A0A077YXW4_TRITR Loading...

Solute carrier family 12

AlphaFold DB , UniProt , Accession A0A077YXW4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,105 aa.

						>A0A077YXW4_TRITR|A0A077YXW4
MQDGDNESLSVGGLPRNQSRFKVNKVEGEEENGAILVSQNETPRPRQVQFVVDMDEDDARAADTAQHPTVTYKTSNFKSFRNVETVERVPIVDYYRDVMSIEGAIATRPSLAELHEEHYANDAKNFETFKLLDTPSPSLKPDKAGSGRLRLGWIQGVLVRVVLSILGTILFLRVSWMTAHAGIGCSILIVLCSSAVSVITCLSMCAICTNGEIKGGGAYFMISRSLGPEFGGSIGLAFAFANVVAAAFCSVGFAETLRDLLKEHGLIFIDGELNDIRVIGILTMVLILAIAVVGVSFESKAQWVMLVVLTVSLVDFLVGTLLPPDEVQQSRGVTGYSTETFLTNFWPDWYGETFFSVFSVFYPATTGIMAGANISGDLDNPATAIPKGTLLGIAVTSLIYAGTVIVTGATVIRQASGEISDAVNGSISACAQNGTCSFGIMNYYQTLELLGAWGPLVTAGIFAATLSSALAGFVSGPKLLQALGKDKLFPFVAWFSFPYGRNREPRRAYVLAFFLGLAIVSIGEINLIAPIIANIFLVCYALINYAVFDASFAGSPGFRPSFRYYNQWVALIGALLCVAIMFVLSWWKALLTFLLTGALYVYIHHRNPDVNWGSSGQAHSYKSALHSTLKLASTEEHVKNYRPQLLLLTGNPVSRPSLVDFGASITKDVCLLVCGHVLLSSLPFKRQQMQKLIEEIYQWFTKRKVKSFYTFVVSDSLHTGVRSLLQSVGVGKLRPNVVLMGFKNDWKESTPEQVEDYFKVIHTVFDNYCGLAILRLQNGLDFSDRIAKCDLMGSDASKSASNVAELSPPAAPTAIDHPVAAGNFISPEESQTVLREDSYMTYGSKESSELPKTEAEETEEILEYLSEEPPAPSGTEPQDSFIPSVFKDVKTRHLSSDQRQLMYDINRFQTRLKHAVIDVYWLFDDGGLGLLIPHLLTLPQSFLRNAKLRVFTVATSRSQLEREQRSMAALLSRFRLDYSDVIVIPDLTKRPSNSLIEEFQEFIFSRRAETSAEETGDRSISSDVFITATEYDTLKPKTYRQLRIKELLHEHSFGAQLIVLTLPIPRKSVISASLYLSWLDFVSKDMPCPVLYLRGNQESVLTFYS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.9	Very low	29.4	Very low	246 Å²	246	156.5 Å²	156.5	100%	1.212	88%	0.876	S	S	*	*				0	129.5	0	-76.3	172.7	-179.5	0	0	106.6
2	Q	29.7	Very low	29	Very low	187 Å²	187	149.4 Å²	149.4	87%	0.874	87%	0.865	S	S	*	*			trans	-64.6	134.4	174.5	-73.5	162.4	-46.6	0	0	109.2
3	D	36.1	Very low	28.8	Very low	170 Å²	170	143.2 Å²	143.2	91%	0.909	85%	0.853	S	S	*	*			trans	-156.5	124.9	137.6	-88.4	-33.6	0	0	0	106.2
4	G	27.3	Very low	28.4	Very low	68 Å²	68	145.5 Å²	145.5	70%	0.701	86%	0.857	S	S	*	*			trans	-97.4	138.6	177	0	0	0	0	0	109.5
5	D	30.7	Very low	28.3	Very low	160 Å²	160	143.7 Å²	143.7	86%	0.856	85%	0.852	S	S	*	*			trans	-137.3	99.1	152.6	-85.9	-38.2	0	0	0	107.5	E7	D5-E7 PolarHBondContact O-N 3.05Å
6	N	27.2	Very low	28.2	Very low	175 Å²	175	149.6 Å²	149.6	94%	0.936	86%	0.855	S	S	*	*			trans	-79.7	84.2	167.2	-102.2	-14.9	0	0	0	107.3	S8	N6-S8 PolarHBondContact O-N 3.05Å
7	E	29.6	Very low	28	Very low	176 Å²	176	150.9 Å²	150.9	82%	0.822	86%	0.858	S	S	*	*			trans	-82.4	102.2	164.9	-77.4	-167	158.3	0	0	109.4	D5 L9	D5-E7 PolarHBondContact O-N 3.05Å; E7-L9 PolarHBondContact O-N 3.49Å
8	S	29.4	Very low	28	Very low	108 Å²	108	152.6 Å²	152.6	76%	0.755	86%	0.858	S	S	*	*			trans	-56.1	113	167.3	51.3	0	0	0	0	110.3	N6 S10	N6-S8 PolarHBondContact O-N 3.05Å; S8-S10 PolarHBondContact O-N 3.14Å
9	L	26.3	Very low	27.8	Very low	174 Å²	174	150.2 Å²	150.2	91%	0.911	85%	0.852	S	S	*	*			trans	-62.4	97.2	168	-108.2	96.4	0	0	0	109.3	E7 V11	E7-L9 PolarHBondContact O-N 3.49Å; L9-V11 PolarHBondContact O-N 2.93Å
10	S	26.1	Very low	27.6	Very low	108 Å²	108	154.9 Å²	154.9	76%	0.755	86%	0.855	S	S	*	*			trans	-70.7	123.1	167.7	58.1	0	0	0	0	109.4	S8 G12	S8-S10 PolarHBondContact O-N 3.14Å; S10-G12 PolarHBondContact O-N 3.47Å
11	V	26.8	Very low	27.5	Very low	149 Å²	149	156.5 Å²	156.5	90%	0.903	85%	0.854	S	S	*	*			trans	-57.2	95.7	174.4	179.6	0	0	0	0	109.5	L9 G13	L9-V11 PolarHBondContact O-N 2.93Å; V11-G13 PolarHBondContact O-N 3.25Å
12	G	25.7	Very low	27	Very low	72 Å²	72	154.2 Å²	154.2	74%	0.742	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-68.8	121.3	174.3	0	0	0	0	0	110.5	S10	S10-G12 PolarHBondContact O-N 3.47Å
13	G	26.1	Very low	26.9	Very low	69 Å²	69	151.5 Å²	151.5	71%	0.711	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-57.3	148	-177.9	0	0	0	0	0	114	V11	V11-G13 PolarHBondContact O-N 3.25Å
14	L	23.2	Very low	26.4	Very low	175 Å²	175	150.1 Å²	150.1	92%	0.916	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-49.9	123.1	176.1	-85.3	102.6	0	0	0	111.6	R16	L14-R16 PolarHBondContact O-N 3.28Å
15	P	27.2	Very low	26.3	Very low	119 Å²	119	156.4 Å²	156.4	77%	0.773	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-73	128.9	172.6	27.4	-29.6	0	0	0	110.2	N17	P15-N17 PolarHBondContact O-N 2.86Å
16	R	26.1	Very low	26.2	Very low	238 Å²	238	155.3 Å²	155.3	90%	0.898	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-52.6	131.8	170.1	-81.5	176.6	167.1	173.6	-4.4	110.6	L14 Q18	L14-R16 PolarHBondContact O-N 3.28Å; R16-Q18 PolarHBondContact O-N 2.95Å
17	N	25.4	Very low	26.2	Very low	171 Å²	171	156.2 Å²	156.2	91%	0.914	83%	0.831	S	S	*	*			trans	-42.4	99.9	169.3	-74.8	-24.8	0	0	0	112.2	P15	P15-N17 PolarHBondContact O-N 2.86Å
18	Q	26.7	Very low	26.2	Very low	181 Å²	181	151.1 Å²	151.1	85%	0.846	83%	0.826	S	S	*	*			trans	-104.1	114.3	158.4	-80.7	-172.7	-9	0	0	107.6	R16 R20	R16-Q18 PolarHBondContact O-N 2.95Å; Q18-R20 PolarHBondContact O-N 3.1Å; Q18-R20 VanDerWaalsContact O-N 3.11Å
19	S	25.7	Very low	26.1	Very low	107 Å²	107	155.4 Å²	155.4	75%	0.748	83%	0.834	S	S	*	*			trans	-60.8	110.4	176.5	54	0	0	0	0	109.8	F21	S19-F21 VanDerWaalsContact C-N 3.25Å; S19-F21 PolarHBondContact O-N 3.37Å
20	R	23	Very low	26	Very low	245 Å²	245	156 Å²	156	93%	0.925	83%	0.833	S	S	*	*			trans	-76.2	77.4	169.9	-84.6	-177	169.6	-176.3	-1.8	109.4	Q18	Q18-R20 PolarHBondContact O-N 3.1Å; Q18-R20 VanDerWaalsContact O-N 3.11Å
21	F	25.3	Very low	26.1	Very low	189 Å²	189	160.2 Å²	160.2	83%	0.829	84%	0.84	S	S	*	*			trans	-114.1	90.6	160.3	-77.7	-81	0	0	0	108.3	S19	S19-F21 VanDerWaalsContact C-N 3.25Å; S19-F21 PolarHBondContact O-N 3.37Å
22	K	24.6	Very low	26.1	Very low	197 Å²	197	161.2 Å²	161.2	86%	0.857	84%	0.84	S	S	*	*			trans	-89.1	104.8	162.8	-97.9	-173.2	173.6	-175.8	0	107.3	N24	K22-N24 PolarHBondContact O-N 3.41Å
23	V	26.5	Very low	26.3	Very low	130 Å²	130	161 Å²	161	79%	0.788	84%	0.838	S	S	*	*			trans	-76.3	109.4	168.9	179.7	0	0	0	0	107.1	K25	V23-K25 PolarHBondContact O-N 2.99Å
24	N	26	Very low	26.3	Very low	141 Å²	141	162.8 Å²	162.8	75%	0.754	85%	0.847	S	S	*	*			trans	-74.2	110.1	169.1	-80.7	-11.3	0	0	0	108	K22 V26	K22-N24 PolarHBondContact O-N 3.41Å; N24-V26 PolarHBondContact O-N 3.35Å
25	K	26	Very low	26.5	Very low	200 Å²	200	162.1 Å²	162.1	87%	0.87	84%	0.842	S	S	*	*			trans	-64.1	116.8	168.1	-117.2	179.2	175.5	-176.6	0	107.8	V23	V23-K25 PolarHBondContact O-N 2.99Å
26	V	27.3	Very low	26.6	Very low	138 Å²	138	164.8 Å²	164.8	84%	0.836	85%	0.849	S	S	*	*			trans	-80	118.4	167.4	178.1	0	0	0	0	106.6	N24 G28	N24-V26 PolarHBondContact O-N 3.35Å; V26-G28 PolarHBondContact O-N 3.39Å
27	E	27.5	Very low	26.5	Very low	193 Å²	193	159.7 Å²	159.7	90%	0.902	84%	0.844	S	S	*	*			trans	-68.7	104.8	174.5	-69.7	172.5	164	0	0	108.3
28	G	28.6	Very low	26.5	Very low	70 Å²	70	157.2 Å²	157.2	72%	0.722	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-95.4	127.6	169.1	0	0	0	0	0	109.2	V26	V26-G28 PolarHBondContact O-N 3.39Å
29	E	27.6	Very low	26.6	Very low	197 Å²	197	156.6 Å²	156.6	92%	0.921	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-57.5	145.1	-177.9	-70.4	174.9	147	0	0	113.1	E31	E29-E31 PolarHBondContact O-N 3.25Å
30	E	25	Very low	26.6	Very low	188 Å²	188	158.7 Å²	158.7	88%	0.879	84%	0.84	S	S	*	*	P	Polyproline II helix	trans	-67	118.2	-172.9	-63.5	172.6	143.5	0	0	112.7
31	E	28.9	Very low	26.9	Very low	196 Å²	196	156.2 Å²	156.2	92%	0.916	84%	0.839	S	S	*	*			trans	-110.1	117.6	154	-86	-168.1	160.7	0	0	110.2	E29 G33	E29-E31 PolarHBondContact O-N 3.25Å; E31-G33 PolarHBondContact O-N 2.93Å
32	N	26.6	Very low	27	Very low	169 Å²	169	153.8 Å²	153.8	90%	0.904	84%	0.84	S	S	*	*			trans	-59.3	109.4	-179.1	-74.1	-51.8	0	0	0	112.4
33	G	29.2	Very low	27.1	Very low	67 Å²	67	150.3 Å²	150.3	69%	0.691	84%	0.838	S	S	*	*			trans	-144.8	82.2	170.4	0	0	0	0	0	110.9	E31 I35	E31-G33 PolarHBondContact O-N 2.93Å; G33-I35 PolarHBondContact O-N 3.11Å
34	A	25.5	Very low	27	Very low	108 Å²	108	155.3 Å²	155.3	89%	0.893	84%	0.842	S	S	*	*			trans	-64.6	110.8	177.6	0	0	0	0	0	111.2
35	I	28.5	Very low	26.9	Very low	161 Å²	161	154.5 Å²	154.5	83%	0.826	84%	0.844	S	S	*	*			trans	-125.4	117.3	160.2	-59.4	-179.2	0	0	0	107.7	G33 V37	G33-I35 PolarHBondContact O-N 3.11Å; I35-V37 PolarHBondContact O-N 2.68Å
36	L	28.1	Very low	26.8	Very low	174 Å²	174	156.2 Å²	156.2	91%	0.911	85%	0.845	S	S	*	*			trans	-58.7	126.8	-174.8	-74.9	150.9	0	0	0	111.9	S38	L36-S38 PolarHBondContact O-N 3.06Å
37	V	23.9	Very low	26.5	Very low	132 Å²	132	159 Å²	159	80%	0.8	85%	0.849	S	S	*	*			trans	-75.8	113.2	168.8	175.5	0	0	0	0	108.6	I35	I35-V37 PolarHBondContact O-N 2.68Å
38	S	27.3	Very low	26.3	Very low	118 Å²	118	154.9 Å²	154.9	83%	0.825	84%	0.837	S	S	*	*			trans	-91.1	133.1	157.4	60.7	0	0	0	0	109.6	L36	L36-S38 PolarHBondContact O-N 3.06Å
39	Q	27	Very low	25.9	Very low	169 Å²	169	160.2 Å²	160.2	79%	0.79	84%	0.843	S	S	*	*			trans	-78.7	153.3	-175.9	-66.4	176.2	-15.7	0	0	112.4
40	N	27.4	Very low	25.7	Very low	151 Å²	151	159.1 Å²	159.1	81%	0.807	84%	0.836	S	S	*	*			trans	60.2	99.7	152.8	-75	-10.2	0	0	0	119
41	E	29.1	Very low	25.6	Very low	192 Å²	192	156.1 Å²	156.1	90%	0.897	83%	0.83	S	S	*	*			trans	-166.5	110.5	130.2	-109.8	172.3	-171.3	0	0	109.7	P43	E41-P43 WeakPolarHBondContact O-CD 3.36Å
42	T	26.5	Very low	25.5	Very low	138 Å²	138	152.2 Å²	152.2	85%	0.847	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-69.6	119.4	168.5	41.4	0	0	0	0	109.1	R44	T42-R44 PolarHBondContact O-N 3.05Å
43	P	26.5	Very low	25.5	Very low	125 Å²	125	151.3 Å²	151.3	81%	0.812	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-73	123.9	-175.3	26.9	-31.2	0	0	0	110.8	E41	E41-P43 WeakPolarHBondContact O-CD 3.36Å
44	R	23.6	Very low	25.3	Very low	234 Å²	234	156.1 Å²	156.1	88%	0.883	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-71.2	139.6	167.8	-68.5	-178.4	-159.6	177.2	6.4	109.6	T42 R46	T42-R44 PolarHBondContact O-N 3.05Å; R44-R46 PolarHBondContact O-N 3.36Å
45	P	25.9	Very low	25.5	Very low	124 Å²	124	158.9 Å²	158.9	81%	0.805	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-67.5	123.3	-178.6	26.2	-32.2	0	0	0	110.8	Q47	P45-Q47 PolarHBondContact O-N 3.38Å
46	R	22.6	Very low	25.5	Very low	236 Å²	236	160 Å²	160	89%	0.891	82%	0.823	S	S	*	*			trans	-64	112.8	172	-104.7	176.9	171	162.8	-2.7	109.3	R44 V48	R44-R46 PolarHBondContact O-N 3.36Å; R46-V48 PolarHBondContact O-N 2.97Å
47	Q	21.8	Very low	25.6	Very low	196 Å²	196	159.5 Å²	159.5	92%	0.916	82%	0.821	S	S	*	*			trans	-70.5	118.2	162.8	-84	178	-28.1	0	0	108.7	P45	P45-Q47 PolarHBondContact O-N 3.38Å
48	V	22.9	Very low	25.8	Very low	108 Å²	108	161.2 Å²	161.2	66%	0.655	83%	0.825	S	S	*	*			trans	-92.8	111.9	172.5	-176.5	0	0	0	0	107.3	R46 F50	R46-V48 PolarHBondContact O-N 2.97Å; V48-F50 HydrophobicContact CB-CE2 4.47Å; V48-F50 HydrophobicContact CG1-CE2 4.12Å; V48-F50 HydrophobicContact CG1-CZ 4.2Å
49	Q	20.5	Very low	25.8	Very low	181 Å²	181	160.2 Å²	160.2	85%	0.846	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-90.7	116.4	-179.7	-169.3	163.1	-14	0	0	108.9
50	F	22.6	Very low	25.8	Very low	175 Å²	175	164 Å²	164	77%	0.768	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-87.4	117.1	176.1	-69.1	-89.3	0	0	0	109.1	V48	V48-F50 HydrophobicContact CB-CE2 4.47Å; V48-F50 HydrophobicContact CG1-CE2 4.12Å; V48-F50 HydrophobicContact CG1-CZ 4.2Å
51	V	22.7	Very low	25.9	Very low	124 Å²	124	162 Å²	162	75%	0.752	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-88.9	120.7	168.7	-179.7	0	0	0	0	106.6
52	V	27.4	Very low	25.7	Very low	114 Å²	114	157.2 Å²	157.2	69%	0.691	83%	0.829	S	S	*	*			trans	-111.2	109.6	176.4	179.4	0	0	0	0	106.5	M54	V52-M54 PolarHBondContact O-N 3.34Å
53	D	26.4	Very low	25.8	Very low	150 Å²	150	158.1 Å²	158.1	80%	0.802	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-65.8	122.7	169.2	-79.3	-35.3	0	0	0	108.4
54	M	26.2	Very low	26	Very low	169 Å²	169	158.7 Å²	158.7	83%	0.833	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-99	118.2	177.3	-70.7	-178	57.5	0	0	108.4	V52	V52-M54 PolarHBondContact O-N 3.34Å
55	D	28.6	Very low	26.1	Very low	166 Å²	166	151.9 Å²	151.9	89%	0.888	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-69.6	131.5	171	-73.2	-43.1	0	0	0	110.5	D57	D55-D57 PolarHBondContact O-N 2.88Å
56	E	28	Very low	26.2	Very low	184 Å²	184	154.6 Å²	154.6	86%	0.86	83%	0.825	S	S	*	*	S	Bend	trans	-73.2	102.7	178.8	-67.6	-179.2	146.2	0	0	110.4
57	D	30.9	Very low	26.2	Very low	163 Å²	163	152.9 Å²	152.9	87%	0.872	83%	0.827	S	S	*	*			trans	-158.9	-7	156.6	-99.1	-29.1	0	0	0	116.9	D55 A59	D55-D57 PolarHBondContact O-N 2.88Å; D57-A59 PolarHBondContact O-N 3.26Å
58	D	29.1	Very low	26.5	Very low	168 Å²	168	148.8 Å²	148.8	90%	0.898	82%	0.818	S	S	*	*			trans	-97.7	19.5	-176.3	-78.5	-27.1	0	0	0	115.4	R60	D58-R60 PolarHBondContact O-N 3.45Å; D58-R60 VanDerWaalsContact O-N 3.13Å
59	A	25.8	Very low	26.6	Very low	97 Å²	97	149.9 Å²	149.9	80%	0.802	83%	0.825	S	S	*	*			trans	-87.8	60.2	-178.1	0	0	0	0	0	113.2	D57	D57-A59 PolarHBondContact O-N 3.26Å
60	R	27.9	Very low	26.8	Very low	250 Å²	250	147.1 Å²	147.1	94%	0.943	82%	0.82	S	S	*	*			trans	-160.2	58.6	170.2	-115.3	170.3	-165.1	-176.2	5.7	115.6	D58	D58-R60 PolarHBondContact O-N 3.45Å; D58-R60 VanDerWaalsContact O-N 3.13Å
61	A	29.7	Very low	26.8	Very low	107 Å²	107	144.6 Å²	144.6	88%	0.884	82%	0.819	S	S	*	*			trans	-160.1	70.3	157.5	0	0	0	0	0	110.8
62	A	25	Very low	26.8	Very low	92 Å²	92	148.7 Å²	148.7	76%	0.76	82%	0.822	S	S	*	*			trans	-123.8	101.7	171.2	0	0	0	0	0	108.5
63	D	27.3	Very low	26.5	Very low	157 Å²	157	152.6 Å²	152.6	84%	0.84	83%	0.83	S	S	*	*			trans	-179.1	99	148.8	-105	-17.5	0	0	0	109.9
64	T	30.5	Very low	26.4	Very low	138 Å²	138	151.9 Å²	151.9	85%	0.847	83%	0.832	S	S	*	*				169.2	113.7	126.8	25.8	0	0	0	0	111.5
65	A	26.1	Very low	26.3	Very low	90 Å²	90	148.5 Å²	148.5	74%	0.744	82%	0.824	S	S	*	*			trans	52	132.7	133.8	0	0	0	0	0	122.4
66	Q	27.9	Very low	26.1	Very low	181 Å²	181	146.6 Å²	146.6	85%	0.846	81%	0.814	S	S	*	*			trans	95.1	115.7	154.3	-59.2	-179.8	0.4	0	0	117.9	P68	Q66-P68 WeakPolarHBondContact O-CD 3.5Å
67	H	24.2	Very low	26	Very low	200 Å²	200	147.9 Å²	147.9	93%	0.926	82%	0.817	S	S	*	*			trans	-64.2	129.6	172.8	-71.1	-90.7	0	0	0	111.8
68	P	27.7	Very low	25.8	Very low	111 Å²	111	148.6 Å²	148.6	72%	0.721	81%	0.813	S	S	*	*			trans	-135.1	137.8	133.4	31.8	-16.6	0	0	0	112.9	Q66	Q66-P68 WeakPolarHBondContact O-CD 3.5Å
69	T	23.8	Very low	25.6	Very low	131 Å²	131	145.5 Å²	145.5	80%	0.804	80%	0.804	S	S	*	*			trans	37.7	118.3	144.8	-24.6	0	0	0	0	119.2	T71	T69-T71 PolarHBondContact O-N 2.86Å
70	V	24.8	Very low	25.9	Very low	123 Å²	123	149.3 Å²	149.3	75%	0.745	80%	0.803	S	S	*	*			trans	-54.2	98.4	179.1	-178.2	0	0	0	0	112.3
71	T	22.5	Very low	25.9	Very low	121 Å²	121	148.9 Å²	148.9	74%	0.742	80%	0.801	S	S	*	*			trans	-88.8	119.2	163.4	-37.8	0	0	0	0	108.6	T69 K73	T69-T71 PolarHBondContact O-N 2.86Å; T71-K73 PolarHBondContact O-N 2.91Å
72	Y	24	Very low	25.9	Very low	210 Å²	210	150.1 Å²	150.1	82%	0.824	79%	0.793	S	S	*	*			trans	-59.2	98.3	172.6	-68.7	-90.7	0	0	0	110.1	T74	Y72-T74 PolarHBondContact O-N 3.12Å
73	K	20.1	Very low	26.6	Very low	197 Å²	197	149.7 Å²	149.7	86%	0.857	78%	0.78	S	S	*	*			trans	-82.5	88	170.5	-78.1	-176.6	177	177.5	0	109.1	T71 S75	T71-K73 PolarHBondContact O-N 2.91Å; K73-S75 PolarHBondContact O-N 2.85Å
74	T	25.3	Very low	27.4	Very low	135 Å²	135	149.4 Å²	149.4	83%	0.828	77%	0.774	S	S	*	*			trans	-73.6	106.3	156.7	51.8	0	0	0	0	107.7	Y72 N76	Y72-T74 PolarHBondContact O-N 3.12Å; T74-N76 PolarHBondContact O-N 2.96Å
75	S	23.8	Very low	28.6	Very low	97 Å²	97	144.5 Å²	144.5	68%	0.678	74%	0.744	S	S	*	*			trans	-56.1	115.5	179.7	47.6	0	0	0	0	112.8	K73 F77	K73-S75 PolarHBondContact O-N 2.85Å; S75-F77 PolarHBondContact O-N 3.34Å
76	N	23.8	Very low	30.2	Very low	126 Å²	126	143.4 Å²	143.4	67%	0.674	73%	0.728	S	S	*	*			trans	43.4	48.1	135.5	-69.5	-22.7	0	0	0	119.8	T74 K78	T74-N76 PolarHBondContact O-N 2.96Å; N76-K78 PolarHBondContact O-N 3.26Å
77	F	26.5	Very low	32.2	Very low	211 Å²	211	136.2 Å²	136.2	93%	0.925	70%	0.695	S	S	*	*			trans	-77.3	64.3	146.5	-83.8	-84	0	0	0	109.6	S75 S79	S75-F77 PolarHBondContact O-N 3.34Å; F77-S79 VanDerWaalsContact C-N 3.27Å; F77-S79 PolarHBondContact O-N 3.47Å; F77-S79 VanDerWaalsContact O-N 3.11Å
78	K	25	Very low	34.5	Very low	179 Å²	179	131.7 Å²	131.7	78%	0.778	67%	0.669	S	S	*	*			trans	-79.5	76.3	169.5	-78.5	-178.6	176.4	178.3	0	108.7	N76	N76-K78 PolarHBondContact O-N 3.26Å
79	S	26.7	Very low	36.8	Very low	102 Å²	102	128.4 Å²	128.4	71%	0.713	65%	0.647	S	S	*	*	S	Bend	trans	-136	91.7	159.6	-167.4	0	0	0	0	108.9	F77 R81	F77-S79 VanDerWaalsContact C-N 3.27Å; F77-S79 PolarHBondContact O-N 3.47Å; F77-S79 VanDerWaalsContact O-N 3.11Å; S79-R81 PolarHBondContact O-N 3.42Å
80	F	30.6	Very low	39.3	Very low	178 Å²	178	122.4 Å²	122.4	78%	0.781	61%	0.61	S	S	*	*			trans	39.7	75.2	155.8	-78.3	-96.3	0	0	0	118.6	N82	F80-N82 HydrophobicContact CD1-CB 3.89Å; F80-N82 HydrophobicContact CE1-CB 4.24Å
81	R	27.8	Very low	41.8	Very low	241 Å²	241	118.7 Å²	118.7	91%	0.909	59%	0.586	S	S	*	*			trans	-76	15.3	142.8	-94.9	-177	171	-175.5	-2.9	113.3	S79 V83	S79-R81 PolarHBondContact O-N 3.42Å; R81-V83 PolarHBondContact O-N 3.02Å
82	N	31.5	Very low	44.1	Very low	132 Å²	132	114 Å²	114	71%	0.706	56%	0.557	S	S	*	*			trans	-100.2	48.3	-173.4	-76.7	8.9	0	0	0	114.5	F80	F80-N82 HydrophobicContact CD1-CB 3.89Å; F80-N82 HydrophobicContact CE1-CB 4.24Å
83	V	39	Very low	46.2	Very low	83 Å²	83	106.8 Å²	106.8	50%	0.503	53%	0.533	S	S	.	.	S	Bend	trans	-135.5	117.4	154.8	-176.1	0	0	0	0	108.2	R81 T85 T988	R81-V83 PolarHBondContact O-N 3.02Å; V83-T85 VanDerWaalsContact C-N 3.25Å; V83-T85 PolarHBondContact O-N 3.05Å; V83-T988 HydrophobicContact CG1-CG2 4.08Å
84	E	44	Very low	48.7	Very low	151 Å²	151	98.5 Å²	98.5	71%	0.706	50%	0.496	S	S	*	.			trans	-66.4	48.4	-163.5	-66.2	163.8	140.2	0	0	116.5
85	T	55.9	Low	51.1	Low	35 Å²	35	92.2 Å²	92.2	22%	0.215	46%	0.457	C	S	.	.			trans	-126.2	123.5	166.1	39.8	0	0	0	0	112.9	V83 E87 R1040	V83-T85 VanDerWaalsContact C-N 3.25Å; V83-T85 PolarHBondContact O-N 3.05Å; T85-E87 PolarHBondContact O-N 3.05Å; T85-R1040 PolarHBondContact OG1-NH1 3.4Å; T85-R1040 VanDerWaalsContact OG1-NH1 3.15Å
86	V	59.3	Low	53.1	Low	67 Å²	67	92.9 Å²	92.9	41%	0.406	45%	0.445	S	S	.	.	S	Bend	trans	-62.9	-21.2	168.9	-174.1	0	0	0	0	111	L114	V86-L114 HydrophobicContact CB-CD2 3.94Å; V86-L114 HydrophobicContact CG1-CD2 3.71Å
87	E	69.5	Low	54.5	Low	31 Å²	31	90.2 Å²	90.2	15%	0.145	43%	0.431	C	S	.	.			trans	-67.8	132.8	174.4	-59.1	-178.2	136.7	0	0	112	T85 L114 F923 I1064 R1094	T85-E87 PolarHBondContact O-N 3.05Å; E87-L114 HydrophobicContact CG-CD2 3.91Å; E87-F923 HydrophobicContact CB-CB 4.26Å; E87-F923 HydrophobicContact CB-CD1 3.72Å; E87-F923 HydrophobicContact CB-CE1 4.23Å; E87-F923 HydrophobicContact CB-CG 3.98Å; E87-I1064 PolarHBondContact OE1-N 3.5Å; E87-R1094 VanDerWaalsContact CD-NH2 3.27Å; E87-R1094 IonicContact OE1-CZ 3.66Å; E87-R1094 IonicContact OE1-NE 2.68Å; E87-R1094 IonicContact OE1-NH2 3.45Å; E87-R1094 PolarHBondContact OE1-NH2 2.65Å
88	R	73.3	Confident	55.6	Low	104 Å²	104	87 Å²	87	39%	0.392	43%	0.428	S	S	.	.			trans	-107.4	154.4	-178.3	-61.2	-166.8	-179.9	-166.9	5	111.8	Y94 P109 F923 D924	R88-Y94 HydrophobicContact CB-CE2 4.34Å; R88-Y94 WeakPolarHBondContact CD-OH 3.31Å; R88-Y94 PolarHBondContact NH1-OH 3.16Å; R88-P109 HydrophobicContact CG-CG 4.16Å; R88-F923 WeakPolarHBondContact O-CA 3.36Å; R88-D924 PolarHBondContact O-N 2.9Å
89	V	75.8	Confident	56.7	Low	43 Å²	43	86 Å²	86	26%	0.261	43%	0.428	S	S	.	.			trans	-73.7	150.3	171.7	-66.6	0	0	0	0	111	I91	V89-I91 PolarHBondContact O-N 2.9Å
90	P	76.9	Confident	57.4	Low	4 Å²	4	84.1 Å²	84.1	3%	0.026	42%	0.415	C	S	.	.			trans	-67.3	129.9	179.3	-10.9	23.4	0	0	0	112.2	W921 D924 M967	P90-W921 HydrophobicContact CB-CD2 4.06Å; P90-W921 HydrophobicContact CB-CE3 3.82Å; P90-W921 HydrophobicContact CB-CH2 3.31Å; P90-W921 HydrophobicContact CB-CZ2 3.56Å; P90-W921 HydrophobicContact CB-CZ3 3.43Å; P90-W921 VanDerWaalsContact CB-CZ3 3.43Å; P90-W921 HydrophobicContact CG-CD2 3.48Å; P90-W921 VanDerWaalsContact CG-CD2 3.48Å; P90-W921 HydrophobicContact CG-CE3 3.59Å; P90-W921 HydrophobicContact CG-CG 4.12Å; P90-W921 HydrophobicContact CG-CH2 3.89Å; P90-W921 HydrophobicContact CG-CZ2 3.78Å; P90-W921 HydrophobicContact CG-CZ3 3.78Å; P90-D924 HydrophobicContact CB-CB 4.21Å; P90-D924 HydrophobicContact CG-CB 4.24Å; P90-M967 HydrophobicContact CB-CE 4.24Å; P90-M967 HydrophobicContact CG-CE 4.31Å
91	I	76.4	Confident	57.8	Low	45 Å²	45	83.8 Å²	83.8	23%	0.231	42%	0.419	C	S	.	.			trans	-133.6	153.7	175.5	58.7	169.9	0	0	0	110.4	V89 D93 Y94 Y95 A106	V89-I91 PolarHBondContact O-N 2.9Å; I91-D93 HydrophobicContact CD1-CB 4.3Å; I91-D93 PolarHBondContact O-N 3Å; I91-D93 VanDerWaalsContact O-N 3.11Å; I91-Y94 HydrophobicContact CD1-CD1 4.41Å; I91-Y94 HydrophobicContact CD1-CD2 4.41Å; I91-Y94 HydrophobicContact CD1-CE1 3.95Å; I91-Y94 HydrophobicContact CD1-CE2 3.97Å; I91-Y94 HydrophobicContact CG1-CD1 4.21Å; I91-Y94 HydrophobicContact CG1-CD2 3.52Å; I91-Y94 HydrophobicContact CG1-CE1 4.09Å; I91-Y94 HydrophobicContact CG1-CE2 3.4Å; I91-Y94 VanDerWaalsContact CG1-CE2 3.4Å; I91-Y94 HydrophobicContact CG1-CG 3.92Å; I91-Y94 PolarHBondContact O-N 2.97Å; I91-Y95 WeakPolarHBondContact O-CD2 3.2Å; I91-A106 HydrophobicContact CD1-CB 4.33Å
92	V	71.5	Confident	58.2	Low	22 Å²	22	80.5 Å²	80.5	13%	0.133	41%	0.414	C	S	.	.	G	3₁₀ helix	trans	-54	-34.8	-176.5	179	0	0	0	0	112.7	Y94 Y95 L970 F1103	V92-Y94 VanDerWaalsContact C-N 3.29Å; V92-Y94 PolarHBondContact O-N 3.28Å; V92-Y95 PolarHBondContact O-N 3.25Å; V92-Y95 VanDerWaalsContact O-N 3.13Å; V92-L970 HydrophobicContact CB-CD1 4.33Å; V92-L970 HydrophobicContact CG2-CB 4.03Å; V92-L970 HydrophobicContact CG2-CD1 3.99Å; V92-L970 HydrophobicContact CG2-CG 4.43Å; V92-F1103 HydrophobicContact CG1-CE1 4.11Å; V92-F1103 HydrophobicContact CG1-CZ 3.95Å
93	D	68.6	Low	58.3	Low	60 Å²	60	77.2 Å²	77.2	32%	0.321	41%	0.412	S	S	.	.	G	3₁₀ helix	trans	-67.5	-26.2	-173.9	-68.6	-17.3	0	0	0	113.6	I91 Y95 R96 I105	I91-D93 HydrophobicContact CD1-CB 4.3Å; I91-D93 PolarHBondContact O-N 3Å; I91-D93 VanDerWaalsContact O-N 3.11Å; D93-Y95 PolarHBondContact O-N 3.47Å; D93-R96 PolarHBondContact O-N 2.91Å; D93-R96 IonicContact OD1-CZ 3.6Å; D93-R96 IonicContact OD1-NE 3.02Å; D93-R96 PolarHBondContact OD1-NE 3.23Å; D93-R96 IonicContact OD1-NH2 4Å; D93-I105 HydrophobicContact CB-CG2 3.74Å
94	Y	72.3	Confident	58.2	Low	23 Å²	23	78.9 Å²	78.9	9%	0.09	43%	0.434	C	S	.	.	G	3₁₀ helix	trans	-70.8	-9.8	174.9	-59.2	-33.9	0	0	0	113.9	R88 I91 V92 A106 R108 D924 S1099	R88-Y94 HydrophobicContact CB-CE2 4.34Å; R88-Y94 WeakPolarHBondContact CD-OH 3.31Å; R88-Y94 PolarHBondContact NH1-OH 3.16Å; I91-Y94 HydrophobicContact CD1-CD1 4.41Å; I91-Y94 HydrophobicContact CD1-CD2 4.41Å; I91-Y94 HydrophobicContact CD1-CE1 3.95Å; I91-Y94 HydrophobicContact CD1-CE2 3.97Å; I91-Y94 HydrophobicContact CG1-CD1 4.21Å; I91-Y94 HydrophobicContact CG1-CD2 3.52Å; I91-Y94 HydrophobicContact CG1-CE1 4.09Å; I91-Y94 HydrophobicContact CG1-CE2 3.4Å; I91-Y94 VanDerWaalsContact CG1-CE2 3.4Å; I91-Y94 HydrophobicContact CG1-CG 3.92Å; I91-Y94 PolarHBondContact O-N 2.97Å; V92-Y94 VanDerWaalsContact C-N 3.29Å; V92-Y94 PolarHBondContact O-N 3.28Å; Y94-A106 WeakPolarHBondContact CD1-O 3.41Å; Y94-A106 HydrophobicContact CE1-CB 3.85Å; Y94-A106 VanDerWaalsContact CE1-O 3.29Å; Y94-A106 WeakPolarHBondContact CE1-O 3.42Å; Y94-R108 HydrophobicContact CD1-CB 4.06Å; Y94-R108 HydrophobicContact CE1-CB 4.35Å; Y94-R108 HydrophobicContact CG-CB 4.33Å; Y94-D924 HydrophobicContact CD2-CB 4.31Å; Y94-D924 WeakPolarHBondContact CD2-OD2 3.43Å; Y94-D924 HydrophobicContact CE2-CB 4.49Å; Y94-S1099 PolarHBondContact O-OG 3.47Å; Y94-S1099 VanDerWaalsContact O-OG 3.11Å
95	Y	75.2	Confident	58.3	Low	3 Å²	3	74.5 Å²	74.5	1%	0.012	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-113.8	9.7	-177.1	-63.3	-86.8	0	0	0	112.9	I91 V92 D93 R108 W921 D924 G926 G927 L970 F974 L1101 Y1104	I91-Y95 WeakPolarHBondContact O-CD2 3.2Å; V92-Y95 PolarHBondContact O-N 3.25Å; V92-Y95 VanDerWaalsContact O-N 3.13Å; D93-Y95 PolarHBondContact O-N 3.47Å; Y95-R108 VanDerWaalsContact CZ-NH2 3.32Å; Y95-R108 PolarHBondContact OH-NH2 3.19Å; Y95-W921 HydrophobicContact CE2-CH2 4.09Å; Y95-W921 HydrophobicContact CE2-CZ2 4.41Å; Y95-W921 VanDerWaalsContact OH-CZ2 3.23Å; Y95-W921 WeakPolarHBondContact OH-CZ2 3.28Å; Y95-D924 PolarHBondContact OH-OD1 3.06Å; Y95-G926 WeakPolarHBondContact CE1-O 3.44Å; Y95-G926 VanDerWaalsContact OH-C 3.22Å; Y95-G927 WeakPolarHBondContact OH-CA 3.44Å; Y95-G927 PolarHBondContact OH-N 3.44Å; Y95-L970 HydrophobicContact CD2-CD1 4.44Å; Y95-F974 AromaticContact CD1-CE1 4Å; Y95-F974 HydrophobicContact CD1-CE1 4Å; Y95-F974 AromaticContact CD1-CZ 3.5Å; Y95-F974 HydrophobicContact CD1-CZ 3.5Å; Y95-F974 AromaticContact CD2-CZ 3.9Å; Y95-F974 HydrophobicContact CD2-CZ 3.9Å; Y95-F974 AromaticContact CE1-CZ 3.92Å; Y95-F974 HydrophobicContact CE1-CZ 3.92Å; Y95-F974 HydrophobicContact CE2-CZ 4.33Å; Y95-F974 HydrophobicContact CG-CE1 4.07Å; Y95-F974 AromaticContact CG-CZ 3.49Å; Y95-F974 HydrophobicContact CG-CZ 3.49Å; Y95-F974 VanDerWaalsContact CG-CZ 3.49Å; Y95-L1101 HydrophobicContact CE1-CB 4.5Å; Y95-Y1104 WeakPolarHBondContact O-CE1 3.3Å
96	R	65.9	Low	58	Low	110 Å²	110	74.8 Å²	74.8	42%	0.415	42%	0.421	S	S	.	.	S	Bend	trans	-88.7	154.7	169.4	-66.1	-173.4	-170	-162.3	6.9	110.5	D93 V98 F1103	D93-R96 PolarHBondContact O-N 2.91Å; D93-R96 IonicContact OD1-CZ 3.6Å; D93-R96 IonicContact OD1-NE 3.02Å; D93-R96 PolarHBondContact OD1-NE 3.23Å; D93-R96 IonicContact OD1-NH2 4Å; R96-V98 PolarHBondContact O-N 3.01Å; R96-F1103 HydrophobicContact CG-CZ 3.98Å
97	D	52.1	Low	57.9	Low	71 Å²	71	76.9 Å²	76.9	38%	0.38	43%	0.434	S	S	.	.			trans	-70.3	126.6	170.5	-174.5	3.7	0	0	0	110.6	M99 S100 Y1104	D97-M99 PolarHBondContact O-N 2.84Å; D97-M99 PolarHBondContact OD1-N 3.17Å; D97-S100 PolarHBondContact O-N 3.16Å; D97-S100 VanDerWaalsContact O-N 3.17Å; D97-S100 PolarHBondContact O-OG 3.33Å; D97-Y1104 HydrophobicContact CB-CE1 4.16Å; D97-Y1104 HydrophobicContact CB-CE2 4.25Å
98	V	50.7	Low	58	Low	142 Å²	142	77.4 Å²	77.4	86%	0.861	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-20.8	179.6	-163.9	0	0	0	0	111.3	R96 S100	R96-V98 PolarHBondContact O-N 3.01Å; V98-S100 VanDerWaalsContact C-N 3.31Å
99	M	47	Very low	58.1	Low	160 Å²	160	73 Å²	73	79%	0.788	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.4	-5.1	176.5	-67	-68	-164	0	0	114	D97 I101	D97-M99 PolarHBondContact O-N 2.84Å; D97-M99 PolarHBondContact OD1-N 3.17Å; M99-I101 PolarHBondContact O-N 2.02Å
100	S	42.5	Very low	58.1	Low	61 Å²	61	72.9 Å²	72.9	43%	0.427	42%	0.42	S	S	.	.	S	Bend	trans	-73.1	120	171.4	65.1	0	0	0	0	110	D97 V98 E102	D97-S100 PolarHBondContact O-N 3.16Å; D97-S100 VanDerWaalsContact O-N 3.17Å; D97-S100 PolarHBondContact O-OG 3.33Å; V98-S100 VanDerWaalsContact C-N 3.31Å; S100-E102 PolarHBondContact O-N 3.47Å
101	I	38.6	Very low	58.2	Low	171 Å²	171	73 Å²	73	88%	0.877	42%	0.42	S	S	*	.	S	Bend	trans	-65	7.8	-157.7	-72.7	168.8	0	0	0	116.3	M99	M99-I101 PolarHBondContact O-N 2.02Å
102	E	36.3	Very low	58.1	Low	173 Å²	173	71.1 Å²	71.1	81%	0.808	41%	0.412	S	S	*	.	S	Bend	trans	-126.5	100.7	-171.7	-69.3	-178	166.9	0	0	113.6	S100	S100-E102 PolarHBondContact O-N 3.47Å
103	G	34.7	Very low	58.3	Low	63 Å²	63	74.1 Å²	74.1	65%	0.649	43%	0.425	S	S	*	.			trans	124.9	138.8	154.7	0	0	0	0	0	114.9	I105	G103-I105 WeakPolarHBondContact O-CG1 3.26Å; G103-I105 PolarHBondContact O-N 3.34Å
104	A	35.5	Very low	58.6	Low	118 Å²	118	71.5 Å²	71.5	98%	0.975	41%	0.411	S	S	*	.			trans	-70.2	59.4	172.5	0	0	0	0	0	111.7
105	I	47.3	Very low	59.1	Low	59 Å²	59	70.6 Å²	70.6	30%	0.303	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-72.3	142.5	-161.8	-67.9	158.9	0	0	0	111.5	D93 G103 T107	D93-I105 HydrophobicContact CB-CG2 3.74Å; G103-I105 WeakPolarHBondContact O-CG1 3.26Å; G103-I105 PolarHBondContact O-N 3.34Å; I105-T107 PolarHBondContact O-N 3.14Å; I105-T107 VanDerWaalsContact O-N 3.16Å
106	A	48.4	Very low	59	Low	41 Å²	41	73.6 Å²	73.6	34%	0.339	42%	0.421	S	S	.	.	P	Polyproline II helix	trans	-46.4	117.3	177.9	0	0	0	0	0	111.8	I91 Y94	I91-A106 HydrophobicContact CD1-CB 4.33Å; Y94-A106 WeakPolarHBondContact CD1-O 3.41Å; Y94-A106 HydrophobicContact CE1-CB 3.85Å; Y94-A106 VanDerWaalsContact CE1-O 3.29Å; Y94-A106 WeakPolarHBondContact CE1-O 3.42Å
107	T	58.1	Low	58.7	Low	110 Å²	110	74.5 Å²	74.5	68%	0.675	43%	0.43	S	S	*	.	P	Polyproline II helix	trans	-77.9	130.9	174.1	49.9	0	0	0	0	110.3	I105	I105-T107 PolarHBondContact O-N 3.14Å; I105-T107 VanDerWaalsContact O-N 3.16Å
108	R	70.4	Confident	58.6	Low	43 Å²	43	78.4 Å²	78.4	16%	0.162	45%	0.446	C	S	.	.	P	Polyproline II helix	trans	-69.1	134	168	178	-170.4	-77.4	159.4	-2.4	108.3	Y94 Y95 S110 D924 Q1097 S1099	Y94-R108 HydrophobicContact CD1-CB 4.06Å; Y94-R108 HydrophobicContact CE1-CB 4.35Å; Y94-R108 HydrophobicContact CG-CB 4.33Å; Y95-R108 VanDerWaalsContact CZ-NH2 3.32Å; Y95-R108 PolarHBondContact OH-NH2 3.19Å; R108-S110 PolarHBondContact O-N 3.36Å; R108-D924 IonicContact CZ-OD2 2.85Å; R108-D924 IonicContact NE-OD2 2.74Å; R108-D924 PolarHBondContact NE-OD2 3.36Å; R108-D924 IonicContact NH2-OD1 3.58Å; R108-D924 PolarHBondContact NH2-OD1 3.34Å; R108-D924 IonicContact NH2-OD2 2.89Å; R108-D924 PolarHBondContact NH2-OD2 3.45Å; R108-Q1097 WeakPolarHBondContact CD-O 3.41Å; R108-Q1097 PolarHBondContact NH1-O 3.3Å; R108-S1099 PolarHBondContact NH1-OG 2.95Å
109	P	76.2	Confident	58	Low	11 Å²	11	77.2 Å²	77.2	7%	0.071	43%	0.427	C	S	.	.	P	Polyproline II helix	trans	-59.8	136.3	172	-20.5	31.5	0	0	0	111.1	R88 E113 L114	R88-P109 HydrophobicContact CG-CG 4.16Å; P109-E113 VanDerWaalsContact CA-OE2 3.29Å; P109-E113 WeakPolarHBondContact CA-OE2 3.37Å; P109-L114 HydrophobicContact CB-CD1 4.41Å; P109-L114 HydrophobicContact CB-CD2 3.97Å; P109-L114 HydrophobicContact CB-CG 4.01Å; P109-L114 HydrophobicContact CG-CD2 4.48Å
110	S	75.5	Confident	57.4	Low	40 Å²	40	73.3 Å²	73.3	28%	0.28	42%	0.42	S	S	.	.	P	Polyproline II helix	trans	-67.5	157.9	174.7	76.4	0	0	0	0	110.7	R108 A112 E113 L114	R108-S110 PolarHBondContact O-N 3.36Å; S110-A112 PolarHBondContact O-N 3.03Å; S110-E113 PolarHBondContact N-OE2 3.44Å; S110-E113 PolarHBondContact O-N 3.37Å; S110-E113 WeakPolarHBondContact OG-CG 3.48Å; S110-E113 PolarHBondContact OG-N 3.01Å; S110-E113 VanDerWaalsContact OG-N 3.13Å; S110-L114 WeakPolarHBondContact O-CG 3.14Å; S110-L114 PolarHBondContact O-N 3.04Å
111	L	79.2	Confident	57	Low	6 Å²	6	77.8 Å²	77.8	3%	0.031	44%	0.439	C	S	.	.	H	α-helix	trans	-56.7	-37.3	176.3	-178.1	64	0	0	0	111.6	L114 H115 F765 I1064 N1096 Q1097	L111-L114 WeakPolarHBondContact O-CB 3.43Å; L111-L114 PolarHBondContact O-N 3.07Å; L111-H115 VanDerWaalsContact O-CB 3.28Å; L111-H115 WeakPolarHBondContact O-CB 3.43Å; L111-H115 PolarHBondContact O-N 3.24Å; L111-F765 HydrophobicContact CD1-CB 4.47Å; L111-F765 HydrophobicContact CD1-CD1 3.78Å; L111-F765 HydrophobicContact CD1-CE1 4.34Å; L111-F765 HydrophobicContact CD1-CG 4.33Å; L111-F765 HydrophobicContact CD2-CB 4.17Å; L111-F765 HydrophobicContact CD2-CD1 4.06Å; L111-F765 VanDerWaalsContact CD2-O 3.28Å; L111-F765 WeakPolarHBondContact CD2-O 3.25Å; L111-F765 HydrophobicContact CG-CB 4.47Å; L111-F765 HydrophobicContact CG-CD1 4.44Å; L111-I1064 HydrophobicContact CD1-CD1 3.94Å; L111-N1096 HydrophobicContact CD2-CB 4.31Å; L111-Q1097 HydrophobicContact CB-CG 4.36Å
112	A	73.9	Confident	56.6	Low	7 Å²	7	77.4 Å²	77.4	6%	0.058	44%	0.439	C	S	.	.	H	α-helix	trans	-71.9	-36.8	-179.6	0	0	0	0	0	112.4	S110 L114 H115 E116 Y119 Y768	S110-A112 PolarHBondContact O-N 3.03Å; A112-L114 PolarHBondContact O-N 3.17Å; A112-H115 PolarHBondContact O-N 2.68Å; A112-E116 VanDerWaalsContact O-CB 3.3Å; A112-E116 WeakPolarHBondContact O-CB 3.47Å; A112-E116 PolarHBondContact O-N 3.39Å; A112-Y119 HydrophobicContact CB-CD2 4.18Å; A112-Y119 HydrophobicContact CB-CE2 3.24Å; A112-Y119 WeakPolarHBondContact CB-OH 3.49Å; A112-Y768 HydrophobicContact CB-CE1 4.48Å
113	E	75.1	Confident	56.1	Low	85 Å²	85	74 Å²	74	40%	0.397	44%	0.44	S	S	.	.	H	α-helix	trans	-61.7	-29.4	170.3	-75.1	171.4	-167.2	0	0	113.1	P109 S110 Y119 R1066	P109-E113 VanDerWaalsContact CA-OE2 3.29Å; P109-E113 WeakPolarHBondContact CA-OE2 3.37Å; S110-E113 PolarHBondContact N-OE2 3.44Å; S110-E113 PolarHBondContact O-N 3.37Å; S110-E113 WeakPolarHBondContact OG-CG 3.48Å; S110-E113 PolarHBondContact OG-N 3.01Å; S110-E113 VanDerWaalsContact OG-N 3.13Å; E113-Y119 HydrophobicContact CG-CD1 3.73Å; E113-Y119 HydrophobicContact CG-CE1 4.18Å; E113-Y119 HydrophobicContact CG-CG 3.99Å; E113-R1066 PolarHBondContact O-NH2 3.35Å
114	L	76.8	Confident	55.7	Low	5 Å²	5	79.7 Å²	79.7	3%	0.026	45%	0.447	C	S	.	.	H	α-helix	trans	-78.9	-33.5	177.8	-67.5	172.8	0	0	0	112.4	V86 E87 P109 S110 L111 A112 I1064 R1066 Q1097	V86-L114 HydrophobicContact CB-CD2 3.94Å; V86-L114 HydrophobicContact CG1-CD2 3.71Å; E87-L114 HydrophobicContact CG-CD2 3.91Å; P109-L114 HydrophobicContact CB-CD1 4.41Å; P109-L114 HydrophobicContact CB-CD2 3.97Å; P109-L114 HydrophobicContact CB-CG 4.01Å; P109-L114 HydrophobicContact CG-CD2 4.48Å; S110-L114 WeakPolarHBondContact O-CG 3.14Å; S110-L114 PolarHBondContact O-N 3.04Å; L111-L114 WeakPolarHBondContact O-CB 3.43Å; L111-L114 PolarHBondContact O-N 3.07Å; A112-L114 PolarHBondContact O-N 3.17Å; L114-I1064 HydrophobicContact CB-CD1 3.83Å; L114-I1064 HydrophobicContact CB-CG2 4.49Å; L114-I1064 HydrophobicContact CD1-CD1 3.65Å; L114-I1064 HydrophobicContact CG-CD1 4.35Å; L114-R1066 WeakPolarHBondContact O-CG 3.46Å; L114-R1066 PolarHBondContact O-NE 3.17Å; L114-R1066 PolarHBondContact O-NH2 2.92Å; L114-Q1097 HydrophobicContact CD1-CG 3.88Å
115	H	82.2	Confident	55.2	Low	3 Å²	3	81.8 Å²	81.8	1%	0.014	44%	0.442	C	S	.	.	H	α-helix	trans	-98.1	-35.6	-169.2	-168.4	-128	0	0	0	114.1	L111 A112 H762 D766 I1064 P1065 K1067	L111-H115 VanDerWaalsContact O-CB 3.28Å; L111-H115 WeakPolarHBondContact O-CB 3.43Å; L111-H115 PolarHBondContact O-N 3.24Å; A112-H115 PolarHBondContact O-N 2.68Å; H115-H762 AromaticContact CD2-ND1 3.83Å; H115-H762 AromaticContact CE1-ND1 3.46Å; H115-H762 PolarHBondContact CE1-ND1 2.78Å; H115-H762 PolarHBondContact CE1-O 3.14Å; H115-H762 AromaticContact NE2-CE1 3.71Å; H115-H762 AromaticContact NE2-CG 3.73Å; H115-H762 AromaticContact NE2-ND1 2.87Å; H115-H762 PolarHBondContact NE2-ND1 2.79Å; H115-D766 IonicContact CE1-OD1 3.33Å; H115-D766 PolarHBondContact CE1-OD1 2.83Å; H115-D766 IonicContact ND1-OD1 2.88Å; H115-D766 PolarHBondContact ND1-OD1 2.78Å; H115-I1064 HydrophobicContact CB-CG2 4.19Å; H115-P1065 PolarHBondContact CD2-O 2.87Å; H115-K1067 WeakPolarHBondContact CE1-CE 3.35Å; H115-K1067 VanDerWaalsContact ND1-CE 3.34Å; H115-K1067 WeakPolarHBondContact ND1-CE 3.08Å; H115-K1067 PolarHBondContact O-N 3.32Å; H115-K1067 VanDerWaalsContact O-N 3.16Å
116	E	73.7	Confident	54.1	Low	67 Å²	67	88.7 Å²	88.7	31%	0.313	47%	0.47	S	S	.	.			trans	-88.3	158.9	-179.5	-62.3	-172.3	171.7	0	0	113.4	A112 Y119	A112-E116 VanDerWaalsContact O-CB 3.3Å; A112-E116 WeakPolarHBondContact O-CB 3.47Å; A112-E116 PolarHBondContact O-N 3.39Å; E116-Y119 HydrophobicContact CB-CD2 4.23Å; E116-Y119 WeakPolarHBondContact OE2-CD2 3.46Å; E116-Y119 VanDerWaalsContact OE2-CE2 3.24Å; E116-Y119 WeakPolarHBondContact OE2-CE2 3.43Å
117	E	59.2	Low	53	Low	128 Å²	128	95.9 Å²	95.9	60%	0.598	50%	0.497	S	S	*	.	S	Bend	trans	-88.4	-37.5	-179.1	-161.5	-178.1	-178.5	0	0	112.9
118	H	49.9	Very low	51.4	Low	153 Å²	153	97.1 Å²	97.1	71%	0.708	50%	0.504	S	S	*	.			trans	-130	82.3	-172.5	-74.4	85.5	0	0	0	112.4	A120	H118-A120 VanDerWaalsContact C-N 3.34Å; H118-A120 PolarHBondContact O-N 3.13Å; H118-A120 VanDerWaalsContact O-N 3.1Å
119	Y	38.3	Very low	49.2	Very low	118 Å²	118	105 Å²	105	46%	0.463	54%	0.54	S	S	.	.			trans	-86.9	64.7	179.6	-139.8	-101.5	0	0	0	112.5	A112 E113 E116	A112-Y119 HydrophobicContact CB-CD2 4.18Å; A112-Y119 HydrophobicContact CB-CE2 3.24Å; A112-Y119 WeakPolarHBondContact CB-OH 3.49Å; E113-Y119 HydrophobicContact CG-CD1 3.73Å; E113-Y119 HydrophobicContact CG-CE1 4.18Å; E113-Y119 HydrophobicContact CG-CG 3.99Å; E116-Y119 HydrophobicContact CB-CD2 4.23Å; E116-Y119 WeakPolarHBondContact OE2-CD2 3.46Å; E116-Y119 VanDerWaalsContact OE2-CE2 3.24Å; E116-Y119 WeakPolarHBondContact OE2-CE2 3.43Å
120	A	33.9	Very low	46.7	Very low	77 Å²	77	113.3 Å²	113.3	64%	0.636	58%	0.575	S	S	*	*	S	Bend	trans	-164.1	90.7	166.9	0	0	0	0	0	110.7	H118	H118-A120 VanDerWaalsContact C-N 3.34Å; H118-A120 PolarHBondContact O-N 3.13Å; H118-A120 VanDerWaalsContact O-N 3.1Å
121	N	34.1	Very low	44.3	Very low	156 Å²	156	119.6 Å²	119.6	83%	0.834	61%	0.605	S	S	*	*	S	Bend	trans	162.6	-11.1	136.8	-82	-24.8	0	0	0	116.4	A123	N121-A123 PolarHBondContact O-N 3.41Å
122	D	29.2	Very low	41.8	Very low	163 Å²	163	127.6 Å²	127.6	87%	0.872	65%	0.646	S	S	*	*			trans	-96.7	26.5	-164.5	-68.5	-21.8	0	0	0	116.4	K124	D122-K124 PolarHBondContact O-N 2.84Å
123	A	26.8	Very low	39.3	Very low	101 Å²	101	135 Å²	135	84%	0.835	69%	0.685	S	S	*	*			trans	-84.2	43.8	177.2	0	0	0	0	0	113.6	N121	N121-A123 PolarHBondContact O-N 3.41Å
124	K	25.2	Very low	37	Very low	182 Å²	182	137.7 Å²	137.7	79%	0.791	71%	0.707	S	S	*	*			trans	-154	98.3	170.5	-72	-174.5	-177.4	171.7	0	108.4	D122	D122-K124 PolarHBondContact O-N 2.84Å
125	N	25.2	Very low	34.4	Very low	163 Å²	163	143 Å²	143	87%	0.872	74%	0.742	S	S	*	*			trans	165.3	81.6	152.4	-79.9	-18.8	0	0	0	109.2
126	F	24.7	Very low	31.6	Very low	204 Å²	204	148 Å²	148	90%	0.895	78%	0.778	S	S	*	*			trans	-134.8	87.4	165	-139.3	-90.1	0	0	0	108.8
127	E	26.5	Very low	29.4	Very low	192 Å²	192	151.1 Å²	151.1	90%	0.897	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-83.4	134.1	174.7	-76.5	-165.5	154.1	0	0	111
128	T	23	Very low	27.6	Very low	136 Å²	136	150.6 Å²	150.6	83%	0.834	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-77	120.3	-168.6	-48	0	0	0	0	112.1
129	F	24.3	Very low	26.3	Very low	207 Å²	207	151.7 Å²	151.7	91%	0.908	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-85.8	121.1	174.4	-144	-95.2	0	0	0	111
130	K	23.5	Very low	25.6	Very low	187 Å²	187	155.1 Å²	155.1	81%	0.813	84%	0.841	S	S	*	*	P	Polyproline II helix	trans	-74.8	134.1	-178.7	-89.5	176.3	173.1	174	0	112
131	L	25.7	Very low	25.3	Very low	172 Å²	172	157.3 Å²	157.3	90%	0.901	85%	0.849	S	S	*	*	P	Polyproline II helix	trans	-71.3	136.1	173.8	-69.6	157.3	0	0	0	111.3
132	L	25.9	Very low	24.8	Very low	174 Å²	174	157.5 Å²	157.5	91%	0.911	85%	0.85	S	S	*	*			trans	-109.2	113.8	173.5	-78.9	163.7	0	0	0	109.7
133	D	21.9	Very low	24.7	Very low	161 Å²	161	159.8 Å²	159.8	86%	0.861	85%	0.852	S	S	*	*			trans	-78.6	133.9	171	-82.8	-37	0	0	0	111.2
134	T	26.3	Very low	24.8	Very low	142 Å²	142	159.6 Å²	159.6	87%	0.871	85%	0.851	S	S	*	*			trans	-146.4	139.4	157.1	40.9	0	0	0	0	112.5
135	P	23.5	Very low	24.9	Very low	116 Å²	116	154.5 Å²	154.5	75%	0.753	85%	0.85	S	S	*	*			trans	-114.3	151.4	-168.5	26.9	-7.4	0	0	0	116.8
136	S	23.1	Very low	25.5	Very low	110 Å²	110	151.5 Å²	151.5	77%	0.769	84%	0.842	S	S	*	*			trans	59.4	133.6	149.7	67.6	0	0	0	0	121.2
137	P	26.4	Very low	26.4	Very low	131 Å²	131	144.4 Å²	144.4	85%	0.851	83%	0.826	S	S	*	*				-140.6	145.5	117.5	32	-15.5	0	0	0	114.4
138	S	22.9	Very low	27.8	Very low	117 Å²	117	138.7 Å²	138.7	82%	0.818	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-80.6	132.2	-176	49.3	0	0	0	0	114.1
139	L	22.7	Very low	29.6	Very low	176 Å²	176	138 Å²	138	92%	0.921	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-82.2	135.6	173.5	-131.3	84.4	0	0	0	111.6
140	K	23	Very low	32.2	Very low	190 Å²	190	132.9 Å²	132.9	83%	0.826	76%	0.762	S	S	*	*	P	Polyproline II helix	trans	-80	146	179.6	-71.4	175.5	179.1	173.2	0	111.5
141	P	27.6	Very low	34.9	Very low	123 Å²	123	124.7 Å²	124.7	80%	0.799	73%	0.727	S	S	*	*	P	Polyproline II helix	trans	-80.5	137.4	177.2	30.1	-31.8	0	0	0	112.6
142	D	24.1	Very low	37.8	Very low	160 Å²	160	118.3 Å²	118.3	86%	0.856	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-71.5	132.8	177	-72.3	-39.1	0	0	0	112.3	A144	D142-A144 PolarHBondContact O-N 3.17Å
143	K	26.1	Very low	40.9	Very low	211 Å²	211	114.4 Å²	114.4	92%	0.917	68%	0.676	S	S	*	*			trans	-76.2	102.4	174.8	-72.4	-179.6	176.9	178.5	0	109.9	G145	K143-G145 PolarHBondContact O-N 3.16Å
144	A	28.6	Very low	44.2	Very low	97 Å²	97	110 Å²	110	80%	0.802	65%	0.652	S	S	*	*			trans	-75.6	101.2	165	0	0	0	0	0	110.2	D142	D142-A144 PolarHBondContact O-N 3.17Å
145	G	27.2	Very low	47.1	Very low	76 Å²	76	106 Å²	106	78%	0.784	62%	0.623	S	S	*	*			trans	-80	138.6	167.6	0	0	0	0	0	111.9	K143	K143-G145 PolarHBondContact O-N 3.16Å
146	S	39.1	Very low	50	Low	99 Å²	99	100.5 Å²	100.5	69%	0.692	59%	0.587	S	S	*	*			trans	-174.2	124.7	158.3	170.7	0	0	0	0	108.5	R148	S146-R148 VanDerWaalsContact C-N 3.25Å; S146-R148 PolarHBondContact O-N 3.43Å
147	G	42.7	Very low	53.3	Low	55 Å²	55	95.2 Å²	95.2	57%	0.567	55%	0.551	S	S	*	*			trans	-66.3	62.6	-167	0	0	0	0	0	116.6	R501	G147-R501 PolarHBondContact O-NE 3.09Å; G147-R501 VanDerWaalsContact O-NE 3.13Å; G147-R501 PolarHBondContact O-NH2 3.15Å
148	R	56.8	Low	56.5	Low	72 Å²	72	90.3 Å²	90.3	27%	0.272	52%	0.517	S	S	.	.			trans	-90	133.7	172.4	-169.7	163.8	56.5	136.9	4.4	110.1	S146 R150 G376 D377	S146-R148 VanDerWaalsContact C-N 3.25Å; S146-R148 PolarHBondContact O-N 3.43Å; R148-R150 PolarHBondContact O-N 3.39Å; R148-R150 VanDerWaalsContact O-N 3.16Å; R148-G376 PolarHBondContact NH1-O 3.19Å; R148-G376 PolarHBondContact NH2-O 2.96Å; R148-D377 IonicContact NH1-OD1 3.86Å; R148-D377 PolarHBondContact NH1-OD1 2.93Å
149	L	61.3	Low	59.8	Low	123 Å²	123	84.9 Å²	84.9	64%	0.644	48%	0.479	S	S	*	.			trans	-68.6	109.1	171.3	-74.2	157.9	0	0	0	107.8
150	R	77.4	Confident	63.1	Low	99 Å²	99	76.5 Å²	76.5	37%	0.374	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-101.2	143.7	177.6	-59.9	-169.7	179.4	-162.5	-0.6	110.3	R148 D377 L378 D379	R148-R150 PolarHBondContact O-N 3.39Å; R148-R150 VanDerWaalsContact O-N 3.16Å; R150-D377 CarbonylContact C-O 3.44Å; R150-D377 WeakPolarHBondContact CA-O 3.27Å; R150-L378 WeakPolarHBondContact CD-O 3.34Å; R150-D379 VanDerWaalsContact CB-CA 3.44Å; R150-D379 HydrophobicContact CB-CB 3.79Å; R150-D379 PolarHBondContact NH1-O 3.36Å
151	L	81.3	Confident	66.4	Low	15 Å²	15	67.5 Å²	67.5	8%	0.079	40%	0.396	C	S	.	.	B	Isolated β-bridge	trans	-84.2	140.8	-177.6	-60.5	177.1	0	0	0	111.3	Q155 V295 I374 D377 L378 D379	L151-Q155 HydrophobicContact CD2-CG 4.14Å; L151-V295 HydrophobicContact CD1-CG1 3.86Å; L151-I374 HydrophobicContact CD1-CD1 3.95Å; L151-D377 PolarHBondContact N-O 2.98Å; L151-L378 HydrophobicContact CB-CD2 4.19Å; L151-L378 WeakPolarHBondContact O-CA 3.46Å; L151-D379 PolarHBondContact O-N 3.07Å
152	G	85.4	Confident	69.6	Low	38 Å²	38	62.2 Å²	62.2	39%	0.392	36%	0.361	S	S	.	.	P	Polyproline II helix	trans	-72.1	168.8	169.9	0	0	0	0	0	112.5	I154 G156	G152-I154 VanDerWaalsContact C-N 3.32Å; G152-I154 PolarHBondContact O-N 3.46Å; G152-G156 PolarHBondContact O-N 2.94Å
153	W	92	Very high	72.7	Confident	91 Å²	91	54.6 Å²	54.6	35%	0.345	32%	0.32	S	S	.	.	H	α-helix	trans	-65.1	-31.7	-176.1	71.6	-90.4	0	0	0	114.1	V157 L158 A384 K387 L391	W153-V157 WeakPolarHBondContact O-CA 3.5Å; W153-V157 WeakPolarHBondContact O-CB 3.46Å; W153-V157 PolarHBondContact O-N 3.02Å; W153-V157 VanDerWaalsContact O-N 3.14Å; W153-L158 HydrophobicContact CE3-CB 4.39Å; W153-L158 HydrophobicContact CH2-CD2 4.5Å; W153-L158 HydrophobicContact CZ3-CB 4.29Å; W153-L158 HydrophobicContact CZ3-CD2 3.96Å; W153-L158 PolarHBondContact O-N 2.9Å; W153-A384 VanDerWaalsContact CB-CA 3.46Å; W153-A384 HydrophobicContact CB-CB 3.53Å; W153-K387 HydrophobicContact CD2-CB 4.28Å; W153-K387 HydrophobicContact CE3-CB 3.99Å; W153-K387 HydrophobicContact CZ3-CB 4.39Å; W153-L391 HydrophobicContact CH2-CD2 4.21Å; W153-L391 HydrophobicContact CZ3-CD2 4.1Å
154	I	90.9	Very high	75.7	Confident	70 Å²	70	45.8 Å²	45.8	36%	0.359	29%	0.285	S	S	.	.	I	π-helix	trans	-68.8	-59.8	177.1	-58.3	177.9	0	0	0	109.5	G152 L158 V159 W303	G152-I154 VanDerWaalsContact C-N 3.32Å; G152-I154 PolarHBondContact O-N 3.46Å; I154-L158 HydrophobicContact CG2-CD2 4.38Å; I154-L158 PolarHBondContact O-N 3.08Å; I154-V159 HydrophobicContact CG2-CG2 4.23Å; I154-V159 WeakPolarHBondContact O-CG2 3.22Å; I154-V159 PolarHBondContact O-N 3.3Å; I154-W303 HydrophobicContact CG2-CH2 3.81Å; I154-W303 HydrophobicContact CG2-CZ2 3.74Å
155	Q	86.5	Confident	78.7	Confident	57 Å²	57	41.5 Å²	41.5	27%	0.266	25%	0.249	S	C	.	.	I	π-helix	trans	-66.6	-40.7	-176	179.4	176.4	-1.9	0	0	113	L151 S299	L151-Q155 HydrophobicContact CD2-CG 4.14Å; Q155-S299 PolarHBondContact NE2-OG 3.46Å
156	G	85.6	Confident	81.6	Confident	0 Å²	0	38 Å²	38	0%	0	21%	0.213	C	C	.	.	I	π-helix	trans	-86.9	-28.9	-174.4	0	0	0	0	0	114.7	G152 I374	G152-G156 PolarHBondContact O-N 2.94Å; G156-I374 WeakPolarHBondContact O-CD1 3.34Å
157	V	92.3	Very high	83.6	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	18%	0.183	C	C	.	.	I	π-helix	trans	-118.1	-61.9	-174.3	-172.7	0	0	0	0	111.5	W153 R160 V161 L378 A384 I385 T389	W153-V157 WeakPolarHBondContact O-CA 3.5Å; W153-V157 WeakPolarHBondContact O-CB 3.46Å; W153-V157 PolarHBondContact O-N 3.02Å; W153-V157 VanDerWaalsContact O-N 3.14Å; V157-R160 PolarHBondContact O-N 3.12Å; V157-V161 HydrophobicContact CG1-CG2 4.22Å; V157-V161 WeakPolarHBondContact O-CB 3.43Å; V157-V161 VanDerWaalsContact O-CG2 3.25Å; V157-V161 WeakPolarHBondContact O-CG2 3.38Å; V157-V161 PolarHBondContact O-N 3.34Å; V157-L378 HydrophobicContact CG2-CD1 3.48Å; V157-L378 VanDerWaalsContact CG2-CD1 3.48Å; V157-L378 HydrophobicContact CG2-CD2 3.8Å; V157-L378 HydrophobicContact CG2-CG 4.31Å; V157-A384 HydrophobicContact CG2-CB 4.13Å; V157-I385 HydrophobicContact CG2-CG1 4.49Å; V157-T389 WeakPolarHBondContact CG1-OG1 3.38Å
158	L	93.9	Very high	85.3	Confident	27 Å²	27	32 Å²	32	14%	0.141	16%	0.162	C	C	.	.	I	π-helix	trans	-58.3	-56.6	-171.9	179.4	65.5	0	0	0	112.3	W153 I154 R160 V161 V162 G388 L391	W153-L158 HydrophobicContact CE3-CB 4.39Å; W153-L158 HydrophobicContact CH2-CD2 4.5Å; W153-L158 HydrophobicContact CZ3-CB 4.29Å; W153-L158 HydrophobicContact CZ3-CD2 3.96Å; W153-L158 PolarHBondContact O-N 2.9Å; I154-L158 HydrophobicContact CG2-CD2 4.38Å; I154-L158 PolarHBondContact O-N 3.08Å; L158-R160 VanDerWaalsContact C-N 3.26Å; L158-R160 PolarHBondContact O-N 3.03Å; L158-V161 PolarHBondContact O-N 2.95Å; L158-V162 HydrophobicContact CD1-CG2 4.03Å; L158-V162 HydrophobicContact CG-CG2 4.41Å; L158-V162 WeakPolarHBondContact O-CB 3.5Å; L158-V162 WeakPolarHBondContact O-CG2 3.11Å; L158-V162 PolarHBondContact O-N 2.8Å; L158-G388 WeakPolarHBondContact CD1-O 3.47Å; L158-L391 HydrophobicContact CD1-CB 3.94Å; L158-L391 HydrophobicContact CD1-CD2 4.03Å; L158-L391 HydrophobicContact CD1-CG 3.89Å; L158-L391 HydrophobicContact CD2-CD2 3.9Å
159	V	92.1	Very high	86.6	Confident	3 Å²	3	29.3 Å²	29.3	2%	0.018	15%	0.153	C	C	.	.	H	α-helix	trans	-57.8	-44.4	-177.7	171.1	0	0	0	0	110.4	I154 V162 L163 Q302 W303 L306	I154-V159 HydrophobicContact CG2-CG2 4.23Å; I154-V159 WeakPolarHBondContact O-CG2 3.22Å; I154-V159 PolarHBondContact O-N 3.3Å; V159-V162 PolarHBondContact O-N 2.84Å; V159-L163 HydrophobicContact CG1-CD1 3.63Å; V159-L163 HydrophobicContact CG1-CG 4.35Å; V159-L163 WeakPolarHBondContact O-CB 3.44Å; V159-L163 VanDerWaalsContact O-CG 3.24Å; V159-L163 WeakPolarHBondContact O-CG 3.28Å; V159-L163 PolarHBondContact O-N 3.19Å; V159-Q302 HydrophobicContact CG1-CB 4.03Å; V159-W303 HydrophobicContact CG2-CD2 4.45Å; V159-W303 HydrophobicContact CG2-CH2 4.07Å; V159-W303 HydrophobicContact CG2-CZ2 3.88Å; V159-W303 HydrophobicContact CG2-CZ3 4.43Å; V159-L306 HydrophobicContact CB-CD2 4.49Å; V159-L306 HydrophobicContact CG1-CB 4.44Å; V159-L306 HydrophobicContact CG1-CD2 4.08Å; V159-L306 HydrophobicContact CG2-CD2 3.9Å
160	R	91.2	Very high	87.9	Confident	1 Å²	1	23.4 Å²	23.4	0%	0.004	12%	0.122	C	C	.	.	H	α-helix	trans	-64.5	-42.5	-179.3	-160.7	-178	-171.8	87.5	8.8	112.5	V157 L158 S164 E298 A370 A471	V157-R160 PolarHBondContact O-N 3.12Å; L158-R160 VanDerWaalsContact C-N 3.26Å; L158-R160 PolarHBondContact O-N 3.03Å; R160-S164 WeakPolarHBondContact O-CB 3.09Å; R160-S164 PolarHBondContact O-N 3.25Å; R160-E298 IonicContact CZ-OE1 3.99Å; R160-E298 IonicContact CZ-OE2 2.67Å; R160-E298 IonicContact NH1-OE1 3.9Å; R160-E298 PolarHBondContact NH1-OE1 3.47Å; R160-E298 IonicContact NH1-OE2 3.22Å; R160-E298 PolarHBondContact NH1-OE2 2.84Å; R160-E298 IonicContact NH2-OE1 2.94Å; R160-E298 PolarHBondContact NH2-OE1 3.12Å; R160-E298 IonicContact NH2-OE2 3.64Å; R160-A370 VanDerWaalsContact CD-O 3.25Å; R160-A370 WeakPolarHBondContact CD-O 3.45Å; R160-A370 HydrophobicContact CG-CB 3.93Å; R160-A370 PolarHBondContact NE-O 3Å; R160-A471 HydrophobicContact CG-CB 4.34Å; R160-A471 PolarHBondContact NH2-O 2.65Å
161	V	93.1	Very high	88.3	Confident	0 Å²	0	18.8 Å²	18.8	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-68.3	-45.8	177.4	170.6	0	0	0	0	110.7	V157 L158 S164 I165	V157-V161 HydrophobicContact CG1-CG2 4.22Å; V157-V161 WeakPolarHBondContact O-CB 3.43Å; V157-V161 VanDerWaalsContact O-CG2 3.25Å; V157-V161 WeakPolarHBondContact O-CG2 3.38Å; V157-V161 PolarHBondContact O-N 3.34Å; L158-V161 PolarHBondContact O-N 2.95Å; V161-S164 PolarHBondContact O-N 3.46Å; V161-I165 HydrophobicContact CG1-CD1 3.62Å; V161-I165 HydrophobicContact CG1-CG1 4.38Å; V161-I165 WeakPolarHBondContact O-CB 3.08Å; V161-I165 WeakPolarHBondContact O-CG1 3.47Å; V161-I165 PolarHBondContact O-N 3.23Å
162	V	93.2	Very high	88.3	Confident	12 Å²	12	19.4 Å²	19.4	7%	0.073	11%	0.108	C	C	.	.	H	α-helix	trans	-59.2	-51.4	178.4	169.4	0	0	0	0	110.8	L158 V159 S164 I165 L166 L306 V395 T396	L158-V162 HydrophobicContact CD1-CG2 4.03Å; L158-V162 HydrophobicContact CG-CG2 4.41Å; L158-V162 WeakPolarHBondContact O-CB 3.5Å; L158-V162 WeakPolarHBondContact O-CG2 3.11Å; L158-V162 PolarHBondContact O-N 2.8Å; V159-V162 PolarHBondContact O-N 2.84Å; V162-S164 VanDerWaalsContact C-N 3.32Å; V162-S164 PolarHBondContact O-N 2.8Å; V162-I165 PolarHBondContact O-N 3.27Å; V162-L166 HydrophobicContact CG1-CD1 3.7Å; V162-L166 HydrophobicContact CG1-CG 4.31Å; V162-L166 VanDerWaalsContact O-CG 3.31Å; V162-L166 WeakPolarHBondContact O-CG 3.31Å; V162-L166 PolarHBondContact O-N 3.12Å; V162-L306 HydrophobicContact CG1-CD1 4.23Å; V162-V395 HydrophobicContact CG2-CG1 4.44Å; V162-T396 HydrophobicContact CB-CG2 4.23Å; V162-T396 HydrophobicContact CG1-CG2 4.15Å; V162-T396 HydrophobicContact CG2-CG2 4.2Å
163	L	90.7	Very high	88.4	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-63.6	-37.8	-179.8	-69	171.7	0	0	0	112.7	V159 G167 Q302 L306 L309 S467 S468	V159-L163 HydrophobicContact CG1-CD1 3.63Å; V159-L163 HydrophobicContact CG1-CG 4.35Å; V159-L163 WeakPolarHBondContact O-CB 3.44Å; V159-L163 VanDerWaalsContact O-CG 3.24Å; V159-L163 WeakPolarHBondContact O-CG 3.28Å; V159-L163 PolarHBondContact O-N 3.19Å; L163-G167 PolarHBondContact O-N 3.37Å; L163-Q302 HydrophobicContact CD1-CB 3.77Å; L163-Q302 HydrophobicContact CD1-CG 4.05Å; L163-Q302 WeakPolarHBondContact CD1-O 3.26Å; L163-L306 HydrophobicContact CD1-CB 4.24Å; L163-L306 HydrophobicContact CD2-CB 4.09Å; L163-L306 HydrophobicContact CD2-CD1 3.83Å; L163-L306 HydrophobicContact CG-CB 4.46Å; L163-L306 HydrophobicContact CG-CD1 4.2Å; L163-L309 HydrophobicContact CD2-CD2 3.71Å; L163-S467 VanDerWaalsContact CB-OG 3.26Å; L163-S467 WeakPolarHBondContact CB-OG 3.35Å; L163-S467 WeakPolarHBondContact CD1-OG 3.04Å; L163-S468 PolarHBondContact O-OG 3Å
164	S	89.2	Confident	88.3	Confident	26 Å²	26	16.7 Å²	16.7	18%	0.182	9%	0.086	C	C	.	.	H	α-helix	trans	-71.6	-30.5	179.4	-173.7	0	0	0	0	113.3	R160 V161 V162 G367	R160-S164 WeakPolarHBondContact O-CB 3.09Å; R160-S164 PolarHBondContact O-N 3.25Å; V161-S164 PolarHBondContact O-N 3.46Å; V162-S164 VanDerWaalsContact C-N 3.32Å; V162-S164 PolarHBondContact O-N 2.8Å; S164-G367 VanDerWaalsContact OG-CA 3.27Å; S164-G367 WeakPolarHBondContact OG-CA 3.3Å
165	I	90.7	Very high	88.3	Confident	8 Å²	8	13.4 Å²	13.4	4%	0.041	7%	0.068	C	C	.	.	H	α-helix	trans	-82.1	-42	178.7	-68.6	172	0	0	0	110.9	V161 V162 G167 A364 I368 I393 T396 Y400	V161-I165 HydrophobicContact CG1-CD1 3.62Å; V161-I165 HydrophobicContact CG1-CG1 4.38Å; V161-I165 WeakPolarHBondContact O-CB 3.08Å; V161-I165 WeakPolarHBondContact O-CG1 3.47Å; V161-I165 PolarHBondContact O-N 3.23Å; V162-I165 PolarHBondContact O-N 3.27Å; I165-G167 PolarHBondContact O-N 2.91Å; I165-A364 WeakPolarHBondContact CA-O 3.41Å; I165-I368 HydrophobicContact CD1-CG2 3.94Å; I165-I393 HydrophobicContact CD1-CG1 4.38Å; I165-T396 HydrophobicContact CB-CG2 3.8Å; I165-T396 HydrophobicContact CD1-CG2 4.45Å; I165-T396 HydrophobicContact CG2-CG2 3.81Å; I165-T396 WeakPolarHBondContact CG2-OG1 3.25Å; I165-Y400 HydrophobicContact CG2-CE2 3.91Å; I165-Y400 PolarHBondContact O-OH 3.28Å
166	L	88.7	Confident	88.5	Confident	3 Å²	3	11.4 Å²	11.4	2%	0.016	6%	0.059	C	C	.	.	H	α-helix	trans	-62.7	-42.5	-178.5	-67.3	177.2	0	0	0	111.8	V162 L170 L309 T396 I399 Y400	V162-L166 HydrophobicContact CG1-CD1 3.7Å; V162-L166 HydrophobicContact CG1-CG 4.31Å; V162-L166 VanDerWaalsContact O-CG 3.31Å; V162-L166 WeakPolarHBondContact O-CG 3.31Å; V162-L166 PolarHBondContact O-N 3.12Å; L166-L170 HydrophobicContact CB-CD2 4.23Å; L166-L170 HydrophobicContact CD2-CD2 3.97Å; L166-L170 WeakPolarHBondContact O-CB 3.22Å; L166-L170 PolarHBondContact O-N 2.98Å; L166-L309 HydrophobicContact CB-CD2 4.17Å; L166-L309 HydrophobicContact CD1-CD2 3.65Å; L166-L309 HydrophobicContact CD1-CG 4.49Å; L166-T396 HydrophobicContact CD2-CG2 3.97Å; L166-T396 HydrophobicContact CG-CG2 3.95Å; L166-I399 HydrophobicContact CD1-CD1 3.98Å; L166-I399 HydrophobicContact CD2-CB 3.96Å; L166-I399 HydrophobicContact CD2-CD1 4.01Å; L166-I399 HydrophobicContact CD2-CG2 3.69Å; L166-Y400 HydrophobicContact CD2-CE2 4.31Å; L166-Y400 PolarHBondContact O-OH 3.1Å
167	G	80.5	Confident	88.8	Confident	7 Å²	7	11.6 Å²	11.6	7%	0.072	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	42.4	-157.5	166.7	0	0	0	0	0	116.6	L163 I165 A464	L163-G167 PolarHBondContact O-N 3.37Å; I165-G167 PolarHBondContact O-N 2.91Å; G167-A464 VanDerWaalsContact O-CB 3.31Å; G167-A464 WeakPolarHBondContact O-CB 3.47Å
168	T	77.8	Confident	88.9	Confident	19 Å²	19	11.6 Å²	11.6	12%	0.117	6%	0.059	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-28.3	172.5	42	0	0	0	0	113.2	L170 F171 L172 T465	T168-L170 PolarHBondContact O-N 3.45Å; T168-F171 PolarHBondContact O-N 3.32Å; T168-F171 VanDerWaalsContact O-N 3.12Å; T168-L172 HydrophobicContact CG2-CD1 4.46Å; T168-L172 PolarHBondContact O-N 3.24Å; T168-T465 HydrophobicContact CG2-CG2 3.03Å
169	I	84.6	Confident	88.7	Confident	16 Å²	16	10.3 Å²	10.3	8%	0.082	5%	0.053	C	C	.	.	H	α-helix	trans	-63.5	-33.3	-170.2	-68.4	170.4	0	0	0	110.6	F171 R173 V174 F361 P363 A364 Y400	I169-F171 PolarHBondContact O-N 2.74Å; I169-R173 HydrophobicContact CG2-CB 3.97Å; I169-R173 WeakPolarHBondContact O-CB 3.2Å; I169-R173 PolarHBondContact O-N 3.41Å; I169-V174 PolarHBondContact O-N 3.4Å; I169-V174 VanDerWaalsContact O-N 3.16Å; I169-F361 HydrophobicContact CG2-CD2 3.92Å; I169-F361 HydrophobicContact CG2-CE2 4.35Å; I169-P363 HydrophobicContact CD1-CB 3.98Å; I169-A364 HydrophobicContact CB-CB 3.96Å; I169-A364 HydrophobicContact CD1-CB 3.65Å; I169-A364 VanDerWaalsContact CD1-N 3.26Å; I169-A364 HydrophobicContact CG1-CB 4.38Å; I169-A364 HydrophobicContact CG2-CB 3.87Å; I169-Y400 HydrophobicContact CG2-CE1 4.45Å
170	L	89.2	Confident	88.8	Confident	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-56.1	-48.1	174.3	-177.9	69.4	0	0	0	112.7	L166 T168 V174 L313 I399 Y400 T403	L166-L170 HydrophobicContact CB-CD2 4.23Å; L166-L170 HydrophobicContact CD2-CD2 3.97Å; L166-L170 WeakPolarHBondContact O-CB 3.22Å; L166-L170 PolarHBondContact O-N 2.98Å; T168-L170 PolarHBondContact O-N 3.45Å; L170-V174 HydrophobicContact CD1-CG2 4.32Å; L170-V174 WeakPolarHBondContact O-CB 3.16Å; L170-V174 WeakPolarHBondContact O-CG2 3.43Å; L170-L313 HydrophobicContact CD2-CD1 4.38Å; L170-L313 HydrophobicContact CD2-CD2 3.81Å; L170-I399 HydrophobicContact CD1-CG2 4.02Å; L170-I399 HydrophobicContact CD2-CG2 4.09Å; L170-Y400 HydrophobicContact CB-CE1 3.83Å; L170-Y400 HydrophobicContact CD1-CD1 3.68Å; L170-Y400 HydrophobicContact CD1-CE1 3.7Å; L170-Y400 HydrophobicContact CD1-CG 4.26Å; L170-Y400 HydrophobicContact CG-CE1 4.41Å; L170-Y400 PolarHBondContact N-OH 3.41Å; L170-T403 HydrophobicContact CD1-CG2 4.3Å
171	F	85.5	Confident	88.8	Confident	1 Å²	1	10.6 Å²	10.6	0%	0.004	5%	0.054	C	C	.	.	H	α-helix	trans	-84.1	-40.6	-174.3	-67.4	-83	0	0	0	113.2	T168 I169 L309 L313 L447 V457 I461 A464	T168-F171 PolarHBondContact O-N 3.32Å; T168-F171 VanDerWaalsContact O-N 3.12Å; I169-F171 PolarHBondContact O-N 2.74Å; F171-L309 HydrophobicContact CE2-CD1 3.47Å; F171-L309 VanDerWaalsContact CE2-CD1 3.47Å; F171-L309 HydrophobicContact CZ-CD1 3.51Å; F171-L313 HydrophobicContact CE1-CD2 4.4Å; F171-L313 HydrophobicContact CZ-CD2 4.21Å; F171-L447 HydrophobicContact CD1-CB 4.03Å; F171-L447 HydrophobicContact CD1-CD2 3.6Å; F171-L447 HydrophobicContact CD1-CG 4.45Å; F171-L447 HydrophobicContact CE1-CD2 3.97Å; F171-L447 HydrophobicContact CG-CD2 4.36Å; F171-V457 HydrophobicContact CD1-CG1 4.01Å; F171-V457 HydrophobicContact CE1-CG1 3.9Å; F171-I461 HydrophobicContact CB-CD1 4.06Å; F171-I461 HydrophobicContact CB-CG1 3.67Å; F171-I461 HydrophobicContact CD1-CD1 4.36Å; F171-I461 HydrophobicContact CD1-CG1 3.7Å; F171-I461 HydrophobicContact CD2-CG1 3.93Å; F171-I461 HydrophobicContact CE1-CG1 4.32Å; F171-I461 HydrophobicContact CE2-CG1 4.49Å; F171-I461 HydrophobicContact CG-CD1 4.3Å; F171-I461 HydrophobicContact CG-CG1 3.5Å; F171-I461 VanDerWaalsContact CG-CG1 3.5Å; F171-A464 HydrophobicContact CE2-CB 4.17Å
172	L	81.5	Confident	88.9	Confident	28 Å²	28	10.6 Å²	10.6	15%	0.147	5%	0.054	C	C	.	.	H	α-helix	trans	-98.4	-17	-167.7	-60.8	-179.7	0	0	0	114.1	T168 Y444 Q445	T168-L172 HydrophobicContact CG2-CD1 4.46Å; T168-L172 PolarHBondContact O-N 3.24Å; L172-Y444 WeakPolarHBondContact CA-O 3.43Å; L172-Y444 WeakPolarHBondContact O-CB 3.47Å; L172-Y444 WeakPolarHBondContact O-CD1 3.47Å; L172-Q445 HydrophobicContact CD2-CG 3.99Å
173	R	87.4	Confident	89	Confident	73 Å²	73	10 Å²	10	28%	0.275	5%	0.051	S	C	.	.	T	Hydrogen-bonded Turn	trans	-127.6	-17.7	-170.5	-62.3	-64.9	-175.4	174	-1.6	114.4	I169 W176 M177 V360	I169-R173 HydrophobicContact CG2-CB 3.97Å; I169-R173 WeakPolarHBondContact O-CB 3.2Å; I169-R173 PolarHBondContact O-N 3.41Å; R173-W176 PolarHBondContact O-N 3.03Å; R173-M177 VanDerWaalsContact O-CB 3.3Å; R173-M177 WeakPolarHBondContact O-CB 3.4Å; R173-M177 PolarHBondContact O-N 2.81Å; R173-V360 HydrophobicContact CG-CG1 4.42Å
174	V	89.9	Confident	89.2	Confident	0 Å²	0	11.3 Å²	11.3	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-66.3	-39.4	178.6	172.1	0	0	0	0	112.1	I169 L170 M177 T178 Y400 T403 V404	I169-V174 PolarHBondContact O-N 3.4Å; I169-V174 VanDerWaalsContact O-N 3.16Å; L170-V174 HydrophobicContact CD1-CG2 4.32Å; L170-V174 WeakPolarHBondContact O-CB 3.16Å; L170-V174 WeakPolarHBondContact O-CG2 3.43Å; V174-M177 HydrophobicContact CG1-CE 4.35Å; V174-M177 HydrophobicContact CG2-CE 4.4Å; V174-M177 PolarHBondContact O-N 2.86Å; V174-T178 WeakPolarHBondContact O-CB 3.35Å; V174-T178 PolarHBondContact O-N 3.47Å; V174-T178 PolarHBondContact O-OG1 3.24Å; V174-Y400 HydrophobicContact CG2-CD1 3.53Å; V174-Y400 HydrophobicContact CG2-CE1 3.58Å; V174-T403 HydrophobicContact CB-CG2 4.27Å; V174-T403 HydrophobicContact CG1-CG2 3.69Å; V174-V404 HydrophobicContact CG1-CB 4.48Å; V174-V404 HydrophobicContact CG1-CG2 3.6Å
175	S	90.8	Very high	89.4	Confident	0 Å²	0	11.5 Å²	11.5	0%	0	6%	0.064	C	C	.	.	H	α-helix	trans	-59.5	-50.5	174.1	51.5	0	0	0	0	111	M177 T178 A179 I440 T446	S175-M177 PolarHBondContact O-N 3.47Å; S175-T178 CarbonylContact O-C 3.6Å; S175-T178 WeakPolarHBondContact O-CB 3.35Å; S175-T178 PolarHBondContact O-N 3.14Å; S175-T178 VanDerWaalsContact O-N 3.14Å; S175-A179 PolarHBondContact O-N 3.45Å; S175-I440 CarbonylContact C-O 3.52Å; S175-T446 WeakPolarHBondContact CB-OG1 3.06Å
176	W	91.3	Very high	89.6	Confident	16 Å²	16	11.1 Å²	11.1	6%	0.061	6%	0.062	C	C	.	.	H	α-helix	trans	-59.4	-44.4	177.5	178.8	85.2	0	0	0	112.6	R173 T178 A179 H180 E352 V357 V360 I440 Y444	R173-W176 PolarHBondContact O-N 3.03Å; W176-T178 VanDerWaalsContact C-N 3.34Å; W176-T178 PolarHBondContact O-N 2.92Å; W176-A179 WeakPolarHBondContact O-CB 3.12Å; W176-A179 PolarHBondContact O-N 2.98Å; W176-H180 AromaticContact CD1-CD2 3.74Å; W176-H180 AromaticContact CD1-NE2 3.7Å; W176-H180 AromaticContact CD2-CD2 3.83Å; W176-H180 AromaticContact CE2-CD2 3.36Å; W176-H180 AromaticContact CE2-NE2 3.51Å; W176-H180 AromaticContact CZ2-CD2 3.76Å; W176-H180 AromaticContact CZ2-NE2 3.9Å; W176-H180 AromaticContact NE1-CD2 3.29Å; W176-H180 PolarHBondContact NE1-CD2 3.41Å; W176-H180 VanDerWaalsContact NE1-CD2 3.29Å; W176-H180 AromaticContact NE1-NE2 3.04Å; W176-H180 PolarHBondContact NE1-NE2 3.37Å; W176-H180 PolarHBondContact O-CD2 3.17Å; W176-H180 PolarHBondContact O-N 3.01Å; W176-H180 VanDerWaalsContact O-N 3.12Å; W176-E352 HydrophobicContact CH2-CG 4.11Å; W176-E352 HydrophobicContact CZ2-CG 3.68Å; W176-V357 HydrophobicContact CH2-CB 4.44Å; W176-V357 HydrophobicContact CH2-CG2 3.75Å; W176-V357 HydrophobicContact CZ3-CB 4.16Å; W176-V357 HydrophobicContact CZ3-CG1 3.97Å; W176-V357 HydrophobicContact CZ3-CG2 3.84Å; W176-V360 HydrophobicContact CE3-CG1 4.22Å; W176-V360 HydrophobicContact CH2-CB 4.31Å; W176-V360 HydrophobicContact CH2-CG1 4.5Å; W176-V360 HydrophobicContact CH2-CG2 3.98Å; W176-V360 HydrophobicContact CZ3-CB 3.82Å; W176-V360 HydrophobicContact CZ3-CG1 3.83Å; W176-V360 HydrophobicContact CZ3-CG2 4.02Å; W176-I440 WeakPolarHBondContact CA-O 3.41Å; W176-I440 PolarHBondContact N-O 3.18Å; W176-Y444 HydrophobicContact CB-CD1 4.09Å; W176-Y444 HydrophobicContact CB-CE1 3.83Å; W176-Y444 AromaticContact CD1-CE1 3.61Å; W176-Y444 AromaticContact CG-CE1 3.8Å; W176-Y444 HydrophobicContact CG-CE1 3.8Å
177	M	92.2	Very high	90	Very high	3 Å²	3	13.1 Å²	13.1	2%	0.015	7%	0.073	C	C	.	.	H	α-helix	trans	-59.1	-46.8	174.6	175.7	179.4	71.5	0	0	111	R173 V174 S175 A179 H180 A181 S186 I189 V190 V357 F361 V404	R173-M177 VanDerWaalsContact O-CB 3.3Å; R173-M177 WeakPolarHBondContact O-CB 3.4Å; R173-M177 PolarHBondContact O-N 2.81Å; V174-M177 HydrophobicContact CG1-CE 4.35Å; V174-M177 HydrophobicContact CG2-CE 4.4Å; V174-M177 PolarHBondContact O-N 2.86Å; S175-M177 PolarHBondContact O-N 3.47Å; M177-A179 VanDerWaalsContact C-N 3.26Å; M177-A179 PolarHBondContact O-N 2.93Å; M177-H180 PolarHBondContact O-N 3.06Å; M177-A181 WeakPolarHBondContact O-CB 3.47Å; M177-A181 PolarHBondContact O-N 2.91Å; M177-S186 PolarHBondContact O-OG 3.12Å; M177-I189 HydrophobicContact SD-CB 4.49Å; M177-I189 HydrophobicContact SD-CG2 3.94Å; M177-V190 HydrophobicContact CE-CG2 4.11Å; M177-V357 HydrophobicContact CB-CG1 4.02Å; M177-V357 HydrophobicContact CG-CG1 3.57Å; M177-F361 HydrophobicContact CE-CD2 4.04Å; M177-F361 HydrophobicContact CE-CE2 4.21Å; M177-F361 HydrophobicContact SD-CB 3.92Å; M177-F361 HydrophobicContact SD-CD2 3.59Å; M177-F361 VanDerWaalsContact SD-CD2 3.59Å; M177-F361 HydrophobicContact SD-CE2 4.27Å; M177-F361 HydrophobicContact SD-CG 3.75Å; M177-V404 HydrophobicContact CE-CG2 3.56Å
178	T	92.9	Very high	90.6	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-63.1	-34.6	177.4	-52.3	0	0	0	0	111.4	V174 S175 W176 G182 I183 S186 V404 I440	V174-T178 WeakPolarHBondContact O-CB 3.35Å; V174-T178 PolarHBondContact O-N 3.47Å; V174-T178 PolarHBondContact O-OG1 3.24Å; S175-T178 CarbonylContact O-C 3.6Å; S175-T178 WeakPolarHBondContact O-CB 3.35Å; S175-T178 PolarHBondContact O-N 3.14Å; S175-T178 VanDerWaalsContact O-N 3.14Å; W176-T178 VanDerWaalsContact C-N 3.34Å; W176-T178 PolarHBondContact O-N 2.92Å; T178-G182 CarbonylContact O-C 3.59Å; T178-G182 WeakPolarHBondContact O-CA 3.26Å; T178-G182 PolarHBondContact O-N 2.91Å; T178-I183 HydrophobicContact CG2-CG1 4.12Å; T178-S186 WeakPolarHBondContact CA-OG 3.47Å; T178-V404 HydrophobicContact CG2-CG1 4.22Å; T178-I440 HydrophobicContact CG2-CD1 4.24Å
179	A	91.2	Very high	91.4	Very high	0 Å²	0	15.9 Å²	15.9	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64	-51.9	177.8	0	0	0	0	0	111.9	S175 W176 M177 R413 I440 M441	S175-A179 PolarHBondContact O-N 3.45Å; W176-A179 WeakPolarHBondContact O-CB 3.12Å; W176-A179 PolarHBondContact O-N 2.98Å; M177-A179 VanDerWaalsContact C-N 3.26Å; M177-A179 PolarHBondContact O-N 2.93Å; A179-R413 PolarHBondContact O-NE 3.35Å; A179-R413 PolarHBondContact O-NH2 3.49Å; A179-I440 HydrophobicContact CB-CB 4.28Å; A179-I440 HydrophobicContact CB-CD1 3.99Å; A179-I440 HydrophobicContact CB-CG1 3.69Å; A179-M441 HydrophobicContact CB-CB 3.84Å; A179-M441 HydrophobicContact CB-CE 4.09Å; A179-M441 HydrophobicContact CB-CG 4.29Å
180	H	92.8	Very high	91.9	Very high	10 Å²	10	15.3 Å²	15.3	5%	0.046	8%	0.082	C	C	.	.	H	α-helix	trans	-79.2	-47.1	-176.2	-73.5	-80.7	0	0	0	113.3	W176 M177 D348 W349 E352 V357	W176-H180 AromaticContact CD1-CD2 3.74Å; W176-H180 AromaticContact CD1-NE2 3.7Å; W176-H180 AromaticContact CD2-CD2 3.83Å; W176-H180 AromaticContact CE2-CD2 3.36Å; W176-H180 AromaticContact CE2-NE2 3.51Å; W176-H180 AromaticContact CZ2-CD2 3.76Å; W176-H180 AromaticContact CZ2-NE2 3.9Å; W176-H180 AromaticContact NE1-CD2 3.29Å; W176-H180 PolarHBondContact NE1-CD2 3.41Å; W176-H180 VanDerWaalsContact NE1-CD2 3.29Å; W176-H180 AromaticContact NE1-NE2 3.04Å; W176-H180 PolarHBondContact NE1-NE2 3.37Å; W176-H180 PolarHBondContact O-CD2 3.17Å; W176-H180 PolarHBondContact O-N 3.01Å; W176-H180 VanDerWaalsContact O-N 3.12Å; M177-H180 PolarHBondContact O-N 3.06Å; H180-D348 CarbonylContact O-C 3.18Å; H180-D348 PolarHBondContact O-N 3.09Å; H180-W349 HydrophobicContact CB-CE3 4.31Å; H180-W349 HydrophobicContact CB-CZ3 4.34Å; H180-E352 HydrophobicContact CB-CB 4.47Å; H180-V357 HydrophobicContact CB-CG2 3.93Å
181	A	92.8	Very high	92.1	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-85	-15.1	-177.2	0	0	0	0	0	112.8	M177 C185 I189 P347 W349 V357	M177-A181 WeakPolarHBondContact O-CB 3.47Å; M177-A181 PolarHBondContact O-N 2.91Å; A181-C185 HydrophobicContact CB-CB 4.08Å; A181-C185 VanDerWaalsContact O-CB 3.27Å; A181-C185 WeakPolarHBondContact O-CB 3.5Å; A181-I189 HydrophobicContact CB-CD1 4.05Å; A181-P347 WeakPolarHBondContact O-CA 3.46Å; A181-P347 WeakPolarHBondContact O-CB 3.38Å; A181-P347 VanDerWaalsContact O-CG 3.29Å; A181-P347 WeakPolarHBondContact O-CG 3.42Å; A181-W349 HydrophobicContact CB-CH2 3.64Å; A181-W349 HydrophobicContact CB-CZ2 4.45Å; A181-W349 HydrophobicContact CB-CZ3 4.13Å; A181-V357 HydrophobicContact CB-CG1 4.36Å
182	G	94.6	Very high	92.5	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	70.1	169.9	-169.2	0	0	0	0	0	112.3	T178 G184 S186 N344	T178-G182 CarbonylContact O-C 3.59Å; T178-G182 WeakPolarHBondContact O-CA 3.26Å; T178-G182 PolarHBondContact O-N 2.91Å; G182-G184 PolarHBondContact O-N 3.13Å; G182-S186 WeakPolarHBondContact O-CB 3.43Å; G182-S186 PolarHBondContact O-N 3.38Å; G182-S186 PolarHBondContact O-OG 3.47Å; G182-N344 CarbonylContact C-O 3.49Å; G182-N344 WeakPolarHBondContact CA-O 3.49Å
183	I	95.4	Very high	93	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	12%	0.117	C	C	.	.	H	α-helix	trans	-59	-48	-178	-58.8	172	0	0	0	110.6	T178 S186 I187 F341 N344 F345 V404 I405	T178-I183 HydrophobicContact CG2-CG1 4.12Å; I183-S186 PolarHBondContact O-N 3Å; I183-I187 HydrophobicContact CG2-CD1 3.9Å; I183-I187 VanDerWaalsContact O-CG1 3.3Å; I183-I187 WeakPolarHBondContact O-CG1 3.48Å; I183-I187 PolarHBondContact O-N 3.13Å; I183-F341 HydrophobicContact CD1-CD2 3.53Å; I183-F341 HydrophobicContact CD1-CE2 3.67Å; I183-F341 HydrophobicContact CD1-CG 4.27Å; I183-F341 HydrophobicContact CD1-CZ 4.48Å; I183-F341 HydrophobicContact CG2-CE2 4.47Å; I183-N344 HydrophobicContact CD1-CB 4.32Å; I183-N344 HydrophobicContact CG1-CB 4.42Å; I183-N344 PolarHBondContact N-O 3.2Å; I183-F345 HydrophobicContact CB-CD2 4.33Å; I183-F345 PolarHBondContact N-O 2.84Å; I183-V404 HydrophobicContact CG2-CG1 4.24Å; I183-I405 HydrophobicContact CG2-CG1 4.14Å
184	G	93.7	Very high	93.3	Very high	26 Å²	26	18.5 Å²	18.5	27%	0.268	11%	0.109	S	C	.	.	H	α-helix	trans	-62.8	-53.6	-175.3	0	0	0	0	0	113.3	G182 S186 I187 L188 F345	G182-G184 PolarHBondContact O-N 3.13Å; G184-S186 VanDerWaalsContact C-N 3.34Å; G184-I187 PolarHBondContact O-N 3.36Å; G184-L188 PolarHBondContact O-N 2.95Å; G184-L188 VanDerWaalsContact O-N 3.12Å; G184-F345 PolarHBondContact N-O 3.1Å; G184-F345 VanDerWaalsContact N-O 3.12Å
185	C	94.4	Very high	93.5	Very high	30 Å²	30	20.9 Å²	20.9	20%	0.203	13%	0.128	C	C	.	.	H	α-helix	trans	-74.2	-25.2	180	-64.3	0	0	0	0	112.7	A181 L188 I189 P347	A181-C185 HydrophobicContact CB-CB 4.08Å; A181-C185 VanDerWaalsContact O-CB 3.27Å; A181-C185 WeakPolarHBondContact O-CB 3.5Å; C185-L188 WeakPolarHBondContact O-CB 3.42Å; C185-L188 PolarHBondContact O-N 3.45Å; C185-I189 WeakPolarHBondContact O-CG1 3.3Å; C185-I189 PolarHBondContact O-N 3.13Å; C185-P347 HydrophobicContact CB-CG 4.14Å; C185-P347 VanDerWaalsContact SG-CG 3.5Å
186	S	95.4	Very high	93.7	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-64.3	-44.2	171.4	-69	0	0	0	0	111.8	M177 T178 G182 I183 G184 L188 I189 V190	M177-S186 PolarHBondContact O-OG 3.12Å; T178-S186 WeakPolarHBondContact CA-OG 3.47Å; G182-S186 WeakPolarHBondContact O-CB 3.43Å; G182-S186 PolarHBondContact O-N 3.38Å; G182-S186 PolarHBondContact O-OG 3.47Å; I183-S186 PolarHBondContact O-N 3Å; G184-S186 VanDerWaalsContact C-N 3.34Å; S186-L188 VanDerWaalsContact C-N 3.28Å; S186-L188 PolarHBondContact O-N 2.67Å; S186-I189 PolarHBondContact O-N 3.24Å; S186-V190 WeakPolarHBondContact O-CG2 3.38Å; S186-V190 PolarHBondContact O-N 3.33Å
187	I	95.8	Very high	93.8	Very high	46 Å²	46	20.7 Å²	20.7	24%	0.236	13%	0.129	C	C	.	.	H	α-helix	trans	-59.8	-41.9	172	-68.6	166.9	0	0	0	110.2	I183 G184 I189 V190 L191 V404 I405	I183-I187 HydrophobicContact CG2-CD1 3.9Å; I183-I187 VanDerWaalsContact O-CG1 3.3Å; I183-I187 WeakPolarHBondContact O-CG1 3.48Å; I183-I187 PolarHBondContact O-N 3.13Å; G184-I187 PolarHBondContact O-N 3.36Å; I187-I189 PolarHBondContact O-N 3.42Å; I187-V190 PolarHBondContact O-N 3.45Å; I187-L191 HydrophobicContact CG2-CD1 3.89Å; I187-L191 HydrophobicContact CG2-CG 4.23Å; I187-L191 WeakPolarHBondContact O-CB 3.48Å; I187-L191 VanDerWaalsContact O-CG 3.28Å; I187-L191 WeakPolarHBondContact O-CG 3.31Å; I187-L191 PolarHBondContact O-N 3.01Å; I187-V404 HydrophobicContact CG1-CG1 4.16Å; I187-I405 HydrophobicContact CD1-CD1 4.1Å; I187-I405 HydrophobicContact CD1-CG1 3.88Å
188	L	94.6	Very high	94	Very high	84 Å²	84	23 Å²	23	44%	0.44	14%	0.144	S	C	.	.	H	α-helix	trans	-61.1	-42.4	175.6	-174.5	65.2	0	0	0	112.4	G184 C185 S186 L191 C192 F354	G184-L188 PolarHBondContact O-N 2.95Å; G184-L188 VanDerWaalsContact O-N 3.12Å; C185-L188 WeakPolarHBondContact O-CB 3.42Å; C185-L188 PolarHBondContact O-N 3.45Å; S186-L188 VanDerWaalsContact C-N 3.28Å; S186-L188 PolarHBondContact O-N 2.67Å; L188-L191 PolarHBondContact O-N 2.93Å; L188-C192 WeakPolarHBondContact O-CB 3.46Å; L188-C192 PolarHBondContact O-N 3.12Å; L188-C192 PolarHBondContact O-SG 2.83Å; L188-F354 HydrophobicContact CD2-CE2 4.26Å; L188-F354 HydrophobicContact CD2-CZ 4.5Å
189	I	94.2	Very high	94.2	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.5	-45.2	175.5	-73.6	168.6	0	0	0	110.8	M177 A181 C185 S186 I187 S193 F354 V357 F358 F361	M177-I189 HydrophobicContact SD-CB 4.49Å; M177-I189 HydrophobicContact SD-CG2 3.94Å; A181-I189 HydrophobicContact CB-CD1 4.05Å; C185-I189 WeakPolarHBondContact O-CG1 3.3Å; C185-I189 PolarHBondContact O-N 3.13Å; S186-I189 PolarHBondContact O-N 3.24Å; I187-I189 PolarHBondContact O-N 3.42Å; I189-S193 WeakPolarHBondContact O-CB 3.33Å; I189-S193 PolarHBondContact O-N 2.99Å; I189-S193 PolarHBondContact O-OG 2.7Å; I189-F354 HydrophobicContact CD1-CD2 4.23Å; I189-F354 HydrophobicContact CD1-CE2 4.06Å; I189-F354 HydrophobicContact CG1-CD2 4.17Å; I189-F354 HydrophobicContact CG1-CE2 3.51Å; I189-F354 HydrophobicContact CG1-CZ 3.75Å; I189-V357 HydrophobicContact CD1-CB 4.27Å; I189-V357 HydrophobicContact CD1-CG1 3.84Å; I189-F358 HydrophobicContact CG2-CD2 4.03Å; I189-F361 HydrophobicContact CG2-CB 4.11Å; I189-F361 HydrophobicContact CG2-CD1 3.64Å; I189-F361 HydrophobicContact CG2-CE1 4.35Å; I189-F361 HydrophobicContact CG2-CG 4.01Å
190	V	94.6	Very high	94.4	Very high	3 Å²	3	24.5 Å²	24.5	2%	0.018	15%	0.151	C	C	.	.	H	α-helix	trans	-61.4	-45.9	176.4	173.6	0	0	0	0	110.4	M177 S186 I187 S193 S194 F361	M177-V190 HydrophobicContact CE-CG2 4.11Å; S186-V190 WeakPolarHBondContact O-CG2 3.38Å; S186-V190 PolarHBondContact O-N 3.33Å; I187-V190 PolarHBondContact O-N 3.45Å; V190-S193 PolarHBondContact O-N 2.72Å; V190-S194 VanDerWaalsContact O-CB 3.24Å; V190-S194 WeakPolarHBondContact O-CB 3.31Å; V190-S194 PolarHBondContact O-N 3.36Å; V190-S194 PolarHBondContact O-OG 3.35Å; V190-F361 HydrophobicContact CB-CZ 4.49Å; V190-F361 HydrophobicContact CG2-CE1 4.25Å; V190-F361 HydrophobicContact CG2-CE2 4.25Å; V190-F361 HydrophobicContact CG2-CZ 3.8Å
191	L	94.1	Very high	94.5	Very high	102 Å²	102	24 Å²	24	53%	0.534	15%	0.149	S	C	.	.	H	α-helix	trans	-66.6	-44.5	-180	-71.2	176	0	0	0	112.5	I187 L188 S194 A195	I187-L191 HydrophobicContact CG2-CD1 3.89Å; I187-L191 HydrophobicContact CG2-CG 4.23Å; I187-L191 WeakPolarHBondContact O-CB 3.48Å; I187-L191 VanDerWaalsContact O-CG 3.28Å; I187-L191 WeakPolarHBondContact O-CG 3.31Å; I187-L191 PolarHBondContact O-N 3.01Å; L188-L191 PolarHBondContact O-N 2.93Å; L191-S194 PolarHBondContact O-N 2.89Å; L191-A195 WeakPolarHBondContact O-CB 3.49Å; L191-A195 PolarHBondContact O-N 3.43Å
192	C	92.3	Very high	94.7	Very high	54 Å²	54	25.9 Å²	25.9	37%	0.365	16%	0.158	S	C	.	.	H	α-helix	trans	-60.4	-45.9	175.9	-74.9	0	0	0	0	111.4	L188 A195 V196 F358	L188-C192 WeakPolarHBondContact O-CB 3.46Å; L188-C192 PolarHBondContact O-N 3.12Å; L188-C192 PolarHBondContact O-SG 2.83Å; C192-A195 WeakPolarHBondContact O-CB 3.02Å; C192-A195 PolarHBondContact O-N 3.07Å; C192-V196 PolarHBondContact O-N 3.35Å; C192-F358 HydrophobicContact CB-CE2 4.47Å
193	S	92.8	Very high	94.7	Very high	0 Å²	0	26 Å²	26	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-64.9	-42.8	177.3	-49.8	0	0	0	0	111.1	I189 V190 A195 V196 S197 F358	I189-S193 WeakPolarHBondContact O-CB 3.33Å; I189-S193 PolarHBondContact O-N 2.99Å; I189-S193 PolarHBondContact O-OG 2.7Å; V190-S193 PolarHBondContact O-N 2.72Å; S193-A195 VanDerWaalsContact C-N 3.3Å; S193-A195 PolarHBondContact O-N 3.26Å; S193-V196 PolarHBondContact O-N 2.99Å; S193-S197 PolarHBondContact O-N 3.39Å; S193-S197 PolarHBondContact O-OG 3.18Å; S193-F358 VanDerWaalsContact OG-CE2 3.23Å; S193-F358 WeakPolarHBondContact OG-CE2 3.47Å
194	S	93.9	Very high	94.6	Very high	14 Å²	14	26 Å²	26	10%	0.098	16%	0.159	C	C	.	.	H	α-helix	trans	-62	-37.1	176.4	-57.5	0	0	0	0	112	V190 L191 S197 V198 S397	V190-S194 VanDerWaalsContact O-CB 3.24Å; V190-S194 WeakPolarHBondContact O-CB 3.31Å; V190-S194 PolarHBondContact O-N 3.36Å; V190-S194 PolarHBondContact O-OG 3.35Å; L191-S194 PolarHBondContact O-N 2.89Å; S194-S197 WeakPolarHBondContact O-CB 3.34Å; S194-S197 PolarHBondContact O-N 3.42Å; S194-V198 WeakPolarHBondContact O-CB 3.38Å; S194-V198 VanDerWaalsContact O-CG2 3.27Å; S194-V198 WeakPolarHBondContact O-CG2 3.24Å; S194-V198 PolarHBondContact O-N 3.26Å; S194-S397 WeakPolarHBondContact CB-OG 3.38Å; S194-S397 PolarHBondContact OG-OG 2.97Å
195	A	94.3	Very high	94.6	Very high	49 Å²	49	24.8 Å²	24.8	41%	0.405	15%	0.147	S	C	.	.	H	α-helix	trans	-62.1	-43.9	176.8	0	0	0	0	0	111.7	L191 C192 S193 V198 I199	L191-A195 WeakPolarHBondContact O-CB 3.49Å; L191-A195 PolarHBondContact O-N 3.43Å; C192-A195 WeakPolarHBondContact O-CB 3.02Å; C192-A195 PolarHBondContact O-N 3.07Å; S193-A195 VanDerWaalsContact C-N 3.3Å; S193-A195 PolarHBondContact O-N 3.26Å; A195-V198 PolarHBondContact O-N 2.99Å; A195-I199 VanDerWaalsContact O-CG1 3.29Å; A195-I199 WeakPolarHBondContact O-CG1 3.29Å; A195-I199 PolarHBondContact O-N 3.49Å
196	V	94.2	Very high	94.5	Very high	9 Å²	9	23.3 Å²	23.3	6%	0.055	14%	0.137	C	C	.	.	H	α-helix	trans	-64	-41.8	175.5	-179.6	0	0	0	0	111.5	C192 S193 T200 Y362 I580	C192-V196 PolarHBondContact O-N 3.35Å; S193-V196 PolarHBondContact O-N 2.99Å; V196-T200 WeakPolarHBondContact O-CB 3.35Å; V196-T200 PolarHBondContact O-N 3.1Å; V196-T200 PolarHBondContact O-OG1 2.88Å; V196-Y362 WeakPolarHBondContact CG1-OH 3.45Å; V196-I580 HydrophobicContact CB-CD1 4.39Å; V196-I580 HydrophobicContact CG1-CD1 4.16Å; V196-I580 HydrophobicContact CG2-CD1 3.71Å
197	S	94.5	Very high	94.2	Very high	3 Å²	3	23.9 Å²	23.9	2%	0.021	14%	0.14	C	C	.	.	H	α-helix	trans	-62.1	-42.7	174.3	-64.8	0	0	0	0	112.7	S193 S194 T200 C201	S193-S197 PolarHBondContact O-N 3.39Å; S193-S197 PolarHBondContact O-OG 3.18Å; S194-S197 WeakPolarHBondContact O-CB 3.34Å; S194-S197 PolarHBondContact O-N 3.42Å; S197-T200 PolarHBondContact O-N 2.83Å; S197-C201 WeakPolarHBondContact O-CB 3.47Å; S197-C201 PolarHBondContact O-N 3.18Å
198	V	96	Very high	93.8	Very high	53 Å²	53	21.7 Å²	21.7	32%	0.321	13%	0.129	S	C	.	.	H	α-helix	trans	-65.1	-48.7	177.6	168.6	0	0	0	0	110.3	S194 A195 T200 C201 L202 I393	S194-V198 WeakPolarHBondContact O-CB 3.38Å; S194-V198 VanDerWaalsContact O-CG2 3.27Å; S194-V198 WeakPolarHBondContact O-CG2 3.24Å; S194-V198 PolarHBondContact O-N 3.26Å; A195-V198 PolarHBondContact O-N 2.99Å; V198-T200 VanDerWaalsContact C-N 3.3Å; V198-T200 PolarHBondContact O-N 3.47Å; V198-C201 CarbonylContact O-C 3.59Å; V198-C201 WeakPolarHBondContact O-CA 3.33Å; V198-C201 WeakPolarHBondContact O-CB 3.37Å; V198-C201 PolarHBondContact O-N 3.46Å; V198-C201 VanDerWaalsContact O-N 3.08Å; V198-L202 HydrophobicContact CG1-CD1 4.09Å; V198-L202 HydrophobicContact CG1-CG 4.22Å; V198-L202 VanDerWaalsContact O-CG 3.31Å; V198-L202 WeakPolarHBondContact O-CG 3.27Å; V198-L202 PolarHBondContact O-N 2.87Å; V198-I393 HydrophobicContact CG2-CG2 3.89Å
199	I	96.1	Very high	93.6	Very high	30 Å²	30	18.6 Å²	18.6	15%	0.154	11%	0.113	C	C	.	.	H	α-helix	trans	-57	-47.5	178	-68.6	165.3	0	0	0	110.4	A195 C201 L202 S203 V569 L576	A195-I199 VanDerWaalsContact O-CG1 3.29Å; A195-I199 WeakPolarHBondContact O-CG1 3.29Å; A195-I199 PolarHBondContact O-N 3.49Å; I199-C201 VanDerWaalsContact C-N 3.31Å; I199-C201 PolarHBondContact O-N 2.89Å; I199-L202 PolarHBondContact O-N 3.41Å; I199-S203 PolarHBondContact O-N 2.86Å; I199-S203 PolarHBondContact O-OG 3.25Å; I199-V569 HydrophobicContact CG1-CG1 4.06Å; I199-V569 HydrophobicContact CG2-CG1 4.07Å; I199-L576 HydrophobicContact CD1-CD1 4.44Å
200	T	95.8	Very high	93.2	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63	-38.5	177.4	-53.9	0	0	0	0	111.8	V196 S197 V198 S203 M204 I368 Y540 N544	V196-T200 WeakPolarHBondContact O-CB 3.35Å; V196-T200 PolarHBondContact O-N 3.1Å; V196-T200 PolarHBondContact O-OG1 2.88Å; S197-T200 PolarHBondContact O-N 2.83Å; V198-T200 VanDerWaalsContact C-N 3.3Å; V198-T200 PolarHBondContact O-N 3.47Å; T200-S203 PolarHBondContact O-N 3.37Å; T200-M204 WeakPolarHBondContact O-CB 3.43Å; T200-M204 PolarHBondContact O-N 3.47Å; T200-I368 HydrophobicContact CG2-CD1 3.85Å; T200-Y540 HydrophobicContact CG2-CD1 4.15Å; T200-Y540 HydrophobicContact CG2-CD2 4.1Å; T200-Y540 HydrophobicContact CG2-CG 3.73Å; T200-N544 WeakPolarHBondContact CA-OD1 3.25Å; T200-N544 PolarHBondContact OG1-ND2 2.88Å
201	C	95.4	Very high	92.5	Very high	0 Å²	0	23 Å²	23	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-65.9	-43.1	175.6	-173.4	0	0	0	0	111.8	S197 V198 I199 S203 M204 C205 T389 L390 I393	S197-C201 WeakPolarHBondContact O-CB 3.47Å; S197-C201 PolarHBondContact O-N 3.18Å; V198-C201 CarbonylContact O-C 3.59Å; V198-C201 WeakPolarHBondContact O-CA 3.33Å; V198-C201 WeakPolarHBondContact O-CB 3.37Å; V198-C201 PolarHBondContact O-N 3.46Å; V198-C201 VanDerWaalsContact O-N 3.08Å; I199-C201 VanDerWaalsContact C-N 3.31Å; I199-C201 PolarHBondContact O-N 2.89Å; C201-S203 VanDerWaalsContact C-N 3.31Å; C201-S203 PolarHBondContact O-N 3.27Å; C201-M204 CarbonylContact O-C 3.57Å; C201-M204 WeakPolarHBondContact O-CB 3.42Å; C201-M204 PolarHBondContact O-N 2.86Å; C201-C205 WeakPolarHBondContact O-CB 3.46Å; C201-C205 PolarHBondContact O-N 3.48Å; C201-C205 PolarHBondContact O-SG 2.93Å; C201-T389 HydrophobicContact CB-CG2 4.33Å; C201-T389 WeakPolarHBondContact SG-CG2 3.06Å; C201-L390 HydrophobicContact CB-CD2 4.09Å; C201-L390 VanDerWaalsContact SG-CD2 3.57Å; C201-I393 HydrophobicContact CB-CD1 3.73Å
202	L	95.9	Very high	91.7	Very high	39 Å²	39	24.5 Å²	24.5	20%	0.204	15%	0.154	C	C	.	.	H	α-helix	trans	-60.3	-42.4	176.2	-65.9	174.6	0	0	0	111.1	V198 I199 C205 A206 L390 F562	V198-L202 HydrophobicContact CG1-CD1 4.09Å; V198-L202 HydrophobicContact CG1-CG 4.22Å; V198-L202 VanDerWaalsContact O-CG 3.31Å; V198-L202 WeakPolarHBondContact O-CG 3.27Å; V198-L202 PolarHBondContact O-N 2.87Å; I199-L202 PolarHBondContact O-N 3.41Å; L202-C205 WeakPolarHBondContact O-CB 3.32Å; L202-C205 PolarHBondContact O-N 3.47Å; L202-A206 PolarHBondContact O-N 3.01Å; L202-L390 HydrophobicContact CD2-CD2 4.27Å; L202-F562 HydrophobicContact CD2-CE1 3.7Å; L202-F562 HydrophobicContact CD2-CZ 3.68Å
203	S	95.7	Very high	91	Very high	4 Å²	4	22.6 Å²	22.6	3%	0.028	14%	0.14	C	C	.	.	H	α-helix	trans	-62.8	-46.9	173.5	-61.8	0	0	0	0	111.6	I199 T200 C201 C205 A206 I207 N544 V547	I199-S203 PolarHBondContact O-N 2.86Å; I199-S203 PolarHBondContact O-OG 3.25Å; T200-S203 PolarHBondContact O-N 3.37Å; C201-S203 VanDerWaalsContact C-N 3.31Å; C201-S203 PolarHBondContact O-N 3.27Å; S203-C205 VanDerWaalsContact C-N 3.26Å; S203-C205 PolarHBondContact O-N 3.05Å; S203-A206 WeakPolarHBondContact O-CB 3.26Å; S203-A206 PolarHBondContact O-N 3.42Å; S203-A206 VanDerWaalsContact O-N 3.12Å; S203-I207 PolarHBondContact O-N 3.47Å; S203-I207 VanDerWaalsContact O-N 3.16Å; S203-N544 WeakPolarHBondContact CB-OD1 3.35Å; S203-N544 PolarHBondContact OG-OD1 2.88Å; S203-V547 VanDerWaalsContact O-CG2 3.22Å; S203-V547 WeakPolarHBondContact O-CG2 3.47Å
204	M	93.2	Very high	90.4	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-56.6	-42.1	174.3	-177.6	-179.9	-69.8	0	0	111.5	T200 C201 A206 I207 C208 M221 M369 A372 I385 I543	T200-M204 WeakPolarHBondContact O-CB 3.43Å; T200-M204 PolarHBondContact O-N 3.47Å; C201-M204 CarbonylContact O-C 3.57Å; C201-M204 WeakPolarHBondContact O-CB 3.42Å; C201-M204 PolarHBondContact O-N 2.86Å; M204-A206 VanDerWaalsContact C-N 3.33Å; M204-A206 PolarHBondContact O-N 3.06Å; M204-I207 PolarHBondContact O-N 3.28Å; M204-C208 WeakPolarHBondContact O-CB 3.39Å; M204-C208 PolarHBondContact O-N 3.03Å; M204-M221 HydrophobicContact CE-CE 3.97Å; M204-M221 HydrophobicContact CG-CE 3.7Å; M204-M221 HydrophobicContact CG-SD 3.78Å; M204-M221 HydrophobicContact SD-CE 4.05Å; M204-M369 HydrophobicContact CE-CB 4.44Å; M204-M369 HydrophobicContact CE-CE 4.27Å; M204-M369 HydrophobicContact CE-CG 3.69Å; M204-M369 HydrophobicContact CE-SD 3.66Å; M204-A372 HydrophobicContact CE-CB 4.15Å; M204-A372 HydrophobicContact SD-CB 3.64Å; M204-I385 HydrophobicContact CG-CG2 4.21Å; M204-I385 HydrophobicContact SD-CG2 3.86Å; M204-I543 HydrophobicContact CB-CG2 4.26Å; M204-I543 HydrophobicContact CE-CD1 3.71Å
205	C	92.9	Very high	89.5	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.7	-37.4	177.6	-66.5	0	0	0	0	112.7	C201 L202 S203 C208 T209 P386 F562	C201-C205 WeakPolarHBondContact O-CB 3.46Å; C201-C205 PolarHBondContact O-N 3.48Å; C201-C205 PolarHBondContact O-SG 2.93Å; L202-C205 WeakPolarHBondContact O-CB 3.32Å; L202-C205 PolarHBondContact O-N 3.47Å; S203-C205 VanDerWaalsContact C-N 3.26Å; S203-C205 PolarHBondContact O-N 3.05Å; C205-C208 VanDerWaalsContact CA-SG 3.52Å; C205-C208 PolarHBondContact O-SG 2.96Å; C205-T209 WeakPolarHBondContact O-CG2 3.35Å; C205-T209 PolarHBondContact O-N 3.15Å; C205-T209 PolarHBondContact O-OG1 3.41Å; C205-P386 HydrophobicContact CB-CB 4.24Å; C205-P386 HydrophobicContact CB-CG 4.06Å; C205-P386 WeakPolarHBondContact SG-CA 3.43Å; C205-P386 WeakPolarHBondContact SG-CB 3.39Å; C205-F562 HydrophobicContact CB-CB 4.4Å; C205-F562 HydrophobicContact CB-CD1 3.61Å; C205-F562 HydrophobicContact CB-CD2 3.98Å; C205-F562 HydrophobicContact CB-CE1 3.72Å; C205-F562 HydrophobicContact CB-CE2 4.08Å; C205-F562 HydrophobicContact CB-CG 3.74Å; C205-F562 HydrophobicContact CB-CZ 3.95Å
206	A	92.2	Very high	88.7	Confident	0 Å²	0	27 Å²	27	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-64.5	-48	176.6	0	0	0	0	0	111.4	L202 S203 M204 T209 N210 V547 P560 Y565	L202-A206 PolarHBondContact O-N 3.01Å; S203-A206 WeakPolarHBondContact O-CB 3.26Å; S203-A206 PolarHBondContact O-N 3.42Å; S203-A206 VanDerWaalsContact O-N 3.12Å; M204-A206 VanDerWaalsContact C-N 3.33Å; M204-A206 PolarHBondContact O-N 3.06Å; A206-T209 PolarHBondContact O-N 2.94Å; A206-T209 PolarHBondContact O-OG1 2.85Å; A206-N210 PolarHBondContact O-N 2.87Å; A206-V547 HydrophobicContact CB-CG1 4.22Å; A206-V547 HydrophobicContact CB-CG2 4.16Å; A206-P560 HydrophobicContact CB-CB 4.32Å; A206-P560 HydrophobicContact CB-CG 4.27Å; A206-P560 WeakPolarHBondContact O-CB 3.47Å; A206-Y565 HydrophobicContact CB-CD1 3.85Å; A206-Y565 HydrophobicContact CB-CD2 3.97Å; A206-Y565 HydrophobicContact CB-CE1 4.48Å; A206-Y565 HydrophobicContact CB-CG 3.57Å
207	I	90	Very high	88.1	Confident	11 Å²	11	26.6 Å²	26.6	6%	0.056	16%	0.155	C	C	.	.	H	α-helix	trans	-66	-42.8	178.2	-53.5	177.7	0	0	0	110.7	S203 M204 T209 N210 M221 I543 A546 V547	S203-I207 PolarHBondContact O-N 3.47Å; S203-I207 VanDerWaalsContact O-N 3.16Å; M204-I207 PolarHBondContact O-N 3.28Å; I207-T209 PolarHBondContact O-N 2.9Å; I207-N210 WeakPolarHBondContact O-CB 3.42Å; I207-N210 PolarHBondContact O-N 3.17Å; I207-M221 HydrophobicContact CB-CB 4.44Å; I207-M221 HydrophobicContact CB-CG 4.45Å; I207-M221 HydrophobicContact CB-SD 4.45Å; I207-M221 HydrophobicContact CD1-CB 4.47Å; I207-M221 HydrophobicContact CG2-CB 3.74Å; I207-M221 HydrophobicContact CG2-CG 3.88Å; I207-I543 HydrophobicContact CD1-CG2 4.21Å; I207-A546 HydrophobicContact CD1-CB 3.99Å; I207-V547 HydrophobicContact CD1-CG2 3.77Å; I207-V547 HydrophobicContact CG1-CG2 3.41Å; I207-V547 VanDerWaalsContact CG1-CG2 3.41Å
208	C	88.4	Confident	87.6	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-66.6	-23	-174.9	92.3	0	0	0	0	112.8	M204 C205 I213 M221 A382 I385	M204-C208 WeakPolarHBondContact O-CB 3.39Å; M204-C208 PolarHBondContact O-N 3.03Å; C205-C208 VanDerWaalsContact CA-SG 3.52Å; C205-C208 PolarHBondContact O-SG 2.96Å; C208-I213 HydrophobicContact CB-CD1 3.19Å; C208-I213 HydrophobicContact CB-CG1 4.32Å; C208-I213 WeakPolarHBondContact O-CD1 3.4Å; C208-M221 HydrophobicContact CB-SD 4.16Å; C208-A382 WeakPolarHBondContact O-CA 3.35Å; C208-A382 VanDerWaalsContact O-CB 3.27Å; C208-A382 WeakPolarHBondContact O-CB 3.38Å; C208-I385 HydrophobicContact CB-CD1 4.38Å
209	T	89.3	Confident	87.3	Confident	19 Å²	19	24 Å²	24	12%	0.117	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	3.5	174.8	58.3	0	0	0	0	113.6	C205 A206 I207 G211 A382 S561 F562	C205-T209 WeakPolarHBondContact O-CG2 3.35Å; C205-T209 PolarHBondContact O-N 3.15Å; C205-T209 PolarHBondContact O-OG1 3.41Å; A206-T209 PolarHBondContact O-N 2.94Å; A206-T209 PolarHBondContact O-OG1 2.85Å; I207-T209 PolarHBondContact O-N 2.9Å; T209-G211 PolarHBondContact O-N 3.24Å; T209-A382 HydrophobicContact CG2-CB 4.39Å; T209-A382 WeakPolarHBondContact CG2-O 3.38Å; T209-S561 PolarHBondContact O-N 3.04Å; T209-S561 PolarHBondContact OG1-N 3.38Å; T209-F562 HydrophobicContact CG2-CB 3.96Å; T209-F562 VanDerWaalsContact OG1-CB 3.28Å; T209-F562 WeakPolarHBondContact OG1-CB 3.38Å; T209-F562 PolarHBondContact OG1-N 3.45Å
210	N	86.6	Confident	86.8	Confident	42 Å²	42	23.7 Å²	23.7	23%	0.225	14%	0.137	C	C	.	.	S	Bend	trans	-98.1	60.6	176.2	-171.3	49.3	0	0	0	111.6	A206 I207 G557 F558 R559 P560	A206-N210 PolarHBondContact O-N 2.87Å; I207-N210 WeakPolarHBondContact O-CB 3.42Å; I207-N210 PolarHBondContact O-N 3.17Å; N210-G557 PolarHBondContact ND2-O 2.98Å; N210-G557 PolarHBondContact OD1-O 3.2Å; N210-G557 VanDerWaalsContact OD1-O 3.06Å; N210-F558 HydrophobicContact CB-CD2 4.36Å; N210-F558 HydrophobicContact CB-CE2 4.36Å; N210-F558 WeakPolarHBondContact ND2-CD2 3.33Å; N210-F558 WeakPolarHBondContact OD1-CA 3.21Å; N210-R559 PolarHBondContact OD1-N 2.87Å; N210-P560 HydrophobicContact CB-CG 4.37Å
211	G	78.9	Confident	86.4	Confident	54 Å²	54	23.9 Å²	23.9	56%	0.557	14%	0.138	S	C	*	.	S	Bend	trans	109.5	-168.2	-179.6	0	0	0	0	0	114	T209	T209-G211 PolarHBondContact O-N 3.24Å
212	E	77.4	Confident	86.1	Confident	134 Å²	134	23.9 Å²	23.9	63%	0.626	14%	0.138	S	C	*	.			trans	-87	124	-179.4	-168.2	-173	-173.7	0	0	110.9	F220	E212-F220 WeakPolarHBondContact O-CE1 3.35Å
213	I	78.3	Confident	85.7	Confident	13 Å²	13	22 Å²	22	7%	0.067	13%	0.128	C	C	.	.			trans	-91.5	126.6	174.5	-49.7	170	0	0	0	109.8	C208 F220 P381 I385	C208-I213 HydrophobicContact CB-CD1 3.19Å; C208-I213 HydrophobicContact CB-CG1 4.32Å; C208-I213 WeakPolarHBondContact O-CD1 3.4Å; I213-F220 HydrophobicContact CG2-CD1 3.96Å; I213-F220 HydrophobicContact CG2-CE1 4.45Å; I213-P381 HydrophobicContact CB-CB 4.03Å; I213-P381 HydrophobicContact CB-CG 4.49Å; I213-P381 HydrophobicContact CD1-CB 3.93Å; I213-P381 HydrophobicContact CG1-CB 4.48Å; I213-I385 HydrophobicContact CD1-CD1 3.87Å
214	K	80.7	Confident	85.3	Confident	121 Å²	121	25.3 Å²	25.3	53%	0.526	14%	0.14	S	C	.	.			trans	-101.6	-175.4	173.3	-61.1	-175.4	179.2	176.9	0	110.8	F220 S375	K214-F220 HydrophobicContact CB-CD2 4.17Å; K214-F220 HydrophobicContact CB-CE2 3.76Å; K214-F220 HydrophobicContact CB-CZ 4Å; K214-F220 HydrophobicContact CD-CE2 4.45Å; K214-F220 HydrophobicContact CG-CE2 4.24Å; K214-F220 HydrophobicContact CG-CZ 4.13Å; K214-S375 PolarHBondContact O-OG 3.41Å; K214-S375 VanDerWaalsContact O-OG 3.12Å
215	G	75	Confident	84.9	Confident	34 Å²	34	25.9 Å²	25.9	35%	0.351	14%	0.144	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.3	145.4	176.8	0	0	0	0	0	112.5	G376 A482	G215-G376 VanDerWaalsContact CA-CA 3.47Å; G215-A482 WeakPolarHBondContact O-CB 3.44Å
216	G	77.1	Confident	84.6	Confident	1 Å²	1	26.4 Å²	26.4	1%	0.01	15%	0.147	C	C	.	.	T	Hydrogen-bonded Turn	trans	111.8	-0.3	-179.8	0	0	0	0	0	114.9	A218 Y219 F220 L479 A482	G216-A218 PolarHBondContact O-N 3.14Å; G216-A218 VanDerWaalsContact O-N 3.09Å; G216-Y219 WeakPolarHBondContact O-CB 3.47Å; G216-Y219 PolarHBondContact O-N 2.88Å; G216-F220 PolarHBondContact O-N 2.86Å; G216-L479 WeakPolarHBondContact O-CD1 3.44Å; G216-A482 VanDerWaalsContact CA-CB 3.48Å
217	G	81.7	Confident	84.4	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	46.4	-117.3	167.4	0	0	0	0	0	114.5	Y219 F220 M221 A372 S375	G217-Y219 PolarHBondContact O-N 3.47Å; G217-F220 PolarHBondContact O-N 3.4Å; G217-F220 VanDerWaalsContact O-N 3.14Å; G217-M221 WeakPolarHBondContact O-CG 3.48Å; G217-M221 PolarHBondContact O-N 3.16Å; G217-A372 WeakPolarHBondContact CA-O 3.29Å; G217-S375 WeakPolarHBondContact CA-OG 3.37Å; G217-S375 PolarHBondContact N-OG 3.19Å; G217-S375 VanDerWaalsContact N-OG 3.1Å
218	A	82.6	Confident	84.3	Confident	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-58	-42.9	-178.7	0	0	0	0	0	113.7	G216 F220 M221 I222 F238 M369 I543	G216-A218 PolarHBondContact O-N 3.14Å; G216-A218 VanDerWaalsContact O-N 3.09Å; A218-F220 VanDerWaalsContact C-N 3.32Å; A218-F220 PolarHBondContact O-N 3.16Å; A218-M221 PolarHBondContact O-N 2.8Å; A218-I222 WeakPolarHBondContact O-CB 3.44Å; A218-I222 VanDerWaalsContact O-CG1 3.24Å; A218-I222 WeakPolarHBondContact O-CG1 3.4Å; A218-I222 PolarHBondContact O-N 3.43Å; A218-F238 HydrophobicContact CB-CD1 4.1Å; A218-F238 HydrophobicContact CB-CE1 3.83Å; A218-M369 HydrophobicContact CB-CE 4.12Å; A218-M369 HydrophobicContact CB-SD 3.41Å; A218-M369 WeakPolarHBondContact CB-SD 3.32Å; A218-I543 HydrophobicContact CB-CD1 4.22Å
219	Y	89.7	Confident	84.3	Confident	1 Å²	1	28.9 Å²	28.9	0%	0.004	16%	0.161	C	C	.	.	H	α-helix	trans	-57.1	-47.8	174.4	158.2	-105.3	0	0	0	111	G216 G217 S223 G231 A482 L483 D486 L488	G216-Y219 WeakPolarHBondContact O-CB 3.47Å; G216-Y219 PolarHBondContact O-N 2.88Å; G217-Y219 PolarHBondContact O-N 3.47Å; Y219-S223 WeakPolarHBondContact O-CB 3.33Å; Y219-S223 PolarHBondContact O-N 3.36Å; Y219-S223 PolarHBondContact O-OG 2.99Å; Y219-G231 WeakPolarHBondContact CD2-O 3.28Å; Y219-A482 HydrophobicContact CD1-CB 3.84Å; Y219-A482 HydrophobicContact CE1-CB 4.01Å; Y219-L483 HydrophobicContact CD1-CD2 4.49Å; Y219-L483 HydrophobicContact CD1-CG 4.3Å; Y219-L483 HydrophobicContact CD2-CD2 3.5Å; Y219-L483 VanDerWaalsContact CD2-CD2 3.5Å; Y219-L483 HydrophobicContact CD2-CG 4.06Å; Y219-L483 HydrophobicContact CE1-CD2 4.29Å; Y219-L483 HydrophobicContact CE1-CG 4.29Å; Y219-L483 HydrophobicContact CE2-CD2 3.24Å; Y219-L483 HydrophobicContact CE2-CG 4.06Å; Y219-L483 HydrophobicContact CG-CD2 4.13Å; Y219-L483 HydrophobicContact CG-CG 4.18Å; Y219-D486 VanDerWaalsContact CE1-OD2 3.26Å; Y219-D486 WeakPolarHBondContact CE1-OD2 3.45Å; Y219-D486 VanDerWaalsContact CZ-OD2 3.3Å; Y219-D486 WeakPolarHBondContact OH-CB 3.3Å; Y219-D486 VanDerWaalsContact OH-CG 3.31Å; Y219-D486 PolarHBondContact OH-OD2 3.43Å; Y219-L488 HydrophobicContact CE2-CD1 3.87Å; Y219-L488 WeakPolarHBondContact OH-CD1 3.31Å
220	F	87	Confident	84.3	Confident	25 Å²	25	31.3 Å²	31.3	11%	0.11	17%	0.17	C	C	.	.	H	α-helix	trans	-64.4	-46.5	180	-173.6	-88.3	0	0	0	110.7	E212 I213 K214 G216 G217 A218 I222 S223 R224	E212-F220 WeakPolarHBondContact O-CE1 3.35Å; I213-F220 HydrophobicContact CG2-CD1 3.96Å; I213-F220 HydrophobicContact CG2-CE1 4.45Å; K214-F220 HydrophobicContact CB-CD2 4.17Å; K214-F220 HydrophobicContact CB-CE2 3.76Å; K214-F220 HydrophobicContact CB-CZ 4Å; K214-F220 HydrophobicContact CD-CE2 4.45Å; K214-F220 HydrophobicContact CG-CE2 4.24Å; K214-F220 HydrophobicContact CG-CZ 4.13Å; G216-F220 PolarHBondContact O-N 2.86Å; G217-F220 PolarHBondContact O-N 3.4Å; G217-F220 VanDerWaalsContact O-N 3.14Å; A218-F220 VanDerWaalsContact C-N 3.32Å; A218-F220 PolarHBondContact O-N 3.16Å; F220-I222 PolarHBondContact O-N 3.06Å; F220-S223 PolarHBondContact O-N 3.27Å; F220-S223 PolarHBondContact O-OG 3.4Å; F220-S223 VanDerWaalsContact O-OG 3.08Å; F220-R224 HydrophobicContact CD1-CG 4.23Å; F220-R224 HydrophobicContact CD2-CG 4.46Å; F220-R224 HydrophobicContact CE1-CG 3.94Å; F220-R224 HydrophobicContact CE2-CG 4.18Å; F220-R224 HydrophobicContact CG-CG 4.49Å; F220-R224 HydrophobicContact CZ-CG 3.92Å; F220-R224 VanDerWaalsContact O-CG 3.27Å; F220-R224 WeakPolarHBondContact O-CG 3.4Å; F220-R224 PolarHBondContact O-N 3.23Å; F220-R224 VanDerWaalsContact O-N 3.14Å
221	M	86.8	Confident	84.4	Confident	3 Å²	3	29.3 Å²	29.3	2%	0.015	16%	0.159	C	C	.	.	H	α-helix	trans	-60.1	-44.8	179.4	-73.7	-175	-69.6	0	0	112.7	M204 I207 C208 G217 A218 S225 A372 I543	M204-M221 HydrophobicContact CE-CE 3.97Å; M204-M221 HydrophobicContact CG-CE 3.7Å; M204-M221 HydrophobicContact CG-SD 3.78Å; M204-M221 HydrophobicContact SD-CE 4.05Å; I207-M221 HydrophobicContact CB-CB 4.44Å; I207-M221 HydrophobicContact CB-CG 4.45Å; I207-M221 HydrophobicContact CB-SD 4.45Å; I207-M221 HydrophobicContact CD1-CB 4.47Å; I207-M221 HydrophobicContact CG2-CB 3.74Å; I207-M221 HydrophobicContact CG2-CG 3.88Å; C208-M221 HydrophobicContact CB-SD 4.16Å; G217-M221 WeakPolarHBondContact O-CG 3.48Å; G217-M221 PolarHBondContact O-N 3.16Å; A218-M221 PolarHBondContact O-N 2.8Å; M221-S225 WeakPolarHBondContact O-CB 3.36Å; M221-S225 PolarHBondContact O-N 3.27Å; M221-S225 PolarHBondContact O-OG 2.93Å; M221-A372 HydrophobicContact CE-CB 4.11Å; M221-I543 HydrophobicContact CE-CD1 4.42Å
222	I	88.4	Confident	84.9	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-71.8	-45.2	-179.7	-63.8	166.9	0	0	0	110.5	A218 F220 R224 S225 L226 F230 I234 L542 I543	A218-I222 WeakPolarHBondContact O-CB 3.44Å; A218-I222 VanDerWaalsContact O-CG1 3.24Å; A218-I222 WeakPolarHBondContact O-CG1 3.4Å; A218-I222 PolarHBondContact O-N 3.43Å; F220-I222 PolarHBondContact O-N 3.06Å; I222-R224 VanDerWaalsContact C-N 3.3Å; I222-R224 PolarHBondContact O-N 3.3Å; I222-S225 PolarHBondContact O-N 3.01Å; I222-S225 VanDerWaalsContact O-N 3.09Å; I222-L226 HydrophobicContact CG2-CD1 4.16Å; I222-L226 PolarHBondContact O-N 2.84Å; I222-F230 HydrophobicContact CG2-CB 4.26Å; I222-I234 HydrophobicContact CB-CG2 4.41Å; I222-I234 HydrophobicContact CD1-CG2 3.64Å; I222-I234 HydrophobicContact CG2-CG2 4.15Å; I222-L542 HydrophobicContact CD1-CB 4.04Å; I222-I543 HydrophobicContact CD1-CG1 3.91Å; I222-I543 HydrophobicContact CG1-CG1 3.89Å
223	S	88.7	Confident	85.6	Confident	0 Å²	0	20.4 Å²	20.4	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-62.8	-35.4	-176.2	65.3	0	0	0	0	113.3	Y219 F220 G227	Y219-S223 WeakPolarHBondContact O-CB 3.33Å; Y219-S223 PolarHBondContact O-N 3.36Å; Y219-S223 PolarHBondContact O-OG 2.99Å; F220-S223 PolarHBondContact O-N 3.27Å; F220-S223 PolarHBondContact O-OG 3.4Å; F220-S223 VanDerWaalsContact O-OG 3.08Å; S223-G227 WeakPolarHBondContact CA-O 3.35Å; S223-G227 CarbonylContact O-C 3.43Å; S223-G227 WeakPolarHBondContact O-CA 3.3Å; S223-G227 PolarHBondContact O-N 3.13Å; S223-G227 VanDerWaalsContact O-N 3.14Å
224	R	86.1	Confident	86.2	Confident	73 Å²	73	19.8 Å²	19.8	28%	0.275	10%	0.1	S	C	.	.	H	α-helix	trans	-82.5	-12	177	-53.7	-53.9	151.6	144.8	-1.4	114.3	F220 I222 D486 W612	F220-R224 HydrophobicContact CD1-CG 4.23Å; F220-R224 HydrophobicContact CD2-CG 4.46Å; F220-R224 HydrophobicContact CE1-CG 3.94Å; F220-R224 HydrophobicContact CE2-CG 4.18Å; F220-R224 HydrophobicContact CG-CG 4.49Å; F220-R224 HydrophobicContact CZ-CG 3.92Å; F220-R224 VanDerWaalsContact O-CG 3.27Å; F220-R224 WeakPolarHBondContact O-CG 3.4Å; F220-R224 PolarHBondContact O-N 3.23Å; F220-R224 VanDerWaalsContact O-N 3.14Å; I222-R224 VanDerWaalsContact C-N 3.3Å; I222-R224 PolarHBondContact O-N 3.3Å; R224-D486 IonicContact NH2-OD1 2.81Å; R224-D486 PolarHBondContact NH2-OD1 3.13Å; R224-D486 IonicContact NH2-OD2 3.11Å; R224-D486 PolarHBondContact NH2-OD2 3.47Å; R224-W612 VanDerWaalsContact CZ-CZ2 3.46Å; R224-W612 VanDerWaalsContact NH2-CE2 3.27Å
225	S	85.2	Confident	86.7	Confident	13 Å²	13	14 Å²	14	9%	0.091	8%	0.075	C	C	.	.	H	α-helix	trans	-100.6	-53.3	179.4	-54	0	0	0	0	111.9	M221 I222 S615	M221-S225 WeakPolarHBondContact O-CB 3.36Å; M221-S225 PolarHBondContact O-N 3.27Å; M221-S225 PolarHBondContact O-OG 2.93Å; I222-S225 PolarHBondContact O-N 3.01Å; I222-S225 VanDerWaalsContact O-N 3.09Å; S225-S615 PolarHBondContact O-N 2.93Å
226	L	86.7	Confident	87.5	Confident	11 Å²	11	14.5 Å²	14.5	6%	0.058	7%	0.069	C	C	.	.	H	α-helix	trans	-93.7	-21.2	-177.7	-66.6	178.7	0	0	0	113	I222 F230 L542 Y545 A546 D549	I222-L226 HydrophobicContact CG2-CD1 4.16Å; I222-L226 PolarHBondContact O-N 2.84Å; L226-F230 HydrophobicContact CB-CB 3.86Å; L226-F230 HydrophobicContact CB-CD2 3.95Å; L226-F230 HydrophobicContact CB-CG 4.09Å; L226-F230 HydrophobicContact CD1-CB 4.24Å; L226-F230 HydrophobicContact CD1-CG 4.22Å; L226-L542 HydrophobicContact CD1-CD2 4.22Å; L226-Y545 HydrophobicContact CD1-CD1 4.02Å; L226-Y545 HydrophobicContact CD2-CD1 4.02Å; L226-Y545 HydrophobicContact CD2-CE1 4.04Å; L226-A546 HydrophobicContact CD1-CB 4.01Å; L226-A546 HydrophobicContact CD2-CB 4.25Å; L226-A546 HydrophobicContact CG-CB 3.8Å; L226-D549 HydrophobicContact CD2-CB 4.24Å
227	G	88	Confident	88.2	Confident	4 Å²	4	14.7 Å²	14.7	4%	0.041	7%	0.071	C	C	.	.			trans	113.8	171.2	-178.2	0	0	0	0	0	113.9	S223 E229 G231	S223-G227 WeakPolarHBondContact CA-O 3.35Å; S223-G227 CarbonylContact O-C 3.43Å; S223-G227 WeakPolarHBondContact O-CA 3.3Å; S223-G227 PolarHBondContact O-N 3.13Å; S223-G227 VanDerWaalsContact O-N 3.14Å; G227-E229 VanDerWaalsContact C-N 3.3Å; G227-E229 PolarHBondContact O-N 3.46Å; G227-G231 PolarHBondContact O-N 3.02Å; G227-G231 VanDerWaalsContact O-N 3.08Å
228	P	87.7	Confident	88.7	Confident	17 Å²	17	14.8 Å²	14.8	11%	0.11	7%	0.071	C	C	.	.	H	α-helix	trans	-63.2	-30.9	-172.8	22.3	-32.4	0	0	0	114.5	G232 L488 P608 W612	P228-G232 PolarHBondContact O-N 3.19Å; P228-L488 HydrophobicContact CB-CD2 3.77Å; P228-P608 HydrophobicContact CB-CG 4.35Å; P228-P608 HydrophobicContact CG-CG 4.34Å; P228-W612 HydrophobicContact CB-CE3 3.83Å; P228-W612 HydrophobicContact CB-CH2 4.18Å; P228-W612 HydrophobicContact CB-CZ3 3.48Å; P228-W612 VanDerWaalsContact CB-CZ3 3.48Å; P228-W612 HydrophobicContact CG-CE3 4.37Å; P228-W612 HydrophobicContact CG-CZ3 4.47Å
229	E	89.3	Confident	89.1	Confident	42 Å²	42	14.8 Å²	14.8	20%	0.196	7%	0.071	C	C	.	.	H	α-helix	trans	-67.4	-50.2	-177.1	-57.9	165	174.5	0	0	111.8	G227 S233 Y600 I603 H604	G227-E229 VanDerWaalsContact C-N 3.3Å; G227-E229 PolarHBondContact O-N 3.46Å; E229-S233 WeakPolarHBondContact O-CB 3.19Å; E229-S233 PolarHBondContact O-N 2.82Å; E229-S233 PolarHBondContact O-OG 3Å; E229-Y600 HydrophobicContact CB-CD2 3.66Å; E229-Y600 HydrophobicContact CB-CE2 3.34Å; E229-Y600 HydrophobicContact CG-CE2 4.34Å; E229-Y600 WeakPolarHBondContact OE2-CE2 3.21Å; E229-Y600 VanDerWaalsContact OE2-CZ 3.25Å; E229-Y600 PolarHBondContact OE2-OH 3.04Å; E229-I603 HydrophobicContact CB-CG2 4.41Å; E229-I603 HydrophobicContact CG-CG2 4.16Å; E229-H604 VanDerWaalsContact CD-ND1 3.32Å; E229-H604 HydrophobicContact CG-CB 4.38Å; E229-H604 IonicContact OE1-CE1 3.29Å; E229-H604 IonicContact OE1-CG 3.06Å; E229-H604 IonicContact OE1-ND1 2.81Å; E229-H604 PolarHBondContact OE1-ND1 3.39Å; E229-H604 IonicContact OE2-ND1 2.66Å
230	F	88.5	Confident	89.2	Confident	69 Å²	69	19 Å²	19	30%	0.303	9%	0.09	S	C	.	.	H	α-helix	trans	-67	-43.9	174.6	-77.8	-75.1	0	0	0	111.5	I222 L226 S233 I234 L542 Y600	I222-F230 HydrophobicContact CG2-CB 4.26Å; L226-F230 HydrophobicContact CB-CB 3.86Å; L226-F230 HydrophobicContact CB-CD2 3.95Å; L226-F230 HydrophobicContact CB-CG 4.09Å; L226-F230 HydrophobicContact CD1-CB 4.24Å; L226-F230 HydrophobicContact CD1-CG 4.22Å; F230-S233 PolarHBondContact O-OG 3.18Å; F230-I234 VanDerWaalsContact O-CG2 3.23Å; F230-I234 WeakPolarHBondContact O-CG2 3.49Å; F230-I234 PolarHBondContact O-N 3.29Å; F230-L542 HydrophobicContact CD1-CD2 4.18Å; F230-Y600 HydrophobicContact CD1-CD2 4.21Å; F230-Y600 HydrophobicContact CD1-CE2 4.34Å; F230-Y600 HydrophobicContact CD2-CD2 4.41Å; F230-Y600 AromaticContact CD2-CE2 3.83Å; F230-Y600 HydrophobicContact CD2-CE2 3.83Å; F230-Y600 HydrophobicContact CE1-CD2 4.25Å; F230-Y600 HydrophobicContact CE1-CE2 4.19Å; F230-Y600 HydrophobicContact CE2-CD2 4.45Å; F230-Y600 AromaticContact CE2-CE2 3.66Å; F230-Y600 HydrophobicContact CE2-CE2 3.66Å; F230-Y600 HydrophobicContact CG-CD2 4.29Å; F230-Y600 HydrophobicContact CG-CE2 4.16Å; F230-Y600 HydrophobicContact CZ-CD2 4.37Å; F230-Y600 AromaticContact CZ-CE2 3.85Å; F230-Y600 HydrophobicContact CZ-CE2 3.85Å
231	G	89.3	Confident	89.4	Confident	0 Å²	0	17.9 Å²	17.9	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-60.4	-55.5	178.7	0	0	0	0	0	112.8	Y219 G227 S233 I234 G235	Y219-G231 WeakPolarHBondContact CD2-O 3.28Å; G227-G231 PolarHBondContact O-N 3.02Å; G227-G231 VanDerWaalsContact O-N 3.08Å; G231-S233 PolarHBondContact O-N 3.04Å; G231-I234 WeakPolarHBondContact O-CG2 3.47Å; G231-G235 WeakPolarHBondContact O-CA 3.41Å; G231-G235 PolarHBondContact O-N 3.04Å
232	G	89.5	Confident	89.7	Confident	0 Å²	0	18 Å²	18	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-62.2	-42.4	-175.7	0	0	0	0	0	113.4	P228 G235 L236 F489	P228-G232 PolarHBondContact O-N 3.19Å; G232-G235 PolarHBondContact O-N 3.34Å; G232-L236 PolarHBondContact O-N 3.22Å; G232-L236 VanDerWaalsContact O-N 3.12Å; G232-F489 WeakPolarHBondContact O-CE2 3.07Å
233	S	91.3	Very high	89.9	Confident	1 Å²	1	18.2 Å²	18.2	1%	0.007	9%	0.087	C	C	.	.	H	α-helix	trans	-62.7	-52.6	179.5	52.6	0	0	0	0	111.9	E229 F230 G231 A237 I603	E229-S233 WeakPolarHBondContact O-CB 3.19Å; E229-S233 PolarHBondContact O-N 2.82Å; E229-S233 PolarHBondContact O-OG 3Å; F230-S233 PolarHBondContact O-OG 3.18Å; G231-S233 PolarHBondContact O-N 3.04Å; S233-A237 PolarHBondContact O-N 3.48Å; S233-I603 VanDerWaalsContact N-CD1 3.3Å
234	I	91	Very high	90	Very high	1 Å²	1	18.6 Å²	18.6	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-68.8	-36.3	178.7	-159.2	65.1	0	0	0	111.8	I222 F230 G231 L236 A237 F238 V538 C539 L542 T596	I222-I234 HydrophobicContact CB-CG2 4.41Å; I222-I234 HydrophobicContact CD1-CG2 3.64Å; I222-I234 HydrophobicContact CG2-CG2 4.15Å; F230-I234 VanDerWaalsContact O-CG2 3.23Å; F230-I234 WeakPolarHBondContact O-CG2 3.49Å; F230-I234 PolarHBondContact O-N 3.29Å; G231-I234 WeakPolarHBondContact O-CG2 3.47Å; I234-L236 VanDerWaalsContact C-N 3.34Å; I234-L236 PolarHBondContact O-N 2.83Å; I234-A237 PolarHBondContact O-N 3.15Å; I234-F238 WeakPolarHBondContact O-CB 3.44Å; I234-F238 PolarHBondContact O-N 3.03Å; I234-V538 HydrophobicContact CD1-CB 4.35Å; I234-V538 HydrophobicContact CD1-CG1 3.61Å; I234-V538 HydrophobicContact CD1-CG2 4.09Å; I234-C539 HydrophobicContact CD1-CB 4.35Å; I234-C539 HydrophobicContact CG1-CB 4.03Å; I234-L542 HydrophobicContact CB-CD1 3.91Å; I234-L542 HydrophobicContact CD1-CD1 3.96Å; I234-L542 HydrophobicContact CG1-CD1 3.87Å; I234-L542 HydrophobicContact CG2-CD1 4.34Å; I234-T596 HydrophobicContact CD1-CG2 4.12Å
235	G	90.7	Very high	90.2	Very high	0 Å²	0	16.1 Å²	16.1	0%	0	8%	0.084	C	C	.	.	H	α-helix	trans	-60.9	-43.3	-179	0	0	0	0	0	112	G231 G232 A239 L479	G231-G235 WeakPolarHBondContact O-CA 3.41Å; G231-G235 PolarHBondContact O-N 3.04Å; G232-G235 PolarHBondContact O-N 3.34Å; G235-A239 WeakPolarHBondContact O-CB 3.28Å; G235-A239 PolarHBondContact O-N 2.69Å; G235-L479 VanDerWaalsContact O-CD2 3.25Å; G235-L479 WeakPolarHBondContact O-CD2 2.9Å
236	L	91.8	Very high	90.5	Very high	44 Å²	44	15.5 Å²	15.5	23%	0.23	8%	0.08	C	C	.	.	H	α-helix	trans	-68.5	-46.5	179.5	-176.7	61.1	0	0	0	111.6	G232 I234 F238 A239 F240 L480 L483 F489 L599	G232-L236 PolarHBondContact O-N 3.22Å; G232-L236 VanDerWaalsContact O-N 3.12Å; I234-L236 VanDerWaalsContact C-N 3.34Å; I234-L236 PolarHBondContact O-N 2.83Å; L236-F238 VanDerWaalsContact C-N 3.3Å; L236-F238 PolarHBondContact O-N 2.8Å; L236-A239 PolarHBondContact O-N 3.42Å; L236-F240 PolarHBondContact O-N 3.47Å; L236-F240 VanDerWaalsContact O-N 3.11Å; L236-L480 HydrophobicContact CD1-CD2 3.71Å; L236-L483 HydrophobicContact CB-CD1 4.34Å; L236-F489 HydrophobicContact CB-CE2 4.15Å; L236-F489 HydrophobicContact CB-CZ 4.28Å; L236-F489 HydrophobicContact CD2-CE1 4.07Å; L236-F489 HydrophobicContact CD2-CE2 4.16Å; L236-F489 HydrophobicContact CD2-CZ 3.85Å; L236-L599 HydrophobicContact CB-CD1 4.46Å; L236-L599 HydrophobicContact CD2-CD1 4.3Å; L236-L599 HydrophobicContact CD2-CD2 4.02Å
237	A	91.5	Very high	90.7	Very high	5 Å²	5	15 Å²	15	4%	0.041	8%	0.077	C	C	.	.	H	α-helix	trans	-60.4	-42	175.8	0	0	0	0	0	111.4	S233 I234 A239 F240 A241 I535	S233-A237 PolarHBondContact O-N 3.48Å; I234-A237 PolarHBondContact O-N 3.15Å; A237-A239 PolarHBondContact O-N 3.45Å; A237-F240 WeakPolarHBondContact O-CB 3.35Å; A237-F240 PolarHBondContact O-N 3.04Å; A237-A241 WeakPolarHBondContact O-CB 3.3Å; A237-A241 PolarHBondContact O-N 3.46Å; A237-I535 HydrophobicContact CB-CG2 4.11Å
238	F	92.2	Very high	90.7	Very high	1 Å²	1	16.7 Å²	16.7	0%	0.004	8%	0.084	C	C	.	.	H	α-helix	trans	-67.9	-35	178.6	-168.1	-129.2	0	0	0	112.2	A218 I234 L236 A241 N242 M369 N373 L479 F536 C539	A218-F238 HydrophobicContact CB-CD1 4.1Å; A218-F238 HydrophobicContact CB-CE1 3.83Å; I234-F238 WeakPolarHBondContact O-CB 3.44Å; I234-F238 PolarHBondContact O-N 3.03Å; L236-F238 VanDerWaalsContact C-N 3.3Å; L236-F238 PolarHBondContact O-N 2.8Å; F238-A241 PolarHBondContact O-N 3.37Å; F238-N242 PolarHBondContact O-N 2.98Å; F238-N242 PolarHBondContact O-ND2 3.2Å; F238-M369 HydrophobicContact CE1-SD 3.93Å; F238-M369 HydrophobicContact CZ-CB 4.04Å; F238-M369 HydrophobicContact CZ-CE 4.39Å; F238-M369 HydrophobicContact CZ-CG 4.19Å; F238-M369 HydrophobicContact CZ-SD 3.7Å; F238-N373 WeakPolarHBondContact CE1-OD1 3.35Å; F238-L479 HydrophobicContact CB-CD2 3.87Å; F238-L479 HydrophobicContact CD1-CD2 3.41Å; F238-L479 VanDerWaalsContact CD1-CD2 3.41Å; F238-L479 HydrophobicContact CE1-CD2 4.35Å; F238-L479 HydrophobicContact CG-CD2 4.01Å; F238-F536 HydrophobicContact CD2-CD1 4.47Å; F238-F536 HydrophobicContact CD2-CD2 4.48Å; F238-F536 HydrophobicContact CD2-CE1 4.46Å; F238-F536 HydrophobicContact CD2-CG 4.47Å; F238-F536 HydrophobicContact CD2-CZ 4.48Å; F238-F536 AromaticContact CE2-CD1 3.42Å; F238-F536 HydrophobicContact CE2-CD1 3.42Å; F238-F536 VanDerWaalsContact CE2-CD1 3.42Å; F238-F536 HydrophobicContact CE2-CD2 4.1Å; F238-F536 AromaticContact CE2-CE1 3.37Å; F238-F536 HydrophobicContact CE2-CE1 3.37Å; F238-F536 HydrophobicContact CE2-CE2 4.09Å; F238-F536 AromaticContact CE2-CG 3.79Å; F238-F536 HydrophobicContact CE2-CG 3.79Å; F238-F536 AromaticContact CE2-CZ 3.73Å; F238-F536 HydrophobicContact CE2-CZ 3.73Å; F238-F536 HydrophobicContact CZ-CD1 4.04Å; F238-F536 AromaticContact CZ-CE1 3.74Å; F238-F536 HydrophobicContact CZ-CE1 3.74Å; F238-F536 HydrophobicContact CZ-CZ 4.28Å; F238-C539 HydrophobicContact CD2-CB 4.1Å; F238-C539 HydrophobicContact CE2-CB 4.33Å
239	A	92.3	Very high	90.8	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.008	8%	0.084	C	C	.	.	H	α-helix	trans	-64.4	-45.5	176.1	0	0	0	0	0	110.9	G235 L236 A237 N242 V243 G476 L479 L480	G235-A239 WeakPolarHBondContact O-CB 3.28Å; G235-A239 PolarHBondContact O-N 2.69Å; L236-A239 PolarHBondContact O-N 3.42Å; A237-A239 PolarHBondContact O-N 3.45Å; A239-N242 PolarHBondContact O-N 2.88Å; A239-V243 PolarHBondContact O-N 2.9Å; A239-G476 WeakPolarHBondContact O-CA 3.48Å; A239-L479 HydrophobicContact CB-CB 4.02Å; A239-L479 HydrophobicContact CB-CD2 3.91Å; A239-L479 HydrophobicContact CB-CG 4.31Å; A239-L480 HydrophobicContact CB-CD2 3.69Å; A239-L480 HydrophobicContact CB-CG 3.77Å
240	F	91	Very high	90.8	Very high	89 Å²	89	14.7 Å²	14.7	39%	0.39	8%	0.075	S	C	.	.	H	α-helix	trans	-58.6	-49.2	173	177.8	-96	0	0	0	111.1	L236 A237 N242 V243 V244 L515	L236-F240 PolarHBondContact O-N 3.47Å; L236-F240 VanDerWaalsContact O-N 3.11Å; A237-F240 WeakPolarHBondContact O-CB 3.35Å; A237-F240 PolarHBondContact O-N 3.04Å; F240-N242 VanDerWaalsContact C-N 3.28Å; F240-N242 PolarHBondContact O-N 2.9Å; F240-V243 WeakPolarHBondContact O-CB 3.43Å; F240-V243 PolarHBondContact O-N 2.96Å; F240-V244 HydrophobicContact CD1-CG2 3.84Å; F240-V244 HydrophobicContact CD2-CG2 4.5Å; F240-V244 HydrophobicContact CE1-CG2 3.47Å; F240-V244 VanDerWaalsContact CE1-CG2 3.47Å; F240-V244 HydrophobicContact CE2-CG2 4.19Å; F240-V244 HydrophobicContact CG-CG2 4.33Å; F240-V244 HydrophobicContact CZ-CG2 3.65Å; F240-V244 WeakPolarHBondContact O-CG2 3.31Å; F240-V244 PolarHBondContact O-N 3.3Å; F240-L515 HydrophobicContact CD2-CD1 4.4Å; F240-L515 HydrophobicContact CD2-CD2 3.46Å; F240-L515 VanDerWaalsContact CD2-CD2 3.46Å; F240-L515 HydrophobicContact CD2-CG 4.47Å; F240-L515 HydrophobicContact CE2-CD1 3.73Å; F240-L515 HydrophobicContact CE2-CD2 3.66Å; F240-L515 HydrophobicContact CE2-CG 4.21Å
241	A	92	Very high	90.7	Very high	1 Å²	1	11.7 Å²	11.7	1%	0.008	6%	0.062	C	C	.	.	H	α-helix	trans	-59.1	-35.7	-179.9	0	0	0	0	0	113.4	A237 F238 V244 A245 I535 F536	A237-A241 WeakPolarHBondContact O-CB 3.3Å; A237-A241 PolarHBondContact O-N 3.46Å; F238-A241 PolarHBondContact O-N 3.37Å; A241-V244 PolarHBondContact O-N 2.9Å; A241-A245 VanDerWaalsContact O-CB 3.27Å; A241-A245 WeakPolarHBondContact O-CB 3.43Å; A241-A245 PolarHBondContact O-N 2.71Å; A241-I535 HydrophobicContact CB-CB 3.86Å; A241-I535 HydrophobicContact CB-CD1 4.12Å; A241-I535 HydrophobicContact CB-CG2 3.57Å; A241-F536 HydrophobicContact CB-CD2 4.04Å; A241-F536 HydrophobicContact CB-CE2 3.75Å
242	N	92.4	Very high	90.4	Very high	7 Å²	7	12 Å²	12	4%	0.037	7%	0.066	C	C	.	.	H	α-helix	trans	-66.4	-36.2	174.7	-82.4	-86.2	0	0	0	112.6	F238 A239 F240 A246 G472 S475	F238-N242 PolarHBondContact O-N 2.98Å; F238-N242 PolarHBondContact O-ND2 3.2Å; A239-N242 PolarHBondContact O-N 2.88Å; F240-N242 VanDerWaalsContact C-N 3.28Å; F240-N242 PolarHBondContact O-N 2.9Å; N242-A246 PolarHBondContact O-N 3.48Å; N242-G472 CarbonylContact O-C 3.53Å; N242-S475 VanDerWaalsContact OD1-CB 3.24Å; N242-S475 WeakPolarHBondContact OD1-CB 3.41Å
243	V	92.8	Very high	90.3	Very high	4 Å²	4	13.5 Å²	13.5	2%	0.024	7%	0.072	C	C	.	.	H	α-helix	trans	-69.4	-43.5	175.1	177.6	0	0	0	0	110.9	A239 F240 A245 A246 A247 A512 L515	A239-V243 PolarHBondContact O-N 2.9Å; F240-V243 WeakPolarHBondContact O-CB 3.43Å; F240-V243 PolarHBondContact O-N 2.96Å; V243-A245 VanDerWaalsContact C-N 3.31Å; V243-A245 PolarHBondContact O-N 2.91Å; V243-A246 WeakPolarHBondContact O-CB 3.28Å; V243-A246 PolarHBondContact O-N 3.37Å; V243-A247 PolarHBondContact O-N 3.43Å; V243-A512 HydrophobicContact CG1-CB 4.11Å; V243-A512 VanDerWaalsContact CG1-O 3.25Å; V243-A512 WeakPolarHBondContact CG1-O 3.39Å; V243-A512 HydrophobicContact CG2-CB 3.59Å; V243-L515 HydrophobicContact CB-CD2 4.17Å; V243-L515 HydrophobicContact CG1-CB 4.13Å; V243-L515 HydrophobicContact CG1-CD2 3.89Å; V243-L515 HydrophobicContact CG1-CG 3.98Å
244	V	90.9	Very high	90.2	Very high	7 Å²	7	13.4 Å²	13.4	4%	0.042	7%	0.072	C	C	.	.	H	α-helix	trans	-64	-38.7	176.5	-176.3	0	0	0	0	110.6	F240 A241 A246 A247 F248 I519 I528 I532	F240-V244 HydrophobicContact CD1-CG2 3.84Å; F240-V244 HydrophobicContact CD2-CG2 4.5Å; F240-V244 HydrophobicContact CE1-CG2 3.47Å; F240-V244 VanDerWaalsContact CE1-CG2 3.47Å; F240-V244 HydrophobicContact CE2-CG2 4.19Å; F240-V244 HydrophobicContact CG-CG2 4.33Å; F240-V244 HydrophobicContact CZ-CG2 3.65Å; F240-V244 WeakPolarHBondContact O-CG2 3.31Å; F240-V244 PolarHBondContact O-N 3.3Å; A241-V244 PolarHBondContact O-N 2.9Å; V244-A246 VanDerWaalsContact C-N 3.33Å; V244-A246 PolarHBondContact O-N 2.96Å; V244-A247 PolarHBondContact O-N 3.39Å; V244-F248 WeakPolarHBondContact O-CB 3.31Å; V244-F248 PolarHBondContact O-N 2.82Å; V244-I519 HydrophobicContact CG1-CG2 4.14Å; V244-I519 HydrophobicContact CG2-CD1 4.35Å; V244-I519 HydrophobicContact CG2-CG1 4.25Å; V244-I528 HydrophobicContact CG1-CG2 3.2Å; V244-I532 HydrophobicContact CB-CD1 4.4Å; V244-I532 HydrophobicContact CB-CG1 4.13Å; V244-I532 HydrophobicContact CG1-CD1 3.8Å; V244-I532 HydrophobicContact CG1-CG1 3.69Å
245	A	90.1	Very high	89.7	Confident	21 Å²	21	16.5 Å²	16.5	17%	0.174	9%	0.086	C	C	.	.	H	α-helix	trans	-62.3	-38.9	173.3	0	0	0	0	0	112.4	A241 V243 F248 C249 I532	A241-A245 VanDerWaalsContact O-CB 3.27Å; A241-A245 WeakPolarHBondContact O-CB 3.43Å; A241-A245 PolarHBondContact O-N 2.71Å; V243-A245 VanDerWaalsContact C-N 3.31Å; V243-A245 PolarHBondContact O-N 2.91Å; A245-F248 WeakPolarHBondContact O-CB 3.38Å; A245-F248 PolarHBondContact O-N 3.25Å; A245-C249 PolarHBondContact O-N 3.31Å; A245-C249 PolarHBondContact O-SG 2.64Å; A245-I532 HydrophobicContact CB-CD1 4.41Å; A245-I532 HydrophobicContact CB-CG2 4.09Å
246	A	91.8	Very high	89.3	Confident	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-62.8	-46.6	174.6	0	0	0	0	0	112	N242 V243 V244 F248 C249 S250 A469 F473	N242-A246 PolarHBondContact O-N 3.48Å; V243-A246 WeakPolarHBondContact O-CB 3.28Å; V243-A246 PolarHBondContact O-N 3.37Å; V244-A246 VanDerWaalsContact C-N 3.33Å; V244-A246 PolarHBondContact O-N 2.96Å; A246-F248 VanDerWaalsContact C-N 3.33Å; A246-F248 PolarHBondContact O-N 2.91Å; A246-C249 PolarHBondContact O-N 3.3Å; A246-S250 PolarHBondContact O-N 2.89Å; A246-S250 PolarHBondContact O-OG 3.45Å; A246-S250 VanDerWaalsContact O-OG 3.08Å; A246-A469 VanDerWaalsContact CB-O 3.25Å; A246-A469 WeakPolarHBondContact CB-O 3.32Å; A246-F473 HydrophobicContact CB-CB 3.82Å; A246-F473 HydrophobicContact CB-CD2 4.32Å
247	A	91.5	Very high	89.1	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-59.9	-44.3	175.2	0	0	0	0	0	111.5	V243 V244 C249 S250 V251 I519 V520	V243-A247 PolarHBondContact O-N 3.43Å; V244-A247 PolarHBondContact O-N 3.39Å; A247-C249 PolarHBondContact O-N 2.87Å; A247-S250 WeakPolarHBondContact O-CB 3.45Å; A247-S250 PolarHBondContact O-N 3.41Å; A247-S250 VanDerWaalsContact O-N 3.16Å; A247-V251 WeakPolarHBondContact O-CG2 3.41Å; A247-V251 PolarHBondContact O-N 3.3Å; A247-I519 HydrophobicContact CB-CB 3.8Å; A247-I519 HydrophobicContact CB-CG2 3.58Å; A247-V520 HydrophobicContact CB-CG2 3.91Å
248	F	87.1	Confident	88.9	Confident	40 Å²	40	18.6 Å²	18.6	18%	0.175	9%	0.093	C	C	.	.	H	α-helix	trans	-56.3	-48	176.3	176.1	-90.9	0	0	0	112.3	V244 A245 A246 S250 V251 G252 I525 A529 I532	V244-F248 WeakPolarHBondContact O-CB 3.31Å; V244-F248 PolarHBondContact O-N 2.82Å; A245-F248 WeakPolarHBondContact O-CB 3.38Å; A245-F248 PolarHBondContact O-N 3.25Å; A246-F248 VanDerWaalsContact C-N 3.33Å; A246-F248 PolarHBondContact O-N 2.91Å; F248-S250 VanDerWaalsContact C-N 3.35Å; F248-S250 PolarHBondContact O-N 2.95Å; F248-V251 PolarHBondContact O-N 2.82Å; F248-G252 PolarHBondContact O-N 3.26Å; F248-I525 HydrophobicContact CD2-CB 4.5Å; F248-I525 HydrophobicContact CD2-CG1 4.43Å; F248-I525 HydrophobicContact CD2-CG2 4.06Å; F248-I525 HydrophobicContact CE2-CB 4.1Å; F248-I525 HydrophobicContact CE2-CG1 4.38Å; F248-I525 HydrophobicContact CE2-CG2 3.24Å; F248-I525 HydrophobicContact CZ-CG2 3.78Å; F248-A529 HydrophobicContact CD2-CB 4.43Å; F248-A529 HydrophobicContact CE2-CB 3.63Å; F248-A529 HydrophobicContact CZ-CB 4.05Å; F248-I532 HydrophobicContact CB-CD1 4.02Å; F248-I532 HydrophobicContact CG-CD1 4.29Å
249	C	89.2	Confident	88.3	Confident	17 Å²	17	21 Å²	21	12%	0.115	11%	0.106	C	C	.	.	H	α-helix	trans	-66.9	-33.7	176.8	-68.2	0	0	0	0	112.9	A245 A246 A247 G252 F253 S468 A469	A245-C249 PolarHBondContact O-N 3.31Å; A245-C249 PolarHBondContact O-SG 2.64Å; A246-C249 PolarHBondContact O-N 3.3Å; A247-C249 PolarHBondContact O-N 2.87Å; C249-G252 PolarHBondContact O-N 3.49Å; C249-F253 PolarHBondContact O-N 2.98Å; C249-S468 VanDerWaalsContact SG-CB 3.57Å; C249-A469 HydrophobicContact CB-CB 3.64Å
250	S	89.8	Confident	87.9	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.1	-37.7	173.4	-62.3	0	0	0	0	112.4	A246 A247 F248 F253 A254 M284 I287	A246-S250 PolarHBondContact O-N 2.89Å; A246-S250 PolarHBondContact O-OG 3.45Å; A246-S250 VanDerWaalsContact O-OG 3.08Å; A247-S250 WeakPolarHBondContact O-CB 3.45Å; A247-S250 PolarHBondContact O-N 3.41Å; A247-S250 VanDerWaalsContact O-N 3.16Å; F248-S250 VanDerWaalsContact C-N 3.35Å; F248-S250 PolarHBondContact O-N 2.95Å; S250-F253 PolarHBondContact O-N 3.14Å; S250-A254 WeakPolarHBondContact O-CB 3.3Å; S250-A254 PolarHBondContact O-N 2.77Å; S250-M284 PolarHBondContact OG-SD 3.12Å; S250-M284 VanDerWaalsContact OG-SD 3.36Å; S250-I287 WeakPolarHBondContact OG-CD1 3.43Å
251	V	86.4	Confident	87.6	Confident	7 Å²	7	20.3 Å²	20.3	4%	0.042	11%	0.106	C	C	.	.	H	α-helix	trans	-67.2	-41.6	173.1	-175.7	0	0	0	0	110.3	A247 F248 F253 A254 E255 I276 V520 I525	A247-V251 WeakPolarHBondContact O-CG2 3.41Å; A247-V251 PolarHBondContact O-N 3.3Å; F248-V251 PolarHBondContact O-N 2.82Å; V251-F253 VanDerWaalsContact C-N 3.33Å; V251-F253 PolarHBondContact O-N 3.29Å; V251-A254 CarbonylContact O-C 3.57Å; V251-A254 WeakPolarHBondContact O-CA 3.1Å; V251-A254 WeakPolarHBondContact O-CB 3.43Å; V251-A254 PolarHBondContact O-N 2.95Å; V251-E255 PolarHBondContact O-N 2.91Å; V251-I276 HydrophobicContact CG1-CG2 3.66Å; V251-V520 HydrophobicContact CG2-CB 4.35Å; V251-V520 HydrophobicContact CG2-CG1 4.24Å; V251-V520 HydrophobicContact CG2-CG2 4.08Å; V251-I525 HydrophobicContact CB-CD1 3.97Å; V251-I525 HydrophobicContact CB-CG1 4.08Å; V251-I525 HydrophobicContact CG1-CD1 3.37Å; V251-I525 HydrophobicContact CG1-CG1 3.68Å
252	G	82.1	Confident	87.1	Confident	7 Å²	7	24 Å²	24	7%	0.072	12%	0.121	C	C	.	.	H	α-helix	trans	-61.9	-37	175.5	0	0	0	0	0	113.7	F248 C249 T256	F248-G252 PolarHBondContact O-N 3.26Å; C249-G252 PolarHBondContact O-N 3.49Å; G252-T256 PolarHBondContact O-N 3.27Å; G252-T256 PolarHBondContact O-OG1 2.98Å
253	F	88.5	Confident	86.3	Confident	30 Å²	30	29.3 Å²	29.3	13%	0.132	15%	0.146	C	C	.	.	H	α-helix	trans	-62	-46.5	168.8	173.8	-97	0	0	0	111.3	C249 S250 V251 E255 T256 L257 I279 T283 F462 T465	C249-F253 PolarHBondContact O-N 2.98Å; S250-F253 PolarHBondContact O-N 3.14Å; V251-F253 VanDerWaalsContact C-N 3.33Å; V251-F253 PolarHBondContact O-N 3.29Å; F253-E255 PolarHBondContact O-N 2.97Å; F253-T256 PolarHBondContact O-N 3.27Å; F253-L257 HydrophobicContact CE1-CD2 4.03Å; F253-L257 HydrophobicContact CZ-CD2 4.21Å; F253-L257 PolarHBondContact O-N 2.94Å; F253-I279 HydrophobicContact CD1-CG2 4.28Å; F253-I279 HydrophobicContact CE1-CG2 4.17Å; F253-T283 HydrophobicContact CD1-CG2 3.91Å; F253-T283 VanDerWaalsContact CD1-OG1 3.25Å; F253-T283 WeakPolarHBondContact CD1-OG1 3.24Å; F253-T283 HydrophobicContact CE1-CG2 4.4Å; F253-T283 WeakPolarHBondContact CE1-OG1 3.38Å; F253-T283 HydrophobicContact CG-CG2 4.45Å; F253-F462 HydrophobicContact CD2-CB 4.21Å; F253-F462 AromaticContact CD2-CD1 3.8Å; F253-F462 HydrophobicContact CD2-CD1 3.8Å; F253-F462 HydrophobicContact CD2-CE1 4.38Å; F253-F462 HydrophobicContact CD2-CG 4.03Å; F253-F462 HydrophobicContact CE2-CB 3.82Å; F253-F462 AromaticContact CE2-CD1 3.66Å; F253-F462 HydrophobicContact CE2-CD1 3.66Å; F253-F462 AromaticContact CE2-CD2 3.88Å; F253-F462 HydrophobicContact CE2-CD2 3.88Å; F253-F462 HydrophobicContact CE2-CE1 4.15Å; F253-F462 HydrophobicContact CE2-CE2 4.36Å; F253-F462 AromaticContact CE2-CG 3.51Å; F253-F462 HydrophobicContact CE2-CG 3.51Å; F253-F462 HydrophobicContact CE2-CZ 4.49Å; F253-T465 HydrophobicContact CB-CG2 4.27Å; F253-T465 WeakPolarHBondContact CD2-OG1 3.22Å
254	A	89.1	Confident	85.7	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-63.9	-38.2	-178.2	0	0	0	0	0	113.3	S250 V251 R258 I276 I279	S250-A254 WeakPolarHBondContact O-CB 3.3Å; S250-A254 PolarHBondContact O-N 2.77Å; V251-A254 CarbonylContact O-C 3.57Å; V251-A254 WeakPolarHBondContact O-CA 3.1Å; V251-A254 WeakPolarHBondContact O-CB 3.43Å; V251-A254 PolarHBondContact O-N 2.95Å; A254-R258 WeakPolarHBondContact O-CB 3.33Å; A254-R258 PolarHBondContact O-N 3.38Å; A254-I276 HydrophobicContact CB-CG2 3.94Å; A254-I276 WeakPolarHBondContact CB-O 3.31Å; A254-I279 HydrophobicContact CB-CB 3.82Å; A254-I279 HydrophobicContact CB-CG2 3.61Å
255	E	81.7	Confident	85.2	Confident	65 Å²	65	38.4 Å²	38.4	30%	0.304	21%	0.205	S	C	.	.	H	α-helix	trans	-59.5	-51.6	172	-75.6	-176.4	156.6	0	0	111.3	V251 F253 L257 R258 D259 I276 I525	V251-E255 PolarHBondContact O-N 2.91Å; F253-E255 PolarHBondContact O-N 2.97Å; E255-L257 VanDerWaalsContact C-N 3.34Å; E255-L257 PolarHBondContact O-N 3.39Å; E255-R258 PolarHBondContact O-N 2.92Å; E255-D259 PolarHBondContact O-N 3.49Å; E255-I276 HydrophobicContact CG-CD1 3.81Å; E255-I276 HydrophobicContact CG-CG1 4.21Å; E255-I276 HydrophobicContact CG-CG2 4.26Å; E255-I525 HydrophobicContact CG-CD1 4.3Å; E255-I525 VanDerWaalsContact OE1-CD1 3.23Å; E255-I525 WeakPolarHBondContact OE1-CD1 3.4Å; E255-I525 VanDerWaalsContact OE2-CD1 3.27Å; E255-I525 WeakPolarHBondContact OE2-CD1 2.89Å
256	T	82	Confident	84.7	Confident	5 Å²	5	42.3 Å²	42.3	3%	0.031	22%	0.222	C	C	.	.	H	α-helix	trans	-62.1	-41.8	-178.6	-48	0	0	0	0	111.4	G252 F253 D259 L260 I461 F462	G252-T256 PolarHBondContact O-N 3.27Å; G252-T256 PolarHBondContact O-OG1 2.98Å; F253-T256 PolarHBondContact O-N 3.27Å; T256-D259 PolarHBondContact O-N 3.48Å; T256-L260 PolarHBondContact O-N 3.04Å; T256-L260 VanDerWaalsContact O-N 3.16Å; T256-I461 HydrophobicContact CG2-CB 4.48Å; T256-I461 HydrophobicContact CG2-CG2 3.84Å; T256-F462 HydrophobicContact CG2-CD1 4.23Å; T256-F462 HydrophobicContact CG2-CE1 3.67Å
257	L	86.8	Confident	84.1	Confident	40 Å²	40	47.3 Å²	47.3	21%	0.209	25%	0.248	C	C	.	.	H	α-helix	trans	-68.3	-40.3	177.8	-178.6	60.2	0	0	0	112.1	F253 E255 D259 L260 L261 I279 F462	F253-L257 HydrophobicContact CE1-CD2 4.03Å; F253-L257 HydrophobicContact CZ-CD2 4.21Å; F253-L257 PolarHBondContact O-N 2.94Å; E255-L257 VanDerWaalsContact C-N 3.34Å; E255-L257 PolarHBondContact O-N 3.39Å; L257-D259 VanDerWaalsContact C-N 3.31Å; L257-D259 PolarHBondContact O-N 3.45Å; L257-L260 PolarHBondContact O-N 3.26Å; L257-L261 HydrophobicContact CD1-CD1 4.43Å; L257-L261 HydrophobicContact CD1-CG 4.38Å; L257-L261 HydrophobicContact CG-CD1 4.07Å; L257-L261 HydrophobicContact CG-CG 4.48Å; L257-L261 VanDerWaalsContact O-CG 3.25Å; L257-L261 WeakPolarHBondContact O-CG 3.44Å; L257-L261 PolarHBondContact O-N 3.29Å; L257-I279 HydrophobicContact CB-CG2 4.41Å; L257-I279 HydrophobicContact CD2-CD1 4.35Å; L257-I279 HydrophobicContact CD2-CG1 4.47Å; L257-I279 HydrophobicContact CD2-CG2 3.74Å; L257-I279 HydrophobicContact CG-CD1 4.37Å; L257-F462 HydrophobicContact CB-CE1 4.27Å; L257-F462 HydrophobicContact CB-CZ 3.98Å; L257-F462 HydrophobicContact CD1-CE2 4.04Å; L257-F462 HydrophobicContact CD1-CZ 3.71Å; L257-F462 HydrophobicContact CG-CZ 4.44Å
258	R	86.9	Confident	83.1	Confident	48 Å²	48	53.5 Å²	53.5	18%	0.181	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-43	175.9	177.3	-85.8	-76	-177.1	1.2	110.9	A254 E255 L261 K262 G271 D275 I276 I279	A254-R258 WeakPolarHBondContact O-CB 3.33Å; A254-R258 PolarHBondContact O-N 3.38Å; E255-R258 PolarHBondContact O-N 2.92Å; R258-L261 PolarHBondContact O-N 2.92Å; R258-K262 PolarHBondContact O-N 2.66Å; R258-G271 WeakPolarHBondContact CD-O 3.4Å; R258-D275 HydrophobicContact CG-CB 4.08Å; R258-I276 HydrophobicContact CB-CG1 4.27Å; R258-I276 HydrophobicContact CG-CG1 4.38Å; R258-I279 HydrophobicContact CB-CD1 4.18Å
259	D	80.7	Confident	82.7	Confident	51 Å²	51	56.9 Å²	56.9	27%	0.273	29%	0.294	S	S	.	.	H	α-helix	trans	-62.7	-45.4	179.6	-72.9	-20.9	0	0	0	111	E255 T256 L257 L261 K262 E263	E255-D259 PolarHBondContact O-N 3.49Å; T256-D259 PolarHBondContact O-N 3.48Å; L257-D259 VanDerWaalsContact C-N 3.31Å; L257-D259 PolarHBondContact O-N 3.45Å; D259-L261 VanDerWaalsContact C-N 3.33Å; D259-L261 PolarHBondContact O-N 3.3Å; D259-K262 WeakPolarHBondContact O-CB 3.47Å; D259-K262 PolarHBondContact O-N 3.35Å; D259-E263 WeakPolarHBondContact O-CG 3.25Å; D259-E263 PolarHBondContact O-N 3.26Å
260	L	82.5	Confident	82.3	Confident	47 Å²	47	58.9 Å²	58.9	25%	0.246	30%	0.304	C	S	.	.	H	α-helix	trans	-59.9	-41.3	175	-174.5	69.3	0	0	0	112.4	T256 L257 E263 H264 T458 F462	T256-L260 PolarHBondContact O-N 3.04Å; T256-L260 VanDerWaalsContact O-N 3.16Å; L257-L260 PolarHBondContact O-N 3.26Å; L260-E263 PolarHBondContact O-N 2.95Å; L260-H264 PolarHBondContact O-N 3.24Å; L260-H264 PolarHBondContact O-ND1 3.03Å; L260-T458 HydrophobicContact CD2-CG2 4.35Å; L260-F462 HydrophobicContact CD2-CZ 4.25Å
261	L	85	Confident	81.5	Confident	30 Å²	30	58.9 Å²	58.9	16%	0.157	30%	0.304	C	S	.	.	H	α-helix	trans	-65.9	-41.9	177.7	-72.7	168.6	0	0	0	111.7	L257 R258 D259 E263 H264 G265 L266 F268 I279	L257-L261 HydrophobicContact CD1-CD1 4.43Å; L257-L261 HydrophobicContact CD1-CG 4.38Å; L257-L261 HydrophobicContact CG-CD1 4.07Å; L257-L261 HydrophobicContact CG-CG 4.48Å; L257-L261 VanDerWaalsContact O-CG 3.25Å; L257-L261 WeakPolarHBondContact O-CG 3.44Å; L257-L261 PolarHBondContact O-N 3.29Å; R258-L261 PolarHBondContact O-N 2.92Å; D259-L261 VanDerWaalsContact C-N 3.33Å; D259-L261 PolarHBondContact O-N 3.3Å; L261-E263 VanDerWaalsContact C-N 3.34Å; L261-E263 PolarHBondContact O-N 3.34Å; L261-H264 CarbonylContact O-C 3.41Å; L261-H264 PolarHBondContact O-N 3.23Å; L261-H264 VanDerWaalsContact O-N 3.13Å; L261-G265 PolarHBondContact O-N 2.53Å; L261-G265 VanDerWaalsContact O-N 3.13Å; L261-L266 CarbonylContact C-O 3.6Å; L261-L266 HydrophobicContact CB-CB 4.14Å; L261-L266 HydrophobicContact CD2-CB 3.97Å; L261-L266 HydrophobicContact CD2-CD1 3.69Å; L261-L266 HydrophobicContact CD2-CG 4.49Å; L261-L266 PolarHBondContact O-N 3.16Å; L261-F268 HydrophobicContact CD1-CD2 4.08Å; L261-F268 HydrophobicContact CD1-CE2 3.33Å; L261-F268 HydrophobicContact CD1-CZ 4.13Å; L261-I279 HydrophobicContact CD1-CD1 4.22Å
262	K	82	Confident	81.3	Confident	77 Å²	77	64.4 Å²	64.4	34%	0.335	33%	0.329	S	S	.	.	H	α-helix	trans	-60	-42.8	174.7	-88.3	-172.5	156.4	168.7	0	112.3	R258 D259 H264 G265 G271	R258-K262 PolarHBondContact O-N 2.66Å; D259-K262 WeakPolarHBondContact O-CB 3.47Å; D259-K262 PolarHBondContact O-N 3.35Å; K262-H264 PolarHBondContact O-N 3.29Å; K262-G265 PolarHBondContact O-N 2.64Å; K262-G271 VanDerWaalsContact CE-C 3.49Å; K262-G271 WeakPolarHBondContact CE-O 3.15Å; K262-G271 PolarHBondContact NZ-O 2.81Å
263	E	75.8	Confident	81.4	Confident	120 Å²	120	67.3 Å²	67.3	56%	0.561	34%	0.343	S	S	*	.	H	α-helix	trans	-60.7	-31.5	176.2	-73.4	-179.7	169.9	0	0	112.5	D259 L260 L261	D259-E263 WeakPolarHBondContact O-CG 3.25Å; D259-E263 PolarHBondContact O-N 3.26Å; L260-E263 PolarHBondContact O-N 2.95Å; L261-E263 VanDerWaalsContact C-N 3.34Å; L261-E263 PolarHBondContact O-N 3.34Å
264	H	80.2	Confident	81.3	Confident	136 Å²	136	68.8 Å²	68.8	63%	0.63	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	9.1	175.5	-65.7	81.4	0	0	0	113.7	L260 L261 K262 L266	L260-H264 PolarHBondContact O-N 3.24Å; L260-H264 PolarHBondContact O-ND1 3.03Å; L261-H264 CarbonylContact O-C 3.41Å; L261-H264 PolarHBondContact O-N 3.23Å; L261-H264 VanDerWaalsContact O-N 3.13Å; K262-H264 PolarHBondContact O-N 3.29Å; H264-L266 VanDerWaalsContact C-N 3.34Å; H264-L266 PolarHBondContact O-N 3.36Å
265	G	79	Confident	81.2	Confident	65 Å²	65	68.9 Å²	68.9	67%	0.67	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	17.9	177.9	0	0	0	0	0	115.3	L261 K262	L261-G265 PolarHBondContact O-N 2.53Å; L261-G265 VanDerWaalsContact O-N 3.13Å; K262-G265 PolarHBondContact O-N 2.64Å
266	L	80.8	Confident	81.5	Confident	103 Å²	103	66.2 Å²	66.2	54%	0.539	34%	0.34	S	S	.	.			trans	-99.2	117.8	178.5	-63.9	172.1	0	0	0	110.3	L261 H264	L261-L266 CarbonylContact C-O 3.6Å; L261-L266 HydrophobicContact CB-CB 4.14Å; L261-L266 HydrophobicContact CD2-CB 3.97Å; L261-L266 HydrophobicContact CD2-CD1 3.69Å; L261-L266 HydrophobicContact CD2-CG 4.49Å; L261-L266 PolarHBondContact O-N 3.16Å; H264-L266 VanDerWaalsContact C-N 3.34Å; H264-L266 PolarHBondContact O-N 3.36Å
267	I	78.9	Confident	81.9	Confident	106 Å²	106	69.6 Å²	69.6	54%	0.544	35%	0.352	S	S	.	.			trans	-122.2	130.3	176.3	-63.4	170.3	0	0	0	108	G271	I267-G271 VanDerWaalsContact CG2-N 3.32Å
268	F	70.6	Confident	82	Confident	130 Å²	130	70.3 Å²	70.3	57%	0.57	36%	0.358	S	S	*	.	S	Bend	trans	-82.9	-52.1	179	-74.9	-74.1	0	0	0	112.1	L261 D275 I279	L261-F268 HydrophobicContact CD1-CD2 4.08Å; L261-F268 HydrophobicContact CD1-CE2 3.33Å; L261-F268 HydrophobicContact CD1-CZ 4.13Å; F268-D275 PolarHBondContact N-OD2 2.86Å; F268-I279 HydrophobicContact CD2-CD1 4.35Å; F268-I279 HydrophobicContact CE2-CD1 4.12Å; F268-I279 HydrophobicContact CE2-CG1 4.26Å
269	I	79.1	Confident	82.2	Confident	110 Å²	110	68.4 Å²	68.4	56%	0.564	35%	0.352	S	S	*	.	S	Bend	trans	-128.4	-68	-176.7	-56.6	174.1	0	0	0	109.8	N274 D275 V278	I269-N274 HydrophobicContact CB-CB 4.49Å; I269-N274 HydrophobicContact CD1-CB 4.26Å; I269-N274 HydrophobicContact CG2-CB 4.4Å; I269-D275 WeakPolarHBondContact CA-OD1 3.41Å; I269-D275 WeakPolarHBondContact CB-OD1 3.44Å; I269-D275 PolarHBondContact N-OD1 3.4Å; I269-V278 HydrophobicContact CD1-CG2 3.85Å
270	D	79.6	Confident	82.7	Confident	59 Å²	59	66 Å²	66	32%	0.316	34%	0.339	S	S	.	.	S	Bend	trans	-127	-11.2	-177.8	57.1	15.6	0	0	0	112.6	E272 N274 D275	D270-E272 PolarHBondContact O-N 3.03Å; D270-E272 PolarHBondContact OD1-N 3.28Å; D270-N274 PolarHBondContact OD1-N 2.93Å; D270-N274 WeakPolarHBondContact OD2-CB 3.22Å; D270-N274 PolarHBondContact OD2-ND2 3.38Å; D270-D275 PolarHBondContact N-OD1 2.99Å; D270-D275 VanDerWaalsContact N-OD1 3.12Å
271	G	74.8	Confident	83.2	Confident	0 Å²	0	66.7 Å²	66.7	0%	0	34%	0.342	C	S	.	.	S	Bend	trans	75.9	1.6	-175.4	0	0	0	0	0	112.4	R258 K262 I267 D275	R258-G271 WeakPolarHBondContact CD-O 3.4Å; K262-G271 VanDerWaalsContact CE-C 3.49Å; K262-G271 WeakPolarHBondContact CE-O 3.15Å; K262-G271 PolarHBondContact NZ-O 2.81Å; I267-G271 VanDerWaalsContact CG2-N 3.32Å; G271-D275 VanDerWaalsContact CA-OD2 3.24Å; G271-D275 WeakPolarHBondContact CA-OD2 3.21Å; G271-D275 VanDerWaalsContact N-CG 3.31Å; G271-D275 PolarHBondContact N-OD1 3.49Å; G271-D275 PolarHBondContact N-OD2 3.29Å
272	E	81.6	Confident	83.6	Confident	124 Å²	124	70.6 Å²	70.6	58%	0.579	36%	0.362	S	S	*	.	S	Bend	trans	-114.1	-118.7	-173.2	-63.7	-174.2	172.6	0	0	109.9	D270 I276	D270-E272 PolarHBondContact O-N 3.03Å; D270-E272 PolarHBondContact OD1-N 3.28Å; E272-I276 WeakPolarHBondContact O-CD1 3.31Å; E272-I276 WeakPolarHBondContact O-CG1 3.18Å; E272-I276 PolarHBondContact O-N 3.38Å
273	L	84.1	Confident	84.1	Confident	68 Å²	68	67.2 Å²	67.2	36%	0.356	35%	0.348	S	S	.	.	H	α-helix	trans	-76	-33.9	-170.9	-172.7	61.6	0	0	0	112.2	I276 R277	L273-I276 PolarHBondContact O-N 3.13Å; L273-R277 VanDerWaalsContact O-CG 3.3Å; L273-R277 WeakPolarHBondContact O-CG 3.38Å; L273-R277 PolarHBondContact O-N 2.82Å
274	N	86.7	Confident	84.9	Confident	60 Å²	60	61.5 Å²	61.5	32%	0.321	32%	0.321	S	S	.	.	H	α-helix	trans	-72.8	-36.8	-177.9	-67	-42.4	0	0	0	111.5	I269 D270 I276 R277 V278	I269-N274 HydrophobicContact CB-CB 4.49Å; I269-N274 HydrophobicContact CD1-CB 4.26Å; I269-N274 HydrophobicContact CG2-CB 4.4Å; D270-N274 PolarHBondContact OD1-N 2.93Å; D270-N274 WeakPolarHBondContact OD2-CB 3.22Å; D270-N274 PolarHBondContact OD2-ND2 3.38Å; N274-I276 VanDerWaalsContact C-N 3.34Å; N274-I276 PolarHBondContact O-N 3Å; N274-R277 PolarHBondContact O-N 3.38Å; N274-R277 PolarHBondContact OD1-NH1 3Å; N274-V278 WeakPolarHBondContact O-CG2 3.29Å; N274-V278 PolarHBondContact O-N 3.31Å
275	D	87	Confident	85.5	Confident	3 Å²	3	58.4 Å²	58.4	2%	0.016	31%	0.312	C	S	.	.	H	α-helix	trans	-59.6	-44.9	172.3	-73.8	28.7	0	0	0	111.1	R258 F268 I269 D270 G271 R277 V278 I279	R258-D275 HydrophobicContact CG-CB 4.08Å; F268-D275 PolarHBondContact N-OD2 2.86Å; I269-D275 WeakPolarHBondContact CA-OD1 3.41Å; I269-D275 WeakPolarHBondContact CB-OD1 3.44Å; I269-D275 PolarHBondContact N-OD1 3.4Å; D270-D275 PolarHBondContact N-OD1 2.99Å; D270-D275 VanDerWaalsContact N-OD1 3.12Å; G271-D275 VanDerWaalsContact CA-OD2 3.24Å; G271-D275 WeakPolarHBondContact CA-OD2 3.21Å; G271-D275 VanDerWaalsContact N-CG 3.31Å; G271-D275 PolarHBondContact N-OD1 3.49Å; G271-D275 PolarHBondContact N-OD2 3.29Å; D275-R277 VanDerWaalsContact C-N 3.35Å; D275-R277 PolarHBondContact O-N 3.48Å; D275-V278 PolarHBondContact O-N 3.22Å; D275-I279 WeakPolarHBondContact O-CB 3.35Å; D275-I279 WeakPolarHBondContact O-CD1 3.32Å; D275-I279 WeakPolarHBondContact O-CG1 3.5Å; D275-I279 PolarHBondContact O-N 2.82Å
276	I	87.2	Confident	86.1	Confident	9 Å²	9	59.6 Å²	59.6	5%	0.046	30%	0.303	C	S	.	.	H	α-helix	trans	-59.9	-44.7	175.3	-66.7	164.3	0	0	0	110.9	V251 A254 E255 R258 E272 L273 N274 G280	V251-I276 HydrophobicContact CG1-CG2 3.66Å; A254-I276 HydrophobicContact CB-CG2 3.94Å; A254-I276 WeakPolarHBondContact CB-O 3.31Å; E255-I276 HydrophobicContact CG-CD1 3.81Å; E255-I276 HydrophobicContact CG-CG1 4.21Å; E255-I276 HydrophobicContact CG-CG2 4.26Å; R258-I276 HydrophobicContact CB-CG1 4.27Å; R258-I276 HydrophobicContact CG-CG1 4.38Å; E272-I276 WeakPolarHBondContact O-CD1 3.31Å; E272-I276 WeakPolarHBondContact O-CG1 3.18Å; E272-I276 PolarHBondContact O-N 3.38Å; L273-I276 PolarHBondContact O-N 3.13Å; N274-I276 VanDerWaalsContact C-N 3.34Å; N274-I276 PolarHBondContact O-N 3Å; I276-G280 PolarHBondContact O-N 3.28Å
277	R	90.5	Very high	86.7	Confident	75 Å²	75	54.7 Å²	54.7	28%	0.283	28%	0.277	S	S	.	.	H	α-helix	trans	-61.3	-47.3	178.4	-73.5	166.5	171.1	159	0.5	111.5	L273 N274 D275 G280 I281 S521	L273-R277 VanDerWaalsContact O-CG 3.3Å; L273-R277 WeakPolarHBondContact O-CG 3.38Å; L273-R277 PolarHBondContact O-N 2.82Å; N274-R277 PolarHBondContact O-N 3.38Å; N274-R277 PolarHBondContact OD1-NH1 3Å; D275-R277 VanDerWaalsContact C-N 3.35Å; D275-R277 PolarHBondContact O-N 3.48Å; R277-G280 PolarHBondContact O-N 3.38Å; R277-I281 WeakPolarHBondContact O-CB 2.83Å; R277-I281 WeakPolarHBondContact O-CD1 3.2Å; R277-I281 WeakPolarHBondContact O-CG1 3.24Å; R277-I281 PolarHBondContact O-N 3.27Å; R277-S521 PolarHBondContact NE-O 3.4Å; R277-S521 PolarHBondContact NH2-O 3.12Å
278	V	90.1	Very high	87.3	Confident	56 Å²	56	51.1 Å²	51.1	34%	0.339	26%	0.259	S	S	.	.	H	α-helix	trans	-62.9	-49.1	-179.9	173.1	0	0	0	0	110.7	I269 N274 D275 G280 I281 L282	I269-V278 HydrophobicContact CD1-CG2 3.85Å; N274-V278 WeakPolarHBondContact O-CG2 3.29Å; N274-V278 PolarHBondContact O-N 3.31Å; D275-V278 PolarHBondContact O-N 3.22Å; V278-G280 VanDerWaalsContact C-N 3.33Å; V278-G280 PolarHBondContact O-N 3.31Å; V278-I281 PolarHBondContact O-N 3.39Å; V278-L282 HydrophobicContact CG1-CD1 4.26Å; V278-L282 WeakPolarHBondContact O-CG 3.48Å; V278-L282 PolarHBondContact O-N 3.3Å
279	I	90.6	Very high	88.2	Confident	8 Å²	8	47.6 Å²	47.6	4%	0.041	25%	0.254	C	S	.	.	H	α-helix	trans	-62.2	-42.2	178.1	-66.8	162.1	0	0	0	110.7	F253 A254 L257 R258 L261 F268 D275 I281 L282 T283	F253-I279 HydrophobicContact CD1-CG2 4.28Å; F253-I279 HydrophobicContact CE1-CG2 4.17Å; A254-I279 HydrophobicContact CB-CB 3.82Å; A254-I279 HydrophobicContact CB-CG2 3.61Å; L257-I279 HydrophobicContact CB-CG2 4.41Å; L257-I279 HydrophobicContact CD2-CD1 4.35Å; L257-I279 HydrophobicContact CD2-CG1 4.47Å; L257-I279 HydrophobicContact CD2-CG2 3.74Å; L257-I279 HydrophobicContact CG-CD1 4.37Å; R258-I279 HydrophobicContact CB-CD1 4.18Å; L261-I279 HydrophobicContact CD1-CD1 4.22Å; F268-I279 HydrophobicContact CD2-CD1 4.35Å; F268-I279 HydrophobicContact CE2-CD1 4.12Å; F268-I279 HydrophobicContact CE2-CG1 4.26Å; D275-I279 WeakPolarHBondContact O-CB 3.35Å; D275-I279 WeakPolarHBondContact O-CD1 3.32Å; D275-I279 WeakPolarHBondContact O-CG1 3.5Å; D275-I279 PolarHBondContact O-N 2.82Å; I279-I281 VanDerWaalsContact C-N 3.34Å; I279-I281 PolarHBondContact O-N 2.98Å; I279-L282 PolarHBondContact O-N 3.25Å; I279-T283 WeakPolarHBondContact O-CB 3.27Å; I279-T283 PolarHBondContact O-N 3.06Å; I279-T283 PolarHBondContact O-OG1 2.99Å
280	G	91.4	Very high	88.7	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.1	-41.8	177.1	0	0	0	0	0	112.3	I276 R277 V278 T283 M284	I276-G280 PolarHBondContact O-N 3.28Å; R277-G280 PolarHBondContact O-N 3.38Å; V278-G280 VanDerWaalsContact C-N 3.33Å; V278-G280 PolarHBondContact O-N 3.31Å; G280-T283 WeakPolarHBondContact O-CB 3.44Å; G280-T283 PolarHBondContact O-N 3.27Å; G280-M284 WeakPolarHBondContact O-CG 3.49Å; G280-M284 PolarHBondContact O-N 2.88Å
281	I	92.3	Very high	89	Confident	62 Å²	62	40.8 Å²	40.8	32%	0.318	22%	0.218	S	C	.	.	H	α-helix	trans	-62.8	-47	175.3	-71.3	166.6	0	0	0	110.8	R277 V278 I279 T283 M284 V285 L517 V520	R277-I281 WeakPolarHBondContact O-CB 2.83Å; R277-I281 WeakPolarHBondContact O-CD1 3.2Å; R277-I281 WeakPolarHBondContact O-CG1 3.24Å; R277-I281 PolarHBondContact O-N 3.27Å; V278-I281 PolarHBondContact O-N 3.39Å; I279-I281 VanDerWaalsContact C-N 3.34Å; I279-I281 PolarHBondContact O-N 2.98Å; I281-T283 VanDerWaalsContact C-N 3.27Å; I281-T283 PolarHBondContact O-N 3.39Å; I281-M284 WeakPolarHBondContact O-CB 3.24Å; I281-M284 PolarHBondContact O-N 3.07Å; I281-V285 WeakPolarHBondContact O-CG2 3.25Å; I281-V285 PolarHBondContact O-N 2.88Å; I281-L517 HydrophobicContact CB-CD2 4.02Å; I281-L517 HydrophobicContact CG1-CD2 3.72Å; I281-L517 HydrophobicContact CG2-CD2 3.69Å; I281-V520 HydrophobicContact CG1-CG1 4.27Å
282	L	92.9	Very high	89.6	Confident	111 Å²	111	43.3 Å²	43.3	58%	0.581	23%	0.233	S	C	*	.	H	α-helix	trans	-60.9	-38.7	176.4	-68.1	174	0	0	0	111.7	V278 I279 V285 L286	V278-L282 HydrophobicContact CG1-CD1 4.26Å; V278-L282 WeakPolarHBondContact O-CG 3.48Å; V278-L282 PolarHBondContact O-N 3.3Å; I279-L282 PolarHBondContact O-N 3.25Å; L282-V285 WeakPolarHBondContact O-CB 3.16Å; L282-V285 PolarHBondContact O-N 2.8Å; L282-L286 PolarHBondContact O-N 3.27Å
283	T	92.2	Very high	89.7	Confident	6 Å²	6	41.9 Å²	41.9	4%	0.037	23%	0.233	C	C	.	.	H	α-helix	trans	-64.4	-41.9	175.8	-54	0	0	0	0	111.2	F253 I279 G280 I281 V285 L286 I287 L466	F253-T283 HydrophobicContact CD1-CG2 3.91Å; F253-T283 VanDerWaalsContact CD1-OG1 3.25Å; F253-T283 WeakPolarHBondContact CD1-OG1 3.24Å; F253-T283 HydrophobicContact CE1-CG2 4.4Å; F253-T283 WeakPolarHBondContact CE1-OG1 3.38Å; F253-T283 HydrophobicContact CG-CG2 4.45Å; I279-T283 WeakPolarHBondContact O-CB 3.27Å; I279-T283 PolarHBondContact O-N 3.06Å; I279-T283 PolarHBondContact O-OG1 2.99Å; G280-T283 WeakPolarHBondContact O-CB 3.44Å; G280-T283 PolarHBondContact O-N 3.27Å; I281-T283 VanDerWaalsContact C-N 3.27Å; I281-T283 PolarHBondContact O-N 3.39Å; T283-V285 VanDerWaalsContact C-N 3.32Å; T283-V285 PolarHBondContact O-N 3.46Å; T283-L286 WeakPolarHBondContact O-CB 3.5Å; T283-L286 PolarHBondContact O-N 3.02Å; T283-I287 HydrophobicContact CG2-CD1 3.96Å; T283-I287 VanDerWaalsContact O-CG1 3.29Å; T283-I287 WeakPolarHBondContact O-CG1 3.44Å; T283-I287 PolarHBondContact O-N 2.98Å; T283-L466 HydrophobicContact CG2-CD1 4.12Å
284	M	92.9	Very high	89.6	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-62.8	-37.1	174.3	-72.5	-61.2	-58.5	0	0	112.4	S250 G280 I281 I287 L288 F473 F513 L517 V520	S250-M284 PolarHBondContact OG-SD 3.12Å; S250-M284 VanDerWaalsContact OG-SD 3.36Å; G280-M284 WeakPolarHBondContact O-CG 3.49Å; G280-M284 PolarHBondContact O-N 2.88Å; I281-M284 WeakPolarHBondContact O-CB 3.24Å; I281-M284 PolarHBondContact O-N 3.07Å; M284-I287 PolarHBondContact O-N 3.04Å; M284-L288 WeakPolarHBondContact O-CB 3.4Å; M284-L288 PolarHBondContact O-N 3.04Å; M284-F473 HydrophobicContact CE-CD2 3.7Å; M284-F473 HydrophobicContact CE-CE2 3.54Å; M284-F513 HydrophobicContact CB-CD2 4.29Å; M284-F513 HydrophobicContact CB-CE2 4.06Å; M284-L517 HydrophobicContact CB-CD2 4.46Å; M284-V520 HydrophobicContact CG-CG2 3.98Å
285	V	93.9	Very high	89.2	Confident	72 Å²	72	36.1 Å²	36.1	44%	0.436	20%	0.203	S	C	.	.	H	α-helix	trans	-64	-44.8	174.3	172.7	0	0	0	0	110.6	I281 L282 T283 L288 A289 F513	I281-V285 WeakPolarHBondContact O-CG2 3.25Å; I281-V285 PolarHBondContact O-N 2.88Å; L282-V285 WeakPolarHBondContact O-CB 3.16Å; L282-V285 PolarHBondContact O-N 2.8Å; T283-V285 VanDerWaalsContact C-N 3.32Å; T283-V285 PolarHBondContact O-N 3.46Å; V285-L288 PolarHBondContact O-N 2.78Å; V285-A289 PolarHBondContact O-N 2.93Å; V285-F513 HydrophobicContact CB-CE2 4.49Å; V285-F513 HydrophobicContact CG2-CE2 3.83Å; V285-F513 HydrophobicContact CG2-CZ 3.76Å
286	L	91.5	Very high	88.9	Confident	90 Å²	90	37.9 Å²	37.9	47%	0.471	22%	0.215	S	C	.	.	H	α-helix	trans	-60.9	-46.8	176.3	177.8	64.2	0	0	0	111.8	L282 T283 L288 A289 I290	L282-L286 PolarHBondContact O-N 3.27Å; T283-L286 WeakPolarHBondContact O-CB 3.5Å; T283-L286 PolarHBondContact O-N 3.02Å; L286-L288 VanDerWaalsContact C-N 3.35Å; L286-L288 PolarHBondContact O-N 2.95Å; L286-A289 WeakPolarHBondContact O-CB 3.48Å; L286-A289 PolarHBondContact O-N 2.8Å; L286-I290 HydrophobicContact CD1-CD1 4.25Å; L286-I290 HydrophobicContact CG-CD1 4.16Å; L286-I290 WeakPolarHBondContact O-CG1 3.45Å; L286-I290 PolarHBondContact O-N 2.95Å
287	I	92.8	Very high	88.8	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-61.6	-43.6	178.2	-70.6	165.8	0	0	0	110.9	S250 T283 M284 A289 I290 A291 L466 A469 L470 F473	S250-I287 WeakPolarHBondContact OG-CD1 3.43Å; T283-I287 HydrophobicContact CG2-CD1 3.96Å; T283-I287 VanDerWaalsContact O-CG1 3.29Å; T283-I287 WeakPolarHBondContact O-CG1 3.44Å; T283-I287 PolarHBondContact O-N 2.98Å; M284-I287 PolarHBondContact O-N 3.04Å; I287-A289 VanDerWaalsContact C-N 3.34Å; I287-A289 PolarHBondContact O-N 3.47Å; I287-I290 PolarHBondContact O-N 3.39Å; I287-A291 VanDerWaalsContact O-CB 3.32Å; I287-A291 WeakPolarHBondContact O-CB 3.17Å; I287-A291 PolarHBondContact O-N 3.06Å; I287-L466 HydrophobicContact CD1-CD1 4.17Å; I287-L466 HydrophobicContact CG1-CD1 3.85Å; I287-A469 HydrophobicContact CD1-CB 3.45Å; I287-A469 VanDerWaalsContact CD1-CB 3.45Å; I287-L470 HydrophobicContact CG2-CD1 3.95Å; I287-F473 HydrophobicContact CG2-CB 3.52Å; I287-F473 HydrophobicContact CG2-CD1 3.58Å; I287-F473 HydrophobicContact CG2-CD2 4.2Å; I287-F473 HydrophobicContact CG2-CE1 4.36Å; I287-F473 HydrophobicContact CG2-CG 3.49Å; I287-F473 VanDerWaalsContact CG2-CG 3.49Å
288	L	92.4	Very high	88.5	Confident	31 Å²	31	38.5 Å²	38.5	16%	0.162	22%	0.22	C	C	.	.	H	α-helix	trans	-59.5	-45.4	175.5	175.6	65.8	0	0	0	111.1	M284 V285 L286 I290 A291 V292 F473 F513	M284-L288 WeakPolarHBondContact O-CB 3.4Å; M284-L288 PolarHBondContact O-N 3.04Å; V285-L288 PolarHBondContact O-N 2.78Å; L286-L288 VanDerWaalsContact C-N 3.35Å; L286-L288 PolarHBondContact O-N 2.95Å; L288-I290 VanDerWaalsContact C-N 3.34Å; L288-I290 PolarHBondContact O-N 3.46Å; L288-A291 PolarHBondContact O-N 2.88Å; L288-V292 HydrophobicContact CD1-CG2 3.74Å; L288-V292 HydrophobicContact CG-CG2 4.23Å; L288-V292 WeakPolarHBondContact O-CB 3.34Å; L288-V292 VanDerWaalsContact O-CG2 3.28Å; L288-V292 WeakPolarHBondContact O-CG2 3.48Å; L288-V292 PolarHBondContact O-N 3.46Å; L288-F473 HydrophobicContact CB-CE1 4.3Å; L288-F473 HydrophobicContact CB-CZ 4.3Å; L288-F473 HydrophobicContact CD1-CE1 3.94Å; L288-F473 HydrophobicContact CD1-CZ 3.96Å; L288-F513 HydrophobicContact CB-CD2 3.96Å; L288-F513 HydrophobicContact CB-CE2 4.47Å; L288-F513 HydrophobicContact CD1-CB 4.27Å; L288-F513 HydrophobicContact CD2-CB 4.04Å; L288-F513 HydrophobicContact CD2-CD1 4.04Å; L288-F513 HydrophobicContact CD2-CD2 3.76Å; L288-F513 HydrophobicContact CD2-CE1 4.42Å; L288-F513 HydrophobicContact CD2-CE2 4.18Å; L288-F513 HydrophobicContact CD2-CG 3.68Å; L288-F513 HydrophobicContact CD2-CZ 4.48Å; L288-F513 HydrophobicContact CG-CD2 4.39Å
289	A	89.5	Confident	88.2	Confident	56 Å²	56	35.9 Å²	35.9	46%	0.463	20%	0.204	S	C	.	.	H	α-helix	trans	-58.4	-45.8	178.4	0	0	0	0	0	111.4	V285 L286 I287 V293	V285-A289 PolarHBondContact O-N 2.93Å; L286-A289 WeakPolarHBondContact O-CB 3.48Å; L286-A289 PolarHBondContact O-N 2.8Å; I287-A289 VanDerWaalsContact C-N 3.34Å; I287-A289 PolarHBondContact O-N 3.47Å; A289-V293 WeakPolarHBondContact O-CG2 3.29Å; A289-V293 PolarHBondContact O-N 2.84Å
290	I	88.6	Confident	88.1	Confident	25 Å²	25	42.1 Å²	42.1	13%	0.128	23%	0.231	C	C	.	.	H	α-helix	trans	-64.6	-44.1	177.3	-63.4	168.5	0	0	0	111.1	L286 I287 L288 V292 V293 F297 E298 L470	L286-I290 HydrophobicContact CD1-CD1 4.25Å; L286-I290 HydrophobicContact CG-CD1 4.16Å; L286-I290 WeakPolarHBondContact O-CG1 3.45Å; L286-I290 PolarHBondContact O-N 2.95Å; I287-I290 PolarHBondContact O-N 3.39Å; L288-I290 VanDerWaalsContact C-N 3.34Å; L288-I290 PolarHBondContact O-N 3.46Å; I290-V292 PolarHBondContact O-N 3Å; I290-V293 PolarHBondContact O-N 3.04Å; I290-F297 HydrophobicContact CG1-CE1 4.48Å; I290-F297 HydrophobicContact CG2-CD1 4.02Å; I290-F297 HydrophobicContact CG2-CE1 4.15Å; I290-E298 HydrophobicContact CG2-CB 4.38Å; I290-L470 HydrophobicContact CB-CD1 4.13Å; I290-L470 HydrophobicContact CG2-CD1 3.83Å; I290-L470 HydrophobicContact CG2-CD2 3.83Å; I290-L470 HydrophobicContact CG2-CG 4.5Å
291	A	86.6	Confident	87.9	Confident	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-66.3	-37.3	-177.9	0	0	0	0	0	112.9	I287 L288 V293 G294 F473 V474 Y509	I287-A291 VanDerWaalsContact O-CB 3.32Å; I287-A291 WeakPolarHBondContact O-CB 3.17Å; I287-A291 PolarHBondContact O-N 3.06Å; L288-A291 PolarHBondContact O-N 2.88Å; A291-V293 VanDerWaalsContact C-N 3.35Å; A291-V293 PolarHBondContact O-N 2.97Å; A291-G294 WeakPolarHBondContact O-CA 3.23Å; A291-G294 PolarHBondContact O-N 3.35Å; A291-G294 VanDerWaalsContact O-N 3.14Å; A291-F473 HydrophobicContact CB-CD1 3.78Å; A291-F473 HydrophobicContact CB-CE1 3.96Å; A291-V474 HydrophobicContact CB-CG2 4.04Å; A291-Y509 HydrophobicContact CB-CD1 4.07Å; A291-Y509 HydrophobicContact CB-CE1 3.84Å
292	V	86.3	Confident	87.7	Confident	53 Å²	53	40.2 Å²	40.2	32%	0.321	23%	0.225	S	C	.	.	H	α-helix	trans	-69.6	-30	-179.9	169.9	0	0	0	0	112.7	L288 I290 G294	L288-V292 HydrophobicContact CD1-CG2 3.74Å; L288-V292 HydrophobicContact CG-CG2 4.23Å; L288-V292 WeakPolarHBondContact O-CB 3.34Å; L288-V292 VanDerWaalsContact O-CG2 3.28Å; L288-V292 WeakPolarHBondContact O-CG2 3.48Å; L288-V292 PolarHBondContact O-N 3.46Å; I290-V292 PolarHBondContact O-N 3Å; V292-G294 PolarHBondContact O-N 3.45Å
293	V	85.3	Confident	87.6	Confident	95 Å²	95	39.9 Å²	39.9	58%	0.576	22%	0.216	S	C	*	.	H	α-helix	trans	-62.6	-31.3	172.5	177.7	0	0	0	0	110.7	A289 I290 A291 F297	A289-V293 WeakPolarHBondContact O-CG2 3.29Å; A289-V293 PolarHBondContact O-N 2.84Å; I290-V293 PolarHBondContact O-N 3.04Å; A291-V293 VanDerWaalsContact C-N 3.35Å; A291-V293 PolarHBondContact O-N 2.97Å; V293-F297 HydrophobicContact CB-CB 4.23Å; V293-F297 HydrophobicContact CB-CD1 4.13Å; V293-F297 HydrophobicContact CB-CG 4.31Å; V293-F297 HydrophobicContact CG1-CB 3.55Å; V293-F297 HydrophobicContact CG1-CD1 3.97Å; V293-F297 HydrophobicContact CG1-CD2 4.28Å; V293-F297 HydrophobicContact CG1-CG 3.67Å
294	G	80.2	Confident	87.6	Confident	1 Å²	1	44.1 Å²	44.1	1%	0.01	24%	0.242	C	C	.	.			trans	119.2	165.2	167.4	0	0	0	0	0	114	A291 V292 S296 F297 E298	A291-G294 WeakPolarHBondContact O-CA 3.23Å; A291-G294 PolarHBondContact O-N 3.35Å; A291-G294 VanDerWaalsContact O-N 3.14Å; V292-G294 PolarHBondContact O-N 3.45Å; G294-S296 PolarHBondContact O-N 3.39Å; G294-S296 VanDerWaalsContact O-N 3.11Å; G294-F297 PolarHBondContact O-N 3.46Å; G294-E298 PolarHBondContact O-N 3.43Å; G294-E298 VanDerWaalsContact O-N 3.09Å
295	V	80.1	Confident	87.5	Confident	5 Å²	5	45 Å²	45	3%	0.03	25%	0.246	C	C	.	.	H	α-helix	trans	-58.4	-29.7	-172.4	174.9	0	0	0	0	113.5	L151 S299 I374 V474 E504	L151-V295 HydrophobicContact CD1-CG1 3.86Å; V295-S299 WeakPolarHBondContact O-CB 3.47Å; V295-S299 PolarHBondContact O-N 3.47Å; V295-S299 PolarHBondContact O-OG 3.28Å; V295-I374 HydrophobicContact CG1-CD1 4.49Å; V295-V474 HydrophobicContact CG2-CG1 3.96Å; V295-E504 WeakPolarHBondContact CG2-OE1 3.28Å; V295-E504 PolarHBondContact N-OE1 2.94Å
296	S	80	Confident	87.5	Confident	40 Å²	40	43 Å²	43	28%	0.28	23%	0.232	S	C	.	.	H	α-helix	trans	-68.8	-32.4	176.7	54.4	0	0	0	0	113.6	G294 S299 K300	G294-S296 PolarHBondContact O-N 3.39Å; G294-S296 VanDerWaalsContact O-N 3.11Å; S296-S299 PolarHBondContact O-OG 2.98Å; S296-K300 WeakPolarHBondContact O-CG 3.25Å
297	F	84.2	Confident	87.6	Confident	97 Å²	97	42.7 Å²	42.7	43%	0.425	23%	0.234	S	C	.	.	H	α-helix	trans	-80.1	-42.3	175.1	-178.9	-99.3	0	0	0	110.3	I290 V293 G294 S299 K300 A301	I290-F297 HydrophobicContact CG1-CE1 4.48Å; I290-F297 HydrophobicContact CG2-CD1 4.02Å; I290-F297 HydrophobicContact CG2-CE1 4.15Å; V293-F297 HydrophobicContact CB-CB 4.23Å; V293-F297 HydrophobicContact CB-CD1 4.13Å; V293-F297 HydrophobicContact CB-CG 4.31Å; V293-F297 HydrophobicContact CG1-CB 3.55Å; V293-F297 HydrophobicContact CG1-CD1 3.97Å; V293-F297 HydrophobicContact CG1-CD2 4.28Å; V293-F297 HydrophobicContact CG1-CG 3.67Å; G294-F297 PolarHBondContact O-N 3.46Å; F297-S299 PolarHBondContact O-N 2.76Å; F297-K300 WeakPolarHBondContact O-CB 3.43Å; F297-K300 PolarHBondContact O-N 3.27Å; F297-A301 PolarHBondContact O-N 3.19Å
298	E	85.5	Confident	87.7	Confident	0 Å²	0	44.9 Å²	44.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-54.5	-47.8	174.1	179.1	-107.9	-168.6	0	0	112.6	R160 I290 G294 K300 A301 Q302 L470 V474	R160-E298 IonicContact CZ-OE1 3.99Å; R160-E298 IonicContact CZ-OE2 2.67Å; R160-E298 IonicContact NH1-OE1 3.9Å; R160-E298 PolarHBondContact NH1-OE1 3.47Å; R160-E298 IonicContact NH1-OE2 3.22Å; R160-E298 PolarHBondContact NH1-OE2 2.84Å; R160-E298 IonicContact NH2-OE1 2.94Å; R160-E298 PolarHBondContact NH2-OE1 3.12Å; R160-E298 IonicContact NH2-OE2 3.64Å; I290-E298 HydrophobicContact CG2-CB 4.38Å; G294-E298 PolarHBondContact O-N 3.43Å; G294-E298 VanDerWaalsContact O-N 3.09Å; E298-K300 VanDerWaalsContact C-N 3.29Å; E298-K300 PolarHBondContact O-N 3.45Å; E298-A301 WeakPolarHBondContact O-CB 3.42Å; E298-A301 PolarHBondContact O-N 2.9Å; E298-A301 VanDerWaalsContact O-N 3.13Å; E298-Q302 PolarHBondContact O-N 2.93Å; E298-Q302 PolarHBondContact OE1-NE2 2.88Å; E298-L470 HydrophobicContact CB-CD2 4.48Å; E298-L470 HydrophobicContact CG-CD1 3.9Å; E298-L470 HydrophobicContact CG-CD2 3.54Å; E298-L470 HydrophobicContact CG-CG 3.53Å; E298-V474 HydrophobicContact CG-CG2 4.14Å
299	S	84.1	Confident	87.7	Confident	1 Å²	1	43.5 Å²	43.5	1%	0.007	24%	0.24	C	C	.	.	H	α-helix	trans	-65.6	-27.2	176.2	56.8	0	0	0	0	113.9	Q155 V295 S296 F297 W303	Q155-S299 PolarHBondContact NE2-OG 3.46Å; V295-S299 WeakPolarHBondContact O-CB 3.47Å; V295-S299 PolarHBondContact O-N 3.47Å; V295-S299 PolarHBondContact O-OG 3.28Å; S296-S299 PolarHBondContact O-OG 2.98Å; F297-S299 PolarHBondContact O-N 2.76Å; S299-W303 VanDerWaalsContact O-CD1 3.26Å; S299-W303 PolarHBondContact O-N 2.93Å
300	K	87.6	Confident	87.9	Confident	139 Å²	139	44.3 Å²	44.3	60%	0.604	24%	0.239	S	C	*	.	H	α-helix	trans	-72.2	-39.3	170.6	-72	175.2	-177.9	-175.5	0	111.5	S296 F297 E298 Q302 W303 V304	S296-K300 WeakPolarHBondContact O-CG 3.25Å; F297-K300 WeakPolarHBondContact O-CB 3.43Å; F297-K300 PolarHBondContact O-N 3.27Å; E298-K300 VanDerWaalsContact C-N 3.29Å; E298-K300 PolarHBondContact O-N 3.45Å; K300-Q302 VanDerWaalsContact C-N 3.28Å; K300-Q302 PolarHBondContact O-N 3.44Å; K300-W303 WeakPolarHBondContact O-CB 3.17Å; K300-W303 PolarHBondContact O-N 3.43Å; K300-V304 PolarHBondContact O-N 3.2Å
301	A	87.7	Confident	88.2	Confident	22 Å²	22	46.4 Å²	46.4	18%	0.182	25%	0.253	C	S	.	.	H	α-helix	trans	-62.2	-37.5	174.1	0	0	0	0	0	111.5	F297 E298 W303 V304 M305	F297-A301 PolarHBondContact O-N 3.19Å; E298-A301 WeakPolarHBondContact O-CB 3.42Å; E298-A301 PolarHBondContact O-N 2.9Å; E298-A301 VanDerWaalsContact O-N 3.13Å; A301-W303 VanDerWaalsContact C-N 3.3Å; A301-W303 PolarHBondContact O-N 3.24Å; A301-V304 WeakPolarHBondContact O-CB 3.23Å; A301-V304 PolarHBondContact O-N 3.34Å; A301-V304 VanDerWaalsContact O-N 3.13Å; A301-M305 HydrophobicContact CB-CE 4.44Å; A301-M305 PolarHBondContact O-N 2.96Å
302	Q	88.5	Confident	88.6	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-60.2	-35.7	174.2	-77.1	176.8	-6.7	0	0	113.3	V159 L163 E298 K300 M305 L306	V159-Q302 HydrophobicContact CG1-CB 4.03Å; L163-Q302 HydrophobicContact CD1-CB 3.77Å; L163-Q302 HydrophobicContact CD1-CG 4.05Å; L163-Q302 WeakPolarHBondContact CD1-O 3.26Å; E298-Q302 PolarHBondContact O-N 2.93Å; E298-Q302 PolarHBondContact OE1-NE2 2.88Å; K300-Q302 VanDerWaalsContact C-N 3.28Å; K300-Q302 PolarHBondContact O-N 3.44Å; Q302-M305 HydrophobicContact CB-CE 4.47Å; Q302-M305 HydrophobicContact CG-CE 3.94Å; Q302-M305 PolarHBondContact O-N 3.44Å; Q302-L306 WeakPolarHBondContact O-CB 3.42Å; Q302-L306 PolarHBondContact O-N 3.37Å
303	W	89.8	Confident	88.9	Confident	104 Å²	104	44.9 Å²	44.9	39%	0.394	24%	0.243	S	C	.	.	H	α-helix	trans	-63.1	-41.5	173.5	-83.8	104.5	0	0	0	112.5	I154 V159 S299 K300 A301 L306 V307	I154-W303 HydrophobicContact CG2-CH2 3.81Å; I154-W303 HydrophobicContact CG2-CZ2 3.74Å; V159-W303 HydrophobicContact CG2-CD2 4.45Å; V159-W303 HydrophobicContact CG2-CH2 4.07Å; V159-W303 HydrophobicContact CG2-CZ2 3.88Å; V159-W303 HydrophobicContact CG2-CZ3 4.43Å; S299-W303 VanDerWaalsContact O-CD1 3.26Å; S299-W303 PolarHBondContact O-N 2.93Å; K300-W303 WeakPolarHBondContact O-CB 3.17Å; K300-W303 PolarHBondContact O-N 3.43Å; A301-W303 VanDerWaalsContact C-N 3.3Å; A301-W303 PolarHBondContact O-N 3.24Å; W303-L306 HydrophobicContact CE3-CD2 4.22Å; W303-L306 HydrophobicContact CZ3-CD2 4.18Å; W303-L306 PolarHBondContact O-N 3.33Å; W303-V307 WeakPolarHBondContact O-CG2 3.33Å; W303-V307 PolarHBondContact O-N 2.88Å
304	V	92	Very high	89.4	Confident	96 Å²	96	44.2 Å²	44.2	58%	0.582	24%	0.239	S	C	*	.	H	α-helix	trans	-63	-47.4	176	179.5	0	0	0	0	110.2	K300 A301 L306 V307 V308	K300-V304 PolarHBondContact O-N 3.2Å; A301-V304 WeakPolarHBondContact O-CB 3.23Å; A301-V304 PolarHBondContact O-N 3.34Å; A301-V304 VanDerWaalsContact O-N 3.13Å; V304-L306 VanDerWaalsContact C-N 3.31Å; V304-L306 PolarHBondContact O-N 2.98Å; V304-V307 PolarHBondContact O-N 3.13Å; V304-V308 WeakPolarHBondContact O-CG2 3.32Å; V304-V308 PolarHBondContact O-N 2.94Å
305	M	92	Very high	90.1	Very high	18 Å²	18	45 Å²	45	9%	0.089	24%	0.243	C	C	.	.	H	α-helix	trans	-62.7	-36.9	177.7	-68.5	-176.4	-69.2	0	0	112.3	A301 Q302 V308 L309 A463 L466 L470	A301-M305 HydrophobicContact CB-CE 4.44Å; A301-M305 PolarHBondContact O-N 2.96Å; Q302-M305 HydrophobicContact CB-CE 4.47Å; Q302-M305 HydrophobicContact CG-CE 3.94Å; Q302-M305 PolarHBondContact O-N 3.44Å; M305-V308 PolarHBondContact O-N 2.93Å; M305-L309 VanDerWaalsContact O-CB 3.25Å; M305-L309 WeakPolarHBondContact O-CB 3.27Å; M305-L309 PolarHBondContact O-N 3.08Å; M305-A463 HydrophobicContact CB-CB 4.07Å; M305-A463 HydrophobicContact CG-CB 4.34Å; M305-L466 HydrophobicContact SD-CB 4.07Å; M305-L466 HydrophobicContact SD-CD2 4.14Å; M305-L466 HydrophobicContact SD-CG 4.05Å; M305-L470 HydrophobicContact CE-CD2 3.99Å
306	L	93.2	Very high	90.8	Very high	29 Å²	29	44.9 Å²	44.9	15%	0.152	24%	0.242	C	C	.	.	H	α-helix	trans	-64.5	-41.8	174.9	-176.6	67.8	0	0	0	112.3	V159 V162 L163 Q302 W303 V304 L309 T310	V159-L306 HydrophobicContact CB-CD2 4.49Å; V159-L306 HydrophobicContact CG1-CB 4.44Å; V159-L306 HydrophobicContact CG1-CD2 4.08Å; V159-L306 HydrophobicContact CG2-CD2 3.9Å; V162-L306 HydrophobicContact CG1-CD1 4.23Å; L163-L306 HydrophobicContact CD1-CB 4.24Å; L163-L306 HydrophobicContact CD2-CB 4.09Å; L163-L306 HydrophobicContact CD2-CD1 3.83Å; L163-L306 HydrophobicContact CG-CB 4.46Å; L163-L306 HydrophobicContact CG-CD1 4.2Å; Q302-L306 WeakPolarHBondContact O-CB 3.42Å; Q302-L306 PolarHBondContact O-N 3.37Å; W303-L306 HydrophobicContact CE3-CD2 4.22Å; W303-L306 HydrophobicContact CZ3-CD2 4.18Å; W303-L306 PolarHBondContact O-N 3.33Å; V304-L306 VanDerWaalsContact C-N 3.31Å; V304-L306 PolarHBondContact O-N 2.98Å; L306-L309 PolarHBondContact O-N 3.37Å; L306-T310 VanDerWaalsContact O-CB 3.31Å; L306-T310 WeakPolarHBondContact O-CB 3.38Å; L306-T310 PolarHBondContact O-N 3.49Å; L306-T310 PolarHBondContact O-OG1 3.34Å
307	V	94.4	Very high	91.5	Very high	84 Å²	84	46.9 Å²	46.9	51%	0.509	25%	0.25	S	C	.	.	H	α-helix	trans	-63.6	-47.9	176.9	171.4	0	0	0	0	110.1	W303 V304 L309 T310 V311	W303-V307 WeakPolarHBondContact O-CG2 3.33Å; W303-V307 PolarHBondContact O-N 2.88Å; V304-V307 PolarHBondContact O-N 3.13Å; V307-L309 VanDerWaalsContact C-N 3.33Å; V307-L309 PolarHBondContact O-N 3.32Å; V307-T310 PolarHBondContact O-N 3.1Å; V307-V311 HydrophobicContact CG1-CG2 4.3Å; V307-V311 WeakPolarHBondContact O-CB 3.4Å; V307-V311 VanDerWaalsContact O-CG2 3.26Å; V307-V311 WeakPolarHBondContact O-CG2 3.34Å; V307-V311 PolarHBondContact O-N 3.04Å
308	V	94.4	Very high	91.9	Very high	47 Å²	47	45.6 Å²	45.6	29%	0.285	25%	0.249	S	C	.	.	H	α-helix	trans	-58.2	-46.7	177.1	174.6	0	0	0	0	110.9	V304 M305 T310 V311 S312 A459 A463	V304-V308 WeakPolarHBondContact O-CG2 3.32Å; V304-V308 PolarHBondContact O-N 2.94Å; M305-V308 PolarHBondContact O-N 2.93Å; V308-T310 PolarHBondContact O-N 3.08Å; V308-V311 PolarHBondContact O-N 2.92Å; V308-S312 WeakPolarHBondContact O-CB 3.49Å; V308-S312 PolarHBondContact O-N 2.81Å; V308-S312 PolarHBondContact O-OG 2.8Å; V308-A459 HydrophobicContact CG1-CB 4.08Å; V308-A463 HydrophobicContact CB-CB 4.07Å; V308-A463 HydrophobicContact CG1-CB 3.91Å
309	L	92.1	Very high	92.3	Very high	1 Å²	1	46 Å²	46	1%	0.005	25%	0.253	C	S	.	.	H	α-helix	trans	-64.3	-39.1	178	-179	62	0	0	0	112.9	L163 L166 F171 M305 L306 V307 S312 L313 A464	L163-L309 HydrophobicContact CD2-CD2 3.71Å; L166-L309 HydrophobicContact CB-CD2 4.17Å; L166-L309 HydrophobicContact CD1-CD2 3.65Å; L166-L309 HydrophobicContact CD1-CG 4.49Å; F171-L309 HydrophobicContact CE2-CD1 3.47Å; F171-L309 VanDerWaalsContact CE2-CD1 3.47Å; F171-L309 HydrophobicContact CZ-CD1 3.51Å; M305-L309 VanDerWaalsContact O-CB 3.25Å; M305-L309 WeakPolarHBondContact O-CB 3.27Å; M305-L309 PolarHBondContact O-N 3.08Å; L306-L309 PolarHBondContact O-N 3.37Å; V307-L309 VanDerWaalsContact C-N 3.33Å; V307-L309 PolarHBondContact O-N 3.32Å; L309-S312 WeakPolarHBondContact CA-OG 3.42Å; L309-S312 PolarHBondContact O-N 3Å; L309-S312 PolarHBondContact O-OG 2.79Å; L309-L313 HydrophobicContact CG-CD1 4.49Å; L309-L313 VanDerWaalsContact O-CG 3.3Å; L309-L313 WeakPolarHBondContact O-CG 3.48Å; L309-L313 PolarHBondContact O-N 2.82Å; L309-A464 HydrophobicContact CD1-CB 4.12Å; L309-A464 HydrophobicContact CD2-CB 4.45Å
310	T	92.9	Very high	92.7	Very high	73 Å²	73	46.2 Å²	46.2	45%	0.448	26%	0.255	S	S	.	.	H	α-helix	trans	-68	-44.7	178.9	-56	0	0	0	0	110.1	L306 V307 V308 S312 L313 V314	L306-T310 VanDerWaalsContact O-CB 3.31Å; L306-T310 WeakPolarHBondContact O-CB 3.38Å; L306-T310 PolarHBondContact O-N 3.49Å; L306-T310 PolarHBondContact O-OG1 3.34Å; V307-T310 PolarHBondContact O-N 3.1Å; V308-T310 PolarHBondContact O-N 3.08Å; T310-S312 VanDerWaalsContact C-N 3.32Å; T310-S312 PolarHBondContact O-N 3.24Å; T310-L313 PolarHBondContact O-N 2.97Å; T310-V314 WeakPolarHBondContact O-CG2 3.45Å; T310-V314 PolarHBondContact O-N 3.26Å
311	V	95.7	Very high	92.9	Very high	69 Å²	69	45.7 Å²	45.7	42%	0.418	26%	0.258	S	S	.	.	H	α-helix	trans	-63.5	-38.8	176.9	172.1	0	0	0	0	110.8	V307 V308 L313 V314 D315 L456	V307-V311 HydrophobicContact CG1-CG2 4.3Å; V307-V311 WeakPolarHBondContact O-CB 3.4Å; V307-V311 VanDerWaalsContact O-CG2 3.26Å; V307-V311 WeakPolarHBondContact O-CG2 3.34Å; V307-V311 PolarHBondContact O-N 3.04Å; V308-V311 PolarHBondContact O-N 2.92Å; V311-L313 PolarHBondContact O-N 3.41Å; V311-V314 PolarHBondContact O-N 2.93Å; V311-D315 WeakPolarHBondContact O-CB 3.35Å; V311-D315 PolarHBondContact O-N 3.28Å; V311-L456 HydrophobicContact CG1-CD1 4.04Å; V311-L456 HydrophobicContact CG1-CD2 3.84Å; V311-L456 HydrophobicContact CG1-CG 4.28Å
312	S	94.5	Very high	93.2	Very high	0 Å²	0	49.2 Å²	49.2	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-66.2	-35.8	175.8	74.6	0	0	0	0	112.9	V308 L309 T310 D315 F316 L456 G460	V308-S312 WeakPolarHBondContact O-CB 3.49Å; V308-S312 PolarHBondContact O-N 2.81Å; V308-S312 PolarHBondContact O-OG 2.8Å; L309-S312 WeakPolarHBondContact CA-OG 3.42Å; L309-S312 PolarHBondContact O-N 3Å; L309-S312 PolarHBondContact O-OG 2.79Å; T310-S312 VanDerWaalsContact C-N 3.32Å; T310-S312 PolarHBondContact O-N 3.24Å; S312-D315 PolarHBondContact O-N 2.9Å; S312-F316 WeakPolarHBondContact O-CB 3.27Å; S312-F316 PolarHBondContact O-N 2.82Å; S312-L456 WeakPolarHBondContact CB-O 3.33Å; S312-G460 WeakPolarHBondContact OG-CA 3.38Å
313	L	93.3	Very high	93.2	Very high	21 Å²	21	54.3 Å²	54.3	11%	0.11	31%	0.306	C	S	.	.	H	α-helix	trans	-70.4	-34.6	174.3	-70.5	173.9	0	0	0	112	L170 F171 L309 T310 V311 L317 I399	L170-L313 HydrophobicContact CD2-CD1 4.38Å; L170-L313 HydrophobicContact CD2-CD2 3.81Å; F171-L313 HydrophobicContact CE1-CD2 4.4Å; F171-L313 HydrophobicContact CZ-CD2 4.21Å; L309-L313 HydrophobicContact CG-CD1 4.49Å; L309-L313 VanDerWaalsContact O-CG 3.3Å; L309-L313 WeakPolarHBondContact O-CG 3.48Å; L309-L313 PolarHBondContact O-N 2.82Å; T310-L313 PolarHBondContact O-N 2.97Å; V311-L313 PolarHBondContact O-N 3.41Å; L313-L317 VanDerWaalsContact O-CG 3.3Å; L313-L317 WeakPolarHBondContact O-CG 3.31Å; L313-L317 PolarHBondContact O-N 3.27Å; L313-I399 HydrophobicContact CD1-CD1 4.47Å; L313-I399 HydrophobicContact CD1-CG2 4.03Å
314	V	95.1	Very high	93.2	Very high	81 Å²	81	50.6 Å²	50.6	49%	0.491	30%	0.295	S	S	.	.	H	α-helix	trans	-67.4	-43.1	172.3	173.5	0	0	0	0	110.7	T310 V311 F316 L317 V318	T310-V314 WeakPolarHBondContact O-CG2 3.45Å; T310-V314 PolarHBondContact O-N 3.26Å; V311-V314 PolarHBondContact O-N 2.93Å; V314-F316 VanDerWaalsContact C-N 3.34Å; V314-F316 PolarHBondContact O-N 3.44Å; V314-L317 PolarHBondContact O-N 3.04Å; V314-L317 VanDerWaalsContact O-N 3.17Å; V314-V318 HydrophobicContact CG1-CG2 4.14Å; V314-V318 WeakPolarHBondContact O-CB 3.36Å; V314-V318 VanDerWaalsContact O-CG2 3.31Å; V314-V318 WeakPolarHBondContact O-CG2 3.25Å; V314-V318 PolarHBondContact O-N 3.01Å
315	D	96.2	Very high	93	Very high	19 Å²	19	51.4 Å²	51.4	10%	0.102	30%	0.296	C	S	.	.	H	α-helix	trans	-58.8	-44.6	175.3	-177	80	0	0	0	112.2	V311 S312 V318 G319 G451 A452 W453 L456	V311-D315 WeakPolarHBondContact O-CB 3.35Å; V311-D315 PolarHBondContact O-N 3.28Å; S312-D315 PolarHBondContact O-N 2.9Å; D315-V318 PolarHBondContact O-N 3.34Å; D315-G319 PolarHBondContact O-N 3.08Å; D315-G451 WeakPolarHBondContact OD2-CA 3.41Å; D315-A452 PolarHBondContact O-N 3.49Å; D315-A452 VanDerWaalsContact O-N 3.16Å; D315-A452 PolarHBondContact OD2-N 3.05Å; D315-A452 VanDerWaalsContact OD2-N 3.17Å; D315-W453 PolarHBondContact OD1-N 3.43Å; D315-W453 VanDerWaalsContact OD1-N 3.14Å; D315-W453 PolarHBondContact OD2-N 3.27Å; D315-L456 HydrophobicContact CB-CD2 3.69Å; D315-L456 HydrophobicContact CB-CG 4.18Å
316	F	94.2	Very high	92.6	Very high	2 Å²	2	56.7 Å²	56.7	1%	0.009	32%	0.321	C	S	.	.	H	α-helix	trans	-55	-50.4	170.6	159.9	-109.6	0	0	0	112.3	S312 V314 G319 T320 T403 V406 T407 L447 L450	S312-F316 WeakPolarHBondContact O-CB 3.27Å; S312-F316 PolarHBondContact O-N 2.82Å; V314-F316 VanDerWaalsContact C-N 3.34Å; V314-F316 PolarHBondContact O-N 3.44Å; F316-G319 PolarHBondContact O-N 3.16Å; F316-T320 HydrophobicContact CD2-CG2 4.2Å; F316-T320 HydrophobicContact CE2-CG2 3.85Å; F316-T320 HydrophobicContact CZ-CG2 4.3Å; F316-T320 WeakPolarHBondContact O-CG2 3.38Å; F316-T320 PolarHBondContact O-N 2.99Å; F316-T320 VanDerWaalsContact O-N 3.13Å; F316-T403 HydrophobicContact CE1-CG2 4.44Å; F316-T403 HydrophobicContact CZ-CG2 4.34Å; F316-V406 HydrophobicContact CE1-CB 4.44Å; F316-V406 HydrophobicContact CE1-CG1 4.15Å; F316-V406 HydrophobicContact CE2-CG1 4.19Å; F316-V406 HydrophobicContact CZ-CB 4Å; F316-V406 HydrophobicContact CZ-CG1 3.53Å; F316-T407 HydrophobicContact CE2-CG2 4.39Å; F316-T407 HydrophobicContact CZ-CG2 4.22Å; F316-L447 HydrophobicContact CD2-CB 4.19Å; F316-L447 HydrophobicContact CD2-CG 3.98Å; F316-L447 HydrophobicContact CE2-CB 4.46Å; F316-L447 HydrophobicContact CE2-CG 3.86Å; F316-L447 HydrophobicContact CG-CG 4.47Å; F316-L447 HydrophobicContact CZ-CG 4.26Å; F316-L450 HydrophobicContact CD2-CB 3.84Å; F316-L450 HydrophobicContact CE2-CB 3.82Å; F316-L450 HydrophobicContact CE2-CD1 3.71Å; F316-L450 HydrophobicContact CE2-CG 4.45Å
317	L	93.6	Very high	92.3	Very high	82 Å²	82	58.8 Å²	58.8	43%	0.429	34%	0.335	S	S	.	.	H	α-helix	trans	-66.7	-40.3	-179.9	-70.3	172.3	0	0	0	112.3	L313 V314 T320 V406	L313-L317 VanDerWaalsContact O-CG 3.3Å; L313-L317 WeakPolarHBondContact O-CG 3.31Å; L313-L317 PolarHBondContact O-N 3.27Å; V314-L317 PolarHBondContact O-N 3.04Å; V314-L317 VanDerWaalsContact O-N 3.17Å; L317-T320 PolarHBondContact O-N 2.71Å; L317-T320 PolarHBondContact O-OG1 3.45Å; L317-V406 HydrophobicContact CD2-CG2 4.04Å
318	V	94.1	Very high	91.9	Very high	70 Å²	70	56.6 Å²	56.6	42%	0.424	32%	0.319	S	S	.	.	H	α-helix	trans	-64.9	-42.6	176.7	171.4	0	0	0	0	110.6	V314 D315 T320 L321 L322 A452	V314-V318 HydrophobicContact CG1-CG2 4.14Å; V314-V318 WeakPolarHBondContact O-CB 3.36Å; V314-V318 VanDerWaalsContact O-CG2 3.31Å; V314-V318 WeakPolarHBondContact O-CG2 3.25Å; V314-V318 PolarHBondContact O-N 3.01Å; D315-V318 PolarHBondContact O-N 3.34Å; V318-T320 VanDerWaalsContact C-N 3.28Å; V318-T320 PolarHBondContact O-N 3.44Å; V318-L321 WeakPolarHBondContact O-CB 3.24Å; V318-L321 PolarHBondContact O-N 3.36Å; V318-L322 PolarHBondContact O-N 3.36Å; V318-A452 HydrophobicContact CG1-CB 4.27Å
319	G	92.5	Very high	91.6	Very high	8 Å²	8	58.2 Å²	58.2	8%	0.082	32%	0.323	C	S	.	.	H	α-helix	trans	-60.4	-37.6	177.6	0	0	0	0	0	112.8	D315 F316 L321 L322 L450	D315-G319 PolarHBondContact O-N 3.08Å; F316-G319 PolarHBondContact O-N 3.16Å; G319-L321 PolarHBondContact O-N 3.48Å; G319-L322 WeakPolarHBondContact O-CB 3.37Å; G319-L322 PolarHBondContact O-N 3.32Å; G319-L450 CarbonylContact C-O 3.18Å; G319-L450 WeakPolarHBondContact CA-O 3.28Å
320	T	93.1	Very high	91.3	Very high	6 Å²	6	58.2 Å²	58.2	4%	0.037	32%	0.324	C	S	.	.	H	α-helix	trans	-65.7	-19	176.3	64.5	0	0	0	0	114	F316 L317 V318 Y336 V406 L450	F316-T320 HydrophobicContact CD2-CG2 4.2Å; F316-T320 HydrophobicContact CE2-CG2 3.85Å; F316-T320 HydrophobicContact CZ-CG2 4.3Å; F316-T320 WeakPolarHBondContact O-CG2 3.38Å; F316-T320 PolarHBondContact O-N 2.99Å; F316-T320 VanDerWaalsContact O-N 3.13Å; L317-T320 PolarHBondContact O-N 2.71Å; L317-T320 PolarHBondContact O-OG1 3.45Å; V318-T320 VanDerWaalsContact C-N 3.28Å; V318-T320 PolarHBondContact O-N 3.44Å; T320-Y336 WeakPolarHBondContact O-CD2 3.17Å; T320-Y336 WeakPolarHBondContact O-CE2 3.41Å; T320-Y336 PolarHBondContact OG1-OH 3.46Å; T320-Y336 VanDerWaalsContact OG1-OH 3.07Å; T320-V406 HydrophobicContact CG2-CG1 3.45Å; T320-V406 VanDerWaalsContact CG2-CG1 3.45Å; T320-L450 HydrophobicContact CG2-CB 3.91Å; T320-L450 HydrophobicContact CG2-CD1 4.2Å; T320-L450 HydrophobicContact CG2-CD2 4.19Å; T320-L450 HydrophobicContact CG2-CG 4.34Å; T320-L450 PolarHBondContact N-O 3.14Å
321	L	92.9	Very high	91.1	Very high	128 Å²	128	58.7 Å²	58.7	67%	0.67	32%	0.317	S	S	*	.	H	α-helix	trans	-88.6	-14.4	176.2	-61.7	169.1	0	0	0	112.8	V318 G319 Y336	V318-L321 WeakPolarHBondContact O-CB 3.24Å; V318-L321 PolarHBondContact O-N 3.36Å; G319-L321 PolarHBondContact O-N 3.48Å; L321-Y336 HydrophobicContact CD2-CD2 4.44Å; L321-Y336 HydrophobicContact CD2-CE2 3.72Å; L321-Y336 HydrophobicContact CG-CE2 4.45Å
322	L	92.3	Very high	90.8	Very high	96 Å²	96	55.4 Å²	55.4	50%	0.503	30%	0.298	S	S	.	.	S	Bend	trans	-79.9	145.9	176.1	-61.8	176.9	0	0	0	110.2	V318 G319 A452	V318-L322 PolarHBondContact O-N 3.36Å; G319-L322 WeakPolarHBondContact O-CB 3.37Å; G319-L322 PolarHBondContact O-N 3.32Å; L322-A452 HydrophobicContact CD1-CB 3.95Å
323	P	89.7	Confident	90.7	Very high	106 Å²	106	55.8 Å²	55.8	69%	0.688	30%	0.3	S	S	*	.	P	Polyproline II helix	trans	-64.1	137.3	175.5	26.5	-33.1	0	0	0	110.4
324	P	88.8	Confident	90.5	Very high	26 Å²	26	57.7 Å²	57.7	17%	0.169	31%	0.312	C	S	.	.	P	Polyproline II helix	trans	-74.1	132	-174.8	28.6	-34.1	0	0	0	112.2	Q328 Q329 V333	P324-Q328 HydrophobicContact CB-CB 4.17Å; P324-Q329 HydrophobicContact CB-CG 3.91Å; P324-Q329 HydrophobicContact CG-CG 3.96Å; P324-Q329 PolarHBondContact O-NE2 3.4Å; P324-V333 HydrophobicContact CB-CB 4.24Å; P324-V333 HydrophobicContact CB-CG1 3.88Å
325	D	88.4	Confident	90.3	Very high	113 Å²	113	54.3 Å²	54.3	60%	0.604	29%	0.294	S	S	*	.	P	Polyproline II helix	trans	-70.7	162.7	174.1	-70.7	-25.2	0	0	0	111.9	V327 Q328 Q329	D325-V327 PolarHBondContact O-N 2.73Å; D325-V327 VanDerWaalsContact O-N 3.12Å; D325-Q328 VanDerWaalsContact N-OE1 3.09Å; D325-Q328 WeakPolarHBondContact O-CA 3.19Å; D325-Q328 WeakPolarHBondContact O-CB 3.42Å; D325-Q328 PolarHBondContact O-N 2.87Å; D325-Q329 WeakPolarHBondContact O-CG 3.42Å; D325-Q329 PolarHBondContact O-N 3.38Å
326	E	84.1	Confident	90.1	Very high	130 Å²	130	59.1 Å²	59.1	61%	0.607	31%	0.312	S	S	*	.	H	α-helix	trans	-54.6	-35.8	-178.7	-66.9	-174.7	173	0	0	113.3	S330	E326-S330 WeakPolarHBondContact O-CB 3.31Å; E326-S330 PolarHBondContact O-N 3.31Å
327	V	85.8	Confident	90	Very high	72 Å²	72	60.9 Å²	60.9	44%	0.436	32%	0.324	S	S	.	.	H	α-helix	trans	-72	-36.3	176.1	-178.3	0	0	0	0	111.8	D325 S330 R331 I419	D325-V327 PolarHBondContact O-N 2.73Å; D325-V327 VanDerWaalsContact O-N 3.12Å; V327-S330 PolarHBondContact O-OG 3.45Å; V327-S330 VanDerWaalsContact O-OG 3.06Å; V327-R331 VanDerWaalsContact O-CG 3.28Å; V327-R331 WeakPolarHBondContact O-CG 3.48Å; V327-R331 PolarHBondContact O-N 3.29Å; V327-I419 HydrophobicContact CG2-CD1 4.5Å
328	Q	87.1	Confident	89.9	Confident	39 Å²	39	62.1 Å²	62.1	18%	0.182	34%	0.335	C	S	.	.	H	α-helix	trans	-69.5	-40.5	175.3	-72.3	179.2	-41.5	0	0	110.4	P324 D325 R331 G332 V333 L449	P324-Q328 HydrophobicContact CB-CB 4.17Å; D325-Q328 VanDerWaalsContact N-OE1 3.09Å; D325-Q328 WeakPolarHBondContact O-CA 3.19Å; D325-Q328 WeakPolarHBondContact O-CB 3.42Å; D325-Q328 PolarHBondContact O-N 2.87Å; Q328-R331 CarbonylContact O-C 3.54Å; Q328-R331 PolarHBondContact O-N 2.85Å; Q328-G332 PolarHBondContact O-N 3.29Å; Q328-G332 VanDerWaalsContact O-N 3.16Å; Q328-V333 HydrophobicContact CB-CB 3.99Å; Q328-V333 HydrophobicContact CB-CG2 4.01Å; Q328-V333 WeakPolarHBondContact O-CB 3.32Å; Q328-V333 WeakPolarHBondContact O-CG2 3.19Å; Q328-V333 PolarHBondContact O-N 3.39Å; Q328-L449 HydrophobicContact CG-CD1 4.05Å; Q328-L449 PolarHBondContact NE2-O 2.79Å
329	Q	86.7	Confident	89.8	Confident	80 Å²	80	65.8 Å²	65.8	37%	0.374	35%	0.348	S	S	.	.	H	α-helix	trans	-62.2	-44.2	175	-66.7	-179.6	19.8	0	0	111.7	P324 D325 R331 G332 V333	P324-Q329 HydrophobicContact CB-CG 3.91Å; P324-Q329 HydrophobicContact CG-CG 3.96Å; P324-Q329 PolarHBondContact O-NE2 3.4Å; D325-Q329 WeakPolarHBondContact O-CG 3.42Å; D325-Q329 PolarHBondContact O-N 3.38Å; Q329-R331 PolarHBondContact O-N 3.07Å; Q329-G332 PolarHBondContact O-N 3.15Å; Q329-V333 WeakPolarHBondContact CA-O 3.35Å
330	S	86.3	Confident	89.7	Confident	2 Å²	2	65.7 Å²	65.7	1%	0.014	35%	0.346	C	S	.	.	H	α-helix	trans	-62.5	-31	177	82	0	0	0	0	113.1	E326 V327 G332 G417	E326-S330 WeakPolarHBondContact O-CB 3.31Å; E326-S330 PolarHBondContact O-N 3.31Å; V327-S330 PolarHBondContact O-OG 3.45Å; V327-S330 VanDerWaalsContact O-OG 3.06Å; S330-G332 VanDerWaalsContact C-N 3.3Å; S330-G417 WeakPolarHBondContact CB-O 3.45Å; S330-G417 WeakPolarHBondContact O-CA 3.49Å; S330-G417 PolarHBondContact O-N 2.9Å; S330-G417 PolarHBondContact OG-O 3.2Å
331	R	88.5	Confident	89.7	Confident	82 Å²	82	68.6 Å²	68.6	31%	0.309	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	0.1	174.8	-65	176.9	-179.7	-170.8	0.4	114	V327 Q328 Q329 A415 F438 G439 L449	V327-R331 VanDerWaalsContact O-CG 3.28Å; V327-R331 WeakPolarHBondContact O-CG 3.48Å; V327-R331 PolarHBondContact O-N 3.29Å; Q328-R331 CarbonylContact O-C 3.54Å; Q328-R331 PolarHBondContact O-N 2.85Å; Q329-R331 PolarHBondContact O-N 3.07Å; R331-A415 WeakPolarHBondContact O-CB 3.48Å; R331-F438 HydrophobicContact CB-CB 4.12Å; R331-F438 HydrophobicContact CB-CD1 3.95Å; R331-F438 HydrophobicContact CB-CG 4.05Å; R331-F438 HydrophobicContact CG-CB 4.44Å; R331-F438 HydrophobicContact CG-CD1 3.64Å; R331-F438 HydrophobicContact CG-CD2 4.24Å; R331-F438 HydrophobicContact CG-CE1 3.83Å; R331-F438 HydrophobicContact CG-CE2 4.39Å; R331-F438 HydrophobicContact CG-CG 3.85Å; R331-F438 HydrophobicContact CG-CZ 4.2Å; R331-F438 WeakPolarHBondContact O-CB 3.38Å; R331-G439 PolarHBondContact O-N 2.98Å; R331-L449 HydrophobicContact CB-CD1 4.3Å; R331-L449 HydrophobicContact CB-CD2 3.74Å
332	G	89.4	Confident	89.8	Confident	1 Å²	1	67.6 Å²	67.6	1%	0.01	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	104.8	7	170.7	0	0	0	0	0	116.2	Q328 Q329 S330 T334 V411 I412	Q328-G332 PolarHBondContact O-N 3.29Å; Q328-G332 VanDerWaalsContact O-N 3.16Å; Q329-G332 PolarHBondContact O-N 3.15Å; S330-G332 VanDerWaalsContact C-N 3.3Å; G332-T334 PolarHBondContact O-N 3.4Å; G332-V411 WeakPolarHBondContact O-CA 3.45Å; G332-I412 PolarHBondContact O-N 3.09Å
333	V	92.5	Very high	89.6	Confident	8 Å²	8	66.9 Å²	66.9	5%	0.048	35%	0.352	C	S	.	.	B	Isolated β-bridge	trans	-78.3	118.8	175.9	-173.6	0	0	0	0	109.8	P324 Q328 Q329 T410 V411 L449 L450	P324-V333 HydrophobicContact CB-CB 4.24Å; P324-V333 HydrophobicContact CB-CG1 3.88Å; Q328-V333 HydrophobicContact CB-CB 3.99Å; Q328-V333 HydrophobicContact CB-CG2 4.01Å; Q328-V333 WeakPolarHBondContact O-CB 3.32Å; Q328-V333 WeakPolarHBondContact O-CG2 3.19Å; Q328-V333 PolarHBondContact O-N 3.39Å; Q329-V333 WeakPolarHBondContact CA-O 3.35Å; V333-T410 WeakPolarHBondContact CA-O 3.32Å; V333-V411 HydrophobicContact CG2-CG2 4.19Å; V333-L449 HydrophobicContact CG2-CD2 3.69Å; V333-L449 HydrophobicContact CG2-CG 3.81Å; V333-L450 HydrophobicContact CG1-CD2 3.72Å; V333-L450 HydrophobicContact CG2-CD2 4.02Å
334	T	90.4	Very high	89.9	Confident	60 Å²	60	62 Å²	62	37%	0.368	32%	0.32	S	S	.	.			trans	-101.6	-10.3	178.5	52.8	0	0	0	0	112.8	G332 T340 T410 I412	G332-T334 PolarHBondContact O-N 3.4Å; T334-T340 PolarHBondContact OG1-OG1 3.26Å; T334-T410 PolarHBondContact N-O 2.99Å; T334-T410 PolarHBondContact OG1-O 3.33Å; T334-I412 HydrophobicContact CG2-CG2 3.85Å
335	G	89.6	Confident	90.2	Very high	10 Å²	10	64 Å²	64	10%	0.103	33%	0.326	C	S	.	.			trans	70.6	-174.8	-163.7	0	0	0	0	0	110.8	S337 T410	G335-S337 PolarHBondContact O-N 3.03Å; G335-T410 PolarHBondContact N-O 2.98Å; G335-T410 WeakPolarHBondContact O-CA 3.35Å
336	Y	92.3	Very high	90.4	Very high	121 Å²	121	67.2 Å²	67.2	48%	0.475	33%	0.33	S	S	.	.	S	Bend	trans	-65.5	100.8	-179.7	-72.5	-78.4	0	0	0	111.5	T320 L321 A409 T410	T320-Y336 WeakPolarHBondContact O-CD2 3.17Å; T320-Y336 WeakPolarHBondContact O-CE2 3.41Å; T320-Y336 PolarHBondContact OG1-OH 3.46Å; T320-Y336 VanDerWaalsContact OG1-OH 3.07Å; L321-Y336 HydrophobicContact CD2-CD2 4.44Å; L321-Y336 HydrophobicContact CD2-CE2 3.72Å; L321-Y336 HydrophobicContact CG-CE2 4.45Å; Y336-A409 HydrophobicContact CD1-CB 4.12Å; Y336-A409 HydrophobicContact CE1-CB 4.41Å; Y336-T410 HydrophobicContact CD1-CG2 3.77Å; Y336-T410 HydrophobicContact CD2-CG2 4.19Å; Y336-T410 HydrophobicContact CE1-CG2 3.79Å; Y336-T410 HydrophobicContact CE2-CG2 4.21Å; Y336-T410 HydrophobicContact CG-CG2 3.99Å
337	S	91.5	Very high	90.7	Very high	38 Å²	38	62.8 Å²	62.8	27%	0.266	31%	0.313	S	S	.	.			trans	-122.1	129.9	179.9	176.2	0	0	0	0	111.2	G335 E339 T340 F341 A409	G335-S337 PolarHBondContact O-N 3.03Å; S337-E339 PolarHBondContact O-N 3.33Å; S337-E339 PolarHBondContact OG-N 2.86Å; S337-T340 PolarHBondContact O-N 3.31Å; S337-F341 WeakPolarHBondContact O-CB 3.39Å; S337-F341 PolarHBondContact O-N 3.29Å; S337-A409 PolarHBondContact N-O 3.18Å
338	T	92.5	Very high	90.9	Very high	109 Å²	109	62.1 Å²	62.1	67%	0.669	31%	0.307	S	S	*	.	H	α-helix	trans	-62.5	-31.2	174.3	-50	0	0	0	0	111.6	L342	T338-L342 HydrophobicContact CG2-CD1 4.07Å; T338-L342 HydrophobicContact CG2-CG 4.43Å; T338-L342 WeakPolarHBondContact O-CB 3.26Å; T338-L342 VanDerWaalsContact O-CG 3.25Å; T338-L342 WeakPolarHBondContact O-CG 3.28Å; T338-L342 PolarHBondContact O-N 2.94Å
339	E	90.7	Very high	90.8	Very high	146 Å²	146	64.6 Å²	64.6	68%	0.682	32%	0.315	S	S	*	.	H	α-helix	trans	-68.2	-49.6	177.2	-173.4	176	-177.5	0	0	111.2	S337 F341 L342 T343	S337-E339 PolarHBondContact O-N 3.33Å; S337-E339 PolarHBondContact OG-N 2.86Å; E339-F341 VanDerWaalsContact C-N 3.32Å; E339-F341 PolarHBondContact O-N 2.94Å; E339-L342 PolarHBondContact O-N 3.12Å; E339-T343 WeakPolarHBondContact O-CG2 3.29Å; E339-T343 PolarHBondContact O-N 3.31Å; E339-T343 PolarHBondContact O-OG1 3.37Å; E339-T343 VanDerWaalsContact O-OG1 3.05Å
340	T	91.1	Very high	90.5	Very high	7 Å²	7	65.9 Å²	65.9	4%	0.043	32%	0.317	C	S	.	.	H	α-helix	trans	-60.4	-42.1	176.2	-53.6	0	0	0	0	111.4	T334 S337 L342 T343 N344 I412	T334-T340 PolarHBondContact OG1-OG1 3.26Å; S337-T340 PolarHBondContact O-N 3.31Å; T340-L342 PolarHBondContact O-N 3.04Å; T340-T343 WeakPolarHBondContact CA-OG1 3.38Å; T340-T343 PolarHBondContact O-OG1 2.83Å; T340-T343 VanDerWaalsContact O-OG1 3.05Å; T340-N344 WeakPolarHBondContact CG2-ND2 3.13Å; T340-N344 VanDerWaalsContact O-CB 3.27Å; T340-N344 WeakPolarHBondContact O-CB 3.27Å; T340-N344 PolarHBondContact O-N 3.44Å; T340-N344 PolarHBondContact O-ND2 2.91Å; T340-I412 HydrophobicContact CG2-CG2 4.16Å
341	F	93.8	Very high	90.3	Very high	66 Å²	66	69.5 Å²	69.5	29%	0.289	35%	0.354	S	S	.	.	H	α-helix	trans	-59.7	-46.5	176.3	179.7	-92.6	0	0	0	112.4	I183 S337 E339 F345 A409	I183-F341 HydrophobicContact CD1-CD2 3.53Å; I183-F341 HydrophobicContact CD1-CE2 3.67Å; I183-F341 HydrophobicContact CD1-CG 4.27Å; I183-F341 HydrophobicContact CD1-CZ 4.48Å; I183-F341 HydrophobicContact CG2-CE2 4.47Å; S337-F341 WeakPolarHBondContact O-CB 3.39Å; S337-F341 PolarHBondContact O-N 3.29Å; E339-F341 VanDerWaalsContact C-N 3.32Å; E339-F341 PolarHBondContact O-N 2.94Å; F341-F345 AromaticContact CE1-CD2 3.86Å; F341-F345 HydrophobicContact CE1-CD2 3.86Å; F341-F345 HydrophobicContact CE1-CE2 4.37Å; F341-F345 AromaticContact CZ-CD2 3.88Å; F341-F345 HydrophobicContact CZ-CD2 3.88Å; F341-F345 HydrophobicContact CZ-CE2 4.17Å; F341-F345 WeakPolarHBondContact O-CB 3.12Å; F341-F345 PolarHBondContact O-N 3.34Å; F341-A409 HydrophobicContact CB-CB 4.49Å; F341-A409 HydrophobicContact CD2-CB 3.99Å
342	L	93.8	Very high	90.3	Very high	108 Å²	108	68.6 Å²	68.6	57%	0.565	35%	0.354	S	S	*	.	H	α-helix	trans	-71.2	-38.4	-177.9	-72	173.5	0	0	0	112.6	T338 E339 T340 F345	T338-L342 HydrophobicContact CG2-CD1 4.07Å; T338-L342 HydrophobicContact CG2-CG 4.43Å; T338-L342 WeakPolarHBondContact O-CB 3.26Å; T338-L342 VanDerWaalsContact O-CG 3.25Å; T338-L342 WeakPolarHBondContact O-CG 3.28Å; T338-L342 PolarHBondContact O-N 2.94Å; E339-L342 PolarHBondContact O-N 3.12Å; T340-L342 PolarHBondContact O-N 3.04Å; L342-F345 WeakPolarHBondContact O-CB 3.27Å; L342-F345 PolarHBondContact O-N 3.26Å
343	T	89.5	Confident	90.3	Very high	80 Å²	80	72.1 Å²	72.1	49%	0.491	38%	0.375	S	S	.	.	H	α-helix	trans	-68.1	-36.4	177.3	54.3	0	0	0	0	111.9	E339 T340	E339-T343 WeakPolarHBondContact O-CG2 3.29Å; E339-T343 PolarHBondContact O-N 3.31Å; E339-T343 PolarHBondContact O-OG1 3.37Å; E339-T343 VanDerWaalsContact O-OG1 3.05Å; T340-T343 WeakPolarHBondContact CA-OG1 3.38Å; T340-T343 PolarHBondContact O-OG1 2.83Å; T340-T343 VanDerWaalsContact O-OG1 3.05Å
344	N	94.6	Very high	90.2	Very high	3 Å²	3	74.5 Å²	74.5	2%	0.016	39%	0.385	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-5.8	176.5	-70.1	-21.6	0	0	0	114	G182 I183 T340 G408 V411 R413	G182-N344 CarbonylContact C-O 3.49Å; G182-N344 WeakPolarHBondContact CA-O 3.49Å; I183-N344 HydrophobicContact CD1-CB 4.32Å; I183-N344 HydrophobicContact CG1-CB 4.42Å; I183-N344 PolarHBondContact N-O 3.2Å; T340-N344 WeakPolarHBondContact CG2-ND2 3.13Å; T340-N344 VanDerWaalsContact O-CB 3.27Å; T340-N344 WeakPolarHBondContact O-CB 3.27Å; T340-N344 PolarHBondContact O-N 3.44Å; T340-N344 PolarHBondContact O-ND2 2.91Å; N344-G408 WeakPolarHBondContact CB-O 3.37Å; N344-G408 PolarHBondContact ND2-O 3.47Å; N344-V411 PolarHBondContact ND2-O 3.08Å; N344-R413 WeakPolarHBondContact OD1-CG 3.37Å
345	F	94.8	Very high	90	Very high	68 Å²	68	77.4 Å²	77.4	30%	0.298	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-45	-173.4	-170	-93.9	0	0	0	112.5	I183 G184 F341 L342	I183-F345 HydrophobicContact CB-CD2 4.33Å; I183-F345 PolarHBondContact N-O 2.84Å; G184-F345 PolarHBondContact N-O 3.1Å; G184-F345 VanDerWaalsContact N-O 3.12Å; F341-F345 AromaticContact CE1-CD2 3.86Å; F341-F345 HydrophobicContact CE1-CD2 3.86Å; F341-F345 HydrophobicContact CE1-CE2 4.37Å; F341-F345 AromaticContact CZ-CD2 3.88Å; F341-F345 HydrophobicContact CZ-CD2 3.88Å; F341-F345 HydrophobicContact CZ-CE2 4.17Å; F341-F345 WeakPolarHBondContact O-CB 3.12Å; F341-F345 PolarHBondContact O-N 3.34Å; L342-F345 WeakPolarHBondContact O-CB 3.27Å; L342-F345 PolarHBondContact O-N 3.26Å
346	W	92.9	Very high	89.9	Confident	181 Å²	181	78.5 Å²	78.5	69%	0.686	40%	0.399	S	S	*	.	S	Bend	trans	-90.7	151.4	-177.6	-69	108.4	0	0	0	112.1	R413	W346-R413 PolarHBondContact O-NH2 3.12Å
347	P	92.2	Very high	89.8	Confident	38 Å²	38	72.7 Å²	72.7	25%	0.247	38%	0.376	C	S	.	.			trans	-62.5	151.7	179.3	-17.3	27.2	0	0	0	114.1	A181 C185 W349	A181-P347 WeakPolarHBondContact O-CA 3.46Å; A181-P347 WeakPolarHBondContact O-CB 3.38Å; A181-P347 VanDerWaalsContact O-CG 3.29Å; A181-P347 WeakPolarHBondContact O-CG 3.42Å; C185-P347 HydrophobicContact CB-CG 4.14Å; C185-P347 VanDerWaalsContact SG-CG 3.5Å; P347-W349 HydrophobicContact CB-CD2 4.25Å; P347-W349 VanDerWaalsContact CB-CE2 3.46Å; P347-W349 HydrophobicContact CB-CZ2 3.64Å; P347-W349 VanDerWaalsContact CB-NE1 3.32Å; P347-W349 HydrophobicContact CG-CZ2 4.06Å
348	D	88.5	Confident	89.7	Confident	58 Å²	58	71.6 Å²	71.6	31%	0.31	37%	0.366	S	S	.	.			trans	-143.2	95.7	171.2	-167.4	2.3	0	0	0	109.8	H180 Y350 R413	H180-D348 CarbonylContact O-C 3.18Å; H180-D348 PolarHBondContact O-N 3.09Å; D348-Y350 HydrophobicContact CB-CE2 4.22Å; D348-Y350 WeakPolarHBondContact O-CD2 3.42Å; D348-Y350 PolarHBondContact O-N 3.46Å; D348-Y350 VanDerWaalsContact O-N 3.1Å; D348-Y350 VanDerWaalsContact OD2-CE2 3.26Å; D348-Y350 WeakPolarHBondContact OD2-CE2 3.47Å; D348-R413 IonicContact OD2-CZ 4Å; D348-R413 IonicContact OD2-NH1 3.23Å; D348-R413 PolarHBondContact OD2-NH1 3.01Å
349	W	86.4	Confident	89.3	Confident	90 Å²	90	67.5 Å²	67.5	34%	0.341	34%	0.342	S	S	.	.			trans	-85.6	80.5	-165.4	-64	116.5	0	0	0	110.7	H180 A181 P347 G351 E352 T353 F354 V357	H180-W349 HydrophobicContact CB-CE3 4.31Å; H180-W349 HydrophobicContact CB-CZ3 4.34Å; A181-W349 HydrophobicContact CB-CH2 3.64Å; A181-W349 HydrophobicContact CB-CZ2 4.45Å; A181-W349 HydrophobicContact CB-CZ3 4.13Å; P347-W349 HydrophobicContact CB-CD2 4.25Å; P347-W349 VanDerWaalsContact CB-CE2 3.46Å; P347-W349 HydrophobicContact CB-CZ2 3.64Å; P347-W349 VanDerWaalsContact CB-NE1 3.32Å; P347-W349 HydrophobicContact CG-CZ2 4.06Å; W349-G351 PolarHBondContact O-N 3.14Å; W349-E352 VanDerWaalsContact CB-O 3.32Å; W349-E352 WeakPolarHBondContact CB-O 3.39Å; W349-E352 HydrophobicContact CE3-CB 4.35Å; W349-T353 WeakPolarHBondContact CZ3-O 3.41Å; W349-F354 HydrophobicContact CH2-CB 3.98Å; W349-F354 HydrophobicContact CH2-CD2 4.39Å; W349-F354 HydrophobicContact CZ2-CB 4.07Å; W349-V357 HydrophobicContact CE3-CG2 4.42Å; W349-V357 HydrophobicContact CZ3-CB 4.23Å; W349-V357 HydrophobicContact CZ3-CG2 3.66Å
350	Y	80.4	Confident	89	Confident	107 Å²	107	63 Å²	63	42%	0.42	32%	0.324	S	S	.	.	S	Bend	trans	-70.6	70.2	172.3	-72.8	-94.2	0	0	0	112.2	D348 E352 M441	D348-Y350 HydrophobicContact CB-CE2 4.22Å; D348-Y350 WeakPolarHBondContact O-CD2 3.42Å; D348-Y350 PolarHBondContact O-N 3.46Å; D348-Y350 VanDerWaalsContact O-N 3.1Å; D348-Y350 VanDerWaalsContact OD2-CE2 3.26Å; D348-Y350 WeakPolarHBondContact OD2-CE2 3.47Å; Y350-E352 PolarHBondContact O-N 3.28Å; Y350-M441 HydrophobicContact CD2-CE 3.17Å; Y350-M441 HydrophobicContact CD2-SD 3.66Å; Y350-M441 HydrophobicContact CE2-CE 3.41Å; Y350-M441 VanDerWaalsContact CE2-CE 3.41Å; Y350-M441 HydrophobicContact CE2-SD 3.94Å; Y350-M441 HydrophobicContact CG-CE 4.05Å; Y350-M441 HydrophobicContact CG-SD 3.98Å
351	G	81.9	Confident	88.8	Confident	78 Å²	78	62.9 Å²	62.9	80%	0.804	32%	0.324	S	S	*	.	S	Bend	trans	79.8	-14.1	-179.3	0	0	0	0	0	114.9	W349	W349-G351 PolarHBondContact O-N 3.14Å
352	E	87.6	Confident	88.6	Confident	63 Å²	63	59.8 Å²	59.8	29%	0.294	31%	0.31	S	S	.	.			trans	-85.2	165	173.4	-65	-61.5	160.8	0	0	112	W176 H180 W349 Y350 S356 V357	W176-E352 HydrophobicContact CH2-CG 4.11Å; W176-E352 HydrophobicContact CZ2-CG 3.68Å; H180-E352 HydrophobicContact CB-CB 4.47Å; W349-E352 VanDerWaalsContact CB-O 3.32Å; W349-E352 WeakPolarHBondContact CB-O 3.39Å; W349-E352 HydrophobicContact CE3-CB 4.35Å; Y350-E352 PolarHBondContact O-N 3.28Å; E352-S356 WeakPolarHBondContact OE2-CB 3.33Å; E352-S356 PolarHBondContact OE2-OG 3.01Å; E352-V357 HydrophobicContact CB-CG2 4.02Å
353	T	89.8	Confident	88	Confident	75 Å²	75	55.8 Å²	55.8	46%	0.46	29%	0.291	S	S	.	.			trans	-129.3	166.1	176.3	64	0	0	0	0	109.7	W349 F355 S356 V357	W349-T353 WeakPolarHBondContact CZ3-O 3.41Å; T353-F355 PolarHBondContact O-N 2.85Å; T353-S356 PolarHBondContact N-OG 3.31Å; T353-S356 PolarHBondContact O-N 3.39Å; T353-S356 PolarHBondContact O-OG 3.45Å; T353-S356 PolarHBondContact OG1-N 2.9Å; T353-S356 VanDerWaalsContact OG1-N 3.16Å; T353-S356 PolarHBondContact OG1-OG 3.22Å; T353-V357 PolarHBondContact O-N 3.17Å
354	F	89.8	Confident	87.8	Confident	58 Å²	58	52.4 Å²	52.4	25%	0.254	27%	0.27	S	S	.	.	H	α-helix	trans	-50.5	-43.9	173.1	179.4	-90.9	0	0	0	112.3	L188 I189 W349 F358	L188-F354 HydrophobicContact CD2-CE2 4.26Å; L188-F354 HydrophobicContact CD2-CZ 4.5Å; I189-F354 HydrophobicContact CD1-CD2 4.23Å; I189-F354 HydrophobicContact CD1-CE2 4.06Å; I189-F354 HydrophobicContact CG1-CD2 4.17Å; I189-F354 HydrophobicContact CG1-CE2 3.51Å; I189-F354 HydrophobicContact CG1-CZ 3.75Å; W349-F354 HydrophobicContact CH2-CB 3.98Å; W349-F354 HydrophobicContact CH2-CD2 4.39Å; W349-F354 HydrophobicContact CZ2-CB 4.07Å; F354-F358 WeakPolarHBondContact O-CB 3.18Å; F354-F358 PolarHBondContact O-N 3.42Å
355	F	86.9	Confident	87.4	Confident	122 Å²	122	52.6 Å²	52.6	54%	0.535	27%	0.272	S	S	.	.	H	α-helix	trans	-75.2	-32.7	-177.9	-68	-63	0	0	0	113.7	T353 S359 V583	T353-F355 PolarHBondContact O-N 2.85Å; F355-S359 VanDerWaalsContact O-CB 3.31Å; F355-S359 WeakPolarHBondContact O-CB 3.28Å; F355-S359 PolarHBondContact O-N 2.98Å; F355-S359 PolarHBondContact O-OG 3.15Å; F355-V583 HydrophobicContact CB-CG1 3.92Å; F355-V583 HydrophobicContact CD1-CG1 3.6Å; F355-V583 HydrophobicContact CE1-CG1 4.44Å; F355-V583 HydrophobicContact CG-CG1 4.02Å
356	S	86.9	Confident	87.1	Confident	32 Å²	32	50.4 Å²	50.4	22%	0.224	26%	0.264	C	S	.	.	H	α-helix	trans	-69.6	-43.5	175.2	64.1	0	0	0	0	110.9	E352 T353 F358 S359 V360	E352-S356 WeakPolarHBondContact OE2-CB 3.33Å; E352-S356 PolarHBondContact OE2-OG 3.01Å; T353-S356 PolarHBondContact N-OG 3.31Å; T353-S356 PolarHBondContact O-N 3.39Å; T353-S356 PolarHBondContact O-OG 3.45Å; T353-S356 PolarHBondContact OG1-N 2.9Å; T353-S356 VanDerWaalsContact OG1-N 3.16Å; T353-S356 PolarHBondContact OG1-OG 3.22Å; S356-F358 PolarHBondContact O-N 2.96Å; S356-S359 WeakPolarHBondContact O-CB 3.35Å; S356-S359 PolarHBondContact O-N 3.14Å; S356-V360 WeakPolarHBondContact O-CG2 3.41Å; S356-V360 PolarHBondContact O-N 2.85Å
357	V	89.6	Confident	86.9	Confident	0 Å²	0	42 Å²	42	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-63.7	-43.4	174.7	177.9	0	0	0	0	111.3	W176 M177 H180 A181 I189 W349 E352 T353 S359 V360 F361	W176-V357 HydrophobicContact CH2-CB 4.44Å; W176-V357 HydrophobicContact CH2-CG2 3.75Å; W176-V357 HydrophobicContact CZ3-CB 4.16Å; W176-V357 HydrophobicContact CZ3-CG1 3.97Å; W176-V357 HydrophobicContact CZ3-CG2 3.84Å; M177-V357 HydrophobicContact CB-CG1 4.02Å; M177-V357 HydrophobicContact CG-CG1 3.57Å; H180-V357 HydrophobicContact CB-CG2 3.93Å; A181-V357 HydrophobicContact CB-CG1 4.36Å; I189-V357 HydrophobicContact CD1-CB 4.27Å; I189-V357 HydrophobicContact CD1-CG1 3.84Å; W349-V357 HydrophobicContact CE3-CG2 4.42Å; W349-V357 HydrophobicContact CZ3-CB 4.23Å; W349-V357 HydrophobicContact CZ3-CG2 3.66Å; E352-V357 HydrophobicContact CB-CG2 4.02Å; T353-V357 PolarHBondContact O-N 3.17Å; V357-S359 VanDerWaalsContact C-N 3.26Å; V357-S359 PolarHBondContact O-N 3.06Å; V357-V360 PolarHBondContact O-N 3.26Å; V357-F361 PolarHBondContact O-N 3.48Å
358	F	89.1	Confident	86.8	Confident	14 Å²	14	40.1 Å²	40.1	6%	0.061	22%	0.221	C	C	.	.	H	α-helix	trans	-55.7	-42.4	171.1	177	-90.6	0	0	0	111.4	I189 C192 S193 F354 S356 V360 F361 Y362 I580	I189-F358 HydrophobicContact CG2-CD2 4.03Å; C192-F358 HydrophobicContact CB-CE2 4.47Å; S193-F358 VanDerWaalsContact OG-CE2 3.23Å; S193-F358 WeakPolarHBondContact OG-CE2 3.47Å; F354-F358 WeakPolarHBondContact O-CB 3.18Å; F354-F358 PolarHBondContact O-N 3.42Å; S356-F358 PolarHBondContact O-N 2.96Å; F358-V360 PolarHBondContact O-N 3.35Å; F358-F361 PolarHBondContact O-N 2.91Å; F358-Y362 AromaticContact CE1-CD2 3.73Å; F358-Y362 HydrophobicContact CE1-CD2 3.73Å; F358-Y362 HydrophobicContact CE1-CE2 4.46Å; F358-Y362 HydrophobicContact CE1-CG 4.09Å; F358-Y362 HydrophobicContact CE2-CD2 4.04Å; F358-Y362 AromaticContact CZ-CD2 3.33Å; F358-Y362 HydrophobicContact CZ-CD2 3.33Å; F358-Y362 AromaticContact CZ-CE2 3.87Å; F358-Y362 HydrophobicContact CZ-CE2 3.87Å; F358-Y362 HydrophobicContact CZ-CG 4.14Å; F358-Y362 VanDerWaalsContact O-CB 3.26Å; F358-Y362 WeakPolarHBondContact O-CB 3.45Å; F358-Y362 PolarHBondContact O-N 2.88Å; F358-I580 HydrophobicContact CE1-CG1 4.24Å; F358-I580 HydrophobicContact CE1-CG2 3.88Å; F358-I580 HydrophobicContact CZ-CD1 4.12Å; F358-I580 HydrophobicContact CZ-CG1 4.3Å; F358-I580 HydrophobicContact CZ-CG2 4.43Å
359	S	84.6	Confident	86.8	Confident	24 Å²	24	37.4 Å²	37.4	17%	0.168	21%	0.207	C	C	.	.	H	α-helix	trans	-68.1	-32.4	-178.8	-59.8	0	0	0	0	113.8	F355 S356 V357 P363 L584	F355-S359 VanDerWaalsContact O-CB 3.31Å; F355-S359 WeakPolarHBondContact O-CB 3.28Å; F355-S359 PolarHBondContact O-N 2.98Å; F355-S359 PolarHBondContact O-OG 3.15Å; S356-S359 WeakPolarHBondContact O-CB 3.35Å; S356-S359 PolarHBondContact O-N 3.14Å; V357-S359 VanDerWaalsContact C-N 3.26Å; V357-S359 PolarHBondContact O-N 3.06Å; S359-P363 WeakPolarHBondContact O-CD 3.38Å; S359-L584 VanDerWaalsContact CB-CD2 3.45Å; S359-L584 WeakPolarHBondContact OG-CD2 3.37Å
360	V	84.1	Confident	87	Confident	50 Å²	50	33.4 Å²	33.4	30%	0.303	19%	0.193	S	C	.	.	H	α-helix	trans	-72.6	-36.1	174	174.4	0	0	0	0	111.2	R173 W176 S356 V357 F358	R173-V360 HydrophobicContact CG-CG1 4.42Å; W176-V360 HydrophobicContact CE3-CG1 4.22Å; W176-V360 HydrophobicContact CH2-CB 4.31Å; W176-V360 HydrophobicContact CH2-CG1 4.5Å; W176-V360 HydrophobicContact CH2-CG2 3.98Å; W176-V360 HydrophobicContact CZ3-CB 3.82Å; W176-V360 HydrophobicContact CZ3-CG1 3.83Å; W176-V360 HydrophobicContact CZ3-CG2 4.02Å; S356-V360 WeakPolarHBondContact O-CG2 3.41Å; S356-V360 PolarHBondContact O-N 2.85Å; V357-V360 PolarHBondContact O-N 3.26Å; F358-V360 PolarHBondContact O-N 3.35Å
361	F	88.6	Confident	87.3	Confident	6 Å²	6	28.3 Å²	28.3	3%	0.026	17%	0.173	C	C	.	.	H	α-helix	trans	-77.9	-41	178.7	176.9	-100.3	0	0	0	113.4	I169 M177 I189 V190 V357 F358 P363 A364 T365 Y400	I169-F361 HydrophobicContact CG2-CD2 3.92Å; I169-F361 HydrophobicContact CG2-CE2 4.35Å; M177-F361 HydrophobicContact CE-CD2 4.04Å; M177-F361 HydrophobicContact CE-CE2 4.21Å; M177-F361 HydrophobicContact SD-CB 3.92Å; M177-F361 HydrophobicContact SD-CD2 3.59Å; M177-F361 VanDerWaalsContact SD-CD2 3.59Å; M177-F361 HydrophobicContact SD-CE2 4.27Å; M177-F361 HydrophobicContact SD-CG 3.75Å; I189-F361 HydrophobicContact CG2-CB 4.11Å; I189-F361 HydrophobicContact CG2-CD1 3.64Å; I189-F361 HydrophobicContact CG2-CE1 4.35Å; I189-F361 HydrophobicContact CG2-CG 4.01Å; V190-F361 HydrophobicContact CB-CZ 4.49Å; V190-F361 HydrophobicContact CG2-CE1 4.25Å; V190-F361 HydrophobicContact CG2-CE2 4.25Å; V190-F361 HydrophobicContact CG2-CZ 3.8Å; V357-F361 PolarHBondContact O-N 3.48Å; F358-F361 PolarHBondContact O-N 2.91Å; F361-P363 VanDerWaalsContact C-N 3.32Å; F361-P363 VanDerWaalsContact O-N 3.11Å; F361-A364 HydrophobicContact CE2-CB 4.47Å; F361-A364 VanDerWaalsContact O-CB 3.28Å; F361-A364 WeakPolarHBondContact O-CB 3.31Å; F361-A364 PolarHBondContact O-N 3.18Å; F361-T365 HydrophobicContact CE1-CG2 4.17Å; F361-Y400 AromaticContact CE2-CD1 3.71Å; F361-Y400 HydrophobicContact CE2-CD1 3.71Å; F361-Y400 AromaticContact CE2-CE1 3.72Å; F361-Y400 HydrophobicContact CE2-CE1 3.72Å; F361-Y400 HydrophobicContact CE2-CG 4.19Å; F361-Y400 HydrophobicContact CZ-CD1 4.24Å; F361-Y400 HydrophobicContact CZ-CD2 4.46Å; F361-Y400 HydrophobicContact CZ-CE1 4.43Å; F361-Y400 HydrophobicContact CZ-CG 4.26Å
362	Y	88	Confident	87.6	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	14%	0.135	C	C	.	.	G	3₁₀ helix	trans	-52.8	-36.4	-168.9	-168.2	-95.8	0	0	0	115.3	V196 F358 A364 T365 L537 I580 L584	V196-Y362 WeakPolarHBondContact CG1-OH 3.45Å; F358-Y362 AromaticContact CE1-CD2 3.73Å; F358-Y362 HydrophobicContact CE1-CD2 3.73Å; F358-Y362 HydrophobicContact CE1-CE2 4.46Å; F358-Y362 HydrophobicContact CE1-CG 4.09Å; F358-Y362 HydrophobicContact CE2-CD2 4.04Å; F358-Y362 AromaticContact CZ-CD2 3.33Å; F358-Y362 HydrophobicContact CZ-CD2 3.33Å; F358-Y362 AromaticContact CZ-CE2 3.87Å; F358-Y362 HydrophobicContact CZ-CE2 3.87Å; F358-Y362 HydrophobicContact CZ-CG 4.14Å; F358-Y362 VanDerWaalsContact O-CB 3.26Å; F358-Y362 WeakPolarHBondContact O-CB 3.45Å; F358-Y362 PolarHBondContact O-N 2.88Å; Y362-A364 PolarHBondContact O-N 3.34Å; Y362-T365 PolarHBondContact O-N 3.26Å; Y362-T365 PolarHBondContact O-OG1 2.78Å; Y362-L537 HydrophobicContact CD1-CD1 4.28Å; Y362-L537 HydrophobicContact CE1-CD1 3.75Å; Y362-L537 HydrophobicContact CE1-CD2 3.53Å; Y362-L537 HydrophobicContact CE1-CG 3.71Å; Y362-L537 WeakPolarHBondContact OH-CD2 3.39Å; Y362-I580 HydrophobicContact CD1-CG2 4.16Å; Y362-I580 HydrophobicContact CD2-CG2 4.4Å; Y362-I580 HydrophobicContact CE1-CG2 4.04Å; Y362-I580 HydrophobicContact CE2-CD1 4Å; Y362-I580 HydrophobicContact CE2-CG2 4.27Å; Y362-I580 HydrophobicContact CG-CG2 4.35Å; Y362-L584 HydrophobicContact CD1-CD1 4.17Å
363	P	82.3	Confident	87.6	Confident	25 Å²	25	21.7 Å²	21.7	16%	0.162	12%	0.121	C	C	.	.	G	3₁₀ helix	trans	-50.8	-28	173.9	-29.1	36	0	0	0	114.5	I169 S359 F361 T365 T366 A533	I169-P363 HydrophobicContact CD1-CB 3.98Å; S359-P363 WeakPolarHBondContact O-CD 3.38Å; F361-P363 VanDerWaalsContact C-N 3.32Å; F361-P363 VanDerWaalsContact O-N 3.11Å; P363-T365 PolarHBondContact O-N 3.05Å; P363-T366 PolarHBondContact O-N 3.28Å; P363-T366 PolarHBondContact O-OG1 3.2Å; P363-A533 HydrophobicContact CG-CB 4.38Å
364	A	85.3	Confident	87.4	Confident	8 Å²	8	18.2 Å²	18.2	7%	0.066	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-60.2	-31.6	175.6	0	0	0	0	0	113.3	I165 I169 F361 Y362 T366	I165-A364 WeakPolarHBondContact CA-O 3.41Å; I169-A364 HydrophobicContact CB-CB 3.96Å; I169-A364 HydrophobicContact CD1-CB 3.65Å; I169-A364 VanDerWaalsContact CD1-N 3.26Å; I169-A364 HydrophobicContact CG1-CB 4.38Å; I169-A364 HydrophobicContact CG2-CB 3.87Å; F361-A364 HydrophobicContact CE2-CB 4.47Å; F361-A364 VanDerWaalsContact O-CB 3.28Å; F361-A364 WeakPolarHBondContact O-CB 3.31Å; F361-A364 PolarHBondContact O-N 3.18Å; Y362-A364 PolarHBondContact O-N 3.34Å; A364-T366 VanDerWaalsContact C-N 3.27Å; A364-T366 PolarHBondContact O-N 3.04Å
365	T	86.6	Confident	87.2	Confident	8 Å²	8	15.5 Å²	15.5	5%	0.049	9%	0.088	C	C	.	.	G	3₁₀ helix	trans	-82.2	-5.5	-175.8	66.7	0	0	0	0	114	F361 Y362 P363 G367	F361-T365 HydrophobicContact CE1-CG2 4.17Å; Y362-T365 PolarHBondContact O-N 3.26Å; Y362-T365 PolarHBondContact O-OG1 2.78Å; P363-T365 PolarHBondContact O-N 3.05Å; T365-G367 PolarHBondContact O-N 3.31Å
366	T	87.2	Confident	87	Confident	21 Å²	21	10.2 Å²	10.2	13%	0.129	7%	0.068	C	C	.	.	G	3₁₀ helix	trans	-74	-9	-176.6	63.4	0	0	0	0	114	P363 A364 I368 F536 Y540	P363-T366 PolarHBondContact O-N 3.28Å; P363-T366 PolarHBondContact O-OG1 3.2Å; A364-T366 VanDerWaalsContact C-N 3.27Å; A364-T366 PolarHBondContact O-N 3.04Å; T366-I368 VanDerWaalsContact C-N 3.28Å; T366-I368 PolarHBondContact O-N 2.82Å; T366-F536 HydrophobicContact CG2-CB 3.99Å; T366-F536 HydrophobicContact CG2-CG 4.34Å; T366-F536 WeakPolarHBondContact O-CD1 3.26Å; T366-F536 WeakPolarHBondContact O-CE1 3.49Å; T366-Y540 WeakPolarHBondContact CA-OH 3.32Å; T366-Y540 PolarHBondContact O-OH 3.07Å
367	G	88.4	Confident	86.9	Confident	4 Å²	4	9.3 Å²	9.3	4%	0.041	6%	0.06	C	C	.	.	G	3₁₀ helix	trans	-73.1	-4.6	-179.1	0	0	0	0	0	116.2	S164 T365 M369 A370	S164-G367 VanDerWaalsContact OG-CA 3.27Å; S164-G367 WeakPolarHBondContact OG-CA 3.3Å; T365-G367 PolarHBondContact O-N 3.31Å; G367-M369 PolarHBondContact O-N 2.91Å; G367-M369 VanDerWaalsContact O-N 3.08Å; G367-A370 WeakPolarHBondContact O-CB 3.42Å; G367-A370 PolarHBondContact O-N 3.4Å; G367-A370 VanDerWaalsContact O-N 3.1Å
368	I	91.4	Very high	86.7	Confident	0 Å²	0	9.3 Å²	9.3	0%	0	6%	0.061	C	C	.	.	G	3₁₀ helix	trans	-61.3	-24.1	-173.9	59.7	161.3	0	0	0	114.2	I165 T200 T366 T389 I393 Y540	I165-I368 HydrophobicContact CD1-CG2 3.94Å; T200-I368 HydrophobicContact CG2-CD1 3.85Å; T366-I368 VanDerWaalsContact C-N 3.28Å; T366-I368 PolarHBondContact O-N 2.82Å; I368-T389 HydrophobicContact CB-CG2 4.03Å; I368-T389 VanDerWaalsContact O-CG2 3.32Å; I368-T389 WeakPolarHBondContact O-CG2 3.45Å; I368-I393 HydrophobicContact CG2-CD1 3.78Å; I368-I393 HydrophobicContact CG2-CG1 3.7Å; I368-Y540 HydrophobicContact CD1-CD2 4.43Å; I368-Y540 HydrophobicContact CD1-CE1 4.38Å; I368-Y540 HydrophobicContact CD1-CE2 3.87Å; I368-Y540 HydrophobicContact CG1-CE1 4.28Å; I368-Y540 HydrophobicContact CG1-CE2 4.02Å; I368-Y540 WeakPolarHBondContact CG1-OH 3.23Å
369	M	88.8	Confident	86.4	Confident	0 Å²	0	12.4 Å²	12.4	0%	0	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-87.7	-7.8	-178.6	-63.2	-134.4	-159.5	0	0	114.1	M204 A218 F238 G367 G371 A372 N373 C539 Y540 I543	M204-M369 HydrophobicContact CE-CB 4.44Å; M204-M369 HydrophobicContact CE-CE 4.27Å; M204-M369 HydrophobicContact CE-CG 3.69Å; M204-M369 HydrophobicContact CE-SD 3.66Å; A218-M369 HydrophobicContact CB-CE 4.12Å; A218-M369 HydrophobicContact CB-SD 3.41Å; A218-M369 WeakPolarHBondContact CB-SD 3.32Å; F238-M369 HydrophobicContact CE1-SD 3.93Å; F238-M369 HydrophobicContact CZ-CB 4.04Å; F238-M369 HydrophobicContact CZ-CE 4.39Å; F238-M369 HydrophobicContact CZ-CG 4.19Å; F238-M369 HydrophobicContact CZ-SD 3.7Å; G367-M369 PolarHBondContact O-N 2.91Å; G367-M369 VanDerWaalsContact O-N 3.08Å; M369-G371 VanDerWaalsContact C-N 3.26Å; M369-G371 PolarHBondContact O-N 3.28Å; M369-A372 PolarHBondContact O-N 3.09Å; M369-N373 VanDerWaalsContact O-CG 3.31Å; M369-N373 PolarHBondContact O-N 2.92Å; M369-C539 HydrophobicContact CE-CB 4.07Å; M369-C539 WeakPolarHBondContact CE-SG 3.5Å; M369-Y540 HydrophobicContact CE-CD1 3.08Å; M369-Y540 HydrophobicContact CE-CE1 3.16Å; M369-Y540 HydrophobicContact CE-CG 4.34Å; M369-Y540 HydrophobicContact CG-CE1 3.68Å; M369-Y540 HydrophobicContact SD-CE1 4.16Å; M369-I543 HydrophobicContact CE-CD1 3.34Å; M369-I543 HydrophobicContact CE-CG1 4.31Å; M369-I543 HydrophobicContact SD-CD1 3.93Å
370	A	89.1	Confident	86.4	Confident	7 Å²	7	15.6 Å²	15.6	6%	0.058	9%	0.093	C	C	.	.	H	α-helix	trans	-55.9	-42.5	-171.2	0	0	0	0	0	112	R160 G367	R160-A370 VanDerWaalsContact CD-O 3.25Å; R160-A370 WeakPolarHBondContact CD-O 3.45Å; R160-A370 HydrophobicContact CG-CB 3.93Å; R160-A370 PolarHBondContact NE-O 3Å; G367-A370 WeakPolarHBondContact O-CB 3.42Å; G367-A370 PolarHBondContact O-N 3.4Å; G367-A370 VanDerWaalsContact O-N 3.1Å
371	G	86.7	Confident	86.5	Confident	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-71.8	-34.8	175.5	0	0	0	0	0	114.3	M369 N373 I374	M369-G371 VanDerWaalsContact C-N 3.26Å; M369-G371 PolarHBondContact O-N 3.28Å; G371-N373 VanDerWaalsContact C-N 3.35Å; G371-I374 WeakPolarHBondContact O-CG1 3.29Å; G371-I374 PolarHBondContact O-N 3.31Å
372	A	88.3	Confident	86.5	Confident	0 Å²	0	15.2 Å²	15.2	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-69.6	-32.3	178.3	0	0	0	0	0	112.3	M204 G217 M221 M369 I374 S375 I385	M204-A372 HydrophobicContact CE-CB 4.15Å; M204-A372 HydrophobicContact SD-CB 3.64Å; G217-A372 WeakPolarHBondContact CA-O 3.29Å; M221-A372 HydrophobicContact CE-CB 4.11Å; M369-A372 PolarHBondContact O-N 3.09Å; A372-I374 PolarHBondContact O-N 3.05Å; A372-S375 WeakPolarHBondContact O-CB 3.5Å; A372-S375 PolarHBondContact O-N 3.27Å; A372-S375 PolarHBondContact O-OG 2.88Å; A372-I385 HydrophobicContact CB-CD1 4.22Å; A372-I385 HydrophobicContact CB-CG2 4.45Å
373	N	88.1	Confident	86.5	Confident	2 Å²	2	18.9 Å²	18.9	1%	0.011	12%	0.118	C	C	.	.	H	α-helix	trans	-62.4	-28.9	179	-70.9	-15.8	0	0	0	113.1	F238 M369 G371	F238-N373 WeakPolarHBondContact CE1-OD1 3.35Å; M369-N373 VanDerWaalsContact O-CG 3.31Å; M369-N373 PolarHBondContact O-N 2.92Å; G371-N373 VanDerWaalsContact C-N 3.35Å
374	I	86.5	Confident	86.9	Confident	1 Å²	1	17.9 Å²	17.9	1%	0.005	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	20.1	173.4	67.7	166.5	0	0	0	113	L151 G156 V295 G371 A372 G376 D377 L378 V474	L151-I374 HydrophobicContact CD1-CD1 3.95Å; G156-I374 WeakPolarHBondContact O-CD1 3.34Å; V295-I374 HydrophobicContact CG1-CD1 4.49Å; G371-I374 WeakPolarHBondContact O-CG1 3.29Å; G371-I374 PolarHBondContact O-N 3.31Å; A372-I374 PolarHBondContact O-N 3.05Å; I374-G376 PolarHBondContact O-N 3.42Å; I374-D377 WeakPolarHBondContact O-CA 3.42Å; I374-D377 PolarHBondContact O-N 3.44Å; I374-L378 HydrophobicContact CD1-CD2 4.48Å; I374-L378 HydrophobicContact CG1-CD2 4.42Å; I374-L378 PolarHBondContact O-N 3.45Å; I374-V474 HydrophobicContact CG2-CG1 4.24Å
375	S	85.7	Confident	87.3	Confident	1 Å²	1	17.5 Å²	17.5	1%	0.007	11%	0.108	C	C	.	.	G	3₁₀ helix	trans	-47.6	-35.8	176.9	41.8	0	0	0	0	113.6	K214 G217 A372 D377 L378 P381	K214-S375 PolarHBondContact O-OG 3.41Å; K214-S375 VanDerWaalsContact O-OG 3.12Å; G217-S375 WeakPolarHBondContact CA-OG 3.37Å; G217-S375 PolarHBondContact N-OG 3.19Å; G217-S375 VanDerWaalsContact N-OG 3.1Å; A372-S375 WeakPolarHBondContact O-CB 3.5Å; A372-S375 PolarHBondContact O-N 3.27Å; A372-S375 PolarHBondContact O-OG 2.88Å; S375-D377 PolarHBondContact O-N 3.26Å; S375-D377 VanDerWaalsContact O-N 3.17Å; S375-L378 PolarHBondContact O-N 3.34Å; S375-P381 VanDerWaalsContact O-CG 3.24Å; S375-P381 WeakPolarHBondContact O-CG 3.46Å
376	G	81.5	Confident	87.6	Confident	11 Å²	11	17.7 Å²	17.7	11%	0.113	11%	0.11	C	C	.	.	G	3₁₀ helix	trans	-60.6	-23.7	175.7	0	0	0	0	0	114.2	R148 G215 I374	R148-G376 PolarHBondContact NH1-O 3.19Å; R148-G376 PolarHBondContact NH2-O 2.96Å; G215-G376 VanDerWaalsContact CA-CA 3.47Å; I374-G376 PolarHBondContact O-N 3.42Å
377	D	84.6	Confident	87.9	Confident	13 Å²	13	22.6 Å²	22.6	7%	0.07	13%	0.129	C	C	.	.	G	3₁₀ helix	trans	-106.6	1.2	-176.6	-62.1	-41.4	0	0	0	112.9	R148 R150 L151 I374 S375 K478	R148-D377 IonicContact NH1-OD1 3.86Å; R148-D377 PolarHBondContact NH1-OD1 2.93Å; R150-D377 CarbonylContact C-O 3.44Å; R150-D377 WeakPolarHBondContact CA-O 3.27Å; L151-D377 PolarHBondContact N-O 2.98Å; I374-D377 WeakPolarHBondContact O-CA 3.42Å; I374-D377 PolarHBondContact O-N 3.44Å; S375-D377 PolarHBondContact O-N 3.26Å; S375-D377 VanDerWaalsContact O-N 3.17Å; D377-K478 IonicContact OD2-NZ 2.72Å; D377-K478 PolarHBondContact OD2-NZ 3.19Å
378	L	86.1	Confident	88.2	Confident	1 Å²	1	22.4 Å²	22.4	1%	0.005	13%	0.127	C	C	.	.	B	Isolated β-bridge	trans	-83.2	148.7	173.4	-57.7	177.8	0	0	0	111.3	R150 L151 V157 I374 S375 P381 A384 I385	R150-L378 WeakPolarHBondContact CD-O 3.34Å; L151-L378 HydrophobicContact CB-CD2 4.19Å; L151-L378 WeakPolarHBondContact O-CA 3.46Å; V157-L378 HydrophobicContact CG2-CD1 3.48Å; V157-L378 VanDerWaalsContact CG2-CD1 3.48Å; V157-L378 HydrophobicContact CG2-CD2 3.8Å; V157-L378 HydrophobicContact CG2-CG 4.31Å; I374-L378 HydrophobicContact CD1-CD2 4.48Å; I374-L378 HydrophobicContact CG1-CD2 4.42Å; I374-L378 PolarHBondContact O-N 3.45Å; S375-L378 PolarHBondContact O-N 3.34Å; L378-P381 HydrophobicContact CB-CG 4.1Å; L378-P381 HydrophobicContact CD1-CB 4.4Å; L378-A384 HydrophobicContact CD1-CB 4.15Å; L378-I385 HydrophobicContact CD1-CD1 4.41Å; L378-I385 HydrophobicContact CD1-CG1 3.88Å
379	D	82	Confident	88.4	Confident	78 Å²	78	22.4 Å²	22.4	42%	0.417	13%	0.127	S	C	.	.	S	Bend	trans	-64.1	-53.9	-179.6	-170.6	42.7	0	0	0	111.6	R150 L151	R150-D379 VanDerWaalsContact CB-CA 3.44Å; R150-D379 HydrophobicContact CB-CB 3.79Å; R150-D379 PolarHBondContact NH1-O 3.36Å; L151-D379 PolarHBondContact O-N 3.07Å
380	N	85	Confident	88.7	Confident	91 Å²	91	24.8 Å²	24.8	49%	0.487	14%	0.139	S	C	.	.	S	Bend	trans	-133.6	82.8	178.7	-70	-62.4	0	0	0	110.6	A382 T383 A384	N380-A382 VanDerWaalsContact C-N 3.28Å; N380-A382 PolarHBondContact O-N 2.95Å; N380-T383 WeakPolarHBondContact CB-OG1 3.13Å; N380-T383 PolarHBondContact O-N 2.81Å; N380-T383 PolarHBondContact O-OG1 3.18Å; N380-T383 VanDerWaalsContact O-OG1 3.11Å; N380-A384 VanDerWaalsContact O-CB 3.29Å; N380-A384 WeakPolarHBondContact O-CB 3.43Å; N380-A384 PolarHBondContact O-N 3.04Å
381	P	86.7	Confident	89	Confident	15 Å²	15	28 Å²	28	10%	0.097	16%	0.155	C	C	.	.	H	α-helix	trans	-53.3	-42	-174.3	-24.2	30.8	0	0	0	113.8	I213 S375 L378 T383 A384 I385	I213-P381 HydrophobicContact CB-CB 4.03Å; I213-P381 HydrophobicContact CB-CG 4.49Å; I213-P381 HydrophobicContact CD1-CB 3.93Å; I213-P381 HydrophobicContact CG1-CB 4.48Å; S375-P381 VanDerWaalsContact O-CG 3.24Å; S375-P381 WeakPolarHBondContact O-CG 3.46Å; L378-P381 HydrophobicContact CB-CG 4.1Å; L378-P381 HydrophobicContact CD1-CB 4.4Å; P381-T383 PolarHBondContact O-N 2.66Å; P381-A384 PolarHBondContact O-N 3.43Å; P381-I385 HydrophobicContact CB-CD1 4.09Å; P381-I385 WeakPolarHBondContact O-CB 3.45Å; P381-I385 WeakPolarHBondContact O-CG1 3.44Å; P381-I385 PolarHBondContact O-N 3.32Å
382	A	87.7	Confident	89.4	Confident	33 Å²	33	28 Å²	28	27%	0.273	16%	0.155	S	C	.	.	H	α-helix	trans	-59.8	-27	-179.1	0	0	0	0	0	113.9	C208 T209 N380 P386	C208-A382 WeakPolarHBondContact O-CA 3.35Å; C208-A382 VanDerWaalsContact O-CB 3.27Å; C208-A382 WeakPolarHBondContact O-CB 3.38Å; T209-A382 HydrophobicContact CG2-CB 4.39Å; T209-A382 WeakPolarHBondContact CG2-O 3.38Å; N380-A382 VanDerWaalsContact C-N 3.28Å; N380-A382 PolarHBondContact O-N 2.95Å; A382-P386 VanDerWaalsContact O-CD 3.29Å; A382-P386 WeakPolarHBondContact O-CD 3.25Å; A382-P386 VanDerWaalsContact O-CG 3.32Å; A382-P386 WeakPolarHBondContact O-CG 3.25Å
383	T	89	Confident	89.8	Confident	78 Å²	78	28.2 Å²	28.2	48%	0.479	16%	0.156	S	C	.	.	H	α-helix	trans	-102.8	-29.1	176.9	64	0	0	0	0	112.6	N380 P381 K387	N380-T383 WeakPolarHBondContact CB-OG1 3.13Å; N380-T383 PolarHBondContact O-N 2.81Å; N380-T383 PolarHBondContact O-OG1 3.18Å; N380-T383 VanDerWaalsContact O-OG1 3.11Å; P381-T383 PolarHBondContact O-N 2.66Å; T383-K387 WeakPolarHBondContact O-CG 3.38Å
384	A	90.6	Very high	90.1	Very high	3 Å²	3	30.4 Å²	30.4	3%	0.025	18%	0.175	C	C	.	.	H	α-helix	trans	-75.8	-43.7	-176.1	0	0	0	0	0	112.6	W153 V157 L378 N380 P381 G388	W153-A384 VanDerWaalsContact CB-CA 3.46Å; W153-A384 HydrophobicContact CB-CB 3.53Å; V157-A384 HydrophobicContact CG2-CB 4.13Å; L378-A384 HydrophobicContact CD1-CB 4.15Å; N380-A384 VanDerWaalsContact O-CB 3.29Å; N380-A384 WeakPolarHBondContact O-CB 3.43Å; N380-A384 PolarHBondContact O-N 3.04Å; P381-A384 PolarHBondContact O-N 3.43Å; A384-G388 PolarHBondContact O-N 3.26Å
385	I	93.3	Very high	90.6	Very high	0 Å²	0	32.9 Å²	32.9	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-62.5	-51	-178.7	-64.3	167.2	0	0	0	110.8	V157 M204 C208 I213 A372 L378 P381 K387 G388 T389	V157-I385 HydrophobicContact CG2-CG1 4.49Å; M204-I385 HydrophobicContact CG-CG2 4.21Å; M204-I385 HydrophobicContact SD-CG2 3.86Å; C208-I385 HydrophobicContact CB-CD1 4.38Å; I213-I385 HydrophobicContact CD1-CD1 3.87Å; A372-I385 HydrophobicContact CB-CD1 4.22Å; A372-I385 HydrophobicContact CB-CG2 4.45Å; L378-I385 HydrophobicContact CD1-CD1 4.41Å; L378-I385 HydrophobicContact CD1-CG1 3.88Å; P381-I385 HydrophobicContact CB-CD1 4.09Å; P381-I385 WeakPolarHBondContact O-CB 3.45Å; P381-I385 WeakPolarHBondContact O-CG1 3.44Å; P381-I385 PolarHBondContact O-N 3.32Å; I385-K387 PolarHBondContact O-N 3.22Å; I385-G388 PolarHBondContact O-N 2.97Å; I385-T389 WeakPolarHBondContact O-CB 3.35Å; I385-T389 PolarHBondContact O-N 3.48Å; I385-T389 PolarHBondContact O-OG1 3.45Å
386	P	93.3	Very high	91	Very high	13 Å²	13	33 Å²	33	8%	0.084	19%	0.19	C	C	.	.	H	α-helix	trans	-59.8	-47.8	-179.5	-26	36.2	0	0	0	113.6	C205 A382 L390 F562	C205-P386 HydrophobicContact CB-CB 4.24Å; C205-P386 HydrophobicContact CB-CG 4.06Å; C205-P386 WeakPolarHBondContact SG-CA 3.43Å; C205-P386 WeakPolarHBondContact SG-CB 3.39Å; A382-P386 VanDerWaalsContact O-CD 3.29Å; A382-P386 WeakPolarHBondContact O-CD 3.25Å; A382-P386 VanDerWaalsContact O-CG 3.32Å; A382-P386 WeakPolarHBondContact O-CG 3.25Å; P386-L390 VanDerWaalsContact O-CB 3.27Å; P386-L390 WeakPolarHBondContact O-CB 3.47Å; P386-L390 WeakPolarHBondContact O-CG 3.4Å; P386-L390 PolarHBondContact O-N 2.85Å; P386-F562 HydrophobicContact CB-CD2 4.48Å; P386-F562 HydrophobicContact CB-CE2 4.43Å
387	K	92.7	Very high	91.6	Very high	123 Å²	123	33.4 Å²	33.4	54%	0.535	19%	0.192	S	C	.	.	H	α-helix	trans	-66	-46.8	-178.5	-68.4	-178.5	179.9	-176.6	0	111.7	W153 T383 I385 L391	W153-K387 HydrophobicContact CD2-CB 4.28Å; W153-K387 HydrophobicContact CE3-CB 3.99Å; W153-K387 HydrophobicContact CZ3-CB 4.39Å; T383-K387 WeakPolarHBondContact O-CG 3.38Å; I385-K387 PolarHBondContact O-N 3.22Å; K387-L391 WeakPolarHBondContact O-CB 3.37Å; K387-L391 PolarHBondContact O-N 3.47Å
388	G	94.7	Very high	92.2	Very high	0 Å²	0	39 Å²	39	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-70.1	-45.7	-175.7	0	0	0	0	0	112.9	L158 A384 I385 G392	L158-G388 WeakPolarHBondContact CD1-O 3.47Å; A384-G388 PolarHBondContact O-N 3.26Å; I385-G388 PolarHBondContact O-N 2.97Å; G388-G392 PolarHBondContact O-N 2.87Å
389	T	95.4	Very high	92.6	Very high	0 Å²	0	41 Å²	41	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-74.2	-43.1	-176.2	-55	0	0	0	0	112.1	V157 C201 I368 I385 G392 I393	V157-T389 WeakPolarHBondContact CG1-OG1 3.38Å; C201-T389 HydrophobicContact CB-CG2 4.33Å; C201-T389 WeakPolarHBondContact SG-CG2 3.06Å; I368-T389 HydrophobicContact CB-CG2 4.03Å; I368-T389 VanDerWaalsContact O-CG2 3.32Å; I368-T389 WeakPolarHBondContact O-CG2 3.45Å; I385-T389 WeakPolarHBondContact O-CB 3.35Å; I385-T389 PolarHBondContact O-N 3.48Å; I385-T389 PolarHBondContact O-OG1 3.45Å; T389-G392 PolarHBondContact O-N 3.13Å; T389-I393 HydrophobicContact CG2-CD1 4.04Å; T389-I393 HydrophobicContact CG2-CG1 4.49Å; T389-I393 VanDerWaalsContact O-CG1 3.31Å; T389-I393 WeakPolarHBondContact O-CG1 3.34Å; T389-I393 PolarHBondContact O-N 3.39Å
390	L	95.4	Very high	93.3	Very high	50 Å²	50	37.5 Å²	37.5	26%	0.262	21%	0.212	S	C	.	.	H	α-helix	trans	-64.5	-44.7	178.7	-72.1	170.8	0	0	0	112	C201 L202 P386 G392 I393 A394 F562	C201-L390 HydrophobicContact CB-CD2 4.09Å; C201-L390 VanDerWaalsContact SG-CD2 3.57Å; L202-L390 HydrophobicContact CD2-CD2 4.27Å; P386-L390 VanDerWaalsContact O-CB 3.27Å; P386-L390 WeakPolarHBondContact O-CB 3.47Å; P386-L390 WeakPolarHBondContact O-CG 3.4Å; P386-L390 PolarHBondContact O-N 2.85Å; L390-G392 VanDerWaalsContact C-N 3.33Å; L390-I393 PolarHBondContact O-N 2.91Å; L390-A394 PolarHBondContact O-N 2.67Å; L390-F562 HydrophobicContact CD1-CE2 4.4Å; L390-F562 HydrophobicContact CD1-CZ 4.23Å
391	L	95.9	Very high	93.8	Very high	75 Å²	75	34.1 Å²	34.1	39%	0.393	20%	0.197	S	C	.	.	H	α-helix	trans	-66.2	-38	175.6	-177.3	63.5	0	0	0	111.1	W153 L158 K387 A394 V395	W153-L391 HydrophobicContact CH2-CD2 4.21Å; W153-L391 HydrophobicContact CZ3-CD2 4.1Å; L158-L391 HydrophobicContact CD1-CB 3.94Å; L158-L391 HydrophobicContact CD1-CD2 4.03Å; L158-L391 HydrophobicContact CD1-CG 3.89Å; L158-L391 HydrophobicContact CD2-CD2 3.9Å; K387-L391 WeakPolarHBondContact O-CB 3.37Å; K387-L391 PolarHBondContact O-N 3.47Å; L391-A394 PolarHBondContact O-N 3.18Å; L391-V395 HydrophobicContact CD1-CG2 4.09Å; L391-V395 HydrophobicContact CG-CG2 4.23Å; L391-V395 WeakPolarHBondContact O-CB 3.48Å; L391-V395 VanDerWaalsContact O-CG2 3.29Å; L391-V395 WeakPolarHBondContact O-CG2 3.19Å; L391-V395 PolarHBondContact O-N 2.67Å
392	G	95.6	Very high	94.2	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-61.1	-46.5	176.3	0	0	0	0	0	112.5	G388 T389 L390 V395 T396	G388-G392 PolarHBondContact O-N 2.87Å; T389-G392 PolarHBondContact O-N 3.13Å; L390-G392 VanDerWaalsContact C-N 3.33Å; G392-V395 PolarHBondContact O-N 2.92Å; G392-T396 WeakPolarHBondContact O-CB 3.49Å; G392-T396 VanDerWaalsContact O-CG2 3.24Å; G392-T396 WeakPolarHBondContact O-CG2 3.44Å; G392-T396 PolarHBondContact O-N 3.47Å; G392-T396 PolarHBondContact O-OG1 2.89Å
393	I	95.6	Very high	94.5	Very high	4 Å²	4	33.5 Å²	33.5	2%	0.021	20%	0.195	C	C	.	.	H	α-helix	trans	-58.1	-51.7	173.1	-65.6	163	0	0	0	109.6	I165 V198 C201 I368 T389 L390 V395 T396 S397	I165-I393 HydrophobicContact CD1-CG1 4.38Å; V198-I393 HydrophobicContact CG2-CG2 3.89Å; C201-I393 HydrophobicContact CB-CD1 3.73Å; I368-I393 HydrophobicContact CG2-CD1 3.78Å; I368-I393 HydrophobicContact CG2-CG1 3.7Å; T389-I393 HydrophobicContact CG2-CD1 4.04Å; T389-I393 HydrophobicContact CG2-CG1 4.49Å; T389-I393 VanDerWaalsContact O-CG1 3.31Å; T389-I393 WeakPolarHBondContact O-CG1 3.34Å; T389-I393 PolarHBondContact O-N 3.39Å; L390-I393 PolarHBondContact O-N 2.91Å; I393-V395 PolarHBondContact O-N 3.43Å; I393-T396 PolarHBondContact O-N 3.49Å; I393-T396 PolarHBondContact O-OG1 3.45Å; I393-S397 WeakPolarHBondContact O-CB 3.28Å; I393-S397 PolarHBondContact O-N 3.24Å; I393-S397 PolarHBondContact O-OG 3.37Å
394	A	95.7	Very high	94.8	Very high	48 Å²	48	29.8 Å²	29.8	40%	0.397	17%	0.172	S	C	.	.	H	α-helix	trans	-57.7	-47.9	-179.1	0	0	0	0	0	113.2	L390 L391 L398	L390-A394 PolarHBondContact O-N 2.67Å; L391-A394 PolarHBondContact O-N 3.18Å; A394-L398 VanDerWaalsContact O-CG 3.28Å; A394-L398 WeakPolarHBondContact O-CG 3.29Å; A394-L398 PolarHBondContact O-N 3.3Å; A394-L398 VanDerWaalsContact O-N 3.15Å
395	V	95.6	Very high	95	Very high	54 Å²	54	33.1 Å²	33.1	33%	0.327	19%	0.189	S	C	.	.	H	α-helix	trans	-62.3	-47.1	179.2	169.4	0	0	0	0	111	V162 L391 G392 I393 L398 I399	V162-V395 HydrophobicContact CG2-CG1 4.44Å; L391-V395 HydrophobicContact CD1-CG2 4.09Å; L391-V395 HydrophobicContact CG-CG2 4.23Å; L391-V395 WeakPolarHBondContact O-CB 3.48Å; L391-V395 VanDerWaalsContact O-CG2 3.29Å; L391-V395 WeakPolarHBondContact O-CG2 3.19Å; L391-V395 PolarHBondContact O-N 2.67Å; G392-V395 PolarHBondContact O-N 2.92Å; I393-V395 PolarHBondContact O-N 3.43Å; V395-L398 PolarHBondContact O-N 3.18Å; V395-I399 HydrophobicContact CG1-CD1 3.86Å; V395-I399 WeakPolarHBondContact O-CG1 2.96Å; V395-I399 PolarHBondContact O-N 2.75Å
396	T	94.7	Very high	95.1	Very high	2 Å²	2	33.8 Å²	33.8	1%	0.012	19%	0.193	C	C	.	.	H	α-helix	trans	-68.2	-40.3	-178.6	56	0	0	0	0	112.8	V162 I165 L166 G392 I393 L398 I399 Y400	V162-T396 HydrophobicContact CB-CG2 4.23Å; V162-T396 HydrophobicContact CG1-CG2 4.15Å; V162-T396 HydrophobicContact CG2-CG2 4.2Å; I165-T396 HydrophobicContact CB-CG2 3.8Å; I165-T396 HydrophobicContact CD1-CG2 4.45Å; I165-T396 HydrophobicContact CG2-CG2 3.81Å; I165-T396 WeakPolarHBondContact CG2-OG1 3.25Å; L166-T396 HydrophobicContact CD2-CG2 3.97Å; L166-T396 HydrophobicContact CG-CG2 3.95Å; G392-T396 WeakPolarHBondContact O-CB 3.49Å; G392-T396 VanDerWaalsContact O-CG2 3.24Å; G392-T396 WeakPolarHBondContact O-CG2 3.44Å; G392-T396 PolarHBondContact O-N 3.47Å; G392-T396 PolarHBondContact O-OG1 2.89Å; I393-T396 PolarHBondContact O-N 3.49Å; I393-T396 PolarHBondContact O-OG1 3.45Å; T396-L398 VanDerWaalsContact C-N 3.28Å; T396-L398 PolarHBondContact O-N 2.94Å; T396-I399 PolarHBondContact O-N 3.15Å; T396-Y400 VanDerWaalsContact O-CD2 3.28Å; T396-Y400 WeakPolarHBondContact O-CD2 3.39Å; T396-Y400 PolarHBondContact O-N 2.94Å
397	S	94.7	Very high	95.1	Very high	21 Å²	21	33.1 Å²	33.1	15%	0.147	19%	0.189	C	C	.	.	H	α-helix	trans	-59	-39.8	174.5	-59.6	0	0	0	0	111.8	S194 I393 A401	S194-S397 WeakPolarHBondContact CB-OG 3.38Å; S194-S397 PolarHBondContact OG-OG 2.97Å; I393-S397 WeakPolarHBondContact O-CB 3.28Å; I393-S397 PolarHBondContact O-N 3.24Å; I393-S397 PolarHBondContact O-OG 3.37Å; S397-A401 WeakPolarHBondContact O-CB 3.47Å; S397-A401 PolarHBondContact O-N 2.99Å
398	L	95.9	Very high	95.2	Very high	129 Å²	129	27.3 Å²	27.3	68%	0.675	16%	0.164	S	C	*	.	H	α-helix	trans	-67.4	-41.7	175.8	-70.9	172.1	0	0	0	112.2	A394 V395 T396 A401 G402	A394-L398 VanDerWaalsContact O-CG 3.28Å; A394-L398 WeakPolarHBondContact O-CG 3.29Å; A394-L398 PolarHBondContact O-N 3.3Å; A394-L398 VanDerWaalsContact O-N 3.15Å; V395-L398 PolarHBondContact O-N 3.18Å; T396-L398 VanDerWaalsContact C-N 3.28Å; T396-L398 PolarHBondContact O-N 2.94Å; L398-A401 PolarHBondContact O-N 3.43Å; L398-G402 PolarHBondContact O-N 3.04Å
399	I	95.7	Very high	95.2	Very high	44 Å²	44	27.7 Å²	27.7	23%	0.226	17%	0.167	C	C	.	.	H	α-helix	trans	-62	-48.4	176.2	-67.9	166.4	0	0	0	110	L166 L170 L313 V395 T396 A401 G402 T403	L166-I399 HydrophobicContact CD1-CD1 3.98Å; L166-I399 HydrophobicContact CD2-CB 3.96Å; L166-I399 HydrophobicContact CD2-CD1 4.01Å; L166-I399 HydrophobicContact CD2-CG2 3.69Å; L170-I399 HydrophobicContact CD1-CG2 4.02Å; L170-I399 HydrophobicContact CD2-CG2 4.09Å; L313-I399 HydrophobicContact CD1-CD1 4.47Å; L313-I399 HydrophobicContact CD1-CG2 4.03Å; V395-I399 HydrophobicContact CG1-CD1 3.86Å; V395-I399 WeakPolarHBondContact O-CG1 2.96Å; V395-I399 PolarHBondContact O-N 2.75Å; T396-I399 PolarHBondContact O-N 3.15Å; I399-A401 PolarHBondContact O-N 3.42Å; I399-G402 PolarHBondContact O-N 3.4Å; I399-T403 PolarHBondContact O-N 2.96Å; I399-T403 PolarHBondContact O-OG1 3.34Å; I399-T403 VanDerWaalsContact O-OG1 3.05Å
400	Y	95.6	Very high	95.1	Very high	4 Å²	4	27.7 Å²	27.7	2%	0.016	17%	0.167	C	C	.	.	H	α-helix	trans	-59.3	-47.7	177.1	-87	-67.8	0	0	0	112.7	I165 L166 I169 L170 V174 F361 T396 G402 T403 V404	I165-Y400 HydrophobicContact CG2-CE2 3.91Å; I165-Y400 PolarHBondContact O-OH 3.28Å; L166-Y400 HydrophobicContact CD2-CE2 4.31Å; L166-Y400 PolarHBondContact O-OH 3.1Å; I169-Y400 HydrophobicContact CG2-CE1 4.45Å; L170-Y400 HydrophobicContact CB-CE1 3.83Å; L170-Y400 HydrophobicContact CD1-CD1 3.68Å; L170-Y400 HydrophobicContact CD1-CE1 3.7Å; L170-Y400 HydrophobicContact CD1-CG 4.26Å; L170-Y400 HydrophobicContact CG-CE1 4.41Å; L170-Y400 PolarHBondContact N-OH 3.41Å; V174-Y400 HydrophobicContact CG2-CD1 3.53Å; V174-Y400 HydrophobicContact CG2-CE1 3.58Å; F361-Y400 AromaticContact CE2-CD1 3.71Å; F361-Y400 HydrophobicContact CE2-CD1 3.71Å; F361-Y400 AromaticContact CE2-CE1 3.72Å; F361-Y400 HydrophobicContact CE2-CE1 3.72Å; F361-Y400 HydrophobicContact CE2-CG 4.19Å; F361-Y400 HydrophobicContact CZ-CD1 4.24Å; F361-Y400 HydrophobicContact CZ-CD2 4.46Å; F361-Y400 HydrophobicContact CZ-CE1 4.43Å; F361-Y400 HydrophobicContact CZ-CG 4.26Å; T396-Y400 VanDerWaalsContact O-CD2 3.28Å; T396-Y400 WeakPolarHBondContact O-CD2 3.39Å; T396-Y400 PolarHBondContact O-N 2.94Å; Y400-G402 VanDerWaalsContact C-N 3.33Å; Y400-G402 PolarHBondContact O-N 3.1Å; Y400-T403 PolarHBondContact O-N 3.2Å; Y400-V404 VanDerWaalsContact O-CG2 3.31Å; Y400-V404 WeakPolarHBondContact O-CG2 3.47Å; Y400-V404 PolarHBondContact O-N 2.97Å
401	A	95.5	Very high	95.1	Very high	21 Å²	21	25.3 Å²	25.3	17%	0.174	15%	0.154	C	C	.	.	H	α-helix	trans	-62.5	-41.4	177.6	0	0	0	0	0	111.8	S397 L398 I399 V404 I405	S397-A401 WeakPolarHBondContact O-CB 3.47Å; S397-A401 PolarHBondContact O-N 2.99Å; L398-A401 PolarHBondContact O-N 3.43Å; I399-A401 PolarHBondContact O-N 3.42Å; A401-V404 PolarHBondContact O-N 3.21Å; A401-I405 VanDerWaalsContact O-CG1 3.31Å; A401-I405 WeakPolarHBondContact O-CG1 3.45Å; A401-I405 PolarHBondContact O-N 2.82Å
402	G	95	Very high	95	Very high	29 Å²	29	23.2 Å²	23.2	30%	0.299	14%	0.143	S	C	.	.	H	α-helix	trans	-61.1	-47.5	175.4	0	0	0	0	0	112.2	L398 I399 Y400 V404 I405 V406	L398-G402 PolarHBondContact O-N 3.04Å; I399-G402 PolarHBondContact O-N 3.4Å; Y400-G402 VanDerWaalsContact C-N 3.33Å; Y400-G402 PolarHBondContact O-N 3.1Å; G402-V404 PolarHBondContact O-N 3.45Å; G402-I405 PolarHBondContact O-N 3.29Å; G402-V406 VanDerWaalsContact O-CG2 3.31Å; G402-V406 WeakPolarHBondContact O-CG2 3.46Å; G402-V406 PolarHBondContact O-N 2.9Å
403	T	94.4	Very high	94.7	Very high	5 Å²	5	24.8 Å²	24.8	3%	0.031	15%	0.149	C	C	.	.	H	α-helix	trans	-61.1	-43	177.4	-57.9	0	0	0	0	111.7	L170 V174 F316 I399 Y400 I405 V406 T407 L447	L170-T403 HydrophobicContact CD1-CG2 4.3Å; V174-T403 HydrophobicContact CB-CG2 4.27Å; V174-T403 HydrophobicContact CG1-CG2 3.69Å; F316-T403 HydrophobicContact CE1-CG2 4.44Å; F316-T403 HydrophobicContact CZ-CG2 4.34Å; I399-T403 PolarHBondContact O-N 2.96Å; I399-T403 PolarHBondContact O-OG1 3.34Å; I399-T403 VanDerWaalsContact O-OG1 3.05Å; Y400-T403 PolarHBondContact O-N 3.2Å; T403-I405 PolarHBondContact O-N 3.41Å; T403-V406 PolarHBondContact O-N 3.46Å; T403-T407 HydrophobicContact CG2-CG2 4.13Å; T403-T407 WeakPolarHBondContact O-CB 3.39Å; T403-T407 WeakPolarHBondContact O-CG2 3.44Å; T403-T407 PolarHBondContact O-N 3.02Å; T403-T407 PolarHBondContact O-OG1 3.47Å; T403-L447 HydrophobicContact CG2-CD1 3.95Å; T403-L447 HydrophobicContact CG2-CD2 3.86Å; T403-L447 HydrophobicContact CG2-CG 4.23Å
404	V	95.7	Very high	94.4	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-57.7	-46.5	174.8	167.2	0	0	0	0	111.8	V174 M177 T178 I183 I187 Y400 A401 G402 T407 G408	V174-V404 HydrophobicContact CG1-CB 4.48Å; V174-V404 HydrophobicContact CG1-CG2 3.6Å; M177-V404 HydrophobicContact CE-CG2 3.56Å; T178-V404 HydrophobicContact CG2-CG1 4.22Å; I183-V404 HydrophobicContact CG2-CG1 4.24Å; I187-V404 HydrophobicContact CG1-CG1 4.16Å; Y400-V404 VanDerWaalsContact O-CG2 3.31Å; Y400-V404 WeakPolarHBondContact O-CG2 3.47Å; Y400-V404 PolarHBondContact O-N 2.97Å; A401-V404 PolarHBondContact O-N 3.21Å; G402-V404 PolarHBondContact O-N 3.45Å; V404-T407 PolarHBondContact O-OG1 3.18Å; V404-G408 PolarHBondContact O-N 3.05Å
405	I	95.5	Very high	94.2	Very high	73 Å²	73	23.3 Å²	23.3	37%	0.374	13%	0.134	S	C	.	.	H	α-helix	trans	-65.3	-46.3	-179.5	-68.2	165.1	0	0	0	110.3	I183 I187 A401 G402 T403 A409	I183-I405 HydrophobicContact CG2-CG1 4.14Å; I187-I405 HydrophobicContact CD1-CD1 4.1Å; I187-I405 HydrophobicContact CD1-CG1 3.88Å; A401-I405 VanDerWaalsContact O-CG1 3.31Å; A401-I405 WeakPolarHBondContact O-CG1 3.45Å; A401-I405 PolarHBondContact O-N 2.82Å; G402-I405 PolarHBondContact O-N 3.29Å; T403-I405 PolarHBondContact O-N 3.41Å; I405-A409 WeakPolarHBondContact O-CB 3.28Å; I405-A409 PolarHBondContact O-N 3.01Å
406	V	95.2	Very high	93.8	Very high	14 Å²	14	21.9 Å²	21.9	9%	0.085	13%	0.126	C	C	.	.	H	α-helix	trans	-65.3	-52.1	-177.5	173.1	0	0	0	0	110.7	F316 L317 T320 G402 T403 G408 A409 T410	F316-V406 HydrophobicContact CE1-CB 4.44Å; F316-V406 HydrophobicContact CE1-CG1 4.15Å; F316-V406 HydrophobicContact CE2-CG1 4.19Å; F316-V406 HydrophobicContact CZ-CB 4Å; F316-V406 HydrophobicContact CZ-CG1 3.53Å; L317-V406 HydrophobicContact CD2-CG2 4.04Å; T320-V406 HydrophobicContact CG2-CG1 3.45Å; T320-V406 VanDerWaalsContact CG2-CG1 3.45Å; G402-V406 VanDerWaalsContact O-CG2 3.31Å; G402-V406 WeakPolarHBondContact O-CG2 3.46Å; G402-V406 PolarHBondContact O-N 2.9Å; T403-V406 PolarHBondContact O-N 3.46Å; V406-G408 VanDerWaalsContact C-N 3.32Å; V406-G408 PolarHBondContact O-N 3.47Å; V406-A409 PolarHBondContact O-N 3.25Å; V406-A409 VanDerWaalsContact O-N 3.15Å; V406-T410 WeakPolarHBondContact O-CG2 3.43Å; V406-T410 PolarHBondContact O-N 2.92Å; V406-T410 VanDerWaalsContact O-N 3.09Å; V406-T410 PolarHBondContact O-OG1 2.85Å
407	T	93.6	Very high	93.3	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-63.4	-38.5	-179.7	56.6	0	0	0	0	112.1	F316 T403 V404 A409 V411 T446 L447 L450	F316-T407 HydrophobicContact CE2-CG2 4.39Å; F316-T407 HydrophobicContact CZ-CG2 4.22Å; T403-T407 HydrophobicContact CG2-CG2 4.13Å; T403-T407 WeakPolarHBondContact O-CB 3.39Å; T403-T407 WeakPolarHBondContact O-CG2 3.44Å; T403-T407 PolarHBondContact O-N 3.02Å; T403-T407 PolarHBondContact O-OG1 3.47Å; V404-T407 PolarHBondContact O-OG1 3.18Å; T407-A409 VanDerWaalsContact C-N 3.34Å; T407-V411 PolarHBondContact O-N 3.31Å; T407-T446 HydrophobicContact CG2-CG2 4.42Å; T407-L447 HydrophobicContact CG2-CD1 3.88Å; T407-L450 HydrophobicContact CG2-CD1 4.07Å
408	G	93.8	Very high	92.9	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-70.5	-26.2	176.1	0	0	0	0	0	114	N344 V404 V406	N344-G408 WeakPolarHBondContact CB-O 3.37Å; N344-G408 PolarHBondContact ND2-O 3.47Å; V404-G408 PolarHBondContact O-N 3.05Å; V406-G408 VanDerWaalsContact C-N 3.32Å; V406-G408 PolarHBondContact O-N 3.47Å
409	A	94.6	Very high	92.2	Very high	8 Å²	8	23.9 Å²	23.9	7%	0.066	14%	0.136	C	C	.	.	H	α-helix	trans	-84.6	-22.4	177.9	0	0	0	0	0	113.7	Y336 S337 F341 I405 V406 T407	Y336-A409 HydrophobicContact CD1-CB 4.12Å; Y336-A409 HydrophobicContact CE1-CB 4.41Å; S337-A409 PolarHBondContact N-O 3.18Å; F341-A409 HydrophobicContact CB-CB 4.49Å; F341-A409 HydrophobicContact CD2-CB 3.99Å; I405-A409 WeakPolarHBondContact O-CB 3.28Å; I405-A409 PolarHBondContact O-N 3.01Å; V406-A409 PolarHBondContact O-N 3.25Å; V406-A409 VanDerWaalsContact O-N 3.15Å; T407-A409 VanDerWaalsContact C-N 3.34Å
410	T	94.4	Very high	91.6	Very high	0 Å²	0	24.9 Å²	24.9	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-114.3	-11.5	-169.6	61.8	0	0	0	0	115.7	V333 T334 G335 Y336 V406	V333-T410 WeakPolarHBondContact CA-O 3.32Å; T334-T410 PolarHBondContact N-O 2.99Å; T334-T410 PolarHBondContact OG1-O 3.33Å; G335-T410 PolarHBondContact N-O 2.98Å; G335-T410 WeakPolarHBondContact O-CA 3.35Å; Y336-T410 HydrophobicContact CD1-CG2 3.77Å; Y336-T410 HydrophobicContact CD2-CG2 4.19Å; Y336-T410 HydrophobicContact CE1-CG2 3.79Å; Y336-T410 HydrophobicContact CE2-CG2 4.21Å; Y336-T410 HydrophobicContact CG-CG2 3.99Å; V406-T410 WeakPolarHBondContact O-CG2 3.43Å; V406-T410 PolarHBondContact O-N 2.92Å; V406-T410 VanDerWaalsContact O-N 3.09Å; V406-T410 PolarHBondContact O-OG1 2.85Å
411	V	94.3	Very high	90.9	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	16%	0.157	C	C	.	.	B	Isolated β-bridge	trans	-137.3	133.8	-175	-171.6	0	0	0	0	111.5	G332 V333 N344 T407 I440 T446 L450	G332-V411 WeakPolarHBondContact O-CA 3.45Å; V333-V411 HydrophobicContact CG2-CG2 4.19Å; N344-V411 PolarHBondContact ND2-O 3.08Å; T407-V411 PolarHBondContact O-N 3.31Å; V411-I440 HydrophobicContact CB-CG2 3.54Å; V411-I440 HydrophobicContact CG1-CG2 3.54Å; V411-I440 HydrophobicContact CG2-CG2 4.42Å; V411-T446 HydrophobicContact CG1-CG2 4.47Å; V411-T446 HydrophobicContact CG2-CG2 4.1Å; V411-L450 HydrophobicContact CG2-CD1 3.75Å; V411-L450 HydrophobicContact CG2-CD2 3.67Å; V411-L450 HydrophobicContact CG2-CG 3.95Å
412	I	92.8	Very high	90	Very high	32 Å²	32	26.6 Å²	26.6	16%	0.164	16%	0.156	C	C	.	.			trans	-72.8	157.3	176	65.3	-179	0	0	0	112	G332 T334 T340 Q414 A415 I427 G439 I440	G332-I412 PolarHBondContact O-N 3.09Å; T334-I412 HydrophobicContact CG2-CG2 3.85Å; T340-I412 HydrophobicContact CG2-CG2 4.16Å; I412-Q414 VanDerWaalsContact C-N 3.35Å; I412-Q414 VanDerWaalsContact CD1-O 3.22Å; I412-Q414 WeakPolarHBondContact CD1-O 3.27Å; I412-Q414 PolarHBondContact O-N 2.86Å; I412-A415 HydrophobicContact CD1-CB 4.09Å; I412-A415 HydrophobicContact CG1-CB 4.31Å; I412-I427 HydrophobicContact CD1-CB 4.37Å; I412-I427 HydrophobicContact CD1-CG2 3.8Å; I412-G439 WeakPolarHBondContact O-CA 3.38Å; I412-I440 PolarHBondContact O-N 3.34Å; I412-I440 VanDerWaalsContact O-N 3.12Å
413	R	90.5	Very high	89.2	Confident	33 Å²	33	30.5 Å²	30.5	13%	0.125	18%	0.175	C	C	.	.	S	Bend	trans	-55.5	-46.8	179.3	-71.5	-168.2	164.1	122.7	12.9	113.8	A179 N344 W346 D348 G439 I440 M441	A179-R413 PolarHBondContact O-NE 3.35Å; A179-R413 PolarHBondContact O-NH2 3.49Å; N344-R413 WeakPolarHBondContact OD1-CG 3.37Å; W346-R413 PolarHBondContact O-NH2 3.12Å; D348-R413 IonicContact OD2-CZ 4Å; D348-R413 IonicContact OD2-NH1 3.23Å; D348-R413 PolarHBondContact OD2-NH1 3.01Å; R413-G439 CarbonylContact O-C 3.48Å; R413-I440 PolarHBondContact O-N 3.46Å; R413-M441 HydrophobicContact CB-CE 4.44Å; R413-M441 WeakPolarHBondContact O-CB 3.39Å; R413-M441 PolarHBondContact O-N 3.28Å
414	Q	90	Very high	88.6	Confident	20 Å²	20	36.2 Å²	36.2	9%	0.093	21%	0.205	C	C	.	.			trans	-139.1	132	-169	-70.3	-173.9	-18.6	0	0	109.9	I412 C436 M441	I412-Q414 VanDerWaalsContact C-N 3.35Å; I412-Q414 VanDerWaalsContact CD1-O 3.22Å; I412-Q414 WeakPolarHBondContact CD1-O 3.27Å; I412-Q414 PolarHBondContact O-N 2.86Å; Q414-C436 HydrophobicContact CB-CB 4.08Å; Q414-M441 HydrophobicContact CG-CB 4.28Å; Q414-M441 HydrophobicContact CG-SD 3.99Å; Q414-M441 PolarHBondContact NE2-SD 3.37Å
415	A	90.1	Very high	87.7	Confident	0 Å²	0	39.2 Å²	39.2	0%	0	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-141.1	143.9	179	0	0	0	0	0	111.3	R331 I412 I427 C430 C436 S437 F438	R331-A415 WeakPolarHBondContact O-CB 3.48Å; I412-A415 HydrophobicContact CD1-CB 4.09Å; I412-A415 HydrophobicContact CG1-CB 4.31Å; A415-I427 HydrophobicContact CB-CG2 3.65Å; A415-C430 VanDerWaalsContact C-SG 3.57Å; A415-C436 WeakPolarHBondContact O-CB 3.34Å; A415-S437 PolarHBondContact O-N 2.89Å; A415-F438 HydrophobicContact CB-CB 4.04Å; A415-F438 PolarHBondContact N-O 2.84Å; A415-F438 CarbonylContact O-C 3.57Å; A415-F438 WeakPolarHBondContact O-CA 3.13Å; A415-F438 PolarHBondContact O-N 3.27Å
416	S	87.4	Confident	87	Confident	24 Å²	24	37.5 Å²	37.5	17%	0.168	23%	0.23	C	C	.	.			trans	-71.5	-34.2	-179.8	64.3	0	0	0	0	112.8	E418 D421 I427 C430	S416-E418 VanDerWaalsContact C-N 3.33Å; S416-E418 PolarHBondContact OG-N 3.44Å; S416-D421 VanDerWaalsContact CB-OD2 3.28Å; S416-D421 WeakPolarHBondContact CB-OD2 3.42Å; S416-D421 WeakPolarHBondContact OG-CB 3.36Å; S416-D421 PolarHBondContact OG-OD2 2.75Å; S416-I427 PolarHBondContact N-O 3.34Å; S416-I427 VanDerWaalsContact N-O 3.14Å; S416-C430 VanDerWaalsContact CA-SG 3.56Å; S416-C430 PolarHBondContact N-SG 3.19Å
417	G	84.9	Confident	86.5	Confident	19 Å²	19	38.3 Å²	38.3	20%	0.196	23%	0.234	C	C	.	.			trans	92.2	-12.4	-172.5	0	0	0	0	0	114	S330 F438	S330-G417 WeakPolarHBondContact CB-O 3.45Å; S330-G417 WeakPolarHBondContact O-CA 3.49Å; S330-G417 PolarHBondContact O-N 2.9Å; S330-G417 PolarHBondContact OG-O 3.2Å; G417-F438 VanDerWaalsContact CA-CD2 3.43Å
418	E	85	Confident	85.9	Confident	107 Å²	107	41.8 Å²	41.8	50%	0.5	26%	0.258	S	S	.	.			trans	-83.9	130.3	-175.7	-172.8	57.4	-105.9	0	0	111.1	S416 S420 D421 A422	S416-E418 VanDerWaalsContact C-N 3.33Å; S416-E418 PolarHBondContact OG-N 3.44Å; E418-S420 VanDerWaalsContact C-N 3.26Å; E418-S420 VanDerWaalsContact CG-OG 3.26Å; E418-S420 WeakPolarHBondContact CG-OG 3.47Å; E418-S420 PolarHBondContact O-N 2.93Å; E418-D421 HydrophobicContact CB-CB 4.48Å; E418-D421 PolarHBondContact O-N 2.69Å; E418-A422 PolarHBondContact O-N 2.9Å
419	I	82.3	Confident	85.3	Confident	68 Å²	68	44.2 Å²	44.2	35%	0.349	28%	0.278	S	S	.	.	H	α-helix	trans	-66.7	-33.6	-175.7	-64.3	162.1	0	0	0	110.4	V327 D421 A422 V423	V327-I419 HydrophobicContact CG2-CD1 4.5Å; I419-D421 VanDerWaalsContact C-N 3.32Å; I419-D421 PolarHBondContact O-N 3.4Å; I419-A422 VanDerWaalsContact O-CB 3.31Å; I419-A422 WeakPolarHBondContact O-CB 3.49Å; I419-A422 PolarHBondContact O-N 3.45Å; I419-A422 VanDerWaalsContact O-N 3.1Å; I419-V423 PolarHBondContact O-N 2.77Å; I419-V423 VanDerWaalsContact O-N 3.14Å
420	S	82.3	Confident	84.8	Confident	65 Å²	65	44.5 Å²	44.5	46%	0.455	28%	0.279	S	S	.	.	H	α-helix	trans	-63.2	-35.1	177.5	66.6	0	0	0	0	113.4	E418 A422 V423 N424	E418-S420 VanDerWaalsContact C-N 3.26Å; E418-S420 VanDerWaalsContact CG-OG 3.26Å; E418-S420 WeakPolarHBondContact CG-OG 3.47Å; E418-S420 PolarHBondContact O-N 2.93Å; S420-A422 VanDerWaalsContact C-N 3.31Å; S420-V423 PolarHBondContact O-N 2.98Å; S420-N424 WeakPolarHBondContact O-CB 3.33Å; S420-N424 VanDerWaalsContact O-CG 3.22Å; S420-N424 PolarHBondContact O-N 3.33Å; S420-N424 PolarHBondContact O-ND2 3.44Å
421	D	81.7	Confident	84.1	Confident	42 Å²	42	46.1 Å²	46.1	23%	0.225	29%	0.293	C	S	.	.	H	α-helix	trans	-69.5	-31.2	174.4	-75.8	-31.8	0	0	0	112	S416 E418 I419 N424 G425 S426 I427	S416-D421 VanDerWaalsContact CB-OD2 3.28Å; S416-D421 WeakPolarHBondContact CB-OD2 3.42Å; S416-D421 WeakPolarHBondContact OG-CB 3.36Å; S416-D421 PolarHBondContact OG-OD2 2.75Å; E418-D421 HydrophobicContact CB-CB 4.48Å; E418-D421 PolarHBondContact O-N 2.69Å; I419-D421 VanDerWaalsContact C-N 3.32Å; I419-D421 PolarHBondContact O-N 3.4Å; D421-N424 PolarHBondContact O-N 3.15Å; D421-G425 PolarHBondContact O-N 3.31Å; D421-S426 PolarHBondContact O-N 3.32Å; D421-S426 PolarHBondContact OD1-OG 3.4Å; D421-I427 WeakPolarHBondContact O-CG1 3.48Å; D421-I427 PolarHBondContact O-N 2.98Å
422	A	76.7	Confident	83.4	Confident	19 Å²	19	54.6 Å²	54.6	16%	0.157	33%	0.332	C	S	.	.	H	α-helix	trans	-64.3	-44.9	175.2	0	0	0	0	0	112.3	E418 I419 S420 I427	E418-A422 PolarHBondContact O-N 2.9Å; I419-A422 VanDerWaalsContact O-CB 3.31Å; I419-A422 WeakPolarHBondContact O-CB 3.49Å; I419-A422 PolarHBondContact O-N 3.45Å; I419-A422 VanDerWaalsContact O-N 3.1Å; S420-A422 VanDerWaalsContact C-N 3.31Å; A422-I427 VanDerWaalsContact CA-CG1 3.41Å; A422-I427 HydrophobicContact CB-CD1 3.94Å; A422-I427 HydrophobicContact CB-CG1 4.15Å
423	V	79	Confident	82.8	Confident	112 Å²	112	59.3 Å²	59.3	68%	0.679	36%	0.358	S	S	*	.	H	α-helix	trans	-70.6	-35.8	177.9	-179.5	0	0	0	0	111.7	I419 S420	I419-V423 PolarHBondContact O-N 2.77Å; I419-V423 VanDerWaalsContact O-N 3.14Å; S420-V423 PolarHBondContact O-N 2.98Å
424	N	80.3	Confident	82.1	Confident	124 Å²	124	60.8 Å²	60.8	66%	0.663	38%	0.384	S	S	*	.	H	α-helix	trans	-81.3	-10.6	-178.9	-70.1	-20.7	0	0	0	114.3	S420 D421 S426	S420-N424 WeakPolarHBondContact O-CB 3.33Å; S420-N424 VanDerWaalsContact O-CG 3.22Å; S420-N424 PolarHBondContact O-N 3.33Å; S420-N424 PolarHBondContact O-ND2 3.44Å; D421-N424 PolarHBondContact O-N 3.15Å; N424-S426 VanDerWaalsContact C-N 3.3Å
425	G	76.5	Confident	81.8	Confident	64 Å²	64	64.1 Å²	64.1	66%	0.66	41%	0.405	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.1	16.2	-174.9	0	0	0	0	0	114.4	D421	D421-G425 PolarHBondContact O-N 3.31Å
426	S	82.4	Confident	81.7	Confident	36 Å²	36	64.4 Å²	64.4	25%	0.252	41%	0.408	S	S	.	.			trans	-100.1	16.1	180	51.7	0	0	0	0	113.9	D421 N424 S428 A429	D421-S426 PolarHBondContact O-N 3.32Å; D421-S426 PolarHBondContact OD1-OG 3.4Å; N424-S426 VanDerWaalsContact C-N 3.3Å; S426-S428 VanDerWaalsContact C-N 3.26Å; S426-S428 PolarHBondContact O-N 3.38Å; S426-S428 VanDerWaalsContact O-N 3.11Å; S426-A429 WeakPolarHBondContact O-CB 3.34Å; S426-A429 PolarHBondContact O-N 2.95Å
427	I	83.4	Confident	81.5	Confident	32 Å²	32	67 Å²	67	16%	0.164	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.8	-40.6	-173.6	-52.8	175.4	0	0	0	113.4	I412 A415 S416 D421 A422 C430	I412-I427 HydrophobicContact CD1-CB 4.37Å; I412-I427 HydrophobicContact CD1-CG2 3.8Å; A415-I427 HydrophobicContact CB-CG2 3.65Å; S416-I427 PolarHBondContact N-O 3.34Å; S416-I427 VanDerWaalsContact N-O 3.14Å; D421-I427 WeakPolarHBondContact O-CG1 3.48Å; D421-I427 PolarHBondContact O-N 2.98Å; A422-I427 VanDerWaalsContact CA-CG1 3.41Å; A422-I427 HydrophobicContact CB-CD1 3.94Å; A422-I427 HydrophobicContact CB-CG1 4.15Å; I427-C430 PolarHBondContact O-SG 3.11Å
428	S	81.1	Confident	81.7	Confident	72 Å²	72	68.2 Å²	68.2	50%	0.503	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	1.1	-177.6	60.2	0	0	0	0	113.9	S426 C430 A431	S426-S428 VanDerWaalsContact C-N 3.26Å; S426-S428 PolarHBondContact O-N 3.38Å; S426-S428 VanDerWaalsContact O-N 3.11Å; S428-C430 VanDerWaalsContact C-N 3.25Å; S428-C430 PolarHBondContact O-N 3.04Å; S428-A431 WeakPolarHBondContact O-CB 3.43Å; S428-A431 PolarHBondContact O-N 3.26Å; S428-A431 VanDerWaalsContact O-N 3.16Å
429	A	81.6	Confident	81.9	Confident	52 Å²	52	63.2 Å²	63.2	43%	0.43	40%	0.403	S	S	.	.	G	3₁₀ helix	trans	-67.5	-26	-177.4	0	0	0	0	0	112.9	S426 A431 Q432	S426-A429 WeakPolarHBondContact O-CB 3.34Å; S426-A429 PolarHBondContact O-N 2.95Å; A429-A431 PolarHBondContact O-N 3.07Å; A429-Q432 PolarHBondContact O-N 3.36Å
430	C	84.4	Confident	82.3	Confident	13 Å²	13	60 Å²	60	9%	0.088	39%	0.386	C	S	.	.	G	3₁₀ helix	trans	-58.9	-16.2	173.6	58	0	0	0	0	113.3	A415 S416 I427 S428 Q432 N433 G434 T435 C436	A415-C430 VanDerWaalsContact C-SG 3.57Å; S416-C430 VanDerWaalsContact CA-SG 3.56Å; S416-C430 PolarHBondContact N-SG 3.19Å; I427-C430 PolarHBondContact O-SG 3.11Å; S428-C430 VanDerWaalsContact C-N 3.25Å; S428-C430 PolarHBondContact O-N 3.04Å; C430-Q432 VanDerWaalsContact C-N 3.25Å; C430-Q432 PolarHBondContact O-N 3.27Å; C430-N433 PolarHBondContact O-N 3.27Å; C430-G434 PolarHBondContact O-N 2.92Å; C430-T435 PolarHBondContact O-N 3.31Å; C430-C436 VanDerWaalsContact CA-SG 3.58Å; C430-C436 HydrophobicContact CB-CB 4.08Å; C430-C436 WeakPolarHBondContact CB-SG 3.33Å; C430-C436 WeakPolarHBondContact SG-CA 3.34Å; C430-C436 WeakPolarHBondContact SG-CB 3.4Å; C430-C436 CovalentContact SG-SG 2.02Å; C430-C436 PolarHBondContact SG-SG 3.06Å
431	A	80.3	Confident	82.6	Confident	34 Å²	34	57.2 Å²	57.2	28%	0.281	37%	0.366	S	S	.	.	G	3₁₀ helix	trans	-57.8	-38.3	176.1	0	0	0	0	0	112.2	S428 A429 N433 G434 C436	S428-A431 WeakPolarHBondContact O-CB 3.43Å; S428-A431 PolarHBondContact O-N 3.26Å; S428-A431 VanDerWaalsContact O-N 3.16Å; A429-A431 PolarHBondContact O-N 3.07Å; A431-N433 VanDerWaalsContact C-N 3.31Å; A431-N433 PolarHBondContact O-N 3.44Å; A431-G434 PolarHBondContact O-N 3.41Å; A431-C436 PolarHBondContact N-SG 3.2Å
432	Q	79.1	Confident	82.8	Confident	178 Å²	178	58.5 Å²	58.5	83%	0.832	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-32.9	-178.3	-64.1	-176.9	-3.4	0	0	112.1	A429 C430	A429-Q432 PolarHBondContact O-N 3.36Å; C430-Q432 VanDerWaalsContact C-N 3.25Å; C430-Q432 PolarHBondContact O-N 3.27Å
433	N	79.5	Confident	83.3	Confident	131 Å²	131	59.3 Å²	59.3	70%	0.701	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.2	-8.8	179.3	-67.3	-14.5	0	0	0	113	C430 A431 T435	C430-N433 PolarHBondContact O-N 3.27Å; A431-N433 VanDerWaalsContact C-N 3.31Å; A431-N433 PolarHBondContact O-N 3.44Å; N433-T435 VanDerWaalsContact C-N 3.25Å; N433-T435 HydrophobicContact CB-CG2 3.97Å; N433-T435 PolarHBondContact O-N 2.92Å
434	G	76.6	Confident	83.4	Confident	64 Å²	64	58.6 Å²	58.6	66%	0.66	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.1	22.6	-174.1	0	0	0	0	0	114	C430 A431	C430-G434 PolarHBondContact O-N 2.92Å; A431-G434 PolarHBondContact O-N 3.41Å
435	T	83.8	Confident	83.8	Confident	90 Å²	90	53.8 Å²	53.8	55%	0.552	33%	0.332	S	S	*	.			trans	-102.4	6	-173.8	58.3	0	0	0	0	114.1	C430 N433 S437	C430-T435 PolarHBondContact O-N 3.31Å; N433-T435 VanDerWaalsContact C-N 3.25Å; N433-T435 HydrophobicContact CB-CG2 3.97Å; N433-T435 PolarHBondContact O-N 2.92Å; T435-S437 PolarHBondContact O-N 3.44Å
436	C	86.5	Confident	84.3	Confident	7 Å²	7	50.8 Å²	50.8	5%	0.047	30%	0.3	C	S	.	.			trans	-67.1	122.4	179.7	-57.2	0	0	0	0	111.2	Q414 A415 C430 A431 N442	Q414-C436 HydrophobicContact CB-CB 4.08Å; A415-C436 WeakPolarHBondContact O-CB 3.34Å; C430-C436 VanDerWaalsContact CA-SG 3.58Å; C430-C436 HydrophobicContact CB-CB 4.08Å; C430-C436 WeakPolarHBondContact CB-SG 3.33Å; C430-C436 WeakPolarHBondContact SG-CA 3.34Å; C430-C436 WeakPolarHBondContact SG-CB 3.4Å; C430-C436 CovalentContact SG-SG 2.02Å; C430-C436 PolarHBondContact SG-SG 3.06Å; A431-C436 PolarHBondContact N-SG 3.2Å; C436-N442 PolarHBondContact O-ND2 3.18Å
437	S	84.4	Confident	84.7	Confident	77 Å²	77	49.1 Å²	49.1	54%	0.538	29%	0.289	S	S	.	.			trans	-90.6	-20.7	175.3	-56.5	0	0	0	0	113.3	A415 T435	A415-S437 PolarHBondContact O-N 2.89Å; T435-S437 PolarHBondContact O-N 3.44Å
438	F	89.1	Confident	85	Confident	45 Å²	45	49.1 Å²	49.1	20%	0.197	29%	0.288	C	S	.	.	B	Isolated β-bridge	trans	-118.2	-177.3	-174.3	-63.9	-84.6	0	0	0	112.8	R331 A415 G417 Y443	R331-F438 HydrophobicContact CB-CB 4.12Å; R331-F438 HydrophobicContact CB-CD1 3.95Å; R331-F438 HydrophobicContact CB-CG 4.05Å; R331-F438 HydrophobicContact CG-CB 4.44Å; R331-F438 HydrophobicContact CG-CD1 3.64Å; R331-F438 HydrophobicContact CG-CD2 4.24Å; R331-F438 HydrophobicContact CG-CE1 3.83Å; R331-F438 HydrophobicContact CG-CE2 4.39Å; R331-F438 HydrophobicContact CG-CG 3.85Å; R331-F438 HydrophobicContact CG-CZ 4.2Å; R331-F438 WeakPolarHBondContact O-CB 3.38Å; A415-F438 HydrophobicContact CB-CB 4.04Å; A415-F438 PolarHBondContact N-O 2.84Å; A415-F438 CarbonylContact O-C 3.57Å; A415-F438 WeakPolarHBondContact O-CA 3.13Å; A415-F438 PolarHBondContact O-N 3.27Å; G417-F438 VanDerWaalsContact CA-CD2 3.43Å; F438-Y443 HydrophobicContact CD1-CD2 4.03Å; F438-Y443 HydrophobicContact CD1-CG 4.09Å; F438-Y443 HydrophobicContact CE1-CD2 4.14Å; F438-Y443 HydrophobicContact CE1-CE2 4.27Å
439	G	89	Confident	85.4	Confident	2 Å²	2	46.5 Å²	46.5	2%	0.021	27%	0.268	C	S	.	.	S	Bend	trans	90.7	167.7	-168.4	0	0	0	0	0	112.8	R331 I412 R413 M441 N442 Y443	R331-G439 PolarHBondContact O-N 2.98Å; I412-G439 WeakPolarHBondContact O-CA 3.38Å; R413-G439 CarbonylContact O-C 3.48Å; G439-M441 PolarHBondContact O-N 3.2Å; G439-N442 PolarHBondContact O-N 3.24Å; G439-Y443 WeakPolarHBondContact O-CB 3.41Å; G439-Y443 PolarHBondContact O-N 2.84Å
440	I	91.1	Very high	85.9	Confident	0 Å²	0	44.2 Å²	44.2	0%	0	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-17.3	-174.5	55.7	172.6	0	0	0	114.1	S175 W176 T178 A179 V411 I412 R413 T446	S175-I440 CarbonylContact C-O 3.52Å; W176-I440 WeakPolarHBondContact CA-O 3.41Å; W176-I440 PolarHBondContact N-O 3.18Å; T178-I440 HydrophobicContact CG2-CD1 4.24Å; A179-I440 HydrophobicContact CB-CB 4.28Å; A179-I440 HydrophobicContact CB-CD1 3.99Å; A179-I440 HydrophobicContact CB-CG1 3.69Å; V411-I440 HydrophobicContact CB-CG2 3.54Å; V411-I440 HydrophobicContact CG1-CG2 3.54Å; V411-I440 HydrophobicContact CG2-CG2 4.42Å; I412-I440 PolarHBondContact O-N 3.34Å; I412-I440 VanDerWaalsContact O-N 3.12Å; R413-I440 PolarHBondContact O-N 3.46Å; I440-T446 HydrophobicContact CG2-CG2 3.84Å
441	M	87.8	Confident	86.2	Confident	7 Å²	7	43.9 Å²	43.9	3%	0.034	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79	-46.6	179.5	-168.3	166.2	-77.5	0	0	112.9	A179 Y350 R413 Q414 G439	A179-M441 HydrophobicContact CB-CB 3.84Å; A179-M441 HydrophobicContact CB-CE 4.09Å; A179-M441 HydrophobicContact CB-CG 4.29Å; Y350-M441 HydrophobicContact CD2-CE 3.17Å; Y350-M441 HydrophobicContact CD2-SD 3.66Å; Y350-M441 HydrophobicContact CE2-CE 3.41Å; Y350-M441 VanDerWaalsContact CE2-CE 3.41Å; Y350-M441 HydrophobicContact CE2-SD 3.94Å; Y350-M441 HydrophobicContact CG-CE 4.05Å; Y350-M441 HydrophobicContact CG-SD 3.98Å; R413-M441 HydrophobicContact CB-CE 4.44Å; R413-M441 WeakPolarHBondContact O-CB 3.39Å; R413-M441 PolarHBondContact O-N 3.28Å; Q414-M441 HydrophobicContact CG-CB 4.28Å; Q414-M441 HydrophobicContact CG-SD 3.99Å; Q414-M441 PolarHBondContact NE2-SD 3.37Å; G439-M441 PolarHBondContact O-N 3.2Å
442	N	86.2	Confident	86.8	Confident	70 Å²	70	44.5 Å²	44.5	37%	0.374	25%	0.253	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106	-19	-170.1	-66.5	-24.2	0	0	0	113.1	C436 G439	C436-N442 PolarHBondContact O-ND2 3.18Å; G439-N442 PolarHBondContact O-N 3.24Å
443	Y	87.6	Confident	87.4	Confident	36 Å²	36	43.6 Å²	43.6	14%	0.141	24%	0.242	C	C	.	.			trans	-103.4	98.4	179.2	-170	-114	0	0	0	112.5	F438 G439 Q445 T446 L449	F438-Y443 HydrophobicContact CD1-CD2 4.03Å; F438-Y443 HydrophobicContact CD1-CG 4.09Å; F438-Y443 HydrophobicContact CE1-CD2 4.14Å; F438-Y443 HydrophobicContact CE1-CE2 4.27Å; G439-Y443 WeakPolarHBondContact O-CB 3.41Å; G439-Y443 PolarHBondContact O-N 2.84Å; Y443-Q445 VanDerWaalsContact C-N 3.26Å; Y443-Q445 HydrophobicContact CE1-CB 3.84Å; Y443-Q445 VanDerWaalsContact CE1-O 3.24Å; Y443-Q445 WeakPolarHBondContact CE1-O 3.47Å; Y443-Q445 HydrophobicContact CE2-CB 4.28Å; Y443-Q445 PolarHBondContact O-N 3.24Å; Y443-T446 PolarHBondContact O-N 2.89Å; Y443-T446 PolarHBondContact O-OG1 3.44Å; Y443-L449 HydrophobicContact CD1-CD2 4.44Å; Y443-L449 HydrophobicContact CE1-CB 3.98Å; Y443-L449 HydrophobicContact CE1-CD2 4.49Å
444	Y	82	Confident	87.7	Confident	97 Å²	97	38.2 Å²	38.2	38%	0.38	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.7	-22.3	-176.6	-64.5	-61.1	0	0	0	114.2	L172 W176 T446	L172-Y444 WeakPolarHBondContact CA-O 3.43Å; L172-Y444 WeakPolarHBondContact O-CB 3.47Å; L172-Y444 WeakPolarHBondContact O-CD1 3.47Å; W176-Y444 HydrophobicContact CB-CD1 4.09Å; W176-Y444 HydrophobicContact CB-CE1 3.83Å; W176-Y444 AromaticContact CD1-CE1 3.61Å; W176-Y444 AromaticContact CG-CE1 3.8Å; W176-Y444 HydrophobicContact CG-CE1 3.8Å; Y444-T446 VanDerWaalsContact C-N 3.29Å; Y444-T446 PolarHBondContact O-N 3.37Å
445	Q	86.8	Confident	88.3	Confident	23 Å²	23	38.6 Å²	38.6	11%	0.107	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	-93.3	31.8	178.3	-68.2	171	-10.3	0	0	112.6	L172 Y443 L447 E448 L449	L172-Q445 HydrophobicContact CD2-CG 3.99Å; Y443-Q445 VanDerWaalsContact C-N 3.26Å; Y443-Q445 HydrophobicContact CE1-CB 3.84Å; Y443-Q445 VanDerWaalsContact CE1-O 3.24Å; Y443-Q445 WeakPolarHBondContact CE1-O 3.47Å; Y443-Q445 HydrophobicContact CE2-CB 4.28Å; Y443-Q445 PolarHBondContact O-N 3.24Å; Q445-L447 PolarHBondContact O-N 3.12Å; Q445-L447 VanDerWaalsContact O-N 3.13Å; Q445-E448 HydrophobicContact CB-CB 4.36Å; Q445-E448 WeakPolarHBondContact O-CB 3.33Å; Q445-E448 PolarHBondContact O-N 3.04Å; Q445-L449 PolarHBondContact O-N 3.47Å
446	T	88.8	Confident	88.7	Confident	1 Å²	1	36.2 Å²	36.2	1%	0.006	19%	0.192	C	C	.	.	H	α-helix	trans	-52.8	-37.7	-179.1	-61.9	0	0	0	0	112.9	S175 T407 V411 I440 Y443 Y444 E448 L449 L450	S175-T446 WeakPolarHBondContact CB-OG1 3.06Å; T407-T446 HydrophobicContact CG2-CG2 4.42Å; V411-T446 HydrophobicContact CG1-CG2 4.47Å; V411-T446 HydrophobicContact CG2-CG2 4.1Å; I440-T446 HydrophobicContact CG2-CG2 3.84Å; Y443-T446 PolarHBondContact O-N 2.89Å; Y443-T446 PolarHBondContact O-OG1 3.44Å; Y444-T446 VanDerWaalsContact C-N 3.29Å; Y444-T446 PolarHBondContact O-N 3.37Å; T446-E448 VanDerWaalsContact C-N 3.25Å; T446-E448 PolarHBondContact O-N 2.95Å; T446-L449 WeakPolarHBondContact O-CB 3.44Å; T446-L449 PolarHBondContact O-N 3.16Å; T446-L450 HydrophobicContact CG2-CD1 3.94Å; T446-L450 HydrophobicContact CG2-CG 4.39Å; T446-L450 WeakPolarHBondContact O-CG 3.33Å; T446-L450 PolarHBondContact O-N 3.04Å; T446-L450 VanDerWaalsContact O-N 3.08Å
447	L	90.5	Very high	88.9	Confident	1 Å²	1	35.9 Å²	35.9	1%	0.005	19%	0.19	C	C	.	.	H	α-helix	trans	-64.4	-31.9	179.6	-86.1	73.2	0	0	0	112.3	F171 F316 T403 T407 Q445 L450 G451 V457	F171-L447 HydrophobicContact CD1-CB 4.03Å; F171-L447 HydrophobicContact CD1-CD2 3.6Å; F171-L447 HydrophobicContact CD1-CG 4.45Å; F171-L447 HydrophobicContact CE1-CD2 3.97Å; F171-L447 HydrophobicContact CG-CD2 4.36Å; F316-L447 HydrophobicContact CD2-CB 4.19Å; F316-L447 HydrophobicContact CD2-CG 3.98Å; F316-L447 HydrophobicContact CE2-CB 4.46Å; F316-L447 HydrophobicContact CE2-CG 3.86Å; F316-L447 HydrophobicContact CG-CG 4.47Å; F316-L447 HydrophobicContact CZ-CG 4.26Å; T403-L447 HydrophobicContact CG2-CD1 3.95Å; T403-L447 HydrophobicContact CG2-CD2 3.86Å; T403-L447 HydrophobicContact CG2-CG 4.23Å; T407-L447 HydrophobicContact CG2-CD1 3.88Å; Q445-L447 PolarHBondContact O-N 3.12Å; Q445-L447 VanDerWaalsContact O-N 3.13Å; L447-L450 PolarHBondContact O-N 3.11Å; L447-G451 PolarHBondContact O-N 3.37Å; L447-G451 VanDerWaalsContact O-N 3.13Å; L447-V457 HydrophobicContact CB-CG1 4.24Å
448	E	89.4	Confident	89.1	Confident	32 Å²	32	32.6 Å²	32.6	15%	0.15	17%	0.167	C	C	.	.	H	α-helix	trans	-68.7	-42.9	175.5	-175.9	179	143.2	0	0	111	Q445 T446 L450 G451 V457 T458	Q445-E448 HydrophobicContact CB-CB 4.36Å; Q445-E448 WeakPolarHBondContact O-CB 3.33Å; Q445-E448 PolarHBondContact O-N 3.04Å; T446-E448 VanDerWaalsContact C-N 3.25Å; T446-E448 PolarHBondContact O-N 2.95Å; E448-L450 PolarHBondContact O-N 3.34Å; E448-G451 PolarHBondContact O-N 3.43Å; E448-G451 VanDerWaalsContact O-N 3.13Å; E448-V457 HydrophobicContact CB-CB 4.32Å; E448-V457 HydrophobicContact CB-CG1 4.15Å; E448-V457 HydrophobicContact CG-CB 4.45Å; E448-T458 VanDerWaalsContact CD-OG1 3.22Å; E448-T458 PolarHBondContact OE2-OG1 3.38Å
449	L	89	Confident	89.1	Confident	17 Å²	17	32.2 Å²	32.2	9%	0.089	17%	0.171	C	C	.	.	H	α-helix	trans	-60.3	-33.2	175.6	178.5	65.6	0	0	0	112.8	Q328 R331 V333 Y443 Q445 T446	Q328-L449 HydrophobicContact CG-CD1 4.05Å; Q328-L449 PolarHBondContact NE2-O 2.79Å; R331-L449 HydrophobicContact CB-CD1 4.3Å; R331-L449 HydrophobicContact CB-CD2 3.74Å; V333-L449 HydrophobicContact CG2-CD2 3.69Å; V333-L449 HydrophobicContact CG2-CG 3.81Å; Y443-L449 HydrophobicContact CD1-CD2 4.44Å; Y443-L449 HydrophobicContact CE1-CB 3.98Å; Y443-L449 HydrophobicContact CE1-CD2 4.49Å; Q445-L449 PolarHBondContact O-N 3.47Å; T446-L449 WeakPolarHBondContact O-CB 3.44Å; T446-L449 PolarHBondContact O-N 3.16Å
450	L	91.8	Very high	89.2	Confident	3 Å²	3	32.1 Å²	32.1	2%	0.016	17%	0.17	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-11.2	178.9	-73.7	175.9	0	0	0	113.8	F316 G319 T320 V333 T407 V411 T446 L447 E448	F316-L450 HydrophobicContact CD2-CB 3.84Å; F316-L450 HydrophobicContact CE2-CB 3.82Å; F316-L450 HydrophobicContact CE2-CD1 3.71Å; F316-L450 HydrophobicContact CE2-CG 4.45Å; G319-L450 CarbonylContact C-O 3.18Å; G319-L450 WeakPolarHBondContact CA-O 3.28Å; T320-L450 HydrophobicContact CG2-CB 3.91Å; T320-L450 HydrophobicContact CG2-CD1 4.2Å; T320-L450 HydrophobicContact CG2-CD2 4.19Å; T320-L450 HydrophobicContact CG2-CG 4.34Å; T320-L450 PolarHBondContact N-O 3.14Å; V333-L450 HydrophobicContact CG1-CD2 3.72Å; V333-L450 HydrophobicContact CG2-CD2 4.02Å; T407-L450 HydrophobicContact CG2-CD1 4.07Å; V411-L450 HydrophobicContact CG2-CD1 3.75Å; V411-L450 HydrophobicContact CG2-CD2 3.67Å; V411-L450 HydrophobicContact CG2-CG 3.95Å; T446-L450 HydrophobicContact CG2-CD1 3.94Å; T446-L450 HydrophobicContact CG2-CG 4.39Å; T446-L450 WeakPolarHBondContact O-CG 3.33Å; T446-L450 PolarHBondContact O-N 3.04Å; T446-L450 VanDerWaalsContact O-N 3.08Å; L447-L450 PolarHBondContact O-N 3.11Å; E448-L450 PolarHBondContact O-N 3.34Å
451	G	91.9	Very high	89.1	Confident	7 Å²	7	32.2 Å²	32.2	7%	0.072	17%	0.171	C	C	.	.	S	Bend	trans	-67.1	145.9	177.7	0	0	0	0	0	112.5	D315 L447 E448 W453	D315-G451 WeakPolarHBondContact OD2-CA 3.41Å; L447-G451 PolarHBondContact O-N 3.37Å; L447-G451 VanDerWaalsContact O-N 3.13Å; E448-G451 PolarHBondContact O-N 3.43Å; E448-G451 VanDerWaalsContact O-N 3.13Å; G451-W453 PolarHBondContact O-N 3.44Å
452	A	91.6	Very high	89.2	Confident	47 Å²	47	34 Å²	34	39%	0.388	18%	0.179	S	C	.	.	S	Bend	trans	-65.8	-30.6	171.4	0	0	0	0	0	110.6	D315 V318 L322	D315-A452 PolarHBondContact O-N 3.49Å; D315-A452 VanDerWaalsContact O-N 3.16Å; D315-A452 PolarHBondContact OD2-N 3.05Å; D315-A452 VanDerWaalsContact OD2-N 3.17Å; V318-A452 HydrophobicContact CG1-CB 4.27Å; L322-A452 HydrophobicContact CD1-CB 3.95Å
453	W	91.5	Very high	89.5	Confident	158 Å²	158	31 Å²	31	60%	0.598	16%	0.164	S	C	*	.	S	Bend	trans	-139.8	96.3	174.1	-169.6	50.9	0	0	0	111.3	D315 G451 P455 L456	D315-W453 PolarHBondContact OD1-N 3.43Å; D315-W453 VanDerWaalsContact OD1-N 3.14Å; D315-W453 PolarHBondContact OD2-N 3.27Å; G451-W453 PolarHBondContact O-N 3.44Å; W453-P455 VanDerWaalsContact C-CD 3.47Å; W453-P455 HydrophobicContact CD2-CB 4.45Å; W453-P455 HydrophobicContact CD2-CG 4.49Å; W453-P455 HydrophobicContact CH2-CB 4.17Å; W453-P455 HydrophobicContact CZ2-CB 3.92Å; W453-P455 HydrophobicContact CZ2-CG 4.05Å; W453-P455 VanDerWaalsContact O-N 3.12Å; W453-L456 HydrophobicContact CD2-CB 4.42Å; W453-L456 HydrophobicContact CE3-CB 3.57Å; W453-L456 HydrophobicContact CE3-CD2 4.24Å; W453-L456 HydrophobicContact CE3-CG 4.45Å; W453-L456 HydrophobicContact CZ3-CB 4.05Å; W453-L456 WeakPolarHBondContact O-CB 3.27Å; W453-L456 PolarHBondContact O-N 3.33Å
454	G	86.3	Confident	89.6	Confident	18 Å²	18	29.3 Å²	29.3	19%	0.186	16%	0.157	C	C	.	.	H	α-helix	trans	-41	-49.9	-176	0	0	0	0	0	116	L456 V457 T458	G454-L456 PolarHBondContact O-N 3.49Å; G454-V457 WeakPolarHBondContact O-CA 3.33Å; G454-V457 WeakPolarHBondContact O-CB 3.41Å; G454-V457 PolarHBondContact O-N 3.16Å; G454-T458 PolarHBondContact O-N 3.21Å; G454-T458 PolarHBondContact O-OG1 2.89Å
455	P	90	Very high	89.9	Confident	73 Å²	73	24.7 Å²	24.7	47%	0.474	14%	0.139	S	C	.	.	H	α-helix	trans	-56.5	-28.1	179.9	-28.1	36.1	0	0	0	115	W453 A459	W453-P455 VanDerWaalsContact C-CD 3.47Å; W453-P455 HydrophobicContact CD2-CB 4.45Å; W453-P455 HydrophobicContact CD2-CG 4.49Å; W453-P455 HydrophobicContact CH2-CB 4.17Å; W453-P455 HydrophobicContact CZ2-CB 3.92Å; W453-P455 HydrophobicContact CZ2-CG 4.05Å; W453-P455 VanDerWaalsContact O-N 3.12Å; P455-A459 WeakPolarHBondContact O-CB 3.46Å; P455-A459 PolarHBondContact O-N 3.26Å
456	L	91.7	Very high	90.1	Very high	39 Å²	39	25.2 Å²	25.2	20%	0.204	14%	0.143	C	C	.	.	H	α-helix	trans	-74.8	-34.9	176.6	-174.5	55.6	0	0	0	112.1	V311 S312 D315 W453 G454 A459 G460	V311-L456 HydrophobicContact CG1-CD1 4.04Å; V311-L456 HydrophobicContact CG1-CD2 3.84Å; V311-L456 HydrophobicContact CG1-CG 4.28Å; S312-L456 WeakPolarHBondContact CB-O 3.33Å; D315-L456 HydrophobicContact CB-CD2 3.69Å; D315-L456 HydrophobicContact CB-CG 4.18Å; W453-L456 HydrophobicContact CD2-CB 4.42Å; W453-L456 HydrophobicContact CE3-CB 3.57Å; W453-L456 HydrophobicContact CE3-CD2 4.24Å; W453-L456 HydrophobicContact CE3-CG 4.45Å; W453-L456 HydrophobicContact CZ3-CB 4.05Å; W453-L456 WeakPolarHBondContact O-CB 3.27Å; W453-L456 PolarHBondContact O-N 3.33Å; G454-L456 PolarHBondContact O-N 3.49Å; L456-A459 PolarHBondContact O-N 2.94Å; L456-G460 PolarHBondContact O-N 3.2Å
457	V	89.6	Confident	90.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.5	-44.6	170.8	-176.6	0	0	0	0	110.3	F171 L447 E448 G454 A459 G460 I461	F171-V457 HydrophobicContact CD1-CG1 4.01Å; F171-V457 HydrophobicContact CE1-CG1 3.9Å; L447-V457 HydrophobicContact CB-CG1 4.24Å; E448-V457 HydrophobicContact CB-CB 4.32Å; E448-V457 HydrophobicContact CB-CG1 4.15Å; E448-V457 HydrophobicContact CG-CB 4.45Å; G454-V457 WeakPolarHBondContact O-CA 3.33Å; G454-V457 WeakPolarHBondContact O-CB 3.41Å; G454-V457 PolarHBondContact O-N 3.16Å; V457-A459 VanDerWaalsContact C-N 3.31Å; V457-A459 PolarHBondContact O-N 2.82Å; V457-G460 CarbonylContact O-C 3.54Å; V457-G460 VanDerWaalsContact O-CA 3.3Å; V457-G460 WeakPolarHBondContact O-CA 3.29Å; V457-G460 PolarHBondContact O-N 3.43Å; V457-I461 WeakPolarHBondContact O-CG1 3.48Å; V457-I461 PolarHBondContact O-N 3.35Å
458	T	88.7	Confident	90.1	Very high	9 Å²	9	25.6 Å²	25.6	6%	0.055	15%	0.145	C	C	.	.	H	α-helix	trans	-59.5	-41.1	174.5	-39.7	0	0	0	0	111.6	L260 E448 G454 G460 I461 F462	L260-T458 HydrophobicContact CD2-CG2 4.35Å; E448-T458 VanDerWaalsContact CD-OG1 3.22Å; E448-T458 PolarHBondContact OE2-OG1 3.38Å; G454-T458 PolarHBondContact O-N 3.21Å; G454-T458 PolarHBondContact O-OG1 2.89Å; T458-G460 VanDerWaalsContact C-N 3.27Å; T458-G460 PolarHBondContact O-N 2.98Å; T458-I461 WeakPolarHBondContact O-CB 3.44Å; T458-I461 PolarHBondContact O-N 3.2Å; T458-I461 VanDerWaalsContact O-N 3.14Å; T458-F462 HydrophobicContact CG2-CE1 4.26Å; T458-F462 HydrophobicContact CG2-CZ 4.24Å; T458-F462 PolarHBondContact O-N 3.02Å
459	A	90.6	Very high	90.2	Very high	36 Å²	36	24 Å²	24	30%	0.298	14%	0.138	S	C	.	.	H	α-helix	trans	-61.2	-35.2	172.4	0	0	0	0	0	112.4	V308 P455 L456 V457 F462 A463	V308-A459 HydrophobicContact CG1-CB 4.08Å; P455-A459 WeakPolarHBondContact O-CB 3.46Å; P455-A459 PolarHBondContact O-N 3.26Å; L456-A459 PolarHBondContact O-N 2.94Å; V457-A459 VanDerWaalsContact C-N 3.31Å; V457-A459 PolarHBondContact O-N 2.82Å; A459-F462 PolarHBondContact O-N 3.47Å; A459-A463 WeakPolarHBondContact O-CB 3.44Å; A459-A463 PolarHBondContact O-N 3.36Å
460	G	91.4	Very high	90.3	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.1	-43.9	170.5	0	0	0	0	0	113.5	S312 L456 V457 T458 F462 A463 A464	S312-G460 WeakPolarHBondContact OG-CA 3.38Å; L456-G460 PolarHBondContact O-N 3.2Å; V457-G460 CarbonylContact O-C 3.54Å; V457-G460 VanDerWaalsContact O-CA 3.3Å; V457-G460 WeakPolarHBondContact O-CA 3.29Å; V457-G460 PolarHBondContact O-N 3.43Å; T458-G460 VanDerWaalsContact C-N 3.27Å; T458-G460 PolarHBondContact O-N 2.98Å; G460-F462 VanDerWaalsContact C-N 3.33Å; G460-F462 PolarHBondContact O-N 3.27Å; G460-A463 PolarHBondContact O-N 3Å; G460-A464 WeakPolarHBondContact O-CB 3.41Å; G460-A464 PolarHBondContact O-N 2.81Å
461	I	88.7	Confident	90.2	Very high	2 Å²	2	23.2 Å²	23.2	1%	0.01	13%	0.134	C	C	.	.	H	α-helix	trans	-60.4	-44.9	175	-59.7	171	0	0	0	110.2	F171 T256 V457 T458 A464 T465	F171-I461 HydrophobicContact CB-CD1 4.06Å; F171-I461 HydrophobicContact CB-CG1 3.67Å; F171-I461 HydrophobicContact CD1-CD1 4.36Å; F171-I461 HydrophobicContact CD1-CG1 3.7Å; F171-I461 HydrophobicContact CD2-CG1 3.93Å; F171-I461 HydrophobicContact CE1-CG1 4.32Å; F171-I461 HydrophobicContact CE2-CG1 4.49Å; F171-I461 HydrophobicContact CG-CD1 4.3Å; F171-I461 HydrophobicContact CG-CG1 3.5Å; F171-I461 VanDerWaalsContact CG-CG1 3.5Å; T256-I461 HydrophobicContact CG2-CB 4.48Å; T256-I461 HydrophobicContact CG2-CG2 3.84Å; V457-I461 WeakPolarHBondContact O-CG1 3.48Å; V457-I461 PolarHBondContact O-N 3.35Å; T458-I461 WeakPolarHBondContact O-CB 3.44Å; T458-I461 PolarHBondContact O-N 3.2Å; T458-I461 VanDerWaalsContact O-N 3.14Å; I461-A464 PolarHBondContact O-N 2.79Å; I461-T465 HydrophobicContact CG2-CG2 4.37Å; I461-T465 WeakPolarHBondContact O-CB 3.38Å; I461-T465 VanDerWaalsContact O-CG2 3.29Å; I461-T465 WeakPolarHBondContact O-CG2 3.15Å; I461-T465 PolarHBondContact O-N 3.39Å; I461-T465 PolarHBondContact O-OG1 3.38Å
462	F	90.1	Very high	90.1	Very high	45 Å²	45	23.3 Å²	23.3	20%	0.197	13%	0.134	C	C	.	.	H	α-helix	trans	-62.6	-41.6	175.7	-73	1.8	0	0	0	112.5	F253 T256 L257 L260 T458 A459 G460 T465 L466	F253-F462 HydrophobicContact CD2-CB 4.21Å; F253-F462 AromaticContact CD2-CD1 3.8Å; F253-F462 HydrophobicContact CD2-CD1 3.8Å; F253-F462 HydrophobicContact CD2-CE1 4.38Å; F253-F462 HydrophobicContact CD2-CG 4.03Å; F253-F462 HydrophobicContact CE2-CB 3.82Å; F253-F462 AromaticContact CE2-CD1 3.66Å; F253-F462 HydrophobicContact CE2-CD1 3.66Å; F253-F462 AromaticContact CE2-CD2 3.88Å; F253-F462 HydrophobicContact CE2-CD2 3.88Å; F253-F462 HydrophobicContact CE2-CE1 4.15Å; F253-F462 HydrophobicContact CE2-CE2 4.36Å; F253-F462 AromaticContact CE2-CG 3.51Å; F253-F462 HydrophobicContact CE2-CG 3.51Å; F253-F462 HydrophobicContact CE2-CZ 4.49Å; T256-F462 HydrophobicContact CG2-CD1 4.23Å; T256-F462 HydrophobicContact CG2-CE1 3.67Å; L257-F462 HydrophobicContact CB-CE1 4.27Å; L257-F462 HydrophobicContact CB-CZ 3.98Å; L257-F462 HydrophobicContact CD1-CE2 4.04Å; L257-F462 HydrophobicContact CD1-CZ 3.71Å; L257-F462 HydrophobicContact CG-CZ 4.44Å; L260-F462 HydrophobicContact CD2-CZ 4.25Å; T458-F462 HydrophobicContact CG2-CE1 4.26Å; T458-F462 HydrophobicContact CG2-CZ 4.24Å; T458-F462 PolarHBondContact O-N 3.02Å; A459-F462 PolarHBondContact O-N 3.47Å; G460-F462 VanDerWaalsContact C-N 3.33Å; G460-F462 PolarHBondContact O-N 3.27Å; F462-T465 WeakPolarHBondContact CA-OG1 2.98Å; F462-T465 PolarHBondContact O-OG1 2.98Å; F462-L466 WeakPolarHBondContact O-CB 3.34Å; F462-L466 PolarHBondContact O-N 3.44Å
463	A	91.4	Very high	90.2	Very high	8 Å²	8	21 Å²	21	7%	0.066	12%	0.116	C	C	.	.	H	α-helix	trans	-65.5	-41.9	176.8	0	0	0	0	0	112.2	M305 V308 A459 G460 S467	M305-A463 HydrophobicContact CB-CB 4.07Å; M305-A463 HydrophobicContact CG-CB 4.34Å; V308-A463 HydrophobicContact CB-CB 4.07Å; V308-A463 HydrophobicContact CG1-CB 3.91Å; A459-A463 WeakPolarHBondContact O-CB 3.44Å; A459-A463 PolarHBondContact O-N 3.36Å; G460-A463 PolarHBondContact O-N 3Å; A463-S467 WeakPolarHBondContact O-CB 3.36Å; A463-S467 PolarHBondContact O-N 3.42Å
464	A	89.8	Confident	90.1	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	9%	0.087	C	C	.	.	H	α-helix	trans	-68.6	-45.3	-179.3	0	0	0	0	0	112.6	G167 F171 L309 G460 I461 S468	G167-A464 VanDerWaalsContact O-CB 3.31Å; G167-A464 WeakPolarHBondContact O-CB 3.47Å; F171-A464 HydrophobicContact CE2-CB 4.17Å; L309-A464 HydrophobicContact CD1-CB 4.12Å; L309-A464 HydrophobicContact CD2-CB 4.45Å; G460-A464 WeakPolarHBondContact O-CB 3.41Å; G460-A464 PolarHBondContact O-N 2.81Å; I461-A464 PolarHBondContact O-N 2.79Å; A464-S468 WeakPolarHBondContact O-CB 3.44Å; A464-S468 PolarHBondContact O-N 3.1Å; A464-S468 VanDerWaalsContact O-N 3.07Å; A464-S468 PolarHBondContact O-OG 3.31Å
465	T	89.1	Confident	90.3	Very high	0 Å²	0	12.7 Å²	12.7	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-60.2	-54	175.3	45.9	0	0	0	0	111.5	T168 F253 I461 F462 S467 S468 A469	T168-T465 HydrophobicContact CG2-CG2 3.03Å; F253-T465 HydrophobicContact CB-CG2 4.27Å; F253-T465 WeakPolarHBondContact CD2-OG1 3.22Å; I461-T465 HydrophobicContact CG2-CG2 4.37Å; I461-T465 WeakPolarHBondContact O-CB 3.38Å; I461-T465 VanDerWaalsContact O-CG2 3.29Å; I461-T465 WeakPolarHBondContact O-CG2 3.15Å; I461-T465 PolarHBondContact O-N 3.39Å; I461-T465 PolarHBondContact O-OG1 3.38Å; F462-T465 WeakPolarHBondContact CA-OG1 2.98Å; F462-T465 PolarHBondContact O-OG1 2.98Å; T465-S467 VanDerWaalsContact C-N 3.33Å; T465-S467 PolarHBondContact O-N 3.38Å; T465-S468 PolarHBondContact O-N 3.24Å; T465-A469 WeakPolarHBondContact O-CB 3.19Å; T465-A469 PolarHBondContact O-N 2.9Å
466	L	90.4	Very high	90.3	Very high	34 Å²	34	9.2 Å²	9.2	18%	0.178	6%	0.056	C	C	.	.	H	α-helix	trans	-64.7	-38.4	-176.6	-174	63.4	0	0	0	111.5	T283 I287 M305 F462 A469 L470	T283-L466 HydrophobicContact CG2-CD1 4.12Å; I287-L466 HydrophobicContact CD1-CD1 4.17Å; I287-L466 HydrophobicContact CG1-CD1 3.85Å; M305-L466 HydrophobicContact SD-CB 4.07Å; M305-L466 HydrophobicContact SD-CD2 4.14Å; M305-L466 HydrophobicContact SD-CG 4.05Å; F462-L466 WeakPolarHBondContact O-CB 3.34Å; F462-L466 PolarHBondContact O-N 3.44Å; L466-A469 PolarHBondContact O-N 3.33Å; L466-L470 VanDerWaalsContact O-CB 3.25Å; L466-L470 WeakPolarHBondContact O-CB 3.47Å; L466-L470 PolarHBondContact O-N 3.24Å
467	S	89.4	Confident	90.4	Very high	0 Å²	0	7.4 Å²	7.4	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-66.6	-41.7	177	-173.7	0	0	0	0	112.6	L163 A463 T465 A469 A471	L163-S467 VanDerWaalsContact CB-OG 3.26Å; L163-S467 WeakPolarHBondContact CB-OG 3.35Å; L163-S467 WeakPolarHBondContact CD1-OG 3.04Å; A463-S467 WeakPolarHBondContact O-CB 3.36Å; A463-S467 PolarHBondContact O-N 3.42Å; T465-S467 VanDerWaalsContact C-N 3.33Å; T465-S467 PolarHBondContact O-N 3.38Å; S467-A469 VanDerWaalsContact C-N 3.35Å; S467-A471 VanDerWaalsContact O-CB 3.28Å; S467-A471 WeakPolarHBondContact O-CB 3.25Å; S467-A471 PolarHBondContact O-N 3.03Å
468	S	90	Very high	90.4	Very high	9 Å²	9	7.9 Å²	7.9	6%	0.063	5%	0.049	C	C	.	.	H	α-helix	trans	-65.4	-41.8	177	-59.8	0	0	0	0	111	L163 C249 A464 T465 A471 G472	L163-S468 PolarHBondContact O-OG 3Å; C249-S468 VanDerWaalsContact SG-CB 3.57Å; A464-S468 WeakPolarHBondContact O-CB 3.44Å; A464-S468 PolarHBondContact O-N 3.1Å; A464-S468 VanDerWaalsContact O-N 3.07Å; A464-S468 PolarHBondContact O-OG 3.31Å; T465-S468 PolarHBondContact O-N 3.24Å; S468-A471 PolarHBondContact O-N 3.43Å; S468-G472 PolarHBondContact O-N 3.34Å
469	A	91.6	Very high	90.5	Very high	0 Å²	0	7.5 Å²	7.5	0%	0	5%	0.046	C	C	.	.	H	α-helix	trans	-61.3	-48.6	176.5	0	0	0	0	0	111.6	A246 C249 I287 T465 L466 S467 A471 G472 F473	A246-A469 VanDerWaalsContact CB-O 3.25Å; A246-A469 WeakPolarHBondContact CB-O 3.32Å; C249-A469 HydrophobicContact CB-CB 3.64Å; I287-A469 HydrophobicContact CD1-CB 3.45Å; I287-A469 VanDerWaalsContact CD1-CB 3.45Å; T465-A469 WeakPolarHBondContact O-CB 3.19Å; T465-A469 PolarHBondContact O-N 2.9Å; L466-A469 PolarHBondContact O-N 3.33Å; S467-A469 VanDerWaalsContact C-N 3.35Å; A469-A471 VanDerWaalsContact C-N 3.35Å; A469-A471 PolarHBondContact O-N 2.84Å; A469-G472 PolarHBondContact O-N 3.29Å; A469-F473 VanDerWaalsContact O-CB 3.28Å; A469-F473 WeakPolarHBondContact O-CB 3.28Å; A469-F473 PolarHBondContact O-N 2.82Å
470	L	91.2	Very high	90.5	Very high	1 Å²	1	6.4 Å²	6.4	1%	0.005	4%	0.036	C	C	.	.	H	α-helix	trans	-62.1	-41.2	177.2	-175.7	60.6	0	0	0	112	I287 I290 E298 M305 L466 F473 V474	I287-L470 HydrophobicContact CG2-CD1 3.95Å; I290-L470 HydrophobicContact CB-CD1 4.13Å; I290-L470 HydrophobicContact CG2-CD1 3.83Å; I290-L470 HydrophobicContact CG2-CD2 3.83Å; I290-L470 HydrophobicContact CG2-CG 4.5Å; E298-L470 HydrophobicContact CB-CD2 4.48Å; E298-L470 HydrophobicContact CG-CD1 3.9Å; E298-L470 HydrophobicContact CG-CD2 3.54Å; E298-L470 HydrophobicContact CG-CG 3.53Å; M305-L470 HydrophobicContact CE-CD2 3.99Å; L466-L470 VanDerWaalsContact O-CB 3.25Å; L466-L470 WeakPolarHBondContact O-CB 3.47Å; L466-L470 PolarHBondContact O-N 3.24Å; L470-F473 PolarHBondContact O-N 2.97Å; L470-V474 HydrophobicContact CD1-CG2 4.49Å; L470-V474 PolarHBondContact O-N 3Å
471	A	90.2	Very high	90.5	Very high	2 Å²	2	7 Å²	7	2%	0.017	4%	0.038	C	C	.	.	H	α-helix	trans	-63.4	-44.6	179.5	0	0	0	0	0	112.6	R160 S467 S468 A469 S475	R160-A471 HydrophobicContact CG-CB 4.34Å; R160-A471 PolarHBondContact NH2-O 2.65Å; S467-A471 VanDerWaalsContact O-CB 3.28Å; S467-A471 WeakPolarHBondContact O-CB 3.25Å; S467-A471 PolarHBondContact O-N 3.03Å; S468-A471 PolarHBondContact O-N 3.43Å; A469-A471 VanDerWaalsContact C-N 3.35Å; A469-A471 PolarHBondContact O-N 2.84Å; A471-S475 WeakPolarHBondContact O-CB 3.38Å; A471-S475 PolarHBondContact O-N 3.19Å; A471-S475 PolarHBondContact O-OG 3.36Å
472	G	89.7	Confident	90.5	Very high	8 Å²	8	7.4 Å²	7.4	8%	0.082	4%	0.042	C	C	.	.	H	α-helix	trans	-65.6	-42.9	174.6	0	0	0	0	0	112.3	N242 S468 A469 V474 S475 G476	N242-G472 CarbonylContact O-C 3.53Å; S468-G472 PolarHBondContact O-N 3.34Å; A469-G472 PolarHBondContact O-N 3.29Å; G472-V474 VanDerWaalsContact C-N 3.29Å; G472-V474 PolarHBondContact O-N 3.29Å; G472-S475 PolarHBondContact O-N 3.5Å; G472-S475 VanDerWaalsContact O-N 3.1Å; G472-G476 PolarHBondContact O-N 2.92Å
473	F	92.4	Very high	90.4	Very high	0 Å²	0	5.2 Å²	5.2	0%	0	3%	0.032	C	C	.	.	H	α-helix	trans	-65	-31.8	-177.8	-167.9	-98.7	0	0	0	112.9	A246 M284 I287 L288 A291 A469 L470 P477 Y509 A512 F513	A246-F473 HydrophobicContact CB-CB 3.82Å; A246-F473 HydrophobicContact CB-CD2 4.32Å; M284-F473 HydrophobicContact CE-CD2 3.7Å; M284-F473 HydrophobicContact CE-CE2 3.54Å; I287-F473 HydrophobicContact CG2-CB 3.52Å; I287-F473 HydrophobicContact CG2-CD1 3.58Å; I287-F473 HydrophobicContact CG2-CD2 4.2Å; I287-F473 HydrophobicContact CG2-CE1 4.36Å; I287-F473 HydrophobicContact CG2-CG 3.49Å; I287-F473 VanDerWaalsContact CG2-CG 3.49Å; L288-F473 HydrophobicContact CB-CE1 4.3Å; L288-F473 HydrophobicContact CB-CZ 4.3Å; L288-F473 HydrophobicContact CD1-CE1 3.94Å; L288-F473 HydrophobicContact CD1-CZ 3.96Å; A291-F473 HydrophobicContact CB-CD1 3.78Å; A291-F473 HydrophobicContact CB-CE1 3.96Å; A469-F473 VanDerWaalsContact O-CB 3.28Å; A469-F473 WeakPolarHBondContact O-CB 3.28Å; A469-F473 PolarHBondContact O-N 2.82Å; L470-F473 PolarHBondContact O-N 2.97Å; F473-P477 WeakPolarHBondContact O-CD 3.12Å; F473-P477 WeakPolarHBondContact O-CG 3.46Å; F473-Y509 HydrophobicContact CD1-CD1 4.22Å; F473-Y509 AromaticContact CE1-CD1 3.82Å; F473-Y509 HydrophobicContact CE1-CD1 3.82Å; F473-A512 HydrophobicContact CD2-CB 4.49Å; F473-A512 HydrophobicContact CE2-CB 3.92Å; F473-A512 HydrophobicContact CZ-CB 4.2Å; F473-F513 HydrophobicContact CE2-CB 4.36Å; F473-F513 HydrophobicContact CZ-CB 4.01Å
474	V	90.4	Very high	90.2	Very high	0 Å²	0	4.9 Å²	4.9	0%	0	3%	0.029	C	C	.	.	H	α-helix	trans	-78.3	-35.5	173	169.1	0	0	0	0	112.4	A291 V295 E298 I374 L470 G472 K478 Y509	A291-V474 HydrophobicContact CB-CG2 4.04Å; V295-V474 HydrophobicContact CG2-CG1 3.96Å; E298-V474 HydrophobicContact CG-CG2 4.14Å; I374-V474 HydrophobicContact CG2-CG1 4.24Å; L470-V474 HydrophobicContact CD1-CG2 4.49Å; L470-V474 PolarHBondContact O-N 3Å; G472-V474 VanDerWaalsContact C-N 3.29Å; G472-V474 PolarHBondContact O-N 3.29Å; V474-K478 HydrophobicContact CG1-CG 4.23Å; V474-K478 VanDerWaalsContact O-CG 3.25Å; V474-K478 WeakPolarHBondContact O-CG 3.44Å; V474-K478 PolarHBondContact O-N 3.07Å; V474-Y509 HydrophobicContact CG2-CE1 4.32Å
475	S	89.8	Confident	90	Very high	1 Å²	1	9.6 Å²	9.6	1%	0.007	5%	0.05	C	C	.	.	H	α-helix	trans	-64.6	-47.7	-175.9	-65.3	0	0	0	0	112.7	N242 A471 G472 K478 L479	N242-S475 VanDerWaalsContact OD1-CB 3.24Å; N242-S475 WeakPolarHBondContact OD1-CB 3.41Å; A471-S475 WeakPolarHBondContact O-CB 3.38Å; A471-S475 PolarHBondContact O-N 3.19Å; A471-S475 PolarHBondContact O-OG 3.36Å; G472-S475 PolarHBondContact O-N 3.5Å; G472-S475 VanDerWaalsContact O-N 3.1Å; S475-K478 PolarHBondContact O-N 3.4Å; S475-L479 WeakPolarHBondContact O-CB 3.44Å; S475-L479 PolarHBondContact O-N 3.12Å
476	G	91.1	Very high	89.7	Confident	0 Å²	0	11.4 Å²	11.4	0%	0	6%	0.06	C	C	.	.	H	α-helix	trans	-57.4	-55.9	-178.1	0	0	0	0	0	113.7	A239 G472 K478 L479 L480	A239-G476 WeakPolarHBondContact O-CA 3.48Å; G472-G476 PolarHBondContact O-N 2.92Å; G476-K478 PolarHBondContact O-N 3.3Å; G476-L479 WeakPolarHBondContact O-CB 3.24Å; G476-L479 PolarHBondContact O-N 3.34Å; G476-L479 VanDerWaalsContact O-N 3.15Å; G476-L480 PolarHBondContact O-N 3.44Å
477	P	92.4	Very high	89.4	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	9%	0.086	C	C	.	.	H	α-helix	trans	-57.3	-41.3	176.4	-31.1	39.7	0	0	0	114.7	F473 L479 L480 Q481 P505 A508 Y509 A512	F473-P477 WeakPolarHBondContact O-CD 3.12Å; F473-P477 WeakPolarHBondContact O-CG 3.46Å; P477-L479 VanDerWaalsContact C-N 3.3Å; P477-L479 PolarHBondContact O-N 3.44Å; P477-L480 PolarHBondContact O-N 2.93Å; P477-Q481 WeakPolarHBondContact O-CB 3.2Å; P477-Q481 PolarHBondContact O-N 3.01Å; P477-P505 HydrophobicContact CB-CG 4.15Å; P477-A508 HydrophobicContact CB-CB 3.78Å; P477-Y509 HydrophobicContact CB-CD1 3.76Å; P477-Y509 HydrophobicContact CB-CE1 3.8Å; P477-Y509 HydrophobicContact CB-CG 4.24Å; P477-Y509 HydrophobicContact CG-CD1 3.57Å; P477-Y509 HydrophobicContact CG-CE1 3.83Å; P477-Y509 HydrophobicContact CG-CG 4.35Å; P477-A512 HydrophobicContact CG-CB 3.64Å
478	K	90.2	Very high	89	Confident	11 Å²	11	18.3 Å²	18.3	5%	0.048	9%	0.088	C	C	.	.	H	α-helix	trans	-65.6	-35.7	176.7	-70.9	-82.5	-179.2	163	0	111.5	D377 V474 S475 G476 Q481 A482 E504 P505	D377-K478 IonicContact OD2-NZ 2.72Å; D377-K478 PolarHBondContact OD2-NZ 3.19Å; V474-K478 HydrophobicContact CG1-CG 4.23Å; V474-K478 VanDerWaalsContact O-CG 3.25Å; V474-K478 WeakPolarHBondContact O-CG 3.44Å; V474-K478 PolarHBondContact O-N 3.07Å; S475-K478 PolarHBondContact O-N 3.4Å; G476-K478 PolarHBondContact O-N 3.3Å; K478-Q481 WeakPolarHBondContact O-CB 3.4Å; K478-Q481 PolarHBondContact O-N 3.13Å; K478-A482 PolarHBondContact O-N 3.42Å; K478-A482 VanDerWaalsContact O-N 3.17Å; K478-E504 WeakPolarHBondContact CE-OE2 3.48Å; K478-E504 IonicContact NZ-OE1 2.86Å; K478-E504 PolarHBondContact NZ-OE1 2.98Å; K478-E504 IonicContact NZ-OE2 2.82Å; K478-E504 PolarHBondContact NZ-OE2 2.9Å; K478-P505 HydrophobicContact CD-CG 4.5Å
479	L	90.7	Very high	88.8	Confident	0 Å²	0	18.5 Å²	18.5	0%	0	9%	0.088	C	C	.	.	H	α-helix	trans	-68	-45.3	175	-155.8	68.7	0	0	0	111.9	G216 G235 F238 A239 S475 G476 P477 Q481 A482 L483	G216-L479 WeakPolarHBondContact O-CD1 3.44Å; G235-L479 VanDerWaalsContact O-CD2 3.25Å; G235-L479 WeakPolarHBondContact O-CD2 2.9Å; F238-L479 HydrophobicContact CB-CD2 3.87Å; F238-L479 HydrophobicContact CD1-CD2 3.41Å; F238-L479 VanDerWaalsContact CD1-CD2 3.41Å; F238-L479 HydrophobicContact CE1-CD2 4.35Å; F238-L479 HydrophobicContact CG-CD2 4.01Å; A239-L479 HydrophobicContact CB-CB 4.02Å; A239-L479 HydrophobicContact CB-CD2 3.91Å; A239-L479 HydrophobicContact CB-CG 4.31Å; S475-L479 WeakPolarHBondContact O-CB 3.44Å; S475-L479 PolarHBondContact O-N 3.12Å; G476-L479 WeakPolarHBondContact O-CB 3.24Å; G476-L479 PolarHBondContact O-N 3.34Å; G476-L479 VanDerWaalsContact O-N 3.15Å; P477-L479 VanDerWaalsContact C-N 3.3Å; P477-L479 PolarHBondContact O-N 3.44Å; L479-Q481 VanDerWaalsContact C-N 3.26Å; L479-Q481 PolarHBondContact O-N 3.16Å; L479-A482 WeakPolarHBondContact O-CB 3.14Å; L479-A482 PolarHBondContact O-N 2.72Å; L479-A482 VanDerWaalsContact O-N 3.13Å; L479-L483 PolarHBondContact O-N 2.98Å
480	L	90.5	Very high	88	Confident	14 Å²	14	21.9 Å²	21.9	7%	0.073	11%	0.11	C	C	.	.	H	α-helix	trans	-59.1	-38.1	172.7	-71.1	178.7	0	0	0	112.1	L236 A239 G476 P477 A482 L483 G484 V492 A508 L511	L236-L480 HydrophobicContact CD1-CD2 3.71Å; A239-L480 HydrophobicContact CB-CD2 3.69Å; A239-L480 HydrophobicContact CB-CG 3.77Å; G476-L480 PolarHBondContact O-N 3.44Å; P477-L480 PolarHBondContact O-N 2.93Å; L480-A482 VanDerWaalsContact C-N 3.32Å; L480-A482 PolarHBondContact O-N 3.4Å; L480-L483 HydrophobicContact CD2-CD1 4.27Å; L480-L483 PolarHBondContact O-N 3.12Å; L480-G484 PolarHBondContact O-N 2.9Å; L480-V492 HydrophobicContact CD2-CG1 4.34Å; L480-A508 HydrophobicContact CB-CB 4.41Å; L480-L511 HydrophobicContact CD1-CD2 4.05Å
481	Q	91.3	Very high	87.4	Confident	13 Å²	13	30 Å²	30	6%	0.061	15%	0.146	C	C	.	.	H	α-helix	trans	-61.8	-41.7	176.1	-165	-168.1	41	0	0	111.9	P477 K478 L479 K485 S496 R503 P505	P477-Q481 WeakPolarHBondContact O-CB 3.2Å; P477-Q481 PolarHBondContact O-N 3.01Å; K478-Q481 WeakPolarHBondContact O-CB 3.4Å; K478-Q481 PolarHBondContact O-N 3.13Å; L479-Q481 VanDerWaalsContact C-N 3.26Å; L479-Q481 PolarHBondContact O-N 3.16Å; Q481-K485 WeakPolarHBondContact O-CG 3.42Å; Q481-K485 PolarHBondContact O-N 3.47Å; Q481-K485 VanDerWaalsContact O-N 3.07Å; Q481-S496 WeakPolarHBondContact CG-O 3.26Å; Q481-S496 PolarHBondContact NE2-O 2.68Å; Q481-R503 PolarHBondContact NE2-O 3.28Å; Q481-P505 HydrophobicContact CB-CB 3.81Å; Q481-P505 HydrophobicContact CB-CG 4.07Å; Q481-P505 HydrophobicContact CG-CB 3.83Å; Q481-P505 HydrophobicContact CG-CG 4.4Å
482	A	88.3	Confident	87.1	Confident	9 Å²	9	30.6 Å²	30.6	7%	0.074	15%	0.149	C	C	.	.	H	α-helix	trans	-65.7	-46.1	177.6	0	0	0	0	0	111.5	G215 G216 Y219 K478 L479 L480 G484 K485 D486	G215-A482 WeakPolarHBondContact O-CB 3.44Å; G216-A482 VanDerWaalsContact CA-CB 3.48Å; Y219-A482 HydrophobicContact CD1-CB 3.84Å; Y219-A482 HydrophobicContact CE1-CB 4.01Å; K478-A482 PolarHBondContact O-N 3.42Å; K478-A482 VanDerWaalsContact O-N 3.17Å; L479-A482 WeakPolarHBondContact O-CB 3.14Å; L479-A482 PolarHBondContact O-N 2.72Å; L479-A482 VanDerWaalsContact O-N 3.13Å; L480-A482 VanDerWaalsContact C-N 3.32Å; L480-A482 PolarHBondContact O-N 3.4Å; A482-G484 VanDerWaalsContact C-N 3.34Å; A482-G484 PolarHBondContact O-N 2.76Å; A482-K485 PolarHBondContact O-N 3.06Å; A482-D486 PolarHBondContact O-N 3.47Å; A482-D486 VanDerWaalsContact O-N 3.15Å
483	L	88.9	Confident	86.7	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	16%	0.157	C	C	.	.	H	α-helix	trans	-57	-45.5	175.2	-76.7	158.2	0	0	0	112.5	Y219 L236 L479 L480 D486 K487 L488 F489 V492	Y219-L483 HydrophobicContact CD1-CD2 4.49Å; Y219-L483 HydrophobicContact CD1-CG 4.3Å; Y219-L483 HydrophobicContact CD2-CD2 3.5Å; Y219-L483 VanDerWaalsContact CD2-CD2 3.5Å; Y219-L483 HydrophobicContact CD2-CG 4.06Å; Y219-L483 HydrophobicContact CE1-CD2 4.29Å; Y219-L483 HydrophobicContact CE1-CG 4.29Å; Y219-L483 HydrophobicContact CE2-CD2 3.24Å; Y219-L483 HydrophobicContact CE2-CG 4.06Å; Y219-L483 HydrophobicContact CG-CD2 4.13Å; Y219-L483 HydrophobicContact CG-CG 4.18Å; L236-L483 HydrophobicContact CB-CD1 4.34Å; L479-L483 PolarHBondContact O-N 2.98Å; L480-L483 HydrophobicContact CD2-CD1 4.27Å; L480-L483 PolarHBondContact O-N 3.12Å; L483-D486 PolarHBondContact O-N 2.72Å; L483-K487 PolarHBondContact O-N 2.81Å; L483-L488 HydrophobicContact CD2-CD1 4.45Å; L483-F489 HydrophobicContact CD2-CE2 4.27Å; L483-V492 HydrophobicContact CB-CG1 4.11Å
484	G	86.7	Confident	86.4	Confident	1 Å²	1	39.1 Å²	39.1	1%	0.01	19%	0.185	C	C	.	.	H	α-helix	trans	-71.6	-29.1	-179	0	0	0	0	0	113.3	L480 A482 D486 K487 S496	L480-G484 PolarHBondContact O-N 2.9Å; A482-G484 VanDerWaalsContact C-N 3.34Å; A482-G484 PolarHBondContact O-N 2.76Å; G484-D486 VanDerWaalsContact C-N 3.34Å; G484-K487 PolarHBondContact O-N 3.06Å; G484-S496 VanDerWaalsContact C-CB 3.47Å
485	K	84.9	Confident	86.2	Confident	99 Å²	99	41 Å²	41	43%	0.43	19%	0.194	S	C	.	.	H	α-helix	trans	-66.4	-37.3	171.5	-79.4	173.2	-175.9	160.2	0	112.2	Q481 A482 K487	Q481-K485 WeakPolarHBondContact O-CG 3.42Å; Q481-K485 PolarHBondContact O-N 3.47Å; Q481-K485 VanDerWaalsContact O-N 3.07Å; A482-K485 PolarHBondContact O-N 3.06Å; K485-K487 PolarHBondContact O-N 3.1Å
486	D	84.7	Confident	85.8	Confident	38 Å²	38	41.9 Å²	41.9	20%	0.203	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-2.7	175.7	-75.4	-24.9	0	0	0	113	Y219 R224 A482 L483 G484 L488 W612	Y219-D486 VanDerWaalsContact CE1-OD2 3.26Å; Y219-D486 WeakPolarHBondContact CE1-OD2 3.45Å; Y219-D486 VanDerWaalsContact CZ-OD2 3.3Å; Y219-D486 WeakPolarHBondContact OH-CB 3.3Å; Y219-D486 VanDerWaalsContact OH-CG 3.31Å; Y219-D486 PolarHBondContact OH-OD2 3.43Å; R224-D486 IonicContact NH2-OD1 2.81Å; R224-D486 PolarHBondContact NH2-OD1 3.13Å; R224-D486 IonicContact NH2-OD2 3.11Å; R224-D486 PolarHBondContact NH2-OD2 3.47Å; A482-D486 PolarHBondContact O-N 3.47Å; A482-D486 VanDerWaalsContact O-N 3.15Å; L483-D486 PolarHBondContact O-N 2.72Å; G484-D486 VanDerWaalsContact C-N 3.34Å; D486-L488 HydrophobicContact CB-CG 4.23Å; D486-L488 PolarHBondContact O-N 3.17Å; D486-W612 HydrophobicContact CB-CH2 3.81Å; D486-W612 HydrophobicContact CB-CZ2 3.95Å
487	K	83.6	Confident	85.5	Confident	167 Å²	167	46.8 Å²	46.8	73%	0.726	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	51.8	28.3	174.9	-61	-176.6	-179.3	-179.3	0	115	L483 G484 K485 F489	L483-K487 PolarHBondContact O-N 2.81Å; G484-K487 PolarHBondContact O-N 3.06Å; K485-K487 PolarHBondContact O-N 3.1Å; K487-F489 PolarHBondContact O-N 2.85Å
488	L	81.4	Confident	85.1	Confident	11 Å²	11	49.4 Å²	49.4	6%	0.058	24%	0.238	C	C	.	.	S	Bend	trans	-66.9	-27.9	177.7	-63.3	-178.5	0	0	0	112.8	Y219 P228 L483 D486 P608 W612	Y219-L488 HydrophobicContact CE2-CD1 3.87Å; Y219-L488 WeakPolarHBondContact OH-CD1 3.31Å; P228-L488 HydrophobicContact CB-CD2 3.77Å; L483-L488 HydrophobicContact CD2-CD1 4.45Å; D486-L488 HydrophobicContact CB-CG 4.23Å; D486-L488 PolarHBondContact O-N 3.17Å; L488-P608 HydrophobicContact CD2-CB 4.24Å; L488-P608 HydrophobicContact CD2-CG 4.27Å; L488-W612 HydrophobicContact CD1-CH2 4.16Å; L488-W612 HydrophobicContact CD1-CZ3 4.39Å; L488-W612 HydrophobicContact CD2-CH2 4.03Å; L488-W612 HydrophobicContact CG-CH2 4.3Å
489	F	84.1	Confident	84.7	Confident	14 Å²	14	52 Å²	52	6%	0.061	25%	0.248	C	C	.	.	S	Bend	trans	-127	123.4	175.8	-59.4	-87.4	0	0	0	109.7	G232 L236 L483 K487 F491 V492 A493 L599 Y602 I603	G232-F489 WeakPolarHBondContact O-CE2 3.07Å; L236-F489 HydrophobicContact CB-CE2 4.15Å; L236-F489 HydrophobicContact CB-CZ 4.28Å; L236-F489 HydrophobicContact CD2-CE1 4.07Å; L236-F489 HydrophobicContact CD2-CE2 4.16Å; L236-F489 HydrophobicContact CD2-CZ 3.85Å; L483-F489 HydrophobicContact CD2-CE2 4.27Å; K487-F489 PolarHBondContact O-N 2.85Å; F489-F491 PolarHBondContact O-N 3.35Å; F489-V492 HydrophobicContact CB-CB 3.81Å; F489-V492 HydrophobicContact CB-CG2 3.47Å; F489-V492 VanDerWaalsContact CB-CG2 3.47Å; F489-V492 HydrophobicContact CD2-CG2 4.3Å; F489-V492 HydrophobicContact CG-CG2 4.07Å; F489-V492 PolarHBondContact O-N 3.46Å; F489-V492 VanDerWaalsContact O-N 3.11Å; F489-A493 PolarHBondContact O-N 2.75Å; F489-L599 HydrophobicContact CE1-CD2 4.14Å; F489-L599 HydrophobicContact CZ-CD2 4.35Å; F489-Y602 HydrophobicContact CD1-CD1 4.24Å; F489-Y602 AromaticContact CD1-CE1 3.91Å; F489-Y602 HydrophobicContact CD1-CE1 3.91Å; F489-Y602 AromaticContact CE1-CD1 3.98Å; F489-Y602 HydrophobicContact CE1-CD1 3.98Å; F489-Y602 HydrophobicContact CE1-CE1 4.13Å; F489-I603 HydrophobicContact CE1-CD1 4.26Å; F489-I603 HydrophobicContact CE1-CG1 4.08Å; F489-I603 HydrophobicContact CE2-CD1 4.12Å; F489-I603 HydrophobicContact CZ-CD1 3.62Å; F489-I603 HydrophobicContact CZ-CG1 3.96Å
490	P	76.3	Confident	83.9	Confident	70 Å²	70	55 Å²	55	46%	0.455	28%	0.28	S	S	.	.	H	α-helix	trans	-61.8	-42.6	-173.9	21.9	-32.1	0	0	0	112.6	V492 A493	P490-V492 VanDerWaalsContact C-N 3.31Å; P490-V492 PolarHBondContact O-N 3.31Å; P490-A493 WeakPolarHBondContact O-CB 3.46Å; P490-A493 PolarHBondContact O-N 3.42Å
491	F	78.2	Confident	82.8	Confident	171 Å²	171	63.3 Å²	63.3	75%	0.75	31%	0.31	S	S	*	.	H	α-helix	trans	-70.2	-26.6	178	-60.7	-69.6	0	0	0	113.1	F489 A493	F489-F491 PolarHBondContact O-N 3.35Å; F491-A493 VanDerWaalsContact C-N 3.34Å
492	V	83.3	Confident	81.8	Confident	16 Å²	16	64 Å²	64	10%	0.097	32%	0.315	C	S	.	.	H	α-helix	trans	-76.3	-25.5	179.3	-175.9	0	0	0	0	111.5	L480 L483 F489 P490 W494 F495	L480-V492 HydrophobicContact CD2-CG1 4.34Å; L483-V492 HydrophobicContact CB-CG1 4.11Å; F489-V492 HydrophobicContact CB-CB 3.81Å; F489-V492 HydrophobicContact CB-CG2 3.47Å; F489-V492 VanDerWaalsContact CB-CG2 3.47Å; F489-V492 HydrophobicContact CD2-CG2 4.3Å; F489-V492 HydrophobicContact CG-CG2 4.07Å; F489-V492 PolarHBondContact O-N 3.46Å; F489-V492 VanDerWaalsContact O-N 3.11Å; P490-V492 VanDerWaalsContact C-N 3.31Å; P490-V492 PolarHBondContact O-N 3.31Å; V492-W494 PolarHBondContact O-N 2.9Å; V492-W494 VanDerWaalsContact O-N 3.14Å; V492-F495 PolarHBondContact O-N 3.32Å
493	A	82	Confident	81.4	Confident	30 Å²	30	70.3 Å²	70.3	25%	0.248	34%	0.336	C	S	.	.	H	α-helix	trans	-55.4	-33.7	177.2	0	0	0	0	0	112.4	F489 P490 F491 F495 S496	F489-A493 PolarHBondContact O-N 2.75Å; P490-A493 WeakPolarHBondContact O-CB 3.46Å; P490-A493 PolarHBondContact O-N 3.42Å; F491-A493 VanDerWaalsContact C-N 3.34Å; A493-F495 VanDerWaalsContact C-N 3.28Å; A493-F495 PolarHBondContact O-N 3.14Å; A493-S496 WeakPolarHBondContact O-CB 3.25Å; A493-S496 PolarHBondContact O-N 3.43Å; A493-S496 VanDerWaalsContact O-N 3.11Å; A493-S496 PolarHBondContact O-OG 3.27Å
494	W	86	Confident	81.3	Confident	156 Å²	156	70.8 Å²	70.8	59%	0.591	34%	0.338	S	S	*	.	G	3₁₀ helix	trans	-62.8	-30.7	178	-173.9	73.7	0	0	0	113.9	V492 S496 R507	V492-W494 PolarHBondContact O-N 2.9Å; V492-W494 VanDerWaalsContact O-N 3.14Å; W494-S496 VanDerWaalsContact C-N 3.31Å; W494-R507 VanDerWaalsContact CD1-NH1 3.35Å; W494-R507 VanDerWaalsContact NE1-NH1 3.15Å; W494-R507 WeakPolarHBondContact O-CD 3.37Å; W494-R507 PolarHBondContact O-NH1 2.95Å
495	F	86.2	Confident	81.4	Confident	39 Å²	39	70.7 Å²	70.7	17%	0.171	34%	0.338	C	S	.	.	G	3₁₀ helix	trans	-81.7	-8	177.7	-62	-69.9	0	0	0	113.5	V492 A493 F497 R507 A508 L511	V492-F495 PolarHBondContact O-N 3.32Å; A493-F495 VanDerWaalsContact C-N 3.28Å; A493-F495 PolarHBondContact O-N 3.14Å; F495-F497 VanDerWaalsContact C-N 3.33Å; F495-F497 PolarHBondContact O-N 3.09Å; F495-R507 HydrophobicContact CD1-CB 4.09Å; F495-A508 HydrophobicContact CB-CB 4.2Å; F495-L511 HydrophobicContact CD1-CB 4.34Å; F495-L511 HydrophobicContact CD1-CD2 4.22Å; F495-L511 HydrophobicContact CD2-CD2 4.28Å; F495-L511 HydrophobicContact CE1-CB 3.91Å; F495-L511 HydrophobicContact CE1-CD1 4.48Å; F495-L511 HydrophobicContact CE1-CD2 3.85Å; F495-L511 HydrophobicContact CE1-CG 4.29Å; F495-L511 HydrophobicContact CE2-CD2 3.94Å; F495-L511 HydrophobicContact CG-CD2 4.43Å; F495-L511 HydrophobicContact CZ-CB 4.48Å; F495-L511 HydrophobicContact CZ-CD1 4.28Å; F495-L511 HydrophobicContact CZ-CD2 3.72Å; F495-L511 HydrophobicContact CZ-CG 4.38Å
496	S	81.7	Confident	81.7	Confident	21 Å²	21	71.7 Å²	71.7	15%	0.147	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-79.7	-11.5	-176	75.8	0	0	0	0	115.1	Q481 G484 A493 W494 P498	Q481-S496 WeakPolarHBondContact CG-O 3.26Å; Q481-S496 PolarHBondContact NE2-O 2.68Å; G484-S496 VanDerWaalsContact C-CB 3.47Å; A493-S496 WeakPolarHBondContact O-CB 3.25Å; A493-S496 PolarHBondContact O-N 3.43Å; A493-S496 VanDerWaalsContact O-N 3.11Å; A493-S496 PolarHBondContact O-OG 3.27Å; W494-S496 VanDerWaalsContact C-N 3.31Å; S496-P498 WeakPolarHBondContact O-CD 3.49Å
497	F	85.3	Confident	82	Confident	102 Å²	102	73.4 Å²	73.4	45%	0.447	34%	0.343	S	S	.	.			trans	-58.6	122.3	-172.4	-166.2	-87.2	0	0	0	111.9	F495 Y499	F495-F497 VanDerWaalsContact C-N 3.33Å; F495-F497 PolarHBondContact O-N 3.09Å; F497-Y499 HydrophobicContact CB-CE2 4.36Å; F497-Y499 AromaticContact CD1-CD2 3.91Å; F497-Y499 HydrophobicContact CD1-CD2 3.91Å; F497-Y499 HydrophobicContact CD1-CE1 4.14Å; F497-Y499 AromaticContact CD1-CE2 3.49Å; F497-Y499 HydrophobicContact CD1-CE2 3.49Å; F497-Y499 VanDerWaalsContact CD1-CE2 3.49Å; F497-Y499 HydrophobicContact CD1-CG 4.41Å; F497-Y499 AromaticContact CD1-CZ 3.61Å; F497-Y499 HydrophobicContact CE1-CD1 4.44Å; F497-Y499 HydrophobicContact CE1-CE1 4.11Å; F497-Y499 HydrophobicContact CE1-CE2 4.27Å; F497-Y499 HydrophobicContact CG-CE2 4.36Å
498	P	82.7	Confident	82.4	Confident	55 Å²	55	65.5 Å²	65.5	36%	0.357	31%	0.308	S	S	.	.			trans	-85	131.3	-177.8	32.1	-32.5	0	0	0	112.3	S496 R503	S496-P498 WeakPolarHBondContact O-CD 3.49Å; P498-R503 HydrophobicContact CB-CB 3.58Å; P498-R503 HydrophobicContact CB-CG 3.99Å
499	Y	81.9	Confident	82.9	Confident	65 Å²	65	65 Å²	65	26%	0.255	31%	0.305	S	S	.	.	B	Isolated β-bridge	trans	-110.9	141.4	174.6	-69.2	-94.6	0	0	0	112.5	F497 R503 E504 R506 R507	F497-Y499 HydrophobicContact CB-CE2 4.36Å; F497-Y499 AromaticContact CD1-CD2 3.91Å; F497-Y499 HydrophobicContact CD1-CD2 3.91Å; F497-Y499 HydrophobicContact CD1-CE1 4.14Å; F497-Y499 AromaticContact CD1-CE2 3.49Å; F497-Y499 HydrophobicContact CD1-CE2 3.49Å; F497-Y499 VanDerWaalsContact CD1-CE2 3.49Å; F497-Y499 HydrophobicContact CD1-CG 4.41Å; F497-Y499 AromaticContact CD1-CZ 3.61Å; F497-Y499 HydrophobicContact CE1-CD1 4.44Å; F497-Y499 HydrophobicContact CE1-CE1 4.11Å; F497-Y499 HydrophobicContact CE1-CE2 4.27Å; F497-Y499 HydrophobicContact CG-CE2 4.36Å; Y499-R503 CarbonylContact O-C 3.59Å; Y499-R503 WeakPolarHBondContact O-CA 3.4Å; Y499-R503 PolarHBondContact O-N 2.84Å; Y499-E504 WeakPolarHBondContact CB-O 3.43Å; Y499-E504 PolarHBondContact N-O 3.42Å; Y499-E504 PolarHBondContact O-N 2.81Å; Y499-R506 HydrophobicContact CD2-CB 3.75Å; Y499-R506 HydrophobicContact CD2-CG 4.03Å; Y499-R506 HydrophobicContact CE2-CB 4.08Å; Y499-R506 HydrophobicContact CG-CB 4.21Å; Y499-R506 HydrophobicContact CG-CG 4.05Å; Y499-R507 HydrophobicContact CE2-CG 4.17Å; Y499-R507 PolarHBondContact OH-NE 3Å; Y499-R507 VanDerWaalsContact OH-NE 3.1Å
500	G	73.5	Confident	83.3	Confident	64 Å²	64	67.6 Å²	67.6	66%	0.66	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.4	-176	173.7	0	0	0	0	0	114.8	N502 R503	G500-N502 VanDerWaalsContact C-N 3.28Å; G500-N502 PolarHBondContact O-N 3.42Å; G500-R503 PolarHBondContact O-N 3.17Å; G500-R503 VanDerWaalsContact O-N 3.12Å
501	R	68.3	Low	84.1	Confident	188 Å²	188	67.6 Å²	67.6	71%	0.709	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-31.7	-175.8	-173.7	173	173.9	154.9	-4.1	113.5	G147 R503	G147-R501 PolarHBondContact O-NE 3.09Å; G147-R501 VanDerWaalsContact O-NE 3.13Å; G147-R501 PolarHBondContact O-NH2 3.15Å; R501-R503 VanDerWaalsContact C-N 3.34Å
502	N	70.2	Confident	84.8	Confident	29 Å²	29	59.5 Å²	59.5	16%	0.155	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.6	4.3	179	-66.4	-15.2	0	0	0	113.5	G500 E504	G500-N502 VanDerWaalsContact C-N 3.28Å; G500-N502 PolarHBondContact O-N 3.42Å; N502-E504 HydrophobicContact CB-CG 4.13Å; N502-E504 PolarHBondContact O-N 3.25Å
503	R	79.8	Confident	85.3	Confident	141 Å²	141	60 Å²	60	53%	0.532	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	45.9	178.6	-61.8	-173.7	178.1	-161.8	-1.8	113.1	Q481 P498 Y499 G500 R501	Q481-R503 PolarHBondContact NE2-O 3.28Å; P498-R503 HydrophobicContact CB-CB 3.58Å; P498-R503 HydrophobicContact CB-CG 3.99Å; Y499-R503 CarbonylContact O-C 3.59Å; Y499-R503 WeakPolarHBondContact O-CA 3.4Å; Y499-R503 PolarHBondContact O-N 2.84Å; G500-R503 PolarHBondContact O-N 3.17Å; G500-R503 VanDerWaalsContact O-N 3.12Å; R501-R503 VanDerWaalsContact C-N 3.34Å
504	E	86.2	Confident	86	Confident	9 Å²	9	64.8 Å²	64.8	4%	0.042	30%	0.299	C	S	.	.	B	Isolated β-bridge	trans	-74.9	135.6	-175.5	-67.9	-60.9	161.9	0	0	112.7	V295 K478 Y499 N502 R506 Y509	V295-E504 WeakPolarHBondContact CG2-OE1 3.28Å; V295-E504 PolarHBondContact N-OE1 2.94Å; K478-E504 WeakPolarHBondContact CE-OE2 3.48Å; K478-E504 IonicContact NZ-OE1 2.86Å; K478-E504 PolarHBondContact NZ-OE1 2.98Å; K478-E504 IonicContact NZ-OE2 2.82Å; K478-E504 PolarHBondContact NZ-OE2 2.9Å; Y499-E504 WeakPolarHBondContact CB-O 3.43Å; Y499-E504 PolarHBondContact N-O 3.42Å; Y499-E504 PolarHBondContact O-N 2.81Å; N502-E504 HydrophobicContact CB-CG 4.13Å; N502-E504 PolarHBondContact O-N 3.25Å; E504-R506 PolarHBondContact O-N 2.87Å; E504-Y509 HydrophobicContact CB-CE2 4.38Å; E504-Y509 PolarHBondContact OE2-OH 2.86Å
505	P	90.1	Very high	86.2	Confident	0 Å²	0	59.8 Å²	59.8	0%	0	28%	0.284	C	S	.	.			trans	-85.2	71.1	-179	35.6	-36.5	0	0	0	112.1	P477 K478 Q481 R507 A508 Y509	P477-P505 HydrophobicContact CB-CG 4.15Å; K478-P505 HydrophobicContact CD-CG 4.5Å; Q481-P505 HydrophobicContact CB-CB 3.81Å; Q481-P505 HydrophobicContact CB-CG 4.07Å; Q481-P505 HydrophobicContact CG-CB 3.83Å; Q481-P505 HydrophobicContact CG-CG 4.4Å; P505-R507 VanDerWaalsContact C-N 3.27Å; P505-R507 PolarHBondContact O-N 2.83Å; P505-A508 HydrophobicContact CB-CB 3.91Å; P505-A508 HydrophobicContact CG-CB 4.39Å; P505-A508 WeakPolarHBondContact O-CB 3.35Å; P505-A508 PolarHBondContact O-N 3.39Å; P505-Y509 HydrophobicContact CG-CD2 4.5Å; P505-Y509 HydrophobicContact CG-CE2 4.13Å; P505-Y509 WeakPolarHBondContact O-CD2 3.36Å; P505-Y509 PolarHBondContact O-N 2.9Å
506	R	89.5	Confident	86.5	Confident	119 Å²	119	58 Å²	58	45%	0.449	28%	0.276	S	S	.	.	H	α-helix	trans	-53.2	-39.6	-177.9	-68	-176.6	179.3	176	-1.6	114	Y499 E504 A508 Y509 V510	Y499-R506 HydrophobicContact CD2-CB 3.75Å; Y499-R506 HydrophobicContact CD2-CG 4.03Å; Y499-R506 HydrophobicContact CE2-CB 4.08Å; Y499-R506 HydrophobicContact CG-CB 4.21Å; Y499-R506 HydrophobicContact CG-CG 4.05Å; E504-R506 PolarHBondContact O-N 2.87Å; R506-A508 PolarHBondContact O-N 3.15Å; R506-Y509 WeakPolarHBondContact O-CB 3.42Å; R506-Y509 PolarHBondContact O-N 3.35Å; R506-V510 WeakPolarHBondContact O-CG2 3.24Å; R506-V510 PolarHBondContact O-N 3.27Å; R506-V510 VanDerWaalsContact O-N 3.09Å
507	R	90.9	Very high	87	Confident	75 Å²	75	58.4 Å²	58.4	28%	0.283	28%	0.276	S	S	.	.	H	α-helix	trans	-63.1	-41	176.5	-64.4	178.7	-174.2	179.6	-4.4	112.2	W494 F495 Y499 P505 Y509 V510 L511	W494-R507 VanDerWaalsContact CD1-NH1 3.35Å; W494-R507 VanDerWaalsContact NE1-NH1 3.15Å; W494-R507 WeakPolarHBondContact O-CD 3.37Å; W494-R507 PolarHBondContact O-NH1 2.95Å; F495-R507 HydrophobicContact CD1-CB 4.09Å; Y499-R507 HydrophobicContact CE2-CG 4.17Å; Y499-R507 PolarHBondContact OH-NE 3Å; Y499-R507 VanDerWaalsContact OH-NE 3.1Å; P505-R507 VanDerWaalsContact C-N 3.27Å; P505-R507 PolarHBondContact O-N 2.83Å; R507-Y509 VanDerWaalsContact C-N 3.35Å; R507-V510 PolarHBondContact O-N 3.01Å; R507-L511 PolarHBondContact O-N 2.91Å; R507-L511 VanDerWaalsContact O-N 3.07Å
508	A	91.9	Very high	87.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-69.6	-33.5	177.4	0	0	0	0	0	111.9	P477 L480 F495 P505 R506 L511 A512	P477-A508 HydrophobicContact CB-CB 3.78Å; L480-A508 HydrophobicContact CB-CB 4.41Å; F495-A508 HydrophobicContact CB-CB 4.2Å; P505-A508 HydrophobicContact CB-CB 3.91Å; P505-A508 HydrophobicContact CG-CB 4.39Å; P505-A508 WeakPolarHBondContact O-CB 3.35Å; P505-A508 PolarHBondContact O-N 3.39Å; R506-A508 PolarHBondContact O-N 3.15Å; A508-L511 PolarHBondContact O-N 3.48Å; A508-A512 WeakPolarHBondContact O-CB 3.17Å; A508-A512 PolarHBondContact O-N 3.42Å
509	Y	93.4	Very high	87.6	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.4	-43.6	171.5	-75.4	-57.6	0	0	0	112.2	A291 F473 V474 P477 E504 P505 R506 R507 A512 F513	A291-Y509 HydrophobicContact CB-CD1 4.07Å; A291-Y509 HydrophobicContact CB-CE1 3.84Å; F473-Y509 HydrophobicContact CD1-CD1 4.22Å; F473-Y509 AromaticContact CE1-CD1 3.82Å; F473-Y509 HydrophobicContact CE1-CD1 3.82Å; V474-Y509 HydrophobicContact CG2-CE1 4.32Å; P477-Y509 HydrophobicContact CB-CD1 3.76Å; P477-Y509 HydrophobicContact CB-CE1 3.8Å; P477-Y509 HydrophobicContact CB-CG 4.24Å; P477-Y509 HydrophobicContact CG-CD1 3.57Å; P477-Y509 HydrophobicContact CG-CE1 3.83Å; P477-Y509 HydrophobicContact CG-CG 4.35Å; E504-Y509 HydrophobicContact CB-CE2 4.38Å; E504-Y509 PolarHBondContact OE2-OH 2.86Å; P505-Y509 HydrophobicContact CG-CD2 4.5Å; P505-Y509 HydrophobicContact CG-CE2 4.13Å; P505-Y509 WeakPolarHBondContact O-CD2 3.36Å; P505-Y509 PolarHBondContact O-N 2.9Å; R506-Y509 WeakPolarHBondContact O-CB 3.42Å; R506-Y509 PolarHBondContact O-N 3.35Å; R507-Y509 VanDerWaalsContact C-N 3.35Å; Y509-A512 PolarHBondContact O-N 3.09Å; Y509-F513 WeakPolarHBondContact O-CB 3.42Å; Y509-F513 PolarHBondContact O-N 3.35Å
510	V	92.6	Very high	87.9	Confident	70 Å²	70	51.5 Å²	51.5	42%	0.424	25%	0.253	S	S	.	.	H	α-helix	trans	-64.1	-42.4	176.8	175.2	0	0	0	0	111.2	R506 R507 F513 F514	R506-V510 WeakPolarHBondContact O-CG2 3.24Å; R506-V510 PolarHBondContact O-N 3.27Å; R506-V510 VanDerWaalsContact O-N 3.09Å; R507-V510 PolarHBondContact O-N 3.01Å; V510-F513 WeakPolarHBondContact O-CB 3.49Å; V510-F513 PolarHBondContact O-N 3.22Å; V510-F514 HydrophobicContact CG1-CD2 3.83Å; V510-F514 HydrophobicContact CG1-CE2 3.57Å; V510-F514 VanDerWaalsContact O-CD2 3.25Å; V510-F514 WeakPolarHBondContact O-CD2 3.43Å; V510-F514 PolarHBondContact O-N 2.91Å; V510-F514 VanDerWaalsContact O-N 3.12Å
511	L	92	Very high	88.5	Confident	69 Å²	69	51 Å²	51	36%	0.361	24%	0.24	S	C	.	.	H	α-helix	trans	-60.2	-48.5	173.9	179	68.6	0	0	0	111.6	L480 F495 R507 A508 F513 F514 L515	L480-L511 HydrophobicContact CD1-CD2 4.05Å; F495-L511 HydrophobicContact CD1-CB 4.34Å; F495-L511 HydrophobicContact CD1-CD2 4.22Å; F495-L511 HydrophobicContact CD2-CD2 4.28Å; F495-L511 HydrophobicContact CE1-CB 3.91Å; F495-L511 HydrophobicContact CE1-CD1 4.48Å; F495-L511 HydrophobicContact CE1-CD2 3.85Å; F495-L511 HydrophobicContact CE1-CG 4.29Å; F495-L511 HydrophobicContact CE2-CD2 3.94Å; F495-L511 HydrophobicContact CG-CD2 4.43Å; F495-L511 HydrophobicContact CZ-CB 4.48Å; F495-L511 HydrophobicContact CZ-CD1 4.28Å; F495-L511 HydrophobicContact CZ-CD2 3.72Å; F495-L511 HydrophobicContact CZ-CG 4.38Å; R507-L511 PolarHBondContact O-N 2.91Å; R507-L511 VanDerWaalsContact O-N 3.07Å; A508-L511 PolarHBondContact O-N 3.48Å; L511-F513 VanDerWaalsContact C-N 3.25Å; L511-F513 PolarHBondContact O-N 2.8Å; L511-F514 PolarHBondContact O-N 3.48Å; L511-L515 WeakPolarHBondContact O-CB 3.48Å; L511-L515 PolarHBondContact O-N 2.9Å
512	A	93.1	Very high	89.2	Confident	2 Å²	2	46 Å²	46	2%	0.017	23%	0.226	C	C	.	.	H	α-helix	trans	-61.6	-34.6	178	0	0	0	0	0	112.3	V243 F473 P477 A508 Y509 G516	V243-A512 HydrophobicContact CG1-CB 4.11Å; V243-A512 VanDerWaalsContact CG1-O 3.25Å; V243-A512 WeakPolarHBondContact CG1-O 3.39Å; V243-A512 HydrophobicContact CG2-CB 3.59Å; F473-A512 HydrophobicContact CD2-CB 4.49Å; F473-A512 HydrophobicContact CE2-CB 3.92Å; F473-A512 HydrophobicContact CZ-CB 4.2Å; P477-A512 HydrophobicContact CG-CB 3.64Å; A508-A512 WeakPolarHBondContact O-CB 3.17Å; A508-A512 PolarHBondContact O-N 3.42Å; Y509-A512 PolarHBondContact O-N 3.09Å; A512-G516 PolarHBondContact O-N 3.4Å
513	F	94.9	Very high	89.2	Confident	27 Å²	27	45 Å²	45	12%	0.118	22%	0.223	C	C	.	.	H	α-helix	trans	-62.7	-53.6	175	174.3	-108.4	0	0	0	111.9	M284 V285 L288 F473 Y509 V510 L511 L515 G516 L517	M284-F513 HydrophobicContact CB-CD2 4.29Å; M284-F513 HydrophobicContact CB-CE2 4.06Å; V285-F513 HydrophobicContact CB-CE2 4.49Å; V285-F513 HydrophobicContact CG2-CE2 3.83Å; V285-F513 HydrophobicContact CG2-CZ 3.76Å; L288-F513 HydrophobicContact CB-CD2 3.96Å; L288-F513 HydrophobicContact CB-CE2 4.47Å; L288-F513 HydrophobicContact CD1-CB 4.27Å; L288-F513 HydrophobicContact CD2-CB 4.04Å; L288-F513 HydrophobicContact CD2-CD1 4.04Å; L288-F513 HydrophobicContact CD2-CD2 3.76Å; L288-F513 HydrophobicContact CD2-CE1 4.42Å; L288-F513 HydrophobicContact CD2-CE2 4.18Å; L288-F513 HydrophobicContact CD2-CG 3.68Å; L288-F513 HydrophobicContact CD2-CZ 4.48Å; L288-F513 HydrophobicContact CG-CD2 4.39Å; F473-F513 HydrophobicContact CE2-CB 4.36Å; F473-F513 HydrophobicContact CZ-CB 4.01Å; Y509-F513 WeakPolarHBondContact O-CB 3.42Å; Y509-F513 PolarHBondContact O-N 3.35Å; V510-F513 WeakPolarHBondContact O-CB 3.49Å; V510-F513 PolarHBondContact O-N 3.22Å; L511-F513 VanDerWaalsContact C-N 3.25Å; L511-F513 PolarHBondContact O-N 2.8Å; F513-L515 VanDerWaalsContact C-N 3.33Å; F513-L515 PolarHBondContact O-N 3.43Å; F513-G516 PolarHBondContact O-N 3.42Å; F513-L517 HydrophobicContact CD1-CD1 3.86Å; F513-L517 HydrophobicContact CD2-CG 4.5Å; F513-L517 HydrophobicContact CE1-CD1 3.34Å; F513-L517 HydrophobicContact CE1-CG 4.21Å; F513-L517 HydrophobicContact CE2-CD1 4.13Å; F513-L517 HydrophobicContact CE2-CD2 4.28Å; F513-L517 HydrophobicContact CE2-CG 4.15Å; F513-L517 HydrophobicContact CG-CD1 4.46Å; F513-L517 HydrophobicContact CZ-CD1 3.5Å; F513-L517 VanDerWaalsContact CZ-CD1 3.5Å; F513-L517 HydrophobicContact CZ-CD2 4.19Å; F513-L517 HydrophobicContact CZ-CG 4.01Å; F513-L517 WeakPolarHBondContact O-CG 3.36Å; F513-L517 PolarHBondContact O-N 3.12Å
514	F	95	Very high	89	Confident	129 Å²	129	44 Å²	44	57%	0.566	22%	0.224	S	C	*	.	H	α-helix	trans	-65	-37.5	179.2	-74.2	-64.4	0	0	0	112.8	V510 L511 L517 A518	V510-F514 HydrophobicContact CG1-CD2 3.83Å; V510-F514 HydrophobicContact CG1-CE2 3.57Å; V510-F514 VanDerWaalsContact O-CD2 3.25Å; V510-F514 WeakPolarHBondContact O-CD2 3.43Å; V510-F514 PolarHBondContact O-N 2.91Å; V510-F514 VanDerWaalsContact O-N 3.12Å; L511-F514 PolarHBondContact O-N 3.48Å; F514-L517 HydrophobicContact CD1-CD1 3.99Å; F514-L517 HydrophobicContact CE1-CD1 4.41Å; F514-L517 PolarHBondContact O-N 3.39Å; F514-A518 PolarHBondContact O-N 2.95Å
515	L	91.9	Very high	88	Confident	52 Å²	52	44.8 Å²	44.8	27%	0.272	23%	0.228	S	C	.	.	H	α-helix	trans	-63.9	-43.9	173.6	177.9	60.8	0	0	0	111.1	F240 V243 L511 F513 L517 A518 I519	F240-L515 HydrophobicContact CD2-CD1 4.4Å; F240-L515 HydrophobicContact CD2-CD2 3.46Å; F240-L515 VanDerWaalsContact CD2-CD2 3.46Å; F240-L515 HydrophobicContact CD2-CG 4.47Å; F240-L515 HydrophobicContact CE2-CD1 3.73Å; F240-L515 HydrophobicContact CE2-CD2 3.66Å; F240-L515 HydrophobicContact CE2-CG 4.21Å; V243-L515 HydrophobicContact CB-CD2 4.17Å; V243-L515 HydrophobicContact CG1-CB 4.13Å; V243-L515 HydrophobicContact CG1-CD2 3.89Å; V243-L515 HydrophobicContact CG1-CG 3.98Å; L511-L515 WeakPolarHBondContact O-CB 3.48Å; L511-L515 PolarHBondContact O-N 2.9Å; F513-L515 VanDerWaalsContact C-N 3.33Å; F513-L515 PolarHBondContact O-N 3.43Å; L515-L517 PolarHBondContact O-N 3.24Å; L515-A518 PolarHBondContact O-N 3.27Å; L515-I519 WeakPolarHBondContact O-CG1 3.33Å; L515-I519 PolarHBondContact O-N 2.81Å; L515-I519 VanDerWaalsContact O-N 3.12Å
516	G	92	Very high	87.2	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-61.7	-41.6	175.3	0	0	0	0	0	112.8	A512 F513 A518 I519 V520	A512-G516 PolarHBondContact O-N 3.4Å; F513-G516 PolarHBondContact O-N 3.42Å; G516-A518 VanDerWaalsContact C-N 3.34Å; G516-A518 PolarHBondContact O-N 3.42Å; G516-I519 PolarHBondContact O-N 3.11Å; G516-V520 WeakPolarHBondContact O-CG2 3.07Å; G516-V520 PolarHBondContact O-N 2.78Å
517	L	92.8	Very high	86.6	Confident	30 Å²	30	49 Å²	49	16%	0.157	26%	0.26	C	S	.	.	H	α-helix	trans	-57.8	-45.7	174.2	-74.9	173	0	0	0	111.7	I281 M284 F513 F514 L515 I519 V520 S521	I281-L517 HydrophobicContact CB-CD2 4.02Å; I281-L517 HydrophobicContact CG1-CD2 3.72Å; I281-L517 HydrophobicContact CG2-CD2 3.69Å; M284-L517 HydrophobicContact CB-CD2 4.46Å; F513-L517 HydrophobicContact CD1-CD1 3.86Å; F513-L517 HydrophobicContact CD2-CG 4.5Å; F513-L517 HydrophobicContact CE1-CD1 3.34Å; F513-L517 HydrophobicContact CE1-CG 4.21Å; F513-L517 HydrophobicContact CE2-CD1 4.13Å; F513-L517 HydrophobicContact CE2-CD2 4.28Å; F513-L517 HydrophobicContact CE2-CG 4.15Å; F513-L517 HydrophobicContact CG-CD1 4.46Å; F513-L517 HydrophobicContact CZ-CD1 3.5Å; F513-L517 VanDerWaalsContact CZ-CD1 3.5Å; F513-L517 HydrophobicContact CZ-CD2 4.19Å; F513-L517 HydrophobicContact CZ-CG 4.01Å; F513-L517 WeakPolarHBondContact O-CG 3.36Å; F513-L517 PolarHBondContact O-N 3.12Å; F514-L517 HydrophobicContact CD1-CD1 3.99Å; F514-L517 HydrophobicContact CE1-CD1 4.41Å; F514-L517 PolarHBondContact O-N 3.39Å; L515-L517 PolarHBondContact O-N 3.24Å; L517-I519 VanDerWaalsContact C-N 3.29Å; L517-I519 PolarHBondContact O-N 3.5Å; L517-V520 PolarHBondContact O-N 3.37Å; L517-S521 WeakPolarHBondContact O-CB 3.46Å; L517-S521 PolarHBondContact O-N 3.36Å; L517-S521 PolarHBondContact O-OG 3.12Å
518	A	90.3	Very high	85.8	Confident	54 Å²	54	46.3 Å²	46.3	45%	0.446	25%	0.251	S	S	.	.	H	α-helix	trans	-60	-41.8	177.9	0	0	0	0	0	111.5	F514 L515 G516 S521 I522	F514-A518 PolarHBondContact O-N 2.95Å; L515-A518 PolarHBondContact O-N 3.27Å; G516-A518 VanDerWaalsContact C-N 3.34Å; G516-A518 PolarHBondContact O-N 3.42Å; A518-S521 WeakPolarHBondContact O-CB 3.33Å; A518-S521 PolarHBondContact O-N 3.43Å; A518-I522 PolarHBondContact O-N 3.46Å
519	I	89.1	Confident	85.2	Confident	23 Å²	23	47.2 Å²	47.2	12%	0.118	26%	0.258	C	S	.	.	H	α-helix	trans	-68.7	-45.1	177.8	-63.4	-62.2	0	0	0	112.2	V244 A247 L515 G516 L517 S521 I522 I528	V244-I519 HydrophobicContact CG1-CG2 4.14Å; V244-I519 HydrophobicContact CG2-CD1 4.35Å; V244-I519 HydrophobicContact CG2-CG1 4.25Å; A247-I519 HydrophobicContact CB-CB 3.8Å; A247-I519 HydrophobicContact CB-CG2 3.58Å; L515-I519 WeakPolarHBondContact O-CG1 3.33Å; L515-I519 PolarHBondContact O-N 2.81Å; L515-I519 VanDerWaalsContact O-N 3.12Å; G516-I519 PolarHBondContact O-N 3.11Å; L517-I519 VanDerWaalsContact C-N 3.29Å; L517-I519 PolarHBondContact O-N 3.5Å; I519-S521 PolarHBondContact O-N 2.79Å; I519-I522 HydrophobicContact CD1-CD1 4.27Å; I519-I522 WeakPolarHBondContact O-CB 3.15Å; I519-I522 PolarHBondContact O-N 2.86Å; I519-I522 VanDerWaalsContact O-N 3.15Å; I519-I528 HydrophobicContact CG2-CD1 3.8Å
520	V	88.7	Confident	84.7	Confident	1 Å²	1	48.8 Å²	48.8	1%	0.006	27%	0.268	C	S	.	.	H	α-helix	trans	-59.1	-36.1	175.3	169.5	0	0	0	0	110.9	A247 V251 I281 M284 G516 L517 I522 G523	A247-V520 HydrophobicContact CB-CG2 3.91Å; V251-V520 HydrophobicContact CG2-CB 4.35Å; V251-V520 HydrophobicContact CG2-CG1 4.24Å; V251-V520 HydrophobicContact CG2-CG2 4.08Å; I281-V520 HydrophobicContact CG1-CG1 4.27Å; M284-V520 HydrophobicContact CG-CG2 3.98Å; G516-V520 WeakPolarHBondContact O-CG2 3.07Å; G516-V520 PolarHBondContact O-N 2.78Å; L517-V520 PolarHBondContact O-N 3.37Å; V520-I522 VanDerWaalsContact C-N 3.26Å; V520-I522 PolarHBondContact O-N 2.86Å; V520-G523 PolarHBondContact O-N 3.2Å; V520-G523 VanDerWaalsContact O-N 3.15Å
521	S	85	Confident	84.3	Confident	54 Å²	54	47.8 Å²	47.8	38%	0.378	26%	0.26	S	S	.	.	H	α-helix	trans	-65.1	-28.7	179.8	-57.8	0	0	0	0	112.9	R277 L517 A518 I519 G523	R277-S521 PolarHBondContact NE-O 3.4Å; R277-S521 PolarHBondContact NH2-O 3.12Å; L517-S521 WeakPolarHBondContact O-CB 3.46Å; L517-S521 PolarHBondContact O-N 3.36Å; L517-S521 PolarHBondContact O-OG 3.12Å; A518-S521 WeakPolarHBondContact O-CB 3.33Å; A518-S521 PolarHBondContact O-N 3.43Å; I519-S521 PolarHBondContact O-N 2.79Å; S521-G523 VanDerWaalsContact C-N 3.34Å
522	I	83.1	Confident	84.1	Confident	82 Å²	82	45.1 Å²	45.1	42%	0.421	25%	0.246	S	C	.	.	H	α-helix	trans	-64.4	-41.1	174.9	-62.4	169.4	0	0	0	110.1	A518 I519 V520 E524	A518-I522 PolarHBondContact O-N 3.46Å; I519-I522 HydrophobicContact CD1-CD1 4.27Å; I519-I522 WeakPolarHBondContact O-CB 3.15Å; I519-I522 PolarHBondContact O-N 2.86Å; I519-I522 VanDerWaalsContact O-N 3.15Å; V520-I522 VanDerWaalsContact C-N 3.26Å; V520-I522 PolarHBondContact O-N 2.86Å; I522-E524 HydrophobicContact CG2-CB 4.32Å; I522-E524 PolarHBondContact O-N 3.48Å
523	G	72.1	Confident	83.9	Confident	9 Å²	9	45.1 Å²	45.1	9%	0.093	25%	0.246	C	C	.	.			trans	73.8	-6	173.9	0	0	0	0	0	116	V520 S521 I525	V520-G523 PolarHBondContact O-N 3.2Å; V520-G523 VanDerWaalsContact O-N 3.15Å; S521-G523 VanDerWaalsContact C-N 3.34Å; G523-I525 PolarHBondContact O-N 3.49Å
524	E	73.7	Confident	83.8	Confident	119 Å²	119	43.8 Å²	43.8	56%	0.556	24%	0.24	S	C	*	.			trans	-95	93.5	-179.2	-69.8	-170.5	-165.1	0	0	113.1	I522 N526 L527 I528	I522-E524 HydrophobicContact CG2-CB 4.32Å; I522-E524 PolarHBondContact O-N 3.48Å; E524-N526 PolarHBondContact O-N 3.19Å; E524-L527 HydrophobicContact CB-CB 4.36Å; E524-I528 WeakPolarHBondContact O-CG1 3.42Å
525	I	66.5	Low	83.7	Confident	25 Å²	25	38 Å²	38	13%	0.128	22%	0.215	C	C	.	.	H	α-helix	trans	-57.8	-42.5	179	-77.3	166.8	0	0	0	112.6	F248 V251 E255 G523 L527 I528 A529	F248-I525 HydrophobicContact CD2-CB 4.5Å; F248-I525 HydrophobicContact CD2-CG1 4.43Å; F248-I525 HydrophobicContact CD2-CG2 4.06Å; F248-I525 HydrophobicContact CE2-CB 4.1Å; F248-I525 HydrophobicContact CE2-CG1 4.38Å; F248-I525 HydrophobicContact CE2-CG2 3.24Å; F248-I525 HydrophobicContact CZ-CG2 3.78Å; V251-I525 HydrophobicContact CB-CD1 3.97Å; V251-I525 HydrophobicContact CB-CG1 4.08Å; V251-I525 HydrophobicContact CG1-CD1 3.37Å; V251-I525 HydrophobicContact CG1-CG1 3.68Å; E255-I525 HydrophobicContact CG-CD1 4.3Å; E255-I525 VanDerWaalsContact OE1-CD1 3.23Å; E255-I525 WeakPolarHBondContact OE1-CD1 3.4Å; E255-I525 VanDerWaalsContact OE2-CD1 3.27Å; E255-I525 WeakPolarHBondContact OE2-CD1 2.89Å; G523-I525 PolarHBondContact O-N 3.49Å; I525-L527 PolarHBondContact O-N 3.22Å; I525-I528 PolarHBondContact O-N 2.75Å; I525-A529 PolarHBondContact O-N 2.81Å; I525-A529 VanDerWaalsContact O-N 3.14Å
526	N	73.4	Confident	83.8	Confident	127 Å²	127	36 Å²	36	68%	0.679	20%	0.204	S	C	*	.	H	α-helix	trans	-69.6	-29.7	-172.3	-68.3	-28.6	0	0	0	113.6	E524 I528 P530	E524-N526 PolarHBondContact O-N 3.19Å; N526-I528 VanDerWaalsContact C-N 3.35Å; N526-P530 VanDerWaalsContact O-CD 3.26Å; N526-P530 WeakPolarHBondContact O-CD 3.34Å
527	L	75.3	Confident	83.9	Confident	82 Å²	82	36 Å²	36	43%	0.429	20%	0.204	S	C	.	.	H	α-helix	trans	-69.7	-38.8	178.4	-174.5	66.3	0	0	0	110.9	E524 I525 K588	E524-L527 HydrophobicContact CB-CB 4.36Å; I525-L527 PolarHBondContact O-N 3.22Å; L527-K588 PolarHBondContact O-NZ 3.41Å
528	I	75.5	Confident	84	Confident	18 Å²	18	34.9 Å²	34.9	9%	0.092	20%	0.198	C	C	.	.	H	α-helix	trans	-86.6	-39.2	-166.9	-60.7	171.9	0	0	0	112	V244 I519 E524 I525 N526 I531 I532	V244-I528 HydrophobicContact CG1-CG2 3.2Å; I519-I528 HydrophobicContact CG2-CD1 3.8Å; E524-I528 WeakPolarHBondContact O-CG1 3.42Å; I525-I528 PolarHBondContact O-N 2.75Å; N526-I528 VanDerWaalsContact C-N 3.35Å; I528-I531 WeakPolarHBondContact O-CB 3.45Å; I528-I531 PolarHBondContact O-N 3.31Å; I528-I532 HydrophobicContact CG2-CD1 3.73Å; I528-I532 HydrophobicContact CG2-CG1 4.04Å; I528-I532 PolarHBondContact O-N 3.12Å; I528-I532 VanDerWaalsContact O-N 3.12Å
529	A	80	Confident	84.2	Confident	18 Å²	18	32.3 Å²	32.3	15%	0.149	18%	0.177	C	C	.	.	H	α-helix	trans	-51	-50.4	-175.7	0	0	0	0	0	114	F248 I525 I531 I532 A533	F248-A529 HydrophobicContact CD2-CB 4.43Å; F248-A529 HydrophobicContact CE2-CB 3.63Å; F248-A529 HydrophobicContact CZ-CB 4.05Å; I525-A529 PolarHBondContact O-N 2.81Å; I525-A529 VanDerWaalsContact O-N 3.14Å; A529-I531 VanDerWaalsContact C-N 3.28Å; A529-I531 PolarHBondContact O-N 3.13Å; A529-I532 PolarHBondContact O-N 3.48Å; A529-A533 PolarHBondContact O-N 3.02Å
530	P	82.3	Confident	84.5	Confident	34 Å²	34	31.2 Å²	31.2	22%	0.221	17%	0.172	C	C	.	.	H	α-helix	trans	-66.5	-27.7	179.1	-23.2	35	0	0	0	113.5	N526 N534 K588	N526-P530 VanDerWaalsContact O-CD 3.26Å; N526-P530 WeakPolarHBondContact O-CD 3.34Å; P530-N534 WeakPolarHBondContact O-CB 3.36Å; P530-N534 PolarHBondContact O-N 3.45Å; P530-N534 PolarHBondContact O-ND2 2.82Å; P530-K588 HydrophobicContact CB-CD 3.72Å
531	I	83.7	Confident	84.8	Confident	49 Å²	49	31.6 Å²	31.6	25%	0.251	18%	0.175	S	C	.	.	H	α-helix	trans	-67.7	-47.5	177	-60.1	175.5	0	0	0	109.6	I528 A529 A533 N534 I535 K588	I528-I531 WeakPolarHBondContact O-CB 3.45Å; I528-I531 PolarHBondContact O-N 3.31Å; A529-I531 VanDerWaalsContact C-N 3.28Å; A529-I531 PolarHBondContact O-N 3.13Å; I531-A533 PolarHBondContact O-N 2.95Å; I531-N534 PolarHBondContact O-N 3.02Å; I531-I535 HydrophobicContact CG2-CD1 4.11Å; I531-I535 WeakPolarHBondContact O-CG1 2.94Å; I531-I535 PolarHBondContact O-N 3.35Å; I531-I535 VanDerWaalsContact O-N 3.09Å; I531-K588 HydrophobicContact CG1-CD 3.8Å; I531-K588 HydrophobicContact CG1-CG 4.36Å
532	I	87.5	Confident	85.3	Confident	12 Å²	12	30.1 Å²	30.1	6%	0.062	16%	0.163	C	C	.	.	H	α-helix	trans	-57.1	-52.6	175.4	-60.6	163	0	0	0	109.5	V244 A245 F248 I528 A529 N534 I535 F536	V244-I532 HydrophobicContact CB-CD1 4.4Å; V244-I532 HydrophobicContact CB-CG1 4.13Å; V244-I532 HydrophobicContact CG1-CD1 3.8Å; V244-I532 HydrophobicContact CG1-CG1 3.69Å; A245-I532 HydrophobicContact CB-CD1 4.41Å; A245-I532 HydrophobicContact CB-CG2 4.09Å; F248-I532 HydrophobicContact CB-CD1 4.02Å; F248-I532 HydrophobicContact CG-CD1 4.29Å; I528-I532 HydrophobicContact CG2-CD1 3.73Å; I528-I532 HydrophobicContact CG2-CG1 4.04Å; I528-I532 PolarHBondContact O-N 3.12Å; I528-I532 VanDerWaalsContact O-N 3.12Å; A529-I532 PolarHBondContact O-N 3.48Å; I532-N534 VanDerWaalsContact C-N 3.28Å; I532-N534 PolarHBondContact O-N 3.03Å; I532-I535 PolarHBondContact O-N 3.41Å; I532-I535 VanDerWaalsContact O-N 3.08Å; I532-F536 HydrophobicContact CG2-CD2 3.63Å; I532-F536 HydrophobicContact CG2-CE2 3.59Å; I532-F536 WeakPolarHBondContact O-CD2 3.24Å; I532-F536 PolarHBondContact O-N 2.83Å
533	A	90	Very high	85.8	Confident	2 Å²	2	26.2 Å²	26.2	2%	0.017	14%	0.143	C	C	.	.	H	α-helix	trans	-57.7	-41.1	-177.4	0	0	0	0	0	112.3	P363 A529 I531 F536 L537 L584	P363-A533 HydrophobicContact CG-CB 4.38Å; A529-A533 PolarHBondContact O-N 3.02Å; I531-A533 PolarHBondContact O-N 2.95Å; A533-F536 PolarHBondContact O-N 2.88Å; A533-L537 WeakPolarHBondContact O-CB 3.43Å; A533-L537 WeakPolarHBondContact O-CG 3.37Å; A533-L537 PolarHBondContact O-N 3.43Å; A533-L584 HydrophobicContact CB-CD1 3.64Å
534	N	92.3	Very high	87	Confident	0 Å²	0	25.8 Å²	25.8	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-62.7	-43.4	175.2	-85.5	-72.2	0	0	0	112.7	P530 I531 I532 L537 V538 M581 S585	P530-N534 WeakPolarHBondContact O-CB 3.36Å; P530-N534 PolarHBondContact O-N 3.45Å; P530-N534 PolarHBondContact O-ND2 2.82Å; I531-N534 PolarHBondContact O-N 3.02Å; I532-N534 VanDerWaalsContact C-N 3.28Å; I532-N534 PolarHBondContact O-N 3.03Å; N534-L537 PolarHBondContact O-N 3.09Å; N534-V538 WeakPolarHBondContact O-CG1 3.2Å; N534-V538 PolarHBondContact O-N 3.08Å; N534-M581 HydrophobicContact CB-CE 4.21Å; N534-M581 WeakPolarHBondContact O-CE 3.39Å; N534-M581 VanDerWaalsContact OD1-CA 3.31Å; N534-M581 WeakPolarHBondContact OD1-CA 3.36Å; N534-M581 WeakPolarHBondContact OD1-CB 3.43Å; N534-M581 WeakPolarHBondContact OD1-CG 3.38Å; N534-M581 PolarHBondContact OD1-O 3.27Å; N534-S585 PolarHBondContact ND2-OG 2.68Å; N534-S585 VanDerWaalsContact ND2-OG 3.1Å
535	I	92.6	Very high	88.1	Confident	7 Å²	7	24.3 Å²	24.3	4%	0.036	13%	0.128	C	C	.	.	H	α-helix	trans	-65.7	-39.8	178.2	-62.9	167.9	0	0	0	111.3	A237 A241 I531 I532 V538 C539 T592	A237-I535 HydrophobicContact CB-CG2 4.11Å; A241-I535 HydrophobicContact CB-CB 3.86Å; A241-I535 HydrophobicContact CB-CD1 4.12Å; A241-I535 HydrophobicContact CB-CG2 3.57Å; I531-I535 HydrophobicContact CG2-CD1 4.11Å; I531-I535 WeakPolarHBondContact O-CG1 2.94Å; I531-I535 PolarHBondContact O-N 3.35Å; I531-I535 VanDerWaalsContact O-N 3.09Å; I532-I535 PolarHBondContact O-N 3.41Å; I532-I535 VanDerWaalsContact O-N 3.08Å; I535-V538 WeakPolarHBondContact O-CG1 3.28Å; I535-C539 PolarHBondContact O-N 3.43Å; I535-T592 HydrophobicContact CG1-CG2 4.01Å
536	F	93	Very high	89.3	Confident	9 Å²	9	23.1 Å²	23.1	4%	0.039	12%	0.122	C	C	.	.	H	α-helix	trans	-64.5	-42.7	174.1	-85.5	-105.8	0	0	0	111.3	F238 A241 T366 I532 A533 C539 Y540	F238-F536 HydrophobicContact CD2-CD1 4.47Å; F238-F536 HydrophobicContact CD2-CD2 4.48Å; F238-F536 HydrophobicContact CD2-CE1 4.46Å; F238-F536 HydrophobicContact CD2-CG 4.47Å; F238-F536 HydrophobicContact CD2-CZ 4.48Å; F238-F536 AromaticContact CE2-CD1 3.42Å; F238-F536 HydrophobicContact CE2-CD1 3.42Å; F238-F536 VanDerWaalsContact CE2-CD1 3.42Å; F238-F536 HydrophobicContact CE2-CD2 4.1Å; F238-F536 AromaticContact CE2-CE1 3.37Å; F238-F536 HydrophobicContact CE2-CE1 3.37Å; F238-F536 HydrophobicContact CE2-CE2 4.09Å; F238-F536 AromaticContact CE2-CG 3.79Å; F238-F536 HydrophobicContact CE2-CG 3.79Å; F238-F536 AromaticContact CE2-CZ 3.73Å; F238-F536 HydrophobicContact CE2-CZ 3.73Å; F238-F536 HydrophobicContact CZ-CD1 4.04Å; F238-F536 AromaticContact CZ-CE1 3.74Å; F238-F536 HydrophobicContact CZ-CE1 3.74Å; F238-F536 HydrophobicContact CZ-CZ 4.28Å; A241-F536 HydrophobicContact CB-CD2 4.04Å; A241-F536 HydrophobicContact CB-CE2 3.75Å; T366-F536 HydrophobicContact CG2-CB 3.99Å; T366-F536 HydrophobicContact CG2-CG 4.34Å; T366-F536 WeakPolarHBondContact O-CD1 3.26Å; T366-F536 WeakPolarHBondContact O-CE1 3.49Å; I532-F536 HydrophobicContact CG2-CD2 3.63Å; I532-F536 HydrophobicContact CG2-CE2 3.59Å; I532-F536 WeakPolarHBondContact O-CD2 3.24Å; I532-F536 PolarHBondContact O-N 2.83Å; A533-F536 PolarHBondContact O-N 2.88Å; F536-C539 VanDerWaalsContact O-CB 3.28Å; F536-C539 WeakPolarHBondContact O-CB 3.42Å; F536-C539 PolarHBondContact O-N 3.11Å; F536-Y540 HydrophobicContact CB-CE1 4.42Å; F536-Y540 HydrophobicContact CD1-CE1 4.29Å; F536-Y540 WeakPolarHBondContact O-CD1 3.44Å; F536-Y540 WeakPolarHBondContact O-CE1 3.42Å; F536-Y540 PolarHBondContact O-N 3.18Å
537	L	94.3	Very high	90.3	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.09	C	C	.	.	H	α-helix	trans	-64.5	-40.1	178.8	-83.7	165.2	0	0	0	113.9	Y362 A533 N534 C539 Y540 A541 C577 I580 M581 L584	Y362-L537 HydrophobicContact CD1-CD1 4.28Å; Y362-L537 HydrophobicContact CE1-CD1 3.75Å; Y362-L537 HydrophobicContact CE1-CD2 3.53Å; Y362-L537 HydrophobicContact CE1-CG 3.71Å; Y362-L537 WeakPolarHBondContact OH-CD2 3.39Å; A533-L537 WeakPolarHBondContact O-CB 3.43Å; A533-L537 WeakPolarHBondContact O-CG 3.37Å; A533-L537 PolarHBondContact O-N 3.43Å; N534-L537 PolarHBondContact O-N 3.09Å; L537-C539 VanDerWaalsContact C-N 3.27Å; L537-C539 PolarHBondContact O-N 3.32Å; L537-Y540 WeakPolarHBondContact O-CB 3.36Å; L537-Y540 PolarHBondContact O-N 3.14Å; L537-Y540 VanDerWaalsContact O-N 3.1Å; L537-A541 WeakPolarHBondContact O-CB 3.25Å; L537-A541 PolarHBondContact O-N 3.49Å; L537-C577 HydrophobicContact CD2-CB 4.06Å; L537-I580 HydrophobicContact CD1-CB 4.26Å; L537-I580 HydrophobicContact CD1-CG2 3.63Å; L537-I580 HydrophobicContact CD2-CB 4.29Å; L537-I580 HydrophobicContact CD2-CG2 4.16Å; L537-M581 HydrophobicContact CB-CG 3.37Å; L537-M581 HydrophobicContact CB-SD 3.89Å; L537-M581 HydrophobicContact CD1-CB 4.5Å; L537-M581 HydrophobicContact CD1-CG 3.7Å; L537-M581 HydrophobicContact CG-CG 4.13Å; L537-L584 HydrophobicContact CD1-CD1 3.49Å; L537-L584 VanDerWaalsContact CD1-CD1 3.49Å; L537-L584 HydrophobicContact CD1-CG 4.43Å
538	V	95	Very high	91.3	Very high	7 Å²	7	14.3 Å²	14.3	4%	0.042	7%	0.074	C	C	.	.	H	α-helix	trans	-66.2	-34.4	174.7	61	0	0	0	0	111.1	I234 N534 I535 Y540 A541 L542 M581 T592 F593	I234-V538 HydrophobicContact CD1-CB 4.35Å; I234-V538 HydrophobicContact CD1-CG1 3.61Å; I234-V538 HydrophobicContact CD1-CG2 4.09Å; N534-V538 WeakPolarHBondContact O-CG1 3.2Å; N534-V538 PolarHBondContact O-N 3.08Å; I535-V538 WeakPolarHBondContact O-CG1 3.28Å; V538-Y540 VanDerWaalsContact C-N 3.29Å; V538-Y540 PolarHBondContact O-N 3.45Å; V538-A541 PolarHBondContact O-N 3.06Å; V538-L542 WeakPolarHBondContact O-CG 3.45Å; V538-L542 PolarHBondContact O-N 3Å; V538-M581 HydrophobicContact CB-CE 3.93Å; V538-M581 HydrophobicContact CB-SD 3.94Å; V538-T592 HydrophobicContact CB-CG2 4.28Å; V538-T592 HydrophobicContact CG1-CG2 3.57Å; V538-F593 HydrophobicContact CG2-CE1 4.3Å
539	C	94.3	Very high	92.1	Very high	1 Å²	1	14.1 Å²	14.1	1%	0.007	7%	0.073	C	C	.	.	H	α-helix	trans	-62.2	-39.3	171.5	-167.7	0	0	0	0	110.9	I234 F238 M369 I535 F536 L537 L542 I543	I234-C539 HydrophobicContact CD1-CB 4.35Å; I234-C539 HydrophobicContact CG1-CB 4.03Å; F238-C539 HydrophobicContact CD2-CB 4.1Å; F238-C539 HydrophobicContact CE2-CB 4.33Å; M369-C539 HydrophobicContact CE-CB 4.07Å; M369-C539 WeakPolarHBondContact CE-SG 3.5Å; I535-C539 PolarHBondContact O-N 3.43Å; F536-C539 VanDerWaalsContact O-CB 3.28Å; F536-C539 WeakPolarHBondContact O-CB 3.42Å; F536-C539 PolarHBondContact O-N 3.11Å; L537-C539 VanDerWaalsContact C-N 3.27Å; L537-C539 PolarHBondContact O-N 3.32Å; C539-L542 PolarHBondContact O-N 3.27Å; C539-I543 WeakPolarHBondContact O-CG1 3.45Å; C539-I543 PolarHBondContact O-N 3.44Å
540	Y	95.3	Very high	92.5	Very high	0 Å²	0	13.7 Å²	13.7	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-69.5	-42.8	179.1	-66.6	8.3	0	0	0	110.7	T200 T366 I368 M369 F536 L537 V538 L542 I543 N544 C577	T200-Y540 HydrophobicContact CG2-CD1 4.15Å; T200-Y540 HydrophobicContact CG2-CD2 4.1Å; T200-Y540 HydrophobicContact CG2-CG 3.73Å; T366-Y540 WeakPolarHBondContact CA-OH 3.32Å; T366-Y540 PolarHBondContact O-OH 3.07Å; I368-Y540 HydrophobicContact CD1-CD2 4.43Å; I368-Y540 HydrophobicContact CD1-CE1 4.38Å; I368-Y540 HydrophobicContact CD1-CE2 3.87Å; I368-Y540 HydrophobicContact CG1-CE1 4.28Å; I368-Y540 HydrophobicContact CG1-CE2 4.02Å; I368-Y540 WeakPolarHBondContact CG1-OH 3.23Å; M369-Y540 HydrophobicContact CE-CD1 3.08Å; M369-Y540 HydrophobicContact CE-CE1 3.16Å; M369-Y540 HydrophobicContact CE-CG 4.34Å; M369-Y540 HydrophobicContact CG-CE1 3.68Å; M369-Y540 HydrophobicContact SD-CE1 4.16Å; F536-Y540 HydrophobicContact CB-CE1 4.42Å; F536-Y540 HydrophobicContact CD1-CE1 4.29Å; F536-Y540 WeakPolarHBondContact O-CD1 3.44Å; F536-Y540 WeakPolarHBondContact O-CE1 3.42Å; F536-Y540 PolarHBondContact O-N 3.18Å; L537-Y540 WeakPolarHBondContact O-CB 3.36Å; L537-Y540 PolarHBondContact O-N 3.14Å; L537-Y540 VanDerWaalsContact O-N 3.1Å; V538-Y540 VanDerWaalsContact C-N 3.29Å; V538-Y540 PolarHBondContact O-N 3.45Å; Y540-L542 VanDerWaalsContact C-N 3.29Å; Y540-L542 PolarHBondContact O-N 2.97Å; Y540-I543 PolarHBondContact O-N 2.54Å; Y540-N544 WeakPolarHBondContact O-CB 3.35Å; Y540-N544 PolarHBondContact O-N 3.3Å; Y540-N544 PolarHBondContact O-ND2 2.87Å; Y540-C577 VanDerWaalsContact CB-SG 3.59Å
541	A	96.1	Very high	92.9	Very high	8 Å²	8	13.3 Å²	13.3	7%	0.066	7%	0.068	C	C	.	.	H	α-helix	trans	-57	-44.2	174.8	0	0	0	0	0	111.1	L537 V538 N544 Y545 A574 C577 V578	L537-A541 WeakPolarHBondContact O-CB 3.25Å; L537-A541 PolarHBondContact O-N 3.49Å; V538-A541 PolarHBondContact O-N 3.06Å; A541-N544 PolarHBondContact O-N 3.08Å; A541-Y545 VanDerWaalsContact O-CB 3.26Å; A541-Y545 WeakPolarHBondContact O-CB 3.35Å; A541-Y545 PolarHBondContact O-N 3.15Å; A541-A574 WeakPolarHBondContact O-CB 3.22Å; A541-C577 HydrophobicContact CB-CB 3.82Å; A541-V578 HydrophobicContact CB-CG2 4.03Å
542	L	95.3	Very high	93.2	Very high	24 Å²	24	15.8 Å²	15.8	13%	0.126	8%	0.077	C	C	.	.	H	α-helix	trans	-71.7	-34.2	178.5	-72.1	179.3	0	0	0	113.8	I222 L226 F230 I234 V538 C539 Y540 A546	I222-L542 HydrophobicContact CD1-CB 4.04Å; L226-L542 HydrophobicContact CD1-CD2 4.22Å; F230-L542 HydrophobicContact CD1-CD2 4.18Å; I234-L542 HydrophobicContact CB-CD1 3.91Å; I234-L542 HydrophobicContact CD1-CD1 3.96Å; I234-L542 HydrophobicContact CG1-CD1 3.87Å; I234-L542 HydrophobicContact CG2-CD1 4.34Å; V538-L542 WeakPolarHBondContact O-CG 3.45Å; V538-L542 PolarHBondContact O-N 3Å; C539-L542 PolarHBondContact O-N 3.27Å; Y540-L542 VanDerWaalsContact C-N 3.29Å; Y540-L542 PolarHBondContact O-N 2.97Å; L542-A546 WeakPolarHBondContact O-CB 3.38Å; L542-A546 PolarHBondContact O-N 3.18Å
543	I	94.4	Very high	93.1	Very high	0 Å²	0	15.5 Å²	15.5	0%	0	8%	0.076	C	C	.	.	H	α-helix	trans	-62	-47.5	171.3	-73.1	-174	0	0	0	110.5	M204 I207 A218 M221 I222 M369 C539 Y540 A546 V547	M204-I543 HydrophobicContact CB-CG2 4.26Å; M204-I543 HydrophobicContact CE-CD1 3.71Å; I207-I543 HydrophobicContact CD1-CG2 4.21Å; A218-I543 HydrophobicContact CB-CD1 4.22Å; M221-I543 HydrophobicContact CE-CD1 4.42Å; I222-I543 HydrophobicContact CD1-CG1 3.91Å; I222-I543 HydrophobicContact CG1-CG1 3.89Å; M369-I543 HydrophobicContact CE-CD1 3.34Å; M369-I543 HydrophobicContact CE-CG1 4.31Å; M369-I543 HydrophobicContact SD-CD1 3.93Å; C539-I543 WeakPolarHBondContact O-CG1 3.45Å; C539-I543 PolarHBondContact O-N 3.44Å; Y540-I543 PolarHBondContact O-N 2.54Å; I543-A546 PolarHBondContact O-N 3.43Å; I543-V547 PolarHBondContact O-N 3.26Å
544	N	96.7	Very high	92.8	Very high	0 Å²	0	18 Å²	18	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-61.9	-46.9	178.3	-80.8	-29.3	0	0	0	111.3	T200 S203 Y540 A541 A546 V547 F548 A570 A574	T200-N544 WeakPolarHBondContact CA-OD1 3.25Å; T200-N544 PolarHBondContact OG1-ND2 2.88Å; S203-N544 WeakPolarHBondContact CB-OD1 3.35Å; S203-N544 PolarHBondContact OG-OD1 2.88Å; Y540-N544 WeakPolarHBondContact O-CB 3.35Å; Y540-N544 PolarHBondContact O-N 3.3Å; Y540-N544 PolarHBondContact O-ND2 2.87Å; A541-N544 PolarHBondContact O-N 3.08Å; N544-A546 PolarHBondContact O-N 3.14Å; N544-V547 PolarHBondContact O-N 3.42Å; N544-F548 PolarHBondContact O-N 3.03Å; N544-F548 VanDerWaalsContact O-N 3.16Å; N544-A570 WeakPolarHBondContact CB-O 3.45Å; N544-A570 WeakPolarHBondContact O-CB 3.44Å; N544-A574 HydrophobicContact CB-CB 3.8Å
545	Y	96.1	Very high	92.2	Very high	88 Å²	88	19.7 Å²	19.7	35%	0.345	11%	0.114	S	C	.	.	H	α-helix	trans	-64	-39.1	176.7	-177.4	-105.3	0	0	0	112.4	L226 A541 V547 F548 D549	L226-Y545 HydrophobicContact CD1-CD1 4.02Å; L226-Y545 HydrophobicContact CD2-CD1 4.02Å; L226-Y545 HydrophobicContact CD2-CE1 4.04Å; A541-Y545 VanDerWaalsContact O-CB 3.26Å; A541-Y545 WeakPolarHBondContact O-CB 3.35Å; A541-Y545 PolarHBondContact O-N 3.15Å; Y545-V547 VanDerWaalsContact C-N 3.32Å; Y545-V547 PolarHBondContact O-N 2.58Å; Y545-F548 HydrophobicContact CD2-CD1 4.11Å; Y545-F548 HydrophobicContact CE2-CD1 4.01Å; Y545-F548 HydrophobicContact CE2-CE1 4.37Å; Y545-F548 PolarHBondContact O-N 3.46Å; Y545-D549 HydrophobicContact CE1-CB 4.16Å; Y545-D549 WeakPolarHBondContact O-CB 3.44Å; Y545-D549 PolarHBondContact O-N 3.13Å
546	A	92.9	Very high	91.7	Very high	0 Å²	0	25.3 Å²	25.3	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.1	-41.5	177.1	0	0	0	0	0	112.4	I207 L226 L542 I543 N544 A550	I207-A546 HydrophobicContact CD1-CB 3.99Å; L226-A546 HydrophobicContact CD1-CB 4.01Å; L226-A546 HydrophobicContact CD2-CB 4.25Å; L226-A546 HydrophobicContact CG-CB 3.8Å; L542-A546 WeakPolarHBondContact O-CB 3.38Å; L542-A546 PolarHBondContact O-N 3.18Å; I543-A546 PolarHBondContact O-N 3.43Å; N544-A546 PolarHBondContact O-N 3.14Å; A546-A550 WeakPolarHBondContact O-CB 3.27Å; A546-A550 PolarHBondContact O-N 3.48Å
547	V	93.9	Very high	91.1	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-66.4	-44.4	175.3	172.9	0	0	0	0	111.6	S203 A206 I207 I543 N544 Y545 S551 F558 Y565 A570	S203-V547 VanDerWaalsContact O-CG2 3.22Å; S203-V547 WeakPolarHBondContact O-CG2 3.47Å; A206-V547 HydrophobicContact CB-CG1 4.22Å; A206-V547 HydrophobicContact CB-CG2 4.16Å; I207-V547 HydrophobicContact CD1-CG2 3.77Å; I207-V547 HydrophobicContact CG1-CG2 3.41Å; I207-V547 VanDerWaalsContact CG1-CG2 3.41Å; I543-V547 PolarHBondContact O-N 3.26Å; N544-V547 PolarHBondContact O-N 3.42Å; Y545-V547 VanDerWaalsContact C-N 3.32Å; Y545-V547 PolarHBondContact O-N 2.58Å; V547-S551 WeakPolarHBondContact O-CB 3.31Å; V547-S551 PolarHBondContact O-N 3.4Å; V547-F558 HydrophobicContact CG1-CZ 4.33Å; V547-Y565 HydrophobicContact CG1-CD2 3.6Å; V547-Y565 HydrophobicContact CG1-CE2 4.03Å; V547-A570 HydrophobicContact CB-CB 4.1Å; V547-A570 HydrophobicContact CG1-CB 4.04Å
548	F	95.6	Very high	90.8	Very high	23 Å²	23	28.7 Å²	28.7	10%	0.101	18%	0.181	C	C	.	.	H	α-helix	trans	-58.2	-54.7	176.4	166.3	-104.5	0	0	0	111	N544 Y545 S551 F552 Q567 W568 A570 L571	N544-F548 PolarHBondContact O-N 3.03Å; N544-F548 VanDerWaalsContact O-N 3.16Å; Y545-F548 HydrophobicContact CD2-CD1 4.11Å; Y545-F548 HydrophobicContact CE2-CD1 4.01Å; Y545-F548 HydrophobicContact CE2-CE1 4.37Å; Y545-F548 PolarHBondContact O-N 3.46Å; F548-S551 PolarHBondContact O-N 2.98Å; F548-F552 HydrophobicContact CE2-CB 4.35Å; F548-F552 HydrophobicContact CE2-CD2 4.48Å; F548-F552 HydrophobicContact CE2-CG 4.49Å; F548-F552 HydrophobicContact CZ-CB 4.37Å; F548-F552 HydrophobicContact CZ-CD2 4.48Å; F548-F552 HydrophobicContact CZ-CG 4.27Å; F548-F552 WeakPolarHBondContact O-CB 3.38Å; F548-F552 PolarHBondContact O-N 3.38Å; F548-Q567 HydrophobicContact CD2-CB 4.22Å; F548-Q567 WeakPolarHBondContact CD2-O 3.45Å; F548-W568 HydrophobicContact CE2-CE3 4.11Å; F548-W568 HydrophobicContact CE2-CH2 4.38Å; F548-W568 AromaticContact CE2-CZ3 3.9Å; F548-W568 HydrophobicContact CE2-CZ3 3.9Å; F548-W568 HydrophobicContact CZ-CZ3 4.46Å; F548-A570 HydrophobicContact CB-CB 4.45Å; F548-L571 HydrophobicContact CB-CB 4.29Å; F548-L571 HydrophobicContact CD1-CD1 3.97Å; F548-L571 HydrophobicContact CD2-CB 3.81Å; F548-L571 HydrophobicContact CD2-CD2 4.3Å; F548-L571 HydrophobicContact CD2-CG 4.46Å; F548-L571 HydrophobicContact CE1-CD1 4.12Å; F548-L571 HydrophobicContact CE1-CD2 4.41Å; F548-L571 HydrophobicContact CE2-CB 4.29Å; F548-L571 HydrophobicContact CE2-CD2 3.92Å; F548-L571 HydrophobicContact CG-CB 3.94Å; F548-L571 HydrophobicContact CG-CD1 4.22Å; F548-L571 HydrophobicContact CZ-CD1 4.5Å; F548-L571 HydrophobicContact CZ-CD2 3.98Å
549	D	93.1	Very high	90.5	Very high	15 Å²	15	37.9 Å²	37.9	8%	0.08	22%	0.215	C	C	.	.	H	α-helix	trans	-67.6	-41.5	-173.9	-172.9	38.6	0	0	0	112.2	L226 Y545 S551 F552 A553 S615 H619	L226-D549 HydrophobicContact CD2-CB 4.24Å; Y545-D549 HydrophobicContact CE1-CB 4.16Å; Y545-D549 WeakPolarHBondContact O-CB 3.44Å; Y545-D549 PolarHBondContact O-N 3.13Å; D549-S551 PolarHBondContact O-N 3.07Å; D549-F552 PolarHBondContact O-N 3.43Å; D549-A553 VanDerWaalsContact O-CB 3.28Å; D549-A553 WeakPolarHBondContact O-CB 3.43Å; D549-A553 PolarHBondContact O-N 3.31Å; D549-S615 WeakPolarHBondContact OD2-CB 3.49Å; D549-S615 PolarHBondContact OD2-OG 2.93Å; D549-H619 IonicContact OD1-CD2 3.36Å; D549-H619 IonicContact OD1-CE1 2.72Å; D549-H619 IonicContact OD1-NE2 2.85Å; D549-H619 PolarHBondContact OD1-NE2 3.37Å
550	A	88.9	Confident	90.2	Very high	8 Å²	8	39 Å²	39	7%	0.066	22%	0.222	C	C	.	.	H	α-helix	trans	-63	-41.5	175.5	0	0	0	0	0	112.1	A546 F558	A546-A550 WeakPolarHBondContact O-CB 3.27Å; A546-A550 PolarHBondContact O-N 3.48Å; A550-F558 HydrophobicContact CB-CB 4.39Å; A550-F558 HydrophobicContact CB-CD1 4.39Å; A550-F558 HydrophobicContact CB-CD2 3.59Å; A550-F558 HydrophobicContact CB-CE2 3.89Å; A550-F558 HydrophobicContact CB-CG 3.87Å; A550-F558 HydrophobicContact CB-CZ 4.4Å
551	S	90.1	Very high	89.8	Confident	26 Å²	26	43.5 Å²	43.5	18%	0.182	25%	0.254	C	S	.	.	H	α-helix	trans	-68.6	-37.7	175.5	-172.9	0	0	0	0	112.2	V547 F548 D549 G554	V547-S551 WeakPolarHBondContact O-CB 3.31Å; V547-S551 PolarHBondContact O-N 3.4Å; F548-S551 PolarHBondContact O-N 2.98Å; D549-S551 PolarHBondContact O-N 3.07Å; S551-G554 PolarHBondContact O-N 3.19Å
552	F	90.6	Very high	89.5	Confident	102 Å²	102	44.6 Å²	44.6	45%	0.447	26%	0.257	S	S	.	.	H	α-helix	trans	-75.6	-35.5	-177.4	-174.7	-105.1	0	0	0	112.6	F548 D549 G554 H619	F548-F552 HydrophobicContact CE2-CB 4.35Å; F548-F552 HydrophobicContact CE2-CD2 4.48Å; F548-F552 HydrophobicContact CE2-CG 4.49Å; F548-F552 HydrophobicContact CZ-CB 4.37Å; F548-F552 HydrophobicContact CZ-CD2 4.48Å; F548-F552 HydrophobicContact CZ-CG 4.27Å; F548-F552 WeakPolarHBondContact O-CB 3.38Å; F548-F552 PolarHBondContact O-N 3.38Å; D549-F552 PolarHBondContact O-N 3.43Å; F552-G554 PolarHBondContact O-N 3.01Å; F552-H619 AromaticContact CD1-CE1 3.76Å
553	A	85.8	Confident	89.1	Confident	6 Å²	6	54.1 Å²	54.1	5%	0.05	29%	0.291	C	S	.	.	H	α-helix	trans	-56.9	-28.7	171.1	0	0	0	0	0	111.9	D549 S555 A618 H619	D549-A553 VanDerWaalsContact O-CB 3.28Å; D549-A553 WeakPolarHBondContact O-CB 3.43Å; D549-A553 PolarHBondContact O-N 3.31Å; A553-S555 PolarHBondContact O-N 2.8Å; A553-A618 HydrophobicContact CB-CB 4.23Å; A553-H619 VanDerWaalsContact CA-CE1 3.45Å; A553-H619 WeakPolarHBondContact CA-CE1 3.03Å
554	G	82	Confident	88.8	Confident	53 Å²	53	62.9 Å²	62.9	55%	0.546	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.4	30.2	-179.1	0	0	0	0	0	112	S551 F552	S551-G554 PolarHBondContact O-N 3.19Å; F552-G554 PolarHBondContact O-N 3.01Å
555	S	81.3	Confident	88.5	Confident	36 Å²	36	65.7 Å²	65.7	25%	0.252	34%	0.336	S	S	.	.			trans	-70.1	131.5	179.2	70.9	0	0	0	0	109.6	A553 G557 F558	A553-S555 PolarHBondContact O-N 2.8Å; S555-G557 PolarHBondContact O-N 2.72Å; S555-F558 PolarHBondContact O-N 3.31Å
556	P	80.9	Confident	88.4	Confident	126 Å²	126	65.5 Å²	65.5	82%	0.818	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.3	-19.1	179.9	-26.2	34.7	0	0	0	114.3	F558	P556-F558 VanDerWaalsContact C-N 3.29Å
557	G	80.7	Confident	88.4	Confident	54 Å²	54	68 Å²	68	56%	0.557	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-21.9	176.1	0	0	0	0	0	113.8	N210 S555 R559	N210-G557 PolarHBondContact ND2-O 2.98Å; N210-G557 PolarHBondContact OD1-O 3.2Å; N210-G557 VanDerWaalsContact OD1-O 3.06Å; S555-G557 PolarHBondContact O-N 2.72Å; G557-R559 PolarHBondContact O-N 3.21Å
558	F	87.1	Confident	88.6	Confident	25 Å²	25	74.6 Å²	74.6	11%	0.11	38%	0.378	C	S	.	.			trans	-90.1	95.5	176.2	-169.3	-102.3	0	0	0	110.9	N210 V547 A550 S555 P556 P560 Y565	N210-F558 HydrophobicContact CB-CD2 4.36Å; N210-F558 HydrophobicContact CB-CE2 4.36Å; N210-F558 WeakPolarHBondContact ND2-CD2 3.33Å; N210-F558 WeakPolarHBondContact OD1-CA 3.21Å; V547-F558 HydrophobicContact CG1-CZ 4.33Å; A550-F558 HydrophobicContact CB-CB 4.39Å; A550-F558 HydrophobicContact CB-CD1 4.39Å; A550-F558 HydrophobicContact CB-CD2 3.59Å; A550-F558 HydrophobicContact CB-CE2 3.89Å; A550-F558 HydrophobicContact CB-CG 3.87Å; A550-F558 HydrophobicContact CB-CZ 4.4Å; S555-F558 PolarHBondContact O-N 3.31Å; P556-F558 VanDerWaalsContact C-N 3.29Å; F558-P560 HydrophobicContact CD1-CG 4.07Å; F558-P560 HydrophobicContact CD2-CG 4.43Å; F558-P560 HydrophobicContact CE1-CG 3.51Å; F558-P560 HydrophobicContact CE2-CG 3.91Å; F558-P560 HydrophobicContact CZ-CG 3.41Å; F558-P560 VanDerWaalsContact CZ-CG 3.41Å; F558-Y565 AromaticContact CE1-CE2 3.91Å; F558-Y565 HydrophobicContact CE1-CE2 3.91Å; F558-Y565 AromaticContact CE1-CZ 3.85Å; F558-Y565 WeakPolarHBondContact CE1-OH 3.46Å; F558-Y565 HydrophobicContact CZ-CE2 4.33Å
559	R	88.7	Confident	88.6	Confident	201 Å²	201	76.3 Å²	76.3	76%	0.758	39%	0.39	S	S	*	.			trans	-135.5	67.2	-178.4	51.7	175	-178.2	-173.5	-0.5	112.1	N210 G557 S561	N210-R559 PolarHBondContact OD1-N 2.87Å; G557-R559 PolarHBondContact O-N 3.21Å; R559-S561 PolarHBondContact O-N 3.34Å
560	P	88.9	Confident	88.8	Confident	24 Å²	24	75.7 Å²	75.7	16%	0.156	39%	0.387	C	S	.	.			trans	-56.5	135.9	179.4	-25	35.5	0	0	0	112.5	A206 N210 F558 F562 Y565	A206-P560 HydrophobicContact CB-CB 4.32Å; A206-P560 HydrophobicContact CB-CG 4.27Å; A206-P560 WeakPolarHBondContact O-CB 3.47Å; N210-P560 HydrophobicContact CB-CG 4.37Å; F558-P560 HydrophobicContact CD1-CG 4.07Å; F558-P560 HydrophobicContact CD2-CG 4.43Å; F558-P560 HydrophobicContact CE1-CG 3.51Å; F558-P560 HydrophobicContact CE2-CG 3.91Å; F558-P560 HydrophobicContact CZ-CG 3.41Å; F558-P560 VanDerWaalsContact CZ-CG 3.41Å; P560-F562 VanDerWaalsContact C-N 3.33Å; P560-Y565 HydrophobicContact CB-CD1 4.31Å; P560-Y565 HydrophobicContact CB-CE1 3.81Å; P560-Y565 HydrophobicContact CG-CD1 4.46Å; P560-Y565 HydrophobicContact CG-CE1 3.72Å
561	S	86.9	Confident	89.2	Confident	95 Å²	95	77.4 Å²	77.4	66%	0.664	40%	0.395	S	S	*	.	S	Bend	trans	-76.2	-25.3	169.5	-59.1	0	0	0	0	112.1	T209 R559 R563	T209-S561 PolarHBondContact O-N 3.04Å; T209-S561 PolarHBondContact OG1-N 3.38Å; R559-S561 PolarHBondContact O-N 3.34Å; S561-R563 PolarHBondContact O-N 2.95Å
562	F	88.9	Confident	89.5	Confident	30 Å²	30	80.7 Å²	80.7	13%	0.132	41%	0.409	C	S	.	.			trans	-72	123.5	175.4	-172.3	-103.2	0	0	0	110.6	L202 C205 T209 P386 L390 P560 Y564 Y565	L202-F562 HydrophobicContact CD2-CE1 3.7Å; L202-F562 HydrophobicContact CD2-CZ 3.68Å; C205-F562 HydrophobicContact CB-CB 4.4Å; C205-F562 HydrophobicContact CB-CD1 3.61Å; C205-F562 HydrophobicContact CB-CD2 3.98Å; C205-F562 HydrophobicContact CB-CE1 3.72Å; C205-F562 HydrophobicContact CB-CE2 4.08Å; C205-F562 HydrophobicContact CB-CG 3.74Å; C205-F562 HydrophobicContact CB-CZ 3.95Å; T209-F562 HydrophobicContact CG2-CB 3.96Å; T209-F562 VanDerWaalsContact OG1-CB 3.28Å; T209-F562 WeakPolarHBondContact OG1-CB 3.38Å; T209-F562 PolarHBondContact OG1-N 3.45Å; P386-F562 HydrophobicContact CB-CD2 4.48Å; P386-F562 HydrophobicContact CB-CE2 4.43Å; L390-F562 HydrophobicContact CD1-CE2 4.4Å; L390-F562 HydrophobicContact CD1-CZ 4.23Å; P560-F562 VanDerWaalsContact C-N 3.33Å; F562-Y564 HydrophobicContact CE2-CD2 4.11Å; F562-Y564 HydrophobicContact CZ-CD2 4.03Å; F562-Y564 HydrophobicContact CZ-CG 4.4Å; F562-Y565 VanDerWaalsContact O-CD1 3.29Å; F562-Y565 WeakPolarHBondContact O-CD1 3.34Å
563	R	86.9	Confident	89.8	Confident	225 Å²	225	75.8 Å²	75.8	85%	0.849	39%	0.388	S	S	*	.			trans	-93.6	-17.7	-171.1	-62.2	-176.6	-179.1	-176.3	-1.2	114.8	S561 Y565	S561-R563 PolarHBondContact O-N 2.95Å; R563-Y565 VanDerWaalsContact C-N 3.26Å; R563-Y565 PolarHBondContact O-N 2.9Å
564	Y	88	Confident	90.4	Very high	184 Å²	184	76 Å²	76	72%	0.722	39%	0.389	S	S	*	.	S	Bend	trans	-91.1	30.5	-172.3	-56.4	-72.1	0	0	0	113.5	F562	F562-Y564 HydrophobicContact CE2-CD2 4.11Å; F562-Y564 HydrophobicContact CZ-CD2 4.03Å; F562-Y564 HydrophobicContact CZ-CG 4.4Å
565	Y	91.3	Very high	91.1	Very high	59 Å²	59	78.7 Å²	78.7	23%	0.231	39%	0.391	C	S	.	.			trans	-107.3	154.6	172.5	86.7	-81.7	0	0	0	110.3	A206 V547 F558 P560 F562 R563	A206-Y565 HydrophobicContact CB-CD1 3.85Å; A206-Y565 HydrophobicContact CB-CD2 3.97Å; A206-Y565 HydrophobicContact CB-CE1 4.48Å; A206-Y565 HydrophobicContact CB-CG 3.57Å; V547-Y565 HydrophobicContact CG1-CD2 3.6Å; V547-Y565 HydrophobicContact CG1-CE2 4.03Å; F558-Y565 AromaticContact CE1-CE2 3.91Å; F558-Y565 HydrophobicContact CE1-CE2 3.91Å; F558-Y565 AromaticContact CE1-CZ 3.85Å; F558-Y565 WeakPolarHBondContact CE1-OH 3.46Å; F558-Y565 HydrophobicContact CZ-CE2 4.33Å; P560-Y565 HydrophobicContact CB-CD1 4.31Å; P560-Y565 HydrophobicContact CB-CE1 3.81Å; P560-Y565 HydrophobicContact CG-CD1 4.46Å; P560-Y565 HydrophobicContact CG-CE1 3.72Å; F562-Y565 VanDerWaalsContact O-CD1 3.29Å; F562-Y565 WeakPolarHBondContact O-CD1 3.34Å; R563-Y565 VanDerWaalsContact C-N 3.26Å; R563-Y565 PolarHBondContact O-N 2.9Å
566	N	94.1	Very high	91.8	Very high	83 Å²	83	80.3 Å²	80.3	44%	0.444	40%	0.396	S	S	.	.			trans	-141.4	132.4	173.2	-177.7	-47.4	0	0	0	108.8	W568 V569 A570	N566-W568 VanDerWaalsContact C-N 3.3Å; N566-W568 PolarHBondContact O-N 3.48Å; N566-W568 PolarHBondContact OD1-N 3.15Å; N566-V569 HydrophobicContact CB-CB 4.12Å; N566-V569 HydrophobicContact CB-CG2 3.87Å; N566-V569 PolarHBondContact O-N 3.2Å; N566-A570 PolarHBondContact O-N 3.24Å
567	Q	93.2	Very high	92.5	Very high	52 Å²	52	74.3 Å²	74.3	24%	0.243	36%	0.357	C	S	.	.	H	α-helix	trans	-57.9	-38	-177.3	68.8	-173.4	-69.2	0	0	113.3	F548 A570 L571	F548-Q567 HydrophobicContact CD2-CB 4.22Å; F548-Q567 WeakPolarHBondContact CD2-O 3.45Å; Q567-A570 WeakPolarHBondContact O-CB 3.03Å; Q567-A570 PolarHBondContact O-N 3.45Å; Q567-L571 PolarHBondContact O-N 2.89Å
568	W	96.9	Very high	93.2	Very high	139 Å²	139	74 Å²	74	53%	0.527	34%	0.344	S	S	.	.	H	α-helix	trans	-75.9	-36.2	-178.5	-61.5	111.6	0	0	0	112.2	F548 N566 A570 L571 I572	F548-W568 HydrophobicContact CE2-CE3 4.11Å; F548-W568 HydrophobicContact CE2-CH2 4.38Å; F548-W568 AromaticContact CE2-CZ3 3.9Å; F548-W568 HydrophobicContact CE2-CZ3 3.9Å; F548-W568 HydrophobicContact CZ-CZ3 4.46Å; N566-W568 VanDerWaalsContact C-N 3.3Å; N566-W568 PolarHBondContact O-N 3.48Å; N566-W568 PolarHBondContact OD1-N 3.15Å; W568-A570 VanDerWaalsContact C-N 3.27Å; W568-A570 PolarHBondContact O-N 3.1Å; W568-L571 HydrophobicContact CE3-CD2 4.01Å; W568-L571 HydrophobicContact CZ3-CD2 4.03Å; W568-L571 PolarHBondContact O-N 3.39Å; W568-I572 WeakPolarHBondContact O-CG1 3.45Å; W568-I572 PolarHBondContact O-N 2.85Å
569	V	96.4	Very high	93.5	Very high	60 Å²	60	75.2 Å²	75.2	36%	0.364	36%	0.359	S	S	.	.	H	α-helix	trans	-63.7	-38.7	172.3	177.6	0	0	0	0	110	I199 N566 I572 G573	I199-V569 HydrophobicContact CG1-CG1 4.06Å; I199-V569 HydrophobicContact CG2-CG1 4.07Å; N566-V569 HydrophobicContact CB-CB 4.12Å; N566-V569 HydrophobicContact CB-CG2 3.87Å; N566-V569 PolarHBondContact O-N 3.2Å; V569-I572 PolarHBondContact O-N 2.89Å; V569-G573 PolarHBondContact O-N 3.41Å
570	A	96.4	Very high	93.7	Very high	2 Å²	2	66.5 Å²	66.5	2%	0.017	33%	0.327	C	S	.	.	H	α-helix	trans	-63.9	-44.4	173.5	0	0	0	0	0	111.5	N544 V547 F548 N566 Q567 W568 I572 G573 A574	N544-A570 WeakPolarHBondContact CB-O 3.45Å; N544-A570 WeakPolarHBondContact O-CB 3.44Å; V547-A570 HydrophobicContact CB-CB 4.1Å; V547-A570 HydrophobicContact CG1-CB 4.04Å; F548-A570 HydrophobicContact CB-CB 4.45Å; N566-A570 PolarHBondContact O-N 3.24Å; Q567-A570 WeakPolarHBondContact O-CB 3.03Å; Q567-A570 PolarHBondContact O-N 3.45Å; W568-A570 VanDerWaalsContact C-N 3.27Å; W568-A570 PolarHBondContact O-N 3.1Å; A570-I572 PolarHBondContact O-N 3.42Å; A570-G573 CarbonylContact O-C 3.47Å; A570-G573 WeakPolarHBondContact O-CA 3.13Å; A570-G573 PolarHBondContact O-N 2.89Å; A570-G573 VanDerWaalsContact O-N 3.13Å; A570-A574 PolarHBondContact O-N 3.46Å
571	L	97.4	Very high	93.9	Very high	43 Å²	43	65.3 Å²	65.3	23%	0.225	32%	0.32	C	S	.	.	H	α-helix	trans	-59.5	-46.5	175	-177.9	62.4	0	0	0	112.3	F548 Q567 W568 G573 A574 L575	F548-L571 HydrophobicContact CB-CB 4.29Å; F548-L571 HydrophobicContact CD1-CD1 3.97Å; F548-L571 HydrophobicContact CD2-CB 3.81Å; F548-L571 HydrophobicContact CD2-CD2 4.3Å; F548-L571 HydrophobicContact CD2-CG 4.46Å; F548-L571 HydrophobicContact CE1-CD1 4.12Å; F548-L571 HydrophobicContact CE1-CD2 4.41Å; F548-L571 HydrophobicContact CE2-CB 4.29Å; F548-L571 HydrophobicContact CE2-CD2 3.92Å; F548-L571 HydrophobicContact CG-CB 3.94Å; F548-L571 HydrophobicContact CG-CD1 4.22Å; F548-L571 HydrophobicContact CZ-CD1 4.5Å; F548-L571 HydrophobicContact CZ-CD2 3.98Å; Q567-L571 PolarHBondContact O-N 2.89Å; W568-L571 HydrophobicContact CE3-CD2 4.01Å; W568-L571 HydrophobicContact CZ3-CD2 4.03Å; W568-L571 PolarHBondContact O-N 3.39Å; L571-G573 VanDerWaalsContact C-N 3.28Å; L571-G573 PolarHBondContact O-N 3.34Å; L571-A574 WeakPolarHBondContact O-CB 3.13Å; L571-A574 PolarHBondContact O-N 2.87Å; L571-A574 VanDerWaalsContact O-N 3.15Å; L571-L575 WeakPolarHBondContact O-CG 3.21Å; L571-L575 PolarHBondContact O-N 3.42Å
572	I	97.3	Very high	94.2	Very high	95 Å²	95	64.9 Å²	64.9	49%	0.487	31%	0.306	S	S	.	.	H	α-helix	trans	-59.1	-43.2	174.6	-68.7	167.2	0	0	0	110.1	W568 V569 A570 A574 L575 L576	W568-I572 WeakPolarHBondContact O-CG1 3.45Å; W568-I572 PolarHBondContact O-N 2.85Å; V569-I572 PolarHBondContact O-N 2.89Å; A570-I572 PolarHBondContact O-N 3.42Å; I572-A574 VanDerWaalsContact C-N 3.33Å; I572-A574 PolarHBondContact O-N 3.02Å; I572-L575 PolarHBondContact O-N 3.31Å; I572-L576 HydrophobicContact CG2-CD1 3.78Å; I572-L576 HydrophobicContact CG2-CG 4.12Å; I572-L576 WeakPolarHBondContact O-CB 3.18Å; I572-L576 VanDerWaalsContact O-CG 3.27Å; I572-L576 WeakPolarHBondContact O-CG 3.47Å; I572-L576 PolarHBondContact O-N 3.4Å
573	G	96.8	Very high	94.2	Very high	0 Å²	0	66.4 Å²	66.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-57.6	-42.2	174.4	0	0	0	0	0	113.1	V569 A570 L571 L576 C577	V569-G573 PolarHBondContact O-N 3.41Å; A570-G573 CarbonylContact O-C 3.47Å; A570-G573 WeakPolarHBondContact O-CA 3.13Å; A570-G573 PolarHBondContact O-N 2.89Å; A570-G573 VanDerWaalsContact O-N 3.13Å; L571-G573 VanDerWaalsContact C-N 3.28Å; L571-G573 PolarHBondContact O-N 3.34Å; G573-L576 PolarHBondContact O-N 3.42Å; G573-C577 PolarHBondContact O-N 3.02Å; G573-C577 PolarHBondContact O-SG 3.38Å
574	A	97.5	Very high	94.2	Very high	9 Å²	9	56.8 Å²	56.8	7%	0.074	28%	0.283	C	S	.	.	H	α-helix	trans	-63.4	-46.5	176.8	0	0	0	0	0	111.7	A541 N544 A570 L571 I572 C577 V578	A541-A574 WeakPolarHBondContact O-CB 3.22Å; N544-A574 HydrophobicContact CB-CB 3.8Å; A570-A574 PolarHBondContact O-N 3.46Å; L571-A574 WeakPolarHBondContact O-CB 3.13Å; L571-A574 PolarHBondContact O-N 2.87Å; L571-A574 VanDerWaalsContact O-N 3.15Å; I572-A574 VanDerWaalsContact C-N 3.33Å; I572-A574 PolarHBondContact O-N 3.02Å; A574-C577 PolarHBondContact O-N 3.4Å; A574-V578 WeakPolarHBondContact O-CG2 3.26Å; A574-V578 PolarHBondContact O-N 3.01Å; A574-V578 VanDerWaalsContact O-N 3.1Å
575	L	97.6	Very high	94.2	Very high	111 Å²	111	48.9 Å²	48.9	58%	0.581	26%	0.255	S	S	*	.	H	α-helix	trans	-64.3	-40.3	177.4	-64.9	175.7	0	0	0	112.1	L571 I572 V578 A579	L571-L575 WeakPolarHBondContact O-CG 3.21Å; L571-L575 PolarHBondContact O-N 3.42Å; I572-L575 PolarHBondContact O-N 3.31Å; L575-V578 PolarHBondContact O-N 2.77Å; L575-A579 WeakPolarHBondContact O-CB 3.38Å; L575-A579 PolarHBondContact O-N 3.17Å
576	L	95.3	Very high	94.2	Very high	70 Å²	70	53.8 Å²	53.8	37%	0.366	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-43	175.3	-75.3	174.5	0	0	0	111.6	I199 I572 G573 V578 A579 I580	I199-L576 HydrophobicContact CD1-CD1 4.44Å; I572-L576 HydrophobicContact CG2-CD1 3.78Å; I572-L576 HydrophobicContact CG2-CG 4.12Å; I572-L576 WeakPolarHBondContact O-CB 3.18Å; I572-L576 VanDerWaalsContact O-CG 3.27Å; I572-L576 WeakPolarHBondContact O-CG 3.47Å; I572-L576 PolarHBondContact O-N 3.4Å; G573-L576 PolarHBondContact O-N 3.42Å; L576-V578 VanDerWaalsContact C-N 3.34Å; L576-V578 PolarHBondContact O-N 3.34Å; L576-A579 PolarHBondContact O-N 3.27Å; L576-I580 VanDerWaalsContact O-CG1 3.28Å; L576-I580 WeakPolarHBondContact O-CG1 3.45Å; L576-I580 PolarHBondContact O-N 3.21Å
577	C	95.7	Very high	94.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-59.7	-44.8	175.2	-70.3	0	0	0	0	111.5	L537 Y540 A541 G573 A574 I580 M581	L537-C577 HydrophobicContact CD2-CB 4.06Å; Y540-C577 VanDerWaalsContact CB-SG 3.59Å; A541-C577 HydrophobicContact CB-CB 3.82Å; G573-C577 PolarHBondContact O-N 3.02Å; G573-C577 PolarHBondContact O-SG 3.38Å; A574-C577 PolarHBondContact O-N 3.4Å; C577-I580 PolarHBondContact O-N 3.22Å; C577-M581 WeakPolarHBondContact O-CG 3.43Å; C577-M581 PolarHBondContact O-N 3.11Å; C577-M581 VanDerWaalsContact O-N 3.07Å
578	V	95.9	Very high	93.9	Very high	46 Å²	46	54 Å²	54	28%	0.279	27%	0.266	S	S	.	.	H	α-helix	trans	-64	-44.2	176.2	173.9	0	0	0	0	111.2	A541 A574 L575 L576 I580 M581 F582 F593	A541-V578 HydrophobicContact CB-CG2 4.03Å; A574-V578 WeakPolarHBondContact O-CG2 3.26Å; A574-V578 PolarHBondContact O-N 3.01Å; A574-V578 VanDerWaalsContact O-N 3.1Å; L575-V578 PolarHBondContact O-N 2.77Å; L576-V578 VanDerWaalsContact C-N 3.34Å; L576-V578 PolarHBondContact O-N 3.34Å; V578-I580 VanDerWaalsContact C-N 3.32Å; V578-I580 PolarHBondContact O-N 3.32Å; V578-M581 WeakPolarHBondContact O-CB 3.48Å; V578-M581 PolarHBondContact O-N 3.32Å; V578-M581 VanDerWaalsContact O-N 3.15Å; V578-F582 HydrophobicContact CG1-CD2 4.18Å; V578-F582 HydrophobicContact CG1-CE2 3.98Å; V578-F582 WeakPolarHBondContact O-CD2 3.32Å; V578-F582 PolarHBondContact O-N 3.36Å; V578-F593 HydrophobicContact CG1-CE2 4.49Å; V578-F593 HydrophobicContact CG1-CZ 4.03Å; V578-F593 HydrophobicContact CG2-CZ 4.23Å
579	A	94.2	Very high	93.7	Very high	52 Å²	52	47.4 Å²	47.4	43%	0.43	24%	0.241	S	C	.	.	H	α-helix	trans	-58.9	-44.2	177	0	0	0	0	0	111.5	L575 L576 M581 F582 V583	L575-A579 WeakPolarHBondContact O-CB 3.38Å; L575-A579 PolarHBondContact O-N 3.17Å; L576-A579 PolarHBondContact O-N 3.27Å; A579-M581 VanDerWaalsContact C-N 3.31Å; A579-M581 PolarHBondContact O-N 3.01Å; A579-F582 PolarHBondContact O-N 3.25Å; A579-V583 WeakPolarHBondContact O-CG2 3.49Å; A579-V583 PolarHBondContact O-N 3.43Å
580	I	93	Very high	93.7	Very high	17 Å²	17	48.7 Å²	48.7	9%	0.087	25%	0.245	C	C	.	.	H	α-helix	trans	-61.8	-38.8	176.9	-68.8	166.2	0	0	0	111.3	V196 F358 Y362 L537 L576 C577 V578 F582 V583 L584	V196-I580 HydrophobicContact CB-CD1 4.39Å; V196-I580 HydrophobicContact CG1-CD1 4.16Å; V196-I580 HydrophobicContact CG2-CD1 3.71Å; F358-I580 HydrophobicContact CE1-CG1 4.24Å; F358-I580 HydrophobicContact CE1-CG2 3.88Å; F358-I580 HydrophobicContact CZ-CD1 4.12Å; F358-I580 HydrophobicContact CZ-CG1 4.3Å; F358-I580 HydrophobicContact CZ-CG2 4.43Å; Y362-I580 HydrophobicContact CD1-CG2 4.16Å; Y362-I580 HydrophobicContact CD2-CG2 4.4Å; Y362-I580 HydrophobicContact CE1-CG2 4.04Å; Y362-I580 HydrophobicContact CE2-CD1 4Å; Y362-I580 HydrophobicContact CE2-CG2 4.27Å; Y362-I580 HydrophobicContact CG-CG2 4.35Å; L537-I580 HydrophobicContact CD1-CB 4.26Å; L537-I580 HydrophobicContact CD1-CG2 3.63Å; L537-I580 HydrophobicContact CD2-CB 4.29Å; L537-I580 HydrophobicContact CD2-CG2 4.16Å; L576-I580 VanDerWaalsContact O-CG1 3.28Å; L576-I580 WeakPolarHBondContact O-CG1 3.45Å; L576-I580 PolarHBondContact O-N 3.21Å; C577-I580 PolarHBondContact O-N 3.22Å; V578-I580 VanDerWaalsContact C-N 3.32Å; V578-I580 PolarHBondContact O-N 3.32Å; I580-F582 VanDerWaalsContact C-N 3.28Å; I580-F582 PolarHBondContact O-N 3.38Å; I580-V583 PolarHBondContact O-N 3.38Å; I580-V583 VanDerWaalsContact O-N 3.12Å; I580-L584 HydrophobicContact CG2-CD1 4.29Å; I580-L584 HydrophobicContact CG2-CG 4.04Å; I580-L584 WeakPolarHBondContact O-CG 3.34Å; I580-L584 PolarHBondContact O-N 2.66Å
581	M	93	Very high	93.5	Very high	0 Å²	0	52.5 Å²	52.5	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-54.6	-45.2	175.6	-71.4	174.8	68	0	0	112.2	N534 L537 V538 C577 V578 A579 L584 S585 A589 T592 F593	N534-M581 HydrophobicContact CB-CE 4.21Å; N534-M581 WeakPolarHBondContact O-CE 3.39Å; N534-M581 VanDerWaalsContact OD1-CA 3.31Å; N534-M581 WeakPolarHBondContact OD1-CA 3.36Å; N534-M581 WeakPolarHBondContact OD1-CB 3.43Å; N534-M581 WeakPolarHBondContact OD1-CG 3.38Å; N534-M581 PolarHBondContact OD1-O 3.27Å; L537-M581 HydrophobicContact CB-CG 3.37Å; L537-M581 HydrophobicContact CB-SD 3.89Å; L537-M581 HydrophobicContact CD1-CB 4.5Å; L537-M581 HydrophobicContact CD1-CG 3.7Å; L537-M581 HydrophobicContact CG-CG 4.13Å; V538-M581 HydrophobicContact CB-CE 3.93Å; V538-M581 HydrophobicContact CB-SD 3.94Å; C577-M581 WeakPolarHBondContact O-CG 3.43Å; C577-M581 PolarHBondContact O-N 3.11Å; C577-M581 VanDerWaalsContact O-N 3.07Å; V578-M581 WeakPolarHBondContact O-CB 3.48Å; V578-M581 PolarHBondContact O-N 3.32Å; V578-M581 VanDerWaalsContact O-N 3.15Å; A579-M581 VanDerWaalsContact C-N 3.31Å; A579-M581 PolarHBondContact O-N 3.01Å; M581-L584 PolarHBondContact O-N 3.14Å; M581-S585 CarbonylContact O-C 3.19Å; M581-S585 PolarHBondContact O-N 2.74Å; M581-S585 VanDerWaalsContact O-N 3.09Å; M581-A589 HydrophobicContact CB-CB 3.88Å; M581-A589 HydrophobicContact CE-CB 4.29Å; M581-T592 HydrophobicContact CE-CG2 3.98Å; M581-F593 HydrophobicContact CE-CE2 4.15Å; M581-F593 HydrophobicContact CE-CZ 4.11Å; M581-F593 HydrophobicContact SD-CZ 4.2Å
582	F	92.7	Very high	93.2	Very high	86 Å²	86	50.7 Å²	50.7	38%	0.377	26%	0.256	S	S	.	.	H	α-helix	trans	-70.2	-34.9	177.9	-77	-84.1	0	0	0	113.1	V578 A579 I580 W586 A589 L590 F593	V578-F582 HydrophobicContact CG1-CD2 4.18Å; V578-F582 HydrophobicContact CG1-CE2 3.98Å; V578-F582 WeakPolarHBondContact O-CD2 3.32Å; V578-F582 PolarHBondContact O-N 3.36Å; A579-F582 PolarHBondContact O-N 3.25Å; I580-F582 VanDerWaalsContact C-N 3.28Å; I580-F582 PolarHBondContact O-N 3.38Å; F582-W586 HydrophobicContact CD1-CB 3.86Å; F582-W586 PolarHBondContact O-N 3.11Å; F582-A589 HydrophobicContact CD1-CB 4.36Å; F582-A589 HydrophobicContact CE1-CB 4.37Å; F582-A589 HydrophobicContact CG-CB 4.43Å; F582-A589 HydrophobicContact CZ-CB 4.46Å; F582-L590 HydrophobicContact CE1-CD2 4.09Å; F582-L590 HydrophobicContact CE1-CG 4.3Å; F582-L590 HydrophobicContact CZ-CD2 4.13Å; F582-F593 AromaticContact CE2-CE2 3.82Å; F582-F593 HydrophobicContact CE2-CE2 3.82Å; F582-F593 HydrophobicContact CZ-CE2 4.09Å
583	V	89.3	Confident	93.1	Very high	61 Å²	61	49.7 Å²	49.7	37%	0.37	25%	0.248	S	C	.	.	H	α-helix	trans	-64.6	-42.8	174.1	171.8	0	0	0	0	111.2	F355 A579 I580	F355-V583 HydrophobicContact CB-CG1 3.92Å; F355-V583 HydrophobicContact CD1-CG1 3.6Å; F355-V583 HydrophobicContact CE1-CG1 4.44Å; F355-V583 HydrophobicContact CG-CG1 4.02Å; A579-V583 WeakPolarHBondContact O-CG2 3.49Å; A579-V583 PolarHBondContact O-N 3.43Å; I580-V583 PolarHBondContact O-N 3.38Å; I580-V583 VanDerWaalsContact O-N 3.12Å
584	L	86.5	Confident	93	Very high	24 Å²	24	55.6 Å²	55.6	13%	0.126	28%	0.279	C	S	.	.	H	α-helix	trans	-62.8	-52.5	177.1	-68.1	-175.6	0	0	0	111	S359 Y362 A533 L537 I580 M581	S359-L584 VanDerWaalsContact CB-CD2 3.45Å; S359-L584 WeakPolarHBondContact OG-CD2 3.37Å; Y362-L584 HydrophobicContact CD1-CD1 4.17Å; A533-L584 HydrophobicContact CB-CD1 3.64Å; L537-L584 HydrophobicContact CD1-CD1 3.49Å; L537-L584 VanDerWaalsContact CD1-CD1 3.49Å; L537-L584 HydrophobicContact CD1-CG 4.43Å; I580-L584 HydrophobicContact CG2-CD1 4.29Å; I580-L584 HydrophobicContact CG2-CG 4.04Å; I580-L584 WeakPolarHBondContact O-CG 3.34Å; I580-L584 PolarHBondContact O-N 2.66Å; M581-L584 PolarHBondContact O-N 3.14Å
585	S	88.2	Confident	92.7	Very high	17 Å²	17	59.2 Å²	59.2	12%	0.119	30%	0.297	C	S	.	.	H	α-helix	trans	-172.4	105.3	177.7	53.6	0	0	0	0	111	N534 M581 W587 K588 A589	N534-S585 PolarHBondContact ND2-OG 2.68Å; N534-S585 VanDerWaalsContact ND2-OG 3.1Å; M581-S585 CarbonylContact O-C 3.19Å; M581-S585 PolarHBondContact O-N 2.74Å; M581-S585 VanDerWaalsContact O-N 3.09Å; S585-W587 PolarHBondContact O-N 2.88Å; S585-K588 PolarHBondContact O-N 3.21Å; S585-K588 WeakPolarHBondContact OG-CB 3.29Å; S585-K588 WeakPolarHBondContact OG-CD 3.43Å; S585-A589 PolarHBondContact O-N 2.77Å
586	W	91	Very high	92.4	Very high	163 Å²	163	54.6 Å²	54.6	62%	0.617	27%	0.273	S	S	*	.	H	α-helix	trans	-54.3	-44	-176.3	71.8	-91.1	0	0	0	114.2	F582 A589 L590	F582-W586 HydrophobicContact CD1-CB 3.86Å; F582-W586 PolarHBondContact O-N 3.11Å; W586-A589 WeakPolarHBondContact O-CB 3.41Å; W586-A589 PolarHBondContact O-N 3.37Å; W586-L590 HydrophobicContact CE3-CD1 3.76Å; W586-L590 HydrophobicContact CZ3-CD1 3.76Å; W586-L590 WeakPolarHBondContact O-CG 3.34Å; W586-L590 PolarHBondContact O-N 3.17Å
587	W	90.9	Very high	92.3	Very high	124 Å²	124	52.8 Å²	52.8	47%	0.47	27%	0.271	S	S	.	.	H	α-helix	trans	-73.7	-33.9	-175.7	76.4	-97.4	0	0	0	112.4	S585 A589 L590 L591	S585-W587 PolarHBondContact O-N 2.88Å; W587-A589 VanDerWaalsContact C-N 3.33Å; W587-L590 PolarHBondContact O-N 3.2Å; W587-L591 HydrophobicContact CZ3-CD2 4.1Å; W587-L591 PolarHBondContact O-N 3.42Å
588	K	90.7	Very high	92.3	Very high	16 Å²	16	55.5 Å²	55.5	7%	0.07	29%	0.293	C	S	.	.	H	α-helix	trans	-72.7	-29.9	174.2	-54	176.1	176	-178.6	0	111.1	L527 P530 I531 S585 L591 T592	L527-K588 PolarHBondContact O-NZ 3.41Å; P530-K588 HydrophobicContact CB-CD 3.72Å; I531-K588 HydrophobicContact CG1-CD 3.8Å; I531-K588 HydrophobicContact CG1-CG 4.36Å; S585-K588 PolarHBondContact O-N 3.21Å; S585-K588 WeakPolarHBondContact OG-CB 3.29Å; S585-K588 WeakPolarHBondContact OG-CD 3.43Å; K588-L591 PolarHBondContact O-N 3.26Å; K588-T592 WeakPolarHBondContact O-CB 3.45Å; K588-T592 PolarHBondContact O-N 3.37Å; K588-T592 PolarHBondContact O-OG1 2.78Å
589	A	92.8	Very high	92.1	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-62.1	-48.5	169.9	0	0	0	0	0	110.7	M581 F582 S585 W586 W587 L591 T592 F593	M581-A589 HydrophobicContact CB-CB 3.88Å; M581-A589 HydrophobicContact CE-CB 4.29Å; F582-A589 HydrophobicContact CD1-CB 4.36Å; F582-A589 HydrophobicContact CE1-CB 4.37Å; F582-A589 HydrophobicContact CG-CB 4.43Å; F582-A589 HydrophobicContact CZ-CB 4.46Å; S585-A589 PolarHBondContact O-N 2.77Å; W586-A589 WeakPolarHBondContact O-CB 3.41Å; W586-A589 PolarHBondContact O-N 3.37Å; W587-A589 VanDerWaalsContact C-N 3.33Å; A589-L591 PolarHBondContact O-N 3.3Å; A589-T592 WeakPolarHBondContact O-CB 3.36Å; A589-T592 PolarHBondContact O-N 3.48Å; A589-T592 VanDerWaalsContact O-N 3.13Å; A589-F593 WeakPolarHBondContact O-CD2 3.39Å; A589-F593 PolarHBondContact O-N 3.32Å
590	L	94.6	Very high	92	Very high	86 Å²	86	55.3 Å²	55.3	45%	0.45	28%	0.279	S	S	.	.	H	α-helix	trans	-59.7	-43.2	174.8	-67.4	178.3	0	0	0	112.4	F582 W586 W587 T592 F593 L594	F582-L590 HydrophobicContact CE1-CD2 4.09Å; F582-L590 HydrophobicContact CE1-CG 4.3Å; F582-L590 HydrophobicContact CZ-CD2 4.13Å; W586-L590 HydrophobicContact CE3-CD1 3.76Å; W586-L590 HydrophobicContact CZ3-CD1 3.76Å; W586-L590 WeakPolarHBondContact O-CG 3.34Å; W586-L590 PolarHBondContact O-N 3.17Å; W587-L590 PolarHBondContact O-N 3.2Å; L590-T592 VanDerWaalsContact C-N 3.3Å; L590-T592 PolarHBondContact O-N 3.44Å; L590-F593 PolarHBondContact O-N 3.24Å; L590-L594 WeakPolarHBondContact O-CB 3.4Å; L590-L594 PolarHBondContact O-N 2.97Å
591	L	92.2	Very high	92.1	Very high	82 Å²	82	57.8 Å²	57.8	43%	0.429	30%	0.295	S	S	.	.	H	α-helix	trans	-60.1	-41	174.8	-180	62.5	0	0	0	111.7	W587 K588 A589 L594 L595	W587-L591 HydrophobicContact CZ3-CD2 4.1Å; W587-L591 PolarHBondContact O-N 3.42Å; K588-L591 PolarHBondContact O-N 3.26Å; A589-L591 PolarHBondContact O-N 3.3Å; L591-L594 PolarHBondContact O-N 3.42Å; L591-L595 WeakPolarHBondContact O-CB 3.31Å; L591-L595 PolarHBondContact O-N 2.99Å
592	T	91.8	Very high	92	Very high	6 Å²	6	62.1 Å²	62.1	4%	0.037	31%	0.312	C	S	.	.	H	α-helix	trans	-65.1	-42.9	177.8	-58.7	0	0	0	0	111.4	I535 V538 M581 K588 A589 L590 T596	I535-T592 HydrophobicContact CG1-CG2 4.01Å; V538-T592 HydrophobicContact CB-CG2 4.28Å; V538-T592 HydrophobicContact CG1-CG2 3.57Å; M581-T592 HydrophobicContact CE-CG2 3.98Å; K588-T592 WeakPolarHBondContact O-CB 3.45Å; K588-T592 PolarHBondContact O-N 3.37Å; K588-T592 PolarHBondContact O-OG1 2.78Å; A589-T592 WeakPolarHBondContact O-CB 3.36Å; A589-T592 PolarHBondContact O-N 3.48Å; A589-T592 VanDerWaalsContact O-N 3.13Å; L590-T592 VanDerWaalsContact C-N 3.3Å; L590-T592 PolarHBondContact O-N 3.44Å; T592-T596 WeakPolarHBondContact O-CB 3.48Å; T592-T596 PolarHBondContact O-N 2.88Å; T592-T596 PolarHBondContact O-OG1 2.77Å
593	F	94.3	Very high	91.8	Very high	74 Å²	74	58.1 Å²	58.1	33%	0.325	29%	0.294	S	S	.	.	H	α-helix	trans	-63.6	-42.5	173.6	-75.4	-57.4	0	0	0	112.1	V538 V578 M581 F582 A589 L590 G597	V538-F593 HydrophobicContact CG2-CE1 4.3Å; V578-F593 HydrophobicContact CG1-CE2 4.49Å; V578-F593 HydrophobicContact CG1-CZ 4.03Å; V578-F593 HydrophobicContact CG2-CZ 4.23Å; M581-F593 HydrophobicContact CE-CE2 4.15Å; M581-F593 HydrophobicContact CE-CZ 4.11Å; M581-F593 HydrophobicContact SD-CZ 4.2Å; F582-F593 AromaticContact CE2-CE2 3.82Å; F582-F593 HydrophobicContact CE2-CE2 3.82Å; F582-F593 HydrophobicContact CZ-CE2 4.09Å; A589-F593 WeakPolarHBondContact O-CD2 3.39Å; A589-F593 PolarHBondContact O-N 3.32Å; L590-F593 PolarHBondContact O-N 3.24Å; F593-G597 WeakPolarHBondContact O-CA 3.4Å; F593-G597 PolarHBondContact O-N 3.26Å
594	L	94.9	Very high	91.8	Very high	124 Å²	124	59.1 Å²	59.1	65%	0.649	30%	0.295	S	S	*	.	H	α-helix	trans	-63.7	-47	178.5	-177.1	144.6	0	0	0	111.6	L590 L591 G597 A598	L590-L594 WeakPolarHBondContact O-CB 3.4Å; L590-L594 PolarHBondContact O-N 2.97Å; L591-L594 PolarHBondContact O-N 3.42Å; L594-G597 PolarHBondContact O-N 2.91Å; L594-A598 VanDerWaalsContact O-CB 3.31Å; L594-A598 WeakPolarHBondContact O-CB 3.42Å; L594-A598 PolarHBondContact O-N 3.4Å
595	L	92.2	Very high	91.9	Very high	85 Å²	85	64.7 Å²	64.7	45%	0.445	32%	0.32	S	S	.	.	H	α-helix	trans	-63	-46.1	178.6	-177.4	67	0	0	0	111.5	L591 A598 L599	L591-L595 WeakPolarHBondContact O-CB 3.31Å; L591-L595 PolarHBondContact O-N 2.99Å; L595-A598 PolarHBondContact O-N 2.92Å; L595-L599 WeakPolarHBondContact O-CG 3.4Å; L595-L599 PolarHBondContact O-N 3.49Å; L595-L599 VanDerWaalsContact O-N 3.12Å
596	T	91.3	Very high	91.7	Very high	14 Å²	14	70.9 Å²	70.9	9%	0.086	34%	0.341	C	S	.	.	H	α-helix	trans	-67.5	-40.5	179.4	-51.1	0	0	0	0	111.1	I234 T592 L599 Y600	I234-T596 HydrophobicContact CD1-CG2 4.12Å; T592-T596 WeakPolarHBondContact O-CB 3.48Å; T592-T596 PolarHBondContact O-N 2.88Å; T592-T596 PolarHBondContact O-OG1 2.77Å; T596-L599 PolarHBondContact O-N 2.92Å; T596-Y600 WeakPolarHBondContact O-CB 3.5Å; T596-Y600 PolarHBondContact O-N 2.87Å
597	G	94.1	Very high	91.1	Very high	31 Å²	31	68.2 Å²	68.2	32%	0.32	34%	0.339	S	S	.	.	H	α-helix	trans	-64.3	-41.8	176	0	0	0	0	0	112.7	F593 L594 L599 Y600 V601	F593-G597 WeakPolarHBondContact O-CA 3.4Å; F593-G597 PolarHBondContact O-N 3.26Å; L594-G597 PolarHBondContact O-N 2.91Å; G597-L599 VanDerWaalsContact C-N 3.33Å; G597-L599 PolarHBondContact O-N 3.05Å; G597-Y600 WeakPolarHBondContact O-CB 3.36Å; G597-Y600 PolarHBondContact O-N 2.95Å; G597-V601 VanDerWaalsContact O-CG2 3.32Å; G597-V601 WeakPolarHBondContact O-CG2 3.41Å; G597-V601 PolarHBondContact O-N 3.2Å
598	A	95	Very high	90.3	Very high	57 Å²	57	64 Å²	64	47%	0.471	33%	0.327	S	S	.	.	H	α-helix	trans	-61.4	-42.2	174.5	0	0	0	0	0	111.7	L594 L595 Y602	L594-A598 VanDerWaalsContact O-CB 3.31Å; L594-A598 WeakPolarHBondContact O-CB 3.42Å; L594-A598 PolarHBondContact O-N 3.4Å; L595-A598 PolarHBondContact O-N 2.92Å; A598-Y602 WeakPolarHBondContact O-CB 3.47Å; A598-Y602 PolarHBondContact O-N 2.73Å
599	L	91.9	Very high	89.2	Confident	32 Å²	32	71.5 Å²	71.5	17%	0.168	37%	0.368	C	S	.	.	H	α-helix	trans	-66	-38.9	174.1	-70.9	173	0	0	0	112.4	L236 F489 L595 T596 G597 Y602 I603	L236-L599 HydrophobicContact CB-CD1 4.46Å; L236-L599 HydrophobicContact CD2-CD1 4.3Å; L236-L599 HydrophobicContact CD2-CD2 4.02Å; F489-L599 HydrophobicContact CE1-CD2 4.14Å; F489-L599 HydrophobicContact CZ-CD2 4.35Å; L595-L599 WeakPolarHBondContact O-CG 3.4Å; L595-L599 PolarHBondContact O-N 3.49Å; L595-L599 VanDerWaalsContact O-N 3.12Å; T596-L599 PolarHBondContact O-N 2.92Å; G597-L599 VanDerWaalsContact C-N 3.33Å; G597-L599 PolarHBondContact O-N 3.05Å; L599-Y602 PolarHBondContact O-N 3.13Å; L599-I603 WeakPolarHBondContact O-CG1 3.44Å; L599-I603 PolarHBondContact O-N 3.19Å
600	Y	92.3	Very high	88.4	Confident	63 Å²	63	73.6 Å²	73.6	25%	0.247	38%	0.381	C	S	.	.	H	α-helix	trans	-59.9	-51.6	175.3	173.2	-88.7	0	0	0	110.7	E229 F230 T596 G597 Y602 I603 H604	E229-Y600 HydrophobicContact CB-CD2 3.66Å; E229-Y600 HydrophobicContact CB-CE2 3.34Å; E229-Y600 HydrophobicContact CG-CE2 4.34Å; E229-Y600 WeakPolarHBondContact OE2-CE2 3.21Å; E229-Y600 VanDerWaalsContact OE2-CZ 3.25Å; E229-Y600 PolarHBondContact OE2-OH 3.04Å; F230-Y600 HydrophobicContact CD1-CD2 4.21Å; F230-Y600 HydrophobicContact CD1-CE2 4.34Å; F230-Y600 HydrophobicContact CD2-CD2 4.41Å; F230-Y600 AromaticContact CD2-CE2 3.83Å; F230-Y600 HydrophobicContact CD2-CE2 3.83Å; F230-Y600 HydrophobicContact CE1-CD2 4.25Å; F230-Y600 HydrophobicContact CE1-CE2 4.19Å; F230-Y600 HydrophobicContact CE2-CD2 4.45Å; F230-Y600 AromaticContact CE2-CE2 3.66Å; F230-Y600 HydrophobicContact CE2-CE2 3.66Å; F230-Y600 HydrophobicContact CG-CD2 4.29Å; F230-Y600 HydrophobicContact CG-CE2 4.16Å; F230-Y600 HydrophobicContact CZ-CD2 4.37Å; F230-Y600 AromaticContact CZ-CE2 3.85Å; F230-Y600 HydrophobicContact CZ-CE2 3.85Å; T596-Y600 WeakPolarHBondContact O-CB 3.5Å; T596-Y600 PolarHBondContact O-N 2.87Å; G597-Y600 WeakPolarHBondContact O-CB 3.36Å; G597-Y600 PolarHBondContact O-N 2.95Å; Y600-Y602 VanDerWaalsContact C-N 3.29Å; Y600-Y602 PolarHBondContact O-N 2.7Å; Y600-I603 PolarHBondContact O-N 3.32Å; Y600-H604 HydrophobicContact CE1-CB 4.47Å; Y600-H604 WeakPolarHBondContact O-CB 3.1Å; Y600-H604 PolarHBondContact O-N 3.15Å
601	V	93.5	Very high	87.5	Confident	69 Å²	69	75.1 Å²	75.1	42%	0.418	39%	0.389	S	S	.	.	H	α-helix	trans	-60.2	-40.6	178.3	172.7	0	0	0	0	110.8	G597 H604 H605	G597-V601 VanDerWaalsContact O-CG2 3.32Å; G597-V601 WeakPolarHBondContact O-CG2 3.41Å; G597-V601 PolarHBondContact O-N 3.2Å; V601-H604 PolarHBondContact O-N 3.48Å; V601-H605 WeakPolarHBondContact CG1-CE1 3.44Å; V601-H605 VanDerWaalsContact CG1-ND1 3.31Å; V601-H605 WeakPolarHBondContact CG1-ND1 3.34Å; V601-H605 PolarHBondContact O-N 3.39Å; V601-H605 PolarHBondContact O-ND1 3.06Å
602	Y	92.4	Very high	86.7	Confident	90 Å²	90	73.8 Å²	73.8	35%	0.353	38%	0.379	S	S	.	.	H	α-helix	trans	-59.7	-47.6	175.7	176.8	-93.2	0	0	0	112.5	F489 A598 L599 Y600 R606	F489-Y602 HydrophobicContact CD1-CD1 4.24Å; F489-Y602 AromaticContact CD1-CE1 3.91Å; F489-Y602 HydrophobicContact CD1-CE1 3.91Å; F489-Y602 AromaticContact CE1-CD1 3.98Å; F489-Y602 HydrophobicContact CE1-CD1 3.98Å; F489-Y602 HydrophobicContact CE1-CE1 4.13Å; A598-Y602 WeakPolarHBondContact O-CB 3.47Å; A598-Y602 PolarHBondContact O-N 2.73Å; L599-Y602 PolarHBondContact O-N 3.13Å; Y600-Y602 VanDerWaalsContact C-N 3.29Å; Y600-Y602 PolarHBondContact O-N 2.7Å; Y602-R606 HydrophobicContact CE1-CG 4.25Å; Y602-R606 WeakPolarHBondContact O-CG 3.46Å; Y602-R606 PolarHBondContact O-N 3.25Å; Y602-R606 PolarHBondContact OH-NE 2.57Å; Y602-R606 PolarHBondContact OH-NH2 3.29Å; Y602-R606 VanDerWaalsContact OH-NH2 3.09Å
603	I	88.6	Confident	85.9	Confident	2 Å²	2	75.7 Å²	75.7	1%	0.01	40%	0.399	C	S	.	.	H	α-helix	trans	-68.1	-40.7	179.3	-62.9	164.3	0	0	0	110.6	E229 S233 F489 L599 Y600 H605 R606 N607 P608	E229-I603 HydrophobicContact CB-CG2 4.41Å; E229-I603 HydrophobicContact CG-CG2 4.16Å; S233-I603 VanDerWaalsContact N-CD1 3.3Å; F489-I603 HydrophobicContact CE1-CD1 4.26Å; F489-I603 HydrophobicContact CE1-CG1 4.08Å; F489-I603 HydrophobicContact CE2-CD1 4.12Å; F489-I603 HydrophobicContact CZ-CD1 3.62Å; F489-I603 HydrophobicContact CZ-CG1 3.96Å; L599-I603 WeakPolarHBondContact O-CG1 3.44Å; L599-I603 PolarHBondContact O-N 3.19Å; Y600-I603 PolarHBondContact O-N 3.32Å; I603-H605 PolarHBondContact O-N 3.29Å; I603-R606 WeakPolarHBondContact O-CB 3.19Å; I603-R606 PolarHBondContact O-N 3.03Å; I603-R606 VanDerWaalsContact O-N 3.15Å; I603-N607 PolarHBondContact O-N 3.31Å; I603-P608 HydrophobicContact CG2-CG 4.02Å; I603-P608 WeakPolarHBondContact O-CD 3.46Å
604	H	88.1	Confident	85.2	Confident	82 Å²	82	73.5 Å²	73.5	38%	0.38	39%	0.393	S	S	.	.	H	α-helix	trans	-59.8	-46.6	177.9	-174.7	70.8	0	0	0	111.5	E229 Y600 V601 R606 N607	E229-H604 VanDerWaalsContact CD-ND1 3.32Å; E229-H604 HydrophobicContact CG-CB 4.38Å; E229-H604 IonicContact OE1-CE1 3.29Å; E229-H604 IonicContact OE1-CG 3.06Å; E229-H604 IonicContact OE1-ND1 2.81Å; E229-H604 PolarHBondContact OE1-ND1 3.39Å; E229-H604 IonicContact OE2-ND1 2.66Å; Y600-H604 HydrophobicContact CE1-CB 4.47Å; Y600-H604 WeakPolarHBondContact O-CB 3.1Å; Y600-H604 PolarHBondContact O-N 3.15Å; V601-H604 PolarHBondContact O-N 3.48Å; H604-R606 PolarHBondContact O-N 2.99Å; H604-N607 PolarHBondContact O-N 3.09Å; H604-N607 PolarHBondContact O-OD1 3.37Å; H604-N607 VanDerWaalsContact O-OD1 3.04Å
605	H	88.6	Confident	84.4	Confident	142 Å²	142	68 Å²	68	66%	0.657	37%	0.365	S	S	*	.	H	α-helix	trans	-64	-27.2	176.8	-77.2	92.4	0	0	0	113.8	V601 I603 N607	V601-H605 WeakPolarHBondContact CG1-CE1 3.44Å; V601-H605 VanDerWaalsContact CG1-ND1 3.31Å; V601-H605 WeakPolarHBondContact CG1-ND1 3.34Å; V601-H605 PolarHBondContact O-N 3.39Å; V601-H605 PolarHBondContact O-ND1 3.06Å; I603-H605 PolarHBondContact O-N 3.29Å; H605-N607 VanDerWaalsContact C-N 3.29Å
606	R	84.9	Confident	83.9	Confident	147 Å²	147	66 Å²	66	56%	0.555	37%	0.365	S	S	*	.	H	α-helix	trans	-72.4	-22.5	175.5	-76.1	-73.4	-158	174	3.9	112.9	Y602 I603 H604	Y602-R606 HydrophobicContact CE1-CG 4.25Å; Y602-R606 WeakPolarHBondContact O-CG 3.46Å; Y602-R606 PolarHBondContact O-N 3.25Å; Y602-R606 PolarHBondContact OH-NE 2.57Å; Y602-R606 PolarHBondContact OH-NH2 3.29Å; Y602-R606 VanDerWaalsContact OH-NH2 3.09Å; I603-R606 WeakPolarHBondContact O-CB 3.19Å; I603-R606 PolarHBondContact O-N 3.03Å; I603-R606 VanDerWaalsContact O-N 3.15Å; H604-R606 PolarHBondContact O-N 2.99Å
607	N	78.7	Confident	83.6	Confident	107 Å²	107	70.2 Å²	70.2	57%	0.572	38%	0.384	S	S	*	.			trans	43.1	64.7	-174.3	-71.3	-49.2	0	0	0	112.2	I603 H604 H605 D609	I603-N607 PolarHBondContact O-N 3.31Å; H604-N607 PolarHBondContact O-N 3.09Å; H604-N607 PolarHBondContact O-OD1 3.37Å; H604-N607 VanDerWaalsContact O-OD1 3.04Å; H605-N607 VanDerWaalsContact C-N 3.29Å; N607-D609 PolarHBondContact O-N 3.27Å
608	P	73.8	Confident	83.1	Confident	35 Å²	35	70.1 Å²	70.1	23%	0.227	38%	0.38	C	S	.	.			trans	-56.9	132.5	179.9	25.2	-34.1	0	0	0	110.6	P228 L488 I603 V610	P228-P608 HydrophobicContact CB-CG 4.35Å; P228-P608 HydrophobicContact CG-CG 4.34Å; L488-P608 HydrophobicContact CD2-CB 4.24Å; L488-P608 HydrophobicContact CD2-CG 4.27Å; I603-P608 HydrophobicContact CG2-CG 4.02Å; I603-P608 WeakPolarHBondContact O-CD 3.46Å; P608-V610 HydrophobicContact CB-CB 4.44Å; P608-V610 HydrophobicContact CB-CG2 4.13Å; P608-V610 PolarHBondContact O-N 3.33Å
609	D	68.2	Low	82.7	Confident	173 Å²	173	69.6 Å²	69.6	93%	0.925	37%	0.368	S	S	*	.	S	Bend	trans	-71.9	61.6	-179.1	-70.9	-37.3	0	0	0	112.2	N607	N607-D609 PolarHBondContact O-N 3.27Å
610	V	76	Confident	82.4	Confident	45 Å²	45	71.9 Å²	71.9	27%	0.273	39%	0.386	S	S	.	.			trans	-141.1	107.2	-164.8	-179.8	0	0	0	0	109.3	P608 W612	P608-V610 HydrophobicContact CB-CB 4.44Å; P608-V610 HydrophobicContact CB-CG2 4.13Å; P608-V610 PolarHBondContact O-N 3.33Å; V610-W612 HydrophobicContact CG1-CD2 3.53Å; V610-W612 HydrophobicContact CG1-CE3 4.2Å; V610-W612 HydrophobicContact CG1-CG 3.96Å; V610-W612 HydrophobicContact CG1-CH2 3.94Å; V610-W612 HydrophobicContact CG1-CZ2 3.22Å; V610-W612 HydrophobicContact CG1-CZ3 4.37Å
611	N	74.6	Confident	82.2	Confident	117 Å²	117	77 Å²	77	63%	0.626	41%	0.406	S	S	*	.			trans	-104.4	101.6	176.9	-169.9	4.7	0	0	0	111.1	G613 Q617	N611-G613 PolarHBondContact OD1-N 2.55Å; N611-G613 VanDerWaalsContact OD1-N 3.15Å; N611-Q617 PolarHBondContact OD1-OE1 3.37Å
612	W	76.3	Confident	81.9	Confident	55 Å²	55	77.4 Å²	77.4	21%	0.208	40%	0.402	C	S	.	.			trans	-100.2	6	176	-62.1	-25.1	0	0	0	113.8	R224 P228 D486 L488 V610	R224-W612 VanDerWaalsContact CZ-CZ2 3.46Å; R224-W612 VanDerWaalsContact NH2-CE2 3.27Å; P228-W612 HydrophobicContact CB-CE3 3.83Å; P228-W612 HydrophobicContact CB-CH2 4.18Å; P228-W612 HydrophobicContact CB-CZ3 3.48Å; P228-W612 VanDerWaalsContact CB-CZ3 3.48Å; P228-W612 HydrophobicContact CG-CE3 4.37Å; P228-W612 HydrophobicContact CG-CZ3 4.47Å; D486-W612 HydrophobicContact CB-CH2 3.81Å; D486-W612 HydrophobicContact CB-CZ2 3.95Å; L488-W612 HydrophobicContact CD1-CH2 4.16Å; L488-W612 HydrophobicContact CD1-CZ3 4.39Å; L488-W612 HydrophobicContact CD2-CH2 4.03Å; L488-W612 HydrophobicContact CG-CH2 4.3Å; V610-W612 HydrophobicContact CG1-CD2 3.53Å; V610-W612 HydrophobicContact CG1-CE3 4.2Å; V610-W612 HydrophobicContact CG1-CG 3.96Å; V610-W612 HydrophobicContact CG1-CH2 3.94Å; V610-W612 HydrophobicContact CG1-CZ2 3.22Å; V610-W612 HydrophobicContact CG1-CZ3 4.37Å
613	G	73.8	Confident	81.8	Confident	45 Å²	45	76.3 Å²	76.3	46%	0.464	41%	0.408	S	S	.	.			trans	71.6	75.8	-175.1	0	0	0	0	0	111.6	N611	N611-G613 PolarHBondContact OD1-N 2.55Å; N611-G613 VanDerWaalsContact OD1-N 3.15Å
614	S	80.6	Confident	81.9	Confident	29 Å²	29	78.8 Å²	78.8	20%	0.203	43%	0.429	C	S	.	.			trans	-75.7	150.1	178.8	64.7	0	0	0	0	111.9	G616 Q617 A618	S614-G616 PolarHBondContact O-N 3.16Å; S614-Q617 PolarHBondContact O-N 3.28Å; S614-Q617 WeakPolarHBondContact OG-CG 3.25Å; S614-Q617 PolarHBondContact OG-N 3.03Å; S614-A618 PolarHBondContact O-N 3.08Å
615	S	78.7	Confident	82	Confident	9 Å²	9	79.2 Å²	79.2	6%	0.063	43%	0.433	C	S	.	.	H	α-helix	trans	-56.4	-34	170.8	54.2	0	0	0	0	112.6	S225 D549 Q617 A618 H619	S225-S615 PolarHBondContact O-N 2.93Å; D549-S615 WeakPolarHBondContact OD2-CB 3.49Å; D549-S615 PolarHBondContact OD2-OG 2.93Å; S615-Q617 PolarHBondContact O-N 3.06Å; S615-A618 WeakPolarHBondContact O-CB 3.04Å; S615-A618 PolarHBondContact O-N 2.96Å; S615-H619 PolarHBondContact O-CD2 3Å; S615-H619 VanDerWaalsContact O-CD2 3.27Å; S615-H619 PolarHBondContact O-N 2.95Å
616	G	81	Confident	82.2	Confident	43 Å²	43	77.6 Å²	77.6	44%	0.443	43%	0.426	S	S	.	.	H	α-helix	trans	-59.9	-41.5	175.3	0	0	0	0	0	113.9	S614 A618 H619 S620	S614-G616 PolarHBondContact O-N 3.16Å; G616-A618 VanDerWaalsContact C-N 3.34Å; G616-H619 PolarHBondContact O-N 3.09Å; G616-S620 PolarHBondContact O-N 3.11Å
617	Q	84	Confident	82.5	Confident	102 Å²	102	74.2 Å²	74.2	48%	0.477	43%	0.425	S	S	.	.	H	α-helix	trans	-65.3	-39	174.9	-71.6	172.1	0.4	0	0	111.7	N611 S614 S615 S620 Y621	N611-Q617 PolarHBondContact OD1-OE1 3.37Å; S614-Q617 PolarHBondContact O-N 3.28Å; S614-Q617 WeakPolarHBondContact OG-CG 3.25Å; S614-Q617 PolarHBondContact OG-N 3.03Å; S615-Q617 PolarHBondContact O-N 3.06Å; Q617-S620 PolarHBondContact O-N 3.23Å; Q617-Y621 PolarHBondContact O-N 3.49Å
618	A	84.3	Confident	83.1	Confident	28 Å²	28	70.5 Å²	70.5	23%	0.231	41%	0.406	C	S	.	.	H	α-helix	trans	-63.5	-42.7	176.9	0	0	0	0	0	112	A553 S614 S615 G616 Y621 K622	A553-A618 HydrophobicContact CB-CB 4.23Å; S614-A618 PolarHBondContact O-N 3.08Å; S615-A618 WeakPolarHBondContact O-CB 3.04Å; S615-A618 PolarHBondContact O-N 2.96Å; G616-A618 VanDerWaalsContact C-N 3.34Å; A618-Y621 PolarHBondContact O-N 2.85Å; A618-K622 PolarHBondContact O-N 2.84Å
619	H	86.6	Confident	83.9	Confident	47 Å²	47	74.6 Å²	74.6	22%	0.218	43%	0.425	C	S	.	.	H	α-helix	trans	-64.2	-39.8	174.3	-77.9	-61.3	0	0	0	112.7	D549 F552 A553 S615 G616 K622 S623	D549-H619 IonicContact OD1-CD2 3.36Å; D549-H619 IonicContact OD1-CE1 2.72Å; D549-H619 IonicContact OD1-NE2 2.85Å; D549-H619 PolarHBondContact OD1-NE2 3.37Å; F552-H619 AromaticContact CD1-CE1 3.76Å; A553-H619 VanDerWaalsContact CA-CE1 3.45Å; A553-H619 WeakPolarHBondContact CA-CE1 3.03Å; S615-H619 PolarHBondContact O-CD2 3Å; S615-H619 VanDerWaalsContact O-CD2 3.27Å; S615-H619 PolarHBondContact O-N 2.95Å; G616-H619 PolarHBondContact O-N 3.09Å; H619-K622 PolarHBondContact O-N 2.78Å; H619-S623 VanDerWaalsContact O-CB 3.29Å; H619-S623 WeakPolarHBondContact O-CB 3.19Å; H619-S623 PolarHBondContact O-N 3.13Å; H619-S623 PolarHBondContact O-OG 3.45Å
620	S	85.1	Confident	85.1	Confident	80 Å²	80	73.6 Å²	73.6	56%	0.559	41%	0.413	S	S	*	.	H	α-helix	trans	-60.2	-46.3	175.5	-175.5	0	0	0	0	111.6	G616 Q617 S623 A624	G616-S620 PolarHBondContact O-N 3.11Å; Q617-S620 PolarHBondContact O-N 3.23Å; S620-S623 PolarHBondContact O-N 3.28Å; S620-A624 WeakPolarHBondContact O-CB 3.14Å; S620-A624 PolarHBondContact O-N 3.01Å
621	Y	89.1	Confident	85.7	Confident	170 Å²	170	74.6 Å²	74.6	67%	0.667	42%	0.416	S	S	*	.	H	α-helix	trans	-59.5	-49.4	175.3	179.4	-88.5	0	0	0	112.2	Q617 A618 S623 A624 L625	Q617-Y621 PolarHBondContact O-N 3.49Å; A618-Y621 PolarHBondContact O-N 2.85Å; Y621-S623 VanDerWaalsContact C-N 3.3Å; Y621-S623 PolarHBondContact O-N 2.94Å; Y621-A624 PolarHBondContact O-N 2.72Å; Y621-L625 HydrophobicContact CE1-CD2 4.34Å; Y621-L625 WeakPolarHBondContact O-CB 3.5Å; Y621-L625 PolarHBondContact O-N 3.06Å
622	K	87.6	Confident	86.2	Confident	77 Å²	77	71.4 Å²	71.4	34%	0.335	41%	0.406	S	S	.	.	H	α-helix	trans	-60.6	-41.4	179	-173.6	177.6	-177.5	176.9	0	111.7	A618 H619 L625 H626	A618-K622 PolarHBondContact O-N 2.84Å; H619-K622 PolarHBondContact O-N 2.78Å; K622-L625 PolarHBondContact O-N 3.17Å; K622-H626 WeakPolarHBondContact O-CB 3.35Å; K622-H626 PolarHBondContact O-CD2 2.98Å; K622-H626 PolarHBondContact O-N 3.06Å
623	S	89.9	Confident	86.7	Confident	68 Å²	68	73.4 Å²	73.4	48%	0.476	43%	0.429	S	S	.	.	H	α-helix	trans	-64.8	-43.7	177.6	-59.7	0	0	0	0	111.5	H619 S620 Y621 S627	H619-S623 VanDerWaalsContact O-CB 3.29Å; H619-S623 WeakPolarHBondContact O-CB 3.19Å; H619-S623 PolarHBondContact O-N 3.13Å; H619-S623 PolarHBondContact O-OG 3.45Å; S620-S623 PolarHBondContact O-N 3.28Å; Y621-S623 VanDerWaalsContact C-N 3.3Å; Y621-S623 PolarHBondContact O-N 2.94Å; S623-S627 WeakPolarHBondContact O-CB 3.45Å; S623-S627 PolarHBondContact O-N 3.23Å; S623-S627 PolarHBondContact O-OG 3.42Å
624	A	90	Very high	87.4	Confident	54 Å²	54	74.4 Å²	74.4	45%	0.446	43%	0.425	S	S	.	.	H	α-helix	trans	-62.4	-44.5	175.6	0	0	0	0	0	111.8	S620 Y621 S627 T628	S620-A624 WeakPolarHBondContact O-CB 3.14Å; S620-A624 PolarHBondContact O-N 3.01Å; Y621-A624 PolarHBondContact O-N 2.72Å; A624-S627 PolarHBondContact O-N 3.02Å; A624-T628 WeakPolarHBondContact O-CB 2.91Å; A624-T628 PolarHBondContact O-N 3.02Å; A624-T628 PolarHBondContact O-OG1 3.42Å
625	L	91	Very high	87.6	Confident	90 Å²	90	81.5 Å²	81.5	47%	0.471	46%	0.456	S	S	.	.	H	α-helix	trans	-62.6	-51.9	177.2	177.8	62.6	0	0	0	111.8	Y621 K622 S627 T628 L629	Y621-L625 HydrophobicContact CE1-CD2 4.34Å; Y621-L625 WeakPolarHBondContact O-CB 3.5Å; Y621-L625 PolarHBondContact O-N 3.06Å; K622-L625 PolarHBondContact O-N 3.17Å; L625-S627 VanDerWaalsContact C-N 3.31Å; L625-S627 PolarHBondContact O-N 3.38Å; L625-T628 PolarHBondContact O-N 3.02Å; L625-L629 WeakPolarHBondContact O-CB 3.26Å; L625-L629 PolarHBondContact O-N 3.44Å
626	H	91.9	Very high	87.7	Confident	108 Å²	108	88.2 Å²	88.2	50%	0.5	49%	0.486	S	S	.	.	H	α-helix	trans	-61.4	-40.6	179.4	-78.7	-158.5	0	0	0	111.7	K622 L629 K630	K622-H626 WeakPolarHBondContact O-CB 3.35Å; K622-H626 PolarHBondContact O-CD2 2.98Å; K622-H626 PolarHBondContact O-N 3.06Å; H626-L629 PolarHBondContact O-N 3.48Å; H626-K630 WeakPolarHBondContact O-CB 3.25Å; H626-K630 PolarHBondContact O-N 2.65Å
627	S	92.1	Very high	87.8	Confident	77 Å²	77	89.9 Å²	89.9	54%	0.538	48%	0.482	S	S	.	.	H	α-helix	trans	-64	-42.6	177.3	-59.6	0	0	0	0	111.4	S623 A624 L625 K630 L631	S623-S627 WeakPolarHBondContact O-CB 3.45Å; S623-S627 PolarHBondContact O-N 3.23Å; S623-S627 PolarHBondContact O-OG 3.42Å; A624-S627 PolarHBondContact O-N 3.02Å; L625-S627 VanDerWaalsContact C-N 3.31Å; L625-S627 PolarHBondContact O-N 3.38Å; S627-K630 PolarHBondContact O-N 3.28Å; S627-L631 WeakPolarHBondContact O-CB 2.99Å; S627-L631 PolarHBondContact O-N 2.92Å
628	T	91.1	Very high	87.8	Confident	28 Å²	28	86.1 Å²	86.1	17%	0.172	47%	0.466	C	S	.	.	H	α-helix	trans	-67.3	-40.2	177.4	-53.5	0	0	0	0	111.7	A624 L625 L631 A632 V730 L733	A624-T628 WeakPolarHBondContact O-CB 2.91Å; A624-T628 PolarHBondContact O-N 3.02Å; A624-T628 PolarHBondContact O-OG1 3.42Å; L625-T628 PolarHBondContact O-N 3.02Å; T628-L631 WeakPolarHBondContact O-CB 3.23Å; T628-L631 PolarHBondContact O-N 3.34Å; T628-A632 PolarHBondContact O-N 3Å; T628-V730 HydrophobicContact CG2-CB 4.44Å; T628-V730 HydrophobicContact CG2-CG1 4.06Å; T628-L733 HydrophobicContact CG2-CD1 4.1Å
629	L	91	Very high	87.8	Confident	121 Å²	121	89.9 Å²	89.9	63%	0.634	48%	0.477	S	S	*	.	H	α-helix	trans	-65.7	-43.5	176.6	-174.9	65.3	0	0	0	111.8	L625 H626 L631 A632 S633	L625-L629 WeakPolarHBondContact O-CB 3.26Å; L625-L629 PolarHBondContact O-N 3.44Å; H626-L629 PolarHBondContact O-N 3.48Å; L629-L631 VanDerWaalsContact C-N 3.3Å; L629-L631 PolarHBondContact O-N 2.68Å; L629-A632 WeakPolarHBondContact O-CB 3.36Å; L629-A632 PolarHBondContact O-N 3.02Å; L629-S633 PolarHBondContact O-N 3.26Å
630	K	92.1	Very high	87.8	Confident	153 Å²	153	93.6 Å²	93.6	67%	0.665	50%	0.498	S	S	*	.	H	α-helix	trans	-60.5	-42.2	173.9	-176.9	178.8	179.1	-179.1	0	111.2	H626 S627 A632 S633 T634	H626-K630 WeakPolarHBondContact O-CB 3.25Å; H626-K630 PolarHBondContact O-N 2.65Å; S627-K630 PolarHBondContact O-N 3.28Å; K630-A632 VanDerWaalsContact C-N 3.3Å; K630-A632 PolarHBondContact O-N 3.33Å; K630-S633 PolarHBondContact O-N 3.46Å; K630-S633 PolarHBondContact O-OG 3.02Å; K630-T634 PolarHBondContact O-N 3.36Å; K630-T634 PolarHBondContact O-OG1 3.29Å
631	L	88.1	Confident	88.1	Confident	66 Å²	66	92.4 Å²	92.4	35%	0.346	48%	0.482	S	S	.	.	H	α-helix	trans	-61.3	-39.5	176.9	-173.8	63.7	0	0	0	111.4	S627 T628 L629 S633 T634 K732 L733	S627-L631 WeakPolarHBondContact O-CB 2.99Å; S627-L631 PolarHBondContact O-N 2.92Å; T628-L631 WeakPolarHBondContact O-CB 3.23Å; T628-L631 PolarHBondContact O-N 3.34Å; L629-L631 VanDerWaalsContact C-N 3.3Å; L629-L631 PolarHBondContact O-N 2.68Å; L631-S633 VanDerWaalsContact C-N 3.26Å; L631-S633 PolarHBondContact O-N 3.44Å; L631-T634 WeakPolarHBondContact O-CB 3.34Å; L631-T634 PolarHBondContact O-N 2.79Å; L631-T634 VanDerWaalsContact O-N 3.13Å; L631-K732 HydrophobicContact CD2-CB 4.12Å; L631-K732 HydrophobicContact CG-CB 4.03Å; L631-K732 HydrophobicContact CG-CD 4.35Å; L631-K732 HydrophobicContact CG-CG 4.47Å; L631-K732 VanDerWaalsContact O-CD 3.25Å; L631-K732 WeakPolarHBondContact O-CD 3.05Å; L631-K732 WeakPolarHBondContact O-CE 3.46Å; L631-L733 HydrophobicContact CD2-CD2 4Å; L631-L733 HydrophobicContact CD2-CG 4.04Å
632	A	86.2	Confident	88.3	Confident	50 Å²	50	90.4 Å²	90.4	41%	0.413	47%	0.473	S	S	.	.	H	α-helix	trans	-58.2	-35.9	175.7	0	0	0	0	0	113.2	T628 L629 K630 K732	T628-A632 PolarHBondContact O-N 3Å; L629-A632 WeakPolarHBondContact O-CB 3.36Å; L629-A632 PolarHBondContact O-N 3.02Å; K630-A632 VanDerWaalsContact C-N 3.3Å; K630-A632 PolarHBondContact O-N 3.33Å; A632-K732 WeakPolarHBondContact O-CE 3.36Å
633	S	86.7	Confident	88.7	Confident	97 Å²	97	87 Å²	87	68%	0.678	46%	0.459	S	S	*	.	H	α-helix	trans	-84.4	-11.5	177.4	63.7	0	0	0	0	115.3	L629 K630 L631	L629-S633 PolarHBondContact O-N 3.26Å; K630-S633 PolarHBondContact O-N 3.46Å; K630-S633 PolarHBondContact O-OG 3.02Å; L631-S633 VanDerWaalsContact C-N 3.26Å; L631-S633 PolarHBondContact O-N 3.44Å
634	T	87.7	Confident	89	Confident	65 Å²	65	85.2 Å²	85.2	40%	0.399	44%	0.443	S	S	.	.	S	Bend	trans	-76.8	138.3	-179	-55.1	0	0	0	0	109.7	K630 L631 K732	K630-T634 PolarHBondContact O-N 3.36Å; K630-T634 PolarHBondContact O-OG1 3.29Å; L631-T634 WeakPolarHBondContact O-CB 3.34Å; L631-T634 PolarHBondContact O-N 2.79Å; L631-T634 VanDerWaalsContact O-N 3.13Å; T634-K732 WeakPolarHBondContact O-CE 3.48Å; T634-K732 PolarHBondContact O-NZ 3.43Å
635	E	85.3	Confident	89.3	Confident	179 Å²	179	82.7 Å²	82.7	84%	0.836	42%	0.422	S	S	*	.	P	Polyproline II helix	trans	-68.5	150.9	175.9	-66.2	-178.7	174.7	0	0	112.1
636	E	80.7	Confident	89.7	Confident	149 Å²	149	78.4 Å²	78.4	70%	0.696	40%	0.4	S	S	*	.	P	Polyproline II helix	trans	-81.5	139.7	176.5	-58.4	-168.7	173.1	0	0	110.4	K732	E636-K732 HydrophobicContact CG-CD 4.4Å; E636-K732 IonicContact OE1-NZ 2.85Å; E636-K732 PolarHBondContact OE1-NZ 3.47Å
637	H	84	Confident	90	Very high	78 Å²	78	73.3 Å²	73.3	36%	0.361	38%	0.376	S	S	.	.			trans	-141.2	134.5	176.4	-167	-83.9	0	0	0	108.6	K639 N640 Y641	H637-K639 WeakPolarHBondContact ND1-CB 3.32Å; H637-K639 PolarHBondContact ND1-N 2.95Å; H637-K639 PolarHBondContact O-N 2.99Å; H637-K639 VanDerWaalsContact O-N 3.09Å; H637-N640 WeakPolarHBondContact O-CA 3.48Å; H637-N640 PolarHBondContact O-N 3.4Å; H637-Y641 PolarHBondContact O-N 2.93Å
638	V	83.4	Confident	90.2	Very high	23 Å²	23	70.4 Å²	70.4	14%	0.139	35%	0.354	C	S	.	.	G	3₁₀ helix	trans	-52.5	-35.3	-176.9	53.1	0	0	0	0	113.2	N640 Y641 S1099 T1102	V638-N640 VanDerWaalsContact C-N 3.25Å; V638-N640 PolarHBondContact O-N 3.26Å; V638-Y641 WeakPolarHBondContact O-CB 3.19Å; V638-Y641 PolarHBondContact O-N 3.16Å; V638-Y641 VanDerWaalsContact O-N 3.08Å; V638-S1099 WeakPolarHBondContact CG2-O 3.21Å; V638-T1102 HydrophobicContact CB-CG2 4.34Å; V638-T1102 HydrophobicContact CG1-CG2 3.5Å; V638-T1102 HydrophobicContact CG2-CG2 4.01Å
639	K	83.9	Confident	90.2	Very high	108 Å²	108	69 Å²	69	47%	0.47	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-61.7	-28.9	174.7	-69.5	-176.5	-179.9	-176.7	0	115.1	H637 T1102 Y1104 S1105	H637-K639 WeakPolarHBondContact ND1-CB 3.32Å; H637-K639 PolarHBondContact ND1-N 2.95Å; H637-K639 PolarHBondContact O-N 2.99Å; H637-K639 VanDerWaalsContact O-N 3.09Å; K639-T1102 HydrophobicContact CG-CG2 3.72Å; K639-Y1104 WeakPolarHBondContact CE-O 3.31Å; K639-S1105 VanDerWaalsContact CE-CA 3.47Å; K639-S1105 WeakPolarHBondContact CE-OXT 3.48Å; K639-S1105 VanDerWaalsContact NZ-C 3.32Å; K639-S1105 PolarHBondContact NZ-OXT 2.94Å
640	N	87.7	Confident	90.1	Very high	124 Å²	124	64.1 Å²	64.1	66%	0.663	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-95.9	3.1	179.4	-66.7	-30.8	0	0	0	111.5	H637 V638 R642	H637-N640 WeakPolarHBondContact O-CA 3.48Å; H637-N640 PolarHBondContact O-N 3.4Å; V638-N640 VanDerWaalsContact C-N 3.25Å; V638-N640 PolarHBondContact O-N 3.26Å; N640-R642 PolarHBondContact O-N 2.75Å
641	Y	91	Very high	90	Very high	55 Å²	55	58.1 Å²	58.1	22%	0.216	30%	0.3	C	S	.	.			trans	-57.6	136.6	176.7	179.7	-89.5	0	0	0	110.6	H637 V638 P643 N736 L931 V1100	H637-Y641 PolarHBondContact O-N 2.93Å; V638-Y641 WeakPolarHBondContact O-CB 3.19Å; V638-Y641 PolarHBondContact O-N 3.16Å; V638-Y641 VanDerWaalsContact O-N 3.08Å; Y641-P643 HydrophobicContact CE1-CG 4.12Å; Y641-N736 WeakPolarHBondContact CE2-ND2 3.31Å; Y641-N736 PolarHBondContact OH-ND2 3.24Å; Y641-L931 HydrophobicContact CD1-CD2 3.77Å; Y641-L931 HydrophobicContact CE1-CD2 3.71Å; Y641-V1100 HydrophobicContact CD1-CB 3.61Å; Y641-V1100 HydrophobicContact CD1-CG1 3.91Å; Y641-V1100 HydrophobicContact CD2-CB 4.27Å; Y641-V1100 HydrophobicContact CD2-CG1 3.85Å; Y641-V1100 HydrophobicContact CE1-CB 3.64Å; Y641-V1100 HydrophobicContact CE1-CG1 3.58Å; Y641-V1100 HydrophobicContact CE1-CG2 4.42Å; Y641-V1100 HydrophobicContact CE2-CB 4.28Å; Y641-V1100 HydrophobicContact CE2-CG1 3.5Å; Y641-V1100 VanDerWaalsContact CE2-CG1 3.5Å; Y641-V1100 HydrophobicContact CG-CB 3.94Å; Y641-V1100 HydrophobicContact CG-CG1 4.04Å
642	R	92.8	Very high	90.2	Very high	128 Å²	128	55 Å²	55	48%	0.483	28%	0.284	S	S	.	.			trans	-134.6	134.6	175.4	-71	-178.5	-178.1	-87.2	-9.1	108.8	N640 Q644 V669 C670 N736	N640-R642 PolarHBondContact O-N 2.75Å; R642-Q644 PolarHBondContact O-N 3.03Å; R642-Q644 VanDerWaalsContact O-N 3.14Å; R642-V669 PolarHBondContact NH1-O 3.33Å; R642-C670 HydrophobicContact CB-CB 4.45Å; R642-N736 PolarHBondContact O-ND2 3.27Å
643	P	95.1	Very high	90.3	Very high	5 Å²	5	52.7 Å²	52.7	3%	0.032	26%	0.264	C	S	.	.			trans	-67.4	110.4	170.6	-17.8	30.3	0	0	0	110.3	Y641 L645 I665 C670 L931 I932 L935	Y641-P643 HydrophobicContact CE1-CG 4.12Å; P643-L645 HydrophobicContact CB-CD2 4.26Å; P643-I665 HydrophobicContact CB-CG2 4.49Å; P643-C670 WeakPolarHBondContact O-CB 3.19Å; P643-L931 HydrophobicContact CG-CD2 4.17Å; P643-I932 HydrophobicContact CB-CD1 3.99Å; P643-I932 HydrophobicContact CG-CD1 3.94Å; P643-L935 HydrophobicContact CG-CD1 3.63Å
644	Q	96.4	Very high	90.5	Very high	31 Å²	31	48.5 Å²	48.5	15%	0.145	24%	0.235	C	C	.	.			trans	-100.6	105.1	177.2	-60	-170.4	57.6	0	0	107.9	R642 L671 K732 R734 P735 N736 V737	R642-Q644 PolarHBondContact O-N 3.03Å; R642-Q644 VanDerWaalsContact O-N 3.14Å; Q644-L671 CarbonylContact C-O 3.33Å; Q644-L671 WeakPolarHBondContact CA-O 3.41Å; Q644-L671 HydrophobicContact CB-CB 3.93Å; Q644-L671 HydrophobicContact CB-CD2 4.33Å; Q644-L671 HydrophobicContact CG-CB 3.99Å; Q644-K732 PolarHBondContact NE2-O 3.28Å; Q644-K732 PolarHBondContact OE1-O 2.89Å; Q644-R734 WeakPolarHBondContact CB-O 3.34Å; Q644-R734 VanDerWaalsContact CD-O 3.24Å; Q644-R734 PolarHBondContact OE1-O 3.5Å; Q644-P735 CarbonylContact O-C 3.6Å; Q644-P735 WeakPolarHBondContact O-CA 3.35Å; Q644-N736 WeakPolarHBondContact CA-OD1 3.34Å; Q644-N736 PolarHBondContact N-OD1 3.48Å; Q644-N736 PolarHBondContact O-N 2.89Å; Q644-N736 PolarHBondContact O-OD1 3.34Å; Q644-V737 PolarHBondContact O-N 3.34Å; Q644-V737 VanDerWaalsContact O-N 3.12Å
645	L	97.9	Very high	90.8	Very high	2 Å²	2	48.8 Å²	48.8	1%	0.01	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	125.7	-168.2	-58	-169.9	0	0	0	112.3	P643 I665 T666 L671 L672 V673 V737 L739	P643-L645 HydrophobicContact CB-CD2 4.26Å; L645-I665 HydrophobicContact CD1-CB 4.1Å; L645-I665 HydrophobicContact CD1-CD1 4.22Å; L645-I665 HydrophobicContact CD1-CG2 4.09Å; L645-T666 HydrophobicContact CB-CG2 4.26Å; L645-T666 HydrophobicContact CD1-CG2 3.72Å; L645-T666 HydrophobicContact CG-CG2 3.69Å; L645-L671 PolarHBondContact N-O 2.91Å; L645-L672 HydrophobicContact CB-CD1 3.83Å; L645-L672 HydrophobicContact CD1-CD1 4.26Å; L645-V673 PolarHBondContact O-N 2.89Å; L645-V737 CarbonylContact C-O 3.57Å; L645-V737 VanDerWaalsContact CA-O 3.32Å; L645-V737 WeakPolarHBondContact CA-O 3.41Å; L645-V737 HydrophobicContact CD2-CB 3.65Å; L645-V737 HydrophobicContact CD2-CG1 3.76Å; L645-L739 HydrophobicContact CD1-CD2 4.45Å
646	L	98.2	Very high	91.1	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	108.2	155.4	179.8	61	0	0	0	108	L648 V673 L724 L725 V728 P735 V737 V738 L739	L646-L648 HydrophobicContact CD2-CD2 4.24Å; L646-L648 HydrophobicContact CG-CD2 4.14Å; L646-V673 HydrophobicContact CD1-CB 4.27Å; L646-V673 HydrophobicContact CD1-CG1 4.31Å; L646-L724 HydrophobicContact CD2-CB 4.21Å; L646-L725 HydrophobicContact CD2-CD2 3.77Å; L646-L725 HydrophobicContact CD2-CG 4.15Å; L646-V728 HydrophobicContact CD1-CG1 4.47Å; L646-V728 HydrophobicContact CD1-CG2 4.4Å; L646-P735 HydrophobicContact CB-CB 3.6Å; L646-P735 HydrophobicContact CB-CG 3.77Å; L646-V737 PolarHBondContact N-O 3.38Å; L646-V738 HydrophobicContact CB-CG2 4.42Å; L646-V738 WeakPolarHBondContact O-CA 3.43Å; L646-L739 PolarHBondContact O-N 2.82Å
647	L	97.7	Very high	91.7	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	109.4	-178.1	-164.1	70.3	0	0	0	109.7	T649 L658 V659 L672 V673 C674 G675 L739	L647-T649 HydrophobicContact CB-CG2 4.1Å; L647-T649 HydrophobicContact CD2-CG2 3.37Å; L647-T649 HydrophobicContact CG-CG2 3.49Å; L647-T649 VanDerWaalsContact CG-CG2 3.49Å; L647-T649 PolarHBondContact O-N 3.14Å; L647-L658 HydrophobicContact CD1-CD1 4Å; L647-L658 HydrophobicContact CD1-CG 3.88Å; L647-L658 HydrophobicContact CD2-CG 4.3Å; L647-L658 WeakPolarHBondContact CD2-O 3.22Å; L647-L658 HydrophobicContact CG-CG 4.11Å; L647-V659 HydrophobicContact CD2-CB 4.39Å; L647-V659 HydrophobicContact CD2-CG2 4.24Å; L647-L672 HydrophobicContact CB-CD1 4.27Å; L647-L672 HydrophobicContact CD2-CD1 4.47Å; L647-V673 PolarHBondContact N-O 3.2Å; L647-C674 CarbonylContact O-C 3.47Å; L647-C674 WeakPolarHBondContact O-CA 3.46Å; L647-G675 PolarHBondContact O-N 2.87Å; L647-L739 CarbonylContact C-O 3.52Å; L647-L739 WeakPolarHBondContact CA-O 3.46Å; L647-L739 HydrophobicContact CD1-CB 3.54Å; L647-L739 HydrophobicContact CD1-CD2 3.3Å; L647-L739 HydrophobicContact CD1-CG 3.33Å
648	L	97.5	Very high	92.2	Very high	16 Å²	16	29.6 Å²	29.6	8%	0.084	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	74.6	178.3	-59.1	-176.5	0	0	0	110.4	L646 V721 L724 V738 L739 M740 V760	L646-L648 HydrophobicContact CD2-CD2 4.24Å; L646-L648 HydrophobicContact CG-CD2 4.14Å; L648-V721 HydrophobicContact CD1-CG1 3.89Å; L648-V721 HydrophobicContact CD1-CG2 3.81Å; L648-V721 HydrophobicContact CD2-CG1 4.31Å; L648-V721 HydrophobicContact CD2-CG2 4.11Å; L648-L724 HydrophobicContact CD2-CD1 4.26Å; L648-V738 HydrophobicContact CD1-CG1 3.78Å; L648-V738 HydrophobicContact CG-CG1 3.85Å; L648-L739 PolarHBondContact N-O 3.12Å; L648-M740 HydrophobicContact CB-CB 3.94Å; L648-M740 HydrophobicContact CD1-CB 4.11Å; L648-M740 HydrophobicContact CD1-CE 4.46Å; L648-M740 HydrophobicContact CD1-SD 4.4Å; L648-M740 HydrophobicContact CG-CB 4.36Å; L648-V760 HydrophobicContact CD1-CG1 4.03Å
649	T	90.7	Very high	92.9	Very high	0 Å²	0	28.5 Å²	28.5	0%	0	13%	0.133	C	C	.	.			trans	-79.9	-22.9	-175.8	53	0	0	0	0	113.3	L647 R655 L658 V659 C674 G675	L647-T649 HydrophobicContact CB-CG2 4.1Å; L647-T649 HydrophobicContact CD2-CG2 3.37Å; L647-T649 HydrophobicContact CG-CG2 3.49Å; L647-T649 VanDerWaalsContact CG-CG2 3.49Å; L647-T649 PolarHBondContact O-N 3.14Å; T649-R655 WeakPolarHBondContact O-CD 3.47Å; T649-R655 WeakPolarHBondContact O-CG 3.39Å; T649-L658 HydrophobicContact CG2-CD2 4.37Å; T649-V659 HydrophobicContact CG2-CG2 3.76Å; T649-C674 HydrophobicContact CG2-CB 4.19Å; T649-G675 PolarHBondContact N-O 3.14Å
650	G	89.3	Confident	93.4	Very high	18 Å²	18	23.7 Å²	23.7	19%	0.186	11%	0.112	C	C	.	.	S	Bend	trans	60.9	-136.9	-154.9	0	0	0	0	0	108.3	P652 G675 H676	G650-P652 WeakPolarHBondContact O-CD 3.3Å; G650-G675 PolarHBondContact N-O 3.03Å; G650-H676 VanDerWaalsContact CA-CD2 3.43Å; G650-H676 WeakPolarHBondContact CA-CD2 3.36Å; G650-H676 WeakPolarHBondContact O-CB 3.43Å; G650-H676 VanDerWaalsContact O-CG 3.31Å
651	N	90.6	Very high	93.8	Very high	27 Å²	27	17.8 Å²	17.8	14%	0.144	8%	0.081	C	C	.	.	S	Bend	trans	-64.3	114.7	168.5	-172.5	-18.6	0	0	0	110.1	V653 S654 R655 H676	N651-V653 PolarHBondContact O-N 2.9Å; N651-V653 VanDerWaalsContact O-N 3.14Å; N651-V653 PolarHBondContact OD1-N 3.41Å; N651-V653 VanDerWaalsContact OD1-N 3.1Å; N651-S654 WeakPolarHBondContact O-CB 3.32Å; N651-S654 PolarHBondContact O-N 2.93Å; N651-R655 PolarHBondContact O-N 3.28Å; N651-H676 PolarHBondContact N-CE1 3.37Å; N651-H676 PolarHBondContact N-NE2 3.2Å
652	P	92.2	Very high	94	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	7%	0.07	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-29.4	-177.9	-23.6	34.4	0	0	0	113.6	G650 S654 R655 V659 C674 I696 W699 F700 Y709	G650-P652 WeakPolarHBondContact O-CD 3.3Å; P652-S654 VanDerWaalsContact C-N 3.3Å; P652-S654 PolarHBondContact O-N 3.33Å; P652-R655 CarbonylContact O-C 3.43Å; P652-R655 PolarHBondContact O-N 3.48Å; P652-V659 HydrophobicContact CB-CG2 3.95Å; P652-C674 HydrophobicContact CG-CB 4.08Å; P652-I696 HydrophobicContact CG-CD1 4.49Å; P652-I696 HydrophobicContact CG-CG2 4.09Å; P652-W699 HydrophobicContact CB-CZ3 4.09Å; P652-W699 WeakPolarHBondContact O-CH2 3.3Å; P652-F700 HydrophobicContact CB-CE1 4.17Å; P652-F700 HydrophobicContact CB-CZ 4.46Å; P652-F700 HydrophobicContact CG-CZ 4.36Å; P652-Y709 HydrophobicContact CG-CD2 3.97Å; P652-Y709 HydrophobicContact CG-CE2 4.02Å
653	V	88.8	Confident	94.1	Very high	1 Å²	1	9.9 Å²	9.9	1%	0.006	5%	0.054	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.6	-28.5	179.8	-170.9	0	0	0	0	112.2	N651 R655 P656 W699 I882	N651-V653 PolarHBondContact O-N 2.9Å; N651-V653 VanDerWaalsContact O-N 3.14Å; N651-V653 PolarHBondContact OD1-N 3.41Å; N651-V653 VanDerWaalsContact OD1-N 3.1Å; V653-R655 VanDerWaalsContact C-N 3.34Å; V653-P656 VanDerWaalsContact O-CD 3.3Å; V653-P656 WeakPolarHBondContact O-CD 3.23Å; V653-W699 HydrophobicContact CG2-CB 4.33Å; V653-W699 HydrophobicContact CG2-CD2 3.97Å; V653-W699 HydrophobicContact CG2-CG 3.79Å; V653-I882 HydrophobicContact CB-CG2 4.27Å; V653-I882 HydrophobicContact CG1-CG2 3.71Å; V653-I882 HydrophobicContact CG2-CG1 4.34Å; V653-I882 HydrophobicContact CG2-CG2 4.09Å
654	S	89.9	Confident	94.1	Very high	9 Å²	9	10.3 Å²	10.3	6%	0.063	6%	0.057	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-26	173.7	-64	0	0	0	0	112.4	N651 P652 P656 F782 S783	N651-S654 WeakPolarHBondContact O-CB 3.32Å; N651-S654 PolarHBondContact O-N 2.93Å; P652-S654 VanDerWaalsContact C-N 3.3Å; P652-S654 PolarHBondContact O-N 3.33Å; S654-P656 WeakPolarHBondContact O-CD 3.46Å; S654-F782 PolarHBondContact O-N 2.87Å; S654-S783 WeakPolarHBondContact CB-OG 3.39Å; S654-S783 PolarHBondContact OG-OG 3.35Å
655	R	93.6	Very high	94	Very high	72 Å²	72	9.2 Å²	9.2	27%	0.272	5%	0.052	S	C	.	.			trans	-126.3	53.1	-176.6	-49.8	-163.3	-175.4	153.3	-2.4	114.4	T649 N651 P652 V653 S657 L658 V659 L780 D781	T649-R655 WeakPolarHBondContact O-CD 3.47Å; T649-R655 WeakPolarHBondContact O-CG 3.39Å; N651-R655 PolarHBondContact O-N 3.28Å; P652-R655 CarbonylContact O-C 3.43Å; P652-R655 PolarHBondContact O-N 3.48Å; V653-R655 VanDerWaalsContact C-N 3.34Å; R655-S657 VanDerWaalsContact C-N 3.31Å; R655-S657 PolarHBondContact O-N 2.99Å; R655-L658 HydrophobicContact CB-CB 4.17Å; R655-L658 WeakPolarHBondContact O-CB 3.47Å; R655-L658 PolarHBondContact O-N 3.42Å; R655-L658 VanDerWaalsContact O-N 3.1Å; R655-V659 PolarHBondContact O-N 2.97Å; R655-L780 VanDerWaalsContact CA-O 3.32Å; R655-L780 WeakPolarHBondContact CA-O 3.23Å; R655-L780 WeakPolarHBondContact CB-O 3.37Å; R655-L780 WeakPolarHBondContact CG-O 3.3Å; R655-D781 IonicContact CZ-OD2 2.83Å; R655-D781 IonicContact NE-OD2 2.66Å; R655-D781 PolarHBondContact NE-OD2 3.45Å; R655-D781 VanDerWaalsContact NE-OD2 3.09Å; R655-D781 IonicContact NH2-OD2 3.36Å; R655-D781 PolarHBondContact NH2-OD2 3.42Å
656	P	92.6	Very high	93.9	Very high	3 Å²	3	9.1 Å²	9.1	2%	0.019	5%	0.052	C	C	.	.	H	α-helix	trans	-53.6	-43.2	-177.7	15.5	-30.3	0	0	0	113.8	V653 S654 L658 V659 D660 W699 R703 F782 I905	V653-P656 VanDerWaalsContact O-CD 3.3Å; V653-P656 WeakPolarHBondContact O-CD 3.23Å; S654-P656 WeakPolarHBondContact O-CD 3.46Å; P656-L658 VanDerWaalsContact C-N 3.26Å; P656-L658 PolarHBondContact O-N 2.78Å; P656-V659 WeakPolarHBondContact O-CA 3.37Å; P656-V659 WeakPolarHBondContact O-CB 3.38Å; P656-V659 PolarHBondContact O-N 3.11Å; P656-V659 VanDerWaalsContact O-N 3.08Å; P656-D660 PolarHBondContact O-N 2.99Å; P656-W699 HydrophobicContact CB-CH2 4.25Å; P656-W699 HydrophobicContact CB-CZ2 3.99Å; P656-R703 VanDerWaalsContact CB-CZ 3.43Å; P656-F782 HydrophobicContact CG-CD2 3.66Å; P656-F782 HydrophobicContact CG-CE2 3.92Å; P656-I905 HydrophobicContact CB-CG2 3.98Å; P656-I905 HydrophobicContact CG-CB 4.18Å; P656-I905 HydrophobicContact CG-CG1 3.92Å; P656-I905 HydrophobicContact CG-CG2 3.74Å
657	S	92.4	Very high	93.5	Very high	0 Å²	0	10.3 Å²	10.3	0%	0	6%	0.057	C	C	.	.	H	α-helix	trans	-65	-33	-177.2	-45.3	0	0	0	0	111.5	R655 F661 F782 D904 I905 F908	R655-S657 VanDerWaalsContact C-N 3.31Å; R655-S657 PolarHBondContact O-N 2.99Å; S657-F661 WeakPolarHBondContact O-CB 3.22Å; S657-F661 PolarHBondContact O-N 3.48Å; S657-F782 VanDerWaalsContact OG-CE2 3.25Å; S657-F782 WeakPolarHBondContact OG-CE2 3.46Å; S657-D904 PolarHBondContact OG-O 3.22Å; S657-I905 PolarHBondContact OG-O 2.91Å; S657-F908 WeakPolarHBondContact O-CD2 3.49Å
658	L	95.6	Very high	93	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-66.4	-41.9	174	-173.8	58.3	0	0	0	110.9	L647 T649 R655 P656 F661 G662 L739 L774 L780	L647-L658 HydrophobicContact CD1-CD1 4Å; L647-L658 HydrophobicContact CD1-CG 3.88Å; L647-L658 HydrophobicContact CD2-CG 4.3Å; L647-L658 WeakPolarHBondContact CD2-O 3.22Å; L647-L658 HydrophobicContact CG-CG 4.11Å; T649-L658 HydrophobicContact CG2-CD2 4.37Å; R655-L658 HydrophobicContact CB-CB 4.17Å; R655-L658 WeakPolarHBondContact O-CB 3.47Å; R655-L658 PolarHBondContact O-N 3.42Å; R655-L658 VanDerWaalsContact O-N 3.1Å; P656-L658 VanDerWaalsContact C-N 3.26Å; P656-L658 PolarHBondContact O-N 2.78Å; L658-F661 PolarHBondContact O-N 2.94Å; L658-G662 PolarHBondContact O-N 3.19Å; L658-L739 HydrophobicContact CD1-CD1 4.34Å; L658-L739 HydrophobicContact CD1-CD2 4.33Å; L658-L739 HydrophobicContact CD1-CG 4.03Å; L658-L774 HydrophobicContact CD1-CB 4.27Å; L658-L774 HydrophobicContact CD1-CD2 4.03Å; L658-L780 HydrophobicContact CB-CD2 4.21Å; L658-L780 HydrophobicContact CD1-CD1 4.27Å
659	V	96.2	Very high	92.7	Very high	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.099	C	C	.	.	H	α-helix	trans	-60.5	-50.1	175.2	-179.6	0	0	0	0	111.2	L647 T649 P652 R655 P656 F661 G662 A663 W699 F700 V705	L647-V659 HydrophobicContact CD2-CB 4.39Å; L647-V659 HydrophobicContact CD2-CG2 4.24Å; T649-V659 HydrophobicContact CG2-CG2 3.76Å; P652-V659 HydrophobicContact CB-CG2 3.95Å; R655-V659 PolarHBondContact O-N 2.97Å; P656-V659 WeakPolarHBondContact O-CA 3.37Å; P656-V659 WeakPolarHBondContact O-CB 3.38Å; P656-V659 PolarHBondContact O-N 3.11Å; P656-V659 VanDerWaalsContact O-N 3.08Å; V659-F661 VanDerWaalsContact C-N 3.31Å; V659-F661 PolarHBondContact O-N 3Å; V659-G662 PolarHBondContact O-N 3.44Å; V659-A663 WeakPolarHBondContact O-CB 3.44Å; V659-A663 PolarHBondContact O-N 3.21Å; V659-W699 HydrophobicContact CB-CH2 4.29Å; V659-W699 HydrophobicContact CB-CZ3 4.47Å; V659-W699 HydrophobicContact CG1-CH2 4.38Å; V659-W699 HydrophobicContact CG1-CZ3 4.13Å; V659-W699 HydrophobicContact CG2-CH2 4.18Å; V659-W699 HydrophobicContact CG2-CZ3 4.27Å; V659-F700 HydrophobicContact CG1-CE1 4.2Å; V659-V705 HydrophobicContact CG1-CB 4.48Å; V659-V705 HydrophobicContact CG1-CG1 3.9Å; V659-V705 HydrophobicContact CG1-CG2 4.33Å
660	D	94.9	Very high	92.8	Very high	6 Å²	6	18.6 Å²	18.6	3%	0.032	11%	0.106	C	C	.	.	H	α-helix	trans	-63.9	-37.1	-178.5	-66.3	-28	0	0	0	112.1	P656 A663 S664 R703 F908 Q909	P656-D660 PolarHBondContact O-N 2.99Å; D660-A663 PolarHBondContact O-N 3.13Å; D660-S664 WeakPolarHBondContact O-CB 3.12Å; D660-S664 PolarHBondContact O-N 2.87Å; D660-S664 PolarHBondContact O-OG 2.81Å; D660-R703 IonicContact OD1-CZ 3.29Å; D660-R703 IonicContact OD1-NE 3.37Å; D660-R703 PolarHBondContact OD1-NE 3.29Å; D660-R703 IonicContact OD1-NH2 3.59Å; D660-R703 IonicContact OD2-CZ 2.72Å; D660-R703 IonicContact OD2-NE 3.15Å; D660-R703 PolarHBondContact OD2-NE 2.66Å; D660-R703 IonicContact OD2-NH2 3.55Å; D660-R703 PolarHBondContact OD2-NH2 3.49Å; D660-F908 HydrophobicContact CB-CB 3.81Å; D660-Q909 HydrophobicContact CB-CG 4.38Å; D660-Q909 PolarHBondContact OD1-NE2 2.9Å; D660-Q909 VanDerWaalsContact OD1-NE2 3.11Å; D660-Q909 VanDerWaalsContact OD2-CG 3.3Å; D660-Q909 WeakPolarHBondContact OD2-CG 3.35Å; D660-Q909 PolarHBondContact OD2-NE2 2.83Å
661	F	96	Very high	93.1	Very high	0 Å²	0	19 Å²	19	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-64.7	-46.8	175.3	-169.7	-95.8	0	0	0	111.2	S657 L658 V659 A663 S664 I665 L739 L774 F908 L936 F942 L1057 L1091	S657-F661 WeakPolarHBondContact O-CB 3.22Å; S657-F661 PolarHBondContact O-N 3.48Å; L658-F661 PolarHBondContact O-N 2.94Å; V659-F661 VanDerWaalsContact C-N 3.31Å; V659-F661 PolarHBondContact O-N 3Å; F661-A663 PolarHBondContact O-N 3.13Å; F661-S664 WeakPolarHBondContact O-CB 3.37Å; F661-S664 PolarHBondContact O-N 3.37Å; F661-I665 HydrophobicContact CD1-CD1 4Å; F661-I665 HydrophobicContact CE1-CD1 3.74Å; F661-I665 PolarHBondContact O-N 3.23Å; F661-L739 HydrophobicContact CD1-CD2 3.84Å; F661-L739 HydrophobicContact CE1-CD2 4.43Å; F661-L774 HydrophobicContact CB-CD2 3.98Å; F661-L774 HydrophobicContact CD1-CD2 4Å; F661-L774 HydrophobicContact CD2-CD2 4.33Å; F661-L774 HydrophobicContact CE1-CD1 4.37Å; F661-L774 HydrophobicContact CE2-CD1 4.37Å; F661-L774 HydrophobicContact CG-CD2 3.84Å; F661-L774 HydrophobicContact CZ-CD1 4.29Å; F661-F908 HydrophobicContact CB-CD2 3.93Å; F661-F908 HydrophobicContact CB-CE2 4.06Å; F661-F908 HydrophobicContact CB-CG 4.29Å; F661-F908 AromaticContact CD2-CD1 3.96Å; F661-F908 HydrophobicContact CD2-CD1 3.96Å; F661-F908 HydrophobicContact CD2-CD2 4.39Å; F661-F908 AromaticContact CD2-CE1 3.73Å; F661-F908 HydrophobicContact CD2-CE1 3.73Å; F661-F908 HydrophobicContact CD2-CE2 4.18Å; F661-F908 HydrophobicContact CD2-CG 4.25Å; F661-F908 AromaticContact CD2-CZ 3.83Å; F661-F908 HydrophobicContact CD2-CZ 3.83Å; F661-F908 HydrophobicContact CE2-CE1 4.29Å; F661-F908 HydrophobicContact CG-CE2 4.48Å; F661-L936 HydrophobicContact CE2-CD1 4.12Å; F661-L936 HydrophobicContact CZ-CD1 3.97Å; F661-F942 AromaticContact CD2-CE1 3.99Å; F661-F942 HydrophobicContact CD2-CE1 3.99Å; F661-F942 AromaticContact CD2-CZ 3.97Å; F661-F942 HydrophobicContact CD2-CZ 3.97Å; F661-F942 HydrophobicContact CE2-CE1 4.19Å; F661-F942 AromaticContact CE2-CZ 3.93Å; F661-F942 HydrophobicContact CE2-CZ 3.93Å; F661-L1057 HydrophobicContact CE2-CD1 4.27Å; F661-L1057 HydrophobicContact CE2-CD2 4.28Å; F661-L1057 HydrophobicContact CZ-CD1 4.41Å; F661-L1057 HydrophobicContact CZ-CD2 4.32Å; F661-L1091 HydrophobicContact CE1-CD1 3.86Å; F661-L1091 HydrophobicContact CE1-CD2 4.1Å; F661-L1091 HydrophobicContact CZ-CD1 4.27Å; F661-L1091 HydrophobicContact CZ-CD2 4.04Å
662	G	95.9	Very high	93.4	Very high	0 Å²	0	17.9 Å²	17.9	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-62.6	-39.7	174.9	0	0	0	0	0	113.4	L658 V659 S664 I665 T666	L658-G662 PolarHBondContact O-N 3.19Å; V659-G662 PolarHBondContact O-N 3.44Å; G662-S664 VanDerWaalsContact C-N 3.33Å; G662-S664 PolarHBondContact O-N 3.32Å; G662-I665 PolarHBondContact O-N 3.46Å; G662-T666 PolarHBondContact O-N 3.42Å; G662-T666 VanDerWaalsContact O-N 3.13Å; G662-T666 PolarHBondContact O-OG1 3.24Å
663	A	94.9	Very high	93.7	Very high	17 Å²	17	18.2 Å²	18.2	14%	0.14	10%	0.1	C	C	.	.	H	α-helix	trans	-64.2	-37.4	174.8	0	0	0	0	0	112.1	V659 D660 F661 I665 T666 K667 L672 V705	V659-A663 WeakPolarHBondContact O-CB 3.44Å; V659-A663 PolarHBondContact O-N 3.21Å; D660-A663 PolarHBondContact O-N 3.13Å; F661-A663 PolarHBondContact O-N 3.13Å; A663-I665 PolarHBondContact O-N 3.09Å; A663-T666 PolarHBondContact O-N 2.67Å; A663-T666 PolarHBondContact O-OG1 3Å; A663-K667 PolarHBondContact O-N 3.29Å; A663-L672 HydrophobicContact CB-CD2 4.13Å; A663-V705 HydrophobicContact CB-CG1 3.82Å; A663-V705 HydrophobicContact CB-CG2 4.15Å
664	S	94	Very high	94.1	Very high	14 Å²	14	18.2 Å²	18.2	10%	0.098	10%	0.1	C	C	.	.	H	α-helix	trans	-65.7	-26.6	176.6	-63.1	0	0	0	0	113.2	D660 F661 G662 K667	D660-S664 WeakPolarHBondContact O-CB 3.12Å; D660-S664 PolarHBondContact O-N 2.87Å; D660-S664 PolarHBondContact O-OG 2.81Å; F661-S664 WeakPolarHBondContact O-CB 3.37Å; F661-S664 PolarHBondContact O-N 3.37Å; G662-S664 VanDerWaalsContact C-N 3.33Å; G662-S664 PolarHBondContact O-N 3.32Å; S664-K667 WeakPolarHBondContact O-CE 3.32Å; S664-K667 WeakPolarHBondContact O-CG 3.33Å
665	I	95.5	Very high	94.4	Very high	8 Å²	8	17.8 Å²	17.8	4%	0.041	10%	0.097	C	C	.	.	H	α-helix	trans	-78.4	-46.5	174.3	-64.5	168.7	0	0	0	110.8	P643 L645 F661 G662 A663 L739 I932 L935 L936	P643-I665 HydrophobicContact CB-CG2 4.49Å; L645-I665 HydrophobicContact CD1-CB 4.1Å; L645-I665 HydrophobicContact CD1-CD1 4.22Å; L645-I665 HydrophobicContact CD1-CG2 4.09Å; F661-I665 HydrophobicContact CD1-CD1 4Å; F661-I665 HydrophobicContact CE1-CD1 3.74Å; F661-I665 PolarHBondContact O-N 3.23Å; G662-I665 PolarHBondContact O-N 3.46Å; A663-I665 PolarHBondContact O-N 3.09Å; I665-L739 HydrophobicContact CD1-CD2 4.39Å; I665-I932 HydrophobicContact CD1-CG2 3.79Å; I665-I932 HydrophobicContact CG1-CG2 4.14Å; I665-I932 HydrophobicContact CG2-CD1 3.66Å; I665-L935 HydrophobicContact CG2-CD1 4.34Å; I665-L936 HydrophobicContact CG1-CD2 3.91Å; I665-L936 HydrophobicContact CG1-CG 4.35Å
666	T	94.7	Very high	94.5	Very high	1 Å²	1	15.3 Å²	15.3	1%	0.006	9%	0.088	C	C	.	.	H	α-helix	trans	-84.4	-31.1	-169.9	51.1	0	0	0	0	114.3	L645 G662 A663 D668 V669 C670 L672	L645-T666 HydrophobicContact CB-CG2 4.26Å; L645-T666 HydrophobicContact CD1-CG2 3.72Å; L645-T666 HydrophobicContact CG-CG2 3.69Å; G662-T666 PolarHBondContact O-N 3.42Å; G662-T666 VanDerWaalsContact O-N 3.13Å; G662-T666 PolarHBondContact O-OG1 3.24Å; A663-T666 PolarHBondContact O-N 2.67Å; A663-T666 PolarHBondContact O-OG1 3Å; T666-D668 PolarHBondContact O-N 3.12Å; T666-D668 VanDerWaalsContact O-N 3.13Å; T666-V669 VanDerWaalsContact O-CG2 3.23Å; T666-V669 WeakPolarHBondContact O-CG2 3.2Å; T666-V669 PolarHBondContact O-N 3Å; T666-C670 HydrophobicContact CG2-CB 3.98Å; T666-C670 PolarHBondContact O-N 3.29Å; T666-C670 VanDerWaalsContact O-N 3.11Å; T666-L672 HydrophobicContact CG2-CB 4.1Å; T666-L672 HydrophobicContact CG2-CD1 4.32Å
667	K	90.1	Very high	94.6	Very high	25 Å²	25	16 Å²	16	11%	0.109	9%	0.093	C	C	.	.	T	Hydrogen-bonded Turn	trans	49.4	39.1	171.6	-52.8	-177.9	-176.4	-169.3	0	114.7	A663 S664 V669 L935 L938 P939	A663-K667 PolarHBondContact O-N 3.29Å; S664-K667 WeakPolarHBondContact O-CE 3.32Å; S664-K667 WeakPolarHBondContact O-CG 3.33Å; K667-V669 HydrophobicContact CB-CG2 4.36Å; K667-V669 PolarHBondContact O-N 3.04Å; K667-L935 WeakPolarHBondContact CE-O 3.26Å; K667-L935 PolarHBondContact NZ-O 3.5Å; K667-L938 PolarHBondContact NZ-O 3.19Å; K667-L938 VanDerWaalsContact NZ-O 3.09Å; K667-P939 PolarHBondContact NZ-O 2.82Å
668	D	87.4	Confident	94.5	Very high	78 Å²	78	17.3 Å²	17.3	42%	0.417	10%	0.1	S	C	.	.	T	Hydrogen-bonded Turn	trans	59.8	6.5	-178	-53.3	-16.9	0	0	0	115.5	T666 K706	T666-D668 PolarHBondContact O-N 3.12Å; T666-D668 VanDerWaalsContact O-N 3.13Å; D668-K706 HydrophobicContact CB-CD 4.02Å; D668-K706 WeakPolarHBondContact OD1-CB 3.35Å; D668-K706 WeakPolarHBondContact OD2-CD 3.35Å; D668-K706 VanDerWaalsContact OD2-CE 3.25Å; D668-K706 WeakPolarHBondContact OD2-CE 3.41Å; D668-K706 IonicContact OD2-NZ 2.87Å; D668-K706 PolarHBondContact OD2-NZ 3.25Å
669	V	90.8	Very high	94.1	Very high	90 Å²	90	22.8 Å²	22.8	55%	0.545	13%	0.128	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.6	-6.5	179.8	-64.4	0	0	0	0	112.6	R642 T666 K667	R642-V669 PolarHBondContact NH1-O 3.33Å; T666-V669 VanDerWaalsContact O-CG2 3.23Å; T666-V669 WeakPolarHBondContact O-CG2 3.2Å; T666-V669 PolarHBondContact O-N 3Å; K667-V669 HydrophobicContact CB-CG2 4.36Å; K667-V669 PolarHBondContact O-N 3.04Å
670	C	93.4	Very high	93.4	Very high	22 Å²	22	24.5 Å²	24.5	15%	0.149	14%	0.14	C	C	.	.	S	Bend	trans	-126.9	156.8	174.3	-55.1	0	0	0	0	109.9	R642 P643 T666 L672	R642-C670 HydrophobicContact CB-CB 4.45Å; P643-C670 WeakPolarHBondContact O-CB 3.19Å; T666-C670 HydrophobicContact CG2-CB 3.98Å; T666-C670 PolarHBondContact O-N 3.29Å; T666-C670 VanDerWaalsContact O-N 3.11Å; C670-L672 PolarHBondContact O-N 3.35Å
671	L	95.8	Very high	92.6	Very high	26 Å²	26	28.9 Å²	28.9	14%	0.136	17%	0.171	C	C	.	.			trans	-66.4	129.8	178.9	-178.8	66.1	0	0	0	110.3	Q644 L645 V673 F708 P735	Q644-L671 CarbonylContact C-O 3.33Å; Q644-L671 WeakPolarHBondContact CA-O 3.41Å; Q644-L671 HydrophobicContact CB-CB 3.93Å; Q644-L671 HydrophobicContact CB-CD2 4.33Å; Q644-L671 HydrophobicContact CG-CB 3.99Å; L645-L671 PolarHBondContact N-O 2.91Å; L671-V673 HydrophobicContact CD1-CG2 3.96Å; L671-V673 HydrophobicContact CD2-CG2 4.19Å; L671-V673 HydrophobicContact CG-CG2 3.91Å; L671-F708 HydrophobicContact CD1-CD2 3.66Å; L671-F708 HydrophobicContact CD1-CE2 3.69Å; L671-P735 HydrophobicContact CD2-CG 4.47Å
672	L	97.3	Very high	91.7	Very high	4 Å²	4	34.8 Å²	34.8	2%	0.021	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	123	170.7	-177.6	62	0	0	0	108.6	L645 L647 A663 T666 C670 V705 S707 F708	L645-L672 HydrophobicContact CB-CD1 3.83Å; L645-L672 HydrophobicContact CD1-CD1 4.26Å; L647-L672 HydrophobicContact CB-CD1 4.27Å; L647-L672 HydrophobicContact CD2-CD1 4.47Å; A663-L672 HydrophobicContact CB-CD2 4.13Å; T666-L672 HydrophobicContact CG2-CB 4.1Å; T666-L672 HydrophobicContact CG2-CD1 4.32Å; C670-L672 PolarHBondContact O-N 3.35Å; L672-V705 HydrophobicContact CD2-CG1 4.18Å; L672-S707 WeakPolarHBondContact CG-OG 3.5Å; L672-S707 PolarHBondContact O-OG 3.27Å; L672-F708 PolarHBondContact O-N 2.98Å
673	V	97.8	Very high	90.7	Very high	7 Å²	7	40.5 Å²	40.5	4%	0.042	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	117.7	176.7	-170.7	0	0	0	0	109.3	L645 L646 L647 L671 G675 F708 T710 V728 P735	L645-V673 PolarHBondContact O-N 2.89Å; L646-V673 HydrophobicContact CD1-CB 4.27Å; L646-V673 HydrophobicContact CD1-CG1 4.31Å; L647-V673 PolarHBondContact N-O 3.2Å; L671-V673 HydrophobicContact CD1-CG2 3.96Å; L671-V673 HydrophobicContact CD2-CG2 4.19Å; L671-V673 HydrophobicContact CG-CG2 3.91Å; V673-G675 PolarHBondContact O-N 3.34Å; V673-F708 CarbonylContact C-O 3.34Å; V673-F708 WeakPolarHBondContact CA-O 3.42Å; V673-F708 HydrophobicContact CB-CB 4.49Å; V673-F708 HydrophobicContact CG1-CB 4.19Å; V673-F708 HydrophobicContact CG2-CB 4.21Å; V673-F708 HydrophobicContact CG2-CD2 4.5Å; V673-T710 HydrophobicContact CG1-CG2 3.54Å; V673-V728 HydrophobicContact CB-CG1 4.13Å; V673-V728 HydrophobicContact CG1-CG1 3.83Å; V673-V728 HydrophobicContact CG2-CG1 3.93Å; V673-P735 HydrophobicContact CG2-CG 4.49Å
674	C	97.7	Very high	89.5	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	111.1	169.6	-64.2	0	0	0	0	109.5	L647 T649 P652 F700 S707 F708 Y709 T710	L647-C674 CarbonylContact O-C 3.47Å; L647-C674 WeakPolarHBondContact O-CA 3.46Å; T649-C674 HydrophobicContact CG2-CB 4.19Å; P652-C674 HydrophobicContact CG-CB 4.08Å; C674-F700 HydrophobicContact CB-CZ 3.96Å; C674-S707 PolarHBondContact SG-OG 3.21Å; C674-S707 VanDerWaalsContact SG-OG 3.33Å; C674-F708 PolarHBondContact N-O 3.34Å; C674-Y709 HydrophobicContact CB-CD2 4.33Å; C674-T710 PolarHBondContact O-N 3.09Å; C674-T710 VanDerWaalsContact O-O 3.11Å
675	G	96.4	Very high	88.8	Confident	1 Å²	1	49.5 Å²	49.5	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	128.5	175.9	0	0	0	0	0	111.9	L647 T649 G650 V673 T710	L647-G675 PolarHBondContact O-N 2.87Å; T649-G675 PolarHBondContact N-O 3.14Å; G650-G675 PolarHBondContact N-O 3.03Å; V673-G675 PolarHBondContact O-N 3.34Å; G675-T710 WeakPolarHBondContact CA-O 3.44Å
676	H	94.6	Very high	88.1	Confident	19 Å²	19	59.4 Å²	59.4	9%	0.088	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	118.6	178.2	-173.8	178.7	0	0	0	110.5	G650 N651 L678 Y709 T710 F711 V712	G650-H676 VanDerWaalsContact CA-CD2 3.43Å; G650-H676 WeakPolarHBondContact CA-CD2 3.36Å; G650-H676 WeakPolarHBondContact O-CB 3.43Å; G650-H676 VanDerWaalsContact O-CG 3.31Å; N651-H676 PolarHBondContact N-CE1 3.37Å; N651-H676 PolarHBondContact N-NE2 3.2Å; H676-L678 VanDerWaalsContact CE1-CD2 3.43Å; H676-L678 WeakPolarHBondContact CE1-CD2 3.41Å; H676-L678 WeakPolarHBondContact NE2-CD2 3.45Å; H676-Y709 HydrophobicContact CB-CE2 3.7Å; H676-Y709 AromaticContact ND1-CZ 3.89Å; H676-Y709 PolarHBondContact ND1-OH 2.56Å; H676-T710 PolarHBondContact N-O 3.39Å; H676-F711 HydrophobicContact CB-CB 3.83Å; H676-F711 CarbonylContact O-C 3.48Å; H676-F711 WeakPolarHBondContact O-CA 3.18Å; H676-F711 VanDerWaalsContact O-CB 3.24Å; H676-F711 WeakPolarHBondContact O-CB 3.45Å; H676-V712 PolarHBondContact O-N 2.92Å
677	V	94.3	Very high	87.5	Confident	18 Å²	18	67.3 Å²	67.3	11%	0.109	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	111.7	168.8	-177.2	0	0	0	0	108.2	L679 V712 L717 V721 L724	V677-L679 HydrophobicContact CG1-CD2 4.21Å; V677-V712 HydrophobicContact CB-CG2 4.3Å; V677-V712 HydrophobicContact CG1-CG2 4.28Å; V677-V712 HydrophobicContact CG2-CG2 3.83Å; V677-L717 HydrophobicContact CB-CD1 4.02Å; V677-L717 HydrophobicContact CG1-CD1 4.46Å; V677-L717 HydrophobicContact CG2-CD1 4.07Å; V677-V721 HydrophobicContact CG2-CG2 3.99Å; V677-L724 HydrophobicContact CG2-CD1 3.68Å
678	L	90.1	Very high	87	Confident	28 Å²	28	70 Å²	70	15%	0.147	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.7	109.9	172.9	-72.8	168.2	0	0	0	108.4	H676 S680 F684 L692 F711 V712 V713 S714	H676-L678 VanDerWaalsContact CE1-CD2 3.43Å; H676-L678 WeakPolarHBondContact CE1-CD2 3.41Å; H676-L678 WeakPolarHBondContact NE2-CD2 3.45Å; L678-S680 PolarHBondContact O-N 3.43Å; L678-S680 VanDerWaalsContact O-N 3.17Å; L678-F684 HydrophobicContact CB-CE2 4.41Å; L678-F684 HydrophobicContact CD1-CE2 4.41Å; L678-F684 HydrophobicContact CD1-CZ 4.29Å; L678-L692 HydrophobicContact CD1-CD2 4.41Å; L678-F711 HydrophobicContact CD1-CD2 3.56Å; L678-F711 HydrophobicContact CD1-CE2 3.99Å; L678-F711 HydrophobicContact CD1-CG 4.21Å; L678-F711 HydrophobicContact CG-CD2 4.44Å; L678-V712 PolarHBondContact N-O 3.04Å; L678-V713 HydrophobicContact CB-CG2 4.39Å; L678-V713 WeakPolarHBondContact O-CA 3.18Å; L678-S714 PolarHBondContact O-N 3.25Å; L678-S714 VanDerWaalsContact O-N 3.13Å
679	L	87.9	Confident	86.8	Confident	114 Å²	114	68.6 Å²	68.6	60%	0.597	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.9	102.1	176.6	-63.2	174.9	0	0	0	109.4	V677 S714	V677-L679 HydrophobicContact CG1-CD2 4.21Å; L679-S714 WeakPolarHBondContact CA-O 3.23Å
680	S	82.5	Confident	86.6	Confident	37 Å²	37	68.7 Å²	68.7	26%	0.259	35%	0.347	S	S	.	.			trans	-162	140.2	176.8	-168.5	0	0	0	0	110.4	L678 L682 V713 S714	L678-S680 PolarHBondContact O-N 3.43Å; L678-S680 VanDerWaalsContact O-N 3.17Å; S680-L682 PolarHBondContact OG-N 2.92Å; S680-V713 WeakPolarHBondContact O-CG1 3.37Å; S680-S714 PolarHBondContact N-O 2.86Å
681	S	76.5	Confident	86.2	Confident	98 Å²	98	70.9 Å²	70.9	69%	0.685	35%	0.353	S	S	*	.	S	Bend	trans	-87.1	-12.7	172.6	56.9	0	0	0	0	113.3	D715	S681-D715 VanDerWaalsContact CA-OD1 3.3Å; S681-D715 WeakPolarHBondContact CA-OD1 3.37Å; S681-D715 WeakPolarHBondContact CB-OD1 3.45Å
682	L	77.6	Confident	85.8	Confident	123 Å²	123	70.5 Å²	70.5	64%	0.644	35%	0.351	S	S	*	.	S	Bend	trans	-95	143.2	-176.5	-64.9	179.7	0	0	0	111.8	S680 F684	S680-L682 PolarHBondContact OG-N 2.92Å; L682-F684 PolarHBondContact O-N 2.98Å
683	P	74.3	Confident	85.6	Confident	121 Å²	121	72.4 Å²	72.4	79%	0.786	36%	0.361	S	S	*	.	P	Polyproline II helix	trans	-67.8	127.4	175.2	27.5	-32.9	0	0	0	110.5
684	F	70.9	Confident	85.2	Confident	73 Å²	73	76.7 Å²	76.7	32%	0.32	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-72.9	143.2	174.5	-86.4	-97.2	0	0	0	112	L678 L682 R686 M689 V713	L678-F684 HydrophobicContact CB-CE2 4.41Å; L678-F684 HydrophobicContact CD1-CE2 4.41Å; L678-F684 HydrophobicContact CD1-CZ 4.29Å; L682-F684 PolarHBondContact O-N 2.98Å; F684-R686 PolarHBondContact O-N 3.21Å; F684-M689 HydrophobicContact CB-CE 3.88Å; F684-M689 HydrophobicContact CB-CG 3.83Å; F684-M689 HydrophobicContact CB-SD 3.91Å; F684-V713 HydrophobicContact CD2-CG1 4.1Å; F684-V713 HydrophobicContact CD2-CG2 3.71Å; F684-V713 HydrophobicContact CE2-CG1 4.24Å; F684-V713 HydrophobicContact CE2-CG2 4.19Å
685	K	78.4	Confident	84.9	Confident	146 Å²	146	77.8 Å²	77.8	64%	0.635	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-70.7	129.8	169.6	-67	-178.2	-178.9	176.9	0	109.3	Q687 Q688 M689	K685-Q687 PolarHBondContact O-N 3.25Å; K685-Q688 HydrophobicContact CB-CG 4.36Å; K685-Q688 PolarHBondContact O-N 3.19Å; K685-M689 PolarHBondContact O-N 3.19Å
686	R	81.7	Confident	84.8	Confident	217 Å²	217	77.8 Å²	77.8	82%	0.819	39%	0.385	S	S	*	.	H	α-helix	trans	-49.6	-36.8	178.6	-175.2	176.7	-179.6	134.6	1.3	113.8	F684 M689 Q690	F684-R686 PolarHBondContact O-N 3.21Å; R686-M689 PolarHBondContact O-N 2.77Å; R686-Q690 PolarHBondContact O-N 3.48Å
687	Q	81.1	Confident	84.7	Confident	166 Å²	166	81 Å²	81	78%	0.776	40%	0.398	S	S	*	.	H	α-helix	trans	-65.1	-41.5	178.8	-71.7	177.9	-18.8	0	0	112.8	K685 M689 Q690 K691	K685-Q687 PolarHBondContact O-N 3.25Å; Q687-M689 VanDerWaalsContact C-N 3.34Å; Q687-Q690 PolarHBondContact O-N 3.02Å; Q687-K691 WeakPolarHBondContact O-CB 3.49Å; Q687-K691 PolarHBondContact O-N 3.32Å
688	Q	80	Confident	84.6	Confident	81 Å²	81	85.4 Å²	85.4	38%	0.379	42%	0.417	S	S	.	.	H	α-helix	trans	-66.4	-40	177.9	-68.7	170.8	-27.4	0	0	110.7	K685 K691 L692 F881	K685-Q688 HydrophobicContact CB-CG 4.36Å; K685-Q688 PolarHBondContact O-N 3.19Å; Q688-K691 PolarHBondContact O-N 3.13Å; Q688-L692 PolarHBondContact O-N 2.89Å; Q688-F881 HydrophobicContact CB-CZ 4.41Å; Q688-F881 HydrophobicContact CG-CZ 4.35Å
689	M	83.7	Confident	84.7	Confident	49 Å²	49	85.5 Å²	85.5	24%	0.241	42%	0.415	C	S	.	.	H	α-helix	trans	-61.4	-46.1	175.5	-66	168.6	125.2	0	0	112.2	F684 K685 R686 Q687 L692 I693 F711 V713	F684-M689 HydrophobicContact CB-CE 3.88Å; F684-M689 HydrophobicContact CB-CG 3.83Å; F684-M689 HydrophobicContact CB-SD 3.91Å; K685-M689 PolarHBondContact O-N 3.19Å; R686-M689 PolarHBondContact O-N 2.77Å; Q687-M689 VanDerWaalsContact C-N 3.34Å; M689-L692 PolarHBondContact O-N 2.96Å; M689-I693 WeakPolarHBondContact O-CG1 3.24Å; M689-I693 PolarHBondContact O-N 2.85Å; M689-F711 HydrophobicContact CB-CE1 4.25Å; M689-F711 HydrophobicContact CB-CZ 3.72Å; M689-F711 HydrophobicContact CE-CE2 3.23Å; M689-F711 HydrophobicContact CE-CZ 3.32Å; M689-F711 HydrophobicContact CG-CE2 4.15Å; M689-F711 HydrophobicContact CG-CZ 3.57Å; M689-F711 HydrophobicContact SD-CE2 4.4Å; M689-F711 HydrophobicContact SD-CZ 3.95Å; M689-V713 HydrophobicContact CE-CG2 4.16Å
690	Q	86.5	Confident	85	Confident	93 Å²	93	80.2 Å²	80.2	44%	0.435	39%	0.388	S	S	.	.	H	α-helix	trans	-63.3	-43	178.6	-174.9	62.9	28.5	0	0	111.2	R686 Q687 L692 I693 E694	R686-Q690 PolarHBondContact O-N 3.48Å; Q687-Q690 PolarHBondContact O-N 3.02Å; Q690-L692 PolarHBondContact O-N 3.47Å; Q690-I693 PolarHBondContact O-N 2.95Å; Q690-E694 WeakPolarHBondContact CG-OE1 3.05Å; Q690-E694 PolarHBondContact NE2-OE1 3.45Å; Q690-E694 WeakPolarHBondContact O-CG 3.39Å; Q690-E694 PolarHBondContact O-N 3.42Å
691	K	86	Confident	85.4	Confident	67 Å²	67	83.7 Å²	83.7	29%	0.291	41%	0.407	S	S	.	.	H	α-helix	trans	-58.7	-46.1	175.5	-171.8	180	179.3	-173.7	0	111.5	Q687 Q688 I693 E694 E695 F881	Q687-K691 WeakPolarHBondContact O-CB 3.49Å; Q687-K691 PolarHBondContact O-N 3.32Å; Q688-K691 PolarHBondContact O-N 3.13Å; K691-I693 PolarHBondContact O-N 2.95Å; K691-E694 PolarHBondContact O-N 2.77Å; K691-E695 WeakPolarHBondContact CE-OE1 3.15Å; K691-E695 VanDerWaalsContact O-CB 3.29Å; K691-E695 WeakPolarHBondContact O-CB 3.44Å; K691-E695 WeakPolarHBondContact O-CG 3.41Å; K691-E695 PolarHBondContact O-N 3.09Å; K691-F881 HydrophobicContact CD-CE2 4.41Å
692	L	87.1	Confident	86	Confident	18 Å²	18	87 Å²	87	9%	0.094	41%	0.409	C	S	.	.	H	α-helix	trans	-60.6	-43.9	176.7	178.1	64.3	0	0	0	112.3	L678 Q688 M689 Q690 E695 I696 F881	L678-L692 HydrophobicContact CD1-CD2 4.41Å; Q688-L692 PolarHBondContact O-N 2.89Å; M689-L692 PolarHBondContact O-N 2.96Å; Q690-L692 PolarHBondContact O-N 3.47Å; L692-E695 PolarHBondContact O-N 3.31Å; L692-I696 HydrophobicContact CD1-CD1 3.79Å; L692-I696 HydrophobicContact CD1-CG1 4.29Å; L692-I696 HydrophobicContact CG-CD1 3.91Å; L692-I696 VanDerWaalsContact O-CG1 3.31Å; L692-I696 WeakPolarHBondContact O-CG1 3.31Å; L692-I696 PolarHBondContact O-N 3.07Å; L692-F881 HydrophobicContact CD1-CB 4.13Å
693	I	92	Very high	86.5	Confident	44 Å²	44	83 Å²	83	23%	0.226	39%	0.386	C	S	.	.	H	α-helix	trans	-59.6	-49	177.1	-69.9	165.8	0	0	0	110.4	M689 Q690 K691 I696 Y697 Y709 F711	M689-I693 WeakPolarHBondContact O-CG1 3.24Å; M689-I693 PolarHBondContact O-N 2.85Å; Q690-I693 PolarHBondContact O-N 2.95Å; K691-I693 PolarHBondContact O-N 2.95Å; I693-I696 PolarHBondContact O-N 3.36Å; I693-Y697 HydrophobicContact CG2-CD2 3.59Å; I693-Y697 HydrophobicContact CG2-CE2 3.6Å; I693-Y697 VanDerWaalsContact O-CD2 3.3Å; I693-Y697 WeakPolarHBondContact O-CD2 3.34Å; I693-Y697 PolarHBondContact O-N 3.36Å; I693-Y709 HydrophobicContact CG1-CD1 4.03Å; I693-Y709 HydrophobicContact CG1-CE1 4.06Å; I693-F711 HydrophobicContact CD1-CE1 3.96Å; I693-F711 HydrophobicContact CG1-CD1 4.42Å; I693-F711 HydrophobicContact CG1-CE1 4.07Å
694	E	90.5	Very high	87.3	Confident	97 Å²	97	86.3 Å²	86.3	45%	0.453	39%	0.388	S	S	.	.	H	α-helix	trans	-61.1	-45.9	-179.5	-73	169.2	-166	0	0	111.7	Q690 K691 I696 Y697 Q698	Q690-E694 WeakPolarHBondContact CG-OE1 3.05Å; Q690-E694 PolarHBondContact NE2-OE1 3.45Å; Q690-E694 WeakPolarHBondContact O-CG 3.39Å; Q690-E694 PolarHBondContact O-N 3.42Å; K691-E694 PolarHBondContact O-N 2.77Å; E694-I696 VanDerWaalsContact C-N 3.32Å; E694-I696 PolarHBondContact O-N 2.76Å; E694-Y697 PolarHBondContact O-N 3.09Å; E694-Q698 WeakPolarHBondContact O-CG 3.29Å; E694-Q698 PolarHBondContact O-N 3.02Å
695	E	90.1	Very high	88.3	Confident	24 Å²	24	83.5 Å²	83.5	11%	0.112	38%	0.377	C	S	.	.	H	α-helix	trans	-55.6	-43.5	174.9	-87.7	-178.7	-162.5	0	0	112.3	K691 L692 Q698 W699 I882	K691-E695 WeakPolarHBondContact CE-OE1 3.15Å; K691-E695 VanDerWaalsContact O-CB 3.29Å; K691-E695 WeakPolarHBondContact O-CB 3.44Å; K691-E695 WeakPolarHBondContact O-CG 3.41Å; K691-E695 PolarHBondContact O-N 3.09Å; L692-E695 PolarHBondContact O-N 3.31Å; E695-Q698 PolarHBondContact O-N 3.44Å; E695-W699 PolarHBondContact O-N 3.49Å; E695-I882 HydrophobicContact CB-CD1 3.5Å; E695-I882 VanDerWaalsContact CB-CD1 3.5Å; E695-I882 HydrophobicContact CB-CG1 4.2Å; E695-I882 HydrophobicContact CG-CD1 3.93Å
696	I	94.1	Very high	89	Confident	0 Å²	0	83.4 Å²	83.4	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-70.9	-40.8	178.9	-70.9	169.6	0	0	0	111.9	P652 L692 I693 E694 Q698 W699 F700 Y709	P652-I696 HydrophobicContact CG-CD1 4.49Å; P652-I696 HydrophobicContact CG-CG2 4.09Å; L692-I696 HydrophobicContact CD1-CD1 3.79Å; L692-I696 HydrophobicContact CD1-CG1 4.29Å; L692-I696 HydrophobicContact CG-CD1 3.91Å; L692-I696 VanDerWaalsContact O-CG1 3.31Å; L692-I696 WeakPolarHBondContact O-CG1 3.31Å; L692-I696 PolarHBondContact O-N 3.07Å; I693-I696 PolarHBondContact O-N 3.36Å; E694-I696 VanDerWaalsContact C-N 3.32Å; E694-I696 PolarHBondContact O-N 2.76Å; I696-Q698 VanDerWaalsContact C-N 3.31Å; I696-Q698 PolarHBondContact O-N 3.36Å; I696-W699 CarbonylContact O-C 3.59Å; I696-W699 WeakPolarHBondContact O-CA 3.46Å; I696-W699 WeakPolarHBondContact O-CB 3.06Å; I696-W699 PolarHBondContact O-N 2.79Å; I696-W699 VanDerWaalsContact O-N 3.12Å; I696-F700 HydrophobicContact CG2-CD2 4.21Å; I696-F700 HydrophobicContact CG2-CE1 4.4Å; I696-F700 HydrophobicContact CG2-CE2 3.8Å; I696-F700 HydrophobicContact CG2-CZ 3.87Å; I696-F700 PolarHBondContact O-N 2.85Å; I696-Y709 HydrophobicContact CB-CD1 4.46Å; I696-Y709 HydrophobicContact CB-CG 4.4Å; I696-Y709 HydrophobicContact CD1-CD1 3.97Å; I696-Y709 HydrophobicContact CD1-CD2 3.91Å; I696-Y709 HydrophobicContact CD1-CE1 3.49Å; I696-Y709 VanDerWaalsContact CD1-CE1 3.49Å; I696-Y709 HydrophobicContact CD1-CE2 3.41Å; I696-Y709 VanDerWaalsContact CD1-CE2 3.41Å; I696-Y709 HydrophobicContact CD1-CG 4.15Å; I696-Y709 WeakPolarHBondContact CD1-OH 3.29Å; I696-Y709 HydrophobicContact CG2-CD1 4.31Å; I696-Y709 HydrophobicContact CG2-CD2 3.87Å; I696-Y709 HydrophobicContact CG2-CE2 4.45Å; I696-Y709 HydrophobicContact CG2-CG 3.77Å
697	Y	94.3	Very high	89.6	Confident	87 Å²	87	73.5 Å²	73.5	34%	0.341	34%	0.34	S	S	.	.	H	α-helix	trans	-65.4	-34.8	175.2	-84.8	-66.4	0	0	0	112.6	I693 E694 W699 F700 T701 S707 Y709	I693-Y697 HydrophobicContact CG2-CD2 3.59Å; I693-Y697 HydrophobicContact CG2-CE2 3.6Å; I693-Y697 VanDerWaalsContact O-CD2 3.3Å; I693-Y697 WeakPolarHBondContact O-CD2 3.34Å; I693-Y697 PolarHBondContact O-N 3.36Å; E694-Y697 PolarHBondContact O-N 3.09Å; Y697-W699 VanDerWaalsContact C-N 3.32Å; Y697-F700 AromaticContact CD1-CD2 3.99Å; Y697-F700 HydrophobicContact CD1-CD2 3.99Å; Y697-F700 HydrophobicContact CE1-CD2 4.3Å; Y697-F700 PolarHBondContact O-N 2.82Å; Y697-T701 PolarHBondContact O-N 3.29Å; Y697-T701 PolarHBondContact O-OG1 3.36Å; Y697-S707 WeakPolarHBondContact CE1-O 3.4Å; Y697-Y709 PolarHBondContact OH-N 3.02Å
698	Q	90.7	Very high	90.3	Very high	111 Å²	111	71.4 Å²	71.4	52%	0.519	33%	0.329	S	S	.	.	H	α-helix	trans	-62.7	-42	170.3	-71.7	177.3	16.5	0	0	111.1	E694 E695 I696 T701 K702	E694-Q698 WeakPolarHBondContact O-CG 3.29Å; E694-Q698 PolarHBondContact O-N 3.02Å; E695-Q698 PolarHBondContact O-N 3.44Å; I696-Q698 VanDerWaalsContact C-N 3.31Å; I696-Q698 PolarHBondContact O-N 3.36Å; Q698-T701 PolarHBondContact O-N 3.12Å; Q698-K702 WeakPolarHBondContact O-CG 3.12Å; Q698-K702 PolarHBondContact O-N 2.86Å
699	W	92.2	Very high	91.1	Very high	30 Å²	30	68.3 Å²	68.3	11%	0.114	31%	0.314	C	S	.	.	H	α-helix	trans	-63.6	-43.5	175.6	-176.2	92.8	0	0	0	112.4	P652 V653 P656 V659 E695 I696 Y697 T701 K702 R703	P652-W699 HydrophobicContact CB-CZ3 4.09Å; P652-W699 WeakPolarHBondContact O-CH2 3.3Å; V653-W699 HydrophobicContact CG2-CB 4.33Å; V653-W699 HydrophobicContact CG2-CD2 3.97Å; V653-W699 HydrophobicContact CG2-CG 3.79Å; P656-W699 HydrophobicContact CB-CH2 4.25Å; P656-W699 HydrophobicContact CB-CZ2 3.99Å; V659-W699 HydrophobicContact CB-CH2 4.29Å; V659-W699 HydrophobicContact CB-CZ3 4.47Å; V659-W699 HydrophobicContact CG1-CH2 4.38Å; V659-W699 HydrophobicContact CG1-CZ3 4.13Å; V659-W699 HydrophobicContact CG2-CH2 4.18Å; V659-W699 HydrophobicContact CG2-CZ3 4.27Å; E695-W699 PolarHBondContact O-N 3.49Å; I696-W699 CarbonylContact O-C 3.59Å; I696-W699 WeakPolarHBondContact O-CA 3.46Å; I696-W699 WeakPolarHBondContact O-CB 3.06Å; I696-W699 PolarHBondContact O-N 2.79Å; I696-W699 VanDerWaalsContact O-N 3.12Å; Y697-W699 VanDerWaalsContact C-N 3.32Å; W699-T701 VanDerWaalsContact C-N 3.33Å; W699-T701 PolarHBondContact O-N 3.16Å; W699-K702 PolarHBondContact O-N 2.91Å; W699-R703 WeakPolarHBondContact O-CB 3.2Å; W699-R703 PolarHBondContact O-N 2.93Å
700	F	94.7	Very high	91.6	Very high	3 Å²	3	68 Å²	68	1%	0.013	32%	0.315	C	S	.	.	H	α-helix	trans	-58	-43.9	173.2	-75.8	-26.6	0	0	0	112.4	P652 V659 C674 I696 Y697 R703 K704 V705	P652-F700 HydrophobicContact CB-CE1 4.17Å; P652-F700 HydrophobicContact CB-CZ 4.46Å; P652-F700 HydrophobicContact CG-CZ 4.36Å; V659-F700 HydrophobicContact CG1-CE1 4.2Å; C674-F700 HydrophobicContact CB-CZ 3.96Å; I696-F700 HydrophobicContact CG2-CD2 4.21Å; I696-F700 HydrophobicContact CG2-CE1 4.4Å; I696-F700 HydrophobicContact CG2-CE2 3.8Å; I696-F700 HydrophobicContact CG2-CZ 3.87Å; I696-F700 PolarHBondContact O-N 2.85Å; Y697-F700 AromaticContact CD1-CD2 3.99Å; Y697-F700 HydrophobicContact CD1-CD2 3.99Å; Y697-F700 HydrophobicContact CE1-CD2 4.3Å; Y697-F700 PolarHBondContact O-N 2.82Å; F700-R703 CarbonylContact O-C 3.57Å; F700-R703 PolarHBondContact O-N 2.87Å; F700-K704 PolarHBondContact O-N 3.13Å; F700-V705 WeakPolarHBondContact CB-O 3.32Å; F700-V705 PolarHBondContact O-N 3.4Å
701	T	90.9	Very high	91.9	Very high	110 Å²	110	65.1 Å²	65.1	68%	0.675	30%	0.301	S	S	*	.	H	α-helix	trans	-62.8	-46.3	177.9	-55.7	0	0	0	0	111.1	Y697 Q698 W699 R703 K704	Y697-T701 PolarHBondContact O-N 3.29Å; Y697-T701 PolarHBondContact O-OG1 3.36Å; Q698-T701 PolarHBondContact O-N 3.12Å; W699-T701 VanDerWaalsContact C-N 3.33Å; W699-T701 PolarHBondContact O-N 3.16Å; T701-R703 VanDerWaalsContact C-N 3.34Å; T701-R703 PolarHBondContact O-N 2.83Å; T701-K704 PolarHBondContact O-N 3.26Å
702	K	88.9	Confident	92.2	Very high	167 Å²	167	63.1 Å²	63.1	73%	0.726	29%	0.294	S	S	*	.	H	α-helix	trans	-62.1	-39.8	176.3	-72.8	175.5	-177.3	175.8	0	112.2	Q698 W699 K704	Q698-K702 WeakPolarHBondContact O-CG 3.12Å; Q698-K702 PolarHBondContact O-N 2.86Å; W699-K702 PolarHBondContact O-N 2.91Å; K702-K704 VanDerWaalsContact C-N 3.28Å; K702-K704 PolarHBondContact O-N 3.49Å
703	R	89.1	Confident	92.3	Very high	38 Å²	38	65 Å²	65	14%	0.143	31%	0.306	C	S	.	.	H	α-helix	trans	-80.3	-6.6	178.8	-157.9	170.3	-170.5	81.3	9.6	113.6	P656 D660 W699 F700 T701 V705 I905 N906 Q909	P656-R703 VanDerWaalsContact CB-CZ 3.43Å; D660-R703 IonicContact OD1-CZ 3.29Å; D660-R703 IonicContact OD1-NE 3.37Å; D660-R703 PolarHBondContact OD1-NE 3.29Å; D660-R703 IonicContact OD1-NH2 3.59Å; D660-R703 IonicContact OD2-CZ 2.72Å; D660-R703 IonicContact OD2-NE 3.15Å; D660-R703 PolarHBondContact OD2-NE 2.66Å; D660-R703 IonicContact OD2-NH2 3.55Å; D660-R703 PolarHBondContact OD2-NH2 3.49Å; W699-R703 WeakPolarHBondContact O-CB 3.2Å; W699-R703 PolarHBondContact O-N 2.93Å; F700-R703 CarbonylContact O-C 3.57Å; F700-R703 PolarHBondContact O-N 2.87Å; T701-R703 VanDerWaalsContact C-N 3.34Å; T701-R703 PolarHBondContact O-N 2.83Å; R703-V705 VanDerWaalsContact C-N 3.34Å; R703-V705 HydrophobicContact CB-CG2 4.41Å; R703-V705 HydrophobicContact CG-CG2 4.23Å; R703-I905 PolarHBondContact NH2-O 3.47Å; R703-N906 PolarHBondContact NH2-OD1 2.85Å; R703-Q909 VanDerWaalsContact CG-NE2 3.32Å; R703-Q909 VanDerWaalsContact CZ-NE2 3.31Å
704	K	91	Very high	92.3	Very high	191 Å²	191	63.6 Å²	63.6	83%	0.83	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	40.1	-176.7	-55.6	-178.8	178.8	178.8	0	113.4	F700 T701 K702	F700-K704 PolarHBondContact O-N 3.13Å; T701-K704 PolarHBondContact O-N 3.26Å; K702-K704 VanDerWaalsContact C-N 3.28Å; K702-K704 PolarHBondContact O-N 3.49Å
705	V	91.4	Very high	92.3	Very high	14 Å²	14	65 Å²	65	9%	0.085	31%	0.311	C	S	.	.			trans	-110.5	126.1	176	174.2	0	0	0	0	109.2	V659 A663 L672 F700 R703 S707	V659-V705 HydrophobicContact CG1-CB 4.48Å; V659-V705 HydrophobicContact CG1-CG1 3.9Å; V659-V705 HydrophobicContact CG1-CG2 4.33Å; A663-V705 HydrophobicContact CB-CG1 3.82Å; A663-V705 HydrophobicContact CB-CG2 4.15Å; L672-V705 HydrophobicContact CD2-CG1 4.18Å; F700-V705 WeakPolarHBondContact CB-O 3.32Å; F700-V705 PolarHBondContact O-N 3.4Å; R703-V705 VanDerWaalsContact C-N 3.34Å; R703-V705 HydrophobicContact CB-CG2 4.41Å; R703-V705 HydrophobicContact CG-CG2 4.23Å; V705-S707 PolarHBondContact O-N 3.11Å
706	K	93.4	Very high	92.3	Very high	144 Å²	144	65.1 Å²	65.1	63%	0.626	32%	0.315	S	S	*	.			trans	-92.1	100.8	172	-56.3	-172	-169.8	133.9	0	109.5	D668	D668-K706 HydrophobicContact CB-CD 4.02Å; D668-K706 WeakPolarHBondContact OD1-CB 3.35Å; D668-K706 WeakPolarHBondContact OD2-CD 3.35Å; D668-K706 VanDerWaalsContact OD2-CE 3.25Å; D668-K706 WeakPolarHBondContact OD2-CE 3.41Å; D668-K706 IonicContact OD2-NZ 2.87Å; D668-K706 PolarHBondContact OD2-NZ 3.25Å
707	S	94.4	Very high	92.3	Very high	10 Å²	10	67.9 Å²	67.9	7%	0.07	33%	0.329	C	S	.	.			trans	-138.6	150	178.9	-175	0	0	0	0	110.4	L672 C674 Y697 V705	L672-S707 WeakPolarHBondContact CG-OG 3.5Å; L672-S707 PolarHBondContact O-OG 3.27Å; C674-S707 PolarHBondContact SG-OG 3.21Å; C674-S707 VanDerWaalsContact SG-OG 3.33Å; Y697-S707 WeakPolarHBondContact CE1-O 3.4Å; V705-S707 PolarHBondContact O-N 3.11Å
708	F	96.1	Very high	92.3	Very high	122 Å²	122	65.4 Å²	65.4	54%	0.535	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.3	147.3	163.7	-64.1	-80	0	0	0	109.8	L671 L672 V673 C674	L671-F708 HydrophobicContact CD1-CD2 3.66Å; L671-F708 HydrophobicContact CD1-CE2 3.69Å; L672-F708 PolarHBondContact O-N 2.98Å; V673-F708 CarbonylContact C-O 3.34Å; V673-F708 WeakPolarHBondContact CA-O 3.42Å; V673-F708 HydrophobicContact CB-CB 4.49Å; V673-F708 HydrophobicContact CG1-CB 4.19Å; V673-F708 HydrophobicContact CG2-CB 4.21Å; V673-F708 HydrophobicContact CG2-CD2 4.5Å; C674-F708 PolarHBondContact N-O 3.34Å
709	Y	96.1	Very high	92.5	Very high	16 Å²	16	63.2 Å²	63.2	6%	0.063	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	135.1	171.6	174.9	-107.5	0	0	0	109.5	P652 C674 H676 I693 I696 Y697 F711	P652-Y709 HydrophobicContact CG-CD2 3.97Å; P652-Y709 HydrophobicContact CG-CE2 4.02Å; C674-Y709 HydrophobicContact CB-CD2 4.33Å; H676-Y709 HydrophobicContact CB-CE2 3.7Å; H676-Y709 AromaticContact ND1-CZ 3.89Å; H676-Y709 PolarHBondContact ND1-OH 2.56Å; I693-Y709 HydrophobicContact CG1-CD1 4.03Å; I693-Y709 HydrophobicContact CG1-CE1 4.06Å; I696-Y709 HydrophobicContact CB-CD1 4.46Å; I696-Y709 HydrophobicContact CB-CG 4.4Å; I696-Y709 HydrophobicContact CD1-CD1 3.97Å; I696-Y709 HydrophobicContact CD1-CD2 3.91Å; I696-Y709 HydrophobicContact CD1-CE1 3.49Å; I696-Y709 VanDerWaalsContact CD1-CE1 3.49Å; I696-Y709 HydrophobicContact CD1-CE2 3.41Å; I696-Y709 VanDerWaalsContact CD1-CE2 3.41Å; I696-Y709 HydrophobicContact CD1-CG 4.15Å; I696-Y709 WeakPolarHBondContact CD1-OH 3.29Å; I696-Y709 HydrophobicContact CG2-CD1 4.31Å; I696-Y709 HydrophobicContact CG2-CD2 3.87Å; I696-Y709 HydrophobicContact CG2-CE2 4.45Å; I696-Y709 HydrophobicContact CG2-CG 3.77Å; Y697-Y709 PolarHBondContact OH-N 3.02Å; Y709-F711 HydrophobicContact CE1-CB 4.33Å; Y709-F711 AromaticContact CE1-CD1 3.77Å; Y709-F711 HydrophobicContact CE1-CD1 3.77Å; Y709-F711 HydrophobicContact CE1-CG 4.46Å
710	T	94.7	Very high	92.6	Very high	42 Å²	42	61.8 Å²	61.8	26%	0.258	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	149.8	174	-171.1	0	0	0	0	109.2	V673 C674 G675 H676 L724 V728	V673-T710 HydrophobicContact CG1-CG2 3.54Å; C674-T710 PolarHBondContact O-N 3.09Å; C674-T710 VanDerWaalsContact O-O 3.11Å; G675-T710 WeakPolarHBondContact CA-O 3.44Å; H676-T710 PolarHBondContact N-O 3.39Å; T710-L724 HydrophobicContact CG2-CD2 3.79Å; T710-V728 HydrophobicContact CG2-CG2 3.59Å
711	F	92.2	Very high	92.7	Very high	33 Å²	33	61.7 Å²	61.7	15%	0.145	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	156.9	178.5	75	-90.1	0	0	0	110.8	H676 L678 M689 I693 Y709 V713	H676-F711 HydrophobicContact CB-CB 3.83Å; H676-F711 CarbonylContact O-C 3.48Å; H676-F711 WeakPolarHBondContact O-CA 3.18Å; H676-F711 VanDerWaalsContact O-CB 3.24Å; H676-F711 WeakPolarHBondContact O-CB 3.45Å; L678-F711 HydrophobicContact CD1-CD2 3.56Å; L678-F711 HydrophobicContact CD1-CE2 3.99Å; L678-F711 HydrophobicContact CD1-CG 4.21Å; L678-F711 HydrophobicContact CG-CD2 4.44Å; M689-F711 HydrophobicContact CB-CE1 4.25Å; M689-F711 HydrophobicContact CB-CZ 3.72Å; M689-F711 HydrophobicContact CE-CE2 3.23Å; M689-F711 HydrophobicContact CE-CZ 3.32Å; M689-F711 HydrophobicContact CG-CE2 4.15Å; M689-F711 HydrophobicContact CG-CZ 3.57Å; M689-F711 HydrophobicContact SD-CE2 4.4Å; M689-F711 HydrophobicContact SD-CZ 3.95Å; I693-F711 HydrophobicContact CD1-CE1 3.96Å; I693-F711 HydrophobicContact CG1-CD1 4.42Å; I693-F711 HydrophobicContact CG1-CE1 4.07Å; Y709-F711 HydrophobicContact CE1-CB 4.33Å; Y709-F711 AromaticContact CE1-CD1 3.77Å; Y709-F711 HydrophobicContact CE1-CD1 3.77Å; Y709-F711 HydrophobicContact CE1-CG 4.46Å; F711-V713 HydrophobicContact CD2-CG2 4.42Å; F711-V713 HydrophobicContact CE2-CG2 4.15Å
712	V	91.7	Very high	92.9	Very high	24 Å²	24	62.4 Å²	62.4	15%	0.145	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	146.6	172.9	-65.9	0	0	0	0	108.7	H676 V677 L678 G720 L724	H676-V712 PolarHBondContact O-N 2.92Å; V677-V712 HydrophobicContact CB-CG2 4.3Å; V677-V712 HydrophobicContact CG1-CG2 4.28Å; V677-V712 HydrophobicContact CG2-CG2 3.83Å; L678-V712 PolarHBondContact N-O 3.04Å; V712-G720 WeakPolarHBondContact CG2-O 3.42Å; V712-L724 HydrophobicContact CB-CD2 4.48Å; V712-L724 HydrophobicContact CB-CG 4.42Å; V712-L724 HydrophobicContact CG1-CD2 3.66Å; V712-L724 HydrophobicContact CG1-CG 3.86Å; V712-L724 HydrophobicContact CG2-CD1 4Å; V712-L724 HydrophobicContact CG2-CD2 4.16Å; V712-L724 HydrophobicContact CG2-CG 3.68Å
713	V	90.4	Very high	93.2	Very high	57 Å²	57	56.9 Å²	56.9	35%	0.345	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	127.2	172	-175.5	0	0	0	0	106.8	L678 S680 F684 M689 F711	L678-V713 HydrophobicContact CB-CG2 4.39Å; L678-V713 WeakPolarHBondContact O-CA 3.18Å; S680-V713 WeakPolarHBondContact O-CG1 3.37Å; F684-V713 HydrophobicContact CD2-CG1 4.1Å; F684-V713 HydrophobicContact CD2-CG2 3.71Å; F684-V713 HydrophobicContact CE2-CG1 4.24Å; F684-V713 HydrophobicContact CE2-CG2 4.19Å; M689-V713 HydrophobicContact CE-CG2 4.16Å; F711-V713 HydrophobicContact CD2-CG2 4.42Å; F711-V713 HydrophobicContact CE2-CG2 4.15Å
714	S	91.1	Very high	93.5	Very high	15 Å²	15	55 Å²	55	11%	0.105	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	149.9	-175.7	175.6	0	0	0	0	110	L678 L679 S680 S716 G720	L678-S714 PolarHBondContact O-N 3.25Å; L678-S714 VanDerWaalsContact O-N 3.13Å; L679-S714 WeakPolarHBondContact CA-O 3.23Å; S680-S714 PolarHBondContact N-O 2.86Å; S714-S716 VanDerWaalsContact C-N 3.33Å; S714-S716 WeakPolarHBondContact CB-O 3.45Å; S714-S716 PolarHBondContact OG-N 3.2Å; S714-S716 PolarHBondContact OG-O 3.14Å; S714-G720 PolarHBondContact OG-N 3.23Å; S714-G720 VanDerWaalsContact OG-N 3.14Å
715	D	90.3	Very high	93.7	Very high	128 Å²	128	46.3 Å²	46.3	68%	0.684	24%	0.237	S	C	*	.	S	Bend	trans	-73.7	-26.9	177.2	-59	-49.4	0	0	0	112.6	S681	S681-D715 VanDerWaalsContact CA-OD1 3.3Å; S681-D715 WeakPolarHBondContact CA-OD1 3.37Å; S681-D715 WeakPolarHBondContact CB-OD1 3.45Å
716	S	91.6	Very high	93.6	Very high	26 Å²	26	50.8 Å²	50.8	18%	0.182	26%	0.257	C	S	.	.	S	Bend	trans	-124.9	150.2	178.5	51.1	0	0	0	0	111.6	S714 H718 T719 G720 D756	S714-S716 VanDerWaalsContact C-N 3.33Å; S714-S716 WeakPolarHBondContact CB-O 3.45Å; S714-S716 PolarHBondContact OG-N 3.2Å; S714-S716 PolarHBondContact OG-O 3.14Å; S716-H718 VanDerWaalsContact C-N 3.32Å; S716-T719 WeakPolarHBondContact OG-CB 3.5Å; S716-T719 PolarHBondContact OG-N 3.36Å; S716-T719 PolarHBondContact OG-OG1 3.34Å; S716-G720 PolarHBondContact O-N 3.29Å; S716-G720 VanDerWaalsContact O-N 3.14Å; S716-D756 VanDerWaalsContact CB-OD2 3.3Å; S716-D756 WeakPolarHBondContact CB-OD2 3.48Å
717	L	93.8	Very high	93.5	Very high	57 Å²	57	47.4 Å²	47.4	30%	0.298	25%	0.252	S	S	.	.	H	α-helix	trans	-64.5	-44.4	177.2	175.3	64	0	0	0	109.8	V677 G720 V721 D756 V760	V677-L717 HydrophobicContact CB-CD1 4.02Å; V677-L717 HydrophobicContact CG1-CD1 4.46Å; V677-L717 HydrophobicContact CG2-CD1 4.07Å; L717-G720 PolarHBondContact O-N 3.25Å; L717-V721 HydrophobicContact CD1-CG2 4.02Å; L717-V721 HydrophobicContact CG-CG2 4.37Å; L717-V721 WeakPolarHBondContact O-CG2 3.47Å; L717-V721 PolarHBondContact O-N 2.8Å; L717-D756 PolarHBondContact N-OD2 3.33Å; L717-V760 HydrophobicContact CD2-CG2 4.33Å; L717-V760 HydrophobicContact CG-CG2 4.05Å
718	H	94.4	Very high	93.6	Very high	35 Å²	35	47.5 Å²	47.5	16%	0.162	25%	0.252	C	S	.	.	H	α-helix	trans	-56.9	-52.2	-180	165.2	-116.1	0	0	0	112.4	S716 G720 V721 R722 K759 V760 T763	S716-H718 VanDerWaalsContact C-N 3.32Å; H718-G720 VanDerWaalsContact C-N 3.3Å; H718-G720 PolarHBondContact O-N 2.91Å; H718-V721 PolarHBondContact O-N 3.29Å; H718-R722 PolarHBondContact O-N 3.14Å; H718-K759 HydrophobicContact CB-CB 4.09Å; H718-V760 HydrophobicContact CB-CG2 4.43Å; H718-T763 PolarHBondContact CD2-OG1 3.26Å; H718-T763 VanDerWaalsContact CD2-OG1 3.28Å; H718-T763 PolarHBondContact NE2-OG1 3.3Å
719	T	94.1	Very high	93.3	Very high	65 Å²	65	43.5 Å²	43.5	40%	0.399	24%	0.244	S	C	.	.	H	α-helix	trans	-65.8	-35.6	-179.4	-54.2	0	0	0	0	111.7	S716 S723	S716-T719 WeakPolarHBondContact OG-CB 3.5Å; S716-T719 PolarHBondContact OG-N 3.36Å; S716-T719 PolarHBondContact OG-OG1 3.34Å; T719-S723 PolarHBondContact O-N 3.27Å; T719-S723 PolarHBondContact O-OG 3.43Å
720	G	94.8	Very high	93	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.5	-48.6	174.2	0	0	0	0	0	112	V712 S714 S716 L717 H718 R722 S723 L724	V712-G720 WeakPolarHBondContact CG2-O 3.42Å; S714-G720 PolarHBondContact OG-N 3.23Å; S714-G720 VanDerWaalsContact OG-N 3.14Å; S716-G720 PolarHBondContact O-N 3.29Å; S716-G720 VanDerWaalsContact O-N 3.14Å; L717-G720 PolarHBondContact O-N 3.25Å; H718-G720 VanDerWaalsContact C-N 3.3Å; H718-G720 PolarHBondContact O-N 2.91Å; G720-R722 VanDerWaalsContact C-N 3.35Å; G720-R722 PolarHBondContact O-N 3.1Å; G720-S723 WeakPolarHBondContact O-CB 3Å; G720-S723 PolarHBondContact O-N 3.21Å; G720-S723 VanDerWaalsContact O-N 3.14Å; G720-L724 PolarHBondContact O-N 2.87Å
721	V	96.9	Very high	92.6	Very high	1 Å²	1	48 Å²	48	1%	0.006	28%	0.284	C	S	.	.	H	α-helix	trans	-64.1	-40.1	178.2	174.9	0	0	0	0	111.6	L648 V677 L717 H718 S723 L724 L725 V760	L648-V721 HydrophobicContact CD1-CG1 3.89Å; L648-V721 HydrophobicContact CD1-CG2 3.81Å; L648-V721 HydrophobicContact CD2-CG1 4.31Å; L648-V721 HydrophobicContact CD2-CG2 4.11Å; V677-V721 HydrophobicContact CG2-CG2 3.99Å; L717-V721 HydrophobicContact CD1-CG2 4.02Å; L717-V721 HydrophobicContact CG-CG2 4.37Å; L717-V721 WeakPolarHBondContact O-CG2 3.47Å; L717-V721 PolarHBondContact O-N 2.8Å; H718-V721 PolarHBondContact O-N 3.29Å; V721-S723 VanDerWaalsContact C-N 3.27Å; V721-S723 PolarHBondContact O-N 3.12Å; V721-L724 WeakPolarHBondContact O-CB 3.46Å; V721-L724 PolarHBondContact O-N 2.63Å; V721-L725 HydrophobicContact CG1-CD1 3.97Å; V721-L725 HydrophobicContact CG1-CG 4.35Å; V721-L725 WeakPolarHBondContact O-CG 3.38Å; V721-L725 PolarHBondContact O-N 3.2Å; V721-V760 HydrophobicContact CB-CG1 4.35Å; V721-V760 HydrophobicContact CB-CG2 4.07Å; V721-V760 HydrophobicContact CG1-CG1 3.91Å; V721-V760 HydrophobicContact CG1-CG2 4.49Å; V721-V760 HydrophobicContact CG2-CG1 4.28Å; V721-V760 HydrophobicContact CG2-CG2 3.92Å
722	R	95.5	Very high	92.4	Very high	125 Å²	125	48.7 Å²	48.7	47%	0.472	29%	0.287	S	S	.	.	H	α-helix	trans	-55.5	-45.5	172.6	-174.8	176.3	179.4	155.7	0.7	111.3	H718 G720 L725 Q726 T763	H718-R722 PolarHBondContact O-N 3.14Å; G720-R722 VanDerWaalsContact C-N 3.35Å; G720-R722 PolarHBondContact O-N 3.1Å; R722-L725 PolarHBondContact O-N 3.37Å; R722-Q726 WeakPolarHBondContact O-CG 3.48Å; R722-Q726 PolarHBondContact O-N 2.9Å; R722-T763 HydrophobicContact CB-CG2 3.84Å; R722-T763 HydrophobicContact CG-CG2 4.17Å
723	S	95.4	Very high	92.4	Very high	51 Å²	51	51 Å²	51	36%	0.357	30%	0.298	S	S	.	.	H	α-helix	trans	-65	-42.3	177.9	-57.2	0	0	0	0	111.9	T719 G720 V721 Q726 S727	T719-S723 PolarHBondContact O-N 3.27Å; T719-S723 PolarHBondContact O-OG 3.43Å; G720-S723 WeakPolarHBondContact O-CB 3Å; G720-S723 PolarHBondContact O-N 3.21Å; G720-S723 VanDerWaalsContact O-N 3.14Å; V721-S723 VanDerWaalsContact C-N 3.27Å; V721-S723 PolarHBondContact O-N 3.12Å; S723-Q726 PolarHBondContact O-N 3.32Å; S723-S727 VanDerWaalsContact O-CB 3.26Å; S723-S727 WeakPolarHBondContact O-CB 3.44Å; S723-S727 PolarHBondContact O-N 3.33Å; S723-S727 PolarHBondContact O-OG 2.89Å
724	L	95.4	Very high	92.4	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.5	-48.3	175.1	-76.7	170	0	0	0	111.6	L646 L648 V677 T710 V712 G720 V721 Q726 S727 V728	L646-L724 HydrophobicContact CD2-CB 4.21Å; L648-L724 HydrophobicContact CD2-CD1 4.26Å; V677-L724 HydrophobicContact CG2-CD1 3.68Å; T710-L724 HydrophobicContact CG2-CD2 3.79Å; V712-L724 HydrophobicContact CB-CD2 4.48Å; V712-L724 HydrophobicContact CB-CG 4.42Å; V712-L724 HydrophobicContact CG1-CD2 3.66Å; V712-L724 HydrophobicContact CG1-CG 3.86Å; V712-L724 HydrophobicContact CG2-CD1 4Å; V712-L724 HydrophobicContact CG2-CD2 4.16Å; V712-L724 HydrophobicContact CG2-CG 3.68Å; G720-L724 PolarHBondContact O-N 2.87Å; V721-L724 WeakPolarHBondContact O-CB 3.46Å; V721-L724 PolarHBondContact O-N 2.63Å; L724-Q726 PolarHBondContact O-N 3.49Å; L724-S727 PolarHBondContact O-N 3.21Å; L724-V728 HydrophobicContact CB-CG2 4.44Å; L724-V728 HydrophobicContact CD2-CG2 4Å; L724-V728 VanDerWaalsContact O-CB 3.31Å; L724-V728 WeakPolarHBondContact O-CB 3.43Å; L724-V728 WeakPolarHBondContact O-CG2 3.45Å; L724-V728 PolarHBondContact O-N 3.15Å
725	L	93.4	Very high	92.6	Very high	7 Å²	7	53.1 Å²	53.1	4%	0.037	30%	0.299	C	S	.	.	H	α-helix	trans	-59	-37	-179.7	-76.9	166.4	0	0	0	112.3	L646 V721 R722 R734 V738 T763 V764 N767	L646-L725 HydrophobicContact CD2-CD2 3.77Å; L646-L725 HydrophobicContact CD2-CG 4.15Å; V721-L725 HydrophobicContact CG1-CD1 3.97Å; V721-L725 HydrophobicContact CG1-CG 4.35Å; V721-L725 WeakPolarHBondContact O-CG 3.38Å; V721-L725 PolarHBondContact O-N 3.2Å; R722-L725 PolarHBondContact O-N 3.37Å; L725-R734 PolarHBondContact O-NE 2.85Å; L725-R734 PolarHBondContact O-NH2 3.21Å; L725-V738 HydrophobicContact CD2-CG2 3.57Å; L725-T763 HydrophobicContact CD1-CG2 3.89Å; L725-V764 HydrophobicContact CD1-CG2 4.17Å; L725-N767 HydrophobicContact CD1-CB 4.4Å
726	Q	90.9	Very high	92.9	Very high	108 Å²	108	48.5 Å²	48.5	51%	0.505	27%	0.274	S	S	.	.	H	α-helix	trans	-81.9	-25.6	-178.8	-68	-178.9	-12.6	0	0	113.8	R722 S723 L724	R722-Q726 WeakPolarHBondContact O-CG 3.48Å; R722-Q726 PolarHBondContact O-N 2.9Å; S723-Q726 PolarHBondContact O-N 3.32Å; L724-Q726 PolarHBondContact O-N 3.49Å
727	S	91.4	Very high	93.1	Very high	74 Å²	74	47.3 Å²	47.3	52%	0.517	27%	0.266	S	S	.	.	H	α-helix	trans	-104.4	-24	-172.5	60.4	0	0	0	0	114.9	S723 L724	S723-S727 VanDerWaalsContact O-CB 3.26Å; S723-S727 WeakPolarHBondContact O-CB 3.44Å; S723-S727 PolarHBondContact O-N 3.33Å; S723-S727 PolarHBondContact O-OG 2.89Å; L724-S727 PolarHBondContact O-N 3.21Å
728	V	94.8	Very high	93.3	Very high	12 Å²	12	44.6 Å²	44.6	7%	0.073	25%	0.252	C	S	.	.	S	Bend	trans	-78.8	129.5	-176	174.4	0	0	0	0	111	L646 V673 T710 L724 R734 P735	L646-V728 HydrophobicContact CD1-CG1 4.47Å; L646-V728 HydrophobicContact CD1-CG2 4.4Å; V673-V728 HydrophobicContact CB-CG1 4.13Å; V673-V728 HydrophobicContact CG1-CG1 3.83Å; V673-V728 HydrophobicContact CG2-CG1 3.93Å; T710-V728 HydrophobicContact CG2-CG2 3.59Å; L724-V728 HydrophobicContact CB-CG2 4.44Å; L724-V728 HydrophobicContact CD2-CG2 4Å; L724-V728 VanDerWaalsContact O-CB 3.31Å; L724-V728 WeakPolarHBondContact O-CB 3.43Å; L724-V728 WeakPolarHBondContact O-CG2 3.45Å; L724-V728 PolarHBondContact O-N 3.15Å; V728-R734 VanDerWaalsContact O-CG 3.32Å; V728-R734 WeakPolarHBondContact O-CG 3.32Å; V728-P735 HydrophobicContact CG1-CG 3.75Å
729	G	90.4	Very high	93.5	Very high	37 Å²	37	43 Å²	43	38%	0.381	24%	0.244	S	C	.	.			trans	106	168.5	173	0	0	0	0	0	114.2	L733	G729-L733 CarbonylContact C-O 3.59Å; G729-L733 WeakPolarHBondContact CA-O 3.28Å
730	V	89.7	Confident	93.7	Very high	102 Å²	102	40.2 Å²	40.2	62%	0.618	23%	0.227	S	C	*	.	B	Isolated β-bridge	trans	-141.2	124.4	179.3	-178.4	0	0	0	0	109.9	T628 K732 L733	T628-V730 HydrophobicContact CG2-CB 4.44Å; T628-V730 HydrophobicContact CG2-CG1 4.06Å; V730-K732 PolarHBondContact O-N 2.94Å; V730-L733 PolarHBondContact N-O 2.97Å; V730-L733 WeakPolarHBondContact O-CB 3.48Å; V730-L733 PolarHBondContact O-N 3.49Å
731	G	85.9	Confident	93.7	Very high	52 Å²	52	40.7 Å²	40.7	54%	0.536	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	57.4	-126.1	-175.2	0	0	0	0	0	110.8
732	K	88.4	Confident	93.7	Very high	46 Å²	46	41.2 Å²	41.2	20%	0.2	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-7.2	176.6	-56.3	-165.1	-178.5	-144.8	0	114.8	L631 A632 T634 E636 Q644 V730 R734	L631-K732 HydrophobicContact CD2-CB 4.12Å; L631-K732 HydrophobicContact CG-CB 4.03Å; L631-K732 HydrophobicContact CG-CD 4.35Å; L631-K732 HydrophobicContact CG-CG 4.47Å; L631-K732 VanDerWaalsContact O-CD 3.25Å; L631-K732 WeakPolarHBondContact O-CD 3.05Å; L631-K732 WeakPolarHBondContact O-CE 3.46Å; A632-K732 WeakPolarHBondContact O-CE 3.36Å; T634-K732 WeakPolarHBondContact O-CE 3.48Å; T634-K732 PolarHBondContact O-NZ 3.43Å; E636-K732 HydrophobicContact CG-CD 4.4Å; E636-K732 IonicContact OE1-NZ 2.85Å; E636-K732 PolarHBondContact OE1-NZ 3.47Å; Q644-K732 PolarHBondContact NE2-O 3.28Å; Q644-K732 PolarHBondContact OE1-O 2.89Å; V730-K732 PolarHBondContact O-N 2.94Å; K732-R734 PolarHBondContact O-N 3.15Å
733	L	91.1	Very high	93.6	Very high	72 Å²	72	36.8 Å²	36.8	38%	0.377	22%	0.219	S	C	.	.	B	Isolated β-bridge	trans	-83.1	66.4	171.2	-64.7	175.9	0	0	0	108.6	T628 L631 G729 V730	T628-L733 HydrophobicContact CG2-CD1 4.1Å; L631-L733 HydrophobicContact CD2-CD2 4Å; L631-L733 HydrophobicContact CD2-CG 4.04Å; G729-L733 CarbonylContact C-O 3.59Å; G729-L733 WeakPolarHBondContact CA-O 3.28Å; V730-L733 PolarHBondContact N-O 2.97Å; V730-L733 WeakPolarHBondContact O-CB 3.48Å; V730-L733 PolarHBondContact O-N 3.49Å
734	R	92.2	Very high	93.4	Very high	104 Å²	104	36.7 Å²	36.7	39%	0.392	21%	0.214	S	C	.	.	S	Bend	trans	-134.5	141.2	-178.3	177.4	161.4	180	-160.4	-7.9	109.4	Q644 L725 V728 K732 N736	Q644-R734 WeakPolarHBondContact CB-O 3.34Å; Q644-R734 VanDerWaalsContact CD-O 3.24Å; Q644-R734 PolarHBondContact OE1-O 3.5Å; L725-R734 PolarHBondContact O-NE 2.85Å; L725-R734 PolarHBondContact O-NH2 3.21Å; V728-R734 VanDerWaalsContact O-CG 3.32Å; V728-R734 WeakPolarHBondContact O-CG 3.32Å; K732-R734 PolarHBondContact O-N 3.15Å; R734-N736 PolarHBondContact O-N 2.89Å
735	P	95.4	Very high	93.2	Very high	13 Å²	13	40.3 Å²	40.3	8%	0.084	23%	0.233	C	C	.	.			trans	-55.4	137.3	177.4	-29.2	37.6	0	0	0	113.1	Q644 L646 L671 V673 V728	Q644-P735 CarbonylContact O-C 3.6Å; Q644-P735 WeakPolarHBondContact O-CA 3.35Å; L646-P735 HydrophobicContact CB-CB 3.6Å; L646-P735 HydrophobicContact CB-CG 3.77Å; L671-P735 HydrophobicContact CD2-CG 4.47Å; V673-P735 HydrophobicContact CG2-CG 4.49Å; V728-P735 HydrophobicContact CG1-CG 3.75Å
736	N	94.8	Very high	93.2	Very high	31 Å²	31	40 Å²	40	17%	0.166	23%	0.232	C	C	.	.	S	Bend	trans	-120.1	-8.6	173.5	61.6	4.5	0	0	0	112.2	Y641 R642 Q644 R734 C769 G770	Y641-N736 WeakPolarHBondContact CE2-ND2 3.31Å; Y641-N736 PolarHBondContact OH-ND2 3.24Å; R642-N736 PolarHBondContact O-ND2 3.27Å; Q644-N736 WeakPolarHBondContact CA-OD1 3.34Å; Q644-N736 PolarHBondContact N-OD1 3.48Å; Q644-N736 PolarHBondContact O-N 2.89Å; Q644-N736 PolarHBondContact O-OD1 3.34Å; R734-N736 PolarHBondContact O-N 2.89Å; N736-C769 WeakPolarHBondContact O-CA 3.04Å; N736-G770 PolarHBondContact O-N 3.08Å
737	V	97.1	Very high	93	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.006	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	133	173.4	178.8	0	0	0	0	108.7	Q644 L645 L646 G770 L928	Q644-V737 PolarHBondContact O-N 3.34Å; Q644-V737 VanDerWaalsContact O-N 3.12Å; L645-V737 CarbonylContact C-O 3.57Å; L645-V737 VanDerWaalsContact CA-O 3.32Å; L645-V737 WeakPolarHBondContact CA-O 3.41Å; L645-V737 HydrophobicContact CD2-CB 3.65Å; L645-V737 HydrophobicContact CD2-CG1 3.76Å; L646-V737 PolarHBondContact N-O 3.38Å; V737-G770 CarbonylContact C-O 3.6Å; V737-G770 VanDerWaalsContact CA-O 3.3Å; V737-G770 WeakPolarHBondContact CA-O 3.18Å; V737-L928 HydrophobicContact CG1-CD2 4.33Å; V737-L928 HydrophobicContact CG2-CD1 4.1Å; V737-L928 HydrophobicContact CG2-CD2 3.79Å
738	V	98.3	Very high	92.9	Very high	0 Å²	0	43.3 Å²	43.3	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	127.6	172.5	-178	0	0	0	0	108.3	L646 L648 L725 V764 C769 G770 L771 A772	L646-V738 HydrophobicContact CB-CG2 4.42Å; L646-V738 WeakPolarHBondContact O-CA 3.43Å; L648-V738 HydrophobicContact CD1-CG1 3.78Å; L648-V738 HydrophobicContact CG-CG1 3.85Å; L725-V738 HydrophobicContact CD2-CG2 3.57Å; V738-V764 HydrophobicContact CB-CG1 3.85Å; V738-V764 HydrophobicContact CB-CG2 3.99Å; V738-V764 HydrophobicContact CG1-CG2 3.96Å; V738-V764 HydrophobicContact CG2-CB 4.43Å; V738-V764 HydrophobicContact CG2-CG1 3.69Å; V738-V764 HydrophobicContact CG2-CG2 3.89Å; V738-C769 HydrophobicContact CG2-CB 4.21Å; V738-G770 PolarHBondContact N-O 2.76Å; V738-L771 HydrophobicContact CB-CD1 4.25Å; V738-L771 HydrophobicContact CG1-CD1 4.35Å; V738-L771 CarbonylContact O-C 3.59Å; V738-L771 WeakPolarHBondContact O-CA 3.36Å; V738-A772 PolarHBondContact O-N 2.95Å
739	L	98.3	Very high	92.6	Very high	1 Å²	1	43.1 Å²	43.1	1%	0.005	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	126	172.6	172.2	61.8	0	0	0	108.9	L645 L646 L647 L648 L658 F661 I665 A772 L774 L1091	L645-L739 HydrophobicContact CD1-CD2 4.45Å; L646-L739 PolarHBondContact O-N 2.82Å; L647-L739 CarbonylContact C-O 3.52Å; L647-L739 WeakPolarHBondContact CA-O 3.46Å; L647-L739 HydrophobicContact CD1-CB 3.54Å; L647-L739 HydrophobicContact CD1-CD2 3.3Å; L647-L739 HydrophobicContact CD1-CG 3.33Å; L648-L739 PolarHBondContact N-O 3.12Å; L658-L739 HydrophobicContact CD1-CD1 4.34Å; L658-L739 HydrophobicContact CD1-CD2 4.33Å; L658-L739 HydrophobicContact CD1-CG 4.03Å; F661-L739 HydrophobicContact CD1-CD2 3.84Å; F661-L739 HydrophobicContact CE1-CD2 4.43Å; I665-L739 HydrophobicContact CD1-CD2 4.39Å; L739-A772 CarbonylContact C-O 3.57Å; L739-A772 WeakPolarHBondContact CA-O 3.48Å; L739-A772 HydrophobicContact CB-CB 4.2Å; L739-A772 HydrophobicContact CD1-CB 3.57Å; L739-A772 HydrophobicContact CG-CB 4.45Å; L739-L774 HydrophobicContact CD1-CB 4.18Å; L739-L1091 HydrophobicContact CD1-CD1 4.04Å
740	M	97.5	Very high	92.6	Very high	8 Å²	8	44.5 Å²	44.5	4%	0.039	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.5	159.6	-180	65.7	-173.6	-60.6	0	0	111.4	L648 Y757 V760 L771 A772 I773 L774	L648-M740 HydrophobicContact CB-CB 3.94Å; L648-M740 HydrophobicContact CD1-CB 4.11Å; L648-M740 HydrophobicContact CD1-CE 4.46Å; L648-M740 HydrophobicContact CD1-SD 4.4Å; L648-M740 HydrophobicContact CG-CB 4.36Å; M740-Y757 HydrophobicContact CE-CD2 3.75Å; M740-Y757 HydrophobicContact CE-CE1 4.34Å; M740-Y757 HydrophobicContact CE-CE2 3.17Å; M740-Y757 VanDerWaalsContact CE-CZ 3.49Å; M740-V760 HydrophobicContact CE-CG1 3.96Å; M740-V760 HydrophobicContact SD-CG1 4.04Å; M740-L771 HydrophobicContact CG-CD1 4.22Å; M740-L771 HydrophobicContact SD-CD1 3.96Å; M740-A772 PolarHBondContact N-O 3.14Å; M740-I773 HydrophobicContact CG-CG1 3.99Å; M740-I773 CarbonylContact O-C 3.53Å; M740-I773 WeakPolarHBondContact O-CA 3.14Å; M740-I773 HydrophobicContact SD-CG1 4.43Å; M740-L774 PolarHBondContact O-N 3.13Å
741	G	95.9	Very high	92.5	Very high	10 Å²	10	41.8 Å²	41.8	10%	0.103	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	143.3	173	0	0	0	0	0	111.6	Y757 L774	G741-Y757 WeakPolarHBondContact O-CE2 3.29Å; G741-Y757 PolarHBondContact O-OH 3.21Å; G741-Y757 VanDerWaalsContact O-OH 3.13Å; G741-L774 WeakPolarHBondContact CA-O 3.43Å
742	F	96.4	Very high	92.7	Very high	11 Å²	11	45.5 Å²	45.5	5%	0.048	23%	0.226	C	C	.	.			trans	-64.6	137.4	170.2	-175	-96.1	0	0	0	111	N744 Y757 I773 L774 R775 L1076 L1079 D1080	F742-N744 VanDerWaalsContact CD1-OD1 3.27Å; F742-N744 WeakPolarHBondContact CD1-OD1 3.42Å; F742-N744 PolarHBondContact O-N 3.45Å; F742-Y757 WeakPolarHBondContact CA-OH 3.46Å; F742-I773 HydrophobicContact CB-CG2 3.82Å; F742-I773 HydrophobicContact CD2-CG2 4.11Å; F742-I773 HydrophobicContact CG-CG2 4.48Å; F742-L774 PolarHBondContact N-O 3.1Å; F742-R775 HydrophobicContact CB-CB 3.63Å; F742-R775 HydrophobicContact CB-CG 3.78Å; F742-R775 HydrophobicContact CD1-CG 3.8Å; F742-R775 HydrophobicContact CG-CB 4.13Å; F742-R775 HydrophobicContact CG-CG 3.9Å; F742-L1076 HydrophobicContact CE2-CD2 4.13Å; F742-L1079 HydrophobicContact CD2-CB 4.42Å; F742-L1079 HydrophobicContact CE2-CB 3.72Å; F742-L1079 HydrophobicContact CE2-CD1 4.27Å; F742-L1079 HydrophobicContact CZ-CB 4.47Å; F742-D1080 HydrophobicContact CE1-CB 4.19Å; F742-D1080 HydrophobicContact CZ-CB 3.78Å
743	K	94	Very high	92.8	Very high	33 Å²	33	48.1 Å²	48.1	14%	0.143	24%	0.239	C	C	.	.			trans	-77.7	86	177.9	-172.3	172.3	170.4	50.1	0	110.7	D745 W746 S749 Y757	K743-D745 VanDerWaalsContact C-N 3.29Å; K743-D745 WeakPolarHBondContact CG-OD1 3.24Å; K743-D745 IonicContact NZ-OD1 3.71Å; K743-D745 PolarHBondContact NZ-OD1 2.68Å; K743-D745 IonicContact NZ-OD2 3.63Å; K743-D745 PolarHBondContact NZ-OD2 2.86Å; K743-D745 PolarHBondContact O-N 2.94Å; K743-W746 HydrophobicContact CB-CB 4.41Å; K743-W746 HydrophobicContact CD-CB 4.29Å; K743-W746 HydrophobicContact CG-CB 4.07Å; K743-W746 WeakPolarHBondContact O-CB 3.15Å; K743-W746 PolarHBondContact O-N 3.3Å; K743-S749 WeakPolarHBondContact CE-OG 3.3Å; K743-S749 PolarHBondContact NZ-OG 2.83Å; K743-Y757 HydrophobicContact CB-CD1 4.49Å; K743-Y757 HydrophobicContact CB-CD2 3.77Å; K743-Y757 HydrophobicContact CB-CE2 3.74Å; K743-Y757 HydrophobicContact CB-CG 4.16Å; K743-Y757 HydrophobicContact CD-CD2 4.2Å; K743-Y757 HydrophobicContact CD-CG 4.23Å
744	N	90.9	Very high	92.9	Very high	49 Å²	49	44.7 Å²	44.7	26%	0.262	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-32.3	-177.6	-82.9	3.6	0	0	0	114	F742 W746 L776 Q777 G779	F742-N744 VanDerWaalsContact CD1-OD1 3.27Å; F742-N744 WeakPolarHBondContact CD1-OD1 3.42Å; F742-N744 PolarHBondContact O-N 3.45Å; N744-W746 PolarHBondContact O-N 2.88Å; N744-L776 PolarHBondContact ND2-O 3.28Å; N744-Q777 PolarHBondContact ND2-O 3.26Å; N744-G779 WeakPolarHBondContact ND2-CA 3.18Å; N744-G779 PolarHBondContact ND2-N 3.45Å
745	D	90.7	Very high	92.9	Very high	75 Å²	75	41 Å²	41	40%	0.401	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.3	9.7	-179	65.9	-35.4	0	0	0	112.9	K743 K747 E748 S749	K743-D745 VanDerWaalsContact C-N 3.29Å; K743-D745 WeakPolarHBondContact CG-OD1 3.24Å; K743-D745 IonicContact NZ-OD1 3.71Å; K743-D745 PolarHBondContact NZ-OD1 2.68Å; K743-D745 IonicContact NZ-OD2 3.63Å; K743-D745 PolarHBondContact NZ-OD2 2.86Å; K743-D745 PolarHBondContact O-N 2.94Å; D745-K747 PolarHBondContact O-N 3.41Å; D745-K747 VanDerWaalsContact O-N 3.08Å; D745-E748 PolarHBondContact O-N 3.29Å; D745-S749 PolarHBondContact O-N 3.14Å; D745-S749 PolarHBondContact O-OG 3.08Å; D745-S749 PolarHBondContact OD2-OG 2.91Å
746	W	92.3	Very high	92.8	Very high	1 Å²	1	42.1 Å²	42.1	0%	0.004	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-30.1	-173.8	74.7	-81	0	0	0	113.5	K743 N744 E748 V754 F1002 R1006 L1076 D1080	K743-W746 HydrophobicContact CB-CB 4.41Å; K743-W746 HydrophobicContact CD-CB 4.29Å; K743-W746 HydrophobicContact CG-CB 4.07Å; K743-W746 WeakPolarHBondContact O-CB 3.15Å; K743-W746 PolarHBondContact O-N 3.3Å; N744-W746 PolarHBondContact O-N 2.88Å; W746-E748 VanDerWaalsContact C-N 3.35Å; W746-V754 HydrophobicContact CB-CG2 4.28Å; W746-V754 VanDerWaalsContact O-CG2 3.3Å; W746-V754 WeakPolarHBondContact O-CG2 3.39Å; W746-F1002 HydrophobicContact CZ2-CE1 4.07Å; W746-F1002 HydrophobicContact CZ2-CZ 4.4Å; W746-R1006 HydrophobicContact CZ3-CG 4.19Å; W746-R1006 PolarHBondContact O-NH2 3.35Å; W746-L1076 HydrophobicContact CB-CD1 3.9Å; W746-L1076 HydrophobicContact CD2-CB 4.05Å; W746-L1076 HydrophobicContact CD2-CD1 4.23Å; W746-L1076 HydrophobicContact CE3-CB 4.09Å; W746-L1076 HydrophobicContact CE3-CD1 4.2Å; W746-L1076 HydrophobicContact CG-CD1 4.13Å; W746-L1076 HydrophobicContact CZ3-CB 4.39Å; W746-D1080 HydrophobicContact CZ2-CB 4.26Å; W746-D1080 PolarHBondContact NE1-OD2 2.98Å
747	K	88.6	Confident	92.8	Very high	70 Å²	70	41.1 Å²	41.1	30%	0.304	21%	0.208	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.3	-28	176	-66.8	-163.9	177.5	-155.4	0	113.8	D745 F1002 R1006	D745-K747 PolarHBondContact O-N 3.41Å; D745-K747 VanDerWaalsContact O-N 3.08Å; K747-F1002 PolarHBondContact NZ-O 3.31Å; K747-F1002 VanDerWaalsContact NZ-O 3.17Å; K747-R1006 VanDerWaalsContact C-NH2 3.3Å; K747-R1006 PolarHBondContact O-NH2 3Å
748	E	88.2	Confident	92.8	Very high	181 Å²	181	41.8 Å²	41.8	85%	0.846	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.9	-14.8	179.7	-62.9	171.8	-175.2	0	0	111.6	D745 W746	D745-E748 PolarHBondContact O-N 3.29Å; W746-E748 VanDerWaalsContact C-N 3.35Å
749	S	88.5	Confident	92.6	Very high	9 Å²	9	45.3 Å²	45.3	6%	0.063	23%	0.226	C	C	.	.	S	Bend	trans	-77.2	157.2	-178.3	-59.6	0	0	0	0	113.3	K743 D745 R1006	K743-S749 WeakPolarHBondContact CE-OG 3.3Å; K743-S749 PolarHBondContact NZ-OG 2.83Å; D745-S749 PolarHBondContact O-N 3.14Å; D745-S749 PolarHBondContact O-OG 3.08Å; D745-S749 PolarHBondContact OD2-OG 2.91Å; S749-R1006 PolarHBondContact O-NH2 3.1Å
750	T	90.7	Very high	92.5	Very high	66 Å²	66	45.3 Å²	45.3	41%	0.405	23%	0.226	S	C	.	.			trans	-64	150	174	65.6	0	0	0	0	110.9	E752 Q753 V754	T750-E752 PolarHBondContact O-N 3.17Å; T750-Q753 PolarHBondContact O-N 3.44Å; T750-Q753 VanDerWaalsContact O-N 3.14Å; T750-Q753 WeakPolarHBondContact OG1-CG 3.5Å; T750-Q753 PolarHBondContact OG1-N 3.16Å; T750-V754 PolarHBondContact O-N 2.84Å
751	P	88.3	Confident	92.4	Very high	45 Å²	45	44.9 Å²	44.9	29%	0.292	22%	0.224	S	C	.	.	H	α-helix	trans	-51.6	-40.4	176	-28	36.1	0	0	0	113.1	Q753 V754 E755 V1024 F1025	P751-Q753 PolarHBondContact O-N 3.31Å; P751-V754 WeakPolarHBondContact O-CB 3.1Å; P751-V754 PolarHBondContact O-N 3.28Å; P751-E755 WeakPolarHBondContact O-CB 3.43Å; P751-E755 PolarHBondContact O-N 3.23Å; P751-V1024 HydrophobicContact CB-CG1 3.92Å; P751-F1025 HydrophobicContact CB-CE2 4.43Å; P751-F1025 HydrophobicContact CG-CE2 4.27Å; P751-F1025 HydrophobicContact CG-CZ 3.97Å
752	E	88.2	Confident	92.4	Very high	130 Å²	130	45.4 Å²	45.4	61%	0.607	22%	0.223	S	C	*	.	H	α-helix	trans	-61	-44.6	178.1	-63.7	166.7	-173	0	0	112.6	T750 V754 E755 D756	T750-E752 PolarHBondContact O-N 3.17Å; E752-V754 VanDerWaalsContact C-N 3.31Å; E752-V754 PolarHBondContact O-N 3.2Å; E752-E755 PolarHBondContact O-N 2.87Å; E752-D756 WeakPolarHBondContact O-CB 3.34Å; E752-D756 PolarHBondContact O-N 3.39Å
753	Q	90.7	Very high	92.3	Very high	101 Å²	101	45.2 Å²	45.2	47%	0.472	22%	0.223	S	C	.	.	H	α-helix	trans	-66.8	-34.3	178.1	-73.9	175.9	-9.4	0	0	112.5	T750 P751 Y757	T750-Q753 PolarHBondContact O-N 3.44Å; T750-Q753 VanDerWaalsContact O-N 3.14Å; T750-Q753 WeakPolarHBondContact OG1-CG 3.5Å; T750-Q753 PolarHBondContact OG1-N 3.16Å; P751-Q753 PolarHBondContact O-N 3.31Å; Q753-Y757 PolarHBondContact O-N 3.38Å; Q753-Y757 VanDerWaalsContact O-N 3.15Å
754	V	92.9	Very high	92.4	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-67.4	-45.4	175.2	170.2	0	0	0	0	110.2	W746 T750 P751 E752 Y757 F758 V1024 A1072 L1076	W746-V754 HydrophobicContact CB-CG2 4.28Å; W746-V754 VanDerWaalsContact O-CG2 3.3Å; W746-V754 WeakPolarHBondContact O-CG2 3.39Å; T750-V754 PolarHBondContact O-N 2.84Å; P751-V754 WeakPolarHBondContact O-CB 3.1Å; P751-V754 PolarHBondContact O-N 3.28Å; E752-V754 VanDerWaalsContact C-N 3.31Å; E752-V754 PolarHBondContact O-N 3.2Å; V754-Y757 PolarHBondContact O-N 3.5Å; V754-F758 PolarHBondContact O-N 3.1Å; V754-V1024 HydrophobicContact CG1-CG1 4.39Å; V754-A1072 HydrophobicContact CG1-CB 3.99Å; V754-L1076 HydrophobicContact CG1-CD1 3.76Å
755	E	92.5	Very high	92.5	Very high	27 Å²	27	41.5 Å²	41.5	13%	0.126	21%	0.205	C	C	.	.	H	α-helix	trans	-61.5	-45	175.5	-161	-170.9	166.8	0	0	111.7	P751 E752 Y757 F758 K759 V1024	P751-E755 WeakPolarHBondContact O-CB 3.43Å; P751-E755 PolarHBondContact O-N 3.23Å; E752-E755 PolarHBondContact O-N 2.87Å; E755-Y757 PolarHBondContact O-N 2.92Å; E755-F758 CarbonylContact O-C 3.46Å; E755-F758 PolarHBondContact O-N 3.3Å; E755-F758 VanDerWaalsContact O-N 3.13Å; E755-K759 HydrophobicContact CG-CD 4.31Å; E755-K759 WeakPolarHBondContact O-CB 3.49Å; E755-K759 WeakPolarHBondContact O-CG 3.19Å; E755-K759 PolarHBondContact O-N 3.25Å; E755-K759 WeakPolarHBondContact OE1-CE 3.36Å; E755-K759 IonicContact OE1-NZ 3.37Å; E755-K759 PolarHBondContact OE1-NZ 3.23Å; E755-K759 IonicContact OE2-NZ 3.77Å; E755-V1024 HydrophobicContact CB-CG2 3.72Å; E755-V1024 HydrophobicContact CG-CG2 3.8Å
756	D	93.7	Very high	92.5	Very high	36 Å²	36	41 Å²	41	19%	0.193	20%	0.202	C	C	.	.	H	α-helix	trans	-58.9	-45	178.1	-110.1	20.3	0	0	0	111.9	S716 L717 E752 F758 K759 V760	S716-D756 VanDerWaalsContact CB-OD2 3.3Å; S716-D756 WeakPolarHBondContact CB-OD2 3.48Å; L717-D756 PolarHBondContact N-OD2 3.33Å; E752-D756 WeakPolarHBondContact O-CB 3.34Å; E752-D756 PolarHBondContact O-N 3.39Å; D756-F758 VanDerWaalsContact C-N 3.33Å; D756-F758 PolarHBondContact O-N 3.18Å; D756-K759 PolarHBondContact O-N 3.21Å; D756-V760 WeakPolarHBondContact O-CG2 3.5Å; D756-V760 PolarHBondContact O-N 3.06Å
757	Y	95.6	Very high	92.4	Very high	10 Å²	10	42.8 Å²	42.8	4%	0.039	21%	0.212	C	C	.	.	H	α-helix	trans	-62.3	-40.9	175.4	-178.1	-83.7	0	0	0	111.7	M740 G741 F742 K743 Q753 V754 E755 V760 I761 I773 L1076	M740-Y757 HydrophobicContact CE-CD2 3.75Å; M740-Y757 HydrophobicContact CE-CE1 4.34Å; M740-Y757 HydrophobicContact CE-CE2 3.17Å; M740-Y757 VanDerWaalsContact CE-CZ 3.49Å; G741-Y757 WeakPolarHBondContact O-CE2 3.29Å; G741-Y757 PolarHBondContact O-OH 3.21Å; G741-Y757 VanDerWaalsContact O-OH 3.13Å; F742-Y757 WeakPolarHBondContact CA-OH 3.46Å; K743-Y757 HydrophobicContact CB-CD1 4.49Å; K743-Y757 HydrophobicContact CB-CD2 3.77Å; K743-Y757 HydrophobicContact CB-CE2 3.74Å; K743-Y757 HydrophobicContact CB-CG 4.16Å; K743-Y757 HydrophobicContact CD-CD2 4.2Å; K743-Y757 HydrophobicContact CD-CG 4.23Å; Q753-Y757 PolarHBondContact O-N 3.38Å; Q753-Y757 VanDerWaalsContact O-N 3.15Å; V754-Y757 PolarHBondContact O-N 3.5Å; E755-Y757 PolarHBondContact O-N 2.92Å; Y757-V760 WeakPolarHBondContact O-CB 3.25Å; Y757-V760 PolarHBondContact O-N 3.36Å; Y757-I761 HydrophobicContact CD1-CD1 4.42Å; Y757-I761 HydrophobicContact CE1-CD1 3.98Å; Y757-I761 PolarHBondContact O-N 3.39Å; Y757-I773 WeakPolarHBondContact OH-CG2 3.28Å; Y757-L1076 HydrophobicContact CD1-CD1 4.41Å; Y757-L1076 HydrophobicContact CD1-CD2 3.89Å; Y757-L1076 HydrophobicContact CE1-CD2 3.77Å
758	F	95.8	Very high	92.5	Very high	15 Å²	15	45.9 Å²	45.9	7%	0.066	22%	0.222	C	C	.	.	H	α-helix	trans	-68.8	-39.2	177.7	-175.6	-120.2	0	0	0	112.3	V754 E755 D756 V760 I761 H762 P1065 I1070 A1072 Y1075	V754-F758 PolarHBondContact O-N 3.1Å; E755-F758 CarbonylContact O-C 3.46Å; E755-F758 PolarHBondContact O-N 3.3Å; E755-F758 VanDerWaalsContact O-N 3.13Å; D756-F758 VanDerWaalsContact C-N 3.33Å; D756-F758 PolarHBondContact O-N 3.18Å; F758-V760 VanDerWaalsContact C-N 3.27Å; F758-V760 PolarHBondContact O-N 3.21Å; F758-I761 HydrophobicContact CD2-CD1 4.48Å; F758-I761 WeakPolarHBondContact O-CB 3.28Å; F758-I761 PolarHBondContact O-N 2.9Å; F758-H762 AromaticContact CE1-CD2 3.74Å; F758-H762 AromaticContact CE1-NE2 3.25Å; F758-H762 WeakPolarHBondContact CE1-NE2 3.34Å; F758-H762 AromaticContact CE2-NE2 3.84Å; F758-H762 AromaticContact CZ-CD2 3.85Å; F758-H762 AromaticContact CZ-NE2 3.13Å; F758-H762 WeakPolarHBondContact CZ-NE2 3.36Å; F758-H762 PolarHBondContact O-CD2 2.94Å; F758-H762 PolarHBondContact O-N 3.1Å; F758-P1065 HydrophobicContact CE2-CB 3.72Å; F758-P1065 HydrophobicContact CE2-CG 4.04Å; F758-P1065 HydrophobicContact CZ-CB 3.69Å; F758-P1065 HydrophobicContact CZ-CG 4.34Å; F758-I1070 HydrophobicContact CZ-CG2 3.97Å; F758-A1072 HydrophobicContact CB-CB 3.6Å; F758-A1072 HydrophobicContact CD1-CB 3.65Å; F758-A1072 HydrophobicContact CE1-CB 4.49Å; F758-A1072 HydrophobicContact CG-CB 3.71Å; F758-Y1075 AromaticContact CD2-CD1 3.73Å; F758-Y1075 HydrophobicContact CD2-CD1 3.73Å; F758-Y1075 HydrophobicContact CD2-CE1 4.41Å; F758-Y1075 HydrophobicContact CD2-CG 4.09Å; F758-Y1075 AromaticContact CE2-CD1 3.5Å; F758-Y1075 HydrophobicContact CE2-CD1 3.5Å; F758-Y1075 VanDerWaalsContact CE2-CD1 3.5Å; F758-Y1075 HydrophobicContact CE2-CD2 4.11Å; F758-Y1075 HydrophobicContact CE2-CE1 4.16Å; F758-Y1075 AromaticContact CE2-CG 3.46Å; F758-Y1075 HydrophobicContact CE2-CG 3.46Å; F758-Y1075 VanDerWaalsContact CE2-CG 3.46Å; F758-Y1075 HydrophobicContact CZ-CG 4.34Å
759	K	94.7	Very high	92.7	Very high	74 Å²	74	37.8 Å²	37.8	32%	0.322	19%	0.185	S	C	.	.	H	α-helix	trans	-61.5	-33.4	172.3	-74.9	174.1	177	162.8	0	112.3	H718 E755 D756 I761 H762 T763	H718-K759 HydrophobicContact CB-CB 4.09Å; E755-K759 HydrophobicContact CG-CD 4.31Å; E755-K759 WeakPolarHBondContact O-CB 3.49Å; E755-K759 WeakPolarHBondContact O-CG 3.19Å; E755-K759 PolarHBondContact O-N 3.25Å; E755-K759 WeakPolarHBondContact OE1-CE 3.36Å; E755-K759 IonicContact OE1-NZ 3.37Å; E755-K759 PolarHBondContact OE1-NZ 3.23Å; E755-K759 IonicContact OE2-NZ 3.77Å; D756-K759 PolarHBondContact O-N 3.21Å; K759-I761 VanDerWaalsContact C-N 3.32Å; K759-I761 PolarHBondContact O-N 2.85Å; K759-H762 PolarHBondContact O-N 3.42Å; K759-T763 WeakPolarHBondContact O-CB 3.48Å; K759-T763 PolarHBondContact O-N 2.91Å; K759-T763 PolarHBondContact O-OG1 3.23Å
760	V	96.6	Very high	93	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-58.2	-44.6	171.5	168	0	0	0	0	111	L648 L717 H718 V721 M740 D756 Y757 F758 H762 T763 V764	L648-V760 HydrophobicContact CD1-CG1 4.03Å; L717-V760 HydrophobicContact CD2-CG2 4.33Å; L717-V760 HydrophobicContact CG-CG2 4.05Å; H718-V760 HydrophobicContact CB-CG2 4.43Å; V721-V760 HydrophobicContact CB-CG1 4.35Å; V721-V760 HydrophobicContact CB-CG2 4.07Å; V721-V760 HydrophobicContact CG1-CG1 3.91Å; V721-V760 HydrophobicContact CG1-CG2 4.49Å; V721-V760 HydrophobicContact CG2-CG1 4.28Å; V721-V760 HydrophobicContact CG2-CG2 3.92Å; M740-V760 HydrophobicContact CE-CG1 3.96Å; M740-V760 HydrophobicContact SD-CG1 4.04Å; D756-V760 WeakPolarHBondContact O-CG2 3.5Å; D756-V760 PolarHBondContact O-N 3.06Å; Y757-V760 WeakPolarHBondContact O-CB 3.25Å; Y757-V760 PolarHBondContact O-N 3.36Å; F758-V760 VanDerWaalsContact C-N 3.27Å; F758-V760 PolarHBondContact O-N 3.21Å; V760-H762 VanDerWaalsContact C-N 3.34Å; V760-H762 PolarHBondContact O-N 3.04Å; V760-T763 PolarHBondContact O-N 3.1Å; V760-T763 VanDerWaalsContact O-N 3.17Å; V760-V764 HydrophobicContact CG1-CG2 4.36Å; V760-V764 WeakPolarHBondContact O-CG2 3.44Å; V760-V764 PolarHBondContact O-N 3.5Å
761	I	96.2	Very high	93.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-58.7	-46.7	178.3	-62.3	-179.8	0	0	0	110.8	Y757 F758 K759 V764 F765 L771 I773 P1065 Y1075	Y757-I761 HydrophobicContact CD1-CD1 4.42Å; Y757-I761 HydrophobicContact CE1-CD1 3.98Å; Y757-I761 PolarHBondContact O-N 3.39Å; F758-I761 HydrophobicContact CD2-CD1 4.48Å; F758-I761 WeakPolarHBondContact O-CB 3.28Å; F758-I761 PolarHBondContact O-N 2.9Å; K759-I761 VanDerWaalsContact C-N 3.32Å; K759-I761 PolarHBondContact O-N 2.85Å; I761-V764 PolarHBondContact O-N 3.25Å; I761-F765 HydrophobicContact CG2-CD2 4.12Å; I761-F765 HydrophobicContact CG2-CE2 3.77Å; I761-F765 VanDerWaalsContact O-CD2 3.29Å; I761-F765 WeakPolarHBondContact O-CD2 3.37Å; I761-F765 PolarHBondContact O-N 3.16Å; I761-L771 HydrophobicContact CB-CD2 4.14Å; I761-L771 HydrophobicContact CG1-CD2 4.1Å; I761-L771 HydrophobicContact CG2-CD2 3.66Å; I761-I773 HydrophobicContact CD1-CD1 3.79Å; I761-I773 HydrophobicContact CG1-CD1 4.28Å; I761-P1065 HydrophobicContact CG2-CG 3.84Å; I761-Y1075 HydrophobicContact CD1-CD1 4.27Å; I761-Y1075 HydrophobicContact CD1-CE1 3.63Å
762	H	94.8	Very high	93.8	Very high	21 Å²	21	32.4 Å²	32.4	10%	0.097	15%	0.152	C	C	.	.	H	α-helix	trans	-59.6	-47.6	174.7	-77.3	-78	0	0	0	111.9	H115 F758 K759 V760 V764 F765 D766 P1065	H115-H762 AromaticContact CD2-ND1 3.83Å; H115-H762 AromaticContact CE1-ND1 3.46Å; H115-H762 PolarHBondContact CE1-ND1 2.78Å; H115-H762 PolarHBondContact CE1-O 3.14Å; H115-H762 AromaticContact NE2-CE1 3.71Å; H115-H762 AromaticContact NE2-CG 3.73Å; H115-H762 AromaticContact NE2-ND1 2.87Å; H115-H762 PolarHBondContact NE2-ND1 2.79Å; F758-H762 AromaticContact CE1-CD2 3.74Å; F758-H762 AromaticContact CE1-NE2 3.25Å; F758-H762 WeakPolarHBondContact CE1-NE2 3.34Å; F758-H762 AromaticContact CE2-NE2 3.84Å; F758-H762 AromaticContact CZ-CD2 3.85Å; F758-H762 AromaticContact CZ-NE2 3.13Å; F758-H762 WeakPolarHBondContact CZ-NE2 3.36Å; F758-H762 PolarHBondContact O-CD2 2.94Å; F758-H762 PolarHBondContact O-N 3.1Å; K759-H762 PolarHBondContact O-N 3.42Å; V760-H762 VanDerWaalsContact C-N 3.34Å; V760-H762 PolarHBondContact O-N 3.04Å; H762-V764 VanDerWaalsContact C-N 3.29Å; H762-V764 PolarHBondContact O-N 3.33Å; H762-F765 PolarHBondContact O-N 3.37Å; H762-F765 VanDerWaalsContact O-N 3.16Å; H762-D766 WeakPolarHBondContact O-CB 3.44Å; H762-D766 VanDerWaalsContact O-CG 3.25Å; H762-D766 PolarHBondContact O-N 3.46Å; H762-P1065 PolarHBondContact CE1-O 2.87Å; H762-P1065 VanDerWaalsContact CE1-O 3.31Å
763	T	94.7	Very high	94.3	Very high	7 Å²	7	26.2 Å²	26.2	4%	0.043	12%	0.123	C	C	.	.	H	α-helix	trans	-61.6	-34.4	-179.4	-76	0	0	0	0	113	H718 R722 L725 K759 V760 N767	H718-T763 PolarHBondContact CD2-OG1 3.26Å; H718-T763 VanDerWaalsContact CD2-OG1 3.28Å; H718-T763 PolarHBondContact NE2-OG1 3.3Å; R722-T763 HydrophobicContact CB-CG2 3.84Å; R722-T763 HydrophobicContact CG-CG2 4.17Å; L725-T763 HydrophobicContact CD1-CG2 3.89Å; K759-T763 WeakPolarHBondContact O-CB 3.48Å; K759-T763 PolarHBondContact O-N 2.91Å; K759-T763 PolarHBondContact O-OG1 3.23Å; V760-T763 PolarHBondContact O-N 3.1Å; V760-T763 VanDerWaalsContact O-N 3.17Å; T763-N767 PolarHBondContact O-N 3.26Å; T763-N767 PolarHBondContact O-ND2 2.99Å
764	V	95.5	Very high	94.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-63.6	-47.6	174.7	173.7	0	0	0	0	111	L725 V738 V760 I761 H762 N767 C769 L771	L725-V764 HydrophobicContact CD1-CG2 4.17Å; V738-V764 HydrophobicContact CB-CG1 3.85Å; V738-V764 HydrophobicContact CB-CG2 3.99Å; V738-V764 HydrophobicContact CG1-CG2 3.96Å; V738-V764 HydrophobicContact CG2-CB 4.43Å; V738-V764 HydrophobicContact CG2-CG1 3.69Å; V738-V764 HydrophobicContact CG2-CG2 3.89Å; V760-V764 HydrophobicContact CG1-CG2 4.36Å; V760-V764 WeakPolarHBondContact O-CG2 3.44Å; V760-V764 PolarHBondContact O-N 3.5Å; I761-V764 PolarHBondContact O-N 3.25Å; H762-V764 VanDerWaalsContact C-N 3.29Å; H762-V764 PolarHBondContact O-N 3.33Å; V764-N767 PolarHBondContact O-N 2.82Å; V764-C769 HydrophobicContact CG1-CB 3.81Å; V764-C769 PolarHBondContact O-N 3.01Å; V764-L771 HydrophobicContact CB-CD1 4.45Å; V764-L771 HydrophobicContact CG1-CB 3.91Å; V764-L771 HydrophobicContact CG1-CD1 4.14Å; V764-L771 HydrophobicContact CG1-CG 4.45Å; V764-L771 HydrophobicContact CG2-CD1 4.27Å
765	F	93.7	Very high	94.8	Very high	4 Å²	4	22 Å²	22	2%	0.018	10%	0.103	C	C	.	.	H	α-helix	trans	-68.2	-35.7	178.4	-67.5	-51.6	0	0	0	112.6	L111 I761 H762 N767 Y768 L771 L1062 I1064 R1094	L111-F765 HydrophobicContact CD1-CB 4.47Å; L111-F765 HydrophobicContact CD1-CD1 3.78Å; L111-F765 HydrophobicContact CD1-CE1 4.34Å; L111-F765 HydrophobicContact CD1-CG 4.33Å; L111-F765 HydrophobicContact CD2-CB 4.17Å; L111-F765 HydrophobicContact CD2-CD1 4.06Å; L111-F765 VanDerWaalsContact CD2-O 3.28Å; L111-F765 WeakPolarHBondContact CD2-O 3.25Å; L111-F765 HydrophobicContact CG-CB 4.47Å; L111-F765 HydrophobicContact CG-CD1 4.44Å; I761-F765 HydrophobicContact CG2-CD2 4.12Å; I761-F765 HydrophobicContact CG2-CE2 3.77Å; I761-F765 VanDerWaalsContact O-CD2 3.29Å; I761-F765 WeakPolarHBondContact O-CD2 3.37Å; I761-F765 PolarHBondContact O-N 3.16Å; H762-F765 PolarHBondContact O-N 3.37Å; H762-F765 VanDerWaalsContact O-N 3.16Å; F765-N767 PolarHBondContact O-N 3.49Å; F765-Y768 PolarHBondContact O-N 3.06Å; F765-L771 HydrophobicContact CE1-CB 3.95Å; F765-L771 HydrophobicContact CE2-CD2 4.04Å; F765-L771 HydrophobicContact CZ-CB 3.94Å; F765-L771 HydrophobicContact CZ-CD2 4.03Å; F765-L1062 HydrophobicContact CZ-CD2 4.15Å; F765-I1064 HydrophobicContact CZ-CG1 4.36Å; F765-R1094 HydrophobicContact CE1-CB 4.1Å; F765-R1094 HydrophobicContact CE1-CG 4Å; F765-R1094 HydrophobicContact CZ-CB 4.06Å; F765-R1094 HydrophobicContact CZ-CG 4.08Å
766	D	90.3	Very high	94.8	Very high	63 Å²	63	21 Å²	21	34%	0.337	10%	0.098	S	C	.	.	H	α-helix	trans	-61.2	-24.2	173.5	-72.4	-22.2	0	0	0	112.8	H115 H762 K1067	H115-D766 IonicContact CE1-OD1 3.33Å; H115-D766 PolarHBondContact CE1-OD1 2.83Å; H115-D766 IonicContact ND1-OD1 2.88Å; H115-D766 PolarHBondContact ND1-OD1 2.78Å; H762-D766 WeakPolarHBondContact O-CB 3.44Å; H762-D766 VanDerWaalsContact O-CG 3.25Å; H762-D766 PolarHBondContact O-N 3.46Å; D766-K1067 WeakPolarHBondContact OD1-CE 3.47Å; D766-K1067 IonicContact OD1-NZ 3.69Å; D766-K1067 PolarHBondContact OD1-NZ 3.42Å; D766-K1067 IonicContact OD2-NZ 3.7Å; D766-K1067 PolarHBondContact OD2-NZ 2.89Å
767	N	90.4	Very high	94.4	Very high	40 Å²	40	22.7 Å²	22.7	21%	0.214	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.3	18.3	175	-74.5	-91	0	0	0	112.8	L725 T763 V764 F765 C769	L725-N767 HydrophobicContact CD1-CB 4.4Å; T763-N767 PolarHBondContact O-N 3.26Å; T763-N767 PolarHBondContact O-ND2 2.99Å; V764-N767 PolarHBondContact O-N 2.82Å; F765-N767 PolarHBondContact O-N 3.49Å; N767-C769 PolarHBondContact O-N 2.88Å; N767-C769 VanDerWaalsContact O-N 3.09Å; N767-C769 PolarHBondContact O-SG 2.91Å; N767-C769 VanDerWaalsContact O-SG 3.36Å
768	Y	90.2	Very high	93.8	Very high	135 Å²	135	26.4 Å²	26.4	53%	0.529	13%	0.126	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.6	29.4	176.7	-58.5	-90.3	0	0	0	114.2	A112 F765 N1096	A112-Y768 HydrophobicContact CB-CE1 4.48Å; F765-Y768 PolarHBondContact O-N 3.06Å; Y768-N1096 WeakPolarHBondContact O-CB 2.95Å; Y768-N1096 PolarHBondContact O-ND2 3.47Å; Y768-N1096 VanDerWaalsContact O-ND2 3.07Å
769	C	93.1	Very high	93.5	Very high	10 Å²	10	26.2 Å²	26.2	7%	0.068	13%	0.128	C	C	.	.			trans	-96.8	147.6	178.7	-69.2	0	0	0	0	110.8	N736 V738 V764 N767	N736-C769 WeakPolarHBondContact O-CA 3.04Å; V738-C769 HydrophobicContact CG2-CB 4.21Å; V764-C769 HydrophobicContact CG1-CB 3.81Å; V764-C769 PolarHBondContact O-N 3.01Å; N767-C769 PolarHBondContact O-N 2.88Å; N767-C769 VanDerWaalsContact O-N 3.09Å; N767-C769 PolarHBondContact O-SG 2.91Å; N767-C769 VanDerWaalsContact O-SG 3.36Å
770	G	94.9	Very high	93.4	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.01	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	149.6	162.4	0	0	0	0	0	110.5	N736 V737 V738 R1094	N736-G770 PolarHBondContact O-N 3.08Å; V737-G770 CarbonylContact C-O 3.6Å; V737-G770 VanDerWaalsContact CA-O 3.3Å; V737-G770 WeakPolarHBondContact CA-O 3.18Å; V738-G770 PolarHBondContact N-O 2.76Å; G770-R1094 CarbonylContact C-O 3.58Å; G770-R1094 WeakPolarHBondContact CA-O 3.47Å
771	L	97.9	Very high	93.1	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	131.9	178.1	179.5	58.9	0	0	0	110.7	V738 M740 I761 V764 F765 I773 L1062 L1093 R1094	V738-L771 HydrophobicContact CB-CD1 4.25Å; V738-L771 HydrophobicContact CG1-CD1 4.35Å; V738-L771 CarbonylContact O-C 3.59Å; V738-L771 WeakPolarHBondContact O-CA 3.36Å; M740-L771 HydrophobicContact CG-CD1 4.22Å; M740-L771 HydrophobicContact SD-CD1 3.96Å; I761-L771 HydrophobicContact CB-CD2 4.14Å; I761-L771 HydrophobicContact CG1-CD2 4.1Å; I761-L771 HydrophobicContact CG2-CD2 3.66Å; V764-L771 HydrophobicContact CB-CD1 4.45Å; V764-L771 HydrophobicContact CG1-CB 3.91Å; V764-L771 HydrophobicContact CG1-CD1 4.14Å; V764-L771 HydrophobicContact CG1-CG 4.45Å; V764-L771 HydrophobicContact CG2-CD1 4.27Å; F765-L771 HydrophobicContact CE1-CB 3.95Å; F765-L771 HydrophobicContact CE2-CD2 4.04Å; F765-L771 HydrophobicContact CZ-CB 3.94Å; F765-L771 HydrophobicContact CZ-CD2 4.03Å; L771-I773 HydrophobicContact CD1-CG1 4.23Å; L771-I773 HydrophobicContact CD2-CD1 4.22Å; L771-I773 HydrophobicContact CD2-CG1 4.34Å; L771-I773 HydrophobicContact CG-CG1 4.1Å; L771-L1062 HydrophobicContact CB-CD2 4.35Å; L771-L1062 HydrophobicContact CD2-CD2 3.66Å; L771-L1062 HydrophobicContact CG-CD2 3.95Å; L771-L1093 CarbonylContact O-C 3.58Å; L771-L1093 WeakPolarHBondContact O-CA 3.48Å; L771-R1094 PolarHBondContact N-O 2.97Å; L771-R1094 PolarHBondContact O-N 3.32Å
772	A	98.1	Very high	92.7	Very high	6 Å²	6	26.5 Å²	26.5	5%	0.05	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	127.1	173.5	0	0	0	0	0	109.4	V738 L739 M740 L1091 Y1092 L1093	V738-A772 PolarHBondContact O-N 2.95Å; L739-A772 CarbonylContact C-O 3.57Å; L739-A772 WeakPolarHBondContact CA-O 3.48Å; L739-A772 HydrophobicContact CB-CB 4.2Å; L739-A772 HydrophobicContact CD1-CB 3.57Å; L739-A772 HydrophobicContact CG-CB 4.45Å; M740-A772 PolarHBondContact N-O 3.14Å; A772-L1091 HydrophobicContact CB-CD1 4.16Å; A772-Y1092 CarbonylContact C-O 3.58Å; A772-Y1092 VanDerWaalsContact CA-O 3.25Å; A772-Y1092 WeakPolarHBondContact CA-O 3.09Å; A772-L1093 HydrophobicContact CB-CD1 3.64Å
773	I	98.3	Very high	92.3	Very high	0 Å²	0	27 Å²	27	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	110.4	176.5	-51.9	179.2	0	0	0	108.2	M740 F742 Y757 I761 L771 L1062 L1079 Y1092	M740-I773 HydrophobicContact CG-CG1 3.99Å; M740-I773 CarbonylContact O-C 3.53Å; M740-I773 WeakPolarHBondContact O-CA 3.14Å; M740-I773 HydrophobicContact SD-CG1 4.43Å; F742-I773 HydrophobicContact CB-CG2 3.82Å; F742-I773 HydrophobicContact CD2-CG2 4.11Å; F742-I773 HydrophobicContact CG-CG2 4.48Å; Y757-I773 WeakPolarHBondContact OH-CG2 3.28Å; I761-I773 HydrophobicContact CD1-CD1 3.79Å; I761-I773 HydrophobicContact CG1-CD1 4.28Å; L771-I773 HydrophobicContact CD1-CG1 4.23Å; L771-I773 HydrophobicContact CD2-CD1 4.22Å; L771-I773 HydrophobicContact CD2-CG1 4.34Å; L771-I773 HydrophobicContact CG-CG1 4.1Å; I773-L1062 HydrophobicContact CD1-CD1 4.09Å; I773-L1062 HydrophobicContact CD1-CD2 4.07Å; I773-L1062 HydrophobicContact CG1-CD2 4.42Å; I773-L1079 HydrophobicContact CD1-CD1 4.3Å; I773-Y1092 PolarHBondContact N-O 2.67Å; I773-Y1092 PolarHBondContact O-N 3.23Å
774	L	97.7	Very high	91.9	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	124.8	177.9	-179.8	66.6	0	0	0	110	L658 F661 L739 M740 G741 F742 L780 F908 P1089 L1091	L658-L774 HydrophobicContact CD1-CB 4.27Å; L658-L774 HydrophobicContact CD1-CD2 4.03Å; F661-L774 HydrophobicContact CB-CD2 3.98Å; F661-L774 HydrophobicContact CD1-CD2 4Å; F661-L774 HydrophobicContact CD2-CD2 4.33Å; F661-L774 HydrophobicContact CE1-CD1 4.37Å; F661-L774 HydrophobicContact CE2-CD1 4.37Å; F661-L774 HydrophobicContact CG-CD2 3.84Å; F661-L774 HydrophobicContact CZ-CD1 4.29Å; L739-L774 HydrophobicContact CD1-CB 4.18Å; M740-L774 PolarHBondContact O-N 3.13Å; G741-L774 WeakPolarHBondContact CA-O 3.43Å; F742-L774 PolarHBondContact N-O 3.1Å; L774-L780 HydrophobicContact CB-CD1 4.3Å; L774-L780 HydrophobicContact CD2-CD1 4.29Å; L774-L780 HydrophobicContact CD2-CD2 4.12Å; L774-L780 HydrophobicContact CG-CD1 4.26Å; L774-L780 VanDerWaalsContact O-CD1 3.26Å; L774-L780 WeakPolarHBondContact O-CD1 3.39Å; L774-F908 HydrophobicContact CD2-CE2 4.08Å; L774-F908 HydrophobicContact CD2-CZ 4.24Å; L774-P1089 HydrophobicContact CD1-CB 4.24Å; L774-L1091 HydrophobicContact CB-CD1 4.08Å; L774-L1091 HydrophobicContact CD1-CD1 4.24Å
775	R	95.6	Very high	91.3	Very high	13 Å²	13	35.6 Å²	35.6	5%	0.049	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	133.3	174.4	-171.6	174.2	172.2	-77.7	0.3	111.4	F742 D1080 S1083 V1090	F742-R775 HydrophobicContact CB-CB 3.63Å; F742-R775 HydrophobicContact CB-CG 3.78Å; F742-R775 HydrophobicContact CD1-CG 3.8Å; F742-R775 HydrophobicContact CG-CB 4.13Å; F742-R775 HydrophobicContact CG-CG 3.9Å; R775-D1080 IonicContact CZ-OD1 2.72Å; R775-D1080 IonicContact NE-OD1 3.75Å; R775-D1080 PolarHBondContact NE-OD1 2.98Å; R775-D1080 IonicContact NH2-OD1 3.84Å; R775-D1080 PolarHBondContact NH2-OD1 3.37Å; R775-S1083 WeakPolarHBondContact CD-OG 3.46Å; R775-S1083 VanDerWaalsContact CZ-OG 3.22Å; R775-S1083 PolarHBondContact NE-OG 3.01Å; R775-S1083 VanDerWaalsContact NE-OG 3.1Å; R775-S1083 PolarHBondContact NH1-O 2.84Å; R775-S1083 PolarHBondContact NH1-OG 3.49Å; R775-V1090 PolarHBondContact N-O 3.19Å; R775-V1090 PolarHBondContact O-N 3.31Å; R775-V1090 VanDerWaalsContact O-N 3.16Å
776	L	92.9	Very high	90.7	Very high	6 Å²	6	35.4 Å²	35.4	3%	0.031	18%	0.178	C	C	.	.			trans	-120.6	142	168.4	-61.4	-173.9	0	0	0	108.5	N744 N778 G779 L780 F908 P1089	N744-L776 PolarHBondContact ND2-O 3.28Å; L776-N778 VanDerWaalsContact C-N 3.28Å; L776-N778 PolarHBondContact O-N 3.26Å; L776-G779 PolarHBondContact O-N 3.11Å; L776-L780 HydrophobicContact CD1-CD2 3.43Å; L776-L780 VanDerWaalsContact CD1-CD2 3.43Å; L776-L780 HydrophobicContact CD1-CG 4.11Å; L776-L780 HydrophobicContact CG-CD2 3.87Å; L776-L780 HydrophobicContact CG-CG 4.17Å; L776-F908 HydrophobicContact CD1-CE2 4.43Å; L776-F908 HydrophobicContact CD2-CZ 4.15Å; L776-P1089 HydrophobicContact CD2-CB 3.59Å; L776-P1089 HydrophobicContact CD2-CG 3.59Å
777	Q	85.5	Confident	90.2	Very high	71 Å²	71	34.6 Å²	34.6	33%	0.332	18%	0.181	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-41.7	179.6	-59.8	-60.9	-15.2	0	0	112.1	N744 G779 S1083 M1086	N744-Q777 PolarHBondContact ND2-O 3.26Å; Q777-G779 VanDerWaalsContact C-N 3.26Å; Q777-G779 PolarHBondContact O-N 3.47Å; Q777-S1083 PolarHBondContact NE2-O 3.13Å; Q777-M1086 WeakPolarHBondContact CG-O 3.43Å; Q777-M1086 PolarHBondContact NE2-O 3.15Å
778	N	83.8	Confident	89.7	Confident	89 Å²	89	39.5 Å²	39.5	48%	0.476	20%	0.2	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	4.4	179.7	-62.4	-5.5	0	0	0	114	L776 D904	L776-N778 VanDerWaalsContact C-N 3.28Å; L776-N778 PolarHBondContact O-N 3.26Å; N778-D904 PolarHBondContact ND2-OD2 2.98Å
779	G	89.4	Confident	88.9	Confident	10 Å²	10	33.4 Å²	33.4	10%	0.103	18%	0.177	C	C	.	.			trans	79.9	173.1	-174.2	0	0	0	0	0	113.9	N744 L776 Q777	N744-G779 WeakPolarHBondContact ND2-CA 3.18Å; N744-G779 PolarHBondContact ND2-N 3.45Å; L776-G779 PolarHBondContact O-N 3.11Å; Q777-G779 VanDerWaalsContact C-N 3.26Å; Q777-G779 PolarHBondContact O-N 3.47Å
780	L	90.8	Very high	87.6	Confident	9 Å²	9	34.8 Å²	34.8	5%	0.047	18%	0.184	C	C	.	.	S	Bend	trans	-109.9	-12.6	177.8	-75.2	162.4	0	0	0	112.4	R655 L658 L774 L776	R655-L780 VanDerWaalsContact CA-O 3.32Å; R655-L780 WeakPolarHBondContact CA-O 3.23Å; R655-L780 WeakPolarHBondContact CB-O 3.37Å; R655-L780 WeakPolarHBondContact CG-O 3.3Å; L658-L780 HydrophobicContact CB-CD2 4.21Å; L658-L780 HydrophobicContact CD1-CD1 4.27Å; L774-L780 HydrophobicContact CB-CD1 4.3Å; L774-L780 HydrophobicContact CD2-CD1 4.29Å; L774-L780 HydrophobicContact CD2-CD2 4.12Å; L774-L780 HydrophobicContact CG-CD1 4.26Å; L774-L780 VanDerWaalsContact O-CD1 3.26Å; L774-L780 WeakPolarHBondContact O-CD1 3.39Å; L776-L780 HydrophobicContact CD1-CD2 3.43Å; L776-L780 VanDerWaalsContact CD1-CD2 3.43Å; L776-L780 HydrophobicContact CD1-CG 4.11Å; L776-L780 HydrophobicContact CG-CD2 3.87Å; L776-L780 HydrophobicContact CG-CG 4.17Å
781	D	91.2	Very high	85.9	Confident	70 Å²	70	39.7 Å²	39.7	37%	0.374	21%	0.209	S	C	.	.			trans	-92.2	113.6	177	-151	-42	0	0	0	110	R655 S783	R655-D781 IonicContact CZ-OD2 2.83Å; R655-D781 IonicContact NE-OD2 2.66Å; R655-D781 PolarHBondContact NE-OD2 3.45Å; R655-D781 VanDerWaalsContact NE-OD2 3.09Å; R655-D781 IonicContact NH2-OD2 3.36Å; R655-D781 PolarHBondContact NH2-OD2 3.42Å; D781-S783 WeakPolarHBondContact OD1-CB 3.47Å; D781-S783 PolarHBondContact OD1-N 3.17Å; D781-S783 VanDerWaalsContact OD1-N 3.15Å; D781-S783 PolarHBondContact OD1-OG 3.43Å
782	F	88.7	Confident	83.8	Confident	1 Å²	1	43.8 Å²	43.8	0%	0.004	23%	0.229	C	C	.	.			trans	-103.5	7	-179.8	-54	-56.4	0	0	0	112.7	S654 P656 S657 D784 R785 I786 L901 D904 I905	S654-F782 PolarHBondContact O-N 2.87Å; P656-F782 HydrophobicContact CG-CD2 3.66Å; P656-F782 HydrophobicContact CG-CE2 3.92Å; S657-F782 VanDerWaalsContact OG-CE2 3.25Å; S657-F782 WeakPolarHBondContact OG-CE2 3.46Å; F782-D784 PolarHBondContact O-N 3.49Å; F782-R785 PolarHBondContact O-N 3.33Å; F782-R785 VanDerWaalsContact O-N 3.09Å; F782-I786 HydrophobicContact CB-CD1 3.86Å; F782-I786 HydrophobicContact CB-CG1 4.1Å; F782-I786 WeakPolarHBondContact O-CB 3.36Å; F782-I786 VanDerWaalsContact O-CG1 3.24Å; F782-I786 WeakPolarHBondContact O-CG1 3.47Å; F782-I786 PolarHBondContact O-N 2.85Å; F782-L901 HydrophobicContact CB-CD1 4.09Å; F782-L901 HydrophobicContact CD1-CD1 4.16Å; F782-L901 HydrophobicContact CG-CD1 4.2Å; F782-D904 HydrophobicContact CE1-CB 4.05Å; F782-D904 HydrophobicContact CZ-CB 4.17Å; F782-I905 HydrophobicContact CD2-CG1 3.77Å; F782-I905 HydrophobicContact CE2-CG1 4.13Å; F782-I905 HydrophobicContact CG-CG1 4.22Å
783	S	85.9	Confident	81.6	Confident	31 Å²	31	44.7 Å²	44.7	22%	0.217	24%	0.239	C	C	.	.	H	α-helix	trans	-51	-53.4	-175	-55.2	0	0	0	0	112.6	S654 D781 R785 I786 A787	S654-S783 WeakPolarHBondContact CB-OG 3.39Å; S654-S783 PolarHBondContact OG-OG 3.35Å; D781-S783 WeakPolarHBondContact OD1-CB 3.47Å; D781-S783 PolarHBondContact OD1-N 3.17Å; D781-S783 VanDerWaalsContact OD1-N 3.15Å; D781-S783 PolarHBondContact OD1-OG 3.43Å; S783-R785 VanDerWaalsContact C-N 3.35Å; S783-R785 PolarHBondContact O-N 3.33Å; S783-I786 PolarHBondContact O-N 3.35Å; S783-A787 PolarHBondContact O-N 2.99Å
784	D	85.3	Confident	79.2	Confident	123 Å²	123	47.5 Å²	47.5	66%	0.658	26%	0.259	S	S	*	.	H	α-helix	trans	-66.8	-35.5	-179.4	-64.3	-21.5	0	0	0	112.8	F782 K788	F782-D784 PolarHBondContact O-N 3.49Å; D784-K788 WeakPolarHBondContact O-CB 3.31Å; D784-K788 VanDerWaalsContact O-CG 3.25Å; D784-K788 WeakPolarHBondContact O-CG 3.32Å; D784-K788 PolarHBondContact O-N 2.87Å
785	R	84.6	Confident	76.4	Confident	65 Å²	65	52.2 Å²	52.2	25%	0.245	28%	0.284	C	S	.	.	H	α-helix	trans	-71.3	-39.7	179.8	-69.3	175.8	63.5	-168.5	1.4	111.2	F782 S783 C789 L901 D904	F782-R785 PolarHBondContact O-N 3.33Å; F782-R785 VanDerWaalsContact O-N 3.09Å; S783-R785 VanDerWaalsContact C-N 3.35Å; S783-R785 PolarHBondContact O-N 3.33Å; R785-C789 VanDerWaalsContact O-CB 3.25Å; R785-C789 WeakPolarHBondContact O-CB 3.28Å; R785-C789 PolarHBondContact O-N 2.9Å; R785-C789 PolarHBondContact O-SG 2.93Å; R785-L901 HydrophobicContact CB-CD1 3.84Å; R785-L901 HydrophobicContact CB-CD2 4.25Å; R785-D904 IonicContact CZ-OD2 2.8Å; R785-D904 IonicContact NH1-OD2 2.67Å; R785-D904 PolarHBondContact NH1-OD2 3.13Å; R785-D904 IonicContact NH2-OD2 2.63Å; R785-D904 PolarHBondContact NH2-OD2 2.79Å
786	I	80.4	Confident	73.5	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-62.5	-51.4	174.6	-68.4	165	0	0	0	109	F782 S783 K788 C789 D790 P883 S884 V885 L901 I905	F782-I786 HydrophobicContact CB-CD1 3.86Å; F782-I786 HydrophobicContact CB-CG1 4.1Å; F782-I786 WeakPolarHBondContact O-CB 3.36Å; F782-I786 VanDerWaalsContact O-CG1 3.24Å; F782-I786 WeakPolarHBondContact O-CG1 3.47Å; F782-I786 PolarHBondContact O-N 2.85Å; S783-I786 PolarHBondContact O-N 3.35Å; I786-K788 PolarHBondContact O-N 3.47Å; I786-C789 PolarHBondContact O-N 2.9Å; I786-C789 VanDerWaalsContact O-N 3.15Å; I786-D790 WeakPolarHBondContact O-CB 3.35Å; I786-D790 PolarHBondContact O-N 3.4Å; I786-P883 HydrophobicContact CG2-CB 3.73Å; I786-S884 WeakPolarHBondContact CG2-O 3.34Å; I786-V885 HydrophobicContact CD1-CG2 4.27Å; I786-L901 HydrophobicContact CG1-CD2 4.15Å; I786-I905 HydrophobicContact CD1-CD1 4.43Å; I786-I905 HydrophobicContact CG1-CD1 4.34Å
787	A	79.4	Confident	70.6	Confident	47 Å²	47	58.1 Å²	58.1	39%	0.388	33%	0.332	S	S	.	.	H	α-helix	trans	-57.8	-45.7	179	0	0	0	0	0	112.9	S783 D790 L791	S783-A787 PolarHBondContact O-N 2.99Å; A787-D790 PolarHBondContact O-N 3.17Å; A787-L791 WeakPolarHBondContact O-CD1 3.47Å; A787-L791 WeakPolarHBondContact O-CG 3.15Å; A787-L791 PolarHBondContact O-N 2.97Å
788	K	80	Confident	68	Low	142 Å²	142	62.8 Å²	62.8	62%	0.617	35%	0.351	S	S	*	.	H	α-helix	trans	-62.1	-43	175.8	-74.4	172.8	-177.2	177.1	0	112.4	D784 I786 D790 L791 M792	D784-K788 WeakPolarHBondContact O-CB 3.31Å; D784-K788 VanDerWaalsContact O-CG 3.25Å; D784-K788 WeakPolarHBondContact O-CG 3.32Å; D784-K788 PolarHBondContact O-N 2.87Å; I786-K788 PolarHBondContact O-N 3.47Å; K788-D790 VanDerWaalsContact C-N 3.35Å; K788-L791 PolarHBondContact O-N 3.46Å; K788-M792 WeakPolarHBondContact O-CG 3.44Å; K788-M792 PolarHBondContact O-N 3.47Å; K788-M792 VanDerWaalsContact O-N 3.1Å
789	C	72.7	Confident	65.4	Low	7 Å²	7	62.3 Å²	62.3	5%	0.047	36%	0.355	C	S	.	.	H	α-helix	trans	-71.6	-30	-178.5	-70.9	0	0	0	0	113	R785 I786 G793 F886 Q898 L901	R785-C789 VanDerWaalsContact O-CB 3.25Å; R785-C789 WeakPolarHBondContact O-CB 3.28Å; R785-C789 PolarHBondContact O-N 2.9Å; R785-C789 PolarHBondContact O-SG 2.93Å; I786-C789 PolarHBondContact O-N 2.9Å; I786-C789 VanDerWaalsContact O-N 3.15Å; C789-G793 PolarHBondContact O-N 2.77Å; C789-F886 HydrophobicContact CB-CE1 3.56Å; C789-F886 HydrophobicContact CB-CZ 3.64Å; C789-Q898 HydrophobicContact CB-CG 4.07Å; C789-Q898 PolarHBondContact O-NE2 3.48Å; C789-L901 HydrophobicContact CB-CD2 3.97Å
790	D	66.9	Low	62.4	Low	39 Å²	39	66.4 Å²	66.4	21%	0.209	39%	0.388	C	S	.	.	H	α-helix	trans	-68	-46.6	171.2	-87.3	-6.4	0	0	0	111.4	I786 A787 K788 M792 G793 S794 S884	I786-D790 WeakPolarHBondContact O-CB 3.35Å; I786-D790 PolarHBondContact O-N 3.4Å; A787-D790 PolarHBondContact O-N 3.17Å; K788-D790 VanDerWaalsContact C-N 3.35Å; D790-M792 PolarHBondContact O-N 3.06Å; D790-G793 WeakPolarHBondContact O-CA 3.12Å; D790-G793 PolarHBondContact O-N 3.03Å; D790-S794 PolarHBondContact O-N 3.16Å; D790-S884 VanDerWaalsContact CG-O 3.26Å; D790-S884 PolarHBondContact OD2-OG 2.87Å
791	L	59.8	Low	59.4	Low	104 Å²	104	69.6 Å²	69.6	55%	0.545	41%	0.41	S	S	.	.	H	α-helix	trans	-60.6	-41.6	177.8	-74.8	160.1	0	0	0	112.6	A787 K788 G793 S794 D795	A787-L791 WeakPolarHBondContact O-CD1 3.47Å; A787-L791 WeakPolarHBondContact O-CG 3.15Å; A787-L791 PolarHBondContact O-N 2.97Å; K788-L791 PolarHBondContact O-N 3.46Å; L791-G793 PolarHBondContact O-N 2.89Å; L791-S794 PolarHBondContact O-N 3.33Å; L791-S794 VanDerWaalsContact O-N 3.11Å; L791-S794 PolarHBondContact O-OG 3.06Å; L791-D795 PolarHBondContact O-N 3.17Å; L791-D795 VanDerWaalsContact O-N 3.16Å
792	M	53.5	Low	56.2	Low	86 Å²	86	73.5 Å²	73.5	42%	0.424	43%	0.431	S	S	.	.	H	α-helix	trans	-61.8	-26.3	174.1	-71.3	-166.8	-62.1	0	0	112.7	K788 D790 D897	K788-M792 WeakPolarHBondContact O-CG 3.44Å; K788-M792 PolarHBondContact O-N 3.47Å; K788-M792 VanDerWaalsContact O-N 3.1Å; D790-M792 PolarHBondContact O-N 3.06Å; M792-D897 HydrophobicContact CE-CB 4.42Å
793	G	51	Low	53.1	Low	25 Å²	25	80.3 Å²	80.3	26%	0.258	47%	0.472	S	S	.	.	H	α-helix	trans	-73.1	-29.2	175.6	0	0	0	0	0	113.8	C789 D790 L791 R892	C789-G793 PolarHBondContact O-N 2.77Å; D790-G793 WeakPolarHBondContact O-CA 3.12Å; D790-G793 PolarHBondContact O-N 3.03Å; L791-G793 PolarHBondContact O-N 2.89Å; G793-R892 PolarHBondContact O-NH1 3.43Å
794	S	48.2	Very low	50.3	Low	60 Å²	60	82.7 Å²	82.7	42%	0.42	49%	0.494	S	S	.	.	H	α-helix	trans	-86.8	-38.2	-179.9	51.6	0	0	0	0	113.7	D790 L791 A796 S797	D790-S794 PolarHBondContact O-N 3.16Å; L791-S794 PolarHBondContact O-N 3.33Å; L791-S794 VanDerWaalsContact O-N 3.11Å; L791-S794 PolarHBondContact O-OG 3.06Å; S794-A796 VanDerWaalsContact C-N 3.3Å; S794-A796 PolarHBondContact O-N 2.91Å; S794-S797 PolarHBondContact O-N 3.26Å; S794-S797 VanDerWaalsContact O-N 3.11Å; S794-S797 PolarHBondContact O-OG 3.46Å
795	D	37.9	Very low	47.4	Very low	99 Å²	99	85.9 Å²	85.9	53%	0.529	51%	0.505	S	S	.	.	H	α-helix	trans	-75.4	-16.6	-172.3	-73	-21.2	0	0	0	114.6	L791 S797 K798 S799	L791-D795 PolarHBondContact O-N 3.17Å; L791-D795 VanDerWaalsContact O-N 3.16Å; D795-S797 PolarHBondContact O-N 3.44Å; D795-K798 PolarHBondContact O-N 3.36Å; D795-S799 PolarHBondContact O-N 3.32Å; D795-S799 PolarHBondContact O-OG 3.01Å
796	A	35.7	Very low	44.6	Very low	57 Å²	57	91 Å²	91	47%	0.471	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-15.1	169.4	0	0	0	0	0	112.8	S794	S794-A796 VanDerWaalsContact C-N 3.3Å; S794-A796 PolarHBondContact O-N 2.91Å
797	S	33	Very low	42	Very low	86 Å²	86	96 Å²	96	60%	0.601	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82	-14.6	176	92.3	0	0	0	0	113.8	S794 D795	S794-S797 PolarHBondContact O-N 3.26Å; S794-S797 VanDerWaalsContact O-N 3.11Å; S794-S797 PolarHBondContact O-OG 3.46Å; D795-S797 PolarHBondContact O-N 3.44Å
798	K	29.7	Very low	39.4	Very low	168 Å²	168	99.6 Å²	99.6	73%	0.73	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.7	-17.8	-179.3	-72.3	-174.3	179	176.1	0	114	D795	D795-K798 PolarHBondContact O-N 3.36Å
799	S	28.6	Very low	37.1	Very low	80 Å²	80	98.8 Å²	98.8	56%	0.559	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.6	-3.9	-175.1	36.2	0	0	0	0	114.5	D795	D795-S799 PolarHBondContact O-N 3.32Å; D795-S799 PolarHBondContact O-OG 3.01Å
800	A	27.7	Very low	34.9	Very low	96 Å²	96	103 Å²	103	79%	0.793	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.9	-5.2	177.2	0	0	0	0	0	114.7
801	S	26.4	Very low	32.8	Very low	75 Å²	75	105.9 Å²	105.9	52%	0.524	67%	0.665	S	S	.	*	S	Bend	trans	-134.5	121	174.7	57.4	0	0	0	0	109.2
802	N	24.9	Very low	31.2	Very low	153 Å²	153	106.3 Å²	106.3	82%	0.818	67%	0.674	S	S	*	*			trans	96.5	47.2	177.6	-44.2	-24.5	0	0	0	115.3	A804	N802-A804 PolarHBondContact O-N 3.24Å
803	V	24.6	Very low	29.8	Very low	143 Å²	143	108.4 Å²	108.4	87%	0.867	69%	0.691	S	S	*	*			trans	-82	74.9	146.8	-173.5	0	0	0	0	107.2
804	A	26	Very low	28.4	Very low	82 Å²	82	112 Å²	112	68%	0.678	72%	0.719	S	S	*	*			trans	-143.5	94.4	165.5	0	0	0	0	0	107.2	N802	N802-A804 PolarHBondContact O-N 3.24Å
805	E	25	Very low	27.4	Very low	189 Å²	189	116.4 Å²	116.4	88%	0.883	74%	0.736	S	S	*	*			trans	59.6	88.8	139.3	-155.7	169.7	-146.4	0	0	117
806	L	25.2	Very low	26.6	Very low	172 Å²	172	119 Å²	119	90%	0.901	75%	0.75	S	S	*	*			trans	-160.4	115.2	133.8	-141.1	66.5	0	0	0	111.8
807	S	25.1	Very low	26.2	Very low	105 Å²	105	124.6 Å²	124.6	73%	0.734	77%	0.766	S	S	*	*	P	Polyproline II helix	trans	-60.3	148	170.7	-46.8	0	0	0	0	111.5
808	P	26.7	Very low	25.8	Very low	123 Å²	123	126 Å²	126	80%	0.799	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-82.1	135.9	-169.4	31.5	-33.1	0	0	0	112.5
809	P	31	Very low	25.5	Very low	125 Å²	125	124.9 Å²	124.9	81%	0.812	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-88.2	145.6	159.4	28.8	-18.3	0	0	0	110.6
810	A	26.2	Very low	25.5	Very low	96 Å²	96	125.8 Å²	125.8	79%	0.793	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-58.9	155.4	-173.1	0	0	0	0	0	115.2
811	A	22	Very low	25.4	Very low	99 Å²	99	125.8 Å²	125.8	82%	0.818	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-54.3	141.1	175.5	0	0	0	0	0	114.1
812	P	27	Very low	25.3	Very low	114 Å²	114	125.5 Å²	125.5	74%	0.74	80%	0.801	S	S	*	*			trans	-112.8	115.6	151.5	18.2	1.3	0	0	0	110.9
813	T	24	Very low	25.3	Very low	129 Å²	129	125.7 Å²	125.7	79%	0.791	80%	0.802	S	S	*	*			trans	12.2	119.9	138.9	49.2	0	0	0	0	119.8
814	A	20.9	Very low	25.2	Very low	101 Å²	101	129.1 Å²	129.1	84%	0.835	81%	0.806	S	S	*	*			trans	13.5	115.5	139.5	0	0	0	0	0	119
815	I	27.3	Very low	25.2	Very low	152 Å²	152	132.9 Å²	132.9	78%	0.779	81%	0.813	S	S	*	*			trans	-140.6	119.7	151.6	-59.5	-178.2	0	0	0	108.8
816	D	21.7	Very low	25.2	Very low	153 Å²	153	128.5 Å²	128.5	82%	0.818	80%	0.803	S	S	*	*			trans	-60	135.9	168.4	-81.8	-47.8	0	0	0	112.1
817	H	26.6	Very low	25.2	Very low	175 Å²	175	126.4 Å²	126.4	81%	0.81	80%	0.8	S	S	*	*			trans	-137.8	124.5	153.1	-90.4	-62.6	0	0	0	111
818	P	25.7	Very low	25.3	Very low	116 Å²	116	130.4 Å²	130.4	75%	0.753	81%	0.807	S	S	*	*			trans	-84.3	139.7	-177.5	32.8	-32.6	0	0	0	112.7	A820	P818-A820 PolarHBondContact O-N 3.29Å
819	V	23.6	Very low	25.2	Very low	145 Å²	145	133.5 Å²	133.5	88%	0.879	81%	0.811	S	S	*	*			trans	-6.1	107	157.9	-172.9	0	0	0	0	115.6
820	A	28	Very low	25	Very low	99 Å²	99	133.7 Å²	133.7	82%	0.818	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-80.4	126.1	166.1	0	0	0	0	0	110.4	P818	P818-A820 PolarHBondContact O-N 3.29Å
821	A	24.6	Very low	25	Very low	95 Å²	95	138 Å²	138	79%	0.785	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-65.4	143.6	177.5	0	0	0	0	0	112.1
822	G	24.4	Very low	25	Very low	69 Å²	69	139.3 Å²	139.3	71%	0.711	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-64.3	133.6	-175.3	0	0	0	0	0	114.2
823	N	25.9	Very low	25	Very low	157 Å²	157	140.5 Å²	140.5	84%	0.84	82%	0.822	S	S	*	*	P	Polyproline II helix	trans	-90.9	121.7	162.9	-95.5	-10	0	0	0	109.5	I825	N823-I825 PolarHBondContact O-N 3Å
824	F	21.2	Very low	24.9	Very low	216 Å²	216	142.7 Å²	142.7	95%	0.947	83%	0.828	S	S	*	*	P	Polyproline II helix	trans	-61.5	123.5	166.8	-80.7	-104	0	0	0	109.8
825	I	27.9	Very low	25.1	Very low	160 Å²	160	148.7 Å²	148.7	82%	0.821	83%	0.829	S	S	*	*			trans	-115.3	119.7	170.1	-62.2	174.7	0	0	0	107.5	N823	N823-I825 PolarHBondContact O-N 3Å
826	S	24.5	Very low	24.9	Very low	98 Å²	98	150.1 Å²	150.1	69%	0.685	83%	0.832	S	S	*	*			trans	-77.3	147.8	171.8	65.1	0	0	0	0	110.7
827	P	25.5	Very low	25.2	Very low	128 Å²	128	149.5 Å²	149.5	83%	0.831	83%	0.829	S	S	*	*			trans	-88.3	122.3	-177	26.1	-14.7	0	0	0	111.1
828	E	26.3	Very low	25	Very low	189 Å²	189	145.5 Å²	145.5	88%	0.883	82%	0.82	S	S	*	*			trans	-111.3	147.6	165.1	-84.5	-172.9	162.8	0	0	111.2
829	E	25	Very low	24.8	Very low	188 Å²	188	150.1 Å²	150.1	88%	0.879	82%	0.824	S	S	*	*			trans	-66.9	145.1	-171.4	-59.3	169.3	142.1	0	0	112.9
830	S	27.7	Very low	25	Very low	128 Å²	128	150.9 Å²	150.9	90%	0.895	82%	0.82	S	S	*	*			trans	-150.5	138.3	158.4	-80.5	0	0	0	0	111.8
831	Q	24.4	Very low	24.6	Very low	188 Å²	188	152.5 Å²	152.5	88%	0.879	82%	0.82	S	S	*	*			trans	-86.4	154.1	-158.2	-68.4	169.9	-29.2	0	0	114.5
832	T	21.9	Very low	24.8	Very low	126 Å²	126	157.9 Å²	157.9	77%	0.773	82%	0.821	S	S	*	*			trans	-25	135	156.5	39.7	0	0	0	0	118.4
833	V	28.2	Very low	24.8	Very low	139 Å²	139	158.1 Å²	158.1	84%	0.842	82%	0.824	S	S	*	*			trans	-146.2	113.5	140.4	-177.3	0	0	0	0	109.3
834	L	21.7	Very low	24.6	Very low	175 Å²	175	156.3 Å²	156.3	92%	0.916	82%	0.823	S	S	*	*			trans	-95.1	133.7	167.9	-77.1	160.6	0	0	0	108
835	R	25.7	Very low	24.9	Very low	227 Å²	227	156.3 Å²	156.3	86%	0.857	82%	0.823	S	S	*	*			trans	-125.9	120.1	178.1	-164.3	171.9	-178.2	139.3	0.1	110.4
836	E	21.8	Very low	24.5	Very low	181 Å²	181	157.5 Å²	157.5	85%	0.846	83%	0.825	S	S	*	*			trans	-83.9	147.7	168.8	-69.7	174.2	141	0	0	110.1
837	D	28	Very low	24.5	Very low	140 Å²	140	158.6 Å²	158.6	75%	0.749	83%	0.833	S	S	*	*			trans	175	155.6	148.6	-85.6	-36.3	0	0	0	108.5
838	S	23.8	Very low	24.5	Very low	91 Å²	91	157.4 Å²	157.4	64%	0.636	83%	0.828	S	S	*	*			cis	173.9	127	-28.1	-84.5	0	0	0	0	105.1
839	Y	21	Very low	24.3	Very low	213 Å²	213	156.5 Å²	156.5	84%	0.835	82%	0.824	S	S	*	*			trans	-19.7	142.9	170	-43.2	-93.1	0	0	0	120.3
840	M	26.8	Very low	24.3	Very low	162 Å²	162	155.1 Å²	155.1	80%	0.798	82%	0.821	S	S	*	*			trans	-145.8	131.7	150	-77	-60.9	-89.3	0	0	112.1	Y842	M840-Y842 HydrophobicContact CE-CE2 3.96Å
841	T	21.2	Very low	24.1	Very low	132 Å²	132	154.2 Å²	154.2	81%	0.81	81%	0.812	S	S	*	*			trans	-113.6	135.9	-179.4	-41.1	0	0	0	0	108.3
842	Y	27.3	Very low	24.2	Very low	208 Å²	208	154.9 Å²	154.9	82%	0.816	81%	0.812	S	S	*	*			trans	-133	106.6	173.7	-95.7	-83.1	0	0	0	113.2	M840	M840-Y842 HydrophobicContact CE-CE2 3.96Å
843	G	24.9	Very low	24.6	Very low	74 Å²	74	155.3 Å²	155.3	76%	0.763	82%	0.815	S	S	*	*				47.5	112.9	119.3	0	0	0	0	0	122.3
844	S	21.6	Very low	24.4	Very low	119 Å²	119	157.9 Å²	157.9	83%	0.832	82%	0.818	S	S	*	*			trans	-62.5	146.9	160.3	50.3	0	0	0	0	115.7
845	K	27.6	Very low	24.8	Very low	216 Å²	216	154.3 Å²	154.3	94%	0.939	81%	0.813	S	S	*	*			trans	-149.5	130.8	156.5	-106.5	-177.8	-179.3	179.5	0	111.9
846	E	20.2	Very low	25	Very low	186 Å²	186	152 Å²	152	87%	0.869	81%	0.812	S	S	*	*			trans	-74	150.1	174.8	-63	163.8	136.8	0	0	112.3
847	S	23.5	Very low	25.2	Very low	120 Å²	120	152.2 Å²	152.2	84%	0.839	81%	0.813	S	S	*	*				161.4	134.4	126.5	49.5	0	0	0	0	114.6
848	S	26	Very low	25.1	Very low	104 Å²	104	151.9 Å²	151.9	73%	0.727	82%	0.816	S	S	*	*			trans	76	105.4	142.5	-147.4	0	0	0	0	123.3
849	E	22.1	Very low	25.4	Very low	170 Å²	170	156.2 Å²	156.2	79%	0.794	83%	0.827	S	S	*	*				40.9	113.7	128.7	-54.9	179.8	158.6	0	0	121.9
850	L	23.8	Very low	25.8	Very low	159 Å²	159	154.7 Å²	154.7	83%	0.832	83%	0.827	S	S	*	*				170	144.5	98.9	-112.6	108.6	0	0	0	110.6
851	P	24.1	Very low	25.8	Very low	108 Å²	108	154.8 Å²	154.8	70%	0.701	83%	0.829	S	S	*	*			trans	-96.4	145	-174.5	36	-30.5	0	0	0	112.6
852	K	27	Very low	26.2	Very low	203 Å²	203	155.6 Å²	155.6	88%	0.883	83%	0.828	S	S	*	*			trans	-170.6	122.7	151.5	-108.3	163.7	-167.9	-177	0	113.6
853	T	29.3	Very low	26.5	Very low	135 Å²	135	153.1 Å²	153.1	83%	0.828	82%	0.824	S	S	*	*			trans	78.4	104.5	149.4	7.4	0	0	0	0	119
854	E	24.8	Very low	26.7	Very low	192 Å²	192	160.4 Å²	160.4	90%	0.897	83%	0.83	S	S	*	*			trans	-53.5	122.7	162.3	-64.3	151.5	161.6	0	0	111.5
855	A	31	Very low	27	Very low	100 Å²	100	162.3 Å²	162.3	83%	0.826	83%	0.83	S	S	*	*			trans	-136.3	108	151.1	0	0	0	0	0	105.7	E857	A855-E857 PolarHBondContact O-N 3.41Å
856	E	29.5	Very low	27.2	Very low	178 Å²	178	156.2 Å²	156.2	83%	0.832	81%	0.814	S	S	*	*			trans	-62.7	113.2	-168.5	-67.7	170.7	140.8	0	0	112.4	T858	E856-T858 PolarHBondContact O-N 3.03Å
857	E	25.1	Very low	27.7	Very low	186 Å²	186	156.6 Å²	156.6	87%	0.869	82%	0.816	S	S	*	*				33.6	85.4	126.2	-63.3	-177.3	166.6	0	0	117.3	A855	A855-E857 PolarHBondContact O-N 3.41Å
858	T	27.3	Very low	28	Very low	133 Å²	133	159.6 Å²	159.6	82%	0.816	82%	0.817	S	S	*	*			trans	-153.2	50.5	152.9	-21.3	0	0	0	0	113.8	E856	E856-T858 PolarHBondContact O-N 3.03Å
859	E	29.4	Very low	28.2	Very low	182 Å²	182	160 Å²	160	85%	0.85	82%	0.817	S	S	*	*	S	Bend	trans	-152.2	2.8	171.2	-118.6	163.7	-151.3	0	0	119.7
860	E	28.6	Very low	28.8	Very low	182 Å²	182	158.1 Å²	158.1	85%	0.85	82%	0.819	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109	20.4	-172.5	-102.2	-178.2	-173.7	0	0	117.7	L862	E860-L862 VanDerWaalsContact C-N 3.3Å
861	I	28.2	Very low	29.2	Very low	164 Å²	164	154.8 Å²	154.8	84%	0.841	82%	0.815	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.9	-6.9	168.5	-64.4	178.1	0	0	0	112.1
862	L	29.3	Very low	29.5	Very low	148 Å²	148	155.5 Å²	155.5	78%	0.775	82%	0.819	S	S	*	*	S	Bend	trans	-93.2	-8.8	-169	-95.6	140.9	0	0	0	116.6	E860	E860-L862 VanDerWaalsContact C-N 3.3Å
863	E	34	Very low	29.6	Very low	156 Å²	156	151.9 Å²	151.9	73%	0.729	82%	0.82	S	S	*	*	S	Bend	trans	-99.1	-11.6	-174.6	-144.5	167.1	-161	0	0	115	L865 S866	E863-L865 VanDerWaalsContact C-N 3.29Å; E863-L865 PolarHBondContact O-N 3.09Å; E863-S866 PolarHBondContact O-OG 2.9Å; E863-S866 VanDerWaalsContact O-OG 3.14Å
864	Y	28.1	Very low	29.7	Very low	228 Å²	228	149.2 Å²	149.2	89%	0.894	82%	0.819	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	8.2	-179.1	-125	-87.9	0	0	0	115.4
865	L	29.1	Very low	29.8	Very low	159 Å²	159	145.9 Å²	145.9	83%	0.832	81%	0.812	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.8	13	177.3	-67.6	177.1	0	0	0	113.7	E863	E863-L865 VanDerWaalsContact C-N 3.29Å; E863-L865 PolarHBondContact O-N 3.09Å
866	S	30.5	Very low	29.6	Very low	88 Å²	88	149.3 Å²	149.3	62%	0.615	81%	0.811	S	S	*	*			trans	-97.6	-4.6	-167.8	-40.8	0	0	0	0	116.3	E863	E863-S866 PolarHBondContact O-OG 2.9Å; E863-S866 VanDerWaalsContact O-OG 3.14Å
867	E	30.2	Very low	29.6	Very low	193 Å²	193	146.5 Å²	146.5	90%	0.902	81%	0.808	S	S	*	*			trans	-109.2	82.7	-178.6	-72.6	-171.9	164.7	0	0	111.9
868	E	30.5	Very low	30.3	Very low	184 Å²	184	145 Å²	145	86%	0.86	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-77.5	134.9	158.5	-88.5	-172.7	162.2	0	0	110.1
869	P	31.2	Very low	30.9	Very low	112 Å²	112	145.4 Å²	145.4	73%	0.727	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-68.8	149.9	177.3	27.7	-32.2	0	0	0	111.6	A871	P869-A871 PolarHBondContact O-N 2.77Å
870	P	34	Very low	31.7	Very low	130 Å²	130	140.5 Å²	140.5	84%	0.844	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-65.9	132	-172.6	25.8	-32.9	0	0	0	112.1
871	A	31.5	Very low	32.8	Very low	89 Å²	89	136.3 Å²	136.3	74%	0.736	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-61.2	143.3	177.7	0	0	0	0	0	112	P869 S873	P869-A871 PolarHBondContact O-N 2.77Å; A871-S873 PolarHBondContact O-N 3.28Å
872	P	30.4	Very low	33.7	Very low	123 Å²	123	130.1 Å²	130.1	80%	0.799	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-62.8	127	-180	24.4	-31.5	0	0	0	111
873	S	29.8	Very low	34.8	Very low	127 Å²	127	125 Å²	125	89%	0.888	71%	0.707	S	S	*	*	S	Bend	trans	-65	132.1	176.2	53.5	0	0	0	0	111	A871	A871-S873 PolarHBondContact O-N 3.28Å
874	G	30.7	Very low	35.6	Very low	80 Å²	80	119.6 Å²	119.6	83%	0.825	69%	0.687	S	S	*	*			trans	114.3	27.6	158.6	0	0	0	0	0	118.3
875	T	27.1	Very low	36.9	Very low	121 Å²	121	110.6 Å²	110.6	74%	0.742	66%	0.656	S	S	*	*			trans	-118.5	120	162.8	-24.6	0	0	0	0	109.1
876	E	27.3	Very low	37.9	Very low	172 Å²	172	104.8 Å²	104.8	80%	0.804	62%	0.624	S	S	*	*			trans	-49.8	146.7	173.2	-68.2	175	158.6	0	0	110.6	Q878	E876-Q878 PolarHBondContact O-N 3.25Å
877	P	29.4	Very low	38.6	Very low	120 Å²	120	108.7 Å²	108.7	78%	0.779	63%	0.63	S	S	*	*			trans	-62.7	107.9	-176.2	-1.1	12.7	0	0	0	108.9	D879	P877-D879 PolarHBondContact O-N 3.29Å; P877-D879 VanDerWaalsContact O-N 3.08Å
878	Q	38.8	Very low	39.3	Very low	154 Å²	154	106.2 Å²	106.2	72%	0.72	62%	0.622	S	S	*	*			trans	-70.1	104.1	170.5	-78.8	-176.9	-10.8	0	0	107.9	E876 S880	E876-Q878 PolarHBondContact O-N 3.25Å; Q878-S880 PolarHBondContact O-N 2.76Å; Q878-S880 VanDerWaalsContact O-N 3.1Å
879	D	40.9	Very low	40.1	Very low	142 Å²	142	99.7 Å²	99.7	76%	0.759	60%	0.595	S	S	*	*			trans	-51	118	175.3	-72.6	-30.6	0	0	0	110.2	P877	P877-D879 PolarHBondContact O-N 3.29Å; P877-D879 VanDerWaalsContact O-N 3.08Å
880	S	46.2	Very low	40.9	Very low	79 Å²	79	104.2 Å²	104.2	55%	0.552	60%	0.603	S	S	*	*			trans	-69.5	136.2	170.4	50.9	0	0	0	0	109	Q878 I882	Q878-S880 PolarHBondContact O-N 2.76Å; Q878-S880 VanDerWaalsContact O-N 3.1Å; S880-I882 PolarHBondContact O-N 3.42Å; S880-I882 PolarHBondContact OG-O 2.77Å
881	F	50.6	Low	41.4	Very low	93 Å²	93	104.4 Å²	104.4	41%	0.408	60%	0.602	S	S	.	*	S	Bend	trans	-73.4	-6.1	176	-66.8	-82	0	0	0	112.8	Q688 K691 L692	Q688-F881 HydrophobicContact CB-CZ 4.41Å; Q688-F881 HydrophobicContact CG-CZ 4.35Å; K691-F881 HydrophobicContact CD-CE2 4.41Å; L692-F881 HydrophobicContact CD1-CB 4.13Å
882	I	47.8	Very low	42.4	Very low	35 Å²	35	107.3 Å²	107.3	18%	0.179	59%	0.594	C	S	.	*	S	Bend	trans	-101.1	123.8	178	-62.5	168.1	0	0	0	110.5	V653 E695 S880 S884	V653-I882 HydrophobicContact CB-CG2 4.27Å; V653-I882 HydrophobicContact CG1-CG2 3.71Å; V653-I882 HydrophobicContact CG2-CG1 4.34Å; V653-I882 HydrophobicContact CG2-CG2 4.09Å; E695-I882 HydrophobicContact CB-CD1 3.5Å; E695-I882 VanDerWaalsContact CB-CD1 3.5Å; E695-I882 HydrophobicContact CB-CG1 4.2Å; E695-I882 HydrophobicContact CG-CD1 3.93Å; S880-I882 PolarHBondContact O-N 3.42Å; S880-I882 PolarHBondContact OG-O 2.77Å; I882-S884 PolarHBondContact O-N 2.89Å
883	P	51.8	Low	43.9	Very low	40 Å²	40	109.9 Å²	109.9	26%	0.26	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-59.3	125.5	162.1	-19.7	32	0	0	0	109.9	I786	I786-P883 HydrophobicContact CG2-CB 3.73Å
884	S	52.7	Low	45.7	Very low	42 Å²	42	105.9 Å²	105.9	29%	0.294	56%	0.564	S	S	.	*	P	Polyproline II helix	trans	-69.1	137.6	176.9	62.6	0	0	0	0	109.6	I786 D790 I882	I786-S884 WeakPolarHBondContact CG2-O 3.34Å; D790-S884 VanDerWaalsContact CG-O 3.26Å; D790-S884 PolarHBondContact OD2-OG 2.87Å; I882-S884 PolarHBondContact O-N 2.89Å
885	V	53.7	Low	48	Very low	40 Å²	40	104.4 Å²	104.4	24%	0.242	54%	0.541	C	S	.	.	S	Bend	trans	-81.9	-35.9	-179	175.3	0	0	0	0	111.5	I786 M902 I905	I786-V885 HydrophobicContact CD1-CG2 4.27Å; V885-M902 HydrophobicContact CG1-SD 4.33Å; V885-I905 HydrophobicContact CG1-CD1 3.97Å
886	F	50.7	Low	50.5	Low	37 Å²	37	103 Å²	103	16%	0.162	54%	0.536	C	S	.	.			trans	-171.6	121.1	153.5	-67.6	-69.3	0	0	0	107.9	C789 V889 Q898 L901 M902	C789-F886 HydrophobicContact CB-CE1 3.56Å; C789-F886 HydrophobicContact CB-CZ 3.64Å; F886-V889 HydrophobicContact CB-CG2 3.27Å; F886-V889 HydrophobicContact CD1-CG2 4.47Å; F886-V889 HydrophobicContact CD2-CG2 4.49Å; F886-V889 HydrophobicContact CG-CG2 3.83Å; F886-Q898 HydrophobicContact CE1-CB 4.35Å; F886-Q898 HydrophobicContact CE1-CG 3.78Å; F886-Q898 VanDerWaalsContact CE1-NE2 3.33Å; F886-Q898 HydrophobicContact CE2-CB 4.41Å; F886-Q898 HydrophobicContact CZ-CB 3.81Å; F886-Q898 HydrophobicContact CZ-CG 3.68Å; F886-L901 HydrophobicContact CZ-CD2 4.29Å; F886-M902 HydrophobicContact CD2-CE 3.46Å; F886-M902 VanDerWaalsContact CD2-CE 3.46Å; F886-M902 HydrophobicContact CD2-SD 4.29Å; F886-M902 HydrophobicContact CE2-CE 3.89Å; F886-M902 HydrophobicContact CE2-CG 4.04Å; F886-M902 HydrophobicContact CE2-SD 4.17Å
887	K	45.1	Very low	53	Low	170 Å²	170	99.4 Å²	99.4	74%	0.739	52%	0.522	S	S	*	.	S	Bend	trans	-70.5	136.6	164.3	-76.2	179.2	175.5	175.9	0	108.9	V889	K887-V889 PolarHBondContact O-N 2.66Å
888	D	44.8	Very low	55.5	Low	140 Å²	140	94.8 Å²	94.8	75%	0.749	49%	0.49	S	S	*	.			trans	66	32.8	160.7	-49.3	-34.6	0	0	0	119.9	K890	D888-K890 PolarHBondContact O-N 2.86Å; D888-K890 VanDerWaalsContact O-N 3.12Å
889	V	47	Very low	57.5	Low	47 Å²	47	93.9 Å²	93.9	29%	0.285	48%	0.48	S	S	.	.	G	3₁₀ helix	trans	-80	14.6	179.6	-165.6	0	0	0	0	114.1	F886 K887 T891 L894	F886-V889 HydrophobicContact CB-CG2 3.27Å; F886-V889 HydrophobicContact CD1-CG2 4.47Å; F886-V889 HydrophobicContact CD2-CG2 4.49Å; F886-V889 HydrophobicContact CG-CG2 3.83Å; K887-V889 PolarHBondContact O-N 2.66Å; V889-T891 PolarHBondContact O-N 3.06Å; V889-L894 HydrophobicContact CG1-CD1 3.55Å; V889-L894 HydrophobicContact CG1-CD2 4.25Å; V889-L894 HydrophobicContact CG1-CG 3.71Å
890	K	48.3	Very low	59.6	Low	207 Å²	207	91.4 Å²	91.4	90%	0.9	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-66	-10.6	179.9	-79.7	-170.1	178.1	-180	0	114	D888	D888-K890 PolarHBondContact O-N 2.86Å; D888-K890 VanDerWaalsContact O-N 3.12Å
891	T	45.5	Very low	61.5	Low	135 Å²	135	87.7 Å²	87.7	83%	0.828	44%	0.438	S	S	*	.	G	3₁₀ helix	trans	-137.4	11.2	-176.8	50.9	0	0	0	0	116.1	V889	V889-T891 PolarHBondContact O-N 3.06Å
892	R	52.3	Low	63.1	Low	149 Å²	149	86.1 Å²	86.1	56%	0.562	43%	0.432	S	S	*	.			trans	-112.5	139.9	-179.5	-77.9	-177.9	174.6	172	-3.2	113.5	G793 L894	G793-R892 PolarHBondContact O-NH1 3.43Å; R892-L894 PolarHBondContact O-N 3.39Å
893	H	60.9	Low	64.8	Low	178 Å²	178	90.8 Å²	90.8	82%	0.824	45%	0.449	S	S	*	.			trans	-62.1	107	161.3	-83.4	-72.9	0	0	0	108.8	S895	H893-S895 PolarHBondContact O-N 2.81Å
894	L	68.2	Low	66.5	Low	42 Å²	42	89 Å²	89	22%	0.22	44%	0.437	C	S	.	.			trans	-57.4	135.7	171.4	-71	96.3	0	0	0	109.5	V889 R892 Q898 R899 M902	V889-L894 HydrophobicContact CG1-CD1 3.55Å; V889-L894 HydrophobicContact CG1-CD2 4.25Å; V889-L894 HydrophobicContact CG1-CG 3.71Å; R892-L894 PolarHBondContact O-N 3.39Å; L894-Q898 HydrophobicContact CB-CB 4.09Å; L894-Q898 HydrophobicContact CD2-CB 3.99Å; L894-Q898 HydrophobicContact CG-CB 4.48Å; L894-R899 HydrophobicContact CB-CG 3.71Å; L894-R899 VanDerWaalsContact O-CZ 3.27Å; L894-R899 PolarHBondContact O-NE 2.89Å; L894-R899 PolarHBondContact O-NH2 3.12Å; L894-M902 HydrophobicContact CD2-CG 4.14Å
895	S	77.7	Confident	68.2	Low	50 Å²	50	87.2 Å²	87.2	35%	0.35	42%	0.424	S	S	.	.			trans	-57.1	156.3	167.8	174	0	0	0	0	110.3	H893 D897 Q898 R899	H893-S895 PolarHBondContact O-N 2.81Å; S895-D897 PolarHBondContact O-N 2.85Å; S895-Q898 PolarHBondContact O-N 3.32Å; S895-Q898 VanDerWaalsContact O-N 3.13Å; S895-R899 WeakPolarHBondContact O-CG 3.31Å; S895-R899 PolarHBondContact O-N 2.77Å
896	S	80.4	Confident	69.8	Low	91 Å²	91	87.4 Å²	87.4	64%	0.636	42%	0.424	S	S	*	.	H	α-helix	trans	-51.5	-43.6	173.9	-173.8	0	0	0	0	111.4	Q898 R899 Q900	S896-Q898 PolarHBondContact O-N 2.88Å; S896-R899 PolarHBondContact O-N 3.44Å; S896-Q900 WeakPolarHBondContact O-CB 3.48Å; S896-Q900 PolarHBondContact O-N 3.12Å
897	D	80.9	Confident	71.6	Confident	97 Å²	97	88 Å²	88	52%	0.519	43%	0.425	S	S	.	.	H	α-helix	trans	-65.8	-38.7	-179.4	-65.8	-14.8	0	0	0	112.4	M792 S895 Q900 L901	M792-D897 HydrophobicContact CE-CB 4.42Å; S895-D897 PolarHBondContact O-N 2.85Å; D897-Q900 PolarHBondContact O-N 3.11Å; D897-L901 WeakPolarHBondContact O-CB 3.36Å; D897-L901 PolarHBondContact O-N 3.14Å
898	Q	81.1	Confident	73.9	Confident	22 Å²	22	80.1 Å²	80.1	10%	0.103	39%	0.391	C	S	.	.	H	α-helix	trans	-68.2	-39.5	176.8	-65.9	177.2	-39.1	0	0	111.4	C789 F886 L894 S895 S896 Q900 L901 M902	C789-Q898 HydrophobicContact CB-CG 4.07Å; C789-Q898 PolarHBondContact O-NE2 3.48Å; F886-Q898 HydrophobicContact CE1-CB 4.35Å; F886-Q898 HydrophobicContact CE1-CG 3.78Å; F886-Q898 VanDerWaalsContact CE1-NE2 3.33Å; F886-Q898 HydrophobicContact CE2-CB 4.41Å; F886-Q898 HydrophobicContact CZ-CB 3.81Å; F886-Q898 HydrophobicContact CZ-CG 3.68Å; L894-Q898 HydrophobicContact CB-CB 4.09Å; L894-Q898 HydrophobicContact CD2-CB 3.99Å; L894-Q898 HydrophobicContact CG-CB 4.48Å; S895-Q898 PolarHBondContact O-N 3.32Å; S895-Q898 VanDerWaalsContact O-N 3.13Å; S896-Q898 PolarHBondContact O-N 2.88Å; Q898-Q900 VanDerWaalsContact C-N 3.35Å; Q898-L901 PolarHBondContact O-N 2.75Å; Q898-M902 WeakPolarHBondContact O-CB 3.47Å; Q898-M902 WeakPolarHBondContact O-CG 3.3Å; Q898-M902 PolarHBondContact O-N 3.09Å
899	R	80.7	Confident	75.9	Confident	136 Å²	136	77.8 Å²	77.8	51%	0.513	38%	0.375	S	S	.	.	H	α-helix	trans	-63.4	-42.6	174	-67.6	-179.4	-161.9	159.2	10.1	111.2	L894 S895 S896 M902 Y903	L894-R899 HydrophobicContact CB-CG 3.71Å; L894-R899 VanDerWaalsContact O-CZ 3.27Å; L894-R899 PolarHBondContact O-NE 2.89Å; L894-R899 PolarHBondContact O-NH2 3.12Å; S895-R899 WeakPolarHBondContact O-CG 3.31Å; S895-R899 PolarHBondContact O-N 2.77Å; S896-R899 PolarHBondContact O-N 3.44Å; R899-M902 PolarHBondContact O-N 3.16Å; R899-Y903 PolarHBondContact O-N 2.93Å
900	Q	85.1	Confident	77.6	Confident	89 Å²	89	79.6 Å²	79.6	42%	0.416	39%	0.387	S	S	.	.	H	α-helix	trans	-64.5	-42.4	177.4	-171.9	62.9	21.5	0	0	111.5	S896 D897 Q898 Y903 D904	S896-Q900 WeakPolarHBondContact O-CB 3.48Å; S896-Q900 PolarHBondContact O-N 3.12Å; D897-Q900 PolarHBondContact O-N 3.11Å; Q898-Q900 VanDerWaalsContact C-N 3.35Å; Q900-Y903 PolarHBondContact O-N 2.77Å; Q900-D904 PolarHBondContact O-N 2.8Å
901	L	85.6	Confident	79.5	Confident	1 Å²	1	76.4 Å²	76.4	1%	0.005	37%	0.369	C	S	.	.	H	α-helix	trans	-60.9	-45.8	173.7	178.6	60.3	0	0	0	111.7	F782 R785 I786 C789 F886 D897 Q898 Y903 D904 I905	F782-L901 HydrophobicContact CB-CD1 4.09Å; F782-L901 HydrophobicContact CD1-CD1 4.16Å; F782-L901 HydrophobicContact CG-CD1 4.2Å; R785-L901 HydrophobicContact CB-CD1 3.84Å; R785-L901 HydrophobicContact CB-CD2 4.25Å; I786-L901 HydrophobicContact CG1-CD2 4.15Å; C789-L901 HydrophobicContact CB-CD2 3.97Å; F886-L901 HydrophobicContact CZ-CD2 4.29Å; D897-L901 WeakPolarHBondContact O-CB 3.36Å; D897-L901 PolarHBondContact O-N 3.14Å; Q898-L901 PolarHBondContact O-N 2.75Å; L901-Y903 VanDerWaalsContact C-N 3.31Å; L901-Y903 PolarHBondContact O-N 2.78Å; L901-D904 PolarHBondContact O-N 3.16Å; L901-I905 HydrophobicContact CD1-CD1 3.79Å; L901-I905 HydrophobicContact CD1-CG1 4.02Å; L901-I905 HydrophobicContact CD2-CD1 4.43Å; L901-I905 HydrophobicContact CG-CD1 3.77Å; L901-I905 HydrophobicContact CG-CG1 4.37Å; L901-I905 WeakPolarHBondContact O-CB 3.3Å; L901-I905 VanDerWaalsContact O-CG1 3.31Å; L901-I905 WeakPolarHBondContact O-CG1 3.35Å; L901-I905 PolarHBondContact O-N 3.4Å
902	M	83.8	Confident	81.5	Confident	60 Å²	60	72.8 Å²	72.8	30%	0.296	34%	0.344	S	S	.	.	H	α-helix	trans	-60.5	-40	176.1	-79.3	-63.7	-147.3	0	0	112.7	V885 F886 L894 Q898 R899 N906	V885-M902 HydrophobicContact CG1-SD 4.33Å; F886-M902 HydrophobicContact CD2-CE 3.46Å; F886-M902 VanDerWaalsContact CD2-CE 3.46Å; F886-M902 HydrophobicContact CD2-SD 4.29Å; F886-M902 HydrophobicContact CE2-CE 3.89Å; F886-M902 HydrophobicContact CE2-CG 4.04Å; F886-M902 HydrophobicContact CE2-SD 4.17Å; L894-M902 HydrophobicContact CD2-CG 4.14Å; Q898-M902 WeakPolarHBondContact O-CB 3.47Å; Q898-M902 WeakPolarHBondContact O-CG 3.3Å; Q898-M902 PolarHBondContact O-N 3.09Å; R899-M902 PolarHBondContact O-N 3.16Å; M902-N906 WeakPolarHBondContact O-CB 3.46Å; M902-N906 PolarHBondContact O-N 3.49Å; M902-N906 VanDerWaalsContact O-N 3.09Å; M902-N906 PolarHBondContact O-ND2 2.93Å
903	Y	85.3	Confident	83.2	Confident	134 Å²	134	74.3 Å²	74.3	53%	0.525	36%	0.355	S	S	.	.	H	α-helix	trans	-63.4	-45.5	174.8	176.7	-96.2	0	0	0	111.5	R899 Q900 L901 N906 R907	R899-Y903 PolarHBondContact O-N 2.93Å; Q900-Y903 PolarHBondContact O-N 2.77Å; L901-Y903 VanDerWaalsContact C-N 3.31Å; L901-Y903 PolarHBondContact O-N 2.78Å; Y903-N906 PolarHBondContact O-N 3.39Å; Y903-R907 WeakPolarHBondContact O-CA 3.36Å; Y903-R907 PolarHBondContact O-N 3.04Å
904	D	87.6	Confident	84.5	Confident	3 Å²	3	74.2 Å²	74.2	2%	0.016	36%	0.355	C	S	.	.	H	α-helix	trans	-65.4	-42.8	-179.9	-73.2	-23.1	0	0	0	112.3	S657 N778 F782 R785 Q900 L901 N906 R907	S657-D904 PolarHBondContact OG-O 3.22Å; N778-D904 PolarHBondContact ND2-OD2 2.98Å; F782-D904 HydrophobicContact CE1-CB 4.05Å; F782-D904 HydrophobicContact CZ-CB 4.17Å; R785-D904 IonicContact CZ-OD2 2.8Å; R785-D904 IonicContact NH1-OD2 2.67Å; R785-D904 PolarHBondContact NH1-OD2 3.13Å; R785-D904 IonicContact NH2-OD2 2.63Å; R785-D904 PolarHBondContact NH2-OD2 2.79Å; Q900-D904 PolarHBondContact O-N 2.8Å; L901-D904 PolarHBondContact O-N 3.16Å; D904-N906 PolarHBondContact O-N 3.09Å; D904-R907 WeakPolarHBondContact O-CB 3.34Å; D904-R907 IonicContact OD1-CZ 2.84Å; D904-R907 IonicContact OD1-NH2 3.26Å; D904-R907 PolarHBondContact OD1-NH2 3.4Å
905	I	88	Confident	85.7	Confident	3 Å²	3	72.4 Å²	72.4	2%	0.015	35%	0.345	C	S	.	.	H	α-helix	trans	-61.4	-42.3	176.5	-74.6	174.7	0	0	0	111.2	P656 S657 R703 F782 I786 V885 L901	P656-I905 HydrophobicContact CB-CG2 3.98Å; P656-I905 HydrophobicContact CG-CB 4.18Å; P656-I905 HydrophobicContact CG-CG1 3.92Å; P656-I905 HydrophobicContact CG-CG2 3.74Å; S657-I905 PolarHBondContact OG-O 2.91Å; R703-I905 PolarHBondContact NH2-O 3.47Å; F782-I905 HydrophobicContact CD2-CG1 3.77Å; F782-I905 HydrophobicContact CE2-CG1 4.13Å; F782-I905 HydrophobicContact CG-CG1 4.22Å; I786-I905 HydrophobicContact CD1-CD1 4.43Å; I786-I905 HydrophobicContact CG1-CD1 4.34Å; V885-I905 HydrophobicContact CG1-CD1 3.97Å; L901-I905 HydrophobicContact CD1-CD1 3.79Å; L901-I905 HydrophobicContact CD1-CG1 4.02Å; L901-I905 HydrophobicContact CD2-CD1 4.43Å; L901-I905 HydrophobicContact CG-CD1 3.77Å; L901-I905 HydrophobicContact CG-CG1 4.37Å; L901-I905 WeakPolarHBondContact O-CB 3.3Å; L901-I905 VanDerWaalsContact O-CG1 3.31Å; L901-I905 WeakPolarHBondContact O-CG1 3.35Å; L901-I905 PolarHBondContact O-N 3.4Å
906	N	87.7	Confident	86.6	Confident	44 Å²	44	71.4 Å²	71.4	24%	0.235	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	13	-173.5	-59.7	-52.1	0	0	0	113.7	R703 M902 Y903 D904 F908 Q909 T910	R703-N906 PolarHBondContact NH2-OD1 2.85Å; M902-N906 WeakPolarHBondContact O-CB 3.46Å; M902-N906 PolarHBondContact O-N 3.49Å; M902-N906 VanDerWaalsContact O-N 3.09Å; M902-N906 PolarHBondContact O-ND2 2.93Å; Y903-N906 PolarHBondContact O-N 3.39Å; D904-N906 PolarHBondContact O-N 3.09Å; N906-F908 PolarHBondContact O-N 3.02Å; N906-F908 VanDerWaalsContact O-N 3.16Å; N906-Q909 PolarHBondContact O-N 2.78Å; N906-Q909 PolarHBondContact OD1-OE1 3Å; N906-T910 PolarHBondContact O-N 2.89Å
907	R	88.1	Confident	87.5	Confident	49 Å²	49	67.1 Å²	67.1	19%	0.185	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-41.5	-175.1	-178.7	176.3	-68	-173.4	-0.1	113.1	Y903 D904	Y903-R907 WeakPolarHBondContact O-CA 3.36Å; Y903-R907 PolarHBondContact O-N 3.04Å; D904-R907 WeakPolarHBondContact O-CB 3.34Å; D904-R907 IonicContact OD1-CZ 2.84Å; D904-R907 IonicContact OD1-NH2 3.26Å; D904-R907 PolarHBondContact OD1-NH2 3.4Å
908	F	92	Very high	88.3	Confident	5 Å²	5	62.5 Å²	62.5	2%	0.022	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94	3.7	-177.6	-57.9	-59.2	0	0	0	114.2	S657 D660 F661 L774 L776 N906 F942 P1089	S657-F908 WeakPolarHBondContact O-CD2 3.49Å; D660-F908 HydrophobicContact CB-CB 3.81Å; F661-F908 HydrophobicContact CB-CD2 3.93Å; F661-F908 HydrophobicContact CB-CE2 4.06Å; F661-F908 HydrophobicContact CB-CG 4.29Å; F661-F908 AromaticContact CD2-CD1 3.96Å; F661-F908 HydrophobicContact CD2-CD1 3.96Å; F661-F908 HydrophobicContact CD2-CD2 4.39Å; F661-F908 AromaticContact CD2-CE1 3.73Å; F661-F908 HydrophobicContact CD2-CE1 3.73Å; F661-F908 HydrophobicContact CD2-CE2 4.18Å; F661-F908 HydrophobicContact CD2-CG 4.25Å; F661-F908 AromaticContact CD2-CZ 3.83Å; F661-F908 HydrophobicContact CD2-CZ 3.83Å; F661-F908 HydrophobicContact CE2-CE1 4.29Å; F661-F908 HydrophobicContact CG-CE2 4.48Å; L774-F908 HydrophobicContact CD2-CE2 4.08Å; L774-F908 HydrophobicContact CD2-CZ 4.24Å; L776-F908 HydrophobicContact CD1-CE2 4.43Å; L776-F908 HydrophobicContact CD2-CZ 4.15Å; N906-F908 PolarHBondContact O-N 3.02Å; N906-F908 VanDerWaalsContact O-N 3.16Å; F908-F942 HydrophobicContact CB-CD1 4.29Å; F908-F942 HydrophobicContact CB-CE1 4.43Å; F908-F942 HydrophobicContact CB-CG 4.49Å; F908-F942 HydrophobicContact CD1-CD1 4.3Å; F908-F942 AromaticContact CD1-CD2 3.99Å; F908-F942 HydrophobicContact CD1-CD2 3.99Å; F908-F942 AromaticContact CD1-CE1 3.83Å; F908-F942 HydrophobicContact CD1-CE1 3.83Å; F908-F942 AromaticContact CD1-CE2 3.45Å; F908-F942 HydrophobicContact CD1-CE2 3.45Å; F908-F942 VanDerWaalsContact CD1-CE2 3.45Å; F908-F942 HydrophobicContact CD1-CG 4.4Å; F908-F942 AromaticContact CD1-CZ 3.38Å; F908-F942 HydrophobicContact CD1-CZ 3.38Å; F908-F942 AromaticContact CE1-CE2 3.91Å; F908-F942 HydrophobicContact CE1-CE2 3.91Å; F908-F942 AromaticContact CE1-CZ 3.77Å; F908-F942 HydrophobicContact CE1-CZ 3.77Å; F908-F942 HydrophobicContact CG-CE1 4.47Å; F908-F942 HydrophobicContact CG-CZ 4.41Å; F908-F942 WeakPolarHBondContact O-CB 3.34Å; F908-P1089 HydrophobicContact CE1-CG 4.06Å; F908-P1089 HydrophobicContact CZ-CB 4.37Å; F908-P1089 HydrophobicContact CZ-CG 4.05Å
909	Q	86.6	Confident	89	Confident	91 Å²	91	61.5 Å²	61.5	43%	0.425	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.1	-24.9	170.7	-58.5	-166.7	-18.5	0	0	111.7	D660 R703 N906	D660-Q909 HydrophobicContact CB-CG 4.38Å; D660-Q909 PolarHBondContact OD1-NE2 2.9Å; D660-Q909 VanDerWaalsContact OD1-NE2 3.11Å; D660-Q909 VanDerWaalsContact OD2-CG 3.3Å; D660-Q909 WeakPolarHBondContact OD2-CG 3.35Å; D660-Q909 PolarHBondContact OD2-NE2 2.83Å; R703-Q909 VanDerWaalsContact CG-NE2 3.32Å; R703-Q909 VanDerWaalsContact CZ-NE2 3.31Å; N906-Q909 PolarHBondContact O-N 2.78Å; N906-Q909 PolarHBondContact OD1-OE1 3Å
910	T	84.8	Confident	89.7	Confident	86 Å²	86	55 Å²	55	53%	0.528	25%	0.254	S	S	.	.	S	Bend	trans	-89.3	122.3	-177	-52.7	0	0	0	0	110.4	N906 L912	N906-T910 PolarHBondContact O-N 2.89Å; T910-L912 PolarHBondContact O-N 2.96Å
911	R	87.3	Confident	90.1	Very high	139 Å²	139	50.8 Å²	50.8	53%	0.525	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-64.6	130.9	177.3	-179.1	-176.8	177.1	-170.4	-0.1	111.3	F942	R911-F942 WeakPolarHBondContact CA-O 3.25Å
912	L	88.4	Confident	90.2	Very high	60 Å²	60	50.9 Å²	50.9	31%	0.314	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-92.2	132.8	171.9	-59.6	-179.6	0	0	0	110.6	T910 A915 F942 L943 Q1056	T910-L912 PolarHBondContact O-N 2.96Å; L912-A915 HydrophobicContact CB-CB 4.08Å; L912-F942 PolarHBondContact N-O 3.09Å; L912-L943 HydrophobicContact CB-CD2 4.45Å; L912-L943 HydrophobicContact CD1-CD2 4.02Å; L912-Q1056 HydrophobicContact CD1-CB 4.02Å; L912-Q1056 HydrophobicContact CD1-CG 3.95Å
913	K	87.2	Confident	90.4	Very high	180 Å²	180	49.1 Å²	49.1	78%	0.783	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.9	140.2	175.1	-65.5	-177.7	-178.5	177.3	0	109.5	A915	K913-A915 PolarHBondContact O-N 3.36Å
914	H	88.6	Confident	90.4	Very high	177 Å²	177	42.9 Å²	42.9	82%	0.819	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	32.9	178.5	-48.8	105.9	0	0	0	114.4
915	A	93.3	Very high	90.4	Very high	3 Å²	3	42.8 Å²	42.8	3%	0.025	20%	0.2	C	C	.	.			trans	-66.5	151.5	179.8	0	0	0	0	0	112	L912 K913 L943 A946 K947 Q1056	L912-A915 HydrophobicContact CB-CB 4.08Å; K913-A915 PolarHBondContact O-N 3.36Å; A915-L943 HydrophobicContact CB-CD2 3.71Å; A915-A946 HydrophobicContact CB-CB 3.85Å; A915-A946 CarbonylContact O-C 3.58Å; A915-A946 WeakPolarHBondContact O-CA 3.31Å; A915-A946 WeakPolarHBondContact O-CB 3.41Å; A915-K947 PolarHBondContact O-N 3.15Å; A915-Q1056 HydrophobicContact CB-CB 4.01Å; A915-Q1056 HydrophobicContact CB-CG 4.02Å
916	V	97	Very high	90.4	Very high	30 Å²	30	42.7 Å²	42.7	18%	0.182	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	129.6	176.1	-177	0	0	0	0	107.9	K947 R949 Q1056	V916-K947 CarbonylContact C-O 3.54Å; V916-K947 VanDerWaalsContact CA-O 3.32Å; V916-K947 WeakPolarHBondContact CA-O 3.47Å; V916-K947 HydrophobicContact CG2-CB 4.41Å; V916-R949 HydrophobicContact CG1-CG 4.15Å; V916-Q1056 PolarHBondContact O-N 3.42Å
917	I	97.5	Very high	90.5	Very high	0 Å²	0	40.6 Å²	40.6	0%	0	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	122.2	173.8	-52.5	177.4	0	0	0	107.8	V919 P933 L936 T937 L943 A946 K947 L948 R949 L1057 V1059	I917-V919 HydrophobicContact CG2-CG2 4.06Å; I917-P933 HydrophobicContact CG2-CB 4.09Å; I917-L936 HydrophobicContact CD1-CB 4.32Å; I917-T937 HydrophobicContact CD1-CG2 3.95Å; I917-L943 HydrophobicContact CD1-CB 4.09Å; I917-L943 HydrophobicContact CD1-CD1 3.65Å; I917-L943 HydrophobicContact CD1-CG 4.45Å; I917-L943 HydrophobicContact CG1-CD1 3.92Å; I917-A946 HydrophobicContact CD1-CB 3.93Å; I917-A946 HydrophobicContact CG1-CB 3.83Å; I917-K947 PolarHBondContact N-O 3.37Å; I917-L948 WeakPolarHBondContact O-CA 3.42Å; I917-R949 PolarHBondContact O-N 3.44Å; I917-L1057 WeakPolarHBondContact CA-O 3.45Å; I917-L1057 HydrophobicContact CG1-CB 4.45Å; I917-L1057 HydrophobicContact CG2-CB 4.27Å; I917-L1057 HydrophobicContact CG2-CD2 4.16Å; I917-L1057 HydrophobicContact CG2-CG 4.3Å; I917-V1059 HydrophobicContact CG2-CG2 4.31Å
918	D	97.9	Very high	90.8	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	120.9	175.6	-72.3	-6.8	0	0	0	109.6	Y920 R949 F951 S1052 A1055 L1057 I1058 V1059	D918-Y920 HydrophobicContact CB-CD2 4.49Å; D918-Y920 HydrophobicContact CB-CE2 4.07Å; D918-R949 IonicContact OD1-CZ 2.9Å; D918-R949 VanDerWaalsContact OD1-CZ 3.22Å; D918-R949 IonicContact OD1-NE 3.55Å; D918-R949 PolarHBondContact OD1-NE 3.37Å; D918-R949 IonicContact OD1-NH2 2.76Å; D918-R949 PolarHBondContact OD1-NH2 3.48Å; D918-R949 IonicContact OD2-CZ 3.46Å; D918-R949 IonicContact OD2-NE 3.83Å; D918-R949 IonicContact OD2-NH2 3.09Å; D918-R949 PolarHBondContact OD2-NH2 3.25Å; D918-F951 HydrophobicContact CB-CD2 4.36Å; D918-F951 HydrophobicContact CB-CE2 3.84Å; D918-S1052 WeakPolarHBondContact OD2-CA 3.38Å; D918-S1052 WeakPolarHBondContact OD2-CB 3.49Å; D918-S1052 PolarHBondContact OD2-OG 3Å; D918-A1055 HydrophobicContact CB-CB 4.3Å; D918-L1057 PolarHBondContact N-O 2.91Å; D918-I1058 CarbonylContact O-C 3.54Å; D918-I1058 WeakPolarHBondContact O-CA 3.41Å; D918-V1059 PolarHBondContact O-N 2.64Å
919	V	96.9	Very high	90.8	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.006	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	103.9	-178	-172.4	0	0	0	0	109	I917 W921 G929 L930 P933 L948 R949 V950 F951 V1059	I917-V919 HydrophobicContact CG2-CG2 4.06Å; V919-W921 HydrophobicContact CG1-CB 4.34Å; V919-W921 PolarHBondContact O-N 2.88Å; V919-W921 VanDerWaalsContact O-N 3.16Å; V919-G929 VanDerWaalsContact CG1-O 3.23Å; V919-G929 WeakPolarHBondContact CG1-O 3.33Å; V919-L930 HydrophobicContact CG1-CD2 4.2Å; V919-P933 HydrophobicContact CG1-CG 4.29Å; V919-P933 HydrophobicContact CG2-CB 3.67Å; V919-P933 HydrophobicContact CG2-CG 3.6Å; V919-L948 HydrophobicContact CG2-CD1 4.27Å; V919-L948 HydrophobicContact CG2-CD2 4.05Å; V919-L948 HydrophobicContact CG2-CG 3.99Å; V919-R949 PolarHBondContact N-O 3.36Å; V919-V950 CarbonylContact O-C 3.55Å; V919-V950 WeakPolarHBondContact O-CA 3.35Å; V919-F951 PolarHBondContact O-N 3.11Å; V919-V1059 CarbonylContact C-O 3.53Å; V919-V1059 HydrophobicContact CG1-CB 4.42Å; V919-V1059 HydrophobicContact CG2-CB 4.49Å
920	Y	95.6	Very high	91.1	Very high	1 Å²	1	34 Å²	34	0%	0.004	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	84.1	172.2	-71.8	-106.2	0	0	0	109.1	D918 L922 F951 I984 L1047 L1048 S1052 I1058 V1059 L1060 T1061	D918-Y920 HydrophobicContact CB-CD2 4.49Å; D918-Y920 HydrophobicContact CB-CE2 4.07Å; Y920-L922 VanDerWaalsContact C-N 3.27Å; Y920-L922 HydrophobicContact CD1-CD2 4.24Å; Y920-L922 PolarHBondContact O-N 2.89Å; Y920-L922 VanDerWaalsContact O-N 3.14Å; Y920-F951 HydrophobicContact CD1-CB 3.67Å; Y920-F951 HydrophobicContact CD1-CG 4.09Å; Y920-F951 HydrophobicContact CD2-CB 4.39Å; Y920-F951 HydrophobicContact CD2-CD2 4.1Å; Y920-F951 HydrophobicContact CD2-CG 4.35Å; Y920-F951 HydrophobicContact CE1-CB 3.88Å; Y920-F951 AromaticContact CE1-CD1 3.92Å; Y920-F951 HydrophobicContact CE1-CD1 3.92Å; Y920-F951 HydrophobicContact CE1-CD2 4.39Å; Y920-F951 AromaticContact CE1-CG 3.82Å; Y920-F951 HydrophobicContact CE1-CG 3.82Å; Y920-F951 AromaticContact CE2-CD2 3.81Å; Y920-F951 HydrophobicContact CE2-CD2 3.81Å; Y920-F951 HydrophobicContact CE2-CE2 4.09Å; Y920-F951 HydrophobicContact CE2-CG 4.09Å; Y920-F951 HydrophobicContact CG-CB 3.93Å; Y920-F951 HydrophobicContact CG-CD2 4.49Å; Y920-F951 HydrophobicContact CG-CG 4.34Å; Y920-F951 AromaticContact CZ-CD1 3.91Å; Y920-F951 AromaticContact CZ-CD2 3.96Å; Y920-F951 AromaticContact CZ-CG 3.81Å; Y920-I984 HydrophobicContact CD1-CD1 4.3Å; Y920-I984 HydrophobicContact CE1-CD1 4.23Å; Y920-L1047 HydrophobicContact CE1-CB 4.5Å; Y920-L1047 PolarHBondContact OH-O 2.85Å; Y920-L1048 HydrophobicContact CD2-CD2 3.97Å; Y920-L1048 HydrophobicContact CE1-CD2 4.13Å; Y920-L1048 HydrophobicContact CE2-CD2 3.42Å; Y920-L1048 VanDerWaalsContact CE2-CD2 3.42Å; Y920-S1052 VanDerWaalsContact CE2-OG 3.27Å; Y920-S1052 WeakPolarHBondContact CE2-OG 3.47Å; Y920-S1052 PolarHBondContact OH-OG 2.99Å; Y920-I1058 HydrophobicContact CD2-CG2 4.1Å; Y920-I1058 HydrophobicContact CE2-CG2 4.2Å; Y920-V1059 PolarHBondContact N-O 3.26Å; Y920-L1060 VanDerWaalsContact CB-CD2 3.47Å; Y920-L1060 HydrophobicContact CD1-CD2 4.22Å; Y920-L1060 HydrophobicContact CD2-CD2 3.74Å; Y920-L1060 HydrophobicContact CG-CD2 3.55Å; Y920-T1061 PolarHBondContact O-N 3Å; Y920-T1061 VanDerWaalsContact O-N 3.09Å; Y920-T1061 PolarHBondContact O-OG1 2.74Å
921	W	92.2	Very high	91.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.141	C	C	.	.			trans	-88.4	68.9	177.8	-162.2	38.7	0	0	0	110	P90 Y95 V919 D925 L930 V950 F951 M967 L970	P90-W921 HydrophobicContact CB-CD2 4.06Å; P90-W921 HydrophobicContact CB-CE3 3.82Å; P90-W921 HydrophobicContact CB-CH2 3.31Å; P90-W921 HydrophobicContact CB-CZ2 3.56Å; P90-W921 HydrophobicContact CB-CZ3 3.43Å; P90-W921 VanDerWaalsContact CB-CZ3 3.43Å; P90-W921 HydrophobicContact CG-CD2 3.48Å; P90-W921 VanDerWaalsContact CG-CD2 3.48Å; P90-W921 HydrophobicContact CG-CE3 3.59Å; P90-W921 HydrophobicContact CG-CG 4.12Å; P90-W921 HydrophobicContact CG-CH2 3.89Å; P90-W921 HydrophobicContact CG-CZ2 3.78Å; P90-W921 HydrophobicContact CG-CZ3 3.78Å; Y95-W921 HydrophobicContact CE2-CH2 4.09Å; Y95-W921 HydrophobicContact CE2-CZ2 4.41Å; Y95-W921 VanDerWaalsContact OH-CZ2 3.23Å; Y95-W921 WeakPolarHBondContact OH-CZ2 3.28Å; V919-W921 HydrophobicContact CG1-CB 4.34Å; V919-W921 PolarHBondContact O-N 2.88Å; V919-W921 VanDerWaalsContact O-N 3.16Å; W921-D925 PolarHBondContact NE1-OD1 2.63Å; W921-L930 HydrophobicContact CD2-CD1 3.97Å; W921-L930 HydrophobicContact CD2-CD2 4.37Å; W921-L930 HydrophobicContact CD2-CG 3.89Å; W921-L930 HydrophobicContact CE3-CD1 3.56Å; W921-L930 HydrophobicContact CE3-CD2 4.25Å; W921-L930 HydrophobicContact CE3-CG 3.93Å; W921-L930 HydrophobicContact CG-CG 4.37Å; W921-L930 HydrophobicContact CH2-CD1 3.56Å; W921-L930 HydrophobicContact CH2-CG 4.41Å; W921-L930 HydrophobicContact CZ2-CD1 3.96Å; W921-L930 HydrophobicContact CZ2-CG 4.37Å; W921-L930 HydrophobicContact CZ3-CD1 3.36Å; W921-L930 HydrophobicContact CZ3-CG 4.21Å; W921-V950 HydrophobicContact CB-CG1 4.33Å; W921-F951 PolarHBondContact N-O 2.81Å; W921-M967 HydrophobicContact CE3-CE 3.76Å; W921-M967 HydrophobicContact CE3-SD 3.77Å; W921-M967 HydrophobicContact CZ3-CE 3.83Å; W921-M967 HydrophobicContact CZ3-SD 3.64Å; W921-L970 HydrophobicContact CH2-CD2 4.1Å; W921-L970 HydrophobicContact CZ3-CD2 4.01Å
922	L	88.6	Confident	91.9	Very high	3 Å²	3	24.4 Å²	24.4	2%	0.016	12%	0.117	C	C	.	.			trans	-76.3	-34.3	-170.8	-54.5	179.4	0	0	0	112.3	Y920 V953 I984 L987 I1044 T1061	Y920-L922 VanDerWaalsContact C-N 3.27Å; Y920-L922 HydrophobicContact CD1-CD2 4.24Å; Y920-L922 PolarHBondContact O-N 2.89Å; Y920-L922 VanDerWaalsContact O-N 3.14Å; L922-V953 HydrophobicContact CB-CG2 4.08Å; L922-V953 HydrophobicContact CD2-CG2 3.54Å; L922-V953 HydrophobicContact CG-CG2 4.36Å; L922-I984 HydrophobicContact CD2-CD1 4.27Å; L922-L987 HydrophobicContact CD1-CD2 4.48Å; L922-I1044 HydrophobicContact CD1-CD1 3.49Å; L922-I1044 VanDerWaalsContact CD1-CD1 3.49Å; L922-I1044 HydrophobicContact CD1-CG1 3.98Å; L922-T1061 PolarHBondContact N-OG1 3.03Å; L922-T1061 VanDerWaalsContact N-OG1 3.11Å
923	F	87.1	Confident	92.3	Very high	22 Å²	22	21.5 Å²	21.5	10%	0.096	10%	0.102	C	C	.	.	S	Bend	trans	-133.3	145.5	-179.8	-54.4	-72.9	0	0	0	109.8	E87 R88 D925 T1061 R1094	E87-F923 HydrophobicContact CB-CB 4.26Å; E87-F923 HydrophobicContact CB-CD1 3.72Å; E87-F923 HydrophobicContact CB-CE1 4.23Å; E87-F923 HydrophobicContact CB-CG 3.98Å; R88-F923 WeakPolarHBondContact O-CA 3.36Å; F923-D925 PolarHBondContact O-N 2.8Å; F923-T1061 HydrophobicContact CB-CG2 4.06Å; F923-T1061 HydrophobicContact CD2-CG2 4.19Å; F923-R1094 PolarHBondContact O-NH1 2.78Å
924	D	85.9	Confident	92.6	Very high	4 Å²	4	14.8 Å²	14.8	2%	0.021	7%	0.073	C	C	.	.			trans	-63.2	134.7	177	-165.6	34.9	0	0	0	110.4	R88 P90 Y94 Y95 R108 R1094 Q1097	R88-D924 PolarHBondContact O-N 2.9Å; P90-D924 HydrophobicContact CB-CB 4.21Å; P90-D924 HydrophobicContact CG-CB 4.24Å; Y94-D924 HydrophobicContact CD2-CB 4.31Å; Y94-D924 WeakPolarHBondContact CD2-OD2 3.43Å; Y94-D924 HydrophobicContact CE2-CB 4.49Å; Y95-D924 PolarHBondContact OH-OD1 3.06Å; R108-D924 IonicContact CZ-OD2 2.85Å; R108-D924 IonicContact NE-OD2 2.74Å; R108-D924 PolarHBondContact NE-OD2 3.36Å; R108-D924 IonicContact NH2-OD1 3.58Å; R108-D924 PolarHBondContact NH2-OD1 3.34Å; R108-D924 IonicContact NH2-OD2 2.89Å; R108-D924 PolarHBondContact NH2-OD2 3.45Å; D924-R1094 PolarHBondContact O-NH1 3.24Å; D924-Q1097 PolarHBondContact O-NE2 2.91Å; D924-Q1097 PolarHBondContact O-OE1 2.86Å
925	D	87.2	Confident	92.9	Very high	1 Å²	1	7.8 Å²	7.8	1%	0.005	4%	0.041	C	C	.	.	S	Bend	trans	-137.7	12.8	-174.1	77.5	-33.7	0	0	0	112.3	W921 F923 G927 L928 G929 G1095 Q1097	W921-D925 PolarHBondContact NE1-OD1 2.63Å; F923-D925 PolarHBondContact O-N 2.8Å; D925-G927 PolarHBondContact OD1-N 2.85Å; D925-L928 PolarHBondContact OD1-N 3.33Å; D925-G929 WeakPolarHBondContact OD2-CA 3.18Å; D925-G929 PolarHBondContact OD2-N 3.45Å; D925-G1095 CarbonylContact O-C 3.54Å; D925-G1095 WeakPolarHBondContact O-CA 3.29Å; D925-G1095 PolarHBondContact OD2-N 3.41Å; D925-Q1097 VanDerWaalsContact CA-OE1 3.24Å
926	G	88.5	Confident	93	Very high	0 Å²	0	7.7 Å²	7.7	0%	0	4%	0.04	C	C	.	.	S	Bend	trans	89.6	-3.6	-172	0	0	0	0	0	115.1	Y95 E1098 S1099 V1100	Y95-G926 WeakPolarHBondContact CE1-O 3.44Å; Y95-G926 VanDerWaalsContact OH-C 3.22Å; G926-E1098 WeakPolarHBondContact CA-O 3.48Å; G926-S1099 WeakPolarHBondContact O-CA 3.38Å; G926-V1100 WeakPolarHBondContact O-CG2 3.08Å; G926-V1100 PolarHBondContact O-N 2.95Å
927	G	90.6	Very high	92.8	Very high	0 Å²	0	7.1 Å²	7.1	0%	0	4%	0.037	C	C	.	.	S	Bend	trans	94.2	4.4	178.4	0	0	0	0	0	113.1	Y95 D925 G929 L930 L931	Y95-G927 WeakPolarHBondContact OH-CA 3.44Å; Y95-G927 PolarHBondContact OH-N 3.44Å; D925-G927 PolarHBondContact OD1-N 2.85Å; G927-G929 PolarHBondContact O-N 2.98Å; G927-L930 PolarHBondContact O-N 3.32Å; G927-L930 VanDerWaalsContact O-N 3.09Å; G927-L931 WeakPolarHBondContact O-CB 3.48Å; G927-L931 PolarHBondContact O-N 3.31Å
928	L	93.4	Very high	92.6	Very high	2 Å²	2	10.2 Å²	10.2	1%	0.01	5%	0.053	C	C	.	.	H	α-helix	trans	-60.5	-39.2	175.2	-171.6	67.5	0	0	0	110.7	V737 D925 L930 L931 I932 L1093 V1100	V737-L928 HydrophobicContact CG1-CD2 4.33Å; V737-L928 HydrophobicContact CG2-CD1 4.1Å; V737-L928 HydrophobicContact CG2-CD2 3.79Å; D925-L928 PolarHBondContact OD1-N 3.33Å; L928-L930 PolarHBondContact O-N 3.47Å; L928-L930 VanDerWaalsContact O-N 3.17Å; L928-L931 PolarHBondContact O-N 2.79Å; L928-I932 HydrophobicContact CD1-CD1 4Å; L928-I932 HydrophobicContact CD1-CG1 3.74Å; L928-I932 HydrophobicContact CG-CG1 3.98Å; L928-I932 PolarHBondContact O-N 3.48Å; L928-L1093 HydrophobicContact CD2-CD1 3.87Å; L928-L1093 HydrophobicContact CD2-CG 4.49Å; L928-L1093 HydrophobicContact CG-CD1 4.18Å; L928-L1093 HydrophobicContact CG-CD2 4.45Å; L928-L1093 HydrophobicContact CG-CG 4.44Å; L928-V1100 HydrophobicContact CB-CG2 4.24Å
929	G	91.6	Very high	92.2	Very high	4 Å²	4	13.4 Å²	13.4	4%	0.041	7%	0.074	C	C	.	.	H	α-helix	trans	-51.9	-30.1	172.6	0	0	0	0	0	114.7	V919 D925 G927 P933	V919-G929 VanDerWaalsContact CG1-O 3.23Å; V919-G929 WeakPolarHBondContact CG1-O 3.33Å; D925-G929 WeakPolarHBondContact OD2-CA 3.18Å; D925-G929 PolarHBondContact OD2-N 3.45Å; G927-G929 PolarHBondContact O-N 2.98Å; G929-P933 WeakPolarHBondContact O-CD 3.36Å; G929-P933 WeakPolarHBondContact O-CG 3.46Å
930	L	93.1	Very high	91.7	Very high	1 Å²	1	20.9 Å²	20.9	1%	0.005	11%	0.109	C	C	.	.	H	α-helix	trans	-95.9	-38.4	175.7	-70	177.3	0	0	0	112.6	V919 W921 G927 L928 H934 V950 L971 F974 L976 L1101	V919-L930 HydrophobicContact CG1-CD2 4.2Å; W921-L930 HydrophobicContact CD2-CD1 3.97Å; W921-L930 HydrophobicContact CD2-CD2 4.37Å; W921-L930 HydrophobicContact CD2-CG 3.89Å; W921-L930 HydrophobicContact CE3-CD1 3.56Å; W921-L930 HydrophobicContact CE3-CD2 4.25Å; W921-L930 HydrophobicContact CE3-CG 3.93Å; W921-L930 HydrophobicContact CG-CG 4.37Å; W921-L930 HydrophobicContact CH2-CD1 3.56Å; W921-L930 HydrophobicContact CH2-CG 4.41Å; W921-L930 HydrophobicContact CZ2-CD1 3.96Å; W921-L930 HydrophobicContact CZ2-CG 4.37Å; W921-L930 HydrophobicContact CZ3-CD1 3.36Å; W921-L930 HydrophobicContact CZ3-CG 4.21Å; G927-L930 PolarHBondContact O-N 3.32Å; G927-L930 VanDerWaalsContact O-N 3.09Å; L928-L930 PolarHBondContact O-N 3.47Å; L928-L930 VanDerWaalsContact O-N 3.17Å; L930-H934 WeakPolarHBondContact O-CB 3.44Å; L930-H934 PolarHBondContact O-N 3.15Å; L930-H934 VanDerWaalsContact O-N 3.1Å; L930-V950 HydrophobicContact CD2-CG1 4.28Å; L930-V950 HydrophobicContact CD2-CG2 4.02Å; L930-L971 HydrophobicContact CD1-CD2 3.56Å; L930-L971 HydrophobicContact CD2-CD2 3.95Å; L930-L971 HydrophobicContact CG-CD2 4.42Å; L930-F974 HydrophobicContact CD1-CD2 4.43Å; L930-F974 HydrophobicContact CD1-CE2 4.45Å; L930-L976 HydrophobicContact CB-CD1 4.01Å; L930-L976 HydrophobicContact CD1-CD1 4.22Å; L930-L1101 HydrophobicContact CB-CD1 3.92Å; L930-L1101 HydrophobicContact CD1-CD1 4.36Å
931	L	93.6	Very high	91.4	Very high	20 Å²	20	21.2 Å²	21.2	11%	0.105	11%	0.111	C	C	.	.	H	α-helix	trans	-62.9	-47.2	-177	178.4	61.8	0	0	0	111.8	Y641 P643 G927 L928 H934 L935 V1100 L1101	Y641-L931 HydrophobicContact CD1-CD2 3.77Å; Y641-L931 HydrophobicContact CE1-CD2 3.71Å; P643-L931 HydrophobicContact CG-CD2 4.17Å; G927-L931 WeakPolarHBondContact O-CB 3.48Å; G927-L931 PolarHBondContact O-N 3.31Å; L928-L931 PolarHBondContact O-N 2.79Å; L931-H934 PolarHBondContact O-N 3.38Å; L931-L935 HydrophobicContact CD1-CD1 4.3Å; L931-L935 HydrophobicContact CD1-CD2 4.42Å; L931-L935 HydrophobicContact CD1-CG 4.11Å; L931-L935 HydrophobicContact CG-CD1 4.16Å; L931-L935 HydrophobicContact CG-CG 4.38Å; L931-L935 WeakPolarHBondContact O-CG 3.32Å; L931-L935 PolarHBondContact O-N 3.13Å; L931-V1100 HydrophobicContact CB-CG2 4.23Å; L931-V1100 HydrophobicContact CD2-CB 4.1Å; L931-V1100 HydrophobicContact CD2-CG2 3.79Å; L931-L1101 HydrophobicContact CB-CD2 4.24Å; L931-L1101 HydrophobicContact CB-CG 4.42Å; L931-L1101 HydrophobicContact CD1-CD2 3.98Å
932	I	95.5	Very high	91.4	Very high	3 Å²	3	21.7 Å²	21.7	2%	0.015	11%	0.113	C	C	.	.	H	α-helix	trans	-63.1	-50.9	-176.7	-62.6	-67.1	0	0	0	111.8	P643 I665 L928 H934 L935 L936 L1091 L1093	P643-I932 HydrophobicContact CB-CD1 3.99Å; P643-I932 HydrophobicContact CG-CD1 3.94Å; I665-I932 HydrophobicContact CD1-CG2 3.79Å; I665-I932 HydrophobicContact CG1-CG2 4.14Å; I665-I932 HydrophobicContact CG2-CD1 3.66Å; L928-I932 HydrophobicContact CD1-CD1 4Å; L928-I932 HydrophobicContact CD1-CG1 3.74Å; L928-I932 HydrophobicContact CG-CG1 3.98Å; L928-I932 PolarHBondContact O-N 3.48Å; I932-H934 VanDerWaalsContact C-N 3.3Å; I932-H934 PolarHBondContact O-N 3.07Å; I932-L935 PolarHBondContact O-N 3.42Å; I932-L936 WeakPolarHBondContact O-CG 3.35Å; I932-L936 PolarHBondContact O-N 3.42Å; I932-L936 VanDerWaalsContact O-N 3.14Å; I932-L1091 HydrophobicContact CG2-CD2 4.17Å; I932-L1093 HydrophobicContact CB-CD2 3.76Å; I932-L1093 HydrophobicContact CG1-CD2 3.85Å; I932-L1093 HydrophobicContact CG2-CD2 4.28Å
933	P	96	Very high	91.7	Very high	0 Å²	0	21.6 Å²	21.6	0%	0	11%	0.113	C	C	.	.	H	α-helix	trans	-54.5	-42.9	171.4	-30.7	38.4	0	0	0	113.9	I917 V919 G929 L936 T937 L948 V1059	I917-P933 HydrophobicContact CG2-CB 4.09Å; V919-P933 HydrophobicContact CG1-CG 4.29Å; V919-P933 HydrophobicContact CG2-CB 3.67Å; V919-P933 HydrophobicContact CG2-CG 3.6Å; G929-P933 WeakPolarHBondContact O-CD 3.36Å; G929-P933 WeakPolarHBondContact O-CG 3.46Å; P933-L936 WeakPolarHBondContact O-CB 3.3Å; P933-L936 PolarHBondContact O-N 3.15Å; P933-L936 VanDerWaalsContact O-N 3.12Å; P933-T937 WeakPolarHBondContact O-CG2 3.26Å; P933-T937 PolarHBondContact O-N 3.02Å; P933-L948 HydrophobicContact CB-CD1 3.75Å; P933-V1059 HydrophobicContact CG-CB 4.1Å; P933-V1059 HydrophobicContact CG-CG1 4.11Å; P933-V1059 HydrophobicContact CG-CG2 3.77Å
934	H	94.3	Very high	91.9	Very high	39 Å²	39	25.5 Å²	25.5	18%	0.181	13%	0.127	C	C	.	.	H	α-helix	trans	-63	-43.6	178	175.3	73.4	0	0	0	111.9	L930 L931 I932 L936 T937 L938 L976	L930-H934 WeakPolarHBondContact O-CB 3.44Å; L930-H934 PolarHBondContact O-N 3.15Å; L930-H934 VanDerWaalsContact O-N 3.1Å; L931-H934 PolarHBondContact O-N 3.38Å; I932-H934 VanDerWaalsContact C-N 3.3Å; I932-H934 PolarHBondContact O-N 3.07Å; H934-L936 PolarHBondContact O-N 3.32Å; H934-T937 PolarHBondContact O-N 3.4Å; H934-T937 PolarHBondContact O-OG1 3.43Å; H934-L938 PolarHBondContact O-N 3.13Å; H934-L976 HydrophobicContact CB-CD2 3.83Å; H934-L976 WeakPolarHBondContact ND1-CD2 3.38Å
935	L	94.1	Very high	92.2	Very high	30 Å²	30	30.7 Å²	30.7	16%	0.157	16%	0.155	C	C	.	.	H	α-helix	trans	-58.2	-34.7	174.5	-69.5	175.9	0	0	0	111.4	P643 I665 K667 L931 I932 T937 L938	P643-L935 HydrophobicContact CG-CD1 3.63Å; I665-L935 HydrophobicContact CG2-CD1 4.34Å; K667-L935 WeakPolarHBondContact CE-O 3.26Å; K667-L935 PolarHBondContact NZ-O 3.5Å; L931-L935 HydrophobicContact CD1-CD1 4.3Å; L931-L935 HydrophobicContact CD1-CD2 4.42Å; L931-L935 HydrophobicContact CD1-CG 4.11Å; L931-L935 HydrophobicContact CG-CD1 4.16Å; L931-L935 HydrophobicContact CG-CG 4.38Å; L931-L935 WeakPolarHBondContact O-CG 3.32Å; L931-L935 PolarHBondContact O-N 3.13Å; I932-L935 PolarHBondContact O-N 3.42Å; L935-T937 VanDerWaalsContact C-N 3.27Å; L935-T937 PolarHBondContact O-N 3.43Å; L935-L938 HydrophobicContact CD2-CD1 3.88Å; L935-L938 PolarHBondContact O-N 2.62Å
936	L	95.2	Very high	92.6	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-69.6	-18.3	174.9	-65.6	173.6	0	0	0	113.7	F661 I665 I917 I932 P933 H934 S941 F942 L943 L1057	F661-L936 HydrophobicContact CE2-CD1 4.12Å; F661-L936 HydrophobicContact CZ-CD1 3.97Å; I665-L936 HydrophobicContact CG1-CD2 3.91Å; I665-L936 HydrophobicContact CG1-CG 4.35Å; I917-L936 HydrophobicContact CD1-CB 4.32Å; I932-L936 WeakPolarHBondContact O-CG 3.35Å; I932-L936 PolarHBondContact O-N 3.42Å; I932-L936 VanDerWaalsContact O-N 3.14Å; P933-L936 WeakPolarHBondContact O-CB 3.3Å; P933-L936 PolarHBondContact O-N 3.15Å; P933-L936 VanDerWaalsContact O-N 3.12Å; H934-L936 PolarHBondContact O-N 3.32Å; L936-S941 WeakPolarHBondContact CA-OG 3.5Å; L936-S941 WeakPolarHBondContact O-CB 3.36Å; L936-S941 PolarHBondContact O-OG 2.98Å; L936-F942 HydrophobicContact CD2-CE1 3.96Å; L936-L943 HydrophobicContact CB-CB 4.38Å; L936-L943 HydrophobicContact CB-CD1 4.33Å; L936-L943 HydrophobicContact CD1-CD1 4.34Å; L936-L943 CarbonylContact O-C 3.56Å; L936-L943 WeakPolarHBondContact O-CB 3.05Å; L936-L1057 HydrophobicContact CD1-CD2 3.57Å
937	T	94.7	Very high	92.9	Very high	18 Å²	18	37.6 Å²	37.6	11%	0.11	19%	0.187	C	C	.	.	H	α-helix	trans	-85.3	-17.8	174.5	73.9	0	0	0	0	113.5	I917 P933 H934 L935 R944 N945 A946	I917-T937 HydrophobicContact CD1-CG2 3.95Å; P933-T937 WeakPolarHBondContact O-CG2 3.26Å; P933-T937 PolarHBondContact O-N 3.02Å; H934-T937 PolarHBondContact O-N 3.4Å; H934-T937 PolarHBondContact O-OG1 3.43Å; L935-T937 VanDerWaalsContact C-N 3.27Å; L935-T937 PolarHBondContact O-N 3.43Å; T937-R944 CarbonylContact O-C 3.59Å; T937-R944 WeakPolarHBondContact O-CA 3.42Å; T937-N945 PolarHBondContact O-N 3.44Å; T937-A946 HydrophobicContact CG2-CB 4.34Å
938	L	92.6	Very high	93.2	Very high	65 Å²	65	37.9 Å²	37.9	34%	0.34	19%	0.188	S	C	.	.	S	Bend	trans	-71.1	164.6	179.6	-63.6	-179.8	0	0	0	112.7	K667 H934 L935 S941	K667-L938 PolarHBondContact NZ-O 3.19Å; K667-L938 VanDerWaalsContact NZ-O 3.09Å; H934-L938 PolarHBondContact O-N 3.13Å; L935-L938 HydrophobicContact CD2-CD1 3.88Å; L935-L938 PolarHBondContact O-N 2.62Å; L938-S941 WeakPolarHBondContact O-CB 3.34Å; L938-S941 PolarHBondContact O-N 3.07Å
939	P	89.6	Confident	93.3	Very high	67 Å²	67	40.6 Å²	40.6	44%	0.435	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	156.8	177	-27.4	35.9	0	0	0	114.5	K667 S941	K667-P939 PolarHBondContact NZ-O 2.82Å; P939-S941 PolarHBondContact O-N 2.67Å
940	Q	85.5	Confident	93.4	Very high	159 Å²	159	40.4 Å²	40.4	74%	0.743	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	66.3	2.5	-176	-58.2	176.2	-24.3	0	0	116.6
941	S	90.4	Very high	93.5	Very high	8 Å²	8	40.4 Å²	40.4	6%	0.056	20%	0.196	C	C	.	.	S	Bend	trans	-94	152.7	170.8	172.3	0	0	0	0	112.4	L936 L938 P939 L943 R944	L936-S941 WeakPolarHBondContact CA-OG 3.5Å; L936-S941 WeakPolarHBondContact O-CB 3.36Å; L936-S941 PolarHBondContact O-OG 2.98Å; L938-S941 WeakPolarHBondContact O-CB 3.34Å; L938-S941 PolarHBondContact O-N 3.07Å; P939-S941 PolarHBondContact O-N 2.67Å; S941-L943 PolarHBondContact O-N 2.85Å; S941-L943 PolarHBondContact OG-N 3.12Å; S941-R944 WeakPolarHBondContact O-CB 3.3Å; S941-R944 PolarHBondContact O-N 2.81Å
942	F	92.1	Very high	93.2	Very high	10 Å²	10	39.5 Å²	39.5	4%	0.044	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-23.1	172.7	74.1	-79.5	0	0	0	113.6	F661 F908 R911 L912 L936	F661-F942 AromaticContact CD2-CE1 3.99Å; F661-F942 HydrophobicContact CD2-CE1 3.99Å; F661-F942 AromaticContact CD2-CZ 3.97Å; F661-F942 HydrophobicContact CD2-CZ 3.97Å; F661-F942 HydrophobicContact CE2-CE1 4.19Å; F661-F942 AromaticContact CE2-CZ 3.93Å; F661-F942 HydrophobicContact CE2-CZ 3.93Å; F908-F942 HydrophobicContact CB-CD1 4.29Å; F908-F942 HydrophobicContact CB-CE1 4.43Å; F908-F942 HydrophobicContact CB-CG 4.49Å; F908-F942 HydrophobicContact CD1-CD1 4.3Å; F908-F942 AromaticContact CD1-CD2 3.99Å; F908-F942 HydrophobicContact CD1-CD2 3.99Å; F908-F942 AromaticContact CD1-CE1 3.83Å; F908-F942 HydrophobicContact CD1-CE1 3.83Å; F908-F942 AromaticContact CD1-CE2 3.45Å; F908-F942 HydrophobicContact CD1-CE2 3.45Å; F908-F942 VanDerWaalsContact CD1-CE2 3.45Å; F908-F942 HydrophobicContact CD1-CG 4.4Å; F908-F942 AromaticContact CD1-CZ 3.38Å; F908-F942 HydrophobicContact CD1-CZ 3.38Å; F908-F942 AromaticContact CE1-CE2 3.91Å; F908-F942 HydrophobicContact CE1-CE2 3.91Å; F908-F942 AromaticContact CE1-CZ 3.77Å; F908-F942 HydrophobicContact CE1-CZ 3.77Å; F908-F942 HydrophobicContact CG-CE1 4.47Å; F908-F942 HydrophobicContact CG-CZ 4.41Å; F908-F942 WeakPolarHBondContact O-CB 3.34Å; R911-F942 WeakPolarHBondContact CA-O 3.25Å; L912-F942 PolarHBondContact N-O 3.09Å; L936-F942 HydrophobicContact CD2-CE1 3.96Å
943	L	94.3	Very high	92.7	Very high	0 Å²	0	40.2 Å²	40.2	0%	0	20%	0.196	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102.2	23.9	175.6	-60.1	174.4	0	0	0	113.1	L912 A915 I917 L936 S941 N945 A946 Q1056 L1057	L912-L943 HydrophobicContact CB-CD2 4.45Å; L912-L943 HydrophobicContact CD1-CD2 4.02Å; A915-L943 HydrophobicContact CB-CD2 3.71Å; I917-L943 HydrophobicContact CD1-CB 4.09Å; I917-L943 HydrophobicContact CD1-CD1 3.65Å; I917-L943 HydrophobicContact CD1-CG 4.45Å; I917-L943 HydrophobicContact CG1-CD1 3.92Å; L936-L943 HydrophobicContact CB-CB 4.38Å; L936-L943 HydrophobicContact CB-CD1 4.33Å; L936-L943 HydrophobicContact CD1-CD1 4.34Å; L936-L943 CarbonylContact O-C 3.56Å; L936-L943 WeakPolarHBondContact O-CB 3.05Å; S941-L943 PolarHBondContact O-N 2.85Å; S941-L943 PolarHBondContact OG-N 3.12Å; L943-N945 PolarHBondContact O-N 3.43Å; L943-A946 HydrophobicContact CB-CB 4.02Å; L943-A946 WeakPolarHBondContact O-CB 3.42Å; L943-A946 PolarHBondContact O-N 2.89Å; L943-Q1056 HydrophobicContact CD2-CB 4.33Å; L943-L1057 HydrophobicContact CD1-CB 3.93Å; L943-L1057 HydrophobicContact CD1-CD2 3.72Å; L943-L1057 HydrophobicContact CD1-CG 4.48Å
944	R	91.9	Very high	91.7	Very high	104 Å²	104	40.3 Å²	40.3	39%	0.392	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-52.6	128.7	179	-178.7	-174.2	-179.1	177.5	-0.4	111.7	T937 S941 A946	T937-R944 CarbonylContact O-C 3.59Å; T937-R944 WeakPolarHBondContact O-CA 3.42Å; S941-R944 WeakPolarHBondContact O-CB 3.3Å; S941-R944 PolarHBondContact O-N 2.81Å; R944-A946 PolarHBondContact O-N 3.06Å
945	N	92.6	Very high	90.3	Very high	114 Å²	114	43.8 Å²	43.8	61%	0.61	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.2	22.3	-176	-50.8	-11.6	0	0	0	114.3	T937 L943	T937-N945 PolarHBondContact O-N 3.44Å; L943-N945 PolarHBondContact O-N 3.43Å
946	A	94.6	Very high	88.9	Confident	10 Å²	10	44.5 Å²	44.5	8%	0.083	23%	0.228	C	C	.	.	P	Polyproline II helix	trans	-63	145.7	171.9	0	0	0	0	0	110.9	A915 I917 T937 L943 R944	A915-A946 HydrophobicContact CB-CB 3.85Å; A915-A946 CarbonylContact O-C 3.58Å; A915-A946 WeakPolarHBondContact O-CA 3.31Å; A915-A946 WeakPolarHBondContact O-CB 3.41Å; I917-A946 HydrophobicContact CD1-CB 3.93Å; I917-A946 HydrophobicContact CG1-CB 3.83Å; T937-A946 HydrophobicContact CG2-CB 4.34Å; L943-A946 HydrophobicContact CB-CB 4.02Å; L943-A946 WeakPolarHBondContact O-CB 3.42Å; L943-A946 PolarHBondContact O-N 2.89Å; R944-A946 PolarHBondContact O-N 3.06Å
947	K	96.2	Very high	87.6	Confident	136 Å²	136	53 Å²	53	59%	0.591	26%	0.26	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.9	128.9	174.6	-67.5	-176.5	178.9	-177.8	0	109.3	A915 V916 I917	A915-K947 PolarHBondContact O-N 3.15Å; V916-K947 CarbonylContact C-O 3.54Å; V916-K947 VanDerWaalsContact CA-O 3.32Å; V916-K947 WeakPolarHBondContact CA-O 3.47Å; V916-K947 HydrophobicContact CG2-CB 4.41Å; I917-K947 PolarHBondContact N-O 3.37Å
948	L	95	Very high	86.3	Confident	5 Å²	5	57 Å²	57	3%	0.026	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	118.5	-178.2	-165.3	149.4	0	0	0	109.9	I917 V919 P933 V950 Y978 S979	I917-L948 WeakPolarHBondContact O-CA 3.42Å; V919-L948 HydrophobicContact CG2-CD1 4.27Å; V919-L948 HydrophobicContact CG2-CD2 4.05Å; V919-L948 HydrophobicContact CG2-CG 3.99Å; P933-L948 HydrophobicContact CB-CD1 3.75Å; L948-V950 HydrophobicContact CD2-CG2 3.3Å; L948-Y978 CarbonylContact O-C 3.55Å; L948-Y978 WeakPolarHBondContact O-CA 3.42Å; L948-Y978 WeakPolarHBondContact O-CB 3.02Å; L948-S979 PolarHBondContact O-N 3.44Å; L948-S979 PolarHBondContact O-OG 2.99Å; L948-S979 VanDerWaalsContact O-OG 3.13Å
949	R	96.4	Very high	85.4	Confident	60 Å²	60	57.1 Å²	57.1	23%	0.226	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	123.7	174.3	-61.5	-170.5	-60.8	172.3	3.8	109.1	V916 I917 D918 V919 F951 S979 D980 H1051	V916-R949 HydrophobicContact CG1-CG 4.15Å; I917-R949 PolarHBondContact O-N 3.44Å; D918-R949 IonicContact OD1-CZ 2.9Å; D918-R949 VanDerWaalsContact OD1-CZ 3.22Å; D918-R949 IonicContact OD1-NE 3.55Å; D918-R949 PolarHBondContact OD1-NE 3.37Å; D918-R949 IonicContact OD1-NH2 2.76Å; D918-R949 PolarHBondContact OD1-NH2 3.48Å; D918-R949 IonicContact OD2-CZ 3.46Å; D918-R949 IonicContact OD2-NE 3.83Å; D918-R949 IonicContact OD2-NH2 3.09Å; D918-R949 PolarHBondContact OD2-NH2 3.25Å; V919-R949 PolarHBondContact N-O 3.36Å; R949-F951 HydrophobicContact CB-CE2 3.94Å; R949-S979 VanDerWaalsContact CG-OG 3.29Å; R949-S979 WeakPolarHBondContact CG-OG 3.37Å; R949-D980 WeakPolarHBondContact CA-O 3.43Å; R949-D980 HydrophobicContact CG-CB 4.42Å; R949-H1051 PolarHBondContact NH2-O 2.88Å
950	V	94.6	Very high	84.7	Confident	0 Å²	0	56 Å²	56	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	125.1	-178.6	-175.4	0	0	0	0	109.9	V919 W921 L930 L948 L971 D980 V981 I982	V919-V950 CarbonylContact O-C 3.55Å; V919-V950 WeakPolarHBondContact O-CA 3.35Å; W921-V950 HydrophobicContact CB-CG1 4.33Å; L930-V950 HydrophobicContact CD2-CG1 4.28Å; L930-V950 HydrophobicContact CD2-CG2 4.02Å; L948-V950 HydrophobicContact CD2-CG2 3.3Å; V950-L971 HydrophobicContact CB-CD1 4.04Å; V950-L971 HydrophobicContact CG1-CD1 4.4Å; V950-L971 HydrophobicContact CG2-CD1 3.7Å; V950-L971 HydrophobicContact CG2-CD2 4.31Å; V950-D980 PolarHBondContact N-O 3.49Å; V950-V981 CarbonylContact O-C 3.6Å; V950-V981 WeakPolarHBondContact O-CA 3.25Å; V950-I982 PolarHBondContact O-N 3.14Å
951	F	93.7	Very high	84.4	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.9	174.8	-63.4	-103.8	0	0	0	109.4	D918 V919 Y920 W921 R949 I982 I984 H1051	D918-F951 HydrophobicContact CB-CD2 4.36Å; D918-F951 HydrophobicContact CB-CE2 3.84Å; V919-F951 PolarHBondContact O-N 3.11Å; Y920-F951 HydrophobicContact CD1-CB 3.67Å; Y920-F951 HydrophobicContact CD1-CG 4.09Å; Y920-F951 HydrophobicContact CD2-CB 4.39Å; Y920-F951 HydrophobicContact CD2-CD2 4.1Å; Y920-F951 HydrophobicContact CD2-CG 4.35Å; Y920-F951 HydrophobicContact CE1-CB 3.88Å; Y920-F951 AromaticContact CE1-CD1 3.92Å; Y920-F951 HydrophobicContact CE1-CD1 3.92Å; Y920-F951 HydrophobicContact CE1-CD2 4.39Å; Y920-F951 AromaticContact CE1-CG 3.82Å; Y920-F951 HydrophobicContact CE1-CG 3.82Å; Y920-F951 AromaticContact CE2-CD2 3.81Å; Y920-F951 HydrophobicContact CE2-CD2 3.81Å; Y920-F951 HydrophobicContact CE2-CE2 4.09Å; Y920-F951 HydrophobicContact CE2-CG 4.09Å; Y920-F951 HydrophobicContact CG-CB 3.93Å; Y920-F951 HydrophobicContact CG-CD2 4.49Å; Y920-F951 HydrophobicContact CG-CG 4.34Å; Y920-F951 AromaticContact CZ-CD1 3.91Å; Y920-F951 AromaticContact CZ-CD2 3.96Å; Y920-F951 AromaticContact CZ-CG 3.81Å; W921-F951 PolarHBondContact N-O 2.81Å; R949-F951 HydrophobicContact CB-CE2 3.94Å; F951-I982 VanDerWaalsContact CA-O 3.29Å; F951-I982 WeakPolarHBondContact CA-O 3.45Å; F951-I982 HydrophobicContact CD1-CB 3.71Å; F951-I982 HydrophobicContact CD1-CD1 4.17Å; F951-I982 HydrophobicContact CD1-CG2 3.78Å; F951-I982 HydrophobicContact CE1-CB 3.83Å; F951-I982 HydrophobicContact CE1-CD1 3.4Å; F951-I982 VanDerWaalsContact CE1-CD1 3.4Å; F951-I982 HydrophobicContact CE1-CG1 4.21Å; F951-I982 HydrophobicContact CE1-CG2 3.85Å; F951-I982 HydrophobicContact CE2-CD1 4.27Å; F951-I982 HydrophobicContact CG-CB 4.37Å; F951-I982 HydrophobicContact CZ-CD1 3.47Å; F951-I982 VanDerWaalsContact CZ-CD1 3.47Å; F951-I984 HydrophobicContact CB-CD1 4.31Å; F951-H1051 HydrophobicContact CE1-CB 3.71Å; F951-H1051 HydrophobicContact CZ-CB 3.94Å
952	T	88.3	Confident	83.9	Confident	2 Å²	2	61.3 Å²	61.3	1%	0.012	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	165.7	177.2	-173.1	0	0	0	0	110.9	M967 I982 V983 I984	T952-M967 HydrophobicContact CG2-CB 4.36Å; T952-M967 HydrophobicContact CG2-CE 4.2Å; T952-M967 HydrophobicContact CG2-CG 4.21Å; T952-I982 PolarHBondContact N-O 2.98Å; T952-V983 HydrophobicContact CG2-CB 4.39Å; T952-V983 HydrophobicContact CG2-CG1 4.25Å; T952-V983 HydrophobicContact CG2-CG2 3.81Å; T952-V983 WeakPolarHBondContact O-CA 3.29Å; T952-I984 PolarHBondContact O-N 2.99Å
953	V	84.1	Confident	83.4	Confident	18 Å²	18	62.6 Å²	62.6	11%	0.109	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	132.8	-176.8	-174.8	0	0	0	0	110.1	L922 L987	L922-V953 HydrophobicContact CB-CG2 4.08Å; L922-V953 HydrophobicContact CD2-CG2 3.54Å; L922-V953 HydrophobicContact CG-CG2 4.36Å; V953-L987 HydrophobicContact CG1-CB 3.89Å; V953-L987 HydrophobicContact CG2-CB 4.44Å; V953-L987 HydrophobicContact CG2-CD2 4.04Å
954	A	75.5	Confident	82.9	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.008	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	141.1	164.6	0	0	0	0	0	111.2	S956 L960 E963 V983 I984	A954-S956 VanDerWaalsContact C-N 3.3Å; A954-S956 PolarHBondContact O-N 3.11Å; A954-L960 HydrophobicContact CB-CD2 3.65Å; A954-L960 HydrophobicContact CB-CG 4.31Å; A954-E963 HydrophobicContact CB-CG 4.3Å; A954-V983 HydrophobicContact CB-CG1 3.46Å; A954-V983 VanDerWaalsContact CB-CG1 3.46Å; A954-I984 PolarHBondContact N-O 3.4Å
955	T	64.3	Low	82.6	Confident	113 Å²	113	69.2 Å²	69.2	69%	0.693	33%	0.33	S	S	*	.	S	Bend	trans	-70.6	-26.6	177.3	-20.4	0	0	0	0	112.6
956	S	65.3	Low	82.2	Confident	44 Å²	44	65.9 Å²	65.9	31%	0.308	32%	0.316	S	S	.	.	S	Bend	trans	-149.6	148.6	178.5	169.9	0	0	0	0	110.8	A954 S958 Q959	A954-S956 VanDerWaalsContact C-N 3.3Å; A954-S956 PolarHBondContact O-N 3.11Å; S956-S958 PolarHBondContact O-N 3.48Å; S956-S958 PolarHBondContact OG-N 3.15Å; S956-S958 PolarHBondContact OG-OG 2.85Å; S956-Q959 PolarHBondContact O-N 3.16Å
957	R	67.6	Low	81.8	Confident	179 Å²	179	65.7 Å²	65.7	68%	0.675	31%	0.313	S	S	*	.	G	3₁₀ helix	trans	-55.1	-32.6	171.7	-74.7	-173.5	175.1	-145.7	-2.2	112.9	Q959 L960 P985	R957-Q959 PolarHBondContact O-N 2.82Å; R957-L960 HydrophobicContact CB-CD1 4.31Å; R957-L960 HydrophobicContact CG-CD1 4.47Å; R957-L960 VanDerWaalsContact O-CD1 3.3Å; R957-L960 WeakPolarHBondContact O-CD1 3.45Å; R957-L960 WeakPolarHBondContact O-CG 3.42Å; R957-P985 HydrophobicContact CG-CB 3.96Å
958	S	68.9	Low	81.3	Confident	103 Å²	103	60.3 Å²	60.3	72%	0.72	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-70.4	-12.8	179.3	59.2	0	0	0	0	114.1	S956	S956-S958 PolarHBondContact O-N 3.48Å; S956-S958 PolarHBondContact OG-N 3.15Å; S956-S958 PolarHBondContact OG-OG 2.85Å
959	Q	72.1	Confident	80.9	Confident	66 Å²	66	62 Å²	62	31%	0.308	31%	0.308	S	S	.	.	G	3₁₀ helix	trans	-109.6	-0	-176.6	-60.9	-173.6	-2.2	0	0	113.7	S956 R957 E961 R962 E963	S956-Q959 PolarHBondContact O-N 3.16Å; R957-Q959 PolarHBondContact O-N 2.82Å; Q959-E961 PolarHBondContact O-N 3.07Å; Q959-R962 WeakPolarHBondContact O-CB 3.48Å; Q959-R962 PolarHBondContact O-N 2.77Å; Q959-E963 PolarHBondContact O-N 3.41Å
960	L	76.3	Confident	80.4	Confident	44 Å²	44	59.2 Å²	59.2	23%	0.23	30%	0.298	C	S	.	.	H	α-helix	trans	-50	-53.3	-175.3	-73.6	163.8	0	0	0	113.5	A954 R957 R962 E963 Q964 V983 P985	A954-L960 HydrophobicContact CB-CD2 3.65Å; A954-L960 HydrophobicContact CB-CG 4.31Å; R957-L960 HydrophobicContact CB-CD1 4.31Å; R957-L960 HydrophobicContact CG-CD1 4.47Å; R957-L960 VanDerWaalsContact O-CD1 3.3Å; R957-L960 WeakPolarHBondContact O-CD1 3.45Å; R957-L960 WeakPolarHBondContact O-CG 3.42Å; L960-R962 VanDerWaalsContact C-N 3.28Å; L960-R962 PolarHBondContact O-N 3.27Å; L960-E963 PolarHBondContact O-N 3.33Å; L960-Q964 WeakPolarHBondContact O-CB 3.44Å; L960-Q964 PolarHBondContact O-N 2.92Å; L960-V983 HydrophobicContact CD2-CB 4.02Å; L960-V983 HydrophobicContact CD2-CG1 3.69Å; L960-P985 HydrophobicContact CD1-CB 3.91Å; L960-P985 HydrophobicContact CD2-CB 3.92Å; L960-P985 HydrophobicContact CG-CB 4.45Å
961	E	78.7	Confident	80.1	Confident	122 Å²	122	59.3 Å²	59.3	57%	0.57	30%	0.298	S	S	*	.	H	α-helix	trans	-63.8	-35.2	-179.1	-67.3	-173	-172.5	0	0	112.6	Q959 R965	Q959-E961 PolarHBondContact O-N 3.07Å; E961-R965 WeakPolarHBondContact O-CB 3.34Å; E961-R965 VanDerWaalsContact O-CG 3.31Å; E961-R965 WeakPolarHBondContact O-CG 3.47Å; E961-R965 PolarHBondContact O-N 3.22Å; E961-R965 IonicContact OE2-CZ 3.2Å; E961-R965 IonicContact OE2-NH1 3.17Å; E961-R965 IonicContact OE2-NH2 3.72Å; E961-R965 PolarHBondContact OE2-NH2 2.9Å
962	R	80.5	Confident	79.8	Confident	157 Å²	157	62.4 Å²	62.4	59%	0.592	32%	0.32	S	S	*	.	H	α-helix	trans	-68.6	-46.1	179.6	-172.3	-175.8	-69.3	115.5	-1.4	110.2	Q959 L960 R965 S966	Q959-R962 WeakPolarHBondContact O-CB 3.48Å; Q959-R962 PolarHBondContact O-N 2.77Å; L960-R962 VanDerWaalsContact C-N 3.28Å; L960-R962 PolarHBondContact O-N 3.27Å; R962-R965 PolarHBondContact O-N 2.97Å; R962-S966 VanDerWaalsContact O-CB 3.31Å; R962-S966 WeakPolarHBondContact O-CB 3.29Å; R962-S966 PolarHBondContact O-N 3.4Å
963	E	80	Confident	79.6	Confident	36 Å²	36	67.8 Å²	67.8	17%	0.168	34%	0.34	C	S	.	.	H	α-helix	trans	-64.2	-40	176.7	-67.9	-54.2	142.8	0	0	111.7	A954 Q959 L960 S966 M967 V983	A954-E963 HydrophobicContact CB-CG 4.3Å; Q959-E963 PolarHBondContact O-N 3.41Å; L960-E963 PolarHBondContact O-N 3.33Å; E963-S966 PolarHBondContact O-N 2.88Å; E963-M967 WeakPolarHBondContact O-CB 3.32Å; E963-M967 PolarHBondContact O-N 3.38Å; E963-V983 HydrophobicContact CB-CG1 4.19Å
964	Q	85.1	Confident	79.8	Confident	82 Å²	82	67.8 Å²	67.8	38%	0.383	34%	0.339	S	S	.	.	H	α-helix	trans	-62	-47.2	176.7	-165.4	178.5	9.3	0	0	111.5	L960 M967 A968 V981 V983	L960-Q964 WeakPolarHBondContact O-CB 3.44Å; L960-Q964 PolarHBondContact O-N 2.92Å; Q964-M967 PolarHBondContact O-N 2.94Å; Q964-A968 VanDerWaalsContact O-CB 3.28Å; Q964-A968 WeakPolarHBondContact O-CB 3.41Å; Q964-A968 PolarHBondContact O-N 3.34Å; Q964-V981 HydrophobicContact CG-CB 4.45Å; Q964-V981 HydrophobicContact CG-CG1 4.29Å; Q964-V981 PolarHBondContact NE2-O 3.5Å; Q964-V983 HydrophobicContact CB-CG2 3.51Å; Q964-V983 HydrophobicContact CG-CG2 3.92Å
965	R	85.6	Confident	80.4	Confident	161 Å²	161	77.7 Å²	77.7	61%	0.608	38%	0.376	S	S	*	.	H	α-helix	trans	-64.5	-40.6	176.5	-71.5	179.1	-164	125.7	12.2	111.9	E961 R962 A969	E961-R965 WeakPolarHBondContact O-CB 3.34Å; E961-R965 VanDerWaalsContact O-CG 3.31Å; E961-R965 WeakPolarHBondContact O-CG 3.47Å; E961-R965 PolarHBondContact O-N 3.22Å; E961-R965 IonicContact OE2-CZ 3.2Å; E961-R965 IonicContact OE2-NH1 3.17Å; E961-R965 IonicContact OE2-NH2 3.72Å; E961-R965 PolarHBondContact OE2-NH2 2.9Å; R962-R965 PolarHBondContact O-N 2.97Å; R965-A969 VanDerWaalsContact O-CB 3.28Å; R965-A969 WeakPolarHBondContact O-CB 3.39Å; R965-A969 PolarHBondContact O-N 3.28Å
966	S	84.4	Confident	81.5	Confident	45 Å²	45	72.9 Å²	72.9	32%	0.315	35%	0.346	S	S	.	.	H	α-helix	trans	-62.1	-47.7	177.6	-175.5	0	0	0	0	111.5	R962 E963 A969 L970	R962-S966 VanDerWaalsContact O-CB 3.31Å; R962-S966 WeakPolarHBondContact O-CB 3.29Å; R962-S966 PolarHBondContact O-N 3.4Å; E963-S966 PolarHBondContact O-N 2.88Å; S966-A969 WeakPolarHBondContact O-CB 3.32Å; S966-A969 PolarHBondContact O-N 3.07Å; S966-L970 PolarHBondContact O-N 3.24Å
967	M	85.3	Confident	82.5	Confident	6 Å²	6	77.7 Å²	77.7	3%	0.03	37%	0.368	C	S	.	.	H	α-helix	trans	-65.7	-43.4	178.1	-175.6	58.7	69.9	0	0	111.8	P90 W921 T952 E963 Q964 A969 L970 L971 V981	P90-M967 HydrophobicContact CB-CE 4.24Å; P90-M967 HydrophobicContact CG-CE 4.31Å; W921-M967 HydrophobicContact CE3-CE 3.76Å; W921-M967 HydrophobicContact CE3-SD 3.77Å; W921-M967 HydrophobicContact CZ3-CE 3.83Å; W921-M967 HydrophobicContact CZ3-SD 3.64Å; T952-M967 HydrophobicContact CG2-CB 4.36Å; T952-M967 HydrophobicContact CG2-CE 4.2Å; T952-M967 HydrophobicContact CG2-CG 4.21Å; E963-M967 WeakPolarHBondContact O-CB 3.32Å; E963-M967 PolarHBondContact O-N 3.38Å; Q964-M967 PolarHBondContact O-N 2.94Å; M967-A969 VanDerWaalsContact C-N 3.32Å; M967-A969 PolarHBondContact O-N 3.34Å; M967-L970 WeakPolarHBondContact O-CB 3.13Å; M967-L970 PolarHBondContact O-N 3.08Å; M967-L970 VanDerWaalsContact O-N 3.15Å; M967-L970 HydrophobicContact SD-CD2 4.4Å; M967-L971 HydrophobicContact CG-CD1 4.24Å; M967-L971 HydrophobicContact CG-CG 4.5Å; M967-L971 WeakPolarHBondContact O-CG 3.25Å; M967-L971 PolarHBondContact O-N 3.49Å; M967-L971 HydrophobicContact SD-CG 4.36Å; M967-V981 HydrophobicContact CB-CG1 3.98Å; M967-V981 HydrophobicContact CG-CG1 3.72Å
968	A	86.3	Confident	83.6	Confident	22 Å²	22	73 Å²	73	18%	0.182	35%	0.351	C	S	.	.	H	α-helix	trans	-59.5	-42	173.3	0	0	0	0	0	112.2	Q964 L970 L971 S972 Y978	Q964-A968 VanDerWaalsContact O-CB 3.28Å; Q964-A968 WeakPolarHBondContact O-CB 3.41Å; Q964-A968 PolarHBondContact O-N 3.34Å; A968-L970 VanDerWaalsContact C-N 3.34Å; A968-L970 PolarHBondContact O-N 2.85Å; A968-L971 PolarHBondContact O-N 2.73Å; A968-S972 WeakPolarHBondContact O-CB 2.99Å; A968-S972 PolarHBondContact O-N 3.17Å; A968-S972 PolarHBondContact O-OG 2.97Å; A968-Y978 WeakPolarHBondContact CB-OH 3.24Å
969	A	85.9	Confident	84.6	Confident	41 Å²	41	71 Å²	71	34%	0.339	34%	0.338	S	S	.	.	H	α-helix	trans	-64.1	-36.8	174.2	0	0	0	0	0	112.3	R965 S966 M967 S972 R973	R965-A969 VanDerWaalsContact O-CB 3.28Å; R965-A969 WeakPolarHBondContact O-CB 3.39Å; R965-A969 PolarHBondContact O-N 3.28Å; S966-A969 WeakPolarHBondContact O-CB 3.32Å; S966-A969 PolarHBondContact O-N 3.07Å; M967-A969 VanDerWaalsContact C-N 3.32Å; M967-A969 PolarHBondContact O-N 3.34Å; A969-S972 WeakPolarHBondContact CA-OG 3.36Å; A969-S972 PolarHBondContact O-OG 3.48Å; A969-R973 WeakPolarHBondContact O-CB 3.32Å; A969-R973 WeakPolarHBondContact O-CG 3.49Å; A969-R973 PolarHBondContact O-N 3.03Å; A969-R973 VanDerWaalsContact O-N 3.12Å
970	L	85.9	Confident	85.5	Confident	2 Å²	2	71.5 Å²	71.5	1%	0.01	34%	0.342	C	S	.	.	H	α-helix	trans	-68	-48.4	175.6	-178.9	56.4	0	0	0	111.9	V92 Y95 W921 S966 M967 A968 S972 R973 F974 F1103	V92-L970 HydrophobicContact CB-CD1 4.33Å; V92-L970 HydrophobicContact CG2-CB 4.03Å; V92-L970 HydrophobicContact CG2-CD1 3.99Å; V92-L970 HydrophobicContact CG2-CG 4.43Å; Y95-L970 HydrophobicContact CD2-CD1 4.44Å; W921-L970 HydrophobicContact CH2-CD2 4.1Å; W921-L970 HydrophobicContact CZ3-CD2 4.01Å; S966-L970 PolarHBondContact O-N 3.24Å; M967-L970 WeakPolarHBondContact O-CB 3.13Å; M967-L970 PolarHBondContact O-N 3.08Å; M967-L970 VanDerWaalsContact O-N 3.15Å; M967-L970 HydrophobicContact SD-CD2 4.4Å; A968-L970 VanDerWaalsContact C-N 3.34Å; A968-L970 PolarHBondContact O-N 2.85Å; L970-S972 PolarHBondContact O-N 3.3Å; L970-R973 WeakPolarHBondContact O-CB 3.39Å; L970-R973 PolarHBondContact O-N 3.26Å; L970-F974 HydrophobicContact CD1-CD2 4.15Å; L970-F974 HydrophobicContact CD1-CE1 4.15Å; L970-F974 HydrophobicContact CD1-CE2 3.46Å; L970-F974 VanDerWaalsContact CD1-CE2 3.46Å; L970-F974 HydrophobicContact CD1-CZ 3.45Å; L970-F974 VanDerWaalsContact CD1-CZ 3.45Å; L970-F974 HydrophobicContact CD2-CE2 4.12Å; L970-F974 HydrophobicContact CG-CD2 4.09Å; L970-F974 HydrophobicContact CG-CE2 3.53Å; L970-F974 HydrophobicContact CG-CZ 4.06Å; L970-F974 WeakPolarHBondContact O-CD2 3.49Å; L970-F974 PolarHBondContact O-N 2.94Å; L970-F1103 HydrophobicContact CD1-CE1 4.45Å
971	L	87.9	Confident	86.1	Confident	1 Å²	1	69.6 Å²	69.6	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-63.4	-41.2	179.3	-67.5	173.3	0	0	0	112.3	L930 V950 M967 A968 R973 F974 R975 L976 Y978 V981	L930-L971 HydrophobicContact CD1-CD2 3.56Å; L930-L971 HydrophobicContact CD2-CD2 3.95Å; L930-L971 HydrophobicContact CG-CD2 4.42Å; V950-L971 HydrophobicContact CB-CD1 4.04Å; V950-L971 HydrophobicContact CG1-CD1 4.4Å; V950-L971 HydrophobicContact CG2-CD1 3.7Å; V950-L971 HydrophobicContact CG2-CD2 4.31Å; M967-L971 HydrophobicContact CG-CD1 4.24Å; M967-L971 HydrophobicContact CG-CG 4.5Å; M967-L971 WeakPolarHBondContact O-CG 3.25Å; M967-L971 PolarHBondContact O-N 3.49Å; M967-L971 HydrophobicContact SD-CG 4.36Å; A968-L971 PolarHBondContact O-N 2.73Å; L971-R973 VanDerWaalsContact C-N 3.34Å; L971-R973 PolarHBondContact O-N 3.2Å; L971-F974 CarbonylContact O-C 3.52Å; L971-F974 PolarHBondContact O-N 2.87Å; L971-R975 PolarHBondContact O-N 3.01Å; L971-L976 HydrophobicContact CD2-CD1 4.22Å; L971-L976 PolarHBondContact O-N 2.58Å; L971-L976 VanDerWaalsContact O-N 3.15Å; L971-Y978 HydrophobicContact CB-CD1 3.59Å; L971-Y978 HydrophobicContact CB-CE1 3.55Å; L971-Y978 HydrophobicContact CD1-CD1 3.8Å; L971-Y978 HydrophobicContact CD1-CD2 4.4Å; L971-Y978 HydrophobicContact CD1-CE1 4.13Å; L971-Y978 HydrophobicContact CD1-CG 3.96Å; L971-Y978 HydrophobicContact CG-CD1 4.32Å; L971-V981 HydrophobicContact CD1-CG2 3.56Å
972	S	87	Confident	86.7	Confident	66 Å²	66	65.5 Å²	65.5	46%	0.462	31%	0.314	S	S	.	.	H	α-helix	trans	-64.2	-36.9	174.3	56.8	0	0	0	0	112.5	A968 A969 L970 R975	A968-S972 WeakPolarHBondContact O-CB 2.99Å; A968-S972 PolarHBondContact O-N 3.17Å; A968-S972 PolarHBondContact O-OG 2.97Å; A969-S972 WeakPolarHBondContact CA-OG 3.36Å; A969-S972 PolarHBondContact O-OG 3.48Å; L970-S972 PolarHBondContact O-N 3.3Å; S972-R975 WeakPolarHBondContact O-CA 3.33Å; S972-R975 PolarHBondContact O-N 3.02Å
973	R	85.8	Confident	86.9	Confident	114 Å²	114	58.8 Å²	58.8	43%	0.43	29%	0.29	S	S	.	.	H	α-helix	trans	-63.8	-40.2	172.2	-77.2	173.5	-177.2	-141.5	1.2	112.4	A969 L970 L971 R975 F1103	A969-R973 WeakPolarHBondContact O-CB 3.32Å; A969-R973 WeakPolarHBondContact O-CG 3.49Å; A969-R973 PolarHBondContact O-N 3.03Å; A969-R973 VanDerWaalsContact O-N 3.12Å; L970-R973 WeakPolarHBondContact O-CB 3.39Å; L970-R973 PolarHBondContact O-N 3.26Å; L971-R973 VanDerWaalsContact C-N 3.34Å; L971-R973 PolarHBondContact O-N 3.2Å; R973-R975 PolarHBondContact O-N 2.67Å; R973-F1103 HydrophobicContact CB-CB 3.88Å; R973-F1103 HydrophobicContact CB-CD1 4.05Å; R973-F1103 HydrophobicContact CB-CG 3.94Å; R973-F1103 VanDerWaalsContact O-CB 3.26Å; R973-F1103 WeakPolarHBondContact O-CB 3.29Å
974	F	87.9	Confident	87.1	Confident	18 Å²	18	57.2 Å²	57.2	8%	0.079	28%	0.283	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-8.7	171.6	-64.1	-39.3	0	0	0	113.6	Y95 L930 L970 L971 L976 L1101 F1103	Y95-F974 AromaticContact CD1-CE1 4Å; Y95-F974 HydrophobicContact CD1-CE1 4Å; Y95-F974 AromaticContact CD1-CZ 3.5Å; Y95-F974 HydrophobicContact CD1-CZ 3.5Å; Y95-F974 AromaticContact CD2-CZ 3.9Å; Y95-F974 HydrophobicContact CD2-CZ 3.9Å; Y95-F974 AromaticContact CE1-CZ 3.92Å; Y95-F974 HydrophobicContact CE1-CZ 3.92Å; Y95-F974 HydrophobicContact CE2-CZ 4.33Å; Y95-F974 HydrophobicContact CG-CE1 4.07Å; Y95-F974 AromaticContact CG-CZ 3.49Å; Y95-F974 HydrophobicContact CG-CZ 3.49Å; Y95-F974 VanDerWaalsContact CG-CZ 3.49Å; L930-F974 HydrophobicContact CD1-CD2 4.43Å; L930-F974 HydrophobicContact CD1-CE2 4.45Å; L970-F974 HydrophobicContact CD1-CD2 4.15Å; L970-F974 HydrophobicContact CD1-CE1 4.15Å; L970-F974 HydrophobicContact CD1-CE2 3.46Å; L970-F974 VanDerWaalsContact CD1-CE2 3.46Å; L970-F974 HydrophobicContact CD1-CZ 3.45Å; L970-F974 VanDerWaalsContact CD1-CZ 3.45Å; L970-F974 HydrophobicContact CD2-CE2 4.12Å; L970-F974 HydrophobicContact CG-CD2 4.09Å; L970-F974 HydrophobicContact CG-CE2 3.53Å; L970-F974 HydrophobicContact CG-CZ 4.06Å; L970-F974 WeakPolarHBondContact O-CD2 3.49Å; L970-F974 PolarHBondContact O-N 2.94Å; L971-F974 CarbonylContact O-C 3.52Å; L971-F974 PolarHBondContact O-N 2.87Å; F974-L976 HydrophobicContact CB-CD1 3.96Å; F974-L976 HydrophobicContact CB-CG 3.79Å; F974-L976 HydrophobicContact CD2-CD1 4.37Å; F974-L976 PolarHBondContact O-N 2.72Å; F974-L1101 HydrophobicContact CD1-CB 4Å; F974-L1101 HydrophobicContact CD2-CD1 4.1Å; F974-L1101 HydrophobicContact CE1-CB 3.81Å; F974-L1101 HydrophobicContact CE2-CB 4.49Å; F974-L1101 HydrophobicContact CE2-CD1 4.21Å; F974-L1101 HydrophobicContact CG-CB 4.44Å; F974-L1101 HydrophobicContact CG-CD1 4.38Å; F974-L1101 HydrophobicContact CZ-CB 4.07Å; F974-F1103 HydrophobicContact CD1-CB 4.41Å; F974-F1103 HydrophobicContact CD1-CD1 4.06Å; F974-F1103 AromaticContact CE1-CD1 3.74Å; F974-F1103 HydrophobicContact CE1-CD1 3.74Å; F974-F1103 HydrophobicContact CE1-CE1 4.41Å
975	R	88	Confident	86.5	Confident	210 Å²	210	55.8 Å²	55.8	79%	0.792	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	36.5	-177.8	-51.5	174.9	-173.8	167.9	0.7	111.9	L971 S972 R973	L971-R975 PolarHBondContact O-N 3.01Å; S972-R975 WeakPolarHBondContact O-CA 3.33Å; S972-R975 PolarHBondContact O-N 3.02Å; R973-R975 PolarHBondContact O-N 2.67Å
976	L	86.5	Confident	85.7	Confident	12 Å²	12	50.9 Å²	50.9	6%	0.063	27%	0.267	C	S	.	.			trans	-89.1	121.1	174.4	-61.8	176.8	0	0	0	108.4	L930 H934 L971 F974 Y978 L1101	L930-L976 HydrophobicContact CB-CD1 4.01Å; L930-L976 HydrophobicContact CD1-CD1 4.22Å; H934-L976 HydrophobicContact CB-CD2 3.83Å; H934-L976 WeakPolarHBondContact ND1-CD2 3.38Å; L971-L976 HydrophobicContact CD2-CD1 4.22Å; L971-L976 PolarHBondContact O-N 2.58Å; L971-L976 VanDerWaalsContact O-N 3.15Å; F974-L976 HydrophobicContact CB-CD1 3.96Å; F974-L976 HydrophobicContact CB-CG 3.79Å; F974-L976 HydrophobicContact CD2-CD1 4.37Å; F974-L976 PolarHBondContact O-N 2.72Å; L976-Y978 VanDerWaalsContact O-CD1 3.31Å; L976-Y978 WeakPolarHBondContact O-CD1 3.32Å; L976-Y978 PolarHBondContact O-N 3.42Å; L976-L1101 HydrophobicContact CD1-CD1 4.2Å
977	D	86.8	Confident	85.4	Confident	145 Å²	145	49.1 Å²	49.1	78%	0.775	25%	0.254	S	S	*	.			trans	-68.7	115.1	172.1	-68	-34.6	0	0	0	109.5
978	Y	89.8	Confident	85	Confident	80 Å²	80	52.4 Å²	52.4	31%	0.314	27%	0.274	S	S	.	.			trans	-123.1	148.3	174.3	65.7	-89.4	0	0	0	109.6	L948 A968 L971 L976 V981	L948-Y978 CarbonylContact O-C 3.55Å; L948-Y978 WeakPolarHBondContact O-CA 3.42Å; L948-Y978 WeakPolarHBondContact O-CB 3.02Å; A968-Y978 WeakPolarHBondContact CB-OH 3.24Å; L971-Y978 HydrophobicContact CB-CD1 3.59Å; L971-Y978 HydrophobicContact CB-CE1 3.55Å; L971-Y978 HydrophobicContact CD1-CD1 3.8Å; L971-Y978 HydrophobicContact CD1-CD2 4.4Å; L971-Y978 HydrophobicContact CD1-CE1 4.13Å; L971-Y978 HydrophobicContact CD1-CG 3.96Å; L971-Y978 HydrophobicContact CG-CD1 4.32Å; L976-Y978 VanDerWaalsContact O-CD1 3.31Å; L976-Y978 WeakPolarHBondContact O-CD1 3.32Å; L976-Y978 PolarHBondContact O-N 3.42Å; Y978-V981 HydrophobicContact CD2-CG2 3.66Å; Y978-V981 HydrophobicContact CE2-CG2 3.55Å; Y978-V981 HydrophobicContact CG-CG2 4.41Å
979	S	91.3	Very high	84.8	Confident	62 Å²	62	56.6 Å²	56.6	43%	0.434	29%	0.288	S	S	.	.	S	Bend	trans	-87.6	-33.6	176.9	54	0	0	0	0	112.9	L948 R949	L948-S979 PolarHBondContact O-N 3.44Å; L948-S979 PolarHBondContact O-OG 2.99Å; L948-S979 VanDerWaalsContact O-OG 3.13Å; R949-S979 VanDerWaalsContact CG-OG 3.29Å; R949-S979 WeakPolarHBondContact CG-OG 3.37Å
980	D	90.7	Very high	84.9	Confident	75 Å²	75	61.8 Å²	61.8	40%	0.401	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.2	155.2	-179.5	-158.4	1.1	0	0	0	111.5	R949 V950	R949-D980 WeakPolarHBondContact CA-O 3.43Å; R949-D980 HydrophobicContact CG-CB 4.42Å; V950-D980 PolarHBondContact N-O 3.49Å
981	V	89.7	Confident	85.1	Confident	4 Å²	4	62 Å²	62	2%	0.024	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	115	172.1	178.7	0	0	0	0	108.4	V950 Q964 M967 L971 Y978	V950-V981 CarbonylContact O-C 3.6Å; V950-V981 WeakPolarHBondContact O-CA 3.25Å; Q964-V981 HydrophobicContact CG-CB 4.45Å; Q964-V981 HydrophobicContact CG-CG1 4.29Å; Q964-V981 PolarHBondContact NE2-O 3.5Å; M967-V981 HydrophobicContact CB-CG1 3.98Å; M967-V981 HydrophobicContact CG-CG1 3.72Å; L971-V981 HydrophobicContact CD1-CG2 3.56Å; Y978-V981 HydrophobicContact CD2-CG2 3.66Å; Y978-V981 HydrophobicContact CE2-CG2 3.55Å; Y978-V981 HydrophobicContact CG-CG2 4.41Å
982	I	90	Very high	85.2	Confident	36 Å²	36	64.2 Å²	64.2	19%	0.185	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	122.8	-176.6	-61.9	162.7	0	0	0	108.5	V950 F951 T952	V950-I982 PolarHBondContact O-N 3.14Å; F951-I982 VanDerWaalsContact CA-O 3.29Å; F951-I982 WeakPolarHBondContact CA-O 3.45Å; F951-I982 HydrophobicContact CD1-CB 3.71Å; F951-I982 HydrophobicContact CD1-CD1 4.17Å; F951-I982 HydrophobicContact CD1-CG2 3.78Å; F951-I982 HydrophobicContact CE1-CB 3.83Å; F951-I982 HydrophobicContact CE1-CD1 3.4Å; F951-I982 VanDerWaalsContact CE1-CD1 3.4Å; F951-I982 HydrophobicContact CE1-CG1 4.21Å; F951-I982 HydrophobicContact CE1-CG2 3.85Å; F951-I982 HydrophobicContact CE2-CD1 4.27Å; F951-I982 HydrophobicContact CG-CB 4.37Å; F951-I982 HydrophobicContact CZ-CD1 3.47Å; F951-I982 VanDerWaalsContact CZ-CD1 3.47Å; T952-I982 PolarHBondContact N-O 2.98Å
983	V	86	Confident	85.5	Confident	16 Å²	16	65.3 Å²	65.3	10%	0.097	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	120.3	178.9	-170.4	0	0	0	0	109.4	T952 A954 L960 E963 Q964 P985	T952-V983 HydrophobicContact CG2-CB 4.39Å; T952-V983 HydrophobicContact CG2-CG1 4.25Å; T952-V983 HydrophobicContact CG2-CG2 3.81Å; T952-V983 WeakPolarHBondContact O-CA 3.29Å; A954-V983 HydrophobicContact CB-CG1 3.46Å; A954-V983 VanDerWaalsContact CB-CG1 3.46Å; L960-V983 HydrophobicContact CD2-CB 4.02Å; L960-V983 HydrophobicContact CD2-CG1 3.69Å; E963-V983 HydrophobicContact CB-CG1 4.19Å; Q964-V983 HydrophobicContact CB-CG2 3.51Å; Q964-V983 HydrophobicContact CG-CG2 3.92Å; V983-P985 WeakPolarHBondContact O-CD 3.49Å
984	I	82.9	Confident	85.8	Confident	3 Å²	3	63.9 Å²	63.9	2%	0.015	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	119.2	-177.5	-65.1	153.1	0	0	0	109.1	Y920 L922 F951 T952 A954 D986 L1047	Y920-I984 HydrophobicContact CD1-CD1 4.3Å; Y920-I984 HydrophobicContact CE1-CD1 4.23Å; L922-I984 HydrophobicContact CD2-CD1 4.27Å; F951-I984 HydrophobicContact CB-CD1 4.31Å; T952-I984 PolarHBondContact O-N 2.99Å; A954-I984 PolarHBondContact N-O 3.4Å; I984-D986 PolarHBondContact O-N 3.22Å; I984-D986 VanDerWaalsContact O-N 3.08Å; I984-L1047 HydrophobicContact CB-CD1 4.47Å; I984-L1047 HydrophobicContact CD1-CD1 3.82Å; I984-L1047 HydrophobicContact CG1-CD1 4.11Å; I984-L1047 HydrophobicContact CG1-CD2 4.46Å; I984-L1047 HydrophobicContact CG2-CD1 3.57Å; I984-L1047 HydrophobicContact CG2-CD2 4.17Å
985	P	72.2	Confident	86.1	Confident	53 Å²	53	63.7 Å²	63.7	34%	0.344	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	98.9	174.7	29.1	-31.5	0	0	0	109.9	R957 L960 V983	R957-P985 HydrophobicContact CG-CB 3.96Å; L960-P985 HydrophobicContact CD1-CB 3.91Å; L960-P985 HydrophobicContact CD2-CB 3.92Å; L960-P985 HydrophobicContact CG-CB 4.45Å; V983-P985 WeakPolarHBondContact O-CD 3.49Å
986	D	69.9	Low	86.3	Confident	57 Å²	57	54.1 Å²	54.1	31%	0.305	29%	0.288	S	S	.	.			trans	67.7	91.7	171.6	-167	4.4	0	0	0	115.6	I984 T988 K989	I984-D986 PolarHBondContact O-N 3.22Å; I984-D986 VanDerWaalsContact O-N 3.08Å; D986-T988 PolarHBondContact O-N 3.27Å; D986-T988 WeakPolarHBondContact OD1-CA 3.4Å; D986-T988 VanDerWaalsContact OD1-CB 3.29Å; D986-T988 WeakPolarHBondContact OD1-CB 3.44Å; D986-T988 PolarHBondContact OD1-N 3.19Å; D986-T988 PolarHBondContact OD1-OG1 2.9Å; D986-K989 WeakPolarHBondContact O-CB 3.44Å; D986-K989 PolarHBondContact O-N 3.26Å
987	L	77.3	Confident	86.6	Confident	8 Å²	8	59.4 Å²	59.4	4%	0.042	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-15.9	171.8	-164.3	68	0	0	0	112.9	L922 V953 K989 R1040 R1043 I1044 L1047	L922-L987 HydrophobicContact CD1-CD2 4.48Å; V953-L987 HydrophobicContact CG1-CB 3.89Å; V953-L987 HydrophobicContact CG2-CB 4.44Å; V953-L987 HydrophobicContact CG2-CD2 4.04Å; L987-K989 VanDerWaalsContact C-N 3.3Å; L987-R1040 HydrophobicContact CG-CB 4.44Å; L987-R1040 HydrophobicContact CG-CG 4.41Å; L987-R1043 HydrophobicContact CD1-CG 4.46Å; L987-I1044 HydrophobicContact CD1-CG1 3.79Å; L987-L1047 HydrophobicContact CD1-CD1 3.99Å
988	T	76.2	Confident	87	Confident	76 Å²	76	55.7 Å²	55.7	47%	0.466	29%	0.291	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-4.6	-179.8	75.6	0	0	0	0	113	V83 D986 R990	V83-T988 HydrophobicContact CG1-CG2 4.08Å; D986-T988 PolarHBondContact O-N 3.27Å; D986-T988 WeakPolarHBondContact OD1-CA 3.4Å; D986-T988 VanDerWaalsContact OD1-CB 3.29Å; D986-T988 WeakPolarHBondContact OD1-CB 3.44Å; D986-T988 PolarHBondContact OD1-N 3.19Å; D986-T988 PolarHBondContact OD1-OG1 2.9Å; T988-R990 PolarHBondContact O-N 3.02Å
989	K	82.8	Confident	87.1	Confident	109 Å²	109	51.9 Å²	51.9	47%	0.474	28%	0.276	S	S	.	.	S	Bend	trans	-53	128.6	171.8	-175.7	-172.6	173.4	-166.8	0	109.8	D986 L987	D986-K989 WeakPolarHBondContact O-CB 3.44Å; D986-K989 PolarHBondContact O-N 3.26Å; L987-K989 VanDerWaalsContact C-N 3.3Å
990	R	87.5	Confident	87.1	Confident	151 Å²	151	52.5 Å²	52.5	57%	0.57	27%	0.272	S	S	*	.	P	Polyproline II helix	trans	-56.1	130	175.1	-174.5	178.5	169.7	175.2	-4	110.2	T988 N993 I996 Y1039	T988-R990 PolarHBondContact O-N 3.02Å; R990-N993 PolarHBondContact NH2-OD1 3.05Å; R990-I996 HydrophobicContact CG-CD1 4.2Å; R990-Y1039 HydrophobicContact CG-CD2 4.26Å; R990-Y1039 HydrophobicContact CG-CE2 4.1Å
991	P	90	Very high	87.2	Confident	5 Å²	5	56.3 Å²	56.3	3%	0.032	29%	0.288	C	S	.	.	P	Polyproline II helix	trans	-61.7	165	173.8	-18.7	28.4	0	0	0	112.6	I996 Y1039 L1042 R1043	P991-I996 HydrophobicContact CB-CD1 4.39Å; P991-I996 HydrophobicContact CB-CG1 4.13Å; P991-I996 HydrophobicContact CG-CG1 4.46Å; P991-Y1039 HydrophobicContact CG-CG 4.32Å; P991-Y1039 VanDerWaalsContact CG-O 3.25Å; P991-Y1039 WeakPolarHBondContact CG-O 3.42Å; P991-L1042 HydrophobicContact CB-CB 3.99Å; P991-L1042 HydrophobicContact CG-CB 3.56Å; P991-L1042 HydrophobicContact CG-CD1 4.41Å; P991-R1043 HydrophobicContact CG-CB 4.5Å
992	S	91.2	Very high	87.2	Confident	48 Å²	48	57.5 Å²	57.5	34%	0.336	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-55.6	140.5	169.9	57.1	0	0	0	0	111.4	S994 L995 I996 E1046	S992-S994 PolarHBondContact O-N 2.73Å; S992-S994 PolarHBondContact OG-OG 2.76Å; S992-L995 PolarHBondContact O-N 3.13Å; S992-L995 VanDerWaalsContact O-N 3.11Å; S992-L995 VanDerWaalsContact OG-CB 3.29Å; S992-L995 WeakPolarHBondContact OG-CB 3.42Å; S992-I996 WeakPolarHBondContact O-CG1 3.27Å; S992-I996 PolarHBondContact O-N 2.86Å; S992-I996 VanDerWaalsContact O-N 3.13Å; S992-E1046 WeakPolarHBondContact CB-OE1 3.48Å; S992-E1046 PolarHBondContact N-OE1 3.3Å; S992-E1046 PolarHBondContact OG-OE1 3.28Å
993	N	92.5	Very high	87.3	Confident	90 Å²	90	55.8 Å²	55.8	48%	0.481	28%	0.284	S	S	.	.	H	α-helix	trans	-60.3	-36	-179.8	-71.6	-28.9	0	0	0	111.6	R990 L995 I996 E997	R990-N993 PolarHBondContact NH2-OD1 3.05Å; N993-L995 VanDerWaalsContact C-N 3.33Å; N993-L995 PolarHBondContact O-N 2.75Å; N993-I996 PolarHBondContact O-N 2.85Å; N993-E997 WeakPolarHBondContact O-CG 3.36Å; N993-E997 PolarHBondContact O-N 3.48Å
994	S	93.5	Very high	87.4	Confident	83 Å²	83	62.5 Å²	62.5	58%	0.58	31%	0.312	S	S	*	.	H	α-helix	trans	-58.3	-42	174.7	51.4	0	0	0	0	112.7	S992 E997 E998	S992-S994 PolarHBondContact O-N 2.73Å; S992-S994 PolarHBondContact OG-OG 2.76Å; S994-E997 PolarHBondContact O-N 2.65Å; S994-E998 WeakPolarHBondContact O-CB 3.13Å; S994-E998 PolarHBondContact O-N 3.09Å
995	L	92.5	Very high	87.4	Confident	15 Å²	15	66.3 Å²	66.3	8%	0.079	34%	0.339	C	S	.	.	H	α-helix	trans	-73.2	-33	179.5	-168.5	70.8	0	0	0	112	S992 N993 F999 L1042 K1045 E1046 F1081	S992-L995 PolarHBondContact O-N 3.13Å; S992-L995 VanDerWaalsContact O-N 3.11Å; S992-L995 VanDerWaalsContact OG-CB 3.29Å; S992-L995 WeakPolarHBondContact OG-CB 3.42Å; N993-L995 VanDerWaalsContact C-N 3.33Å; N993-L995 PolarHBondContact O-N 2.75Å; L995-F999 WeakPolarHBondContact O-CB 3.05Å; L995-F999 PolarHBondContact O-N 3.18Å; L995-L1042 HydrophobicContact CD2-CB 4.05Å; L995-L1042 VanDerWaalsContact CD2-O 3.26Å; L995-L1042 WeakPolarHBondContact CD2-O 3.29Å; L995-K1045 HydrophobicContact CD1-CG 4.29Å; L995-K1045 HydrophobicContact CD2-CB 4.37Å; L995-K1045 HydrophobicContact CD2-CG 4.23Å; L995-E1046 HydrophobicContact CD2-CG 3.51Å; L995-F1081 HydrophobicContact CD1-CE1 3.61Å; L995-F1081 HydrophobicContact CD1-CZ 3.79Å; L995-F1081 HydrophobicContact CG-CE1 3.96Å; L995-F1081 HydrophobicContact CG-CZ 4.37Å
996	I	93.1	Very high	88	Confident	8 Å²	8	65 Å²	65	4%	0.041	33%	0.327	C	S	.	.	H	α-helix	trans	-64.9	-44.2	174.1	-64.6	168.2	0	0	0	110.1	R990 P991 S992 N993 F999 Q1000 Y1039 L1042	R990-I996 HydrophobicContact CG-CD1 4.2Å; P991-I996 HydrophobicContact CB-CD1 4.39Å; P991-I996 HydrophobicContact CB-CG1 4.13Å; P991-I996 HydrophobicContact CG-CG1 4.46Å; S992-I996 WeakPolarHBondContact O-CG1 3.27Å; S992-I996 PolarHBondContact O-N 2.86Å; S992-I996 VanDerWaalsContact O-N 3.13Å; N993-I996 PolarHBondContact O-N 2.85Å; I996-F999 PolarHBondContact O-N 3.29Å; I996-Q1000 VanDerWaalsContact O-CG 3.3Å; I996-Q1000 WeakPolarHBondContact O-CG 3.33Å; I996-Q1000 PolarHBondContact O-N 3.42Å; I996-Y1039 HydrophobicContact CD1-CE1 4.03Å; I996-Y1039 HydrophobicContact CD1-CE2 4.33Å; I996-Y1039 HydrophobicContact CG1-CE1 4.12Å; I996-Y1039 HydrophobicContact CG2-CE1 4.23Å; I996-L1042 HydrophobicContact CG1-CD1 4.16Å
997	E	93.6	Very high	88.7	Confident	123 Å²	123	66.6 Å²	66.6	58%	0.575	33%	0.329	S	S	*	.	H	α-helix	trans	-63.1	-47.1	176	-73.2	167.7	-164.4	0	0	111.1	N993 S994 F999 Q1000 E1001	N993-E997 WeakPolarHBondContact O-CG 3.36Å; N993-E997 PolarHBondContact O-N 3.48Å; S994-E997 PolarHBondContact O-N 2.65Å; E997-F999 VanDerWaalsContact C-N 3.29Å; E997-F999 PolarHBondContact O-N 2.9Å; E997-Q1000 PolarHBondContact O-N 2.99Å; E997-Q1000 VanDerWaalsContact O-N 3.15Å; E997-E1001 PolarHBondContact O-N 3.28Å
998	E	93.5	Very high	88.6	Confident	68 Å²	68	68.3 Å²	68.3	32%	0.318	34%	0.344	S	S	.	.	H	α-helix	trans	-58.7	-41.5	175.8	-168.9	-166.9	162.4	0	0	111.3	S994 E1001 F1002 F1081 K1084	S994-E998 WeakPolarHBondContact O-CB 3.13Å; S994-E998 PolarHBondContact O-N 3.09Å; E998-E1001 PolarHBondContact O-N 3.35Å; E998-F1002 WeakPolarHBondContact O-CB 3.33Å; E998-F1002 PolarHBondContact O-N 3.36Å; E998-F1081 HydrophobicContact CB-CE2 4.46Å; E998-F1081 HydrophobicContact CB-CZ 4.11Å; E998-F1081 HydrophobicContact CG-CE2 3.97Å; E998-F1081 HydrophobicContact CG-CZ 3.99Å; E998-K1084 IonicContact OE1-NZ 2.77Å; E998-K1084 PolarHBondContact OE1-NZ 3.2Å
999	F	93.7	Very high	87.9	Confident	0 Å²	0	72.6 Å²	72.6	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-67.3	-40.3	177.2	-175	-110.2	0	0	0	112.5	L995 I996 E997 E1001 F1002 I1003 Y1031 T1038 L1042 L1074 S1077 W1078 F1081	L995-F999 WeakPolarHBondContact O-CB 3.05Å; L995-F999 PolarHBondContact O-N 3.18Å; I996-F999 PolarHBondContact O-N 3.29Å; E997-F999 VanDerWaalsContact C-N 3.29Å; E997-F999 PolarHBondContact O-N 2.9Å; F999-E1001 VanDerWaalsContact C-N 3.33Å; F999-F1002 HydrophobicContact CD2-CD1 4.48Å; F999-F1002 HydrophobicContact CE2-CD1 4.46Å; F999-F1002 WeakPolarHBondContact O-CB 3.45Å; F999-F1002 PolarHBondContact O-N 2.83Å; F999-I1003 HydrophobicContact CD1-CD1 4.34Å; F999-I1003 HydrophobicContact CD1-CG2 4.47Å; F999-I1003 HydrophobicContact CD2-CG2 4.29Å; F999-I1003 HydrophobicContact CE1-CD1 3.97Å; F999-I1003 HydrophobicContact CE1-CG2 3.95Å; F999-I1003 HydrophobicContact CE2-CG2 3.76Å; F999-I1003 HydrophobicContact CZ-CG2 3.56Å; F999-I1003 WeakPolarHBondContact O-CG1 3.47Å; F999-I1003 PolarHBondContact O-N 3.28Å; F999-Y1031 HydrophobicContact CE1-CE2 4.06Å; F999-T1038 HydrophobicContact CD1-CG2 3.76Å; F999-T1038 HydrophobicContact CE1-CG2 3.32Å; F999-T1038 HydrophobicContact CZ-CG2 4.11Å; F999-L1042 HydrophobicContact CB-CD1 3.98Å; F999-L1042 HydrophobicContact CB-CD2 3.73Å; F999-L1042 HydrophobicContact CD1-CD1 4.19Å; F999-L1042 HydrophobicContact CD1-CD2 4.24Å; F999-L1042 HydrophobicContact CD2-CD2 3.76Å; F999-L1042 HydrophobicContact CE2-CD2 4.44Å; F999-L1042 HydrophobicContact CG-CD1 4.16Å; F999-L1042 HydrophobicContact CG-CD2 3.63Å; F999-L1042 HydrophobicContact CG-CG 4.42Å; F999-L1074 HydrophobicContact CZ-CD1 4.38Å; F999-S1077 WeakPolarHBondContact CZ-OG 3.38Å; F999-W1078 AromaticContact CZ-CD1 3.68Å; F999-F1081 HydrophobicContact CB-CE1 4.07Å; F999-F1081 HydrophobicContact CB-CE2 4.23Å; F999-F1081 HydrophobicContact CB-CZ 3.91Å; F999-F1081 HydrophobicContact CD2-CB 3.91Å; F999-F1081 AromaticContact CD2-CD1 3.72Å; F999-F1081 HydrophobicContact CD2-CD1 3.72Å; F999-F1081 AromaticContact CD2-CD2 3.76Å; F999-F1081 HydrophobicContact CD2-CD2 3.76Å; F999-F1081 HydrophobicContact CD2-CE1 4.12Å; F999-F1081 HydrophobicContact CD2-CE2 4.14Å; F999-F1081 AromaticContact CD2-CG 3.52Å; F999-F1081 HydrophobicContact CD2-CG 3.52Å; F999-F1081 HydrophobicContact CD2-CZ 4.31Å; F999-F1081 HydrophobicContact CE2-CB 3.92Å; F999-F1081 HydrophobicContact CE2-CD1 4.45Å; F999-F1081 HydrophobicContact CE2-CD2 4.5Å; F999-F1081 HydrophobicContact CE2-CG 4.06Å
1000	Q	91.3	Very high	86.4	Confident	75 Å²	75	74.2 Å²	74.2	35%	0.35	38%	0.378	S	S	.	.	H	α-helix	trans	-63.1	-41	176.8	-76.2	-179.6	-4.3	0	0	111.8	I996 E997 I1003 F1004	I996-Q1000 VanDerWaalsContact O-CG 3.3Å; I996-Q1000 WeakPolarHBondContact O-CG 3.33Å; I996-Q1000 PolarHBondContact O-N 3.42Å; E997-Q1000 PolarHBondContact O-N 2.99Å; E997-Q1000 VanDerWaalsContact O-N 3.15Å; Q1000-I1003 WeakPolarHBondContact O-CG1 3.33Å; Q1000-F1004 PolarHBondContact O-N 2.72Å
1001	E	92	Very high	84.3	Confident	155 Å²	155	71.5 Å²	71.5	72%	0.724	38%	0.383	S	S	*	.	H	α-helix	trans	-63.8	-42.8	171.6	-173.6	178.2	-174.2	0	0	110.9	E997 E998 F999 I1003 F1004	E997-E1001 PolarHBondContact O-N 3.28Å; E998-E1001 PolarHBondContact O-N 3.35Å; F999-E1001 VanDerWaalsContact C-N 3.33Å; E1001-I1003 VanDerWaalsContact C-N 3.29Å; E1001-I1003 PolarHBondContact O-N 3.41Å; E1001-F1004 WeakPolarHBondContact O-CB 3.22Å; E1001-F1004 PolarHBondContact O-N 3.29Å; E1001-F1004 VanDerWaalsContact O-N 3.12Å
1002	F	90.5	Very high	82	Confident	28 Å²	28	74.5 Å²	74.5	12%	0.123	41%	0.407	C	S	.	.	H	α-helix	trans	-61.3	-34.3	-178.7	-176.6	-94	0	0	0	114	W746 K747 E998 F999 D1080 F1081 K1084	W746-F1002 HydrophobicContact CZ2-CE1 4.07Å; W746-F1002 HydrophobicContact CZ2-CZ 4.4Å; K747-F1002 PolarHBondContact NZ-O 3.31Å; K747-F1002 VanDerWaalsContact NZ-O 3.17Å; E998-F1002 WeakPolarHBondContact O-CB 3.33Å; E998-F1002 PolarHBondContact O-N 3.36Å; F999-F1002 HydrophobicContact CD2-CD1 4.48Å; F999-F1002 HydrophobicContact CE2-CD1 4.46Å; F999-F1002 WeakPolarHBondContact O-CB 3.45Å; F999-F1002 PolarHBondContact O-N 2.83Å; F1002-D1080 HydrophobicContact CE1-CB 4.41Å; F1002-D1080 HydrophobicContact CZ-CB 4.08Å; F1002-D1080 WeakPolarHBondContact CZ-OD2 3.4Å; F1002-F1081 HydrophobicContact CB-CD2 3.92Å; F1002-F1081 HydrophobicContact CB-CE2 3.94Å; F1002-F1081 HydrophobicContact CD1-CB 4.34Å; F1002-F1081 AromaticContact CD1-CD2 3.78Å; F1002-F1081 HydrophobicContact CD1-CD2 3.78Å; F1002-F1081 HydrophobicContact CD1-CG 4.49Å; F1002-F1081 AromaticContact CD2-CD2 3.81Å; F1002-F1081 HydrophobicContact CD2-CD2 3.81Å; F1002-F1081 HydrophobicContact CD2-CE2 4.26Å; F1002-F1081 HydrophobicContact CE1-CB 4.1Å; F1002-F1081 HydrophobicContact CE1-CD2 4.16Å; F1002-F1081 HydrophobicContact CE2-CD2 4.18Å; F1002-F1081 AromaticContact CG-CD2 3.58Å; F1002-F1081 HydrophobicContact CG-CD2 3.58Å; F1002-F1081 HydrophobicContact CG-CE2 4.06Å; F1002-F1081 HydrophobicContact CZ-CB 4.46Å; F1002-F1081 HydrophobicContact CZ-CD2 4.33Å; F1002-K1084 HydrophobicContact CE2-CD 4.15Å
1003	I	90.6	Very high	79.6	Confident	1 Å²	1	81.1 Å²	81.1	1%	0.005	43%	0.433	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.3	-5.1	178.3	69.4	177.3	0	0	0	113.7	F999 Q1000 E1001 S1005 R1006 R1007 I1026 Y1031	F999-I1003 HydrophobicContact CD1-CD1 4.34Å; F999-I1003 HydrophobicContact CD1-CG2 4.47Å; F999-I1003 HydrophobicContact CD2-CG2 4.29Å; F999-I1003 HydrophobicContact CE1-CD1 3.97Å; F999-I1003 HydrophobicContact CE1-CG2 3.95Å; F999-I1003 HydrophobicContact CE2-CG2 3.76Å; F999-I1003 HydrophobicContact CZ-CG2 3.56Å; F999-I1003 WeakPolarHBondContact O-CG1 3.47Å; F999-I1003 PolarHBondContact O-N 3.28Å; Q1000-I1003 WeakPolarHBondContact O-CG1 3.33Å; E1001-I1003 VanDerWaalsContact C-N 3.29Å; E1001-I1003 PolarHBondContact O-N 3.41Å; I1003-S1005 VanDerWaalsContact C-N 3.31Å; I1003-S1005 PolarHBondContact O-N 3.23Å; I1003-R1006 PolarHBondContact O-N 2.84Å; I1003-R1007 PolarHBondContact O-N 3.23Å; I1003-I1026 HydrophobicContact CB-CD1 3.84Å; I1003-I1026 HydrophobicContact CD1-CD1 4.29Å; I1003-I1026 HydrophobicContact CG2-CD1 4.18Å; I1003-Y1031 HydrophobicContact CD1-CD2 3.89Å; I1003-Y1031 HydrophobicContact CD1-CE2 3.51Å
1004	F	87.8	Confident	77.2	Confident	156 Å²	156	85.8 Å²	85.8	68%	0.684	45%	0.452	S	S	*	.	G	3₁₀ helix	trans	-54.5	-44.9	-172.4	180	-101.1	0	0	0	112.5	Q1000 E1001 R1006 R1007	Q1000-F1004 PolarHBondContact O-N 2.72Å; E1001-F1004 WeakPolarHBondContact O-CB 3.22Å; E1001-F1004 PolarHBondContact O-N 3.29Å; E1001-F1004 VanDerWaalsContact O-N 3.12Å; F1004-R1006 PolarHBondContact O-N 2.94Å; F1004-R1006 VanDerWaalsContact O-N 3.13Å; F1004-R1007 PolarHBondContact O-N 3.16Å
1005	S	83.3	Confident	74.6	Confident	84 Å²	84	86.9 Å²	86.9	59%	0.587	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-69.1	-7.3	-179.3	62.9	0	0	0	0	115.2	I1003	I1003-S1005 VanDerWaalsContact C-N 3.31Å; I1003-S1005 PolarHBondContact O-N 3.23Å
1006	R	85	Confident	72.2	Confident	24 Å²	24	90.2 Å²	90.2	9%	0.091	49%	0.493	C	S	.	.	G	3₁₀ helix	trans	-121.5	12.9	-177.5	-65.4	-66.7	-175.6	161.2	-1.7	113.1	W746 K747 S749 I1003 F1004 I1026	W746-R1006 HydrophobicContact CZ3-CG 4.19Å; W746-R1006 PolarHBondContact O-NH2 3.35Å; K747-R1006 VanDerWaalsContact C-NH2 3.3Å; K747-R1006 PolarHBondContact O-NH2 3Å; S749-R1006 PolarHBondContact O-NH2 3.1Å; I1003-R1006 PolarHBondContact O-N 2.84Å; F1004-R1006 PolarHBondContact O-N 2.94Å; F1004-R1006 VanDerWaalsContact O-N 3.13Å; R1006-I1026 PolarHBondContact O-N 3.42Å
1007	R	84.1	Confident	69.7	Low	91 Å²	91	95.1 Å²	95.1	34%	0.343	52%	0.519	S	S	.	.	B	Isolated β-bridge	trans	-79.1	143.5	169.1	-72.9	-177.7	172.6	-171.8	-2.7	110.2	I1003 F1004 E1009 I1026	I1003-R1007 PolarHBondContact O-N 3.23Å; F1004-R1007 PolarHBondContact O-N 3.16Å; R1007-E1009 PolarHBondContact O-N 3.31Å; R1007-I1026 WeakPolarHBondContact CA-O 3.03Å; R1007-I1026 HydrophobicContact CG-CB 4.35Å
1008	A	76.4	Confident	67.2	Low	45 Å²	45	99.8 Å²	99.8	37%	0.372	53%	0.532	S	S	.	.	P	Polyproline II helix	trans	-64.5	128.2	171.4	0	0	0	0	0	109.4	T1010 F1025 I1026 T1027	A1008-T1010 PolarHBondContact O-N 2.91Å; A1008-F1025 HydrophobicContact CB-CB 4.07Å; A1008-I1026 PolarHBondContact N-O 3.06Å; A1008-T1027 HydrophobicContact CB-CG2 4.47Å
1009	E	61.8	Low	65.1	Low	166 Å²	166	100.8 Å²	100.8	78%	0.776	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-68.2	128.4	169	-67.8	-178.7	177.4	0	0	108.6	R1007 S1011	R1007-E1009 PolarHBondContact O-N 3.31Å; E1009-S1011 PolarHBondContact O-N 3.48Å
1010	T	49.7	Very low	63	Low	142 Å²	142	104.4 Å²	104.4	87%	0.871	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	7.9	-178.9	33.6	0	0	0	0	114.8	A1008	A1008-T1010 PolarHBondContact O-N 2.91Å
1011	S	43.9	Very low	61.2	Low	95 Å²	95	103.6 Å²	103.6	66%	0.664	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111	7.8	-173.3	-56	0	0	0	0	114.8	E1009 E1013	E1009-S1011 PolarHBondContact O-N 3.48Å; S1011-E1013 PolarHBondContact O-N 3.19Å
1012	A	42.9	Very low	59.6	Low	67 Å²	67	99.1 Å²	99.1	55%	0.554	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76	33.7	179	0	0	0	0	0	114.3	E1014	A1012-E1014 PolarHBondContact O-N 3.2Å
1013	E	40.2	Very low	58.6	Low	188 Å²	188	101.6 Å²	101.6	88%	0.879	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.8	-11.5	170.8	-76.5	-169.6	154.9	0	0	113	S1011	S1011-E1013 PolarHBondContact O-N 3.19Å
1014	E	42	Very low	58.2	Low	188 Å²	188	101.6 Å²	101.6	88%	0.879	57%	0.568	S	S	*	*	S	Bend	trans	-106.5	-5.8	-172.2	-69.8	-168.3	159.5	0	0	116.9	A1012	A1012-E1014 PolarHBondContact O-N 3.2Å
1015	T	38.5	Very low	58.2	Low	105 Å²	105	96.7 Å²	96.7	64%	0.644	55%	0.547	S	S	*	.			trans	-114.8	110.3	176.4	41.4	0	0	0	0	111	D1017	T1015-D1017 PolarHBondContact O-N 3.11Å
1016	G	42.5	Very low	58.4	Low	85 Å²	85	92.9 Å²	92.9	88%	0.876	52%	0.519	S	S	*	.			trans	-65	19.6	-173.2	0	0	0	0	0	117	R1018	G1016-R1018 PolarHBondContact O-N 3.27Å
1017	D	40.4	Very low	58.5	Low	111 Å²	111	93.7 Å²	93.7	59%	0.594	53%	0.527	S	S	*	.			trans	-101.3	65.1	-179.6	-134.7	-4.1	0	0	0	110.5	T1015 S1019	T1015-D1017 PolarHBondContact O-N 3.11Å; D1017-S1019 VanDerWaalsContact C-N 3.28Å; D1017-S1019 PolarHBondContact O-N 3.13Å
1018	R	41.4	Very low	58.4	Low	221 Å²	221	92.7 Å²	92.7	83%	0.834	54%	0.539	S	S	*	.	H	α-helix	trans	-69	-18.3	-170.2	-73.9	-176.9	171.6	172.1	-2.5	115	G1016	G1016-R1018 PolarHBondContact O-N 3.27Å
1019	S	49.4	Very low	58.8	Low	90 Å²	90	95.5 Å²	95.5	63%	0.629	55%	0.551	S	S	*	*	H	α-helix	trans	-85.1	-32.1	-168.6	71.5	0	0	0	0	114.3	D1017	D1017-S1019 VanDerWaalsContact C-N 3.28Å; D1017-S1019 PolarHBondContact O-N 3.13Å
1020	I	48.7	Very low	59.9	Low	76 Å²	76	88.6 Å²	88.6	39%	0.39	52%	0.519	S	S	.	.	H	α-helix	trans	-86.6	-32.5	-171.8	-56.2	173.3	0	0	0	111.7
1021	S	53.9	Low	61.6	Low	57 Å²	57	82.4 Å²	82.4	40%	0.399	48%	0.48	S	S	.	.	H	α-helix	trans	-80.4	-30.7	-171.1	82.1	0	0	0	0	114.3	D1023 F1025	S1021-D1023 PolarHBondContact O-N 3.05Å; S1021-F1025 WeakPolarHBondContact O-CD2 3.42Å; S1021-F1025 PolarHBondContact O-N 3.09Å
1022	S	58.8	Low	63.7	Low	61 Å²	61	82.7 Å²	82.7	43%	0.427	47%	0.474	S	S	.	.	H	α-helix	trans	-64.3	-42.2	-174.6	167.1	0	0	0	0	113.1
1023	D	70	Confident	65.7	Low	81 Å²	81	84.4 Å²	84.4	43%	0.433	48%	0.478	S	S	.	.	H	α-helix	trans	-86.6	-13.9	-168.7	-67.8	-4.5	0	0	0	112.8	S1021 S1071 A1072	S1021-D1023 PolarHBondContact O-N 3.05Å; D1023-S1071 VanDerWaalsContact O-CA 3.22Å; D1023-S1071 WeakPolarHBondContact O-CA 3.46Å; D1023-S1071 WeakPolarHBondContact O-CB 3.3Å; D1023-A1072 PolarHBondContact O-N 3.3Å
1024	V	82.3	Confident	68.1	Low	0 Å²	0	75.9 Å²	75.9	0%	0	44%	0.438	C	S	.	.	H	α-helix	trans	-97.6	-46.1	-180	-172.9	0	0	0	0	112	P751 V754 E755 S1073	P751-V1024 HydrophobicContact CB-CG1 3.92Å; V754-V1024 HydrophobicContact CG1-CG1 4.39Å; E755-V1024 HydrophobicContact CB-CG2 3.72Å; E755-V1024 HydrophobicContact CG-CG2 3.8Å; V1024-S1073 WeakPolarHBondContact O-CB 3.48Å; V1024-S1073 PolarHBondContact O-N 2.86Å; V1024-S1073 VanDerWaalsContact O-N 3.13Å; V1024-S1073 PolarHBondContact O-OG 2.95Å
1025	F	86.8	Confident	70.4	Confident	54 Å²	54	70.5 Å²	70.5	24%	0.237	41%	0.412	C	S	.	.	S	Bend	trans	-88.6	151.6	-174.3	-69.1	-80	0	0	0	112.6	P751 A1008 S1021 T1027	P751-F1025 HydrophobicContact CB-CE2 4.43Å; P751-F1025 HydrophobicContact CG-CE2 4.27Å; P751-F1025 HydrophobicContact CG-CZ 3.97Å; A1008-F1025 HydrophobicContact CB-CB 4.07Å; S1021-F1025 WeakPolarHBondContact O-CD2 3.42Å; S1021-F1025 PolarHBondContact O-N 3.09Å; F1025-T1027 PolarHBondContact O-N 3.15Å
1026	I	88	Confident	72.7	Confident	3 Å²	3	68.5 Å²	68.5	2%	0.015	40%	0.4	C	S	.	.	B	Isolated β-bridge	trans	-81.1	115.1	-176.9	-50.2	175	0	0	0	108.9	I1003 R1006 R1007 A1008 Y1031 L1074	I1003-I1026 HydrophobicContact CB-CD1 3.84Å; I1003-I1026 HydrophobicContact CD1-CD1 4.29Å; I1003-I1026 HydrophobicContact CG2-CD1 4.18Å; R1006-I1026 PolarHBondContact O-N 3.42Å; R1007-I1026 WeakPolarHBondContact CA-O 3.03Å; R1007-I1026 HydrophobicContact CG-CB 4.35Å; A1008-I1026 PolarHBondContact N-O 3.06Å; I1026-Y1031 HydrophobicContact CG2-CD2 4.35Å; I1026-L1074 HydrophobicContact CD1-CB 4.1Å; I1026-L1074 HydrophobicContact CD1-CD1 4.14Å; I1026-L1074 HydrophobicContact CG1-CB 3.95Å; I1026-L1074 HydrophobicContact CG2-CB 4.45Å; I1026-L1074 HydrophobicContact CG2-CD1 4.43Å
1027	T	86.8	Confident	74.8	Confident	41 Å²	41	66.7 Å²	66.7	25%	0.252	37%	0.368	S	S	.	.			trans	-86.5	152.1	174.6	65.5	0	0	0	0	111	A1008 F1025 T1029 E1030 Y1031	A1008-T1027 HydrophobicContact CB-CG2 4.47Å; F1025-T1027 PolarHBondContact O-N 3.15Å; T1027-T1029 VanDerWaalsContact C-N 3.32Å; T1027-T1029 PolarHBondContact O-N 3.31Å; T1027-T1029 PolarHBondContact OG1-OG1 3.38Å; T1027-E1030 PolarHBondContact N-OE2 2.77Å; T1027-E1030 PolarHBondContact O-N 3.24Å; T1027-E1030 WeakPolarHBondContact OG1-CB 3.05Å; T1027-E1030 PolarHBondContact OG1-N 2.64Å; T1027-Y1031 WeakPolarHBondContact O-CB 3.43Å; T1027-Y1031 PolarHBondContact O-N 3.13Å
1028	A	83	Confident	77.2	Confident	71 Å²	71	61.4 Å²	61.4	59%	0.587	34%	0.34	S	S	*	.	H	α-helix	trans	-62.8	-40.1	-179.2	0	0	0	0	0	112.1	Y1031 D1032	A1028-Y1031 PolarHBondContact O-N 2.77Å; A1028-D1032 PolarHBondContact O-N 3.44Å
1029	T	83.7	Confident	79.7	Confident	104 Å²	104	52.7 Å²	52.7	64%	0.638	31%	0.307	S	S	*	.	H	α-helix	trans	-64.6	-43.7	177.9	47.9	0	0	0	0	112.3	T1027 T1033	T1027-T1029 VanDerWaalsContact C-N 3.32Å; T1027-T1029 PolarHBondContact O-N 3.31Å; T1027-T1029 PolarHBondContact OG1-OG1 3.38Å; T1029-T1033 WeakPolarHBondContact O-CB 3.34Å; T1029-T1033 PolarHBondContact O-N 3.41Å; T1029-T1033 PolarHBondContact O-OG1 3.41Å
1030	E	85.4	Confident	81.6	Confident	20 Å²	20	49.7 Å²	49.7	9%	0.093	28%	0.282	C	S	.	.	H	α-helix	trans	-60.4	-49.2	173.4	178.5	-156.5	171.2	0	0	110.9	T1027 D1032 T1033 L1034 S1071 L1074	T1027-E1030 PolarHBondContact N-OE2 2.77Å; T1027-E1030 PolarHBondContact O-N 3.24Å; T1027-E1030 WeakPolarHBondContact OG1-CB 3.05Å; T1027-E1030 PolarHBondContact OG1-N 2.64Å; E1030-D1032 VanDerWaalsContact C-N 3.33Å; E1030-D1032 PolarHBondContact O-N 3.04Å; E1030-T1033 PolarHBondContact O-N 3.1Å; E1030-L1034 HydrophobicContact CG-CD1 4.01Å; E1030-L1034 WeakPolarHBondContact O-CB 3.41Å; E1030-L1034 PolarHBondContact O-N 2.89Å; E1030-S1071 VanDerWaalsContact CD-OG 3.31Å; E1030-S1071 WeakPolarHBondContact OE1-CB 3.33Å; E1030-S1071 PolarHBondContact OE1-N 3.13Å; E1030-S1071 PolarHBondContact OE1-OG 2.9Å; E1030-S1071 WeakPolarHBondContact OE2-CB 3.39Å; E1030-S1071 PolarHBondContact OE2-OG 2.77Å; E1030-S1071 VanDerWaalsContact OE2-OG 3.07Å; E1030-L1074 HydrophobicContact CG-CD2 4.32Å; E1030-L1074 WeakPolarHBondContact OE1-CD2 3.41Å
1031	Y	86	Confident	83.7	Confident	12 Å²	12	47 Å²	47	5%	0.047	27%	0.268	C	S	.	.	H	α-helix	trans	-60.5	-42.3	-178.6	-176.6	-98.4	0	0	0	112.2	F999 I1003 I1026 T1027 A1028 L1034 K1035 T1038 L1074	F999-Y1031 HydrophobicContact CE1-CE2 4.06Å; I1003-Y1031 HydrophobicContact CD1-CD2 3.89Å; I1003-Y1031 HydrophobicContact CD1-CE2 3.51Å; I1026-Y1031 HydrophobicContact CG2-CD2 4.35Å; T1027-Y1031 WeakPolarHBondContact O-CB 3.43Å; T1027-Y1031 PolarHBondContact O-N 3.13Å; A1028-Y1031 PolarHBondContact O-N 2.77Å; Y1031-L1034 PolarHBondContact O-N 3.02Å; Y1031-K1035 WeakPolarHBondContact O-CA 3.33Å; Y1031-K1035 WeakPolarHBondContact O-CB 3.34Å; Y1031-K1035 PolarHBondContact O-N 3.29Å; Y1031-T1038 HydrophobicContact CE2-CG2 4.26Å; Y1031-L1074 HydrophobicContact CD2-CD1 4.2Å
1032	D	86.5	Confident	85.6	Confident	101 Å²	101	44.4 Å²	44.4	54%	0.54	25%	0.25	S	C	.	.	H	α-helix	trans	-66.9	-39	177	-78.5	-29.8	0	0	0	112	A1028 E1030 K1035	A1028-D1032 PolarHBondContact O-N 3.44Å; E1030-D1032 VanDerWaalsContact C-N 3.33Å; E1030-D1032 PolarHBondContact O-N 3.04Å; D1032-K1035 VanDerWaalsContact O-CB 3.31Å; D1032-K1035 WeakPolarHBondContact O-CB 3.38Å; D1032-K1035 PolarHBondContact O-N 3.17Å
1033	T	86.3	Confident	87.1	Confident	104 Å²	104	42.7 Å²	42.7	64%	0.638	23%	0.234	S	C	*	.	H	α-helix	trans	-66.4	-41.3	176.9	-55.3	0	0	0	0	111.8	T1029 E1030	T1029-T1033 WeakPolarHBondContact O-CB 3.34Å; T1029-T1033 PolarHBondContact O-N 3.41Å; T1029-T1033 PolarHBondContact O-OG1 3.41Å; E1030-T1033 PolarHBondContact O-N 3.1Å
1034	L	89.1	Confident	88.2	Confident	8 Å²	8	39.2 Å²	39.2	4%	0.042	22%	0.215	C	C	.	.	H	α-helix	trans	-90.6	2.1	-178	-67.9	178.4	0	0	0	114	E1030 Y1031 P1036 K1037 T1038 V1069 I1070 L1074 W1078	E1030-L1034 HydrophobicContact CG-CD1 4.01Å; E1030-L1034 WeakPolarHBondContact O-CB 3.41Å; E1030-L1034 PolarHBondContact O-N 2.89Å; Y1031-L1034 PolarHBondContact O-N 3.02Å; L1034-P1036 VanDerWaalsContact C-CD 3.46Å; L1034-K1037 HydrophobicContact CD2-CD 4.06Å; L1034-K1037 HydrophobicContact CD2-CG 4.27Å; L1034-K1037 WeakPolarHBondContact O-CA 3.31Å; L1034-K1037 WeakPolarHBondContact O-CB 3.27Å; L1034-K1037 PolarHBondContact O-N 2.88Å; L1034-T1038 PolarHBondContact O-N 2.54Å; L1034-T1038 PolarHBondContact O-OG1 3.48Å; L1034-V1069 HydrophobicContact CD2-CG1 4.05Å; L1034-I1070 HydrophobicContact CD1-CB 3.75Å; L1034-I1070 HydrophobicContact CD1-CD1 4Å; L1034-I1070 HydrophobicContact CD1-CG1 3.81Å; L1034-L1074 HydrophobicContact CB-CD2 4.23Å; L1034-L1074 HydrophobicContact CD1-CD2 3.8Å; L1034-W1078 HydrophobicContact CB-CH2 4.4Å; L1034-W1078 HydrophobicContact CB-CZ2 4.21Å; L1034-W1078 HydrophobicContact CD1-CH2 4.35Å
1035	K	90.1	Very high	88.7	Confident	76 Å²	76	39.5 Å²	39.5	33%	0.33	22%	0.216	S	C	.	.	H	α-helix	trans	-50.1	-43.1	-179.1	-171.9	175.9	-174.8	170.3	0	114.2	Y1031 D1032 K1037 T1038 Y1039	Y1031-K1035 WeakPolarHBondContact O-CA 3.33Å; Y1031-K1035 WeakPolarHBondContact O-CB 3.34Å; Y1031-K1035 PolarHBondContact O-N 3.29Å; D1032-K1035 VanDerWaalsContact O-CB 3.31Å; D1032-K1035 WeakPolarHBondContact O-CB 3.38Å; D1032-K1035 PolarHBondContact O-N 3.17Å; K1035-K1037 VanDerWaalsContact C-N 3.33Å; K1035-K1037 PolarHBondContact O-N 3.49Å; K1035-T1038 WeakPolarHBondContact O-CB 3.41Å; K1035-T1038 PolarHBondContact O-N 3.22Å; K1035-Y1039 WeakPolarHBondContact CE-OH 3.47Å; K1035-Y1039 HydrophobicContact CG-CD1 4.36Å; K1035-Y1039 HydrophobicContact CG-CE1 3.98Å; K1035-Y1039 HydrophobicContact CG-CE2 4.38Å; K1035-Y1039 PolarHBondContact O-N 3.29Å
1036	P	87.2	Confident	89	Confident	62 Å²	62	38.2 Å²	38.2	40%	0.403	21%	0.211	S	C	.	.	H	α-helix	trans	-63.4	-35.7	174.9	-21.7	34.4	0	0	0	113.2	L1034 R1040	L1034-P1036 VanDerWaalsContact C-CD 3.46Å; P1036-R1040 WeakPolarHBondContact O-CG 3.15Å; P1036-R1040 PolarHBondContact O-N 3.35Å
1037	K	87.7	Confident	89.2	Confident	47 Å²	47	38.2 Å²	38.2	20%	0.204	21%	0.211	C	C	.	.	H	α-helix	trans	-69.2	-45.6	174.7	-54.9	-151	179.8	168	0	110.9	L1034 K1035 Y1039 R1040 Q1041 W1078	L1034-K1037 HydrophobicContact CD2-CD 4.06Å; L1034-K1037 HydrophobicContact CD2-CG 4.27Å; L1034-K1037 WeakPolarHBondContact O-CA 3.31Å; L1034-K1037 WeakPolarHBondContact O-CB 3.27Å; L1034-K1037 PolarHBondContact O-N 2.88Å; K1035-K1037 VanDerWaalsContact C-N 3.33Å; K1035-K1037 PolarHBondContact O-N 3.49Å; K1037-Y1039 VanDerWaalsContact C-N 3.33Å; K1037-Y1039 PolarHBondContact O-N 2.87Å; K1037-R1040 WeakPolarHBondContact O-CB 3.49Å; K1037-R1040 PolarHBondContact O-N 3.27Å; K1037-R1040 VanDerWaalsContact O-N 3.15Å; K1037-Q1041 WeakPolarHBondContact O-CG 3.25Å; K1037-Q1041 PolarHBondContact O-N 2.91Å; K1037-Q1041 VanDerWaalsContact O-N 3.09Å; K1037-W1078 HydrophobicContact CB-CH2 3.62Å; K1037-W1078 HydrophobicContact CB-CZ2 4.04Å; K1037-W1078 HydrophobicContact CB-CZ3 4.37Å; K1037-W1078 HydrophobicContact CD-CH2 4.33Å
1038	T	91.1	Very high	89.5	Confident	0 Å²	0	36.3 Å²	36.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-54.3	-49.6	174.6	-59.4	0	0	0	0	110.9	F999 Y1031 L1034 K1035 R1040 Q1041 L1042 W1078	F999-T1038 HydrophobicContact CD1-CG2 3.76Å; F999-T1038 HydrophobicContact CE1-CG2 3.32Å; F999-T1038 HydrophobicContact CZ-CG2 4.11Å; Y1031-T1038 HydrophobicContact CE2-CG2 4.26Å; L1034-T1038 PolarHBondContact O-N 2.54Å; L1034-T1038 PolarHBondContact O-OG1 3.48Å; K1035-T1038 WeakPolarHBondContact O-CB 3.41Å; K1035-T1038 PolarHBondContact O-N 3.22Å; T1038-R1040 VanDerWaalsContact C-N 3.29Å; T1038-R1040 PolarHBondContact O-N 2.88Å; T1038-Q1041 WeakPolarHBondContact O-CB 3.38Å; T1038-Q1041 PolarHBondContact O-N 2.77Å; T1038-L1042 HydrophobicContact CG2-CD1 4.31Å; T1038-L1042 HydrophobicContact CG2-CG 4.43Å; T1038-L1042 WeakPolarHBondContact O-CG 3.4Å; T1038-L1042 PolarHBondContact O-N 2.96Å; T1038-W1078 WeakPolarHBondContact OG1-CZ2 3.39Å; T1038-W1078 PolarHBondContact OG1-NE1 3.25Å; T1038-W1078 VanDerWaalsContact OG1-NE1 3.13Å
1039	Y	93.2	Very high	89.8	Confident	39 Å²	39	36.4 Å²	36.4	15%	0.153	19%	0.188	C	C	.	.	H	α-helix	trans	-61.9	-34.9	179.7	-78.2	10.5	0	0	0	113	R990 P991 I996 K1035 K1037 L1042 R1043	R990-Y1039 HydrophobicContact CG-CD2 4.26Å; R990-Y1039 HydrophobicContact CG-CE2 4.1Å; P991-Y1039 HydrophobicContact CG-CG 4.32Å; P991-Y1039 VanDerWaalsContact CG-O 3.25Å; P991-Y1039 WeakPolarHBondContact CG-O 3.42Å; I996-Y1039 HydrophobicContact CD1-CE1 4.03Å; I996-Y1039 HydrophobicContact CD1-CE2 4.33Å; I996-Y1039 HydrophobicContact CG1-CE1 4.12Å; I996-Y1039 HydrophobicContact CG2-CE1 4.23Å; K1035-Y1039 WeakPolarHBondContact CE-OH 3.47Å; K1035-Y1039 HydrophobicContact CG-CD1 4.36Å; K1035-Y1039 HydrophobicContact CG-CE1 3.98Å; K1035-Y1039 HydrophobicContact CG-CE2 4.38Å; K1035-Y1039 PolarHBondContact O-N 3.29Å; K1037-Y1039 VanDerWaalsContact C-N 3.33Å; K1037-Y1039 PolarHBondContact O-N 2.87Å; Y1039-L1042 HydrophobicContact CD1-CD1 4.33Å; Y1039-L1042 PolarHBondContact O-N 3.39Å; Y1039-R1043 WeakPolarHBondContact O-CB 3.48Å; Y1039-R1043 PolarHBondContact O-N 3.11Å
1040	R	89.6	Confident	90.1	Very high	27 Å²	27	36.8 Å²	36.8	10%	0.102	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-42.3	172.4	-72.4	-176.8	-63.5	165.8	7.2	111.9	T85 L987 P1036 K1037 T1038 R1043 I1044	T85-R1040 PolarHBondContact OG1-NH1 3.4Å; T85-R1040 VanDerWaalsContact OG1-NH1 3.15Å; L987-R1040 HydrophobicContact CG-CB 4.44Å; L987-R1040 HydrophobicContact CG-CG 4.41Å; P1036-R1040 WeakPolarHBondContact O-CG 3.15Å; P1036-R1040 PolarHBondContact O-N 3.35Å; K1037-R1040 WeakPolarHBondContact O-CB 3.49Å; K1037-R1040 PolarHBondContact O-N 3.27Å; K1037-R1040 VanDerWaalsContact O-N 3.15Å; T1038-R1040 VanDerWaalsContact C-N 3.29Å; T1038-R1040 PolarHBondContact O-N 2.88Å; R1040-R1043 PolarHBondContact O-N 3.43Å; R1040-I1044 WeakPolarHBondContact O-CG1 3.27Å; R1040-I1044 PolarHBondContact O-N 2.85Å
1041	Q	92.1	Very high	90.4	Very high	20 Å²	20	39.4 Å²	39.4	9%	0.093	19%	0.194	C	C	.	.	H	α-helix	trans	-61.1	-45.4	175.2	-60.8	-57.3	-29.4	0	0	111.1	K1037 T1038 R1043 I1044 K1045 W1078 V1082	K1037-Q1041 WeakPolarHBondContact O-CG 3.25Å; K1037-Q1041 PolarHBondContact O-N 2.91Å; K1037-Q1041 VanDerWaalsContact O-N 3.09Å; T1038-Q1041 WeakPolarHBondContact O-CB 3.38Å; T1038-Q1041 PolarHBondContact O-N 2.77Å; Q1041-R1043 VanDerWaalsContact C-N 3.31Å; Q1041-R1043 PolarHBondContact O-N 3.34Å; Q1041-I1044 WeakPolarHBondContact O-CB 3.43Å; Q1041-I1044 PolarHBondContact O-N 3.45Å; Q1041-I1044 VanDerWaalsContact O-N 3.13Å; Q1041-K1045 PolarHBondContact O-N 3.13Å; Q1041-W1078 HydrophobicContact CB-CB 4.39Å; Q1041-W1078 HydrophobicContact CB-CG 4.31Å; Q1041-W1078 HydrophobicContact CG-CB 4.06Å; Q1041-W1078 HydrophobicContact CG-CD2 3.9Å; Q1041-W1078 HydrophobicContact CG-CE3 4.1Å; Q1041-W1078 HydrophobicContact CG-CG 3.9Å; Q1041-V1082 HydrophobicContact CB-CG2 3.94Å; Q1041-V1082 VanDerWaalsContact O-CG2 3.27Å; Q1041-V1082 WeakPolarHBondContact O-CG2 3.28Å
1042	L	93.5	Very high	90.8	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	19%	0.192	C	C	.	.	H	α-helix	trans	-62.2	-36.7	175.1	-61.2	-176.3	0	0	0	112.6	P991 L995 I996 F999 T1038 Y1039 I1044 K1045 E1046 F1081	P991-L1042 HydrophobicContact CB-CB 3.99Å; P991-L1042 HydrophobicContact CG-CB 3.56Å; P991-L1042 HydrophobicContact CG-CD1 4.41Å; L995-L1042 HydrophobicContact CD2-CB 4.05Å; L995-L1042 VanDerWaalsContact CD2-O 3.26Å; L995-L1042 WeakPolarHBondContact CD2-O 3.29Å; I996-L1042 HydrophobicContact CG1-CD1 4.16Å; F999-L1042 HydrophobicContact CB-CD1 3.98Å; F999-L1042 HydrophobicContact CB-CD2 3.73Å; F999-L1042 HydrophobicContact CD1-CD1 4.19Å; F999-L1042 HydrophobicContact CD1-CD2 4.24Å; F999-L1042 HydrophobicContact CD2-CD2 3.76Å; F999-L1042 HydrophobicContact CE2-CD2 4.44Å; F999-L1042 HydrophobicContact CG-CD1 4.16Å; F999-L1042 HydrophobicContact CG-CD2 3.63Å; F999-L1042 HydrophobicContact CG-CG 4.42Å; T1038-L1042 HydrophobicContact CG2-CD1 4.31Å; T1038-L1042 HydrophobicContact CG2-CG 4.43Å; T1038-L1042 WeakPolarHBondContact O-CG 3.4Å; T1038-L1042 PolarHBondContact O-N 2.96Å; Y1039-L1042 HydrophobicContact CD1-CD1 4.33Å; Y1039-L1042 PolarHBondContact O-N 3.39Å; L1042-I1044 VanDerWaalsContact C-N 3.35Å; L1042-K1045 VanDerWaalsContact O-CB 3.31Å; L1042-K1045 WeakPolarHBondContact O-CB 3.28Å; L1042-K1045 PolarHBondContact O-N 3.18Å; L1042-E1046 PolarHBondContact O-N 3.12Å; L1042-F1081 HydrophobicContact CD2-CD1 3.47Å; L1042-F1081 VanDerWaalsContact CD2-CD1 3.47Å; L1042-F1081 HydrophobicContact CD2-CE1 3.46Å; L1042-F1081 VanDerWaalsContact CD2-CE1 3.46Å
1043	R	91.4	Very high	91.1	Very high	24 Å²	24	39.5 Å²	39.5	9%	0.091	19%	0.19	C	C	.	.	H	α-helix	trans	-67.6	-35.6	174.5	-175.6	57.8	-173.4	147.6	13.7	112	L987 P991 Y1039 R1040 Q1041 K1045 E1046 L1047 E1050	L987-R1043 HydrophobicContact CD1-CG 4.46Å; P991-R1043 HydrophobicContact CG-CB 4.5Å; Y1039-R1043 WeakPolarHBondContact O-CB 3.48Å; Y1039-R1043 PolarHBondContact O-N 3.11Å; R1040-R1043 PolarHBondContact O-N 3.43Å; Q1041-R1043 VanDerWaalsContact C-N 3.31Å; Q1041-R1043 PolarHBondContact O-N 3.34Å; R1043-K1045 VanDerWaalsContact C-N 3.3Å; R1043-K1045 PolarHBondContact O-N 3.42Å; R1043-E1046 VanDerWaalsContact CD-OE2 3.22Å; R1043-E1046 WeakPolarHBondContact CD-OE2 3.33Å; R1043-E1046 IonicContact CZ-OE2 3.9Å; R1043-E1046 IonicContact NE-OE2 2.97Å; R1043-E1046 IonicContact NH1-OE2 3.28Å; R1043-E1046 PolarHBondContact NH1-OE2 2.75Å; R1043-E1046 PolarHBondContact O-N 3.42Å; R1043-L1047 HydrophobicContact CG-CD1 4.32Å; R1043-L1047 WeakPolarHBondContact O-CG 2.99Å; R1043-L1047 PolarHBondContact O-N 3.26Å; R1043-L1047 VanDerWaalsContact O-N 3.12Å; R1043-E1050 IonicContact NH1-OE1 3.73Å; R1043-E1050 PolarHBondContact NH1-OE1 3.4Å; R1043-E1050 IonicContact NH2-OE1 2.82Å; R1043-E1050 IonicContact NH2-OE2 3.69Å
1044	I	92.6	Very high	91.3	Very high	9 Å²	9	37.3 Å²	37.3	5%	0.046	19%	0.188	C	C	.	.	H	α-helix	trans	-59.6	-43.7	172.1	-65.8	165.3	0	0	0	110	L922 L987 R1040 Q1041 L1042 E1046 L1047 L1048 L1060 V1082	L922-I1044 HydrophobicContact CD1-CD1 3.49Å; L922-I1044 VanDerWaalsContact CD1-CD1 3.49Å; L922-I1044 HydrophobicContact CD1-CG1 3.98Å; L987-I1044 HydrophobicContact CD1-CG1 3.79Å; R1040-I1044 WeakPolarHBondContact O-CG1 3.27Å; R1040-I1044 PolarHBondContact O-N 2.85Å; Q1041-I1044 WeakPolarHBondContact O-CB 3.43Å; Q1041-I1044 PolarHBondContact O-N 3.45Å; Q1041-I1044 VanDerWaalsContact O-N 3.13Å; L1042-I1044 VanDerWaalsContact C-N 3.35Å; I1044-E1046 VanDerWaalsContact C-N 3.34Å; I1044-E1046 PolarHBondContact O-N 2.9Å; I1044-L1047 WeakPolarHBondContact O-CB 3.33Å; I1044-L1047 PolarHBondContact O-N 3.06Å; I1044-L1047 VanDerWaalsContact O-N 3.11Å; I1044-L1048 HydrophobicContact CG2-CD1 4.14Å; I1044-L1048 HydrophobicContact CG2-CG 4.16Å; I1044-L1048 WeakPolarHBondContact O-CG 3.29Å; I1044-L1048 PolarHBondContact O-N 2.89Å; I1044-L1060 HydrophobicContact CG2-CD2 4.07Å; I1044-V1082 HydrophobicContact CG2-CG1 3.92Å
1045	K	93.7	Very high	91.5	Very high	5 Å²	5	37.1 Å²	37.1	2%	0.022	19%	0.188	C	C	.	.	H	α-helix	trans	-55.4	-45.7	176.2	173.7	60.4	166.9	169.6	0	112.6	L995 Q1041 L1042 R1043 L1047 L1048 H1049 F1081 V1082 K1084	L995-K1045 HydrophobicContact CD1-CG 4.29Å; L995-K1045 HydrophobicContact CD2-CB 4.37Å; L995-K1045 HydrophobicContact CD2-CG 4.23Å; Q1041-K1045 PolarHBondContact O-N 3.13Å; L1042-K1045 VanDerWaalsContact O-CB 3.31Å; L1042-K1045 WeakPolarHBondContact O-CB 3.28Å; L1042-K1045 PolarHBondContact O-N 3.18Å; R1043-K1045 VanDerWaalsContact C-N 3.3Å; R1043-K1045 PolarHBondContact O-N 3.42Å; K1045-L1047 VanDerWaalsContact C-N 3.35Å; K1045-L1047 PolarHBondContact O-N 3.31Å; K1045-L1048 PolarHBondContact O-N 2.9Å; K1045-H1049 VanDerWaalsContact CE-NE2 3.31Å; K1045-H1049 WeakPolarHBondContact CE-NE2 3.4Å; K1045-H1049 PolarHBondContact NZ-NE2 2.78Å; K1045-H1049 PolarHBondContact O-CD2 3.31Å; K1045-H1049 PolarHBondContact O-N 2.89Å; K1045-F1081 WeakPolarHBondContact CD-O 3.32Å; K1045-F1081 VanDerWaalsContact CE-O 3.3Å; K1045-F1081 WeakPolarHBondContact CE-O 3.26Å; K1045-F1081 HydrophobicContact CG-CD1 4.5Å; K1045-F1081 HydrophobicContact CG-CE1 4.42Å; K1045-V1082 HydrophobicContact CB-CG2 4.44Å; K1045-V1082 WeakPolarHBondContact CD-O 3.31Å; K1045-K1084 PolarHBondContact NZ-O 3.17Å
1046	E	92.3	Very high	91.8	Very high	27 Å²	27	36.5 Å²	36.5	13%	0.126	19%	0.186	C	C	.	.	H	α-helix	trans	-60.1	-45.4	175.2	-63.5	179.8	155	0	0	111.4	S992 L995 L1042 R1043 I1044 L1048 H1049 E1050	S992-E1046 WeakPolarHBondContact CB-OE1 3.48Å; S992-E1046 PolarHBondContact N-OE1 3.3Å; S992-E1046 PolarHBondContact OG-OE1 3.28Å; L995-E1046 HydrophobicContact CD2-CG 3.51Å; L1042-E1046 PolarHBondContact O-N 3.12Å; R1043-E1046 VanDerWaalsContact CD-OE2 3.22Å; R1043-E1046 WeakPolarHBondContact CD-OE2 3.33Å; R1043-E1046 IonicContact CZ-OE2 3.9Å; R1043-E1046 IonicContact NE-OE2 2.97Å; R1043-E1046 IonicContact NH1-OE2 3.28Å; R1043-E1046 PolarHBondContact NH1-OE2 2.75Å; R1043-E1046 PolarHBondContact O-N 3.42Å; I1044-E1046 VanDerWaalsContact C-N 3.34Å; I1044-E1046 PolarHBondContact O-N 2.9Å; E1046-L1048 VanDerWaalsContact C-N 3.34Å; E1046-L1048 PolarHBondContact O-N 3.41Å; E1046-H1049 PolarHBondContact O-N 3.29Å; E1046-E1050 WeakPolarHBondContact O-CB 3.38Å; E1046-E1050 VanDerWaalsContact O-CG 3.28Å; E1046-E1050 WeakPolarHBondContact O-CG 3.33Å; E1046-E1050 PolarHBondContact O-N 2.8Å
1047	L	91	Very high	92.2	Very high	4 Å²	4	33.6 Å²	33.6	2%	0.021	17%	0.167	C	C	.	.	H	α-helix	trans	-64.4	-37.2	-179.8	-67.5	165.8	0	0	0	112.8	Y920 I984 L987 R1043 I1044 K1045 H1049 E1050 H1051	Y920-L1047 HydrophobicContact CE1-CB 4.5Å; Y920-L1047 PolarHBondContact OH-O 2.85Å; I984-L1047 HydrophobicContact CB-CD1 4.47Å; I984-L1047 HydrophobicContact CD1-CD1 3.82Å; I984-L1047 HydrophobicContact CG1-CD1 4.11Å; I984-L1047 HydrophobicContact CG1-CD2 4.46Å; I984-L1047 HydrophobicContact CG2-CD1 3.57Å; I984-L1047 HydrophobicContact CG2-CD2 4.17Å; L987-L1047 HydrophobicContact CD1-CD1 3.99Å; R1043-L1047 HydrophobicContact CG-CD1 4.32Å; R1043-L1047 WeakPolarHBondContact O-CG 2.99Å; R1043-L1047 PolarHBondContact O-N 3.26Å; R1043-L1047 VanDerWaalsContact O-N 3.12Å; I1044-L1047 WeakPolarHBondContact O-CB 3.33Å; I1044-L1047 PolarHBondContact O-N 3.06Å; I1044-L1047 VanDerWaalsContact O-N 3.11Å; K1045-L1047 VanDerWaalsContact C-N 3.35Å; K1045-L1047 PolarHBondContact O-N 3.31Å; L1047-H1049 VanDerWaalsContact C-N 3.34Å; L1047-E1050 PolarHBondContact O-N 3.04Å; L1047-H1051 WeakPolarHBondContact O-CB 3.44Å; L1047-H1051 PolarHBondContact O-N 3.34Å
1048	L	93.3	Very high	92.7	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-62.4	-42	174.9	-70	178.2	0	0	0	111.7	Y920 I1044 K1045 E1046 S1052 F1053 I1058 L1060 V1082 M1086	Y920-L1048 HydrophobicContact CD2-CD2 3.97Å; Y920-L1048 HydrophobicContact CE1-CD2 4.13Å; Y920-L1048 HydrophobicContact CE2-CD2 3.42Å; Y920-L1048 VanDerWaalsContact CE2-CD2 3.42Å; I1044-L1048 HydrophobicContact CG2-CD1 4.14Å; I1044-L1048 HydrophobicContact CG2-CG 4.16Å; I1044-L1048 WeakPolarHBondContact O-CG 3.29Å; I1044-L1048 PolarHBondContact O-N 2.89Å; K1045-L1048 PolarHBondContact O-N 2.9Å; E1046-L1048 VanDerWaalsContact C-N 3.34Å; E1046-L1048 PolarHBondContact O-N 3.41Å; L1048-S1052 CarbonylContact O-C 3.53Å; L1048-S1052 VanDerWaalsContact O-CA 3.32Å; L1048-S1052 WeakPolarHBondContact O-CA 3.32Å; L1048-S1052 WeakPolarHBondContact O-CB 3.5Å; L1048-S1052 PolarHBondContact O-N 3.39Å; L1048-F1053 PolarHBondContact O-N 3.07Å; L1048-I1058 HydrophobicContact CD2-CD1 4.36Å; L1048-I1058 HydrophobicContact CD2-CG2 3.72Å; L1048-L1060 HydrophobicContact CD1-CD1 3.82Å; L1048-L1060 HydrophobicContact CD1-CD2 4.33Å; L1048-L1060 HydrophobicContact CD2-CD2 3.89Å; L1048-V1082 HydrophobicContact CD1-CG1 3.61Å; L1048-V1082 WeakPolarHBondContact CD1-O 3.22Å; L1048-M1086 HydrophobicContact CB-CE 4.09Å; L1048-M1086 HydrophobicContact CB-SD 4.09Å
1049	H	90.9	Very high	93.1	Very high	74 Å²	74	31.4 Å²	31.4	34%	0.343	16%	0.158	S	C	.	.	H	α-helix	trans	-67.3	-41.5	174.2	-85	-71.7	0	0	0	112.3	K1045 E1046 L1047 F1053	K1045-H1049 VanDerWaalsContact CE-NE2 3.31Å; K1045-H1049 WeakPolarHBondContact CE-NE2 3.4Å; K1045-H1049 PolarHBondContact NZ-NE2 2.78Å; K1045-H1049 PolarHBondContact O-CD2 3.31Å; K1045-H1049 PolarHBondContact O-N 2.89Å; E1046-H1049 PolarHBondContact O-N 3.29Å; L1047-H1049 VanDerWaalsContact C-N 3.34Å; H1049-F1053 AromaticContact ND1-CD2 3.96Å
1050	E	89.3	Confident	93.2	Very high	111 Å²	111	29.8 Å²	29.8	52%	0.519	15%	0.152	S	C	.	.	H	α-helix	trans	-65	-40.8	-179.9	-72.9	170.3	-159.4	0	0	112.2	R1043 E1046 L1047	R1043-E1050 IonicContact NH1-OE1 3.73Å; R1043-E1050 PolarHBondContact NH1-OE1 3.4Å; R1043-E1050 IonicContact NH2-OE1 2.82Å; R1043-E1050 IonicContact NH2-OE2 3.69Å; E1046-E1050 WeakPolarHBondContact O-CB 3.38Å; E1046-E1050 VanDerWaalsContact O-CG 3.28Å; E1046-E1050 WeakPolarHBondContact O-CG 3.33Å; E1046-E1050 PolarHBondContact O-N 2.8Å; L1047-E1050 PolarHBondContact O-N 3.04Å
1051	H	91.4	Very high	93.4	Very high	76 Å²	76	29.1 Å²	29.1	35%	0.352	15%	0.151	S	C	.	.	H	α-helix	trans	-118.5	-22.8	-166.9	-65.7	-66.6	0	0	0	116.1	R949 F951 L1047	R949-H1051 PolarHBondContact NH2-O 2.88Å; F951-H1051 HydrophobicContact CE1-CB 3.71Å; F951-H1051 HydrophobicContact CZ-CB 3.94Å; L1047-H1051 WeakPolarHBondContact O-CB 3.44Å; L1047-H1051 PolarHBondContact O-N 3.34Å
1052	S	95.1	Very high	93.6	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	15%	0.147	C	C	.	.			trans	-121.9	5.8	-164	-63.2	0	0	0	0	115	D918 Y920 L1048 G1054 A1055	D918-S1052 WeakPolarHBondContact OD2-CA 3.38Å; D918-S1052 WeakPolarHBondContact OD2-CB 3.49Å; D918-S1052 PolarHBondContact OD2-OG 3Å; Y920-S1052 VanDerWaalsContact CE2-OG 3.27Å; Y920-S1052 WeakPolarHBondContact CE2-OG 3.47Å; Y920-S1052 PolarHBondContact OH-OG 2.99Å; L1048-S1052 CarbonylContact O-C 3.53Å; L1048-S1052 VanDerWaalsContact O-CA 3.32Å; L1048-S1052 WeakPolarHBondContact O-CA 3.32Å; L1048-S1052 WeakPolarHBondContact O-CB 3.5Å; L1048-S1052 PolarHBondContact O-N 3.39Å; S1052-G1054 PolarHBondContact O-N 3.36Å; S1052-G1054 VanDerWaalsContact O-N 3.17Å; S1052-A1055 WeakPolarHBondContact O-CB 3.45Å; S1052-A1055 PolarHBondContact O-N 3.26Å; S1052-A1055 VanDerWaalsContact O-N 3.12Å
1053	F	91.3	Very high	93.4	Very high	114 Å²	114	28.6 Å²	28.6	50%	0.5	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-28.5	178.3	-161.4	-97.5	0	0	0	113.5	L1048 H1049 P1087	L1048-F1053 PolarHBondContact O-N 3.07Å; H1049-F1053 AromaticContact ND1-CD2 3.96Å; F1053-P1087 HydrophobicContact CD1-CG 4.36Å; F1053-P1087 HydrophobicContact CD2-CG 4.27Å; F1053-P1087 HydrophobicContact CE1-CG 4.27Å; F1053-P1087 HydrophobicContact CE2-CG 4.18Å; F1053-P1087 HydrophobicContact CG-CG 4.37Å; F1053-P1087 HydrophobicContact CZ-CG 4.18Å; F1053-P1087 WeakPolarHBondContact O-CG 3.31Å
1054	G	91.1	Very high	93.3	Very high	58 Å²	58	28.1 Å²	28.1	60%	0.598	15%	0.149	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.2	-1.4	178.4	0	0	0	0	0	116	S1052 Q1056	S1052-G1054 PolarHBondContact O-N 3.36Å; S1052-G1054 VanDerWaalsContact O-N 3.17Å; G1054-Q1056 PolarHBondContact O-NE2 3.36Å
1055	A	94.6	Very high	93.2	Very high	4 Å²	4	27.9 Å²	27.9	3%	0.033	15%	0.147	C	C	.	.			trans	-72.4	155.2	-178.6	0	0	0	0	0	111.8	D918 S1052 I1058 C1088	D918-A1055 HydrophobicContact CB-CB 4.3Å; S1052-A1055 WeakPolarHBondContact O-CB 3.45Å; S1052-A1055 PolarHBondContact O-N 3.26Å; S1052-A1055 VanDerWaalsContact O-N 3.12Å; A1055-I1058 HydrophobicContact CB-CG1 4.08Å; A1055-C1088 WeakPolarHBondContact O-CB 3.32Å; A1055-C1088 PolarHBondContact O-SG 3.28Å
1056	Q	95	Very high	92.8	Very high	63 Å²	63	30.4 Å²	30.4	29%	0.294	16%	0.157	S	C	.	.	S	Bend	trans	-96.2	-16.5	177.3	-76	66.2	44	0	0	112.5	L912 A915 V916 L943 G1054 P1089	L912-Q1056 HydrophobicContact CD1-CB 4.02Å; L912-Q1056 HydrophobicContact CD1-CG 3.95Å; A915-Q1056 HydrophobicContact CB-CB 4.01Å; A915-Q1056 HydrophobicContact CB-CG 4.02Å; V916-Q1056 PolarHBondContact O-N 3.42Å; L943-Q1056 HydrophobicContact CD2-CB 4.33Å; G1054-Q1056 PolarHBondContact O-NE2 3.36Å; Q1056-P1089 WeakPolarHBondContact O-CD 3.45Å
1057	L	97.1	Very high	92.2	Very high	1 Å²	1	32.1 Å²	32.1	1%	0.005	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	134.2	170	175.9	66.2	0	0	0	108.3	F661 I917 D918 L936 L943 V1059 P1089 L1091	F661-L1057 HydrophobicContact CE2-CD1 4.27Å; F661-L1057 HydrophobicContact CE2-CD2 4.28Å; F661-L1057 HydrophobicContact CZ-CD1 4.41Å; F661-L1057 HydrophobicContact CZ-CD2 4.32Å; I917-L1057 WeakPolarHBondContact CA-O 3.45Å; I917-L1057 HydrophobicContact CG1-CB 4.45Å; I917-L1057 HydrophobicContact CG2-CB 4.27Å; I917-L1057 HydrophobicContact CG2-CD2 4.16Å; I917-L1057 HydrophobicContact CG2-CG 4.3Å; D918-L1057 PolarHBondContact N-O 2.91Å; L936-L1057 HydrophobicContact CD1-CD2 3.57Å; L943-L1057 HydrophobicContact CD1-CB 3.93Å; L943-L1057 HydrophobicContact CD1-CD2 3.72Å; L943-L1057 HydrophobicContact CD1-CG 4.48Å; L1057-V1059 HydrophobicContact CD2-CG2 4.02Å; L1057-V1059 HydrophobicContact CG-CG2 4.03Å; L1057-P1089 HydrophobicContact CD1-CB 4.04Å; L1057-L1091 HydrophobicContact CD1-CB 4.34Å
1058	I	98	Very high	91.7	Very high	0 Å²	0	37.2 Å²	37.2	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.2	126.1	171.8	-59.9	167.3	0	0	0	107.6	D918 Y920 L1048 A1055 L1060 M1086 C1088 P1089 V1090 L1091	D918-I1058 CarbonylContact O-C 3.54Å; D918-I1058 WeakPolarHBondContact O-CA 3.41Å; Y920-I1058 HydrophobicContact CD2-CG2 4.1Å; Y920-I1058 HydrophobicContact CE2-CG2 4.2Å; L1048-I1058 HydrophobicContact CD2-CD1 4.36Å; L1048-I1058 HydrophobicContact CD2-CG2 3.72Å; A1055-I1058 HydrophobicContact CB-CG1 4.08Å; I1058-L1060 HydrophobicContact CG2-CD1 4.47Å; I1058-L1060 HydrophobicContact CG2-CD2 4.17Å; I1058-L1060 HydrophobicContact CG2-CG 3.94Å; I1058-M1086 HydrophobicContact CD1-CE 3.44Å; I1058-M1086 VanDerWaalsContact CD1-CE 3.44Å; I1058-C1088 VanDerWaalsContact CD1-SG 3.51Å; I1058-P1089 PolarHBondContact N-O 3.17Å; I1058-P1089 VanDerWaalsContact N-O 3.07Å; I1058-V1090 HydrophobicContact CB-CG2 4.43Å; I1058-V1090 CarbonylContact O-C 3.53Å; I1058-V1090 WeakPolarHBondContact O-CA 3.14Å; I1058-L1091 PolarHBondContact O-N 2.84Å
1059	V	97.7	Very high	91.3	Very high	2 Å²	2	39.7 Å²	39.7	1%	0.012	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	115.6	174	-177.2	0	0	0	0	108.5	I917 D918 V919 Y920 P933 L1057 L1091 L1093	I917-V1059 HydrophobicContact CG2-CG2 4.31Å; D918-V1059 PolarHBondContact O-N 2.64Å; V919-V1059 CarbonylContact C-O 3.53Å; V919-V1059 HydrophobicContact CG1-CB 4.42Å; V919-V1059 HydrophobicContact CG2-CB 4.49Å; Y920-V1059 PolarHBondContact N-O 3.26Å; P933-V1059 HydrophobicContact CG-CB 4.1Å; P933-V1059 HydrophobicContact CG-CG1 4.11Å; P933-V1059 HydrophobicContact CG-CG2 3.77Å; L1057-V1059 HydrophobicContact CD2-CG2 4.02Å; L1057-V1059 HydrophobicContact CG-CG2 4.03Å; V1059-L1091 CarbonylContact C-O 3.47Å; V1059-L1091 VanDerWaalsContact CA-O 3.3Å; V1059-L1091 WeakPolarHBondContact CA-O 3.48Å; V1059-L1091 HydrophobicContact CG1-CD2 4.29Å; V1059-L1091 HydrophobicContact CG2-CB 4.16Å; V1059-L1091 HydrophobicContact CG2-CD2 4.14Å; V1059-L1093 HydrophobicContact CG1-CB 3.98Å; V1059-L1093 HydrophobicContact CG1-CD2 3.99Å
1060	L	96.7	Very high	91.2	Very high	5 Å²	5	36.9 Å²	36.9	3%	0.026	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109	137.1	-178.6	-70.7	170.3	0	0	0	109.8	Y920 I1044 L1048 I1058 L1062 V1082 V1090 L1091 Y1092 L1093	Y920-L1060 VanDerWaalsContact CB-CD2 3.47Å; Y920-L1060 HydrophobicContact CD1-CD2 4.22Å; Y920-L1060 HydrophobicContact CD2-CD2 3.74Å; Y920-L1060 HydrophobicContact CG-CD2 3.55Å; I1044-L1060 HydrophobicContact CG2-CD2 4.07Å; L1048-L1060 HydrophobicContact CD1-CD1 3.82Å; L1048-L1060 HydrophobicContact CD1-CD2 4.33Å; L1048-L1060 HydrophobicContact CD2-CD2 3.89Å; I1058-L1060 HydrophobicContact CG2-CD1 4.47Å; I1058-L1060 HydrophobicContact CG2-CD2 4.17Å; I1058-L1060 HydrophobicContact CG2-CG 3.94Å; L1060-L1062 PolarHBondContact O-N 2.95Å; L1060-L1062 VanDerWaalsContact O-N 3.12Å; L1060-V1082 HydrophobicContact CD1-CG1 3.93Å; L1060-V1090 HydrophobicContact CD1-CG1 3.6Å; L1060-V1090 HydrophobicContact CG-CG1 4.25Å; L1060-L1091 PolarHBondContact N-O 3.24Å; L1060-Y1092 HydrophobicContact CB-CD1 3.83Å; L1060-Y1092 HydrophobicContact CB-CE1 3.99Å; L1060-Y1092 HydrophobicContact CD1-CD1 4.25Å; L1060-Y1092 HydrophobicContact CD1-CE1 3.58Å; L1060-Y1092 HydrophobicContact CG-CE1 4.44Å; L1060-Y1092 CarbonylContact O-C 3.56Å; L1060-Y1092 WeakPolarHBondContact O-CA 3.45Å; L1060-L1093 PolarHBondContact O-N 3.34Å
1061	T	93.9	Very high	91.3	Very high	13 Å²	13	31.8 Å²	31.8	8%	0.08	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	117	169.6	-54.3	0	0	0	0	109.4	Y920 L922 F923 L1093	Y920-T1061 PolarHBondContact O-N 3Å; Y920-T1061 VanDerWaalsContact O-N 3.09Å; Y920-T1061 PolarHBondContact O-OG1 2.74Å; L922-T1061 PolarHBondContact N-OG1 3.03Å; L922-T1061 VanDerWaalsContact N-OG1 3.11Å; F923-T1061 HydrophobicContact CB-CG2 4.06Å; F923-T1061 HydrophobicContact CD2-CG2 4.19Å; T1061-L1093 CarbonylContact C-O 3.17Å; T1061-L1093 WeakPolarHBondContact CA-O 3.12Å
1062	L	94.8	Very high	91.3	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-71.4	124.1	179.2	179.2	75.6	0	0	0	109.3	F765 L771 I773 L1060 Y1075 L1079 Y1092 L1093 R1094	F765-L1062 HydrophobicContact CZ-CD2 4.15Å; L771-L1062 HydrophobicContact CB-CD2 4.35Å; L771-L1062 HydrophobicContact CD2-CD2 3.66Å; L771-L1062 HydrophobicContact CG-CD2 3.95Å; I773-L1062 HydrophobicContact CD1-CD1 4.09Å; I773-L1062 HydrophobicContact CD1-CD2 4.07Å; I773-L1062 HydrophobicContact CG1-CD2 4.42Å; L1060-L1062 PolarHBondContact O-N 2.95Å; L1060-L1062 VanDerWaalsContact O-N 3.12Å; L1062-Y1075 WeakPolarHBondContact CD1-OH 3.42Å; L1062-Y1075 WeakPolarHBondContact CG-OH 3.45Å; L1062-L1079 HydrophobicContact CD1-CD1 3.85Å; L1062-L1079 HydrophobicContact CD1-CD2 3.64Å; L1062-L1079 HydrophobicContact CD1-CG 4.42Å; L1062-Y1092 HydrophobicContact CD1-CD1 4.17Å; L1062-Y1092 HydrophobicContact CD1-CG 4Å; L1062-L1093 PolarHBondContact N-O 3.38Å; L1062-R1094 HydrophobicContact CB-CB 4Å; L1062-R1094 WeakPolarHBondContact O-CD 3.3Å
1063	P	91.3	Very high	91.2	Very high	11 Å²	11	28.1 Å²	28.1	7%	0.071	16%	0.162	C	C	.	.	P	Polyproline II helix	trans	-66.6	134.3	176.5	26.6	-33.4	0	0	0	110.5	P1065 Y1075 L1079	P1063-P1065 WeakPolarHBondContact O-CD 3.42Å; P1063-Y1075 HydrophobicContact CG-CE2 4.15Å; P1063-Y1075 VanDerWaalsContact O-CE2 3.32Å; P1063-Y1075 WeakPolarHBondContact O-CE2 3.5Å; P1063-Y1075 PolarHBondContact O-OH 3.12Å; P1063-L1079 HydrophobicContact CG-CD2 4.34Å
1064	I	88.5	Confident	91.3	Very high	14 Å²	14	22.7 Å²	22.7	7%	0.072	14%	0.138	C	C	.	.	P	Polyproline II helix	trans	-77.1	121.6	178.6	-63.8	169.7	0	0	0	109.4	E87 L111 L114 H115 F765 R1066 R1094	E87-I1064 PolarHBondContact OE1-N 3.5Å; L111-I1064 HydrophobicContact CD1-CD1 3.94Å; L114-I1064 HydrophobicContact CB-CD1 3.83Å; L114-I1064 HydrophobicContact CB-CG2 4.49Å; L114-I1064 HydrophobicContact CD1-CD1 3.65Å; L114-I1064 HydrophobicContact CG-CD1 4.35Å; H115-I1064 HydrophobicContact CB-CG2 4.19Å; F765-I1064 HydrophobicContact CZ-CG1 4.36Å; I1064-R1066 PolarHBondContact O-N 3.2Å; I1064-R1094 HydrophobicContact CD1-CG 4.16Å; I1064-R1094 VanDerWaalsContact CD1-NE 3.32Å; I1064-R1094 HydrophobicContact CG1-CG 3.91Å
1065	P	89.3	Confident	91.5	Very high	3 Å²	3	20 Å²	20	2%	0.019	11%	0.11	C	C	.	.	P	Polyproline II helix	trans	-74.1	122.5	174.2	29	-29.7	0	0	0	109.8	H115 F758 I761 H762 P1063 I1070 Y1075	H115-P1065 PolarHBondContact CD2-O 2.87Å; F758-P1065 HydrophobicContact CE2-CB 3.72Å; F758-P1065 HydrophobicContact CE2-CG 4.04Å; F758-P1065 HydrophobicContact CZ-CB 3.69Å; F758-P1065 HydrophobicContact CZ-CG 4.34Å; I761-P1065 HydrophobicContact CG2-CG 3.84Å; H762-P1065 PolarHBondContact CE1-O 2.87Å; H762-P1065 VanDerWaalsContact CE1-O 3.31Å; P1063-P1065 WeakPolarHBondContact O-CD 3.42Å; P1065-I1070 HydrophobicContact CB-CG2 3.87Å; P1065-Y1075 HydrophobicContact CB-CD2 3.88Å; P1065-Y1075 HydrophobicContact CB-CE2 3.74Å; P1065-Y1075 HydrophobicContact CG-CE2 4Å
1066	R	85.5	Confident	91.5	Very high	59 Å²	59	19.8 Å²	19.8	22%	0.223	11%	0.108	C	C	.	.	P	Polyproline II helix	trans	-75	134.3	171.3	-79.9	-177	174.7	-110	-25.5	109.7	E113 L114 I1064 S1068 V1069	E113-R1066 PolarHBondContact O-NH2 3.35Å; L114-R1066 WeakPolarHBondContact O-CG 3.46Å; L114-R1066 PolarHBondContact O-NE 3.17Å; L114-R1066 PolarHBondContact O-NH2 2.92Å; I1064-R1066 PolarHBondContact O-N 3.2Å; R1066-S1068 PolarHBondContact O-N 3.29Å; R1066-V1069 HydrophobicContact CB-CB 3.87Å; R1066-V1069 HydrophobicContact CB-CG2 3.8Å; R1066-V1069 PolarHBondContact O-N 3.4Å
1067	K	81.5	Confident	91.5	Very high	62 Å²	62	16.8 Å²	16.8	27%	0.27	9%	0.094	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	135.6	178.4	-67.3	-179	-176.7	174.3	0	110.3	H115 D766 V1069	H115-K1067 WeakPolarHBondContact CE1-CE 3.35Å; H115-K1067 VanDerWaalsContact ND1-CE 3.34Å; H115-K1067 WeakPolarHBondContact ND1-CE 3.08Å; H115-K1067 PolarHBondContact O-N 3.32Å; H115-K1067 VanDerWaalsContact O-N 3.16Å; D766-K1067 WeakPolarHBondContact OD1-CE 3.47Å; D766-K1067 IonicContact OD1-NZ 3.69Å; D766-K1067 PolarHBondContact OD1-NZ 3.42Å; D766-K1067 IonicContact OD2-NZ 3.7Å; D766-K1067 PolarHBondContact OD2-NZ 2.89Å; K1067-V1069 PolarHBondContact O-N 3.08Å
1068	S	79.2	Confident	91.4	Very high	111 Å²	111	17.3 Å²	17.3	78%	0.776	10%	0.096	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.2	9.5	176.8	-53.6	0	0	0	0	116.6	R1066	R1066-S1068 PolarHBondContact O-N 3.29Å
1069	V	84.7	Confident	91.2	Very high	52 Å²	52	17.3 Å²	17.3	32%	0.315	10%	0.096	S	C	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-32.5	178.7	175.1	0	0	0	0	112.1	L1034 R1066 K1067	L1034-V1069 HydrophobicContact CD2-CG1 4.05Å; R1066-V1069 HydrophobicContact CB-CB 3.87Å; R1066-V1069 HydrophobicContact CB-CG2 3.8Å; R1066-V1069 PolarHBondContact O-N 3.4Å; K1067-V1069 PolarHBondContact O-N 3.08Å
1070	I	89.4	Confident	91.1	Very high	15 Å²	15	17.9 Å²	17.9	8%	0.077	10%	0.099	C	C	.	.	S	Bend	trans	-127.9	134.2	-176.4	-173.3	165.1	0	0	0	110.8	F758 L1034 P1065 L1074 Y1075 W1078	F758-I1070 HydrophobicContact CZ-CG2 3.97Å; L1034-I1070 HydrophobicContact CD1-CB 3.75Å; L1034-I1070 HydrophobicContact CD1-CD1 4Å; L1034-I1070 HydrophobicContact CD1-CG1 3.81Å; P1065-I1070 HydrophobicContact CB-CG2 3.87Å; I1070-L1074 HydrophobicContact CD1-CB 4.34Å; I1070-L1074 HydrophobicContact CD1-CD2 4.28Å; I1070-L1074 HydrophobicContact CD1-CG 4.14Å; I1070-L1074 HydrophobicContact CG1-CB 4.05Å; I1070-L1074 HydrophobicContact CG1-CD2 4.2Å; I1070-L1074 HydrophobicContact CG1-CG 4.26Å; I1070-Y1075 HydrophobicContact CD1-CD2 4.07Å; I1070-W1078 HydrophobicContact CD1-CD2 4.28Å; I1070-W1078 HydrophobicContact CD1-CE3 3.78Å; I1070-W1078 HydrophobicContact CD1-CH2 3.34Å; I1070-W1078 HydrophobicContact CD1-CZ2 3.88Å; I1070-W1078 HydrophobicContact CD1-CZ3 3.28Å
1071	S	91.4	Very high	91	Very high	4 Å²	4	17.7 Å²	17.7	3%	0.028	10%	0.098	C	C	.	.			trans	-72.9	151.5	175.1	61.5	0	0	0	0	111.6	D1023 E1030 S1073 L1074 Y1075	D1023-S1071 VanDerWaalsContact O-CA 3.22Å; D1023-S1071 WeakPolarHBondContact O-CA 3.46Å; D1023-S1071 WeakPolarHBondContact O-CB 3.3Å; E1030-S1071 VanDerWaalsContact CD-OG 3.31Å; E1030-S1071 WeakPolarHBondContact OE1-CB 3.33Å; E1030-S1071 PolarHBondContact OE1-N 3.13Å; E1030-S1071 PolarHBondContact OE1-OG 2.9Å; E1030-S1071 WeakPolarHBondContact OE2-CB 3.39Å; E1030-S1071 PolarHBondContact OE2-OG 2.77Å; E1030-S1071 VanDerWaalsContact OE2-OG 3.07Å; S1071-S1073 VanDerWaalsContact C-N 3.27Å; S1071-S1073 PolarHBondContact O-N 3.33Å; S1071-L1074 PolarHBondContact O-N 2.9Å; S1071-L1074 WeakPolarHBondContact OG-CB 3.04Å; S1071-L1074 PolarHBondContact OG-N 3.21Å; S1071-Y1075 PolarHBondContact O-N 2.89Å
1072	A	91.4	Very high	91	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-56.7	-42.2	178.6	0	0	0	0	0	111.9	V754 F758 D1023 Y1075 L1076	V754-A1072 HydrophobicContact CG1-CB 3.99Å; F758-A1072 HydrophobicContact CB-CB 3.6Å; F758-A1072 HydrophobicContact CD1-CB 3.65Å; F758-A1072 HydrophobicContact CE1-CB 4.49Å; F758-A1072 HydrophobicContact CG-CB 3.71Å; D1023-A1072 PolarHBondContact O-N 3.3Å; A1072-Y1075 PolarHBondContact O-N 3.22Å; A1072-L1076 WeakPolarHBondContact O-CG 3.41Å; A1072-L1076 PolarHBondContact O-N 2.78Å
1073	S	93	Very high	90.9	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-67.2	-41.8	-180	-62.6	0	0	0	0	112.6	V1024 S1071 S1077	V1024-S1073 WeakPolarHBondContact O-CB 3.48Å; V1024-S1073 PolarHBondContact O-N 2.86Å; V1024-S1073 VanDerWaalsContact O-N 3.13Å; V1024-S1073 PolarHBondContact O-OG 2.95Å; S1071-S1073 VanDerWaalsContact C-N 3.27Å; S1071-S1073 PolarHBondContact O-N 3.33Å; S1073-S1077 WeakPolarHBondContact O-CB 3.49Å; S1073-S1077 PolarHBondContact O-N 2.57Å; S1073-S1077 PolarHBondContact O-OG 3.4Å
1074	L	93.1	Very high	90.9	Very high	0 Å²	0	19.2 Å²	19.2	0%	0	10%	0.102	C	C	.	.	H	α-helix	trans	-65.3	-43.7	177.9	-174.8	58.7	0	0	0	110.5	F999 I1026 E1030 Y1031 L1034 I1070 S1071 S1077 W1078	F999-L1074 HydrophobicContact CZ-CD1 4.38Å; I1026-L1074 HydrophobicContact CD1-CB 4.1Å; I1026-L1074 HydrophobicContact CD1-CD1 4.14Å; I1026-L1074 HydrophobicContact CG1-CB 3.95Å; I1026-L1074 HydrophobicContact CG2-CB 4.45Å; I1026-L1074 HydrophobicContact CG2-CD1 4.43Å; E1030-L1074 HydrophobicContact CG-CD2 4.32Å; E1030-L1074 WeakPolarHBondContact OE1-CD2 3.41Å; Y1031-L1074 HydrophobicContact CD2-CD1 4.2Å; L1034-L1074 HydrophobicContact CB-CD2 4.23Å; L1034-L1074 HydrophobicContact CD1-CD2 3.8Å; I1070-L1074 HydrophobicContact CD1-CB 4.34Å; I1070-L1074 HydrophobicContact CD1-CD2 4.28Å; I1070-L1074 HydrophobicContact CD1-CG 4.14Å; I1070-L1074 HydrophobicContact CG1-CB 4.05Å; I1070-L1074 HydrophobicContact CG1-CD2 4.2Å; I1070-L1074 HydrophobicContact CG1-CG 4.26Å; S1071-L1074 PolarHBondContact O-N 2.9Å; S1071-L1074 WeakPolarHBondContact OG-CB 3.04Å; S1071-L1074 PolarHBondContact OG-N 3.21Å; L1074-S1077 WeakPolarHBondContact CA-OG 3.2Å; L1074-S1077 PolarHBondContact O-N 3.33Å; L1074-S1077 PolarHBondContact O-OG 3.27Å; L1074-W1078 HydrophobicContact CD2-CZ2 4.1Å; L1074-W1078 HydrophobicContact CG-CZ2 4.1Å; L1074-W1078 PolarHBondContact O-N 3.32Å; L1074-W1078 VanDerWaalsContact O-N 3.09Å
1075	Y	94.7	Very high	90.9	Very high	1 Å²	1	22.8 Å²	22.8	0%	0.004	12%	0.122	C	C	.	.	H	α-helix	trans	-62.8	-48.6	179.1	-173	-97.1	0	0	0	112.7	F758 I761 L1062 P1063 P1065 I1070 S1071 A1072 S1077 W1078 L1079	F758-Y1075 AromaticContact CD2-CD1 3.73Å; F758-Y1075 HydrophobicContact CD2-CD1 3.73Å; F758-Y1075 HydrophobicContact CD2-CE1 4.41Å; F758-Y1075 HydrophobicContact CD2-CG 4.09Å; F758-Y1075 AromaticContact CE2-CD1 3.5Å; F758-Y1075 HydrophobicContact CE2-CD1 3.5Å; F758-Y1075 VanDerWaalsContact CE2-CD1 3.5Å; F758-Y1075 HydrophobicContact CE2-CD2 4.11Å; F758-Y1075 HydrophobicContact CE2-CE1 4.16Å; F758-Y1075 AromaticContact CE2-CG 3.46Å; F758-Y1075 HydrophobicContact CE2-CG 3.46Å; F758-Y1075 VanDerWaalsContact CE2-CG 3.46Å; F758-Y1075 HydrophobicContact CZ-CG 4.34Å; I761-Y1075 HydrophobicContact CD1-CD1 4.27Å; I761-Y1075 HydrophobicContact CD1-CE1 3.63Å; L1062-Y1075 WeakPolarHBondContact CD1-OH 3.42Å; L1062-Y1075 WeakPolarHBondContact CG-OH 3.45Å; P1063-Y1075 HydrophobicContact CG-CE2 4.15Å; P1063-Y1075 VanDerWaalsContact O-CE2 3.32Å; P1063-Y1075 WeakPolarHBondContact O-CE2 3.5Å; P1063-Y1075 PolarHBondContact O-OH 3.12Å; P1065-Y1075 HydrophobicContact CB-CD2 3.88Å; P1065-Y1075 HydrophobicContact CB-CE2 3.74Å; P1065-Y1075 HydrophobicContact CG-CE2 4Å; I1070-Y1075 HydrophobicContact CD1-CD2 4.07Å; S1071-Y1075 PolarHBondContact O-N 2.89Å; A1072-Y1075 PolarHBondContact O-N 3.22Å; Y1075-S1077 VanDerWaalsContact C-N 3.29Å; Y1075-S1077 PolarHBondContact O-N 3.42Å; Y1075-W1078 HydrophobicContact CD2-CE3 4.43Å; Y1075-W1078 WeakPolarHBondContact O-CB 3.48Å; Y1075-W1078 PolarHBondContact O-N 3.48Å; Y1075-L1079 HydrophobicContact CD1-CD1 4.16Å; Y1075-L1079 HydrophobicContact CE1-CD1 3.61Å; Y1075-L1079 HydrophobicContact CE1-CG 4.23Å; Y1075-L1079 PolarHBondContact O-N 3.28Å
1076	L	94.9	Very high	91	Very high	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-65.3	-33.9	176.5	-69.1	-174.5	0	0	0	112.1	F742 W746 V754 Y757 A1072 W1078 L1079 D1080	F742-L1076 HydrophobicContact CE2-CD2 4.13Å; W746-L1076 HydrophobicContact CB-CD1 3.9Å; W746-L1076 HydrophobicContact CD2-CB 4.05Å; W746-L1076 HydrophobicContact CD2-CD1 4.23Å; W746-L1076 HydrophobicContact CE3-CB 4.09Å; W746-L1076 HydrophobicContact CE3-CD1 4.2Å; W746-L1076 HydrophobicContact CG-CD1 4.13Å; W746-L1076 HydrophobicContact CZ3-CB 4.39Å; V754-L1076 HydrophobicContact CG1-CD1 3.76Å; Y757-L1076 HydrophobicContact CD1-CD1 4.41Å; Y757-L1076 HydrophobicContact CD1-CD2 3.89Å; Y757-L1076 HydrophobicContact CE1-CD2 3.77Å; A1072-L1076 WeakPolarHBondContact O-CG 3.41Å; A1072-L1076 PolarHBondContact O-N 2.78Å; L1076-W1078 VanDerWaalsContact C-N 3.29Å; L1076-W1078 PolarHBondContact O-N 3.39Å; L1076-L1079 PolarHBondContact O-N 2.9Å; L1076-D1080 VanDerWaalsContact O-CB 3.31Å; L1076-D1080 WeakPolarHBondContact O-CB 3.05Å; L1076-D1080 PolarHBondContact O-N 3.42Å
1077	S	94.6	Very high	91.1	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-62.7	-36.4	175.3	76.8	0	0	0	0	112.4	F999 S1073 L1074 Y1075 F1081	F999-S1077 WeakPolarHBondContact CZ-OG 3.38Å; S1073-S1077 WeakPolarHBondContact O-CB 3.49Å; S1073-S1077 PolarHBondContact O-N 2.57Å; S1073-S1077 PolarHBondContact O-OG 3.4Å; L1074-S1077 WeakPolarHBondContact CA-OG 3.2Å; L1074-S1077 PolarHBondContact O-N 3.33Å; L1074-S1077 PolarHBondContact O-OG 3.27Å; Y1075-S1077 VanDerWaalsContact C-N 3.29Å; Y1075-S1077 PolarHBondContact O-N 3.42Å; S1077-F1081 WeakPolarHBondContact O-CB 3.25Å; S1077-F1081 PolarHBondContact O-N 3.21Å
1078	W	94.9	Very high	91.7	Very high	11 Å²	11	21.2 Å²	21.2	4%	0.042	13%	0.126	C	C	.	.	H	α-helix	trans	-63.1	-50.4	174.2	-68	-12.1	0	0	0	111.4	F999 L1034 K1037 T1038 Q1041 I1070 L1074 Y1075 L1076 V1082	F999-W1078 AromaticContact CZ-CD1 3.68Å; L1034-W1078 HydrophobicContact CB-CH2 4.4Å; L1034-W1078 HydrophobicContact CB-CZ2 4.21Å; L1034-W1078 HydrophobicContact CD1-CH2 4.35Å; K1037-W1078 HydrophobicContact CB-CH2 3.62Å; K1037-W1078 HydrophobicContact CB-CZ2 4.04Å; K1037-W1078 HydrophobicContact CB-CZ3 4.37Å; K1037-W1078 HydrophobicContact CD-CH2 4.33Å; T1038-W1078 WeakPolarHBondContact OG1-CZ2 3.39Å; T1038-W1078 PolarHBondContact OG1-NE1 3.25Å; T1038-W1078 VanDerWaalsContact OG1-NE1 3.13Å; Q1041-W1078 HydrophobicContact CB-CB 4.39Å; Q1041-W1078 HydrophobicContact CB-CG 4.31Å; Q1041-W1078 HydrophobicContact CG-CB 4.06Å; Q1041-W1078 HydrophobicContact CG-CD2 3.9Å; Q1041-W1078 HydrophobicContact CG-CE3 4.1Å; Q1041-W1078 HydrophobicContact CG-CG 3.9Å; I1070-W1078 HydrophobicContact CD1-CD2 4.28Å; I1070-W1078 HydrophobicContact CD1-CE3 3.78Å; I1070-W1078 HydrophobicContact CD1-CH2 3.34Å; I1070-W1078 HydrophobicContact CD1-CZ2 3.88Å; I1070-W1078 HydrophobicContact CD1-CZ3 3.28Å; L1074-W1078 HydrophobicContact CD2-CZ2 4.1Å; L1074-W1078 HydrophobicContact CG-CZ2 4.1Å; L1074-W1078 PolarHBondContact O-N 3.32Å; L1074-W1078 VanDerWaalsContact O-N 3.09Å; Y1075-W1078 HydrophobicContact CD2-CE3 4.43Å; Y1075-W1078 WeakPolarHBondContact O-CB 3.48Å; Y1075-W1078 PolarHBondContact O-N 3.48Å; L1076-W1078 VanDerWaalsContact C-N 3.29Å; L1076-W1078 PolarHBondContact O-N 3.39Å; W1078-V1082 VanDerWaalsContact O-CB 3.28Å; W1078-V1082 WeakPolarHBondContact O-CB 3.31Å; W1078-V1082 WeakPolarHBondContact O-CG2 3.49Å; W1078-V1082 PolarHBondContact O-N 2.72Å
1079	L	95.3	Very high	92.4	Very high	0 Å²	0	16.4 Å²	16.4	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-63.7	-45.1	-179.7	-59.7	-174.1	0	0	0	111.4	F742 I773 L1062 P1063 Y1075 L1076 S1083 Y1092	F742-L1079 HydrophobicContact CD2-CB 4.42Å; F742-L1079 HydrophobicContact CE2-CB 3.72Å; F742-L1079 HydrophobicContact CE2-CD1 4.27Å; F742-L1079 HydrophobicContact CZ-CB 4.47Å; I773-L1079 HydrophobicContact CD1-CD1 4.3Å; L1062-L1079 HydrophobicContact CD1-CD1 3.85Å; L1062-L1079 HydrophobicContact CD1-CD2 3.64Å; L1062-L1079 HydrophobicContact CD1-CG 4.42Å; P1063-L1079 HydrophobicContact CG-CD2 4.34Å; Y1075-L1079 HydrophobicContact CD1-CD1 4.16Å; Y1075-L1079 HydrophobicContact CE1-CD1 3.61Å; Y1075-L1079 HydrophobicContact CE1-CG 4.23Å; Y1075-L1079 PolarHBondContact O-N 3.28Å; L1076-L1079 PolarHBondContact O-N 2.9Å; L1079-S1083 PolarHBondContact O-N 2.97Å; L1079-S1083 PolarHBondContact O-OG 3.21Å; L1079-Y1092 HydrophobicContact CB-CE2 4.19Å; L1079-Y1092 HydrophobicContact CD2-CD1 3.75Å; L1079-Y1092 HydrophobicContact CD2-CD2 4.41Å; L1079-Y1092 HydrophobicContact CD2-CE1 3.67Å; L1079-Y1092 HydrophobicContact CD2-CE2 4.36Å; L1079-Y1092 HydrophobicContact CD2-CG 4.13Å; L1079-Y1092 PolarHBondContact O-OH 3.13Å
1080	D	95	Very high	93	Very high	15 Å²	15	14 Å²	14	8%	0.08	8%	0.077	C	C	.	.	H	α-helix	trans	-65.4	-49.9	-179.4	-162.2	16.4	0	0	0	111	F742 W746 R775 F1002 L1076 V1082 S1083 K1084	F742-D1080 HydrophobicContact CE1-CB 4.19Å; F742-D1080 HydrophobicContact CZ-CB 3.78Å; W746-D1080 HydrophobicContact CZ2-CB 4.26Å; W746-D1080 PolarHBondContact NE1-OD2 2.98Å; R775-D1080 IonicContact CZ-OD1 2.72Å; R775-D1080 IonicContact NE-OD1 3.75Å; R775-D1080 PolarHBondContact NE-OD1 2.98Å; R775-D1080 IonicContact NH2-OD1 3.84Å; R775-D1080 PolarHBondContact NH2-OD1 3.37Å; F1002-D1080 HydrophobicContact CE1-CB 4.41Å; F1002-D1080 HydrophobicContact CZ-CB 4.08Å; F1002-D1080 WeakPolarHBondContact CZ-OD2 3.4Å; L1076-D1080 VanDerWaalsContact O-CB 3.31Å; L1076-D1080 WeakPolarHBondContact O-CB 3.05Å; L1076-D1080 PolarHBondContact O-N 3.42Å; D1080-V1082 PolarHBondContact O-N 3.43Å; D1080-S1083 PolarHBondContact O-N 3.38Å; D1080-S1083 PolarHBondContact O-OG 2.96Å; D1080-K1084 WeakPolarHBondContact O-CB 3.3Å; D1080-K1084 PolarHBondContact O-N 3.12Å
1081	F	94.6	Very high	93.4	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-65.7	-39.2	-175.7	-165.4	-95	0	0	0	112.7	L995 E998 F999 F1002 L1042 K1045 S1077 S1083	L995-F1081 HydrophobicContact CD1-CE1 3.61Å; L995-F1081 HydrophobicContact CD1-CZ 3.79Å; L995-F1081 HydrophobicContact CG-CE1 3.96Å; L995-F1081 HydrophobicContact CG-CZ 4.37Å; E998-F1081 HydrophobicContact CB-CE2 4.46Å; E998-F1081 HydrophobicContact CB-CZ 4.11Å; E998-F1081 HydrophobicContact CG-CE2 3.97Å; E998-F1081 HydrophobicContact CG-CZ 3.99Å; F999-F1081 HydrophobicContact CB-CE1 4.07Å; F999-F1081 HydrophobicContact CB-CE2 4.23Å; F999-F1081 HydrophobicContact CB-CZ 3.91Å; F999-F1081 HydrophobicContact CD2-CB 3.91Å; F999-F1081 AromaticContact CD2-CD1 3.72Å; F999-F1081 HydrophobicContact CD2-CD1 3.72Å; F999-F1081 AromaticContact CD2-CD2 3.76Å; F999-F1081 HydrophobicContact CD2-CD2 3.76Å; F999-F1081 HydrophobicContact CD2-CE1 4.12Å; F999-F1081 HydrophobicContact CD2-CE2 4.14Å; F999-F1081 AromaticContact CD2-CG 3.52Å; F999-F1081 HydrophobicContact CD2-CG 3.52Å; F999-F1081 HydrophobicContact CD2-CZ 4.31Å; F999-F1081 HydrophobicContact CE2-CB 3.92Å; F999-F1081 HydrophobicContact CE2-CD1 4.45Å; F999-F1081 HydrophobicContact CE2-CD2 4.5Å; F999-F1081 HydrophobicContact CE2-CG 4.06Å; F1002-F1081 HydrophobicContact CB-CD2 3.92Å; F1002-F1081 HydrophobicContact CB-CE2 3.94Å; F1002-F1081 HydrophobicContact CD1-CB 4.34Å; F1002-F1081 AromaticContact CD1-CD2 3.78Å; F1002-F1081 HydrophobicContact CD1-CD2 3.78Å; F1002-F1081 HydrophobicContact CD1-CG 4.49Å; F1002-F1081 AromaticContact CD2-CD2 3.81Å; F1002-F1081 HydrophobicContact CD2-CD2 3.81Å; F1002-F1081 HydrophobicContact CD2-CE2 4.26Å; F1002-F1081 HydrophobicContact CE1-CB 4.1Å; F1002-F1081 HydrophobicContact CE1-CD2 4.16Å; F1002-F1081 HydrophobicContact CE2-CD2 4.18Å; F1002-F1081 AromaticContact CG-CD2 3.58Å; F1002-F1081 HydrophobicContact CG-CD2 3.58Å; F1002-F1081 HydrophobicContact CG-CE2 4.06Å; F1002-F1081 HydrophobicContact CZ-CB 4.46Å; F1002-F1081 HydrophobicContact CZ-CD2 4.33Å; L1042-F1081 HydrophobicContact CD2-CD1 3.47Å; L1042-F1081 VanDerWaalsContact CD2-CD1 3.47Å; L1042-F1081 HydrophobicContact CD2-CE1 3.46Å; L1042-F1081 VanDerWaalsContact CD2-CE1 3.46Å; K1045-F1081 WeakPolarHBondContact CD-O 3.32Å; K1045-F1081 VanDerWaalsContact CE-O 3.3Å; K1045-F1081 WeakPolarHBondContact CE-O 3.26Å; K1045-F1081 HydrophobicContact CG-CD1 4.5Å; K1045-F1081 HydrophobicContact CG-CE1 4.42Å; S1077-F1081 WeakPolarHBondContact O-CB 3.25Å; S1077-F1081 PolarHBondContact O-N 3.21Å; F1081-S1083 VanDerWaalsContact C-N 3.29Å; F1081-S1083 PolarHBondContact O-N 3.42Å
1082	V	94.4	Very high	93.7	Very high	2 Å²	2	13.1 Å²	13.1	1%	0.012	7%	0.072	C	C	.	.	H	α-helix	trans	-64.5	-34.8	177.8	170.3	0	0	0	0	112.1	Q1041 I1044 K1045 L1048 L1060 W1078 D1080	Q1041-V1082 HydrophobicContact CB-CG2 3.94Å; Q1041-V1082 VanDerWaalsContact O-CG2 3.27Å; Q1041-V1082 WeakPolarHBondContact O-CG2 3.28Å; I1044-V1082 HydrophobicContact CG2-CG1 3.92Å; K1045-V1082 HydrophobicContact CB-CG2 4.44Å; K1045-V1082 WeakPolarHBondContact CD-O 3.31Å; L1048-V1082 HydrophobicContact CD1-CG1 3.61Å; L1048-V1082 WeakPolarHBondContact CD1-O 3.22Å; L1060-V1082 HydrophobicContact CD1-CG1 3.93Å; W1078-V1082 VanDerWaalsContact O-CB 3.28Å; W1078-V1082 WeakPolarHBondContact O-CB 3.31Å; W1078-V1082 WeakPolarHBondContact O-CG2 3.49Å; W1078-V1082 PolarHBondContact O-N 2.72Å; D1080-V1082 PolarHBondContact O-N 3.43Å
1083	S	93	Very high	94	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-100.7	-10.4	-176.5	57.2	0	0	0	0	114.3	R775 Q777 L1079 D1080 F1081 M1086 Y1092	R775-S1083 WeakPolarHBondContact CD-OG 3.46Å; R775-S1083 VanDerWaalsContact CZ-OG 3.22Å; R775-S1083 PolarHBondContact NE-OG 3.01Å; R775-S1083 VanDerWaalsContact NE-OG 3.1Å; R775-S1083 PolarHBondContact NH1-O 2.84Å; R775-S1083 PolarHBondContact NH1-OG 3.49Å; Q777-S1083 PolarHBondContact NE2-O 3.13Å; L1079-S1083 PolarHBondContact O-N 2.97Å; L1079-S1083 PolarHBondContact O-OG 3.21Å; D1080-S1083 PolarHBondContact O-N 3.38Å; D1080-S1083 PolarHBondContact O-OG 2.96Å; F1081-S1083 VanDerWaalsContact C-N 3.29Å; F1081-S1083 PolarHBondContact O-N 3.42Å; S1083-M1086 PolarHBondContact O-N 3.26Å; S1083-Y1092 VanDerWaalsContact CB-OH 3.29Å; S1083-Y1092 WeakPolarHBondContact CB-OH 3.42Å; S1083-Y1092 PolarHBondContact OG-OH 2.92Å
1084	K	90.6	Very high	94.1	Very high	54 Å²	54	13.2 Å²	13.2	24%	0.235	7%	0.073	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.1	146.4	172.5	-165.5	-169.6	163.1	-164.9	0	110.1	E998 F1002 K1045 D1080 M1086	E998-K1084 IonicContact OE1-NZ 2.77Å; E998-K1084 PolarHBondContact OE1-NZ 3.2Å; F1002-K1084 HydrophobicContact CE2-CD 4.15Å; K1045-K1084 PolarHBondContact NZ-O 3.17Å; D1080-K1084 WeakPolarHBondContact O-CB 3.3Å; D1080-K1084 PolarHBondContact O-N 3.12Å; K1084-M1086 PolarHBondContact O-N 2.94Å
1085	D	87.6	Confident	94	Very high	90 Å²	90	13.3 Å²	13.3	48%	0.481	7%	0.074	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.6	6.3	174	-47.3	-44.6	0	0	0	117.4
1086	M	91.9	Very high	93.7	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.078	C	C	.	.			trans	-78.3	128.1	171.1	-63.4	-51.9	-64	0	0	110.3	Q777 L1048 I1058 S1083 K1084 C1088 V1090	Q777-M1086 WeakPolarHBondContact CG-O 3.43Å; Q777-M1086 PolarHBondContact NE2-O 3.15Å; L1048-M1086 HydrophobicContact CB-CE 4.09Å; L1048-M1086 HydrophobicContact CB-SD 4.09Å; I1058-M1086 HydrophobicContact CD1-CE 3.44Å; I1058-M1086 VanDerWaalsContact CD1-CE 3.44Å; S1083-M1086 PolarHBondContact O-N 3.26Å; K1084-M1086 PolarHBondContact O-N 2.94Å; M1086-C1088 VanDerWaalsContact C-N 3.28Å; M1086-C1088 PolarHBondContact O-N 3.05Å; M1086-V1090 HydrophobicContact CB-CG2 4.19Å; M1086-V1090 HydrophobicContact CG-CG2 4.46Å
1087	P	88.5	Confident	93.2	Very high	77 Å²	77	14.8 Å²	14.8	50%	0.5	8%	0.081	S	C	.	.	S	Bend	trans	-72.3	-21.8	-173.9	27.7	-34.7	0	0	0	113.3	F1053	F1053-P1087 HydrophobicContact CD1-CG 4.36Å; F1053-P1087 HydrophobicContact CD2-CG 4.27Å; F1053-P1087 HydrophobicContact CE1-CG 4.27Å; F1053-P1087 HydrophobicContact CE2-CG 4.18Å; F1053-P1087 HydrophobicContact CG-CG 4.37Å; F1053-P1087 HydrophobicContact CZ-CG 4.18Å; F1053-P1087 WeakPolarHBondContact O-CG 3.31Å
1088	C	92.6	Very high	92.7	Very high	13 Å²	13	20.4 Å²	20.4	9%	0.088	11%	0.108	C	C	.	.	S	Bend	trans	-106.1	164	-178.2	63.8	0	0	0	0	112.7	A1055 I1058 M1086	A1055-C1088 WeakPolarHBondContact O-CB 3.32Å; A1055-C1088 PolarHBondContact O-SG 3.28Å; I1058-C1088 VanDerWaalsContact CD1-SG 3.51Å; M1086-C1088 VanDerWaalsContact C-N 3.28Å; M1086-C1088 PolarHBondContact O-N 3.05Å
1089	P	95.1	Very high	92.3	Very high	10 Å²	10	21.9 Å²	21.9	7%	0.065	12%	0.119	C	C	.	.			trans	-58.1	140	172.9	-22.9	34.1	0	0	0	112.3	L774 L776 F908 Q1056 L1057 I1058	L774-P1089 HydrophobicContact CD1-CB 4.24Å; L776-P1089 HydrophobicContact CD2-CB 3.59Å; L776-P1089 HydrophobicContact CD2-CG 3.59Å; F908-P1089 HydrophobicContact CE1-CG 4.06Å; F908-P1089 HydrophobicContact CZ-CB 4.37Å; F908-P1089 HydrophobicContact CZ-CG 4.05Å; Q1056-P1089 WeakPolarHBondContact O-CD 3.45Å; L1057-P1089 HydrophobicContact CD1-CB 4.04Å; I1058-P1089 PolarHBondContact N-O 3.17Å; I1058-P1089 VanDerWaalsContact N-O 3.07Å
1090	V	97.5	Very high	91.9	Very high	1 Å²	1	22.3 Å²	22.3	1%	0.006	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	123.9	173.2	-177.6	0	0	0	0	108.6	R775 I1058 L1060 M1086 Y1092	R775-V1090 PolarHBondContact N-O 3.19Å; R775-V1090 PolarHBondContact O-N 3.31Å; R775-V1090 VanDerWaalsContact O-N 3.16Å; I1058-V1090 HydrophobicContact CB-CG2 4.43Å; I1058-V1090 CarbonylContact O-C 3.53Å; I1058-V1090 WeakPolarHBondContact O-CA 3.14Å; L1060-V1090 HydrophobicContact CD1-CG1 3.6Å; L1060-V1090 HydrophobicContact CG-CG1 4.25Å; M1086-V1090 HydrophobicContact CB-CG2 4.19Å; M1086-V1090 HydrophobicContact CG-CG2 4.46Å; V1090-Y1092 HydrophobicContact CG1-CD2 4.3Å; V1090-Y1092 HydrophobicContact CG1-CE2 3.88Å
1091	L	97.9	Very high	91.5	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.123	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	108.4	174.7	-176.6	73	0	0	0	108.9	F661 L739 A772 L774 I932 L1057 I1058 V1059 L1060 L1093	F661-L1091 HydrophobicContact CE1-CD1 3.86Å; F661-L1091 HydrophobicContact CE1-CD2 4.1Å; F661-L1091 HydrophobicContact CZ-CD1 4.27Å; F661-L1091 HydrophobicContact CZ-CD2 4.04Å; L739-L1091 HydrophobicContact CD1-CD1 4.04Å; A772-L1091 HydrophobicContact CB-CD1 4.16Å; L774-L1091 HydrophobicContact CB-CD1 4.08Å; L774-L1091 HydrophobicContact CD1-CD1 4.24Å; I932-L1091 HydrophobicContact CG2-CD2 4.17Å; L1057-L1091 HydrophobicContact CD1-CB 4.34Å; I1058-L1091 PolarHBondContact O-N 2.84Å; V1059-L1091 CarbonylContact C-O 3.47Å; V1059-L1091 VanDerWaalsContact CA-O 3.3Å; V1059-L1091 WeakPolarHBondContact CA-O 3.48Å; V1059-L1091 HydrophobicContact CG1-CD2 4.29Å; V1059-L1091 HydrophobicContact CG2-CB 4.16Å; V1059-L1091 HydrophobicContact CG2-CD2 4.14Å; L1060-L1091 PolarHBondContact N-O 3.24Å; L1091-L1093 HydrophobicContact CD2-CD2 4.32Å; L1091-L1093 HydrophobicContact CG-CB 4.49Å
1092	Y	98	Very high	90.9	Very high	2 Å²	2	23.8 Å²	23.8	1%	0.008	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	126.3	166.6	-66.8	-81.5	0	0	0	109	A772 I773 L1060 L1062 L1079 S1083 V1090	A772-Y1092 CarbonylContact C-O 3.58Å; A772-Y1092 VanDerWaalsContact CA-O 3.25Å; A772-Y1092 WeakPolarHBondContact CA-O 3.09Å; I773-Y1092 PolarHBondContact N-O 2.67Å; I773-Y1092 PolarHBondContact O-N 3.23Å; L1060-Y1092 HydrophobicContact CB-CD1 3.83Å; L1060-Y1092 HydrophobicContact CB-CE1 3.99Å; L1060-Y1092 HydrophobicContact CD1-CD1 4.25Å; L1060-Y1092 HydrophobicContact CD1-CE1 3.58Å; L1060-Y1092 HydrophobicContact CG-CE1 4.44Å; L1060-Y1092 CarbonylContact O-C 3.56Å; L1060-Y1092 WeakPolarHBondContact O-CA 3.45Å; L1062-Y1092 HydrophobicContact CD1-CD1 4.17Å; L1062-Y1092 HydrophobicContact CD1-CG 4Å; L1079-Y1092 HydrophobicContact CB-CE2 4.19Å; L1079-Y1092 HydrophobicContact CD2-CD1 3.75Å; L1079-Y1092 HydrophobicContact CD2-CD2 4.41Å; L1079-Y1092 HydrophobicContact CD2-CE1 3.67Å; L1079-Y1092 HydrophobicContact CD2-CE2 4.36Å; L1079-Y1092 HydrophobicContact CD2-CG 4.13Å; L1079-Y1092 PolarHBondContact O-OH 3.13Å; S1083-Y1092 VanDerWaalsContact CB-OH 3.29Å; S1083-Y1092 WeakPolarHBondContact CB-OH 3.42Å; S1083-Y1092 PolarHBondContact OG-OH 2.92Å; V1090-Y1092 HydrophobicContact CG1-CD2 4.3Å; V1090-Y1092 HydrophobicContact CG1-CE2 3.88Å
1093	L	96.7	Very high	90	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.005	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	135.4	-172.1	-175.7	60.2	0	0	0	111.3	L771 A772 L928 I932 V1059 L1060 T1061 L1062 L1091	L771-L1093 CarbonylContact O-C 3.58Å; L771-L1093 WeakPolarHBondContact O-CA 3.48Å; A772-L1093 HydrophobicContact CB-CD1 3.64Å; L928-L1093 HydrophobicContact CD2-CD1 3.87Å; L928-L1093 HydrophobicContact CD2-CG 4.49Å; L928-L1093 HydrophobicContact CG-CD1 4.18Å; L928-L1093 HydrophobicContact CG-CD2 4.45Å; L928-L1093 HydrophobicContact CG-CG 4.44Å; I932-L1093 HydrophobicContact CB-CD2 3.76Å; I932-L1093 HydrophobicContact CG1-CD2 3.85Å; I932-L1093 HydrophobicContact CG2-CD2 4.28Å; V1059-L1093 HydrophobicContact CG1-CB 3.98Å; V1059-L1093 HydrophobicContact CG1-CD2 3.99Å; L1060-L1093 PolarHBondContact O-N 3.34Å; T1061-L1093 CarbonylContact C-O 3.17Å; T1061-L1093 WeakPolarHBondContact CA-O 3.12Å; L1062-L1093 PolarHBondContact N-O 3.38Å; L1091-L1093 HydrophobicContact CD2-CD2 4.32Å; L1091-L1093 HydrophobicContact CG-CB 4.49Å
1094	R	94.7	Very high	88.7	Confident	0 Å²	0	30 Å²	30	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	121.8	173.6	-166.3	65.1	158.4	154.8	1.4	109.6	E87 F765 G770 L771 F923 D924 L1062 I1064	E87-R1094 VanDerWaalsContact CD-NH2 3.27Å; E87-R1094 IonicContact OE1-CZ 3.66Å; E87-R1094 IonicContact OE1-NE 2.68Å; E87-R1094 IonicContact OE1-NH2 3.45Å; E87-R1094 PolarHBondContact OE1-NH2 2.65Å; F765-R1094 HydrophobicContact CE1-CB 4.1Å; F765-R1094 HydrophobicContact CE1-CG 4Å; F765-R1094 HydrophobicContact CZ-CB 4.06Å; F765-R1094 HydrophobicContact CZ-CG 4.08Å; G770-R1094 CarbonylContact C-O 3.58Å; G770-R1094 WeakPolarHBondContact CA-O 3.47Å; L771-R1094 PolarHBondContact N-O 2.97Å; L771-R1094 PolarHBondContact O-N 3.32Å; F923-R1094 PolarHBondContact O-NH1 2.78Å; D924-R1094 PolarHBondContact O-NH1 3.24Å; L1062-R1094 HydrophobicContact CB-CB 4Å; L1062-R1094 WeakPolarHBondContact O-CD 3.3Å; I1064-R1094 HydrophobicContact CD1-CG 4.16Å; I1064-R1094 VanDerWaalsContact CD1-NE 3.32Å; I1064-R1094 HydrophobicContact CG1-CG 3.91Å
1095	G	92	Very high	87	Confident	2 Å²	2	34 Å²	34	2%	0.021	19%	0.191	C	C	.	.			trans	-73.2	175.3	168.7	0	0	0	0	0	113.5	D925 Q1097	D925-G1095 CarbonylContact O-C 3.54Å; D925-G1095 WeakPolarHBondContact O-CA 3.29Å; D925-G1095 PolarHBondContact OD2-N 3.41Å; G1095-Q1097 PolarHBondContact O-N 3.11Å
1096	N	87.1	Confident	87	Confident	17 Å²	17	31.2 Å²	31.2	9%	0.091	18%	0.177	C	C	.	.			trans	-86.2	14.8	-178.2	69.1	-15.4	0	0	0	113.7	L111 Y768 E1098	L111-N1096 HydrophobicContact CD2-CB 4.31Å; Y768-N1096 WeakPolarHBondContact O-CB 2.95Å; Y768-N1096 PolarHBondContact O-ND2 3.47Å; Y768-N1096 VanDerWaalsContact O-ND2 3.07Å; N1096-E1098 PolarHBondContact ND2-OE2 2.93Å; N1096-E1098 PolarHBondContact O-N 3.45Å; N1096-E1098 WeakPolarHBondContact OD1-CB 3.2Å; N1096-E1098 PolarHBondContact OD1-N 3.39Å; N1096-E1098 VanDerWaalsContact OD1-N 3.09Å
1097	Q	84.5	Confident	86.7	Confident	16 Å²	16	32.8 Å²	32.8	8%	0.075	19%	0.186	C	C	.	.	S	Bend	trans	68.7	8.8	-174.4	-57.3	-62.4	10.8	0	0	116.5	R108 L111 L114 D924 D925 G1095	R108-Q1097 WeakPolarHBondContact CD-O 3.41Å; R108-Q1097 PolarHBondContact NH1-O 3.3Å; L111-Q1097 HydrophobicContact CB-CG 4.36Å; L114-Q1097 HydrophobicContact CD1-CG 3.88Å; D924-Q1097 PolarHBondContact O-NE2 2.91Å; D924-Q1097 PolarHBondContact O-OE1 2.86Å; D925-Q1097 VanDerWaalsContact CA-OE1 3.24Å; G1095-Q1097 PolarHBondContact O-N 3.11Å
1098	E	84.8	Confident	86.6	Confident	118 Å²	118	30.4 Å²	30.4	55%	0.551	17%	0.168	S	C	*	.	S	Bend	trans	-90.6	142.9	167.5	-62.3	178.5	152.9	0	0	110.8	G926 N1096 V1100	G926-E1098 WeakPolarHBondContact CA-O 3.48Å; N1096-E1098 PolarHBondContact ND2-OE2 2.93Å; N1096-E1098 PolarHBondContact O-N 3.45Å; N1096-E1098 WeakPolarHBondContact OD1-CB 3.2Å; N1096-E1098 PolarHBondContact OD1-N 3.39Å; N1096-E1098 VanDerWaalsContact OD1-N 3.09Å; E1098-V1100 PolarHBondContact O-N 3.45Å
1099	S	86	Confident	86.2	Confident	41 Å²	41	31.4 Å²	31.4	29%	0.287	17%	0.173	S	C	.	.			trans	-72.1	116.2	-178.2	-67.2	0	0	0	0	110.8	Y94 R108 V638 G926	Y94-S1099 PolarHBondContact O-OG 3.47Å; Y94-S1099 VanDerWaalsContact O-OG 3.11Å; R108-S1099 PolarHBondContact NH1-OG 2.95Å; V638-S1099 WeakPolarHBondContact CG2-O 3.21Å; G926-S1099 WeakPolarHBondContact O-CA 3.38Å
1100	V	88.3	Confident	85.7	Confident	9 Å²	9	32.8 Å²	32.8	6%	0.055	18%	0.18	C	C	.	.			trans	-101.8	-6	177.4	-54.6	0	0	0	0	112.9	Y641 G926 L928 L931 E1098	Y641-V1100 HydrophobicContact CD1-CB 3.61Å; Y641-V1100 HydrophobicContact CD1-CG1 3.91Å; Y641-V1100 HydrophobicContact CD2-CB 4.27Å; Y641-V1100 HydrophobicContact CD2-CG1 3.85Å; Y641-V1100 HydrophobicContact CE1-CB 3.64Å; Y641-V1100 HydrophobicContact CE1-CG1 3.58Å; Y641-V1100 HydrophobicContact CE1-CG2 4.42Å; Y641-V1100 HydrophobicContact CE2-CB 4.28Å; Y641-V1100 HydrophobicContact CE2-CG1 3.5Å; Y641-V1100 VanDerWaalsContact CE2-CG1 3.5Å; Y641-V1100 HydrophobicContact CG-CB 3.94Å; Y641-V1100 HydrophobicContact CG-CG1 4.04Å; G926-V1100 WeakPolarHBondContact O-CG2 3.08Å; G926-V1100 PolarHBondContact O-N 2.95Å; L928-V1100 HydrophobicContact CB-CG2 4.24Å; L931-V1100 HydrophobicContact CB-CG2 4.23Å; L931-V1100 HydrophobicContact CD2-CB 4.1Å; L931-V1100 HydrophobicContact CD2-CG2 3.79Å; E1098-V1100 PolarHBondContact O-N 3.45Å
1101	L	86.5	Confident	84.9	Confident	20 Å²	20	34.9 Å²	34.9	11%	0.105	19%	0.191	C	C	.	.			trans	-119.7	145.9	173.6	-68.5	175.1	0	0	0	109.9	Y95 L930 L931 F974 L976	Y95-L1101 HydrophobicContact CE1-CB 4.5Å; L930-L1101 HydrophobicContact CB-CD1 3.92Å; L930-L1101 HydrophobicContact CD1-CD1 4.36Å; L931-L1101 HydrophobicContact CB-CD2 4.24Å; L931-L1101 HydrophobicContact CB-CG 4.42Å; L931-L1101 HydrophobicContact CD1-CD2 3.98Å; F974-L1101 HydrophobicContact CD1-CB 4Å; F974-L1101 HydrophobicContact CD2-CD1 4.1Å; F974-L1101 HydrophobicContact CE1-CB 3.81Å; F974-L1101 HydrophobicContact CE2-CB 4.49Å; F974-L1101 HydrophobicContact CE2-CD1 4.21Å; F974-L1101 HydrophobicContact CG-CB 4.44Å; F974-L1101 HydrophobicContact CG-CD1 4.38Å; F974-L1101 HydrophobicContact CZ-CB 4.07Å; L976-L1101 HydrophobicContact CD1-CD1 4.2Å
1102	T	81.7	Confident	84	Confident	27 Å²	27	37.4 Å²	37.4	17%	0.166	21%	0.205	C	C	.	.			trans	-145	153.6	173.5	-177.2	0	0	0	0	110.5	V638 K639 Y1104	V638-T1102 HydrophobicContact CB-CG2 4.34Å; V638-T1102 HydrophobicContact CG1-CG2 3.5Å; V638-T1102 HydrophobicContact CG2-CG2 4.01Å; K639-T1102 HydrophobicContact CG-CG2 3.72Å; T1102-Y1104 WeakPolarHBondContact OG1-CD1 3.21Å; T1102-Y1104 WeakPolarHBondContact OG1-CE1 3.41Å; T1102-Y1104 VanDerWaalsContact OG1-CG 3.29Å; T1102-Y1104 PolarHBondContact OG1-N 3.41Å; T1102-Y1104 VanDerWaalsContact OG1-N 3.13Å
1103	F	75	Confident	82.9	Confident	57 Å²	57	40.1 Å²	40.1	25%	0.25	22%	0.22	C	C	.	.			trans	-116.1	0.8	169.8	55.6	-100.2	0	0	0	112.8	V92 R96 L970 R973 F974	V92-F1103 HydrophobicContact CG1-CE1 4.11Å; V92-F1103 HydrophobicContact CG1-CZ 3.95Å; R96-F1103 HydrophobicContact CG-CZ 3.98Å; L970-F1103 HydrophobicContact CD1-CE1 4.45Å; R973-F1103 HydrophobicContact CB-CB 3.88Å; R973-F1103 HydrophobicContact CB-CD1 4.05Å; R973-F1103 HydrophobicContact CB-CG 3.94Å; R973-F1103 VanDerWaalsContact O-CB 3.26Å; R973-F1103 WeakPolarHBondContact O-CB 3.29Å; F974-F1103 HydrophobicContact CD1-CB 4.41Å; F974-F1103 HydrophobicContact CD1-CD1 4.06Å; F974-F1103 AromaticContact CE1-CD1 3.74Å; F974-F1103 HydrophobicContact CE1-CD1 3.74Å; F974-F1103 HydrophobicContact CE1-CE1 4.41Å
1104	Y	65.4	Low	81.7	Confident	75 Å²	75	43.3 Å²	43.3	29%	0.294	24%	0.238	S	C	.	.			trans	-96.7	149.6	175.7	61.1	-96.7	0	0	0	111.3	Y95 D97 K639 T1102	Y95-Y1104 WeakPolarHBondContact O-CE1 3.3Å; D97-Y1104 HydrophobicContact CB-CE1 4.16Å; D97-Y1104 HydrophobicContact CB-CE2 4.25Å; K639-Y1104 WeakPolarHBondContact CE-O 3.31Å; T1102-Y1104 WeakPolarHBondContact OG1-CD1 3.21Å; T1102-Y1104 WeakPolarHBondContact OG1-CE1 3.41Å; T1102-Y1104 VanDerWaalsContact OG1-CG 3.29Å; T1102-Y1104 PolarHBondContact OG1-N 3.41Å; T1102-Y1104 VanDerWaalsContact OG1-N 3.13Å
1105	S	55.1	Low	80.6	Confident	138 Å²	138	47.3 Å²	47.3	97%	0.965	26%	0.26	S	S	*	.			trans	-88.2	0	-179.6	62.5	0	0	0	0	112	K639	K639-S1105 VanDerWaalsContact CE-CA 3.47Å; K639-S1105 WeakPolarHBondContact CE-OXT 3.48Å; K639-S1105 VanDerWaalsContact NZ-C 3.32Å; K639-S1105 PolarHBondContact NZ-OXT 2.94Å

Retrieved 1,105 of 1,105 residues in 665 ms (Link to these results)

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