0	107.7
315	P	49.9	Very low	30.4	Very low	105 Å²	105	128.5 Å²	128.5	68%	0.682	74%	0.736	S	S	*	*			cis	-146	-150.4	24.1	36	-8.8	0	0	0	115.6
316	L	25.2	Very low	30.3	Very low	155 Å²	155	127.7 Å²	127.7	81%	0.812	74%	0.737	S	S	*	*			trans	74.5	150.6	176.2	-84.4	69.8	0	0	0	116
317	S	26.1	Very low	30.2	Very low	93 Å²	93	130.6 Å²	130.6	65%	0.65	74%	0.744	S	S	*	*			cis	-178.6	160.3	-10.5	48.1	0	0	0	0	110.6
318	T	26.2	Very low	30.9	Very low	124 Å²	124	127.8 Å²	127.8	76%	0.761	74%	0.735	S	S	*	*			cis	-175.3	145.9	-27.1	38.5	0	0	0	0	109.2
319	V	30.4	Very low	30.6	Very low	152 Å²	152	131.2 Å²	131.2	92%	0.921	74%	0.742	S	S	*	*			trans	68.3	143	168.8	-179.4	0	0	0	0	115.9
320	G	29.5	Very low	30.7	Very low	58 Å²	58	130.9 Å²	130.9	60%	0.598	74%	0.744	S	S	*	*			cis	165	-176.4	-4.2	0	0	0	0	0	110.8
321	V	29.8	Very low	30.6	Very low	139 Å²	139	129 Å²	129	84%	0.842	74%	0.741	S	S	*	*			trans	73.1	136.4	171.2	171.1	0	0	0	0	115.5
322	L	30.9	Very low	30.8	Very low	137 Å²	137	129.3 Å²	129.3	72%	0.717	74%	0.742	S	S	*	*			cis	-156.8	-172.6	-12	-116.3	-177.6	0	0	0	113.1
323	Q	31.1	Very low	30.9	Very low	142 Å²	142	130 Å²	130	66%	0.664	75%	0.746	S	S	*	*			trans	-58.7	178.3	165.6	-75.9	157.5	-101.6	0	0	116
324	E	30.6	Very low	31.3	Very low	148 Å²	148	133.9 Å²	133.9	69%	0.692	74%	0.742	S	S	*	*			cis	-159.2	157.4	16.3	-142.9	149.4	-158	0	0	115
325	D	31.7	Very low	31.4	Very low	138 Å²	138	137.4 Å²	137.4	74%	0.738	74%	0.743	S	S	*	*			trans	39.5	165.6	152.1	-95.9	-107.3	0	0	0	123.7
326	V	30.6	Very low	30.3	Very low	134 Å²	134	136.5 Å²	136.5	81%	0.812	74%	0.744	S	S	*	*			cis	-136.9	165.8	14.1	-162.5	0	0	0	0	111.3
327	K	27.9	Very low	31.1	Very low	190 Å²	190	135.3 Å²	135.3	83%	0.826	75%	0.746	S	S	*	*			trans	-112.9	-158.1	176.8	-133.2	177.1	-179.5	174	0	110.1
328	P	47.4	Very low	31.2	Very low	101 Å²	101	137.2 Å²	137.2	66%	0.656	75%	0.753	S	S	*	*			cis	-139.6	-159.5	-19.6	35.9	-11.9	0	0	0	115.5
329	L	25.7	Very low	32	Very low	152 Å²	152	136.4 Å²	136.4	80%	0.796	75%	0.75	S	S	*	*			trans	76.4	152.1	158.1	-103.3	69.1	0	0	0	118
330	L	30.7	Very low	31.8	Very low	151 Å²	151	135.8 Å²	135.8	79%	0.791	75%	0.747	S	S	*	*			cis	-153.5	-161.5	2.2	-169.1	63.3	0	0	0	109
331	D	28.2	Very low	31.6	Very low	107 Å²	107	139.4 Å²	139.4	57%	0.572	76%	0.757	S	S	*	*				-148.5	172.6	-103	-169.7	13.9	0	0	0	113.2
332	K	33.9	Very low	32	Very low	157 Å²	157	137.9 Å²	137.9	68%	0.683	75%	0.75	S	S	*	*			trans	24.3	113.6	164.6	-74.5	154	-166.9	72.2	0	120.4
333	N	28.8	Very low	31.7	Very low	145 Å²	145	136.7 Å²	136.7	78%	0.775	75%	0.749	S	S	*	*				54.5	110	66	-165.3	-10.7	0	0	0	117.2
334	Q	35.5	Very low	31.7	Very low	163 Å²	163	138.5 Å²	138.5	76%	0.762	76%	0.758	S	S	*	*			trans	179.3	139.8	136.1	-106.8	169.8	103.1	0	0	119.4
335	K	28.7	Very low	31.6	Very low	195 Å²	195	135.7 Å²	135.7	85%	0.848	76%	0.755	S	S	*	*			trans	76.4	159.6	140.8	-136.8	160.6	-173.3	171.8	0	122
336	A	27.7	Very low	31.5	Very low	86 Å²	86	137.1 Å²	137.1	71%	0.711	76%	0.761	S	S	*	*			trans	-143.1	160.9	-171.7	0	0	0	0	0	113.1
337	P	41.3	Very low	31.4	Very low	130 Å²	130	137.8 Å²	137.8	84%	0.844	76%	0.756	S	S	*	*				-148	178.5	126.8	39.3	-22.9	0	0	0	116
338	T	27.7	Very low	31.7	Very low	132 Å²	132	135 Å²	135	81%	0.81	75%	0.749	S	S	*	*			trans	-108	179.3	173.9	50.8	0	0	0	0	110.3
339	P	44.8	Very low	30.8	Very low	107 Å²	107	137.7 Å²	137.7	70%	0.695	76%	0.757	S	S	*	*			cis	-147.7	-166	20.8	39.4	-14.4	0	0	0	118.8
340	T	25.3	Very low	31	Very low	140 Å²	140	137.5 Å²	137.5	86%	0.859	76%	0.756	S	S	*	*			trans	97.5	152.5	164.5	66.4	0	0	0	0	120.8
341	T	26.3	Very low	31.1	Very low	133 Å²	133	136.4 Å²	136.4	82%	0.816	76%	0.758	S	S	*	*			trans	-107.6	178.1	-160.9	34.8	0	0	0	0	112.7
342	P	38.1	Very low	31.2	Very low	107 Å²	107	136.8 Å²	136.8	70%	0.695	77%	0.769	S	S	*	*			cis	-144.2	177.6	19.6	41.4	-20.6	0	0	0	119.5
343	T	23.8	Very low	31	Very low	113 Å²	113	135.4 Å²	135.4	69%	0.693	77%	0.774	S	S	*	*			trans	64.5	133.4	153.8	34.6	0	0	0	0	122.3
344	Q	30.4	Very low	31.7	Very low	179 Å²	179	134.6 Å²	134.6	84%	0.836	78%	0.776	S	S	*	*			trans	64.5	154.6	154.6	-66.3	173.7	97.8	0	0	116.9
345	S	28.7	Very low	31.9	Very low	90 Å²	90	137.2 Å²	137.2	63%	0.629	79%	0.785	S	S	*	*			cis	-178.8	141.9	-37.1	51.9	0	0	0	0	106.2
346	L	30.6	Very low	32	Very low	167 Å²	167	131.7 Å²	131.7	87%	0.874	78%	0.784	S	S	*	*			trans	65.7	160.3	-169.6	-98.9	64.6	0	0	0	112.1
347	E	28.8	Very low	32.6	Very low	149 Å²	149	140 Å²	140	70%	0.696	80%	0.797	S	S	*	*			cis	-146.2	163.2	17.3	-121.6	-161.1	149.8	0	0	112.9
348	L	33	Very low	31.9	Very low	131 Å²	131	137.4 Å²	137.4	69%	0.686	79%	0.793	S	S	*	*			trans	46.7	147.8	144.1	-64.3	177.4	0	0	0	124.1
349	L	28.7	Very low	32.4	Very low	157 Å²	157	140.9 Å²	140.9	82%	0.822	80%	0.797	S	S	*	*				-164.1	121	105.5	-103.9	168.8	0	0	0	113.9
350	L	30.4	Very low	32.1	Very low	148 Å²	148	141.8 Å²	141.8	78%	0.775	80%	0.803	S	S	*	*			trans	-114.7	145.5	150	-80.9	171.2	0	0	0	107.1
351	P	32.8	Very low	32.4	Very low	129 Å²	129	141.5 Å²	141.5	84%	0.838	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-65.3	163.8	179.7	-24.5	36.2	0	0	0	115.5
352	S	29.4	Very low	32.7	Very low	114 Å²	114	141.1 Å²	141.1	80%	0.797	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-102.6	169.6	-150.2	-42.3	0	0	0	0	116.8
353	T	30.3	Very low	32.8	Very low	128 Å²	128	144.8 Å²	144.8	79%	0.785	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-86	162.1	177.7	61.7	0	0	0	0	114.2
354	P	43.7	Very low	33.2	Very low	128 Å²	128	144.6 Å²	144.6	83%	0.831	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-78.5	167.8	152.1	33.2	-31.7	0	0	0	111.9
355	K	40.4	Very low	33.4	Very low	218 Å²	218	139.5 Å²	139.5	95%	0.948	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-99.9	146.2	-166.1	-102.9	167	176	165.8	0	114.5
356	G	30.8	Very low	33.9	Very low	79 Å²	79	140.6 Å²	140.6	81%	0.814	81%	0.81	S	S	*	*			trans	-153.8	146.3	161.9	0	0	0	0	0	109.4
357	R	39.5	Very low	34.7	Very low	261 Å²	261	138.5 Å²	138.5	99%	0.985	81%	0.807	S	S	*	*			trans	-133.7	119.3	-165.8	-176.4	-176	-172.9	174.4	2.2	112.2
358	G	27.3	Very low	35.7	Very low	75 Å²	75	139.8 Å²	139.8	77%	0.773	81%	0.813	S	S	*	*			trans	-179.8	139.7	170.6	0	0	0	0	0	113.5
359	K	36.6	Very low	36.1	Very low	206 Å²	206	141.1 Å²	141.1	90%	0.896	82%	0.821	S	S	*	*			trans	-127	140.3	156.3	-80.9	-175.2	174.1	-177.8	0	104.9
360	P	39	Very low	37.2	Very low	125 Å²	125	136.9 Å²	136.9	81%	0.812	81%	0.814	S	S	*	*				-143.4	166	89.7	39	-24	0	0	0	116.2
361	N	31.4	Very low	38.4	Very low	135 Å²	135	131.4 Å²	131.4	72%	0.722	79%	0.794	S	S	*	*			trans	22.7	136.7	144.2	-150	27.4	0	0	0	123.8
362	N	32.1	Very low	40.2	Very low	125 Å²	125	134.2 Å²	134.2	67%	0.668	79%	0.793	S	S	*	*			trans	64.9	139.9	148.9	-84.3	-14	0	0	0	123.9
363	Q	41.1	Very low	42.3	Very low	183 Å²	183	132 Å²	132	86%	0.855	78%	0.776	S	S	*	*			trans	42.1	108.1	153.7	-59.3	-170.7	27	0	0	121.1
364	A	31.8	Very low	44.7	Very low	110 Å²	110	129.1 Å²	129.1	91%	0.909	75%	0.752	S	S	*	*			trans	-156.8	149.8	142.2	0	0	0	0	0	109
365	G	35.1	Very low	46.5	Very low	72 Å²	72	128.9 Å²	128.9	74%	0.742	74%	0.74	S	S	*	*			trans	-108.9	155.6	-173.5	0	0	0	0	0	115.3
366	S	39	Very low	48.7	Very low	112 Å²	112	118.5 Å²	118.5	78%	0.783	70%	0.695	S	S	*	*			trans	65.8	161.4	176.5	-122.4	0	0	0	0	114.9
367	P	47	Very low	50.8	Low	124 Å²	124	119.7 Å²	119.7	81%	0.805	69%	0.688	S	S	*	*			cis	-104.5	170	33.7	2.4	20.3	0	0	0	115.4
368	E	49.8	Very low	52.3	Low	176 Å²	176	111.7 Å²	111.7	82%	0.822	67%	0.669	S	S	*	*			trans	-57.6	140.7	163.4	-67.6	-147.7	118.9	0	0	112.2	G370	E368-G370 PolarHBondContact O-N 3.27Å
369	D	42.1	Very low	54.7	Low	159 Å²	159	111.5 Å²	111.5	85%	0.85	65%	0.654	S	S	*	*			trans	-69.8	83.6	160.7	-179.5	43	0	0	0	109.2	G371	D369-G371 PolarHBondContact O-N 3.27Å
370	G	50.8	Low	56.8	Low	67 Å²	67	103.3 Å²	103.3	69%	0.691	63%	0.629	S	S	*	*			trans	-66.8	37.9	171.7	0	0	0	0	0	113.5	E368 K372	E368-G370 PolarHBondContact O-N 3.27Å; G370-K372 PolarHBondContact O-N 3.48Å
371	G	55.4	Low	58.9	Low	33 Å²	33	101.5 Å²	101.5	34%	0.34	61%	0.612	S	S	.	*			trans	-56.6	109	-179	0	0	0	0	0	111.1	D369 P373	D369-G371 PolarHBondContact O-N 3.27Å; G371-P373 VanDerWaalsContact O-N 3.13Å
372	K	71.8	Confident	61.5	Low	189 Å²	189	98.9 Å²	98.9	82%	0.822	60%	0.601	S	S	*	*			trans	-46.9	119.9	-180	-65.5	-177.9	-179.7	-179.1	0	109.4	G370 F374	G370-K372 PolarHBondContact O-N 3.48Å; K372-F374 PolarHBondContact O-N 3.32Å
373	P	73.3	Confident	64.2	Low	67 Å²	67	94 Å²	94	44%	0.435	57%	0.574	S	S	.	*			trans	-69.9	137.3	-164.1	29	-36.8	0	0	0	110.6	G371 Q375 V382 K384	G371-P373 VanDerWaalsContact O-N 3.13Å; P373-Q375 PolarHBondContact O-N 3.46Å; P373-V382 HydrophobicContact CB-CG1 3.54Å; P373-V382 HydrophobicContact CG-CG1 3.57Å; P373-K384 HydrophobicContact CB-CG 4.48Å
374	F	80.5	Confident	66.3	Low	67 Å²	67	94.2 Å²	94.2	29%	0.294	57%	0.572	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.7	102.5	-169.8	-60.9	-94	0	0	0	110.3	K372 I383 K386 W389	K372-F374 PolarHBondContact O-N 3.32Å; F374-I383 WeakPolarHBondContact CB-O 3.39Å; F374-I383 PolarHBondContact N-O 3.1Å; F374-I383 PolarHBondContact O-N 3.02Å; F374-K386 HydrophobicContact CD1-CG 4.31Å; F374-K386 HydrophobicContact CD2-CB 4.16Å; F374-K386 HydrophobicContact CE1-CB 4.08Å; F374-K386 HydrophobicContact CE1-CD 3.98Å; F374-K386 HydrophobicContact CE1-CG 3.77Å; F374-K386 HydrophobicContact CE2-CB 3.67Å; F374-K386 HydrophobicContact CE2-CG 4.3Å; F374-K386 HydrophobicContact CZ-CB 3.63Å; F374-K386 HydrophobicContact CZ-CD 3.87Å; F374-K386 HydrophobicContact CZ-CG 3.78Å; F374-W389 HydrophobicContact CB-CB 3.59Å; F374-W389 VanDerWaalsContact CB-CD1 3.48Å; F374-W389 HydrophobicContact CB-CD2 4.04Å; F374-W389 HydrophobicContact CB-CG 3.43Å; F374-W389 VanDerWaalsContact CB-CG 3.43Å; F374-W389 HydrophobicContact CD1-CD2 4.48Å; F374-W389 HydrophobicContact CG-CB 4.25Å; F374-W389 HydrophobicContact CG-CG 4.28Å; F374-W389 VanDerWaalsContact O-CD1 3.24Å
375	Q	82.7	Confident	68.9	Low	123 Å²	123	95.5 Å²	95.5	58%	0.575	55%	0.554	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-75.6	135.7	174.2	-165.8	168.5	24	0	0	110.7	P373 G380 L381 V382 W389	P373-Q375 PolarHBondContact O-N 3.46Å; Q375-G380 WeakPolarHBondContact CG-O 3.24Å; Q375-G380 PolarHBondContact NE2-O 2.72Å; Q375-G380 VanDerWaalsContact NE2-O 3.14Å; Q375-L381 CarbonylContact C-O 3.57Å; Q375-V382 HydrophobicContact CB-CG2 4.3Å; Q375-V382 HydrophobicContact CG-CG2 3.96Å; Q375-W389 PolarHBondContact O-NE1 2.67Å
376	C	85.3	Confident	71.2	Confident	1 Å²	1	98.9 Å²	98.9	1%	0.007	55%	0.548	C	S	.	.			trans	-75.2	124.3	168.7	-175.1	0	0	0	0	110	V378 G380 L381 H392 H396	C376-V378 PolarHBondContact O-N 3.21Å; C376-G380 VanDerWaalsContact O-CA 3.25Å; C376-G380 WeakPolarHBondContact O-CA 3.25Å; C376-G380 PolarHBondContact O-N 2.98Å; C376-L381 HydrophobicContact CB-CB 4.32Å; C376-L381 PolarHBondContact N-O 3.26Å; C376-H392 WeakPolarHBondContact CB-NE2 3.46Å; C376-H392 VanDerWaalsContact SG-CD2 3.6Å; C376-H392 PolarHBondContact SG-NE2 2.77Å; C376-H392 VanDerWaalsContact SG-NE2 3.39Å; C376-H396 PolarHBondContact SG-CD2 3.24Å; C376-H396 PolarHBondContact SG-NE2 3.34Å
377	P	75.3	Confident	73.3	Confident	103 Å²	103	96.9 Å²	96.9	67%	0.669	53%	0.534	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-16.9	179.1	28.1	-34.7	0	0	0	113.7	M393	P377-M393 HydrophobicContact CG-CE 4.31Å; P377-M393 HydrophobicContact CG-SD 4.3Å
378	V	70.9	Confident	74.8	Confident	94 Å²	94	95.9 Å²	95.9	57%	0.57	52%	0.515	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.5	-29.6	-174.1	-172.5	0	0	0	0	113	C376 M393 H396	C376-V378 PolarHBondContact O-N 3.21Å; V378-M393 HydrophobicContact CG2-CE 4.01Å; V378-H396 HydrophobicContact CB-CB 4.17Å; V378-H396 HydrophobicContact CG1-CB 4.12Å; V378-H396 WeakPolarHBondContact CG1-ND1 3.38Å; V378-H396 HydrophobicContact CG2-CB 4.04Å
379	C	78.4	Confident	76.5	Confident	70 Å²	70	90.7 Å²	90.7	47%	0.473	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.8	17.5	179.8	76.4	0	0	0	0	114.3	L381 H392 H396	C379-L381 PolarHBondContact O-N 3.38Å; C379-H392 PolarHBondContact SG-NE2 2.98Å; C379-H396 PolarHBondContact SG-NE2 3.48Å; C379-H396 VanDerWaalsContact SG-NE2 3.4Å
380	G	80	Confident	78.3	Confident	35 Å²	35	90.5 Å²	90.5	36%	0.361	48%	0.479	S	S	.	.			trans	66.6	-1.8	175.9	0	0	0	0	0	116.6	Q375 C376 V382	Q375-G380 WeakPolarHBondContact CG-O 3.24Å; Q375-G380 PolarHBondContact NE2-O 2.72Å; Q375-G380 VanDerWaalsContact NE2-O 3.14Å; C376-G380 VanDerWaalsContact O-CA 3.25Å; C376-G380 WeakPolarHBondContact O-CA 3.25Å; C376-G380 PolarHBondContact O-N 2.98Å; G380-V382 PolarHBondContact O-N 2.72Å
381	L	83.4	Confident	79.5	Confident	87 Å²	87	92.7 Å²	92.7	46%	0.455	47%	0.467	S	S	.	.			trans	-65.3	116.9	-172.6	-177.4	63	0	0	0	111.7	Q375 C376 C379 I383	Q375-L381 CarbonylContact C-O 3.57Å; C376-L381 HydrophobicContact CB-CB 4.32Å; C376-L381 PolarHBondContact N-O 3.26Å; C379-L381 PolarHBondContact O-N 3.38Å; L381-I383 HydrophobicContact CD2-CD1 4.07Å; L381-I383 HydrophobicContact CD2-CG1 4.24Å; L381-I383 HydrophobicContact CG-CD1 4.21Å; L381-I383 HydrophobicContact CG-CG1 3.97Å
382	V	86.1	Confident	80.8	Confident	80 Å²	80	92.5 Å²	92.5	49%	0.485	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	119.1	-178.3	178.6	0	0	0	0	110.5	P373 Q375 G380	P373-V382 HydrophobicContact CB-CG1 3.54Å; P373-V382 HydrophobicContact CG-CG1 3.57Å; Q375-V382 HydrophobicContact CB-CG2 4.3Å; Q375-V382 HydrophobicContact CG-CG2 3.96Å; G380-V382 PolarHBondContact O-N 2.72Å
383	I	88.7	Confident	81.1	Confident	21 Å²	21	85.2 Å²	85.2	11%	0.108	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	112.5	-171.1	-59.5	168	0	0	0	110.4	F374 L381 R385 W389 H392	F374-I383 WeakPolarHBondContact CB-O 3.39Å; F374-I383 PolarHBondContact N-O 3.1Å; F374-I383 PolarHBondContact O-N 3.02Å; L381-I383 HydrophobicContact CD2-CD1 4.07Å; L381-I383 HydrophobicContact CD2-CG1 4.24Å; L381-I383 HydrophobicContact CG-CD1 4.21Å; L381-I383 HydrophobicContact CG-CG1 3.97Å; I383-R385 PolarHBondContact O-N 3.39Å; I383-W389 HydrophobicContact CB-CB 4.18Å; I383-W389 HydrophobicContact CD1-CB 4.26Å; I383-W389 HydrophobicContact CG2-CB 4.23Å; I383-H392 HydrophobicContact CD1-CB 3.66Å
384	K	85.8	Confident	81.2	Confident	188 Å²	188	84.2 Å²	84.2	82%	0.817	42%	0.419	S	S	*	.	S	Bend	trans	-59.2	-18.8	-177.4	-66.7	-165.6	174.8	-165.8	0	115.7	P373	P373-K384 HydrophobicContact CB-CG 4.48Å
385	R	86.1	Confident	80.7	Confident	138 Å²	138	86.8 Å²	86.8	52%	0.521	43%	0.434	S	S	.	.			trans	-123.2	124.2	-178.1	-77.7	-169.3	-84.4	140.3	-13.4	113.5	I383 S387 Y388 W389	I383-R385 PolarHBondContact O-N 3.39Å; R385-S387 PolarHBondContact O-N 3.33Å; R385-S387 VanDerWaalsContact O-N 3.12Å; R385-Y388 VanDerWaalsContact NH1-CZ 3.35Å; R385-Y388 PolarHBondContact NH1-OH 3.27Å; R385-Y388 PolarHBondContact O-N 3.46Å; R385-W389 PolarHBondContact O-N 2.86Å
386	K	83.7	Confident	80	Confident	142 Å²	142	84 Å²	84	62%	0.617	42%	0.421	S	S	*	.	H	α-helix	trans	-49.3	-38.1	178.9	-163.2	171.6	-175.1	173.7	0	113.9	F374 W389 K390	F374-K386 HydrophobicContact CD1-CG 4.31Å; F374-K386 HydrophobicContact CD2-CB 4.16Å; F374-K386 HydrophobicContact CE1-CB 4.08Å; F374-K386 HydrophobicContact CE1-CD 3.98Å; F374-K386 HydrophobicContact CE1-CG 3.77Å; F374-K386 HydrophobicContact CE2-CB 3.67Å; F374-K386 HydrophobicContact CE2-CG 4.3Å; F374-K386 HydrophobicContact CZ-CB 3.63Å; F374-K386 HydrophobicContact CZ-CD 3.87Å; F374-K386 HydrophobicContact CZ-CG 3.78Å; K386-W389 PolarHBondContact O-N 3.31Å; K386-K390 WeakPolarHBondContact O-CB 3.37Å; K386-K390 PolarHBondContact O-N 3.23Å
387	S	82.4	Confident	78.9	Confident	71 Å²	71	87.8 Å²	87.8	50%	0.497	45%	0.445	S	S	.	.	H	α-helix	trans	-71.3	-27.5	178.7	57.2	0	0	0	0	114	R385 R391	R385-S387 PolarHBondContact O-N 3.33Å; R385-S387 VanDerWaalsContact O-N 3.12Å; S387-R391 WeakPolarHBondContact O-CB 3.45Å; S387-R391 PolarHBondContact O-N 2.78Å
388	Y	77.6	Confident	78	Confident	102 Å²	102	85.2 Å²	85.2	40%	0.4	44%	0.437	S	S	.	.	H	α-helix	trans	-82.4	-38.1	172.6	-73.6	5.6	0	0	0	111	R385 R391 H392	R385-Y388 VanDerWaalsContact NH1-CZ 3.35Å; R385-Y388 PolarHBondContact NH1-OH 3.27Å; R385-Y388 PolarHBondContact O-N 3.46Å; Y388-R391 WeakPolarHBondContact O-CB 3.41Å; Y388-R391 PolarHBondContact O-N 3.06Å; Y388-H392 WeakPolarHBondContact O-CB 3.46Å; Y388-H392 PolarHBondContact O-N 2.92Å
389	W	86.9	Confident	76.9	Confident	67 Å²	67	86.6 Å²	86.6	25%	0.254	44%	0.44	S	S	.	.	H	α-helix	trans	-61.2	-47.9	173.1	175.6	89.4	0	0	0	111.9	F374 Q375 I383 R385 K386 R391 H392 M393	F374-W389 HydrophobicContact CB-CB 3.59Å; F374-W389 VanDerWaalsContact CB-CD1 3.48Å; F374-W389 HydrophobicContact CB-CD2 4.04Å; F374-W389 HydrophobicContact CB-CG 3.43Å; F374-W389 VanDerWaalsContact CB-CG 3.43Å; F374-W389 HydrophobicContact CD1-CD2 4.48Å; F374-W389 HydrophobicContact CG-CB 4.25Å; F374-W389 HydrophobicContact CG-CG 4.28Å; F374-W389 VanDerWaalsContact O-CD1 3.24Å; Q375-W389 PolarHBondContact O-NE1 2.67Å; I383-W389 HydrophobicContact CB-CB 4.18Å; I383-W389 HydrophobicContact CD1-CB 4.26Å; I383-W389 HydrophobicContact CG2-CB 4.23Å; R385-W389 PolarHBondContact O-N 2.86Å; K386-W389 PolarHBondContact O-N 3.31Å; W389-R391 VanDerWaalsContact C-N 3.25Å; W389-R391 PolarHBondContact O-N 2.63Å; W389-H392 PolarHBondContact O-N 3.04Å; W389-H392 VanDerWaalsContact O-N 3.09Å; W389-M393 HydrophobicContact CD2-CG 4.04Å; W389-M393 HydrophobicContact CE3-CG 4.37Å; W389-M393 HydrophobicContact CH2-CG 4.37Å; W389-M393 HydrophobicContact CH2-SD 4.15Å; W389-M393 HydrophobicContact CZ2-CG 4.05Å; W389-M393 HydrophobicContact CZ2-SD 3.63Å; W389-M393 VanDerWaalsContact O-CG 3.27Å; W389-M393 WeakPolarHBondContact O-CG 3.45Å; W389-M393 PolarHBondContact O-N 3.46Å
390	K	79.8	Confident	75.8	Confident	155 Å²	155	89.3 Å²	89.3	67%	0.674	44%	0.444	S	S	*	.	H	α-helix	trans	-60.7	-34.4	176.1	-170.8	171.1	-177.2	175.6	0	112.2	K386 V394	K386-K390 WeakPolarHBondContact O-CB 3.37Å; K386-K390 PolarHBondContact O-N 3.23Å; K390-V394 WeakPolarHBondContact O-CG2 3.4Å
391	R	76.4	Confident	74.8	Confident	113 Å²	113	91.7 Å²	91.7	43%	0.426	46%	0.455	S	S	.	.	H	α-helix	trans	-70.1	-40.8	173.8	-173.2	-168.9	-61	151.1	1.5	112.3	S387 Y388 W389 V394	S387-R391 WeakPolarHBondContact O-CB 3.45Å; S387-R391 PolarHBondContact O-N 2.78Å; Y388-R391 WeakPolarHBondContact O-CB 3.41Å; Y388-R391 PolarHBondContact O-N 3.06Å; W389-R391 VanDerWaalsContact C-N 3.25Å; W389-R391 PolarHBondContact O-N 2.63Å; R391-V394 WeakPolarHBondContact O-CB 3.3Å; R391-V394 PolarHBondContact O-N 3.15Å
392	H	80.9	Confident	74	Confident	29 Å²	29	90.3 Å²	90.3	13%	0.134	45%	0.446	C	S	.	.	H	α-helix	trans	-66.7	-37.9	177.8	172.1	76.6	0	0	0	111.8	C376 C379 I383 Y388 W389 V394 I395 H396	C376-H392 WeakPolarHBondContact CB-NE2 3.46Å; C376-H392 VanDerWaalsContact SG-CD2 3.6Å; C376-H392 PolarHBondContact SG-NE2 2.77Å; C376-H392 VanDerWaalsContact SG-NE2 3.39Å; C379-H392 PolarHBondContact SG-NE2 2.98Å; I383-H392 HydrophobicContact CD1-CB 3.66Å; Y388-H392 WeakPolarHBondContact O-CB 3.46Å; Y388-H392 PolarHBondContact O-N 2.92Å; W389-H392 PolarHBondContact O-N 3.04Å; W389-H392 VanDerWaalsContact O-N 3.09Å; H392-V394 PolarHBondContact O-N 2.84Å; H392-I395 VanDerWaalsContact O-CB 3.24Å; H392-I395 WeakPolarHBondContact O-CB 3.45Å; H392-I395 WeakPolarHBondContact O-CG1 3.41Å; H392-I395 PolarHBondContact O-N 3.49Å; H392-H396 AromaticContact CD2-NE2 3.83Å; H392-H396 AromaticContact CE1-NE2 3.42Å; H392-H396 PolarHBondContact CE1-NE2 2.97Å; H392-H396 AromaticContact NE2-CD2 3.69Å; H392-H396 AromaticContact NE2-NE2 3.02Å; H392-H396 PolarHBondContact NE2-NE2 2.79Å
393	M	78.1	Confident	73.2	Confident	36 Å²	36	91.1 Å²	91.1	18%	0.177	45%	0.445	C	S	.	.	H	α-helix	trans	-58.5	-29.4	174.4	-69.2	-101	51.8	0	0	113.2	P377 V378 W389 I395 H396 T397	P377-M393 HydrophobicContact CG-CE 4.31Å; P377-M393 HydrophobicContact CG-SD 4.3Å; V378-M393 HydrophobicContact CG2-CE 4.01Å; W389-M393 HydrophobicContact CD2-CG 4.04Å; W389-M393 HydrophobicContact CE3-CG 4.37Å; W389-M393 HydrophobicContact CH2-CG 4.37Å; W389-M393 HydrophobicContact CH2-SD 4.15Å; W389-M393 HydrophobicContact CZ2-CG 4.05Å; W389-M393 HydrophobicContact CZ2-SD 3.63Å; W389-M393 VanDerWaalsContact O-CG 3.27Å; W389-M393 WeakPolarHBondContact O-CG 3.45Å; W389-M393 PolarHBondContact O-N 3.46Å; M393-I395 PolarHBondContact O-N 3.42Å; M393-H396 HydrophobicContact CE-CB 4.29Å; M393-H396 PolarHBondContact O-N 2.77Å; M393-T397 PolarHBondContact O-N 3.38Å; M393-T397 VanDerWaalsContact O-N 3.11Å; M393-T397 PolarHBondContact O-OG1 2.97Å
394	V	76.1	Confident	72.6	Confident	46 Å²	46	90.1 Å²	90.1	28%	0.279	44%	0.44	S	S	.	.	H	α-helix	trans	-62.4	-28.7	175.5	-167.4	0	0	0	0	112.2	K390 R391 H392 T397 A412	K390-V394 WeakPolarHBondContact O-CG2 3.4Å; R391-V394 WeakPolarHBondContact O-CB 3.3Å; R391-V394 PolarHBondContact O-N 3.15Å; H392-V394 PolarHBondContact O-N 2.84Å; V394-T397 WeakPolarHBondContact CA-OG1 3.49Å; V394-T397 PolarHBondContact O-OG1 2.9Å; V394-A412 HydrophobicContact CB-CB 4.49Å; V394-A412 HydrophobicContact CG1-CB 3.77Å
395	I	70.1	Confident	71.6	Confident	121 Å²	121	86.3 Å²	86.3	62%	0.621	43%	0.434	S	S	*	.	H	α-helix	trans	-63.2	-48	176.6	-53.8	173.7	0	0	0	109.8	H392 M393 G398	H392-I395 VanDerWaalsContact O-CB 3.24Å; H392-I395 WeakPolarHBondContact O-CB 3.45Å; H392-I395 WeakPolarHBondContact O-CG1 3.41Å; H392-I395 PolarHBondContact O-N 3.49Å; M393-I395 PolarHBondContact O-N 3.42Å; I395-G398 PolarHBondContact O-N 3.14Å
396	H	68	Low	70.3	Confident	65 Å²	65	84.6 Å²	84.6	30%	0.301	44%	0.435	S	S	.	.	H	α-helix	trans	-71.2	-33.3	-178.5	-62.3	-61.9	0	0	0	113.5	C376 V378 C379 H392 M393 G398	C376-H396 PolarHBondContact SG-CD2 3.24Å; C376-H396 PolarHBondContact SG-NE2 3.34Å; V378-H396 HydrophobicContact CB-CB 4.17Å; V378-H396 HydrophobicContact CG1-CB 4.12Å; V378-H396 WeakPolarHBondContact CG1-ND1 3.38Å; V378-H396 HydrophobicContact CG2-CB 4.04Å; C379-H396 PolarHBondContact SG-NE2 3.48Å; C379-H396 VanDerWaalsContact SG-NE2 3.4Å; H392-H396 AromaticContact CD2-NE2 3.83Å; H392-H396 AromaticContact CE1-NE2 3.42Å; H392-H396 PolarHBondContact CE1-NE2 2.97Å; H392-H396 AromaticContact NE2-CD2 3.69Å; H392-H396 AromaticContact NE2-NE2 3.02Å; H392-H396 PolarHBondContact NE2-NE2 2.79Å; M393-H396 HydrophobicContact CE-CB 4.29Å; M393-H396 PolarHBondContact O-N 2.77Å; H396-G398 PolarHBondContact O-N 3.21Å
397	T	62.6	Low	69.5	Low	81 Å²	81	79.6 Å²	79.6	50%	0.497	42%	0.417	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-9.8	176.2	56.6	0	0	0	0	114.1	M393 V394 L399	M393-T397 PolarHBondContact O-N 3.38Å; M393-T397 VanDerWaalsContact O-N 3.11Å; M393-T397 PolarHBondContact O-OG1 2.97Å; V394-T397 WeakPolarHBondContact CA-OG1 3.49Å; V394-T397 PolarHBondContact O-OG1 2.9Å; T397-L399 PolarHBondContact O-N 3.13Å
398	G	56.9	Low	68.5	Low	49 Å²	49	81 Å²	81	51%	0.505	42%	0.424	S	S	.	.			trans	67.7	-10.1	-177.8	0	0	0	0	0	116.1	I395 H396 K400	I395-G398 PolarHBondContact O-N 3.14Å; H396-G398 PolarHBondContact O-N 3.21Å; G398-K400 VanDerWaalsContact C-N 3.29Å; G398-K400 PolarHBondContact O-N 2.82Å
399	L	47.4	Very low	68	Low	123 Å²	123	80 Å²	80	64%	0.644	42%	0.423	S	S	*	.			trans	-68.1	73.7	-174.6	-63.7	179.9	0	0	0	113.4	T397 S401	T397-L399 PolarHBondContact O-N 3.13Å; L399-S401 PolarHBondContact O-N 3.17Å
400	K	55.3	Low	67.3	Low	126 Å²	126	83.8 Å²	83.8	55%	0.548	44%	0.437	S	S	.	.			trans	-74.7	73.1	171.1	-63.8	170.3	-178.1	171.3	0	110.5	G398 H402 R410 C411	G398-K400 VanDerWaalsContact C-N 3.29Å; G398-K400 PolarHBondContact O-N 2.82Å; K400-H402 PolarHBondContact O-N 2.97Å; K400-H402 VanDerWaalsContact O-N 3.09Å; K400-R410 HydrophobicContact CB-CB 3.8Å; K400-R410 HydrophobicContact CD-CB 4.01Å; K400-C411 CarbonylContact C-O 3.59Å
401	S	58.7	Low	67.1	Low	86 Å²	86	76.9 Å²	76.9	60%	0.601	41%	0.408	S	S	*	.			trans	-60.9	-13.6	-174.4	57.4	0	0	0	0	116.3	L399	L399-S401 PolarHBondContact O-N 3.17Å
402	H	66.8	Low	66.8	Low	57 Å²	57	73.6 Å²	73.6	26%	0.264	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	92.8	-176.9	-60.7	-63.8	0	0	0	111.1	K400 C411 K414 L417	K400-H402 PolarHBondContact O-N 2.97Å; K400-H402 VanDerWaalsContact O-N 3.09Å; H402-C411 WeakPolarHBondContact CB-O 3.38Å; H402-C411 PolarHBondContact N-O 3.17Å; H402-C411 PolarHBondContact O-N 2.84Å; H402-C411 PolarHBondContact O-SG 3.3Å; H402-K414 PolarHBondContact CD2-N 2.94Å; H402-K414 PolarHBondContact NE2-N 3.37Å; H402-L417 HydrophobicContact CB-CB 4.21Å; H402-L417 HydrophobicContact CB-CD2 4.07Å
403	Q	67.9	Low	66.4	Low	97 Å²	97	76.6 Å²	76.6	45%	0.453	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	143.4	169	176	161.6	-20.8	0	0	111.1	R410 L417	Q403-R410 HydrophobicContact CB-CG 3.97Å; Q403-R410 HydrophobicContact CG-CG 4.14Å; Q403-R410 VanDerWaalsContact OE1-CZ 3.24Å; Q403-L417 WeakPolarHBondContact O-CD2 3.38Å
404	C	76.8	Confident	66.3	Low	1 Å²	1	82.2 Å²	82.2	1%	0.007	44%	0.438	C	S	.	.			trans	-76.8	132.8	166	179.6	0	0	0	0	110.6	L406 C407 F409 L417 H420 M421 H424	C404-L406 VanDerWaalsContact C-N 3.28Å; C404-L406 PolarHBondContact O-N 3.09Å; C404-L406 PolarHBondContact SG-N 3.49Å; C404-L406 VanDerWaalsContact SG-N 3.36Å; C404-C407 WeakPolarHBondContact CB-O 3.39Å; C404-C407 VanDerWaalsContact O-O 3.04Å; C404-F409 HydrophobicContact CB-CB 4.14Å; C404-F409 WeakPolarHBondContact CB-O 3.42Å; C404-F409 PolarHBondContact N-O 2.68Å; C404-L417 HydrophobicContact CB-CD1 3.95Å; C404-H420 PolarHBondContact SG-CD2 3.4Å; C404-H420 PolarHBondContact SG-NE2 3.15Å; C404-M421 WeakPolarHBondContact SG-CE 3.48Å; C404-H424 PolarHBondContact SG-NE2 2.83Å
405	P	64.5	Low	66.4	Low	107 Å²	107	84.2 Å²	84.2	70%	0.695	45%	0.447	S	S	*	.	S	Bend	trans	-72.7	-19.8	175.6	28.5	-33.3	0	0	0	113.3	M421	P405-M421 HydrophobicContact CG-CE 4.26Å; P405-M421 HydrophobicContact CG-SD 3.98Å
406	L	58.7	Low	66.8	Low	102 Å²	102	81.9 Å²	81.9	53%	0.534	44%	0.436	S	S	.	.	S	Bend	trans	-101.2	-10.4	-173.6	-59.3	178.9	0	0	0	114.4	C404 M421 H424	C404-L406 VanDerWaalsContact C-N 3.28Å; C404-L406 PolarHBondContact O-N 3.09Å; C404-L406 PolarHBondContact SG-N 3.49Å; C404-L406 VanDerWaalsContact SG-N 3.36Å; L406-M421 HydrophobicContact CB-CE 4.31Å; L406-M421 HydrophobicContact CD1-CE 3.72Å; L406-M421 HydrophobicContact CG-CE 3.98Å; L406-H424 HydrophobicContact CD1-CB 3.56Å; L406-H424 PolarHBondContact O-CE1 2.71Å
407	C	67.4	Low	67.4	Low	37 Å²	37	80.1 Å²	80.1	25%	0.25	43%	0.429	C	S	.	.	S	Bend	trans	-162.3	166.1	174.7	77.3	0	0	0	0	111.4	C404 F409 H420 H424	C404-C407 WeakPolarHBondContact CB-O 3.39Å; C404-C407 VanDerWaalsContact O-O 3.04Å; C407-F409 PolarHBondContact O-N 3.1Å; C407-H420 VanDerWaalsContact SG-CE1 3.59Å; C407-H420 PolarHBondContact SG-NE2 2.97Å; C407-H424 WeakPolarHBondContact CB-CE1 3.48Å; C407-H424 PolarHBondContact SG-CE1 2.57Å; C407-H424 PolarHBondContact SG-NE2 3.03Å
408	P	61.7	Low	68.3	Low	100 Å²	100	83.9 Å²	83.9	65%	0.649	44%	0.438	S	S	*	.	S	Bend	trans	-68.7	13.1	-177.1	27.5	-36	0	0	0	115.6	R410	P408-R410 PolarHBondContact O-N 3.31Å
409	F	67.6	Low	69.3	Low	83 Å²	83	85.1 Å²	85.1	36%	0.364	44%	0.44	S	S	.	.			trans	-65.9	119.7	174.4	-178.5	-103.4	0	0	0	111.2	C404 C407 C411 H420	C404-F409 HydrophobicContact CB-CB 4.14Å; C404-F409 WeakPolarHBondContact CB-O 3.42Å; C404-F409 PolarHBondContact N-O 2.68Å; C407-F409 PolarHBondContact O-N 3.1Å; F409-C411 HydrophobicContact CE1-CB 3.78Å; F409-C411 HydrophobicContact CZ-CB 3.95Å; F409-H420 HydrophobicContact CD1-CB 3.98Å; F409-H420 AromaticContact CD1-CD2 3.59Å; F409-H420 AromaticContact CD1-CE1 3.72Å; F409-H420 AromaticContact CD1-CG 3.4Å; F409-H420 AromaticContact CD1-ND1 3.49Å; F409-H420 WeakPolarHBondContact CD1-ND1 3.26Å; F409-H420 AromaticContact CD1-NE2 3.79Å; F409-H420 HydrophobicContact CE1-CB 3.73Å; F409-H420 AromaticContact CE1-CG 3.66Å; F409-H420 AromaticContact CE1-ND1 3.84Å; F409-H420 AromaticContact CG-CE1 3.61Å; F409-H420 AromaticContact CG-ND1 3.7Å; F409-H420 AromaticContact CG-NE2 3.93Å
410	R	72.5	Confident	70.9	Confident	146 Å²	146	80.5 Å²	80.5	55%	0.551	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	136.1	172.9	-66.7	-174.3	165.6	175.7	-3.8	110.3	K400 Q403 P408	K400-R410 HydrophobicContact CB-CB 3.8Å; K400-R410 HydrophobicContact CD-CB 4.01Å; Q403-R410 HydrophobicContact CB-CG 3.97Å; Q403-R410 HydrophobicContact CG-CG 4.14Å; Q403-R410 VanDerWaalsContact OE1-CZ 3.24Å; P408-R410 PolarHBondContact O-N 3.31Å
411	C	74.9	Confident	71.9	Confident	10 Å²	10	77.1 Å²	77.1	7%	0.068	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	163.3	179.1	67.9	0	0	0	0	113.1	K400 H402 F409 R413 N416 L417	K400-C411 CarbonylContact C-O 3.59Å; H402-C411 WeakPolarHBondContact CB-O 3.38Å; H402-C411 PolarHBondContact N-O 3.17Å; H402-C411 PolarHBondContact O-N 2.84Å; H402-C411 PolarHBondContact O-SG 3.3Å; F409-C411 HydrophobicContact CE1-CB 3.78Å; F409-C411 HydrophobicContact CZ-CB 3.95Å; C411-R413 PolarHBondContact SG-O 2.9Å; C411-R413 VanDerWaalsContact SG-O 3.34Å; C411-N416 HydrophobicContact CB-CB 4.24Å; C411-L417 PolarHBondContact SG-N 3.08Å
412	A	70.7	Confident	72.7	Confident	43 Å²	43	79.3 Å²	79.3	36%	0.355	40%	0.4	S	S	.	.	S	Bend	trans	-89.5	3.4	-176.9	0	0	0	0	0	114.7	V394	V394-A412 HydrophobicContact CB-CB 4.49Å; V394-A412 HydrophobicContact CG1-CB 3.77Å
413	R	72.8	Confident	72.7	Confident	93 Å²	93	77.3 Å²	77.3	35%	0.351	39%	0.392	S	S	.	.			trans	-145.7	131.7	-177.8	-73.2	-176.9	65	179.3	1.6	112.4	C411 D415 N416 L417	C411-R413 PolarHBondContact SG-O 2.9Å; C411-R413 VanDerWaalsContact SG-O 3.34Å; R413-D415 IonicContact CZ-OD2 2.63Å; R413-D415 IonicContact NE-OD2 3.17Å; R413-D415 PolarHBondContact NE-OD2 2.87Å; R413-D415 IonicContact NH2-OD2 2.91Å; R413-D415 PolarHBondContact NH2-OD2 3.1Å; R413-D415 PolarHBondContact O-N 3.18Å; R413-D415 VanDerWaalsContact O-N 3.16Å; R413-N416 HydrophobicContact CB-CB 4.37Å; R413-N416 WeakPolarHBondContact O-CB 3.27Å; R413-N416 PolarHBondContact O-N 2.71Å; R413-L417 PolarHBondContact O-N 3.37Å; R413-L417 VanDerWaalsContact O-N 3.15Å
414	K	76.3	Confident	72.7	Confident	153 Å²	153	73.7 Å²	73.7	67%	0.665	38%	0.375	S	S	*	.	H	α-helix	trans	-54.5	-32.5	174	-168.9	173.3	-177.5	174.5	0	113	H402 L417 K418	H402-K414 PolarHBondContact CD2-N 2.94Å; H402-K414 PolarHBondContact NE2-N 3.37Å; K414-L417 PolarHBondContact O-N 2.74Å; K414-K418 PolarHBondContact O-N 2.91Å
415	D	78	Confident	72.1	Confident	88 Å²	88	80.3 Å²	80.3	47%	0.471	41%	0.405	S	S	.	.	H	α-helix	trans	-64.9	-40.5	177.2	-38.6	-60.5	0	0	0	112	R413 K418 S419	R413-D415 IonicContact CZ-OD2 2.63Å; R413-D415 IonicContact NE-OD2 3.17Å; R413-D415 PolarHBondContact NE-OD2 2.87Å; R413-D415 IonicContact NH2-OD2 2.91Å; R413-D415 PolarHBondContact NH2-OD2 3.1Å; R413-D415 PolarHBondContact O-N 3.18Å; R413-D415 VanDerWaalsContact O-N 3.16Å; D415-K418 PolarHBondContact O-N 2.89Å; D415-S419 PolarHBondContact O-N 2.88Å; D415-S419 PolarHBondContact O-OG 2.92Å
416	N	76.7	Confident	71.7	Confident	73 Å²	73	79.9 Å²	79.9	39%	0.39	39%	0.394	S	S	.	.	H	α-helix	trans	-73.1	-31.1	178	-64.6	12	0	0	0	111	C411 R413 S419 H420	C411-N416 HydrophobicContact CB-CB 4.24Å; R413-N416 HydrophobicContact CB-CB 4.37Å; R413-N416 WeakPolarHBondContact O-CB 3.27Å; R413-N416 PolarHBondContact O-N 2.71Å; N416-S419 PolarHBondContact O-OG 3.04Å; N416-H420 WeakPolarHBondContact O-CB 3.3Å; N416-H420 PolarHBondContact O-N 3.2Å
417	L	82.1	Confident	71.4	Confident	28 Å²	28	80.1 Å²	80.1	15%	0.147	39%	0.392	C	S	.	.	H	α-helix	trans	-66.5	-44	167.7	177.4	58	0	0	0	110.7	H402 Q403 C404 C411 R413 K414 S419 H420 M421	H402-L417 HydrophobicContact CB-CB 4.21Å; H402-L417 HydrophobicContact CB-CD2 4.07Å; Q403-L417 WeakPolarHBondContact O-CD2 3.38Å; C404-L417 HydrophobicContact CB-CD1 3.95Å; C411-L417 PolarHBondContact SG-N 3.08Å; R413-L417 PolarHBondContact O-N 3.37Å; R413-L417 VanDerWaalsContact O-N 3.15Å; K414-L417 PolarHBondContact O-N 2.74Å; L417-S419 PolarHBondContact O-N 3.25Å; L417-H420 CarbonylContact O-C 3.6Å; L417-H420 WeakPolarHBondContact O-CB 3.14Å; L417-H420 PolarHBondContact O-N 2.86Å; L417-M421 HydrophobicContact CD1-CG 3.85Å; L417-M421 HydrophobicContact CD1-SD 4.2Å; L417-M421 HydrophobicContact CG-CG 4.15Å; L417-M421 WeakPolarHBondContact O-CG 3.23Å; L417-M421 PolarHBondContact O-N 3.45Å
418	K	81.9	Confident	70.6	Confident	159 Å²	159	84.6 Å²	84.6	69%	0.691	41%	0.414	S	S	*	.	H	α-helix	trans	-63.2	-38.9	179.2	-169.3	178.1	-178.2	-177.3	0	112.7	K414 D415	K414-K418 PolarHBondContact O-N 2.91Å; D415-K418 PolarHBondContact O-N 2.89Å
419	S	77.6	Confident	70.1	Confident	76 Å²	76	88 Å²	88	53%	0.531	41%	0.414	S	S	.	.	H	α-helix	trans	-73.1	-32.8	173.4	62	0	0	0	0	112.7	D415 N416 L417	D415-S419 PolarHBondContact O-N 2.88Å; D415-S419 PolarHBondContact O-OG 2.92Å; N416-S419 PolarHBondContact O-OG 3.04Å; L417-S419 PolarHBondContact O-N 3.25Å
420	H	80.6	Confident	69.3	Low	26 Å²	26	87 Å²	87	12%	0.12	43%	0.426	C	S	.	.	H	α-helix	trans	-66.9	-37.7	171.7	175.8	81.6	0	0	0	112.9	C404 C407 F409 N416 L417 K422 V423 H424	C404-H420 PolarHBondContact SG-CD2 3.4Å; C404-H420 PolarHBondContact SG-NE2 3.15Å; C407-H420 VanDerWaalsContact SG-CE1 3.59Å; C407-H420 PolarHBondContact SG-NE2 2.97Å; F409-H420 HydrophobicContact CD1-CB 3.98Å; F409-H420 AromaticContact CD1-CD2 3.59Å; F409-H420 AromaticContact CD1-CE1 3.72Å; F409-H420 AromaticContact CD1-CG 3.4Å; F409-H420 AromaticContact CD1-ND1 3.49Å; F409-H420 WeakPolarHBondContact CD1-ND1 3.26Å; F409-H420 AromaticContact CD1-NE2 3.79Å; F409-H420 HydrophobicContact CE1-CB 3.73Å; F409-H420 AromaticContact CE1-CG 3.66Å; F409-H420 AromaticContact CE1-ND1 3.84Å; F409-H420 AromaticContact CG-CE1 3.61Å; F409-H420 AromaticContact CG-ND1 3.7Å; F409-H420 AromaticContact CG-NE2 3.93Å; N416-H420 WeakPolarHBondContact O-CB 3.3Å; N416-H420 PolarHBondContact O-N 3.2Å; L417-H420 CarbonylContact O-C 3.6Å; L417-H420 WeakPolarHBondContact O-CB 3.14Å; L417-H420 PolarHBondContact O-N 2.86Å; H420-K422 VanDerWaalsContact C-N 3.26Å; H420-K422 PolarHBondContact O-N 3.2Å; H420-V423 WeakPolarHBondContact O-CB 3.28Å; H420-V423 WeakPolarHBondContact O-CG2 3.42Å; H420-V423 PolarHBondContact O-N 3.41Å; H420-H424 AromaticContact CD2-NE2 3.01Å; H420-H424 PolarHBondContact CD2-NE2 2.77Å; H420-H424 AromaticContact CE1-NE2 2.82Å; H420-H424 PolarHBondContact CE1-NE2 2.91Å; H420-H424 AromaticContact CG-NE2 3.96Å; H420-H424 AromaticContact ND1-NE2 3.86Å; H420-H424 AromaticContact NE2-CD2 3.7Å; H420-H424 AromaticContact NE2-NE2 2.07Å; H420-H424 PolarHBondContact NE2-NE2 2.78Å
421	M	75.3	Confident	68.4	Low	55 Å²	55	85.2 Å²	85.2	27%	0.271	43%	0.425	S	S	.	.	H	α-helix	trans	-64.4	-30.7	179.5	-65.7	-95.5	61.4	0	0	112.4	C404 P405 L406 L417 V423 H424 Q425	C404-M421 WeakPolarHBondContact SG-CE 3.48Å; P405-M421 HydrophobicContact CG-CE 4.26Å; P405-M421 HydrophobicContact CG-SD 3.98Å; L406-M421 HydrophobicContact CB-CE 4.31Å; L406-M421 HydrophobicContact CD1-CE 3.72Å; L406-M421 HydrophobicContact CG-CE 3.98Å; L417-M421 HydrophobicContact CD1-CG 3.85Å; L417-M421 HydrophobicContact CD1-SD 4.2Å; L417-M421 HydrophobicContact CG-CG 4.15Å; L417-M421 WeakPolarHBondContact O-CG 3.23Å; L417-M421 PolarHBondContact O-N 3.45Å; M421-V423 PolarHBondContact O-N 2.91Å; M421-H424 PolarHBondContact O-N 3.35Å; M421-Q425 PolarHBondContact O-N 2.75Å
422	K	76.5	Confident	67.7	Low	132 Å²	132	88.5 Å²	88.5	57%	0.574	44%	0.444	S	S	*	.	H	α-helix	trans	-61.9	-21.2	169.9	-69.8	-166.1	170.8	-160.2	0	113.9	H420 H426	H420-K422 VanDerWaalsContact C-N 3.26Å; H420-K422 PolarHBondContact O-N 3.2Å; K422-H426 PolarHBondContact O-CD2 3.45Å; K422-H426 PolarHBondContact O-N 2.66Å
423	V	67.3	Low	67.6	Low	14 Å²	14	89.7 Å²	89.7	9%	0.085	44%	0.442	C	S	.	.	H	α-helix	trans	-68.4	-45.7	175.4	178.9	0	0	0	0	110.4	H420 M421 Q425 H426 Q427	H420-V423 WeakPolarHBondContact O-CB 3.28Å; H420-V423 WeakPolarHBondContact O-CG2 3.42Å; H420-V423 PolarHBondContact O-N 3.41Å; M421-V423 PolarHBondContact O-N 2.91Å; V423-Q425 VanDerWaalsContact C-N 3.31Å; V423-Q425 PolarHBondContact O-N 3.46Å; V423-H426 PolarHBondContact O-N 3.32Å; V423-H426 VanDerWaalsContact O-N 3.1Å; V423-Q427 PolarHBondContact O-N 2.64Å; V423-Q427 VanDerWaalsContact O-N 3.08Å
424	H	67.8	Low	67.2	Low	22 Å²	22	91 Å²	91	10%	0.102	45%	0.452	C	S	.	.	H	α-helix	trans	-62.4	-41.1	178.9	-65.4	-82.4	0	0	0	111.3	C404 L406 C407 H420 M421 H426 Q427 D428	C404-H424 PolarHBondContact SG-NE2 2.83Å; L406-H424 HydrophobicContact CD1-CB 3.56Å; L406-H424 PolarHBondContact O-CE1 2.71Å; C407-H424 WeakPolarHBondContact CB-CE1 3.48Å; C407-H424 PolarHBondContact SG-CE1 2.57Å; C407-H424 PolarHBondContact SG-NE2 3.03Å; H420-H424 AromaticContact CD2-NE2 3.01Å; H420-H424 PolarHBondContact CD2-NE2 2.77Å; H420-H424 AromaticContact CE1-NE2 2.82Å; H420-H424 PolarHBondContact CE1-NE2 2.91Å; H420-H424 AromaticContact CG-NE2 3.96Å; H420-H424 AromaticContact ND1-NE2 3.86Å; H420-H424 AromaticContact NE2-CD2 3.7Å; H420-H424 AromaticContact NE2-NE2 2.07Å; H420-H424 PolarHBondContact NE2-NE2 2.78Å; M421-H424 PolarHBondContact O-N 3.35Å; H424-H426 PolarHBondContact O-N 3.49Å; H424-Q427 WeakPolarHBondContact O-CA 3.43Å; H424-Q427 WeakPolarHBondContact O-CB 3.38Å; H424-Q427 PolarHBondContact O-N 3.36Å; H424-D428 PolarHBondContact O-N 2.9Å; H424-D428 VanDerWaalsContact O-OD2 3.14Å
425	Q	62.7	Low	67.3	Low	139 Å²	139	83.8 Å²	83.8	65%	0.65	42%	0.421	S	S	*	.	H	α-helix	trans	-61.2	-16.6	175.1	-166.8	166.5	34.9	0	0	114.9	M421 V423	M421-Q425 PolarHBondContact O-N 2.75Å; V423-Q425 VanDerWaalsContact C-N 3.31Å; V423-Q425 PolarHBondContact O-N 3.46Å
426	H	55.9	Low	67	Low	98 Å²	98	88.8 Å²	88.8	45%	0.454	44%	0.441	S	S	.	.	H	α-helix	trans	-101.6	-11	169	-69.9	-63	0	0	0	113.5	K422 V423 H424	K422-H426 PolarHBondContact O-CD2 3.45Å; K422-H426 PolarHBondContact O-N 2.66Å; V423-H426 PolarHBondContact O-N 3.32Å; V423-H426 VanDerWaalsContact O-N 3.1Å; H424-H426 PolarHBondContact O-N 3.49Å
427	Q	52.5	Low	66.7	Low	107 Å²	107	90 Å²	90	50%	0.5	45%	0.447	S	S	.	.	H	α-helix	trans	-89.7	-36.3	179	-171.4	171.2	-27.9	0	0	111.7	V423 H424 R429 G430	V423-Q427 PolarHBondContact O-N 2.64Å; V423-Q427 VanDerWaalsContact O-N 3.08Å; H424-Q427 WeakPolarHBondContact O-CA 3.43Å; H424-Q427 WeakPolarHBondContact O-CB 3.38Å; H424-Q427 PolarHBondContact O-N 3.36Å; Q427-R429 PolarHBondContact O-N 2.25Å; Q427-R429 VanDerWaalsContact O-N 3.09Å; Q427-G430 PolarHBondContact O-N 3.23Å
428	D	52.1	Low	66.2	Low	131 Å²	131	90.8 Å²	90.8	70%	0.701	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-7.1	179.4	-66.8	-45.3	0	0	0	114.4	H424	H424-D428 PolarHBondContact O-N 2.9Å; H424-D428 VanDerWaalsContact O-OD2 3.14Å
429	R	49.7	Very low	65.6	Low	172 Å²	172	89 Å²	89	65%	0.649	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-10.1	178	-71.3	-166.6	170.8	-153.9	-5.7	115	Q427 E431	Q427-R429 PolarHBondContact O-N 2.25Å; Q427-R429 VanDerWaalsContact O-N 3.09Å; R429-E431 HydrophobicContact CB-CB 4.29Å; R429-E431 HydrophobicContact CB-CG 4.07Å; R429-E431 WeakPolarHBondContact CD-OE2 3.48Å; R429-E431 IonicContact NH1-OE1 3.26Å; R429-E431 IonicContact NH1-OE2 3.32Å; R429-E431 PolarHBondContact O-N 2.9Å
430	G	50.8	Low	65.1	Low	61 Å²	61	89 Å²	89	63%	0.629	45%	0.449	S	S	*	.			trans	69.1	-16	-173.3	0	0	0	0	0	115.5	Q427 T432	Q427-G430 PolarHBondContact O-N 3.23Å; G430-T432 VanDerWaalsContact C-N 3.32Å; G430-T432 PolarHBondContact O-N 3.12Å
431	E	54.6	Low	64.4	Low	110 Å²	110	91.2 Å²	91.2	51%	0.514	47%	0.465	S	S	.	.			trans	-59.6	78.3	176.3	-66.7	166.4	172.6	0	0	112.6	R429 F433	R429-E431 HydrophobicContact CB-CB 4.29Å; R429-E431 HydrophobicContact CB-CG 4.07Å; R429-E431 WeakPolarHBondContact CD-OE2 3.48Å; R429-E431 IonicContact NH1-OE1 3.26Å; R429-E431 IonicContact NH1-OE2 3.32Å; R429-E431 PolarHBondContact O-N 2.9Å; E431-F433 PolarHBondContact O-N 3.49Å
432	T	60.6	Low	64.3	Low	78 Å²	78	89.4 Å²	89.4	48%	0.479	46%	0.458	S	S	.	.			trans	-76.2	121.5	169.2	57.2	0	0	0	0	110.4	G430 Q434	G430-T432 VanDerWaalsContact C-N 3.32Å; G430-T432 PolarHBondContact O-N 3.12Å; T432-Q434 PolarHBondContact O-N 3.45Å
433	F	68.3	Low	63.9	Low	69 Å²	69	85.2 Å²	85.2	30%	0.303	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	95.8	170.6	-59.3	-87.6	0	0	0	109.4	E431 S442 H445 L448	E431-F433 PolarHBondContact O-N 3.49Å; F433-S442 WeakPolarHBondContact CA-O 3.32Å; F433-S442 WeakPolarHBondContact CB-O 3.23Å; F433-S442 WeakPolarHBondContact CD2-O 3.33Å; F433-S442 PolarHBondContact N-O 3.01Å; F433-S442 PolarHBondContact O-N 3.46Å; F433-H445 HydrophobicContact CD1-CB 4.07Å; F433-H445 HydrophobicContact CD2-CB 4.33Å; F433-H445 VanDerWaalsContact CD2-N 3.35Å; F433-H445 HydrophobicContact CE1-CB 3.86Å; F433-H445 HydrophobicContact CE2-CB 4.14Å; F433-H445 HydrophobicContact CG-CB 4.31Å; F433-H445 HydrophobicContact CZ-CB 3.91Å; F433-L448 HydrophobicContact CB-CB 4.09Å; F433-L448 HydrophobicContact CB-CD2 3.79Å
434	Q	64.6	Low	63.9	Low	120 Å²	120	90.1 Å²	90.1	56%	0.561	46%	0.462	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.9	149.1	174.2	-175.7	166.2	-12.7	0	0	111	T432 T441 L448	T432-Q434 PolarHBondContact O-N 3.45Å; Q434-T441 HydrophobicContact CB-CG2 4.11Å; Q434-T441 HydrophobicContact CG-CG2 4.04Å; Q434-L448 WeakPolarHBondContact O-CD2 3.15Å
435	C	77.8	Confident	63.9	Low	2 Å²	2	94.3 Å²	94.3	1%	0.014	48%	0.482	C	S	.	.			trans	-85.5	131.2	166.2	-174.3	0	0	0	0	110.5	L437 F440 L448 H451 M452 H455	C435-L437 PolarHBondContact O-N 2.93Å; C435-L437 PolarHBondContact SG-N 3.27Å; C435-L437 VanDerWaalsContact SG-N 3.39Å; C435-F440 HydrophobicContact CB-CB 4.34Å; C435-F440 PolarHBondContact N-O 3.03Å; C435-L448 HydrophobicContact CB-CD1 3.76Å; C435-H451 VanDerWaalsContact SG-CD2 3.6Å; C435-M452 HydrophobicContact CB-SD 4.41Å; C435-M452 PolarHBondContact SG-SD 3.1Å; C435-H455 PolarHBondContact SG-NE2 3.33Å
436	E	70.8	Confident	64.3	Low	192 Å²	192	95 Å²	95	90%	0.897	48%	0.483	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-17.9	175.8	-66.7	159.7	-175.2	0	0	112.7
437	L	71.5	Confident	65.1	Low	98 Å²	98	92.2 Å²	92.2	51%	0.513	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-9.2	-174.1	-60.5	178.5	0	0	0	114.3	C435 M452 H455	C435-L437 PolarHBondContact O-N 2.93Å; C435-L437 PolarHBondContact SG-N 3.27Å; C435-L437 VanDerWaalsContact SG-N 3.39Å; L437-M452 HydrophobicContact CD1-CE 3.91Å; L437-M452 HydrophobicContact CG-CE 4.39Å; L437-H455 HydrophobicContact CD1-CB 3.74Å
438	C	71.6	Confident	66.2	Low	46 Å²	46	88.2 Å²	88.2	31%	0.311	46%	0.456	S	S	.	.	S	Bend	trans	-165.4	164.1	171.5	79.1	0	0	0	0	110.9	F440 H451	C438-F440 PolarHBondContact O-N 2.71Å; C438-H451 PolarHBondContact SG-CE1 3.44Å; C438-H451 PolarHBondContact SG-NE2 3.37Å
439	P	69.2	Low	67.4	Low	121 Å²	121	88.7 Å²	88.7	79%	0.786	45%	0.452	S	S	*	.	S	Bend	trans	-70.9	23.9	-175.1	30.2	-37.2	0	0	0	115.6	T441	P439-T441 PolarHBondContact O-N 2.89Å
440	F	67.3	Low	68.5	Low	75 Å²	75	84.7 Å²	84.7	33%	0.329	44%	0.443	S	S	.	.			trans	-76.3	112.1	175.1	179.5	-99.4	0	0	0	111.2	C435 C438 H451	C435-F440 HydrophobicContact CB-CB 4.34Å; C435-F440 PolarHBondContact N-O 3.03Å; C438-F440 PolarHBondContact O-N 2.71Å; F440-H451 WeakPolarHBondContact CB-CE1 3.25Å; F440-H451 HydrophobicContact CD1-CB 3.84Å; F440-H451 AromaticContact CD1-CD2 3.79Å; F440-H451 AromaticContact CD1-CE1 3.71Å; F440-H451 AromaticContact CD1-CG 3.37Å; F440-H451 AromaticContact CD1-ND1 3.32Å; F440-H451 VanDerWaalsContact CD1-ND1 3.32Å; F440-H451 WeakPolarHBondContact CD1-ND1 3.15Å; F440-H451 AromaticContact CD1-NE2 4Å; F440-H451 AromaticContact CD2-ND1 3.9Å; F440-H451 HydrophobicContact CE1-CB 3.61Å; F440-H451 AromaticContact CE1-CG 3.66Å; F440-H451 AromaticContact CE1-ND1 3.73Å; F440-H451 AromaticContact CG-CE1 3.49Å; F440-H451 VanDerWaalsContact CG-CE1 3.49Å; F440-H451 WeakPolarHBondContact CG-CE1 3.25Å; F440-H451 AromaticContact CG-CG 3.95Å; F440-H451 AromaticContact CG-ND1 3.41Å; F440-H451 WeakPolarHBondContact CG-ND1 3.19Å; F440-H451 HydrophobicContact CZ-CB 4.37Å
441	T	66.6	Low	69.7	Low	74 Å²	74	83.1 Å²	83.1	45%	0.454	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	146.3	170.4	57	0	0	0	0	111.2	Q434 P439	Q434-T441 HydrophobicContact CB-CG2 4.11Å; Q434-T441 HydrophobicContact CG-CG2 4.04Å; P439-T441 PolarHBondContact O-N 2.89Å
442	S	73	Confident	70.5	Confident	16 Å²	16	80.9 Å²	80.9	11%	0.112	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	129.3	-178.4	-143.5	0	0	0	0	112.7	F433 R444 S447	F433-S442 WeakPolarHBondContact CA-O 3.32Å; F433-S442 WeakPolarHBondContact CB-O 3.23Å; F433-S442 WeakPolarHBondContact CD2-O 3.33Å; F433-S442 PolarHBondContact N-O 3.01Å; F433-S442 PolarHBondContact O-N 3.46Å; S442-R444 PolarHBondContact O-N 3.35Å; S442-S447 WeakPolarHBondContact OG-CB 3.34Å
443	S	66.6	Low	71.3	Confident	44 Å²	44	82.7 Å²	82.7	31%	0.308	41%	0.408	S	S	.	.	S	Bend	trans	-73	11.5	174.9	56.7	0	0	0	0	114.5
444	R	67.8	Low	71.4	Confident	117 Å²	117	82.5 Å²	82.5	44%	0.442	41%	0.414	S	S	.	.			trans	-148.7	124.8	-179.8	-54.1	-178.3	-153.6	176	8.6	112.2	S442 F446 S447 L448	S442-R444 PolarHBondContact O-N 3.35Å; R444-F446 PolarHBondContact O-N 3.47Å; R444-F446 VanDerWaalsContact O-N 3.17Å; R444-S447 WeakPolarHBondContact O-CA 3.25Å; R444-S447 WeakPolarHBondContact O-CB 3.38Å; R444-S447 PolarHBondContact O-N 3.35Å; R444-L448 PolarHBondContact O-N 3.4Å; R444-L448 VanDerWaalsContact O-N 3.1Å
445	H	68.2	Low	71.6	Confident	111 Å²	111	78.6 Å²	78.6	51%	0.514	40%	0.396	S	S	.	.	H	α-helix	trans	-54.5	-34.6	174.3	-178.9	-136.2	0	0	0	114	F433 S447 L448 K449	F433-H445 HydrophobicContact CD1-CB 4.07Å; F433-H445 HydrophobicContact CD2-CB 4.33Å; F433-H445 VanDerWaalsContact CD2-N 3.35Å; F433-H445 HydrophobicContact CE1-CB 3.86Å; F433-H445 HydrophobicContact CE2-CB 4.14Å; F433-H445 HydrophobicContact CG-CB 4.31Å; F433-H445 HydrophobicContact CZ-CB 3.91Å; H445-S447 VanDerWaalsContact C-N 3.33Å; H445-S447 PolarHBondContact O-N 3.13Å; H445-L448 PolarHBondContact O-N 2.83Å; H445-K449 WeakPolarHBondContact O-CB 3.46Å; H445-K449 PolarHBondContact O-N 3.27Å
446	F	70.1	Confident	70.8	Confident	153 Å²	153	85.5 Å²	85.5	67%	0.671	43%	0.428	S	S	*	.	H	α-helix	trans	-63.4	-37.8	173.9	177.6	-92.8	0	0	0	112.9	R444 K449 L450	R444-F446 PolarHBondContact O-N 3.47Å; R444-F446 VanDerWaalsContact O-N 3.17Å; F446-K449 PolarHBondContact O-N 3.41Å; F446-L450 PolarHBondContact O-N 3.34Å
447	S	72.8	Confident	69.9	Low	39 Å²	39	84.2 Å²	84.2	27%	0.273	42%	0.422	S	S	.	.	H	α-helix	trans	-72	-37.5	177.9	-70.3	0	0	0	0	111.1	S442 R444 H445 L450 H451	S442-S447 WeakPolarHBondContact OG-CB 3.34Å; R444-S447 WeakPolarHBondContact O-CA 3.25Å; R444-S447 WeakPolarHBondContact O-CB 3.38Å; R444-S447 PolarHBondContact O-N 3.35Å; H445-S447 VanDerWaalsContact C-N 3.33Å; H445-S447 PolarHBondContact O-N 3.13Å; S447-L450 PolarHBondContact O-N 3.1Å; S447-H451 WeakPolarHBondContact O-CB 3.45Å; S447-H451 PolarHBondContact O-N 3.44Å
448	L	77.1	Confident	68.3	Low	24 Å²	24	85 Å²	85	13%	0.126	42%	0.421	C	S	.	.	H	α-helix	trans	-62.2	-46.5	167.5	-177.4	61.7	0	0	0	111.4	F433 Q434 C435 R444 H445 L450 H451 M452	F433-L448 HydrophobicContact CB-CB 4.09Å; F433-L448 HydrophobicContact CB-CD2 3.79Å; Q434-L448 WeakPolarHBondContact O-CD2 3.15Å; C435-L448 HydrophobicContact CB-CD1 3.76Å; R444-L448 PolarHBondContact O-N 3.4Å; R444-L448 VanDerWaalsContact O-N 3.1Å; H445-L448 PolarHBondContact O-N 2.83Å; L448-L450 PolarHBondContact O-N 3.41Å; L448-H451 CarbonylContact O-C 3.58Å; L448-H451 WeakPolarHBondContact O-CA 3.38Å; L448-H451 WeakPolarHBondContact O-CB 3.47Å; L448-H451 PolarHBondContact O-N 3.32Å; L448-M452 HydrophobicContact CD1-CG 4.27Å; L448-M452 HydrophobicContact CD1-SD 3.75Å; L448-M452 HydrophobicContact CG-CG 4.22Å; L448-M452 HydrophobicContact CG-SD 4.29Å; L448-M452 WeakPolarHBondContact O-CG 3.5Å; L448-M452 PolarHBondContact O-N 3.16Å
449	K	76.9	Confident	66.8	Low	140 Å²	140	88.4 Å²	88.4	61%	0.609	44%	0.443	S	S	*	.	H	α-helix	trans	-68.6	-15.3	178.5	-168.3	162.1	-175.4	165.4	0	114.4	H445 F446 R453	H445-K449 WeakPolarHBondContact O-CB 3.46Å; H445-K449 PolarHBondContact O-N 3.27Å; F446-K449 PolarHBondContact O-N 3.41Å; K449-R453 PolarHBondContact O-NE 3.25Å
450	L	72.1	Confident	65.2	Low	88 Å²	88	92.1 Å²	92.1	46%	0.461	44%	0.441	S	S	.	.	H	α-helix	trans	-80.6	-43.3	164.2	177.3	60.3	0	0	0	111.1	F446 S447 L448 R453	F446-L450 PolarHBondContact O-N 3.34Å; S447-L450 PolarHBondContact O-N 3.1Å; L448-L450 PolarHBondContact O-N 3.41Å; L450-R453 WeakPolarHBondContact O-CB 3.44Å; L450-R453 PolarHBondContact O-N 2.97Å
451	H	76.4	Confident	63.8	Low	29 Å²	29	94.6 Å²	94.6	13%	0.134	46%	0.462	C	S	.	.	H	α-helix	trans	-62.7	-37.7	175.1	179.2	93.3	0	0	0	113	C435 C438 F440 S447 L448 R453 C454 H455	C435-H451 VanDerWaalsContact SG-CD2 3.6Å; C438-H451 PolarHBondContact SG-CE1 3.44Å; C438-H451 PolarHBondContact SG-NE2 3.37Å; F440-H451 WeakPolarHBondContact CB-CE1 3.25Å; F440-H451 HydrophobicContact CD1-CB 3.84Å; F440-H451 AromaticContact CD1-CD2 3.79Å; F440-H451 AromaticContact CD1-CE1 3.71Å; F440-H451 AromaticContact CD1-CG 3.37Å; F440-H451 AromaticContact CD1-ND1 3.32Å; F440-H451 VanDerWaalsContact CD1-ND1 3.32Å; F440-H451 WeakPolarHBondContact CD1-ND1 3.15Å; F440-H451 AromaticContact CD1-NE2 4Å; F440-H451 AromaticContact CD2-ND1 3.9Å; F440-H451 HydrophobicContact CE1-CB 3.61Å; F440-H451 AromaticContact CE1-CG 3.66Å; F440-H451 AromaticContact CE1-ND1 3.73Å; F440-H451 AromaticContact CG-CE1 3.49Å; F440-H451 VanDerWaalsContact CG-CE1 3.49Å; F440-H451 WeakPolarHBondContact CG-CE1 3.25Å; F440-H451 AromaticContact CG-CG 3.95Å; F440-H451 AromaticContact CG-ND1 3.41Å; F440-H451 WeakPolarHBondContact CG-ND1 3.19Å; F440-H451 HydrophobicContact CZ-CB 4.37Å; S447-H451 WeakPolarHBondContact O-CB 3.45Å; S447-H451 PolarHBondContact O-N 3.44Å; L448-H451 CarbonylContact O-C 3.58Å; L448-H451 WeakPolarHBondContact O-CA 3.38Å; L448-H451 WeakPolarHBondContact O-CB 3.47Å; L448-H451 PolarHBondContact O-N 3.32Å; H451-R453 PolarHBondContact O-N 2.87Å; H451-R453 VanDerWaalsContact O-N 3.17Å; H451-C454 WeakPolarHBondContact O-CA 3.37Å; H451-C454 WeakPolarHBondContact O-CB 3.49Å; H451-C454 PolarHBondContact O-N 2.86Å; H451-H455 AromaticContact CD2-CD2 3.73Å; H451-H455 AromaticContact CD2-NE2 3.55Å; H451-H455 AromaticContact CE1-NE2 3.96Å; H451-H455 AromaticContact NE2-CD2 3.63Å; H451-H455 AromaticContact NE2-NE2 2.96Å; H451-H455 PolarHBondContact NE2-NE2 3.49Å
452	M	71.3	Confident	62.2	Low	63 Å²	63	97.1 Å²	97.1	31%	0.31	47%	0.473	S	S	.	.	H	α-helix	trans	-62.9	-22.8	175.1	-61.2	-40.4	-67.9	0	0	112.8	C435 L437 L448 C454 H455 Q456	C435-M452 HydrophobicContact CB-SD 4.41Å; C435-M452 PolarHBondContact SG-SD 3.1Å; L437-M452 HydrophobicContact CD1-CE 3.91Å; L437-M452 HydrophobicContact CG-CE 4.39Å; L448-M452 HydrophobicContact CD1-CG 4.27Å; L448-M452 HydrophobicContact CD1-SD 3.75Å; L448-M452 HydrophobicContact CG-CG 4.22Å; L448-M452 HydrophobicContact CG-SD 4.29Å; L448-M452 WeakPolarHBondContact O-CG 3.5Å; L448-M452 PolarHBondContact O-N 3.16Å; M452-C454 VanDerWaalsContact C-N 3.3Å; M452-H455 PolarHBondContact O-N 3.01Å; M452-Q456 WeakPolarHBondContact O-CB 3.16Å; M452-Q456 PolarHBondContact O-N 3.25Å
453	R	78.4	Confident	60.3	Low	116 Å²	116	101.9 Å²	101.9	44%	0.438	50%	0.501	S	S	.	.	H	α-helix	trans	-75.6	-15	169.8	-84.3	175.3	-69.5	141.2	-5.7	113.9	K449 L450 H451 H457	K449-R453 PolarHBondContact O-NE 3.25Å; L450-R453 WeakPolarHBondContact O-CB 3.44Å; L450-R453 PolarHBondContact O-N 2.97Å; H451-R453 PolarHBondContact O-N 2.87Å; H451-R453 VanDerWaalsContact O-N 3.17Å; R453-H457 PolarHBondContact O-CD2 3.09Å
454	C	68.4	Low	58.7	Low	64 Å²	64	109 Å²	109	43%	0.432	53%	0.527	S	S	.	.	H	α-helix	trans	-71.7	-34.8	165.3	-56.8	0	0	0	0	110.9	H451 M452 F458	H451-C454 WeakPolarHBondContact O-CA 3.37Å; H451-C454 WeakPolarHBondContact O-CB 3.49Å; H451-C454 PolarHBondContact O-N 2.86Å; M452-C454 VanDerWaalsContact C-N 3.3Å; C454-F458 VanDerWaalsContact O-CD2 3.29Å; C454-F458 WeakPolarHBondContact O-CD2 3.41Å; C454-F458 VanDerWaalsContact O-CE2 3.32Å; C454-F458 WeakPolarHBondContact O-CE2 3.41Å
455	H	70.6	Confident	56.9	Low	38 Å²	38	108.3 Å²	108.3	18%	0.176	54%	0.535	C	S	.	.	H	α-helix	trans	-75.2	-35.3	171.6	-63.6	-64.7	0	0	0	112.7	C435 L437 H451 M452 H457 F458	C435-H455 PolarHBondContact SG-NE2 3.33Å; L437-H455 HydrophobicContact CD1-CB 3.74Å; H451-H455 AromaticContact CD2-CD2 3.73Å; H451-H455 AromaticContact CD2-NE2 3.55Å; H451-H455 AromaticContact CE1-NE2 3.96Å; H451-H455 AromaticContact NE2-CD2 3.63Å; H451-H455 AromaticContact NE2-NE2 2.96Å; H451-H455 PolarHBondContact NE2-NE2 3.49Å; M452-H455 PolarHBondContact O-N 3.01Å; H455-H457 PolarHBondContact O-N 3.07Å; H455-F458 WeakPolarHBondContact O-CB 3.46Å; H455-F458 PolarHBondContact O-N 2.84Å
456	Q	60.6	Low	55.1	Low	148 Å²	148	109.9 Å²	109.9	69%	0.692	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-7.7	-178.6	-158.3	169.2	25.7	0	0	115.1	M452	M452-Q456 WeakPolarHBondContact O-CB 3.16Å; M452-Q456 PolarHBondContact O-N 3.25Å
457	H	51.3	Low	53.3	Low	165 Å²	165	111 Å²	111	76%	0.764	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.9	3.4	168.7	-78.3	-62.6	0	0	0	114	R453 H455	R453-H457 PolarHBondContact O-CD2 3.09Å; H455-H457 PolarHBondContact O-N 3.07Å
458	F	38.7	Very low	51.2	Low	114 Å²	114	115.3 Å²	115.3	50%	0.5	56%	0.563	S	S	.	*			trans	-109.1	100.1	165.5	-60.2	-90.1	0	0	0	108.5	C454 H455 R460 M1047	C454-F458 VanDerWaalsContact O-CD2 3.29Å; C454-F458 WeakPolarHBondContact O-CD2 3.41Å; C454-F458 VanDerWaalsContact O-CE2 3.32Å; C454-F458 WeakPolarHBondContact O-CE2 3.41Å; H455-F458 WeakPolarHBondContact O-CB 3.46Å; H455-F458 PolarHBondContact O-N 2.84Å; F458-R460 PolarHBondContact O-N 3.29Å; F458-M1047 HydrophobicContact CE1-CE 4.19Å; F458-M1047 HydrophobicContact CE1-SD 3.96Å; F458-M1047 HydrophobicContact CZ-CE 3.73Å; F458-M1047 HydrophobicContact CZ-CG 4.48Å; F458-M1047 HydrophobicContact CZ-SD 3.74Å
459	P	40.4	Very low	49.2	Very low	118 Å²	118	120.2 Å²	120.2	77%	0.766	60%	0.597	S	S	*	*			trans	-61	133.1	156.9	28.3	-32.2	0	0	0	107.7
460	R	34.1	Very low	46.6	Very low	198 Å²	198	119.9 Å²	119.9	75%	0.747	61%	0.607	S	S	*	*			trans	-66	136.1	159.9	-86.7	-166.2	171.8	-156.5	0.5	107.8	F458 D462	F458-R460 PolarHBondContact O-N 3.29Å; R460-D462 PolarHBondContact O-N 3.32Å; R460-D462 VanDerWaalsContact O-N 3.11Å
461	T	37.5	Very low	44.5	Very low	127 Å²	127	121.6 Å²	121.6	78%	0.779	62%	0.621	S	S	*	*			trans	-76.3	85.5	157.2	48.7	0	0	0	0	107	V463	T461-V463 PolarHBondContact O-N 3.32Å
462	D	32.9	Very low	42.3	Very low	128 Å²	128	127.4 Å²	127.4	68%	0.684	65%	0.653	S	S	*	*			trans	-70.2	88.4	167.8	-65.5	-45.3	0	0	0	107.5	R460 K464	R460-D462 PolarHBondContact O-N 3.32Å; R460-D462 VanDerWaalsContact O-N 3.11Å; D462-K464 VanDerWaalsContact C-N 3.28Å; D462-K464 PolarHBondContact O-N 2.93Å
463	V	34	Very low	40.5	Very low	115 Å²	115	129.6 Å²	129.6	70%	0.697	67%	0.67	S	S	*	*			trans	-68.3	93.2	174.2	-176.2	0	0	0	0	106.9	T461 V465	T461-V463 PolarHBondContact O-N 3.32Å; V463-V465 HydrophobicContact CG1-CG2 3.88Å; V463-V465 PolarHBondContact O-N 3.09Å
464	K	33.6	Very low	38.6	Very low	194 Å²	194	133.3 Å²	133.3	84%	0.843	69%	0.692	S	S	*	*			trans	-70.1	77	173.3	-172.2	174.3	-179.5	174.9	0	109.3	D462 K466	D462-K464 VanDerWaalsContact C-N 3.28Å; D462-K464 PolarHBondContact O-N 2.93Å; K464-K466 PolarHBondContact O-N 2.79Å
465	V	29.6	Very low	37	Very low	102 Å²	102	134 Å²	134	62%	0.618	71%	0.711	S	S	*	*			trans	-62.7	105.6	165.8	-179.1	0	0	0	0	106.9	V463 E467	V463-V465 HydrophobicContact CG1-CG2 3.88Å; V463-V465 PolarHBondContact O-N 3.09Å; V465-E467 VanDerWaalsContact C-N 3.33Å; V465-E467 HydrophobicContact CG1-CG 3.9Å; V465-E467 PolarHBondContact O-N 2.96Å
466	K	31	Very low	35.3	Very low	145 Å²	145	142.1 Å²	142.1	63%	0.63	75%	0.748	S	S	*	*			trans	-86.7	81.2	166.2	-166.2	-157.5	-169.8	-156	0	107.7	K464 E468	K464-K466 PolarHBondContact O-N 2.79Å; K466-E468 WeakPolarHBondContact CE-OE1 3.49Å; K466-E468 WeakPolarHBondContact CE-OE2 3.31Å; K466-E468 IonicContact NZ-OE1 2.61Å; K466-E468 PolarHBondContact NZ-OE1 3.35Å; K466-E468 IonicContact NZ-OE2 2.68Å; K466-E468 PolarHBondContact NZ-OE2 2.78Å; K466-E468 PolarHBondContact O-N 3.38Å
467	E	32.2	Very low	33.9	Very low	176 Å²	176	138.7 Å²	138.7	82%	0.822	75%	0.753	S	S	*	*			trans	-72.5	110.6	158.3	-86.8	177.2	160.5	0	0	107.8	V465	V465-E467 VanDerWaalsContact C-N 3.33Å; V465-E467 HydrophobicContact CG1-CG 3.9Å; V465-E467 PolarHBondContact O-N 2.96Å
468	E	28.7	Very low	33	Very low	129 Å²	129	136 Å²	136	60%	0.603	75%	0.753	S	S	*	*			trans	-110.2	133.2	154.8	-94.4	173	-172.8	0	0	107.3	K466	K466-E468 WeakPolarHBondContact CE-OE1 3.49Å; K466-E468 WeakPolarHBondContact CE-OE2 3.31Å; K466-E468 IonicContact NZ-OE1 2.61Å; K466-E468 PolarHBondContact NZ-OE1 3.35Å; K466-E468 IonicContact NZ-OE2 2.68Å; K466-E468 PolarHBondContact NZ-OE2 2.78Å; K466-E468 PolarHBondContact O-N 3.38Å
469	P	33.4	Very low	32.6	Very low	127 Å²	127	137.5 Å²	137.5	83%	0.825	77%	0.765	S	S	*	*			trans	-79.9	136.9	-179.3	32	-33.6	0	0	0	110.9
470	T	24.1	Very low	32.3	Very low	134 Å²	134	140 Å²	140	82%	0.822	77%	0.771	S	S	*	*			trans	-132.9	108.1	166.8	56.9	0	0	0	0	110.4
471	T	27.8	Very low	32.1	Very low	124 Å²	124	134.4 Å²	134.4	76%	0.761	78%	0.775	S	S	*	*			trans	-126	97.7	158.8	51.2	0	0	0	0	107.2
472	D	29.1	Very low	31.7	Very low	150 Å²	150	136.9 Å²	136.9	80%	0.802	78%	0.784	S	S	*	*			trans	63.5	152.5	160.1	-42.7	-55.4	0	0	0	116
473	T	34.6	Very low	31.5	Very low	109 Å²	109	134.5 Å²	134.5	67%	0.669	79%	0.79	S	S	*	*			cis	-157.9	141.9	33.3	-55	0	0	0	0	110.3
474	E	37.6	Very low	31.3	Very low	194 Å²	194	134.1 Å²	134.1	91%	0.907	79%	0.792	S	S	*	*			trans	58.8	141	159.9	-71.8	165	-169.1	0	0	121.2
475	G	34.7	Very low	31.1	Very low	79 Å²	79	130.8 Å²	130.8	81%	0.814	79%	0.788	S	S	*	*			trans	152.2	108.3	168	0	0	0	0	0	115.2
476	E	35	Very low	31.1	Very low	208 Å²	208	132.1 Å²	132.1	97%	0.972	79%	0.792	S	S	*	*			trans	-70.4	159.3	173.5	-63.3	-145.6	120.2	0	0	113.7
477	G	31.9	Very low	31.1	Very low	77 Å²	77	130.9 Å²	130.9	79%	0.794	79%	0.792	S	S	*	*			trans	158	75.8	160.5	0	0	0	0	0	119.8
478	S	31.4	Very low	31.3	Very low	107 Å²	107	128.5 Å²	128.5	75%	0.748	78%	0.784	S	S	*	*			trans	6.7	128.5	148.5	-67.4	0	0	0	0	123.3
479	L	31.2	Very low	31.6	Very low	146 Å²	146	132.6 Å²	132.6	76%	0.764	79%	0.794	S	S	*	*				74.8	115.8	129.3	-60.3	170.8	0	0	0	123.1
480	L	34.8	Very low	31.5	Very low	171 Å²	171	131 Å²	131	90%	0.895	79%	0.792	S	S	*	*			trans	59.9	132.3	130.5	-56.1	175.8	0	0	0	122.3
481	G	28.8	Very low	31.8	Very low	80 Å²	80	128.7 Å²	128.7	83%	0.825	79%	0.786	S	S	*	*			trans	164.4	114.5	155.3	0	0	0	0	0	116
482	D	28.8	Very low	31.9	Very low	179 Å²	179	129.5 Å²	129.5	96%	0.957	78%	0.781	S	S	*	*			trans	-77.2	153.5	163.8	-77.8	-65.2	0	0	0	111.3
483	G	28.5	Very low	32.1	Very low	79 Å²	79	125.3 Å²	125.3	81%	0.814	77%	0.768	S	S	*	*			trans	-175.9	74.8	-178.6	0	0	0	0	0	118.4
484	S	30.3	Very low	31.8	Very low	106 Å²	106	123 Å²	123	74%	0.741	76%	0.756	S	S	*	*			trans	-36.2	152.9	169.5	-53.9	0	0	0	0	120.6
485	T	30.8	Very low	32.4	Very low	125 Å²	125	118.3 Å²	118.3	77%	0.767	74%	0.742	S	S	*	*			trans	80.3	135	134.1	44.9	0	0	0	0	124.7
486	N	29.4	Very low	32.1	Very low	129 Å²	129	120.3 Å²	120.3	69%	0.69	73%	0.734	S	S	*	*			trans	88.5	112.3	136.3	-78.4	43.9	0	0	0	124.1
487	D	29.8	Very low	31.9	Very low	119 Å²	119	117.7 Å²	117.7	64%	0.636	72%	0.721	S	S	*	*				92.8	134	119	-91.6	-45.6	0	0	0	124.7
488	L	37.1	Very low	31.8	Very low	127 Å²	127	117.8 Å²	117.8	67%	0.665	71%	0.714	S	S	*	*			trans	66.4	157.7	148.5	-59.2	164.7	0	0	0	119.6
489	R	33.9	Very low	31.6	Very low	215 Å²	215	121.8 Å²	121.8	81%	0.811	72%	0.721	S	S	*	*			cis	-173.2	148.7	-30.8	-176.9	-168.8	-78.7	-165.7	1.8	109.4
490	A	32.1	Very low	31.5	Very low	93 Å²	93	119 Å²	119	77%	0.769	72%	0.719	S	S	*	*			trans	69.9	159.5	156.7	0	0	0	0	0	118.2
491	A	31.1	Very low	31.2	Very low	86 Å²	86	119.5 Å²	119.5	71%	0.711	72%	0.717	S	S	*	*			cis	-167.7	160.3	-19.8	0	0	0	0	0	111.9
492	E	29	Very low	31.3	Very low	141 Å²	141	124.3 Å²	124.3	66%	0.659	72%	0.718	S	S	*	*			trans	25.7	148.9	143	-51.7	-68.6	100.6	0	0	122.8
493	A	33.9	Very low	31.3	Very low	62 Å²	62	124 Å²	124	51%	0.512	71%	0.711	S	S	.	*			cis	180	145.7	-19.2	0	0	0	0	0	113
494	S	27.3	Very low	31.1	Very low	61 Å²	61	125.9 Å²	125.9	43%	0.427	71%	0.707	S	S	.	*			trans	61.8	175.5	153.6	-57.6	0	0	0	0	120.5	A9	A9-S494 WeakPolarHBondContact CB-OG 3.46Å; A9-S494 PolarHBondContact N-OG 2.93Å; A9-S494 VanDerWaalsContact N-OG 3.15Å
495	P	49.9	Very low	31	Very low	94 Å²	94	126.4 Å²	126.4	61%	0.61	71%	0.71	S	S	*	*			cis	-118.8	-167.5	-18.8	21.9	4.5	0	0	0	112	N8	N8-P495 VanDerWaalsContact O-CA 3.31Å; N8-P495 WeakPolarHBondContact O-CA 3.4Å; N8-P495 WeakPolarHBondContact O-CB 3.27Å
496	L	29.4	Very low	31.4	Very low	122 Å²	122	125.9 Å²	125.9	64%	0.639	71%	0.709	S	S	*	*				-175.3	139.7	52.2	-83	169.5	0	0	0	114.9
497	Q	30.8	Very low	31.8	Very low	153 Å²	153	125 Å²	125	72%	0.715	71%	0.71	S	S	*	*				57.9	141.9	126.2	-144.3	175	-23.1	0	0	127.2
498	A	30.3	Very low	31.6	Very low	78 Å²	78	125.4 Å²	125.4	65%	0.645	71%	0.713	S	S	*	*			trans	69.3	117.6	154.2	0	0	0	0	0	120
499	E	26.6	Very low	31	Very low	191 Å²	191	127.7 Å²	127.7	89%	0.893	72%	0.72	S	S	*	*				93.7	105.9	59.7	-85.5	-165.7	113.1	0	0	115.2
500	A	29.8	Very low	30.6	Very low	88 Å²	88	122.3 Å²	122.3	73%	0.727	72%	0.721	S	S	*	*				167.2	119.4	127	0	0	0	0	0	116.7
501	Q	28.2	Very low	30.4	Very low	181 Å²	181	123.6 Å²	123.6	85%	0.846	73%	0.725	S	S	*	*			trans	66.4	154.1	139.6	-61.2	-172.9	-93.4	0	0	124.7
502	Q	31.2	Very low	30.1	Very low	181 Å²	181	123.9 Å²	123.9	85%	0.846	72%	0.722	S	S	*	*			trans	83.2	105.3	158.6	-76.5	176.3	14.6	0	0	122.7
503	Q	27.3	Very low	30	Very low	173 Å²	173	123.9 Å²	123.9	81%	0.808	73%	0.726	S	S	*	*			trans	-47.5	154.4	145.9	-62.6	165.9	-87.3	0	0	112.3
504	T	24.4	Very low	29.8	Very low	118 Å²	118	128.8 Å²	128.8	72%	0.724	74%	0.738	S	S	*	*			cis	-169.8	165.4	1.5	15.8	0	0	0	0	110.9
505	S	27.8	Very low	29.8	Very low	117 Å²	117	131.3 Å²	131.3	82%	0.818	75%	0.751	S	S	*	*			trans	88.2	163.8	153.8	91.3	0	0	0	0	116.5
506	P	40.4	Very low	28.6	Very low	114 Å²	114	134.4 Å²	134.4	74%	0.74	76%	0.757	S	S	*	*			trans	-126.6	-153.4	-137.2	49.5	-36.6	0	0	0	112.7
507	P	37	Very low	28.4	Very low	110 Å²	110	134.3 Å²	134.3	71%	0.714	76%	0.761	S	S	*	*			cis	-134.1	-179.7	-10.2	41.4	-23.2	0	0	0	116.6
508	N	25.3	Very low	28.1	Very low	129 Å²	129	135.5 Å²	135.5	69%	0.69	76%	0.764	S	S	*	*			trans	30.6	116.7	157.2	-80.6	52.1	0	0	0	124.2
509	E	26.2	Very low	28.1	Very low	174 Å²	174	138.7 Å²	138.7	81%	0.813	77%	0.765	S	S	*	*				73.2	159	120.3	-66.4	-170.6	127.6	0	0	123.9
510	A	24.7	Very low	28	Very low	102 Å²	102	137.7 Å²	137.7	84%	0.843	76%	0.761	S	S	*	*			trans	70.5	154.8	175.3	0	0	0	0	0	117
511	S	27.4	Very low	28.8	Very low	120 Å²	120	138.5 Å²	138.5	84%	0.839	76%	0.758	S	S	*	*			cis	-170.5	168.1	-29.2	-174.3	0	0	0	0	107.6
512	S	24.4	Very low	28.7	Very low	93 Å²	93	137.8 Å²	137.8	65%	0.65	76%	0.755	S	S	*	*			trans	-153.6	123.5	179.1	-173.7	0	0	0	0	107.7
513	N	28.5	Very low	28.5	Very low	140 Å²	140	135.3 Å²	135.3	75%	0.749	74%	0.743	S	S	*	*			cis	-152.2	142	22.3	-100.5	-36.4	0	0	0	113.6
514	H	28.9	Very low	28.7	Very low	166 Å²	166	137 Å²	137	77%	0.769	74%	0.742	S	S	*	*			trans	61.8	158.3	143.4	-109.5	-120.3	0	0	0	120.2
515	V	27.2	Very low	28.7	Very low	113 Å²	113	138.3 Å²	138.3	69%	0.685	75%	0.745	S	S	*	*			cis	-147.7	141	15.8	-162.8	0	0	0	0	112.8
516	H	26	Very low	28.8	Very low	160 Å²	160	139.8 Å²	139.8	74%	0.741	74%	0.743	S	S	*	*			trans	64.1	124.6	150.1	-85.6	-141.5	0	0	0	127
517	V	24.1	Very low	28.2	Very low	119 Å²	119	139.7 Å²	139.7	72%	0.721	75%	0.745	S	S	*	*				66.3	125.3	127.8	176.5	0	0	0	0	118.7
518	K	25.4	Very low	27.7	Very low	178 Å²	178	140.2 Å²	140.2	77%	0.774	75%	0.746	S	S	*	*			cis	-152.5	177.3	44	-160.2	165.6	175.6	-177.6	0	115.1
519	E	29	Very low	27.9	Very low	145 Å²	145	141.8 Å²	141.8	68%	0.678	75%	0.754	S	S	*	*			trans	-67.6	147.6	-170.5	-57.3	138.1	99.8	0	0	119.7
520	E	25.6	Very low	27.9	Very low	171 Å²	171	139 Å²	139	80%	0.799	75%	0.753	S	S	*	*			trans	50.6	162.9	134.8	-72.9	-149.5	99.6	0	0	124.4
521	P	45	Very low	29	Very low	104 Å²	104	138.7 Å²	138.7	68%	0.675	74%	0.742	S	S	*	*			cis	-130	179.3	-10.4	22	2.6	0	0	0	115.8
522	Q	26.9	Very low	29.2	Very low	167 Å²	167	142.4 Å²	142.4	78%	0.78	74%	0.744	S	S	*	*			trans	1.6	148.2	139.6	-135.1	172.3	-1.5	0	0	118.3
523	E	27.8	Very low	29.6	Very low	128 Å²	128	142.1 Å²	142.1	60%	0.598	74%	0.742	S	S	*	*			cis	-162.2	175.2	38.2	-28.9	-177.9	138.6	0	0	115.5
524	R	30.5	Very low	29.8	Very low	208 Å²	208	142.9 Å²	142.9	79%	0.785	74%	0.744	S	S	*	*			trans	73.9	108	144.5	-86.5	-173.2	-80.5	149.5	-5	124.8
525	D	25.4	Very low	29.6	Very low	146 Å²	146	141.2 Å²	141.2	78%	0.781	75%	0.75	S	S	*	*				85.8	167	114	-126.7	-28.3	0	0	0	123.1
526	L	29.4	Very low	29.8	Very low	149 Å²	149	146.1 Å²	146.1	78%	0.78	76%	0.756	S	S	*	*			trans	-106.2	146.7	-154.8	-59.7	160.9	0	0	0	114.9
527	S	28.6	Very low	29.8	Very low	112 Å²	112	144.8 Å²	144.8	78%	0.783	75%	0.754	S	S	*	*				161.9	131.2	122.4	-76.1	0	0	0	0	117.8
528	V	26.2	Very low	30.2	Very low	120 Å²	120	150.2 Å²	150.2	73%	0.727	76%	0.762	S	S	*	*			trans	58.1	100.2	131.2	-172.4	0	0	0	0	122.2
529	L	29.3	Very low	31.3	Very low	163 Å²	163	147.3 Å²	147.3	85%	0.853	76%	0.761	S	S	*	*			trans	59.5	154.6	131.8	-58.3	178.4	0	0	0	124.9
530	S	25.6	Very low	31.3	Very low	114 Å²	114	144 Å²	144	80%	0.797	77%	0.767	S	S	*	*			trans	100.3	159.5	148.2	-95.9	0	0	0	0	120.2
531	P	48.8	Very low	31.7	Very low	96 Å²	96	142 Å²	142	62%	0.623	77%	0.772	S	S	*	*				-143.2	177.5	-125	44.5	-25.1	0	0	0	119
532	F	31.1	Very low	31.1	Very low	198 Å²	198	141.9 Å²	141.9	87%	0.868	77%	0.773	S	S	*	*			trans	61.6	155.5	159.8	-66.8	-58.8	0	0	0	117.6
533	S	32.9	Very low	31.4	Very low	88 Å²	88	139.8 Å²	139.8	62%	0.615	77%	0.772	S	S	*	*			cis	-168.5	160.1	-1.6	-119.6	0	0	0	0	113.2
534	I	32.3	Very low	31.7	Very low	156 Å²	156	140.5 Å²	140.5	80%	0.8	78%	0.78	S	S	*	*			trans	67.4	127.1	147.9	-60.5	159.5	0	0	0	121.5
535	C	25.4	Very low	31.7	Very low	130 Å²	130	135.3 Å²	135.3	88%	0.878	78%	0.775	S	S	*	*				-168.6	-176.3	127.1	-131.4	0	0	0	0	114.1
536	R	30.8	Very low	32.5	Very low	216 Å²	216	135.7 Å²	135.7	82%	0.815	78%	0.776	S	S	*	*			trans	-154.5	162.6	-152.1	-164.5	-176.9	138.6	157.5	-0.1	117.2
537	D	26.6	Very low	32.4	Very low	132 Å²	132	135.5 Å²	135.5	71%	0.706	78%	0.776	S	S	*	*			trans	93.9	172.9	156.2	-79	-45.3	0	0	0	123.6
538	R	30.7	Very low	32.6	Very low	233 Å²	233	137.9 Å²	137.9	88%	0.879	78%	0.779	S	S	*	*			trans	-115.3	-166.6	-157.3	-135.9	-175	169	-162.6	-1.3	111.6
539	P	50.1	Low	34	Very low	117 Å²	117	138.1 Å²	138.1	76%	0.76	78%	0.783	S	S	*	*			cis	-137.6	-169.5	-17	43	-23	0	0	0	116.8
540	G	28.6	Very low	34.2	Very low	77 Å²	77	133.5 Å²	133.5	79%	0.794	78%	0.775	S	S	*	*			trans	179.7	166.1	171.4	0	0	0	0	0	117.1
541	S	34.5	Very low	34.6	Very low	129 Å²	129	135.6 Å²	135.6	90%	0.902	78%	0.783	S	S	*	*			trans	-169.9	156.4	-174.8	-178.1	0	0	0	0	117.6
542	S	30.9	Very low	33.7	Very low	100 Å²	100	134.5 Å²	134.5	70%	0.699	79%	0.789	S	S	*	*			trans	-175.7	132	160.4	56.4	0	0	0	0	120.1
543	T	34.9	Very low	33.6	Very low	124 Å²	124	133.6 Å²	133.6	76%	0.761	79%	0.791	S	S	*	*			trans	65.6	169.3	152.6	57.7	0	0	0	0	121.7
544	N	34	Very low	33.3	Very low	143 Å²	143	132.8 Å²	132.8	77%	0.765	80%	0.797	S	S	*	*			cis	-174.8	-174.9	-22.1	-92.4	13.9	0	0	0	108.6
545	S	30.3	Very low	33.1	Very low	99 Å²	99	132.7 Å²	132.7	69%	0.692	80%	0.803	S	S	*	*			cis	-178.8	171.4	-33.7	-70.3	0	0	0	0	108.1
546	L	41	Very low	33.2	Very low	153 Å²	153	130 Å²	130	80%	0.801	80%	0.797	S	S	*	*			cis	-167.4	-176.1	-4.7	-122.4	174	0	0	0	113
547	D	27.2	Very low	33	Very low	145 Å²	145	126.4 Å²	126.4	78%	0.775	79%	0.791	S	S	*	*			trans	83.5	154.4	157.3	-78.5	-55.6	0	0	0	127
548	L	34.3	Very low	33.2	Very low	163 Å²	163	130.2 Å²	130.2	85%	0.853	80%	0.795	S	S	*	*			trans	-155.5	-164.1	-167.5	-127.6	73.4	0	0	0	111.8
549	P	54.4	Low	33	Very low	124 Å²	124	124.3 Å²	124.3	81%	0.805	79%	0.79	S	S	*	*			cis	-128.1	-149.7	-11.7	46.2	-27	0	0	0	112.6
550	G	33.9	Very low	32.2	Very low	67 Å²	67	124.1 Å²	124.1	69%	0.691	79%	0.792	S	S	*	*			cis	161.7	153.6	-14.6	0	0	0	0	0	117.2
551	V	34.3	Very low	33.1	Very low	158 Å²	158	126.1 Å²	126.1	96%	0.958	79%	0.791	S	S	*	*			trans	77.7	135.2	160.6	-171.4	0	0	0	0	123
552	G	29.6	Very low	32.8	Very low	72 Å²	72	125.4 Å²	125.4	74%	0.742	79%	0.785	S	S	*	*			trans	169.4	146.6	162.9	0	0	0	0	0	118
553	I	29.4	Very low	32.9	Very low	179 Å²	179	124 Å²	124	92%	0.918	79%	0.786	S	S	*	*			trans	-128.1	149.3	-167.6	-62.8	166	0	0	0	113.9
554	G	27	Very low	33.3	Very low	71 Å²	71	124 Å²	124	73%	0.732	79%	0.789	S	S	*	*			trans	151	100.2	147.3	0	0	0	0	0	124
555	V	27.8	Very low	33	Very low	155 Å²	155	122.5 Å²	122.5	94%	0.939	79%	0.785	S	S	*	*			trans	7.8	143.1	146.6	-170.8	0	0	0	0	123.1
556	G	26	Very low	33.1	Very low	72 Å²	72	124.2 Å²	124.2	74%	0.742	79%	0.791	S	S	*	*			trans	-143.8	-47.9	-176.8	0	0	0	0	0	125
557	M	28.4	Very low	32.4	Very low	142 Å²	142	121.4 Å²	121.4	70%	0.7	79%	0.791	S	S	*	*			trans	71	135.1	176.1	-86.7	-76.9	111.3	0	0	124
558	R	29.2	Very low	32.6	Very low	211 Å²	211	119.5 Å²	119.5	80%	0.796	79%	0.789	S	S	*	*			trans	68	143.8	150.4	-85.3	176.4	-70.5	-109.2	4	120.1
559	S	28.2	Very low	32.2	Very low	109 Å²	109	118 Å²	118	76%	0.762	78%	0.78	S	S	*	*			cis	-146.8	168.7	7	-77.9	0	0	0	0	113.1
560	S	31.4	Very low	30.8	Very low	114 Å²	114	120.2 Å²	120.2	80%	0.797	78%	0.778	S	S	*	*			trans	-118.6	-168.9	177.2	-44.1	0	0	0	0	111.7
561	P	47.6	Very low	31.2	Very low	119 Å²	119	122.6 Å²	122.6	77%	0.773	78%	0.784	S	S	*	*			cis	-102.6	-160.7	38.9	43.5	-40.3	0	0	0	112.7
562	S	29.6	Very low	31.4	Very low	113 Å²	113	120.6 Å²	120.6	79%	0.79	77%	0.774	S	S	*	*			cis	-160.2	169.6	-3.7	12.7	0	0	0	0	107.8
563	G	32.5	Very low	31.8	Very low	70 Å²	70	124.4 Å²	124.4	72%	0.722	78%	0.778	S	S	*	*			cis	123.8	132.6	-3.3	0	0	0	0	0	112.7
564	P	43.3	Very low	31.8	Very low	124 Å²	124	123.2 Å²	123.2	81%	0.805	77%	0.771	S	S	*	*			cis	-104.1	-177.3	-6.1	43.2	-32.8	0	0	0	111.7
565	T	28.7	Very low	32.1	Very low	113 Å²	113	124.2 Å²	124.2	69%	0.693	76%	0.764	S	S	*	*	S	Bend	cis	-147.5	134.6	18.4	-43	0	0	0	0	111.8
566	T	30.6	Very low	32.9	Very low	134 Å²	134	123.5 Å²	123.5	82%	0.822	76%	0.76	S	S	*	*			trans	35.7	107.8	162.7	57	0	0	0	0	119.8
567	A	26.6	Very low	33.6	Very low	95 Å²	95	127.6 Å²	127.6	79%	0.785	76%	0.757	S	S	*	*			trans	-86.6	164.1	163.4	0	0	0	0	0	112.7
568	S	31.4	Very low	34.4	Very low	105 Å²	105	126 Å²	126	73%	0.734	76%	0.756	S	S	*	*			trans	34.5	142.7	132.6	-163.7	0	0	0	0	121
569	L	25.4	Very low	34.9	Very low	130 Å²	130	119.4 Å²	119.4	68%	0.681	75%	0.746	S	S	*	*				178.3	156.7	115.4	-95.1	166.2	0	0	0	114.2
570	F	26.1	Very low	35.7	Very low	171 Å²	171	118 Å²	118	75%	0.75	73%	0.733	S	S	*	*			trans	58.3	120.7	163.1	-55.6	-57.5	0	0	0	121.3
571	S	42.3	Very low	36.2	Very low	118 Å²	118	116 Å²	116	83%	0.825	71%	0.714	S	S	*	*			trans	-83.9	144.7	130.4	-52.4	0	0	0	0	108.7
572	P	38.2	Very low	36	Very low	115 Å²	115	116.6 Å²	116.6	75%	0.747	71%	0.709	S	S	*	*				-135.7	159.4	112.6	38.3	-30.3	0	0	0	113.1
573	D	37.9	Very low	36.8	Very low	153 Å²	153	117.9 Å²	117.9	82%	0.818	71%	0.707	S	S	*	*			trans	-59.8	144.5	167.1	-61.2	-86.2	0	0	0	112
574	I	29.8	Very low	37.7	Very low	153 Å²	153	121 Å²	121	79%	0.785	70%	0.704	S	S	*	*			trans	-168.1	122.2	137.2	-107.7	157.3	0	0	0	114.2
575	T	32.3	Very low	37.6	Very low	93 Å²	93	121.4 Å²	121.4	57%	0.571	69%	0.693	S	S	*	*			trans	66.9	144	156.9	63.8	0	0	0	0	122.2	K577	T575-K577 PolarHBondContact O-N 3.23Å; T575-K577 WeakPolarHBondContact OG1-CB 3.38Å
576	T	44.9	Very low	38.2	Very low	140 Å²	140	123.8 Å²	123.8	86%	0.859	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.6	36.3	166.7	44	0	0	0	0	114.3
577	K	41.9	Very low	38.7	Very low	157 Å²	157	122 Å²	122	68%	0.683	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	-12.5	-168.9	-158.8	169.2	-177.1	177.1	0	114.6	T575 T580	T575-K577 PolarHBondContact O-N 3.23Å; T575-K577 WeakPolarHBondContact OG1-CB 3.38Å; K577-T580 PolarHBondContact O-OG1 3.34Å
578	T	45.3	Very low	39.2	Very low	109 Å²	109	121.7 Å²	121.7	67%	0.669	69%	0.691	S	S	*	*	H	α-helix	trans	-87.2	-28.6	178.2	47	0	0	0	0	113.3	T580 D581	T578-T580 PolarHBondContact O-N 3.42Å; T578-D581 PolarHBondContact O-N 2.93Å
579	A	38.3	Very low	39.4	Very low	72 Å²	72	120.8 Å²	120.8	60%	0.595	69%	0.69	S	S	*	*	H	α-helix	trans	-66.3	-23.9	174.7	0	0	0	0	0	113.3
580	T	46	Very low	39.7	Very low	80 Å²	80	121.9 Å²	121.9	49%	0.491	70%	0.697	S	S	.	*	H	α-helix	trans	-89.5	-26.6	177.2	29.9	0	0	0	0	113.8	K577 T578 L583 M584	K577-T580 PolarHBondContact O-OG1 3.34Å; T578-T580 PolarHBondContact O-N 3.42Å; T580-L583 PolarHBondContact O-N 3.02Å; T580-M584 PolarHBondContact O-N 2.93Å
581	D	41.9	Very low	40	Very low	73 Å²	73	123 Å²	123	39%	0.39	70%	0.704	S	S	.	*	H	α-helix	trans	-67.7	-37.9	177.5	178.5	61.6	0	0	0	112.5	T578 L583 M584 K585	T578-D581 PolarHBondContact O-N 2.93Å; D581-L583 VanDerWaalsContact C-N 3.27Å; D581-L583 PolarHBondContact O-N 3.01Å; D581-M584 PolarHBondContact O-N 3.38Å; D581-K585 WeakPolarHBondContact O-CB 3.3Å; D581-K585 WeakPolarHBondContact O-CG 3.47Å; D581-K585 PolarHBondContact O-N 3.33Å; D581-K585 VanDerWaalsContact O-N 3.08Å; D581-K585 WeakPolarHBondContact OD1-CE 3.27Å; D581-K585 IonicContact OD1-NZ 3.65Å; D581-K585 PolarHBondContact OD1-NZ 3.25Å; D581-K585 IonicContact OD2-NZ 2.63Å; D581-K585 PolarHBondContact OD2-NZ 3.4Å
582	L	44	Very low	39.7	Very low	130 Å²	130	126.7 Å²	126.7	68%	0.681	70%	0.7	S	S	*	*	H	α-helix	trans	-69.8	-20.9	173.8	-75.1	170.6	0	0	0	113.7
583	L	46.3	Very low	39.2	Very low	140 Å²	140	128 Å²	128	73%	0.733	70%	0.696	S	S	*	*	H	α-helix	trans	-88.1	-29.2	173.6	-84.9	163.1	0	0	0	113.1	T580 D581	T580-L583 PolarHBondContact O-N 3.02Å; D581-L583 VanDerWaalsContact C-N 3.27Å; D581-L583 PolarHBondContact O-N 3.01Å
584	M	50.2	Low	38.8	Very low	135 Å²	135	125.5 Å²	125.5	67%	0.665	69%	0.691	S	S	*	*	H	α-helix	trans	-72.9	-30.7	169.8	-76	-156.3	-168.7	0	0	113.3	T580 D581 L586 S587	T580-M584 PolarHBondContact O-N 2.93Å; D581-M584 PolarHBondContact O-N 3.38Å; M584-L586 PolarHBondContact O-N 3.41Å; M584-L586 VanDerWaalsContact O-N 3.13Å; M584-S587 PolarHBondContact O-N 2.94Å; M584-S587 PolarHBondContact O-OG 2.81Å
585	K	41.5	Very low	38.7	Very low	134 Å²	134	125.9 Å²	125.9	58%	0.583	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-1.6	-175.5	-85.7	168.6	176.2	153.1	0	116	D581	D581-K585 WeakPolarHBondContact O-CB 3.3Å; D581-K585 WeakPolarHBondContact O-CG 3.47Å; D581-K585 PolarHBondContact O-N 3.33Å; D581-K585 VanDerWaalsContact O-N 3.08Å; D581-K585 WeakPolarHBondContact OD1-CE 3.27Å; D581-K585 IonicContact OD1-NZ 3.65Å; D581-K585 PolarHBondContact OD1-NZ 3.25Å; D581-K585 IonicContact OD2-NZ 2.63Å; D581-K585 PolarHBondContact OD2-NZ 3.4Å
586	L	41.8	Very low	38.3	Very low	163 Å²	163	131.3 Å²	131.3	85%	0.853	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.2	1.2	171.8	-67.6	176.7	0	0	0	114.2	M584	M584-L586 PolarHBondContact O-N 3.41Å; M584-L586 VanDerWaalsContact O-N 3.13Å
587	S	40.5	Very low	37.5	Very low	97 Å²	97	129.9 Å²	129.9	68%	0.678	71%	0.705	S	S	*	*	S	Bend	trans	-123.2	7.3	-175.4	67.2	0	0	0	0	115.5	M584	M584-S587 PolarHBondContact O-N 2.94Å; M584-S587 PolarHBondContact O-OG 2.81Å
588	A	37.6	Very low	37.7	Very low	87 Å²	87	126.8 Å²	126.8	72%	0.719	70%	0.701	S	S	*	*			trans	-123.9	18.6	-171.4	0	0	0	0	0	115.1
589	A	35.5	Very low	36.7	Very low	87 Å²	87	130 Å²	130	72%	0.719	71%	0.706	S	S	*	*	S	Bend	trans	-115	41	-172	0	0	0	0	0	114.7
590	N	31.9	Very low	36.1	Very low	153 Å²	153	133.6 Å²	133.6	82%	0.818	71%	0.71	S	S	*	*			trans	-162.4	87.9	158.2	-118.7	-67.9	0	0	0	112
591	Q	32	Very low	35.1	Very low	195 Å²	195	136.3 Å²	136.3	91%	0.911	72%	0.721	S	S	*	*			trans	-113.8	159.7	154.9	-66.6	-163.6	27.9	0	0	108.6
592	R	35.6	Very low	34.2	Very low	195 Å²	195	140.2 Å²	140.2	74%	0.736	74%	0.735	S	S	*	*			trans	-111.3	172.4	-154.5	-56.6	172.1	93.7	-137.4	13.8	113.3
593	E	28.9	Very low	33.4	Very low	141 Å²	141	142 Å²	142	66%	0.659	74%	0.739	S	S	*	*			trans	76.5	89.9	149.1	-77.1	148.6	135.1	0	0	119.2
594	S	27.8	Very low	32.3	Very low	102 Å²	102	143.6 Å²	143.6	71%	0.713	74%	0.743	S	S	*	*				58.4	136.4	121.4	65.8	0	0	0	0	122.3
595	L	28.4	Very low	31.8	Very low	161 Å²	161	141.7 Å²	141.7	84%	0.843	74%	0.741	S	S	*	*				178.5	121.3	121	-100.6	164.7	0	0	0	113.5
596	K	24.3	Very low	31	Very low	206 Å²	206	144.1 Å²	144.1	90%	0.896	75%	0.751	S	S	*	*				168.9	139.4	126.3	-93.6	166.8	-177.5	177.2	0	113.1
597	S	28.6	Very low	30.2	Very low	110 Å²	110	142.1 Å²	142.1	77%	0.769	75%	0.746	S	S	*	*			trans	-105.7	-179	164.3	58.7	0	0	0	0	109.6
598	P	45.5	Very low	29.5	Very low	92 Å²	92	145.4 Å²	145.4	60%	0.597	75%	0.75	S	S	*	*				-155.9	169.9	83.5	42.1	-22.9	0	0	0	118.1
599	F	24.2	Very low	28.8	Very low	177 Å²	177	149.1 Å²	149.1	78%	0.776	75%	0.753	S	S	*	*			trans	66.8	148.1	158.7	-55.9	-49.7	0	0	0	119.5
600	H	25.1	Very low	28.2	Very low	148 Å²	148	150.6 Å²	150.6	69%	0.685	75%	0.753	S	S	*	*			cis	-158.9	157.4	-12.9	-124.1	-42.7	0	0	0	112
601	L	25.1	Very low	28.4	Very low	137 Å²	137	148.1 Å²	148.1	72%	0.717	75%	0.745	S	S	*	*			trans	64.3	101.9	148.7	-70.3	167.7	0	0	0	122.6
602	K	24.4	Very low	28	Very low	155 Å²	155	144.2 Å²	144.2	67%	0.674	74%	0.739	S	S	*	*				79.6	127.9	100.3	-177	166.4	172.6	162.8	0	122.6
603	E	26.6	Very low	28.4	Very low	167 Å²	167	140.1 Å²	140.1	78%	0.78	74%	0.738	S	S	*	*			trans	88.1	161.6	154.5	-97.4	161.8	-158.2	0	0	123
604	E	23.8	Very low	28.4	Very low	173 Å²	173	144.9 Å²	144.9	81%	0.808	75%	0.75	S	S	*	*			trans	-92.4	-171.7	-162	-120.4	-171.5	113.2	0	0	112.8
605	P	39.5	Very low	29.3	Very low	95 Å²	95	145.4 Å²	145.4	62%	0.617	75%	0.751	S	S	*	*			cis	-139.9	-178.8	-15.4	39.1	-20.1	0	0	0	116.2
606	K	23.4	Very low	29.3	Very low	186 Å²	186	144 Å²	144	81%	0.809	75%	0.754	S	S	*	*			trans	56.3	156.4	139.2	-91.1	179.1	177.8	175	0	124.9
607	V	26.3	Very low	29.7	Very low	121 Å²	121	139.3 Å²	139.3	73%	0.733	75%	0.748	S	S	*	*			trans	71.2	126.2	159	164.5	0	0	0	0	114.4
608	E	24.1	Very low	29.8	Very low	165 Å²	165	141.9 Å²	141.9	77%	0.771	75%	0.747	S	S	*	*				99.7	146.4	51.4	-145.5	178.2	152.9	0	0	111.7
609	E	23.3	Very low	28.8	Very low	165 Å²	165	142.4 Å²	142.4	77%	0.771	75%	0.752	S	S	*	*			trans	64.7	132.4	171.3	-64	-137.2	78.7	0	0	123.7
610	T	22.8	Very low	29	Very low	118 Å²	118	142.3 Å²	142.3	72%	0.724	75%	0.754	S	S	*	*			trans	-47.8	-171	146.1	15.5	0	0	0	0	116.2
611	P	37.1	Very low	29.2	Very low	101 Å²	101	139.4 Å²	139.4	66%	0.656	75%	0.751	S	S	*	*			cis	-140.7	174.1	-23.9	34.3	-14.5	0	0	0	116.9
612	S	23.9	Very low	29.4	Very low	113 Å²	113	141.3 Å²	141.3	79%	0.79	76%	0.756	S	S	*	*			trans	67.6	-171.7	141.1	-77.6	0	0	0	0	120
613	P	42.8	Very low	29.5	Very low	109 Å²	109	141.5 Å²	141.5	71%	0.708	76%	0.764	S	S	*	*				-140.2	156.7	-60.8	40.3	-24.9	0	0	0	118.7
614	R	30.1	Very low	29.5	Very low	242 Å²	242	137 Å²	137	91%	0.913	76%	0.763	S	S	*	*			trans	57.7	-176.6	145.5	-88.8	-174	-178.8	-163.6	1.5	119.8
615	P	45.4	Very low	30.8	Very low	113 Å²	113	134.9 Å²	134.9	73%	0.734	76%	0.764	S	S	*	*			cis	-130.4	-179.9	-29.7	35	-17	0	0	0	115.1
616	S	29.8	Very low	30.3	Very low	130 Å²	130	136.5 Å²	136.5	91%	0.909	77%	0.772	S	S	*	*			trans	-171.6	165.7	150.3	-92.4	0	0	0	0	114
617	S	32.2	Very low	30.8	Very low	108 Å²	108	130.9 Å²	130.9	76%	0.755	77%	0.767	S	S	*	*			trans	-125.1	-175.1	-170.6	50.6	0	0	0	0	112.5
618	Q	30.9	Very low	31	Very low	164 Å²	164	129.8 Å²	129.8	77%	0.766	77%	0.771	S	S	*	*			cis	-174.4	144.9	34.6	-178	168.9	-8	0	0	114.7
619	C	24.2	Very low	31.4	Very low	104 Å²	104	126.6 Å²	126.6	70%	0.703	77%	0.773	S	S	*	*			trans	57.5	148.3	158.5	-70.6	0	0	0	0	120.5
620	Q	29.1	Very low	32	Very low	175 Å²	175	122.7 Å²	122.7	82%	0.818	77%	0.769	S	S	*	*			cis	-162.9	-172.4	0.6	-124.2	-171.4	124.9	0	0	108.9
621	S	28.1	Very low	32.5	Very low	87 Å²	87	122.7 Å²	122.7	61%	0.608	77%	0.774	S	S	*	*			cis	-168.9	165.8	-0.3	37.7	0	0	0	0	111.3
622	Q	28.9	Very low	32.2	Very low	176 Å²	176	122.3 Å²	122.3	82%	0.822	78%	0.779	S	S	*	*			trans	72.3	128.6	163.3	-74.4	-179.7	-17.7	0	0	120.6
623	D	27.7	Very low	32.5	Very low	159 Å²	159	121.4 Å²	121.4	85%	0.85	78%	0.778	S	S	*	*			trans	41.7	131.4	161.6	-48.5	-19.4	0	0	0	120.9
624	G	25.8	Very low	31.8	Very low	73 Å²	73	124.7 Å²	124.7	75%	0.753	79%	0.786	S	S	*	*			cis	116.9	148.2	-4.2	0	0	0	0	0	114.2
625	P	51	Low	31.8	Very low	129 Å²	129	121 Å²	121	84%	0.838	78%	0.779	S	S	*	*			cis	-101.5	-163.3	-23.7	35.8	-19.9	0	0	0	110.5
626	T	28.9	Very low	30.9	Very low	128 Å²	128	119.6 Å²	119.6	79%	0.785	77%	0.773	S	S	*	*			cis	-125.5	-170.9	3.7	60	0	0	0	0	109.7
627	G	34.2	Very low	30.8	Very low	68 Å²	68	121.9 Å²	121.9	70%	0.701	77%	0.774	S	S	*	*			cis	99.3	129.6	5.3	0	0	0	0	0	113.2
628	A	31.6	Very low	30.3	Very low	98 Å²	98	125.9 Å²	125.9	81%	0.81	78%	0.778	S	S	*	*			cis	-152.9	142.3	1.2	0	0	0	0	0	110.1
629	A	31.5	Very low	30.5	Very low	99 Å²	99	123.4 Å²	123.4	82%	0.818	78%	0.776	S	S	*	*			cis	80.2	148.5	46.1	0	0	0	0	0	114.4
630	A	35.1	Very low	30.5	Very low	83 Å²	83	128.6 Å²	128.6	69%	0.686	78%	0.78	S	S	*	*			cis	-177.4	163	-25.2	0	0	0	0	0	110.6
631	S	33.6	Very low	30.4	Very low	118 Å²	118	127.8 Å²	127.8	83%	0.825	78%	0.777	S	S	*	*			trans	53.9	155.7	145.9	51.7	0	0	0	0	122.7
632	A	32.1	Very low	30.6	Very low	93 Å²	93	127.7 Å²	127.7	77%	0.769	79%	0.789	S	S	*	*			cis	-175.2	177	-17.9	0	0	0	0	0	111.6
633	A	29.8	Very low	30.7	Very low	94 Å²	94	125 Å²	125	78%	0.777	79%	0.79	S	S	*	*			trans	99.1	141.1	148.2	0	0	0	0	0	123.6
634	M	28.8	Very low	31.6	Very low	177 Å²	177	122.7 Å²	122.7	87%	0.872	78%	0.783	S	S	*	*			trans	75.2	114.6	150.1	-78.6	172.4	170.8	0	0	125.1
635	E	28.3	Very low	32	Very low	164 Å²	164	128.3 Å²	128.3	77%	0.766	79%	0.792	S	S	*	*				70.9	136.6	123.6	-122.6	-166.1	105	0	0	126.5
636	S	26.7	Very low	31.2	Very low	85 Å²	85	127 Å²	127	59%	0.594	79%	0.792	S	S	*	*			trans	68.6	130.8	143.5	-81.5	0	0	0	0	125
637	L	27.5	Very low	31.5	Very low	177 Å²	177	129.9 Å²	129.9	93%	0.927	79%	0.794	S	S	*	*			trans	76.5	159.8	145.4	-67.9	169.1	0	0	0	122.9
638	K	22.4	Very low	31.4	Very low	193 Å²	193	134.1 Å²	134.1	84%	0.839	80%	0.801	S	S	*	*			trans	-107.2	162.1	173.2	-135.3	176	-179.6	173.4	0	106.7
639	P	34.6	Very low	31.4	Very low	112 Å²	112	134.2 Å²	134.2	73%	0.727	80%	0.796	S	S	*	*			cis	-140.2	-162.8	9.2	40.4	-19.2	0	0	0	114.9
640	R	25.7	Very low	31.3	Very low	212 Å²	212	136.4 Å²	136.4	80%	0.8	79%	0.793	S	S	*	*			trans	94.2	136.2	145.2	-162.7	175.1	-178.2	-166.5	-6.3	120.5
641	E	25.8	Very low	31.2	Very low	159 Å²	159	139.9 Å²	139.9	74%	0.743	80%	0.799	S	S	*	*			trans	2.4	123.3	160.7	-54	168.8	126.4	0	0	120.3
642	G	32.9	Very low	31	Very low	85 Å²	85	138.3 Å²	138.3	88%	0.876	79%	0.788	S	S	*	*			trans	166.3	149.8	164	0	0	0	0	0	115.3
643	S	30.5	Very low	31.3	Very low	119 Å²	119	141.8 Å²	141.8	83%	0.832	79%	0.788	S	S	*	*			trans	-116.3	172.5	172.3	-135.8	0	0	0	0	109.4
644	P	47.1	Very low	31.7	Very low	110 Å²	110	143 Å²	143	71%	0.714	78%	0.782	S	S	*	*			cis	-139.5	-177.7	-1.6	40.9	-22.1	0	0	0	116.5
645	M	35	Very low	32	Very low	191 Å²	191	141.9 Å²	141.9	94%	0.941	78%	0.778	S	S	*	*			trans	77.3	142.5	152.1	-103.4	-169.9	170.5	0	0	123.9
646	A	33.6	Very low	32	Very low	101 Å²	101	140.7 Å²	140.7	84%	0.835	78%	0.777	S	S	*	*			trans	89.6	134.5	150.6	0	0	0	0	0	123.8
647	K	34.6	Very low	32.3	Very low	190 Å²	190	141.3 Å²	141.3	83%	0.826	78%	0.777	S	S	*	*			trans	-27.8	134.5	175.2	-50.4	167.9	-178.2	175.5	0	120.6
648	N	32.1	Very low	32.8	Very low	156 Å²	156	142.8 Å²	142.8	83%	0.834	78%	0.776	S	S	*	*				168.8	141.6	102.6	-101.3	-9.3	0	0	0	117.2
649	S	32.2	Very low	33.4	Very low	101 Å²	101	139.7 Å²	139.7	71%	0.706	77%	0.772	S	S	*	*			trans	50.4	148	140.9	-132	0	0	0	0	126.2
650	L	30	Very low	33.2	Very low	144 Å²	144	138.9 Å²	138.9	75%	0.754	78%	0.776	S	S	*	*			trans	64.8	133.1	164.7	-61.7	164.7	0	0	0	115.8
651	L	32.1	Very low	33.6	Very low	156 Å²	156	134.6 Å²	134.6	82%	0.817	78%	0.778	S	S	*	*				57	130.9	60.7	-59.8	179.7	0	0	0	111.4
652	S	30.2	Very low	34	Very low	86 Å²	86	135.2 Å²	135.2	60%	0.601	78%	0.781	S	S	*	*			cis	-164.8	146.2	34.2	51.6	0	0	0	0	113.5
653	Q	37	Very low	34.2	Very low	165 Å²	165	138.7 Å²	138.7	77%	0.771	78%	0.778	S	S	*	*			trans	66.5	158.1	143.9	-64.8	179.4	-82.8	0	0	119
654	D	39.7	Very low	34.6	Very low	121 Å²	121	141.4 Å²	141.4	65%	0.647	78%	0.783	S	S	*	*			cis	-163.2	-170.5	-20	-102.1	-18.8	0	0	0	107.5
655	I	34.1	Very low	34	Very low	153 Å²	153	143.2 Å²	143.2	79%	0.785	79%	0.785	S	S	*	*			trans	78.9	130.3	161.5	-46.7	179.4	0	0	0	112.6
656	N	28	Very low	33.6	Very low	138 Å²	138	142.4 Å²	142.4	74%	0.738	78%	0.776	S	S	*	*			cis	-147.1	174.2	26.1	-143.5	-11.3	0	0	0	115.2
657	V	34	Very low	33.5	Very low	99 Å²	99	144.8 Å²	144.8	60%	0.6	77%	0.774	S	S	*	*			trans	28.1	114.1	148.4	163.7	0	0	0	0	117.4	V659	V657-V659 HydrophobicContact CG1-CG2 3.78Å
658	K	36.6	Very low	33.2	Very low	208 Å²	208	140.1 Å²	140.1	90%	0.904	77%	0.765	S	S	*	*				67.3	42.2	51.1	-151.6	178	-178.6	176.7	0	115.4
659	V	36.3	Very low	33	Very low	127 Å²	127	141 Å²	141	77%	0.77	76%	0.764	S	S	*	*			trans	-124.9	104.9	157.9	175.9	0	0	0	0	108.3	V657	V657-V659 HydrophobicContact CG1-CG2 3.78Å
660	A	29.1	Very low	32.8	Very low	96 Å²	96	142 Å²	142	79%	0.793	76%	0.762	S	S	*	*			trans	-158.6	54.3	-174.1	0	0	0	0	0	112.8
661	S	36.1	Very low	32.9	Very low	122 Å²	122	138.9 Å²	138.9	85%	0.853	75%	0.752	S	S	*	*	S	Bend	trans	-147.3	10.9	-176.1	-58.9	0	0	0	0	116
662	E	33.3	Very low	33	Very low	171 Å²	171	139.9 Å²	139.9	80%	0.799	75%	0.75	S	S	*	*	S	Bend	trans	-133.6	4.3	-161.9	-101.3	-80.1	106.6	0	0	116.4
663	L	37.2	Very low	33.1	Very low	158 Å²	158	142.3 Å²	142.3	83%	0.827	76%	0.756	S	S	*	*			trans	-136.6	69.6	-173.5	-71.8	176.4	0	0	0	114.3
664	L	37.7	Very low	32.8	Very low	176 Å²	176	138.1 Å²	138.1	92%	0.921	75%	0.75	S	S	*	*	S	Bend	trans	-140	20.1	163.2	-92.9	-174.4	0	0	0	115.4
665	I	34.3	Very low	32.2	Very low	148 Å²	148	139.2 Å²	139.2	76%	0.759	75%	0.751	S	S	*	*	S	Bend	trans	-131.5	114.7	160.8	-62.3	-179.9	0	0	0	108.3
666	K	28.3	Very low	32.1	Very low	175 Å²	175	140.3 Å²	140.3	76%	0.761	75%	0.746	S	S	*	*			trans	67	142.1	179.6	-62.5	167.4	-176.3	172.7	0	113.4
667	L	30.1	Very low	32.2	Very low	151 Å²	151	140 Å²	140	79%	0.791	74%	0.74	S	S	*	*			cis	-148.5	176.4	-1.8	-118.5	164.7	0	0	0	110.5
668	S	28.5	Very low	31.9	Very low	92 Å²	92	143 Å²	143	64%	0.643	75%	0.746	S	S	*	*			trans	-54.4	137.9	168.8	51.1	0	0	0	0	113.2
669	E	28.5	Very low	31.5	Very low	174 Å²	174	138.9 Å²	138.9	81%	0.813	74%	0.737	S	S	*	*				-175.1	138.6	101.5	-89	-169.5	123.8	0	0	108.2
670	N	27.6	Very low	31.2	Very low	123 Å²	123	141.3 Å²	141.3	66%	0.658	74%	0.738	S	S	*	*			cis	109.4	124.3	21.3	178.5	42.7	0	0	0	112.1
671	S	32.4	Very low	31.2	Very low	78 Å²	78	141.9 Å²	141.9	55%	0.545	73%	0.731	S	S	.	*			trans	63.8	167.3	168.9	64.4	0	0	0	0	114.8
672	K	34	Very low	30.8	Very low	177 Å²	177	144.7 Å²	144.7	77%	0.77	73%	0.728	S	S	*	*			cis	-157.1	159.9	37.6	-73.6	-175.2	176.8	159	0	110.2
673	D	32.7	Very low	30.7	Very low	136 Å²	136	139.9 Å²	139.9	73%	0.727	72%	0.718	S	S	*	*			cis	-162.3	-179.6	-7.7	-125.6	-53.2	0	0	0	111.4
674	A	30.1	Very low	30.1	Very low	77 Å²	77	140 Å²	140	64%	0.636	71%	0.714	S	S	*	*			trans	71.2	140.2	163.6	0	0	0	0	0	117.7
675	Q	27.8	Very low	30.6	Very low	145 Å²	145	135.2 Å²	135.2	68%	0.678	69%	0.693	S	S	*	*			cis	-159.4	168.6	-2.7	-107.3	162.1	23.1	0	0	107.1
676	Y	30.6	Very low	30.4	Very low	175 Å²	175	133.3 Å²	133.3	69%	0.686	68%	0.682	S	S	*	*			cis	-143.7	151	12.1	-100.9	-45.6	0	0	0	108
677	Q	30.2	Very low	30.4	Very low	131 Å²	131	130.2 Å²	130.2	61%	0.612	67%	0.671	S	S	*	*				64.7	128.4	74.8	-163.6	-179.7	123.9	0	0	114.1
678	K	28.5	Very low	30.4	Very low	163 Å²	163	127.7 Å²	127.7	71%	0.709	66%	0.662	S	S	*	*			cis	-141.7	134.2	26.6	-126.6	140	-178.9	154.9	0	109.3
679	V	28.2	Very low	30.2	Very low	121 Å²	121	130.2 Å²	130.2	73%	0.733	67%	0.668	S	S	*	*				71.7	130	82.7	161.9	0	0	0	0	112.8
680	K	30	Very low	31.3	Very low	179 Å²	179	126.8 Å²	126.8	78%	0.778	66%	0.661	S	S	*	*			cis	-168.6	171.6	22.1	-139.9	-179.5	177.5	-178.7	0	113.6
681	V	28.6	Very low	32.7	Very low	108 Å²	108	126.1 Å²	126.1	66%	0.655	66%	0.663	S	S	*	*			trans	74.4	145.1	149.4	156.4	0	0	0	0	119.1
682	K	29.2	Very low	33.7	Very low	180 Å²	180	127.9 Å²	127.9	78%	0.783	67%	0.673	S	S	*	*			cis	-174.3	126.1	-24.1	-178.7	-175.4	172.4	-167.7	0	113.2
683	A	31.1	Very low	33.6	Very low	71 Å²	71	123.7 Å²	123.7	59%	0.587	67%	0.671	S	S	*	*			trans	24.8	138.5	148.5	0	0	0	0	0	126.8
684	E	24.8	Very low	33.4	Very low	161 Å²	161	124 Å²	124	75%	0.752	67%	0.668	S	S	*	*			trans	64.8	169.4	134.8	-73	-178.2	142.1	0	0	122.3
685	P	47.9	Very low	33.3	Very low	75 Å²	75	130.1 Å²	130.1	49%	0.487	68%	0.675	S	S	.	*			cis	-135.9	-170.1	-43.2	38.7	-20.2	0	0	0	115.5	T262	T262-P685 VanDerWaalsContact OG1-CA 3.27Å; T262-P685 WeakPolarHBondContact OG1-CA 3.35Å
686	M	28.6	Very low	33.1	Very low	107 Å²	107	129.6 Å²	129.6	53%	0.527	68%	0.681	S	S	.	*			trans	54.4	140.7	141.6	-86.6	170.3	64	0	0	126.4	R261	R261-M686 WeakPolarHBondContact CD-O 3.49Å; R261-M686 PolarHBondContact NH1-O 3.41Å
687	E	28.9	Very low	34.4	Very low	111 Å²	111	126.8 Å²	126.8	52%	0.519	69%	0.685	S	S	.	*			trans	94.7	115.3	138.9	-75.4	-175.6	142.9	0	0	127.4	E260 R261	E260-E687 WeakPolarHBondContact OE2-CA 3.35Å; E260-E687 PolarHBondContact OE2-N 2.82Å; R261-E687 PolarHBondContact NH1-O 2.73Å; R261-E687 PolarHBondContact NH2-O 3.07Å
688	V	30.2	Very low	35.3	Very low	98 Å²	98	125.9 Å²	125.9	59%	0.594	69%	0.69	S	S	*	*				88.9	120.2	127.6	172.2	0	0	0	0	124.1	E260	E260-V688 PolarHBondContact OE1-N 3.14Å
689	D	24.9	Very low	35.5	Very low	144 Å²	144	122.5 Å²	122.5	77%	0.77	69%	0.692	S	S	*	*				5	177	127.1	-115.8	7.4	0	0	0	122.9
690	P	50.3	Low	35.7	Very low	103 Å²	103	121 Å²	121	67%	0.669	69%	0.687	S	S	*	*			cis	-125.6	-104.8	-30.5	23.3	1.6	0	0	0	119.1
691	P	57	Low	35.8	Very low	109 Å²	109	120.5 Å²	120.5	71%	0.708	69%	0.688	S	S	*	*				-129.1	-150.1	-128.1	45.3	-23.8	0	0	0	114.6
692	P	53.3	Low	35.7	Very low	115 Å²	115	121.6 Å²	121.6	75%	0.747	69%	0.689	S	S	*	*			cis	-142.7	-163	-5.8	43.3	-21.9	0	0	0	117.7
693	A	32.9	Very low	35.6	Very low	89 Å²	89	119.6 Å²	119.6	74%	0.736	69%	0.686	S	S	*	*			trans	81.5	151.3	152.4	0	0	0	0	0	120.8
694	E	27.7	Very low	35.3	Very low	141 Å²	141	121.3 Å²	121.3	66%	0.659	69%	0.689	S	S	*	*			cis	-162.1	156.9	-17	-113.6	-158.9	154.6	0	0	114.6
695	R	28.3	Very low	35.3	Very low	206 Å²	206	122.6 Å²	122.6	78%	0.777	69%	0.693	S	S	*	*			trans	61.3	148.8	147.4	-66	-178.6	-163	-178.6	19.6	125.8
696	T	24.4	Very low	34.2	Very low	134 Å²	134	124.5 Å²	124.5	82%	0.822	71%	0.708	S	S	*	*			trans	-97.9	-165.6	170.3	44.7	0	0	0	0	110.9
697	P	57.2	Low	34.3	Very low	116 Å²	116	125.4 Å²	125.4	75%	0.753	72%	0.72	S	S	*	*			cis	-128	-146	-2.1	45	-25	0	0	0	111.2
698	P	50.3	Low	34.3	Very low	113 Å²	113	128.4 Å²	128.4	73%	0.734	74%	0.738	S	S	*	*			cis	-122.7	151.8	-14.8	40.6	-24	0	0	0	114.8
699	A	31.4	Very low	34	Very low	91 Å²	91	127.2 Å²	127.2	75%	0.752	75%	0.746	S	S	*	*				71.1	152.8	88.7	0	0	0	0	0	115.7
700	S	33.2	Very low	34	Very low	90 Å²	90	125.2 Å²	125.2	63%	0.629	75%	0.749	S	S	*	*			cis	-168.2	151.8	12.5	2.2	0	0	0	0	113.8
701	H	30.6	Very low	32.9	Very low	169 Å²	169	125.6 Å²	125.6	78%	0.782	76%	0.755	S	S	*	*			trans	66.2	155.6	139.9	-60.7	-31.2	0	0	0	122.1
702	L	27.1	Very low	31.5	Very low	131 Å²	131	127 Å²	127	69%	0.686	75%	0.752	S	S	*	*			cis	-162.5	146.8	-20	-97.2	167.2	0	0	0	111.4
703	L	28.1	Very low	30.3	Very low	138 Å²	138	129.6 Å²	129.6	72%	0.723	75%	0.751	S	S	*	*			trans	54.6	138.7	138.6	-66.3	173.4	0	0	0	126.8
704	T	23.3	Very low	30	Very low	106 Å²	106	133.5 Å²	133.5	65%	0.65	76%	0.76	S	S	*	*			trans	92.6	121.4	130.7	42.2	0	0	0	0	126.1
705	F	26.6	Very low	29.9	Very low	189 Å²	189	133.9 Å²	133.9	83%	0.829	76%	0.762	S	S	*	*			trans	76.8	134.2	135.8	-82	-60.6	0	0	0	125
706	S	24.8	Very low	30.4	Very low	114 Å²	114	129 Å²	129	80%	0.797	76%	0.756	S	S	*	*			trans	92.1	163.2	142.5	-67.1	0	0	0	0	121.8
707	T	30.4	Very low	30.4	Very low	127 Å²	127	129.7 Å²	129.7	78%	0.779	75%	0.752	S	S	*	*			trans	-107.7	149.8	-154.3	-39.4	0	0	0	0	113.5
708	L	28.3	Very low	28.9	Very low	173 Å²	173	128.6 Å²	128.6	91%	0.906	75%	0.747	S	S	*	*			trans	153.6	162.6	136.4	-84.4	165.3	0	0	0	113.8
709	G	24.8	Very low	27.7	Very low	74 Å²	74	130.6 Å²	130.6	76%	0.763	75%	0.752	S	S	*	*			trans	87.3	131.6	165.2	0	0	0	0	0	115.4
710	A	25	Very low	27.3	Very low	101 Å²	101	134.1 Å²	134.1	84%	0.835	76%	0.757	S	S	*	*			cis	104.1	96.5	8.2	0	0	0	0	0	117.9
711	S	27.1	Very low	27.5	Very low	112 Å²	112	134.3 Å²	134.3	78%	0.783	76%	0.756	S	S	*	*			trans	78.9	161.4	141.9	-139	0	0	0	0	122.5
712	E	27.5	Very low	27.4	Very low	138 Å²	138	134.2 Å²	134.2	65%	0.645	76%	0.756	S	S	*	*			trans	71.4	107	162.5	-49.2	-117.9	100.2	0	0	116.8
713	K	28.4	Very low	27.3	Very low	169 Å²	169	132.9 Å²	132.9	74%	0.735	75%	0.754	S	S	*	*				69.8	123.4	80.7	-71.9	178.7	-164.5	154	0	114.7
714	N	25.5	Very low	27.2	Very low	171 Å²	171	134 Å²	134	91%	0.914	76%	0.76	S	S	*	*				-169.4	160.1	122.8	-103.7	-58.2	0	0	0	113
715	E	25.9	Very low	27.3	Very low	150 Å²	150	133.4 Å²	133.4	70%	0.701	77%	0.765	S	S	*	*			trans	-112.9	-161.3	178.2	-125	-156.3	143.9	0	0	108.8
716	P	39.6	Very low	27.5	Very low	102 Å²	102	130 Å²	130	66%	0.662	76%	0.764	S	S	*	*			cis	-133.8	-176.4	-9.6	24	1.9	0	0	0	115.8
717	M	24.3	Very low	28.1	Very low	149 Å²	149	130.1 Å²	130.1	73%	0.734	76%	0.761	S	S	*	*			trans	6.8	146	150.3	-71.5	73.8	177.8	0	0	120.5
718	S	25.3	Very low	28	Very low	94 Å²	94	131.5 Å²	131.5	66%	0.657	76%	0.759	S	S	*	*				-179.7	165.4	63.8	45.2	0	0	0	0	115.5
719	N	25.5	Very low	28.1	Very low	155 Å²	155	133.1 Å²	133.1	83%	0.829	76%	0.759	S	S	*	*			trans	88.8	127.7	152.9	-59.2	-39.1	0	0	0	122.5
720	L	23.1	Very low	28.5	Very low	165 Å²	165	136.2 Å²	136.2	86%	0.864	76%	0.758	S	S	*	*			trans	-92.5	-170	163.8	-82.1	164	0	0	0	108.7
721	P	36.6	Very low	28.7	Very low	94 Å²	94	139.8 Å²	139.8	61%	0.61	76%	0.762	S	S	*	*			cis	-140.5	-177.4	7.2	43.5	-24.2	0	0	0	117.2
722	E	27.6	Very low	28.8	Very low	166 Å²	166	143.3 Å²	143.3	78%	0.776	76%	0.764	S	S	*	*			trans	58.7	158	140.8	-79.6	166.9	118.8	0	0	121.6
723	T	26.6	Very low	29	Very low	103 Å²	103	141.8 Å²	141.8	63%	0.632	77%	0.768	S	S	*	*			cis	-157.8	154.2	6.9	1.1	0	0	0	0	111.3
724	L	25.7	Very low	29.7	Very low	163 Å²	163	142.2 Å²	142.2	85%	0.853	77%	0.773	S	S	*	*			trans	61.2	153.9	146.3	-62.2	168.1	0	0	0	120.7
725	A	25	Very low	30.5	Very low	93 Å²	93	142.1 Å²	142.1	77%	0.769	77%	0.773	S	S	*	*			cis	-161.9	175.8	-15.7	0	0	0	0	0	113
726	C	30.1	Very low	31.5	Very low	118 Å²	118	140.8 Å²	140.8	80%	0.797	77%	0.769	S	S	*	*			trans	-71.7	174.7	-177.7	-136.7	0	0	0	0	114.3
727	P	37.6	Very low	31.9	Very low	115 Å²	115	139.8 Å²	139.8	75%	0.747	77%	0.765	S	S	*	*				-151.9	156.8	65.2	40	-19	0	0	0	120.3
728	Q	29.5	Very low	33.3	Very low	156 Å²	156	138.4 Å²	138.4	73%	0.729	76%	0.764	S	S	*	*			trans	41.4	128.6	147.5	-70.5	-171.3	-76.9	0	0	123.5
729	K	30.3	Very low	34.3	Very low	208 Å²	208	141.8 Å²	141.8	90%	0.904	77%	0.767	S	S	*	*				-164.5	138.3	107.2	-99.3	150.4	-173	170.9	0	111.8
730	D	31.6	Very low	35.6	Very low	138 Å²	138	139.9 Å²	139.9	74%	0.738	76%	0.755	S	S	*	*			trans	-76.6	156.5	171.6	-55.6	-91.7	0	0	0	112.2
731	L	30.4	Very low	36.9	Very low	176 Å²	176	134.6 Å²	134.6	92%	0.921	73%	0.734	S	S	*	*				-169.4	166.8	124.9	-104.2	167.6	0	0	0	112.9
732	F	28	Very low	37.9	Very low	186 Å²	186	133.3 Å²	133.3	82%	0.816	73%	0.728	S	S	*	*			trans	-104.3	151.7	-163	-116.7	-116.4	0	0	0	114
733	S	32.7	Very low	39.6	Very low	107 Å²	107	129.9 Å²	129.9	75%	0.748	71%	0.712	S	S	*	*			trans	61.6	138.1	148.1	65.7	0	0	0	0	121.2
734	Q	43.3	Very low	41.5	Very low	177 Å²	177	130.3 Å²	130.3	83%	0.827	71%	0.71	S	S	*	*			trans	-146.5	45.9	164.2	-152.9	174.2	19.5	0	0	114.3	I736	Q734-I736 VanDerWaalsContact C-N 3.26Å; Q734-I736 PolarHBondContact O-N 2.72Å
735	D	42.9	Very low	43.4	Very low	170 Å²	170	128.4 Å²	128.4	91%	0.909	70%	0.699	S	S	*	*			trans	-75.2	71.7	169.2	-87.4	-55.6	0	0	0	111.7
736	I	47.1	Very low	45.4	Very low	121 Å²	121	131 Å²	131	62%	0.621	69%	0.694	S	S	*	*			trans	-131.7	85.1	-178.5	-47.9	-178.5	0	0	0	111.8	Q734	Q734-I736 VanDerWaalsContact C-N 3.26Å; Q734-I736 PolarHBondContact O-N 2.72Å
737	S	47.5	Very low	46.9	Very low	82 Å²	82	130.7 Å²	130.7	57%	0.573	68%	0.679	S	S	*	*	S	Bend	trans	-148.8	-48.1	162.9	64.1	0	0	0	0	112.6	K739 M740 A741	S737-K739 VanDerWaalsContact C-N 3.3Å; S737-K739 PolarHBondContact O-N 2.98Å; S737-M740 PolarHBondContact O-N 3.28Å; S737-A741 PolarHBondContact O-N 3.08Å
738	V	52.5	Low	48.1	Very low	120 Å²	120	130.6 Å²	130.6	73%	0.727	67%	0.672	S	S	*	*	H	α-helix	trans	-57.4	-39.2	-175.5	-175.3	0	0	0	0	112.8	A741 S742	V738-A741 PolarHBondContact O-N 2.81Å; V738-S742 PolarHBondContact O-N 3.31Å; V738-S742 VanDerWaalsContact O-N 3.09Å
739	K	47.9	Very low	49.6	Very low	164 Å²	164	126.6 Å²	126.6	71%	0.713	66%	0.661	S	S	*	*	H	α-helix	trans	-70.2	-43.4	-176.2	-160.2	171.6	-176.1	-179.7	0	112.6	S737 A741 S742 E743	S737-K739 VanDerWaalsContact C-N 3.3Å; S737-K739 PolarHBondContact O-N 2.98Å; K739-A741 VanDerWaalsContact C-N 3.34Å; K739-A741 PolarHBondContact O-N 3.12Å; K739-S742 PolarHBondContact O-N 3.36Å; K739-S742 PolarHBondContact O-OG 2.94Å; K739-E743 PolarHBondContact O-N 2.93Å
740	M	52	Low	50.9	Low	116 Å²	116	120.7 Å²	120.7	57%	0.571	64%	0.636	S	S	*	*	H	α-helix	trans	-62.6	-40.3	174.9	-69.8	-157	-60	0	0	111.9	S737 S742 E743 L744	S737-M740 PolarHBondContact O-N 3.28Å; M740-S742 VanDerWaalsContact C-N 3.33Å; M740-S742 PolarHBondContact O-N 2.65Å; M740-E743 PolarHBondContact O-N 3.08Å; M740-L744 WeakPolarHBondContact O-CB 3.43Å; M740-L744 VanDerWaalsContact O-CG 3.32Å; M740-L744 WeakPolarHBondContact O-CG 3.25Å; M740-L744 PolarHBondContact O-N 2.79Å
741	A	50.6	Low	51.9	Low	53 Å²	53	121.8 Å²	121.8	44%	0.438	64%	0.635	S	S	.	*	H	α-helix	trans	-59.5	-43.1	175.1	0	0	0	0	0	111.9	S737 V738 K739 L745	S737-A741 PolarHBondContact O-N 3.08Å; V738-A741 PolarHBondContact O-N 2.81Å; K739-A741 VanDerWaalsContact C-N 3.34Å; K739-A741 PolarHBondContact O-N 3.12Å; A741-L745 WeakPolarHBondContact O-CG 3.43Å; A741-L745 PolarHBondContact O-N 2.55Å
742	S	56.8	Low	53	Low	68 Å²	68	118.4 Å²	118.4	48%	0.476	62%	0.621	S	S	.	*	H	α-helix	trans	-65.7	-37.8	175.8	71.6	0	0	0	0	113.3	V738 K739 M740 F746	V738-S742 PolarHBondContact O-N 3.31Å; V738-S742 VanDerWaalsContact O-N 3.09Å; K739-S742 PolarHBondContact O-N 3.36Å; K739-S742 PolarHBondContact O-OG 2.94Å; M740-S742 VanDerWaalsContact C-N 3.33Å; M740-S742 PolarHBondContact O-N 2.65Å; S742-F746 WeakPolarHBondContact O-CB 3.41Å; S742-F746 PolarHBondContact O-N 3.49Å
743	E	63.5	Low	54	Low	94 Å²	94	112.6 Å²	112.6	44%	0.439	60%	0.603	S	S	.	*	H	α-helix	trans	-74.9	-35.4	-178.6	-161	-173.6	130.7	0	0	112.5	K739 M740 F746 K747	K739-E743 PolarHBondContact O-N 2.93Å; M740-E743 PolarHBondContact O-N 3.08Å; E743-F746 PolarHBondContact O-N 2.83Å; E743-K747 HydrophobicContact CG-CD 4.38Å; E743-K747 WeakPolarHBondContact O-CB 2.99Å; E743-K747 WeakPolarHBondContact O-CG 3.32Å; E743-K747 PolarHBondContact O-N 3.4Å; E743-K747 WeakPolarHBondContact OE1-CE 3.31Å; E743-K747 IonicContact OE1-NZ 2.83Å; E743-K747 PolarHBondContact OE1-NZ 3.18Å
744	L	66.6	Low	54.6	Low	112 Å²	112	113.7 Å²	113.7	59%	0.586	60%	0.595	S	S	*	*	H	α-helix	trans	-66	-42.5	173.6	-72.5	169.4	0	0	0	111.5	M740 F746 K747 L748	M740-L744 WeakPolarHBondContact O-CB 3.43Å; M740-L744 VanDerWaalsContact O-CG 3.32Å; M740-L744 WeakPolarHBondContact O-CG 3.25Å; M740-L744 PolarHBondContact O-N 2.79Å; L744-F746 VanDerWaalsContact C-N 3.35Å; L744-K747 PolarHBondContact O-N 3.39Å; L744-L748 WeakPolarHBondContact O-CB 3.41Å; L744-L748 WeakPolarHBondContact O-CG 3.3Å; L744-L748 PolarHBondContact O-N 2.77Å
745	L	65.8	Low	54.7	Low	122 Å²	122	108.8 Å²	108.8	64%	0.639	59%	0.585	S	S	*	*	H	α-helix	trans	-63.8	-39.6	173.3	-73.5	169.1	0	0	0	112	A741 L748 S749	A741-L745 WeakPolarHBondContact O-CG 3.43Å; A741-L745 PolarHBondContact O-N 2.55Å; L745-L748 PolarHBondContact O-N 3.34Å; L745-S749 PolarHBondContact O-N 3.18Å
746	F	67.9	Low	54.7	Low	147 Å²	147	107.3 Å²	107.3	65%	0.645	58%	0.577	S	S	*	*	H	α-helix	trans	-66.2	-45	176.1	-159.2	-91.6	0	0	0	112	S742 E743 L744 L748 S749 E750	S742-F746 WeakPolarHBondContact O-CB 3.41Å; S742-F746 PolarHBondContact O-N 3.49Å; E743-F746 PolarHBondContact O-N 2.83Å; L744-F746 VanDerWaalsContact C-N 3.35Å; F746-L748 VanDerWaalsContact C-N 3.34Å; F746-L748 PolarHBondContact O-N 3.33Å; F746-S749 WeakPolarHBondContact O-CB 3.45Å; F746-S749 PolarHBondContact O-N 2.99Å; F746-E750 WeakPolarHBondContact O-CB 3.49Å; F746-E750 PolarHBondContact O-N 2.94Å
747	K	61.3	Low	54.4	Low	113 Å²	113	107.7 Å²	107.7	49%	0.491	58%	0.58	S	S	.	*	H	α-helix	trans	-63.5	-35.4	175.6	-80.7	170.3	170.1	166.6	0	112.8	E743 L744 K751	E743-K747 HydrophobicContact CG-CD 4.38Å; E743-K747 WeakPolarHBondContact O-CB 2.99Å; E743-K747 WeakPolarHBondContact O-CG 3.32Å; E743-K747 PolarHBondContact O-N 3.4Å; E743-K747 WeakPolarHBondContact OE1-CE 3.31Å; E743-K747 IonicContact OE1-NZ 2.83Å; E743-K747 PolarHBondContact OE1-NZ 3.18Å; L744-K747 PolarHBondContact O-N 3.39Å; K747-K751 VanDerWaalsContact O-CB 3.3Å; K747-K751 WeakPolarHBondContact O-CB 3.4Å; K747-K751 PolarHBondContact O-N 2.93Å; K747-K751 VanDerWaalsContact O-N 3.09Å
748	L	61.9	Low	54.2	Low	113 Å²	113	111.9 Å²	111.9	59%	0.592	59%	0.59	S	S	*	*	H	α-helix	trans	-66.6	-45	171.9	-75.3	168.3	0	0	0	111.5	L744 L745 F746 E750 K751 V752	L744-L748 WeakPolarHBondContact O-CB 3.41Å; L744-L748 WeakPolarHBondContact O-CG 3.3Å; L744-L748 PolarHBondContact O-N 2.77Å; L745-L748 PolarHBondContact O-N 3.34Å; F746-L748 VanDerWaalsContact C-N 3.34Å; F746-L748 PolarHBondContact O-N 3.33Å; L748-E750 PolarHBondContact O-N 2.83Å; L748-K751 PolarHBondContact O-N 3.19Å; L748-V752 WeakPolarHBondContact O-CG2 3.43Å; L748-V752 PolarHBondContact O-N 3.33Å
749	S	61.2	Low	53.7	Low	71 Å²	71	115.1 Å²	115.1	50%	0.497	59%	0.594	S	S	.	*	H	α-helix	trans	-58.3	-48.3	174.9	-169.8	0	0	0	0	111.8	L745 F746 K751 V752 S753	L745-S749 PolarHBondContact O-N 3.18Å; F746-S749 WeakPolarHBondContact O-CB 3.45Å; F746-S749 PolarHBondContact O-N 2.99Å; S749-K751 VanDerWaalsContact C-N 3.31Å; S749-K751 PolarHBondContact O-N 3.14Å; S749-V752 PolarHBondContact O-N 3.3Å; S749-S753 PolarHBondContact O-N 2.68Å; S749-S753 PolarHBondContact O-OG 2.89Å
750	E	57.1	Low	53.5	Low	84 Å²	84	114.9 Å²	114.9	39%	0.393	60%	0.601	S	S	.	*	H	α-helix	trans	-62.5	-38.4	-179.5	-163.5	-166.3	150.5	0	0	112	F746 L748 S753 K754	F746-E750 WeakPolarHBondContact O-CB 3.49Å; F746-E750 PolarHBondContact O-N 2.94Å; L748-E750 PolarHBondContact O-N 2.83Å; E750-S753 PolarHBondContact O-N 2.82Å; E750-K754 HydrophobicContact CG-CD 4.34Å; E750-K754 WeakPolarHBondContact O-CB 3.45Å; E750-K754 WeakPolarHBondContact O-CG 3.49Å; E750-K754 PolarHBondContact O-N 3.47Å; E750-K754 WeakPolarHBondContact OE1-CE 3.2Å; E750-K754 IonicContact OE1-NZ 2.64Å; E750-K754 PolarHBondContact OE1-NZ 3.15Å
751	K	53.8	Low	52.4	Low	162 Å²	162	113.8 Å²	113.8	70%	0.704	61%	0.605	S	S	*	*	H	α-helix	trans	-70.9	-34.1	179.7	-152.3	168.2	-171	178.2	0	112.4	K747 L748 S749 A755	K747-K751 VanDerWaalsContact O-CB 3.3Å; K747-K751 WeakPolarHBondContact O-CB 3.4Å; K747-K751 PolarHBondContact O-N 2.93Å; K747-K751 VanDerWaalsContact O-N 3.09Å; L748-K751 PolarHBondContact O-N 3.19Å; S749-K751 VanDerWaalsContact C-N 3.31Å; S749-K751 PolarHBondContact O-N 3.14Å; K751-A755 PolarHBondContact O-N 3.42Å; K751-A755 VanDerWaalsContact O-N 3.16Å
752	V	53.3	Low	51.3	Low	105 Å²	105	118.8 Å²	118.8	64%	0.636	62%	0.624	S	S	*	*	H	α-helix	trans	-70.6	-44	171.1	173.8	0	0	0	0	111.1	L748 S749 K754 A755 N756	L748-V752 WeakPolarHBondContact O-CG2 3.43Å; L748-V752 PolarHBondContact O-N 3.33Å; S749-V752 PolarHBondContact O-N 3.3Å; V752-K754 VanDerWaalsContact C-N 3.32Å; V752-K754 PolarHBondContact O-N 2.8Å; V752-A755 PolarHBondContact O-N 2.88Å; V752-N756 PolarHBondContact O-N 3.39Å; V752-N756 VanDerWaalsContact O-N 3.17Å
753	S	48.3	Very low	50	Low	64 Å²	64	124.5 Å²	124.5	45%	0.448	65%	0.646	S	S	.	*	H	α-helix	trans	-61.7	-37.7	175.8	-63	0	0	0	0	112.7	S749 E750 N756 N757	S749-S753 PolarHBondContact O-N 2.68Å; S749-S753 PolarHBondContact O-OG 2.89Å; E750-S753 PolarHBondContact O-N 2.82Å; S753-N756 PolarHBondContact O-N 3.44Å; S753-N757 PolarHBondContact O-ND2 2.95Å
754	K	45.2	Very low	48.5	Very low	129 Å²	129	126.2 Å²	126.2	56%	0.561	66%	0.662	S	S	*	*	H	α-helix	trans	-71.5	-29.8	175.4	-78.3	175	170.5	172.5	0	113.5	E750 V752	E750-K754 HydrophobicContact CG-CD 4.34Å; E750-K754 WeakPolarHBondContact O-CB 3.45Å; E750-K754 WeakPolarHBondContact O-CG 3.49Å; E750-K754 PolarHBondContact O-N 3.47Å; E750-K754 WeakPolarHBondContact OE1-CE 3.2Å; E750-K754 IonicContact OE1-NZ 2.64Å; E750-K754 PolarHBondContact OE1-NZ 3.15Å; V752-K754 VanDerWaalsContact C-N 3.32Å; V752-K754 PolarHBondContact O-N 2.8Å
755	A	46.4	Very low	46.6	Very low	75 Å²	75	123.7 Å²	123.7	62%	0.62	66%	0.664	S	S	*	*	H	α-helix	trans	-68.6	-37.6	173.2	0	0	0	0	0	112.5	K751 V752 N757	K751-A755 PolarHBondContact O-N 3.42Å; K751-A755 VanDerWaalsContact O-N 3.16Å; V752-A755 PolarHBondContact O-N 2.88Å; A755-N757 VanDerWaalsContact C-N 3.34Å; A755-N757 PolarHBondContact O-N 3.25Å
756	N	42.8	Very low	44.9	Very low	139 Å²	139	126.1 Å²	126.1	74%	0.743	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.3	9.5	-174	-153.8	86.3	0	0	0	115	V752 S753	V752-N756 PolarHBondContact O-N 3.39Å; V752-N756 VanDerWaalsContact O-N 3.17Å; S753-N756 PolarHBondContact O-N 3.44Å
757	N	41	Very low	42.9	Very low	129 Å²	129	125.6 Å²	125.6	69%	0.69	68%	0.679	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.2	6.6	178.7	-81.3	-88.1	0	0	0	113.7	S753 A755	S753-N757 PolarHBondContact O-ND2 2.95Å; A755-N757 VanDerWaalsContact C-N 3.34Å; A755-N757 PolarHBondContact O-N 3.25Å
758	H	42.8	Very low	41.4	Very low	170 Å²	170	125.9 Å²	125.9	79%	0.787	70%	0.696	S	S	*	*	S	Bend	trans	-115.4	12.6	-170.5	-100.7	-56.3	0	0	0	115.5
759	K	42.7	Very low	39.7	Very low	187 Å²	187	125.9 Å²	125.9	81%	0.813	71%	0.705	S	S	*	*	S	Bend	trans	-120.2	-15.9	-172.6	-145.5	-179.8	177.8	-173.5	0	117.3
760	D	42.8	Very low	37.9	Very low	159 Å²	159	127.9 Å²	127.9	85%	0.85	72%	0.719	S	S	*	*	S	Bend	trans	-123.7	54.4	-171.1	-66.6	-71.7	0	0	0	113.3
761	S	28.5	Very low	36.4	Very low	94 Å²	94	129.5 Å²	129.5	66%	0.657	74%	0.74	S	S	*	*			trans	-156.3	62.6	173.8	70.2	0	0	0	0	115.2
762	N	27.6	Very low	35.1	Very low	157 Å²	157	130.7 Å²	130.7	84%	0.84	75%	0.745	S	S	*	*			trans	168.6	112.8	135.7	-91.9	-25.5	0	0	0	113.9
763	M	29.2	Very low	33.9	Very low	188 Å²	188	132.6 Å²	132.6	93%	0.926	75%	0.751	S	S	*	*			trans	-154.2	120.5	134.8	-156.9	175.1	79.3	0	0	108
764	V	31.8	Very low	32.8	Very low	130 Å²	130	136 Å²	136	79%	0.788	76%	0.764	S	S	*	*			trans	-126.9	124	-169.9	175.7	0	0	0	0	111.2
765	G	26.6	Very low	32	Very low	60 Å²	60	137.6 Å²	137.6	62%	0.619	77%	0.774	S	S	*	*			trans	77.8	165.8	168.2	0	0	0	0	0	116
766	I	30.6	Very low	31.1	Very low	173 Å²	173	138.6 Å²	138.6	89%	0.887	78%	0.775	S	S	*	*			cis	-164.8	149.5	-5.5	-118.6	154.1	0	0	0	107.6
767	N	26.6	Very low	30.5	Very low	135 Å²	135	139.4 Å²	139.4	72%	0.722	77%	0.772	S	S	*	*			cis	-167.2	136.4	-28.5	168	53.3	0	0	0	108
768	S	28.7	Very low	30.2	Very low	120 Å²	120	140.3 Å²	140.3	84%	0.839	77%	0.766	S	S	*	*			trans	-143.9	119.3	172.8	-79.3	0	0	0	0	112.9
769	S	26.7	Very low	29.7	Very low	112 Å²	112	137.5 Å²	137.5	78%	0.783	75%	0.753	S	S	*	*			trans	-60.2	143.3	-178.1	51.4	0	0	0	0	116.9
770	S	24.4	Very low	29.6	Very low	113 Å²	113	132.6 Å²	132.6	79%	0.79	74%	0.743	S	S	*	*				-148.3	114.9	124.5	56.7	0	0	0	0	111.9
771	S	24.3	Very low	29.6	Very low	119 Å²	119	130.8 Å²	130.8	83%	0.832	74%	0.74	S	S	*	*			trans	-124.1	94	162	-61.4	0	0	0	0	107
772	F	27.6	Very low	29.6	Very low	186 Å²	186	132.2 Å²	132.2	82%	0.816	73%	0.734	S	S	*	*			trans	-147.1	119.3	175.3	-96.2	-82.8	0	0	0	108
773	L	27.4	Very low	29.5	Very low	146 Å²	146	130.6 Å²	130.6	76%	0.764	73%	0.726	S	S	*	*			trans	41.4	119.4	151.9	-52.8	173.3	0	0	0	116.9
774	D	25.1	Very low	29.3	Very low	135 Å²	135	126.1 Å²	126.1	72%	0.722	71%	0.712	S	S	*	*			cis	41.1	86.4	27.8	-147.9	-33.5	0	0	0	113.7
775	E	27.6	Very low	28.8	Very low	162 Å²	162	131.3 Å²	131.3	76%	0.757	72%	0.718	S	S	*	*				-149.4	156	114.4	-122.2	-171.3	104.8	0	0	114
776	C	29.3	Very low	28.7	Very low	97 Å²	97	133 Å²	133	66%	0.655	72%	0.72	S	S	*	*			trans	-49.2	172.7	176	-63.3	0	0	0	0	116.2
777	F	30.1	Very low	28.4	Very low	155 Å²	155	133.9 Å²	133.9	68%	0.68	72%	0.718	S	S	*	*				178.8	152.4	129.8	-92.7	-165.7	0	0	0	108.2
778	R	33.3	Very low	28.4	Very low	149 Å²	149	132.5 Å²	132.5	56%	0.562	72%	0.718	S	S	*	*			cis	-168.2	161.3	-12.6	-109.5	-171.9	135.1	106.4	-174.4	106.6
779	Q	32.3	Very low	28.2	Very low	111 Å²	111	132.5 Å²	132.5	52%	0.519	72%	0.718	S	S	.	*			cis	-167.4	176.5	-26.5	-133.6	174	21.1	0	0	108.3
780	S	40.2	Very low	28.1	Very low	84 Å²	84	132.2 Å²	132.2	59%	0.587	72%	0.716	S	S	*	*			trans	-66.1	145.7	153.6	162.1	0	0	0	0	110.3	F782	S780-F782 WeakPolarHBondContact O-CD2 3.38Å; S780-F782 WeakPolarHBondContact O-CE2 3.43Å
781	P	43.9	Very low	29.6	Very low	121 Å²	121	132.5 Å²	132.5	79%	0.786	72%	0.716	S	S	*	*			trans	-92.6	118.2	155.4	-9.7	28.7	0	0	0	109.2
782	F	28.6	Very low	29.6	Very low	123 Å²	123	131.1 Å²	131.1	54%	0.539	71%	0.711	S	S	.	*			cis	75.2	138.4	48.1	-78.2	-133	0	0	0	113	S780	S780-F782 WeakPolarHBondContact O-CD2 3.38Å; S780-F782 WeakPolarHBondContact O-CE2 3.43Å
783	N	25	Very low	29.5	Very low	124 Å²	124	130.6 Å²	130.6	66%	0.663	71%	0.711	S	S	*	*			cis	-159	172.3	-11.8	-131.4	-0.1	0	0	0	108.4
784	S	24.3	Very low	29.5	Very low	93 Å²	93	129 Å²	129	65%	0.65	71%	0.708	S	S	*	*				175.2	149.6	76.4	-64.4	0	0	0	0	113.1
785	R	22	Very low	29.7	Very low	239 Å²	239	128.2 Å²	128.2	90%	0.902	71%	0.708	S	S	*	*			trans	65.4	156.8	153.4	-73.7	-175.4	175.9	-166.6	-0.7	118.2
786	S	24.2	Very low	29.7	Very low	96 Å²	96	130.2 Å²	130.2	67%	0.671	71%	0.709	S	S	*	*			cis	-172.1	153.2	-23.7	53.5	0	0	0	0	112.9
787	K	25.9	Very low	29.7	Very low	192 Å²	192	133.7 Å²	133.7	84%	0.835	72%	0.715	S	S	*	*			trans	52.3	120.4	145.8	-100.8	-174.5	175.3	-176.2	0	121.7
788	S	24.8	Very low	29.5	Very low	105 Å²	105	129.9 Å²	129.9	73%	0.734	72%	0.719	S	S	*	*			trans	41.4	130.9	130	63	0	0	0	0	122.3
789	S	24.5	Very low	29.2	Very low	120 Å²	120	126.4 Å²	126.4	84%	0.839	73%	0.73	S	S	*	*			trans	-99.3	157.9	139.8	58	0	0	0	0	109
790	S	24.9	Very low	29	Very low	106 Å²	106	128.1 Å²	128.1	74%	0.741	75%	0.748	S	S	*	*			cis	-147.1	-174.6	17.2	70.2	0	0	0	0	110.2
791	P	57.3	Low	28.4	Very low	120 Å²	120	129.3 Å²	129.3	78%	0.779	76%	0.756	S	S	*	*			cis	-127.4	-164	-12.7	37.3	-18.7	0	0	0	113
792	A	23.5	Very low	29.1	Very low	89 Å²	89	129.1 Å²	129.1	74%	0.736	76%	0.755	S	S	*	*			trans	108.8	109.7	157.8	0	0	0	0	0	119.3
793	E	25.8	Very low	30	Very low	175 Å²	175	128.4 Å²	128.4	82%	0.818	76%	0.762	S	S	*	*			trans	63.1	128.9	131.7	-62	-144.3	100	0	0	124.6
794	T	27.8	Very low	30	Very low	113 Å²	113	132.1 Å²	132.1	69%	0.693	77%	0.768	S	S	*	*			trans	85	111.5	137.3	54.9	0	0	0	0	123.5
795	V	27.7	Very low	30.4	Very low	119 Å²	119	132 Å²	132	72%	0.721	77%	0.768	S	S	*	*				84.5	107.1	117.4	172.1	0	0	0	0	120.7
796	R	28.7	Very low	30.7	Very low	204 Å²	204	127.6 Å²	127.6	77%	0.77	76%	0.757	S	S	*	*			trans	92.8	126.7	135.5	-78.2	178.2	172.8	-161.6	-3.3	124
797	H	27.9	Very low	31	Very low	170 Å²	170	130.2 Å²	130.2	79%	0.787	76%	0.756	S	S	*	*			trans	55.8	149.2	137.1	-49.8	-41.8	0	0	0	120.3
798	G	27.7	Very low	31.1	Very low	74 Å²	74	127.5 Å²	127.5	76%	0.763	75%	0.751	S	S	*	*			cis	-114.5	-172.5	-8.3	0	0	0	0	0	111.7
799	G	25.2	Very low	31.4	Very low	77 Å²	77	130 Å²	130	79%	0.794	76%	0.756	S	S	*	*			cis	83	123.1	40.9	0	0	0	0	0	108.9
800	V	29.8	Very low	31.7	Very low	147 Å²	147	128 Å²	128	89%	0.891	76%	0.755	S	S	*	*			cis	-138.9	156.4	26	171	0	0	0	0	111.3
801	S	25.8	Very low	32	Very low	109 Å²	109	132 Å²	132	76%	0.762	76%	0.762	S	S	*	*			trans	-101.6	-133.6	178.8	-58.6	0	0	0	0	112.8
802	P	58.5	Low	31.5	Very low	117 Å²	117	131.5 Å²	131.5	76%	0.76	76%	0.759	S	S	*	*			trans	-109	-149.9	-138.5	32.9	-9.3	0	0	0	111.5
803	P	47.8	Very low	31.8	Very low	107 Å²	107	131.1 Å²	131.1	70%	0.695	76%	0.764	S	S	*	*				-142.8	-169.8	71.5	42.5	-23	0	0	0	112.6
804	Y	26.2	Very low	32	Very low	203 Å²	203	131.1 Å²	131.1	80%	0.796	77%	0.769	S	S	*	*			cis	-159.4	136.2	23.5	-158.7	-97.3	0	0	0	112.1
805	S	31.3	Very low	32	Very low	91 Å²	91	129.1 Å²	129.1	64%	0.636	77%	0.771	S	S	*	*			trans	53	147.9	154.7	72.6	0	0	0	0	122.6
806	E	29.3	Very low	32.1	Very low	146 Å²	146	132.1 Å²	132.1	68%	0.682	78%	0.782	S	S	*	*			cis	-174	157.6	-13.3	-110.2	-152.1	123.3	0	0	110.7
807	K	31.1	Very low	32.1	Very low	150 Å²	150	126.4 Å²	126.4	65%	0.652	78%	0.778	S	S	*	*			trans	63.6	155	156.9	-64.8	178.8	170.3	70	0	118.1
808	D	28.3	Very low	32.4	Very low	136 Å²	136	126.6 Å²	126.6	73%	0.727	78%	0.78	S	S	*	*			cis	-153.4	178.1	-10.6	-121.2	-157.2	0	0	0	110.6
809	D	30.7	Very low	32.4	Very low	156 Å²	156	134.7 Å²	134.7	83%	0.834	79%	0.787	S	S	*	*			trans	-45.5	162.5	-178.6	-69.7	-122.9	0	0	0	120.5
810	G	30.4	Very low	33.1	Very low	80 Å²	80	139.2 Å²	139.2	83%	0.825	79%	0.785	S	S	*	*			trans	136.9	113.1	143.5	0	0	0	0	0	118.7
811	E	30.9	Very low	33.4	Very low	188 Å²	188	139.3 Å²	139.3	88%	0.879	78%	0.78	S	S	*	*			trans	-94	166.3	159.6	-94	-127.9	127.2	0	0	111.2
812	P	47.6	Very low	34.2	Very low	111 Å²	111	142.4 Å²	142.4	72%	0.721	78%	0.782	S	S	*	*			cis	-128.6	156.5	-26.3	33.7	-17.8	0	0	0	113.1
813	G	28.9	Very low	33.7	Very low	81 Å²	81	143.7 Å²	143.7	84%	0.835	78%	0.778	S	S	*	*			trans	-153.7	139.3	179.5	0	0	0	0	0	114.9
814	N	29.9	Very low	34.3	Very low	175 Å²	175	145.8 Å²	145.8	94%	0.936	78%	0.778	S	S	*	*			trans	-85.6	134.2	-172.5	-101.4	-32.9	0	0	0	114.5
815	G	29.3	Very low	36.2	Very low	70 Å²	70	140.1 Å²	140.1	72%	0.722	76%	0.761	S	S	*	*			trans	77.1	129.9	154	0	0	0	0	0	116.3
816	L	29.2	Very low	37.7	Very low	183 Å²	183	138.2 Å²	138.2	96%	0.958	74%	0.741	S	S	*	*			cis	-159.6	122.5	44.1	-157.7	80.4	0	0	0	110.7
817	A	28.6	Very low	39.6	Very low	83 Å²	83	134.8 Å²	134.8	69%	0.686	73%	0.732	S	S	*	*			trans	-101.8	126.6	-179.7	0	0	0	0	0	112.7	W819	A817-W819 PolarHBondContact O-N 3.04Å
818	Q	33.2	Very low	41.8	Very low	175 Å²	175	127.7 Å²	127.7	82%	0.818	70%	0.701	S	S	*	*			trans	-66	108	179.9	-179.7	-175.2	21.9	0	0	112.8	K820	Q818-K820 PolarHBondContact O-N 2.8Å; Q818-K820 VanDerWaalsContact O-N 3.14Å
819	W	28.6	Very low	43.4	Very low	244 Å²	244	126.8 Å²	126.8	92%	0.924	70%	0.703	S	S	*	*			trans	-77.6	98.1	177.3	-73.6	76.9	0	0	0	112.4	A817 L821	A817-W819 PolarHBondContact O-N 3.04Å; W819-L821 PolarHBondContact O-N 3.08Å
820	K	39.1	Very low	44.9	Very low	172 Å²	172	123.8 Å²	123.8	75%	0.748	69%	0.69	S	S	*	*			trans	-75.1	100.5	165.5	-79.3	-177.9	176.7	174.4	0	110.6	Q818	Q818-K820 PolarHBondContact O-N 2.8Å; Q818-K820 VanDerWaalsContact O-N 3.14Å
821	L	35.8	Very low	46.7	Very low	149 Å²	149	122.5 Å²	122.5	78%	0.78	67%	0.668	S	S	*	*			trans	-89.6	118.9	168.2	-154.6	160.4	0	0	0	109.5	W819 E823	W819-L821 PolarHBondContact O-N 3.08Å; L821-E823 VanDerWaalsContact C-N 3.29Å; L821-E823 HydrophobicContact CD2-CG 3.99Å; L821-E823 PolarHBondContact O-N 3.1Å
822	H	42.9	Very low	48.4	Very low	174 Å²	174	116 Å²	116	81%	0.806	65%	0.651	S	S	*	*			trans	-75.2	77.8	175.8	-88.1	78.6	0	0	0	111	Q824	H822-Q824 VanDerWaalsContact C-N 3.35Å; H822-Q824 PolarHBondContact O-N 3.5Å
823	E	49.7	Very low	49.4	Very low	143 Å²	143	117 Å²	117	67%	0.668	64%	0.644	S	S	*	*			trans	-68.5	96.1	160.4	-71.7	-149.8	122	0	0	109	L821 L825	L821-E823 VanDerWaalsContact C-N 3.29Å; L821-E823 HydrophobicContact CD2-CG 3.99Å; L821-E823 PolarHBondContact O-N 3.1Å; E823-L825 HydrophobicContact CB-CD2 4.37Å; E823-L825 HydrophobicContact CB-CG 4.13Å; E823-L825 PolarHBondContact O-N 3.45Å
824	Q	60	Low	51	Low	152 Å²	152	117.1 Å²	117.1	71%	0.71	63%	0.628	S	S	*	*			trans	-73.7	77.3	171.8	-164	172.4	55.2	0	0	109.2	H822 F826	H822-Q824 VanDerWaalsContact C-N 3.35Å; H822-Q824 PolarHBondContact O-N 3.5Å; Q824-F826 HydrophobicContact CG-CE1 4.42Å; Q824-F826 HydrophobicContact CG-CZ 4.19Å; Q824-F826 WeakPolarHBondContact O-CD2 3.39Å; Q824-F826 WeakPolarHBondContact O-CE2 3.36Å
825	L	64.8	Low	53.5	Low	84 Å²	84	111 Å²	111	44%	0.44	59%	0.594	S	S	.	*			trans	-66.8	133.5	178.2	-68.9	177	0	0	0	110.3	E823 P827 V834	E823-L825 HydrophobicContact CB-CD2 4.37Å; E823-L825 HydrophobicContact CB-CG 4.13Å; E823-L825 PolarHBondContact O-N 3.45Å; L825-P827 WeakPolarHBondContact O-CD 3.21Å; L825-V834 HydrophobicContact CB-CG1 3.6Å; L825-V834 HydrophobicContact CD1-CG1 4.16Å; L825-V834 HydrophobicContact CD2-CG1 4.21Å; L825-V834 HydrophobicContact CG-CG1 4.21Å
826	F	63.4	Low	55.4	Low	50 Å²	50	110.4 Å²	110.4	22%	0.219	59%	0.588	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-104	94.8	-176.1	-62.8	-82.1	0	0	0	110.8	Q824 F835 Q838 L841	Q824-F826 HydrophobicContact CG-CE1 4.42Å; Q824-F826 HydrophobicContact CG-CZ 4.19Å; Q824-F826 WeakPolarHBondContact O-CD2 3.39Å; Q824-F826 WeakPolarHBondContact O-CE2 3.36Å; F826-F835 WeakPolarHBondContact CB-O 3.43Å; F826-F835 PolarHBondContact N-O 3.01Å; F826-F835 PolarHBondContact O-N 3.01Å; F826-Q838 HydrophobicContact CD1-CB 4.1Å; F826-Q838 HydrophobicContact CD1-CG 4.46Å; F826-Q838 VanDerWaalsContact CD1-OE1 3.28Å; F826-Q838 HydrophobicContact CD2-CB 4.12Å; F826-Q838 VanDerWaalsContact CD2-N 3.29Å; F826-Q838 HydrophobicContact CE1-CB 3.97Å; F826-Q838 HydrophobicContact CE1-CG 4.39Å; F826-Q838 HydrophobicContact CE2-CB 3.97Å; F826-Q838 HydrophobicContact CG-CB 4.19Å; F826-Q838 HydrophobicContact CZ-CB 3.91Å; F826-L841 HydrophobicContact CB-CB 4.05Å; F826-L841 HydrophobicContact CB-CD2 3.76Å
827	P	69.5	Low	57.7	Low	74 Å²	74	110.8 Å²	110.8	48%	0.481	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.2	144.6	175.8	30.7	-36.2	0	0	0	112.2	L825 P829 K833 V834 L841	L825-P827 WeakPolarHBondContact O-CD 3.21Å; P827-P829 WeakPolarHBondContact O-CD 3.35Å; P827-K833 CarbonylContact C-O 3.55Å; P827-V834 HydrophobicContact CB-CG2 4.33Å; P827-L841 VanDerWaalsContact O-CD2 3.32Å; P827-L841 WeakPolarHBondContact O-CD2 3.45Å
828	C	76.6	Confident	59.4	Low	2 Å²	2	111.2 Å²	111.2	1%	0.014	56%	0.564	C	S	.	*			trans	-80.9	115.6	171.8	-177.8	0	0	0	0	111.2	V830 C831 G832 K833 F835 L841 H844 H848	C828-V830 PolarHBondContact O-N 2.96Å; C828-C831 PolarHBondContact O-N 3.24Å; C828-G832 WeakPolarHBondContact O-CA 3.47Å; C828-G832 PolarHBondContact O-N 3.36Å; C828-K833 WeakPolarHBondContact CB-O 3.42Å; C828-K833 PolarHBondContact N-O 3.06Å; C828-F835 HydrophobicContact CB-CE2 4.39Å; C828-L841 HydrophobicContact CB-CD1 3.62Å; C828-H844 PolarHBondContact SG-CD2 3.22Å; C828-H848 PolarHBondContact SG-NE2 2.89Å
829	P	63.1	Low	61.1	Low	116 Å²	116	110.3 Å²	110.3	75%	0.753	56%	0.56	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.6	-15.9	179.3	24.2	-35.4	0	0	0	114.4	P827 L845	P827-P829 WeakPolarHBondContact O-CD 3.35Å; P829-L845 HydrophobicContact CG-CD2 4.39Å
830	V	61.9	Low	63.1	Low	93 Å²	93	101.2 Å²	101.2	56%	0.564	53%	0.531	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.4	-22	-177.8	-168.1	0	0	0	0	113.1	C828 L845 H848	C828-V830 PolarHBondContact O-N 2.96Å; V830-L845 HydrophobicContact CG2-CD2 4.33Å; V830-H848 HydrophobicContact CB-CB 4.41Å; V830-H848 HydrophobicContact CG1-CB 4.26Å; V830-H848 WeakPolarHBondContact CG1-ND1 3.3Å; V830-H848 HydrophobicContact CG2-CB 4.31Å
831	C	67.6	Low	64.6	Low	53 Å²	53	93.5 Å²	93.5	36%	0.358	50%	0.498	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.7	19.1	-179.4	75.2	0	0	0	0	116	C828 K833 H844 H848	C828-C831 PolarHBondContact O-N 3.24Å; C831-K833 PolarHBondContact O-N 2.95Å; C831-H844 PolarHBondContact SG-NE2 3.26Å; C831-H848 PolarHBondContact SG-NE2 3.48Å; C831-H848 VanDerWaalsContact SG-NE2 3.43Å
832	G	65.9	Low	66.2	Low	52 Å²	52	89.3 Å²	89.3	54%	0.536	48%	0.481	S	S	.	.			trans	69.4	-9.6	173.9	0	0	0	0	0	116.5	C828 V834	C828-G832 WeakPolarHBondContact O-CA 3.47Å; C828-G832 PolarHBondContact O-N 3.36Å; G832-V834 WeakPolarHBondContact O-CG2 3.49Å; G832-V834 PolarHBondContact O-N 2.07Å
833	K	68.6	Low	67.3	Low	131 Å²	131	88.9 Å²	88.9	57%	0.57	47%	0.473	S	S	*	.			trans	-65.6	125.3	-175.3	-69.8	-176.7	-179.5	-178.2	0	111.8	P827 C828 C831 F835	P827-K833 CarbonylContact C-O 3.55Å; C828-K833 WeakPolarHBondContact CB-O 3.42Å; C828-K833 PolarHBondContact N-O 3.06Å; C831-K833 PolarHBondContact O-N 2.95Å; K833-F835 HydrophobicContact CB-CE2 3.82Å; K833-F835 HydrophobicContact CB-CZ 4.01Å; K833-F835 VanDerWaalsContact O-CD2 3.3Å; K833-F835 WeakPolarHBondContact O-CD2 3.32Å; K833-F835 WeakPolarHBondContact O-CE2 3.41Å
834	V	63.3	Low	68.3	Low	84 Å²	84	83.6 Å²	83.6	51%	0.509	45%	0.448	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	134.5	-173.8	-171.2	0	0	0	0	110.6	L825 P827 G832	L825-V834 HydrophobicContact CB-CG1 3.6Å; L825-V834 HydrophobicContact CD1-CG1 4.16Å; L825-V834 HydrophobicContact CD2-CG1 4.21Å; L825-V834 HydrophobicContact CG-CG1 4.21Å; P827-V834 HydrophobicContact CB-CG2 4.33Å; G832-V834 WeakPolarHBondContact O-CG2 3.49Å; G832-V834 PolarHBondContact O-N 2.07Å
835	F	81.4	Confident	68.5	Low	48 Å²	48	78.7 Å²	78.7	21%	0.211	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	128.6	-179.7	-59.8	-88	0	0	0	110.8	F826 C828 K833 R837 L841 H844	F826-F835 WeakPolarHBondContact CB-O 3.43Å; F826-F835 PolarHBondContact N-O 3.01Å; F826-F835 PolarHBondContact O-N 3.01Å; C828-F835 HydrophobicContact CB-CE2 4.39Å; K833-F835 HydrophobicContact CB-CE2 3.82Å; K833-F835 HydrophobicContact CB-CZ 4.01Å; K833-F835 VanDerWaalsContact O-CD2 3.3Å; K833-F835 WeakPolarHBondContact O-CD2 3.32Å; K833-F835 WeakPolarHBondContact O-CE2 3.41Å; F835-R837 PolarHBondContact O-N 2.82Å; F835-L841 HydrophobicContact CB-CB 4.35Å; F835-L841 HydrophobicContact CD2-CB 4.09Å; F835-L841 HydrophobicContact CD2-CD1 3.92Å; F835-L841 HydrophobicContact CE2-CD1 4.15Å; F835-L841 HydrophobicContact CG-CB 4.45Å; F835-H844 HydrophobicContact CE1-CB 4.28Å; F835-H844 HydrophobicContact CE2-CB 3.85Å; F835-H844 AromaticContact CE2-CD2 3.38Å; F835-H844 WeakPolarHBondContact CE2-CD2 3.39Å; F835-H844 AromaticContact CE2-CG 3.61Å; F835-H844 HydrophobicContact CZ-CB 3.63Å; F835-H844 AromaticContact CZ-CD2 3.61Å; F835-H844 AromaticContact CZ-CG 3.38Å; F835-H844 AromaticContact CZ-ND1 3.85Å
836	G	70.7	Confident	68.4	Low	57 Å²	57	77.4 Å²	77.4	59%	0.588	42%	0.424	S	S	*	.	S	Bend	trans	-70.1	5.1	176.7	0	0	0	0	0	115.6
837	R	76.1	Confident	68.1	Low	191 Å²	191	78.3 Å²	78.3	72%	0.721	43%	0.431	S	S	*	.	S	Bend	trans	-147.1	132.9	175.4	-59	-175.6	-172.7	-179.2	2	111.5	F835 Q839 T840 L841	F835-R837 PolarHBondContact O-N 2.82Å; R837-Q839 VanDerWaalsContact C-N 3.28Å; R837-Q839 PolarHBondContact O-N 3.21Å; R837-T840 PolarHBondContact O-N 3.29Å; R837-T840 PolarHBondContact O-OG1 3.04Å; R837-L841 PolarHBondContact O-N 3.26Å
838	Q	65	Low	67.5	Low	92 Å²	92	78.1 Å²	78.1	43%	0.43	42%	0.424	S	S	.	.	H	α-helix	trans	-57.5	-38.1	179.4	-177.2	64.8	-33.2	0	0	112.8	F826 T840 L841 S842	F826-Q838 HydrophobicContact CD1-CB 4.1Å; F826-Q838 HydrophobicContact CD1-CG 4.46Å; F826-Q838 VanDerWaalsContact CD1-OE1 3.28Å; F826-Q838 HydrophobicContact CD2-CB 4.12Å; F826-Q838 VanDerWaalsContact CD2-N 3.29Å; F826-Q838 HydrophobicContact CE1-CB 3.97Å; F826-Q838 HydrophobicContact CE1-CG 4.39Å; F826-Q838 HydrophobicContact CE2-CB 3.97Å; F826-Q838 HydrophobicContact CG-CB 4.19Å; F826-Q838 HydrophobicContact CZ-CB 3.91Å; Q838-T840 PolarHBondContact O-N 3.46Å; Q838-L841 CarbonylContact O-C 3.55Å; Q838-L841 WeakPolarHBondContact O-CA 3.16Å; Q838-L841 PolarHBondContact O-N 3.25Å; Q838-S842 PolarHBondContact O-N 2.8Å; Q838-S842 PolarHBondContact O-OG 3.13Å; Q838-S842 VanDerWaalsContact O-OG 3.1Å
839	Q	69	Low	66.3	Low	155 Å²	155	82.9 Å²	82.9	72%	0.724	45%	0.453	S	S	*	.	H	α-helix	trans	-59.3	-32.8	177.3	-65.9	-177.3	0.7	0	0	113.7	R837 R843	R837-Q839 VanDerWaalsContact C-N 3.28Å; R837-Q839 PolarHBondContact O-N 3.21Å; Q839-R843 WeakPolarHBondContact O-CB 3.36Å; Q839-R843 PolarHBondContact O-N 3.17Å
840	T	69.8	Low	65.6	Low	54 Å²	54	79.9 Å²	79.9	33%	0.331	44%	0.442	S	S	.	.	H	α-helix	trans	-76.4	-35.5	173.6	30.5	0	0	0	0	112.2	R837 Q838 R843 H844	R837-T840 PolarHBondContact O-N 3.29Å; R837-T840 PolarHBondContact O-OG1 3.04Å; Q838-T840 PolarHBondContact O-N 3.46Å; T840-R843 PolarHBondContact O-N 3.47Å; T840-H844 WeakPolarHBondContact O-CB 3.49Å; T840-H844 PolarHBondContact O-N 3.37Å
841	L	72.4	Confident	64.5	Low	10 Å²	10	82.3 Å²	82.3	5%	0.052	45%	0.451	C	S	.	.	H	α-helix	trans	-65	-47.1	170.5	176.3	58.7	0	0	0	111.3	F826 P827 C828 F835 R837 Q838 R843 H844 L845	F826-L841 HydrophobicContact CB-CB 4.05Å; F826-L841 HydrophobicContact CB-CD2 3.76Å; P827-L841 VanDerWaalsContact O-CD2 3.32Å; P827-L841 WeakPolarHBondContact O-CD2 3.45Å; C828-L841 HydrophobicContact CB-CD1 3.62Å; F835-L841 HydrophobicContact CB-CB 4.35Å; F835-L841 HydrophobicContact CD2-CB 4.09Å; F835-L841 HydrophobicContact CD2-CD1 3.92Å; F835-L841 HydrophobicContact CE2-CD1 4.15Å; F835-L841 HydrophobicContact CG-CB 4.45Å; R837-L841 PolarHBondContact O-N 3.26Å; Q838-L841 CarbonylContact O-C 3.55Å; Q838-L841 WeakPolarHBondContact O-CA 3.16Å; Q838-L841 PolarHBondContact O-N 3.25Å; L841-R843 VanDerWaalsContact C-N 3.29Å; L841-R843 PolarHBondContact O-N 3.07Å; L841-H844 CarbonylContact O-C 3.5Å; L841-H844 WeakPolarHBondContact O-CA 3.49Å; L841-H844 WeakPolarHBondContact O-CB 3.41Å; L841-H844 PolarHBondContact O-N 2.99Å; L841-L845 HydrophobicContact CD1-CD1 4Å; L841-L845 HydrophobicContact CD1-CD2 4.4Å; L841-L845 HydrophobicContact CD1-CG 3.81Å; L841-L845 HydrophobicContact CD2-CD1 4.29Å; L841-L845 HydrophobicContact CG-CD1 3.8Å; L841-L845 HydrophobicContact CG-CG 4.13Å; L841-L845 WeakPolarHBondContact O-CB 3.19Å; L841-L845 WeakPolarHBondContact O-CG 2.99Å; L841-L845 PolarHBondContact O-N 2.93Å
842	S	68.3	Low	63.4	Low	60 Å²	60	83.8 Å²	83.8	42%	0.42	46%	0.456	S	S	.	.	H	α-helix	trans	-58.3	-40.5	177.3	-51.6	0	0	0	0	112	Q838 L845 S846	Q838-S842 PolarHBondContact O-N 2.8Å; Q838-S842 PolarHBondContact O-OG 3.13Å; Q838-S842 VanDerWaalsContact O-OG 3.1Å; S842-L845 PolarHBondContact O-N 3.38Å; S842-S846 PolarHBondContact O-N 2.91Å
843	R	65.8	Low	62.7	Low	166 Å²	166	87 Å²	87	63%	0.626	46%	0.455	S	S	*	.	H	α-helix	trans	-63.9	-40.8	173.4	-167.2	-175.4	-53	174.5	5.8	111.9	Q839 T840 L841 S846	Q839-R843 WeakPolarHBondContact O-CB 3.36Å; Q839-R843 PolarHBondContact O-N 3.17Å; T840-R843 PolarHBondContact O-N 3.47Å; L841-R843 VanDerWaalsContact C-N 3.29Å; L841-R843 PolarHBondContact O-N 3.07Å; R843-S846 PolarHBondContact O-N 3.15Å; R843-S846 PolarHBondContact O-OG 2.75Å
844	H	72.1	Confident	61.5	Low	31 Å²	31	85.7 Å²	85.7	14%	0.144	45%	0.453	C	S	.	.	H	α-helix	trans	-69.1	-38.4	176.2	178.2	65.4	0	0	0	112.6	C828 C831 F835 T840 L841 S846 L847 H848	C828-H844 PolarHBondContact SG-CD2 3.22Å; C831-H844 PolarHBondContact SG-NE2 3.26Å; F835-H844 HydrophobicContact CE1-CB 4.28Å; F835-H844 HydrophobicContact CE2-CB 3.85Å; F835-H844 AromaticContact CE2-CD2 3.38Å; F835-H844 WeakPolarHBondContact CE2-CD2 3.39Å; F835-H844 AromaticContact CE2-CG 3.61Å; F835-H844 HydrophobicContact CZ-CB 3.63Å; F835-H844 AromaticContact CZ-CD2 3.61Å; F835-H844 AromaticContact CZ-CG 3.38Å; F835-H844 AromaticContact CZ-ND1 3.85Å; T840-H844 WeakPolarHBondContact O-CB 3.49Å; T840-H844 PolarHBondContact O-N 3.37Å; L841-H844 CarbonylContact O-C 3.5Å; L841-H844 WeakPolarHBondContact O-CA 3.49Å; L841-H844 WeakPolarHBondContact O-CB 3.41Å; L841-H844 PolarHBondContact O-N 2.99Å; H844-S846 VanDerWaalsContact C-N 3.29Å; H844-S846 PolarHBondContact O-N 3.38Å; H844-L847 VanDerWaalsContact O-CB 3.29Å; H844-L847 WeakPolarHBondContact O-CB 3.28Å; H844-L847 PolarHBondContact O-N 3.41Å; H844-H848 AromaticContact CD2-NE2 3.76Å; H844-H848 AromaticContact CE1-NE2 3.47Å; H844-H848 PolarHBondContact CE1-NE2 2.84Å; H844-H848 AromaticContact NE2-CD2 3.75Å; H844-H848 AromaticContact NE2-NE2 3.03Å; H844-H848 PolarHBondContact NE2-NE2 3.03Å; H844-H848 PolarHBondContact O-CD2 2.89Å
845	L	63.1	Low	60.6	Low	49 Å²	49	82.1 Å²	82.1	26%	0.257	43%	0.432	S	S	.	.	H	α-helix	trans	-63.4	-33.9	172.6	-73.2	170.5	0	0	0	112	P829 V830 L841 S842 L847 H848 T849	P829-L845 HydrophobicContact CG-CD2 4.39Å; V830-L845 HydrophobicContact CG2-CD2 4.33Å; L841-L845 HydrophobicContact CD1-CD1 4Å; L841-L845 HydrophobicContact CD1-CD2 4.4Å; L841-L845 HydrophobicContact CD1-CG 3.81Å; L841-L845 HydrophobicContact CD2-CD1 4.29Å; L841-L845 HydrophobicContact CG-CD1 3.8Å; L841-L845 HydrophobicContact CG-CG 4.13Å; L841-L845 WeakPolarHBondContact O-CB 3.19Å; L841-L845 WeakPolarHBondContact O-CG 2.99Å; L841-L845 PolarHBondContact O-N 2.93Å; S842-L845 PolarHBondContact O-N 3.38Å; L845-L847 PolarHBondContact O-N 3.39Å; L845-L847 VanDerWaalsContact O-N 3.12Å; L845-H848 WeakPolarHBondContact O-CA 3.48Å; L845-H848 PolarHBondContact O-N 3.02Å; L845-T849 PolarHBondContact O-N 2.87Å; L845-T849 PolarHBondContact O-OG1 3.07Å
846	S	63.3	Low	59	Low	57 Å²	57	89.8 Å²	89.8	40%	0.399	47%	0.465	S	S	.	.	H	α-helix	trans	-65.4	-11.1	172.7	77.8	0	0	0	0	114.6	S842 R843 H844	S842-S846 PolarHBondContact O-N 2.91Å; R843-S846 PolarHBondContact O-N 3.15Å; R843-S846 PolarHBondContact O-OG 2.75Å; H844-S846 VanDerWaalsContact C-N 3.29Å; H844-S846 PolarHBondContact O-N 3.38Å
847	L	56.9	Low	57.7	Low	69 Å²	69	91.8 Å²	91.8	36%	0.361	46%	0.46	S	S	.	.	H	α-helix	trans	-87.1	-23.7	168.8	-55.5	173.4	0	0	0	112.5	H844 L845 K863	H844-L847 VanDerWaalsContact O-CB 3.29Å; H844-L847 WeakPolarHBondContact O-CB 3.28Å; H844-L847 PolarHBondContact O-N 3.41Å; L845-L847 PolarHBondContact O-N 3.39Å; L845-L847 VanDerWaalsContact O-N 3.12Å; L847-K863 HydrophobicContact CD2-CB 4.2Å; L847-K863 HydrophobicContact CD2-CG 4.4Å
848	H	55.8	Low	56.2	Low	71 Å²	71	84.4 Å²	84.4	33%	0.329	44%	0.437	S	S	.	.	H	α-helix	trans	-84.1	-31.6	174.4	-67.7	-71.7	0	0	0	112	C828 V830 C831 H844 L845 G850	C828-H848 PolarHBondContact SG-NE2 2.89Å; V830-H848 HydrophobicContact CB-CB 4.41Å; V830-H848 HydrophobicContact CG1-CB 4.26Å; V830-H848 WeakPolarHBondContact CG1-ND1 3.3Å; V830-H848 HydrophobicContact CG2-CB 4.31Å; C831-H848 PolarHBondContact SG-NE2 3.48Å; C831-H848 VanDerWaalsContact SG-NE2 3.43Å; H844-H848 AromaticContact CD2-NE2 3.76Å; H844-H848 AromaticContact CE1-NE2 3.47Å; H844-H848 PolarHBondContact CE1-NE2 2.84Å; H844-H848 AromaticContact NE2-CD2 3.75Å; H844-H848 AromaticContact NE2-NE2 3.03Å; H844-H848 PolarHBondContact NE2-NE2 3.03Å; H844-H848 PolarHBondContact O-CD2 2.89Å; L845-H848 WeakPolarHBondContact O-CA 3.48Å; L845-H848 PolarHBondContact O-N 3.02Å; H848-G850 PolarHBondContact O-N 3.06Å
849	T	52.8	Low	55.3	Low	102 Å²	102	85.6 Å²	85.6	63%	0.626	45%	0.453	S	S	*	.	S	Bend	trans	-82.4	21.6	178.8	60.4	0	0	0	0	114.8	L845 L851	L845-T849 PolarHBondContact O-N 2.87Å; L845-T849 PolarHBondContact O-OG1 3.07Å; T849-L851 VanDerWaalsContact C-N 3.34Å; T849-L851 PolarHBondContact O-N 3.24Å; T849-L851 VanDerWaalsContact O-N 3.13Å
850	G	48.3	Very low	54.1	Low	52 Å²	52	83 Å²	83	54%	0.536	44%	0.437	S	S	.	.			trans	76.6	-3.2	159.5	0	0	0	0	0	118.4	H848 N852	H848-G850 PolarHBondContact O-N 3.06Å; G850-N852 PolarHBondContact O-N 3.13Å
851	L	38.9	Very low	52.9	Low	144 Å²	144	82.5 Å²	82.5	75%	0.754	44%	0.439	S	S	*	.			trans	-78.3	50.4	-179.7	-66.8	-178.9	0	0	0	114	T849 K853	T849-L851 VanDerWaalsContact C-N 3.34Å; T849-L851 PolarHBondContact O-N 3.24Å; T849-L851 VanDerWaalsContact O-N 3.13Å; L851-K853 PolarHBondContact O-N 2.66Å
852	N	44.1	Very low	51.9	Low	84 Å²	84	82.1 Å²	82.1	45%	0.449	44%	0.437	S	S	.	.			trans	-59.2	121.4	171	-78.7	-39.3	0	0	0	110.5	G850 I854 A861	G850-N852 PolarHBondContact O-N 3.13Å; N852-I854 HydrophobicContact CB-CG1 4.33Å; N852-I854 PolarHBondContact O-N 3.44Å; N852-I854 VanDerWaalsContact O-N 3.11Å; N852-A861 HydrophobicContact CB-CB 4.3Å
853	K	51.1	Low	50.8	Low	120 Å²	120	87.3 Å²	87.3	52%	0.522	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	87.2	174	-57.4	-142.5	176.3	-155.8	0	109.3	L851 A862 L868	L851-K853 PolarHBondContact O-N 2.66Å; K853-A862 PolarHBondContact O-N 3.47Å; K853-L868 HydrophobicContact CB-CD2 3.85Å
854	I	43.4	Very low	49.8	Very low	104 Å²	104	82 Å²	82	53%	0.533	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	141.1	176.9	-49	175.7	0	0	0	109.3	N852 Y860 A861	N852-I854 HydrophobicContact CB-CG1 4.33Å; N852-I854 PolarHBondContact O-N 3.44Å; N852-I854 VanDerWaalsContact O-N 3.11Å; I854-Y860 WeakPolarHBondContact CA-O 3.45Å; I854-A861 HydrophobicContact CG1-CB 4.28Å
855	C	43.7	Very low	48.6	Very low	8 Å²	8	89 Å²	89	5%	0.054	47%	0.465	C	S	.	.			trans	-67.6	136.3	170.4	-175	0	0	0	0	110.6	M857 C858 Y860 L868 H871 H875	C855-M857 PolarHBondContact O-N 2.95Å; C855-M857 PolarHBondContact SG-N 3.44Å; C855-M857 VanDerWaalsContact SG-N 3.43Å; C855-C858 WeakPolarHBondContact CB-O 3.49Å; C855-Y860 PolarHBondContact N-O 2.84Å; C855-L868 HydrophobicContact CB-CD1 3.92Å; C855-H871 VanDerWaalsContact SG-CD2 3.59Å; C855-H871 PolarHBondContact SG-NE2 2.83Å; C855-H871 VanDerWaalsContact SG-NE2 3.43Å; C855-H875 PolarHBondContact SG-NE2 2.94Å; C855-H875 VanDerWaalsContact SG-NE2 3.39Å
856	K	47.7	Very low	47.9	Very low	210 Å²	210	89.8 Å²	89.8	91%	0.913	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-15.6	176	-69	-166.6	173.4	-167	0	113.8
857	M	44.8	Very low	47.3	Very low	99 Å²	99	90.5 Å²	90.5	49%	0.488	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	-13	-174.8	-53	-54.8	-69	0	0	114	C855	C855-M857 PolarHBondContact O-N 2.95Å; C855-M857 PolarHBondContact SG-N 3.44Å; C855-M857 VanDerWaalsContact SG-N 3.43Å
858	C	44.9	Very low	47.1	Very low	35 Å²	35	88.1 Å²	88.1	24%	0.236	47%	0.466	C	S	.	.	S	Bend	trans	-163.1	161.7	177.1	81.4	0	0	0	0	110.9	C855 Y860 H871 H875	C855-C858 WeakPolarHBondContact CB-O 3.49Å; C858-Y860 PolarHBondContact O-N 3.31Å; C858-Y860 VanDerWaalsContact SG-CB 3.57Å; C858-H871 PolarHBondContact SG-CE1 2.86Å; C858-H871 PolarHBondContact SG-NE2 3.48Å; C858-H875 PolarHBondContact SG-NE2 3.21Å; C858-H875 VanDerWaalsContact SG-NE2 3.44Å
859	P	45.2	Very low	46.8	Very low	117 Å²	117	88.7 Å²	88.7	76%	0.76	47%	0.471	S	S	*	.	S	Bend	trans	-69.7	17.4	-175.3	28.9	-36.3	0	0	0	115.9	A861	P859-A861 PolarHBondContact O-N 3.32Å
860	Y	43.3	Very low	46.9	Very low	100 Å²	100	90.3 Å²	90.3	39%	0.392	47%	0.472	S	S	.	.			trans	-71.4	111.1	177.5	-178.2	-103.5	0	0	0	112	I854 C855 C858 A862 H871	I854-Y860 WeakPolarHBondContact CA-O 3.45Å; C855-Y860 PolarHBondContact N-O 2.84Å; C858-Y860 PolarHBondContact O-N 3.31Å; C858-Y860 VanDerWaalsContact SG-CB 3.57Å; Y860-A862 HydrophobicContact CD1-CB 4.34Å; Y860-A862 HydrophobicContact CE1-CB 3.83Å; Y860-H871 HydrophobicContact CD1-CB 3.91Å; Y860-H871 AromaticContact CD1-CD2 3.7Å; Y860-H871 AromaticContact CD1-CE1 3.94Å; Y860-H871 AromaticContact CD1-CG 3.45Å; Y860-H871 VanDerWaalsContact CD1-CG 3.45Å; Y860-H871 AromaticContact CD1-ND1 3.61Å; Y860-H871 HydrophobicContact CE1-CB 3.76Å; Y860-H871 AromaticContact CE1-CG 3.81Å; Y860-H871 AromaticContact CG-CE1 3.88Å; Y860-H871 AromaticContact CG-ND1 3.85Å
861	A	44.1	Very low	47.4	Very low	45 Å²	45	89.2 Å²	89.2	37%	0.372	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	112	172.7	0	0	0	0	0	111.5	N852 I854 P859	N852-A861 HydrophobicContact CB-CB 4.3Å; I854-A861 HydrophobicContact CG1-CB 4.28Å; P859-A861 PolarHBondContact O-N 3.32Å
862	A	52.4	Low	48.1	Very low	2 Å²	2	85.5 Å²	85.5	2%	0.017	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	128.6	-179.1	0	0	0	0	0	112.3	K853 Y860 C864 N867 L868	K853-A862 PolarHBondContact O-N 3.47Å; Y860-A862 HydrophobicContact CD1-CB 4.34Å; Y860-A862 HydrophobicContact CE1-CB 3.83Å; A862-C864 PolarHBondContact O-N 2.74Å; A862-C864 VanDerWaalsContact O-N 3.14Å; A862-N867 HydrophobicContact CB-CB 4.39Å; A862-L868 HydrophobicContact CB-CB 3.62Å; A862-L868 HydrophobicContact CB-CD1 4.15Å; A862-L868 HydrophobicContact CB-CG 4.41Å
863	K	44.4	Very low	48.7	Very low	168 Å²	168	84.8 Å²	84.8	73%	0.73	43%	0.432	S	S	*	.	S	Bend	trans	-67.6	-8.9	178	-63.3	-179.1	-178.8	175.7	0	114.6	L847	L847-K863 HydrophobicContact CD2-CB 4.2Å; L847-K863 HydrophobicContact CD2-CG 4.4Å
864	C	45.8	Very low	49	Very low	56 Å²	56	84.6 Å²	84.6	38%	0.378	44%	0.435	S	S	.	.	S	Bend	trans	-158.8	162.1	171.5	71.7	0	0	0	0	111.3	A862 A866 N867 L868	A862-C864 PolarHBondContact O-N 2.74Å; A862-C864 VanDerWaalsContact O-N 3.14Å; C864-A866 VanDerWaalsContact C-N 3.28Å; C864-A866 PolarHBondContact O-N 2.88Å; C864-N867 PolarHBondContact O-N 3.11Å; C864-N867 VanDerWaalsContact SG-CG 3.59Å; C864-N867 PolarHBondContact SG-N 2.61Å; C864-N867 VanDerWaalsContact SG-N 3.43Å; C864-N867 PolarHBondContact SG-OD1 3.43Å; C864-L868 PolarHBondContact O-N 3.37Å; C864-L868 VanDerWaalsContact O-N 3.08Å
865	R	46.8	Very low	49.5	Very low	176 Å²	176	81.8 Å²	81.8	66%	0.664	42%	0.42	S	S	*	.	H	α-helix	trans	-63.4	-30	179.9	-170.3	174	-174	158.9	3.6	113.3	L868 N869	R865-L868 PolarHBondContact O-N 3.15Å; R865-N869 WeakPolarHBondContact O-CB 3.26Å; R865-N869 VanDerWaalsContact O-CG 3.31Å; R865-N869 PolarHBondContact O-N 3.45Å; R865-N869 PolarHBondContact O-OD1 3.05Å
866	A	47.6	Very low	49.7	Very low	66 Å²	66	84.2 Å²	84.2	55%	0.545	44%	0.437	S	S	.	.	H	α-helix	trans	-65.5	-47.1	176.8	0	0	0	0	0	111.7	C864 L868 N869 Q870	C864-A866 VanDerWaalsContact C-N 3.28Å; C864-A866 PolarHBondContact O-N 2.88Å; A866-L868 VanDerWaalsContact C-N 3.31Å; A866-L868 PolarHBondContact O-N 3.36Å; A866-N869 PolarHBondContact O-N 2.92Å; A866-Q870 PolarHBondContact O-N 3.37Å
867	N	50.7	Low	49.5	Very low	72 Å²	72	79.9 Å²	79.9	39%	0.385	43%	0.428	S	S	.	.	H	α-helix	trans	-65.9	-33.8	175.4	-68.9	31.2	0	0	0	111.7	A862 C864 H871	A862-N867 HydrophobicContact CB-CB 4.39Å; C864-N867 PolarHBondContact O-N 3.11Å; C864-N867 VanDerWaalsContact SG-CG 3.59Å; C864-N867 PolarHBondContact SG-N 2.61Å; C864-N867 VanDerWaalsContact SG-N 3.43Å; C864-N867 PolarHBondContact SG-OD1 3.43Å; N867-H871 VanDerWaalsContact O-CB 3.32Å; N867-H871 WeakPolarHBondContact O-CB 3.4Å; N867-H871 PolarHBondContact O-N 2.96Å
868	L	52.7	Low	49.5	Very low	20 Å²	20	81 Å²	81	11%	0.105	43%	0.43	C	S	.	.	H	α-helix	trans	-64.6	-45.3	171.9	-172.4	56.2	0	0	0	111.4	K853 C855 A862 C864 R865 A866 Q870 H871 L872	K853-L868 HydrophobicContact CB-CD2 3.85Å; C855-L868 HydrophobicContact CB-CD1 3.92Å; A862-L868 HydrophobicContact CB-CB 3.62Å; A862-L868 HydrophobicContact CB-CD1 4.15Å; A862-L868 HydrophobicContact CB-CG 4.41Å; C864-L868 PolarHBondContact O-N 3.37Å; C864-L868 VanDerWaalsContact O-N 3.08Å; R865-L868 PolarHBondContact O-N 3.15Å; A866-L868 VanDerWaalsContact C-N 3.31Å; A866-L868 PolarHBondContact O-N 3.36Å; L868-Q870 PolarHBondContact O-N 2.93Å; L868-H871 CarbonylContact O-C 3.6Å; L868-H871 PolarHBondContact O-N 2.75Å; L868-L872 HydrophobicContact CD1-CD1 4.46Å; L868-L872 HydrophobicContact CD1-CG 4.37Å; L868-L872 HydrophobicContact CG-CD1 3.97Å; L868-L872 HydrophobicContact CG-CG 4.34Å; L868-L872 WeakPolarHBondContact O-CB 3.43Å; L868-L872 VanDerWaalsContact O-CG 3.28Å; L868-L872 WeakPolarHBondContact O-CG 3.25Å; L868-L872 PolarHBondContact O-N 3.1Å
869	N	50	Low	49.2	Very low	82 Å²	82	83.9 Å²	83.9	44%	0.439	44%	0.443	S	S	.	.	H	α-helix	trans	-63.4	-40.7	177.4	-75.1	4.8	0	0	0	111.5	R865 A866 H871 L872 T873	R865-N869 WeakPolarHBondContact O-CB 3.26Å; R865-N869 VanDerWaalsContact O-CG 3.31Å; R865-N869 PolarHBondContact O-N 3.45Å; R865-N869 PolarHBondContact O-OD1 3.05Å; A866-N869 PolarHBondContact O-N 2.92Å; N869-H871 VanDerWaalsContact C-N 3.32Å; N869-H871 PolarHBondContact O-N 3.17Å; N869-L872 CarbonylContact O-C 3.58Å; N869-L872 PolarHBondContact O-N 2.82Å; N869-T873 PolarHBondContact O-N 3.21Å; N869-T873 PolarHBondContact O-OG1 2.84Å
870	Q	56	Low	48.8	Very low	137 Å²	137	84.3 Å²	84.3	64%	0.64	44%	0.443	S	S	*	.	H	α-helix	trans	-64.7	-36.6	175.4	-171.2	177.2	6.8	0	0	112	A866 L868 T873	A866-Q870 PolarHBondContact O-N 3.37Å; L868-Q870 PolarHBondContact O-N 2.93Å; Q870-T873 WeakPolarHBondContact CA-OG1 3.37Å; Q870-T873 PolarHBondContact O-N 3.38Å; Q870-T873 PolarHBondContact O-OG1 3.32Å
871	H	57.4	Low	48.6	Very low	28 Å²	28	87.5 Å²	87.5	13%	0.13	46%	0.461	C	S	.	.	H	α-helix	trans	-69	-39.6	171.4	173	81.5	0	0	0	112.1	C855 C858 Y860 N867 L868 N869 T873 I874 H875	C855-H871 VanDerWaalsContact SG-CD2 3.59Å; C855-H871 PolarHBondContact SG-NE2 2.83Å; C855-H871 VanDerWaalsContact SG-NE2 3.43Å; C858-H871 PolarHBondContact SG-CE1 2.86Å; C858-H871 PolarHBondContact SG-NE2 3.48Å; Y860-H871 HydrophobicContact CD1-CB 3.91Å; Y860-H871 AromaticContact CD1-CD2 3.7Å; Y860-H871 AromaticContact CD1-CE1 3.94Å; Y860-H871 AromaticContact CD1-CG 3.45Å; Y860-H871 VanDerWaalsContact CD1-CG 3.45Å; Y860-H871 AromaticContact CD1-ND1 3.61Å; Y860-H871 HydrophobicContact CE1-CB 3.76Å; Y860-H871 AromaticContact CE1-CG 3.81Å; Y860-H871 AromaticContact CG-CE1 3.88Å; Y860-H871 AromaticContact CG-ND1 3.85Å; N867-H871 VanDerWaalsContact O-CB 3.32Å; N867-H871 WeakPolarHBondContact O-CB 3.4Å; N867-H871 PolarHBondContact O-N 2.96Å; L868-H871 CarbonylContact O-C 3.6Å; L868-H871 PolarHBondContact O-N 2.75Å; N869-H871 VanDerWaalsContact C-N 3.32Å; N869-H871 PolarHBondContact O-N 3.17Å; H871-T873 VanDerWaalsContact C-N 3.27Å; H871-T873 PolarHBondContact O-N 3.17Å; H871-I874 VanDerWaalsContact O-CB 3.26Å; H871-I874 WeakPolarHBondContact O-CB 3.45Å; H871-I874 PolarHBondContact O-N 3.23Å; H871-H875 AromaticContact CD2-NE2 3.25Å; H871-H875 PolarHBondContact CD2-NE2 2.87Å; H871-H875 VanDerWaalsContact CD2-NE2 3.25Å; H871-H875 AromaticContact CE1-NE2 2.94Å; H871-H875 PolarHBondContact CE1-NE2 3.2Å; H871-H875 AromaticContact ND1-NE2 3.95Å; H871-H875 AromaticContact NE2-CD2 3.85Å; H871-H875 AromaticContact NE2-NE2 2.33Å; H871-H875 PolarHBondContact NE2-NE2 3.02Å; H871-H875 PolarHBondContact O-CD2 3.17Å
872	L	53.1	Low	48.3	Very low	66 Å²	66	91 Å²	91	35%	0.346	48%	0.478	S	S	.	.	H	α-helix	trans	-65.3	-28.1	173.6	-72.1	169.7	0	0	0	112.4	L868 N869 I874 H875 S876	L868-L872 HydrophobicContact CD1-CD1 4.46Å; L868-L872 HydrophobicContact CD1-CG 4.37Å; L868-L872 HydrophobicContact CG-CD1 3.97Å; L868-L872 HydrophobicContact CG-CG 4.34Å; L868-L872 WeakPolarHBondContact O-CB 3.43Å; L868-L872 VanDerWaalsContact O-CG 3.28Å; L868-L872 WeakPolarHBondContact O-CG 3.25Å; L868-L872 PolarHBondContact O-N 3.1Å; N869-L872 CarbonylContact O-C 3.58Å; N869-L872 PolarHBondContact O-N 2.82Å; L872-I874 PolarHBondContact O-N 2.8Å; L872-H875 WeakPolarHBondContact O-CB 3Å; L872-H875 PolarHBondContact O-N 2.92Å; L872-H875 VanDerWaalsContact O-N 3.14Å; L872-S876 PolarHBondContact O-N 3.21Å
873	T	56.6	Low	47.7	Very low	69 Å²	69	95.5 Å²	95.5	42%	0.423	50%	0.502	S	S	.	.	H	α-helix	trans	-69.4	-18.8	169.9	47.8	0	0	0	0	113.8	N869 Q870 H871 H875 S876 V877	N869-T873 PolarHBondContact O-N 3.21Å; N869-T873 PolarHBondContact O-OG1 2.84Å; Q870-T873 WeakPolarHBondContact CA-OG1 3.37Å; Q870-T873 PolarHBondContact O-N 3.38Å; Q870-T873 PolarHBondContact O-OG1 3.32Å; H871-T873 VanDerWaalsContact C-N 3.27Å; H871-T873 PolarHBondContact O-N 3.17Å; T873-H875 VanDerWaalsContact C-N 3.34Å; T873-S876 WeakPolarHBondContact CA-OG 3.39Å; T873-S876 PolarHBondContact O-N 3.18Å; T873-V877 WeakPolarHBondContact O-CB 3.36Å; T873-V877 WeakPolarHBondContact O-CG2 3.4Å; T873-V877 PolarHBondContact O-N 3.08Å; T873-V877 VanDerWaalsContact O-N 3.15Å
874	I	58.8	Low	47.5	Very low	116 Å²	116	89.5 Å²	89.5	60%	0.595	48%	0.484	S	S	*	.	H	α-helix	trans	-68.4	-38.9	169.1	-53.3	173.9	0	0	0	109.6	H871 L872	H871-I874 VanDerWaalsContact O-CB 3.26Å; H871-I874 WeakPolarHBondContact O-CB 3.45Å; H871-I874 PolarHBondContact O-N 3.23Å; L872-I874 PolarHBondContact O-N 2.8Å
875	H	54.3	Low	47.2	Very low	45 Å²	45	94.7 Å²	94.7	21%	0.208	50%	0.503	C	S	.	.	H	α-helix	trans	-70.2	-39.1	172.1	-63.1	-79.7	0	0	0	112.4	C855 C858 H871 L872 T873 S922	C855-H875 PolarHBondContact SG-NE2 2.94Å; C855-H875 VanDerWaalsContact SG-NE2 3.39Å; C858-H875 PolarHBondContact SG-NE2 3.21Å; C858-H875 VanDerWaalsContact SG-NE2 3.44Å; H871-H875 AromaticContact CD2-NE2 3.25Å; H871-H875 PolarHBondContact CD2-NE2 2.87Å; H871-H875 VanDerWaalsContact CD2-NE2 3.25Å; H871-H875 AromaticContact CE1-NE2 2.94Å; H871-H875 PolarHBondContact CE1-NE2 3.2Å; H871-H875 AromaticContact ND1-NE2 3.95Å; H871-H875 AromaticContact NE2-CD2 3.85Å; H871-H875 AromaticContact NE2-NE2 2.33Å; H871-H875 PolarHBondContact NE2-NE2 3.02Å; H871-H875 PolarHBondContact O-CD2 3.17Å; L872-H875 WeakPolarHBondContact O-CB 3Å; L872-H875 PolarHBondContact O-N 2.92Å; L872-H875 VanDerWaalsContact O-N 3.14Å; T873-H875 VanDerWaalsContact C-N 3.34Å; H875-S922 PolarHBondContact CE1-OG 3Å; H875-S922 VanDerWaalsContact CE1-OG 3.32Å
876	S	47.4	Very low	46.7	Very low	59 Å²	59	92.7 Å²	92.7	41%	0.413	50%	0.501	S	S	.	.	H	α-helix	trans	-75.8	-22.8	-175.2	82.8	0	0	0	0	114.8	L872 T873 K878 L879	L872-S876 PolarHBondContact O-N 3.21Å; T873-S876 WeakPolarHBondContact CA-OG 3.39Å; T873-S876 PolarHBondContact O-N 3.18Å; S876-K878 PolarHBondContact O-N 3.41Å; S876-L879 PolarHBondContact O-N 2.83Å
877	V	43.3	Very low	46.6	Very low	119 Å²	119	93.6 Å²	93.6	72%	0.721	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-8.8	-176	160.4	0	0	0	0	113.8	T873	T873-V877 WeakPolarHBondContact O-CB 3.36Å; T873-V877 WeakPolarHBondContact O-CG2 3.4Å; T873-V877 PolarHBondContact O-N 3.08Å; T873-V877 VanDerWaalsContact O-N 3.15Å
878	K	44	Very low	46	Very low	124 Å²	124	94.5 Å²	94.5	54%	0.539	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-121.6	11.5	170.4	-81.9	-176	173.1	179.2	0	114.7	S876 V880 S925	S876-K878 PolarHBondContact O-N 3.41Å; K878-V880 VanDerWaalsContact C-N 3.34Å; K878-V880 PolarHBondContact O-N 2.87Å; K878-S925 PolarHBondContact NZ-O 2.91Å
879	L	38.5	Very low	45.2	Very low	94 Å²	94	96.9 Å²	96.9	49%	0.492	52%	0.522	S	S	.	.			trans	-95.2	39.5	176.9	-86.5	167.8	0	0	0	113.3	S876 A884	S876-L879 PolarHBondContact O-N 2.83Å; L879-A884 HydrophobicContact CD2-CB 4.44Å
880	V	37.4	Very low	44.9	Very low	126 Å²	126	96 Å²	96	76%	0.764	53%	0.526	S	S	*	.	S	Bend	trans	-133.1	58.6	173.9	-167	0	0	0	0	110.3	K878	K878-V880 VanDerWaalsContact C-N 3.34Å; K878-V880 PolarHBondContact O-N 2.87Å
881	Q	40	Very low	44.1	Very low	168 Å²	168	93.8 Å²	93.8	79%	0.785	52%	0.521	S	S	*	.	S	Bend	trans	-165.2	134.7	147.3	-148.2	84.5	8.8	0	0	106.2
882	T	38.1	Very low	43	Very low	118 Å²	118	97.2 Å²	97.2	72%	0.724	54%	0.544	S	S	*	.	S	Bend	trans	66.5	154.7	-171.2	78.4	0	0	0	0	116.7	A884	T882-A884 PolarHBondContact O-N 3.45Å
883	D	38.1	Very low	42.1	Very low	97 Å²	97	98.1 Å²	98.1	52%	0.519	56%	0.561	S	S	.	*			trans	-75.1	105.7	-153.8	-55.6	-26.9	0	0	0	114.1	E885 Q886 I887	D883-E885 PolarHBondContact O-N 2.83Å; D883-E885 VanDerWaalsContact O-N 3.13Å; D883-Q886 HydrophobicContact CB-CB 4.24Å; D883-Q886 HydrophobicContact CB-CG 3.92Å; D883-Q886 PolarHBondContact O-N 3.44Å; D883-Q886 VanDerWaalsContact O-N 3.13Å; D883-Q886 PolarHBondContact OD2-NE2 3.23Å; D883-I887 PolarHBondContact O-N 3.24Å
884	A	40.8	Very low	41.6	Very low	42 Å²	42	98.4 Å²	98.4	35%	0.347	56%	0.56	S	S	.	*	H	α-helix	trans	-56.8	-28.7	174.9	0	0	0	0	0	113.2	L879 T882 V888	L879-A884 HydrophobicContact CD2-CB 4.44Å; T882-A884 PolarHBondContact O-N 3.45Å; A884-V888 WeakPolarHBondContact O-CB 3.43Å; A884-V888 VanDerWaalsContact O-CG2 3.27Å; A884-V888 WeakPolarHBondContact O-CG2 3.49Å; A884-V888 PolarHBondContact O-N 3.4Å
885	E	40.3	Very low	40.6	Very low	165 Å²	165	98.2 Å²	98.2	77%	0.771	57%	0.569	S	S	*	*	H	α-helix	trans	-72.3	-34.8	179.4	-61	-171.8	167.4	0	0	112.6	D883 S889	D883-E885 PolarHBondContact O-N 2.83Å; D883-E885 VanDerWaalsContact O-N 3.13Å; E885-S889 VanDerWaalsContact O-CB 3.24Å; E885-S889 WeakPolarHBondContact O-CB 3.35Å; E885-S889 PolarHBondContact O-N 3.23Å; E885-S889 PolarHBondContact O-OG 3.19Å
886	Q	36.5	Very low	39.8	Very low	133 Å²	133	101.2 Å²	101.2	62%	0.621	60%	0.596	S	S	*	*	H	α-helix	trans	-69.5	-43.5	172.9	-64.1	-163.7	53.9	0	0	111	D883 S889 A890	D883-Q886 HydrophobicContact CB-CB 4.24Å; D883-Q886 HydrophobicContact CB-CG 3.92Å; D883-Q886 PolarHBondContact O-N 3.44Å; D883-Q886 VanDerWaalsContact O-N 3.13Å; D883-Q886 PolarHBondContact OD2-NE2 3.23Å; Q886-S889 PolarHBondContact O-N 3.4Å; Q886-A890 WeakPolarHBondContact O-CB 3.4Å; Q886-A890 PolarHBondContact O-N 2.93Å
887	I	44.6	Very low	39.5	Very low	86 Å²	86	106.8 Å²	106.8	44%	0.441	62%	0.615	S	S	.	*	H	α-helix	trans	-65.3	-43.7	-179.9	-60.7	171.1	0	0	0	110.9	D883 V891	D883-I887 PolarHBondContact O-N 3.24Å; I887-V891 VanDerWaalsContact O-CG2 3.31Å; I887-V891 WeakPolarHBondContact O-CG2 3.38Å; I887-V891 PolarHBondContact O-N 3.18Å; I887-V891 VanDerWaalsContact O-N 3.08Å
888	V	37.9	Very low	39.5	Very low	90 Å²	90	108.2 Å²	108.2	55%	0.545	61%	0.607	S	S	.	*	H	α-helix	trans	-65.2	-42.2	175.2	170.4	0	0	0	0	110.9	A884 A890 V891 T892	A884-V888 WeakPolarHBondContact O-CB 3.43Å; A884-V888 VanDerWaalsContact O-CG2 3.27Å; A884-V888 WeakPolarHBondContact O-CG2 3.49Å; A884-V888 PolarHBondContact O-N 3.4Å; V888-A890 PolarHBondContact O-N 3.08Å; V888-V891 PolarHBondContact O-N 3.4Å; V888-T892 HydrophobicContact CG1-CG2 4.45Å; V888-T892 PolarHBondContact O-N 3.26Å; V888-T892 PolarHBondContact O-OG1 3.13Å; V888-T892 VanDerWaalsContact O-OG1 3.08Å
889	S	36.8	Very low	39.4	Very low	70 Å²	70	111.2 Å²	111.2	49%	0.49	62%	0.621	S	S	.	*	H	α-helix	trans	-60.1	-46	177.5	-62	0	0	0	0	111.9	E885 Q886 V891 T892 A893	E885-S889 VanDerWaalsContact O-CB 3.24Å; E885-S889 WeakPolarHBondContact O-CB 3.35Å; E885-S889 PolarHBondContact O-N 3.23Å; E885-S889 PolarHBondContact O-OG 3.19Å; Q886-S889 PolarHBondContact O-N 3.4Å; S889-V891 VanDerWaalsContact C-N 3.31Å; S889-V891 PolarHBondContact O-N 3.18Å; S889-T892 PolarHBondContact O-N 3.13Å; S889-T892 VanDerWaalsContact O-N 3.15Å; S889-T892 PolarHBondContact O-OG1 2.92Å; S889-T892 VanDerWaalsContact O-OG1 3.12Å; S889-A893 WeakPolarHBondContact O-CB 3.48Å; S889-A893 PolarHBondContact O-N 3.47Å
890	A	42.4	Very low	39.6	Very low	65 Å²	65	112 Å²	112	54%	0.537	63%	0.625	S	S	.	*	H	α-helix	trans	-61.4	-36.4	175.6	0	0	0	0	0	112.8	Q886 V888	Q886-A890 WeakPolarHBondContact O-CB 3.4Å; Q886-A890 PolarHBondContact O-N 2.93Å; V888-A890 PolarHBondContact O-N 3.08Å
891	V	39.1	Very low	40.1	Very low	89 Å²	89	108.7 Å²	108.7	54%	0.539	61%	0.607	S	S	.	*	H	α-helix	trans	-74.9	-23.4	176.2	170.2	0	0	0	0	112.8	I887 V888 S889	I887-V891 VanDerWaalsContact O-CG2 3.31Å; I887-V891 WeakPolarHBondContact O-CG2 3.38Å; I887-V891 PolarHBondContact O-N 3.18Å; I887-V891 VanDerWaalsContact O-N 3.08Å; V888-V891 PolarHBondContact O-N 3.4Å; S889-V891 VanDerWaalsContact C-N 3.31Å; S889-V891 PolarHBondContact O-N 3.18Å
892	T	34.8	Very low	41.2	Very low	100 Å²	100	101.8 Å²	101.8	61%	0.613	58%	0.577	S	S	*	*	H	α-helix	trans	-95.8	-19.8	176.3	53.5	0	0	0	0	115.1	V888 S889 D894	V888-T892 HydrophobicContact CG1-CG2 4.45Å; V888-T892 PolarHBondContact O-N 3.26Å; V888-T892 PolarHBondContact O-OG1 3.13Å; V888-T892 VanDerWaalsContact O-OG1 3.08Å; S889-T892 PolarHBondContact O-N 3.13Å; S889-T892 VanDerWaalsContact O-N 3.15Å; S889-T892 PolarHBondContact O-OG1 2.92Å; S889-T892 VanDerWaalsContact O-OG1 3.12Å; T892-D894 VanDerWaalsContact C-N 3.35Å
893	A	35.1	Very low	42.4	Very low	85 Å²	85	97.7 Å²	97.7	70%	0.702	55%	0.549	S	S	*	.	H	α-helix	trans	-75.9	-22.7	179.9	0	0	0	0	0	113.3	S889 S895	S889-A893 WeakPolarHBondContact O-CB 3.48Å; S889-A893 PolarHBondContact O-N 3.47Å; A893-S895 PolarHBondContact O-N 2.68Å
894	D	45.1	Very low	44.1	Very low	75 Å²	75	96.2 Å²	96.2	40%	0.401	54%	0.536	S	S	.	.			trans	-103	77.8	-172.1	-162.7	-36.1	0	0	0	111.5	T892 R898	T892-D894 VanDerWaalsContact C-N 3.35Å; D894-R898 VanDerWaalsContact CG-NH2 3.3Å; D894-R898 WeakPolarHBondContact OD1-CG 3.17Å; D894-R898 IonicContact OD1-CZ 2.94Å; D894-R898 IonicContact OD1-NE 2.68Å; D894-R898 PolarHBondContact OD1-NE 3.31Å; D894-R898 IonicContact OD1-NH2 2.68Å; D894-R898 IonicContact OD2-CZ 3.82Å; D894-R898 IonicContact OD2-NE 3.74Å; D894-R898 PolarHBondContact OD2-NE 3Å; D894-R898 VanDerWaalsContact OD2-NE 3.15Å; D894-R898 IonicContact OD2-NH2 2.65Å; D894-R898 PolarHBondContact OD2-NH2 2.87Å
895	S	38.4	Very low	45.8	Very low	112 Å²	112	94.7 Å²	94.7	78%	0.783	52%	0.521	S	S	*	.			trans	-148.7	51	-178.6	-177.4	0	0	0	0	113.1	A893	A893-S895 PolarHBondContact O-N 2.68Å
896	S	36.6	Very low	47	Very low	109 Å²	109	87.5 Å²	87.5	76%	0.762	49%	0.489	S	S	*	.	S	Bend	trans	-139.2	-43.7	168.3	53.6	0	0	0	0	114
897	E	42.4	Very low	48.9	Very low	175 Å²	175	81.3 Å²	81.3	82%	0.818	46%	0.46	S	S	*	.			trans	-127.7	50.1	-169.4	-61.8	-158	130.6	0	0	115.2	K899	E897-K899 PolarHBondContact O-N 3.12Å
898	R	42.2	Very low	49.4	Very low	149 Å²	149	83.3 Å²	83.3	56%	0.562	47%	0.468	S	S	*	.			trans	-94.1	84.2	166.8	-70.2	-165.3	178.6	-147.7	0	112.5	D894	D894-R898 VanDerWaalsContact CG-NH2 3.3Å; D894-R898 WeakPolarHBondContact OD1-CG 3.17Å; D894-R898 IonicContact OD1-CZ 2.94Å; D894-R898 IonicContact OD1-NE 2.68Å; D894-R898 PolarHBondContact OD1-NE 3.31Å; D894-R898 IonicContact OD1-NH2 2.68Å; D894-R898 IonicContact OD2-CZ 3.82Å; D894-R898 IonicContact OD2-NE 3.74Å; D894-R898 PolarHBondContact OD2-NE 3Å; D894-R898 VanDerWaalsContact OD2-NE 3.15Å; D894-R898 IonicContact OD2-NH2 2.65Å; D894-R898 PolarHBondContact OD2-NH2 2.87Å
899	K	42.9	Very low	50.3	Low	187 Å²	187	82.8 Å²	82.8	81%	0.813	47%	0.465	S	S	*	.	S	Bend	trans	-117.5	133.6	151.9	-70	178.7	-179.2	173.3	0	107.6	E897	E897-K899 PolarHBondContact O-N 3.12Å
900	N	42.9	Very low	51.3	Low	110 Å²	110	82.6 Å²	82.6	59%	0.588	46%	0.463	S	S	*	.			trans	62	87.8	178.8	-51.5	-4.9	0	0	0	115.1	P902 N964	N900-P902 WeakPolarHBondContact O-CD 3.42Å; N900-N964 PolarHBondContact ND2-OD1 3.44Å
901	C	48.2	Very low	52.1	Low	58 Å²	58	82.1 Å²	82.1	39%	0.392	46%	0.464	S	S	.	.			trans	-97.3	98.4	153.6	-62.2	0	0	0	0	107.6	Y903	C901-Y903 PolarHBondContact O-N 3.08Å
902	P	61.2	Low	53.4	Low	22 Å²	22	81.3 Å²	81.3	14%	0.143	45%	0.454	C	S	.	.			trans	-89.9	46.8	-166.2	37.1	-36.1	0	0	0	112.7	N900 C939 S940 V941 I956	N900-P902 WeakPolarHBondContact O-CD 3.42Å; P902-C939 PolarHBondContact O-SG 3.21Å; P902-C939 VanDerWaalsContact O-SG 3.42Å; P902-S940 WeakPolarHBondContact CA-OG 3.14Å; P902-S940 PolarHBondContact O-N 3.33Å; P902-S940 PolarHBondContact O-OG 3.11Å; P902-V941 HydrophobicContact CB-CG2 4.22Å; P902-I956 HydrophobicContact CG-CD1 3.89Å; P902-I956 HydrophobicContact CG-CG1 4.08Å; P902-I956 HydrophobicContact CG-CG2 3.6Å
903	Y	65.3	Low	55.1	Low	33 Å²	33	82.1 Å²	82.1	13%	0.129	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	154.9	175.3	70.1	-87.9	0	0	0	111.1	C901 Y905 L937 C938 E949 M952 I956	C901-Y903 PolarHBondContact O-N 3.08Å; Y903-Y905 HydrophobicContact CD2-CE2 4.32Å; Y903-Y905 HydrophobicContact CE2-CD2 4.44Å; Y903-Y905 AromaticContact CE2-CE2 3.63Å; Y903-Y905 HydrophobicContact CE2-CE2 3.63Å; Y903-Y905 AromaticContact CE2-CZ 3.7Å; Y903-Y905 PolarHBondContact OH-OH 3.32Å; Y903-L937 HydrophobicContact CD2-CD2 4.01Å; Y903-L937 HydrophobicContact CE2-CD2 3.78Å; Y903-C938 CarbonylContact C-O 3.46Å; Y903-C938 VanDerWaalsContact CA-O 3.25Å; Y903-C938 WeakPolarHBondContact CA-O 3.32Å; Y903-C938 WeakPolarHBondContact CB-O 3.48Å; Y903-E949 WeakPolarHBondContact OH-CG 3.43Å; Y903-E949 PolarHBondContact OH-OE1 3.44Å; Y903-E949 VanDerWaalsContact OH-OE1 3.09Å; Y903-M952 HydrophobicContact CD1-CG 3.95Å; Y903-M952 HydrophobicContact CD2-CG 3.87Å; Y903-M952 HydrophobicContact CE2-CG 4.47Å; Y903-M952 HydrophobicContact CG-CG 3.58Å; Y903-M952 HydrophobicContact CG-SD 4.35Å; Y903-I956 HydrophobicContact CD1-CD1 3.49Å; Y903-I956 VanDerWaalsContact CD1-CD1 3.49Å; Y903-I956 HydrophobicContact CE1-CD1 4.28Å; Y903-I956 HydrophobicContact CG-CD1 4.17Å
904	Y	73.7	Confident	56.8	Low	66 Å²	66	78.7 Å²	78.7	26%	0.259	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	147.7	179.9	61.3	-86.1	0	0	0	111.6	Q913 C938	Y904-Q913 HydrophobicContact CD2-CB 3.94Å; Y904-Q913 HydrophobicContact CD2-CG 3.88Å; Y904-Q913 HydrophobicContact CE2-CB 4.38Å; Y904-Q913 HydrophobicContact CE2-CG 3.86Å; Y904-C938 HydrophobicContact CD1-CB 4.2Å; Y904-C938 HydrophobicContact CD2-CB 4.06Å; Y904-C938 HydrophobicContact CE1-CB 3.67Å; Y904-C938 HydrophobicContact CE2-CB 3.52Å; Y904-C938 HydrophobicContact CG-CB 4.37Å; Y904-C938 PolarHBondContact N-O 3.39Å; Y904-C938 PolarHBondContact O-N 3.15Å
905	Y	75.6	Confident	58	Low	10 Å²	10	81.9 Å²	81.9	4%	0.039	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	124.3	177.3	-62.4	-101.8	0	0	0	109	Y903 Q913 T914 N917 F920 F935 L937 E949	Y903-Y905 HydrophobicContact CD2-CE2 4.32Å; Y903-Y905 HydrophobicContact CE2-CD2 4.44Å; Y903-Y905 AromaticContact CE2-CE2 3.63Å; Y903-Y905 HydrophobicContact CE2-CE2 3.63Å; Y903-Y905 AromaticContact CE2-CZ 3.7Å; Y903-Y905 PolarHBondContact OH-OH 3.32Å; Y905-Q913 VanDerWaalsContact O-CA 3.31Å; Y905-Q913 WeakPolarHBondContact O-CA 3.48Å; Y905-T914 PolarHBondContact N-O 2.94Å; Y905-T914 PolarHBondContact O-N 2.82Å; Y905-T914 VanDerWaalsContact O-N 3.07Å; Y905-N917 HydrophobicContact CE1-CB 4.41Å; Y905-N917 HydrophobicContact CE2-CB 3.94Å; Y905-N917 PolarHBondContact OH-ND2 2.96Å; Y905-F920 VanDerWaalsContact CB-CG 3.45Å; Y905-F920 HydrophobicContact CD1-CD1 4.01Å; Y905-F920 HydrophobicContact CD1-CG 4.24Å; Y905-F920 HydrophobicContact CG-CB 4.17Å; Y905-F920 HydrophobicContact CG-CD1 4.27Å; Y905-F920 HydrophobicContact CG-CD2 4.44Å; Y905-F920 HydrophobicContact CG-CG 4.02Å; Y905-F935 HydrophobicContact CD1-CD2 4.45Å; Y905-L937 HydrophobicContact CD1-CG 4.33Å; Y905-L937 HydrophobicContact CE1-CD2 4.36Å; Y905-L937 HydrophobicContact CE1-CG 4.29Å; Y905-E949 PolarHBondContact OH-OE2 2.88Å
906	S	66.3	Low	59.4	Low	14 Å²	14	80.3 Å²	80.3	10%	0.098	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.8	179.3	66.2	0	0	0	0	112.4	F912 F935 S936 C938	S906-F912 WeakPolarHBondContact CA-O 3.29Å; S906-F935 WeakPolarHBondContact O-CA 3.48Å; S906-S936 PolarHBondContact N-O 3.01Å; S906-S936 PolarHBondContact O-N 3.35Å; S906-S936 VanDerWaalsContact O-N 3.08Å; S906-S936 VanDerWaalsContact OG-CB 3.32Å; S906-S936 WeakPolarHBondContact OG-CB 3.26Å; S906-S936 PolarHBondContact OG-O 2.68Å; S906-S936 PolarHBondContact OG-OG 2.91Å; S906-C938 PolarHBondContact OG-SG 3.46Å; S906-C938 VanDerWaalsContact OG-SG 3.37Å
907	C	75.3	Confident	60.5	Low	2 Å²	2	78.4 Å²	78.4	1%	0.014	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	109.9	-180	175.8	0	0	0	0	110.7	V909 C910 G911 F912 F920 H923 M924	C907-V909 PolarHBondContact O-N 3.47Å; C907-V909 VanDerWaalsContact O-N 3.1Å; C907-C910 PolarHBondContact O-N 2.87Å; C907-G911 WeakPolarHBondContact O-CA 3.32Å; C907-G911 PolarHBondContact O-N 3.15Å; C907-F912 HydrophobicContact CB-CB 4.12Å; C907-F912 PolarHBondContact N-O 3.49Å; C907-F920 HydrophobicContact CB-CE2 3.89Å; C907-F920 HydrophobicContact CB-CZ 4.33Å; C907-H923 PolarHBondContact SG-NE2 3.43Å; C907-H923 VanDerWaalsContact SG-NE2 3.41Å; C907-M924 HydrophobicContact CB-CE 4.44Å; C907-M924 VanDerWaalsContact SG-CE 3.58Å
908	H	55.6	Low	61.6	Low	128 Å²	128	72.8 Å²	72.8	59%	0.593	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-19.3	178.8	-108.4	76.6	0	0	0	114	M934 S936	H908-M934 HydrophobicContact CB-CB 4.26Å; H908-S936 PolarHBondContact ND1-OG 3.16Å; H908-S936 VanDerWaalsContact ND1-OG 3.1Å
909	V	56	Low	62.4	Low	79 Å²	79	69.5 Å²	69.5	48%	0.479	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-23.2	-176.4	-170	0	0	0	0	113	C907 H927	C907-V909 PolarHBondContact O-N 3.47Å; C907-V909 VanDerWaalsContact O-N 3.1Å; V909-H927 WeakPolarHBondContact CG1-ND1 3.49Å
910	C	58.6	Low	63.5	Low	67 Å²	67	60.9 Å²	60.9	45%	0.453	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-156.8	17.4	180	71.2	0	0	0	0	115.9	C907 F912 H923	C907-C910 PolarHBondContact O-N 2.87Å; C910-F912 PolarHBondContact O-N 3.25Å; C910-F912 VanDerWaalsContact O-N 3.16Å; C910-H923 PolarHBondContact SG-CE1 3.17Å; C910-H923 PolarHBondContact SG-NE2 3.32Å
911	G	59.9	Low	64.6	Low	55 Å²	55	59.9 Å²	59.9	57%	0.567	33%	0.332	S	S	*	.			trans	67.8	11.3	176.6	0	0	0	0	0	115.7	C907 Q913	C907-G911 WeakPolarHBondContact O-CA 3.32Å; C907-G911 PolarHBondContact O-N 3.15Å; G911-Q913 PolarHBondContact O-N 3Å
912	F	65.8	Low	65.4	Low	72 Å²	72	58.9 Å²	58.9	32%	0.316	33%	0.325	S	S	.	.			trans	-67.9	130.6	178.6	178.8	-97.8	0	0	0	110.6	S906 C907 C910 T914 H923	S906-F912 WeakPolarHBondContact CA-O 3.29Å; C907-F912 HydrophobicContact CB-CB 4.12Å; C907-F912 PolarHBondContact N-O 3.49Å; C910-F912 PolarHBondContact O-N 3.25Å; C910-F912 VanDerWaalsContact O-N 3.16Å; F912-T914 HydrophobicContact CD1-CG2 4.45Å; F912-T914 HydrophobicContact CE1-CG2 3.66Å; F912-T914 HydrophobicContact CZ-CG2 4.35Å; F912-H923 WeakPolarHBondContact CB-CE1 3.38Å; F912-H923 WeakPolarHBondContact CB-NE2 3.31Å; F912-H923 HydrophobicContact CD1-CB 3.71Å; F912-H923 AromaticContact CD1-CD2 3.56Å; F912-H923 AromaticContact CD1-CE1 3.9Å; F912-H923 AromaticContact CD1-CG 3.26Å; F912-H923 AromaticContact CD1-ND1 3.49Å; F912-H923 WeakPolarHBondContact CD1-ND1 3.27Å; F912-H923 AromaticContact CD1-NE2 3.97Å; F912-H923 AromaticContact CD2-ND1 3.82Å; F912-H923 HydrophobicContact CE1-CB 3.57Å; F912-H923 AromaticContact CE1-CG 3.66Å; F912-H923 AromaticContact CE1-ND1 3.96Å; F912-H923 HydrophobicContact CG-CB 4.5Å; F912-H923 AromaticContact CG-CD2 3.94Å; F912-H923 AromaticContact CG-CE1 3.51Å; F912-H923 AromaticContact CG-CG 3.69Å; F912-H923 AromaticContact CG-ND1 3.4Å; F912-H923 WeakPolarHBondContact CG-ND1 3.46Å; F912-H923 AromaticContact CG-NE2 3.85Å; F912-H923 HydrophobicContact CZ-CB 4.28Å
913	Q	69.4	Low	65.6	Low	117 Å²	117	59 Å²	59	55%	0.547	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	140	-179.3	-64.8	173.6	13.7	0	0	110	Y904 Y905 G911	Y904-Q913 HydrophobicContact CD2-CB 3.94Å; Y904-Q913 HydrophobicContact CD2-CG 3.88Å; Y904-Q913 HydrophobicContact CE2-CB 4.38Å; Y904-Q913 HydrophobicContact CE2-CG 3.86Å; Y905-Q913 VanDerWaalsContact O-CA 3.31Å; Y905-Q913 WeakPolarHBondContact O-CA 3.48Å; G911-Q913 PolarHBondContact O-N 3Å
914	T	71.9	Confident	65.4	Low	13 Å²	13	58.5 Å²	58.5	8%	0.08	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.2	145.1	170.5	-178.5	0	0	0	0	111.5	Y905 F912 L916 Q919 F920	Y905-T914 PolarHBondContact N-O 2.94Å; Y905-T914 PolarHBondContact O-N 2.82Å; Y905-T914 VanDerWaalsContact O-N 3.07Å; F912-T914 HydrophobicContact CD1-CG2 4.45Å; F912-T914 HydrophobicContact CE1-CG2 3.66Å; F912-T914 HydrophobicContact CZ-CG2 4.35Å; T914-L916 PolarHBondContact OG1-N 3.19Å; T914-Q919 HydrophobicContact CG2-CB 4.01Å; T914-Q919 PolarHBondContact OG1-OE1 3.37Å; T914-F920 HydrophobicContact CG2-CB 3.71Å; T914-F920 HydrophobicContact CG2-CD2 4.14Å; T914-F920 HydrophobicContact CG2-CG 4.44Å
915	E	69.1	Low	65	Low	141 Å²	141	57.5 Å²	57.5	66%	0.659	33%	0.325	S	S	*	.	S	Bend	trans	-76.3	-13	172.9	-64.7	159.6	-158.4	0	0	112.2
916	L	68	Low	64.3	Low	80 Å²	80	62.7 Å²	62.7	42%	0.419	35%	0.353	S	S	.	.			trans	-108.4	107.6	-172.4	-71	170.4	0	0	0	111.7	T914 A918 Q919 F920	T914-L916 PolarHBondContact OG1-N 3.19Å; L916-A918 PolarHBondContact O-N 3.15Å; L916-A918 VanDerWaalsContact O-N 3.14Å; L916-Q919 HydrophobicContact CB-CB 4.16Å; L916-Q919 HydrophobicContact CB-CG 3.89Å; L916-Q919 HydrophobicContact CD1-CG 4.31Å; L916-Q919 WeakPolarHBondContact O-CA 3.42Å; L916-Q919 WeakPolarHBondContact O-CB 3.19Å; L916-Q919 PolarHBondContact O-N 3.09Å; L916-F920 PolarHBondContact O-N 3.34Å
917	N	61.4	Low	64	Low	68 Å²	68	64.5 Å²	64.5	36%	0.364	36%	0.36	S	S	.	.	H	α-helix	trans	-48.5	-42.3	176.6	-170.7	-25.6	0	0	0	112.6	Y905 Q919 F920 V921	Y905-N917 HydrophobicContact CE1-CB 4.41Å; Y905-N917 HydrophobicContact CE2-CB 3.94Å; Y905-N917 PolarHBondContact OH-ND2 2.96Å; N917-Q919 VanDerWaalsContact C-N 3.33Å; N917-Q919 PolarHBondContact O-N 3Å; N917-F920 CarbonylContact O-C 3.58Å; N917-F920 WeakPolarHBondContact O-CA 3.33Å; N917-F920 WeakPolarHBondContact O-CB 3.42Å; N917-F920 PolarHBondContact O-N 2.93Å; N917-V921 PolarHBondContact O-N 3.27Å; N917-V921 WeakPolarHBondContact OD1-CG2 3.1Å
918	A	64.3	Low	62.9	Low	58 Å²	58	69 Å²	69	48%	0.479	39%	0.388	S	S	.	.	H	α-helix	trans	-61.1	-34.8	175.1	0	0	0	0	0	114.2	L916 S922	L916-A918 PolarHBondContact O-N 3.15Å; L916-A918 VanDerWaalsContact O-N 3.14Å; A918-S922 VanDerWaalsContact O-CB 3.25Å; A918-S922 WeakPolarHBondContact O-CB 3.49Å; A918-S922 PolarHBondContact O-N 3.36Å
919	Q	59.2	Low	62.4	Low	79 Å²	79	70.1 Å²	70.1	37%	0.369	40%	0.398	S	S	.	.	H	α-helix	trans	-73.9	-34.9	171.2	-63.7	-174.8	1.8	0	0	111.3	T914 L916 N917 S922 H923	T914-Q919 HydrophobicContact CG2-CB 4.01Å; T914-Q919 PolarHBondContact OG1-OE1 3.37Å; L916-Q919 HydrophobicContact CB-CB 4.16Å; L916-Q919 HydrophobicContact CB-CG 3.89Å; L916-Q919 HydrophobicContact CD1-CG 4.31Å; L916-Q919 WeakPolarHBondContact O-CA 3.42Å; L916-Q919 WeakPolarHBondContact O-CB 3.19Å; L916-Q919 PolarHBondContact O-N 3.09Å; N917-Q919 VanDerWaalsContact C-N 3.33Å; N917-Q919 PolarHBondContact O-N 3Å; Q919-S922 PolarHBondContact O-N 3.02Å; Q919-H923 VanDerWaalsContact O-CB 3.31Å; Q919-H923 WeakPolarHBondContact O-CB 3.15Å; Q919-H923 PolarHBondContact O-N 3.39Å
920	F	65.9	Low	61.7	Low	7 Å²	7	73.3 Å²	73.3	3%	0.031	41%	0.405	C	S	.	.	H	α-helix	trans	-65.5	-47.7	177.7	-168.7	-106.4	0	0	0	112.1	Y905 C907 T914 L916 N917 S922 H923 M924 F935	Y905-F920 VanDerWaalsContact CB-CG 3.45Å; Y905-F920 HydrophobicContact CD1-CD1 4.01Å; Y905-F920 HydrophobicContact CD1-CG 4.24Å; Y905-F920 HydrophobicContact CG-CB 4.17Å; Y905-F920 HydrophobicContact CG-CD1 4.27Å; Y905-F920 HydrophobicContact CG-CD2 4.44Å; Y905-F920 HydrophobicContact CG-CG 4.02Å; C907-F920 HydrophobicContact CB-CE2 3.89Å; C907-F920 HydrophobicContact CB-CZ 4.33Å; T914-F920 HydrophobicContact CG2-CB 3.71Å; T914-F920 HydrophobicContact CG2-CD2 4.14Å; T914-F920 HydrophobicContact CG2-CG 4.44Å; L916-F920 PolarHBondContact O-N 3.34Å; N917-F920 CarbonylContact O-C 3.58Å; N917-F920 WeakPolarHBondContact O-CA 3.33Å; N917-F920 WeakPolarHBondContact O-CB 3.42Å; N917-F920 PolarHBondContact O-N 2.93Å; F920-S922 PolarHBondContact O-N 2.77Å; F920-H923 CarbonylContact O-C 3.37Å; F920-H923 WeakPolarHBondContact O-CB 3.49Å; F920-H923 PolarHBondContact O-N 2.91Å; F920-M924 HydrophobicContact CD1-CG 3.81Å; F920-M924 HydrophobicContact CD1-SD 4.49Å; F920-M924 HydrophobicContact CE1-CG 3.43Å; F920-M924 VanDerWaalsContact CE1-CG 3.43Å; F920-M924 HydrophobicContact CE1-SD 3.54Å; F920-M924 VanDerWaalsContact CE1-SD 3.54Å; F920-M924 HydrophobicContact CE2-CG 4.39Å; F920-M924 HydrophobicContact CG-CG 4.41Å; F920-M924 HydrophobicContact CZ-CE 4.37Å; F920-M924 HydrophobicContact CZ-CG 3.73Å; F920-M924 HydrophobicContact CZ-SD 3.57Å; F920-M924 VanDerWaalsContact CZ-SD 3.57Å; F920-M924 WeakPolarHBondContact O-CB 3.24Å; F920-M924 WeakPolarHBondContact O-CG 3.32Å; F920-M924 PolarHBondContact O-N 2.33Å; F920-F935 HydrophobicContact CE1-CB 3.61Å; F920-F935 AromaticContact CE1-CD2 3.93Å; F920-F935 HydrophobicContact CE1-CD2 3.93Å; F920-F935 AromaticContact CE1-CG 3.79Å; F920-F935 HydrophobicContact CE1-CG 3.79Å; F920-F935 HydrophobicContact CZ-CB 3.4Å; F920-F935 VanDerWaalsContact CZ-CB 3.4Å; F920-F935 HydrophobicContact CZ-CD2 4.42Å; F920-F935 HydrophobicContact CZ-CG 4.12Å
921	V	65.9	Low	61	Low	89 Å²	89	79 Å²	79	54%	0.539	43%	0.425	S	S	.	.	H	α-helix	trans	-63.6	-41.2	175.3	173.8	0	0	0	0	111.2	N917 H923 M924 S925	N917-V921 PolarHBondContact O-N 3.27Å; N917-V921 WeakPolarHBondContact OD1-CG2 3.1Å; V921-H923 VanDerWaalsContact C-N 3.32Å; V921-H923 PolarHBondContact O-N 3.39Å; V921-M924 PolarHBondContact O-N 3.43Å; V921-S925 PolarHBondContact O-N 2.94Å
922	S	64.4	Low	60.3	Low	37 Å²	37	82.8 Å²	82.8	26%	0.259	43%	0.428	S	S	.	.	H	α-helix	trans	-58.3	-43.8	172.5	-177.2	0	0	0	0	111.7	H875 A918 Q919 F920 S925	H875-S922 PolarHBondContact CE1-OG 3Å; H875-S922 VanDerWaalsContact CE1-OG 3.32Å; A918-S922 VanDerWaalsContact O-CB 3.25Å; A918-S922 WeakPolarHBondContact O-CB 3.49Å; A918-S922 PolarHBondContact O-N 3.36Å; Q919-S922 PolarHBondContact O-N 3.02Å; F920-S922 PolarHBondContact O-N 2.77Å; S922-S925 WeakPolarHBondContact O-CB 3.46Å; S922-S925 PolarHBondContact O-N 3.25Å; S922-S925 PolarHBondContact O-OG 3.15Å
923	H	66.6	Low	59.6	Low	24 Å²	24	89 Å²	89	11%	0.111	45%	0.45	C	S	.	.	H	α-helix	trans	-66.2	-46.6	174.7	175.2	83.8	0	0	0	112.9	C907 C910 F912 Q919 F920 V921 S925 L926 H927	C907-H923 PolarHBondContact SG-NE2 3.43Å; C907-H923 VanDerWaalsContact SG-NE2 3.41Å; C910-H923 PolarHBondContact SG-CE1 3.17Å; C910-H923 PolarHBondContact SG-NE2 3.32Å; F912-H923 WeakPolarHBondContact CB-CE1 3.38Å; F912-H923 WeakPolarHBondContact CB-NE2 3.31Å; F912-H923 HydrophobicContact CD1-CB 3.71Å; F912-H923 AromaticContact CD1-CD2 3.56Å; F912-H923 AromaticContact CD1-CE1 3.9Å; F912-H923 AromaticContact CD1-CG 3.26Å; F912-H923 AromaticContact CD1-ND1 3.49Å; F912-H923 WeakPolarHBondContact CD1-ND1 3.27Å; F912-H923 AromaticContact CD1-NE2 3.97Å; F912-H923 AromaticContact CD2-ND1 3.82Å; F912-H923 HydrophobicContact CE1-CB 3.57Å; F912-H923 AromaticContact CE1-CG 3.66Å; F912-H923 AromaticContact CE1-ND1 3.96Å; F912-H923 HydrophobicContact CG-CB 4.5Å; F912-H923 AromaticContact CG-CD2 3.94Å; F912-H923 AromaticContact CG-CE1 3.51Å; F912-H923 AromaticContact CG-CG 3.69Å; F912-H923 AromaticContact CG-ND1 3.4Å; F912-H923 WeakPolarHBondContact CG-ND1 3.46Å; F912-H923 AromaticContact CG-NE2 3.85Å; F912-H923 HydrophobicContact CZ-CB 4.28Å; Q919-H923 VanDerWaalsContact O-CB 3.31Å; Q919-H923 WeakPolarHBondContact O-CB 3.15Å; Q919-H923 PolarHBondContact O-N 3.39Å; F920-H923 CarbonylContact O-C 3.37Å; F920-H923 WeakPolarHBondContact O-CB 3.49Å; F920-H923 PolarHBondContact O-N 2.91Å; V921-H923 VanDerWaalsContact C-N 3.32Å; V921-H923 PolarHBondContact O-N 3.39Å; H923-S925 PolarHBondContact O-N 3.49Å; H923-L926 VanDerWaalsContact O-CB 3.26Å; H923-L926 WeakPolarHBondContact O-CB 3.5Å; H923-L926 WeakPolarHBondContact O-CG 3.46Å; H923-L926 PolarHBondContact O-N 3.47Å; H923-L926 VanDerWaalsContact O-N 3.07Å; H923-H927 AromaticContact CD2-NE2 3.75Å; H923-H927 AromaticContact CE1-NE2 3.55Å; H923-H927 AromaticContact NE2-CD2 3.67Å; H923-H927 AromaticContact NE2-NE2 2.93Å; H923-H927 PolarHBondContact NE2-NE2 3.39Å
924	M	60.9	Low	58.9	Low	23 Å²	23	87.7 Å²	87.7	11%	0.113	45%	0.445	C	S	.	.	H	α-helix	trans	-57.2	-35	176.8	-70.4	-93.9	71.1	0	0	111.4	C907 F920 V921 L926 H927	C907-M924 HydrophobicContact CB-CE 4.44Å; C907-M924 VanDerWaalsContact SG-CE 3.58Å; F920-M924 HydrophobicContact CD1-CG 3.81Å; F920-M924 HydrophobicContact CD1-SD 4.49Å; F920-M924 HydrophobicContact CE1-CG 3.43Å; F920-M924 VanDerWaalsContact CE1-CG 3.43Å; F920-M924 HydrophobicContact CE1-SD 3.54Å; F920-M924 VanDerWaalsContact CE1-SD 3.54Å; F920-M924 HydrophobicContact CE2-CG 4.39Å; F920-M924 HydrophobicContact CG-CG 4.41Å; F920-M924 HydrophobicContact CZ-CE 4.37Å; F920-M924 HydrophobicContact CZ-CG 3.73Å; F920-M924 HydrophobicContact CZ-SD 3.57Å; F920-M924 VanDerWaalsContact CZ-SD 3.57Å; F920-M924 WeakPolarHBondContact O-CB 3.24Å; F920-M924 WeakPolarHBondContact O-CG 3.32Å; F920-M924 PolarHBondContact O-N 2.33Å; V921-M924 PolarHBondContact O-N 3.43Å; M924-L926 PolarHBondContact O-N 2.9Å; M924-H927 PolarHBondContact O-N 3.14Å
925	S	65.1	Low	58.6	Low	44 Å²	44	90.3 Å²	90.3	31%	0.308	46%	0.455	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-22.9	178.1	86.3	0	0	0	0	114.4	K878 V921 S922 H923	K878-S925 PolarHBondContact NZ-O 2.91Å; V921-S925 PolarHBondContact O-N 2.94Å; S922-S925 WeakPolarHBondContact O-CB 3.46Å; S922-S925 PolarHBondContact O-N 3.25Å; S922-S925 PolarHBondContact O-OG 3.15Å; H923-S925 PolarHBondContact O-N 3.49Å
926	L	61.3	Low	58.7	Low	119 Å²	119	84 Å²	84	62%	0.623	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-19.4	178.7	-53.2	174.5	0	0	0	113.4	H923 M924 V928	H923-L926 VanDerWaalsContact O-CB 3.26Å; H923-L926 WeakPolarHBondContact O-CB 3.5Å; H923-L926 WeakPolarHBondContact O-CG 3.46Å; H923-L926 PolarHBondContact O-N 3.47Å; H923-L926 VanDerWaalsContact O-N 3.07Å; M924-L926 PolarHBondContact O-N 2.9Å; L926-V928 PolarHBondContact O-N 3.43Å
927	H	60.1	Low	59.2	Low	53 Å²	53	80.3 Å²	80.3	25%	0.245	41%	0.407	C	S	.	.			trans	-91.3	91.4	175.7	-62.3	-73	0	0	0	108.8	V909 H923 M924	V909-H927 WeakPolarHBondContact CG1-ND1 3.49Å; H923-H927 AromaticContact CD2-NE2 3.75Å; H923-H927 AromaticContact CE1-NE2 3.55Å; H923-H927 AromaticContact NE2-CD2 3.67Å; H923-H927 AromaticContact NE2-NE2 2.93Å; H923-H927 PolarHBondContact NE2-NE2 3.39Å; M924-H927 PolarHBondContact O-N 3.14Å
928	V	52.3	Low	60	Low	97 Å²	97	77.7 Å²	77.7	59%	0.588	39%	0.394	S	S	*	.			trans	-88.4	-26.2	-166.5	179.9	0	0	0	0	113.8	L926	L926-V928 PolarHBondContact O-N 3.43Å
929	D	44.3	Very low	60.8	Low	150 Å²	150	75.2 Å²	75.2	80%	0.802	37%	0.373	S	S	*	.	S	Bend	trans	-116	25.1	-155.5	-58.9	-60.5	0	0	0	116.2
930	K	41.5	Very low	61.4	Low	147 Å²	147	74.8 Å²	74.8	64%	0.639	38%	0.379	S	S	*	.			trans	-143	130	174.2	-69.2	-168.2	177.4	-175.1	0	114.4	Q932	K930-Q932 PolarHBondContact O-N 3.28Å
931	E	43.1	Very low	61.5	Low	186 Å²	186	78 Å²	78	87%	0.869	40%	0.399	S	S	*	.	S	Bend	trans	-78.9	36.8	175.6	-58	179	137.8	0	0	112.9
932	Q	45.1	Very low	62	Low	135 Å²	135	76 Å²	76	63%	0.631	39%	0.389	S	S	*	.			trans	-131.3	79.3	-179.5	-69.7	-71.3	-83.5	0	0	108	K930 M934	K930-Q932 PolarHBondContact O-N 3.28Å; Q932-M934 PolarHBondContact O-N 3.47Å
933	W	51	Low	62.4	Low	203 Å²	203	82.3 Å²	82.3	77%	0.769	42%	0.419	S	S	*	.			trans	-76.2	62.6	-179.6	-72.2	62.9	0	0	0	110.7
934	M	55.4	Low	62.9	Low	89 Å²	89	85.2 Å²	85.2	44%	0.438	43%	0.43	S	S	.	.			trans	-88	112.9	177.2	-69	-178.9	68.6	0	0	110.3	H908 Q932	H908-M934 HydrophobicContact CB-CB 4.26Å; Q932-M934 PolarHBondContact O-N 3.47Å
935	F	64.9	Low	63.7	Low	67 Å²	67	87.9 Å²	87.9	29%	0.294	45%	0.447	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	156.7	165.6	68.1	-80.4	0	0	0	109.6	Y905 S906 F920 L937	Y905-F935 HydrophobicContact CD1-CD2 4.45Å; S906-F935 WeakPolarHBondContact O-CA 3.48Å; F920-F935 HydrophobicContact CE1-CB 3.61Å; F920-F935 AromaticContact CE1-CD2 3.93Å; F920-F935 HydrophobicContact CE1-CD2 3.93Å; F920-F935 AromaticContact CE1-CG 3.79Å; F920-F935 HydrophobicContact CE1-CG 3.79Å; F920-F935 HydrophobicContact CZ-CB 3.4Å; F920-F935 VanDerWaalsContact CZ-CB 3.4Å; F920-F935 HydrophobicContact CZ-CD2 4.42Å; F920-F935 HydrophobicContact CZ-CG 4.12Å; F935-L937 HydrophobicContact CD2-CD1 4.03Å; F935-L937 HydrophobicContact CE2-CD1 3.65Å
936	S	72.6	Confident	64.1	Low	10 Å²	10	86.3 Å²	86.3	7%	0.07	44%	0.436	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	118.6	-175	20.7	0	0	0	0	108.4	S906 H908 V945	S906-S936 PolarHBondContact N-O 3.01Å; S906-S936 PolarHBondContact O-N 3.35Å; S906-S936 VanDerWaalsContact O-N 3.08Å; S906-S936 VanDerWaalsContact OG-CB 3.32Å; S906-S936 WeakPolarHBondContact OG-CB 3.26Å; S906-S936 PolarHBondContact OG-O 2.68Å; S906-S936 PolarHBondContact OG-OG 2.91Å; H908-S936 PolarHBondContact ND1-OG 3.16Å; H908-S936 VanDerWaalsContact ND1-OG 3.1Å; S936-V945 VanDerWaalsContact CB-CG1 3.43Å
937	L	77.7	Confident	64.5	Low	2 Å²	2	86.8 Å²	86.8	1%	0.01	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	122	165.2	-66.1	82.7	0	0	0	106.6	Y903 Y905 F935 V945 C946 E949 M952	Y903-L937 HydrophobicContact CD2-CD2 4.01Å; Y903-L937 HydrophobicContact CE2-CD2 3.78Å; Y905-L937 HydrophobicContact CD1-CG 4.33Å; Y905-L937 HydrophobicContact CE1-CD2 4.36Å; Y905-L937 HydrophobicContact CE1-CG 4.29Å; F935-L937 HydrophobicContact CD2-CD1 4.03Å; F935-L937 HydrophobicContact CE2-CD1 3.65Å; L937-V945 VanDerWaalsContact O-CA 3.3Å; L937-V945 WeakPolarHBondContact O-CA 3.42Å; L937-C946 PolarHBondContact N-O 3.33Å; L937-C946 PolarHBondContact O-N 3.02Å; L937-E949 HydrophobicContact CD2-CB 4.09Å; L937-E949 HydrophobicContact CD2-CG 4.18Å; L937-M952 HydrophobicContact CB-CB 4.3Å; L937-M952 HydrophobicContact CB-CE 3.9Å; L937-M952 HydrophobicContact CB-CG 4.32Å; L937-M952 HydrophobicContact CD2-CB 3.78Å; L937-M952 HydrophobicContact CD2-CG 4.16Å; L937-M952 VanDerWaalsContact O-CE 3.23Å; L937-M952 WeakPolarHBondContact O-CE 3.28Å
938	C	79.5	Confident	65.1	Low	13 Å²	13	89.9 Å²	89.9	9%	0.088	45%	0.451	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	133.3	176.7	-58.6	0	0	0	0	108.5	Y903 Y904 S906 V945	Y903-C938 CarbonylContact C-O 3.46Å; Y903-C938 VanDerWaalsContact CA-O 3.25Å; Y903-C938 WeakPolarHBondContact CA-O 3.32Å; Y903-C938 WeakPolarHBondContact CB-O 3.48Å; Y904-C938 HydrophobicContact CD1-CB 4.2Å; Y904-C938 HydrophobicContact CD2-CB 4.06Å; Y904-C938 HydrophobicContact CE1-CB 3.67Å; Y904-C938 HydrophobicContact CE2-CB 3.52Å; Y904-C938 HydrophobicContact CG-CB 4.37Å; Y904-C938 PolarHBondContact N-O 3.39Å; Y904-C938 PolarHBondContact O-N 3.15Å; S906-C938 PolarHBondContact OG-SG 3.46Å; S906-C938 VanDerWaalsContact OG-SG 3.37Å; C938-V945 HydrophobicContact CB-CG2 4.42Å
939	C	80.4	Confident	66	Low	5 Å²	5	89.3 Å²	89.3	3%	0.034	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.8	147	172.1	-173.9	0	0	0	0	109.9	P902 V941 C942 Y944 M952	P902-C939 PolarHBondContact O-SG 3.21Å; P902-C939 VanDerWaalsContact O-SG 3.42Å; C939-V941 VanDerWaalsContact C-N 3.28Å; C939-V941 PolarHBondContact SG-N 3.19Å; C939-C942 WeakPolarHBondContact CB-O 3.4Å; C939-Y944 PolarHBondContact N-O 3.4Å; C939-M952 HydrophobicContact CB-CE 4.21Å; C939-M952 HydrophobicContact CB-SD 3.92Å
940	S	70.7	Confident	67.3	Low	70 Å²	70	84.8 Å²	84.8	49%	0.49	42%	0.422	S	S	.	.	S	Bend	trans	-86.7	2.9	176.4	79.4	0	0	0	0	113.4	P902	P902-S940 WeakPolarHBondContact CA-OG 3.14Å; P902-S940 PolarHBondContact O-N 3.33Å; P902-S940 PolarHBondContact O-OG 3.11Å
941	V	69.9	Low	69	Low	74 Å²	74	81.3 Å²	81.3	45%	0.448	41%	0.411	S	S	.	.	S	Bend	trans	-125.7	-20.9	-171.4	-173.4	0	0	0	0	112.2	P902 C939 L963	P902-V941 HydrophobicContact CB-CG2 4.22Å; C939-V941 VanDerWaalsContact C-N 3.28Å; C939-V941 PolarHBondContact SG-N 3.19Å; V941-L963 HydrophobicContact CG1-CD1 4.4Å
942	C	76	Confident	70.9	Confident	49 Å²	49	72.5 Å²	72.5	33%	0.331	37%	0.369	S	S	.	.	S	Bend	trans	-152.6	169.2	171.2	69.2	0	0	0	0	111.4	C939 Y944 H955	C939-C942 WeakPolarHBondContact CB-O 3.4Å; C942-Y944 PolarHBondContact O-N 3.26Å; C942-H955 PolarHBondContact SG-CE1 3Å; C942-H955 PolarHBondContact SG-NE2 3.42Å
943	D	72.8	Confident	72.3	Confident	168 Å²	168	72.8 Å²	72.8	90%	0.898	37%	0.369	S	S	*	.	S	Bend	trans	-73.3	20.9	-176.8	-53.4	-60.8	0	0	0	114.7	V945	D943-V945 PolarHBondContact O-N 3.37Å
944	Y	75.8	Confident	73.6	Confident	85 Å²	85	65.8 Å²	65.8	33%	0.333	35%	0.351	S	S	.	.			trans	-72.3	128.3	175.9	-177.2	-100.6	0	0	0	111	C939 C942 C946 M952 H955	C939-Y944 PolarHBondContact N-O 3.4Å; C942-Y944 PolarHBondContact O-N 3.26Å; Y944-C946 HydrophobicContact CE1-CB 3.84Å; Y944-M952 HydrophobicContact CD1-CE 3.77Å; Y944-M952 HydrophobicContact CD1-SD 4.33Å; Y944-M952 HydrophobicContact CE1-CE 4.18Å; Y944-H955 VanDerWaalsContact CB-CE1 3.41Å; Y944-H955 WeakPolarHBondContact CB-CE1 3.45Å; Y944-H955 WeakPolarHBondContact CB-NE2 3.44Å; Y944-H955 HydrophobicContact CD1-CB 3.84Å; Y944-H955 AromaticContact CD1-CD2 3.4Å; Y944-H955 VanDerWaalsContact CD1-CD2 3.4Å; Y944-H955 WeakPolarHBondContact CD1-CD2 3.36Å; Y944-H955 AromaticContact CD1-CE1 3.93Å; Y944-H955 AromaticContact CD1-CG 3.32Å; Y944-H955 AromaticContact CD1-ND1 3.67Å; Y944-H955 AromaticContact CD1-NE2 3.8Å; Y944-H955 AromaticContact CD2-ND1 3.95Å; Y944-H955 HydrophobicContact CE1-CB 3.61Å; Y944-H955 AromaticContact CE1-CG 3.65Å; Y944-H955 AromaticContact CG-CD2 3.87Å; Y944-H955 AromaticContact CG-CE1 3.58Å; Y944-H955 AromaticContact CG-CG 3.74Å; Y944-H955 AromaticContact CG-ND1 3.56Å; Y944-H955 AromaticContact CG-NE2 3.78Å
945	V	78.3	Confident	74.8	Confident	79 Å²	79	63 Å²	63	48%	0.479	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	130.4	179.9	-176.5	0	0	0	0	109.9	S936 L937 C938 D943	S936-V945 VanDerWaalsContact CB-CG1 3.43Å; L937-V945 VanDerWaalsContact O-CA 3.3Å; L937-V945 WeakPolarHBondContact O-CA 3.42Å; C938-V945 HydrophobicContact CB-CG2 4.42Å; D943-V945 PolarHBondContact O-N 3.37Å
946	C	74.2	Confident	75.3	Confident	12 Å²	12	60.8 Å²	60.8	8%	0.081	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	176.3	173	69.7	0	0	0	0	111.4	L937 Y944 E948 D951 M952	L937-C946 PolarHBondContact N-O 3.33Å; L937-C946 PolarHBondContact O-N 3.02Å; Y944-C946 HydrophobicContact CE1-CB 3.84Å; C946-E948 PolarHBondContact SG-O 3.32Å; C946-D951 HydrophobicContact CB-CB 4.02Å; C946-M952 PolarHBondContact SG-N 3.21Å; C946-M952 VanDerWaalsContact SG-N 3.45Å
947	M	69.9	Low	75.2	Confident	128 Å²	128	63.9 Å²	63.9	63%	0.631	35%	0.35	S	S	*	.	S	Bend	trans	-107.6	-12.9	-179.8	-64.1	179.7	66.8	0	0	113.6
948	E	71.3	Confident	75	Confident	119 Å²	119	69.2 Å²	69.2	56%	0.556	38%	0.382	S	S	*	.			trans	-115.5	141	-179.5	-151.8	177.7	126.3	0	0	112.3	C946 S950 D951 M952	C946-E948 PolarHBondContact SG-O 3.32Å; E948-S950 VanDerWaalsContact C-N 3.29Å; E948-S950 VanDerWaalsContact CG-OG 3.25Å; E948-S950 WeakPolarHBondContact CG-OG 3.48Å; E948-S950 PolarHBondContact O-N 2.94Å; E948-S950 WeakPolarHBondContact OE1-CB 3.37Å; E948-S950 PolarHBondContact OE1-OG 2.86Å; E948-D951 PolarHBondContact O-N 2.71Å; E948-M952 PolarHBondContact O-N 2.87Å
949	E	71.8	Confident	74.3	Confident	85 Å²	85	71 Å²	71	40%	0.397	40%	0.403	S	S	.	.	H	α-helix	trans	-68.6	-29.6	179.2	-162.3	-173.7	146.2	0	0	112.2	Y903 Y905 L937 K953	Y903-E949 WeakPolarHBondContact OH-CG 3.43Å; Y903-E949 PolarHBondContact OH-OE1 3.44Å; Y903-E949 VanDerWaalsContact OH-OE1 3.09Å; Y905-E949 PolarHBondContact OH-OE2 2.88Å; L937-E949 HydrophobicContact CD2-CB 4.09Å; L937-E949 HydrophobicContact CD2-CG 4.18Å; E949-K953 WeakPolarHBondContact O-CB 3.24Å; E949-K953 PolarHBondContact O-N 3.39Å
950	S	71.5	Confident	73.7	Confident	55 Å²	55	72.2 Å²	72.2	39%	0.385	41%	0.408	S	S	.	.	H	α-helix	trans	-59.7	-50	173.2	58.6	0	0	0	0	111.4	E948 K953 S954	E948-S950 VanDerWaalsContact C-N 3.29Å; E948-S950 VanDerWaalsContact CG-OG 3.25Å; E948-S950 WeakPolarHBondContact CG-OG 3.48Å; E948-S950 PolarHBondContact O-N 2.94Å; E948-S950 WeakPolarHBondContact OE1-CB 3.37Å; E948-S950 PolarHBondContact OE1-OG 2.86Å; S950-K953 PolarHBondContact O-N 3.39Å; S950-S954 WeakPolarHBondContact O-CB 3.42Å; S950-S954 PolarHBondContact O-N 3.49Å
951	D	78.2	Confident	73.1	Confident	74 Å²	74	71.7 Å²	71.7	40%	0.396	41%	0.408	S	S	.	.	H	α-helix	trans	-60.2	-50.1	177.1	-74.8	-23.6	0	0	0	111	C946 E948 K953 S954 H955	C946-D951 HydrophobicContact CB-CB 4.02Å; E948-D951 PolarHBondContact O-N 2.71Å; D951-K953 VanDerWaalsContact C-N 3.32Å; D951-K953 PolarHBondContact O-N 3.21Å; D951-S954 PolarHBondContact O-N 3.47Å; D951-S954 VanDerWaalsContact O-N 3.15Å; D951-S954 PolarHBondContact O-OG 3.25Å; D951-H955 WeakPolarHBondContact O-CB 3.37Å; D951-H955 PolarHBondContact O-N 2.96Å
952	M	81.1	Confident	72.1	Confident	0 Å²	0	71.2 Å²	71.2	0%	0	42%	0.418	C	S	.	.	H	α-helix	trans	-58.8	-44.9	178.4	-177.4	50.6	65.9	0	0	111.3	Y903 L937 C939 Y944 C946 E948 S954 H955 I956	Y903-M952 HydrophobicContact CD1-CG 3.95Å; Y903-M952 HydrophobicContact CD2-CG 3.87Å; Y903-M952 HydrophobicContact CE2-CG 4.47Å; Y903-M952 HydrophobicContact CG-CG 3.58Å; Y903-M952 HydrophobicContact CG-SD 4.35Å; L937-M952 HydrophobicContact CB-CB 4.3Å; L937-M952 HydrophobicContact CB-CE 3.9Å; L937-M952 HydrophobicContact CB-CG 4.32Å; L937-M952 HydrophobicContact CD2-CB 3.78Å; L937-M952 HydrophobicContact CD2-CG 4.16Å; L937-M952 VanDerWaalsContact O-CE 3.23Å; L937-M952 WeakPolarHBondContact O-CE 3.28Å; C939-M952 HydrophobicContact CB-CE 4.21Å; C939-M952 HydrophobicContact CB-SD 3.92Å; Y944-M952 HydrophobicContact CD1-CE 3.77Å; Y944-M952 HydrophobicContact CD1-SD 4.33Å; Y944-M952 HydrophobicContact CE1-CE 4.18Å; C946-M952 PolarHBondContact SG-N 3.21Å; C946-M952 VanDerWaalsContact SG-N 3.45Å; E948-M952 PolarHBondContact O-N 2.87Å; M952-S954 VanDerWaalsContact C-N 3.35Å; M952-S954 PolarHBondContact O-N 2.77Å; M952-H955 PolarHBondContact O-N 3.44Å; M952-I956 HydrophobicContact CG-CD1 3.77Å; M952-I956 WeakPolarHBondContact O-CD1 3.29Å; M952-I956 VanDerWaalsContact O-CG1 3.25Å; M952-I956 WeakPolarHBondContact O-CG1 3.42Å; M952-I956 PolarHBondContact O-N 3.22Å; M952-I956 HydrophobicContact SD-CD1 3.86Å; M952-I956 HydrophobicContact SD-CG1 4.14Å
953	K	75.9	Confident	70.7	Confident	141 Å²	141	74.8 Å²	74.8	61%	0.613	43%	0.433	S	S	*	.	H	α-helix	trans	-65.5	-37.8	177.8	-170	172.3	-175.6	173.3	0	111.8	E949 S950 D951 S957	E949-K953 WeakPolarHBondContact O-CB 3.24Å; E949-K953 PolarHBondContact O-N 3.39Å; S950-K953 PolarHBondContact O-N 3.39Å; D951-K953 VanDerWaalsContact C-N 3.32Å; D951-K953 PolarHBondContact O-N 3.21Å; K953-S957 VanDerWaalsContact O-CB 3.27Å; K953-S957 WeakPolarHBondContact O-CB 3.42Å; K953-S957 PolarHBondContact O-N 2.83Å; K953-S957 PolarHBondContact O-OG 3.15Å
954	S	77	Confident	69.2	Low	57 Å²	57	70.8 Å²	70.8	40%	0.399	41%	0.412	S	S	.	.	H	α-helix	trans	-64.7	-46.6	174.5	85.1	0	0	0	0	111.2	S950 D951 M952 I956 S957 T958	S950-S954 WeakPolarHBondContact O-CB 3.42Å; S950-S954 PolarHBondContact O-N 3.49Å; D951-S954 PolarHBondContact O-N 3.47Å; D951-S954 VanDerWaalsContact O-N 3.15Å; D951-S954 PolarHBondContact O-OG 3.25Å; M952-S954 VanDerWaalsContact C-N 3.35Å; M952-S954 PolarHBondContact O-N 2.77Å; S954-I956 PolarHBondContact O-N 3.01Å; S954-S957 WeakPolarHBondContact CA-OG 3.38Å; S954-S957 PolarHBondContact O-N 3.08Å; S954-S957 PolarHBondContact O-OG 3.03Å; S954-T958 WeakPolarHBondContact O-CB 3.49Å; S954-T958 WeakPolarHBondContact O-CG2 3.49Å; S954-T958 PolarHBondContact O-N 3.06Å; S954-T958 PolarHBondContact O-OG1 3.47Å
955	H	80.4	Confident	67.4	Low	30 Å²	30	71.1 Å²	71.1	14%	0.139	43%	0.426	C	S	.	.	H	α-helix	trans	-58.9	-46.9	176.1	165	77	0	0	0	111.7	C942 Y944 D951 M952 S957 T958 G959 H960	C942-H955 PolarHBondContact SG-CE1 3Å; C942-H955 PolarHBondContact SG-NE2 3.42Å; Y944-H955 VanDerWaalsContact CB-CE1 3.41Å; Y944-H955 WeakPolarHBondContact CB-CE1 3.45Å; Y944-H955 WeakPolarHBondContact CB-NE2 3.44Å; Y944-H955 HydrophobicContact CD1-CB 3.84Å; Y944-H955 AromaticContact CD1-CD2 3.4Å; Y944-H955 VanDerWaalsContact CD1-CD2 3.4Å; Y944-H955 WeakPolarHBondContact CD1-CD2 3.36Å; Y944-H955 AromaticContact CD1-CE1 3.93Å; Y944-H955 AromaticContact CD1-CG 3.32Å; Y944-H955 AromaticContact CD1-ND1 3.67Å; Y944-H955 AromaticContact CD1-NE2 3.8Å; Y944-H955 AromaticContact CD2-ND1 3.95Å; Y944-H955 HydrophobicContact CE1-CB 3.61Å; Y944-H955 AromaticContact CE1-CG 3.65Å; Y944-H955 AromaticContact CG-CD2 3.87Å; Y944-H955 AromaticContact CG-CE1 3.58Å; Y944-H955 AromaticContact CG-CG 3.74Å; Y944-H955 AromaticContact CG-ND1 3.56Å; Y944-H955 AromaticContact CG-NE2 3.78Å; D951-H955 WeakPolarHBondContact O-CB 3.37Å; D951-H955 PolarHBondContact O-N 2.96Å; M952-H955 PolarHBondContact O-N 3.44Å; H955-S957 PolarHBondContact O-N 3.11Å; H955-T958 PolarHBondContact O-N 3.3Å; H955-T958 PolarHBondContact O-OG1 2.84Å; H955-G959 PolarHBondContact O-N 3.29Å; H955-H960 AromaticContact NE2-NE2 3.67Å
956	I	75.6	Confident	65.3	Low	20 Å²	20	78.7 Å²	78.7	10%	0.103	45%	0.446	C	S	.	.	H	α-helix	trans	-62.7	-44	175	-67	157	0	0	0	110.9	P902 Y903 M952 S954 T958 H960 A961	P902-I956 HydrophobicContact CG-CD1 3.89Å; P902-I956 HydrophobicContact CG-CG1 4.08Å; P902-I956 HydrophobicContact CG-CG2 3.6Å; Y903-I956 HydrophobicContact CD1-CD1 3.49Å; Y903-I956 VanDerWaalsContact CD1-CD1 3.49Å; Y903-I956 HydrophobicContact CE1-CD1 4.28Å; Y903-I956 HydrophobicContact CG-CD1 4.17Å; M952-I956 HydrophobicContact CG-CD1 3.77Å; M952-I956 WeakPolarHBondContact O-CD1 3.29Å; M952-I956 VanDerWaalsContact O-CG1 3.25Å; M952-I956 WeakPolarHBondContact O-CG1 3.42Å; M952-I956 PolarHBondContact O-N 3.22Å; M952-I956 HydrophobicContact SD-CD1 3.86Å; M952-I956 HydrophobicContact SD-CG1 4.14Å; S954-I956 PolarHBondContact O-N 3.01Å; I956-T958 PolarHBondContact O-N 3.47Å; I956-H960 HydrophobicContact CG2-CB 4.47Å; I956-H960 CarbonylContact O-C 3.59Å; I956-H960 WeakPolarHBondContact O-CA 3.29Å; I956-H960 WeakPolarHBondContact O-CB 3.42Å; I956-H960 PolarHBondContact O-N 3.43Å; I956-A961 PolarHBondContact O-N 2.93Å
957	S	71.9	Confident	62.9	Low	76 Å²	76	83.3 Å²	83.3	53%	0.531	48%	0.479	S	S	.	.	H	α-helix	trans	-70.3	-15.7	-178.3	73.3	0	0	0	0	114.4	K953 S954 H955	K953-S957 VanDerWaalsContact O-CB 3.27Å; K953-S957 WeakPolarHBondContact O-CB 3.42Å; K953-S957 PolarHBondContact O-N 2.83Å; K953-S957 PolarHBondContact O-OG 3.15Å; S954-S957 WeakPolarHBondContact CA-OG 3.38Å; S954-S957 PolarHBondContact O-N 3.08Å; S954-S957 PolarHBondContact O-OG 3.03Å; H955-S957 PolarHBondContact O-N 3.11Å
958	T	72.1	Confident	61.5	Low	114 Å²	114	82.8 Å²	82.8	70%	0.699	49%	0.485	S	S	*	.	H	α-helix	trans	-108	-40.6	179.4	50.5	0	0	0	0	112.8	S954 H955 I956	S954-T958 WeakPolarHBondContact O-CB 3.49Å; S954-T958 WeakPolarHBondContact O-CG2 3.49Å; S954-T958 PolarHBondContact O-N 3.06Å; S954-T958 PolarHBondContact O-OG1 3.47Å; H955-T958 PolarHBondContact O-N 3.3Å; H955-T958 PolarHBondContact O-OG1 2.84Å; I956-T958 PolarHBondContact O-N 3.47Å
959	G	65.6	Low	59.4	Low	50 Å²	50	85.2 Å²	85.2	52%	0.515	50%	0.501	S	S	.	.	H	α-helix	trans	-91.1	-22.7	-179.2	0	0	0	0	0	115.4	H955	H955-G959 PolarHBondContact O-N 3.29Å
960	H	67.6	Low	57.3	Low	31 Å²	31	85.6 Å²	85.6	14%	0.144	51%	0.513	C	S	.	.	S	Bend	trans	-127.1	11.7	-172.9	-59.2	-37.7	0	0	0	114.3	H955 I956 G962 L963	H955-H960 AromaticContact NE2-NE2 3.67Å; I956-H960 HydrophobicContact CG2-CB 4.47Å; I956-H960 CarbonylContact O-C 3.59Å; I956-H960 WeakPolarHBondContact O-CA 3.29Å; I956-H960 WeakPolarHBondContact O-CB 3.42Å; I956-H960 PolarHBondContact O-N 3.43Å; H960-G962 PolarHBondContact O-N 3.28Å; H960-G962 VanDerWaalsContact O-N 3.13Å; H960-L963 PolarHBondContact O-N 3.06Å; H960-L963 VanDerWaalsContact O-N 3.14Å
961	A	57.3	Low	55.2	Low	59 Å²	59	91.1 Å²	91.1	49%	0.488	53%	0.533	S	S	.	.	H	α-helix	trans	-49.1	-41.1	-179.3	0	0	0	0	0	114.2	I956 L963	I956-A961 PolarHBondContact O-N 2.93Å; A961-L963 PolarHBondContact O-N 3.49Å
962	G	49.2	Very low	52.8	Low	64 Å²	64	93.6 Å²	93.6	66%	0.66	55%	0.55	S	S	*	*	H	α-helix	trans	-70.6	-7.9	-175.9	0	0	0	0	0	116.2	H960	H960-G962 PolarHBondContact O-N 3.28Å; H960-G962 VanDerWaalsContact O-N 3.13Å
963	L	47.4	Very low	50.4	Low	124 Å²	124	103.4 Å²	103.4	65%	0.649	59%	0.593	S	S	*	*	H	α-helix	trans	-95.3	-22	-179.3	-64.8	-179.8	0	0	0	113.9	V941 H960 A961	V941-L963 HydrophobicContact CG1-CD1 4.4Å; H960-L963 PolarHBondContact O-N 3.06Å; H960-L963 VanDerWaalsContact O-N 3.14Å; A961-L963 PolarHBondContact O-N 3.49Å
964	N	42.1	Very low	48.1	Very low	84 Å²	84	102.7 Å²	102.7	45%	0.449	61%	0.606	S	S	.	*	H	α-helix	trans	-94	-10.8	179.2	-83	-16.4	0	0	0	113.7	N900 R966	N900-N964 PolarHBondContact ND2-OD1 3.44Å; N964-R966 VanDerWaalsContact C-N 3.31Å; N964-R966 PolarHBondContact O-N 3.43Å
965	S	36.4	Very low	45.9	Very low	91 Å²	91	106.7 Å²	106.7	64%	0.636	63%	0.628	S	S	*	*			trans	-82.8	66	177.4	61.9	0	0	0	0	112.9
966	R	34.3	Very low	43.4	Very low	238 Å²	238	110.6 Å²	110.6	90%	0.898	66%	0.659	S	S	*	*			trans	-138.9	54.8	168.8	-141.4	175.9	-164.8	-174.4	5.2	113.5	N964	N964-R966 VanDerWaalsContact C-N 3.31Å; N964-R966 PolarHBondContact O-N 3.43Å
967	S	25.3	Very low	41.4	Very low	110 Å²	110	114.9 Å²	114.9	77%	0.769	69%	0.691	S	S	*	*			trans	-61.3	141.5	168.6	-55.1	0	0	0	0	111.4
968	P	40.1	Very low	39.5	Very low	117 Å²	117	116.3 Å²	116.3	76%	0.76	70%	0.7	S	S	*	*			trans	-83.9	177.1	174.3	36.1	-36	0	0	0	112.3
969	L	27.7	Very low	37.5	Very low	170 Å²	170	118.3 Å²	118.3	89%	0.89	71%	0.706	S	S	*	*			trans	96.2	136.6	-167.6	-60.7	170.1	0	0	0	112
970	S	26.5	Very low	35.9	Very low	93 Å²	93	121.2 Å²	121.2	65%	0.65	72%	0.719	S	S	*	*			cis	-157.9	-172.9	-5	41.3	0	0	0	0	110.9
971	E	26.9	Very low	34.1	Very low	171 Å²	171	123.6 Å²	123.6	80%	0.799	74%	0.743	S	S	*	*			trans	73.4	103.7	168.3	-53.9	-170.9	172.9	0	0	116
972	T	28.9	Very low	32.7	Very low	125 Å²	125	128.9 Å²	128.9	77%	0.767	76%	0.763	S	S	*	*				71.7	97.8	69.2	64.8	0	0	0	0	116.4
973	K	31	Very low	31.8	Very low	207 Å²	207	129.7 Å²	129.7	90%	0.9	76%	0.758	S	S	*	*			trans	41.3	110.7	149.5	-63.7	-176.6	178.6	-178.2	0	118.8
974	S	27.7	Very low	30.9	Very low	126 Å²	126	130.4 Å²	130.4	88%	0.881	76%	0.763	S	S	*	*			trans	-154.1	149.1	130.2	-85.7	0	0	0	0	111.1
975	T	29.3	Very low	30.6	Very low	140 Å²	140	130.2 Å²	130.2	86%	0.859	77%	0.768	S	S	*	*			trans	-135.4	115	-175.6	48.9	0	0	0	0	110.6
976	S	29.5	Very low	30.2	Very low	113 Å²	113	132.9 Å²	132.9	79%	0.79	77%	0.774	S	S	*	*			trans	-163.2	100.8	165.3	55.3	0	0	0	0	113.6
977	S	32.4	Very low	30.1	Very low	110 Å²	110	128.3 Å²	128.3	77%	0.769	77%	0.768	S	S	*	*			trans	16.1	118.7	135.5	-48	0	0	0	0	121.6
978	S	31.6	Very low	30.3	Very low	105 Å²	105	128 Å²	128	73%	0.734	77%	0.765	S	S	*	*				74.2	158.1	113.7	-51.6	0	0	0	0	123
979	L	31.6	Very low	30	Very low	156 Å²	156	129.2 Å²	129.2	82%	0.817	77%	0.765	S	S	*	*			trans	81	117	167.3	-51.4	-173.8	0	0	0	114.3
980	S	31	Very low	30.4	Very low	112 Å²	112	129.7 Å²	129.7	78%	0.783	76%	0.763	S	S	*	*				75.5	140.7	75	-60.5	0	0	0	0	112.6
981	A	30.2	Very low	30.6	Very low	80 Å²	80	129 Å²	129	66%	0.661	77%	0.77	S	S	*	*			cis	-168.3	-166.4	-12	0	0	0	0	0	107.3
982	L	28.1	Very low	30.8	Very low	171 Å²	171	124.7 Å²	124.7	90%	0.895	77%	0.771	S	S	*	*			trans	72.4	158.2	168.7	-49.4	178.9	0	0	0	115.5
983	S	30.6	Very low	30.8	Very low	81 Å²	81	126.2 Å²	126.2	57%	0.566	78%	0.775	S	S	*	*			cis	-170.5	177	-32.6	-171.7	0	0	0	0	107.5
984	D	27.2	Very low	30.8	Very low	138 Å²	138	122.1 Å²	122.1	74%	0.738	77%	0.767	S	S	*	*			trans	74.1	143.1	149.1	-65.6	-45.9	0	0	0	120.5
985	S	35.4	Very low	30.8	Very low	81 Å²	81	119.8 Å²	119.8	57%	0.566	76%	0.755	S	S	*	*			cis	-172.4	152.8	-22.3	-115.6	0	0	0	0	109.9
986	L	29.4	Very low	30.7	Very low	146 Å²	146	122.5 Å²	122.5	76%	0.764	76%	0.758	S	S	*	*			trans	55.1	140.9	144.4	-59.5	170.4	0	0	0	118.4
987	N	31.8	Very low	30.6	Very low	143 Å²	143	120.3 Å²	120.3	77%	0.765	75%	0.753	S	S	*	*			cis	-163.3	178	31.7	-92.2	-49.2	0	0	0	107.3
988	S	29.5	Very low	30.4	Very low	102 Å²	102	122.5 Å²	122.5	71%	0.713	76%	0.756	S	S	*	*			cis	178.2	148.1	-28.1	-179.9	0	0	0	0	107.3
989	L	34.2	Very low	30.3	Very low	143 Å²	143	125.2 Å²	125.2	75%	0.749	76%	0.757	S	S	*	*			trans	153.3	111.9	135.8	-166.1	69.5	0	0	0	113
990	E	35.5	Very low	30.3	Very low	181 Å²	181	124 Å²	124	85%	0.846	75%	0.747	S	S	*	*			trans	21.2	146.5	146.9	-56.5	175.1	145.1	0	0	122.7
991	G	30.1	Very low	30.3	Very low	78 Å²	78	125.2 Å²	125.2	80%	0.804	74%	0.744	S	S	*	*			cis	163.1	150.3	-6.3	0	0	0	0	0	115.4
992	G	31.7	Very low	30.3	Very low	80 Å²	80	128.6 Å²	128.6	83%	0.825	74%	0.744	S	S	*	*			trans	84.7	143	165.4	0	0	0	0	0	118.2
993	D	29.2	Very low	30.1	Very low	157 Å²	157	127.9 Å²	127.9	84%	0.84	74%	0.741	S	S	*	*			cis	-163.4	163.9	-12.5	-155.2	-7.4	0	0	0	112.6
994	V	30.6	Very low	30	Very low	121 Å²	121	132 Å²	132	73%	0.733	76%	0.756	S	S	*	*			trans	77.4	122.2	162.7	-171.1	0	0	0	0	121.3
995	A	27.1	Very low	29.9	Very low	77 Å²	77	133.6 Å²	133.6	64%	0.636	76%	0.764	S	S	*	*			trans	55.9	102.7	157.1	0	0	0	0	0	119.9
996	H	28.5	Very low	29.4	Very low	197 Å²	197	134.2 Å²	134.2	91%	0.912	77%	0.774	S	S	*	*				69.1	112.3	71.8	-70.8	48	0	0	0	115.5
997	G	27.8	Very low	29.9	Very low	68 Å²	68	132.9 Å²	132.9	70%	0.701	77%	0.774	S	S	*	*			cis	176.5	146	-8.8	0	0	0	0	0	115.7
998	N	27.2	Very low	29.7	Very low	155 Å²	155	132.2 Å²	132.2	83%	0.829	78%	0.777	S	S	*	*			trans	52.8	130.2	163.8	-64.9	11.8	0	0	0	120.2
999	E	30.4	Very low	29.4	Very low	163 Å²	163	132.7 Å²	132.7	76%	0.762	78%	0.781	S	S	*	*			cis	72.8	132.8	45.3	-62.1	-73.4	88.4	0	0	113.4
1000	E	30	Very low	29.2	Very low	130 Å²	130	131.3 Å²	131.3	61%	0.607	78%	0.783	S	S	*	*			cis	-151.7	-175.4	-8.4	-156	-130.2	124.6	0	0	109.6	K1002	E1000-K1002 IonicContact OE1-NZ 2.93Å; E1000-K1002 PolarHBondContact OE1-NZ 3.05Å; E1000-K1002 IonicContact OE2-NZ 3.7Å
1001	L	32.7	Very low	28.9	Very low	137 Å²	137	127.7 Å²	127.7	72%	0.717	78%	0.784	S	S	*	*			trans	-76.9	138.2	179.3	-64	152.3	0	0	0	112.7
1002	K	28.4	Very low	28.6	Very low	151 Å²	151	127.2 Å²	127.2	66%	0.657	78%	0.779	S	S	*	*				173.7	153.3	115.6	-91.9	157.6	-149.3	84.8	0	116.1	E1000	E1000-K1002 IonicContact OE1-NZ 2.93Å; E1000-K1002 PolarHBondContact OE1-NZ 3.05Å; E1000-K1002 IonicContact OE2-NZ 3.7Å
1003	N	25.3	Very low	28.7	Very low	157 Å²	157	128.6 Å²	128.6	84%	0.84	78%	0.776	S	S	*	*			trans	70.8	133.2	153.1	-62.8	-17.1	0	0	0	120.7
1004	L	28.8	Very low	28.9	Very low	167 Å²	167	130.3 Å²	130.3	87%	0.874	78%	0.779	S	S	*	*			trans	-102.4	129.4	174	-63.4	163.2	0	0	0	109.7
1005	L	25.1	Very low	28.8	Very low	171 Å²	171	128.4 Å²	128.4	90%	0.895	78%	0.776	S	S	*	*				-171.9	155.1	122.4	-127.3	69.8	0	0	0	112.8
1006	A	23.9	Very low	28.9	Very low	95 Å²	95	130.4 Å²	130.4	79%	0.785	79%	0.785	S	S	*	*			trans	71	142.7	171.2	0	0	0	0	0	118.3
1007	P	41	Very low	28.8	Very low	117 Å²	117	126.6 Å²	126.6	76%	0.76	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-103.1	167.7	179.6	40.4	-35.6	0	0	0	113.6
1008	P	27.2	Very low	28.7	Very low	129 Å²	129	126.7 Å²	126.7	84%	0.838	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-98.2	147.6	159.3	36	-29.7	0	0	0	112.6
1009	S	23.4	Very low	28.8	Very low	112 Å²	112	123.6 Å²	123.6	78%	0.783	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-94.9	160.3	174.6	-53.9	0	0	0	0	112.3
1010	S	28.9	Very low	28.7	Very low	115 Å²	115	124.3 Å²	124.3	80%	0.804	77%	0.774	S	S	*	*				135.8	146.5	117.7	69.4	0	0	0	0	117.3
1011	A	29	Very low	28.7	Very low	104 Å²	104	123.6 Å²	123.6	86%	0.86	78%	0.783	S	S	*	*			trans	59.4	148.7	165.6	0	0	0	0	0	118.5
1012	G	25.4	Very low	28.3	Very low	68 Å²	68	121.1 Å²	121.1	70%	0.701	79%	0.791	S	S	*	*			cis	129.5	146.5	2.2	0	0	0	0	0	111.4
1013	S	33.7	Very low	28.6	Very low	109 Å²	109	120.2 Å²	120.2	76%	0.762	80%	0.804	S	S	*	*			cis	-165.3	142.7	0.8	-74.3	0	0	0	0	111.9
1014	Q	32.7	Very low	28.6	Very low	193 Å²	193	116 Å²	116	90%	0.902	80%	0.797	S	S	*	*			trans	56.7	169.4	145.6	-60	-170.4	5.6	0	0	119.3
1015	A	28.5	Very low	29.2	Very low	82 Å²	82	115.1 Å²	115.1	68%	0.678	80%	0.799	S	S	*	*			cis	-140.4	149.9	6.6	0	0	0	0	0	110.4
1016	S	28.4	Very low	29.5	Very low	118 Å²	118	116.6 Å²	116.6	83%	0.825	80%	0.801	S	S	*	*				66	140.7	87.2	-150.7	0	0	0	0	114.7
1017	C	27.5	Very low	30.1	Very low	118 Å²	118	119.1 Å²	119.1	80%	0.797	80%	0.801	S	S	*	*			cis	-141.6	160.2	7.3	54.2	0	0	0	0	110.9
1018	G	25.7	Very low	30	Very low	69 Å²	69	123.1 Å²	123.1	71%	0.711	81%	0.807	S	S	*	*				128.8	161	85.3	0	0	0	0	0	109.5
1019	S	29.1	Very low	30.6	Very low	90 Å²	90	121.8 Å²	121.8	63%	0.629	80%	0.801	S	S	*	*			cis	-162.4	169.2	4.1	-69.9	0	0	0	0	111.3
1020	H	28.8	Very low	31.8	Very low	179 Å²	179	123.7 Å²	123.7	83%	0.829	80%	0.802	S	S	*	*			trans	73.8	144.5	165.9	-45.9	-61.9	0	0	0	117.7
1021	S	29.1	Very low	33.2	Very low	114 Å²	114	127.1 Å²	127.1	80%	0.797	80%	0.803	S	S	*	*			cis	-163.1	142.1	-19	-92.8	0	0	0	0	108.7
1022	G	25.5	Very low	35	Very low	85 Å²	85	123.3 Å²	123.3	88%	0.876	77%	0.773	S	S	*	*			trans	175	146.1	174.8	0	0	0	0	0	113.7
1023	S	33.1	Very low	37.1	Very low	133 Å²	133	124.2 Å²	124.2	93%	0.93	76%	0.758	S	S	*	*			trans	-108.7	144.8	179.7	-173.6	0	0	0	0	111.1
1024	G	26.8	Very low	39.1	Very low	68 Å²	68	125.3 Å²	125.3	70%	0.701	75%	0.751	S	S	*	*			trans	-177.9	131.9	175.5	0	0	0	0	0	112.5
1025	T	40.5	Very low	40.8	Very low	148 Å²	148	116.1 Å²	116.1	91%	0.908	71%	0.708	S	S	*	*			trans	-101.6	123.1	174	51.2	0	0	0	0	109.8
1026	E	32.4	Very low	42.7	Very low	202 Å²	202	117.6 Å²	117.6	94%	0.944	71%	0.709	S	S	*	*			trans	-116.8	148.7	177.6	-68.1	-148.6	112.2	0	0	114.5
1027	D	35.1	Very low	44.1	Very low	148 Å²	148	118.6 Å²	118.6	79%	0.791	70%	0.698	S	S	*	*			trans	-83.3	148.4	-156.3	-166.1	-107.5	0	0	0	113.6	S1029	D1027-S1029 PolarHBondContact O-N 3.27Å
1028	K	38.4	Very low	46	Very low	201 Å²	201	115.9 Å²	115.9	87%	0.874	68%	0.68	S	S	*	*			trans	-92.2	95.8	167.6	-82.1	-175.9	177.3	175	0	109.4	D1030	K1028-D1030 PolarHBondContact O-N 2.88Å
1029	S	40.6	Very low	47.5	Very low	102 Å²	102	118.4 Å²	118.4	71%	0.713	68%	0.677	S	S	*	*			trans	-54.7	101.5	-177.7	62	0	0	0	0	113	D1027 K1031	D1027-S1029 PolarHBondContact O-N 3.27Å; S1029-K1031 PolarHBondContact O-N 3.26Å
1030	D	47.9	Very low	49.3	Very low	151 Å²	151	119.5 Å²	119.5	81%	0.807	67%	0.671	S	S	*	*			trans	-71.6	122.1	179.2	-149.7	-21.6	0	0	0	110.4	K1028 G1032	K1028-D1030 PolarHBondContact O-N 2.88Å; D1030-G1032 PolarHBondContact O-N 3.09Å
1031	K	59.2	Low	51.1	Low	188 Å²	188	114.9 Å²	114.9	82%	0.817	66%	0.655	S	S	*	*			trans	-77.4	96	-174.2	-71.1	-171.5	178.4	-174.7	0	110.1	S1029	S1029-K1031 PolarHBondContact O-N 3.26Å
1032	G	66	Low	53.4	Low	24 Å²	24	109.5 Å²	109.5	25%	0.247	62%	0.618	C	S	.	*			trans	-59.2	153.1	179.4	0	0	0	0	0	114	D1030 E1034	D1030-G1032 PolarHBondContact O-N 3.09Å; G1032-E1034 PolarHBondContact O-N 2.85Å
1033	F	70.2	Confident	55.4	Low	87 Å²	87	114.1 Å²	114.1	38%	0.382	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.5	102.1	-178.3	-63.4	-94.9	0	0	0	110.5	C1042 R1045 Y1048	F1033-C1042 HydrophobicContact CB-CB 4.44Å; F1033-C1042 PolarHBondContact N-O 3.21Å; F1033-C1042 WeakPolarHBondContact O-CB 3.44Å; F1033-C1042 PolarHBondContact O-N 2.85Å; F1033-R1045 HydrophobicContact CD1-CB 4.47Å; F1033-R1045 HydrophobicContact CD2-CB 4.24Å; F1033-R1045 HydrophobicContact CE1-CB 4.12Å; F1033-R1045 HydrophobicContact CE1-CG 4.33Å; F1033-R1045 HydrophobicContact CE2-CB 3.89Å; F1033-R1045 HydrophobicContact CZ-CB 3.83Å; F1033-R1045 HydrophobicContact CZ-CG 4.49Å; F1033-Y1048 HydrophobicContact CB-CD1 3.76Å; F1033-Y1048 HydrophobicContact CB-CG 3.86Å; F1033-Y1048 HydrophobicContact CD1-CD1 4.34Å; F1033-Y1048 HydrophobicContact CG-CD1 4.4Å
1034	E	75	Confident	57.2	Low	131 Å²	131	110.8 Å²	110.8	61%	0.612	59%	0.587	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.3	145.5	176.5	68	-164.3	159.7	0	0	113.1	G1032 V1041 Y1048	G1032-E1034 PolarHBondContact O-N 2.85Å; E1034-V1041 HydrophobicContact CB-CG2 4.22Å; E1034-Y1048 WeakPolarHBondContact O-CE2 3.4Å; E1034-Y1048 VanDerWaalsContact O-CZ 3.31Å; E1034-Y1048 PolarHBondContact O-OH 2.9Å
1035	C	68.9	Low	59.2	Low	0 Å²	0	114.7 Å²	114.7	0%	0	58%	0.581	C	S	.	*			trans	-98.2	114.5	176.1	-177.7	0	0	0	0	112.7	F1037 C1038 N1039 F1040 Y1048 H1051 H1055	C1035-F1037 PolarHBondContact O-N 3.24Å; C1035-C1038 PolarHBondContact O-N 3.43Å; C1035-N1039 VanDerWaalsContact O-CA 3.26Å; C1035-N1039 WeakPolarHBondContact O-CA 3.49Å; C1035-N1039 PolarHBondContact O-N 3.42Å; C1035-F1040 PolarHBondContact N-O 3.12Å; C1035-F1040 VanDerWaalsContact N-O 3.1Å; C1035-Y1048 HydrophobicContact CB-CD2 4.14Å; C1035-Y1048 HydrophobicContact CB-CE2 3.68Å; C1035-H1051 VanDerWaalsContact CB-CD2 3.47Å; C1035-H1051 WeakPolarHBondContact CB-CD2 3.36Å; C1035-H1051 WeakPolarHBondContact CB-NE2 3.27Å; C1035-H1051 PolarHBondContact SG-CD2 3.4Å; C1035-H1051 PolarHBondContact SG-NE2 3Å; C1035-H1051 VanDerWaalsContact SG-NE2 3.4Å; C1035-H1055 PolarHBondContact SG-NE2 3.22Å
1036	V	68.3	Low	60.3	Low	114 Å²	114	110.7 Å²	110.7	69%	0.691	56%	0.559	S	S	*	*	T	Hydrogen-bonded Turn	trans	-51.8	-23.2	178.4	-171.6	0	0	0	0	114.3
1037	F	58.9	Low	61.9	Low	139 Å²	139	103 Å²	103	61%	0.61	52%	0.524	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-13	-178.7	-60.1	-70.6	0	0	0	115.3	C1035 L1052 H1055	C1035-F1037 PolarHBondContact O-N 3.24Å; F1037-L1052 HydrophobicContact CD2-CD2 3.93Å; F1037-L1052 HydrophobicContact CE2-CD2 3.84Å; F1037-H1055 HydrophobicContact CD2-CB 4.41Å
1038	C	65.9	Low	64	Low	60 Å²	60	98 Å²	98	41%	0.405	49%	0.494	S	S	.	.	T	Hydrogen-bonded Turn	trans	-159.8	15.3	178.9	65	0	0	0	0	114.9	C1035 F1040 H1051 H1055	C1035-C1038 PolarHBondContact O-N 3.43Å; C1038-F1040 PolarHBondContact O-N 2.91Å; C1038-H1051 PolarHBondContact SG-CE1 3.14Å; C1038-H1051 PolarHBondContact SG-NE2 3.18Å; C1038-H1055 PolarHBondContact SG-NE2 3.42Å
1039	N	57	Low	65.6	Low	123 Å²	123	92.9 Å²	92.9	66%	0.658	47%	0.473	S	S	*	.			trans	52.5	20	-178.7	-57.6	-17.2	0	0	0	115.8	C1035 V1041	C1035-N1039 VanDerWaalsContact O-CA 3.26Å; C1035-N1039 WeakPolarHBondContact O-CA 3.49Å; C1035-N1039 PolarHBondContact O-N 3.42Å; N1039-V1041 PolarHBondContact O-N 3.39Å
1040	F	68.6	Low	67.1	Low	112 Å²	112	94 Å²	94	49%	0.491	46%	0.462	S	S	.	.			trans	-75.6	115	-179.5	-174	-101.9	0	0	0	112	C1035 C1038 C1042 H1051	C1035-F1040 PolarHBondContact N-O 3.12Å; C1035-F1040 VanDerWaalsContact N-O 3.1Å; C1038-F1040 PolarHBondContact O-N 2.91Å; F1040-C1042 PolarHBondContact O-N 3Å; F1040-H1051 AromaticContact CD1-CE1 3.96Å; F1040-H1051 AromaticContact CD1-ND1 3.87Å
1041	V	66.6	Low	68.4	Low	83 Å²	83	88.2 Å²	88.2	50%	0.503	43%	0.43	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	104	-175.6	-176.3	0	0	0	0	111.6	E1034 N1039	E1034-V1041 HydrophobicContact CB-CG2 4.22Å; N1039-V1041 PolarHBondContact O-N 3.39Å
1042	C	75.5	Confident	69	Low	1 Å²	1	81 Å²	81	1%	0.007	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	114.1	178.3	-70.6	0	0	0	0	111.9	F1033 F1040 T1044 M1047	F1033-C1042 HydrophobicContact CB-CB 4.44Å; F1033-C1042 PolarHBondContact N-O 3.21Å; F1033-C1042 WeakPolarHBondContact O-CB 3.44Å; F1033-C1042 PolarHBondContact O-N 2.85Å; F1040-C1042 PolarHBondContact O-N 3Å; C1042-T1044 PolarHBondContact O-N 3.14Å; C1042-M1047 HydrophobicContact CB-CB 3.94Å
1043	K	68.1	Low	69.2	Low	182 Å²	182	84.5 Å²	84.5	79%	0.791	41%	0.41	S	S	*	.	S	Bend	trans	-57.4	-13.6	177.9	-67	-167.1	176.5	-168.9	0	115.8
1044	T	72.2	Confident	68.9	Low	62 Å²	62	84.8 Å²	84.8	38%	0.38	42%	0.415	S	S	.	.	S	Bend	trans	-138.4	148.5	171.8	69.6	0	0	0	0	112.1	C1042 S1046 M1047 Y1048	C1042-T1044 PolarHBondContact O-N 3.14Å; T1044-S1046 PolarHBondContact O-N 3.33Å; T1044-S1046 PolarHBondContact OG1-OG 3.32Å; T1044-M1047 WeakPolarHBondContact O-CB 3.35Å; T1044-M1047 PolarHBondContact O-N 3.13Å; T1044-M1047 WeakPolarHBondContact OG1-CG 3.44Å; T1044-M1047 PolarHBondContact OG1-N 2.92Å; T1044-Y1048 PolarHBondContact O-N 3.4Å
1045	R	67.4	Low	68.4	Low	150 Å²	150	81.7 Å²	81.7	57%	0.566	40%	0.4	S	S	*	.	H	α-helix	trans	-54.9	-37.5	175.5	-172.7	178.7	172.4	105.1	16.7	112.9	F1033 M1047 Y1048 E1049	F1033-R1045 HydrophobicContact CD1-CB 4.47Å; F1033-R1045 HydrophobicContact CD2-CB 4.24Å; F1033-R1045 HydrophobicContact CE1-CB 4.12Å; F1033-R1045 HydrophobicContact CE1-CG 4.33Å; F1033-R1045 HydrophobicContact CE2-CB 3.89Å; F1033-R1045 HydrophobicContact CZ-CB 3.83Å; F1033-R1045 HydrophobicContact CZ-CG 4.49Å; R1045-M1047 VanDerWaalsContact C-N 3.28Å; R1045-M1047 PolarHBondContact O-N 2.95Å; R1045-Y1048 PolarHBondContact O-N 2.81Å; R1045-Y1048 VanDerWaalsContact O-N 3.15Å; R1045-E1049 HydrophobicContact CG-CG 4.41Å; R1045-E1049 IonicContact CZ-OE1 2.91Å; R1045-E1049 VanDerWaalsContact CZ-OE1 3.26Å; R1045-E1049 IonicContact NE-OE1 2.74Å; R1045-E1049 PolarHBondContact NE-OE1 3.41Å; R1045-E1049 IonicContact NH2-OE1 2.75Å; R1045-E1049 PolarHBondContact NH2-OE1 3.12Å; R1045-E1049 WeakPolarHBondContact O-CG 3.25Å; R1045-E1049 PolarHBondContact O-N 2.91Å
1046	S	64.2	Low	68.1	Low	65 Å²	65	85.4 Å²	85.4	46%	0.455	42%	0.419	S	S	.	.	H	α-helix	trans	-69	-24.8	178.7	84.3	0	0	0	0	113.7	T1044 R1050	T1044-S1046 PolarHBondContact O-N 3.33Å; T1044-S1046 PolarHBondContact OG1-OG 3.32Å; S1046-R1050 PolarHBondContact O-N 3.39Å; S1046-R1050 PolarHBondContact O-NE 3.17Å; S1046-R1050 PolarHBondContact O-NH2 3.31Å; S1046-R1050 VanDerWaalsContact O-NH2 3.08Å; S1046-R1050 PolarHBondContact OG-NH2 2.74Å
1047	M	66.8	Low	67.3	Low	39 Å²	39	86.1 Å²	86.1	19%	0.192	42%	0.418	C	S	.	.	H	α-helix	trans	-75.6	-43.7	168.7	-74.1	172	62.8	0	0	110.2	F458 C1042 T1044 R1045 E1049 R1050 H1051	F458-M1047 HydrophobicContact CE1-CE 4.19Å; F458-M1047 HydrophobicContact CE1-SD 3.96Å; F458-M1047 HydrophobicContact CZ-CE 3.73Å; F458-M1047 HydrophobicContact CZ-CG 4.48Å; F458-M1047 HydrophobicContact CZ-SD 3.74Å; C1042-M1047 HydrophobicContact CB-CB 3.94Å; T1044-M1047 WeakPolarHBondContact O-CB 3.35Å; T1044-M1047 PolarHBondContact O-N 3.13Å; T1044-M1047 WeakPolarHBondContact OG1-CG 3.44Å; T1044-M1047 PolarHBondContact OG1-N 2.92Å; R1045-M1047 VanDerWaalsContact C-N 3.28Å; R1045-M1047 PolarHBondContact O-N 2.95Å; M1047-E1049 PolarHBondContact O-N 3.15Å; M1047-R1050 CarbonylContact O-C 3.56Å; M1047-R1050 PolarHBondContact O-N 3.31Å; M1047-R1050 VanDerWaalsContact O-N 3.17Å; M1047-H1051 VanDerWaalsContact O-CB 3.27Å; M1047-H1051 WeakPolarHBondContact O-CB 3.34Å; M1047-H1051 PolarHBondContact O-N 3.41Å
1048	Y	78.3	Confident	66.8	Low	45 Å²	45	82.8 Å²	82.8	18%	0.176	41%	0.409	C	S	.	.	H	α-helix	trans	-59.8	-46.5	178.4	-179	-144.4	0	0	0	111.9	F1033 E1034 C1035 T1044 R1045 R1050 H1051 L1052	F1033-Y1048 HydrophobicContact CB-CD1 3.76Å; F1033-Y1048 HydrophobicContact CB-CG 3.86Å; F1033-Y1048 HydrophobicContact CD1-CD1 4.34Å; F1033-Y1048 HydrophobicContact CG-CD1 4.4Å; E1034-Y1048 WeakPolarHBondContact O-CE2 3.4Å; E1034-Y1048 VanDerWaalsContact O-CZ 3.31Å; E1034-Y1048 PolarHBondContact O-OH 2.9Å; C1035-Y1048 HydrophobicContact CB-CD2 4.14Å; C1035-Y1048 HydrophobicContact CB-CE2 3.68Å; T1044-Y1048 PolarHBondContact O-N 3.4Å; R1045-Y1048 PolarHBondContact O-N 2.81Å; R1045-Y1048 VanDerWaalsContact O-N 3.15Å; Y1048-R1050 VanDerWaalsContact C-N 3.32Å; Y1048-R1050 PolarHBondContact O-N 2.95Å; Y1048-H1051 PolarHBondContact O-N 3.46Å; Y1048-H1051 VanDerWaalsContact O-N 3.13Å; Y1048-L1052 HydrophobicContact CD1-CD1 4.18Å; Y1048-L1052 HydrophobicContact CD2-CD1 3.98Å; Y1048-L1052 HydrophobicContact CD2-CG 3.87Å; Y1048-L1052 HydrophobicContact CE1-CD1 3.87Å; Y1048-L1052 HydrophobicContact CE2-CD1 3.58Å; Y1048-L1052 HydrophobicContact CE2-CD2 3.82Å; Y1048-L1052 HydrophobicContact CE2-CG 3.44Å; Y1048-L1052 VanDerWaalsContact CE2-CG 3.44Å; Y1048-L1052 HydrophobicContact CG-CD1 4.25Å; Y1048-L1052 WeakPolarHBondContact O-CB 3.3Å; Y1048-L1052 WeakPolarHBondContact O-CG 3.32Å; Y1048-L1052 PolarHBondContact O-N 2.86Å
1049	E	72.3	Confident	65.8	Low	93 Å²	93	87.2 Å²	87.2	44%	0.435	42%	0.417	S	S	.	.	H	α-helix	trans	-62.6	-36.5	176.1	-71.8	172.5	175.4	0	0	112.1	R1045 M1047 Q1053	R1045-E1049 HydrophobicContact CG-CG 4.41Å; R1045-E1049 IonicContact CZ-OE1 2.91Å; R1045-E1049 VanDerWaalsContact CZ-OE1 3.26Å; R1045-E1049 IonicContact NE-OE1 2.74Å; R1045-E1049 PolarHBondContact NE-OE1 3.41Å; R1045-E1049 IonicContact NH2-OE1 2.75Å; R1045-E1049 PolarHBondContact NH2-OE1 3.12Å; R1045-E1049 WeakPolarHBondContact O-CG 3.25Å; R1045-E1049 PolarHBondContact O-N 2.91Å; M1047-E1049 PolarHBondContact O-N 3.15Å; E1049-Q1053 VanDerWaalsContact O-CB 3.3Å; E1049-Q1053 WeakPolarHBondContact O-CB 3.41Å; E1049-Q1053 PolarHBondContact O-N 3.03Å
1050	R	72.3	Confident	65.8	Low	125 Å²	125	85.3 Å²	85.3	47%	0.472	41%	0.406	S	S	.	.	H	α-helix	trans	-69.5	-35.3	172.2	-108.1	176.8	-64.1	122	0.4	113.5	S1046 M1047 Y1048 Q1053 I1054	S1046-R1050 PolarHBondContact O-N 3.39Å; S1046-R1050 PolarHBondContact O-NE 3.17Å; S1046-R1050 PolarHBondContact O-NH2 3.31Å; S1046-R1050 VanDerWaalsContact O-NH2 3.08Å; S1046-R1050 PolarHBondContact OG-NH2 2.74Å; M1047-R1050 CarbonylContact O-C 3.56Å; M1047-R1050 PolarHBondContact O-N 3.31Å; M1047-R1050 VanDerWaalsContact O-N 3.17Å; Y1048-R1050 VanDerWaalsContact C-N 3.32Å; Y1048-R1050 PolarHBondContact O-N 2.95Å; R1050-Q1053 CarbonylContact O-C 3.27Å; R1050-Q1053 WeakPolarHBondContact O-CA 3.16Å; R1050-Q1053 WeakPolarHBondContact O-CB 3.31Å; R1050-Q1053 PolarHBondContact O-N 3.02Å; R1050-I1054 PolarHBondContact O-N 3.5Å
1051	H	73.9	Confident	65.6	Low	30 Å²	30	83.4 Å²	83.4	14%	0.139	40%	0.397	C	S	.	.	H	α-helix	trans	-74.5	-42.1	-180	173.8	91.3	0	0	0	110.9	C1035 C1038 F1040 M1047 Y1048 Q1053 I1054 H1055	C1035-H1051 VanDerWaalsContact CB-CD2 3.47Å; C1035-H1051 WeakPolarHBondContact CB-CD2 3.36Å; C1035-H1051 WeakPolarHBondContact CB-NE2 3.27Å; C1035-H1051 PolarHBondContact SG-CD2 3.4Å; C1035-H1051 PolarHBondContact SG-NE2 3Å; C1035-H1051 VanDerWaalsContact SG-NE2 3.4Å; C1038-H1051 PolarHBondContact SG-CE1 3.14Å; C1038-H1051 PolarHBondContact SG-NE2 3.18Å; F1040-H1051 AromaticContact CD1-CE1 3.96Å; F1040-H1051 AromaticContact CD1-ND1 3.87Å; M1047-H1051 VanDerWaalsContact O-CB 3.27Å; M1047-H1051 WeakPolarHBondContact O-CB 3.34Å; M1047-H1051 PolarHBondContact O-N 3.41Å; Y1048-H1051 PolarHBondContact O-N 3.46Å; Y1048-H1051 VanDerWaalsContact O-N 3.13Å; H1051-Q1053 PolarHBondContact O-N 3.04Å; H1051-I1054 WeakPolarHBondContact O-CA 3.43Å; H1051-I1054 VanDerWaalsContact O-CB 3.3Å; H1051-I1054 WeakPolarHBondContact O-CB 3.21Å; H1051-I1054 PolarHBondContact O-N 3.04Å; H1051-H1055 AromaticContact CD2-CD2 3.83Å; H1051-H1055 AromaticContact CD2-NE2 3.23Å; H1051-H1055 PolarHBondContact CD2-NE2 3.35Å; H1051-H1055 AromaticContact CE1-NE2 2.9Å; H1051-H1055 PolarHBondContact CE1-NE2 3.46Å; H1051-H1055 AromaticContact ND1-NE2 3.95Å; H1051-H1055 AromaticContact NE2-CD2 3.59Å; H1051-H1055 AromaticContact NE2-NE2 2.25Å; H1051-H1055 PolarHBondContact NE2-NE2 3.25Å; H1051-H1055 PolarHBondContact O-CD2 2.68Å; H1051-H1055 PolarHBondContact O-N 2.92Å
1052	L	72.4	Confident	65.7	Low	37 Å²	37	83.1 Å²	83.1	19%	0.194	39%	0.39	C	S	.	.	H	α-helix	trans	-54.4	-42	162.5	-75.7	168.2	0	0	0	111	F1037 Y1048 I1054 H1055 L1056	F1037-L1052 HydrophobicContact CD2-CD2 3.93Å; F1037-L1052 HydrophobicContact CE2-CD2 3.84Å; Y1048-L1052 HydrophobicContact CD1-CD1 4.18Å; Y1048-L1052 HydrophobicContact CD2-CD1 3.98Å; Y1048-L1052 HydrophobicContact CD2-CG 3.87Å; Y1048-L1052 HydrophobicContact CE1-CD1 3.87Å; Y1048-L1052 HydrophobicContact CE2-CD1 3.58Å; Y1048-L1052 HydrophobicContact CE2-CD2 3.82Å; Y1048-L1052 HydrophobicContact CE2-CG 3.44Å; Y1048-L1052 VanDerWaalsContact CE2-CG 3.44Å; Y1048-L1052 HydrophobicContact CG-CD1 4.25Å; Y1048-L1052 WeakPolarHBondContact O-CB 3.3Å; Y1048-L1052 WeakPolarHBondContact O-CG 3.32Å; Y1048-L1052 PolarHBondContact O-N 2.86Å; L1052-I1054 PolarHBondContact O-N 2.87Å; L1052-H1055 CarbonylContact O-C 3.56Å; L1052-H1055 PolarHBondContact O-N 3.09Å; L1052-H1055 VanDerWaalsContact O-N 3.12Å; L1052-L1056 WeakPolarHBondContact O-CB 3.39Å; L1052-L1056 VanDerWaalsContact O-CG 3.25Å; L1052-L1056 WeakPolarHBondContact O-CG 3.32Å; L1052-L1056 PolarHBondContact O-N 3.18Å
1053	Q	69.9	Low	65.7	Low	96 Å²	96	83.1 Å²	83.1	45%	0.449	39%	0.39	S	S	.	.	H	α-helix	trans	-64.7	-23.5	176.4	-160.9	63.8	32.4	0	0	113	E1049 R1050 H1051 I1057	E1049-Q1053 VanDerWaalsContact O-CB 3.3Å; E1049-Q1053 WeakPolarHBondContact O-CB 3.41Å; E1049-Q1053 PolarHBondContact O-N 3.03Å; R1050-Q1053 CarbonylContact O-C 3.27Å; R1050-Q1053 WeakPolarHBondContact O-CA 3.16Å; R1050-Q1053 WeakPolarHBondContact O-CB 3.31Å; R1050-Q1053 PolarHBondContact O-N 3.02Å; H1051-Q1053 PolarHBondContact O-N 3.04Å; Q1053-I1057 HydrophobicContact CG-CD1 3.84Å; Q1053-I1057 HydrophobicContact CG-CG1 4.3Å; Q1053-I1057 VanDerWaalsContact O-CB 3.28Å; Q1053-I1057 WeakPolarHBondContact O-CB 3.46Å; Q1053-I1057 WeakPolarHBondContact O-CD1 3.33Å; Q1053-I1057 WeakPolarHBondContact O-CG1 3.45Å; Q1053-I1057 PolarHBondContact O-N 3.02Å
1054	I	65.1	Low	66	Low	94 Å²	94	80 Å²	80	48%	0.482	38%	0.382	S	S	.	.	H	α-helix	trans	-64.9	-61	166	-60.7	170.1	0	0	0	108.3	R1050 H1051 L1052 L1056 I1057 T1058	R1050-I1054 PolarHBondContact O-N 3.5Å; H1051-I1054 WeakPolarHBondContact O-CA 3.43Å; H1051-I1054 VanDerWaalsContact O-CB 3.3Å; H1051-I1054 WeakPolarHBondContact O-CB 3.21Å; H1051-I1054 PolarHBondContact O-N 3.04Å; L1052-I1054 PolarHBondContact O-N 2.87Å; I1054-L1056 PolarHBondContact O-N 2.91Å; I1054-L1056 VanDerWaalsContact O-N 3.08Å; I1054-I1057 CarbonylContact O-C 3.31Å; I1054-I1057 PolarHBondContact O-N 3.23Å; I1054-T1058 HydrophobicContact CG2-CG2 4.34Å; I1054-T1058 PolarHBondContact O-N 2.93Å; I1054-T1058 PolarHBondContact O-OG1 2.88Å
1055	H	64.7	Low	66	Low	65 Å²	65	81.4 Å²	81.4	30%	0.301	39%	0.39	S	S	.	.	H	α-helix	trans	-53.2	-32.5	178.3	-67.1	-74.7	0	0	0	114.1	C1035 F1037 C1038 H1051 L1052 T1058 R1059	C1035-H1055 PolarHBondContact SG-NE2 3.22Å; F1037-H1055 HydrophobicContact CD2-CB 4.41Å; C1038-H1055 PolarHBondContact SG-NE2 3.42Å; H1051-H1055 AromaticContact CD2-CD2 3.83Å; H1051-H1055 AromaticContact CD2-NE2 3.23Å; H1051-H1055 PolarHBondContact CD2-NE2 3.35Å; H1051-H1055 AromaticContact CE1-NE2 2.9Å; H1051-H1055 PolarHBondContact CE1-NE2 3.46Å; H1051-H1055 AromaticContact ND1-NE2 3.95Å; H1051-H1055 AromaticContact NE2-CD2 3.59Å; H1051-H1055 AromaticContact NE2-NE2 2.25Å; H1051-H1055 PolarHBondContact NE2-NE2 3.25Å; H1051-H1055 PolarHBondContact O-CD2 2.68Å; H1051-H1055 PolarHBondContact O-N 2.92Å; L1052-H1055 CarbonylContact O-C 3.56Å; L1052-H1055 PolarHBondContact O-N 3.09Å; L1052-H1055 VanDerWaalsContact O-N 3.12Å; H1055-T1058 CarbonylContact O-C 3.46Å; H1055-T1058 VanDerWaalsContact O-C 3.27Å; H1055-R1059 WeakPolarHBondContact O-CG 3.49Å; H1055-R1059 PolarHBondContact O-N 2.64Å; H1055-R1059 VanDerWaalsContact O-N 3.14Å
1056	L	61.2	Low	66.4	Low	78 Å²	78	76.2 Å²	76.2	41%	0.408	38%	0.377	S	S	.	.	H	α-helix	trans	-76.8	-34.8	176.9	-68.5	166	0	0	0	113.4	L1052 I1054	L1052-L1056 WeakPolarHBondContact O-CB 3.39Å; L1052-L1056 VanDerWaalsContact O-CG 3.25Å; L1052-L1056 WeakPolarHBondContact O-CG 3.32Å; L1052-L1056 PolarHBondContact O-N 3.18Å; I1054-L1056 PolarHBondContact O-N 2.91Å; I1054-L1056 VanDerWaalsContact O-N 3.08Å
1057	I	51.4	Low	66.6	Low	130 Å²	130	78.9 Å²	78.9	67%	0.667	38%	0.382	S	S	*	.	H	α-helix	trans	-81.5	-33.8	175.1	-70	172.3	0	0	0	111	Q1053 I1054	Q1053-I1057 HydrophobicContact CG-CD1 3.84Å; Q1053-I1057 HydrophobicContact CG-CG1 4.3Å; Q1053-I1057 VanDerWaalsContact O-CB 3.28Å; Q1053-I1057 WeakPolarHBondContact O-CB 3.46Å; Q1053-I1057 WeakPolarHBondContact O-CD1 3.33Å; Q1053-I1057 WeakPolarHBondContact O-CG1 3.45Å; Q1053-I1057 PolarHBondContact O-N 3.02Å; I1054-I1057 CarbonylContact O-C 3.31Å; I1054-I1057 PolarHBondContact O-N 3.23Å
1058	T	48.6	Very low	66.5	Low	68 Å²	68	83 Å²	83	42%	0.417	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	48.9	172.9	68.9	0	0	0	0	110.4	I1054 H1055 M1060	I1054-T1058 HydrophobicContact CG2-CG2 4.34Å; I1054-T1058 PolarHBondContact O-N 2.93Å; I1054-T1058 PolarHBondContact O-OG1 2.88Å; H1055-T1058 CarbonylContact O-C 3.46Å; H1055-T1058 VanDerWaalsContact O-C 3.27Å; T1058-M1060 PolarHBondContact O-N 3.23Å
1059	R	46.1	Very low	66	Low	153 Å²	153	86.2 Å²	86.2	58%	0.577	41%	0.414	S	S	*	.			trans	-66.8	67	157.6	-78.2	-175.5	171.5	173.9	-2.7	109.3	H1055	H1055-R1059 WeakPolarHBondContact O-CG 3.49Å; H1055-R1059 PolarHBondContact O-N 2.64Å; H1055-R1059 VanDerWaalsContact O-N 3.14Å
1060	M	56.1	Low	66.2	Low	84 Å²	84	83.7 Å²	83.7	41%	0.414	40%	0.403	S	S	.	.			trans	-87.1	115.4	166.5	-60.8	-178.5	66.3	0	0	105.7	T1058 E1062 F1069 L1070	T1058-M1060 PolarHBondContact O-N 3.23Å; M1060-E1062 PolarHBondContact O-N 3.04Å; M1060-E1062 VanDerWaalsContact O-N 3.1Å; M1060-F1069 HydrophobicContact CB-CB 3.76Å; M1060-F1069 HydrophobicContact CB-CD1 4.19Å; M1060-F1069 HydrophobicContact CB-CG 4.45Å; M1060-F1069 HydrophobicContact CE-CB 3.83Å; M1060-F1069 WeakPolarHBondContact CE-O 3.1Å; M1060-F1069 HydrophobicContact SD-CB 4.4Å; M1060-L1070 CarbonylContact C-O 3.54Å; M1060-L1070 VanDerWaalsContact C-O 3.31Å; M1060-L1070 WeakPolarHBondContact CA-O 3.48Å
1061	F	64.4	Low	65.7	Low	71 Å²	71	85.6 Å²	85.6	31%	0.311	42%	0.415	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.4	106	-178.5	-66.9	-89.4	0	0	0	108.5	L1070 P1073 L1076	F1061-L1070 PolarHBondContact N-O 3Å; F1061-L1070 WeakPolarHBondContact O-CB 3.39Å; F1061-L1070 PolarHBondContact O-N 3.45Å; F1061-P1073 HydrophobicContact CD1-CB 3.93Å; F1061-P1073 HydrophobicContact CD2-CB 4.39Å; F1061-P1073 HydrophobicContact CE1-CB 3.74Å; F1061-P1073 HydrophobicContact CE1-CG 4.34Å; F1061-P1073 HydrophobicContact CE2-CB 4.22Å; F1061-P1073 VanDerWaalsContact CE2-CD 3.5Å; F1061-P1073 HydrophobicContact CE2-CG 4.26Å; F1061-P1073 HydrophobicContact CG-CB 4.26Å; F1061-P1073 HydrophobicContact CZ-CB 3.89Å; F1061-P1073 HydrophobicContact CZ-CG 4.01Å; F1061-L1076 HydrophobicContact CB-CB 3.64Å; F1061-L1076 HydrophobicContact CB-CD2 3.7Å; F1061-L1076 HydrophobicContact CB-CG 4.17Å; F1061-L1076 HydrophobicContact CD1-CD2 4.5Å
1062	E	69	Low	65.3	Low	78 Å²	78	86.3 Å²	86.3	36%	0.364	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	144.7	-179.3	-166.3	177.9	159.2	0	0	110.8	M1060 H1067 F1069 L1076	M1060-E1062 PolarHBondContact O-N 3.04Å; M1060-E1062 VanDerWaalsContact O-N 3.1Å; E1062-H1067 IonicContact OE1-CE1 3.82Å; E1062-H1067 IonicContact OE1-CG 3.5Å; E1062-H1067 IonicContact OE1-ND1 2.72Å; E1062-H1067 PolarHBondContact OE1-ND1 3.23Å; E1062-F1069 HydrophobicContact CB-CD1 3.91Å; E1062-F1069 HydrophobicContact CB-CE1 3.76Å; E1062-F1069 HydrophobicContact CB-CZ 4.49Å; E1062-F1069 VanDerWaalsContact CD-CZ 3.47Å; E1062-F1069 HydrophobicContact CG-CD1 4.04Å; E1062-F1069 HydrophobicContact CG-CE1 3.66Å; E1062-F1069 HydrophobicContact CG-CE2 4.48Å; E1062-F1069 HydrophobicContact CG-CZ 3.9Å; E1062-F1069 WeakPolarHBondContact OE2-CE1 3.47Å; E1062-F1069 VanDerWaalsContact OE2-CZ 3.3Å; E1062-F1069 WeakPolarHBondContact OE2-CZ 3.41Å; E1062-L1076 VanDerWaalsContact O-CD1 3.28Å; E1062-L1076 WeakPolarHBondContact O-CD1 3.45Å; E1062-L1076 WeakPolarHBondContact O-CD2 3.42Å
1063	C	75.6	Confident	65.2	Low	0 Å²	0	86.8 Å²	86.8	0%	0	43%	0.426	C	S	.	.			trans	-91.3	109.3	174.7	-168.3	0	0	0	0	111.6	V1065 C1066 H1067 K1068 L1076 H1079 H1083	C1063-V1065 PolarHBondContact O-N 3.04Å; C1063-C1066 PolarHBondContact O-N 3.02Å; C1063-H1067 WeakPolarHBondContact O-CA 3.44Å; C1063-H1067 PolarHBondContact O-N 3.47Å; C1063-K1068 PolarHBondContact N-O 2.72Å; C1063-K1068 VanDerWaalsContact N-O 3.09Å; C1063-L1076 HydrophobicContact CB-CD1 3.8Å; C1063-H1079 VanDerWaalsContact SG-CD2 3.55Å; C1063-H1083 VanDerWaalsContact SG-CD2 3.6Å
1064	D	73.7	Confident	65.4	Low	116 Å²	116	88 Å²	88	62%	0.62	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-9.8	178.6	2.5	-41.7	0	0	0	114.8	K1080	D1064-K1080 VanDerWaalsContact OD1-CE 3.24Å; D1064-K1080 WeakPolarHBondContact OD1-CE 3.32Å; D1064-K1080 IonicContact OD1-NZ 3.15Å; D1064-K1080 PolarHBondContact OD1-NZ 3.24Å; D1064-K1080 WeakPolarHBondContact OD2-CE 3.43Å; D1064-K1080 IonicContact OD2-NZ 2.67Å; D1064-K1080 PolarHBondContact OD2-NZ 3.33Å
1065	V	71.9	Confident	65.8	Low	92 Å²	92	86.8 Å²	86.8	56%	0.558	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	-25.7	176.9	-172.1	0	0	0	0	113.2	C1063 H1083	C1063-V1065 PolarHBondContact O-N 3.04Å; V1065-H1083 HydrophobicContact CB-CB 4.34Å; V1065-H1083 HydrophobicContact CG1-CB 4.02Å; V1065-H1083 HydrophobicContact CG2-CB 4.33Å
1066	C	76.9	Confident	66.5	Low	42 Å²	42	84.7 Å²	84.7	28%	0.284	42%	0.415	S	S	.	.	T	Hydrogen-bonded Turn	trans	-151.8	18.5	-176.2	82.1	0	0	0	0	115.7	C1063 K1068 H1079 H1083	C1063-C1066 PolarHBondContact O-N 3.02Å; C1066-K1068 PolarHBondContact O-N 3.22Å; C1066-H1079 PolarHBondContact SG-NE2 3.1Å; C1066-H1083 VanDerWaalsContact SG-CE1 3.54Å; C1066-H1083 PolarHBondContact SG-NE2 2.79Å; C1066-H1083 VanDerWaalsContact SG-NE2 3.38Å
1067	H	67.7	Low	67.3	Low	121 Å²	121	86.3 Å²	86.3	56%	0.56	42%	0.424	S	S	*	.			trans	52.7	26.6	172.9	-55.7	-75.2	0	0	0	115.5	E1062 C1063 F1069	E1062-H1067 IonicContact OE1-CE1 3.82Å; E1062-H1067 IonicContact OE1-CG 3.5Å; E1062-H1067 IonicContact OE1-ND1 2.72Å; E1062-H1067 PolarHBondContact OE1-ND1 3.23Å; C1063-H1067 WeakPolarHBondContact O-CA 3.44Å; C1063-H1067 PolarHBondContact O-N 3.47Å; H1067-F1069 PolarHBondContact O-N 2.98Å
1068	K	65.4	Low	68.5	Low	124 Å²	124	85.5 Å²	85.5	54%	0.539	42%	0.417	S	S	.	.			trans	-82.6	116.5	175.2	-75.4	-175.7	-168.5	-61.6	0	110.6	C1063 C1066	C1063-K1068 PolarHBondContact N-O 2.72Å; C1063-K1068 VanDerWaalsContact N-O 3.09Å; C1066-K1068 PolarHBondContact O-N 3.22Å
1069	F	66.6	Low	70	Confident	114 Å²	114	84 Å²	84	50%	0.5	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	115.6	175.8	-66.7	-78.4	0	0	0	111.5	M1060 E1062 H1067	M1060-F1069 HydrophobicContact CB-CB 3.76Å; M1060-F1069 HydrophobicContact CB-CD1 4.19Å; M1060-F1069 HydrophobicContact CB-CG 4.45Å; M1060-F1069 HydrophobicContact CE-CB 3.83Å; M1060-F1069 WeakPolarHBondContact CE-O 3.1Å; M1060-F1069 HydrophobicContact SD-CB 4.4Å; E1062-F1069 HydrophobicContact CB-CD1 3.91Å; E1062-F1069 HydrophobicContact CB-CE1 3.76Å; E1062-F1069 HydrophobicContact CB-CZ 4.49Å; E1062-F1069 VanDerWaalsContact CD-CZ 3.47Å; E1062-F1069 HydrophobicContact CG-CD1 4.04Å; E1062-F1069 HydrophobicContact CG-CE1 3.66Å; E1062-F1069 HydrophobicContact CG-CE2 4.48Å; E1062-F1069 HydrophobicContact CG-CZ 3.9Å; E1062-F1069 WeakPolarHBondContact OE2-CE1 3.47Å; E1062-F1069 VanDerWaalsContact OE2-CZ 3.3Å; E1062-F1069 WeakPolarHBondContact OE2-CZ 3.41Å; H1067-F1069 PolarHBondContact O-N 2.98Å
1070	L	77.3	Confident	71.5	Confident	39 Å²	39	79.2 Å²	79.2	20%	0.204	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	145.7	-174.5	-69.3	159.5	0	0	0	111.7	M1060 F1061 T1072 Q1075 L1076 H1079	M1060-L1070 CarbonylContact C-O 3.54Å; M1060-L1070 VanDerWaalsContact C-O 3.31Å; M1060-L1070 WeakPolarHBondContact CA-O 3.48Å; F1061-L1070 PolarHBondContact N-O 3Å; F1061-L1070 WeakPolarHBondContact O-CB 3.39Å; F1061-L1070 PolarHBondContact O-N 3.45Å; L1070-T1072 PolarHBondContact O-N 3.37Å; L1070-Q1075 HydrophobicContact CB-CB 4.17Å; L1070-L1076 HydrophobicContact CD1-CB 4.48Å; L1070-L1076 HydrophobicContact CD1-CD1 4.17Å; L1070-H1079 HydrophobicContact CD1-CB 3.39Å; L1070-H1079 VanDerWaalsContact CD1-CD2 3.48Å; L1070-H1079 WeakPolarHBondContact CD1-CD2 3.41Å
1071	K	60.9	Low	72.5	Confident	165 Å²	165	80.2 Å²	80.2	72%	0.717	39%	0.391	S	S	*	.	S	Bend	trans	-80.9	-15.4	-161.4	-169	162.1	-178.2	169.7	0	114.7	Q1075	K1071-Q1075 VanDerWaalsContact N-OE1 3.15Å
1072	T	67.4	Low	72.9	Confident	46 Å²	46	81 Å²	81	28%	0.282	41%	0.405	S	S	.	.	S	Bend	trans	-142	156.9	-179.8	80.5	0	0	0	0	110	L1070 E1074 Q1075 L1076	L1070-T1072 PolarHBondContact O-N 3.37Å; T1072-E1074 VanDerWaalsContact C-N 3.28Å; T1072-E1074 WeakPolarHBondContact CB-OE2 3.43Å; T1072-E1074 PolarHBondContact O-N 3.45Å; T1072-E1074 PolarHBondContact OG1-OE2 2.93Å; T1072-Q1075 WeakPolarHBondContact O-CB 3.32Å; T1072-Q1075 PolarHBondContact O-N 3.45Å; T1072-Q1075 WeakPolarHBondContact OG1-CG 3.45Å; T1072-Q1075 PolarHBondContact OG1-N 2.86Å; T1072-L1076 PolarHBondContact O-N 2.82Å; T1072-L1076 VanDerWaalsContact O-N 3.13Å
1073	P	68.4	Low	73	Confident	46 Å²	46	80.8 Å²	80.8	30%	0.299	40%	0.403	S	S	.	.	H	α-helix	trans	-70.7	-25.7	-176.3	27.7	-31.1	0	0	0	112.3	F1061 L1076 L1077	F1061-P1073 HydrophobicContact CD1-CB 3.93Å; F1061-P1073 HydrophobicContact CD2-CB 4.39Å; F1061-P1073 HydrophobicContact CE1-CB 3.74Å; F1061-P1073 HydrophobicContact CE1-CG 4.34Å; F1061-P1073 HydrophobicContact CE2-CB 4.22Å; F1061-P1073 VanDerWaalsContact CE2-CD 3.5Å; F1061-P1073 HydrophobicContact CE2-CG 4.26Å; F1061-P1073 HydrophobicContact CG-CB 4.26Å; F1061-P1073 HydrophobicContact CZ-CB 3.89Å; F1061-P1073 HydrophobicContact CZ-CG 4.01Å; P1073-L1076 PolarHBondContact O-N 3Å; P1073-L1077 WeakPolarHBondContact O-CB 3.37Å; P1073-L1077 PolarHBondContact O-N 2.78Å
1074	E	75.6	Confident	72.2	Confident	122 Å²	122	85.7 Å²	85.7	57%	0.57	43%	0.433	S	S	*	.	H	α-helix	trans	-69.7	-39.6	174.6	-42	73.4	-157.4	0	0	110.2	T1072 L1076 L1077 E1078	T1072-E1074 VanDerWaalsContact C-N 3.28Å; T1072-E1074 WeakPolarHBondContact CB-OE2 3.43Å; T1072-E1074 PolarHBondContact O-N 3.45Å; T1072-E1074 PolarHBondContact OG1-OE2 2.93Å; E1074-L1076 VanDerWaalsContact C-N 3.31Å; E1074-L1076 PolarHBondContact O-N 2.97Å; E1074-L1077 PolarHBondContact O-N 3.05Å; E1074-E1078 WeakPolarHBondContact O-CB 2.98Å; E1074-E1078 PolarHBondContact O-N 2.63Å
1075	Q	73.2	Confident	70.8	Confident	69 Å²	69	85.3 Å²	85.3	32%	0.322	44%	0.435	S	S	.	.	H	α-helix	trans	-62.1	-39.7	172.2	-72.2	178.8	-13.4	0	0	111.6	L1070 K1071 T1072 H1079	L1070-Q1075 HydrophobicContact CB-CB 4.17Å; K1071-Q1075 VanDerWaalsContact N-OE1 3.15Å; T1072-Q1075 WeakPolarHBondContact O-CB 3.32Å; T1072-Q1075 PolarHBondContact O-N 3.45Å; T1072-Q1075 WeakPolarHBondContact OG1-CG 3.45Å; T1072-Q1075 PolarHBondContact OG1-N 2.86Å; Q1075-H1079 VanDerWaalsContact O-CB 3.23Å; Q1075-H1079 WeakPolarHBondContact O-CB 3.44Å; Q1075-H1079 PolarHBondContact O-N 3.09Å
1076	L	79.4	Confident	69.4	Low	20 Å²	20	86.2 Å²	86.2	11%	0.105	44%	0.443	C	S	.	.	H	α-helix	trans	-62.9	-43.9	172.1	176.8	62.8	0	0	0	111.6	F1061 E1062 C1063 L1070 T1072 P1073 E1074 H1079 K1080	F1061-L1076 HydrophobicContact CB-CB 3.64Å; F1061-L1076 HydrophobicContact CB-CD2 3.7Å; F1061-L1076 HydrophobicContact CB-CG 4.17Å; F1061-L1076 HydrophobicContact CD1-CD2 4.5Å; E1062-L1076 VanDerWaalsContact O-CD1 3.28Å; E1062-L1076 WeakPolarHBondContact O-CD1 3.45Å; E1062-L1076 WeakPolarHBondContact O-CD2 3.42Å; C1063-L1076 HydrophobicContact CB-CD1 3.8Å; L1070-L1076 HydrophobicContact CD1-CB 4.48Å; L1070-L1076 HydrophobicContact CD1-CD1 4.17Å; T1072-L1076 PolarHBondContact O-N 2.82Å; T1072-L1076 VanDerWaalsContact O-N 3.13Å; P1073-L1076 PolarHBondContact O-N 3Å; E1074-L1076 VanDerWaalsContact C-N 3.31Å; E1074-L1076 PolarHBondContact O-N 2.97Å; L1076-H1079 PolarHBondContact O-N 2.87Å; L1076-K1080 HydrophobicContact CD1-CD 4.36Å; L1076-K1080 HydrophobicContact CD1-CG 4.11Å; L1076-K1080 HydrophobicContact CG-CD 4.3Å; L1076-K1080 HydrophobicContact CG-CG 4.39Å; L1076-K1080 WeakPolarHBondContact O-CB 3.3Å; L1076-K1080 WeakPolarHBondContact O-CG 3.49Å; L1076-K1080 PolarHBondContact O-N 2.92Å
1077	L	77.9	Confident	67.9	Low	113 Å²	113	90.5 Å²	90.5	59%	0.592	47%	0.473	S	S	*	.	H	α-helix	trans	-68.3	-41.2	-177.4	-151	72.3	0	0	0	111.6	P1073 E1074 H1079 K1080 K1081	P1073-L1077 WeakPolarHBondContact O-CB 3.37Å; P1073-L1077 PolarHBondContact O-N 2.78Å; E1074-L1077 PolarHBondContact O-N 3.05Å; L1077-H1079 VanDerWaalsContact C-N 3.34Å; L1077-K1080 PolarHBondContact O-N 3.39Å; L1077-K1081 WeakPolarHBondContact O-CG 3.4Å; L1077-K1081 PolarHBondContact O-N 3.28Å
1078	E	77.1	Confident	66.4	Low	112 Å²	112	88.3 Å²	88.3	52%	0.523	48%	0.484	S	S	.	.	H	α-helix	trans	-59.8	-43.9	171.8	-151.5	71.1	-99.5	0	0	111.2	E1074 K1081 C1082	E1074-E1078 WeakPolarHBondContact O-CB 2.98Å; E1074-E1078 PolarHBondContact O-N 2.63Å; E1078-K1081 WeakPolarHBondContact O-CB 3.38Å; E1078-K1081 PolarHBondContact O-N 2.95Å; E1078-K1081 WeakPolarHBondContact OE1-CD 3.43Å; E1078-K1081 WeakPolarHBondContact OE1-CE 3.12Å; E1078-K1081 IonicContact OE1-NZ 3.93Å; E1078-K1081 PolarHBondContact OE1-NZ 3.44Å; E1078-K1081 IonicContact OE2-NZ 3.98Å; E1078-C1082 PolarHBondContact O-N 2.85Å
1079	H	79.6	Confident	65.3	Low	36 Å²	36	85.6 Å²	85.6	17%	0.167	49%	0.491	C	S	.	.	H	α-helix	trans	-70.5	-33.6	177.5	-177.9	53.9	0	0	0	113.2	C1063 C1066 L1070 Q1075 L1076 L1077 K1081 C1082 H1083	C1063-H1079 VanDerWaalsContact SG-CD2 3.55Å; C1066-H1079 PolarHBondContact SG-NE2 3.1Å; L1070-H1079 HydrophobicContact CD1-CB 3.39Å; L1070-H1079 VanDerWaalsContact CD1-CD2 3.48Å; L1070-H1079 WeakPolarHBondContact CD1-CD2 3.41Å; Q1075-H1079 VanDerWaalsContact O-CB 3.23Å; Q1075-H1079 WeakPolarHBondContact O-CB 3.44Å; Q1075-H1079 PolarHBondContact O-N 3.09Å; L1076-H1079 PolarHBondContact O-N 2.87Å; L1077-H1079 VanDerWaalsContact C-N 3.34Å; H1079-K1081 VanDerWaalsContact C-N 3.29Å; H1079-K1081 PolarHBondContact O-N 3.21Å; H1079-C1082 VanDerWaalsContact O-CB 3.25Å; H1079-C1082 WeakPolarHBondContact O-CB 3.43Å; H1079-C1082 PolarHBondContact O-N 3.16Å; H1079-C1082 VanDerWaalsContact O-N 3.1Å; H1079-H1083 AromaticContact CD2-NE2 3.86Å; H1079-H1083 AromaticContact CE1-NE2 3.4Å; H1079-H1083 PolarHBondContact CE1-NE2 3.07Å; H1079-H1083 AromaticContact NE2-NE2 3.15Å; H1079-H1083 PolarHBondContact NE2-NE2 3.49Å; H1079-H1083 VanDerWaalsContact NE2-NE2 3.15Å; H1079-H1083 PolarHBondContact O-CD2 3.31Å; H1079-H1083 VanDerWaalsContact O-CD2 3.27Å
1080	K	76.9	Confident	63.7	Low	53 Å²	53	88.8 Å²	88.8	23%	0.23	51%	0.512	C	S	.	.	H	α-helix	trans	-63	-35.4	170.5	-77.6	-172.8	-177.4	-173	0	111.3	D1064 L1076 L1077 C1082 H1083 T1084	D1064-K1080 VanDerWaalsContact OD1-CE 3.24Å; D1064-K1080 WeakPolarHBondContact OD1-CE 3.32Å; D1064-K1080 IonicContact OD1-NZ 3.15Å; D1064-K1080 PolarHBondContact OD1-NZ 3.24Å; D1064-K1080 WeakPolarHBondContact OD2-CE 3.43Å; D1064-K1080 IonicContact OD2-NZ 2.67Å; D1064-K1080 PolarHBondContact OD2-NZ 3.33Å; L1076-K1080 HydrophobicContact CD1-CD 4.36Å; L1076-K1080 HydrophobicContact CD1-CG 4.11Å; L1076-K1080 HydrophobicContact CG-CD 4.3Å; L1076-K1080 HydrophobicContact CG-CG 4.39Å; L1076-K1080 WeakPolarHBondContact O-CB 3.3Å; L1076-K1080 WeakPolarHBondContact O-CG 3.49Å; L1076-K1080 PolarHBondContact O-N 2.92Å; L1077-K1080 PolarHBondContact O-N 3.39Å; K1080-C1082 PolarHBondContact O-N 2.64Å; K1080-H1083 PolarHBondContact O-N 2.9Å; K1080-T1084 PolarHBondContact O-N 3.42Å
1081	K	78.4	Confident	61.6	Low	105 Å²	105	96.2 Å²	96.2	46%	0.457	54%	0.543	S	S	.	.	H	α-helix	trans	-60.1	-33.1	171.3	-62.7	174.1	-154.5	163.8	0	112.7	L1077 E1078 H1079 H1083 T1084 V1085	L1077-K1081 WeakPolarHBondContact O-CG 3.4Å; L1077-K1081 PolarHBondContact O-N 3.28Å; E1078-K1081 WeakPolarHBondContact O-CB 3.38Å; E1078-K1081 PolarHBondContact O-N 2.95Å; E1078-K1081 WeakPolarHBondContact OE1-CD 3.43Å; E1078-K1081 WeakPolarHBondContact OE1-CE 3.12Å; E1078-K1081 IonicContact OE1-NZ 3.93Å; E1078-K1081 PolarHBondContact OE1-NZ 3.44Å; E1078-K1081 IonicContact OE2-NZ 3.98Å; H1079-K1081 VanDerWaalsContact C-N 3.29Å; H1079-K1081 PolarHBondContact O-N 3.21Å; K1081-H1083 PolarHBondContact O-N 3.39Å; K1081-T1084 WeakPolarHBondContact CA-OG1 3.41Å; K1081-T1084 PolarHBondContact O-N 3.16Å; K1081-T1084 PolarHBondContact O-OG1 3.17Å; K1081-V1085 PolarHBondContact O-N 3.48Å
1082	C	71.3	Confident	60.6	Low	89 Å²	89	92.9 Å²	92.9	60%	0.601	55%	0.546	S	S	*	.	H	α-helix	trans	-61.8	-26.4	174.8	-55.2	0	0	0	0	112.9	E1078 H1079 K1080	E1078-C1082 PolarHBondContact O-N 2.85Å; H1079-C1082 VanDerWaalsContact O-CB 3.25Å; H1079-C1082 WeakPolarHBondContact O-CB 3.43Å; H1079-C1082 PolarHBondContact O-N 3.16Å; H1079-C1082 VanDerWaalsContact O-N 3.1Å; K1080-C1082 PolarHBondContact O-N 2.64Å
1083	H	71.9	Confident	58.9	Low	72 Å²	72	97 Å²	97	33%	0.333	57%	0.571	S	S	.	*	H	α-helix	trans	-88.3	-14.8	174.8	-61.4	-71.3	0	0	0	113.4	C1063 V1065 C1066 H1079 K1080 K1081	C1063-H1083 VanDerWaalsContact SG-CD2 3.6Å; V1065-H1083 HydrophobicContact CB-CB 4.34Å; V1065-H1083 HydrophobicContact CG1-CB 4.02Å; V1065-H1083 HydrophobicContact CG2-CB 4.33Å; C1066-H1083 VanDerWaalsContact SG-CE1 3.54Å; C1066-H1083 PolarHBondContact SG-NE2 2.79Å; C1066-H1083 VanDerWaalsContact SG-NE2 3.38Å; H1079-H1083 AromaticContact CD2-NE2 3.86Å; H1079-H1083 AromaticContact CE1-NE2 3.4Å; H1079-H1083 PolarHBondContact CE1-NE2 3.07Å; H1079-H1083 AromaticContact NE2-NE2 3.15Å; H1079-H1083 PolarHBondContact NE2-NE2 3.49Å; H1079-H1083 VanDerWaalsContact NE2-NE2 3.15Å; H1079-H1083 PolarHBondContact O-CD2 3.31Å; H1079-H1083 VanDerWaalsContact O-CD2 3.27Å; K1080-H1083 PolarHBondContact O-N 2.9Å; K1081-H1083 PolarHBondContact O-N 3.39Å
1084	T	59	Low	57.5	Low	104 Å²	104	103 Å²	103	64%	0.638	60%	0.6	S	S	*	*	S	Bend	trans	-103.8	15.2	-179.5	67.9	0	0	0	0	113.9	K1080 K1081 P1086	K1080-T1084 PolarHBondContact O-N 3.42Å; K1081-T1084 WeakPolarHBondContact CA-OG1 3.41Å; K1081-T1084 PolarHBondContact O-N 3.16Å; K1081-T1084 PolarHBondContact O-OG1 3.17Å; T1084-P1086 WeakPolarHBondContact O-CD 2.94Å
1085	V	44.1	Very low	55.6	Low	107 Å²	107	100.4 Å²	100.4	65%	0.648	61%	0.607	S	S	*	*	S	Bend	trans	-81.7	116	165.7	-178.3	0	0	0	0	107.6	K1081 S1087	K1081-V1085 PolarHBondContact O-N 3.48Å; V1085-S1087 PolarHBondContact O-N 3.2Å
1086	P	42.8	Very low	53.5	Low	111 Å²	111	105.8 Å²	105.8	72%	0.721	63%	0.632	S	S	*	*			trans	-63.1	139.5	174.4	-18.6	32.2	0	0	0	109.9	T1084 G1088	T1084-P1086 WeakPolarHBondContact O-CD 2.94Å; P1086-G1088 PolarHBondContact O-N 3.3Å
1087	S	45.2	Very low	51.1	Low	132 Å²	132	120.1 Å²	120.1	92%	0.923	69%	0.685	S	S	*	*			trans	-71.7	56.5	175.2	-61.1	0	0	0	0	112.5	V1085 G1089	V1085-S1087 PolarHBondContact O-N 3.2Å; S1087-G1089 PolarHBondContact O-N 3.14Å
1088	G	36.8	Very low	49.8	Very low	76 Å²	76	120.5 Å²	120.5	78%	0.784	69%	0.69	S	S	*	*			trans	-79.4	48.6	-177	0	0	0	0	0	114.1	P1086	P1086-G1088 PolarHBondContact O-N 3.3Å
1089	G	41.8	Very low	48.3	Very low	67 Å²	67	120.9 Å²	120.9	69%	0.691	70%	0.698	S	S	*	*			trans	71.7	90.2	163.1	0	0	0	0	0	117.4	S1087	S1087-G1089 PolarHBondContact O-N 3.14Å
1090	L	33.3	Very low	46.6	Very low	180 Å²	180	125.7 Å²	125.7	94%	0.942	73%	0.728	S	S	*	*			trans	-125.8	144.3	137.9	-99.1	172.1	0	0	0	109.2
1091	K	33	Very low	44.8	Very low	196 Å²	196	129.9 Å²	129.9	85%	0.852	76%	0.757	S	S	*	*			trans	-76.9	149.4	-167	-66.2	176.6	-179.7	176.1	0	111.5	T1093	K1091-T1093 PolarHBondContact O-N 2.83Å
1092	A	40.4	Very low	42.7	Very low	95 Å²	95	131.5 Å²	131.5	79%	0.785	78%	0.776	S	S	*	*			trans	-61.3	129.3	172.3	0	0	0	0	0	111.3
1093	T	31.9	Very low	40.8	Very low	133 Å²	133	134.3 Å²	134.3	82%	0.816	79%	0.787	S	S	*	*			trans	-125.5	100.3	161.2	52.3	0	0	0	0	107.7	K1091 G1095	K1091-T1093 PolarHBondContact O-N 2.83Å; T1093-G1095 PolarHBondContact O-N 3.4Å
1094	N	37.4	Very low	38.6	Very low	170 Å²	170	138.8 Å²	138.8	91%	0.909	82%	0.82	S	S	*	*			trans	-62.9	126.3	168.7	-72	-10	0	0	0	108.5
1095	G	35.9	Very low	37	Very low	69 Å²	69	141.5 Å²	141.5	71%	0.711	83%	0.834	S	S	*	*			trans	-170.2	137.5	177.8	0	0	0	0	0	109.2	T1093	T1093-G1095 PolarHBondContact O-N 3.4Å
1096	H	28.6	Very low	36.4	Very low	181 Å²	181	144.3 Å²	144.3	84%	0.838	85%	0.849	S	S	*	*			trans	-53.3	140.3	-172.6	-48.9	140.5	0	0	0	113.1
1097	W	29.7	Very low	35.8	Very low	322 Å²	322	147.4 Å²	147.4	100%	1.22	86%	0.861	S	S	*	*				-164.2	0	99.2	-93.8	101.9	0	0	0	110.6

Retrieved 1,097 of 1,097 residues in 307.6 ms (Link to these results)

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