A0A087Y5L3_POEFO Loading...

Solute carrier family 12 member 7-like

AlphaFold DB , UniProt , Accession A0A087Y5L3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,126 aa.

						>A0A087Y5L3_POEFO|A0A087Y5L3
MPTNFTVVPVKDGTGKTREGNDEDDVDGSNVLREEEDPTGDGVPKENSPFINSAENDKNNYDGTNMALFEEEMDRHPMVSSLLDKLANYTNLSQGAQEHEEADEEEGTKKKTVKSPQMGTFMGVYLPCLQNILGVILFLRLTWIVGTAGILESLAIVGLCCSCTMLTAISMSAIATNGVVPAGGSYYMISRSLGPEFGGAVGLCFYLGTTFAGAMYILGTIEILLTYIVPQAAIFTAERKEDQLNALLNNMRIYGTICLSLMAVVVFVGVKYVNKLALVFLACVILSIISIYAGVIKSGFDPPDFPVCMLGNRTLQNLQFDKCLKTEIINNNTVSTQLWRLFCDGPELSSTCNEYFVNNNLTLIQGIPGLASGVISENMWSAYGPLGMLVENKRLPSVGGIDPAKDIYLPYVVNDISTFFTLLVGIYFPSVTGIMAGSNRSGDLKDAQKSIPIGTILAIATTSFIYVSGVILFGACIEGVLLRDKFGDSVKGNLVIGTLSWPSPWVIVIGSFFSCCGAGLQSLTGAPRLLQAIARDGIVPFLQVFGHGKANGEPTWALLLTAGICEIGILIASLDAVAPILSMFFLMCYMFVNLACAVQTLLRTPNWRPRFKYYHWTLSFLGMSLCLSIMFISSWYYAIIAMGIAGCIYKYIEYRGAEKEWGDGIRGLSLNAARYALIRLEEAPPHTKNWRPQLLVLLNLDSDLGVKHPRLLSLTTQLKAGKGLTIVGNVLQGTYLSHEAEAKKAEQNIKSTMATERTKGFCHVVVSSNLRDGISHLIQSAGLGGMKHNTVLVGWPGTWKQSEDPQSWRNFIEIVRETTTAHQAMLVAKNVDSFPTCQDRLGEGTIDVWWVVHDGGMLMLLPFLLRQHKVWGMCKMRIFTVAQMDDNSIQMKKDLQMFLYHLRLDAEVEVVEMHDNDISAFTYEKTLVMEQRSQMLKQMHLSRTEREREIQSITDESRNSIRRKNQGATENSNVSQQSSTVEDAQEDEAQLIHDKNTTAHTTMNNKEEAGPDRVHMTWTKDKLSTERNRNREPNANVAVRDLFNMKPEWESLNQSNVRRMHTAVKLNEVVVNKSQGAHLVLLNMPGPPRNRGGDENYMEFLEVLLEGLNRVLMVRGGGREVITIYS
					

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Loading PAE data...

(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	29.7	Very low	31	Very low	223 Å²	223	150.5 Å²	150.5	100%	1.099	83%	0.826	S	S	*	*				0	151.6	0	-73.1	-175.4	167.5	0	0	108.4	T3	M1-T3 HydrophobicContact CB-CG2 4.44Å; M1-T3 HydrophobicContact CG-CG2 4.05Å
2	P	38.3	Very low	30.8	Very low	125 Å²	125	150.8 Å²	150.8	81%	0.812	83%	0.827	S	S	*	*			cis	-90	117	-0.6	3.1	17.5	0	0	0	111
3	T	32.9	Very low	30.6	Very low	97 Å²	97	144.4 Å²	144.4	60%	0.595	82%	0.816	S	S	*	*				80.9	95.3	80	55.2	0	0	0	0	115	M1	M1-T3 HydrophobicContact CB-CG2 4.44Å; M1-T3 HydrophobicContact CG-CG2 4.05Å
4	N	30.8	Very low	30.3	Very low	161 Å²	161	145.1 Å²	145.1	86%	0.861	83%	0.825	S	S	*	*				-169.9	106.4	110	-90.2	-10.5	0	0	0	110.4
5	F	28.5	Very low	30.2	Very low	207 Å²	207	139.9 Å²	139.9	91%	0.908	82%	0.817	S	S	*	*			trans	-118.3	120.4	167.8	-104.1	-93	0	0	0	107
6	T	31.6	Very low	30.1	Very low	147 Å²	147	143.8 Å²	143.8	90%	0.902	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-89.2	121.9	172.6	11.6	0	0	0	0	109.8
7	V	29.6	Very low	29.9	Very low	126 Å²	126	141.9 Å²	141.9	76%	0.764	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-92.4	133	-175.8	175.9	0	0	0	0	110
8	V	29.9	Very low	29.8	Very low	127 Å²	127	145.7 Å²	145.7	77%	0.77	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-87.1	125	166.7	-179.9	0	0	0	0	108.4
9	P	31.1	Very low	29.6	Very low	114 Å²	114	145.7 Å²	145.7	74%	0.74	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-83.5	124	179.5	31.6	-32	0	0	0	111.6
10	V	28.8	Very low	29.5	Very low	126 Å²	126	141.9 Å²	141.9	76%	0.764	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-92.2	138.9	162.1	177.8	0	0	0	0	108.3
11	K	29.8	Very low	29.3	Very low	202 Å²	202	141.6 Å²	141.6	88%	0.878	80%	0.797	S	S	*	*			trans	-122.4	108.9	169.1	-90.8	-172.2	173.1	-178.1	0	110.2
12	D	28.6	Very low	29.2	Very low	155 Å²	155	136.2 Å²	136.2	83%	0.829	77%	0.773	S	S	*	*			trans	-68.8	156.3	147.8	-55.9	-54.5	0	0	0	108.6
13	G	28.2	Very low	28.7	Very low	67 Å²	67	138.1 Å²	138.1	69%	0.691	77%	0.771	S	S	*	*			cis	147.2	134.4	-0.9	0	0	0	0	0	109.7
14	T	26.7	Very low	28.5	Very low	154 Å²	154	139.8 Å²	139.8	95%	0.945	78%	0.776	S	S	*	*			trans	-166.1	136.5	165	36.8	0	0	0	0	109.4
15	G	28	Very low	28.3	Very low	68 Å²	68	138.7 Å²	138.7	70%	0.701	77%	0.77	S	S	*	*			trans	-127.7	-156.8	179	0	0	0	0	0	113.9
16	K	29	Very low	28.3	Very low	202 Å²	202	134.4 Å²	134.4	88%	0.878	76%	0.76	S	S	*	*			trans	85.3	138.9	-170.4	-62.7	-176.7	175.9	178.4	0	113.3
17	T	27	Very low	28.1	Very low	111 Å²	111	135.1 Å²	135.1	68%	0.681	76%	0.759	S	S	*	*			cis	-162.6	145.4	11.6	-3.6	0	0	0	0	112.2
18	R	27.6	Very low	28	Very low	210 Å²	210	133 Å²	133	79%	0.792	76%	0.762	S	S	*	*			trans	57.5	156.9	142.6	-77.5	167.5	165.7	-148.9	5.1	119.3
19	E	26.9	Very low	27.9	Very low	147 Å²	147	131.7 Å²	131.7	69%	0.687	76%	0.759	S	S	*	*			cis	-160.5	147.6	7.2	-131.8	150.1	-143.3	0	0	110.4
20	G	26.7	Very low	27.8	Very low	69 Å²	69	133.2 Å²	133.2	71%	0.711	76%	0.761	S	S	*	*			trans	64.9	164.5	158.4	0	0	0	0	0	119.7
21	N	26.4	Very low	27.9	Very low	135 Å²	135	132.7 Å²	132.7	72%	0.722	76%	0.757	S	S	*	*			cis	-166.2	157.9	-21.7	-134.8	46.4	0	0	0	108.7
22	D	27.6	Very low	27.9	Very low	111 Å²	111	129.7 Å²	129.7	59%	0.594	75%	0.75	S	S	*	*			trans	67.6	120.6	155.9	-49	-26.8	0	0	0	118
23	E	27.6	Very low	27.8	Very low	165 Å²	165	131.3 Å²	131.3	77%	0.771	75%	0.745	S	S	*	*				65.1	137.4	87.8	-64.1	179.4	178.4	0	0	113.1
24	D	27.9	Very low	27.7	Very low	131 Å²	131	135 Å²	135	70%	0.701	74%	0.744	S	S	*	*			cis	-164.7	170.4	-10	-111.8	-17.8	0	0	0	110
25	D	26.7	Very low	27.6	Very low	139 Å²	139	135.7 Å²	135.7	74%	0.743	74%	0.737	S	S	*	*			trans	68.8	123.2	142.7	-83.2	-8.6	0	0	0	126.2
26	V	29	Very low	27.6	Very low	116 Å²	116	140.8 Å²	140.8	70%	0.703	74%	0.742	S	S	*	*				96.8	130.4	119.8	170.3	0	0	0	0	122.8
27	D	27	Very low	27.4	Very low	162 Å²	162	138.8 Å²	138.8	87%	0.866	74%	0.741	S	S	*	*			trans	1.3	149.3	159.8	-65.2	-38.4	0	0	0	122.9
28	G	28	Very low	28.5	Very low	81 Å²	81	138 Å²	138	84%	0.835	74%	0.738	S	S	*	*			trans	-178.5	90.3	160.4	0	0	0	0	0	114.8
29	S	28.1	Very low	28.5	Very low	101 Å²	101	134.9 Å²	134.9	71%	0.706	74%	0.742	S	S	*	*			trans	-75.8	155.6	-179.1	62.1	0	0	0	0	115.8
30	N	28.7	Very low	28.6	Very low	145 Å²	145	131.1 Å²	131.1	78%	0.775	74%	0.743	S	S	*	*			trans	86.5	124	137.3	-78.7	-16.2	0	0	0	123.2
31	V	30.3	Very low	28.6	Very low	115 Å²	115	136.5 Å²	136.5	70%	0.697	76%	0.755	S	S	*	*				102.1	107.2	119.8	163.4	0	0	0	0	122
32	L	29.4	Very low	28.7	Very low	139 Å²	139	133.8 Å²	133.8	73%	0.728	76%	0.759	S	S	*	*			trans	75.3	134.7	136.6	-69.9	178	0	0	0	125.5
33	R	26.3	Very low	28.7	Very low	190 Å²	190	135.1 Å²	135.1	72%	0.717	77%	0.771	S	S	*	*			trans	85.7	119.6	139.2	-80.7	-178.1	146.2	139.9	2.8	120.4
34	E	26.6	Very low	30	Very low	145 Å²	145	132.1 Å²	132.1	68%	0.678	77%	0.766	S	S	*	*				73	127.3	94.1	-80.4	170.3	174.1	0	0	111
35	E	25.7	Very low	30.1	Very low	167 Å²	167	133.4 Å²	133.4	78%	0.78	77%	0.766	S	S	*	*			cis	-159.2	161.4	38.4	-104.7	158	-178.1	0	0	114.1
36	E	26.9	Very low	30.2	Very low	175 Å²	175	133.3 Å²	133.3	82%	0.818	76%	0.76	S	S	*	*			trans	34.4	116.4	145.3	-56.5	-174.4	161.6	0	0	125.9
37	D	24.3	Very low	30.1	Very low	160 Å²	160	135 Å²	135	86%	0.856	77%	0.765	S	S	*	*				31.2	169.3	115.2	-106	7.7	0	0	0	124
38	P	49.8	Very low	30.4	Very low	94 Å²	94	132.3 Å²	132.3	61%	0.61	76%	0.76	S	S	*	*			cis	-141.7	-163.1	-8.9	32.4	-7.5	0	0	0	116.3
39	T	28.5	Very low	31.1	Very low	145 Å²	145	133.1 Å²	133.1	89%	0.89	75%	0.75	S	S	*	*			trans	89.2	141.1	162.8	74	0	0	0	0	119.1
40	G	28.1	Very low	31.2	Very low	68 Å²	68	136.5 Å²	136.5	70%	0.701	75%	0.753	S	S	*	*			cis	175.3	156.3	-8.2	0	0	0	0	0	114.9
41	D	28.1	Very low	31.5	Very low	182 Å²	182	136 Å²	136	97%	0.973	75%	0.749	S	S	*	*			trans	65.7	137.6	157.8	-62.7	-19	0	0	0	125.6
42	G	28.2	Very low	31.3	Very low	78 Å²	78	136.8 Å²	136.8	80%	0.804	75%	0.749	S	S	*	*			trans	146.1	105	151.9	0	0	0	0	0	118.9
43	V	26.9	Very low	31.1	Very low	139 Å²	139	134.8 Å²	134.8	84%	0.842	75%	0.746	S	S	*	*			trans	-138.7	-178.1	174	-127.6	0	0	0	0	109.1
44	P	55.7	Low	31.1	Very low	102 Å²	102	130.8 Å²	130.8	66%	0.662	75%	0.754	S	S	*	*			cis	-136.2	-157.9	-22.6	28.7	-3	0	0	0	114.1
45	K	29.6	Very low	31.2	Very low	159 Å²	159	133.1 Å²	133.1	69%	0.691	77%	0.765	S	S	*	*			trans	92	146.8	153.5	-72.9	-178.6	171.7	-88.5	0	120
46	E	28.7	Very low	31.2	Very low	136 Å²	136	131.7 Å²	131.7	64%	0.636	76%	0.763	S	S	*	*			cis	-168.9	170.8	-17.8	-125.5	164.4	-161.8	0	0	111.4
47	N	27.7	Very low	31.2	Very low	151 Å²	151	131.2 Å²	131.2	81%	0.807	77%	0.766	S	S	*	*			trans	89.9	129.5	156.6	-60.5	-29.2	0	0	0	123.1
48	S	32.8	Very low	31.4	Very low	107 Å²	107	132.3 Å²	132.3	75%	0.748	76%	0.763	S	S	*	*			trans	-111	-179.5	160.4	62.2	0	0	0	0	108.8
49	P	43.6	Very low	30.3	Very low	98 Å²	98	134.9 Å²	134.9	64%	0.636	77%	0.771	S	S	*	*				-161.8	-179.9	81.2	36.7	-11.6	0	0	0	119.4
50	F	29.8	Very low	30.2	Very low	172 Å²	172	133.9 Å²	133.9	75%	0.754	76%	0.76	S	S	*	*			trans	77	104.1	162.2	-62.9	-62.2	0	0	0	119.9
51	I	34.3	Very low	30.2	Very low	135 Å²	135	140 Å²	140	69%	0.692	76%	0.764	S	S	*	*				80.6	131.7	83.3	-83	-161.3	0	0	0	112
52	N	26.4	Very low	30.2	Very low	131 Å²	131	139.6 Å²	139.6	70%	0.701	76%	0.762	S	S	*	*			cis	-160.9	174.8	7.1	-116.3	12.8	0	0	0	109.1
53	S	24.8	Very low	30.4	Very low	97 Å²	97	139 Å²	139	68%	0.678	76%	0.755	S	S	*	*			cis	-177.2	138.4	-22.5	47	0	0	0	0	110.4
54	A	27.1	Very low	30.9	Very low	105 Å²	105	138.6 Å²	138.6	87%	0.868	75%	0.753	S	S	*	*			trans	-159	145.2	159.4	0	0	0	0	0	110.6
55	E	27.1	Very low	29.8	Very low	195 Å²	195	141.2 Å²	141.2	91%	0.911	76%	0.762	S	S	*	*			trans	-72.3	160	-177.4	-67.5	163.3	134.9	0	0	113
56	N	27.7	Very low	29.9	Very low	137 Å²	137	142.7 Å²	142.7	73%	0.733	77%	0.773	S	S	*	*			cis	-168.9	79.7	-21.8	176.4	34.3	0	0	0	107.9
57	D	26.2	Very low	30.3	Very low	165 Å²	165	141 Å²	141	88%	0.882	78%	0.783	S	S	*	*			trans	-116.6	111.6	173.4	-94.8	-39.7	0	0	0	110.6
58	K	28.2	Very low	30.6	Very low	182 Å²	182	141 Å²	141	79%	0.791	78%	0.782	S	S	*	*			trans	-150.2	144.5	172.5	-88.8	-172	179	-179.2	0	108.1
59	N	27.1	Very low	30.5	Very low	148 Å²	148	144.6 Å²	144.6	79%	0.791	79%	0.785	S	S	*	*			cis	-154.6	151.5	-22.1	-132.3	7.2	0	0	0	105.8
60	N	25.8	Very low	30.1	Very low	124 Å²	124	149.1 Å²	149.1	66%	0.663	80%	0.797	S	S	*	*			trans	-83.5	156	171.6	-156.3	6.8	0	0	0	110.3
61	Y	28.8	Very low	30.5	Very low	197 Å²	197	150.3 Å²	150.3	77%	0.773	81%	0.805	S	S	*	*			trans	68.2	107.6	177.7	-59.2	-80.8	0	0	0	118
62	D	28.4	Very low	30.6	Very low	174 Å²	174	152.6 Å²	152.6	93%	0.93	81%	0.813	S	S	*	*				-151.1	157.2	108	-139.6	-22.2	0	0	0	110.7
63	G	31.1	Very low	31	Very low	65 Å²	65	153.3 Å²	153.3	67%	0.67	81%	0.814	S	S	*	*			trans	111.3	23.3	164	0	0	0	0	0	120.6	N65	G63-N65 PolarHBondContact O-N 2.63Å; G63-N65 VanDerWaalsContact O-N 3.15Å
64	T	38.5	Very low	31.5	Very low	130 Å²	130	156.4 Å²	156.4	80%	0.798	82%	0.823	S	S	*	*			trans	-77.3	89.2	157.3	41.1	0	0	0	0	110.1
65	N	32.3	Very low	32	Very low	157 Å²	157	162.9 Å²	162.9	84%	0.84	82%	0.824	S	S	*	*			trans	170.8	80.3	151.2	-90	-16.2	0	0	0	111.2	G63	G63-N65 PolarHBondContact O-N 2.63Å; G63-N65 VanDerWaalsContact O-N 3.15Å
66	M	31.8	Very low	33	Very low	190 Å²	190	159 Å²	159	94%	0.936	81%	0.806	S	S	*	*			trans	-157.2	78	152.4	-84	-141.3	-67.1	0	0	109.3
67	A	37.2	Very low	33.8	Very low	101 Å²	101	156.7 Å²	156.7	84%	0.835	80%	0.799	S	S	*	*			trans	-125.3	55.7	175.2	0	0	0	0	0	110.2
68	L	33.6	Very low	35.1	Very low	150 Å²	150	156.3 Å²	156.3	79%	0.785	79%	0.794	S	S	*	*	S	Bend	trans	-150	9.5	175.8	-143.1	89.2	0	0	0	115.6
69	F	31.7	Very low	36.3	Very low	184 Å²	184	152.6 Å²	152.6	81%	0.807	79%	0.786	S	S	*	*	S	Bend	trans	-144.2	38.1	-179.3	-75.1	-69.9	0	0	0	114
70	E	35.1	Very low	37.3	Very low	193 Å²	193	147.1 Å²	147.1	90%	0.902	76%	0.759	S	S	*	*	S	Bend	trans	-107.8	5.8	172.3	-104.5	-170.1	172.6	0	0	114.5
71	E	38.2	Very low	39	Very low	196 Å²	196	143.2 Å²	143.2	92%	0.916	74%	0.741	S	S	*	*	S	Bend	trans	-96.7	1.3	177.8	-88.1	-168.3	151	0	0	115.6
72	E	34.9	Very low	40.3	Very low	184 Å²	184	138.7 Å²	138.7	86%	0.86	73%	0.73	S	S	*	*	S	Bend	trans	-114.5	28.7	179.9	-75.6	-156.6	126.4	0	0	115.4
73	M	34.9	Very low	41.8	Very low	146 Å²	146	135.3 Å²	135.3	72%	0.719	71%	0.711	S	S	*	*			trans	-104.6	5.2	173.1	-152.6	156.1	63.5	0	0	115.2	R75	M73-R75 PolarHBondContact O-N 2.78Å
74	D	36	Very low	43.4	Very low	162 Å²	162	137 Å²	137	87%	0.866	71%	0.705	S	S	*	*			trans	-84.7	55.8	171.3	-101.3	-17.1	0	0	0	112.7
75	R	37.4	Very low	44.7	Very low	240 Å²	240	137.4 Å²	137.4	91%	0.906	70%	0.696	S	S	*	*			trans	-125.9	33.5	163.1	-75.6	-165	-179.4	-177.7	5.4	113.5	M73	M73-R75 PolarHBondContact O-N 2.78Å
76	H	47.5	Very low	46.1	Very low	115 Å²	115	133 Å²	133	53%	0.532	67%	0.672	S	S	.	*	S	Bend	trans	-64.5	135.8	154.2	-69.1	-76	0	0	0	109.2	M78	H76-M78 PolarHBondContact O-N 3.24Å
77	P	45.8	Very low	47.4	Very low	88 Å²	88	127.4 Å²	127.4	57%	0.571	66%	0.656	S	S	*	*			trans	-58.1	136.7	177.8	23.2	-31.8	0	0	0	109.7	V79 S80 S81	P77-V79 PolarHBondContact O-N 3.17Å; P77-S80 WeakPolarHBondContact CD-OG 3.43Å; P77-S80 PolarHBondContact O-N 2.96Å; P77-S80 PolarHBondContact O-OG 2.89Å; P77-S81 PolarHBondContact O-N 3.18Å
78	M	53.7	Low	48.7	Very low	157 Å²	157	127.5 Å²	127.5	77%	0.773	64%	0.642	S	S	*	*	H	α-helix	trans	-51.9	-29.9	-174.7	-71.6	-166.9	-174.5	0	0	113.4	H76 S81 L82	H76-M78 PolarHBondContact O-N 3.24Å; M78-S81 PolarHBondContact O-OG 3.07Å; M78-L82 VanDerWaalsContact O-CB 3.3Å; M78-L82 WeakPolarHBondContact O-CB 3.25Å; M78-L82 WeakPolarHBondContact O-CD1 3.44Å; M78-L82 WeakPolarHBondContact O-CG 3.16Å; M78-L82 PolarHBondContact O-N 3.09Å
79	V	52.2	Low	50.5	Low	104 Å²	104	120.7 Å²	120.7	63%	0.63	61%	0.606	S	S	*	*	H	α-helix	trans	-64.7	-41.2	175.5	-175.7	0	0	0	0	111.9	P77 L82 L83	P77-V79 PolarHBondContact O-N 3.17Å; V79-L82 PolarHBondContact O-N 3.46Å; V79-L83 HydrophobicContact CG1-CD1 3.89Å; V79-L83 HydrophobicContact CG1-CG 4.31Å; V79-L83 WeakPolarHBondContact O-CB 3.49Å; V79-L83 WeakPolarHBondContact O-CG 2.95Å; V79-L83 PolarHBondContact O-N 3.48Å
80	S	49.7	Very low	52.4	Low	33 Å²	33	113.8 Å²	113.8	23%	0.231	58%	0.579	C	S	.	*	H	α-helix	trans	-69.5	-42.4	178.7	68.6	0	0	0	0	111.8	P77 L82 L83 D84	P77-S80 WeakPolarHBondContact CD-OG 3.43Å; P77-S80 PolarHBondContact O-N 2.96Å; P77-S80 PolarHBondContact O-OG 2.89Å; S80-L82 VanDerWaalsContact C-N 3.31Å; S80-L82 PolarHBondContact O-N 3.16Å; S80-L83 CarbonylContact O-C 3.59Å; S80-L83 PolarHBondContact O-N 3.14Å; S80-L83 VanDerWaalsContact O-N 3.13Å; S80-D84 PolarHBondContact O-N 2.99Å
81	S	60.5	Low	53.9	Low	41 Å²	41	105.1 Å²	105.1	29%	0.287	54%	0.539	S	S	.	.	H	α-helix	trans	-71	-25.6	177.8	68.5	0	0	0	0	113.3	P77 M78 K85	P77-S81 PolarHBondContact O-N 3.18Å; M78-S81 PolarHBondContact O-OG 3.07Å; S81-K85 WeakPolarHBondContact O-CB 3.42Å; S81-K85 WeakPolarHBondContact O-CD 3.41Å; S81-K85 VanDerWaalsContact O-CG 3.22Å; S81-K85 WeakPolarHBondContact O-CG 3.18Å; S81-K85 PolarHBondContact O-N 2.83Å
82	L	55.3	Low	55.5	Low	103 Å²	103	96.1 Å²	96.1	54%	0.539	50%	0.497	S	S	.	.	H	α-helix	trans	-71.5	-42.7	165.9	-75.6	169.4	0	0	0	111.8	M78 V79 S80 K85 L86	M78-L82 VanDerWaalsContact O-CB 3.3Å; M78-L82 WeakPolarHBondContact O-CB 3.25Å; M78-L82 WeakPolarHBondContact O-CD1 3.44Å; M78-L82 WeakPolarHBondContact O-CG 3.16Å; M78-L82 PolarHBondContact O-N 3.09Å; V79-L82 PolarHBondContact O-N 3.46Å; S80-L82 VanDerWaalsContact C-N 3.31Å; S80-L82 PolarHBondContact O-N 3.16Å; L82-K85 PolarHBondContact O-N 2.85Å; L82-L86 WeakPolarHBondContact O-CB 3.37Å; L82-L86 WeakPolarHBondContact O-CD1 3.33Å; L82-L86 VanDerWaalsContact O-CG 3.23Å; L82-L86 WeakPolarHBondContact O-CG 3.37Å; L82-L86 PolarHBondContact O-N 3.2Å
83	L	60.9	Low	57.1	Low	102 Å²	102	88 Å²	88	53%	0.534	46%	0.46	S	S	.	.	H	α-helix	trans	-63.8	-39.7	176.9	-75.3	170.4	0	0	0	112.2	V79 S80 L86 A87	V79-L83 HydrophobicContact CG1-CD1 3.89Å; V79-L83 HydrophobicContact CG1-CG 4.31Å; V79-L83 WeakPolarHBondContact O-CB 3.49Å; V79-L83 WeakPolarHBondContact O-CG 2.95Å; V79-L83 PolarHBondContact O-N 3.48Å; S80-L83 CarbonylContact O-C 3.59Å; S80-L83 PolarHBondContact O-N 3.14Å; S80-L83 VanDerWaalsContact O-N 3.13Å; L83-L86 CarbonylContact O-C 3.58Å; L83-L86 PolarHBondContact O-N 3.44Å; L83-A87 VanDerWaalsContact O-CB 3.3Å; L83-A87 WeakPolarHBondContact O-CB 3.4Å; L83-A87 PolarHBondContact O-N 2.92Å
84	D	64.1	Low	58.9	Low	100 Å²	100	81.6 Å²	81.6	54%	0.535	43%	0.429	S	S	.	.	H	α-helix	trans	-66.6	-38.4	174.8	-70.2	-30.7	0	0	0	111.8	S80 L86 A87 N88	S80-D84 PolarHBondContact O-N 2.99Å; D84-L86 VanDerWaalsContact C-N 3.32Å; D84-A87 PolarHBondContact O-N 3.16Å; D84-N88 PolarHBondContact O-N 2.69Å; D84-N88 PolarHBondContact O-ND2 3.16Å
85	K	65.4	Low	60.5	Low	139 Å²	139	74.2 Å²	74.2	60%	0.604	39%	0.391	S	S	*	.	H	α-helix	trans	-68.2	-30.1	173	-74.4	169.8	-175.1	167.4	0	112.7	S81 L82 M122	S81-K85 WeakPolarHBondContact O-CB 3.42Å; S81-K85 WeakPolarHBondContact O-CD 3.41Å; S81-K85 VanDerWaalsContact O-CG 3.22Å; S81-K85 WeakPolarHBondContact O-CG 3.18Å; S81-K85 PolarHBondContact O-N 2.83Å; L82-K85 PolarHBondContact O-N 2.85Å; K85-M122 WeakPolarHBondContact O-CE 3.4Å
86	L	63.1	Low	62.3	Low	66 Å²	66	62.9 Å²	62.9	35%	0.346	35%	0.348	S	S	.	.	H	α-helix	trans	-76.8	-39	173.5	-75.1	162.2	0	0	0	111.8	L82 L83 D84 N88 Y89 M122 L278	L82-L86 WeakPolarHBondContact O-CB 3.37Å; L82-L86 WeakPolarHBondContact O-CD1 3.33Å; L82-L86 VanDerWaalsContact O-CG 3.23Å; L82-L86 WeakPolarHBondContact O-CG 3.37Å; L82-L86 PolarHBondContact O-N 3.2Å; L83-L86 CarbonylContact O-C 3.58Å; L83-L86 PolarHBondContact O-N 3.44Å; D84-L86 VanDerWaalsContact C-N 3.32Å; L86-N88 PolarHBondContact O-N 2.85Å; L86-Y89 VanDerWaalsContact O-CB 3.22Å; L86-Y89 WeakPolarHBondContact O-CB 3.31Å; L86-Y89 PolarHBondContact O-N 3.25Å; L86-Y89 VanDerWaalsContact O-N 3.14Å; L86-M122 HydrophobicContact CD2-CE 3.74Å; L86-M122 HydrophobicContact CD2-SD 4.19Å; L86-M122 HydrophobicContact CG-CE 4.29Å; L86-L278 HydrophobicContact CB-CD1 3.84Å; L86-L278 HydrophobicContact CD2-CD1 3.79Å; L86-L278 HydrophobicContact CG-CD1 4.42Å; L86-L278 WeakPolarHBondContact O-CD1 3.03Å
87	A	58.6	Low	63.7	Low	71 Å²	71	60.4 Å²	60.4	59%	0.587	34%	0.337	S	S	*	.	H	α-helix	trans	-64.2	-29.8	177.6	0	0	0	0	0	112.6	L83 D84	L83-A87 VanDerWaalsContact O-CB 3.3Å; L83-A87 WeakPolarHBondContact O-CB 3.4Å; L83-A87 PolarHBondContact O-N 2.92Å; D84-A87 PolarHBondContact O-N 3.16Å
88	N	65.1	Low	65.1	Low	103 Å²	103	59.5 Å²	59.5	55%	0.551	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	18.3	175.5	-66.9	-36.2	0	0	0	113.9	D84 L86	D84-N88 PolarHBondContact O-N 2.69Å; D84-N88 PolarHBondContact O-ND2 3.16Å; L86-N88 PolarHBondContact O-N 2.85Å
89	Y	70.5	Confident	66.2	Low	8 Å²	8	52.5 Å²	52.5	3%	0.031	29%	0.291	C	S	.	.			trans	-75.4	130	175.4	178.9	-102	0	0	0	112.3	L86 N91 M122 L126 P127 Q130 A277 L278 L281 R440	L86-Y89 VanDerWaalsContact O-CB 3.22Å; L86-Y89 WeakPolarHBondContact O-CB 3.31Å; L86-Y89 PolarHBondContact O-N 3.25Å; L86-Y89 VanDerWaalsContact O-N 3.14Å; Y89-N91 HydrophobicContact CE1-CB 3.87Å; Y89-M122 HydrophobicContact CD2-CE 3.74Å; Y89-M122 HydrophobicContact CG-CE 4.23Å; Y89-L126 HydrophobicContact CE2-CB 4.16Å; Y89-P127 HydrophobicContact CE2-CG 4.11Å; Y89-Q130 PolarHBondContact OH-OE1 3.22Å; Y89-A277 HydrophobicContact CD1-CB 4.04Å; Y89-A277 HydrophobicContact CE1-CB 3.92Å; Y89-L278 HydrophobicContact CD1-CB 4.16Å; Y89-L281 HydrophobicContact CE1-CD2 4.44Å; Y89-R440 VanDerWaalsContact CE2-NH2 3.29Å
90	T	71.3	Confident	67.4	Low	39 Å²	39	51.4 Å²	51.4	24%	0.239	28%	0.279	C	S	.	.			trans	-137.7	77.4	-169.2	47.2	0	0	0	0	112.1	L92 N274 R440	T90-L92 PolarHBondContact O-N 2.94Å; T90-N274 HydrophobicContact CG2-CB 4.17Å; T90-R440 PolarHBondContact O-NE 3.07Å; T90-R440 PolarHBondContact O-NH2 3.14Å
91	N	66.3	Low	68.6	Low	10 Å²	10	54.6 Å²	54.6	5%	0.053	29%	0.29	C	S	.	.			trans	-64.8	-2	-170.6	74.6	-21.8	0	0	0	116.4	Y89 Q130 A277 R440 Q521	Y89-N91 HydrophobicContact CE1-CB 3.87Å; N91-Q130 PolarHBondContact ND2-NE2 2.9Å; N91-Q130 PolarHBondContact ND2-OE1 3.35Å; N91-A277 HydrophobicContact CB-CB 4.05Å; N91-A277 WeakPolarHBondContact OD1-CB 3.43Å; N91-R440 VanDerWaalsContact CA-NH2 3.29Å; N91-Q521 PolarHBondContact ND2-NE2 3.11Å; N91-Q521 PolarHBondContact ND2-OE1 3.19Å; N91-Q521 PolarHBondContact O-NE2 3.4Å
92	L	72.7	Confident	69	Low	8 Å²	8	54.1 Å²	54.1	4%	0.042	29%	0.289	C	S	.	.	S	Bend	trans	-74.9	162.3	179.5	-85.1	63.3	0	0	0	113.2	T90 V270 V273 N274 T524	T90-L92 PolarHBondContact O-N 2.94Å; L92-V270 HydrophobicContact CD2-CG1 3.06Å; L92-V273 HydrophobicContact CD1-CG1 4.07Å; L92-N274 WeakPolarHBondContact CD1-OD1 3.34Å; L92-T524 HydrophobicContact CD2-CG2 3.84Å; L92-T524 WeakPolarHBondContact CD2-OG1 3.47Å; L92-T524 WeakPolarHBondContact CG-OG1 3.31Å
93	S	67.5	Low	69.5	Low	12 Å²	12	53.6 Å²	53.6	8%	0.084	29%	0.286	C	S	.	.	P	Polyproline II helix	trans	-79.8	140.6	179.1	63.1	0	0	0	0	112.5	G525 R528	S93-G525 WeakPolarHBondContact OG-CA 3.41Å; S93-R528 VanDerWaalsContact O-CD 3.29Å; S93-R528 WeakPolarHBondContact O-CD 3.44Å; S93-R528 PolarHBondContact O-NH1 3.18Å
94	Q	73	Confident	69.8	Low	13 Å²	13	55.6 Å²	55.6	6%	0.061	29%	0.293	C	S	.	.	P	Polyproline II helix	trans	-62.5	159.7	165	-71.1	-177	-18.9	0	0	111.3	E98 N439 D443	Q94-E98 WeakPolarHBondContact CA-OE2 3.33Å; Q94-E98 WeakPolarHBondContact CB-OE2 3.25Å; Q94-E98 WeakPolarHBondContact CG-OE2 3.3Å; Q94-N439 WeakPolarHBondContact CB-O 3.37Å; Q94-N439 WeakPolarHBondContact CG-O 3.38Å; Q94-N439 PolarHBondContact N-O 3.09Å; Q94-D443 PolarHBondContact NE2-OD1 2.64Å; Q94-D443 PolarHBondContact NE2-OD2 2.78Å
95	G	70.1	Confident	69.5	Low	7 Å²	7	57.1 Å²	57.1	7%	0.072	30%	0.297	C	S	.	.			trans	-143.3	-174.1	-175	0	0	0	0	0	113.6	Q97 E98 H99	G95-Q97 VanDerWaalsContact C-N 3.33Å; G95-Q97 PolarHBondContact O-N 2.97Å; G95-E98 PolarHBondContact N-OE2 2.82Å; G95-E98 PolarHBondContact O-N 2.87Å; G95-H99 PolarHBondContact O-N 2.93Å
96	A	75.3	Confident	68.9	Low	1 Å²	1	58.9 Å²	58.9	1%	0.008	31%	0.307	C	S	.	.	H	α-helix	trans	-63.6	-31	-170	0	0	0	0	0	115	H99 E100 Y187 A532	A96-H99 PolarHBondContact O-N 2.96Å; A96-E100 WeakPolarHBondContact O-CG 3.21Å; A96-E100 PolarHBondContact O-N 2.86Å; A96-Y187 HydrophobicContact CB-CE2 4.46Å; A96-Y187 WeakPolarHBondContact CB-OH 3.28Å; A96-A532 HydrophobicContact CB-CB 4.38Å
97	Q	76.9	Confident	68.1	Low	63 Å²	63	58.5 Å²	58.5	29%	0.294	32%	0.319	S	S	.	.	H	α-helix	trans	-63.7	-40.8	175.9	177.5	176.1	-14.7	0	0	111.9	G95 H99 E100 E101 N551	G95-Q97 VanDerWaalsContact C-N 3.33Å; G95-Q97 PolarHBondContact O-N 2.97Å; Q97-H99 VanDerWaalsContact C-N 3.26Å; Q97-H99 PolarHBondContact O-N 2.96Å; Q97-E100 PolarHBondContact O-N 3.5Å; Q97-E101 HydrophobicContact CG-CG 4.33Å; Q97-E101 WeakPolarHBondContact CG-OE1 3.22Å; Q97-E101 PolarHBondContact NE2-OE1 2.69Å; Q97-E101 WeakPolarHBondContact O-CB 3.37Å; Q97-E101 WeakPolarHBondContact O-CG 3.38Å; Q97-E101 PolarHBondContact O-N 3.39Å; Q97-N551 VanDerWaalsContact OE1-C 3.23Å; Q97-N551 PolarHBondContact OE1-O 3.41Å
98	E	75.4	Confident	67.2	Low	69 Å²	69	59.5 Å²	59.5	32%	0.322	32%	0.318	S	S	.	.	H	α-helix	trans	-72.7	-22.6	-179	-64.6	148.3	160.5	0	0	111.5	Q94 G95 A102	Q94-E98 WeakPolarHBondContact CA-OE2 3.33Å; Q94-E98 WeakPolarHBondContact CB-OE2 3.25Å; Q94-E98 WeakPolarHBondContact CG-OE2 3.3Å; G95-E98 PolarHBondContact N-OE2 2.82Å; G95-E98 PolarHBondContact O-N 2.87Å; E98-A102 WeakPolarHBondContact O-CB 3.4Å; E98-A102 PolarHBondContact O-N 2.85Å
99	H	77.3	Confident	66	Low	11 Å²	11	65.1 Å²	65.1	5%	0.051	34%	0.337	C	S	.	.	H	α-helix	trans	-73.8	-43.4	167.8	-171.5	-49.6	0	0	0	111.4	G95 A96 Q97 A102 D103 A182 Y187	G95-H99 PolarHBondContact O-N 2.93Å; A96-H99 PolarHBondContact O-N 2.96Å; Q97-H99 VanDerWaalsContact C-N 3.26Å; Q97-H99 PolarHBondContact O-N 2.96Å; H99-A102 PolarHBondContact O-N 3.3Å; H99-D103 IonicContact CE1-OD1 3.51Å; H99-D103 PolarHBondContact CE1-OD1 2.86Å; H99-D103 VanDerWaalsContact CE1-OD1 3.32Å; H99-D103 IonicContact CE1-OD2 3.97Å; H99-D103 PolarHBondContact CE1-OD2 2.9Å; H99-D103 IonicContact ND1-OD1 3.73Å; H99-D103 PolarHBondContact ND1-OD1 3.13Å; H99-D103 IonicContact ND1-OD2 3.59Å; H99-D103 PolarHBondContact ND1-OD2 2.95Å; H99-D103 PolarHBondContact O-N 3.14Å; H99-A182 WeakPolarHBondContact CB-O 3.21Å; H99-A182 PolarHBondContact CD2-O 3.04Å; H99-Y187 HydrophobicContact CB-CD2 4.37Å; H99-Y187 HydrophobicContact CB-CE2 4.1Å; H99-Y187 AromaticContact CD2-CD1 3.32Å; H99-Y187 WeakPolarHBondContact CD2-CD1 3.27Å; H99-Y187 AromaticContact CD2-CD2 3.61Å; H99-Y187 AromaticContact CD2-CE1 3.68Å; H99-Y187 AromaticContact CD2-CE2 3.94Å; H99-Y187 AromaticContact CD2-CG 3.28Å; H99-Y187 AromaticContact CD2-CZ 3.97Å; H99-Y187 AromaticContact NE2-CD1 3.55Å; H99-Y187 AromaticContact NE2-CG 3.88Å
100	E	76.5	Confident	64.3	Low	81 Å²	81	73.4 Å²	73.4	38%	0.379	37%	0.374	S	S	.	.	H	α-helix	trans	-62.9	-42.2	176.6	-73.9	159.2	-166.2	0	0	111.6	A96 Q97 A102 D103 E104 R535	A96-E100 WeakPolarHBondContact O-CG 3.21Å; A96-E100 PolarHBondContact O-N 2.86Å; Q97-E100 PolarHBondContact O-N 3.5Å; E100-A102 PolarHBondContact O-N 2.83Å; E100-D103 PolarHBondContact O-N 2.8Å; E100-E104 WeakPolarHBondContact O-CG 3.5Å; E100-E104 PolarHBondContact O-N 2.99Å; E100-R535 WeakPolarHBondContact OE1-CD 3.44Å; E100-R535 IonicContact OE1-CZ 2.6Å; E100-R535 IonicContact OE1-NE 2.7Å; E100-R535 IonicContact OE1-NH1 3.08Å; E100-R535 PolarHBondContact OE1-NH1 3.03Å; E100-R535 IonicContact OE2-CZ 3.96Å; E100-R535 IonicContact OE2-NH1 3.04Å; E100-R535 PolarHBondContact OE2-NH1 3.26Å
101	E	75.3	Confident	62.5	Low	99 Å²	99	81.4 Å²	81.4	46%	0.463	41%	0.405	S	S	.	.	H	α-helix	trans	-62.3	-41.2	174.9	-73.8	173.4	-175.5	0	0	111.9	Q97 E104 E105	Q97-E101 HydrophobicContact CG-CG 4.33Å; Q97-E101 WeakPolarHBondContact CG-OE1 3.22Å; Q97-E101 PolarHBondContact NE2-OE1 2.69Å; Q97-E101 WeakPolarHBondContact O-CB 3.37Å; Q97-E101 WeakPolarHBondContact O-CG 3.38Å; Q97-E101 PolarHBondContact O-N 3.39Å; E101-E104 PolarHBondContact O-N 3.14Å; E101-E105 WeakPolarHBondContact O-CG 3.33Å; E101-E105 PolarHBondContact O-N 2.83Å
102	A	67.4	Low	60.8	Low	32 Å²	32	86.3 Å²	86.3	26%	0.264	44%	0.436	S	S	.	.	H	α-helix	trans	-67.8	-40.5	176.5	0	0	0	0	0	113.1	E98 H99 E100 E104 E105 E106 A182	E98-A102 WeakPolarHBondContact O-CB 3.4Å; E98-A102 PolarHBondContact O-N 2.85Å; H99-A102 PolarHBondContact O-N 3.3Å; E100-A102 PolarHBondContact O-N 2.83Å; A102-E104 VanDerWaalsContact C-N 3.32Å; A102-E104 PolarHBondContact O-N 3.29Å; A102-E105 PolarHBondContact O-N 3.47Å; A102-E106 PolarHBondContact O-N 2.79Å; A102-A182 HydrophobicContact CB-CB 3.63Å
103	D	67.4	Low	59	Low	92 Å²	92	92 Å²	92	49%	0.492	47%	0.47	S	S	.	.	H	α-helix	trans	-64.5	-36	175.1	-70.4	-19.2	0	0	0	111.4	H99 E100 G107	H99-D103 IonicContact CE1-OD1 3.51Å; H99-D103 PolarHBondContact CE1-OD1 2.86Å; H99-D103 VanDerWaalsContact CE1-OD1 3.32Å; H99-D103 IonicContact CE1-OD2 3.97Å; H99-D103 PolarHBondContact CE1-OD2 2.9Å; H99-D103 IonicContact ND1-OD1 3.73Å; H99-D103 PolarHBondContact ND1-OD1 3.13Å; H99-D103 IonicContact ND1-OD2 3.59Å; H99-D103 PolarHBondContact ND1-OD2 2.95Å; H99-D103 PolarHBondContact O-N 3.14Å; E100-D103 PolarHBondContact O-N 2.8Å; D103-G107 PolarHBondContact O-N 3.16Å
104	E	66.2	Low	57.7	Low	144 Å²	144	100.6 Å²	100.6	67%	0.673	51%	0.506	S	S	*	.	H	α-helix	trans	-71.5	-33.5	175.7	-76.2	-168.8	-173.3	0	0	113.2	E100 E101 A102 G107 T108	E100-E104 WeakPolarHBondContact O-CG 3.5Å; E100-E104 PolarHBondContact O-N 2.99Å; E101-E104 PolarHBondContact O-N 3.14Å; A102-E104 VanDerWaalsContact C-N 3.32Å; A102-E104 PolarHBondContact O-N 3.29Å; E104-G107 PolarHBondContact O-N 3.4Å; E104-G107 VanDerWaalsContact O-N 3.09Å; E104-T108 PolarHBondContact O-N 2.69Å; E104-T108 VanDerWaalsContact O-N 3.11Å
105	E	57.8	Low	56.7	Low	131 Å²	131	103 Å²	103	61%	0.612	52%	0.524	S	S	*	.	H	α-helix	trans	-66.6	-33.9	175.4	-78.4	-165.1	163.9	0	0	112.8	E101 A102 G107	E101-E105 WeakPolarHBondContact O-CG 3.33Å; E101-E105 PolarHBondContact O-N 2.83Å; A102-E105 PolarHBondContact O-N 3.47Å; E105-G107 PolarHBondContact O-N 2.88Å
106	E	54.2	Low	56.1	Low	177 Å²	177	105.9 Å²	105.9	83%	0.827	54%	0.542	S	S	*	.	H	α-helix	trans	-67.4	-26.5	169.9	-69.1	-161.5	158.7	0	0	112.3	A102	A102-E106 PolarHBondContact O-N 2.79Å
107	G	44.7	Very low	55.8	Low	58 Å²	58	112.4 Å²	112.4	60%	0.598	57%	0.572	S	S	*	*	H	α-helix	trans	-86.2	-35	-174.3	0	0	0	0	0	116.1	D103 E104 E105	D103-G107 PolarHBondContact O-N 3.16Å; E104-G107 PolarHBondContact O-N 3.4Å; E104-G107 VanDerWaalsContact O-N 3.09Å; E105-G107 PolarHBondContact O-N 2.88Å
108	T	39.4	Very low	55.9	Low	91 Å²	91	110.4 Å²	110.4	56%	0.558	56%	0.563	S	S	*	*			trans	-145	133.8	-178.2	53.9	0	0	0	0	115.1	E104 K110	E104-T108 PolarHBondContact O-N 2.69Å; E104-T108 VanDerWaalsContact O-N 3.11Å; T108-K110 PolarHBondContact O-N 3.19Å
109	K	40.1	Very low	56.4	Low	221 Å²	221	109.1 Å²	109.1	96%	0.961	57%	0.569	S	S	*	*			trans	-66.3	86.6	173.3	-68.2	-176.7	178.8	-179.5	0	112.1
110	K	35.5	Very low	57	Low	183 Å²	183	110.7 Å²	110.7	80%	0.796	58%	0.579	S	S	*	*			trans	-106.8	162.3	161.3	-85.7	178.6	178.5	168.7	0	111	T108 T112	T108-K110 PolarHBondContact O-N 3.19Å; K110-T112 PolarHBondContact O-N 2.86Å
111	K	33.6	Very low	57.7	Low	206 Å²	206	112.6 Å²	112.6	90%	0.896	59%	0.586	S	S	*	*			trans	-59.2	124	-174	-77.3	-178.2	173.4	-179.8	0	110.9	V113	K111-V113 PolarHBondContact O-N 3.47Å
112	T	30.3	Very low	58.1	Low	114 Å²	114	109.5 Å²	109.5	70%	0.699	57%	0.572	S	S	*	*			trans	-59.7	112	177.6	50.5	0	0	0	0	111.8	K110 K114	K110-T112 PolarHBondContact O-N 2.86Å; T112-K114 PolarHBondContact O-N 3.23Å
113	V	35.4	Very low	58.8	Low	127 Å²	127	108 Å²	108	77%	0.77	56%	0.56	S	S	*	*			trans	-82	101.9	150.7	178.5	0	0	0	0	105.2	K111 S115	K111-V113 PolarHBondContact O-N 3.47Å; V113-S115 PolarHBondContact O-N 3.06Å
114	K	40.7	Very low	59.9	Low	192 Å²	192	103.6 Å²	103.6	84%	0.835	54%	0.536	S	S	*	.			trans	-56.1	109.3	-179.4	-77.4	179.1	176.3	173.3	0	109.7	T112	T112-K114 PolarHBondContact O-N 3.23Å
115	S	51.6	Low	61.2	Low	63 Å²	63	98.2 Å²	98.2	44%	0.441	51%	0.51	S	S	.	.			trans	-58.4	144.4	167.4	56.3	0	0	0	0	109.7	V113 Q117	V113-S115 PolarHBondContact O-N 3.06Å; S115-Q117 PolarHBondContact O-N 2.72Å
116	P	56.1	Low	62.6	Low	68 Å²	68	92.7 Å²	92.7	44%	0.442	49%	0.485	S	S	.	.			trans	-72.9	95.2	-172.9	29	-34.4	0	0	0	110.7	M118	P116-M118 HydrophobicContact CG-CE 4.47Å; P116-M118 VanDerWaalsContact O-CG 3.28Å; P116-M118 WeakPolarHBondContact O-CG 3.4Å; P116-M118 PolarHBondContact O-N 2.71Å
117	Q	69.7	Low	64.2	Low	138 Å²	138	84.4 Å²	84.4	65%	0.645	45%	0.446	S	S	*	.			trans	-58.6	97	179.1	-70.3	-170.4	1.6	0	0	112.4	S115 K445	S115-Q117 PolarHBondContact O-N 2.72Å; Q117-K445 HydrophobicContact CB-CB 4.28Å
118	M	79.4	Confident	66.3	Low	22 Å²	22	81.6 Å²	81.6	11%	0.108	42%	0.417	C	S	.	.	B	Isolated β-bridge	trans	-83	143.3	179	-60.3	-158	-175.5	0	0	111.7	P116 R440 D443 L444 K445	P116-M118 HydrophobicContact CG-CE 4.47Å; P116-M118 VanDerWaalsContact O-CG 3.28Å; P116-M118 WeakPolarHBondContact O-CG 3.4Å; P116-M118 PolarHBondContact O-N 2.71Å; M118-R440 PolarHBondContact SD-NH1 2.83Å; M118-D443 HydrophobicContact CG-CB 4.3Å; M118-D443 PolarHBondContact N-O 2.95Å; M118-L444 HydrophobicContact CB-CD2 4.34Å; M118-K445 PolarHBondContact O-N 3.35Å; M118-K445 VanDerWaalsContact O-N 3.11Å
119	G	86.4	Confident	68.7	Low	42 Å²	42	77.9 Å²	77.9	43%	0.433	39%	0.394	S	S	.	.			trans	-91.7	165.7	170.8	0	0	0	0	0	112.6	F121 M122 G123	G119-F121 VanDerWaalsContact C-N 3.27Å; G119-F121 PolarHBondContact O-N 3.07Å; G119-F121 VanDerWaalsContact O-N 3.08Å; G119-M122 PolarHBondContact O-N 3.18Å; G119-G123 WeakPolarHBondContact O-CA 3.41Å; G119-G123 PolarHBondContact O-N 2.9Å
120	T	90.3	Very high	71	Confident	43 Å²	43	68 Å²	68	26%	0.264	35%	0.351	S	S	.	.	H	α-helix	trans	-47.8	-41.1	-174.5	-45.5	0	0	0	0	114.9	V124 Y125 S450 I453	T120-V124 WeakPolarHBondContact O-CB 3.26Å; T120-V124 PolarHBondContact O-N 3.31Å; T120-V124 VanDerWaalsContact O-N 3.07Å; T120-Y125 PolarHBondContact O-N 3.43Å; T120-S450 WeakPolarHBondContact CG2-O 3.44Å; T120-S450 PolarHBondContact OG1-OG 2.75Å; T120-I453 HydrophobicContact CG2-CB 4.2Å; T120-I453 HydrophobicContact CG2-CG2 4.17Å
121	F	89.6	Confident	73.4	Confident	121 Å²	121	60.7 Å²	60.7	53%	0.531	32%	0.321	S	S	.	.	I	π-helix	trans	-67.4	-56.3	-176.6	-175.6	-103.9	0	0	0	112.9	G119 Y125 L126	G119-F121 VanDerWaalsContact C-N 3.27Å; G119-F121 PolarHBondContact O-N 3.07Å; G119-F121 VanDerWaalsContact O-N 3.08Å; F121-Y125 AromaticContact CD2-CD1 3.54Å; F121-Y125 HydrophobicContact CD2-CD1 3.54Å; F121-Y125 HydrophobicContact CD2-CE1 4.08Å; F121-Y125 HydrophobicContact CD2-CG 4.3Å; F121-Y125 AromaticContact CE2-CD1 3.47Å; F121-Y125 HydrophobicContact CE2-CD1 3.47Å; F121-Y125 VanDerWaalsContact CE2-CD1 3.47Å; F121-Y125 AromaticContact CE2-CE1 3.55Å; F121-Y125 HydrophobicContact CE2-CE1 3.55Å; F121-Y125 HydrophobicContact CG-CD1 4.49Å; F121-Y125 HydrophobicContact CZ-CD1 4.37Å; F121-Y125 HydrophobicContact CZ-CE1 4.38Å; F121-Y125 PolarHBondContact O-N 2.85Å; F121-L126 HydrophobicContact CD1-CD1 4.12Å; F121-L126 HydrophobicContact CD1-CG 4.34Å; F121-L126 HydrophobicContact CE1-CD1 3.68Å; F121-L126 HydrophobicContact CE1-CD2 4.24Å; F121-L126 HydrophobicContact CE1-CG 4.01Å; F121-L126 HydrophobicContact CE2-CD2 4.31Å; F121-L126 HydrophobicContact CZ-CD1 4.19Å; F121-L126 HydrophobicContact CZ-CD2 3.88Å; F121-L126 HydrophobicContact CZ-CG 4.11Å; F121-L126 PolarHBondContact O-N 3.15Å
122	M	84.2	Confident	76.1	Confident	35 Å²	35	50.9 Å²	50.9	17%	0.172	28%	0.278	C	S	.	.	I	π-helix	trans	-74.5	-32.9	-179.8	-70.8	-65	-74.4	0	0	112.8	K85 L86 Y89 G119 L126 P127 R440	K85-M122 WeakPolarHBondContact O-CE 3.4Å; L86-M122 HydrophobicContact CD2-CE 3.74Å; L86-M122 HydrophobicContact CD2-SD 4.19Å; L86-M122 HydrophobicContact CG-CE 4.29Å; Y89-M122 HydrophobicContact CD2-CE 3.74Å; Y89-M122 HydrophobicContact CG-CE 4.23Å; G119-M122 PolarHBondContact O-N 3.18Å; M122-L126 HydrophobicContact SD-CD1 3.64Å; M122-P127 WeakPolarHBondContact O-CD 3.41Å; M122-R440 PolarHBondContact O-NH1 3.37Å
123	G	82.3	Confident	78.8	Confident	0 Å²	0	45.6 Å²	45.6	0%	0	25%	0.246	C	C	.	.	I	π-helix	trans	-82.6	-36.4	-173.2	0	0	0	0	0	114.9	G119	G119-G123 WeakPolarHBondContact O-CA 3.41Å; G119-G123 PolarHBondContact O-N 2.9Å
124	V	90.7	Very high	81	Confident	0 Å²	0	39.8 Å²	39.8	0%	0	21%	0.211	C	C	.	.	I	π-helix	trans	-124.9	-52.5	-171.5	-178.5	0	0	0	0	112	T120 P127 C128 L444 I451	T120-V124 WeakPolarHBondContact O-CB 3.26Å; T120-V124 PolarHBondContact O-N 3.31Å; T120-V124 VanDerWaalsContact O-N 3.07Å; V124-P127 WeakPolarHBondContact O-CD 3.42Å; V124-C128 WeakPolarHBondContact O-CB 3.43Å; V124-C128 PolarHBondContact O-N 2.79Å; V124-L444 HydrophobicContact CG2-CD1 3.65Å; V124-L444 HydrophobicContact CG2-CD2 3.76Å; V124-L444 HydrophobicContact CG2-CG 4.38Å; V124-I451 HydrophobicContact CG2-CG1 4.38Å
125	Y	92.7	Very high	83.1	Confident	31 Å²	31	30.7 Å²	30.7	12%	0.122	17%	0.171	C	C	.	.	I	π-helix	trans	-65.8	-54	-172	170.7	-97.2	0	0	0	112.7	T120 F121 C128 L129 L457 A458 T461	T120-Y125 PolarHBondContact O-N 3.43Å; F121-Y125 AromaticContact CD2-CD1 3.54Å; F121-Y125 HydrophobicContact CD2-CD1 3.54Å; F121-Y125 HydrophobicContact CD2-CE1 4.08Å; F121-Y125 HydrophobicContact CD2-CG 4.3Å; F121-Y125 AromaticContact CE2-CD1 3.47Å; F121-Y125 HydrophobicContact CE2-CD1 3.47Å; F121-Y125 VanDerWaalsContact CE2-CD1 3.47Å; F121-Y125 AromaticContact CE2-CE1 3.55Å; F121-Y125 HydrophobicContact CE2-CE1 3.55Å; F121-Y125 HydrophobicContact CG-CD1 4.49Å; F121-Y125 HydrophobicContact CZ-CD1 4.37Å; F121-Y125 HydrophobicContact CZ-CE1 4.38Å; F121-Y125 PolarHBondContact O-N 2.85Å; Y125-C128 PolarHBondContact O-N 3.26Å; Y125-L129 HydrophobicContact CE1-CD2 4.1Å; Y125-L129 VanDerWaalsContact O-CB 3.29Å; Y125-L129 WeakPolarHBondContact O-CB 3.24Å; Y125-L129 PolarHBondContact O-N 3.19Å; Y125-L457 HydrophobicContact CD2-CB 4.11Å; Y125-L457 HydrophobicContact CD2-CD2 3.94Å; Y125-L457 HydrophobicContact CD2-CG 3.93Å; Y125-L457 HydrophobicContact CE2-CB 4.38Å; Y125-L457 HydrophobicContact CE2-CD2 4.05Å; Y125-L457 HydrophobicContact CE2-CG 3.81Å; Y125-A458 HydrophobicContact CD2-CB 3.87Å; Y125-A458 HydrophobicContact CE2-CB 4.22Å; Y125-T461 PolarHBondContact OH-OG1 3.25Å
126	L	88.7	Confident	85	Confident	15 Å²	15	27.8 Å²	27.8	8%	0.079	15%	0.151	C	C	.	.	H	α-helix	trans	-63.7	-43.1	-179.8	-66.6	-179.6	0	0	0	113.5	Y89 F121 M122 C128 L129 Q130 L281	Y89-L126 HydrophobicContact CE2-CB 4.16Å; F121-L126 HydrophobicContact CD1-CD1 4.12Å; F121-L126 HydrophobicContact CD1-CG 4.34Å; F121-L126 HydrophobicContact CE1-CD1 3.68Å; F121-L126 HydrophobicContact CE1-CD2 4.24Å; F121-L126 HydrophobicContact CE1-CG 4.01Å; F121-L126 HydrophobicContact CE2-CD2 4.31Å; F121-L126 HydrophobicContact CZ-CD1 4.19Å; F121-L126 HydrophobicContact CZ-CD2 3.88Å; F121-L126 HydrophobicContact CZ-CG 4.11Å; F121-L126 PolarHBondContact O-N 3.15Å; M122-L126 HydrophobicContact SD-CD1 3.64Å; L126-C128 VanDerWaalsContact C-N 3.35Å; L126-C128 PolarHBondContact O-N 2.87Å; L126-L129 HydrophobicContact CD2-CD2 4.37Å; L126-L129 PolarHBondContact O-N 2.91Å; L126-Q130 WeakPolarHBondContact O-CB 3.38Å; L126-Q130 PolarHBondContact O-N 3.03Å; L126-L281 HydrophobicContact CB-CD2 4.16Å; L126-L281 HydrophobicContact CD1-CD2 4.07Å; L126-L281 HydrophobicContact CD2-CD2 4.27Å; L126-L281 HydrophobicContact CG-CD2 4.4Å
127	P	86.6	Confident	86.6	Confident	2 Å²	2	24.8 Å²	24.8	1%	0.013	13%	0.131	C	C	.	.	H	α-helix	trans	-62.5	-38.6	174.7	-26.4	37.5	0	0	0	113.3	Y89 M122 V124 N131 R440	Y89-P127 HydrophobicContact CE2-CG 4.11Å; M122-P127 WeakPolarHBondContact O-CD 3.41Å; V124-P127 WeakPolarHBondContact O-CD 3.42Å; P127-N131 PolarHBondContact O-N 3.33Å; P127-N131 PolarHBondContact O-ND2 3.23Å; P127-R440 VanDerWaalsContact CG-CZ 3.49Å
128	C	90.1	Very high	87.6	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.101	C	C	.	.	H	α-helix	trans	-65.5	-48.7	175.5	-167.5	0	0	0	0	111.1	V124 Y125 L126 Q130 N131 I132 A458	V124-C128 WeakPolarHBondContact O-CB 3.43Å; V124-C128 PolarHBondContact O-N 2.79Å; Y125-C128 PolarHBondContact O-N 3.26Å; L126-C128 VanDerWaalsContact C-N 3.35Å; L126-C128 PolarHBondContact O-N 2.87Å; C128-Q130 VanDerWaalsContact C-N 3.3Å; C128-Q130 PolarHBondContact O-N 3.44Å; C128-N131 PolarHBondContact O-N 3.14Å; C128-I132 WeakPolarHBondContact O-CD1 3.34Å; C128-I132 VanDerWaalsContact O-CG1 3.31Å; C128-I132 WeakPolarHBondContact O-CG1 3.13Å; C128-I132 PolarHBondContact O-N 3.34Å; C128-I132 VanDerWaalsContact O-N 3.12Å; C128-A458 HydrophobicContact CB-CB 3.72Å
129	L	89.5	Confident	88.1	Confident	12 Å²	12	17.6 Å²	17.6	6%	0.063	10%	0.098	C	C	.	.	H	α-helix	trans	-55.8	-43.4	176.4	-172.7	69.6	0	0	0	112	Y125 L126 L133 T461 T462	Y125-L129 HydrophobicContact CE1-CD2 4.1Å; Y125-L129 VanDerWaalsContact O-CB 3.29Å; Y125-L129 WeakPolarHBondContact O-CB 3.24Å; Y125-L129 PolarHBondContact O-N 3.19Å; L126-L129 HydrophobicContact CD2-CD2 4.37Å; L126-L129 PolarHBondContact O-N 2.91Å; L129-L133 HydrophobicContact CD1-CD1 3.86Å; L129-L133 HydrophobicContact CD1-CG 4.42Å; L129-L133 HydrophobicContact CG-CD1 3.83Å; L129-L133 WeakPolarHBondContact O-CB 3.41Å; L129-L133 VanDerWaalsContact O-CG 3.3Å; L129-L133 WeakPolarHBondContact O-CG 3.46Å; L129-L133 PolarHBondContact O-N 3.14Å; L129-L133 VanDerWaalsContact O-N 3.16Å; L129-T461 HydrophobicContact CD1-CG2 4.14Å; L129-T462 HydrophobicContact CD1-CG2 3.57Å
130	Q	86.8	Confident	88.4	Confident	13 Å²	13	15.6 Å²	15.6	6%	0.061	8%	0.077	C	C	.	.	H	α-helix	trans	-67	-34.3	-179.8	-169.2	169.7	11.9	0	0	113.6	Y89 N91 L126 C128 A277 L281	Y89-Q130 PolarHBondContact OH-OE1 3.22Å; N91-Q130 PolarHBondContact ND2-NE2 2.9Å; N91-Q130 PolarHBondContact ND2-OE1 3.35Å; L126-Q130 WeakPolarHBondContact O-CB 3.38Å; L126-Q130 PolarHBondContact O-N 3.03Å; C128-Q130 VanDerWaalsContact C-N 3.3Å; C128-Q130 PolarHBondContact O-N 3.44Å; Q130-A277 PolarHBondContact NE2-O 3.29Å; Q130-L281 HydrophobicContact CB-CD1 4.2Å; Q130-L281 HydrophobicContact CG-CD1 4.42Å
131	N	86	Confident	88.6	Confident	30 Å²	30	13.6 Å²	13.6	16%	0.16	7%	0.065	C	C	.	.	H	α-helix	trans	-80.7	-28	179.2	-80.4	-89.2	0	0	0	113.2	P127 C128 A436 Q521	P127-N131 PolarHBondContact O-N 3.33Å; P127-N131 PolarHBondContact O-ND2 3.23Å; C128-N131 PolarHBondContact O-N 3.14Å; N131-A436 HydrophobicContact CB-CB 3.79Å; N131-A436 WeakPolarHBondContact ND2-CB 3.44Å; N131-Q521 PolarHBondContact ND2-NE2 3.26Å; N131-Q521 VanDerWaalsContact OD1-CD 3.27Å; N131-Q521 PolarHBondContact OD1-NE2 3.33Å; N131-Q521 PolarHBondContact OD1-OE1 3.04Å
132	I	90.8	Very high	88.8	Confident	1 Å²	1	8.2 Å²	8.2	1%	0.005	4%	0.042	C	C	.	.	H	α-helix	trans	-76.6	-40.4	177	-61.3	161.1	0	0	0	110.7	C128 G134 S430 T432 I434 I459 T462 Y466	C128-I132 WeakPolarHBondContact O-CD1 3.34Å; C128-I132 VanDerWaalsContact O-CG1 3.31Å; C128-I132 WeakPolarHBondContact O-CG1 3.13Å; C128-I132 PolarHBondContact O-N 3.34Å; C128-I132 VanDerWaalsContact O-N 3.12Å; I132-G134 PolarHBondContact O-N 3Å; I132-S430 WeakPolarHBondContact CG2-O 3.39Å; I132-S430 VanDerWaalsContact O-O 3.05Å; I132-T432 WeakPolarHBondContact CA-O 3.45Å; I132-T432 VanDerWaalsContact CG1-O 3.25Å; I132-T432 WeakPolarHBondContact CG1-O 3.31Å; I132-I434 HydrophobicContact CD1-CG2 4.45Å; I132-I459 HydrophobicContact CD1-CG1 4.21Å; I132-T462 HydrophobicContact CB-CG2 3.97Å; I132-T462 HydrophobicContact CD1-CG2 4.22Å; I132-T462 HydrophobicContact CG2-CG2 3.68Å; I132-Y466 HydrophobicContact CG2-CE2 4.24Å; I132-Y466 PolarHBondContact O-OH 3.36Å
133	L	88.3	Confident	89.3	Confident	3 Å²	3	7 Å²	7	2%	0.016	4%	0.035	C	C	.	.	S	Bend	trans	-77.7	79.2	-176.5	-66	173.7	0	0	0	112.3	L129 L137 V284 I288 T462	L129-L133 HydrophobicContact CD1-CD1 3.86Å; L129-L133 HydrophobicContact CD1-CG 4.42Å; L129-L133 HydrophobicContact CG-CD1 3.83Å; L129-L133 WeakPolarHBondContact O-CB 3.41Å; L129-L133 VanDerWaalsContact O-CG 3.3Å; L129-L133 WeakPolarHBondContact O-CG 3.46Å; L129-L133 PolarHBondContact O-N 3.14Å; L129-L133 VanDerWaalsContact O-N 3.16Å; L133-L137 HydrophobicContact CD2-CD2 4.07Å; L133-V284 HydrophobicContact CB-CG1 3.92Å; L133-V284 HydrophobicContact CD1-CG1 3.75Å; L133-V284 HydrophobicContact CG-CG1 4.47Å; L133-I288 HydrophobicContact CD1-CD1 3.76Å; L133-I288 HydrophobicContact CD2-CD1 4.15Å; L133-T462 HydrophobicContact CD2-CG2 4.01Å; L133-T462 HydrophobicContact CG-CG2 4.1Å
134	G	80.5	Confident	89.9	Confident	4 Å²	4	7.1 Å²	7.1	4%	0.041	4%	0.036	C	C	.	.			trans	-105.2	-171.3	-178.7	0	0	0	0	0	116.1	I132 I136 L137	I132-G134 PolarHBondContact O-N 3Å; G134-I136 VanDerWaalsContact C-N 3.26Å; G134-I136 PolarHBondContact O-N 3.34Å; G134-I136 VanDerWaalsContact O-N 3.09Å; G134-L137 PolarHBondContact O-N 3.22Å
135	V	85.3	Confident	90.2	Very high	1 Å²	1	7.1 Å²	7.1	1%	0.006	4%	0.036	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.6	-36.9	-175.7	65.6	0	0	0	0	115.4	L137 F138 L139 M215 Y216 C515 L574	V135-L137 VanDerWaalsContact C-N 3.26Å; V135-L137 PolarHBondContact O-N 3.16Å; V135-F138 PolarHBondContact O-N 2.87Å; V135-F138 VanDerWaalsContact O-N 3.11Å; V135-L139 HydrophobicContact CG2-CB 4.13Å; V135-L139 HydrophobicContact CG2-CD1 4.06Å; V135-L139 HydrophobicContact CG2-CD2 3.78Å; V135-L139 HydrophobicContact CG2-CG 4.21Å; V135-L139 PolarHBondContact O-N 2.58Å; V135-M215 HydrophobicContact CG1-CE 3.87Å; V135-Y216 HydrophobicContact CB-CD1 4.35Å; V135-Y216 HydrophobicContact CG1-CD1 4.05Å; V135-Y216 HydrophobicContact CG1-CE1 4.22Å; V135-C515 VanDerWaalsContact CB-SG 3.53Å; V135-L574 HydrophobicContact CG2-CD1 4.32Å
136	I	90.6	Very high	90.2	Very high	3 Å²	3	6 Å²	6	2%	0.015	3%	0.034	C	C	.	.	H	α-helix	trans	-60.7	-33.8	-174.8	-65.6	-60.3	0	0	0	112.4	G134 F138 R140 L141 M215 I426 Y427 L574	G134-I136 VanDerWaalsContact C-N 3.26Å; G134-I136 PolarHBondContact O-N 3.34Å; G134-I136 VanDerWaalsContact O-N 3.09Å; I136-F138 VanDerWaalsContact C-N 3.26Å; I136-F138 PolarHBondContact O-N 2.97Å; I136-R140 HydrophobicContact CD1-CB 4.03Å; I136-R140 HydrophobicContact CD1-CG 3.87Å; I136-R140 HydrophobicContact CG2-CB 4.29Å; I136-R140 PolarHBondContact O-N 2.87Å; I136-R140 VanDerWaalsContact O-N 3.15Å; I136-L141 PolarHBondContact O-N 3.15Å; I136-M215 HydrophobicContact CD1-CE 3.47Å; I136-M215 VanDerWaalsContact CD1-CE 3.47Å; I136-M215 HydrophobicContact CG1-CE 3.58Å; I136-I426 HydrophobicContact CD1-CG2 4.36Å; I136-Y427 HydrophobicContact CG2-CD2 4.33Å; I136-L574 HydrophobicContact CD1-CD2 4.19Å
137	L	91	Very high	90.4	Very high	5 Å²	5	5.3 Å²	5.3	3%	0.026	3%	0.03	C	C	.	.	H	α-helix	trans	-57.1	-40.8	177	177	60.6	0	0	0	111.9	L133 G134 V135 L141 I288 I465 Y466	L133-L137 HydrophobicContact CD2-CD2 4.07Å; G134-L137 PolarHBondContact O-N 3.22Å; V135-L137 VanDerWaalsContact C-N 3.26Å; V135-L137 PolarHBondContact O-N 3.16Å; L137-L141 HydrophobicContact CD1-CD2 3.8Å; L137-I288 HydrophobicContact CD2-CD1 4.08Å; L137-I288 HydrophobicContact CD2-CG1 4.15Å; L137-I465 HydrophobicContact CD1-CG2 4.47Å; L137-Y466 HydrophobicContact CB-CE1 4.07Å; L137-Y466 HydrophobicContact CD1-CD1 3.96Å; L137-Y466 HydrophobicContact CD1-CE1 3.77Å; L137-Y466 HydrophobicContact CG-CE1 4.38Å
138	F	90.6	Very high	90.8	Very high	1 Å²	1	5.2 Å²	5.2	0%	0.004	3%	0.029	C	C	.	.	H	α-helix	trans	-94.4	-39.2	-173.7	-56.7	-67.3	0	0	0	112.9	V135 I136 I291 I507	V135-F138 PolarHBondContact O-N 2.87Å; V135-F138 VanDerWaalsContact O-N 3.11Å; I136-F138 VanDerWaalsContact C-N 3.26Å; I136-F138 PolarHBondContact O-N 2.97Å; F138-I291 HydrophobicContact CD1-CD1 4.23Å; F138-I291 HydrophobicContact CE1-CD1 3.96Å; F138-I507 HydrophobicContact CD1-CG2 3.92Å; F138-I507 HydrophobicContact CE1-CG2 4.47Å
139	L	89.8	Confident	91	Very high	7 Å²	7	5.2 Å²	5.2	4%	0.037	3%	0.03	C	C	.	.	H	α-helix	trans	-98.8	-17.3	-169.5	-90.6	69.9	0	0	0	115.2	V135 E222 I223 L494	V135-L139 HydrophobicContact CG2-CB 4.13Å; V135-L139 HydrophobicContact CG2-CD1 4.06Å; V135-L139 HydrophobicContact CG2-CD2 3.78Å; V135-L139 HydrophobicContact CG2-CG 4.21Å; V135-L139 PolarHBondContact O-N 2.58Å; L139-E222 HydrophobicContact CD2-CB 4.31Å; L139-E222 HydrophobicContact CD2-CG 4.24Å; L139-I223 HydrophobicContact CD1-CD1 3.85Å; L139-I223 HydrophobicContact CD1-CG1 3.83Å; L139-I223 HydrophobicContact CD2-CD1 4.46Å; L139-I223 HydrophobicContact CD2-CG1 3.98Å; L139-I223 HydrophobicContact CG-CG1 4.41Å; L139-L494 HydrophobicContact CD1-CD1 4.34Å
140	R	93	Very high	91.4	Very high	1 Å²	1	5 Å²	5	0%	0.004	3%	0.028	C	C	.	.	T	Hydrogen-bonded Turn	trans	-134.2	-22.1	-171.8	-65	-63.2	-177.7	-87.8	-7.4	114.7	I136 T142 W143 I144 E222 I426 K485 D575	I136-R140 HydrophobicContact CD1-CB 4.03Å; I136-R140 HydrophobicContact CD1-CG 3.87Å; I136-R140 HydrophobicContact CG2-CB 4.29Å; I136-R140 PolarHBondContact O-N 2.87Å; I136-R140 VanDerWaalsContact O-N 3.15Å; R140-T142 PolarHBondContact O-N 3.47Å; R140-W143 PolarHBondContact O-N 2.91Å; R140-W143 VanDerWaalsContact O-N 3.16Å; R140-I144 HydrophobicContact CB-CD1 4.31Å; R140-I144 VanDerWaalsContact O-CG1 3.32Å; R140-I144 WeakPolarHBondContact O-CG1 3.16Å; R140-I144 PolarHBondContact O-N 3.48Å; R140-E222 IonicContact CZ-OE1 2.71Å; R140-E222 IonicContact CZ-OE2 3.74Å; R140-E222 IonicContact NH1-OE1 3.29Å; R140-E222 PolarHBondContact NH1-OE1 3.45Å; R140-E222 IonicContact NH1-OE2 3.39Å; R140-E222 IonicContact NH2-OE1 3.95Å; R140-E222 PolarHBondContact NH2-OE1 3.12Å; R140-E222 IonicContact NH2-OE2 2.79Å; R140-E222 PolarHBondContact NH2-OE2 3.1Å; R140-I426 HydrophobicContact CG-CG2 4.5Å; R140-K485 VanDerWaalsContact CZ-CE 3.49Å; R140-D575 IonicContact CZ-OD1 3.7Å; R140-D575 IonicContact NE-OD1 3.72Å; R140-D575 PolarHBondContact NE-OD1 3.14Å; R140-D575 IonicContact NE-OD2 3.4Å; R140-D575 IonicContact NH2-OD1 3.38Å; R140-D575 PolarHBondContact NH2-OD1 3.4Å; R140-D575 VanDerWaalsContact NH2-OD1 3.15Å; R140-D575 IonicContact NH2-OD2 3.5Å
141	L	93.3	Very high	91.8	Very high	1 Å²	1	8.4 Å²	8.4	1%	0.005	5%	0.046	C	C	.	.	H	α-helix	trans	-62.2	-41.8	-176.8	-172.7	53.7	0	0	0	113	I136 L137 W143 I144 V145 Y427 Y466 V470 F473	I136-L141 PolarHBondContact O-N 3.15Å; L137-L141 HydrophobicContact CD1-CD2 3.8Å; L141-W143 VanDerWaalsContact C-N 3.32Å; L141-W143 PolarHBondContact O-N 3.26Å; L141-I144 PolarHBondContact O-N 2.93Å; L141-V145 HydrophobicContact CD1-CG2 4.48Å; L141-V145 VanDerWaalsContact O-CG2 3.26Å; L141-V145 WeakPolarHBondContact O-CG2 3.43Å; L141-V145 PolarHBondContact O-N 2.88Å; L141-Y427 HydrophobicContact CD1-CD2 4.46Å; L141-Y427 HydrophobicContact CD1-CE2 4.05Å; L141-Y466 HydrophobicContact CD2-CD1 4.04Å; L141-V470 HydrophobicContact CD1-CG2 3.91Å; L141-F473 HydrophobicContact CB-CE2 4.46Å; L141-F473 HydrophobicContact CD2-CE2 3.87Å; L141-F473 HydrophobicContact CG-CD2 4.31Å; L141-F473 HydrophobicContact CG-CE2 4.01Å
142	T	94.1	Very high	92.2	Very high	8 Å²	8	9.6 Å²	9.6	5%	0.049	5%	0.051	C	C	.	.	H	α-helix	trans	-59.9	-42.1	174.1	48	0	0	0	0	112.2	R140 V145 G146 F473 L482 V495 I496	R140-T142 PolarHBondContact O-N 3.47Å; T142-V145 PolarHBondContact O-N 3.26Å; T142-G146 PolarHBondContact O-N 2.79Å; T142-F473 HydrophobicContact CG2-CD2 3.91Å; T142-F473 HydrophobicContact CG2-CE2 4.4Å; T142-F473 HydrophobicContact CG2-CG 4.2Å; T142-L482 HydrophobicContact CG2-CD2 4.34Å; T142-V495 HydrophobicContact CG2-CG1 4.25Å; T142-I496 HydrophobicContact CG2-CB 3.97Å; T142-I496 HydrophobicContact CG2-CG1 4.21Å
143	W	94.6	Very high	92.4	Very high	10 Å²	10	9.5 Å²	9.5	4%	0.038	5%	0.051	C	C	.	.	H	α-helix	trans	-68.8	-38.2	178.8	179.6	78	0	0	0	113.4	R140 L141 V145 G146 T147 I416 T418 L423 I426 L482 K485	R140-W143 PolarHBondContact O-N 2.91Å; R140-W143 VanDerWaalsContact O-N 3.16Å; L141-W143 VanDerWaalsContact C-N 3.32Å; L141-W143 PolarHBondContact O-N 3.26Å; W143-V145 VanDerWaalsContact C-N 3.35Å; W143-G146 PolarHBondContact O-N 3.45Å; W143-T147 HydrophobicContact CD2-CG2 4.33Å; W143-T147 HydrophobicContact CZ2-CG2 4.12Å; W143-T147 WeakPolarHBondContact O-CB 3.34Å; W143-T147 WeakPolarHBondContact O-CG2 3.18Å; W143-T147 PolarHBondContact O-N 3.44Å; W143-T147 PolarHBondContact O-OG1 3.15Å; W143-I416 HydrophobicContact CH2-CD1 3.79Å; W143-I416 HydrophobicContact CH2-CG1 4.01Å; W143-I416 HydrophobicContact CZ2-CD1 4.34Å; W143-I416 HydrophobicContact CZ2-CG1 4.07Å; W143-T418 HydrophobicContact CH2-CG2 3.66Å; W143-T418 HydrophobicContact CZ2-CG2 3.44Å; W143-T418 VanDerWaalsContact CZ2-CG2 3.44Å; W143-L423 HydrophobicContact CE3-CD2 4.26Å; W143-L423 HydrophobicContact CH2-CD2 3.69Å; W143-L423 HydrophobicContact CZ3-CD2 3.39Å; W143-I426 HydrophobicContact CZ3-CD1 4.24Å; W143-L482 VanDerWaalsContact CA-O 3.31Å; W143-L482 WeakPolarHBondContact CA-O 3.45Å; W143-K485 HydrophobicContact CG-CB 4.37Å
144	I	95.1	Very high	92.8	Very high	2 Å²	2	11.8 Å²	11.8	1%	0.01	6%	0.063	C	C	.	.	H	α-helix	trans	-61.4	-45.4	171.7	-67.6	162.2	0	0	0	109.8	R140 L141 G146 T147 A148 S153 I156 L423 Y427	R140-I144 HydrophobicContact CB-CD1 4.31Å; R140-I144 VanDerWaalsContact O-CG1 3.32Å; R140-I144 WeakPolarHBondContact O-CG1 3.16Å; R140-I144 PolarHBondContact O-N 3.48Å; L141-I144 PolarHBondContact O-N 2.93Å; I144-G146 PolarHBondContact O-N 3.24Å; I144-T147 PolarHBondContact O-N 2.93Å; I144-T147 PolarHBondContact O-OG1 3.23Å; I144-A148 WeakPolarHBondContact O-CB 3.41Å; I144-A148 PolarHBondContact O-N 3.39Å; I144-S153 PolarHBondContact O-OG 3.46Å; I144-I156 HydrophobicContact CG2-CD1 4.47Å; I144-L423 HydrophobicContact CG1-CD2 4.37Å; I144-Y427 HydrophobicContact CD1-CD2 3.97Å
145	V	96	Very high	93.5	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-62.9	-40.3	176.6	177.5	0	0	0	0	111.9	L141 T142 W143 G149 I150 S153 V470 L482	L141-V145 HydrophobicContact CD1-CG2 4.48Å; L141-V145 VanDerWaalsContact O-CG2 3.26Å; L141-V145 WeakPolarHBondContact O-CG2 3.43Å; L141-V145 PolarHBondContact O-N 2.88Å; T142-V145 PolarHBondContact O-N 3.26Å; W143-V145 VanDerWaalsContact C-N 3.35Å; V145-G149 CarbonylContact O-C 3.46Å; V145-G149 WeakPolarHBondContact O-CA 3.24Å; V145-G149 PolarHBondContact O-N 3.01Å; V145-I150 HydrophobicContact CG1-CG1 4.38Å; V145-S153 WeakPolarHBondContact CA-OG 3.35Å; V145-V470 HydrophobicContact CG2-CB 4.15Å; V145-V470 HydrophobicContact CG2-CG1 4.09Å; V145-V470 HydrophobicContact CG2-CG2 3.9Å; V145-L482 HydrophobicContact CG1-CD1 4.29Å
146	G	93.5	Very high	94	Very high	7 Å²	7	14 Å²	14	7%	0.072	8%	0.08	C	C	.	.	H	α-helix	trans	-69	-29.7	177.2	0	0	0	0	0	114.9	T142 W143 I144 R483	T142-G146 PolarHBondContact O-N 2.79Å; W143-G146 PolarHBondContact O-N 3.45Å; I144-G146 PolarHBondContact O-N 3.24Å; G146-R483 WeakPolarHBondContact O-CD 3.41Å; G146-R483 WeakPolarHBondContact O-CG 3.29Å
147	T	93.8	Very high	94.2	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	8%	0.08	C	C	.	.	H	α-helix	trans	-94.1	-41.2	-176	50.8	0	0	0	0	113.3	W143 I144 A382 T418 R483	W143-T147 HydrophobicContact CD2-CG2 4.33Å; W143-T147 HydrophobicContact CZ2-CG2 4.12Å; W143-T147 WeakPolarHBondContact O-CB 3.34Å; W143-T147 WeakPolarHBondContact O-CG2 3.18Å; W143-T147 PolarHBondContact O-N 3.44Å; W143-T147 PolarHBondContact O-OG1 3.15Å; I144-T147 PolarHBondContact O-N 2.93Å; I144-T147 PolarHBondContact O-OG1 3.23Å; T147-A382 CarbonylContact O-C 3.59Å; T147-A382 PolarHBondContact O-N 2.65Å; T147-T418 HydrophobicContact CG2-CG2 4.3Å; T147-R483 HydrophobicContact CG2-CG 4.41Å
148	A	94.4	Very high	94.4	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.094	C	C	.	.	H	α-helix	trans	-88.9	-17.8	176.8	0	0	0	0	0	113.2	I144 E152 I156 S381 L423	I144-A148 WeakPolarHBondContact O-CB 3.41Å; I144-A148 PolarHBondContact O-N 3.39Å; A148-E152 HydrophobicContact CB-CB 4Å; A148-E152 WeakPolarHBondContact O-CB 3.38Å; A148-I156 HydrophobicContact CB-CD1 4.32Å; A148-S381 WeakPolarHBondContact O-CA 3.35Å; A148-S381 WeakPolarHBondContact O-CB 3.13Å; A148-S381 PolarHBondContact O-N 3.28Å; A148-L423 HydrophobicContact CB-CD1 3.78Å
149	G	95.1	Very high	94.6	Very high	1 Å²	1	17.8 Å²	17.8	1%	0.01	11%	0.108	C	C	.	.	H	α-helix	trans	72.1	170.3	-167.7	0	0	0	0	0	112.2	V145 L151 S153 N378	V145-G149 CarbonylContact O-C 3.46Å; V145-G149 WeakPolarHBondContact O-CA 3.24Å; V145-G149 PolarHBondContact O-N 3.01Å; G149-L151 PolarHBondContact O-N 3.44Å; G149-S153 WeakPolarHBondContact O-CB 3.11Å; G149-S153 PolarHBondContact O-N 3Å; G149-S153 PolarHBondContact O-OG 2.94Å; G149-N378 CarbonylContact C-O 3.57Å; G149-N378 WeakPolarHBondContact CA-O 3.48Å
150	I	95.9	Very high	94.8	Very high	7 Å²	7	17.5 Å²	17.5	4%	0.036	11%	0.106	C	C	.	.	H	α-helix	trans	-61.8	-45	-174.7	-66.2	156.6	0	0	0	111.7	V145 S153 L154 I375 N378 M379 V470	V145-I150 HydrophobicContact CG1-CG1 4.38Å; I150-S153 PolarHBondContact O-N 3.32Å; I150-L154 HydrophobicContact CG2-CD1 3.93Å; I150-L154 HydrophobicContact CG2-CG 4.35Å; I150-L154 WeakPolarHBondContact O-CB 3.35Å; I150-L154 VanDerWaalsContact O-CG 3.3Å; I150-L154 WeakPolarHBondContact O-CG 3.39Å; I150-L154 PolarHBondContact O-N 2.91Å; I150-I375 HydrophobicContact CD1-CG1 3.62Å; I150-N378 HydrophobicContact CD1-CB 4Å; I150-N378 HydrophobicContact CG1-CB 4.4Å; I150-N378 WeakPolarHBondContact CG1-O 3.16Å; I150-N378 PolarHBondContact N-O 3.25Å; I150-M379 HydrophobicContact CB-SD 4.33Å; I150-M379 HydrophobicContact CD1-SD 4.02Å; I150-V470 HydrophobicContact CG2-CG1 4.34Å
151	L	95.3	Very high	94.9	Very high	84 Å²	84	18 Å²	18	44%	0.44	11%	0.11	S	C	.	.	H	α-helix	trans	-65.5	-49.4	-173.6	-70.7	176.3	0	0	0	112.7	G149 L154 A155 M379	G149-L151 PolarHBondContact O-N 3.44Å; L151-L154 PolarHBondContact O-N 2.83Å; L151-A155 PolarHBondContact O-N 3.2Å; L151-A155 VanDerWaalsContact O-N 3.14Å; L151-M379 HydrophobicContact CD1-CE 3.9Å; L151-M379 HydrophobicContact CD2-CE 3.71Å; L151-M379 HydrophobicContact CG-CE 3.65Å
152	E	95.2	Very high	95	Very high	55 Å²	55	20.7 Å²	20.7	26%	0.257	13%	0.129	S	C	.	.	H	α-helix	trans	-72	-34	178.9	-62.1	-177.1	-148.6	0	0	111.3	A148 L154 A155 I156 S381 Y383 F420	A148-E152 HydrophobicContact CB-CB 4Å; A148-E152 WeakPolarHBondContact O-CB 3.38Å; E152-L154 PolarHBondContact O-N 2.97Å; E152-A155 WeakPolarHBondContact O-CB 3.28Å; E152-A155 PolarHBondContact O-N 3.14Å; E152-A155 VanDerWaalsContact O-N 3.13Å; E152-I156 WeakPolarHBondContact O-CG1 3.06Å; E152-I156 PolarHBondContact O-N 2.89Å; E152-S381 WeakPolarHBondContact OE1-CB 3.17Å; E152-S381 PolarHBondContact OE1-OG 2.79Å; E152-Y383 WeakPolarHBondContact OE2-CE2 3.31Å; E152-Y383 VanDerWaalsContact OE2-CZ 3.27Å; E152-Y383 PolarHBondContact OE2-OH 3.1Å; E152-F420 HydrophobicContact CB-CD2 4.33Å; E152-F420 HydrophobicContact CB-CE2 4.31Å
153	S	96	Very high	95.1	Very high	0 Å²	0	20.3 Å²	20.3	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-60.5	-43.7	172.4	-63.7	0	0	0	0	112.1	I144 V145 G149 I150 A155 I156 V157	I144-S153 PolarHBondContact O-OG 3.46Å; V145-S153 WeakPolarHBondContact CA-OG 3.35Å; G149-S153 WeakPolarHBondContact O-CB 3.11Å; G149-S153 PolarHBondContact O-N 3Å; G149-S153 PolarHBondContact O-OG 2.94Å; I150-S153 PolarHBondContact O-N 3.32Å; S153-A155 VanDerWaalsContact C-N 3.28Å; S153-A155 PolarHBondContact O-N 3.31Å; S153-I156 PolarHBondContact O-N 3.04Å; S153-V157 VanDerWaalsContact O-CG2 3.31Å; S153-V157 WeakPolarHBondContact O-CG2 3.35Å; S153-V157 PolarHBondContact O-N 3.17Å
154	L	96.3	Very high	95.1	Very high	51 Å²	51	19.9 Å²	19.9	27%	0.267	13%	0.125	S	C	.	.	H	α-helix	trans	-61.8	-36.3	173.9	-75.6	175	0	0	0	112	I150 L151 E152 G158 V467 V470 I471	I150-L154 HydrophobicContact CG2-CD1 3.93Å; I150-L154 HydrophobicContact CG2-CG 4.35Å; I150-L154 WeakPolarHBondContact O-CB 3.35Å; I150-L154 VanDerWaalsContact O-CG 3.3Å; I150-L154 WeakPolarHBondContact O-CG 3.39Å; I150-L154 PolarHBondContact O-N 2.91Å; L151-L154 PolarHBondContact O-N 2.83Å; E152-L154 PolarHBondContact O-N 2.97Å; L154-G158 PolarHBondContact O-N 3.1Å; L154-V467 HydrophobicContact CD2-CB 4.5Å; L154-V467 HydrophobicContact CD2-CG1 3.93Å; L154-V470 HydrophobicContact CD2-CB 4.2Å; L154-V470 HydrophobicContact CD2-CG1 3.87Å; L154-V470 HydrophobicContact CG-CG1 3.81Å; L154-I471 HydrophobicContact CD1-CD1 4.48Å; L154-I471 HydrophobicContact CD1-CG1 4.22Å; L154-I471 HydrophobicContact CD2-CD1 4.4Å; L154-I471 HydrophobicContact CD2-CG1 4.18Å
155	A	95.1	Very high	95.1	Very high	50 Å²	50	22.2 Å²	22.2	41%	0.413	14%	0.137	S	C	.	.	H	α-helix	trans	-66	-43.6	173.7	0	0	0	0	0	112.1	L151 E152 S153 G158 L159	L151-A155 PolarHBondContact O-N 3.2Å; L151-A155 VanDerWaalsContact O-N 3.14Å; E152-A155 WeakPolarHBondContact O-CB 3.28Å; E152-A155 PolarHBondContact O-N 3.14Å; E152-A155 VanDerWaalsContact O-N 3.13Å; S153-A155 VanDerWaalsContact C-N 3.28Å; S153-A155 PolarHBondContact O-N 3.31Å; A155-G158 PolarHBondContact O-N 2.98Å; A155-L159 WeakPolarHBondContact O-CB 3.48Å; A155-L159 PolarHBondContact O-N 3.29Å
156	I	95.2	Very high	95.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-59.3	-50.9	175.5	-66.6	167	0	0	0	110.5	I144 A148 E152 S153 C160 F420 L423 V424 Y427	I144-I156 HydrophobicContact CG2-CD1 4.47Å; A148-I156 HydrophobicContact CB-CD1 4.32Å; E152-I156 WeakPolarHBondContact O-CG1 3.06Å; E152-I156 PolarHBondContact O-N 2.89Å; S153-I156 PolarHBondContact O-N 3.04Å; I156-C160 WeakPolarHBondContact O-CB 3.36Å; I156-C160 PolarHBondContact O-N 3.39Å; I156-C160 VanDerWaalsContact O-N 3.07Å; I156-C160 PolarHBondContact O-SG 2.92Å; I156-F420 HydrophobicContact CD1-CD2 4.16Å; I156-F420 HydrophobicContact CD1-CE2 4.05Å; I156-F420 HydrophobicContact CG1-CD2 4.14Å; I156-F420 HydrophobicContact CG1-CE2 3.54Å; I156-F420 HydrophobicContact CG1-CZ 3.92Å; I156-L423 HydrophobicContact CD1-CB 3.9Å; I156-V424 HydrophobicContact CG1-CG2 3.89Å; I156-V424 HydrophobicContact CG2-CG2 4.2Å; I156-Y427 HydrophobicContact CG2-CD1 3.81Å; I156-Y427 HydrophobicContact CG2-CG 3.83Å
157	V	95.4	Very high	95.3	Very high	2 Å²	2	23 Å²	23	1%	0.012	14%	0.139	C	C	.	.	H	α-helix	trans	-61.2	-50.3	178.4	175	0	0	0	0	110.9	S153 L159 C160 C161 Y427 V467 V470	S153-V157 VanDerWaalsContact O-CG2 3.31Å; S153-V157 WeakPolarHBondContact O-CG2 3.35Å; S153-V157 PolarHBondContact O-N 3.17Å; V157-L159 PolarHBondContact O-N 2.81Å; V157-C160 PolarHBondContact O-N 2.88Å; V157-C161 WeakPolarHBondContact O-CB 3.42Å; V157-C161 PolarHBondContact O-N 2.87Å; V157-C161 PolarHBondContact O-SG 3.39Å; V157-C161 VanDerWaalsContact O-SG 3.36Å; V157-Y427 HydrophobicContact CB-CE1 4.35Å; V157-Y427 HydrophobicContact CG2-CE1 4.01Å; V157-Y427 HydrophobicContact CG2-CE2 3.86Å; V157-Y427 WeakPolarHBondContact CG2-OH 3.28Å; V157-V467 HydrophobicContact CG1-CG2 3.74Å; V157-V470 HydrophobicContact CG2-CG2 3.92Å
158	G	94.8	Very high	95.4	Very high	31 Å²	31	23 Å²	23	32%	0.32	14%	0.139	S	C	.	.	H	α-helix	trans	-60.4	-41.7	-177.8	0	0	0	0	0	113.7	L154 A155 S162	L154-G158 PolarHBondContact O-N 3.1Å; A155-G158 PolarHBondContact O-N 2.98Å; G158-S162 VanDerWaalsContact O-CB 3.22Å; G158-S162 WeakPolarHBondContact O-CB 3.47Å; G158-S162 PolarHBondContact O-N 2.96Å; G158-S162 PolarHBondContact O-OG 2.94Å
159	L	94.3	Very high	95.4	Very high	57 Å²	57	24.2 Å²	24.2	30%	0.298	15%	0.145	S	C	.	.	H	α-helix	trans	-65.2	-45	175.9	167.6	145.2	0	0	0	111.8	A155 V157 S162 C163 V424 I629	A155-L159 WeakPolarHBondContact O-CB 3.48Å; A155-L159 PolarHBondContact O-N 3.29Å; V157-L159 PolarHBondContact O-N 2.81Å; L159-S162 PolarHBondContact O-N 3Å; L159-C163 PolarHBondContact O-N 3Å; L159-C163 VanDerWaalsContact O-N 3.12Å; L159-V424 HydrophobicContact CD2-CG1 4.15Å; L159-I629 HydrophobicContact CD2-CD1 3.44Å; L159-I629 VanDerWaalsContact CD2-CD1 3.44Å; L159-I629 HydrophobicContact CD2-CG1 3.79Å; L159-I629 HydrophobicContact CG-CD1 4.11Å; L159-I629 HydrophobicContact CG-CG1 4.39Å
160	C	94.5	Very high	95.4	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-69	-42.7	178.7	-65.4	0	0	0	0	112.2	I156 V157 S162 C163 T164 Y427 F428 V431	I156-C160 WeakPolarHBondContact O-CB 3.36Å; I156-C160 PolarHBondContact O-N 3.39Å; I156-C160 VanDerWaalsContact O-N 3.07Å; I156-C160 PolarHBondContact O-SG 2.92Å; V157-C160 PolarHBondContact O-N 2.88Å; C160-S162 VanDerWaalsContact C-N 3.35Å; C160-S162 PolarHBondContact O-N 3.39Å; C160-C163 VanDerWaalsContact O-CB 3.25Å; C160-C163 WeakPolarHBondContact O-CB 3.21Å; C160-C163 PolarHBondContact O-N 2.79Å; C160-T164 PolarHBondContact O-N 3.12Å; C160-T164 PolarHBondContact O-OG1 3.2Å; C160-Y427 HydrophobicContact CB-CD1 3.95Å; C160-Y427 HydrophobicContact CB-CE1 3.87Å; C160-F428 HydrophobicContact CB-CD2 4.31Å; C160-V431 HydrophobicContact CB-CG1 4.2Å; C160-V431 HydrophobicContact CB-CG2 3.84Å
161	C	95.1	Very high	95.3	Very high	11 Å²	11	24 Å²	24	7%	0.074	14%	0.144	C	C	.	.	H	α-helix	trans	-66.1	-35.3	176.4	-72.3	0	0	0	0	112.6	V157 T164 M165 S463	V157-C161 WeakPolarHBondContact O-CB 3.42Å; V157-C161 PolarHBondContact O-N 2.87Å; V157-C161 PolarHBondContact O-SG 3.39Å; V157-C161 VanDerWaalsContact O-SG 3.36Å; C161-T164 PolarHBondContact O-N 2.76Å; C161-T164 PolarHBondContact O-OG1 3.09Å; C161-M165 VanDerWaalsContact O-CB 3.25Å; C161-M165 WeakPolarHBondContact O-CB 3.42Å; C161-M165 PolarHBondContact O-N 2.88Å; C161-S463 WeakPolarHBondContact CB-OG 3.26Å; C161-S463 PolarHBondContact SG-OG 2.9Å
162	S	95.4	Very high	95.2	Very high	58 Å²	58	20 Å²	20	41%	0.406	12%	0.123	S	C	.	.	H	α-helix	trans	-66.5	-40	174.5	-69.2	0	0	0	0	112	G158 L159 C160 T164 L166	G158-S162 VanDerWaalsContact O-CB 3.22Å; G158-S162 WeakPolarHBondContact O-CB 3.47Å; G158-S162 PolarHBondContact O-N 2.96Å; G158-S162 PolarHBondContact O-OG 2.94Å; L159-S162 PolarHBondContact O-N 3Å; C160-S162 VanDerWaalsContact C-N 3.35Å; C160-S162 PolarHBondContact O-N 3.39Å; S162-T164 VanDerWaalsContact C-N 3.35Å; S162-T164 PolarHBondContact O-N 3.47Å; S162-L166 WeakPolarHBondContact O-CB 3.3Å; S162-L166 WeakPolarHBondContact O-CD1 3.31Å; S162-L166 VanDerWaalsContact O-CG 3.25Å; S162-L166 WeakPolarHBondContact O-CG 3.27Å; S162-L166 PolarHBondContact O-N 2.82Å
163	C	95.4	Very high	95.2	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	11%	0.111	C	C	.	.	H	α-helix	trans	-53.7	-49.8	173.2	-170.6	0	0	0	0	112.2	L159 C160 T167 F428 L625 C626 I629	L159-C163 PolarHBondContact O-N 3Å; L159-C163 VanDerWaalsContact O-N 3.12Å; C160-C163 VanDerWaalsContact O-CB 3.25Å; C160-C163 WeakPolarHBondContact O-CB 3.21Å; C160-C163 PolarHBondContact O-N 2.79Å; C163-T167 PolarHBondContact O-N 2.7Å; C163-T167 PolarHBondContact O-OG1 3.39Å; C163-F428 HydrophobicContact CB-CE2 4.41Å; C163-L625 HydrophobicContact CB-CD2 3.47Å; C163-L625 VanDerWaalsContact CB-CD2 3.47Å; C163-C626 PolarHBondContact SG-SG 3.13Å; C163-I629 HydrophobicContact CB-CD1 4.19Å
164	T	95.1	Very high	95	Very high	1 Å²	1	17.4 Å²	17.4	1%	0.006	11%	0.111	C	C	.	.	H	α-helix	trans	-79.3	-33	-174.6	57.5	0	0	0	0	112.5	C160 C161 S162 T167 A168 V431 Y589	C160-T164 PolarHBondContact O-N 3.12Å; C160-T164 PolarHBondContact O-OG1 3.2Å; C161-T164 PolarHBondContact O-N 2.76Å; C161-T164 PolarHBondContact O-OG1 3.09Å; S162-T164 VanDerWaalsContact C-N 3.35Å; S162-T164 PolarHBondContact O-N 3.47Å; T164-T167 PolarHBondContact O-N 2.9Å; T164-A168 WeakPolarHBondContact O-CB 3.23Å; T164-A168 PolarHBondContact O-N 3.2Å; T164-V431 HydrophobicContact CG2-CB 3.98Å; T164-V431 HydrophobicContact CG2-CG2 3.64Å; T164-V431 WeakPolarHBondContact CG2-O 3.36Å; T164-Y589 HydrophobicContact CG2-CE2 4.05Å
165	M	95.9	Very high	94.8	Very high	52 Å²	52	15 Å²	15	26%	0.256	10%	0.098	S	C	.	.	H	α-helix	trans	-61.7	-46.8	172	-175.7	60.4	75	0	0	112.2	C161 T167 A168 I169 I456 I459	C161-M165 VanDerWaalsContact O-CB 3.25Å; C161-M165 WeakPolarHBondContact O-CB 3.42Å; C161-M165 PolarHBondContact O-N 2.88Å; M165-T167 VanDerWaalsContact C-N 3.31Å; M165-T167 PolarHBondContact O-N 3.47Å; M165-A168 PolarHBondContact O-N 3.35Å; M165-I169 WeakPolarHBondContact O-CG1 3.38Å; M165-I169 PolarHBondContact O-N 3.34Å; M165-I456 HydrophobicContact CE-CG2 4.43Å; M165-I456 HydrophobicContact SD-CG2 4.06Å; M165-I459 HydrophobicContact CB-CG2 4.49Å; M165-I459 HydrophobicContact CE-CB 4.12Å; M165-I459 HydrophobicContact CE-CG2 3.74Å
166	L	96.5	Very high	94.6	Very high	21 Å²	21	13.1 Å²	13.1	11%	0.11	8%	0.082	C	C	.	.	H	α-helix	trans	-62.9	-39.6	176.6	-68	163.4	0	0	0	111.5	S162 A168 I169 S170 L618 L621 L625	S162-L166 WeakPolarHBondContact O-CB 3.3Å; S162-L166 WeakPolarHBondContact O-CD1 3.31Å; S162-L166 VanDerWaalsContact O-CG 3.25Å; S162-L166 WeakPolarHBondContact O-CG 3.27Å; S162-L166 PolarHBondContact O-N 2.82Å; L166-A168 VanDerWaalsContact C-N 3.34Å; L166-A168 PolarHBondContact O-N 3.46Å; L166-I169 PolarHBondContact O-N 3.29Å; L166-S170 PolarHBondContact O-N 3.29Å; L166-S170 VanDerWaalsContact O-N 3.09Å; L166-S170 PolarHBondContact O-OG 3.49Å; L166-L618 HydrophobicContact CD2-CB 4.26Å; L166-L618 HydrophobicContact CD2-CD2 4.25Å; L166-L621 HydrophobicContact CD1-CD2 3.38Å; L166-L625 HydrophobicContact CD1-CD1 4.31Å
167	T	96.1	Very high	94.3	Very high	2 Å²	2	13.6 Å²	13.6	1%	0.012	8%	0.084	C	C	.	.	H	α-helix	trans	-66.3	-35.5	175.6	-52	0	0	0	0	111.9	C163 T164 M165 S170 M171 I434 Y589 V592 N593	C163-T167 PolarHBondContact O-N 2.7Å; C163-T167 PolarHBondContact O-OG1 3.39Å; T164-T167 PolarHBondContact O-N 2.9Å; M165-T167 VanDerWaalsContact C-N 3.31Å; M165-T167 PolarHBondContact O-N 3.47Å; T167-S170 WeakPolarHBondContact O-CB 3.35Å; T167-S170 PolarHBondContact O-N 2.8Å; T167-M171 WeakPolarHBondContact O-CB 3.5Å; T167-M171 PolarHBondContact O-N 2.91Å; T167-I434 HydrophobicContact CG2-CD1 3.96Å; T167-Y589 HydrophobicContact CG2-CD1 3.88Å; T167-Y589 HydrophobicContact CG2-CG 3.81Å; T167-V592 HydrophobicContact CG2-CG1 4.45Å; T167-N593 WeakPolarHBondContact CA-OD1 3.42Å; T167-N593 PolarHBondContact OG1-ND2 3.46Å
168	A	95.6	Very high	93.5	Very high	0 Å²	0	15.8 Å²	15.8	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-68.7	-31.8	174.3	0	0	0	0	0	113	T164 M165 L166 M171 S172 T455 I459	T164-A168 WeakPolarHBondContact O-CB 3.23Å; T164-A168 PolarHBondContact O-N 3.2Å; M165-A168 PolarHBondContact O-N 3.35Å; L166-A168 VanDerWaalsContact C-N 3.34Å; L166-A168 PolarHBondContact O-N 3.46Å; A168-M171 PolarHBondContact O-N 3.02Å; A168-S172 VanDerWaalsContact O-CB 3.32Å; A168-S172 WeakPolarHBondContact O-CB 3.5Å; A168-S172 PolarHBondContact O-N 2.96Å; A168-S172 PolarHBondContact O-OG 2.82Å; A168-T455 HydrophobicContact CB-CG2 4.13Å; A168-I459 HydrophobicContact CB-CD1 3.37Å
169	I	95.8	Very high	93	Very high	26 Å²	26	20.2 Å²	20.2	13%	0.133	13%	0.128	C	C	.	.	H	α-helix	trans	-65.3	-44.9	170	-66.5	167	0	0	0	110.3	M165 L166 M171 S172 A173 F611 L618	M165-I169 WeakPolarHBondContact O-CG1 3.38Å; M165-I169 PolarHBondContact O-N 3.34Å; L166-I169 PolarHBondContact O-N 3.29Å; I169-M171 PolarHBondContact O-N 2.95Å; I169-S172 WeakPolarHBondContact O-CB 3.47Å; I169-S172 PolarHBondContact O-N 3.44Å; I169-A173 PolarHBondContact O-N 3.05Å; I169-F611 HydrophobicContact CG2-CE1 4.31Å; I169-L618 HydrophobicContact CG2-CD1 4.38Å
170	S	95.6	Very high	92.3	Very high	0 Å²	0	18.5 Å²	18.5	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-61.3	-42	174.1	-61	0	0	0	0	112.3	L166 T167 S172 A173 I174 N593 S619	L166-S170 PolarHBondContact O-N 3.29Å; L166-S170 VanDerWaalsContact O-N 3.09Å; L166-S170 PolarHBondContact O-OG 3.49Å; T167-S170 WeakPolarHBondContact O-CB 3.35Å; T167-S170 PolarHBondContact O-N 2.8Å; S170-S172 VanDerWaalsContact C-N 3.35Å; S170-A173 WeakPolarHBondContact O-CB 3.49Å; S170-A173 PolarHBondContact O-N 2.98Å; S170-I174 PolarHBondContact O-N 2.89Å; S170-N593 VanDerWaalsContact CB-OD1 3.24Å; S170-N593 WeakPolarHBondContact CB-OD1 3.18Å; S170-N593 PolarHBondContact OG-OD1 3.47Å; S170-S619 WeakPolarHBondContact OG-CB 3.48Å; S170-S619 PolarHBondContact OG-OG 2.79Å
171	M	93.1	Very high	91.5	Very high	3 Å²	3	19.7 Å²	19.7	2%	0.015	13%	0.127	C	C	.	.	H	α-helix	trans	-68.6	-32.5	176.7	-169.1	-107	-77.8	0	0	112.4	T167 A168 I169 A173 I174 A175 M188 I434 I451 T455	T167-M171 WeakPolarHBondContact O-CB 3.5Å; T167-M171 PolarHBondContact O-N 2.91Å; A168-M171 PolarHBondContact O-N 3.02Å; I169-M171 PolarHBondContact O-N 2.95Å; M171-A173 VanDerWaalsContact C-N 3.32Å; M171-I174 WeakPolarHBondContact O-CB 3.42Å; M171-I174 PolarHBondContact O-N 3.29Å; M171-A175 WeakPolarHBondContact O-CB 3.48Å; M171-A175 PolarHBondContact O-N 3.4Å; M171-M188 HydrophobicContact CG-CE 3.92Å; M171-M188 HydrophobicContact SD-CE 3.99Å; M171-I434 WeakPolarHBondContact CE-O 3.22Å; M171-I451 HydrophobicContact SD-CG2 3.79Å; M171-T455 HydrophobicContact CE-CG2 3.79Å
172	S	93.6	Very high	90.5	Very high	0 Å²	0	20.1 Å²	20.1	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-66.6	-32.6	171.8	-61	0	0	0	0	112.7	A168 I169 S170 T176 P452	A168-S172 VanDerWaalsContact O-CB 3.32Å; A168-S172 WeakPolarHBondContact O-CB 3.5Å; A168-S172 PolarHBondContact O-N 2.96Å; A168-S172 PolarHBondContact O-OG 2.82Å; I169-S172 WeakPolarHBondContact O-CB 3.47Å; I169-S172 PolarHBondContact O-N 3.44Å; S170-S172 VanDerWaalsContact C-N 3.35Å; S172-T176 WeakPolarHBondContact O-CG2 3.24Å; S172-T176 PolarHBondContact O-N 2.88Å; S172-T176 PolarHBondContact O-OG1 3.46Å; S172-P452 WeakPolarHBondContact OG-CA 3.3Å; S172-P452 WeakPolarHBondContact OG-CB 3.35Å
173	A	93.7	Very high	89.4	Confident	0 Å²	0	17.5 Å²	17.5	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-68	-40.8	172.7	0	0	0	0	0	111.7	I169 S170 M171 T176 N177 W607 P609 Y614	I169-A173 PolarHBondContact O-N 3.05Å; S170-A173 WeakPolarHBondContact O-CB 3.49Å; S170-A173 PolarHBondContact O-N 2.98Å; M171-A173 VanDerWaalsContact C-N 3.32Å; A173-T176 PolarHBondContact O-N 3.36Å; A173-T176 PolarHBondContact O-OG1 2.83Å; A173-N177 PolarHBondContact O-N 3.24Å; A173-W607 HydrophobicContact CB-CH2 4.38Å; A173-W607 HydrophobicContact CB-CZ2 4.34Å; A173-P609 HydrophobicContact CB-CB 3.9Å; A173-Y614 HydrophobicContact CB-CD1 4.24Å; A173-Y614 HydrophobicContact CB-CD2 3.33Å; A173-Y614 HydrophobicContact CB-CE2 3.69Å; A173-Y614 HydrophobicContact CB-CG 3.63Å
174	I	93.4	Very high	88.9	Confident	1 Å²	1	17.6 Å²	17.6	1%	0.005	11%	0.114	C	C	.	.	H	α-helix	trans	-60	-52	171.8	-63	172.3	0	0	0	110.2	S170 M171 T176 N177 M188 I189 L193 V592 W607	S170-I174 PolarHBondContact O-N 2.89Å; M171-I174 WeakPolarHBondContact O-CB 3.42Å; M171-I174 PolarHBondContact O-N 3.29Å; I174-T176 PolarHBondContact O-N 3.46Å; I174-N177 WeakPolarHBondContact O-CB 3.49Å; I174-N177 PolarHBondContact O-N 3.16Å; I174-M188 HydrophobicContact CG2-CE 4.23Å; I174-M188 HydrophobicContact CG2-CG 4.05Å; I174-I189 HydrophobicContact CD1-CG1 4.48Å; I174-L193 HydrophobicContact CD1-CD1 3.94Å; I174-L193 HydrophobicContact CD1-CD2 4.19Å; I174-L193 HydrophobicContact CD1-CG 4.2Å; I174-L193 HydrophobicContact CG1-CD2 4.15Å; I174-V592 HydrophobicContact CD1-CG1 3.96Å; I174-W607 HydrophobicContact CG1-CH2 3.85Å; I174-W607 HydrophobicContact CG1-CZ3 4.15Å
175	A	91.6	Very high	88.5	Confident	0 Å²	0	17.8 Å²	17.8	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-64.7	-11	-178.7	0	0	0	0	0	114.9	M171 V180 M188 I451	M171-A175 WeakPolarHBondContact O-CB 3.48Å; M171-A175 PolarHBondContact O-N 3.4Å; A175-V180 WeakPolarHBondContact O-CG2 3.17Å; A175-M188 HydrophobicContact CB-SD 3.76Å; A175-I451 HydrophobicContact CB-CB 4.08Å; A175-I451 HydrophobicContact CB-CD1 4.35Å; A175-I451 HydrophobicContact CB-CG2 3.82Å
176	T	90.9	Very high	88.3	Confident	11 Å²	11	15.7 Å²	15.7	7%	0.067	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.2	6.8	175.2	55.7	0	0	0	0	113.2	S172 A173 I174 Q448 P452 F611	S172-T176 WeakPolarHBondContact O-CG2 3.24Å; S172-T176 PolarHBondContact O-N 2.88Å; S172-T176 PolarHBondContact O-OG1 3.46Å; A173-T176 PolarHBondContact O-N 3.36Å; A173-T176 PolarHBondContact O-OG1 2.83Å; I174-T176 PolarHBondContact O-N 3.46Å; T176-Q448 WeakPolarHBondContact CG2-O 3.46Å; T176-P452 HydrophobicContact CG2-CG 4.12Å; T176-F611 HydrophobicContact CG2-CB 4.3Å; T176-F611 WeakPolarHBondContact OG1-CB 3.13Å; T176-F611 PolarHBondContact OG1-N 3.37Å
177	N	88.6	Confident	87.9	Confident	10 Å²	10	15.1 Å²	15.1	5%	0.053	10%	0.101	C	C	.	.	S	Bend	trans	-96.2	118.8	174.9	-170.5	56.2	0	0	0	110.7	A173 I174 N606 W607 R608	A173-N177 PolarHBondContact O-N 3.24Å; I174-N177 WeakPolarHBondContact O-CB 3.49Å; I174-N177 PolarHBondContact O-N 3.16Å; N177-N606 PolarHBondContact ND2-O 3.46Å; N177-N606 VanDerWaalsContact ND2-O 3.1Å; N177-N606 PolarHBondContact OD1-O 3.44Å; N177-W607 HydrophobicContact CB-CE3 4.24Å; N177-W607 HydrophobicContact CB-CZ3 4.12Å; N177-R608 PolarHBondContact OD1-N 3.47Å
178	G	79.6	Confident	87.5	Confident	47 Å²	47	15 Å²	15	49%	0.485	10%	0.101	S	C	.	.	S	Bend	trans	70.6	-146.9	179.7	0	0	0	0	0	114	Q448	G178-Q448 PolarHBondContact O-NE2 3.37Å
179	V	83	Confident	87.3	Confident	125 Å²	125	15.4 Å²	15.4	76%	0.758	10%	0.103	S	C	*	.	P	Polyproline II helix	trans	-98	140.2	169.9	179.5	0	0	0	0	107.8	P181	V179-P181 WeakPolarHBondContact O-CD 3.47Å
180	V	80.5	Confident	87	Confident	21 Å²	21	14.5 Å²	14.5	13%	0.127	10%	0.099	C	C	.	.	P	Polyproline II helix	trans	-87.6	119	179.8	-179.6	0	0	0	0	108.3	A175 M188 A447 Q448 I451	A175-V180 WeakPolarHBondContact O-CG2 3.17Å; V180-M188 HydrophobicContact CG1-CG 4.28Å; V180-M188 HydrophobicContact CG1-SD 4.4Å; V180-A447 HydrophobicContact CB-CB 4.05Å; V180-A447 HydrophobicContact CG1-CB 4Å; V180-A447 HydrophobicContact CG2-CB 4.33Å; V180-Q448 HydrophobicContact CG2-CG 3.8Å; V180-I451 HydrophobicContact CG1-CD1 4.38Å
181	P	77.4	Confident	86.6	Confident	24 Å²	24	21.7 Å²	21.7	16%	0.156	13%	0.126	C	C	.	.	P	Polyproline II helix	trans	-71.5	150.2	179.3	29.9	-35.2	0	0	0	111.6	V179 R191 S441	V179-P181 WeakPolarHBondContact O-CD 3.47Å; P181-R191 HydrophobicContact CG-CG 4.29Å; P181-S441 WeakPolarHBondContact O-CB 3.44Å; P181-S441 PolarHBondContact O-OG 3Å
182	A	73.6	Confident	86.2	Confident	20 Å²	20	22.7 Å²	22.7	17%	0.165	13%	0.133	C	C	.	.	S	Bend	trans	-67.5	150.5	162.2	0	0	0	0	0	110	H99 A102	H99-A182 WeakPolarHBondContact CB-O 3.21Å; H99-A182 PolarHBondContact CD2-O 3.04Å; A102-A182 HydrophobicContact CB-CB 3.63Å
183	G	73	Confident	85.8	Confident	4 Å²	4	23 Å²	23	4%	0.041	14%	0.135	C	C	.	.	S	Bend	trans	112.6	2.7	-178.1	0	0	0	0	0	115.6	Y187	G183-Y187 WeakPolarHBondContact O-CD2 3.48Å
184	G	84.9	Confident	85.5	Confident	1 Å²	1	23.9 Å²	23.9	1%	0.01	14%	0.143	C	C	.	.			trans	87.9	-162.5	167.2	0	0	0	0	0	116.4	Y186 Y187 M188 S438 S441	G184-Y186 PolarHBondContact O-N 2.71Å; G184-Y187 PolarHBondContact O-N 3.01Å; G184-M188 WeakPolarHBondContact O-CB 3.31Å; G184-M188 PolarHBondContact O-N 3.42Å; G184-S438 CarbonylContact C-O 3.49Å; G184-S438 VanDerWaalsContact CA-O 3.29Å; G184-S438 WeakPolarHBondContact CA-O 3.32Å; G184-S441 WeakPolarHBondContact CA-OG 3.27Å; G184-S441 PolarHBondContact N-OG 3.02Å
185	S	86.4	Confident	85.1	Confident	5 Å²	5	26.6 Å²	26.6	4%	0.035	16%	0.161	C	C	.	.	H	α-helix	trans	-60.4	-38.1	-167.9	56	0	0	0	0	114.4	I189 S438 N439	S185-I189 WeakPolarHBondContact O-CB 3.44Å; S185-I189 WeakPolarHBondContact O-CD1 3.34Å; S185-I189 WeakPolarHBondContact O-CG1 3.48Å; S185-I189 PolarHBondContact O-N 3Å; S185-S438 WeakPolarHBondContact CB-OG 3.48Å; S185-S438 PolarHBondContact N-O 3.14Å; S185-N439 VanDerWaalsContact CB-OD1 3.25Å; S185-N439 WeakPolarHBondContact CB-OD1 3.26Å; S185-N439 PolarHBondContact OG-OD1 2.89Å
186	Y	90.7	Very high	84.9	Confident	9 Å²	9	29 Å²	29	4%	0.035	17%	0.172	C	C	.	.	H	α-helix	trans	-63.4	-53.5	-179.4	169.9	-102.5	0	0	0	112.5	G184 M188 I189 S190 L529 A532 I533 D536	G184-Y186 PolarHBondContact O-N 2.71Å; Y186-M188 VanDerWaalsContact C-N 3.34Å; Y186-M188 PolarHBondContact O-N 3.39Å; Y186-I189 PolarHBondContact O-N 3.04Å; Y186-I189 VanDerWaalsContact O-N 3.1Å; Y186-S190 PolarHBondContact O-N 3.04Å; Y186-S190 PolarHBondContact O-OG 2.88Å; Y186-L529 HydrophobicContact CD2-CD1 4.19Å; Y186-L529 HydrophobicContact CG-CD1 4.05Å; Y186-A532 HydrophobicContact CD1-CB 3.73Å; Y186-A532 HydrophobicContact CE1-CB 4.1Å; Y186-I533 HydrophobicContact CD2-CD1 4.47Å; Y186-I533 HydrophobicContact CD2-CG1 3.87Å; Y186-I533 HydrophobicContact CE1-CG1 4.42Å; Y186-I533 HydrophobicContact CE2-CD1 4.39Å; Y186-I533 HydrophobicContact CE2-CG1 3.48Å; Y186-I533 VanDerWaalsContact CE2-CG1 3.48Å; Y186-I533 HydrophobicContact CG-CG1 4.5Å; Y186-D536 WeakPolarHBondContact CE1-OD2 3.39Å; Y186-D536 VanDerWaalsContact CZ-OD2 3.26Å; Y186-D536 PolarHBondContact OH-OD2 3.3Å
187	Y	88.9	Confident	84.7	Confident	8 Å²	8	29.9 Å²	29.9	3%	0.031	18%	0.175	C	C	.	.	H	α-helix	trans	-66.3	-36.9	-179.4	-71.5	-74.1	0	0	0	112.1	A96 H99 G183 G184 I189 S190 R191 A532 D536	A96-Y187 HydrophobicContact CB-CE2 4.46Å; A96-Y187 WeakPolarHBondContact CB-OH 3.28Å; H99-Y187 HydrophobicContact CB-CD2 4.37Å; H99-Y187 HydrophobicContact CB-CE2 4.1Å; H99-Y187 AromaticContact CD2-CD1 3.32Å; H99-Y187 WeakPolarHBondContact CD2-CD1 3.27Å; H99-Y187 AromaticContact CD2-CD2 3.61Å; H99-Y187 AromaticContact CD2-CE1 3.68Å; H99-Y187 AromaticContact CD2-CE2 3.94Å; H99-Y187 AromaticContact CD2-CG 3.28Å; H99-Y187 AromaticContact CD2-CZ 3.97Å; H99-Y187 AromaticContact NE2-CD1 3.55Å; H99-Y187 AromaticContact NE2-CG 3.88Å; G183-Y187 WeakPolarHBondContact O-CD2 3.48Å; G184-Y187 PolarHBondContact O-N 3.01Å; Y187-I189 VanDerWaalsContact C-N 3.28Å; Y187-I189 PolarHBondContact O-N 3.28Å; Y187-S190 PolarHBondContact O-N 3.47Å; Y187-S190 PolarHBondContact O-OG 3.25Å; Y187-R191 VanDerWaalsContact O-CB 3.31Å; Y187-R191 WeakPolarHBondContact O-CB 3.45Å; Y187-R191 VanDerWaalsContact O-CG 3.23Å; Y187-R191 WeakPolarHBondContact O-CG 3.35Å; Y187-R191 PolarHBondContact O-N 2.89Å; Y187-A532 HydrophobicContact CE2-CB 3.65Å; Y187-D536 WeakPolarHBondContact CE1-OD1 3.49Å
188	M	88.4	Confident	84.7	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-57.5	-41	171.5	-173.4	-172.7	73.3	0	0	111.7	M171 I174 A175 V180 G184 Y186 S192 I451	M171-M188 HydrophobicContact CG-CE 3.92Å; M171-M188 HydrophobicContact SD-CE 3.99Å; I174-M188 HydrophobicContact CG2-CE 4.23Å; I174-M188 HydrophobicContact CG2-CG 4.05Å; A175-M188 HydrophobicContact CB-SD 3.76Å; V180-M188 HydrophobicContact CG1-CG 4.28Å; V180-M188 HydrophobicContact CG1-SD 4.4Å; G184-M188 WeakPolarHBondContact O-CB 3.31Å; G184-M188 PolarHBondContact O-N 3.42Å; Y186-M188 VanDerWaalsContact C-N 3.34Å; Y186-M188 PolarHBondContact O-N 3.39Å; M188-S192 WeakPolarHBondContact O-CB 3.17Å; M188-S192 PolarHBondContact O-N 2.92Å; M188-S192 PolarHBondContact O-OG 3.25Å; M188-I451 HydrophobicContact SD-CD1 4.14Å
189	I	89.9	Confident	85.1	Confident	7 Å²	7	27.1 Å²	27.1	4%	0.036	15%	0.15	C	C	.	.	H	α-helix	trans	-75.6	-46.7	178.6	-67.6	169.3	0	0	0	111.4	I174 S185 Y186 Y187 S192 L193 V201 M435	I174-I189 HydrophobicContact CD1-CG1 4.48Å; S185-I189 WeakPolarHBondContact O-CB 3.44Å; S185-I189 WeakPolarHBondContact O-CD1 3.34Å; S185-I189 WeakPolarHBondContact O-CG1 3.48Å; S185-I189 PolarHBondContact O-N 3Å; Y186-I189 PolarHBondContact O-N 3.04Å; Y186-I189 VanDerWaalsContact O-N 3.1Å; Y187-I189 VanDerWaalsContact C-N 3.28Å; Y187-I189 PolarHBondContact O-N 3.28Å; I189-S192 PolarHBondContact O-N 3.16Å; I189-L193 HydrophobicContact CG2-CD1 3.79Å; I189-L193 HydrophobicContact CG2-CG 4.37Å; I189-L193 WeakPolarHBondContact O-CB 3.3Å; I189-L193 PolarHBondContact O-N 2.92Å; I189-V201 HydrophobicContact CD1-CG1 4.18Å; I189-V201 HydrophobicContact CG2-CB 4.48Å; I189-V201 HydrophobicContact CG2-CG1 4.35Å; I189-M435 HydrophobicContact CD1-CE 4.1Å
190	S	89.3	Confident	85.5	Confident	7 Å²	7	21.3 Å²	21.3	5%	0.049	11%	0.114	C	C	.	.	H	α-helix	trans	-68.3	-37.1	-174.7	71.1	0	0	0	0	113	Y186 Y187 G194	Y186-S190 PolarHBondContact O-N 3.04Å; Y186-S190 PolarHBondContact O-OG 2.88Å; Y187-S190 PolarHBondContact O-N 3.47Å; Y187-S190 PolarHBondContact O-OG 3.25Å; S190-G194 CarbonylContact O-C 3.56Å; S190-G194 VanDerWaalsContact O-CA 3.3Å; S190-G194 WeakPolarHBondContact O-CA 3.38Å; S190-G194 PolarHBondContact O-N 3.38Å
191	R	87.2	Confident	86	Confident	152 Å²	152	20.4 Å²	20.4	57%	0.574	11%	0.109	S	C	*	.	H	α-helix	trans	-74.5	-35.5	177	-60.7	-63.2	-177.7	-154.9	-7.6	112.8	P181 Y187 D536	P181-R191 HydrophobicContact CG-CG 4.29Å; Y187-R191 VanDerWaalsContact O-CB 3.31Å; Y187-R191 WeakPolarHBondContact O-CB 3.45Å; Y187-R191 VanDerWaalsContact O-CG 3.23Å; Y187-R191 WeakPolarHBondContact O-CG 3.35Å; Y187-R191 PolarHBondContact O-N 2.89Å; R191-D536 IonicContact NH2-OD1 2.69Å
192	S	86.1	Confident	86.7	Confident	23 Å²	23	19.4 Å²	19.4	16%	0.161	10%	0.103	C	C	.	.	H	α-helix	trans	-81.3	-39.9	179.1	-60.7	0	0	0	0	113.8	M188 I189	M188-S192 WeakPolarHBondContact O-CB 3.17Å; M188-S192 PolarHBondContact O-N 2.92Å; M188-S192 PolarHBondContact O-OG 3.25Å; I189-S192 PolarHBondContact O-N 3.16Å
193	L	85.4	Confident	87.5	Confident	8 Å²	8	19.8 Å²	19.8	4%	0.042	10%	0.102	C	C	.	.	H	α-helix	trans	-97.9	-16.9	-174.1	-58.1	-175.4	0	0	0	114.3	I174 I189 F197 A595 Q599 W607	I174-L193 HydrophobicContact CD1-CD1 3.94Å; I174-L193 HydrophobicContact CD1-CD2 4.19Å; I174-L193 HydrophobicContact CD1-CG 4.2Å; I174-L193 HydrophobicContact CG1-CD2 4.15Å; I189-L193 HydrophobicContact CG2-CD1 3.79Å; I189-L193 HydrophobicContact CG2-CG 4.37Å; I189-L193 WeakPolarHBondContact O-CB 3.3Å; I189-L193 PolarHBondContact O-N 2.92Å; L193-F197 HydrophobicContact CB-CB 3.94Å; L193-F197 HydrophobicContact CD1-CB 4.34Å; L193-A595 HydrophobicContact CD1-CB 3.75Å; L193-A595 HydrophobicContact CD2-CB 4.22Å; L193-Q599 VanDerWaalsContact CD2-OE1 3.22Å; L193-Q599 PolarHBondContact O-NE2 2.85Å; L193-W607 HydrophobicContact CD2-CE3 4.43Å; L193-W607 HydrophobicContact CD2-CH2 4.24Å; L193-W607 HydrophobicContact CD2-CZ3 3.8Å
194	G	86.2	Confident	88.4	Confident	17 Å²	17	19.9 Å²	19.9	18%	0.175	10%	0.102	C	C	.	.			trans	102	156.8	-170.9	0	0	0	0	0	113	S190 E196 F197 G198	S190-G194 CarbonylContact O-C 3.56Å; S190-G194 VanDerWaalsContact O-CA 3.3Å; S190-G194 WeakPolarHBondContact O-CA 3.38Å; S190-G194 PolarHBondContact O-N 3.38Å; G194-E196 VanDerWaalsContact C-N 3.28Å; G194-E196 PolarHBondContact O-N 3.02Å; G194-F197 PolarHBondContact O-N 3.41Å; G194-G198 PolarHBondContact O-N 2.99Å
195	P	85.3	Confident	88.7	Confident	58 Å²	58	20.8 Å²	20.8	38%	0.377	11%	0.106	S	C	.	.	H	α-helix	trans	-66.8	-25.6	-173.4	27.7	-35.1	0	0	0	113.7	G199 I538	P195-G199 PolarHBondContact O-N 3.4Å; P195-I538 HydrophobicContact CB-CG2 3.97Å
196	E	86.9	Confident	89.1	Confident	50 Å²	50	20.9 Å²	20.9	23%	0.234	11%	0.106	C	C	.	.	H	α-helix	trans	-69.6	-48.1	-179.3	-47.1	76.9	-171.3	0	0	110.7	G194 A200 Y649 I652 E653	G194-E196 VanDerWaalsContact C-N 3.28Å; G194-E196 PolarHBondContact O-N 3.02Å; E196-A200 WeakPolarHBondContact O-CB 3.34Å; E196-A200 PolarHBondContact O-N 3.23Å; E196-Y649 HydrophobicContact CB-CD2 3.95Å; E196-Y649 HydrophobicContact CB-CE2 3.54Å; E196-I652 HydrophobicContact CB-CG2 4.49Å; E196-I652 HydrophobicContact CG-CG2 4.5Å; E196-E653 HydrophobicContact CG-CB 4.14Å; E196-E653 HydrophobicContact CG-CG 4.35Å
197	F	87.4	Confident	89.2	Confident	30 Å²	30	23 Å²	23	13%	0.132	12%	0.117	C	C	.	.	H	α-helix	trans	-70.1	-43.6	173.4	-74.4	-71.4	0	0	0	111.3	L193 G194 G199 A200 V201 A595 Y649	L193-F197 HydrophobicContact CB-CB 3.94Å; L193-F197 HydrophobicContact CD1-CB 4.34Å; G194-F197 PolarHBondContact O-N 3.41Å; F197-G199 PolarHBondContact O-N 2.9Å; F197-A200 PolarHBondContact O-N 3.24Å; F197-V201 VanDerWaalsContact O-CB 3.24Å; F197-V201 WeakPolarHBondContact O-CB 3.32Å; F197-V201 WeakPolarHBondContact O-CG2 3.47Å; F197-V201 PolarHBondContact O-N 3.38Å; F197-A595 HydrophobicContact CD1-CB 3.84Å; F197-A595 HydrophobicContact CD2-CB 4.41Å; F197-A595 HydrophobicContact CE1-CB 3.98Å; F197-A595 HydrophobicContact CG-CB 4.07Å; F197-A595 HydrophobicContact CZ-CB 4.33Å; F197-Y649 HydrophobicContact CD1-CD2 4.48Å; F197-Y649 AromaticContact CD1-CE2 3.97Å; F197-Y649 HydrophobicContact CD1-CE2 3.97Å; F197-Y649 HydrophobicContact CD2-CE2 4.12Å; F197-Y649 AromaticContact CE1-CE2 3.85Å; F197-Y649 HydrophobicContact CE1-CE2 3.85Å; F197-Y649 HydrophobicContact CE2-CE2 4.01Å; F197-Y649 HydrophobicContact CG-CE2 4.1Å; F197-Y649 AromaticContact CZ-CE2 3.87Å; F197-Y649 HydrophobicContact CZ-CE2 3.87Å
198	G	88.4	Confident	89.3	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	12%	0.116	C	C	.	.	H	α-helix	trans	-56.2	-47.7	177.8	0	0	0	0	0	113.2	G194 G202	G194-G198 PolarHBondContact O-N 2.99Å; G198-G202 WeakPolarHBondContact O-CA 3.4Å; G198-G202 PolarHBondContact O-N 3.1Å
199	G	88.9	Confident	89.5	Confident	0 Å²	0	23.6 Å²	23.6	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-68.4	-44.3	179.2	0	0	0	0	0	113.9	P195 F197 G202 L203	P195-G199 PolarHBondContact O-N 3.4Å; F197-G199 PolarHBondContact O-N 2.9Å; G199-G202 PolarHBondContact O-N 3.35Å; G199-L203 WeakPolarHBondContact O-CB 3.42Å; G199-L203 WeakPolarHBondContact O-CG 3.39Å; G199-L203 PolarHBondContact O-N 2.84Å
200	A	89.8	Confident	89.8	Confident	2 Å²	2	23.3 Å²	23.3	2%	0.017	12%	0.12	C	C	.	.	H	α-helix	trans	-64.8	-46.3	177.7	0	0	0	0	0	111.9	E196 F197 C204 I648	E196-A200 WeakPolarHBondContact O-CB 3.34Å; E196-A200 PolarHBondContact O-N 3.23Å; F197-A200 PolarHBondContact O-N 3.24Å; A200-C204 PolarHBondContact O-N 3.47Å; A200-C204 PolarHBondContact O-SG 3.45Å; A200-I648 HydrophobicContact CB-CG2 4.39Å
201	V	91.8	Very high	90	Very high	3 Å²	3	24.1 Å²	24.1	2%	0.018	12%	0.123	C	C	.	.	H	α-helix	trans	-62.9	-45.2	175.5	172.9	0	0	0	0	110.7	I189 F197 L203 C204 F205 F591 V592	I189-V201 HydrophobicContact CD1-CG1 4.18Å; I189-V201 HydrophobicContact CG2-CB 4.48Å; I189-V201 HydrophobicContact CG2-CG1 4.35Å; F197-V201 VanDerWaalsContact O-CB 3.24Å; F197-V201 WeakPolarHBondContact O-CB 3.32Å; F197-V201 WeakPolarHBondContact O-CG2 3.47Å; F197-V201 PolarHBondContact O-N 3.38Å; V201-L203 PolarHBondContact O-N 3.39Å; V201-C204 PolarHBondContact O-N 3.43Å; V201-F205 VanDerWaalsContact O-CB 3.28Å; V201-F205 WeakPolarHBondContact O-CB 3.43Å; V201-F205 PolarHBondContact O-N 3.43Å; V201-F591 HydrophobicContact CG2-CB 3.66Å; V201-V592 HydrophobicContact CG1-CG2 3.9Å; V201-V592 HydrophobicContact CG2-CG2 4.25Å
202	G	91.6	Very high	90.3	Very high	3 Å²	3	17 Å²	17	3%	0.031	10%	0.097	C	C	.	.	H	α-helix	trans	-60.8	-43.1	179.7	0	0	0	0	0	113.4	G198 G199 F205 Y206 I533	G198-G202 WeakPolarHBondContact O-CA 3.4Å; G198-G202 PolarHBondContact O-N 3.1Å; G199-G202 PolarHBondContact O-N 3.35Å; G202-F205 PolarHBondContact O-N 3.48Å; G202-Y206 WeakPolarHBondContact O-CB 3.4Å; G202-Y206 PolarHBondContact O-N 2.91Å; G202-I533 VanDerWaalsContact C-CD1 3.5Å
203	L	91.6	Very high	90.6	Very high	27 Å²	27	16 Å²	16	14%	0.141	9%	0.09	C	C	.	.	H	α-helix	trans	-68.3	-39.2	177.4	-73	170.2	0	0	0	112.5	G199 V201 Y206 L207 I533 L542 I648	G199-L203 WeakPolarHBondContact O-CB 3.42Å; G199-L203 WeakPolarHBondContact O-CG 3.39Å; G199-L203 PolarHBondContact O-N 2.84Å; V201-L203 PolarHBondContact O-N 3.39Å; L203-Y206 PolarHBondContact O-N 2.98Å; L203-L207 WeakPolarHBondContact O-CG 3.39Å; L203-L207 PolarHBondContact O-N 3.24Å; L203-L207 VanDerWaalsContact O-N 3.1Å; L203-I533 HydrophobicContact CD2-CD1 4.34Å; L203-I533 HydrophobicContact CD2-CG2 4.23Å; L203-I533 HydrophobicContact CG-CD1 4.46Å; L203-L542 HydrophobicContact CD2-CD1 3.79Å; L203-I648 HydrophobicContact CD1-CG2 3.8Å
204	C	91.1	Very high	91.1	Very high	7 Å²	7	15.6 Å²	15.6	5%	0.047	9%	0.088	C	C	.	.	H	α-helix	trans	-67.1	-39.7	174.2	-64.7	0	0	0	0	111.9	A200 V201 L207 G208 M587 C588	A200-C204 PolarHBondContact O-N 3.47Å; A200-C204 PolarHBondContact O-SG 3.45Å; V201-C204 PolarHBondContact O-N 3.43Å; C204-L207 PolarHBondContact O-N 3.19Å; C204-G208 PolarHBondContact O-N 3.47Å; C204-M587 HydrophobicContact CB-SD 4.41Å; C204-M587 PolarHBondContact SG-SD 2.61Å; C204-C588 HydrophobicContact CB-CB 4.37Å
205	F	92	Very high	91.5	Very high	20 Å²	20	14.9 Å²	14.9	9%	0.088	8%	0.08	C	C	.	.	H	α-helix	trans	-64.8	-40.3	175	-173.1	-130.4	0	0	0	111.5	V201 G202 G208 T209 M435 L529 F585	V201-F205 VanDerWaalsContact O-CB 3.28Å; V201-F205 WeakPolarHBondContact O-CB 3.43Å; V201-F205 PolarHBondContact O-N 3.43Å; G202-F205 PolarHBondContact O-N 3.48Å; F205-G208 PolarHBondContact O-N 3.12Å; F205-T209 PolarHBondContact O-N 2.91Å; F205-T209 PolarHBondContact O-OG1 3.38Å; F205-M435 HydrophobicContact CD1-SD 4.23Å; F205-M435 HydrophobicContact CD2-SD 3.76Å; F205-M435 HydrophobicContact CE1-CB 4.38Å; F205-M435 HydrophobicContact CE1-SD 4.19Å; F205-M435 HydrophobicContact CE2-CB 4.05Å; F205-M435 HydrophobicContact CE2-CG 4.36Å; F205-M435 HydrophobicContact CE2-SD 3.7Å; F205-M435 HydrophobicContact CG-SD 4.07Å; F205-M435 HydrophobicContact CZ-CB 3.72Å; F205-M435 HydrophobicContact CZ-CG 4.41Å; F205-M435 HydrophobicContact CZ-SD 3.95Å; F205-L529 HydrophobicContact CB-CD2 4.16Å; F205-L529 HydrophobicContact CD1-CD1 4.3Å; F205-L529 HydrophobicContact CD1-CD2 3.36Å; F205-L529 HydrophobicContact CD1-CG 4.48Å; F205-L529 HydrophobicContact CE1-CD2 4.04Å; F205-L529 HydrophobicContact CG-CD2 4.05Å; F205-F585 HydrophobicContact CD2-CD1 4.23Å; F205-F585 AromaticContact CD2-CE1 3.72Å; F205-F585 HydrophobicContact CD2-CE1 3.72Å; F205-F585 AromaticContact CE2-CE1 3.78Å; F205-F585 HydrophobicContact CE2-CE1 3.78Å
206	Y	93.8	Very high	91.9	Very high	7 Å²	7	13 Å²	13	3%	0.027	7%	0.065	C	C	.	.	H	α-helix	trans	-57.7	-51.4	173.4	169.2	-108.9	0	0	0	112.7	G202 L203 G208 T209 T210 A526 L530 T561 I564	G202-Y206 WeakPolarHBondContact O-CB 3.4Å; G202-Y206 PolarHBondContact O-N 2.91Å; L203-Y206 PolarHBondContact O-N 2.98Å; Y206-G208 VanDerWaalsContact C-N 3.33Å; Y206-G208 PolarHBondContact O-N 3.4Å; Y206-T209 PolarHBondContact O-N 3.1Å; Y206-T210 WeakPolarHBondContact O-CB 3.36Å; Y206-T210 PolarHBondContact O-N 2.87Å; Y206-T210 PolarHBondContact O-OG1 3.12Å; Y206-A526 HydrophobicContact CD2-CB 3.84Å; Y206-A526 VanDerWaalsContact CD2-O 3.22Å; Y206-A526 WeakPolarHBondContact CD2-O 3.48Å; Y206-A526 HydrophobicContact CE2-CB 3.86Å; Y206-A526 WeakPolarHBondContact CE2-O 3.27Å; Y206-L530 HydrophobicContact CD2-CB 3.88Å; Y206-L530 HydrophobicContact CE1-CD2 4.15Å; Y206-L530 HydrophobicContact CE2-CB 3.85Å; Y206-L530 HydrophobicContact CE2-CD2 4.05Å; Y206-L530 HydrophobicContact CE2-CG 4.5Å; Y206-L530 HydrophobicContact CG-CB 4.42Å; Y206-T561 WeakPolarHBondContact CE2-OG1 3.42Å; Y206-T561 WeakPolarHBondContact OH-CA 3.36Å; Y206-T561 PolarHBondContact OH-N 3.4Å; Y206-T561 PolarHBondContact OH-OG1 3.29Å; Y206-I564 HydrophobicContact CE1-CD1 4.09Å
207	L	92.6	Very high	92.2	Very high	54 Å²	54	10.6 Å²	10.6	28%	0.283	5%	0.054	S	C	.	.	H	α-helix	trans	-62.3	-42.2	177.8	-68	174.6	0	0	0	111.2	L203 C204 T210 F211 I564 F584	L203-L207 WeakPolarHBondContact O-CG 3.39Å; L203-L207 PolarHBondContact O-N 3.24Å; L203-L207 VanDerWaalsContact O-N 3.1Å; C204-L207 PolarHBondContact O-N 3.19Å; L207-T210 PolarHBondContact O-N 3.25Å; L207-F211 WeakPolarHBondContact O-CD2 3.42Å; L207-F211 PolarHBondContact O-N 2.8Å; L207-I564 HydrophobicContact CD2-CD1 4.36Å; L207-F584 HydrophobicContact CB-CD1 3.9Å; L207-F584 HydrophobicContact CB-CD2 4.34Å; L207-F584 HydrophobicContact CB-CE1 3.96Å; L207-F584 HydrophobicContact CB-CE2 4.38Å; L207-F584 HydrophobicContact CB-CG 4.1Å; L207-F584 HydrophobicContact CB-CZ 4.21Å; L207-F584 HydrophobicContact CD1-CD1 4.21Å; L207-F584 HydrophobicContact CD1-CE1 3.66Å; L207-F584 HydrophobicContact CD1-CZ 4.16Å; L207-F584 HydrophobicContact CG-CE1 4.46Å
208	G	92.4	Very high	92.6	Very high	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.049	C	C	.	.	H	α-helix	trans	-55.5	-59.8	173.2	0	0	0	0	0	112.5	C204 F205 Y206 T210 F211 A212 L581	C204-G208 PolarHBondContact O-N 3.47Å; F205-G208 PolarHBondContact O-N 3.12Å; Y206-G208 VanDerWaalsContact C-N 3.33Å; Y206-G208 PolarHBondContact O-N 3.4Å; G208-T210 PolarHBondContact O-N 2.95Å; G208-T210 VanDerWaalsContact O-N 3.16Å; G208-F211 PolarHBondContact O-N 2.73Å; G208-A212 PolarHBondContact O-N 3.06Å; G208-L581 WeakPolarHBondContact O-CD1 3.04Å
209	T	92.8	Very high	92.8	Very high	20 Å²	20	9.3 Å²	9.3	12%	0.123	5%	0.049	C	C	.	.	H	α-helix	trans	-58.5	-32.3	179.4	-56.7	0	0	0	0	112.6	F205 Y206 A212 G213 S522 A526	F205-T209 PolarHBondContact O-N 2.91Å; F205-T209 PolarHBondContact O-OG1 3.38Å; Y206-T209 PolarHBondContact O-N 3.1Å; T209-A212 WeakPolarHBondContact O-CB 3.3Å; T209-A212 PolarHBondContact O-N 3.28Å; T209-G213 PolarHBondContact O-N 2.87Å; T209-G213 VanDerWaalsContact O-N 3.09Å; T209-S522 WeakPolarHBondContact O-CB 3.37Å; T209-A526 HydrophobicContact CG2-CB 3.95Å
210	T	94.8	Very high	93	Very high	1 Å²	1	9.4 Å²	9.4	1%	0.006	5%	0.05	C	C	.	.	H	α-helix	trans	-68.4	-47.8	176.7	-52.6	0	0	0	0	112.1	Y206 L207 G208 A212 G213 A214 T561 I564 C565	Y206-T210 WeakPolarHBondContact O-CB 3.36Å; Y206-T210 PolarHBondContact O-N 2.87Å; Y206-T210 PolarHBondContact O-OG1 3.12Å; L207-T210 PolarHBondContact O-N 3.25Å; G208-T210 PolarHBondContact O-N 2.95Å; G208-T210 VanDerWaalsContact O-N 3.16Å; T210-A212 VanDerWaalsContact C-N 3.28Å; T210-A212 PolarHBondContact O-N 3.42Å; T210-G213 PolarHBondContact O-N 3.45Å; T210-G213 VanDerWaalsContact O-N 3.13Å; T210-A214 PolarHBondContact O-N 3.46Å; T210-T561 HydrophobicContact CG2-CG2 3.74Å; T210-T561 WeakPolarHBondContact CG2-O 3.35Å; T210-I564 HydrophobicContact CG2-CB 3.67Å; T210-I564 HydrophobicContact CG2-CG2 3.56Å; T210-C565 PolarHBondContact O-SG 2.93Å
211	F	94.3	Very high	93.3	Very high	24 Å²	24	9.6 Å²	9.6	11%	0.105	5%	0.05	C	C	.	.	H	α-helix	trans	-66.5	-27.8	174	-80.6	-72.7	0	0	0	113	L207 G208 A214 M215 I564 L581 F584	L207-F211 WeakPolarHBondContact O-CD2 3.42Å; L207-F211 PolarHBondContact O-N 2.8Å; G208-F211 PolarHBondContact O-N 2.73Å; F211-A214 PolarHBondContact O-N 3.33Å; F211-M215 PolarHBondContact O-N 2.95Å; F211-I564 HydrophobicContact CE2-CG2 4.17Å; F211-I564 HydrophobicContact CZ-CG2 4.28Å; F211-L581 HydrophobicContact CB-CB 4.45Å; F211-L581 HydrophobicContact CB-CD1 4.04Å; F211-F584 HydrophobicContact CD2-CD2 4.02Å; F211-F584 AromaticContact CD2-CE2 3.65Å; F211-F584 HydrophobicContact CD2-CE2 3.65Å; F211-F584 AromaticContact CE2-CE2 3.69Å; F211-F584 HydrophobicContact CE2-CE2 3.69Å; F211-F584 HydrophobicContact CE2-CZ 4.33Å
212	A	93.1	Very high	93.3	Very high	4 Å²	4	9.8 Å²	9.8	3%	0.033	5%	0.051	C	C	.	.	H	α-helix	trans	-62.4	-41.9	170	0	0	0	0	0	111.7	G208 T209 T210 A214 M215 Y216 L581	G208-A212 PolarHBondContact O-N 3.06Å; T209-A212 WeakPolarHBondContact O-CB 3.3Å; T209-A212 PolarHBondContact O-N 3.28Å; T210-A212 VanDerWaalsContact C-N 3.28Å; T210-A212 PolarHBondContact O-N 3.42Å; A212-A214 PolarHBondContact O-N 2.84Å; A212-M215 WeakPolarHBondContact O-CB 2.94Å; A212-M215 PolarHBondContact O-N 2.94Å; A212-Y216 HydrophobicContact CB-CD2 4.38Å; A212-Y216 HydrophobicContact CB-CE2 3.95Å; A212-Y216 WeakPolarHBondContact O-CD2 3.33Å; A212-Y216 PolarHBondContact O-N 2.8Å; A212-L581 HydrophobicContact CB-CD1 4Å; A212-L581 HydrophobicContact CB-CD2 3.97Å
213	G	93.1	Very high	93.3	Very high	1 Å²	1	9.7 Å²	9.7	1%	0.01	5%	0.049	C	C	.	.	H	α-helix	trans	-54.8	-48.7	173.6	0	0	0	0	0	112.5	T209 T210 Y216 I217	T209-G213 PolarHBondContact O-N 2.87Å; T209-G213 VanDerWaalsContact O-N 3.09Å; T210-G213 PolarHBondContact O-N 3.45Å; T210-G213 VanDerWaalsContact O-N 3.13Å; G213-Y216 PolarHBondContact O-N 3.49Å; G213-I217 WeakPolarHBondContact O-CD1 3.48Å; G213-I217 VanDerWaalsContact O-CG1 3.29Å; G213-I217 WeakPolarHBondContact O-CG1 3.43Å; G213-I217 PolarHBondContact O-N 3.26Å
214	A	94.9	Very high	93.4	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-61.3	-44.1	175.5	0	0	0	0	0	112.6	T210 F211 A212 Y216 I217 L218 C565 I569	T210-A214 PolarHBondContact O-N 3.46Å; F211-A214 PolarHBondContact O-N 3.33Å; A212-A214 PolarHBondContact O-N 2.84Å; A214-Y216 PolarHBondContact O-N 3.32Å; A214-I217 PolarHBondContact O-N 2.94Å; A214-L218 WeakPolarHBondContact O-CG 3.38Å; A214-L218 PolarHBondContact O-N 3.41Å; A214-C565 WeakPolarHBondContact CB-O 3.48Å; A214-I569 HydrophobicContact CB-CG1 4.21Å
215	M	94.1	Very high	93.4	Very high	2 Å²	2	10.9 Å²	10.9	1%	0.01	6%	0.055	C	C	.	.	H	α-helix	trans	-60.4	-44.2	177.8	-178.1	-175.8	173	0	0	112.6	V135 I136 F211 A212 L218 G219 P429 L574 V577 A578 L581	V135-M215 HydrophobicContact CG1-CE 3.87Å; I136-M215 HydrophobicContact CD1-CE 3.47Å; I136-M215 VanDerWaalsContact CD1-CE 3.47Å; I136-M215 HydrophobicContact CG1-CE 3.58Å; F211-M215 PolarHBondContact O-N 2.95Å; A212-M215 WeakPolarHBondContact O-CB 2.94Å; A212-M215 PolarHBondContact O-N 2.94Å; M215-L218 PolarHBondContact O-N 2.56Å; M215-G219 PolarHBondContact O-N 3.28Å; M215-P429 HydrophobicContact CE-CB 4.02Å; M215-P429 HydrophobicContact CE-CG 4.26Å; M215-P429 HydrophobicContact SD-CB 4.02Å; M215-P429 HydrophobicContact SD-CG 4.23Å; M215-L574 HydrophobicContact CE-CD2 4.09Å; M215-L574 HydrophobicContact CG-CG 4.33Å; M215-V577 HydrophobicContact CB-CG1 4.14Å; M215-A578 HydrophobicContact CE-CB 3.93Å; M215-A578 HydrophobicContact SD-CB 4.16Å; M215-L581 HydrophobicContact SD-CD2 3.53Å; M215-L581 VanDerWaalsContact SD-CD2 3.53Å
216	Y	94	Very high	93.2	Very high	17 Å²	17	11.4 Å²	11.4	7%	0.067	6%	0.06	C	C	.	.	H	α-helix	trans	-69.8	-33.8	178.3	-65	-50.4	0	0	0	112.7	V135 A212 G213 A214 G219 T220 A518	V135-Y216 HydrophobicContact CB-CD1 4.35Å; V135-Y216 HydrophobicContact CG1-CD1 4.05Å; V135-Y216 HydrophobicContact CG1-CE1 4.22Å; A212-Y216 HydrophobicContact CB-CD2 4.38Å; A212-Y216 HydrophobicContact CB-CE2 3.95Å; A212-Y216 WeakPolarHBondContact O-CD2 3.33Å; A212-Y216 PolarHBondContact O-N 2.8Å; G213-Y216 PolarHBondContact O-N 3.49Å; A214-Y216 PolarHBondContact O-N 3.32Å; Y216-G219 PolarHBondContact O-N 3.37Å; Y216-T220 PolarHBondContact O-N 2.85Å; Y216-T220 PolarHBondContact O-OG1 2.94Å; Y216-A518 HydrophobicContact CD1-CB 3.96Å; Y216-A518 HydrophobicContact CD2-CB 3.67Å; Y216-A518 HydrophobicContact CE1-CB 4.06Å; Y216-A518 HydrophobicContact CE2-CB 3.76Å; Y216-A518 HydrophobicContact CG-CB 3.78Å
217	I	94.8	Very high	93	Very high	1 Å²	1	12 Å²	12	1%	0.005	6%	0.062	C	C	.	.	H	α-helix	trans	-66.1	-48.5	173.3	-69.4	165.7	0	0	0	110.4	G213 A214 G219 T220 I221 C258 L259 M262 I569	G213-I217 WeakPolarHBondContact O-CD1 3.48Å; G213-I217 VanDerWaalsContact O-CG1 3.29Å; G213-I217 WeakPolarHBondContact O-CG1 3.43Å; G213-I217 PolarHBondContact O-N 3.26Å; A214-I217 PolarHBondContact O-N 2.94Å; I217-G219 VanDerWaalsContact C-N 3.29Å; I217-G219 PolarHBondContact O-N 3.21Å; I217-T220 WeakPolarHBondContact O-CB 3.22Å; I217-T220 PolarHBondContact O-N 3.01Å; I217-T220 VanDerWaalsContact O-N 3.08Å; I217-I221 WeakPolarHBondContact O-CG1 3.43Å; I217-I221 PolarHBondContact O-N 2.94Å; I217-C258 HydrophobicContact CG2-CB 4Å; I217-L259 HydrophobicContact CD1-CB 4.07Å; I217-L259 HydrophobicContact CD1-CD1 3.71Å; I217-L259 HydrophobicContact CD1-CG 4.48Å; I217-M262 HydrophobicContact CD1-SD 3.92Å; I217-M262 HydrophobicContact CG1-CE 4.35Å; I217-M262 HydrophobicContact CG1-SD 3.71Å; I217-I569 HydrophobicContact CB-CD1 4.33Å; I217-I569 HydrophobicContact CD1-CD1 4.29Å; I217-I569 HydrophobicContact CG2-CD1 3.8Å; I217-I569 HydrophobicContact CG2-CG1 4.49Å
218	L	94.6	Very high	93	Very high	2 Å²	2	12.2 Å²	12.2	1%	0.01	6%	0.063	C	C	.	.	H	α-helix	trans	-57.2	-42.7	174.6	-72.1	174.5	0	0	0	111.6	A214 M215 T220 I221 E222 M251 I569 V577	A214-L218 WeakPolarHBondContact O-CG 3.38Å; A214-L218 PolarHBondContact O-N 3.41Å; M215-L218 PolarHBondContact O-N 2.56Å; L218-T220 PolarHBondContact O-N 3.19Å; L218-I221 PolarHBondContact O-N 3.04Å; L218-E222 WeakPolarHBondContact O-CB 3.36Å; L218-E222 PolarHBondContact O-N 3.36Å; L218-M251 HydrophobicContact CD2-CB 4.44Å; L218-I569 HydrophobicContact CD2-CG2 4.42Å; L218-V577 HydrophobicContact CD1-CG2 4.06Å
219	G	93.1	Very high	92.9	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-61	-40	173.6	0	0	0	0	0	113.9	M215 Y216 I217 I221 E222 I223	M215-G219 PolarHBondContact O-N 3.28Å; Y216-G219 PolarHBondContact O-N 3.37Å; I217-G219 VanDerWaalsContact C-N 3.29Å; I217-G219 PolarHBondContact O-N 3.21Å; G219-I221 VanDerWaalsContact C-N 3.33Å; G219-I221 PolarHBondContact O-N 3.47Å; G219-E222 PolarHBondContact O-N 3.1Å; G219-I223 WeakPolarHBondContact O-CD1 3.42Å; G219-I223 VanDerWaalsContact O-CG1 3.27Å; G219-I223 WeakPolarHBondContact O-CG1 3.16Å; G219-I223 PolarHBondContact O-N 2.86Å
220	T	93.5	Very high	92.5	Very high	3 Å²	3	18.3 Å²	18.3	2%	0.018	10%	0.102	C	C	.	.	H	α-helix	trans	-63.3	-39.8	175.6	-56.2	0	0	0	0	111.5	Y216 I217 L218 I223 L224 F512 C515 C516	Y216-T220 PolarHBondContact O-N 2.85Å; Y216-T220 PolarHBondContact O-OG1 2.94Å; I217-T220 WeakPolarHBondContact O-CB 3.22Å; I217-T220 PolarHBondContact O-N 3.01Å; I217-T220 VanDerWaalsContact O-N 3.08Å; L218-T220 PolarHBondContact O-N 3.19Å; T220-I223 PolarHBondContact O-N 3.25Å; T220-L224 WeakPolarHBondContact O-CB 3.43Å; T220-L224 PolarHBondContact O-N 3.21Å; T220-F512 HydrophobicContact CG2-CD2 3.81Å; T220-F512 HydrophobicContact CG2-CE2 3.48Å; T220-F512 VanDerWaalsContact CG2-CE2 3.48Å; T220-F512 HydrophobicContact CG2-CZ 4.09Å; T220-C515 WeakPolarHBondContact OG1-CB 3.24Å; T220-C516 HydrophobicContact CG2-CB 4.37Å; T220-C516 PolarHBondContact OG1-N 3.36Å
221	I	94.6	Very high	92	Very high	5 Å²	5	27.4 Å²	27.4	3%	0.026	14%	0.144	C	C	.	.	H	α-helix	trans	-74.1	-36.3	177.8	-61.2	-47.9	0	0	0	112	I217 L218 G219 I223 L224 L225 M251 C258	I217-I221 WeakPolarHBondContact O-CG1 3.43Å; I217-I221 PolarHBondContact O-N 2.94Å; L218-I221 PolarHBondContact O-N 3.04Å; G219-I221 VanDerWaalsContact C-N 3.33Å; G219-I221 PolarHBondContact O-N 3.47Å; I221-I223 VanDerWaalsContact C-N 3.3Å; I221-I223 PolarHBondContact O-N 2.98Å; I221-L224 HydrophobicContact CD1-CD2 4.18Å; I221-L224 PolarHBondContact O-N 3.47Å; I221-L225 HydrophobicContact CG2-CD1 3.66Å; I221-L225 HydrophobicContact CG2-CG 4.04Å; I221-L225 WeakPolarHBondContact O-CB 3.49Å; I221-L225 PolarHBondContact O-N 3.45Å; I221-M251 HydrophobicContact CB-SD 4.33Å; I221-M251 HydrophobicContact CG2-SD 3.78Å; I221-C258 HydrophobicContact CD1-CB 3.98Å; I221-C258 HydrophobicContact CG1-CB 4.45Å
222	E	91.8	Very high	91.7	Very high	8 Å²	8	28 Å²	28	4%	0.037	15%	0.153	C	C	.	.	H	α-helix	trans	-59.4	-42.5	171.4	-171.2	178.5	141.3	0	0	111	L139 R140 L218 G219 T226 M251	L139-E222 HydrophobicContact CD2-CB 4.31Å; L139-E222 HydrophobicContact CD2-CG 4.24Å; R140-E222 IonicContact CZ-OE1 2.71Å; R140-E222 IonicContact CZ-OE2 3.74Å; R140-E222 IonicContact NH1-OE1 3.29Å; R140-E222 PolarHBondContact NH1-OE1 3.45Å; R140-E222 IonicContact NH1-OE2 3.39Å; R140-E222 IonicContact NH2-OE1 3.95Å; R140-E222 PolarHBondContact NH2-OE1 3.12Å; R140-E222 IonicContact NH2-OE2 2.79Å; R140-E222 PolarHBondContact NH2-OE2 3.1Å; L218-E222 WeakPolarHBondContact O-CB 3.36Å; L218-E222 PolarHBondContact O-N 3.36Å; G219-E222 PolarHBondContact O-N 3.1Å; E222-T226 WeakPolarHBondContact O-CB 3.37Å; E222-T226 PolarHBondContact O-N 2.92Å; E222-T226 PolarHBondContact O-OG1 2.58Å; E222-T226 VanDerWaalsContact O-OG1 3.07Å; E222-M251 HydrophobicContact CB-CE 3.75Å; E222-M251 HydrophobicContact CB-SD 4.44Å; E222-M251 HydrophobicContact CG-CE 3.89Å
223	I	92.8	Very high	91.3	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-64.9	-44.5	175.5	-61.8	160.4	0	0	0	111.3	L139 G219 T220 I221 Y227 I228 V508 F512	L139-I223 HydrophobicContact CD1-CD1 3.85Å; L139-I223 HydrophobicContact CD1-CG1 3.83Å; L139-I223 HydrophobicContact CD2-CD1 4.46Å; L139-I223 HydrophobicContact CD2-CG1 3.98Å; L139-I223 HydrophobicContact CG-CG1 4.41Å; G219-I223 WeakPolarHBondContact O-CD1 3.42Å; G219-I223 VanDerWaalsContact O-CG1 3.27Å; G219-I223 WeakPolarHBondContact O-CG1 3.16Å; G219-I223 PolarHBondContact O-N 2.86Å; T220-I223 PolarHBondContact O-N 3.25Å; I221-I223 VanDerWaalsContact C-N 3.3Å; I221-I223 PolarHBondContact O-N 2.98Å; I223-Y227 HydrophobicContact CG2-CD2 4.47Å; I223-Y227 PolarHBondContact O-N 3.04Å; I223-I228 HydrophobicContact CG2-CD1 4.13Å; I223-I228 HydrophobicContact CG2-CG1 4.35Å; I223-I228 PolarHBondContact O-N 3.44Å; I223-V508 HydrophobicContact CG2-CG1 4.13Å; I223-F512 HydrophobicContact CG2-CB 4.01Å; I223-F512 HydrophobicContact CG2-CD2 4.33Å
224	L	92.9	Very high	91	Very high	47 Å²	47	33.6 Å²	33.6	25%	0.246	19%	0.186	C	C	.	.	I	π-helix	trans	-62.6	-49.4	-178.1	-176.4	65.7	0	0	0	112.6	T220 I221 I228 V229 F512	T220-L224 WeakPolarHBondContact O-CB 3.43Å; T220-L224 PolarHBondContact O-N 3.21Å; I221-L224 HydrophobicContact CD1-CD2 4.18Å; I221-L224 PolarHBondContact O-N 3.47Å; L224-I228 HydrophobicContact CD1-CB 4.35Å; L224-I228 HydrophobicContact CD1-CD1 4.38Å; L224-I228 PolarHBondContact O-N 2.86Å; L224-V229 PolarHBondContact O-N 2.83Å; L224-F512 HydrophobicContact CB-CE2 4.29Å; L224-F512 HydrophobicContact CD1-CE2 4.32Å
225	L	90.9	Very high	90.6	Very high	12 Å²	12	37.9 Å²	37.9	6%	0.063	21%	0.205	C	C	.	.	I	π-helix	trans	-80	-33.7	-174.9	-66.4	179.2	0	0	0	113	I221 P230 N250 M251 Y254	I221-L225 HydrophobicContact CG2-CD1 3.66Å; I221-L225 HydrophobicContact CG2-CG 4.04Å; I221-L225 WeakPolarHBondContact O-CB 3.49Å; I221-L225 PolarHBondContact O-N 3.45Å; L225-P230 WeakPolarHBondContact O-CA 3.41Å; L225-N250 HydrophobicContact CD1-CB 3.88Å; L225-M251 HydrophobicContact CD1-SD 4.42Å; L225-Y254 HydrophobicContact CD1-CD2 4.05Å; L225-Y254 HydrophobicContact CD2-CD2 4Å; L225-Y254 HydrophobicContact CD2-CE2 4Å; L225-Y254 HydrophobicContact CD2-CG 4.49Å
226	T	88.1	Confident	89.9	Confident	31 Å²	31	43.3 Å²	43.3	19%	0.19	24%	0.238	C	C	.	.	I	π-helix	trans	-85.3	-43.1	-178.6	-52.2	0	0	0	0	112	E222 F486	E222-T226 WeakPolarHBondContact O-CB 3.37Å; E222-T226 PolarHBondContact O-N 2.92Å; E222-T226 PolarHBondContact O-OG1 2.58Å; E222-T226 VanDerWaalsContact O-OG1 3.07Å; T226-F486 HydrophobicContact CG2-CB 4.5Å; T226-F486 HydrophobicContact CG2-CD1 4.46Å
227	Y	90.6	Very high	88.9	Confident	19 Å²	19	44.4 Å²	44.4	8%	0.075	25%	0.251	C	S	.	.	I	π-helix	trans	-112.8	-20.4	-166.1	-54.6	-62.2	0	0	0	115.5	I223 F486 G492 L494	I223-Y227 HydrophobicContact CG2-CD2 4.47Å; I223-Y227 PolarHBondContact O-N 3.04Å; Y227-F486 WeakPolarHBondContact CE1-O 3.25Å; Y227-F486 PolarHBondContact OH-O 3.41Å; Y227-G492 VanDerWaalsContact CD1-O 3.29Å; Y227-G492 WeakPolarHBondContact CD1-O 3.3Å; Y227-L494 HydrophobicContact CD1-CB 3.85Å; Y227-L494 HydrophobicContact CD2-CB 4.25Å; Y227-L494 HydrophobicContact CD2-CD1 3.71Å; Y227-L494 HydrophobicContact CD2-CG 4.2Å; Y227-L494 HydrophobicContact CE1-CB 3.66Å; Y227-L494 HydrophobicContact CE1-CG 4.14Å; Y227-L494 HydrophobicContact CE2-CB 4.12Å; Y227-L494 HydrophobicContact CE2-CD1 3.61Å; Y227-L494 HydrophobicContact CE2-CG 3.78Å; Y227-L494 HydrophobicContact CG-CB 4.15Å; Y227-L494 HydrophobicContact CG-CD1 4.33Å
228	I	91.9	Very high	87.4	Confident	60 Å²	60	54 Å²	54	31%	0.308	30%	0.295	S	S	.	.	I	π-helix	trans	-104.4	-55.8	-176.9	-50.7	179.6	0	0	0	111.7	I223 L224 V508 F512	I223-I228 HydrophobicContact CG2-CD1 4.13Å; I223-I228 HydrophobicContact CG2-CG1 4.35Å; I223-I228 PolarHBondContact O-N 3.44Å; L224-I228 HydrophobicContact CD1-CB 4.35Å; L224-I228 HydrophobicContact CD1-CD1 4.38Å; L224-I228 PolarHBondContact O-N 2.86Å; I228-V508 HydrophobicContact CD1-CG1 4.27Å; I228-V508 HydrophobicContact CG1-CG1 3.72Å; I228-F512 HydrophobicContact CD1-CB 4.39Å; I228-F512 HydrophobicContact CD1-CD2 3.92Å; I228-F512 HydrophobicContact CD1-CE2 4.46Å; I228-F512 HydrophobicContact CD1-CG 4.16Å
229	V	90.8	Very high	86.1	Confident	65 Å²	65	61.9 Å²	61.9	39%	0.394	33%	0.325	S	S	.	.			trans	-138.1	72.6	-176.4	-161.6	0	0	0	0	111.7	L224 Q231 A232	L224-V229 PolarHBondContact O-N 2.83Å; V229-Q231 PolarHBondContact O-N 3Å; V229-A232 HydrophobicContact CB-CB 4.19Å; V229-A232 HydrophobicContact CG1-CB 3.84Å; V229-A232 WeakPolarHBondContact O-CB 3.39Å; V229-A232 PolarHBondContact O-N 2.94Å
230	P	84.5	Confident	84.8	Confident	82 Å²	82	64.9 Å²	64.9	53%	0.532	34%	0.338	S	S	.	.	G	3₁₀ helix	trans	-63	-23	177.6	25.5	-34.6	0	0	0	113.8	L225 A232 A233	L225-P230 WeakPolarHBondContact O-CA 3.41Å; P230-A232 PolarHBondContact O-N 2.82Å; P230-A233 PolarHBondContact O-N 2.86Å
231	Q	84.5	Confident	83.6	Confident	192 Å²	192	70 Å²	70	90%	0.897	36%	0.362	S	S	*	.	G	3₁₀ helix	trans	-70.1	-10.1	174.4	-63.1	-178.6	-1.7	0	0	113.9	V229 A233	V229-Q231 PolarHBondContact O-N 3Å; Q231-A233 VanDerWaalsContact C-N 3.32Å
232	A	87	Confident	82.6	Confident	36 Å²	36	73.7 Å²	73.7	30%	0.298	38%	0.382	S	S	.	.	G	3₁₀ helix	trans	-84.3	-0.8	178.5	0	0	0	0	0	113.9	V229 P230 I234 Y254	V229-A232 HydrophobicContact CB-CB 4.19Å; V229-A232 HydrophobicContact CG1-CB 3.84Å; V229-A232 WeakPolarHBondContact O-CB 3.39Å; V229-A232 PolarHBondContact O-N 2.94Å; P230-A232 PolarHBondContact O-N 2.82Å; A232-I234 PolarHBondContact O-N 2.88Å; A232-Y254 PolarHBondContact O-OH 3.09Å
233	A	85.6	Confident	81.8	Confident	31 Å²	31	78.4 Å²	78.4	26%	0.256	40%	0.404	S	S	.	.			trans	-60	121.2	177.7	0	0	0	0	0	111.6	P230 Q231 T236	P230-A233 PolarHBondContact O-N 2.86Å; Q231-A233 VanDerWaalsContact C-N 3.32Å; A233-T236 HydrophobicContact CB-CG2 4.32Å
234	I	86.5	Confident	81	Confident	92 Å²	92	82.3 Å²	82.3	47%	0.472	42%	0.424	S	S	.	.	S	Bend	trans	-74.9	-44.5	-178.6	-63.8	166.6	0	0	0	110.2	A232 N250 I253 Y254	A232-I234 PolarHBondContact O-N 2.88Å; I234-N250 PolarHBondContact N-OD1 3.41Å; I234-I253 HydrophobicContact CD1-CG2 4.02Å; I234-Y254 HydrophobicContact CD1-CD2 4.49Å; I234-Y254 HydrophobicContact CD1-CE2 3.7Å; I234-Y254 HydrophobicContact CG1-CE2 3.94Å
235	F	86.3	Confident	80.6	Confident	90 Å²	90	84.4 Å²	84.4	40%	0.395	44%	0.436	S	S	.	.	S	Bend	trans	-95.6	110.5	171.7	-55.9	-69.1	0	0	0	109.1	A246 N249 N250 I253	F235-A246 HydrophobicContact CB-CB 4.1Å; F235-N249 HydrophobicContact CD2-CB 3.61Å; F235-N249 HydrophobicContact CE2-CB 3.79Å; F235-N249 HydrophobicContact CG-CB 4.43Å; F235-N250 PolarHBondContact N-OD1 3.38Å; F235-N250 PolarHBondContact O-ND2 3.33Å; F235-I253 HydrophobicContact CE2-CD1 3.53Å; F235-I253 HydrophobicContact CE2-CG1 4.47Å; F235-I253 HydrophobicContact CZ-CD1 3.93Å
236	T	79	Confident	80.3	Confident	116 Å²	116	84.5 Å²	84.5	71%	0.712	44%	0.438	S	S	*	.			trans	-104.7	133	167.7	48.5	0	0	0	0	108.9	A233	A233-T236 HydrophobicContact CB-CG2 4.32Å
237	A	72.6	Confident	80.2	Confident	40 Å²	40	85.3 Å²	85.3	33%	0.331	44%	0.441	S	S	.	.			trans	-91.9	128.3	-179.4	0	0	0	0	0	110.6	R239 D242 Q243 A246	A237-R239 VanDerWaalsContact C-N 3.28Å; A237-D242 HydrophobicContact CB-CB 3.99Å; A237-Q243 HydrophobicContact CB-CB 4.3Å; A237-A246 HydrophobicContact CB-CB 4.07Å
238	E	64.8	Low	80.1	Confident	202 Å²	202	86.4 Å²	86.4	94%	0.944	45%	0.448	S	S	*	.	S	Bend	trans	-75.4	-18.9	172.9	-63.5	-174.6	165.5	0	0	112.6
239	R	66.3	Low	80.1	Confident	168 Å²	168	86.3 Å²	86.3	63%	0.634	45%	0.448	S	S	*	.	S	Bend	trans	-122.8	142.5	179.6	-63	-177.8	-178.1	-172.9	1.5	110.8	A237 E241 D242	A237-R239 VanDerWaalsContact C-N 3.28Å; R239-E241 PolarHBondContact O-N 2.93Å; R239-D242 PolarHBondContact O-N 2.79Å; R239-D242 VanDerWaalsContact O-N 3.13Å
240	K	66.5	Low	80.2	Confident	64 Å²	64	83.4 Å²	83.4	28%	0.278	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-62.6	-28.3	179.1	-165.5	168.5	177.9	172.7	0	112.9	D242 Q243 Y408 L409	K240-D242 VanDerWaalsContact C-N 3.32Å; K240-D242 PolarHBondContact O-N 2.95Å; K240-Q243 WeakPolarHBondContact O-CB 3.06Å; K240-Q243 PolarHBondContact O-N 3.26Å; K240-Y408 WeakPolarHBondContact CD-O 3.4Å; K240-L409 PolarHBondContact NZ-O 3.47Å
241	E	66.9	Low	80.5	Confident	111 Å²	111	80 Å²	80	52%	0.519	41%	0.407	S	S	.	.	G	3₁₀ helix	trans	-57	-40.1	172.9	-72.7	169.7	-168.9	0	0	113.1	R239 Y408	R239-E241 PolarHBondContact O-N 2.93Å; E241-Y408 HydrophobicContact CG-CD1 4.02Å; E241-Y408 HydrophobicContact CG-CE1 3.52Å
242	D	74.3	Confident	81	Confident	82 Å²	82	74.9 Å²	74.9	44%	0.439	38%	0.38	S	S	.	.	G	3₁₀ helix	trans	-90.1	-6.4	-175.2	-67.1	-55.1	0	0	0	113.5	A237 R239 K240 L244 N245 A246	A237-D242 HydrophobicContact CB-CB 3.99Å; R239-D242 PolarHBondContact O-N 2.79Å; R239-D242 VanDerWaalsContact O-N 3.13Å; K240-D242 VanDerWaalsContact C-N 3.32Å; K240-D242 PolarHBondContact O-N 2.95Å; D242-L244 PolarHBondContact O-N 3.42Å; D242-N245 PolarHBondContact O-N 3.03Å; D242-N245 VanDerWaalsContact O-N 3.16Å; D242-A246 WeakPolarHBondContact O-CB 3.45Å; D242-A246 PolarHBondContact O-N 2.98Å
243	Q	75.2	Confident	81.4	Confident	106 Å²	106	76.1 Å²	76.1	50%	0.495	38%	0.381	S	S	.	.	H	α-helix	trans	-60.8	-40.3	-172.4	-172.2	176.4	-13.3	0	0	112.9	A237 K240 A246 L247	A237-Q243 HydrophobicContact CB-CB 4.3Å; K240-Q243 WeakPolarHBondContact O-CB 3.06Å; K240-Q243 PolarHBondContact O-N 3.26Å; Q243-A246 PolarHBondContact O-N 3.32Å; Q243-L247 WeakPolarHBondContact O-CB 3.48Å; Q243-L247 PolarHBondContact O-N 3.2Å
244	L	75.8	Confident	81.8	Confident	82 Å²	82	77.2 Å²	77.2	43%	0.429	38%	0.379	S	S	.	.	H	α-helix	trans	-65.6	-43.1	176.4	-179	63.6	0	0	0	111.7	D242 L247 L248	D242-L244 PolarHBondContact O-N 3.42Å; L244-L247 PolarHBondContact O-N 2.8Å; L244-L248 HydrophobicContact CD1-CD1 4.48Å; L244-L248 HydrophobicContact CG-CD1 4.27Å; L244-L248 WeakPolarHBondContact O-CG 3.44Å; L244-L248 PolarHBondContact O-N 2.97Å
245	N	83.6	Confident	82.2	Confident	91 Å²	91	72.8 Å²	72.8	49%	0.487	36%	0.356	S	S	.	.	H	α-helix	trans	-66.4	-40	178.6	-69.7	-39.1	0	0	0	111.7	D242 N249	D242-N245 PolarHBondContact O-N 3.03Å; D242-N245 VanDerWaalsContact O-N 3.16Å; N245-N249 WeakPolarHBondContact O-CB 3.3Å; N245-N249 VanDerWaalsContact O-CG 3.32Å; N245-N249 PolarHBondContact O-N 3.07Å; N245-N249 PolarHBondContact O-ND2 3.37Å
246	A	86.4	Confident	82.7	Confident	14 Å²	14	71 Å²	71	12%	0.116	35%	0.353	C	S	.	.	H	α-helix	trans	-62	-46.4	174.1	0	0	0	0	0	111.6	F235 A237 D242 Q243 N249 N250	F235-A246 HydrophobicContact CB-CB 4.1Å; A237-A246 HydrophobicContact CB-CB 4.07Å; D242-A246 WeakPolarHBondContact O-CB 3.45Å; D242-A246 PolarHBondContact O-N 2.98Å; Q243-A246 PolarHBondContact O-N 3.32Å; A246-N249 PolarHBondContact O-N 3.25Å; A246-N250 PolarHBondContact O-N 3.21Å; A246-N250 PolarHBondContact O-ND2 3Å
247	L	84.8	Confident	83.5	Confident	49 Å²	49	70 Å²	70	26%	0.257	34%	0.342	S	S	.	.	H	α-helix	trans	-58.2	-49.9	176.1	-176.9	64.1	0	0	0	111.7	Q243 L244 N249 N250 M251	Q243-L247 WeakPolarHBondContact O-CB 3.48Å; Q243-L247 PolarHBondContact O-N 3.2Å; L244-L247 PolarHBondContact O-N 2.8Å; L247-N249 VanDerWaalsContact C-N 3.31Å; L247-N249 PolarHBondContact O-N 3.4Å; L247-N250 WeakPolarHBondContact O-CB 3.19Å; L247-N250 PolarHBondContact O-N 2.92Å; L247-N250 VanDerWaalsContact O-N 3.16Å; L247-M251 HydrophobicContact CD1-CE 4.23Å; L247-M251 HydrophobicContact CG-CE 4.36Å; L247-M251 WeakPolarHBondContact O-CG 3.33Å; L247-M251 PolarHBondContact O-N 2.92Å
248	L	88.8	Confident	84.6	Confident	41 Å²	41	69.2 Å²	69.2	22%	0.215	33%	0.334	C	S	.	.	H	α-helix	trans	-61	-37.9	178.7	-68.3	170.6	0	0	0	112.4	L244 M251 R252 A572	L244-L248 HydrophobicContact CD1-CD1 4.48Å; L244-L248 HydrophobicContact CG-CD1 4.27Å; L244-L248 WeakPolarHBondContact O-CG 3.44Å; L244-L248 PolarHBondContact O-N 2.97Å; L248-M251 WeakPolarHBondContact O-CB 3.31Å; L248-M251 PolarHBondContact O-N 2.83Å; L248-R252 WeakPolarHBondContact O-CG 3.47Å; L248-R252 PolarHBondContact O-N 2.98Å; L248-R252 VanDerWaalsContact O-N 3.12Å; L248-A572 HydrophobicContact CB-CB 4.15Å; L248-A572 HydrophobicContact CD2-CB 3.88Å; L248-A572 WeakPolarHBondContact O-CB 3.37Å
249	N	91.9	Very high	86.1	Confident	59 Å²	59	59.9 Å²	59.9	32%	0.316	29%	0.29	S	S	.	.	H	α-helix	trans	-69.6	-34.7	176.1	-72.5	-26.7	0	0	0	112.8	F235 N245 A246 L247 R252 I253	F235-N249 HydrophobicContact CD2-CB 3.61Å; F235-N249 HydrophobicContact CE2-CB 3.79Å; F235-N249 HydrophobicContact CG-CB 4.43Å; N245-N249 WeakPolarHBondContact O-CB 3.3Å; N245-N249 VanDerWaalsContact O-CG 3.32Å; N245-N249 PolarHBondContact O-N 3.07Å; N245-N249 PolarHBondContact O-ND2 3.37Å; A246-N249 PolarHBondContact O-N 3.25Å; L247-N249 VanDerWaalsContact C-N 3.31Å; L247-N249 PolarHBondContact O-N 3.4Å; N249-R252 PolarHBondContact O-N 3.41Å; N249-R252 PolarHBondContact OD1-NH1 3.17Å; N249-I253 PolarHBondContact O-N 3.03Å
250	N	91.9	Very high	87.4	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-63.7	-45	170.5	-69.5	-46.9	0	0	0	111.2	L225 I234 F235 A246 L247 R252 I253 Y254	L225-N250 HydrophobicContact CD1-CB 3.88Å; I234-N250 PolarHBondContact N-OD1 3.41Å; F235-N250 PolarHBondContact N-OD1 3.38Å; F235-N250 PolarHBondContact O-ND2 3.33Å; A246-N250 PolarHBondContact O-N 3.21Å; A246-N250 PolarHBondContact O-ND2 3Å; L247-N250 WeakPolarHBondContact O-CB 3.19Å; L247-N250 PolarHBondContact O-N 2.92Å; L247-N250 VanDerWaalsContact O-N 3.16Å; N250-R252 VanDerWaalsContact C-N 3.28Å; N250-R252 PolarHBondContact O-N 2.85Å; N250-I253 PolarHBondContact O-N 3.18Å; N250-Y254 WeakPolarHBondContact O-CD2 3.26Å; N250-Y254 PolarHBondContact O-N 3.1Å
251	M	91.6	Very high	88.7	Confident	10 Å²	10	57.4 Å²	57.4	5%	0.049	30%	0.297	C	S	.	.	H	α-helix	trans	-55.8	-41.2	176.3	-65.9	-66.7	-164.2	0	0	112.2	L218 I221 E222 L225 L247 L248 G255 A572	L218-M251 HydrophobicContact CD2-CB 4.44Å; I221-M251 HydrophobicContact CB-SD 4.33Å; I221-M251 HydrophobicContact CG2-SD 3.78Å; E222-M251 HydrophobicContact CB-CE 3.75Å; E222-M251 HydrophobicContact CB-SD 4.44Å; E222-M251 HydrophobicContact CG-CE 3.89Å; L225-M251 HydrophobicContact CD1-SD 4.42Å; L247-M251 HydrophobicContact CD1-CE 4.23Å; L247-M251 HydrophobicContact CG-CE 4.36Å; L247-M251 WeakPolarHBondContact O-CG 3.33Å; L247-M251 PolarHBondContact O-N 2.92Å; L248-M251 WeakPolarHBondContact O-CB 3.31Å; L248-M251 PolarHBondContact O-N 2.83Å; M251-G255 WeakPolarHBondContact O-CA 3.4Å; M251-G255 PolarHBondContact O-N 3.35Å; M251-A572 HydrophobicContact CB-CB 4.23Å
252	R	95	Very high	89.9	Confident	85 Å²	85	52.3 Å²	52.3	32%	0.321	27%	0.274	S	S	.	.	H	α-helix	trans	-60.3	-55.7	177.2	-70.3	171.4	174	142	0.8	112	L248 N249 N250 G255 T256 L570 A572	L248-R252 WeakPolarHBondContact O-CG 3.47Å; L248-R252 PolarHBondContact O-N 2.98Å; L248-R252 VanDerWaalsContact O-N 3.12Å; N249-R252 PolarHBondContact O-N 3.41Å; N249-R252 PolarHBondContact OD1-NH1 3.17Å; N250-R252 VanDerWaalsContact C-N 3.28Å; N250-R252 PolarHBondContact O-N 2.85Å; R252-G255 PolarHBondContact O-N 2.8Å; R252-T256 WeakPolarHBondContact O-CB 3.28Å; R252-T256 PolarHBondContact O-N 3.35Å; R252-T256 PolarHBondContact O-OG1 3.32Å; R252-L570 PolarHBondContact NE-O 3.14Å; R252-L570 PolarHBondContact NH2-O 3.09Å; R252-L570 VanDerWaalsContact NH2-O 3.15Å; R252-A572 HydrophobicContact CG-CB 3.75Å
253	I	94.9	Very high	90.8	Very high	61 Å²	61	49.3 Å²	49.3	31%	0.313	26%	0.26	S	S	.	.	H	α-helix	trans	-63	-51.4	-175.7	-65.3	-176.1	0	0	0	110.6	I234 F235 N249 N250 G255 T256 I257	I234-I253 HydrophobicContact CD1-CG2 4.02Å; F235-I253 HydrophobicContact CE2-CD1 3.53Å; F235-I253 HydrophobicContact CE2-CG1 4.47Å; F235-I253 HydrophobicContact CZ-CD1 3.93Å; N249-I253 PolarHBondContact O-N 3.03Å; N250-I253 PolarHBondContact O-N 3.18Å; I253-G255 VanDerWaalsContact C-N 3.32Å; I253-G255 PolarHBondContact O-N 3.04Å; I253-T256 PolarHBondContact O-N 3.23Å; I253-I257 HydrophobicContact CG2-CD1 3.81Å; I253-I257 VanDerWaalsContact O-CG1 3.29Å; I253-I257 WeakPolarHBondContact O-CG1 3.34Å; I253-I257 PolarHBondContact O-N 3.46Å
254	Y	95.1	Very high	91.6	Very high	54 Å²	54	48.5 Å²	48.5	21%	0.212	26%	0.263	C	S	.	.	H	α-helix	trans	-66.2	-34.5	179.8	-80.9	-76.2	0	0	0	112.5	L225 A232 I234 N250 C258	L225-Y254 HydrophobicContact CD1-CD2 4.05Å; L225-Y254 HydrophobicContact CD2-CD2 4Å; L225-Y254 HydrophobicContact CD2-CE2 4Å; L225-Y254 HydrophobicContact CD2-CG 4.49Å; A232-Y254 PolarHBondContact O-OH 3.09Å; I234-Y254 HydrophobicContact CD1-CD2 4.49Å; I234-Y254 HydrophobicContact CD1-CE2 3.7Å; I234-Y254 HydrophobicContact CG1-CE2 3.94Å; N250-Y254 WeakPolarHBondContact O-CD2 3.26Å; N250-Y254 PolarHBondContact O-N 3.1Å; Y254-C258 WeakPolarHBondContact O-CB 3.35Å; Y254-C258 PolarHBondContact O-N 3.12Å
255	G	95	Very high	92.2	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-62.9	-48.8	173.6	0	0	0	0	0	112.4	M251 R252 I253 I257 C258 L259	M251-G255 WeakPolarHBondContact O-CA 3.4Å; M251-G255 PolarHBondContact O-N 3.35Å; R252-G255 PolarHBondContact O-N 2.8Å; I253-G255 VanDerWaalsContact C-N 3.32Å; I253-G255 PolarHBondContact O-N 3.04Å; G255-I257 VanDerWaalsContact C-N 3.35Å; G255-I257 PolarHBondContact O-N 3.23Å; G255-C258 PolarHBondContact O-N 2.83Å; G255-L259 WeakPolarHBondContact O-CB 3.12Å; G255-L259 PolarHBondContact O-N 3.39Å
256	T	96.1	Very high	92.5	Very high	53 Å²	53	43.5 Å²	43.5	33%	0.325	24%	0.238	S	C	.	.	H	α-helix	trans	-59.7	-45.1	177.9	-49.1	0	0	0	0	111	R252 I253 L259 S260 E566	R252-T256 WeakPolarHBondContact O-CB 3.28Å; R252-T256 PolarHBondContact O-N 3.35Å; R252-T256 PolarHBondContact O-OG1 3.32Å; I253-T256 PolarHBondContact O-N 3.23Å; T256-L259 PolarHBondContact O-N 3.04Å; T256-S260 WeakPolarHBondContact O-CB 3.37Å; T256-S260 PolarHBondContact O-N 2.8Å; T256-E566 PolarHBondContact OG1-OE1 2.87Å
257	I	95.9	Very high	92.6	Very high	94 Å²	94	47.8 Å²	47.8	48%	0.482	26%	0.255	S	S	.	.	H	α-helix	trans	-60.8	-47.8	176.1	-68.1	167.2	0	0	0	110.3	I253 G255 S260 L261	I253-I257 HydrophobicContact CG2-CD1 3.81Å; I253-I257 VanDerWaalsContact O-CG1 3.29Å; I253-I257 WeakPolarHBondContact O-CG1 3.34Å; I253-I257 PolarHBondContact O-N 3.46Å; G255-I257 VanDerWaalsContact C-N 3.35Å; G255-I257 PolarHBondContact O-N 3.23Å; I257-S260 PolarHBondContact O-N 3.49Å; I257-S260 PolarHBondContact O-OG 3.06Å; I257-L261 PolarHBondContact O-N 3.24Å
258	C	95	Very high	92.6	Very high	24 Å²	24	50.3 Å²	50.3	16%	0.162	27%	0.272	C	S	.	.	H	α-helix	trans	-62.3	-45	179.6	-170.3	0	0	0	0	112.2	I217 I221 Y254 G255 S260 L261 M262	I217-C258 HydrophobicContact CG2-CB 4Å; I221-C258 HydrophobicContact CD1-CB 3.98Å; I221-C258 HydrophobicContact CG1-CB 4.45Å; Y254-C258 WeakPolarHBondContact O-CB 3.35Å; Y254-C258 PolarHBondContact O-N 3.12Å; G255-C258 PolarHBondContact O-N 2.83Å; C258-S260 PolarHBondContact O-N 3.02Å; C258-L261 PolarHBondContact O-N 3.12Å; C258-M262 WeakPolarHBondContact O-CB 3.5Å; C258-M262 WeakPolarHBondContact O-CG 3.3Å; C258-M262 PolarHBondContact O-N 3.35Å
259	L	96.1	Very high	91.9	Very high	6 Å²	6	48.9 Å²	48.9	3%	0.031	27%	0.267	C	S	.	.	H	α-helix	trans	-59.4	-45.2	174.3	176.8	63.1	0	0	0	111.5	I217 G255 T256 L261 M262 A263 L523 C565 E566 I569	I217-L259 HydrophobicContact CD1-CB 4.07Å; I217-L259 HydrophobicContact CD1-CD1 3.71Å; I217-L259 HydrophobicContact CD1-CG 4.48Å; G255-L259 WeakPolarHBondContact O-CB 3.12Å; G255-L259 PolarHBondContact O-N 3.39Å; T256-L259 PolarHBondContact O-N 3.04Å; L259-L261 VanDerWaalsContact C-N 3.33Å; L259-L261 PolarHBondContact O-N 3.05Å; L259-M262 PolarHBondContact O-N 2.9Å; L259-A263 VanDerWaalsContact O-CB 3.27Å; L259-A263 WeakPolarHBondContact O-CB 3.48Å; L259-A263 PolarHBondContact O-N 3.05Å; L259-L523 HydrophobicContact CD1-CD1 4.27Å; L259-L523 HydrophobicContact CD1-CD2 4.24Å; L259-C565 HydrophobicContact CD1-CB 3.83Å; L259-C565 HydrophobicContact CD2-CB 3.79Å; L259-E566 HydrophobicContact CD2-CB 4.05Å; L259-E566 WeakPolarHBondContact CD2-OE2 3.32Å; L259-I569 HydrophobicContact CB-CD1 3.66Å; L259-I569 HydrophobicContact CD2-CD1 3.8Å; L259-I569 HydrophobicContact CG-CD1 4.24Å
260	S	94.8	Very high	91.2	Very high	68 Å²	68	46.4 Å²	46.4	48%	0.476	25%	0.254	S	S	.	.	H	α-helix	trans	-61.6	-41.4	179	76.7	0	0	0	0	112	T256 I257 C258 A263 V264	T256-S260 WeakPolarHBondContact O-CB 3.37Å; T256-S260 PolarHBondContact O-N 2.8Å; I257-S260 PolarHBondContact O-N 3.49Å; I257-S260 PolarHBondContact O-OG 3.06Å; C258-S260 PolarHBondContact O-N 3.02Å; S260-A263 PolarHBondContact O-N 3.36Å; S260-V264 VanDerWaalsContact O-CG2 3.32Å; S260-V264 WeakPolarHBondContact O-CG2 3.39Å; S260-V264 PolarHBondContact O-N 3.1Å
261	L	93.6	Very high	90.4	Very high	111 Å²	111	53.9 Å²	53.9	58%	0.581	29%	0.286	S	S	*	.	H	α-helix	trans	-67	-46.4	177.1	-171.9	154.4	0	0	0	111.1	I257 C258 L259 A263 V264 V265	I257-L261 PolarHBondContact O-N 3.24Å; C258-L261 PolarHBondContact O-N 3.12Å; L259-L261 VanDerWaalsContact C-N 3.33Å; L259-L261 PolarHBondContact O-N 3.05Å; L261-A263 PolarHBondContact O-N 2.92Å; L261-V264 PolarHBondContact O-N 3.24Å; L261-V265 HydrophobicContact CD2-CG2 4.15Å; L261-V265 WeakPolarHBondContact O-CG2 3.42Å; L261-V265 PolarHBondContact O-N 3.06Å
262	M	92.4	Very high	89.7	Confident	4 Å²	4	61.3 Å²	61.3	2%	0.02	32%	0.315	C	S	.	.	H	α-helix	trans	-60.9	-43	175.9	-73.5	-173.4	175.5	0	0	111.9	I217 C258 L259 V264 V265 V266 C516 L520 L523	I217-M262 HydrophobicContact CD1-SD 3.92Å; I217-M262 HydrophobicContact CG1-CE 4.35Å; I217-M262 HydrophobicContact CG1-SD 3.71Å; C258-M262 WeakPolarHBondContact O-CB 3.5Å; C258-M262 WeakPolarHBondContact O-CG 3.3Å; C258-M262 PolarHBondContact O-N 3.35Å; L259-M262 PolarHBondContact O-N 2.9Å; M262-V264 VanDerWaalsContact C-N 3.34Å; M262-V264 PolarHBondContact O-N 3.24Å; M262-V265 PolarHBondContact O-N 2.98Å; M262-V266 WeakPolarHBondContact O-CG2 3.43Å; M262-V266 PolarHBondContact O-N 2.74Å; M262-C516 HydrophobicContact CE-CB 4.22Å; M262-C516 VanDerWaalsContact CE-SG 3.59Å; M262-L520 HydrophobicContact CB-CD2 3.87Å; M262-L520 HydrophobicContact CE-CG 4.44Å; M262-L520 HydrophobicContact CG-CD2 3.82Å; M262-L520 HydrophobicContact CG-CG 4.23Å; M262-L520 HydrophobicContact SD-CD2 4.39Å; M262-L520 HydrophobicContact SD-CG 4.26Å; M262-L523 HydrophobicContact CB-CD2 3.77Å
263	A	92.2	Very high	88.9	Confident	19 Å²	19	57.4 Å²	57.4	16%	0.157	30%	0.301	C	S	.	.	H	α-helix	trans	-63.4	-38.9	177.7	0	0	0	0	0	112.1	L259 S260 L261 V266 F267 L523	L259-A263 VanDerWaalsContact O-CB 3.27Å; L259-A263 WeakPolarHBondContact O-CB 3.48Å; L259-A263 PolarHBondContact O-N 3.05Å; S260-A263 PolarHBondContact O-N 3.36Å; L261-A263 PolarHBondContact O-N 2.92Å; A263-V266 PolarHBondContact O-N 3.49Å; A263-F267 VanDerWaalsContact O-CB 3.31Å; A263-F267 WeakPolarHBondContact O-CB 3.43Å; A263-F267 PolarHBondContact O-N 2.99Å; A263-L523 HydrophobicContact CB-CD2 4.24Å
264	V	91.8	Very high	87.9	Confident	90 Å²	90	56.1 Å²	56.1	55%	0.545	29%	0.294	S	S	.	.	H	α-helix	trans	-64.7	-44.1	172.9	169.7	0	0	0	0	111.3	S260 L261 M262 V266 F267 V268	S260-V264 VanDerWaalsContact O-CG2 3.32Å; S260-V264 WeakPolarHBondContact O-CG2 3.39Å; S260-V264 PolarHBondContact O-N 3.1Å; L261-V264 PolarHBondContact O-N 3.24Å; M262-V264 VanDerWaalsContact C-N 3.34Å; M262-V264 PolarHBondContact O-N 3.24Å; V264-V266 VanDerWaalsContact C-N 3.33Å; V264-V266 PolarHBondContact O-N 3.41Å; V264-F267 PolarHBondContact O-N 2.78Å; V264-V268 HydrophobicContact CG1-CG2 4.14Å; V264-V268 WeakPolarHBondContact O-CB 3.45Å; V264-V268 VanDerWaalsContact O-CG2 3.29Å; V264-V268 WeakPolarHBondContact O-CG2 3.47Å; V264-V268 PolarHBondContact O-N 2.86Å
265	V	89.9	Confident	87.1	Confident	57 Å²	57	61.2 Å²	61.2	35%	0.345	32%	0.318	S	S	.	.	H	α-helix	trans	-58.2	-45.2	175.7	169.4	0	0	0	0	111.2	L261 M262 V268 G269 V273 L520	L261-V265 HydrophobicContact CD2-CG2 4.15Å; L261-V265 WeakPolarHBondContact O-CG2 3.42Å; L261-V265 PolarHBondContact O-N 3.06Å; M262-V265 PolarHBondContact O-N 2.98Å; V265-V268 PolarHBondContact O-N 2.98Å; V265-G269 PolarHBondContact O-N 2.88Å; V265-V273 HydrophobicContact CG1-CG2 4.1Å; V265-L520 HydrophobicContact CG1-CD2 4.34Å
266	V	89.1	Confident	86.5	Confident	10 Å²	10	65.1 Å²	65.1	6%	0.061	34%	0.338	C	S	.	.	H	α-helix	trans	-64.8	-39.3	176.4	172.5	0	0	0	0	112	M262 A263 V264 V270 L520 L523 T524 L558	M262-V266 WeakPolarHBondContact O-CG2 3.43Å; M262-V266 PolarHBondContact O-N 2.74Å; A263-V266 PolarHBondContact O-N 3.49Å; V264-V266 VanDerWaalsContact C-N 3.33Å; V264-V266 PolarHBondContact O-N 3.41Å; V266-V270 HydrophobicContact CG1-CG2 4.38Å; V266-L520 HydrophobicContact CG2-CD2 4.18Å; V266-L523 HydrophobicContact CG2-CD2 4.26Å; V266-L523 HydrophobicContact CG2-CG 4.36Å; V266-T524 HydrophobicContact CB-CG2 4.21Å; V266-T524 HydrophobicContact CG1-CG2 3.72Å; V266-T524 HydrophobicContact CG2-CG2 3.49Å; V266-T524 VanDerWaalsContact CG2-CG2 3.49Å; V266-L558 HydrophobicContact CB-CD1 4.38Å; V266-L558 HydrophobicContact CB-CD2 4.47Å; V266-L558 HydrophobicContact CG1-CD1 3.74Å; V266-L558 HydrophobicContact CG1-CD2 3.96Å
267	F	88	Confident	85.6	Confident	104 Å²	104	62.6 Å²	62.6	46%	0.456	32%	0.323	S	S	.	.	H	α-helix	trans	-71.9	-32.7	179.3	-178.6	-94.2	0	0	0	113.8	A263 V264 K549 T555 L558	A263-F267 VanDerWaalsContact O-CB 3.31Å; A263-F267 WeakPolarHBondContact O-CB 3.43Å; A263-F267 PolarHBondContact O-N 2.99Å; V264-F267 PolarHBondContact O-N 2.78Å; F267-K549 PolarHBondContact O-NZ 3.5Å; F267-T555 HydrophobicContact CE2-CG2 4.25Å; F267-L558 HydrophobicContact CB-CD2 3.93Å; F267-L558 HydrophobicContact CD2-CD2 4.3Å
268	V	86.3	Confident	84.8	Confident	103 Å²	103	61.1 Å²	61.1	62%	0.624	32%	0.316	S	S	*	.	H	α-helix	trans	-75.3	-36.4	-178.3	168.3	0	0	0	0	111.9	V264 V265	V264-V268 HydrophobicContact CG1-CG2 4.14Å; V264-V268 WeakPolarHBondContact O-CB 3.45Å; V264-V268 VanDerWaalsContact O-CG2 3.29Å; V264-V268 WeakPolarHBondContact O-CG2 3.47Å; V264-V268 PolarHBondContact O-N 2.86Å; V265-V268 PolarHBondContact O-N 2.98Å
269	G	73.7	Confident	84.4	Confident	10 Å²	10	63.6 Å²	63.6	10%	0.103	33%	0.329	C	S	.	.			trans	169.4	119.7	169.1	0	0	0	0	0	114.4	V265 K271 Y272	V265-G269 PolarHBondContact O-N 2.88Å; G269-K271 PolarHBondContact O-N 2.98Å; G269-K271 VanDerWaalsContact O-N 3.11Å; G269-Y272 PolarHBondContact O-N 3.36Å
270	V	76.3	Confident	83.8	Confident	8 Å²	8	63.9 Å²	63.9	5%	0.048	33%	0.331	C	S	.	.	H	α-helix	trans	-63.9	-21.4	-177.1	176.4	0	0	0	0	113.1	L92 V266 Y272 V273 N274 T524 E553	L92-V270 HydrophobicContact CD2-CG1 3.06Å; V266-V270 HydrophobicContact CG1-CG2 4.38Å; V270-Y272 PolarHBondContact O-N 3.08Å; V270-Y272 VanDerWaalsContact O-N 3.16Å; V270-V273 WeakPolarHBondContact O-CB 3.42Å; V270-V273 PolarHBondContact O-N 2.89Å; V270-V273 VanDerWaalsContact O-N 3.08Å; V270-N274 PolarHBondContact O-N 3Å; V270-T524 HydrophobicContact CG1-CG2 4.35Å; V270-T524 HydrophobicContact CG2-CG2 4.27Å; V270-E553 WeakPolarHBondContact CB-OE1 3.37Å; V270-E553 HydrophobicContact CG2-CG 4.33Å; V270-E553 WeakPolarHBondContact CG2-OE1 3.23Å; V270-E553 PolarHBondContact N-OE1 2.84Å
271	K	75.9	Confident	83.3	Confident	161 Å²	161	61.3 Å²	61.3	70%	0.7	31%	0.312	S	S	*	.	H	α-helix	trans	-57.4	-28.8	178.4	-64.7	-177.2	179.8	-179.6	0	114	G269	G269-K271 PolarHBondContact O-N 2.98Å; G269-K271 VanDerWaalsContact O-N 3.11Å
272	Y	76.6	Confident	83.1	Confident	165 Å²	165	58 Å²	58	65%	0.647	30%	0.3	S	S	*	.	H	α-helix	trans	-76	-38.6	176.6	-63.6	-77.7	0	0	0	112	G269 V270 N274 K275 L276	G269-Y272 PolarHBondContact O-N 3.36Å; V270-Y272 PolarHBondContact O-N 3.08Å; V270-Y272 VanDerWaalsContact O-N 3.16Å; Y272-N274 VanDerWaalsContact C-N 3.32Å; Y272-N274 PolarHBondContact O-N 3.39Å; Y272-K275 PolarHBondContact O-N 2.89Å; Y272-L276 PolarHBondContact O-N 3.46Å
273	V	79.2	Confident	82.9	Confident	4 Å²	4	59.2 Å²	59.2	2%	0.024	31%	0.309	C	S	.	.	H	α-helix	trans	-61.4	-42.7	176.4	-171.3	0	0	0	0	110.4	L92 V265 V270 K275 L276 A277 L520	L92-V273 HydrophobicContact CD1-CG1 4.07Å; V265-V273 HydrophobicContact CG1-CG2 4.1Å; V270-V273 WeakPolarHBondContact O-CB 3.42Å; V270-V273 PolarHBondContact O-N 2.89Å; V270-V273 VanDerWaalsContact O-N 3.08Å; V273-K275 VanDerWaalsContact C-N 3.31Å; V273-K275 PolarHBondContact O-N 3.22Å; V273-L276 PolarHBondContact O-N 3.43Å; V273-L276 VanDerWaalsContact O-N 3.13Å; V273-A277 PolarHBondContact O-N 3.07Å; V273-A277 VanDerWaalsContact O-N 3.09Å; V273-L520 HydrophobicContact CG1-CB 4.09Å
274	N	74.2	Confident	82.7	Confident	34 Å²	34	58.5 Å²	58.5	18%	0.182	30%	0.302	C	S	.	.	H	α-helix	trans	-53.4	-43.8	174.2	-81.6	-9.3	0	0	0	112.9	T90 L92 V270 Y272 A277	T90-N274 HydrophobicContact CG2-CB 4.17Å; L92-N274 WeakPolarHBondContact CD1-OD1 3.34Å; V270-N274 PolarHBondContact O-N 3Å; Y272-N274 VanDerWaalsContact C-N 3.32Å; Y272-N274 PolarHBondContact O-N 3.39Å; N274-A277 WeakPolarHBondContact O-CB 3.23Å; N274-A277 PolarHBondContact O-N 2.89Å
275	K	77.1	Confident	82.6	Confident	161 Å²	161	57.3 Å²	57.3	70%	0.7	29%	0.292	S	S	*	.	H	α-helix	trans	-70.3	-31.8	179.7	-69.1	-172.5	175.3	-171.1	0	113.1	Y272 V273 A277	Y272-K275 PolarHBondContact O-N 2.89Å; V273-K275 VanDerWaalsContact C-N 3.31Å; V273-K275 PolarHBondContact O-N 3.22Å; K275-A277 VanDerWaalsContact C-N 3.32Å
276	L	82	Confident	82.7	Confident	81 Å²	81	59.6 Å²	59.6	42%	0.424	30%	0.302	S	S	.	.	H	α-helix	trans	-75.6	-20.3	177	-65.3	173.9	0	0	0	113	Y272 V273 L278 V279 F280	Y272-L276 PolarHBondContact O-N 3.46Å; V273-L276 PolarHBondContact O-N 3.43Å; V273-L276 VanDerWaalsContact O-N 3.13Å; L276-L278 VanDerWaalsContact C-N 3.27Å; L276-L278 PolarHBondContact O-N 2.98Å; L276-V279 WeakPolarHBondContact O-CB 3.33Å; L276-V279 PolarHBondContact O-N 3.08Å; L276-F280 HydrophobicContact CB-CD2 4.33Å; L276-F280 HydrophobicContact CB-CE2 3.67Å; L276-F280 HydrophobicContact CB-CZ 3.84Å; L276-F280 HydrophobicContact CD1-CZ 4.37Å; L276-F280 WeakPolarHBondContact O-CD2 3.31Å; L276-F280 WeakPolarHBondContact O-CG 3.35Å; L276-F280 PolarHBondContact O-N 3.08Å
277	A	77.4	Confident	82.9	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.008	30%	0.3	C	S	.	.	H	α-helix	trans	-50	-42.6	179.9	0	0	0	0	0	114.3	Y89 N91 Q130 V273 N274 K275 L281	Y89-A277 HydrophobicContact CD1-CB 4.04Å; Y89-A277 HydrophobicContact CE1-CB 3.92Å; N91-A277 HydrophobicContact CB-CB 4.05Å; N91-A277 WeakPolarHBondContact OD1-CB 3.43Å; Q130-A277 PolarHBondContact NE2-O 3.29Å; V273-A277 PolarHBondContact O-N 3.07Å; V273-A277 VanDerWaalsContact O-N 3.09Å; N274-A277 WeakPolarHBondContact O-CB 3.23Å; N274-A277 PolarHBondContact O-N 2.89Å; K275-A277 VanDerWaalsContact C-N 3.32Å; A277-L281 PolarHBondContact O-N 3.47Å; A277-L281 VanDerWaalsContact O-N 3.08Å
278	L	79.7	Confident	83.1	Confident	63 Å²	63	55.1 Å²	55.1	33%	0.33	28%	0.282	S	S	.	.	H	α-helix	trans	-69.8	-36.2	179.9	-174.9	149.9	0	0	0	111.8	L86 Y89 L276 L281 A282	L86-L278 HydrophobicContact CB-CD1 3.84Å; L86-L278 HydrophobicContact CD2-CD1 3.79Å; L86-L278 HydrophobicContact CG-CD1 4.42Å; L86-L278 WeakPolarHBondContact O-CD1 3.03Å; Y89-L278 HydrophobicContact CD1-CB 4.16Å; L276-L278 VanDerWaalsContact C-N 3.27Å; L276-L278 PolarHBondContact O-N 2.98Å; L278-L281 PolarHBondContact O-N 3.01Å; L278-A282 WeakPolarHBondContact O-CB 3.4Å; L278-A282 PolarHBondContact O-N 2.93Å
279	V	85.3	Confident	83.5	Confident	75 Å²	75	55 Å²	55	46%	0.455	28%	0.277	S	S	.	.	H	α-helix	trans	-64.4	-47	175.5	-176.5	0	0	0	0	109.9	L276 L281 A282 C283	L276-V279 WeakPolarHBondContact O-CB 3.33Å; L276-V279 PolarHBondContact O-N 3.08Å; V279-L281 VanDerWaalsContact C-N 3.33Å; V279-L281 PolarHBondContact O-N 2.95Å; V279-A282 PolarHBondContact O-N 3.35Å; V279-C283 PolarHBondContact O-N 3.18Å; V279-C283 PolarHBondContact O-SG 3.05Å; V279-C283 VanDerWaalsContact O-SG 3.33Å
280	F	85.2	Confident	84.5	Confident	13 Å²	13	55.1 Å²	55.1	6%	0.057	28%	0.277	C	S	.	.	H	α-helix	trans	-60.1	-41.7	176.6	-57.7	-40.5	0	0	0	112.3	L276 C283 V284 F513 G517 L520	L276-F280 HydrophobicContact CB-CD2 4.33Å; L276-F280 HydrophobicContact CB-CE2 3.67Å; L276-F280 HydrophobicContact CB-CZ 3.84Å; L276-F280 HydrophobicContact CD1-CZ 4.37Å; L276-F280 WeakPolarHBondContact O-CD2 3.31Å; L276-F280 WeakPolarHBondContact O-CG 3.35Å; L276-F280 PolarHBondContact O-N 3.08Å; F280-C283 PolarHBondContact O-N 2.6Å; F280-V284 WeakPolarHBondContact O-CG2 3.45Å; F280-V284 PolarHBondContact O-N 3.16Å; F280-V284 VanDerWaalsContact O-N 3.15Å; F280-F513 HydrophobicContact CD1-CB 4.19Å; F280-F513 WeakPolarHBondContact CD1-O 3.41Å; F280-F513 HydrophobicContact CE1-CD1 4.21Å; F280-G517 VanDerWaalsContact CD2-CA 3.49Å; F280-L520 HydrophobicContact CE2-CD1 4.4Å; F280-L520 HydrophobicContact CZ-CD1 4.3Å
281	L	84.3	Confident	85.3	Confident	14 Å²	14	55.3 Å²	55.3	7%	0.073	28%	0.277	C	S	.	.	H	α-helix	trans	-62.1	-43.9	175.3	178.3	62.1	0	0	0	112	Y89 L126 Q130 A277 L278 V279 V284 I285	Y89-L281 HydrophobicContact CE1-CD2 4.44Å; L126-L281 HydrophobicContact CB-CD2 4.16Å; L126-L281 HydrophobicContact CD1-CD2 4.07Å; L126-L281 HydrophobicContact CD2-CD2 4.27Å; L126-L281 HydrophobicContact CG-CD2 4.4Å; Q130-L281 HydrophobicContact CB-CD1 4.2Å; Q130-L281 HydrophobicContact CG-CD1 4.42Å; A277-L281 PolarHBondContact O-N 3.47Å; A277-L281 VanDerWaalsContact O-N 3.08Å; L278-L281 PolarHBondContact O-N 3.01Å; V279-L281 VanDerWaalsContact C-N 3.33Å; V279-L281 PolarHBondContact O-N 2.95Å; L281-V284 PolarHBondContact O-N 2.96Å; L281-I285 HydrophobicContact CD1-CD1 3.9Å; L281-I285 HydrophobicContact CD1-CG1 4.33Å; L281-I285 HydrophobicContact CG-CD1 3.99Å; L281-I285 WeakPolarHBondContact O-CG1 3.35Å; L281-I285 PolarHBondContact O-N 3.04Å; L281-I285 VanDerWaalsContact O-N 3.09Å
282	A	87.9	Confident	86.2	Confident	42 Å²	42	50.8 Å²	50.8	35%	0.347	26%	0.256	S	S	.	.	H	α-helix	trans	-62.1	-43.1	176.9	0	0	0	0	0	111.9	L278 V279 V284 I285 L286	L278-A282 WeakPolarHBondContact O-CB 3.4Å; L278-A282 PolarHBondContact O-N 2.93Å; V279-A282 PolarHBondContact O-N 3.35Å; A282-V284 VanDerWaalsContact C-N 3.35Å; A282-V284 PolarHBondContact O-N 3.14Å; A282-I285 PolarHBondContact O-N 3.21Å; A282-L286 WeakPolarHBondContact O-CB 3.2Å; A282-L286 VanDerWaalsContact O-CG 3.29Å; A282-L286 WeakPolarHBondContact O-CG 3.44Å; A282-L286 PolarHBondContact O-N 3.18Å
283	C	87.9	Confident	87.1	Confident	29 Å²	29	44.4 Å²	44.4	20%	0.196	24%	0.237	C	C	.	.	H	α-helix	trans	-57.6	-43.6	175	-69.4	0	0	0	0	112.6	V279 F280 S287 F513	V279-C283 PolarHBondContact O-N 3.18Å; V279-C283 PolarHBondContact O-SG 3.05Å; V279-C283 VanDerWaalsContact O-SG 3.33Å; F280-C283 PolarHBondContact O-N 2.6Å; C283-S287 WeakPolarHBondContact O-CB 3.46Å; C283-S287 PolarHBondContact O-N 3.4Å; C283-S287 PolarHBondContact O-OG 3.37Å; C283-F513 HydrophobicContact CB-CB 4.48Å
284	V	88.6	Confident	87.8	Confident	3 Å²	3	44.3 Å²	44.3	2%	0.018	24%	0.238	C	C	.	.	H	α-helix	trans	-63.8	-49.4	177.7	172.1	0	0	0	0	111.3	L133 F280 L281 A282 L286 S287 I288 S514	L133-V284 HydrophobicContact CB-CG1 3.92Å; L133-V284 HydrophobicContact CD1-CG1 3.75Å; L133-V284 HydrophobicContact CG-CG1 4.47Å; F280-V284 WeakPolarHBondContact O-CG2 3.45Å; F280-V284 PolarHBondContact O-N 3.16Å; F280-V284 VanDerWaalsContact O-N 3.15Å; L281-V284 PolarHBondContact O-N 2.96Å; A282-V284 VanDerWaalsContact C-N 3.35Å; A282-V284 PolarHBondContact O-N 3.14Å; V284-L286 PolarHBondContact O-N 2.87Å; V284-S287 WeakPolarHBondContact O-CB 3.33Å; V284-S287 PolarHBondContact O-N 3.26Å; V284-I288 HydrophobicContact CG1-CD1 3.91Å; V284-I288 WeakPolarHBondContact O-CG1 3.47Å; V284-I288 PolarHBondContact O-N 2.96Å; V284-S514 WeakPolarHBondContact CG2-OG 3.46Å
285	I	90.6	Very high	88.7	Confident	66 Å²	66	43 Å²	43	34%	0.338	23%	0.23	S	C	.	.	H	α-helix	trans	-63.7	-44.7	-177.8	-66.6	171.1	0	0	0	110.9	L281 A282 S287 I288 I289	L281-I285 HydrophobicContact CD1-CD1 3.9Å; L281-I285 HydrophobicContact CD1-CG1 4.33Å; L281-I285 HydrophobicContact CG-CD1 3.99Å; L281-I285 WeakPolarHBondContact O-CG1 3.35Å; L281-I285 PolarHBondContact O-N 3.04Å; L281-I285 VanDerWaalsContact O-N 3.09Å; A282-I285 PolarHBondContact O-N 3.21Å; I285-S287 VanDerWaalsContact C-N 3.31Å; I285-S287 PolarHBondContact O-N 3.16Å; I285-I288 PolarHBondContact O-N 3.15Å; I285-I289 HydrophobicContact CG2-CD1 3.8Å; I285-I289 HydrophobicContact CG2-CG1 4.49Å; I285-I289 WeakPolarHBondContact O-CG1 3.41Å; I285-I289 PolarHBondContact O-N 3.36Å
286	L	92.2	Very high	89.5	Confident	104 Å²	104	40.6 Å²	40.6	55%	0.545	22%	0.224	S	C	.	.	H	α-helix	trans	-62.5	-37.6	176.7	-70.8	171.7	0	0	0	112.2	A282 V284 I289 S290	A282-L286 WeakPolarHBondContact O-CB 3.2Å; A282-L286 VanDerWaalsContact O-CG 3.29Å; A282-L286 WeakPolarHBondContact O-CG 3.44Å; A282-L286 PolarHBondContact O-N 3.18Å; V284-L286 PolarHBondContact O-N 2.87Å; L286-I289 PolarHBondContact O-N 3.48Å; L286-S290 WeakPolarHBondContact O-CB 3.23Å; L286-S290 PolarHBondContact O-N 2.73Å; L286-S290 PolarHBondContact O-OG 3.45Å
287	S	92.7	Very high	90.1	Very high	2 Å²	2	40.4 Å²	40.4	1%	0.014	22%	0.22	C	C	.	.	H	α-helix	trans	-63.1	-45.5	175.7	-58.2	0	0	0	0	111.6	C283 V284 I285 S290 I291 I507 G510	C283-S287 WeakPolarHBondContact O-CB 3.46Å; C283-S287 PolarHBondContact O-N 3.4Å; C283-S287 PolarHBondContact O-OG 3.37Å; V284-S287 WeakPolarHBondContact O-CB 3.33Å; V284-S287 PolarHBondContact O-N 3.26Å; I285-S287 VanDerWaalsContact C-N 3.31Å; I285-S287 PolarHBondContact O-N 3.16Å; S287-S290 WeakPolarHBondContact O-CB 3.49Å; S287-S290 PolarHBondContact O-N 2.75Å; S287-I291 WeakPolarHBondContact O-CG1 3.32Å; S287-I291 PolarHBondContact O-N 2.9Å; S287-I507 VanDerWaalsContact O-CD1 3.25Å; S287-I507 WeakPolarHBondContact O-CD1 3.46Å; S287-G510 WeakPolarHBondContact OG-CA 3.47Å
288	I	92.3	Very high	90.8	Very high	18 Å²	18	40.5 Å²	40.5	9%	0.092	22%	0.221	C	C	.	.	H	α-helix	trans	-64.4	-43.6	178.8	-68	169.7	0	0	0	111.1	L133 L137 V284 I285 S290 I291 Y292 I465	L133-I288 HydrophobicContact CD1-CD1 3.76Å; L133-I288 HydrophobicContact CD2-CD1 4.15Å; L137-I288 HydrophobicContact CD2-CD1 4.08Å; L137-I288 HydrophobicContact CD2-CG1 4.15Å; V284-I288 HydrophobicContact CG1-CD1 3.91Å; V284-I288 WeakPolarHBondContact O-CG1 3.47Å; V284-I288 PolarHBondContact O-N 2.96Å; I285-I288 PolarHBondContact O-N 3.15Å; I288-S290 VanDerWaalsContact C-N 3.3Å; I288-S290 PolarHBondContact O-N 3.38Å; I288-I291 PolarHBondContact O-N 3.41Å; I288-Y292 HydrophobicContact CG2-CD2 3.85Å; I288-Y292 HydrophobicContact CG2-CE2 3.57Å; I288-Y292 VanDerWaalsContact O-CD2 3.26Å; I288-Y292 WeakPolarHBondContact O-CD2 3.33Å; I288-Y292 PolarHBondContact O-N 2.78Å; I288-Y292 VanDerWaalsContact O-N 3.14Å; I288-I465 HydrophobicContact CD1-CD1 4.47Å
289	I	94.3	Very high	91.3	Very high	100 Å²	100	38.7 Å²	38.7	51%	0.513	22%	0.217	S	C	.	.	H	α-helix	trans	-60.7	-41	175.1	-67.4	168.1	0	0	0	111	I285 L286 I291 Y292 A293	I285-I289 HydrophobicContact CG2-CD1 3.8Å; I285-I289 HydrophobicContact CG2-CG1 4.49Å; I285-I289 WeakPolarHBondContact O-CG1 3.41Å; I285-I289 PolarHBondContact O-N 3.36Å; L286-I289 PolarHBondContact O-N 3.48Å; I289-I291 VanDerWaalsContact C-N 3.32Å; I289-I291 PolarHBondContact O-N 3.13Å; I289-Y292 PolarHBondContact O-N 3.09Å; I289-A293 WeakPolarHBondContact O-CB 3.4Å; I289-A293 PolarHBondContact O-N 2.97Å
290	S	94.6	Very high	91.6	Very high	14 Å²	14	43.9 Å²	43.9	10%	0.098	23%	0.234	C	C	.	.	H	α-helix	trans	-64.8	-33.4	178.7	-57.2	0	0	0	0	113	L286 S287 I288 G294 W501	L286-S290 WeakPolarHBondContact O-CB 3.23Å; L286-S290 PolarHBondContact O-N 2.73Å; L286-S290 PolarHBondContact O-OG 3.45Å; S287-S290 WeakPolarHBondContact O-CB 3.49Å; S287-S290 PolarHBondContact O-N 2.75Å; I288-S290 VanDerWaalsContact C-N 3.3Å; I288-S290 PolarHBondContact O-N 3.38Å; S290-G294 PolarHBondContact O-N 3.14Å; S290-W501 WeakPolarHBondContact CA-O 3.37Å; S290-W501 VanDerWaalsContact CB-O 3.26Å; S290-W501 WeakPolarHBondContact CB-O 3.49Å; S290-W501 PolarHBondContact O-N 3.01Å; S290-W501 VanDerWaalsContact O-N 3.08Å
291	I	93.7	Very high	91.9	Very high	12 Å²	12	47.7 Å²	47.7	6%	0.062	26%	0.255	C	S	.	.	H	α-helix	trans	-66.7	-51.6	172.9	-67.8	160	0	0	0	110.4	F138 S287 I288 I289 A293 G294 V295 F473 I496 I507	F138-I291 HydrophobicContact CD1-CD1 4.23Å; F138-I291 HydrophobicContact CE1-CD1 3.96Å; S287-I291 WeakPolarHBondContact O-CG1 3.32Å; S287-I291 PolarHBondContact O-N 2.9Å; I288-I291 PolarHBondContact O-N 3.41Å; I289-I291 VanDerWaalsContact C-N 3.32Å; I289-I291 PolarHBondContact O-N 3.13Å; I291-A293 PolarHBondContact O-N 3.08Å; I291-G294 PolarHBondContact O-N 3.41Å; I291-V295 WeakPolarHBondContact O-CG2 3.16Å; I291-V295 PolarHBondContact O-N 3.41Å; I291-F473 HydrophobicContact CG2-CE1 3.78Å; I291-F473 HydrophobicContact CG2-CZ 4.25Å; I291-I496 HydrophobicContact CD1-CD1 3.73Å; I291-I496 HydrophobicContact CD1-CG1 4.11Å; I291-I496 HydrophobicContact CG1-CD1 4.42Å; I291-I496 HydrophobicContact CG1-CG1 4.29Å; I291-I507 HydrophobicContact CD1-CD1 4.09Å; I291-I507 HydrophobicContact CG1-CD1 3.76Å; I291-I507 HydrophobicContact CG1-CG1 4.39Å
292	Y	95.1	Very high	92.1	Very high	66 Å²	66	49.7 Å²	49.7	26%	0.259	27%	0.269	S	S	.	.	H	α-helix	trans	-63.7	-39	179.2	-74.5	-68.5	0	0	0	112.8	I288 I289 G294 V295 I296 S468 L472	I288-Y292 HydrophobicContact CG2-CD2 3.85Å; I288-Y292 HydrophobicContact CG2-CE2 3.57Å; I288-Y292 VanDerWaalsContact O-CD2 3.26Å; I288-Y292 WeakPolarHBondContact O-CD2 3.33Å; I288-Y292 PolarHBondContact O-N 2.78Å; I288-Y292 VanDerWaalsContact O-N 3.14Å; I289-Y292 PolarHBondContact O-N 3.09Å; Y292-G294 VanDerWaalsContact C-N 3.32Å; Y292-G294 PolarHBondContact O-N 3.49Å; Y292-V295 PolarHBondContact O-N 3.46Å; Y292-I296 VanDerWaalsContact O-CG1 3.32Å; Y292-I296 WeakPolarHBondContact O-CG1 3.27Å; Y292-I296 PolarHBondContact O-N 3.08Å; Y292-S468 PolarHBondContact OH-OG 3.18Å; Y292-L472 HydrophobicContact CD1-CD1 3.97Å; Y292-L472 HydrophobicContact CE1-CD1 3.72Å
293	A	94.6	Very high	92.2	Very high	30 Å²	30	49.2 Å²	49.2	25%	0.248	26%	0.262	C	S	.	.	H	α-helix	trans	-61.4	-41.5	174.3	0	0	0	0	0	111.7	I289 I291 I296 K297 W501	I289-A293 WeakPolarHBondContact O-CB 3.4Å; I289-A293 PolarHBondContact O-N 2.97Å; I291-A293 PolarHBondContact O-N 3.08Å; A293-I296 PolarHBondContact O-N 2.95Å; A293-K297 WeakPolarHBondContact O-CB 3.43Å; A293-K297 PolarHBondContact O-N 2.84Å; A293-W501 HydrophobicContact CB-CB 4.48Å; A293-W501 HydrophobicContact CB-CE3 4Å
294	G	94.1	Very high	92.3	Very high	3 Å²	3	53.7 Å²	53.7	3%	0.031	28%	0.284	C	S	.	.	H	α-helix	trans	-63.7	-45	174.8	0	0	0	0	0	113.8	S290 I291 Y292 I296 K297 S298 L499	S290-G294 PolarHBondContact O-N 3.14Å; I291-G294 PolarHBondContact O-N 3.41Å; Y292-G294 VanDerWaalsContact C-N 3.32Å; Y292-G294 PolarHBondContact O-N 3.49Å; G294-I296 PolarHBondContact O-N 3.21Å; G294-K297 PolarHBondContact O-N 2.82Å; G294-S298 PolarHBondContact O-N 3.16Å; G294-L499 CarbonylContact C-O 3.6Å; G294-L499 WeakPolarHBondContact CA-O 3.46Å
295	V	93.6	Very high	92.4	Very high	5 Å²	5	55.7 Å²	55.7	3%	0.03	29%	0.292	C	S	.	.	H	α-helix	trans	-54.9	-50.7	172.1	168.5	0	0	0	0	111.2	I291 Y292 K297 S298 L472 L499	I291-V295 WeakPolarHBondContact O-CG2 3.16Å; I291-V295 PolarHBondContact O-N 3.41Å; Y292-V295 PolarHBondContact O-N 3.46Å; V295-K297 PolarHBondContact O-N 3.04Å; V295-S298 WeakPolarHBondContact O-CB 3.37Å; V295-S298 PolarHBondContact O-N 2.96Å; V295-S298 PolarHBondContact O-OG 3.32Å; V295-L472 HydrophobicContact CG1-CB 4.28Å; V295-L472 HydrophobicContact CG1-CD1 4.16Å; V295-L472 HydrophobicContact CG1-CD2 3.86Å; V295-L472 HydrophobicContact CG1-CG 4.3Å; V295-L472 HydrophobicContact CG2-CB 4.24Å; V295-L499 HydrophobicContact CG2-CD2 3.78Å; V295-L499 HydrophobicContact CG2-CG 4.21Å
296	I	93.3	Very high	92.4	Very high	111 Å²	111	54.8 Å²	54.8	57%	0.569	29%	0.291	S	S	*	.	H	α-helix	trans	-63.4	-43.9	-179.1	-67	164.9	0	0	0	110.7	Y292 A293 G294 S298 G299	Y292-I296 VanDerWaalsContact O-CG1 3.32Å; Y292-I296 WeakPolarHBondContact O-CG1 3.27Å; Y292-I296 PolarHBondContact O-N 3.08Å; A293-I296 PolarHBondContact O-N 2.95Å; G294-I296 PolarHBondContact O-N 3.21Å; I296-S298 VanDerWaalsContact C-N 3.29Å; I296-S298 PolarHBondContact O-N 3.05Å; I296-G299 PolarHBondContact O-N 2.7Å
297	K	93.9	Very high	92.3	Very high	78 Å²	78	49.9 Å²	49.9	34%	0.339	27%	0.265	S	S	.	.	H	α-helix	trans	-57.9	-42.2	175.1	179.6	179.9	165.5	64.1	0	111.5	A293 G294 V295 G299 F300 D301 W501	A293-K297 WeakPolarHBondContact O-CB 3.43Å; A293-K297 PolarHBondContact O-N 2.84Å; G294-K297 PolarHBondContact O-N 2.82Å; V295-K297 PolarHBondContact O-N 3.04Å; K297-G299 PolarHBondContact O-N 2.79Å; K297-G299 VanDerWaalsContact O-N 3.07Å; K297-F300 PolarHBondContact O-N 3.39Å; K297-D301 IonicContact NZ-OD2 2.56Å; K297-D301 PolarHBondContact NZ-OD2 2.85Å; K297-D301 CarbonylContact O-C 3.58Å; K297-D301 PolarHBondContact O-N 2.84Å; K297-W501 HydrophobicContact CD-CB 4.42Å; K297-W501 HydrophobicContact CD-CG 4.14Å
298	S	92.6	Very high	92.3	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.021	27%	0.265	C	S	.	.	H	α-helix	trans	-62.4	-15.5	-179.7	83.8	0	0	0	0	114.8	G294 V295 I296 F300 G369 L370	G294-S298 PolarHBondContact O-N 3.16Å; V295-S298 WeakPolarHBondContact O-CB 3.37Å; V295-S298 PolarHBondContact O-N 2.96Å; V295-S298 PolarHBondContact O-OG 3.32Å; I296-S298 VanDerWaalsContact C-N 3.29Å; I296-S298 PolarHBondContact O-N 3.05Å; S298-F300 VanDerWaalsContact C-N 3.31Å; S298-G369 WeakPolarHBondContact O-CA 3.42Å; S298-L370 PolarHBondContact O-N 3.13Å
299	G	90.6	Very high	92.2	Very high	24 Å²	24	49 Å²	49	25%	0.247	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-17.9	173	0	0	0	0	0	114.4	I296 K297	I296-G299 PolarHBondContact O-N 2.7Å; K297-G299 PolarHBondContact O-N 2.79Å; K297-G299 VanDerWaalsContact O-N 3.07Å
300	F	91.6	Very high	92	Very high	184 Å²	184	44.3 Å²	44.3	81%	0.807	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-126.2	-31.9	-177.7	-53.9	-76.8	0	0	0	113.4	K297 S298	K297-F300 PolarHBondContact O-N 3.39Å; S298-F300 VanDerWaalsContact C-N 3.31Å
301	D	90.7	Very high	91.7	Very high	94 Å²	94	43.9 Å²	43.9	50%	0.503	24%	0.235	S	C	.	.	S	Bend	trans	-146.6	83.2	-175.6	-176.3	33.2	0	0	0	109.2	K297	K297-D301 IonicContact NZ-OD2 2.56Å; K297-D301 PolarHBondContact NZ-OD2 2.85Å; K297-D301 CarbonylContact O-C 3.58Å; K297-D301 PolarHBondContact O-N 2.84Å
302	P	89.9	Confident	91.5	Very high	56 Å²	56	44.1 Å²	44.1	36%	0.364	24%	0.236	S	C	.	.			trans	-68.6	141.6	-176.5	27.9	-33.9	0	0	0	111.9
303	P	89.9	Confident	91.3	Very high	32 Å²	32	42 Å²	42	21%	0.208	23%	0.227	C	C	.	.			trans	-70.9	141.9	-179.5	30.7	-35.4	0	0	0	111.9	F305 Q365 I367	P303-F305 HydrophobicContact CB-CD2 3.96Å; P303-F305 HydrophobicContact CB-CE2 4Å; P303-F305 HydrophobicContact CG-CD2 4.35Å; P303-F305 PolarHBondContact O-N 2.92Å; P303-Q365 PolarHBondContact O-NE2 2.71Å; P303-I367 HydrophobicContact CG-CB 4.05Å; P303-I367 HydrophobicContact CG-CD1 3.89Å; P303-I367 HydrophobicContact CG-CG2 3.85Å
304	D	89	Confident	91.1	Very high	122 Å²	122	40.5 Å²	40.5	65%	0.652	22%	0.216	S	C	*	.			trans	-85.7	94.7	-175.7	-163.9	17.6	0	0	0	113.4	Q365	D304-Q365 PolarHBondContact OD1-NE2 2.44Å
305	F	90.3	Very high	90.9	Very high	46 Å²	46	40.4 Å²	40.4	20%	0.202	21%	0.214	C	C	.	.			trans	-128.3	90	176.4	-74.7	-78.3	0	0	0	110.3	P303 G366 I367 V490 T498 P504	P303-F305 HydrophobicContact CB-CD2 3.96Å; P303-F305 HydrophobicContact CB-CE2 4Å; P303-F305 HydrophobicContact CG-CD2 4.35Å; P303-F305 PolarHBondContact O-N 2.92Å; F305-G366 WeakPolarHBondContact O-CA 3.48Å; F305-G366 PolarHBondContact O-N 3.47Å; F305-I367 HydrophobicContact CD2-CD1 4.45Å; F305-V490 HydrophobicContact CB-CG1 4.39Å; F305-T498 HydrophobicContact CD1-CG2 3.86Å; F305-T498 HydrophobicContact CD2-CG2 4.24Å; F305-T498 HydrophobicContact CE1-CG2 3.71Å; F305-T498 HydrophobicContact CE2-CG2 4.09Å; F305-T498 VanDerWaalsContact CE2-O 3.29Å; F305-T498 WeakPolarHBondContact CE2-O 3.37Å; F305-T498 HydrophobicContact CG-CG2 4.12Å; F305-T498 HydrophobicContact CZ-CG2 3.83Å; F305-P504 HydrophobicContact CZ-CG 4.14Å
306	P	91.1	Very high	90.6	Very high	47 Å²	47	41.3 Å²	41.3	31%	0.305	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	138.6	-178.3	30.6	-35.4	0	0	0	112.9	L363 I364	P306-L363 HydrophobicContact CB-CD1 3.99Å; P306-L363 HydrophobicContact CB-CD2 3.48Å; P306-L363 VanDerWaalsContact CB-CD2 3.48Å; P306-L363 HydrophobicContact CB-CG 3.75Å; P306-I364 WeakPolarHBondContact CA-O 3.4Å
307	V	91.6	Very high	90.1	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.006	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	134	176.1	175.6	0	0	0	0	109.7	M309 T314 L363 I364 V480 V490	V307-M309 HydrophobicContact CG1-SD 4.05Å; V307-T314 HydrophobicContact CG1-CG2 3.82Å; V307-L363 WeakPolarHBondContact O-CA 3.37Å; V307-I364 HydrophobicContact CB-CG1 3.99Å; V307-I364 HydrophobicContact CG1-CG1 4.45Å; V307-I364 PolarHBondContact N-O 3.49Å; V307-I364 PolarHBondContact O-N 2.96Å; V307-V480 HydrophobicContact CG1-CG2 4.46Å; V307-V490 HydrophobicContact CG2-CG1 4.06Å
308	C	92.2	Very high	89.3	Confident	2 Å²	2	38 Å²	38	1%	0.014	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	126.6	-179.7	-170.9	0	0	0	0	111.1	L315 F320 C323	C308-L315 HydrophobicContact CB-CB 4.48Å; C308-L315 PolarHBondContact O-N 3.37Å; C308-F320 HydrophobicContact CB-CE2 4.03Å; C308-F320 HydrophobicContact CB-CZ 3.85Å; C308-C323 VanDerWaalsContact CA-SG 3.51Å; C308-C323 HydrophobicContact CB-CB 3.79Å; C308-C323 WeakPolarHBondContact CB-SG 3.37Å; C308-C323 WeakPolarHBondContact SG-CB 3.37Å; C308-C323 CovalentContact SG-SG 2.03Å; C308-C323 PolarHBondContact SG-SG 3.08Å
309	M	90.3	Very high	88.4	Confident	0 Å²	0	43.2 Å²	43.2	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	138.5	-177.5	-58.8	-64.5	-64.2	0	0	110.2	V307 N312 R313 T314 L361 T362 I364 N392 L395 V480	V307-M309 HydrophobicContact CG1-SD 4.05Å; M309-N312 VanDerWaalsContact CE-O 3.24Å; M309-N312 WeakPolarHBondContact CE-O 3.26Å; M309-R313 WeakPolarHBondContact CA-O 3.46Å; M309-T314 WeakPolarHBondContact CE-OG1 3.42Å; M309-T314 HydrophobicContact SD-CG2 4.02Å; M309-T314 PolarHBondContact SD-OG1 2.68Å; M309-L361 CarbonylContact O-C 3.42Å; M309-L361 VanDerWaalsContact O-CA 3.32Å; M309-L361 WeakPolarHBondContact O-CA 3.11Å; M309-T362 PolarHBondContact N-O 2.73Å; M309-T362 PolarHBondContact O-N 3.22Å; M309-I364 HydrophobicContact CG-CD1 3.73Å; M309-I364 HydrophobicContact CG-CG1 3.92Å; M309-I364 HydrophobicContact CG-CG2 4.37Å; M309-I364 HydrophobicContact SD-CD1 4Å; M309-N392 HydrophobicContact CE-CB 3.85Å; M309-L395 HydrophobicContact CB-CD1 3.85Å; M309-L395 HydrophobicContact CE-CD1 4.06Å; M309-L395 HydrophobicContact CG-CD1 3.88Å; M309-V480 HydrophobicContact CE-CG1 4.28Å; M309-V480 HydrophobicContact SD-CG2 4.4Å
310	L	89.9	Confident	87.9	Confident	0 Å²	0	42.5 Å²	42.5	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	107.8	170.6	180	70.7	0	0	0	108.1	N312 R313 L315 F342 Y355 F356 N359 L361 Y411	L310-N312 PolarHBondContact O-N 3.38Å; L310-N312 VanDerWaalsContact O-N 3.08Å; L310-R313 PolarHBondContact N-O 3.14Å; L310-R313 PolarHBondContact O-N 2.67Å; L310-L315 HydrophobicContact CB-CD1 4.06Å; L310-L315 HydrophobicContact CB-CD2 4.49Å; L310-L315 HydrophobicContact CB-CG 4.28Å; L310-F342 HydrophobicContact CD2-CE1 4.39Å; L310-F342 HydrophobicContact CD2-CZ 4.44Å; L310-Y355 HydrophobicContact CB-CE1 4.44Å; L310-Y355 HydrophobicContact CD2-CD1 3.74Å; L310-Y355 HydrophobicContact CD2-CE1 3.84Å; L310-Y355 HydrophobicContact CG-CD1 4.13Å; L310-Y355 HydrophobicContact CG-CE1 3.8Å; L310-Y355 WeakPolarHBondContact O-CE1 3.28Å; L310-Y355 PolarHBondContact O-OH 3.47Å; L310-F356 HydrophobicContact CD1-CD2 3.82Å; L310-F356 HydrophobicContact CD1-CE2 4.34Å; L310-F356 HydrophobicContact CD2-CB 4.26Å; L310-F356 HydrophobicContact CD2-CD2 3.83Å; L310-F356 HydrophobicContact CG-CD2 4.5Å; L310-N359 HydrophobicContact CD1-CB 4.43Å; L310-N359 HydrophobicContact CG-CB 4.48Å; L310-L361 HydrophobicContact CB-CD2 3.93Å; L310-L361 HydrophobicContact CD1-CD2 3.63Å; L310-L361 HydrophobicContact CD1-CG 4.06Å; L310-L361 HydrophobicContact CG-CD2 4.38Å; L310-Y411 HydrophobicContact CD2-CE1 4.03Å; L310-Y411 WeakPolarHBondContact CD2-OH 3.49Å
311	G	88.6	Confident	87.2	Confident	6 Å²	6	39.2 Å²	39.2	6%	0.062	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.2	-114.3	-166.9	0	0	0	0	0	110.3	N360 L395	G311-N360 PolarHBondContact N-O 3.17Å; G311-L395 VanDerWaalsContact O-CB 3.31Å; G311-L395 WeakPolarHBondContact O-CB 3.49Å; G311-L395 WeakPolarHBondContact O-CD1 3.45Å
312	N	89.4	Confident	87	Confident	17 Å²	17	39.1 Å²	39.1	9%	0.091	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-7.5	175.9	69	-32.7	0	0	0	114.8	M309 L310 Y355 E391 N392 L395 S397	M309-N312 VanDerWaalsContact CE-O 3.24Å; M309-N312 WeakPolarHBondContact CE-O 3.26Å; L310-N312 PolarHBondContact O-N 3.38Å; L310-N312 VanDerWaalsContact O-N 3.08Å; N312-Y355 PolarHBondContact N-OH 3.27Å; N312-Y355 PolarHBondContact OD1-OH 2.76Å; N312-E391 PolarHBondContact ND2-OE1 3.48Å; N312-E391 PolarHBondContact ND2-OE2 3.07Å; N312-E391 CarbonylContact O-C 3.56Å; N312-E391 WeakPolarHBondContact O-CA 3.39Å; N312-N392 WeakPolarHBondContact CB-O 3.5Å; N312-N392 PolarHBondContact O-N 2.82Å; N312-L395 HydrophobicContact CB-CB 4.5Å; N312-S397 PolarHBondContact ND2-OG 2.75Å; N312-S397 WeakPolarHBondContact OD1-CB 3.42Å; N312-S397 PolarHBondContact OD1-OG 2.81Å; N312-S397 VanDerWaalsContact OD1-OG 3.13Å
313	R	89.7	Confident	86.9	Confident	20 Å²	20	37.6 Å²	37.6	8%	0.075	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	138.6	-172.3	-64.1	174.1	-179.9	178.3	-10.3	113.1	M309 L310 Y355 E391 D406 Y411	M309-R313 WeakPolarHBondContact CA-O 3.46Å; L310-R313 PolarHBondContact N-O 3.14Å; L310-R313 PolarHBondContact O-N 2.67Å; R313-Y355 HydrophobicContact CG-CE1 4.21Å; R313-E391 HydrophobicContact CG-CG 4.07Å; R313-E391 IonicContact NE-OE1 2.67Å; R313-D406 IonicContact CZ-OD2 2.66Å; R313-D406 IonicContact NH1-OD2 3.87Å; R313-D406 PolarHBondContact NH1-OD2 3.17Å; R313-D406 IonicContact NH2-OD2 2.76Å; R313-D406 PolarHBondContact NH2-OD2 2.78Å; R313-D406 VanDerWaalsContact NH2-OD2 3.08Å; R313-Y411 HydrophobicContact CB-CD1 3.84Å; R313-Y411 HydrophobicContact CB-CE1 3.78Å; R313-Y411 HydrophobicContact CG-CE1 4.45Å; R313-Y411 PolarHBondContact NH1-OH 3.2Å
314	T	90.9	Very high	86.8	Confident	0 Å²	0	40.5 Å²	40.5	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	135.6	177.6	-52.9	0	0	0	0	112.6	V307 M309 V390 Y411 V412 S489	V307-T314 HydrophobicContact CG1-CG2 3.82Å; M309-T314 WeakPolarHBondContact CE-OG1 3.42Å; M309-T314 HydrophobicContact SD-CG2 4.02Å; M309-T314 PolarHBondContact SD-OG1 2.68Å; T314-V390 PolarHBondContact N-O 2.94Å; T314-V390 PolarHBondContact OG1-O 2.9Å; T314-Y411 WeakPolarHBondContact O-CA 3.46Å; T314-V412 HydrophobicContact CG2-CB 4.38Å; T314-V412 HydrophobicContact CG2-CG2 3.92Å; T314-V412 PolarHBondContact O-N 2.78Å; T314-S489 WeakPolarHBondContact CG2-OG 3.45Å
315	L	90.2	Very high	86.7	Confident	0 Å²	0	36.7 Å²	36.7	0%	0	19%	0.186	C	C	.	.	B	Isolated β-bridge	trans	-102.7	146.2	179.7	-67.4	172.5	0	0	0	113	C308 L310 N317 F320 L338 F342 L361 P410 Y411	C308-L315 HydrophobicContact CB-CB 4.48Å; C308-L315 PolarHBondContact O-N 3.37Å; L310-L315 HydrophobicContact CB-CD1 4.06Å; L310-L315 HydrophobicContact CB-CD2 4.49Å; L310-L315 HydrophobicContact CB-CG 4.28Å; L315-N317 PolarHBondContact O-N 2.77Å; L315-F320 HydrophobicContact CB-CE1 4.21Å; L315-F320 HydrophobicContact CB-CZ 4.11Å; L315-F320 HydrophobicContact CD1-CZ 4.41Å; L315-L338 HydrophobicContact CD1-CD1 4.21Å; L315-L338 HydrophobicContact CD1-CD2 4.31Å; L315-F342 HydrophobicContact CD2-CE2 3.91Å; L315-F342 HydrophobicContact CD2-CZ 3.57Å; L315-L361 HydrophobicContact CD1-CD2 3.73Å; L315-P410 WeakPolarHBondContact CA-O 3.35Å; L315-Y411 HydrophobicContact CD2-CD1 3.65Å; L315-Y411 HydrophobicContact CD2-CE1 3.73Å
316	Q	87.6	Confident	86.5	Confident	24 Å²	24	37.1 Å²	37.1	11%	0.112	19%	0.193	C	C	.	.			trans	-75	111.1	174.7	-63.8	179.2	-63	0	0	110.8	L318 F320 P410 V412 D488	Q316-L318 PolarHBondContact O-N 2.91Å; Q316-F320 WeakPolarHBondContact O-CE1 3.46Å; Q316-P410 PolarHBondContact N-O 3.09Å; Q316-V412 HydrophobicContact CG-CG2 3.91Å; Q316-D488 HydrophobicContact CB-CB 4.25Å; Q316-D488 HydrophobicContact CG-CB 3.99Å; Q316-D488 PolarHBondContact NE2-OD2 3.24Å
317	N	82.8	Confident	86.4	Confident	18 Å²	18	37.7 Å²	37.7	10%	0.096	19%	0.191	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	45.7	-173	-164.7	-1.3	0	0	0	112	L315 D488 S489 K491	L315-N317 PolarHBondContact O-N 2.77Å; N317-D488 WeakPolarHBondContact CA-O 3.32Å; N317-D488 WeakPolarHBondContact CB-O 3.39Å; N317-D488 PolarHBondContact N-O 3.38Å; N317-S489 WeakPolarHBondContact CB-O 3.45Å; N317-S489 PolarHBondContact ND2-O 3.4Å; N317-S489 VanDerWaalsContact ND2-O 3.12Å; N317-K491 HydrophobicContact CB-CG 4.36Å; N317-K491 WeakPolarHBondContact O-CA 3.48Å; N317-K491 WeakPolarHBondContact O-CG 3.35Å; N317-K491 WeakPolarHBondContact OD1-CE 3.36Å
318	L	75.7	Confident	86.1	Confident	102 Å²	102	43.5 Å²	43.5	53%	0.534	22%	0.221	S	C	.	.	T	Hydrogen-bonded Turn	trans	-119	-24	-177.3	-73.7	167.1	0	0	0	113.2	Q316 D488	Q316-L318 PolarHBondContact O-N 2.91Å; L318-D488 HydrophobicContact CD1-CB 4.37Å
319	Q	74.8	Confident	85.8	Confident	113 Å²	113	47.2 Å²	47.2	53%	0.528	24%	0.24	S	C	.	.	S	Bend	trans	-111.3	4.9	-171.5	-65.7	-178.2	-27	0	0	113.9	L341	Q319-L341 HydrophobicContact CB-CD1 3.73Å; Q319-L341 HydrophobicContact CB-CD2 4.33Å
320	F	80.5	Confident	85.4	Confident	8 Å²	8	54.3 Å²	54.3	4%	0.035	28%	0.278	C	S	.	.			trans	-148.2	140.2	178.5	61.8	-90.5	0	0	0	112.9	C308 L315 Q316 K322 C323 Q337 L338 L341	C308-F320 HydrophobicContact CB-CE2 4.03Å; C308-F320 HydrophobicContact CB-CZ 3.85Å; L315-F320 HydrophobicContact CB-CE1 4.21Å; L315-F320 HydrophobicContact CB-CZ 4.11Å; L315-F320 HydrophobicContact CD1-CZ 4.41Å; Q316-F320 WeakPolarHBondContact O-CE1 3.46Å; F320-K322 WeakPolarHBondContact CD2-O 3.49Å; F320-C323 HydrophobicContact CE2-CB 4.36Å; F320-Q337 HydrophobicContact CB-CB 4.22Å; F320-L338 HydrophobicContact CB-CB 3.95Å; F320-L338 HydrophobicContact CD1-CB 4.5Å; F320-L338 HydrophobicContact CD1-CD1 3.73Å; F320-L338 HydrophobicContact CD2-CB 4.4Å; F320-L338 HydrophobicContact CD2-CD2 4.27Å; F320-L338 HydrophobicContact CE1-CD1 3.89Å; F320-L338 HydrophobicContact CE2-CD2 4.27Å; F320-L338 HydrophobicContact CG-CB 4.05Å; F320-L338 HydrophobicContact CG-CD1 4.12Å; F320-L338 HydrophobicContact CG-CG 4.46Å; F320-L338 HydrophobicContact CZ-CD1 4.42Å; F320-L341 HydrophobicContact CD1-CD1 4.18Å
321	D	77.1	Confident	85.4	Confident	116 Å²	116	61.7 Å²	61.7	62%	0.62	32%	0.317	S	S	*	.	S	Bend	trans	-80.1	-27.3	-178.3	-66.9	-47.1	0	0	0	114.3	Q337	D321-Q337 PolarHBondContact OD2-NE2 2.82Å; D321-Q337 PolarHBondContact OD2-OE1 2.84Å
322	K	84.6	Confident	85.1	Confident	92 Å²	92	66.8 Å²	66.8	40%	0.4	34%	0.343	S	S	.	.	S	Bend	trans	-135.9	130.4	-172.1	-64.3	177.4	-173	169	0	111.8	F320 L324 E327	F320-K322 WeakPolarHBondContact CD2-O 3.49Å; K322-L324 PolarHBondContact O-N 2.82Å; K322-E327 WeakPolarHBondContact CD-OE2 3.4Å; K322-E327 IonicContact NZ-OE1 3.58Å; K322-E327 PolarHBondContact NZ-OE1 2.92Å; K322-E327 IonicContact NZ-OE2 2.63Å; K322-E327 PolarHBondContact NZ-OE2 3.32Å
323	C	87.8	Confident	84.9	Confident	24 Å²	24	69.9 Å²	69.9	16%	0.162	36%	0.363	C	S	.	.	S	Bend	trans	-77.8	58.5	176.6	-171.7	0	0	0	0	112.1	C308 F320 L363	C308-C323 VanDerWaalsContact CA-SG 3.51Å; C308-C323 HydrophobicContact CB-CB 3.79Å; C308-C323 WeakPolarHBondContact CB-SG 3.37Å; C308-C323 WeakPolarHBondContact SG-CB 3.37Å; C308-C323 CovalentContact SG-SG 2.03Å; C308-C323 PolarHBondContact SG-SG 3.08Å; F320-C323 HydrophobicContact CE2-CB 4.36Å; C323-L363 HydrophobicContact CB-CD1 4.42Å
324	L	88.9	Confident	84.8	Confident	92 Å²	92	72 Å²	72	48%	0.482	38%	0.378	S	S	.	.			trans	-140.3	150.3	-178.9	-66.9	172.8	0	0	0	109.8	K322 T336 L361	K322-L324 PolarHBondContact O-N 2.82Å; L324-T336 HydrophobicContact CB-CG2 4.26Å; L324-T336 WeakPolarHBondContact O-CB 3.42Å; L324-T336 VanDerWaalsContact O-CG2 3.25Å; L324-T336 WeakPolarHBondContact O-CG2 3.27Å; L324-T336 PolarHBondContact O-OG1 3.1Å; L324-L361 VanDerWaalsContact C-CD1 3.5Å
325	K	86.5	Confident	84.5	Confident	42 Å²	42	72.8 Å²	72.8	18%	0.183	38%	0.383	C	S	.	.	S	Bend	trans	-77.6	-39.7	175.9	-60.6	-167.1	-174	179.4	0	112.1	T336 W339 F356 V357 N359 L361	K325-T336 PolarHBondContact O-N 2.79Å; K325-T336 PolarHBondContact O-OG1 3.5Å; K325-W339 HydrophobicContact CB-CE3 4.17Å; K325-W339 HydrophobicContact CB-CZ3 4.33Å; K325-F356 HydrophobicContact CB-CZ 4.34Å; K325-F356 HydrophobicContact CD-CE1 4.18Å; K325-F356 HydrophobicContact CD-CZ 4.01Å; K325-F356 WeakPolarHBondContact CE-O 3.49Å; K325-F356 HydrophobicContact CG-CE1 4.42Å; K325-F356 HydrophobicContact CG-CE2 4.29Å; K325-F356 HydrophobicContact CG-CZ 3.8Å; K325-F356 PolarHBondContact NZ-O 3.4Å; K325-V357 PolarHBondContact NZ-O 2.95Å; K325-N359 VanDerWaalsContact CE-O 3.3Å; K325-N359 WeakPolarHBondContact CE-O 3.17Å; K325-N359 PolarHBondContact NZ-O 2.93Å; K325-L361 HydrophobicContact CG-CD1 3.61Å; K325-L361 HydrophobicContact CG-CG 4.21Å
326	T	87.2	Confident	84.4	Confident	55 Å²	55	73.5 Å²	73.5	34%	0.337	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	146.3	-176.9	53.2	0	0	0	0	110	V334 L348	T326-V334 CarbonylContact C-O 3.55Å; T326-V334 VanDerWaalsContact CA-O 3.31Å; T326-V334 WeakPolarHBondContact CA-O 3.48Å; T326-L348 HydrophobicContact CG2-CD2 4.04Å
327	E	87.4	Confident	84.3	Confident	60 Å²	60	76.7 Å²	76.7	28%	0.28	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	145.5	172.7	-178.7	165	-150.6	0	0	110.3	K322 I329 V334 T336	K322-E327 WeakPolarHBondContact CD-OE2 3.4Å; K322-E327 IonicContact NZ-OE1 3.58Å; K322-E327 PolarHBondContact NZ-OE1 2.92Å; K322-E327 IonicContact NZ-OE2 2.63Å; K322-E327 PolarHBondContact NZ-OE2 3.32Å; E327-I329 HydrophobicContact CG-CG1 3.97Å; E327-V334 PolarHBondContact N-O 3.35Å; E327-V334 PolarHBondContact O-N 3.42Å; E327-T336 HydrophobicContact CB-CG2 4.28Å
328	I	86.7	Confident	84.5	Confident	122 Å²	122	75.8 Å²	75.8	63%	0.626	40%	0.398	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	108.5	175.3	-58.3	172.5	0	0	0	108.1	N332 T333	I328-N332 WeakPolarHBondContact CA-O 3.33Å; I328-T333 HydrophobicContact CG1-CG2 4.15Å
329	I	85.3	Confident	85.1	Confident	81 Å²	81	72.4 Å²	72.4	42%	0.415	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	120.2	176.8	-55.3	178.6	0	0	0	107.4	E327 N331 N332 V334	E327-I329 HydrophobicContact CG-CG1 3.97Å; I329-N331 PolarHBondContact O-N 3.46Å; I329-N332 PolarHBondContact N-O 3.41Å; I329-N332 PolarHBondContact O-N 3.39Å; I329-V334 HydrophobicContact CB-CG2 4.35Å
330	N	82.5	Confident	85.6	Confident	149 Å²	149	74.8 Å²	74.8	80%	0.797	38%	0.382	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	48.2	-179.4	-57.1	-27	0	0	0	113.4	N332	N330-N332 PolarHBondContact O-N 3.07Å; N330-N332 VanDerWaalsContact O-N 3.09Å
331	N	88.4	Confident	85.8	Confident	155 Å²	155	76.8 Å²	76.8	83%	0.829	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	61.7	0.5	-173.7	-68.4	-11	0	0	0	116.7	I329	I329-N331 PolarHBondContact O-N 3.46Å
332	N	83.6	Confident	86.3	Confident	113 Å²	113	71.7 Å²	71.7	60%	0.604	37%	0.365	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	134.7	174.6	-67.1	-18.8	0	0	0	110.3	I328 I329 N330 V334	I328-N332 WeakPolarHBondContact CA-O 3.33Å; I329-N332 PolarHBondContact N-O 3.41Å; I329-N332 PolarHBondContact O-N 3.39Å; N330-N332 PolarHBondContact O-N 3.07Å; N330-N332 VanDerWaalsContact O-N 3.09Å; N332-V334 PolarHBondContact O-N 2.7Å
333	T	85.1	Confident	86.4	Confident	82 Å²	82	67.8 Å²	67.8	50%	0.503	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	113.1	171.3	46.7	0	0	0	0	110	I328	I328-T333 HydrophobicContact CG1-CG2 4.15Å
334	V	86.8	Confident	86.2	Confident	64 Å²	64	73.3 Å²	73.3	39%	0.388	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	143.8	179.1	-173	0	0	0	0	109.4	T326 E327 I329 N332	T326-V334 CarbonylContact C-O 3.55Å; T326-V334 VanDerWaalsContact CA-O 3.31Å; T326-V334 WeakPolarHBondContact CA-O 3.48Å; E327-V334 PolarHBondContact N-O 3.35Å; E327-V334 PolarHBondContact O-N 3.42Å; I329-V334 HydrophobicContact CB-CG2 4.35Å; N332-V334 PolarHBondContact O-N 2.7Å
335	S	85.8	Confident	86	Confident	17 Å²	17	69.8 Å²	69.8	12%	0.119	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	140.7	172.5	56.8	0	0	0	0	111.6	P346	S335-P346 VanDerWaalsContact CB-O 3.29Å; S335-P346 WeakPolarHBondContact CB-O 3.44Å; S335-P346 PolarHBondContact OG-O 3.35Å
336	T	88.3	Confident	85.7	Confident	14 Å²	14	70.7 Å²	70.7	9%	0.086	37%	0.373	C	S	.	.			trans	-79.7	171.2	174.4	62.5	0	0	0	0	111.3	L324 K325 E327 L338 W339	L324-T336 HydrophobicContact CB-CG2 4.26Å; L324-T336 WeakPolarHBondContact O-CB 3.42Å; L324-T336 VanDerWaalsContact O-CG2 3.25Å; L324-T336 WeakPolarHBondContact O-CG2 3.27Å; L324-T336 PolarHBondContact O-OG1 3.1Å; K325-T336 PolarHBondContact O-N 2.79Å; K325-T336 PolarHBondContact O-OG1 3.5Å; E327-T336 HydrophobicContact CB-CG2 4.28Å; T336-L338 PolarHBondContact O-N 3.13Å; T336-L338 PolarHBondContact OG1-N 3.46Å; T336-W339 VanDerWaalsContact O-CB 3.31Å; T336-W339 WeakPolarHBondContact O-CB 3.46Å; T336-W339 PolarHBondContact O-N 3.06Å; T336-W339 PolarHBondContact OG1-N 3.12Å
337	Q	84.9	Confident	85.5	Confident	91 Å²	91	74.3 Å²	74.3	43%	0.425	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-37.7	169.2	-69.5	162.3	-7	0	0	111.8	F320 D321 W339 R340	F320-Q337 HydrophobicContact CB-CB 4.22Å; D321-Q337 PolarHBondContact OD2-NE2 2.82Å; D321-Q337 PolarHBondContact OD2-OE1 2.84Å; Q337-W339 VanDerWaalsContact C-N 3.28Å; Q337-W339 PolarHBondContact O-N 3.47Å; Q337-R340 WeakPolarHBondContact O-CB 3.39Å; Q337-R340 PolarHBondContact O-N 3.17Å; Q337-R340 VanDerWaalsContact O-N 3.1Å
338	L	87.5	Confident	85.2	Confident	0 Å²	0	76 Å²	76	0%	0	40%	0.397	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61	-33.9	178.7	-179.8	57.1	0	0	0	112.6	L315 F320 T336 R340 L341 F342 F356 L361	L315-L338 HydrophobicContact CD1-CD1 4.21Å; L315-L338 HydrophobicContact CD1-CD2 4.31Å; F320-L338 HydrophobicContact CB-CB 3.95Å; F320-L338 HydrophobicContact CD1-CB 4.5Å; F320-L338 HydrophobicContact CD1-CD1 3.73Å; F320-L338 HydrophobicContact CD2-CB 4.4Å; F320-L338 HydrophobicContact CD2-CD2 4.27Å; F320-L338 HydrophobicContact CE1-CD1 3.89Å; F320-L338 HydrophobicContact CE2-CD2 4.27Å; F320-L338 HydrophobicContact CG-CB 4.05Å; F320-L338 HydrophobicContact CG-CD1 4.12Å; F320-L338 HydrophobicContact CG-CG 4.46Å; F320-L338 HydrophobicContact CZ-CD1 4.42Å; T336-L338 PolarHBondContact O-N 3.13Å; T336-L338 PolarHBondContact OG1-N 3.46Å; L338-R340 VanDerWaalsContact C-N 3.31Å; L338-R340 PolarHBondContact O-N 3.37Å; L338-L341 HydrophobicContact CD1-CD1 4.28Å; L338-L341 PolarHBondContact O-N 3.41Å; L338-F342 HydrophobicContact CD1-CD2 3.99Å; L338-F342 HydrophobicContact CD1-CE2 3.71Å; L338-F356 HydrophobicContact CG-CE2 4.42Å; L338-L361 HydrophobicContact CD2-CD1 3.5Å; L338-L361 VanDerWaalsContact CD2-CD1 3.5Å; L338-L361 HydrophobicContact CD2-CD2 4.03Å; L338-L361 HydrophobicContact CD2-CG 4.45Å
339	W	87.7	Confident	84.9	Confident	30 Å²	30	75.6 Å²	75.6	11%	0.114	41%	0.405	C	S	.	.	G	3₁₀ helix	trans	-57.8	-43	173.5	-172.6	-84.8	0	0	0	112	K325 T336 Q337 L341 F342 C343 G345 L348 S350 F356	K325-W339 HydrophobicContact CB-CE3 4.17Å; K325-W339 HydrophobicContact CB-CZ3 4.33Å; T336-W339 VanDerWaalsContact O-CB 3.31Å; T336-W339 WeakPolarHBondContact O-CB 3.46Å; T336-W339 PolarHBondContact O-N 3.06Å; T336-W339 PolarHBondContact OG1-N 3.12Å; Q337-W339 VanDerWaalsContact C-N 3.28Å; Q337-W339 PolarHBondContact O-N 3.47Å; W339-L341 PolarHBondContact O-N 3.26Å; W339-F342 PolarHBondContact O-N 3.44Å; W339-F342 VanDerWaalsContact O-N 3.1Å; W339-C343 VanDerWaalsContact CE2-SG 3.57Å; W339-C343 HydrophobicContact CG-CB 4.48Å; W339-C343 WeakPolarHBondContact O-CB 3.42Å; W339-C343 PolarHBondContact O-N 2.98Å; W339-G345 VanDerWaalsContact CD1-O 3.28Å; W339-G345 PolarHBondContact NE1-O 3.25Å; W339-L348 HydrophobicContact CH2-CD2 4.47Å; W339-S350 PolarHBondContact NE1-OG 3.36Å; W339-S350 VanDerWaalsContact NE1-OG 3.16Å; W339-F356 HydrophobicContact CD2-CE1 4.38Å; W339-F356 AromaticContact CE3-CE1 3.84Å; W339-F356 HydrophobicContact CE3-CE1 3.84Å; W339-F356 HydrophobicContact CE3-CZ 4.3Å; W339-F356 HydrophobicContact CZ3-CE1 4.17Å
340	R	85.9	Confident	84.8	Confident	164 Å²	164	72.9 Å²	72.9	62%	0.619	39%	0.393	S	S	*	.	G	3₁₀ helix	trans	-68.1	-13.4	-179	-57.3	-178.5	-178.2	-176.5	-1.9	114	Q337 L338	Q337-R340 WeakPolarHBondContact O-CB 3.39Å; Q337-R340 PolarHBondContact O-N 3.17Å; Q337-R340 VanDerWaalsContact O-N 3.1Å; L338-R340 VanDerWaalsContact C-N 3.31Å; L338-R340 PolarHBondContact O-N 3.37Å
341	L	84.7	Confident	84.9	Confident	49 Å²	49	70.6 Å²	70.6	26%	0.257	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-87.3	-15.1	175.8	-57.7	173.9	0	0	0	112.6	Q319 F320 L338 W339 P410	Q319-L341 HydrophobicContact CB-CD1 3.73Å; Q319-L341 HydrophobicContact CB-CD2 4.33Å; F320-L341 HydrophobicContact CD1-CD1 4.18Å; L338-L341 HydrophobicContact CD1-CD1 4.28Å; L338-L341 PolarHBondContact O-N 3.41Å; W339-L341 PolarHBondContact O-N 3.26Å; L341-P410 HydrophobicContact CB-CG 3.96Å; L341-P410 HydrophobicContact CD1-CG 4.04Å
342	F	86.7	Confident	84.7	Confident	9 Å²	9	65 Å²	65	4%	0.039	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	-123.9	-3.4	-176.4	-73	-81.8	0	0	0	114.1	L310 L315 L338 W339 C352 N353 F356 L409 P410 Y411	L310-F342 HydrophobicContact CD2-CE1 4.39Å; L310-F342 HydrophobicContact CD2-CZ 4.44Å; L315-F342 HydrophobicContact CD2-CE2 3.91Å; L315-F342 HydrophobicContact CD2-CZ 3.57Å; L338-F342 HydrophobicContact CD1-CD2 3.99Å; L338-F342 HydrophobicContact CD1-CE2 3.71Å; W339-F342 PolarHBondContact O-N 3.44Å; W339-F342 VanDerWaalsContact O-N 3.1Å; F342-C352 WeakPolarHBondContact O-CA 3.48Å; F342-N353 HydrophobicContact CD1-CB 4.37Å; F342-N353 PolarHBondContact O-N 3.02Å; F342-F356 HydrophobicContact CB-CB 3.93Å; F342-F356 HydrophobicContact CB-CD1 3.79Å; F342-F356 HydrophobicContact CB-CD2 3.79Å; F342-F356 HydrophobicContact CB-CE1 4.2Å; F342-F356 HydrophobicContact CB-CE2 4.21Å; F342-F356 HydrophobicContact CB-CG 3.56Å; F342-F356 HydrophobicContact CB-CZ 4.4Å; F342-F356 HydrophobicContact CD1-CB 4Å; F342-F356 HydrophobicContact CD1-CD2 4.15Å; F342-F356 HydrophobicContact CD1-CG 4.25Å; F342-F356 AromaticContact CD2-CD2 3.73Å; F342-F356 HydrophobicContact CD2-CD2 3.73Å; F342-F356 AromaticContact CD2-CE2 3.87Å; F342-F356 HydrophobicContact CD2-CE2 3.87Å; F342-F356 HydrophobicContact CD2-CG 4.39Å; F342-F356 HydrophobicContact CE2-CD2 4.37Å; F342-F356 HydrophobicContact CG-CB 4.07Å; F342-F356 AromaticContact CG-CD2 3.61Å; F342-F356 HydrophobicContact CG-CD2 3.61Å; F342-F356 HydrophobicContact CG-CE2 4.14Å; F342-F356 AromaticContact CG-CG 3.82Å; F342-F356 HydrophobicContact CG-CG 3.82Å; F342-L409 HydrophobicContact CD1-CD1 3.97Å; F342-L409 HydrophobicContact CD1-CD2 4.23Å; F342-L409 HydrophobicContact CE1-CB 3.9Å; F342-L409 HydrophobicContact CE1-CD1 3.85Å; F342-L409 HydrophobicContact CE1-CD2 4.36Å; F342-L409 HydrophobicContact CE1-CG 4.26Å; F342-L409 HydrophobicContact CZ-CB 4.44Å; F342-P410 HydrophobicContact CE2-CG 3.65Å; F342-P410 HydrophobicContact CZ-CG 3.71Å; F342-Y411 HydrophobicContact CE1-CE1 4.3Å; F342-Y411 HydrophobicContact CE1-CE2 4.02Å; F342-Y411 AromaticContact CE1-CZ 3.69Å; F342-Y411 HydrophobicContact CZ-CE1 4.2Å; F342-Y411 HydrophobicContact CZ-CE2 4.49Å
343	C	87.1	Confident	84.8	Confident	10 Å²	10	61.5 Å²	61.5	7%	0.068	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-139.4	148.5	-176.6	-52.9	0	0	0	0	111.6	W339 G345 S350 T351 C352	W339-C343 VanDerWaalsContact CE2-SG 3.57Å; W339-C343 HydrophobicContact CG-CB 4.48Å; W339-C343 WeakPolarHBondContact O-CB 3.42Å; W339-C343 PolarHBondContact O-N 2.98Å; C343-G345 PolarHBondContact O-N 3.25Å; C343-G345 VanDerWaalsContact O-N 3.1Å; C343-S350 WeakPolarHBondContact CB-OG 3.35Å; C343-T351 VanDerWaalsContact CA-O 3.26Å; C343-T351 WeakPolarHBondContact CA-O 3.46Å; C343-T351 WeakPolarHBondContact CB-O 3.36Å; C343-C352 HydrophobicContact CB-CB 4.02Å; C343-C352 WeakPolarHBondContact CB-SG 3.4Å; C343-C352 WeakPolarHBondContact SG-CB 3.44Å; C343-C352 CovalentContact SG-SG 2.03Å; C343-C352 PolarHBondContact SG-SG 3.25Å
344	D	83.4	Confident	84.8	Confident	140 Å²	140	61.6 Å²	61.6	75%	0.749	33%	0.333	S	S	*	.	S	Bend	trans	-70.9	-6.2	-172.4	-60.5	-49.7	0	0	0	114.6	T351	D344-T351 PolarHBondContact N-O 2.92Å; D344-T351 WeakPolarHBondContact OD2-CB 3.39Å; D344-T351 PolarHBondContact OD2-OG1 3.41Å
345	G	84.6	Confident	84.7	Confident	19 Å²	19	58.8 Å²	58.8	20%	0.196	32%	0.316	C	S	.	.	S	Bend	trans	-161.1	171	-178.8	0	0	0	0	0	114.1	W339 C343 E347 S350	W339-G345 VanDerWaalsContact CD1-O 3.28Å; W339-G345 PolarHBondContact NE1-O 3.25Å; C343-G345 PolarHBondContact O-N 3.25Å; C343-G345 VanDerWaalsContact O-N 3.1Å; G345-E347 VanDerWaalsContact C-N 3.34Å; G345-S350 PolarHBondContact O-OG 3.48Å
346	P	81.2	Confident	84.8	Confident	60 Å²	60	58.1 Å²	58.1	39%	0.39	31%	0.311	S	S	.	.	S	Bend	trans	-81.8	-10.7	178.9	34.6	-36.4	0	0	0	113.6	S335	S335-P346 VanDerWaalsContact CB-O 3.29Å; S335-P346 WeakPolarHBondContact CB-O 3.44Å; S335-P346 PolarHBondContact OG-O 3.35Å
347	E	82.9	Confident	84.8	Confident	132 Å²	132	61.6 Å²	61.6	62%	0.617	33%	0.332	S	S	*	.	S	Bend	trans	-77.7	144.7	-179.4	-61.3	-56.5	149.6	0	0	111.5	G345 S349 S350	G345-E347 VanDerWaalsContact C-N 3.34Å; E347-S349 PolarHBondContact O-N 2.85Å; E347-S350 WeakPolarHBondContact O-CB 3.27Å; E347-S350 PolarHBondContact O-N 3.19Å; E347-S350 PolarHBondContact O-OG 3.24Å
348	L	80.2	Confident	85	Confident	96 Å²	96	61 Å²	61	50%	0.503	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-12.9	177.6	-77.3	149.8	0	0	0	113.9	T326 W339	T326-L348 HydrophobicContact CG2-CD2 4.04Å; W339-L348 HydrophobicContact CH2-CD2 4.47Å
349	S	80.9	Confident	85	Confident	112 Å²	112	61.2 Å²	61.2	78%	0.783	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.7	1.4	176.5	55	0	0	0	0	114.3	E347	E347-S349 PolarHBondContact O-N 2.85Å
350	S	82.9	Confident	85.2	Confident	25 Å²	25	65.8 Å²	65.8	18%	0.175	36%	0.359	C	S	.	.	S	Bend	trans	-64.1	145.6	179	61.2	0	0	0	0	112.6	W339 C343 G345 E347 C352	W339-S350 PolarHBondContact NE1-OG 3.36Å; W339-S350 VanDerWaalsContact NE1-OG 3.16Å; C343-S350 WeakPolarHBondContact CB-OG 3.35Å; G345-S350 PolarHBondContact O-OG 3.48Å; E347-S350 WeakPolarHBondContact O-CB 3.27Å; E347-S350 PolarHBondContact O-N 3.19Å; E347-S350 PolarHBondContact O-OG 3.24Å; S350-C352 PolarHBondContact O-SG 3.41Å
351	T	84.8	Confident	85.3	Confident	101 Å²	101	59.4 Å²	59.4	62%	0.62	34%	0.338	S	S	*	.			trans	-61	135.6	163.2	31.8	0	0	0	0	110.7	C343 D344	C343-T351 VanDerWaalsContact CA-O 3.26Å; C343-T351 WeakPolarHBondContact CA-O 3.46Å; C343-T351 WeakPolarHBondContact CB-O 3.36Å; D344-T351 PolarHBondContact N-O 2.92Å; D344-T351 WeakPolarHBondContact OD2-CB 3.39Å; D344-T351 PolarHBondContact OD2-OG1 3.41Å
352	C	84.6	Confident	85.6	Confident	38 Å²	38	59.6 Å²	59.6	26%	0.257	34%	0.341	S	S	.	.	B	Isolated β-bridge	trans	-134	157.1	-174.5	-67.2	0	0	0	0	110.6	F342 C343 S350 E354 V357	F342-C352 WeakPolarHBondContact O-CA 3.48Å; C343-C352 HydrophobicContact CB-CB 4.02Å; C343-C352 WeakPolarHBondContact CB-SG 3.4Å; C343-C352 WeakPolarHBondContact SG-CB 3.44Å; C343-C352 CovalentContact SG-SG 2.03Å; C343-C352 PolarHBondContact SG-SG 3.25Å; S350-C352 PolarHBondContact O-SG 3.41Å; C352-E354 PolarHBondContact O-N 3.2Å; C352-V357 HydrophobicContact CB-CG2 3.76Å
353	N	85.4	Confident	85.8	Confident	38 Å²	38	64.4 Å²	64.4	20%	0.203	37%	0.366	C	S	.	.			trans	-58.8	132.6	171.3	177.6	-71.8	0	0	0	111.4	F342 Y355 F356 V357 D406 L409	F342-N353 HydrophobicContact CD1-CB 4.37Å; F342-N353 PolarHBondContact O-N 3.02Å; N353-Y355 VanDerWaalsContact C-N 3.34Å; N353-Y355 PolarHBondContact O-N 2.93Å; N353-Y355 WeakPolarHBondContact OD1-CA 3.25Å; N353-Y355 VanDerWaalsContact OD1-CB 3.31Å; N353-Y355 WeakPolarHBondContact OD1-CB 3.49Å; N353-Y355 PolarHBondContact OD1-N 3.34Å; N353-F356 HydrophobicContact CB-CB 4.21Å; N353-F356 WeakPolarHBondContact O-CB 3.24Å; N353-F356 PolarHBondContact O-N 3.12Å; N353-F356 PolarHBondContact OD1-N 2.64Å; N353-V357 PolarHBondContact O-N 3.04Å; N353-D406 PolarHBondContact ND2-OD1 3.39Å; N353-L409 HydrophobicContact CB-CD1 4.45Å; N353-L409 VanDerWaalsContact ND2-CD1 3.32Å; N353-L409 WeakPolarHBondContact ND2-CD1 3.49Å
354	E	84.3	Confident	86	Confident	85 Å²	85	65.5 Å²	65.5	40%	0.397	37%	0.371	S	S	.	.	H	α-helix	trans	-56.8	-42.8	-176.2	-177.3	-178.8	-141.6	0	0	112.8	C352 F356 V357 N358 G400 I401	C352-E354 PolarHBondContact O-N 3.2Å; E354-F356 VanDerWaalsContact C-N 3.33Å; E354-F356 PolarHBondContact O-N 2.9Å; E354-V357 PolarHBondContact O-N 3.5Å; E354-N358 WeakPolarHBondContact O-CB 3.41Å; E354-N358 VanDerWaalsContact O-CG 3.25Å; E354-N358 PolarHBondContact O-N 3.09Å; E354-N358 PolarHBondContact O-ND2 3.12Å; E354-G400 WeakPolarHBondContact OE2-CA 3.25Å; E354-I401 PolarHBondContact OE2-N 3.23Å
355	Y	85.9	Confident	86.4	Confident	5 Å²	5	61.8 Å²	61.8	2%	0.02	35%	0.349	C	S	.	.	H	α-helix	trans	-66.6	-35.4	178.1	-175.6	-86.1	0	0	0	111.7	L310 N312 R313 N353 N359 Y411	L310-Y355 HydrophobicContact CB-CE1 4.44Å; L310-Y355 HydrophobicContact CD2-CD1 3.74Å; L310-Y355 HydrophobicContact CD2-CE1 3.84Å; L310-Y355 HydrophobicContact CG-CD1 4.13Å; L310-Y355 HydrophobicContact CG-CE1 3.8Å; L310-Y355 WeakPolarHBondContact O-CE1 3.28Å; L310-Y355 PolarHBondContact O-OH 3.47Å; N312-Y355 PolarHBondContact N-OH 3.27Å; N312-Y355 PolarHBondContact OD1-OH 2.76Å; R313-Y355 HydrophobicContact CG-CE1 4.21Å; N353-Y355 VanDerWaalsContact C-N 3.34Å; N353-Y355 PolarHBondContact O-N 2.93Å; N353-Y355 WeakPolarHBondContact OD1-CA 3.25Å; N353-Y355 VanDerWaalsContact OD1-CB 3.31Å; N353-Y355 WeakPolarHBondContact OD1-CB 3.49Å; N353-Y355 PolarHBondContact OD1-N 3.34Å; Y355-N359 VanDerWaalsContact CD2-ND2 3.28Å; Y355-N359 WeakPolarHBondContact CD2-ND2 3.32Å; Y355-N359 HydrophobicContact CE1-CB 4.24Å; Y355-N359 VanDerWaalsContact CE2-ND2 3.29Å; Y355-N359 WeakPolarHBondContact CE2-ND2 3.4Å; Y355-N359 WeakPolarHBondContact O-CB 3.47Å; Y355-N359 PolarHBondContact O-N 2.71Å; Y355-N359 VanDerWaalsContact O-N 3.16Å; Y355-N359 PolarHBondContact O-ND2 3.33Å; Y355-Y411 WeakPolarHBondContact CD1-OH 3.21Å
356	F	87.9	Confident	86.6	Confident	2 Å²	2	60.9 Å²	60.9	1%	0.009	34%	0.34	C	S	.	.	H	α-helix	trans	-69.5	-32.9	175.3	-178.7	-99.6	0	0	0	113	L310 K325 L338 W339 F342 N353 E354	L310-F356 HydrophobicContact CD1-CD2 3.82Å; L310-F356 HydrophobicContact CD1-CE2 4.34Å; L310-F356 HydrophobicContact CD2-CB 4.26Å; L310-F356 HydrophobicContact CD2-CD2 3.83Å; L310-F356 HydrophobicContact CG-CD2 4.5Å; K325-F356 HydrophobicContact CB-CZ 4.34Å; K325-F356 HydrophobicContact CD-CE1 4.18Å; K325-F356 HydrophobicContact CD-CZ 4.01Å; K325-F356 WeakPolarHBondContact CE-O 3.49Å; K325-F356 HydrophobicContact CG-CE1 4.42Å; K325-F356 HydrophobicContact CG-CE2 4.29Å; K325-F356 HydrophobicContact CG-CZ 3.8Å; K325-F356 PolarHBondContact NZ-O 3.4Å; L338-F356 HydrophobicContact CG-CE2 4.42Å; W339-F356 HydrophobicContact CD2-CE1 4.38Å; W339-F356 AromaticContact CE3-CE1 3.84Å; W339-F356 HydrophobicContact CE3-CE1 3.84Å; W339-F356 HydrophobicContact CE3-CZ 4.3Å; W339-F356 HydrophobicContact CZ3-CE1 4.17Å; F342-F356 HydrophobicContact CB-CB 3.93Å; F342-F356 HydrophobicContact CB-CD1 3.79Å; F342-F356 HydrophobicContact CB-CD2 3.79Å; F342-F356 HydrophobicContact CB-CE1 4.2Å; F342-F356 HydrophobicContact CB-CE2 4.21Å; F342-F356 HydrophobicContact CB-CG 3.56Å; F342-F356 HydrophobicContact CB-CZ 4.4Å; F342-F356 HydrophobicContact CD1-CB 4Å; F342-F356 HydrophobicContact CD1-CD2 4.15Å; F342-F356 HydrophobicContact CD1-CG 4.25Å; F342-F356 AromaticContact CD2-CD2 3.73Å; F342-F356 HydrophobicContact CD2-CD2 3.73Å; F342-F356 AromaticContact CD2-CE2 3.87Å; F342-F356 HydrophobicContact CD2-CE2 3.87Å; F342-F356 HydrophobicContact CD2-CG 4.39Å; F342-F356 HydrophobicContact CE2-CD2 4.37Å; F342-F356 HydrophobicContact CG-CB 4.07Å; F342-F356 AromaticContact CG-CD2 3.61Å; F342-F356 HydrophobicContact CG-CD2 3.61Å; F342-F356 HydrophobicContact CG-CE2 4.14Å; F342-F356 AromaticContact CG-CG 3.82Å; F342-F356 HydrophobicContact CG-CG 3.82Å; N353-F356 HydrophobicContact CB-CB 4.21Å; N353-F356 WeakPolarHBondContact O-CB 3.24Å; N353-F356 PolarHBondContact O-N 3.12Å; N353-F356 PolarHBondContact OD1-N 2.64Å; E354-F356 VanDerWaalsContact C-N 3.33Å; E354-F356 PolarHBondContact O-N 2.9Å
357	V	87.2	Confident	87.2	Confident	88 Å²	88	58 Å²	58	53%	0.533	32%	0.321	S	S	.	.	H	α-helix	trans	-69.7	-50.1	173.3	177.2	0	0	0	0	110.3	K325 C352 N353 E354 N359	K325-V357 PolarHBondContact NZ-O 2.95Å; C352-V357 HydrophobicContact CB-CG2 3.76Å; N353-V357 PolarHBondContact O-N 3.04Å; E354-V357 PolarHBondContact O-N 3.5Å; V357-N359 PolarHBondContact O-N 2.99Å
358	N	88.8	Confident	87.5	Confident	77 Å²	77	53.4 Å²	53.4	41%	0.412	30%	0.303	S	S	.	.	H	α-helix	trans	-72.7	-22.8	-170	-67.4	-14.5	0	0	0	114.9	E354 V398	E354-N358 WeakPolarHBondContact O-CB 3.41Å; E354-N358 VanDerWaalsContact O-CG 3.25Å; E354-N358 PolarHBondContact O-N 3.09Å; E354-N358 PolarHBondContact O-ND2 3.12Å; N358-V398 HydrophobicContact CB-CB 4.38Å; N358-V398 HydrophobicContact CB-CG1 4.42Å
359	N	88.4	Confident	88	Confident	5 Å²	5	48.9 Å²	48.9	3%	0.027	28%	0.279	C	S	.	.	S	Bend	trans	-111.8	143.1	-174.6	-65.8	-81.9	0	0	0	112.8	L310 K325 Y355 V357 S397 V398	L310-N359 HydrophobicContact CD1-CB 4.43Å; L310-N359 HydrophobicContact CG-CB 4.48Å; K325-N359 VanDerWaalsContact CE-O 3.3Å; K325-N359 WeakPolarHBondContact CE-O 3.17Å; K325-N359 PolarHBondContact NZ-O 2.93Å; Y355-N359 VanDerWaalsContact CD2-ND2 3.28Å; Y355-N359 WeakPolarHBondContact CD2-ND2 3.32Å; Y355-N359 HydrophobicContact CE1-CB 4.24Å; Y355-N359 VanDerWaalsContact CE2-ND2 3.29Å; Y355-N359 WeakPolarHBondContact CE2-ND2 3.4Å; Y355-N359 WeakPolarHBondContact O-CB 3.47Å; Y355-N359 PolarHBondContact O-N 2.71Å; Y355-N359 VanDerWaalsContact O-N 3.16Å; Y355-N359 PolarHBondContact O-ND2 3.33Å; V357-N359 PolarHBondContact O-N 2.99Å; N359-S397 VanDerWaalsContact OD1-CA 3.3Å; N359-S397 WeakPolarHBondContact OD1-CA 3.39Å; N359-V398 PolarHBondContact ND2-O 3.34Å; N359-V398 PolarHBondContact OD1-N 3.48Å
360	N	90.7	Very high	88.4	Confident	126 Å²	126	47.2 Å²	47.2	67%	0.674	26%	0.261	S	S	*	.			trans	-80.6	154	175.6	-74.1	-22	0	0	0	111.8	G311	G311-N360 PolarHBondContact N-O 3.17Å
361	L	89.6	Confident	88.6	Confident	31 Å²	31	50.3 Å²	50.3	16%	0.162	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	136.5	167.4	-70.8	169.3	0	0	0	109.4	M309 L310 L315 L324 K325 L338	M309-L361 CarbonylContact O-C 3.42Å; M309-L361 VanDerWaalsContact O-CA 3.32Å; M309-L361 WeakPolarHBondContact O-CA 3.11Å; L310-L361 HydrophobicContact CB-CD2 3.93Å; L310-L361 HydrophobicContact CD1-CD2 3.63Å; L310-L361 HydrophobicContact CD1-CG 4.06Å; L310-L361 HydrophobicContact CG-CD2 4.38Å; L315-L361 HydrophobicContact CD1-CD2 3.73Å; L324-L361 VanDerWaalsContact C-CD1 3.5Å; K325-L361 HydrophobicContact CG-CD1 3.61Å; K325-L361 HydrophobicContact CG-CG 4.21Å; L338-L361 HydrophobicContact CD2-CD1 3.5Å; L338-L361 VanDerWaalsContact CD2-CD1 3.5Å; L338-L361 HydrophobicContact CD2-CD2 4.03Å; L338-L361 HydrophobicContact CD2-CG 4.45Å
362	T	90.5	Very high	88.6	Confident	53 Å²	53	48 Å²	48	33%	0.325	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	152	172.9	56.8	0	0	0	0	109.8	M309	M309-T362 PolarHBondContact N-O 2.73Å; M309-T362 PolarHBondContact O-N 3.22Å
363	L	90.6	Very high	88.7	Confident	109 Å²	109	47.9 Å²	47.9	57%	0.571	28%	0.282	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119	120.8	-179.9	-178.9	157	0	0	0	107.2	P306 V307 C323	P306-L363 HydrophobicContact CB-CD1 3.99Å; P306-L363 HydrophobicContact CB-CD2 3.48Å; P306-L363 VanDerWaalsContact CB-CD2 3.48Å; P306-L363 HydrophobicContact CB-CG 3.75Å; V307-L363 WeakPolarHBondContact O-CA 3.37Å; C323-L363 HydrophobicContact CB-CD1 4.42Å
364	I	91.7	Very high	88.9	Confident	33 Å²	33	46.4 Å²	46.4	17%	0.169	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	155.1	-176.1	66.8	173.4	0	0	0	110.5	P306 V307 M309 G366 L395 E478 V480	P306-I364 WeakPolarHBondContact CA-O 3.4Å; V307-I364 HydrophobicContact CB-CG1 3.99Å; V307-I364 HydrophobicContact CG1-CG1 4.45Å; V307-I364 PolarHBondContact N-O 3.49Å; V307-I364 PolarHBondContact O-N 2.96Å; M309-I364 HydrophobicContact CG-CD1 3.73Å; M309-I364 HydrophobicContact CG-CG1 3.92Å; M309-I364 HydrophobicContact CG-CG2 4.37Å; M309-I364 HydrophobicContact SD-CD1 4Å; I364-G366 PolarHBondContact O-N 2.97Å; I364-L395 HydrophobicContact CG2-CD1 4.44Å; I364-E478 HydrophobicContact CD1-CG 4.24Å; I364-V480 HydrophobicContact CD1-CG2 3.95Å
365	Q	91.2	Very high	89.3	Confident	63 Å²	63	45.6 Å²	45.6	29%	0.294	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	122.6	176.4	-154.9	64.9	14.7	0	0	110.5	P303 D304 I367 P368	P303-Q365 PolarHBondContact O-NE2 2.71Å; D304-Q365 PolarHBondContact OD1-NE2 2.44Å; Q365-I367 WeakPolarHBondContact CG-O 3.36Å; Q365-P368 HydrophobicContact CB-CB 4.33Å
366	G	89.6	Confident	89.5	Confident	0 Å²	0	48.9 Å²	48.9	0%	0	30%	0.295	C	S	.	.	S	Bend	trans	-72.2	-30.7	175.2	0	0	0	0	0	113.3	F305 I364 E478	F305-G366 WeakPolarHBondContact O-CA 3.48Å; F305-G366 PolarHBondContact O-N 3.47Å; I364-G366 PolarHBondContact O-N 2.97Å; G366-E478 WeakPolarHBondContact O-CB 3.26Å; G366-E478 PolarHBondContact O-N 3.41Å
367	I	92.3	Very high	89.5	Confident	0 Å²	0	51.3 Å²	51.3	0%	0	31%	0.306	C	S	.	.			trans	-126	86	173.6	-57.2	179.4	0	0	0	108.4	P303 F305 Q365 G369 C476 I477 L481 T498 L499	P303-I367 HydrophobicContact CG-CB 4.05Å; P303-I367 HydrophobicContact CG-CD1 3.89Å; P303-I367 HydrophobicContact CG-CG2 3.85Å; F305-I367 HydrophobicContact CD2-CD1 4.45Å; Q365-I367 WeakPolarHBondContact CG-O 3.36Å; I367-G369 PolarHBondContact O-N 3.41Å; I367-C476 WeakPolarHBondContact CG2-O 3.29Å; I367-I477 HydrophobicContact CG1-CG1 4.49Å; I367-L481 HydrophobicContact CG1-CD2 4.48Å; I367-T498 VanDerWaalsContact CD1-C 3.44Å; I367-T498 WeakPolarHBondContact CD1-O 3.39Å; I367-T498 WeakPolarHBondContact CD1-OG1 3.35Å; I367-L499 HydrophobicContact CD1-CB 4.05Å; I367-L499 HydrophobicContact CD1-CD1 4.43Å; I367-L499 HydrophobicContact CG2-CD1 4.02Å
368	P	90.6	Very high	89.9	Confident	34 Å²	34	47.7 Å²	47.7	22%	0.221	28%	0.284	C	S	.	.			trans	-74.5	-9.2	174.9	29.3	-32.1	0	0	0	112.8	Q365 V374	Q365-P368 HydrophobicContact CB-CB 4.33Å; P368-V374 HydrophobicContact CG-CB 4.41Å; P368-V374 HydrophobicContact CG-CG2 3.6Å
369	G	89.6	Confident	90.1	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.01	28%	0.277	C	S	.	.			trans	85.8	168	170.3	0	0	0	0	0	114.6	S298 I367 A371 S372 C476	S298-G369 WeakPolarHBondContact O-CA 3.42Å; I367-G369 PolarHBondContact O-N 3.41Å; G369-A371 PolarHBondContact O-N 2.66Å; G369-A371 VanDerWaalsContact O-N 3.11Å; G369-S372 VanDerWaalsContact O-CB 3.29Å; G369-S372 WeakPolarHBondContact O-CB 3.13Å; G369-S372 PolarHBondContact O-N 3.32Å; G369-S372 VanDerWaalsContact O-N 3.09Å; G369-S372 PolarHBondContact O-OG 3.27Å; G369-C476 PolarHBondContact N-O 3.43Å
370	L	89.5	Confident	90.3	Very high	78 Å²	78	55.4 Å²	55.4	41%	0.408	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-26.2	-168.6	-171.4	63.7	0	0	0	114.2	S298 S372 A475	S298-L370 PolarHBondContact O-N 3.13Å; L370-S372 VanDerWaalsContact C-N 3.35Å; L370-A475 HydrophobicContact CD1-CB 3.77Å
371	A	88	Confident	90.4	Very high	89 Å²	89	51.4 Å²	51.4	74%	0.736	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-7	-179.5	0	0	0	0	0	114.4	G369	G369-A371 PolarHBondContact O-N 2.66Å; G369-A371 VanDerWaalsContact O-N 3.11Å
372	S	84.6	Confident	90.4	Very high	52 Å²	52	51.5 Å²	51.5	36%	0.364	30%	0.297	S	S	.	.	S	Bend	trans	-77.4	-19.7	-169.2	63.6	0	0	0	0	116.1	G369 L370 V374	G369-S372 VanDerWaalsContact O-CB 3.29Å; G369-S372 WeakPolarHBondContact O-CB 3.13Å; G369-S372 PolarHBondContact O-N 3.32Å; G369-S372 VanDerWaalsContact O-N 3.09Å; G369-S372 PolarHBondContact O-OG 3.27Å; L370-S372 VanDerWaalsContact C-N 3.35Å; S372-V374 WeakPolarHBondContact OG-CG2 3.35Å
373	G	86.3	Confident	90.5	Very high	37 Å²	37	52.2 Å²	52.2	38%	0.381	30%	0.295	S	S	.	.			trans	82.6	3.5	-176.7	0	0	0	0	0	115.8	I375 S376	G373-I375 PolarHBondContact O-N 2.64Å; G373-S376 PolarHBondContact O-N 3.14Å; G373-S376 VanDerWaalsContact O-N 3.16Å; G373-S376 PolarHBondContact O-OG 2.86Å
374	V	89.9	Confident	90.4	Very high	6 Å²	6	47.5 Å²	47.5	4%	0.036	27%	0.272	C	S	.	.	G	3₁₀ helix	trans	-58.2	-21.1	179.7	166	0	0	0	0	113.8	P368 S372 S376 E377 N378	P368-V374 HydrophobicContact CG-CB 4.41Å; P368-V374 HydrophobicContact CG-CG2 3.6Å; S372-V374 WeakPolarHBondContact OG-CG2 3.35Å; V374-S376 PolarHBondContact O-N 2.4Å; V374-E377 WeakPolarHBondContact O-CB 3.43Å; V374-E377 PolarHBondContact O-N 2.84Å; V374-N378 PolarHBondContact O-N 3.37Å
375	I	92.7	Very high	90.3	Very high	69 Å²	69	50.1 Å²	50.1	35%	0.354	29%	0.291	S	S	.	.	G	3₁₀ helix	trans	-46.8	-38.1	171.5	-164.4	177.3	0	0	0	113.1	I150 G373 E377 N378 M379 G474 A475	I150-I375 HydrophobicContact CD1-CG1 3.62Å; G373-I375 PolarHBondContact O-N 2.64Å; I375-E377 PolarHBondContact O-N 3.41Å; I375-N378 PolarHBondContact O-N 3.09Å; I375-M379 VanDerWaalsContact O-CG 3.3Å; I375-M379 WeakPolarHBondContact O-CG 3.38Å; I375-M379 PolarHBondContact O-N 2.86Å; I375-G474 WeakPolarHBondContact CA-O 3.04Å; I375-A475 HydrophobicContact CB-CB 3.96Å; I375-A475 HydrophobicContact CD1-CB 4.1Å; I375-A475 HydrophobicContact CG1-CB 4.08Å
376	S	90.6	Very high	90	Very high	73 Å²	73	52.7 Å²	52.7	51%	0.51	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-64.7	-23.8	-179	60.8	0	0	0	0	114	G373 V374	G373-S376 PolarHBondContact O-N 3.14Å; G373-S376 VanDerWaalsContact O-N 3.16Å; G373-S376 PolarHBondContact O-OG 2.86Å; V374-S376 PolarHBondContact O-N 2.4Å
377	E	87.8	Confident	89.6	Confident	53 Å²	53	53.5 Å²	53.5	25%	0.248	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-40.3	-175.9	-46.6	-171.8	-141.8	0	0	110.9	V374 I375 M379 R394	V374-E377 WeakPolarHBondContact O-CB 3.43Å; V374-E377 PolarHBondContact O-N 2.84Å; I375-E377 PolarHBondContact O-N 3.41Å; E377-M379 PolarHBondContact O-N 3.22Å; E377-R394 VanDerWaalsContact CD-NE 3.26Å; E377-R394 IonicContact OE1-CZ 3.43Å; E377-R394 IonicContact OE1-NE 2.7Å; E377-R394 PolarHBondContact OE1-NE 3.42Å; E377-R394 IonicContact OE1-NH1 2.87Å; E377-R394 PolarHBondContact OE1-NH1 2.8Å; E377-R394 VanDerWaalsContact OE1-NH1 3.13Å; E377-R394 IonicContact OE1-NH2 3.13Å; E377-R394 PolarHBondContact OE1-NH2 2.87Å; E377-R394 WeakPolarHBondContact OE2-CD 3.41Å; E377-R394 IonicContact OE2-CZ 2.69Å; E377-R394 IonicContact OE2-NE 2.76Å; E377-R394 PolarHBondContact OE2-NE 3.33Å; E377-R394 IonicContact OE2-NH1 3.07Å; E377-R394 IonicContact OE2-NH2 3.85Å; E377-R394 PolarHBondContact OE2-NH2 3.32Å
378	N	94.1	Very high	89.4	Confident	12 Å²	12	57.4 Å²	57.4	6%	0.064	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-80	7.4	178.7	-66.9	-31.3	0	0	0	113.3	G149 I150 V374 I375 W380 G474 I477 G479 L482	G149-N378 CarbonylContact C-O 3.57Å; G149-N378 WeakPolarHBondContact CA-O 3.48Å; I150-N378 HydrophobicContact CD1-CB 4Å; I150-N378 HydrophobicContact CG1-CB 4.4Å; I150-N378 WeakPolarHBondContact CG1-O 3.16Å; I150-N378 PolarHBondContact N-O 3.25Å; V374-N378 PolarHBondContact O-N 3.37Å; I375-N378 PolarHBondContact O-N 3.09Å; N378-W380 VanDerWaalsContact C-N 3.32Å; N378-W380 PolarHBondContact O-N 3.11Å; N378-G474 PolarHBondContact ND2-O 3.4Å; N378-I477 PolarHBondContact ND2-O 3.19Å; N378-G479 WeakPolarHBondContact OD1-CA 3.43Å; N378-L482 WeakPolarHBondContact ND2-CD1 3.24Å
379	M	92.9	Very high	89.2	Confident	55 Å²	55	56.9 Å²	56.9	27%	0.271	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-30.7	179.2	-72.4	-57.3	-73.9	0	0	113.9	I150 L151 I375 E377	I150-M379 HydrophobicContact CB-SD 4.33Å; I150-M379 HydrophobicContact CD1-SD 4.02Å; L151-M379 HydrophobicContact CD1-CE 3.9Å; L151-M379 HydrophobicContact CD2-CE 3.71Å; L151-M379 HydrophobicContact CG-CE 3.65Å; I375-M379 VanDerWaalsContact O-CG 3.3Å; I375-M379 WeakPolarHBondContact O-CG 3.38Å; I375-M379 PolarHBondContact O-N 2.86Å; E377-M379 PolarHBondContact O-N 3.22Å
380	W	93.3	Very high	89.1	Confident	189 Å²	189	57 Å²	57	72%	0.716	33%	0.33	S	S	*	.	S	Bend	trans	-112.5	155	-166.9	-58.3	103.9	0	0	0	112.8	N378	N378-W380 VanDerWaalsContact C-N 3.32Å; N378-W380 PolarHBondContact O-N 3.11Å
381	S	93.5	Very high	89.1	Confident	43 Å²	43	56.2 Å²	56.2	30%	0.301	32%	0.324	S	S	.	.			trans	-73.1	151.4	179.3	44.7	0	0	0	0	113.9	A148 E152	A148-S381 WeakPolarHBondContact O-CA 3.35Å; A148-S381 WeakPolarHBondContact O-CB 3.13Å; A148-S381 PolarHBondContact O-N 3.28Å; E152-S381 WeakPolarHBondContact OE1-CB 3.17Å; E152-S381 PolarHBondContact OE1-OG 2.79Å
382	A	90.1	Very high	89.1	Confident	32 Å²	32	52.7 Å²	52.7	26%	0.264	29%	0.293	S	S	.	.			trans	-135.5	48.9	-178.2	0	0	0	0	0	110.6	T147	T147-A382 CarbonylContact O-C 3.59Å; T147-A382 PolarHBondContact O-N 2.65Å
383	Y	92.4	Very high	88.9	Confident	68 Å²	68	59.8 Å²	59.8	27%	0.267	32%	0.317	S	S	.	.			trans	-61.7	144.2	176.3	-64.2	-59.4	0	0	0	112.5	E152 F420 L423	E152-Y383 WeakPolarHBondContact OE2-CE2 3.31Å; E152-Y383 VanDerWaalsContact OE2-CZ 3.27Å; E152-Y383 PolarHBondContact OE2-OH 3.1Å; Y383-F420 WeakPolarHBondContact OH-CA 3.41Å; Y383-L423 HydrophobicContact CE1-CD1 3.74Å
384	G	87.7	Confident	88.7	Confident	10 Å²	10	66 Å²	66	10%	0.103	33%	0.329	C	S	.	.			trans	-158.8	159.5	-177.4	0	0	0	0	0	114.2	M388 S417 T418	G384-M388 VanDerWaalsContact CA-SD 3.6Å; G384-S417 WeakPolarHBondContact O-CA 3.32Å; G384-T418 PolarHBondContact N-OG1 3.3Å; G384-T418 VanDerWaalsContact N-OG1 3.12Å; G384-T418 PolarHBondContact O-N 3.49Å; G384-T418 PolarHBondContact O-OG1 3.48Å
385	P	89.2	Confident	88.4	Confident	88 Å²	88	67.6 Å²	67.6	57%	0.571	34%	0.337	S	S	*	.			trans	-69.7	165.9	172.3	31.5	-35.6	0	0	0	112	G387 M388	P385-G387 PolarHBondContact O-N 3.34Å; P385-M388 HydrophobicContact CG-CB 4.27Å; P385-M388 WeakPolarHBondContact O-CB 3.42Å; P385-M388 PolarHBondContact O-N 3.06Å
386	L	85	Confident	87.8	Confident	117 Å²	117	69.7 Å²	69.7	61%	0.613	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	134.1	167.4	174.8	66.8	0	0	0	110.3	M388 D415	L386-M388 VanDerWaalsContact C-N 3.31Å; L386-M388 PolarHBondContact O-N 2.99Å; L386-D415 WeakPolarHBondContact CD1-O 3.46Å
387	G	81.8	Confident	87.4	Confident	17 Å²	17	68.8 Å²	68.8	18%	0.175	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.6	2.5	178.8	0	0	0	0	0	115.5	P385 L389 N414	P385-G387 PolarHBondContact O-N 3.34Å; G387-L389 PolarHBondContact O-N 3.23Å; G387-N414 PolarHBondContact N-O 3.13Å
388	M	87.2	Confident	87	Confident	82 Å²	82	70.3 Å²	70.3	40%	0.404	36%	0.362	S	S	.	.			trans	-63.4	130.2	173.9	-179.6	175.9	176.2	0	0	111.1	G384 P385 L386 V413 N414	G384-M388 VanDerWaalsContact CA-SD 3.6Å; P385-M388 HydrophobicContact CG-CB 4.27Å; P385-M388 WeakPolarHBondContact O-CB 3.42Å; P385-M388 PolarHBondContact O-N 3.06Å; L386-M388 VanDerWaalsContact C-N 3.31Å; L386-M388 PolarHBondContact O-N 2.99Å; M388-V413 CarbonylContact O-C 3.6Å; M388-V413 VanDerWaalsContact O-CA 3.32Å; M388-V413 WeakPolarHBondContact O-CA 3.32Å; M388-N414 HydrophobicContact CB-CB 4.39Å; M388-N414 PolarHBondContact O-N 3.46Å
389	L	87	Confident	85.7	Confident	23 Å²	23	72.7 Å²	72.7	12%	0.12	39%	0.389	C	S	.	.	B	Isolated β-bridge	trans	-66.5	138.9	177.2	-68	162	0	0	0	111.7	G387 E391 Y411 V413	G387-L389 PolarHBondContact O-N 3.23Å; L389-E391 HydrophobicContact CB-CG 4.38Å; L389-E391 PolarHBondContact O-N 3.17Å; L389-Y411 HydrophobicContact CD2-CD2 3.81Å; L389-Y411 HydrophobicContact CD2-CG 3.7Å; L389-V413 HydrophobicContact CD2-CG1 3.78Å; L389-V413 HydrophobicContact CG-CG1 4.42Å
390	V	88.7	Confident	84.2	Confident	3 Å²	3	71.5 Å²	71.5	2%	0.018	39%	0.391	C	S	.	.			trans	-80.4	111.6	173.7	-179.5	0	0	0	0	109.2	T314 V412 V480 R483	T314-V390 PolarHBondContact N-O 2.94Å; T314-V390 PolarHBondContact OG1-O 2.9Å; V390-V412 HydrophobicContact CB-CB 4.33Å; V390-V412 HydrophobicContact CB-CG1 4.29Å; V390-V412 HydrophobicContact CG2-CB 4.35Å; V390-V412 HydrophobicContact CG2-CG1 3.85Å; V390-V412 PolarHBondContact N-O 3.1Å; V390-V480 HydrophobicContact CG1-CB 3.99Å; V390-V480 HydrophobicContact CG1-CG1 4.06Å; V390-R483 HydrophobicContact CG1-CB 4.12Å; V390-R483 HydrophobicContact CG2-CB 4.39Å
391	E	88.6	Confident	82.2	Confident	63 Å²	63	69.5 Å²	69.5	29%	0.294	39%	0.393	S	S	.	.	B	Isolated β-bridge	trans	-118.5	147	-177.3	-61.8	-171.6	156	0	0	113.2	N312 R313 L389 R483	N312-E391 PolarHBondContact ND2-OE1 3.48Å; N312-E391 PolarHBondContact ND2-OE2 3.07Å; N312-E391 CarbonylContact O-C 3.56Å; N312-E391 WeakPolarHBondContact O-CA 3.39Å; R313-E391 HydrophobicContact CG-CG 4.07Å; R313-E391 IonicContact NE-OE1 2.67Å; L389-E391 HydrophobicContact CB-CG 4.38Å; L389-E391 PolarHBondContact O-N 3.17Å; E391-R483 PolarHBondContact O-NH1 3.43Å; E391-R483 PolarHBondContact O-NH2 3.1Å
392	N	87.3	Confident	80.3	Confident	14 Å²	14	71 Å²	71	8%	0.075	40%	0.398	C	S	.	.			trans	-100.2	116.4	168.3	-166.7	-32.5	0	0	0	110.5	M309 N312 R394 L395 E478 V480	M309-N392 HydrophobicContact CE-CB 3.85Å; N312-N392 WeakPolarHBondContact CB-O 3.5Å; N312-N392 PolarHBondContact O-N 2.82Å; N392-R394 PolarHBondContact O-N 3.42Å; N392-R394 WeakPolarHBondContact OD1-CB 3.49Å; N392-R394 PolarHBondContact OD1-N 3.44Å; N392-L395 HydrophobicContact CB-CD1 4.36Å; N392-L395 PolarHBondContact O-N 3.34Å; N392-E478 PolarHBondContact ND2-OE1 2.92Å; N392-V480 HydrophobicContact CB-CG1 3.78Å
393	K	81.8	Confident	78.9	Confident	202 Å²	202	73.6 Å²	73.6	88%	0.878	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-12.2	-176.6	-64.7	178.9	-178.9	172.9	0	114.4
394	R	80.3	Confident	77.3	Confident	167 Å²	167	73.5 Å²	73.5	63%	0.63	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-27.3	176.8	-68.8	-169.4	172.6	-161.1	-7.6	113.8	E377 N392	E377-R394 VanDerWaalsContact CD-NE 3.26Å; E377-R394 IonicContact OE1-CZ 3.43Å; E377-R394 IonicContact OE1-NE 2.7Å; E377-R394 PolarHBondContact OE1-NE 3.42Å; E377-R394 IonicContact OE1-NH1 2.87Å; E377-R394 PolarHBondContact OE1-NH1 2.8Å; E377-R394 VanDerWaalsContact OE1-NH1 3.13Å; E377-R394 IonicContact OE1-NH2 3.13Å; E377-R394 PolarHBondContact OE1-NH2 2.87Å; E377-R394 WeakPolarHBondContact OE2-CD 3.41Å; E377-R394 IonicContact OE2-CZ 2.69Å; E377-R394 IonicContact OE2-NE 2.76Å; E377-R394 PolarHBondContact OE2-NE 3.33Å; E377-R394 IonicContact OE2-NH1 3.07Å; E377-R394 IonicContact OE2-NH2 3.85Å; E377-R394 PolarHBondContact OE2-NH2 3.32Å; N392-R394 PolarHBondContact O-N 3.42Å; N392-R394 WeakPolarHBondContact OD1-CB 3.49Å; N392-R394 PolarHBondContact OD1-N 3.44Å
395	L	83.9	Confident	76	Confident	40 Å²	40	79.7 Å²	79.7	21%	0.209	45%	0.449	C	S	.	.	S	Bend	trans	-86.3	129.4	-175.4	-66.2	173.4	0	0	0	109.8	M309 G311 N312 I364 N392	M309-L395 HydrophobicContact CB-CD1 3.85Å; M309-L395 HydrophobicContact CE-CD1 4.06Å; M309-L395 HydrophobicContact CG-CD1 3.88Å; G311-L395 VanDerWaalsContact O-CB 3.31Å; G311-L395 WeakPolarHBondContact O-CB 3.49Å; G311-L395 WeakPolarHBondContact O-CD1 3.45Å; N312-L395 HydrophobicContact CB-CB 4.5Å; I364-L395 HydrophobicContact CG2-CD1 4.44Å; N392-L395 HydrophobicContact CB-CD1 4.36Å; N392-L395 PolarHBondContact O-N 3.34Å
396	P	79.9	Confident	74.9	Confident	113 Å²	113	75.9 Å²	75.9	73%	0.734	42%	0.424	S	S	*	.			trans	-68.6	141.4	176	29.4	-34.1	0	0	0	110.3
397	S	82.5	Confident	73.9	Confident	54 Å²	54	73.7 Å²	73.7	38%	0.378	41%	0.412	S	S	.	.			trans	-135.3	147.6	173.7	59.4	0	0	0	0	111.3	N312 N359	N312-S397 PolarHBondContact ND2-OG 2.75Å; N312-S397 WeakPolarHBondContact OD1-CB 3.42Å; N312-S397 PolarHBondContact OD1-OG 2.81Å; N312-S397 VanDerWaalsContact OD1-OG 3.13Å; N359-S397 VanDerWaalsContact OD1-CA 3.3Å; N359-S397 WeakPolarHBondContact OD1-CA 3.39Å
398	V	79.8	Confident	73.4	Confident	85 Å²	85	79.1 Å²	79.1	52%	0.515	43%	0.428	S	S	.	.			trans	-103.7	120.5	170.2	-177.6	0	0	0	0	107.1	N358 N359	N358-V398 HydrophobicContact CB-CB 4.38Å; N358-V398 HydrophobicContact CB-CG1 4.42Å; N359-V398 PolarHBondContact ND2-O 3.34Å; N359-V398 PolarHBondContact OD1-N 3.48Å
399	G	67.6	Low	73.1	Confident	62 Å²	62	76.9 Å²	76.9	64%	0.639	42%	0.417	S	S	*	.			trans	-66.1	148.2	-177.8	0	0	0	0	0	113.2
400	G	60.6	Low	72.9	Confident	30 Å²	30	76 Å²	76	31%	0.309	41%	0.414	S	S	.	.			trans	-106.6	168.2	167.2	0	0	0	0	0	111.4	E354	E354-G400 WeakPolarHBondContact OE2-CA 3.25Å
401	I	52.2	Low	72.9	Confident	147 Å²	147	76 Å²	76	75%	0.754	41%	0.413	S	S	*	.	S	Bend	trans	-81.9	-17.2	-162.6	-66.7	173.3	0	0	0	114.5	E354	E354-I401 PolarHBondContact OE2-N 3.23Å
402	D	53.6	Low	72.9	Confident	74 Å²	74	73.2 Å²	73.2	40%	0.396	40%	0.401	S	S	.	.			trans	-143.5	84.4	-171.5	-167.7	6.8	0	0	0	114.2	A404 K405	D402-A404 PolarHBondContact O-N 3.44Å; D402-A404 VanDerWaalsContact O-N 3.16Å; D402-K405 IonicContact OD2-NZ 2.88Å; D402-K405 PolarHBondContact OD2-NZ 3.07Å
403	P	60.3	Low	72.9	Confident	86 Å²	86	74.8 Å²	74.8	56%	0.558	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.8	-9.1	-176.5	29	-35.8	0	0	0	114.4	K405 D406	P403-K405 VanDerWaalsContact C-N 3.34Å; P403-K405 PolarHBondContact O-N 2.68Å; P403-D406 PolarHBondContact O-N 3.08Å
404	A	57.8	Low	73.1	Confident	66 Å²	66	65.6 Å²	65.6	55%	0.545	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-25.3	-175.7	0	0	0	0	0	113.6	D402	D402-A404 PolarHBondContact O-N 3.44Å; D402-A404 VanDerWaalsContact O-N 3.16Å
405	K	60.7	Low	73.1	Confident	140 Å²	140	59.7 Å²	59.7	61%	0.609	35%	0.352	S	S	*	.	S	Bend	trans	-86.9	-18.8	178	-68.6	176.8	-176.2	122.3	0	113.5	D402 P403 I407	D402-K405 IonicContact OD2-NZ 2.88Å; D402-K405 PolarHBondContact OD2-NZ 3.07Å; P403-K405 VanDerWaalsContact C-N 3.34Å; P403-K405 PolarHBondContact O-N 2.68Å; K405-I407 VanDerWaalsContact C-N 3.25Å; K405-I407 PolarHBondContact O-N 3.28Å
406	D	66	Low	73.2	Confident	8 Å²	8	59.7 Å²	59.7	4%	0.043	35%	0.352	C	S	.	.	G	3₁₀ helix	trans	-69.8	-20	-173.8	-73.4	-26.7	0	0	0	113.2	R313 N353 P403 Y408 L409 Y411	R313-D406 IonicContact CZ-OD2 2.66Å; R313-D406 IonicContact NH1-OD2 3.87Å; R313-D406 PolarHBondContact NH1-OD2 3.17Å; R313-D406 IonicContact NH2-OD2 2.76Å; R313-D406 PolarHBondContact NH2-OD2 2.78Å; R313-D406 VanDerWaalsContact NH2-OD2 3.08Å; N353-D406 PolarHBondContact ND2-OD1 3.39Å; P403-D406 PolarHBondContact O-N 3.08Å; D406-Y408 PolarHBondContact O-N 3.06Å; D406-L409 WeakPolarHBondContact O-CB 3.38Å; D406-L409 PolarHBondContact O-N 2.97Å; D406-L409 VanDerWaalsContact O-N 3.09Å; D406-Y411 HydrophobicContact CB-CD2 4.43Å; D406-Y411 HydrophobicContact CB-CE2 4Å; D406-Y411 WeakPolarHBondContact O-CD2 3.05Å
407	I	64.6	Low	73.6	Confident	71 Å²	71	57.1 Å²	57.1	36%	0.364	34%	0.337	S	S	.	.	G	3₁₀ helix	trans	-60	-29.7	-179.5	-59.3	173.4	0	0	0	112.1	K405	K405-I407 VanDerWaalsContact C-N 3.25Å; K405-I407 PolarHBondContact O-N 3.28Å
408	Y	70.8	Confident	74	Confident	131 Å²	131	55 Å²	55	51%	0.514	32%	0.321	S	S	.	.	G	3₁₀ helix	trans	-85.5	-8.1	-179.3	-55	-62.2	0	0	0	114.2	K240 E241 D406	K240-Y408 WeakPolarHBondContact CD-O 3.4Å; E241-Y408 HydrophobicContact CG-CD1 4.02Å; E241-Y408 HydrophobicContact CG-CE1 3.52Å; D406-Y408 PolarHBondContact O-N 3.06Å
409	L	80.2	Confident	74.6	Confident	35 Å²	35	55.5 Å²	55.5	18%	0.183	32%	0.317	C	S	.	.	S	Bend	trans	-80.9	165.8	175.2	-66.2	173.3	0	0	0	110.7	K240 F342 N353 D406 Y411	K240-L409 PolarHBondContact NZ-O 3.47Å; F342-L409 HydrophobicContact CD1-CD1 3.97Å; F342-L409 HydrophobicContact CD1-CD2 4.23Å; F342-L409 HydrophobicContact CE1-CB 3.9Å; F342-L409 HydrophobicContact CE1-CD1 3.85Å; F342-L409 HydrophobicContact CE1-CD2 4.36Å; F342-L409 HydrophobicContact CE1-CG 4.26Å; F342-L409 HydrophobicContact CZ-CB 4.44Å; N353-L409 HydrophobicContact CB-CD1 4.45Å; N353-L409 VanDerWaalsContact ND2-CD1 3.32Å; N353-L409 WeakPolarHBondContact ND2-CD1 3.49Å; D406-L409 WeakPolarHBondContact O-CB 3.38Å; D406-L409 PolarHBondContact O-N 2.97Å; D406-L409 VanDerWaalsContact O-N 3.09Å; L409-Y411 HydrophobicContact CB-CD2 3.85Å; L409-Y411 HydrophobicContact CB-CE2 3.75Å; L409-Y411 HydrophobicContact CD1-CE2 4.1Å; L409-Y411 PolarHBondContact O-N 2.86Å
410	P	83.9	Confident	75.7	Confident	6 Å²	6	55.8 Å²	55.8	4%	0.039	30%	0.301	C	S	.	.	S	Bend	trans	-76.4	49	-174.2	34.4	-41	0	0	0	113.9	L315 Q316 L341 F342	L315-P410 WeakPolarHBondContact CA-O 3.35Å; Q316-P410 PolarHBondContact N-O 3.09Å; L341-P410 HydrophobicContact CB-CG 3.96Å; L341-P410 HydrophobicContact CD1-CG 4.04Å; F342-P410 HydrophobicContact CE2-CG 3.65Å; F342-P410 HydrophobicContact CZ-CG 3.71Å
411	Y	88.3	Confident	77.1	Confident	1 Å²	1	56.3 Å²	56.3	0%	0.004	30%	0.298	C	S	.	.	B	Isolated β-bridge	trans	-89.9	156.8	168.4	-59.3	-68.5	0	0	0	111.7	L310 R313 T314 L315 F342 Y355 L389 D406 L409	L310-Y411 HydrophobicContact CD2-CE1 4.03Å; L310-Y411 WeakPolarHBondContact CD2-OH 3.49Å; R313-Y411 HydrophobicContact CB-CD1 3.84Å; R313-Y411 HydrophobicContact CB-CE1 3.78Å; R313-Y411 HydrophobicContact CG-CE1 4.45Å; R313-Y411 PolarHBondContact NH1-OH 3.2Å; T314-Y411 WeakPolarHBondContact O-CA 3.46Å; L315-Y411 HydrophobicContact CD2-CD1 3.65Å; L315-Y411 HydrophobicContact CD2-CE1 3.73Å; F342-Y411 HydrophobicContact CE1-CE1 4.3Å; F342-Y411 HydrophobicContact CE1-CE2 4.02Å; F342-Y411 AromaticContact CE1-CZ 3.69Å; F342-Y411 HydrophobicContact CZ-CE1 4.2Å; F342-Y411 HydrophobicContact CZ-CE2 4.49Å; Y355-Y411 WeakPolarHBondContact CD1-OH 3.21Å; L389-Y411 HydrophobicContact CD2-CD2 3.81Å; L389-Y411 HydrophobicContact CD2-CG 3.7Å; D406-Y411 HydrophobicContact CB-CD2 4.43Å; D406-Y411 HydrophobicContact CB-CE2 4Å; D406-Y411 WeakPolarHBondContact O-CD2 3.05Å; L409-Y411 HydrophobicContact CB-CD2 3.85Å; L409-Y411 HydrophobicContact CB-CE2 3.75Å; L409-Y411 HydrophobicContact CD1-CE2 4.1Å; L409-Y411 PolarHBondContact O-N 2.86Å
412	V	87.9	Confident	78.8	Confident	6 Å²	6	51.3 Å²	51.3	4%	0.036	27%	0.272	C	S	.	.			trans	-82.8	130.6	169.4	-175.6	0	0	0	0	109.3	T314 Q316 V390 D484 D488	T314-V412 HydrophobicContact CG2-CB 4.38Å; T314-V412 HydrophobicContact CG2-CG2 3.92Å; T314-V412 PolarHBondContact O-N 2.78Å; Q316-V412 HydrophobicContact CG-CG2 3.91Å; V390-V412 HydrophobicContact CB-CB 4.33Å; V390-V412 HydrophobicContact CB-CG1 4.29Å; V390-V412 HydrophobicContact CG2-CB 4.35Å; V390-V412 HydrophobicContact CG2-CG1 3.85Å; V390-V412 PolarHBondContact N-O 3.1Å; V412-D484 HydrophobicContact CG1-CB 4.24Å; V412-D488 HydrophobicContact CG2-CB 4.4Å
413	V	87.3	Confident	80.6	Confident	46 Å²	46	47.8 Å²	47.8	28%	0.279	25%	0.253	S	S	.	.	B	Isolated β-bridge	trans	-130.8	155	-176.2	-68.3	0	0	0	0	111.8	M388 L389 D415	M388-V413 CarbonylContact O-C 3.6Å; M388-V413 VanDerWaalsContact O-CA 3.32Å; M388-V413 WeakPolarHBondContact O-CA 3.32Å; L389-V413 HydrophobicContact CD2-CG1 3.78Å; L389-V413 HydrophobicContact CG-CG1 4.42Å; V413-D415 PolarHBondContact O-N 3.32Å
414	N	86.3	Confident	82.2	Confident	10 Å²	10	43.8 Å²	43.8	5%	0.053	23%	0.228	C	C	.	.			trans	-67	117.5	172.2	-76	-5.9	0	0	0	111.2	G387 M388 I416	G387-N414 PolarHBondContact N-O 3.13Å; M388-N414 HydrophobicContact CB-CB 4.39Å; M388-N414 PolarHBondContact O-N 3.46Å; N414-I416 VanDerWaalsContact C-N 3.33Å; N414-I416 PolarHBondContact O-N 3.24Å
415	D	80.4	Confident	83.7	Confident	43 Å²	43	40.7 Å²	40.7	23%	0.23	20%	0.202	C	C	.	.	S	Bend	trans	-70.3	-22.4	179.6	-175.7	42.4	0	0	0	114	L386 V413 K485 F486	L386-D415 WeakPolarHBondContact CD1-O 3.46Å; V413-D415 PolarHBondContact O-N 3.32Å; D415-K485 HydrophobicContact CB-CD 4.38Å; D415-K485 IonicContact OD2-NZ 2.75Å; D415-K485 PolarHBondContact OD2-NZ 3.39Å; D415-F486 HydrophobicContact CB-CE2 4.46Å
416	I	87.3	Confident	85.2	Confident	39 Å²	39	34 Å²	34	20%	0.2	17%	0.173	C	C	.	.	S	Bend	trans	-143.3	159.2	174.1	58.5	176.5	0	0	0	111.2	W143 N414 T418 L422 I426 D575	W143-I416 HydrophobicContact CH2-CD1 3.79Å; W143-I416 HydrophobicContact CH2-CG1 4.01Å; W143-I416 HydrophobicContact CZ2-CD1 4.34Å; W143-I416 HydrophobicContact CZ2-CG1 4.07Å; N414-I416 VanDerWaalsContact C-N 3.33Å; N414-I416 PolarHBondContact O-N 3.24Å; I416-T418 HydrophobicContact CG1-CG2 4.44Å; I416-L422 HydrophobicContact CD1-CD2 4.09Å; I416-I426 HydrophobicContact CD1-CD1 4.18Å; I416-D575 HydrophobicContact CD1-CB 4.22Å
417	S	88.3	Confident	86.5	Confident	60 Å²	60	33.7 Å²	33.7	42%	0.42	17%	0.171	S	C	.	.			trans	-70.1	127.3	169.3	50.8	0	0	0	0	110.7	G384	G384-S417 WeakPolarHBondContact O-CA 3.32Å
418	T	90.6	Very high	87.8	Confident	9 Å²	9	30.4 Å²	30.4	6%	0.055	15%	0.154	C	C	.	.			trans	-108.8	136.6	-174.5	54.9	0	0	0	0	112.2	W143 T147 G384 I416	W143-T418 HydrophobicContact CH2-CG2 3.66Å; W143-T418 HydrophobicContact CZ2-CG2 3.44Å; W143-T418 VanDerWaalsContact CZ2-CG2 3.44Å; T147-T418 HydrophobicContact CG2-CG2 4.3Å; G384-T418 PolarHBondContact N-OG1 3.3Å; G384-T418 VanDerWaalsContact N-OG1 3.12Å; G384-T418 PolarHBondContact O-N 3.49Å; G384-T418 PolarHBondContact O-OG1 3.48Å; I416-T418 HydrophobicContact CG1-CG2 4.44Å
419	F	91.2	Very high	88.9	Confident	96 Å²	96	24.3 Å²	24.3	42%	0.421	13%	0.131	S	C	.	.			trans	-156.8	154.5	172.6	49.5	-86	0	0	0	109.2	T421 L422 L423	F419-T421 VanDerWaalsContact C-N 3.29Å; F419-T421 VanDerWaalsContact CD2-OG1 3.3Å; F419-T421 WeakPolarHBondContact CD2-OG1 3.46Å; F419-T421 VanDerWaalsContact CE2-OG1 3.24Å; F419-T421 WeakPolarHBondContact CE2-OG1 3.41Å; F419-T421 PolarHBondContact O-N 3.31Å; F419-T421 VanDerWaalsContact O-N 3.11Å; F419-L422 HydrophobicContact CD1-CB 4.33Å; F419-L422 HydrophobicContact CD2-CB 3.86Å; F419-L422 HydrophobicContact CE1-CB 4.03Å; F419-L422 HydrophobicContact CE1-CD1 4.05Å; F419-L422 HydrophobicContact CE2-CB 3.54Å; F419-L422 HydrophobicContact CG-CB 4.25Å; F419-L422 HydrophobicContact CZ-CB 3.63Å; F419-L422 HydrophobicContact CZ-CD1 3.97Å; F419-L422 HydrophobicContact CZ-CG 4.45Å; F419-L422 PolarHBondContact O-N 3.49Å; F419-L422 VanDerWaalsContact O-N 3.11Å; F419-L423 PolarHBondContact O-N 2.9Å
420	F	90.9	Very high	89.4	Confident	68 Å²	68	22.8 Å²	22.8	30%	0.298	12%	0.123	S	C	.	.	H	α-helix	trans	-46.6	-46.5	-172.5	-178.8	-95	0	0	0	114	E152 I156 Y383 L422 L423 V424	E152-F420 HydrophobicContact CB-CD2 4.33Å; E152-F420 HydrophobicContact CB-CE2 4.31Å; I156-F420 HydrophobicContact CD1-CD2 4.16Å; I156-F420 HydrophobicContact CD1-CE2 4.05Å; I156-F420 HydrophobicContact CG1-CD2 4.14Å; I156-F420 HydrophobicContact CG1-CE2 3.54Å; I156-F420 HydrophobicContact CG1-CZ 3.92Å; Y383-F420 WeakPolarHBondContact OH-CA 3.41Å; F420-L422 PolarHBondContact O-N 3.28Å; F420-L423 PolarHBondContact O-N 3.45Å; F420-V424 HydrophobicContact CD1-CG2 4.22Å; F420-V424 HydrophobicContact CE1-CG2 3.85Å; F420-V424 HydrophobicContact CZ-CG2 4.17Å; F420-V424 WeakPolarHBondContact O-CG2 3.35Å; F420-V424 PolarHBondContact O-N 3.03Å
421	T	89.8	Confident	89.9	Confident	41 Å²	41	22.6 Å²	22.6	25%	0.252	12%	0.122	S	C	.	.	H	α-helix	trans	-73.2	-27.9	-173.1	76.5	0	0	0	0	113.8	F419 G425 I632	F419-T421 VanDerWaalsContact C-N 3.29Å; F419-T421 VanDerWaalsContact CD2-OG1 3.3Å; F419-T421 WeakPolarHBondContact CD2-OG1 3.46Å; F419-T421 VanDerWaalsContact CE2-OG1 3.24Å; F419-T421 WeakPolarHBondContact CE2-OG1 3.41Å; F419-T421 PolarHBondContact O-N 3.31Å; F419-T421 VanDerWaalsContact O-N 3.11Å; T421-G425 PolarHBondContact O-N 2.94Å; T421-I632 VanDerWaalsContact CB-O 3.25Å; T421-I632 WeakPolarHBondContact CB-O 3.47Å; T421-I632 HydrophobicContact CG2-CG2 3.47Å; T421-I632 VanDerWaalsContact CG2-CG2 3.47Å; T421-I632 PolarHBondContact OG1-O 3.38Å
422	L	88.9	Confident	90.1	Very high	41 Å²	41	22.7 Å²	22.7	22%	0.215	12%	0.122	C	C	.	.	H	α-helix	trans	-71.3	-39.6	171.7	173.4	140.4	0	0	0	111	I416 F419 F420 V424 G425 I426	I416-L422 HydrophobicContact CD1-CD2 4.09Å; F419-L422 HydrophobicContact CD1-CB 4.33Å; F419-L422 HydrophobicContact CD2-CB 3.86Å; F419-L422 HydrophobicContact CE1-CB 4.03Å; F419-L422 HydrophobicContact CE1-CD1 4.05Å; F419-L422 HydrophobicContact CE2-CB 3.54Å; F419-L422 HydrophobicContact CG-CB 4.25Å; F419-L422 HydrophobicContact CZ-CB 3.63Å; F419-L422 HydrophobicContact CZ-CD1 3.97Å; F419-L422 HydrophobicContact CZ-CG 4.45Å; F419-L422 PolarHBondContact O-N 3.49Å; F419-L422 VanDerWaalsContact O-N 3.11Å; F420-L422 PolarHBondContact O-N 3.28Å; L422-V424 VanDerWaalsContact C-N 3.35Å; L422-V424 PolarHBondContact O-N 3.47Å; L422-G425 PolarHBondContact O-N 3.18Å; L422-G425 VanDerWaalsContact O-N 3.13Å; L422-I426 HydrophobicContact CD2-CD1 3.57Å; L422-I426 HydrophobicContact CG-CD1 4.13Å; L422-I426 WeakPolarHBondContact O-CG1 3.45Å; L422-I426 PolarHBondContact O-N 2.79Å
423	L	92.1	Very high	90.1	Very high	0 Å²	0	23 Å²	23	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-65.3	-36.2	175.1	-62.2	-176.2	0	0	0	112.4	W143 I144 A148 I156 Y383 F419 F420 G425 I426 Y427	W143-L423 HydrophobicContact CE3-CD2 4.26Å; W143-L423 HydrophobicContact CH2-CD2 3.69Å; W143-L423 HydrophobicContact CZ3-CD2 3.39Å; I144-L423 HydrophobicContact CG1-CD2 4.37Å; A148-L423 HydrophobicContact CB-CD1 3.78Å; I156-L423 HydrophobicContact CD1-CB 3.9Å; Y383-L423 HydrophobicContact CE1-CD1 3.74Å; F419-L423 PolarHBondContact O-N 2.9Å; F420-L423 PolarHBondContact O-N 3.45Å; L423-G425 VanDerWaalsContact C-N 3.32Å; L423-G425 PolarHBondContact O-N 3.04Å; L423-I426 PolarHBondContact O-N 3.01Å; L423-Y427 VanDerWaalsContact O-CB 3.24Å; L423-Y427 WeakPolarHBondContact O-CB 3.37Å; L423-Y427 PolarHBondContact O-N 3.11Å
424	V	92.4	Very high	90.4	Very high	3 Å²	3	20.9 Å²	20.9	2%	0.018	11%	0.114	C	C	.	.	H	α-helix	trans	-58.2	-44.4	170.1	174.8	0	0	0	0	111	I156 L159 F420 L422 Y427 F428 I629	I156-V424 HydrophobicContact CG1-CG2 3.89Å; I156-V424 HydrophobicContact CG2-CG2 4.2Å; L159-V424 HydrophobicContact CD2-CG1 4.15Å; F420-V424 HydrophobicContact CD1-CG2 4.22Å; F420-V424 HydrophobicContact CE1-CG2 3.85Å; F420-V424 HydrophobicContact CZ-CG2 4.17Å; F420-V424 WeakPolarHBondContact O-CG2 3.35Å; F420-V424 PolarHBondContact O-N 3.03Å; L422-V424 VanDerWaalsContact C-N 3.35Å; L422-V424 PolarHBondContact O-N 3.47Å; V424-Y427 PolarHBondContact O-N 2.68Å; V424-F428 WeakPolarHBondContact O-CB 3.43Å; V424-F428 PolarHBondContact O-N 2.85Å; V424-I629 HydrophobicContact CG1-CG2 3.81Å
425	G	89.5	Confident	90.5	Very high	1 Å²	1	20.6 Å²	20.6	1%	0.01	11%	0.112	C	C	.	.	H	α-helix	trans	-67.9	-32.2	178.3	0	0	0	0	0	114.8	T421 L422 L423 A578 S582	T421-G425 PolarHBondContact O-N 2.94Å; L422-G425 PolarHBondContact O-N 3.18Å; L422-G425 VanDerWaalsContact O-N 3.13Å; L423-G425 VanDerWaalsContact C-N 3.32Å; L423-G425 PolarHBondContact O-N 3.04Å; G425-A578 CarbonylContact O-C 3.49Å; G425-S582 PolarHBondContact O-OG 3.48Å; G425-S582 VanDerWaalsContact O-OG 3.12Å
426	I	91.8	Very high	90.7	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.104	C	C	.	.	H	α-helix	trans	-77.4	-35.2	174.3	-67.2	172.4	0	0	0	111.2	I136 R140 W143 I416 L422 L423 P429 D575	I136-I426 HydrophobicContact CD1-CG2 4.36Å; R140-I426 HydrophobicContact CG-CG2 4.5Å; W143-I426 HydrophobicContact CZ3-CD1 4.24Å; I416-I426 HydrophobicContact CD1-CD1 4.18Å; L422-I426 HydrophobicContact CD2-CD1 3.57Å; L422-I426 HydrophobicContact CG-CD1 4.13Å; L422-I426 WeakPolarHBondContact O-CG1 3.45Å; L422-I426 PolarHBondContact O-N 2.79Å; L423-I426 PolarHBondContact O-N 3.01Å; I426-P429 WeakPolarHBondContact O-CD 3.45Å; I426-D575 HydrophobicContact CD1-CB 4.02Å
427	Y	93.8	Very high	90.4	Very high	1 Å²	1	17 Å²	17	0%	0.004	9%	0.094	C	C	.	.	H	α-helix	trans	-76	-39.8	-179.4	-177.3	-96.8	0	0	0	113	I136 L141 I144 I156 V157 C160 L423 V424 P429 S430 V431 Y466	I136-Y427 HydrophobicContact CG2-CD2 4.33Å; L141-Y427 HydrophobicContact CD1-CD2 4.46Å; L141-Y427 HydrophobicContact CD1-CE2 4.05Å; I144-Y427 HydrophobicContact CD1-CD2 3.97Å; I156-Y427 HydrophobicContact CG2-CD1 3.81Å; I156-Y427 HydrophobicContact CG2-CG 3.83Å; V157-Y427 HydrophobicContact CB-CE1 4.35Å; V157-Y427 HydrophobicContact CG2-CE1 4.01Å; V157-Y427 HydrophobicContact CG2-CE2 3.86Å; V157-Y427 WeakPolarHBondContact CG2-OH 3.28Å; C160-Y427 HydrophobicContact CB-CD1 3.95Å; C160-Y427 HydrophobicContact CB-CE1 3.87Å; L423-Y427 VanDerWaalsContact O-CB 3.24Å; L423-Y427 WeakPolarHBondContact O-CB 3.37Å; L423-Y427 PolarHBondContact O-N 3.11Å; V424-Y427 PolarHBondContact O-N 2.68Å; Y427-P429 VanDerWaalsContact C-N 3.34Å; Y427-P429 WeakPolarHBondContact O-CD 3.32Å; Y427-P429 VanDerWaalsContact O-N 3.1Å; Y427-S430 WeakPolarHBondContact CE1-OG 3.46Å; Y427-S430 WeakPolarHBondContact CE2-OG 3.34Å; Y427-S430 VanDerWaalsContact O-CB 3.23Å; Y427-S430 WeakPolarHBondContact O-CB 3.27Å; Y427-S430 PolarHBondContact O-N 3.16Å; Y427-S430 PolarHBondContact O-OG 3.42Å; Y427-V431 HydrophobicContact CE1-CG1 3.98Å; Y427-Y466 WeakPolarHBondContact OH-CB 3.43Å; Y427-Y466 WeakPolarHBondContact OH-CD2 3.41Å
428	F	93.2	Very high	90.3	Very high	1 Å²	1	14.1 Å²	14.1	0%	0.004	7%	0.074	C	C	.	.	G	3₁₀ helix	trans	-51.3	-36.7	-170	-174.7	-91.9	0	0	0	115.8	C160 C163 V424 S430 V431 T432 F585 L586 Y589 I629	C160-F428 HydrophobicContact CB-CD2 4.31Å; C163-F428 HydrophobicContact CB-CE2 4.41Å; V424-F428 WeakPolarHBondContact O-CB 3.43Å; V424-F428 PolarHBondContact O-N 2.85Å; F428-S430 PolarHBondContact O-N 3.07Å; F428-S430 VanDerWaalsContact O-N 3.08Å; F428-V431 HydrophobicContact CD2-CG2 4.11Å; F428-V431 HydrophobicContact CE2-CG2 4.21Å; F428-V431 WeakPolarHBondContact O-CG2 3.37Å; F428-V431 PolarHBondContact O-N 3.36Å; F428-V431 VanDerWaalsContact O-N 3.11Å; F428-T432 HydrophobicContact CD1-CG2 3.94Å; F428-T432 HydrophobicContact CE1-CG2 3.7Å; F428-F585 HydrophobicContact CE1-CB 4.02Å; F428-L586 HydrophobicContact CD1-CG 4.23Å; F428-L586 HydrophobicContact CD2-CD2 4.19Å; F428-L586 HydrophobicContact CE1-CD2 4.02Å; F428-L586 HydrophobicContact CE1-CG 3.72Å; F428-L586 HydrophobicContact CE2-CD2 3.49Å; F428-L586 VanDerWaalsContact CE2-CD2 3.49Å; F428-L586 HydrophobicContact CE2-CG 4.09Å; F428-L586 HydrophobicContact CZ-CD2 3.39Å; F428-L586 HydrophobicContact CZ-CG 3.65Å; F428-Y589 HydrophobicContact CE1-CE2 4.42Å; F428-Y589 HydrophobicContact CZ-CD2 4.06Å; F428-Y589 HydrophobicContact CZ-CE2 4.02Å; F428-I629 HydrophobicContact CE2-CD1 4.47Å
429	P	92.1	Very high	90	Very high	4 Å²	4	15 Å²	15	3%	0.026	8%	0.078	C	C	.	.	G	3₁₀ helix	trans	-54.9	-28.6	174.7	-28.5	39.1	0	0	0	114.2	M215 I426 Y427 V431 T432 A578 L581 S582	M215-P429 HydrophobicContact CE-CB 4.02Å; M215-P429 HydrophobicContact CE-CG 4.26Å; M215-P429 HydrophobicContact SD-CB 4.02Å; M215-P429 HydrophobicContact SD-CG 4.23Å; I426-P429 WeakPolarHBondContact O-CD 3.45Å; Y427-P429 VanDerWaalsContact C-N 3.34Å; Y427-P429 WeakPolarHBondContact O-CD 3.32Å; Y427-P429 VanDerWaalsContact O-N 3.1Å; P429-V431 PolarHBondContact O-N 3.03Å; P429-T432 PolarHBondContact O-N 2.85Å; P429-T432 VanDerWaalsContact O-N 3.13Å; P429-T432 PolarHBondContact O-OG1 3.29Å; P429-A578 HydrophobicContact CG-CB 4.08Å; P429-L581 HydrophobicContact CB-CD2 3.97Å; P429-L581 HydrophobicContact CG-CD2 4.1Å; P429-L581 HydrophobicContact CG-CG 4.49Å; P429-S582 VanDerWaalsContact CD-OG 3.3Å; P429-S582 WeakPolarHBondContact CD-OG 3.5Å; P429-S582 WeakPolarHBondContact CG-OG 3.25Å
430	S	91.9	Very high	89.4	Confident	2 Å²	2	10.6 Å²	10.6	1%	0.014	6%	0.059	C	C	.	.	G	3₁₀ helix	trans	-64.4	-19.4	178.7	71.1	0	0	0	0	115.2	I132 Y427 F428 Y466	I132-S430 WeakPolarHBondContact CG2-O 3.39Å; I132-S430 VanDerWaalsContact O-O 3.05Å; Y427-S430 WeakPolarHBondContact CE1-OG 3.46Å; Y427-S430 WeakPolarHBondContact CE2-OG 3.34Å; Y427-S430 VanDerWaalsContact O-CB 3.23Å; Y427-S430 WeakPolarHBondContact O-CB 3.27Å; Y427-S430 PolarHBondContact O-N 3.16Å; Y427-S430 PolarHBondContact O-OG 3.42Å; F428-S430 PolarHBondContact O-N 3.07Å; F428-S430 VanDerWaalsContact O-N 3.08Å; S430-Y466 WeakPolarHBondContact O-CE2 3.3Å; S430-Y466 PolarHBondContact O-OH 2.93Å
431	V	93.6	Very high	89	Confident	3 Å²	3	7.6 Å²	7.6	2%	0.018	5%	0.046	C	C	.	.	G	3₁₀ helix	trans	-104.1	-0	176.4	-60.9	0	0	0	0	112.8	C160 T164 Y427 F428 P429	C160-V431 HydrophobicContact CB-CG1 4.2Å; C160-V431 HydrophobicContact CB-CG2 3.84Å; T164-V431 HydrophobicContact CG2-CB 3.98Å; T164-V431 HydrophobicContact CG2-CG2 3.64Å; T164-V431 WeakPolarHBondContact CG2-O 3.36Å; Y427-V431 HydrophobicContact CE1-CG1 3.98Å; F428-V431 HydrophobicContact CD2-CG2 4.11Å; F428-V431 HydrophobicContact CE2-CG2 4.21Å; F428-V431 WeakPolarHBondContact O-CG2 3.37Å; F428-V431 PolarHBondContact O-N 3.36Å; F428-V431 VanDerWaalsContact O-N 3.11Å; P429-V431 PolarHBondContact O-N 3.03Å
432	T	92.1	Very high	88.3	Confident	3 Å²	3	7 Å²	7	2%	0.018	5%	0.049	C	C	.	.			trans	-77.1	178.8	178.9	69.3	0	0	0	0	112	I132 F428 P429 F585	I132-T432 WeakPolarHBondContact CA-O 3.45Å; I132-T432 VanDerWaalsContact CG1-O 3.25Å; I132-T432 WeakPolarHBondContact CG1-O 3.31Å; F428-T432 HydrophobicContact CD1-CG2 3.94Å; F428-T432 HydrophobicContact CE1-CG2 3.7Å; P429-T432 PolarHBondContact O-N 2.85Å; P429-T432 VanDerWaalsContact O-N 3.13Å; P429-T432 PolarHBondContact O-OG1 3.29Å; T432-F585 HydrophobicContact CG2-CB 3.99Å; T432-F585 HydrophobicContact CG2-CD2 3.53Å; T432-F585 HydrophobicContact CG2-CE2 4.1Å; T432-F585 HydrophobicContact CG2-CG 3.89Å
433	G	88.6	Confident	87.9	Confident	12 Å²	12	6.5 Å²	6.5	12%	0.124	5%	0.046	C	C	.	.			trans	89.9	1.4	-179.7	0	0	0	0	0	115.5	M435 A436	G433-M435 PolarHBondContact O-N 2.65Å; G433-A436 WeakPolarHBondContact O-CB 3.48Å; G433-A436 PolarHBondContact O-N 3.15Å
434	I	93.2	Very high	87.5	Confident	1 Å²	1	7.3 Å²	7.3	1%	0.005	5%	0.05	C	C	.	.	G	3₁₀ helix	trans	-56.6	-26	-179.5	67.6	175.5	0	0	0	114.2	I132 T167 M171 A436 G437 T455 I459 Y589	I132-I434 HydrophobicContact CD1-CG2 4.45Å; T167-I434 HydrophobicContact CG2-CD1 3.96Å; M171-I434 WeakPolarHBondContact CE-O 3.22Å; I434-A436 PolarHBondContact O-N 3.05Å; I434-G437 PolarHBondContact O-N 3.42Å; I434-T455 HydrophobicContact CB-CG2 4.46Å; I434-I459 HydrophobicContact CB-CD1 4.15Å; I434-I459 HydrophobicContact CG2-CD1 3.6Å; I434-I459 HydrophobicContact CG2-CG1 3.83Å; I434-Y589 HydrophobicContact CD1-CE1 4.19Å; I434-Y589 HydrophobicContact CG1-CE1 4.16Å
435	M	89.1	Confident	87.1	Confident	5 Å²	5	14.8 Å²	14.8	3%	0.025	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-71.7	-13.3	176.9	-68.1	-177.3	169.4	0	0	113.4	I189 F205 G433 G437 S438 N439 C588 Y589 V592	I189-M435 HydrophobicContact CD1-CE 4.1Å; F205-M435 HydrophobicContact CD1-SD 4.23Å; F205-M435 HydrophobicContact CD2-SD 3.76Å; F205-M435 HydrophobicContact CE1-CB 4.38Å; F205-M435 HydrophobicContact CE1-SD 4.19Å; F205-M435 HydrophobicContact CE2-CB 4.05Å; F205-M435 HydrophobicContact CE2-CG 4.36Å; F205-M435 HydrophobicContact CE2-SD 3.7Å; F205-M435 HydrophobicContact CG-SD 4.07Å; F205-M435 HydrophobicContact CZ-CB 3.72Å; F205-M435 HydrophobicContact CZ-CG 4.41Å; F205-M435 HydrophobicContact CZ-SD 3.95Å; G433-M435 PolarHBondContact O-N 2.65Å; M435-G437 PolarHBondContact O-N 3.12Å; M435-S438 PolarHBondContact O-N 3.44Å; M435-S438 VanDerWaalsContact O-N 3.12Å; M435-S438 PolarHBondContact O-OG 3.44Å; M435-S438 VanDerWaalsContact O-OG 3.07Å; M435-N439 PolarHBondContact O-N 2.94Å; M435-N439 PolarHBondContact O-OD1 3.29Å; M435-C588 VanDerWaalsContact CE-SG 3.54Å; M435-Y589 HydrophobicContact CE-CD1 4.25Å; M435-Y589 HydrophobicContact CE-CE1 4.24Å; M435-V592 HydrophobicContact CE-CG2 3.97Å
436	A	83.9	Confident	86.9	Confident	6 Å²	6	18 Å²	18	5%	0.05	10%	0.1	C	C	.	.	G	3₁₀ helix	trans	-61.4	-26	173.7	0	0	0	0	0	113.1	N131 G433 I434 S438 N439	N131-A436 HydrophobicContact CB-CB 3.79Å; N131-A436 WeakPolarHBondContact ND2-CB 3.44Å; G433-A436 WeakPolarHBondContact O-CB 3.48Å; G433-A436 PolarHBondContact O-N 3.15Å; I434-A436 PolarHBondContact O-N 3.05Å; A436-S438 VanDerWaalsContact C-N 3.3Å; A436-S438 PolarHBondContact O-N 2.99Å; A436-N439 PolarHBondContact O-N 3.38Å
437	G	81.2	Confident	86.7	Confident	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.105	C	C	.	.	G	3₁₀ helix	trans	-64.6	-29.9	174.5	0	0	0	0	0	114.1	I434 M435	I434-G437 PolarHBondContact O-N 3.42Å; M435-G437 PolarHBondContact O-N 3.12Å
438	S	86.1	Confident	86.5	Confident	0 Å²	0	20.8 Å²	20.8	0%	0	12%	0.115	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-3.5	177.1	52.2	0	0	0	0	113.7	G184 S185 M435 A436 R440 S441	G184-S438 CarbonylContact C-O 3.49Å; G184-S438 VanDerWaalsContact CA-O 3.29Å; G184-S438 WeakPolarHBondContact CA-O 3.32Å; S185-S438 WeakPolarHBondContact CB-OG 3.48Å; S185-S438 PolarHBondContact N-O 3.14Å; M435-S438 PolarHBondContact O-N 3.44Å; M435-S438 VanDerWaalsContact O-N 3.12Å; M435-S438 PolarHBondContact O-OG 3.44Å; M435-S438 VanDerWaalsContact O-OG 3.07Å; A436-S438 VanDerWaalsContact C-N 3.3Å; A436-S438 PolarHBondContact O-N 2.99Å; S438-R440 PolarHBondContact O-N 3.27Å; S438-S441 PolarHBondContact O-N 3.4Å
439	N	84.2	Confident	86.3	Confident	27 Å²	27	27 Å²	27	14%	0.144	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.4	-6.6	-178.7	-83	-5.5	0	0	0	115	Q94 S185 M435 A436	Q94-N439 WeakPolarHBondContact CB-O 3.37Å; Q94-N439 WeakPolarHBondContact CG-O 3.38Å; Q94-N439 PolarHBondContact N-O 3.09Å; S185-N439 VanDerWaalsContact CB-OD1 3.25Å; S185-N439 WeakPolarHBondContact CB-OD1 3.26Å; S185-N439 PolarHBondContact OG-OD1 2.89Å; M435-N439 PolarHBondContact O-N 2.94Å; M435-N439 PolarHBondContact O-OD1 3.29Å; A436-N439 PolarHBondContact O-N 3.38Å
440	R	78.8	Confident	86.4	Confident	3 Å²	3	27.1 Å²	27.1	1%	0.011	14%	0.143	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.2	37.2	173.4	-58.8	-165.5	-163.8	142.8	-1.1	113.1	Y89 T90 N91 M118 M122 P127 S438 G442 D443 L444	Y89-R440 VanDerWaalsContact CE2-NH2 3.29Å; T90-R440 PolarHBondContact O-NE 3.07Å; T90-R440 PolarHBondContact O-NH2 3.14Å; N91-R440 VanDerWaalsContact CA-NH2 3.29Å; M118-R440 PolarHBondContact SD-NH1 2.83Å; M122-R440 PolarHBondContact O-NH1 3.37Å; P127-R440 VanDerWaalsContact CG-CZ 3.49Å; S438-R440 PolarHBondContact O-N 3.27Å; R440-G442 PolarHBondContact O-N 3.23Å; R440-G442 VanDerWaalsContact O-N 3.14Å; R440-D443 PolarHBondContact O-N 3.22Å; R440-D443 VanDerWaalsContact O-N 3.15Å; R440-L444 WeakPolarHBondContact O-CG 3.25Å
441	S	81.8	Confident	86.4	Confident	5 Å²	5	27 Å²	27	4%	0.035	14%	0.142	C	C	.	.	G	3₁₀ helix	trans	-55.1	-34.3	-171.5	57.4	0	0	0	0	114.3	P181 G184 S438	P181-S441 WeakPolarHBondContact O-CB 3.44Å; P181-S441 PolarHBondContact O-OG 3Å; G184-S441 WeakPolarHBondContact CA-OG 3.27Å; G184-S441 PolarHBondContact N-OG 3.02Å; S438-S441 PolarHBondContact O-N 3.4Å
442	G	76.8	Confident	86.5	Confident	29 Å²	29	27.2 Å²	27.2	30%	0.299	14%	0.143	S	C	.	.	G	3₁₀ helix	trans	-77.5	-22	-179.7	0	0	0	0	0	115.6	R440 L444	R440-G442 PolarHBondContact O-N 3.23Å; R440-G442 VanDerWaalsContact O-N 3.14Å; G442-L444 VanDerWaalsContact C-N 3.35Å
443	D	80	Confident	86.6	Confident	30 Å²	30	31.3 Å²	31.3	16%	0.16	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-87.1	-5.5	-179.5	-65.4	-34.1	0	0	0	112.7	Q94 M118 R440	Q94-D443 PolarHBondContact NE2-OD1 2.64Å; Q94-D443 PolarHBondContact NE2-OD2 2.78Å; M118-D443 HydrophobicContact CG-CB 4.3Å; M118-D443 PolarHBondContact N-O 2.95Å; R440-D443 PolarHBondContact O-N 3.22Å; R440-D443 VanDerWaalsContact O-N 3.15Å
444	L	84	Confident	86.8	Confident	17 Å²	17	30.8 Å²	30.8	9%	0.089	16%	0.159	C	C	.	.	B	Isolated β-bridge	trans	-87.5	131.6	-173.2	-66	171.2	0	0	0	111.8	M118 V124 R440 G442 D446 A447 I451	M118-L444 HydrophobicContact CB-CD2 4.34Å; V124-L444 HydrophobicContact CG2-CD1 3.65Å; V124-L444 HydrophobicContact CG2-CD2 3.76Å; V124-L444 HydrophobicContact CG2-CG 4.38Å; R440-L444 WeakPolarHBondContact O-CG 3.25Å; G442-L444 VanDerWaalsContact C-N 3.35Å; L444-D446 PolarHBondContact O-N 3.42Å; L444-A447 HydrophobicContact CB-CB 4.15Å; L444-A447 HydrophobicContact CD1-CB 4.15Å; L444-I451 HydrophobicContact CD1-CD1 4.21Å; L444-I451 HydrophobicContact CD1-CG1 3.76Å
445	K	83.1	Confident	86.9	Confident	160 Å²	160	30.8 Å²	30.8	70%	0.696	16%	0.159	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-33.2	174.4	-175.6	171.6	-179.7	172.7	0	113.4	Q117 M118	Q117-K445 HydrophobicContact CB-CB 4.28Å; M118-K445 PolarHBondContact O-N 3.35Å; M118-K445 VanDerWaalsContact O-N 3.11Å
446	D	86.3	Confident	87.2	Confident	70 Å²	70	32.7 Å²	32.7	37%	0.374	17%	0.169	S	C	.	.	T	Hydrogen-bonded Turn	trans	-148.6	92.2	174.8	176.1	-7.7	0	0	0	107.7	L444 Q448 K449 S450	L444-D446 PolarHBondContact O-N 3.42Å; D446-Q448 VanDerWaalsContact C-N 3.35Å; D446-Q448 PolarHBondContact OD1-N 3.36Å; D446-K449 HydrophobicContact CB-CB 4.42Å; D446-K449 VanDerWaalsContact CG-CB 3.41Å; D446-K449 WeakPolarHBondContact OD1-CB 3.14Å; D446-K449 PolarHBondContact OD1-N 3.01Å; D446-K449 WeakPolarHBondContact OD2-CB 3.26Å; D446-S450 WeakPolarHBondContact O-CB 3.45Å; D446-S450 PolarHBondContact O-N 3.49Å; D446-S450 PolarHBondContact O-OG 3.04Å
447	A	87.1	Confident	87.8	Confident	13 Å²	13	36.7 Å²	36.7	11%	0.107	19%	0.189	C	C	.	.	H	α-helix	trans	-64.4	-38.4	-179.8	0	0	0	0	0	112.2	V180 L444 K449 S450 I451	V180-A447 HydrophobicContact CB-CB 4.05Å; V180-A447 HydrophobicContact CG1-CB 4Å; V180-A447 HydrophobicContact CG2-CB 4.33Å; L444-A447 HydrophobicContact CB-CB 4.15Å; L444-A447 HydrophobicContact CD1-CB 4.15Å; A447-K449 VanDerWaalsContact C-N 3.32Å; A447-K449 PolarHBondContact O-N 3.49Å; A447-S450 PolarHBondContact O-N 3.21Å; A447-I451 HydrophobicContact CB-CD1 4.06Å; A447-I451 WeakPolarHBondContact O-CB 3.47Å; A447-I451 VanDerWaalsContact O-CG1 3.31Å; A447-I451 WeakPolarHBondContact O-CG1 3.39Å; A447-I451 PolarHBondContact O-N 3.49Å
448	Q	89.2	Confident	88.4	Confident	46 Å²	46	36.7 Å²	36.7	22%	0.215	19%	0.189	C	C	.	.	H	α-helix	trans	-65.1	-35.7	-175.8	-58.6	-163.1	8.5	0	0	112.5	T176 G178 V180 D446 P452	T176-Q448 WeakPolarHBondContact CG2-O 3.46Å; G178-Q448 PolarHBondContact O-NE2 3.37Å; V180-Q448 HydrophobicContact CG2-CG 3.8Å; D446-Q448 VanDerWaalsContact C-N 3.35Å; D446-Q448 PolarHBondContact OD1-N 3.36Å; Q448-P452 WeakPolarHBondContact O-CD 3.41Å; Q448-P452 VanDerWaalsContact O-CG 3.32Å; Q448-P452 WeakPolarHBondContact O-CG 3.41Å
449	K	90.2	Very high	88.9	Confident	131 Å²	131	36.8 Å²	36.8	57%	0.57	19%	0.189	S	C	*	.	H	α-helix	trans	-86.9	-38.4	174.8	-171.8	176.6	178.3	-179.5	0	112.7	D446 A447 I453	D446-K449 HydrophobicContact CB-CB 4.42Å; D446-K449 VanDerWaalsContact CG-CB 3.41Å; D446-K449 WeakPolarHBondContact OD1-CB 3.14Å; D446-K449 PolarHBondContact OD1-N 3.01Å; D446-K449 WeakPolarHBondContact OD2-CB 3.26Å; A447-K449 VanDerWaalsContact C-N 3.32Å; A447-K449 PolarHBondContact O-N 3.49Å; K449-I453 HydrophobicContact CG-CD1 3.79Å; K449-I453 WeakPolarHBondContact O-CD1 3.34Å; K449-I453 VanDerWaalsContact O-CG1 3.32Å; K449-I453 WeakPolarHBondContact O-CG1 3.37Å
450	S	92.4	Very high	89.4	Confident	7 Å²	7	37.7 Å²	37.7	5%	0.049	20%	0.2	C	C	.	.	H	α-helix	trans	-73.4	-41	-174	-64.7	0	0	0	0	113.3	T120 D446 A447 G454	T120-S450 WeakPolarHBondContact CG2-O 3.44Å; T120-S450 PolarHBondContact OG1-OG 2.75Å; D446-S450 WeakPolarHBondContact O-CB 3.45Å; D446-S450 PolarHBondContact O-N 3.49Å; D446-S450 PolarHBondContact O-OG 3.04Å; A447-S450 PolarHBondContact O-N 3.21Å; S450-G454 PolarHBondContact O-N 3.47Å
451	I	93	Very high	90.2	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-62.2	-50.6	-176.3	-66	169.3	0	0	0	111.4	V124 M171 A175 V180 M188 L444 A447 T455	V124-I451 HydrophobicContact CG2-CG1 4.38Å; M171-I451 HydrophobicContact SD-CG2 3.79Å; A175-I451 HydrophobicContact CB-CB 4.08Å; A175-I451 HydrophobicContact CB-CD1 4.35Å; A175-I451 HydrophobicContact CB-CG2 3.82Å; V180-I451 HydrophobicContact CG1-CD1 4.38Å; M188-I451 HydrophobicContact SD-CD1 4.14Å; L444-I451 HydrophobicContact CD1-CD1 4.21Å; L444-I451 HydrophobicContact CD1-CG1 3.76Å; A447-I451 HydrophobicContact CB-CD1 4.06Å; A447-I451 WeakPolarHBondContact O-CB 3.47Å; A447-I451 VanDerWaalsContact O-CG1 3.31Å; A447-I451 WeakPolarHBondContact O-CG1 3.39Å; A447-I451 PolarHBondContact O-N 3.49Å; I451-T455 VanDerWaalsContact O-CB 3.23Å; I451-T455 WeakPolarHBondContact O-CB 3.49Å; I451-T455 PolarHBondContact O-N 2.89Å; I451-T455 VanDerWaalsContact O-N 3.07Å; I451-T455 PolarHBondContact O-OG1 3.24Å
452	P	94.6	Very high	90.8	Very high	6 Å²	6	39.4 Å²	39.4	4%	0.039	21%	0.211	C	C	.	.	H	α-helix	trans	-61	-49.1	178	-26.2	36.7	0	0	0	113.4	S172 T176 Q448 I456 F611	S172-P452 WeakPolarHBondContact OG-CA 3.3Å; S172-P452 WeakPolarHBondContact OG-CB 3.35Å; T176-P452 HydrophobicContact CG2-CG 4.12Å; Q448-P452 WeakPolarHBondContact O-CD 3.41Å; Q448-P452 VanDerWaalsContact O-CG 3.32Å; Q448-P452 WeakPolarHBondContact O-CG 3.41Å; P452-I456 WeakPolarHBondContact O-CB 3.41Å; P452-I456 VanDerWaalsContact O-CG1 3.31Å; P452-I456 WeakPolarHBondContact O-CG1 3.45Å; P452-I456 PolarHBondContact O-N 3.13Å; P452-F611 HydrophobicContact CB-CD2 4.29Å; P452-F611 HydrophobicContact CB-CE2 3.89Å; P452-F611 HydrophobicContact CB-CZ 4.48Å
453	I	94.2	Very high	91.7	Very high	90 Å²	90	39 Å²	39	46%	0.462	20%	0.204	S	C	.	.	H	α-helix	trans	-66.1	-48.3	-174.9	-63.3	175.3	0	0	0	110.5	T120 K449 L457	T120-I453 HydrophobicContact CG2-CB 4.2Å; T120-I453 HydrophobicContact CG2-CG2 4.17Å; K449-I453 HydrophobicContact CG-CD1 3.79Å; K449-I453 WeakPolarHBondContact O-CD1 3.34Å; K449-I453 VanDerWaalsContact O-CG1 3.32Å; K449-I453 WeakPolarHBondContact O-CG1 3.37Å; I453-L457 WeakPolarHBondContact O-CB 3.38Å; I453-L457 PolarHBondContact O-N 3.13Å; I453-L457 VanDerWaalsContact O-N 3.09Å
454	G	94.5	Very high	92.4	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.01	23%	0.226	C	C	.	.	H	α-helix	trans	-67.3	-38.7	-177.9	0	0	0	0	0	113	S450 A458	S450-G454 PolarHBondContact O-N 3.47Å; G454-A458 VanDerWaalsContact O-CB 3.32Å; G454-A458 WeakPolarHBondContact O-CB 3.42Å; G454-A458 PolarHBondContact O-N 2.95Å
455	T	94.9	Very high	93	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-71.4	-48.1	-179.1	-52.1	0	0	0	0	111.8	A168 M171 I434 I451 L457 A458 I459	A168-T455 HydrophobicContact CB-CG2 4.13Å; M171-T455 HydrophobicContact CE-CG2 3.79Å; I434-T455 HydrophobicContact CB-CG2 4.46Å; I451-T455 VanDerWaalsContact O-CB 3.23Å; I451-T455 WeakPolarHBondContact O-CB 3.49Å; I451-T455 PolarHBondContact O-N 2.89Å; I451-T455 VanDerWaalsContact O-N 3.07Å; I451-T455 PolarHBondContact O-OG1 3.24Å; T455-L457 VanDerWaalsContact C-N 3.33Å; T455-L457 PolarHBondContact O-N 3.16Å; T455-A458 PolarHBondContact O-N 3.29Å; T455-I459 HydrophobicContact CG2-CD1 4.04Å; T455-I459 WeakPolarHBondContact O-CG1 3.37Å; T455-I459 PolarHBondContact O-N 2.94Å
456	I	95.6	Very high	93.5	Very high	45 Å²	45	37 Å²	37	23%	0.231	19%	0.194	C	C	.	.	H	α-helix	trans	-63.8	-41.2	179.6	-67.5	170.7	0	0	0	110.5	M165 P452 I459 A460 F611	M165-I456 HydrophobicContact CE-CG2 4.43Å; M165-I456 HydrophobicContact SD-CG2 4.06Å; P452-I456 WeakPolarHBondContact O-CB 3.41Å; P452-I456 VanDerWaalsContact O-CG1 3.31Å; P452-I456 WeakPolarHBondContact O-CG1 3.45Å; P452-I456 PolarHBondContact O-N 3.13Å; I456-I459 PolarHBondContact O-N 3.48Å; I456-A460 WeakPolarHBondContact O-CB 3.26Å; I456-A460 PolarHBondContact O-N 2.9Å; I456-F611 HydrophobicContact CD1-CE1 4.4Å; I456-F611 HydrophobicContact CD1-CZ 3.81Å
457	L	95.4	Very high	94	Very high	91 Å²	91	36.3 Å²	36.3	48%	0.476	19%	0.192	S	C	.	.	H	α-helix	trans	-63.8	-43.2	176.7	-173.4	65.9	0	0	0	111.8	Y125 I453 T455 I459 A460 T461	Y125-L457 HydrophobicContact CD2-CB 4.11Å; Y125-L457 HydrophobicContact CD2-CD2 3.94Å; Y125-L457 HydrophobicContact CD2-CG 3.93Å; Y125-L457 HydrophobicContact CE2-CB 4.38Å; Y125-L457 HydrophobicContact CE2-CD2 4.05Å; Y125-L457 HydrophobicContact CE2-CG 3.81Å; I453-L457 WeakPolarHBondContact O-CB 3.38Å; I453-L457 PolarHBondContact O-N 3.13Å; I453-L457 VanDerWaalsContact O-N 3.09Å; T455-L457 VanDerWaalsContact C-N 3.33Å; T455-L457 PolarHBondContact O-N 3.16Å; L457-I459 PolarHBondContact O-N 3.14Å; L457-A460 PolarHBondContact O-N 2.99Å; L457-T461 PolarHBondContact O-N 3.19Å; L457-T461 PolarHBondContact O-OG1 2.97Å; L457-T461 VanDerWaalsContact O-OG1 3.11Å
458	A	94.8	Very high	94.4	Very high	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.1	-44.7	177.5	0	0	0	0	0	112.1	Y125 C128 G454 T455 A460 T461 T462	Y125-A458 HydrophobicContact CD2-CB 3.87Å; Y125-A458 HydrophobicContact CE2-CB 4.22Å; C128-A458 HydrophobicContact CB-CB 3.72Å; G454-A458 VanDerWaalsContact O-CB 3.32Å; G454-A458 WeakPolarHBondContact O-CB 3.42Å; G454-A458 PolarHBondContact O-N 2.95Å; T455-A458 PolarHBondContact O-N 3.29Å; A458-A460 VanDerWaalsContact C-N 3.34Å; A458-A460 PolarHBondContact O-N 3.5Å; A458-T461 PolarHBondContact O-N 3.4Å; A458-T462 WeakPolarHBondContact O-CG2 3.33Å; A458-T462 PolarHBondContact O-N 2.89Å; A458-T462 PolarHBondContact O-OG1 3.36Å
459	I	95.6	Very high	94.6	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	19%	0.185	C	C	.	.	H	α-helix	trans	-65	-38.7	177	-62.3	165.6	0	0	0	111.1	I132 M165 A168 I434 T455 I456 L457 T462 S463	I132-I459 HydrophobicContact CD1-CG1 4.21Å; M165-I459 HydrophobicContact CB-CG2 4.49Å; M165-I459 HydrophobicContact CE-CB 4.12Å; M165-I459 HydrophobicContact CE-CG2 3.74Å; A168-I459 HydrophobicContact CB-CD1 3.37Å; I434-I459 HydrophobicContact CB-CD1 4.15Å; I434-I459 HydrophobicContact CG2-CD1 3.6Å; I434-I459 HydrophobicContact CG2-CG1 3.83Å; T455-I459 HydrophobicContact CG2-CD1 4.04Å; T455-I459 WeakPolarHBondContact O-CG1 3.37Å; T455-I459 PolarHBondContact O-N 2.94Å; I456-I459 PolarHBondContact O-N 3.48Å; L457-I459 PolarHBondContact O-N 3.14Å; I459-T462 PolarHBondContact O-OG1 3.42Å; I459-S463 WeakPolarHBondContact O-CB 3.42Å; I459-S463 PolarHBondContact O-N 3.46Å; I459-S463 PolarHBondContact O-OG 3.33Å
460	A	95.7	Very high	94.9	Very high	46 Å²	46	28.3 Å²	28.3	38%	0.38	16%	0.158	S	C	.	.	H	α-helix	trans	-62.5	-44.2	175.1	0	0	0	0	0	111.7	I456 L457 A458 F464	I456-A460 WeakPolarHBondContact O-CB 3.26Å; I456-A460 PolarHBondContact O-N 2.9Å; L457-A460 PolarHBondContact O-N 2.99Å; A458-A460 VanDerWaalsContact C-N 3.34Å; A458-A460 PolarHBondContact O-N 3.5Å; A460-F464 WeakPolarHBondContact O-CB 3.33Å; A460-F464 PolarHBondContact O-N 2.94Å
461	T	95.1	Very high	95	Very high	41 Å²	41	31.1 Å²	31.1	25%	0.252	17%	0.172	S	C	.	.	H	α-helix	trans	-63.7	-45.8	176.9	-59.5	0	0	0	0	112.4	Y125 L129 L457 A458 F464 I465	Y125-T461 PolarHBondContact OH-OG1 3.25Å; L129-T461 HydrophobicContact CD1-CG2 4.14Å; L457-T461 PolarHBondContact O-N 3.19Å; L457-T461 PolarHBondContact O-OG1 2.97Å; L457-T461 VanDerWaalsContact O-OG1 3.11Å; A458-T461 PolarHBondContact O-N 3.4Å; T461-F464 PolarHBondContact O-N 2.67Å; T461-I465 HydrophobicContact CG2-CD1 4.07Å; T461-I465 WeakPolarHBondContact O-CG1 3.31Å; T461-I465 PolarHBondContact O-N 2.7Å
462	T	94.8	Very high	95.1	Very high	3 Å²	3	32.9 Å²	32.9	2%	0.018	18%	0.181	C	C	.	.	H	α-helix	trans	-69.5	-39.8	179	56.8	0	0	0	0	112.2	L129 I132 L133 A458 I459 F464 I465 Y466	L129-T462 HydrophobicContact CD1-CG2 3.57Å; I132-T462 HydrophobicContact CB-CG2 3.97Å; I132-T462 HydrophobicContact CD1-CG2 4.22Å; I132-T462 HydrophobicContact CG2-CG2 3.68Å; L133-T462 HydrophobicContact CD2-CG2 4.01Å; L133-T462 HydrophobicContact CG-CG2 4.1Å; A458-T462 WeakPolarHBondContact O-CG2 3.33Å; A458-T462 PolarHBondContact O-N 2.89Å; A458-T462 PolarHBondContact O-OG1 3.36Å; I459-T462 PolarHBondContact O-OG1 3.42Å; T462-F464 VanDerWaalsContact C-N 3.28Å; T462-F464 PolarHBondContact O-N 2.99Å; T462-I465 PolarHBondContact O-N 3.3Å; T462-I465 VanDerWaalsContact O-N 3.12Å; T462-Y466 WeakPolarHBondContact O-CD2 3.38Å; T462-Y466 PolarHBondContact O-N 2.92Å
463	S	95.4	Very high	95.1	Very high	21 Å²	21	32.9 Å²	32.9	15%	0.147	18%	0.18	C	C	.	.	H	α-helix	trans	-59.4	-40	174.4	-57	0	0	0	0	111.5	C161 I459 Y466 V467	C161-S463 WeakPolarHBondContact CB-OG 3.26Å; C161-S463 PolarHBondContact SG-OG 2.9Å; I459-S463 WeakPolarHBondContact O-CB 3.42Å; I459-S463 PolarHBondContact O-N 3.46Å; I459-S463 PolarHBondContact O-OG 3.33Å; S463-Y466 PolarHBondContact O-N 3.49Å; S463-V467 WeakPolarHBondContact O-CB 3.41Å; S463-V467 VanDerWaalsContact O-CG2 3.29Å; S463-V467 WeakPolarHBondContact O-CG2 3.46Å; S463-V467 PolarHBondContact O-N 3.3Å
464	F	95.6	Very high	95.1	Very high	144 Å²	144	28.6 Å²	28.6	63%	0.632	16%	0.158	S	C	*	.	H	α-helix	trans	-62.8	-45	172.9	178.2	-96.9	0	0	0	112.4	A460 T461 T462 Y466 S468	A460-F464 WeakPolarHBondContact O-CB 3.33Å; A460-F464 PolarHBondContact O-N 2.94Å; T461-F464 PolarHBondContact O-N 2.67Å; T462-F464 VanDerWaalsContact C-N 3.28Å; T462-F464 PolarHBondContact O-N 2.99Å; F464-Y466 PolarHBondContact O-N 3.02Å; F464-S468 WeakPolarHBondContact O-CB 3.18Å; F464-S468 PolarHBondContact O-N 3.45Å; F464-S468 PolarHBondContact O-OG 3.48Å
465	I	94.9	Very high	95	Very high	21 Å²	21	28.9 Å²	28.9	11%	0.108	16%	0.16	C	C	.	.	H	α-helix	trans	-61	-43.3	177.3	-68.2	162.6	0	0	0	111.1	L137 I288 T461 T462 S468 G469	L137-I465 HydrophobicContact CD1-CG2 4.47Å; I288-I465 HydrophobicContact CD1-CD1 4.47Å; T461-I465 HydrophobicContact CG2-CD1 4.07Å; T461-I465 WeakPolarHBondContact O-CG1 3.31Å; T461-I465 PolarHBondContact O-N 2.7Å; T462-I465 PolarHBondContact O-N 3.3Å; T462-I465 VanDerWaalsContact O-N 3.12Å; I465-S468 PolarHBondContact O-OG 2.88Å; I465-G469 PolarHBondContact O-N 3.26Å
466	Y	95.3	Very high	95	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-69.1	-46.1	178.9	-67.7	-52.6	0	0	0	112.9	I132 L137 L141 Y427 S430 T462 S463 F464 G469 V470	I132-Y466 HydrophobicContact CG2-CE2 4.24Å; I132-Y466 PolarHBondContact O-OH 3.36Å; L137-Y466 HydrophobicContact CB-CE1 4.07Å; L137-Y466 HydrophobicContact CD1-CD1 3.96Å; L137-Y466 HydrophobicContact CD1-CE1 3.77Å; L137-Y466 HydrophobicContact CG-CE1 4.38Å; L141-Y466 HydrophobicContact CD2-CD1 4.04Å; Y427-Y466 WeakPolarHBondContact OH-CB 3.43Å; Y427-Y466 WeakPolarHBondContact OH-CD2 3.41Å; S430-Y466 WeakPolarHBondContact O-CE2 3.3Å; S430-Y466 PolarHBondContact O-OH 2.93Å; T462-Y466 WeakPolarHBondContact O-CD2 3.38Å; T462-Y466 PolarHBondContact O-N 2.92Å; S463-Y466 PolarHBondContact O-N 3.49Å; F464-Y466 PolarHBondContact O-N 3.02Å; Y466-G469 PolarHBondContact O-N 2.97Å; Y466-V470 WeakPolarHBondContact O-CG2 3.28Å; Y466-V470 PolarHBondContact O-N 2.84Å
467	V	95.4	Very high	94.9	Very high	56 Å²	56	26.7 Å²	26.7	34%	0.339	15%	0.149	S	C	.	.	H	α-helix	trans	-64.1	-44.3	178.9	168	0	0	0	0	111.5	L154 V157 S463 I471	L154-V467 HydrophobicContact CD2-CB 4.5Å; L154-V467 HydrophobicContact CD2-CG1 3.93Å; V157-V467 HydrophobicContact CG1-CG2 3.74Å; S463-V467 WeakPolarHBondContact O-CB 3.41Å; S463-V467 VanDerWaalsContact O-CG2 3.29Å; S463-V467 WeakPolarHBondContact O-CG2 3.46Å; S463-V467 PolarHBondContact O-N 3.3Å; V467-I471 HydrophobicContact CG1-CD1 4.4Å; V467-I471 WeakPolarHBondContact O-CG1 3.43Å; V467-I471 PolarHBondContact O-N 3.16Å
468	S	95.6	Very high	94.8	Very high	17 Å²	17	23.2 Å²	23.2	12%	0.119	13%	0.131	C	C	.	.	H	α-helix	trans	-66.6	-41.4	175.1	58.5	0	0	0	0	111.8	Y292 F464 I465 V470 I471 L472	Y292-S468 PolarHBondContact OH-OG 3.18Å; F464-S468 WeakPolarHBondContact O-CB 3.18Å; F464-S468 PolarHBondContact O-N 3.45Å; F464-S468 PolarHBondContact O-OG 3.48Å; I465-S468 PolarHBondContact O-OG 2.88Å; S468-V470 PolarHBondContact O-N 3.04Å; S468-I471 PolarHBondContact O-N 2.97Å; S468-L472 WeakPolarHBondContact O-CB 3.37Å; S468-L472 WeakPolarHBondContact O-CG 3.34Å; S468-L472 PolarHBondContact O-N 3.27Å
469	G	93.6	Very high	94.7	Very high	4 Å²	4	23.7 Å²	23.7	4%	0.041	14%	0.135	C	C	.	.	H	α-helix	trans	-55.4	-48	175.4	0	0	0	0	0	112.9	I465 Y466 I471 L472 F473	I465-G469 PolarHBondContact O-N 3.26Å; Y466-G469 PolarHBondContact O-N 2.97Å; G469-I471 VanDerWaalsContact C-N 3.35Å; G469-I471 PolarHBondContact O-N 3.42Å; G469-L472 PolarHBondContact O-N 3.46Å; G469-F473 WeakPolarHBondContact O-CB 3.16Å; G469-F473 WeakPolarHBondContact O-CD2 3.31Å; G469-F473 WeakPolarHBondContact O-CG 3.14Å; G469-F473 PolarHBondContact O-N 3.47Å
470	V	96.1	Very high	94.5	Very high	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-55.4	-47.7	176.9	165.6	0	0	0	0	112.1	L141 V145 I150 L154 V157 Y466 S468 G474	L141-V470 HydrophobicContact CD1-CG2 3.91Å; V145-V470 HydrophobicContact CG2-CB 4.15Å; V145-V470 HydrophobicContact CG2-CG1 4.09Å; V145-V470 HydrophobicContact CG2-CG2 3.9Å; I150-V470 HydrophobicContact CG2-CG1 4.34Å; L154-V470 HydrophobicContact CD2-CB 4.2Å; L154-V470 HydrophobicContact CD2-CG1 3.87Å; L154-V470 HydrophobicContact CG-CG1 3.81Å; V157-V470 HydrophobicContact CG2-CG2 3.92Å; Y466-V470 WeakPolarHBondContact O-CG2 3.28Å; Y466-V470 PolarHBondContact O-N 2.84Å; S468-V470 PolarHBondContact O-N 3.04Å; V470-G474 PolarHBondContact O-N 3.02Å
471	I	95.3	Very high	94.4	Very high	67 Å²	67	21.5 Å²	21.5	34%	0.344	12%	0.117	S	C	.	.	H	α-helix	trans	-67.9	-44.9	-179	-62.5	169.4	0	0	0	110.6	L154 V467 S468 G469 A475	L154-I471 HydrophobicContact CD1-CD1 4.48Å; L154-I471 HydrophobicContact CD1-CG1 4.22Å; L154-I471 HydrophobicContact CD2-CD1 4.4Å; L154-I471 HydrophobicContact CD2-CG1 4.18Å; V467-I471 HydrophobicContact CG1-CD1 4.4Å; V467-I471 WeakPolarHBondContact O-CG1 3.43Å; V467-I471 PolarHBondContact O-N 3.16Å; S468-I471 PolarHBondContact O-N 2.97Å; G469-I471 VanDerWaalsContact C-N 3.35Å; G469-I471 PolarHBondContact O-N 3.42Å; I471-A475 VanDerWaalsContact O-CB 3.25Å; I471-A475 WeakPolarHBondContact O-CB 3.45Å; I471-A475 PolarHBondContact O-N 3.4Å
472	L	94.8	Very high	94.3	Very high	37 Å²	37	19.5 Å²	19.5	19%	0.194	11%	0.105	C	C	.	.	H	α-helix	trans	-71.6	-38.6	-174.5	-65.5	172.7	0	0	0	112.6	Y292 V295 S468 G469 A475 C476	Y292-L472 HydrophobicContact CD1-CD1 3.97Å; Y292-L472 HydrophobicContact CE1-CD1 3.72Å; V295-L472 HydrophobicContact CG1-CB 4.28Å; V295-L472 HydrophobicContact CG1-CD1 4.16Å; V295-L472 HydrophobicContact CG1-CD2 3.86Å; V295-L472 HydrophobicContact CG1-CG 4.3Å; V295-L472 HydrophobicContact CG2-CB 4.24Å; S468-L472 WeakPolarHBondContact O-CB 3.37Å; S468-L472 WeakPolarHBondContact O-CG 3.34Å; S468-L472 PolarHBondContact O-N 3.27Å; G469-L472 PolarHBondContact O-N 3.46Å; L472-A475 PolarHBondContact O-N 3.22Å; L472-C476 WeakPolarHBondContact O-CB 3.41Å; L472-C476 PolarHBondContact O-N 2.95Å; L472-C476 PolarHBondContact O-SG 2.98Å
473	F	94.5	Very high	94.1	Very high	5 Å²	5	21.3 Å²	21.3	2%	0.022	11%	0.111	C	C	.	.	H	α-helix	trans	-67.6	-44.5	176.4	-55.4	-23.3	0	0	0	111.2	L141 T142 I291 G469 A475 C476 I477 L482 I496 L499	L141-F473 HydrophobicContact CB-CE2 4.46Å; L141-F473 HydrophobicContact CD2-CE2 3.87Å; L141-F473 HydrophobicContact CG-CD2 4.31Å; L141-F473 HydrophobicContact CG-CE2 4.01Å; T142-F473 HydrophobicContact CG2-CD2 3.91Å; T142-F473 HydrophobicContact CG2-CE2 4.4Å; T142-F473 HydrophobicContact CG2-CG 4.2Å; I291-F473 HydrophobicContact CG2-CE1 3.78Å; I291-F473 HydrophobicContact CG2-CZ 4.25Å; G469-F473 WeakPolarHBondContact O-CB 3.16Å; G469-F473 WeakPolarHBondContact O-CD2 3.31Å; G469-F473 WeakPolarHBondContact O-CG 3.14Å; G469-F473 PolarHBondContact O-N 3.47Å; F473-A475 PolarHBondContact O-N 3.49Å; F473-C476 PolarHBondContact O-N 3.05Å; F473-I477 HydrophobicContact CB-CD1 4.43Å; F473-I477 WeakPolarHBondContact O-CB 3.06Å; F473-I477 PolarHBondContact O-N 2.88Å; F473-I477 VanDerWaalsContact O-N 3.09Å; F473-L482 HydrophobicContact CB-CD2 4.33Å; F473-I496 HydrophobicContact CE1-CD1 3.94Å; F473-I496 HydrophobicContact CE1-CG1 3.99Å; F473-I496 HydrophobicContact CE2-CD1 3.69Å; F473-I496 HydrophobicContact CE2-CG1 4.38Å; F473-I496 HydrophobicContact CZ-CD1 3.31Å; F473-I496 HydrophobicContact CZ-CG1 3.89Å; F473-L499 HydrophobicContact CD1-CD2 4.01Å; F473-L499 HydrophobicContact CE1-CD2 4.42Å
474	G	93.7	Very high	93.8	Very high	0 Å²	0	20.5 Å²	20.5	0%	0	11%	0.105	C	C	.	.	H	α-helix	trans	-65.2	-22.7	175.2	0	0	0	0	0	113.8	I375 N378 V470	I375-G474 WeakPolarHBondContact CA-O 3.04Å; N378-G474 PolarHBondContact ND2-O 3.4Å; V470-G474 PolarHBondContact O-N 3.02Å
475	A	93.9	Very high	93.4	Very high	7 Å²	7	14.6 Å²	14.6	6%	0.058	8%	0.08	C	C	.	.	H	α-helix	trans	-89.6	-26.2	177.2	0	0	0	0	0	114.8	L370 I375 I471 L472 F473	L370-A475 HydrophobicContact CD1-CB 3.77Å; I375-A475 HydrophobicContact CB-CB 3.96Å; I375-A475 HydrophobicContact CD1-CB 4.1Å; I375-A475 HydrophobicContact CG1-CB 4.08Å; I471-A475 VanDerWaalsContact O-CB 3.25Å; I471-A475 WeakPolarHBondContact O-CB 3.45Å; I471-A475 PolarHBondContact O-N 3.4Å; L472-A475 PolarHBondContact O-N 3.22Å; F473-A475 PolarHBondContact O-N 3.49Å
476	C	93.9	Very high	93	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-102.6	-26.6	-174.5	-59.7	0	0	0	0	114.8	I367 G369 L472 F473 L499	I367-C476 WeakPolarHBondContact CG2-O 3.29Å; G369-C476 PolarHBondContact N-O 3.43Å; L472-C476 WeakPolarHBondContact O-CB 3.41Å; L472-C476 PolarHBondContact O-N 2.95Å; L472-C476 PolarHBondContact O-SG 2.98Å; F473-C476 PolarHBondContact O-N 3.05Å; C476-L499 HydrophobicContact CB-CD1 4.04Å; C476-L499 HydrophobicContact CB-CD2 4.37Å
477	I	94	Very high	92.7	Very high	0 Å²	0	15.4 Å²	15.4	0%	0	8%	0.082	C	C	.	.	S	Bend	trans	-111.6	137.3	-169.4	-50	-179.2	0	0	0	110.5	I367 N378 F473 L481 L482 V495 L499	I367-I477 HydrophobicContact CG1-CG1 4.49Å; N378-I477 PolarHBondContact ND2-O 3.19Å; F473-I477 HydrophobicContact CB-CD1 4.43Å; F473-I477 WeakPolarHBondContact O-CB 3.06Å; F473-I477 PolarHBondContact O-N 2.88Å; F473-I477 VanDerWaalsContact O-N 3.09Å; I477-L481 HydrophobicContact CG2-CB 4.04Å; I477-L481 HydrophobicContact CG2-CD2 3.93Å; I477-L481 HydrophobicContact CG2-CG 3.98Å; I477-L482 HydrophobicContact CB-CD1 4.34Å; I477-L482 HydrophobicContact CB-CD2 3.8Å; I477-L482 HydrophobicContact CB-CG 3.87Å; I477-L482 HydrophobicContact CD1-CD2 3.93Å; I477-L482 HydrophobicContact CG1-CD2 4.38Å; I477-L482 HydrophobicContact CG2-CD2 3.87Å; I477-L482 HydrophobicContact CG2-CG 3.79Å; I477-V495 HydrophobicContact CD1-CG1 4.15Å; I477-V495 HydrophobicContact CG2-CG1 4.36Å; I477-L499 HydrophobicContact CD1-CD2 4.05Å; I477-L499 HydrophobicContact CG1-CD2 4.24Å
478	E	93.4	Very high	92.3	Very high	18 Å²	18	14.1 Å²	14.1	8%	0.084	7%	0.074	C	C	.	.			trans	-63.8	138.4	177.4	-176.9	64.1	-164.7	0	0	112.2	I364 G366 N392 V480 L481 L482	I364-E478 HydrophobicContact CD1-CG 4.24Å; G366-E478 WeakPolarHBondContact O-CB 3.26Å; G366-E478 PolarHBondContact O-N 3.41Å; N392-E478 PolarHBondContact ND2-OE1 2.92Å; E478-V480 VanDerWaalsContact C-N 3.27Å; E478-V480 HydrophobicContact CG-CG2 3.8Å; E478-V480 PolarHBondContact O-N 3.18Å; E478-V480 VanDerWaalsContact O-N 3.15Å; E478-L481 PolarHBondContact O-N 3.44Å; E478-L482 PolarHBondContact O-N 3.04Å
479	G	91.5	Very high	92	Very high	9 Å²	9	13.3 Å²	13.3	9%	0.093	7%	0.068	C	C	.	.	H	α-helix	trans	-63.7	-21.1	-173	0	0	0	0	0	115.9	N378 R483	N378-G479 WeakPolarHBondContact OD1-CA 3.43Å; G479-R483 PolarHBondContact O-NE 3.37Å; G479-R483 PolarHBondContact O-NH2 3.27Å
480	V	91.9	Very high	91.8	Very high	1 Å²	1	13.3 Å²	13.3	1%	0.006	7%	0.067	C	C	.	.	H	α-helix	trans	-72.1	-38.2	169.2	-68.9	0	0	0	0	112.1	V307 M309 I364 V390 N392 E478 R483 D484	V307-V480 HydrophobicContact CG1-CG2 4.46Å; M309-V480 HydrophobicContact CE-CG1 4.28Å; M309-V480 HydrophobicContact SD-CG2 4.4Å; I364-V480 HydrophobicContact CD1-CG2 3.95Å; V390-V480 HydrophobicContact CG1-CB 3.99Å; V390-V480 HydrophobicContact CG1-CG1 4.06Å; N392-V480 HydrophobicContact CB-CG1 3.78Å; E478-V480 VanDerWaalsContact C-N 3.27Å; E478-V480 HydrophobicContact CG-CG2 3.8Å; E478-V480 PolarHBondContact O-N 3.18Å; E478-V480 VanDerWaalsContact O-N 3.15Å; V480-R483 PolarHBondContact O-N 3.48Å; V480-D484 PolarHBondContact O-N 3.39Å
481	L	92.9	Very high	91.3	Very high	0 Å²	0	19 Å²	19	0%	0	9%	0.092	C	C	.	.	H	α-helix	trans	-75.1	-33.4	-179.6	-179.5	57	0	0	0	111.6	I367 I477 E478 R483 D484 V490 V495	I367-L481 HydrophobicContact CG1-CD2 4.48Å; I477-L481 HydrophobicContact CG2-CB 4.04Å; I477-L481 HydrophobicContact CG2-CD2 3.93Å; I477-L481 HydrophobicContact CG2-CG 3.98Å; E478-L481 PolarHBondContact O-N 3.44Å; L481-R483 VanDerWaalsContact C-N 3.27Å; L481-R483 PolarHBondContact O-N 3.2Å; L481-D484 PolarHBondContact O-N 3.24Å; L481-V490 HydrophobicContact CD1-CB 4.36Å; L481-V490 HydrophobicContact CD1-CG1 3.62Å; L481-V490 HydrophobicContact CD1-CG2 3.79Å; L481-V490 HydrophobicContact CD2-CG1 3.88Å; L481-V490 HydrophobicContact CG-CG1 4.43Å; L481-V495 HydrophobicContact CD1-CG1 4.49Å; L481-V495 HydrophobicContact CD1-CG2 3.97Å; L481-V495 HydrophobicContact CG-CG1 4.06Å; L481-V495 HydrophobicContact CG-CG2 4.43Å
482	L	92.8	Very high	90.7	Very high	0 Å²	0	16.7 Å²	16.7	0%	0	9%	0.085	C	C	.	.	H	α-helix	trans	-64	-30.4	171.7	-71.8	173.3	0	0	0	113.1	T142 W143 V145 N378 F473 I477 E478	T142-L482 HydrophobicContact CG2-CD2 4.34Å; W143-L482 VanDerWaalsContact CA-O 3.31Å; W143-L482 WeakPolarHBondContact CA-O 3.45Å; V145-L482 HydrophobicContact CG1-CD1 4.29Å; N378-L482 WeakPolarHBondContact ND2-CD1 3.24Å; F473-L482 HydrophobicContact CB-CD2 4.33Å; I477-L482 HydrophobicContact CB-CD1 4.34Å; I477-L482 HydrophobicContact CB-CD2 3.8Å; I477-L482 HydrophobicContact CB-CG 3.87Å; I477-L482 HydrophobicContact CD1-CD2 3.93Å; I477-L482 HydrophobicContact CG1-CD2 4.38Å; I477-L482 HydrophobicContact CG2-CD2 3.87Å; I477-L482 HydrophobicContact CG2-CG 3.79Å; E478-L482 PolarHBondContact O-N 3.04Å
483	R	91.9	Very high	90.5	Very high	41 Å²	41	17.2 Å²	17.2	16%	0.155	9%	0.088	C	C	.	.	H	α-helix	trans	-82.4	-15.2	178.5	-75.2	176.4	-70.2	157.5	0.7	113.5	G146 T147 V390 E391 G479 V480 L481 K485	G146-R483 WeakPolarHBondContact O-CD 3.41Å; G146-R483 WeakPolarHBondContact O-CG 3.29Å; T147-R483 HydrophobicContact CG2-CG 4.41Å; V390-R483 HydrophobicContact CG1-CB 4.12Å; V390-R483 HydrophobicContact CG2-CB 4.39Å; E391-R483 PolarHBondContact O-NH1 3.43Å; E391-R483 PolarHBondContact O-NH2 3.1Å; G479-R483 PolarHBondContact O-NE 3.37Å; G479-R483 PolarHBondContact O-NH2 3.27Å; V480-R483 PolarHBondContact O-N 3.48Å; L481-R483 VanDerWaalsContact C-N 3.27Å; L481-R483 PolarHBondContact O-N 3.2Å; R483-K485 PolarHBondContact O-N 3.03Å
484	D	89.6	Confident	90.3	Very high	4 Å²	4	17.2 Å²	17.2	2%	0.021	9%	0.088	C	C	.	.			trans	-77.6	108.4	173.9	-172.2	-18.4	0	0	0	110.4	V412 V480 L481 F486 G487 D488 S489	V412-D484 HydrophobicContact CG1-CB 4.24Å; V480-D484 PolarHBondContact O-N 3.39Å; L481-D484 PolarHBondContact O-N 3.24Å; D484-F486 PolarHBondContact OD1-N 3.07Å; D484-G487 PolarHBondContact OD1-N 3.28Å; D484-D488 PolarHBondContact OD1-N 3.22Å; D484-D488 PolarHBondContact OD2-N 3.45Å; D484-S489 VanDerWaalsContact OD2-CB 3.22Å; D484-S489 WeakPolarHBondContact OD2-CB 3.38Å; D484-S489 PolarHBondContact OD2-N 2.98Å; D484-S489 PolarHBondContact OD2-OG 3.46Å
485	K	85.9	Confident	90.2	Very high	20 Å²	20	17.5 Å²	17.5	9%	0.087	9%	0.089	C	C	.	.	S	Bend	trans	-70.4	-32.9	-175.9	177	-179.2	162	-173.7	0	113.2	R140 W143 D415 R483 D575	R140-K485 VanDerWaalsContact CZ-CE 3.49Å; W143-K485 HydrophobicContact CG-CB 4.37Å; D415-K485 HydrophobicContact CB-CD 4.38Å; D415-K485 IonicContact OD2-NZ 2.75Å; D415-K485 PolarHBondContact OD2-NZ 3.39Å; R483-K485 PolarHBondContact O-N 3.03Å; K485-D575 WeakPolarHBondContact CE-OD2 3.32Å; K485-D575 IonicContact NZ-OD2 3.53Å; K485-D575 PolarHBondContact NZ-OD2 3.29Å
486	F	87.8	Confident	90.1	Very high	37 Å²	37	17.1 Å²	17.1	16%	0.162	9%	0.087	C	C	.	.	S	Bend	trans	-109.1	-10.3	-172.5	-60.4	-64.6	0	0	0	113.3	T226 Y227 D415 D484	T226-F486 HydrophobicContact CG2-CB 4.5Å; T226-F486 HydrophobicContact CG2-CD1 4.46Å; Y227-F486 WeakPolarHBondContact CE1-O 3.25Å; Y227-F486 PolarHBondContact OH-O 3.41Å; D415-F486 HydrophobicContact CB-CE2 4.46Å; D484-F486 PolarHBondContact OD1-N 3.07Å
487	G	88.1	Confident	90	Very high	0 Å²	0	17.1 Å²	17.1	0%	0	9%	0.087	C	C	.	.			trans	79.2	24.3	-179.8	0	0	0	0	0	113.7	D484 S489 V490 G492	D484-G487 PolarHBondContact OD1-N 3.28Å; G487-S489 PolarHBondContact O-N 3.23Å; G487-V490 CarbonylContact O-C 3.55Å; G487-V490 VanDerWaalsContact O-CG2 3.3Å; G487-V490 WeakPolarHBondContact O-CG2 3.16Å; G487-V490 PolarHBondContact O-N 3.27Å; G487-G492 WeakPolarHBondContact O-CA 3.34Å; G487-G492 PolarHBondContact O-N 3.32Å
488	D	87.8	Confident	89.9	Confident	30 Å²	30	17.2 Å²	17.2	16%	0.16	9%	0.087	C	C	.	.	G	3₁₀ helix	trans	-54.7	-35.9	177.8	-74.7	-8.9	0	0	0	111.8	Q316 N317 L318 V412 D484 V490	Q316-D488 HydrophobicContact CB-CB 4.25Å; Q316-D488 HydrophobicContact CG-CB 3.99Å; Q316-D488 PolarHBondContact NE2-OD2 3.24Å; N317-D488 WeakPolarHBondContact CA-O 3.32Å; N317-D488 WeakPolarHBondContact CB-O 3.39Å; N317-D488 PolarHBondContact N-O 3.38Å; L318-D488 HydrophobicContact CD1-CB 4.37Å; V412-D488 HydrophobicContact CG2-CB 4.4Å; D484-D488 PolarHBondContact OD1-N 3.22Å; D484-D488 PolarHBondContact OD2-N 3.45Å; D488-V490 PolarHBondContact O-N 3.25Å
489	S	88.3	Confident	89.8	Confident	0 Å²	0	16.5 Å²	16.5	0%	0	8%	0.084	C	C	.	.	G	3₁₀ helix	trans	-61.4	-27.3	177	-54.2	0	0	0	0	113.6	T314 N317 D484 G487	T314-S489 WeakPolarHBondContact CG2-OG 3.45Å; N317-S489 WeakPolarHBondContact CB-O 3.45Å; N317-S489 PolarHBondContact ND2-O 3.4Å; N317-S489 VanDerWaalsContact ND2-O 3.12Å; D484-S489 VanDerWaalsContact OD2-CB 3.22Å; D484-S489 WeakPolarHBondContact OD2-CB 3.38Å; D484-S489 PolarHBondContact OD2-N 2.98Å; D484-S489 PolarHBondContact OD2-OG 3.46Å; G487-S489 PolarHBondContact O-N 3.23Å
490	V	89.4	Confident	89.9	Confident	3 Å²	3	16.7 Å²	16.7	2%	0.018	8%	0.083	C	C	.	.	G	3₁₀ helix	trans	-118.8	38.9	-173.8	-69.7	0	0	0	0	111.8	F305 V307 L481 G487 D488 G492 N493 T498	F305-V490 HydrophobicContact CB-CG1 4.39Å; V307-V490 HydrophobicContact CG2-CG1 4.06Å; L481-V490 HydrophobicContact CD1-CB 4.36Å; L481-V490 HydrophobicContact CD1-CG1 3.62Å; L481-V490 HydrophobicContact CD1-CG2 3.79Å; L481-V490 HydrophobicContact CD2-CG1 3.88Å; L481-V490 HydrophobicContact CG-CG1 4.43Å; G487-V490 CarbonylContact O-C 3.55Å; G487-V490 VanDerWaalsContact O-CG2 3.3Å; G487-V490 WeakPolarHBondContact O-CG2 3.16Å; G487-V490 PolarHBondContact O-N 3.27Å; D488-V490 PolarHBondContact O-N 3.25Å; V490-G492 VanDerWaalsContact C-N 3.33Å; V490-G492 PolarHBondContact O-N 3.14Å; V490-N493 HydrophobicContact CG2-CB 4.19Å; V490-N493 WeakPolarHBondContact CG2-O 3.27Å; V490-N493 WeakPolarHBondContact O-CB 3.36Å; V490-N493 PolarHBondContact O-N 3.49Å; V490-N493 PolarHBondContact O-ND2 3.23Å; V490-T498 HydrophobicContact CG2-CG2 4.29Å
491	K	84.9	Confident	89.9	Confident	120 Å²	120	23.3 Å²	23.3	52%	0.522	11%	0.108	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.5	34.6	176.8	-48.6	-164.5	169.6	-167.9	0	114	N317 N493	N317-K491 HydrophobicContact CB-CG 4.36Å; N317-K491 WeakPolarHBondContact O-CA 3.48Å; N317-K491 WeakPolarHBondContact O-CG 3.35Å; N317-K491 WeakPolarHBondContact OD1-CE 3.36Å; K491-N493 VanDerWaalsContact C-N 3.32Å; K491-N493 PolarHBondContact O-N 3.44Å
492	G	84.1	Confident	89.9	Confident	19 Å²	19	27.5 Å²	27.5	20%	0.196	14%	0.136	C	C	.	.	T	Hydrogen-bonded Turn	trans	70.3	25.4	-178.1	0	0	0	0	0	113.6	Y227 G487 V490	Y227-G492 VanDerWaalsContact CD1-O 3.29Å; Y227-G492 WeakPolarHBondContact CD1-O 3.3Å; G487-G492 WeakPolarHBondContact O-CA 3.34Å; G487-G492 PolarHBondContact O-N 3.32Å; V490-G492 VanDerWaalsContact C-N 3.33Å; V490-G492 PolarHBondContact O-N 3.14Å
493	N	90	Very high	89.9	Confident	48 Å²	48	29.5 Å²	29.5	26%	0.257	15%	0.15	S	C	.	.			trans	-85	135.7	169.7	-73.5	-80.8	0	0	0	110.5	V490 K491 V495 T498	V490-N493 HydrophobicContact CG2-CB 4.19Å; V490-N493 WeakPolarHBondContact CG2-O 3.27Å; V490-N493 WeakPolarHBondContact O-CB 3.36Å; V490-N493 PolarHBondContact O-N 3.49Å; V490-N493 PolarHBondContact O-ND2 3.23Å; K491-N493 VanDerWaalsContact C-N 3.32Å; K491-N493 PolarHBondContact O-N 3.44Å; N493-V495 PolarHBondContact O-N 2.99Å; N493-T498 HydrophobicContact CB-CG2 3.55Å
494	L	90.6	Very high	89.9	Confident	5 Å²	5	28.6 Å²	28.6	3%	0.026	15%	0.149	C	C	.	.			trans	-62.1	123.9	176.9	-163.4	166.6	0	0	0	109.9	L139 Y227 I496 G497 T498 V508	L139-L494 HydrophobicContact CD1-CD1 4.34Å; Y227-L494 HydrophobicContact CD1-CB 3.85Å; Y227-L494 HydrophobicContact CD2-CB 4.25Å; Y227-L494 HydrophobicContact CD2-CD1 3.71Å; Y227-L494 HydrophobicContact CD2-CG 4.2Å; Y227-L494 HydrophobicContact CE1-CB 3.66Å; Y227-L494 HydrophobicContact CE1-CG 4.14Å; Y227-L494 HydrophobicContact CE2-CB 4.12Å; Y227-L494 HydrophobicContact CE2-CD1 3.61Å; Y227-L494 HydrophobicContact CE2-CG 3.78Å; Y227-L494 HydrophobicContact CG-CB 4.15Å; Y227-L494 HydrophobicContact CG-CD1 4.33Å; L494-I496 HydrophobicContact CD2-CB 4.23Å; L494-I496 HydrophobicContact CD2-CG2 3.43Å; L494-I496 VanDerWaalsContact CD2-CG2 3.43Å; L494-I496 PolarHBondContact O-N 3.4Å; L494-G497 VanDerWaalsContact O-CA 3.24Å; L494-G497 WeakPolarHBondContact O-CA 3.48Å; L494-G497 PolarHBondContact O-N 2.82Å; L494-T498 PolarHBondContact O-N 2.66Å; L494-T498 VanDerWaalsContact O-N 3.16Å; L494-V508 HydrophobicContact CB-CG2 4.37Å
495	V	91.8	Very high	90	Very high	5 Å²	5	34.4 Å²	34.4	3%	0.03	17%	0.171	C	C	.	.	H	α-helix	trans	-56.4	-42	-168.4	178.3	0	0	0	0	114.2	T142 I477 L481 N493 G497 T498	T142-V495 HydrophobicContact CG2-CG1 4.25Å; I477-V495 HydrophobicContact CD1-CG1 4.15Å; I477-V495 HydrophobicContact CG2-CG1 4.36Å; L481-V495 HydrophobicContact CD1-CG1 4.49Å; L481-V495 HydrophobicContact CD1-CG2 3.97Å; L481-V495 HydrophobicContact CG-CG1 4.06Å; L481-V495 HydrophobicContact CG-CG2 4.43Å; N493-V495 PolarHBondContact O-N 2.99Å; V495-G497 PolarHBondContact O-N 3.08Å; V495-T498 PolarHBondContact O-OG1 2.98Å
496	I	91.7	Very high	90.3	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-72.1	-20.4	175.8	-152.9	176.2	0	0	0	112.3	T142 I291 F473 L494 I507	T142-I496 HydrophobicContact CG2-CB 3.97Å; T142-I496 HydrophobicContact CG2-CG1 4.21Å; I291-I496 HydrophobicContact CD1-CD1 3.73Å; I291-I496 HydrophobicContact CD1-CG1 4.11Å; I291-I496 HydrophobicContact CG1-CD1 4.42Å; I291-I496 HydrophobicContact CG1-CG1 4.29Å; F473-I496 HydrophobicContact CE1-CD1 3.94Å; F473-I496 HydrophobicContact CE1-CG1 3.99Å; F473-I496 HydrophobicContact CE2-CD1 3.69Å; F473-I496 HydrophobicContact CE2-CG1 4.38Å; F473-I496 HydrophobicContact CZ-CD1 3.31Å; F473-I496 HydrophobicContact CZ-CG1 3.89Å; L494-I496 HydrophobicContact CD2-CB 4.23Å; L494-I496 HydrophobicContact CD2-CG2 3.43Å; L494-I496 VanDerWaalsContact CD2-CG2 3.43Å; L494-I496 PolarHBondContact O-N 3.4Å; I496-I507 HydrophobicContact CG2-CG2 3.76Å
497	G	91.1	Very high	90.6	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-73.9	-39.2	176	0	0	0	0	0	112.6	L494 V495 L499 S500 P504	L494-G497 VanDerWaalsContact O-CA 3.24Å; L494-G497 WeakPolarHBondContact O-CA 3.48Å; L494-G497 PolarHBondContact O-N 2.82Å; V495-G497 PolarHBondContact O-N 3.08Å; G497-L499 PolarHBondContact O-N 2.73Å; G497-S500 WeakPolarHBondContact O-CB 3.47Å; G497-S500 PolarHBondContact O-N 2.89Å; G497-S500 PolarHBondContact O-OG 3.32Å; G497-P504 VanDerWaalsContact O-CA 3.31Å; G497-P504 WeakPolarHBondContact O-CA 3.2Å; G497-P504 WeakPolarHBondContact O-CB 3.24Å; G497-P504 WeakPolarHBondContact O-CG 3.3Å
498	T	91.3	Very high	90.8	Very high	2 Å²	2	34.4 Å²	34.4	1%	0.012	18%	0.175	C	C	.	.	H	α-helix	trans	-62.8	-24.6	177.2	57	0	0	0	0	113	F305 I367 V490 N493 L494 V495	F305-T498 HydrophobicContact CD1-CG2 3.86Å; F305-T498 HydrophobicContact CD2-CG2 4.24Å; F305-T498 HydrophobicContact CE1-CG2 3.71Å; F305-T498 HydrophobicContact CE2-CG2 4.09Å; F305-T498 VanDerWaalsContact CE2-O 3.29Å; F305-T498 WeakPolarHBondContact CE2-O 3.37Å; F305-T498 HydrophobicContact CG-CG2 4.12Å; F305-T498 HydrophobicContact CZ-CG2 3.83Å; I367-T498 VanDerWaalsContact CD1-C 3.44Å; I367-T498 WeakPolarHBondContact CD1-O 3.39Å; I367-T498 WeakPolarHBondContact CD1-OG1 3.35Å; V490-T498 HydrophobicContact CG2-CG2 4.29Å; N493-T498 HydrophobicContact CB-CG2 3.55Å; L494-T498 PolarHBondContact O-N 2.66Å; L494-T498 VanDerWaalsContact O-N 3.16Å; V495-T498 PolarHBondContact O-OG1 2.98Å
499	L	91.9	Very high	91	Very high	3 Å²	3	37.1 Å²	37.1	2%	0.016	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-21.1	172.7	-175.8	58.2	0	0	0	113.8	G294 V295 I367 F473 C476 I477 G497	G294-L499 CarbonylContact C-O 3.6Å; G294-L499 WeakPolarHBondContact CA-O 3.46Å; V295-L499 HydrophobicContact CG2-CD2 3.78Å; V295-L499 HydrophobicContact CG2-CG 4.21Å; I367-L499 HydrophobicContact CD1-CB 4.05Å; I367-L499 HydrophobicContact CD1-CD1 4.43Å; I367-L499 HydrophobicContact CG2-CD1 4.02Å; F473-L499 HydrophobicContact CD1-CD2 4.01Å; F473-L499 HydrophobicContact CE1-CD2 4.42Å; C476-L499 HydrophobicContact CB-CD1 4.04Å; C476-L499 HydrophobicContact CB-CD2 4.37Å; I477-L499 HydrophobicContact CD1-CD2 4.05Å; I477-L499 HydrophobicContact CG1-CD2 4.24Å; G497-L499 PolarHBondContact O-N 2.73Å
500	S	93.6	Very high	91.1	Very high	12 Å²	12	37.3 Å²	37.3	8%	0.084	19%	0.191	C	C	.	.			trans	-79.2	148	-169.3	72.4	0	0	0	0	114.3	G497 S503 I507	G497-S500 WeakPolarHBondContact O-CB 3.47Å; G497-S500 PolarHBondContact O-N 2.89Å; G497-S500 PolarHBondContact O-OG 3.32Å; S500-S503 PolarHBondContact OG-O 3.49Å; S500-I507 WeakPolarHBondContact OG-CG1 3.43Å
501	W	92.8	Very high	91.2	Very high	140 Å²	140	37.2 Å²	37.2	53%	0.53	19%	0.19	S	C	.	.	S	Bend	trans	-115.1	137.3	171.8	179	86.8	0	0	0	109.8	S290 A293 K297	S290-W501 WeakPolarHBondContact CA-O 3.37Å; S290-W501 VanDerWaalsContact CB-O 3.26Å; S290-W501 WeakPolarHBondContact CB-O 3.49Å; S290-W501 PolarHBondContact O-N 3.01Å; S290-W501 VanDerWaalsContact O-N 3.08Å; A293-W501 HydrophobicContact CB-CB 4.48Å; A293-W501 HydrophobicContact CB-CE3 4Å; K297-W501 HydrophobicContact CD-CB 4.42Å; K297-W501 HydrophobicContact CD-CG 4.14Å
502	P	92.1	Very high	91.6	Very high	88 Å²	88	33.7 Å²	33.7	57%	0.571	18%	0.175	S	C	*	.	S	Bend	cis	-89.1	-13.2	9.5	34.4	-38	0	0	0	116.5	V506	P502-V506 HydrophobicContact CG-CG2 4.38Å
503	S	92.9	Very high	91.9	Very high	42 Å²	42	36.9 Å²	36.9	29%	0.294	18%	0.184	S	C	.	.			trans	-158	144.1	-176.9	-176.3	0	0	0	0	111.9	S500 W505 V506	S500-S503 PolarHBondContact OG-O 3.49Å; S503-W505 PolarHBondContact O-N 3.47Å; S503-W505 VanDerWaalsContact O-N 3.08Å; S503-V506 WeakPolarHBondContact O-CB 3.49Å; S503-V506 WeakPolarHBondContact O-CG2 3.35Å; S503-V506 PolarHBondContact O-N 2.9Å
504	P	91.6	Very high	91.8	Very high	22 Å²	22	34.9 Å²	34.9	14%	0.143	17%	0.174	C	C	.	.	H	α-helix	trans	-52.5	-31.8	175.5	-26.8	34	0	0	0	114.4	F305 G497 V506 I507 V508	F305-P504 HydrophobicContact CZ-CG 4.14Å; G497-P504 VanDerWaalsContact O-CA 3.31Å; G497-P504 WeakPolarHBondContact O-CA 3.2Å; G497-P504 WeakPolarHBondContact O-CB 3.24Å; G497-P504 WeakPolarHBondContact O-CG 3.3Å; P504-V506 PolarHBondContact O-N 3.42Å; P504-I507 PolarHBondContact O-N 3.43Å; P504-I507 VanDerWaalsContact O-N 3.08Å; P504-V508 PolarHBondContact O-N 2.94Å
505	W	92	Very high	91.8	Very high	127 Å²	127	34.7 Å²	34.7	48%	0.481	17%	0.172	S	C	.	.	H	α-helix	trans	-59.7	-26.4	178.9	-72.3	105.9	0	0	0	114.1	S503 I507 V508 I509	S503-W505 PolarHBondContact O-N 3.47Å; S503-W505 VanDerWaalsContact O-N 3.08Å; W505-I507 VanDerWaalsContact C-N 3.29Å; W505-I507 PolarHBondContact O-N 2.88Å; W505-V508 HydrophobicContact CE3-CB 4.25Å; W505-V508 HydrophobicContact CE3-CG1 4.2Å; W505-V508 HydrophobicContact CZ3-CG1 4.17Å; W505-V508 PolarHBondContact O-N 3.38Å; W505-I509 WeakPolarHBondContact O-CB 3.37Å; W505-I509 VanDerWaalsContact O-CG1 3.31Å; W505-I509 WeakPolarHBondContact O-CG1 3.29Å; W505-I509 PolarHBondContact O-N 3.14Å
506	V	93.4	Very high	91.7	Very high	48 Å²	48	35.8 Å²	35.8	29%	0.291	18%	0.18	S	C	.	.	H	α-helix	trans	-61.7	-41.4	176	-180	0	0	0	0	110.4	P502 S503 P504 G510	P502-V506 HydrophobicContact CG-CG2 4.38Å; S503-V506 WeakPolarHBondContact O-CB 3.49Å; S503-V506 WeakPolarHBondContact O-CG2 3.35Å; S503-V506 PolarHBondContact O-N 2.9Å; P504-V506 PolarHBondContact O-N 3.42Å; V506-G510 WeakPolarHBondContact O-CA 3.27Å; V506-G510 PolarHBondContact O-N 3.4Å
507	I	92.9	Very high	91.6	Very high	0 Å²	0	36 Å²	36	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-76.4	-39.5	178.8	-52.3	-54.4	0	0	0	111.4	F138 S287 I291 I496 S500 P504 W505 G510 S511	F138-I507 HydrophobicContact CD1-CG2 3.92Å; F138-I507 HydrophobicContact CE1-CG2 4.47Å; S287-I507 VanDerWaalsContact O-CD1 3.25Å; S287-I507 WeakPolarHBondContact O-CD1 3.46Å; I291-I507 HydrophobicContact CD1-CD1 4.09Å; I291-I507 HydrophobicContact CG1-CD1 3.76Å; I291-I507 HydrophobicContact CG1-CG1 4.39Å; I496-I507 HydrophobicContact CG2-CG2 3.76Å; S500-I507 WeakPolarHBondContact OG-CG1 3.43Å; P504-I507 PolarHBondContact O-N 3.43Å; P504-I507 VanDerWaalsContact O-N 3.08Å; W505-I507 VanDerWaalsContact C-N 3.29Å; W505-I507 PolarHBondContact O-N 2.88Å; I507-G510 PolarHBondContact O-N 3.07Å; I507-S511 WeakPolarHBondContact O-CB 3.45Å; I507-S511 PolarHBondContact O-N 3.32Å; I507-S511 PolarHBondContact O-OG 2.88Å
508	V	92.9	Very high	91.5	Very high	8 Å²	8	36.4 Å²	36.4	5%	0.048	19%	0.186	C	C	.	.	H	α-helix	trans	-59.9	-49.4	176.9	177	0	0	0	0	110.7	I223 I228 L494 P504 W505 S511 F512	I223-V508 HydrophobicContact CG2-CG1 4.13Å; I228-V508 HydrophobicContact CD1-CG1 4.27Å; I228-V508 HydrophobicContact CG1-CG1 3.72Å; L494-V508 HydrophobicContact CB-CG2 4.37Å; P504-V508 PolarHBondContact O-N 2.94Å; W505-V508 HydrophobicContact CE3-CB 4.25Å; W505-V508 HydrophobicContact CE3-CG1 4.2Å; W505-V508 HydrophobicContact CZ3-CG1 4.17Å; W505-V508 PolarHBondContact O-N 3.38Å; V508-S511 PolarHBondContact O-OG 3.47Å; V508-F512 WeakPolarHBondContact O-CB 3.02Å; V508-F512 PolarHBondContact O-N 3.28Å; V508-F512 VanDerWaalsContact O-N 3.11Å
509	I	91.6	Very high	91.4	Very high	88 Å²	88	36.3 Å²	36.3	45%	0.451	19%	0.185	S	C	.	.	H	α-helix	trans	-69.6	-42.9	178.8	-63.8	168.9	0	0	0	111.1	W505 F512 F513	W505-I509 WeakPolarHBondContact O-CB 3.37Å; W505-I509 VanDerWaalsContact O-CG1 3.31Å; W505-I509 WeakPolarHBondContact O-CG1 3.29Å; W505-I509 PolarHBondContact O-N 3.14Å; I509-F512 PolarHBondContact O-N 3.27Å; I509-F513 HydrophobicContact CG2-CD2 3.76Å; I509-F513 HydrophobicContact CG2-CE2 3.71Å; I509-F513 WeakPolarHBondContact O-CD2 3.29Å; I509-F513 PolarHBondContact O-N 3.24Å; I509-F513 VanDerWaalsContact O-N 3.11Å
510	G	90.9	Very high	91.3	Very high	4 Å²	4	36.7 Å²	36.7	4%	0.041	19%	0.187	C	C	.	.	H	α-helix	trans	-65.2	-42.5	-179	0	0	0	0	0	113.5	S287 V506 I507 S514	S287-G510 WeakPolarHBondContact OG-CA 3.47Å; V506-G510 WeakPolarHBondContact O-CA 3.27Å; V506-G510 PolarHBondContact O-N 3.4Å; I507-G510 PolarHBondContact O-N 3.07Å; G510-S514 VanDerWaalsContact O-CB 3.27Å; G510-S514 WeakPolarHBondContact O-CB 3.27Å; G510-S514 PolarHBondContact O-N 3.45Å
511	S	90.9	Very high	91.1	Very high	0 Å²	0	36.9 Å²	36.9	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-68.8	-37.9	175.1	61.6	0	0	0	0	112.3	I507 V508 S514 C515	I507-S511 WeakPolarHBondContact O-CB 3.45Å; I507-S511 PolarHBondContact O-N 3.32Å; I507-S511 PolarHBondContact O-OG 2.88Å; V508-S511 PolarHBondContact O-OG 3.47Å; S511-S514 WeakPolarHBondContact O-CB 3.25Å; S511-S514 PolarHBondContact O-N 2.91Å; S511-C515 PolarHBondContact O-N 3.17Å; S511-C515 PolarHBondContact O-SG 3.47Å
512	F	92.8	Very high	91	Very high	47 Å²	47	30.6 Å²	30.6	21%	0.206	16%	0.164	C	C	.	.	H	α-helix	trans	-57.7	-52.1	173.9	177.3	-94.9	0	0	0	111.8	T220 I223 L224 I228 V508 I509 S514 C515 C516	T220-F512 HydrophobicContact CG2-CD2 3.81Å; T220-F512 HydrophobicContact CG2-CE2 3.48Å; T220-F512 VanDerWaalsContact CG2-CE2 3.48Å; T220-F512 HydrophobicContact CG2-CZ 4.09Å; I223-F512 HydrophobicContact CG2-CB 4.01Å; I223-F512 HydrophobicContact CG2-CD2 4.33Å; L224-F512 HydrophobicContact CB-CE2 4.29Å; L224-F512 HydrophobicContact CD1-CE2 4.32Å; I228-F512 HydrophobicContact CD1-CB 4.39Å; I228-F512 HydrophobicContact CD1-CD2 3.92Å; I228-F512 HydrophobicContact CD1-CE2 4.46Å; I228-F512 HydrophobicContact CD1-CG 4.16Å; V508-F512 WeakPolarHBondContact O-CB 3.02Å; V508-F512 PolarHBondContact O-N 3.28Å; V508-F512 VanDerWaalsContact O-N 3.11Å; I509-F512 PolarHBondContact O-N 3.27Å; F512-S514 PolarHBondContact O-N 2.85Å; F512-C515 PolarHBondContact O-N 3.18Å; F512-C516 VanDerWaalsContact O-CB 3.32Å; F512-C516 WeakPolarHBondContact O-CB 3.32Å; F512-C516 PolarHBondContact O-N 3.38Å
513	F	90.1	Very high	90.9	Very high	86 Å²	86	26.5 Å²	26.5	38%	0.377	14%	0.137	S	C	.	.	H	α-helix	trans	-67.8	-33.8	178	-77.6	-60.2	0	0	0	113	F280 C283 I509 G517	F280-F513 HydrophobicContact CD1-CB 4.19Å; F280-F513 WeakPolarHBondContact CD1-O 3.41Å; F280-F513 HydrophobicContact CE1-CD1 4.21Å; C283-F513 HydrophobicContact CB-CB 4.48Å; I509-F513 HydrophobicContact CG2-CD2 3.76Å; I509-F513 HydrophobicContact CG2-CE2 3.71Å; I509-F513 WeakPolarHBondContact O-CD2 3.29Å; I509-F513 PolarHBondContact O-N 3.24Å; I509-F513 VanDerWaalsContact O-N 3.11Å; F513-G517 PolarHBondContact O-N 2.96Å
514	S	88.4	Confident	90.7	Very high	6 Å²	6	24.7 Å²	24.7	4%	0.042	13%	0.125	C	C	.	.	H	α-helix	trans	-60.3	-50.9	173.1	173.4	0	0	0	0	111.9	V284 G510 S511 F512 G517 A518	V284-S514 WeakPolarHBondContact CG2-OG 3.46Å; G510-S514 VanDerWaalsContact O-CB 3.27Å; G510-S514 WeakPolarHBondContact O-CB 3.27Å; G510-S514 PolarHBondContact O-N 3.45Å; S511-S514 WeakPolarHBondContact O-CB 3.25Å; S511-S514 PolarHBondContact O-N 2.91Å; F512-S514 PolarHBondContact O-N 2.85Å; S514-G517 PolarHBondContact O-N 3.2Å; S514-A518 WeakPolarHBondContact O-CB 3.43Å; S514-A518 PolarHBondContact O-N 3.47Å
515	C	90.4	Very high	90.5	Very high	0 Å²	0	24.2 Å²	24.2	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-64.9	-43	-179.8	-60.9	0	0	0	0	111.5	V135 T220 S511 F512 G517 A518 G519	V135-C515 VanDerWaalsContact CB-SG 3.53Å; T220-C515 WeakPolarHBondContact OG1-CB 3.24Å; S511-C515 PolarHBondContact O-N 3.17Å; S511-C515 PolarHBondContact O-SG 3.47Å; F512-C515 PolarHBondContact O-N 3.18Å; C515-G517 VanDerWaalsContact C-N 3.34Å; C515-G517 PolarHBondContact O-N 2.91Å; C515-A518 PolarHBondContact O-N 2.75Å; C515-G519 PolarHBondContact O-N 3.39Å
516	C	90.6	Very high	90.5	Very high	28 Å²	28	18.2 Å²	18.2	19%	0.189	10%	0.101	C	C	.	.	H	α-helix	trans	-58.5	-44.9	175	-177.6	0	0	0	0	111.9	T220 M262 F512 G519 L520	T220-C516 HydrophobicContact CG2-CB 4.37Å; T220-C516 PolarHBondContact OG1-N 3.36Å; M262-C516 HydrophobicContact CE-CB 4.22Å; M262-C516 VanDerWaalsContact CE-SG 3.59Å; F512-C516 VanDerWaalsContact O-CB 3.32Å; F512-C516 WeakPolarHBondContact O-CB 3.32Å; F512-C516 PolarHBondContact O-N 3.38Å; C516-G519 PolarHBondContact O-N 3.26Å; C516-L520 WeakPolarHBondContact O-CG 3.45Å; C516-L520 PolarHBondContact O-N 3.4Å
517	G	88.7	Confident	90.5	Very high	4 Å²	4	16 Å²	16	4%	0.041	9%	0.088	C	C	.	.	H	α-helix	trans	-64.2	-44.2	176.3	0	0	0	0	0	113.7	F280 F513 S514 C515 L520 Q521	F280-G517 VanDerWaalsContact CD2-CA 3.49Å; F513-G517 PolarHBondContact O-N 2.96Å; S514-G517 PolarHBondContact O-N 3.2Å; C515-G517 VanDerWaalsContact C-N 3.34Å; C515-G517 PolarHBondContact O-N 2.91Å; G517-L520 PolarHBondContact O-N 3.01Å; G517-Q521 WeakPolarHBondContact O-CB 3.47Å; G517-Q521 PolarHBondContact O-N 3.41Å
518	A	89.1	Confident	90.3	Very high	10 Å²	10	18 Å²	18	8%	0.083	10%	0.095	C	C	.	.	H	α-helix	trans	-66.9	-35.3	177.7	0	0	0	0	0	112.5	Y216 S514 C515 Q521 S522	Y216-A518 HydrophobicContact CD1-CB 3.96Å; Y216-A518 HydrophobicContact CD2-CB 3.67Å; Y216-A518 HydrophobicContact CE1-CB 4.06Å; Y216-A518 HydrophobicContact CE2-CB 3.76Å; Y216-A518 HydrophobicContact CG-CB 3.78Å; S514-A518 WeakPolarHBondContact O-CB 3.43Å; S514-A518 PolarHBondContact O-N 3.47Å; C515-A518 PolarHBondContact O-N 2.75Å; A518-Q521 PolarHBondContact O-N 3.26Å; A518-S522 WeakPolarHBondContact O-CB 3.44Å; A518-S522 PolarHBondContact O-N 3.43Å; A518-S522 PolarHBondContact O-OG 3.01Å
519	G	90.9	Very high	90.2	Very high	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-61.9	-50.8	171.1	0	0	0	0	0	112.2	C515 C516 Q521 S522 L523	C515-G519 PolarHBondContact O-N 3.39Å; C516-G519 PolarHBondContact O-N 3.26Å; G519-Q521 VanDerWaalsContact C-N 3.33Å; G519-Q521 PolarHBondContact O-N 3.45Å; G519-S522 PolarHBondContact O-N 2.96Å; G519-L523 WeakPolarHBondContact O-CB 3.24Å; G519-L523 PolarHBondContact O-N 3.32Å
520	L	89.4	Confident	90.2	Very high	11 Å²	11	14.2 Å²	14.2	6%	0.058	8%	0.076	C	C	.	.	H	α-helix	trans	-60.2	-39.5	175.4	-76	168.2	0	0	0	112.7	M262 V265 V266 V273 F280 C516 G517 L523 T524	M262-L520 HydrophobicContact CB-CD2 3.87Å; M262-L520 HydrophobicContact CE-CG 4.44Å; M262-L520 HydrophobicContact CG-CD2 3.82Å; M262-L520 HydrophobicContact CG-CG 4.23Å; M262-L520 HydrophobicContact SD-CD2 4.39Å; M262-L520 HydrophobicContact SD-CG 4.26Å; V265-L520 HydrophobicContact CG1-CD2 4.34Å; V266-L520 HydrophobicContact CG2-CD2 4.18Å; V273-L520 HydrophobicContact CG1-CB 4.09Å; F280-L520 HydrophobicContact CE2-CD1 4.4Å; F280-L520 HydrophobicContact CZ-CD1 4.3Å; C516-L520 WeakPolarHBondContact O-CG 3.45Å; C516-L520 PolarHBondContact O-N 3.4Å; G517-L520 PolarHBondContact O-N 3.01Å; L520-L523 PolarHBondContact O-N 3.48Å; L520-T524 WeakPolarHBondContact O-CB 3.3Å; L520-T524 WeakPolarHBondContact O-CG2 3.42Å; L520-T524 PolarHBondContact O-N 2.97Å; L520-T524 PolarHBondContact O-OG1 3.46Å
521	Q	88	Confident	90.3	Very high	15 Å²	15	14.3 Å²	14.3	7%	0.07	8%	0.075	C	C	.	.	H	α-helix	trans	-66.3	-40.7	177.1	-173.6	166	18.1	0	0	111.9	N91 N131 G517 A518 G519 T524 G525	N91-Q521 PolarHBondContact ND2-NE2 3.11Å; N91-Q521 PolarHBondContact ND2-OE1 3.19Å; N91-Q521 PolarHBondContact O-NE2 3.4Å; N131-Q521 PolarHBondContact ND2-NE2 3.26Å; N131-Q521 VanDerWaalsContact OD1-CD 3.27Å; N131-Q521 PolarHBondContact OD1-NE2 3.33Å; N131-Q521 PolarHBondContact OD1-OE1 3.04Å; G517-Q521 WeakPolarHBondContact O-CB 3.47Å; G517-Q521 PolarHBondContact O-N 3.41Å; A518-Q521 PolarHBondContact O-N 3.26Å; G519-Q521 VanDerWaalsContact C-N 3.33Å; G519-Q521 PolarHBondContact O-N 3.45Å; Q521-T524 WeakPolarHBondContact CA-OG1 3.35Å; Q521-T524 PolarHBondContact O-N 3.45Å; Q521-T524 PolarHBondContact O-OG1 3.02Å; Q521-G525 PolarHBondContact O-N 3.2Å
522	S	90.5	Very high	90.1	Very high	9 Å²	9	14.5 Å²	14.5	6%	0.063	8%	0.076	C	C	.	.	H	α-helix	trans	-65.4	-43.8	175.3	-58.9	0	0	0	0	111.6	T209 A518 G519 T524 G525 A526	T209-S522 WeakPolarHBondContact O-CB 3.37Å; A518-S522 WeakPolarHBondContact O-CB 3.44Å; A518-S522 PolarHBondContact O-N 3.43Å; A518-S522 PolarHBondContact O-OG 3.01Å; G519-S522 PolarHBondContact O-N 2.96Å; S522-T524 VanDerWaalsContact C-N 3.28Å; S522-T524 PolarHBondContact O-N 3.23Å; S522-G525 PolarHBondContact O-N 3.1Å; S522-A526 WeakPolarHBondContact O-CB 3.41Å; S522-A526 PolarHBondContact O-N 2.85Å
523	L	90.8	Very high	90	Very high	1 Å²	1	12.2 Å²	12.2	1%	0.005	7%	0.067	C	C	.	.	H	α-helix	trans	-70.5	-20.1	179.7	-167.4	63.2	0	0	0	113.5	L259 M262 A263 V266 G519 L520 P527 L558 T561	L259-L523 HydrophobicContact CD1-CD1 4.27Å; L259-L523 HydrophobicContact CD1-CD2 4.24Å; M262-L523 HydrophobicContact CB-CD2 3.77Å; A263-L523 HydrophobicContact CB-CD2 4.24Å; V266-L523 HydrophobicContact CG2-CD2 4.26Å; V266-L523 HydrophobicContact CG2-CG 4.36Å; G519-L523 WeakPolarHBondContact O-CB 3.24Å; G519-L523 PolarHBondContact O-N 3.32Å; L520-L523 PolarHBondContact O-N 3.48Å; L523-P527 WeakPolarHBondContact O-CD 3.44Å; L523-P527 WeakPolarHBondContact O-CG 3.3Å; L523-L558 HydrophobicContact CD1-CD1 4.26Å; L523-L558 HydrophobicContact CG-CD1 4.19Å; L523-T561 HydrophobicContact CD1-CG2 4.1Å
524	T	88.8	Confident	90.1	Very high	5 Å²	5	8.3 Å²	8.3	3%	0.031	5%	0.05	C	C	.	.	H	α-helix	trans	-91	-35.4	172.1	47.7	0	0	0	0	113	L92 V266 V270 L520 Q521 S522 R528	L92-T524 HydrophobicContact CD2-CG2 3.84Å; L92-T524 WeakPolarHBondContact CD2-OG1 3.47Å; L92-T524 WeakPolarHBondContact CG-OG1 3.31Å; V266-T524 HydrophobicContact CB-CG2 4.21Å; V266-T524 HydrophobicContact CG1-CG2 3.72Å; V266-T524 HydrophobicContact CG2-CG2 3.49Å; V266-T524 VanDerWaalsContact CG2-CG2 3.49Å; V270-T524 HydrophobicContact CG1-CG2 4.35Å; V270-T524 HydrophobicContact CG2-CG2 4.27Å; L520-T524 WeakPolarHBondContact O-CB 3.3Å; L520-T524 WeakPolarHBondContact O-CG2 3.42Å; L520-T524 PolarHBondContact O-N 2.97Å; L520-T524 PolarHBondContact O-OG1 3.46Å; Q521-T524 WeakPolarHBondContact CA-OG1 3.35Å; Q521-T524 PolarHBondContact O-N 3.45Å; Q521-T524 PolarHBondContact O-OG1 3.02Å; S522-T524 VanDerWaalsContact C-N 3.28Å; S522-T524 PolarHBondContact O-N 3.23Å; T524-R528 WeakPolarHBondContact O-CG 3.44Å
525	G	88.3	Confident	90	Very high	12 Å²	12	12 Å²	12	12%	0.124	6%	0.063	C	C	.	.	H	α-helix	trans	-74.5	-46.5	-178.6	0	0	0	0	0	114.1	S93 Q521 S522 R528 L529	S93-G525 WeakPolarHBondContact OG-CA 3.41Å; Q521-G525 PolarHBondContact O-N 3.2Å; S522-G525 PolarHBondContact O-N 3.1Å; G525-R528 PolarHBondContact O-N 3.43Å; G525-L529 PolarHBondContact O-N 3.35Å
526	A	91.6	Very high	89.7	Confident	0 Å²	0	13.8 Å²	13.8	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-59.5	-43.4	-177.4	0	0	0	0	0	113.6	Y206 T209 S522 R528 L529 L530 T561	Y206-A526 HydrophobicContact CD2-CB 3.84Å; Y206-A526 VanDerWaalsContact CD2-O 3.22Å; Y206-A526 WeakPolarHBondContact CD2-O 3.48Å; Y206-A526 HydrophobicContact CE2-CB 3.86Å; Y206-A526 WeakPolarHBondContact CE2-O 3.27Å; T209-A526 HydrophobicContact CG2-CB 3.95Å; S522-A526 WeakPolarHBondContact O-CB 3.41Å; S522-A526 PolarHBondContact O-N 2.85Å; A526-R528 PolarHBondContact O-N 3.27Å; A526-L529 PolarHBondContact O-N 2.91Å; A526-L530 PolarHBondContact O-N 2.95Å; A526-T561 HydrophobicContact CB-CG2 3.81Å
527	P	92.4	Very high	89.4	Confident	3 Å²	3	13.4 Å²	13.4	2%	0.019	7%	0.074	C	C	.	.	H	α-helix	trans	-63.8	-38.5	175.7	-24.9	36.5	0	0	0	113.8	L523 L530 Q531 P554 A557 L558 T561	L523-P527 WeakPolarHBondContact O-CD 3.44Å; L523-P527 WeakPolarHBondContact O-CG 3.3Å; P527-L530 PolarHBondContact O-N 3.49Å; P527-Q531 WeakPolarHBondContact O-CB 3.34Å; P527-Q531 PolarHBondContact O-N 2.89Å; P527-P554 HydrophobicContact CB-CG 3.67Å; P527-A557 HydrophobicContact CB-CB 4.06Å; P527-L558 HydrophobicContact CB-CB 4.32Å; P527-L558 HydrophobicContact CG-CB 4.22Å; P527-L558 HydrophobicContact CG-CD1 3.89Å; P527-T561 HydrophobicContact CG-CG2 4.14Å
528	R	88.9	Confident	89.2	Confident	41 Å²	41	14.3 Å²	14.3	16%	0.155	8%	0.077	C	C	.	.	H	α-helix	trans	-65.1	-40.6	177.8	-71.9	178.1	174	-143.8	-11.3	111.5	S93 T524 G525 A526 Q531 A532	S93-R528 VanDerWaalsContact O-CD 3.29Å; S93-R528 WeakPolarHBondContact O-CD 3.44Å; S93-R528 PolarHBondContact O-NH1 3.18Å; T524-R528 WeakPolarHBondContact O-CG 3.44Å; G525-R528 PolarHBondContact O-N 3.43Å; A526-R528 PolarHBondContact O-N 3.27Å; R528-Q531 PolarHBondContact O-N 3.07Å; R528-A532 PolarHBondContact O-N 3.14Å
529	L	90.4	Very high	89	Confident	15 Å²	15	14 Å²	14	8%	0.079	7%	0.074	C	C	.	.	H	α-helix	trans	-62.5	-47.7	174	174.8	63.6	0	0	0	112.1	Y186 F205 G525 A526 Q531 A532 I533	Y186-L529 HydrophobicContact CD2-CD1 4.19Å; Y186-L529 HydrophobicContact CG-CD1 4.05Å; F205-L529 HydrophobicContact CB-CD2 4.16Å; F205-L529 HydrophobicContact CD1-CD1 4.3Å; F205-L529 HydrophobicContact CD1-CD2 3.36Å; F205-L529 HydrophobicContact CD1-CG 4.48Å; F205-L529 HydrophobicContact CE1-CD2 4.04Å; F205-L529 HydrophobicContact CG-CD2 4.05Å; G525-L529 PolarHBondContact O-N 3.35Å; A526-L529 PolarHBondContact O-N 2.91Å; L529-Q531 VanDerWaalsContact C-N 3.3Å; L529-Q531 PolarHBondContact O-N 2.92Å; L529-A532 PolarHBondContact O-N 3.39Å; L529-I533 HydrophobicContact CD1-CD1 4.18Å; L529-I533 HydrophobicContact CG-CD1 4.11Å; L529-I533 WeakPolarHBondContact O-CG1 3.21Å; L529-I533 PolarHBondContact O-N 3.42Å; L529-I533 VanDerWaalsContact O-N 3.1Å
530	L	92.5	Very high	88.8	Confident	2 Å²	2	15.9 Å²	15.9	1%	0.01	9%	0.086	C	C	.	.	H	α-helix	trans	-64	-36.6	177.5	-179	61.8	0	0	0	112.1	Y206 A526 P527 I533 A534 L542 F545 A557 L560	Y206-L530 HydrophobicContact CD2-CB 3.88Å; Y206-L530 HydrophobicContact CE1-CD2 4.15Å; Y206-L530 HydrophobicContact CE2-CB 3.85Å; Y206-L530 HydrophobicContact CE2-CD2 4.05Å; Y206-L530 HydrophobicContact CE2-CG 4.5Å; Y206-L530 HydrophobicContact CG-CB 4.42Å; A526-L530 PolarHBondContact O-N 2.95Å; P527-L530 PolarHBondContact O-N 3.49Å; L530-I533 PolarHBondContact O-N 3.22Å; L530-A534 WeakPolarHBondContact O-CB 3.48Å; L530-A534 PolarHBondContact O-N 3.5Å; L530-L542 HydrophobicContact CD1-CD1 4.22Å; L530-F545 HydrophobicContact CD2-CB 4.11Å; L530-F545 HydrophobicContact CD2-CD2 4.46Å; L530-F545 HydrophobicContact CD2-CG 4.12Å; L530-F545 HydrophobicContact CG-CB 4.15Å; L530-A557 HydrophobicContact CB-CB 4.27Å; L530-A557 HydrophobicContact CD2-CB 3.97Å; L530-A557 HydrophobicContact CG-CB 4.29Å; L530-L560 HydrophobicContact CD2-CD2 3.68Å
531	Q	91.9	Very high	88.7	Confident	6 Å²	6	21.8 Å²	21.8	3%	0.028	11%	0.112	C	C	.	.	H	α-helix	trans	-62.7	-42.5	175	-174.2	-175.4	25.9	0	0	112.2	P527 R528 L529 A534 R535 G552 P554	P527-Q531 WeakPolarHBondContact O-CB 3.34Å; P527-Q531 PolarHBondContact O-N 2.89Å; R528-Q531 PolarHBondContact O-N 3.07Å; L529-Q531 VanDerWaalsContact C-N 3.3Å; L529-Q531 PolarHBondContact O-N 2.92Å; Q531-A534 PolarHBondContact O-N 3.17Å; Q531-R535 WeakPolarHBondContact O-CG 3.33Å; Q531-R535 PolarHBondContact O-N 3.47Å; Q531-G552 PolarHBondContact NE2-O 3.3Å; Q531-G552 PolarHBondContact OE1-O 3.18Å; Q531-P554 HydrophobicContact CB-CB 4.03Å; Q531-P554 HydrophobicContact CB-CG 4.39Å; Q531-P554 HydrophobicContact CG-CB 4.15Å
532	A	88.3	Confident	88.8	Confident	3 Å²	3	21.8 Å²	21.8	3%	0.025	11%	0.112	C	C	.	.	H	α-helix	trans	-62.4	-47.1	175.5	0	0	0	0	0	112	A96 Y186 Y187 R528 L529 A534 R535 D536	A96-A532 HydrophobicContact CB-CB 4.38Å; Y186-A532 HydrophobicContact CD1-CB 3.73Å; Y186-A532 HydrophobicContact CE1-CB 4.1Å; Y187-A532 HydrophobicContact CE2-CB 3.65Å; R528-A532 PolarHBondContact O-N 3.14Å; L529-A532 PolarHBondContact O-N 3.39Å; A532-A534 VanDerWaalsContact C-N 3.28Å; A532-A534 PolarHBondContact O-N 3.01Å; A532-R535 PolarHBondContact O-N 3.28Å; A532-D536 PolarHBondContact O-N 3.46Å
533	I	90.5	Very high	88.7	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-56.8	-41.5	174	-69.9	163.8	0	0	0	111.6	Y186 G202 L203 L529 L530 I538 L542	Y186-I533 HydrophobicContact CD2-CD1 4.47Å; Y186-I533 HydrophobicContact CD2-CG1 3.87Å; Y186-I533 HydrophobicContact CE1-CG1 4.42Å; Y186-I533 HydrophobicContact CE2-CD1 4.39Å; Y186-I533 HydrophobicContact CE2-CG1 3.48Å; Y186-I533 VanDerWaalsContact CE2-CG1 3.48Å; Y186-I533 HydrophobicContact CG-CG1 4.5Å; G202-I533 VanDerWaalsContact C-CD1 3.5Å; L203-I533 HydrophobicContact CD2-CD1 4.34Å; L203-I533 HydrophobicContact CD2-CG2 4.23Å; L203-I533 HydrophobicContact CG-CD1 4.46Å; L529-I533 HydrophobicContact CD1-CD1 4.18Å; L529-I533 HydrophobicContact CG-CD1 4.11Å; L529-I533 WeakPolarHBondContact O-CG1 3.21Å; L529-I533 PolarHBondContact O-N 3.42Å; L529-I533 VanDerWaalsContact O-N 3.1Å; L530-I533 PolarHBondContact O-N 3.22Å; I533-I538 HydrophobicContact CG2-CD1 4.12Å; I533-I538 HydrophobicContact CG2-CG1 4.4Å; I533-L542 HydrophobicContact CG2-CD1 4.18Å
534	A	91	Very high	88.7	Confident	4 Å²	4	31.1 Å²	31.1	3%	0.033	16%	0.161	C	C	.	.	H	α-helix	trans	-69.2	-38.8	179.3	0	0	0	0	0	112.9	L530 Q531 A532 G537 L542 F545	L530-A534 WeakPolarHBondContact O-CB 3.48Å; L530-A534 PolarHBondContact O-N 3.5Å; Q531-A534 PolarHBondContact O-N 3.17Å; A532-A534 VanDerWaalsContact C-N 3.28Å; A532-A534 PolarHBondContact O-N 3.01Å; A534-G537 PolarHBondContact O-N 2.99Å; A534-L542 WeakPolarHBondContact CB-O 3.44Å; A534-F545 HydrophobicContact CB-CB 4.41Å
535	R	86.9	Confident	88.9	Confident	84 Å²	84	33 Å²	33	32%	0.317	17%	0.169	S	C	.	.	H	α-helix	trans	-72.8	-33.5	179.5	-75.6	-176.7	177.9	-168	-3.1	113.5	E100 Q531 A532 G537 G546	E100-R535 WeakPolarHBondContact OE1-CD 3.44Å; E100-R535 IonicContact OE1-CZ 2.6Å; E100-R535 IonicContact OE1-NE 2.7Å; E100-R535 IonicContact OE1-NH1 3.08Å; E100-R535 PolarHBondContact OE1-NH1 3.03Å; E100-R535 IonicContact OE2-CZ 3.96Å; E100-R535 IonicContact OE2-NH1 3.04Å; E100-R535 PolarHBondContact OE2-NH1 3.26Å; Q531-R535 WeakPolarHBondContact O-CG 3.33Å; Q531-R535 PolarHBondContact O-N 3.47Å; A532-R535 PolarHBondContact O-N 3.28Å; R535-G537 PolarHBondContact O-N 3.4Å; R535-G537 VanDerWaalsContact O-N 3.11Å; R535-G546 PolarHBondContact NE-O 3.48Å
536	D	85.1	Confident	88.8	Confident	37 Å²	37	32.9 Å²	32.9	20%	0.198	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-18.9	170.4	-90.6	0.1	0	0	0	112.9	Y186 Y187 R191 A532 I538	Y186-D536 WeakPolarHBondContact CE1-OD2 3.39Å; Y186-D536 VanDerWaalsContact CZ-OD2 3.26Å; Y186-D536 PolarHBondContact OH-OD2 3.3Å; Y187-D536 WeakPolarHBondContact CE1-OD1 3.49Å; R191-D536 IonicContact NH2-OD1 2.69Å; A532-D536 PolarHBondContact O-N 3.46Å; D536-I538 HydrophobicContact CB-CG1 4.42Å; D536-I538 HydrophobicContact CB-CG2 4.38Å; D536-I538 PolarHBondContact O-N 3.49Å
537	G	83.3	Confident	88.6	Confident	20 Å²	20	38.5 Å²	38.5	21%	0.206	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	68.5	15.6	174.3	0	0	0	0	0	114.4	A534 R535 V539	A534-G537 PolarHBondContact O-N 2.99Å; R535-G537 PolarHBondContact O-N 3.4Å; R535-G537 VanDerWaalsContact O-N 3.11Å; G537-V539 VanDerWaalsContact C-N 3.26Å; G537-V539 PolarHBondContact O-N 3.1Å
538	I	84.9	Confident	88.2	Confident	23 Å²	23	39.2 Å²	39.2	12%	0.118	20%	0.202	C	C	.	.	S	Bend	trans	-64.3	-28.5	177.9	48.8	159.9	0	0	0	113.1	P195 I533 D536 I652	P195-I538 HydrophobicContact CB-CG2 3.97Å; I533-I538 HydrophobicContact CG2-CD1 4.12Å; I533-I538 HydrophobicContact CG2-CG1 4.4Å; D536-I538 HydrophobicContact CB-CG1 4.42Å; D536-I538 HydrophobicContact CB-CG2 4.38Å; D536-I538 PolarHBondContact O-N 3.49Å; I538-I652 HydrophobicContact CB-CG2 4.32Å; I538-I652 HydrophobicContact CD1-CD1 4.49Å
539	V	85.6	Confident	87.9	Confident	4 Å²	4	40.7 Å²	40.7	2%	0.024	21%	0.209	C	C	.	.	S	Bend	trans	-127.3	100.6	-179.9	-178.9	0	0	0	0	108.9	G537 F541 L542 Y651 I652	G537-V539 VanDerWaalsContact C-N 3.26Å; G537-V539 PolarHBondContact O-N 3.1Å; V539-F541 VanDerWaalsContact C-N 3.33Å; V539-F541 HydrophobicContact CG1-CD1 3.6Å; V539-F541 HydrophobicContact CG1-CD2 4.18Å; V539-F541 HydrophobicContact CG1-CE1 3.22Å; V539-F541 HydrophobicContact CG1-CE2 3.86Å; V539-F541 HydrophobicContact CG1-CG 4.06Å; V539-F541 HydrophobicContact CG1-CZ 3.37Å; V539-F541 PolarHBondContact O-N 3.41Å; V539-L542 HydrophobicContact CB-CB 4.32Å; V539-L542 HydrophobicContact CB-CD1 3.92Å; V539-L542 HydrophobicContact CB-CG 4.12Å; V539-L542 HydrophobicContact CG1-CB 4.26Å; V539-L542 HydrophobicContact CG1-CD1 3.8Å; V539-L542 HydrophobicContact CG1-CG 3.69Å; V539-L542 HydrophobicContact CG2-CD1 4.43Å; V539-L542 PolarHBondContact O-N 3.48Å; V539-Y651 HydrophobicContact CG1-CE1 4.27Å; V539-I652 HydrophobicContact CG2-CD1 4.43Å; V539-I652 HydrophobicContact CG2-CG1 4.1Å
540	P	84.9	Confident	87.2	Confident	39 Å²	39	44.8 Å²	44.8	25%	0.253	25%	0.246	S	C	.	.	G	3₁₀ helix	trans	-57.6	-38.6	-170.3	-28.6	35	0	0	0	114.8	L542 Q543	P540-L542 PolarHBondContact O-N 2.88Å; P540-Q543 WeakPolarHBondContact O-CB 3.15Å; P540-Q543 VanDerWaalsContact O-CG 3.27Å; P540-Q543 WeakPolarHBondContact O-CG 3.44Å; P540-Q543 PolarHBondContact O-N 3.33Å
541	F	88.8	Confident	86.2	Confident	135 Å²	135	50 Å²	50	59%	0.592	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-70.3	-15.7	-179.6	66.5	-100.4	0	0	0	113.7	V539 Y651	V539-F541 VanDerWaalsContact C-N 3.33Å; V539-F541 HydrophobicContact CG1-CD1 3.6Å; V539-F541 HydrophobicContact CG1-CD2 4.18Å; V539-F541 HydrophobicContact CG1-CE1 3.22Å; V539-F541 HydrophobicContact CG1-CE2 3.86Å; V539-F541 HydrophobicContact CG1-CG 4.06Å; V539-F541 HydrophobicContact CG1-CZ 3.37Å; V539-F541 PolarHBondContact O-N 3.41Å; F541-Y651 HydrophobicContact CE1-CE1 4.25Å
542	L	89.7	Confident	85.4	Confident	15 Å²	15	50.1 Å²	50.1	8%	0.079	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-85.7	-7.9	175.3	-65.4	-179.3	0	0	0	113.3	L203 L530 I533 A534 V539 P540 V544 F545	L203-L542 HydrophobicContact CD2-CD1 3.79Å; L530-L542 HydrophobicContact CD1-CD1 4.22Å; I533-L542 HydrophobicContact CG2-CD1 4.18Å; A534-L542 WeakPolarHBondContact CB-O 3.44Å; V539-L542 HydrophobicContact CB-CB 4.32Å; V539-L542 HydrophobicContact CB-CD1 3.92Å; V539-L542 HydrophobicContact CB-CG 4.12Å; V539-L542 HydrophobicContact CG1-CB 4.26Å; V539-L542 HydrophobicContact CG1-CD1 3.8Å; V539-L542 HydrophobicContact CG1-CG 3.69Å; V539-L542 HydrophobicContact CG2-CD1 4.43Å; V539-L542 PolarHBondContact O-N 3.48Å; P540-L542 PolarHBondContact O-N 2.88Å; L542-V544 PolarHBondContact O-N 3.19Å; L542-V544 VanDerWaalsContact O-N 3.07Å; L542-F545 HydrophobicContact CB-CD2 4.27Å; L542-F545 HydrophobicContact CD2-CD2 3.73Å; L542-F545 HydrophobicContact CD2-CE2 3.78Å; L542-F545 WeakPolarHBondContact O-CB 3.5Å; L542-F545 WeakPolarHBondContact O-CD2 3.39Å; L542-F545 PolarHBondContact O-N 3.1Å
543	Q	88.1	Confident	85.3	Confident	112 Å²	112	51 Å²	51	52%	0.523	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-56	-30.1	-176.1	-73.5	177.1	-14.4	0	0	113.8	P540 F545 G546	P540-Q543 WeakPolarHBondContact O-CB 3.15Å; P540-Q543 VanDerWaalsContact O-CG 3.27Å; P540-Q543 WeakPolarHBondContact O-CG 3.44Å; P540-Q543 PolarHBondContact O-N 3.33Å; Q543-F545 PolarHBondContact O-N 3.03Å; Q543-G546 PolarHBondContact O-N 3.48Å
544	V	91.7	Very high	85.2	Confident	94 Å²	94	51.7 Å²	51.7	57%	0.57	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-57.2	-33.5	175.1	-177	0	0	0	0	112	L542 G546	L542-V544 PolarHBondContact O-N 3.19Å; L542-V544 VanDerWaalsContact O-N 3.07Å; V544-G546 VanDerWaalsContact C-N 3.29Å; V544-G546 PolarHBondContact O-N 3.14Å
545	F	92.4	Very high	85.1	Confident	43 Å²	43	53 Å²	53	19%	0.189	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-79.1	-7.6	179.6	-55	-66.7	0	0	0	113.8	L530 A534 L542 Q543 H547 W556 A557 L560	L530-F545 HydrophobicContact CD2-CB 4.11Å; L530-F545 HydrophobicContact CD2-CD2 4.46Å; L530-F545 HydrophobicContact CD2-CG 4.12Å; L530-F545 HydrophobicContact CG-CB 4.15Å; A534-F545 HydrophobicContact CB-CB 4.41Å; L542-F545 HydrophobicContact CB-CD2 4.27Å; L542-F545 HydrophobicContact CD2-CD2 3.73Å; L542-F545 HydrophobicContact CD2-CE2 3.78Å; L542-F545 WeakPolarHBondContact O-CB 3.5Å; L542-F545 WeakPolarHBondContact O-CD2 3.39Å; L542-F545 PolarHBondContact O-N 3.1Å; Q543-F545 PolarHBondContact O-N 3.03Å; F545-H547 PolarHBondContact O-N 2.88Å; F545-W556 HydrophobicContact CD1-CB 3.85Å; F545-W556 HydrophobicContact CE1-CB 4.36Å; F545-A557 HydrophobicContact CB-CB 4.24Å; F545-L560 HydrophobicContact CD1-CB 4.45Å; F545-L560 HydrophobicContact CD1-CD2 4.41Å; F545-L560 HydrophobicContact CE1-CB 4.01Å; F545-L560 HydrophobicContact CE1-CD2 3.98Å; F545-L560 HydrophobicContact CE1-CG 4.45Å; F545-L560 HydrophobicContact CE2-CD2 4.18Å; F545-L560 HydrophobicContact CZ-CD2 3.86Å
546	G	86.3	Confident	85.4	Confident	10 Å²	10	55.3 Å²	55.3	10%	0.103	30%	0.301	C	S	.	.	G	3₁₀ helix	trans	-74	-13.6	174	0	0	0	0	0	114.1	R535 Q543 V544 G548	R535-G546 PolarHBondContact NE-O 3.48Å; Q543-G546 PolarHBondContact O-N 3.48Å; V544-G546 VanDerWaalsContact C-N 3.29Å; V544-G546 PolarHBondContact O-N 3.14Å; G546-G548 PolarHBondContact O-N 3.08Å
547	H	87.9	Confident	85.7	Confident	119 Å²	119	53.5 Å²	53.5	55%	0.551	29%	0.291	S	S	*	.			trans	-71.6	123.4	-178.4	-171.9	81.6	0	0	0	112	F545 T555	F545-H547 PolarHBondContact O-N 2.88Å; H547-T555 PolarHBondContact O-N 3.42Å
548	G	83	Confident	86.2	Confident	18 Å²	18	53.2 Å²	53.2	19%	0.186	29%	0.285	C	S	.	.	B	Isolated β-bridge	trans	-125.3	165.9	178.3	0	0	0	0	0	112.6	G546 E553	G546-G548 PolarHBondContact O-N 3.08Å; G548-E553 CarbonylContact C-O 3.56Å; G548-E553 VanDerWaalsContact CA-O 3.27Å; G548-E553 WeakPolarHBondContact CA-O 3.4Å
549	K	82.5	Confident	86.7	Confident	71 Å²	71	57.4 Å²	57.4	31%	0.309	31%	0.307	S	S	.	.			trans	-64.8	170.7	167.7	-64.2	179.5	-176.7	173.6	0	110.2	F267 N551 G552 E553 T555	F267-K549 PolarHBondContact O-NZ 3.5Å; K549-N551 PolarHBondContact O-N 3.29Å; K549-G552 PolarHBondContact O-N 3.42Å; K549-E553 PolarHBondContact N-O 3.41Å; K549-T555 HydrophobicContact CD-CG2 4.49Å; K549-T555 HydrophobicContact CG-CG2 3.82Å
550	A	76.1	Confident	87.1	Confident	102 Å²	102	60 Å²	60	84%	0.843	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.3	-19.2	171.8	0	0	0	0	0	114.2	G552	A550-G552 VanDerWaalsContact C-N 3.34Å
551	N	71.1	Confident	87.6	Confident	110 Å²	110	58.2 Å²	58.2	59%	0.588	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.8	15.9	175.4	-54.6	-8.2	0	0	0	113	Q97 K549 E553	Q97-N551 VanDerWaalsContact OE1-C 3.23Å; Q97-N551 PolarHBondContact OE1-O 3.41Å; K549-N551 PolarHBondContact O-N 3.29Å; N551-E553 PolarHBondContact O-N 2.82Å
552	G	76.4	Confident	87.9	Confident	9 Å²	9	52.7 Å²	52.7	9%	0.093	29%	0.288	C	S	.	.	S	Bend	trans	75.6	-23.8	-176.4	0	0	0	0	0	115.5	Q531 K549 A550	Q531-G552 PolarHBondContact NE2-O 3.3Å; Q531-G552 PolarHBondContact OE1-O 3.18Å; K549-G552 PolarHBondContact O-N 3.42Å; A550-G552 VanDerWaalsContact C-N 3.34Å
553	E	84.1	Confident	88.2	Confident	22 Å²	22	53.9 Å²	53.9	10%	0.103	30%	0.304	C	S	.	.			trans	-54.5	121.8	-175.2	-67.3	177.6	157.7	0	0	112.6	V270 G548 K549 N551	V270-E553 WeakPolarHBondContact CB-OE1 3.37Å; V270-E553 HydrophobicContact CG2-CG 4.33Å; V270-E553 WeakPolarHBondContact CG2-OE1 3.23Å; V270-E553 PolarHBondContact N-OE1 2.84Å; G548-E553 CarbonylContact C-O 3.56Å; G548-E553 VanDerWaalsContact CA-O 3.27Å; G548-E553 WeakPolarHBondContact CA-O 3.4Å; K549-E553 PolarHBondContact N-O 3.41Å; N551-E553 PolarHBondContact O-N 2.82Å
554	P	88.6	Confident	88.6	Confident	14 Å²	14	50 Å²	50	9%	0.091	29%	0.286	C	S	.	.	B	Isolated β-bridge	trans	-77.2	134.9	-175.3	29.4	-34	0	0	0	112.2	P527 Q531 A557 L558	P527-P554 HydrophobicContact CB-CG 3.67Å; Q531-P554 HydrophobicContact CB-CB 4.03Å; Q531-P554 HydrophobicContact CB-CG 4.39Å; Q531-P554 HydrophobicContact CG-CB 4.15Å; P554-A557 HydrophobicContact CB-CB 3.95Å; P554-L558 WeakPolarHBondContact O-CB 2.91Å
555	T	89.3	Confident	88.7	Confident	33 Å²	33	45.5 Å²	45.5	20%	0.202	26%	0.259	C	S	.	.	S	Bend	trans	-96.6	-60.5	-176.2	50.7	0	0	0	0	111.9	F267 H547 K549 A557 L558 L559	F267-T555 HydrophobicContact CE2-CG2 4.25Å; H547-T555 PolarHBondContact O-N 3.42Å; K549-T555 HydrophobicContact CD-CG2 4.49Å; K549-T555 HydrophobicContact CG-CG2 3.82Å; T555-A557 VanDerWaalsContact C-N 3.34Å; T555-A557 PolarHBondContact O-N 3Å; T555-L558 PolarHBondContact O-N 3.32Å; T555-L559 PolarHBondContact O-N 2.85Å; T555-L559 VanDerWaalsContact O-N 3.14Å
556	W	92.6	Very high	88.9	Confident	131 Å²	131	45.5 Å²	45.5	50%	0.496	26%	0.26	S	S	.	.	H	α-helix	trans	-65.2	-35.1	179.9	-65.4	112.4	0	0	0	113	F545 L558 L559 L560	F545-W556 HydrophobicContact CD1-CB 3.85Å; F545-W556 HydrophobicContact CE1-CB 4.36Å; W556-L558 VanDerWaalsContact C-N 3.35Å; W556-L559 HydrophobicContact CE3-CD2 3.91Å; W556-L559 HydrophobicContact CZ3-CD2 3.88Å; W556-L559 PolarHBondContact O-N 3.2Å; W556-L560 PolarHBondContact O-N 2.78Å
557	A	93.3	Very high	89.3	Confident	0 Å²	0	49.8 Å²	49.8	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-67.2	-34.9	176	0	0	0	0	0	112.2	P527 L530 F545 P554 T555 T561	P527-A557 HydrophobicContact CB-CB 4.06Å; L530-A557 HydrophobicContact CB-CB 4.27Å; L530-A557 HydrophobicContact CD2-CB 3.97Å; L530-A557 HydrophobicContact CG-CB 4.29Å; F545-A557 HydrophobicContact CB-CB 4.24Å; P554-A557 HydrophobicContact CB-CB 3.95Å; T555-A557 VanDerWaalsContact C-N 3.34Å; T555-A557 PolarHBondContact O-N 3Å; A557-T561 VanDerWaalsContact O-CB 3.32Å; A557-T561 WeakPolarHBondContact O-CB 3.48Å; A557-T561 PolarHBondContact O-N 3.06Å; A557-T561 PolarHBondContact O-OG1 3.2Å
558	L	93.4	Very high	89.6	Confident	14 Å²	14	44.1 Å²	44.1	7%	0.073	25%	0.253	C	S	.	.	H	α-helix	trans	-66.1	-42.5	174.1	178.5	64.4	0	0	0	110.8	V266 F267 L523 P527 P554 T555 W556 T561 A562	V266-L558 HydrophobicContact CB-CD1 4.38Å; V266-L558 HydrophobicContact CB-CD2 4.47Å; V266-L558 HydrophobicContact CG1-CD1 3.74Å; V266-L558 HydrophobicContact CG1-CD2 3.96Å; F267-L558 HydrophobicContact CB-CD2 3.93Å; F267-L558 HydrophobicContact CD2-CD2 4.3Å; L523-L558 HydrophobicContact CD1-CD1 4.26Å; L523-L558 HydrophobicContact CG-CD1 4.19Å; P527-L558 HydrophobicContact CB-CB 4.32Å; P527-L558 HydrophobicContact CG-CB 4.22Å; P527-L558 HydrophobicContact CG-CD1 3.89Å; P554-L558 WeakPolarHBondContact O-CB 2.91Å; T555-L558 PolarHBondContact O-N 3.32Å; W556-L558 VanDerWaalsContact C-N 3.35Å; L558-T561 PolarHBondContact O-N 3.2Å; L558-A562 WeakPolarHBondContact O-CB 3.28Å; L558-A562 PolarHBondContact O-N 3.34Å
559	L	93.9	Very high	90.2	Very high	110 Å²	110	43.3 Å²	43.3	58%	0.576	24%	0.244	S	C	*	.	H	α-helix	trans	-61.7	-45.1	176.4	-173.7	67.1	0	0	0	112.1	T555 W556 A562 G563	T555-L559 PolarHBondContact O-N 2.85Å; T555-L559 VanDerWaalsContact O-N 3.14Å; W556-L559 HydrophobicContact CE3-CD2 3.91Å; W556-L559 HydrophobicContact CZ3-CD2 3.88Å; W556-L559 PolarHBondContact O-N 3.2Å; L559-A562 PolarHBondContact O-N 2.88Å; L559-G563 PolarHBondContact O-N 3.13Å
560	L	94.7	Very high	90.8	Very high	60 Å²	60	44 Å²	44	31%	0.314	25%	0.251	S	S	.	.	H	α-helix	trans	-62.2	-44.3	175.6	-176.5	68.3	0	0	0	111.6	L530 F545 W556 A562 G563 I564	L530-L560 HydrophobicContact CD2-CD2 3.68Å; F545-L560 HydrophobicContact CD1-CB 4.45Å; F545-L560 HydrophobicContact CD1-CD2 4.41Å; F545-L560 HydrophobicContact CE1-CB 4.01Å; F545-L560 HydrophobicContact CE1-CD2 3.98Å; F545-L560 HydrophobicContact CE1-CG 4.45Å; F545-L560 HydrophobicContact CE2-CD2 4.18Å; F545-L560 HydrophobicContact CZ-CD2 3.86Å; W556-L560 PolarHBondContact O-N 2.78Å; L560-A562 PolarHBondContact O-N 3.16Å; L560-G563 PolarHBondContact O-N 3.45Å; L560-I564 HydrophobicContact CD1-CD1 4.31Å; L560-I564 HydrophobicContact CG-CD1 4Å; L560-I564 WeakPolarHBondContact O-CG1 3.46Å; L560-I564 PolarHBondContact O-N 3.25Å
561	T	95.3	Very high	91.6	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-43.6	179.2	-55.6	0	0	0	0	111.1	Y206 T210 L523 A526 P527 A557 L558 G563 I564 C565	Y206-T561 WeakPolarHBondContact CE2-OG1 3.42Å; Y206-T561 WeakPolarHBondContact OH-CA 3.36Å; Y206-T561 PolarHBondContact OH-N 3.4Å; Y206-T561 PolarHBondContact OH-OG1 3.29Å; T210-T561 HydrophobicContact CG2-CG2 3.74Å; T210-T561 WeakPolarHBondContact CG2-O 3.35Å; L523-T561 HydrophobicContact CD1-CG2 4.1Å; A526-T561 HydrophobicContact CB-CG2 3.81Å; P527-T561 HydrophobicContact CG-CG2 4.14Å; A557-T561 VanDerWaalsContact O-CB 3.32Å; A557-T561 WeakPolarHBondContact O-CB 3.48Å; A557-T561 PolarHBondContact O-N 3.06Å; A557-T561 PolarHBondContact O-OG1 3.2Å; L558-T561 PolarHBondContact O-N 3.2Å; T561-G563 PolarHBondContact O-N 3.46Å; T561-I564 PolarHBondContact O-N 3.11Å; T561-C565 WeakPolarHBondContact O-CB 3.2Å; T561-C565 PolarHBondContact O-N 3.45Å; T561-C565 PolarHBondContact O-SG 2.96Å; T561-C565 VanDerWaalsContact O-SG 3.33Å
562	A	95.5	Very high	92.5	Very high	19 Å²	19	37.2 Å²	37.2	16%	0.157	20%	0.2	C	C	.	.	H	α-helix	trans	-61.8	-42.4	173.8	0	0	0	0	0	111.8	L558 L559 L560 I564 C565 E566	L558-A562 WeakPolarHBondContact O-CB 3.28Å; L558-A562 PolarHBondContact O-N 3.34Å; L559-A562 PolarHBondContact O-N 2.88Å; L560-A562 PolarHBondContact O-N 3.16Å; A562-I564 PolarHBondContact O-N 3.11Å; A562-C565 WeakPolarHBondContact O-CB 3.32Å; A562-C565 PolarHBondContact O-N 3.28Å; A562-E566 WeakPolarHBondContact O-CB 3.31Å; A562-E566 PolarHBondContact O-N 3.01Å
563	G	96	Very high	93.1	Very high	40 Å²	40	38.4 Å²	38.4	41%	0.412	21%	0.208	S	C	.	.	H	α-helix	trans	-61.4	-38	175.6	0	0	0	0	0	114	L559 L560 T561 I567	L559-G563 PolarHBondContact O-N 3.13Å; L560-G563 PolarHBondContact O-N 3.45Å; T561-G563 PolarHBondContact O-N 3.46Å; G563-I567 PolarHBondContact O-N 3.29Å
564	I	95.6	Very high	93.3	Very high	30 Å²	30	37.6 Å²	37.6	15%	0.154	20%	0.204	C	C	.	.	H	α-helix	trans	-75.6	-37.8	175.8	-62.9	168.4	0	0	0	111.1	Y206 L207 T210 F211 L560 T561 A562 E566 I567 G568	Y206-I564 HydrophobicContact CE1-CD1 4.09Å; L207-I564 HydrophobicContact CD2-CD1 4.36Å; T210-I564 HydrophobicContact CG2-CB 3.67Å; T210-I564 HydrophobicContact CG2-CG2 3.56Å; F211-I564 HydrophobicContact CE2-CG2 4.17Å; F211-I564 HydrophobicContact CZ-CG2 4.28Å; L560-I564 HydrophobicContact CD1-CD1 4.31Å; L560-I564 HydrophobicContact CG-CD1 4Å; L560-I564 WeakPolarHBondContact O-CG1 3.46Å; L560-I564 PolarHBondContact O-N 3.25Å; T561-I564 PolarHBondContact O-N 3.11Å; A562-I564 PolarHBondContact O-N 3.11Å; I564-E566 VanDerWaalsContact C-N 3.28Å; I564-E566 PolarHBondContact O-N 3.37Å; I564-I567 WeakPolarHBondContact O-CB 3.09Å; I564-I567 PolarHBondContact O-N 2.89Å; I564-G568 PolarHBondContact O-N 3.38Å
565	C	95.1	Very high	93.3	Very high	1 Å²	1	37.4 Å²	37.4	1%	0.007	20%	0.202	C	C	.	.	H	α-helix	trans	-57.1	-42.5	171.1	-77.2	0	0	0	0	111.7	T210 A214 L259 T561 A562 I567 G568 I569	T210-C565 PolarHBondContact O-SG 2.93Å; A214-C565 WeakPolarHBondContact CB-O 3.48Å; L259-C565 HydrophobicContact CD1-CB 3.83Å; L259-C565 HydrophobicContact CD2-CB 3.79Å; T561-C565 WeakPolarHBondContact O-CB 3.2Å; T561-C565 PolarHBondContact O-N 3.45Å; T561-C565 PolarHBondContact O-SG 2.96Å; T561-C565 VanDerWaalsContact O-SG 3.33Å; A562-C565 WeakPolarHBondContact O-CB 3.32Å; A562-C565 PolarHBondContact O-N 3.28Å; C565-I567 VanDerWaalsContact C-N 3.32Å; C565-I567 PolarHBondContact O-N 3.48Å; C565-G568 CarbonylContact O-C 3.44Å; C565-G568 WeakPolarHBondContact O-CA 3.47Å; C565-G568 PolarHBondContact O-N 2.94Å; C565-I569 PolarHBondContact O-N 3.45Å
566	E	96.1	Very high	93.3	Very high	43 Å²	43	38 Å²	38	20%	0.201	21%	0.21	C	C	.	.	H	α-helix	trans	-60	-40.1	178.8	-174.8	60	-160.2	0	0	111.9	T256 L259 A562 I564 G568 I569 L570	T256-E566 PolarHBondContact OG1-OE1 2.87Å; L259-E566 HydrophobicContact CD2-CB 4.05Å; L259-E566 WeakPolarHBondContact CD2-OE2 3.32Å; A562-E566 WeakPolarHBondContact O-CB 3.31Å; A562-E566 PolarHBondContact O-N 3.01Å; I564-E566 VanDerWaalsContact C-N 3.28Å; I564-E566 PolarHBondContact O-N 3.37Å; E566-G568 VanDerWaalsContact C-N 3.26Å; E566-G568 PolarHBondContact O-N 2.9Å; E566-I569 PolarHBondContact O-N 3.36Å; E566-L570 HydrophobicContact CG-CD1 4.33Å; E566-L570 HydrophobicContact CG-CG 4.48Å; E566-L570 WeakPolarHBondContact O-CG 3.24Å; E566-L570 PolarHBondContact O-N 2.92Å
567	I	95.1	Very high	93.3	Very high	100 Å²	100	31.8 Å²	31.8	51%	0.513	19%	0.187	S	C	.	.	H	α-helix	trans	-57.2	-41.5	172.7	-61.8	169.1	0	0	0	110.8	G563 I564 C565	G563-I567 PolarHBondContact O-N 3.29Å; I564-I567 WeakPolarHBondContact O-CB 3.09Å; I564-I567 PolarHBondContact O-N 2.89Å; C565-I567 VanDerWaalsContact C-N 3.32Å; C565-I567 PolarHBondContact O-N 3.48Å
568	G	93.7	Very high	93.1	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-65.4	-36.8	174.7	0	0	0	0	0	113.6	I564 C565 E566 I571	I564-G568 PolarHBondContact O-N 3.38Å; C565-G568 CarbonylContact O-C 3.44Å; C565-G568 WeakPolarHBondContact O-CA 3.47Å; C565-G568 PolarHBondContact O-N 2.94Å; E566-G568 VanDerWaalsContact C-N 3.26Å; E566-G568 PolarHBondContact O-N 2.9Å; G568-I571 WeakPolarHBondContact O-CB 3.43Å
569	I	95.6	Very high	92.8	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-72.3	-36.3	178.5	-68.2	175.7	0	0	0	111.8	A214 I217 L218 L259 C565 E566 I571 A572	A214-I569 HydrophobicContact CB-CG1 4.21Å; I217-I569 HydrophobicContact CB-CD1 4.33Å; I217-I569 HydrophobicContact CD1-CD1 4.29Å; I217-I569 HydrophobicContact CG2-CD1 3.8Å; I217-I569 HydrophobicContact CG2-CG1 4.49Å; L218-I569 HydrophobicContact CD2-CG2 4.42Å; L259-I569 HydrophobicContact CB-CD1 3.66Å; L259-I569 HydrophobicContact CD2-CD1 3.8Å; L259-I569 HydrophobicContact CG-CD1 4.24Å; C565-I569 PolarHBondContact O-N 3.45Å; E566-I569 PolarHBondContact O-N 3.36Å; I569-I571 PolarHBondContact O-N 3.46Å; I569-A572 VanDerWaalsContact O-CA 3.3Å; I569-A572 WeakPolarHBondContact O-CA 3.22Å; I569-A572 PolarHBondContact O-N 2.75Å
570	L	95.3	Very high	92.6	Very high	87 Å²	87	29.6 Å²	29.6	46%	0.455	18%	0.177	S	C	.	.	H	α-helix	trans	-64.4	-25.1	177.4	-69.9	172.2	0	0	0	113.3	R252 E566 A572	R252-L570 PolarHBondContact NE-O 3.14Å; R252-L570 PolarHBondContact NH2-O 3.09Å; R252-L570 VanDerWaalsContact NH2-O 3.15Å; E566-L570 HydrophobicContact CG-CD1 4.33Å; E566-L570 HydrophobicContact CG-CG 4.48Å; E566-L570 WeakPolarHBondContact O-CG 3.24Å; E566-L570 PolarHBondContact O-N 2.92Å; L570-A572 PolarHBondContact O-N 3.43Å
571	I	93.6	Very high	92.4	Very high	64 Å²	64	26.8 Å²	26.8	33%	0.328	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-28.7	169.8	-64	168.8	0	0	0	111.2	G568 I569 S573 A576 V577 I580	G568-I571 WeakPolarHBondContact O-CB 3.43Å; I569-I571 PolarHBondContact O-N 3.46Å; I571-S573 PolarHBondContact O-N 2.83Å; I571-A576 HydrophobicContact CG2-CB 3.9Å; I571-V577 HydrophobicContact CB-CG2 4.07Å; I571-V577 HydrophobicContact CD1-CG2 4.3Å; I571-V577 HydrophobicContact CG2-CG2 3.95Å; I571-I580 HydrophobicContact CD1-CD1 4.12Å
572	A	89.8	Confident	92.2	Very high	4 Å²	4	26.8 Å²	26.8	3%	0.033	16%	0.162	C	C	.	.			trans	63.7	-23.3	172.6	0	0	0	0	0	117.5	L248 M251 R252 I569 L570	L248-A572 HydrophobicContact CB-CB 4.15Å; L248-A572 HydrophobicContact CD2-CB 3.88Å; L248-A572 WeakPolarHBondContact O-CB 3.37Å; M251-A572 HydrophobicContact CB-CB 4.23Å; R252-A572 HydrophobicContact CG-CB 3.75Å; I569-A572 VanDerWaalsContact O-CA 3.3Å; I569-A572 WeakPolarHBondContact O-CA 3.22Å; I569-A572 PolarHBondContact O-N 2.75Å; L570-A572 PolarHBondContact O-N 3.43Å
573	S	88.4	Confident	91.9	Very high	35 Å²	35	26.4 Å²	26.4	25%	0.245	16%	0.157	C	C	.	.			trans	-95.2	116.6	176.4	176.9	0	0	0	0	111.7	I571 D575 A576 V577	I571-S573 PolarHBondContact O-N 2.83Å; S573-D575 PolarHBondContact O-N 2.88Å; S573-A576 PolarHBondContact O-N 2.99Å; S573-V577 WeakPolarHBondContact O-CG2 3.45Å; S573-V577 PolarHBondContact O-N 2.82Å
574	L	87.5	Confident	91.7	Very high	4 Å²	4	26.4 Å²	26.4	2%	0.021	15%	0.146	C	C	.	.	H	α-helix	trans	-54.5	-41.3	174	-174.6	157.3	0	0	0	111.5	V135 I136 M215 A576 V577 A578	V135-L574 HydrophobicContact CG2-CD1 4.32Å; I136-L574 HydrophobicContact CD1-CD2 4.19Å; M215-L574 HydrophobicContact CE-CD2 4.09Å; M215-L574 HydrophobicContact CG-CG 4.33Å; L574-A576 VanDerWaalsContact C-N 3.26Å; L574-A576 PolarHBondContact O-N 3.46Å; L574-V577 PolarHBondContact O-N 3.43Å; L574-A578 PolarHBondContact O-N 3.03Å
575	D	90.5	Very high	91.6	Very high	10 Å²	10	25.3 Å²	25.3	5%	0.053	14%	0.14	C	C	.	.	H	α-helix	trans	-72.3	-21.4	-174.7	-51.9	-26.7	0	0	0	112.3	R140 I416 I426 K485 S573 P579	R140-D575 IonicContact CZ-OD1 3.7Å; R140-D575 IonicContact NE-OD1 3.72Å; R140-D575 PolarHBondContact NE-OD1 3.14Å; R140-D575 IonicContact NE-OD2 3.4Å; R140-D575 IonicContact NH2-OD1 3.38Å; R140-D575 PolarHBondContact NH2-OD1 3.4Å; R140-D575 VanDerWaalsContact NH2-OD1 3.15Å; R140-D575 IonicContact NH2-OD2 3.5Å; I416-D575 HydrophobicContact CD1-CB 4.22Å; I426-D575 HydrophobicContact CD1-CB 4.02Å; K485-D575 WeakPolarHBondContact CE-OD2 3.32Å; K485-D575 IonicContact NZ-OD2 3.53Å; K485-D575 PolarHBondContact NZ-OD2 3.29Å; S573-D575 PolarHBondContact O-N 2.88Å; D575-P579 WeakPolarHBondContact O-CD 3.47Å
576	A	89.4	Confident	91.5	Very high	46 Å²	46	25.3 Å²	25.3	38%	0.38	14%	0.14	S	C	.	.	H	α-helix	trans	-85	-30.9	172.3	0	0	0	0	0	112.8	I571 S573 L574	I571-A576 HydrophobicContact CG2-CB 3.9Å; S573-A576 PolarHBondContact O-N 2.99Å; L574-A576 VanDerWaalsContact C-N 3.26Å; L574-A576 PolarHBondContact O-N 3.46Å
577	V	91.1	Very high	91.3	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-76.5	-36.1	178.3	176.3	0	0	0	0	111.9	M215 L218 I571 S573 L574 I580 L581	M215-V577 HydrophobicContact CB-CG1 4.14Å; L218-V577 HydrophobicContact CD1-CG2 4.06Å; I571-V577 HydrophobicContact CB-CG2 4.07Å; I571-V577 HydrophobicContact CD1-CG2 4.3Å; I571-V577 HydrophobicContact CG2-CG2 3.95Å; S573-V577 WeakPolarHBondContact O-CG2 3.45Å; S573-V577 PolarHBondContact O-N 2.82Å; L574-V577 PolarHBondContact O-N 3.43Å; V577-I580 WeakPolarHBondContact O-CB 3.47Å; V577-I580 PolarHBondContact O-N 2.97Å; V577-L581 PolarHBondContact O-N 3.07Å
578	A	88.8	Confident	91.2	Very high	0 Å²	0	18.7 Å²	18.7	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-58.9	-41.7	-177	0	0	0	0	0	115	M215 G425 P429 L574 L581 S582	M215-A578 HydrophobicContact CE-CB 3.93Å; M215-A578 HydrophobicContact SD-CB 4.16Å; G425-A578 CarbonylContact O-C 3.49Å; P429-A578 HydrophobicContact CG-CB 4.08Å; L574-A578 PolarHBondContact O-N 3.03Å; A578-L581 WeakPolarHBondContact O-CB 3.47Å; A578-L581 PolarHBondContact O-N 3.4Å; A578-S582 PolarHBondContact O-N 3.26Å; A578-S582 PolarHBondContact O-OG 3.23Å
579	P	88.1	Confident	91.3	Very high	29 Å²	29	18.7 Å²	18.7	19%	0.188	11%	0.107	C	C	.	.	H	α-helix	trans	-65.8	-37.7	173	-25.2	36	0	0	0	113.8	D575 L581 S582 M583	D575-P579 WeakPolarHBondContact O-CD 3.47Å; P579-L581 VanDerWaalsContact C-N 3.34Å; P579-L581 PolarHBondContact O-N 2.91Å; P579-S582 WeakPolarHBondContact O-CB 3.48Å; P579-S582 PolarHBondContact O-N 3.24Å; P579-M583 WeakPolarHBondContact O-CG 3.4Å; P579-M583 PolarHBondContact O-N 3.06Å; P579-M583 VanDerWaalsContact O-N 3.14Å
580	I	88.9	Confident	91.2	Very high	50 Å²	50	19.2 Å²	19.2	26%	0.256	11%	0.11	S	C	.	.	H	α-helix	trans	-61.6	-46.4	177	-61.4	171.6	0	0	0	109.7	I571 V577 S582 M583 F584	I571-I580 HydrophobicContact CD1-CD1 4.12Å; V577-I580 WeakPolarHBondContact O-CB 3.47Å; V577-I580 PolarHBondContact O-N 2.97Å; I580-S582 VanDerWaalsContact C-N 3.31Å; I580-S582 PolarHBondContact O-N 3.43Å; I580-M583 PolarHBondContact O-N 3.31Å; I580-F584 HydrophobicContact CG2-CD2 4.46Å; I580-F584 HydrophobicContact CG2-CE2 3.94Å; I580-F584 WeakPolarHBondContact O-CD2 3.32Å
581	L	90.3	Very high	91.1	Very high	0 Å²	0	16.2 Å²	16.2	0%	0	9%	0.093	C	C	.	.	H	α-helix	trans	-57.3	-44.1	174.7	176.8	58.2	0	0	0	112.3	G208 F211 A212 M215 P429 V577 A578 P579 M583 F584 F585	G208-L581 WeakPolarHBondContact O-CD1 3.04Å; F211-L581 HydrophobicContact CB-CB 4.45Å; F211-L581 HydrophobicContact CB-CD1 4.04Å; A212-L581 HydrophobicContact CB-CD1 4Å; A212-L581 HydrophobicContact CB-CD2 3.97Å; M215-L581 HydrophobicContact SD-CD2 3.53Å; M215-L581 VanDerWaalsContact SD-CD2 3.53Å; P429-L581 HydrophobicContact CB-CD2 3.97Å; P429-L581 HydrophobicContact CG-CD2 4.1Å; P429-L581 HydrophobicContact CG-CG 4.49Å; V577-L581 PolarHBondContact O-N 3.07Å; A578-L581 WeakPolarHBondContact O-CB 3.47Å; A578-L581 PolarHBondContact O-N 3.4Å; P579-L581 VanDerWaalsContact C-N 3.34Å; P579-L581 PolarHBondContact O-N 2.91Å; L581-M583 VanDerWaalsContact C-N 3.32Å; L581-M583 PolarHBondContact O-N 2.89Å; L581-F584 PolarHBondContact O-N 3.42Å; L581-F585 HydrophobicContact CD1-CD2 3.7Å; L581-F585 HydrophobicContact CD1-CE2 3.41Å; L581-F585 VanDerWaalsContact CD1-CE2 3.41Å; L581-F585 HydrophobicContact CD1-CZ 4.32Å; L581-F585 HydrophobicContact CD2-CE2 4.37Å; L581-F585 HydrophobicContact CG-CD2 3.94Å; L581-F585 HydrophobicContact CG-CE2 3.91Å; L581-F585 PolarHBondContact O-N 3.49Å
582	S	90.9	Very high	91.1	Very high	1 Å²	1	13.2 Å²	13.2	1%	0.007	8%	0.078	C	C	.	.	H	α-helix	trans	-62.2	-36.9	-179.4	-61.3	0	0	0	0	112.6	G425 P429 A578 P579 I580 F584 F585 L586	G425-S582 PolarHBondContact O-OG 3.48Å; G425-S582 VanDerWaalsContact O-OG 3.12Å; P429-S582 VanDerWaalsContact CD-OG 3.3Å; P429-S582 WeakPolarHBondContact CD-OG 3.5Å; P429-S582 WeakPolarHBondContact CG-OG 3.25Å; A578-S582 PolarHBondContact O-N 3.26Å; A578-S582 PolarHBondContact O-OG 3.23Å; P579-S582 WeakPolarHBondContact O-CB 3.48Å; P579-S582 PolarHBondContact O-N 3.24Å; I580-S582 VanDerWaalsContact C-N 3.31Å; I580-S582 PolarHBondContact O-N 3.43Å; S582-F584 PolarHBondContact O-N 3.32Å; S582-F585 PolarHBondContact O-N 2.95Å; S582-L586 VanDerWaalsContact O-CB 3.24Å; S582-L586 WeakPolarHBondContact O-CB 3.48Å; S582-L586 WeakPolarHBondContact O-CD1 3.37Å; S582-L586 VanDerWaalsContact O-CG 3.22Å; S582-L586 WeakPolarHBondContact O-CG 3.3Å; S582-L586 PolarHBondContact O-N 3.5Å
583	M	90.8	Very high	91.4	Very high	10 Å²	10	13 Å²	13	5%	0.049	8%	0.076	C	C	.	.	H	α-helix	trans	-59.2	-45.6	176	-65.9	-68.9	150.4	0	0	112.2	P579 I580 L581 M587 M630 S633	P579-M583 WeakPolarHBondContact O-CG 3.4Å; P579-M583 PolarHBondContact O-N 3.06Å; P579-M583 VanDerWaalsContact O-N 3.14Å; I580-M583 PolarHBondContact O-N 3.31Å; L581-M583 VanDerWaalsContact C-N 3.32Å; L581-M583 PolarHBondContact O-N 2.89Å; M583-M587 VanDerWaalsContact O-CB 3.29Å; M583-M587 WeakPolarHBondContact O-CB 3.24Å; M583-M587 PolarHBondContact O-N 2.95Å; M583-M630 HydrophobicContact SD-CG 3.58Å; M583-M630 VanDerWaalsContact SD-CG 3.58Å; M583-S633 VanDerWaalsContact CE-CB 3.49Å; M583-S633 VanDerWaalsContact CE-OG 3.29Å; M583-S633 WeakPolarHBondContact CE-OG 3.49Å
584	F	92.2	Very high	91.7	Very high	41 Å²	41	14 Å²	14	18%	0.18	8%	0.078	C	C	.	.	H	α-helix	trans	-66.6	-42.4	179.8	-68.9	-62.8	0	0	0	112.5	L207 F211 I580 L581 S582 C588	L207-F584 HydrophobicContact CB-CD1 3.9Å; L207-F584 HydrophobicContact CB-CD2 4.34Å; L207-F584 HydrophobicContact CB-CE1 3.96Å; L207-F584 HydrophobicContact CB-CE2 4.38Å; L207-F584 HydrophobicContact CB-CG 4.1Å; L207-F584 HydrophobicContact CB-CZ 4.21Å; L207-F584 HydrophobicContact CD1-CD1 4.21Å; L207-F584 HydrophobicContact CD1-CE1 3.66Å; L207-F584 HydrophobicContact CD1-CZ 4.16Å; L207-F584 HydrophobicContact CG-CE1 4.46Å; F211-F584 HydrophobicContact CD2-CD2 4.02Å; F211-F584 AromaticContact CD2-CE2 3.65Å; F211-F584 HydrophobicContact CD2-CE2 3.65Å; F211-F584 AromaticContact CE2-CE2 3.69Å; F211-F584 HydrophobicContact CE2-CE2 3.69Å; F211-F584 HydrophobicContact CE2-CZ 4.33Å; I580-F584 HydrophobicContact CG2-CD2 4.46Å; I580-F584 HydrophobicContact CG2-CE2 3.94Å; I580-F584 WeakPolarHBondContact O-CD2 3.32Å; L581-F584 PolarHBondContact O-N 3.42Å; S582-F584 PolarHBondContact O-N 3.32Å; F584-C588 WeakPolarHBondContact O-CB 3.49Å; F584-C588 PolarHBondContact O-N 3.18Å
585	F	92.3	Very high	91.9	Very high	6 Å²	6	13.8 Å²	13.8	3%	0.026	8%	0.077	C	C	.	.	H	α-helix	trans	-71.1	-41.3	177.1	-76.7	-52.9	0	0	0	113.2	F205 F428 T432 L581 S582 M587 C588 Y589	F205-F585 HydrophobicContact CD2-CD1 4.23Å; F205-F585 AromaticContact CD2-CE1 3.72Å; F205-F585 HydrophobicContact CD2-CE1 3.72Å; F205-F585 AromaticContact CE2-CE1 3.78Å; F205-F585 HydrophobicContact CE2-CE1 3.78Å; F428-F585 HydrophobicContact CE1-CB 4.02Å; T432-F585 HydrophobicContact CG2-CB 3.99Å; T432-F585 HydrophobicContact CG2-CD2 3.53Å; T432-F585 HydrophobicContact CG2-CE2 4.1Å; T432-F585 HydrophobicContact CG2-CG 3.89Å; L581-F585 HydrophobicContact CD1-CD2 3.7Å; L581-F585 HydrophobicContact CD1-CE2 3.41Å; L581-F585 VanDerWaalsContact CD1-CE2 3.41Å; L581-F585 HydrophobicContact CD1-CZ 4.32Å; L581-F585 HydrophobicContact CD2-CE2 4.37Å; L581-F585 HydrophobicContact CG-CD2 3.94Å; L581-F585 HydrophobicContact CG-CE2 3.91Å; L581-F585 PolarHBondContact O-N 3.49Å; S582-F585 PolarHBondContact O-N 2.95Å; F585-M587 VanDerWaalsContact C-N 3.29Å; F585-M587 PolarHBondContact O-N 2.94Å; F585-C588 WeakPolarHBondContact O-CB 3.36Å; F585-C588 PolarHBondContact O-N 3.06Å; F585-Y589 HydrophobicContact CB-CE2 4.34Å; F585-Y589 WeakPolarHBondContact O-CB 3.33Å; F585-Y589 WeakPolarHBondContact O-CD2 3.24Å; F585-Y589 PolarHBondContact O-N 2.83Å
586	L	93.4	Very high	92.1	Very high	1 Å²	1	13.3 Å²	13.3	1%	0.005	8%	0.075	C	C	.	.	H	α-helix	trans	-58.9	-42	174.4	-77.8	165	0	0	0	111.5	F428 S582 Y589 M590 C626 I629 M630	F428-L586 HydrophobicContact CD1-CG 4.23Å; F428-L586 HydrophobicContact CD2-CD2 4.19Å; F428-L586 HydrophobicContact CE1-CD2 4.02Å; F428-L586 HydrophobicContact CE1-CG 3.72Å; F428-L586 HydrophobicContact CE2-CD2 3.49Å; F428-L586 VanDerWaalsContact CE2-CD2 3.49Å; F428-L586 HydrophobicContact CE2-CG 4.09Å; F428-L586 HydrophobicContact CZ-CD2 3.39Å; F428-L586 HydrophobicContact CZ-CG 3.65Å; S582-L586 VanDerWaalsContact O-CB 3.24Å; S582-L586 WeakPolarHBondContact O-CB 3.48Å; S582-L586 WeakPolarHBondContact O-CD1 3.37Å; S582-L586 VanDerWaalsContact O-CG 3.22Å; S582-L586 WeakPolarHBondContact O-CG 3.3Å; S582-L586 PolarHBondContact O-N 3.5Å; L586-Y589 PolarHBondContact O-N 3.26Å; L586-M590 VanDerWaalsContact O-CB 3.24Å; L586-M590 WeakPolarHBondContact O-CB 3.49Å; L586-M590 PolarHBondContact O-N 2.87Å; L586-C626 HydrophobicContact CD2-CB 4.43Å; L586-I629 HydrophobicContact CD1-CB 4.11Å; L586-I629 HydrophobicContact CD1-CG2 3.57Å; L586-I629 HydrophobicContact CD2-CB 3.93Å; L586-I629 HydrophobicContact CD2-CD1 4.28Å; L586-I629 HydrophobicContact CD2-CG2 3.98Å; L586-I629 HydrophobicContact CG-CG2 4.43Å; L586-M630 HydrophobicContact CD1-CB 4.3Å
587	M	92.3	Very high	92.3	Very high	4 Å²	4	11.5 Å²	11.5	2%	0.02	6%	0.06	C	C	.	.	H	α-helix	trans	-66.3	-44.1	176.5	-171.1	-160.7	-59.9	0	0	112.3	C204 M583 F585 Y589 M590 F591 M630 A641 A645	C204-M587 HydrophobicContact CB-SD 4.41Å; C204-M587 PolarHBondContact SG-SD 2.61Å; M583-M587 VanDerWaalsContact O-CB 3.29Å; M583-M587 WeakPolarHBondContact O-CB 3.24Å; M583-M587 PolarHBondContact O-N 2.95Å; F585-M587 VanDerWaalsContact C-N 3.29Å; F585-M587 PolarHBondContact O-N 2.94Å; M587-Y589 VanDerWaalsContact C-N 3.35Å; M587-Y589 PolarHBondContact O-N 3.35Å; M587-M590 HydrophobicContact CG-CE 4.32Å; M587-M590 WeakPolarHBondContact O-CB 3.47Å; M587-M590 PolarHBondContact O-N 3.44Å; M587-F591 HydrophobicContact CG-CD2 3.89Å; M587-F591 HydrophobicContact CG-CE2 3.48Å; M587-F591 VanDerWaalsContact CG-CE2 3.48Å; M587-F591 HydrophobicContact CG-CZ 4.34Å; M587-F591 VanDerWaalsContact O-CD2 3.27Å; M587-F591 WeakPolarHBondContact O-CD2 3.25Å; M587-F591 PolarHBondContact O-N 3.1Å; M587-F591 HydrophobicContact SD-CD2 4.49Å; M587-F591 HydrophobicContact SD-CE2 3.73Å; M587-M630 HydrophobicContact CB-SD 4.46Å; M587-A641 HydrophobicContact CE-CB 3.26Å; M587-A641 VanDerWaalsContact CE-O 3.28Å; M587-A641 WeakPolarHBondContact CE-O 3.39Å; M587-A645 HydrophobicContact CE-CB 4.4Å; M587-A645 HydrophobicContact SD-CB 3.43Å; M587-A645 WeakPolarHBondContact SD-CB 3.48Å
588	C	92.7	Very high	92.4	Very high	0 Å²	0	14 Å²	14	0%	0	8%	0.075	C	C	.	.	H	α-helix	trans	-55.4	-49.8	173.8	175.5	0	0	0	0	111.1	C204 M435 F584 F585 F591 V592	C204-C588 HydrophobicContact CB-CB 4.37Å; M435-C588 VanDerWaalsContact CE-SG 3.54Å; F584-C588 WeakPolarHBondContact O-CB 3.49Å; F584-C588 PolarHBondContact O-N 3.18Å; F585-C588 WeakPolarHBondContact O-CB 3.36Å; F585-C588 PolarHBondContact O-N 3.06Å; C588-F591 PolarHBondContact O-N 3.27Å; C588-V592 WeakPolarHBondContact O-CG2 3.25Å; C588-V592 PolarHBondContact O-N 3.18Å; C588-V592 VanDerWaalsContact O-N 3.1Å
589	Y	94.6	Very high	92.4	Very high	0 Å²	0	14.8 Å²	14.8	0%	0	8%	0.079	C	C	.	.	H	α-helix	trans	-67.7	-36.5	178.9	-60.5	-14.2	0	0	0	112.6	T164 T167 F428 I434 M435 F585 L586 M587 V592 N593	T164-Y589 HydrophobicContact CG2-CE2 4.05Å; T167-Y589 HydrophobicContact CG2-CD1 3.88Å; T167-Y589 HydrophobicContact CG2-CG 3.81Å; F428-Y589 HydrophobicContact CE1-CE2 4.42Å; F428-Y589 HydrophobicContact CZ-CD2 4.06Å; F428-Y589 HydrophobicContact CZ-CE2 4.02Å; I434-Y589 HydrophobicContact CD1-CE1 4.19Å; I434-Y589 HydrophobicContact CG1-CE1 4.16Å; M435-Y589 HydrophobicContact CE-CD1 4.25Å; M435-Y589 HydrophobicContact CE-CE1 4.24Å; F585-Y589 HydrophobicContact CB-CE2 4.34Å; F585-Y589 WeakPolarHBondContact O-CB 3.33Å; F585-Y589 WeakPolarHBondContact O-CD2 3.24Å; F585-Y589 PolarHBondContact O-N 2.83Å; L586-Y589 PolarHBondContact O-N 3.26Å; M587-Y589 VanDerWaalsContact C-N 3.35Å; M587-Y589 PolarHBondContact O-N 3.35Å; Y589-V592 PolarHBondContact O-N 3.01Å; Y589-N593 VanDerWaalsContact O-CB 3.32Å; Y589-N593 WeakPolarHBondContact O-CB 3.33Å; Y589-N593 VanDerWaalsContact O-CG 3.31Å; Y589-N593 PolarHBondContact O-N 2.71Å; Y589-N593 PolarHBondContact O-ND2 3.15Å
590	M	94.4	Very high	92.5	Very high	12 Å²	12	15.4 Å²	15.4	6%	0.059	8%	0.082	C	C	.	.	H	α-helix	trans	-58.7	-47.1	172.9	-177.4	-164.8	72.4	0	0	111.3	L586 M587 N593 L594 M623 C626 L627 M630	L586-M590 VanDerWaalsContact O-CB 3.24Å; L586-M590 WeakPolarHBondContact O-CB 3.49Å; L586-M590 PolarHBondContact O-N 2.87Å; M587-M590 HydrophobicContact CG-CE 4.32Å; M587-M590 WeakPolarHBondContact O-CB 3.47Å; M587-M590 PolarHBondContact O-N 3.44Å; M590-N593 PolarHBondContact O-N 2.98Å; M590-L594 VanDerWaalsContact O-CB 3.24Å; M590-L594 WeakPolarHBondContact O-CB 3.21Å; M590-L594 PolarHBondContact O-N 2.86Å; M590-M623 HydrophobicContact CG-CG 4.01Å; M590-C626 HydrophobicContact CB-CB 3.9Å; M590-L627 HydrophobicContact SD-CB 4.46Å; M590-L627 HydrophobicContact SD-CD1 4.31Å; M590-M630 HydrophobicContact SD-CE 4.19Å
591	F	93.4	Very high	92.6	Very high	23 Å²	23	18.8 Å²	18.8	10%	0.101	10%	0.1	C	C	.	.	H	α-helix	trans	-67.7	-40.6	179.5	-75.2	-52.6	0	0	0	113.2	V201 M587 C588 N593 L594 A595 A645	V201-F591 HydrophobicContact CG2-CB 3.66Å; M587-F591 HydrophobicContact CG-CD2 3.89Å; M587-F591 HydrophobicContact CG-CE2 3.48Å; M587-F591 VanDerWaalsContact CG-CE2 3.48Å; M587-F591 HydrophobicContact CG-CZ 4.34Å; M587-F591 VanDerWaalsContact O-CD2 3.27Å; M587-F591 WeakPolarHBondContact O-CD2 3.25Å; M587-F591 PolarHBondContact O-N 3.1Å; M587-F591 HydrophobicContact SD-CD2 4.49Å; M587-F591 HydrophobicContact SD-CE2 3.73Å; C588-F591 PolarHBondContact O-N 3.27Å; F591-N593 VanDerWaalsContact C-N 3.34Å; F591-N593 PolarHBondContact O-N 3.42Å; F591-L594 HydrophobicContact CD1-CD2 4.31Å; F591-L594 PolarHBondContact O-N 3.01Å; F591-A595 VanDerWaalsContact O-CB 3.27Å; F591-A595 WeakPolarHBondContact O-CB 3.36Å; F591-A595 PolarHBondContact O-N 3.35Å; F591-A645 HydrophobicContact CE2-CB 3.57Å; F591-A645 HydrophobicContact CZ-CB 3.67Å
592	V	93.8	Very high	92.3	Very high	1 Å²	1	22.5 Å²	22.5	1%	0.006	12%	0.119	C	C	.	.	H	α-helix	trans	-58.9	-46.9	173.9	169.3	0	0	0	0	110.8	T167 I174 V201 M435 C588 Y589 C596	T167-V592 HydrophobicContact CG2-CG1 4.45Å; I174-V592 HydrophobicContact CD1-CG1 3.96Å; V201-V592 HydrophobicContact CG1-CG2 3.9Å; V201-V592 HydrophobicContact CG2-CG2 4.25Å; M435-V592 HydrophobicContact CE-CG2 3.97Å; C588-V592 WeakPolarHBondContact O-CG2 3.25Å; C588-V592 PolarHBondContact O-N 3.18Å; C588-V592 VanDerWaalsContact O-N 3.1Å; Y589-V592 PolarHBondContact O-N 3.01Å; V592-C596 PolarHBondContact O-N 3.49Å; V592-C596 PolarHBondContact O-SG 3.48Å; V592-C596 VanDerWaalsContact O-SG 3.34Å
593	N	96.1	Very high	91.8	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-66.2	-43.1	178.5	-76.8	-35.8	0	0	0	112.8	T167 S170 Y589 M590 F591 A597 S619 M623	T167-N593 WeakPolarHBondContact CA-OD1 3.42Å; T167-N593 PolarHBondContact OG1-ND2 3.46Å; S170-N593 VanDerWaalsContact CB-OD1 3.24Å; S170-N593 WeakPolarHBondContact CB-OD1 3.18Å; S170-N593 PolarHBondContact OG-OD1 3.47Å; Y589-N593 VanDerWaalsContact O-CB 3.32Å; Y589-N593 WeakPolarHBondContact O-CB 3.33Å; Y589-N593 VanDerWaalsContact O-CG 3.31Å; Y589-N593 PolarHBondContact O-N 2.71Å; Y589-N593 PolarHBondContact O-ND2 3.15Å; M590-N593 PolarHBondContact O-N 2.98Å; F591-N593 VanDerWaalsContact C-N 3.34Å; F591-N593 PolarHBondContact O-N 3.42Å; N593-A597 WeakPolarHBondContact O-CB 3.22Å; N593-A597 PolarHBondContact O-N 3.31Å; N593-S619 WeakPolarHBondContact CB-O 3.18Å; N593-S619 WeakPolarHBondContact O-CB 3.43Å; N593-M623 HydrophobicContact CB-CB 3.88Å
594	L	94.2	Very high	91.3	Very high	55 Å²	55	32.9 Å²	32.9	29%	0.288	16%	0.16	S	C	.	.	H	α-helix	trans	-59.9	-49.3	175.5	172.9	63.7	0	0	0	111.2	M590 F591 A597 V598 M623	M590-L594 VanDerWaalsContact O-CB 3.24Å; M590-L594 WeakPolarHBondContact O-CB 3.21Å; M590-L594 PolarHBondContact O-N 2.86Å; F591-L594 HydrophobicContact CD1-CD2 4.31Å; F591-L594 PolarHBondContact O-N 3.01Å; L594-A597 PolarHBondContact O-N 3.42Å; L594-V598 HydrophobicContact CD1-CG2 3.69Å; L594-V598 HydrophobicContact CG-CG2 4.31Å; L594-V598 WeakPolarHBondContact O-CB 3.32Å; L594-V598 VanDerWaalsContact O-CG2 3.29Å; L594-V598 WeakPolarHBondContact O-CG2 3.4Å; L594-V598 PolarHBondContact O-N 3.42Å; L594-M623 HydrophobicContact CB-CG 4.11Å; L594-M623 HydrophobicContact CB-SD 3.98Å; L594-M623 HydrophobicContact CD1-SD 3.61Å; L594-M623 HydrophobicContact CG-SD 4.34Å
595	A	92.3	Very high	90.4	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-60.6	-51	-177.3	0	0	0	0	0	111.5	L193 F197 F591 A597 V598 Q599	L193-A595 HydrophobicContact CD1-CB 3.75Å; L193-A595 HydrophobicContact CD2-CB 4.22Å; F197-A595 HydrophobicContact CD1-CB 3.84Å; F197-A595 HydrophobicContact CD2-CB 4.41Å; F197-A595 HydrophobicContact CE1-CB 3.98Å; F197-A595 HydrophobicContact CG-CB 4.07Å; F197-A595 HydrophobicContact CZ-CB 4.33Å; F591-A595 VanDerWaalsContact O-CB 3.27Å; F591-A595 WeakPolarHBondContact O-CB 3.36Å; F591-A595 PolarHBondContact O-N 3.35Å; A595-A597 VanDerWaalsContact C-N 3.32Å; A595-A597 PolarHBondContact O-N 3.19Å; A595-V598 PolarHBondContact O-N 3.21Å; A595-Q599 WeakPolarHBondContact O-CB 3.43Å; A595-Q599 VanDerWaalsContact O-CG 3.25Å; A595-Q599 WeakPolarHBondContact O-CG 3.46Å; A595-Q599 PolarHBondContact O-N 2.98Å
596	C	93.7	Very high	89.9	Confident	0 Å²	0	38.7 Å²	38.7	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-57.3	-43.6	177.8	-65.8	0	0	0	0	112.2	V592 T600 W607 Y614	V592-C596 PolarHBondContact O-N 3.49Å; V592-C596 PolarHBondContact O-SG 3.48Å; V592-C596 VanDerWaalsContact O-SG 3.34Å; C596-T600 PolarHBondContact O-N 3.18Å; C596-T600 PolarHBondContact O-OG1 3.13Å; C596-T600 VanDerWaalsContact O-OG1 3.13Å; C596-W607 HydrophobicContact CB-CH2 4.32Å; C596-W607 HydrophobicContact CB-CZ2 4Å; C596-Y614 HydrophobicContact CB-CE2 4.28Å; C596-Y614 PolarHBondContact O-OH 3.42Å
597	A	94.7	Very high	89.5	Confident	8 Å²	8	39.5 Å²	39.5	7%	0.066	20%	0.198	C	C	.	.	H	α-helix	trans	-64.3	-46.5	178.3	0	0	0	0	0	112.2	N593 L594 A595 L601 F620	N593-A597 WeakPolarHBondContact O-CB 3.22Å; N593-A597 PolarHBondContact O-N 3.31Å; L594-A597 PolarHBondContact O-N 3.42Å; A595-A597 VanDerWaalsContact C-N 3.32Å; A595-A597 PolarHBondContact O-N 3.19Å; A597-L601 WeakPolarHBondContact O-CB 3.44Å; A597-L601 PolarHBondContact O-N 2.86Å; A597-F620 HydrophobicContact CB-CB 4.5Å
598	V	91.7	Very high	89.3	Confident	52 Å²	52	47.3 Å²	47.3	32%	0.315	23%	0.227	S	C	.	.	H	α-helix	trans	-65.5	-42.5	-179.8	169.1	0	0	0	0	111.6	L594 A595 L601 L602	L594-V598 HydrophobicContact CD1-CG2 3.69Å; L594-V598 HydrophobicContact CG-CG2 4.31Å; L594-V598 WeakPolarHBondContact O-CB 3.32Å; L594-V598 VanDerWaalsContact O-CG2 3.29Å; L594-V598 WeakPolarHBondContact O-CG2 3.4Å; L594-V598 PolarHBondContact O-N 3.42Å; A595-V598 PolarHBondContact O-N 3.21Å; V598-L601 PolarHBondContact O-N 2.83Å; V598-L602 HydrophobicContact CG1-CD1 3.56Å; V598-L602 HydrophobicContact CG1-CG 4.09Å; V598-L602 WeakPolarHBondContact O-CB 3.34Å; V598-L602 WeakPolarHBondContact O-CG 3.34Å; V598-L602 PolarHBondContact O-N 3.32Å
599	Q	90.4	Very high	89.2	Confident	18 Å²	18	48.9 Å²	48.9	8%	0.084	24%	0.237	C	C	.	.	H	α-helix	trans	-65.5	-41.3	-179.6	-70.9	-171.8	-9.2	0	0	112.4	L193 A595 R603 T604 W607	L193-Q599 VanDerWaalsContact CD2-OE1 3.22Å; L193-Q599 PolarHBondContact O-NE2 2.85Å; A595-Q599 WeakPolarHBondContact O-CB 3.43Å; A595-Q599 VanDerWaalsContact O-CG 3.25Å; A595-Q599 WeakPolarHBondContact O-CG 3.46Å; A595-Q599 PolarHBondContact O-N 2.98Å; Q599-R603 PolarHBondContact O-N 2.87Å; Q599-T604 HydrophobicContact CB-CG2 4.21Å; Q599-T604 WeakPolarHBondContact CB-OG1 3.41Å; Q599-T604 HydrophobicContact CG-CG2 4.08Å; Q599-T604 PolarHBondContact O-N 2.88Å; Q599-T604 VanDerWaalsContact O-N 3.17Å; Q599-T604 PolarHBondContact O-OG1 3.1Å; Q599-W607 HydrophobicContact CB-CB 4.36Å; Q599-W607 HydrophobicContact CB-CD2 4.06Å; Q599-W607 HydrophobicContact CB-CG 3.86Å; Q599-W607 VanDerWaalsContact OE1-CE3 3.23Å
600	T	90.1	Very high	88.9	Confident	41 Å²	41	57.2 Å²	57.2	25%	0.252	27%	0.269	S	S	.	.	H	α-helix	trans	-63.3	-45.1	171.3	-59.7	0	0	0	0	111.9	C596 R603 W607 Y614 W616	C596-T600 PolarHBondContact O-N 3.18Å; C596-T600 PolarHBondContact O-OG1 3.13Å; C596-T600 VanDerWaalsContact O-OG1 3.13Å; T600-R603 PolarHBondContact O-N 2.83Å; T600-W607 PolarHBondContact OG1-NE1 3.35Å; T600-Y614 WeakPolarHBondContact OG1-CE1 3.32Å; T600-Y614 PolarHBondContact OG1-OH 3.48Å; T600-W616 HydrophobicContact CG2-CB 3.95Å
601	L	89.3	Confident	88.8	Confident	121 Å²	121	58.3 Å²	58.3	63%	0.634	27%	0.273	S	S	*	.	H	α-helix	trans	-67.6	-40.1	-177.2	-171.1	70	0	0	0	112.6	A597 V598 R603	A597-L601 WeakPolarHBondContact O-CB 3.44Å; A597-L601 PolarHBondContact O-N 2.86Å; V598-L601 PolarHBondContact O-N 2.83Å; L601-R603 VanDerWaalsContact C-N 3.28Å; L601-R603 PolarHBondContact O-N 3.46Å
602	L	84.3	Confident	88.6	Confident	79 Å²	79	66 Å²	66	41%	0.414	31%	0.307	S	S	.	.	H	α-helix	trans	-79.8	-7.3	179.2	-67.3	-178.5	0	0	0	113.9	V598	V598-L602 HydrophobicContact CG1-CD1 3.56Å; V598-L602 HydrophobicContact CG1-CG 4.09Å; V598-L602 WeakPolarHBondContact O-CB 3.34Å; V598-L602 WeakPolarHBondContact O-CG 3.34Å; V598-L602 PolarHBondContact O-N 3.32Å
603	R	81.2	Confident	88.6	Confident	203 Å²	203	73.7 Å²	73.7	77%	0.766	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	61	-172.7	-59.2	-176.6	-178.4	-175.7	-0.3	111.4	Q599 T600 L601	Q599-R603 PolarHBondContact O-N 2.87Å; T600-R603 PolarHBondContact O-N 2.83Å; L601-R603 VanDerWaalsContact C-N 3.28Å; L601-R603 PolarHBondContact O-N 3.46Å
604	T	79.6	Confident	88.6	Confident	25 Å²	25	75.1 Å²	75.1	15%	0.153	34%	0.342	C	S	.	.			trans	-63.8	130.8	175.1	44.1	0	0	0	0	110.9	Q599 N606 W607 Y675	Q599-T604 HydrophobicContact CB-CG2 4.21Å; Q599-T604 WeakPolarHBondContact CB-OG1 3.41Å; Q599-T604 HydrophobicContact CG-CG2 4.08Å; Q599-T604 PolarHBondContact O-N 2.88Å; Q599-T604 VanDerWaalsContact O-N 3.17Å; Q599-T604 PolarHBondContact O-OG1 3.1Å; T604-N606 VanDerWaalsContact C-N 3.31Å; T604-N606 PolarHBondContact O-N 3.47Å; T604-N606 VanDerWaalsContact O-N 3.14Å; T604-W607 PolarHBondContact O-N 3Å; T604-W607 WeakPolarHBondContact OG1-CB 3.38Å; T604-Y675 VanDerWaalsContact CA-OH 3.29Å; T604-Y675 WeakPolarHBondContact CA-OH 3.43Å; T604-Y675 HydrophobicContact CG2-CE2 4.27Å; T604-Y675 WeakPolarHBondContact CG2-OH 3.48Å
605	P	74.1	Confident	88.6	Confident	19 Å²	19	76.9 Å²	76.9	12%	0.123	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-41.2	-167.5	-30.3	35.7	0	0	0	115.1	W607 R608 I678	P605-W607 VanDerWaalsContact C-N 3.34Å; P605-W607 PolarHBondContact O-N 2.98Å; P605-R608 PolarHBondContact O-NE 3.06Å; P605-R608 VanDerWaalsContact O-NE 3.1Å; P605-R608 PolarHBondContact O-NH2 3.37Å; P605-I678 HydrophobicContact CG-CG2 3.96Å
606	N	80.8	Confident	88.7	Confident	150 Å²	150	81.7 Å²	81.7	80%	0.802	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	5.1	-175.7	-63.8	-5.9	0	0	0	114.1	N177 T604	N177-N606 PolarHBondContact ND2-O 3.46Å; N177-N606 VanDerWaalsContact ND2-O 3.1Å; N177-N606 PolarHBondContact OD1-O 3.44Å; T604-N606 VanDerWaalsContact C-N 3.31Å; T604-N606 PolarHBondContact O-N 3.47Å; T604-N606 VanDerWaalsContact O-N 3.14Å
607	W	86	Confident	88.8	Confident	19 Å²	19	84.5 Å²	84.5	7%	0.072	38%	0.384	C	S	.	.			trans	-106.6	100.6	-177.6	-177.8	-104.7	0	0	0	110.7	A173 I174 N177 L193 C596 Q599 T600 T604 P605 P609	A173-W607 HydrophobicContact CB-CH2 4.38Å; A173-W607 HydrophobicContact CB-CZ2 4.34Å; I174-W607 HydrophobicContact CG1-CH2 3.85Å; I174-W607 HydrophobicContact CG1-CZ3 4.15Å; N177-W607 HydrophobicContact CB-CE3 4.24Å; N177-W607 HydrophobicContact CB-CZ3 4.12Å; L193-W607 HydrophobicContact CD2-CE3 4.43Å; L193-W607 HydrophobicContact CD2-CH2 4.24Å; L193-W607 HydrophobicContact CD2-CZ3 3.8Å; C596-W607 HydrophobicContact CB-CH2 4.32Å; C596-W607 HydrophobicContact CB-CZ2 4Å; Q599-W607 HydrophobicContact CB-CB 4.36Å; Q599-W607 HydrophobicContact CB-CD2 4.06Å; Q599-W607 HydrophobicContact CB-CG 3.86Å; Q599-W607 VanDerWaalsContact OE1-CE3 3.23Å; T600-W607 PolarHBondContact OG1-NE1 3.35Å; T604-W607 PolarHBondContact O-N 3Å; T604-W607 WeakPolarHBondContact OG1-CB 3.38Å; P605-W607 VanDerWaalsContact C-N 3.34Å; P605-W607 PolarHBondContact O-N 2.98Å; W607-P609 HydrophobicContact CZ2-CB 4.33Å; W607-P609 HydrophobicContact CZ2-CG 4.08Å
608	R	88.4	Confident	88.9	Confident	167 Å²	167	86.8 Å²	86.8	63%	0.63	40%	0.395	S	S	*	.			trans	-137.6	63.4	-177.1	-57.2	-177.8	-170.8	-169	-2.2	109.4	N177 P605 R610 E682	N177-R608 PolarHBondContact OD1-N 3.47Å; P605-R608 PolarHBondContact O-NE 3.06Å; P605-R608 VanDerWaalsContact O-NE 3.1Å; P605-R608 PolarHBondContact O-NH2 3.37Å; R608-R610 PolarHBondContact O-N 3.03Å; R608-E682 IonicContact NH2-OE1 3.15Å; R608-E682 PolarHBondContact NH2-OE1 3.09Å
609	P	89.6	Confident	89.1	Confident	33 Å²	33	84.3 Å²	84.3	21%	0.214	38%	0.38	C	S	.	.			trans	-61.1	127.1	-175.7	25.6	-35	0	0	0	111.1	A173 W607 Y614	A173-P609 HydrophobicContact CB-CB 3.9Å; W607-P609 HydrophobicContact CZ2-CB 4.33Å; W607-P609 HydrophobicContact CZ2-CG 4.08Å; P609-Y614 HydrophobicContact CB-CD1 4.19Å; P609-Y614 HydrophobicContact CB-CE1 4.49Å; P609-Y614 HydrophobicContact CG-CD1 3.7Å; P609-Y614 HydrophobicContact CG-CE1 3.68Å
610	R	88.8	Confident	89.4	Confident	175 Å²	175	88.7 Å²	88.7	66%	0.66	40%	0.399	S	S	*	.			trans	-91.1	-1.1	-176.2	-61.1	-168.7	-72	-172.4	-0.9	114.1	R608 K612	R608-R610 PolarHBondContact O-N 3.03Å; R610-K612 PolarHBondContact O-N 3.04Å
611	F	92.1	Very high	89.7	Confident	36 Å²	36	91.2 Å²	91.2	16%	0.158	41%	0.411	C	S	.	.			trans	-71.9	118	-177.1	-172.7	-121	0	0	0	112.9	I169 T176 P452 I456 Y613 Y614	I169-F611 HydrophobicContact CG2-CE1 4.31Å; T176-F611 HydrophobicContact CG2-CB 4.3Å; T176-F611 WeakPolarHBondContact OG1-CB 3.13Å; T176-F611 PolarHBondContact OG1-N 3.37Å; P452-F611 HydrophobicContact CB-CD2 4.29Å; P452-F611 HydrophobicContact CB-CE2 3.89Å; P452-F611 HydrophobicContact CB-CZ 4.48Å; I456-F611 HydrophobicContact CD1-CE1 4.4Å; I456-F611 HydrophobicContact CD1-CZ 3.81Å; F611-Y613 VanDerWaalsContact C-N 3.28Å; F611-Y613 HydrophobicContact CE1-CD2 4.32Å; F611-Y613 HydrophobicContact CE2-CD2 4.17Å; F611-Y613 AromaticContact CZ-CD2 3.83Å; F611-Y613 HydrophobicContact CZ-CD2 3.83Å; F611-Y613 HydrophobicContact CZ-CG 4.45Å; F611-Y613 PolarHBondContact O-N 3.04Å; F611-Y613 VanDerWaalsContact O-N 3.16Å; F611-Y614 WeakPolarHBondContact O-CB 3.46Å; F611-Y614 PolarHBondContact O-N 3.21Å; F611-Y614 VanDerWaalsContact O-N 3.1Å
612	K	90.4	Very high	89.9	Confident	184 Å²	184	85.5 Å²	85.5	80%	0.8	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-32	-173.6	-175.3	177	179.2	-179.7	0	115.2	R610	R610-K612 PolarHBondContact O-N 3.04Å
613	Y	92.9	Very high	90.5	Very high	162 Å²	162	83.2 Å²	83.2	64%	0.635	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.3	6.8	-176.9	-55	-78.8	0	0	0	113.3	F611 L618	F611-Y613 VanDerWaalsContact C-N 3.28Å; F611-Y613 HydrophobicContact CE1-CD2 4.32Å; F611-Y613 HydrophobicContact CE2-CD2 4.17Å; F611-Y613 AromaticContact CZ-CD2 3.83Å; F611-Y613 HydrophobicContact CZ-CD2 3.83Å; F611-Y613 HydrophobicContact CZ-CG 4.45Å; F611-Y613 PolarHBondContact O-N 3.04Å; F611-Y613 VanDerWaalsContact O-N 3.16Å; Y613-L618 WeakPolarHBondContact O-CD1 3.47Å
614	Y	95.3	Very high	91.2	Very high	30 Å²	30	76.1 Å²	76.1	12%	0.118	35%	0.35	C	S	.	.			trans	-80.4	134	175.9	175.9	-106	0	0	0	111.5	A173 C596 T600 P609 F611 S619	A173-Y614 HydrophobicContact CB-CD1 4.24Å; A173-Y614 HydrophobicContact CB-CD2 3.33Å; A173-Y614 HydrophobicContact CB-CE2 3.69Å; A173-Y614 HydrophobicContact CB-CG 3.63Å; C596-Y614 HydrophobicContact CB-CE2 4.28Å; C596-Y614 PolarHBondContact O-OH 3.42Å; T600-Y614 WeakPolarHBondContact OG1-CE1 3.32Å; T600-Y614 PolarHBondContact OG1-OH 3.48Å; P609-Y614 HydrophobicContact CB-CD1 4.19Å; P609-Y614 HydrophobicContact CB-CE1 4.49Å; P609-Y614 HydrophobicContact CG-CD1 3.7Å; P609-Y614 HydrophobicContact CG-CE1 3.68Å; F611-Y614 WeakPolarHBondContact O-CB 3.46Å; F611-Y614 PolarHBondContact O-N 3.21Å; F611-Y614 VanDerWaalsContact O-N 3.1Å; Y614-S619 WeakPolarHBondContact CE2-OG 3.43Å
615	H	95.1	Very high	91.9	Very high	92 Å²	92	76.6 Å²	76.6	43%	0.426	35%	0.351	S	S	.	.			trans	-148.7	145.1	165.7	-169.8	-104.7	0	0	0	109.8	T617 L618	H615-T617 PolarHBondContact ND1-N 3.43Å; H615-T617 PolarHBondContact ND1-OG1 3.24Å; H615-T617 PolarHBondContact O-N 2.85Å; H615-T617 VanDerWaalsContact O-N 3.14Å; H615-L618 HydrophobicContact CB-CD1 4.48Å; H615-L618 WeakPolarHBondContact O-CB 3.5Å; H615-L618 PolarHBondContact O-N 2.92Å
616	W	94.9	Very high	92.8	Very high	102 Å²	102	75.7 Å²	75.7	39%	0.386	35%	0.345	S	S	.	.	H	α-helix	trans	-59.6	-29.7	-174	66.7	-91.8	0	0	0	113.5	T600 L618 S619 F620	T600-W616 HydrophobicContact CG2-CB 3.95Å; W616-L618 VanDerWaalsContact C-N 3.32Å; W616-L618 PolarHBondContact O-N 2.86Å; W616-S619 PolarHBondContact O-N 3.33Å; W616-F620 WeakPolarHBondContact O-CB 3.42Å; W616-F620 PolarHBondContact O-N 3.19Å
617	T	96.2	Very high	93.4	Very high	59 Å²	59	71.4 Å²	71.4	36%	0.362	32%	0.322	S	S	.	.	H	α-helix	trans	-66.3	-31.6	176.2	56.9	0	0	0	0	113	H615 F620 L621	H615-T617 PolarHBondContact ND1-N 3.43Å; H615-T617 PolarHBondContact ND1-OG1 3.24Å; H615-T617 PolarHBondContact O-N 2.85Å; H615-T617 VanDerWaalsContact O-N 3.14Å; T617-F620 PolarHBondContact O-N 3.47Å; T617-L621 VanDerWaalsContact O-CB 3.3Å; T617-L621 WeakPolarHBondContact O-CB 3.2Å; T617-L621 PolarHBondContact O-N 2.95Å
618	L	95.4	Very high	93.8	Very high	56 Å²	56	73 Å²	73	29%	0.293	34%	0.336	S	S	.	.	H	α-helix	trans	-69.1	-43.5	177.6	-63.7	174.8	0	0	0	110.5	L166 I169 Y613 H615 W616 L621 G622	L166-L618 HydrophobicContact CD2-CB 4.26Å; L166-L618 HydrophobicContact CD2-CD2 4.25Å; I169-L618 HydrophobicContact CG2-CD1 4.38Å; Y613-L618 WeakPolarHBondContact O-CD1 3.47Å; H615-L618 HydrophobicContact CB-CD1 4.48Å; H615-L618 WeakPolarHBondContact O-CB 3.5Å; H615-L618 PolarHBondContact O-N 2.92Å; W616-L618 VanDerWaalsContact C-N 3.32Å; W616-L618 PolarHBondContact O-N 2.86Å; L618-L621 PolarHBondContact O-N 3.47Å; L618-G622 PolarHBondContact O-N 3.12Å
619	S	95.9	Very high	93.9	Very high	0 Å²	0	65.2 Å²	65.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-64.4	-41.5	173	-58.2	0	0	0	0	111.9	S170 N593 Y614 W616 L621 G622 M623	S170-S619 WeakPolarHBondContact OG-CB 3.48Å; S170-S619 PolarHBondContact OG-OG 2.79Å; N593-S619 WeakPolarHBondContact CB-O 3.18Å; N593-S619 WeakPolarHBondContact O-CB 3.43Å; Y614-S619 WeakPolarHBondContact CE2-OG 3.43Å; W616-S619 PolarHBondContact O-N 3.33Å; S619-L621 PolarHBondContact O-N 3.1Å; S619-G622 PolarHBondContact O-N 2.65Å; S619-M623 WeakPolarHBondContact O-CB 3.22Å; S619-M623 PolarHBondContact O-N 2.92Å
620	F	96.3	Very high	94	Very high	109 Å²	109	63.6 Å²	63.6	48%	0.478	30%	0.296	S	S	.	.	H	α-helix	trans	-63.3	-40	175.5	-175.3	-98.4	0	0	0	112.7	A597 W616 T617 M623 S624	A597-F620 HydrophobicContact CB-CB 4.5Å; W616-F620 WeakPolarHBondContact O-CB 3.42Å; W616-F620 PolarHBondContact O-N 3.19Å; T617-F620 PolarHBondContact O-N 3.47Å; F620-M623 HydrophobicContact CD2-CE 3.8Å; F620-M623 HydrophobicContact CD2-SD 4.49Å; F620-M623 HydrophobicContact CE2-CE 3.56Å; F620-M623 HydrophobicContact CZ-CE 4.21Å; F620-M623 PolarHBondContact O-N 3.34Å; F620-S624 WeakPolarHBondContact O-CB 3.14Å; F620-S624 PolarHBondContact O-N 3.33Å
621	L	96.3	Very high	94.1	Very high	95 Å²	95	59 Å²	59	50%	0.497	28%	0.281	S	S	.	.	H	α-helix	trans	-65.8	-42.2	174.8	-166.3	153.4	0	0	0	110.9	L166 T617 L618 S619 S624 L625	L166-L621 HydrophobicContact CD1-CD2 3.38Å; T617-L621 VanDerWaalsContact O-CB 3.3Å; T617-L621 WeakPolarHBondContact O-CB 3.2Å; T617-L621 PolarHBondContact O-N 2.95Å; L618-L621 PolarHBondContact O-N 3.47Å; S619-L621 PolarHBondContact O-N 3.1Å; L621-S624 PolarHBondContact O-N 3.47Å; L621-L625 VanDerWaalsContact O-CB 3.31Å; L621-L625 WeakPolarHBondContact O-CB 3.4Å; L621-L625 PolarHBondContact O-N 3.24Å
622	G	95.5	Very high	94	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-58.7	-45.8	172.7	0	0	0	0	0	112.7	L618 S619 L625 C626	L618-G622 PolarHBondContact O-N 3.12Å; S619-G622 PolarHBondContact O-N 2.65Å; G622-L625 PolarHBondContact O-N 3.42Å; G622-C626 PolarHBondContact O-N 2.85Å; G622-C626 PolarHBondContact O-SG 3.47Å
623	M	95.4	Very high	93.6	Very high	31 Å²	31	53.6 Å²	53.6	15%	0.153	26%	0.264	C	S	.	.	H	α-helix	trans	-58.9	-48.6	174.7	-178.6	-152.3	75.1	0	0	111.9	M590 N593 L594 S619 F620 L625 C626 L627	M590-M623 HydrophobicContact CG-CG 4.01Å; N593-M623 HydrophobicContact CB-CB 3.88Å; L594-M623 HydrophobicContact CB-CG 4.11Å; L594-M623 HydrophobicContact CB-SD 3.98Å; L594-M623 HydrophobicContact CD1-SD 3.61Å; L594-M623 HydrophobicContact CG-SD 4.34Å; S619-M623 WeakPolarHBondContact O-CB 3.22Å; S619-M623 PolarHBondContact O-N 2.92Å; F620-M623 HydrophobicContact CD2-CE 3.8Å; F620-M623 HydrophobicContact CD2-SD 4.49Å; F620-M623 HydrophobicContact CE2-CE 3.56Å; F620-M623 HydrophobicContact CZ-CE 4.21Å; F620-M623 PolarHBondContact O-N 3.34Å; M623-L625 VanDerWaalsContact C-N 3.32Å; M623-L625 PolarHBondContact O-N 2.76Å; M623-C626 PolarHBondContact O-N 3.17Å; M623-L627 WeakPolarHBondContact O-CB 3.35Å; M623-L627 PolarHBondContact O-N 3.23Å
624	S	95.4	Very high	93.2	Very high	55 Å²	55	46.4 Å²	46.4	39%	0.385	24%	0.238	S	C	.	.	H	α-helix	trans	-60.8	-41.2	178.7	-174.6	0	0	0	0	112.1	F620 L621 L627 S628	F620-S624 WeakPolarHBondContact O-CB 3.14Å; F620-S624 PolarHBondContact O-N 3.33Å; L621-S624 PolarHBondContact O-N 3.47Å; S624-L627 PolarHBondContact O-N 3.29Å; S624-S628 WeakPolarHBondContact O-CB 3.47Å; S624-S628 PolarHBondContact O-N 3.06Å; S624-S628 PolarHBondContact O-OG 3.46Å
625	L	94.3	Very high	92.9	Very high	34 Å²	34	52.8 Å²	52.8	18%	0.178	26%	0.262	C	S	.	.	H	α-helix	trans	-68.2	-46.3	178.2	-164.2	165.3	0	0	0	110.8	C163 L166 L621 G622 M623 L627 S628 I629	C163-L625 HydrophobicContact CB-CD2 3.47Å; C163-L625 VanDerWaalsContact CB-CD2 3.47Å; L166-L625 HydrophobicContact CD1-CD1 4.31Å; L621-L625 VanDerWaalsContact O-CB 3.31Å; L621-L625 WeakPolarHBondContact O-CB 3.4Å; L621-L625 PolarHBondContact O-N 3.24Å; G622-L625 PolarHBondContact O-N 3.42Å; M623-L625 VanDerWaalsContact C-N 3.32Å; M623-L625 PolarHBondContact O-N 2.76Å; L625-L627 VanDerWaalsContact C-N 3.33Å; L625-L627 PolarHBondContact O-N 2.87Å; L625-S628 PolarHBondContact O-N 3.25Å; L625-I629 HydrophobicContact CD2-CD1 3.49Å; L625-I629 VanDerWaalsContact CD2-CD1 3.49Å; L625-I629 HydrophobicContact CD2-CG1 4.02Å; L625-I629 WeakPolarHBondContact O-CG1 3.49Å; L625-I629 PolarHBondContact O-N 3.17Å
626	C	94.4	Very high	92.6	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-53.9	-48.6	173.2	-67	0	0	0	0	111.9	C163 L586 M590 G622 M623 S628 I629 M630	C163-C626 PolarHBondContact SG-SG 3.13Å; L586-C626 HydrophobicContact CD2-CB 4.43Å; M590-C626 HydrophobicContact CB-CB 3.9Å; G622-C626 PolarHBondContact O-N 2.85Å; G622-C626 PolarHBondContact O-SG 3.47Å; M623-C626 PolarHBondContact O-N 3.17Å; C626-S628 PolarHBondContact O-N 3.47Å; C626-I629 PolarHBondContact O-N 3.46Å; C626-M630 WeakPolarHBondContact O-CB 3.5Å; C626-M630 PolarHBondContact O-N 3.18Å; C626-M630 VanDerWaalsContact O-N 3.08Å
627	L	93.6	Very high	92.2	Very high	61 Å²	61	54.5 Å²	54.5	32%	0.319	27%	0.266	S	S	.	.	H	α-helix	trans	-63	-42.7	179.7	-174.4	148.3	0	0	0	111.2	M590 M623 S624 L625 M630 F631	M590-L627 HydrophobicContact SD-CB 4.46Å; M590-L627 HydrophobicContact SD-CD1 4.31Å; M623-L627 WeakPolarHBondContact O-CB 3.35Å; M623-L627 PolarHBondContact O-N 3.23Å; S624-L627 PolarHBondContact O-N 3.29Å; L625-L627 VanDerWaalsContact C-N 3.33Å; L625-L627 PolarHBondContact O-N 2.87Å; L627-M630 PolarHBondContact O-N 3.32Å; L627-F631 HydrophobicContact CD2-CD2 3.69Å; L627-F631 HydrophobicContact CD2-CE2 3.87Å; L627-F631 HydrophobicContact CG-CD2 4.01Å; L627-F631 HydrophobicContact CG-CE2 4.04Å; L627-F631 WeakPolarHBondContact O-CD2 3.3Å; L627-F631 PolarHBondContact O-N 3.42Å
628	S	92.6	Very high	91.8	Very high	51 Å²	51	51.7 Å²	51.7	36%	0.357	25%	0.249	S	C	.	.	H	α-helix	trans	-59.4	-48.5	177.3	-59.6	0	0	0	0	111.9	S624 L625 C626 M630 F631 I632	S624-S628 WeakPolarHBondContact O-CB 3.47Å; S624-S628 PolarHBondContact O-N 3.06Å; S624-S628 PolarHBondContact O-OG 3.46Å; L625-S628 PolarHBondContact O-N 3.25Å; C626-S628 PolarHBondContact O-N 3.47Å; S628-M630 VanDerWaalsContact C-N 3.32Å; S628-M630 PolarHBondContact O-N 3.12Å; S628-F631 PolarHBondContact O-N 3.07Å; S628-I632 VanDerWaalsContact O-CB 3.32Å; S628-I632 WeakPolarHBondContact O-CB 3.42Å; S628-I632 WeakPolarHBondContact O-CD1 3.39Å; S628-I632 WeakPolarHBondContact O-CG1 3.48Å; S628-I632 PolarHBondContact O-N 3.35Å
629	I	91.6	Very high	91.6	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.021	26%	0.256	C	S	.	.	H	α-helix	trans	-60.2	-43.6	177.5	-61.8	179.5	0	0	0	111.1	L159 C163 V424 F428 L586 L625 C626 F631 I632 S633	L159-I629 HydrophobicContact CD2-CD1 3.44Å; L159-I629 VanDerWaalsContact CD2-CD1 3.44Å; L159-I629 HydrophobicContact CD2-CG1 3.79Å; L159-I629 HydrophobicContact CG-CD1 4.11Å; L159-I629 HydrophobicContact CG-CG1 4.39Å; C163-I629 HydrophobicContact CB-CD1 4.19Å; V424-I629 HydrophobicContact CG1-CG2 3.81Å; F428-I629 HydrophobicContact CE2-CD1 4.47Å; L586-I629 HydrophobicContact CD1-CB 4.11Å; L586-I629 HydrophobicContact CD1-CG2 3.57Å; L586-I629 HydrophobicContact CD2-CB 3.93Å; L586-I629 HydrophobicContact CD2-CD1 4.28Å; L586-I629 HydrophobicContact CD2-CG2 3.98Å; L586-I629 HydrophobicContact CG-CG2 4.43Å; L625-I629 HydrophobicContact CD2-CD1 3.49Å; L625-I629 VanDerWaalsContact CD2-CD1 3.49Å; L625-I629 HydrophobicContact CD2-CG1 4.02Å; L625-I629 WeakPolarHBondContact O-CG1 3.49Å; L625-I629 PolarHBondContact O-N 3.17Å; C626-I629 PolarHBondContact O-N 3.46Å; I629-F631 PolarHBondContact O-N 3.43Å; I629-I632 PolarHBondContact O-N 3.27Å; I629-S633 WeakPolarHBondContact O-CB 3.32Å; I629-S633 PolarHBondContact O-N 3.09Å
630	M	91.6	Very high	91.3	Very high	0 Å²	0	58 Å²	58	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.2	-45.6	-178.4	-164	175.8	55.1	0	0	111.6	M583 L586 M587 M590 C626 L627 S628 S634 A638 M642	M583-M630 HydrophobicContact SD-CG 3.58Å; M583-M630 VanDerWaalsContact SD-CG 3.58Å; L586-M630 HydrophobicContact CD1-CB 4.3Å; M587-M630 HydrophobicContact CB-SD 4.46Å; M590-M630 HydrophobicContact SD-CE 4.19Å; C626-M630 WeakPolarHBondContact O-CB 3.5Å; C626-M630 PolarHBondContact O-N 3.18Å; C626-M630 VanDerWaalsContact O-N 3.08Å; L627-M630 PolarHBondContact O-N 3.32Å; S628-M630 VanDerWaalsContact C-N 3.32Å; S628-M630 PolarHBondContact O-N 3.12Å; M630-S634 CarbonylContact O-C 3.53Å; M630-S634 PolarHBondContact O-N 2.7Å; M630-S634 VanDerWaalsContact O-N 3.14Å; M630-A638 HydrophobicContact CB-CB 4.48Å; M630-A638 HydrophobicContact CE-CB 4.2Å; M630-A638 HydrophobicContact CG-CB 3.7Å; M630-A638 HydrophobicContact SD-CB 4.32Å; M630-M642 HydrophobicContact CE-CE 4.16Å; M630-M642 HydrophobicContact CE-CG 3.68Å; M630-M642 HydrophobicContact CE-SD 3.56Å; M630-M642 VanDerWaalsContact CE-SD 3.56Å
631	F	91.8	Very high	90.8	Very high	78 Å²	78	53.6 Å²	53.6	34%	0.342	26%	0.264	S	S	.	.	H	α-helix	trans	-69.2	-37.2	175.3	-87.7	-85	0	0	0	113.7	L627 S628 I629 W635 I639 M642	L627-F631 HydrophobicContact CD2-CD2 3.69Å; L627-F631 HydrophobicContact CD2-CE2 3.87Å; L627-F631 HydrophobicContact CG-CD2 4.01Å; L627-F631 HydrophobicContact CG-CE2 4.04Å; L627-F631 WeakPolarHBondContact O-CD2 3.3Å; L627-F631 PolarHBondContact O-N 3.42Å; S628-F631 PolarHBondContact O-N 3.07Å; I629-F631 PolarHBondContact O-N 3.43Å; F631-W635 HydrophobicContact CD1-CB 3.8Å; F631-W635 HydrophobicContact CE1-CB 4.39Å; F631-W635 PolarHBondContact O-N 3.08Å; F631-I639 HydrophobicContact CE1-CD1 4.3Å; F631-I639 HydrophobicContact CE1-CG1 4.02Å; F631-I639 HydrophobicContact CZ-CG1 4.16Å; F631-M642 HydrophobicContact CE2-CE 3.57Å; F631-M642 HydrophobicContact CZ-CE 3.57Å
632	I	88.9	Confident	90.4	Very high	81 Å²	81	51.5 Å²	51.5	42%	0.415	25%	0.252	S	S	.	.	H	α-helix	trans	-64.4	-40	178	-75.7	167.8	0	0	0	111.4	T421 S628 I629	T421-I632 VanDerWaalsContact CB-O 3.25Å; T421-I632 WeakPolarHBondContact CB-O 3.47Å; T421-I632 HydrophobicContact CG2-CG2 3.47Å; T421-I632 VanDerWaalsContact CG2-CG2 3.47Å; T421-I632 PolarHBondContact OG1-O 3.38Å; S628-I632 VanDerWaalsContact O-CB 3.32Å; S628-I632 WeakPolarHBondContact O-CB 3.42Å; S628-I632 WeakPolarHBondContact O-CD1 3.39Å; S628-I632 WeakPolarHBondContact O-CG1 3.48Å; S628-I632 PolarHBondContact O-N 3.35Å; I629-I632 PolarHBondContact O-N 3.27Å
633	S	82.9	Confident	90.1	Very high	26 Å²	26	53.4 Å²	53.4	18%	0.182	27%	0.272	C	S	.	.	H	α-helix	trans	-75.7	-49.8	179.9	174.1	0	0	0	0	112.5	M583 I629	M583-S633 VanDerWaalsContact CE-CB 3.49Å; M583-S633 VanDerWaalsContact CE-OG 3.29Å; M583-S633 WeakPolarHBondContact CE-OG 3.49Å; I629-S633 WeakPolarHBondContact O-CB 3.32Å; I629-S633 PolarHBondContact O-N 3.09Å
634	S	84.1	Confident	89.7	Confident	11 Å²	11	56.6 Å²	56.6	8%	0.077	29%	0.289	C	S	.	.	H	α-helix	trans	-160.3	100.5	171.8	178.3	0	0	0	0	111.9	M630 Y636 Y637 A638	M630-S634 CarbonylContact O-C 3.53Å; M630-S634 PolarHBondContact O-N 2.7Å; M630-S634 VanDerWaalsContact O-N 3.14Å; S634-Y636 VanDerWaalsContact C-N 3.28Å; S634-Y636 PolarHBondContact O-N 3.12Å; S634-Y636 VanDerWaalsContact OG-CD1 3.31Å; S634-Y636 WeakPolarHBondContact OG-CD1 3.34Å; S634-Y636 WeakPolarHBondContact OG-CE1 3.42Å; S634-Y636 VanDerWaalsContact OG-CZ 3.26Å; S634-Y637 PolarHBondContact O-N 2.56Å; S634-Y637 WeakPolarHBondContact OG-CD2 3.04Å; S634-Y637 PolarHBondContact OG-N 2.82Å; S634-A638 VanDerWaalsContact O-CB 3.26Å; S634-A638 WeakPolarHBondContact O-CB 3.48Å; S634-A638 PolarHBondContact O-N 3.23Å
635	W	89.2	Confident	89.2	Confident	164 Å²	164	54 Å²	54	62%	0.621	27%	0.271	S	S	*	.	H	α-helix	trans	-58.4	-34.7	179.7	72.5	-87.7	0	0	0	114	F631 I639	F631-W635 HydrophobicContact CD1-CB 3.8Å; F631-W635 HydrophobicContact CE1-CB 4.39Å; F631-W635 PolarHBondContact O-N 3.08Å; W635-I639 HydrophobicContact CE3-CD1 3.76Å; W635-I639 HydrophobicContact CZ3-CD1 4.05Å; W635-I639 WeakPolarHBondContact O-CG1 3.37Å; W635-I639 PolarHBondContact O-N 2.88Å; W635-I639 VanDerWaalsContact O-N 3.1Å
636	Y	88.8	Confident	88.9	Confident	110 Å²	110	54 Å²	54	43%	0.431	28%	0.28	S	S	.	.	H	α-helix	trans	-77.9	-41.2	-177.2	60.9	-87.6	0	0	0	111.8	S634 A638 I640	S634-Y636 VanDerWaalsContact C-N 3.28Å; S634-Y636 PolarHBondContact O-N 3.12Å; S634-Y636 VanDerWaalsContact OG-CD1 3.31Å; S634-Y636 WeakPolarHBondContact OG-CD1 3.34Å; S634-Y636 WeakPolarHBondContact OG-CE1 3.42Å; S634-Y636 VanDerWaalsContact OG-CZ 3.26Å; Y636-A638 VanDerWaalsContact C-N 3.34Å; Y636-I640 WeakPolarHBondContact O-CG1 3.25Å; Y636-I640 PolarHBondContact O-N 2.99Å
637	Y	85.9	Confident	88.7	Confident	120 Å²	120	58.3 Å²	58.3	47%	0.471	31%	0.309	S	S	.	.	H	α-helix	trans	-64.7	-39.7	170	-67.9	-43.3	0	0	0	111.1	S634 I639 I640 A641	S634-Y637 PolarHBondContact O-N 2.56Å; S634-Y637 WeakPolarHBondContact OG-CD2 3.04Å; S634-Y637 PolarHBondContact OG-N 2.82Å; Y637-I639 PolarHBondContact O-N 3.48Å; Y637-I640 PolarHBondContact O-N 3.26Å; Y637-A641 WeakPolarHBondContact O-CB 3.5Å; Y637-A641 PolarHBondContact O-N 3.07Å
638	A	88.8	Confident	88.5	Confident	0 Å²	0	57.7 Å²	57.7	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-55.7	-48.8	176.1	0	0	0	0	0	112.5	M630 S634 Y636 A641 M642	M630-A638 HydrophobicContact CB-CB 4.48Å; M630-A638 HydrophobicContact CE-CB 4.2Å; M630-A638 HydrophobicContact CG-CB 3.7Å; M630-A638 HydrophobicContact SD-CB 4.32Å; S634-A638 VanDerWaalsContact O-CB 3.26Å; S634-A638 WeakPolarHBondContact O-CB 3.48Å; S634-A638 PolarHBondContact O-N 3.23Å; Y636-A638 VanDerWaalsContact C-N 3.34Å; A638-A641 PolarHBondContact O-N 3.5Å; A638-M642 WeakPolarHBondContact O-CB 3.5Å; A638-M642 VanDerWaalsContact O-CG 3.31Å; A638-M642 WeakPolarHBondContact O-CG 3.46Å; A638-M642 PolarHBondContact O-N 2.62Å
639	I	90.5	Very high	88.3	Confident	86 Å²	86	58 Å²	58	44%	0.441	30%	0.299	S	S	.	.	H	α-helix	trans	-64.2	-47.2	179.5	-69.8	170.6	0	0	0	111.5	F631 W635 Y637 A641 G643	F631-I639 HydrophobicContact CE1-CD1 4.3Å; F631-I639 HydrophobicContact CE1-CG1 4.02Å; F631-I639 HydrophobicContact CZ-CG1 4.16Å; W635-I639 HydrophobicContact CE3-CD1 3.76Å; W635-I639 HydrophobicContact CZ3-CD1 4.05Å; W635-I639 WeakPolarHBondContact O-CG1 3.37Å; W635-I639 PolarHBondContact O-N 2.88Å; W635-I639 VanDerWaalsContact O-N 3.1Å; Y637-I639 PolarHBondContact O-N 3.48Å; I639-A641 VanDerWaalsContact C-N 3.34Å; I639-A641 PolarHBondContact O-N 3.4Å; I639-G643 PolarHBondContact O-N 3.13Å
640	I	89.1	Confident	88.2	Confident	102 Å²	102	63.6 Å²	63.6	52%	0.523	32%	0.323	S	S	.	.	H	α-helix	trans	-60.3	-47.1	179.1	-68.2	167.2	0	0	0	110.2	Y636 Y637 G643 I644	Y636-I640 WeakPolarHBondContact O-CG1 3.25Å; Y636-I640 PolarHBondContact O-N 2.99Å; Y637-I640 PolarHBondContact O-N 3.26Å; I640-G643 PolarHBondContact O-N 3.47Å; I640-I644 HydrophobicContact CG2-CD1 3.9Å; I640-I644 WeakPolarHBondContact O-CG1 3.42Å; I640-I644 PolarHBondContact O-N 3.44Å
641	A	85.6	Confident	88.2	Confident	17 Å²	17	67.8 Å²	67.8	14%	0.14	34%	0.339	C	S	.	.	H	α-helix	trans	-68.4	-41.3	-175.6	0	0	0	0	0	111.7	M587 Y637 A638 I639 G643 I644 A645	M587-A641 HydrophobicContact CE-CB 3.26Å; M587-A641 VanDerWaalsContact CE-O 3.28Å; M587-A641 WeakPolarHBondContact CE-O 3.39Å; Y637-A641 WeakPolarHBondContact O-CB 3.5Å; Y637-A641 PolarHBondContact O-N 3.07Å; A638-A641 PolarHBondContact O-N 3.5Å; I639-A641 VanDerWaalsContact C-N 3.34Å; I639-A641 PolarHBondContact O-N 3.4Å; A641-G643 VanDerWaalsContact C-N 3.34Å; A641-G643 PolarHBondContact O-N 3.45Å; A641-I644 PolarHBondContact O-N 3.48Å; A641-A645 PolarHBondContact O-N 2.87Å
642	M	87.8	Confident	88.1	Confident	50 Å²	50	64.3 Å²	64.3	25%	0.246	32%	0.324	C	S	.	.	H	α-helix	trans	-62.1	-39.1	170.8	-74.6	-171.1	-64.9	0	0	112.5	M630 F631 A638 A645 G646	M630-M642 HydrophobicContact CE-CE 4.16Å; M630-M642 HydrophobicContact CE-CG 3.68Å; M630-M642 HydrophobicContact CE-SD 3.56Å; M630-M642 VanDerWaalsContact CE-SD 3.56Å; F631-M642 HydrophobicContact CE2-CE 3.57Å; F631-M642 HydrophobicContact CZ-CE 3.57Å; A638-M642 WeakPolarHBondContact O-CB 3.5Å; A638-M642 VanDerWaalsContact O-CG 3.31Å; A638-M642 WeakPolarHBondContact O-CG 3.46Å; A638-M642 PolarHBondContact O-N 2.62Å; M642-A645 PolarHBondContact O-N 3.47Å; M642-G646 PolarHBondContact O-N 3.43Å
643	G	89.1	Confident	88	Confident	40 Å²	40	62.7 Å²	62.7	41%	0.412	32%	0.315	S	S	.	.	H	α-helix	trans	-60.9	-47.1	175.9	0	0	0	0	0	112.3	I639 I640 A641 G646 C647	I639-G643 PolarHBondContact O-N 3.13Å; I640-G643 PolarHBondContact O-N 3.47Å; A641-G643 VanDerWaalsContact C-N 3.34Å; A641-G643 PolarHBondContact O-N 3.45Å; G643-G646 PolarHBondContact O-N 3Å; G643-C647 PolarHBondContact O-N 3.34Å; G643-C647 PolarHBondContact O-SG 3.14Å
644	I	86.9	Confident	88.4	Confident	98 Å²	98	65.6 Å²	65.6	50%	0.503	32%	0.322	S	S	.	.	H	α-helix	trans	-60	-48.2	175.7	-68	166.2	0	0	0	110.7	I640 A641 G646 C647 I648	I640-I644 HydrophobicContact CG2-CD1 3.9Å; I640-I644 WeakPolarHBondContact O-CG1 3.42Å; I640-I644 PolarHBondContact O-N 3.44Å; A641-I644 PolarHBondContact O-N 3.48Å; I644-G646 PolarHBondContact O-N 3.44Å; I644-C647 WeakPolarHBondContact O-CB 3.47Å; I644-C647 PolarHBondContact O-N 2.99Å; I644-I648 HydrophobicContact CG2-CD1 3.91Å; I644-I648 WeakPolarHBondContact O-CG1 3.49Å; I644-I648 PolarHBondContact O-N 3.32Å
645	A	85.9	Confident	88.5	Confident	1 Å²	1	68.9 Å²	68.9	1%	0.008	33%	0.333	C	S	.	.	H	α-helix	trans	-67.9	-35	-178.8	0	0	0	0	0	113.5	M587 F591 A641 M642 C647 I648 Y649	M587-A645 HydrophobicContact CE-CB 4.4Å; M587-A645 HydrophobicContact SD-CB 3.43Å; M587-A645 WeakPolarHBondContact SD-CB 3.48Å; F591-A645 HydrophobicContact CE2-CB 3.57Å; F591-A645 HydrophobicContact CZ-CB 3.67Å; A641-A645 PolarHBondContact O-N 2.87Å; M642-A645 PolarHBondContact O-N 3.47Å; A645-C647 VanDerWaalsContact C-N 3.32Å; A645-I648 PolarHBondContact O-N 2.88Å; A645-Y649 WeakPolarHBondContact O-CB 3.33Å; A645-Y649 PolarHBondContact O-N 3.23Å
646	G	88.3	Confident	88.3	Confident	35 Å²	35	62.6 Å²	62.6	36%	0.361	32%	0.319	S	S	.	.	H	α-helix	trans	-62.5	-38.5	170.8	0	0	0	0	0	112.6	M642 G643 I644 K650	M642-G646 PolarHBondContact O-N 3.43Å; G643-G646 PolarHBondContact O-N 3Å; I644-G646 PolarHBondContact O-N 3.44Å; G646-K650 PolarHBondContact O-N 2.98Å
647	C	90.3	Very high	88.2	Confident	90 Å²	90	57.4 Å²	57.4	61%	0.608	30%	0.299	S	S	*	.	H	α-helix	trans	-65.9	-42.7	173	-64.9	0	0	0	0	112	G643 I644 A645 K650 Y651	G643-C647 PolarHBondContact O-N 3.34Å; G643-C647 PolarHBondContact O-SG 3.14Å; I644-C647 WeakPolarHBondContact O-CB 3.47Å; I644-C647 PolarHBondContact O-N 2.99Å; A645-C647 VanDerWaalsContact C-N 3.32Å; C647-K650 PolarHBondContact O-N 3.42Å; C647-Y651 VanDerWaalsContact O-CB 3.26Å; C647-Y651 WeakPolarHBondContact O-CB 3.48Å; C647-Y651 PolarHBondContact O-N 2.67Å
648	I	88.6	Confident	88.3	Confident	47 Å²	47	54.4 Å²	54.4	24%	0.241	29%	0.289	C	S	.	.	H	α-helix	trans	-60.7	-48.7	175.6	-70.1	168.6	0	0	0	110.7	A200 L203 I644 A645 K650 Y651 I652	A200-I648 HydrophobicContact CB-CG2 4.39Å; L203-I648 HydrophobicContact CD1-CG2 3.8Å; I644-I648 HydrophobicContact CG2-CD1 3.91Å; I644-I648 WeakPolarHBondContact O-CG1 3.49Å; I644-I648 PolarHBondContact O-N 3.32Å; A645-I648 PolarHBondContact O-N 2.88Å; I648-K650 PolarHBondContact O-N 3.39Å; I648-Y651 PolarHBondContact O-N 2.68Å; I648-I652 HydrophobicContact CG2-CD1 3.78Å; I648-I652 WeakPolarHBondContact O-CG1 3.41Å; I648-I652 PolarHBondContact O-N 2.9Å
649	Y	89.5	Confident	88.1	Confident	58 Å²	58	62.6 Å²	62.6	23%	0.227	33%	0.325	C	S	.	.	H	α-helix	trans	-56.8	-50.8	177.6	179.1	-90.4	0	0	0	111.5	E196 F197 A645 Y651 I652 E653	E196-Y649 HydrophobicContact CB-CD2 3.95Å; E196-Y649 HydrophobicContact CB-CE2 3.54Å; F197-Y649 HydrophobicContact CD1-CD2 4.48Å; F197-Y649 AromaticContact CD1-CE2 3.97Å; F197-Y649 HydrophobicContact CD1-CE2 3.97Å; F197-Y649 HydrophobicContact CD2-CE2 4.12Å; F197-Y649 AromaticContact CE1-CE2 3.85Å; F197-Y649 HydrophobicContact CE1-CE2 3.85Å; F197-Y649 HydrophobicContact CE2-CE2 4.01Å; F197-Y649 HydrophobicContact CG-CE2 4.1Å; F197-Y649 AromaticContact CZ-CE2 3.87Å; F197-Y649 HydrophobicContact CZ-CE2 3.87Å; A645-Y649 WeakPolarHBondContact O-CB 3.33Å; A645-Y649 PolarHBondContact O-N 3.23Å; Y649-Y651 VanDerWaalsContact C-N 3.34Å; Y649-Y651 PolarHBondContact O-N 3.32Å; Y649-I652 PolarHBondContact O-N 2.65Å; Y649-E653 WeakPolarHBondContact CE1-OE2 3.23Å; Y649-E653 WeakPolarHBondContact O-CB 3.49Å; Y649-E653 PolarHBondContact O-N 2.72Å
650	K	89.6	Confident	87.8	Confident	121 Å²	121	63.4 Å²	63.4	53%	0.526	33%	0.327	S	S	.	.	H	α-helix	trans	-66.9	-31.8	179.3	-79.5	-72	168.4	-162.1	0	113.5	G646 C647 I648 E653 Y654	G646-K650 PolarHBondContact O-N 2.98Å; C647-K650 PolarHBondContact O-N 3.42Å; I648-K650 PolarHBondContact O-N 3.39Å; K650-E653 VanDerWaalsContact CD-OE2 3.32Å; K650-E653 WeakPolarHBondContact CD-OE2 3.37Å; K650-E653 VanDerWaalsContact CE-OE2 3.25Å; K650-E653 WeakPolarHBondContact CE-OE2 3.45Å; K650-E653 VanDerWaalsContact NZ-CD 3.26Å; K650-E653 IonicContact NZ-OE1 3.26Å; K650-E653 PolarHBondContact NZ-OE1 2.82Å; K650-E653 IonicContact NZ-OE2 2.58Å; K650-E653 PolarHBondContact NZ-OE2 3.32Å; K650-Y654 WeakPolarHBondContact O-CB 3.43Å; K650-Y654 PolarHBondContact O-N 3.15Å
651	Y	90.6	Very high	87.7	Confident	89 Å²	89	63.6 Å²	63.6	35%	0.349	32%	0.321	S	S	.	.	H	α-helix	trans	-65.7	-44.4	173.3	176.8	-95.6	0	0	0	111.7	V539 F541 C647 I648 Y649 Y654 R655	V539-Y651 HydrophobicContact CG1-CE1 4.27Å; F541-Y651 HydrophobicContact CE1-CE1 4.25Å; C647-Y651 VanDerWaalsContact O-CB 3.26Å; C647-Y651 WeakPolarHBondContact O-CB 3.48Å; C647-Y651 PolarHBondContact O-N 2.67Å; I648-Y651 PolarHBondContact O-N 2.68Å; Y649-Y651 VanDerWaalsContact C-N 3.34Å; Y649-Y651 PolarHBondContact O-N 3.32Å; Y651-Y654 PolarHBondContact O-N 3.3Å; Y651-R655 HydrophobicContact CD1-CG 4.39Å; Y651-R655 HydrophobicContact CD2-CG 4.46Å; Y651-R655 HydrophobicContact CE1-CG 3.95Å; Y651-R655 HydrophobicContact CE2-CG 4.04Å; Y651-R655 WeakPolarHBondContact O-CG 3.17Å; Y651-R655 PolarHBondContact O-N 3.3Å
652	I	89.6	Confident	87.7	Confident	4 Å²	4	66 Å²	66	2%	0.021	35%	0.347	C	S	.	.	H	α-helix	trans	-65.4	-44.7	177.3	-63.3	162.4	0	0	0	110.5	E196 I538 V539 I648 Y649 Y654 R655 G656	E196-I652 HydrophobicContact CB-CG2 4.49Å; E196-I652 HydrophobicContact CG-CG2 4.5Å; I538-I652 HydrophobicContact CB-CG2 4.32Å; I538-I652 HydrophobicContact CD1-CD1 4.49Å; V539-I652 HydrophobicContact CG2-CD1 4.43Å; V539-I652 HydrophobicContact CG2-CG1 4.1Å; I648-I652 HydrophobicContact CG2-CD1 3.78Å; I648-I652 WeakPolarHBondContact O-CG1 3.41Å; I648-I652 PolarHBondContact O-N 2.9Å; Y649-I652 PolarHBondContact O-N 2.65Å; I652-Y654 VanDerWaalsContact C-N 3.33Å; I652-Y654 PolarHBondContact O-N 3.38Å; I652-R655 PolarHBondContact O-N 2.87Å; I652-G656 PolarHBondContact O-N 3.49Å
653	E	87.9	Confident	87.8	Confident	47 Å²	47	67.1 Å²	67.1	22%	0.22	36%	0.355	C	S	.	.	H	α-helix	trans	-57.4	-44.7	176.3	-163.6	-168.3	147.5	0	0	111.6	E196 Y649 K650 A657 L668	E196-E653 HydrophobicContact CG-CB 4.14Å; E196-E653 HydrophobicContact CG-CG 4.35Å; Y649-E653 WeakPolarHBondContact CE1-OE2 3.23Å; Y649-E653 WeakPolarHBondContact O-CB 3.49Å; Y649-E653 PolarHBondContact O-N 2.72Å; K650-E653 VanDerWaalsContact CD-OE2 3.32Å; K650-E653 WeakPolarHBondContact CD-OE2 3.37Å; K650-E653 VanDerWaalsContact CE-OE2 3.25Å; K650-E653 WeakPolarHBondContact CE-OE2 3.45Å; K650-E653 VanDerWaalsContact NZ-CD 3.26Å; K650-E653 IonicContact NZ-OE1 3.26Å; K650-E653 PolarHBondContact NZ-OE1 2.82Å; K650-E653 IonicContact NZ-OE2 2.58Å; K650-E653 PolarHBondContact NZ-OE2 3.32Å; E653-A657 WeakPolarHBondContact O-CB 3.44Å; E653-A657 PolarHBondContact O-N 3.41Å; E653-L668 HydrophobicContact CB-CD2 4.43Å; E653-L668 HydrophobicContact CG-CD2 3.64Å
654	Y	89.3	Confident	87.7	Confident	87 Å²	87	65.3 Å²	65.3	34%	0.341	34%	0.335	S	S	.	.	H	α-helix	trans	-63.8	-46.8	176.5	176	-91.7	0	0	0	112.7	K650 Y651 I652 A657 E658 I665 L668	K650-Y654 WeakPolarHBondContact O-CB 3.43Å; K650-Y654 PolarHBondContact O-N 3.15Å; Y651-Y654 PolarHBondContact O-N 3.3Å; I652-Y654 VanDerWaalsContact C-N 3.33Å; I652-Y654 PolarHBondContact O-N 3.38Å; Y654-A657 PolarHBondContact O-N 3.41Å; Y654-E658 VanDerWaalsContact CE1-OE2 3.27Å; Y654-E658 WeakPolarHBondContact CE1-OE2 3.44Å; Y654-E658 WeakPolarHBondContact O-CB 3.32Å; Y654-E658 PolarHBondContact O-N 2.92Å; Y654-I665 HydrophobicContact CE2-CG1 3.99Å; Y654-L668 HydrophobicContact CD2-CD1 4.33Å
655	R	86.9	Confident	87.7	Confident	80 Å²	80	66.7 Å²	66.7	30%	0.302	34%	0.343	S	S	.	.	H	α-helix	trans	-70.8	-31.3	179.6	-65.7	-63.7	-71.1	177	-0.8	112.4	Y651 I652 E658 K659	Y651-R655 HydrophobicContact CD1-CG 4.39Å; Y651-R655 HydrophobicContact CD2-CG 4.46Å; Y651-R655 HydrophobicContact CE1-CG 3.95Å; Y651-R655 HydrophobicContact CE2-CG 4.04Å; Y651-R655 WeakPolarHBondContact O-CG 3.17Å; Y651-R655 PolarHBondContact O-N 3.3Å; I652-R655 PolarHBondContact O-N 2.87Å; R655-E658 WeakPolarHBondContact CD-OE2 3.4Å; R655-E658 IonicContact CZ-OE1 3.32Å; R655-E658 IonicContact CZ-OE2 2.68Å; R655-E658 IonicContact NE-OE2 3.03Å; R655-E658 IonicContact NH1-OE1 3.45Å; R655-E658 PolarHBondContact NH1-OE1 2.94Å; R655-E658 IonicContact NH1-OE2 3.83Å; R655-E658 PolarHBondContact NH1-OE2 3.28Å; R655-E658 IonicContact NH2-OE1 2.86Å; R655-E658 PolarHBondContact O-N 3.04Å; R655-K659 WeakPolarHBondContact O-CB 3.39Å; R655-K659 PolarHBondContact O-N 3.07Å
656	G	85.5	Confident	87.9	Confident	32 Å²	32	74.6 Å²	74.6	33%	0.33	37%	0.372	S	S	.	.	H	α-helix	trans	-61.7	-49.7	170	0	0	0	0	0	111.4	I652 E658 K659 E660	I652-G656 PolarHBondContact O-N 3.49Å; G656-E658 PolarHBondContact O-N 3.46Å; G656-K659 PolarHBondContact O-N 3.43Å; G656-E660 WeakPolarHBondContact O-CB 3.44Å; G656-E660 PolarHBondContact O-N 3.33Å
657	A	86.1	Confident	87.9	Confident	1 Å²	1	73 Å²	73	1%	0.008	36%	0.355	C	S	.	.	H	α-helix	trans	-60.5	-41.5	174.9	0	0	0	0	0	113.2	E653 Y654 E660 W661 L668	E653-A657 WeakPolarHBondContact O-CB 3.44Å; E653-A657 PolarHBondContact O-N 3.41Å; Y654-A657 PolarHBondContact O-N 3.41Å; A657-E660 PolarHBondContact O-N 3.03Å; A657-W661 WeakPolarHBondContact O-CB 3.48Å; A657-W661 PolarHBondContact O-N 3.38Å; A657-L668 HydrophobicContact CB-CD2 3.94Å; A657-L668 HydrophobicContact CB-CG 3.85Å
658	E	87.9	Confident	87.7	Confident	57 Å²	57	71.2 Å²	71.2	27%	0.266	34%	0.34	S	S	.	.	H	α-helix	trans	-63.5	-40.2	175.9	-169.5	-172.8	146.2	0	0	111.9	Y654 R655 G656 G662	Y654-E658 VanDerWaalsContact CE1-OE2 3.27Å; Y654-E658 WeakPolarHBondContact CE1-OE2 3.44Å; Y654-E658 WeakPolarHBondContact O-CB 3.32Å; Y654-E658 PolarHBondContact O-N 2.92Å; R655-E658 WeakPolarHBondContact CD-OE2 3.4Å; R655-E658 IonicContact CZ-OE1 3.32Å; R655-E658 IonicContact CZ-OE2 2.68Å; R655-E658 IonicContact NE-OE2 3.03Å; R655-E658 IonicContact NH1-OE1 3.45Å; R655-E658 PolarHBondContact NH1-OE1 2.94Å; R655-E658 IonicContact NH1-OE2 3.83Å; R655-E658 PolarHBondContact NH1-OE2 3.28Å; R655-E658 IonicContact NH2-OE1 2.86Å; R655-E658 PolarHBondContact O-N 3.04Å; G656-E658 PolarHBondContact O-N 3.46Å; E658-G662 CarbonylContact O-C 3.55Å; E658-G662 WeakPolarHBondContact O-CA 3.45Å; E658-G662 PolarHBondContact O-N 3.23Å
659	K	85	Confident	87.7	Confident	173 Å²	173	72.4 Å²	72.4	75%	0.752	35%	0.352	S	S	*	.	H	α-helix	trans	-70.2	-37	177.6	-174.6	179.9	178	-176.7	0	112.9	R655 G656	R655-K659 WeakPolarHBondContact O-CB 3.39Å; R655-K659 PolarHBondContact O-N 3.07Å; G656-K659 PolarHBondContact O-N 3.43Å
660	E	84.3	Confident	87.7	Confident	103 Å²	103	72.6 Å²	72.6	48%	0.481	36%	0.356	S	S	.	.	H	α-helix	trans	-81.9	-34.3	-177.5	-170.3	175.5	-154.1	0	0	113	G656 A657 N671 R674	G656-E660 WeakPolarHBondContact O-CB 3.44Å; G656-E660 PolarHBondContact O-N 3.33Å; A657-E660 PolarHBondContact O-N 3.03Å; E660-N671 PolarHBondContact OE2-ND2 3.03Å; E660-N671 PolarHBondContact OE2-OD1 3.32Å; E660-N671 VanDerWaalsContact OE2-OD1 3.08Å; E660-R674 IonicContact OE1-CZ 3.19Å; E660-R674 IonicContact OE1-NH1 3.87Å; E660-R674 PolarHBondContact OE1-NH1 3.42Å; E660-R674 IonicContact OE2-NH1 2.8Å
661	W	86.8	Confident	87.5	Confident	105 Å²	105	68.9 Å²	68.9	40%	0.398	34%	0.343	S	S	.	.	H	α-helix	trans	-120.2	-1.6	-172.4	-58.6	93.4	0	0	0	115.1	A657 D663 L670 N671	A657-W661 WeakPolarHBondContact O-CB 3.48Å; A657-W661 PolarHBondContact O-N 3.38Å; W661-D663 PolarHBondContact O-N 2.98Å; W661-L670 HydrophobicContact CB-CD1 4.49Å; W661-L670 HydrophobicContact CD2-CB 3.93Å; W661-L670 HydrophobicContact CD2-CD1 3.9Å; W661-L670 HydrophobicContact CE3-CB 4.12Å; W661-L670 HydrophobicContact CE3-CD1 3.54Å; W661-L670 HydrophobicContact CE3-CG 4.42Å; W661-L670 HydrophobicContact CG-CB 4.47Å; W661-L670 HydrophobicContact CG-CD1 4.32Å; W661-L670 HydrophobicContact CH2-CB 4.25Å; W661-L670 HydrophobicContact CZ2-CB 4.08Å; W661-L670 HydrophobicContact CZ3-CB 4.27Å; W661-L670 HydrophobicContact CZ3-CD1 4.07Å; W661-N671 PolarHBondContact NE1-ND2 2.86Å; W661-N671 PolarHBondContact NE1-OD1 3.45Å
662	G	86.1	Confident	87.4	Confident	67 Å²	67	67.8 Å²	67.8	69%	0.691	35%	0.352	S	S	*	.	S	Bend	trans	79.1	-19.4	-179.5	0	0	0	0	0	115.6	E658	E658-G662 CarbonylContact O-C 3.55Å; E658-G662 WeakPolarHBondContact O-CA 3.45Å; E658-G662 PolarHBondContact O-N 3.23Å
663	D	90.1	Very high	87.3	Confident	75 Å²	75	70 Å²	70	40%	0.401	37%	0.37	S	S	.	.			trans	-132.8	123.9	175.1	168.8	3.5	0	0	0	108.7	W661 I665 R666 G667	W661-D663 PolarHBondContact O-N 2.98Å; D663-I665 PolarHBondContact OD1-N 3.44Å; D663-R666 HydrophobicContact CB-CB 4.18Å; D663-R666 PolarHBondContact OD1-N 3.28Å; D663-R666 WeakPolarHBondContact OD2-CB 3.4Å; D663-G667 VanDerWaalsContact O-CA 3.28Å; D663-G667 WeakPolarHBondContact O-CA 3.32Å; D663-G667 PolarHBondContact O-N 3.16Å
664	G	85.8	Confident	87.4	Confident	1 Å²	1	73.3 Å²	73.3	1%	0.01	38%	0.381	C	S	.	.	H	α-helix	trans	-64.5	-46.5	-177.3	0	0	0	0	0	113.9	G667 L668	G664-G667 PolarHBondContact O-N 3.03Å; G664-L668 VanDerWaalsContact O-CG 3.27Å; G664-L668 WeakPolarHBondContact O-CG 3.34Å; G664-L668 PolarHBondContact O-N 3.36Å
665	I	88.8	Confident	87.1	Confident	127 Å²	127	73 Å²	73	65%	0.651	38%	0.38	S	S	*	.	H	α-helix	trans	-71.1	-45.4	-174.9	-58.3	-176.8	0	0	0	110.2	Y654 D663	Y654-I665 HydrophobicContact CE2-CG1 3.99Å; D663-I665 PolarHBondContact OD1-N 3.44Å
666	R	88.9	Confident	87.1	Confident	168 Å²	168	71 Å²	71	63%	0.634	38%	0.38	S	S	*	.	H	α-helix	trans	-68	-39.6	176.5	-171.4	175.9	178.6	178.8	-2.6	111.4	D663 L668 S669 L670	D663-R666 HydrophobicContact CB-CB 4.18Å; D663-R666 PolarHBondContact OD1-N 3.28Å; D663-R666 WeakPolarHBondContact OD2-CB 3.4Å; R666-L668 VanDerWaalsContact C-N 3.34Å; R666-L668 PolarHBondContact O-N 3.04Å; R666-S669 PolarHBondContact O-N 3.12Å; R666-S669 VanDerWaalsContact O-N 3.11Å; R666-S669 PolarHBondContact O-OG 3.31Å; R666-L670 HydrophobicContact CG-CD1 4.1Å; R666-L670 HydrophobicContact CG-CG 4.46Å; R666-L670 WeakPolarHBondContact O-CG 3.43Å; R666-L670 PolarHBondContact O-N 3.37Å
667	G	87.7	Confident	87.2	Confident	0 Å²	0	71 Å²	71	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-58.1	-41.8	176.9	0	0	0	0	0	113	D663 G664 S669 L670 N671	D663-G667 VanDerWaalsContact O-CA 3.28Å; D663-G667 WeakPolarHBondContact O-CA 3.32Å; D663-G667 PolarHBondContact O-N 3.16Å; G664-G667 PolarHBondContact O-N 3.03Å; G667-S669 VanDerWaalsContact C-N 3.31Å; G667-S669 PolarHBondContact O-N 2.97Å; G667-L670 PolarHBondContact O-N 3.32Å; G667-L670 VanDerWaalsContact O-N 3.16Å; G667-N671 PolarHBondContact O-N 3.13Å
668	L	86.9	Confident	87.2	Confident	54 Å²	54	74.4 Å²	74.4	28%	0.283	39%	0.39	S	S	.	.	H	α-helix	trans	-57.5	-43.6	174.1	-72.4	169.6	0	0	0	111.8	E653 Y654 A657 G664 R666 A672	E653-L668 HydrophobicContact CB-CD2 4.43Å; E653-L668 HydrophobicContact CG-CD2 3.64Å; Y654-L668 HydrophobicContact CD2-CD1 4.33Å; A657-L668 HydrophobicContact CB-CD2 3.94Å; A657-L668 HydrophobicContact CB-CG 3.85Å; G664-L668 VanDerWaalsContact O-CG 3.27Å; G664-L668 WeakPolarHBondContact O-CG 3.34Å; G664-L668 PolarHBondContact O-N 3.36Å; R666-L668 VanDerWaalsContact C-N 3.34Å; R666-L668 PolarHBondContact O-N 3.04Å; L668-A672 WeakPolarHBondContact O-CB 3.32Å; L668-A672 PolarHBondContact O-N 2.89Å
669	S	88.8	Confident	86.9	Confident	71 Å²	71	76.7 Å²	76.7	50%	0.497	40%	0.396	S	S	.	.	H	α-helix	trans	-67.8	-35.3	177.5	76	0	0	0	0	113.1	R666 G667 A673	R666-S669 PolarHBondContact O-N 3.12Å; R666-S669 VanDerWaalsContact O-N 3.11Å; R666-S669 PolarHBondContact O-OG 3.31Å; G667-S669 VanDerWaalsContact C-N 3.31Å; G667-S669 PolarHBondContact O-N 2.97Å; S669-A673 WeakPolarHBondContact O-CB 3.32Å; S669-A673 PolarHBondContact O-N 3.28Å
670	L	89.9	Confident	86.8	Confident	62 Å²	62	72.8 Å²	72.8	33%	0.325	38%	0.383	S	S	.	.	H	α-helix	trans	-71.4	-41.3	177.4	-69.4	171	0	0	0	111.6	W661 R666 G667 A673 R674	W661-L670 HydrophobicContact CB-CD1 4.49Å; W661-L670 HydrophobicContact CD2-CB 3.93Å; W661-L670 HydrophobicContact CD2-CD1 3.9Å; W661-L670 HydrophobicContact CE3-CB 4.12Å; W661-L670 HydrophobicContact CE3-CD1 3.54Å; W661-L670 HydrophobicContact CE3-CG 4.42Å; W661-L670 HydrophobicContact CG-CB 4.47Å; W661-L670 HydrophobicContact CG-CD1 4.32Å; W661-L670 HydrophobicContact CH2-CB 4.25Å; W661-L670 HydrophobicContact CZ2-CB 4.08Å; W661-L670 HydrophobicContact CZ3-CB 4.27Å; W661-L670 HydrophobicContact CZ3-CD1 4.07Å; R666-L670 HydrophobicContact CG-CD1 4.1Å; R666-L670 HydrophobicContact CG-CG 4.46Å; R666-L670 WeakPolarHBondContact O-CG 3.43Å; R666-L670 PolarHBondContact O-N 3.37Å; G667-L670 PolarHBondContact O-N 3.32Å; G667-L670 VanDerWaalsContact O-N 3.16Å; L670-A673 PolarHBondContact O-N 3.43Å; L670-R674 WeakPolarHBondContact O-CB 3.35Å; L670-R674 PolarHBondContact O-N 3.39Å
671	N	85.1	Confident	86.7	Confident	44 Å²	44	74.4 Å²	74.4	24%	0.235	39%	0.391	C	S	.	.	H	α-helix	trans	-65.2	-42.5	174.7	-89.8	-14.9	0	0	0	112.4	E660 W661 G667 A673 R674 Y675	E660-N671 PolarHBondContact OE2-ND2 3.03Å; E660-N671 PolarHBondContact OE2-OD1 3.32Å; E660-N671 VanDerWaalsContact OE2-OD1 3.08Å; W661-N671 PolarHBondContact NE1-ND2 2.86Å; W661-N671 PolarHBondContact NE1-OD1 3.45Å; G667-N671 PolarHBondContact O-N 3.13Å; N671-A673 VanDerWaalsContact C-N 3.31Å; N671-A673 PolarHBondContact O-N 3.32Å; N671-R674 PolarHBondContact O-N 3.26Å; N671-Y675 VanDerWaalsContact O-CB 3.26Å; N671-Y675 WeakPolarHBondContact O-CB 3.45Å; N671-Y675 PolarHBondContact O-N 3.39Å
672	A	87.3	Confident	86	Confident	65 Å²	65	73.9 Å²	73.9	54%	0.537	39%	0.393	S	S	.	.	H	α-helix	trans	-59.1	-42.1	172.9	0	0	0	0	0	112.1	L668 A676	L668-A672 WeakPolarHBondContact O-CB 3.32Å; L668-A672 PolarHBondContact O-N 2.89Å; A672-A676 WeakPolarHBondContact O-CB 3.25Å; A672-A676 PolarHBondContact O-N 3.16Å; A672-A676 VanDerWaalsContact O-N 3.12Å
673	A	89.4	Confident	85	Confident	50 Å²	50	72.8 Å²	72.8	41%	0.413	38%	0.377	S	S	.	.	H	α-helix	trans	-66.4	-49.7	177	0	0	0	0	0	112.5	S669 L670 N671 Y675 A676 L677	S669-A673 WeakPolarHBondContact O-CB 3.32Å; S669-A673 PolarHBondContact O-N 3.28Å; L670-A673 PolarHBondContact O-N 3.43Å; N671-A673 VanDerWaalsContact C-N 3.31Å; N671-A673 PolarHBondContact O-N 3.32Å; A673-Y675 PolarHBondContact O-N 3.05Å; A673-A676 PolarHBondContact O-N 3.48Å; A673-L677 VanDerWaalsContact O-CG 3.3Å; A673-L677 WeakPolarHBondContact O-CG 3.4Å; A673-L677 PolarHBondContact O-N 3.05Å
674	R	88.4	Confident	83.7	Confident	117 Å²	117	74.1 Å²	74.1	44%	0.442	39%	0.389	S	S	.	.	H	α-helix	trans	-55.6	-49.2	176.3	170.6	-176.1	162.5	-159.8	2.3	111.6	E660 L670 N671 A676 L677 I678	E660-R674 IonicContact OE1-CZ 3.19Å; E660-R674 IonicContact OE1-NH1 3.87Å; E660-R674 PolarHBondContact OE1-NH1 3.42Å; E660-R674 IonicContact OE2-NH1 2.8Å; L670-R674 WeakPolarHBondContact O-CB 3.35Å; L670-R674 PolarHBondContact O-N 3.39Å; N671-R674 PolarHBondContact O-N 3.26Å; R674-A676 VanDerWaalsContact C-N 3.33Å; R674-A676 PolarHBondContact O-N 2.91Å; R674-L677 PolarHBondContact O-N 3Å; R674-I678 HydrophobicContact CG-CD1 3.88Å; R674-I678 WeakPolarHBondContact O-CG1 3.49Å; R674-I678 PolarHBondContact O-N 3.5Å
675	Y	83.4	Confident	82.6	Confident	81 Å²	81	79.4 Å²	79.4	32%	0.318	42%	0.424	S	S	.	.	H	α-helix	trans	-62.2	-41.6	-179.2	-178.8	-90.2	0	0	0	111.8	T604 N671 A673 L677 R679	T604-Y675 VanDerWaalsContact CA-OH 3.29Å; T604-Y675 WeakPolarHBondContact CA-OH 3.43Å; T604-Y675 HydrophobicContact CG2-CE2 4.27Å; T604-Y675 WeakPolarHBondContact CG2-OH 3.48Å; N671-Y675 VanDerWaalsContact O-CB 3.26Å; N671-Y675 WeakPolarHBondContact O-CB 3.45Å; N671-Y675 PolarHBondContact O-N 3.39Å; A673-Y675 PolarHBondContact O-N 3.05Å; Y675-L677 VanDerWaalsContact C-N 3.35Å; Y675-L677 PolarHBondContact O-N 3.38Å; Y675-R679 PolarHBondContact O-N 3.02Å
676	A	86.4	Confident	81.1	Confident	38 Å²	38	81.3 Å²	81.3	31%	0.314	43%	0.429	S	S	.	.	H	α-helix	trans	-63.9	-37.3	175	0	0	0	0	0	112.9	A672 A673 R674 L680	A672-A676 WeakPolarHBondContact O-CB 3.25Å; A672-A676 PolarHBondContact O-N 3.16Å; A672-A676 VanDerWaalsContact O-N 3.12Å; A673-A676 PolarHBondContact O-N 3.48Å; R674-A676 VanDerWaalsContact C-N 3.33Å; R674-A676 PolarHBondContact O-N 2.91Å; A676-L680 WeakPolarHBondContact O-CG 3.48Å; A676-L680 PolarHBondContact O-N 3.34Å
677	L	88.1	Confident	79.9	Confident	32 Å²	32	75.8 Å²	75.8	17%	0.168	41%	0.414	C	S	.	.	H	α-helix	trans	-69.5	-46.1	179.5	-72.6	168.5	0	0	0	112.9	A673 R674 Y675 R679 L680 E681 L783 M786	A673-L677 VanDerWaalsContact O-CG 3.3Å; A673-L677 WeakPolarHBondContact O-CG 3.4Å; A673-L677 PolarHBondContact O-N 3.05Å; R674-L677 PolarHBondContact O-N 3Å; Y675-L677 VanDerWaalsContact C-N 3.35Å; Y675-L677 PolarHBondContact O-N 3.38Å; L677-R679 VanDerWaalsContact C-N 3.29Å; L677-R679 PolarHBondContact O-N 3.38Å; L677-L680 WeakPolarHBondContact O-CB 3.31Å; L677-L680 PolarHBondContact O-N 3.2Å; L677-E681 PolarHBondContact O-N 2.93Å; L677-L783 HydrophobicContact CD1-CD2 3.69Å; L677-L783 HydrophobicContact CD1-CG 4.14Å; L677-M786 HydrophobicContact CD2-CB 3.46Å; L677-M786 VanDerWaalsContact CD2-CB 3.46Å; L677-M786 HydrophobicContact CD2-CG 4.38Å; L677-M786 HydrophobicContact CD2-SD 4.11Å
678	I	85.4	Confident	78.8	Confident	73 Å²	73	78.4 Å²	78.4	37%	0.374	43%	0.426	S	S	.	.	H	α-helix	trans	-60	-42.7	177.6	-65.8	167.7	0	0	0	110.3	P605 R674 L680 E681 E682	P605-I678 HydrophobicContact CG-CG2 3.96Å; R674-I678 HydrophobicContact CG-CD1 3.88Å; R674-I678 WeakPolarHBondContact O-CG1 3.49Å; R674-I678 PolarHBondContact O-N 3.5Å; I678-L680 VanDerWaalsContact C-N 3.25Å; I678-L680 PolarHBondContact O-N 3Å; I678-E681 WeakPolarHBondContact O-CB 3.45Å; I678-E681 PolarHBondContact O-N 3.32Å; I678-E682 PolarHBondContact O-N 3.16Å
679	R	81.8	Confident	78.3	Confident	105 Å²	105	78.5 Å²	78.5	40%	0.396	43%	0.427	S	S	.	.	H	α-helix	trans	-64.8	-26.5	177	-166.3	-174	65.3	176.1	-2.5	113.4	Y675 L677 E681	Y675-R679 PolarHBondContact O-N 3.02Å; L677-R679 VanDerWaalsContact C-N 3.29Å; L677-R679 PolarHBondContact O-N 3.38Å; R679-E681 VanDerWaalsContact C-N 3.27Å
680	L	82.7	Confident	78.1	Confident	90 Å²	90	76.4 Å²	76.4	47%	0.471	41%	0.408	S	S	.	.	H	α-helix	trans	-76.2	-13.3	174.3	-75.5	168.5	0	0	0	113.2	A676 L677 I678	A676-L680 WeakPolarHBondContact O-CG 3.48Å; A676-L680 PolarHBondContact O-N 3.34Å; L677-L680 WeakPolarHBondContact O-CB 3.31Å; L677-L680 PolarHBondContact O-N 3.2Å; I678-L680 VanDerWaalsContact C-N 3.25Å; I678-L680 PolarHBondContact O-N 3Å
681	E	82.3	Confident	78	Confident	138 Å²	138	76.3 Å²	76.3	65%	0.645	40%	0.403	S	S	*	.	H	α-helix	trans	-92.1	-34.2	179.9	-169.6	163.3	-164.2	0	0	112.4	L677 I678 R679 A683	L677-E681 PolarHBondContact O-N 2.93Å; I678-E681 WeakPolarHBondContact O-CB 3.45Å; I678-E681 PolarHBondContact O-N 3.32Å; R679-E681 VanDerWaalsContact C-N 3.27Å; E681-A683 VanDerWaalsContact C-N 3.32Å; E681-A683 PolarHBondContact O-N 3.49Å
682	E	73.3	Confident	78.4	Confident	94 Å²	94	74.3 Å²	74.3	44%	0.439	39%	0.393	S	S	.	.	H	α-helix	trans	-69.5	-26.1	174.8	-67.8	-168.8	128.9	0	0	113.7	R608 I678	R608-E682 IonicContact NH2-OE1 3.15Å; R608-E682 PolarHBondContact NH2-OE1 3.09Å; I678-E682 PolarHBondContact O-N 3.16Å
683	A	64.8	Low	78.6	Confident	44 Å²	44	73.5 Å²	73.5	36%	0.364	38%	0.378	S	S	.	.	S	Bend	trans	-90.8	128.4	-179.4	0	0	0	0	0	111	E681	E681-A683 VanDerWaalsContact C-N 3.32Å; E681-A683 PolarHBondContact O-N 3.49Å
684	P	62.2	Low	78.9	Confident	102 Å²	102	71.1 Å²	71.1	66%	0.662	36%	0.358	S	S	*	.	P	Polyproline II helix	trans	-61.4	131.7	173.8	26.2	-33.4	0	0	0	109.2	H686	P684-H686 PolarHBondContact O-N 2.92Å; P684-H686 VanDerWaalsContact O-N 3.14Å
685	P	62	Low	79.3	Confident	113 Å²	113	65.6 Å²	65.6	73%	0.734	34%	0.337	S	S	*	.	P	Polyproline II helix	trans	-59.6	122.2	-175.9	23.4	-33.5	0	0	0	109.8	T687	P685-T687 PolarHBondContact O-N 2.9Å
686	H	59	Low	80	Confident	166 Å²	166	61.7 Å²	61.7	77%	0.769	32%	0.322	S	S	*	.			trans	-65.8	92.5	-175.1	-66	-44.9	0	0	0	111.8	P684 K688	P684-H686 PolarHBondContact O-N 2.92Å; P684-H686 VanDerWaalsContact O-N 3.14Å; H686-K688 VanDerWaalsContact C-N 3.28Å; H686-K688 PolarHBondContact O-N 3.42Å
687	T	61.9	Low	80.4	Confident	52 Å²	52	60.7 Å²	60.7	32%	0.319	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-27	178.7	45.8	0	0	0	0	113.7	P685 N689 M935 M939 V1121	P685-T687 PolarHBondContact O-N 2.9Å; T687-N689 PolarHBondContact O-N 3.31Å; T687-N689 VanDerWaalsContact O-N 3.07Å; T687-M935 HydrophobicContact CG2-CE 4.21Å; T687-M939 HydrophobicContact CG2-SD 4.37Å; T687-M939 PolarHBondContact OG1-SD 3.37Å; T687-V1121 VanDerWaalsContact O-O 3.09Å
688	K	64.8	Low	80.6	Confident	55 Å²	55	59.4 Å²	59.4	24%	0.239	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-16	-175.1	-64.7	-165.2	171.1	-168.3	0	115.1	H686 M939 H940 L941 E945 V1121 T1123	H686-K688 VanDerWaalsContact C-N 3.28Å; H686-K688 PolarHBondContact O-N 3.42Å; K688-M939 WeakPolarHBondContact CE-O 3.49Å; K688-H940 PolarHBondContact NZ-O 3.06Å; K688-L941 HydrophobicContact CD-CD2 3.71Å; K688-L941 HydrophobicContact CG-CD2 3.94Å; K688-E945 IonicContact NZ-OE1 3.34Å; K688-E945 IonicContact NZ-OE2 2.7Å; K688-E945 PolarHBondContact NZ-OE2 3.09Å; K688-V1121 CarbonylContact C-O 3.6Å; K688-T1123 PolarHBondContact O-N 2.66Å; K688-T1123 PolarHBondContact O-OG1 3.18Å
689	N	76.4	Confident	80.8	Confident	57 Å²	57	60.5 Å²	60.5	31%	0.305	31%	0.311	S	S	.	.	B	Isolated β-bridge	trans	-142.1	77.1	177.6	-85	-52.2	0	0	0	111.9	T687 T1123 I1124	T687-N689 PolarHBondContact O-N 3.31Å; T687-N689 VanDerWaalsContact O-N 3.07Å; N689-T1123 PolarHBondContact ND2-OG1 3.38Å; N689-T1123 PolarHBondContact OD1-N 2.8Å; N689-T1123 PolarHBondContact OD1-OG1 3.19Å; N689-I1124 WeakPolarHBondContact OD1-CB 3.12Å; N689-I1124 PolarHBondContact OD1-N 3.15Å
690	W	85.9	Confident	81.2	Confident	26 Å²	26	56.9 Å²	56.9	10%	0.098	30%	0.3	C	S	.	.			trans	-61.1	143.7	176.6	-171.7	93.6	0	0	0	112.8	P692 N789 T790 A824 M857 L860 E1120 V1121 I1122	W690-P692 HydrophobicContact CH2-CB 3.64Å; W690-P692 HydrophobicContact CH2-CG 4.37Å; W690-P692 HydrophobicContact CZ2-CB 4.34Å; W690-P692 HydrophobicContact CZ3-CB 4Å; W690-P692 HydrophobicContact CZ3-CG 4.23Å; W690-N789 PolarHBondContact NE1-ND2 2.83Å; W690-T790 VanDerWaalsContact CZ2-OG1 3.24Å; W690-T790 WeakPolarHBondContact CZ2-OG1 3.33Å; W690-A824 HydrophobicContact CH2-CB 4.33Å; W690-A824 HydrophobicContact CZ2-CB 3.84Å; W690-M857 HydrophobicContact CH2-CG 4.2Å; W690-M857 HydrophobicContact CH2-SD 3.47Å; W690-M857 WeakPolarHBondContact CH2-SD 3.39Å; W690-M857 HydrophobicContact CZ2-SD 4.12Å; W690-M857 HydrophobicContact CZ3-CG 4.03Å; W690-M857 HydrophobicContact CZ3-SD 3.9Å; W690-L860 HydrophobicContact CE3-CD2 3.83Å; W690-L860 HydrophobicContact CZ3-CD2 4.06Å; W690-E1120 HydrophobicContact CB-CB 4.44Å; W690-E1120 HydrophobicContact CD2-CB 4.4Å; W690-E1120 HydrophobicContact CD2-CG 3.92Å; W690-E1120 HydrophobicContact CG-CB 4.13Å; W690-E1120 HydrophobicContact CG-CG 3.9Å; W690-E1120 HydrophobicContact CZ2-CG 4.26Å; W690-V1121 WeakPolarHBondContact CB-O 3.39Å; W690-V1121 PolarHBondContact N-O 2.71Å; W690-I1122 HydrophobicContact CB-CG1 3.95Å; W690-I1122 HydrophobicContact CE3-CD1 4.24Å
691	R	88.3	Confident	81.4	Confident	60 Å²	60	55.7 Å²	55.7	23%	0.226	29%	0.294	C	S	.	.			trans	-142.7	139.6	172.6	-69.5	-66.8	-177.6	-89.2	6.3	108.6	Q693 N789 I1124 S1126	R691-Q693 PolarHBondContact O-N 2.91Å; R691-N789 PolarHBondContact O-ND2 3.05Å; R691-I1124 PolarHBondContact NH1-O 3.34Å; R691-I1124 VanDerWaalsContact NH1-O 3.13Å; R691-I1124 PolarHBondContact NH2-O 2.91Å; R691-S1126 PolarHBondContact NH2-OG 3.06Å
692	P	91.7	Very high	81.5	Confident	2 Å²	2	54.6 Å²	54.6	1%	0.013	30%	0.301	C	S	.	.			trans	-70.7	123.8	-178	26.5	-32.5	0	0	0	110.8	W690 L694 K719 L861 L864	W690-P692 HydrophobicContact CH2-CB 3.64Å; W690-P692 HydrophobicContact CH2-CG 4.37Å; W690-P692 HydrophobicContact CZ2-CB 4.34Å; W690-P692 HydrophobicContact CZ3-CB 4Å; W690-P692 HydrophobicContact CZ3-CG 4.23Å; P692-L694 HydrophobicContact CB-CD2 4.24Å; P692-K719 PolarHBondContact O-NZ 2.94Å; P692-L861 HydrophobicContact CG-CD2 4.43Å; P692-L864 HydrophobicContact CG-CD1 4.03Å
693	Q	93.3	Very high	82.1	Confident	49 Å²	49	55.9 Å²	55.9	23%	0.229	31%	0.311	C	S	.	.			trans	-112.3	113.4	168.5	-50.9	-56.9	-7	0	0	107.1	R691 K719 L724 H788 N789 T790	R691-Q693 PolarHBondContact O-N 2.91Å; Q693-K719 VanDerWaalsContact OE1-NZ 3.11Å; Q693-L724 HydrophobicContact CB-CB 4.23Å; Q693-H788 WeakPolarHBondContact O-CB 3.45Å; Q693-N789 PolarHBondContact N-OD1 3.05Å; Q693-N789 PolarHBondContact O-N 3Å; Q693-N789 PolarHBondContact O-OD1 2.78Å; Q693-T790 PolarHBondContact O-N 3.25Å
694	L	95.6	Very high	83.2	Confident	0 Å²	0	54.8 Å²	54.8	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	129.5	-160.2	-60.2	173.3	0	0	0	112.1	P692 V696 T715 L718 K719 L724 T725 I726 T790 L826	P692-L694 HydrophobicContact CB-CD2 4.24Å; L694-V696 HydrophobicContact CB-CG2 4.2Å; L694-T715 HydrophobicContact CD1-CG2 3.83Å; L694-L718 HydrophobicContact CD1-CD2 4.29Å; L694-L718 HydrophobicContact CD2-CD2 4.5Å; L694-K719 HydrophobicContact CD1-CD 3.78Å; L694-K719 HydrophobicContact CD1-CG 3.49Å; L694-K719 VanDerWaalsContact CD1-CG 3.49Å; L694-K719 HydrophobicContact CG-CD 4.1Å; L694-K719 HydrophobicContact CG-CG 4.31Å; L694-L724 PolarHBondContact N-O 2.85Å; L694-T725 CarbonylContact O-C 3.56Å; L694-T725 WeakPolarHBondContact O-CA 3.5Å; L694-I726 PolarHBondContact O-N 3.49Å; L694-T790 CarbonylContact C-O 3.54Å; L694-T790 WeakPolarHBondContact CA-O 3.31Å; L694-T790 HydrophobicContact CD2-CG2 3.72Å; L694-L826 HydrophobicContact CD2-CD1 4.06Å
695	L	96.9	Very high	84.5	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	110.7	153.3	173.8	63.8	0	0	0	107.6	L697 I726 I778 A781 H788 T790 V791 L792	L695-L697 HydrophobicContact CD1-CD2 4.41Å; L695-L697 HydrophobicContact CD2-CD2 4.16Å; L695-L697 HydrophobicContact CG-CD2 4.15Å; L695-L697 HydrophobicContact CG-CG 4.44Å; L695-I726 CarbonylContact C-O 3.5Å; L695-I726 WeakPolarHBondContact CA-O 3.48Å; L695-I726 HydrophobicContact CD1-CB 4.09Å; L695-I726 HydrophobicContact CD1-CG2 3.89Å; L695-I778 HydrophobicContact CD2-CG1 4.29Å; L695-A781 HydrophobicContact CD1-CB 4.36Å; L695-H788 HydrophobicContact CB-CB 3.93Å; L695-T790 PolarHBondContact N-O 2.97Å; L695-V791 HydrophobicContact CD2-CG2 4.44Å; L695-V791 CarbonylContact O-C 3.49Å; L695-V791 WeakPolarHBondContact O-CA 3.42Å; L695-L792 PolarHBondContact O-N 2.59Å
696	V	96.4	Very high	85.9	Confident	0 Å²	0	46.2 Å²	46.2	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	112.2	179	-172	0	0	0	0	108.2	L694 L698 L711 T715 T725 I726 V727 G728 L792	L694-V696 HydrophobicContact CB-CG2 4.2Å; V696-L698 HydrophobicContact CG1-CD2 4.19Å; V696-L698 HydrophobicContact CG1-CG 4.44Å; V696-L711 HydrophobicContact CG1-CD2 3.7Å; V696-L711 HydrophobicContact CG1-CG 3.94Å; V696-T715 HydrophobicContact CG2-CG2 3.79Å; V696-T715 WeakPolarHBondContact CG2-OG1 3.15Å; V696-T725 HydrophobicContact CG2-CG2 4.23Å; V696-I726 PolarHBondContact N-O 3.42Å; V696-V727 HydrophobicContact CB-CG2 4.45Å; V696-V727 CarbonylContact O-C 3.56Å; V696-V727 WeakPolarHBondContact O-CA 3.29Å; V696-G728 PolarHBondContact O-N 2.94Å; V696-L792 HydrophobicContact CG1-CD2 4.32Å; V696-L792 HydrophobicContact CG2-CB 4.47Å; V696-L792 HydrophobicContact CG2-CD2 4.21Å
697	L	95.6	Very high	87.3	Confident	16 Å²	16	44.1 Å²	44.1	8%	0.084	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	113.6	176.4	-65.1	177.8	0	0	0	109.5	L695 I774 L777 V791 L792 V793 I814	L695-L697 HydrophobicContact CD1-CD2 4.41Å; L695-L697 HydrophobicContact CD2-CD2 4.16Å; L695-L697 HydrophobicContact CG-CD2 4.15Å; L695-L697 HydrophobicContact CG-CG 4.44Å; L697-I774 HydrophobicContact CD1-CG2 3.65Å; L697-L777 HydrophobicContact CD2-CD1 4.17Å; L697-V791 HydrophobicContact CD1-CG1 3.82Å; L697-V791 HydrophobicContact CG-CG1 4.23Å; L697-L792 PolarHBondContact N-O 2.76Å; L697-V793 HydrophobicContact CB-CG2 4.04Å; L697-V793 HydrophobicContact CD1-CG2 3.81Å; L697-V793 HydrophobicContact CG-CG2 4.31Å; L697-I814 HydrophobicContact CD1-CG2 4.34Å
698	L	93	Very high	88.7	Confident	6 Å²	6	44 Å²	44	3%	0.031	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-101.1	138.2	177	-67.1	-179.4	0	0	0	111.4	V696 V706 L711 L712 V727 G728 N729 I749	V696-L698 HydrophobicContact CG1-CD2 4.19Å; V696-L698 HydrophobicContact CG1-CG 4.44Å; L698-V706 HydrophobicContact CD1-CG1 3.94Å; L698-V706 HydrophobicContact CD1-CG2 4.23Å; L698-V706 HydrophobicContact CD2-CG1 4.15Å; L698-L711 HydrophobicContact CD2-CB 4.19Å; L698-L711 HydrophobicContact CD2-CD2 4.08Å; L698-L712 HydrophobicContact CD1-CD1 4.05Å; L698-L712 HydrophobicContact CD1-CD2 4.17Å; L698-L712 HydrophobicContact CD1-CG 4.17Å; L698-L712 HydrophobicContact CD2-CG 4.44Å; L698-V727 HydrophobicContact CD1-CG1 3.35Å; L698-V727 HydrophobicContact CG-CG1 3.87Å; L698-G728 PolarHBondContact N-O 3.23Å; L698-N729 PolarHBondContact O-ND2 3.04Å; L698-I749 HydrophobicContact CD1-CG2 4.24Å
699	N	89.3	Confident	90	Very high	95 Å²	95	43.3 Å²	43.3	51%	0.508	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-94.4	138.8	165.9	-64.2	-30.5	0	0	0	109.3	K707	N699-K707 WeakPolarHBondContact O-CB 3.39Å; N699-K707 PolarHBondContact O-N 2.91Å; N699-K707 VanDerWaalsContact O-N 3.14Å
700	L	89.9	Confident	90.7	Very high	30 Å²	30	43.8 Å²	43.8	16%	0.157	23%	0.23	C	C	.	.	B	Isolated β-bridge	trans	-99.3	159.2	174.1	-59.5	177.9	0	0	0	110.9	G705 V706 N729 L731 A745 I749	L700-G705 CarbonylContact C-O 3.51Å; L700-G705 WeakPolarHBondContact CA-O 3.29Å; L700-G705 WeakPolarHBondContact CB-O 3.28Å; L700-G705 VanDerWaalsContact CD2-O 3.24Å; L700-G705 WeakPolarHBondContact CD2-O 3.43Å; L700-V706 HydrophobicContact CD2-CG2 3.94Å; L700-N729 VanDerWaalsContact CD1-OD1 3.27Å; L700-N729 WeakPolarHBondContact CD1-OD1 3.31Å; L700-L731 HydrophobicContact CD1-CD2 3.97Å; L700-A745 HydrophobicContact CD1-CB 3.71Å; L700-I749 HydrophobicContact CD1-CD1 4.45Å; L700-I749 HydrophobicContact CD2-CD1 4.2Å; L700-I749 HydrophobicContact CD2-CG1 4.05Å
701	D	86.9	Confident	91.1	Very high	64 Å²	64	42.7 Å²	42.7	34%	0.342	23%	0.226	S	C	.	.			trans	-87.6	-178.3	168.1	59.8	44.2	0	0	0	111.7	D703 L704 G705	D701-D703 PolarHBondContact O-N 2.8Å; D701-D703 WeakPolarHBondContact OD1-CA 3.33Å; D701-D703 PolarHBondContact OD1-N 3.09Å; D701-L704 PolarHBondContact O-N 3.31Å; D701-L704 PolarHBondContact OD1-N 2.69Å; D701-L704 VanDerWaalsContact OD1-N 3.15Å; D701-G705 PolarHBondContact N-O 2.76Å; D701-G705 WeakPolarHBondContact OD1-CA 3.48Å; D701-G705 PolarHBondContact OD1-N 2.66Å; D701-G705 VanDerWaalsContact OD2-C 3.31Å; D701-G705 WeakPolarHBondContact OD2-CA 3.44Å
702	S	83.7	Confident	91.4	Very high	116 Å²	116	39.9 Å²	39.9	81%	0.811	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-21.9	179.2	49.9	0	0	0	0	114.4	L704	S702-L704 VanDerWaalsContact C-N 3.29Å
703	D	85.6	Confident	91.5	Very high	120 Å²	120	39.8 Å²	39.8	64%	0.642	22%	0.215	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90	0.7	179	-65.2	-31.6	0	0	0	112.3	D701 G705 K744	D701-D703 PolarHBondContact O-N 2.8Å; D701-D703 WeakPolarHBondContact OD1-CA 3.33Å; D701-D703 PolarHBondContact OD1-N 3.09Å; D703-G705 VanDerWaalsContact C-N 3.3Å; D703-K744 PolarHBondContact O-NZ 2.83Å
704	L	89.4	Confident	91.5	Very high	21 Å²	21	37.6 Å²	37.6	11%	0.11	21%	0.205	C	C	.	.	S	Bend	trans	67.2	27.1	-171.3	-50.7	171.2	0	0	0	112.9	D701 S702 L731 E741 K744 A745 N748	D701-L704 PolarHBondContact O-N 3.31Å; D701-L704 PolarHBondContact OD1-N 2.69Å; D701-L704 VanDerWaalsContact OD1-N 3.15Å; S702-L704 VanDerWaalsContact C-N 3.29Å; L704-L731 HydrophobicContact CD2-CD2 3.88Å; L704-E741 HydrophobicContact CD1-CB 3.78Å; L704-E741 HydrophobicContact CD1-CG 4.07Å; L704-K744 HydrophobicContact CD1-CD 4.23Å; L704-A745 HydrophobicContact CB-CB 4.38Å; L704-N748 PolarHBondContact O-ND2 2.65Å
705	G	89.4	Confident	91.4	Very high	19 Å²	19	37.7 Å²	37.7	20%	0.196	21%	0.205	C	C	.	.			trans	-84.3	161.1	167.9	0	0	0	0	0	112.3	L700 D701 D703 K707	L700-G705 CarbonylContact C-O 3.51Å; L700-G705 WeakPolarHBondContact CA-O 3.29Å; L700-G705 WeakPolarHBondContact CB-O 3.28Å; L700-G705 VanDerWaalsContact CD2-O 3.24Å; L700-G705 WeakPolarHBondContact CD2-O 3.43Å; D701-G705 PolarHBondContact N-O 2.76Å; D701-G705 WeakPolarHBondContact OD1-CA 3.48Å; D701-G705 PolarHBondContact OD1-N 2.66Å; D701-G705 VanDerWaalsContact OD2-C 3.31Å; D701-G705 WeakPolarHBondContact OD2-CA 3.44Å; D703-G705 VanDerWaalsContact C-N 3.3Å; G705-K707 PolarHBondContact O-N 2.85Å
706	V	91.3	Very high	91.2	Very high	17 Å²	17	38.4 Å²	38.4	10%	0.103	21%	0.209	C	C	.	.	B	Isolated β-bridge	trans	-82	113.1	179.8	177.8	0	0	0	0	109.9	L698 L700 H708 I749 T752	L698-V706 HydrophobicContact CD1-CG1 3.94Å; L698-V706 HydrophobicContact CD1-CG2 4.23Å; L698-V706 HydrophobicContact CD2-CG1 4.15Å; L700-V706 HydrophobicContact CD2-CG2 3.94Å; V706-H708 PolarHBondContact O-N 3.4Å; V706-I749 HydrophobicContact CG2-CG1 4Å; V706-T752 HydrophobicContact CB-CG2 4.38Å; V706-T752 HydrophobicContact CG2-CG2 4.34Å
707	K	88.4	Confident	91.1	Very high	122 Å²	122	38.4 Å²	38.4	53%	0.53	21%	0.21	S	C	.	.	S	Bend	trans	-60.4	-39.8	-174.8	-173.4	178.2	176.8	174	0	113.7	N699 G705	N699-K707 WeakPolarHBondContact O-CB 3.39Å; N699-K707 PolarHBondContact O-N 2.91Å; N699-K707 VanDerWaalsContact O-N 3.14Å; G705-K707 PolarHBondContact O-N 2.85Å
708	H	89.9	Confident	91	Very high	49 Å²	49	38.2 Å²	38.2	23%	0.227	21%	0.209	C	C	.	.			trans	-128.7	77.5	-177.3	-64	-64.7	0	0	0	111.3	V706 R710 L711 V831 D832	V706-H708 PolarHBondContact O-N 3.4Å; H708-R710 PolarHBondContact O-N 3.13Å; H708-R710 VanDerWaalsContact O-N 3.16Å; H708-L711 PolarHBondContact O-N 3.24Å; H708-V831 HydrophobicContact CB-CB 4.44Å; H708-V831 HydrophobicContact CB-CG1 4.15Å; H708-D832 IonicContact CE1-OD1 2.68Å; H708-D832 IonicContact CE1-OD2 3.32Å; H708-D832 PolarHBondContact CE1-OD2 3.22Å; H708-D832 IonicContact CG-OD1 2.65Å; H708-D832 VanDerWaalsContact ND1-CG 3.28Å; H708-D832 IonicContact ND1-OD1 3.28Å; H708-D832 PolarHBondContact ND1-OD1 3.41Å; H708-D832 IonicContact ND1-OD2 3.4Å; H708-D832 PolarHBondContact ND1-OD2 2.92Å
709	P	91.9	Very high	90.9	Very high	41 Å²	41	39.2 Å²	39.2	27%	0.266	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-22	-176.8	26.8	-34.7	0	0	0	112.9	L711 L712 S713 T752	P709-L711 PolarHBondContact O-N 3.08Å; P709-L711 VanDerWaalsContact O-N 3.15Å; P709-L712 WeakPolarHBondContact O-CB 3.16Å; P709-L712 PolarHBondContact O-N 2.95Å; P709-S713 PolarHBondContact O-N 2.65Å; P709-T752 HydrophobicContact CB-CG2 3.96Å
710	R	92.6	Very high	90.8	Very high	66 Å²	66	37.2 Å²	37.2	25%	0.249	21%	0.209	C	C	.	.	H	α-helix	trans	-61.1	-20.8	176.5	-66.5	-65.5	172.7	-115.7	-7.6	114.2	H708 L712 S713 L714 E756 V831 F834 T836	H708-R710 PolarHBondContact O-N 3.13Å; H708-R710 VanDerWaalsContact O-N 3.16Å; R710-L712 VanDerWaalsContact C-N 3.29Å; R710-L712 PolarHBondContact O-N 3.11Å; R710-S713 WeakPolarHBondContact O-CB 3.17Å; R710-S713 PolarHBondContact O-N 3.19Å; R710-L714 PolarHBondContact O-N 2.71Å; R710-E756 IonicContact NH1-OE1 3.6Å; R710-E756 PolarHBondContact NH1-OE1 2.9Å; R710-E756 VanDerWaalsContact NH1-OE1 3.09Å; R710-V831 HydrophobicContact CB-CG1 4.05Å; R710-V831 WeakPolarHBondContact CB-O 3.46Å; R710-F834 HydrophobicContact CB-CB 4.49Å; R710-F834 WeakPolarHBondContact CD-O 3.42Å; R710-T836 VanDerWaalsContact CZ-CG2 3.4Å
711	L	93.4	Very high	90.3	Very high	4 Å²	4	37.4 Å²	37.4	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-66	-34	172.2	-157.8	67.1	0	0	0	111.6	V696 L698 H708 P709 T715 L792 A828 V831	V696-L711 HydrophobicContact CG1-CD2 3.7Å; V696-L711 HydrophobicContact CG1-CG 3.94Å; L698-L711 HydrophobicContact CD2-CB 4.19Å; L698-L711 HydrophobicContact CD2-CD2 4.08Å; H708-L711 PolarHBondContact O-N 3.24Å; P709-L711 PolarHBondContact O-N 3.08Å; P709-L711 VanDerWaalsContact O-N 3.15Å; L711-T715 WeakPolarHBondContact O-CB 3.13Å; L711-T715 PolarHBondContact O-N 3.28Å; L711-T715 PolarHBondContact O-OG1 2.86Å; L711-L792 HydrophobicContact CD1-CD1 4.06Å; L711-L792 HydrophobicContact CD1-CD2 4.09Å; L711-L792 HydrophobicContact CD1-CG 3.93Å; L711-L792 HydrophobicContact CD2-CG 4.43Å; L711-L792 HydrophobicContact CG-CD2 4.12Å; L711-L792 HydrophobicContact CG-CG 4.16Å; L711-A828 HydrophobicContact CD1-CB 4.03Å; L711-V831 HydrophobicContact CB-CG1 4.01Å; L711-V831 HydrophobicContact CD1-CG1 4.11Å
712	L	94.1	Very high	90.3	Very high	0 Å²	0	41.4 Å²	41.4	0%	0	23%	0.232	C	C	.	.	H	α-helix	trans	-71.1	-39.8	171.8	-66.3	174.8	0	0	0	111.3	L698 P709 R710 L714 T715 T716 V727 T752 M753 E756 T758	L698-L712 HydrophobicContact CD1-CD1 4.05Å; L698-L712 HydrophobicContact CD1-CD2 4.17Å; L698-L712 HydrophobicContact CD1-CG 4.17Å; L698-L712 HydrophobicContact CD2-CG 4.44Å; P709-L712 WeakPolarHBondContact O-CB 3.16Å; P709-L712 PolarHBondContact O-N 2.95Å; R710-L712 VanDerWaalsContact C-N 3.29Å; R710-L712 PolarHBondContact O-N 3.11Å; L712-L714 PolarHBondContact O-N 2.85Å; L712-T715 WeakPolarHBondContact O-CB 3.21Å; L712-T715 PolarHBondContact O-N 3.3Å; L712-T716 PolarHBondContact O-N 3.36Å; L712-T716 PolarHBondContact O-OG1 3.35Å; L712-V727 HydrophobicContact CD2-CG1 4.16Å; L712-V727 HydrophobicContact CD2-CG2 3.78Å; L712-T752 HydrophobicContact CD1-CG2 3.81Å; L712-M753 HydrophobicContact CD1-CG 4.05Å; L712-M753 HydrophobicContact CD2-CG 4.21Å; L712-E756 HydrophobicContact CB-CB 4.04Å; L712-E756 HydrophobicContact CB-CG 4.34Å; L712-T758 HydrophobicContact CD2-CG2 4.22Å; L712-T758 PolarHBondContact O-OG1 3.5Å
713	S	93.8	Very high	90.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-56.6	-49.5	172.2	-44.8	0	0	0	0	111.3	P709 R710 T715 T716 Q717 E756 C837	P709-S713 PolarHBondContact O-N 2.65Å; R710-S713 WeakPolarHBondContact O-CB 3.17Å; R710-S713 PolarHBondContact O-N 3.19Å; S713-T715 VanDerWaalsContact C-N 3.34Å; S713-T715 PolarHBondContact O-N 2.85Å; S713-T716 PolarHBondContact O-N 3.49Å; S713-Q717 WeakPolarHBondContact O-CG 3.5Å; S713-Q717 PolarHBondContact O-N 3.29Å; S713-Q717 PolarHBondContact O-NE2 2.85Å; S713-E756 WeakPolarHBondContact CB-OE2 3.37Å; S713-E756 PolarHBondContact OG-OE1 2.88Å; S713-E756 PolarHBondContact OG-OE2 2.73Å; S713-C837 PolarHBondContact O-SG 2.66Å; S713-C837 VanDerWaalsContact O-SG 3.4Å
714	L	93.9	Very high	90.8	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-41.5	177.2	177.7	59.8	0	0	0	111.9	R710 L712 Q717 L718 A828 F834 L865 L1112	R710-L714 PolarHBondContact O-N 2.71Å; L712-L714 PolarHBondContact O-N 2.85Å; L714-Q717 PolarHBondContact O-N 3.2Å; L714-L718 WeakPolarHBondContact O-CB 3.45Å; L714-L718 PolarHBondContact O-N 3.05Å; L714-A828 HydrophobicContact CD2-CB 4.1Å; L714-F834 HydrophobicContact CD1-CD1 3.91Å; L714-F834 HydrophobicContact CD1-CE1 3.82Å; L714-F834 HydrophobicContact CD2-CD1 4.12Å; L714-F834 HydrophobicContact CD2-CE1 3.81Å; L714-F834 HydrophobicContact CD2-CZ 4.25Å; L714-F834 HydrophobicContact CG-CD1 4.4Å; L714-F834 HydrophobicContact CG-CE1 4.38Å; L714-L865 HydrophobicContact CD1-CD1 4.26Å; L714-L1112 HydrophobicContact CD2-CD1 4.5Å
715	T	94	Very high	91.1	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.006	19%	0.194	C	C	.	.	H	α-helix	trans	-58.7	-49.1	174.6	-60.6	0	0	0	0	111.3	L694 V696 L711 L712 S713 Q717 L718 K719 T725 T758 L792	L694-T715 HydrophobicContact CD1-CG2 3.83Å; V696-T715 HydrophobicContact CG2-CG2 3.79Å; V696-T715 WeakPolarHBondContact CG2-OG1 3.15Å; L711-T715 WeakPolarHBondContact O-CB 3.13Å; L711-T715 PolarHBondContact O-N 3.28Å; L711-T715 PolarHBondContact O-OG1 2.86Å; L712-T715 WeakPolarHBondContact O-CB 3.21Å; L712-T715 PolarHBondContact O-N 3.3Å; S713-T715 VanDerWaalsContact C-N 3.34Å; S713-T715 PolarHBondContact O-N 2.85Å; T715-Q717 VanDerWaalsContact C-N 3.31Å; T715-Q717 PolarHBondContact O-N 3.46Å; T715-L718 PolarHBondContact O-N 3.49Å; T715-K719 WeakPolarHBondContact O-CB 3.3Å; T715-K719 WeakPolarHBondContact O-CG 3.44Å; T715-K719 PolarHBondContact O-N 3.22Å; T715-T725 HydrophobicContact CG2-CG2 3.55Å; T715-T758 HydrophobicContact CG2-CG2 4Å; T715-L792 WeakPolarHBondContact OG1-CD2 3.3Å
716	T	93.5	Very high	91.4	Very high	15 Å²	15	32.7 Å²	32.7	9%	0.092	19%	0.187	C	C	.	.	H	α-helix	trans	-60.8	-39.6	176.4	-60.7	0	0	0	0	111.6	L712 S713 A720 E756 R757 T758	L712-T716 PolarHBondContact O-N 3.36Å; L712-T716 PolarHBondContact O-OG1 3.35Å; S713-T716 PolarHBondContact O-N 3.49Å; T716-A720 VanDerWaalsContact O-CA 3.32Å; T716-A720 WeakPolarHBondContact O-CA 3.27Å; T716-A720 PolarHBondContact O-N 2.97Å; T716-E756 PolarHBondContact OG1-O 3.29Å; T716-R757 HydrophobicContact CG2-CB 4.38Å; T716-T758 VanDerWaalsContact OG1-CA 3.3Å; T716-T758 WeakPolarHBondContact OG1-CA 3.2Å; T716-T758 PolarHBondContact OG1-N 3.4Å; T716-T758 PolarHBondContact OG1-OG1 3.4Å
717	Q	93	Very high	91.7	Very high	1 Å²	1	31.9 Å²	31.9	1%	0.005	18%	0.183	C	C	.	.	H	α-helix	trans	-65.9	-46.6	177.7	-68.1	164.1	30.7	0	0	112.1	S713 L714 T715 P835 L865 H868 V870	S713-Q717 WeakPolarHBondContact O-CG 3.5Å; S713-Q717 PolarHBondContact O-N 3.29Å; S713-Q717 PolarHBondContact O-NE2 2.85Å; L714-Q717 PolarHBondContact O-N 3.2Å; T715-Q717 VanDerWaalsContact C-N 3.31Å; T715-Q717 PolarHBondContact O-N 3.46Å; Q717-P835 PolarHBondContact NE2-O 3.27Å; Q717-L865 HydrophobicContact CB-CD1 3.99Å; Q717-H868 WeakPolarHBondContact O-CB 3.27Å; Q717-V870 HydrophobicContact CG-CG2 4.3Å
718	L	93	Very high	92	Very high	12 Å²	12	26 Å²	26	6%	0.063	16%	0.157	C	C	.	.	H	α-helix	trans	-70	-32.6	-178.5	-177.6	61.3	0	0	0	113.1	L694 L714 T715 L826 L861 L864 L865	L694-L718 HydrophobicContact CD1-CD2 4.29Å; L694-L718 HydrophobicContact CD2-CD2 4.5Å; L714-L718 WeakPolarHBondContact O-CB 3.45Å; L714-L718 PolarHBondContact O-N 3.05Å; T715-L718 PolarHBondContact O-N 3.49Å; L718-L826 HydrophobicContact CD2-CD1 4.06Å; L718-L861 HydrophobicContact CD1-CD2 4.01Å; L718-L861 HydrophobicContact CD2-CD2 4.08Å; L718-L864 HydrophobicContact CD1-CB 4.16Å; L718-L865 HydrophobicContact CB-CD1 4.25Å; L718-L865 HydrophobicContact CD1-CD1 4.45Å
719	K	91.7	Very high	92.2	Very high	27 Å²	27	24 Å²	24	12%	0.117	15%	0.148	C	C	.	.	H	α-helix	trans	-96.9	-18.2	-177	-65	-67	-68.4	172.9	0	114.2	P692 Q693 L694 T715 G721 K722 L724	P692-K719 PolarHBondContact O-NZ 2.94Å; Q693-K719 VanDerWaalsContact OE1-NZ 3.11Å; L694-K719 HydrophobicContact CD1-CD 3.78Å; L694-K719 HydrophobicContact CD1-CG 3.49Å; L694-K719 VanDerWaalsContact CD1-CG 3.49Å; L694-K719 HydrophobicContact CG-CD 4.1Å; L694-K719 HydrophobicContact CG-CG 4.31Å; T715-K719 WeakPolarHBondContact O-CB 3.3Å; T715-K719 WeakPolarHBondContact O-CG 3.44Å; T715-K719 PolarHBondContact O-N 3.22Å; K719-G721 PolarHBondContact O-N 3.39Å; K719-K722 WeakPolarHBondContact CE-O 3.48Å; K719-K722 PolarHBondContact NZ-O 3.22Å; K719-K722 PolarHBondContact O-N 3.36Å; K719-L724 WeakPolarHBondContact CE-O 3.38Å
720	A	86.5	Confident	92.3	Very high	53 Å²	53	22.7 Å²	22.7	44%	0.438	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.2	31.8	-174.2	0	0	0	0	0	114.1	T716 K722	T716-A720 VanDerWaalsContact O-CA 3.32Å; T716-A720 WeakPolarHBondContact O-CA 3.27Å; T716-A720 PolarHBondContact O-N 2.97Å; A720-K722 VanDerWaalsContact C-N 3.35Å; A720-K722 PolarHBondContact O-N 2.88Å
721	G	80.1	Confident	92.4	Very high	33 Å²	33	20.4 Å²	20.4	34%	0.34	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	71	18.4	-177.2	0	0	0	0	0	116	K719	K719-G721 PolarHBondContact O-N 3.39Å
722	K	86.5	Confident	92.2	Very high	148 Å²	148	26.6 Å²	26.6	64%	0.643	16%	0.161	S	C	*	.			trans	-111.6	152.6	177.3	-59.9	175.2	-176.9	172.3	0	111.4	K719 A720	K719-K722 WeakPolarHBondContact CE-O 3.48Å; K719-K722 PolarHBondContact NZ-O 3.22Å; K719-K722 PolarHBondContact O-N 3.36Å; A720-K722 VanDerWaalsContact C-N 3.35Å; A720-K722 PolarHBondContact O-N 2.88Å
723	G	87.8	Confident	92.1	Very high	64 Å²	64	27.3 Å²	27.3	66%	0.66	17%	0.168	S	C	*	.	S	Bend	trans	74.7	-169.9	176.2	0	0	0	0	0	114.3
724	L	92.4	Very high	92	Very high	15 Å²	15	31.2 Å²	31.2	8%	0.079	19%	0.192	C	C	.	.			trans	-86	140.9	-178.1	177.7	64	0	0	0	111.3	Q693 L694 K719 I726 F761 M786 K787	Q693-L724 HydrophobicContact CB-CB 4.23Å; L694-L724 PolarHBondContact N-O 2.85Å; K719-L724 WeakPolarHBondContact CE-O 3.38Å; L724-I726 HydrophobicContact CD1-CD1 4.42Å; L724-I726 HydrophobicContact CD1-CG1 3.96Å; L724-I726 HydrophobicContact CD2-CD1 4.29Å; L724-I726 HydrophobicContact CG-CG1 4.24Å; L724-F761 HydrophobicContact CD1-CD2 3.83Å; L724-F761 HydrophobicContact CD1-CE2 3.81Å; L724-M786 HydrophobicContact CD1-CE 3.84Å; L724-M786 HydrophobicContact CD1-CG 4.43Å; L724-M786 HydrophobicContact CD2-CG 4.12Å; L724-K787 VanDerWaalsContact CD2-C 3.45Å; L724-K787 WeakPolarHBondContact CD2-O 3.38Å
725	T	95.7	Very high	91.9	Very high	4 Å²	4	37 Å²	37	3%	0.025	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	126.7	168.9	-65.1	0	0	0	0	107.8	L694 V696 T715 V727 T758 G760 F761	L694-T725 CarbonylContact O-C 3.56Å; L694-T725 WeakPolarHBondContact O-CA 3.5Å; V696-T725 HydrophobicContact CG2-CG2 4.23Å; T715-T725 HydrophobicContact CG2-CG2 3.55Å; T725-V727 HydrophobicContact CG2-CG2 4.4Å; T725-T758 HydrophobicContact CG2-CG2 4.12Å; T725-G760 CarbonylContact O-C 3.5Å; T725-G760 WeakPolarHBondContact O-CA 3.22Å; T725-F761 PolarHBondContact O-N 2.99Å
726	I	96.3	Very high	91.8	Very high	10 Å²	10	44.6 Å²	44.6	5%	0.051	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	130.1	174.7	-56.2	175.7	0	0	0	106.5	L694 L695 V696 L724 F761 H763 A781	L694-I726 PolarHBondContact O-N 3.49Å; L695-I726 CarbonylContact C-O 3.5Å; L695-I726 WeakPolarHBondContact CA-O 3.48Å; L695-I726 HydrophobicContact CD1-CB 4.09Å; L695-I726 HydrophobicContact CD1-CG2 3.89Å; V696-I726 PolarHBondContact N-O 3.42Å; L724-I726 HydrophobicContact CD1-CD1 4.42Å; L724-I726 HydrophobicContact CD1-CG1 3.96Å; L724-I726 HydrophobicContact CD2-CD1 4.29Å; L724-I726 HydrophobicContact CG-CG1 4.24Å; I726-F761 CarbonylContact C-O 3.59Å; I726-F761 WeakPolarHBondContact CA-O 3.31Å; I726-H763 HydrophobicContact CG2-CB 4.48Å; I726-A781 HydrophobicContact CD1-CB 4.22Å; I726-A781 HydrophobicContact CG2-CB 4.43Å
727	V	96.4	Very high	91.7	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	107.2	177.2	-178.8	0	0	0	0	107.6	V696 L698 L712 T725 I749 M753 F761 C762 H763	V696-V727 HydrophobicContact CB-CG2 4.45Å; V696-V727 CarbonylContact O-C 3.56Å; V696-V727 WeakPolarHBondContact O-CA 3.29Å; L698-V727 HydrophobicContact CD1-CG1 3.35Å; L698-V727 HydrophobicContact CG-CG1 3.87Å; L712-V727 HydrophobicContact CD2-CG1 4.16Å; L712-V727 HydrophobicContact CD2-CG2 3.78Å; T725-V727 HydrophobicContact CG2-CG2 4.4Å; V727-I749 HydrophobicContact CB-CG2 4.47Å; V727-I749 HydrophobicContact CG1-CG2 3.69Å; V727-M753 HydrophobicContact CB-CE 4.39Å; V727-M753 HydrophobicContact CB-SD 3.9Å; V727-M753 HydrophobicContact CG1-SD 4.34Å; V727-M753 HydrophobicContact CG2-CE 3.73Å; V727-M753 HydrophobicContact CG2-CG 4.24Å; V727-M753 HydrophobicContact CG2-SD 3.71Å; V727-F761 PolarHBondContact N-O 3.41Å; V727-C762 WeakPolarHBondContact O-CA 3.38Å; V727-H763 PolarHBondContact O-N 3.27Å
728	G	95	Very high	91.6	Very high	0 Å²	0	50.1 Å²	50.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	139.5	-177.4	0	0	0	0	0	112.2	V696 L698 H763	V696-G728 PolarHBondContact O-N 2.94Å; L698-G728 PolarHBondContact N-O 3.23Å; G728-H763 WeakPolarHBondContact CA-O 3.46Å
729	N	95.3	Very high	91.6	Very high	7 Å²	7	53.3 Å²	53.3	4%	0.037	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	150.1	165	170.7	-104.3	0	0	0	110.4	L698 L700 I749 H763 V764 V765	L698-N729 PolarHBondContact O-ND2 3.04Å; L700-N729 VanDerWaalsContact CD1-OD1 3.27Å; L700-N729 WeakPolarHBondContact CD1-OD1 3.31Å; N729-I749 HydrophobicContact CB-CD1 3.84Å; N729-H763 PolarHBondContact N-O 3.45Å; N729-V764 WeakPolarHBondContact O-CA 3.16Å; N729-V765 PolarHBondContact O-N 3.49Å
730	V	94.1	Very high	91.6	Very high	12 Å²	12	55.9 Å²	55.9	7%	0.073	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	125.6	174.8	-178.7	0	0	0	0	109.2	V765 L770 I774 L777	V730-V765 CarbonylContact C-O 3.59Å; V730-V765 VanDerWaalsContact CA-O 3.28Å; V730-V765 WeakPolarHBondContact CA-O 3.22Å; V730-L770 HydrophobicContact CB-CD1 3.78Å; V730-L770 HydrophobicContact CG1-CD1 3.83Å; V730-I774 HydrophobicContact CB-CG1 4.22Å; V730-I774 HydrophobicContact CG2-CG1 3.68Å; V730-L777 HydrophobicContact CG2-CD1 3.5Å; V730-L777 HydrophobicContact CG2-CG 4.33Å
731	L	92.9	Very high	91.9	Very high	19 Å²	19	57.5 Å²	57.5	10%	0.099	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	131.4	169.6	-65.4	177.9	0	0	0	109.1	L700 L704 A742 A745 V764 V765 V766 S767	L700-L731 HydrophobicContact CD1-CD2 3.97Å; L704-L731 HydrophobicContact CD2-CD2 3.88Å; L731-A742 HydrophobicContact CD1-CB 4.12Å; L731-A745 HydrophobicContact CD1-CB 4.14Å; L731-V764 HydrophobicContact CD1-CG1 4.03Å; L731-V764 HydrophobicContact CG-CG1 4.12Å; L731-V765 PolarHBondContact N-O 3.1Å; L731-V766 HydrophobicContact CB-CG2 4.33Å; L731-V766 HydrophobicContact CD1-CG2 4.5Å; L731-V766 WeakPolarHBondContact O-CA 3.45Å; L731-S767 PolarHBondContact O-N 3.16Å
732	Q	90.6	Very high	92.5	Very high	133 Å²	133	56.4 Å²	56.4	62%	0.621	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.5	118.8	176.2	-172.5	175.1	-1.2	0	0	110.1	S767	Q732-S767 CarbonylContact C-O 3.56Å; Q732-S767 VanDerWaalsContact CA-O 3.3Å; Q732-S767 WeakPolarHBondContact CA-O 3.38Å
733	G	91.4	Very high	92.8	Very high	16 Å²	16	54.2 Å²	54.2	17%	0.165	31%	0.306	C	S	.	.	S	Bend	trans	159.7	-167	179.7	0	0	0	0	0	113.5	S767 S768	G733-S767 PolarHBondContact N-O 3.09Å; G733-S767 CarbonylContact O-C 3.56Å; G733-S768 WeakPolarHBondContact O-CA 3.25Å; G733-S768 PolarHBondContact O-N 3.03Å; G733-S768 VanDerWaalsContact O-N 3.14Å
734	T	91.8	Very high	93.1	Very high	82 Å²	82	56 Å²	56	50%	0.503	30%	0.295	S	S	.	.			trans	-105.3	129.2	173.7	-55.1	0	0	0	0	109.2	L736 S737 H738	T734-L736 HydrophobicContact CG2-CB 4.33Å; T734-L736 PolarHBondContact O-N 3.36Å; T734-L736 VanDerWaalsContact O-N 3.16Å; T734-S737 PolarHBondContact O-N 3.46Å; T734-S737 PolarHBondContact O-OG 3.46Å; T734-S737 VanDerWaalsContact O-OG 3.08Å; T734-H738 PolarHBondContact O-N 3.28Å; T734-H738 PolarHBondContact O-ND1 3.07Å
735	Y	91.4	Very high	93.1	Very high	126 Å²	126	55.2 Å²	55.2	49%	0.494	29%	0.291	S	S	.	.	H	α-helix	trans	-53.9	-39	-175.9	-176.4	-96.9	0	0	0	113.4	S737 H738 E739 V766	Y735-S737 PolarHBondContact O-N 3.06Å; Y735-H738 PolarHBondContact O-N 3.33Å; Y735-E739 HydrophobicContact CE1-CB 4.49Å; Y735-E739 HydrophobicContact CE1-CG 4.35Å; Y735-E739 PolarHBondContact O-N 3.45Å; Y735-V766 HydrophobicContact CD2-CB 4.05Å; Y735-V766 HydrophobicContact CD2-CG2 3.86Å
736	L	92.6	Very high	93.1	Very high	160 Å²	160	58 Å²	58	84%	0.838	30%	0.304	S	S	*	.	H	α-helix	trans	-57	-29.8	178.8	-68.3	171.1	0	0	0	114.5	T734	T734-L736 HydrophobicContact CG2-CB 4.33Å; T734-L736 PolarHBondContact O-N 3.36Å; T734-L736 VanDerWaalsContact O-N 3.16Å
737	S	91.4	Very high	93	Very high	82 Å²	82	63.8 Å²	63.8	57%	0.573	33%	0.331	S	S	*	.	H	α-helix	trans	-99.1	-23.3	177.5	46.3	0	0	0	0	113.5	T734 Y735	T734-S737 PolarHBondContact O-N 3.46Å; T734-S737 PolarHBondContact O-OG 3.46Å; T734-S737 VanDerWaalsContact O-OG 3.08Å; Y735-S737 PolarHBondContact O-N 3.06Å
738	H	90.7	Very high	92.9	Very high	50 Å²	50	66.4 Å²	66.4	23%	0.231	34%	0.344	C	S	.	.	H	α-helix	trans	-110	14.3	-172.5	-62.1	67.1	0	0	0	113.7	T734 Y735 A740 E741 A742 V766	T734-H738 PolarHBondContact O-N 3.28Å; T734-H738 PolarHBondContact O-ND1 3.07Å; Y735-H738 PolarHBondContact O-N 3.33Å; H738-A740 VanDerWaalsContact C-N 3.34Å; H738-A740 PolarHBondContact O-N 3.04Å; H738-E741 IonicContact CD2-OE2 3.79Å; H738-E741 PolarHBondContact CD2-OE2 2.75Å; H738-E741 VanDerWaalsContact CD2-OE2 3.29Å; H738-E741 PolarHBondContact O-N 3.28Å; H738-A742 WeakPolarHBondContact O-CB 3.29Å; H738-A742 PolarHBondContact O-N 2.92Å; H738-V766 HydrophobicContact CB-CG1 4.21Å
739	E	92.6	Very high	92.9	Very high	79 Å²	79	66.4 Å²	66.4	37%	0.369	34%	0.344	S	S	.	.	H	α-helix	trans	-56.6	-44.3	179.5	-177.2	-175.9	172.3	0	0	112.7	Y735 E741 A742 K743	Y735-E739 HydrophobicContact CE1-CB 4.49Å; Y735-E739 HydrophobicContact CE1-CG 4.35Å; Y735-E739 PolarHBondContact O-N 3.45Å; E739-E741 VanDerWaalsContact C-N 3.35Å; E739-A742 PolarHBondContact O-N 3.37Å; E739-K743 HydrophobicContact CG-CD 4.49Å; E739-K743 WeakPolarHBondContact O-CG 3.41Å; E739-K743 PolarHBondContact O-N 3.22Å; E739-K743 VanDerWaalsContact O-N 3.1Å; E739-K743 VanDerWaalsContact OE1-CE 3.26Å; E739-K743 WeakPolarHBondContact OE1-CE 3.5Å; E739-K743 IonicContact OE1-NZ 2.71Å; E739-K743 PolarHBondContact OE1-NZ 3.37Å
740	A	92.6	Very high	92.9	Very high	80 Å²	80	70.7 Å²	70.7	66%	0.661	36%	0.363	S	S	*	.	H	α-helix	trans	-66.1	-38.6	179.5	0	0	0	0	0	112	H738 K743 K744	H738-A740 VanDerWaalsContact C-N 3.34Å; H738-A740 PolarHBondContact O-N 3.04Å; A740-K743 PolarHBondContact O-N 2.82Å; A740-K744 WeakPolarHBondContact O-CB 3.47Å; A740-K744 PolarHBondContact O-N 2.9Å
741	E	92	Very high	92.9	Very high	88 Å²	88	73.8 Å²	73.8	41%	0.411	39%	0.385	S	S	.	.	H	α-helix	trans	-69.3	-40.6	176.9	-69	-178.7	-163.6	0	0	111.9	L704 H738 E739 K743 K744 A745	L704-E741 HydrophobicContact CD1-CB 3.78Å; L704-E741 HydrophobicContact CD1-CG 4.07Å; H738-E741 IonicContact CD2-OE2 3.79Å; H738-E741 PolarHBondContact CD2-OE2 2.75Å; H738-E741 VanDerWaalsContact CD2-OE2 3.29Å; H738-E741 PolarHBondContact O-N 3.28Å; E739-E741 VanDerWaalsContact C-N 3.35Å; E741-K743 VanDerWaalsContact C-N 3.35Å; E741-K743 PolarHBondContact O-N 2.99Å; E741-K744 PolarHBondContact O-N 3.34Å; E741-A745 VanDerWaalsContact O-CB 3.31Å; E741-A745 WeakPolarHBondContact O-CB 3.43Å; E741-A745 PolarHBondContact O-N 2.97Å
742	A	92.6	Very high	93	Very high	10 Å²	10	74.3 Å²	74.3	8%	0.083	39%	0.389	C	S	.	.	H	α-helix	trans	-59.7	-43.8	173.8	0	0	0	0	0	111.9	L731 H738 E739 A745 E746 V764 V766	L731-A742 HydrophobicContact CD1-CB 4.12Å; H738-A742 WeakPolarHBondContact O-CB 3.29Å; H738-A742 PolarHBondContact O-N 2.92Å; E739-A742 PolarHBondContact O-N 3.37Å; A742-A745 PolarHBondContact O-N 2.87Å; A742-E746 WeakPolarHBondContact O-CB 3.43Å; A742-E746 PolarHBondContact O-N 3.31Å; A742-V764 HydrophobicContact CB-CG1 4.37Å; A742-V766 HydrophobicContact CB-CG2 3.73Å
743	K	93.1	Very high	93.1	Very high	102 Å²	102	68.5 Å²	68.5	44%	0.443	36%	0.362	S	S	.	.	H	α-helix	trans	-65.3	-40	174.6	-70.1	175.3	-172.2	172.2	0	112.3	E739 A740 E741 E746 Q747	E739-K743 HydrophobicContact CG-CD 4.49Å; E739-K743 WeakPolarHBondContact O-CG 3.41Å; E739-K743 PolarHBondContact O-N 3.22Å; E739-K743 VanDerWaalsContact O-N 3.1Å; E739-K743 VanDerWaalsContact OE1-CE 3.26Å; E739-K743 WeakPolarHBondContact OE1-CE 3.5Å; E739-K743 IonicContact OE1-NZ 2.71Å; E739-K743 PolarHBondContact OE1-NZ 3.37Å; A740-K743 PolarHBondContact O-N 2.82Å; E741-K743 VanDerWaalsContact C-N 3.35Å; E741-K743 PolarHBondContact O-N 2.99Å; K743-E746 PolarHBondContact O-N 3.47Å; K743-Q747 WeakPolarHBondContact O-CG 3.5Å; K743-Q747 PolarHBondContact O-N 3.4Å
744	K	93.8	Very high	93.2	Very high	100 Å²	100	71.2 Å²	71.2	44%	0.435	38%	0.383	S	S	.	.	H	α-helix	trans	-63.8	-46.7	175.3	-176.6	-175	170.2	-146.4	0	111.3	D703 L704 A740 E741 E746 Q747 N748	D703-K744 PolarHBondContact O-NZ 2.83Å; L704-K744 HydrophobicContact CD1-CD 4.23Å; A740-K744 WeakPolarHBondContact O-CB 3.47Å; A740-K744 PolarHBondContact O-N 2.9Å; E741-K744 PolarHBondContact O-N 3.34Å; K744-E746 PolarHBondContact O-N 2.71Å; K744-Q747 PolarHBondContact O-N 2.92Å; K744-N748 WeakPolarHBondContact O-CB 3.36Å; K744-N748 PolarHBondContact O-N 3.41Å
745	A	94	Very high	93.3	Very high	0 Å²	0	72.2 Å²	72.2	0%	0	39%	0.389	C	S	.	.	H	α-helix	trans	-59.4	-44.9	175.6	0	0	0	0	0	111.7	L700 L704 L731 E741 A742 Q747 N748 I749 V764	L700-A745 HydrophobicContact CD1-CB 3.71Å; L704-A745 HydrophobicContact CB-CB 4.38Å; L731-A745 HydrophobicContact CD1-CB 4.14Å; E741-A745 VanDerWaalsContact O-CB 3.31Å; E741-A745 WeakPolarHBondContact O-CB 3.43Å; E741-A745 PolarHBondContact O-N 2.97Å; A742-A745 PolarHBondContact O-N 2.87Å; A745-Q747 PolarHBondContact O-N 3.03Å; A745-N748 PolarHBondContact O-N 2.91Å; A745-I749 VanDerWaalsContact O-CG1 3.26Å; A745-I749 WeakPolarHBondContact O-CG1 3.47Å; A745-I749 PolarHBondContact O-N 3.23Å; A745-V764 HydrophobicContact CB-CG1 4.5Å
746	E	94.6	Very high	93.2	Very high	61 Å²	61	67.3 Å²	67.3	29%	0.285	37%	0.371	S	S	.	.	H	α-helix	trans	-61.9	-41.1	177.1	-163.8	-164.8	172.3	0	0	112	A742 K743 K744 K750 C762 V764	A742-E746 WeakPolarHBondContact O-CB 3.43Å; A742-E746 PolarHBondContact O-N 3.31Å; K743-E746 PolarHBondContact O-N 3.47Å; K744-E746 PolarHBondContact O-N 2.71Å; E746-K750 VanDerWaalsContact CD-NZ 3.29Å; E746-K750 HydrophobicContact CG-CD 4.4Å; E746-K750 WeakPolarHBondContact O-CB 3.29Å; E746-K750 VanDerWaalsContact O-CG 3.26Å; E746-K750 WeakPolarHBondContact O-CG 3.49Å; E746-K750 PolarHBondContact O-N 2.98Å; E746-K750 WeakPolarHBondContact OE1-CE 3.4Å; E746-K750 IonicContact OE1-NZ 3.76Å; E746-K750 PolarHBondContact OE1-NZ 2.9Å; E746-K750 IonicContact OE2-NZ 2.9Å; E746-C762 HydrophobicContact CG-CB 4.48Å; E746-V764 HydrophobicContact CB-CG2 3.85Å; E746-V764 HydrophobicContact CG-CG2 4.18Å
747	Q	94	Very high	93.1	Very high	133 Å²	133	68.6 Å²	68.6	62%	0.621	37%	0.365	S	S	*	.	H	α-helix	trans	-65.8	-43.8	174.7	-73	176.7	6.1	0	0	112.2	K743 K744 A745 K750 S751	K743-Q747 WeakPolarHBondContact O-CG 3.5Å; K743-Q747 PolarHBondContact O-N 3.4Å; K744-Q747 PolarHBondContact O-N 2.92Å; A745-Q747 PolarHBondContact O-N 3.03Å; Q747-K750 PolarHBondContact O-N 3.3Å; Q747-S751 WeakPolarHBondContact O-CB 3.48Å; Q747-S751 PolarHBondContact O-N 3.36Å
748	N	94.8	Very high	93.1	Very high	54 Å²	54	65.2 Å²	65.2	29%	0.289	34%	0.34	S	S	.	.	H	α-helix	trans	-59.7	-49	176	-76.5	-6.1	0	0	0	111.2	L704 K744 A745 K750 S751 T752	L704-N748 PolarHBondContact O-ND2 2.65Å; K744-N748 WeakPolarHBondContact O-CB 3.36Å; K744-N748 PolarHBondContact O-N 3.41Å; A745-N748 PolarHBondContact O-N 2.91Å; N748-K750 PolarHBondContact O-N 3.13Å; N748-S751 WeakPolarHBondContact O-CB 3.35Å; N748-S751 PolarHBondContact O-N 3.38Å; N748-T752 PolarHBondContact O-N 2.91Å; N748-T752 PolarHBondContact O-OG1 3.16Å
749	I	94.9	Very high	93.1	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	36%	0.361	C	S	.	.	H	α-helix	trans	-60.1	-46.1	177.1	-66.2	162.7	0	0	0	110.7	L698 L700 V706 V727 N729 A745 S751 T752 M753 C762 V764	L698-I749 HydrophobicContact CD1-CG2 4.24Å; L700-I749 HydrophobicContact CD1-CD1 4.45Å; L700-I749 HydrophobicContact CD2-CD1 4.2Å; L700-I749 HydrophobicContact CD2-CG1 4.05Å; V706-I749 HydrophobicContact CG2-CG1 4Å; V727-I749 HydrophobicContact CB-CG2 4.47Å; V727-I749 HydrophobicContact CG1-CG2 3.69Å; N729-I749 HydrophobicContact CB-CD1 3.84Å; A745-I749 VanDerWaalsContact O-CG1 3.26Å; A745-I749 WeakPolarHBondContact O-CG1 3.47Å; A745-I749 PolarHBondContact O-N 3.23Å; I749-S751 VanDerWaalsContact C-N 3.32Å; I749-S751 PolarHBondContact O-N 2.81Å; I749-T752 PolarHBondContact O-N 3.2Å; I749-M753 HydrophobicContact CG2-CG 4.25Å; I749-M753 HydrophobicContact CG2-SD 3.93Å; I749-M753 WeakPolarHBondContact O-CB 3.5Å; I749-M753 VanDerWaalsContact O-CG 3.28Å; I749-M753 WeakPolarHBondContact O-CG 3.4Å; I749-M753 PolarHBondContact O-N 3.04Å; I749-C762 HydrophobicContact CG2-CB 4.44Å; I749-C762 VanDerWaalsContact CG2-SG 3.52Å; I749-V764 HydrophobicContact CD1-CG2 3.83Å
750	K	95.3	Very high	93.1	Very high	98 Å²	98	68.1 Å²	68.1	43%	0.426	36%	0.361	S	S	.	.	H	α-helix	trans	-60.7	-38.6	176.7	-75.7	172.2	-176.3	171.2	0	112.6	E746 Q747 N748 M753 A754 C762	E746-K750 VanDerWaalsContact CD-NZ 3.29Å; E746-K750 HydrophobicContact CG-CD 4.4Å; E746-K750 WeakPolarHBondContact O-CB 3.29Å; E746-K750 VanDerWaalsContact O-CG 3.26Å; E746-K750 WeakPolarHBondContact O-CG 3.49Å; E746-K750 PolarHBondContact O-N 2.98Å; E746-K750 WeakPolarHBondContact OE1-CE 3.4Å; E746-K750 IonicContact OE1-NZ 3.76Å; E746-K750 PolarHBondContact OE1-NZ 2.9Å; E746-K750 IonicContact OE2-NZ 2.9Å; Q747-K750 PolarHBondContact O-N 3.3Å; N748-K750 PolarHBondContact O-N 3.13Å; K750-M753 PolarHBondContact O-N 3.46Å; K750-A754 PolarHBondContact O-N 2.91Å; K750-C762 HydrophobicContact CG-CB 3.94Å
751	S	94.6	Very high	93.2	Very high	76 Å²	76	70.3 Å²	70.3	53%	0.531	36%	0.356	S	S	.	.	H	α-helix	trans	-64.2	-44.1	174.7	-172.4	0	0	0	0	111.9	Q747 N748 I749 A754 T755	Q747-S751 WeakPolarHBondContact O-CB 3.48Å; Q747-S751 PolarHBondContact O-N 3.36Å; N748-S751 WeakPolarHBondContact O-CB 3.35Å; N748-S751 PolarHBondContact O-N 3.38Å; I749-S751 VanDerWaalsContact C-N 3.32Å; I749-S751 PolarHBondContact O-N 2.81Å; S751-A754 PolarHBondContact O-N 3.45Å; S751-T755 PolarHBondContact O-N 3.14Å; S751-T755 PolarHBondContact O-OG1 2.82Å
752	T	93.8	Very high	93.3	Very high	31 Å²	31	67.1 Å²	67.1	19%	0.19	34%	0.343	C	S	.	.	H	α-helix	trans	-64.8	-42.1	174.5	-46.6	0	0	0	0	111.8	V706 P709 L712 N748 I749 A754 T755 E756	V706-T752 HydrophobicContact CB-CG2 4.38Å; V706-T752 HydrophobicContact CG2-CG2 4.34Å; P709-T752 HydrophobicContact CB-CG2 3.96Å; L712-T752 HydrophobicContact CD1-CG2 3.81Å; N748-T752 PolarHBondContact O-N 2.91Å; N748-T752 PolarHBondContact O-OG1 3.16Å; I749-T752 PolarHBondContact O-N 3.2Å; T752-A754 VanDerWaalsContact C-N 3.34Å; T752-A754 PolarHBondContact O-N 2.96Å; T752-T755 WeakPolarHBondContact O-CB 3.43Å; T752-T755 PolarHBondContact O-N 3.43Å; T752-E756 PolarHBondContact O-N 3.46Å
753	M	94	Very high	93.4	Very high	10 Å²	10	70.5 Å²	70.5	5%	0.049	36%	0.357	C	S	.	.	H	α-helix	trans	-59.6	-41.9	174.6	-72.8	173.3	68.6	0	0	112.1	L712 V727 I749 K750 R757 T758 C762	L712-M753 HydrophobicContact CD1-CG 4.05Å; L712-M753 HydrophobicContact CD2-CG 4.21Å; V727-M753 HydrophobicContact CB-CE 4.39Å; V727-M753 HydrophobicContact CB-SD 3.9Å; V727-M753 HydrophobicContact CG1-SD 4.34Å; V727-M753 HydrophobicContact CG2-CE 3.73Å; V727-M753 HydrophobicContact CG2-CG 4.24Å; V727-M753 HydrophobicContact CG2-SD 3.71Å; I749-M753 HydrophobicContact CG2-CG 4.25Å; I749-M753 HydrophobicContact CG2-SD 3.93Å; I749-M753 WeakPolarHBondContact O-CB 3.5Å; I749-M753 VanDerWaalsContact O-CG 3.28Å; I749-M753 WeakPolarHBondContact O-CG 3.4Å; I749-M753 PolarHBondContact O-N 3.04Å; K750-M753 PolarHBondContact O-N 3.46Å; M753-R757 CarbonylContact O-C 3.48Å; M753-R757 WeakPolarHBondContact O-CA 3.29Å; M753-R757 PolarHBondContact O-N 2.96Å; M753-T758 PolarHBondContact O-N 2.86Å; M753-C762 HydrophobicContact SD-CB 4.1Å
754	A	93.5	Very high	93.4	Very high	74 Å²	74	66.8 Å²	66.8	61%	0.612	34%	0.343	S	S	*	.	H	α-helix	trans	-63.8	-41.7	175.3	0	0	0	0	0	111.7	K750 S751 T752 R757	K750-A754 PolarHBondContact O-N 2.91Å; S751-A754 PolarHBondContact O-N 3.45Å; T752-A754 VanDerWaalsContact C-N 3.34Å; T752-A754 PolarHBondContact O-N 2.96Å; A754-R757 PolarHBondContact O-N 2.82Å
755	T	92.4	Very high	93.4	Very high	102 Å²	102	63.8 Å²	63.8	63%	0.626	33%	0.333	S	S	*	.	H	α-helix	trans	-63.3	-47.6	178.3	-56.5	0	0	0	0	112	S751 T752 R757	S751-T755 PolarHBondContact O-N 3.14Å; S751-T755 PolarHBondContact O-OG1 2.82Å; T752-T755 WeakPolarHBondContact O-CB 3.43Å; T752-T755 PolarHBondContact O-N 3.43Å; T755-R757 PolarHBondContact O-N 3.3Å
756	E	90.2	Very high	93.5	Very high	24 Å²	24	64.9 Å²	64.9	11%	0.112	34%	0.339	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	9	177.4	-66.3	-65.7	163.9	0	0	113.5	R710 L712 S713 T716 T752 T758	R710-E756 IonicContact NH1-OE1 3.6Å; R710-E756 PolarHBondContact NH1-OE1 2.9Å; R710-E756 VanDerWaalsContact NH1-OE1 3.09Å; L712-E756 HydrophobicContact CB-CB 4.04Å; L712-E756 HydrophobicContact CB-CG 4.34Å; S713-E756 WeakPolarHBondContact CB-OE2 3.37Å; S713-E756 PolarHBondContact OG-OE1 2.88Å; S713-E756 PolarHBondContact OG-OE2 2.73Å; T716-E756 PolarHBondContact OG1-O 3.29Å; T752-E756 PolarHBondContact O-N 3.46Å; E756-T758 PolarHBondContact O-N 3.02Å; E756-T758 VanDerWaalsContact O-N 3.14Å
757	R	90.3	Very high	93.4	Very high	187 Å²	187	62.8 Å²	62.8	71%	0.706	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.5	25.8	177.9	-54.5	-177.6	178.8	-164.6	-2	114.7	T716 M753 A754 T755 K759	T716-R757 HydrophobicContact CG2-CB 4.38Å; M753-R757 CarbonylContact O-C 3.48Å; M753-R757 WeakPolarHBondContact O-CA 3.29Å; M753-R757 PolarHBondContact O-N 2.96Å; A754-R757 PolarHBondContact O-N 2.82Å; T755-R757 PolarHBondContact O-N 3.3Å; R757-K759 PolarHBondContact O-N 3.2Å
758	T	90.6	Very high	93.3	Very high	11 Å²	11	60.9 Å²	60.9	7%	0.067	33%	0.333	C	S	.	.			trans	-75.6	106.3	179	-47.5	0	0	0	0	110.2	L712 T715 T716 T725 M753 E756 G760	L712-T758 HydrophobicContact CD2-CG2 4.22Å; L712-T758 PolarHBondContact O-OG1 3.5Å; T715-T758 HydrophobicContact CG2-CG2 4Å; T716-T758 VanDerWaalsContact OG1-CA 3.3Å; T716-T758 WeakPolarHBondContact OG1-CA 3.2Å; T716-T758 PolarHBondContact OG1-N 3.4Å; T716-T758 PolarHBondContact OG1-OG1 3.4Å; T725-T758 HydrophobicContact CG2-CG2 4.12Å; M753-T758 PolarHBondContact O-N 2.86Å; E756-T758 PolarHBondContact O-N 3.02Å; E756-T758 VanDerWaalsContact O-N 3.14Å; T758-G760 PolarHBondContact O-N 3.29Å
759	K	91.8	Very high	93.1	Very high	155 Å²	155	60.7 Å²	60.7	67%	0.674	33%	0.332	S	S	*	.			trans	-79.3	115.4	171.5	-65.6	-175.3	179.2	-177.7	0	109.4	R757	R757-K759 PolarHBondContact O-N 3.2Å
760	G	92.1	Very high	92.8	Very high	35 Å²	35	63 Å²	63	36%	0.361	34%	0.344	S	S	.	.	S	Bend	trans	-179.9	-174.4	-179.5	0	0	0	0	0	112.5	T725 T758	T725-G760 CarbonylContact O-C 3.5Å; T725-G760 WeakPolarHBondContact O-CA 3.22Å; T758-G760 PolarHBondContact O-N 3.29Å
761	F	94.3	Very high	92.5	Very high	126 Å²	126	61.8 Å²	61.8	55%	0.553	34%	0.337	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.9	147.4	176	-55.5	-83.3	0	0	0	110	L724 T725 I726 V727 M786	L724-F761 HydrophobicContact CD1-CD2 3.83Å; L724-F761 HydrophobicContact CD1-CE2 3.81Å; T725-F761 PolarHBondContact O-N 2.99Å; I726-F761 CarbonylContact C-O 3.59Å; I726-F761 WeakPolarHBondContact CA-O 3.31Å; V727-F761 PolarHBondContact N-O 3.41Å; F761-M786 HydrophobicContact CE2-CE 3.91Å; F761-M786 HydrophobicContact CZ-CE 4.3Å
762	C	94.9	Very high	92.3	Very high	21 Å²	21	60.9 Å²	60.9	14%	0.142	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	137.4	172.9	-179.4	0	0	0	0	108.9	V727 E746 I749 K750 M753	V727-C762 WeakPolarHBondContact O-CA 3.38Å; E746-C762 HydrophobicContact CG-CB 4.48Å; I749-C762 HydrophobicContact CG2-CB 4.44Å; I749-C762 VanDerWaalsContact CG2-SG 3.52Å; K750-C762 HydrophobicContact CG-CB 3.94Å; M753-C762 HydrophobicContact SD-CB 4.1Å
763	H	93.7	Very high	92.3	Very high	81 Å²	81	59.4 Å²	59.4	38%	0.375	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	111.8	175.3	-161.6	-25.4	0	0	0	109.4	I726 V727 G728 N729 L777	I726-H763 HydrophobicContact CG2-CB 4.48Å; V727-H763 PolarHBondContact O-N 3.27Å; G728-H763 WeakPolarHBondContact CA-O 3.46Å; N729-H763 PolarHBondContact N-O 3.45Å; H763-L777 HydrophobicContact CB-CD2 4.47Å
764	V	94.1	Very high	92.3	Very high	24 Å²	24	59.6 Å²	59.6	15%	0.145	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	137.5	171.5	-176.9	0	0	0	0	108.1	N729 L731 A742 A745 E746 I749	N729-V764 WeakPolarHBondContact O-CA 3.16Å; L731-V764 HydrophobicContact CD1-CG1 4.03Å; L731-V764 HydrophobicContact CG-CG1 4.12Å; A742-V764 HydrophobicContact CB-CG1 4.37Å; A745-V764 HydrophobicContact CB-CG1 4.5Å; E746-V764 HydrophobicContact CB-CG2 3.85Å; E746-V764 HydrophobicContact CG-CG2 4.18Å; I749-V764 HydrophobicContact CD1-CG2 3.83Å
765	V	94.2	Very high	92.3	Very high	36 Å²	36	56.8 Å²	56.8	22%	0.218	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	135.4	177.3	175.9	0	0	0	0	108.7	N729 V730 L731 L777	N729-V765 PolarHBondContact O-N 3.49Å; V730-V765 CarbonylContact C-O 3.59Å; V730-V765 VanDerWaalsContact CA-O 3.28Å; V730-V765 WeakPolarHBondContact CA-O 3.22Å; L731-V765 PolarHBondContact N-O 3.1Å; V765-L777 HydrophobicContact CG2-CD2 3.69Å; V765-L777 HydrophobicContact CG2-CG 4.11Å
766	V	94.7	Very high	92.4	Very high	24 Å²	24	57.1 Å²	57.1	15%	0.145	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	126	170.9	-172.9	0	0	0	0	108.4	L731 Y735 H738 A742	L731-V766 HydrophobicContact CB-CG2 4.33Å; L731-V766 HydrophobicContact CD1-CG2 4.5Å; L731-V766 WeakPolarHBondContact O-CA 3.45Å; Y735-V766 HydrophobicContact CD2-CB 4.05Å; Y735-V766 HydrophobicContact CD2-CG2 3.86Å; H738-V766 HydrophobicContact CB-CG1 4.21Å; A742-V766 HydrophobicContact CB-CG2 3.73Å
767	S	93.9	Very high	92.6	Very high	17 Å²	17	56 Å²	56	12%	0.119	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	142.7	-178.3	178.5	0	0	0	0	110.5	L731 Q732 G733 N769	L731-S767 PolarHBondContact O-N 3.16Å; Q732-S767 CarbonylContact C-O 3.56Å; Q732-S767 VanDerWaalsContact CA-O 3.3Å; Q732-S767 WeakPolarHBondContact CA-O 3.38Å; G733-S767 PolarHBondContact N-O 3.09Å; G733-S767 CarbonylContact O-C 3.56Å; S767-N769 WeakPolarHBondContact CB-O 3.36Å; S767-N769 PolarHBondContact O-N 3.44Å; S767-N769 PolarHBondContact OG-N 3.49Å; S767-N769 PolarHBondContact OG-O 3.43Å
768	S	91.2	Very high	92.8	Very high	92 Å²	92	47.2 Å²	47.2	64%	0.643	25%	0.249	S	C	*	.	S	Bend	trans	-62	-29.7	176	52.6	0	0	0	0	112.4	G733	G733-S768 WeakPolarHBondContact O-CA 3.25Å; G733-S768 PolarHBondContact O-N 3.03Å; G733-S768 VanDerWaalsContact O-N 3.14Å
769	N	90.6	Very high	92.8	Very high	51 Å²	51	53.3 Å²	53.3	27%	0.273	28%	0.277	S	S	.	.	S	Bend	trans	-121.6	128.7	175.8	-176.5	6.3	0	0	0	110.4	S767 R771 D772 G773	S767-N769 WeakPolarHBondContact CB-O 3.36Å; S767-N769 PolarHBondContact O-N 3.44Å; S767-N769 PolarHBondContact OG-N 3.49Å; S767-N769 PolarHBondContact OG-O 3.43Å; N769-R771 VanDerWaalsContact C-N 3.33Å; N769-R771 PolarHBondContact O-N 3.04Å; N769-R771 PolarHBondContact OD1-N 2.93Å; N769-R771 VanDerWaalsContact OD1-N 3.16Å; N769-D772 HydrophobicContact CB-CB 4.35Å; N769-D772 WeakPolarHBondContact CB-OD2 3.21Å; N769-D772 PolarHBondContact ND2-OD1 3.36Å; N769-D772 PolarHBondContact ND2-OD2 3.2Å; N769-G773 PolarHBondContact O-N 2.94Å; N769-G773 VanDerWaalsContact O-N 3.15Å
770	L	88.3	Confident	92.8	Very high	47 Å²	47	49.9 Å²	49.9	25%	0.246	27%	0.273	C	S	.	.	H	α-helix	trans	-60.3	-41.3	177.8	-178.2	61.1	0	0	0	111.9	V730 G773 I774	V730-L770 HydrophobicContact CB-CD1 3.78Å; V730-L770 HydrophobicContact CG1-CD1 3.83Å; L770-G773 PolarHBondContact O-N 3.46Å; L770-I774 HydrophobicContact CD1-CD1 3.94Å; L770-I774 HydrophobicContact CD1-CG1 4.33Å; L770-I774 HydrophobicContact CG-CD1 4Å; L770-I774 WeakPolarHBondContact O-CG1 3.37Å; L770-I774 PolarHBondContact O-N 3.27Å; L770-I774 VanDerWaalsContact O-N 3.08Å
771	R	89.3	Confident	92.9	Very high	74 Å²	74	48.4 Å²	48.4	28%	0.279	26%	0.257	S	S	.	.	H	α-helix	trans	-59.5	-54.9	179.7	176.3	178.5	173.5	-89.9	-0	111.2	N769 G773 I774 S775 E813	N769-R771 VanDerWaalsContact C-N 3.33Å; N769-R771 PolarHBondContact O-N 3.04Å; N769-R771 PolarHBondContact OD1-N 2.93Å; N769-R771 VanDerWaalsContact OD1-N 3.16Å; R771-G773 VanDerWaalsContact C-N 3.29Å; R771-G773 PolarHBondContact O-N 2.83Å; R771-I774 PolarHBondContact O-N 3.35Å; R771-I774 VanDerWaalsContact O-N 3.13Å; R771-S775 WeakPolarHBondContact O-CB 3.48Å; R771-S775 PolarHBondContact O-N 2.99Å; R771-E813 IonicContact CZ-OE2 3.29Å; R771-E813 VanDerWaalsContact CZ-OE2 3.32Å; R771-E813 IonicContact NE-OE2 2.65Å; R771-E813 PolarHBondContact NE-OE2 3.44Å; R771-E813 VanDerWaalsContact NE-OE2 3.08Å; R771-E813 IonicContact NH2-OE2 2.99Å; R771-E813 PolarHBondContact NH2-OE2 3.39Å
772	D	91.5	Very high	92.7	Very high	57 Å²	57	44.4 Å²	44.4	31%	0.305	25%	0.251	S	S	.	.	H	α-helix	trans	-67.2	-33.9	-174.4	-50.9	-28.6	0	0	0	111	N769 S775 H776	N769-D772 HydrophobicContact CB-CB 4.35Å; N769-D772 WeakPolarHBondContact CB-OD2 3.21Å; N769-D772 PolarHBondContact ND2-OD1 3.36Å; N769-D772 PolarHBondContact ND2-OD2 3.2Å; D772-S775 WeakPolarHBondContact O-CB 3.13Å; D772-S775 PolarHBondContact O-N 3.33Å; D772-H776 PolarHBondContact O-N 2.96Å; D772-H776 PolarHBondContact O-ND1 2.9Å; D772-H776 VanDerWaalsContact O-ND1 3.12Å
773	G	93.2	Very high	92.4	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.6	-39.9	172.5	0	0	0	0	0	113.6	N769 L770 R771 L777	N769-G773 PolarHBondContact O-N 2.94Å; N769-G773 VanDerWaalsContact O-N 3.15Å; L770-G773 PolarHBondContact O-N 3.46Å; R771-G773 VanDerWaalsContact C-N 3.29Å; R771-G773 PolarHBondContact O-N 2.83Å; G773-L777 PolarHBondContact O-N 3.47Å; G773-L777 VanDerWaalsContact O-N 3.14Å
774	I	93.2	Very high	91.9	Very high	13 Å²	13	47 Å²	47	7%	0.067	28%	0.275	C	S	.	.	H	α-helix	trans	-71.9	-40.3	176.6	-64.5	170.7	0	0	0	110.3	L697 V730 L770 R771 H776 L777 I778 I814	L697-I774 HydrophobicContact CD1-CG2 3.65Å; V730-I774 HydrophobicContact CB-CG1 4.22Å; V730-I774 HydrophobicContact CG2-CG1 3.68Å; L770-I774 HydrophobicContact CD1-CD1 3.94Å; L770-I774 HydrophobicContact CD1-CG1 4.33Å; L770-I774 HydrophobicContact CG-CD1 4Å; L770-I774 WeakPolarHBondContact O-CG1 3.37Å; L770-I774 PolarHBondContact O-N 3.27Å; L770-I774 VanDerWaalsContact O-N 3.08Å; R771-I774 PolarHBondContact O-N 3.35Å; R771-I774 VanDerWaalsContact O-N 3.13Å; I774-H776 VanDerWaalsContact C-N 3.3Å; I774-H776 PolarHBondContact O-N 2.83Å; I774-L777 WeakPolarHBondContact O-CB 3.42Å; I774-L777 PolarHBondContact O-N 2.77Å; I774-L777 VanDerWaalsContact O-N 3.09Å; I774-I778 HydrophobicContact CG2-CD1 3.84Å; I774-I778 HydrophobicContact CG2-CG1 4.34Å; I774-I778 WeakPolarHBondContact O-CG1 3.31Å; I774-I778 PolarHBondContact O-N 3.19Å; I774-I814 HydrophobicContact CD1-CD1 3.92Å; I774-I814 HydrophobicContact CG2-CD1 3.94Å; I774-I814 HydrophobicContact CG2-CG1 3.74Å
775	S	94.1	Very high	91.4	Very high	15 Å²	15	47.5 Å²	47.5	11%	0.105	29%	0.286	C	S	.	.	H	α-helix	trans	-54.7	-45.7	173.4	-158	0	0	0	0	111.6	R771 D772 I778 Q779 E817	R771-S775 WeakPolarHBondContact O-CB 3.48Å; R771-S775 PolarHBondContact O-N 2.99Å; D772-S775 WeakPolarHBondContact O-CB 3.13Å; D772-S775 PolarHBondContact O-N 3.33Å; S775-I778 PolarHBondContact O-N 3.01Å; S775-Q779 VanDerWaalsContact O-CG 3.31Å; S775-Q779 WeakPolarHBondContact O-CG 3.48Å; S775-Q779 PolarHBondContact O-N 3.41Å; S775-Q779 PolarHBondContact O-NE2 3.42Å; S775-Q779 PolarHBondContact OG-NE2 3.33Å; S775-Q779 VanDerWaalsContact OG-NE2 3.13Å; S775-E817 WeakPolarHBondContact CA-OE2 3.23Å; S775-E817 WeakPolarHBondContact CB-OE1 3.32Å; S775-E817 WeakPolarHBondContact CB-OE2 3.49Å; S775-E817 PolarHBondContact OG-OE1 3.29Å; S775-E817 PolarHBondContact OG-OE2 2.82Å
776	H	94.2	Very high	91.1	Very high	110 Å²	110	49.6 Å²	49.6	51%	0.509	29%	0.294	S	S	.	.	H	α-helix	trans	-64.1	-39.7	175.1	-64.9	149.3	0	0	0	113	D772 I774 Q779 S780	D772-H776 PolarHBondContact O-N 2.96Å; D772-H776 PolarHBondContact O-ND1 2.9Å; D772-H776 VanDerWaalsContact O-ND1 3.12Å; I774-H776 VanDerWaalsContact C-N 3.3Å; I774-H776 PolarHBondContact O-N 2.83Å; H776-Q779 PolarHBondContact O-N 3.3Å; H776-S780 WeakPolarHBondContact O-CB 3.26Å; H776-S780 PolarHBondContact O-N 2.88Å; H776-S780 PolarHBondContact O-OG 3.07Å
777	L	94.3	Very high	90.9	Very high	1 Å²	1	55.1 Å²	55.1	1%	0.005	32%	0.316	C	S	.	.	H	α-helix	trans	-63.1	-43.8	175.3	-79.9	177.5	0	0	0	112.3	L697 V730 H763 V765 G773 I774 Q779 A781	L697-L777 HydrophobicContact CD2-CD1 4.17Å; V730-L777 HydrophobicContact CG2-CD1 3.5Å; V730-L777 HydrophobicContact CG2-CG 4.33Å; H763-L777 HydrophobicContact CB-CD2 4.47Å; V765-L777 HydrophobicContact CG2-CD2 3.69Å; V765-L777 HydrophobicContact CG2-CG 4.11Å; G773-L777 PolarHBondContact O-N 3.47Å; G773-L777 VanDerWaalsContact O-N 3.14Å; I774-L777 WeakPolarHBondContact O-CB 3.42Å; I774-L777 PolarHBondContact O-N 2.77Å; I774-L777 VanDerWaalsContact O-N 3.09Å; L777-Q779 PolarHBondContact O-N 2.92Å; L777-A781 WeakPolarHBondContact O-CB 3.04Å; L777-A781 PolarHBondContact O-N 3.43Å; L777-A781 VanDerWaalsContact O-N 3.12Å
778	I	94.5	Very high	90.9	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.005	31%	0.312	C	S	.	.	H	α-helix	trans	-62.9	-32.2	179.5	-67.6	167	0	0	0	111.7	L695 I774 S775 H788 V791 I814 E817 A821 Q823	L695-I778 HydrophobicContact CD2-CG1 4.29Å; I774-I778 HydrophobicContact CG2-CD1 3.84Å; I774-I778 HydrophobicContact CG2-CG1 4.34Å; I774-I778 WeakPolarHBondContact O-CG1 3.31Å; I774-I778 PolarHBondContact O-N 3.19Å; S775-I778 PolarHBondContact O-N 3.01Å; I778-H788 WeakPolarHBondContact CA-NE2 3.36Å; I778-H788 PolarHBondContact O-NE2 2.84Å; I778-V791 HydrophobicContact CG1-CG2 4.41Å; I778-I814 HydrophobicContact CD1-CG2 4.08Å; I778-E817 HydrophobicContact CD1-CB 4.27Å; I778-A821 HydrophobicContact CG2-CB 4.2Å; I778-Q823 PolarHBondContact O-NE2 2.96Å
779	Q	91.4	Very high	90.9	Very high	139 Å²	139	52.2 Å²	52.2	65%	0.65	29%	0.292	S	S	*	.	H	α-helix	trans	-90.7	-34.3	-176.6	-66.5	175.2	53.4	0	0	113.6	S775 H776 L777	S775-Q779 VanDerWaalsContact O-CG 3.31Å; S775-Q779 WeakPolarHBondContact O-CG 3.48Å; S775-Q779 PolarHBondContact O-N 3.41Å; S775-Q779 PolarHBondContact O-NE2 3.42Å; S775-Q779 PolarHBondContact OG-NE2 3.33Å; S775-Q779 VanDerWaalsContact OG-NE2 3.13Å; H776-Q779 PolarHBondContact O-N 3.3Å; L777-Q779 PolarHBondContact O-N 2.92Å
780	S	92.3	Very high	91.1	Very high	84 Å²	84	49.8 Å²	49.8	59%	0.587	28%	0.279	S	S	*	.	H	α-helix	trans	-112.4	-10.3	-168.5	70.1	0	0	0	0	116	H776 G782	H776-S780 WeakPolarHBondContact O-CB 3.26Å; H776-S780 PolarHBondContact O-N 2.88Å; H776-S780 PolarHBondContact O-OG 3.07Å; S780-G782 PolarHBondContact O-N 3.25Å; S780-G782 VanDerWaalsContact O-N 3.15Å
781	A	93.2	Very high	91.5	Very high	4 Å²	4	47.6 Å²	47.6	3%	0.033	27%	0.267	C	S	.	.			trans	-71	112.3	-175.7	0	0	0	0	0	113.3	L695 I726 L777 H788	L695-A781 HydrophobicContact CD1-CB 4.36Å; I726-A781 HydrophobicContact CD1-CB 4.22Å; I726-A781 HydrophobicContact CG2-CB 4.43Å; L777-A781 WeakPolarHBondContact O-CB 3.04Å; L777-A781 PolarHBondContact O-N 3.43Å; L777-A781 VanDerWaalsContact O-N 3.12Å; A781-H788 PolarHBondContact O-CD2 2.96Å
782	G	89.9	Confident	91.8	Very high	41 Å²	41	44.1 Å²	44.1	42%	0.423	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	143.4	-172	179.1	0	0	0	0	0	111.5	S780 M786	S780-G782 PolarHBondContact O-N 3.25Å; S780-G782 VanDerWaalsContact O-N 3.15Å; G782-M786 WeakPolarHBondContact CA-O 3.36Å
783	L	89.3	Confident	92	Very high	117 Å²	117	41.9 Å²	41.9	61%	0.613	24%	0.243	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-146.2	118.9	172.7	-174.6	58.6	0	0	0	110.3	L677 G785 M786	L677-L783 HydrophobicContact CD1-CD2 3.69Å; L677-L783 HydrophobicContact CD1-CG 4.14Å; L783-G785 PolarHBondContact O-N 3.38Å; L783-M786 PolarHBondContact N-O 3.45Å; L783-M786 WeakPolarHBondContact O-CB 3.04Å; L783-M786 PolarHBondContact O-N 3.43Å
784	G	83.4	Confident	92	Very high	39 Å²	39	42.6 Å²	42.6	40%	0.402	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.7	-128.7	-177.3	0	0	0	0	0	112.6	M786	G784-M786 PolarHBondContact O-N 3Å
785	G	81.9	Confident	91.9	Very high	36 Å²	36	43 Å²	43	37%	0.371	25%	0.251	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-15.3	174.8	0	0	0	0	0	115.2	L783 K787	L783-G785 PolarHBondContact O-N 3.38Å; G785-K787 PolarHBondContact O-N 3.39Å
786	M	88.9	Confident	91.6	Very high	79 Å²	79	43.4 Å²	43.4	39%	0.389	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	77.7	-178.7	-171	164.5	175.1	0	0	111.2	L677 L724 F761 G782 L783 G784	L677-M786 HydrophobicContact CD2-CB 3.46Å; L677-M786 VanDerWaalsContact CD2-CB 3.46Å; L677-M786 HydrophobicContact CD2-CG 4.38Å; L677-M786 HydrophobicContact CD2-SD 4.11Å; L724-M786 HydrophobicContact CD1-CE 3.84Å; L724-M786 HydrophobicContact CD1-CG 4.43Å; L724-M786 HydrophobicContact CD2-CG 4.12Å; F761-M786 HydrophobicContact CE2-CE 3.91Å; F761-M786 HydrophobicContact CZ-CE 4.3Å; G782-M786 WeakPolarHBondContact CA-O 3.36Å; L783-M786 PolarHBondContact N-O 3.45Å; L783-M786 WeakPolarHBondContact O-CB 3.04Å; L783-M786 PolarHBondContact O-N 3.43Å; G784-M786 PolarHBondContact O-N 3Å
787	K	90.3	Very high	90.8	Very high	141 Å²	141	40.6 Å²	40.6	61%	0.613	25%	0.254	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-127.3	161.4	-179	63.3	-175.3	177.1	-173.2	0	112.9	L724 G785	L724-K787 VanDerWaalsContact CD2-C 3.45Å; L724-K787 WeakPolarHBondContact CD2-O 3.38Å; G785-K787 PolarHBondContact O-N 3.39Å
788	H	93.7	Very high	89.8	Confident	8 Å²	8	45 Å²	45	4%	0.037	28%	0.281	C	S	.	.			trans	-71.5	161.1	172.5	65	92.5	0	0	0	111.6	Q693 L695 I778 A781 Q823	Q693-H788 WeakPolarHBondContact O-CB 3.45Å; L695-H788 HydrophobicContact CB-CB 3.93Å; I778-H788 WeakPolarHBondContact CA-NE2 3.36Å; I778-H788 PolarHBondContact O-NE2 2.84Å; A781-H788 PolarHBondContact O-CD2 2.96Å; H788-Q823 PolarHBondContact CE1-OE1 2.92Å; H788-Q823 PolarHBondContact ND1-OE1 2.98Å; H788-Q823 VanDerWaalsContact ND1-OE1 3.14Å; H788-Q823 PolarHBondContact NE2-NE2 3.49Å; H788-Q823 PolarHBondContact NE2-OE1 2.03Å
789	N	92.1	Very high	89.2	Confident	40 Å²	40	45.6 Å²	45.6	21%	0.214	28%	0.283	C	S	.	.			trans	-136.3	-0.6	173.1	70	7.3	0	0	0	112.9	W690 R691 Q693 A824	W690-N789 PolarHBondContact NE1-ND2 2.83Å; R691-N789 PolarHBondContact O-ND2 3.05Å; Q693-N789 PolarHBondContact N-OD1 3.05Å; Q693-N789 PolarHBondContact O-N 3Å; Q693-N789 PolarHBondContact O-OD1 2.78Å; N789-A824 PolarHBondContact O-N 3Å
790	T	94.5	Very high	88.5	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	124.8	-176.2	-53.7	0	0	0	0	108.9	W690 Q693 L694 L695 A824 L826	W690-T790 VanDerWaalsContact CZ2-OG1 3.24Å; W690-T790 WeakPolarHBondContact CZ2-OG1 3.33Å; Q693-T790 PolarHBondContact O-N 3.25Å; L694-T790 CarbonylContact C-O 3.54Å; L694-T790 WeakPolarHBondContact CA-O 3.31Å; L694-T790 HydrophobicContact CD2-CG2 3.72Å; L695-T790 PolarHBondContact N-O 2.97Å; T790-A824 CarbonylContact C-O 3.58Å; T790-A824 VanDerWaalsContact CA-O 3.25Å; T790-A824 WeakPolarHBondContact CA-O 3.48Å; T790-A824 HydrophobicContact CG2-CB 4.11Å; T790-L826 HydrophobicContact CG2-CD1 3.65Å; T790-L826 HydrophobicContact CG2-CG 3.68Å
791	V	96.6	Very high	87.6	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	125.3	175.8	-177.8	0	0	0	0	109.3	L695 L697 I778 V793 T818 Q823 A824 M825 L826	L695-V791 HydrophobicContact CD2-CG2 4.44Å; L695-V791 CarbonylContact O-C 3.49Å; L695-V791 WeakPolarHBondContact O-CA 3.42Å; L697-V791 HydrophobicContact CD1-CG1 3.82Å; L697-V791 HydrophobicContact CG-CG1 4.23Å; I778-V791 HydrophobicContact CG1-CG2 4.41Å; V791-V793 HydrophobicContact CG1-CG2 3.94Å; V791-T818 HydrophobicContact CB-CG2 3.9Å; V791-T818 HydrophobicContact CG2-CG2 3.71Å; V791-Q823 VanDerWaalsContact CG2-OE1 3.27Å; V791-A824 PolarHBondContact N-O 2.85Å; V791-M825 WeakPolarHBondContact O-CA 3.48Å; V791-L826 PolarHBondContact O-N 3.41Å
792	L	96.2	Very high	86.4	Confident	1 Å²	1	50.3 Å²	50.3	1%	0.005	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	121.9	177.2	175.9	63.7	0	0	0	110.2	L695 V696 L697 L711 T715 L826	L695-L792 PolarHBondContact O-N 2.59Å; V696-L792 HydrophobicContact CG1-CD2 4.32Å; V696-L792 HydrophobicContact CG2-CB 4.47Å; V696-L792 HydrophobicContact CG2-CD2 4.21Å; L697-L792 PolarHBondContact N-O 2.76Å; L711-L792 HydrophobicContact CD1-CD1 4.06Å; L711-L792 HydrophobicContact CD1-CD2 4.09Å; L711-L792 HydrophobicContact CD1-CG 3.93Å; L711-L792 HydrophobicContact CD2-CG 4.43Å; L711-L792 HydrophobicContact CG-CD2 4.12Å; L711-L792 HydrophobicContact CG-CG 4.16Å; T715-L792 WeakPolarHBondContact OG1-CD2 3.3Å; L792-L826 WeakPolarHBondContact CA-O 3.3Å; L792-L826 HydrophobicContact CB-CB 4.45Å; L792-L826 HydrophobicContact CD1-CB 3.63Å
793	V	94.6	Very high	85.1	Confident	11 Å²	11	57.5 Å²	57.5	7%	0.067	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	145.6	-174.9	169.4	0	0	0	0	110.1	L697 V791 F811 I814 M825 L826 V827 A828	L697-V793 HydrophobicContact CB-CG2 4.04Å; L697-V793 HydrophobicContact CD1-CG2 3.81Å; L697-V793 HydrophobicContact CG-CG2 4.31Å; V791-V793 HydrophobicContact CG1-CG2 3.94Å; V793-F811 HydrophobicContact CG1-CD2 3.99Å; V793-F811 HydrophobicContact CG1-CE2 3.96Å; V793-I814 HydrophobicContact CG2-CG2 4.2Å; V793-M825 HydrophobicContact CB-CE 4.42Å; V793-M825 HydrophobicContact CG2-CE 4.31Å; V793-L826 PolarHBondContact N-O 2.86Å; V793-V827 WeakPolarHBondContact O-CA 3.4Å; V793-A828 PolarHBondContact O-N 3.07Å
794	G	92.8	Very high	84.2	Confident	15 Å²	15	57.4 Å²	57.4	16%	0.155	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.3	140.7	167.6	0	0	0	0	0	111.7
795	W	91.1	Very high	83.8	Confident	21 Å²	21	58.2 Å²	58.2	8%	0.08	32%	0.319	C	S	.	.			trans	-55.4	136.2	174.8	-177.9	-109.4	0	0	0	111.5	G797 W799 F811 V827 A828 K829 M1098 L1101 E1102 M1113	W795-G797 PolarHBondContact O-N 3.36Å; W795-W799 AromaticContact CZ2-NE1 3.86Å; W795-F811 HydrophobicContact CE3-CE1 4.19Å; W795-F811 AromaticContact CE3-CZ 3.96Å; W795-F811 HydrophobicContact CE3-CZ 3.96Å; W795-F811 AromaticContact CZ3-CE1 3.7Å; W795-F811 HydrophobicContact CZ3-CE1 3.7Å; W795-F811 AromaticContact CZ3-CZ 3.87Å; W795-F811 HydrophobicContact CZ3-CZ 3.87Å; W795-V827 HydrophobicContact CB-CG1 4.42Å; W795-V827 HydrophobicContact CE3-CG1 4.09Å; W795-A828 WeakPolarHBondContact CB-O 3.32Å; W795-A828 PolarHBondContact N-O 3.34Å; W795-K829 HydrophobicContact CB-CB 4.17Å; W795-K829 HydrophobicContact CB-CG 4.22Å; W795-K829 HydrophobicContact CG-CB 4.39Å; W795-K829 HydrophobicContact CG-CG 4.02Å; W795-M1098 HydrophobicContact CH2-CE 3.41Å; W795-M1098 VanDerWaalsContact CH2-CE 3.41Å; W795-M1098 HydrophobicContact CH2-SD 4.01Å; W795-M1098 HydrophobicContact CZ2-CE 3.64Å; W795-M1098 HydrophobicContact CZ3-CE 4.1Å; W795-M1098 HydrophobicContact CZ3-SD 4.45Å; W795-L1101 HydrophobicContact CH2-CB 3.71Å; W795-L1101 HydrophobicContact CH2-CD1 4.08Å; W795-L1101 HydrophobicContact CZ3-CB 4.29Å; W795-L1101 HydrophobicContact CZ3-CD1 4Å; W795-E1102 WeakPolarHBondContact CZ2-OE2 3.43Å; W795-E1102 PolarHBondContact NE1-OE2 3.19Å; W795-M1113 HydrophobicContact CE3-CE 3.64Å; W795-M1113 HydrophobicContact CZ3-CE 3.67Å
796	P	88.3	Confident	83.6	Confident	24 Å²	24	61 Å²	61	16%	0.156	32%	0.323	C	S	.	.			trans	-68.3	90.5	174	29	-35.9	0	0	0	110.7	F811 M1098	P796-F811 HydrophobicContact CG-CB 4.07Å; P796-F811 HydrophobicContact CG-CD1 4.11Å; P796-F811 HydrophobicContact CG-CD2 4.31Å; P796-F811 HydrophobicContact CG-CG 3.9Å; P796-M1098 HydrophobicContact CG-CE 3.9Å
797	G	76.6	Confident	83.1	Confident	51 Å²	51	59.7 Å²	59.7	53%	0.526	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.7	150.8	173.8	0	0	0	0	0	112.2	W795 W799	W795-G797 PolarHBondContact O-N 3.36Å; G797-W799 PolarHBondContact O-N 3.46Å; G797-W799 VanDerWaalsContact O-N 3.12Å
798	T	74	Confident	82.8	Confident	93 Å²	93	53.9 Å²	53.9	57%	0.571	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	16.9	176.2	54.4	0	0	0	0	116.5	K800 Q801 S802	T798-K800 PolarHBondContact O-N 2.96Å; T798-K800 VanDerWaalsContact O-N 3.1Å; T798-Q801 WeakPolarHBondContact O-CA 3.09Å; T798-Q801 PolarHBondContact O-N 3.25Å; T798-S802 PolarHBondContact O-N 3.46Å
799	W	82	Confident	82.5	Confident	13 Å²	13	59 Å²	59	5%	0.049	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.5	-24.8	-176.6	72.3	-91	0	0	0	115.6	W795 G797 S802 W808 M1098 E1099 E1102	W795-W799 AromaticContact CZ2-NE1 3.86Å; G797-W799 PolarHBondContact O-N 3.46Å; G797-W799 VanDerWaalsContact O-N 3.12Å; W799-S802 PolarHBondContact O-OG 3Å; W799-W808 HydrophobicContact CB-CB 4.02Å; W799-W808 HydrophobicContact CB-CG 4.48Å; W799-W808 HydrophobicContact CE3-CB 4.42Å; W799-W808 AromaticContact CE3-CD1 3.96Å; W799-W808 HydrophobicContact CE3-CG 4.09Å; W799-W808 HydrophobicContact CG-CB 4.48Å; W799-M1098 HydrophobicContact CD2-CE 3.99Å; W799-M1098 HydrophobicContact CE3-CB 4.37Å; W799-M1098 HydrophobicContact CG-CE 4.05Å; W799-M1098 HydrophobicContact CH2-CB 3.53Å; W799-M1098 HydrophobicContact CZ2-CB 3.71Å; W799-M1098 HydrophobicContact CZ2-CE 4.44Å; W799-M1098 HydrophobicContact CZ3-CB 3.89Å; W799-E1099 HydrophobicContact CH2-CG 3.85Å; W799-E1102 HydrophobicContact CZ2-CB 4.11Å; W799-E1102 PolarHBondContact NE1-OE2 3.49Å
800	K	77.1	Confident	82.4	Confident	123 Å²	123	58 Å²	58	54%	0.535	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-15.3	172.6	-66.3	-168.5	177.6	-172.3	0	114.2	T798	T798-K800 PolarHBondContact O-N 2.96Å; T798-K800 VanDerWaalsContact O-N 3.1Å
801	Q	72.9	Confident	82.2	Confident	157 Å²	157	58.3 Å²	58.3	73%	0.734	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	-24.3	-174.1	-65.9	174	-11.5	0	0	112.4	T798	T798-Q801 WeakPolarHBondContact O-CA 3.09Å; T798-Q801 PolarHBondContact O-N 3.25Å
802	S	68.4	Low	81.9	Confident	46 Å²	46	58.3 Å²	58.3	32%	0.322	31%	0.31	S	S	.	.			trans	-71.4	128.1	172.6	54.8	0	0	0	0	111.1	T798 W799 D804	T798-S802 PolarHBondContact O-N 3.46Å; W799-S802 PolarHBondContact O-OG 3Å; S802-D804 PolarHBondContact O-N 3.08Å
803	E	61.8	Low	81.7	Confident	193 Å²	193	59.2 Å²	59.2	90%	0.902	31%	0.314	S	S	*	.	S	Bend	trans	-63.5	-22	174.3	-63.8	-171.8	156	0	0	112.8	P805	E803-P805 WeakPolarHBondContact O-CD 3.2Å
804	D	70.4	Confident	81.6	Confident	115 Å²	115	59.4 Å²	59.4	62%	0.615	32%	0.315	S	S	*	.			trans	-78.7	106.4	-179.9	-73.3	-40.9	0	0	0	113.5	S802 Q806 S807	S802-D804 PolarHBondContact O-N 3.08Å; D804-Q806 PolarHBondContact O-N 2.81Å; D804-Q806 VanDerWaalsContact O-N 3.16Å; D804-S807 PolarHBondContact O-OG 3.43Å; D804-S807 VanDerWaalsContact O-OG 3.05Å
805	P	75.7	Confident	81.6	Confident	56 Å²	56	58.7 Å²	58.7	36%	0.364	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.6	-11.4	178.2	-12.9	31.4	0	0	0	112.4	E803 S807 W808 R809	E803-P805 WeakPolarHBondContact O-CD 3.2Å; P805-S807 VanDerWaalsContact C-N 3.3Å; P805-S807 PolarHBondContact O-N 2.81Å; P805-W808 HydrophobicContact CB-CZ2 4.35Å; P805-R809 WeakPolarHBondContact O-CB 3.44Å; P805-R809 VanDerWaalsContact O-CD 3.31Å; P805-R809 WeakPolarHBondContact O-CD 3.37Å; P805-R809 WeakPolarHBondContact O-CG 3.31Å; P805-R809 PolarHBondContact O-N 3.49Å
806	Q	77.1	Confident	81.6	Confident	95 Å²	95	59.4 Å²	59.4	44%	0.444	31%	0.31	S	S	.	.	H	α-helix	trans	-69.7	-28.7	-175.9	-163.9	60.9	31.7	0	0	112.3	D804 N810	D804-Q806 PolarHBondContact O-N 2.81Å; D804-Q806 VanDerWaalsContact O-N 3.16Å; Q806-N810 PolarHBondContact NE2-OD1 3.18Å; Q806-N810 WeakPolarHBondContact O-CB 3.26Å; Q806-N810 PolarHBondContact O-N 2.93Å; Q806-N810 PolarHBondContact O-ND2 2.67Å; Q806-N810 PolarHBondContact O-OD1 3.38Å
807	S	78.1	Confident	81.7	Confident	51 Å²	51	59.5 Å²	59.5	36%	0.357	31%	0.308	S	S	.	.	H	α-helix	trans	-60.7	-55	-176.6	59.9	0	0	0	0	112.7	D804 P805 F811	D804-S807 PolarHBondContact O-OG 3.43Å; D804-S807 VanDerWaalsContact O-OG 3.05Å; P805-S807 VanDerWaalsContact C-N 3.3Å; P805-S807 PolarHBondContact O-N 2.81Å; S807-F811 PolarHBondContact O-N 3.45Å
808	W	85.4	Confident	82.5	Confident	19 Å²	19	57 Å²	57	7%	0.072	28%	0.283	C	S	.	.	H	α-helix	trans	-77.9	-29	179.2	61.1	-98.8	0	0	0	112.9	W799 P805 F811 I812 D1094 E1095 M1098	W799-W808 HydrophobicContact CB-CB 4.02Å; W799-W808 HydrophobicContact CB-CG 4.48Å; W799-W808 HydrophobicContact CE3-CB 4.42Å; W799-W808 AromaticContact CE3-CD1 3.96Å; W799-W808 HydrophobicContact CE3-CG 4.09Å; W799-W808 HydrophobicContact CG-CB 4.48Å; P805-W808 HydrophobicContact CB-CZ2 4.35Å; W808-F811 WeakPolarHBondContact O-CB 3.29Å; W808-F811 PolarHBondContact O-N 2.71Å; W808-I812 HydrophobicContact CE3-CD1 3.62Å; W808-I812 HydrophobicContact CZ3-CD1 3.71Å; W808-I812 WeakPolarHBondContact O-CG1 3.39Å; W808-I812 PolarHBondContact O-N 3.07Å; W808-D1094 HydrophobicContact CZ3-CB 4Å; W808-E1095 HydrophobicContact CH2-CB 3.83Å; W808-E1095 HydrophobicContact CH2-CG 4.33Å; W808-E1095 HydrophobicContact CZ2-CB 4.49Å; W808-E1095 HydrophobicContact CZ3-CB 4.37Å; W808-M1098 HydrophobicContact CB-CE 4.21Å; W808-M1098 HydrophobicContact CB-CG 4.5Å; W808-M1098 HydrophobicContact CE3-CG 3.99Å
809	R	87.8	Confident	83.2	Confident	116 Å²	116	54.5 Å²	54.5	44%	0.438	27%	0.268	S	S	.	.	H	α-helix	trans	-62.3	-42.4	171	-73.7	173.9	-175.7	175.1	1.2	111.8	P805 F811 I812 E813	P805-R809 WeakPolarHBondContact O-CB 3.44Å; P805-R809 VanDerWaalsContact O-CD 3.31Å; P805-R809 WeakPolarHBondContact O-CD 3.37Å; P805-R809 WeakPolarHBondContact O-CG 3.31Å; P805-R809 PolarHBondContact O-N 3.49Å; R809-F811 VanDerWaalsContact C-N 3.29Å; R809-F811 PolarHBondContact O-N 3.12Å; R809-I812 PolarHBondContact O-N 3.42Å; R809-E813 WeakPolarHBondContact O-CG 3.37Å; R809-E813 PolarHBondContact O-N 3.31Å
810	N	88.5	Confident	83.5	Confident	17 Å²	17	59.2 Å²	59.2	9%	0.091	30%	0.298	C	S	.	.	H	α-helix	trans	-59.4	-41.7	173.3	-71.3	-13.3	0	0	0	111	Q806 E813 I814	Q806-N810 PolarHBondContact NE2-OD1 3.18Å; Q806-N810 WeakPolarHBondContact O-CB 3.26Å; Q806-N810 PolarHBondContact O-N 2.93Å; Q806-N810 PolarHBondContact O-ND2 2.67Å; Q806-N810 PolarHBondContact O-OD1 3.38Å; N810-E813 PolarHBondContact O-N 3.34Å; N810-I814 VanDerWaalsContact O-CG1 3.3Å; N810-I814 WeakPolarHBondContact O-CG1 3.42Å; N810-I814 PolarHBondContact O-N 3.31Å
811	F	91.1	Very high	84.1	Confident	7 Å²	7	55.1 Å²	55.1	3%	0.031	29%	0.287	C	S	.	.	H	α-helix	trans	-60.5	-44.8	175.1	173.2	-99.5	0	0	0	112.9	V793 W795 P796 S807 W808 R809 E813 I814 V815 M825 V827 M1084 M1098	V793-F811 HydrophobicContact CG1-CD2 3.99Å; V793-F811 HydrophobicContact CG1-CE2 3.96Å; W795-F811 HydrophobicContact CE3-CE1 4.19Å; W795-F811 AromaticContact CE3-CZ 3.96Å; W795-F811 HydrophobicContact CE3-CZ 3.96Å; W795-F811 AromaticContact CZ3-CE1 3.7Å; W795-F811 HydrophobicContact CZ3-CE1 3.7Å; W795-F811 AromaticContact CZ3-CZ 3.87Å; W795-F811 HydrophobicContact CZ3-CZ 3.87Å; P796-F811 HydrophobicContact CG-CB 4.07Å; P796-F811 HydrophobicContact CG-CD1 4.11Å; P796-F811 HydrophobicContact CG-CD2 4.31Å; P796-F811 HydrophobicContact CG-CG 3.9Å; S807-F811 PolarHBondContact O-N 3.45Å; W808-F811 WeakPolarHBondContact O-CB 3.29Å; W808-F811 PolarHBondContact O-N 2.71Å; R809-F811 VanDerWaalsContact C-N 3.29Å; R809-F811 PolarHBondContact O-N 3.12Å; F811-E813 VanDerWaalsContact C-N 3.34Å; F811-E813 PolarHBondContact O-N 3.12Å; F811-I814 WeakPolarHBondContact O-CB 3.31Å; F811-I814 PolarHBondContact O-N 2.96Å; F811-V815 HydrophobicContact CD1-CG2 4.49Å; F811-V815 HydrophobicContact CE1-CG2 4.08Å; F811-V815 HydrophobicContact CZ-CG2 4.1Å; F811-V815 WeakPolarHBondContact O-CG2 3.48Å; F811-V815 PolarHBondContact O-N 2.92Å; F811-V815 VanDerWaalsContact O-N 3.07Å; F811-M825 HydrophobicContact CE2-CE 4.25Å; F811-V827 HydrophobicContact CE2-CG1 3.87Å; F811-V827 HydrophobicContact CE2-CG2 4.01Å; F811-V827 HydrophobicContact CZ-CG1 3.91Å; F811-V827 HydrophobicContact CZ-CG2 4.07Å; F811-M1084 HydrophobicContact CZ-CE 4.22Å; F811-M1098 HydrophobicContact CD1-CE 4.3Å; F811-M1098 HydrophobicContact CD1-SD 3.7Å; F811-M1098 HydrophobicContact CE1-SD 3.93Å
812	I	90.9	Very high	84.9	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.6	-40	176.8	-63.2	170	0	0	0	111.5	W808 R809 I814 V815 R816 P1087 D1094 Y1097 M1098	W808-I812 HydrophobicContact CE3-CD1 3.62Å; W808-I812 HydrophobicContact CZ3-CD1 3.71Å; W808-I812 WeakPolarHBondContact O-CG1 3.39Å; W808-I812 PolarHBondContact O-N 3.07Å; R809-I812 PolarHBondContact O-N 3.42Å; I812-I814 VanDerWaalsContact C-N 3.33Å; I812-I814 PolarHBondContact O-N 3.1Å; I812-V815 WeakPolarHBondContact O-CB 3.24Å; I812-V815 PolarHBondContact O-N 2.75Å; I812-V815 VanDerWaalsContact O-N 3.17Å; I812-R816 PolarHBondContact O-N 3.25Å; I812-P1087 HydrophobicContact CG2-CB 4.49Å; I812-D1094 HydrophobicContact CD1-CB 3.61Å; I812-D1094 VanDerWaalsContact CD1-O 3.23Å; I812-D1094 WeakPolarHBondContact CD1-O 3.37Å; I812-Y1097 HydrophobicContact CG1-CD1 4.37Å; I812-M1098 HydrophobicContact CD1-CG 3.76Å; I812-M1098 HydrophobicContact CD1-SD 4.48Å; I812-M1098 HydrophobicContact CG1-CG 4.1Å; I812-M1098 HydrophobicContact CG1-SD 4.16Å
813	E	90.4	Very high	86	Confident	20 Å²	20	51.4 Å²	51.4	9%	0.093	27%	0.265	C	S	.	.	H	α-helix	trans	-64.4	-37.6	176	-66.7	-73.9	120.3	0	0	111	R771 R809 N810 F811 V815 R816 E817 R1091	R771-E813 IonicContact CZ-OE2 3.29Å; R771-E813 VanDerWaalsContact CZ-OE2 3.32Å; R771-E813 IonicContact NE-OE2 2.65Å; R771-E813 PolarHBondContact NE-OE2 3.44Å; R771-E813 VanDerWaalsContact NE-OE2 3.08Å; R771-E813 IonicContact NH2-OE2 2.99Å; R771-E813 PolarHBondContact NH2-OE2 3.39Å; R809-E813 WeakPolarHBondContact O-CG 3.37Å; R809-E813 PolarHBondContact O-N 3.31Å; N810-E813 PolarHBondContact O-N 3.34Å; F811-E813 VanDerWaalsContact C-N 3.34Å; F811-E813 PolarHBondContact O-N 3.12Å; E813-V815 VanDerWaalsContact C-N 3.34Å; E813-V815 PolarHBondContact O-N 3.23Å; E813-R816 WeakPolarHBondContact O-CB 3.37Å; E813-R816 PolarHBondContact O-N 3.45Å; E813-R816 VanDerWaalsContact O-N 3.16Å; E813-R816 WeakPolarHBondContact OE1-CD 3.37Å; E813-R816 IonicContact OE1-CZ 3.56Å; E813-R816 IonicContact OE1-NE 2.7Å; E813-R816 IonicContact OE1-NH1 3.98Å; E813-R816 PolarHBondContact OE1-NH1 3.22Å; E813-E817 WeakPolarHBondContact O-CB 3.4Å; E813-E817 VanDerWaalsContact O-CG 3.27Å; E813-E817 WeakPolarHBondContact O-CG 3.3Å; E813-E817 PolarHBondContact O-N 3.35Å; E813-R1091 IonicContact OE1-CZ 3.48Å; E813-R1091 IonicContact OE1-NE 3.78Å; E813-R1091 IonicContact OE1-NH2 2.67Å; E813-R1091 IonicContact OE2-NH2 3.9Å; E813-R1091 PolarHBondContact OE2-NH2 3.37Å
814	I	92.9	Very high	87.5	Confident	15 Å²	15	42.2 Å²	42.2	8%	0.077	22%	0.222	C	C	.	.	H	α-helix	trans	-59	-42.6	170.6	-65.5	165.8	0	0	0	111.6	L697 I774 I778 V793 N810 F811 I812 R816 E817 T818 M825	L697-I814 HydrophobicContact CD1-CG2 4.34Å; I774-I814 HydrophobicContact CD1-CD1 3.92Å; I774-I814 HydrophobicContact CG2-CD1 3.94Å; I774-I814 HydrophobicContact CG2-CG1 3.74Å; I778-I814 HydrophobicContact CD1-CG2 4.08Å; V793-I814 HydrophobicContact CG2-CG2 4.2Å; N810-I814 VanDerWaalsContact O-CG1 3.3Å; N810-I814 WeakPolarHBondContact O-CG1 3.42Å; N810-I814 PolarHBondContact O-N 3.31Å; F811-I814 WeakPolarHBondContact O-CB 3.31Å; F811-I814 PolarHBondContact O-N 2.96Å; I812-I814 VanDerWaalsContact C-N 3.33Å; I812-I814 PolarHBondContact O-N 3.1Å; I814-R816 VanDerWaalsContact C-N 3.34Å; I814-R816 PolarHBondContact O-N 2.98Å; I814-E817 PolarHBondContact O-N 3.18Å; I814-T818 VanDerWaalsContact O-CB 3.27Å; I814-T818 WeakPolarHBondContact O-CB 3.45Å; I814-T818 PolarHBondContact O-N 3.21Å; I814-T818 PolarHBondContact O-OG1 3.19Å; I814-M825 HydrophobicContact CG2-CE 3.77Å
815	V	92.7	Very high	88.6	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-61.5	-43.4	175.9	-177.9	0	0	0	0	110.8	F811 I812 E813 T819 M825 M1084 P1087	F811-V815 HydrophobicContact CD1-CG2 4.49Å; F811-V815 HydrophobicContact CE1-CG2 4.08Å; F811-V815 HydrophobicContact CZ-CG2 4.1Å; F811-V815 WeakPolarHBondContact O-CG2 3.48Å; F811-V815 PolarHBondContact O-N 2.92Å; F811-V815 VanDerWaalsContact O-N 3.07Å; I812-V815 WeakPolarHBondContact O-CB 3.24Å; I812-V815 PolarHBondContact O-N 2.75Å; I812-V815 VanDerWaalsContact O-N 3.17Å; E813-V815 VanDerWaalsContact C-N 3.34Å; E813-V815 PolarHBondContact O-N 3.23Å; V815-T819 WeakPolarHBondContact O-CB 3.09Å; V815-T819 PolarHBondContact O-N 3.18Å; V815-T819 VanDerWaalsContact O-N 3.08Å; V815-T819 PolarHBondContact O-OG1 3.15Å; V815-M825 HydrophobicContact CB-CE 4.44Å; V815-M825 HydrophobicContact CB-SD 4.02Å; V815-M825 HydrophobicContact CG1-SD 4.13Å; V815-M825 HydrophobicContact CG2-CE 3.7Å; V815-M825 HydrophobicContact CG2-SD 3.7Å; V815-M1084 HydrophobicContact CG1-SD 4.16Å; V815-M1084 HydrophobicContact CG2-SD 4.33Å; V815-P1087 HydrophobicContact CG1-CB 4.47Å; V815-P1087 HydrophobicContact CG1-CG 3.92Å
816	R	90.8	Very high	89.6	Confident	36 Å²	36	34.1 Å²	34.1	14%	0.136	18%	0.175	C	C	.	.	H	α-helix	trans	-63.7	-49.2	177.4	-74.1	176.5	167	133.4	7.8	111.8	I812 E813 I814 T819 T820 P1087 P1088 D1094	I812-R816 PolarHBondContact O-N 3.25Å; E813-R816 WeakPolarHBondContact O-CB 3.37Å; E813-R816 PolarHBondContact O-N 3.45Å; E813-R816 VanDerWaalsContact O-N 3.16Å; E813-R816 WeakPolarHBondContact OE1-CD 3.37Å; E813-R816 IonicContact OE1-CZ 3.56Å; E813-R816 IonicContact OE1-NE 2.7Å; E813-R816 IonicContact OE1-NH1 3.98Å; E813-R816 PolarHBondContact OE1-NH1 3.22Å; I814-R816 VanDerWaalsContact C-N 3.34Å; I814-R816 PolarHBondContact O-N 2.98Å; R816-T819 PolarHBondContact O-N 3.23Å; R816-T820 WeakPolarHBondContact O-CB 3.47Å; R816-T820 PolarHBondContact O-N 3.32Å; R816-T820 PolarHBondContact O-OG1 2.71Å; R816-P1087 HydrophobicContact CG-CB 4.44Å; R816-P1087 HydrophobicContact CG-CG 4.1Å; R816-P1088 PolarHBondContact NH2-O 2.94Å; R816-D1094 IonicContact CZ-OD1 3.63Å; R816-D1094 IonicContact CZ-OD2 3.92Å; R816-D1094 IonicContact NH1-OD1 2.7Å; R816-D1094 IonicContact NH1-OD2 2.66Å; R816-D1094 PolarHBondContact NH1-OD2 3.42Å; R816-D1094 IonicContact NH2-OD1 2.9Å; R816-D1094 PolarHBondContact NH2-OD1 3.09Å; R816-D1094 IonicContact NH2-OD2 3.81Å; R816-D1094 PolarHBondContact NH2-OD2 2.89Å
817	E	91.9	Very high	90.5	Very high	26 Å²	26	29.7 Å²	29.7	12%	0.121	16%	0.155	C	C	.	.	H	α-helix	trans	-64	-46	-178	-72	175.9	159.1	0	0	111.3	S775 I778 E813 I814 T819 T820 A821	S775-E817 WeakPolarHBondContact CA-OE2 3.23Å; S775-E817 WeakPolarHBondContact CB-OE1 3.32Å; S775-E817 WeakPolarHBondContact CB-OE2 3.49Å; S775-E817 PolarHBondContact OG-OE1 3.29Å; S775-E817 PolarHBondContact OG-OE2 2.82Å; I778-E817 HydrophobicContact CD1-CB 4.27Å; E813-E817 WeakPolarHBondContact O-CB 3.4Å; E813-E817 VanDerWaalsContact O-CG 3.27Å; E813-E817 WeakPolarHBondContact O-CG 3.3Å; E813-E817 PolarHBondContact O-N 3.35Å; I814-E817 PolarHBondContact O-N 3.18Å; E817-T819 VanDerWaalsContact C-N 3.34Å; E817-T819 PolarHBondContact O-N 2.97Å; E817-T820 PolarHBondContact O-N 3.11Å; E817-A821 VanDerWaalsContact O-CB 3.32Å; E817-A821 WeakPolarHBondContact O-CB 3.47Å; E817-A821 PolarHBondContact O-N 3.31Å
818	T	92.6	Very high	91.3	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-59.6	-43.5	175.4	-53.6	0	0	0	0	111.6	V791 I814 A821 H822 Q823 M825	V791-T818 HydrophobicContact CB-CG2 3.9Å; V791-T818 HydrophobicContact CG2-CG2 3.71Å; I814-T818 VanDerWaalsContact O-CB 3.27Å; I814-T818 WeakPolarHBondContact O-CB 3.45Å; I814-T818 PolarHBondContact O-N 3.21Å; I814-T818 PolarHBondContact O-OG1 3.19Å; T818-A821 PolarHBondContact O-N 3.46Å; T818-H822 PolarHBondContact O-N 3.07Å; T818-Q823 HydrophobicContact CG2-CB 3.88Å; T818-Q823 PolarHBondContact O-N 3.16Å; T818-Q823 VanDerWaalsContact O-N 3.09Å; T818-M825 HydrophobicContact CG2-CB 3.95Å; T818-M825 HydrophobicContact CG2-CG 4.26Å
819	T	88.6	Confident	91.6	Very high	40 Å²	40	27 Å²	27	25%	0.245	14%	0.137	C	C	.	.	H	α-helix	trans	-65.9	-41	177.2	-56	0	0	0	0	111.7	V815 R816 E817 A821 H822 R1115	V815-T819 WeakPolarHBondContact O-CB 3.09Å; V815-T819 PolarHBondContact O-N 3.18Å; V815-T819 VanDerWaalsContact O-N 3.08Å; V815-T819 PolarHBondContact O-OG1 3.15Å; R816-T819 PolarHBondContact O-N 3.23Å; E817-T819 VanDerWaalsContact C-N 3.34Å; E817-T819 PolarHBondContact O-N 2.97Å; T819-A821 VanDerWaalsContact C-N 3.33Å; T819-H822 PolarHBondContact O-N 3.07Å; T819-H822 VanDerWaalsContact O-N 3.11Å; T819-R1115 PolarHBondContact OG1-NE 2.85Å
820	T	89.3	Confident	91.8	Very high	111 Å²	111	24.9 Å²	24.9	68%	0.681	13%	0.134	S	C	*	.	H	α-helix	trans	-68.5	-34.1	178.6	-56.5	0	0	0	0	111.6	R816 E817 H822	R816-T820 WeakPolarHBondContact O-CB 3.47Å; R816-T820 PolarHBondContact O-N 3.32Å; R816-T820 PolarHBondContact O-OG1 2.71Å; E817-T820 PolarHBondContact O-N 3.11Å; T820-H822 PolarHBondContact O-N 2.92Å
821	A	89.6	Confident	91.8	Very high	38 Å²	38	24.4 Å²	24.4	31%	0.314	13%	0.132	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.1	-1.4	172.7	0	0	0	0	0	113.7	I778 E817 T818 T819 Q823	I778-A821 HydrophobicContact CG2-CB 4.2Å; E817-A821 VanDerWaalsContact O-CB 3.32Å; E817-A821 WeakPolarHBondContact O-CB 3.47Å; E817-A821 PolarHBondContact O-N 3.31Å; T818-A821 PolarHBondContact O-N 3.46Å; T819-A821 VanDerWaalsContact C-N 3.33Å; A821-Q823 VanDerWaalsContact C-N 3.26Å; A821-Q823 HydrophobicContact CB-CG 4.03Å; A821-Q823 PolarHBondContact O-N 2.99Å
822	H	88.6	Confident	91.7	Very high	97 Å²	97	28.6 Å²	28.6	45%	0.449	16%	0.155	S	C	.	.	T	Hydrogen-bonded Turn	trans	54.1	39.8	-173.9	-58.9	-71	0	0	0	113.4	T818 T819 T820 R1119	T818-H822 PolarHBondContact O-N 3.07Å; T819-H822 PolarHBondContact O-N 3.07Å; T819-H822 VanDerWaalsContact O-N 3.11Å; T820-H822 PolarHBondContact O-N 2.92Å; H822-R1119 PolarHBondContact CD2-NH2 3.05Å; H822-R1119 PolarHBondContact NE2-NH2 3.48Å
823	Q	91.6	Very high	91.6	Very high	27 Å²	27	30.5 Å²	30.5	13%	0.126	17%	0.168	C	C	.	.			trans	-105.4	150.6	176.5	-64.5	175.1	13	0	0	110	I778 H788 V791 T818 A821 G1117	I778-Q823 PolarHBondContact O-NE2 2.96Å; H788-Q823 PolarHBondContact CE1-OE1 2.92Å; H788-Q823 PolarHBondContact ND1-OE1 2.98Å; H788-Q823 VanDerWaalsContact ND1-OE1 3.14Å; H788-Q823 PolarHBondContact NE2-NE2 3.49Å; H788-Q823 PolarHBondContact NE2-OE1 2.03Å; V791-Q823 VanDerWaalsContact CG2-OE1 3.27Å; T818-Q823 HydrophobicContact CG2-CB 3.88Å; T818-Q823 PolarHBondContact O-N 3.16Å; T818-Q823 VanDerWaalsContact O-N 3.09Å; A821-Q823 VanDerWaalsContact C-N 3.26Å; A821-Q823 HydrophobicContact CB-CG 4.03Å; A821-Q823 PolarHBondContact O-N 2.99Å; Q823-G1117 WeakPolarHBondContact O-CA 3.41Å
824	A	93.1	Very high	91.7	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	152.1	170.3	0	0	0	0	0	110.4	W690 N789 T790 V791 M857 R1115	W690-A824 HydrophobicContact CH2-CB 4.33Å; W690-A824 HydrophobicContact CZ2-CB 3.84Å; N789-A824 PolarHBondContact O-N 3Å; T790-A824 CarbonylContact C-O 3.58Å; T790-A824 VanDerWaalsContact CA-O 3.25Å; T790-A824 WeakPolarHBondContact CA-O 3.48Å; T790-A824 HydrophobicContact CG2-CB 4.11Å; V791-A824 PolarHBondContact N-O 2.85Å; A824-M857 HydrophobicContact CB-CE 4.09Å; A824-M857 HydrophobicContact CB-SD 3.86Å; A824-R1115 CarbonylContact C-O 3.21Å; A824-R1115 VanDerWaalsContact CA-O 3.25Å; A824-R1115 WeakPolarHBondContact CA-O 3.35Å
825	M	94.4	Very high	91.7	Very high	2 Å²	2	29.2 Å²	29.2	1%	0.01	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	136.7	175.3	-162.1	177.7	-175	0	0	110.9	V791 V793 F811 I814 V815 T818 V827 R1115	V791-M825 WeakPolarHBondContact O-CA 3.48Å; V793-M825 HydrophobicContact CB-CE 4.42Å; V793-M825 HydrophobicContact CG2-CE 4.31Å; F811-M825 HydrophobicContact CE2-CE 4.25Å; I814-M825 HydrophobicContact CG2-CE 3.77Å; V815-M825 HydrophobicContact CB-CE 4.44Å; V815-M825 HydrophobicContact CB-SD 4.02Å; V815-M825 HydrophobicContact CG1-SD 4.13Å; V815-M825 HydrophobicContact CG2-CE 3.7Å; V815-M825 HydrophobicContact CG2-SD 3.7Å; T818-M825 HydrophobicContact CG2-CB 3.95Å; T818-M825 HydrophobicContact CG2-CG 4.26Å; M825-V827 HydrophobicContact CE-CG2 3.72Å; M825-V827 HydrophobicContact CG-CG2 4.11Å; M825-V827 HydrophobicContact SD-CG2 4.19Å; M825-R1115 HydrophobicContact CB-CB 4.2Å; M825-R1115 PolarHBondContact N-O 2.9Å; M825-R1115 PolarHBondContact O-N 3.1Å
826	L	96.1	Very high	91.5	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	126.1	174.1	-61.7	-179.9	0	0	0	108.6	L694 L718 T790 V791 L792 V793 L861 L1112 M1113 V1114	L694-L826 HydrophobicContact CD2-CD1 4.06Å; L718-L826 HydrophobicContact CD2-CD1 4.06Å; T790-L826 HydrophobicContact CG2-CD1 3.65Å; T790-L826 HydrophobicContact CG2-CG 3.68Å; V791-L826 PolarHBondContact O-N 3.41Å; L792-L826 WeakPolarHBondContact CA-O 3.3Å; L792-L826 HydrophobicContact CB-CB 4.45Å; L792-L826 HydrophobicContact CD1-CB 3.63Å; V793-L826 PolarHBondContact N-O 2.86Å; L826-L861 HydrophobicContact CD1-CD2 4.3Å; L826-L861 HydrophobicContact CD2-CD1 3.59Å; L826-L1112 HydrophobicContact CB-CD1 4.21Å; L826-M1113 WeakPolarHBondContact CA-O 3.37Å; L826-V1114 HydrophobicContact CD2-CB 4.36Å; L826-V1114 HydrophobicContact CD2-CG1 4.17Å; L826-V1114 HydrophobicContact CD2-CG2 3.93Å
827	V	95.6	Very high	91.2	Very high	1 Å²	1	29.5 Å²	29.5	1%	0.006	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	115.7	178.5	-176.6	0	0	0	0	110.4	V793 W795 F811 M825 M1084 M1113	V793-V827 WeakPolarHBondContact O-CA 3.4Å; W795-V827 HydrophobicContact CB-CG1 4.42Å; W795-V827 HydrophobicContact CE3-CG1 4.09Å; F811-V827 HydrophobicContact CE2-CG1 3.87Å; F811-V827 HydrophobicContact CE2-CG2 4.01Å; F811-V827 HydrophobicContact CZ-CG1 3.91Å; F811-V827 HydrophobicContact CZ-CG2 4.07Å; M825-V827 HydrophobicContact CE-CG2 3.72Å; M825-V827 HydrophobicContact CG-CG2 4.11Å; M825-V827 HydrophobicContact SD-CG2 4.19Å; V827-M1084 HydrophobicContact CB-CE 4.18Å; V827-M1084 HydrophobicContact CG2-CE 3.89Å; V827-M1113 HydrophobicContact CB-CB 4.23Å; V827-M1113 HydrophobicContact CB-CE 4.1Å; V827-M1113 HydrophobicContact CG1-CE 3.91Å; V827-M1113 PolarHBondContact N-O 3.15Å; V827-M1113 PolarHBondContact O-N 3.07Å
828	A	95.1	Very high	90.7	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	118	179	0	0	0	0	0	110.6	L711 L714 V793 W795 V831 F834 L1112	L711-A828 HydrophobicContact CD1-CB 4.03Å; L714-A828 HydrophobicContact CD2-CB 4.1Å; V793-A828 PolarHBondContact O-N 3.07Å; W795-A828 WeakPolarHBondContact CB-O 3.32Å; W795-A828 PolarHBondContact N-O 3.34Å; A828-V831 HydrophobicContact CB-CG2 4.02Å; A828-V831 VanDerWaalsContact O-CG2 3.24Å; A828-V831 WeakPolarHBondContact O-CG2 3.31Å; A828-F834 HydrophobicContact CB-CE2 4.35Å; A828-F834 HydrophobicContact CB-CZ 4.44Å; A828-L1112 HydrophobicContact CB-CD1 4.31Å
829	K	92.8	Very high	90.2	Very high	13 Å²	13	39 Å²	39	6%	0.057	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	145.9	170.6	-168.6	177	-178.5	-179.7	0	109.7	W795 V831 E1102 L1105 V1111	W795-K829 HydrophobicContact CB-CB 4.17Å; W795-K829 HydrophobicContact CB-CG 4.22Å; W795-K829 HydrophobicContact CG-CB 4.39Å; W795-K829 HydrophobicContact CG-CG 4.02Å; K829-V831 PolarHBondContact O-N 3.37Å; K829-E1102 VanDerWaalsContact CE-OE1 3.28Å; K829-E1102 WeakPolarHBondContact CE-OE1 3.26Å; K829-E1102 IonicContact NZ-OE1 3.05Å; K829-E1102 PolarHBondContact NZ-OE1 3.21Å; K829-L1105 HydrophobicContact CD-CB 3.81Å; K829-L1105 HydrophobicContact CD-CD1 3.82Å; K829-L1105 HydrophobicContact CD-CG 4.47Å; K829-L1105 VanDerWaalsContact NZ-CB 3.29Å; K829-L1105 PolarHBondContact NZ-O 3.23Å; K829-V1111 HydrophobicContact CB-CB 4.16Å; K829-V1111 PolarHBondContact N-O 2.56Å
830	N	90.5	Very high	89.9	Confident	72 Å²	72	46.7 Å²	46.7	39%	0.385	24%	0.24	S	C	.	.	S	Bend	trans	54.8	48.3	-178.7	-56.4	-24.9	0	0	0	112.7	D832 S833 N1109	N830-D832 PolarHBondContact O-N 3.44Å; N830-D832 VanDerWaalsContact O-N 3.09Å; N830-S833 WeakPolarHBondContact O-CB 3.35Å; N830-S833 PolarHBondContact O-N 3.28Å; N830-S833 PolarHBondContact O-OG 3.33Å; N830-N1109 WeakPolarHBondContact CB-O 3.4Å; N830-N1109 PolarHBondContact ND2-O 3.09Å
831	V	89.6	Confident	89.6	Confident	8 Å²	8	42.7 Å²	42.7	5%	0.048	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-51.2	-38	-172.4	-171	0	0	0	0	112.7	H708 R710 L711 A828 K829 S833 F834	H708-V831 HydrophobicContact CB-CB 4.44Å; H708-V831 HydrophobicContact CB-CG1 4.15Å; R710-V831 HydrophobicContact CB-CG1 4.05Å; R710-V831 WeakPolarHBondContact CB-O 3.46Å; L711-V831 HydrophobicContact CB-CG1 4.01Å; L711-V831 HydrophobicContact CD1-CG1 4.11Å; A828-V831 HydrophobicContact CB-CG2 4.02Å; A828-V831 VanDerWaalsContact O-CG2 3.24Å; A828-V831 WeakPolarHBondContact O-CG2 3.31Å; K829-V831 PolarHBondContact O-N 3.37Å; V831-S833 PolarHBondContact O-N 3.16Å; V831-F834 WeakPolarHBondContact O-CB 3.4Å; V831-F834 PolarHBondContact O-N 3.49Å; V831-F834 VanDerWaalsContact O-N 3.16Å
832	D	88.8	Confident	89	Confident	95 Å²	95	43 Å²	43	51%	0.508	22%	0.221	S	C	.	.	G	3₁₀ helix	trans	-69.4	-18	-178	-53.2	-49.4	0	0	0	114	H708 N830 F834	H708-D832 IonicContact CE1-OD1 2.68Å; H708-D832 IonicContact CE1-OD2 3.32Å; H708-D832 PolarHBondContact CE1-OD2 3.22Å; H708-D832 IonicContact CG-OD1 2.65Å; H708-D832 VanDerWaalsContact ND1-CG 3.28Å; H708-D832 IonicContact ND1-OD1 3.28Å; H708-D832 PolarHBondContact ND1-OD1 3.41Å; H708-D832 IonicContact ND1-OD2 3.4Å; H708-D832 PolarHBondContact ND1-OD2 2.92Å; N830-D832 PolarHBondContact O-N 3.44Å; N830-D832 VanDerWaalsContact O-N 3.09Å; D832-F834 VanDerWaalsContact C-N 3.33Å
833	S	89.5	Confident	88.7	Confident	39 Å²	39	47.1 Å²	47.1	27%	0.273	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-80.7	-11	175.2	74.4	0	0	0	0	113.7	N830 V831 R1110	N830-S833 WeakPolarHBondContact O-CB 3.35Å; N830-S833 PolarHBondContact O-N 3.28Å; N830-S833 PolarHBondContact O-OG 3.33Å; V831-S833 PolarHBondContact O-N 3.16Å; S833-R1110 PolarHBondContact O-NE 3.37Å; S833-R1110 PolarHBondContact O-NH2 3.44Å
834	F	92.4	Very high	88.5	Confident	5 Å²	5	46.6 Å²	46.6	2%	0.022	24%	0.242	C	C	.	.	S	Bend	trans	-67.7	144.9	179	-84.2	-106.3	0	0	0	111.7	R710 L714 A828 V831 D832 W871 L1079 R1110	R710-F834 HydrophobicContact CB-CB 4.49Å; R710-F834 WeakPolarHBondContact CD-O 3.42Å; L714-F834 HydrophobicContact CD1-CD1 3.91Å; L714-F834 HydrophobicContact CD1-CE1 3.82Å; L714-F834 HydrophobicContact CD2-CD1 4.12Å; L714-F834 HydrophobicContact CD2-CE1 3.81Å; L714-F834 HydrophobicContact CD2-CZ 4.25Å; L714-F834 HydrophobicContact CG-CD1 4.4Å; L714-F834 HydrophobicContact CG-CE1 4.38Å; A828-F834 HydrophobicContact CB-CE2 4.35Å; A828-F834 HydrophobicContact CB-CZ 4.44Å; V831-F834 WeakPolarHBondContact O-CB 3.4Å; V831-F834 PolarHBondContact O-N 3.49Å; V831-F834 VanDerWaalsContact O-N 3.16Å; D832-F834 VanDerWaalsContact C-N 3.33Å; F834-W871 HydrophobicContact CD1-CZ2 4.48Å; F834-L1079 HydrophobicContact CE1-CD1 3.83Å; F834-L1079 HydrophobicContact CZ-CD1 3.77Å; F834-R1110 HydrophobicContact CE2-CB 4.21Å; F834-R1110 HydrophobicContact CZ-CB 4.27Å
835	P	92.1	Very high	88.4	Confident	4 Å²	4	48 Å²	48	3%	0.026	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-64.5	148.7	179.9	28.5	-36.7	0	0	0	112	Q717 D839 L841 V870 W871	Q717-P835 PolarHBondContact NE2-O 3.27Å; P835-D839 WeakPolarHBondContact CA-OD2 3.36Å; P835-D839 HydrophobicContact CB-CB 4.09Å; P835-L841 HydrophobicContact CB-CD2 4.28Å; P835-L841 HydrophobicContact CG-CD1 4.2Å; P835-V870 HydrophobicContact CB-CG1 3.79Å; P835-V870 HydrophobicContact CG-CG1 3.55Å; P835-W871 HydrophobicContact CG-CH2 4.31Å; P835-W871 HydrophobicContact CG-CZ2 3.63Å
836	T	89.3	Confident	88.5	Confident	25 Å²	25	48 Å²	48	15%	0.153	25%	0.251	C	S	.	.	P	Polyproline II helix	trans	-68.4	163.9	170.8	89	0	0	0	0	110.9	R710 Q838 D839	R710-T836 VanDerWaalsContact CZ-CG2 3.4Å; T836-Q838 PolarHBondContact O-N 3.49Å; T836-Q838 VanDerWaalsContact O-N 3.16Å; T836-Q838 PolarHBondContact OG1-N 3.44Å; T836-D839 WeakPolarHBondContact CG2-OD1 3.48Å; T836-D839 WeakPolarHBondContact CG2-OD2 3.34Å; T836-D839 PolarHBondContact N-OD2 3.22Å; T836-D839 PolarHBondContact O-N 3.07Å; T836-D839 PolarHBondContact OG1-N 2.88Å; T836-D839 PolarHBondContact OG1-OD1 3.06Å
837	C	83.8	Confident	88.4	Confident	16 Å²	16	48 Å²	48	11%	0.108	25%	0.251	C	S	.	.	S	Bend	trans	-68.2	-3.3	169.6	-72.3	0	0	0	0	114.2	S713 K869	S713-C837 PolarHBondContact O-SG 2.66Å; S713-C837 VanDerWaalsContact O-SG 3.4Å; C837-K869 WeakPolarHBondContact O-CE 3.38Å; C837-K869 PolarHBondContact O-NZ 2.98Å
838	Q	80.9	Confident	88.4	Confident	160 Å²	160	48 Å²	48	75%	0.748	25%	0.251	S	S	*	.	S	Bend	trans	-95.6	-36.6	174.7	-58.6	-166.1	16.6	0	0	112.3	T836	T836-Q838 PolarHBondContact O-N 3.49Å; T836-Q838 VanDerWaalsContact O-N 3.16Å; T836-Q838 PolarHBondContact OG1-N 3.44Å
839	D	83.4	Confident	88.3	Confident	67 Å²	67	48.1 Å²	48.1	36%	0.358	25%	0.251	S	S	.	.			trans	-55.3	151.9	-177	-52.1	-5.6	0	0	0	111.8	P835 T836 V870	P835-D839 WeakPolarHBondContact CA-OD2 3.36Å; P835-D839 HydrophobicContact CB-CB 4.09Å; T836-D839 WeakPolarHBondContact CG2-OD1 3.48Å; T836-D839 WeakPolarHBondContact CG2-OD2 3.34Å; T836-D839 PolarHBondContact N-OD2 3.22Å; T836-D839 PolarHBondContact O-N 3.07Å; T836-D839 PolarHBondContact OG1-N 2.88Å; T836-D839 PolarHBondContact OG1-OD1 3.06Å; D839-V870 WeakPolarHBondContact O-CG2 3.32Å
840	R	81.3	Confident	88.2	Confident	201 Å²	201	47.7 Å²	47.7	76%	0.758	25%	0.25	S	C	*	.			trans	-124.1	117.7	166.1	-67.1	-176.1	-178.1	-176.4	-0	107
841	L	83.4	Confident	87.9	Confident	26 Å²	26	44.5 Å²	44.5	14%	0.136	23%	0.232	C	C	.	.			trans	-70.4	145.4	170.2	-58.3	174.8	0	0	0	108.2	P835 V870 W871	P835-L841 HydrophobicContact CB-CD2 4.28Å; P835-L841 HydrophobicContact CG-CD1 4.2Å; L841-V870 WeakPolarHBondContact CB-O 3.21Å; L841-V870 HydrophobicContact CD1-CG1 4.2Å; L841-V870 HydrophobicContact CG-CG1 4.12Å; L841-V870 PolarHBondContact N-O 2.94Å; L841-W871 HydrophobicContact CD1-CD2 3.94Å; L841-W871 HydrophobicContact CD1-CE3 3.56Å; L841-W871 HydrophobicContact CD1-CH2 3.86Å; L841-W871 HydrophobicContact CD1-CZ2 4.21Å; L841-W871 HydrophobicContact CD1-CZ3 3.52Å
842	G	76.1	Confident	87.1	Confident	46 Å²	46	44.2 Å²	44.2	47%	0.474	23%	0.231	S	C	.	.			trans	-75.9	-157.1	174.6	0	0	0	0	0	111.8	G844	G842-G844 PolarHBondContact O-N 3.35Å
843	E	82.4	Confident	86.5	Confident	183 Å²	183	41.4 Å²	41.4	86%	0.855	21%	0.214	S	C	*	.	S	Bend	trans	-61.9	135.1	167.7	-64.2	-170.4	173.9	0	0	110.4
844	G	87	Confident	86.1	Confident	16 Å²	16	41 Å²	41	17%	0.165	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-175.8	177.3	-174.5	0	0	0	0	0	111.7	G842 C874 K875	G842-G844 PolarHBondContact O-N 3.35Å; G844-C874 CarbonylContact O-C 3.53Å; G844-C874 VanDerWaalsContact O-CA 3.25Å; G844-C874 WeakPolarHBondContact O-CA 3.47Å; G844-K875 PolarHBondContact O-N 3.41Å
845	T	92.6	Very high	85.5	Confident	30 Å²	30	40.7 Å²	40.7	18%	0.184	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	144.6	178.6	68.1	0	0	0	0	112.5	D847 K875 R877 H1078	T845-D847 VanDerWaalsContact CB-OD1 3.26Å; T845-D847 WeakPolarHBondContact CB-OD1 3.41Å; T845-D847 PolarHBondContact OG1-OD1 3.05Å; T845-K875 CarbonylContact C-O 3.54Å; T845-K875 VanDerWaalsContact CA-O 3.3Å; T845-K875 WeakPolarHBondContact CA-O 3.49Å; T845-R877 HydrophobicContact CG2-CG 4.27Å; T845-H1078 PolarHBondContact O-N 3.49Å
846	I	95	Very high	85.1	Confident	1 Å²	1	41 Å²	41	1%	0.005	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	116.5	160.4	-58.4	168.8	0	0	0	106.2	P862 W871 C874 K875 M876 R877 L1079 L1081	I846-P862 HydrophobicContact CG2-CB 3.97Å; I846-P862 HydrophobicContact CG2-CG 4.36Å; I846-W871 HydrophobicContact CD1-CB 4.4Å; I846-W871 HydrophobicContact CD1-CE3 3.96Å; I846-W871 HydrophobicContact CG1-CE3 4.06Å; I846-W871 HydrophobicContact CG1-CZ3 4.41Å; I846-C874 HydrophobicContact CD1-CB 4.01Å; I846-C874 HydrophobicContact CG1-CB 3.89Å; I846-K875 PolarHBondContact N-O 2.9Å; I846-M876 WeakPolarHBondContact O-CA 3.14Å; I846-R877 PolarHBondContact O-N 3.32Å; I846-L1079 HydrophobicContact CG2-CB 4.38Å; I846-L1079 HydrophobicContact CG2-CD2 4.35Å; I846-L1081 HydrophobicContact CG2-CD1 3.47Å; I846-L1081 VanDerWaalsContact CG2-CD1 3.47Å
847	D	95.6	Very high	85	Confident	0 Å²	0	40 Å²	40	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	127	-174.5	-74.1	10.4	0	0	0	109.8	T845 R877 F879 S1074 A1077 L1079 V1080 L1081	T845-D847 VanDerWaalsContact CB-OD1 3.26Å; T845-D847 WeakPolarHBondContact CB-OD1 3.41Å; T845-D847 PolarHBondContact OG1-OD1 3.05Å; D847-R877 VanDerWaalsContact CG-NH2 3.33Å; D847-R877 IonicContact OD1-CZ 3.14Å; D847-R877 IonicContact OD1-NE 3.78Å; D847-R877 PolarHBondContact OD1-NE 2.89Å; D847-R877 IonicContact OD1-NH2 3.79Å; D847-R877 PolarHBondContact OD1-NH2 3.19Å; D847-R877 IonicContact OD2-CZ 3.09Å; D847-R877 IonicContact OD2-NE 2.83Å; D847-R877 IonicContact OD2-NH2 2.99Å; D847-R877 PolarHBondContact OD2-NH2 3.42Å; D847-F879 HydrophobicContact CB-CD2 4.42Å; D847-F879 HydrophobicContact CB-CE2 3.91Å; D847-S1074 WeakPolarHBondContact OD2-CA 3.31Å; D847-S1074 WeakPolarHBondContact OD2-CB 3.39Å; D847-S1074 PolarHBondContact OD2-OG 3.37Å; D847-A1077 HydrophobicContact CB-CB 4.09Å; D847-A1077 WeakPolarHBondContact OD2-CB 3.29Å; D847-L1079 PolarHBondContact N-O 3.03Å; D847-V1080 CarbonylContact O-C 3.58Å; D847-V1080 WeakPolarHBondContact O-CA 3.43Å; D847-L1081 PolarHBondContact O-N 2.69Å
848	V	95.1	Very high	85.2	Confident	1 Å²	1	39.3 Å²	39.3	1%	0.006	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	110.3	-175.1	-173.4	0	0	0	0	109.3	L858 P862 M876 R877 I878 F879	V848-L858 HydrophobicContact CG1-CB 3.88Å; V848-L858 HydrophobicContact CG1-CD2 4.36Å; V848-L858 WeakPolarHBondContact CG1-O 3.49Å; V848-P862 HydrophobicContact CG2-CB 4.32Å; V848-P862 HydrophobicContact CG2-CG 3.55Å; V848-M876 HydrophobicContact CG2-CG 4.35Å; V848-R877 PolarHBondContact N-O 2.95Å; V848-I878 HydrophobicContact CB-CG1 4.35Å; V848-F879 PolarHBondContact O-N 2.89Å
849	W	93.5	Very high	85.6	Confident	2 Å²	2	31.9 Å²	31.9	1%	0.008	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	105.5	175.6	-74.6	84.6	0	0	0	110.3	F879 V881 V911 V1069 V1070 K1073 S1074 L1081 L1082	W849-F879 HydrophobicContact CD2-CB 3.69Å; W849-F879 HydrophobicContact CD2-CD2 4.24Å; W849-F879 HydrophobicContact CD2-CG 4.18Å; W849-F879 AromaticContact CE2-CD2 3.67Å; W849-F879 AromaticContact CE2-CG 3.78Å; W849-F879 HydrophobicContact CE3-CB 3.7Å; W849-F879 HydrophobicContact CG-CB 4.31Å; W849-F879 HydrophobicContact CG-CD2 4.5Å; W849-F879 HydrophobicContact CH2-CB 4.01Å; W849-F879 HydrophobicContact CH2-CD1 4.35Å; W849-F879 HydrophobicContact CH2-CG 4.12Å; W849-F879 HydrophobicContact CZ2-CB 3.98Å; W849-F879 HydrophobicContact CZ2-CD1 4.16Å; W849-F879 AromaticContact CZ2-CD2 3.95Å; W849-F879 HydrophobicContact CZ2-CD2 3.95Å; W849-F879 AromaticContact CZ2-CG 3.75Å; W849-F879 HydrophobicContact CZ2-CG 3.75Å; W849-F879 HydrophobicContact CZ3-CB 3.88Å; W849-F879 HydrophobicContact CZ3-CG 4.49Å; W849-F879 AromaticContact NE1-CD2 3.61Å; W849-V881 HydrophobicContact CE3-CG2 4.39Å; W849-V911 HydrophobicContact CH2-CG2 4.27Å; W849-V911 HydrophobicContact CZ3-CG2 4.22Å; W849-V1069 HydrophobicContact CH2-CG1 3.88Å; W849-V1069 HydrophobicContact CZ3-CG1 4.19Å; W849-V1070 HydrophobicContact CD2-CG2 3.76Å; W849-V1070 HydrophobicContact CE3-CG2 3.89Å; W849-V1070 HydrophobicContact CG-CG2 4.28Å; W849-V1070 HydrophobicContact CH2-CG2 4.25Å; W849-V1070 HydrophobicContact CZ2-CB 4.33Å; W849-V1070 HydrophobicContact CZ2-CG2 4.13Å; W849-V1070 HydrophobicContact CZ3-CG2 4.13Å; W849-K1073 HydrophobicContact CH2-CD 4.27Å; W849-K1073 HydrophobicContact CZ2-CB 4.06Å; W849-K1073 HydrophobicContact CZ2-CD 4.43Å; W849-S1074 PolarHBondContact NE1-OG 2.7Å; W849-L1081 PolarHBondContact N-O 2.99Å; W849-L1082 HydrophobicContact CB-CB 3.99Å
850	W	90.2	Very high	85.8	Confident	5 Å²	5	28.7 Å²	28.7	2%	0.019	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	100.4	175.7	175.5	17.8	0	0	0	110.2	V852 H853 L858 M859 F879 T880 V881 L895 I950 T954	W850-V852 PolarHBondContact NE1-O 3Å; W850-H853 PolarHBondContact NE1-O 3.42Å; W850-L858 HydrophobicContact CB-CD1 4.07Å; W850-L858 HydrophobicContact CG-CD1 4.28Å; W850-M859 HydrophobicContact CE3-CE 3.7Å; W850-M859 HydrophobicContact CZ3-CE 3.76Å; W850-F879 PolarHBondContact N-O 3.44Å; W850-T880 HydrophobicContact CB-CG2 4.31Å; W850-T880 HydrophobicContact CD2-CG2 4.26Å; W850-T880 HydrophobicContact CE3-CG2 3.55Å; W850-T880 HydrophobicContact CZ3-CG2 4.26Å; W850-V881 PolarHBondContact O-N 3.34Å; W850-V881 VanDerWaalsContact O-N 3.1Å; W850-L895 HydrophobicContact CH2-CD2 4.26Å; W850-L895 HydrophobicContact CZ3-CD2 3.62Å; W850-I950 HydrophobicContact CH2-CD1 4.09Å; W850-I950 HydrophobicContact CH2-CG1 4Å; W850-I950 HydrophobicContact CH2-CG2 4.11Å; W850-I950 HydrophobicContact CZ3-CD1 3.7Å; W850-I950 HydrophobicContact CZ3-CG1 4.11Å; W850-T954 HydrophobicContact CH2-CG2 3.33Å; W850-T954 WeakPolarHBondContact CH2-OG1 2.96Å; W850-T954 HydrophobicContact CZ2-CG2 4Å; W850-T954 WeakPolarHBondContact CZ2-OG1 3.49Å; W850-T954 HydrophobicContact CZ3-CG2 3.94Å
851	V	83	Confident	86.4	Confident	4 Å²	4	19.2 Å²	19.2	2%	0.024	11%	0.113	C	C	.	.			trans	-99.8	92.2	175.4	-166.1	0	0	0	0	109.4	H853 V881 I918 F921 N1083	V851-H853 PolarHBondContact O-N 3.47Å; V851-V881 HydrophobicContact CG1-CB 4.41Å; V851-V881 HydrophobicContact CG1-CG2 4.43Å; V851-V881 HydrophobicContact CG2-CG2 3.95Å; V851-I918 HydrophobicContact CG1-CG2 4.47Å; V851-F921 HydrophobicContact CB-CD1 4.42Å; V851-F921 HydrophobicContact CB-CG 4.38Å; V851-F921 HydrophobicContact CG1-CB 4.02Å; V851-F921 HydrophobicContact CG1-CD1 4.31Å; V851-F921 HydrophobicContact CG1-CD2 3.79Å; V851-F921 HydrophobicContact CG1-CE2 4.32Å; V851-F921 HydrophobicContact CG1-CG 3.78Å; V851-N1083 VanDerWaalsContact CB-OD1 3.23Å; V851-N1083 WeakPolarHBondContact CB-OD1 3.47Å; V851-N1083 WeakPolarHBondContact CG2-OD1 3.46Å; V851-N1083 PolarHBondContact N-OD1 2.63Å; V851-N1083 PolarHBondContact O-ND2 2.7Å
852	V	73.6	Confident	86.8	Confident	2 Å²	2	18 Å²	18	1%	0.012	11%	0.107	C	C	.	.	S	Bend	trans	69.4	-48.9	173.8	-170.3	0	0	0	0	116.3	W850 T922 K925 Q951	W850-V852 PolarHBondContact NE1-O 3Å; V852-T922 HydrophobicContact CG2-CG2 4.22Å; V852-K925 HydrophobicContact CG1-CD 3.67Å; V852-K925 HydrophobicContact CG1-CG 3.9Å; V852-Q951 PolarHBondContact O-NE2 3.09Å
853	H	76.5	Confident	87.4	Confident	36 Å²	36	17.3 Å²	17.3	17%	0.167	9%	0.091	C	C	.	.	S	Bend	trans	-118.3	168.2	-167.6	-66.3	-58.7	0	0	0	114.1	W850 V851 G855 K925	W850-H853 PolarHBondContact NE1-O 3.42Å; V851-H853 PolarHBondContact O-N 3.47Å; H853-G855 PolarHBondContact O-N 3.4Å; H853-G855 VanDerWaalsContact O-N 3.12Å; H853-K925 WeakPolarHBondContact NE2-CA 3.41Å
854	D	80.6	Confident	87.8	Confident	30 Å²	30	9.8 Å²	9.8	16%	0.16	6%	0.057	C	C	.	.			trans	58.7	19.6	172.5	-57.4	-29.4	0	0	0	117.3	G856 M857 L858 G1116	D854-G856 VanDerWaalsContact C-N 3.31Å; D854-G856 PolarHBondContact O-N 2.67Å; D854-G856 VanDerWaalsContact O-N 3.12Å; D854-M857 PolarHBondContact O-N 2.74Å; D854-L858 PolarHBondContact O-N 3.08Å; D854-L858 VanDerWaalsContact O-N 3.09Å; D854-G1116 PolarHBondContact OD2-N 3.13Å
855	G	79.9	Confident	88.1	Confident	0 Å²	0	9.3 Å²	9.3	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-52	-41	-172.5	0	0	0	0	0	115	H853 M857 L858 M859	H853-G855 PolarHBondContact O-N 3.4Å; H853-G855 VanDerWaalsContact O-N 3.12Å; G855-M857 PolarHBondContact O-N 2.96Å; G855-L858 PolarHBondContact O-N 2.94Å; G855-M859 WeakPolarHBondContact O-CG 3.45Å; G855-M859 PolarHBondContact O-N 2.86Å; G855-M859 VanDerWaalsContact O-N 3.1Å
856	G	83.1	Confident	88	Confident	10 Å²	10	10.5 Å²	10.5	10%	0.103	5%	0.051	C	C	.	.	H	α-helix	trans	-63.8	-40.2	179.5	0	0	0	0	0	113.8	D854 M859 L860 I1122 Y1125	D854-G856 VanDerWaalsContact C-N 3.31Å; D854-G856 PolarHBondContact O-N 2.67Å; D854-G856 VanDerWaalsContact O-N 3.12Å; G856-M859 PolarHBondContact O-N 3.15Å; G856-L860 WeakPolarHBondContact O-CB 3.16Å; G856-L860 PolarHBondContact O-N 2.91Å; G856-I1122 VanDerWaalsContact C-CD1 3.48Å; G856-I1122 WeakPolarHBondContact O-CD1 3.47Å; G856-Y1125 WeakPolarHBondContact CA-OH 3.21Å
857	M	87.2	Confident	87.7	Confident	5 Å²	5	14.8 Å²	14.8	3%	0.025	7%	0.071	C	C	.	.	H	α-helix	trans	-74.1	-39.1	177.8	177.1	168.3	47.1	0	0	111.3	W690 A824 D854 G855 M859 L860 L861 V1114 G1116 I1122	W690-M857 HydrophobicContact CH2-CG 4.2Å; W690-M857 HydrophobicContact CH2-SD 3.47Å; W690-M857 WeakPolarHBondContact CH2-SD 3.39Å; W690-M857 HydrophobicContact CZ2-SD 4.12Å; W690-M857 HydrophobicContact CZ3-CG 4.03Å; W690-M857 HydrophobicContact CZ3-SD 3.9Å; A824-M857 HydrophobicContact CB-CE 4.09Å; A824-M857 HydrophobicContact CB-SD 3.86Å; D854-M857 PolarHBondContact O-N 2.74Å; G855-M857 PolarHBondContact O-N 2.96Å; M857-M859 PolarHBondContact O-N 2.81Å; M857-L860 PolarHBondContact O-N 3.44Å; M857-L861 HydrophobicContact CG-CD1 3.69Å; M857-L861 HydrophobicContact CG-CG 4.04Å; M857-L861 WeakPolarHBondContact O-CG 3.47Å; M857-L861 PolarHBondContact O-N 3.28Å; M857-L861 HydrophobicContact SD-CD1 4.36Å; M857-V1114 HydrophobicContact CE-CG1 3.57Å; M857-V1114 HydrophobicContact CG-CG1 4Å; M857-V1114 HydrophobicContact SD-CG1 4.03Å; M857-G1116 VanDerWaalsContact CE-CA 3.48Å; M857-I1122 HydrophobicContact CB-CD1 4.47Å
858	L	89.4	Confident	87.4	Confident	1 Å²	1	16 Å²	16	1%	0.005	8%	0.077	C	C	.	.	H	α-helix	trans	-58.2	-28.2	173.7	-79	167.4	0	0	0	113	V848 W850 D854 G855 P862 L1081 N1083 V1114	V848-L858 HydrophobicContact CG1-CB 3.88Å; V848-L858 HydrophobicContact CG1-CD2 4.36Å; V848-L858 WeakPolarHBondContact CG1-O 3.49Å; W850-L858 HydrophobicContact CB-CD1 4.07Å; W850-L858 HydrophobicContact CG-CD1 4.28Å; D854-L858 PolarHBondContact O-N 3.08Å; D854-L858 VanDerWaalsContact O-N 3.09Å; G855-L858 PolarHBondContact O-N 2.94Å; L858-P862 WeakPolarHBondContact O-CD 3.48Å; L858-P862 WeakPolarHBondContact O-CG 3.43Å; L858-L1081 HydrophobicContact CD2-CB 4.25Å; L858-N1083 HydrophobicContact CD1-CB 4.3Å; L858-V1114 HydrophobicContact CD2-CB 3.93Å; L858-V1114 HydrophobicContact CD2-CG1 4.28Å; L858-V1114 HydrophobicContact CD2-CG2 4.02Å
859	M	87.9	Confident	87.2	Confident	3 Å²	3	21 Å²	21	2%	0.015	10%	0.098	C	C	.	.	H	α-helix	trans	-88.6	-32.9	173.8	-65	-170.1	-168.2	0	0	113.6	W850 G855 G856 M857 F863 I878 L899 I950 Y1125	W850-M859 HydrophobicContact CE3-CE 3.7Å; W850-M859 HydrophobicContact CZ3-CE 3.76Å; G855-M859 WeakPolarHBondContact O-CG 3.45Å; G855-M859 PolarHBondContact O-N 2.86Å; G855-M859 VanDerWaalsContact O-N 3.1Å; G856-M859 PolarHBondContact O-N 3.15Å; M857-M859 PolarHBondContact O-N 2.81Å; M859-F863 WeakPolarHBondContact O-CB 3.27Å; M859-F863 PolarHBondContact O-N 3.22Å; M859-I878 HydrophobicContact CE-CD1 3.85Å; M859-I878 HydrophobicContact CE-CG2 3.87Å; M859-I878 HydrophobicContact CG-CD1 4.1Å; M859-I878 HydrophobicContact SD-CD1 3.92Å; M859-L899 HydrophobicContact SD-CD2 3.92Å; M859-I950 HydrophobicContact CE-CD1 3.23Å; M859-I950 HydrophobicContact SD-CD1 3.33Å; M859-I950 WeakPolarHBondContact SD-CD1 3.5Å; M859-Y1125 HydrophobicContact CB-CE1 4.17Å
860	L	89.4	Confident	87.1	Confident	0 Å²	0	21 Å²	21	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-67.9	-40.2	178.4	-177.9	64.4	0	0	0	112.4	W690 G856 M857 F863 L864 I1122 Y1125	W690-L860 HydrophobicContact CE3-CD2 3.83Å; W690-L860 HydrophobicContact CZ3-CD2 4.06Å; G856-L860 WeakPolarHBondContact O-CB 3.16Å; G856-L860 PolarHBondContact O-N 2.91Å; M857-L860 PolarHBondContact O-N 3.44Å; L860-F863 HydrophobicContact CD1-CD1 4.37Å; L860-F863 PolarHBondContact O-N 3.01Å; L860-L864 HydrophobicContact CD1-CD1 4.14Å; L860-L864 HydrophobicContact CD1-CD2 4.48Å; L860-L864 HydrophobicContact CD1-CG 4.05Å; L860-L864 HydrophobicContact CD2-CD1 4.43Å; L860-L864 HydrophobicContact CG-CD1 3.9Å; L860-L864 HydrophobicContact CG-CG 4.23Å; L860-L864 VanDerWaalsContact O-CG 3.31Å; L860-L864 WeakPolarHBondContact O-CG 3.22Å; L860-L864 PolarHBondContact O-N 3.29Å; L860-I1122 HydrophobicContact CB-CD1 4.06Å; L860-I1122 HydrophobicContact CD2-CD1 3.75Å; L860-I1122 HydrophobicContact CD2-CG1 4.28Å; L860-I1122 HydrophobicContact CD2-CG2 4.48Å; L860-Y1125 HydrophobicContact CB-CD1 4.34Å; L860-Y1125 HydrophobicContact CB-CE1 4.08Å; L860-Y1125 HydrophobicContact CD1-CD1 4.06Å
861	L	92.1	Very high	87.2	Confident	2 Å²	2	20.7 Å²	20.7	1%	0.01	10%	0.097	C	C	.	.	H	α-helix	trans	-64.6	-50	-175.2	-65.5	165.3	0	0	0	113.4	P692 L718 L826 M857 F863 L864 L865 L1081 V1114	P692-L861 HydrophobicContact CG-CD2 4.43Å; L718-L861 HydrophobicContact CD1-CD2 4.01Å; L718-L861 HydrophobicContact CD2-CD2 4.08Å; L826-L861 HydrophobicContact CD1-CD2 4.3Å; L826-L861 HydrophobicContact CD2-CD1 3.59Å; M857-L861 HydrophobicContact CG-CD1 3.69Å; M857-L861 HydrophobicContact CG-CG 4.04Å; M857-L861 WeakPolarHBondContact O-CG 3.47Å; M857-L861 PolarHBondContact O-N 3.28Å; M857-L861 HydrophobicContact SD-CD1 4.36Å; L861-F863 VanDerWaalsContact C-N 3.32Å; L861-F863 PolarHBondContact O-N 3.39Å; L861-L864 PolarHBondContact O-N 3.36Å; L861-L865 WeakPolarHBondContact O-CB 3.48Å; L861-L865 PolarHBondContact O-N 2.92Å; L861-L1081 HydrophobicContact CB-CD2 3.99Å; L861-V1114 HydrophobicContact CD1-CB 4.49Å; L861-V1114 HydrophobicContact CD1-CG1 3.84Å; L861-V1114 HydrophobicContact CD1-CG2 3.74Å
862	P	92	Very high	87.4	Confident	1 Å²	1	22.5 Å²	22.5	1%	0.006	12%	0.117	C	C	.	.	H	α-helix	trans	-62.1	-39	174.3	-21.3	32.5	0	0	0	112.6	I846 V848 L858 L865 R866 M876 L1081	I846-P862 HydrophobicContact CG2-CB 3.97Å; I846-P862 HydrophobicContact CG2-CG 4.36Å; V848-P862 HydrophobicContact CG2-CB 4.32Å; V848-P862 HydrophobicContact CG2-CG 3.55Å; L858-P862 WeakPolarHBondContact O-CD 3.48Å; L858-P862 WeakPolarHBondContact O-CG 3.43Å; P862-L865 PolarHBondContact O-N 3.26Å; P862-R866 WeakPolarHBondContact O-CB 3.36Å; P862-R866 PolarHBondContact O-N 3.38Å; P862-M876 HydrophobicContact CB-SD 3.67Å; P862-M876 HydrophobicContact CG-SD 4.3Å; P862-L1081 HydrophobicContact CG-CD1 3.97Å; P862-L1081 HydrophobicContact CG-CD2 3.71Å; P862-L1081 HydrophobicContact CG-CG 4.44Å
863	F	89.8	Confident	88.1	Confident	31 Å²	31	29.2 Å²	29.2	14%	0.136	15%	0.15	C	C	.	.	H	α-helix	trans	-61.5	-48	178.6	169.6	-100.9	0	0	0	111.4	M859 L860 L861 L865 R866 Q867 L904 S1126	M859-F863 WeakPolarHBondContact O-CB 3.27Å; M859-F863 PolarHBondContact O-N 3.22Å; L860-F863 HydrophobicContact CD1-CD1 4.37Å; L860-F863 PolarHBondContact O-N 3.01Å; L861-F863 VanDerWaalsContact C-N 3.32Å; L861-F863 PolarHBondContact O-N 3.39Å; F863-L865 VanDerWaalsContact C-N 3.33Å; F863-L865 PolarHBondContact O-N 3.45Å; F863-R866 PolarHBondContact O-N 3.04Å; F863-Q867 VanDerWaalsContact CE1-NE2 3.26Å; F863-Q867 PolarHBondContact O-N 2.86Å; F863-L904 HydrophobicContact CB-CD2 4.24Å; F863-L904 HydrophobicContact CD2-CD2 3.2Å; F863-L904 HydrophobicContact CE2-CD2 3.6Å; F863-L904 HydrophobicContact CG-CD2 3.78Å; F863-L904 HydrophobicContact CZ-CD2 4.47Å; F863-S1126 VanDerWaalsContact CE1-C 3.43Å; F863-S1126 WeakPolarHBondContact CE1-O 3.46Å; F863-S1126 WeakPolarHBondContact CZ-OXT 3.42Å
864	L	91.1	Very high	88.8	Confident	26 Å²	26	27.7 Å²	27.7	14%	0.136	14%	0.143	C	C	.	.	H	α-helix	trans	-60.9	-42	173.5	-70.5	175.1	0	0	0	111.7	P692 L718 L860 L861 R866 Q867	P692-L864 HydrophobicContact CG-CD1 4.03Å; L718-L864 HydrophobicContact CD1-CB 4.16Å; L860-L864 HydrophobicContact CD1-CD1 4.14Å; L860-L864 HydrophobicContact CD1-CD2 4.48Å; L860-L864 HydrophobicContact CD1-CG 4.05Å; L860-L864 HydrophobicContact CD2-CD1 4.43Å; L860-L864 HydrophobicContact CG-CD1 3.9Å; L860-L864 HydrophobicContact CG-CG 4.23Å; L860-L864 VanDerWaalsContact O-CG 3.31Å; L860-L864 WeakPolarHBondContact O-CG 3.22Å; L860-L864 PolarHBondContact O-N 3.29Å; L861-L864 PolarHBondContact O-N 3.36Å; L864-R866 PolarHBondContact O-N 2.69Å; L864-Q867 WeakPolarHBondContact O-CB 3.48Å; L864-Q867 PolarHBondContact O-N 2.7Å
865	L	91.6	Very high	89.3	Confident	5 Å²	5	32.6 Å²	32.6	3%	0.026	16%	0.163	C	C	.	.	H	α-helix	trans	-64.3	-40	-179.8	-160.7	71.1	0	0	0	111.9	L714 Q717 L718 L861 P862 F863 Q867 H868 W871 L1079	L714-L865 HydrophobicContact CD1-CD1 4.26Å; Q717-L865 HydrophobicContact CB-CD1 3.99Å; L718-L865 HydrophobicContact CB-CD1 4.25Å; L718-L865 HydrophobicContact CD1-CD1 4.45Å; L861-L865 WeakPolarHBondContact O-CB 3.48Å; L861-L865 PolarHBondContact O-N 2.92Å; P862-L865 PolarHBondContact O-N 3.26Å; F863-L865 VanDerWaalsContact C-N 3.33Å; F863-L865 PolarHBondContact O-N 3.45Å; L865-Q867 PolarHBondContact O-N 3.47Å; L865-H868 WeakPolarHBondContact O-CB 3.29Å; L865-H868 PolarHBondContact O-N 3.47Å; L865-W871 HydrophobicContact CD2-CD2 3.79Å; L865-W871 HydrophobicContact CD2-CE3 4.3Å; L865-W871 HydrophobicContact CD2-CG 4.04Å; L865-W871 HydrophobicContact CD2-CZ2 4.15Å; L865-W871 HydrophobicContact CG-CB 4.43Å; L865-W871 HydrophobicContact CG-CD2 4.1Å; L865-W871 HydrophobicContact CG-CG 3.8Å; L865-L1079 HydrophobicContact CD2-CD2 3.48Å; L865-L1079 VanDerWaalsContact CD2-CD2 3.48Å
866	R	91	Very high	89.9	Confident	56 Å²	56	32.9 Å²	32.9	21%	0.211	16%	0.164	C	C	.	.	H	α-helix	trans	-65.8	-21.5	177.1	-164.9	171.5	78.8	-172.4	8.7	113.3	P862 F863 L864 H868 G872 C874 D905	P862-R866 WeakPolarHBondContact O-CB 3.36Å; P862-R866 PolarHBondContact O-N 3.38Å; F863-R866 PolarHBondContact O-N 3.04Å; L864-R866 PolarHBondContact O-N 2.69Å; R866-H868 PolarHBondContact O-N 2.97Å; R866-G872 VanDerWaalsContact O-CA 3.31Å; R866-G872 WeakPolarHBondContact O-CA 3.18Å; R866-C874 WeakPolarHBondContact CD-O 3.44Å; R866-D905 PolarHBondContact NH1-O 3.19Å; R866-D905 PolarHBondContact NH2-O 3.16Å
867	Q	88.3	Confident	90.4	Very high	91 Å²	91	35.3 Å²	35.3	43%	0.425	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.4	-18.5	170.7	-60.9	-177.2	8.3	0	0	112.5	F863 L864 L865 S1126	F863-Q867 VanDerWaalsContact CE1-NE2 3.26Å; F863-Q867 PolarHBondContact O-N 2.86Å; L864-Q867 WeakPolarHBondContact O-CB 3.48Å; L864-Q867 PolarHBondContact O-N 2.7Å; L865-Q867 PolarHBondContact O-N 3.47Å; Q867-S1126 PolarHBondContact NE2-O 2.97Å; Q867-S1126 VanDerWaalsContact NE2-O 3.09Å; Q867-S1126 PolarHBondContact NE2-OXT 3.38Å; Q867-S1126 VanDerWaalsContact NE2-OXT 3.14Å
868	H	90.3	Very high	90.7	Very high	25 Å²	25	35.1 Å²	35.1	12%	0.116	17%	0.169	C	C	.	.	S	Bend	trans	-86.9	140.2	178.7	-169.6	-99.2	0	0	0	112.4	Q717 L865 R866 V870 W871 G872	Q717-H868 WeakPolarHBondContact O-CB 3.27Å; L865-H868 WeakPolarHBondContact O-CB 3.29Å; L865-H868 PolarHBondContact O-N 3.47Å; R866-H868 PolarHBondContact O-N 2.97Å; H868-V870 WeakPolarHBondContact CE1-CG2 3.49Å; H868-V870 VanDerWaalsContact ND1-CG2 3.31Å; H868-V870 WeakPolarHBondContact ND1-CG2 3.35Å; H868-V870 PolarHBondContact ND1-N 3.3Å; H868-V870 PolarHBondContact O-N 3.3Å; H868-W871 PolarHBondContact O-N 3.43Å; H868-G872 PolarHBondContact O-N 3.03Å; H868-G872 VanDerWaalsContact O-N 3.14Å
869	K	90.4	Very high	90.9	Very high	106 Å²	106	35.3 Å²	35.3	46%	0.461	17%	0.17	S	C	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-16.7	-176.7	62	155.8	-172.4	156.8	0	116.9	C837	C837-K869 WeakPolarHBondContact O-CE 3.38Å; C837-K869 PolarHBondContact O-NZ 2.98Å
870	V	92	Very high	91	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.006	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.4	-37.2	178.5	173.2	0	0	0	0	110.7	Q717 P835 D839 L841 H868	Q717-V870 HydrophobicContact CG-CG2 4.3Å; P835-V870 HydrophobicContact CB-CG1 3.79Å; P835-V870 HydrophobicContact CG-CG1 3.55Å; D839-V870 WeakPolarHBondContact O-CG2 3.32Å; L841-V870 WeakPolarHBondContact CB-O 3.21Å; L841-V870 HydrophobicContact CD1-CG1 4.2Å; L841-V870 HydrophobicContact CG-CG1 4.12Å; L841-V870 PolarHBondContact N-O 2.94Å; H868-V870 WeakPolarHBondContact CE1-CG2 3.49Å; H868-V870 VanDerWaalsContact ND1-CG2 3.31Å; H868-V870 WeakPolarHBondContact ND1-CG2 3.35Å; H868-V870 PolarHBondContact ND1-N 3.3Å; H868-V870 PolarHBondContact O-N 3.3Å
871	W	92.2	Very high	90.8	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-2.4	-168.9	-58.2	94.9	0	0	0	113.4	F834 P835 L841 I846 L865 H868 M873 C874 H1078 L1079	F834-W871 HydrophobicContact CD1-CZ2 4.48Å; P835-W871 HydrophobicContact CG-CH2 4.31Å; P835-W871 HydrophobicContact CG-CZ2 3.63Å; L841-W871 HydrophobicContact CD1-CD2 3.94Å; L841-W871 HydrophobicContact CD1-CE3 3.56Å; L841-W871 HydrophobicContact CD1-CH2 3.86Å; L841-W871 HydrophobicContact CD1-CZ2 4.21Å; L841-W871 HydrophobicContact CD1-CZ3 3.52Å; I846-W871 HydrophobicContact CD1-CB 4.4Å; I846-W871 HydrophobicContact CD1-CE3 3.96Å; I846-W871 HydrophobicContact CG1-CE3 4.06Å; I846-W871 HydrophobicContact CG1-CZ3 4.41Å; L865-W871 HydrophobicContact CD2-CD2 3.79Å; L865-W871 HydrophobicContact CD2-CE3 4.3Å; L865-W871 HydrophobicContact CD2-CG 4.04Å; L865-W871 HydrophobicContact CD2-CZ2 4.15Å; L865-W871 HydrophobicContact CG-CB 4.43Å; L865-W871 HydrophobicContact CG-CD2 4.1Å; L865-W871 HydrophobicContact CG-CG 3.8Å; H868-W871 PolarHBondContact O-N 3.43Å; W871-M873 PolarHBondContact O-N 3.48Å; W871-M873 VanDerWaalsContact O-N 3.13Å; W871-C874 WeakPolarHBondContact O-CB 3.09Å; W871-C874 PolarHBondContact O-N 3.03Å; W871-H1078 HydrophobicContact CZ3-CB 4.13Å; W871-L1079 HydrophobicContact CH2-CB 3.79Å; W871-L1079 HydrophobicContact CH2-CD2 4.14Å; W871-L1079 HydrophobicContact CH2-CG 4.43Å; W871-L1079 HydrophobicContact CZ3-CB 3.63Å; W871-L1079 HydrophobicContact CZ3-CD2 4.3Å
872	G	87.3	Confident	90.4	Very high	42 Å²	42	35.3 Å²	35.3	43%	0.433	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-18.9	-173.8	0	0	0	0	0	116	R866 H868	R866-G872 VanDerWaalsContact O-CA 3.31Å; R866-G872 WeakPolarHBondContact O-CA 3.18Å; H868-G872 PolarHBondContact O-N 3.03Å; H868-G872 VanDerWaalsContact O-N 3.14Å
873	M	89.1	Confident	89.9	Confident	143 Å²	143	36.3 Å²	36.3	70%	0.704	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.2	0.2	174.1	-62.6	-59.4	-176.8	0	0	113.4	W871	W871-M873 PolarHBondContact O-N 3.48Å; W871-M873 VanDerWaalsContact O-N 3.13Å
874	C	90.8	Very high	89.3	Confident	4 Å²	4	39.8 Å²	39.8	3%	0.027	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87	130.1	-178.6	-54.8	0	0	0	0	111.8	G844 I846 R866 W871	G844-C874 CarbonylContact O-C 3.53Å; G844-C874 VanDerWaalsContact O-CA 3.25Å; G844-C874 WeakPolarHBondContact O-CA 3.47Å; I846-C874 HydrophobicContact CD1-CB 4.01Å; I846-C874 HydrophobicContact CG1-CB 3.89Å; R866-C874 WeakPolarHBondContact CD-O 3.44Å; W871-C874 WeakPolarHBondContact O-CB 3.09Å; W871-C874 PolarHBondContact O-N 3.03Å
875	K	91.2	Very high	88.8	Confident	133 Å²	133	44.6 Å²	44.6	58%	0.578	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	147.8	172.2	-65.7	-175.7	178.1	-177.4	0	110.6	G844 T845 I846	G844-K875 PolarHBondContact O-N 3.41Å; T845-K875 CarbonylContact C-O 3.54Å; T845-K875 VanDerWaalsContact CA-O 3.3Å; T845-K875 WeakPolarHBondContact CA-O 3.49Å; I846-K875 PolarHBondContact N-O 2.9Å
876	M	91.6	Very high	88.2	Confident	5 Å²	5	45.3 Å²	45.3	3%	0.025	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	126.1	178.1	-178.2	163.1	71.7	0	0	109.7	I846 V848 P862 I878 L904 A906 E907	I846-M876 WeakPolarHBondContact O-CA 3.14Å; V848-M876 HydrophobicContact CG2-CG 4.35Å; P862-M876 HydrophobicContact CB-SD 3.67Å; P862-M876 HydrophobicContact CG-SD 4.3Å; M876-I878 HydrophobicContact CE-CD1 4.36Å; M876-I878 HydrophobicContact CG-CG1 4.26Å; M876-L904 HydrophobicContact CE-CB 4.42Å; M876-A906 HydrophobicContact CB-CB 3.94Å; M876-A906 HydrophobicContact CE-CB 3.52Å; M876-A906 HydrophobicContact CG-CB 3.91Å; M876-A906 VanDerWaalsContact O-CA 3.24Å; M876-A906 WeakPolarHBondContact O-CA 3.45Å; M876-A906 WeakPolarHBondContact O-CB 3.38Å; M876-E907 PolarHBondContact O-N 3.24Å
877	R	93.9	Very high	87.9	Confident	61 Å²	61	46.1 Å²	46.1	23%	0.23	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	133.2	174.4	-56.2	-166.4	-60.6	170.1	4.1	109.3	T845 I846 D847 V848 F879 E907 K1073	T845-R877 HydrophobicContact CG2-CG 4.27Å; I846-R877 PolarHBondContact O-N 3.32Å; D847-R877 VanDerWaalsContact CG-NH2 3.33Å; D847-R877 IonicContact OD1-CZ 3.14Å; D847-R877 IonicContact OD1-NE 3.78Å; D847-R877 PolarHBondContact OD1-NE 2.89Å; D847-R877 IonicContact OD1-NH2 3.79Å; D847-R877 PolarHBondContact OD1-NH2 3.19Å; D847-R877 IonicContact OD2-CZ 3.09Å; D847-R877 IonicContact OD2-NE 2.83Å; D847-R877 IonicContact OD2-NH2 2.99Å; D847-R877 PolarHBondContact OD2-NH2 3.42Å; V848-R877 PolarHBondContact N-O 2.95Å; R877-F879 HydrophobicContact CB-CE2 3.9Å; R877-F879 HydrophobicContact CB-CZ 4.09Å; R877-E907 CarbonylContact C-O 3.49Å; R877-E907 WeakPolarHBondContact CA-O 3.3Å; R877-E907 HydrophobicContact CG-CB 4.47Å; R877-K1073 PolarHBondContact NH2-O 3.19Å
878	I	92.9	Very high	87.8	Confident	1 Å²	1	42.8 Å²	42.8	1%	0.005	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	114.9	-175.8	-54.2	-175.6	0	0	0	108.7	V848 M859 M876 T880 L899 A906 E907 V908 E909	V848-I878 HydrophobicContact CB-CG1 4.35Å; M859-I878 HydrophobicContact CE-CD1 3.85Å; M859-I878 HydrophobicContact CE-CG2 3.87Å; M859-I878 HydrophobicContact CG-CD1 4.1Å; M859-I878 HydrophobicContact SD-CD1 3.92Å; M876-I878 HydrophobicContact CE-CD1 4.36Å; M876-I878 HydrophobicContact CG-CG1 4.26Å; I878-T880 HydrophobicContact CG2-CG2 3.95Å; I878-L899 HydrophobicContact CD1-CD1 4.05Å; I878-L899 HydrophobicContact CD1-CD2 4.17Å; I878-A906 HydrophobicContact CD1-CB 4.03Å; I878-A906 HydrophobicContact CG1-CB 4.24Å; I878-E907 PolarHBondContact N-O 3.46Å; I878-V908 WeakPolarHBondContact O-CA 3.05Å; I878-E909 PolarHBondContact O-N 2.89Å
879	F	93.5	Very high	87.5	Confident	5 Å²	5	47.1 Å²	47.1	2%	0.022	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	112.7	175.9	-56.5	-80.1	0	0	0	108.6	D847 V848 W849 W850 R877 E909 K1073	D847-F879 HydrophobicContact CB-CD2 4.42Å; D847-F879 HydrophobicContact CB-CE2 3.91Å; V848-F879 PolarHBondContact O-N 2.89Å; W849-F879 HydrophobicContact CD2-CB 3.69Å; W849-F879 HydrophobicContact CD2-CD2 4.24Å; W849-F879 HydrophobicContact CD2-CG 4.18Å; W849-F879 AromaticContact CE2-CD2 3.67Å; W849-F879 AromaticContact CE2-CG 3.78Å; W849-F879 HydrophobicContact CE3-CB 3.7Å; W849-F879 HydrophobicContact CG-CB 4.31Å; W849-F879 HydrophobicContact CG-CD2 4.5Å; W849-F879 HydrophobicContact CH2-CB 4.01Å; W849-F879 HydrophobicContact CH2-CD1 4.35Å; W849-F879 HydrophobicContact CH2-CG 4.12Å; W849-F879 HydrophobicContact CZ2-CB 3.98Å; W849-F879 HydrophobicContact CZ2-CD1 4.16Å; W849-F879 AromaticContact CZ2-CD2 3.95Å; W849-F879 HydrophobicContact CZ2-CD2 3.95Å; W849-F879 AromaticContact CZ2-CG 3.75Å; W849-F879 HydrophobicContact CZ2-CG 3.75Å; W849-F879 HydrophobicContact CZ3-CB 3.88Å; W849-F879 HydrophobicContact CZ3-CG 4.49Å; W849-F879 AromaticContact NE1-CD2 3.61Å; W850-F879 PolarHBondContact N-O 3.44Å; R877-F879 HydrophobicContact CB-CE2 3.9Å; R877-F879 HydrophobicContact CB-CZ 4.09Å; F879-E909 WeakPolarHBondContact CA-O 3.46Å; F879-E909 HydrophobicContact CD1-CB 4.03Å; F879-E909 HydrophobicContact CE1-CB 4.28Å; F879-E909 VanDerWaalsContact CE1-OE2 3.3Å; F879-E909 WeakPolarHBondContact CE1-OE2 3.32Å; F879-K1073 HydrophobicContact CD1-CD 4.17Å; F879-K1073 HydrophobicContact CE1-CB 4.41Å; F879-K1073 HydrophobicContact CE1-CD 3.92Å; F879-K1073 HydrophobicContact CZ-CB 4.46Å
880	T	89.9	Confident	87.2	Confident	4 Å²	4	45.8 Å²	45.8	3%	0.025	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	126.2	178.6	63.5	0	0	0	0	110.5	W850 I878 L895 E909 V910 V911	W850-T880 HydrophobicContact CB-CG2 4.31Å; W850-T880 HydrophobicContact CD2-CG2 4.26Å; W850-T880 HydrophobicContact CE3-CG2 3.55Å; W850-T880 HydrophobicContact CZ3-CG2 4.26Å; I878-T880 HydrophobicContact CG2-CG2 3.95Å; T880-L895 HydrophobicContact CG2-CD1 3.65Å; T880-E909 PolarHBondContact N-O 3.15Å; T880-V910 WeakPolarHBondContact O-CA 3.48Å; T880-V911 PolarHBondContact O-N 3.14Å
881	V	86.5	Confident	86.6	Confident	2 Å²	2	45.9 Å²	45.9	1%	0.012	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.7	126.2	-179	-174.1	0	0	0	0	110.9	W849 W850 V851 V911 M913 I918 R958	W849-V881 HydrophobicContact CE3-CG2 4.39Å; W850-V881 PolarHBondContact O-N 3.34Å; W850-V881 VanDerWaalsContact O-N 3.1Å; V851-V881 HydrophobicContact CG1-CB 4.41Å; V851-V881 HydrophobicContact CG1-CG2 4.43Å; V851-V881 HydrophobicContact CG2-CG2 3.95Å; V881-V911 WeakPolarHBondContact CA-O 3.47Å; V881-M913 HydrophobicContact CG1-CB 4.02Å; V881-M913 HydrophobicContact CG1-CG 3.94Å; V881-M913 HydrophobicContact CG1-SD 3.87Å; V881-I918 HydrophobicContact CG1-CG2 3.94Å; V881-R958 PolarHBondContact O-NH2 3.27Å
882	A	83.9	Confident	86.5	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.3	145.1	177.7	0	0	0	0	0	110.9	D886 M891 V910 V911 E912 M913	A882-D886 HydrophobicContact CB-CB 4.35Å; A882-M891 HydrophobicContact CB-CE 3.49Å; A882-M891 VanDerWaalsContact CB-CE 3.49Å; A882-V910 HydrophobicContact CB-CG1 3.55Å; A882-V911 PolarHBondContact N-O 3.22Å; A882-E912 HydrophobicContact CB-CG 4.22Å; A882-M913 PolarHBondContact O-N 3.5Å
883	Q	81.3	Confident	86.5	Confident	22 Å²	22	53 Å²	53	10%	0.103	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	154.3	167.2	-59.1	-178.2	-103.8	0	0	108.6	D885 D886 D915 I918	Q883-D885 PolarHBondContact O-N 2.95Å; Q883-D885 VanDerWaalsContact O-N 3.08Å; Q883-D886 PolarHBondContact N-OD2 2.72Å; Q883-D886 WeakPolarHBondContact O-CB 3.29Å; Q883-D886 PolarHBondContact O-N 3Å; Q883-D915 PolarHBondContact NE2-OD1 3.13Å; Q883-D915 PolarHBondContact NE2-OD2 3.35Å; Q883-I918 HydrophobicContact CG-CD1 3.78Å
884	M	77.6	Confident	86.2	Confident	104 Å²	104	48.3 Å²	48.3	51%	0.512	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59	-21.3	176.4	-62	-66.9	-70.4	0	0	113.2	E912	M884-E912 HydrophobicContact SD-CB 4.22Å
885	D	79.4	Confident	86	Confident	126 Å²	126	48.2 Å²	48.2	67%	0.674	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-10	176.9	-61	-13	0	0	0	113.2	Q883	Q883-D885 PolarHBondContact O-N 2.95Å; Q883-D885 VanDerWaalsContact O-N 3.08Å
886	D	79.4	Confident	85.8	Confident	21 Å²	21	46.3 Å²	46.3	11%	0.112	23%	0.226	C	C	.	.	S	Bend	trans	-86.4	144.8	-179.8	-67.5	-28.3	0	0	0	111.1	A882 Q883 S888 M891 R958	A882-D886 HydrophobicContact CB-CB 4.35Å; Q883-D886 PolarHBondContact N-OD2 2.72Å; Q883-D886 WeakPolarHBondContact O-CB 3.29Å; Q883-D886 PolarHBondContact O-N 3Å; D886-S888 PolarHBondContact O-N 3.46Å; D886-M891 HydrophobicContact CB-CE 4.13Å; D886-R958 WeakPolarHBondContact OD1-CG 3.45Å; D886-R958 IonicContact OD1-NE 2.76Å; D886-R958 IonicContact OD2-CZ 2.86Å; D886-R958 VanDerWaalsContact OD2-CZ 3.26Å; D886-R958 IonicContact OD2-NE 3.79Å; D886-R958 PolarHBondContact OD2-NE 3.05Å; D886-R958 IonicContact OD2-NH2 2.72Å; D886-R958 PolarHBondContact OD2-NH2 3.09Å
887	N	84.9	Confident	85.4	Confident	73 Å²	73	51 Å²	51	39%	0.39	25%	0.249	S	C	.	.			trans	-77.8	90.4	171.1	-172.7	-21	0	0	0	111.3	I889 Q890 M891 I961	N887-I889 VanDerWaalsContact C-N 3.32Å; N887-I889 PolarHBondContact O-N 2.85Å; N887-I889 PolarHBondContact OD1-N 3.11Å; N887-Q890 HydrophobicContact CB-CB 4.05Å; N887-Q890 VanDerWaalsContact CG-CB 3.43Å; N887-Q890 WeakPolarHBondContact ND2-CB 3.46Å; N887-Q890 PolarHBondContact O-N 2.93Å; N887-Q890 PolarHBondContact OD1-N 2.89Å; N887-M891 WeakPolarHBondContact O-CB 3.1Å; N887-M891 PolarHBondContact O-N 2.76Å; N887-I961 HydrophobicContact CB-CD1 4Å
888	S	84.8	Confident	84.8	Confident	21 Å²	21	48.5 Å²	48.5	15%	0.147	24%	0.24	C	C	.	.	H	α-helix	trans	-58	-38.3	179.7	59.6	0	0	0	0	113.8	D886 K892 E912	D886-S888 PolarHBondContact O-N 3.46Å; S888-K892 WeakPolarHBondContact O-CB 3.29Å; S888-K892 PolarHBondContact O-N 3.35Å; S888-E912 WeakPolarHBondContact CB-OE1 3.46Å; S888-E912 PolarHBondContact OG-OE1 3.07Å
889	I	85.6	Confident	84.5	Confident	115 Å²	115	48.7 Å²	48.7	59%	0.59	24%	0.241	S	C	*	.	H	α-helix	trans	-67.1	-45.5	180	-59.4	174.7	0	0	0	111	N887 K892 K893	N887-I889 VanDerWaalsContact C-N 3.32Å; N887-I889 PolarHBondContact O-N 2.85Å; N887-I889 PolarHBondContact OD1-N 3.11Å; I889-K892 PolarHBondContact O-N 3.23Å; I889-K893 WeakPolarHBondContact O-CG 3.19Å; I889-K893 PolarHBondContact O-N 3.39Å
890	Q	82.4	Confident	84	Confident	78 Å²	78	56.8 Å²	56.8	36%	0.364	27%	0.273	S	S	.	.	H	α-helix	trans	-67.4	-47.2	178.9	-174.3	58.9	35.5	0	0	110.6	N887 K892 K893 D894	N887-Q890 HydrophobicContact CB-CB 4.05Å; N887-Q890 VanDerWaalsContact CG-CB 3.43Å; N887-Q890 WeakPolarHBondContact ND2-CB 3.46Å; N887-Q890 PolarHBondContact O-N 2.93Å; N887-Q890 PolarHBondContact OD1-N 2.89Å; Q890-K892 VanDerWaalsContact C-N 3.28Å; Q890-K892 PolarHBondContact O-N 3.48Å; Q890-K893 WeakPolarHBondContact O-CB 3.31Å; Q890-K893 PolarHBondContact O-N 3.46Å; Q890-D894 WeakPolarHBondContact CG-OD2 3.32Å; Q890-D894 PolarHBondContact NE2-OD1 2.91Å; Q890-D894 PolarHBondContact NE2-OD2 3.48Å; Q890-D894 VanDerWaalsContact O-CG 3.28Å; Q890-D894 PolarHBondContact O-N 2.85Å
891	M	81.1	Confident	83.4	Confident	3 Å²	3	63 Å²	63	2%	0.015	30%	0.301	C	S	.	.	H	α-helix	trans	-57.1	-39.8	175.9	178.9	161.1	45.2	0	0	112.2	A882 D886 N887 L895 V910 T954	A882-M891 HydrophobicContact CB-CE 3.49Å; A882-M891 VanDerWaalsContact CB-CE 3.49Å; D886-M891 HydrophobicContact CB-CE 4.13Å; N887-M891 WeakPolarHBondContact O-CB 3.1Å; N887-M891 PolarHBondContact O-N 2.76Å; M891-L895 HydrophobicContact CG-CD1 3.92Å; M891-L895 WeakPolarHBondContact O-CB 3.48Å; M891-L895 WeakPolarHBondContact O-CD1 3.35Å; M891-L895 WeakPolarHBondContact O-CG 3.4Å; M891-L895 PolarHBondContact O-N 2.92Å; M891-V910 HydrophobicContact CE-CG1 4.08Å; M891-T954 HydrophobicContact CG-CG2 4.49Å; M891-T954 HydrophobicContact SD-CG2 4.4Å
892	K	88.6	Confident	82.9	Confident	78 Å²	78	64.4 Å²	64.4	34%	0.339	31%	0.308	S	S	.	.	H	α-helix	trans	-60.3	-46.6	173.6	-173.2	165.9	176.3	162.9	0	112.3	S888 I889 Q890 Q896 V908 V910	S888-K892 WeakPolarHBondContact O-CB 3.29Å; S888-K892 PolarHBondContact O-N 3.35Å; I889-K892 PolarHBondContact O-N 3.23Å; Q890-K892 VanDerWaalsContact C-N 3.28Å; Q890-K892 PolarHBondContact O-N 3.48Å; K892-Q896 VanDerWaalsContact O-CG 3.3Å; K892-Q896 WeakPolarHBondContact O-CG 3.22Å; K892-Q896 PolarHBondContact O-N 3.04Å; K892-V908 WeakPolarHBondContact CE-O 3.04Å; K892-V908 PolarHBondContact NZ-O 3.29Å; K892-V910 HydrophobicContact CB-CG2 3.66Å; K892-V910 HydrophobicContact CG-CG2 4.27Å
893	K	87.1	Confident	82.8	Confident	115 Å²	115	75.4 Å²	75.4	50%	0.5	35%	0.35	S	S	.	.	H	α-helix	trans	-64.1	-46.2	179.4	-72.4	176.6	179.1	179.7	0	111.9	I889 Q890 L895 Q896 M897	I889-K893 WeakPolarHBondContact O-CG 3.19Å; I889-K893 PolarHBondContact O-N 3.39Å; Q890-K893 WeakPolarHBondContact O-CB 3.31Å; Q890-K893 PolarHBondContact O-N 3.46Å; K893-L895 VanDerWaalsContact C-N 3.31Å; K893-L895 PolarHBondContact O-N 2.91Å; K893-Q896 PolarHBondContact O-N 3.26Å; K893-M897 WeakPolarHBondContact O-CG 3.17Å; K893-M897 PolarHBondContact O-N 3.02Å
894	D	84.1	Confident	82.9	Confident	43 Å²	43	74.7 Å²	74.7	23%	0.23	35%	0.347	C	S	.	.	H	α-helix	trans	-62.2	-41.3	-178.9	-64.2	-25.6	0	0	0	111	Q890 M897 F898 I953	Q890-D894 WeakPolarHBondContact CG-OD2 3.32Å; Q890-D894 PolarHBondContact NE2-OD1 2.91Å; Q890-D894 PolarHBondContact NE2-OD2 3.48Å; Q890-D894 VanDerWaalsContact O-CG 3.28Å; Q890-D894 PolarHBondContact O-N 2.85Å; D894-M897 PolarHBondContact O-N 2.89Å; D894-F898 VanDerWaalsContact O-CB 3.27Å; D894-F898 WeakPolarHBondContact O-CB 3.3Å; D894-F898 PolarHBondContact O-N 3.05Å; D894-I953 HydrophobicContact CB-CG2 3.93Å
895	L	85.4	Confident	83.2	Confident	3 Å²	3	75.7 Å²	75.7	2%	0.016	35%	0.354	C	S	.	.	H	α-helix	trans	-66.9	-40.1	175	-69.2	171.6	0	0	0	113	W850 T880 M891 K893 F898 L899 V908 I950 T954	W850-L895 HydrophobicContact CH2-CD2 4.26Å; W850-L895 HydrophobicContact CZ3-CD2 3.62Å; T880-L895 HydrophobicContact CG2-CD1 3.65Å; M891-L895 HydrophobicContact CG-CD1 3.92Å; M891-L895 WeakPolarHBondContact O-CB 3.48Å; M891-L895 WeakPolarHBondContact O-CD1 3.35Å; M891-L895 WeakPolarHBondContact O-CG 3.4Å; M891-L895 PolarHBondContact O-N 2.92Å; K893-L895 VanDerWaalsContact C-N 3.31Å; K893-L895 PolarHBondContact O-N 2.91Å; L895-F898 PolarHBondContact O-N 3.34Å; L895-L899 VanDerWaalsContact O-CG 3.32Å; L895-L899 WeakPolarHBondContact O-CG 3.48Å; L895-L899 PolarHBondContact O-N 3.49Å; L895-V908 HydrophobicContact CB-CG1 4.07Å; L895-V908 HydrophobicContact CD1-CG1 4.15Å; L895-I950 HydrophobicContact CD2-CD1 3.68Å; L895-I950 HydrophobicContact CD2-CG1 3.96Å; L895-T954 HydrophobicContact CD2-CG2 3.97Å; L895-T954 HydrophobicContact CG-CG2 4.49Å
896	Q	87.8	Confident	83.7	Confident	93 Å²	93	70.7 Å²	70.7	44%	0.435	33%	0.33	S	S	.	.	H	α-helix	trans	-64.2	-44	174.7	-75.1	178.8	-44.4	0	0	111.8	K892 K893 F898 L899 Y900 V908	K892-Q896 VanDerWaalsContact O-CG 3.3Å; K892-Q896 WeakPolarHBondContact O-CG 3.22Å; K892-Q896 PolarHBondContact O-N 3.04Å; K893-Q896 PolarHBondContact O-N 3.26Å; Q896-F898 VanDerWaalsContact C-N 3.35Å; Q896-L899 PolarHBondContact O-N 3.03Å; Q896-Y900 WeakPolarHBondContact O-CB 3.36Å; Q896-Y900 PolarHBondContact O-N 3.48Å; Q896-V908 HydrophobicContact CG-CB 4.18Å; Q896-V908 HydrophobicContact CG-CG2 4.27Å
897	M	83.2	Confident	84.2	Confident	103 Å²	103	75.1 Å²	75.1	51%	0.507	35%	0.35	S	S	.	.	H	α-helix	trans	-61.7	-42.2	174.4	-74.2	-61.7	-60.7	0	0	111.8	K893 D894 Y900 H901	K893-M897 WeakPolarHBondContact O-CG 3.17Å; K893-M897 PolarHBondContact O-N 3.02Å; D894-M897 PolarHBondContact O-N 2.89Å; M897-Y900 WeakPolarHBondContact O-CB 3.17Å; M897-Y900 PolarHBondContact O-N 3.35Å; M897-H901 PolarHBondContact O-CD2 3.23Å; M897-H901 PolarHBondContact O-N 3.03Å
898	F	81.3	Confident	84.5	Confident	9 Å²	9	72.1 Å²	72.1	4%	0.039	33%	0.334	C	S	.	.	H	α-helix	trans	-60.9	-50.1	177.1	-179	-98.8	0	0	0	112.6	D894 L895 Q896 Y900 H901 L902 R948 I950 I953	D894-F898 VanDerWaalsContact O-CB 3.27Å; D894-F898 WeakPolarHBondContact O-CB 3.3Å; D894-F898 PolarHBondContact O-N 3.05Å; L895-F898 PolarHBondContact O-N 3.34Å; Q896-F898 VanDerWaalsContact C-N 3.35Å; F898-Y900 VanDerWaalsContact C-N 3.3Å; F898-Y900 PolarHBondContact O-N 3.05Å; F898-H901 PolarHBondContact O-N 3.45Å; F898-L902 HydrophobicContact CD1-CD1 3.89Å; F898-L902 HydrophobicContact CE1-CD1 3.19Å; F898-L902 HydrophobicContact CE1-CG 4.18Å; F898-L902 HydrophobicContact CE2-CD1 4.31Å; F898-L902 HydrophobicContact CZ-CD1 3.46Å; F898-L902 VanDerWaalsContact CZ-CD1 3.46Å; F898-L902 HydrophobicContact CZ-CG 4.24Å; F898-L902 PolarHBondContact O-N 3.43Å; F898-R948 WeakPolarHBondContact CE2-O 3.35Å; F898-R948 WeakPolarHBondContact CZ-O 3.09Å; F898-I950 HydrophobicContact CD1-CB 4.14Å; F898-I950 HydrophobicContact CD1-CD1 3.46Å; F898-I950 VanDerWaalsContact CD1-CD1 3.46Å; F898-I950 HydrophobicContact CD1-CG1 3.57Å; F898-I950 HydrophobicContact CD2-CG1 4.48Å; F898-I950 HydrophobicContact CE1-CB 3.49Å; F898-I950 VanDerWaalsContact CE1-CB 3.49Å; F898-I950 HydrophobicContact CE1-CD1 3.45Å; F898-I950 VanDerWaalsContact CE1-CD1 3.45Å; F898-I950 HydrophobicContact CE1-CG1 3.45Å; F898-I950 VanDerWaalsContact CE1-CG1 3.45Å; F898-I950 HydrophobicContact CE2-CB 4.16Å; F898-I950 HydrophobicContact CE2-CG1 4.36Å; F898-I950 HydrophobicContact CG-CD1 4.37Å; F898-I950 HydrophobicContact CG-CG1 4.09Å; F898-I950 HydrophobicContact CZ-CB 3.5Å; F898-I950 VanDerWaalsContact CZ-CB 3.5Å; F898-I950 HydrophobicContact CZ-CD1 4.33Å; F898-I950 HydrophobicContact CZ-CG1 3.87Å; F898-I953 HydrophobicContact CB-CD1 4.38Å; F898-I953 HydrophobicContact CD2-CD1 3.25Å; F898-I953 HydrophobicContact CE2-CD1 3.74Å; F898-I953 HydrophobicContact CG-CD1 4.08Å
899	L	85.5	Confident	84.9	Confident	5 Å²	5	74.8 Å²	74.8	3%	0.026	34%	0.344	C	S	.	.	H	α-helix	trans	-62.8	-37.6	177.3	-67.9	172	0	0	0	112	M859 I878 L895 Q896 L902 R903 L904 A906 V908	M859-L899 HydrophobicContact SD-CD2 3.92Å; I878-L899 HydrophobicContact CD1-CD1 4.05Å; I878-L899 HydrophobicContact CD1-CD2 4.17Å; L895-L899 VanDerWaalsContact O-CG 3.32Å; L895-L899 WeakPolarHBondContact O-CG 3.48Å; L895-L899 PolarHBondContact O-N 3.49Å; Q896-L899 PolarHBondContact O-N 3.03Å; L899-L902 CarbonylContact O-C 3.5Å; L899-L902 PolarHBondContact O-N 2.93Å; L899-R903 PolarHBondContact O-N 3.35Å; L899-L904 HydrophobicContact CB-CB 4.37Å; L899-L904 HydrophobicContact CD2-CB 3.76Å; L899-L904 HydrophobicContact CD2-CD1 3.84Å; L899-L904 HydrophobicContact CD2-CG 4.45Å; L899-L904 PolarHBondContact O-N 3.29Å; L899-A906 HydrophobicContact CD1-CB 4.22Å; L899-V908 HydrophobicContact CD1-CG2 3.25Å
900	Y	83.9	Confident	85.1	Confident	175 Å²	175	70.4 Å²	70.4	69%	0.686	32%	0.323	S	S	*	.	H	α-helix	trans	-60.3	-47	173.9	177	-100.7	0	0	0	111.9	Q896 M897 F898 L902 R903	Q896-Y900 WeakPolarHBondContact O-CB 3.36Å; Q896-Y900 PolarHBondContact O-N 3.48Å; M897-Y900 WeakPolarHBondContact O-CB 3.17Å; M897-Y900 PolarHBondContact O-N 3.35Å; F898-Y900 VanDerWaalsContact C-N 3.3Å; F898-Y900 PolarHBondContact O-N 3.05Å; Y900-L902 VanDerWaalsContact C-N 3.27Å; Y900-L902 PolarHBondContact O-N 2.91Å; Y900-R903 PolarHBondContact O-N 2.94Å
901	H	78.3	Confident	85.4	Confident	135 Å²	135	67.4 Å²	67.4	63%	0.625	31%	0.31	S	S	*	.	H	α-helix	trans	-62.1	-33.3	175.5	-74.5	-57.3	0	0	0	113.1	M897 F898	M897-H901 PolarHBondContact O-CD2 3.23Å; M897-H901 PolarHBondContact O-N 3.03Å; F898-H901 PolarHBondContact O-N 3.45Å
902	L	74.8	Confident	85.7	Confident	31 Å²	31	72.1 Å²	72.1	16%	0.162	33%	0.332	C	S	.	.	H	α-helix	trans	-82.7	-6.7	174.2	-66.7	-177.5	0	0	0	114.7	F898 L899 Y900 L904 Y1125	F898-L902 HydrophobicContact CD1-CD1 3.89Å; F898-L902 HydrophobicContact CE1-CD1 3.19Å; F898-L902 HydrophobicContact CE1-CG 4.18Å; F898-L902 HydrophobicContact CE2-CD1 4.31Å; F898-L902 HydrophobicContact CZ-CD1 3.46Å; F898-L902 VanDerWaalsContact CZ-CD1 3.46Å; F898-L902 HydrophobicContact CZ-CG 4.24Å; F898-L902 PolarHBondContact O-N 3.43Å; L899-L902 CarbonylContact O-C 3.5Å; L899-L902 PolarHBondContact O-N 2.93Å; Y900-L902 VanDerWaalsContact C-N 3.27Å; Y900-L902 PolarHBondContact O-N 2.91Å; L902-L904 HydrophobicContact CB-CB 4.49Å; L902-L904 HydrophobicContact CB-CD1 4Å; L902-L904 HydrophobicContact CB-CG 3.87Å; L902-L904 HydrophobicContact CD1-CD1 3.78Å; L902-L904 PolarHBondContact O-N 2.94Å; L902-Y1125 HydrophobicContact CD1-CD2 3.38Å; L902-Y1125 HydrophobicContact CD1-CE2 3.44Å; L902-Y1125 VanDerWaalsContact CD1-CE2 3.44Å; L902-Y1125 HydrophobicContact CD1-CG 4.09Å; L902-Y1125 HydrophobicContact CD2-CD2 3.78Å; L902-Y1125 HydrophobicContact CD2-CE2 4.32Å; L902-Y1125 HydrophobicContact CG-CD2 4.17Å
903	R	82.7	Confident	85.4	Confident	230 Å²	230	69.2 Å²	69.2	87%	0.868	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	30.8	-172.5	-51.6	177.7	179.8	-179.9	-1.8	113.4	L899 Y900 D905	L899-R903 PolarHBondContact O-N 3.35Å; Y900-R903 PolarHBondContact O-N 2.94Å; R903-D905 PolarHBondContact O-N 3.44Å
904	L	83.4	Confident	85.1	Confident	8 Å²	8	68.8 Å²	68.8	4%	0.042	32%	0.319	C	S	.	.			trans	-87.1	100.6	175.6	-70.3	177.4	0	0	0	109.6	F863 M876 L899 L902 A906 Y1125	F863-L904 HydrophobicContact CB-CD2 4.24Å; F863-L904 HydrophobicContact CD2-CD2 3.2Å; F863-L904 HydrophobicContact CE2-CD2 3.6Å; F863-L904 HydrophobicContact CG-CD2 3.78Å; F863-L904 HydrophobicContact CZ-CD2 4.47Å; M876-L904 HydrophobicContact CE-CB 4.42Å; L899-L904 HydrophobicContact CB-CB 4.37Å; L899-L904 HydrophobicContact CD2-CB 3.76Å; L899-L904 HydrophobicContact CD2-CD1 3.84Å; L899-L904 HydrophobicContact CD2-CG 4.45Å; L899-L904 PolarHBondContact O-N 3.29Å; L902-L904 HydrophobicContact CB-CB 4.49Å; L902-L904 HydrophobicContact CB-CD1 4Å; L902-L904 HydrophobicContact CB-CG 3.87Å; L902-L904 HydrophobicContact CD1-CD1 3.78Å; L902-L904 PolarHBondContact O-N 2.94Å; L904-A906 PolarHBondContact O-N 2.74Å; L904-A906 VanDerWaalsContact O-N 3.09Å; L904-Y1125 HydrophobicContact CD1-CD1 4.09Å; L904-Y1125 HydrophobicContact CD1-CG 4.23Å
905	D	83.9	Confident	84.5	Confident	125 Å²	125	70.1 Å²	70.1	67%	0.668	33%	0.327	S	S	*	.			trans	-68.5	104.3	173.4	-175.6	28.1	0	0	0	110.8	R866 R903	R866-D905 PolarHBondContact NH1-O 3.19Å; R866-D905 PolarHBondContact NH2-O 3.16Å; R903-D905 PolarHBondContact O-N 3.44Å
906	A	88.5	Confident	83.8	Confident	21 Å²	21	76 Å²	76	17%	0.174	36%	0.358	C	S	.	.			trans	-157.2	146.5	-179.7	0	0	0	0	0	112.8	M876 I878 L899 L904	M876-A906 HydrophobicContact CB-CB 3.94Å; M876-A906 HydrophobicContact CE-CB 3.52Å; M876-A906 HydrophobicContact CG-CB 3.91Å; M876-A906 VanDerWaalsContact O-CA 3.24Å; M876-A906 WeakPolarHBondContact O-CA 3.45Å; M876-A906 WeakPolarHBondContact O-CB 3.38Å; I878-A906 HydrophobicContact CD1-CB 4.03Å; I878-A906 HydrophobicContact CG1-CB 4.24Å; L899-A906 HydrophobicContact CD1-CB 4.22Å; L904-A906 PolarHBondContact O-N 2.74Å; L904-A906 VanDerWaalsContact O-N 3.09Å
907	E	90.5	Very high	83.2	Confident	114 Å²	114	72.2 Å²	72.2	53%	0.533	34%	0.341	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	129.5	174.4	-66.3	170.3	-167.7	0	0	109.9	M876 R877 I878	M876-E907 PolarHBondContact O-N 3.24Å; R877-E907 CarbonylContact C-O 3.49Å; R877-E907 WeakPolarHBondContact CA-O 3.3Å; R877-E907 HydrophobicContact CG-CB 4.47Å; I878-E907 PolarHBondContact N-O 3.46Å
908	V	91.9	Very high	82.8	Confident	9 Å²	9	67.4 Å²	67.4	6%	0.055	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	127.2	178.6	-177	0	0	0	0	111	I878 K892 L895 Q896 L899	I878-V908 WeakPolarHBondContact O-CA 3.05Å; K892-V908 WeakPolarHBondContact CE-O 3.04Å; K892-V908 PolarHBondContact NZ-O 3.29Å; L895-V908 HydrophobicContact CB-CG1 4.07Å; L895-V908 HydrophobicContact CD1-CG1 4.15Å; Q896-V908 HydrophobicContact CG-CB 4.18Å; Q896-V908 HydrophobicContact CG-CG2 4.27Å; L899-V908 HydrophobicContact CD1-CG2 3.25Å
909	E	92.3	Very high	82.2	Confident	77 Å²	77	67.9 Å²	67.9	36%	0.36	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	135.7	169.9	-154.6	-171.1	174.5	0	0	110.9	I878 F879 T880 K1073	I878-E909 PolarHBondContact O-N 2.89Å; F879-E909 WeakPolarHBondContact CA-O 3.46Å; F879-E909 HydrophobicContact CD1-CB 4.03Å; F879-E909 HydrophobicContact CE1-CB 4.28Å; F879-E909 VanDerWaalsContact CE1-OE2 3.3Å; F879-E909 WeakPolarHBondContact CE1-OE2 3.32Å; T880-E909 PolarHBondContact N-O 3.15Å; E909-K1073 IonicContact OE1-NZ 3.44Å; E909-K1073 PolarHBondContact OE1-NZ 3.04Å; E909-K1073 IonicContact OE2-NZ 3.61Å; E909-K1073 PolarHBondContact OE2-NZ 3.08Å
910	V	89.8	Confident	81.3	Confident	24 Å²	24	68.1 Å²	68.1	15%	0.145	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	130.8	175.9	-177.1	0	0	0	0	107.8	T880 A882 M891 K892	T880-V910 WeakPolarHBondContact O-CA 3.48Å; A882-V910 HydrophobicContact CB-CG1 3.55Å; M891-V910 HydrophobicContact CE-CG1 4.08Å; K892-V910 HydrophobicContact CB-CG2 3.66Å; K892-V910 HydrophobicContact CG-CG2 4.27Å
911	V	89.9	Confident	80.6	Confident	15 Å²	15	60.3 Å²	60.3	9%	0.091	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.4	115.6	-179.8	-177.5	0	0	0	0	108.4	W849 T880 V881 A882 M913 V1069	W849-V911 HydrophobicContact CH2-CG2 4.27Å; W849-V911 HydrophobicContact CZ3-CG2 4.22Å; T880-V911 PolarHBondContact O-N 3.14Å; V881-V911 WeakPolarHBondContact CA-O 3.47Å; A882-V911 PolarHBondContact N-O 3.22Å; V911-M913 HydrophobicContact CG1-CG 4.32Å; V911-V1069 HydrophobicContact CG1-CG1 3.91Å
912	E	86.5	Confident	80.1	Confident	102 Å²	102	55.3 Å²	55.3	48%	0.477	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	132.7	178.3	-68.8	172.2	-174.7	0	0	110.5	A882 M884 S888	A882-E912 HydrophobicContact CB-CG 4.22Å; M884-E912 HydrophobicContact SD-CB 4.22Å; S888-E912 WeakPolarHBondContact CB-OE1 3.46Å; S888-E912 PolarHBondContact OG-OE1 3.07Å
913	M	83.5	Confident	79.7	Confident	16 Å²	16	60.3 Å²	60.3	8%	0.079	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	155.2	177.8	-64.1	-171.6	75.4	0	0	111.1	V881 A882 V911 D917 I918 L1066	V881-M913 HydrophobicContact CG1-CB 4.02Å; V881-M913 HydrophobicContact CG1-CG 3.94Å; V881-M913 HydrophobicContact CG1-SD 3.87Å; A882-M913 PolarHBondContact O-N 3.5Å; V911-M913 HydrophobicContact CG1-CG 4.32Å; M913-D917 HydrophobicContact CE-CB 4.01Å; M913-I918 HydrophobicContact CB-CG2 4.24Å; M913-I918 HydrophobicContact SD-CG2 4.25Å; M913-L1066 HydrophobicContact CE-CB 4.39Å; M913-L1066 HydrophobicContact CE-CD1 3.94Å; M913-L1066 HydrophobicContact SD-CD1 3.68Å
914	H	80.8	Confident	78.6	Confident	106 Å²	106	52.7 Å²	52.7	49%	0.491	27%	0.265	S	S	.	.			trans	-76.7	146.3	173.4	-69.5	-65.9	0	0	0	111.9	N916 D917 I918	H914-N916 PolarHBondContact O-N 3.2Å; H914-N916 VanDerWaalsContact O-N 3.12Å; H914-D917 WeakPolarHBondContact O-CA 3.2Å; H914-D917 WeakPolarHBondContact O-CB 3.1Å; H914-D917 PolarHBondContact O-N 3.21Å; H914-I918 PolarHBondContact O-N 2.92Å
915	D	70.9	Confident	77.7	Confident	71 Å²	71	53.9 Å²	53.9	38%	0.38	27%	0.27	S	S	.	.	G	3₁₀ helix	trans	-51.6	-36.8	178.9	-82.2	28.7	0	0	0	114.6	Q883 D917 I918 S919	Q883-D915 PolarHBondContact NE2-OD1 3.13Å; Q883-D915 PolarHBondContact NE2-OD2 3.35Å; D915-D917 PolarHBondContact O-N 2.8Å; D915-I918 PolarHBondContact O-N 3.33Å; D915-S919 WeakPolarHBondContact O-CA 3.33Å; D915-S919 PolarHBondContact O-N 3.07Å
916	N	71.1	Confident	76.6	Confident	127 Å²	127	52.8 Å²	52.8	68%	0.679	27%	0.268	S	S	*	.	G	3₁₀ helix	trans	-58.7	-37.7	176	-68.4	-33.1	0	0	0	111.5	H914 I918 S919 T1062	H914-N916 PolarHBondContact O-N 3.2Å; H914-N916 VanDerWaalsContact O-N 3.12Å; N916-I918 VanDerWaalsContact C-N 3.31Å; N916-I918 PolarHBondContact O-N 3.46Å; N916-S919 WeakPolarHBondContact O-CB 3.47Å; N916-S919 PolarHBondContact O-OG 2.83Å; N916-T1062 PolarHBondContact O-OG1 3.24Å; N916-T1062 VanDerWaalsContact O-OG1 3.06Å
917	D	74.9	Confident	75.4	Confident	14 Å²	14	56.6 Å²	56.6	8%	0.075	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-86.1	0.2	-174.4	-53.4	-31.2	0	0	0	112.9	M913 H914 D915 T1062 K1065	M913-D917 HydrophobicContact CE-CB 4.01Å; H914-D917 WeakPolarHBondContact O-CA 3.2Å; H914-D917 WeakPolarHBondContact O-CB 3.1Å; H914-D917 PolarHBondContact O-N 3.21Å; D915-D917 PolarHBondContact O-N 2.8Å; D917-T1062 WeakPolarHBondContact O-CG2 3.43Å; D917-K1065 HydrophobicContact CB-CD 4.21Å; D917-K1065 WeakPolarHBondContact OD1-CD 3.43Å; D917-K1065 IonicContact OD1-NZ 3.19Å; D917-K1065 PolarHBondContact OD1-NZ 3.35Å; D917-K1065 WeakPolarHBondContact OD2-CD 3.38Å; D917-K1065 IonicContact OD2-NZ 2.69Å; D917-K1065 PolarHBondContact OD2-NZ 2.92Å
918	I	74.6	Confident	74.2	Confident	1 Å²	1	54 Å²	54	1%	0.005	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-128.9	11.8	170.8	61.2	169.4	0	0	0	113.4	V851 V881 Q883 M913 H914 D915 N916 A920 F921 T922	V851-I918 HydrophobicContact CG1-CG2 4.47Å; V881-I918 HydrophobicContact CG1-CG2 3.94Å; Q883-I918 HydrophobicContact CG-CD1 3.78Å; M913-I918 HydrophobicContact CB-CG2 4.24Å; M913-I918 HydrophobicContact SD-CG2 4.25Å; H914-I918 PolarHBondContact O-N 2.92Å; D915-I918 PolarHBondContact O-N 3.33Å; N916-I918 VanDerWaalsContact C-N 3.31Å; N916-I918 PolarHBondContact O-N 3.46Å; I918-A920 PolarHBondContact O-N 2.93Å; I918-F921 PolarHBondContact O-N 2.94Å; I918-T922 HydrophobicContact CD1-CG2 3.55Å; I918-T922 HydrophobicContact CG1-CG2 3.82Å; I918-T922 PolarHBondContact O-N 3.33Å
919	S	69.6	Low	72.9	Confident	20 Å²	20	56.4 Å²	56.4	14%	0.14	29%	0.288	C	S	.	.	H	α-helix	trans	-57.7	-25.7	-169.6	59.6	0	0	0	0	115.4	D915 N916 F921 T922 Y923	D915-S919 WeakPolarHBondContact O-CA 3.33Å; D915-S919 PolarHBondContact O-N 3.07Å; N916-S919 WeakPolarHBondContact O-CB 3.47Å; N916-S919 PolarHBondContact O-OG 2.83Å; S919-F921 VanDerWaalsContact C-N 3.32Å; S919-T922 WeakPolarHBondContact CA-OG1 3.45Å; S919-Y923 PolarHBondContact O-N 3.07Å
920	A	66.6	Low	71.8	Confident	10 Å²	10	58.4 Å²	58.4	8%	0.083	30%	0.297	C	S	.	.	H	α-helix	trans	-70.1	-25.5	175	0	0	0	0	0	113.6	I918 F1100	I918-A920 PolarHBondContact O-N 2.93Å; A920-F1100 HydrophobicContact CB-CE2 4Å; A920-F1100 HydrophobicContact CB-CZ 3.74Å
921	F	69.1	Low	70.9	Confident	10 Å²	10	63 Å²	63	4%	0.044	32%	0.317	C	S	.	.	H	α-helix	trans	-97.5	-29.4	-179.5	-63.3	-83.9	0	0	0	112.6	V851 I918 S919 L1066 N1083 P1085 F1100 L1104	V851-F921 HydrophobicContact CB-CD1 4.42Å; V851-F921 HydrophobicContact CB-CG 4.38Å; V851-F921 HydrophobicContact CG1-CB 4.02Å; V851-F921 HydrophobicContact CG1-CD1 4.31Å; V851-F921 HydrophobicContact CG1-CD2 3.79Å; V851-F921 HydrophobicContact CG1-CE2 4.32Å; V851-F921 HydrophobicContact CG1-CG 3.78Å; I918-F921 PolarHBondContact O-N 2.94Å; S919-F921 VanDerWaalsContact C-N 3.32Å; F921-L1066 HydrophobicContact CD2-CD2 4.48Å; F921-L1066 HydrophobicContact CE2-CD2 3.71Å; F921-L1066 HydrophobicContact CZ-CD2 4.47Å; F921-N1083 VanDerWaalsContact CD1-ND2 3.33Å; F921-N1083 WeakPolarHBondContact CD1-ND2 3.31Å; F921-N1083 WeakPolarHBondContact CE1-ND2 3.47Å; F921-N1083 WeakPolarHBondContact CE1-O 3.46Å; F921-P1085 HydrophobicContact CD1-CB 4.04Å; F921-P1085 HydrophobicContact CE1-CB 3.77Å; F921-P1085 HydrophobicContact CE1-CG 4.12Å; F921-P1085 HydrophobicContact CZ-CB 4.16Å; F921-P1085 HydrophobicContact CZ-CG 4.13Å; F921-F1100 HydrophobicContact CE2-CZ 4.49Å; F921-L1104 HydrophobicContact CZ-CD2 4.19Å
922	T	67.9	Low	69.8	Low	31 Å²	31	64.3 Å²	64.3	19%	0.19	32%	0.32	C	S	.	.	H	α-helix	trans	-82.8	-19.2	-178.1	53.3	0	0	0	0	114.4	V852 I918 S919 E924 K925	V852-T922 HydrophobicContact CG2-CG2 4.22Å; I918-T922 HydrophobicContact CD1-CG2 3.55Å; I918-T922 HydrophobicContact CG1-CG2 3.82Å; I918-T922 PolarHBondContact O-N 3.33Å; S919-T922 WeakPolarHBondContact CA-OG1 3.45Å; T922-E924 PolarHBondContact O-N 2.93Å; T922-K925 WeakPolarHBondContact O-CB 3.32Å; T922-K925 PolarHBondContact O-N 3.03Å
923	Y	64.4	Low	69.1	Low	135 Å²	135	62 Å²	62	53%	0.529	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-38.2	-176.6	-177.3	-100.8	0	0	0	114	S919	S919-Y923 PolarHBondContact O-N 3.07Å
924	E	61	Low	68.6	Low	70 Å²	70	66.2 Å²	66.2	33%	0.327	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.3	-7.4	-178.8	-57.3	-168	137.6	0	0	113	T922 T926 L927 V928	T922-E924 PolarHBondContact O-N 2.93Å; E924-T926 PolarHBondContact O-N 3.1Å; E924-L927 PolarHBondContact O-N 3.34Å; E924-V928 HydrophobicContact CB-CG2 4.48Å; E924-V928 WeakPolarHBondContact O-CG2 3.46Å; E924-V928 PolarHBondContact O-N 2.98Å
925	K	64.1	Low	68.3	Low	33 Å²	33	63.2 Å²	63.2	14%	0.143	32%	0.322	C	S	.	.	H	α-helix	trans	-53.7	-52.1	-167.9	-174.3	-178.8	-176.6	175	0	113.7	V852 H853 T922 M929	V852-K925 HydrophobicContact CG1-CD 3.67Å; V852-K925 HydrophobicContact CG1-CG 3.9Å; H853-K925 WeakPolarHBondContact NE2-CA 3.41Å; T922-K925 WeakPolarHBondContact O-CB 3.32Å; T922-K925 PolarHBondContact O-N 3.03Å; K925-M929 WeakPolarHBondContact O-CB 3.42Å; K925-M929 PolarHBondContact O-N 2.82Å
926	T	60.5	Low	68.2	Low	103 Å²	103	61.4 Å²	61.4	63%	0.632	31%	0.312	S	S	*	.	H	α-helix	trans	-65.1	-44.4	-171.3	-44.8	0	0	0	0	112.6	E924 E930	E924-T926 PolarHBondContact O-N 3.1Å; T926-E930 PolarHBondContact O-N 3.41Å
927	L	63.9	Low	68.2	Low	100 Å²	100	63 Å²	63	52%	0.524	31%	0.313	S	S	.	.	H	α-helix	trans	-68	-45.7	-176.7	-170.5	82.4	0	0	0	111.5	E924 E930 Q931	E924-L927 PolarHBondContact O-N 3.34Å; L927-E930 PolarHBondContact O-N 3.32Å; L927-Q931 PolarHBondContact O-N 3.16Å
928	V	65.6	Low	67.8	Low	59 Å²	59	69.5 Å²	69.5	36%	0.358	34%	0.343	S	S	.	.	H	α-helix	trans	-71.2	-36.6	-176.7	179.2	0	0	0	0	111.2	E924 Q931 R932	E924-V928 HydrophobicContact CB-CG2 4.48Å; E924-V928 WeakPolarHBondContact O-CG2 3.46Å; E924-V928 PolarHBondContact O-N 2.98Å; V928-Q931 PolarHBondContact O-N 2.88Å; V928-R932 WeakPolarHBondContact O-CB 3.38Å; V928-R932 PolarHBondContact O-N 3.05Å
929	M	64.9	Low	67.3	Low	60 Å²	60	71 Å²	71	30%	0.296	35%	0.35	S	S	.	.	H	α-helix	trans	-64.6	-39.2	176.9	-167.9	-179.6	80.8	0	0	112	K925 S933 D955	K925-M929 WeakPolarHBondContact O-CB 3.42Å; K925-M929 PolarHBondContact O-N 2.82Å; M929-S933 WeakPolarHBondContact O-CB 3.25Å; M929-S933 PolarHBondContact O-N 3.48Å; M929-D955 HydrophobicContact SD-CB 4.25Å
930	E	68.1	Low	67.2	Low	120 Å²	120	77.8 Å²	77.8	56%	0.561	38%	0.38	S	S	*	.	H	α-helix	trans	-67.8	-46.2	176.9	-173.6	170.9	-166.5	0	0	112.1	T926 L927 R932 S933 Q934	T926-E930 PolarHBondContact O-N 3.41Å; L927-E930 PolarHBondContact O-N 3.32Å; E930-R932 VanDerWaalsContact C-N 3.33Å; E930-R932 PolarHBondContact O-N 2.63Å; E930-S933 WeakPolarHBondContact O-CB 3.19Å; E930-S933 PolarHBondContact O-N 3.18Å; E930-S933 VanDerWaalsContact O-N 3.16Å; E930-Q934 WeakPolarHBondContact O-CG 3.48Å; E930-Q934 PolarHBondContact O-N 3.44Å
931	Q	70.1	Confident	67.3	Low	119 Å²	119	78.9 Å²	78.9	56%	0.556	38%	0.384	S	S	*	.	H	α-helix	trans	-58.8	-43.4	174.5	-72.5	-176	-20.8	0	0	112	L927 V928 S933 Q934 M935	L927-Q931 PolarHBondContact O-N 3.16Å; V928-Q931 PolarHBondContact O-N 2.88Å; Q931-S933 PolarHBondContact O-N 3.03Å; Q931-Q934 PolarHBondContact O-N 3.02Å; Q931-M935 PolarHBondContact O-N 2.92Å
932	R	68.8	Low	67.6	Low	43 Å²	43	80.8 Å²	80.8	16%	0.162	40%	0.399	C	S	.	.	H	α-helix	trans	-61	-43.2	174.4	-173.9	-176.9	-176.4	135	5.8	111.7	V928 E930 Q934 M935 L936 E949 E1120	V928-R932 WeakPolarHBondContact O-CB 3.38Å; V928-R932 PolarHBondContact O-N 3.05Å; E930-R932 VanDerWaalsContact C-N 3.33Å; E930-R932 PolarHBondContact O-N 2.63Å; R932-Q934 PolarHBondContact O-N 3.38Å; R932-M935 PolarHBondContact O-N 3.31Å; R932-L936 HydrophobicContact CG-CD1 4.07Å; R932-L936 HydrophobicContact CG-CG 4.45Å; R932-L936 VanDerWaalsContact O-CG 3.31Å; R932-L936 WeakPolarHBondContact O-CG 3.29Å; R932-L936 PolarHBondContact O-N 3.41Å; R932-E949 IonicContact CZ-OE1 2.88Å; R932-E949 IonicContact NE-OE1 3.89Å; R932-E949 PolarHBondContact NE-OE1 2.72Å; R932-E949 IonicContact NH2-OE1 2.78Å; R932-E949 PolarHBondContact NH2-OE1 3.47Å; R932-E1120 PolarHBondContact NH2-O 3.41Å
933	S	70.5	Confident	67.7	Low	55 Å²	55	88.3 Å²	88.3	39%	0.385	42%	0.424	S	S	.	.	H	α-helix	trans	-62.5	-40.5	178	-168.6	0	0	0	0	112.5	M929 E930 Q931 L936 K937	M929-S933 WeakPolarHBondContact O-CB 3.25Å; M929-S933 PolarHBondContact O-N 3.48Å; E930-S933 WeakPolarHBondContact O-CB 3.19Å; E930-S933 PolarHBondContact O-N 3.18Å; E930-S933 VanDerWaalsContact O-N 3.16Å; Q931-S933 PolarHBondContact O-N 3.03Å; S933-L936 PolarHBondContact O-N 3.37Å; S933-K937 WeakPolarHBondContact O-CG 3.38Å; S933-K937 PolarHBondContact O-N 3.2Å; S933-K937 VanDerWaalsContact O-N 3.14Å
934	Q	72.8	Confident	68.1	Low	104 Å²	104	86 Å²	86	49%	0.486	42%	0.423	S	S	.	.	H	α-helix	trans	-63.8	-43.9	173.9	-67.5	177.2	6.6	0	0	111.6	E930 Q931 R932 L936 K937 Q938	E930-Q934 WeakPolarHBondContact O-CG 3.48Å; E930-Q934 PolarHBondContact O-N 3.44Å; Q931-Q934 PolarHBondContact O-N 3.02Å; R932-Q934 PolarHBondContact O-N 3.38Å; Q934-L936 PolarHBondContact O-N 2.97Å; Q934-K937 PolarHBondContact O-N 2.8Å; Q934-Q938 PolarHBondContact O-N 3.28Å
935	M	74.1	Confident	68.6	Low	43 Å²	43	85.5 Å²	85.5	21%	0.212	42%	0.421	C	S	.	.	H	α-helix	trans	-61.6	-42.6	176.2	-167.9	-164.9	165	0	0	112.1	T687 Q931 R932 K937 Q938 M939 R1119	T687-M935 HydrophobicContact CG2-CE 4.21Å; Q931-M935 PolarHBondContact O-N 2.92Å; R932-M935 PolarHBondContact O-N 3.31Å; M935-K937 VanDerWaalsContact C-N 3.34Å; M935-K937 PolarHBondContact O-N 3.12Å; M935-Q938 PolarHBondContact O-N 2.84Å; M935-M939 HydrophobicContact CE-CE 3.88Å; M935-M939 HydrophobicContact CE-SD 4.04Å; M935-M939 HydrophobicContact CG-CE 3.96Å; M935-M939 PolarHBondContact O-N 3.29Å; M935-M939 HydrophobicContact SD-CE 4.26Å; M935-R1119 HydrophobicContact CE-CB 3.92Å; M935-R1119 HydrophobicContact CE-CG 4.17Å; M935-R1119 HydrophobicContact SD-CB 4.27Å; M935-R1119 HydrophobicContact SD-CG 4.14Å
936	L	68.8	Low	68.9	Low	33 Å²	33	89.4 Å²	89.4	17%	0.173	44%	0.435	C	S	.	.	H	α-helix	trans	-62.3	-38.7	177.3	-73.1	168.3	0	0	0	112.6	R932 S933 Q934 Q938 M939 L941 E949 V1121	R932-L936 HydrophobicContact CG-CD1 4.07Å; R932-L936 HydrophobicContact CG-CG 4.45Å; R932-L936 VanDerWaalsContact O-CG 3.31Å; R932-L936 WeakPolarHBondContact O-CG 3.29Å; R932-L936 PolarHBondContact O-N 3.41Å; S933-L936 PolarHBondContact O-N 3.37Å; Q934-L936 PolarHBondContact O-N 2.97Å; L936-Q938 VanDerWaalsContact C-N 3.33Å; L936-Q938 PolarHBondContact O-N 2.62Å; L936-M939 HydrophobicContact CD2-CE 3.85Å; L936-M939 HydrophobicContact CG-CE 4.41Å; L936-M939 PolarHBondContact O-N 2.89Å; L936-L941 HydrophobicContact CD2-CD1 3.56Å; L936-E949 WeakPolarHBondContact CD2-OE2 3.27Å; L936-V1121 HydrophobicContact CD2-CG2 3.83Å
937	K	71.3	Confident	69.3	Low	159 Å²	159	88.9 Å²	88.9	69%	0.691	43%	0.425	S	S	*	.	H	α-helix	trans	-62.9	-36.8	175.1	-72.2	172.7	-176.8	-179.9	0	112.6	S933 Q934 M935 M939	S933-K937 WeakPolarHBondContact O-CG 3.38Å; S933-K937 PolarHBondContact O-N 3.2Å; S933-K937 VanDerWaalsContact O-N 3.14Å; Q934-K937 PolarHBondContact O-N 2.8Å; M935-K937 VanDerWaalsContact C-N 3.34Å; M935-K937 PolarHBondContact O-N 3.12Å; K937-M939 VanDerWaalsContact C-N 3.27Å; K937-M939 PolarHBondContact O-N 3.12Å
938	Q	67.8	Low	69.5	Low	152 Å²	152	90.4 Å²	90.4	71%	0.71	42%	0.424	S	S	*	.	H	α-helix	trans	-69.9	-20.4	177.3	-68	174.3	-6.4	0	0	113.5	Q934 M935 L936	Q934-Q938 PolarHBondContact O-N 3.28Å; M935-Q938 PolarHBondContact O-N 2.84Å; L936-Q938 VanDerWaalsContact C-N 3.33Å; L936-Q938 PolarHBondContact O-N 2.62Å
939	M	62.8	Low	69.8	Low	31 Å²	31	87.7 Å²	87.7	15%	0.153	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	1.1	-173.9	-75.5	-171.9	-74.6	0	0	115.3	T687 K688 M935 L936 K937 L941 V1121	T687-M939 HydrophobicContact CG2-SD 4.37Å; T687-M939 PolarHBondContact OG1-SD 3.37Å; K688-M939 WeakPolarHBondContact CE-O 3.49Å; M935-M939 HydrophobicContact CE-CE 3.88Å; M935-M939 HydrophobicContact CE-SD 4.04Å; M935-M939 HydrophobicContact CG-CE 3.96Å; M935-M939 PolarHBondContact O-N 3.29Å; M935-M939 HydrophobicContact SD-CE 4.26Å; L936-M939 HydrophobicContact CD2-CE 3.85Å; L936-M939 HydrophobicContact CG-CE 4.41Å; L936-M939 PolarHBondContact O-N 2.89Å; K937-M939 VanDerWaalsContact C-N 3.27Å; K937-M939 PolarHBondContact O-N 3.12Å; M939-L941 VanDerWaalsContact C-N 3.31Å; M939-L941 HydrophobicContact CB-CG 4.42Å; M939-L941 PolarHBondContact O-N 3.38Å; M939-V1121 HydrophobicContact CE-CG2 3.78Å
940	H	68.4	Low	70	Confident	164 Å²	164	85 Å²	85	76%	0.759	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	41.6	57.3	-179.3	-64.9	-82.7	0	0	0	112.2	K688	K688-H940 PolarHBondContact NZ-O 3.06Å
941	L	69.1	Low	69.8	Low	32 Å²	32	79.4 Å²	79.4	17%	0.168	37%	0.368	C	S	.	.			trans	-74	137.2	173.4	-72.9	159.1	0	0	0	109.6	K688 L936 M939 E945 T1123	K688-L941 HydrophobicContact CD-CD2 3.71Å; K688-L941 HydrophobicContact CG-CD2 3.94Å; L936-L941 HydrophobicContact CD2-CD1 3.56Å; M939-L941 VanDerWaalsContact C-N 3.31Å; M939-L941 HydrophobicContact CB-CG 4.42Å; M939-L941 PolarHBondContact O-N 3.38Å; L941-E945 WeakPolarHBondContact CA-OE2 3.32Å; L941-E945 HydrophobicContact CB-CB 4.39Å; L941-E945 HydrophobicContact CD2-CB 3.89Å; L941-T1123 HydrophobicContact CD2-CG2 4.43Å
942	S	73.9	Confident	69.6	Low	51 Å²	51	74.6 Å²	74.6	36%	0.357	35%	0.348	S	S	.	.			trans	-68.5	161	169.1	80.2	0	0	0	0	110.2	T944 E945 R946	S942-T944 VanDerWaalsContact C-N 3.28Å; S942-T944 PolarHBondContact O-N 2.96Å; S942-T944 PolarHBondContact OG-OG1 3.4Å; S942-E945 PolarHBondContact N-OE2 2.86Å; S942-E945 PolarHBondContact O-N 3.11Å; S942-E945 VanDerWaalsContact O-N 3.13Å; S942-E945 WeakPolarHBondContact OG-CG 3.33Å; S942-E945 PolarHBondContact OG-N 3.3Å; S942-E945 VanDerWaalsContact OG-N 3.13Å; S942-R946 PolarHBondContact O-N 2.03Å
943	R	71.5	Confident	69.6	Low	189 Å²	189	74.2 Å²	74.2	71%	0.713	35%	0.348	S	S	*	.	H	α-helix	trans	-56.1	-43.5	177	-179.5	174	174.2	172.1	0.2	112.1	E945 R946 E947	R943-E945 PolarHBondContact O-N 2.95Å; R943-R946 PolarHBondContact O-N 2.99Å; R943-E947 VanDerWaalsContact CG-OE1 3.25Å; R943-E947 WeakPolarHBondContact CG-OE1 3.36Å; R943-E947 IonicContact CZ-OE1 3.08Å; R943-E947 IonicContact NE-OE1 3.69Å; R943-E947 PolarHBondContact NE-OE1 3.3Å; R943-E947 IonicContact NH2-OE1 3.51Å; R943-E947 WeakPolarHBondContact O-CG 3.32Å; R943-E947 PolarHBondContact O-N 2.91Å
944	T	72.5	Confident	69.4	Low	86 Å²	86	71.7 Å²	71.7	53%	0.528	33%	0.331	S	S	.	.	H	α-helix	trans	-72.2	-24	178.7	55	0	0	0	0	113.8	S942 R948	S942-T944 VanDerWaalsContact C-N 3.28Å; S942-T944 PolarHBondContact O-N 2.96Å; S942-T944 PolarHBondContact OG-OG1 3.4Å; T944-R948 WeakPolarHBondContact O-CD 3.49Å; T944-R948 WeakPolarHBondContact O-CG 3.28Å
945	E	70.2	Confident	69.3	Low	59 Å²	59	67.8 Å²	67.8	28%	0.276	31%	0.313	S	S	.	.	H	α-helix	trans	-73.7	-40.9	168.6	-73.2	176.1	156	0	0	111.2	K688 L941 S942 R943 R948 T1123	K688-E945 IonicContact NZ-OE1 3.34Å; K688-E945 IonicContact NZ-OE2 2.7Å; K688-E945 PolarHBondContact NZ-OE2 3.09Å; L941-E945 WeakPolarHBondContact CA-OE2 3.32Å; L941-E945 HydrophobicContact CB-CB 4.39Å; L941-E945 HydrophobicContact CD2-CB 3.89Å; S942-E945 PolarHBondContact N-OE2 2.86Å; S942-E945 PolarHBondContact O-N 3.11Å; S942-E945 VanDerWaalsContact O-N 3.13Å; S942-E945 WeakPolarHBondContact OG-CG 3.33Å; S942-E945 PolarHBondContact OG-N 3.3Å; S942-E945 VanDerWaalsContact OG-N 3.13Å; R943-E945 PolarHBondContact O-N 2.95Å; E945-R948 WeakPolarHBondContact O-CB 3.49Å; E945-R948 PolarHBondContact O-N 3.38Å; E945-R948 VanDerWaalsContact O-N 3.08Å; E945-T1123 HydrophobicContact CB-CG2 4.43Å
946	R	70.3	Confident	68.9	Low	116 Å²	116	71 Å²	71	44%	0.438	33%	0.327	S	S	.	.	H	α-helix	trans	-65.7	-40.7	178.5	-162	-177.5	89.1	-160	11.2	112.2	S942 R943 R948 E949 S952 E956	S942-R946 PolarHBondContact O-N 2.03Å; R943-R946 PolarHBondContact O-N 2.99Å; R946-R948 PolarHBondContact O-N 2.89Å; R946-R948 VanDerWaalsContact O-N 3.17Å; R946-E949 PolarHBondContact O-N 3.18Å; R946-S952 PolarHBondContact O-OG 3.43Å; R946-E956 IonicContact CZ-OE1 2.78Å; R946-E956 IonicContact NH2-OE1 2.67Å; R946-E956 PolarHBondContact NH2-OE1 3.16Å
947	E	69.1	Low	68.6	Low	91 Å²	91	70.1 Å²	70.1	43%	0.425	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-7.7	173.2	-70.2	165.1	-175.4	0	0	113	R943	R943-E947 VanDerWaalsContact CG-OE1 3.25Å; R943-E947 WeakPolarHBondContact CG-OE1 3.36Å; R943-E947 IonicContact CZ-OE1 3.08Å; R943-E947 IonicContact NE-OE1 3.69Å; R943-E947 PolarHBondContact NE-OE1 3.3Å; R943-E947 IonicContact NH2-OE1 3.51Å; R943-E947 WeakPolarHBondContact O-CG 3.32Å; R943-E947 PolarHBondContact O-N 2.91Å
948	R	69.8	Low	68.2	Low	132 Å²	132	63.8 Å²	63.8	50%	0.498	30%	0.296	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	-0.9	171.3	-69.7	173.9	-174.9	-176.6	3.1	114	F898 T944 E945 R946	F898-R948 WeakPolarHBondContact CE2-O 3.35Å; F898-R948 WeakPolarHBondContact CZ-O 3.09Å; T944-R948 WeakPolarHBondContact O-CD 3.49Å; T944-R948 WeakPolarHBondContact O-CG 3.28Å; E945-R948 WeakPolarHBondContact O-CB 3.49Å; E945-R948 PolarHBondContact O-N 3.38Å; E945-R948 VanDerWaalsContact O-N 3.08Å; R946-R948 PolarHBondContact O-N 2.89Å; R946-R948 VanDerWaalsContact O-N 3.17Å
949	E	72	Confident	67.7	Low	3 Å²	3	59.8 Å²	59.8	1%	0.014	28%	0.28	C	S	.	.			trans	-95.7	118.8	171.2	-178.1	178	177.5	0	0	110.3	R932 L936 R946 Q951 S952	R932-E949 IonicContact CZ-OE1 2.88Å; R932-E949 IonicContact NE-OE1 3.89Å; R932-E949 PolarHBondContact NE-OE1 2.72Å; R932-E949 IonicContact NH2-OE1 2.78Å; R932-E949 PolarHBondContact NH2-OE1 3.47Å; L936-E949 WeakPolarHBondContact CD2-OE2 3.27Å; R946-E949 PolarHBondContact O-N 3.18Å; E949-Q951 PolarHBondContact O-N 2.87Å; E949-S952 WeakPolarHBondContact CB-OG 3.2Å; E949-S952 PolarHBondContact O-OG 2.74Å
950	I	68.4	Low	67.2	Low	2 Å²	2	61.6 Å²	61.6	1%	0.01	30%	0.295	C	S	.	.	H	α-helix	trans	-70.2	-34.6	-168.5	-156.1	175.8	0	0	0	114.3	W850 M859 L895 F898 S952 I953 T954	W850-I950 HydrophobicContact CH2-CD1 4.09Å; W850-I950 HydrophobicContact CH2-CG1 4Å; W850-I950 HydrophobicContact CH2-CG2 4.11Å; W850-I950 HydrophobicContact CZ3-CD1 3.7Å; W850-I950 HydrophobicContact CZ3-CG1 4.11Å; M859-I950 HydrophobicContact CE-CD1 3.23Å; M859-I950 HydrophobicContact SD-CD1 3.33Å; M859-I950 WeakPolarHBondContact SD-CD1 3.5Å; L895-I950 HydrophobicContact CD2-CD1 3.68Å; L895-I950 HydrophobicContact CD2-CG1 3.96Å; F898-I950 HydrophobicContact CD1-CB 4.14Å; F898-I950 HydrophobicContact CD1-CD1 3.46Å; F898-I950 VanDerWaalsContact CD1-CD1 3.46Å; F898-I950 HydrophobicContact CD1-CG1 3.57Å; F898-I950 HydrophobicContact CD2-CG1 4.48Å; F898-I950 HydrophobicContact CE1-CB 3.49Å; F898-I950 VanDerWaalsContact CE1-CB 3.49Å; F898-I950 HydrophobicContact CE1-CD1 3.45Å; F898-I950 VanDerWaalsContact CE1-CD1 3.45Å; F898-I950 HydrophobicContact CE1-CG1 3.45Å; F898-I950 VanDerWaalsContact CE1-CG1 3.45Å; F898-I950 HydrophobicContact CE2-CB 4.16Å; F898-I950 HydrophobicContact CE2-CG1 4.36Å; F898-I950 HydrophobicContact CG-CD1 4.37Å; F898-I950 HydrophobicContact CG-CG1 4.09Å; F898-I950 HydrophobicContact CZ-CB 3.5Å; F898-I950 VanDerWaalsContact CZ-CB 3.5Å; F898-I950 HydrophobicContact CZ-CD1 4.33Å; F898-I950 HydrophobicContact CZ-CG1 3.87Å; I950-S952 VanDerWaalsContact C-N 3.32Å; I950-S952 PolarHBondContact O-N 2.93Å; I950-I953 PolarHBondContact O-N 3Å; I950-T954 PolarHBondContact O-N 3.19Å; I950-T954 PolarHBondContact O-OG1 3.13Å
951	Q	63.3	Low	66.2	Low	4 Å²	4	56.2 Å²	56.2	2%	0.019	27%	0.272	C	S	.	.	H	α-helix	trans	-64.8	-40.1	-175.4	-171.1	72	49.5	0	0	110.4	V852 E949 I953 T954 D955	V852-Q951 PolarHBondContact O-NE2 3.09Å; E949-Q951 PolarHBondContact O-N 2.87Å; Q951-I953 VanDerWaalsContact C-N 3.3Å; Q951-I953 PolarHBondContact O-N 2.81Å; Q951-T954 PolarHBondContact O-N 2.9Å; Q951-T954 PolarHBondContact O-OG1 3.43Å; Q951-D955 PolarHBondContact NE2-OD1 3.4Å; Q951-D955 WeakPolarHBondContact O-CB 3.46Å; Q951-D955 PolarHBondContact O-N 2.93Å
952	S	66.9	Low	65.2	Low	18 Å²	18	63 Å²	63	13%	0.126	30%	0.295	C	S	.	.	H	α-helix	trans	-58.4	-38.9	175.4	16.3	0	0	0	0	113	R946 E949 I950 D955 E956	R946-S952 PolarHBondContact O-OG 3.43Å; E949-S952 WeakPolarHBondContact CB-OG 3.2Å; E949-S952 PolarHBondContact O-OG 2.74Å; I950-S952 VanDerWaalsContact C-N 3.32Å; I950-S952 PolarHBondContact O-N 2.93Å; S952-D955 PolarHBondContact O-N 3.07Å; S952-E956 WeakPolarHBondContact O-CB 3.47Å; S952-E956 WeakPolarHBondContact O-CG 3.47Å; S952-E956 PolarHBondContact O-N 3.02Å
953	I	68.2	Low	63.9	Low	34 Å²	34	70.6 Å²	70.6	17%	0.174	32%	0.316	C	S	.	.	H	α-helix	trans	-66	-45.7	178.4	-63	168.5	0	0	0	110.4	D894 F898 I950 Q951 D955 E956 S957	D894-I953 HydrophobicContact CB-CG2 3.93Å; F898-I953 HydrophobicContact CB-CD1 4.38Å; F898-I953 HydrophobicContact CD2-CD1 3.25Å; F898-I953 HydrophobicContact CE2-CD1 3.74Å; F898-I953 HydrophobicContact CG-CD1 4.08Å; I950-I953 PolarHBondContact O-N 3Å; Q951-I953 VanDerWaalsContact C-N 3.3Å; Q951-I953 PolarHBondContact O-N 2.81Å; I953-D955 VanDerWaalsContact C-N 3.32Å; I953-D955 PolarHBondContact O-N 3.34Å; I953-E956 PolarHBondContact O-N 3.3Å; I953-S957 PolarHBondContact O-N 3.32Å; I953-S957 PolarHBondContact O-OG 3.02Å
954	T	67.1	Low	62.4	Low	2 Å²	2	69.5 Å²	69.5	1%	0.012	32%	0.316	C	S	.	.	H	α-helix	trans	-70.4	-27.4	176.4	48	0	0	0	0	113.7	W850 M891 L895 I950 Q951 S957 R958	W850-T954 HydrophobicContact CH2-CG2 3.33Å; W850-T954 WeakPolarHBondContact CH2-OG1 2.96Å; W850-T954 HydrophobicContact CZ2-CG2 4Å; W850-T954 WeakPolarHBondContact CZ2-OG1 3.49Å; W850-T954 HydrophobicContact CZ3-CG2 3.94Å; M891-T954 HydrophobicContact CG-CG2 4.49Å; M891-T954 HydrophobicContact SD-CG2 4.4Å; L895-T954 HydrophobicContact CD2-CG2 3.97Å; L895-T954 HydrophobicContact CG-CG2 4.49Å; I950-T954 PolarHBondContact O-N 3.19Å; I950-T954 PolarHBondContact O-OG1 3.13Å; Q951-T954 PolarHBondContact O-N 2.9Å; Q951-T954 PolarHBondContact O-OG1 3.43Å; T954-S957 PolarHBondContact O-OG 3.26Å; T954-R958 WeakPolarHBondContact O-CB 3.48Å; T954-R958 WeakPolarHBondContact O-CD 3.4Å; T954-R958 WeakPolarHBondContact O-CG 3.44Å; T954-R958 PolarHBondContact O-N 2.76Å
955	D	69.6	Low	60.9	Low	23 Å²	23	70.7 Å²	70.7	12%	0.123	32%	0.319	C	S	.	.	H	α-helix	trans	-76.8	-35.1	175.4	-65	-9.2	0	0	0	110.4	M929 Q951 S952 I953 N959	M929-D955 HydrophobicContact SD-CB 4.25Å; Q951-D955 PolarHBondContact NE2-OD1 3.4Å; Q951-D955 WeakPolarHBondContact O-CB 3.46Å; Q951-D955 PolarHBondContact O-N 2.93Å; S952-D955 PolarHBondContact O-N 3.07Å; I953-D955 VanDerWaalsContact C-N 3.32Å; I953-D955 PolarHBondContact O-N 3.34Å; D955-N959 WeakPolarHBondContact O-CB 3.37Å; D955-N959 VanDerWaalsContact O-CG 3.3Å; D955-N959 PolarHBondContact O-N 3.11Å; D955-N959 VanDerWaalsContact O-N 3.1Å; D955-N959 PolarHBondContact O-ND2 3.17Å
956	E	65.6	Low	59.4	Low	109 Å²	109	75.1 Å²	75.1	51%	0.509	34%	0.34	S	S	.	.	H	α-helix	trans	-66.3	-46.8	171.3	-77.6	-177.6	-175.9	0	0	111.6	R946 S952 I953 R958 N959 S960	R946-E956 IonicContact CZ-OE1 2.78Å; R946-E956 IonicContact NH2-OE1 2.67Å; R946-E956 PolarHBondContact NH2-OE1 3.16Å; S952-E956 WeakPolarHBondContact O-CB 3.47Å; S952-E956 WeakPolarHBondContact O-CG 3.47Å; S952-E956 PolarHBondContact O-N 3.02Å; I953-E956 PolarHBondContact O-N 3.3Å; E956-R958 VanDerWaalsContact C-N 3.31Å; E956-R958 PolarHBondContact O-N 2.93Å; E956-N959 PolarHBondContact O-N 3.29Å; E956-S960 PolarHBondContact O-N 3.08Å; E956-S960 VanDerWaalsContact O-N 3.09Å
957	S	62.1	Low	57.6	Low	15 Å²	15	72.3 Å²	72.3	11%	0.105	35%	0.347	C	S	.	.	H	α-helix	trans	-61.4	-38.6	-179.8	72.6	0	0	0	0	112.4	I953 T954 S960	I953-S957 PolarHBondContact O-N 3.32Å; I953-S957 PolarHBondContact O-OG 3.02Å; T954-S957 PolarHBondContact O-OG 3.26Å; S957-S960 PolarHBondContact O-OG 3.2Å
958	R	64.8	Low	56	Low	27 Å²	27	71.8 Å²	71.8	10%	0.102	36%	0.358	C	S	.	.	H	α-helix	trans	-68.3	-40	174.3	-72.4	178.5	144.2	119.9	9.8	113.9	V881 D886 T954 E956 S960	V881-R958 PolarHBondContact O-NH2 3.27Å; D886-R958 WeakPolarHBondContact OD1-CG 3.45Å; D886-R958 IonicContact OD1-NE 2.76Å; D886-R958 IonicContact OD2-CZ 2.86Å; D886-R958 VanDerWaalsContact OD2-CZ 3.26Å; D886-R958 IonicContact OD2-NE 3.79Å; D886-R958 PolarHBondContact OD2-NE 3.05Å; D886-R958 IonicContact OD2-NH2 2.72Å; D886-R958 PolarHBondContact OD2-NH2 3.09Å; T954-R958 WeakPolarHBondContact O-CB 3.48Å; T954-R958 WeakPolarHBondContact O-CD 3.4Å; T954-R958 WeakPolarHBondContact O-CG 3.44Å; T954-R958 PolarHBondContact O-N 2.76Å; E956-R958 VanDerWaalsContact C-N 3.31Å; E956-R958 PolarHBondContact O-N 2.93Å; R958-S960 VanDerWaalsContact C-N 3.32Å; R958-S960 PolarHBondContact O-N 3.04Å
959	N	57	Low	54.4	Low	68 Å²	68	71.4 Å²	71.4	36%	0.364	37%	0.371	S	S	.	.	H	α-helix	trans	-76.3	-18.5	-178.6	-76	-49.8	0	0	0	113.6	D955 E956 I961 R962	D955-N959 WeakPolarHBondContact O-CB 3.37Å; D955-N959 VanDerWaalsContact O-CG 3.3Å; D955-N959 PolarHBondContact O-N 3.11Å; D955-N959 VanDerWaalsContact O-N 3.1Å; D955-N959 PolarHBondContact O-ND2 3.17Å; E956-N959 PolarHBondContact O-N 3.29Å; N959-I961 VanDerWaalsContact C-N 3.31Å; N959-I961 PolarHBondContact O-N 3.37Å; N959-R962 PolarHBondContact O-N 3.19Å
960	S	51.7	Low	52.7	Low	68 Å²	68	78.9 Å²	78.9	48%	0.476	41%	0.406	S	S	.	.	H	α-helix	trans	-56.3	-38.5	-178.6	71.9	0	0	0	0	114.2	E956 S957 R958	E956-S960 PolarHBondContact O-N 3.08Å; E956-S960 VanDerWaalsContact O-N 3.09Å; S957-S960 PolarHBondContact O-OG 3.2Å; R958-S960 VanDerWaalsContact C-N 3.32Å; R958-S960 PolarHBondContact O-N 3.04Å
961	I	47.5	Very low	50.8	Low	52 Å²	52	86.4 Å²	86.4	27%	0.267	45%	0.446	S	S	.	.	H	α-helix	trans	-78.5	-35.7	179.9	-69.2	168.7	0	0	0	111.8	N887 N959 R963 K964 N965	N887-I961 HydrophobicContact CB-CD1 4Å; N959-I961 VanDerWaalsContact C-N 3.31Å; N959-I961 PolarHBondContact O-N 3.37Å; I961-R963 VanDerWaalsContact C-N 3.31Å; I961-R963 PolarHBondContact O-N 2.89Å; I961-K964 WeakPolarHBondContact O-CA 3.39Å; I961-K964 WeakPolarHBondContact O-CB 3.48Å; I961-K964 PolarHBondContact O-N 3.13Å; I961-N965 PolarHBondContact O-N 3.31Å
962	R	48.2	Very low	49.1	Very low	174 Å²	174	91.4 Å²	91.4	66%	0.657	48%	0.481	S	S	*	.	H	α-helix	trans	-62.8	-37.6	-175.4	-134.6	178	-168.8	-178.6	4.6	112.5	N959 Q966	N959-R962 PolarHBondContact O-N 3.19Å; R962-Q966 PolarHBondContact O-N 3.4Å
963	R	45.5	Very low	47.3	Very low	211 Å²	211	97.6 Å²	97.6	80%	0.796	51%	0.513	S	S	*	.	H	α-helix	trans	-67.5	-37.1	170	-77.7	-177.3	169.3	179.7	-4.2	112.7	I961 Q966 G967	I961-R963 VanDerWaalsContact C-N 3.31Å; I961-R963 PolarHBondContact O-N 2.89Å; R963-Q966 PolarHBondContact O-N 3.11Å; R963-G967 PolarHBondContact O-N 3.49Å
964	K	41.8	Very low	45.4	Very low	166 Å²	166	102.3 Å²	102.3	72%	0.722	54%	0.543	S	S	*	.	H	α-helix	trans	-70.5	-35.8	-178.3	-154.6	173.9	-173.7	179.3	0	112.8	I961	I961-K964 WeakPolarHBondContact O-CA 3.39Å; I961-K964 WeakPolarHBondContact O-CB 3.48Å; I961-K964 PolarHBondContact O-N 3.13Å
965	N	39.8	Very low	43.5	Very low	111 Å²	111	106.5 Å²	106.5	59%	0.594	57%	0.572	S	S	*	*	H	α-helix	trans	-77.3	-28.5	175.8	-74.8	1.2	0	0	0	113.2	I961 A968	I961-N965 PolarHBondContact O-N 3.31Å; N965-A968 PolarHBondContact O-N 2.94Å
966	Q	38.3	Very low	41.6	Very low	151 Å²	151	113.9 Å²	113.9	71%	0.706	61%	0.606	S	S	*	*	H	α-helix	trans	-69.5	-36.4	171.4	-77.5	-178.5	-37.6	0	0	112.2	R962 R963 A968 T969	R962-Q966 PolarHBondContact O-N 3.4Å; R963-Q966 PolarHBondContact O-N 3.11Å; Q966-A968 PolarHBondContact O-N 3.08Å; Q966-T969 PolarHBondContact O-OG1 3.24Å
967	G	33.9	Very low	39.7	Very low	57 Å²	57	117.6 Å²	117.6	59%	0.588	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.3	0.5	174.8	0	0	0	0	0	115.7	R963	R963-G967 PolarHBondContact O-N 3.49Å
968	A	34.2	Very low	38	Very low	80 Å²	80	122.1 Å²	122.1	66%	0.661	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	-5.8	-178.3	0	0	0	0	0	114.1	N965 Q966	N965-A968 PolarHBondContact O-N 2.94Å; Q966-A968 PolarHBondContact O-N 3.08Å
969	T	36.3	Very low	36.1	Very low	124 Å²	124	126.8 Å²	126.8	76%	0.761	69%	0.692	S	S	*	*	S	Bend	trans	-97.4	-5.3	-178	-3.5	0	0	0	0	114.4	Q966	Q966-T969 PolarHBondContact O-OG1 3.24Å
970	E	36.9	Very low	34.6	Very low	161 Å²	161	129.6 Å²	129.6	75%	0.752	71%	0.712	S	S	*	*	S	Bend	trans	-135.7	102	173.4	-71.3	-172.1	148.1	0	0	110.1
971	N	28.6	Very low	33.5	Very low	160 Å²	160	132.3 Å²	132.3	86%	0.856	73%	0.725	S	S	*	*			trans	155.3	84.4	140	-81.4	-38	0	0	0	112.3
972	S	28.3	Very low	32.5	Very low	109 Å²	109	139.2 Å²	139.2	76%	0.762	76%	0.756	S	S	*	*			trans	-85.1	99.5	145.5	55.1	0	0	0	0	108.8
973	N	27.4	Very low	31.4	Very low	148 Å²	148	138.3 Å²	138.3	79%	0.791	76%	0.764	S	S	*	*			trans	158.8	158	138.4	-78.9	-24.8	0	0	0	113.9
974	V	29.4	Very low	30.6	Very low	132 Å²	132	132.1 Å²	132.1	80%	0.8	76%	0.759	S	S	*	*			trans	78.9	80.7	167.3	-158.8	0	0	0	0	117.9
975	S	27.3	Very low	29.9	Very low	90 Å²	90	133.5 Å²	133.5	63%	0.629	77%	0.768	S	S	*	*			trans	0.8	137.9	133.7	53.9	0	0	0	0	121.8
976	Q	28.3	Very low	29.2	Very low	178 Å²	178	137.8 Å²	137.8	83%	0.832	78%	0.784	S	S	*	*			trans	58.2	121.6	138.6	-64.9	178	-18.1	0	0	117.9
977	Q	27.5	Very low	28.8	Very low	188 Å²	188	138.5 Å²	138.5	88%	0.879	79%	0.793	S	S	*	*				-161.9	173.7	65.3	-128.5	166.5	8.8	0	0	113.4
978	S	25.1	Very low	28.7	Very low	109 Å²	109	145.2 Å²	145.2	76%	0.762	81%	0.809	S	S	*	*			trans	-95.8	147.3	-170.8	53.1	0	0	0	0	115.3
979	S	25.4	Very low	28.3	Very low	125 Å²	125	145.7 Å²	145.7	87%	0.874	81%	0.813	S	S	*	*			trans	-161.9	162	139.4	51	0	0	0	0	112.1
980	T	25.4	Very low	28	Very low	128 Å²	128	149.3 Å²	149.3	79%	0.785	82%	0.821	S	S	*	*			trans	-101.8	147.7	-167.8	42.3	0	0	0	0	113.7
981	V	29	Very low	27.7	Very low	125 Å²	125	149.7 Å²	149.7	76%	0.758	83%	0.827	S	S	*	*			trans	24.2	116.5	138.6	-172.6	0	0	0	0	117.7
982	E	25.4	Very low	27.8	Very low	197 Å²	197	149.4 Å²	149.4	92%	0.921	82%	0.824	S	S	*	*				-158.6	160.4	121.8	-113.5	169	-160.2	0	0	111.6
983	D	26.4	Very low	27.8	Very low	154 Å²	154	152 Å²	152	82%	0.824	82%	0.824	S	S	*	*			trans	-93.9	165.1	-159.2	-97.9	-50.4	0	0	0	115.4
984	A	28.6	Very low	27.6	Very low	82 Å²	82	151.5 Å²	151.5	68%	0.678	82%	0.821	S	S	*	*			trans	60.3	99.9	150	0	0	0	0	0	119.8
985	Q	25.6	Very low	27.7	Very low	194 Å²	194	154.4 Å²	154.4	91%	0.907	82%	0.823	S	S	*	*				176.7	121.9	119.1	-98	172.4	-64.8	0	0	109.8
986	E	26.6	Very low	27.7	Very low	202 Å²	202	157.2 Å²	157.2	94%	0.944	83%	0.831	S	S	*	*			trans	174.4	80.8	149.1	-100.7	170.3	-163.2	0	0	109.9
987	D	29.9	Very low	27.6	Very low	166 Å²	166	155.6 Å²	155.6	89%	0.888	83%	0.833	S	S	*	*			trans	-104.9	152.2	147.9	-97.7	-43	0	0	0	106.5
988	E	30.4	Very low	27.6	Very low	198 Å²	198	153.4 Å²	153.4	93%	0.925	83%	0.833	S	S	*	*	S	Bend	trans	76.9	62.9	-174.2	-55.6	-160.6	143.4	0	0	118.5
989	A	26.5	Very low	27.6	Very low	90 Å²	90	151.9 Å²	151.9	74%	0.744	83%	0.827	S	S	*	*			trans	-169.8	96.8	136	0	0	0	0	0	113.1
990	Q	29.5	Very low	27.7	Very low	199 Å²	199	153.7 Å²	153.7	93%	0.93	82%	0.821	S	S	*	*			trans	-173.9	71.9	149	-105.5	158.6	53	0	0	112.6
991	L	30.2	Very low	27.8	Very low	169 Å²	169	154.4 Å²	154.4	89%	0.885	83%	0.826	S	S	*	*	S	Bend	trans	-125.4	138.9	148.5	-91	164.4	0	0	0	106.3
992	I	32.5	Very low	27.6	Very low	154 Å²	154	154.1 Å²	154.1	79%	0.79	82%	0.824	S	S	*	*			trans	89.6	123.2	-170.2	-51.1	159.3	0	0	0	112.8
993	H	26.7	Very low	27.8	Very low	164 Å²	164	152.9 Å²	152.9	76%	0.759	82%	0.821	S	S	*	*			trans	90.7	114.4	-165.6	-65.8	-68	0	0	0	114.3
994	D	25	Very low	27.7	Very low	138 Å²	138	153.2 Å²	153.2	74%	0.738	82%	0.823	S	S	*	*			cis	-141.9	141	0.1	-89	-48	0	0	0	113.7
995	K	30.1	Very low	27.6	Very low	193 Å²	193	156 Å²	156	84%	0.839	83%	0.826	S	S	*	*			trans	-86	110.3	147.2	-86	-179	173	178.9	0	106.7
996	N	26.8	Very low	27.6	Very low	149 Å²	149	156.5 Å²	156.5	80%	0.797	83%	0.825	S	S	*	*			trans	159.9	91	142.3	-82.7	-15.4	0	0	0	111.7
997	T	26.9	Very low	27.5	Very low	143 Å²	143	156.2 Å²	156.2	88%	0.877	82%	0.824	S	S	*	*			trans	-150.8	82	148.8	-35.2	0	0	0	0	111.1
998	T	27.5	Very low	27.2	Very low	142 Å²	142	157.3 Å²	157.3	87%	0.871	82%	0.824	S	S	*	*			trans	-80.7	117.5	153.3	44.2	0	0	0	0	108.6
999	A	25.4	Very low	27.1	Very low	77 Å²	77	153.3 Å²	153.3	64%	0.636	83%	0.825	S	S	*	*			trans	-171.7	138.1	150	0	0	0	0	0	113.6
1000	H	27.3	Very low	27	Very low	163 Å²	163	152 Å²	152	76%	0.755	82%	0.82	S	S	*	*			trans	57	88.9	153.8	-60.8	-54.8	0	0	0	120.5	T1002	H1000-T1002 PolarHBondContact O-N 3.02Å
1001	T	28.3	Very low	27	Very low	143 Å²	143	148.5 Å²	148.5	88%	0.877	81%	0.814	S	S	*	*				-53.7	120.1	127.8	46.6	0	0	0	0	111.1
1002	T	24.6	Very low	26.8	Very low	119 Å²	119	148.2 Å²	148.2	73%	0.73	81%	0.814	S	S	*	*			trans	-129.9	123.5	157.2	38.1	0	0	0	0	109.1	H1000	H1000-T1002 PolarHBondContact O-N 3.02Å
1003	M	30	Very low	26.7	Very low	171 Å²	171	152.1 Å²	152.1	84%	0.842	82%	0.819	S	S	*	*			trans	-68.9	134.3	172	-61.3	174.3	74	0	0	108.7
1004	N	23.4	Very low	27.4	Very low	161 Å²	161	149 Å²	149	86%	0.861	81%	0.811	S	S	*	*			trans	-146.1	97.4	159.7	-130.9	-8.5	0	0	0	109.8	K1006	N1004-K1006 PolarHBondContact O-N 2.93Å
1005	N	27.2	Very low	28	Very low	142 Å²	142	147.6 Å²	147.6	76%	0.759	80%	0.8	S	S	*	*			trans	-71.2	120.2	171.2	-75.4	-11.9	0	0	0	109
1006	K	24	Very low	29	Very low	203 Å²	203	140.2 Å²	140.2	88%	0.883	77%	0.769	S	S	*	*			trans	-134.7	115.8	150	-91.9	-172.2	173.7	-179.2	0	108.6	N1004 E1008	N1004-K1006 PolarHBondContact O-N 2.93Å; K1006-E1008 PolarHBondContact O-N 2.89Å
1007	E	25.1	Very low	30.3	Very low	196 Å²	196	134.2 Å²	134.2	92%	0.916	74%	0.737	S	S	*	*			trans	-77.8	115.6	172.7	-63.8	175.3	146.9	0	0	108.4
1008	E	23.7	Very low	31.5	Very low	189 Å²	189	129.3 Å²	129.3	88%	0.883	70%	0.703	S	S	*	*			trans	-96.5	124.3	158.1	-81.4	-169.9	146.4	0	0	108.8	K1006 G1010	K1006-E1008 PolarHBondContact O-N 2.89Å; E1008-G1010 PolarHBondContact O-N 2.76Å; E1008-G1010 VanDerWaalsContact O-N 3.13Å
1009	A	28.7	Very low	32.5	Very low	114 Å²	114	123.3 Å²	123.3	94%	0.942	67%	0.666	S	S	*	*			trans	-76.6	99.7	-175.4	0	0	0	0	0	111.5
1010	G	25	Very low	33.3	Very low	62 Å²	62	128.4 Å²	128.4	64%	0.639	67%	0.674	S	S	*	*			trans	-92.1	159.8	162.7	0	0	0	0	0	112.1	E1008	E1008-G1010 PolarHBondContact O-N 2.76Å; E1008-G1010 VanDerWaalsContact O-N 3.13Å
1011	P	27.8	Very low	33.9	Very low	126 Å²	126	125.7 Å²	125.7	82%	0.818	67%	0.665	S	S	*	*			trans	-68	150.7	-165.6	27.3	-35.8	0	0	0	114.6	R1013	P1011-R1013 PolarHBondContact O-N 3.2Å
1012	D	27.4	Very low	34.5	Very low	163 Å²	163	124.8 Å²	124.8	87%	0.872	65%	0.649	S	S	*	*			trans	-43.3	102.6	-173.2	-76.9	-45.7	0	0	0	115.3	V1014	D1012-V1014 PolarHBondContact O-N 2.73Å
1013	R	29.3	Very low	35.3	Very low	237 Å²	237	124.2 Å²	124.2	89%	0.894	64%	0.64	S	S	*	*			trans	-83.4	92.8	165	-83.2	-175	163	-179.3	-3.4	110.6	P1011 H1015	P1011-R1013 PolarHBondContact O-N 3.2Å; R1013-H1015 PolarHBondContact O-N 3.11Å
1014	V	41.8	Very low	35.6	Very low	98 Å²	98	119 Å²	119	59%	0.594	62%	0.621	S	S	*	*			trans	-53.3	121.9	174.8	-179	0	0	0	0	111.2	D1012 M1016	D1012-V1014 PolarHBondContact O-N 2.73Å; V1014-M1016 PolarHBondContact O-N 2.78Å
1015	H	37.3	Very low	36.3	Very low	109 Å²	109	115.8 Å²	115.8	51%	0.505	61%	0.607	S	S	.	*			trans	-83.1	111	-173.7	-151.5	72.2	0	0	0	112	R1013 T1017	R1013-H1015 PolarHBondContact O-N 3.11Å; H1015-T1017 PolarHBondContact O-N 2.85Å
1016	M	51.3	Low	36.9	Very low	38 Å²	38	114.5 Å²	114.5	19%	0.187	60%	0.597	C	S	.	*			trans	-86.4	111.8	-175.9	-66.1	-66.3	-77.2	0	0	111.8	V1014 R1058 R1059	V1014-M1016 PolarHBondContact O-N 2.78Å; M1016-R1058 HydrophobicContact CE-CB 4.09Å; M1016-R1059 HydrophobicContact CE-CG 3.8Å; M1016-R1059 PolarHBondContact O-NH2 2.86Å; M1016-R1059 VanDerWaalsContact O-NH2 3.1Å
1017	T	54.3	Low	37.8	Very low	23 Å²	23	114.1 Å²	114.1	14%	0.141	59%	0.59	C	S	.	*			trans	-122	159.2	-178.6	65.2	0	0	0	0	112.9	H1015 R1059	H1015-T1017 PolarHBondContact O-N 2.85Å; T1017-R1059 PolarHBondContact O-NH1 2.84Å
1018	W	51.7	Low	38.4	Very low	39 Å²	39	110.9 Å²	110.9	15%	0.148	58%	0.579	C	S	.	*	S	Bend	trans	-88.1	-0.8	-178.6	-74.6	101.1	0	0	0	114.6	R1059 P1088 G1093 Y1097	W1018-R1059 VanDerWaalsContact CD1-NH1 3.32Å; W1018-P1088 HydrophobicContact CB-CB 3.7Å; W1018-P1088 HydrophobicContact CD2-CB 3.83Å; W1018-P1088 HydrophobicContact CD2-CG 4.46Å; W1018-P1088 HydrophobicContact CE3-CB 4.32Å; W1018-P1088 HydrophobicContact CG-CB 3.57Å; W1018-G1093 WeakPolarHBondContact O-CA 3.25Å; W1018-Y1097 AromaticContact CH2-CD2 3.87Å; W1018-Y1097 HydrophobicContact CH2-CD2 3.87Å; W1018-Y1097 HydrophobicContact CZ2-CD2 4.42Å; W1018-Y1097 HydrophobicContact CZ3-CD2 4.28Å
1019	T	48.3	Very low	39.3	Very low	16 Å²	16	112.1 Å²	112.1	10%	0.098	58%	0.575	C	S	.	*	S	Bend	trans	-139.6	146.5	-167.3	48.4	0	0	0	0	113	D1021 N1090	T1019-D1021 PolarHBondContact O-N 3.2Å; T1019-N1090 HydrophobicContact CG2-CB 3.47Å; T1019-N1090 VanDerWaalsContact CG2-CB 3.47Å; T1019-N1090 PolarHBondContact OG1-ND2 3.11Å
1020	K	42.6	Very low	39.7	Very low	184 Å²	184	113.8 Å²	113.8	80%	0.8	57%	0.569	S	S	*	*	S	Bend	trans	-58	-37.6	-176.2	-167	175.7	-178.6	179.4	0	114.8
1021	D	40.8	Very low	40.4	Very low	107 Å²	107	121.3 Å²	121.3	57%	0.572	58%	0.577	S	S	*	*	H	α-helix	trans	-86.7	-24	-154	-49.4	-44.7	0	0	0	116.1	T1019 L1023 S1024 T1025	T1019-D1021 PolarHBondContact O-N 3.2Å; D1021-L1023 VanDerWaalsContact C-N 3.33Å; D1021-L1023 PolarHBondContact O-N 3.42Å; D1021-S1024 PolarHBondContact O-N 2.67Å; D1021-S1024 PolarHBondContact O-OG 3.33Å; D1021-T1025 PolarHBondContact O-N 2.84Å; D1021-T1025 PolarHBondContact O-OG1 2.97Å; D1021-T1025 VanDerWaalsContact O-OG1 3.07Å
1022	K	41	Very low	40.6	Very low	124 Å²	124	124 Å²	124	54%	0.539	58%	0.579	S	S	.	*	H	α-helix	trans	-66.8	-33.3	-177.2	-86	-164.7	170.9	-168.2	0	113.3	S1024 T1025 E1026	K1022-S1024 VanDerWaalsContact C-N 3.32Å; K1022-S1024 PolarHBondContact O-N 3.32Å; K1022-T1025 PolarHBondContact O-N 3.38Å; K1022-E1026 PolarHBondContact O-N 3.15Å; K1022-E1026 VanDerWaalsContact O-N 3.1Å
1023	L	41.2	Very low	41	Very low	106 Å²	106	122.3 Å²	122.3	56%	0.555	58%	0.577	S	S	*	*	H	α-helix	trans	-71.2	-29.5	-177.2	-160.6	133.6	0	0	0	111.9	D1021 R1027	D1021-L1023 VanDerWaalsContact C-N 3.33Å; D1021-L1023 PolarHBondContact O-N 3.42Å; L1023-R1027 VanDerWaalsContact O-CB 3.28Å; L1023-R1027 WeakPolarHBondContact O-CB 3.43Å; L1023-R1027 PolarHBondContact O-N 3.42Å
1024	S	35.2	Very low	41.1	Very low	62 Å²	62	119 Å²	119	43%	0.434	58%	0.577	S	S	.	*	H	α-helix	trans	-68.4	-38.7	169	24.2	0	0	0	0	112.8	D1021 K1022 R1027 N1028	D1021-S1024 PolarHBondContact O-N 2.67Å; D1021-S1024 PolarHBondContact O-OG 3.33Å; K1022-S1024 VanDerWaalsContact C-N 3.32Å; K1022-S1024 PolarHBondContact O-N 3.32Å; S1024-R1027 PolarHBondContact O-N 3.08Å; S1024-N1028 WeakPolarHBondContact O-CB 3.25Å; S1024-N1028 PolarHBondContact O-N 3.39Å
1025	T	39.9	Very low	40.8	Very low	94 Å²	94	118.4 Å²	118.4	58%	0.577	58%	0.582	S	S	*	*	H	α-helix	trans	-70.8	-39.5	-178.9	-34.6	0	0	0	0	112.1	D1021 K1022 R1029	D1021-T1025 PolarHBondContact O-N 2.84Å; D1021-T1025 PolarHBondContact O-OG1 2.97Å; D1021-T1025 VanDerWaalsContact O-OG1 3.07Å; K1022-T1025 PolarHBondContact O-N 3.38Å; T1025-R1029 PolarHBondContact O-N 3.34Å
1026	E	39.9	Very low	40.5	Very low	114 Å²	114	120.6 Å²	120.6	53%	0.533	60%	0.598	S	S	.	*	H	α-helix	trans	-67.9	-41.5	173.5	-74.6	177.8	151.9	0	0	111.9	K1022 N1028 R1029 N1030	K1022-E1026 PolarHBondContact O-N 3.15Å; K1022-E1026 VanDerWaalsContact O-N 3.1Å; E1026-N1028 VanDerWaalsContact C-N 3.28Å; E1026-N1028 PolarHBondContact O-N 3.01Å; E1026-R1029 WeakPolarHBondContact O-CB 3.4Å; E1026-R1029 PolarHBondContact O-N 3.46Å; E1026-N1030 PolarHBondContact O-N 2.85Å
1027	R	41.3	Very low	39.5	Very low	196 Å²	196	125.6 Å²	125.6	74%	0.74	63%	0.63	S	S	*	*	H	α-helix	trans	-65.4	-30.4	178.5	-165.8	170.7	-172.8	167.2	1.9	113.2	L1023 S1024	L1023-R1027 VanDerWaalsContact O-CB 3.28Å; L1023-R1027 WeakPolarHBondContact O-CB 3.43Å; L1023-R1027 PolarHBondContact O-N 3.42Å; S1024-R1027 PolarHBondContact O-N 3.08Å
1028	N	39.4	Very low	38.6	Very low	128 Å²	128	128.3 Å²	128.3	68%	0.684	66%	0.655	S	S	*	*	H	α-helix	trans	-78.7	-16.5	171.9	-79	-8.9	0	0	0	113.6	S1024 E1026	S1024-N1028 WeakPolarHBondContact O-CB 3.25Å; S1024-N1028 PolarHBondContact O-N 3.39Å; E1026-N1028 VanDerWaalsContact C-N 3.28Å; E1026-N1028 PolarHBondContact O-N 3.01Å
1029	R	40.6	Very low	38	Very low	214 Å²	214	133 Å²	133	81%	0.808	69%	0.688	S	S	*	*	H	α-helix	trans	-79.3	-23.7	178.6	-154.6	173.5	-176.2	-173.5	-1.4	112.9	T1025 E1026 R1031	T1025-R1029 PolarHBondContact O-N 3.34Å; E1026-R1029 WeakPolarHBondContact O-CB 3.4Å; E1026-R1029 PolarHBondContact O-N 3.46Å; R1029-R1031 VanDerWaalsContact C-N 3.35Å; R1029-R1031 PolarHBondContact O-N 3.18Å
1030	N	38.9	Very low	37.2	Very low	150 Å²	150	142.9 Å²	142.9	80%	0.802	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.5	29.6	179.2	-71.1	5	0	0	0	113.9	E1026	E1026-N1030 PolarHBondContact O-N 2.85Å
1031	R	39.3	Very low	36.6	Very low	219 Å²	219	141.1 Å²	141.1	83%	0.826	72%	0.723	S	S	*	*			trans	-124.1	92.5	168.5	-98.1	-175.9	165.7	177.3	-5.2	110	R1029	R1029-R1031 VanDerWaalsContact C-N 3.35Å; R1029-R1031 PolarHBondContact O-N 3.18Å
1032	E	32.5	Very low	36.2	Very low	183 Å²	183	143.2 Å²	143.2	86%	0.855	73%	0.733	S	S	*	*			trans	-69.2	143.5	165.1	-68.6	-169.8	143.4	0	0	110.8	N1034	E1032-N1034 PolarHBondContact O-N 2.84Å
1033	P	35.8	Very low	35.9	Very low	127 Å²	127	146.3 Å²	146.3	83%	0.825	75%	0.747	S	S	*	*			trans	-89.9	93.5	179.5	34.5	-32.1	0	0	0	111.3
1034	N	30	Very low	35.4	Very low	167 Å²	167	148.5 Å²	148.5	89%	0.893	76%	0.759	S	S	*	*			trans	-84.3	120.2	165.4	-109.8	-22	0	0	0	110.2	E1032	E1032-N1034 PolarHBondContact O-N 2.84Å
1035	A	36.7	Very low	35.3	Very low	86 Å²	86	154.7 Å²	154.7	71%	0.711	78%	0.783	S	S	*	*			trans	-83.4	116	-178	0	0	0	0	0	111.6
1036	N	29.4	Very low	34.8	Very low	155 Å²	155	157 Å²	157	83%	0.829	79%	0.785	S	S	*	*			trans	174.7	161.3	130.6	-93.1	-37.7	0	0	0	113.2
1037	V	31.5	Very low	34.6	Very low	143 Å²	143	155.7 Å²	155.7	87%	0.867	79%	0.787	S	S	*	*			trans	76.1	120	171.5	-167.6	0	0	0	0	116.3
1038	A	34.5	Very low	34.1	Very low	81 Å²	81	154.6 Å²	154.6	67%	0.669	79%	0.79	S	S	*	*			trans	-96.9	165.4	170.5	0	0	0	0	0	111.6
1039	V	40.1	Very low	33.9	Very low	137 Å²	137	158.4 Å²	158.4	83%	0.83	80%	0.795	S	S	*	*			trans	69	82.4	164.4	-163.7	0	0	0	0	116.7
1040	R	31.3	Very low	33.5	Very low	224 Å²	224	155.6 Å²	155.6	85%	0.845	79%	0.791	S	S	*	*				173.3	113	128	-101.4	171.2	-179	163.5	-0.1	110.8
1041	D	30	Very low	33.4	Very low	147 Å²	147	153.4 Å²	153.4	79%	0.786	79%	0.788	S	S	*	*				-177.4	121.9	88.4	-92.6	-26.1	0	0	0	111.7
1042	L	31.8	Very low	33.1	Very low	150 Å²	150	148.1 Å²	148.1	79%	0.785	78%	0.775	S	S	*	*			trans	-74	151.1	157.9	-152.4	74.5	0	0	0	106.9
1043	F	35.1	Very low	34	Very low	189 Å²	189	143.5 Å²	143.5	83%	0.829	76%	0.756	S	S	*	*			trans	80.5	74.3	-176.1	-55.6	-79.7	0	0	0	117.5
1044	N	29.4	Very low	34.4	Very low	152 Å²	152	144.1 Å²	144.1	81%	0.813	75%	0.748	S	S	*	*			trans	-151.7	80.6	134.7	-133.6	-19.3	0	0	0	112.1	K1046	N1044-K1046 PolarHBondContact O-N 2.82Å; N1044-K1046 VanDerWaalsContact O-N 3.1Å
1045	M	33.7	Very low	35.3	Very low	192 Å²	192	137.9 Å²	137.9	95%	0.946	72%	0.718	S	S	*	*			trans	-76	91.1	167.5	-78.4	172.2	70.1	0	0	109.3
1046	K	30.4	Very low	36.1	Very low	142 Å²	142	135.6 Å²	135.6	62%	0.617	69%	0.693	S	S	*	*			trans	-82	137.2	156.5	-96.2	-170.6	154.8	-146.6	0	109	N1044 E1050	N1044-K1046 PolarHBondContact O-N 2.82Å; N1044-K1046 VanDerWaalsContact O-N 3.1Å; K1046-E1050 IonicContact NZ-OE1 3.75Å; K1046-E1050 IonicContact NZ-OE2 2.75Å; K1046-E1050 PolarHBondContact NZ-OE2 3.29Å
1047	P	35.3	Very low	37.4	Very low	87 Å²	87	132.2 Å²	132.2	57%	0.565	68%	0.678	S	S	*	*			trans	-79.3	150.4	-175.2	34.4	-37.1	0	0	0	112.2	W1049	P1047-W1049 PolarHBondContact O-N 3.41Å
1048	E	30.4	Very low	38.6	Very low	174 Å²	174	131.2 Å²	131.2	81%	0.813	66%	0.659	S	S	*	*	G	3₁₀ helix	trans	-65.6	-6.1	-165.4	-66.9	177.4	114.2	0	0	116.6	E1050 S1051	E1048-E1050 VanDerWaalsContact C-N 3.31Å; E1048-E1050 PolarHBondContact O-N 3.48Å; E1048-S1051 PolarHBondContact O-N 3.25Å; E1048-S1051 PolarHBondContact O-OG 3.2Å
1049	W	35	Very low	39.9	Very low	208 Å²	208	127.9 Å²	127.9	79%	0.788	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-64.8	-24.4	-170.9	-50.3	102.1	0	0	0	114.9	P1047 S1051	P1047-W1049 PolarHBondContact O-N 3.41Å; W1049-S1051 PolarHBondContact O-N 2.94Å
1050	E	31.6	Very low	41	Very low	154 Å²	154	124.9 Å²	124.9	72%	0.72	61%	0.607	S	S	*	*	G	3₁₀ helix	trans	-71.4	-4	-179.5	-68.4	-174.2	140.1	0	0	113.9	K1046 E1048	K1046-E1050 IonicContact NZ-OE1 3.75Å; K1046-E1050 IonicContact NZ-OE2 2.75Å; K1046-E1050 PolarHBondContact NZ-OE2 3.29Å; E1048-E1050 VanDerWaalsContact C-N 3.31Å; E1048-E1050 PolarHBondContact O-N 3.48Å
1051	S	36.8	Very low	42.8	Very low	104 Å²	104	119.4 Å²	119.4	73%	0.727	59%	0.591	S	S	*	*	G	3₁₀ helix	trans	-99.6	-2.9	-174.1	68.8	0	0	0	0	116	E1048 W1049	E1048-S1051 PolarHBondContact O-N 3.25Å; E1048-S1051 PolarHBondContact O-OG 3.2Å; W1049-S1051 PolarHBondContact O-N 2.94Å
1052	L	34.3	Very low	45	Very low	109 Å²	109	112.6 Å²	112.6	57%	0.571	56%	0.555	S	S	*	*	S	Bend	trans	-83.3	121.5	-175.4	-86.9	155.2	0	0	0	114.1	Q1054	L1052-Q1054 PolarHBondContact O-N 3.25Å
1053	N	51	Low	47.2	Very low	85 Å²	85	105.5 Å²	105.5	46%	0.455	52%	0.517	S	S	.	.			trans	62.7	24.1	144	-62.7	-13	0	0	0	121.5	S1055 N1056 V1057	N1053-S1055 VanDerWaalsContact C-N 3.3Å; N1053-S1055 PolarHBondContact O-N 3.49Å; N1053-S1055 VanDerWaalsContact O-N 3.12Å; N1053-N1056 PolarHBondContact O-N 2.65Å; N1053-V1057 HydrophobicContact CB-CG2 3.87Å; N1053-V1057 VanDerWaalsContact O-CB 3.3Å; N1053-V1057 WeakPolarHBondContact O-CB 3.47Å; N1053-V1057 VanDerWaalsContact O-CG2 3.27Å; N1053-V1057 WeakPolarHBondContact O-CG2 3.49Å; N1053-V1057 PolarHBondContact O-N 2.85Å
1054	Q	44.2	Very low	49.5	Very low	141 Å²	141	99.3 Å²	99.3	66%	0.659	50%	0.495	S	S	*	.	H	α-helix	trans	-53.5	-36.3	179.6	-76.2	-167.3	-0.5	0	0	115.8	L1052 R1058	L1052-Q1054 PolarHBondContact O-N 3.25Å; Q1054-R1058 WeakPolarHBondContact O-CB 3.45Å; Q1054-R1058 WeakPolarHBondContact O-CD 3.4Å; Q1054-R1058 WeakPolarHBondContact O-CG 3.24Å; Q1054-R1058 PolarHBondContact O-N 2.81Å
1055	S	49.6	Very low	52.2	Low	35 Å²	35	95.3 Å²	95.3	25%	0.245	47%	0.47	C	S	.	.	H	α-helix	trans	-77.5	-43.2	179.1	51.4	0	0	0	0	113.4	N1053 R1058 R1059	N1053-S1055 VanDerWaalsContact C-N 3.3Å; N1053-S1055 PolarHBondContact O-N 3.49Å; N1053-S1055 VanDerWaalsContact O-N 3.12Å; S1055-R1058 PolarHBondContact O-N 3.05Å; S1055-R1059 PolarHBondContact O-N 3.23Å
1056	N	53	Low	54.7	Low	38 Å²	38	86.3 Å²	86.3	20%	0.203	43%	0.426	C	S	.	.	H	α-helix	trans	-69	-42.8	177.8	-78.2	3.6	0	0	0	111.5	N1053 R1058 R1059 M1060 N1096	N1053-N1056 PolarHBondContact O-N 2.65Å; N1056-R1058 VanDerWaalsContact C-N 3.32Å; N1056-R1058 PolarHBondContact O-N 3.25Å; N1056-R1059 PolarHBondContact O-N 2.92Å; N1056-R1059 VanDerWaalsContact O-N 3.12Å; N1056-M1060 PolarHBondContact O-N 3.47Å; N1056-N1096 PolarHBondContact ND2-OD1 3.2Å
1057	V	55.5	Low	57.5	Low	85 Å²	85	80.3 Å²	80.3	52%	0.515	40%	0.401	S	S	.	.	H	α-helix	trans	-59.4	-42.6	174.7	171.3	0	0	0	0	110.7	N1053 R1059 M1060 H1061	N1053-V1057 HydrophobicContact CB-CG2 3.87Å; N1053-V1057 VanDerWaalsContact O-CB 3.3Å; N1053-V1057 WeakPolarHBondContact O-CB 3.47Å; N1053-V1057 VanDerWaalsContact O-CG2 3.27Å; N1053-V1057 WeakPolarHBondContact O-CG2 3.49Å; N1053-V1057 PolarHBondContact O-N 2.85Å; V1057-R1059 VanDerWaalsContact C-N 3.33Å; V1057-R1059 PolarHBondContact O-N 3.16Å; V1057-M1060 PolarHBondContact O-N 3.32Å; V1057-H1061 WeakPolarHBondContact O-CB 3.45Å; V1057-H1061 PolarHBondContact O-N 3.11Å
1058	R	57.5	Low	60	Low	121 Å²	121	82 Å²	82	46%	0.457	40%	0.401	S	S	.	.	H	α-helix	trans	-60.9	-38.1	175.3	-77.9	173.3	-172.3	-168.1	4.3	112.8	M1016 Q1054 S1055 N1056 T1062	M1016-R1058 HydrophobicContact CE-CB 4.09Å; Q1054-R1058 WeakPolarHBondContact O-CB 3.45Å; Q1054-R1058 WeakPolarHBondContact O-CD 3.4Å; Q1054-R1058 WeakPolarHBondContact O-CG 3.24Å; Q1054-R1058 PolarHBondContact O-N 2.81Å; S1055-R1058 PolarHBondContact O-N 3.05Å; N1056-R1058 VanDerWaalsContact C-N 3.32Å; N1056-R1058 PolarHBondContact O-N 3.25Å; R1058-T1062 PolarHBondContact O-N 3.45Å; R1058-T1062 PolarHBondContact O-OG1 3.19Å
1059	R	61.2	Low	62.9	Low	11 Å²	11	76 Å²	76	4%	0.042	38%	0.376	C	S	.	.	H	α-helix	trans	-75.6	-34	177.8	-73.8	-178.6	170.8	-174.3	-3.4	113.8	M1016 T1017 W1018 S1055 N1056 V1057 T1062 A1063	M1016-R1059 HydrophobicContact CE-CG 3.8Å; M1016-R1059 PolarHBondContact O-NH2 2.86Å; M1016-R1059 VanDerWaalsContact O-NH2 3.1Å; T1017-R1059 PolarHBondContact O-NH1 2.84Å; W1018-R1059 VanDerWaalsContact CD1-NH1 3.32Å; S1055-R1059 PolarHBondContact O-N 3.23Å; N1056-R1059 PolarHBondContact O-N 2.92Å; N1056-R1059 VanDerWaalsContact O-N 3.12Å; V1057-R1059 VanDerWaalsContact C-N 3.33Å; V1057-R1059 PolarHBondContact O-N 3.16Å; R1059-T1062 VanDerWaalsContact O-CB 3.3Å; R1059-T1062 WeakPolarHBondContact O-CB 3.31Å; R1059-T1062 PolarHBondContact O-N 3.38Å; R1059-A1063 PolarHBondContact O-N 2.87Å; R1059-A1063 VanDerWaalsContact O-N 3.1Å
1060	M	64.3	Low	65.6	Low	75 Å²	75	66.4 Å²	66.4	37%	0.369	34%	0.34	S	S	.	.	H	α-helix	trans	-64.5	-45.2	168	-77.8	-176.3	149.9	0	0	111	N1056 V1057 T1062 A1063 V1064 E1099	N1056-M1060 PolarHBondContact O-N 3.47Å; V1057-M1060 PolarHBondContact O-N 3.32Å; M1060-T1062 PolarHBondContact O-N 3.4Å; M1060-A1063 WeakPolarHBondContact O-CB 3.42Å; M1060-A1063 PolarHBondContact O-N 2.67Å; M1060-V1064 WeakPolarHBondContact O-CG2 3.41Å; M1060-V1064 PolarHBondContact O-N 3.09Å; M1060-E1099 HydrophobicContact CE-CB 3.84Å; M1060-E1099 HydrophobicContact CE-CG 4.38Å; M1060-E1099 WeakPolarHBondContact CE-OE2 3.48Å
1061	H	69.4	Low	68.4	Low	108 Å²	108	60.3 Å²	60.3	50%	0.5	31%	0.314	S	S	.	.	H	α-helix	trans	-61.5	-31.4	175.9	-167.7	-84.6	0	0	0	112.9	V1057 K1065	V1057-H1061 WeakPolarHBondContact O-CB 3.45Å; V1057-H1061 PolarHBondContact O-N 3.11Å; H1061-K1065 WeakPolarHBondContact O-CG 3.42Å; H1061-K1065 PolarHBondContact O-N 3.18Å
1062	T	74.6	Confident	71.1	Confident	5 Å²	5	62.1 Å²	62.1	3%	0.031	32%	0.315	C	S	.	.	H	α-helix	trans	-62.4	-50.7	169.1	-58.6	0	0	0	0	111	N916 D917 R1058 R1059 M1060 L1066	N916-T1062 PolarHBondContact O-OG1 3.24Å; N916-T1062 VanDerWaalsContact O-OG1 3.06Å; D917-T1062 WeakPolarHBondContact O-CG2 3.43Å; R1058-T1062 PolarHBondContact O-N 3.45Å; R1058-T1062 PolarHBondContact O-OG1 3.19Å; R1059-T1062 VanDerWaalsContact O-CB 3.3Å; R1059-T1062 WeakPolarHBondContact O-CB 3.31Å; R1059-T1062 PolarHBondContact O-N 3.38Å; M1060-T1062 PolarHBondContact O-N 3.4Å; T1062-L1066 PolarHBondContact O-N 3.33Å; T1062-L1066 VanDerWaalsContact O-N 3.12Å
1063	A	78.2	Confident	73.8	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-62.7	-44.2	179.2	0	0	0	0	0	112.6	R1059 M1060 L1066 N1067 F1100 V1103	R1059-A1063 PolarHBondContact O-N 2.87Å; R1059-A1063 VanDerWaalsContact O-N 3.1Å; M1060-A1063 WeakPolarHBondContact O-CB 3.42Å; M1060-A1063 PolarHBondContact O-N 2.67Å; A1063-L1066 PolarHBondContact O-N 2.97Å; A1063-N1067 WeakPolarHBondContact O-CB 3.29Å; A1063-N1067 PolarHBondContact O-N 3.05Å; A1063-F1100 HydrophobicContact CB-CD2 3.72Å; A1063-F1100 HydrophobicContact CB-CE2 3.69Å; A1063-F1100 HydrophobicContact CB-CG 4.26Å; A1063-F1100 HydrophobicContact CB-CZ 4.18Å; A1063-V1103 HydrophobicContact CB-CB 4.32Å; A1063-V1103 HydrophobicContact CB-CG1 3.91Å
1064	V	84.5	Confident	75.8	Confident	60 Å²	60	56.1 Å²	56.1	36%	0.364	28%	0.281	S	S	.	.	H	α-helix	trans	-58	-53.7	178.6	172	0	0	0	0	110.6	M1060 L1066 N1067 E1068 V1103	M1060-V1064 WeakPolarHBondContact O-CG2 3.41Å; M1060-V1064 PolarHBondContact O-N 3.09Å; V1064-L1066 PolarHBondContact O-N 3.45Å; V1064-N1067 PolarHBondContact O-N 3.45Å; V1064-N1067 VanDerWaalsContact O-N 3.16Å; V1064-E1068 HydrophobicContact CG1-CG 4.39Å; V1064-E1068 WeakPolarHBondContact O-CG 3.34Å; V1064-E1068 PolarHBondContact O-N 3.14Å; V1064-V1103 HydrophobicContact CB-CG1 4.49Å; V1064-V1103 HydrophobicContact CG2-CG1 3.61Å
1065	K	85.1	Confident	77.9	Confident	67 Å²	67	56.2 Å²	56.2	29%	0.291	28%	0.281	S	S	.	.	H	α-helix	trans	-59.3	-43.2	178.8	-81.3	178.5	158.2	-170.8	0	113.4	D917 H1061 N1067 E1068 V1069	D917-K1065 HydrophobicContact CB-CD 4.21Å; D917-K1065 WeakPolarHBondContact OD1-CD 3.43Å; D917-K1065 IonicContact OD1-NZ 3.19Å; D917-K1065 PolarHBondContact OD1-NZ 3.35Å; D917-K1065 WeakPolarHBondContact OD2-CD 3.38Å; D917-K1065 IonicContact OD2-NZ 2.69Å; D917-K1065 PolarHBondContact OD2-NZ 2.92Å; H1061-K1065 WeakPolarHBondContact O-CG 3.42Å; H1061-K1065 PolarHBondContact O-N 3.18Å; K1065-N1067 VanDerWaalsContact C-N 3.32Å; K1065-E1068 PolarHBondContact O-N 2.95Å; K1065-V1069 WeakPolarHBondContact O-CG2 3.4Å; K1065-V1069 PolarHBondContact O-N 3.43Å
1066	L	85.9	Confident	79.6	Confident	3 Å²	3	58 Å²	58	2%	0.016	31%	0.306	C	S	.	.	H	α-helix	trans	-64.6	-41.4	177.8	-176.9	59.3	0	0	0	110.3	M913 F921 T1062 A1063 V1064 V1069 V1070 L1104	M913-L1066 HydrophobicContact CE-CB 4.39Å; M913-L1066 HydrophobicContact CE-CD1 3.94Å; M913-L1066 HydrophobicContact SD-CD1 3.68Å; F921-L1066 HydrophobicContact CD2-CD2 4.48Å; F921-L1066 HydrophobicContact CE2-CD2 3.71Å; F921-L1066 HydrophobicContact CZ-CD2 4.47Å; T1062-L1066 PolarHBondContact O-N 3.33Å; T1062-L1066 VanDerWaalsContact O-N 3.12Å; A1063-L1066 PolarHBondContact O-N 2.97Å; V1064-L1066 PolarHBondContact O-N 3.45Å; L1066-V1069 PolarHBondContact O-N 3.2Å; L1066-V1070 HydrophobicContact CD1-CG2 4.47Å; L1066-V1070 VanDerWaalsContact O-CG2 3.23Å; L1066-V1070 WeakPolarHBondContact O-CG2 3.49Å; L1066-V1070 PolarHBondContact O-N 3.4Å; L1066-L1104 HydrophobicContact CB-CD1 4.16Å; L1066-L1104 HydrophobicContact CD2-CD1 3.68Å; L1066-L1104 HydrophobicContact CG-CD1 3.8Å
1067	N	89.9	Confident	81.4	Confident	17 Å²	17	56.9 Å²	56.9	9%	0.091	30%	0.301	C	S	.	.	H	α-helix	trans	-65.3	-43.1	176	-168	39.7	0	0	0	112.7	A1063 V1064 K1065 V1069 V1070 V1071 V1103 L1104 E1106	A1063-N1067 WeakPolarHBondContact O-CB 3.29Å; A1063-N1067 PolarHBondContact O-N 3.05Å; V1064-N1067 PolarHBondContact O-N 3.45Å; V1064-N1067 VanDerWaalsContact O-N 3.16Å; K1065-N1067 VanDerWaalsContact C-N 3.32Å; N1067-V1069 VanDerWaalsContact C-N 3.26Å; N1067-V1069 PolarHBondContact O-N 3Å; N1067-V1070 PolarHBondContact O-N 2.97Å; N1067-V1070 VanDerWaalsContact O-N 3.14Å; N1067-V1071 WeakPolarHBondContact O-CB 3.35Å; N1067-V1071 WeakPolarHBondContact O-CG2 3.22Å; N1067-V1071 PolarHBondContact O-N 3.46Å; N1067-V1071 WeakPolarHBondContact OD1-CG2 3.16Å; N1067-V1103 WeakPolarHBondContact CB-O 3.12Å; N1067-V1103 VanDerWaalsContact CG-O 3.25Å; N1067-V1103 PolarHBondContact ND2-O 3.41Å; N1067-L1104 PolarHBondContact OD1-O 3.18Å; N1067-E1106 PolarHBondContact ND2-O 2.86Å; N1067-E1106 PolarHBondContact OD1-O 3.28Å
1068	E	88.8	Confident	83.2	Confident	123 Å²	123	55.1 Å²	55.1	58%	0.575	29%	0.287	S	S	*	.	H	α-helix	trans	-53.1	-44.9	175.1	-76.4	173.2	-179.8	0	0	111.5	V1064 K1065 N1072	V1064-E1068 HydrophobicContact CG1-CG 4.39Å; V1064-E1068 WeakPolarHBondContact O-CG 3.34Å; V1064-E1068 PolarHBondContact O-N 3.14Å; K1065-E1068 PolarHBondContact O-N 2.95Å; E1068-N1072 WeakPolarHBondContact O-CB 3.38Å; E1068-N1072 PolarHBondContact O-N 3.09Å
1069	V	90.5	Very high	84.9	Confident	46 Å²	46	49.3 Å²	49.3	28%	0.279	27%	0.265	S	S	.	.	H	α-helix	trans	-68.3	-42.1	177.7	173.3	0	0	0	0	112.1	W849 V911 K1065 L1066 N1067 K1073	W849-V1069 HydrophobicContact CH2-CG1 3.88Å; W849-V1069 HydrophobicContact CZ3-CG1 4.19Å; V911-V1069 HydrophobicContact CG1-CG1 3.91Å; K1065-V1069 WeakPolarHBondContact O-CG2 3.4Å; K1065-V1069 PolarHBondContact O-N 3.43Å; L1066-V1069 PolarHBondContact O-N 3.2Å; N1067-V1069 VanDerWaalsContact C-N 3.26Å; N1067-V1069 PolarHBondContact O-N 3Å; V1069-K1073 PolarHBondContact O-N 3.08Å
1070	V	90.8	Very high	86.6	Confident	7 Å²	7	49 Å²	49	4%	0.042	26%	0.264	C	S	.	.	H	α-helix	trans	-65.1	-50.3	178	172.6	0	0	0	0	111	W849 L1066 N1067 K1073 S1074 V1080 L1108	W849-V1070 HydrophobicContact CD2-CG2 3.76Å; W849-V1070 HydrophobicContact CE3-CG2 3.89Å; W849-V1070 HydrophobicContact CG-CG2 4.28Å; W849-V1070 HydrophobicContact CH2-CG2 4.25Å; W849-V1070 HydrophobicContact CZ2-CB 4.33Å; W849-V1070 HydrophobicContact CZ2-CG2 4.13Å; W849-V1070 HydrophobicContact CZ3-CG2 4.13Å; L1066-V1070 HydrophobicContact CD1-CG2 4.47Å; L1066-V1070 VanDerWaalsContact O-CG2 3.23Å; L1066-V1070 WeakPolarHBondContact O-CG2 3.49Å; L1066-V1070 PolarHBondContact O-N 3.4Å; N1067-V1070 PolarHBondContact O-N 2.97Å; N1067-V1070 VanDerWaalsContact O-N 3.14Å; V1070-K1073 PolarHBondContact O-N 3.41Å; V1070-S1074 WeakPolarHBondContact O-CB 3.49Å; V1070-S1074 PolarHBondContact O-N 2.93Å; V1070-V1080 HydrophobicContact CG1-CG1 4.47Å; V1070-L1108 HydrophobicContact CG1-CD1 3.82Å; V1070-L1108 HydrophobicContact CG1-CD2 4.28Å
1071	V	92.2	Very high	88	Confident	27 Å²	27	45.4 Å²	45.4	16%	0.164	25%	0.247	C	C	.	.	H	α-helix	trans	-60.9	-48.5	179.8	173	0	0	0	0	110.7	N1067 K1073 S1074 Q1075 E1106 L1108	N1067-V1071 WeakPolarHBondContact O-CB 3.35Å; N1067-V1071 WeakPolarHBondContact O-CG2 3.22Å; N1067-V1071 PolarHBondContact O-N 3.46Å; N1067-V1071 WeakPolarHBondContact OD1-CG2 3.16Å; V1071-K1073 PolarHBondContact O-N 2.95Å; V1071-S1074 PolarHBondContact O-N 3.37Å; V1071-Q1075 HydrophobicContact CG1-CB 4.18Å; V1071-Q1075 HydrophobicContact CG1-CG 4.44Å; V1071-Q1075 VanDerWaalsContact O-CB 3.25Å; V1071-Q1075 WeakPolarHBondContact O-CB 3.49Å; V1071-Q1075 PolarHBondContact O-N 3.42Å; V1071-E1106 WeakPolarHBondContact CG2-O 3.22Å; V1071-L1108 HydrophobicContact CG2-CD2 3.86Å; V1071-L1108 HydrophobicContact CG2-CG 4.21Å
1072	N	92.9	Very high	89.1	Confident	141 Å²	141	40.7 Å²	40.7	75%	0.754	23%	0.225	S	C	*	.	H	α-helix	trans	-54.4	-32.3	-179.3	-172.6	18	0	0	0	113.1	E1068	E1068-N1072 WeakPolarHBondContact O-CB 3.38Å; E1068-N1072 PolarHBondContact O-N 3.09Å
1073	K	91.4	Very high	89.9	Confident	67 Å²	67	40.7 Å²	40.7	29%	0.291	23%	0.225	S	C	.	.	H	α-helix	trans	-98	-24.9	178.7	-69.5	-168.5	170.4	-166.3	0	115.2	W849 R877 F879 E909 V1069 V1070 V1071	W849-K1073 HydrophobicContact CH2-CD 4.27Å; W849-K1073 HydrophobicContact CZ2-CB 4.06Å; W849-K1073 HydrophobicContact CZ2-CD 4.43Å; R877-K1073 PolarHBondContact NH2-O 3.19Å; F879-K1073 HydrophobicContact CD1-CD 4.17Å; F879-K1073 HydrophobicContact CE1-CB 4.41Å; F879-K1073 HydrophobicContact CE1-CD 3.92Å; F879-K1073 HydrophobicContact CZ-CB 4.46Å; E909-K1073 IonicContact OE1-NZ 3.44Å; E909-K1073 PolarHBondContact OE1-NZ 3.04Å; E909-K1073 IonicContact OE2-NZ 3.61Å; E909-K1073 PolarHBondContact OE2-NZ 3.08Å; V1069-K1073 PolarHBondContact O-N 3.08Å; V1070-K1073 PolarHBondContact O-N 3.41Å; V1071-K1073 PolarHBondContact O-N 2.95Å
1074	S	93.1	Very high	90.4	Very high	2 Å²	2	41.1 Å²	41.1	1%	0.014	23%	0.227	C	C	.	.	H	α-helix	trans	-122.4	3.6	-167.6	-60.5	0	0	0	0	115.4	D847 W849 V1070 V1071 G1076 A1077	D847-S1074 WeakPolarHBondContact OD2-CA 3.31Å; D847-S1074 WeakPolarHBondContact OD2-CB 3.39Å; D847-S1074 PolarHBondContact OD2-OG 3.37Å; W849-S1074 PolarHBondContact NE1-OG 2.7Å; V1070-S1074 WeakPolarHBondContact O-CB 3.49Å; V1070-S1074 PolarHBondContact O-N 2.93Å; V1071-S1074 PolarHBondContact O-N 3.37Å; S1074-G1076 PolarHBondContact O-N 3.04Å; S1074-G1076 VanDerWaalsContact O-N 3.16Å; S1074-A1077 WeakPolarHBondContact O-CB 3.38Å; S1074-A1077 PolarHBondContact O-N 2.96Å
1075	Q	86.9	Confident	90.5	Very high	143 Å²	143	38.5 Å²	38.5	67%	0.668	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-55.9	-33.3	178.8	-172.4	177.5	17.3	0	0	113.6	V1071	V1071-Q1075 HydrophobicContact CG1-CB 4.18Å; V1071-Q1075 HydrophobicContact CG1-CG 4.44Å; V1071-Q1075 VanDerWaalsContact O-CB 3.25Å; V1071-Q1075 WeakPolarHBondContact O-CB 3.49Å; V1071-Q1075 PolarHBondContact O-N 3.42Å
1076	G	85.6	Confident	90.3	Very high	73 Å²	73	35.7 Å²	35.7	75%	0.753	20%	0.202	S	C	*	.	T	Hydrogen-bonded Turn	trans	-88.5	2.6	176.4	0	0	0	0	0	115.6	S1074	S1074-G1076 PolarHBondContact O-N 3.04Å; S1074-G1076 VanDerWaalsContact O-N 3.16Å
1077	A	91.4	Very high	90.2	Very high	13 Å²	13	36.4 Å²	36.4	11%	0.107	21%	0.206	C	C	.	.			trans	-72.4	147.6	-176.6	0	0	0	0	0	112	D847 S1074 V1080	D847-A1077 HydrophobicContact CB-CB 4.09Å; D847-A1077 WeakPolarHBondContact OD2-CB 3.29Å; S1074-A1077 WeakPolarHBondContact O-CB 3.38Å; S1074-A1077 PolarHBondContact O-N 2.96Å; A1077-V1080 HydrophobicContact CB-CG2 3.99Å
1078	H	92.1	Very high	89.7	Confident	48 Å²	48	35.6 Å²	35.6	22%	0.222	20%	0.202	C	C	.	.	S	Bend	trans	-77.7	-26.7	177.1	-82.3	67.9	0	0	0	112.8	T845 W871 R1110	T845-H1078 PolarHBondContact O-N 3.49Å; W871-H1078 HydrophobicContact CZ3-CB 4.13Å; H1078-R1110 WeakPolarHBondContact O-CD 3.45Å; H1078-R1110 PolarHBondContact O-NH1 2.94Å
1079	L	94.6	Very high	88.9	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154	134.3	173.4	178.5	64.9	0	0	0	109.2	F834 I846 D847 L865 W871 L1081 R1110 L1112	F834-L1079 HydrophobicContact CE1-CD1 3.83Å; F834-L1079 HydrophobicContact CZ-CD1 3.77Å; I846-L1079 HydrophobicContact CG2-CB 4.38Å; I846-L1079 HydrophobicContact CG2-CD2 4.35Å; D847-L1079 PolarHBondContact N-O 3.03Å; L865-L1079 HydrophobicContact CD2-CD2 3.48Å; L865-L1079 VanDerWaalsContact CD2-CD2 3.48Å; W871-L1079 HydrophobicContact CH2-CB 3.79Å; W871-L1079 HydrophobicContact CH2-CD2 4.14Å; W871-L1079 HydrophobicContact CH2-CG 4.43Å; W871-L1079 HydrophobicContact CZ3-CB 3.63Å; W871-L1079 HydrophobicContact CZ3-CD2 4.3Å; L1079-L1081 HydrophobicContact CD2-CD1 3.8Å; L1079-L1081 HydrophobicContact CG-CD1 3.89Å; L1079-R1110 HydrophobicContact CD1-CB 4.01Å; L1079-L1112 HydrophobicContact CD1-CB 4.25Å
1080	V	95.5	Very high	88.2	Confident	3 Å²	3	41.6 Å²	41.6	2%	0.018	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	126.4	170.8	-172.9	0	0	0	0	109.1	D847 V1070 A1077 L1082 L1108 R1110 V1111 L1112	D847-V1080 CarbonylContact O-C 3.58Å; D847-V1080 WeakPolarHBondContact O-CA 3.43Å; V1070-V1080 HydrophobicContact CG1-CG1 4.47Å; A1077-V1080 HydrophobicContact CB-CG2 3.99Å; V1080-L1082 HydrophobicContact CG1-CD2 4.06Å; V1080-L1108 HydrophobicContact CG1-CD1 4.44Å; V1080-L1108 HydrophobicContact CG2-CD2 4.42Å; V1080-R1110 PolarHBondContact N-O 3.01Å; V1080-V1111 WeakPolarHBondContact O-CA 3.35Å; V1080-L1112 PolarHBondContact O-N 2.87Å
1081	L	95.3	Very high	87.5	Confident	1 Å²	1	49 Å²	49	1%	0.005	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	133.2	167.5	-68.1	85	0	0	0	108.7	I846 D847 W849 L858 L861 P862 L1079 L1112 V1114	I846-L1081 HydrophobicContact CG2-CD1 3.47Å; I846-L1081 VanDerWaalsContact CG2-CD1 3.47Å; D847-L1081 PolarHBondContact O-N 2.69Å; W849-L1081 PolarHBondContact N-O 2.99Å; L858-L1081 HydrophobicContact CD2-CB 4.25Å; L861-L1081 HydrophobicContact CB-CD2 3.99Å; P862-L1081 HydrophobicContact CG-CD1 3.97Å; P862-L1081 HydrophobicContact CG-CD2 3.71Å; P862-L1081 HydrophobicContact CG-CG 4.44Å; L1079-L1081 HydrophobicContact CD2-CD1 3.8Å; L1079-L1081 HydrophobicContact CG-CD1 3.89Å; L1081-L1112 WeakPolarHBondContact CA-O 3.43Å; L1081-L1112 HydrophobicContact CD2-CD2 4.3Å; L1081-L1112 HydrophobicContact CG-CB 4.36Å; L1081-V1114 HydrophobicContact CD2-CG2 4.29Å
1082	L	92.8	Very high	86.5	Confident	9 Å²	9	50.8 Å²	50.8	5%	0.047	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	157.3	169.8	60.3	131.9	0	0	0	110.8	W849 V1080 L1104 L1105 V1111 L1112 M1113 V1114	W849-L1082 HydrophobicContact CB-CB 3.99Å; V1080-L1082 HydrophobicContact CG1-CD2 4.06Å; L1082-L1104 HydrophobicContact CD1-CD2 3.87Å; L1082-L1104 HydrophobicContact CD1-CG 4.09Å; L1082-L1105 HydrophobicContact CD1-CD2 3.92Å; L1082-L1105 HydrophobicContact CD2-CD2 3.72Å; L1082-L1105 HydrophobicContact CG-CD2 4.33Å; L1082-V1111 HydrophobicContact CD2-CG1 3.55Å; L1082-V1111 HydrophobicContact CG-CG1 4.48Å; L1082-L1112 PolarHBondContact N-O 3Å; L1082-M1113 HydrophobicContact CG-CG 4.41Å; L1082-M1113 CarbonylContact O-C 3.06Å; L1082-M1113 WeakPolarHBondContact O-CA 3.23Å; L1082-V1114 PolarHBondContact O-N 3.29Å
1083	N	89.9	Confident	85.8	Confident	4 Å²	4	44 Å²	44	2%	0.021	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	143.4	175.6	57.8	-57.6	0	0	0	112.8	V851 L858 F921 V1114	V851-N1083 VanDerWaalsContact CB-OD1 3.23Å; V851-N1083 WeakPolarHBondContact CB-OD1 3.47Å; V851-N1083 WeakPolarHBondContact CG2-OD1 3.46Å; V851-N1083 PolarHBondContact N-OD1 2.63Å; V851-N1083 PolarHBondContact O-ND2 2.7Å; L858-N1083 HydrophobicContact CD1-CB 4.3Å; F921-N1083 VanDerWaalsContact CD1-ND2 3.33Å; F921-N1083 WeakPolarHBondContact CD1-ND2 3.31Å; F921-N1083 WeakPolarHBondContact CE1-ND2 3.47Å; F921-N1083 WeakPolarHBondContact CE1-O 3.46Å; N1083-V1114 CarbonylContact C-O 3.59Å; N1083-V1114 WeakPolarHBondContact CA-O 3.33Å
1084	M	88.6	Confident	85.4	Confident	9 Å²	9	41.5 Å²	41.5	4%	0.044	23%	0.225	C	C	.	.	P	Polyproline II helix	trans	-93.5	127.3	176.8	179.2	-173	-80.4	0	0	110.8	F811 V815 V827 Y1097 L1101 M1113 V1114 R1115	F811-M1084 HydrophobicContact CZ-CE 4.22Å; V815-M1084 HydrophobicContact CG1-SD 4.16Å; V815-M1084 HydrophobicContact CG2-SD 4.33Å; V827-M1084 HydrophobicContact CB-CE 4.18Å; V827-M1084 HydrophobicContact CG2-CE 3.89Å; M1084-Y1097 WeakPolarHBondContact CG-OH 3.47Å; M1084-Y1097 PolarHBondContact SD-OH 2.9Å; M1084-Y1097 VanDerWaalsContact SD-OH 3.35Å; M1084-L1101 HydrophobicContact CE-CD1 4.1Å; M1084-L1101 HydrophobicContact CG-CD2 4.17Å; M1084-M1113 HydrophobicContact CB-CB 4.37Å; M1084-M1113 HydrophobicContact CB-SD 4.37Å; M1084-M1113 HydrophobicContact CE-CB 4.1Å; M1084-M1113 HydrophobicContact CE-CE 3.49Å; M1084-M1113 VanDerWaalsContact CE-CE 3.49Å; M1084-M1113 HydrophobicContact CE-CG 4.46Å; M1084-M1113 HydrophobicContact CE-SD 3.43Å; M1084-M1113 WeakPolarHBondContact CE-SD 3.17Å; M1084-M1113 HydrophobicContact CG-SD 4.39Å; M1084-V1114 PolarHBondContact N-O 2.83Å; M1084-R1115 HydrophobicContact CB-CB 4.45Å; M1084-R1115 PolarHBondContact O-NH1 3.08Å
1085	P	86.3	Confident	85	Confident	6 Å²	6	46.9 Å²	46.9	4%	0.039	25%	0.25	C	S	.	.	P	Polyproline II helix	trans	-69.7	166.2	179.1	30.2	-36.3	0	0	0	113.2	F921 Y1097 F1100 L1101 R1115	F921-P1085 HydrophobicContact CD1-CB 4.04Å; F921-P1085 HydrophobicContact CE1-CB 3.77Å; F921-P1085 HydrophobicContact CE1-CG 4.12Å; F921-P1085 HydrophobicContact CZ-CB 4.16Å; F921-P1085 HydrophobicContact CZ-CG 4.13Å; P1085-Y1097 HydrophobicContact CG-CE2 4.24Å; P1085-Y1097 PolarHBondContact O-OH 3.31Å; P1085-F1100 HydrophobicContact CG-CD1 4.22Å; P1085-F1100 HydrophobicContact CG-CE1 3.8Å; P1085-L1101 HydrophobicContact CG-CD2 4.25Å; P1085-R1115 PolarHBondContact O-NH1 2.72Å
1086	G	81.6	Confident	84.8	Confident	8 Å²	8	42.2 Å²	42.2	8%	0.082	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-56.8	130.2	175.4	0	0	0	0	0	114.2	Y1097	G1086-Y1097 WeakPolarHBondContact O-CE2 3.29Å
1087	P	83.9	Confident	84.8	Confident	17 Å²	17	38.8 Å²	38.8	11%	0.11	19%	0.194	C	C	.	.	P	Polyproline II helix	trans	-64.2	149.1	164.7	30.7	-35.6	0	0	0	109.6	I812 V815 R816 Y1097	I812-P1087 HydrophobicContact CG2-CB 4.49Å; V815-P1087 HydrophobicContact CG1-CB 4.47Å; V815-P1087 HydrophobicContact CG1-CG 3.92Å; R816-P1087 HydrophobicContact CG-CB 4.44Å; R816-P1087 HydrophobicContact CG-CG 4.1Å; P1087-Y1097 HydrophobicContact CB-CE1 4.16Å; P1087-Y1097 HydrophobicContact CB-CE2 4.3Å
1088	P	79.7	Confident	84.7	Confident	1 Å²	1	38.1 Å²	38.1	1%	0.006	19%	0.189	C	C	.	.	P	Polyproline II helix	trans	-61.2	140.5	-179	25.2	-35.3	0	0	0	112.1	R816 W1018 N1090 D1094	R816-P1088 PolarHBondContact NH2-O 2.94Å; W1018-P1088 HydrophobicContact CB-CB 3.7Å; W1018-P1088 HydrophobicContact CD2-CB 3.83Å; W1018-P1088 HydrophobicContact CD2-CG 4.46Å; W1018-P1088 HydrophobicContact CE3-CB 4.32Å; W1018-P1088 HydrophobicContact CG-CB 3.57Å; P1088-N1090 PolarHBondContact O-N 2.97Å; P1088-D1094 WeakPolarHBondContact CG-OD1 3.35Å
1089	R	71.1	Confident	84.4	Confident	212 Å²	212	38.6 Å²	38.6	80%	0.8	19%	0.191	S	C	*	.	S	Bend	trans	-61.4	-28.8	171.4	-70.2	-172.4	177.8	-167.3	-1.5	113
1090	N	76.7	Confident	84.1	Confident	83 Å²	83	38.9 Å²	38.9	44%	0.444	19%	0.193	S	C	.	.	S	Bend	trans	-103.9	130.4	-179.4	-65.8	-2.7	0	0	0	110.4	T1019 P1088 G1092 G1093	T1019-N1090 HydrophobicContact CG2-CB 3.47Å; T1019-N1090 VanDerWaalsContact CG2-CB 3.47Å; T1019-N1090 PolarHBondContact OG1-ND2 3.11Å; P1088-N1090 PolarHBondContact O-N 2.97Å; N1090-G1092 PolarHBondContact O-N 3.22Å; N1090-G1092 VanDerWaalsContact O-N 3.14Å; N1090-G1093 PolarHBondContact O-N 3.06Å
1091	R	76.8	Confident	83.8	Confident	161 Å²	161	38.7 Å²	38.7	61%	0.608	19%	0.192	S	C	*	.	G	3₁₀ helix	trans	-61.3	-20.8	-179.1	-69.9	-177.3	165.9	166.7	-4.3	115.4	E813 G1093 D1094	E813-R1091 IonicContact OE1-CZ 3.48Å; E813-R1091 IonicContact OE1-NE 3.78Å; E813-R1091 IonicContact OE1-NH2 2.67Å; E813-R1091 IonicContact OE2-NH2 3.9Å; E813-R1091 PolarHBondContact OE2-NH2 3.37Å; R1091-G1093 PolarHBondContact O-N 3.43Å; R1091-D1094 WeakPolarHBondContact CA-OD1 3.48Å; R1091-D1094 WeakPolarHBondContact O-CB 3.42Å; R1091-D1094 PolarHBondContact O-N 3.26Å
1092	G	70.6	Confident	83.5	Confident	65 Å²	65	40.6 Å²	40.6	67%	0.67	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-70.4	-1.5	176.2	0	0	0	0	0	115.2	N1090	N1090-G1092 PolarHBondContact O-N 3.22Å; N1090-G1092 VanDerWaalsContact O-N 3.14Å
1093	G	77.6	Confident	83.3	Confident	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.205	C	C	.	.	G	3₁₀ helix	trans	-108.1	2.5	176.2	0	0	0	0	0	114.6	W1018 N1090 R1091 E1095 N1096 Y1097	W1018-G1093 WeakPolarHBondContact O-CA 3.25Å; N1090-G1093 PolarHBondContact O-N 3.06Å; R1091-G1093 PolarHBondContact O-N 3.43Å; G1093-E1095 PolarHBondContact O-N 3.32Å; G1093-N1096 PolarHBondContact O-N 2.9Å; G1093-Y1097 PolarHBondContact O-N 3.33Å; G1093-Y1097 VanDerWaalsContact O-N 3.1Å
1094	D	84.1	Confident	83.2	Confident	14 Å²	14	41.2 Å²	41.2	8%	0.075	21%	0.205	C	C	.	.	H	α-helix	trans	-65.6	-38.1	-165.6	-72.8	10.8	0	0	0	112.9	W808 I812 R816 P1088 R1091 Y1097 M1098	W808-D1094 HydrophobicContact CZ3-CB 4Å; I812-D1094 HydrophobicContact CD1-CB 3.61Å; I812-D1094 VanDerWaalsContact CD1-O 3.23Å; I812-D1094 WeakPolarHBondContact CD1-O 3.37Å; R816-D1094 IonicContact CZ-OD1 3.63Å; R816-D1094 IonicContact CZ-OD2 3.92Å; R816-D1094 IonicContact NH1-OD1 2.7Å; R816-D1094 IonicContact NH1-OD2 2.66Å; R816-D1094 PolarHBondContact NH1-OD2 3.42Å; R816-D1094 IonicContact NH2-OD1 2.9Å; R816-D1094 PolarHBondContact NH2-OD1 3.09Å; R816-D1094 IonicContact NH2-OD2 3.81Å; R816-D1094 PolarHBondContact NH2-OD2 2.89Å; P1088-D1094 WeakPolarHBondContact CG-OD1 3.35Å; R1091-D1094 WeakPolarHBondContact CA-OD1 3.48Å; R1091-D1094 WeakPolarHBondContact O-CB 3.42Å; R1091-D1094 PolarHBondContact O-N 3.26Å; D1094-Y1097 PolarHBondContact O-N 3.07Å; D1094-M1098 PolarHBondContact O-N 3.24Å
1095	E	83.7	Confident	83.3	Confident	114 Å²	114	40.9 Å²	40.9	53%	0.533	20%	0.203	S	C	.	.	H	α-helix	trans	-67.5	-46.7	175.4	-170.1	166.8	-162.3	0	0	111.7	W808 G1093 Y1097 M1098 E1099	W808-E1095 HydrophobicContact CH2-CB 3.83Å; W808-E1095 HydrophobicContact CH2-CG 4.33Å; W808-E1095 HydrophobicContact CZ2-CB 4.49Å; W808-E1095 HydrophobicContact CZ3-CB 4.37Å; G1093-E1095 PolarHBondContact O-N 3.32Å; E1095-Y1097 PolarHBondContact O-N 3.14Å; E1095-Y1097 VanDerWaalsContact O-N 3.16Å; E1095-M1098 PolarHBondContact O-N 3.42Å; E1095-E1099 PolarHBondContact O-N 2.83Å
1096	N	82.9	Confident	83.4	Confident	46 Å²	46	46.4 Å²	46.4	25%	0.246	23%	0.228	C	C	.	.	H	α-helix	trans	-58	-31.2	175.9	-56.6	-50.9	0	0	0	112.1	N1056 G1093 F1100	N1056-N1096 PolarHBondContact ND2-OD1 3.2Å; G1093-N1096 PolarHBondContact O-N 2.9Å; N1096-F1100 VanDerWaalsContact O-CB 3.27Å; N1096-F1100 WeakPolarHBondContact O-CB 3.44Å; N1096-F1100 PolarHBondContact O-N 3.39Å
1097	Y	86.6	Confident	83.6	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-71.5	-41.9	175.9	177.6	-100.1	0	0	0	112	I812 W1018 M1084 P1085 G1086 P1087 G1093 D1094 E1095 F1100 L1101	I812-Y1097 HydrophobicContact CG1-CD1 4.37Å; W1018-Y1097 AromaticContact CH2-CD2 3.87Å; W1018-Y1097 HydrophobicContact CH2-CD2 3.87Å; W1018-Y1097 HydrophobicContact CZ2-CD2 4.42Å; W1018-Y1097 HydrophobicContact CZ3-CD2 4.28Å; M1084-Y1097 WeakPolarHBondContact CG-OH 3.47Å; M1084-Y1097 PolarHBondContact SD-OH 2.9Å; M1084-Y1097 VanDerWaalsContact SD-OH 3.35Å; P1085-Y1097 HydrophobicContact CG-CE2 4.24Å; P1085-Y1097 PolarHBondContact O-OH 3.31Å; G1086-Y1097 WeakPolarHBondContact O-CE2 3.29Å; P1087-Y1097 HydrophobicContact CB-CE1 4.16Å; P1087-Y1097 HydrophobicContact CB-CE2 4.3Å; G1093-Y1097 PolarHBondContact O-N 3.33Å; G1093-Y1097 VanDerWaalsContact O-N 3.1Å; D1094-Y1097 PolarHBondContact O-N 3.07Å; E1095-Y1097 PolarHBondContact O-N 3.14Å; E1095-Y1097 VanDerWaalsContact O-N 3.16Å; Y1097-F1100 PolarHBondContact O-N 2.91Å; Y1097-L1101 HydrophobicContact CD1-CD1 4.12Å; Y1097-L1101 HydrophobicContact CE1-CD1 3.52Å; Y1097-L1101 HydrophobicContact CE1-CG 4.32Å; Y1097-L1101 HydrophobicContact CE2-CD1 4.48Å; Y1097-L1101 WeakPolarHBondContact O-CG 3.41Å; Y1097-L1101 PolarHBondContact O-N 3.48Å
1098	M	87.9	Confident	83.9	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-66.5	-39.5	173.9	-73.8	-64.4	-59.2	0	0	112.4	W795 P796 W799 W808 F811 I812 D1094 E1095 L1101 E1102	W795-M1098 HydrophobicContact CH2-CE 3.41Å; W795-M1098 VanDerWaalsContact CH2-CE 3.41Å; W795-M1098 HydrophobicContact CH2-SD 4.01Å; W795-M1098 HydrophobicContact CZ2-CE 3.64Å; W795-M1098 HydrophobicContact CZ3-CE 4.1Å; W795-M1098 HydrophobicContact CZ3-SD 4.45Å; P796-M1098 HydrophobicContact CG-CE 3.9Å; W799-M1098 HydrophobicContact CD2-CE 3.99Å; W799-M1098 HydrophobicContact CE3-CB 4.37Å; W799-M1098 HydrophobicContact CG-CE 4.05Å; W799-M1098 HydrophobicContact CH2-CB 3.53Å; W799-M1098 HydrophobicContact CZ2-CB 3.71Å; W799-M1098 HydrophobicContact CZ2-CE 4.44Å; W799-M1098 HydrophobicContact CZ3-CB 3.89Å; W808-M1098 HydrophobicContact CB-CE 4.21Å; W808-M1098 HydrophobicContact CB-CG 4.5Å; W808-M1098 HydrophobicContact CE3-CG 3.99Å; F811-M1098 HydrophobicContact CD1-CE 4.3Å; F811-M1098 HydrophobicContact CD1-SD 3.7Å; F811-M1098 HydrophobicContact CE1-SD 3.93Å; I812-M1098 HydrophobicContact CD1-CG 3.76Å; I812-M1098 HydrophobicContact CD1-SD 4.48Å; I812-M1098 HydrophobicContact CG1-CG 4.1Å; I812-M1098 HydrophobicContact CG1-SD 4.16Å; D1094-M1098 PolarHBondContact O-N 3.24Å; E1095-M1098 PolarHBondContact O-N 3.42Å; M1098-L1101 PolarHBondContact O-N 3.19Å; M1098-E1102 WeakPolarHBondContact O-CB 3.35Å; M1098-E1102 PolarHBondContact O-N 3.01Å
1099	E	86.3	Confident	84.3	Confident	58 Å²	58	52.7 Å²	52.7	27%	0.271	27%	0.272	S	S	.	.	H	α-helix	trans	-63.4	-43.5	173.3	-69.1	-163.7	123.8	0	0	112.3	W799 M1060 E1095 L1101 E1102 V1103	W799-E1099 HydrophobicContact CH2-CG 3.85Å; M1060-E1099 HydrophobicContact CE-CB 3.84Å; M1060-E1099 HydrophobicContact CE-CG 4.38Å; M1060-E1099 WeakPolarHBondContact CE-OE2 3.48Å; E1095-E1099 PolarHBondContact O-N 2.83Å; E1099-L1101 VanDerWaalsContact C-N 3.33Å; E1099-L1101 PolarHBondContact O-N 3.45Å; E1099-E1102 PolarHBondContact O-N 2.86Å; E1099-V1103 WeakPolarHBondContact O-CG2 3.32Å; E1099-V1103 PolarHBondContact O-N 3.23Å
1100	F	87.4	Confident	85.3	Confident	5 Å²	5	44.7 Å²	44.7	2%	0.022	24%	0.242	C	C	.	.	H	α-helix	trans	-57.1	-46.4	174.7	179.5	-80.1	0	0	0	111.5	A920 F921 A1063 P1085 N1096 Y1097 L1104	A920-F1100 HydrophobicContact CB-CE2 4Å; A920-F1100 HydrophobicContact CB-CZ 3.74Å; F921-F1100 HydrophobicContact CE2-CZ 4.49Å; A1063-F1100 HydrophobicContact CB-CD2 3.72Å; A1063-F1100 HydrophobicContact CB-CE2 3.69Å; A1063-F1100 HydrophobicContact CB-CG 4.26Å; A1063-F1100 HydrophobicContact CB-CZ 4.18Å; P1085-F1100 HydrophobicContact CG-CD1 4.22Å; P1085-F1100 HydrophobicContact CG-CE1 3.8Å; N1096-F1100 VanDerWaalsContact O-CB 3.27Å; N1096-F1100 WeakPolarHBondContact O-CB 3.44Å; N1096-F1100 PolarHBondContact O-N 3.39Å; Y1097-F1100 PolarHBondContact O-N 2.91Å; F1100-L1104 HydrophobicContact CE1-CD2 3.9Å; F1100-L1104 VanDerWaalsContact O-CB 3.26Å; F1100-L1104 WeakPolarHBondContact O-CB 3.49Å; F1100-L1104 PolarHBondContact O-N 3.44Å
1101	L	89.6	Confident	86.1	Confident	0 Å²	0	40.7 Å²	40.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-67.6	-36.3	177.5	-70.2	-178.1	0	0	0	112.8	W795 M1084 P1085 Y1097 M1098 E1099 L1105 M1113	W795-L1101 HydrophobicContact CH2-CB 3.71Å; W795-L1101 HydrophobicContact CH2-CD1 4.08Å; W795-L1101 HydrophobicContact CZ3-CB 4.29Å; W795-L1101 HydrophobicContact CZ3-CD1 4Å; M1084-L1101 HydrophobicContact CE-CD1 4.1Å; M1084-L1101 HydrophobicContact CG-CD2 4.17Å; P1085-L1101 HydrophobicContact CG-CD2 4.25Å; Y1097-L1101 HydrophobicContact CD1-CD1 4.12Å; Y1097-L1101 HydrophobicContact CE1-CD1 3.52Å; Y1097-L1101 HydrophobicContact CE1-CG 4.32Å; Y1097-L1101 HydrophobicContact CE2-CD1 4.48Å; Y1097-L1101 WeakPolarHBondContact O-CG 3.41Å; Y1097-L1101 PolarHBondContact O-N 3.48Å; M1098-L1101 PolarHBondContact O-N 3.19Å; E1099-L1101 VanDerWaalsContact C-N 3.33Å; E1099-L1101 PolarHBondContact O-N 3.45Å; L1101-L1105 WeakPolarHBondContact O-CB 3.3Å; L1101-L1105 WeakPolarHBondContact O-CD1 3.38Å; L1101-L1105 WeakPolarHBondContact O-CG 3.26Å; L1101-L1105 PolarHBondContact O-N 3.44Å; L1101-M1113 HydrophobicContact CD2-SD 4.07Å
1102	E	88.9	Confident	87	Confident	40 Å²	40	33.4 Å²	33.4	19%	0.187	19%	0.194	C	C	.	.	H	α-helix	trans	-66.6	-46.3	178.1	-164.6	65.6	-113.4	0	0	111	W795 W799 K829 M1098 E1099 L1105 E1106	W795-E1102 WeakPolarHBondContact CZ2-OE2 3.43Å; W795-E1102 PolarHBondContact NE1-OE2 3.19Å; W799-E1102 HydrophobicContact CZ2-CB 4.11Å; W799-E1102 PolarHBondContact NE1-OE2 3.49Å; K829-E1102 VanDerWaalsContact CE-OE1 3.28Å; K829-E1102 WeakPolarHBondContact CE-OE1 3.26Å; K829-E1102 IonicContact NZ-OE1 3.05Å; K829-E1102 PolarHBondContact NZ-OE1 3.21Å; M1098-E1102 WeakPolarHBondContact O-CB 3.35Å; M1098-E1102 PolarHBondContact O-N 3.01Å; E1099-E1102 PolarHBondContact O-N 2.86Å; E1102-L1105 CarbonylContact O-C 3.54Å; E1102-L1105 PolarHBondContact O-N 2.7Å; E1102-L1105 VanDerWaalsContact O-N 3.15Å; E1102-E1106 PolarHBondContact O-N 3.39Å
1103	V	89.1	Confident	88.2	Confident	24 Å²	24	30.4 Å²	30.4	15%	0.145	16%	0.162	C	C	.	.	H	α-helix	trans	-64.6	-38.4	177.7	172	0	0	0	0	112.1	A1063 V1064 N1067 E1099 L1105	A1063-V1103 HydrophobicContact CB-CB 4.32Å; A1063-V1103 HydrophobicContact CB-CG1 3.91Å; V1064-V1103 HydrophobicContact CB-CG1 4.49Å; V1064-V1103 HydrophobicContact CG2-CG1 3.61Å; N1067-V1103 WeakPolarHBondContact CB-O 3.12Å; N1067-V1103 VanDerWaalsContact CG-O 3.25Å; N1067-V1103 PolarHBondContact ND2-O 3.41Å; E1099-V1103 WeakPolarHBondContact O-CG2 3.32Å; E1099-V1103 PolarHBondContact O-N 3.23Å; V1103-L1105 PolarHBondContact O-N 2.77Å
1104	L	88.6	Confident	89	Confident	3 Å²	3	30.4 Å²	30.4	2%	0.016	16%	0.162	C	C	.	.	H	α-helix	trans	-65.1	-17.3	176	-178.6	58.1	0	0	0	113.2	F921 L1066 N1067 L1082 F1100	F921-L1104 HydrophobicContact CZ-CD2 4.19Å; L1066-L1104 HydrophobicContact CB-CD1 4.16Å; L1066-L1104 HydrophobicContact CD2-CD1 3.68Å; L1066-L1104 HydrophobicContact CG-CD1 3.8Å; N1067-L1104 PolarHBondContact OD1-O 3.18Å; L1082-L1104 HydrophobicContact CD1-CD2 3.87Å; L1082-L1104 HydrophobicContact CD1-CG 4.09Å; F1100-L1104 HydrophobicContact CE1-CD2 3.9Å; F1100-L1104 VanDerWaalsContact O-CB 3.26Å; F1100-L1104 WeakPolarHBondContact O-CB 3.49Å; F1100-L1104 PolarHBondContact O-N 3.44Å
1105	L	89.6	Confident	89.3	Confident	1 Å²	1	31 Å²	31	1%	0.005	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-120.7	16.2	-172.5	-60.8	-179.3	0	0	0	112.6	K829 L1082 L1101 E1102 V1103 V1111 M1113	K829-L1105 HydrophobicContact CD-CB 3.81Å; K829-L1105 HydrophobicContact CD-CD1 3.82Å; K829-L1105 HydrophobicContact CD-CG 4.47Å; K829-L1105 VanDerWaalsContact NZ-CB 3.29Å; K829-L1105 PolarHBondContact NZ-O 3.23Å; L1082-L1105 HydrophobicContact CD1-CD2 3.92Å; L1082-L1105 HydrophobicContact CD2-CD2 3.72Å; L1082-L1105 HydrophobicContact CG-CD2 4.33Å; L1101-L1105 WeakPolarHBondContact O-CB 3.3Å; L1101-L1105 WeakPolarHBondContact O-CD1 3.38Å; L1101-L1105 WeakPolarHBondContact O-CG 3.26Å; L1101-L1105 PolarHBondContact O-N 3.44Å; E1102-L1105 CarbonylContact O-C 3.54Å; E1102-L1105 PolarHBondContact O-N 2.7Å; E1102-L1105 VanDerWaalsContact O-N 3.15Å; V1103-L1105 PolarHBondContact O-N 2.77Å; L1105-V1111 HydrophobicContact CD2-CG1 3.78Å; L1105-V1111 HydrophobicContact CD2-CG2 4.38Å; L1105-M1113 HydrophobicContact CD1-CE 3.57Å; L1105-M1113 HydrophobicContact CD1-CG 4.23Å; L1105-M1113 HydrophobicContact CD1-SD 3.66Å; L1105-M1113 HydrophobicContact CD2-CG 4.46Å
1106	E	89.4	Confident	89.5	Confident	123 Å²	123	26 Å²	26	58%	0.575	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.6	133.6	-176.8	-171.8	159.3	-158.9	0	0	110.3	N1067 V1071 E1102 L1108	N1067-E1106 PolarHBondContact ND2-O 2.86Å; N1067-E1106 PolarHBondContact OD1-O 3.28Å; V1071-E1106 WeakPolarHBondContact CG2-O 3.22Å; E1102-E1106 PolarHBondContact O-N 3.39Å; E1106-L1108 VanDerWaalsContact C-N 3.33Å; E1106-L1108 PolarHBondContact O-N 3.3Å
1107	G	85.9	Confident	89.5	Confident	56 Å²	56	24.2 Å²	24.2	58%	0.577	14%	0.135	S	C	*	.	T	Hydrogen-bonded Turn	trans	83.3	-3.3	-175.8	0	0	0	0	0	115.9
1108	L	89.4	Confident	89.1	Confident	9 Å²	9	25.9 Å²	25.9	5%	0.047	15%	0.153	C	C	.	.			trans	-96.5	134.7	176.5	-58.3	179	0	0	0	112	V1070 V1071 V1080 E1106 V1111	V1070-L1108 HydrophobicContact CG1-CD1 3.82Å; V1070-L1108 HydrophobicContact CG1-CD2 4.28Å; V1071-L1108 HydrophobicContact CG2-CD2 3.86Å; V1071-L1108 HydrophobicContact CG2-CG 4.21Å; V1080-L1108 HydrophobicContact CG1-CD1 4.44Å; V1080-L1108 HydrophobicContact CG2-CD2 4.42Å; E1106-L1108 VanDerWaalsContact C-N 3.33Å; E1106-L1108 PolarHBondContact O-N 3.3Å; L1108-V1111 HydrophobicContact CB-CG2 3.56Å; L1108-V1111 HydrophobicContact CD1-CG2 3.96Å; L1108-V1111 HydrophobicContact CG-CG2 4.43Å
1109	N	87.1	Confident	88.5	Confident	92 Å²	92	32.2 Å²	32.2	49%	0.492	18%	0.176	S	C	.	.	S	Bend	trans	-78.9	-71	-176.2	-171	1.9	0	0	0	112.5	N830	N830-N1109 WeakPolarHBondContact CB-O 3.4Å; N830-N1109 PolarHBondContact ND2-O 3.09Å
1110	R	92.9	Very high	88.4	Confident	44 Å²	44	30.3 Å²	30.3	17%	0.166	17%	0.167	C	C	.	.	S	Bend	trans	-105.5	118.4	177.3	-58.7	-167.7	-165.4	94.1	3.9	110.3	S833 F834 H1078 L1079 V1080	S833-R1110 PolarHBondContact O-NE 3.37Å; S833-R1110 PolarHBondContact O-NH2 3.44Å; F834-R1110 HydrophobicContact CE2-CB 4.21Å; F834-R1110 HydrophobicContact CZ-CB 4.27Å; H1078-R1110 WeakPolarHBondContact O-CD 3.45Å; H1078-R1110 PolarHBondContact O-NH1 2.94Å; L1079-R1110 HydrophobicContact CD1-CB 4.01Å; V1080-R1110 PolarHBondContact N-O 3.01Å
1111	V	94.4	Very high	88	Confident	0 Å²	0	30.2 Å²	30.2	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	134.7	177.5	-176.1	0	0	0	0	110.9	K829 V1080 L1082 L1105 L1108 M1113	K829-V1111 HydrophobicContact CB-CB 4.16Å; K829-V1111 PolarHBondContact N-O 2.56Å; V1080-V1111 WeakPolarHBondContact O-CA 3.35Å; L1082-V1111 HydrophobicContact CD2-CG1 3.55Å; L1082-V1111 HydrophobicContact CG-CG1 4.48Å; L1105-V1111 HydrophobicContact CD2-CG1 3.78Å; L1105-V1111 HydrophobicContact CD2-CG2 4.38Å; L1108-V1111 HydrophobicContact CB-CG2 3.56Å; L1108-V1111 HydrophobicContact CD1-CG2 3.96Å; L1108-V1111 HydrophobicContact CG-CG2 4.43Å; V1111-M1113 HydrophobicContact CG1-CG 4.31Å
1112	L	95.8	Very high	87.6	Confident	8 Å²	8	30.5 Å²	30.5	4%	0.042	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	104.2	165.1	-176.2	67.5	0	0	0	109	L714 L826 A828 L1079 V1080 L1081 L1082 V1114	L714-L1112 HydrophobicContact CD2-CD1 4.5Å; L826-L1112 HydrophobicContact CB-CD1 4.21Å; A828-L1112 HydrophobicContact CB-CD1 4.31Å; L1079-L1112 HydrophobicContact CD1-CB 4.25Å; V1080-L1112 PolarHBondContact O-N 2.87Å; L1081-L1112 WeakPolarHBondContact CA-O 3.43Å; L1081-L1112 HydrophobicContact CD2-CD2 4.3Å; L1081-L1112 HydrophobicContact CG-CB 4.36Å; L1082-L1112 PolarHBondContact N-O 3Å; L1112-V1114 HydrophobicContact CG-CG2 4.45Å
1113	M	94.9	Very high	86.7	Confident	2 Å²	2	28.8 Å²	28.8	1%	0.01	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	140.2	170.5	-76.9	-172.7	-75.8	0	0	110.5	W795 L826 V827 L1082 M1084 L1101 L1105 V1111	W795-M1113 HydrophobicContact CE3-CE 3.64Å; W795-M1113 HydrophobicContact CZ3-CE 3.67Å; L826-M1113 WeakPolarHBondContact CA-O 3.37Å; V827-M1113 HydrophobicContact CB-CB 4.23Å; V827-M1113 HydrophobicContact CB-CE 4.1Å; V827-M1113 HydrophobicContact CG1-CE 3.91Å; V827-M1113 PolarHBondContact N-O 3.15Å; V827-M1113 PolarHBondContact O-N 3.07Å; L1082-M1113 HydrophobicContact CG-CG 4.41Å; L1082-M1113 CarbonylContact O-C 3.06Å; L1082-M1113 WeakPolarHBondContact O-CA 3.23Å; M1084-M1113 HydrophobicContact CB-CB 4.37Å; M1084-M1113 HydrophobicContact CB-SD 4.37Å; M1084-M1113 HydrophobicContact CE-CB 4.1Å; M1084-M1113 HydrophobicContact CE-CE 3.49Å; M1084-M1113 VanDerWaalsContact CE-CE 3.49Å; M1084-M1113 HydrophobicContact CE-CG 4.46Å; M1084-M1113 HydrophobicContact CE-SD 3.43Å; M1084-M1113 WeakPolarHBondContact CE-SD 3.17Å; M1084-M1113 HydrophobicContact CG-SD 4.39Å; L1101-M1113 HydrophobicContact CD2-SD 4.07Å; L1105-M1113 HydrophobicContact CD1-CE 3.57Å; L1105-M1113 HydrophobicContact CD1-CG 4.23Å; L1105-M1113 HydrophobicContact CD1-SD 3.66Å; L1105-M1113 HydrophobicContact CD2-CG 4.46Å; V1111-M1113 HydrophobicContact CG1-CG 4.31Å
1114	V	93.9	Very high	85.7	Confident	0 Å²	0	31.6 Å²	31.6	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127	140.3	-174.1	-179.2	0	0	0	0	110.2	L826 M857 L858 L861 L1081 L1082 N1083 M1084 L1112	L826-V1114 HydrophobicContact CD2-CB 4.36Å; L826-V1114 HydrophobicContact CD2-CG1 4.17Å; L826-V1114 HydrophobicContact CD2-CG2 3.93Å; M857-V1114 HydrophobicContact CE-CG1 3.57Å; M857-V1114 HydrophobicContact CG-CG1 4Å; M857-V1114 HydrophobicContact SD-CG1 4.03Å; L858-V1114 HydrophobicContact CD2-CB 3.93Å; L858-V1114 HydrophobicContact CD2-CG1 4.28Å; L858-V1114 HydrophobicContact CD2-CG2 4.02Å; L861-V1114 HydrophobicContact CD1-CB 4.49Å; L861-V1114 HydrophobicContact CD1-CG1 3.84Å; L861-V1114 HydrophobicContact CD1-CG2 3.74Å; L1081-V1114 HydrophobicContact CD2-CG2 4.29Å; L1082-V1114 PolarHBondContact O-N 3.29Å; N1083-V1114 CarbonylContact C-O 3.59Å; N1083-V1114 WeakPolarHBondContact CA-O 3.33Å; M1084-V1114 PolarHBondContact N-O 2.83Å; L1112-V1114 HydrophobicContact CG-CG2 4.45Å
1115	R	91.3	Very high	84.7	Confident	25 Å²	25	32.4 Å²	32.4	9%	0.094	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	129.1	174.3	-173.2	-165.2	-177.1	77.8	11.5	110.3	T819 A824 M825 M1084 P1085	T819-R1115 PolarHBondContact OG1-NE 2.85Å; A824-R1115 CarbonylContact C-O 3.21Å; A824-R1115 VanDerWaalsContact CA-O 3.25Å; A824-R1115 WeakPolarHBondContact CA-O 3.35Å; M825-R1115 HydrophobicContact CB-CB 4.2Å; M825-R1115 PolarHBondContact N-O 2.9Å; M825-R1115 PolarHBondContact O-N 3.1Å; M1084-R1115 HydrophobicContact CB-CB 4.45Å; M1084-R1115 PolarHBondContact O-NH1 3.08Å; P1085-R1115 PolarHBondContact O-NH1 2.72Å
1116	G	88	Confident	83.1	Confident	10 Å²	10	36.9 Å²	36.9	10%	0.103	21%	0.209	C	C	.	.			trans	-76.3	151.7	174	0	0	0	0	0	113.5	D854 M857 G1118	D854-G1116 PolarHBondContact OD2-N 3.13Å; M857-G1116 VanDerWaalsContact CE-CA 3.48Å; G1116-G1118 VanDerWaalsContact C-N 3.28Å
1117	G	83.2	Confident	82.8	Confident	8 Å²	8	32.6 Å²	32.6	8%	0.082	19%	0.19	C	C	.	.			trans	-80.5	-7.6	166.9	0	0	0	0	0	113.5	Q823 E1120	Q823-G1117 WeakPolarHBondContact O-CA 3.41Å; G1117-E1120 WeakPolarHBondContact CA-OE1 3.3Å; G1117-E1120 PolarHBondContact N-OE1 2.8Å; G1117-E1120 PolarHBondContact N-OE2 3.48Å
1118	G	78.4	Confident	82.6	Confident	36 Å²	36	31.3 Å²	31.3	37%	0.371	17%	0.17	S	C	.	.	S	Bend	trans	91.6	10.6	175.7	0	0	0	0	0	114.6	G1116 E1120	G1116-G1118 VanDerWaalsContact C-N 3.28Å; G1118-E1120 PolarHBondContact N-OE2 2.99Å
1119	R	75.3	Confident	82.2	Confident	132 Å²	132	32.6 Å²	32.6	50%	0.498	18%	0.177	S	C	.	.			trans	-125.6	4.2	-175	-62.4	-174.3	-174.7	-166.2	2.5	113.3	H822 M935 V1121	H822-R1119 PolarHBondContact CD2-NH2 3.05Å; H822-R1119 PolarHBondContact NE2-NH2 3.48Å; M935-R1119 HydrophobicContact CE-CB 3.92Å; M935-R1119 HydrophobicContact CE-CG 4.17Å; M935-R1119 HydrophobicContact SD-CB 4.27Å; M935-R1119 HydrophobicContact SD-CG 4.14Å; R1119-V1121 PolarHBondContact O-N 3.39Å
1120	E	83.2	Confident	82	Confident	18 Å²	18	29.1 Å²	29.1	8%	0.084	16%	0.158	C	C	.	.			trans	-83	105.9	-172.8	-62	81	-178	0	0	112.2	W690 R932 G1117 G1118	W690-E1120 HydrophobicContact CB-CB 4.44Å; W690-E1120 HydrophobicContact CD2-CB 4.4Å; W690-E1120 HydrophobicContact CD2-CG 3.92Å; W690-E1120 HydrophobicContact CG-CB 4.13Å; W690-E1120 HydrophobicContact CG-CG 3.9Å; W690-E1120 HydrophobicContact CZ2-CG 4.26Å; R932-E1120 PolarHBondContact NH2-O 3.41Å; G1117-E1120 WeakPolarHBondContact CA-OE1 3.3Å; G1117-E1120 PolarHBondContact N-OE1 2.8Å; G1117-E1120 PolarHBondContact N-OE2 3.48Å; G1118-E1120 PolarHBondContact N-OE2 2.99Å
1121	V	79	Confident	81.3	Confident	4 Å²	4	28.1 Å²	28.1	2%	0.024	16%	0.158	C	C	.	.			trans	-108.9	131	169.1	179.6	0	0	0	0	109.4	T687 K688 W690 L936 M939 R1119 T1123	T687-V1121 VanDerWaalsContact O-O 3.09Å; K688-V1121 CarbonylContact C-O 3.6Å; W690-V1121 WeakPolarHBondContact CB-O 3.39Å; W690-V1121 PolarHBondContact N-O 2.71Å; L936-V1121 HydrophobicContact CD2-CG2 3.83Å; M939-V1121 HydrophobicContact CE-CG2 3.78Å; R1119-V1121 PolarHBondContact O-N 3.39Å; V1121-T1123 HydrophobicContact CG1-CG2 4.09Å
1122	I	81.4	Confident	80.4	Confident	5 Å²	5	30 Å²	30	3%	0.026	17%	0.168	C	C	.	.	B	Isolated β-bridge	trans	-132.1	104.2	-177.4	-57.9	160.1	0	0	0	107.6	W690 G856 M857 L860 Y1125	W690-I1122 HydrophobicContact CB-CG1 3.95Å; W690-I1122 HydrophobicContact CE3-CD1 4.24Å; G856-I1122 VanDerWaalsContact C-CD1 3.48Å; G856-I1122 WeakPolarHBondContact O-CD1 3.47Å; M857-I1122 HydrophobicContact CB-CD1 4.47Å; L860-I1122 HydrophobicContact CB-CD1 4.06Å; L860-I1122 HydrophobicContact CD2-CD1 3.75Å; L860-I1122 HydrophobicContact CD2-CG1 4.28Å; L860-I1122 HydrophobicContact CD2-CG2 4.48Å; I1122-Y1125 HydrophobicContact CB-CE2 4.42Å; I1122-Y1125 HydrophobicContact CG2-CD1 4.23Å; I1122-Y1125 HydrophobicContact CG2-CD2 4.05Å; I1122-Y1125 HydrophobicContact CG2-CE1 3.81Å; I1122-Y1125 HydrophobicContact CG2-CE2 3.62Å; I1122-Y1125 HydrophobicContact CG2-CG 4.34Å; I1122-Y1125 VanDerWaalsContact CG2-CZ 3.48Å
1123	T	69.7	Low	79.3	Confident	5 Å²	5	31.6 Å²	31.6	3%	0.031	18%	0.177	C	C	.	.			trans	-103	-18.9	178.9	56.8	0	0	0	0	113	K688 N689 L941 E945 V1121	K688-T1123 PolarHBondContact O-N 2.66Å; K688-T1123 PolarHBondContact O-OG1 3.18Å; N689-T1123 PolarHBondContact ND2-OG1 3.38Å; N689-T1123 PolarHBondContact OD1-N 2.8Å; N689-T1123 PolarHBondContact OD1-OG1 3.19Å; L941-T1123 HydrophobicContact CD2-CG2 4.43Å; E945-T1123 HydrophobicContact CB-CG2 4.43Å; V1121-T1123 HydrophobicContact CG1-CG2 4.09Å
1124	I	69.3	Low	78.1	Confident	82 Å²	82	33.8 Å²	33.8	42%	0.421	19%	0.19	S	C	.	.			trans	-130.6	119.1	178.9	-52.1	179.7	0	0	0	110.6	N689 R691	N689-I1124 WeakPolarHBondContact OD1-CB 3.12Å; N689-I1124 PolarHBondContact OD1-N 3.15Å; R691-I1124 PolarHBondContact NH1-O 3.34Å; R691-I1124 VanDerWaalsContact NH1-O 3.13Å; R691-I1124 PolarHBondContact NH2-O 2.91Å
1125	Y	66.6	Low	76.8	Confident	21 Å²	21	36.7 Å²	36.7	8%	0.082	21%	0.206	C	C	.	.			trans	-98.8	121.1	170.3	-60.6	-105.8	0	0	0	106.9	G856 M859 L860 L902 L904 I1122	G856-Y1125 WeakPolarHBondContact CA-OH 3.21Å; M859-Y1125 HydrophobicContact CB-CE1 4.17Å; L860-Y1125 HydrophobicContact CB-CD1 4.34Å; L860-Y1125 HydrophobicContact CB-CE1 4.08Å; L860-Y1125 HydrophobicContact CD1-CD1 4.06Å; L902-Y1125 HydrophobicContact CD1-CD2 3.38Å; L902-Y1125 HydrophobicContact CD1-CE2 3.44Å; L902-Y1125 VanDerWaalsContact CD1-CE2 3.44Å; L902-Y1125 HydrophobicContact CD1-CG 4.09Å; L902-Y1125 HydrophobicContact CD2-CD2 3.78Å; L902-Y1125 HydrophobicContact CD2-CE2 4.32Å; L902-Y1125 HydrophobicContact CG-CD2 4.17Å; L904-Y1125 HydrophobicContact CD1-CD1 4.09Å; L904-Y1125 HydrophobicContact CD1-CG 4.23Å; I1122-Y1125 HydrophobicContact CB-CE2 4.42Å; I1122-Y1125 HydrophobicContact CG2-CD1 4.23Å; I1122-Y1125 HydrophobicContact CG2-CD2 4.05Å; I1122-Y1125 HydrophobicContact CG2-CE1 3.81Å; I1122-Y1125 HydrophobicContact CG2-CE2 3.62Å; I1122-Y1125 HydrophobicContact CG2-CG 4.34Å; I1122-Y1125 VanDerWaalsContact CG2-CZ 3.48Å
1126	S	56.1	Low	75.5	Confident	94 Å²	94	37.7 Å²	37.7	66%	0.657	22%	0.216	S	C	*	.			trans	-136.2	0	-167.8	69.6	0	0	0	0	113.2	R691 F863 Q867	R691-S1126 PolarHBondContact NH2-OG 3.06Å; F863-S1126 VanDerWaalsContact CE1-C 3.43Å; F863-S1126 WeakPolarHBondContact CE1-O 3.46Å; F863-S1126 WeakPolarHBondContact CZ-OXT 3.42Å; Q867-S1126 PolarHBondContact NE2-O 2.97Å; Q867-S1126 VanDerWaalsContact NE2-O 3.09Å; Q867-S1126 PolarHBondContact NE2-OXT 3.38Å; Q867-S1126 VanDerWaalsContact NE2-OXT 3.14Å

Retrieved 1,126 of 1,126 residues in 803.2 ms (Link to these results)

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