A0A087XDE4_POEFO Loading...

Diaphanous related formin 1

AlphaFold DB , UniProt , Accession A0A087XDE4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,167 aa.

						>A0A087XDE4_POEFO|A0A087XDE4
MDQNTGSSASFAGSKKEKDKKSKKKDKDKDEDGDGKKKFNLKRLIPDELERLTSMRTKKDKEKPLPPNQRHSSAATYELSPQSAMLHEQTDEDILALFEKMLVDMNLNEEKQRPLREKHISIKREMVSQYLHTSKAGQDQRERSKSAVMYIQEIKMEYRDPQQLLTCLESLRVSLNNNPVSLSWVQNFGDEGLMLLLSLLKRLQDEKDENSQARNMGYKCQHEIIRCLKAFMNNMYGIKSMLGTEDGIRLLVRALNYKVPNMMVDAAKLLSAICILDHPDNLHDRVLEAITEEAEKQDAERFQPLIDGMQSNQIALKSGCMQLINALISRAEELDFRIHIRSELLRLGLRQHLSEIRRIENEELQVQLNVFDEQAEDDSDDLRGRLEDIRIEMDDDVREVFDILFNTVKDSKAESHFLSLMQHLLLIRNDYLARPQYYKLIDECIAQIVLHKNGSDPDFKCRKLHVDIEGLIDNMVDKTKVEVSEAKATDLEKKLESELTARHELQVEKNKLESDYDQKLQDLSQEKEQLACTKLEREKENQGLQEQLSSLQNQIEKLSKDLEEAKTKVITVTVPVPTPGVPPPPPLPGQSGVAPPTAPIPGHAAIPGPVPPPPPPPPFPGMPGPPPPPPFPGMPGPPPPPPFPGMPGPPPPPPLPGMPGPPPPPPLPGMGGPPPPPPLPGGPGIPPPPPGPGMPPPPPGNWGPPAPPPLPFGLQPKTEYKPEVQLKRANWSKIAAEDLSENSFWTKANEEQFQSNELFAKLTLTFSSQTKHNKFKKDQDGGQEKQTQKKKVKELKVLDSKSSQNLSIFLGSFRLPYEEIKNAILQVNEKILTESMVQNLIKQLPGPEQLSVLGEMKDEYDDLAESEQFGVVMSNVKRLMPRLQAIQFKLQFEEQQNNIKPDVVAVTAACEELRNSNTFAKLLQIILLVGNYMNSGSRNGAAFGFSISYLCKLRDTKSADLKQTLLHFLADVCNEQHPDVMKFPEELIHVEKASRVSAETIQKNLEQMGRQIKSLQKDLETFPPAQNENDHFVDKMSIFVTYAQEQYEKLDGMHKNMEKQYTELGDYFVFDPRKMSVEEFFGDLHNFITMFQQAVKENQKRKEAEEKIRKAKLAREKAEKEKEEKLKRSQLPDINAAEGDETGIMDGLLEALQSGAAFRRKRGPRQA
					

Structure Viewer

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	32	Very low	29	Very low	224 Å²	224	131.9 Å²	131.9	100%	1.103	78%	0.783	S	S	*	*				0	90.1	0	-64.7	176.2	-175	0	0	105.9
2	D	26.1	Very low	29	Very low	132 Å²	132	128.4 Å²	128.4	71%	0.706	78%	0.78	S	S	*	*			cis	68.3	133.6	49	-52.5	-81.7	0	0	0	111.9
3	Q	32.1	Very low	28.8	Very low	153 Å²	153	123.9 Å²	123.9	72%	0.715	78%	0.775	S	S	*	*			cis	-163	153.7	-6.7	-121.5	178.4	62.1	0	0	111.3
4	N	32.3	Very low	28.8	Very low	128 Å²	128	122.4 Å²	122.4	68%	0.684	77%	0.771	S	S	*	*				56.3	147.5	128.2	-151.2	8.1	0	0	0	122.9
5	T	31.5	Very low	28.8	Very low	130 Å²	130	126.5 Å²	126.5	80%	0.798	77%	0.773	S	S	*	*			trans	74.1	144.9	165.6	74.7	0	0	0	0	118.7
6	G	28.2	Very low	28.7	Very low	69 Å²	69	129.9 Å²	129.9	71%	0.711	77%	0.774	S	S	*	*			cis	154.1	159.1	-12.4	0	0	0	0	0	114.1
7	S	26.7	Very low	28.7	Very low	122 Å²	122	130.7 Å²	130.7	85%	0.853	77%	0.768	S	S	*	*			trans	66.4	159.5	168	-83.2	0	0	0	0	117.8
8	S	27.5	Very low	28.7	Very low	102 Å²	102	133.6 Å²	133.6	71%	0.713	77%	0.769	S	S	*	*			cis	-165.5	168	-15.5	-104.4	0	0	0	0	110.9
9	A	27.6	Very low	28.7	Very low	90 Å²	90	132.9 Å²	132.9	74%	0.744	76%	0.763	S	S	*	*			trans	64.6	137.8	162.9	0	0	0	0	0	118.6
10	S	28.5	Very low	28.6	Very low	101 Å²	101	135.6 Å²	135.6	71%	0.706	77%	0.765	S	S	*	*			cis	110.4	114.8	4	78.9	0	0	0	0	116.4
11	F	26.6	Very low	28.5	Very low	200 Å²	200	138.4 Å²	138.4	88%	0.877	77%	0.769	S	S	*	*				-179.9	120.6	127.5	-111.7	-127.3	0	0	0	107.1
12	A	28.8	Very low	28.3	Very low	90 Å²	90	133.2 Å²	133.2	74%	0.744	76%	0.755	S	S	*	*				85.1	136.6	69.5	0	0	0	0	0	113.5
13	G	27.3	Very low	28.6	Very low	70 Å²	70	136.8 Å²	136.8	72%	0.722	76%	0.764	S	S	*	*			cis	147.9	-170.1	-8.8	0	0	0	0	0	113.6
14	S	28.7	Very low	28.6	Very low	103 Å²	103	138.5 Å²	138.5	72%	0.72	77%	0.769	S	S	*	*			trans	70.6	154.3	161.3	-66.4	0	0	0	0	118.6
15	K	28.2	Very low	28.6	Very low	183 Å²	183	140 Å²	140	80%	0.796	77%	0.769	S	S	*	*			cis	-161.2	152.8	-9.4	-102.3	159.9	-170	173.5	0	106.3
16	K	27.3	Very low	28.6	Very low	182 Å²	182	139.3 Å²	139.3	79%	0.791	76%	0.761	S	S	*	*			cis	102.8	140.2	36.6	-154.4	-172.7	-173.4	-171.6	0	113.1
17	E	28.2	Very low	28.5	Very low	143 Å²	143	144.4 Å²	144.4	67%	0.668	76%	0.764	S	S	*	*			trans	82	157.2	175.2	-49.7	-170.2	167.9	0	0	116.4
18	K	29.2	Very low	28.6	Very low	182 Å²	182	144.2 Å²	144.2	79%	0.791	75%	0.753	S	S	*	*			cis	-155.9	-169.6	15.3	-144.1	152.7	-168.4	148.2	0	115.2
19	D	28.9	Very low	28.7	Very low	122 Å²	122	146.9 Å²	146.9	65%	0.652	75%	0.752	S	S	*	*			trans	-70.3	153.5	-168.7	-109.6	-86.5	0	0	0	119.8
20	K	27.5	Very low	28.8	Very low	185 Å²	185	148.3 Å²	148.3	80%	0.804	75%	0.747	S	S	*	*			trans	65.5	123.8	143.6	-84.9	163	-173.1	155.6	0	124.5
21	K	26.4	Very low	29	Very low	196 Å²	196	153 Å²	153	85%	0.852	76%	0.758	S	S	*	*			trans	92	116	133.3	-160.6	-175.6	-175.2	-177.7	0	118.9
22	S	26.2	Very low	29.6	Very low	114 Å²	114	151.5 Å²	151.5	80%	0.797	76%	0.759	S	S	*	*			trans	127.9	133.2	147.5	-56.4	0	0	0	0	116.4
23	K	33	Very low	29.8	Very low	207 Å²	207	150.2 Å²	150.2	90%	0.9	75%	0.754	S	S	*	*			trans	8.9	130.5	158.3	-90.2	177.7	167.5	173.7	0	121.5
24	K	31.6	Very low	30	Very low	190 Å²	190	154.2 Å²	154.2	83%	0.826	76%	0.759	S	S	*	*				101.4	114.9	129.4	-163.6	-172.5	-179.1	-169.7	0	120.3
25	K	32.5	Very low	29.9	Very low	158 Å²	158	152.8 Å²	152.8	69%	0.687	76%	0.76	S	S	*	*			trans	72.8	129.5	150.6	-85.6	-169.5	149.3	-72.3	0	123.2
26	D	31.2	Very low	30.1	Very low	117 Å²	117	152.9 Å²	152.9	63%	0.626	76%	0.761	S	S	*	*			trans	68.3	128.6	136.7	-50.9	-14.4	0	0	0	124.5
27	K	27	Very low	30.1	Very low	176 Å²	176	154.6 Å²	154.6	77%	0.765	77%	0.768	S	S	*	*			trans	77.1	128.6	147	-80.1	-178.7	152.1	-80	0	123
28	D	27.8	Very low	30.1	Very low	117 Å²	117	157.2 Å²	157.2	63%	0.626	78%	0.777	S	S	*	*				50.3	138.7	129.7	-49.5	-16.5	0	0	0	120.7
29	K	30.3	Very low	29.8	Very low	158 Å²	158	158.8 Å²	158.8	69%	0.687	79%	0.785	S	S	*	*			cis	-171.5	168.3	-5.8	-131.3	173.1	148.5	-75.9	0	111.8
30	D	30.3	Very low	29.6	Very low	121 Å²	121	161 Å²	161	65%	0.647	80%	0.796	S	S	*	*			trans	75.4	150.9	146.4	-60.7	-28.7	0	0	0	126.5
31	E	31.8	Very low	29.5	Very low	200 Å²	200	160.1 Å²	160.1	94%	0.935	80%	0.8	S	S	*	*			trans	89.3	158.7	153.4	-85.7	179.4	-174.2	0	0	125.4
32	D	39.3	Very low	29.4	Very low	167 Å²	167	160.1 Å²	160.1	89%	0.893	80%	0.8	S	S	*	*			trans	-146.9	173.5	-145.2	-177.8	25.3	0	0	0	113
33	G	33	Very low	29.3	Very low	63 Å²	63	165.8 Å²	165.8	65%	0.649	80%	0.804	S	S	*	*			trans	175.6	101.8	172.6	0	0	0	0	0	122.6
34	D	30.8	Very low	29	Very low	155 Å²	155	163 Å²	163	83%	0.829	80%	0.797	S	S	*	*			trans	68.9	153.6	137.9	-161.7	36.7	0	0	0	123.7
35	G	28.5	Very low	28.7	Very low	72 Å²	72	161.1 Å²	161.1	74%	0.742	80%	0.795	S	S	*	*			trans	153.3	80	165.3	0	0	0	0	0	117.6
36	K	31.8	Very low	28.9	Very low	185 Å²	185	159 Å²	159	80%	0.804	80%	0.797	S	S	*	*			trans	-100.3	150.8	-177.7	-68.2	167.3	179.6	159.1	0	116.1
37	K	26	Very low	28.6	Very low	218 Å²	218	160.8 Å²	160.8	95%	0.948	81%	0.807	S	S	*	*			trans	-165.6	164.8	140.9	-107.4	152.1	-169.8	172.3	0	114.4
38	K	29.3	Very low	28.5	Very low	199 Å²	199	162 Å²	162	87%	0.865	82%	0.816	S	S	*	*			trans	-111.4	161.7	-163.4	-54	175.1	177.4	-179.6	0	113.5
39	F	22	Very low	28.3	Very low	215 Å²	215	164.1 Å²	164.1	94%	0.943	83%	0.826	S	S	*	*				-164.8	169.8	122.7	-112.8	-75.3	0	0	0	112.6
40	N	24.8	Very low	28.1	Very low	167 Å²	167	162.7 Å²	162.7	89%	0.893	82%	0.821	S	S	*	*			trans	-94.9	158.1	-169.7	-90	-37.8	0	0	0	114.7
41	L	26.1	Very low	27.8	Very low	168 Å²	168	166 Å²	166	88%	0.88	83%	0.825	S	S	*	*			trans	-114.8	144.7	-177.8	-175	68.2	0	0	0	113.1
42	K	24.2	Very low	27.5	Very low	195 Å²	195	162.9 Å²	162.9	85%	0.848	81%	0.814	S	S	*	*			trans	-151.2	132	164.7	-108.9	-179.4	-179.9	177.4	0	112.1
43	R	25.2	Very low	26.9	Very low	234 Å²	234	160.9 Å²	160.9	88%	0.883	81%	0.808	S	S	*	*			trans	66.1	98.5	164.3	-71.4	-173.6	168.5	174.1	-4.3	120.8
44	L	24.8	Very low	26.4	Very low	147 Å²	147	163.2 Å²	163.2	77%	0.77	82%	0.815	S	S	*	*				30.3	126.6	124	-76.4	78	0	0	0	122
45	I	27.1	Very low	26.1	Very low	151 Å²	151	163.6 Å²	163.6	77%	0.774	81%	0.813	S	S	*	*				64.6	137.4	124.1	-62.7	178.3	0	0	0	117.6
46	P	35.9	Very low	25.9	Very low	114 Å²	114	171.2 Å²	171.2	74%	0.74	82%	0.82	S	S	*	*			cis	-133.9	-177.6	32.7	40	-21.1	0	0	0	118.8
47	D	25.6	Very low	25.5	Very low	154 Å²	154	169.4 Å²	169.4	82%	0.824	82%	0.824	S	S	*	*			trans	-32.2	151.5	172.5	-46.1	-33.5	0	0	0	120
48	E	24	Very low	25.6	Very low	203 Å²	203	168.4 Å²	168.4	95%	0.949	82%	0.82	S	S	*	*			trans	-146.4	162.1	130.4	-143.1	170.3	-145.1	0	0	110.3
49	L	24.4	Very low	25.6	Very low	160 Å²	160	166 Å²	166	84%	0.838	81%	0.81	S	S	*	*			trans	-106.3	174	-167.7	-145.3	79.1	0	0	0	113.1
50	E	25.8	Very low	25.7	Very low	128 Å²	128	162.7 Å²	162.7	60%	0.598	80%	0.802	S	S	*	*			trans	83.5	126.3	157.6	-86.3	-151.8	115.8	0	0	122.2
51	R	24.3	Very low	25.8	Very low	190 Å²	190	163.6 Å²	163.6	72%	0.717	80%	0.797	S	S	*	*			trans	81.5	142.7	144.1	-63.4	167.9	-173.2	167.1	14.6	120.8
52	L	24.8	Very low	25.7	Very low	135 Å²	135	164.8 Å²	164.8	71%	0.707	80%	0.798	S	S	*	*			cis	-165.6	143.4	-18.7	-115.5	176	0	0	0	111.8
53	T	26.5	Very low	25.8	Very low	126 Å²	126	165.2 Å²	165.2	77%	0.773	80%	0.8	S	S	*	*			trans	31.1	135.9	149.9	52.1	0	0	0	0	124.4
54	S	23.1	Very low	26.1	Very low	112 Å²	112	159.6 Å²	159.6	78%	0.783	79%	0.794	S	S	*	*			trans	-144	142	133.1	-166.9	0	0	0	0	106.4
55	M	23.5	Very low	26.1	Very low	162 Å²	162	160.3 Å²	160.3	80%	0.798	80%	0.798	S	S	*	*			cis	-140	143.5	38.4	-70.1	-176.7	-75.5	0	0	111.4
56	R	24.3	Very low	27	Very low	233 Å²	233	158.6 Å²	158.6	88%	0.879	80%	0.797	S	S	*	*				56.3	107.6	96	-142.3	-175.6	-156.9	174.1	6.9	113.5
57	T	24.7	Very low	27.4	Very low	146 Å²	146	158 Å²	158	90%	0.896	79%	0.793	S	S	*	*				-138.7	-179.2	95.8	31.6	0	0	0	0	114.5
58	K	27.8	Very low	27.4	Very low	198 Å²	198	157.5 Å²	157.5	86%	0.861	79%	0.79	S	S	*	*			trans	-71.6	131	-174.8	-67.2	167.7	-175.8	172.2	0	110.4
59	K	28.3	Very low	27.5	Very low	149 Å²	149	154.4 Å²	154.4	65%	0.648	78%	0.776	S	S	*	*				75.2	110	61.2	177.8	-106	171	-140.4	0	112.9
60	D	23.6	Very low	27.6	Very low	145 Å²	145	157 Å²	157	78%	0.775	77%	0.774	S	S	*	*				-138.6	170.3	127.9	-107.9	-32.6	0	0	0	112.4
61	K	28.8	Very low	27.6	Very low	185 Å²	185	159.6 Å²	159.6	80%	0.804	79%	0.786	S	S	*	*			trans	-119.9	137.8	-170.9	-79.2	-175.9	170.2	-175.1	0	111.3
62	E	23	Very low	27.7	Very low	193 Å²	193	155.8 Å²	155.8	90%	0.902	79%	0.789	S	S	*	*			trans	-106.2	143	148.3	-82.2	-154.1	126.2	0	0	111.6
63	K	26.4	Very low	27.7	Very low	204 Å²	204	154.6 Å²	154.6	89%	0.887	79%	0.791	S	S	*	*			trans	168	151.7	153.6	-102.4	179.3	179.8	-178.4	0	108.8
64	P	31.4	Very low	28.2	Very low	117 Å²	117	153.4 Å²	153.4	76%	0.76	79%	0.794	S	S	*	*			cis	-135.7	173	-14.5	42.8	-27.4	0	0	0	114.1
65	L	24.2	Very low	28.4	Very low	161 Å²	161	152.6 Å²	152.6	84%	0.843	79%	0.794	S	S	*	*			trans	-76.1	170.5	152.6	-76.3	168.1	0	0	0	109.9
66	P	45.8	Very low	29.1	Very low	116 Å²	116	150.7 Å²	150.7	75%	0.753	79%	0.792	S	S	*	*			cis	-127.6	-158.9	11.8	42	-21.8	0	0	0	111.1
67	P	45.4	Very low	29.4	Very low	101 Å²	101	149.5 Å²	149.5	66%	0.656	79%	0.789	S	S	*	*			cis	-138.9	175.8	3.6	43.8	-25.8	0	0	0	118.4
68	N	25.6	Very low	29.6	Very low	144 Å²	144	150.5 Å²	150.5	77%	0.77	78%	0.784	S	S	*	*			trans	68.1	139.5	164.4	-69.9	-22.1	0	0	0	116.4
69	Q	26.5	Very low	29.7	Very low	137 Å²	137	149 Å²	149	64%	0.64	78%	0.784	S	S	*	*			cis	-162.3	156.6	20	-134.1	179.7	66.1	0	0	112.5
70	R	25.3	Very low	29.8	Very low	215 Å²	215	146 Å²	146	81%	0.811	78%	0.782	S	S	*	*			trans	74.3	149.9	155.2	-65.6	175.3	-177.2	-167.9	-3.4	121.3
71	H	26.1	Very low	30.6	Very low	183 Å²	183	143.8 Å²	143.8	85%	0.847	78%	0.775	S	S	*	*			trans	-55.1	162.6	166.3	-38.3	-93.9	0	0	0	112.1
72	S	26	Very low	31.2	Very low	110 Å²	110	141.7 Å²	141.7	77%	0.769	77%	0.768	S	S	*	*			cis	-157.6	-175.1	11	-137.1	0	0	0	0	108.5
73	S	25.9	Very low	31.9	Very low	109 Å²	109	136.5 Å²	136.5	76%	0.762	75%	0.754	S	S	*	*			cis	-157.5	173.2	6.3	37	0	0	0	0	109.9
74	A	37.3	Very low	32.5	Very low	101 Å²	101	129.9 Å²	129.9	84%	0.835	74%	0.737	S	S	*	*			trans	-77.6	149.1	175	0	0	0	0	0	113.7
75	A	26.6	Very low	33.3	Very low	95 Å²	95	130.8 Å²	130.8	79%	0.785	73%	0.733	S	S	*	*			trans	-144.6	126.6	162.3	0	0	0	0	0	109
76	T	37.9	Very low	34.3	Very low	123 Å²	123	126.6 Å²	126.6	76%	0.755	71%	0.711	S	S	*	*			trans	-89.8	135.4	-174.3	-45.2	0	0	0	0	111.2
77	Y	31.4	Very low	34.4	Very low	208 Å²	208	129.2 Å²	129.2	82%	0.816	71%	0.713	S	S	*	*			trans	-140.5	101.7	157.2	-84.6	-79.7	0	0	0	106.2
78	E	27.8	Very low	34.5	Very low	167 Å²	167	132.2 Å²	132.2	78%	0.78	72%	0.718	S	S	*	*				71.7	119.4	80.2	-70.7	-162	146.8	0	0	113.4
79	L	31.5	Very low	35.8	Very low	165 Å²	165	128 Å²	128	86%	0.864	69%	0.693	S	S	*	*			trans	-82	137.2	-179.3	-73.2	144.2	0	0	0	110.5
80	S	30.3	Very low	37.8	Very low	86 Å²	86	124.8 Å²	124.8	60%	0.601	68%	0.684	S	S	*	*			trans	-79.2	140.5	171.5	-172.2	0	0	0	0	110.9	Q82	S80-Q82 VanDerWaalsContact C-N 3.28Å; S80-Q82 PolarHBondContact O-N 3.07Å; S80-Q82 VanDerWaalsContact O-N 3.07Å
81	P	40.2	Very low	40.2	Very low	99 Å²	99	118.4 Å²	118.4	64%	0.643	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-68.2	-14.4	-162.3	-24	36.1	0	0	0	116.9	S83	P81-S83 PolarHBondContact O-N 3.41Å
82	Q	39.7	Very low	42.3	Very low	141 Å²	141	117.3 Å²	117.3	66%	0.659	66%	0.661	S	S	*	*	G	3₁₀ helix	trans	-76.6	-14.3	-172.9	-96.7	61.8	37.6	0	0	115.3	S80 A84 M85	S80-Q82 VanDerWaalsContact C-N 3.28Å; S80-Q82 PolarHBondContact O-N 3.07Å; S80-Q82 VanDerWaalsContact O-N 3.07Å; Q82-A84 PolarHBondContact O-N 3.17Å; Q82-A84 VanDerWaalsContact O-N 3.17Å; Q82-M85 PolarHBondContact O-N 3.42Å
83	S	37.8	Very low	44.6	Very low	84 Å²	84	115.5 Å²	115.5	59%	0.587	64%	0.643	S	S	*	*	G	3₁₀ helix	trans	-63.9	-17.3	174.4	-60	0	0	0	0	113.5	P81	P81-S83 PolarHBondContact O-N 3.41Å
84	A	40.2	Very low	47.2	Very low	66 Å²	66	110.5 Å²	110.5	55%	0.545	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-69.3	-29.7	179.9	0	0	0	0	0	113.9	Q82 L86	Q82-A84 PolarHBondContact O-N 3.17Å; Q82-A84 VanDerWaalsContact O-N 3.17Å; A84-L86 PolarHBondContact O-N 3.2Å
85	M	48.5	Very low	49.2	Very low	136 Å²	136	109 Å²	109	67%	0.67	59%	0.585	S	S	*	*	G	3₁₀ helix	trans	-86	-3.8	-171.7	-63.2	-155.3	78.2	0	0	115.4	Q82	Q82-M85 PolarHBondContact O-N 3.42Å
86	L	45.7	Very low	51.5	Low	72 Å²	72	107.6 Å²	107.6	38%	0.377	57%	0.573	S	S	.	*	G	3₁₀ helix	trans	-96.7	-3.9	171.6	-72.4	174.2	0	0	0	113.3	A84 Q89 R124	A84-L86 PolarHBondContact O-N 3.2Å; L86-Q89 VanDerWaalsContact CD2-OE1 3.28Å; L86-R124 PolarHBondContact O-NH1 3.05Å
87	H	46.5	Very low	53.3	Low	172 Å²	172	104.1 Å²	104.1	80%	0.796	55%	0.55	S	S	*	.	S	Bend	trans	-91.8	-11.5	172.9	-101.3	-66.7	0	0	0	114
88	E	47.8	Very low	55.7	Low	163 Å²	163	94.2 Å²	94.2	76%	0.762	51%	0.511	S	S	*	.	S	Bend	trans	-97.1	-8.8	172.5	-66.1	-170.2	139.7	0	0	113.5	T90	E88-T90 PolarHBondContact O-N 3.27Å
89	Q	53.8	Low	58.1	Low	55 Å²	55	89.1 Å²	89.1	26%	0.257	49%	0.487	S	S	.	.	S	Bend	trans	-71.8	126.4	168.9	-75.1	-166.2	-39.7	0	0	110.3	L86 D93 I94 R124	L86-Q89 VanDerWaalsContact CD2-OE1 3.28Å; Q89-D93 HydrophobicContact CB-CB 4.08Å; Q89-D93 HydrophobicContact CG-CB 4.38Å; Q89-I94 HydrophobicContact CB-CD1 4.41Å; Q89-I94 HydrophobicContact CB-CG1 4.47Å; Q89-R124 PolarHBondContact O-NH1 3.34Å; Q89-R124 PolarHBondContact O-NH2 3.13Å
90	T	68.1	Low	59.8	Low	71 Å²	71	87 Å²	87	44%	0.436	47%	0.471	S	S	.	.			trans	-64.4	164	177.3	67.6	0	0	0	0	110.8	E88 E92 D93 I94 R124	E88-T90 PolarHBondContact O-N 3.27Å; T90-E92 PolarHBondContact O-N 3.36Å; T90-E92 PolarHBondContact OG1-N 3.4Å; T90-D93 WeakPolarHBondContact CB-OD2 3.45Å; T90-D93 PolarHBondContact N-OD2 2.98Å; T90-D93 PolarHBondContact O-N 2.86Å; T90-D93 VanDerWaalsContact OG1-CG 3.24Å; T90-D93 PolarHBondContact OG1-N 3.36Å; T90-D93 PolarHBondContact OG1-OD2 3.42Å; T90-I94 WeakPolarHBondContact O-CG1 3.3Å; T90-I94 PolarHBondContact O-N 3.34Å; T90-R124 VanDerWaalsContact C-NH2 3.3Å; T90-R124 PolarHBondContact O-NH2 3.12Å
91	D	75.3	Confident	62.2	Low	81 Å²	81	83.1 Å²	83.1	43%	0.433	44%	0.443	S	S	.	.	H	α-helix	trans	-64.6	-22.8	172.3	-72.8	-35.1	0	0	0	111.8	L95 I120 R124	D91-L95 WeakPolarHBondContact O-CB 3.35Å; D91-L95 WeakPolarHBondContact O-CD1 3.45Å; D91-L95 WeakPolarHBondContact O-CG 3.44Å; D91-L95 PolarHBondContact O-N 3.48Å; D91-I120 HydrophobicContact CB-CD1 4.27Å; D91-I120 HydrophobicContact CB-CG1 3.97Å; D91-I120 VanDerWaalsContact OD1-CG1 3.28Å; D91-I120 WeakPolarHBondContact OD1-CG1 3.41Å; D91-R124 IonicContact OD1-CZ 3.57Å; D91-R124 VanDerWaalsContact OD1-CZ 3.25Å; D91-R124 IonicContact OD1-NE 2.83Å; D91-R124 PolarHBondContact OD1-NE 3.2Å; D91-R124 IonicContact OD1-NH2 3.5Å; D91-R124 PolarHBondContact OD1-NH2 2.88Å
92	E	71.3	Confident	63.7	Low	160 Å²	160	78.4 Å²	78.4	75%	0.748	41%	0.412	S	S	*	.	H	α-helix	trans	-72.5	-44.3	175.7	-161	159.7	-145.4	0	0	111.7	T90 I94 L95 A96	T90-E92 PolarHBondContact O-N 3.36Å; T90-E92 PolarHBondContact OG1-N 3.4Å; E92-I94 VanDerWaalsContact C-N 3.28Å; E92-I94 PolarHBondContact O-N 2.96Å; E92-L95 PolarHBondContact O-N 3.42Å; E92-A96 PolarHBondContact O-N 2.88Å
93	D	73.9	Confident	64.9	Low	72 Å²	72	74.9 Å²	74.9	39%	0.385	40%	0.4	S	S	.	.	H	α-helix	trans	-57.1	-41.4	171.8	-65.4	-64.7	0	0	0	111.9	Q89 T90 A96 L97	Q89-D93 HydrophobicContact CB-CB 4.08Å; Q89-D93 HydrophobicContact CG-CB 4.38Å; T90-D93 WeakPolarHBondContact CB-OD2 3.45Å; T90-D93 PolarHBondContact N-OD2 2.98Å; T90-D93 PolarHBondContact O-N 2.86Å; T90-D93 VanDerWaalsContact OG1-CG 3.24Å; T90-D93 PolarHBondContact OG1-N 3.36Å; T90-D93 PolarHBondContact OG1-OD2 3.42Å; D93-A96 PolarHBondContact O-N 3.49Å; D93-L97 WeakPolarHBondContact O-CG 3.5Å; D93-L97 PolarHBondContact O-N 3.02Å
94	I	80.6	Confident	66	Low	4 Å²	4	72.7 Å²	72.7	2%	0.021	38%	0.382	C	S	.	.	H	α-helix	trans	-70.4	-39.2	178.7	-65.3	-69.8	0	0	0	111.3	Q89 T90 E92 A96 L97 F98 I120 K123 R124 V127	Q89-I94 HydrophobicContact CB-CD1 4.41Å; Q89-I94 HydrophobicContact CB-CG1 4.47Å; T90-I94 WeakPolarHBondContact O-CG1 3.3Å; T90-I94 PolarHBondContact O-N 3.34Å; E92-I94 VanDerWaalsContact C-N 3.28Å; E92-I94 PolarHBondContact O-N 2.96Å; I94-A96 VanDerWaalsContact C-N 3.33Å; I94-L97 PolarHBondContact O-N 3.07Å; I94-F98 WeakPolarHBondContact O-CB 3.43Å; I94-F98 PolarHBondContact O-N 3.21Å; I94-I120 HydrophobicContact CB-CD1 4.38Å; I94-I120 HydrophobicContact CG2-CD1 3.94Å; I94-K123 HydrophobicContact CG2-CB 4.43Å; I94-R124 HydrophobicContact CB-CG 4.22Å; I94-R124 HydrophobicContact CD1-CG 4.1Å; I94-R124 HydrophobicContact CG1-CG 3.85Å; I94-R124 HydrophobicContact CG2-CB 4.38Å; I94-R124 HydrophobicContact CG2-CG 3.62Å; I94-V127 HydrophobicContact CD1-CG1 4.49Å
95	L	78.7	Confident	67.2	Low	70 Å²	70	74.3 Å²	74.3	37%	0.366	38%	0.38	S	S	.	.	H	α-helix	trans	-63	-41.6	175.4	-75.1	166	0	0	0	110.8	D91 E92 F98 E99 I120 K123	D91-L95 WeakPolarHBondContact O-CB 3.35Å; D91-L95 WeakPolarHBondContact O-CD1 3.45Å; D91-L95 WeakPolarHBondContact O-CG 3.44Å; D91-L95 PolarHBondContact O-N 3.48Å; E92-L95 PolarHBondContact O-N 3.42Å; L95-F98 PolarHBondContact O-N 2.81Å; L95-E99 WeakPolarHBondContact O-CG 3.28Å; L95-E99 PolarHBondContact O-N 2.95Å; L95-I120 HydrophobicContact CD2-CD1 4.03Å; L95-I120 HydrophobicContact CG-CD1 3.89Å; L95-K123 HydrophobicContact CD2-CD 3.74Å
96	A	75.1	Confident	67.6	Low	65 Å²	65	71 Å²	71	54%	0.537	37%	0.365	S	S	.	.	H	α-helix	trans	-61.6	-43.9	173.3	0	0	0	0	0	112.6	E92 D93 I94 F98 K100	E92-A96 PolarHBondContact O-N 2.88Å; D93-A96 PolarHBondContact O-N 3.49Å; I94-A96 VanDerWaalsContact C-N 3.33Å; A96-F98 VanDerWaalsContact C-N 3.33Å; A96-F98 PolarHBondContact O-N 3.44Å; A96-K100 WeakPolarHBondContact O-CB 3.13Å; A96-K100 PolarHBondContact O-N 3.35Å
97	L	74.7	Confident	68.5	Low	49 Å²	49	69.9 Å²	69.9	26%	0.257	36%	0.359	S	S	.	.	H	α-helix	trans	-67.6	-30.7	175.2	-75.6	167.4	0	0	0	113.3	D93 I94 M101 V127	D93-L97 WeakPolarHBondContact O-CG 3.5Å; D93-L97 PolarHBondContact O-N 3.02Å; I94-L97 PolarHBondContact O-N 3.07Å; L97-M101 WeakPolarHBondContact O-CB 3.47Å; L97-M101 PolarHBondContact O-N 2.82Å; L97-V127 HydrophobicContact CB-CG1 3.74Å; L97-V127 HydrophobicContact CB-CG2 4.14Å; L97-V127 HydrophobicContact CD1-CG1 4.19Å
98	F	81.8	Confident	69	Low	0 Å²	0	65 Å²	65	0%	0	34%	0.339	C	S	.	.	H	α-helix	trans	-74.8	-43.4	178	-178.7	-93.8	0	0	0	112	I94 L95 A96 K100 M101 L102 L115 K123 M126 V127	I94-F98 WeakPolarHBondContact O-CB 3.43Å; I94-F98 PolarHBondContact O-N 3.21Å; L95-F98 PolarHBondContact O-N 2.81Å; A96-F98 VanDerWaalsContact C-N 3.33Å; A96-F98 PolarHBondContact O-N 3.44Å; F98-K100 VanDerWaalsContact C-N 3.32Å; F98-M101 HydrophobicContact CD2-CE 3.51Å; F98-M101 HydrophobicContact CE2-CE 3.47Å; F98-M101 VanDerWaalsContact CE2-CE 3.47Å; F98-M101 HydrophobicContact CG-CE 4.32Å; F98-M101 HydrophobicContact CZ-CE 4.26Å; F98-M101 WeakPolarHBondContact O-CB 3.43Å; F98-M101 PolarHBondContact O-N 3.06Å; F98-L102 HydrophobicContact CD1-CD1 4.1Å; F98-L102 HydrophobicContact CD1-CG 4.42Å; F98-L102 HydrophobicContact CE1-CD1 3.64Å; F98-L102 HydrophobicContact CE1-CG 4.12Å; F98-L102 HydrophobicContact CZ-CD1 4.34Å; F98-L102 WeakPolarHBondContact O-CG 3.42Å; F98-L102 PolarHBondContact O-N 2.7Å; F98-L115 HydrophobicContact CZ-CB 4.11Å; F98-L115 WeakPolarHBondContact CZ-O 3.31Å; F98-K123 HydrophobicContact CB-CB 4.37Å; F98-K123 HydrophobicContact CB-CD 4.5Å; F98-K123 HydrophobicContact CD1-CD 3.71Å; F98-K123 HydrophobicContact CD1-CG 4.18Å; F98-K123 HydrophobicContact CD2-CB 3.55Å; F98-K123 HydrophobicContact CD2-CD 4.12Å; F98-K123 HydrophobicContact CD2-CG 3.71Å; F98-K123 HydrophobicContact CE1-CD 3.83Å; F98-K123 HydrophobicContact CE1-CG 4.11Å; F98-K123 HydrophobicContact CE2-CB 3.92Å; F98-K123 HydrophobicContact CE2-CD 4.24Å; F98-K123 HydrophobicContact CE2-CG 3.63Å; F98-K123 HydrophobicContact CG-CB 3.94Å; F98-K123 HydrophobicContact CG-CD 3.85Å; F98-K123 HydrophobicContact CG-CG 3.98Å; F98-K123 HydrophobicContact CZ-CD 4.09Å; F98-K123 HydrophobicContact CZ-CG 3.84Å; F98-M126 HydrophobicContact CE2-CB 4.32Å; F98-M126 HydrophobicContact CE2-SD 3.98Å; F98-V127 HydrophobicContact CB-CG2 3.76Å; F98-V127 HydrophobicContact CD2-CG2 4.19Å; F98-V127 HydrophobicContact CG-CG2 4.5Å
99	E	78.1	Confident	69.9	Low	60 Å²	60	62 Å²	62	28%	0.28	33%	0.325	S	S	.	.	H	α-helix	trans	-63.4	-41	172.6	-68.8	-57.8	149.6	0	0	111	L95 M101 L102 V103 R116	L95-E99 WeakPolarHBondContact O-CG 3.28Å; L95-E99 PolarHBondContact O-N 2.95Å; E99-M101 VanDerWaalsContact C-N 3.35Å; E99-M101 PolarHBondContact O-N 3.31Å; E99-L102 PolarHBondContact O-N 3.48Å; E99-L102 VanDerWaalsContact O-N 3.12Å; E99-V103 WeakPolarHBondContact O-CG2 3.46Å; E99-V103 PolarHBondContact O-N 3.46Å; E99-R116 VanDerWaalsContact CD-NE 3.32Å; E99-R116 WeakPolarHBondContact OE1-CD 3.37Å; E99-R116 WeakPolarHBondContact OE1-CG 3.48Å; E99-R116 IonicContact OE1-NE 3.2Å; E99-R116 PolarHBondContact OE1-NE 3.31Å; E99-R116 IonicContact OE2-CZ 2.7Å; E99-R116 IonicContact OE2-NE 3Å; E99-R116 PolarHBondContact OE2-NE 3.41Å; E99-R116 IonicContact OE2-NH2 2.95Å; E99-R116 PolarHBondContact OE2-NH2 3.4Å
100	K	69	Low	70.2	Confident	121 Å²	121	66.4 Å²	66.4	53%	0.526	35%	0.345	S	S	.	.	H	α-helix	trans	-58	-44.6	171.3	176.5	163.6	-176.2	165.8	0	112.6	A96 F98 L102 V103 D104	A96-K100 WeakPolarHBondContact O-CB 3.13Å; A96-K100 PolarHBondContact O-N 3.35Å; F98-K100 VanDerWaalsContact C-N 3.32Å; K100-L102 VanDerWaalsContact C-N 3.3Å; K100-L102 PolarHBondContact O-N 3.46Å; K100-V103 PolarHBondContact O-N 2.82Å; K100-D104 WeakPolarHBondContact CE-OD2 3.44Å; K100-D104 WeakPolarHBondContact CG-OD2 3.25Å; K100-D104 WeakPolarHBondContact O-CB 3.34Å; K100-D104 VanDerWaalsContact O-CG 3.27Å; K100-D104 PolarHBondContact O-N 2.95Å
101	M	78.9	Confident	70.1	Confident	4 Å²	4	68.8 Å²	68.8	2%	0.02	35%	0.35	C	S	.	.	H	α-helix	trans	-59.9	-37.9	174.8	177.7	-162.7	74.9	0	0	112.2	L97 F98 E99 M105 M126 Y130	L97-M101 WeakPolarHBondContact O-CB 3.47Å; L97-M101 PolarHBondContact O-N 2.82Å; F98-M101 HydrophobicContact CD2-CE 3.51Å; F98-M101 HydrophobicContact CE2-CE 3.47Å; F98-M101 VanDerWaalsContact CE2-CE 3.47Å; F98-M101 HydrophobicContact CG-CE 4.32Å; F98-M101 HydrophobicContact CZ-CE 4.26Å; F98-M101 WeakPolarHBondContact O-CB 3.43Å; F98-M101 PolarHBondContact O-N 3.06Å; E99-M101 VanDerWaalsContact C-N 3.35Å; E99-M101 PolarHBondContact O-N 3.31Å; M101-M105 HydrophobicContact CG-SD 4.43Å; M101-M105 WeakPolarHBondContact O-CB 3.24Å; M101-M105 VanDerWaalsContact O-CG 3.28Å; M101-M105 WeakPolarHBondContact O-CG 3.27Å; M101-M105 PolarHBondContact O-N 3.08Å; M101-M105 VanDerWaalsContact O-N 3.08Å; M101-M126 HydrophobicContact CE-CB 4.05Å; M101-M126 HydrophobicContact CE-CE 3.9Å; M101-M126 HydrophobicContact SD-CB 4.01Å; M101-Y130 HydrophobicContact CB-CD1 3.69Å; M101-Y130 HydrophobicContact CB-CE1 4.03Å; M101-Y130 HydrophobicContact CB-CG 4.19Å; M101-Y130 HydrophobicContact CG-CD1 3.7Å; M101-Y130 HydrophobicContact CG-CD2 4.16Å; M101-Y130 HydrophobicContact CG-CE1 4.29Å; M101-Y130 HydrophobicContact CG-CG 3.64Å; M101-Y130 HydrophobicContact SD-CG 4.25Å
102	L	73.1	Confident	69.9	Low	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-66.8	-38.3	176.2	-69.4	179.2	0	0	0	112.5	F98 E99 K100 M105 Q112 L115 R116	F98-L102 HydrophobicContact CD1-CD1 4.1Å; F98-L102 HydrophobicContact CD1-CG 4.42Å; F98-L102 HydrophobicContact CE1-CD1 3.64Å; F98-L102 HydrophobicContact CE1-CG 4.12Å; F98-L102 HydrophobicContact CZ-CD1 4.34Å; F98-L102 WeakPolarHBondContact O-CG 3.42Å; F98-L102 PolarHBondContact O-N 2.7Å; E99-L102 PolarHBondContact O-N 3.48Å; E99-L102 VanDerWaalsContact O-N 3.12Å; K100-L102 VanDerWaalsContact C-N 3.3Å; K100-L102 PolarHBondContact O-N 3.46Å; L102-M105 PolarHBondContact O-N 3.33Å; L102-Q112 HydrophobicContact CB-CG 4.5Å; L102-Q112 HydrophobicContact CD1-CB 4.28Å; L102-L115 HydrophobicContact CD2-CB 4.21Å; L102-L115 HydrophobicContact CD2-CD1 3.75Å; L102-R116 HydrophobicContact CD1-CG 3.89Å
103	V	64.1	Low	69.9	Low	67 Å²	67	64.7 Å²	64.7	41%	0.406	32%	0.322	S	S	.	.	H	α-helix	trans	-65.7	-50.5	173.1	174.5	0	0	0	0	110.8	E99 K100 M105 N106	E99-V103 WeakPolarHBondContact O-CG2 3.46Å; E99-V103 PolarHBondContact O-N 3.46Å; K100-V103 PolarHBondContact O-N 2.82Å; V103-M105 PolarHBondContact O-N 3.39Å; V103-M105 VanDerWaalsContact O-N 3.07Å; V103-N106 PolarHBondContact O-N 2.87Å
104	D	61	Low	69.7	Low	38 Å²	38	63.9 Å²	63.9	20%	0.203	32%	0.321	C	S	.	.	H	α-helix	trans	-61	-18.5	178.7	-68.3	-25.7	0	0	0	112.6	K100 Y130	K100-D104 WeakPolarHBondContact CE-OD2 3.44Å; K100-D104 WeakPolarHBondContact CG-OD2 3.25Å; K100-D104 WeakPolarHBondContact O-CB 3.34Å; K100-D104 VanDerWaalsContact O-CG 3.27Å; K100-D104 PolarHBondContact O-N 2.95Å; D104-Y130 WeakPolarHBondContact CB-OH 3.45Å; D104-Y130 VanDerWaalsContact CG-OH 3.25Å; D104-Y130 PolarHBondContact OD2-OH 2.86Å
105	M	66.4	Low	69.5	Low	100 Å²	100	65.7 Å²	65.7	49%	0.493	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.6	-6.1	176.5	-78.5	-167.6	72.6	0	0	115.8	M101 L102 V103 L107	M101-M105 HydrophobicContact CG-SD 4.43Å; M101-M105 WeakPolarHBondContact O-CB 3.24Å; M101-M105 VanDerWaalsContact O-CG 3.28Å; M101-M105 WeakPolarHBondContact O-CG 3.27Å; M101-M105 PolarHBondContact O-N 3.08Å; M101-M105 VanDerWaalsContact O-N 3.08Å; L102-M105 PolarHBondContact O-N 3.33Å; V103-M105 PolarHBondContact O-N 3.39Å; V103-M105 VanDerWaalsContact O-N 3.07Å; M105-L107 HydrophobicContact CB-CD1 4.43Å; M105-L107 HydrophobicContact CB-CG 4.22Å; M105-L107 HydrophobicContact CE-CD1 4.32Å; M105-L107 PolarHBondContact O-N 3.24Å
106	N	54.9	Low	69.7	Low	67 Å²	67	66.1 Å²	66.1	36%	0.358	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	47.9	50.2	176.7	-168.8	9	0	0	0	113.9	V103 T1142	V103-N106 PolarHBondContact O-N 2.87Å; N106-T1142 PolarHBondContact OD1-OG1 3.33Å
107	L	65.3	Low	70	Confident	48 Å²	48	70 Å²	70	25%	0.251	34%	0.335	S	S	.	.			trans	-98	139.6	175.8	-64.2	178.1	0	0	0	110.7	M105 K111 Q112 L115	M105-L107 HydrophobicContact CB-CD1 4.43Å; M105-L107 HydrophobicContact CB-CG 4.22Å; M105-L107 HydrophobicContact CE-CD1 4.32Å; M105-L107 PolarHBondContact O-N 3.24Å; L107-K111 HydrophobicContact CB-CB 4.44Å; L107-Q112 HydrophobicContact CB-CG 4.11Å; L107-Q112 WeakPolarHBondContact O-CG 3.49Å; L107-Q112 PolarHBondContact O-NE2 3.46Å; L107-L115 HydrophobicContact CD1-CD1 4.09Å
108	N	58	Low	70.3	Confident	71 Å²	71	72.1 Å²	72.1	38%	0.38	34%	0.342	S	S	.	.			trans	-65	152.6	173.4	72.6	-39.9	0	0	0	111.9	E110 K111 Q112	N108-E110 PolarHBondContact O-N 3.28Å; N108-E110 VanDerWaalsContact O-N 3.12Å; N108-K111 PolarHBondContact O-N 3.31Å; N108-K111 WeakPolarHBondContact OD1-CD 3.49Å; N108-K111 VanDerWaalsContact OD1-CE 3.31Å; N108-K111 WeakPolarHBondContact OD1-CE 3.22Å; N108-K111 VanDerWaalsContact OD1-CG 3.22Å; N108-K111 WeakPolarHBondContact OD1-CG 3.39Å; N108-K111 PolarHBondContact OD1-NZ 3.29Å; N108-Q112 PolarHBondContact O-N 3.11Å; N108-Q112 VanDerWaalsContact O-N 3.11Å
109	E	66.7	Low	70.3	Confident	100 Å²	100	78.1 Å²	78.1	47%	0.467	37%	0.369	S	S	.	.	H	α-helix	trans	-58.9	-33.8	-168	-153.2	-128.3	129.8	0	0	113.3	K111 Q112 R113	E109-K111 VanDerWaalsContact C-N 3.25Å; E109-K111 PolarHBondContact O-N 3.17Å; E109-Q112 WeakPolarHBondContact O-CB 3.33Å; E109-Q112 PolarHBondContact O-N 2.86Å; E109-Q112 VanDerWaalsContact O-N 3.08Å; E109-R113 WeakPolarHBondContact O-CB 3.46Å; E109-R113 PolarHBondContact O-N 3.13Å; E109-R113 IonicContact OE1-CZ 3.01Å; E109-R113 VanDerWaalsContact OE1-CZ 3.27Å; E109-R113 IonicContact OE1-NE 3.25Å; E109-R113 PolarHBondContact OE1-NE 3.35Å; E109-R113 IonicContact OE1-NH2 3.16Å; E109-R113 PolarHBondContact OE1-NH2 2.89Å; E109-R113 IonicContact OE2-CZ 2.89Å; E109-R113 IonicContact OE2-NH2 2.59Å; E109-R113 PolarHBondContact OE2-NH2 2.83Å
110	E	60.3	Low	70.5	Confident	146 Å²	146	77 Å²	77	68%	0.682	37%	0.365	S	S	*	.	H	α-helix	trans	-59.5	-31.8	174.5	-169.9	-179.4	-133.8	0	0	113.3	N108 P114	N108-E110 PolarHBondContact O-N 3.28Å; N108-E110 VanDerWaalsContact O-N 3.12Å; E110-P114 WeakPolarHBondContact O-CD 3.34Å
111	K	64.9	Low	70.8	Confident	121 Å²	121	74.4 Å²	74.4	53%	0.526	36%	0.362	S	S	.	.	H	α-helix	trans	-86.4	-27.7	173.5	-65.4	176.3	-164	119.4	0	112.3	L107 N108 E109 L115	L107-K111 HydrophobicContact CB-CB 4.44Å; N108-K111 PolarHBondContact O-N 3.31Å; N108-K111 WeakPolarHBondContact OD1-CD 3.49Å; N108-K111 VanDerWaalsContact OD1-CE 3.31Å; N108-K111 WeakPolarHBondContact OD1-CE 3.22Å; N108-K111 VanDerWaalsContact OD1-CG 3.22Å; N108-K111 WeakPolarHBondContact OD1-CG 3.39Å; N108-K111 PolarHBondContact OD1-NZ 3.29Å; E109-K111 VanDerWaalsContact C-N 3.25Å; E109-K111 PolarHBondContact O-N 3.17Å; K111-L115 WeakPolarHBondContact O-CG 3.28Å
112	Q	71.6	Confident	70.8	Confident	28 Å²	28	77.9 Å²	77.9	13%	0.131	38%	0.38	C	S	.	.	H	α-helix	trans	-69.5	-40.5	173.4	-62.8	-177.5	4.2	0	0	112	L102 L107 N108 E109 L115 R116	L102-Q112 HydrophobicContact CB-CG 4.5Å; L102-Q112 HydrophobicContact CD1-CB 4.28Å; L107-Q112 HydrophobicContact CB-CG 4.11Å; L107-Q112 WeakPolarHBondContact O-CG 3.49Å; L107-Q112 PolarHBondContact O-NE2 3.46Å; N108-Q112 PolarHBondContact O-N 3.11Å; N108-Q112 VanDerWaalsContact O-N 3.11Å; E109-Q112 WeakPolarHBondContact O-CB 3.33Å; E109-Q112 PolarHBondContact O-N 2.86Å; E109-Q112 VanDerWaalsContact O-N 3.08Å; Q112-L115 CarbonylContact O-C 3.56Å; Q112-L115 WeakPolarHBondContact O-CA 3.09Å; Q112-L115 VanDerWaalsContact O-CB 3.31Å; Q112-L115 WeakPolarHBondContact O-CB 3.48Å; Q112-L115 PolarHBondContact O-N 3.5Å; Q112-R116 PolarHBondContact O-N 3.34Å
113	R	70.7	Confident	71.2	Confident	127 Å²	127	78.7 Å²	78.7	48%	0.479	38%	0.383	S	S	.	.	H	α-helix	trans	-53.9	-51.9	-174.7	-155.9	173.6	-68.6	163.6	-6.1	114.1	E109 L115 R116 E117	E109-R113 WeakPolarHBondContact O-CB 3.46Å; E109-R113 PolarHBondContact O-N 3.13Å; E109-R113 IonicContact OE1-CZ 3.01Å; E109-R113 VanDerWaalsContact OE1-CZ 3.27Å; E109-R113 IonicContact OE1-NE 3.25Å; E109-R113 PolarHBondContact OE1-NE 3.35Å; E109-R113 IonicContact OE1-NH2 3.16Å; E109-R113 PolarHBondContact OE1-NH2 2.89Å; E109-R113 IonicContact OE2-CZ 2.89Å; E109-R113 IonicContact OE2-NH2 2.59Å; E109-R113 PolarHBondContact OE2-NH2 2.83Å; R113-L115 PolarHBondContact O-N 2.9Å; R113-L115 VanDerWaalsContact O-N 3.17Å; R113-R116 PolarHBondContact O-N 3.24Å; R113-R116 VanDerWaalsContact O-N 3.12Å; R113-E117 WeakPolarHBondContact O-CG 3.4Å; R113-E117 PolarHBondContact O-N 3.22Å; R113-E117 VanDerWaalsContact O-N 3.13Å
114	P	70.8	Confident	72	Confident	56 Å²	56	78.6 Å²	78.6	36%	0.364	38%	0.376	S	S	.	.	H	α-helix	trans	-70.8	-7.6	175.8	30.1	-37.6	0	0	0	114.7	E110 K118	E110-P114 WeakPolarHBondContact O-CD 3.34Å; P114-K118 WeakPolarHBondContact O-CE 3.35Å; P114-K118 PolarHBondContact O-NZ 3.36Å
115	L	75.1	Confident	72.7	Confident	42 Å²	42	82.3 Å²	82.3	22%	0.22	39%	0.392	C	S	.	.	H	α-helix	trans	-88.9	-39.2	168.9	-59.6	175.1	0	0	0	110.8	F98 L102 L107 K111 Q112 R113 E117 K118 M126	F98-L115 HydrophobicContact CZ-CB 4.11Å; F98-L115 WeakPolarHBondContact CZ-O 3.31Å; L102-L115 HydrophobicContact CD2-CB 4.21Å; L102-L115 HydrophobicContact CD2-CD1 3.75Å; L107-L115 HydrophobicContact CD1-CD1 4.09Å; K111-L115 WeakPolarHBondContact O-CG 3.28Å; Q112-L115 CarbonylContact O-C 3.56Å; Q112-L115 WeakPolarHBondContact O-CA 3.09Å; Q112-L115 VanDerWaalsContact O-CB 3.31Å; Q112-L115 WeakPolarHBondContact O-CB 3.48Å; Q112-L115 PolarHBondContact O-N 3.5Å; R113-L115 PolarHBondContact O-N 2.9Å; R113-L115 VanDerWaalsContact O-N 3.17Å; L115-E117 PolarHBondContact O-N 2.99Å; L115-K118 WeakPolarHBondContact O-CB 3.49Å; L115-K118 WeakPolarHBondContact O-CG 3.42Å; L115-K118 PolarHBondContact O-N 3.35Å; L115-K118 VanDerWaalsContact O-N 3.13Å; L115-M126 HydrophobicContact CD2-CE 4.31Å
116	R	83.4	Confident	73.2	Confident	79 Å²	79	80 Å²	80	30%	0.298	38%	0.381	S	S	.	.	H	α-helix	trans	-60.7	-31.9	172.1	-71	-170.4	173.3	107.5	11.2	112.7	E99 L102 Q112 R113 K118 K123	E99-R116 VanDerWaalsContact CD-NE 3.32Å; E99-R116 WeakPolarHBondContact OE1-CD 3.37Å; E99-R116 WeakPolarHBondContact OE1-CG 3.48Å; E99-R116 IonicContact OE1-NE 3.2Å; E99-R116 PolarHBondContact OE1-NE 3.31Å; E99-R116 IonicContact OE2-CZ 2.7Å; E99-R116 IonicContact OE2-NE 3Å; E99-R116 PolarHBondContact OE2-NE 3.41Å; E99-R116 IonicContact OE2-NH2 2.95Å; E99-R116 PolarHBondContact OE2-NH2 3.4Å; L102-R116 HydrophobicContact CD1-CG 3.89Å; Q112-R116 PolarHBondContact O-N 3.34Å; R113-R116 PolarHBondContact O-N 3.24Å; R113-R116 VanDerWaalsContact O-N 3.12Å; R116-K118 VanDerWaalsContact C-N 3.26Å; R116-K118 PolarHBondContact O-N 3.25Å; R116-K123 WeakPolarHBondContact O-CE 3.49Å; R116-K123 PolarHBondContact O-NZ 2.96Å
117	E	80.6	Confident	74.2	Confident	147 Å²	147	77 Å²	77	69%	0.687	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-5.3	175.9	-70.4	169.2	-171.9	0	0	114.8	R113 L115	R113-E117 WeakPolarHBondContact O-CG 3.4Å; R113-E117 PolarHBondContact O-N 3.22Å; R113-E117 VanDerWaalsContact O-N 3.13Å; L115-E117 PolarHBondContact O-N 2.99Å
118	K	82	Confident	74.3	Confident	93 Å²	93	76.5 Å²	76.5	40%	0.404	37%	0.365	S	S	.	.	S	Bend	trans	-74.4	146.7	179.4	-59.7	-52.8	-177.1	-150.3	0	112.6	P114 L115 R116 I122 K123	P114-K118 WeakPolarHBondContact O-CE 3.35Å; P114-K118 PolarHBondContact O-NZ 3.36Å; L115-K118 WeakPolarHBondContact O-CB 3.49Å; L115-K118 WeakPolarHBondContact O-CG 3.42Å; L115-K118 PolarHBondContact O-N 3.35Å; L115-K118 VanDerWaalsContact O-N 3.13Å; R116-K118 VanDerWaalsContact C-N 3.26Å; R116-K118 PolarHBondContact O-N 3.25Å; K118-I122 HydrophobicContact CB-CB 4.15Å; K118-I122 HydrophobicContact CB-CD1 4.39Å; K118-I122 HydrophobicContact CB-CG2 4.14Å; K118-I122 HydrophobicContact CG-CG2 4.38Å; K118-K123 VanDerWaalsContact O-CE 3.27Å; K118-K123 WeakPolarHBondContact O-CE 3.43Å
119	H	82	Confident	74.7	Confident	125 Å²	125	78.5 Å²	78.5	58%	0.579	37%	0.372	S	S	*	.			trans	-57.3	146.8	175.4	-168	-106.4	0	0	0	111.8	S121 I122 K123	H119-S121 PolarHBondContact CE1-OG 2.62Å; H119-S121 PolarHBondContact ND1-OG 3.29Å; H119-S121 PolarHBondContact O-N 3.38Å; H119-S121 VanDerWaalsContact O-N 3.07Å; H119-I122 WeakPolarHBondContact O-CB 3.48Å; H119-I122 PolarHBondContact O-N 3.18Å; H119-K123 PolarHBondContact O-N 3.41Å
120	I	82	Confident	74.9	Confident	36 Å²	36	76.5 Å²	76.5	19%	0.185	36%	0.361	C	S	.	.	H	α-helix	trans	-56	-31.7	-173.9	-169.5	59.5	0	0	0	113.3	D91 I94 L95 I122 K123 R124	D91-I120 HydrophobicContact CB-CD1 4.27Å; D91-I120 HydrophobicContact CB-CG1 3.97Å; D91-I120 VanDerWaalsContact OD1-CG1 3.28Å; D91-I120 WeakPolarHBondContact OD1-CG1 3.41Å; I94-I120 HydrophobicContact CB-CD1 4.38Å; I94-I120 HydrophobicContact CG2-CD1 3.94Å; L95-I120 HydrophobicContact CD2-CD1 4.03Å; L95-I120 HydrophobicContact CG-CD1 3.89Å; I120-I122 VanDerWaalsContact C-N 3.34Å; I120-I122 PolarHBondContact O-N 3.25Å; I120-K123 HydrophobicContact CD1-CB 4.31Å; I120-K123 HydrophobicContact CD1-CD 4.46Å; I120-K123 WeakPolarHBondContact O-CB 3.15Å; I120-K123 PolarHBondContact O-N 2.83Å; I120-R124 WeakPolarHBondContact O-CG 3.21Å; I120-R124 PolarHBondContact O-N 3.03Å
121	S	74.8	Confident	75.1	Confident	68 Å²	68	72.5 Å²	72.5	48%	0.476	34%	0.344	S	S	.	.	H	α-helix	trans	-60.3	-39.6	173.7	-40.6	0	0	0	0	113.2	H119 R124 E125	H119-S121 PolarHBondContact CE1-OG 2.62Å; H119-S121 PolarHBondContact ND1-OG 3.29Å; H119-S121 PolarHBondContact O-N 3.38Å; H119-S121 VanDerWaalsContact O-N 3.07Å; S121-R124 PolarHBondContact O-N 3.25Å; S121-E125 PolarHBondContact O-N 3.25Å
122	I	79.6	Confident	74.7	Confident	76 Å²	76	73.4 Å²	73.4	39%	0.39	35%	0.35	S	S	.	.	H	α-helix	trans	-72.1	-38.3	177.4	-58.3	173.6	0	0	0	109.4	K118 H119 I120 E125 M126	K118-I122 HydrophobicContact CB-CB 4.15Å; K118-I122 HydrophobicContact CB-CD1 4.39Å; K118-I122 HydrophobicContact CB-CG2 4.14Å; K118-I122 HydrophobicContact CG-CG2 4.38Å; H119-I122 WeakPolarHBondContact O-CB 3.48Å; H119-I122 PolarHBondContact O-N 3.18Å; I120-I122 VanDerWaalsContact C-N 3.34Å; I120-I122 PolarHBondContact O-N 3.25Å; I122-E125 PolarHBondContact O-N 3.17Å; I122-M126 HydrophobicContact CG2-CG 4.41Å; I122-M126 HydrophobicContact CG2-SD 4.25Å; I122-M126 WeakPolarHBondContact O-CG 3.41Å; I122-M126 PolarHBondContact O-N 2.96Å
123	K	81.6	Confident	74.1	Confident	17 Å²	17	76.3 Å²	76.3	7%	0.074	37%	0.37	C	S	.	.	H	α-helix	trans	-62.4	-44.3	173.1	-60	-168.8	174.3	-178.6	0	111.8	I94 L95 F98 R116 K118 H119 I120 E125 M126 V127	I94-K123 HydrophobicContact CG2-CB 4.43Å; L95-K123 HydrophobicContact CD2-CD 3.74Å; F98-K123 HydrophobicContact CB-CB 4.37Å; F98-K123 HydrophobicContact CB-CD 4.5Å; F98-K123 HydrophobicContact CD1-CD 3.71Å; F98-K123 HydrophobicContact CD1-CG 4.18Å; F98-K123 HydrophobicContact CD2-CB 3.55Å; F98-K123 HydrophobicContact CD2-CD 4.12Å; F98-K123 HydrophobicContact CD2-CG 3.71Å; F98-K123 HydrophobicContact CE1-CD 3.83Å; F98-K123 HydrophobicContact CE1-CG 4.11Å; F98-K123 HydrophobicContact CE2-CB 3.92Å; F98-K123 HydrophobicContact CE2-CD 4.24Å; F98-K123 HydrophobicContact CE2-CG 3.63Å; F98-K123 HydrophobicContact CG-CB 3.94Å; F98-K123 HydrophobicContact CG-CD 3.85Å; F98-K123 HydrophobicContact CG-CG 3.98Å; F98-K123 HydrophobicContact CZ-CD 4.09Å; F98-K123 HydrophobicContact CZ-CG 3.84Å; R116-K123 WeakPolarHBondContact O-CE 3.49Å; R116-K123 PolarHBondContact O-NZ 2.96Å; K118-K123 VanDerWaalsContact O-CE 3.27Å; K118-K123 WeakPolarHBondContact O-CE 3.43Å; H119-K123 PolarHBondContact O-N 3.41Å; I120-K123 HydrophobicContact CD1-CB 4.31Å; I120-K123 HydrophobicContact CD1-CD 4.46Å; I120-K123 WeakPolarHBondContact O-CB 3.15Å; I120-K123 PolarHBondContact O-N 2.83Å; K123-E125 VanDerWaalsContact C-N 3.33Å; K123-E125 PolarHBondContact O-N 2.88Å; K123-M126 PolarHBondContact O-N 2.99Å; K123-V127 WeakPolarHBondContact O-CB 3.45Å; K123-V127 WeakPolarHBondContact O-CG2 3.35Å; K123-V127 PolarHBondContact O-N 2.92Å
124	R	80.7	Confident	73.2	Confident	66 Å²	66	72.4 Å²	72.4	25%	0.249	36%	0.361	C	S	.	.	H	α-helix	trans	-56.1	-44.6	172.1	-77	-173.8	176.9	-97.7	0.9	111.4	L86 Q89 T90 D91 I94 I120 S121 S128	L86-R124 PolarHBondContact O-NH1 3.05Å; Q89-R124 PolarHBondContact O-NH1 3.34Å; Q89-R124 PolarHBondContact O-NH2 3.13Å; T90-R124 VanDerWaalsContact C-NH2 3.3Å; T90-R124 PolarHBondContact O-NH2 3.12Å; D91-R124 IonicContact OD1-CZ 3.57Å; D91-R124 VanDerWaalsContact OD1-CZ 3.25Å; D91-R124 IonicContact OD1-NE 2.83Å; D91-R124 PolarHBondContact OD1-NE 3.2Å; D91-R124 IonicContact OD1-NH2 3.5Å; D91-R124 PolarHBondContact OD1-NH2 2.88Å; I94-R124 HydrophobicContact CB-CG 4.22Å; I94-R124 HydrophobicContact CD1-CG 4.1Å; I94-R124 HydrophobicContact CG1-CG 3.85Å; I94-R124 HydrophobicContact CG2-CB 4.38Å; I94-R124 HydrophobicContact CG2-CG 3.62Å; I120-R124 WeakPolarHBondContact O-CG 3.21Å; I120-R124 PolarHBondContact O-N 3.03Å; S121-R124 PolarHBondContact O-N 3.25Å; R124-S128 VanDerWaalsContact O-CB 3.3Å; R124-S128 WeakPolarHBondContact O-CB 3.35Å; R124-S128 PolarHBondContact O-N 3.25Å
125	E	75.6	Confident	72.1	Confident	115 Å²	115	77 Å²	77	54%	0.537	38%	0.376	S	S	.	.	H	α-helix	trans	-67.4	-46.4	178	-168.5	179	176.4	0	0	112.4	S121 I122 K123 V127 S128 Q129	S121-E125 PolarHBondContact O-N 3.25Å; I122-E125 PolarHBondContact O-N 3.17Å; K123-E125 VanDerWaalsContact C-N 3.33Å; K123-E125 PolarHBondContact O-N 2.88Å; E125-V127 PolarHBondContact O-N 3.23Å; E125-S128 WeakPolarHBondContact O-CB 3.31Å; E125-S128 PolarHBondContact O-N 3.42Å; E125-Q129 WeakPolarHBondContact O-CG 3.15Å; E125-Q129 PolarHBondContact O-N 2.96Å; E125-Q129 PolarHBondContact OE1-NE2 2.97Å
126	M	75.9	Confident	70.7	Confident	53 Å²	53	78.5 Å²	78.5	26%	0.261	39%	0.394	S	S	.	.	H	α-helix	trans	-61.2	-43.9	177	-70.9	-178.2	73.6	0	0	112	F98 M101 L115 I122 K123 S128 Q129 Y130	F98-M126 HydrophobicContact CE2-CB 4.32Å; F98-M126 HydrophobicContact CE2-SD 3.98Å; M101-M126 HydrophobicContact CE-CB 4.05Å; M101-M126 HydrophobicContact CE-CE 3.9Å; M101-M126 HydrophobicContact SD-CB 4.01Å; L115-M126 HydrophobicContact CD2-CE 4.31Å; I122-M126 HydrophobicContact CG2-CG 4.41Å; I122-M126 HydrophobicContact CG2-SD 4.25Å; I122-M126 WeakPolarHBondContact O-CG 3.41Å; I122-M126 PolarHBondContact O-N 2.96Å; K123-M126 PolarHBondContact O-N 2.99Å; M126-S128 PolarHBondContact O-N 2.58Å; M126-Q129 PolarHBondContact O-N 2.98Å; M126-Y130 WeakPolarHBondContact O-CB 3.22Å; M126-Y130 PolarHBondContact O-N 2.77Å
127	V	76.3	Confident	68.7	Low	2 Å²	2	76 Å²	76	1%	0.012	39%	0.393	C	S	.	.	H	α-helix	trans	-62	-41.8	174	167.3	0	0	0	0	111.3	I94 L97 F98 K123 E125 Y130 L131	I94-V127 HydrophobicContact CD1-CG1 4.49Å; L97-V127 HydrophobicContact CB-CG1 3.74Å; L97-V127 HydrophobicContact CB-CG2 4.14Å; L97-V127 HydrophobicContact CD1-CG1 4.19Å; F98-V127 HydrophobicContact CB-CG2 3.76Å; F98-V127 HydrophobicContact CD2-CG2 4.19Å; F98-V127 HydrophobicContact CG-CG2 4.5Å; K123-V127 WeakPolarHBondContact O-CB 3.45Å; K123-V127 WeakPolarHBondContact O-CG2 3.35Å; K123-V127 PolarHBondContact O-N 2.92Å; E125-V127 PolarHBondContact O-N 3.23Å; V127-Y130 PolarHBondContact O-N 3.19Å; V127-L131 HydrophobicContact CG1-CD1 3.81Å; V127-L131 HydrophobicContact CG1-CG 4.34Å; V127-L131 WeakPolarHBondContact O-CB 3.5Å; V127-L131 VanDerWaalsContact O-CG 3.25Å; V127-L131 WeakPolarHBondContact O-CG 3.49Å; V127-L131 PolarHBondContact O-N 3.44Å
128	S	68.4	Low	66.9	Low	39 Å²	39	74.5 Å²	74.5	27%	0.273	39%	0.386	S	S	.	.	H	α-helix	trans	-62.3	-46	176.3	-173.7	0	0	0	0	111.8	R124 E125 M126 L131 H132	R124-S128 VanDerWaalsContact O-CB 3.3Å; R124-S128 WeakPolarHBondContact O-CB 3.35Å; R124-S128 PolarHBondContact O-N 3.25Å; E125-S128 WeakPolarHBondContact O-CB 3.31Å; E125-S128 PolarHBondContact O-N 3.42Å; M126-S128 PolarHBondContact O-N 2.58Å; S128-L131 PolarHBondContact O-N 2.8Å; S128-H132 PolarHBondContact O-CD2 3.32Å; S128-H132 PolarHBondContact O-N 3.49Å
129	Q	65.3	Low	64.7	Low	112 Å²	112	77.3 Å²	77.3	52%	0.523	41%	0.405	S	S	.	.	H	α-helix	trans	-62.9	-42.4	175.1	-68.4	-176.1	24.6	0	0	111.5	E125 M126 H132 T133	E125-Q129 WeakPolarHBondContact O-CG 3.15Å; E125-Q129 PolarHBondContact O-N 2.96Å; E125-Q129 PolarHBondContact OE1-NE2 2.97Å; M126-Q129 PolarHBondContact O-N 2.98Å; Q129-H132 PolarHBondContact O-N 3.47Å; Q129-T133 PolarHBondContact O-N 2.88Å; Q129-T133 PolarHBondContact O-OG1 3.28Å; Q129-T133 VanDerWaalsContact O-OG1 3.08Å
130	Y	70.7	Confident	62.8	Low	58 Å²	58	78.7 Å²	78.7	23%	0.227	41%	0.412	C	S	.	.	H	α-helix	trans	-59	-48.2	175.4	173.9	-126.2	0	0	0	112.2	M101 D104 M126 V127 H132 T133 S134	M101-Y130 HydrophobicContact CB-CD1 3.69Å; M101-Y130 HydrophobicContact CB-CE1 4.03Å; M101-Y130 HydrophobicContact CB-CG 4.19Å; M101-Y130 HydrophobicContact CG-CD1 3.7Å; M101-Y130 HydrophobicContact CG-CD2 4.16Å; M101-Y130 HydrophobicContact CG-CE1 4.29Å; M101-Y130 HydrophobicContact CG-CG 3.64Å; M101-Y130 HydrophobicContact SD-CG 4.25Å; D104-Y130 WeakPolarHBondContact CB-OH 3.45Å; D104-Y130 VanDerWaalsContact CG-OH 3.25Å; D104-Y130 PolarHBondContact OD2-OH 2.86Å; M126-Y130 WeakPolarHBondContact O-CB 3.22Å; M126-Y130 PolarHBondContact O-N 2.77Å; V127-Y130 PolarHBondContact O-N 3.19Å; Y130-H132 VanDerWaalsContact C-N 3.31Å; Y130-H132 PolarHBondContact O-N 2.85Å; Y130-T133 WeakPolarHBondContact CA-OG1 3.5Å; Y130-T133 PolarHBondContact O-N 3.08Å; Y130-T133 PolarHBondContact O-OG1 3.07Å; Y130-S134 VanDerWaalsContact O-CB 3.24Å; Y130-S134 WeakPolarHBondContact O-CB 3.47Å; Y130-S134 PolarHBondContact O-N 3.46Å
131	L	65.6	Low	60.9	Low	62 Å²	62	84.5 Å²	84.5	33%	0.325	43%	0.432	S	S	.	.	H	α-helix	trans	-64.5	-33.2	177.3	-68.9	169.8	0	0	0	112.4	V127 S128 K135	V127-L131 HydrophobicContact CG1-CD1 3.81Å; V127-L131 HydrophobicContact CG1-CG 4.34Å; V127-L131 WeakPolarHBondContact O-CB 3.5Å; V127-L131 VanDerWaalsContact O-CG 3.25Å; V127-L131 WeakPolarHBondContact O-CG 3.49Å; V127-L131 PolarHBondContact O-N 3.44Å; S128-L131 PolarHBondContact O-N 2.8Å; L131-K135 PolarHBondContact O-N 3.19Å
132	H	57	Low	59.2	Low	140 Å²	140	90.1 Å²	90.1	65%	0.648	45%	0.451	S	S	*	.	H	α-helix	trans	-68.6	-47.3	171.6	-95.2	-85.8	0	0	0	112.4	S128 Q129 Y130 S134 K135 A136	S128-H132 PolarHBondContact O-CD2 3.32Å; S128-H132 PolarHBondContact O-N 3.49Å; Q129-H132 PolarHBondContact O-N 3.47Å; Y130-H132 VanDerWaalsContact C-N 3.31Å; Y130-H132 PolarHBondContact O-N 2.85Å; H132-S134 VanDerWaalsContact C-N 3.33Å; H132-S134 PolarHBondContact O-N 3.07Å; H132-K135 PolarHBondContact O-N 3.28Å; H132-A136 PolarHBondContact O-N 3.08Å; H132-A136 VanDerWaalsContact O-N 3.11Å
133	T	57.4	Low	57.6	Low	90 Å²	90	97.8 Å²	97.8	55%	0.552	48%	0.475	S	S	*	.	H	α-helix	trans	-66.5	-34.1	177.8	49.8	0	0	0	0	112.5	Q129 Y130 K135 A136 G137	Q129-T133 PolarHBondContact O-N 2.88Å; Q129-T133 PolarHBondContact O-OG1 3.28Å; Q129-T133 VanDerWaalsContact O-OG1 3.08Å; Y130-T133 WeakPolarHBondContact CA-OG1 3.5Å; Y130-T133 PolarHBondContact O-N 3.08Å; Y130-T133 PolarHBondContact O-OG1 3.07Å; T133-K135 VanDerWaalsContact C-N 3.29Å; T133-K135 PolarHBondContact O-N 2.76Å; T133-A136 PolarHBondContact O-N 3.11Å; T133-G137 PolarHBondContact O-N 3.12Å
134	S	53.2	Low	56.3	Low	44 Å²	44	100.3 Å²	100.3	31%	0.308	49%	0.494	S	S	.	.	H	α-helix	trans	-63	-34.4	176.7	-172.6	0	0	0	0	112.3	Y130 H132	Y130-S134 VanDerWaalsContact O-CB 3.24Å; Y130-S134 WeakPolarHBondContact O-CB 3.47Å; Y130-S134 PolarHBondContact O-N 3.46Å; H132-S134 VanDerWaalsContact C-N 3.33Å; H132-S134 PolarHBondContact O-N 3.07Å
135	K	46.3	Very low	55.6	Low	153 Å²	153	101 Å²	101	67%	0.665	50%	0.499	S	S	*	.	H	α-helix	trans	-74.8	-41.8	171.9	-72.8	-178.4	177.6	178.5	0	112.8	L131 H132 T133 G137 Q138	L131-K135 PolarHBondContact O-N 3.19Å; H132-K135 PolarHBondContact O-N 3.28Å; T133-K135 VanDerWaalsContact C-N 3.29Å; T133-K135 PolarHBondContact O-N 2.76Å; K135-G137 PolarHBondContact O-N 2.81Å; K135-Q138 WeakPolarHBondContact O-CB 3.36Å; K135-Q138 WeakPolarHBondContact O-CG 3.39Å; K135-Q138 PolarHBondContact O-N 2.68Å; K135-Q138 VanDerWaalsContact O-N 3.17Å
136	A	46.6	Very low	55.7	Low	73 Å²	73	98.3 Å²	98.3	60%	0.603	49%	0.494	S	S	*	.	H	α-helix	trans	-62.3	-27.5	173.7	0	0	0	0	0	112.8	H132 T133 Q138	H132-A136 PolarHBondContact O-N 3.08Å; H132-A136 VanDerWaalsContact O-N 3.11Å; T133-A136 PolarHBondContact O-N 3.11Å; A136-Q138 PolarHBondContact O-N 2.89Å
137	G	42	Very low	55.9	Low	27 Å²	27	96 Å²	96	28%	0.278	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71	-7.4	175.5	0	0	0	0	0	115.4	T133 K135 D139 Q140 R141	T133-G137 PolarHBondContact O-N 3.12Å; K135-G137 PolarHBondContact O-N 2.81Å; G137-D139 VanDerWaalsContact C-N 3.35Å; G137-D139 PolarHBondContact O-N 3.01Å; G137-Q140 PolarHBondContact O-N 3.03Å; G137-R141 PolarHBondContact O-N 3Å
138	Q	41	Very low	56.2	Low	115 Å²	115	99.3 Å²	99.3	54%	0.537	50%	0.503	S	S	.	.	H	α-helix	trans	-64.5	-37.6	-180	-68.6	-170.8	-107.4	0	0	112.4	K135 A136 Q140 R141	K135-Q138 WeakPolarHBondContact O-CB 3.36Å; K135-Q138 WeakPolarHBondContact O-CG 3.39Å; K135-Q138 PolarHBondContact O-N 2.68Å; K135-Q138 VanDerWaalsContact O-N 3.17Å; A136-Q138 PolarHBondContact O-N 2.89Å; Q138-Q140 PolarHBondContact O-N 3.24Å; Q138-R141 WeakPolarHBondContact O-CB 3.42Å; Q138-R141 PolarHBondContact O-N 3.4Å
139	D	36.8	Very low	56.8	Low	152 Å²	152	101.3 Å²	101.3	81%	0.813	51%	0.509	S	S	*	.	H	α-helix	trans	-69.3	-11.9	178.5	-65.4	-25.9	0	0	0	113.8	G137	G137-D139 VanDerWaalsContact C-N 3.35Å; G137-D139 PolarHBondContact O-N 3.01Å
140	Q	41.6	Very low	57.9	Low	155 Å²	155	96.1 Å²	96.1	72%	0.724	48%	0.484	S	S	*	.	H	α-helix	trans	-94.2	-19.3	170.3	-71.8	-167.9	-7.6	0	0	113.4	G137 Q138 E142 R143	G137-Q140 PolarHBondContact O-N 3.03Å; Q138-Q140 PolarHBondContact O-N 3.24Å; Q140-E142 VanDerWaalsContact C-N 3.25Å; Q140-E142 PolarHBondContact O-N 2.85Å; Q140-R143 PolarHBondContact O-N 3.12Å
141	R	42.7	Very low	58.6	Low	157 Å²	157	93.7 Å²	93.7	59%	0.592	48%	0.475	S	S	*	.	H	α-helix	trans	-65.1	-25.7	-176.3	-77.5	-178.1	173.7	-176.5	-1.4	113.5	G137 Q138 R143	G137-R141 PolarHBondContact O-N 3Å; Q138-R141 WeakPolarHBondContact O-CB 3.42Å; Q138-R141 PolarHBondContact O-N 3.4Å; R141-R143 PolarHBondContact O-N 2.93Å
142	E	39.5	Very low	59.4	Low	186 Å²	186	95.4 Å²	95.4	87%	0.869	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-6.6	178.4	-62	-162.8	145.5	0	0	114.7	Q140	Q140-E142 VanDerWaalsContact C-N 3.25Å; Q140-E142 PolarHBondContact O-N 2.85Å
143	R	44.8	Very low	60.7	Low	237 Å²	237	90.5 Å²	90.5	89%	0.894	46%	0.459	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.7	-11.4	178.8	-74.1	-173	173.5	-174.8	-1.1	115.6	Q140 R141	Q140-R143 PolarHBondContact O-N 3.12Å; R141-R143 PolarHBondContact O-N 2.93Å
144	S	54.7	Low	62	Low	70 Å²	70	87 Å²	87	49%	0.49	44%	0.436	S	S	.	.	S	Bend	trans	-92	116.7	178.2	-67.1	0	0	0	0	110.8	S146	S144-S146 PolarHBondContact O-N 3.39Å
145	K	66.6	Low	63.5	Low	80 Å²	80	90.2 Å²	90.2	35%	0.348	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-57.1	135.5	171.5	-67.1	-173.6	-173.8	-174.6	0	110.2	M149 Y150 E153	K145-M149 HydrophobicContact CB-CB 4.35Å; K145-Y150 HydrophobicContact CB-CD2 4.09Å; K145-Y150 HydrophobicContact CB-CE2 3.56Å; K145-Y150 HydrophobicContact CD-CE1 4.07Å; K145-Y150 HydrophobicContact CD-CE2 4.46Å; K145-E153 WeakPolarHBondContact CE-OE1 3.43Å; K145-E153 IonicContact NZ-OE1 3.24Å; K145-E153 PolarHBondContact NZ-OE1 2.97Å; K145-E153 IonicContact NZ-OE2 2.71Å; K145-E153 PolarHBondContact NZ-OE2 3Å
146	S	77.9	Confident	65.1	Low	60 Å²	60	90.5 Å²	90.5	42%	0.42	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-72.3	158.6	173.4	67.6	0	0	0	0	111.2	S144 V148 M149 Y150	S144-S146 PolarHBondContact O-N 3.39Å; S146-V148 PolarHBondContact O-N 3.35Å; S146-M149 WeakPolarHBondContact O-CB 3.41Å; S146-M149 PolarHBondContact O-N 2.93Å; S146-M149 WeakPolarHBondContact OG-CG 3.4Å; S146-M149 PolarHBondContact OG-N 2.99Å; S146-Y150 WeakPolarHBondContact O-CD2 3.39Å; S146-Y150 PolarHBondContact O-N 2.95Å
147	A	80.1	Confident	65.9	Low	4 Å²	4	94.5 Å²	94.5	3%	0.033	46%	0.457	C	S	.	.	H	α-helix	trans	-53.3	-42.3	176.6	0	0	0	0	0	112.5	M149 Y150 I151 W184 N187 F188	A147-M149 VanDerWaalsContact C-N 3.31Å; A147-M149 PolarHBondContact O-N 3.35Å; A147-Y150 PolarHBondContact O-N 3.11Å; A147-Y150 VanDerWaalsContact O-N 3.1Å; A147-I151 WeakPolarHBondContact O-CG1 3.29Å; A147-I151 PolarHBondContact O-N 3.08Å; A147-W184 HydrophobicContact CB-CD2 4.09Å; A147-W184 HydrophobicContact CB-CE3 4.23Å; A147-W184 HydrophobicContact CB-CH2 4.1Å; A147-W184 HydrophobicContact CB-CZ2 4Å; A147-W184 HydrophobicContact CB-CZ3 4.22Å; A147-N187 HydrophobicContact CB-CB 4.06Å; A147-F188 HydrophobicContact CB-CB 3.94Å; A147-F188 HydrophobicContact CB-CD2 4.43Å
148	V	81.5	Confident	67	Low	71 Å²	71	95.8 Å²	95.8	43%	0.43	45%	0.454	S	S	.	.	H	α-helix	trans	-61.9	-34.2	177.4	-176.7	0	0	0	0	112.6	S146 I151 Q152	S146-V148 PolarHBondContact O-N 3.35Å; V148-I151 PolarHBondContact O-N 3.32Å; V148-Q152 WeakPolarHBondContact O-CG 3.31Å; V148-Q152 PolarHBondContact O-N 2.98Å
149	M	82.3	Confident	67.9	Low	82 Å²	82	102.3 Å²	102.3	40%	0.404	47%	0.474	S	S	.	.	H	α-helix	trans	-66.6	-38.6	174.4	-70.8	-62.9	-61.2	0	0	111.7	K145 S146 A147 Q152 E153	K145-M149 HydrophobicContact CB-CB 4.35Å; S146-M149 WeakPolarHBondContact O-CB 3.41Å; S146-M149 PolarHBondContact O-N 2.93Å; S146-M149 WeakPolarHBondContact OG-CG 3.4Å; S146-M149 PolarHBondContact OG-N 2.99Å; A147-M149 VanDerWaalsContact C-N 3.31Å; A147-M149 PolarHBondContact O-N 3.35Å; M149-Q152 PolarHBondContact O-N 2.78Å; M149-E153 WeakPolarHBondContact O-CB 3.47Å; M149-E153 WeakPolarHBondContact O-CG 3.49Å; M149-E153 PolarHBondContact O-N 3.43Å
150	Y	86.9	Confident	69.9	Low	2 Å²	2	98 Å²	98	1%	0.008	45%	0.45	C	S	.	.	H	α-helix	trans	-67.2	-39.8	173.9	-72.6	-74.2	0	0	0	112.4	K145 S146 A147 Q152 E153 I154 S170 L171 S174 W184	K145-Y150 HydrophobicContact CB-CD2 4.09Å; K145-Y150 HydrophobicContact CB-CE2 3.56Å; K145-Y150 HydrophobicContact CD-CE1 4.07Å; K145-Y150 HydrophobicContact CD-CE2 4.46Å; S146-Y150 WeakPolarHBondContact O-CD2 3.39Å; S146-Y150 PolarHBondContact O-N 2.95Å; A147-Y150 PolarHBondContact O-N 3.11Å; A147-Y150 VanDerWaalsContact O-N 3.1Å; Y150-Q152 VanDerWaalsContact C-N 3.33Å; Y150-Q152 PolarHBondContact O-N 3.04Å; Y150-E153 PolarHBondContact O-N 3.45Å; Y150-I154 VanDerWaalsContact O-CG1 3.29Å; Y150-I154 WeakPolarHBondContact O-CG1 3.37Å; Y150-I154 PolarHBondContact O-N 3.45Å; Y150-S170 PolarHBondContact OH-O 3.19Å; Y150-S170 PolarHBondContact OH-OG 2.87Å; Y150-L171 HydrophobicContact CD1-CB 3.96Å; Y150-L171 HydrophobicContact CD1-CD1 4.34Å; Y150-L171 HydrophobicContact CD2-CD1 4.21Å; Y150-L171 HydrophobicContact CE1-CB 3.96Å; Y150-L171 HydrophobicContact CG-CD1 4.03Å; Y150-S174 WeakPolarHBondContact CE2-OG 3.39Å; Y150-S174 PolarHBondContact OH-OG 2.79Å; Y150-W184 AromaticContact CD2-CH2 3.71Å; Y150-W184 HydrophobicContact CD2-CH2 3.71Å; Y150-W184 AromaticContact CD2-CZ2 3.62Å; Y150-W184 HydrophobicContact CD2-CZ2 3.62Å; Y150-W184 HydrophobicContact CE2-CH2 4.04Å; Y150-W184 AromaticContact CE2-CZ2 3.71Å; Y150-W184 HydrophobicContact CE2-CZ2 3.71Å
151	I	85.7	Confident	71.6	Confident	7 Å²	7	93.6 Å²	93.6	4%	0.036	44%	0.435	C	S	.	.	H	α-helix	trans	-56.8	-47.9	172.8	-68.8	171.7	0	0	0	110.4	A147 V148 K155 F188 E191 L195	A147-I151 WeakPolarHBondContact O-CG1 3.29Å; A147-I151 PolarHBondContact O-N 3.08Å; V148-I151 PolarHBondContact O-N 3.32Å; I151-K155 HydrophobicContact CG2-CD 4.31Å; I151-K155 WeakPolarHBondContact O-CB 3.39Å; I151-K155 WeakPolarHBondContact O-CG 3.34Å; I151-K155 PolarHBondContact O-N 2.96Å; I151-F188 WeakPolarHBondContact CD1-O 3.41Å; I151-F188 HydrophobicContact CG1-CD2 4.1Å; I151-F188 HydrophobicContact CG1-CE2 4.23Å; I151-E191 HydrophobicContact CD1-CG 4.41Å; I151-E191 HydrophobicContact CG2-CG 3.98Å; I151-L195 HydrophobicContact CB-CD1 4.31Å; I151-L195 HydrophobicContact CG2-CD1 3.76Å
152	Q	83.8	Confident	73.5	Confident	98 Å²	98	90.3 Å²	90.3	46%	0.458	43%	0.427	S	S	.	.	H	α-helix	trans	-66.5	-42.1	179.1	-71.4	177.7	11.4	0	0	112.5	V148 M149 Y150 K155 M156	V148-Q152 WeakPolarHBondContact O-CG 3.31Å; V148-Q152 PolarHBondContact O-N 2.98Å; M149-Q152 PolarHBondContact O-N 2.78Å; Y150-Q152 VanDerWaalsContact C-N 3.33Å; Y150-Q152 PolarHBondContact O-N 3.04Å; Q152-K155 PolarHBondContact O-N 3.46Å; Q152-M156 WeakPolarHBondContact O-CG 3.48Å; Q152-M156 PolarHBondContact O-N 2.77Å; Q152-M156 VanDerWaalsContact O-N 3.13Å
153	E	83.6	Confident	75.6	Confident	38 Å²	38	86.5 Å²	86.5	18%	0.178	41%	0.409	C	S	.	.	H	α-helix	trans	-64	-40.6	177.6	-84.1	-177.7	-146.6	0	0	112.8	K145 M149 Y150 M156 Y158	K145-E153 WeakPolarHBondContact CE-OE1 3.43Å; K145-E153 IonicContact NZ-OE1 3.24Å; K145-E153 PolarHBondContact NZ-OE1 2.97Å; K145-E153 IonicContact NZ-OE2 2.71Å; K145-E153 PolarHBondContact NZ-OE2 3Å; M149-E153 WeakPolarHBondContact O-CB 3.47Å; M149-E153 WeakPolarHBondContact O-CG 3.49Å; M149-E153 PolarHBondContact O-N 3.43Å; Y150-E153 PolarHBondContact O-N 3.45Å; E153-M156 PolarHBondContact O-N 2.81Å; E153-Y158 HydrophobicContact CB-CE2 4.5Å; E153-Y158 WeakPolarHBondContact CB-OH 3.32Å; E153-Y158 WeakPolarHBondContact O-CE2 3.48Å; E153-Y158 PolarHBondContact OE2-OH 3.48Å
154	I	85.1	Confident	77.6	Confident	15 Å²	15	75.6 Å²	75.6	8%	0.077	37%	0.368	C	S	.	.	H	α-helix	trans	-68.3	-39.2	175.2	-64.1	164.6	0	0	0	110.8	Y150 M156 E157 L171 L195 L196	Y150-I154 VanDerWaalsContact O-CG1 3.29Å; Y150-I154 WeakPolarHBondContact O-CG1 3.37Å; Y150-I154 PolarHBondContact O-N 3.45Å; I154-M156 PolarHBondContact O-N 3.16Å; I154-E157 PolarHBondContact O-N 2.74Å; I154-L171 HydrophobicContact CD1-CD2 3.97Å; I154-L195 HydrophobicContact CG2-CB 3.9Å; I154-L195 HydrophobicContact CG2-CD2 4.44Å; I154-L196 HydrophobicContact CD1-CD2 4.29Å
155	K	83.8	Confident	79.2	Confident	113 Å²	113	72.8 Å²	72.8	49%	0.491	35%	0.348	S	S	.	.	H	α-helix	trans	-64.3	-18.3	174.5	-79.3	-177	-179.9	-171.6	0	114.7	I151 Q152 E157 E191 L195	I151-K155 HydrophobicContact CG2-CD 4.31Å; I151-K155 WeakPolarHBondContact O-CB 3.39Å; I151-K155 WeakPolarHBondContact O-CG 3.34Å; I151-K155 PolarHBondContact O-N 2.96Å; Q152-K155 PolarHBondContact O-N 3.46Å; K155-E157 PolarHBondContact O-N 2.78Å; K155-E191 VanDerWaalsContact CE-OE1 3.28Å; K155-E191 WeakPolarHBondContact CE-OE1 3.41Å; K155-E191 IonicContact NZ-OE1 2.79Å; K155-E191 PolarHBondContact NZ-OE1 2.81Å; K155-L195 HydrophobicContact CD-CD1 4.4Å; K155-L195 HydrophobicContact CG-CD1 3.81Å; K155-L195 HydrophobicContact CG-CD2 3.68Å; K155-L195 HydrophobicContact CG-CG 4.42Å
156	M	79.1	Confident	80.2	Confident	159 Å²	159	72.7 Å²	72.7	78%	0.783	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.9	3.9	179.2	-80.6	-173.1	170.7	0	0	114.3	Q152 E153 I154	Q152-M156 WeakPolarHBondContact O-CG 3.48Å; Q152-M156 PolarHBondContact O-N 2.77Å; Q152-M156 VanDerWaalsContact O-N 3.13Å; E153-M156 PolarHBondContact O-N 2.81Å; I154-M156 PolarHBondContact O-N 3.16Å
157	E	64.1	Low	80.8	Confident	157 Å²	157	70 Å²	70	73%	0.734	34%	0.335	S	S	*	.			trans	48.8	75.7	176.2	-67.4	-166.6	160.5	0	0	114	I154 K155 R159	I154-E157 PolarHBondContact O-N 2.74Å; K155-E157 PolarHBondContact O-N 2.78Å; E157-R159 PolarHBondContact O-N 2.59Å
158	Y	65.5	Low	81.3	Confident	53 Å²	53	69.9 Å²	69.9	21%	0.208	33%	0.334	C	S	.	.			trans	-48.9	107.1	173.8	-70.6	-80.1	0	0	0	112.7	E153 D160 Q163 L164 C167	E153-Y158 HydrophobicContact CB-CE2 4.5Å; E153-Y158 WeakPolarHBondContact CB-OH 3.32Å; E153-Y158 WeakPolarHBondContact O-CE2 3.48Å; E153-Y158 PolarHBondContact OE2-OH 3.48Å; Y158-D160 PolarHBondContact O-N 3.16Å; Y158-Q163 HydrophobicContact CD1-CB 3.64Å; Y158-Q163 HydrophobicContact CE1-CB 3.94Å; Y158-L164 HydrophobicContact CD2-CB 4.09Å; Y158-L164 HydrophobicContact CD2-CD1 3.63Å; Y158-L164 HydrophobicContact CD2-CG 4.48Å; Y158-L164 HydrophobicContact CE2-CD1 4.18Å; Y158-L164 HydrophobicContact CG-CB 4.07Å; Y158-L164 HydrophobicContact CG-CD1 4.42Å; Y158-C167 HydrophobicContact CE2-CB 3.95Å; Y158-C167 VanDerWaalsContact OH-CB 3.29Å; Y158-C167 WeakPolarHBondContact OH-CB 3.25Å; Y158-C167 PolarHBondContact OH-SG 3.36Å
159	R	60.7	Low	81.7	Confident	253 Å²	253	70.6 Å²	70.6	96%	0.955	33%	0.333	S	S	*	.	S	Bend	trans	-68.1	-13.4	170.2	-66.7	-168.4	-175.2	-85.1	0.6	113.7	E157	E157-R159 PolarHBondContact O-N 2.59Å
160	D	76.9	Confident	82	Confident	61 Å²	61	69 Å²	69	33%	0.326	33%	0.33	S	S	.	.	S	Bend	trans	-111.9	110.6	177.4	179	-1	0	0	0	110.2	Y158 Q162 Q163 L164	Y158-D160 PolarHBondContact O-N 3.16Å; D160-Q162 PolarHBondContact O-N 3.11Å; D160-Q162 VanDerWaalsContact O-N 3.16Å; D160-Q162 VanDerWaalsContact OD1-CB 3.3Å; D160-Q162 WeakPolarHBondContact OD1-CB 3.31Å; D160-Q162 PolarHBondContact OD1-N 3.14Å; D160-Q163 HydrophobicContact CB-CB 4.23Å; D160-Q163 HydrophobicContact CB-CG 4.05Å; D160-Q163 PolarHBondContact O-N 3.09Å; D160-Q163 VanDerWaalsContact O-N 3.15Å; D160-Q163 WeakPolarHBondContact OD2-CG 3.42Å; D160-Q163 PolarHBondContact OD2-NE2 3.47Å; D160-L164 PolarHBondContact O-N 3.25Å
161	P	77.4	Confident	82.1	Confident	63 Å²	63	69 Å²	69	41%	0.409	33%	0.329	S	S	.	.	H	α-helix	trans	-56.4	-26.4	176.5	-28.4	37.1	0	0	0	114.8	L165 M216	P161-L165 WeakPolarHBondContact O-CB 3.2Å; P161-L165 PolarHBondContact O-N 3.15Å; P161-M216 HydrophobicContact CB-CB 4.33Å; P161-M216 HydrophobicContact CB-CG 3.7Å
162	Q	82.8	Confident	82.3	Confident	88 Å²	88	71.4 Å²	71.4	41%	0.411	34%	0.338	S	S	.	.	H	α-helix	trans	-74.5	-34.3	179.3	-171.8	59.5	73.7	0	0	112	D160 T166	D160-Q162 PolarHBondContact O-N 3.11Å; D160-Q162 VanDerWaalsContact O-N 3.16Å; D160-Q162 VanDerWaalsContact OD1-CB 3.3Å; D160-Q162 WeakPolarHBondContact OD1-CB 3.31Å; D160-Q162 PolarHBondContact OD1-N 3.14Å; Q162-T166 PolarHBondContact O-N 2.82Å; Q162-T166 PolarHBondContact O-OG1 3.06Å
163	Q	84.3	Confident	82.4	Confident	106 Å²	106	69.8 Å²	69.8	50%	0.495	34%	0.335	S	S	.	.	H	α-helix	trans	-70.2	-41.5	172.5	-68.8	170.4	44.8	0	0	111	Y158 D160 L165 T166 C167	Y158-Q163 HydrophobicContact CD1-CB 3.64Å; Y158-Q163 HydrophobicContact CE1-CB 3.94Å; D160-Q163 HydrophobicContact CB-CB 4.23Å; D160-Q163 HydrophobicContact CB-CG 4.05Å; D160-Q163 PolarHBondContact O-N 3.09Å; D160-Q163 VanDerWaalsContact O-N 3.15Å; D160-Q163 WeakPolarHBondContact OD2-CG 3.42Å; D160-Q163 PolarHBondContact OD2-NE2 3.47Å; Q163-L165 PolarHBondContact O-N 3.32Å; Q163-T166 PolarHBondContact O-N 3.43Å; Q163-C167 PolarHBondContact O-N 3.06Å
164	L	87.1	Confident	82.5	Confident	7 Å²	7	68.7 Å²	68.7	4%	0.037	33%	0.331	C	S	.	.	H	α-helix	trans	-57	-50.2	173.5	177.2	63.9	0	0	0	111.6	Y158 D160 T166 C167 L168 L199 C220	Y158-L164 HydrophobicContact CD2-CB 4.09Å; Y158-L164 HydrophobicContact CD2-CD1 3.63Å; Y158-L164 HydrophobicContact CD2-CG 4.48Å; Y158-L164 HydrophobicContact CE2-CD1 4.18Å; Y158-L164 HydrophobicContact CG-CB 4.07Å; Y158-L164 HydrophobicContact CG-CD1 4.42Å; D160-L164 PolarHBondContact O-N 3.25Å; L164-T166 VanDerWaalsContact C-N 3.29Å; L164-T166 PolarHBondContact O-N 2.91Å; L164-C167 WeakPolarHBondContact O-CB 3.42Å; L164-C167 PolarHBondContact O-N 3.34Å; L164-C167 VanDerWaalsContact O-N 3.15Å; L164-L168 HydrophobicContact CD1-CD1 4.13Å; L164-L168 HydrophobicContact CD1-CG 4.28Å; L164-L168 HydrophobicContact CG-CD1 3.9Å; L164-L168 HydrophobicContact CG-CG 4.47Å; L164-L168 WeakPolarHBondContact O-CG 3.48Å; L164-L168 PolarHBondContact O-N 2.97Å; L164-L199 HydrophobicContact CD1-CD2 3.82Å; L164-L199 HydrophobicContact CD2-CD1 3.98Å; L164-L199 HydrophobicContact CD2-CD2 4.25Å; L164-C220 HydrophobicContact CD2-CB 4.31Å
165	L	88.3	Confident	82.4	Confident	11 Å²	11	68.1 Å²	68.1	6%	0.058	33%	0.328	C	S	.	.	H	α-helix	trans	-57.4	-43.2	178	-177.2	60.3	0	0	0	111.7	P161 Q163 C167 L168 E169 M216 K219 E223	P161-L165 WeakPolarHBondContact O-CB 3.2Å; P161-L165 PolarHBondContact O-N 3.15Å; Q163-L165 PolarHBondContact O-N 3.32Å; L165-C167 VanDerWaalsContact C-N 3.32Å; L165-C167 PolarHBondContact O-N 3.48Å; L165-L168 PolarHBondContact O-N 3.48Å; L165-E169 HydrophobicContact CD1-CG 4.44Å; L165-E169 WeakPolarHBondContact O-CG 3.1Å; L165-E169 PolarHBondContact O-N 2.74Å; L165-M216 HydrophobicContact CD2-SD 3.91Å; L165-K219 HydrophobicContact CD1-CB 4.1Å; L165-K219 HydrophobicContact CD2-CB 3.99Å; L165-K219 HydrophobicContact CD2-CD 4.02Å; L165-E223 HydrophobicContact CD1-CB 3.96Å; L165-E223 HydrophobicContact CD1-CG 4.32Å
166	T	87.9	Confident	82.2	Confident	78 Å²	78	66.4 Å²	66.4	48%	0.479	33%	0.325	S	S	.	.	H	α-helix	trans	-64.6	-36.1	179.2	-50.6	0	0	0	0	111.9	Q162 Q163 L164 S170	Q162-T166 PolarHBondContact O-N 2.82Å; Q162-T166 PolarHBondContact O-OG1 3.06Å; Q163-T166 PolarHBondContact O-N 3.43Å; L164-T166 VanDerWaalsContact C-N 3.29Å; L164-T166 PolarHBondContact O-N 2.91Å; T166-S170 WeakPolarHBondContact O-CB 3.47Å; T166-S170 PolarHBondContact O-N 3.45Å
167	C	89.7	Confident	81.8	Confident	5 Å²	5	64.7 Å²	64.7	3%	0.034	32%	0.318	C	S	.	.	H	α-helix	trans	-67.1	-44.7	173.5	-171.5	0	0	0	0	111.9	Y158 Q163 L164 L165 S170 L171	Y158-C167 HydrophobicContact CE2-CB 3.95Å; Y158-C167 VanDerWaalsContact OH-CB 3.29Å; Y158-C167 WeakPolarHBondContact OH-CB 3.25Å; Y158-C167 PolarHBondContact OH-SG 3.36Å; Q163-C167 PolarHBondContact O-N 3.06Å; L164-C167 WeakPolarHBondContact O-CB 3.42Å; L164-C167 PolarHBondContact O-N 3.34Å; L164-C167 VanDerWaalsContact O-N 3.15Å; L165-C167 VanDerWaalsContact C-N 3.32Å; L165-C167 PolarHBondContact O-N 3.48Å; C167-S170 WeakPolarHBondContact O-CB 3.5Å; C167-S170 PolarHBondContact O-N 2.64Å; C167-L171 WeakPolarHBondContact O-CB 3.28Å; C167-L171 PolarHBondContact O-N 3.11Å
168	L	91	Very high	81.6	Confident	1 Å²	1	58.7 Å²	58.7	1%	0.005	29%	0.291	C	S	.	.	H	α-helix	trans	-63.6	-43.4	177.8	-67.3	166	0	0	0	112.4	L164 L165 S170 L171 R172 L196 L199 C220 E223 I224 C227	L164-L168 HydrophobicContact CD1-CD1 4.13Å; L164-L168 HydrophobicContact CD1-CG 4.28Å; L164-L168 HydrophobicContact CG-CD1 3.9Å; L164-L168 HydrophobicContact CG-CG 4.47Å; L164-L168 WeakPolarHBondContact O-CG 3.48Å; L164-L168 PolarHBondContact O-N 2.97Å; L165-L168 PolarHBondContact O-N 3.48Å; L168-S170 VanDerWaalsContact C-N 3.28Å; L168-S170 PolarHBondContact O-N 3.35Å; L168-L171 WeakPolarHBondContact O-CB 3.24Å; L168-L171 PolarHBondContact O-N 3.17Å; L168-R172 PolarHBondContact O-N 3.46Å; L168-L196 HydrophobicContact CD2-CD2 3.76Å; L168-L199 HydrophobicContact CD1-CD2 4.43Å; L168-L199 HydrophobicContact CD2-CD2 4.3Å; L168-C220 HydrophobicContact CD1-CB 4.16Å; L168-E223 HydrophobicContact CB-CB 4.19Å; L168-E223 HydrophobicContact CB-CG 3.77Å; L168-I224 HydrophobicContact CD1-CD1 4.35Å; L168-I224 HydrophobicContact CD1-CG1 3.87Å; L168-I224 HydrophobicContact CD2-CG1 3.78Å; L168-I224 HydrophobicContact CG-CG1 4.47Å; L168-C227 PolarHBondContact O-SG 2.81Å
169	E	90.3	Very high	80.7	Confident	86 Å²	86	60.4 Å²	60.4	40%	0.402	31%	0.309	S	S	.	.	H	α-helix	trans	-60.9	-38.2	175.5	-72.7	-178.7	156	0	0	112.1	L165 V173 E223	L165-E169 HydrophobicContact CD1-CG 4.44Å; L165-E169 WeakPolarHBondContact O-CG 3.1Å; L165-E169 PolarHBondContact O-N 2.74Å; E169-V173 WeakPolarHBondContact O-CG2 3.35Å; E169-V173 PolarHBondContact O-N 3.3Å; E169-E223 HydrophobicContact CG-CG 3.89Å
170	S	88.8	Confident	80.2	Confident	49 Å²	49	51.3 Å²	51.3	34%	0.343	28%	0.282	S	S	.	.	H	α-helix	trans	-70.2	-38.3	175.5	-170	0	0	0	0	112.1	Y150 T166 C167 L168 V173 S174	Y150-S170 PolarHBondContact OH-O 3.19Å; Y150-S170 PolarHBondContact OH-OG 2.87Å; T166-S170 WeakPolarHBondContact O-CB 3.47Å; T166-S170 PolarHBondContact O-N 3.45Å; C167-S170 WeakPolarHBondContact O-CB 3.5Å; C167-S170 PolarHBondContact O-N 2.64Å; L168-S170 VanDerWaalsContact C-N 3.28Å; L168-S170 PolarHBondContact O-N 3.35Å; S170-V173 PolarHBondContact O-N 3.38Å; S170-S174 WeakPolarHBondContact O-CB 3.41Å; S170-S174 PolarHBondContact O-N 3.42Å; S170-S174 PolarHBondContact O-OG 3.38Å
171	L	89.3	Confident	79.2	Confident	0 Å²	0	49 Å²	49	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-64.3	-48.1	175	173.6	57.8	0	0	0	111.6	Y150 I154 C167 L168 V173 S174 L175 W184 F188 L196	Y150-L171 HydrophobicContact CD1-CB 3.96Å; Y150-L171 HydrophobicContact CD1-CD1 4.34Å; Y150-L171 HydrophobicContact CD2-CD1 4.21Å; Y150-L171 HydrophobicContact CE1-CB 3.96Å; Y150-L171 HydrophobicContact CG-CD1 4.03Å; I154-L171 HydrophobicContact CD1-CD2 3.97Å; C167-L171 WeakPolarHBondContact O-CB 3.28Å; C167-L171 PolarHBondContact O-N 3.11Å; L168-L171 WeakPolarHBondContact O-CB 3.24Å; L168-L171 PolarHBondContact O-N 3.17Å; L171-V173 VanDerWaalsContact C-N 3.29Å; L171-V173 PolarHBondContact O-N 2.78Å; L171-S174 CarbonylContact O-C 3.59Å; L171-S174 WeakPolarHBondContact O-CA 3.32Å; L171-S174 WeakPolarHBondContact O-CB 3.36Å; L171-S174 PolarHBondContact O-N 3.44Å; L171-L175 HydrophobicContact CD1-CD1 3.98Å; L171-L175 HydrophobicContact CD1-CG 4.08Å; L171-L175 HydrophobicContact CG-CD1 3.96Å; L171-L175 WeakPolarHBondContact O-CG 3.31Å; L171-L175 PolarHBondContact O-N 3.29Å; L171-W184 HydrophobicContact CD1-CH2 3.56Å; L171-W184 HydrophobicContact CD1-CZ3 3.99Å; L171-F188 HydrophobicContact CD1-CD2 4.25Å; L171-F188 HydrophobicContact CD1-CE2 3.82Å; L171-F188 HydrophobicContact CD1-CZ 4.15Å; L171-F188 HydrophobicContact CD2-CE2 4.07Å; L171-F188 HydrophobicContact CD2-CZ 3.84Å; L171-L196 HydrophobicContact CD2-CD1 4.4Å; L171-L196 HydrophobicContact CD2-CD2 3.96Å
172	R	89.4	Confident	78.4	Confident	59 Å²	59	47.7 Å²	47.7	22%	0.223	26%	0.26	C	S	.	.	H	α-helix	trans	-53.7	-45.9	174.3	-179.1	-155.6	56.7	-142.3	-8.2	111.5	L168 S174 L175 N176 E223 R226	L168-R172 PolarHBondContact O-N 3.46Å; R172-S174 VanDerWaalsContact C-N 3.31Å; R172-S174 PolarHBondContact O-N 2.83Å; R172-L175 PolarHBondContact O-N 2.78Å; R172-N176 PolarHBondContact O-N 3.42Å; R172-N176 VanDerWaalsContact O-N 3.11Å; R172-E223 WeakPolarHBondContact CB-OE1 3.19Å; R172-E223 WeakPolarHBondContact CD-OE1 3.38Å; R172-E223 IonicContact CZ-OE1 2.74Å; R172-E223 IonicContact CZ-OE2 2.81Å; R172-E223 IonicContact NE-OE1 3.99Å; R172-E223 PolarHBondContact NE-OE1 2.74Å; R172-E223 IonicContact NH1-OE1 3.3Å; R172-E223 PolarHBondContact NH1-OE1 3.23Å; R172-E223 IonicContact NH1-OE2 3.88Å; R172-E223 PolarHBondContact NH1-OE2 3.44Å; R172-E223 IonicContact NH2-OE1 2.64Å; R172-R226 HydrophobicContact CG-CB 4.19Å
173	V	85.9	Confident	77.6	Confident	64 Å²	64	45.7 Å²	45.7	39%	0.388	26%	0.255	S	S	.	.	H	α-helix	trans	-65	-36.5	177.4	172.5	0	0	0	0	111.4	E169 S170 L171 N176 N177	E169-V173 WeakPolarHBondContact O-CG2 3.35Å; E169-V173 PolarHBondContact O-N 3.3Å; S170-V173 PolarHBondContact O-N 3.38Å; L171-V173 VanDerWaalsContact C-N 3.29Å; L171-V173 PolarHBondContact O-N 2.78Å; V173-N176 PolarHBondContact O-N 3.29Å; V173-N177 WeakPolarHBondContact O-CB 3.28Å; V173-N177 PolarHBondContact O-N 2.91Å
174	S	84.4	Confident	77.3	Confident	14 Å²	14	41.9 Å²	41.9	10%	0.098	24%	0.236	C	C	.	.	H	α-helix	trans	-70.3	-34	177.3	-55.4	0	0	0	0	112.9	Y150 S170 L171 R172 N178	Y150-S174 WeakPolarHBondContact CE2-OG 3.39Å; Y150-S174 PolarHBondContact OH-OG 2.79Å; S170-S174 WeakPolarHBondContact O-CB 3.41Å; S170-S174 PolarHBondContact O-N 3.42Å; S170-S174 PolarHBondContact O-OG 3.38Å; L171-S174 CarbonylContact O-C 3.59Å; L171-S174 WeakPolarHBondContact O-CA 3.32Å; L171-S174 WeakPolarHBondContact O-CB 3.36Å; L171-S174 PolarHBondContact O-N 3.44Å; R172-S174 VanDerWaalsContact C-N 3.31Å; R172-S174 PolarHBondContact O-N 2.83Å; S174-N178 PolarHBondContact O-ND2 3.46Å
175	L	83.6	Confident	76.9	Confident	3 Å²	3	41.5 Å²	41.5	2%	0.016	24%	0.235	C	C	.	.	H	α-helix	trans	-69.3	-37.4	174.2	-72.4	161.9	0	0	0	112.1	L171 R172 W184 V185 C227 A230 F231	L171-L175 HydrophobicContact CD1-CD1 3.98Å; L171-L175 HydrophobicContact CD1-CG 4.08Å; L171-L175 HydrophobicContact CG-CD1 3.96Å; L171-L175 WeakPolarHBondContact O-CG 3.31Å; L171-L175 PolarHBondContact O-N 3.29Å; R172-L175 PolarHBondContact O-N 2.78Å; L175-W184 HydrophobicContact CD2-CE3 3.98Å; L175-W184 HydrophobicContact CD2-CZ3 3.6Å; L175-W184 HydrophobicContact CG-CZ3 3.94Å; L175-V185 HydrophobicContact CD2-CG2 3.79Å; L175-C227 HydrophobicContact CD1-CB 3.95Å; L175-A230 HydrophobicContact CB-CB 3.54Å; L175-A230 HydrophobicContact CD1-CB 4.21Å; L175-A230 HydrophobicContact CG-CB 4.48Å; L175-F231 HydrophobicContact CD2-CB 4.37Å; L175-F231 HydrophobicContact CD2-CD2 4.29Å
176	N	78.9	Confident	76.5	Confident	78 Å²	78	44.9 Å²	44.9	42%	0.417	25%	0.25	S	S	.	.	H	α-helix	trans	-81.4	-42.6	-178.7	-78.7	-12.5	0	0	0	114.6	R172 V173 A230	R172-N176 PolarHBondContact O-N 3.42Å; R172-N176 VanDerWaalsContact O-N 3.11Å; V173-N176 PolarHBondContact O-N 3.29Å; N176-A230 WeakPolarHBondContact OD1-CB 3.12Å
177	N	71	Confident	76.3	Confident	122 Å²	122	46.1 Å²	46.1	65%	0.652	25%	0.254	S	S	*	.	H	α-helix	trans	-106.6	-3.9	-159	-67.3	0.2	0	0	0	115.6	V173	V173-N177 WeakPolarHBondContact O-CB 3.28Å; V173-N177 PolarHBondContact O-N 2.91Å
178	N	60.2	Low	76.1	Confident	31 Å²	31	45.9 Å²	45.9	17%	0.166	25%	0.252	C	S	.	.			trans	-79	131	179.9	-81.6	-56.9	0	0	0	110.9	S174 V180 S181	S174-N178 PolarHBondContact O-ND2 3.46Å; N178-V180 PolarHBondContact O-N 3.28Å; N178-S181 PolarHBondContact O-N 2.97Å; N178-S181 VanDerWaalsContact O-N 3.14Å
179	P	45.9	Very low	75.8	Confident	90 Å²	90	46.2 Å²	46.2	58%	0.584	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	33.5	177.3	35.7	-38.9	0	0	0	112.4
180	V	51	Low	75.7	Confident	61 Å²	61	46 Å²	46	37%	0.37	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-146.8	24.6	179.4	-150.5	0	0	0	0	108.4	N178 L182 S183 W184	N178-V180 PolarHBondContact O-N 3.28Å; V180-L182 PolarHBondContact O-N 2.98Å; V180-L182 VanDerWaalsContact O-N 3.11Å; V180-S183 VanDerWaalsContact CG1-OG 3.25Å; V180-S183 WeakPolarHBondContact CG1-OG 3.44Å; V180-S183 PolarHBondContact O-N 2.98Å; V180-S183 VanDerWaalsContact O-N 3.09Å; V180-W184 WeakPolarHBondContact O-CB 3.37Å; V180-W184 PolarHBondContact O-N 3.36Å
181	S	56.8	Low	75.7	Confident	14 Å²	14	48.4 Å²	48.4	10%	0.098	26%	0.263	C	S	.	.	H	α-helix	trans	-51.1	-44.4	-166.7	68.8	0	0	0	0	111.7	N178 W184 V185 N234	N178-S181 PolarHBondContact O-N 2.97Å; N178-S181 VanDerWaalsContact O-N 3.14Å; S181-W184 PolarHBondContact O-N 2.9Å; S181-V185 WeakPolarHBondContact O-CB 3.45Å; S181-V185 WeakPolarHBondContact O-CG2 3.49Å; S181-V185 PolarHBondContact O-N 3.13Å; S181-N234 PolarHBondContact OG-OD1 3.22Å
182	L	59.3	Low	75.8	Confident	35 Å²	35	48.4 Å²	48.4	18%	0.183	26%	0.263	C	S	.	.	H	α-helix	trans	-49.3	-62.5	174.7	-173.3	78	0	0	0	112.8	V180 V185 Q186 D1140	V180-L182 PolarHBondContact O-N 2.98Å; V180-L182 VanDerWaalsContact O-N 3.11Å; L182-V185 PolarHBondContact O-N 3Å; L182-Q186 VanDerWaalsContact O-CG 3.26Å; L182-Q186 WeakPolarHBondContact O-CG 3.35Å; L182-Q186 PolarHBondContact O-N 3.12Å; L182-D1140 HydrophobicContact CD1-CB 3.98Å; L182-D1140 HydrophobicContact CD2-CB 3.69Å; L182-D1140 HydrophobicContact CG-CB 4.49Å
183	S	65.9	Low	75.9	Confident	45 Å²	45	45.6 Å²	45.6	32%	0.315	25%	0.252	S	S	.	.	H	α-helix	trans	-77.1	-24.7	-177.2	92.7	0	0	0	0	112.7	V180 N187	V180-S183 VanDerWaalsContact CG1-OG 3.25Å; V180-S183 WeakPolarHBondContact CG1-OG 3.44Å; V180-S183 PolarHBondContact O-N 2.98Å; V180-S183 VanDerWaalsContact O-N 3.09Å; S183-N187 VanDerWaalsContact O-CB 3.25Å; S183-N187 WeakPolarHBondContact O-CB 3.36Å; S183-N187 PolarHBondContact O-N 2.93Å; S183-N187 PolarHBondContact O-ND2 3.34Å
184	W	78.7	Confident	76.2	Confident	26 Å²	26	47.6 Å²	47.6	10%	0.098	26%	0.259	C	S	.	.	H	α-helix	trans	-66.8	-42.6	172.5	-162.6	104.6	0	0	0	110.8	A147 Y150 L171 L175 V180 S181 N187 F188	A147-W184 HydrophobicContact CB-CD2 4.09Å; A147-W184 HydrophobicContact CB-CE3 4.23Å; A147-W184 HydrophobicContact CB-CH2 4.1Å; A147-W184 HydrophobicContact CB-CZ2 4Å; A147-W184 HydrophobicContact CB-CZ3 4.22Å; Y150-W184 AromaticContact CD2-CH2 3.71Å; Y150-W184 HydrophobicContact CD2-CH2 3.71Å; Y150-W184 AromaticContact CD2-CZ2 3.62Å; Y150-W184 HydrophobicContact CD2-CZ2 3.62Å; Y150-W184 HydrophobicContact CE2-CH2 4.04Å; Y150-W184 AromaticContact CE2-CZ2 3.71Å; Y150-W184 HydrophobicContact CE2-CZ2 3.71Å; L171-W184 HydrophobicContact CD1-CH2 3.56Å; L171-W184 HydrophobicContact CD1-CZ3 3.99Å; L175-W184 HydrophobicContact CD2-CE3 3.98Å; L175-W184 HydrophobicContact CD2-CZ3 3.6Å; L175-W184 HydrophobicContact CG-CZ3 3.94Å; V180-W184 WeakPolarHBondContact O-CB 3.37Å; V180-W184 PolarHBondContact O-N 3.36Å; S181-W184 PolarHBondContact O-N 2.9Å; W184-N187 CarbonylContact O-C 3.59Å; W184-N187 PolarHBondContact O-N 2.85Å; W184-F188 HydrophobicContact CE3-CB 4.25Å; W184-F188 HydrophobicContact CH2-CD2 4.33Å; W184-F188 HydrophobicContact CZ3-CB 3.94Å; W184-F188 HydrophobicContact CZ3-CD2 4.16Å; W184-F188 HydrophobicContact CZ3-CG 4.13Å; W184-F188 PolarHBondContact O-N 3.17Å
185	V	78.8	Confident	76.5	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-69.6	-38.1	176.1	166.6	0	0	0	0	111.1	L175 S181 L182 F188 G189 F231 Y236	L175-V185 HydrophobicContact CD2-CG2 3.79Å; S181-V185 WeakPolarHBondContact O-CB 3.45Å; S181-V185 WeakPolarHBondContact O-CG2 3.49Å; S181-V185 PolarHBondContact O-N 3.13Å; L182-V185 PolarHBondContact O-N 3Å; V185-F188 PolarHBondContact O-N 3.24Å; V185-G189 PolarHBondContact O-N 3.24Å; V185-F231 HydrophobicContact CG1-CD2 3.69Å; V185-F231 HydrophobicContact CG1-CE2 3.72Å; V185-F231 HydrophobicContact CG1-CG 4.44Å; V185-F231 HydrophobicContact CG1-CZ 4.5Å; V185-Y236 HydrophobicContact CG1-CD1 4.02Å
186	Q	79.6	Confident	77	Confident	82 Å²	82	48.2 Å²	48.2	38%	0.383	26%	0.261	S	S	.	.	H	α-helix	trans	-65	-39	169.8	-70.7	164.5	-8.9	0	0	112.5	L182 F188 G189 Y236	L182-Q186 VanDerWaalsContact O-CG 3.26Å; L182-Q186 WeakPolarHBondContact O-CG 3.35Å; L182-Q186 PolarHBondContact O-N 3.12Å; Q186-F188 VanDerWaalsContact C-N 3.31Å; Q186-G189 VanDerWaalsContact O-CA 3.31Å; Q186-G189 WeakPolarHBondContact O-CA 3.42Å; Q186-G189 PolarHBondContact O-N 2.95Å; Q186-Y236 HydrophobicContact CG-CD1 4.17Å; Q186-Y236 HydrophobicContact CG-CD2 4.28Å; Q186-Y236 HydrophobicContact CG-CG 4Å
187	N	83.3	Confident	77.7	Confident	103 Å²	103	44.7 Å²	44.7	55%	0.551	24%	0.242	S	C	*	.	H	α-helix	trans	-74.5	-17.9	175.2	-80	-68.1	0	0	0	113.6	A147 S183 W184	A147-N187 HydrophobicContact CB-CB 4.06Å; S183-N187 VanDerWaalsContact O-CB 3.25Å; S183-N187 WeakPolarHBondContact O-CB 3.36Å; S183-N187 PolarHBondContact O-N 2.93Å; S183-N187 PolarHBondContact O-ND2 3.34Å; W184-N187 CarbonylContact O-C 3.59Å; W184-N187 PolarHBondContact O-N 2.85Å
188	F	86.4	Confident	78.7	Confident	1 Å²	1	42 Å²	42	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-80.2	-43.8	166.2	-172	-106.5	0	0	0	109.8	A147 I151 L171 W184 V185 Q186 G192 L196 F231	A147-F188 HydrophobicContact CB-CB 3.94Å; A147-F188 HydrophobicContact CB-CD2 4.43Å; I151-F188 WeakPolarHBondContact CD1-O 3.41Å; I151-F188 HydrophobicContact CG1-CD2 4.1Å; I151-F188 HydrophobicContact CG1-CE2 4.23Å; L171-F188 HydrophobicContact CD1-CD2 4.25Å; L171-F188 HydrophobicContact CD1-CE2 3.82Å; L171-F188 HydrophobicContact CD1-CZ 4.15Å; L171-F188 HydrophobicContact CD2-CE2 4.07Å; L171-F188 HydrophobicContact CD2-CZ 3.84Å; W184-F188 HydrophobicContact CE3-CB 4.25Å; W184-F188 HydrophobicContact CH2-CD2 4.33Å; W184-F188 HydrophobicContact CZ3-CB 3.94Å; W184-F188 HydrophobicContact CZ3-CD2 4.16Å; W184-F188 HydrophobicContact CZ3-CG 4.13Å; W184-F188 PolarHBondContact O-N 3.17Å; V185-F188 PolarHBondContact O-N 3.24Å; Q186-F188 VanDerWaalsContact C-N 3.31Å; F188-G192 VanDerWaalsContact CE1-CA 3.49Å; F188-G192 WeakPolarHBondContact CE1-O 3.06Å; F188-G192 VanDerWaalsContact CZ-CA 3.48Å; F188-G192 WeakPolarHBondContact CZ-O 3.32Å; F188-G192 WeakPolarHBondContact O-CA 3.32Å; F188-G192 PolarHBondContact O-N 2.9Å; F188-L196 HydrophobicContact CE1-CD1 3.75Å; F188-L196 HydrophobicContact CE1-CG 4.3Å; F188-L196 HydrophobicContact CZ-CD1 3.89Å; F188-L196 HydrophobicContact CZ-CG 4.08Å; F188-F231 AromaticContact CD1-CD2 3.95Å; F188-F231 HydrophobicContact CD1-CD2 3.95Å; F188-F231 AromaticContact CD1-CE2 3.93Å; F188-F231 HydrophobicContact CD1-CE2 3.93Å
189	G	85.6	Confident	80.2	Confident	7 Å²	7	41.2 Å²	41.2	7%	0.072	23%	0.229	C	C	.	.	H	α-helix	trans	66	-171.2	160.4	0	0	0	0	0	115.6	V185 Q186 E191 G192 L193 Y236	V185-G189 PolarHBondContact O-N 3.24Å; Q186-G189 VanDerWaalsContact O-CA 3.31Å; Q186-G189 WeakPolarHBondContact O-CA 3.42Å; Q186-G189 PolarHBondContact O-N 2.95Å; G189-E191 PolarHBondContact O-N 2.88Å; G189-G192 PolarHBondContact O-N 3.27Å; G189-L193 PolarHBondContact O-N 2.88Å; G189-Y236 VanDerWaalsContact CA-OH 3.29Å; G189-Y236 WeakPolarHBondContact CA-OH 3.48Å
190	D	87	Confident	82.4	Confident	82 Å²	82	37 Å²	37	44%	0.439	20%	0.201	S	C	.	.	H	α-helix	trans	-61.1	-29.3	172.5	-50.8	-68.2	0	0	0	111.5	M194 Y236 S240	D190-M194 VanDerWaalsContact O-CB 3.29Å; D190-M194 WeakPolarHBondContact O-CB 3.44Å; D190-M194 WeakPolarHBondContact O-CG 3.48Å; D190-M194 PolarHBondContact O-N 2.77Å; D190-Y236 PolarHBondContact N-OH 3.31Å; D190-Y236 VanDerWaalsContact N-OH 3.1Å; D190-Y236 PolarHBondContact OD1-OH 2.71Å; D190-Y236 PolarHBondContact OD2-OH 3.27Å; D190-S240 WeakPolarHBondContact OD1-CB 3.43Å; D190-S240 PolarHBondContact OD1-OG 3.29Å
191	E	89.8	Confident	84.4	Confident	100 Å²	100	37.8 Å²	37.8	47%	0.467	20%	0.2	S	C	.	.	H	α-helix	trans	-64.8	-49.8	175.8	-178.3	173.4	-160.3	0	0	112.3	I151 K155 G189 M194 L195	I151-E191 HydrophobicContact CD1-CG 4.41Å; I151-E191 HydrophobicContact CG2-CG 3.98Å; K155-E191 VanDerWaalsContact CE-OE1 3.28Å; K155-E191 WeakPolarHBondContact CE-OE1 3.41Å; K155-E191 IonicContact NZ-OE1 2.79Å; K155-E191 PolarHBondContact NZ-OE1 2.81Å; G189-E191 PolarHBondContact O-N 2.88Å; E191-M194 PolarHBondContact O-N 3.3Å; E191-L195 VanDerWaalsContact O-CG 3.31Å; E191-L195 WeakPolarHBondContact O-CG 3.43Å; E191-L195 PolarHBondContact O-N 2.72Å; E191-L195 VanDerWaalsContact O-N 3.1Å
192	G	90.2	Very high	86	Confident	0 Å²	0	42 Å²	42	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-66.4	-38.2	175.9	0	0	0	0	0	112.5	F188 G189 L195 L196	F188-G192 VanDerWaalsContact CE1-CA 3.49Å; F188-G192 WeakPolarHBondContact CE1-O 3.06Å; F188-G192 VanDerWaalsContact CZ-CA 3.48Å; F188-G192 WeakPolarHBondContact CZ-O 3.32Å; F188-G192 WeakPolarHBondContact O-CA 3.32Å; F188-G192 PolarHBondContact O-N 2.9Å; G189-G192 PolarHBondContact O-N 3.27Å; G192-L195 PolarHBondContact O-N 3Å; G192-L196 WeakPolarHBondContact O-CG 3.44Å; G192-L196 PolarHBondContact O-N 2.65Å
193	L	92.4	Very high	87.4	Confident	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.209	C	C	.	.	H	α-helix	trans	-60.1	-50.4	172.9	175.4	65.4	0	0	0	111.7	G189 L195 L196 L197 L228 F231 S240 M241	G189-L193 PolarHBondContact O-N 2.88Å; L193-L195 PolarHBondContact O-N 3.02Å; L193-L196 PolarHBondContact O-N 3.17Å; L193-L196 VanDerWaalsContact O-N 3.08Å; L193-L197 HydrophobicContact CD1-CD1 3.88Å; L193-L197 HydrophobicContact CD1-CG 4.05Å; L193-L197 HydrophobicContact CD2-CD1 4.47Å; L193-L197 HydrophobicContact CG-CD1 3.89Å; L193-L197 HydrophobicContact CG-CG 4.39Å; L193-L197 WeakPolarHBondContact O-CG 3.01Å; L193-L197 PolarHBondContact O-N 3.28Å; L193-L228 HydrophobicContact CD1-CD2 3.54Å; L193-F231 HydrophobicContact CB-CE1 4.18Å; L193-F231 HydrophobicContact CB-CZ 4Å; L193-F231 HydrophobicContact CD1-CD1 4.21Å; L193-F231 HydrophobicContact CD1-CE1 3.95Å; L193-F231 HydrophobicContact CD2-CE1 3.97Å; L193-F231 HydrophobicContact CD2-CZ 4.35Å; L193-F231 HydrophobicContact CG-CE1 4.25Å; L193-S240 VanDerWaalsContact CD2-C 3.47Å; L193-S240 WeakPolarHBondContact CD2-O 3.09Å; L193-M241 HydrophobicContact CD1-SD 3.95Å
194	M	91.3	Very high	88.6	Confident	105 Å²	105	40.7 Å²	40.7	52%	0.517	20%	0.202	S	C	.	.	H	α-helix	trans	-61.9	-32.4	179.1	-77.4	-67.7	-72.3	0	0	112.4	D190 E191 S198 T244	D190-M194 VanDerWaalsContact O-CB 3.29Å; D190-M194 WeakPolarHBondContact O-CB 3.44Å; D190-M194 WeakPolarHBondContact O-CG 3.48Å; D190-M194 PolarHBondContact O-N 2.77Å; E191-M194 PolarHBondContact O-N 3.3Å; M194-S198 VanDerWaalsContact O-CB 3.28Å; M194-S198 WeakPolarHBondContact O-CB 3.47Å; M194-S198 PolarHBondContact O-N 3.28Å; M194-S198 PolarHBondContact O-OG 3.3Å; M194-T244 HydrophobicContact SD-CG2 3.82Å
195	L	92	Very high	89	Confident	30 Å²	30	43.4 Å²	43.4	16%	0.157	22%	0.218	C	C	.	.	H	α-helix	trans	-68.3	-41.4	172	-71.8	167.6	0	0	0	112.5	I151 I154 K155 E191 G192 L193 S198 L199	I151-L195 HydrophobicContact CB-CD1 4.31Å; I151-L195 HydrophobicContact CG2-CD1 3.76Å; I154-L195 HydrophobicContact CG2-CB 3.9Å; I154-L195 HydrophobicContact CG2-CD2 4.44Å; K155-L195 HydrophobicContact CD-CD1 4.4Å; K155-L195 HydrophobicContact CG-CD1 3.81Å; K155-L195 HydrophobicContact CG-CD2 3.68Å; K155-L195 HydrophobicContact CG-CG 4.42Å; E191-L195 VanDerWaalsContact O-CG 3.31Å; E191-L195 WeakPolarHBondContact O-CG 3.43Å; E191-L195 PolarHBondContact O-N 2.72Å; E191-L195 VanDerWaalsContact O-N 3.1Å; G192-L195 PolarHBondContact O-N 3Å; L193-L195 PolarHBondContact O-N 3.02Å; L195-S198 PolarHBondContact O-OG 3.17Å; L195-L199 WeakPolarHBondContact O-CB 3.29Å; L195-L199 PolarHBondContact O-N 2.95Å
196	L	93.2	Very high	89.2	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-64.7	-42.7	174	-72.1	178.7	0	0	0	112.4	I154 L168 L171 F188 G192 L193 L200 I224 C227 L228	I154-L196 HydrophobicContact CD1-CD2 4.29Å; L168-L196 HydrophobicContact CD2-CD2 3.76Å; L171-L196 HydrophobicContact CD2-CD1 4.4Å; L171-L196 HydrophobicContact CD2-CD2 3.96Å; F188-L196 HydrophobicContact CE1-CD1 3.75Å; F188-L196 HydrophobicContact CE1-CG 4.3Å; F188-L196 HydrophobicContact CZ-CD1 3.89Å; F188-L196 HydrophobicContact CZ-CG 4.08Å; G192-L196 WeakPolarHBondContact O-CG 3.44Å; G192-L196 PolarHBondContact O-N 2.65Å; L193-L196 PolarHBondContact O-N 3.17Å; L193-L196 VanDerWaalsContact O-N 3.08Å; L196-L200 WeakPolarHBondContact O-CB 3.45Å; L196-L200 PolarHBondContact O-N 3.37Å; L196-I224 HydrophobicContact CB-CG2 4.06Å; L196-I224 HydrophobicContact CD2-CG1 4.35Å; L196-I224 HydrophobicContact CD2-CG2 4.27Å; L196-C227 HydrophobicContact CD1-CB 3.82Å; L196-C227 HydrophobicContact CD2-CB 4.46Å; L196-L228 HydrophobicContact CB-CD2 4.46Å; L196-L228 HydrophobicContact CD1-CD2 4.45Å
197	L	93.8	Very high	88.6	Confident	4 Å²	4	52.8 Å²	52.8	2%	0.021	26%	0.259	C	S	.	.	H	α-helix	trans	-70.8	-43.4	-179.2	-67	176.7	0	0	0	112.2	L193 L199 L200 K201 L228 M241 T244 L250	L193-L197 HydrophobicContact CD1-CD1 3.88Å; L193-L197 HydrophobicContact CD1-CG 4.05Å; L193-L197 HydrophobicContact CD2-CD1 4.47Å; L193-L197 HydrophobicContact CG-CD1 3.89Å; L193-L197 HydrophobicContact CG-CG 4.39Å; L193-L197 WeakPolarHBondContact O-CG 3.01Å; L193-L197 PolarHBondContact O-N 3.28Å; L197-L199 VanDerWaalsContact C-N 3.33Å; L197-L199 PolarHBondContact O-N 3.25Å; L197-L200 PolarHBondContact O-N 3.49Å; L197-K201 WeakPolarHBondContact O-CB 3.38Å; L197-K201 PolarHBondContact O-N 3.19Å; L197-L228 HydrophobicContact CD2-CD1 3.91Å; L197-L228 HydrophobicContact CD2-CD2 4.09Å; L197-M241 HydrophobicContact CD1-SD 4.19Å; L197-M241 HydrophobicContact CD2-CE 4.13Å; L197-M241 HydrophobicContact CD2-SD 4.17Å; L197-T244 HydrophobicContact CD1-CG2 3.63Å; L197-L250 HydrophobicContact CB-CD1 3.88Å; L197-L250 HydrophobicContact CD2-CD1 4.01Å; L197-L250 WeakPolarHBondContact O-CD1 3.29Å
198	S	91.9	Very high	87.9	Confident	67 Å²	67	51.3 Å²	51.3	47%	0.469	25%	0.251	S	S	.	.	H	α-helix	trans	-65	-36.4	174.6	56	0	0	0	0	112.5	M194 L195 R202	M194-S198 VanDerWaalsContact O-CB 3.28Å; M194-S198 WeakPolarHBondContact O-CB 3.47Å; M194-S198 PolarHBondContact O-N 3.28Å; M194-S198 PolarHBondContact O-OG 3.3Å; L195-S198 PolarHBondContact O-OG 3.17Å; S198-R202 WeakPolarHBondContact O-CB 3.39Å; S198-R202 PolarHBondContact O-N 2.96Å
199	L	91.3	Very high	87	Confident	14 Å²	14	60.1 Å²	60.1	7%	0.073	29%	0.292	C	S	.	.	H	α-helix	trans	-64.4	-45.2	171.8	179.5	66.5	0	0	0	112.1	L164 L168 L195 L197 R202 L203 I224	L164-L199 HydrophobicContact CD1-CD2 3.82Å; L164-L199 HydrophobicContact CD2-CD1 3.98Å; L164-L199 HydrophobicContact CD2-CD2 4.25Å; L168-L199 HydrophobicContact CD1-CD2 4.43Å; L168-L199 HydrophobicContact CD2-CD2 4.3Å; L195-L199 WeakPolarHBondContact O-CB 3.29Å; L195-L199 PolarHBondContact O-N 2.95Å; L197-L199 VanDerWaalsContact C-N 3.33Å; L197-L199 PolarHBondContact O-N 3.25Å; L199-R202 PolarHBondContact O-N 2.91Å; L199-L203 HydrophobicContact CD1-CD1 4.22Å; L199-L203 HydrophobicContact CD1-CG 4.44Å; L199-L203 HydrophobicContact CG-CD1 4.04Å; L199-L203 WeakPolarHBondContact O-CB 3.39Å; L199-L203 VanDerWaalsContact O-CG 3.29Å; L199-L203 WeakPolarHBondContact O-CG 3.45Å; L199-L203 PolarHBondContact O-N 3.42Å; L199-I224 HydrophobicContact CB-CD1 4.31Å; L199-I224 HydrophobicContact CD2-CD1 3.63Å; L199-I224 HydrophobicContact CD2-CG1 4.19Å; L199-I224 HydrophobicContact CG-CD1 3.72Å
200	L	93.4	Very high	86.6	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-61.4	-44.6	176.6	179.9	58.8	0	0	0	111.2	L196 L197 L203 Q204 Q221 I224 I225 L228 L250	L196-L200 WeakPolarHBondContact O-CB 3.45Å; L196-L200 PolarHBondContact O-N 3.37Å; L197-L200 PolarHBondContact O-N 3.49Å; L200-L203 PolarHBondContact O-N 2.88Å; L200-Q204 HydrophobicContact CD1-CG 4.23Å; L200-Q204 WeakPolarHBondContact O-CB 3.43Å; L200-Q204 VanDerWaalsContact O-CG 3.29Å; L200-Q204 WeakPolarHBondContact O-CG 3.45Å; L200-Q204 PolarHBondContact O-N 2.98Å; L200-Q221 HydrophobicContact CD1-CB 3.99Å; L200-Q221 HydrophobicContact CD1-CG 4.01Å; L200-I224 HydrophobicContact CB-CD1 4.21Å; L200-I224 HydrophobicContact CB-CG2 4.06Å; L200-I224 HydrophobicContact CD2-CG2 4.3Å; L200-I225 HydrophobicContact CD2-CD1 3.9Å; L200-L228 HydrophobicContact CD2-CD1 4.18Å; L200-L250 HydrophobicContact CD2-CB 3.88Å; L200-L250 HydrophobicContact CG-CB 4.37Å
201	K	92.9	Very high	86	Confident	79 Å²	79	64.3 Å²	64.3	34%	0.343	32%	0.32	S	S	.	.	H	α-helix	trans	-57.6	-52	175.6	-170.2	167.8	-173.4	171.4	0	111.6	L197 L203 Q204 D205 D246 L250	L197-K201 WeakPolarHBondContact O-CB 3.38Å; L197-K201 PolarHBondContact O-N 3.19Å; K201-L203 PolarHBondContact O-N 3.15Å; K201-Q204 PolarHBondContact O-N 3.35Å; K201-Q204 VanDerWaalsContact O-N 3.1Å; K201-D205 PolarHBondContact O-N 2.75Å; K201-D246 IonicContact NZ-OD2 2.99Å; K201-D246 PolarHBondContact NZ-OD2 3.24Å; K201-L250 HydrophobicContact CB-CD1 4.16Å; K201-L250 HydrophobicContact CB-CD2 3.65Å; K201-L250 HydrophobicContact CD-CD2 4.43Å; K201-L250 HydrophobicContact CG-CD2 3.93Å
202	R	89.9	Confident	85.3	Confident	102 Å²	102	66.9 Å²	66.9	39%	0.385	33%	0.332	S	S	.	.	H	α-helix	trans	-55.5	-49.6	175.7	-178	177.5	64.2	73.7	-2.9	111.6	S198 L199 Q204 D205 E206	S198-R202 WeakPolarHBondContact O-CB 3.39Å; S198-R202 PolarHBondContact O-N 2.96Å; L199-R202 PolarHBondContact O-N 2.91Å; R202-Q204 PolarHBondContact O-N 3.25Å; R202-D205 PolarHBondContact O-N 2.71Å; R202-E206 WeakPolarHBondContact CD-OE1 3.41Å; R202-E206 HydrophobicContact CG-CG 4.35Å; R202-E206 WeakPolarHBondContact CG-OE1 3.48Å; R202-E206 IonicContact CZ-OE1 3.41Å; R202-E206 IonicContact NE-OE1 3.04Å; R202-E206 IonicContact NH1-OE1 2.71Å; R202-E206 PolarHBondContact NH1-OE1 3.46Å; R202-E206 IonicContact NH1-OE2 2.65Å; R202-E206 PolarHBondContact NH1-OE2 3.41Å; R202-E206 WeakPolarHBondContact O-CB 3.45Å; R202-E206 VanDerWaalsContact O-CG 3.24Å; R202-E206 WeakPolarHBondContact O-CG 3.37Å; R202-E206 PolarHBondContact O-N 3.32Å
203	L	89.1	Confident	84.7	Confident	16 Å²	16	68.4 Å²	68.4	8%	0.084	34%	0.344	C	S	.	.	H	α-helix	trans	-65.5	-23.9	179.7	-71	169.9	0	0	0	113.6	L199 L200 K201 C220 Q221 I224	L199-L203 HydrophobicContact CD1-CD1 4.22Å; L199-L203 HydrophobicContact CD1-CG 4.44Å; L199-L203 HydrophobicContact CG-CD1 4.04Å; L199-L203 WeakPolarHBondContact O-CB 3.39Å; L199-L203 VanDerWaalsContact O-CG 3.29Å; L199-L203 WeakPolarHBondContact O-CG 3.45Å; L199-L203 PolarHBondContact O-N 3.42Å; L200-L203 PolarHBondContact O-N 2.88Å; K201-L203 PolarHBondContact O-N 3.15Å; L203-C220 HydrophobicContact CD1-CB 3.68Å; L203-Q221 HydrophobicContact CB-CG 3.81Å; L203-Q221 HydrophobicContact CD1-CG 4.46Å; L203-Q221 PolarHBondContact O-NE2 3.4Å; L203-I224 HydrophobicContact CD1-CD1 3.75Å
204	Q	90.4	Very high	84.1	Confident	36 Å²	36	73.3 Å²	73.3	17%	0.168	36%	0.363	C	S	.	.	H	α-helix	trans	-83.7	-38.1	176	-76.4	174.7	-9.6	0	0	112.3	L200 K201 R202 E206 L250 R253	L200-Q204 HydrophobicContact CD1-CG 4.23Å; L200-Q204 WeakPolarHBondContact O-CB 3.43Å; L200-Q204 VanDerWaalsContact O-CG 3.29Å; L200-Q204 WeakPolarHBondContact O-CG 3.45Å; L200-Q204 PolarHBondContact O-N 2.98Å; K201-Q204 PolarHBondContact O-N 3.35Å; K201-Q204 VanDerWaalsContact O-N 3.1Å; R202-Q204 PolarHBondContact O-N 3.25Å; Q204-E206 VanDerWaalsContact C-N 3.34Å; Q204-L250 PolarHBondContact NE2-O 3.12Å; Q204-R253 VanDerWaalsContact OE1-CB 3.22Å; Q204-R253 VanDerWaalsContact OE1-CD 3.27Å
205	D	87.1	Confident	83.7	Confident	84 Å²	84	73 Å²	73	45%	0.449	36%	0.363	S	S	.	.	H	α-helix	trans	-77.3	-19.4	178.1	-64.7	-33.5	0	0	0	112.4	K201 R202 K207 R253	K201-D205 PolarHBondContact O-N 2.75Å; R202-D205 PolarHBondContact O-N 2.71Å; D205-K207 PolarHBondContact O-N 2.87Å; D205-R253 IonicContact OD1-CZ 3.95Å; D205-R253 IonicContact OD1-NH1 2.7Å; D205-R253 PolarHBondContact OD1-NH1 3.16Å
206	E	82.1	Confident	83.4	Confident	91 Å²	91	73.2 Å²	73.2	43%	0.425	36%	0.364	S	S	.	.			trans	-67.7	93.4	177	-86.4	169.6	178.8	0	0	113.7	R202 Q204 D208	R202-E206 WeakPolarHBondContact CD-OE1 3.41Å; R202-E206 HydrophobicContact CG-CG 4.35Å; R202-E206 WeakPolarHBondContact CG-OE1 3.48Å; R202-E206 IonicContact CZ-OE1 3.41Å; R202-E206 IonicContact NE-OE1 3.04Å; R202-E206 IonicContact NH1-OE1 2.71Å; R202-E206 PolarHBondContact NH1-OE1 3.46Å; R202-E206 IonicContact NH1-OE2 2.65Å; R202-E206 PolarHBondContact NH1-OE2 3.41Å; R202-E206 WeakPolarHBondContact O-CB 3.45Å; R202-E206 VanDerWaalsContact O-CG 3.24Å; R202-E206 WeakPolarHBondContact O-CG 3.37Å; R202-E206 PolarHBondContact O-N 3.32Å; Q204-E206 VanDerWaalsContact C-N 3.34Å; E206-D208 PolarHBondContact O-N 2.95Å
207	K	67.6	Low	83.1	Confident	188 Å²	188	73.9 Å²	73.9	82%	0.817	37%	0.371	S	S	*	.			trans	-78.9	55.5	177.4	-67.5	-178.5	-179	178.1	0	113.6	D205 E209	D205-K207 PolarHBondContact O-N 2.87Å; K207-E209 PolarHBondContact O-N 3.25Å
208	D	69.7	Low	82.9	Confident	72 Å²	72	76 Å²	76	39%	0.385	38%	0.379	S	S	.	.			trans	-63.3	125.9	-177.1	-144.2	-11.1	0	0	0	112.1	E206 A213 R214	E206-D208 PolarHBondContact O-N 2.95Å; D208-A213 WeakPolarHBondContact OD2-CB 3.37Å; D208-R214 PolarHBondContact O-NE 3.23Å; D208-R214 PolarHBondContact O-NH2 2.67Å
209	E	66.3	Low	82.9	Confident	185 Å²	185	78.3 Å²	78.3	86%	0.864	38%	0.38	S	S	*	.			trans	-77.7	-26.6	-179.9	-65.5	-167.1	151.8	0	0	112.5	K207 S211	K207-E209 PolarHBondContact O-N 3.25Å; E209-S211 PolarHBondContact O-N 3.44Å
210	N	77	Confident	82.9	Confident	93 Å²	93	77.7 Å²	77.7	50%	0.497	38%	0.377	S	S	.	.			trans	-72.2	112.9	179.8	179.5	-4.3	0	0	0	110.7	Q212 A213 R214	N210-Q212 PolarHBondContact O-N 3.38Å; N210-Q212 VanDerWaalsContact O-N 3.14Å; N210-Q212 PolarHBondContact OD1-N 3.11Å; N210-A213 HydrophobicContact CB-CB 4Å; N210-A213 PolarHBondContact O-N 2.76Å; N210-A213 VanDerWaalsContact O-N 3.11Å; N210-R214 WeakPolarHBondContact O-CB 3.29Å; N210-R214 PolarHBondContact O-N 2.67Å
211	S	75	Confident	82.9	Confident	84 Å²	84	78.2 Å²	78.2	59%	0.587	38%	0.38	S	S	*	.	H	α-helix	trans	-57.5	-28.4	179.5	-68.2	0	0	0	0	114	E209 N215	E209-S211 PolarHBondContact O-N 3.44Å; S211-N215 VanDerWaalsContact O-CB 3.3Å; S211-N215 WeakPolarHBondContact O-CB 3.5Å; S211-N215 VanDerWaalsContact O-CG 3.29Å; S211-N215 PolarHBondContact O-N 3Å; S211-N215 PolarHBondContact O-ND2 2.72Å
212	Q	75.9	Confident	83	Confident	154 Å²	154	75.3 Å²	75.3	72%	0.72	37%	0.367	S	S	*	.	H	α-helix	trans	-78.9	-37.8	177.3	-173.8	169.1	-14.4	0	0	112.2	N210 M216	N210-Q212 PolarHBondContact O-N 3.38Å; N210-Q212 VanDerWaalsContact O-N 3.14Å; N210-Q212 PolarHBondContact OD1-N 3.11Å; Q212-M216 PolarHBondContact O-N 3.4Å
213	A	75.9	Confident	83.2	Confident	32 Å²	32	70.7 Å²	70.7	26%	0.264	35%	0.35	S	S	.	.	H	α-helix	trans	-69.1	-48.1	176.1	0	0	0	0	0	110.9	D208 N210 N215 M216 G217	D208-A213 WeakPolarHBondContact OD2-CB 3.37Å; N210-A213 HydrophobicContact CB-CB 4Å; N210-A213 PolarHBondContact O-N 2.76Å; N210-A213 VanDerWaalsContact O-N 3.11Å; A213-N215 VanDerWaalsContact C-N 3.32Å; A213-N215 PolarHBondContact O-N 3.01Å; A213-M216 WeakPolarHBondContact O-CA 3.46Å; A213-M216 WeakPolarHBondContact O-CB 3.42Å; A213-M216 PolarHBondContact O-N 3.02Å; A213-G217 PolarHBondContact O-N 3.32Å
214	R	80.8	Confident	83.5	Confident	104 Å²	104	69.9 Å²	69.9	39%	0.392	35%	0.346	S	S	.	.	H	α-helix	trans	-53.6	-43.8	172.8	-176.7	-179.9	-69.8	-159.4	-2.8	112.8	D208 N210 M216 G217 Y218	D208-R214 PolarHBondContact O-NE 3.23Å; D208-R214 PolarHBondContact O-NH2 2.67Å; N210-R214 WeakPolarHBondContact O-CB 3.29Å; N210-R214 PolarHBondContact O-N 2.67Å; R214-M216 VanDerWaalsContact C-N 3.3Å; R214-M216 PolarHBondContact O-N 3.33Å; R214-G217 PolarHBondContact O-N 2.86Å; R214-Y218 HydrophobicContact CG-CD2 4.25Å; R214-Y218 HydrophobicContact CG-CE1 4.47Å; R214-Y218 HydrophobicContact CG-CE2 3.62Å; R214-Y218 WeakPolarHBondContact O-CD2 3.49Å; R214-Y218 PolarHBondContact O-N 2.85Å
215	N	83.3	Confident	83.7	Confident	97 Å²	97	68.2 Å²	68.2	52%	0.519	34%	0.338	S	S	.	.	H	α-helix	trans	-66.5	-27.3	175.9	-85.5	-45	0	0	0	113.7	S211 A213	S211-N215 VanDerWaalsContact O-CB 3.3Å; S211-N215 WeakPolarHBondContact O-CB 3.5Å; S211-N215 VanDerWaalsContact O-CG 3.29Å; S211-N215 PolarHBondContact O-N 3Å; S211-N215 PolarHBondContact O-ND2 2.72Å; A213-N215 VanDerWaalsContact C-N 3.32Å; A213-N215 PolarHBondContact O-N 3.01Å
216	M	84.3	Confident	84.1	Confident	36 Å²	36	68.2 Å²	68.2	18%	0.177	33%	0.332	C	S	.	.	H	α-helix	trans	-77.7	-39.2	171.3	-160.8	64.8	77.9	0	0	111.2	P161 L165 Q212 A213 R214 Y218 K219 C220	P161-M216 HydrophobicContact CB-CB 4.33Å; P161-M216 HydrophobicContact CB-CG 3.7Å; L165-M216 HydrophobicContact CD2-SD 3.91Å; Q212-M216 PolarHBondContact O-N 3.4Å; A213-M216 WeakPolarHBondContact O-CA 3.46Å; A213-M216 WeakPolarHBondContact O-CB 3.42Å; A213-M216 PolarHBondContact O-N 3.02Å; R214-M216 VanDerWaalsContact C-N 3.3Å; R214-M216 PolarHBondContact O-N 3.33Å; M216-Y218 VanDerWaalsContact C-N 3.33Å; M216-Y218 PolarHBondContact O-N 2.84Å; M216-K219 WeakPolarHBondContact O-CB 3.12Å; M216-K219 PolarHBondContact O-N 3.11Å; M216-K219 HydrophobicContact SD-CD 3.81Å; M216-C220 PolarHBondContact O-N 3.1Å; M216-C220 PolarHBondContact O-SG 3.03Å
217	G	87.1	Confident	84.6	Confident	14 Å²	14	63.9 Å²	63.9	14%	0.144	31%	0.312	C	S	.	.	H	α-helix	trans	-52.2	-48.9	170.9	0	0	0	0	0	112.1	A213 R214 K219 C220 Q221	A213-G217 PolarHBondContact O-N 3.32Å; R214-G217 PolarHBondContact O-N 2.86Å; G217-K219 VanDerWaalsContact C-N 3.3Å; G217-K219 PolarHBondContact O-N 3.27Å; G217-C220 PolarHBondContact O-N 3.26Å; G217-C220 VanDerWaalsContact O-N 3.15Å; G217-Q221 WeakPolarHBondContact O-CG 3.48Å; G217-Q221 PolarHBondContact O-N 2.89Å
218	Y	90.3	Very high	85.8	Confident	48 Å²	48	55 Å²	55	19%	0.188	27%	0.273	C	S	.	.	H	α-helix	trans	-61.3	-31.4	175.6	-65.8	-35	0	0	0	114.4	R214 M216 H222 V259	R214-Y218 HydrophobicContact CG-CD2 4.25Å; R214-Y218 HydrophobicContact CG-CE1 4.47Å; R214-Y218 HydrophobicContact CG-CE2 3.62Å; R214-Y218 WeakPolarHBondContact O-CD2 3.49Å; R214-Y218 PolarHBondContact O-N 2.85Å; M216-Y218 VanDerWaalsContact C-N 3.33Å; M216-Y218 PolarHBondContact O-N 2.84Å; Y218-H222 WeakPolarHBondContact O-CB 3.49Å; Y218-H222 PolarHBondContact O-N 3.06Å; Y218-V259 HydrophobicContact CD1-CG2 3.98Å; Y218-V259 HydrophobicContact CD2-CG2 3.73Å; Y218-V259 HydrophobicContact CE1-CG2 4.45Å; Y218-V259 HydrophobicContact CE2-CG2 4.2Å; Y218-V259 HydrophobicContact CG-CG2 3.61Å
219	K	90.7	Very high	86.8	Confident	115 Å²	115	54.1 Å²	54.1	50%	0.5	27%	0.266	S	S	.	.	H	α-helix	trans	-69.7	-44.5	172.6	-69.6	176	-179	-178.4	0	111.5	L165 M216 G217 H222 E223	L165-K219 HydrophobicContact CD1-CB 4.1Å; L165-K219 HydrophobicContact CD2-CB 3.99Å; L165-K219 HydrophobicContact CD2-CD 4.02Å; M216-K219 WeakPolarHBondContact O-CB 3.12Å; M216-K219 PolarHBondContact O-N 3.11Å; M216-K219 HydrophobicContact SD-CD 3.81Å; G217-K219 VanDerWaalsContact C-N 3.3Å; G217-K219 PolarHBondContact O-N 3.27Å; K219-H222 PolarHBondContact O-N 3.23Å; K219-E223 WeakPolarHBondContact O-CB 3.09Å; K219-E223 PolarHBondContact O-N 3.33Å
220	C	91.3	Very high	87.9	Confident	1 Å²	1	45.5 Å²	45.5	1%	0.007	23%	0.226	C	C	.	.	H	α-helix	trans	-62.6	-43.6	176.1	-64.1	0	0	0	0	111.3	L164 L168 L203 M216 G217 E223 I224	L164-C220 HydrophobicContact CD2-CB 4.31Å; L168-C220 HydrophobicContact CD1-CB 4.16Å; L203-C220 HydrophobicContact CD1-CB 3.68Å; M216-C220 PolarHBondContact O-N 3.1Å; M216-C220 PolarHBondContact O-SG 3.03Å; G217-C220 PolarHBondContact O-N 3.26Å; G217-C220 VanDerWaalsContact O-N 3.15Å; C220-E223 PolarHBondContact O-N 3.47Å; C220-I224 WeakPolarHBondContact O-CD1 3.26Å; C220-I224 VanDerWaalsContact O-CG1 3.24Å; C220-I224 WeakPolarHBondContact O-CG1 3.48Å; C220-I224 PolarHBondContact O-N 3.14Å
221	Q	93.8	Very high	88.5	Confident	11 Å²	11	41 Å²	41	5%	0.051	20%	0.202	C	C	.	.	H	α-helix	trans	-55.8	-52.1	172.1	-68.7	176.2	12.6	0	0	111	L200 L203 G217 E223 I224 I225 M262	L200-Q221 HydrophobicContact CD1-CB 3.99Å; L200-Q221 HydrophobicContact CD1-CG 4.01Å; L203-Q221 HydrophobicContact CB-CG 3.81Å; L203-Q221 HydrophobicContact CD1-CG 4.46Å; L203-Q221 PolarHBondContact O-NE2 3.4Å; G217-Q221 WeakPolarHBondContact O-CG 3.48Å; G217-Q221 PolarHBondContact O-N 2.89Å; Q221-E223 VanDerWaalsContact C-N 3.31Å; Q221-E223 PolarHBondContact O-N 3.16Å; Q221-I224 PolarHBondContact O-N 3.33Å; Q221-I224 VanDerWaalsContact O-N 3.16Å; Q221-I225 WeakPolarHBondContact O-CG1 3.25Å; Q221-I225 PolarHBondContact O-N 3.03Å; Q221-M262 HydrophobicContact CB-SD 3.58Å; Q221-M262 VanDerWaalsContact CB-SD 3.58Å
222	H	94.9	Very high	89.2	Confident	19 Å²	19	37 Å²	37	9%	0.088	17%	0.174	C	C	.	.	H	α-helix	trans	-59.9	-41	-179.1	-173.2	-162.9	0	0	0	112.5	Y218 K219 I225 R226 N261 M262 D265	Y218-H222 WeakPolarHBondContact O-CB 3.49Å; Y218-H222 PolarHBondContact O-N 3.06Å; K219-H222 PolarHBondContact O-N 3.23Å; H222-I225 WeakPolarHBondContact O-CB 3.35Å; H222-I225 PolarHBondContact O-N 3.4Å; H222-R226 PolarHBondContact CE1-NE 3.13Å; H222-R226 PolarHBondContact CE1-NH2 2.76Å; H222-R226 VanDerWaalsContact CE1-NH2 3.3Å; H222-R226 PolarHBondContact NE2-NE 3.47Å; H222-R226 VanDerWaalsContact NE2-NE 3.19Å; H222-R226 PolarHBondContact O-N 3.14Å; H222-R226 VanDerWaalsContact O-N 3.12Å; H222-N261 WeakPolarHBondContact CE1-CB 3.29Å; H222-N261 PolarHBondContact NE2-O 3.4Å; H222-M262 HydrophobicContact CB-CB 3.9Å; H222-M262 HydrophobicContact CB-CG 4Å; H222-M262 HydrophobicContact CB-SD 4.11Å; H222-M262 VanDerWaalsContact CD2-CA 3.41Å; H222-M262 WeakPolarHBondContact CD2-CA 3.45Å; H222-D265 IonicContact CD2-OD2 3.97Å; H222-D265 IonicContact CE1-OD2 3.82Å; H222-D265 IonicContact NE2-OD2 2.93Å; H222-D265 PolarHBondContact NE2-OD2 3.41Å
223	E	94.8	Very high	89.7	Confident	4 Å²	4	30.5 Å²	30.5	2%	0.019	14%	0.144	C	C	.	.	H	α-helix	trans	-71.5	-30.7	179.4	-161.2	56.1	-153.9	0	0	112.3	L165 L168 E169 R172 K219 C220 Q221 R226 C227	L165-E223 HydrophobicContact CD1-CB 3.96Å; L165-E223 HydrophobicContact CD1-CG 4.32Å; L168-E223 HydrophobicContact CB-CB 4.19Å; L168-E223 HydrophobicContact CB-CG 3.77Å; E169-E223 HydrophobicContact CG-CG 3.89Å; R172-E223 WeakPolarHBondContact CB-OE1 3.19Å; R172-E223 WeakPolarHBondContact CD-OE1 3.38Å; R172-E223 IonicContact CZ-OE1 2.74Å; R172-E223 IonicContact CZ-OE2 2.81Å; R172-E223 IonicContact NE-OE1 3.99Å; R172-E223 PolarHBondContact NE-OE1 2.74Å; R172-E223 IonicContact NH1-OE1 3.3Å; R172-E223 PolarHBondContact NH1-OE1 3.23Å; R172-E223 IonicContact NH1-OE2 3.88Å; R172-E223 PolarHBondContact NH1-OE2 3.44Å; R172-E223 IonicContact NH2-OE1 2.64Å; K219-E223 WeakPolarHBondContact O-CB 3.09Å; K219-E223 PolarHBondContact O-N 3.33Å; C220-E223 PolarHBondContact O-N 3.47Å; Q221-E223 VanDerWaalsContact C-N 3.31Å; Q221-E223 PolarHBondContact O-N 3.16Å; E223-R226 PolarHBondContact O-N 3.44Å; E223-R226 VanDerWaalsContact OE2-CD 3.29Å; E223-R226 WeakPolarHBondContact OE2-CD 3.34Å; E223-R226 IonicContact OE2-NH1 3.27Å; E223-R226 PolarHBondContact OE2-NH1 3.09Å; E223-C227 PolarHBondContact O-N 3.17Å; E223-C227 PolarHBondContact O-SG 2.95Å; E223-C227 VanDerWaalsContact O-SG 3.4Å
224	I	95	Very high	90	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-64	-44.5	167.7	-63.7	157.6	0	0	0	111.1	L168 L196 L199 L200 L203 C220 Q221 R226 C227 L228	L168-I224 HydrophobicContact CD1-CD1 4.35Å; L168-I224 HydrophobicContact CD1-CG1 3.87Å; L168-I224 HydrophobicContact CD2-CG1 3.78Å; L168-I224 HydrophobicContact CG-CG1 4.47Å; L196-I224 HydrophobicContact CB-CG2 4.06Å; L196-I224 HydrophobicContact CD2-CG1 4.35Å; L196-I224 HydrophobicContact CD2-CG2 4.27Å; L199-I224 HydrophobicContact CB-CD1 4.31Å; L199-I224 HydrophobicContact CD2-CD1 3.63Å; L199-I224 HydrophobicContact CD2-CG1 4.19Å; L199-I224 HydrophobicContact CG-CD1 3.72Å; L200-I224 HydrophobicContact CB-CD1 4.21Å; L200-I224 HydrophobicContact CB-CG2 4.06Å; L200-I224 HydrophobicContact CD2-CG2 4.3Å; L203-I224 HydrophobicContact CD1-CD1 3.75Å; C220-I224 WeakPolarHBondContact O-CD1 3.26Å; C220-I224 VanDerWaalsContact O-CG1 3.24Å; C220-I224 WeakPolarHBondContact O-CG1 3.48Å; C220-I224 PolarHBondContact O-N 3.14Å; Q221-I224 PolarHBondContact O-N 3.33Å; Q221-I224 VanDerWaalsContact O-N 3.16Å; I224-R226 PolarHBondContact O-N 3Å; I224-C227 WeakPolarHBondContact O-CB 3.48Å; I224-C227 PolarHBondContact O-N 3.45Å; I224-C227 VanDerWaalsContact O-N 3.08Å; I224-L228 HydrophobicContact CG2-CD1 4.19Å; I224-L228 HydrophobicContact CG2-CG 4.27Å; I224-L228 WeakPolarHBondContact O-CG 3.36Å; I224-L228 PolarHBondContact O-N 2.88Å
225	I	95.9	Very high	90	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-56.4	-34.3	175.7	-62	-65.6	0	0	0	111	L200 Q221 H222 L228 K229 L251 A254 M262 D265 A266 L269	L200-I225 HydrophobicContact CD2-CD1 3.9Å; Q221-I225 WeakPolarHBondContact O-CG1 3.25Å; Q221-I225 PolarHBondContact O-N 3.03Å; H222-I225 WeakPolarHBondContact O-CB 3.35Å; H222-I225 PolarHBondContact O-N 3.4Å; I225-L228 PolarHBondContact O-N 3.34Å; I225-K229 PolarHBondContact O-N 2.97Å; I225-L251 HydrophobicContact CD1-CD2 3.61Å; I225-A254 HydrophobicContact CD1-CB 3.62Å; I225-A254 HydrophobicContact CG1-CB 4.05Å; I225-M262 HydrophobicContact CG1-CG 4.13Å; I225-D265 HydrophobicContact CG2-CB 3.94Å; I225-A266 HydrophobicContact CG2-CB 4.44Å; I225-L269 HydrophobicContact CG2-CD1 3.77Å
226	R	93.9	Very high	90	Very high	85 Å²	85	23.2 Å²	23.2	32%	0.321	10%	0.104	S	C	.	.	H	α-helix	trans	-76.3	-36	175.4	-70.4	165.2	162.8	-173.5	-6.8	114	R172 H222 E223 I224 L228 K229 A230 D265	R172-R226 HydrophobicContact CG-CB 4.19Å; H222-R226 PolarHBondContact CE1-NE 3.13Å; H222-R226 PolarHBondContact CE1-NH2 2.76Å; H222-R226 VanDerWaalsContact CE1-NH2 3.3Å; H222-R226 PolarHBondContact NE2-NE 3.47Å; H222-R226 VanDerWaalsContact NE2-NE 3.19Å; H222-R226 PolarHBondContact O-N 3.14Å; H222-R226 VanDerWaalsContact O-N 3.12Å; E223-R226 PolarHBondContact O-N 3.44Å; E223-R226 VanDerWaalsContact OE2-CD 3.29Å; E223-R226 WeakPolarHBondContact OE2-CD 3.34Å; E223-R226 IonicContact OE2-NH1 3.27Å; E223-R226 PolarHBondContact OE2-NH1 3.09Å; I224-R226 PolarHBondContact O-N 3Å; R226-L228 VanDerWaalsContact C-N 3.33Å; R226-K229 PolarHBondContact O-N 3.37Å; R226-A230 WeakPolarHBondContact O-CB 3.23Å; R226-A230 PolarHBondContact O-N 3.46Å; R226-D265 IonicContact CZ-OD2 2.98Å; R226-D265 IonicContact NE-OD2 3.3Å; R226-D265 PolarHBondContact NE-OD2 3.48Å; R226-D265 VanDerWaalsContact NE-OD2 3.09Å; R226-D265 IonicContact NH2-OD2 3.92Å
227	C	93.4	Very high	90.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-60.6	-43.5	167.6	-69.7	0	0	0	0	110.9	L168 L175 L196 E223 I224 A230 F231	L168-C227 PolarHBondContact O-SG 2.81Å; L175-C227 HydrophobicContact CD1-CB 3.95Å; L196-C227 HydrophobicContact CD1-CB 3.82Å; L196-C227 HydrophobicContact CD2-CB 4.46Å; E223-C227 PolarHBondContact O-N 3.17Å; E223-C227 PolarHBondContact O-SG 2.95Å; E223-C227 VanDerWaalsContact O-SG 3.4Å; I224-C227 WeakPolarHBondContact O-CB 3.48Å; I224-C227 PolarHBondContact O-N 3.45Å; I224-C227 VanDerWaalsContact O-N 3.08Å; C227-A230 PolarHBondContact O-N 3.37Å; C227-F231 VanDerWaalsContact O-CB 3.29Å; C227-F231 WeakPolarHBondContact O-CB 3.5Å; C227-F231 PolarHBondContact O-N 3.35Å
228	L	93.1	Very high	90.1	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-62.1	-43.7	175.2	-66.6	174	0	0	0	111.3	L193 L196 L197 L200 I224 I225 R226 A230 F231 M232 M241 L251	L193-L228 HydrophobicContact CD1-CD2 3.54Å; L196-L228 HydrophobicContact CB-CD2 4.46Å; L196-L228 HydrophobicContact CD1-CD2 4.45Å; L197-L228 HydrophobicContact CD2-CD1 3.91Å; L197-L228 HydrophobicContact CD2-CD2 4.09Å; L200-L228 HydrophobicContact CD2-CD1 4.18Å; I224-L228 HydrophobicContact CG2-CD1 4.19Å; I224-L228 HydrophobicContact CG2-CG 4.27Å; I224-L228 WeakPolarHBondContact O-CG 3.36Å; I224-L228 PolarHBondContact O-N 2.88Å; I225-L228 PolarHBondContact O-N 3.34Å; R226-L228 VanDerWaalsContact C-N 3.33Å; L228-A230 PolarHBondContact O-N 2.86Å; L228-F231 PolarHBondContact O-N 3.35Å; L228-M232 WeakPolarHBondContact O-CB 3.46Å; L228-M232 VanDerWaalsContact O-CG 3.26Å; L228-M232 WeakPolarHBondContact O-CG 3.23Å; L228-M232 PolarHBondContact O-N 2.93Å; L228-M241 HydrophobicContact CD1-CE 4.17Å; L228-M241 HydrophobicContact CD2-SD 4.2Å; L228-L251 HydrophobicContact CD1-CD2 4.08Å
229	K	91.3	Very high	89.8	Confident	55 Å²	55	23.6 Å²	23.6	24%	0.239	10%	0.102	C	C	.	.	H	α-helix	trans	-55.3	-49.7	172.1	-178.7	176.8	173.3	-175.9	0	112.1	I225 R226 M232 N233 L269 D1146 L1149	I225-K229 PolarHBondContact O-N 2.97Å; R226-K229 PolarHBondContact O-N 3.37Å; K229-M232 PolarHBondContact O-N 3.02Å; K229-N233 PolarHBondContact O-N 2.95Å; K229-L269 HydrophobicContact CB-CD1 4.35Å; K229-L269 HydrophobicContact CB-CD2 3.85Å; K229-L269 HydrophobicContact CG-CD2 3.97Å; K229-D1146 WeakPolarHBondContact CE-OD1 3.44Å; K229-D1146 IonicContact NZ-OD1 3.32Å; K229-D1146 PolarHBondContact NZ-OD1 2.61Å; K229-L1149 HydrophobicContact CD-CD1 4.24Å; K229-L1149 VanDerWaalsContact CE-CD1 3.44Å
230	A	89.3	Confident	89.7	Confident	3 Å²	3	18.6 Å²	18.6	3%	0.025	8%	0.081	C	C	.	.	H	α-helix	trans	-64	-42.3	-178.1	0	0	0	0	0	112.2	L175 N176 R226 C227 L228 N233 N234	L175-A230 HydrophobicContact CB-CB 3.54Å; L175-A230 HydrophobicContact CD1-CB 4.21Å; L175-A230 HydrophobicContact CG-CB 4.48Å; N176-A230 WeakPolarHBondContact OD1-CB 3.12Å; R226-A230 WeakPolarHBondContact O-CB 3.23Å; R226-A230 PolarHBondContact O-N 3.46Å; C227-A230 PolarHBondContact O-N 3.37Å; L228-A230 PolarHBondContact O-N 2.86Å; A230-N233 WeakPolarHBondContact O-CB 3.39Å; A230-N233 PolarHBondContact O-N 2.95Å; A230-N234 PolarHBondContact O-ND2 2.89Å
231	F	88.6	Confident	89.7	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-61.5	-49.9	175.3	-178.4	-97.5	0	0	0	111.5	L175 V185 F188 L193 C227 L228 N233 N234 Y236 G237	L175-F231 HydrophobicContact CD2-CB 4.37Å; L175-F231 HydrophobicContact CD2-CD2 4.29Å; V185-F231 HydrophobicContact CG1-CD2 3.69Å; V185-F231 HydrophobicContact CG1-CE2 3.72Å; V185-F231 HydrophobicContact CG1-CG 4.44Å; V185-F231 HydrophobicContact CG1-CZ 4.5Å; F188-F231 AromaticContact CD1-CD2 3.95Å; F188-F231 HydrophobicContact CD1-CD2 3.95Å; F188-F231 AromaticContact CD1-CE2 3.93Å; F188-F231 HydrophobicContact CD1-CE2 3.93Å; L193-F231 HydrophobicContact CB-CE1 4.18Å; L193-F231 HydrophobicContact CB-CZ 4Å; L193-F231 HydrophobicContact CD1-CD1 4.21Å; L193-F231 HydrophobicContact CD1-CE1 3.95Å; L193-F231 HydrophobicContact CD2-CE1 3.97Å; L193-F231 HydrophobicContact CD2-CZ 4.35Å; L193-F231 HydrophobicContact CG-CE1 4.25Å; C227-F231 VanDerWaalsContact O-CB 3.29Å; C227-F231 WeakPolarHBondContact O-CB 3.5Å; C227-F231 PolarHBondContact O-N 3.35Å; L228-F231 PolarHBondContact O-N 3.35Å; F231-N233 PolarHBondContact O-N 3.16Å; F231-N233 VanDerWaalsContact O-N 3.1Å; F231-N234 PolarHBondContact O-ND2 3.3Å; F231-Y236 HydrophobicContact CE2-CE1 4.46Å; F231-Y236 HydrophobicContact CZ-CD1 4.46Å; F231-Y236 HydrophobicContact CZ-CE1 4.13Å; F231-G237 WeakPolarHBondContact CE1-O 3.42Å
232	M	88.9	Confident	89.4	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	8%	0.082	C	C	.	.	H	α-helix	trans	-63.8	-10	176.5	-70.9	-178.4	77	0	0	114.4	L228 K229 N234 I238 M241 L269 I273 M1145	L228-M232 WeakPolarHBondContact O-CB 3.46Å; L228-M232 VanDerWaalsContact O-CG 3.26Å; L228-M232 WeakPolarHBondContact O-CG 3.23Å; L228-M232 PolarHBondContact O-N 2.93Å; K229-M232 PolarHBondContact O-N 3.02Å; M232-N234 PolarHBondContact O-N 3.43Å; M232-I238 HydrophobicContact CB-CG1 4.4Å; M232-I238 WeakPolarHBondContact O-CD1 3.4Å; M232-I238 WeakPolarHBondContact O-CG1 3.3Å; M232-M241 HydrophobicContact CE-CG 4.23Å; M232-M241 HydrophobicContact CG-CB 4.09Å; M232-M241 HydrophobicContact CG-CG 4.15Å; M232-M241 HydrophobicContact SD-CB 4.36Å; M232-M241 HydrophobicContact SD-CG 3.81Å; M232-L269 HydrophobicContact SD-CD2 4.34Å; M232-I273 HydrophobicContact CE-CD1 4.05Å; M232-I273 HydrophobicContact CE-CG1 3.96Å; M232-M1145 HydrophobicContact CB-CG 4.31Å; M232-M1145 HydrophobicContact CE-CE 3.58Å; M232-M1145 HydrophobicContact CE-SD 4.22Å; M232-M1145 HydrophobicContact SD-CE 4.16Å
233	N	87.7	Confident	88.9	Confident	17 Å²	17	21 Å²	21	9%	0.091	11%	0.111	C	C	.	.	T	Hydrogen-bonded Turn	trans	-75.1	12.4	177.6	-146.9	16.3	0	0	0	114.1	K229 A230 F231 G1143 M1145 D1146	K229-N233 PolarHBondContact O-N 2.95Å; A230-N233 WeakPolarHBondContact O-CB 3.39Å; A230-N233 PolarHBondContact O-N 2.95Å; F231-N233 PolarHBondContact O-N 3.16Å; F231-N233 VanDerWaalsContact O-N 3.1Å; N233-G1143 PolarHBondContact O-N 3.4Å; N233-G1143 VanDerWaalsContact OD1-C 3.25Å; N233-G1143 WeakPolarHBondContact OD1-CA 2.98Å; N233-M1145 HydrophobicContact CB-CB 4.28Å; N233-M1145 WeakPolarHBondContact OD1-CB 3.39Å; N233-M1145 PolarHBondContact OD1-N 2.87Å; N233-M1145 VanDerWaalsContact OD1-N 3.11Å; N233-D1146 PolarHBondContact ND2-OD2 3.35Å; N233-D1146 PolarHBondContact OD1-N 3.14Å
234	N	82	Confident	88.6	Confident	5 Å²	5	22.1 Å²	22.1	3%	0.027	12%	0.118	C	C	.	.	B	Isolated β-bridge	trans	-137.7	141.6	-176.9	-45.8	-99.8	0	0	0	107.9	S181 A230 F231 M232 Y236 G237 I238 T1142	S181-N234 PolarHBondContact OG-OD1 3.22Å; A230-N234 PolarHBondContact O-ND2 2.89Å; F231-N234 PolarHBondContact O-ND2 3.3Å; M232-N234 PolarHBondContact O-N 3.43Å; N234-Y236 VanDerWaalsContact C-N 3.3Å; N234-Y236 PolarHBondContact O-N 2.94Å; N234-G237 PolarHBondContact O-N 2.9Å; N234-I238 PolarHBondContact O-N 2.74Å; N234-T1142 HydrophobicContact CB-CG2 4.31Å; N234-T1142 WeakPolarHBondContact OD1-CG2 3.45Å
235	M	80.1	Confident	88.1	Confident	15 Å²	15	30.1 Å²	30.1	7%	0.074	16%	0.156	C	C	.	.	H	α-helix	trans	-52.2	-43.1	-174.8	-178.2	59.9	83.3	0	0	113.9	G237 I238 K239 I1134 A1137 E1141 I1144	M235-G237 PolarHBondContact O-N 3.36Å; M235-I238 PolarHBondContact O-N 2.85Å; M235-K239 HydrophobicContact CG-CD 4.27Å; M235-K239 PolarHBondContact O-N 2.76Å; M235-K239 HydrophobicContact SD-CD 4.28Å; M235-K239 VanDerWaalsContact SD-CE 3.54Å; M235-I1134 HydrophobicContact CE-CG2 3.91Å; M235-I1134 HydrophobicContact SD-CG2 3.56Å; M235-I1134 VanDerWaalsContact SD-CG2 3.56Å; M235-A1137 HydrophobicContact CE-CB 3.94Å; M235-E1141 PolarHBondContact N-O 3.32Å; M235-E1141 VanDerWaalsContact N-O 3.09Å; M235-I1144 HydrophobicContact CB-CD1 3.83Å; M235-I1144 HydrophobicContact CE-CD1 3.75Å; M235-I1144 HydrophobicContact SD-CD1 4.2Å
236	Y	84.1	Confident	87.6	Confident	59 Å²	59	32 Å²	32	23%	0.231	17%	0.166	C	C	.	.	H	α-helix	trans	-59.5	-45.3	175.2	172.5	-93.8	0	0	0	112.1	V185 Q186 G189 D190 F231 N234 I238 K239 S240	V185-Y236 HydrophobicContact CG1-CD1 4.02Å; Q186-Y236 HydrophobicContact CG-CD1 4.17Å; Q186-Y236 HydrophobicContact CG-CD2 4.28Å; Q186-Y236 HydrophobicContact CG-CG 4Å; G189-Y236 VanDerWaalsContact CA-OH 3.29Å; G189-Y236 WeakPolarHBondContact CA-OH 3.48Å; D190-Y236 PolarHBondContact N-OH 3.31Å; D190-Y236 VanDerWaalsContact N-OH 3.1Å; D190-Y236 PolarHBondContact OD1-OH 2.71Å; D190-Y236 PolarHBondContact OD2-OH 3.27Å; F231-Y236 HydrophobicContact CE2-CE1 4.46Å; F231-Y236 HydrophobicContact CZ-CD1 4.46Å; F231-Y236 HydrophobicContact CZ-CE1 4.13Å; N234-Y236 VanDerWaalsContact C-N 3.3Å; N234-Y236 PolarHBondContact O-N 2.94Å; Y236-I238 VanDerWaalsContact C-N 3.3Å; Y236-I238 PolarHBondContact O-N 3.1Å; Y236-K239 PolarHBondContact O-N 3.28Å; Y236-K239 VanDerWaalsContact O-N 3.12Å; Y236-S240 VanDerWaalsContact CZ-OG 3.27Å; Y236-S240 PolarHBondContact O-N 2.92Å; Y236-S240 PolarHBondContact O-OG 2.88Å
237	G	86.6	Confident	87.4	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-67.4	-28.9	-177.4	0	0	0	0	0	113.8	F231 N234 M235 M241	F231-G237 WeakPolarHBondContact CE1-O 3.42Å; N234-G237 PolarHBondContact O-N 2.9Å; M235-G237 PolarHBondContact O-N 3.36Å; G237-M241 WeakPolarHBondContact O-CB 3.43Å; G237-M241 PolarHBondContact O-N 3.41Å; G237-M241 VanDerWaalsContact O-N 3.14Å
238	I	86.3	Confident	87.5	Confident	2 Å²	2	28.7 Å²	28.7	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-66.1	-52.5	168.6	-59.8	-179.7	0	0	0	109.7	M232 N234 M235 Y236 S240 M241 L242 L276 I1144	M232-I238 HydrophobicContact CB-CG1 4.4Å; M232-I238 WeakPolarHBondContact O-CD1 3.4Å; M232-I238 WeakPolarHBondContact O-CG1 3.3Å; N234-I238 PolarHBondContact O-N 2.74Å; M235-I238 PolarHBondContact O-N 2.85Å; Y236-I238 VanDerWaalsContact C-N 3.3Å; Y236-I238 PolarHBondContact O-N 3.1Å; I238-S240 PolarHBondContact O-N 2.99Å; I238-M241 PolarHBondContact O-N 3.46Å; I238-L242 HydrophobicContact CG2-CD1 3.64Å; I238-L242 HydrophobicContact CG2-CG 4.21Å; I238-L242 WeakPolarHBondContact O-CB 3.42Å; I238-L242 VanDerWaalsContact O-CG 3.31Å; I238-L242 WeakPolarHBondContact O-CG 3.41Å; I238-L242 PolarHBondContact O-N 2.93Å; I238-L276 HydrophobicContact CG2-CD1 3.91Å; I238-I1144 HydrophobicContact CD1-CB 4.07Å; I238-I1144 HydrophobicContact CD1-CD1 4.38Å; I238-I1144 HydrophobicContact CD1-CG2 3.67Å
239	K	85.1	Confident	87.5	Confident	105 Å²	105	31.9 Å²	31.9	46%	0.457	17%	0.166	S	C	.	.	H	α-helix	trans	-59.5	-44.2	-177.5	-70.9	175.5	176.8	173	0	112	M235 Y236 G243	M235-K239 HydrophobicContact CG-CD 4.27Å; M235-K239 PolarHBondContact O-N 2.76Å; M235-K239 HydrophobicContact SD-CD 4.28Å; M235-K239 VanDerWaalsContact SD-CE 3.54Å; Y236-K239 PolarHBondContact O-N 3.28Å; Y236-K239 VanDerWaalsContact O-N 3.12Å; K239-G243 PolarHBondContact O-N 3.11Å
240	S	88.1	Confident	87.7	Confident	9 Å²	9	29.4 Å²	29.4	6%	0.063	16%	0.156	C	C	.	.	H	α-helix	trans	-64.1	-42.8	174.5	-67.1	0	0	0	0	113.7	D190 L193 Y236 I238 G243 T244	D190-S240 WeakPolarHBondContact OD1-CB 3.43Å; D190-S240 PolarHBondContact OD1-OG 3.29Å; L193-S240 VanDerWaalsContact CD2-C 3.47Å; L193-S240 WeakPolarHBondContact CD2-O 3.09Å; Y236-S240 VanDerWaalsContact CZ-OG 3.27Å; Y236-S240 PolarHBondContact O-N 2.92Å; Y236-S240 PolarHBondContact O-OG 2.88Å; I238-S240 PolarHBondContact O-N 2.99Å; S240-G243 PolarHBondContact O-N 3.26Å; S240-T244 PolarHBondContact O-OG1 2.9Å
241	M	89.9	Confident	88	Confident	1 Å²	1	29.3 Å²	29.3	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-66.2	-40.1	179.5	-177.6	61.9	174	0	0	112.2	L193 L197 L228 M232 G237 I238 T244 G247 L251	L193-M241 HydrophobicContact CD1-SD 3.95Å; L197-M241 HydrophobicContact CD1-SD 4.19Å; L197-M241 HydrophobicContact CD2-CE 4.13Å; L197-M241 HydrophobicContact CD2-SD 4.17Å; L228-M241 HydrophobicContact CD1-CE 4.17Å; L228-M241 HydrophobicContact CD2-SD 4.2Å; M232-M241 HydrophobicContact CE-CG 4.23Å; M232-M241 HydrophobicContact CG-CB 4.09Å; M232-M241 HydrophobicContact CG-CG 4.15Å; M232-M241 HydrophobicContact SD-CB 4.36Å; M232-M241 HydrophobicContact SD-CG 3.81Å; G237-M241 WeakPolarHBondContact O-CB 3.43Å; G237-M241 PolarHBondContact O-N 3.41Å; G237-M241 VanDerWaalsContact O-N 3.14Å; I238-M241 PolarHBondContact O-N 3.46Å; M241-T244 PolarHBondContact O-N 3.23Å; M241-G247 VanDerWaalsContact CE-O 3.28Å; M241-G247 WeakPolarHBondContact CE-O 3.49Å; M241-L251 HydrophobicContact CE-CD1 3.63Å; M241-L251 HydrophobicContact CE-CD2 4.23Å; M241-L251 HydrophobicContact CE-CG 3.71Å
242	L	87.7	Confident	88.3	Confident	12 Å²	12	29.8 Å²	29.8	6%	0.063	16%	0.158	C	C	.	.	H	α-helix	trans	-75.8	-28	178.8	-63.4	177.9	0	0	0	113.1	I238 T244 I248 I273 L276 L282	I238-L242 HydrophobicContact CG2-CD1 3.64Å; I238-L242 HydrophobicContact CG2-CG 4.21Å; I238-L242 WeakPolarHBondContact O-CB 3.42Å; I238-L242 VanDerWaalsContact O-CG 3.31Å; I238-L242 WeakPolarHBondContact O-CG 3.41Å; I238-L242 PolarHBondContact O-N 2.93Å; L242-T244 PolarHBondContact O-N 2.9Å; L242-I248 HydrophobicContact CD2-CD1 4.38Å; L242-I273 HydrophobicContact CD2-CG2 4.2Å; L242-L276 HydrophobicContact CD1-CD1 4.24Å; L242-L282 HydrophobicContact CD1-CD1 3.52Å; L242-L282 HydrophobicContact CD1-CD2 4.33Å; L242-L282 HydrophobicContact CD2-CD1 3.92Å; L242-L282 HydrophobicContact CD2-CD2 3.95Å; L242-L282 HydrophobicContact CG-CD1 4.35Å
243	G	85.5	Confident	88.6	Confident	69 Å²	69	32.9 Å²	32.9	71%	0.711	17%	0.17	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-4.6	172.9	0	0	0	0	0	114.9	K239 S240	K239-G243 PolarHBondContact O-N 3.11Å; S240-G243 PolarHBondContact O-N 3.26Å
244	T	89	Confident	88.9	Confident	28 Å²	28	32.1 Å²	32.1	17%	0.172	17%	0.165	C	C	.	.	S	Bend	trans	-105.3	115.3	-178.3	-55.3	0	0	0	0	111.3	M194 L197 S240 M241 L242 D246 G247	M194-T244 HydrophobicContact SD-CG2 3.82Å; L197-T244 HydrophobicContact CD1-CG2 3.63Å; S240-T244 PolarHBondContact O-OG1 2.9Å; M241-T244 PolarHBondContact O-N 3.23Å; L242-T244 PolarHBondContact O-N 2.9Å; T244-D246 VanDerWaalsContact C-N 3.26Å; T244-D246 PolarHBondContact O-N 3.38Å; T244-D246 VanDerWaalsContact O-N 3.12Å; T244-G247 PolarHBondContact O-N 3.09Å
245	E	83.1	Confident	89.6	Confident	167 Å²	167	32.6 Å²	32.6	78%	0.78	17%	0.168	S	C	*	.	H	α-helix	trans	-53	-37.9	-175.5	-64.7	-168.9	170.4	0	0	114.6	R249	E245-R249 IonicContact OE2-NH2 3.72Å
246	D	86.8	Confident	90.1	Very high	41 Å²	41	33.3 Å²	33.3	22%	0.219	17%	0.172	C	C	.	.	H	α-helix	trans	-82.9	-11.3	-179.8	-84.6	-3.4	0	0	0	113.7	K201 T244 I248 R249 L250	K201-D246 IonicContact NZ-OD2 2.99Å; K201-D246 PolarHBondContact NZ-OD2 3.24Å; T244-D246 VanDerWaalsContact C-N 3.26Å; T244-D246 PolarHBondContact O-N 3.38Å; T244-D246 VanDerWaalsContact O-N 3.12Å; D246-I248 PolarHBondContact O-N 2.89Å; D246-R249 PolarHBondContact O-N 3.09Å; D246-R249 IonicContact OD1-CZ 3.25Å; D246-R249 IonicContact OD1-NE 3.98Å; D246-R249 PolarHBondContact OD1-NE 3.35Å; D246-R249 IonicContact OD1-NH2 2.77Å; D246-R249 PolarHBondContact OD1-NH2 3.38Å; D246-L250 HydrophobicContact CB-CD1 3.96Å; D246-L250 HydrophobicContact CB-CG 4.28Å; D246-L250 WeakPolarHBondContact O-CB 3.3Å; D246-L250 WeakPolarHBondContact O-CG 3.26Å; D246-L250 PolarHBondContact O-N 2.73Å
247	G	89.8	Confident	90.5	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-56.8	-55.1	-174	0	0	0	0	0	112.8	M241 T244 L251	M241-G247 VanDerWaalsContact CE-O 3.28Å; M241-G247 WeakPolarHBondContact CE-O 3.49Å; T244-G247 PolarHBondContact O-N 3.09Å; G247-L251 WeakPolarHBondContact O-CG 3.45Å; G247-L251 PolarHBondContact O-N 3.21Å
248	I	94	Very high	90.6	Very high	14 Å²	14	41.5 Å²	41.5	7%	0.072	21%	0.207	C	C	.	.	H	α-helix	trans	-66.9	-42.2	178.7	-61.9	176.3	0	0	0	110.9	L242 D246 L250 L251 V252 L270 I273 R285 V286 A289	L242-I248 HydrophobicContact CD2-CD1 4.38Å; D246-I248 PolarHBondContact O-N 2.89Å; I248-L250 VanDerWaalsContact C-N 3.33Å; I248-L250 PolarHBondContact O-N 2.69Å; I248-L251 PolarHBondContact O-N 3.19Å; I248-V252 HydrophobicContact CG2-CG2 4.43Å; I248-V252 WeakPolarHBondContact O-CG2 3.45Å; I248-V252 PolarHBondContact O-N 2.93Å; I248-L270 HydrophobicContact CG2-CD2 4.23Å; I248-I273 HydrophobicContact CD1-CG2 4.21Å; I248-R285 HydrophobicContact CD1-CB 4.09Å; I248-V286 HydrophobicContact CG2-CB 4.49Å; I248-V286 HydrophobicContact CG2-CG2 3.82Å; I248-A289 HydrophobicContact CG2-CB 3.93Å
249	R	93.6	Very high	90.9	Very high	67 Å²	67	42.5 Å²	42.5	25%	0.253	21%	0.213	S	C	.	.	H	α-helix	trans	-61.6	-38.5	-178.8	-63.4	-166.2	-72.7	-138.1	-5.3	112.6	E245 D246 V252 R253 A289 E292	E245-R249 IonicContact OE2-NH2 3.72Å; D246-R249 PolarHBondContact O-N 3.09Å; D246-R249 IonicContact OD1-CZ 3.25Å; D246-R249 IonicContact OD1-NE 3.98Å; D246-R249 PolarHBondContact OD1-NE 3.35Å; D246-R249 IonicContact OD1-NH2 2.77Å; D246-R249 PolarHBondContact OD1-NH2 3.38Å; R249-V252 PolarHBondContact O-N 3Å; R249-R253 WeakPolarHBondContact O-CG 3.46Å; R249-R253 PolarHBondContact O-N 3.15Å; R249-A289 HydrophobicContact CG-CB 3.93Å; R249-E292 WeakPolarHBondContact CD-OE1 3.5Å; R249-E292 WeakPolarHBondContact CD-OE2 3.35Å; R249-E292 IonicContact NH1-OE1 3.73Å; R249-E292 PolarHBondContact NH1-OE1 3.13Å; R249-E292 IonicContact NH1-OE2 3.9Å
250	L	94.8	Very high	91.2	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-74.2	-29.8	177.5	-66.2	170.5	0	0	0	113.2	L197 L200 K201 Q204 D246 I248 A254	L197-L250 HydrophobicContact CB-CD1 3.88Å; L197-L250 HydrophobicContact CD2-CD1 4.01Å; L197-L250 WeakPolarHBondContact O-CD1 3.29Å; L200-L250 HydrophobicContact CD2-CB 3.88Å; L200-L250 HydrophobicContact CG-CB 4.37Å; K201-L250 HydrophobicContact CB-CD1 4.16Å; K201-L250 HydrophobicContact CB-CD2 3.65Å; K201-L250 HydrophobicContact CD-CD2 4.43Å; K201-L250 HydrophobicContact CG-CD2 3.93Å; Q204-L250 PolarHBondContact NE2-O 3.12Å; D246-L250 HydrophobicContact CB-CD1 3.96Å; D246-L250 HydrophobicContact CB-CG 4.28Å; D246-L250 WeakPolarHBondContact O-CB 3.3Å; D246-L250 WeakPolarHBondContact O-CG 3.26Å; D246-L250 PolarHBondContact O-N 2.73Å; I248-L250 VanDerWaalsContact C-N 3.33Å; I248-L250 PolarHBondContact O-N 2.69Å; L250-A254 PolarHBondContact O-N 3.17Å
251	L	95.6	Very high	91.5	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-67.9	-42.5	169.1	-69.9	-178.5	0	0	0	111.6	I225 L228 M241 G247 I248 R253 A254 L269 L270 I273	I225-L251 HydrophobicContact CD1-CD2 3.61Å; L228-L251 HydrophobicContact CD1-CD2 4.08Å; M241-L251 HydrophobicContact CE-CD1 3.63Å; M241-L251 HydrophobicContact CE-CD2 4.23Å; M241-L251 HydrophobicContact CE-CG 3.71Å; G247-L251 WeakPolarHBondContact O-CG 3.45Å; G247-L251 PolarHBondContact O-N 3.21Å; I248-L251 PolarHBondContact O-N 3.19Å; L251-R253 PolarHBondContact O-N 3.45Å; L251-A254 WeakPolarHBondContact O-CA 3.47Å; L251-A254 WeakPolarHBondContact O-CB 3.36Å; L251-A254 PolarHBondContact O-N 3.3Å; L251-L269 HydrophobicContact CD1-CB 4.36Å; L251-L269 HydrophobicContact CD2-CD1 3.91Å; L251-L270 HydrophobicContact CB-CD1 4.45Å; L251-L270 HydrophobicContact CB-CD2 3.89Å; L251-L270 HydrophobicContact CB-CG 4.16Å; L251-L270 HydrophobicContact CD1-CD2 4.33Å; L251-I273 HydrophobicContact CD1-CD1 3.57Å
252	V	96.3	Very high	91.7	Very high	11 Å²	11	42.3 Å²	42.3	7%	0.067	22%	0.218	C	C	.	.	H	α-helix	trans	-60.4	-44.2	175.2	166.2	0	0	0	0	111.2	I248 R249 A254 L255 L270 A289 I290 E293	I248-V252 HydrophobicContact CG2-CG2 4.43Å; I248-V252 WeakPolarHBondContact O-CG2 3.45Å; I248-V252 PolarHBondContact O-N 2.93Å; R249-V252 PolarHBondContact O-N 3Å; V252-A254 PolarHBondContact O-N 2.79Å; V252-A254 VanDerWaalsContact O-N 3.11Å; V252-L255 VanDerWaalsContact O-CB 3.24Å; V252-L255 WeakPolarHBondContact O-CB 3.49Å; V252-L255 WeakPolarHBondContact O-CG 3.26Å; V252-L255 PolarHBondContact O-N 3.33Å; V252-L270 HydrophobicContact CG2-CD1 3.93Å; V252-L270 HydrophobicContact CG2-CD2 4.03Å; V252-A289 HydrophobicContact CB-CB 4.45Å; V252-A289 HydrophobicContact CG2-CB 3.86Å; V252-I290 HydrophobicContact CG1-CB 4.45Å; V252-I290 HydrophobicContact CG1-CG1 3.87Å; V252-I290 HydrophobicContact CG2-CG1 3.81Å; V252-E293 HydrophobicContact CG1-CB 4.14Å
253	R	94.1	Very high	92.2	Very high	65 Å²	65	41.8 Å²	41.8	25%	0.245	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.7	-20.7	172.7	-76.9	171.9	165.5	-133.6	-21.2	114.3	Q204 D205 R249 L251 L255 E293	Q204-R253 VanDerWaalsContact OE1-CB 3.22Å; Q204-R253 VanDerWaalsContact OE1-CD 3.27Å; D205-R253 IonicContact OD1-CZ 3.95Å; D205-R253 IonicContact OD1-NH1 2.7Å; D205-R253 PolarHBondContact OD1-NH1 3.16Å; R249-R253 WeakPolarHBondContact O-CG 3.46Å; R249-R253 PolarHBondContact O-N 3.15Å; L251-R253 PolarHBondContact O-N 3.45Å; R253-L255 VanDerWaalsContact C-N 3.32Å; R253-E293 HydrophobicContact CG-CG 3.76Å; R253-E293 IonicContact CZ-OE1 3.41Å; R253-E293 IonicContact CZ-OE2 3.92Å; R253-E293 VanDerWaalsContact CZ-OE2 3.3Å; R253-E293 IonicContact NE-OE1 3.93Å; R253-E293 IonicContact NE-OE2 2.69Å; R253-E293 PolarHBondContact NE-OE2 2.87Å; R253-E293 IonicContact NH2-OE1 3.23Å; R253-E293 IonicContact NH2-OE2 3.27Å; R253-E293 PolarHBondContact NH2-OE2 3.18Å
254	A	95.1	Very high	92.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.8	-0.2	175.3	0	0	0	0	0	114	I225 L250 L251 V252 N256 M262 A266	I225-A254 HydrophobicContact CD1-CB 3.62Å; I225-A254 HydrophobicContact CG1-CB 4.05Å; L250-A254 PolarHBondContact O-N 3.17Å; L251-A254 WeakPolarHBondContact O-CA 3.47Å; L251-A254 WeakPolarHBondContact O-CB 3.36Å; L251-A254 PolarHBondContact O-N 3.3Å; V252-A254 PolarHBondContact O-N 2.79Å; V252-A254 VanDerWaalsContact O-N 3.11Å; A254-N256 PolarHBondContact O-N 3.11Å; A254-M262 HydrophobicContact CB-CE 4.24Å; A254-M262 HydrophobicContact CB-CG 4.32Å; A254-M262 HydrophobicContact CB-SD 4.43Å; A254-A266 HydrophobicContact CB-CB 3.85Å
255	L	95.5	Very high	92.9	Very high	15 Å²	15	39.7 Å²	39.7	8%	0.079	19%	0.187	C	C	.	.			trans	-73	51.7	173.4	-66.1	174.7	0	0	0	113.1	V252 R253 M263 A266 A267 L270 P304 L305 L323	V252-L255 VanDerWaalsContact O-CB 3.24Å; V252-L255 WeakPolarHBondContact O-CB 3.49Å; V252-L255 WeakPolarHBondContact O-CG 3.26Å; V252-L255 PolarHBondContact O-N 3.33Å; R253-L255 VanDerWaalsContact C-N 3.32Å; L255-M263 HydrophobicContact CB-CE 4.38Å; L255-M263 HydrophobicContact CD2-CE 4.48Å; L255-M263 HydrophobicContact CD2-CG 4.22Å; L255-A266 HydrophobicContact CD2-CB 4.35Å; L255-A267 HydrophobicContact CD2-CB 3.81Å; L255-L270 HydrophobicContact CD1-CD1 3.79Å; L255-L270 HydrophobicContact CD2-CD1 4.06Å; L255-L270 HydrophobicContact CG-CD1 3.96Å; L255-P304 WeakPolarHBondContact O-CB 3.3Å; L255-L305 HydrophobicContact CD1-CD2 4.33Å; L255-L305 HydrophobicContact CD2-CD2 4.43Å; L255-L323 HydrophobicContact CD1-CD2 4.16Å; L255-L323 HydrophobicContact CD2-CD2 4.13Å
256	N	91.9	Very high	93.6	Very high	31 Å²	31	31.8 Å²	31.8	17%	0.166	15%	0.15	C	C	.	.			trans	-101	103.2	-173.8	-179.9	2	0	0	0	111.4	A254 K258 V259 M262	A254-N256 PolarHBondContact O-N 3.11Å; N256-K258 PolarHBondContact O-N 3.37Å; N256-K258 VanDerWaalsContact OD1-CB 3.28Å; N256-K258 WeakPolarHBondContact OD1-CB 3.49Å; N256-K258 PolarHBondContact OD1-N 2.89Å; N256-K258 VanDerWaalsContact OD1-N 3.11Å; N256-V259 CarbonylContact O-C 3.59Å; N256-V259 PolarHBondContact O-N 3.21Å; N256-M262 HydrophobicContact CB-CE 4.14Å
257	Y	91.1	Very high	94	Very high	88 Å²	88	29.8 Å²	29.8	35%	0.345	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58.6	-19.1	-179.4	67.5	-97.5	0	0	0	114.3	V259 P260 M263 D307	Y257-V259 PolarHBondContact O-N 2.95Å; Y257-P260 WeakPolarHBondContact O-CD 3.21Å; Y257-M263 WeakPolarHBondContact CA-SD 3.48Å; Y257-M263 PolarHBondContact N-SD 2.97Å; Y257-M263 VanDerWaalsContact N-SD 3.36Å; Y257-D307 HydrophobicContact CD1-CB 3.44Å; Y257-D307 VanDerWaalsContact CD1-CB 3.44Å; Y257-D307 HydrophobicContact CD2-CB 4.34Å; Y257-D307 HydrophobicContact CE1-CB 3.61Å; Y257-D307 WeakPolarHBondContact CE1-OD2 3.5Å; Y257-D307 HydrophobicContact CG-CB 3.81Å; Y257-D307 PolarHBondContact OH-OD2 2.92Å
258	K	88.9	Confident	94.3	Very high	142 Å²	142	31.1 Å²	31.1	62%	0.617	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-11.9	175.8	-55.7	168	-174.4	162	0	112	N256	N256-K258 PolarHBondContact O-N 3.37Å; N256-K258 VanDerWaalsContact OD1-CB 3.28Å; N256-K258 WeakPolarHBondContact OD1-CB 3.49Å; N256-K258 PolarHBondContact OD1-N 2.89Å; N256-K258 VanDerWaalsContact OD1-N 3.11Å
259	V	92.3	Very high	94.3	Very high	23 Å²	23	30.5 Å²	30.5	14%	0.139	14%	0.142	C	C	.	.	S	Bend	trans	-127.6	70.4	174.8	-167	0	0	0	0	109.3	Y218 N256 Y257 N261 M262 M263	Y218-V259 HydrophobicContact CD1-CG2 3.98Å; Y218-V259 HydrophobicContact CD2-CG2 3.73Å; Y218-V259 HydrophobicContact CE1-CG2 4.45Å; Y218-V259 HydrophobicContact CE2-CG2 4.2Å; Y218-V259 HydrophobicContact CG-CG2 3.61Å; N256-V259 CarbonylContact O-C 3.59Å; N256-V259 PolarHBondContact O-N 3.21Å; Y257-V259 PolarHBondContact O-N 2.95Å; V259-N261 PolarHBondContact O-N 2.93Å; V259-N261 VanDerWaalsContact O-N 3.12Å; V259-M262 HydrophobicContact CB-CB 4.15Å; V259-M262 HydrophobicContact CB-CE 4.2Å; V259-M262 HydrophobicContact CG1-CB 3.67Å; V259-M262 HydrophobicContact CG1-CE 4.46Å; V259-M262 HydrophobicContact CG2-CE 4.45Å; V259-M262 WeakPolarHBondContact O-CB 3.38Å; V259-M262 PolarHBondContact O-N 2.89Å; V259-M263 PolarHBondContact O-N 3.42Å; V259-M263 VanDerWaalsContact O-N 3.16Å
260	P	93	Very high	94.4	Very high	23 Å²	23	27.3 Å²	27.3	15%	0.149	13%	0.13	C	C	.	.	H	α-helix	trans	-49.9	-44.9	-166.7	-34.2	38.7	0	0	0	116.1	Y257 M262 M263 V264 Q313 L316	Y257-P260 WeakPolarHBondContact O-CD 3.21Å; P260-M262 VanDerWaalsContact C-N 3.31Å; P260-M262 PolarHBondContact O-N 3.27Å; P260-M263 PolarHBondContact O-N 3.12Å; P260-V264 WeakPolarHBondContact O-CG2 3.23Å; P260-V264 PolarHBondContact O-N 3.19Å; P260-Q313 VanDerWaalsContact CB-OE1 3.29Å; P260-L316 HydrophobicContact CB-CD2 3.99Å; P260-L316 HydrophobicContact CG-CD2 4.34Å
261	N	93.8	Very high	94.4	Very high	89 Å²	89	27.1 Å²	27.1	48%	0.476	13%	0.129	S	C	.	.	H	α-helix	trans	-67.1	-31.8	-177.8	-59.9	-32.1	0	0	0	112.7	H222 V259 D265	H222-N261 WeakPolarHBondContact CE1-CB 3.29Å; H222-N261 PolarHBondContact NE2-O 3.4Å; V259-N261 PolarHBondContact O-N 2.93Å; V259-N261 VanDerWaalsContact O-N 3.12Å; N261-D265 PolarHBondContact O-N 3.34Å; N261-D265 VanDerWaalsContact O-N 3.12Å
262	M	95	Very high	94.2	Very high	0 Å²	0	27.1 Å²	27.1	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-71.1	-42.2	175	-174.6	175	77.1	0	0	110.8	Q221 H222 I225 A254 N256 V259 P260 V264 D265 A266	Q221-M262 HydrophobicContact CB-SD 3.58Å; Q221-M262 VanDerWaalsContact CB-SD 3.58Å; H222-M262 HydrophobicContact CB-CB 3.9Å; H222-M262 HydrophobicContact CB-CG 4Å; H222-M262 HydrophobicContact CB-SD 4.11Å; H222-M262 VanDerWaalsContact CD2-CA 3.41Å; H222-M262 WeakPolarHBondContact CD2-CA 3.45Å; I225-M262 HydrophobicContact CG1-CG 4.13Å; A254-M262 HydrophobicContact CB-CE 4.24Å; A254-M262 HydrophobicContact CB-CG 4.32Å; A254-M262 HydrophobicContact CB-SD 4.43Å; N256-M262 HydrophobicContact CB-CE 4.14Å; V259-M262 HydrophobicContact CB-CB 4.15Å; V259-M262 HydrophobicContact CB-CE 4.2Å; V259-M262 HydrophobicContact CG1-CB 3.67Å; V259-M262 HydrophobicContact CG1-CE 4.46Å; V259-M262 HydrophobicContact CG2-CE 4.45Å; V259-M262 WeakPolarHBondContact O-CB 3.38Å; V259-M262 PolarHBondContact O-N 2.89Å; P260-M262 VanDerWaalsContact C-N 3.31Å; P260-M262 PolarHBondContact O-N 3.27Å; M262-V264 VanDerWaalsContact C-N 3.33Å; M262-V264 PolarHBondContact O-N 3.16Å; M262-D265 PolarHBondContact O-N 3.3Å; M262-A266 VanDerWaalsContact O-CB 3.25Å; M262-A266 WeakPolarHBondContact O-CB 3.44Å; M262-A266 PolarHBondContact O-N 3.37Å
263	M	96.1	Very high	94	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-66.1	-33.8	175.3	-176.5	173.9	-177.9	0	0	112.3	L255 Y257 V259 P260 A267 P304 L305 L316 C320	L255-M263 HydrophobicContact CB-CE 4.38Å; L255-M263 HydrophobicContact CD2-CE 4.48Å; L255-M263 HydrophobicContact CD2-CG 4.22Å; Y257-M263 WeakPolarHBondContact CA-SD 3.48Å; Y257-M263 PolarHBondContact N-SD 2.97Å; Y257-M263 VanDerWaalsContact N-SD 3.36Å; V259-M263 PolarHBondContact O-N 3.42Å; V259-M263 VanDerWaalsContact O-N 3.16Å; P260-M263 PolarHBondContact O-N 3.12Å; M263-A267 WeakPolarHBondContact O-CB 3.29Å; M263-A267 PolarHBondContact O-N 3.24Å; M263-P304 WeakPolarHBondContact CE-O 3.42Å; M263-L305 HydrophobicContact CE-CD2 3.76Å; M263-L316 HydrophobicContact CB-CD1 3.86Å; M263-L316 HydrophobicContact CG-CD1 3.65Å; M263-L316 HydrophobicContact SD-CD1 3.81Å; M263-L316 HydrophobicContact SD-CD2 4.43Å; M263-C320 VanDerWaalsContact CE-SG 3.57Å
264	V	95.6	Very high	93.9	Very high	19 Å²	19	23.5 Å²	23.5	12%	0.115	11%	0.114	C	C	.	.	H	α-helix	trans	-61.5	-54.5	170.7	168.9	0	0	0	0	110.8	P260 M262 A266 A267 K268 A315 L316	P260-V264 WeakPolarHBondContact O-CG2 3.23Å; P260-V264 PolarHBondContact O-N 3.19Å; M262-V264 VanDerWaalsContact C-N 3.33Å; M262-V264 PolarHBondContact O-N 3.16Å; V264-A266 VanDerWaalsContact C-N 3.34Å; V264-A266 PolarHBondContact O-N 3.49Å; V264-A267 PolarHBondContact O-N 2.64Å; V264-K268 WeakPolarHBondContact O-CB 3.32Å; V264-K268 WeakPolarHBondContact O-CG 3.35Å; V264-K268 PolarHBondContact O-N 3.07Å; V264-A315 HydrophobicContact CG2-CB 4.4Å; V264-A315 WeakPolarHBondContact CG2-O 3.48Å; V264-L316 HydrophobicContact CG2-CB 4.09Å; V264-L316 HydrophobicContact CG2-CD1 3.93Å
265	D	95.3	Very high	93.4	Very high	35 Å²	35	24.6 Å²	24.6	19%	0.187	12%	0.12	C	C	.	.	H	α-helix	trans	-61.3	-43.5	-179.1	-75.5	-32	0	0	0	110.7	H222 I225 R226 N261 M262 K268 L269	H222-D265 IonicContact CD2-OD2 3.97Å; H222-D265 IonicContact CE1-OD2 3.82Å; H222-D265 IonicContact NE2-OD2 2.93Å; H222-D265 PolarHBondContact NE2-OD2 3.41Å; I225-D265 HydrophobicContact CG2-CB 3.94Å; R226-D265 IonicContact CZ-OD2 2.98Å; R226-D265 IonicContact NE-OD2 3.3Å; R226-D265 PolarHBondContact NE-OD2 3.48Å; R226-D265 VanDerWaalsContact NE-OD2 3.09Å; R226-D265 IonicContact NH2-OD2 3.92Å; N261-D265 PolarHBondContact O-N 3.34Å; N261-D265 VanDerWaalsContact O-N 3.12Å; M262-D265 PolarHBondContact O-N 3.3Å; D265-K268 PolarHBondContact O-N 3.06Å; D265-L269 VanDerWaalsContact O-CG 3.29Å; D265-L269 WeakPolarHBondContact O-CG 3.47Å; D265-L269 PolarHBondContact O-N 3.29Å
266	A	96.8	Very high	92.9	Very high	0 Å²	0	24.3 Å²	24.3	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-65.7	-45.6	177.4	0	0	0	0	0	113.5	I225 A254 L255 M262 V264 K268 L269 L270	I225-A266 HydrophobicContact CG2-CB 4.44Å; A254-A266 HydrophobicContact CB-CB 3.85Å; L255-A266 HydrophobicContact CD2-CB 4.35Å; M262-A266 VanDerWaalsContact O-CB 3.25Å; M262-A266 WeakPolarHBondContact O-CB 3.44Å; M262-A266 PolarHBondContact O-N 3.37Å; V264-A266 VanDerWaalsContact C-N 3.34Å; V264-A266 PolarHBondContact O-N 3.49Å; A266-K268 VanDerWaalsContact C-N 3.32Å; A266-K268 PolarHBondContact O-N 3.31Å; A266-L269 PolarHBondContact O-N 2.92Å; A266-L270 WeakPolarHBondContact O-CG 3.31Å; A266-L270 PolarHBondContact O-N 2.87Å
267	A	96.6	Very high	92.1	Very high	0 Å²	0	26.8 Å²	26.8	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-65.1	-37.2	178.2	0	0	0	0	0	111.8	L255 M263 V264 S271 L323	L255-A267 HydrophobicContact CD2-CB 3.81Å; M263-A267 WeakPolarHBondContact O-CB 3.29Å; M263-A267 PolarHBondContact O-N 3.24Å; V264-A267 PolarHBondContact O-N 2.64Å; A267-S271 WeakPolarHBondContact O-CB 3.44Å; A267-S271 PolarHBondContact O-N 3.08Å; A267-S271 PolarHBondContact O-OG 3.11Å; A267-L323 HydrophobicContact CB-CB 4.26Å; A267-L323 HydrophobicContact CB-CD2 4.07Å
268	K	94.8	Very high	91.4	Very high	28 Å²	28	25 Å²	25	12%	0.122	13%	0.127	C	C	.	.	H	α-helix	trans	-66.5	-42.2	173.9	-74.5	-154.4	179.3	-135.2	0	112	V264 D265 A266 S271 A272 Q322 E363 L1149	V264-K268 WeakPolarHBondContact O-CB 3.32Å; V264-K268 WeakPolarHBondContact O-CG 3.35Å; V264-K268 PolarHBondContact O-N 3.07Å; D265-K268 PolarHBondContact O-N 3.06Å; A266-K268 VanDerWaalsContact C-N 3.32Å; A266-K268 PolarHBondContact O-N 3.31Å; K268-S271 WeakPolarHBondContact O-CB 3.38Å; K268-S271 PolarHBondContact O-N 3.44Å; K268-A272 PolarHBondContact O-N 3.37Å; K268-A272 VanDerWaalsContact O-N 3.16Å; K268-Q322 VanDerWaalsContact CE-OE1 3.24Å; K268-E363 IonicContact NZ-OE1 2.65Å; K268-E363 PolarHBondContact NZ-OE1 3.04Å; K268-L1149 HydrophobicContact CB-CD2 3.72Å; K268-L1149 VanDerWaalsContact O-CD2 3.26Å; K268-L1149 WeakPolarHBondContact O-CD2 3.4Å
269	L	94.9	Very high	90.5	Very high	1 Å²	1	23.1 Å²	23.1	1%	0.005	13%	0.128	C	C	.	.	H	α-helix	trans	-60.1	-48.1	173	-72	173.5	0	0	0	112.4	I225 K229 M232 L251 D265 A266 S271 A272 I273 M1145	I225-L269 HydrophobicContact CG2-CD1 3.77Å; K229-L269 HydrophobicContact CB-CD1 4.35Å; K229-L269 HydrophobicContact CB-CD2 3.85Å; K229-L269 HydrophobicContact CG-CD2 3.97Å; M232-L269 HydrophobicContact SD-CD2 4.34Å; L251-L269 HydrophobicContact CD1-CB 4.36Å; L251-L269 HydrophobicContact CD2-CD1 3.91Å; D265-L269 VanDerWaalsContact O-CG 3.29Å; D265-L269 WeakPolarHBondContact O-CG 3.47Å; D265-L269 PolarHBondContact O-N 3.29Å; A266-L269 PolarHBondContact O-N 2.92Å; L269-S271 VanDerWaalsContact C-N 3.34Å; L269-S271 PolarHBondContact O-N 3.44Å; L269-A272 PolarHBondContact O-N 3.01Å; L269-I273 WeakPolarHBondContact O-CG1 3.45Å; L269-I273 PolarHBondContact O-N 2.99Å; L269-M1145 HydrophobicContact CB-CE 4.36Å; L269-M1145 HydrophobicContact CD2-CE 3.45Å; L269-M1145 VanDerWaalsContact CD2-CE 3.45Å; L269-M1145 HydrophobicContact CD2-CG 4.4Å
270	L	95.8	Very high	89.6	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64.1	-38.3	178.4	-70.2	167.8	0	0	0	112	I248 L251 V252 L255 A266 A272 I273 C274 V286 L323	I248-L270 HydrophobicContact CG2-CD2 4.23Å; L251-L270 HydrophobicContact CB-CD1 4.45Å; L251-L270 HydrophobicContact CB-CD2 3.89Å; L251-L270 HydrophobicContact CB-CG 4.16Å; L251-L270 HydrophobicContact CD1-CD2 4.33Å; V252-L270 HydrophobicContact CG2-CD1 3.93Å; V252-L270 HydrophobicContact CG2-CD2 4.03Å; L255-L270 HydrophobicContact CD1-CD1 3.79Å; L255-L270 HydrophobicContact CD2-CD1 4.06Å; L255-L270 HydrophobicContact CG-CD1 3.96Å; A266-L270 WeakPolarHBondContact O-CG 3.31Å; A266-L270 PolarHBondContact O-N 2.87Å; L270-A272 VanDerWaalsContact C-N 3.28Å; L270-A272 PolarHBondContact O-N 3.42Å; L270-I273 HydrophobicContact CD2-CD1 4.37Å; L270-I273 PolarHBondContact O-N 3.22Å; L270-I273 VanDerWaalsContact O-N 3.17Å; L270-C274 PolarHBondContact O-N 3.24Å; L270-C274 PolarHBondContact O-SG 3.45Å; L270-V286 HydrophobicContact CD2-CG1 4.15Å; L270-V286 HydrophobicContact CD2-CG2 4.09Å; L270-L323 HydrophobicContact CB-CD1 3.87Å; L270-L323 HydrophobicContact CB-CD2 4.37Å; L270-L323 HydrophobicContact CD1-CD2 4.5Å
271	S	94.5	Very high	89.1	Confident	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-57.4	-42.6	174.3	-57.1	0	0	0	0	111.7	A267 K268 L269 I275 L323	A267-S271 WeakPolarHBondContact O-CB 3.44Å; A267-S271 PolarHBondContact O-N 3.08Å; A267-S271 PolarHBondContact O-OG 3.11Å; K268-S271 WeakPolarHBondContact O-CB 3.38Å; K268-S271 PolarHBondContact O-N 3.44Å; L269-S271 VanDerWaalsContact C-N 3.34Å; L269-S271 PolarHBondContact O-N 3.44Å; S271-I275 PolarHBondContact O-N 2.95Å; S271-L323 VanDerWaalsContact OG-CA 3.27Å; S271-L323 WeakPolarHBondContact OG-CA 3.49Å; S271-L323 PolarHBondContact OG-N 2.91Å
272	A	91.8	Very high	88.8	Confident	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-67.2	-43.1	176.1	0	0	0	0	0	111.8	K268 L269 L270 C274 I275 L276 M1145 L1148 L1149 L1152	K268-A272 PolarHBondContact O-N 3.37Å; K268-A272 VanDerWaalsContact O-N 3.16Å; L269-A272 PolarHBondContact O-N 3.01Å; L270-A272 VanDerWaalsContact C-N 3.28Å; L270-A272 PolarHBondContact O-N 3.42Å; A272-C274 VanDerWaalsContact C-N 3.31Å; A272-C274 PolarHBondContact O-N 3.43Å; A272-I275 VanDerWaalsContact O-CG1 3.26Å; A272-I275 WeakPolarHBondContact O-CG1 3.49Å; A272-I275 PolarHBondContact O-N 3.26Å; A272-I275 VanDerWaalsContact O-N 3.16Å; A272-L276 WeakPolarHBondContact O-CG 3.07Å; A272-L276 PolarHBondContact O-N 2.93Å; A272-L276 VanDerWaalsContact O-N 3.1Å; A272-M1145 HydrophobicContact CB-CE 3.5Å; A272-M1145 VanDerWaalsContact CB-CE 3.5Å; A272-M1145 HydrophobicContact CB-SD 3.83Å; A272-L1148 HydrophobicContact CB-CB 4.22Å; A272-L1149 HydrophobicContact CB-CD2 4.32Å; A272-L1152 HydrophobicContact CB-CD1 3.97Å
273	I	91.6	Very high	88.5	Confident	0 Å²	0	24 Å²	24	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-59.1	-39.8	176.1	-67.4	164.1	0	0	0	111.7	M232 L242 I248 L251 L269 L270 I275 L282 V286	M232-I273 HydrophobicContact CE-CD1 4.05Å; M232-I273 HydrophobicContact CE-CG1 3.96Å; L242-I273 HydrophobicContact CD2-CG2 4.2Å; I248-I273 HydrophobicContact CD1-CG2 4.21Å; L251-I273 HydrophobicContact CD1-CD1 3.57Å; L269-I273 WeakPolarHBondContact O-CG1 3.45Å; L269-I273 PolarHBondContact O-N 2.99Å; L270-I273 HydrophobicContact CD2-CD1 4.37Å; L270-I273 PolarHBondContact O-N 3.22Å; L270-I273 VanDerWaalsContact O-N 3.17Å; I273-I275 PolarHBondContact O-N 3.39Å; I273-L282 HydrophobicContact CG2-CB 4.03Å; I273-L282 HydrophobicContact CG2-CD1 4.44Å; I273-L282 WeakPolarHBondContact O-CB 3.31Å; I273-V286 HydrophobicContact CB-CG2 4.41Å; I273-V286 HydrophobicContact CG2-CG2 3.76Å
274	C	90.7	Very high	88.2	Confident	0 Å²	0	27.4 Å²	27.4	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-64.1	-36.4	176.3	-65.7	0	0	0	0	113.4	L270 A272 A326 R330	L270-C274 PolarHBondContact O-N 3.24Å; L270-C274 PolarHBondContact O-SG 3.45Å; A272-C274 VanDerWaalsContact C-N 3.31Å; A272-C274 PolarHBondContact O-N 3.43Å; C274-A326 HydrophobicContact CB-CB 4.02Å; C274-R330 WeakPolarHBondContact O-CG 3.3Å; C274-R330 PolarHBondContact O-NE 2.85Å
275	I	86.3	Confident	88	Confident	22 Å²	22	31.1 Å²	31.1	11%	0.113	16%	0.161	C	C	.	.	H	α-helix	trans	-87.8	-10.7	-178.1	65.7	158.4	0	0	0	114.5	S271 A272 I273 R330 L1148 L1152 A1157	S271-I275 PolarHBondContact O-N 2.95Å; A272-I275 VanDerWaalsContact O-CG1 3.26Å; A272-I275 WeakPolarHBondContact O-CG1 3.49Å; A272-I275 PolarHBondContact O-N 3.26Å; A272-I275 VanDerWaalsContact O-N 3.16Å; I273-I275 PolarHBondContact O-N 3.39Å; I275-R330 HydrophobicContact CG2-CG 4.14Å; I275-L1148 HydrophobicContact CD1-CB 4.42Å; I275-L1148 HydrophobicContact CD1-CD2 3.77Å; I275-L1148 HydrophobicContact CG1-CD2 4.28Å; I275-L1152 HydrophobicContact CD1-CD1 3.86Å; I275-L1152 HydrophobicContact CD1-CD2 3.77Å; I275-L1152 HydrophobicContact CD1-CG 3.64Å; I275-L1152 HydrophobicContact CG1-CD1 4.33Å; I275-L1152 HydrophobicContact CG1-CD2 4.29Å; I275-L1152 HydrophobicContact CG1-CG 4.47Å; I275-L1152 HydrophobicContact CG2-CD2 4.03Å; I275-A1157 HydrophobicContact CD1-CB 3.66Å
276	L	84.6	Confident	87.9	Confident	9 Å²	9	29.5 Å²	29.5	5%	0.047	15%	0.152	C	C	.	.	S	Bend	trans	-60	137.6	172	-78.3	177	0	0	0	110.7	I238 L242 A272 L282 R330 I1134 L1148	I238-L276 HydrophobicContact CG2-CD1 3.91Å; L242-L276 HydrophobicContact CD1-CD1 4.24Å; A272-L276 WeakPolarHBondContact O-CG 3.07Å; A272-L276 PolarHBondContact O-N 2.93Å; A272-L276 VanDerWaalsContact O-N 3.1Å; L276-L282 HydrophobicContact CB-CD1 3.93Å; L276-L282 HydrophobicContact CD1-CD1 4.21Å; L276-R330 PolarHBondContact O-NH2 3.13Å; L276-I1134 HydrophobicContact CB-CD1 4.07Å; L276-I1134 HydrophobicContact CD2-CD1 3.78Å; L276-I1134 HydrophobicContact CD2-CG1 4.49Å; L276-I1134 HydrophobicContact CG-CD1 4.36Å; L276-L1148 HydrophobicContact CD2-CD1 3.4Å; L276-L1148 VanDerWaalsContact CD2-CD1 3.4Å; L276-L1148 HydrophobicContact CG-CD1 4.19Å
277	D	74	Confident	87.7	Confident	84 Å²	84	29.8 Å²	29.8	45%	0.449	15%	0.154	S	C	.	.			trans	-94.1	106.5	176.4	-124.3	24.8	0	0	0	109.6	R330 I1134	D277-R330 IonicContact OD1-CZ 2.67Å; D277-R330 IonicContact OD1-NH1 2.72Å; D277-R330 PolarHBondContact OD1-NH1 2.84Å; D277-R330 VanDerWaalsContact OD1-NH1 3.12Å; D277-R330 IonicContact OD1-NH2 2.88Å; D277-R330 PolarHBondContact OD1-NH2 3.38Å; D277-I1134 WeakPolarHBondContact O-CD1 3.46Å; D277-I1134 WeakPolarHBondContact O-CG1 3.41Å
278	H	76.4	Confident	87.6	Confident	51 Å²	51	35.5 Å²	35.5	24%	0.236	18%	0.181	C	C	.	.			trans	-151.6	140.2	-166.8	-176.3	-84.3	0	0	0	110.4	D280 N281 L282 I1134	H278-D280 VanDerWaalsContact C-N 3.34Å; H278-D280 IonicContact CE1-OD1 2.71Å; H278-D280 IonicContact CE1-OD2 3.22Å; H278-D280 PolarHBondContact ND1-N 2.87Å; H278-D280 PolarHBondContact O-N 3.49Å; H278-N281 PolarHBondContact O-N 2.83Å; H278-L282 HydrophobicContact CB-CD1 3.54Å; H278-L282 HydrophobicContact CB-CG 3.83Å; H278-I1134 HydrophobicContact CB-CD1 4.3Å
279	P	69.9	Low	87.6	Confident	101 Å²	101	34.4 Å²	34.4	66%	0.656	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-37.4	-171.5	20.2	-33.7	0	0	0	114.8	N281	P279-N281 PolarHBondContact O-N 3.08Å
280	D	75.2	Confident	87.6	Confident	77 Å²	77	34.9 Å²	34.9	41%	0.412	18%	0.179	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.8	16.7	-178	-63.3	15.5	0	0	0	115.4	H278 L282 R285	H278-D280 VanDerWaalsContact C-N 3.34Å; H278-D280 IonicContact CE1-OD1 2.71Å; H278-D280 IonicContact CE1-OD2 3.22Å; H278-D280 PolarHBondContact ND1-N 2.87Å; H278-D280 PolarHBondContact O-N 3.49Å; D280-L282 HydrophobicContact CB-CD2 4.43Å; D280-L282 PolarHBondContact O-N 3.32Å; D280-R285 IonicContact OD2-CZ 3.05Å; D280-R285 VanDerWaalsContact OD2-CZ 3.32Å; D280-R285 IonicContact OD2-NH1 3.96Å; D280-R285 PolarHBondContact OD2-NH1 3.3Å; D280-R285 IonicContact OD2-NH2 3.46Å; D280-R285 PolarHBondContact OD2-NH2 3.04Å
281	N	81.2	Confident	87.6	Confident	73 Å²	73	36.7 Å²	36.7	39%	0.39	19%	0.19	S	C	.	.			trans	35.7	71.5	-173.4	-167.6	9.1	0	0	0	114.4	H278 P279 H283 D284 R285	H278-N281 PolarHBondContact O-N 2.83Å; P279-N281 PolarHBondContact O-N 3.08Å; N281-H283 PolarHBondContact O-N 3.3Å; N281-D284 PolarHBondContact ND2-OD1 3.02Å; N281-D284 PolarHBondContact ND2-OD2 3.21Å; N281-D284 PolarHBondContact O-N 3.45Å; N281-R285 PolarHBondContact O-N 2.95Å
282	L	87.8	Confident	87.6	Confident	2 Å²	2	39.1 Å²	39.1	1%	0.01	20%	0.202	C	C	.	.	H	α-helix	trans	-60	-24.4	-171.4	-59.5	174.9	0	0	0	114.5	L242 I273 L276 H278 D280 R285 V286	L242-L282 HydrophobicContact CD1-CD1 3.52Å; L242-L282 HydrophobicContact CD1-CD2 4.33Å; L242-L282 HydrophobicContact CD2-CD1 3.92Å; L242-L282 HydrophobicContact CD2-CD2 3.95Å; L242-L282 HydrophobicContact CG-CD1 4.35Å; I273-L282 HydrophobicContact CG2-CB 4.03Å; I273-L282 HydrophobicContact CG2-CD1 4.44Å; I273-L282 WeakPolarHBondContact O-CB 3.31Å; L276-L282 HydrophobicContact CB-CD1 3.93Å; L276-L282 HydrophobicContact CD1-CD1 4.21Å; H278-L282 HydrophobicContact CB-CD1 3.54Å; H278-L282 HydrophobicContact CB-CG 3.83Å; D280-L282 HydrophobicContact CB-CD2 4.43Å; D280-L282 PolarHBondContact O-N 3.32Å; L282-R285 PolarHBondContact O-N 3.44Å; L282-V286 WeakPolarHBondContact O-CG2 3.26Å; L282-V286 PolarHBondContact O-N 3.32Å
283	H	89.1	Confident	87.7	Confident	2 Å²	2	40.1 Å²	40.1	1%	0.009	21%	0.207	C	C	.	.	H	α-helix	trans	-57.2	-49.1	172.2	168.5	-94.3	0	0	0	111.6	N281 V286 L287 L327 R330	N281-H283 PolarHBondContact O-N 3.3Å; H283-V286 PolarHBondContact O-N 3.3Å; H283-L287 WeakPolarHBondContact CE1-CD1 3.33Å; H283-L287 PolarHBondContact O-N 2.99Å; H283-L287 VanDerWaalsContact O-N 3.08Å; H283-L327 PolarHBondContact NE2-O 3.45Å; H283-L327 VanDerWaalsContact NE2-O 3.15Å; H283-R330 HydrophobicContact CB-CB 4.22Å
284	D	88.9	Confident	87.7	Confident	72 Å²	72	40.7 Å²	40.7	39%	0.385	21%	0.211	S	C	.	.	H	α-helix	trans	-70.1	-37.4	-177.1	-67.1	6.4	0	0	0	110.6	N281 V286 L287 E288	N281-D284 PolarHBondContact ND2-OD1 3.02Å; N281-D284 PolarHBondContact ND2-OD2 3.21Å; N281-D284 PolarHBondContact O-N 3.45Å; D284-V286 VanDerWaalsContact C-N 3.29Å; D284-V286 PolarHBondContact O-N 2.83Å; D284-L287 PolarHBondContact O-N 3.11Å; D284-L287 VanDerWaalsContact O-N 3.15Å; D284-E288 WeakPolarHBondContact O-CB 3.45Å; D284-E288 PolarHBondContact O-N 2.98Å
285	R	90.9	Very high	87.9	Confident	97 Å²	97	47.8 Å²	47.8	37%	0.366	24%	0.244	S	C	.	.	H	α-helix	trans	-60.4	-34.1	171.2	-81.8	-174.9	162.9	162.6	8.2	113.5	I248 D280 N281 L282 A289	I248-R285 HydrophobicContact CD1-CB 4.09Å; D280-R285 IonicContact OD2-CZ 3.05Å; D280-R285 VanDerWaalsContact OD2-CZ 3.32Å; D280-R285 IonicContact OD2-NH1 3.96Å; D280-R285 PolarHBondContact OD2-NH1 3.3Å; D280-R285 IonicContact OD2-NH2 3.46Å; D280-R285 PolarHBondContact OD2-NH2 3.04Å; N281-R285 PolarHBondContact O-N 2.95Å; L282-R285 PolarHBondContact O-N 3.44Å; R285-A289 VanDerWaalsContact O-CB 3.28Å; R285-A289 WeakPolarHBondContact O-CB 3.43Å; R285-A289 PolarHBondContact O-N 3.04Å
286	V	94.1	Very high	88	Confident	0 Å²	0	52.1 Å²	52.1	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-70.7	-42	173.4	173	0	0	0	0	110.7	I248 L270 I273 L282 H283 D284 A289 I290 L327	I248-V286 HydrophobicContact CG2-CB 4.49Å; I248-V286 HydrophobicContact CG2-CG2 3.82Å; L270-V286 HydrophobicContact CD2-CG1 4.15Å; L270-V286 HydrophobicContact CD2-CG2 4.09Å; I273-V286 HydrophobicContact CB-CG2 4.41Å; I273-V286 HydrophobicContact CG2-CG2 3.76Å; L282-V286 WeakPolarHBondContact O-CG2 3.26Å; L282-V286 PolarHBondContact O-N 3.32Å; H283-V286 PolarHBondContact O-N 3.3Å; D284-V286 VanDerWaalsContact C-N 3.29Å; D284-V286 PolarHBondContact O-N 2.83Å; V286-A289 PolarHBondContact O-N 3.02Å; V286-I290 HydrophobicContact CG1-CD1 3.76Å; V286-I290 HydrophobicContact CG1-CG1 4.42Å; V286-I290 WeakPolarHBondContact O-CB 3.32Å; V286-I290 VanDerWaalsContact O-CG1 3.23Å; V286-I290 WeakPolarHBondContact O-CG1 3.41Å; V286-I290 PolarHBondContact O-N 3.09Å; V286-L327 HydrophobicContact CG1-CD2 4.04Å
287	L	93.4	Very high	88.2	Confident	7 Å²	7	57.4 Å²	57.4	4%	0.037	29%	0.287	C	S	.	.	H	α-helix	trans	-64.8	-39.8	175.3	-77.1	175.1	0	0	0	112.9	H283 D284 I290 T291 F302 L327 F336 I340	H283-L287 WeakPolarHBondContact CE1-CD1 3.33Å; H283-L287 PolarHBondContact O-N 2.99Å; H283-L287 VanDerWaalsContact O-N 3.08Å; D284-L287 PolarHBondContact O-N 3.11Å; D284-L287 VanDerWaalsContact O-N 3.15Å; L287-I290 PolarHBondContact O-N 2.88Å; L287-T291 WeakPolarHBondContact O-CB 3.31Å; L287-T291 PolarHBondContact O-N 3.01Å; L287-T291 PolarHBondContact O-OG1 3.37Å; L287-F302 HydrophobicContact CD2-CE1 4.03Å; L287-F302 HydrophobicContact CD2-CZ 3.87Å; L287-L327 HydrophobicContact CD2-CD1 4.46Å; L287-L327 HydrophobicContact CD2-CD2 3.84Å; L287-L327 HydrophobicContact CG-CD2 4Å; L287-F336 HydrophobicContact CD1-CE1 4.01Å; L287-F336 HydrophobicContact CD1-CZ 3.87Å; L287-I340 HydrophobicContact CD2-CD1 4.48Å
288	E	93.3	Very high	89	Confident	120 Å²	120	61.3 Å²	61.3	56%	0.561	31%	0.308	S	S	*	.	H	α-helix	trans	-61.5	-50.8	174	-177.5	174.9	-137.9	0	0	110.3	D284 I290 T291 E292	D284-E288 WeakPolarHBondContact O-CB 3.45Å; D284-E288 PolarHBondContact O-N 2.98Å; E288-I290 VanDerWaalsContact C-N 3.34Å; E288-I290 PolarHBondContact O-N 3.05Å; E288-T291 CarbonylContact O-C 3.59Å; E288-T291 PolarHBondContact O-N 3.4Å; E288-E292 WeakPolarHBondContact O-CB 3.48Å; E288-E292 PolarHBondContact O-N 3.1Å
289	A	95	Very high	89.7	Confident	5 Å²	5	61.3 Å²	61.3	4%	0.041	32%	0.316	C	S	.	.	H	α-helix	trans	-60.9	-38.5	176.8	0	0	0	0	0	113.4	I248 R249 V252 R285 V286 T291 E293	I248-A289 HydrophobicContact CG2-CB 3.93Å; R249-A289 HydrophobicContact CG-CB 3.93Å; V252-A289 HydrophobicContact CB-CB 4.45Å; V252-A289 HydrophobicContact CG2-CB 3.86Å; R285-A289 VanDerWaalsContact O-CB 3.28Å; R285-A289 WeakPolarHBondContact O-CB 3.43Å; R285-A289 PolarHBondContact O-N 3.04Å; V286-A289 PolarHBondContact O-N 3.02Å; A289-T291 VanDerWaalsContact C-N 3.34Å; A289-E293 WeakPolarHBondContact O-CB 3.25Å; A289-E293 PolarHBondContact O-N 2.98Å; A289-E293 VanDerWaalsContact O-N 3.16Å
290	I	95.9	Very high	90.8	Very high	10 Å²	10	61.7 Å²	61.7	5%	0.051	31%	0.309	C	S	.	.	H	α-helix	trans	-63.3	-39.7	173	-74.4	169.5	0	0	0	111	V252 V286 L287 E288 A294 R301 F302 L327	V252-I290 HydrophobicContact CG1-CB 4.45Å; V252-I290 HydrophobicContact CG1-CG1 3.87Å; V252-I290 HydrophobicContact CG2-CG1 3.81Å; V286-I290 HydrophobicContact CG1-CD1 3.76Å; V286-I290 HydrophobicContact CG1-CG1 4.42Å; V286-I290 WeakPolarHBondContact O-CB 3.32Å; V286-I290 VanDerWaalsContact O-CG1 3.23Å; V286-I290 WeakPolarHBondContact O-CG1 3.41Å; V286-I290 PolarHBondContact O-N 3.09Å; L287-I290 PolarHBondContact O-N 2.88Å; E288-I290 VanDerWaalsContact C-N 3.34Å; E288-I290 PolarHBondContact O-N 3.05Å; I290-A294 WeakPolarHBondContact O-CB 3.3Å; I290-A294 PolarHBondContact O-N 3.38Å; I290-R301 HydrophobicContact CG2-CB 4.08Å; I290-R301 WeakPolarHBondContact CG2-O 2.82Å; I290-F302 HydrophobicContact CG2-CD1 4.22Å; I290-F302 HydrophobicContact CG2-CE1 4.11Å; I290-L327 HydrophobicContact CD1-CD1 4.04Å; I290-L327 HydrophobicContact CD1-CD2 4.5Å
291	T	95	Very high	91.7	Very high	38 Å²	38	60.3 Å²	60.3	23%	0.233	30%	0.299	C	S	.	.	H	α-helix	trans	-73.4	-47.6	179.6	-51.3	0	0	0	0	111.1	L287 E288 A289 E293 A294 E295 R301	L287-T291 WeakPolarHBondContact O-CB 3.31Å; L287-T291 PolarHBondContact O-N 3.01Å; L287-T291 PolarHBondContact O-OG1 3.37Å; E288-T291 CarbonylContact O-C 3.59Å; E288-T291 PolarHBondContact O-N 3.4Å; A289-T291 VanDerWaalsContact C-N 3.34Å; T291-E293 VanDerWaalsContact C-N 3.29Å; T291-E293 PolarHBondContact O-N 3.05Å; T291-A294 WeakPolarHBondContact O-CB 3.4Å; T291-A294 PolarHBondContact O-N 2.93Å; T291-A294 VanDerWaalsContact O-N 3.16Å; T291-E295 WeakPolarHBondContact O-CG 3.28Å; T291-E295 PolarHBondContact O-N 2.84Å; T291-R301 WeakPolarHBondContact OG1-CD 3.17Å; T291-R301 PolarHBondContact OG1-NH1 3.46Å; T291-R301 VanDerWaalsContact OG1-NH1 3.14Å
292	E	94.4	Very high	92.4	Very high	52 Å²	52	56.9 Å²	56.9	24%	0.243	28%	0.28	C	S	.	.	H	α-helix	trans	-49.2	-47.1	173.2	-93.9	-159.3	-144.8	0	0	112.2	R249 E288 K296	R249-E292 WeakPolarHBondContact CD-OE1 3.5Å; R249-E292 WeakPolarHBondContact CD-OE2 3.35Å; R249-E292 IonicContact NH1-OE1 3.73Å; R249-E292 PolarHBondContact NH1-OE1 3.13Å; R249-E292 IonicContact NH1-OE2 3.9Å; E288-E292 WeakPolarHBondContact O-CB 3.48Å; E288-E292 PolarHBondContact O-N 3.1Å; E292-K296 VanDerWaalsContact O-CD 3.31Å; E292-K296 WeakPolarHBondContact O-CD 3.32Å; E292-K296 VanDerWaalsContact O-CE 3.22Å; E292-K296 WeakPolarHBondContact O-CE 3.44Å; E292-K296 WeakPolarHBondContact O-CG 3.29Å; E292-K296 PolarHBondContact O-N 3.47Å; E292-K296 IonicContact OE2-NZ 3.76Å; E292-K296 PolarHBondContact OE2-NZ 3.32Å
293	E	93.1	Very high	92.8	Very high	21 Å²	21	59.5 Å²	59.5	10%	0.098	29%	0.292	C	S	.	.	H	α-helix	trans	-78.5	-25.8	-174.7	-170.6	56	-150	0	0	112.6	V252 R253 A289 T291 K296 Q297	V252-E293 HydrophobicContact CG1-CB 4.14Å; R253-E293 HydrophobicContact CG-CG 3.76Å; R253-E293 IonicContact CZ-OE1 3.41Å; R253-E293 IonicContact CZ-OE2 3.92Å; R253-E293 VanDerWaalsContact CZ-OE2 3.3Å; R253-E293 IonicContact NE-OE1 3.93Å; R253-E293 IonicContact NE-OE2 2.69Å; R253-E293 PolarHBondContact NE-OE2 2.87Å; R253-E293 IonicContact NH2-OE1 3.23Å; R253-E293 IonicContact NH2-OE2 3.27Å; R253-E293 PolarHBondContact NH2-OE2 3.18Å; A289-E293 WeakPolarHBondContact O-CB 3.25Å; A289-E293 PolarHBondContact O-N 2.98Å; A289-E293 VanDerWaalsContact O-N 3.16Å; T291-E293 VanDerWaalsContact C-N 3.29Å; T291-E293 PolarHBondContact O-N 3.05Å; E293-K296 WeakPolarHBondContact OE2-CD 3.35Å; E293-K296 IonicContact OE2-NZ 3.62Å; E293-Q297 WeakPolarHBondContact O-CG 3.06Å; E293-Q297 PolarHBondContact O-N 3.26Å; E293-Q297 PolarHBondContact OE1-NE2 3.49Å
294	A	93.3	Very high	93	Very high	12 Å²	12	61.4 Å²	61.4	10%	0.099	31%	0.305	C	S	.	.	H	α-helix	trans	-70.5	-43.3	172	0	0	0	0	0	112.1	I290 T291 K296 Q297 D298 A299 R301	I290-A294 WeakPolarHBondContact O-CB 3.3Å; I290-A294 PolarHBondContact O-N 3.38Å; T291-A294 WeakPolarHBondContact O-CB 3.4Å; T291-A294 PolarHBondContact O-N 2.93Å; T291-A294 VanDerWaalsContact O-N 3.16Å; A294-K296 VanDerWaalsContact C-N 3.32Å; A294-K296 PolarHBondContact O-N 2.93Å; A294-Q297 CarbonylContact O-C 3.46Å; A294-Q297 PolarHBondContact O-N 3.28Å; A294-D298 PolarHBondContact O-N 2.93Å; A294-A299 WeakPolarHBondContact CB-O 3.48Å; A294-A299 PolarHBondContact O-N 3.42Å; A294-A299 VanDerWaalsContact O-N 3.12Å; A294-R301 VanDerWaalsContact CB-CA 3.44Å; A294-R301 HydrophobicContact CB-CB 3.61Å
295	E	93.1	Very high	93.3	Very high	148 Å²	148	58.2 Å²	58.2	69%	0.692	29%	0.288	S	S	*	.	H	α-helix	trans	-59.6	-41.7	173.5	-70.9	-179.5	170.2	0	0	111.7	T291 Q297 D298	T291-E295 WeakPolarHBondContact O-CG 3.28Å; T291-E295 PolarHBondContact O-N 2.84Å; E295-Q297 PolarHBondContact O-N 3.03Å; E295-D298 PolarHBondContact O-N 3.17Å
296	K	90.1	Very high	93.5	Very high	113 Å²	113	53.6 Å²	53.6	49%	0.491	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.9	-15.1	174.9	-68.7	163.3	-154	161.4	0	113.9	E292 E293 A294	E292-K296 VanDerWaalsContact O-CD 3.31Å; E292-K296 WeakPolarHBondContact O-CD 3.32Å; E292-K296 VanDerWaalsContact O-CE 3.22Å; E292-K296 WeakPolarHBondContact O-CE 3.44Å; E292-K296 WeakPolarHBondContact O-CG 3.29Å; E292-K296 PolarHBondContact O-N 3.47Å; E292-K296 IonicContact OE2-NZ 3.76Å; E292-K296 PolarHBondContact OE2-NZ 3.32Å; E293-K296 WeakPolarHBondContact OE2-CD 3.35Å; E293-K296 IonicContact OE2-NZ 3.62Å; A294-K296 VanDerWaalsContact C-N 3.32Å; A294-K296 PolarHBondContact O-N 2.93Å
297	Q	87.2	Confident	93.5	Very high	120 Å²	120	55.4 Å²	55.4	56%	0.561	28%	0.28	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	0.7	-180	-66.7	-176.2	37.1	0	0	113.6	E293 A294 E295 A299	E293-Q297 WeakPolarHBondContact O-CG 3.06Å; E293-Q297 PolarHBondContact O-N 3.26Å; E293-Q297 PolarHBondContact OE1-NE2 3.49Å; A294-Q297 CarbonylContact O-C 3.46Å; A294-Q297 PolarHBondContact O-N 3.28Å; E295-Q297 PolarHBondContact O-N 3.03Å; Q297-A299 VanDerWaalsContact C-N 3.33Å; Q297-A299 HydrophobicContact CB-CB 4.27Å; Q297-A299 PolarHBondContact O-N 3.08Å
298	D	91.3	Very high	93.4	Very high	166 Å²	166	55 Å²	55	89%	0.888	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.8	47.7	-173.9	-162.3	30.2	0	0	0	112.1	A294 E295	A294-D298 PolarHBondContact O-N 2.93Å; E295-D298 PolarHBondContact O-N 3.17Å
299	A	91.4	Very high	93.3	Very high	51 Å²	51	49.4 Å²	49.4	42%	0.421	25%	0.252	S	S	.	.	S	Bend	trans	-135.9	157.4	-169.9	0	0	0	0	0	113.6	A294 Q297	A294-A299 WeakPolarHBondContact CB-O 3.48Å; A294-A299 PolarHBondContact O-N 3.42Å; A294-A299 VanDerWaalsContact O-N 3.12Å; Q297-A299 VanDerWaalsContact C-N 3.33Å; Q297-A299 HydrophobicContact CB-CB 4.27Å; Q297-A299 PolarHBondContact O-N 3.08Å
300	E	92.9	Very high	93.1	Very high	109 Å²	109	54.3 Å²	54.3	51%	0.509	27%	0.274	S	S	.	.			trans	-70.4	129.5	173.7	-65.5	-82.3	-159.8	0	0	110.5	F302 Q303 L347	E300-F302 VanDerWaalsContact C-N 3.34Å; E300-F302 PolarHBondContact O-N 3.2Å; E300-F302 VanDerWaalsContact O-N 3.15Å; E300-Q303 HydrophobicContact CB-CB 4.29Å; E300-Q303 WeakPolarHBondContact O-CB 3.3Å; E300-Q303 PolarHBondContact O-N 2.8Å; E300-L347 HydrophobicContact CB-CD1 4.45Å; E300-L347 HydrophobicContact CB-CD2 3.72Å; E300-L347 HydrophobicContact CG-CD2 3.8Å
301	R	94.9	Very high	92.8	Very high	49 Å²	49	55.1 Å²	55.1	19%	0.185	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-28.8	-161.2	68.3	178.3	174.2	170.9	-1.5	116.9	I290 T291 A294 E343	I290-R301 HydrophobicContact CG2-CB 4.08Å; I290-R301 WeakPolarHBondContact CG2-O 2.82Å; T291-R301 WeakPolarHBondContact OG1-CD 3.17Å; T291-R301 PolarHBondContact OG1-NH1 3.46Å; T291-R301 VanDerWaalsContact OG1-NH1 3.14Å; A294-R301 VanDerWaalsContact CB-CA 3.44Å; A294-R301 HydrophobicContact CB-CB 3.61Å; R301-E343 WeakPolarHBondContact CG-OE1 3.46Å; R301-E343 IonicContact CZ-OE1 3.59Å; R301-E343 IonicContact CZ-OE2 2.7Å; R301-E343 IonicContact NE-OE1 3.77Å; R301-E343 PolarHBondContact NE-OE1 3.45Å; R301-E343 IonicContact NE-OE2 2.57Å; R301-E343 PolarHBondContact NE-OE2 3.49Å; R301-E343 IonicContact NH2-OE1 2.67Å; R301-E343 IonicContact NH2-OE2 3.72Å; R301-E343 PolarHBondContact NH2-OE2 2.89Å
302	F	96.3	Very high	92.4	Very high	1 Å²	1	61 Å²	61	0%	0.004	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.1	1.5	175.3	-56.9	-55	0	0	0	113.9	L287 I290 E300 P304 L305 I306 L327 I340 E343 L344 L347	L287-F302 HydrophobicContact CD2-CE1 4.03Å; L287-F302 HydrophobicContact CD2-CZ 3.87Å; I290-F302 HydrophobicContact CG2-CD1 4.22Å; I290-F302 HydrophobicContact CG2-CE1 4.11Å; E300-F302 VanDerWaalsContact C-N 3.34Å; E300-F302 PolarHBondContact O-N 3.2Å; E300-F302 VanDerWaalsContact O-N 3.15Å; F302-P304 VanDerWaalsContact C-CD 3.43Å; F302-P304 VanDerWaalsContact C-N 3.35Å; F302-L305 HydrophobicContact CD1-CD1 4.15Å; F302-L305 WeakPolarHBondContact O-CB 3.46Å; F302-L305 PolarHBondContact O-N 3.18Å; F302-I306 PolarHBondContact O-N 3.31Å; F302-L327 HydrophobicContact CE1-CD1 4.09Å; F302-I340 HydrophobicContact CE2-CD1 4.27Å; F302-I340 HydrophobicContact CE2-CG2 4.32Å; F302-I340 HydrophobicContact CZ-CD1 4.12Å; F302-I340 HydrophobicContact CZ-CG2 4.27Å; F302-E343 HydrophobicContact CD2-CG 4.17Å; F302-E343 VanDerWaalsContact CD2-OE1 3.27Å; F302-E343 WeakPolarHBondContact CD2-OE1 3.3Å; F302-E343 VanDerWaalsContact CE2-CD 3.47Å; F302-E343 HydrophobicContact CE2-CG 4.3Å; F302-E343 VanDerWaalsContact CE2-OE1 3.27Å; F302-E343 WeakPolarHBondContact CE2-OE1 3.39Å; F302-L344 HydrophobicContact CB-CD2 3.51Å; F302-L344 HydrophobicContact CD1-CD2 4.38Å; F302-L344 HydrophobicContact CD2-CD2 3.82Å; F302-L344 HydrophobicContact CD2-CG 3.96Å; F302-L344 HydrophobicContact CE2-CG 4.45Å; F302-L344 HydrophobicContact CG-CD2 3.65Å; F302-L344 HydrophobicContact CG-CG 4.3Å; F302-L347 HydrophobicContact CB-CD1 3.89Å; F302-L347 HydrophobicContact CD2-CD1 4.45Å
303	Q	94.2	Very high	92.3	Very high	57 Å²	57	62.3 Å²	62.3	27%	0.266	32%	0.317	S	S	.	.	H	α-helix	trans	-53.9	-40.6	-178.7	-167.8	63.2	48.7	0	0	113.8	E300 L305 I306 D307	E300-Q303 HydrophobicContact CB-CB 4.29Å; E300-Q303 WeakPolarHBondContact O-CB 3.3Å; E300-Q303 PolarHBondContact O-N 2.8Å; Q303-L305 PolarHBondContact O-N 3.33Å; Q303-I306 PolarHBondContact O-N 2.84Å; Q303-I306 VanDerWaalsContact O-N 3.12Å; Q303-D307 PolarHBondContact NE2-OD1 3.44Å; Q303-D307 PolarHBondContact O-N 2.8Å
304	P	93.8	Very high	92.2	Very high	42 Å²	42	64.6 Å²	64.6	27%	0.273	33%	0.329	S	S	.	.	H	α-helix	trans	-60	-32.6	177	-24	34.9	0	0	0	113.3	L255 M263 F302 G308	L255-P304 WeakPolarHBondContact O-CB 3.3Å; M263-P304 WeakPolarHBondContact CE-O 3.42Å; F302-P304 VanDerWaalsContact C-CD 3.43Å; F302-P304 VanDerWaalsContact C-N 3.35Å; P304-G308 PolarHBondContact O-N 3.47Å
305	L	95.9	Very high	92.1	Very high	4 Å²	4	66.5 Å²	66.5	2%	0.021	34%	0.344	C	S	.	.	H	α-helix	trans	-72.2	-40.4	176.3	-53.3	-177.2	0	0	0	111.3	L255 M263 F302 Q303 G308 M309 L323 I324	L255-L305 HydrophobicContact CD1-CD2 4.33Å; L255-L305 HydrophobicContact CD2-CD2 4.43Å; M263-L305 HydrophobicContact CE-CD2 3.76Å; F302-L305 HydrophobicContact CD1-CD1 4.15Å; F302-L305 WeakPolarHBondContact O-CB 3.46Å; F302-L305 PolarHBondContact O-N 3.18Å; Q303-L305 PolarHBondContact O-N 3.33Å; L305-G308 PolarHBondContact O-N 3.15Å; L305-M309 VanDerWaalsContact O-CG 3.27Å; L305-M309 WeakPolarHBondContact O-CG 3.45Å; L305-M309 PolarHBondContact O-N 3.05Å; L305-L323 HydrophobicContact CD1-CD2 4.35Å; L305-L323 HydrophobicContact CD2-CD2 3.93Å; L305-I324 HydrophobicContact CD1-CG1 4.16Å
306	I	94.8	Very high	92.2	Very high	1 Å²	1	59.4 Å²	59.4	1%	0.005	31%	0.311	C	S	.	.	H	α-helix	trans	-66.5	-42.9	176.2	-55.8	-55.9	0	0	0	111	F302 Q303 G308 M309 Q310 L344 L347 L349	F302-I306 PolarHBondContact O-N 3.31Å; Q303-I306 PolarHBondContact O-N 2.84Å; Q303-I306 VanDerWaalsContact O-N 3.12Å; I306-G308 VanDerWaalsContact C-N 3.31Å; I306-G308 PolarHBondContact O-N 3.1Å; I306-M309 WeakPolarHBondContact O-CB 3.38Å; I306-M309 PolarHBondContact O-N 3.04Å; I306-M309 VanDerWaalsContact O-N 3.15Å; I306-Q310 PolarHBondContact O-N 3.08Å; I306-L344 HydrophobicContact CD1-CD2 4.28Å; I306-L347 HydrophobicContact CG1-CB 4.07Å; I306-L349 HydrophobicContact CD1-CB 3.95Å; I306-L349 HydrophobicContact CD1-CD1 4.43Å
307	D	93.4	Very high	92.4	Very high	37 Å²	37	55.4 Å²	55.4	20%	0.198	29%	0.294	C	S	.	.	H	α-helix	trans	-61.5	-40.1	173	-72	5.1	0	0	0	111	Y257 Q303 M309 Q310	Y257-D307 HydrophobicContact CD1-CB 3.44Å; Y257-D307 VanDerWaalsContact CD1-CB 3.44Å; Y257-D307 HydrophobicContact CD2-CB 4.34Å; Y257-D307 HydrophobicContact CE1-CB 3.61Å; Y257-D307 WeakPolarHBondContact CE1-OD2 3.5Å; Y257-D307 HydrophobicContact CG-CB 3.81Å; Y257-D307 PolarHBondContact OH-OD2 2.92Å; Q303-D307 PolarHBondContact NE2-OD1 3.44Å; Q303-D307 PolarHBondContact O-N 2.8Å; D307-M309 VanDerWaalsContact C-N 3.33Å; D307-M309 PolarHBondContact O-N 3.47Å; D307-Q310 WeakPolarHBondContact O-CB 3.45Å; D307-Q310 PolarHBondContact O-N 2.78Å; D307-Q310 VanDerWaalsContact O-N 3.15Å
308	G	92.4	Very high	92.7	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-60.2	-39.2	172.8	0	0	0	0	0	113.2	P304 L305 I306 Q310 S311	P304-G308 PolarHBondContact O-N 3.47Å; L305-G308 PolarHBondContact O-N 3.15Å; I306-G308 VanDerWaalsContact C-N 3.31Å; I306-G308 PolarHBondContact O-N 3.1Å; G308-Q310 PolarHBondContact O-N 3.09Å; G308-S311 WeakPolarHBondContact O-CB 3.31Å; G308-S311 PolarHBondContact O-N 3.15Å; G308-S311 VanDerWaalsContact O-N 3.09Å
309	M	91.6	Very high	92.8	Very high	1 Å²	1	41.8 Å²	41.8	1%	0.005	23%	0.225	C	C	.	.	H	α-helix	trans	-67.9	-15	175.9	-69.9	-72.7	-100.3	0	0	113.8	L305 I306 D307 S311 K317 C320 M321 L349 I356	L305-M309 VanDerWaalsContact O-CG 3.27Å; L305-M309 WeakPolarHBondContact O-CG 3.45Å; L305-M309 PolarHBondContact O-N 3.05Å; I306-M309 WeakPolarHBondContact O-CB 3.38Å; I306-M309 PolarHBondContact O-N 3.04Å; I306-M309 VanDerWaalsContact O-N 3.15Å; D307-M309 VanDerWaalsContact C-N 3.33Å; D307-M309 PolarHBondContact O-N 3.47Å; M309-S311 VanDerWaalsContact C-N 3.35Å; M309-K317 WeakPolarHBondContact O-CE 3.36Å; M309-K317 HydrophobicContact SD-CB 4.18Å; M309-K317 HydrophobicContact SD-CG 4.18Å; M309-C320 HydrophobicContact CG-CB 3.85Å; M309-C320 HydrophobicContact SD-CB 3.81Å; M309-M321 HydrophobicContact CE-CB 4.2Å; M309-M321 HydrophobicContact CE-CG 4.41Å; M309-M321 HydrophobicContact CE-SD 3.45Å; M309-M321 WeakPolarHBondContact CE-SD 3.47Å; M309-L349 HydrophobicContact CE-CD1 3.76Å; M309-I356 HydrophobicContact CB-CD1 4.37Å; M309-I356 HydrophobicContact CE-CD1 3.51Å; M309-I356 HydrophobicContact SD-CD1 3.81Å
310	Q	89.8	Confident	93.1	Very high	109 Å²	109	39.3 Å²	39.3	51%	0.509	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82	-12.8	171.9	-66	176.5	16.1	0	0	113.1	I306 D307 G308 H352	I306-Q310 PolarHBondContact O-N 3.08Å; D307-Q310 WeakPolarHBondContact O-CB 3.45Å; D307-Q310 PolarHBondContact O-N 2.78Å; D307-Q310 VanDerWaalsContact O-N 3.15Å; G308-Q310 PolarHBondContact O-N 3.09Å; Q310-H352 VanDerWaalsContact CG-CE1 3.49Å; Q310-H352 WeakPolarHBondContact CG-CE1 3.46Å; Q310-H352 WeakPolarHBondContact CG-NE2 3.26Å; Q310-H352 PolarHBondContact NE2-NE2 3.17Å
311	S	89.3	Confident	93.2	Very high	27 Å²	27	34.1 Å²	34.1	19%	0.189	18%	0.18	C	C	.	.	S	Bend	trans	-63.9	147.5	-175.7	-175.4	0	0	0	0	114	G308 M309 Q313 K317	G308-S311 WeakPolarHBondContact O-CB 3.31Å; G308-S311 PolarHBondContact O-N 3.15Å; G308-S311 VanDerWaalsContact O-N 3.09Å; M309-S311 VanDerWaalsContact C-N 3.35Å; S311-Q313 PolarHBondContact O-N 2.97Å; S311-Q313 PolarHBondContact OG-N 3.05Å; S311-K317 WeakPolarHBondContact O-CE 3.35Å; S311-K317 PolarHBondContact O-NZ 2.86Å
312	N	86.9	Confident	93.2	Very high	160 Å²	160	31.8 Å²	31.8	86%	0.856	17%	0.172	S	C	*	.	S	Bend	trans	-71.2	-10.8	170.8	-71.5	-34	0	0	0	113.2
313	Q	91.9	Very high	93.1	Very high	81 Å²	81	31.8 Å²	31.8	38%	0.379	17%	0.171	S	C	.	.			trans	-86.4	113	179.8	-60.1	-168.8	19	0	0	111.2	P260 S311 A315 L316 K317	P260-Q313 VanDerWaalsContact CB-OE1 3.29Å; S311-Q313 PolarHBondContact O-N 2.97Å; S311-Q313 PolarHBondContact OG-N 3.05Å; Q313-A315 VanDerWaalsContact C-N 3.28Å; Q313-A315 PolarHBondContact O-N 2.76Å; Q313-L316 HydrophobicContact CB-CB 4.28Å; Q313-L316 PolarHBondContact O-N 3.27Å; Q313-K317 PolarHBondContact O-N 3.32Å
314	I	91.7	Very high	93.2	Very high	69 Å²	69	29.1 Å²	29.1	35%	0.354	16%	0.159	S	C	.	.	H	α-helix	trans	-57	-42	179.5	-58.1	176.8	0	0	0	111	L316 K317 S318 I359 N361 L364	I314-L316 VanDerWaalsContact C-N 3.26Å; I314-L316 PolarHBondContact O-N 3.07Å; I314-K317 WeakPolarHBondContact O-CB 3.26Å; I314-K317 PolarHBondContact O-N 3.32Å; I314-K317 VanDerWaalsContact O-N 3.11Å; I314-S318 PolarHBondContact O-N 3.2Å; I314-S318 PolarHBondContact O-OG 2.93Å; I314-I359 HydrophobicContact CD1-CG2 3.93Å; I314-I359 HydrophobicContact CG1-CG2 4.29Å; I314-N361 HydrophobicContact CG2-CB 3.88Å; I314-L364 HydrophobicContact CG2-CD2 4.02Å
315	A	91.9	Very high	93.2	Very high	51 Å²	51	27.1 Å²	27.1	42%	0.421	15%	0.146	S	C	.	.	H	α-helix	trans	-59.5	-33.2	177.8	0	0	0	0	0	113.5	V264 Q313 G319	V264-A315 HydrophobicContact CG2-CB 4.4Å; V264-A315 WeakPolarHBondContact CG2-O 3.48Å; Q313-A315 VanDerWaalsContact C-N 3.28Å; Q313-A315 PolarHBondContact O-N 2.76Å; A315-G319 PolarHBondContact O-N 2.83Å
316	L	94.5	Very high	93.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-72	-41.4	175.1	-175.6	59.3	0	0	0	111.4	P260 M263 V264 Q313 I314 S318 G319 C320	P260-L316 HydrophobicContact CB-CD2 3.99Å; P260-L316 HydrophobicContact CG-CD2 4.34Å; M263-L316 HydrophobicContact CB-CD1 3.86Å; M263-L316 HydrophobicContact CG-CD1 3.65Å; M263-L316 HydrophobicContact SD-CD1 3.81Å; M263-L316 HydrophobicContact SD-CD2 4.43Å; V264-L316 HydrophobicContact CG2-CB 4.09Å; V264-L316 HydrophobicContact CG2-CD1 3.93Å; Q313-L316 HydrophobicContact CB-CB 4.28Å; Q313-L316 PolarHBondContact O-N 3.27Å; I314-L316 VanDerWaalsContact C-N 3.26Å; I314-L316 PolarHBondContact O-N 3.07Å; L316-S318 VanDerWaalsContact C-N 3.33Å; L316-S318 PolarHBondContact O-N 3.26Å; L316-G319 PolarHBondContact O-N 2.94Å; L316-C320 WeakPolarHBondContact O-CB 3.31Å; L316-C320 PolarHBondContact O-N 3.29Å; L316-C320 PolarHBondContact O-SG 3.45Å
317	K	94.8	Very high	93	Very high	28 Å²	28	27 Å²	27	12%	0.122	15%	0.145	C	C	.	.	H	α-helix	trans	-57	-46.5	171.4	-78.6	163	165	158	0	111.4	M309 S311 Q313 I314 C320 M321 I356 I359 L364	M309-K317 WeakPolarHBondContact O-CE 3.36Å; M309-K317 HydrophobicContact SD-CB 4.18Å; M309-K317 HydrophobicContact SD-CG 4.18Å; S311-K317 WeakPolarHBondContact O-CE 3.35Å; S311-K317 PolarHBondContact O-NZ 2.86Å; Q313-K317 PolarHBondContact O-N 3.32Å; I314-K317 WeakPolarHBondContact O-CB 3.26Å; I314-K317 PolarHBondContact O-N 3.32Å; I314-K317 VanDerWaalsContact O-N 3.11Å; K317-C320 PolarHBondContact O-N 2.92Å; K317-M321 VanDerWaalsContact O-CB 3.3Å; K317-M321 WeakPolarHBondContact O-CB 3.23Å; K317-M321 PolarHBondContact O-N 3.49Å; K317-I356 HydrophobicContact CD-CD1 4.25Å; K317-I356 HydrophobicContact CD-CG1 4.12Å; K317-I356 HydrophobicContact CG-CD1 4.13Å; K317-I359 HydrophobicContact CD-CD1 4.23Å; K317-L364 HydrophobicContact CB-CD1 4.22Å; K317-L364 HydrophobicContact CB-CD2 4.19Å
318	S	93.1	Very high	92.9	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.8	-45.1	175.6	-56.1	0	0	0	0	112.4	I314 L316 M321 Q322	I314-S318 PolarHBondContact O-N 3.2Å; I314-S318 PolarHBondContact O-OG 2.93Å; L316-S318 VanDerWaalsContact C-N 3.33Å; L316-S318 PolarHBondContact O-N 3.26Å; S318-M321 PolarHBondContact O-N 3.31Å; S318-Q322 VanDerWaalsContact O-CB 3.23Å; S318-Q322 WeakPolarHBondContact O-CB 3.09Å; S318-Q322 PolarHBondContact O-N 3.21Å
319	G	93.8	Very high	92.6	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-64	-42.5	177.8	0	0	0	0	0	113.9	A315 L316 L323	A315-G319 PolarHBondContact O-N 2.83Å; L316-G319 PolarHBondContact O-N 2.94Å; G319-L323 PolarHBondContact O-N 3.12Å; G319-L323 VanDerWaalsContact O-N 3.13Å
320	C	96.4	Very high	92.1	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.154	C	C	.	.	H	α-helix	trans	-64.5	-43.7	174.2	-68.9	0	0	0	0	111.6	M263 M309 L316 K317 L323 I324	M263-C320 VanDerWaalsContact CE-SG 3.57Å; M309-C320 HydrophobicContact CG-CB 3.85Å; M309-C320 HydrophobicContact SD-CB 3.81Å; L316-C320 WeakPolarHBondContact O-CB 3.31Å; L316-C320 PolarHBondContact O-N 3.29Å; L316-C320 PolarHBondContact O-SG 3.45Å; K317-C320 PolarHBondContact O-N 2.92Å; C320-L323 PolarHBondContact O-N 3.26Å; C320-I324 WeakPolarHBondContact O-CG1 3.25Å; C320-I324 PolarHBondContact O-N 3.38Å
321	M	95	Very high	91.6	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.133	C	C	.	.	H	α-helix	trans	-66.8	-38.6	178.2	-160.3	70.3	-157.4	0	0	112.2	M309 K317 S318 L323 I324 N325 L353 L364 Q367 F371	M309-M321 HydrophobicContact CE-CB 4.2Å; M309-M321 HydrophobicContact CE-CG 4.41Å; M309-M321 HydrophobicContact CE-SD 3.45Å; M309-M321 WeakPolarHBondContact CE-SD 3.47Å; K317-M321 VanDerWaalsContact O-CB 3.3Å; K317-M321 WeakPolarHBondContact O-CB 3.23Å; K317-M321 PolarHBondContact O-N 3.49Å; S318-M321 PolarHBondContact O-N 3.31Å; M321-L323 VanDerWaalsContact C-N 3.35Å; M321-L323 PolarHBondContact O-N 2.87Å; M321-I324 HydrophobicContact CE-CG2 4.39Å; M321-I324 PolarHBondContact O-N 3.16Å; M321-N325 WeakPolarHBondContact O-CB 3.39Å; M321-N325 VanDerWaalsContact O-CG 3.28Å; M321-N325 PolarHBondContact O-N 2.98Å; M321-N325 PolarHBondContact O-ND2 2.94Å; M321-L353 HydrophobicContact CE-CD2 3.94Å; M321-L353 HydrophobicContact SD-CD2 4.03Å; M321-L364 HydrophobicContact CB-CD1 4.45Å; M321-Q367 HydrophobicContact CB-CB 3.93Å; M321-Q367 HydrophobicContact CG-CB 3.62Å; M321-F371 HydrophobicContact CE-CB 3.33Å; M321-F371 HydrophobicContact CE-CD1 4.11Å; M321-F371 HydrophobicContact CE-CD2 3.35Å; M321-F371 HydrophobicContact CE-CE2 4.12Å; M321-F371 HydrophobicContact CE-CG 3.33Å
322	Q	94.9	Very high	91	Very high	0 Å²	0	31.9 Å²	31.9	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-61.3	-41.1	175.3	-170.4	-170	-54	0	0	111.8	K268 S318 N325 A326 Q367 L1152 F1158	K268-Q322 VanDerWaalsContact CE-OE1 3.24Å; S318-Q322 VanDerWaalsContact O-CB 3.23Å; S318-Q322 WeakPolarHBondContact O-CB 3.09Å; S318-Q322 PolarHBondContact O-N 3.21Å; Q322-N325 PolarHBondContact O-N 3.3Å; Q322-A326 PolarHBondContact O-N 3.42Å; Q322-Q367 HydrophobicContact CB-CG 4.41Å; Q322-L1152 HydrophobicContact CG-CB 4.1Å; Q322-F1158 HydrophobicContact CG-CZ 4.27Å
323	L	95.9	Very high	90.8	Very high	0 Å²	0	30.1 Å²	30.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-72.1	-40.9	176	-178.5	58.5	0	0	0	112.1	L255 A267 L270 S271 L305 G319 C320 M321 N325 A326 L327	L255-L323 HydrophobicContact CD1-CD2 4.16Å; L255-L323 HydrophobicContact CD2-CD2 4.13Å; A267-L323 HydrophobicContact CB-CB 4.26Å; A267-L323 HydrophobicContact CB-CD2 4.07Å; L270-L323 HydrophobicContact CB-CD1 3.87Å; L270-L323 HydrophobicContact CB-CD2 4.37Å; L270-L323 HydrophobicContact CD1-CD2 4.5Å; S271-L323 VanDerWaalsContact OG-CA 3.27Å; S271-L323 WeakPolarHBondContact OG-CA 3.49Å; S271-L323 PolarHBondContact OG-N 2.91Å; L305-L323 HydrophobicContact CD1-CD2 4.35Å; L305-L323 HydrophobicContact CD2-CD2 3.93Å; G319-L323 PolarHBondContact O-N 3.12Å; G319-L323 VanDerWaalsContact O-N 3.13Å; C320-L323 PolarHBondContact O-N 3.26Å; M321-L323 VanDerWaalsContact C-N 3.35Å; M321-L323 PolarHBondContact O-N 2.87Å; L323-N325 VanDerWaalsContact C-N 3.28Å; L323-N325 PolarHBondContact O-N 2.87Å; L323-A326 PolarHBondContact O-N 2.97Å; L323-A326 VanDerWaalsContact O-N 3.15Å; L323-L327 HydrophobicContact CD1-CD1 4.11Å; L323-L327 HydrophobicContact CD1-CD2 4.49Å; L323-L327 HydrophobicContact CD1-CG 4.05Å; L323-L327 HydrophobicContact CG-CD1 3.96Å; L323-L327 HydrophobicContact CG-CG 4.36Å; L323-L327 VanDerWaalsContact O-CG 3.28Å; L323-L327 WeakPolarHBondContact O-CG 3.35Å; L323-L327 PolarHBondContact O-N 3.38Å
324	I	95.4	Very high	90.6	Very high	1 Å²	1	26.7 Å²	26.7	1%	0.005	14%	0.135	C	C	.	.	H	α-helix	trans	-55.2	-46.2	171.7	-76	165	0	0	0	110.5	L305 C320 M321 L327 I328 L344 L349 F371	L305-I324 HydrophobicContact CD1-CG1 4.16Å; C320-I324 WeakPolarHBondContact O-CG1 3.25Å; C320-I324 PolarHBondContact O-N 3.38Å; M321-I324 HydrophobicContact CE-CG2 4.39Å; M321-I324 PolarHBondContact O-N 3.16Å; I324-L327 PolarHBondContact O-N 3.13Å; I324-I328 HydrophobicContact CG2-CD1 3.86Å; I324-I328 WeakPolarHBondContact O-CG1 3.45Å; I324-I328 PolarHBondContact O-N 3.41Å; I324-I328 VanDerWaalsContact O-N 3.13Å; I324-L344 HydrophobicContact CD1-CD2 4.33Å; I324-L344 HydrophobicContact CG1-CD1 4.21Å; I324-L344 HydrophobicContact CG1-CD2 4.19Å; I324-L344 HydrophobicContact CG2-CD1 3.85Å; I324-L349 HydrophobicContact CD1-CD1 4.29Å; I324-L349 HydrophobicContact CD1-CD2 4.31Å; I324-L349 HydrophobicContact CG2-CD2 4.42Å; I324-F371 HydrophobicContact CG2-CD2 4.15Å; I324-F371 HydrophobicContact CG2-CE2 4.04Å
325	N	94.4	Very high	90.3	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-62.5	-43.9	176	-73.4	-15.8	0	0	0	111.6	M321 Q322 L323 L327 I328 S329 Q367 V370 F371 F1158	M321-N325 WeakPolarHBondContact O-CB 3.39Å; M321-N325 VanDerWaalsContact O-CG 3.28Å; M321-N325 PolarHBondContact O-N 2.98Å; M321-N325 PolarHBondContact O-ND2 2.94Å; Q322-N325 PolarHBondContact O-N 3.3Å; L323-N325 VanDerWaalsContact C-N 3.28Å; L323-N325 PolarHBondContact O-N 2.87Å; N325-L327 PolarHBondContact O-N 2.97Å; N325-I328 PolarHBondContact O-N 2.77Å; N325-S329 WeakPolarHBondContact O-CB 3.23Å; N325-S329 PolarHBondContact O-N 3.32Å; N325-S329 PolarHBondContact O-OG 3.42Å; N325-Q367 PolarHBondContact ND2-O 3.32Å; N325-Q367 PolarHBondContact ND2-OE1 2.56Å; N325-V370 HydrophobicContact CB-CG1 4.11Å; N325-F371 WeakPolarHBondContact OD1-CB 3.46Å; N325-F1158 HydrophobicContact CB-CD1 4.4Å; N325-F1158 HydrophobicContact CB-CD2 4.5Å; N325-F1158 HydrophobicContact CB-CE1 3.93Å; N325-F1158 HydrophobicContact CB-CE2 4.05Å; N325-F1158 HydrophobicContact CB-CZ 3.71Å
326	A	92.9	Very high	90.2	Very high	0 Å²	0	28.8 Å²	28.8	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-61.7	-39.9	178.3	0	0	0	0	0	113.4	C274 Q322 L323 I328 F1158	C274-A326 HydrophobicContact CB-CB 4.02Å; Q322-A326 PolarHBondContact O-N 3.42Å; L323-A326 PolarHBondContact O-N 2.97Å; L323-A326 VanDerWaalsContact O-N 3.15Å; A326-I328 VanDerWaalsContact C-N 3.33Å; A326-I328 PolarHBondContact O-N 3.2Å; A326-F1158 HydrophobicContact CB-CE1 4.09Å
327	L	92.5	Very high	90.1	Very high	2 Å²	2	29.5 Å²	29.5	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-74.5	-16.6	177.9	-63.5	171.2	0	0	0	114.1	H283 V286 L287 I290 F302 L323 I324 N325	H283-L327 PolarHBondContact NE2-O 3.45Å; H283-L327 VanDerWaalsContact NE2-O 3.15Å; V286-L327 HydrophobicContact CG1-CD2 4.04Å; L287-L327 HydrophobicContact CD2-CD1 4.46Å; L287-L327 HydrophobicContact CD2-CD2 3.84Å; L287-L327 HydrophobicContact CG-CD2 4Å; I290-L327 HydrophobicContact CD1-CD1 4.04Å; I290-L327 HydrophobicContact CD1-CD2 4.5Å; F302-L327 HydrophobicContact CE1-CD1 4.09Å; L323-L327 HydrophobicContact CD1-CD1 4.11Å; L323-L327 HydrophobicContact CD1-CD2 4.49Å; L323-L327 HydrophobicContact CD1-CG 4.05Å; L323-L327 HydrophobicContact CG-CD1 3.96Å; L323-L327 HydrophobicContact CG-CG 4.36Å; L323-L327 VanDerWaalsContact O-CG 3.28Å; L323-L327 WeakPolarHBondContact O-CG 3.35Å; L323-L327 PolarHBondContact O-N 3.38Å; I324-L327 PolarHBondContact O-N 3.13Å; N325-L327 PolarHBondContact O-N 2.97Å
328	I	91	Very high	89.8	Confident	0 Å²	0	29 Å²	29	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-97.8	-30.8	173	-65	168.9	0	0	0	111	I324 N325 A326 R337 I340 R341 L344 F371	I324-I328 HydrophobicContact CG2-CD1 3.86Å; I324-I328 WeakPolarHBondContact O-CG1 3.45Å; I324-I328 PolarHBondContact O-N 3.41Å; I324-I328 VanDerWaalsContact O-N 3.13Å; N325-I328 PolarHBondContact O-N 2.77Å; A326-I328 VanDerWaalsContact C-N 3.33Å; A326-I328 PolarHBondContact O-N 3.2Å; I328-R337 WeakPolarHBondContact O-CD 3.47Å; I328-R337 WeakPolarHBondContact O-CG 3.49Å; I328-I340 HydrophobicContact CG1-CG2 3.91Å; I328-R341 HydrophobicContact CD1-CB 4.05Å; I328-R341 HydrophobicContact CD1-CG 4.19Å; I328-L344 HydrophobicContact CD1-CD1 4.04Å; I328-F371 HydrophobicContact CD1-CD2 4.18Å; I328-F371 HydrophobicContact CD1-CE2 3.74Å
329	S	86.2	Confident	89.7	Confident	17 Å²	17	33.2 Å²	33.2	12%	0.119	16%	0.157	C	C	.	.	H	α-helix	trans	-71.7	-33	-172.4	-64.4	0	0	0	0	114.4	N325 Q374 F1158	N325-S329 WeakPolarHBondContact O-CB 3.23Å; N325-S329 PolarHBondContact O-N 3.32Å; N325-S329 PolarHBondContact O-OG 3.42Å; S329-Q374 PolarHBondContact OG-NE2 3.05Å; S329-Q374 PolarHBondContact OG-OE1 3.08Å; S329-F1158 WeakPolarHBondContact OG-CD1 3.5Å
330	R	82.3	Confident	89.6	Confident	73 Å²	73	33.2 Å²	33.2	28%	0.275	16%	0.157	S	C	.	.	S	Bend	trans	-97.6	-15	-166.9	-72.6	-77.2	-77.2	163.3	-14.5	114.4	C274 I275 L276 D277 H283 E332	C274-R330 WeakPolarHBondContact O-CG 3.3Å; C274-R330 PolarHBondContact O-NE 2.85Å; I275-R330 HydrophobicContact CG2-CG 4.14Å; L276-R330 PolarHBondContact O-NH2 3.13Å; D277-R330 IonicContact OD1-CZ 2.67Å; D277-R330 IonicContact OD1-NH1 2.72Å; D277-R330 PolarHBondContact OD1-NH1 2.84Å; D277-R330 VanDerWaalsContact OD1-NH1 3.12Å; D277-R330 IonicContact OD1-NH2 2.88Å; D277-R330 PolarHBondContact OD1-NH2 3.38Å; H283-R330 HydrophobicContact CB-CB 4.22Å; R330-E332 PolarHBondContact O-N 2.97Å
331	A	79	Confident	89.4	Confident	7 Å²	7	33.2 Å²	33.2	6%	0.058	16%	0.157	C	C	.	.			trans	-67.1	112.8	170.3	0	0	0	0	0	111	F336 R337	A331-F336 HydrophobicContact CB-CD1 3.6Å; A331-F336 HydrophobicContact CB-CE1 4.24Å; A331-F336 HydrophobicContact CB-CG 4.49Å; A331-R337 HydrophobicContact CB-CG 3.7Å; A331-R337 WeakPolarHBondContact O-CD 3.39Å; A331-R337 VanDerWaalsContact O-CG 3.28Å; A331-R337 WeakPolarHBondContact O-CG 3.27Å; A331-R337 PolarHBondContact O-NH1 3.15Å
332	E	75.8	Confident	89.1	Confident	180 Å²	180	33.2 Å²	33.2	84%	0.841	16%	0.157	S	C	*	.			trans	-69	-35.8	-176.8	-57.6	-160.9	139	0	0	112.7	R330 R337	R330-E332 PolarHBondContact O-N 2.97Å; E332-R337 VanDerWaalsContact C-NH1 3.31Å; E332-R337 PolarHBondContact O-NH1 3.01Å
333	E	84	Confident	89	Confident	124 Å²	124	34.4 Å²	34.4	58%	0.579	16%	0.162	S	C	*	.	S	Bend	trans	-77	127.1	179.5	-71.7	-59	159.6	0	0	113.1	D335 F336 R337	E333-D335 VanDerWaalsContact C-N 3.33Å; E333-D335 PolarHBondContact O-N 2.83Å; E333-F336 HydrophobicContact CB-CB 4.2Å; E333-F336 PolarHBondContact O-N 3.43Å; E333-R337 PolarHBondContact O-N 2.85Å; E333-R337 VanDerWaalsContact O-N 3.15Å
334	L	86.1	Confident	88.8	Confident	9 Å²	9	34.5 Å²	34.5	5%	0.047	16%	0.163	C	C	.	.	H	α-helix	trans	-57.4	-45.5	-179.2	176	62.6	0	0	0	111.8	F336 R337 I338 D378 D381 L382	L334-F336 VanDerWaalsContact C-N 3.27Å; L334-F336 PolarHBondContact O-N 3.44Å; L334-R337 PolarHBondContact O-N 3.49Å; L334-I338 HydrophobicContact CD1-CD1 3.97Å; L334-I338 HydrophobicContact CD1-CG1 4.25Å; L334-I338 HydrophobicContact CD2-CD1 4.46Å; L334-I338 HydrophobicContact CG-CD1 3.83Å; L334-I338 HydrophobicContact CG-CG1 4.47Å; L334-I338 WeakPolarHBondContact O-CG1 3.39Å; L334-I338 PolarHBondContact O-N 3.31Å; L334-D378 HydrophobicContact CD1-CB 3.74Å; L334-D381 HydrophobicContact CD1-CB 4.39Å; L334-D381 HydrophobicContact CD2-CB 4.16Å; L334-L382 HydrophobicContact CD2-CB 4.19Å; L334-L382 HydrophobicContact CD2-CD1 4.45Å
335	D	87.4	Confident	88.5	Confident	85 Å²	85	35.3 Å²	35.3	46%	0.455	17%	0.167	S	C	.	.	H	α-helix	trans	-66.4	-31.6	-176.1	-50	-81.5	0	0	0	111.7	E333 H339 R385	E333-D335 VanDerWaalsContact C-N 3.33Å; E333-D335 PolarHBondContact O-N 2.83Å; D335-H339 VanDerWaalsContact O-CB 3.3Å; D335-H339 WeakPolarHBondContact O-CB 3.29Å; D335-H339 PolarHBondContact O-N 3.04Å; D335-R385 IonicContact OD1-CZ 2.81Å; D335-R385 IonicContact OD1-NH1 3.43Å; D335-R385 PolarHBondContact OD1-NH1 3.25Å; D335-R385 IonicContact OD2-CZ 2.61Å; D335-R385 VanDerWaalsContact OD2-CZ 3.25Å; D335-R385 IonicContact OD2-NH1 3.89Å; D335-R385 PolarHBondContact OD2-NH1 2.93Å; D335-R385 IonicContact OD2-NH2 2.64Å; D335-R385 PolarHBondContact OD2-NH2 3.37Å
336	F	89.5	Confident	88.1	Confident	78 Å²	78	39.1 Å²	39.1	34%	0.342	18%	0.181	S	C	.	.	H	α-helix	trans	-73.3	-38.7	174.8	-168.1	-134	0	0	0	111.7	L287 A331 E333 L334 H339 I340	L287-F336 HydrophobicContact CD1-CE1 4.01Å; L287-F336 HydrophobicContact CD1-CZ 3.87Å; A331-F336 HydrophobicContact CB-CD1 3.6Å; A331-F336 HydrophobicContact CB-CE1 4.24Å; A331-F336 HydrophobicContact CB-CG 4.49Å; E333-F336 HydrophobicContact CB-CB 4.2Å; E333-F336 PolarHBondContact O-N 3.43Å; L334-F336 VanDerWaalsContact C-N 3.27Å; L334-F336 PolarHBondContact O-N 3.44Å; F336-H339 WeakPolarHBondContact O-CB 3.4Å; F336-H339 PolarHBondContact O-N 3.39Å; F336-I340 HydrophobicContact CD2-CG1 4.45Å; F336-I340 HydrophobicContact CE2-CD1 4.14Å; F336-I340 HydrophobicContact CE2-CG1 4.26Å; F336-I340 HydrophobicContact CZ-CD1 4.27Å; F336-I340 HydrophobicContact CZ-CG1 4.39Å; F336-I340 WeakPolarHBondContact O-CG1 3.42Å; F336-I340 PolarHBondContact O-N 3.49Å
337	R	90.8	Very high	88	Confident	15 Å²	15	40.6 Å²	40.6	6%	0.057	19%	0.189	C	C	.	.	H	α-helix	trans	-62.8	-45.5	172	-66	-164.5	-59	-87.8	4	112.5	I328 A331 E332 E333 L334 H339 I340 R341 D378 R1160	I328-R337 WeakPolarHBondContact O-CD 3.47Å; I328-R337 WeakPolarHBondContact O-CG 3.49Å; A331-R337 HydrophobicContact CB-CG 3.7Å; A331-R337 WeakPolarHBondContact O-CD 3.39Å; A331-R337 VanDerWaalsContact O-CG 3.28Å; A331-R337 WeakPolarHBondContact O-CG 3.27Å; A331-R337 PolarHBondContact O-NH1 3.15Å; E332-R337 VanDerWaalsContact C-NH1 3.31Å; E332-R337 PolarHBondContact O-NH1 3.01Å; E333-R337 PolarHBondContact O-N 2.85Å; E333-R337 VanDerWaalsContact O-N 3.15Å; L334-R337 PolarHBondContact O-N 3.49Å; R337-H339 VanDerWaalsContact C-N 3.3Å; R337-H339 PolarHBondContact O-N 3.01Å; R337-I340 PolarHBondContact O-N 2.84Å; R337-R341 WeakPolarHBondContact O-CB 3.24Å; R337-R341 PolarHBondContact O-N 3.29Å; R337-D378 IonicContact CZ-OD1 2.71Å; R337-D378 VanDerWaalsContact CZ-OD1 3.23Å; R337-D378 IonicContact NE-OD1 2.79Å; R337-D378 PolarHBondContact NE-OD1 3.31Å; R337-D378 IonicContact NE-OD2 3.98Å; R337-D378 IonicContact NH2-OD1 3.39Å; R337-D378 PolarHBondContact NH2-OD1 3.28Å; R337-R1160 VanDerWaalsContact CD-NH2 3.27Å
338	I	89.5	Confident	87.8	Confident	19 Å²	19	41.1 Å²	41.1	10%	0.097	20%	0.196	C	C	.	.	H	α-helix	trans	-57.1	-45.6	173.8	-72.5	173.6	0	0	0	109.8	L334 S342	L334-I338 HydrophobicContact CD1-CD1 3.97Å; L334-I338 HydrophobicContact CD1-CG1 4.25Å; L334-I338 HydrophobicContact CD2-CD1 4.46Å; L334-I338 HydrophobicContact CG-CD1 3.83Å; L334-I338 HydrophobicContact CG-CG1 4.47Å; L334-I338 WeakPolarHBondContact O-CG1 3.39Å; L334-I338 PolarHBondContact O-N 3.31Å; I338-S342 WeakPolarHBondContact O-CB 3.48Å; I338-S342 PolarHBondContact O-N 3.46Å; I338-S342 PolarHBondContact O-OG 2.67Å
339	H	90.8	Very high	87.7	Confident	87 Å²	87	41.1 Å²	41.1	40%	0.403	20%	0.196	S	C	.	.	H	α-helix	trans	-59.1	-53.7	177.9	-179.8	93.1	0	0	0	112.8	D335 F336 R337 S342 E343	D335-H339 VanDerWaalsContact O-CB 3.3Å; D335-H339 WeakPolarHBondContact O-CB 3.29Å; D335-H339 PolarHBondContact O-N 3.04Å; F336-H339 WeakPolarHBondContact O-CB 3.4Å; F336-H339 PolarHBondContact O-N 3.39Å; R337-H339 VanDerWaalsContact C-N 3.3Å; R337-H339 PolarHBondContact O-N 3.01Å; H339-S342 PolarHBondContact O-N 2.93Å; H339-E343 IonicContact NE2-OE2 3.61Å; H339-E343 WeakPolarHBondContact O-CB 3.44Å; H339-E343 PolarHBondContact O-N 3.29Å
340	I	91.6	Very high	87.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	22%	0.215	C	C	.	.	H	α-helix	trans	-62.4	-45.9	-178.8	-62.7	-66.8	0	0	0	111.2	L287 F302 I328 F336 R337 S342 E343 L344	L287-I340 HydrophobicContact CD2-CD1 4.48Å; F302-I340 HydrophobicContact CE2-CD1 4.27Å; F302-I340 HydrophobicContact CE2-CG2 4.32Å; F302-I340 HydrophobicContact CZ-CD1 4.12Å; F302-I340 HydrophobicContact CZ-CG2 4.27Å; I328-I340 HydrophobicContact CG1-CG2 3.91Å; F336-I340 HydrophobicContact CD2-CG1 4.45Å; F336-I340 HydrophobicContact CE2-CD1 4.14Å; F336-I340 HydrophobicContact CE2-CG1 4.26Å; F336-I340 HydrophobicContact CZ-CD1 4.27Å; F336-I340 HydrophobicContact CZ-CG1 4.39Å; F336-I340 WeakPolarHBondContact O-CG1 3.42Å; F336-I340 PolarHBondContact O-N 3.49Å; R337-I340 PolarHBondContact O-N 2.84Å; I340-S342 VanDerWaalsContact C-N 3.32Å; I340-S342 PolarHBondContact O-N 3.31Å; I340-E343 PolarHBondContact O-N 2.98Å; I340-L344 HydrophobicContact CG2-CD1 4.12Å; I340-L344 WeakPolarHBondContact O-CG 3.46Å; I340-L344 PolarHBondContact O-N 2.93Å; I340-L344 VanDerWaalsContact O-N 3.12Å
341	R	92.1	Very high	87.8	Confident	0 Å²	0	48.8 Å²	48.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-62	-41.5	176.9	-167.5	-177.9	-66.9	104.2	-8.6	111.1	I328 R337 L344 L345 F371 Q374 D378 G454 S455	I328-R341 HydrophobicContact CD1-CB 4.05Å; I328-R341 HydrophobicContact CD1-CG 4.19Å; R337-R341 WeakPolarHBondContact O-CB 3.24Å; R337-R341 PolarHBondContact O-N 3.29Å; R341-L344 PolarHBondContact O-N 3.2Å; R341-L345 HydrophobicContact CG-CD1 4.15Å; R341-L345 WeakPolarHBondContact O-CB 3.18Å; R341-L345 WeakPolarHBondContact O-CG 3.39Å; R341-L345 PolarHBondContact O-N 3Å; R341-F371 HydrophobicContact CG-CE2 3.94Å; R341-F371 HydrophobicContact CG-CZ 3.65Å; R341-Q374 VanDerWaalsContact NH2-C 3.25Å; R341-Q374 PolarHBondContact NH2-O 3.41Å; R341-Q374 VanDerWaalsContact NH2-O 3.14Å; R341-D378 IonicContact CZ-OD2 3.82Å; R341-D378 VanDerWaalsContact CZ-OD2 3.24Å; R341-D378 IonicContact NH1-OD2 3.71Å; R341-D378 PolarHBondContact NH1-OD2 3.15Å; R341-D378 IonicContact NH2-OD2 3.48Å; R341-D378 PolarHBondContact NH2-OD2 3.09Å; R341-G454 PolarHBondContact NH1-O 3Å; R341-S455 WeakPolarHBondContact CB-OG 3.38Å; R341-S455 WeakPolarHBondContact CD-OG 3.28Å; R341-S455 WeakPolarHBondContact CG-OG 3.48Å
342	S	89.9	Confident	88.2	Confident	1 Å²	1	49.7 Å²	49.7	1%	0.007	23%	0.229	C	C	.	.	H	α-helix	trans	-69.2	-34	179.1	-55.2	0	0	0	0	112.8	I338 H339 I340 L345 R346 S455 D456	I338-S342 WeakPolarHBondContact O-CB 3.48Å; I338-S342 PolarHBondContact O-N 3.46Å; I338-S342 PolarHBondContact O-OG 2.67Å; H339-S342 PolarHBondContact O-N 2.93Å; I340-S342 VanDerWaalsContact C-N 3.32Å; I340-S342 PolarHBondContact O-N 3.31Å; S342-L345 PolarHBondContact O-N 2.93Å; S342-R346 WeakPolarHBondContact O-CB 3.39Å; S342-R346 VanDerWaalsContact O-CG 3.23Å; S342-R346 WeakPolarHBondContact O-CG 3.49Å; S342-R346 PolarHBondContact O-N 3.17Å; S342-R346 PolarHBondContact O-NE 2.89Å; S342-S455 WeakPolarHBondContact OG-CB 3.36Å; S342-D456 PolarHBondContact OG-N 3.45Å
343	E	91.5	Very high	88.8	Confident	24 Å²	24	41.4 Å²	41.4	11%	0.112	19%	0.191	C	C	.	.	H	α-helix	trans	-62.5	-52	172.9	-171.9	-174.7	150.8	0	0	111.3	R301 F302 H339 I340 L345 R346 L347	R301-E343 WeakPolarHBondContact CG-OE1 3.46Å; R301-E343 IonicContact CZ-OE1 3.59Å; R301-E343 IonicContact CZ-OE2 2.7Å; R301-E343 IonicContact NE-OE1 3.77Å; R301-E343 PolarHBondContact NE-OE1 3.45Å; R301-E343 IonicContact NE-OE2 2.57Å; R301-E343 PolarHBondContact NE-OE2 3.49Å; R301-E343 IonicContact NH2-OE1 2.67Å; R301-E343 IonicContact NH2-OE2 3.72Å; R301-E343 PolarHBondContact NH2-OE2 2.89Å; F302-E343 HydrophobicContact CD2-CG 4.17Å; F302-E343 VanDerWaalsContact CD2-OE1 3.27Å; F302-E343 WeakPolarHBondContact CD2-OE1 3.3Å; F302-E343 VanDerWaalsContact CE2-CD 3.47Å; F302-E343 HydrophobicContact CE2-CG 4.3Å; F302-E343 VanDerWaalsContact CE2-OE1 3.27Å; F302-E343 WeakPolarHBondContact CE2-OE1 3.39Å; H339-E343 IonicContact NE2-OE2 3.61Å; H339-E343 WeakPolarHBondContact O-CB 3.44Å; H339-E343 PolarHBondContact O-N 3.29Å; I340-E343 PolarHBondContact O-N 2.98Å; E343-L345 VanDerWaalsContact C-N 3.31Å; E343-L345 PolarHBondContact O-N 2.92Å; E343-R346 PolarHBondContact O-N 2.94Å; E343-R346 VanDerWaalsContact O-N 3.11Å; E343-L347 HydrophobicContact CG-CD1 4.46Å; E343-L347 WeakPolarHBondContact O-CG 3.32Å; E343-L347 PolarHBondContact O-N 2.96Å
344	L	91.9	Very high	88.8	Confident	2 Å²	2	38.5 Å²	38.5	1%	0.01	18%	0.184	C	C	.	.	H	α-helix	trans	-57.5	-41.3	175.8	-73.3	162.6	0	0	0	112.6	F302 I306 I324 I328 I340 R341 L347 G348 L349	F302-L344 HydrophobicContact CB-CD2 3.51Å; F302-L344 HydrophobicContact CD1-CD2 4.38Å; F302-L344 HydrophobicContact CD2-CD2 3.82Å; F302-L344 HydrophobicContact CD2-CG 3.96Å; F302-L344 HydrophobicContact CE2-CG 4.45Å; F302-L344 HydrophobicContact CG-CD2 3.65Å; F302-L344 HydrophobicContact CG-CG 4.3Å; I306-L344 HydrophobicContact CD1-CD2 4.28Å; I324-L344 HydrophobicContact CD1-CD2 4.33Å; I324-L344 HydrophobicContact CG1-CD1 4.21Å; I324-L344 HydrophobicContact CG1-CD2 4.19Å; I324-L344 HydrophobicContact CG2-CD1 3.85Å; I328-L344 HydrophobicContact CD1-CD1 4.04Å; I340-L344 HydrophobicContact CG2-CD1 4.12Å; I340-L344 WeakPolarHBondContact O-CG 3.46Å; I340-L344 PolarHBondContact O-N 2.93Å; I340-L344 VanDerWaalsContact O-N 3.12Å; R341-L344 PolarHBondContact O-N 3.2Å; L344-L347 PolarHBondContact O-N 3.1Å; L344-G348 PolarHBondContact O-N 3.32Å; L344-L349 HydrophobicContact CB-CB 4.46Å; L344-L349 HydrophobicContact CB-CD2 3.89Å; L344-L349 WeakPolarHBondContact O-CB 3.11Å; L344-L349 PolarHBondContact O-N 3.22Å; L344-L349 VanDerWaalsContact O-N 3.17Å
345	L	88.8	Confident	88.8	Confident	18 Å²	18	43.7 Å²	43.7	9%	0.094	21%	0.208	C	C	.	.	I	π-helix	trans	-64.7	-40.7	175.8	-70.8	169	0	0	0	112	R341 S342 E343 L347 G348 R350 L353	R341-L345 HydrophobicContact CG-CD1 4.15Å; R341-L345 WeakPolarHBondContact O-CB 3.18Å; R341-L345 WeakPolarHBondContact O-CG 3.39Å; R341-L345 PolarHBondContact O-N 3Å; S342-L345 PolarHBondContact O-N 2.93Å; E343-L345 VanDerWaalsContact C-N 3.31Å; E343-L345 PolarHBondContact O-N 2.92Å; L345-L347 VanDerWaalsContact C-N 3.3Å; L345-L347 PolarHBondContact O-N 3.13Å; L345-G348 PolarHBondContact O-N 2.94Å; L345-R350 HydrophobicContact CD2-CB 3.86Å; L345-L353 HydrophobicContact CD2-CD1 4.45Å
346	R	87.4	Confident	88.8	Confident	80 Å²	80	39.7 Å²	39.7	30%	0.302	19%	0.187	S	C	.	.	I	π-helix	trans	-67.3	-25.2	175.6	-73.9	179.4	-65.3	-112.9	4.1	113.6	S342 E343 G348 D456 D458	S342-R346 WeakPolarHBondContact O-CB 3.39Å; S342-R346 VanDerWaalsContact O-CG 3.23Å; S342-R346 WeakPolarHBondContact O-CG 3.49Å; S342-R346 PolarHBondContact O-N 3.17Å; S342-R346 PolarHBondContact O-NE 2.89Å; E343-R346 PolarHBondContact O-N 2.94Å; E343-R346 VanDerWaalsContact O-N 3.11Å; R346-G348 VanDerWaalsContact C-N 3.31Å; R346-D456 IonicContact NH1-OD2 3.63Å; R346-D456 PolarHBondContact NH1-OD2 3.35Å; R346-D458 HydrophobicContact CG-CB 4.28Å
347	L	89.9	Confident	88.8	Confident	31 Å²	31	41.3 Å²	41.3	16%	0.162	19%	0.191	C	C	.	.	I	π-helix	trans	-81.6	-4.3	173.4	-67.2	171	0	0	0	113.7	E300 F302 I306 E343 L344 L345	E300-L347 HydrophobicContact CB-CD1 4.45Å; E300-L347 HydrophobicContact CB-CD2 3.72Å; E300-L347 HydrophobicContact CG-CD2 3.8Å; F302-L347 HydrophobicContact CB-CD1 3.89Å; F302-L347 HydrophobicContact CD2-CD1 4.45Å; I306-L347 HydrophobicContact CG1-CB 4.07Å; E343-L347 HydrophobicContact CG-CD1 4.46Å; E343-L347 WeakPolarHBondContact O-CG 3.32Å; E343-L347 PolarHBondContact O-N 2.96Å; L344-L347 PolarHBondContact O-N 3.1Å; L345-L347 VanDerWaalsContact C-N 3.3Å; L345-L347 PolarHBondContact O-N 3.13Å
348	G	87.6	Confident	88.6	Confident	14 Å²	14	50.8 Å²	50.8	14%	0.144	23%	0.227	C	C	.	.	I	π-helix	trans	112.9	6	173	0	0	0	0	0	115.9	L344 L345 R346 R350 Q351 H352	L344-G348 PolarHBondContact O-N 3.32Å; L345-G348 PolarHBondContact O-N 2.94Å; R346-G348 VanDerWaalsContact C-N 3.31Å; G348-R350 PolarHBondContact O-N 3Å; G348-R350 VanDerWaalsContact O-N 3.16Å; G348-Q351 PolarHBondContact O-N 3.16Å; G348-Q351 PolarHBondContact O-OE1 3.28Å; G348-Q351 VanDerWaalsContact O-OE1 3.1Å; G348-H352 PolarHBondContact O-CD2 3.35Å
349	L	89.8	Confident	88.7	Confident	0 Å²	0	51.8 Å²	51.8	0%	0	23%	0.232	C	C	.	.	I	π-helix	trans	-56.6	-32.5	178.2	-177.9	60.6	0	0	0	112.5	I306 M309 I324 L344 Q351 H352 L353 F371	I306-L349 HydrophobicContact CD1-CB 3.95Å; I306-L349 HydrophobicContact CD1-CD1 4.43Å; M309-L349 HydrophobicContact CE-CD1 3.76Å; I324-L349 HydrophobicContact CD1-CD1 4.29Å; I324-L349 HydrophobicContact CD1-CD2 4.31Å; I324-L349 HydrophobicContact CG2-CD2 4.42Å; L344-L349 HydrophobicContact CB-CB 4.46Å; L344-L349 HydrophobicContact CB-CD2 3.89Å; L344-L349 WeakPolarHBondContact O-CB 3.11Å; L344-L349 PolarHBondContact O-N 3.22Å; L344-L349 VanDerWaalsContact O-N 3.17Å; L349-Q351 VanDerWaalsContact C-N 3.3Å; L349-Q351 PolarHBondContact O-N 3.39Å; L349-H352 PolarHBondContact O-N 2.99Å; L349-L353 HydrophobicContact CD1-CD1 4.47Å; L349-L353 HydrophobicContact CD1-CD2 4.34Å; L349-L353 HydrophobicContact CD1-CG 4.02Å; L349-L353 HydrophobicContact CD2-CD1 4.34Å; L349-L353 HydrophobicContact CG-CD1 3.87Å; L349-L353 HydrophobicContact CG-CG 3.94Å; L349-L353 WeakPolarHBondContact O-CG 3.21Å; L349-L353 PolarHBondContact O-N 3.47Å; L349-F371 HydrophobicContact CD2-CE2 4.13Å; L349-F371 HydrophobicContact CD2-CZ 4.07Å
350	R	85.7	Confident	88.5	Confident	138 Å²	138	57 Å²	57	52%	0.521	26%	0.257	S	S	.	.	H	α-helix	trans	-59.3	-38.3	-178.9	-171.7	172.3	179.1	146.9	1.4	113	L345 G348 S354	L345-R350 HydrophobicContact CD2-CB 3.86Å; G348-R350 PolarHBondContact O-N 3Å; G348-R350 VanDerWaalsContact O-N 3.16Å; R350-S354 PolarHBondContact O-OG 3.24Å
351	Q	84.4	Confident	88.5	Confident	112 Å²	112	59.5 Å²	59.5	52%	0.523	27%	0.27	S	S	.	.	H	α-helix	trans	-67.1	-51.5	177.3	-70.6	78.5	-15.6	0	0	109.3	G348 L349 L353 S354 E355	G348-Q351 PolarHBondContact O-N 3.16Å; G348-Q351 PolarHBondContact O-OE1 3.28Å; G348-Q351 VanDerWaalsContact O-OE1 3.1Å; L349-Q351 VanDerWaalsContact C-N 3.3Å; L349-Q351 PolarHBondContact O-N 3.39Å; Q351-L353 PolarHBondContact O-N 3.39Å; Q351-S354 VanDerWaalsContact O-CB 3.29Å; Q351-S354 WeakPolarHBondContact O-CB 3.43Å; Q351-S354 PolarHBondContact O-N 2.9Å; Q351-S354 VanDerWaalsContact O-N 3.08Å; Q351-E355 PolarHBondContact O-N 3.26Å
352	H	88	Confident	88.3	Confident	26 Å²	26	67.6 Å²	67.6	12%	0.12	31%	0.308	C	S	.	.	H	α-helix	trans	-67.4	-36.7	-177	-60.5	-44	0	0	0	113.2	Q310 G348 L349 S354 E355 I356	Q310-H352 VanDerWaalsContact CG-CE1 3.49Å; Q310-H352 WeakPolarHBondContact CG-CE1 3.46Å; Q310-H352 WeakPolarHBondContact CG-NE2 3.26Å; Q310-H352 PolarHBondContact NE2-NE2 3.17Å; G348-H352 PolarHBondContact O-CD2 3.35Å; L349-H352 PolarHBondContact O-N 2.99Å; H352-S354 PolarHBondContact O-N 3.04Å; H352-E355 IonicContact CE1-OE2 2.64Å; H352-E355 IonicContact ND1-OE2 3.78Å; H352-E355 PolarHBondContact ND1-OE2 2.95Å; H352-E355 PolarHBondContact O-N 3.38Å; H352-I356 HydrophobicContact CB-CD1 4.14Å; H352-I356 VanDerWaalsContact O-CB 3.28Å; H352-I356 WeakPolarHBondContact O-CB 3.31Å; H352-I356 WeakPolarHBondContact O-CG1 3.21Å; H352-I356 PolarHBondContact O-N 3.1Å
353	L	88.3	Confident	88.1	Confident	6 Å²	6	69.5 Å²	69.5	3%	0.031	32%	0.316	C	S	.	.	H	α-helix	trans	-56.2	-35.6	171	-71.8	171.8	0	0	0	112.3	M321 L345 L349 Q351 E355 R357 L368 F371	M321-L353 HydrophobicContact CE-CD2 3.94Å; M321-L353 HydrophobicContact SD-CD2 4.03Å; L345-L353 HydrophobicContact CD2-CD1 4.45Å; L349-L353 HydrophobicContact CD1-CD1 4.47Å; L349-L353 HydrophobicContact CD1-CD2 4.34Å; L349-L353 HydrophobicContact CD1-CG 4.02Å; L349-L353 HydrophobicContact CD2-CD1 4.34Å; L349-L353 HydrophobicContact CG-CD1 3.87Å; L349-L353 HydrophobicContact CG-CG 3.94Å; L349-L353 WeakPolarHBondContact O-CG 3.21Å; L349-L353 PolarHBondContact O-N 3.47Å; Q351-L353 PolarHBondContact O-N 3.39Å; L353-E355 VanDerWaalsContact C-N 3.28Å; L353-E355 PolarHBondContact O-N 3.35Å; L353-R357 WeakPolarHBondContact O-CB 3.29Å; L353-R357 VanDerWaalsContact O-CG 3.3Å; L353-R357 WeakPolarHBondContact O-CG 3.13Å; L353-R357 PolarHBondContact O-N 3.16Å; L353-L368 HydrophobicContact CD2-CD2 3.48Å; L353-L368 VanDerWaalsContact CD2-CD2 3.48Å; L353-F371 HydrophobicContact CD1-CD1 4.28Å; L353-F371 HydrophobicContact CD1-CE1 3.7Å; L353-F371 HydrophobicContact CD1-CZ 4.16Å
354	S	84.7	Confident	88.1	Confident	63 Å²	63	68.3 Å²	68.3	44%	0.441	31%	0.311	S	S	.	.	H	α-helix	trans	-72.2	-21.5	179.2	-53.8	0	0	0	0	113.5	R350 Q351 H352 R358	R350-S354 PolarHBondContact O-OG 3.24Å; Q351-S354 VanDerWaalsContact O-CB 3.29Å; Q351-S354 WeakPolarHBondContact O-CB 3.43Å; Q351-S354 PolarHBondContact O-N 2.9Å; Q351-S354 VanDerWaalsContact O-N 3.08Å; H352-S354 PolarHBondContact O-N 3.04Å; S354-R358 PolarHBondContact O-NE 3.08Å
355	E	85.5	Confident	88.1	Confident	119 Å²	119	71 Å²	71	56%	0.556	32%	0.323	S	S	*	.	H	α-helix	trans	-89.2	-45.8	173.8	-60.2	175.4	137.1	0	0	110.7	Q351 H352 L353 R358	Q351-E355 PolarHBondContact O-N 3.26Å; H352-E355 IonicContact CE1-OE2 2.64Å; H352-E355 IonicContact ND1-OE2 3.78Å; H352-E355 PolarHBondContact ND1-OE2 2.95Å; H352-E355 PolarHBondContact O-N 3.38Å; L353-E355 VanDerWaalsContact C-N 3.28Å; L353-E355 PolarHBondContact O-N 3.35Å; E355-R358 WeakPolarHBondContact O-CB 3.35Å; E355-R358 PolarHBondContact O-N 2.93Å; E355-R358 VanDerWaalsContact O-N 3.15Å
356	I	87.5	Confident	88.2	Confident	1 Å²	1	72.3 Å²	72.3	1%	0.005	33%	0.332	C	S	.	.	H	α-helix	trans	-66.5	-37.5	-175.4	-70.5	170.1	0	0	0	111.7	M309 K317 H352 R358 I359 L364 L368	M309-I356 HydrophobicContact CB-CD1 4.37Å; M309-I356 HydrophobicContact CE-CD1 3.51Å; M309-I356 HydrophobicContact SD-CD1 3.81Å; K317-I356 HydrophobicContact CD-CD1 4.25Å; K317-I356 HydrophobicContact CD-CG1 4.12Å; K317-I356 HydrophobicContact CG-CD1 4.13Å; H352-I356 HydrophobicContact CB-CD1 4.14Å; H352-I356 VanDerWaalsContact O-CB 3.28Å; H352-I356 WeakPolarHBondContact O-CB 3.31Å; H352-I356 WeakPolarHBondContact O-CG1 3.21Å; H352-I356 PolarHBondContact O-N 3.1Å; I356-R358 PolarHBondContact O-N 3.36Å; I356-I359 WeakPolarHBondContact O-CB 3.5Å; I356-I359 WeakPolarHBondContact O-CG1 3.42Å; I356-I359 PolarHBondContact O-N 3.02Å; I356-L364 HydrophobicContact CG2-CD1 3.84Å; I356-L364 HydrophobicContact CG2-CD2 3.72Å; I356-L364 HydrophobicContact CG2-CG 3.8Å; I356-L368 HydrophobicContact CG2-CD1 4.03Å; I356-L368 HydrophobicContact CG2-CD2 4.19Å; I356-L368 HydrophobicContact CG2-CG 4.43Å
357	R	88.8	Confident	88.4	Confident	111 Å²	111	68.5 Å²	68.5	42%	0.419	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-15.9	173.4	-79.3	175.4	-178.7	140.1	-0.7	114.3	L353 Q365 L368 D372	L353-R357 WeakPolarHBondContact O-CB 3.29Å; L353-R357 VanDerWaalsContact O-CG 3.3Å; L353-R357 WeakPolarHBondContact O-CG 3.13Å; L353-R357 PolarHBondContact O-N 3.16Å; R357-Q365 PolarHBondContact O-NE2 3.35Å; R357-L368 HydrophobicContact CG-CD1 3.9Å; R357-L368 HydrophobicContact CG-CD2 4.17Å; R357-D372 IonicContact CZ-OD1 2.65Å; R357-D372 IonicContact CZ-OD2 3.04Å; R357-D372 IonicContact NE-OD2 3.87Å; R357-D372 PolarHBondContact NE-OD2 3.05Å; R357-D372 IonicContact NH2-OD1 2.7Å; R357-D372 PolarHBondContact NH2-OD1 2.71Å; R357-D372 IonicContact NH2-OD2 2.65Å; R357-D372 PolarHBondContact NH2-OD2 3.34Å
358	R	88	Confident	88.5	Confident	214 Å²	214	67.1 Å²	67.1	81%	0.808	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	1.9	176.3	-51.1	179.4	-175.7	-167.5	-4.4	113.7	S354 E355 I356	S354-R358 PolarHBondContact O-NE 3.08Å; E355-R358 WeakPolarHBondContact O-CB 3.35Å; E355-R358 PolarHBondContact O-N 2.93Å; E355-R358 VanDerWaalsContact O-N 3.15Å; I356-R358 PolarHBondContact O-N 3.36Å
359	I	90	Very high	88.6	Confident	41 Å²	41	70.6 Å²	70.6	21%	0.21	33%	0.326	C	S	.	.	S	Bend	trans	-96.7	120.4	-178.9	-56.4	176.3	0	0	0	109.1	I314 K317 I356 N361 L364 Q365	I314-I359 HydrophobicContact CD1-CG2 3.93Å; I314-I359 HydrophobicContact CG1-CG2 4.29Å; K317-I359 HydrophobicContact CD-CD1 4.23Å; I356-I359 WeakPolarHBondContact O-CB 3.5Å; I356-I359 WeakPolarHBondContact O-CG1 3.42Å; I356-I359 PolarHBondContact O-N 3.02Å; I359-N361 HydrophobicContact CG2-CB 4.28Å; I359-N361 PolarHBondContact O-N 2.88Å; I359-N361 VanDerWaalsContact O-N 3.1Å; I359-L364 HydrophobicContact CB-CD2 4.39Å; I359-L364 HydrophobicContact CD1-CD2 4.34Å; I359-L364 HydrophobicContact CG2-CD2 4.35Å; I359-Q365 PolarHBondContact O-NE2 3.37Å
360	E	86.4	Confident	88.6	Confident	197 Å²	197	71.3 Å²	71.3	92%	0.921	33%	0.33	S	S	*	.			trans	-77	91.2	173.6	-67.3	176.4	-177.5	0	0	109.8
361	N	92.2	Very high	88.9	Confident	51 Å²	51	65 Å²	65	27%	0.273	31%	0.306	S	S	.	.			trans	-150.2	122.1	174	176.1	-102.3	0	0	0	110.6	I314 I359 E363 L364 Q365	I314-N361 HydrophobicContact CG2-CB 3.88Å; I359-N361 HydrophobicContact CG2-CB 4.28Å; I359-N361 PolarHBondContact O-N 2.88Å; I359-N361 VanDerWaalsContact O-N 3.1Å; N361-E363 PolarHBondContact O-N 3.45Å; N361-L364 HydrophobicContact CB-CB 4.08Å; N361-L364 PolarHBondContact O-N 3.37Å; N361-L364 VanDerWaalsContact OD1-CB 3.3Å; N361-L364 WeakPolarHBondContact OD1-CB 3.38Å; N361-L364 PolarHBondContact OD1-N 3.1Å; N361-Q365 WeakPolarHBondContact O-CB 3.12Å; N361-Q365 VanDerWaalsContact O-CG 3.23Å; N361-Q365 WeakPolarHBondContact O-CG 3.21Å; N361-Q365 PolarHBondContact O-N 3.14Å
362	E	87.7	Confident	89.1	Confident	171 Å²	171	61.8 Å²	61.8	80%	0.799	29%	0.293	S	S	*	.	H	α-helix	trans	-59.5	-49.3	-171.9	-63	176.8	165.1	0	0	113	L364 Q365 V366	E362-L364 PolarHBondContact O-N 2.63Å; E362-Q365 PolarHBondContact O-N 3.41Å; E362-V366 WeakPolarHBondContact O-CG2 3.28Å; E362-V366 PolarHBondContact O-N 2.59Å
363	E	87.1	Confident	89.1	Confident	40 Å²	40	66.1 Å²	66.1	19%	0.187	31%	0.313	C	S	.	.	H	α-helix	trans	-58.1	-45.8	177.9	175.8	176.5	171.1	0	0	112	K268 N361 V366 Q367 Q1153	K268-E363 IonicContact NZ-OE1 2.65Å; K268-E363 PolarHBondContact NZ-OE1 3.04Å; N361-E363 PolarHBondContact O-N 3.45Å; E363-V366 PolarHBondContact O-N 3.35Å; E363-Q367 WeakPolarHBondContact O-CG 3.31Å; E363-Q367 PolarHBondContact O-N 3.3Å; E363-Q367 VanDerWaalsContact O-N 3.09Å; E363-Q1153 VanDerWaalsContact CD-NE2 3.33Å; E363-Q1153 HydrophobicContact CG-CG 3.83Å; E363-Q1153 PolarHBondContact OE2-NE2 3.1Å
364	L	90.9	Very high	89.1	Confident	0 Å²	0	66.1 Å²	66.1	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-68.6	-37.6	-180	-171.1	52.3	0	0	0	112.2	I314 K317 M321 I356 I359 N361 E362 Q367 L368	I314-L364 HydrophobicContact CG2-CD2 4.02Å; K317-L364 HydrophobicContact CB-CD1 4.22Å; K317-L364 HydrophobicContact CB-CD2 4.19Å; M321-L364 HydrophobicContact CB-CD1 4.45Å; I356-L364 HydrophobicContact CG2-CD1 3.84Å; I356-L364 HydrophobicContact CG2-CD2 3.72Å; I356-L364 HydrophobicContact CG2-CG 3.8Å; I359-L364 HydrophobicContact CB-CD2 4.39Å; I359-L364 HydrophobicContact CD1-CD2 4.34Å; I359-L364 HydrophobicContact CG2-CD2 4.35Å; N361-L364 HydrophobicContact CB-CB 4.08Å; N361-L364 PolarHBondContact O-N 3.37Å; N361-L364 VanDerWaalsContact OD1-CB 3.3Å; N361-L364 WeakPolarHBondContact OD1-CB 3.38Å; N361-L364 PolarHBondContact OD1-N 3.1Å; E362-L364 PolarHBondContact O-N 2.63Å; L364-Q367 PolarHBondContact O-N 2.69Å; L364-L368 VanDerWaalsContact O-CG 3.3Å; L364-L368 WeakPolarHBondContact O-CG 3.4Å; L364-L368 PolarHBondContact O-N 3.22Å
365	Q	90.9	Very high	89.2	Confident	59 Å²	59	63.3 Å²	63.3	28%	0.276	29%	0.293	S	S	.	.	H	α-helix	trans	-68.5	-35.1	175.4	-66.7	-71	-15.7	0	0	111.7	R357 I359 N361 E362 L368 N369	R357-Q365 PolarHBondContact O-NE2 3.35Å; I359-Q365 PolarHBondContact O-NE2 3.37Å; N361-Q365 WeakPolarHBondContact O-CB 3.12Å; N361-Q365 VanDerWaalsContact O-CG 3.23Å; N361-Q365 WeakPolarHBondContact O-CG 3.21Å; N361-Q365 PolarHBondContact O-N 3.14Å; E362-Q365 PolarHBondContact O-N 3.41Å; Q365-L368 PolarHBondContact O-N 2.89Å; Q365-N369 WeakPolarHBondContact O-CB 3.38Å; Q365-N369 PolarHBondContact O-N 3.12Å; Q365-N369 PolarHBondContact O-OD1 2.96Å
366	V	90.6	Very high	89.2	Confident	45 Å²	45	64.1 Å²	64.1	27%	0.273	30%	0.297	S	S	.	.	H	α-helix	trans	-60.3	-46	169.2	167.7	0	0	0	0	111.1	E362 E363 L368 N369 V370	E362-V366 WeakPolarHBondContact O-CG2 3.28Å; E362-V366 PolarHBondContact O-N 2.59Å; E363-V366 PolarHBondContact O-N 3.35Å; V366-L368 VanDerWaalsContact C-N 3.34Å; V366-L368 PolarHBondContact O-N 3.43Å; V366-N369 PolarHBondContact O-N 2.86Å; V366-V370 VanDerWaalsContact O-CG2 3.31Å; V366-V370 WeakPolarHBondContact O-CG2 3.29Å; V366-V370 PolarHBondContact O-N 3.41Å
367	Q	92.4	Very high	89.1	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	30%	0.303	C	S	.	.	H	α-helix	trans	-67.2	-32.2	177.9	-60.1	-50.2	-46.5	0	0	113.2	M321 Q322 N325 E363 L364 F371 L1152 F1158	M321-Q367 HydrophobicContact CB-CB 3.93Å; M321-Q367 HydrophobicContact CG-CB 3.62Å; Q322-Q367 HydrophobicContact CB-CG 4.41Å; N325-Q367 PolarHBondContact ND2-O 3.32Å; N325-Q367 PolarHBondContact ND2-OE1 2.56Å; E363-Q367 WeakPolarHBondContact O-CG 3.31Å; E363-Q367 PolarHBondContact O-N 3.3Å; E363-Q367 VanDerWaalsContact O-N 3.09Å; L364-Q367 PolarHBondContact O-N 2.69Å; Q367-F371 PolarHBondContact O-N 3.1Å; Q367-L1152 PolarHBondContact NE2-O 2.72Å; Q367-F1158 VanDerWaalsContact OE1-CE2 3.22Å
368	L	92	Very high	89.1	Confident	2 Å²	2	60 Å²	60	1%	0.01	28%	0.283	C	S	.	.	H	α-helix	trans	-67.7	-47.7	173	-72.5	166.9	0	0	0	111.6	L353 I356 R357 L364 Q365 V366 V370 F371 D372	L353-L368 HydrophobicContact CD2-CD2 3.48Å; L353-L368 VanDerWaalsContact CD2-CD2 3.48Å; I356-L368 HydrophobicContact CG2-CD1 4.03Å; I356-L368 HydrophobicContact CG2-CD2 4.19Å; I356-L368 HydrophobicContact CG2-CG 4.43Å; R357-L368 HydrophobicContact CG-CD1 3.9Å; R357-L368 HydrophobicContact CG-CD2 4.17Å; L364-L368 VanDerWaalsContact O-CG 3.3Å; L364-L368 WeakPolarHBondContact O-CG 3.4Å; L364-L368 PolarHBondContact O-N 3.22Å; Q365-L368 PolarHBondContact O-N 2.89Å; V366-L368 VanDerWaalsContact C-N 3.34Å; V366-L368 PolarHBondContact O-N 3.43Å; L368-V370 VanDerWaalsContact C-N 3.33Å; L368-V370 PolarHBondContact O-N 2.85Å; L368-F371 WeakPolarHBondContact O-CB 3.44Å; L368-F371 PolarHBondContact O-N 3.26Å; L368-F371 VanDerWaalsContact O-N 3.13Å; L368-D372 PolarHBondContact O-N 2.8Å
369	N	89.8	Confident	88.9	Confident	87 Å²	87	50.9 Å²	50.9	47%	0.465	25%	0.253	S	S	.	.	H	α-helix	trans	-59.9	-42.7	177.4	-68.7	-7.1	0	0	0	111.3	Q365 V366 F371 D372 E373	Q365-N369 WeakPolarHBondContact O-CB 3.38Å; Q365-N369 PolarHBondContact O-N 3.12Å; Q365-N369 PolarHBondContact O-OD1 2.96Å; V366-N369 PolarHBondContact O-N 2.86Å; N369-F371 VanDerWaalsContact C-N 3.33Å; N369-F371 PolarHBondContact O-N 3.02Å; N369-D372 PolarHBondContact O-N 3.32Å; N369-E373 VanDerWaalsContact O-CB 3.26Å; N369-E373 WeakPolarHBondContact O-CB 3.18Å; N369-E373 VanDerWaalsContact O-CG 3.31Å; N369-E373 WeakPolarHBondContact O-CG 3.34Å; N369-E373 PolarHBondContact O-N 2.93Å
370	V	90.1	Very high	88.6	Confident	14 Å²	14	51.9 Å²	51.9	9%	0.085	26%	0.258	C	S	.	.	H	α-helix	trans	-58.9	-42.8	174.5	165.4	0	0	0	0	112	N325 V366 L368 Q374 F1158	N325-V370 HydrophobicContact CB-CG1 4.11Å; V366-V370 VanDerWaalsContact O-CG2 3.31Å; V366-V370 WeakPolarHBondContact O-CG2 3.29Å; V366-V370 PolarHBondContact O-N 3.41Å; L368-V370 VanDerWaalsContact C-N 3.33Å; L368-V370 PolarHBondContact O-N 2.85Å; V370-Q374 VanDerWaalsContact O-CB 3.29Å; V370-Q374 WeakPolarHBondContact O-CB 3.44Å; V370-Q374 VanDerWaalsContact O-CG 3.25Å; V370-Q374 WeakPolarHBondContact O-CG 3.33Å; V370-Q374 PolarHBondContact O-N 3.43Å; V370-F1158 HydrophobicContact CB-CD2 4.34Å; V370-F1158 HydrophobicContact CG1-CB 3.54Å; V370-F1158 HydrophobicContact CG1-CD2 3.63Å; V370-F1158 HydrophobicContact CG1-CE2 4.43Å; V370-F1158 HydrophobicContact CG1-CG 3.71Å; V370-F1158 HydrophobicContact CG2-CB 4.27Å; V370-F1158 HydrophobicContact CG2-CD2 3.97Å
371	F	91.6	Very high	88.5	Confident	5 Å²	5	45.2 Å²	45.2	2%	0.022	23%	0.229	C	C	.	.	H	α-helix	trans	-66.4	-41.1	179.5	-177.4	-92	0	0	0	112.1	M321 I324 N325 I328 R341 L349 L353 Q367 L368 N369 A375	M321-F371 HydrophobicContact CE-CB 3.33Å; M321-F371 HydrophobicContact CE-CD1 4.11Å; M321-F371 HydrophobicContact CE-CD2 3.35Å; M321-F371 HydrophobicContact CE-CE2 4.12Å; M321-F371 HydrophobicContact CE-CG 3.33Å; I324-F371 HydrophobicContact CG2-CD2 4.15Å; I324-F371 HydrophobicContact CG2-CE2 4.04Å; N325-F371 WeakPolarHBondContact OD1-CB 3.46Å; I328-F371 HydrophobicContact CD1-CD2 4.18Å; I328-F371 HydrophobicContact CD1-CE2 3.74Å; R341-F371 HydrophobicContact CG-CE2 3.94Å; R341-F371 HydrophobicContact CG-CZ 3.65Å; L349-F371 HydrophobicContact CD2-CE2 4.13Å; L349-F371 HydrophobicContact CD2-CZ 4.07Å; L353-F371 HydrophobicContact CD1-CD1 4.28Å; L353-F371 HydrophobicContact CD1-CE1 3.7Å; L353-F371 HydrophobicContact CD1-CZ 4.16Å; Q367-F371 PolarHBondContact O-N 3.1Å; L368-F371 WeakPolarHBondContact O-CB 3.44Å; L368-F371 PolarHBondContact O-N 3.26Å; L368-F371 VanDerWaalsContact O-N 3.13Å; N369-F371 VanDerWaalsContact C-N 3.33Å; N369-F371 PolarHBondContact O-N 3.02Å; F371-A375 WeakPolarHBondContact O-CB 3.29Å; F371-A375 PolarHBondContact O-N 3.49Å
372	D	89.5	Confident	88.1	Confident	46 Å²	46	44.6 Å²	44.6	25%	0.246	23%	0.225	C	C	.	.	H	α-helix	trans	-74.5	-43.7	-180	-71.3	-31.7	0	0	0	111.7	R357 L368 N369 Q374 A375 E376	R357-D372 IonicContact CZ-OD1 2.65Å; R357-D372 IonicContact CZ-OD2 3.04Å; R357-D372 IonicContact NE-OD2 3.87Å; R357-D372 PolarHBondContact NE-OD2 3.05Å; R357-D372 IonicContact NH2-OD1 2.7Å; R357-D372 PolarHBondContact NH2-OD1 2.71Å; R357-D372 IonicContact NH2-OD2 2.65Å; R357-D372 PolarHBondContact NH2-OD2 3.34Å; L368-D372 PolarHBondContact O-N 2.8Å; N369-D372 PolarHBondContact O-N 3.32Å; D372-Q374 VanDerWaalsContact C-N 3.28Å; D372-Q374 PolarHBondContact O-N 2.81Å; D372-A375 WeakPolarHBondContact O-CB 3.19Å; D372-A375 PolarHBondContact O-N 2.87Å; D372-A375 VanDerWaalsContact O-N 3.08Å; D372-E376 PolarHBondContact O-N 3.39Å
373	E	87.7	Confident	87.9	Confident	116 Å²	116	43.5 Å²	43.5	54%	0.542	21%	0.214	S	C	.	.	H	α-helix	trans	-57.1	-40.8	171.2	-77	179.2	-168.1	0	0	111.3	N369 E376 D377	N369-E373 VanDerWaalsContact O-CB 3.26Å; N369-E373 WeakPolarHBondContact O-CB 3.18Å; N369-E373 VanDerWaalsContact O-CG 3.31Å; N369-E373 WeakPolarHBondContact O-CG 3.34Å; N369-E373 PolarHBondContact O-N 2.93Å; E373-E376 PolarHBondContact O-N 3.05Å; E373-D377 WeakPolarHBondContact O-CB 3.46Å; E373-D377 PolarHBondContact O-N 2.81Å
374	Q	87.4	Confident	87.6	Confident	6 Å²	6	42.2 Å²	42.2	3%	0.028	21%	0.211	C	C	.	.	H	α-helix	trans	-73.2	-28.5	176.1	-74.9	-171.8	17.5	0	0	113.6	S329 R341 V370 D372 D378 F1158	S329-Q374 PolarHBondContact OG-NE2 3.05Å; S329-Q374 PolarHBondContact OG-OE1 3.08Å; R341-Q374 VanDerWaalsContact NH2-C 3.25Å; R341-Q374 PolarHBondContact NH2-O 3.41Å; R341-Q374 VanDerWaalsContact NH2-O 3.14Å; V370-Q374 VanDerWaalsContact O-CB 3.29Å; V370-Q374 WeakPolarHBondContact O-CB 3.44Å; V370-Q374 VanDerWaalsContact O-CG 3.25Å; V370-Q374 WeakPolarHBondContact O-CG 3.33Å; V370-Q374 PolarHBondContact O-N 3.43Å; D372-Q374 VanDerWaalsContact C-N 3.28Å; D372-Q374 PolarHBondContact O-N 2.81Å; Q374-D378 VanDerWaalsContact O-CB 3.32Å; Q374-D378 WeakPolarHBondContact O-CB 3.45Å; Q374-D378 PolarHBondContact O-N 3.47Å; Q374-F1158 PolarHBondContact NE2-O 3.5Å
375	A	87.5	Confident	87.2	Confident	4 Å²	4	46.5 Å²	46.5	3%	0.033	23%	0.227	C	C	.	.	H	α-helix	trans	-71.4	-34.8	173	0	0	0	0	0	111.3	F371 D372 S379 N453 G454	F371-A375 WeakPolarHBondContact O-CB 3.29Å; F371-A375 PolarHBondContact O-N 3.49Å; D372-A375 WeakPolarHBondContact O-CB 3.19Å; D372-A375 PolarHBondContact O-N 2.87Å; D372-A375 VanDerWaalsContact O-N 3.08Å; A375-S379 WeakPolarHBondContact O-CB 3.27Å; A375-S379 PolarHBondContact O-N 3.14Å; A375-S379 VanDerWaalsContact O-N 3.11Å; A375-N453 HydrophobicContact CB-CB 4.45Å; A375-N453 WeakPolarHBondContact CB-O 3.24Å; A375-N453 CarbonylContact O-C 3.47Å; A375-G454 PolarHBondContact O-N 3.25Å
376	E	85.8	Confident	86.8	Confident	137 Å²	137	46.6 Å²	46.6	64%	0.64	23%	0.23	S	C	*	.	H	α-helix	trans	-69.5	-48.6	170.3	-70.3	-174.5	172.3	0	0	111.5	D372 E373 D378 S379 D380	D372-E376 PolarHBondContact O-N 3.39Å; E373-E376 PolarHBondContact O-N 3.05Å; E376-D378 VanDerWaalsContact C-N 3.33Å; E376-D378 PolarHBondContact O-N 3.23Å; E376-S379 CarbonylContact O-C 2.89Å; E376-S379 WeakPolarHBondContact O-CB 3.44Å; E376-S379 PolarHBondContact O-N 2.94Å; E376-S379 VanDerWaalsContact O-N 3.1Å; E376-D380 WeakPolarHBondContact O-CB 3.49Å; E376-D380 PolarHBondContact O-N 3.2Å
377	D	84.6	Confident	86.2	Confident	24 Å²	24	48.6 Å²	48.6	13%	0.128	24%	0.236	C	C	.	.	H	α-helix	trans	-54.1	-47	174.5	-97.1	-4.1	0	0	0	111.7	E373 S379 D380 D381 R1162	E373-D377 WeakPolarHBondContact O-CB 3.46Å; E373-D377 PolarHBondContact O-N 2.81Å; D377-S379 VanDerWaalsContact C-N 3.33Å; D377-S379 PolarHBondContact O-N 3.19Å; D377-D380 PolarHBondContact O-N 2.92Å; D377-D381 PolarHBondContact O-N 2.71Å; D377-R1162 IonicContact OD1-CZ 2.65Å; D377-R1162 VanDerWaalsContact OD1-CZ 3.28Å; D377-R1162 IonicContact OD1-NE 2.75Å; D377-R1162 PolarHBondContact OD1-NE 3.11Å; D377-R1162 IonicContact OD1-NH2 3.17Å; D377-R1162 PolarHBondContact OD1-NH2 3.46Å; D377-R1162 IonicContact OD2-NE 2.67Å
378	D	87.8	Confident	85.5	Confident	0 Å²	0	51.2 Å²	51.2	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-67.5	-32.9	179.1	-69.4	-29.3	0	0	0	112.2	L334 R337 R341 Q374 E376 L382 R1160	L334-D378 HydrophobicContact CD1-CB 3.74Å; R337-D378 IonicContact CZ-OD1 2.71Å; R337-D378 VanDerWaalsContact CZ-OD1 3.23Å; R337-D378 IonicContact NE-OD1 2.79Å; R337-D378 PolarHBondContact NE-OD1 3.31Å; R337-D378 IonicContact NE-OD2 3.98Å; R337-D378 IonicContact NH2-OD1 3.39Å; R337-D378 PolarHBondContact NH2-OD1 3.28Å; R341-D378 IonicContact CZ-OD2 3.82Å; R341-D378 VanDerWaalsContact CZ-OD2 3.24Å; R341-D378 IonicContact NH1-OD2 3.71Å; R341-D378 PolarHBondContact NH1-OD2 3.15Å; R341-D378 IonicContact NH2-OD2 3.48Å; R341-D378 PolarHBondContact NH2-OD2 3.09Å; Q374-D378 VanDerWaalsContact O-CB 3.32Å; Q374-D378 WeakPolarHBondContact O-CB 3.45Å; Q374-D378 PolarHBondContact O-N 3.47Å; E376-D378 VanDerWaalsContact C-N 3.33Å; E376-D378 PolarHBondContact O-N 3.23Å; D378-L382 WeakPolarHBondContact O-CB 3.28Å; D378-L382 PolarHBondContact O-N 2.87Å; D378-L382 VanDerWaalsContact O-N 3.12Å; D378-R1160 IonicContact OD1-CZ 2.78Å; D378-R1160 IonicContact OD1-NH1 2.63Å; D378-R1160 PolarHBondContact OD1-NH1 3.29Å; D378-R1160 IonicContact OD1-NH2 2.87Å; D378-R1160 IonicContact OD2-NH1 2.85Å; D378-R1160 IonicContact OD2-NH2 3.04Å; D378-R1160 PolarHBondContact OD2-NH2 3.44Å
379	S	85.4	Confident	84.9	Confident	24 Å²	24	55.4 Å²	55.4	17%	0.168	27%	0.271	C	S	.	.	H	α-helix	trans	-70.6	-33.8	172.5	-170.7	0	0	0	0	112.4	A375 E376 D377 R383	A375-S379 WeakPolarHBondContact O-CB 3.27Å; A375-S379 PolarHBondContact O-N 3.14Å; A375-S379 VanDerWaalsContact O-N 3.11Å; E376-S379 CarbonylContact O-C 2.89Å; E376-S379 WeakPolarHBondContact O-CB 3.44Å; E376-S379 PolarHBondContact O-N 2.94Å; E376-S379 VanDerWaalsContact O-N 3.1Å; D377-S379 VanDerWaalsContact C-N 3.33Å; D377-S379 PolarHBondContact O-N 3.19Å; S379-R383 WeakPolarHBondContact O-CB 3.46Å; S379-R383 PolarHBondContact O-N 2.7Å
380	D	84.1	Confident	84.3	Confident	61 Å²	61	56.3 Å²	56.3	33%	0.326	27%	0.268	S	S	.	.	H	α-helix	trans	-79.8	-31.9	-177.8	-159.2	61.6	0	0	0	111.5	E376 D377 R383 G384 R1165	E376-D380 WeakPolarHBondContact O-CB 3.49Å; E376-D380 PolarHBondContact O-N 3.2Å; D377-D380 PolarHBondContact O-N 2.92Å; D380-R383 PolarHBondContact O-N 3.15Å; D380-G384 PolarHBondContact O-N 3.11Å; D380-R1165 VanDerWaalsContact C-NH2 3.32Å; D380-R1165 PolarHBondContact O-NH2 3.5Å; D380-R1165 IonicContact OD2-CZ 3.09Å; D380-R1165 IonicContact OD2-NH1 2.64Å; D380-R1165 PolarHBondContact OD2-NH1 3.41Å; D380-R1165 IonicContact OD2-NH2 3.72Å; D380-R1165 PolarHBondContact OD2-NH2 3.18Å
381	D	83.6	Confident	83.4	Confident	57 Å²	57	59.6 Å²	59.6	31%	0.305	28%	0.284	S	S	.	.	H	α-helix	trans	-71.1	-37.9	169.3	-76.7	-12.6	0	0	0	112.3	L334 D377 R383 G384 R385 R1165	L334-D381 HydrophobicContact CD1-CB 4.39Å; L334-D381 HydrophobicContact CD2-CB 4.16Å; D377-D381 PolarHBondContact O-N 2.71Å; D381-R383 VanDerWaalsContact C-N 3.31Å; D381-R383 PolarHBondContact O-N 2.97Å; D381-G384 WeakPolarHBondContact O-CA 3.08Å; D381-G384 PolarHBondContact O-N 3.31Å; D381-G384 VanDerWaalsContact O-N 3.14Å; D381-R385 PolarHBondContact O-N 3.35Å; D381-R1165 IonicContact OD1-CZ 2.73Å; D381-R1165 IonicContact OD1-NE 3.59Å; D381-R1165 PolarHBondContact OD1-NE 3.01Å; D381-R1165 VanDerWaalsContact OD1-NE 3.13Å; D381-R1165 IonicContact OD1-NH2 3.62Å; D381-R1165 PolarHBondContact OD1-NH2 2.62Å
382	L	84.1	Confident	82.4	Confident	38 Å²	38	67.1 Å²	67.1	20%	0.199	32%	0.32	C	S	.	.	H	α-helix	trans	-63.2	-38.8	171.6	-174.6	64.6	0	0	0	111.5	L334 D378 G384 R385 L386 L450	L334-L382 HydrophobicContact CD2-CB 4.19Å; L334-L382 HydrophobicContact CD2-CD1 4.45Å; D378-L382 WeakPolarHBondContact O-CB 3.28Å; D378-L382 PolarHBondContact O-N 2.87Å; D378-L382 VanDerWaalsContact O-N 3.12Å; L382-G384 VanDerWaalsContact C-N 3.33Å; L382-R385 PolarHBondContact O-N 2.89Å; L382-L386 PolarHBondContact O-N 3.42Å; L382-L450 HydrophobicContact CB-CD2 4.47Å; L382-L450 HydrophobicContact CD2-CD2 3.91Å; L382-L450 HydrophobicContact CG-CD2 3.75Å
383	R	82.4	Confident	81.4	Confident	149 Å²	149	66.5 Å²	66.5	56%	0.562	32%	0.315	S	S	*	.	H	α-helix	trans	-67.3	-32.5	172.1	-173.6	173.3	-178.8	-85.1	-12.6	112.4	S379 D380 D381 L386 E387 L450	S379-R383 WeakPolarHBondContact O-CB 3.46Å; S379-R383 PolarHBondContact O-N 2.7Å; D380-R383 PolarHBondContact O-N 3.15Å; D381-R383 VanDerWaalsContact C-N 3.31Å; D381-R383 PolarHBondContact O-N 2.97Å; R383-L386 PolarHBondContact O-N 2.97Å; R383-E387 PolarHBondContact O-N 3.45Å; R383-L450 HydrophobicContact CG-CD1 4.4Å
384	G	80.8	Confident	80.2	Confident	12 Å²	12	67.6 Å²	67.6	12%	0.124	33%	0.325	C	S	.	.	H	α-helix	trans	-59	-55.7	170.2	0	0	0	0	0	111.9	D380 D381 L382 L386 E387 D388	D380-G384 PolarHBondContact O-N 3.11Å; D381-G384 WeakPolarHBondContact O-CA 3.08Å; D381-G384 PolarHBondContact O-N 3.31Å; D381-G384 VanDerWaalsContact O-N 3.14Å; L382-G384 VanDerWaalsContact C-N 3.33Å; G384-L386 PolarHBondContact O-N 3.36Å; G384-L386 VanDerWaalsContact O-N 3.14Å; G384-E387 PolarHBondContact O-N 3.01Å; G384-D388 PolarHBondContact O-N 3.11Å
385	R	83.4	Confident	78.8	Confident	90 Å²	90	74.4 Å²	74.4	34%	0.34	36%	0.362	S	S	.	.	H	α-helix	trans	-53	-36.6	176.9	-74.4	-178.8	171.4	179.9	-2.4	113.1	D335 D381 L382 I389	D335-R385 IonicContact OD1-CZ 2.81Å; D335-R385 IonicContact OD1-NH1 3.43Å; D335-R385 PolarHBondContact OD1-NH1 3.25Å; D335-R385 IonicContact OD2-CZ 2.61Å; D335-R385 VanDerWaalsContact OD2-CZ 3.25Å; D335-R385 IonicContact OD2-NH1 3.89Å; D335-R385 PolarHBondContact OD2-NH1 2.93Å; D335-R385 IonicContact OD2-NH2 2.64Å; D335-R385 PolarHBondContact OD2-NH2 3.37Å; D381-R385 PolarHBondContact O-N 3.35Å; L382-R385 PolarHBondContact O-N 2.89Å; R385-I389 WeakPolarHBondContact O-CD1 3.4Å; R385-I389 VanDerWaalsContact O-CG1 3.22Å; R385-I389 WeakPolarHBondContact O-CG1 3.47Å; R385-I389 PolarHBondContact O-N 2.98Å; R385-I389 VanDerWaalsContact O-N 3.08Å
386	L	82.3	Confident	78	Confident	62 Å²	62	77.6 Å²	77.6	33%	0.325	38%	0.378	S	S	.	.	H	α-helix	trans	-66.9	-37.6	176.3	178.7	62.6	0	0	0	112.8	L382 R383 G384 R390 L450	L382-L386 PolarHBondContact O-N 3.42Å; R383-L386 PolarHBondContact O-N 2.97Å; G384-L386 PolarHBondContact O-N 3.36Å; G384-L386 VanDerWaalsContact O-N 3.14Å; L386-R390 WeakPolarHBondContact O-CG 3.47Å; L386-R390 PolarHBondContact O-N 3.19Å; L386-R390 VanDerWaalsContact O-N 3.13Å; L386-L450 HydrophobicContact CD2-CD1 3.87Å
387	E	78.9	Confident	77.7	Confident	87 Å²	87	77 Å²	77	41%	0.407	38%	0.384	S	S	.	.	H	α-helix	trans	-74.8	-35.9	177.9	-158.3	75.7	166.7	0	0	111.3	R383 G384 I389 R390 I391	R383-E387 PolarHBondContact O-N 3.45Å; G384-E387 PolarHBondContact O-N 3.01Å; E387-I389 PolarHBondContact O-N 3.08Å; E387-R390 WeakPolarHBondContact O-CB 3.32Å; E387-R390 PolarHBondContact O-N 3.35Å; E387-R390 WeakPolarHBondContact OE2-CD 3.42Å; E387-R390 IonicContact OE2-CZ 2.63Å; E387-R390 IonicContact OE2-NH1 3.22Å; E387-R390 PolarHBondContact OE2-NH1 2.87Å; E387-I391 HydrophobicContact CG-CD1 4.18Å; E387-I391 VanDerWaalsContact O-CG1 3.26Å; E387-I391 WeakPolarHBondContact O-CG1 3.42Å; E387-I391 PolarHBondContact O-N 3.5Å
388	D	77.7	Confident	77.6	Confident	55 Å²	55	84.5 Å²	84.5	29%	0.294	41%	0.41	S	S	.	.	H	α-helix	trans	-57.1	-49.7	171.1	-61	-32.8	0	0	0	110.6	G384 R390 I391 E392	G384-D388 PolarHBondContact O-N 3.11Å; D388-R390 VanDerWaalsContact C-N 3.3Å; D388-R390 PolarHBondContact O-N 2.88Å; D388-I391 PolarHBondContact O-N 3.35Å; D388-I391 VanDerWaalsContact O-N 3.12Å; D388-E392 PolarHBondContact O-N 3.48Å
389	I	78.1	Confident	77.3	Confident	89 Å²	89	90 Å²	90	46%	0.456	44%	0.436	S	S	.	.	H	α-helix	trans	-58.3	-39.7	176.1	-69.9	166.3	0	0	0	111.6	R385 E387 M393	R385-I389 WeakPolarHBondContact O-CD1 3.4Å; R385-I389 VanDerWaalsContact O-CG1 3.22Å; R385-I389 WeakPolarHBondContact O-CG1 3.47Å; R385-I389 PolarHBondContact O-N 2.98Å; R385-I389 VanDerWaalsContact O-N 3.08Å; E387-I389 PolarHBondContact O-N 3.08Å; I389-M393 HydrophobicContact CG2-CG 4.42Å; I389-M393 HydrophobicContact CG2-SD 4.04Å; I389-M393 VanDerWaalsContact O-CB 3.27Å; I389-M393 WeakPolarHBondContact O-CB 3.33Å; I389-M393 VanDerWaalsContact O-CG 3.32Å; I389-M393 WeakPolarHBondContact O-CG 3.24Å; I389-M393 PolarHBondContact O-N 3.38Å
390	R	77.3	Confident	77.2	Confident	107 Å²	107	91.3 Å²	91.3	40%	0.404	44%	0.443	S	S	.	.	H	α-helix	trans	-64.3	-44.5	175	-74.3	165.1	167.5	-174.3	-6.2	111.8	L386 E387 D388 E392 M393 D394	L386-R390 WeakPolarHBondContact O-CG 3.47Å; L386-R390 PolarHBondContact O-N 3.19Å; L386-R390 VanDerWaalsContact O-N 3.13Å; E387-R390 WeakPolarHBondContact O-CB 3.32Å; E387-R390 PolarHBondContact O-N 3.35Å; E387-R390 WeakPolarHBondContact OE2-CD 3.42Å; E387-R390 IonicContact OE2-CZ 2.63Å; E387-R390 IonicContact OE2-NH1 3.22Å; E387-R390 PolarHBondContact OE2-NH1 2.87Å; D388-R390 VanDerWaalsContact C-N 3.3Å; D388-R390 PolarHBondContact O-N 2.88Å; R390-E392 VanDerWaalsContact C-N 3.28Å; R390-E392 PolarHBondContact O-N 2.95Å; R390-M393 PolarHBondContact O-N 2.99Å; R390-D394 WeakPolarHBondContact O-CA 3.38Å; R390-D394 VanDerWaalsContact O-CB 3.3Å; R390-D394 WeakPolarHBondContact O-CB 3.45Å; R390-D394 PolarHBondContact O-N 2.82Å
391	I	72.3	Confident	77.4	Confident	82 Å²	82	92 Å²	92	42%	0.421	44%	0.443	S	S	.	.	H	α-helix	trans	-67.9	-27.4	-178.4	-68.5	165.1	0	0	0	112.5	E387 D388	E387-I391 HydrophobicContact CG-CD1 4.18Å; E387-I391 VanDerWaalsContact O-CG1 3.26Å; E387-I391 WeakPolarHBondContact O-CG1 3.42Å; E387-I391 PolarHBondContact O-N 3.5Å; D388-I391 PolarHBondContact O-N 3.35Å; D388-I391 VanDerWaalsContact O-N 3.12Å
392	E	69.1	Low	77.5	Confident	164 Å²	164	93.2 Å²	93.2	77%	0.766	45%	0.45	S	S	*	.	H	α-helix	trans	-85.4	-34.2	174.7	-68.3	-167.8	151.2	0	0	113.4	D388 R390	D388-E392 PolarHBondContact O-N 3.48Å; R390-E392 VanDerWaalsContact C-N 3.28Å; R390-E392 PolarHBondContact O-N 2.95Å
393	M	69.4	Low	77.6	Confident	32 Å²	32	95.7 Å²	95.7	16%	0.158	46%	0.462	C	S	.	.	H	α-helix	trans	-112	12.8	-169.2	-52.2	-166.5	78.4	0	0	115.4	I389 R390 D395 E399 V400 I403	I389-M393 HydrophobicContact CG2-CG 4.42Å; I389-M393 HydrophobicContact CG2-SD 4.04Å; I389-M393 VanDerWaalsContact O-CB 3.27Å; I389-M393 WeakPolarHBondContact O-CB 3.33Å; I389-M393 VanDerWaalsContact O-CG 3.32Å; I389-M393 WeakPolarHBondContact O-CG 3.24Å; I389-M393 PolarHBondContact O-N 3.38Å; R390-M393 PolarHBondContact O-N 2.99Å; M393-D395 PolarHBondContact O-N 2.97Å; M393-D395 VanDerWaalsContact O-N 3.11Å; M393-E399 HydrophobicContact CE-CB 3.66Å; M393-E399 HydrophobicContact CE-CG 3.52Å; M393-V400 HydrophobicContact CB-CG2 3.88Å; M393-V400 HydrophobicContact CE-CB 4.37Å; M393-V400 HydrophobicContact CE-CG2 3.72Å; M393-V400 HydrophobicContact SD-CG2 3.87Å; M393-I403 HydrophobicContact CE-CD1 3.74Å; M393-I403 HydrophobicContact SD-CD1 4.31Å
394	D	61.5	Low	77.9	Confident	140 Å²	140	92.4 Å²	92.4	75%	0.749	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-24.3	-173.1	-131.3	4.2	0	0	0	114.8	R390	R390-D394 WeakPolarHBondContact O-CA 3.38Å; R390-D394 VanDerWaalsContact O-CB 3.3Å; R390-D394 WeakPolarHBondContact O-CB 3.45Å; R390-D394 PolarHBondContact O-N 2.82Å
395	D	58.6	Low	78.3	Confident	148 Å²	148	95.4 Å²	95.4	79%	0.791	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.3	-22.1	-171.2	-92.5	-17.9	0	0	0	115.3	M393 K1100	M393-D395 PolarHBondContact O-N 2.97Å; M393-D395 VanDerWaalsContact O-N 3.11Å; D395-K1100 IonicContact OD2-NZ 2.76Å
396	D	72	Confident	78.7	Confident	72 Å²	72	96.4 Å²	96.4	39%	0.385	48%	0.477	S	S	.	.			trans	-145	110.1	177	-162.4	-7.8	0	0	0	115.7	R398 E399	D396-R398 PolarHBondContact O-N 2.99Å; D396-R398 VanDerWaalsContact O-N 3.12Å; D396-R398 WeakPolarHBondContact OD1-CB 3.25Å; D396-R398 VanDerWaalsContact OD1-CG 3.23Å; D396-R398 WeakPolarHBondContact OD1-CG 3.29Å; D396-R398 PolarHBondContact OD1-N 3.26Å; D396-R398 IonicContact OD1-NE 2.67Å; D396-R398 IonicContact OD2-NE 2.82Å; D396-E399 PolarHBondContact O-N 2.76Å
397	V	78.8	Confident	79	Confident	124 Å²	124	98.3 Å²	98.3	75%	0.752	49%	0.491	S	S	*	.	H	α-helix	trans	-57.7	-23.7	174.6	-178.6	0	0	0	0	113.3	F401	V397-F401 PolarHBondContact O-N 3.04Å; V397-F401 VanDerWaalsContact O-N 3.11Å
398	R	81.6	Confident	79.6	Confident	181 Å²	181	95.2 Å²	95.2	68%	0.683	48%	0.478	S	S	*	.	H	α-helix	trans	-69.1	-37.7	179.7	-61.6	172.2	-151.9	-132.8	4.6	112.7	D396 F401 D402	D396-R398 PolarHBondContact O-N 2.99Å; D396-R398 VanDerWaalsContact O-N 3.12Å; D396-R398 WeakPolarHBondContact OD1-CB 3.25Å; D396-R398 VanDerWaalsContact OD1-CG 3.23Å; D396-R398 WeakPolarHBondContact OD1-CG 3.29Å; D396-R398 PolarHBondContact OD1-N 3.26Å; D396-R398 IonicContact OD1-NE 2.67Å; D396-R398 IonicContact OD2-NE 2.82Å; R398-F401 WeakPolarHBondContact O-CB 3.19Å; R398-F401 PolarHBondContact O-N 3.44Å; R398-D402 PolarHBondContact O-N 3.46Å
399	E	81.6	Confident	80.2	Confident	117 Å²	117	96.7 Å²	96.7	55%	0.547	48%	0.482	S	S	.	.	H	α-helix	trans	-67.5	-42.1	-178.2	-165.6	174.8	-172.7	0	0	110.2	M393 D396 F401 D402 I403	M393-E399 HydrophobicContact CE-CB 3.66Å; M393-E399 HydrophobicContact CE-CG 3.52Å; D396-E399 PolarHBondContact O-N 2.76Å; E399-F401 VanDerWaalsContact C-N 3.3Å; E399-F401 PolarHBondContact O-N 3.02Å; E399-D402 PolarHBondContact O-N 2.93Å; E399-I403 WeakPolarHBondContact O-CG1 3.37Å; E399-I403 PolarHBondContact O-N 3.28Å
400	V	83.8	Confident	80.7	Confident	50 Å²	50	99 Å²	99	30%	0.303	50%	0.495	S	S	.	.	H	α-helix	trans	-57.8	-44.1	170.9	-173.3	0	0	0	0	110.8	M393 L404	M393-V400 HydrophobicContact CB-CG2 3.88Å; M393-V400 HydrophobicContact CE-CB 4.37Å; M393-V400 HydrophobicContact CE-CG2 3.72Å; M393-V400 HydrophobicContact SD-CG2 3.87Å; V400-L404 HydrophobicContact CG1-CD1 4.05Å; V400-L404 WeakPolarHBondContact O-CB 3.49Å; V400-L404 VanDerWaalsContact O-CG 3.27Å; V400-L404 WeakPolarHBondContact O-CG 3.34Å; V400-L404 PolarHBondContact O-N 3Å
401	F	87.6	Confident	81.5	Confident	75 Å²	75	96.4 Å²	96.4	33%	0.329	49%	0.493	S	S	.	.	H	α-helix	trans	-63.1	-45.5	177.2	171	-99.6	0	0	0	112.8	V397 R398 E399 L404 F405 F417 M421	V397-F401 PolarHBondContact O-N 3.04Å; V397-F401 VanDerWaalsContact O-N 3.11Å; R398-F401 WeakPolarHBondContact O-CB 3.19Å; R398-F401 PolarHBondContact O-N 3.44Å; E399-F401 VanDerWaalsContact C-N 3.3Å; E399-F401 PolarHBondContact O-N 3.02Å; F401-L404 PolarHBondContact O-N 2.86Å; F401-F405 HydrophobicContact CE1-CB 4.4Å; F401-F405 HydrophobicContact CE2-CB 4.49Å; F401-F405 HydrophobicContact CZ-CB 4.17Å; F401-F405 HydrophobicContact CZ-CG 4.48Å; F401-F405 WeakPolarHBondContact O-CB 3.35Å; F401-F405 PolarHBondContact O-N 2.92Å; F401-F417 HydrophobicContact CD2-CZ 4.3Å; F401-F417 AromaticContact CE2-CE1 3.92Å; F401-F417 HydrophobicContact CE2-CE1 3.92Å; F401-F417 HydrophobicContact CE2-CZ 4.08Å; F401-M421 HydrophobicContact CD2-CE 4.13Å; F401-M421 HydrophobicContact CE2-CE 3.34Å; F401-M421 HydrophobicContact CE2-SD 3.68Å; F401-M421 HydrophobicContact CZ-CE 3.91Å; F401-M421 HydrophobicContact CZ-SD 4.35Å
402	D	86.6	Confident	82.4	Confident	84 Å²	84	101.9 Å²	101.9	45%	0.449	51%	0.514	S	S	.	.	H	α-helix	trans	-68.4	-35.6	-178.6	-76.2	-23.1	0	0	0	111.6	R398 E399 F405 N406	R398-D402 PolarHBondContact O-N 3.46Å; E399-D402 PolarHBondContact O-N 2.93Å; D402-F405 PolarHBondContact O-N 3.47Å; D402-N406 WeakPolarHBondContact O-CB 3.28Å; D402-N406 PolarHBondContact O-N 3.45Å; D402-N406 PolarHBondContact O-ND2 2.92Å
403	I	86.3	Confident	83.4	Confident	89 Å²	89	96.2 Å²	96.2	46%	0.456	50%	0.495	S	S	.	.	H	α-helix	trans	-65.4	-44.9	172.1	-66.8	177.5	0	0	0	111	M393 E399 N406 T407	M393-I403 HydrophobicContact CE-CD1 3.74Å; M393-I403 HydrophobicContact SD-CD1 4.31Å; E399-I403 WeakPolarHBondContact O-CG1 3.37Å; E399-I403 PolarHBondContact O-N 3.28Å; I403-N406 PolarHBondContact O-N 3.02Å; I403-T407 PolarHBondContact O-N 3.43Å; I403-T407 PolarHBondContact O-OG1 3.41Å
404	L	88.5	Confident	84.4	Confident	81 Å²	81	98.2 Å²	98.2	42%	0.424	50%	0.504	S	S	.	.	H	α-helix	trans	-63.5	-41.2	176.1	-73.9	172.4	0	0	0	111.9	V400 F401 T407 V408 F417	V400-L404 HydrophobicContact CG1-CD1 4.05Å; V400-L404 WeakPolarHBondContact O-CB 3.49Å; V400-L404 VanDerWaalsContact O-CG 3.27Å; V400-L404 WeakPolarHBondContact O-CG 3.34Å; V400-L404 PolarHBondContact O-N 3Å; F401-L404 PolarHBondContact O-N 2.86Å; L404-T407 WeakPolarHBondContact CA-OG1 3.29Å; L404-T407 PolarHBondContact O-N 3.3Å; L404-T407 PolarHBondContact O-OG1 2.96Å; L404-V408 WeakPolarHBondContact O-CG2 3.29Å; L404-V408 PolarHBondContact O-N 2.98Å; L404-V408 VanDerWaalsContact O-N 3.14Å; L404-F417 HydrophobicContact CB-CE2 4.16Å; L404-F417 HydrophobicContact CB-CZ 4.01Å
405	F	90	Very high	85.7	Confident	75 Å²	75	95.2 Å²	95.2	33%	0.329	49%	0.494	S	S	.	.	H	α-helix	trans	-64.1	-47.9	177	179.8	-114.2	0	0	0	111.2	F401 D402 T407 V408 K409	F401-F405 HydrophobicContact CE1-CB 4.4Å; F401-F405 HydrophobicContact CE2-CB 4.49Å; F401-F405 HydrophobicContact CZ-CB 4.17Å; F401-F405 HydrophobicContact CZ-CG 4.48Å; F401-F405 WeakPolarHBondContact O-CB 3.35Å; F401-F405 PolarHBondContact O-N 2.92Å; D402-F405 PolarHBondContact O-N 3.47Å; F405-T407 PolarHBondContact O-N 3.43Å; F405-V408 PolarHBondContact O-N 3.15Å; F405-K409 HydrophobicContact CE1-CD 3.96Å; F405-K409 HydrophobicContact CZ-CD 4.11Å; F405-K409 HydrophobicContact CZ-CG 4.4Å; F405-K409 WeakPolarHBondContact O-CB 3.5Å; F405-K409 PolarHBondContact O-N 2.86Å
406	N	90.6	Very high	87.3	Confident	111 Å²	111	94.3 Å²	94.3	59%	0.594	49%	0.485	S	S	*	.	H	α-helix	trans	-65.2	-23.8	179	-75.1	-56.6	0	0	0	113.8	D402 I403	D402-N406 WeakPolarHBondContact O-CB 3.28Å; D402-N406 PolarHBondContact O-N 3.45Å; D402-N406 PolarHBondContact O-ND2 2.92Å; I403-N406 PolarHBondContact O-N 3.02Å
407	T	88.2	Confident	88.2	Confident	101 Å²	101	92.7 Å²	92.7	62%	0.62	48%	0.475	S	S	*	.	H	α-helix	trans	-86.2	-23.6	175.5	46.2	0	0	0	0	114.2	I403 L404 F405	I403-T407 PolarHBondContact O-N 3.43Å; I403-T407 PolarHBondContact O-OG1 3.41Å; L404-T407 WeakPolarHBondContact CA-OG1 3.29Å; L404-T407 PolarHBondContact O-N 3.3Å; L404-T407 PolarHBondContact O-OG1 2.96Å; F405-T407 PolarHBondContact O-N 3.43Å
408	V	93.2	Very high	88.8	Confident	22 Å²	22	91.2 Å²	91.2	13%	0.133	46%	0.462	C	S	.	.	H	α-helix	trans	-94.7	-22.3	173.4	-56.8	0	0	0	0	114.4	L404 F405 S411 A413 E414 F417	L404-V408 WeakPolarHBondContact O-CG2 3.29Å; L404-V408 PolarHBondContact O-N 2.98Å; L404-V408 VanDerWaalsContact O-N 3.14Å; F405-V408 PolarHBondContact O-N 3.15Å; V408-S411 VanDerWaalsContact O-CB 3.23Å; V408-S411 WeakPolarHBondContact O-CB 3.44Å; V408-S411 PolarHBondContact O-N 3.24Å; V408-S411 PolarHBondContact O-OG 2.8Å; V408-A413 HydrophobicContact CB-CB 4.38Å; V408-A413 HydrophobicContact CG1-CB 4.36Å; V408-E414 WeakPolarHBondContact O-CB 3.43Å; V408-F417 HydrophobicContact CB-CB 4.32Å; V408-F417 HydrophobicContact CG1-CB 4.25Å; V408-F417 HydrophobicContact CG1-CD2 4.37Å; V408-F417 HydrophobicContact CG1-CG 4.29Å; V408-F417 HydrophobicContact CG2-CB 3.89Å; V408-F417 HydrophobicContact CG2-CD1 3.65Å; V408-F417 HydrophobicContact CG2-CE1 4.25Å; V408-F417 HydrophobicContact CG2-CG 3.78Å
409	K	88.6	Confident	89.4	Confident	87 Å²	87	84.7 Å²	84.7	38%	0.378	44%	0.444	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	143.7	-177.2	178.1	-179	174.9	-66.7	0	112.3	F405 S411 E414	F405-K409 HydrophobicContact CE1-CD 3.96Å; F405-K409 HydrophobicContact CZ-CD 4.11Å; F405-K409 HydrophobicContact CZ-CG 4.4Å; F405-K409 WeakPolarHBondContact O-CB 3.5Å; F405-K409 PolarHBondContact O-N 2.86Å; K409-S411 PolarHBondContact O-N 2.61Å; K409-S411 VanDerWaalsContact O-N 3.08Å; K409-E414 WeakPolarHBondContact CA-OE2 3.45Å
410	D	90.3	Very high	89.9	Confident	137 Å²	137	84.5 Å²	84.5	73%	0.733	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.5	11.3	-175.5	-54.8	-57	0	0	0	114.2	E414	D410-E414 PolarHBondContact N-OE2 3.38Å
411	S	94.2	Very high	90.3	Very high	52 Å²	52	85.6 Å²	85.6	36%	0.364	45%	0.449	S	S	.	.	S	Bend	trans	-109.2	166.7	179.5	90.8	0	0	0	0	113	V408 K409 A413 E414	V408-S411 VanDerWaalsContact O-CB 3.23Å; V408-S411 WeakPolarHBondContact O-CB 3.44Å; V408-S411 PolarHBondContact O-N 3.24Å; V408-S411 PolarHBondContact O-OG 2.8Å; K409-S411 PolarHBondContact O-N 2.61Å; K409-S411 VanDerWaalsContact O-N 3.08Å; S411-A413 PolarHBondContact O-N 3.49Å; S411-A413 VanDerWaalsContact O-N 3.14Å; S411-A413 WeakPolarHBondContact OG-CB 3.22Å; S411-A413 PolarHBondContact OG-N 3.39Å; S411-E414 WeakPolarHBondContact O-CB 3.5Å; S411-E414 PolarHBondContact O-N 3.02Å
412	K	89.5	Confident	90.5	Very high	198 Å²	198	86.9 Å²	86.9	86%	0.861	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-10.6	172.9	-65.5	178.7	-178	172.5	0	113.8	H416	K412-H416 PolarHBondContact O-CE1 3.1Å; K412-H416 PolarHBondContact O-ND1 2.93Å
413	A	90.2	Very high	90.8	Very high	44 Å²	44	88.3 Å²	88.3	36%	0.364	46%	0.46	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85	-19.1	174.8	0	0	0	0	0	113.2	V408 S411 S415 H416 F417	V408-A413 HydrophobicContact CB-CB 4.38Å; V408-A413 HydrophobicContact CG1-CB 4.36Å; S411-A413 PolarHBondContact O-N 3.49Å; S411-A413 VanDerWaalsContact O-N 3.14Å; S411-A413 WeakPolarHBondContact OG-CB 3.22Å; S411-A413 PolarHBondContact OG-N 3.39Å; A413-S415 PolarHBondContact O-N 3.13Å; A413-H416 WeakPolarHBondContact O-CA 3.48Å; A413-H416 WeakPolarHBondContact O-CB 3.28Å; A413-H416 PolarHBondContact O-N 3.49Å; A413-F417 PolarHBondContact O-N 3.29Å
414	E	90.3	Very high	91	Very high	75 Å²	75	87.1 Å²	87.1	35%	0.35	45%	0.454	S	S	.	.	H	α-helix	trans	-56.3	-45.8	-172.6	-165.4	-175.4	131	0	0	112.9	V408 K409 D410 S411 H416 F417 L418	V408-E414 WeakPolarHBondContact O-CB 3.43Å; K409-E414 WeakPolarHBondContact CA-OE2 3.45Å; D410-E414 PolarHBondContact N-OE2 3.38Å; S411-E414 WeakPolarHBondContact O-CB 3.5Å; S411-E414 PolarHBondContact O-N 3.02Å; E414-H416 VanDerWaalsContact C-N 3.28Å; E414-H416 PolarHBondContact O-N 3.11Å; E414-F417 PolarHBondContact O-N 3.32Å; E414-L418 WeakPolarHBondContact O-CB 3.37Å; E414-L418 PolarHBondContact O-N 3.4Å
415	S	90.6	Very high	91	Very high	77 Å²	77	90.2 Å²	90.2	54%	0.538	47%	0.47	S	S	.	.	H	α-helix	trans	-65	-30.7	177.5	56	0	0	0	0	113.3	A413 S419	A413-S415 PolarHBondContact O-N 3.13Å; S415-S419 WeakPolarHBondContact O-CB 3.36Å; S415-S419 PolarHBondContact O-N 3.43Å; S415-S419 VanDerWaalsContact O-N 3.11Å
416	H	90.5	Very high	91	Very high	128 Å²	128	93.2 Å²	93.2	59%	0.593	49%	0.489	S	S	*	.	H	α-helix	trans	-76.4	-41.1	176.6	-59.6	92.1	0	0	0	110.9	K412 A413 E414 S419 L420	K412-H416 PolarHBondContact O-CE1 3.1Å; K412-H416 PolarHBondContact O-ND1 2.93Å; A413-H416 WeakPolarHBondContact O-CA 3.48Å; A413-H416 WeakPolarHBondContact O-CB 3.28Å; A413-H416 PolarHBondContact O-N 3.49Å; E414-H416 VanDerWaalsContact C-N 3.28Å; E414-H416 PolarHBondContact O-N 3.11Å; H416-S419 WeakPolarHBondContact O-CB 3.35Å; H416-S419 PolarHBondContact O-N 2.97Å; H416-L420 WeakPolarHBondContact O-CG 3.43Å; H416-L420 PolarHBondContact O-N 2.63Å
417	F	92.3	Very high	91	Very high	39 Å²	39	89.1 Å²	89.1	17%	0.171	47%	0.467	C	S	.	.	H	α-helix	trans	-63.9	-46.4	174.5	-177	-104.5	0	0	0	112	F401 L404 V408 A413 E414 S419 L420 M421	F401-F417 HydrophobicContact CD2-CZ 4.3Å; F401-F417 AromaticContact CE2-CE1 3.92Å; F401-F417 HydrophobicContact CE2-CE1 3.92Å; F401-F417 HydrophobicContact CE2-CZ 4.08Å; L404-F417 HydrophobicContact CB-CE2 4.16Å; L404-F417 HydrophobicContact CB-CZ 4.01Å; V408-F417 HydrophobicContact CB-CB 4.32Å; V408-F417 HydrophobicContact CG1-CB 4.25Å; V408-F417 HydrophobicContact CG1-CD2 4.37Å; V408-F417 HydrophobicContact CG1-CG 4.29Å; V408-F417 HydrophobicContact CG2-CB 3.89Å; V408-F417 HydrophobicContact CG2-CD1 3.65Å; V408-F417 HydrophobicContact CG2-CE1 4.25Å; V408-F417 HydrophobicContact CG2-CG 3.78Å; A413-F417 PolarHBondContact O-N 3.29Å; E414-F417 PolarHBondContact O-N 3.32Å; F417-S419 VanDerWaalsContact C-N 3.26Å; F417-S419 PolarHBondContact O-N 2.97Å; F417-L420 WeakPolarHBondContact O-CB 3.47Å; F417-L420 PolarHBondContact O-N 3.22Å; F417-L420 VanDerWaalsContact O-N 3.14Å; F417-M421 HydrophobicContact CD1-SD 4.07Å; F417-M421 HydrophobicContact CE1-CG 4.31Å; F417-M421 HydrophobicContact CE1-SD 3.66Å; F417-M421 HydrophobicContact CZ-SD 4.27Å; F417-M421 WeakPolarHBondContact O-CG 3.32Å; F417-M421 PolarHBondContact O-N 2.96Å
418	L	90.2	Very high	90.9	Very high	93 Å²	93	93.2 Å²	93.2	49%	0.487	47%	0.471	S	S	.	.	H	α-helix	trans	-55.9	-42.6	171.6	177.5	60.6	0	0	0	111.5	E414 M421 Q422	E414-L418 WeakPolarHBondContact O-CB 3.37Å; E414-L418 PolarHBondContact O-N 3.4Å; L418-M421 PolarHBondContact O-N 3.29Å; L418-Q422 HydrophobicContact CD1-CG 4.48Å; L418-Q422 VanDerWaalsContact O-CG 3.25Å; L418-Q422 WeakPolarHBondContact O-CG 3.15Å; L418-Q422 PolarHBondContact O-N 3.19Å
419	S	93.6	Very high	90.2	Very high	43 Å²	43	98.9 Å²	98.9	30%	0.301	50%	0.5	S	S	.	.	H	α-helix	trans	-64.8	-42.5	176.3	-166.9	0	0	0	0	112.1	S415 H416 F417 M421 Q422 H423	S415-S419 WeakPolarHBondContact O-CB 3.36Å; S415-S419 PolarHBondContact O-N 3.43Å; S415-S419 VanDerWaalsContact O-N 3.11Å; H416-S419 WeakPolarHBondContact O-CB 3.35Å; H416-S419 PolarHBondContact O-N 2.97Å; F417-S419 VanDerWaalsContact C-N 3.26Å; F417-S419 PolarHBondContact O-N 2.97Å; S419-M421 PolarHBondContact O-N 2.7Å; S419-Q422 WeakPolarHBondContact O-CB 3.25Å; S419-Q422 PolarHBondContact O-N 2.98Å; S419-H423 PolarHBondContact O-N 2.87Å; S419-H423 PolarHBondContact O-ND1 2.89Å; S419-H423 PolarHBondContact OG-CE1 3.43Å
420	L	93.4	Very high	90.3	Very high	114 Å²	114	98 Å²	98	60%	0.597	50%	0.5	S	S	*	.	H	α-helix	trans	-58.6	-48.4	174.8	-72.8	168.8	0	0	0	111.2	H416 F417 Q422 H423 L424	H416-L420 WeakPolarHBondContact O-CG 3.43Å; H416-L420 PolarHBondContact O-N 2.63Å; F417-L420 WeakPolarHBondContact O-CB 3.47Å; F417-L420 PolarHBondContact O-N 3.22Å; F417-L420 VanDerWaalsContact O-N 3.14Å; L420-Q422 VanDerWaalsContact C-N 3.31Å; L420-Q422 PolarHBondContact O-N 2.82Å; L420-H423 PolarHBondContact O-N 3.29Å; L420-H423 VanDerWaalsContact O-N 3.13Å; L420-L424 WeakPolarHBondContact O-CG 3.28Å; L420-L424 PolarHBondContact O-N 2.87Å
421	M	91.8	Very high	89.4	Confident	73 Å²	73	101.5 Å²	101.5	36%	0.36	50%	0.504	S	S	.	.	H	α-helix	trans	-57.1	-43.5	174.9	-66.3	-177.4	78.4	0	0	112.3	F401 F417 L418 S419 H423 L424 L425	F401-M421 HydrophobicContact CD2-CE 4.13Å; F401-M421 HydrophobicContact CE2-CE 3.34Å; F401-M421 HydrophobicContact CE2-SD 3.68Å; F401-M421 HydrophobicContact CZ-CE 3.91Å; F401-M421 HydrophobicContact CZ-SD 4.35Å; F417-M421 HydrophobicContact CD1-SD 4.07Å; F417-M421 HydrophobicContact CE1-CG 4.31Å; F417-M421 HydrophobicContact CE1-SD 3.66Å; F417-M421 HydrophobicContact CZ-SD 4.27Å; F417-M421 WeakPolarHBondContact O-CG 3.32Å; F417-M421 PolarHBondContact O-N 2.96Å; L418-M421 PolarHBondContact O-N 3.29Å; S419-M421 PolarHBondContact O-N 2.7Å; M421-H423 VanDerWaalsContact C-N 3.31Å; M421-H423 PolarHBondContact O-N 3.28Å; M421-L424 PolarHBondContact O-N 3.12Å; M421-L425 WeakPolarHBondContact O-CG 3.12Å; M421-L425 PolarHBondContact O-N 3.47Å; M421-L425 VanDerWaalsContact O-N 3.13Å
422	Q	92.2	Very high	88.4	Confident	101 Å²	101	105.1 Å²	105.1	47%	0.472	52%	0.519	S	S	.	.	H	α-helix	trans	-61.7	-37.2	177.2	-73.8	169.7	0.1	0	0	112.4	L418 S419 L420 L425	L418-Q422 HydrophobicContact CD1-CG 4.48Å; L418-Q422 VanDerWaalsContact O-CG 3.25Å; L418-Q422 WeakPolarHBondContact O-CG 3.15Å; L418-Q422 PolarHBondContact O-N 3.19Å; S419-Q422 WeakPolarHBondContact O-CB 3.25Å; S419-Q422 PolarHBondContact O-N 2.98Å; L420-Q422 VanDerWaalsContact C-N 3.31Å; L420-Q422 PolarHBondContact O-N 2.82Å; Q422-L425 PolarHBondContact O-N 3.45Å
423	H	91.8	Very high	87.7	Confident	115 Å²	115	97.5 Å²	97.5	53%	0.532	49%	0.492	S	S	.	.	H	α-helix	trans	-68.9	-37.6	173.5	-69.8	96.2	0	0	0	112.4	S419 L420 M421 L425 L426	S419-H423 PolarHBondContact O-N 2.87Å; S419-H423 PolarHBondContact O-ND1 2.89Å; S419-H423 PolarHBondContact OG-CE1 3.43Å; L420-H423 PolarHBondContact O-N 3.29Å; L420-H423 VanDerWaalsContact O-N 3.13Å; M421-H423 VanDerWaalsContact C-N 3.31Å; M421-H423 PolarHBondContact O-N 3.28Å; H423-L425 PolarHBondContact O-N 2.94Å; H423-L426 WeakPolarHBondContact O-CB 3.23Å; H423-L426 PolarHBondContact O-N 3.47Å
424	L	91.8	Very high	87.5	Confident	63 Å²	63	99.6 Å²	99.6	33%	0.33	49%	0.491	S	S	.	.	H	α-helix	trans	-62.8	-30.4	175.3	-64.5	179.5	0	0	0	112.7	L420 M421 L426 I427 Y438 I441	L420-L424 WeakPolarHBondContact O-CG 3.28Å; L420-L424 PolarHBondContact O-N 2.87Å; M421-L424 PolarHBondContact O-N 3.12Å; L424-L426 PolarHBondContact O-N 2.96Å; L424-I427 HydrophobicContact CD2-CD1 3.76Å; L424-I427 WeakPolarHBondContact O-CG1 3.37Å; L424-I427 PolarHBondContact O-N 2.76Å; L424-Y438 HydrophobicContact CD2-CE1 4.1Å; L424-I441 HydrophobicContact CD2-CD1 3.84Å; L424-I441 HydrophobicContact CD2-CG2 4.47Å
425	L	88.4	Confident	87.2	Confident	147 Å²	147	99.5 Å²	99.5	77%	0.77	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-16.4	173.1	-66.5	174.7	0	0	0	113.8	M421 Q422 H423	M421-L425 WeakPolarHBondContact O-CG 3.12Å; M421-L425 PolarHBondContact O-N 3.47Å; M421-L425 VanDerWaalsContact O-N 3.13Å; Q422-L425 PolarHBondContact O-N 3.45Å; H423-L425 PolarHBondContact O-N 2.94Å
426	L	90.5	Very high	86.7	Confident	137 Å²	137	99.3 Å²	99.3	72%	0.717	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	-6.1	177.6	-57.3	178.1	0	0	0	113.2	H423 L424 R428	H423-L426 WeakPolarHBondContact O-CB 3.23Å; H423-L426 PolarHBondContact O-N 3.47Å; L424-L426 PolarHBondContact O-N 2.96Å; L426-R428 PolarHBondContact O-N 2.69Å
427	I	89.6	Confident	86.5	Confident	25 Å²	25	98.9 Å²	98.9	13%	0.128	48%	0.481	C	S	.	.	S	Bend	trans	-66.4	121.6	176.7	-60.4	173.2	0	0	0	109.2	L424 R434 Y437 Y438 I441	L424-I427 HydrophobicContact CD2-CD1 3.76Å; L424-I427 WeakPolarHBondContact O-CG1 3.37Å; L424-I427 PolarHBondContact O-N 2.76Å; I427-R434 HydrophobicContact CG2-CG 3.96Å; I427-Y437 HydrophobicContact CG2-CD2 3.94Å; I427-Y437 HydrophobicContact CG2-CG 4.04Å; I427-Y438 HydrophobicContact CD1-CD1 4.21Å; I427-Y438 HydrophobicContact CD1-CE1 3.76Å; I427-Y438 HydrophobicContact CD1-CE2 4.35Å; I427-I441 HydrophobicContact CD1-CD1 3.74Å
428	R	85.6	Confident	86.3	Confident	188 Å²	188	101.1 Å²	101.1	71%	0.709	49%	0.489	S	S	*	.			trans	-60.4	139.2	-177.3	-70.9	178.1	58.2	176.2	-5.4	111.6	L426 D430	L426-R428 PolarHBondContact O-N 2.69Å; R428-D430 PolarHBondContact O-N 3.32Å
429	N	80.1	Confident	86	Confident	140 Å²	140	99.2 Å²	99.2	75%	0.749	48%	0.477	S	S	*	.			trans	-79	62	177.2	-162.5	44.9	0	0	0	112.7	R434	N429-R434 PolarHBondContact OD1-NH1 2.8Å
430	D	88.8	Confident	85.6	Confident	69 Å²	69	99 Å²	99	37%	0.369	47%	0.472	S	S	.	.			trans	-103.2	129	174.8	-177.1	-75.5	0	0	0	110.1	R428 L432 A433 R434	R428-D430 PolarHBondContact O-N 3.32Å; D430-L432 VanDerWaalsContact C-N 3.3Å; D430-L432 PolarHBondContact O-N 3.46Å; D430-L432 PolarHBondContact OD1-N 3.32Å; D430-A433 HydrophobicContact CB-CB 4.11Å; D430-A433 PolarHBondContact OD1-N 3.01Å; D430-R434 WeakPolarHBondContact O-CB 3.47Å; D430-R434 PolarHBondContact O-N 3.24Å
431	Y	72.4	Confident	85.4	Confident	210 Å²	210	96.3 Å²	96.3	82%	0.824	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.6	-32.1	-172.8	179.6	-104.7	0	0	0	114	P435	Y431-P435 VanDerWaalsContact O-CD 3.31Å; Y431-P435 WeakPolarHBondContact O-CD 3.47Å
432	L	72.2	Confident	85.1	Confident	129 Å²	129	96.9 Å²	96.9	68%	0.675	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-38.4	-176.8	-63.1	177.7	0	0	0	112.1	D430 Q436	D430-L432 VanDerWaalsContact C-N 3.3Å; D430-L432 PolarHBondContact O-N 3.46Å; D430-L432 PolarHBondContact OD1-N 3.32Å; L432-Q436 WeakPolarHBondContact O-CG 3.49Å
433	A	76.3	Confident	84.7	Confident	37 Å²	37	96.1 Å²	96.1	31%	0.306	46%	0.459	S	S	.	.	H	α-helix	trans	-83.4	-32.5	-178	0	0	0	0	0	113.3	D430 Q436 Y437	D430-A433 HydrophobicContact CB-CB 4.11Å; D430-A433 PolarHBondContact OD1-N 3.01Å; A433-Q436 PolarHBondContact O-N 3.4Å; A433-Y437 HydrophobicContact CB-CD2 4.38Å; A433-Y437 HydrophobicContact CB-CE2 4.12Å; A433-Y437 VanDerWaalsContact O-CD2 3.23Å; A433-Y437 WeakPolarHBondContact O-CD2 3.39Å; A433-Y437 PolarHBondContact O-N 3.43Å
434	R	85.3	Confident	84.4	Confident	89 Å²	89	91.9 Å²	91.9	34%	0.336	44%	0.442	S	S	.	.	H	α-helix	trans	-59.7	-43.6	-178	-173.1	167.3	-169.6	-160	-7	113.3	I427 N429 D430 Q436 Y437 Y438	I427-R434 HydrophobicContact CG2-CG 3.96Å; N429-R434 PolarHBondContact OD1-NH1 2.8Å; D430-R434 WeakPolarHBondContact O-CB 3.47Å; D430-R434 PolarHBondContact O-N 3.24Å; R434-Q436 VanDerWaalsContact C-N 3.29Å; R434-Q436 PolarHBondContact O-N 3Å; R434-Y437 PolarHBondContact O-N 2.79Å; R434-Y438 HydrophobicContact CG-CD2 3.99Å; R434-Y438 HydrophobicContact CG-CE2 3.64Å; R434-Y438 PolarHBondContact NH2-OH 2.99Å; R434-Y438 VanDerWaalsContact O-CD2 3.26Å; R434-Y438 WeakPolarHBondContact O-CD2 2.97Å; R434-Y438 PolarHBondContact O-N 3.33Å
435	P	83.1	Confident	84.2	Confident	72 Å²	72	93.2 Å²	93.2	47%	0.468	45%	0.449	S	S	.	.	H	α-helix	trans	-59.9	-37.2	172.6	-24.6	35.5	0	0	0	113	Y431 Y438 K439	Y431-P435 VanDerWaalsContact O-CD 3.31Å; Y431-P435 WeakPolarHBondContact O-CD 3.47Å; P435-Y438 PolarHBondContact O-N 2.8Å; P435-K439 VanDerWaalsContact O-CB 3.3Å; P435-K439 WeakPolarHBondContact O-CB 3.3Å; P435-K439 PolarHBondContact O-N 3.23Å
436	Q	81.9	Confident	83.9	Confident	74 Å²	74	87.6 Å²	87.6	35%	0.346	42%	0.423	S	S	.	.	H	α-helix	trans	-71.6	-34	179.8	-52	-57.5	-20.1	0	0	112.3	L432 A433 R434 K439 L440	L432-Q436 WeakPolarHBondContact O-CG 3.49Å; A433-Q436 PolarHBondContact O-N 3.4Å; R434-Q436 VanDerWaalsContact C-N 3.29Å; R434-Q436 PolarHBondContact O-N 3Å; Q436-K439 PolarHBondContact O-N 2.89Å; Q436-L440 VanDerWaalsContact O-CB 3.3Å; Q436-L440 WeakPolarHBondContact O-CB 3.18Å; Q436-L440 PolarHBondContact O-N 3.23Å
437	Y	84.9	Confident	83.4	Confident	118 Å²	118	83.8 Å²	83.8	46%	0.463	40%	0.402	S	S	.	.	H	α-helix	trans	-61.5	-47.6	170.3	-78	-66.9	0	0	0	111.6	I427 A433 R434 L440 I441	I427-Y437 HydrophobicContact CG2-CD2 3.94Å; I427-Y437 HydrophobicContact CG2-CG 4.04Å; A433-Y437 HydrophobicContact CB-CD2 4.38Å; A433-Y437 HydrophobicContact CB-CE2 4.12Å; A433-Y437 VanDerWaalsContact O-CD2 3.23Å; A433-Y437 WeakPolarHBondContact O-CD2 3.39Å; A433-Y437 PolarHBondContact O-N 3.43Å; R434-Y437 PolarHBondContact O-N 2.79Å; Y437-L440 PolarHBondContact O-N 3.22Å; Y437-I441 WeakPolarHBondContact O-CB 3.47Å; Y437-I441 WeakPolarHBondContact O-CD1 3.43Å; Y437-I441 WeakPolarHBondContact O-CG1 3.49Å; Y437-I441 PolarHBondContact O-N 3.1Å
438	Y	89.3	Confident	83	Confident	87 Å²	87	85.8 Å²	85.8	34%	0.341	41%	0.412	S	S	.	.	H	α-helix	trans	-67.1	-39	177.2	-72	-70.6	0	0	0	112.5	L424 I427 R434 P435 I441 D442	L424-Y438 HydrophobicContact CD2-CE1 4.1Å; I427-Y438 HydrophobicContact CD1-CD1 4.21Å; I427-Y438 HydrophobicContact CD1-CE1 3.76Å; I427-Y438 HydrophobicContact CD1-CE2 4.35Å; R434-Y438 HydrophobicContact CG-CD2 3.99Å; R434-Y438 HydrophobicContact CG-CE2 3.64Å; R434-Y438 PolarHBondContact NH2-OH 2.99Å; R434-Y438 VanDerWaalsContact O-CD2 3.26Å; R434-Y438 WeakPolarHBondContact O-CD2 2.97Å; R434-Y438 PolarHBondContact O-N 3.33Å; P435-Y438 PolarHBondContact O-N 2.8Å; Y438-I441 PolarHBondContact O-N 3.16Å; Y438-D442 WeakPolarHBondContact O-CB 3.17Å; Y438-D442 PolarHBondContact O-N 2.6Å
439	K	83.9	Confident	82.8	Confident	53 Å²	53	81.1 Å²	81.1	23%	0.23	40%	0.404	C	S	.	.	H	α-helix	trans	-61.2	-43.1	174.7	-174	174.3	173.6	-177.6	0	112	P435 Q436 I441 E443 M475	P435-K439 VanDerWaalsContact O-CB 3.3Å; P435-K439 WeakPolarHBondContact O-CB 3.3Å; P435-K439 PolarHBondContact O-N 3.23Å; Q436-K439 PolarHBondContact O-N 2.89Å; K439-I441 VanDerWaalsContact C-N 3.33Å; K439-I441 PolarHBondContact O-N 2.9Å; K439-E443 VanDerWaalsContact O-CB 3.29Å; K439-E443 WeakPolarHBondContact O-CB 3.49Å; K439-E443 PolarHBondContact O-N 3.31Å; K439-M475 HydrophobicContact CB-CE 3.97Å; K439-M475 HydrophobicContact CD-CE 3.97Å; K439-M475 HydrophobicContact CG-CE 3.8Å; K439-M475 HydrophobicContact CG-SD 4.47Å
440	L	84.6	Confident	82.8	Confident	38 Å²	38	76.1 Å²	76.1	20%	0.199	38%	0.377	C	S	.	.	H	α-helix	trans	-65.2	-37.3	174.9	-175.7	66.9	0	0	0	111.7	Q436 Y437 C444 L471 I472 M475	Q436-L440 VanDerWaalsContact O-CB 3.3Å; Q436-L440 WeakPolarHBondContact O-CB 3.18Å; Q436-L440 PolarHBondContact O-N 3.23Å; Y437-L440 PolarHBondContact O-N 3.22Å; L440-C444 VanDerWaalsContact O-CB 3.3Å; L440-C444 WeakPolarHBondContact O-CB 3.34Å; L440-C444 PolarHBondContact O-N 3.45Å; L440-C444 PolarHBondContact O-SG 2.98Å; L440-L471 HydrophobicContact CD1-CB 4.44Å; L440-L471 HydrophobicContact CD1-CD2 3.83Å; L440-L471 HydrophobicContact CD1-CG 4.08Å; L440-I472 HydrophobicContact CD1-CG1 4.08Å; L440-M475 HydrophobicContact CB-CE 4.12Å; L440-M475 HydrophobicContact CB-SD 4.06Å; L440-M475 HydrophobicContact CD1-SD 3.77Å
441	I	88.9	Confident	82.3	Confident	58 Å²	58	74.6 Å²	74.6	30%	0.297	37%	0.368	S	S	.	.	H	α-helix	trans	-70.9	-44.4	178.4	-71.2	165	0	0	0	111.2	L424 I427 Y437 Y438 K439 C444 I445	L424-I441 HydrophobicContact CD2-CD1 3.84Å; L424-I441 HydrophobicContact CD2-CG2 4.47Å; I427-I441 HydrophobicContact CD1-CD1 3.74Å; Y437-I441 WeakPolarHBondContact O-CB 3.47Å; Y437-I441 WeakPolarHBondContact O-CD1 3.43Å; Y437-I441 WeakPolarHBondContact O-CG1 3.49Å; Y437-I441 PolarHBondContact O-N 3.1Å; Y438-I441 PolarHBondContact O-N 3.16Å; K439-I441 VanDerWaalsContact C-N 3.33Å; K439-I441 PolarHBondContact O-N 2.9Å; I441-C444 PolarHBondContact O-N 2.77Å; I441-I445 HydrophobicContact CG2-CD1 3.7Å; I441-I445 HydrophobicContact CG2-CG1 4.43Å; I441-I445 WeakPolarHBondContact O-CB 3.42Å; I441-I445 VanDerWaalsContact O-CG1 3.26Å; I441-I445 WeakPolarHBondContact O-CG1 3.34Å; I441-I445 PolarHBondContact O-N 3.5Å
442	D	86.8	Confident	82.1	Confident	85 Å²	85	73.2 Å²	73.2	46%	0.455	37%	0.366	S	S	.	.	H	α-helix	trans	-57.9	-51.8	174.5	-177.5	46.1	0	0	0	110.8	Y438 C444 I445 A446	Y438-D442 WeakPolarHBondContact O-CB 3.17Å; Y438-D442 PolarHBondContact O-N 2.6Å; D442-C444 VanDerWaalsContact C-N 3.3Å; D442-C444 PolarHBondContact O-N 3.22Å; D442-I445 PolarHBondContact O-N 3.16Å; D442-I445 VanDerWaalsContact O-N 3.13Å; D442-A446 WeakPolarHBondContact O-CB 3.5Å; D442-A446 PolarHBondContact O-N 2.7Å
443	E	83.1	Confident	82	Confident	85 Å²	85	68.8 Å²	68.8	40%	0.397	34%	0.343	S	S	.	.	H	α-helix	trans	-66.4	-29.7	179.8	-156.5	88.7	-131	0	0	112.3	K439 Q447 L471	K439-E443 VanDerWaalsContact O-CB 3.29Å; K439-E443 WeakPolarHBondContact O-CB 3.49Å; K439-E443 PolarHBondContact O-N 3.31Å; E443-Q447 WeakPolarHBondContact O-CG 3.39Å; E443-Q447 PolarHBondContact O-N 3.2Å; E443-L471 HydrophobicContact CB-CD1 4.29Å; E443-L471 HydrophobicContact CB-CD2 4.22Å; E443-L471 HydrophobicContact CG-CD1 3.47Å; E443-L471 VanDerWaalsContact CG-CD1 3.47Å; E443-L471 HydrophobicContact CG-CD2 4.28Å; E443-L471 HydrophobicContact CG-CG 4.17Å
444	C	84.3	Confident	81.8	Confident	26 Å²	26	67 Å²	67	18%	0.176	33%	0.329	C	S	.	.	H	α-helix	trans	-68.7	-45.4	169.1	-74.3	0	0	0	0	112.6	L440 I441 D442 A446 Q447 I448	L440-C444 VanDerWaalsContact O-CB 3.3Å; L440-C444 WeakPolarHBondContact O-CB 3.34Å; L440-C444 PolarHBondContact O-N 3.45Å; L440-C444 PolarHBondContact O-SG 2.98Å; I441-C444 PolarHBondContact O-N 2.77Å; D442-C444 VanDerWaalsContact C-N 3.3Å; D442-C444 PolarHBondContact O-N 3.22Å; C444-A446 VanDerWaalsContact C-N 3.34Å; C444-Q447 PolarHBondContact O-N 2.84Å; C444-I448 WeakPolarHBondContact O-CG1 3.21Å; C444-I448 PolarHBondContact O-N 3.17Å
445	I	87.4	Confident	81.5	Confident	91 Å²	91	63.2 Å²	63.2	47%	0.467	32%	0.316	S	S	.	.	H	α-helix	trans	-64.5	-42.2	178	-71	167.3	0	0	0	109.6	I441 D442 Q447 I448 V449	I441-I445 HydrophobicContact CG2-CD1 3.7Å; I441-I445 HydrophobicContact CG2-CG1 4.43Å; I441-I445 WeakPolarHBondContact O-CB 3.42Å; I441-I445 VanDerWaalsContact O-CG1 3.26Å; I441-I445 WeakPolarHBondContact O-CG1 3.34Å; I441-I445 PolarHBondContact O-N 3.5Å; D442-I445 PolarHBondContact O-N 3.16Å; D442-I445 VanDerWaalsContact O-N 3.13Å; I445-Q447 VanDerWaalsContact C-N 3.34Å; I445-Q447 PolarHBondContact O-N 3.24Å; I445-I448 PolarHBondContact O-N 3.21Å; I445-V449 HydrophobicContact CG2-CG2 4.01Å; I445-V449 WeakPolarHBondContact O-CG2 3.35Å; I445-V449 PolarHBondContact O-N 2.96Å
446	A	83.8	Confident	81.3	Confident	28 Å²	28	63.3 Å²	63.3	23%	0.231	31%	0.312	C	S	.	.	H	α-helix	trans	-58	-42.7	175.8	0	0	0	0	0	111.7	D442 C444 I448 L450	D442-A446 WeakPolarHBondContact O-CB 3.5Å; D442-A446 PolarHBondContact O-N 2.7Å; C444-A446 VanDerWaalsContact C-N 3.34Å; A446-I448 VanDerWaalsContact C-N 3.26Å; A446-I448 PolarHBondContact O-N 3.12Å; A446-L450 CarbonylContact O-C 3.48Å; A446-L450 VanDerWaalsContact O-CA 3.27Å; A446-L450 WeakPolarHBondContact O-CA 3.39Å; A446-L450 VanDerWaalsContact O-CB 3.24Å; A446-L450 WeakPolarHBondContact O-CB 3.45Å; A446-L450 PolarHBondContact O-N 3.14Å
447	Q	79.9	Confident	80.9	Confident	57 Å²	57	60.4 Å²	60.4	27%	0.266	30%	0.3	S	S	.	.	H	α-helix	trans	-65.4	-25.3	175	-77.2	-172.3	54.1	0	0	114.6	E443 C444 I445	E443-Q447 WeakPolarHBondContact O-CG 3.39Å; E443-Q447 PolarHBondContact O-N 3.2Å; C444-Q447 PolarHBondContact O-N 2.84Å; I445-Q447 VanDerWaalsContact C-N 3.34Å; I445-Q447 PolarHBondContact O-N 3.24Å
448	I	79.9	Confident	80.3	Confident	67 Å²	67	56.8 Å²	56.8	34%	0.344	29%	0.288	S	S	.	.	H	α-helix	trans	-86.4	-41	179.8	-65.8	166.7	0	0	0	111	C444 I445 A446 V466	C444-I448 WeakPolarHBondContact O-CG1 3.21Å; C444-I448 PolarHBondContact O-N 3.17Å; I445-I448 PolarHBondContact O-N 3.21Å; A446-I448 VanDerWaalsContact C-N 3.26Å; A446-I448 PolarHBondContact O-N 3.12Å; I448-V466 HydrophobicContact CG1-CG2 4.37Å
449	V	83.1	Confident	79.3	Confident	91 Å²	91	60 Å²	60	55%	0.552	31%	0.305	S	S	*	.	H	α-helix	trans	-87	-49.3	-176.7	178.5	0	0	0	0	111.5	I445 H451	I445-V449 HydrophobicContact CG2-CG2 4.01Å; I445-V449 WeakPolarHBondContact O-CG2 3.35Å; I445-V449 PolarHBondContact O-N 2.96Å; V449-H451 PolarHBondContact O-N 3.23Å; V449-H451 VanDerWaalsContact O-N 3.17Å
450	L	79.8	Confident	78.6	Confident	35 Å²	35	64.9 Å²	64.9	18%	0.183	33%	0.326	C	S	.	.	S	Bend	trans	-89.1	50.5	173	-49.7	-179.2	0	0	0	110	L382 R383 L386 A446 K452	L382-L450 HydrophobicContact CB-CD2 4.47Å; L382-L450 HydrophobicContact CD2-CD2 3.91Å; L382-L450 HydrophobicContact CG-CD2 3.75Å; R383-L450 HydrophobicContact CG-CD1 4.4Å; L386-L450 HydrophobicContact CD2-CD1 3.87Å; A446-L450 CarbonylContact O-C 3.48Å; A446-L450 VanDerWaalsContact O-CA 3.27Å; A446-L450 WeakPolarHBondContact O-CA 3.39Å; A446-L450 VanDerWaalsContact O-CB 3.24Å; A446-L450 WeakPolarHBondContact O-CB 3.45Å; A446-L450 PolarHBondContact O-N 3.14Å; L450-K452 PolarHBondContact O-N 2.87Å
451	H	77.6	Confident	77.2	Confident	37 Å²	37	66.4 Å²	66.4	17%	0.171	34%	0.339	C	S	.	.			trans	-63.3	133.9	-178	179.7	-93.9	0	0	0	110.6	V449 N453 G454 P457	V449-H451 PolarHBondContact O-N 3.23Å; V449-H451 VanDerWaalsContact O-N 3.17Å; H451-N453 PolarHBondContact CE1-OD1 3.43Å; H451-N453 PolarHBondContact ND1-OD1 2.74Å; H451-N453 PolarHBondContact O-N 2.92Å; H451-G454 PolarHBondContact O-N 2.89Å; H451-G454 VanDerWaalsContact O-N 3.16Å; H451-P457 HydrophobicContact CB-CG 4.45Å
452	K	68.3	Low	75.5	Confident	180 Å²	180	75.6 Å²	75.6	78%	0.783	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	12	-159.3	-58.9	-173.8	178.1	-177.5	0	118	L450	L450-K452 PolarHBondContact O-N 2.87Å
453	N	71.1	Confident	74.1	Confident	36 Å²	36	80.2 Å²	80.2	19%	0.193	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-137.5	22.4	178.9	76.2	-33.3	0	0	0	113.4	A375 H451 S455	A375-N453 HydrophobicContact CB-CB 4.45Å; A375-N453 WeakPolarHBondContact CB-O 3.24Å; A375-N453 CarbonylContact O-C 3.47Å; H451-N453 PolarHBondContact CE1-OD1 3.43Å; H451-N453 PolarHBondContact ND1-OD1 2.74Å; H451-N453 PolarHBondContact O-N 2.92Å; N453-S455 VanDerWaalsContact C-N 3.32Å; N453-S455 PolarHBondContact O-N 2.75Å
454	G	71.6	Confident	73.1	Confident	1 Å²	1	80.3 Å²	80.3	1%	0.01	39%	0.389	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.5	46.7	176.4	0	0	0	0	0	112.6	R341 A375 H451	R341-G454 PolarHBondContact NH1-O 3Å; A375-G454 PolarHBondContact O-N 3.25Å; H451-G454 PolarHBondContact O-N 2.89Å; H451-G454 VanDerWaalsContact O-N 3.16Å
455	S	77.8	Confident	72	Confident	9 Å²	9	86.9 Å²	86.9	6%	0.063	42%	0.416	C	S	.	.	S	Bend	trans	-161.8	153.7	-176.5	-72.7	0	0	0	0	112.6	R341 S342 N453	R341-S455 WeakPolarHBondContact CB-OG 3.38Å; R341-S455 WeakPolarHBondContact CD-OG 3.28Å; R341-S455 WeakPolarHBondContact CG-OG 3.48Å; S342-S455 WeakPolarHBondContact OG-CB 3.36Å; N453-S455 VanDerWaalsContact C-N 3.32Å; N453-S455 PolarHBondContact O-N 2.75Å
456	D	78.8	Confident	71.1	Confident	73 Å²	73	84.4 Å²	84.4	39%	0.39	41%	0.405	S	S	.	.			trans	-57.6	141.7	175.2	-60.4	-35.7	0	0	0	111.3	S342 R346 D458	S342-D456 PolarHBondContact OG-N 3.45Å; R346-D456 IonicContact NH1-OD2 3.63Å; R346-D456 PolarHBondContact NH1-OD2 3.35Å; D456-D458 PolarHBondContact O-N 3.03Å
457	P	73.7	Confident	70.3	Confident	13 Å²	13	86.6 Å²	86.6	8%	0.084	41%	0.413	C	S	.	.			trans	-59.5	134.1	161.5	-22.1	33.7	0	0	0	111.6	H451 F459 L464	H451-P457 HydrophobicContact CB-CG 4.45Å; P457-F459 HydrophobicContact CB-CE1 4.18Å; P457-F459 HydrophobicContact CB-CE2 4.34Å; P457-F459 HydrophobicContact CB-CZ 3.99Å; P457-F459 HydrophobicContact CG-CZ 4.15Å; P457-F459 WeakPolarHBondContact O-CD2 3.45Å; P457-F459 VanDerWaalsContact O-CE2 3.3Å; P457-F459 WeakPolarHBondContact O-CE2 3.38Å; P457-F459 PolarHBondContact O-N 3.3Å; P457-L464 HydrophobicContact CB-CD1 3.98Å; P457-L464 HydrophobicContact CG-CD1 4.46Å
458	D	72.4	Confident	70	Confident	42 Å²	42	87.9 Å²	87.9	23%	0.225	42%	0.421	C	S	.	.			trans	-74.4	95.1	171.5	173.6	33.2	0	0	0	110.9	R346 D456 K460 C461	R346-D458 HydrophobicContact CG-CB 4.28Å; D456-D458 PolarHBondContact O-N 3.03Å; D458-K460 PolarHBondContact O-N 3.16Å; D458-K460 VanDerWaalsContact OD1-CB 3.24Å; D458-K460 WeakPolarHBondContact OD1-CB 3.32Å; D458-K460 PolarHBondContact OD1-N 2.86Å; D458-C461 HydrophobicContact CB-CB 4.43Å; D458-C461 WeakPolarHBondContact O-CB 3.23Å; D458-C461 PolarHBondContact O-N 3.12Å; D458-C461 WeakPolarHBondContact OD2-CB 3.39Å; D458-C461 PolarHBondContact OD2-N 2.98Å
459	F	69.7	Low	69.6	Low	156 Å²	156	92.1 Å²	92.1	68%	0.684	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-9.1	176.1	-57.5	-75.1	0	0	0	114.2	P457 C461	P457-F459 HydrophobicContact CB-CE1 4.18Å; P457-F459 HydrophobicContact CB-CE2 4.34Å; P457-F459 HydrophobicContact CB-CZ 3.99Å; P457-F459 HydrophobicContact CG-CZ 4.15Å; P457-F459 WeakPolarHBondContact O-CD2 3.45Å; P457-F459 VanDerWaalsContact O-CE2 3.3Å; P457-F459 WeakPolarHBondContact O-CE2 3.38Å; P457-F459 PolarHBondContact O-N 3.3Å; F459-C461 VanDerWaalsContact C-N 3.31Å
460	K	67.6	Low	69	Low	155 Å²	155	88.6 Å²	88.6	67%	0.674	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-26.4	167.9	-57.8	179	-179.5	177	0	111.2	D458 R462	D458-K460 PolarHBondContact O-N 3.16Å; D458-K460 VanDerWaalsContact OD1-CB 3.24Å; D458-K460 WeakPolarHBondContact OD1-CB 3.32Å; D458-K460 PolarHBondContact OD1-N 2.86Å; K460-R462 PolarHBondContact O-N 3.44Å
461	C	56.8	Low	68.6	Low	70 Å²	70	87.6 Å²	87.6	47%	0.473	42%	0.416	S	S	.	.	S	Bend	trans	-78.1	118.3	176.5	-170.2	0	0	0	0	111.1	D458 F459 K463	D458-C461 HydrophobicContact CB-CB 4.43Å; D458-C461 WeakPolarHBondContact O-CB 3.23Å; D458-C461 PolarHBondContact O-N 3.12Å; D458-C461 WeakPolarHBondContact OD2-CB 3.39Å; D458-C461 PolarHBondContact OD2-N 2.98Å; F459-C461 VanDerWaalsContact C-N 3.31Å; C461-K463 PolarHBondContact O-N 3.34Å
462	R	53.2	Low	68.5	Low	250 Å²	250	89.4 Å²	89.4	94%	0.943	43%	0.427	S	S	*	.	S	Bend	trans	-69.9	16.8	-172.7	-51.3	-172.7	-168.9	-169	3.7	115.7	K460	K460-R462 PolarHBondContact O-N 3.44Å
463	K	56.8	Low	68.9	Low	182 Å²	182	85.8 Å²	85.8	79%	0.791	42%	0.416	S	S	*	.			trans	-146.9	72.9	-176.8	-68.9	-167.3	177.2	-171.1	0	111.5	C461 H465	C461-K463 PolarHBondContact O-N 3.34Å; K463-H465 PolarHBondContact O-N 2.91Å
464	L	62.6	Low	68.9	Low	88 Å²	88	89.7 Å²	89.7	46%	0.461	44%	0.437	S	S	.	.			trans	-68.3	117.5	154.2	-175.2	64.1	0	0	0	107.5	P457 V466	P457-L464 HydrophobicContact CB-CD1 3.98Å; P457-L464 HydrophobicContact CG-CD1 4.46Å; L464-V466 HydrophobicContact CD2-CG2 4.21Å; L464-V466 HydrophobicContact CG-CG2 4.15Å
465	H	61.3	Low	69	Low	163 Å²	163	90.6 Å²	90.6	76%	0.755	44%	0.441	S	S	*	.			trans	-103.6	87.8	-179.7	-174.5	35.6	0	0	0	109.4	K463	K463-H465 PolarHBondContact O-N 2.91Å
466	V	67.4	Low	68.8	Low	39 Å²	39	93.1 Å²	93.1	24%	0.236	46%	0.456	C	S	.	.			trans	-83.7	117.6	164.4	-175	0	0	0	0	106.8	I448 L464 I468	I448-V466 HydrophobicContact CG1-CG2 4.37Å; L464-V466 HydrophobicContact CD2-CG2 4.21Å; L464-V466 HydrophobicContact CG-CG2 4.15Å; V466-I468 HydrophobicContact CG1-CG1 4.06Å; V466-I468 PolarHBondContact O-N 2.72Å
467	D	67.6	Low	68.7	Low	74 Å²	74	93.8 Å²	93.8	40%	0.396	46%	0.459	S	S	.	.			trans	-86.2	90	177.9	179.4	12.5	0	0	0	109.8	E469 G470 L471	D467-E469 PolarHBondContact OD1-N 3.01Å; D467-G470 PolarHBondContact OD1-N 3.45Å; D467-L471 VanDerWaalsContact O-CB 3.31Å; D467-L471 WeakPolarHBondContact O-CB 3.39Å; D467-L471 PolarHBondContact O-N 3.12Å
468	I	72.4	Confident	68.7	Low	85 Å²	85	98.8 Å²	98.8	44%	0.436	48%	0.48	S	S	.	.	H	α-helix	trans	-74.9	-28.1	-180	-57.6	175.8	0	0	0	111.1	V466 L471 I472	V466-I468 HydrophobicContact CG1-CG1 4.06Å; V466-I468 PolarHBondContact O-N 2.72Å; I468-L471 PolarHBondContact O-N 3.27Å; I468-I472 HydrophobicContact CG2-CD1 3.99Å; I468-I472 WeakPolarHBondContact O-CD1 3.21Å; I468-I472 VanDerWaalsContact O-CG1 3.28Å; I468-I472 WeakPolarHBondContact O-CG1 3.09Å; I468-I472 PolarHBondContact O-N 2.98Å
469	E	71.6	Confident	68.8	Low	156 Å²	156	98.9 Å²	98.9	73%	0.729	48%	0.482	S	S	*	.	H	α-helix	trans	-71.9	-51.5	-179.7	-65.9	-176.6	167.6	0	0	110	D467 L471 I472 D473	D467-E469 PolarHBondContact OD1-N 3.01Å; E469-L471 PolarHBondContact O-N 3.04Å; E469-I472 PolarHBondContact O-N 3.01Å; E469-I472 VanDerWaalsContact O-N 3.14Å; E469-D473 PolarHBondContact O-N 2.84Å
470	G	71.6	Confident	69.1	Low	17 Å²	17	97.3 Å²	97.3	18%	0.175	48%	0.475	C	S	.	.	H	α-helix	trans	-60.4	-29.1	171.7	0	0	0	0	0	113.2	D467 N474	D467-G470 PolarHBondContact OD1-N 3.45Å; G470-N474 WeakPolarHBondContact O-CB 3.37Å; G470-N474 PolarHBondContact O-N 3.11Å; G470-N474 PolarHBondContact O-ND2 3.36Å
471	L	71.3	Confident	69.6	Low	13 Å²	13	93.3 Å²	93.3	7%	0.068	46%	0.463	C	S	.	.	H	α-helix	trans	-68	-44.3	174.4	-159.3	58.2	0	0	0	112.4	L440 E443 D467 I468 E469 N474 M475	L440-L471 HydrophobicContact CD1-CB 4.44Å; L440-L471 HydrophobicContact CD1-CD2 3.83Å; L440-L471 HydrophobicContact CD1-CG 4.08Å; E443-L471 HydrophobicContact CB-CD1 4.29Å; E443-L471 HydrophobicContact CB-CD2 4.22Å; E443-L471 HydrophobicContact CG-CD1 3.47Å; E443-L471 VanDerWaalsContact CG-CD1 3.47Å; E443-L471 HydrophobicContact CG-CD2 4.28Å; E443-L471 HydrophobicContact CG-CG 4.17Å; D467-L471 VanDerWaalsContact O-CB 3.31Å; D467-L471 WeakPolarHBondContact O-CB 3.39Å; D467-L471 PolarHBondContact O-N 3.12Å; I468-L471 PolarHBondContact O-N 3.27Å; E469-L471 PolarHBondContact O-N 3.04Å; L471-N474 PolarHBondContact O-N 3.46Å; L471-M475 WeakPolarHBondContact O-CB 3.28Å; L471-M475 WeakPolarHBondContact O-CG 3.28Å; L471-M475 PolarHBondContact O-N 2.77Å
472	I	75.2	Confident	70.4	Confident	76 Å²	76	93.9 Å²	93.9	39%	0.39	46%	0.459	S	S	.	.	H	α-helix	trans	-63.5	-44.7	176	-71.4	165.2	0	0	0	110.4	L440 I468 E469 M475 V476	L440-I472 HydrophobicContact CD1-CG1 4.08Å; I468-I472 HydrophobicContact CG2-CD1 3.99Å; I468-I472 WeakPolarHBondContact O-CD1 3.21Å; I468-I472 VanDerWaalsContact O-CG1 3.28Å; I468-I472 WeakPolarHBondContact O-CG1 3.09Å; I468-I472 PolarHBondContact O-N 2.98Å; E469-I472 PolarHBondContact O-N 3.01Å; E469-I472 VanDerWaalsContact O-N 3.14Å; I472-M475 PolarHBondContact O-N 3.29Å; I472-V476 HydrophobicContact CG2-CG2 4.28Å; I472-V476 WeakPolarHBondContact O-CB 3.2Å; I472-V476 VanDerWaalsContact O-CG2 3.28Å; I472-V476 WeakPolarHBondContact O-CG2 3.41Å; I472-V476 PolarHBondContact O-N 3.14Å
473	D	76.6	Confident	71.6	Confident	104 Å²	104	85.5 Å²	85.5	56%	0.556	44%	0.435	S	S	*	.	H	α-helix	trans	-62	-45.2	178.7	-77.2	-21.3	0	0	0	111.9	E469 M475 V476 D477	E469-D473 PolarHBondContact O-N 2.84Å; D473-M475 PolarHBondContact O-N 3.2Å; D473-V476 PolarHBondContact O-N 3.1Å; D473-D477 PolarHBondContact O-N 3.49Å
474	N	71.9	Confident	72.2	Confident	118 Å²	118	79.8 Å²	79.8	63%	0.631	42%	0.418	S	S	*	.	H	α-helix	trans	-61.6	-41.2	174.3	-80.2	-66	0	0	0	112.5	G470 L471 K478	G470-N474 WeakPolarHBondContact O-CB 3.37Å; G470-N474 PolarHBondContact O-N 3.11Å; G470-N474 PolarHBondContact O-ND2 3.36Å; L471-N474 PolarHBondContact O-N 3.46Å; N474-K478 VanDerWaalsContact O-CB 3.29Å; N474-K478 WeakPolarHBondContact O-CB 3.39Å; N474-K478 PolarHBondContact O-N 3.43Å
475	M	71.9	Confident	72.9	Confident	19 Å²	19	81.1 Å²	81.1	9%	0.094	42%	0.422	C	S	.	.	H	α-helix	trans	-64.4	-40.4	175	-76.7	177.8	57.3	0	0	112	K439 L440 L471 I472 D473 T479	K439-M475 HydrophobicContact CB-CE 3.97Å; K439-M475 HydrophobicContact CD-CE 3.97Å; K439-M475 HydrophobicContact CG-CE 3.8Å; K439-M475 HydrophobicContact CG-SD 4.47Å; L440-M475 HydrophobicContact CB-CE 4.12Å; L440-M475 HydrophobicContact CB-SD 4.06Å; L440-M475 HydrophobicContact CD1-SD 3.77Å; L471-M475 WeakPolarHBondContact O-CB 3.28Å; L471-M475 WeakPolarHBondContact O-CG 3.28Å; L471-M475 PolarHBondContact O-N 2.77Å; I472-M475 PolarHBondContact O-N 3.29Å; D473-M475 PolarHBondContact O-N 3.2Å; M475-T479 WeakPolarHBondContact O-CB 3.48Å; M475-T479 PolarHBondContact O-N 2.76Å; M475-T479 PolarHBondContact O-OG1 3Å
476	V	74.9	Confident	73.7	Confident	63 Å²	63	76.3 Å²	76.3	38%	0.382	41%	0.411	S	S	.	.	H	α-helix	trans	-65.7	-46.3	178.1	162	0	0	0	0	110.8	I472 D473 T479 K480	I472-V476 HydrophobicContact CG2-CG2 4.28Å; I472-V476 WeakPolarHBondContact O-CB 3.2Å; I472-V476 VanDerWaalsContact O-CG2 3.28Å; I472-V476 WeakPolarHBondContact O-CG2 3.41Å; I472-V476 PolarHBondContact O-N 3.14Å; D473-V476 PolarHBondContact O-N 3.1Å; V476-T479 PolarHBondContact O-N 3.22Å; V476-K480 VanDerWaalsContact CG1-CE 3.48Å; V476-K480 WeakPolarHBondContact O-CG 3.23Å; V476-K480 PolarHBondContact O-N 2.75Å
477	D	75.9	Confident	74.2	Confident	86 Å²	86	80.7 Å²	80.7	46%	0.46	43%	0.426	S	S	.	.	H	α-helix	trans	-68.9	-40.5	179.1	-81.3	-6.7	0	0	0	112.5	D473 T479 K480 V481	D473-D477 PolarHBondContact O-N 3.49Å; D477-T479 VanDerWaalsContact C-N 3.29Å; D477-T479 PolarHBondContact O-N 3.03Å; D477-K480 WeakPolarHBondContact O-CB 3.26Å; D477-K480 PolarHBondContact O-N 2.93Å; D477-K480 VanDerWaalsContact O-N 3.12Å; D477-K480 WeakPolarHBondContact OD1-CD 3.29Å; D477-K480 WeakPolarHBondContact OD1-CE 3.3Å; D477-K480 IonicContact OD1-NZ 2.71Å; D477-K480 PolarHBondContact OD1-NZ 2.78Å; D477-V481 WeakPolarHBondContact O-CG2 3.14Å; D477-V481 PolarHBondContact O-N 2.95Å
478	K	74.1	Confident	74.7	Confident	118 Å²	118	79.3 Å²	79.3	51%	0.513	43%	0.425	S	S	.	.	H	α-helix	trans	-57.5	-42.6	170.5	179.8	168.3	177.2	175.5	0	111.7	N474 K480 V481 E482	N474-K478 VanDerWaalsContact O-CB 3.29Å; N474-K478 WeakPolarHBondContact O-CB 3.39Å; N474-K478 PolarHBondContact O-N 3.43Å; K478-K480 VanDerWaalsContact C-N 3.34Å; K478-K480 PolarHBondContact O-N 3.34Å; K478-V481 PolarHBondContact O-N 3.38Å; K478-E482 WeakPolarHBondContact CE-OE1 3.41Å; K478-E482 HydrophobicContact CG-CG 4.49Å; K478-E482 WeakPolarHBondContact CG-OE1 3.3Å; K478-E482 WeakPolarHBondContact O-CG 3.3Å; K478-E482 PolarHBondContact O-N 3.13Å
479	T	75.3	Confident	75	Confident	44 Å²	44	79.1 Å²	79.1	27%	0.27	43%	0.428	S	S	.	.	H	α-helix	trans	-65.8	-34.4	176.8	-52.3	0	0	0	0	112.2	M475 V476 D477 V483	M475-T479 WeakPolarHBondContact O-CB 3.48Å; M475-T479 PolarHBondContact O-N 2.76Å; M475-T479 PolarHBondContact O-OG1 3Å; V476-T479 PolarHBondContact O-N 3.22Å; D477-T479 VanDerWaalsContact C-N 3.29Å; D477-T479 PolarHBondContact O-N 3.03Å; T479-V483 WeakPolarHBondContact O-CB 3.4Å; T479-V483 VanDerWaalsContact O-CG2 3.27Å; T479-V483 WeakPolarHBondContact O-CG2 3.38Å; T479-V483 PolarHBondContact O-N 2.9Å; T479-V483 VanDerWaalsContact O-N 3.11Å
480	K	75.9	Confident	75.6	Confident	124 Å²	124	75.1 Å²	75.1	54%	0.539	41%	0.412	S	S	.	.	H	α-helix	trans	-64.3	-40.8	172.4	-68	168.5	-165.3	158.1	0	111.6	V476 D477 K478 S484	V476-K480 VanDerWaalsContact CG1-CE 3.48Å; V476-K480 WeakPolarHBondContact O-CG 3.23Å; V476-K480 PolarHBondContact O-N 2.75Å; D477-K480 WeakPolarHBondContact O-CB 3.26Å; D477-K480 PolarHBondContact O-N 2.93Å; D477-K480 VanDerWaalsContact O-N 3.12Å; D477-K480 WeakPolarHBondContact OD1-CD 3.29Å; D477-K480 WeakPolarHBondContact OD1-CE 3.3Å; D477-K480 IonicContact OD1-NZ 2.71Å; D477-K480 PolarHBondContact OD1-NZ 2.78Å; K478-K480 VanDerWaalsContact C-N 3.34Å; K478-K480 PolarHBondContact O-N 3.34Å; K480-S484 PolarHBondContact O-N 2.99Å; K480-S484 VanDerWaalsContact O-N 3.08Å
481	V	76.9	Confident	76	Confident	70 Å²	70	79.8 Å²	79.8	42%	0.424	43%	0.432	S	S	.	.	H	α-helix	trans	-64.1	-52.6	177.3	173.7	0	0	0	0	110.5	D477 K478 V483 S484 E485	D477-V481 WeakPolarHBondContact O-CG2 3.14Å; D477-V481 PolarHBondContact O-N 2.95Å; K478-V481 PolarHBondContact O-N 3.38Å; V481-V483 VanDerWaalsContact C-N 3.27Å; V481-V483 PolarHBondContact O-N 2.74Å; V481-S484 WeakPolarHBondContact O-CA 3.42Å; V481-S484 WeakPolarHBondContact O-CB 3.48Å; V481-S484 PolarHBondContact O-N 2.75Å; V481-S484 PolarHBondContact O-OG 2.74Å; V481-E485 HydrophobicContact CG1-CG 4.28Å; V481-E485 PolarHBondContact O-N 2.76Å
482	E	74.8	Confident	76.3	Confident	82 Å²	82	85 Å²	85	38%	0.383	46%	0.456	S	S	.	.	H	α-helix	trans	-52.9	-43.8	177.3	-69.7	164.8	-179.4	0	0	111.5	K478 S484 A486	K478-E482 WeakPolarHBondContact CE-OE1 3.41Å; K478-E482 HydrophobicContact CG-CG 4.49Å; K478-E482 WeakPolarHBondContact CG-OE1 3.3Å; K478-E482 WeakPolarHBondContact O-CG 3.3Å; K478-E482 PolarHBondContact O-N 3.13Å; E482-S484 VanDerWaalsContact C-N 3.3Å; E482-S484 PolarHBondContact O-N 2.72Å; E482-A486 WeakPolarHBondContact O-CB 3.42Å; E482-A486 PolarHBondContact O-N 2.9Å; E482-A486 VanDerWaalsContact O-N 3.14Å
483	V	77.4	Confident	76.8	Confident	74 Å²	74	89.1 Å²	89.1	45%	0.448	47%	0.471	S	S	.	.	H	α-helix	trans	-70.2	-21	176.2	168.9	0	0	0	0	113.6	T479 V481 K487	T479-V483 WeakPolarHBondContact O-CB 3.4Å; T479-V483 VanDerWaalsContact O-CG2 3.27Å; T479-V483 WeakPolarHBondContact O-CG2 3.38Å; T479-V483 PolarHBondContact O-N 2.9Å; T479-V483 VanDerWaalsContact O-N 3.11Å; V481-V483 VanDerWaalsContact C-N 3.27Å; V481-V483 PolarHBondContact O-N 2.74Å; V483-K487 WeakPolarHBondContact O-CD 3.33Å; V483-K487 WeakPolarHBondContact O-CG 3.43Å
484	S	69.9	Low	77.3	Confident	62 Å²	62	89.4 Å²	89.4	43%	0.434	47%	0.467	S	S	.	.	H	α-helix	trans	-84.5	-39.1	175.3	76	0	0	0	0	112.4	K480 V481 E482 K487 A488	K480-S484 PolarHBondContact O-N 2.99Å; K480-S484 VanDerWaalsContact O-N 3.08Å; V481-S484 WeakPolarHBondContact O-CA 3.42Å; V481-S484 WeakPolarHBondContact O-CB 3.48Å; V481-S484 PolarHBondContact O-N 2.75Å; V481-S484 PolarHBondContact O-OG 2.74Å; E482-S484 VanDerWaalsContact C-N 3.3Å; E482-S484 PolarHBondContact O-N 2.72Å; S484-K487 WeakPolarHBondContact O-CB 3.29Å; S484-K487 PolarHBondContact O-N 2.84Å; S484-K487 VanDerWaalsContact O-N 3.14Å; S484-A488 PolarHBondContact O-N 3.18Å
485	E	76.4	Confident	77.8	Confident	117 Å²	117	89 Å²	89	55%	0.547	47%	0.465	S	S	.	.	H	α-helix	trans	-68.2	-38.8	177.4	-66.7	175.5	152	0	0	111.5	V481 K487 A488 T489	V481-E485 HydrophobicContact CG1-CG 4.28Å; V481-E485 PolarHBondContact O-N 2.76Å; E485-K487 PolarHBondContact O-N 2.86Å; E485-A488 PolarHBondContact O-N 3.08Å; E485-T489 PolarHBondContact O-N 3.15Å; E485-T489 PolarHBondContact O-OG1 3.45Å
486	A	78.6	Confident	78.4	Confident	62 Å²	62	93.9 Å²	93.9	51%	0.512	49%	0.487	S	S	.	.	H	α-helix	trans	-61.7	-26.2	171.6	0	0	0	0	0	113.4	E482 T489	E482-A486 WeakPolarHBondContact O-CB 3.42Å; E482-A486 PolarHBondContact O-N 2.9Å; E482-A486 VanDerWaalsContact O-N 3.14Å; A486-T489 PolarHBondContact O-OG1 3.3Å
487	K	79.1	Confident	78.9	Confident	130 Å²	130	94.2 Å²	94.2	57%	0.565	49%	0.493	S	S	*	.	H	α-helix	trans	-85	-34.7	174.8	-70.9	169.7	-173.5	169.7	0	112.3	V483 S484 E485 L491	V483-K487 WeakPolarHBondContact O-CD 3.33Å; V483-K487 WeakPolarHBondContact O-CG 3.43Å; S484-K487 WeakPolarHBondContact O-CB 3.29Å; S484-K487 PolarHBondContact O-N 2.84Å; S484-K487 VanDerWaalsContact O-N 3.14Å; E485-K487 PolarHBondContact O-N 2.86Å; K487-L491 VanDerWaalsContact O-CG 3.3Å; K487-L491 WeakPolarHBondContact O-CG 3.45Å; K487-L491 PolarHBondContact O-N 3.15Å; K487-L491 VanDerWaalsContact O-N 3.16Å
488	A	77.8	Confident	79.1	Confident	45 Å²	45	96.6 Å²	96.6	37%	0.372	50%	0.501	S	S	.	.	H	α-helix	trans	-61.4	-48.6	173.8	0	0	0	0	0	110.7	S484 E485 D490 L491 E492	S484-A488 PolarHBondContact O-N 3.18Å; E485-A488 PolarHBondContact O-N 3.08Å; A488-D490 PolarHBondContact O-N 3.37Å; A488-L491 WeakPolarHBondContact O-CB 3.4Å; A488-L491 PolarHBondContact O-N 3.47Å; A488-L491 VanDerWaalsContact O-N 3.12Å; A488-E492 WeakPolarHBondContact O-CG 3.27Å; A488-E492 PolarHBondContact O-N 3.25Å
489	T	79.2	Confident	79.5	Confident	81 Å²	81	95.2 Å²	95.2	50%	0.497	50%	0.499	S	S	.	.	H	α-helix	trans	-66.3	-34	-179.3	46.2	0	0	0	0	114	E485 A486 K493	E485-T489 PolarHBondContact O-N 3.15Å; E485-T489 PolarHBondContact O-OG1 3.45Å; A486-T489 PolarHBondContact O-OG1 3.3Å; T489-K493 WeakPolarHBondContact O-CB 3.34Å; T489-K493 PolarHBondContact O-N 2.93Å
490	D	83.7	Confident	79.8	Confident	73 Å²	73	96.3 Å²	96.3	39%	0.39	51%	0.505	S	S	.	.	H	α-helix	trans	-66.9	-36.1	170.7	171.5	63.9	0	0	0	112.5	A488 K494	A488-D490 PolarHBondContact O-N 3.37Å; D490-K494 WeakPolarHBondContact O-CD 3.22Å; D490-K494 WeakPolarHBondContact O-CG 3.33Å; D490-K494 PolarHBondContact O-N 3Å; D490-K494 VanDerWaalsContact O-N 3.16Å; D490-K494 VanDerWaalsContact OD1-CE 3.26Å; D490-K494 WeakPolarHBondContact OD1-CE 3.48Å; D490-K494 IonicContact OD1-NZ 3.42Å; D490-K494 PolarHBondContact OD1-NZ 2.83Å; D490-K494 IonicContact OD2-NZ 2.74Å; D490-K494 PolarHBondContact OD2-NZ 2.9Å
491	L	79.8	Confident	80.2	Confident	114 Å²	114	92.3 Å²	92.3	60%	0.597	50%	0.495	S	S	*	.	H	α-helix	trans	-71.6	-39.7	174.2	-70.8	169.5	0	0	0	112.4	K487 A488 K494 L495	K487-L491 VanDerWaalsContact O-CG 3.3Å; K487-L491 WeakPolarHBondContact O-CG 3.45Å; K487-L491 PolarHBondContact O-N 3.15Å; K487-L491 VanDerWaalsContact O-N 3.16Å; A488-L491 WeakPolarHBondContact O-CB 3.4Å; A488-L491 PolarHBondContact O-N 3.47Å; A488-L491 VanDerWaalsContact O-N 3.12Å; L491-K494 PolarHBondContact O-N 3.07Å; L491-L495 PolarHBondContact O-N 3.29Å
492	E	77.6	Confident	80.4	Confident	123 Å²	123	98 Å²	98	58%	0.575	51%	0.509	S	S	*	.	H	α-helix	trans	-61.2	-45.5	173.3	-73.2	173.1	161.7	0	0	111.3	A488 K494 L495 E496	A488-E492 WeakPolarHBondContact O-CG 3.27Å; A488-E492 PolarHBondContact O-N 3.25Å; E492-K494 VanDerWaalsContact C-N 3.29Å; E492-K494 PolarHBondContact O-N 3.43Å; E492-L495 WeakPolarHBondContact O-CB 3.47Å; E492-L495 PolarHBondContact O-N 3.12Å; E492-E496 PolarHBondContact O-N 3.28Å
493	K	86	Confident	80.8	Confident	162 Å²	162	100.2 Å²	100.2	70%	0.704	52%	0.519	S	S	*	.	H	α-helix	trans	-61.2	-36.8	176.3	-172.8	174.5	-178.4	177.6	0	112.6	T489 S497	T489-K493 WeakPolarHBondContact O-CB 3.34Å; T489-K493 PolarHBondContact O-N 2.93Å; K493-S497 PolarHBondContact O-N 2.95Å; K493-S497 VanDerWaalsContact O-N 3.12Å; K493-S497 PolarHBondContact O-OG 2.71Å
494	K	85.4	Confident	81	Confident	110 Å²	110	102.7 Å²	102.7	48%	0.478	53%	0.526	S	S	.	.	H	α-helix	trans	-68	-44.1	174.4	-76.5	163.5	-176.7	162	0	111.7	D490 L491 E492 E496 S497 E498	D490-K494 WeakPolarHBondContact O-CD 3.22Å; D490-K494 WeakPolarHBondContact O-CG 3.33Å; D490-K494 PolarHBondContact O-N 3Å; D490-K494 VanDerWaalsContact O-N 3.16Å; D490-K494 VanDerWaalsContact OD1-CE 3.26Å; D490-K494 WeakPolarHBondContact OD1-CE 3.48Å; D490-K494 IonicContact OD1-NZ 3.42Å; D490-K494 PolarHBondContact OD1-NZ 2.83Å; D490-K494 IonicContact OD2-NZ 2.74Å; D490-K494 PolarHBondContact OD2-NZ 2.9Å; L491-K494 PolarHBondContact O-N 3.07Å; E492-K494 VanDerWaalsContact C-N 3.29Å; E492-K494 PolarHBondContact O-N 3.43Å; K494-E496 VanDerWaalsContact C-N 3.33Å; K494-E496 PolarHBondContact O-N 3.06Å; K494-S497 WeakPolarHBondContact CA-OG 3.34Å; K494-S497 PolarHBondContact O-N 3.37Å; K494-S497 PolarHBondContact O-OG 3.49Å; K494-E498 PolarHBondContact O-N 2.91Å
495	L	84.2	Confident	81.6	Confident	109 Å²	109	105.1 Å²	105.1	57%	0.571	53%	0.534	S	S	*	.	H	α-helix	trans	-58.4	-44.9	175.1	-179.7	61.6	0	0	0	111.5	L491 E492 S497 E498 L499	L491-L495 PolarHBondContact O-N 3.29Å; E492-L495 WeakPolarHBondContact O-CB 3.47Å; E492-L495 PolarHBondContact O-N 3.12Å; L495-S497 PolarHBondContact O-N 2.65Å; L495-E498 PolarHBondContact O-N 3.24Å; L495-L499 HydrophobicContact CD1-CD1 4.38Å; L495-L499 HydrophobicContact CD1-CG 4.39Å; L495-L499 HydrophobicContact CG-CD1 4.11Å; L495-L499 WeakPolarHBondContact O-CB 3.26Å; L495-L499 VanDerWaalsContact O-CG 3.3Å; L495-L499 WeakPolarHBondContact O-CG 3.07Å; L495-L499 PolarHBondContact O-N 2.83Å
496	E	83.8	Confident	81.7	Confident	122 Å²	122	104.2 Å²	104.2	57%	0.57	53%	0.529	S	S	*	.	H	α-helix	trans	-64.5	-37.8	178	-163.8	63.6	-160.5	0	0	112.6	E492 K494 L499 T500	E492-E496 PolarHBondContact O-N 3.28Å; K494-E496 VanDerWaalsContact C-N 3.33Å; K494-E496 PolarHBondContact O-N 3.06Å; E496-L499 PolarHBondContact O-N 3.27Å; E496-T500 WeakPolarHBondContact O-CB 3.15Å; E496-T500 PolarHBondContact O-N 2.89Å; E496-T500 PolarHBondContact O-OG1 3.43Å
497	S	84.9	Confident	81.9	Confident	71 Å²	71	105.1 Å²	105.1	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-66.6	-37.6	175	65	0	0	0	0	113.1	K493 K494 L495 T500 A501	K493-S497 PolarHBondContact O-N 2.95Å; K493-S497 VanDerWaalsContact O-N 3.12Å; K493-S497 PolarHBondContact O-OG 2.71Å; K494-S497 WeakPolarHBondContact CA-OG 3.34Å; K494-S497 PolarHBondContact O-N 3.37Å; K494-S497 PolarHBondContact O-OG 3.49Å; L495-S497 PolarHBondContact O-N 2.65Å; S497-T500 PolarHBondContact O-N 2.9Å; S497-A501 PolarHBondContact O-N 2.82Å
498	E	80.4	Confident	82.1	Confident	135 Å²	135	104.5 Å²	104.5	63%	0.631	53%	0.527	S	S	*	.	H	α-helix	trans	-70.5	-38.3	176.5	-171.5	68.8	-150.1	0	0	111.3	K494 L495 R502	K494-E498 PolarHBondContact O-N 2.91Å; L495-E498 PolarHBondContact O-N 3.24Å; E498-R502 VanDerWaalsContact O-CB 3.23Å; E498-R502 WeakPolarHBondContact O-CB 3.24Å; E498-R502 PolarHBondContact O-N 2.84Å
499	L	82.5	Confident	82.3	Confident	90 Å²	90	107.1 Å²	107.1	47%	0.471	53%	0.53	S	S	.	.	H	α-helix	trans	-65	-40.7	173.5	-71.9	172.7	0	0	0	111.9	L495 E496 R502 H503	L495-L499 HydrophobicContact CD1-CD1 4.38Å; L495-L499 HydrophobicContact CD1-CG 4.39Å; L495-L499 HydrophobicContact CG-CD1 4.11Å; L495-L499 WeakPolarHBondContact O-CB 3.26Å; L495-L499 VanDerWaalsContact O-CG 3.3Å; L495-L499 WeakPolarHBondContact O-CG 3.07Å; L495-L499 PolarHBondContact O-N 2.83Å; E496-L499 PolarHBondContact O-N 3.27Å; L499-R502 PolarHBondContact O-N 3Å; L499-H503 PolarHBondContact O-N 3.4Å
500	T	81.5	Confident	82.3	Confident	66 Å²	66	107.1 Å²	107.1	41%	0.405	53%	0.527	S	S	.	.	H	α-helix	trans	-62.1	-53.5	174.9	-58.4	0	0	0	0	111.2	E496 S497 R502 H503 E504	E496-T500 WeakPolarHBondContact O-CB 3.15Å; E496-T500 PolarHBondContact O-N 2.89Å; E496-T500 PolarHBondContact O-OG1 3.43Å; S497-T500 PolarHBondContact O-N 2.9Å; T500-R502 VanDerWaalsContact C-N 3.25Å; T500-R502 PolarHBondContact O-N 3.41Å; T500-H503 WeakPolarHBondContact O-CA 3.41Å; T500-H503 WeakPolarHBondContact O-CB 3.42Å; T500-H503 PolarHBondContact O-N 2.62Å; T500-E504 PolarHBondContact O-N 2.99Å
501	A	85.1	Confident	82.5	Confident	40 Å²	40	109.8 Å²	109.8	33%	0.331	54%	0.536	S	S	.	.	H	α-helix	trans	-58.8	-37.2	178.4	0	0	0	0	0	112.3	S497 H503 E504 L505	S497-A501 PolarHBondContact O-N 2.82Å; A501-H503 VanDerWaalsContact C-N 3.35Å; A501-E504 PolarHBondContact O-N 3.32Å; A501-L505 WeakPolarHBondContact O-CG 3.41Å; A501-L505 PolarHBondContact O-N 2.82Å
502	R	80.3	Confident	82.7	Confident	191 Å²	191	109.6 Å²	109.6	72%	0.721	54%	0.535	S	S	*	.	H	α-helix	trans	-66	-33.6	173.6	-176.2	175.8	-177.5	141.4	3.8	113.1	E498 L499 T500 Q506	E498-R502 VanDerWaalsContact O-CB 3.23Å; E498-R502 WeakPolarHBondContact O-CB 3.24Å; E498-R502 PolarHBondContact O-N 2.84Å; L499-R502 PolarHBondContact O-N 3Å; T500-R502 VanDerWaalsContact C-N 3.25Å; T500-R502 PolarHBondContact O-N 3.41Å; R502-Q506 WeakPolarHBondContact O-CB 3.5Å; R502-Q506 PolarHBondContact O-N 3.41Å
503	H	82.9	Confident	82.7	Confident	128 Å²	128	108.3 Å²	108.3	59%	0.593	53%	0.529	S	S	*	.	H	α-helix	trans	-71.3	-43.1	174.9	-169.2	71.5	0	0	0	111.4	L499 T500 A501 Q506 V507	L499-H503 PolarHBondContact O-N 3.4Å; T500-H503 WeakPolarHBondContact O-CA 3.41Å; T500-H503 WeakPolarHBondContact O-CB 3.42Å; T500-H503 PolarHBondContact O-N 2.62Å; A501-H503 VanDerWaalsContact C-N 3.35Å; H503-Q506 WeakPolarHBondContact O-CB 3.47Å; H503-Q506 PolarHBondContact O-N 2.9Å; H503-Q506 VanDerWaalsContact O-N 3.13Å; H503-V507 WeakPolarHBondContact O-CG2 3.27Å; H503-V507 PolarHBondContact O-N 3.08Å
504	E	81.6	Confident	82.3	Confident	126 Å²	126	104.2 Å²	104.2	59%	0.589	52%	0.52	S	S	*	.	H	α-helix	trans	-58.7	-48.5	176	-68.5	175	158.9	0	0	111.7	T500 A501 Q506 V507 E508	T500-E504 PolarHBondContact O-N 2.99Å; A501-E504 PolarHBondContact O-N 3.32Å; E504-Q506 VanDerWaalsContact C-N 3.27Å; E504-Q506 PolarHBondContact O-N 3.27Å; E504-V507 PolarHBondContact O-N 3.44Å; E504-V507 VanDerWaalsContact O-N 3.1Å; E504-E508 PolarHBondContact O-N 3.12Å
505	L	81.8	Confident	82.3	Confident	113 Å²	113	103 Å²	103	59%	0.592	52%	0.519	S	S	*	.	H	α-helix	trans	-61.4	-32.7	175	-72.3	170.1	0	0	0	112.9	A501 K509	A501-L505 WeakPolarHBondContact O-CG 3.41Å; A501-L505 PolarHBondContact O-N 2.82Å; L505-K509 VanDerWaalsContact O-CB 3.28Å; L505-K509 WeakPolarHBondContact O-CB 3.34Å; L505-K509 PolarHBondContact O-N 3.37Å
506	Q	78.8	Confident	82.1	Confident	98 Å²	98	105.6 Å²	105.6	46%	0.458	52%	0.522	S	S	.	.	H	α-helix	trans	-71.1	-35.8	175	-175.2	63.3	73.1	0	0	111.9	R502 H503 E504 N510	R502-Q506 WeakPolarHBondContact O-CB 3.5Å; R502-Q506 PolarHBondContact O-N 3.41Å; H503-Q506 WeakPolarHBondContact O-CB 3.47Å; H503-Q506 PolarHBondContact O-N 2.9Å; H503-Q506 VanDerWaalsContact O-N 3.13Å; E504-Q506 VanDerWaalsContact C-N 3.27Å; E504-Q506 PolarHBondContact O-N 3.27Å; Q506-N510 PolarHBondContact NE2-OD1 2.97Å; Q506-N510 WeakPolarHBondContact O-CB 3.37Å; Q506-N510 PolarHBondContact O-N 3.28Å; Q506-N510 PolarHBondContact O-OD1 3.25Å; Q506-N510 VanDerWaalsContact O-OD1 3.08Å
507	V	84.3	Confident	82	Confident	81 Å²	81	104.2 Å²	104.2	49%	0.491	52%	0.519	S	S	.	.	H	α-helix	trans	-69.1	-43.5	173.8	172.8	0	0	0	0	110.9	H503 E504 N510 K511	H503-V507 WeakPolarHBondContact O-CG2 3.27Å; H503-V507 PolarHBondContact O-N 3.08Å; E504-V507 PolarHBondContact O-N 3.44Å; E504-V507 VanDerWaalsContact O-N 3.1Å; V507-N510 PolarHBondContact O-N 3.23Å; V507-K511 PolarHBondContact O-N 2.75Å
508	E	82.8	Confident	81.8	Confident	116 Å²	116	105.3 Å²	105.3	54%	0.542	52%	0.516	S	S	.	.	H	α-helix	trans	-61.1	-44.3	174.6	-174.4	176	-147.5	0	0	111.6	E504 N510 K511 L512	E504-E508 PolarHBondContact O-N 3.12Å; E508-N510 PolarHBondContact O-N 3.46Å; E508-K511 WeakPolarHBondContact O-CB 3.48Å; E508-K511 PolarHBondContact O-N 2.98Å; E508-L512 HydrophobicContact CG-CD1 4.5Å; E508-L512 PolarHBondContact O-N 2.97Å
509	K	82.4	Confident	82	Confident	101 Å²	101	105.5 Å²	105.5	44%	0.439	52%	0.515	S	S	.	.	H	α-helix	trans	-58.8	-45.1	175.3	-174.6	-99	168.1	-165	0	112	L505 K511 L512 E513	L505-K509 VanDerWaalsContact O-CB 3.28Å; L505-K509 WeakPolarHBondContact O-CB 3.34Å; L505-K509 PolarHBondContact O-N 3.37Å; K509-K511 VanDerWaalsContact C-N 3.32Å; K509-K511 PolarHBondContact O-N 3.01Å; K509-L512 PolarHBondContact O-N 2.88Å; K509-E513 IonicContact NZ-OE1 3.28Å; K509-E513 PolarHBondContact NZ-OE1 3.19Å; K509-E513 IonicContact NZ-OE2 3.59Å; K509-E513 PolarHBondContact NZ-OE2 2.65Å; K509-E513 WeakPolarHBondContact O-CB 3.41Å; K509-E513 PolarHBondContact O-N 3.06Å; K509-E513 VanDerWaalsContact O-N 3.07Å
510	N	78.6	Confident	81.8	Confident	81 Å²	81	105.5 Å²	105.5	43%	0.433	52%	0.515	S	S	.	.	H	α-helix	trans	-66.1	-34.2	177.6	-67.3	2.2	0	0	0	112	Q506 V507 E508 S514	Q506-N510 PolarHBondContact NE2-OD1 2.97Å; Q506-N510 WeakPolarHBondContact O-CB 3.37Å; Q506-N510 PolarHBondContact O-N 3.28Å; Q506-N510 PolarHBondContact O-OD1 3.25Å; Q506-N510 VanDerWaalsContact O-OD1 3.08Å; V507-N510 PolarHBondContact O-N 3.23Å; E508-N510 PolarHBondContact O-N 3.46Å; N510-S514 PolarHBondContact O-N 3.26Å; N510-S514 VanDerWaalsContact O-N 3.09Å
511	K	86.9	Confident	81.7	Confident	129 Å²	129	107.7 Å²	107.7	56%	0.561	52%	0.52	S	S	*	.	H	α-helix	trans	-66.8	-47.7	174.5	-174.5	-173.4	171.2	-170.6	0	111.4	V507 E508 K509 E513 S514 D515	V507-K511 PolarHBondContact O-N 2.75Å; E508-K511 WeakPolarHBondContact O-CB 3.48Å; E508-K511 PolarHBondContact O-N 2.98Å; K509-K511 VanDerWaalsContact C-N 3.32Å; K509-K511 PolarHBondContact O-N 3.01Å; K511-E513 PolarHBondContact O-N 3.5Å; K511-S514 WeakPolarHBondContact O-CB 3.38Å; K511-S514 PolarHBondContact O-N 3.4Å; K511-S514 VanDerWaalsContact O-N 3.11Å; K511-D515 PolarHBondContact O-N 3.14Å
512	L	84.4	Confident	81.6	Confident	110 Å²	110	109.5 Å²	109.5	58%	0.576	52%	0.524	S	S	*	.	H	α-helix	trans	-58.6	-35.9	176.1	-111.7	69.8	0	0	0	112.5	E508 K509 Y516	E508-L512 HydrophobicContact CG-CD1 4.5Å; E508-L512 PolarHBondContact O-N 2.97Å; K509-L512 PolarHBondContact O-N 2.88Å; L512-Y516 WeakPolarHBondContact O-CB 3.37Å; L512-Y516 PolarHBondContact O-N 3.19Å
513	E	78	Confident	81.7	Confident	96 Å²	96	105 Å²	105	45%	0.449	51%	0.514	S	S	.	.	H	α-helix	trans	-65.1	-45.3	175.4	-158.4	158.4	-135.7	0	0	110.7	K509 K511 Y516 D517	K509-E513 IonicContact NZ-OE1 3.28Å; K509-E513 PolarHBondContact NZ-OE1 3.19Å; K509-E513 IonicContact NZ-OE2 3.59Å; K509-E513 PolarHBondContact NZ-OE2 2.65Å; K509-E513 WeakPolarHBondContact O-CB 3.41Å; K509-E513 PolarHBondContact O-N 3.06Å; K509-E513 VanDerWaalsContact O-N 3.07Å; K511-E513 PolarHBondContact O-N 3.5Å; E513-Y516 PolarHBondContact O-N 3.19Å; E513-D517 PolarHBondContact O-N 3.46Å
514	S	77.2	Confident	81.5	Confident	75 Å²	75	101.9 Å²	101.9	52%	0.524	51%	0.507	S	S	.	.	H	α-helix	trans	-66.2	-39.4	174.4	-169.5	0	0	0	0	113.6	N510 K511 Y516 D517 Q518	N510-S514 PolarHBondContact O-N 3.26Å; N510-S514 VanDerWaalsContact O-N 3.09Å; K511-S514 WeakPolarHBondContact O-CB 3.38Å; K511-S514 PolarHBondContact O-N 3.4Å; K511-S514 VanDerWaalsContact O-N 3.11Å; S514-Y516 VanDerWaalsContact C-N 3.25Å; S514-Y516 PolarHBondContact O-N 2.73Å; S514-D517 PolarHBondContact O-N 3.45Å; S514-Q518 PolarHBondContact O-N 3.11Å
515	D	84.9	Confident	81.4	Confident	85 Å²	85	101.6 Å²	101.6	46%	0.455	51%	0.506	S	S	.	.	H	α-helix	trans	-65.9	-30.6	176.7	-71.7	-22.3	0	0	0	110.9	K511 K519	K511-D515 PolarHBondContact O-N 3.14Å; D515-K519 WeakPolarHBondContact O-CB 3.38Å; D515-K519 PolarHBondContact O-N 2.97Å
516	Y	80.4	Confident	81.4	Confident	163 Å²	163	101.4 Å²	101.4	64%	0.639	50%	0.502	S	S	*	.	H	α-helix	trans	-75.1	-43.9	175.5	-162.4	-92.5	0	0	0	112.3	L512 E513 S514 K519 L520	L512-Y516 WeakPolarHBondContact O-CB 3.37Å; L512-Y516 PolarHBondContact O-N 3.19Å; E513-Y516 PolarHBondContact O-N 3.19Å; S514-Y516 VanDerWaalsContact C-N 3.25Å; S514-Y516 PolarHBondContact O-N 2.73Å; Y516-K519 PolarHBondContact O-N 3.17Å; Y516-L520 HydrophobicContact CD1-CD1 3.86Å; Y516-L520 HydrophobicContact CD1-CG 4.27Å; Y516-L520 HydrophobicContact CE1-CD1 3.85Å; Y516-L520 HydrophobicContact CE1-CG 4.19Å; Y516-L520 PolarHBondContact O-N 3.02Å
517	D	81.2	Confident	81.4	Confident	94 Å²	94	104.1 Å²	104.1	50%	0.503	51%	0.512	S	S	.	.	H	α-helix	trans	-63.8	-39.5	176.4	-84.6	-12.5	0	0	0	112.3	E513 S514 K519 L520 Q521	E513-D517 PolarHBondContact O-N 3.46Å; S514-D517 PolarHBondContact O-N 3.45Å; D517-K519 VanDerWaalsContact C-N 3.33Å; D517-K519 PolarHBondContact O-N 3.33Å; D517-L520 PolarHBondContact O-N 2.98Å; D517-Q521 PolarHBondContact O-N 3.5Å; D517-Q521 VanDerWaalsContact O-N 3.13Å
518	Q	82.4	Confident	81.2	Confident	93 Å²	93	106.6 Å²	106.6	44%	0.435	52%	0.518	S	S	.	.	H	α-helix	trans	-59.7	-45.8	172.4	-176	59.5	59.1	0	0	110.8	S514 L520 Q521 D522	S514-Q518 PolarHBondContact O-N 3.11Å; Q518-L520 VanDerWaalsContact C-N 3.27Å; Q518-L520 PolarHBondContact O-N 3.11Å; Q518-Q521 WeakPolarHBondContact O-CA 3.35Å; Q518-Q521 WeakPolarHBondContact O-CB 3.38Å; Q518-Q521 PolarHBondContact O-N 3.35Å; Q518-D522 PolarHBondContact NE2-OD1 3.16Å; Q518-D522 VanDerWaalsContact O-CG 3.24Å; Q518-D522 PolarHBondContact O-N 2.98Å
519	K	84	Confident	81	Confident	139 Å²	139	107.8 Å²	107.8	60%	0.604	52%	0.524	S	S	*	.	H	α-helix	trans	-65.5	-28.4	-179.7	-162	165.1	-168.9	164	0	113.3	D515 Y516 D517 L523	D515-K519 WeakPolarHBondContact O-CB 3.38Å; D515-K519 PolarHBondContact O-N 2.97Å; Y516-K519 PolarHBondContact O-N 3.17Å; D517-K519 VanDerWaalsContact C-N 3.33Å; D517-K519 PolarHBondContact O-N 3.33Å; K519-L523 WeakPolarHBondContact O-CB 3.48Å; K519-L523 WeakPolarHBondContact O-CD1 3.32Å; K519-L523 VanDerWaalsContact O-CG 3.31Å; K519-L523 WeakPolarHBondContact O-CG 3.48Å; K519-L523 PolarHBondContact O-N 3.17Å
520	L	77.3	Confident	80.9	Confident	90 Å²	90	108 Å²	108	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-69	-38.1	169.6	-76.2	170.8	0	0	0	112.3	Y516 D517 Q518 S524	Y516-L520 HydrophobicContact CD1-CD1 3.86Å; Y516-L520 HydrophobicContact CD1-CG 4.27Å; Y516-L520 HydrophobicContact CE1-CD1 3.85Å; Y516-L520 HydrophobicContact CE1-CG 4.19Å; Y516-L520 PolarHBondContact O-N 3.02Å; D517-L520 PolarHBondContact O-N 2.98Å; Q518-L520 VanDerWaalsContact C-N 3.27Å; Q518-L520 PolarHBondContact O-N 3.11Å; L520-S524 WeakPolarHBondContact O-CB 3.48Å; L520-S524 PolarHBondContact O-N 3.38Å; L520-S524 VanDerWaalsContact O-N 3.14Å
521	Q	80.2	Confident	81	Confident	112 Å²	112	106.9 Å²	106.9	52%	0.523	53%	0.532	S	S	.	.	H	α-helix	trans	-66.7	-45.3	173.8	-66.3	-174.3	26.2	0	0	111.7	D517 Q518 L523 S524 Q525	D517-Q521 PolarHBondContact O-N 3.5Å; D517-Q521 VanDerWaalsContact O-N 3.13Å; Q518-Q521 WeakPolarHBondContact O-CA 3.35Å; Q518-Q521 WeakPolarHBondContact O-CB 3.38Å; Q518-Q521 PolarHBondContact O-N 3.35Å; Q521-L523 PolarHBondContact O-N 3.01Å; Q521-S524 WeakPolarHBondContact O-CA 3.45Å; Q521-S524 WeakPolarHBondContact O-CB 3.21Å; Q521-S524 PolarHBondContact O-N 2.91Å; Q521-Q525 PolarHBondContact O-N 3.49Å
522	D	83.5	Confident	80.7	Confident	78 Å²	78	104.6 Å²	104.6	42%	0.417	53%	0.531	S	S	.	.	H	α-helix	trans	-58.2	-48.2	179.6	-59.9	-15.3	0	0	0	111.2	Q518 S524 Q525 E526	Q518-D522 PolarHBondContact NE2-OD1 3.16Å; Q518-D522 VanDerWaalsContact O-CG 3.24Å; Q518-D522 PolarHBondContact O-N 2.98Å; D522-S524 VanDerWaalsContact C-N 3.25Å; D522-S524 PolarHBondContact O-N 3.26Å; D522-Q525 PolarHBondContact O-N 3.12Å; D522-E526 PolarHBondContact O-N 3.44Å
523	L	82.1	Confident	80.5	Confident	97 Å²	97	102.6 Å²	102.6	51%	0.508	52%	0.523	S	S	.	.	H	α-helix	trans	-63.2	-29.1	175.1	-74.6	169.3	0	0	0	113	K519 Q521 K527	K519-L523 WeakPolarHBondContact O-CB 3.48Å; K519-L523 WeakPolarHBondContact O-CD1 3.32Å; K519-L523 VanDerWaalsContact O-CG 3.31Å; K519-L523 WeakPolarHBondContact O-CG 3.48Å; K519-L523 PolarHBondContact O-N 3.17Å; Q521-L523 PolarHBondContact O-N 3.01Å; L523-K527 VanDerWaalsContact O-CB 3.29Å; L523-K527 WeakPolarHBondContact O-CB 3.49Å; L523-K527 PolarHBondContact O-N 3.32Å; L523-K527 VanDerWaalsContact O-N 3.16Å
524	S	78.1	Confident	80.7	Confident	63 Å²	63	103.6 Å²	103.6	44%	0.441	53%	0.526	S	S	.	.	H	α-helix	trans	-72.7	-39.1	174.1	-164.1	0	0	0	0	111.9	L520 Q521 D522 K527 E528	L520-S524 WeakPolarHBondContact O-CB 3.48Å; L520-S524 PolarHBondContact O-N 3.38Å; L520-S524 VanDerWaalsContact O-N 3.14Å; Q521-S524 WeakPolarHBondContact O-CA 3.45Å; Q521-S524 WeakPolarHBondContact O-CB 3.21Å; Q521-S524 PolarHBondContact O-N 2.91Å; D522-S524 VanDerWaalsContact C-N 3.25Å; D522-S524 PolarHBondContact O-N 3.26Å; S524-K527 PolarHBondContact O-N 2.88Å; S524-E528 PolarHBondContact O-N 3.43Å; S524-E528 VanDerWaalsContact O-N 3.14Å
525	Q	81.1	Confident	80.9	Confident	120 Å²	120	104.7 Å²	104.7	56%	0.561	53%	0.526	S	S	*	.	H	α-helix	trans	-69	-41.6	175.5	-67.5	-174	18.4	0	0	112	Q521 D522 K527 E528 Q529	Q521-Q525 PolarHBondContact O-N 3.49Å; D522-Q525 PolarHBondContact O-N 3.12Å; Q525-K527 VanDerWaalsContact C-N 3.29Å; Q525-K527 PolarHBondContact O-N 2.92Å; Q525-E528 PolarHBondContact O-N 2.85Å; Q525-E528 VanDerWaalsContact O-N 3.16Å; Q525-Q529 PolarHBondContact O-N 3.12Å
526	E	81.3	Confident	80.6	Confident	109 Å²	109	106.7 Å²	106.7	51%	0.509	53%	0.532	S	S	.	.	H	α-helix	trans	-58.8	-42.7	174.5	-172.6	-177.8	-171.2	0	0	111	D522 E528 Q529 L530	D522-E526 PolarHBondContact O-N 3.44Å; E526-E528 VanDerWaalsContact C-N 3.34Å; E526-E528 PolarHBondContact O-N 3.48Å; E526-Q529 PolarHBondContact O-N 2.98Å; E526-L530 HydrophobicContact CG-CD1 4.11Å; E526-L530 WeakPolarHBondContact O-CB 3.35Å; E526-L530 WeakPolarHBondContact O-CG 3.41Å; E526-L530 PolarHBondContact O-N 2.91Å
527	K	79.3	Confident	80.6	Confident	154 Å²	154	106 Å²	106	67%	0.67	53%	0.529	S	S	*	.	H	α-helix	trans	-61.8	-37.3	175.3	-178.8	-174.6	174.8	-168.9	0	113	L523 S524 Q525 A531	L523-K527 VanDerWaalsContact O-CB 3.29Å; L523-K527 WeakPolarHBondContact O-CB 3.49Å; L523-K527 PolarHBondContact O-N 3.32Å; L523-K527 VanDerWaalsContact O-N 3.16Å; S524-K527 PolarHBondContact O-N 2.88Å; Q525-K527 VanDerWaalsContact C-N 3.29Å; Q525-K527 PolarHBondContact O-N 2.92Å; K527-A531 PolarHBondContact O-N 3.15Å
528	E	80	Confident	80.5	Confident	133 Å²	133	105.5 Å²	105.5	62%	0.621	52%	0.523	S	S	*	.	H	α-helix	trans	-72.5	-39.6	174.8	-72.2	-172.1	155	0	0	112.3	S524 Q525 E526 L530 A531 C532	S524-E528 PolarHBondContact O-N 3.43Å; S524-E528 VanDerWaalsContact O-N 3.14Å; Q525-E528 PolarHBondContact O-N 2.85Å; Q525-E528 VanDerWaalsContact O-N 3.16Å; E526-E528 VanDerWaalsContact C-N 3.34Å; E526-E528 PolarHBondContact O-N 3.48Å; E528-L530 VanDerWaalsContact C-N 3.34Å; E528-L530 PolarHBondContact O-N 3.49Å; E528-A531 WeakPolarHBondContact O-CB 3.46Å; E528-A531 PolarHBondContact O-N 3.04Å; E528-C532 PolarHBondContact O-N 3.44Å
529	Q	78.5	Confident	80.4	Confident	141 Å²	141	107.5 Å²	107.5	66%	0.659	53%	0.53	S	S	*	.	H	α-helix	trans	-61.9	-40.5	172.3	-75.3	-170.3	-7.8	0	0	112.5	Q525 E526 A531 C532 T533	Q525-Q529 PolarHBondContact O-N 3.12Å; E526-Q529 PolarHBondContact O-N 2.98Å; Q529-A531 VanDerWaalsContact C-N 3.33Å; Q529-C532 PolarHBondContact O-N 2.99Å; Q529-T533 PolarHBondContact O-N 2.72Å; Q529-T533 PolarHBondContact O-OG1 2.94Å
530	L	80.6	Confident	80.2	Confident	105 Å²	105	105.5 Å²	105.5	55%	0.55	52%	0.523	S	S	.	.	H	α-helix	trans	-64.7	-35	173.8	-77.5	165.8	0	0	0	112.2	E526 E528 T533 K534	E526-L530 HydrophobicContact CG-CD1 4.11Å; E526-L530 WeakPolarHBondContact O-CB 3.35Å; E526-L530 WeakPolarHBondContact O-CG 3.41Å; E526-L530 PolarHBondContact O-N 2.91Å; E528-L530 VanDerWaalsContact C-N 3.34Å; E528-L530 PolarHBondContact O-N 3.49Å; L530-T533 WeakPolarHBondContact CA-OG1 3.41Å; L530-T533 PolarHBondContact O-OG1 3.24Å; L530-K534 WeakPolarHBondContact O-CB 3.43Å; L530-K534 PolarHBondContact O-N 3.16Å
531	A	79.6	Confident	80.2	Confident	59 Å²	59	105.3 Å²	105.3	49%	0.488	52%	0.523	S	S	.	.	H	α-helix	trans	-67.6	-43.1	173.8	0	0	0	0	0	112.1	K527 E528 Q529 K534 L535	K527-A531 PolarHBondContact O-N 3.15Å; E528-A531 WeakPolarHBondContact O-CB 3.46Å; E528-A531 PolarHBondContact O-N 3.04Å; Q529-A531 VanDerWaalsContact C-N 3.33Å; A531-K534 PolarHBondContact O-N 3.45Å; A531-L535 PolarHBondContact O-N 3.47Å
532	C	80.3	Confident	80.2	Confident	80 Å²	80	106 Å²	106	54%	0.541	53%	0.526	S	S	.	.	H	α-helix	trans	-63.1	-50.6	176.1	-73	0	0	0	0	112.4	E528 Q529 K534 L535 E536	E528-C532 PolarHBondContact O-N 3.44Å; Q529-C532 PolarHBondContact O-N 2.99Å; C532-K534 VanDerWaalsContact C-N 3.3Å; C532-K534 PolarHBondContact O-N 3.26Å; C532-L535 WeakPolarHBondContact O-CB 3.46Å; C532-L535 PolarHBondContact O-N 2.99Å; C532-E536 PolarHBondContact O-N 3.14Å
533	T	80.6	Confident	79.9	Confident	69 Å²	69	103.6 Å²	103.6	42%	0.423	52%	0.519	S	S	.	.	H	α-helix	trans	-65.5	-31.1	178.6	46.3	0	0	0	0	112.8	Q529 L530 E536 R537	Q529-T533 PolarHBondContact O-N 2.72Å; Q529-T533 PolarHBondContact O-OG1 2.94Å; L530-T533 WeakPolarHBondContact CA-OG1 3.41Å; L530-T533 PolarHBondContact O-OG1 3.24Å; T533-E536 PolarHBondContact O-N 3.14Å; T533-R537 WeakPolarHBondContact O-CB 3.44Å; T533-R537 WeakPolarHBondContact O-CG 3.45Å; T533-R537 PolarHBondContact O-N 3.06Å
534	K	82.1	Confident	79.9	Confident	117 Å²	117	102.9 Å²	102.9	51%	0.509	52%	0.515	S	S	.	.	H	α-helix	trans	-62.7	-43.5	169	179.9	177.1	176.8	-68.4	0	112	L530 A531 C532 E536 R537 E538	L530-K534 WeakPolarHBondContact O-CB 3.43Å; L530-K534 PolarHBondContact O-N 3.16Å; A531-K534 PolarHBondContact O-N 3.45Å; C532-K534 VanDerWaalsContact C-N 3.3Å; C532-K534 PolarHBondContact O-N 3.26Å; K534-E536 VanDerWaalsContact C-N 3.33Å; K534-E536 PolarHBondContact O-N 3.16Å; K534-R537 PolarHBondContact O-N 2.93Å; K534-E538 WeakPolarHBondContact CE-OE1 3.29Å; K534-E538 IonicContact NZ-OE1 3.29Å; K534-E538 PolarHBondContact NZ-OE1 3.46Å; K534-E538 IonicContact NZ-OE2 2.68Å; K534-E538 PolarHBondContact NZ-OE2 2.79Å; K534-E538 VanDerWaalsContact NZ-OE2 3.16Å; K534-E538 WeakPolarHBondContact O-CG 3.45Å; K534-E538 PolarHBondContact O-N 2.92Å
535	L	81.8	Confident	79.7	Confident	98 Å²	98	106.1 Å²	106.1	51%	0.513	52%	0.524	S	S	.	.	H	α-helix	trans	-65.7	-35.9	178.3	-168.2	73.8	0	0	0	112	A531 C532 E538 K539	A531-L535 PolarHBondContact O-N 3.47Å; C532-L535 WeakPolarHBondContact O-CB 3.46Å; C532-L535 PolarHBondContact O-N 2.99Å; L535-E538 PolarHBondContact O-N 2.95Å; L535-K539 PolarHBondContact O-N 3.29Å; L535-K539 VanDerWaalsContact O-N 3.13Å
536	E	78.9	Confident	79.7	Confident	127 Å²	127	107.2 Å²	107.2	59%	0.593	53%	0.529	S	S	*	.	H	α-helix	trans	-66.9	-46	173	-68.9	-179.6	147.4	0	0	111.7	C532 T533 K534 E538 K539 E540	C532-E536 PolarHBondContact O-N 3.14Å; T533-E536 PolarHBondContact O-N 3.14Å; K534-E536 VanDerWaalsContact C-N 3.33Å; K534-E536 PolarHBondContact O-N 3.16Å; E536-E538 VanDerWaalsContact C-N 3.26Å; E536-E538 PolarHBondContact O-N 3.14Å; E536-K539 PolarHBondContact O-N 3.26Å; E536-E540 WeakPolarHBondContact O-CB 3.3Å; E536-E540 PolarHBondContact O-N 3.38Å
537	R	79.7	Confident	79.5	Confident	149 Å²	149	107.8 Å²	107.8	56%	0.562	53%	0.531	S	S	*	.	H	α-helix	trans	-58.3	-35.1	172.3	-71.1	-101.4	101.2	105.8	-0.3	112.5	T533 K534 E540 N541	T533-R537 WeakPolarHBondContact O-CB 3.44Å; T533-R537 WeakPolarHBondContact O-CG 3.45Å; T533-R537 PolarHBondContact O-N 3.06Å; K534-R537 PolarHBondContact O-N 2.93Å; R537-E540 IonicContact CZ-OE2 2.83Å; R537-E540 IonicContact NE-OE2 3.92Å; R537-E540 PolarHBondContact NE-OE2 3.35Å; R537-E540 IonicContact NH2-OE1 2.98Å; R537-E540 IonicContact NH2-OE2 2.62Å; R537-E540 PolarHBondContact NH2-OE2 3.19Å; R537-N541 VanDerWaalsContact O-CB 3.31Å; R537-N541 WeakPolarHBondContact O-CB 3.43Å; R537-N541 PolarHBondContact O-N 3.15Å; R537-N541 PolarHBondContact O-ND2 3.23Å
538	E	78.6	Confident	79.5	Confident	83 Å²	83	105 Å²	105	39%	0.388	52%	0.523	S	S	.	.	H	α-helix	trans	-70.2	-37.8	176.9	-78.1	174.4	160.3	0	0	112.1	K534 L535 E536 Q542	K534-E538 WeakPolarHBondContact CE-OE1 3.29Å; K534-E538 IonicContact NZ-OE1 3.29Å; K534-E538 PolarHBondContact NZ-OE1 3.46Å; K534-E538 IonicContact NZ-OE2 2.68Å; K534-E538 PolarHBondContact NZ-OE2 2.79Å; K534-E538 VanDerWaalsContact NZ-OE2 3.16Å; K534-E538 WeakPolarHBondContact O-CG 3.45Å; K534-E538 PolarHBondContact O-N 2.92Å; L535-E538 PolarHBondContact O-N 2.95Å; E536-E538 VanDerWaalsContact C-N 3.26Å; E536-E538 PolarHBondContact O-N 3.14Å; E538-Q542 VanDerWaalsContact O-CG 3.29Å; E538-Q542 WeakPolarHBondContact O-CG 3.4Å; E538-Q542 PolarHBondContact O-N 3.37Å
539	K	81.9	Confident	79.3	Confident	135 Å²	135	101.2 Å²	101.2	59%	0.587	51%	0.512	S	S	*	.	H	α-helix	trans	-68.1	-42.2	170.8	-69.7	174.9	-178	174.9	0	112.7	L535 E536 Q542 G543	L535-K539 PolarHBondContact O-N 3.29Å; L535-K539 VanDerWaalsContact O-N 3.13Å; E536-K539 PolarHBondContact O-N 3.26Å; K539-Q542 PolarHBondContact O-N 3.45Å; K539-G543 PolarHBondContact O-N 2.64Å
540	E	78.7	Confident	79.2	Confident	97 Å²	97	97.4 Å²	97.4	45%	0.453	50%	0.501	S	S	.	.	H	α-helix	trans	-60.6	-46.1	176.8	-172.1	177.9	-127.5	0	0	110.5	E536 R537 G543 L544	E536-E540 WeakPolarHBondContact O-CB 3.3Å; E536-E540 PolarHBondContact O-N 3.38Å; R537-E540 IonicContact CZ-OE2 2.83Å; R537-E540 IonicContact NE-OE2 3.92Å; R537-E540 PolarHBondContact NE-OE2 3.35Å; R537-E540 IonicContact NH2-OE1 2.98Å; R537-E540 IonicContact NH2-OE2 2.62Å; R537-E540 PolarHBondContact NH2-OE2 3.19Å; E540-G543 PolarHBondContact O-N 3.04Å; E540-L544 WeakPolarHBondContact O-CG 3.36Å; E540-L544 PolarHBondContact O-N 2.65Å
541	N	76.8	Confident	79.2	Confident	86 Å²	86	96.6 Å²	96.6	46%	0.46	50%	0.496	S	S	.	.	H	α-helix	trans	-62.8	-39.8	172.7	-79.7	-47.6	0	0	0	112.8	R537 L544 Q545	R537-N541 VanDerWaalsContact O-CB 3.31Å; R537-N541 WeakPolarHBondContact O-CB 3.43Å; R537-N541 PolarHBondContact O-N 3.15Å; R537-N541 PolarHBondContact O-ND2 3.23Å; N541-L544 CarbonylContact O-C 3.49Å; N541-L544 PolarHBondContact O-N 2.82Å; N541-Q545 WeakPolarHBondContact O-CB 3.5Å; N541-Q545 PolarHBondContact O-N 3.02Å
542	Q	79.9	Confident	79.1	Confident	127 Å²	127	99.9 Å²	99.9	59%	0.593	50%	0.502	S	S	*	.	H	α-helix	trans	-60.7	-45.7	175	-77.9	170.9	2.5	0	0	111.9	E538 K539 L544 Q545 E546	E538-Q542 VanDerWaalsContact O-CG 3.29Å; E538-Q542 WeakPolarHBondContact O-CG 3.4Å; E538-Q542 PolarHBondContact O-N 3.37Å; K539-Q542 PolarHBondContact O-N 3.45Å; Q542-L544 VanDerWaalsContact C-N 3.33Å; Q542-L544 PolarHBondContact O-N 3.02Å; Q542-Q545 VanDerWaalsContact O-CB 3.31Å; Q542-Q545 WeakPolarHBondContact O-CB 3.34Å; Q542-Q545 PolarHBondContact O-N 2.78Å; Q542-Q545 VanDerWaalsContact O-N 3.11Å; Q542-E546 PolarHBondContact O-N 2.79Å
543	G	79.2	Confident	78.9	Confident	27 Å²	27	101 Å²	101	28%	0.278	50%	0.502	S	S	.	.	H	α-helix	trans	-62.6	-37	174.9	0	0	0	0	0	113.2	K539 E540 E546 Q547	K539-G543 PolarHBondContact O-N 2.64Å; E540-G543 PolarHBondContact O-N 3.04Å; G543-E546 PolarHBondContact O-N 2.88Å; G543-Q547 WeakPolarHBondContact O-CG 3.28Å; G543-Q547 PolarHBondContact O-N 3.31Å
544	L	81.8	Confident	78.7	Confident	81 Å²	81	102.8 Å²	102.8	42%	0.424	51%	0.506	S	S	.	.	H	α-helix	trans	-68.8	-33.9	172	-69.6	170.9	0	0	0	112.4	E540 N541 Q542 Q547 L548	E540-L544 WeakPolarHBondContact O-CG 3.36Å; E540-L544 PolarHBondContact O-N 2.65Å; N541-L544 CarbonylContact O-C 3.49Å; N541-L544 PolarHBondContact O-N 2.82Å; Q542-L544 VanDerWaalsContact C-N 3.33Å; Q542-L544 PolarHBondContact O-N 3.02Å; L544-Q547 PolarHBondContact O-N 3.25Å; L544-L548 WeakPolarHBondContact O-CB 3.36Å; L544-L548 VanDerWaalsContact O-CG 3.31Å; L544-L548 WeakPolarHBondContact O-CG 3.41Å; L544-L548 PolarHBondContact O-N 2.86Å
545	Q	74.1	Confident	78.5	Confident	132 Å²	132	102.5 Å²	102.5	62%	0.617	51%	0.509	S	S	*	.	H	α-helix	trans	-65.3	-40.3	174.4	-150.7	87	26.2	0	0	111.2	N541 Q542 L548 S549	N541-Q545 WeakPolarHBondContact O-CB 3.5Å; N541-Q545 PolarHBondContact O-N 3.02Å; Q542-Q545 VanDerWaalsContact O-CB 3.31Å; Q542-Q545 WeakPolarHBondContact O-CB 3.34Å; Q542-Q545 PolarHBondContact O-N 2.78Å; Q542-Q545 VanDerWaalsContact O-N 3.11Å; Q545-L548 PolarHBondContact O-N 3.32Å; Q545-S549 PolarHBondContact O-N 3.36Å
546	E	79.3	Confident	78.3	Confident	142 Å²	142	104.4 Å²	104.4	66%	0.664	52%	0.515	S	S	*	.	H	α-helix	trans	-66	-42.9	173.4	-71.2	-178.5	171.3	0	0	111.8	Q542 G543 S549 S550	Q542-E546 PolarHBondContact O-N 2.79Å; G543-E546 PolarHBondContact O-N 2.88Å; E546-S549 PolarHBondContact O-N 2.91Å; E546-S549 PolarHBondContact O-OG 2.7Å; E546-S550 PolarHBondContact O-N 2.92Å
547	Q	78.6	Confident	78.1	Confident	121 Å²	121	105.1 Å²	105.1	57%	0.565	52%	0.516	S	S	*	.	H	α-helix	trans	-62.9	-41.7	173.6	-71.9	177.2	27.3	0	0	112	G543 L544 S550 L551	G543-Q547 WeakPolarHBondContact O-CG 3.28Å; G543-Q547 PolarHBondContact O-N 3.31Å; L544-Q547 PolarHBondContact O-N 3.25Å; Q547-S550 WeakPolarHBondContact O-CB 3.47Å; Q547-S550 PolarHBondContact O-N 2.96Å; Q547-L551 WeakPolarHBondContact O-CB 3.31Å; Q547-L551 WeakPolarHBondContact O-CG 3.28Å; Q547-L551 PolarHBondContact O-N 2.91Å
548	L	77.8	Confident	77.9	Confident	95 Å²	95	103.4 Å²	103.4	50%	0.497	52%	0.517	S	S	.	.	H	α-helix	trans	-63.5	-39.1	174.7	-78.3	170.1	0	0	0	111.9	L544 Q545 L551 Q552	L544-L548 WeakPolarHBondContact O-CB 3.36Å; L544-L548 VanDerWaalsContact O-CG 3.31Å; L544-L548 WeakPolarHBondContact O-CG 3.41Å; L544-L548 PolarHBondContact O-N 2.86Å; Q545-L548 PolarHBondContact O-N 3.32Å; L548-L551 PolarHBondContact O-N 3.44Å; L548-Q552 WeakPolarHBondContact O-CB 3.42Å; L548-Q552 VanDerWaalsContact O-CG 3.28Å; L548-Q552 WeakPolarHBondContact O-CG 3.32Å; L548-Q552 PolarHBondContact O-N 3.34Å
549	S	77.1	Confident	77.4	Confident	55 Å²	55	102 Å²	102	39%	0.385	52%	0.517	S	S	.	.	H	α-helix	trans	-67.8	-38.3	175.6	82.3	0	0	0	0	111.7	Q545 E546 Q552 N553	Q545-S549 PolarHBondContact O-N 3.36Å; E546-S549 PolarHBondContact O-N 2.91Å; E546-S549 PolarHBondContact O-OG 2.7Å; S549-Q552 PolarHBondContact O-N 3.48Å; S549-N553 PolarHBondContact O-N 2.71Å; S549-N553 PolarHBondContact O-ND2 2.65Å
550	S	76.9	Confident	76.9	Confident	61 Å²	61	103.3 Å²	103.3	43%	0.427	52%	0.523	S	S	.	.	H	α-helix	trans	-61.8	-46.1	172.9	-174	0	0	0	0	111.7	E546 Q547 N553 Q554	E546-S550 PolarHBondContact O-N 2.92Å; Q547-S550 WeakPolarHBondContact O-CB 3.47Å; Q547-S550 PolarHBondContact O-N 2.96Å; S550-N553 PolarHBondContact O-N 2.89Å; S550-Q554 WeakPolarHBondContact O-CG 3.33Å; S550-Q554 PolarHBondContact O-N 3.14Å
551	L	80.1	Confident	76.3	Confident	87 Å²	87	102.3 Å²	102.3	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-66.4	-37	175.4	-72.1	168.9	0	0	0	112.3	Q547 L548 Q554 I555	Q547-L551 WeakPolarHBondContact O-CB 3.31Å; Q547-L551 WeakPolarHBondContact O-CG 3.28Å; Q547-L551 PolarHBondContact O-N 2.91Å; L548-L551 PolarHBondContact O-N 3.44Å; L551-Q554 PolarHBondContact O-N 3.24Å; L551-I555 WeakPolarHBondContact O-CB 3.48Å; L551-I555 WeakPolarHBondContact O-CD1 3.3Å; L551-I555 VanDerWaalsContact O-CG1 3.23Å; L551-I555 WeakPolarHBondContact O-CG1 3.29Å; L551-I555 PolarHBondContact O-N 3.43Å
552	Q	76	Confident	75.8	Confident	128 Å²	128	102.2 Å²	102.2	60%	0.598	52%	0.52	S	S	*	.	H	α-helix	trans	-64.4	-42	173.6	-80.1	175.8	-23.4	0	0	111.7	L548 S549 Q554 I555 E556	L548-Q552 WeakPolarHBondContact O-CB 3.42Å; L548-Q552 VanDerWaalsContact O-CG 3.28Å; L548-Q552 WeakPolarHBondContact O-CG 3.32Å; L548-Q552 PolarHBondContact O-N 3.34Å; S549-Q552 PolarHBondContact O-N 3.48Å; Q552-Q554 VanDerWaalsContact C-N 3.32Å; Q552-Q554 PolarHBondContact O-N 2.65Å; Q552-I555 PolarHBondContact O-N 3.41Å; Q552-E556 WeakPolarHBondContact O-CB 3.13Å; Q552-E556 PolarHBondContact O-N 3.37Å
553	N	78.1	Confident	74.9	Confident	104 Å²	104	100.9 Å²	100.9	56%	0.556	51%	0.513	S	S	*	.	H	α-helix	trans	-63.1	-36.7	173.2	-79.2	-77	0	0	0	112.1	S549 S550 K557	S549-N553 PolarHBondContact O-N 2.71Å; S549-N553 PolarHBondContact O-ND2 2.65Å; S550-N553 PolarHBondContact O-N 2.89Å; N553-K557 WeakPolarHBondContact O-CB 3.43Å; N553-K557 PolarHBondContact O-N 2.68Å; N553-K557 VanDerWaalsContact O-N 3.08Å
554	Q	75.5	Confident	74	Confident	107 Å²	107	107.5 Å²	107.5	50%	0.5	54%	0.537	S	S	.	.	H	α-helix	trans	-67.1	-42.1	172.2	-70.5	-179.1	15.4	0	0	112.2	S550 L551 Q552 K557 L558	S550-Q554 WeakPolarHBondContact O-CG 3.33Å; S550-Q554 PolarHBondContact O-N 3.14Å; L551-Q554 PolarHBondContact O-N 3.24Å; Q552-Q554 VanDerWaalsContact C-N 3.32Å; Q552-Q554 PolarHBondContact O-N 2.65Å; Q554-K557 PolarHBondContact O-N 3.01Å; Q554-L558 WeakPolarHBondContact O-CB 3.33Å; Q554-L558 VanDerWaalsContact O-CG 3.28Å; Q554-L558 WeakPolarHBondContact O-CG 3.46Å; Q554-L558 PolarHBondContact O-N 3.28Å
555	I	78	Confident	72.7	Confident	110 Å²	110	107.2 Å²	107.2	56%	0.564	55%	0.546	S	S	*	.	H	α-helix	trans	-66.6	-41	177.4	-71.6	163.5	0	0	0	110.9	L551 Q552 L558 S559	L551-I555 WeakPolarHBondContact O-CB 3.48Å; L551-I555 WeakPolarHBondContact O-CD1 3.3Å; L551-I555 VanDerWaalsContact O-CG1 3.23Å; L551-I555 WeakPolarHBondContact O-CG1 3.29Å; L551-I555 PolarHBondContact O-N 3.43Å; Q552-I555 PolarHBondContact O-N 3.41Å; I555-L558 PolarHBondContact O-N 3.02Å; I555-S559 WeakPolarHBondContact O-CA 3.17Å; I555-S559 WeakPolarHBondContact O-CB 3.48Å; I555-S559 PolarHBondContact O-N 3.26Å
556	E	76.6	Confident	71.6	Confident	138 Å²	138	106.2 Å²	106.2	65%	0.645	54%	0.54	S	S	*	.	H	α-helix	trans	-65.3	-41.5	176.8	-173.7	172.8	-167.2	0	0	111.1	Q552 S559 K560	Q552-E556 WeakPolarHBondContact O-CB 3.13Å; Q552-E556 PolarHBondContact O-N 3.37Å; E556-S559 PolarHBondContact O-N 2.81Å; E556-K560 WeakPolarHBondContact O-CB 3.23Å; E556-K560 PolarHBondContact O-N 2.84Å
557	K	75.6	Confident	70.2	Confident	142 Å²	142	105.3 Å²	105.3	62%	0.617	54%	0.544	S	S	*	.	H	α-helix	trans	-60.2	-53.5	171.9	-173.7	-179.4	177.9	-174.9	0	111.7	N553 Q554 S559 K560 D561	N553-K557 WeakPolarHBondContact O-CB 3.43Å; N553-K557 PolarHBondContact O-N 2.68Å; N553-K557 VanDerWaalsContact O-N 3.08Å; Q554-K557 PolarHBondContact O-N 3.01Å; K557-S559 VanDerWaalsContact C-N 3.26Å; K557-S559 PolarHBondContact O-N 3Å; K557-K560 WeakPolarHBondContact O-CB 3.27Å; K557-K560 PolarHBondContact O-N 3.32Å; K557-K560 VanDerWaalsContact O-N 3.11Å; K557-D561 PolarHBondContact O-N 3.33Å
558	L	74.6	Confident	68.7	Low	113 Å²	113	108.1 Å²	108.1	59%	0.592	56%	0.555	S	S	*	*	H	α-helix	trans	-63.2	-30.7	178.6	-71.8	169	0	0	0	112.7	Q554 I555 L562	Q554-L558 WeakPolarHBondContact O-CB 3.33Å; Q554-L558 VanDerWaalsContact O-CG 3.28Å; Q554-L558 WeakPolarHBondContact O-CG 3.46Å; Q554-L558 PolarHBondContact O-N 3.28Å; I555-L558 PolarHBondContact O-N 3.02Å; L558-L562 WeakPolarHBondContact O-CB 3.27Å; L558-L562 PolarHBondContact O-N 3.2Å
559	S	68.2	Low	66.8	Low	55 Å²	55	109.6 Å²	109.6	39%	0.385	57%	0.567	S	S	.	*	H	α-helix	trans	-71.6	-36.4	175	-168.9	0	0	0	0	111.4	I555 E556 K557 L562 E563	I555-S559 WeakPolarHBondContact O-CA 3.17Å; I555-S559 WeakPolarHBondContact O-CB 3.48Å; I555-S559 PolarHBondContact O-N 3.26Å; E556-S559 PolarHBondContact O-N 2.81Å; K557-S559 VanDerWaalsContact C-N 3.26Å; K557-S559 PolarHBondContact O-N 3Å; S559-L562 PolarHBondContact O-N 3.2Å; S559-E563 WeakPolarHBondContact O-CG 3.35Å; S559-E563 PolarHBondContact O-N 3.32Å
560	K	72.1	Confident	64.8	Low	161 Å²	161	114.3 Å²	114.3	70%	0.7	59%	0.587	S	S	*	*	H	α-helix	trans	-65.9	-46.3	172.4	-168.1	174.3	-176.3	175	0	111.5	E556 K557 L562 E563 E564	E556-K560 WeakPolarHBondContact O-CB 3.23Å; E556-K560 PolarHBondContact O-N 2.84Å; K557-K560 WeakPolarHBondContact O-CB 3.27Å; K557-K560 PolarHBondContact O-N 3.32Å; K557-K560 VanDerWaalsContact O-N 3.11Å; K560-L562 PolarHBondContact O-N 2.98Å; K560-E563 PolarHBondContact O-N 3.03Å; K560-E564 PolarHBondContact O-N 3.47Å; K560-E564 VanDerWaalsContact O-N 3.12Å
561	D	66.5	Low	62.6	Low	77 Å²	77	116.9 Å²	116.9	41%	0.412	60%	0.6	S	S	.	*	H	α-helix	trans	-60.4	-33.7	173.5	-57.4	-19.2	0	0	0	111	K557 A565	K557-D561 PolarHBondContact O-N 3.33Å; D561-A565 PolarHBondContact O-N 3.5Å
562	L	64.8	Low	60.3	Low	84 Å²	84	119 Å²	119	44%	0.44	62%	0.616	S	S	.	*	H	α-helix	trans	-76.6	-38.1	178.5	178.7	64	0	0	0	113.9	L558 S559 K560 A565 K566	L558-L562 WeakPolarHBondContact O-CB 3.27Å; L558-L562 PolarHBondContact O-N 3.2Å; S559-L562 PolarHBondContact O-N 3.2Å; K560-L562 PolarHBondContact O-N 2.98Å; L562-A565 CarbonylContact O-C 3.56Å; L562-A565 PolarHBondContact O-N 2.79Å; L562-K566 HydrophobicContact CD1-CG 4.39Å; L562-K566 HydrophobicContact CG-CD 4.23Å; L562-K566 HydrophobicContact CG-CG 4.49Å; L562-K566 WeakPolarHBondContact O-CB 3.44Å; L562-K566 WeakPolarHBondContact O-CG 3.4Å; L562-K566 PolarHBondContact O-N 3.31Å
563	E	62.3	Low	58.1	Low	99 Å²	99	118.3 Å²	118.3	46%	0.463	62%	0.621	S	S	.	*	H	α-helix	trans	-69.2	-35.3	174.1	-70.2	-54	129.2	0	0	111.6	S559 K560 A565 K566 T567	S559-E563 WeakPolarHBondContact O-CG 3.35Å; S559-E563 PolarHBondContact O-N 3.32Å; K560-E563 PolarHBondContact O-N 3.03Å; E563-A565 PolarHBondContact O-N 3.35Å; E563-K566 PolarHBondContact O-N 3.4Å; E563-K566 VanDerWaalsContact OE1-CD 3.24Å; E563-K566 WeakPolarHBondContact OE1-CD 3.3Å; E563-K566 IonicContact OE1-NZ 2.65Å; E563-K566 PolarHBondContact OE1-NZ 2.99Å; E563-T567 PolarHBondContact O-OG1 2.86Å
564	E	59	Low	55.9	Low	166 Å²	166	119.5 Å²	119.5	78%	0.776	63%	0.632	S	S	*	*	H	α-helix	trans	-61.4	-33.6	170.7	-161.8	163.7	-120.5	0	0	111.4	K560	K560-E564 PolarHBondContact O-N 3.47Å; K560-E564 VanDerWaalsContact O-N 3.12Å
565	A	55.5	Low	54.4	Low	75 Å²	75	120.1 Å²	120.1	62%	0.62	65%	0.645	S	S	*	*	H	α-helix	trans	-77.8	-27.6	173.4	0	0	0	0	0	115.1	D561 L562 E563 T567	D561-A565 PolarHBondContact O-N 3.5Å; L562-A565 CarbonylContact O-C 3.56Å; L562-A565 PolarHBondContact O-N 2.79Å; E563-A565 PolarHBondContact O-N 3.35Å; A565-T567 PolarHBondContact O-N 2.78Å
566	K	50.1	Low	52.5	Low	110 Å²	110	121.1 Å²	121.1	48%	0.478	66%	0.656	S	S	.	*	H	α-helix	trans	-80.6	-4.9	-174.2	-84.4	173.2	-175.2	164.5	0	115.8	L562 E563 K568	L562-K566 HydrophobicContact CD1-CG 4.39Å; L562-K566 HydrophobicContact CG-CD 4.23Å; L562-K566 HydrophobicContact CG-CG 4.49Å; L562-K566 WeakPolarHBondContact O-CB 3.44Å; L562-K566 WeakPolarHBondContact O-CG 3.4Å; L562-K566 PolarHBondContact O-N 3.31Å; E563-K566 PolarHBondContact O-N 3.4Å; E563-K566 VanDerWaalsContact OE1-CD 3.24Å; E563-K566 WeakPolarHBondContact OE1-CD 3.3Å; E563-K566 IonicContact OE1-NZ 2.65Å; E563-K566 PolarHBondContact OE1-NZ 2.99Å; K566-K568 PolarHBondContact O-N 2.96Å
567	T	51.7	Low	51	Low	123 Å²	123	120.1 Å²	120.1	76%	0.755	66%	0.662	S	S	*	*			trans	-74	34.5	-175.4	-52	0	0	0	0	113.3	E563 A565	E563-T567 PolarHBondContact O-OG1 2.86Å; A565-T567 PolarHBondContact O-N 2.78Å
568	K	46.6	Very low	49	Very low	180 Å²	180	119.9 Å²	119.9	78%	0.783	67%	0.672	S	S	*	*	S	Bend	trans	-148.2	103.1	178.4	-68.3	-176.7	-179.4	169.3	0	112.9	K566	K566-K568 PolarHBondContact O-N 2.96Å
569	V	38.3	Very low	48.5	Very low	126 Å²	126	120.7 Å²	120.7	76%	0.764	68%	0.684	S	S	*	*			trans	68	100.9	152.2	-172.9	0	0	0	0	116
570	I	34.3	Very low	46.6	Very low	154 Å²	154	121.5 Å²	121.5	79%	0.79	70%	0.701	S	S	*	*				72.5	138.3	81.3	-70.4	165.1	0	0	0	114.4
571	T	31.6	Very low	45.1	Very low	115 Å²	115	120.6 Å²	120.6	71%	0.706	71%	0.709	S	S	*	*			cis	-172.3	174.2	-22.6	-65.9	0	0	0	0	107.5
572	V	30.6	Very low	44.5	Very low	132 Å²	132	122.3 Å²	122.3	80%	0.8	72%	0.724	S	S	*	*			trans	102.1	160	156.4	-171.5	0	0	0	0	118.5
573	T	29.7	Very low	44	Very low	113 Å²	113	124.2 Å²	124.2	69%	0.693	74%	0.742	S	S	*	*				-159.7	170.6	-87.2	-45.9	0	0	0	0	112
574	V	31.6	Very low	43.8	Very low	129 Å²	129	125.1 Å²	125.1	78%	0.782	76%	0.756	S	S	*	*			trans	76.3	172.5	157.6	-94.3	0	0	0	0	120.7
575	P	45.6	Very low	43.9	Very low	121 Å²	121	123 Å²	123	79%	0.786	76%	0.757	S	S	*	*				-136.1	-151.2	-85.5	41.6	-17.6	0	0	0	117.7
576	V	36.5	Very low	43.6	Very low	130 Å²	130	125.2 Å²	125.2	79%	0.788	77%	0.765	S	S	*	*			trans	-126.9	149.2	-152.2	171.9	0	0	0	0	116.6
577	P	45.9	Very low	43.1	Very low	118 Å²	118	127.7 Å²	127.7	77%	0.766	78%	0.782	S	S	*	*			trans	-106.3	171.5	174.1	40.6	-35.2	0	0	0	116.7
578	T	33.9	Very low	42.9	Very low	137 Å²	137	128 Å²	128	84%	0.84	79%	0.786	S	S	*	*			trans	-143.4	-160.2	-168.4	71.9	0	0	0	0	115.5
579	P	63.3	Low	42.3	Very low	129 Å²	129	122.3 Å²	122.3	84%	0.838	78%	0.779	S	S	*	*			trans	-133.4	-165.6	-135.9	38.4	-12.1	0	0	0	118.4
580	G	29.8	Very low	42	Very low	73 Å²	73	125.7 Å²	125.7	75%	0.753	79%	0.787	S	S	*	*			trans	-166.9	151.1	170.1	0	0	0	0	0	115.5
581	V	40.1	Very low	42	Very low	141 Å²	141	123.5 Å²	123.5	86%	0.855	79%	0.785	S	S	*	*			trans	-150.6	145.3	-167.6	-179	0	0	0	0	115
582	P	53.7	Low	42.2	Very low	113 Å²	113	121.3 Å²	121.3	73%	0.734	79%	0.786	S	S	*	*			trans	-110.4	176	175.1	41.3	-34.2	0	0	0	116.5
583	P	53.3	Low	42.5	Very low	125 Å²	125	122.2 Å²	122.2	81%	0.812	79%	0.791	S	S	*	*			trans	-106.4	155.7	-165.4	38	-33.1	0	0	0	119.5
584	P	57.9	Low	42.7	Very low	118 Å²	118	121.2 Å²	121.2	77%	0.766	80%	0.795	S	S	*	*			trans	-108.2	166.2	-178.1	42.4	-37	0	0	0	116.2
585	P	61.1	Low	43.6	Very low	122 Å²	122	120.6 Å²	120.6	79%	0.792	79%	0.793	S	S	*	*				-146.3	-160.9	112.5	42.3	-26.3	0	0	0	111.6
586	P	50.9	Low	44.2	Very low	121 Å²	121	119.8 Å²	119.8	79%	0.786	79%	0.788	S	S	*	*			cis	-131.9	-129.4	-3.7	43	-22	0	0	0	114.7
587	L	39.8	Very low	43.9	Very low	161 Å²	161	120.4 Å²	120.4	84%	0.843	79%	0.792	S	S	*	*			trans	-155.3	176	-167	-82.7	169.2	0	0	0	111.3
588	P	46.7	Very low	43.4	Very low	129 Å²	129	119.1 Å²	119.1	84%	0.838	79%	0.792	S	S	*	*			cis	-124.8	-178	0.4	42	-27.4	0	0	0	114.3
589	G	33.1	Very low	43.9	Very low	62 Å²	62	118.4 Å²	118.4	64%	0.639	79%	0.789	S	S	*	*			cis	163.7	153.2	-12	0	0	0	0	0	114.6
590	Q	33.3	Very low	42.7	Very low	196 Å²	196	119.8 Å²	119.8	92%	0.916	79%	0.788	S	S	*	*			trans	63.5	163.8	163.3	-67.9	-177.7	18.3	0	0	120.1
591	S	33.8	Very low	43.5	Very low	108 Å²	108	122 Å²	122	76%	0.755	79%	0.789	S	S	*	*			cis	179.3	154.7	-45.4	55.3	0	0	0	0	110
592	G	34.7	Very low	43.2	Very low	70 Å²	70	118.2 Å²	118.2	72%	0.722	78%	0.778	S	S	*	*			cis	158.6	138	-9.8	0	0	0	0	0	115
593	V	37	Very low	42.3	Very low	150 Å²	150	121.9 Å²	121.9	91%	0.909	79%	0.785	S	S	*	*			trans	78.2	111.4	154.8	-171.3	0	0	0	0	122.2
594	A	34.1	Very low	41.5	Very low	93 Å²	93	120.7 Å²	120.7	77%	0.769	79%	0.786	S	S	*	*			trans	80.3	159.8	140.8	0	0	0	0	0	123.9
595	P	52	Low	40	Very low	115 Å²	115	120 Å²	120	75%	0.747	79%	0.79	S	S	*	*			trans	-124.1	-153.1	-162.3	47.9	-31.9	0	0	0	112.9
596	P	57.5	Low	39	Very low	104 Å²	104	121.9 Å²	121.9	68%	0.675	79%	0.792	S	S	*	*			cis	-138.5	-164.9	-6.7	33.6	-8.7	0	0	0	116.4
597	T	29.6	Very low	38.9	Very low	144 Å²	144	121.9 Å²	121.9	88%	0.883	79%	0.792	S	S	*	*			trans	88.3	163.6	160.1	65.2	0	0	0	0	121.7
598	A	35.7	Very low	38.6	Very low	91 Å²	91	117.7 Å²	117.7	75%	0.752	79%	0.788	S	S	*	*			trans	-134.4	-179.9	-173.2	0	0	0	0	0	109.1
599	P	45.1	Very low	38.4	Very low	122 Å²	122	117.8 Å²	117.8	79%	0.792	79%	0.788	S	S	*	*			cis	-134.2	-139	15.2	42.7	-20.5	0	0	0	115.1
600	I	36.8	Very low	38.8	Very low	158 Å²	158	121.4 Å²	121.4	81%	0.81	80%	0.797	S	S	*	*			trans	-139.2	-173.4	-165	63.3	173.7	0	0	0	110.9
601	P	47.4	Very low	39.7	Very low	120 Å²	120	117.5 Å²	117.5	78%	0.779	79%	0.789	S	S	*	*			cis	-137.3	-163.1	-4.9	44.1	-25.7	0	0	0	115.2
602	G	33.8	Very low	40.1	Very low	61 Å²	61	117.8 Å²	117.8	63%	0.629	79%	0.788	S	S	*	*			trans	137.3	106.8	137.9	0	0	0	0	0	123.2
603	H	35.7	Very low	40.8	Very low	190 Å²	190	119.7 Å²	119.7	88%	0.88	79%	0.788	S	S	*	*			trans	63.7	112	135.3	-71.4	87	0	0	0	126.9
604	A	35.6	Very low	41.6	Very low	100 Å²	100	118.1 Å²	118.1	83%	0.826	78%	0.781	S	S	*	*				75.9	126.4	116.5	0	0	0	0	0	126
605	A	27.3	Very low	41.8	Very low	102 Å²	102	119 Å²	119	84%	0.843	78%	0.779	S	S	*	*			trans	-169.2	150.5	145	0	0	0	0	0	112.5
606	I	39.1	Very low	41.6	Very low	163 Å²	163	119.1 Å²	119.1	84%	0.836	78%	0.78	S	S	*	*			trans	-155.8	-172.9	-174.6	61.2	174.3	0	0	0	110.6
607	P	49.5	Very low	41.4	Very low	120 Å²	120	119.9 Å²	119.9	78%	0.779	79%	0.785	S	S	*	*			cis	-139.4	-177.2	-8.2	43.4	-25.3	0	0	0	117.4
608	G	33.8	Very low	41.8	Very low	74 Å²	74	118.3 Å²	118.3	76%	0.763	78%	0.777	S	S	*	*			trans	101.1	165.4	149.2	0	0	0	0	0	119.1
609	P	42.5	Very low	42	Very low	131 Å²	131	123.7 Å²	123.7	85%	0.851	78%	0.784	S	S	*	*			cis	-127.6	-173.7	-1.1	42.3	-25.7	0	0	0	116.1
610	V	40.6	Very low	41.9	Very low	137 Å²	137	124.1 Å²	124.1	83%	0.83	79%	0.787	S	S	*	*			trans	-149.7	177.1	-174.6	-66.8	0	0	0	0	111.3
611	P	52.9	Low	41.6	Very low	115 Å²	115	120.6 Å²	120.6	75%	0.747	79%	0.789	S	S	*	*			cis	-118.6	-114.8	4.5	32.8	-7.6	0	0	0	113.3
612	P	42.3	Very low	41	Very low	113 Å²	113	123 Å²	123	73%	0.734	79%	0.792	S	S	*	*			cis	-130.5	173.8	11.8	44.7	-27.3	0	0	0	118.4
613	P	48.6	Very low	41	Very low	110 Å²	110	126.1 Å²	126.1	71%	0.714	80%	0.801	S	S	*	*			trans	-87.8	-168.7	164.5	39.5	-37.9	0	0	0	112.3
614	P	53	Low	40.8	Very low	117 Å²	117	120.2 Å²	120.2	76%	0.76	79%	0.792	S	S	*	*			cis	-130	-142.6	8.3	41.7	-18.5	0	0	0	112.2
615	P	40.1	Very low	41.4	Very low	112 Å²	112	121.2 Å²	121.2	73%	0.727	79%	0.79	S	S	*	*			cis	-137.6	175.6	-12	41.7	-22.7	0	0	0	118.5
616	P	45.8	Very low	42.3	Very low	118 Å²	118	122.1 Å²	122.1	77%	0.766	79%	0.787	S	S	*	*			trans	-100.2	-169.2	167	41.9	-36.4	0	0	0	112.9
617	P	54.8	Low	42.3	Very low	120 Å²	120	119.9 Å²	119.9	78%	0.779	78%	0.783	S	S	*	*			cis	-118.3	-115.7	0.1	36.4	-13	0	0	0	112.7
618	P	38.1	Very low	42	Very low	111 Å²	111	119.9 Å²	119.9	72%	0.721	78%	0.783	S	S	*	*			cis	-131.2	-167	6.8	45.4	-26.3	0	0	0	116.7
619	F	39	Very low	42.6	Very low	204 Å²	204	122 Å²	122	90%	0.895	78%	0.784	S	S	*	*			trans	-155.9	156	172.4	-105.3	-82.1	0	0	0	110.6
620	P	42.8	Very low	42.4	Very low	131 Å²	131	121.5 Å²	121.5	85%	0.851	78%	0.78	S	S	*	*			trans	-155.7	157.3	134	37.6	-19.8	0	0	0	118.1
621	G	30.9	Very low	42.3	Very low	84 Å²	84	124.3 Å²	124.3	87%	0.866	78%	0.782	S	S	*	*			trans	145.9	127.3	153	0	0	0	0	0	118.3
622	M	34.2	Very low	41.6	Very low	169 Å²	169	125.2 Å²	125.2	83%	0.833	79%	0.788	S	S	*	*			trans	-155.9	148.7	171.8	-152.3	-171.9	94.3	0	0	110.9
623	P	35	Very low	41.2	Very low	128 Å²	128	123.5 Å²	123.5	83%	0.831	79%	0.79	S	S	*	*				-147	-177.2	118.6	36	-17.7	0	0	0	114.6
624	G	30.5	Very low	40.6	Very low	65 Å²	65	126.6 Å²	126.6	67%	0.67	80%	0.797	S	S	*	*			trans	-117	-169.6	-157.2	0	0	0	0	0	120.6
625	P	48.9	Very low	39.9	Very low	122 Å²	122	126.4 Å²	126.4	79%	0.792	80%	0.796	S	S	*	*			trans	-115.5	167.6	-153.7	42.7	-36.9	0	0	0	117.3
626	P	45	Very low	40.1	Very low	120 Å²	120	124.2 Å²	124.2	78%	0.779	79%	0.793	S	S	*	*			trans	-122.4	-155.4	152.8	46.2	-34.4	0	0	0	110.7
627	P	39.7	Very low	40.1	Very low	117 Å²	117	124.4 Å²	124.4	76%	0.76	80%	0.795	S	S	*	*				-131.6	-160.4	-116.2	48.4	-26	0	0	0	114.3
628	P	44.3	Very low	39.8	Very low	119 Å²	119	124.2 Å²	124.2	77%	0.773	79%	0.793	S	S	*	*			trans	-107	-157.2	-140.3	20	9	0	0	0	111.9
629	P	45.4	Very low	40.2	Very low	120 Å²	120	124.6 Å²	124.6	78%	0.779	80%	0.796	S	S	*	*			cis	-127.5	-149.4	2.1	42	-19.6	0	0	0	111.6
630	P	38.4	Very low	40.6	Very low	120 Å²	120	120.4 Å²	120.4	78%	0.779	79%	0.789	S	S	*	*			cis	-136.5	-156.1	-3	44.8	-24	0	0	0	115.8
631	F	39.2	Very low	40.8	Very low	196 Å²	196	119.6 Å²	119.6	86%	0.86	78%	0.784	S	S	*	*			trans	-107.4	165	-179.3	-74.5	-95.6	0	0	0	114.1
632	P	36.7	Very low	41.3	Very low	134 Å²	134	121.6 Å²	121.6	87%	0.87	78%	0.782	S	S	*	*				-140.3	145	108.4	37.6	-25.9	0	0	0	114.6
633	G	34.8	Very low	41.5	Very low	77 Å²	77	123.2 Å²	123.2	79%	0.794	79%	0.785	S	S	*	*			trans	152.5	61.4	170.4	0	0	0	0	0	117.3
634	M	35.9	Very low	41.6	Very low	175 Å²	175	123.2 Å²	123.2	86%	0.862	79%	0.785	S	S	*	*			trans	-127	137.1	167.2	-92.7	-172.8	70.6	0	0	110.8
635	P	39.3	Very low	42.1	Very low	113 Å²	113	123.6 Å²	123.6	73%	0.734	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-67	151.6	154.1	-11.6	28.3	0	0	0	110.3
636	G	43.7	Very low	41.5	Very low	65 Å²	65	126.6 Å²	126.6	67%	0.67	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-78.1	163.8	172.8	0	0	0	0	0	113.1
637	P	44.9	Very low	41.4	Very low	122 Å²	122	126.9 Å²	126.9	79%	0.792	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-69.6	155.3	176.6	30.5	-35.8	0	0	0	112.4
638	P	49.1	Very low	41.2	Very low	116 Å²	116	124.6 Å²	124.6	75%	0.753	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-70.9	158.9	173.1	31.4	-35.6	0	0	0	112.3
639	P	46.8	Very low	41.2	Very low	119 Å²	119	125 Å²	125	77%	0.773	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-70.7	155.3	175.3	30.6	-35.6	0	0	0	112.5
640	P	47.8	Very low	41.3	Very low	116 Å²	116	124.9 Å²	124.9	75%	0.753	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-72.4	156.3	-177	30.3	-36.4	0	0	0	113.5
641	P	46.4	Very low	41.5	Very low	114 Å²	114	125 Å²	125	74%	0.74	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-76	147.5	-179.1	31.4	-35.7	0	0	0	113
642	P	40.7	Very low	42	Very low	127 Å²	127	121.7 Å²	121.7	83%	0.825	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-78.8	145.5	170.2	32.7	-33.8	0	0	0	111.9
643	F	38.3	Very low	42.8	Very low	202 Å²	202	121.2 Å²	121.2	89%	0.886	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-72.8	157.1	175.1	-84.1	-93.2	0	0	0	112.8
644	P	37.6	Very low	43.4	Very low	128 Å²	128	123 Å²	123	83%	0.831	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-83.2	140.1	-169.4	-8	26.3	0	0	0	113.7
645	G	41.3	Very low	43.5	Very low	73 Å²	73	122.4 Å²	122.4	75%	0.753	79%	0.789	S	S	*	*			trans	139.2	76.2	153.5	0	0	0	0	0	118.3
646	M	35.3	Very low	43.6	Very low	186 Å²	186	123 Å²	123	92%	0.916	79%	0.792	S	S	*	*			trans	-173.8	148.1	137.9	-105.1	178.4	74.7	0	0	111.1
647	P	42.9	Very low	43.1	Very low	125 Å²	125	123.6 Å²	123.6	81%	0.812	80%	0.799	S	S	*	*			trans	-93.6	153.1	-174.8	36	-34.9	0	0	0	114.5
648	G	36	Very low	42.8	Very low	70 Å²	70	126.1 Å²	126.1	72%	0.722	80%	0.802	S	S	*	*			trans	-114.7	152.7	169.8	0	0	0	0	0	112.8
649	P	45.3	Very low	42.8	Very low	128 Å²	128	126.7 Å²	126.7	83%	0.831	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-83.7	160.9	-167.1	32.8	-36.9	0	0	0	115.8
650	P	46.5	Very low	42.2	Very low	117 Å²	117	124 Å²	124	76%	0.76	80%	0.8	S	S	*	*	P	Polyproline II helix	trans	-89.3	162.9	-173.7	36.3	-37.7	0	0	0	115.4
651	P	42.3	Very low	42.8	Very low	123 Å²	123	124.5 Å²	124.5	80%	0.799	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-84.9	151.9	175.9	34.2	-35.4	0	0	0	114.5
652	P	51.3	Low	42.8	Very low	125 Å²	125	125 Å²	125	81%	0.812	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-94.3	167.6	-177.7	36.8	-36.6	0	0	0	116.2
653	P	51.8	Low	42.8	Very low	125 Å²	125	124.5 Å²	124.5	81%	0.812	80%	0.803	S	S	*	*			trans	-95.6	175.6	-173.1	38.4	-37.6	0	0	0	116.8
654	P	49.4	Very low	43.3	Very low	114 Å²	114	120.5 Å²	120.5	74%	0.74	80%	0.798	S	S	*	*			trans	-115.1	-172.9	-163.6	42.4	-34.1	0	0	0	117.8
655	L	36.6	Very low	44.2	Very low	162 Å²	162	120 Å²	120	85%	0.848	79%	0.794	S	S	*	*			trans	102.6	165.6	168	-62.6	161	0	0	0	117.2
656	P	41.3	Very low	43.8	Very low	125 Å²	125	122.3 Å²	122.3	81%	0.812	80%	0.796	S	S	*	*			cis	-138.4	171.4	-40.6	37.4	-20.3	0	0	0	116.4
657	G	33.3	Very low	44	Very low	78 Å²	78	121.3 Å²	121.3	80%	0.804	79%	0.793	S	S	*	*			trans	164	147.4	162.8	0	0	0	0	0	118.3
658	M	40.1	Very low	43.9	Very low	176 Å²	176	120.9 Å²	120.9	87%	0.867	79%	0.79	S	S	*	*			trans	-154.2	153.4	-177.6	-122.6	-173.6	78.1	0	0	112.2
659	P	48.4	Very low	43.7	Very low	128 Å²	128	121 Å²	121	83%	0.831	79%	0.792	S	S	*	*				-149.4	169	79.2	39	-19.1	0	0	0	115.1
660	G	33.7	Very low	43	Very low	63 Å²	63	124.1 Å²	124.1	65%	0.649	80%	0.798	S	S	*	*				150.8	164.6	53.1	0	0	0	0	0	111.2
661	P	60.3	Low	42.3	Very low	125 Å²	125	122.2 Å²	122.2	81%	0.812	80%	0.8	S	S	*	*			trans	-113.6	162.4	-166.9	41.9	-34.8	0	0	0	116.9
662	P	47	Very low	42.1	Very low	126 Å²	126	119.6 Å²	119.6	82%	0.818	80%	0.795	S	S	*	*				-157.1	-151.7	92	40.3	-17.5	0	0	0	114.5
663	P	41.3	Very low	41.8	Very low	115 Å²	115	119.5 Å²	119.5	75%	0.747	79%	0.794	S	S	*	*				-121.4	-179.2	-58.5	34.2	-15.1	0	0	0	115.7
664	P	47.6	Very low	41.7	Very low	119 Å²	119	119.2 Å²	119.2	77%	0.773	79%	0.792	S	S	*	*			trans	-116.5	-168	177.3	44	-34.6	0	0	0	114.3
665	P	55.9	Low	41.6	Very low	118 Å²	118	119.5 Å²	119.5	77%	0.766	79%	0.794	S	S	*	*			cis	-121.3	-167.3	-28.5	39.9	-22.4	0	0	0	112.7
666	P	33.6	Very low	42.1	Very low	121 Å²	121	117.2 Å²	117.2	79%	0.786	79%	0.789	S	S	*	*				-154.2	174.8	94.5	41.5	-22.4	0	0	0	118.4
667	L	38.7	Very low	42.3	Very low	164 Å²	164	116.7 Å²	116.7	86%	0.859	79%	0.786	S	S	*	*			trans	-138.8	175	168.8	-99.3	142.6	0	0	0	106.5
668	P	41.3	Very low	42.7	Very low	116 Å²	116	119.1 Å²	119.1	75%	0.753	79%	0.787	S	S	*	*			cis	-135.8	166.8	-6.5	39.5	-21.9	0	0	0	117.1
669	G	31.6	Very low	42.5	Very low	74 Å²	74	118.5 Å²	118.5	76%	0.763	79%	0.787	S	S	*	*				80	126	129.6	0	0	0	0	0	122.9
670	M	31.3	Very low	42	Very low	192 Å²	192	118.4 Å²	118.4	95%	0.946	79%	0.786	S	S	*	*				-175.8	130.3	118.9	-169.2	69	79.9	0	0	111.6
671	G	31.9	Very low	42.2	Very low	78 Å²	78	119.3 Å²	119.3	80%	0.804	80%	0.796	S	S	*	*			trans	78.2	136.6	170.7	0	0	0	0	0	115.5
672	G	37.2	Very low	41	Very low	67 Å²	67	116.7 Å²	116.7	69%	0.691	79%	0.791	S	S	*	*			cis	-163.5	174.9	-6.2	0	0	0	0	0	110
673	P	46.1	Very low	40.5	Very low	123 Å²	123	116.8 Å²	116.8	80%	0.799	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-64.9	151.5	177.6	28.8	-35	0	0	0	111.5
674	P	49.3	Very low	40.2	Very low	119 Å²	119	114.9 Å²	114.9	77%	0.773	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-61.5	143	174.5	26.9	-34.3	0	0	0	110.8
675	P	48.1	Very low	39.7	Very low	120 Å²	120	116.8 Å²	116.8	78%	0.779	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-66.6	151.6	-178.8	27.6	-34.5	0	0	0	112.1
676	P	45.4	Very low	39.1	Very low	114 Å²	114	115.9 Å²	115.9	74%	0.74	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-72.9	159.9	-172.6	30.6	-36.8	0	0	0	113.3
677	P	47.2	Very low	39.4	Very low	114 Å²	114	115.4 Å²	115.4	74%	0.74	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-62.4	146.7	170.4	27.8	-35.2	0	0	0	111.4
678	P	40.2	Very low	39.4	Very low	129 Å²	129	113.3 Å²	113.3	84%	0.838	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-61.6	136.1	174.9	-22.4	33.9	0	0	0	112.3
679	L	35.7	Very low	39.4	Very low	164 Å²	164	113.5 Å²	113.5	86%	0.859	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-74.1	140.5	179.8	-160.6	72.1	0	0	0	111	G681	L679-G681 PolarHBondContact O-N 3.04Å
680	P	38.5	Very low	39.7	Very low	125 Å²	125	116.3 Å²	116.3	81%	0.812	79%	0.788	S	S	*	*	S	Bend	trans	-72	119.1	178	-15.9	30.4	0	0	0	112
681	G	38.2	Very low	40.2	Very low	83 Å²	83	110.4 Å²	110.4	86%	0.856	78%	0.777	S	S	*	*			trans	153.2	95.9	170.1	0	0	0	0	0	114.9	L679	L679-G681 PolarHBondContact O-N 3.04Å
682	G	33.9	Very low	41.1	Very low	69 Å²	69	113.2 Å²	113.2	71%	0.711	78%	0.781	S	S	*	*			trans	-178.2	114.8	174.4	0	0	0	0	0	111.3
683	P	38.5	Very low	41.3	Very low	128 Å²	128	113.9 Å²	113.9	83%	0.831	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-70	138.8	-176.5	-19.8	32.8	0	0	0	113	I685	P683-I685 PolarHBondContact O-N 2.64Å
684	G	33.3	Very low	40.9	Very low	76 Å²	76	116.9 Å²	116.9	78%	0.784	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-65.8	125.3	169.5	0	0	0	0	0	111.3
685	I	38.8	Very low	40.4	Very low	159 Å²	159	116.6 Å²	116.6	82%	0.815	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-68.7	130.3	-178.9	-58	172.1	0	0	0	109.6	P683	P683-I685 PolarHBondContact O-N 2.64Å
686	P	41.4	Very low	40.4	Very low	98 Å²	98	116.6 Å²	116.6	64%	0.636	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-74.1	148.7	175.9	30.8	-34.8	0	0	0	111.8
687	P	40	Very low	40.9	Very low	112 Å²	112	116.6 Å²	116.6	73%	0.727	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-69.6	147.5	177.8	29	-35.2	0	0	0	112.3
688	P	39.7	Very low	40.7	Very low	120 Å²	120	116.8 Å²	116.8	78%	0.779	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-75.4	158.7	-177.1	31.2	-36.1	0	0	0	113.6
689	P	41.3	Very low	41.1	Very low	119 Å²	119	117 Å²	117	77%	0.773	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-81.1	160	-177.4	33.5	-36.5	0	0	0	113.9
690	P	38.6	Very low	41.1	Very low	133 Å²	133	113 Å²	113	86%	0.864	79%	0.793	S	S	*	*	P	Polyproline II helix	trans	-74.8	139.2	175.4	31.4	-34.9	0	0	0	112.4
691	G	40.7	Very low	41.4	Very low	68 Å²	68	113.5 Å²	113.5	70%	0.701	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-87.3	163.1	179.7	0	0	0	0	0	114.9
692	P	50.6	Low	41.6	Very low	137 Å²	137	120.6 Å²	120.6	89%	0.89	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-73.3	160.1	176.3	-13.7	30.3	0	0	0	113.4
693	G	42.6	Very low	42.3	Very low	81 Å²	81	120.6 Å²	120.6	84%	0.835	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-78.4	165.5	-179	0	0	0	0	0	115.6
694	M	36.1	Very low	42.7	Very low	186 Å²	186	120.5 Å²	120.5	92%	0.916	79%	0.789	S	S	*	*			trans	-122.4	158.4	177.1	-93.8	176.9	56.2	0	0	112.4
695	P	39.6	Very low	43.6	Very low	114 Å²	114	122.8 Å²	122.8	74%	0.74	79%	0.79	S	S	*	*			trans	-84.4	167	-176.5	34.5	-36.5	0	0	0	114.9
696	P	47.2	Very low	44.4	Very low	119 Å²	119	119.5 Å²	119.5	77%	0.773	79%	0.787	S	S	*	*			trans	-99.8	-170.7	-178.5	43	-38.7	0	0	0	112.6
697	P	56.8	Low	45.3	Very low	114 Å²	114	120.2 Å²	120.2	74%	0.74	79%	0.791	S	S	*	*			cis	-118	-167.3	-14.8	45.6	-31.4	0	0	0	111
698	P	42.1	Very low	46.4	Very low	119 Å²	119	120.2 Å²	120.2	77%	0.773	79%	0.791	S	S	*	*				-140.8	175.6	68	28.9	-5.1	0	0	0	114.4
699	P	48.8	Very low	47.7	Very low	134 Å²	134	120.6 Å²	120.6	87%	0.87	79%	0.794	S	S	*	*			trans	-88.8	138.1	-170.8	33.7	-34.8	0	0	0	115.3
700	G	37	Very low	49.5	Very low	80 Å²	80	118.2 Å²	118.2	83%	0.825	77%	0.774	S	S	*	*			trans	-156	129.6	171.2	0	0	0	0	0	111.2
701	N	43.8	Very low	51.3	Low	134 Å²	134	114.1 Å²	114.1	72%	0.717	75%	0.748	S	S	*	*			trans	-82	174.1	-168.8	-167.4	68.6	0	0	0	113.7
702	W	43.5	Very low	53.3	Low	233 Å²	233	115.6 Å²	115.6	88%	0.883	74%	0.735	S	S	*	*			trans	94	80.4	163.9	-54.3	96.5	0	0	0	119.9
703	G	48	Very low	54.4	Low	69 Å²	69	111.9 Å²	111.9	71%	0.711	72%	0.721	S	S	*	*			trans	86.5	139.4	136.3	0	0	0	0	0	119
704	P	47.6	Very low	56.2	Low	125 Å²	125	109.5 Å²	109.5	81%	0.812	69%	0.689	S	S	*	*	P	Polyproline II helix	trans	-74.5	144	166.2	32.3	-33.2	0	0	0	110.8
705	P	51.6	Low	58.3	Low	124 Å²	124	107.6 Å²	107.6	81%	0.805	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-69.1	152.4	175	29.9	-35	0	0	0	111.6
706	A	56.2	Low	60.2	Low	91 Å²	91	106.7 Å²	106.7	75%	0.752	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-63.8	145.9	171.9	0	0	0	0	0	111
707	P	59.1	Low	62	Low	112 Å²	112	106.6 Å²	106.6	73%	0.727	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-63	148.3	176.2	27.5	-34.8	0	0	0	111.1
708	P	63.6	Low	63.4	Low	112 Å²	112	104.4 Å²	104.4	73%	0.727	64%	0.644	S	S	*	*	P	Polyproline II helix	trans	-63.9	146.5	179.2	27.3	-34.7	0	0	0	111.3	L710	P708-L710 PolarHBondContact O-N 3.27Å
709	P	66.9	Low	65.3	Low	129 Å²	129	105.5 Å²	105.5	84%	0.838	64%	0.639	S	S	*	*	P	Polyproline II helix	trans	-65.2	135.3	177.3	27.9	-34.4	0	0	0	110.8
710	L	78.8	Confident	67	Low	69 Å²	69	103.7 Å²	103.7	36%	0.361	62%	0.616	S	S	.	*	P	Polyproline II helix	trans	-75.4	150.1	175.7	-64.5	171.6	0	0	0	110.7	P708 L714 P716 A736	P708-L710 PolarHBondContact O-N 3.27Å; L710-L714 HydrophobicContact CB-CB 4.04Å; L710-L714 WeakPolarHBondContact CB-O 3.48Å; L710-L714 HydrophobicContact CD1-CB 4.47Å; L710-P716 HydrophobicContact CD1-CG 4.26Å; L710-A736 HydrophobicContact CD2-CB 4.08Å
711	P	77.1	Confident	69.2	Low	47 Å²	47	107.1 Å²	107.1	31%	0.305	61%	0.608	S	S	.	*	G	3₁₀ helix	trans	-66.7	158	-178.7	28.6	-35.5	0	0	0	112.4	G713 L714 A736	P711-G713 PolarHBondContact O-N 2.85Å; P711-G713 VanDerWaalsContact O-N 3.07Å; P711-L714 WeakPolarHBondContact O-CB 3.22Å; P711-L714 WeakPolarHBondContact O-CG 3.31Å; P711-L714 PolarHBondContact O-N 3.12Å; P711-A736 HydrophobicContact CG-CB 4.35Å; P711-A736 VanDerWaalsContact CG-O 3.23Å; P711-A736 WeakPolarHBondContact CG-O 3.08Å
712	F	81.8	Confident	70.8	Confident	98 Å²	98	104.5 Å²	104.5	43%	0.43	60%	0.598	S	S	.	*	G	3₁₀ helix	trans	56.1	21.5	177.6	-39.6	-67	0	0	0	115.6	L714 L739 E741 T746	F712-L714 VanDerWaalsContact C-N 3.28Å; F712-L714 PolarHBondContact O-N 3.06Å; F712-L739 HydrophobicContact CD2-CB 4.38Å; F712-L739 HydrophobicContact CE2-CB 4.06Å; F712-L739 WeakPolarHBondContact CE2-O 3.48Å; F712-L739 WeakPolarHBondContact CZ-O 3.4Å; F712-E741 HydrophobicContact CD1-CB 3.6Å; F712-E741 HydrophobicContact CD1-CG 3.92Å; F712-E741 HydrophobicContact CE1-CB 3.71Å; F712-E741 HydrophobicContact CE1-CG 4.45Å; F712-E741 HydrophobicContact CG-CB 4.41Å; F712-T746 HydrophobicContact CB-CG2 4.16Å; F712-T746 HydrophobicContact CD2-CG2 4.07Å; F712-T746 HydrophobicContact CG-CG2 4.28Å
713	G	75.5	Confident	72.4	Confident	59 Å²	59	102.9 Å²	102.9	61%	0.608	60%	0.601	S	S	*	*	G	3₁₀ helix	trans	77.2	9.2	179.2	0	0	0	0	0	114.9	P711 Q715	P711-G713 PolarHBondContact O-N 2.85Å; P711-G713 VanDerWaalsContact O-N 3.07Å; G713-Q715 PolarHBondContact O-NE2 3.27Å; G713-Q715 VanDerWaalsContact O-NE2 3.14Å
714	L	79.9	Confident	73.9	Confident	31 Å²	31	101.3 Å²	101.3	16%	0.162	58%	0.577	C	S	.	*	P	Polyproline II helix	trans	-54.8	137.1	177.4	-75.1	169.4	0	0	0	111.6	L710 P711 F712 L739	L710-L714 HydrophobicContact CB-CB 4.04Å; L710-L714 WeakPolarHBondContact CB-O 3.48Å; L710-L714 HydrophobicContact CD1-CB 4.47Å; P711-L714 WeakPolarHBondContact O-CB 3.22Å; P711-L714 WeakPolarHBondContact O-CG 3.31Å; P711-L714 PolarHBondContact O-N 3.12Å; F712-L714 VanDerWaalsContact C-N 3.28Å; F712-L714 PolarHBondContact O-N 3.06Å; L714-L739 HydrophobicContact CD1-CD1 3.64Å
715	Q	79.4	Confident	75.3	Confident	146 Å²	146	102.1 Å²	102.1	68%	0.682	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-87	151.9	170.1	-60.6	-53.5	-63.6	0	0	110.5	G713 K717	G713-Q715 PolarHBondContact O-NE2 3.27Å; G713-Q715 VanDerWaalsContact O-NE2 3.14Å; Q715-K717 PolarHBondContact O-N 3.17Å
716	P	80.6	Confident	76.8	Confident	96 Å²	96	97.7 Å²	97.7	62%	0.623	54%	0.54	S	S	*	.	P	Polyproline II helix	trans	-55.8	128	169.6	-23.9	34.6	0	0	0	110.8	L710	L710-P716 HydrophobicContact CD1-CG 4.26Å
717	K	83.7	Confident	77.9	Confident	117 Å²	117	100.7 Å²	100.7	51%	0.509	54%	0.536	S	S	.	.	P	Polyproline II helix	trans	-65.8	136.5	-179.8	-66.8	-76.2	171	-172.8	0	110.8	Q715 E719 A748 E750	Q715-K717 PolarHBondContact O-N 3.17Å; K717-E719 PolarHBondContact O-N 3.44Å; K717-A748 PolarHBondContact NZ-O 3.02Å; K717-E750 WeakPolarHBondContact CD-OE1 3.21Å; K717-E750 WeakPolarHBondContact CE-OE1 3.35Å; K717-E750 IonicContact NZ-OE1 2.84Å; K717-E750 PolarHBondContact NZ-OE1 3.38Å; K717-E750 IonicContact NZ-OE2 2.61Å; K717-E750 PolarHBondContact NZ-OE2 3.1Å
718	T	85.8	Confident	78.9	Confident	67 Å²	67	105 Å²	105	41%	0.411	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-56.8	129	-179.3	-77	0	0	0	0	112.3	Y720 E751	T718-Y720 HydrophobicContact CG2-CD1 4.22Å; T718-Y720 HydrophobicContact CG2-CE1 3.72Å; T718-Y720 HydrophobicContact CG2-CE2 4.23Å; T718-Y720 WeakPolarHBondContact O-CD2 3.43Å; T718-Y720 PolarHBondContact O-N 2.71Å; T718-E751 VanDerWaalsContact CB-OE1 3.27Å; T718-E751 WeakPolarHBondContact CB-OE1 3.46Å; T718-E751 PolarHBondContact OG1-OE1 3.04Å
719	E	82.6	Confident	79.5	Confident	143 Å²	143	102.9 Å²	102.9	67%	0.668	53%	0.529	S	S	*	.			trans	-87.6	96.4	-177.5	-167.4	-163.5	-179.9	0	0	111.7	K717 K721	K717-E719 PolarHBondContact O-N 3.44Å; E719-K721 WeakPolarHBondContact OE1-CE 3.22Å; E719-K721 IonicContact OE1-NZ 3.28Å; E719-K721 PolarHBondContact OE1-NZ 2.93Å; E719-K721 WeakPolarHBondContact OE2-CE 3.26Å; E719-K721 IonicContact OE2-NZ 2.62Å; E719-K721 PolarHBondContact OE2-NZ 3.28Å
720	Y	85.4	Confident	80.1	Confident	95 Å²	95	104.4 Å²	104.4	37%	0.373	53%	0.53	S	S	.	.			trans	-74.3	133.3	175.9	-58.1	-72.6	0	0	0	112.7	T718 Q754 F759	T718-Y720 HydrophobicContact CG2-CD1 4.22Å; T718-Y720 HydrophobicContact CG2-CE1 3.72Å; T718-Y720 HydrophobicContact CG2-CE2 4.23Å; T718-Y720 WeakPolarHBondContact O-CD2 3.43Å; T718-Y720 PolarHBondContact O-N 2.71Å; Y720-Q754 VanDerWaalsContact CE1-OE1 3.24Å; Y720-Q754 PolarHBondContact OH-OE1 3.39Å; Y720-F759 AromaticContact CD1-CE2 3.89Å; Y720-F759 HydrophobicContact CD1-CE2 3.89Å; Y720-F759 AromaticContact CD1-CZ 3.95Å; Y720-F759 HydrophobicContact CD1-CZ 3.95Å; Y720-F759 AromaticContact CE1-CE2 3.74Å; Y720-F759 HydrophobicContact CE1-CE2 3.74Å; Y720-F759 AromaticContact CE1-CZ 3.67Å; Y720-F759 HydrophobicContact CE1-CZ 3.67Å
721	K	81.9	Confident	80	Confident	153 Å²	153	111.2 Å²	111.2	67%	0.665	55%	0.551	S	S	*	*			trans	-123.2	83.9	177	-73.7	168.3	178.3	143.6	0	110.7	E719	E719-K721 WeakPolarHBondContact OE1-CE 3.22Å; E719-K721 IonicContact OE1-NZ 3.28Å; E719-K721 PolarHBondContact OE1-NZ 2.93Å; E719-K721 WeakPolarHBondContact OE2-CE 3.26Å; E719-K721 IonicContact OE2-NZ 2.62Å; E719-K721 PolarHBondContact OE2-NZ 3.28Å
722	P	78.5	Confident	80.5	Confident	79 Å²	79	114.6 Å²	114.6	51%	0.513	58%	0.576	S	S	.	*			trans	-63.5	136.8	177.4	-20.8	33.2	0	0	0	111.9	V724	P722-V724 PolarHBondContact O-N 3.22Å
723	E	76.7	Confident	80.7	Confident	199 Å²	199	118.3 Å²	118.3	93%	0.93	59%	0.592	S	S	*	*	S	Bend	trans	-65.2	-25.1	179.5	-59.8	-177	158	0	0	113.3
724	V	79.1	Confident	81.3	Confident	36 Å²	36	119.7 Å²	119.7	22%	0.218	59%	0.585	C	S	.	*	S	Bend	trans	-121.7	132.9	-179.9	-177	0	0	0	0	109.5	P722 L726 T763 Q769	P722-V724 PolarHBondContact O-N 3.22Å; V724-L726 VanDerWaalsContact O-CD2 3.28Å; V724-L726 WeakPolarHBondContact O-CD2 3.43Å; V724-L726 PolarHBondContact O-N 3.01Å; V724-T763 HydrophobicContact CB-CG2 4.02Å; V724-T763 HydrophobicContact CG2-CG2 4.28Å; V724-Q769 HydrophobicContact CG1-CG 4.21Å
725	Q	77.4	Confident	81.5	Confident	141 Å²	141	119.3 Å²	119.3	66%	0.659	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-67.8	119	179	-171.2	166.8	1.9	0	0	111.2	S768	Q725-S768 VanDerWaalsContact O-CB 3.28Å; Q725-S768 WeakPolarHBondContact O-CB 3.48Å; Q725-S768 PolarHBondContact O-N 2.74Å
726	L	83.7	Confident	81.6	Confident	32 Å²	32	113.7 Å²	113.7	17%	0.168	56%	0.564	C	S	.	*	B	Isolated β-bridge	trans	-94.9	159.4	-179.3	-47.4	-171.7	0	0	0	111.9	V724 R728 L762 T763 F766	V724-L726 VanDerWaalsContact O-CD2 3.28Å; V724-L726 WeakPolarHBondContact O-CD2 3.43Å; V724-L726 PolarHBondContact O-N 3.01Å; L726-R728 PolarHBondContact O-N 3.13Å; L726-L762 HydrophobicContact CD1-CD2 4.07Å; L726-L762 HydrophobicContact CD1-CG 4.36Å; L726-T763 HydrophobicContact CD2-CG2 4.09Å; L726-F766 WeakPolarHBondContact CA-O 3.32Å
727	K	77.8	Confident	81.7	Confident	154 Å²	154	116.7 Å²	116.7	67%	0.67	57%	0.57	S	S	*	*	P	Polyproline II helix	trans	-62.1	129.8	163.6	-66	-178.6	-179.6	179.5	0	108.9	F766	K727-F766 PolarHBondContact N-O 3.08Å
728	R	81.8	Confident	81.7	Confident	202 Å²	202	116.3 Å²	116.3	76%	0.762	57%	0.573	S	S	*	*	P	Polyproline II helix	trans	-88	146.5	-175	-64.3	-179.7	177.6	175.5	-1.8	111.4	L726	L726-R728 PolarHBondContact O-N 3.13Å
729	A	75.5	Confident	81.6	Confident	67 Å²	67	114.6 Å²	114.6	55%	0.554	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-78.8	124.9	164.7	0	0	0	0	0	109.3	W731	A729-W731 VanDerWaalsContact C-N 3.33Å; A729-W731 HydrophobicContact CB-CD2 4.3Å; A729-W731 HydrophobicContact CB-CE3 4.04Å; A729-W731 HydrophobicContact CB-CZ3 4.28Å; A729-W731 PolarHBondContact O-N 2.79Å
730	N	79.6	Confident	81.7	Confident	161 Å²	161	111.1 Å²	111.1	86%	0.861	55%	0.553	S	S	*	*			trans	-92.8	59.4	-176	-64.9	-24	0	0	0	111.1
731	W	76.9	Confident	81.6	Confident	213 Å²	213	113.1 Å²	113.1	81%	0.807	57%	0.566	S	S	*	*	P	Polyproline II helix	trans	-84.8	156.7	176.3	52.8	42.8	0	0	0	112.7	A729 K733	A729-W731 VanDerWaalsContact C-N 3.33Å; A729-W731 HydrophobicContact CB-CD2 4.3Å; A729-W731 HydrophobicContact CB-CE3 4.04Å; A729-W731 HydrophobicContact CB-CZ3 4.28Å; A729-W731 PolarHBondContact O-N 2.79Å; W731-K733 PolarHBondContact O-N 2.87Å
732	S	86.4	Confident	81.6	Confident	118 Å²	118	112.4 Å²	112.4	83%	0.825	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-76.7	116.9	164.9	-60	0	0	0	0	109.2
733	K	87.1	Confident	82	Confident	176 Å²	176	109.8 Å²	109.8	77%	0.765	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-74.4	129.9	176.7	177.6	-173.9	173.7	-165.2	0	110.1	W731	W731-K733 PolarHBondContact O-N 2.87Å
734	I	87.6	Confident	82.6	Confident	88 Å²	88	107.2 Å²	107.2	45%	0.451	54%	0.539	S	S	.	.	P	Polyproline II helix	trans	-80.6	129	163.3	-56.4	175	0	0	0	107.8	D738 L739	I734-D738 HydrophobicContact CG2-CB 3.69Å; I734-L739 HydrophobicContact CG2-CD2 3.87Å; I734-L739 HydrophobicContact CG2-CG 4.35Å
735	A	84.9	Confident	83.1	Confident	22 Å²	22	112.2 Å²	112.2	18%	0.182	55%	0.554	C	S	.	*	P	Polyproline II helix	trans	-80	167.4	175.6	0	0	0	0	0	111.5	E737 D738	A735-E737 VanDerWaalsContact C-N 3.28Å; A735-E737 HydrophobicContact CB-CG 4.02Å; A735-E737 WeakPolarHBondContact CB-OE2 3.4Å; A735-E737 PolarHBondContact O-N 2.77Å; A735-D738 WeakPolarHBondContact CA-OD2 3.19Å; A735-D738 VanDerWaalsContact CB-OD2 3.24Å; A735-D738 WeakPolarHBondContact CB-OD2 3.4Å; A735-D738 PolarHBondContact N-OD2 3.38Å; A735-D738 PolarHBondContact O-N 2.99Å
736	A	81.1	Confident	83.5	Confident	28 Å²	28	107 Å²	107	23%	0.231	53%	0.532	C	S	.	.	S	Bend	trans	-69.9	-31.2	179.5	0	0	0	0	0	111.3	L710 P711 D738	L710-A736 HydrophobicContact CD2-CB 4.08Å; P711-A736 HydrophobicContact CG-CB 4.35Å; P711-A736 VanDerWaalsContact CG-O 3.23Å; P711-A736 WeakPolarHBondContact CG-O 3.08Å; A736-D738 VanDerWaalsContact C-N 3.32Å
737	E	82.4	Confident	83.6	Confident	159 Å²	159	113.1 Å²	113.1	74%	0.743	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-21.8	172.9	60.7	-104.3	-127.8	0	0	114.8	A735 L739	A735-E737 VanDerWaalsContact C-N 3.28Å; A735-E737 HydrophobicContact CB-CG 4.02Å; A735-E737 WeakPolarHBondContact CB-OE2 3.4Å; A735-E737 PolarHBondContact O-N 2.77Å; E737-L739 VanDerWaalsContact C-N 3.27Å; E737-L739 PolarHBondContact O-N 3.12Å
738	D	82.9	Confident	84	Confident	109 Å²	109	107 Å²	107	58%	0.583	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.7	-6	179.6	-61.2	-40.8	0	0	0	113.1	I734 A735 A736	I734-D738 HydrophobicContact CG2-CB 3.69Å; A735-D738 WeakPolarHBondContact CA-OD2 3.19Å; A735-D738 VanDerWaalsContact CB-OD2 3.24Å; A735-D738 WeakPolarHBondContact CB-OD2 3.4Å; A735-D738 PolarHBondContact N-OD2 3.38Å; A735-D738 PolarHBondContact O-N 2.99Å; A736-D738 VanDerWaalsContact C-N 3.32Å
739	L	83.7	Confident	84.2	Confident	32 Å²	32	101.2 Å²	101.2	17%	0.168	52%	0.519	C	S	.	.			trans	-83.9	149.6	-175.6	-67	175.8	0	0	0	112.1	F712 L714 I734 E737 W745	F712-L739 HydrophobicContact CD2-CB 4.38Å; F712-L739 HydrophobicContact CE2-CB 4.06Å; F712-L739 WeakPolarHBondContact CE2-O 3.48Å; F712-L739 WeakPolarHBondContact CZ-O 3.4Å; L714-L739 HydrophobicContact CD1-CD1 3.64Å; I734-L739 HydrophobicContact CG2-CD2 3.87Å; I734-L739 HydrophobicContact CG2-CG 4.35Å; E737-L739 VanDerWaalsContact C-N 3.27Å; E737-L739 PolarHBondContact O-N 3.12Å; L739-W745 HydrophobicContact CD2-CB 3.82Å; L739-W745 HydrophobicContact CD2-CG 4.29Å
740	S	85.8	Confident	84.7	Confident	69 Å²	69	101.5 Å²	101.5	48%	0.483	51%	0.509	S	S	.	.			trans	-107.2	153.5	165.7	64.5	0	0	0	0	110.4	N742 S743 T746	S740-N742 PolarHBondContact O-N 2.93Å; S740-S743 WeakPolarHBondContact O-CB 3.27Å; S740-S743 PolarHBondContact O-N 3.19Å; S740-T746 WeakPolarHBondContact O-CG2 3.46Å
741	E	82.4	Confident	84.9	Confident	137 Å²	137	97.9 Å²	97.9	64%	0.64	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.4	-40.9	-178.2	-170.6	175.1	-170.8	0	0	113	F712 S743 T746	F712-E741 HydrophobicContact CD1-CB 3.6Å; F712-E741 HydrophobicContact CD1-CG 3.92Å; F712-E741 HydrophobicContact CE1-CB 3.71Å; F712-E741 HydrophobicContact CE1-CG 4.45Å; F712-E741 HydrophobicContact CG-CB 4.41Å; E741-S743 VanDerWaalsContact C-N 3.33Å; E741-S743 PolarHBondContact O-N 3.5Å; E741-T746 PolarHBondContact O-OG1 3.33Å
742	N	82.1	Confident	85.5	Confident	138 Å²	138	93.9 Å²	93.9	74%	0.738	48%	0.477	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	0.2	178.6	-74.5	-48.3	0	0	0	114.6	S740	S740-N742 PolarHBondContact O-N 2.93Å
743	S	86.6	Confident	85.5	Confident	24 Å²	24	95.2 Å²	95.2	17%	0.168	47%	0.468	C	S	.	.	S	Bend	trans	-60.4	140.2	177.3	-176.7	0	0	0	0	111.2	S740 E741 W745 T746	S740-S743 WeakPolarHBondContact O-CB 3.27Å; S740-S743 PolarHBondContact O-N 3.19Å; E741-S743 VanDerWaalsContact C-N 3.33Å; E741-S743 PolarHBondContact O-N 3.5Å; S743-W745 PolarHBondContact O-N 3.31Å; S743-W745 VanDerWaalsContact O-N 3.1Å; S743-W745 PolarHBondContact OG-N 3.02Å; S743-T746 PolarHBondContact O-N 2.96Å; S743-T746 VanDerWaalsContact O-N 3.08Å; S743-T746 PolarHBondContact O-OG1 2.75Å
744	F	89.4	Confident	85.5	Confident	146 Å²	146	90.9 Å²	90.9	64%	0.64	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-50.8	-36.8	173.5	171.1	-99.1	0	0	0	112.2	T746 K747 A748	F744-T746 VanDerWaalsContact C-N 3.28Å; F744-T746 PolarHBondContact O-N 3.37Å; F744-K747 PolarHBondContact O-N 3.26Å; F744-K747 VanDerWaalsContact O-N 3.09Å; F744-A748 HydrophobicContact CE1-CB 4.24Å; F744-A748 PolarHBondContact O-N 3.36Å
745	W	89.7	Confident	85.5	Confident	140 Å²	140	88.9 Å²	88.9	53%	0.53	45%	0.445	S	S	.	.	G	3₁₀ helix	trans	-68.1	-17.5	-177.3	-54.3	115.9	0	0	0	114.7	L739 S743 K747 A748	L739-W745 HydrophobicContact CD2-CB 3.82Å; L739-W745 HydrophobicContact CD2-CG 4.29Å; S743-W745 PolarHBondContact O-N 3.31Å; S743-W745 VanDerWaalsContact O-N 3.1Å; S743-W745 PolarHBondContact OG-N 3.02Å; W745-K747 VanDerWaalsContact C-N 3.25Å; W745-K747 PolarHBondContact O-N 3.42Å; W745-A748 HydrophobicContact CE3-CB 4.09Å
746	T	87.3	Confident	85.5	Confident	33 Å²	33	94 Å²	94	20%	0.202	47%	0.47	C	S	.	.	G	3₁₀ helix	trans	-73.8	-19.4	172.5	63	0	0	0	0	112.6	F712 S740 E741 S743 F744	F712-T746 HydrophobicContact CB-CG2 4.16Å; F712-T746 HydrophobicContact CD2-CG2 4.07Å; F712-T746 HydrophobicContact CG-CG2 4.28Å; S740-T746 WeakPolarHBondContact O-CG2 3.46Å; E741-T746 PolarHBondContact O-OG1 3.33Å; S743-T746 PolarHBondContact O-N 2.96Å; S743-T746 VanDerWaalsContact O-N 3.08Å; S743-T746 PolarHBondContact O-OG1 2.75Å; F744-T746 VanDerWaalsContact C-N 3.28Å; F744-T746 PolarHBondContact O-N 3.37Å
747	K	84.8	Confident	85.8	Confident	159 Å²	159	100.3 Å²	100.3	69%	0.691	49%	0.494	S	S	*	.	S	Bend	trans	-108	-2.4	-179.7	-61.3	170	-171.9	169.7	0	112.7	F744 W745 N749	F744-K747 PolarHBondContact O-N 3.26Å; F744-K747 VanDerWaalsContact O-N 3.09Å; W745-K747 VanDerWaalsContact C-N 3.25Å; W745-K747 PolarHBondContact O-N 3.42Å; K747-N749 PolarHBondContact O-N 3.05Å
748	A	85.6	Confident	86.1	Confident	25 Å²	25	97 Å²	97	21%	0.207	48%	0.481	C	S	.	.			trans	-78.1	111.5	-178.8	0	0	0	0	0	111.3	K717 F744 W745	K717-A748 PolarHBondContact NZ-O 3.02Å; F744-A748 HydrophobicContact CE1-CB 4.24Å; F744-A748 PolarHBondContact O-N 3.36Å; W745-A748 HydrophobicContact CE3-CB 4.09Å
749	N	85.8	Confident	86.4	Confident	82 Å²	82	95 Å²	95	44%	0.439	47%	0.467	S	S	.	.			trans	-105.5	104.3	168.3	179.2	-1.5	0	0	0	109.2	K747 E751 Q752	K747-N749 PolarHBondContact O-N 3.05Å; N749-E751 WeakPolarHBondContact OD1-CB 3.36Å; N749-E751 PolarHBondContact OD1-N 2.95Å; N749-Q752 WeakPolarHBondContact O-CG 3.28Å; N749-Q752 PolarHBondContact O-NE2 2.87Å; N749-Q752 PolarHBondContact OD1-N 3.31Å
750	E	85.9	Confident	86.5	Confident	72 Å²	72	96.4 Å²	96.4	34%	0.336	48%	0.483	S	S	.	.			trans	-80.3	-22.6	173.7	63.3	-73.1	162.1	0	0	114.2	K717 Q752 F753	K717-E750 WeakPolarHBondContact CD-OE1 3.21Å; K717-E750 WeakPolarHBondContact CE-OE1 3.35Å; K717-E750 IonicContact NZ-OE1 2.84Å; K717-E750 PolarHBondContact NZ-OE1 3.38Å; K717-E750 IonicContact NZ-OE2 2.61Å; K717-E750 PolarHBondContact NZ-OE2 3.1Å; E750-Q752 PolarHBondContact O-N 3.11Å; E750-F753 PolarHBondContact O-N 3.2Å
751	E	85.6	Confident	86.6	Confident	85 Å²	85	100.2 Å²	100.2	40%	0.397	49%	0.491	S	S	.	.	G	3₁₀ helix	trans	-66.3	-27.1	-173.9	-56.8	-172.5	158.2	0	0	111.9	T718 N749 F753 Q754	T718-E751 VanDerWaalsContact CB-OE1 3.27Å; T718-E751 WeakPolarHBondContact CB-OE1 3.46Å; T718-E751 PolarHBondContact OG1-OE1 3.04Å; N749-E751 WeakPolarHBondContact OD1-CB 3.36Å; N749-E751 PolarHBondContact OD1-N 2.95Å; E751-F753 PolarHBondContact O-N 3.21Å; E751-F753 VanDerWaalsContact O-N 3.17Å; E751-Q754 WeakPolarHBondContact O-CB 3.45Å; E751-Q754 PolarHBondContact O-N 2.98Å; E751-Q754 VanDerWaalsContact O-N 3.07Å
752	Q	88.8	Confident	86.6	Confident	130 Å²	130	97.5 Å²	97.5	61%	0.607	48%	0.48	S	S	*	.	G	3₁₀ helix	trans	-62.5	-18.1	172.5	76.8	-171.2	-48	0	0	114	N749 E750	N749-Q752 WeakPolarHBondContact O-CG 3.28Å; N749-Q752 PolarHBondContact O-NE2 2.87Å; N749-Q752 PolarHBondContact OD1-N 3.31Å; E750-Q752 PolarHBondContact O-N 3.11Å
753	F	85.4	Confident	86.8	Confident	145 Å²	145	92.7 Å²	92.7	64%	0.636	46%	0.456	S	S	*	.	G	3₁₀ helix	trans	-101.3	4.3	177.4	-54.9	-67.2	0	0	0	112.8	E750 E751 S755	E750-F753 PolarHBondContact O-N 3.2Å; E751-F753 PolarHBondContact O-N 3.21Å; E751-F753 VanDerWaalsContact O-N 3.17Å; F753-S755 PolarHBondContact O-N 3.41Å
754	Q	87.3	Confident	86.5	Confident	85 Å²	85	98.5 Å²	98.5	40%	0.397	49%	0.485	S	S	.	.			trans	-71	126	-179.7	-179.5	169.4	-32.5	0	0	111.5	Y720 E751 F759	Y720-Q754 VanDerWaalsContact CE1-OE1 3.24Å; Y720-Q754 PolarHBondContact OH-OE1 3.39Å; E751-Q754 WeakPolarHBondContact O-CB 3.45Å; E751-Q754 PolarHBondContact O-N 2.98Å; E751-Q754 VanDerWaalsContact O-N 3.07Å; Q754-F759 HydrophobicContact CG-CE2 3.61Å; Q754-F759 HydrophobicContact CG-CZ 3.83Å
755	S	88.5	Confident	86.2	Confident	47 Å²	47	95.8 Å²	95.8	33%	0.329	48%	0.48	S	S	.	.			trans	-140.2	138	172.2	167.6	0	0	0	0	110.9	F753 E757 L758 F759	F753-S755 PolarHBondContact O-N 3.41Å; S755-E757 VanDerWaalsContact C-N 3.25Å; S755-E757 PolarHBondContact O-N 2.99Å; S755-E757 PolarHBondContact OG-N 3.36Å; S755-L758 WeakPolarHBondContact O-CB 3.37Å; S755-L758 PolarHBondContact O-N 3.34Å; S755-F759 PolarHBondContact O-N 3.45Å
756	N	85.1	Confident	85.8	Confident	130 Å²	130	94 Å²	94	70%	0.695	48%	0.476	S	S	*	.	H	α-helix	trans	-64.3	-32.3	175.2	-67.9	-14.7	0	0	0	111.6	A760	N756-A760 VanDerWaalsContact O-CB 3.26Å; N756-A760 WeakPolarHBondContact O-CB 3.4Å; N756-A760 PolarHBondContact O-N 2.71Å
757	E	87.8	Confident	85.6	Confident	159 Å²	159	94.1 Å²	94.1	74%	0.743	48%	0.479	S	S	*	.	H	α-helix	trans	-68.1	-39.8	173.7	-61.8	-170.3	139.1	0	0	111.6	S755 A760 K761	S755-E757 VanDerWaalsContact C-N 3.25Å; S755-E757 PolarHBondContact O-N 2.99Å; S755-E757 PolarHBondContact OG-N 3.36Å; E757-A760 PolarHBondContact O-N 3.23Å; E757-K761 VanDerWaalsContact O-CB 3.23Å; E757-K761 WeakPolarHBondContact O-CB 3.35Å; E757-K761 PolarHBondContact O-N 2.89Å
758	L	86.9	Confident	84.8	Confident	91 Å²	91	90 Å²	90	48%	0.476	47%	0.47	S	S	.	.	H	α-helix	trans	-61.4	-47.5	176	177.2	61.7	0	0	0	110.5	S755 K761 L762	S755-L758 WeakPolarHBondContact O-CB 3.37Å; S755-L758 PolarHBondContact O-N 3.34Å; L758-K761 PolarHBondContact O-N 2.81Å; L758-L762 VanDerWaalsContact O-CB 3.29Å; L758-L762 WeakPolarHBondContact O-CB 3.41Å; L758-L762 PolarHBondContact O-N 3.47Å
759	F	90.9	Very high	83.8	Confident	67 Å²	67	95.8 Å²	95.8	29%	0.294	49%	0.493	S	S	.	.	H	α-helix	trans	-67.6	-38.4	177.4	-66.5	-23.3	0	0	0	113.2	Y720 Q754 S755 L762 T763	Y720-F759 AromaticContact CD1-CE2 3.89Å; Y720-F759 HydrophobicContact CD1-CE2 3.89Å; Y720-F759 AromaticContact CD1-CZ 3.95Å; Y720-F759 HydrophobicContact CD1-CZ 3.95Å; Y720-F759 AromaticContact CE1-CE2 3.74Å; Y720-F759 HydrophobicContact CE1-CE2 3.74Å; Y720-F759 AromaticContact CE1-CZ 3.67Å; Y720-F759 HydrophobicContact CE1-CZ 3.67Å; Q754-F759 HydrophobicContact CG-CE2 3.61Å; Q754-F759 HydrophobicContact CG-CZ 3.83Å; S755-F759 PolarHBondContact O-N 3.45Å; F759-L762 PolarHBondContact O-N 3.19Å; F759-T763 VanDerWaalsContact O-CB 3.25Å; F759-T763 WeakPolarHBondContact O-CB 3.46Å; F759-T763 PolarHBondContact O-N 3.09Å; F759-T763 PolarHBondContact O-OG1 2.92Å
760	A	85.1	Confident	81.9	Confident	60 Å²	60	98 Å²	98	50%	0.496	51%	0.509	S	S	.	.	H	α-helix	trans	-63.3	-44.4	174.5	0	0	0	0	0	111.6	N756 E757 T763 L764	N756-A760 VanDerWaalsContact O-CB 3.26Å; N756-A760 WeakPolarHBondContact O-CB 3.4Å; N756-A760 PolarHBondContact O-N 2.71Å; E757-A760 PolarHBondContact O-N 3.23Å; A760-T763 PolarHBondContact O-N 3.12Å; A760-L764 WeakPolarHBondContact O-CB 3.3Å; A760-L764 PolarHBondContact O-N 3.43Å
761	K	87.1	Confident	79.8	Confident	150 Å²	150	104.1 Å²	104.1	65%	0.652	54%	0.535	S	S	*	.	H	α-helix	trans	-65.3	-44.6	176.7	-169.7	173.7	-176.8	177.2	0	111.8	E757 L758 T763 L764 T765	E757-K761 VanDerWaalsContact O-CB 3.23Å; E757-K761 WeakPolarHBondContact O-CB 3.35Å; E757-K761 PolarHBondContact O-N 2.89Å; L758-K761 PolarHBondContact O-N 2.81Å; K761-T763 VanDerWaalsContact C-N 3.3Å; K761-T763 PolarHBondContact O-N 2.91Å; K761-L764 PolarHBondContact O-N 3.29Å; K761-T765 WeakPolarHBondContact O-CB 3.4Å; K761-T765 PolarHBondContact O-N 2.96Å; K761-T765 PolarHBondContact O-OG1 2.94Å; K761-T765 VanDerWaalsContact O-OG1 3.11Å
762	L	83.4	Confident	77.6	Confident	79 Å²	79	108.2 Å²	108.2	41%	0.414	55%	0.554	S	S	.	*	H	α-helix	trans	-58.5	-43.5	174.4	-165	83	0	0	0	111.3	L726 L758 F759 T765 F766	L726-L762 HydrophobicContact CD1-CD2 4.07Å; L726-L762 HydrophobicContact CD1-CG 4.36Å; L758-L762 VanDerWaalsContact O-CB 3.29Å; L758-L762 WeakPolarHBondContact O-CB 3.41Å; L758-L762 PolarHBondContact O-N 3.47Å; F759-L762 PolarHBondContact O-N 3.19Å; L762-T765 PolarHBondContact O-N 3.34Å; L762-F766 HydrophobicContact CD1-CD2 3.79Å; L762-F766 HydrophobicContact CD1-CE2 4.04Å; L762-F766 HydrophobicContact CG-CD2 4.16Å; L762-F766 WeakPolarHBondContact O-CB 3.46Å; L762-F766 WeakPolarHBondContact O-CD2 3.47Å; L762-F766 PolarHBondContact O-N 3.01Å
763	T	85.8	Confident	74.9	Confident	38 Å²	38	109.3 Å²	109.3	23%	0.233	56%	0.564	C	S	.	*	H	α-helix	trans	-64	-45.5	178.6	-62.5	0	0	0	0	111.8	V724 L726 F759 A760 K761 S767	V724-T763 HydrophobicContact CB-CG2 4.02Å; V724-T763 HydrophobicContact CG2-CG2 4.28Å; L726-T763 HydrophobicContact CD2-CG2 4.09Å; F759-T763 VanDerWaalsContact O-CB 3.25Å; F759-T763 WeakPolarHBondContact O-CB 3.46Å; F759-T763 PolarHBondContact O-N 3.09Å; F759-T763 PolarHBondContact O-OG1 2.92Å; A760-T763 PolarHBondContact O-N 3.12Å; K761-T763 VanDerWaalsContact C-N 3.3Å; K761-T763 PolarHBondContact O-N 2.91Å; T763-S767 WeakPolarHBondContact O-CB 3.39Å; T763-S767 PolarHBondContact O-N 3.48Å; T763-S767 VanDerWaalsContact O-N 3.15Å; T763-S767 PolarHBondContact O-OG 3.33Å
764	L	81.2	Confident	72.4	Confident	145 Å²	145	111.6 Å²	111.6	76%	0.759	57%	0.573	S	S	*	*	H	α-helix	trans	-61.6	-43.7	176.7	-179.1	62.9	0	0	0	112.2	A760 K761	A760-L764 WeakPolarHBondContact O-CB 3.3Å; A760-L764 PolarHBondContact O-N 3.43Å; K761-L764 PolarHBondContact O-N 3.29Å
765	T	82.6	Confident	69.7	Low	89 Å²	89	117.2 Å²	117.2	55%	0.546	60%	0.597	S	S	.	*	H	α-helix	trans	-79.6	-34.9	-175	-57.1	0	0	0	0	113.7	K761 L762	K761-T765 WeakPolarHBondContact O-CB 3.4Å; K761-T765 PolarHBondContact O-N 2.96Å; K761-T765 PolarHBondContact O-OG1 2.94Å; K761-T765 VanDerWaalsContact O-OG1 3.11Å; L762-T765 PolarHBondContact O-N 3.34Å
766	F	80.8	Confident	67.2	Low	102 Å²	102	123.7 Å²	123.7	45%	0.447	62%	0.619	S	S	.	*	H	α-helix	trans	-118.5	11.7	-169.2	-59.4	-74.5	0	0	0	115.2	L726 K727 L762	L726-F766 WeakPolarHBondContact CA-O 3.32Å; K727-F766 PolarHBondContact N-O 3.08Å; L762-F766 HydrophobicContact CD1-CD2 3.79Å; L762-F766 HydrophobicContact CD1-CE2 4.04Å; L762-F766 HydrophobicContact CG-CD2 4.16Å; L762-F766 WeakPolarHBondContact O-CB 3.46Å; L762-F766 WeakPolarHBondContact O-CD2 3.47Å; L762-F766 PolarHBondContact O-N 3.01Å
767	S	83.4	Confident	64.6	Low	37 Å²	37	127.3 Å²	127.3	26%	0.259	63%	0.629	S	S	.	*	B	Isolated β-bridge	trans	-57.8	147	172.2	55.9	0	0	0	0	112.9	T763 Q769	T763-S767 WeakPolarHBondContact O-CB 3.39Å; T763-S767 PolarHBondContact O-N 3.48Å; T763-S767 VanDerWaalsContact O-N 3.15Å; T763-S767 PolarHBondContact O-OG 3.33Å; S767-Q769 VanDerWaalsContact C-N 3.29Å; S767-Q769 PolarHBondContact O-N 3.26Å
768	S	68.9	Low	61.9	Low	73 Å²	73	125.6 Å²	125.6	51%	0.51	63%	0.625	S	S	.	*			trans	-87	8.9	179.9	-166.1	0	0	0	0	113.6	Q725 T770	Q725-S768 VanDerWaalsContact O-CB 3.28Å; Q725-S768 WeakPolarHBondContact O-CB 3.48Å; Q725-S768 PolarHBondContact O-N 2.74Å; S768-T770 PolarHBondContact O-N 2.85Å
769	Q	62.6	Low	59.3	Low	145 Å²	145	130.4 Å²	130.4	68%	0.678	64%	0.644	S	S	*	*			trans	-84.7	108.8	-179	-66.4	-168.2	9.2	0	0	111.4	V724 S767 K771	V724-Q769 HydrophobicContact CG1-CG 4.21Å; S767-Q769 VanDerWaalsContact C-N 3.29Å; S767-Q769 PolarHBondContact O-N 3.26Å; Q769-K771 PolarHBondContact O-N 3.47Å
770	T	47.1	Very low	56.4	Low	129 Å²	129	135.5 Å²	135.5	79%	0.791	68%	0.675	S	S	*	*			trans	-70.1	120.5	168.4	45.7	0	0	0	0	110.5	S768 H772	S768-T770 PolarHBondContact O-N 2.85Å; T770-H772 PolarHBondContact O-N 2.95Å; T770-H772 VanDerWaalsContact O-N 3.16Å
771	K	41.1	Very low	53.8	Low	201 Å²	201	135.8 Å²	135.8	87%	0.874	68%	0.684	S	S	*	*			trans	-63.2	114.1	179.3	-68.9	-175.7	178.7	-179.7	0	111.5	Q769 N773	Q769-K771 PolarHBondContact O-N 3.47Å; K771-N773 PolarHBondContact O-N 3.29Å
772	H	39.4	Very low	51.2	Low	171 Å²	171	132.3 Å²	132.3	79%	0.792	69%	0.691	S	S	*	*			trans	-72.9	91.9	171.3	-98.1	-48.5	0	0	0	111.4	T770 K774	T770-H772 PolarHBondContact O-N 2.95Å; T770-H772 VanDerWaalsContact O-N 3.16Å; H772-K774 PolarHBondContact O-N 3.36Å
773	N	32.3	Very low	48.8	Very low	152 Å²	152	137.5 Å²	137.5	81%	0.813	71%	0.713	S	S	*	*			trans	-81.8	96.9	161.8	-91.7	3.9	0	0	0	109.9	K771 F775	K771-N773 PolarHBondContact O-N 3.29Å; N773-F775 PolarHBondContact O-N 3.03Å
774	K	32.6	Very low	46.4	Very low	193 Å²	193	144.7 Å²	144.7	84%	0.839	74%	0.744	S	S	*	*			trans	-83.9	98.8	164.9	-80.5	-173.7	176.1	179.1	0	109.9	H772	H772-K774 PolarHBondContact O-N 3.36Å
775	F	31.3	Very low	44.1	Very low	204 Å²	204	147.1 Å²	147.1	90%	0.895	75%	0.748	S	S	*	*			trans	-98.7	135.4	153	-105.6	-89.8	0	0	0	109.3	N773	N773-F775 PolarHBondContact O-N 3.03Å
776	K	35.8	Very low	41.7	Very low	183 Å²	183	151.3 Å²	151.3	80%	0.796	76%	0.762	S	S	*	*			trans	-72.1	142.2	174.9	-74.6	-173.7	171.8	-167.2	0	110.6
777	K	29.5	Very low	39.3	Very low	206 Å²	206	153.2 Å²	153.2	90%	0.896	78%	0.782	S	S	*	*				-149.1	141.5	125.5	-146.3	173.3	-176.2	-179.4	0	110.2
778	D	31.6	Very low	37	Very low	123 Å²	123	159.8 Å²	159.8	66%	0.658	81%	0.808	S	S	*	*			trans	-90	137.1	-171.7	-41.6	-97.5	0	0	0	111.1
779	Q	32.9	Very low	35.5	Very low	191 Å²	191	166 Å²	166	89%	0.893	83%	0.826	S	S	*	*			trans	-172.3	113.3	132.9	-106.3	170.7	23.5	0	0	112.7
780	D	29.3	Very low	34.3	Very low	174 Å²	174	167 Å²	167	93%	0.93	83%	0.829	S	S	*	*			trans	55.6	165.8	135.2	-150.7	13	0	0	0	122
781	G	30.6	Very low	34.2	Very low	67 Å²	67	170.2 Å²	170.2	69%	0.691	83%	0.831	S	S	*	*			trans	90.5	54	162.2	0	0	0	0	0	116.9
782	G	33	Very low	34.9	Very low	77 Å²	77	167.6 Å²	167.6	79%	0.794	83%	0.832	S	S	*	*			trans	-77	139.4	171.4	0	0	0	0	0	113.7
783	Q	32.2	Very low	36.5	Very low	187 Å²	187	163.4 Å²	163.4	87%	0.874	81%	0.811	S	S	*	*			trans	-152.2	127.5	156.8	-124.6	176.4	47.4	0	0	111.7
784	E	36.9	Very low	38.6	Very low	190 Å²	190	164.1 Å²	164.1	89%	0.888	81%	0.81	S	S	*	*			trans	-74.8	142.6	176.1	-57.8	177.7	127	0	0	110.7
785	K	31.9	Very low	41	Very low	195 Å²	195	157.8 Å²	157.8	85%	0.848	79%	0.785	S	S	*	*			trans	-128.1	131.3	159.3	-83.8	-169.7	174.7	178.8	0	111.2
786	Q	31.8	Very low	43.5	Very low	178 Å²	178	152.3 Å²	152.3	83%	0.832	76%	0.761	S	S	*	*			trans	-70.1	128.6	-168.7	-62.6	164.6	-5.8	0	0	111.6	Q788	Q786-Q788 PolarHBondContact O-N 3.28Å; Q786-Q788 VanDerWaalsContact O-N 3.12Å
787	T	31.9	Very low	45.9	Very low	142 Å²	142	145.3 Å²	145.3	87%	0.871	73%	0.733	S	S	*	*			trans	-76.8	91.4	165.3	32.3	0	0	0	0	110.2	K789	T787-K789 PolarHBondContact O-N 3.49Å
788	Q	34.6	Very low	48.6	Very low	174 Å²	174	135.9 Å²	135.9	81%	0.813	69%	0.692	S	S	*	*			trans	-62.4	119.6	165.8	-70.4	-172.8	-3.5	0	0	109.7	Q786 K790	Q786-Q788 PolarHBondContact O-N 3.28Å; Q786-Q788 VanDerWaalsContact O-N 3.12Å; Q788-K790 PolarHBondContact O-N 3.25Å; Q788-K790 VanDerWaalsContact O-N 3.08Å
789	K	36.2	Very low	51.2	Low	205 Å²	205	133.6 Å²	133.6	89%	0.891	68%	0.68	S	S	*	*			trans	-72.3	97.3	166.6	-70.8	-178	177.2	179.9	0	108.7	T787 K791	T787-K789 PolarHBondContact O-N 3.49Å; K789-K791 PolarHBondContact O-N 3.46Å
790	K	37.8	Very low	53.6	Low	166 Å²	166	128.7 Å²	128.7	72%	0.722	67%	0.667	S	S	*	*	P	Polyproline II helix	trans	-50.5	128.5	160.1	-98.2	-173.5	171.3	-179.9	0	107.6	Q788 E865	Q788-K790 PolarHBondContact O-N 3.25Å; Q788-K790 VanDerWaalsContact O-N 3.08Å; K790-E865 IonicContact NZ-OE1 2.74Å; K790-E865 PolarHBondContact NZ-OE1 3.44Å
791	K	44.8	Very low	56.2	Low	196 Å²	196	126.6 Å²	126.6	85%	0.852	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-63.8	137.7	163.9	-70.4	-177.8	178.7	179.8	0	107.6	K789 K793	K789-K791 PolarHBondContact O-N 3.46Å; K791-K793 PolarHBondContact O-N 3.23Å
792	V	55.6	Low	58.7	Low	146 Å²	146	125.3 Å²	125.3	89%	0.885	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-69.8	124	167.9	-179.6	0	0	0	0	106.9
793	K	73.5	Confident	61.3	Low	82 Å²	82	122 Å²	122	36%	0.357	60%	0.595	S	S	.	*	P	Polyproline II helix	trans	-75.9	145.1	171.2	-61.8	-179.3	-177.8	-174	0	109	K791 D861 L863 A864	K791-K793 PolarHBondContact O-N 3.23Å; K793-D861 WeakPolarHBondContact CE-O 2.97Å; K793-D861 PolarHBondContact NZ-O 3.28Å; K793-L863 WeakPolarHBondContact CD-O 3.26Å; K793-L863 WeakPolarHBondContact CE-O 3.39Å; K793-L863 PolarHBondContact NZ-O 2.75Å; K793-A864 HydrophobicContact CB-CB 4.47Å
794	E	76.6	Confident	63.8	Low	167 Å²	167	118.7 Å²	118.7	78%	0.78	58%	0.579	S	S	*	*	P	Polyproline II helix	trans	-77.2	145.9	179.2	-168.5	161.3	-157.9	0	0	110.8
795	L	84.2	Confident	66.1	Low	60 Å²	60	112.4 Å²	112.4	31%	0.314	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-86.3	133.9	179.1	-58.4	177.1	0	0	0	109.7	S803 A864 E867	L795-S803 WeakPolarHBondContact CD2-OG 3.34Å; L795-A864 HydrophobicContact CD2-CB 3.48Å; L795-A864 VanDerWaalsContact CD2-CB 3.48Å; L795-E867 HydrophobicContact CD2-CG 4.42Å
796	K	83.3	Confident	68.8	Low	90 Å²	90	103.2 Å²	103.2	39%	0.391	51%	0.512	S	S	.	.	S	Bend	trans	-108.2	-25.3	-175.6	-58.9	-172.8	-168.8	165.5	0	113.8	M856 E859 L863 E867	K796-M856 HydrophobicContact CB-CE 4.01Å; K796-M856 HydrophobicContact CB-SD 4.23Å; K796-M856 HydrophobicContact CD-CE 3.53Å; K796-M856 HydrophobicContact CG-CE 4.41Å; K796-E859 IonicContact NZ-OE2 2.62Å; K796-E859 PolarHBondContact NZ-OE2 3.27Å; K796-L863 HydrophobicContact CB-CD2 4.33Å; K796-L863 HydrophobicContact CD-CD2 3.7Å; K796-L863 HydrophobicContact CG-CD2 4.16Å; K796-E867 PolarHBondContact N-OE1 2.96Å; K796-E867 PolarHBondContact N-OE2 3.2Å
797	V	85.1	Confident	71.3	Confident	35 Å²	35	97.3 Å²	97.3	21%	0.212	49%	0.49	C	S	.	.	S	Bend	trans	-136.1	-36.4	-174.7	-171.9	0	0	0	0	112.9	Q849 V852 L853 M856 E867	V797-Q849 HydrophobicContact CG1-CB 4.43Å; V797-V852 HydrophobicContact CG1-CB 4.16Å; V797-V852 HydrophobicContact CG1-CG1 4.01Å; V797-V852 HydrophobicContact CG2-CG1 3.85Å; V797-L853 HydrophobicContact CB-CD2 3.86Å; V797-L853 HydrophobicContact CB-CG 4.03Å; V797-L853 HydrophobicContact CG1-CD2 4.49Å; V797-L853 HydrophobicContact CG1-CG 4.11Å; V797-L853 HydrophobicContact CG2-CD2 3.75Å; V797-L853 HydrophobicContact CG2-CG 4.14Å; V797-M856 HydrophobicContact CG2-SD 3.5Å; V797-M856 WeakPolarHBondContact CG2-SD 3.28Å; V797-E867 PolarHBondContact N-OE1 3.31Å
798	L	87.5	Confident	73.9	Confident	8 Å²	8	95.8 Å²	95.8	4%	0.042	48%	0.476	C	S	.	.	S	Bend	trans	-89.1	137.9	-177.4	-62.9	-178	0	0	0	111.9	L806 P845 Q849 L853 E867	L798-L806 HydrophobicContact CD1-CD1 3.9Å; L798-P845 HydrophobicContact CD1-CG 4.26Å; L798-P845 HydrophobicContact CD2-CB 3.74Å; L798-P845 HydrophobicContact CD2-CG 3.63Å; L798-Q849 HydrophobicContact CD2-CB 4.49Å; L798-L853 HydrophobicContact CD1-CD1 4.39Å; L798-L853 HydrophobicContact CD2-CD1 4.1Å; L798-L853 HydrophobicContact CG-CD1 4.14Å; L798-E867 HydrophobicContact CB-CG 4.15Å; L798-E867 HydrophobicContact CD1-CG 3.79Å; L798-E867 HydrophobicContact CG-CG 3.88Å; L798-E867 PolarHBondContact N-OE1 3.36Å
799	D	86.5	Confident	76.3	Confident	76 Å²	76	88.1 Å²	88.1	41%	0.406	44%	0.44	S	S	.	.			trans	-67.2	156.6	170.8	79	85.9	0	0	0	111.2	K801 S802 S803	D799-K801 VanDerWaalsContact C-N 3.25Å; D799-K801 PolarHBondContact O-N 3.48Å; D799-K801 VanDerWaalsContact O-N 3.17Å; D799-K801 WeakPolarHBondContact OD1-CA 3.32Å; D799-K801 VanDerWaalsContact OD1-CB 3.26Å; D799-K801 WeakPolarHBondContact OD1-CB 3.44Å; D799-K801 PolarHBondContact OD1-N 2.95Å; D799-S802 PolarHBondContact O-N 3.39Å; D799-S802 PolarHBondContact OD1-N 3.06Å; D799-S802 WeakPolarHBondContact OD2-CB 3.4Å; D799-S802 PolarHBondContact OD2-OG 2.9Å; D799-S803 WeakPolarHBondContact O-CB 3.34Å; D799-S803 PolarHBondContact O-N 3.45Å
800	S	82	Confident	78.6	Confident	88 Å²	88	79 Å²	79	62%	0.615	40%	0.401	S	S	*	.	H	α-helix	trans	-54.8	-36.5	-176.3	-173.3	0	0	0	0	113.7	Q804	S800-Q804 WeakPolarHBondContact O-CB 3.28Å; S800-Q804 PolarHBondContact O-N 3Å
801	K	83.7	Confident	80.7	Confident	129 Å²	129	73.1 Å²	73.1	56%	0.561	39%	0.387	S	S	*	.	H	α-helix	trans	-77.3	-45.5	-177.4	-175	-176.1	178.3	-175.5	0	111.5	D799 Q804 N805	D799-K801 VanDerWaalsContact C-N 3.25Å; D799-K801 PolarHBondContact O-N 3.48Å; D799-K801 VanDerWaalsContact O-N 3.17Å; D799-K801 WeakPolarHBondContact OD1-CA 3.32Å; D799-K801 VanDerWaalsContact OD1-CB 3.26Å; D799-K801 WeakPolarHBondContact OD1-CB 3.44Å; D799-K801 PolarHBondContact OD1-N 2.95Å; K801-Q804 PolarHBondContact O-N 3.49Å; K801-N805 WeakPolarHBondContact O-CB 3.24Å; K801-N805 VanDerWaalsContact O-CG 3.25Å; K801-N805 PolarHBondContact O-N 3.5Å; K801-N805 PolarHBondContact O-OD1 3.03Å
802	S	83.6	Confident	82.4	Confident	40 Å²	40	67.7 Å²	67.7	28%	0.28	37%	0.374	S	S	.	.	H	α-helix	trans	-64.4	-42.5	175.2	-57.7	0	0	0	0	111.2	D799 N805 L806	D799-S802 PolarHBondContact O-N 3.39Å; D799-S802 PolarHBondContact OD1-N 3.06Å; D799-S802 WeakPolarHBondContact OD2-CB 3.4Å; D799-S802 PolarHBondContact OD2-OG 2.9Å; S802-N805 PolarHBondContact O-N 3.38Å; S802-L806 WeakPolarHBondContact O-CB 3.49Å; S802-L806 PolarHBondContact O-N 2.87Å
803	S	86.7	Confident	83.5	Confident	8 Å²	8	63.9 Å²	63.9	6%	0.056	35%	0.345	C	S	.	.	H	α-helix	trans	-61.3	-43.7	174.5	-178.2	0	0	0	0	112.5	L795 D799 S807 S866	L795-S803 WeakPolarHBondContact CD2-OG 3.34Å; D799-S803 WeakPolarHBondContact O-CB 3.34Å; D799-S803 PolarHBondContact O-N 3.45Å; S803-S807 WeakPolarHBondContact O-CB 3.3Å; S803-S807 PolarHBondContact O-N 3.01Å; S803-S807 PolarHBondContact O-OG 3.13Å; S803-S866 WeakPolarHBondContact O-CB 3.2Å; S803-S866 PolarHBondContact OG-OG 3.2Å
804	Q	85.3	Confident	84	Confident	117 Å²	117	70.1 Å²	70.1	55%	0.547	37%	0.367	S	S	.	.	H	α-helix	trans	-65.8	-44	176	-176.3	176.1	17.4	0	0	112.1	S800 K801 L806 S807 I808	S800-Q804 WeakPolarHBondContact O-CB 3.28Å; S800-Q804 PolarHBondContact O-N 3Å; K801-Q804 PolarHBondContact O-N 3.49Å; Q804-L806 PolarHBondContact O-N 2.86Å; Q804-S807 PolarHBondContact O-N 3.2Å; Q804-I808 HydrophobicContact CG-CD1 3.94Å; Q804-I808 VanDerWaalsContact O-CG1 3.31Å; Q804-I808 WeakPolarHBondContact O-CG1 3.3Å; Q804-I808 PolarHBondContact O-N 2.81Å
805	N	86.1	Confident	84.5	Confident	58 Å²	58	64.3 Å²	64.3	31%	0.31	34%	0.341	S	S	.	.	H	α-helix	trans	-59.2	-47.4	176.8	-77.3	-3.2	0	0	0	111.8	K801 S802 I808 F809 Q843	K801-N805 WeakPolarHBondContact O-CB 3.24Å; K801-N805 VanDerWaalsContact O-CG 3.25Å; K801-N805 PolarHBondContact O-N 3.5Å; K801-N805 PolarHBondContact O-OD1 3.03Å; S802-N805 PolarHBondContact O-N 3.38Å; N805-I808 PolarHBondContact O-N 3.11Å; N805-F809 WeakPolarHBondContact O-CB 3.3Å; N805-F809 PolarHBondContact O-N 3.38Å; N805-Q843 PolarHBondContact ND2-OE1 2.82Å
806	L	87.1	Confident	84.8	Confident	2 Å²	2	65.2 Å²	65.2	1%	0.01	35%	0.35	C	S	.	.	H	α-helix	trans	-62.2	-42.4	174.8	-79.1	167.5	0	0	0	111.5	L798 S802 Q804 I808 F809 L810 Q843 P845 F869	L798-L806 HydrophobicContact CD1-CD1 3.9Å; S802-L806 WeakPolarHBondContact O-CB 3.49Å; S802-L806 PolarHBondContact O-N 2.87Å; Q804-L806 PolarHBondContact O-N 2.86Å; L806-I808 VanDerWaalsContact C-N 3.33Å; L806-I808 PolarHBondContact O-N 3.06Å; L806-F809 PolarHBondContact O-N 2.97Å; L806-L810 WeakPolarHBondContact O-CB 3.26Å; L806-L810 WeakPolarHBondContact O-CG 3.46Å; L806-L810 PolarHBondContact O-N 3.01Å; L806-Q843 HydrophobicContact CD2-CB 4.12Å; L806-Q843 WeakPolarHBondContact CD2-O 3.32Å; L806-Q843 WeakPolarHBondContact CG-O 3.44Å; L806-P845 HydrophobicContact CD1-CG 3.96Å; L806-F869 HydrophobicContact CD2-CD1 3.95Å; L806-F869 HydrophobicContact CD2-CE1 3.76Å
807	S	85.4	Confident	85.2	Confident	54 Å²	54	62.9 Å²	62.9	38%	0.378	34%	0.339	S	S	.	.	H	α-helix	trans	-62	-39	177.6	-59.1	0	0	0	0	112.5	S803 Q804 G811	S803-S807 WeakPolarHBondContact O-CB 3.3Å; S803-S807 PolarHBondContact O-N 3.01Å; S803-S807 PolarHBondContact O-OG 3.13Å; Q804-S807 PolarHBondContact O-N 3.2Å; S807-G811 PolarHBondContact O-N 2.6Å
808	I	85.5	Confident	85.5	Confident	111 Å²	111	65.1 Å²	65.1	57%	0.569	35%	0.347	S	S	*	.	H	α-helix	trans	-66.6	-43.6	175.1	-69.5	165.7	0	0	0	110.9	Q804 N805 L806 S812	Q804-I808 HydrophobicContact CG-CD1 3.94Å; Q804-I808 VanDerWaalsContact O-CG1 3.31Å; Q804-I808 WeakPolarHBondContact O-CG1 3.3Å; Q804-I808 PolarHBondContact O-N 2.81Å; N805-I808 PolarHBondContact O-N 3.11Å; L806-I808 VanDerWaalsContact C-N 3.33Å; L806-I808 PolarHBondContact O-N 3.06Å; I808-S812 PolarHBondContact O-N 3.26Å
809	F	85.4	Confident	85.7	Confident	12 Å²	12	68.6 Å²	68.6	5%	0.053	36%	0.363	C	S	.	.	H	α-helix	trans	-63.1	-52.3	176.5	169.9	-99	0	0	0	111.8	N805 L806 G811 S812 F813 M836 N839 L840	N805-F809 WeakPolarHBondContact O-CB 3.3Å; N805-F809 PolarHBondContact O-N 3.38Å; L806-F809 PolarHBondContact O-N 2.97Å; F809-G811 VanDerWaalsContact C-N 3.28Å; F809-G811 PolarHBondContact O-N 2.63Å; F809-S812 PolarHBondContact O-N 3.02Å; F809-S812 VanDerWaalsContact O-N 3.12Å; F809-S812 PolarHBondContact O-OG 3.38Å; F809-F813 AromaticContact CD2-CD2 3.62Å; F809-F813 HydrophobicContact CD2-CD2 3.62Å; F809-F813 AromaticContact CD2-CE2 3.55Å; F809-F813 HydrophobicContact CD2-CE2 3.55Å; F809-F813 AromaticContact CE2-CD2 3.37Å; F809-F813 HydrophobicContact CE2-CD2 3.37Å; F809-F813 AromaticContact CE2-CE2 3.21Å; F809-F813 HydrophobicContact CE2-CE2 3.21Å; F809-F813 HydrophobicContact CE2-CG 4.31Å; F809-F813 HydrophobicContact CE2-CZ 4.05Å; F809-F813 HydrophobicContact CG-CD2 4.3Å; F809-F813 AromaticContact CZ-CD2 3.86Å; F809-F813 HydrophobicContact CZ-CD2 3.86Å; F809-F813 HydrophobicContact CZ-CE2 4.07Å; F809-F813 HydrophobicContact CZ-CG 4.43Å; F809-F813 WeakPolarHBondContact O-CD2 3.4Å; F809-F813 PolarHBondContact O-N 2.98Å; F809-F813 VanDerWaalsContact O-N 3.13Å; F809-M836 HydrophobicContact CZ-CG 4.41Å; F809-N839 HydrophobicContact CD2-CB 3.79Å; F809-N839 HydrophobicContact CE2-CB 3.51Å; F809-L840 HydrophobicContact CE1-CD2 3.62Å; F809-L840 HydrophobicContact CE1-CG 4.3Å; F809-L840 HydrophobicContact CZ-CD2 3.64Å; F809-L840 HydrophobicContact CZ-CG 3.81Å
810	L	85.2	Confident	86	Confident	15 Å²	15	65 Å²	65	8%	0.079	34%	0.344	C	S	.	.	H	α-helix	trans	-63.3	-35.9	-180	-63	168	0	0	0	111.6	L806 S812 R814 Y817 I820 F869	L806-L810 WeakPolarHBondContact O-CB 3.26Å; L806-L810 WeakPolarHBondContact O-CG 3.46Å; L806-L810 PolarHBondContact O-N 3.01Å; L810-S812 VanDerWaalsContact C-N 3.29Å; L810-S812 PolarHBondContact O-N 2.83Å; L810-R814 PolarHBondContact O-N 2.95Å; L810-Y817 HydrophobicContact CB-CE1 4.47Å; L810-Y817 HydrophobicContact CD1-CE1 4.03Å; L810-Y817 HydrophobicContact CD2-CD1 4.16Å; L810-Y817 HydrophobicContact CD2-CE1 3.96Å; L810-Y817 HydrophobicContact CG-CE1 4.36Å; L810-I820 HydrophobicContact CD2-CD1 4.33Å; L810-F869 HydrophobicContact CD1-CB 3.54Å; L810-F869 HydrophobicContact CD1-CD1 4.21Å; L810-F869 HydrophobicContact CD1-CD2 4.29Å; L810-F869 HydrophobicContact CD1-CG 3.77Å; L810-F869 HydrophobicContact CD2-CB 4.34Å; L810-F869 HydrophobicContact CD2-CD1 4.38Å; L810-F869 HydrophobicContact CD2-CD2 3.5Å; L810-F869 VanDerWaalsContact CD2-CD2 3.5Å; L810-F869 HydrophobicContact CD2-CE2 3.78Å; L810-F869 HydrophobicContact CD2-CG 3.82Å; L810-F869 HydrophobicContact CD2-CZ 4.34Å; L810-F869 HydrophobicContact CG-CG 4.38Å
811	G	81.6	Confident	86.5	Confident	42 Å²	42	62.3 Å²	62.3	43%	0.433	32%	0.321	S	S	.	.	H	α-helix	trans	-67.2	-21.8	175.7	0	0	0	0	0	115.2	S807 F809 R814	S807-G811 PolarHBondContact O-N 2.6Å; F809-G811 VanDerWaalsContact C-N 3.28Å; F809-G811 PolarHBondContact O-N 2.63Å; G811-R814 WeakPolarHBondContact O-CG 3.38Å; G811-R814 PolarHBondContact O-NE 3.48Å; G811-R814 VanDerWaalsContact O-NE 3.13Å
812	S	80.6	Confident	87	Confident	81 Å²	81	58.4 Å²	58.4	57%	0.566	31%	0.307	S	S	*	.	H	α-helix	trans	-89.4	-40.2	174.6	69.8	0	0	0	0	112.8	I808 F809 L810	I808-S812 PolarHBondContact O-N 3.26Å; F809-S812 PolarHBondContact O-N 3.02Å; F809-S812 VanDerWaalsContact O-N 3.12Å; F809-S812 PolarHBondContact O-OG 3.38Å; L810-S812 VanDerWaalsContact C-N 3.29Å; L810-S812 PolarHBondContact O-N 2.83Å
813	F	78.6	Confident	87.5	Confident	67 Å²	67	56.6 Å²	56.6	29%	0.294	29%	0.294	S	S	.	.	H	α-helix	trans	-80.6	-33	179.8	-76.7	-87.1	0	0	0	114	F809 L815 M836	F809-F813 AromaticContact CD2-CD2 3.62Å; F809-F813 HydrophobicContact CD2-CD2 3.62Å; F809-F813 AromaticContact CD2-CE2 3.55Å; F809-F813 HydrophobicContact CD2-CE2 3.55Å; F809-F813 AromaticContact CE2-CD2 3.37Å; F809-F813 HydrophobicContact CE2-CD2 3.37Å; F809-F813 AromaticContact CE2-CE2 3.21Å; F809-F813 HydrophobicContact CE2-CE2 3.21Å; F809-F813 HydrophobicContact CE2-CG 4.31Å; F809-F813 HydrophobicContact CE2-CZ 4.05Å; F809-F813 HydrophobicContact CG-CD2 4.3Å; F809-F813 AromaticContact CZ-CD2 3.86Å; F809-F813 HydrophobicContact CZ-CD2 3.86Å; F809-F813 HydrophobicContact CZ-CE2 4.07Å; F809-F813 HydrophobicContact CZ-CG 4.43Å; F809-F813 WeakPolarHBondContact O-CD2 3.4Å; F809-F813 PolarHBondContact O-N 2.98Å; F809-F813 VanDerWaalsContact O-N 3.13Å; F813-L815 PolarHBondContact O-N 3.03Å; F813-M836 HydrophobicContact CD1-CB 4.37Å; F813-M836 HydrophobicContact CD1-CE 4.47Å; F813-M836 HydrophobicContact CD1-CG 3.9Å; F813-M836 HydrophobicContact CD1-SD 4.02Å; F813-M836 HydrophobicContact CE1-CB 3.61Å; F813-M836 HydrophobicContact CE1-CG 3.62Å; F813-M836 HydrophobicContact CE1-SD 4.17Å; F813-M836 HydrophobicContact CZ-CB 3.95Å; F813-M836 HydrophobicContact CZ-CG 4.09Å
814	R	83.7	Confident	87.9	Confident	212 Å²	212	56.2 Å²	56.2	80%	0.8	29%	0.291	S	S	*	.			trans	56.4	15.8	172.5	-56.4	-175.3	176.7	-172	-0.8	117.1	L810 G811	L810-R814 PolarHBondContact O-N 2.95Å; G811-R814 WeakPolarHBondContact O-CG 3.38Å; G811-R814 PolarHBondContact O-NE 3.48Å; G811-R814 VanDerWaalsContact O-NE 3.13Å
815	L	86.4	Confident	88.3	Confident	46 Å²	46	50.7 Å²	50.7	24%	0.241	27%	0.266	C	S	.	.			trans	-79.3	142.4	173.7	-66.8	171.5	0	0	0	111	F813 I820 I831 M836	F813-L815 PolarHBondContact O-N 3.03Å; L815-I820 HydrophobicContact CB-CD1 4.1Å; L815-I820 HydrophobicContact CB-CG1 3.74Å; L815-I820 HydrophobicContact CD1-CG1 4.29Å; L815-I831 HydrophobicContact CD1-CG2 3.64Å; L815-M836 HydrophobicContact CD1-CE 3.89Å; L815-M836 HydrophobicContact CD1-SD 4.45Å
816	P	91.6	Very high	88.8	Confident	78 Å²	78	50.6 Å²	50.6	51%	0.506	26%	0.263	S	S	.	.			trans	-54	137.6	166.9	-22.8	32.8	0	0	0	111.3	E818 E819 I820	P816-E818 VanDerWaalsContact C-N 3.26Å; P816-E818 PolarHBondContact O-N 3.32Å; P816-E819 HydrophobicContact CB-CB 4.15Å; P816-E819 WeakPolarHBondContact CD-OE2 3.27Å; P816-E819 HydrophobicContact CG-CB 4.4Å; P816-E819 WeakPolarHBondContact O-CA 3.5Å; P816-E819 WeakPolarHBondContact O-CB 3.32Å; P816-E819 PolarHBondContact O-N 2.96Å; P816-I820 PolarHBondContact O-N 3.36Å; P816-I820 VanDerWaalsContact O-N 3.1Å
817	Y	91.9	Very high	89.1	Confident	42 Å²	42	50.5 Å²	50.5	17%	0.165	26%	0.263	C	S	.	.	H	α-helix	trans	-62.5	-33.7	-173.9	-47.1	-33	0	0	0	112.7	L810 E819 I820 K821 E865 Q868 F869 V872 M873	L810-Y817 HydrophobicContact CB-CE1 4.47Å; L810-Y817 HydrophobicContact CD1-CE1 4.03Å; L810-Y817 HydrophobicContact CD2-CD1 4.16Å; L810-Y817 HydrophobicContact CD2-CE1 3.96Å; L810-Y817 HydrophobicContact CG-CE1 4.36Å; Y817-E819 VanDerWaalsContact C-N 3.35Å; Y817-I820 PolarHBondContact O-N 3Å; Y817-K821 WeakPolarHBondContact O-CB 3.2Å; Y817-K821 PolarHBondContact O-N 3.48Å; Y817-E865 PolarHBondContact OH-O 3.1Å; Y817-Q868 HydrophobicContact CD2-CB 4.31Å; Y817-Q868 HydrophobicContact CE2-CB 3.86Å; Y817-F869 HydrophobicContact CD1-CB 4.17Å; Y817-F869 AromaticContact CD1-CD2 3.88Å; Y817-F869 HydrophobicContact CD1-CD2 3.88Å; Y817-F869 HydrophobicContact CD2-CB 4.17Å; Y817-F869 HydrophobicContact CE1-CB 4.3Å; Y817-F869 HydrophobicContact CE2-CB 4.29Å; Y817-F869 HydrophobicContact CG-CB 4.12Å; Y817-F869 HydrophobicContact CG-CD2 4.1Å; Y817-V872 WeakPolarHBondContact O-CG1 3.34Å; Y817-M873 WeakPolarHBondContact O-CE 3.3Å
818	E	90.7	Very high	89.5	Confident	82 Å²	82	50 Å²	50	38%	0.383	26%	0.256	S	S	.	.	H	α-helix	trans	-67.3	-30.9	172.1	-77.6	-67.4	148.4	0	0	112.8	P816 K821 N822 V872	P816-E818 VanDerWaalsContact C-N 3.26Å; P816-E818 PolarHBondContact O-N 3.32Å; E818-K821 PolarHBondContact O-N 3.02Å; E818-K821 IonicContact OE1-NZ 3.23Å; E818-K821 PolarHBondContact OE1-NZ 3.31Å; E818-K821 WeakPolarHBondContact OE2-CD 3.28Å; E818-K821 WeakPolarHBondContact OE2-CE 3.3Å; E818-K821 IonicContact OE2-NZ 2.72Å; E818-K821 PolarHBondContact OE2-NZ 3.16Å; E818-N822 WeakPolarHBondContact O-CB 3.32Å; E818-N822 VanDerWaalsContact O-CG 3.23Å; E818-N822 PolarHBondContact O-N 2.8Å; E818-N822 PolarHBondContact O-ND2 3Å; E818-V872 HydrophobicContact CG-CG1 4.23Å; E818-V872 WeakPolarHBondContact OE1-CG1 3.24Å
819	E	92	Very high	89.8	Confident	81 Å²	81	49.2 Å²	49.2	38%	0.379	25%	0.25	S	C	.	.	H	α-helix	trans	-70.3	-40.3	173.6	-169.9	174.5	175.7	0	0	110.9	P816 Y817 K821 N822 A823 I831	P816-E819 HydrophobicContact CB-CB 4.15Å; P816-E819 WeakPolarHBondContact CD-OE2 3.27Å; P816-E819 HydrophobicContact CG-CB 4.4Å; P816-E819 WeakPolarHBondContact O-CA 3.5Å; P816-E819 WeakPolarHBondContact O-CB 3.32Å; P816-E819 PolarHBondContact O-N 2.96Å; Y817-E819 VanDerWaalsContact C-N 3.35Å; E819-K821 PolarHBondContact O-N 2.95Å; E819-N822 PolarHBondContact O-N 2.91Å; E819-A823 VanDerWaalsContact O-CB 3.29Å; E819-A823 WeakPolarHBondContact O-CB 3.49Å; E819-A823 PolarHBondContact O-N 3.1Å; E819-I831 HydrophobicContact CG-CD1 4.31Å
820	I	92.1	Very high	90	Very high	1 Å²	1	58.2 Å²	58.2	1%	0.005	29%	0.289	C	S	.	.	H	α-helix	trans	-60.2	-46.3	172.6	-57.3	173.7	0	0	0	110.4	L810 L815 P816 Y817 A823 I824 M836 L840 F869 M873	L810-I820 HydrophobicContact CD2-CD1 4.33Å; L815-I820 HydrophobicContact CB-CD1 4.1Å; L815-I820 HydrophobicContact CB-CG1 3.74Å; L815-I820 HydrophobicContact CD1-CG1 4.29Å; P816-I820 PolarHBondContact O-N 3.36Å; P816-I820 VanDerWaalsContact O-N 3.1Å; Y817-I820 PolarHBondContact O-N 3Å; I820-A823 PolarHBondContact O-N 2.98Å; I820-I824 HydrophobicContact CG2-CD1 3.99Å; I820-I824 WeakPolarHBondContact O-CD1 3.21Å; I820-I824 VanDerWaalsContact O-CG1 3.3Å; I820-I824 WeakPolarHBondContact O-CG1 3.3Å; I820-I824 PolarHBondContact O-N 3.16Å; I820-M836 HydrophobicContact CD1-CE 4.32Å; I820-M836 HydrophobicContact CG1-CE 4.01Å; I820-M836 HydrophobicContact CG2-CE 3.99Å; I820-L840 HydrophobicContact CG2-CD1 4.42Å; I820-F869 HydrophobicContact CD1-CE2 4.07Å; I820-F869 HydrophobicContact CG2-CE2 4.42Å; I820-M873 HydrophobicContact CB-CE 4.04Å; I820-M873 HydrophobicContact CG2-CE 3.89Å
821	K	93.3	Very high	90.2	Very high	31 Å²	31	59.3 Å²	59.3	14%	0.135	30%	0.295	C	S	.	.	H	α-helix	trans	-60.5	-48.3	176.9	164.9	178.8	164.2	-143.2	0	111.9	Y817 E818 E819 A823 I824 L825 V872 M873 V876	Y817-K821 WeakPolarHBondContact O-CB 3.2Å; Y817-K821 PolarHBondContact O-N 3.48Å; E818-K821 PolarHBondContact O-N 3.02Å; E818-K821 IonicContact OE1-NZ 3.23Å; E818-K821 PolarHBondContact OE1-NZ 3.31Å; E818-K821 WeakPolarHBondContact OE2-CD 3.28Å; E818-K821 WeakPolarHBondContact OE2-CE 3.3Å; E818-K821 IonicContact OE2-NZ 2.72Å; E818-K821 PolarHBondContact OE2-NZ 3.16Å; E819-K821 PolarHBondContact O-N 2.95Å; K821-A823 VanDerWaalsContact C-N 3.34Å; K821-A823 PolarHBondContact O-N 3.35Å; K821-I824 PolarHBondContact O-N 3.33Å; K821-L825 HydrophobicContact CG-CD1 4.19Å; K821-L825 WeakPolarHBondContact O-CG 3.42Å; K821-L825 PolarHBondContact O-N 2.97Å; K821-V872 HydrophobicContact CB-CG1 3.98Å; K821-V872 HydrophobicContact CD-CG1 3.61Å; K821-V872 HydrophobicContact CG-CG1 4.48Å; K821-M873 HydrophobicContact CB-CE 3.85Å; K821-V876 HydrophobicContact CD-CG2 4.47Å; K821-V876 HydrophobicContact CG-CG2 3.88Å
822	N	93.7	Very high	90.7	Very high	47 Å²	47	57.4 Å²	57.4	25%	0.251	27%	0.274	S	S	.	.	H	α-helix	trans	-64.9	-37.9	177.7	-72.1	-37.7	0	0	0	111.7	E818 E819 I824 L825 Q826	E818-N822 WeakPolarHBondContact O-CB 3.32Å; E818-N822 VanDerWaalsContact O-CG 3.23Å; E818-N822 PolarHBondContact O-N 2.8Å; E818-N822 PolarHBondContact O-ND2 3Å; E819-N822 PolarHBondContact O-N 2.91Å; N822-I824 VanDerWaalsContact C-N 3.31Å; N822-I824 PolarHBondContact O-N 3.42Å; N822-L825 PolarHBondContact O-N 3.41Å; N822-Q826 VanDerWaalsContact O-CB 3.26Å; N822-Q826 WeakPolarHBondContact O-CB 3.3Å; N822-Q826 VanDerWaalsContact O-CG 3.28Å; N822-Q826 WeakPolarHBondContact O-CG 3.37Å; N822-Q826 PolarHBondContact O-N 3.21Å
823	A	94.4	Very high	91.2	Very high	2 Å²	2	57.1 Å²	57.1	2%	0.017	27%	0.269	C	S	.	.	H	α-helix	trans	-62	-36.3	173.7	0	0	0	0	0	112.8	E819 I820 K821 V827 N828 I831 L832	E819-A823 VanDerWaalsContact O-CB 3.29Å; E819-A823 WeakPolarHBondContact O-CB 3.49Å; E819-A823 PolarHBondContact O-N 3.1Å; I820-A823 PolarHBondContact O-N 2.98Å; K821-A823 VanDerWaalsContact C-N 3.34Å; K821-A823 PolarHBondContact O-N 3.35Å; A823-V827 CarbonylContact O-C 3.19Å; A823-V827 WeakPolarHBondContact O-CA 3.39Å; A823-V827 PolarHBondContact O-N 3.31Å; A823-N828 HydrophobicContact CB-CB 4.11Å; A823-N828 PolarHBondContact O-N 3.48Å; A823-I831 HydrophobicContact CB-CB 4.04Å; A823-I831 HydrophobicContact CB-CD1 4.24Å; A823-I831 HydrophobicContact CB-CG2 3.92Å; A823-L832 HydrophobicContact CB-CD2 4Å; A823-L832 HydrophobicContact CB-CG 4.03Å; A823-L832 WeakPolarHBondContact O-CD1 3.46Å
824	I	95.1	Very high	91.8	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-70.7	-43.2	174.6	-66.5	161.9	0	0	0	111.7	I820 K821 N822 L832 L840 M873 V876 L879 R882 L883 I886	I820-I824 HydrophobicContact CG2-CD1 3.99Å; I820-I824 WeakPolarHBondContact O-CD1 3.21Å; I820-I824 VanDerWaalsContact O-CG1 3.3Å; I820-I824 WeakPolarHBondContact O-CG1 3.3Å; I820-I824 PolarHBondContact O-N 3.16Å; K821-I824 PolarHBondContact O-N 3.33Å; N822-I824 VanDerWaalsContact C-N 3.31Å; N822-I824 PolarHBondContact O-N 3.42Å; I824-L832 HydrophobicContact CG1-CD1 4.17Å; I824-L832 HydrophobicContact CG1-CD2 4.29Å; I824-L840 HydrophobicContact CD1-CD1 4.34Å; I824-M873 HydrophobicContact CD1-SD 3.98Å; I824-V876 HydrophobicContact CG2-CG1 4.32Å; I824-L879 HydrophobicContact CD1-CD1 4.25Å; I824-L879 HydrophobicContact CG2-CD1 4.27Å; I824-R882 HydrophobicContact CG2-CB 4.33Å; I824-L883 HydrophobicContact CD1-CD2 3.93Å; I824-L883 HydrophobicContact CG1-CD2 3.97Å; I824-L883 HydrophobicContact CG2-CD2 4.48Å; I824-I886 HydrophobicContact CG2-CD1 4.21Å
825	L	94.7	Very high	92.1	Very high	1 Å²	1	49.7 Å²	49.7	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-66.2	-44.9	178.3	-69.1	176.2	0	0	0	112	K821 N822 V827 V876 N1029 D1030 H1031 F1032	K821-L825 HydrophobicContact CG-CD1 4.19Å; K821-L825 WeakPolarHBondContact O-CG 3.42Å; K821-L825 PolarHBondContact O-N 2.97Å; N822-L825 PolarHBondContact O-N 3.41Å; L825-V827 VanDerWaalsContact C-N 3.32Å; L825-V827 PolarHBondContact O-N 2.91Å; L825-V876 HydrophobicContact CD2-CG1 4.09Å; L825-N1029 CarbonylContact C-O 3.57Å; L825-D1030 HydrophobicContact CD2-CB 4.35Å; L825-H1031 PolarHBondContact O-N 3.48Å; L825-H1031 VanDerWaalsContact O-N 3.16Å; L825-F1032 PolarHBondContact O-N 2.97Å
826	Q	95	Very high	92.3	Very high	55 Å²	55	47.6 Å²	47.6	26%	0.257	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.7	-8.9	-179.4	-64.9	176.6	-11.9	0	0	113.5	N822 N1029 K1035	N822-Q826 VanDerWaalsContact O-CB 3.26Å; N822-Q826 WeakPolarHBondContact O-CB 3.3Å; N822-Q826 VanDerWaalsContact O-CG 3.28Å; N822-Q826 WeakPolarHBondContact O-CG 3.37Å; N822-Q826 PolarHBondContact O-N 3.21Å; Q826-N1029 WeakPolarHBondContact CA-O 3.31Å; Q826-N1029 HydrophobicContact CG-CB 3.99Å; Q826-N1029 VanDerWaalsContact CG-O 3.22Å; Q826-N1029 WeakPolarHBondContact CG-O 3.35Å; Q826-N1029 PolarHBondContact N-O 3.29Å; Q826-N1029 PolarHBondContact NE2-OD1 3.44Å; Q826-K1035 WeakPolarHBondContact O-CD 3.45Å; Q826-K1035 WeakPolarHBondContact O-CE 3.29Å; Q826-K1035 PolarHBondContact O-NZ 3.29Å
827	V	94.9	Very high	92.4	Very high	1 Å²	1	43.9 Å²	43.9	1%	0.006	22%	0.216	C	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	66.2	-168.1	-174.7	0	0	0	0	110.5	A823 L825 E829 I886 F1032 K1035 M1036	A823-V827 CarbonylContact O-C 3.19Å; A823-V827 WeakPolarHBondContact O-CA 3.39Å; A823-V827 PolarHBondContact O-N 3.31Å; L825-V827 VanDerWaalsContact C-N 3.32Å; L825-V827 PolarHBondContact O-N 2.91Å; V827-E829 PolarHBondContact O-N 3.35Å; V827-I886 HydrophobicContact CG1-CG1 4.18Å; V827-I886 HydrophobicContact CG2-CD1 4.2Å; V827-I886 HydrophobicContact CG2-CG1 4.17Å; V827-F1032 HydrophobicContact CG2-CB 4.33Å; V827-F1032 HydrophobicContact CG2-CD2 3.76Å; V827-F1032 HydrophobicContact CG2-CG 4.49Å; V827-K1035 HydrophobicContact CB-CD 3.79Å; V827-K1035 HydrophobicContact CG1-CD 4.39Å; V827-K1035 PolarHBondContact O-NZ 3.49Å; V827-M1036 HydrophobicContact CG1-CE 3.97Å; V827-M1036 HydrophobicContact CG2-CE 4.15Å
828	N	93.1	Very high	92.4	Very high	43 Å²	43	45.4 Å²	45.4	23%	0.23	23%	0.225	C	C	.	.			trans	-92.2	91.9	-175.3	-170.8	-10.2	0	0	0	111.8	A823 K830 I831 L832	A823-N828 HydrophobicContact CB-CB 4.11Å; A823-N828 PolarHBondContact O-N 3.48Å; N828-K830 PolarHBondContact O-N 3.45Å; N828-K830 VanDerWaalsContact O-N 3.09Å; N828-K830 WeakPolarHBondContact OD1-CB 3.46Å; N828-K830 PolarHBondContact OD1-N 3.47Å; N828-I831 WeakPolarHBondContact ND2-CD1 3.3Å; N828-I831 PolarHBondContact O-N 2.87Å; N828-L832 PolarHBondContact O-N 2.98Å
829	E	91.1	Very high	92.4	Very high	94 Å²	94	43.8 Å²	43.8	44%	0.439	22%	0.219	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.2	-10.6	-178.8	-64.5	162.6	-112.3	0	0	114.4	V827 K889 L890	V827-E829 PolarHBondContact O-N 3.35Å; E829-K889 WeakPolarHBondContact OE1-CE 3.5Å; E829-K889 IonicContact OE1-NZ 3.22Å; E829-K889 PolarHBondContact OE1-NZ 2.94Å; E829-K889 VanDerWaalsContact OE1-NZ 3.12Å; E829-K889 WeakPolarHBondContact OE2-CE 3.45Å; E829-K889 IonicContact OE2-NZ 3.68Å; E829-K889 PolarHBondContact OE2-NZ 3.29Å; E829-L890 HydrophobicContact CG-CD2 4.21Å
830	K	90.1	Very high	92.3	Very high	201 Å²	201	40 Å²	40	87%	0.874	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-16.3	172	-62.2	-176.7	178.7	-179.8	0	113.5	N828	N828-K830 PolarHBondContact O-N 3.45Å; N828-K830 VanDerWaalsContact O-N 3.09Å; N828-K830 WeakPolarHBondContact OD1-CB 3.46Å; N828-K830 PolarHBondContact OD1-N 3.47Å
831	I	89.9	Confident	92.3	Very high	39 Å²	39	41.8 Å²	41.8	20%	0.2	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.8	-45.3	-179.8	-59.2	179.8	0	0	0	109.6	L815 E819 A823 N828 T833	L815-I831 HydrophobicContact CD1-CG2 3.64Å; E819-I831 HydrophobicContact CG-CD1 4.31Å; A823-I831 HydrophobicContact CB-CB 4.04Å; A823-I831 HydrophobicContact CB-CD1 4.24Å; A823-I831 HydrophobicContact CB-CG2 3.92Å; N828-I831 WeakPolarHBondContact ND2-CD1 3.3Å; N828-I831 PolarHBondContact O-N 2.87Å; I831-T833 PolarHBondContact O-N 2.98Å; I831-T833 VanDerWaalsContact O-N 3.17Å
832	L	92.5	Very high	92.1	Very high	1 Å²	1	47.9 Å²	47.9	1%	0.005	24%	0.237	C	C	.	.			trans	-81.2	95.3	179.6	-59.8	-174.1	0	0	0	110.8	A823 I824 N828 M836 V837 I886 L890	A823-L832 HydrophobicContact CB-CD2 4Å; A823-L832 HydrophobicContact CB-CG 4.03Å; A823-L832 WeakPolarHBondContact O-CD1 3.46Å; I824-L832 HydrophobicContact CG1-CD1 4.17Å; I824-L832 HydrophobicContact CG1-CD2 4.29Å; N828-L832 PolarHBondContact O-N 2.98Å; L832-M836 HydrophobicContact CD2-CE 4.33Å; L832-M836 HydrophobicContact CD2-SD 4.16Å; L832-V837 HydrophobicContact CB-CG2 3.9Å; L832-V837 HydrophobicContact CD2-CG2 4.41Å; L832-I886 HydrophobicContact CB-CG2 4.49Å; L832-I886 HydrophobicContact CD1-CD1 3.99Å; L832-I886 HydrophobicContact CD1-CG2 3.94Å; L832-L890 VanDerWaalsContact O-CD1 3.31Å; L832-L890 WeakPolarHBondContact O-CD1 3.49Å
833	T	91.4	Very high	91.8	Very high	75 Å²	75	47.8 Å²	47.8	46%	0.46	24%	0.235	S	C	.	.			trans	-81.9	155.8	167.4	66	0	0	0	0	111	I831 S835 M836 V837	I831-T833 PolarHBondContact O-N 2.98Å; I831-T833 VanDerWaalsContact O-N 3.17Å; T833-S835 VanDerWaalsContact C-N 3.35Å; T833-S835 PolarHBondContact O-N 3.33Å; T833-M836 WeakPolarHBondContact O-CB 3.36Å; T833-M836 PolarHBondContact O-N 3.28Å; T833-M836 WeakPolarHBondContact OG1-CB 3.48Å; T833-M836 PolarHBondContact OG1-N 3.48Å; T833-V837 WeakPolarHBondContact O-CG2 3.26Å; T833-V837 PolarHBondContact O-N 3.1Å
834	E	90.7	Very high	91.5	Very high	62 Å²	62	48.9 Å²	48.9	29%	0.29	24%	0.24	S	C	.	.	H	α-helix	trans	-54.5	-48.7	-180	-171.5	-116.7	178.1	0	0	111.9	M836 V837 Q838 L890 Q891	E834-M836 VanDerWaalsContact C-N 3.34Å; E834-M836 PolarHBondContact O-N 2.9Å; E834-V837 PolarHBondContact O-N 2.84Å; E834-Q838 VanDerWaalsContact CD-NE2 3.29Å; E834-Q838 WeakPolarHBondContact O-CG 3.38Å; E834-Q838 PolarHBondContact O-N 3.33Å; E834-Q838 PolarHBondContact OE1-NE2 3.29Å; E834-L890 HydrophobicContact CB-CB 4.25Å; E834-L890 HydrophobicContact CG-CB 4.48Å; E834-Q891 HydrophobicContact CG-CG 3.67Å; E834-Q891 WeakPolarHBondContact OE1-CG 3.41Å; E834-Q891 PolarHBondContact OE1-NE2 3.06Å
835	S	90	Very high	91.1	Very high	61 Å²	61	49.4 Å²	49.4	43%	0.427	24%	0.244	S	C	.	.	H	α-helix	trans	-62.9	-34.3	175.2	-166.2	0	0	0	0	113.7	T833 N839	T833-S835 VanDerWaalsContact C-N 3.35Å; T833-S835 PolarHBondContact O-N 3.33Å; S835-N839 WeakPolarHBondContact O-CB 3.42Å; S835-N839 PolarHBondContact O-N 3Å; S835-N839 VanDerWaalsContact O-N 3.08Å; S835-N839 PolarHBondContact O-ND2 3.14Å
836	M	89.7	Confident	90.6	Very high	2 Å²	2	50.7 Å²	50.7	1%	0.01	26%	0.257	C	S	.	.	H	α-helix	trans	-64.5	-46.9	174.1	-174.4	-178.5	176.6	0	0	110.7	F809 F813 L815 I820 L832 T833 E834 N839 L840	F809-M836 HydrophobicContact CZ-CG 4.41Å; F813-M836 HydrophobicContact CD1-CB 4.37Å; F813-M836 HydrophobicContact CD1-CE 4.47Å; F813-M836 HydrophobicContact CD1-CG 3.9Å; F813-M836 HydrophobicContact CD1-SD 4.02Å; F813-M836 HydrophobicContact CE1-CB 3.61Å; F813-M836 HydrophobicContact CE1-CG 3.62Å; F813-M836 HydrophobicContact CE1-SD 4.17Å; F813-M836 HydrophobicContact CZ-CB 3.95Å; F813-M836 HydrophobicContact CZ-CG 4.09Å; L815-M836 HydrophobicContact CD1-CE 3.89Å; L815-M836 HydrophobicContact CD1-SD 4.45Å; I820-M836 HydrophobicContact CD1-CE 4.32Å; I820-M836 HydrophobicContact CG1-CE 4.01Å; I820-M836 HydrophobicContact CG2-CE 3.99Å; L832-M836 HydrophobicContact CD2-CE 4.33Å; L832-M836 HydrophobicContact CD2-SD 4.16Å; T833-M836 WeakPolarHBondContact O-CB 3.36Å; T833-M836 PolarHBondContact O-N 3.28Å; T833-M836 WeakPolarHBondContact OG1-CB 3.48Å; T833-M836 PolarHBondContact OG1-N 3.48Å; E834-M836 VanDerWaalsContact C-N 3.34Å; E834-M836 PolarHBondContact O-N 2.9Å; M836-N839 PolarHBondContact O-N 2.59Å; M836-L840 HydrophobicContact CE-CD1 4.43Å; M836-L840 HydrophobicContact CG-CD1 4.32Å; M836-L840 WeakPolarHBondContact O-CG 3.31Å; M836-L840 PolarHBondContact O-N 3.45Å
837	V	93.4	Very high	90.2	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-69.3	-40.5	-178.5	-179.9	0	0	0	0	111.6	L832 T833 E834 N839 L840 I841 L883 I886 Q887 L890	L832-V837 HydrophobicContact CB-CG2 3.9Å; L832-V837 HydrophobicContact CD2-CG2 4.41Å; T833-V837 WeakPolarHBondContact O-CG2 3.26Å; T833-V837 PolarHBondContact O-N 3.1Å; E834-V837 PolarHBondContact O-N 2.84Å; V837-N839 VanDerWaalsContact C-N 3.31Å; V837-N839 PolarHBondContact O-N 2.83Å; V837-L840 PolarHBondContact O-N 3.28Å; V837-I841 HydrophobicContact CG1-CD1 4.02Å; V837-I841 WeakPolarHBondContact O-CG1 3.33Å; V837-I841 PolarHBondContact O-N 2.87Å; V837-L883 HydrophobicContact CG1-CB 4.31Å; V837-L883 HydrophobicContact CG1-CD2 4.12Å; V837-L883 VanDerWaalsContact CG1-O 3.3Å; V837-L883 WeakPolarHBondContact CG1-O 3.34Å; V837-I886 HydrophobicContact CG1-CB 4.48Å; V837-I886 HydrophobicContact CG1-CG2 4.41Å; V837-I886 HydrophobicContact CG2-CG2 3.99Å; V837-Q887 HydrophobicContact CG1-CB 3.87Å; V837-L890 HydrophobicContact CB-CD1 4.49Å; V837-L890 HydrophobicContact CG2-CD1 3.92Å
838	Q	92.4	Very high	89.8	Confident	75 Å²	75	61 Å²	61	35%	0.35	32%	0.315	S	S	.	.	H	α-helix	trans	-55.5	-45.6	170.4	-74.5	-175	7.1	0	0	111.9	E834 I841 K842 Q887	E834-Q838 VanDerWaalsContact CD-NE2 3.29Å; E834-Q838 WeakPolarHBondContact O-CG 3.38Å; E834-Q838 PolarHBondContact O-N 3.33Å; E834-Q838 PolarHBondContact OE1-NE2 3.29Å; Q838-I841 PolarHBondContact O-N 3.32Å; Q838-K842 VanDerWaalsContact O-CB 3.3Å; Q838-K842 WeakPolarHBondContact O-CB 3.42Å; Q838-K842 PolarHBondContact O-N 3Å; Q838-Q887 HydrophobicContact CG-CG 4.45Å
839	N	89.9	Confident	89.5	Confident	47 Å²	47	61.9 Å²	61.9	25%	0.251	32%	0.318	S	S	.	.	H	α-helix	trans	-71	-34.9	179.6	-80.3	-71.3	0	0	0	112.4	F809 S835 M836 V837 K842 Q843	F809-N839 HydrophobicContact CD2-CB 3.79Å; F809-N839 HydrophobicContact CE2-CB 3.51Å; S835-N839 WeakPolarHBondContact O-CB 3.42Å; S835-N839 PolarHBondContact O-N 3Å; S835-N839 VanDerWaalsContact O-N 3.08Å; S835-N839 PolarHBondContact O-ND2 3.14Å; M836-N839 PolarHBondContact O-N 2.59Å; V837-N839 VanDerWaalsContact C-N 3.31Å; V837-N839 PolarHBondContact O-N 2.83Å; N839-K842 PolarHBondContact O-N 3.46Å; N839-Q843 WeakPolarHBondContact O-CB 3.36Å; N839-Q843 WeakPolarHBondContact O-CG 3.42Å; N839-Q843 PolarHBondContact O-N 2.92Å
840	L	90.2	Very high	89.5	Confident	3 Å²	3	58.1 Å²	58.1	2%	0.016	30%	0.3	C	S	.	.	H	α-helix	trans	-58.5	-51	170.3	-73.1	168.8	0	0	0	111.1	F809 I820 I824 M836 V837 K842 Q843 L844 F869 L883	F809-L840 HydrophobicContact CE1-CD2 3.62Å; F809-L840 HydrophobicContact CE1-CG 4.3Å; F809-L840 HydrophobicContact CZ-CD2 3.64Å; F809-L840 HydrophobicContact CZ-CG 3.81Å; I820-L840 HydrophobicContact CG2-CD1 4.42Å; I824-L840 HydrophobicContact CD1-CD1 4.34Å; M836-L840 HydrophobicContact CE-CD1 4.43Å; M836-L840 HydrophobicContact CG-CD1 4.32Å; M836-L840 WeakPolarHBondContact O-CG 3.31Å; M836-L840 PolarHBondContact O-N 3.45Å; V837-L840 PolarHBondContact O-N 3.28Å; L840-K842 PolarHBondContact O-N 2.89Å; L840-Q843 PolarHBondContact O-N 3.22Å; L840-L844 WeakPolarHBondContact O-CB 3.25Å; L840-L844 WeakPolarHBondContact O-CD1 3.21Å; L840-L844 WeakPolarHBondContact O-CG 3.44Å; L840-L844 PolarHBondContact O-N 2.8Å; L840-F869 HydrophobicContact CD2-CE2 4.43Å; L840-F869 HydrophobicContact CD2-CZ 3.73Å; L840-L883 HydrophobicContact CB-CD1 4.11Å; L840-L883 HydrophobicContact CB-CD2 4.29Å; L840-L883 HydrophobicContact CD1-CD2 3.93Å
841	I	91.8	Very high	89.4	Confident	37 Å²	37	51.9 Å²	51.9	19%	0.19	28%	0.282	C	S	.	.	H	α-helix	trans	-58.5	-36.2	177.9	-68.4	166.8	0	0	0	111.7	V837 Q838 M880 L883 Q884 Q887	V837-I841 HydrophobicContact CG1-CD1 4.02Å; V837-I841 WeakPolarHBondContact O-CG1 3.33Å; V837-I841 PolarHBondContact O-N 2.87Å; Q838-I841 PolarHBondContact O-N 3.32Å; I841-M880 HydrophobicContact CG2-CE 4.04Å; I841-L883 HydrophobicContact CD1-CB 4.04Å; I841-L883 HydrophobicContact CG1-CB 3.64Å; I841-L883 HydrophobicContact CG1-CD1 4.47Å; I841-Q884 HydrophobicContact CD1-CG 4.25Å; I841-Q887 HydrophobicContact CD1-CB 3.95Å; I841-Q887 HydrophobicContact CD1-CG 4.44Å
842	K	90.7	Very high	89.4	Confident	159 Å²	159	53.3 Å²	53.3	69%	0.691	29%	0.293	S	S	*	.	H	α-helix	trans	-81	-28.1	-177.1	-175.7	174.2	179.6	177.5	0	114.6	Q838 N839 L840	Q838-K842 VanDerWaalsContact O-CB 3.3Å; Q838-K842 WeakPolarHBondContact O-CB 3.42Å; Q838-K842 PolarHBondContact O-N 3Å; N839-K842 PolarHBondContact O-N 3.46Å; L840-K842 PolarHBondContact O-N 2.89Å
843	Q	87.3	Confident	89.3	Confident	46 Å²	46	53.3 Å²	53.3	22%	0.215	29%	0.292	C	S	.	.	H	α-helix	trans	-112.9	-7.7	-171.4	-53.7	-67.4	1.7	0	0	113.9	N805 L806 N839 L840	N805-Q843 PolarHBondContact ND2-OE1 2.82Å; L806-Q843 HydrophobicContact CD2-CB 4.12Å; L806-Q843 WeakPolarHBondContact CD2-O 3.32Å; L806-Q843 WeakPolarHBondContact CG-O 3.44Å; N839-Q843 WeakPolarHBondContact O-CB 3.36Å; N839-Q843 WeakPolarHBondContact O-CG 3.42Å; N839-Q843 PolarHBondContact O-N 2.92Å; L840-Q843 PolarHBondContact O-N 3.22Å
844	L	87.1	Confident	89.2	Confident	24 Å²	24	50.7 Å²	50.7	13%	0.126	28%	0.28	C	S	.	.	P	Polyproline II helix	trans	-62.4	141.1	176.4	-90.1	168.1	0	0	0	112.1	L840 L850 F869 M873 L879 M880 L883	L840-L844 WeakPolarHBondContact O-CB 3.25Å; L840-L844 WeakPolarHBondContact O-CD1 3.21Å; L840-L844 WeakPolarHBondContact O-CG 3.44Å; L840-L844 PolarHBondContact O-N 2.8Å; L844-L850 HydrophobicContact CD2-CD1 4.49Å; L844-F869 HydrophobicContact CD2-CE1 3.99Å; L844-F869 HydrophobicContact CD2-CZ 4.42Å; L844-M873 HydrophobicContact CD2-CB 4.27Å; L844-M873 HydrophobicContact CD2-CG 4.21Å; L844-L879 HydrophobicContact CD1-CD2 3.73Å; L844-L879 HydrophobicContact CD1-CG 4.06Å; L844-L879 HydrophobicContact CD2-CD2 3.97Å; L844-M880 HydrophobicContact CB-SD 4.5Å; L844-M880 HydrophobicContact CD1-SD 3.96Å; L844-L883 HydrophobicContact CD1-CD1 3.28Å
845	P	87.1	Confident	89.1	Confident	11 Å²	11	54.7 Å²	54.7	7%	0.071	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-62.3	161.1	170.2	-18.5	31.7	0	0	0	112.2	L798 L806 Q849 L850	L798-P845 HydrophobicContact CD1-CG 4.26Å; L798-P845 HydrophobicContact CD2-CB 3.74Å; L798-P845 HydrophobicContact CD2-CG 3.63Å; L806-P845 HydrophobicContact CD1-CG 3.96Å; P845-Q849 HydrophobicContact CB-CB 3.87Å; P845-L850 HydrophobicContact CB-CD2 4.34Å; P845-L850 HydrophobicContact CB-CG 4.23Å; P845-L850 HydrophobicContact CG-CD2 4.14Å
846	G	85.1	Confident	89	Confident	29 Å²	29	53.5 Å²	53.5	30%	0.299	29%	0.287	S	S	.	.	P	Polyproline II helix	trans	-60.5	155.5	174.9	0	0	0	0	0	112.4	E848 Q849 L850	G846-E848 PolarHBondContact O-N 3.43Å; G846-E848 VanDerWaalsContact O-N 3.17Å; G846-Q849 PolarHBondContact O-N 2.94Å; G846-L850 PolarHBondContact O-N 3.17Å
847	P	85.2	Confident	88.8	Confident	108 Å²	108	59.3 Å²	59.3	70%	0.701	31%	0.313	S	S	*	.	H	α-helix	trans	-59	-32.1	-177.5	23.9	-33.9	0	0	0	112.9	S851	P847-S851 PolarHBondContact O-N 3.12Å
848	E	86.4	Confident	88.5	Confident	164 Å²	164	66 Å²	66	77%	0.766	35%	0.348	S	S	*	.	H	α-helix	trans	-65.7	-45.9	174.2	-62.5	174.1	177.2	0	0	111.7	G846 L850 S851 V852	G846-E848 PolarHBondContact O-N 3.43Å; G846-E848 VanDerWaalsContact O-N 3.17Å; E848-L850 PolarHBondContact O-N 3.39Å; E848-S851 WeakPolarHBondContact O-CB 3.25Å; E848-S851 PolarHBondContact O-N 3.01Å; E848-V852 WeakPolarHBondContact O-CG2 3.35Å; E848-V852 PolarHBondContact O-N 3.28Å
849	Q	88.4	Confident	88.2	Confident	62 Å²	62	66.9 Å²	66.9	29%	0.29	35%	0.352	S	S	.	.	H	α-helix	trans	-65.3	-38.7	177	-63.6	175	-62.5	0	0	111.9	V797 L798 P845 G846 S851 V852 L853	V797-Q849 HydrophobicContact CG1-CB 4.43Å; L798-Q849 HydrophobicContact CD2-CB 4.49Å; P845-Q849 HydrophobicContact CB-CB 3.87Å; G846-Q849 PolarHBondContact O-N 2.94Å; Q849-S851 VanDerWaalsContact C-N 3.34Å; Q849-V852 PolarHBondContact O-N 2.94Å; Q849-L853 WeakPolarHBondContact O-CB 3.3Å; Q849-L853 WeakPolarHBondContact O-CG 3.49Å; Q849-L853 PolarHBondContact O-N 3.32Å
850	L	90.1	Very high	88.1	Confident	14 Å²	14	68 Å²	68	7%	0.073	35%	0.354	C	S	.	.	H	α-helix	trans	-64	-38.4	172.9	-72.1	174.2	0	0	0	111.7	L844 P845 G846 E848 L853 G854 M873 S874 L879	L844-L850 HydrophobicContact CD2-CD1 4.49Å; P845-L850 HydrophobicContact CB-CD2 4.34Å; P845-L850 HydrophobicContact CB-CG 4.23Å; P845-L850 HydrophobicContact CG-CD2 4.14Å; G846-L850 PolarHBondContact O-N 3.17Å; E848-L850 PolarHBondContact O-N 3.39Å; L850-L853 PolarHBondContact O-N 2.68Å; L850-G854 PolarHBondContact O-N 3.08Å; L850-M873 HydrophobicContact CD2-CB 4.37Å; L850-S874 WeakPolarHBondContact O-CB 3.28Å; L850-L879 HydrophobicContact CD1-CD2 4.04Å
851	S	88.9	Confident	87.9	Confident	70 Å²	70	74.1 Å²	74.1	49%	0.49	39%	0.386	S	S	.	.	H	α-helix	trans	-61.6	-49.4	175.2	-162.3	0	0	0	0	111.3	P847 E848 Q849 L853 G854 E855	P847-S851 PolarHBondContact O-N 3.12Å; E848-S851 WeakPolarHBondContact O-CB 3.25Å; E848-S851 PolarHBondContact O-N 3.01Å; Q849-S851 VanDerWaalsContact C-N 3.34Å; S851-L853 PolarHBondContact O-N 2.87Å; S851-G854 PolarHBondContact O-N 2.94Å; S851-G854 VanDerWaalsContact O-N 3.1Å; S851-E855 PolarHBondContact O-N 3.04Å
852	V	89.8	Confident	87.6	Confident	70 Å²	70	77.8 Å²	77.8	42%	0.424	41%	0.406	S	S	.	.	H	α-helix	trans	-59.9	-45.2	177.6	178.5	0	0	0	0	111.1	V797 E848 Q849 G854 E855 M856	V797-V852 HydrophobicContact CG1-CB 4.16Å; V797-V852 HydrophobicContact CG1-CG1 4.01Å; V797-V852 HydrophobicContact CG2-CG1 3.85Å; E848-V852 WeakPolarHBondContact O-CG2 3.35Å; E848-V852 PolarHBondContact O-N 3.28Å; Q849-V852 PolarHBondContact O-N 2.94Å; V852-G854 VanDerWaalsContact C-N 3.29Å; V852-G854 PolarHBondContact O-N 3.01Å; V852-E855 PolarHBondContact O-N 2.85Å; V852-E855 VanDerWaalsContact O-N 3.15Å; V852-M856 WeakPolarHBondContact O-CG 3.28Å; V852-M856 PolarHBondContact O-N 3.24Å
853	L	90.2	Very high	87.5	Confident	0 Å²	0	70.2 Å²	70.2	0%	0	37%	0.373	C	S	.	.	H	α-helix	trans	-61.4	-35.4	175.5	-75.1	167.2	0	0	0	112.5	V797 L798 Q849 L850 S851 E855 M856 E867 V871	V797-L853 HydrophobicContact CB-CD2 3.86Å; V797-L853 HydrophobicContact CB-CG 4.03Å; V797-L853 HydrophobicContact CG1-CD2 4.49Å; V797-L853 HydrophobicContact CG1-CG 4.11Å; V797-L853 HydrophobicContact CG2-CD2 3.75Å; V797-L853 HydrophobicContact CG2-CG 4.14Å; L798-L853 HydrophobicContact CD1-CD1 4.39Å; L798-L853 HydrophobicContact CD2-CD1 4.1Å; L798-L853 HydrophobicContact CG-CD1 4.14Å; Q849-L853 WeakPolarHBondContact O-CB 3.3Å; Q849-L853 WeakPolarHBondContact O-CG 3.49Å; Q849-L853 PolarHBondContact O-N 3.32Å; L850-L853 PolarHBondContact O-N 2.68Å; S851-L853 PolarHBondContact O-N 2.87Å; L853-E855 VanDerWaalsContact C-N 3.25Å; L853-E855 PolarHBondContact O-N 2.97Å; L853-M856 PolarHBondContact O-N 3.2Å; L853-M856 VanDerWaalsContact O-N 3.13Å; L853-E867 HydrophobicContact CD2-CB 3.86Å; L853-E867 HydrophobicContact CD2-CG 4.17Å; L853-V871 HydrophobicContact CB-CG2 4.39Å; L853-V871 WeakPolarHBondContact O-CG2 3.47Å
854	G	88.2	Confident	87.5	Confident	20 Å²	20	68.5 Å²	68.5	21%	0.206	37%	0.367	C	S	.	.	H	α-helix	trans	-62.4	-28.1	175.4	0	0	0	0	0	114.6	L850 S851 V852 S874	L850-G854 PolarHBondContact O-N 3.08Å; S851-G854 PolarHBondContact O-N 2.94Å; S851-G854 VanDerWaalsContact O-N 3.1Å; V852-G854 VanDerWaalsContact C-N 3.29Å; V852-G854 PolarHBondContact O-N 3.01Å; G854-S874 WeakPolarHBondContact CA-OG 3.31Å
855	E	90.1	Very high	87.6	Confident	146 Å²	146	71.9 Å²	71.9	68%	0.682	38%	0.382	S	S	*	.	H	α-helix	trans	-74.7	-28.9	174.9	-65.5	174.9	-170.7	0	0	111.8	S851 V852 L853 K857	S851-E855 PolarHBondContact O-N 3.04Å; V852-E855 PolarHBondContact O-N 2.85Å; V852-E855 VanDerWaalsContact O-N 3.15Å; L853-E855 VanDerWaalsContact C-N 3.25Å; L853-E855 PolarHBondContact O-N 2.97Å; E855-K857 PolarHBondContact O-N 2.79Å; E855-K857 VanDerWaalsContact O-N 3.17Å
856	M	87.4	Confident	87.7	Confident	37 Å²	37	71.3 Å²	71.3	18%	0.182	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-80.5	13.6	-178.4	-53.1	-166.1	81.3	0	0	114.9	K796 V797 V852 L853 D858 E859 L863	K796-M856 HydrophobicContact CB-CE 4.01Å; K796-M856 HydrophobicContact CB-SD 4.23Å; K796-M856 HydrophobicContact CD-CE 3.53Å; K796-M856 HydrophobicContact CG-CE 4.41Å; V797-M856 HydrophobicContact CG2-SD 3.5Å; V797-M856 WeakPolarHBondContact CG2-SD 3.28Å; V852-M856 WeakPolarHBondContact O-CG 3.28Å; V852-M856 PolarHBondContact O-N 3.24Å; L853-M856 PolarHBondContact O-N 3.2Å; L853-M856 VanDerWaalsContact O-N 3.13Å; M856-D858 PolarHBondContact O-N 2.96Å; M856-D858 VanDerWaalsContact O-N 3.11Å; M856-E859 PolarHBondContact O-N 2.81Å; M856-L863 HydrophobicContact CB-CD1 4.19Å; M856-L863 HydrophobicContact CE-CD2 4.42Å; M856-L863 HydrophobicContact SD-CD2 4.42Å
857	K	85.3	Confident	87.9	Confident	124 Å²	124	70 Å²	70	54%	0.539	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-53.4	-31.9	-177.9	75.2	-167.2	-178.6	-174.9	0	114.1	E855 E859 Y860 V871	E855-K857 PolarHBondContact O-N 2.79Å; E855-K857 VanDerWaalsContact O-N 3.17Å; K857-E859 VanDerWaalsContact C-N 3.26Å; K857-E859 PolarHBondContact O-N 3.34Å; K857-Y860 VanDerWaalsContact O-CB 3.3Å; K857-Y860 WeakPolarHBondContact O-CB 3.23Å; K857-Y860 PolarHBondContact O-N 3.36Å; K857-V871 HydrophobicContact CB-CG1 4.13Å
858	D	86.9	Confident	88.2	Confident	140 Å²	140	65.8 Å²	65.8	75%	0.749	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-81.1	-10.1	-175.5	-58.3	-47.1	0	0	0	111.7	M856	M856-D858 PolarHBondContact O-N 2.96Å; M856-D858 VanDerWaalsContact O-N 3.11Å
859	E	85.9	Confident	88.6	Confident	94 Å²	94	58 Å²	58	44%	0.439	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-106.3	14.3	172.2	-63.1	-177.1	-152.7	0	0	112.5	K796 M856 K857 D861 D862 L863	K796-E859 IonicContact NZ-OE2 2.62Å; K796-E859 PolarHBondContact NZ-OE2 3.27Å; M856-E859 PolarHBondContact O-N 2.81Å; K857-E859 VanDerWaalsContact C-N 3.26Å; K857-E859 PolarHBondContact O-N 3.34Å; E859-D861 VanDerWaalsContact C-N 3.32Å; E859-D861 PolarHBondContact O-N 3.09Å; E859-D861 VanDerWaalsContact O-N 3.15Å; E859-D862 PolarHBondContact O-N 3.48Å; E859-L863 PolarHBondContact O-N 3.47Å
860	Y	87.8	Confident	88.7	Confident	71 Å²	71	55 Å²	55	28%	0.278	29%	0.285	S	S	.	.	G	3₁₀ helix	trans	-50.4	-44.9	-169	179	-93.1	0	0	0	114.1	K857 D862 L863 Q868 V871 V872	K857-Y860 VanDerWaalsContact O-CB 3.3Å; K857-Y860 WeakPolarHBondContact O-CB 3.23Å; K857-Y860 PolarHBondContact O-N 3.36Å; Y860-D862 PolarHBondContact O-N 3.4Å; Y860-L863 PolarHBondContact O-N 2.99Å; Y860-Q868 HydrophobicContact CD2-CB 4.32Å; Y860-Q868 HydrophobicContact CD2-CG 4.15Å; Y860-Q868 HydrophobicContact CE1-CG 4.25Å; Y860-Q868 HydrophobicContact CE2-CB 3.64Å; Y860-Q868 HydrophobicContact CE2-CG 3.87Å; Y860-Q868 WeakPolarHBondContact CE2-O 3.31Å; Y860-Q868 HydrophobicContact CG-CG 4.47Å; Y860-Q868 WeakPolarHBondContact O-CG 3.27Å; Y860-Q868 PolarHBondContact O-NE2 3.12Å; Y860-V871 HydrophobicContact CD2-CB 4.06Å; Y860-V871 HydrophobicContact CD2-CG1 4.07Å; Y860-V871 HydrophobicContact CD2-CG2 4.25Å; Y860-V871 HydrophobicContact CE2-CB 4.31Å; Y860-V872 HydrophobicContact CE2-CG2 4.02Å
861	D	86.4	Confident	88.8	Confident	130 Å²	130	54.6 Å²	54.6	70%	0.695	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-70.1	-13.1	-178.4	-78.4	-40.4	0	0	0	114.2	K793 E859	K793-D861 WeakPolarHBondContact CE-O 2.97Å; K793-D861 PolarHBondContact NZ-O 3.28Å; E859-D861 VanDerWaalsContact C-N 3.32Å; E859-D861 PolarHBondContact O-N 3.09Å; E859-D861 VanDerWaalsContact O-N 3.15Å
862	D	85.1	Confident	89	Confident	114 Å²	114	51.6 Å²	51.6	61%	0.61	26%	0.262	S	S	*	.	G	3₁₀ helix	trans	-96.8	-8.9	174.6	-72.7	-46.4	0	0	0	113.7	E859 Y860	E859-D862 PolarHBondContact O-N 3.48Å; Y860-D862 PolarHBondContact O-N 3.4Å
863	L	88.2	Confident	89.2	Confident	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.242	C	C	.	.	S	Bend	trans	-80.4	151.7	178.2	-65.9	175.8	0	0	0	113.3	K793 K796 M856 E859 Y860 E867 Q868 V871	K793-L863 WeakPolarHBondContact CD-O 3.26Å; K793-L863 WeakPolarHBondContact CE-O 3.39Å; K793-L863 PolarHBondContact NZ-O 2.75Å; K796-L863 HydrophobicContact CB-CD2 4.33Å; K796-L863 HydrophobicContact CD-CD2 3.7Å; K796-L863 HydrophobicContact CG-CD2 4.16Å; M856-L863 HydrophobicContact CB-CD1 4.19Å; M856-L863 HydrophobicContact CE-CD2 4.42Å; M856-L863 HydrophobicContact SD-CD2 4.42Å; E859-L863 PolarHBondContact O-N 3.47Å; Y860-L863 PolarHBondContact O-N 2.99Å; L863-E867 HydrophobicContact CB-CB 4.11Å; L863-Q868 HydrophobicContact CB-CG 3.89Å; L863-Q868 PolarHBondContact O-NE2 2.95Å; L863-V871 HydrophobicContact CD1-CG2 3.48Å; L863-V871 VanDerWaalsContact CD1-CG2 3.48Å
864	A	88.4	Confident	89.3	Confident	11 Å²	11	50 Å²	50	9%	0.091	25%	0.254	C	S	.	.			trans	-64.5	155.9	173.1	0	0	0	0	0	112.5	K793 L795 S866 E867 Q868	K793-A864 HydrophobicContact CB-CB 4.47Å; L795-A864 HydrophobicContact CD2-CB 3.48Å; L795-A864 VanDerWaalsContact CD2-CB 3.48Å; A864-S866 VanDerWaalsContact C-N 3.25Å; A864-S866 PolarHBondContact O-N 3.35Å; A864-E867 HydrophobicContact CB-CG 4.48Å; A864-E867 CarbonylContact O-C 3.59Å; A864-E867 WeakPolarHBondContact O-CA 3.45Å; A864-E867 PolarHBondContact O-N 3.11Å; A864-Q868 WeakPolarHBondContact O-CG 3.41Å; A864-Q868 PolarHBondContact O-N 2.82Å
865	E	88	Confident	89.3	Confident	94 Å²	94	53.5 Å²	53.5	44%	0.439	27%	0.268	S	S	.	.	H	α-helix	trans	-58.8	-33.4	-174.6	-71.2	174.4	-160.2	0	0	113.3	K790 Y817 F869	K790-E865 IonicContact NZ-OE1 2.74Å; K790-E865 PolarHBondContact NZ-OE1 3.44Å; Y817-E865 PolarHBondContact OH-O 3.1Å; E865-F869 PolarHBondContact O-N 3.27Å
866	S	88.9	Confident	89.4	Confident	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-68.9	-34.7	172	47.1	0	0	0	0	113.9	S803 A864 G870	S803-S866 WeakPolarHBondContact O-CB 3.2Å; S803-S866 PolarHBondContact OG-OG 3.2Å; A864-S866 VanDerWaalsContact C-N 3.25Å; A864-S866 PolarHBondContact O-N 3.35Å; S866-G870 PolarHBondContact O-N 3.17Å
867	E	91.3	Very high	89.5	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.254	C	S	.	.	H	α-helix	trans	-79.8	-41	178.8	-67.8	-174	141.3	0	0	110.9	L795 K796 V797 L798 L853 L863 A864 F869 G870 V871	L795-E867 HydrophobicContact CD2-CG 4.42Å; K796-E867 PolarHBondContact N-OE1 2.96Å; K796-E867 PolarHBondContact N-OE2 3.2Å; V797-E867 PolarHBondContact N-OE1 3.31Å; L798-E867 HydrophobicContact CB-CG 4.15Å; L798-E867 HydrophobicContact CD1-CG 3.79Å; L798-E867 HydrophobicContact CG-CG 3.88Å; L798-E867 PolarHBondContact N-OE1 3.36Å; L853-E867 HydrophobicContact CD2-CB 3.86Å; L853-E867 HydrophobicContact CD2-CG 4.17Å; L863-E867 HydrophobicContact CB-CB 4.11Å; A864-E867 HydrophobicContact CB-CG 4.48Å; A864-E867 CarbonylContact O-C 3.59Å; A864-E867 WeakPolarHBondContact O-CA 3.45Å; A864-E867 PolarHBondContact O-N 3.11Å; E867-F869 VanDerWaalsContact C-N 3.3Å; E867-F869 PolarHBondContact O-N 3.23Å; E867-G870 CarbonylContact O-C 3.53Å; E867-G870 WeakPolarHBondContact O-CA 3.43Å; E867-G870 PolarHBondContact O-N 3.29Å; E867-V871 WeakPolarHBondContact O-CG2 3.44Å; E867-V871 PolarHBondContact O-N 3.21Å
868	Q	91.4	Very high	89.8	Confident	20 Å²	20	49 Å²	49	9%	0.093	24%	0.243	C	C	.	.	H	α-helix	trans	-53.7	-44.8	170.4	-74	-174.3	-22.7	0	0	111.8	Y817 Y860 L863 A864 G870 V871 V872	Y817-Q868 HydrophobicContact CD2-CB 4.31Å; Y817-Q868 HydrophobicContact CE2-CB 3.86Å; Y860-Q868 HydrophobicContact CD2-CB 4.32Å; Y860-Q868 HydrophobicContact CD2-CG 4.15Å; Y860-Q868 HydrophobicContact CE1-CG 4.25Å; Y860-Q868 HydrophobicContact CE2-CB 3.64Å; Y860-Q868 HydrophobicContact CE2-CG 3.87Å; Y860-Q868 WeakPolarHBondContact CE2-O 3.31Å; Y860-Q868 HydrophobicContact CG-CG 4.47Å; Y860-Q868 WeakPolarHBondContact O-CG 3.27Å; Y860-Q868 PolarHBondContact O-NE2 3.12Å; L863-Q868 HydrophobicContact CB-CG 3.89Å; L863-Q868 PolarHBondContact O-NE2 2.95Å; A864-Q868 WeakPolarHBondContact O-CG 3.41Å; A864-Q868 PolarHBondContact O-N 2.82Å; Q868-G870 VanDerWaalsContact C-N 3.32Å; Q868-G870 PolarHBondContact O-N 2.85Å; Q868-V871 PolarHBondContact O-N 3.49Å; Q868-V872 PolarHBondContact O-N 3.39Å; Q868-V872 VanDerWaalsContact O-N 3.11Å
869	F	92.9	Very high	90	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-58.6	-42.1	171.6	170.6	-101.7	0	0	0	112.4	L806 L810 Y817 I820 L840 L844 E865 E867 V872 M873	L806-F869 HydrophobicContact CD2-CD1 3.95Å; L806-F869 HydrophobicContact CD2-CE1 3.76Å; L810-F869 HydrophobicContact CD1-CB 3.54Å; L810-F869 HydrophobicContact CD1-CD1 4.21Å; L810-F869 HydrophobicContact CD1-CD2 4.29Å; L810-F869 HydrophobicContact CD1-CG 3.77Å; L810-F869 HydrophobicContact CD2-CB 4.34Å; L810-F869 HydrophobicContact CD2-CD1 4.38Å; L810-F869 HydrophobicContact CD2-CD2 3.5Å; L810-F869 VanDerWaalsContact CD2-CD2 3.5Å; L810-F869 HydrophobicContact CD2-CE2 3.78Å; L810-F869 HydrophobicContact CD2-CG 3.82Å; L810-F869 HydrophobicContact CD2-CZ 4.34Å; L810-F869 HydrophobicContact CG-CG 4.38Å; Y817-F869 HydrophobicContact CD1-CB 4.17Å; Y817-F869 AromaticContact CD1-CD2 3.88Å; Y817-F869 HydrophobicContact CD1-CD2 3.88Å; Y817-F869 HydrophobicContact CD2-CB 4.17Å; Y817-F869 HydrophobicContact CE1-CB 4.3Å; Y817-F869 HydrophobicContact CE2-CB 4.29Å; Y817-F869 HydrophobicContact CG-CB 4.12Å; Y817-F869 HydrophobicContact CG-CD2 4.1Å; I820-F869 HydrophobicContact CD1-CE2 4.07Å; I820-F869 HydrophobicContact CG2-CE2 4.42Å; L840-F869 HydrophobicContact CD2-CE2 4.43Å; L840-F869 HydrophobicContact CD2-CZ 3.73Å; L844-F869 HydrophobicContact CD2-CE1 3.99Å; L844-F869 HydrophobicContact CD2-CZ 4.42Å; E865-F869 PolarHBondContact O-N 3.27Å; E867-F869 VanDerWaalsContact C-N 3.3Å; E867-F869 PolarHBondContact O-N 3.23Å; F869-V872 PolarHBondContact O-N 2.88Å; F869-M873 HydrophobicContact CD1-CG 4.21Å; F869-M873 HydrophobicContact CD2-CE 4.22Å; F869-M873 HydrophobicContact CD2-CG 4.06Å; F869-M873 HydrophobicContact CE1-CG 3.79Å; F869-M873 HydrophobicContact CE2-CE 3.7Å; F869-M873 HydrophobicContact CE2-CG 3.64Å; F869-M873 HydrophobicContact CE2-SD 3.95Å; F869-M873 HydrophobicContact CG-CG 4.34Å; F869-M873 HydrophobicContact CZ-CE 4.35Å; F869-M873 HydrophobicContact CZ-CG 3.49Å; F869-M873 VanDerWaalsContact CZ-CG 3.49Å; F869-M873 HydrophobicContact CZ-SD 3.97Å; F869-M873 WeakPolarHBondContact O-CB 3.3Å; F869-M873 VanDerWaalsContact O-CG 3.29Å; F869-M873 WeakPolarHBondContact O-CG 3.37Å; F869-M873 PolarHBondContact O-N 3.01Å
870	G	91.8	Very high	90.3	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.6	-39.6	175.2	0	0	0	0	0	114	S866 E867 Q868 V872 M873 S874	S866-G870 PolarHBondContact O-N 3.17Å; E867-G870 CarbonylContact O-C 3.53Å; E867-G870 WeakPolarHBondContact O-CA 3.43Å; E867-G870 PolarHBondContact O-N 3.29Å; Q868-G870 VanDerWaalsContact C-N 3.32Å; Q868-G870 PolarHBondContact O-N 2.85Å; G870-V872 VanDerWaalsContact C-N 3.33Å; G870-V872 PolarHBondContact O-N 3.35Å; G870-M873 PolarHBondContact O-N 3.17Å; G870-S874 WeakPolarHBondContact O-CB 3.38Å; G870-S874 PolarHBondContact O-N 3.33Å
871	V	92.5	Very high	90.4	Very high	6 Å²	6	39.3 Å²	39.3	4%	0.036	20%	0.199	C	C	.	.	H	α-helix	trans	-60	-43.3	172.3	-175.9	0	0	0	0	110.8	L853 K857 Y860 L863 E867 Q868 S874 N875	L853-V871 HydrophobicContact CB-CG2 4.39Å; L853-V871 WeakPolarHBondContact O-CG2 3.47Å; K857-V871 HydrophobicContact CB-CG1 4.13Å; Y860-V871 HydrophobicContact CD2-CB 4.06Å; Y860-V871 HydrophobicContact CD2-CG1 4.07Å; Y860-V871 HydrophobicContact CD2-CG2 4.25Å; Y860-V871 HydrophobicContact CE2-CB 4.31Å; L863-V871 HydrophobicContact CD1-CG2 3.48Å; L863-V871 VanDerWaalsContact CD1-CG2 3.48Å; E867-V871 WeakPolarHBondContact O-CG2 3.44Å; E867-V871 PolarHBondContact O-N 3.21Å; Q868-V871 PolarHBondContact O-N 3.49Å; V871-S874 PolarHBondContact O-OG 3.02Å; V871-N875 PolarHBondContact O-ND2 3.36Å
872	V	92.8	Very high	90.8	Very high	7 Å²	7	33.2 Å²	33.2	4%	0.042	17%	0.166	C	C	.	.	H	α-helix	trans	-69.2	-41.2	179.3	176	0	0	0	0	111	Y817 E818 K821 Y860 Q868 F869 G870 N875	Y817-V872 WeakPolarHBondContact O-CG1 3.34Å; E818-V872 HydrophobicContact CG-CG1 4.23Å; E818-V872 WeakPolarHBondContact OE1-CG1 3.24Å; K821-V872 HydrophobicContact CB-CG1 3.98Å; K821-V872 HydrophobicContact CD-CG1 3.61Å; K821-V872 HydrophobicContact CG-CG1 4.48Å; Y860-V872 HydrophobicContact CE2-CG2 4.02Å; Q868-V872 PolarHBondContact O-N 3.39Å; Q868-V872 VanDerWaalsContact O-N 3.11Å; F869-V872 PolarHBondContact O-N 2.88Å; G870-V872 VanDerWaalsContact C-N 3.33Å; G870-V872 PolarHBondContact O-N 3.35Å; V872-N875 PolarHBondContact O-N 3.35Å
873	M	93.3	Very high	91.2	Very high	1 Å²	1	27.8 Å²	27.8	1%	0.005	14%	0.137	C	C	.	.	H	α-helix	trans	-69.9	-31.1	179.4	-69.7	-62.3	118.9	0	0	113.8	Y817 I820 K821 I824 L844 L850 F869 G870 N875 V876 L879	Y817-M873 WeakPolarHBondContact O-CE 3.3Å; I820-M873 HydrophobicContact CB-CE 4.04Å; I820-M873 HydrophobicContact CG2-CE 3.89Å; K821-M873 HydrophobicContact CB-CE 3.85Å; I824-M873 HydrophobicContact CD1-SD 3.98Å; L844-M873 HydrophobicContact CD2-CB 4.27Å; L844-M873 HydrophobicContact CD2-CG 4.21Å; L850-M873 HydrophobicContact CD2-CB 4.37Å; F869-M873 HydrophobicContact CD1-CG 4.21Å; F869-M873 HydrophobicContact CD2-CE 4.22Å; F869-M873 HydrophobicContact CD2-CG 4.06Å; F869-M873 HydrophobicContact CE1-CG 3.79Å; F869-M873 HydrophobicContact CE2-CE 3.7Å; F869-M873 HydrophobicContact CE2-CG 3.64Å; F869-M873 HydrophobicContact CE2-SD 3.95Å; F869-M873 HydrophobicContact CG-CG 4.34Å; F869-M873 HydrophobicContact CZ-CE 4.35Å; F869-M873 HydrophobicContact CZ-CG 3.49Å; F869-M873 VanDerWaalsContact CZ-CG 3.49Å; F869-M873 HydrophobicContact CZ-SD 3.97Å; F869-M873 WeakPolarHBondContact O-CB 3.3Å; F869-M873 VanDerWaalsContact O-CG 3.29Å; F869-M873 WeakPolarHBondContact O-CG 3.37Å; F869-M873 PolarHBondContact O-N 3.01Å; G870-M873 PolarHBondContact O-N 3.17Å; M873-N875 PolarHBondContact O-N 3.13Å; M873-V876 WeakPolarHBondContact O-CB 3.32Å; M873-V876 PolarHBondContact O-N 2.75Å; M873-L879 HydrophobicContact CB-CD2 3.94Å
874	S	91.8	Very high	91.5	Very high	34 Å²	34	32.6 Å²	32.6	24%	0.238	16%	0.16	C	C	.	.	H	α-helix	trans	-63.8	-23.9	178.6	70.5	0	0	0	0	113.4	L850 G854 G870 V871 V876	L850-S874 WeakPolarHBondContact O-CB 3.28Å; G854-S874 WeakPolarHBondContact CA-OG 3.31Å; G870-S874 WeakPolarHBondContact O-CB 3.38Å; G870-S874 PolarHBondContact O-N 3.33Å; V871-S874 PolarHBondContact O-OG 3.02Å; S874-V876 PolarHBondContact O-N 3.14Å; S874-V876 VanDerWaalsContact O-N 3.15Å
875	N	90	Very high	91.8	Very high	94 Å²	94	32.4 Å²	32.4	50%	0.503	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	0.9	173.7	-74.8	-85.5	0	0	0	114.1	V871 V872 M873	V871-N875 PolarHBondContact O-ND2 3.36Å; V872-N875 PolarHBondContact O-N 3.35Å; M873-N875 PolarHBondContact O-N 3.13Å
876	V	91.8	Very high	92.2	Very high	5 Å²	5	28 Å²	28	3%	0.03	14%	0.138	C	C	.	.	S	Bend	trans	-102.9	98.6	177.2	-176.7	0	0	0	0	110.6	K821 I824 L825 M873 S874 R878 L879	K821-V876 HydrophobicContact CD-CG2 4.47Å; K821-V876 HydrophobicContact CG-CG2 3.88Å; I824-V876 HydrophobicContact CG2-CG1 4.32Å; L825-V876 HydrophobicContact CD2-CG1 4.09Å; M873-V876 WeakPolarHBondContact O-CB 3.32Å; M873-V876 PolarHBondContact O-N 2.75Å; S874-V876 PolarHBondContact O-N 3.14Å; S874-V876 VanDerWaalsContact O-N 3.15Å; V876-R878 PolarHBondContact O-N 2.88Å; V876-L879 HydrophobicContact CB-CB 4.3Å; V876-L879 HydrophobicContact CB-CD1 4.07Å; V876-L879 HydrophobicContact CG1-CB 4.26Å; V876-L879 HydrophobicContact CG1-CD1 3.9Å; V876-L879 WeakPolarHBondContact O-CB 3.49Å; V876-L879 PolarHBondContact O-N 2.82Å
877	K	89.9	Confident	92.5	Very high	124 Å²	124	30 Å²	30	54%	0.539	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-56.8	135.3	174.3	-67.5	170.1	-154.9	173.6	0	111	L879 R882 Q1026	K877-L879 VanDerWaalsContact C-N 3.31Å; K877-L879 PolarHBondContact O-N 3.24Å; K877-R882 PolarHBondContact O-NE 3.17Å; K877-Q1026 HydrophobicContact CD-CG 3.86Å; K877-Q1026 HydrophobicContact CG-CG 4.43Å
878	R	90.4	Very high	92.7	Very high	84 Å²	84	30.2 Å²	30.2	32%	0.317	15%	0.148	S	C	.	.	T	Hydrogen-bonded Turn	trans	58	36.4	-179.1	-60.3	-99	-85.3	145.2	1.9	113.2	V876 M880 P881 R882 D1018 F1022 P1023	V876-R878 PolarHBondContact O-N 2.88Å; R878-M880 PolarHBondContact O-N 3.49Å; R878-P881 HydrophobicContact CB-CG 4.38Å; R878-P881 VanDerWaalsContact O-CD 3.3Å; R878-P881 WeakPolarHBondContact O-CD 3.44Å; R878-R882 WeakPolarHBondContact O-CG 3.29Å; R878-R882 PolarHBondContact O-N 3.32Å; R878-D1018 IonicContact CZ-OD1 3.58Å; R878-D1018 VanDerWaalsContact CZ-OD1 3.28Å; R878-D1018 IonicContact NH1-OD1 2.71Å; R878-D1018 PolarHBondContact NH1-OD1 2.99Å; R878-D1018 PolarHBondContact NH2-O 3.19Å; R878-D1018 IonicContact NH2-OD1 3.13Å; R878-D1018 PolarHBondContact NH2-OD1 3.02Å; R878-F1022 HydrophobicContact CB-CE2 3.76Å; R878-F1022 HydrophobicContact CB-CZ 3.76Å; R878-F1022 HydrophobicContact CG-CE2 4.29Å; R878-F1022 HydrophobicContact CG-CZ 4.45Å; R878-P1023 HydrophobicContact CG-CG 4.34Å
879	L	91.7	Very high	92.9	Very high	10 Å²	10	31.1 Å²	31.1	5%	0.052	15%	0.151	C	C	.	.	H	α-helix	trans	-47.2	-49.7	-179.2	179.6	61.1	0	0	0	114.8	I824 L844 L850 M873 V876 K877 R882 L883	I824-L879 HydrophobicContact CD1-CD1 4.25Å; I824-L879 HydrophobicContact CG2-CD1 4.27Å; L844-L879 HydrophobicContact CD1-CD2 3.73Å; L844-L879 HydrophobicContact CD1-CG 4.06Å; L844-L879 HydrophobicContact CD2-CD2 3.97Å; L850-L879 HydrophobicContact CD1-CD2 4.04Å; M873-L879 HydrophobicContact CB-CD2 3.94Å; V876-L879 HydrophobicContact CB-CB 4.3Å; V876-L879 HydrophobicContact CB-CD1 4.07Å; V876-L879 HydrophobicContact CG1-CB 4.26Å; V876-L879 HydrophobicContact CG1-CD1 3.9Å; V876-L879 WeakPolarHBondContact O-CB 3.49Å; V876-L879 PolarHBondContact O-N 2.82Å; K877-L879 VanDerWaalsContact C-N 3.31Å; K877-L879 PolarHBondContact O-N 3.24Å; L879-R882 WeakPolarHBondContact O-CB 3.45Å; L879-R882 PolarHBondContact O-N 2.96Å; L879-L883 HydrophobicContact CD1-CD1 3.78Å; L879-L883 HydrophobicContact CD1-CG 4.1Å; L879-L883 HydrophobicContact CG-CD1 3.98Å; L879-L883 WeakPolarHBondContact O-CG 3.34Å; L879-L883 PolarHBondContact O-N 3.14Å
880	M	91	Very high	93	Very high	66 Å²	66	33.2 Å²	33.2	33%	0.325	16%	0.163	S	C	.	.	H	α-helix	trans	-65.2	-50.8	-177.8	-71.3	-62.4	-71.2	0	0	112.9	I841 L844 R878 R882 L883 Q884	I841-M880 HydrophobicContact CG2-CE 4.04Å; L844-M880 HydrophobicContact CB-SD 4.5Å; L844-M880 HydrophobicContact CD1-SD 3.96Å; R878-M880 PolarHBondContact O-N 3.49Å; M880-R882 VanDerWaalsContact C-N 3.27Å; M880-R882 PolarHBondContact O-N 3.24Å; M880-L883 PolarHBondContact O-N 3.04Å; M880-Q884 WeakPolarHBondContact O-CB 3.42Å; M880-Q884 WeakPolarHBondContact O-CG 3.37Å; M880-Q884 PolarHBondContact O-N 2.61Å; M880-Q884 PolarHBondContact O-OE1 3.45Å
881	P	91.3	Very high	93.1	Very high	26 Å²	26	34.6 Å²	34.6	17%	0.169	17%	0.169	C	C	.	.	H	α-helix	trans	-52.3	-39.9	168.8	-29.9	33.7	0	0	0	114.2	R878 Q884 A885	R878-P881 HydrophobicContact CB-CG 4.38Å; R878-P881 VanDerWaalsContact O-CD 3.3Å; R878-P881 WeakPolarHBondContact O-CD 3.44Å; P881-Q884 PolarHBondContact O-N 3.33Å; P881-A885 VanDerWaalsContact O-CB 3.3Å; P881-A885 WeakPolarHBondContact O-CB 3.48Å; P881-A885 PolarHBondContact O-N 2.88Å
882	R	93.9	Very high	93.3	Very high	1 Å²	1	34.4 Å²	34.4	0%	0.004	17%	0.168	C	C	.	.	H	α-helix	trans	-60.8	-51.1	175.8	-69.9	170.5	177.5	-94.2	0.1	111.8	I824 K877 R878 L879 M880 Q884 A885 I886 F1022 D1030 F1032	I824-R882 HydrophobicContact CG2-CB 4.33Å; K877-R882 PolarHBondContact O-NE 3.17Å; R878-R882 WeakPolarHBondContact O-CG 3.29Å; R878-R882 PolarHBondContact O-N 3.32Å; L879-R882 WeakPolarHBondContact O-CB 3.45Å; L879-R882 PolarHBondContact O-N 2.96Å; M880-R882 VanDerWaalsContact C-N 3.27Å; M880-R882 PolarHBondContact O-N 3.24Å; R882-Q884 VanDerWaalsContact C-N 3.35Å; R882-Q884 PolarHBondContact O-N 2.97Å; R882-A885 PolarHBondContact O-N 3.28Å; R882-I886 WeakPolarHBondContact O-CB 3.24Å; R882-I886 WeakPolarHBondContact O-CD1 3.44Å; R882-I886 WeakPolarHBondContact O-CG1 3.4Å; R882-I886 PolarHBondContact O-N 3.17Å; R882-F1022 HydrophobicContact CG-CE2 4.42Å; R882-F1022 HydrophobicContact CG-CZ 3.72Å; R882-D1030 IonicContact CZ-OD1 3.28Å; R882-D1030 IonicContact CZ-OD2 2.78Å; R882-D1030 IonicContact NH1-OD1 2.69Å; R882-D1030 PolarHBondContact NH1-OD1 3.31Å; R882-D1030 IonicContact NH2-OD1 3.86Å; R882-D1030 PolarHBondContact NH2-OD1 2.9Å; R882-D1030 IonicContact NH2-OD2 2.68Å; R882-D1030 PolarHBondContact NH2-OD2 3.43Å; R882-F1032 HydrophobicContact CB-CD2 4.17Å; R882-F1032 HydrophobicContact CB-CE2 3.81Å; R882-F1032 HydrophobicContact CB-CZ 4.24Å; R882-F1032 HydrophobicContact CG-CD1 4.32Å; R882-F1032 HydrophobicContact CG-CD2 3.91Å; R882-F1032 HydrophobicContact CG-CE1 4.22Å; R882-F1032 HydrophobicContact CG-CE2 3.8Å; R882-F1032 HydrophobicContact CG-CG 4.17Å; R882-F1032 HydrophobicContact CG-CZ 3.96Å
883	L	94.4	Very high	93.3	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-65	-39.5	-178.6	-70.4	169.1	0	0	0	111.7	I824 V837 L840 I841 L844 L879 M880 I886 Q887	I824-L883 HydrophobicContact CD1-CD2 3.93Å; I824-L883 HydrophobicContact CG1-CD2 3.97Å; I824-L883 HydrophobicContact CG2-CD2 4.48Å; V837-L883 HydrophobicContact CG1-CB 4.31Å; V837-L883 HydrophobicContact CG1-CD2 4.12Å; V837-L883 VanDerWaalsContact CG1-O 3.3Å; V837-L883 WeakPolarHBondContact CG1-O 3.34Å; L840-L883 HydrophobicContact CB-CD1 4.11Å; L840-L883 HydrophobicContact CB-CD2 4.29Å; L840-L883 HydrophobicContact CD1-CD2 3.93Å; I841-L883 HydrophobicContact CD1-CB 4.04Å; I841-L883 HydrophobicContact CG1-CB 3.64Å; I841-L883 HydrophobicContact CG1-CD1 4.47Å; L844-L883 HydrophobicContact CD1-CD1 3.28Å; L879-L883 HydrophobicContact CD1-CD1 3.78Å; L879-L883 HydrophobicContact CD1-CG 4.1Å; L879-L883 HydrophobicContact CG-CD1 3.98Å; L879-L883 WeakPolarHBondContact O-CG 3.34Å; L879-L883 PolarHBondContact O-N 3.14Å; M880-L883 PolarHBondContact O-N 3.04Å; L883-I886 PolarHBondContact O-N 3.4Å; L883-Q887 WeakPolarHBondContact O-CB 3.39Å; L883-Q887 PolarHBondContact O-N 3.12Å
884	Q	93.9	Very high	93.2	Very high	102 Å²	102	45.3 Å²	45.3	48%	0.477	22%	0.218	S	C	.	.	H	α-helix	trans	-64	-41	175.6	-71.3	171.2	-41	0	0	112.1	I841 M880 P881 R882 Q887 F888	I841-Q884 HydrophobicContact CD1-CG 4.25Å; M880-Q884 WeakPolarHBondContact O-CB 3.42Å; M880-Q884 WeakPolarHBondContact O-CG 3.37Å; M880-Q884 PolarHBondContact O-N 2.61Å; M880-Q884 PolarHBondContact O-OE1 3.45Å; P881-Q884 PolarHBondContact O-N 3.33Å; R882-Q884 VanDerWaalsContact C-N 3.35Å; R882-Q884 PolarHBondContact O-N 2.97Å; Q884-Q887 PolarHBondContact O-N 3.49Å; Q884-F888 WeakPolarHBondContact O-CB 3.39Å; Q884-F888 PolarHBondContact O-N 3.22Å
885	A	94.9	Very high	93.2	Very high	6 Å²	6	45.5 Å²	45.5	5%	0.05	22%	0.215	C	C	.	.	H	α-helix	trans	-64.9	-41.7	173.4	0	0	0	0	0	112.5	P881 R882 F888 K889 L1015 F1032 M1036	P881-A885 VanDerWaalsContact O-CB 3.3Å; P881-A885 WeakPolarHBondContact O-CB 3.48Å; P881-A885 PolarHBondContact O-N 2.88Å; R882-A885 PolarHBondContact O-N 3.28Å; A885-F888 PolarHBondContact O-N 3.11Å; A885-K889 WeakPolarHBondContact O-CB 3.29Å; A885-K889 PolarHBondContact O-N 2.79Å; A885-L1015 HydrophobicContact CB-CD1 3.58Å; A885-F1032 HydrophobicContact CB-CE2 3.92Å; A885-F1032 HydrophobicContact CB-CZ 3.7Å; A885-M1036 HydrophobicContact CB-CE 4.05Å; A885-M1036 HydrophobicContact CB-SD 4.3Å
886	I	95.9	Very high	93.3	Very high	2 Å²	2	41.7 Å²	41.7	1%	0.01	20%	0.195	C	C	.	.	H	α-helix	trans	-66.3	-42.9	176.4	-64.1	163.8	0	0	0	110.7	I824 V827 L832 V837 R882 L883 F888 K889 L890 F1032 M1036	I824-I886 HydrophobicContact CG2-CD1 4.21Å; V827-I886 HydrophobicContact CG1-CG1 4.18Å; V827-I886 HydrophobicContact CG2-CD1 4.2Å; V827-I886 HydrophobicContact CG2-CG1 4.17Å; L832-I886 HydrophobicContact CB-CG2 4.49Å; L832-I886 HydrophobicContact CD1-CD1 3.99Å; L832-I886 HydrophobicContact CD1-CG2 3.94Å; V837-I886 HydrophobicContact CG1-CB 4.48Å; V837-I886 HydrophobicContact CG1-CG2 4.41Å; V837-I886 HydrophobicContact CG2-CG2 3.99Å; R882-I886 WeakPolarHBondContact O-CB 3.24Å; R882-I886 WeakPolarHBondContact O-CD1 3.44Å; R882-I886 WeakPolarHBondContact O-CG1 3.4Å; R882-I886 PolarHBondContact O-N 3.17Å; L883-I886 PolarHBondContact O-N 3.4Å; I886-F888 PolarHBondContact O-N 2.88Å; I886-K889 PolarHBondContact O-N 3.31Å; I886-L890 HydrophobicContact CG2-CD1 3.83Å; I886-L890 HydrophobicContact CG2-CG 4.32Å; I886-L890 VanDerWaalsContact O-CG 3.29Å; I886-L890 WeakPolarHBondContact O-CG 3.23Å; I886-L890 PolarHBondContact O-N 2.85Å; I886-F1032 HydrophobicContact CG1-CE2 4.36Å; I886-M1036 HydrophobicContact CB-CE 4.17Å; I886-M1036 HydrophobicContact CG1-CE 3.48Å; I886-M1036 VanDerWaalsContact CG1-CE 3.48Å
887	Q	95.3	Very high	93.3	Very high	41 Å²	41	46.2 Å²	46.2	19%	0.192	22%	0.219	C	C	.	.	H	α-helix	trans	-57.5	-49.9	174.6	-172.5	-167.3	-9.6	0	0	110.4	V837 Q838 I841 L883 Q884 K889 L890 Q891	V837-Q887 HydrophobicContact CG1-CB 3.87Å; Q838-Q887 HydrophobicContact CG-CG 4.45Å; I841-Q887 HydrophobicContact CD1-CB 3.95Å; I841-Q887 HydrophobicContact CD1-CG 4.44Å; L883-Q887 WeakPolarHBondContact O-CB 3.39Å; L883-Q887 PolarHBondContact O-N 3.12Å; Q884-Q887 PolarHBondContact O-N 3.49Å; Q887-K889 PolarHBondContact O-N 2.77Å; Q887-L890 PolarHBondContact O-N 3.26Å; Q887-Q891 HydrophobicContact CG-CG 4.44Å; Q887-Q891 WeakPolarHBondContact O-CB 3.27Å; Q887-Q891 WeakPolarHBondContact O-CG 3.1Å; Q887-Q891 PolarHBondContact O-N 3.27Å
888	F	96	Very high	93.3	Very high	5 Å²	5	44.8 Å²	44.8	2%	0.022	22%	0.217	C	C	.	.	H	α-helix	trans	-59.9	-44.7	178.4	176.2	-125	0	0	0	111.8	Q884 A885 I886 L890 Q891 F892 M1008 Q1011 I1012 L1015 F1039	Q884-F888 WeakPolarHBondContact O-CB 3.39Å; Q884-F888 PolarHBondContact O-N 3.22Å; A885-F888 PolarHBondContact O-N 3.11Å; I886-F888 PolarHBondContact O-N 2.88Å; F888-L890 VanDerWaalsContact C-N 3.33Å; F888-L890 PolarHBondContact O-N 3.14Å; F888-Q891 PolarHBondContact O-N 3.38Å; F888-F892 HydrophobicContact CE1-CD2 4.42Å; F888-F892 AromaticContact CE2-CD2 3.78Å; F888-F892 HydrophobicContact CE2-CD2 3.78Å; F888-F892 AromaticContact CZ-CD2 3.53Å; F888-F892 HydrophobicContact CZ-CD2 3.53Å; F888-F892 HydrophobicContact CZ-CE2 4.07Å; F888-F892 WeakPolarHBondContact O-CB 3.48Å; F888-F892 PolarHBondContact O-N 3.44Å; F888-M1008 HydrophobicContact CE2-CG 4.45Å; F888-M1008 HydrophobicContact CZ-CG 4.46Å; F888-Q1011 HydrophobicContact CD1-CB 4.12Å; F888-Q1011 HydrophobicContact CD2-CB 3.67Å; F888-Q1011 HydrophobicContact CD2-CG 4.19Å; F888-Q1011 HydrophobicContact CE1-CB 4.13Å; F888-Q1011 HydrophobicContact CE2-CB 3.66Å; F888-Q1011 HydrophobicContact CE2-CG 4.46Å; F888-Q1011 HydrophobicContact CG-CB 3.92Å; F888-Q1011 HydrophobicContact CZ-CB 3.92Å; F888-I1012 HydrophobicContact CE1-CG1 3.72Å; F888-I1012 HydrophobicContact CZ-CD1 4.36Å; F888-I1012 HydrophobicContact CZ-CG1 3.53Å; F888-L1015 HydrophobicContact CD1-CD2 4.32Å; F888-F1039 AromaticContact CD1-CE1 3.73Å; F888-F1039 HydrophobicContact CD1-CE1 3.73Å; F888-F1039 AromaticContact CD1-CZ 3.99Å; F888-F1039 HydrophobicContact CD1-CZ 3.99Å; F888-F1039 AromaticContact CE1-CE1 3.79Å; F888-F1039 HydrophobicContact CE1-CE1 3.79Å; F888-F1039 AromaticContact CE1-CZ 3.82Å; F888-F1039 HydrophobicContact CE1-CZ 3.82Å; F888-F1039 HydrophobicContact CZ-CZ 4.42Å
889	K	95.8	Very high	93.5	Very high	39 Å²	39	41 Å²	41	17%	0.17	20%	0.203	C	C	.	.	H	α-helix	trans	-59.5	-39.5	175.1	170.6	164.1	158.3	44.6	0	113.3	E829 A885 I886 Q887 M1036 F1039	E829-K889 WeakPolarHBondContact OE1-CE 3.5Å; E829-K889 IonicContact OE1-NZ 3.22Å; E829-K889 PolarHBondContact OE1-NZ 2.94Å; E829-K889 VanDerWaalsContact OE1-NZ 3.12Å; E829-K889 WeakPolarHBondContact OE2-CE 3.45Å; E829-K889 IonicContact OE2-NZ 3.68Å; E829-K889 PolarHBondContact OE2-NZ 3.29Å; A885-K889 WeakPolarHBondContact O-CB 3.29Å; A885-K889 PolarHBondContact O-N 2.79Å; I886-K889 PolarHBondContact O-N 3.31Å; Q887-K889 PolarHBondContact O-N 2.77Å; K889-M1036 HydrophobicContact CB-CE 4.26Å; K889-M1036 HydrophobicContact CB-SD 4.38Å; K889-M1036 HydrophobicContact CD-CE 4.21Å; K889-M1036 HydrophobicContact CD-SD 4.12Å; K889-F1039 VanDerWaalsContact CA-CZ 3.5Å; K889-F1039 HydrophobicContact CB-CD1 3.88Å; K889-F1039 HydrophobicContact CB-CD2 4.26Å; K889-F1039 HydrophobicContact CB-CE1 3.73Å; K889-F1039 HydrophobicContact CB-CE2 4.11Å; K889-F1039 HydrophobicContact CB-CG 4.16Å; K889-F1039 HydrophobicContact CB-CZ 3.87Å; K889-F1039 HydrophobicContact CD-CB 3.99Å; K889-F1039 HydrophobicContact CD-CD1 4.2Å; K889-F1039 HydrophobicContact CD-CD2 4.03Å; K889-F1039 HydrophobicContact CD-CG 3.77Å; K889-F1039 HydrophobicContact CG-CD1 4.26Å; K889-F1039 HydrophobicContact CG-CD2 3.91Å; K889-F1039 HydrophobicContact CG-CE1 4.43Å; K889-F1039 HydrophobicContact CG-CE2 4.08Å; K889-F1039 HydrophobicContact CG-CG 4.02Å; K889-F1039 HydrophobicContact CG-CZ 4.36Å
890	L	95	Very high	93.7	Very high	45 Å²	45	44.9 Å²	44.9	24%	0.236	22%	0.219	C	C	.	.	H	α-helix	trans	-73.1	-28.3	178.2	-68.4	169.1	0	0	0	112.8	E829 L832 E834 V837 I886 Q887 F888	E829-L890 HydrophobicContact CG-CD2 4.21Å; L832-L890 VanDerWaalsContact O-CD1 3.31Å; L832-L890 WeakPolarHBondContact O-CD1 3.49Å; E834-L890 HydrophobicContact CB-CB 4.25Å; E834-L890 HydrophobicContact CG-CB 4.48Å; V837-L890 HydrophobicContact CB-CD1 4.49Å; V837-L890 HydrophobicContact CG2-CD1 3.92Å; I886-L890 HydrophobicContact CG2-CD1 3.83Å; I886-L890 HydrophobicContact CG2-CG 4.32Å; I886-L890 VanDerWaalsContact O-CG 3.29Å; I886-L890 WeakPolarHBondContact O-CG 3.23Å; I886-L890 PolarHBondContact O-N 2.85Å; Q887-L890 PolarHBondContact O-N 3.26Å; F888-L890 VanDerWaalsContact C-N 3.33Å; F888-L890 PolarHBondContact O-N 3.14Å
891	Q	94.4	Very high	93.9	Very high	29 Å²	29	45.1 Å²	45.1	14%	0.136	23%	0.226	C	C	.	.	H	α-helix	trans	-88.3	-19.1	178.7	-70	-178.5	-33.4	0	0	114	E834 Q887 F888 E893 E894 Q895	E834-Q891 HydrophobicContact CG-CG 3.67Å; E834-Q891 WeakPolarHBondContact OE1-CG 3.41Å; E834-Q891 PolarHBondContact OE1-NE2 3.06Å; Q887-Q891 HydrophobicContact CG-CG 4.44Å; Q887-Q891 WeakPolarHBondContact O-CB 3.27Å; Q887-Q891 WeakPolarHBondContact O-CG 3.1Å; Q887-Q891 PolarHBondContact O-N 3.27Å; F888-Q891 PolarHBondContact O-N 3.38Å; Q891-E893 PolarHBondContact O-N 2.91Å; Q891-E894 PolarHBondContact O-N 2.84Å; Q891-Q895 WeakPolarHBondContact O-CG 3.45Å; Q891-Q895 PolarHBondContact O-N 3.1Å
892	F	95.5	Very high	94.2	Very high	1 Å²	1	46.8 Å²	46.8	0%	0.004	23%	0.233	C	C	.	.	H	α-helix	trans	-58.9	-46.4	-166.4	-176.8	-101.5	0	0	0	114.1	F888 E894 Q895 Q896 M1008 I1012 F1039 Y1042 A1043 Q1046	F888-F892 HydrophobicContact CE1-CD2 4.42Å; F888-F892 AromaticContact CE2-CD2 3.78Å; F888-F892 HydrophobicContact CE2-CD2 3.78Å; F888-F892 AromaticContact CZ-CD2 3.53Å; F888-F892 HydrophobicContact CZ-CD2 3.53Å; F888-F892 HydrophobicContact CZ-CE2 4.07Å; F888-F892 WeakPolarHBondContact O-CB 3.48Å; F888-F892 PolarHBondContact O-N 3.44Å; F892-E894 PolarHBondContact O-N 3.23Å; F892-Q895 PolarHBondContact O-N 3.27Å; F892-Q896 WeakPolarHBondContact O-CB 3.47Å; F892-Q896 PolarHBondContact O-N 3.04Å; F892-M1008 HydrophobicContact CD2-CE 4.37Å; F892-M1008 HydrophobicContact CD2-CG 4.31Å; F892-M1008 HydrophobicContact CD2-SD 4.37Å; F892-M1008 HydrophobicContact CE2-CE 4.1Å; F892-M1008 HydrophobicContact CE2-CG 3.81Å; F892-M1008 HydrophobicContact CE2-SD 3.61Å; F892-M1008 HydrophobicContact CZ-SD 4.23Å; F892-I1012 HydrophobicContact CE2-CD1 4.29Å; F892-F1039 HydrophobicContact CB-CE2 3.92Å; F892-F1039 HydrophobicContact CB-CZ 3.88Å; F892-F1039 HydrophobicContact CD1-CE2 4.08Å; F892-F1039 HydrophobicContact CD2-CZ 4.35Å; F892-F1039 AromaticContact CG-CE2 3.95Å; F892-F1039 HydrophobicContact CG-CE2 3.95Å; F892-F1039 HydrophobicContact CG-CZ 4.01Å; F892-Y1042 HydrophobicContact CD1-CE1 4.32Å; F892-Y1042 HydrophobicContact CE1-CD1 4.45Å; F892-Y1042 HydrophobicContact CE1-CE1 4.1Å; F892-A1043 HydrophobicContact CD2-CB 4.21Å; F892-A1043 HydrophobicContact CE1-CB 4.18Å; F892-A1043 HydrophobicContact CE2-CB 3.81Å; F892-A1043 HydrophobicContact CZ-CB 3.8Å; F892-Q1046 HydrophobicContact CE1-CB 3.9Å; F892-Q1046 HydrophobicContact CE1-CG 4.28Å; F892-Q1046 HydrophobicContact CZ-CB 3.82Å
893	E	92.9	Very high	94.3	Very high	119 Å²	119	46.8 Å²	46.8	56%	0.556	23%	0.233	S	C	*	.	H	α-helix	trans	-67.3	-36.1	-178.8	-63.1	-171.2	169.8	0	0	111.9	Q891 Q896 N897	Q891-E893 PolarHBondContact O-N 2.91Å; E893-Q896 PolarHBondContact O-N 2.99Å; E893-N897 VanDerWaalsContact O-CB 3.27Å; E893-N897 WeakPolarHBondContact O-CB 3.46Å; E893-N897 PolarHBondContact O-N 2.72Å; E893-N897 PolarHBondContact O-ND2 3.49Å
894	E	91.9	Very high	94.5	Very high	119 Å²	119	49.8 Å²	49.8	56%	0.556	25%	0.252	S	S	*	.	H	α-helix	trans	-67.3	-45.9	174.7	-161.4	-164.9	132	0	0	110.9	Q891 F892 Q896 N897 N898	Q891-E894 PolarHBondContact O-N 2.84Å; F892-E894 PolarHBondContact O-N 3.23Å; E894-Q896 VanDerWaalsContact C-N 3.31Å; E894-Q896 PolarHBondContact O-N 3.19Å; E894-N897 PolarHBondContact O-N 2.94Å; E894-N898 WeakPolarHBondContact O-CB 3.23Å; E894-N898 PolarHBondContact O-N 3.34Å; E894-N898 PolarHBondContact O-ND2 3.18Å; E894-N898 PolarHBondContact OE1-ND2 2.85Å
895	Q	92.1	Very high	94.6	Very high	37 Å²	37	45.2 Å²	45.2	17%	0.173	23%	0.231	C	C	.	.	H	α-helix	trans	-58.2	-42.6	175	-69.1	177.9	5.6	0	0	111.7	Q891 F892 N898 I899 M1008	Q891-Q895 WeakPolarHBondContact O-CG 3.45Å; Q891-Q895 PolarHBondContact O-N 3.1Å; F892-Q895 PolarHBondContact O-N 3.27Å; Q895-N898 PolarHBondContact O-N 2.96Å; Q895-I899 WeakPolarHBondContact O-CD1 3.45Å; Q895-I899 VanDerWaalsContact O-CG1 3.25Å; Q895-I899 WeakPolarHBondContact O-CG1 3.4Å; Q895-I899 PolarHBondContact O-N 2.73Å; Q895-M1008 HydrophobicContact CB-CE 3.57Å
896	Q	90.9	Very high	94.8	Very high	15 Å²	15	45 Å²	45	7%	0.07	23%	0.229	C	C	.	.	H	α-helix	trans	-64.1	-44.9	176.1	-169.6	-177.6	9.4	0	0	111.6	F892 E893 E894 N898 I899 K900 M1008 L1050	F892-Q896 WeakPolarHBondContact O-CB 3.47Å; F892-Q896 PolarHBondContact O-N 3.04Å; E893-Q896 PolarHBondContact O-N 2.99Å; E894-Q896 VanDerWaalsContact C-N 3.31Å; E894-Q896 PolarHBondContact O-N 3.19Å; Q896-N898 VanDerWaalsContact C-N 3.33Å; Q896-N898 PolarHBondContact O-N 3.04Å; Q896-I899 PolarHBondContact O-N 3.34Å; Q896-K900 VanDerWaalsContact O-CB 3.23Å; Q896-K900 WeakPolarHBondContact O-CB 3.48Å; Q896-K900 PolarHBondContact O-N 3.22Å; Q896-M1008 HydrophobicContact CB-CE 4.48Å; Q896-L1050 HydrophobicContact CG-CD2 4.35Å
897	N	92.1	Very high	94.9	Very high	100 Å²	100	45.9 Å²	45.9	54%	0.535	24%	0.235	S	C	.	.	H	α-helix	trans	-71.7	-23.6	-179.3	-73	-37.2	0	0	0	113.6	E893 E894 P901	E893-N897 VanDerWaalsContact O-CB 3.27Å; E893-N897 WeakPolarHBondContact O-CB 3.46Å; E893-N897 PolarHBondContact O-N 2.72Å; E893-N897 PolarHBondContact O-ND2 3.49Å; E894-N897 PolarHBondContact O-N 2.94Å; N897-P901 WeakPolarHBondContact O-CD 3.35Å; N897-P901 WeakPolarHBondContact O-CG 3.43Å
898	N	90.6	Very high	95	Very high	93 Å²	93	44.9 Å²	44.9	50%	0.497	23%	0.233	S	C	.	.	H	α-helix	trans	-80.7	-27.9	174.2	-69.5	-16.8	0	0	0	112.7	E894 Q895 Q896	E894-N898 WeakPolarHBondContact O-CB 3.23Å; E894-N898 PolarHBondContact O-N 3.34Å; E894-N898 PolarHBondContact O-ND2 3.18Å; E894-N898 PolarHBondContact OE1-ND2 2.85Å; Q895-N898 PolarHBondContact O-N 2.96Å; Q896-N898 VanDerWaalsContact C-N 3.33Å; Q896-N898 PolarHBondContact O-N 3.04Å
899	I	93.8	Very high	95.1	Very high	5 Å²	5	44.6 Å²	44.6	3%	0.026	23%	0.232	C	C	.	.	H	α-helix	trans	-90.3	-41.4	-179.4	-61.9	162.9	0	0	0	112.2	Q895 Q896 D902 V903 I1001 N1004 L1005 M1008 L1050	Q895-I899 WeakPolarHBondContact O-CD1 3.45Å; Q895-I899 VanDerWaalsContact O-CG1 3.25Å; Q895-I899 WeakPolarHBondContact O-CG1 3.4Å; Q895-I899 PolarHBondContact O-N 2.73Å; Q896-I899 PolarHBondContact O-N 3.34Å; I899-D902 PolarHBondContact O-N 2.84Å; I899-V903 HydrophobicContact CG2-CG2 4.02Å; I899-V903 PolarHBondContact O-N 2.9Å; I899-I1001 HydrophobicContact CG2-CG2 3.86Å; I899-N1004 HydrophobicContact CD1-CB 3.73Å; I899-N1004 HydrophobicContact CG1-CB 3.99Å; I899-L1005 HydrophobicContact CD1-CD2 4.29Å; I899-L1005 HydrophobicContact CD1-CG 4.39Å; I899-L1005 HydrophobicContact CG2-CD2 4.29Å; I899-L1005 HydrophobicContact CG2-CG 4.18Å; I899-M1008 HydrophobicContact CD1-CE 4.03Å; I899-L1050 HydrophobicContact CB-CD2 4.02Å; I899-L1050 HydrophobicContact CD1-CD2 4.33Å; I899-L1050 HydrophobicContact CG2-CD1 4.35Å; I899-L1050 HydrophobicContact CG2-CD2 3.85Å; I899-L1050 HydrophobicContact CG2-CG 4.24Å
900	K	95.4	Very high	95.3	Very high	91 Å²	91	42.9 Å²	42.9	40%	0.396	23%	0.225	S	C	.	.	H	α-helix	trans	-62.4	-41.8	-169.3	-174.4	179.7	178	-176.3	0	115	Q896 D902 V904 L1050 M1053	Q896-K900 VanDerWaalsContact O-CB 3.23Å; Q896-K900 WeakPolarHBondContact O-CB 3.48Å; Q896-K900 PolarHBondContact O-N 3.22Å; K900-D902 VanDerWaalsContact C-N 3.31Å; K900-D902 PolarHBondContact O-N 3.35Å; K900-V904 VanDerWaalsContact O-CG2 3.31Å; K900-V904 WeakPolarHBondContact O-CG2 3.36Å; K900-V904 PolarHBondContact O-N 3.22Å; K900-V904 VanDerWaalsContact O-N 3.11Å; K900-L1050 HydrophobicContact CB-CD1 3.78Å; K900-L1050 HydrophobicContact CG-CD1 4.03Å; K900-M1053 HydrophobicContact CG-CE 4.31Å
901	P	96.2	Very high	95.4	Very high	71 Å²	71	45.2 Å²	45.2	46%	0.461	24%	0.235	S	C	.	.	H	α-helix	trans	-62.4	-38.9	179.2	-22.7	34.8	0	0	0	112.4	N897 V904 A905	N897-P901 WeakPolarHBondContact O-CD 3.35Å; N897-P901 WeakPolarHBondContact O-CG 3.43Å; P901-V904 PolarHBondContact O-N 3.47Å; P901-A905 WeakPolarHBondContact O-CB 3.17Å; P901-A905 PolarHBondContact O-N 2.94Å
902	D	96.7	Very high	95.5	Very high	62 Å²	62	45.6 Å²	45.6	33%	0.332	24%	0.236	S	C	.	.	H	α-helix	trans	-68.5	-45.5	-177.4	-71.4	12.2	0	0	0	111.4	I899 K900 V904 A905 V906 V996 I1001	I899-D902 PolarHBondContact O-N 2.84Å; K900-D902 VanDerWaalsContact C-N 3.31Å; K900-D902 PolarHBondContact O-N 3.35Å; D902-V904 VanDerWaalsContact C-N 3.31Å; D902-V904 PolarHBondContact O-N 2.99Å; D902-A905 PolarHBondContact O-N 2.94Å; D902-V906 PolarHBondContact O-N 2.67Å; D902-V996 HydrophobicContact CB-CB 4.39Å; D902-V996 HydrophobicContact CB-CG1 3.79Å; D902-V996 HydrophobicContact CB-CG2 3.66Å; D902-I1001 HydrophobicContact CB-CD1 3.98Å; D902-I1001 HydrophobicContact CB-CG1 4.39Å
903	V	97.4	Very high	95.6	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-59.4	-42	173	175.5	0	0	0	0	111.2	I899 T907 I1001 M1053 M1057	I899-V903 HydrophobicContact CG2-CG2 4.02Å; I899-V903 PolarHBondContact O-N 2.9Å; V903-T907 WeakPolarHBondContact O-CB 3.23Å; V903-T907 PolarHBondContact O-N 3.41Å; V903-T907 PolarHBondContact O-OG1 3.37Å; V903-I1001 HydrophobicContact CG2-CD1 4.04Å; V903-I1001 HydrophobicContact CG2-CG2 3.86Å; V903-M1053 HydrophobicContact CG1-CB 3.82Å; V903-M1057 HydrophobicContact CB-SD 4.33Å; V903-M1057 HydrophobicContact CG1-CB 4.22Å; V903-M1057 HydrophobicContact CG1-SD 4.19Å; V903-M1057 HydrophobicContact CG2-SD 4.31Å
904	V	97.1	Very high	95.8	Very high	64 Å²	64	44.4 Å²	44.4	39%	0.388	23%	0.227	S	C	.	.	H	α-helix	trans	-65.3	-42.3	176	170.3	0	0	0	0	111.5	K900 P901 D902 T907 A908 M1053	K900-V904 VanDerWaalsContact O-CG2 3.31Å; K900-V904 WeakPolarHBondContact O-CG2 3.36Å; K900-V904 PolarHBondContact O-N 3.22Å; K900-V904 VanDerWaalsContact O-N 3.11Å; P901-V904 PolarHBondContact O-N 3.47Å; D902-V904 VanDerWaalsContact C-N 3.31Å; D902-V904 PolarHBondContact O-N 2.99Å; V904-T907 PolarHBondContact O-N 3.38Å; V904-A908 VanDerWaalsContact O-CB 3.29Å; V904-A908 WeakPolarHBondContact O-CB 3.48Å; V904-A908 PolarHBondContact O-N 3.5Å; V904-M1053 HydrophobicContact CG2-CE 3.43Å; V904-M1053 VanDerWaalsContact CG2-CE 3.43Å
905	A	97.8	Very high	95.9	Very high	6 Å²	6	44 Å²	44	5%	0.05	23%	0.229	C	C	.	.	H	α-helix	trans	-63.2	-43.9	-179.6	0	0	0	0	0	112.4	P901 D902 A909 K992	P901-A905 WeakPolarHBondContact O-CB 3.17Å; P901-A905 PolarHBondContact O-N 2.94Å; D902-A905 PolarHBondContact O-N 2.94Å; A905-A909 VanDerWaalsContact O-CB 3.3Å; A905-A909 WeakPolarHBondContact O-CB 3.26Å; A905-A909 PolarHBondContact O-N 3.3Å; A905-K992 HydrophobicContact CB-CB 3.79Å
906	V	98.1	Very high	96.1	Very high	1 Å²	1	42.5 Å²	42.5	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-68.8	-42.7	176.5	176.9	0	0	0	0	111.3	D902 A908 A909 C910 A993 V996 M1057 V1077 F1081	D902-V906 PolarHBondContact O-N 2.67Å; V906-A908 PolarHBondContact O-N 3.01Å; V906-A909 PolarHBondContact O-N 3.5Å; V906-C910 PolarHBondContact O-N 2.98Å; V906-C910 PolarHBondContact O-SG 2.91Å; V906-A993 HydrophobicContact CG2-CB 4.05Å; V906-V996 HydrophobicContact CG2-CB 3.82Å; V906-V996 HydrophobicContact CG2-CG1 3.62Å; V906-V996 HydrophobicContact CG2-CG2 4.21Å; V906-M1057 HydrophobicContact CB-CG 3.7Å; V906-M1057 HydrophobicContact CB-SD 3.68Å; V906-M1057 HydrophobicContact CG1-CG 3.41Å; V906-M1057 VanDerWaalsContact CG1-CG 3.41Å; V906-M1057 HydrophobicContact CG1-SD 3.78Å; V906-M1057 HydrophobicContact CG2-SD 4.25Å; V906-V1077 HydrophobicContact CB-CG1 4.28Å; V906-V1077 HydrophobicContact CG1-CG1 3.52Å; V906-V1077 HydrophobicContact CG2-CG1 3.67Å; V906-F1081 HydrophobicContact CG1-CE2 4.28Å
907	T	97.9	Very high	96.3	Very high	20 Å²	20	48.1 Å²	48.1	12%	0.123	25%	0.253	C	S	.	.	H	α-helix	trans	-58.4	-49.8	176.1	-55.5	0	0	0	0	110.7	V903 V904 A909 C910 E911 M1057 Q1060	V903-T907 WeakPolarHBondContact O-CB 3.23Å; V903-T907 PolarHBondContact O-N 3.41Å; V903-T907 PolarHBondContact O-OG1 3.37Å; V904-T907 PolarHBondContact O-N 3.38Å; T907-A909 PolarHBondContact O-N 3.09Å; T907-C910 WeakPolarHBondContact O-CB 3.34Å; T907-C910 PolarHBondContact O-N 2.87Å; T907-E911 PolarHBondContact O-N 3.1Å; T907-M1057 WeakPolarHBondContact OG1-CB 3.29Å; T907-Q1060 VanDerWaalsContact CG2-OE1 3.24Å; T907-Q1060 PolarHBondContact O-OE1 2.93Å
908	A	98.1	Very high	96.4	Very high	20 Å²	20	44 Å²	44	17%	0.165	23%	0.231	C	C	.	.	H	α-helix	trans	-61.4	-45.2	177.7	0	0	0	0	0	111.9	V904 V906 C910 E911 E912 H989	V904-A908 VanDerWaalsContact O-CB 3.29Å; V904-A908 WeakPolarHBondContact O-CB 3.48Å; V904-A908 PolarHBondContact O-N 3.5Å; V906-A908 PolarHBondContact O-N 3.01Å; A908-C910 VanDerWaalsContact C-N 3.28Å; A908-C910 PolarHBondContact O-N 3.26Å; A908-E911 PolarHBondContact O-N 3.22Å; A908-E912 VanDerWaalsContact O-CB 3.28Å; A908-E912 WeakPolarHBondContact O-CB 3.3Å; A908-E912 VanDerWaalsContact O-CG 3.24Å; A908-E912 WeakPolarHBondContact O-CG 3.35Å; A908-E912 PolarHBondContact O-N 3.31Å; A908-H989 HydrophobicContact CB-CB 3.91Å
909	A	98.4	Very high	96.8	Very high	0 Å²	0	39.7 Å²	39.7	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-62.6	-32.7	177.1	0	0	0	0	0	112.9	A905 V906 T907 L913 H989 V990 A993 F1081	A905-A909 VanDerWaalsContact O-CB 3.3Å; A905-A909 WeakPolarHBondContact O-CB 3.26Å; A905-A909 PolarHBondContact O-N 3.3Å; V906-A909 PolarHBondContact O-N 3.5Å; T907-A909 PolarHBondContact O-N 3.09Å; A909-L913 VanDerWaalsContact O-CB 3.25Å; A909-L913 WeakPolarHBondContact O-CB 3.45Å; A909-L913 PolarHBondContact O-N 2.98Å; A909-L913 VanDerWaalsContact O-N 3.11Å; A909-H989 HydrophobicContact CB-CB 4.04Å; A909-V990 HydrophobicContact CB-CG2 4.14Å; A909-A993 HydrophobicContact CB-CB 3.61Å; A909-F1081 HydrophobicContact CB-CD1 4.13Å; A909-F1081 HydrophobicContact CB-CE1 3.63Å; A909-F1081 HydrophobicContact CB-CE2 4.35Å; A909-F1081 HydrophobicContact CB-CZ 3.76Å
910	C	98.3	Very high	96.8	Very high	3 Å²	3	40.7 Å²	40.7	2%	0.02	22%	0.217	C	C	.	.	H	α-helix	trans	-67.5	-44.1	172.8	-73.2	0	0	0	0	112.5	V906 T907 A908 R914 Q1060 L1064	V906-C910 PolarHBondContact O-N 2.98Å; V906-C910 PolarHBondContact O-SG 2.91Å; T907-C910 WeakPolarHBondContact O-CB 3.34Å; T907-C910 PolarHBondContact O-N 2.87Å; A908-C910 VanDerWaalsContact C-N 3.28Å; A908-C910 PolarHBondContact O-N 3.26Å; C910-R914 WeakPolarHBondContact O-CB 3.37Å; C910-R914 PolarHBondContact O-N 2.89Å; C910-Q1060 HydrophobicContact CB-CB 3.88Å; C910-L1064 HydrophobicContact CB-CD1 4.13Å; C910-L1064 HydrophobicContact CB-CG 4.49Å
911	E	97.3	Very high	96.8	Very high	93 Å²	93	39.2 Å²	39.2	44%	0.435	21%	0.211	S	C	.	.	H	α-helix	trans	-69.5	-44.1	178.5	-70	178.5	-178.3	0	0	112.1	T907 A908 R914 N915 Q1060	T907-E911 PolarHBondContact O-N 3.1Å; A908-E911 PolarHBondContact O-N 3.22Å; E911-R914 PolarHBondContact O-N 3.24Å; E911-N915 WeakPolarHBondContact O-CB 3.31Å; E911-N915 PolarHBondContact O-N 3.27Å; E911-N915 VanDerWaalsContact O-N 3.09Å; E911-N915 PolarHBondContact O-ND2 3.21Å; E911-Q1060 PolarHBondContact OE1-NE2 2.95Å
912	E	97.9	Very high	96.9	Very high	37 Å²	37	35.9 Å²	35.9	17%	0.173	19%	0.189	C	C	.	.	H	α-helix	trans	-54.5	-54.2	173.6	-78.3	174.2	-176.9	0	0	111	A908 R914 N915 S916 E986 L987 I988 H989	A908-E912 VanDerWaalsContact O-CB 3.28Å; A908-E912 WeakPolarHBondContact O-CB 3.3Å; A908-E912 VanDerWaalsContact O-CG 3.24Å; A908-E912 WeakPolarHBondContact O-CG 3.35Å; A908-E912 PolarHBondContact O-N 3.31Å; E912-R914 VanDerWaalsContact C-N 3.35Å; E912-R914 PolarHBondContact O-N 3.09Å; E912-N915 PolarHBondContact O-N 2.99Å; E912-S916 WeakPolarHBondContact O-CB 3.43Å; E912-S916 PolarHBondContact O-N 2.91Å; E912-E986 VanDerWaalsContact CB-O 3.31Å; E912-E986 WeakPolarHBondContact CB-O 3.38Å; E912-E986 VanDerWaalsContact CG-O 3.3Å; E912-E986 WeakPolarHBondContact CG-O 3.25Å; E912-L987 HydrophobicContact CB-CD2 4.06Å; E912-L987 WeakPolarHBondContact OE2-CA 3.27Å; E912-I988 VanDerWaalsContact OE1-CG1 3.26Å; E912-I988 WeakPolarHBondContact OE1-CG1 3.17Å; E912-I988 PolarHBondContact OE2-N 3.26Å; E912-I988 VanDerWaalsContact OE2-N 3.1Å; E912-H989 IonicContact OE1-CE1 2.77Å; E912-H989 IonicContact OE1-CG 3.29Å; E912-H989 IonicContact OE1-ND1 3.74Å; E912-H989 PolarHBondContact OE1-ND1 3.37Å; E912-H989 WeakPolarHBondContact OE2-CB 3.27Å; E912-H989 PolarHBondContact OE2-N 3.23Å; E912-H989 IonicContact OE2-ND1 3.6Å
913	L	97.5	Very high	96.9	Very high	2 Å²	2	34.3 Å²	34.3	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-65.6	-35.3	-175.7	-171.3	61.9	0	0	0	113.7	A909 F919 L987 L1064 F1068 F1080 F1081 L1084	A909-L913 VanDerWaalsContact O-CB 3.25Å; A909-L913 WeakPolarHBondContact O-CB 3.45Å; A909-L913 PolarHBondContact O-N 2.98Å; A909-L913 VanDerWaalsContact O-N 3.11Å; L913-F919 HydrophobicContact CD1-CD1 3.5Å; L913-F919 HydrophobicContact CD1-CE1 3.48Å; L913-F919 VanDerWaalsContact CD1-CE1 3.48Å; L913-F919 HydrophobicContact CD1-CG 4.13Å; L913-F919 HydrophobicContact CD1-CZ 4.08Å; L913-F919 HydrophobicContact CG-CE1 4.41Å; L913-L987 HydrophobicContact CB-CD2 4.14Å; L913-L987 HydrophobicContact CD1-CD1 3.97Å; L913-L987 HydrophobicContact CD1-CD2 3.87Å; L913-L1064 HydrophobicContact CD2-CD1 4.12Å; L913-F1068 HydrophobicContact CD2-CD2 4.48Å; L913-F1068 HydrophobicContact CD2-CE2 3.8Å; L913-F1068 HydrophobicContact CG-CE2 3.77Å; L913-F1068 HydrophobicContact CG-CZ 4.13Å; L913-F1080 HydrophobicContact CD2-CE1 3.5Å; L913-F1080 HydrophobicContact CD2-CZ 3.58Å; L913-F1081 HydrophobicContact CD2-CE1 4.26Å; L913-L1084 HydrophobicContact CD1-CD1 4.42Å; L913-L1084 HydrophobicContact CD1-CD2 3.54Å; L913-L1084 HydrophobicContact CD2-CD2 3.6Å; L913-L1084 HydrophobicContact CG-CD2 4.13Å
914	R	95.6	Very high	96.8	Very high	94 Å²	94	40.5 Å²	40.5	36%	0.355	21%	0.209	S	C	.	.	H	α-helix	trans	-75.4	-32.9	-180	-164	175.3	-174.5	180	3.2	112.8	C910 E911 E912 E1063 L1064 Y1067	C910-R914 WeakPolarHBondContact O-CB 3.37Å; C910-R914 PolarHBondContact O-N 2.89Å; E911-R914 PolarHBondContact O-N 3.24Å; E912-R914 VanDerWaalsContact C-N 3.35Å; E912-R914 PolarHBondContact O-N 3.09Å; R914-E1063 IonicContact CZ-OE2 3.89Å; R914-E1063 IonicContact NH1-OE2 3.12Å; R914-E1063 PolarHBondContact NH1-OE2 3.26Å; R914-E1063 IonicContact NH2-OE2 2.6Å; R914-E1063 PolarHBondContact NH2-OE2 3.14Å; R914-L1064 HydrophobicContact CB-CD2 3.88Å; R914-L1064 HydrophobicContact CG-CD2 4.26Å; R914-Y1067 HydrophobicContact CG-CD1 4.31Å; R914-Y1067 HydrophobicContact CG-CE1 4.38Å
915	N	95.2	Very high	96.8	Very high	111 Å²	111	38.1 Å²	38.1	59%	0.594	20%	0.195	S	C	*	.	H	α-helix	trans	-93.1	-10.3	-177.3	-64.7	-53.1	0	0	0	113.3	E911 E912 N917	E911-N915 WeakPolarHBondContact O-CB 3.31Å; E911-N915 PolarHBondContact O-N 3.27Å; E911-N915 VanDerWaalsContact O-N 3.09Å; E911-N915 PolarHBondContact O-ND2 3.21Å; E912-N915 PolarHBondContact O-N 2.99Å; N915-N917 PolarHBondContact O-N 2.93Å; N915-N917 PolarHBondContact O-ND2 3.01Å; N915-N917 VanDerWaalsContact O-ND2 3.1Å
916	S	96.9	Very high	96.7	Very high	4 Å²	4	38.2 Å²	38.2	3%	0.028	19%	0.194	C	C	.	.			trans	-68.5	99.4	178.6	-178.9	0	0	0	0	112.5	E912 T918 F919 A920 E986	E912-S916 WeakPolarHBondContact O-CB 3.43Å; E912-S916 PolarHBondContact O-N 2.91Å; S916-T918 VanDerWaalsContact C-N 3.29Å; S916-T918 PolarHBondContact O-N 3.28Å; S916-T918 PolarHBondContact OG-OG1 3.41Å; S916-F919 VanDerWaalsContact OG-CB 3.3Å; S916-F919 WeakPolarHBondContact OG-CB 3.19Å; S916-F919 PolarHBondContact OG-N 3Å; S916-F919 VanDerWaalsContact OG-N 3.16Å; S916-A920 WeakPolarHBondContact O-CB 3.43Å; S916-A920 PolarHBondContact O-N 2.88Å; S916-E986 WeakPolarHBondContact CA-OE2 3.28Å; S916-E986 WeakPolarHBondContact CB-OE2 3.44Å; S916-E986 PolarHBondContact OG-OE2 3.12Å
917	N	93.4	Very high	96.5	Very high	133 Å²	133	40.1 Å²	40.1	71%	0.711	20%	0.204	S	C	*	.	H	α-helix	trans	-68.5	-30	176.5	-72.3	-83.6	0	0	0	111.7	N915 K921	N915-N917 PolarHBondContact O-N 2.93Å; N915-N917 PolarHBondContact O-ND2 3.01Å; N915-N917 VanDerWaalsContact O-ND2 3.1Å; N917-K921 WeakPolarHBondContact O-CB 3.34Å; N917-K921 PolarHBondContact O-N 2.88Å
918	T	95.7	Very high	96.4	Very high	15 Å²	15	45.2 Å²	45.2	9%	0.092	23%	0.23	C	C	.	.	H	α-helix	trans	-72.8	-40.4	178.2	55.9	0	0	0	0	111.5	S916 K921 L922 D979 F983 E986	S916-T918 VanDerWaalsContact C-N 3.29Å; S916-T918 PolarHBondContact O-N 3.28Å; S916-T918 PolarHBondContact OG-OG1 3.41Å; T918-K921 PolarHBondContact O-N 3.43Å; T918-L922 PolarHBondContact O-N 3.13Å; T918-D979 WeakPolarHBondContact CG2-O 3.48Å; T918-F983 VanDerWaalsContact OG1-CA 3.3Å; T918-F983 WeakPolarHBondContact OG1-CA 3.33Å; T918-F983 VanDerWaalsContact OG1-CB 3.28Å; T918-F983 WeakPolarHBondContact OG1-CB 3.31Å; T918-E986 WeakPolarHBondContact CB-OE1 3.23Å; T918-E986 WeakPolarHBondContact CG2-OE1 3.21Å; T918-E986 PolarHBondContact OG1-OE1 3.05Å; T918-E986 PolarHBondContact OG1-OE2 3.24Å
919	F	97.2	Very high	96.2	Very high	1 Å²	1	45.5 Å²	45.5	0%	0.004	23%	0.23	C	C	.	.	H	α-helix	trans	-64.8	-43.4	170	-175.4	-107.7	0	0	0	111.8	L913 S916 K921 L922 L923 I947 L950 F983 L987 F1068 L1084 F1087	L913-F919 HydrophobicContact CD1-CD1 3.5Å; L913-F919 HydrophobicContact CD1-CE1 3.48Å; L913-F919 VanDerWaalsContact CD1-CE1 3.48Å; L913-F919 HydrophobicContact CD1-CG 4.13Å; L913-F919 HydrophobicContact CD1-CZ 4.08Å; L913-F919 HydrophobicContact CG-CE1 4.41Å; S916-F919 VanDerWaalsContact OG-CB 3.3Å; S916-F919 WeakPolarHBondContact OG-CB 3.19Å; S916-F919 PolarHBondContact OG-N 3Å; S916-F919 VanDerWaalsContact OG-N 3.16Å; F919-K921 VanDerWaalsContact C-N 3.25Å; F919-K921 PolarHBondContact O-N 3.11Å; F919-L922 WeakPolarHBondContact O-CB 3.4Å; F919-L922 PolarHBondContact O-N 3.49Å; F919-L922 VanDerWaalsContact O-N 3.1Å; F919-L923 HydrophobicContact CD1-CD1 4.16Å; F919-L923 HydrophobicContact CD1-CG 4.38Å; F919-L923 HydrophobicContact CE1-CD1 3.74Å; F919-L923 HydrophobicContact CE1-CD2 4.25Å; F919-L923 HydrophobicContact CE1-CG 4.07Å; F919-L923 HydrophobicContact CE2-CD2 4.44Å; F919-L923 HydrophobicContact CZ-CD1 4.31Å; F919-L923 HydrophobicContact CZ-CD2 3.98Å; F919-L923 HydrophobicContact CZ-CG 4.27Å; F919-L923 WeakPolarHBondContact O-CG 3.44Å; F919-L923 PolarHBondContact O-N 3.22Å; F919-I947 HydrophobicContact CE1-CD1 4.33Å; F919-L950 HydrophobicContact CE2-CD1 4.07Å; F919-L950 HydrophobicContact CZ-CD1 3.83Å; F919-F983 HydrophobicContact CB-CB 4.27Å; F919-F983 HydrophobicContact CB-CD2 4.33Å; F919-F983 AromaticContact CD2-CD2 3.68Å; F919-F983 HydrophobicContact CD2-CD2 3.68Å; F919-F983 AromaticContact CD2-CE2 3.87Å; F919-F983 HydrophobicContact CD2-CE2 3.87Å; F919-F983 HydrophobicContact CD2-CG 4.46Å; F919-F983 HydrophobicContact CE2-CE2 4.32Å; F919-F983 HydrophobicContact CG-CD2 4.46Å; F919-L987 HydrophobicContact CD2-CD1 4.34Å; F919-L987 HydrophobicContact CG-CD1 4.48Å; F919-F1068 HydrophobicContact CD1-CZ 4.4Å; F919-F1068 HydrophobicContact CE1-CE1 4.38Å; F919-F1068 HydrophobicContact CE1-CZ 4.15Å; F919-L1084 HydrophobicContact CE2-CD1 3.74Å; F919-L1084 HydrophobicContact CZ-CD1 3.63Å; F919-F1087 HydrophobicContact CE2-CD1 4.38Å; F919-F1087 HydrophobicContact CE2-CE1 4.11Å
920	A	95.3	Very high	95.8	Very high	27 Å²	27	46.5 Å²	46.5	22%	0.223	24%	0.239	C	C	.	.	H	α-helix	trans	-60.3	-33.9	175	0	0	0	0	0	112.8	S916 Q924	S916-A920 WeakPolarHBondContact O-CB 3.43Å; S916-A920 PolarHBondContact O-N 2.88Å; A920-Q924 WeakPolarHBondContact O-CG 3.46Å; A920-Q924 PolarHBondContact O-N 2.98Å; A920-Q924 PolarHBondContact O-NE2 2.7Å
921	K	95.7	Very high	95.4	Very high	60 Å²	60	48.2 Å²	48.2	26%	0.261	25%	0.248	S	C	.	.	H	α-helix	trans	-71	-39.9	172.8	-173.9	177.3	178.2	-170.4	0	112.1	N917 T918 F919 L923 Q924 I925 D979 V980	N917-K921 WeakPolarHBondContact O-CB 3.34Å; N917-K921 PolarHBondContact O-N 2.88Å; T918-K921 PolarHBondContact O-N 3.43Å; F919-K921 VanDerWaalsContact C-N 3.25Å; F919-K921 PolarHBondContact O-N 3.11Å; K921-L923 PolarHBondContact O-N 2.9Å; K921-Q924 WeakPolarHBondContact O-CB 3.43Å; K921-Q924 PolarHBondContact O-N 3.36Å; K921-I925 HydrophobicContact CG-CD1 4.22Å; K921-I925 WeakPolarHBondContact O-CD1 3.39Å; K921-I925 WeakPolarHBondContact O-CG1 3.49Å; K921-I925 PolarHBondContact O-N 2.8Å; K921-I925 VanDerWaalsContact O-N 3.09Å; K921-D979 WeakPolarHBondContact CD-OD2 3.47Å; K921-D979 IonicContact NZ-OD1 3.88Å; K921-D979 PolarHBondContact NZ-OD1 2.64Å; K921-D979 IonicContact NZ-OD2 2.72Å; K921-D979 PolarHBondContact NZ-OD2 2.81Å; K921-V980 HydrophobicContact CB-CG2 4.11Å; K921-V980 HydrophobicContact CD-CG2 3.59Å; K921-V980 HydrophobicContact CG-CG2 3.78Å
922	L	97.3	Very high	95.2	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-58	-45.4	173.5	-177.7	53.3	0	0	0	112.1	T918 F919 Q924 I925 I926 V980 F983 F1087 F1091	T918-L922 PolarHBondContact O-N 3.13Å; F919-L922 WeakPolarHBondContact O-CB 3.4Å; F919-L922 PolarHBondContact O-N 3.49Å; F919-L922 VanDerWaalsContact O-N 3.1Å; L922-Q924 VanDerWaalsContact C-N 3.29Å; L922-Q924 PolarHBondContact O-N 3.08Å; L922-I925 PolarHBondContact O-N 2.84Å; L922-I926 HydrophobicContact CD1-CD1 3.96Å; L922-I926 HydrophobicContact CD1-CG1 4.27Å; L922-I926 HydrophobicContact CG-CD1 3.83Å; L922-I926 WeakPolarHBondContact O-CD1 3.5Å; L922-I926 VanDerWaalsContact O-CG1 3.26Å; L922-I926 WeakPolarHBondContact O-CG1 3.25Å; L922-I926 PolarHBondContact O-N 3.21Å; L922-V980 HydrophobicContact CB-CG1 3.76Å; L922-V980 HydrophobicContact CD1-CG1 4.07Å; L922-V980 HydrophobicContact CD2-CG1 4.38Å; L922-V980 HydrophobicContact CG-CG1 4.28Å; L922-F983 HydrophobicContact CD2-CD1 3.65Å; L922-F983 HydrophobicContact CD2-CD2 4.48Å; L922-F983 HydrophobicContact CD2-CE1 3.31Å; L922-F983 HydrophobicContact CD2-CE2 4.18Å; L922-F983 HydrophobicContact CD2-CG 4.25Å; L922-F983 HydrophobicContact CD2-CZ 3.61Å; L922-F1087 HydrophobicContact CD2-CE1 3.9Å; L922-F1087 HydrophobicContact CD2-CZ 3.87Å; L922-F1091 HydrophobicContact CD1-CE2 4.06Å; L922-F1091 HydrophobicContact CD2-CD2 4.46Å; L922-F1091 HydrophobicContact CD2-CE2 4.24Å
923	L	97	Very high	94.9	Very high	28 Å²	28	56.4 Å²	56.4	15%	0.147	28%	0.281	C	S	.	.	H	α-helix	trans	-59.7	-37.9	176.3	-64.4	-178.5	0	0	0	112.6	F919 K921 I926 L927 F945 L950 F1068	F919-L923 HydrophobicContact CD1-CD1 4.16Å; F919-L923 HydrophobicContact CD1-CG 4.38Å; F919-L923 HydrophobicContact CE1-CD1 3.74Å; F919-L923 HydrophobicContact CE1-CD2 4.25Å; F919-L923 HydrophobicContact CE1-CG 4.07Å; F919-L923 HydrophobicContact CE2-CD2 4.44Å; F919-L923 HydrophobicContact CZ-CD1 4.31Å; F919-L923 HydrophobicContact CZ-CD2 3.98Å; F919-L923 HydrophobicContact CZ-CG 4.27Å; F919-L923 WeakPolarHBondContact O-CG 3.44Å; F919-L923 PolarHBondContact O-N 3.22Å; K921-L923 PolarHBondContact O-N 2.9Å; L923-I926 PolarHBondContact O-N 3.3Å; L923-L927 WeakPolarHBondContact O-CB 3.36Å; L923-L927 PolarHBondContact O-N 2.92Å; L923-F945 HydrophobicContact CB-CZ 4.46Å; L923-F945 HydrophobicContact CD2-CE2 4.07Å; L923-F945 HydrophobicContact CD2-CZ 3.77Å; L923-L950 HydrophobicContact CD2-CD1 4.17Å; L923-L950 HydrophobicContact CD2-CD2 3.95Å; L923-F1068 HydrophobicContact CD1-CD1 4.21Å; L923-F1068 HydrophobicContact CD1-CE1 3.74Å
924	Q	94.9	Very high	94.6	Very high	130 Å²	130	59 Å²	59	61%	0.607	30%	0.295	S	S	*	.	H	α-helix	trans	-67	-40.4	176.2	-71.1	166.3	75.2	0	0	112.4	A920 K921 L922 L927 L928	A920-Q924 WeakPolarHBondContact O-CG 3.46Å; A920-Q924 PolarHBondContact O-N 2.98Å; A920-Q924 PolarHBondContact O-NE2 2.7Å; K921-Q924 WeakPolarHBondContact O-CB 3.43Å; K921-Q924 PolarHBondContact O-N 3.36Å; L922-Q924 VanDerWaalsContact C-N 3.29Å; L922-Q924 PolarHBondContact O-N 3.08Å; Q924-L927 PolarHBondContact O-N 2.87Å; Q924-L928 WeakPolarHBondContact O-CB 3.47Å; Q924-L928 PolarHBondContact O-N 3.4Å
925	I	96.8	Very high	94.4	Very high	15 Å²	15	59 Å²	59	8%	0.077	31%	0.31	C	S	.	.	H	α-helix	trans	-63.1	-44.9	175.4	-63.8	155.5	0	0	0	110.2	K921 L922 L927 L928 V929 L969 H977 V980	K921-I925 HydrophobicContact CG-CD1 4.22Å; K921-I925 WeakPolarHBondContact O-CD1 3.39Å; K921-I925 WeakPolarHBondContact O-CG1 3.49Å; K921-I925 PolarHBondContact O-N 2.8Å; K921-I925 VanDerWaalsContact O-N 3.09Å; L922-I925 PolarHBondContact O-N 2.84Å; I925-L927 VanDerWaalsContact C-N 3.35Å; I925-L927 PolarHBondContact O-N 2.66Å; I925-L928 PolarHBondContact O-N 3.49Å; I925-V929 WeakPolarHBondContact O-CG2 3.49Å; I925-V929 PolarHBondContact O-N 3.03Å; I925-L969 HydrophobicContact CG2-CD2 4.04Å; I925-H977 HydrophobicContact CD1-CB 4.34Å; I925-H977 WeakPolarHBondContact CD1-CD2 3.45Å; I925-V980 HydrophobicContact CD1-CG2 4.02Å
926	I	96.9	Very high	93.9	Very high	7 Å²	7	58 Å²	58	4%	0.036	33%	0.325	C	S	.	.	H	α-helix	trans	-62.7	-41.8	176.8	-64.4	163	0	0	0	110.9	L922 L923 G930 F945 L950 L953 L969 F1087	L922-I926 HydrophobicContact CD1-CD1 3.96Å; L922-I926 HydrophobicContact CD1-CG1 4.27Å; L922-I926 HydrophobicContact CG-CD1 3.83Å; L922-I926 WeakPolarHBondContact O-CD1 3.5Å; L922-I926 VanDerWaalsContact O-CG1 3.26Å; L922-I926 WeakPolarHBondContact O-CG1 3.25Å; L922-I926 PolarHBondContact O-N 3.21Å; L923-I926 PolarHBondContact O-N 3.3Å; I926-G930 PolarHBondContact O-N 3.04Å; I926-F945 HydrophobicContact CB-CE1 3.97Å; I926-F945 HydrophobicContact CB-CZ 3.79Å; I926-F945 HydrophobicContact CD1-CZ 4.49Å; I926-F945 HydrophobicContact CG2-CD1 4.48Å; I926-F945 HydrophobicContact CG2-CE1 3.62Å; I926-F945 HydrophobicContact CG2-CE2 4.15Å; I926-F945 HydrophobicContact CG2-CZ 3.42Å; I926-F945 VanDerWaalsContact CG2-CZ 3.42Å; I926-L950 HydrophobicContact CD1-CD2 3.57Å; I926-L953 HydrophobicContact CD1-CD1 3.88Å; I926-L953 HydrophobicContact CG1-CD1 4.24Å; I926-L953 HydrophobicContact CG2-CD1 4.14Å; I926-L953 HydrophobicContact CG2-CD2 4.02Å; I926-L969 HydrophobicContact CG1-CD1 3.96Å; I926-L969 HydrophobicContact CG1-CD2 4.11Å; I926-F1087 HydrophobicContact CD1-CZ 4.46Å
927	L	93.8	Very high	93.6	Very high	42 Å²	42	60.5 Å²	60.5	22%	0.22	34%	0.342	C	S	.	.	H	α-helix	trans	-63.9	-42.4	177.2	-177.5	62.6	0	0	0	111.9	L923 Q924 I925 N931 A942 F943 F945	L923-L927 WeakPolarHBondContact O-CB 3.36Å; L923-L927 PolarHBondContact O-N 2.92Å; Q924-L927 PolarHBondContact O-N 2.87Å; I925-L927 VanDerWaalsContact C-N 3.35Å; I925-L927 PolarHBondContact O-N 2.66Å; L927-N931 VanDerWaalsContact O-CB 3.25Å; L927-N931 WeakPolarHBondContact O-CB 3.42Å; L927-N931 PolarHBondContact O-N 3.47Å; L927-N931 PolarHBondContact O-ND2 3.29Å; L927-A942 HydrophobicContact CD1-CB 4.49Å; L927-F943 WeakPolarHBondContact CD2-O 3.47Å; L927-F945 HydrophobicContact CB-CD1 4.34Å; L927-F945 HydrophobicContact CB-CE1 4.02Å; L927-F945 HydrophobicContact CD1-CD1 4.08Å
928	L	94.5	Very high	93.3	Very high	127 Å²	127	65.7 Å²	65.7	67%	0.665	35%	0.352	S	S	*	.	H	α-helix	trans	-62	-52.5	177.1	175.1	61.3	0	0	0	111.6	Q924 I925 N931 Y932	Q924-L928 WeakPolarHBondContact O-CB 3.47Å; Q924-L928 PolarHBondContact O-N 3.4Å; I925-L928 PolarHBondContact O-N 3.49Å; L928-N931 PolarHBondContact O-N 2.97Å; L928-Y932 PolarHBondContact O-N 3.31Å
929	V	94	Very high	92.7	Very high	26 Å²	26	69.5 Å²	69.5	16%	0.158	37%	0.372	C	S	.	.	H	α-helix	trans	-64.3	-43.6	179.9	176	0	0	0	0	110.7	I925 N931 Y932 M933 L965 F968 L969	I925-V929 WeakPolarHBondContact O-CG2 3.49Å; I925-V929 PolarHBondContact O-N 3.03Å; V929-N931 PolarHBondContact O-N 2.99Å; V929-Y932 PolarHBondContact O-N 3.4Å; V929-M933 HydrophobicContact CG1-CG 4.41Å; V929-M933 HydrophobicContact CG1-SD 3.87Å; V929-M933 WeakPolarHBondContact O-CG 3.31Å; V929-M933 PolarHBondContact O-N 3Å; V929-L965 HydrophobicContact CG1-CD1 3.8Å; V929-F968 HydrophobicContact CG1-CE1 4.46Å; V929-L969 HydrophobicContact CB-CD2 4.18Å; V929-L969 HydrophobicContact CG1-CD2 4.45Å; V929-L969 HydrophobicContact CG2-CD2 4.01Å
930	G	90.2	Very high	92.1	Very high	20 Å²	20	70.5 Å²	70.5	21%	0.206	38%	0.382	C	S	.	.	H	α-helix	trans	-60.6	-42.1	175.9	0	0	0	0	0	113	I926 M933 N934	I926-G930 PolarHBondContact O-N 3.04Å; G930-M933 PolarHBondContact O-N 3.47Å; G930-N934 VanDerWaalsContact O-CB 3.28Å; G930-N934 WeakPolarHBondContact O-CB 3.49Å; G930-N934 PolarHBondContact O-N 3.28Å; G930-N934 PolarHBondContact O-ND2 2.85Å
931	N	90.9	Very high	91.8	Very high	39 Å²	39	73.3 Å²	73.3	21%	0.209	41%	0.405	C	S	.	.	H	α-helix	trans	-67.2	-37.7	176.3	-88.2	-38.4	0	0	0	112.9	L927 L928 V929 S935 A941 A942	L927-N931 VanDerWaalsContact O-CB 3.25Å; L927-N931 WeakPolarHBondContact O-CB 3.42Å; L927-N931 PolarHBondContact O-N 3.47Å; L927-N931 PolarHBondContact O-ND2 3.29Å; L928-N931 PolarHBondContact O-N 2.97Å; V929-N931 PolarHBondContact O-N 2.99Å; N931-S935 PolarHBondContact O-N 3.43Å; N931-A941 WeakPolarHBondContact OD1-CA 3.38Å; N931-A941 PolarHBondContact OD1-N 3.4Å; N931-A942 PolarHBondContact ND2-O 3.4Å; N931-A942 PolarHBondContact OD1-N 2.87Å
932	Y	93.1	Very high	91.7	Very high	198 Å²	198	72.4 Å²	72.4	78%	0.776	41%	0.409	S	S	*	.	H	α-helix	trans	-64.4	-48.1	174.7	-173.5	-92.3	0	0	0	111.3	L928 V929 N934 S935	L928-Y932 PolarHBondContact O-N 3.31Å; V929-Y932 PolarHBondContact O-N 3.4Å; Y932-N934 PolarHBondContact O-N 2.96Å; Y932-S935 VanDerWaalsContact O-CB 3.28Å; Y932-S935 WeakPolarHBondContact O-CB 3.41Å; Y932-S935 PolarHBondContact O-N 3.34Å
933	M	91.5	Very high	91.4	Very high	104 Å²	104	82.3 Å²	82.3	51%	0.512	45%	0.453	S	S	.	.	H	α-helix	trans	-65.1	-34.7	178.9	-70.1	177.8	68.6	0	0	113.4	V929 G930 S935 T956 L965	V929-M933 HydrophobicContact CG1-CG 4.41Å; V929-M933 HydrophobicContact CG1-SD 3.87Å; V929-M933 WeakPolarHBondContact O-CG 3.31Å; V929-M933 PolarHBondContact O-N 3Å; G930-M933 PolarHBondContact O-N 3.47Å; M933-S935 VanDerWaalsContact C-N 3.32Å; M933-T956 HydrophobicContact CE-CG2 3.94Å; M933-L965 HydrophobicContact CE-CD1 4.46Å; M933-L965 HydrophobicContact CE-CD2 4.21Å; M933-L965 HydrophobicContact SD-CD1 3.7Å; M933-L965 HydrophobicContact SD-CD2 3.92Å; M933-L965 HydrophobicContact SD-CG 4.44Å
934	N	91.1	Very high	91.1	Very high	56 Å²	56	83.1 Å²	83.1	30%	0.299	47%	0.468	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	8.8	178.9	-71	-64.4	0	0	0	113.7	G930 Y932 G936 S937 N939 G940	G930-N934 VanDerWaalsContact O-CB 3.28Å; G930-N934 WeakPolarHBondContact O-CB 3.49Å; G930-N934 PolarHBondContact O-N 3.28Å; G930-N934 PolarHBondContact O-ND2 2.85Å; Y932-N934 PolarHBondContact O-N 2.96Å; N934-G936 PolarHBondContact O-N 3.06Å; N934-S937 VanDerWaalsContact O-CB 3.28Å; N934-S937 WeakPolarHBondContact O-CB 3.49Å; N934-S937 PolarHBondContact O-N 3.03Å; N934-S937 PolarHBondContact O-OG 3.46Å; N934-N939 HydrophobicContact CB-CB 4.16Å; N934-G940 VanDerWaalsContact O-CA 3.3Å; N934-G940 WeakPolarHBondContact O-CA 3.33Å; N934-G940 PolarHBondContact O-N 3.02Å
935	S	91.7	Very high	91.1	Very high	96 Å²	96	79.8 Å²	79.8	67%	0.671	45%	0.451	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	136	-179.6	-172.4	0	0	0	0	112.3	N931 Y932 M933 S937	N931-S935 PolarHBondContact O-N 3.43Å; Y932-S935 VanDerWaalsContact O-CB 3.28Å; Y932-S935 WeakPolarHBondContact O-CB 3.41Å; Y932-S935 PolarHBondContact O-N 3.34Å; M933-S935 VanDerWaalsContact C-N 3.32Å; S935-S937 PolarHBondContact O-N 3.09Å
936	G	83.3	Confident	90.9	Very high	89 Å²	89	82 Å²	82	92%	0.918	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.4	-3.9	-174.9	0	0	0	0	0	115.7	N934	N934-G936 PolarHBondContact O-N 3.06Å
937	S	90.8	Very high	90.7	Very high	56 Å²	56	82.2 Å²	82.2	39%	0.392	47%	0.469	S	S	.	.	S	Bend	trans	-96.4	168.3	174.7	84.8	0	0	0	0	112.6	N934 S935 N939 G940	N934-S937 VanDerWaalsContact O-CB 3.28Å; N934-S937 WeakPolarHBondContact O-CB 3.49Å; N934-S937 PolarHBondContact O-N 3.03Å; N934-S937 PolarHBondContact O-OG 3.46Å; S935-S937 PolarHBondContact O-N 3.09Å; S937-N939 PolarHBondContact O-N 2.96Å; S937-N939 VanDerWaalsContact O-N 3.12Å; S937-N939 PolarHBondContact OG-N 3.27Å; S937-N939 VanDerWaalsContact OG-N 3.08Å; S937-G940 PolarHBondContact O-N 2.93Å; S937-G940 VanDerWaalsContact O-N 3.17Å; S937-G940 PolarHBondContact OG-N 3.44Å
938	R	87.9	Confident	90.5	Very high	242 Å²	242	81.6 Å²	81.6	91%	0.913	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.2	-15.9	171.7	-164.7	-177.1	68.2	178	-0.4	113.6
939	N	83.6	Confident	90.5	Very high	96 Å²	96	79.9 Å²	79.9	51%	0.513	45%	0.453	S	S	.	.	T	Hydrogen-bonded Turn	trans	-102.6	0.7	-178.4	-58.8	-3.6	0	0	0	112.6	N934 S937	N934-N939 HydrophobicContact CB-CB 4.16Å; S937-N939 PolarHBondContact O-N 2.96Å; S937-N939 VanDerWaalsContact O-N 3.12Å; S937-N939 PolarHBondContact OG-N 3.27Å; S937-N939 VanDerWaalsContact OG-N 3.08Å
940	G	83.7	Confident	90.6	Very high	21 Å²	21	78.7 Å²	78.7	22%	0.216	45%	0.446	C	S	.	.	S	Bend	trans	-81.7	161	176.4	0	0	0	0	0	112.5	N934 S937 A942	N934-G940 VanDerWaalsContact O-CA 3.3Å; N934-G940 WeakPolarHBondContact O-CA 3.33Å; N934-G940 PolarHBondContact O-N 3.02Å; S937-G940 PolarHBondContact O-N 2.93Å; S937-G940 VanDerWaalsContact O-N 3.17Å; S937-G940 PolarHBondContact OG-N 3.44Å; G940-A942 PolarHBondContact O-N 2.79Å
941	A	89.3	Confident	90.9	Very high	86 Å²	86	78.7 Å²	78.7	71%	0.711	44%	0.443	S	S	*	.	S	Bend	trans	55.2	34.5	-176.4	0	0	0	0	0	114.2	N931	N931-A941 WeakPolarHBondContact OD1-CA 3.38Å; N931-A941 PolarHBondContact OD1-N 3.4Å
942	A	93.1	Very high	91.1	Very high	41 Å²	41	81.4 Å²	81.4	34%	0.339	45%	0.453	S	S	.	.			trans	-69.3	143.2	170.9	0	0	0	0	0	111.1	L927 N931 G940	L927-A942 HydrophobicContact CD1-CB 4.49Å; N931-A942 PolarHBondContact ND2-O 3.4Å; N931-A942 PolarHBondContact OD1-N 2.87Å; G940-A942 PolarHBondContact O-N 2.79Å
943	F	90.9	Very high	91.3	Very high	210 Å²	210	72.1 Å²	72.1	92%	0.921	42%	0.416	S	S	*	.	S	Bend	trans	-86	-10.6	174.2	-66.6	-84.7	0	0	0	113.4	L927	L927-F943 WeakPolarHBondContact CD2-O 3.47Å
944	G	91.3	Very high	91.4	Very high	45 Å²	45	73.1 Å²	73.1	46%	0.464	42%	0.415	S	S	.	.			trans	-179.6	175.4	-177.9	0	0	0	0	0	110.9
945	F	94.7	Very high	91.6	Very high	60 Å²	60	75.1 Å²	75.1	26%	0.263	43%	0.425	S	S	.	.			trans	-143.1	156.3	177	58.8	-93.6	0	0	0	110.2	L923 I926 L927 Y949 L950	L923-F945 HydrophobicContact CB-CZ 4.46Å; L923-F945 HydrophobicContact CD2-CE2 4.07Å; L923-F945 HydrophobicContact CD2-CZ 3.77Å; I926-F945 HydrophobicContact CB-CE1 3.97Å; I926-F945 HydrophobicContact CB-CZ 3.79Å; I926-F945 HydrophobicContact CD1-CZ 4.49Å; I926-F945 HydrophobicContact CG2-CD1 4.48Å; I926-F945 HydrophobicContact CG2-CE1 3.62Å; I926-F945 HydrophobicContact CG2-CE2 4.15Å; I926-F945 HydrophobicContact CG2-CZ 3.42Å; I926-F945 VanDerWaalsContact CG2-CZ 3.42Å; L927-F945 HydrophobicContact CB-CD1 4.34Å; L927-F945 HydrophobicContact CB-CE1 4.02Å; L927-F945 HydrophobicContact CD1-CD1 4.08Å; F945-Y949 HydrophobicContact CD2-CD1 4.46Å; F945-L950 HydrophobicContact CE2-CD2 3.79Å; F945-L950 HydrophobicContact CE2-CG 4.3Å; F945-L950 HydrophobicContact CZ-CD2 4.21Å
946	S	93.4	Very high	91.8	Very high	60 Å²	60	72.7 Å²	72.7	42%	0.42	41%	0.407	S	S	.	.			trans	-68.3	135.9	177	177.8	0	0	0	0	111.3	S948 Y949	S946-S948 PolarHBondContact O-N 2.91Å; S946-S948 VanDerWaalsContact O-N 3.14Å; S946-S948 PolarHBondContact OG-OG 3.14Å; S946-Y949 WeakPolarHBondContact O-CB 2.78Å; S946-Y949 PolarHBondContact O-N 2.71Å
947	I	91.5	Very high	92.2	Very high	12 Å²	12	74.8 Å²	74.8	6%	0.062	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-55.1	-32.3	179.6	-81.9	-175.7	0	0	0	112.8	F919 Y949 L950 F1068 F1080	F919-I947 HydrophobicContact CE1-CD1 4.33Å; I947-Y949 PolarHBondContact O-N 3.45Å; I947-L950 HydrophobicContact CG2-CD1 4.13Å; I947-L950 VanDerWaalsContact O-CB 3.27Å; I947-L950 WeakPolarHBondContact O-CB 3.37Å; I947-L950 VanDerWaalsContact O-CG 3.23Å; I947-L950 WeakPolarHBondContact O-CG 3.46Å; I947-L950 PolarHBondContact O-N 2.95Å; I947-F1068 HydrophobicContact CD1-CB 3.72Å; I947-F1068 HydrophobicContact CD1-CD1 3.64Å; I947-F1068 HydrophobicContact CD1-CD2 3.7Å; I947-F1068 HydrophobicContact CD1-CE1 4.08Å; I947-F1068 HydrophobicContact CD1-CE2 4.13Å; I947-F1068 HydrophobicContact CD1-CG 3.42Å; I947-F1068 VanDerWaalsContact CD1-CG 3.42Å; I947-F1068 HydrophobicContact CD1-CZ 4.31Å; I947-F1068 HydrophobicContact CG1-CB 4.4Å; I947-F1068 HydrophobicContact CG1-CG 4.46Å; I947-F1080 HydrophobicContact CB-CE2 4.43Å; I947-F1080 HydrophobicContact CD1-CE2 4.2Å; I947-F1080 HydrophobicContact CD1-CZ 4.22Å; I947-F1080 HydrophobicContact CG2-CE2 4.04Å
948	S	89.9	Confident	92.3	Very high	29 Å²	29	73.4 Å²	73.4	20%	0.203	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-67.3	0.5	174.7	65.5	0	0	0	0	114.9	S946 K952 D1083	S946-S948 PolarHBondContact O-N 2.91Å; S946-S948 VanDerWaalsContact O-N 3.14Å; S946-S948 PolarHBondContact OG-OG 3.14Å; S948-K952 PolarHBondContact O-NZ 3.1Å; S948-D1083 VanDerWaalsContact CA-OD2 3.31Å; S948-D1083 WeakPolarHBondContact CA-OD2 3.19Å; S948-D1083 WeakPolarHBondContact CB-OD2 3.41Å
949	Y	95.1	Very high	92.6	Very high	91 Å²	91	67.4 Å²	67.4	36%	0.357	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-83.3	-20.3	167.2	-171	-104.8	0	0	0	113	F945 S946 I947 C951 K952 L953	F945-Y949 HydrophobicContact CD2-CD1 4.46Å; S946-Y949 WeakPolarHBondContact O-CB 2.78Å; S946-Y949 PolarHBondContact O-N 2.71Å; I947-Y949 PolarHBondContact O-N 3.45Å; Y949-C951 VanDerWaalsContact C-N 3.29Å; Y949-C951 PolarHBondContact O-N 3.33Å; Y949-K952 HydrophobicContact CD2-CB 4.04Å; Y949-K952 HydrophobicContact CD2-CD 4.11Å; Y949-K952 HydrophobicContact CE2-CB 4.03Å; Y949-K952 WeakPolarHBondContact O-CA 3.47Å; Y949-K952 WeakPolarHBondContact O-CB 3.48Å; Y949-K952 PolarHBondContact O-N 2.93Å; Y949-L953 HydrophobicContact CD1-CD2 4.24Å; Y949-L953 HydrophobicContact CE1-CD2 3.79Å; Y949-L953 PolarHBondContact O-N 3.25Å
950	L	96.7	Very high	92.9	Very high	1 Å²	1	66.7 Å²	66.7	1%	0.005	38%	0.379	C	S	.	.	G	3₁₀ helix	trans	-56.2	-42.1	-179.4	-69	177.5	0	0	0	112.3	F919 L923 I926 F945 I947 K952 L953 F1087	F919-L950 HydrophobicContact CE2-CD1 4.07Å; F919-L950 HydrophobicContact CZ-CD1 3.83Å; L923-L950 HydrophobicContact CD2-CD1 4.17Å; L923-L950 HydrophobicContact CD2-CD2 3.95Å; I926-L950 HydrophobicContact CD1-CD2 3.57Å; F945-L950 HydrophobicContact CE2-CD2 3.79Å; F945-L950 HydrophobicContact CE2-CG 4.3Å; F945-L950 HydrophobicContact CZ-CD2 4.21Å; I947-L950 HydrophobicContact CG2-CD1 4.13Å; I947-L950 VanDerWaalsContact O-CB 3.27Å; I947-L950 WeakPolarHBondContact O-CB 3.37Å; I947-L950 VanDerWaalsContact O-CG 3.23Å; I947-L950 WeakPolarHBondContact O-CG 3.46Å; I947-L950 PolarHBondContact O-N 2.95Å; L950-K952 PolarHBondContact O-N 2.57Å; L950-K952 VanDerWaalsContact O-N 3.17Å; L950-L953 HydrophobicContact CD2-CD1 4.01Å; L950-L953 WeakPolarHBondContact O-CB 3.24Å; L950-L953 WeakPolarHBondContact O-CG 3.35Å; L950-L953 PolarHBondContact O-N 2.99Å; L950-F1087 HydrophobicContact CB-CB 4.03Å; L950-F1087 HydrophobicContact CB-CD1 4.2Å; L950-F1087 HydrophobicContact CB-CD2 3.61Å; L950-F1087 HydrophobicContact CB-CE2 4.08Å; L950-F1087 HydrophobicContact CB-CG 3.66Å; L950-F1087 HydrophobicContact CD1-CD1 3.86Å; L950-F1087 HydrophobicContact CD1-CE1 4.1Å; L950-F1087 HydrophobicContact CD1-CG 4.17Å; L950-F1087 HydrophobicContact CD2-CE1 4.39Å; L950-F1087 HydrophobicContact CD2-CE2 4.23Å; L950-F1087 HydrophobicContact CD2-CZ 4.12Å; L950-F1087 HydrophobicContact CG-CD1 4.49Å; L950-F1087 HydrophobicContact CG-CG 4.42Å
951	C	95.3	Very high	93.1	Very high	20 Å²	20	71.6 Å²	71.6	14%	0.135	40%	0.4	C	S	.	.	G	3₁₀ helix	trans	-59.1	-25.5	174.5	-67.5	0	0	0	0	114.1	Y949 D1083 M1090	Y949-C951 VanDerWaalsContact C-N 3.29Å; Y949-C951 PolarHBondContact O-N 3.33Å; C951-D1083 PolarHBondContact SG-O 2.85Å; C951-D1083 PolarHBondContact SG-OD1 3.11Å; C951-M1090 HydrophobicContact CB-CE 3.87Å
952	K	96.1	Very high	92.9	Very high	97 Å²	97	75.2 Å²	75.2	42%	0.422	40%	0.4	S	S	.	.	G	3₁₀ helix	trans	-92.3	-5.5	-173.7	-62.1	164.9	-172.9	130.8	0	113	S948 Y949 L950 R954 D955	S948-K952 PolarHBondContact O-NZ 3.1Å; Y949-K952 HydrophobicContact CD2-CB 4.04Å; Y949-K952 HydrophobicContact CD2-CD 4.11Å; Y949-K952 HydrophobicContact CE2-CB 4.03Å; Y949-K952 WeakPolarHBondContact O-CA 3.47Å; Y949-K952 WeakPolarHBondContact O-CB 3.48Å; Y949-K952 PolarHBondContact O-N 2.93Å; L950-K952 PolarHBondContact O-N 2.57Å; L950-K952 VanDerWaalsContact O-N 3.17Å; K952-R954 PolarHBondContact O-N 3.44Å; K952-D955 PolarHBondContact O-N 3.41Å
953	L	96	Very high	92.9	Very high	2 Å²	2	75.8 Å²	75.8	1%	0.01	40%	0.395	C	S	.	.	G	3₁₀ helix	trans	-61.1	-23.8	172.1	-64.4	171.8	0	0	0	112.4	I926 Y949 L950 L965 L966 L969 F1087	I926-L953 HydrophobicContact CD1-CD1 3.88Å; I926-L953 HydrophobicContact CG1-CD1 4.24Å; I926-L953 HydrophobicContact CG2-CD1 4.14Å; I926-L953 HydrophobicContact CG2-CD2 4.02Å; Y949-L953 HydrophobicContact CD1-CD2 4.24Å; Y949-L953 HydrophobicContact CE1-CD2 3.79Å; Y949-L953 PolarHBondContact O-N 3.25Å; L950-L953 HydrophobicContact CD2-CD1 4.01Å; L950-L953 WeakPolarHBondContact O-CB 3.24Å; L950-L953 WeakPolarHBondContact O-CG 3.35Å; L950-L953 PolarHBondContact O-N 2.99Å; L953-L965 HydrophobicContact CD2-CD2 3.97Å; L953-L965 HydrophobicContact CD2-CG 4.38Å; L953-L965 WeakPolarHBondContact O-CB 3.21Å; L953-L966 HydrophobicContact CB-CB 4.03Å; L953-L966 HydrophobicContact CB-CD1 4.34Å; L953-L966 PolarHBondContact O-N 3.32Å; L953-L969 HydrophobicContact CD1-CD1 3.97Å; L953-L969 HydrophobicContact CD2-CD1 4.04Å; L953-L969 HydrophobicContact CG-CD1 4.44Å; L953-F1087 HydrophobicContact CD1-CE2 4.07Å
954	R	95.1	Very high	93.2	Very high	125 Å²	125	66.6 Å²	66.6	47%	0.472	36%	0.356	S	S	.	.	G	3₁₀ helix	trans	-74	-25.5	173.7	-171.5	-173.9	61.8	-168.9	-10.1	113	K952 T964 L966 M1090	K952-R954 PolarHBondContact O-N 3.44Å; R954-T964 HydrophobicContact CG-CG2 4.25Å; R954-T964 VanDerWaalsContact O-CB 3.29Å; R954-T964 WeakPolarHBondContact O-CB 3.32Å; R954-T964 WeakPolarHBondContact O-CG2 2.96Å; R954-L966 HydrophobicContact CB-CB 4.47Å; R954-L966 HydrophobicContact CB-CD2 4.18Å; R954-M1090 PolarHBondContact NH1-SD 2.89Å
955	D	95.1	Very high	93.4	Very high	98 Å²	98	65.3 Å²	65.3	52%	0.524	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-22.9	-171.4	-54.6	-26.5	0	0	0	112	K952	K952-D955 PolarHBondContact O-N 3.41Å
956	T	94.1	Very high	93.6	Very high	46 Å²	46	62.6 Å²	62.6	28%	0.282	33%	0.327	S	S	.	.	S	Bend	trans	-78.4	121.1	171.3	-57.9	0	0	0	0	109.7	M933 T964 L965	M933-T956 HydrophobicContact CE-CG2 3.94Å; T956-T964 CarbonylContact O-C 3.59Å; T956-T964 WeakPolarHBondContact O-CA 3.42Å; T956-T964 WeakPolarHBondContact O-CB 3.23Å; T956-L965 HydrophobicContact CG2-CB 4.02Å; T956-L965 HydrophobicContact CG2-CD2 4.27Å; T956-L965 PolarHBondContact O-N 2.98Å
957	K	93.8	Very high	93.8	Very high	132 Å²	132	60.8 Å²	60.8	57%	0.574	31%	0.312	S	S	*	.	B	Isolated β-bridge	trans	-109.4	156.9	-175.2	-59.6	-168.5	177.9	-171.8	0	113.1	L961 Q963 T964	K957-L961 HydrophobicContact CB-CD2 4Å; K957-L961 HydrophobicContact CD-CD2 4.05Å; K957-Q963 WeakPolarHBondContact CA-O 3.07Å; K957-T964 HydrophobicContact CG-CG2 4.49Å
958	S	91.3	Very high	94	Very high	27 Å²	27	64.8 Å²	64.8	19%	0.189	33%	0.329	C	S	.	.			trans	-65.2	158.9	167.8	59.5	0	0	0	0	111.6	D960 L961 K962 Q963	S958-D960 VanDerWaalsContact CB-OD1 3.32Å; S958-D960 WeakPolarHBondContact CB-OD1 3.37Å; S958-D960 PolarHBondContact O-N 3.37Å; S958-D960 PolarHBondContact OG-OD1 3.38Å; S958-L961 WeakPolarHBondContact O-CA 3.4Å; S958-L961 PolarHBondContact O-N 2.89Å; S958-L961 PolarHBondContact OG-N 3.26Å; S958-K962 PolarHBondContact OG-N 3.29Å; S958-Q963 PolarHBondContact N-O 3.46Å; S958-Q963 PolarHBondContact OG-N 3.26Å; S958-Q963 VanDerWaalsContact OG-N 3.14Å; S958-Q963 PolarHBondContact OG-O 3.16Å
959	A	94.2	Very high	94.4	Very high	116 Å²	116	63.5 Å²	63.5	96%	0.959	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.9	-25.2	179.3	0	0	0	0	0	114
960	D	89.6	Confident	94.5	Very high	81 Å²	81	59.2 Å²	59.2	43%	0.433	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	5	173.8	71.8	-18.5	0	0	0	113.6	S958 K962	S958-D960 VanDerWaalsContact CB-OD1 3.32Å; S958-D960 WeakPolarHBondContact CB-OD1 3.37Å; S958-D960 PolarHBondContact O-N 3.37Å; S958-D960 PolarHBondContact OG-OD1 3.38Å; D960-K962 HydrophobicContact CB-CG 4.41Å; D960-K962 PolarHBondContact O-N 3.1Å; D960-K962 PolarHBondContact OD1-N 2.97Å; D960-K962 VanDerWaalsContact OD2-CD 3.31Å; D960-K962 WeakPolarHBondContact OD2-CD 3.4Å; D960-K962 WeakPolarHBondContact OD2-CE 3.39Å; D960-K962 WeakPolarHBondContact OD2-CG 3.46Å; D960-K962 IonicContact OD2-NZ 3.12Å; D960-K962 PolarHBondContact OD2-NZ 2.94Å
961	L	89.1	Confident	94.4	Very high	125 Å²	125	59.9 Å²	59.9	65%	0.654	31%	0.306	S	S	*	.	S	Bend	trans	58.6	4.7	-178.6	-54.1	176.6	0	0	0	116.2	K957 S958 Q963	K957-L961 HydrophobicContact CB-CD2 4Å; K957-L961 HydrophobicContact CD-CD2 4.05Å; S958-L961 WeakPolarHBondContact O-CA 3.4Å; S958-L961 PolarHBondContact O-N 2.89Å; S958-L961 PolarHBondContact OG-N 3.26Å; L961-Q963 PolarHBondContact O-N 3.2Å
962	K	85.8	Confident	94.4	Very high	162 Å²	162	60 Å²	60	70%	0.704	31%	0.307	S	S	*	.	S	Bend	trans	-74.9	-19.3	-177.6	-62.8	-166.5	-157.6	114.6	0	114.7	S958 D960	S958-K962 PolarHBondContact OG-N 3.29Å; D960-K962 HydrophobicContact CB-CG 4.41Å; D960-K962 PolarHBondContact O-N 3.1Å; D960-K962 PolarHBondContact OD1-N 2.97Å; D960-K962 VanDerWaalsContact OD2-CD 3.31Å; D960-K962 WeakPolarHBondContact OD2-CD 3.4Å; D960-K962 WeakPolarHBondContact OD2-CE 3.39Å; D960-K962 WeakPolarHBondContact OD2-CG 3.46Å; D960-K962 IonicContact OD2-NZ 3.12Å; D960-K962 PolarHBondContact OD2-NZ 2.94Å
963	Q	92.3	Very high	94.3	Very high	53 Å²	53	55.4 Å²	55.4	25%	0.248	29%	0.286	C	S	.	.			trans	-145.7	172	-179.5	65.4	178.6	-30.7	0	0	112.3	K957 S958 L961 H967 R1101	K957-Q963 WeakPolarHBondContact CA-O 3.07Å; S958-Q963 PolarHBondContact N-O 3.46Å; S958-Q963 PolarHBondContact OG-N 3.26Å; S958-Q963 VanDerWaalsContact OG-N 3.14Å; S958-Q963 PolarHBondContact OG-O 3.16Å; L961-Q963 PolarHBondContact O-N 3.2Å; Q963-H967 HydrophobicContact CB-CB 4.12Å; Q963-R1101 VanDerWaalsContact CD-NH1 3.29Å
964	T	97.1	Very high	94.2	Very high	17 Å²	17	58.1 Å²	58.1	10%	0.104	30%	0.301	C	S	.	.	B	Isolated β-bridge	trans	-117.1	165.9	178.3	72.3	0	0	0	0	111.1	R954 T956 K957 L966 H967 F968	R954-T964 HydrophobicContact CG-CG2 4.25Å; R954-T964 VanDerWaalsContact O-CB 3.29Å; R954-T964 WeakPolarHBondContact O-CB 3.32Å; R954-T964 WeakPolarHBondContact O-CG2 2.96Å; T956-T964 CarbonylContact O-C 3.59Å; T956-T964 WeakPolarHBondContact O-CA 3.42Å; T956-T964 WeakPolarHBondContact O-CB 3.23Å; K957-T964 HydrophobicContact CG-CG2 4.49Å; T964-L966 PolarHBondContact O-N 2.88Å; T964-L966 PolarHBondContact OG1-N 3.44Å; T964-H967 WeakPolarHBondContact O-CB 3.3Å; T964-H967 PolarHBondContact O-N 3.48Å; T964-H967 VanDerWaalsContact O-N 3.1Å; T964-H967 PolarHBondContact OG1-N 3.43Å; T964-H967 PolarHBondContact OG1-ND1 3.47Å; T964-F968 PolarHBondContact O-N 3.15Å
965	L	96.3	Very high	94	Very high	17 Å²	17	57.8 Å²	57.8	9%	0.089	31%	0.305	C	S	.	.	H	α-helix	trans	-60.3	-34.6	173.8	176.2	59.1	0	0	0	111.1	V929 M933 L953 T956 F968 L969	V929-L965 HydrophobicContact CG1-CD1 3.8Å; M933-L965 HydrophobicContact CE-CD1 4.46Å; M933-L965 HydrophobicContact CE-CD2 4.21Å; M933-L965 HydrophobicContact SD-CD1 3.7Å; M933-L965 HydrophobicContact SD-CD2 3.92Å; M933-L965 HydrophobicContact SD-CG 4.44Å; L953-L965 HydrophobicContact CD2-CD2 3.97Å; L953-L965 HydrophobicContact CD2-CG 4.38Å; L953-L965 WeakPolarHBondContact O-CB 3.21Å; T956-L965 HydrophobicContact CG2-CB 4.02Å; T956-L965 HydrophobicContact CG2-CD2 4.27Å; T956-L965 PolarHBondContact O-N 2.98Å; L965-F968 HydrophobicContact CD1-CD1 4.29Å; L965-F968 PolarHBondContact O-N 3.45Å; L965-L969 HydrophobicContact CD1-CD1 4.13Å; L965-L969 HydrophobicContact CD1-CG 4.14Å; L965-L969 HydrophobicContact CG-CD1 3.89Å; L965-L969 HydrophobicContact CG-CG 4.41Å; L965-L969 WeakPolarHBondContact O-CB 3.34Å; L965-L969 WeakPolarHBondContact O-CD1 3.29Å; L965-L969 VanDerWaalsContact O-CG 3.25Å; L965-L969 WeakPolarHBondContact O-CG 3.38Å; L965-L969 PolarHBondContact O-N 2.99Å
966	L	97.9	Very high	94	Very high	3 Å²	3	59 Å²	59	2%	0.016	31%	0.308	C	S	.	.	H	α-helix	trans	-60.8	-43.4	171.5	-175.7	60.9	0	0	0	112.7	L953 R954 T964 L969 A970 F1087 M1090 F1091 A1094	L953-L966 HydrophobicContact CB-CB 4.03Å; L953-L966 HydrophobicContact CB-CD1 4.34Å; L953-L966 PolarHBondContact O-N 3.32Å; R954-L966 HydrophobicContact CB-CB 4.47Å; R954-L966 HydrophobicContact CB-CD2 4.18Å; T964-L966 PolarHBondContact O-N 2.88Å; T964-L966 PolarHBondContact OG1-N 3.44Å; L966-L969 PolarHBondContact O-N 2.97Å; L966-A970 VanDerWaalsContact O-CB 3.3Å; L966-A970 WeakPolarHBondContact O-CB 3.48Å; L966-A970 PolarHBondContact O-N 3.27Å; L966-F1087 HydrophobicContact CD1-CD2 4.45Å; L966-F1087 HydrophobicContact CD1-CE2 3.74Å; L966-M1090 HydrophobicContact CD2-CB 3.74Å; L966-F1091 HydrophobicContact CD1-CB 4.46Å; L966-F1091 HydrophobicContact CD1-CD2 4Å; L966-A1094 HydrophobicContact CD2-CB 4.41Å; L966-A1094 HydrophobicContact CG-CB 4.1Å
967	H	97.6	Very high	93.9	Very high	22 Å²	22	59.5 Å²	59.5	10%	0.102	31%	0.306	C	S	.	.	H	α-helix	trans	-62.3	-45.5	174	-74.6	94.8	0	0	0	111.7	Q963 T964 L969 A970 D971 A1094 E1097 N1098	Q963-H967 HydrophobicContact CB-CB 4.12Å; T964-H967 WeakPolarHBondContact O-CB 3.3Å; T964-H967 PolarHBondContact O-N 3.48Å; T964-H967 VanDerWaalsContact O-N 3.1Å; T964-H967 PolarHBondContact OG1-N 3.43Å; T964-H967 PolarHBondContact OG1-ND1 3.47Å; H967-L969 PolarHBondContact O-N 2.96Å; H967-A970 PolarHBondContact O-N 2.61Å; H967-D971 PolarHBondContact O-N 2.95Å; H967-A1094 PolarHBondContact CD2-O 3.03Å; H967-E1097 IonicContact CE1-OE2 3.58Å; H967-E1097 WeakPolarHBondContact NE2-CB 3.3Å; H967-E1097 IonicContact NE2-OE2 3.96Å; H967-E1097 PolarHBondContact NE2-OE2 3.45Å; H967-N1098 WeakPolarHBondContact CB-OD1 3.48Å; H967-N1098 PolarHBondContact CD2-OD1 3.07Å; H967-N1098 VanDerWaalsContact CD2-OD1 3.31Å; H967-N1098 PolarHBondContact O-ND2 2.99Å
968	F	96.6	Very high	93.9	Very high	97 Å²	97	56.9 Å²	56.9	43%	0.425	30%	0.303	S	S	.	.	H	α-helix	trans	-60	-46	176.9	178.3	-97.2	0	0	0	112	V929 T964 L965 D971 V972	V929-F968 HydrophobicContact CG1-CE1 4.46Å; T964-F968 PolarHBondContact O-N 3.15Å; L965-F968 HydrophobicContact CD1-CD1 4.29Å; L965-F968 PolarHBondContact O-N 3.45Å; F968-D971 PolarHBondContact O-N 2.94Å; F968-V972 HydrophobicContact CD1-CG2 4.29Å; F968-V972 HydrophobicContact CE1-CG2 3.87Å; F968-V972 HydrophobicContact CE2-CG2 4.2Å; F968-V972 HydrophobicContact CZ-CG2 3.82Å; F968-V972 WeakPolarHBondContact O-CG2 3.48Å; F968-V972 PolarHBondContact O-N 3Å
969	L	97.1	Very high	93.9	Very high	2 Å²	2	59 Å²	59	1%	0.01	31%	0.312	C	S	.	.	H	α-helix	trans	-62.6	-42	176.6	-74.2	162.2	0	0	0	112.3	I925 I926 V929 L953 L965 L966 H967 V972 C973	I925-L969 HydrophobicContact CG2-CD2 4.04Å; I926-L969 HydrophobicContact CG1-CD1 3.96Å; I926-L969 HydrophobicContact CG1-CD2 4.11Å; V929-L969 HydrophobicContact CB-CD2 4.18Å; V929-L969 HydrophobicContact CG1-CD2 4.45Å; V929-L969 HydrophobicContact CG2-CD2 4.01Å; L953-L969 HydrophobicContact CD1-CD1 3.97Å; L953-L969 HydrophobicContact CD2-CD1 4.04Å; L953-L969 HydrophobicContact CG-CD1 4.44Å; L965-L969 HydrophobicContact CD1-CD1 4.13Å; L965-L969 HydrophobicContact CD1-CG 4.14Å; L965-L969 HydrophobicContact CG-CD1 3.89Å; L965-L969 HydrophobicContact CG-CG 4.41Å; L965-L969 WeakPolarHBondContact O-CB 3.34Å; L965-L969 WeakPolarHBondContact O-CD1 3.29Å; L965-L969 VanDerWaalsContact O-CG 3.25Å; L965-L969 WeakPolarHBondContact O-CG 3.38Å; L965-L969 PolarHBondContact O-N 2.99Å; L966-L969 PolarHBondContact O-N 2.97Å; H967-L969 PolarHBondContact O-N 2.96Å; L969-V972 PolarHBondContact O-N 3.38Å; L969-C973 WeakPolarHBondContact O-CB 3.49Å; L969-C973 PolarHBondContact O-N 3.48Å; L969-C973 PolarHBondContact O-SG 2.84Å
970	A	97	Very high	93.9	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-62.7	-41.5	176.9	0	0	0	0	0	112.1	L966 H967 N974 F1091 A1094 V1095	L966-A970 VanDerWaalsContact O-CB 3.3Å; L966-A970 WeakPolarHBondContact O-CB 3.48Å; L966-A970 PolarHBondContact O-N 3.27Å; H967-A970 PolarHBondContact O-N 2.61Å; A970-N974 WeakPolarHBondContact O-CB 3.49Å; A970-N974 PolarHBondContact O-N 3.49Å; A970-F1091 HydrophobicContact CB-CD2 4.47Å; A970-F1091 HydrophobicContact CB-CE2 4.06Å; A970-F1091 HydrophobicContact CB-CZ 4.14Å; A970-A1094 HydrophobicContact CB-CB 4.3Å; A970-V1095 HydrophobicContact CB-CG2 3.88Å
971	D	95.1	Very high	94.1	Very high	15 Å²	15	51.6 Å²	51.6	8%	0.08	26%	0.256	C	S	.	.	H	α-helix	trans	-68.7	-43	175.7	-102.8	-13.1	0	0	0	112.3	H967 F968 C973 N974 E975 N1098 R1101 K1102	H967-D971 PolarHBondContact O-N 2.95Å; F968-D971 PolarHBondContact O-N 2.94Å; D971-C973 VanDerWaalsContact C-N 3.31Å; D971-C973 PolarHBondContact O-N 3.25Å; D971-N974 PolarHBondContact O-N 2.72Å; D971-E975 WeakPolarHBondContact O-CB 3.46Å; D971-E975 WeakPolarHBondContact O-CG 3.32Å; D971-E975 PolarHBondContact O-N 3.34Å; D971-N1098 VanDerWaalsContact CG-CG 3.46Å; D971-N1098 PolarHBondContact N-ND2 3.47Å; D971-N1098 WeakPolarHBondContact OD1-CB 3.29Å; D971-N1098 PolarHBondContact OD1-ND2 3.23Å; D971-N1098 PolarHBondContact OD2-ND2 3.08Å; D971-R1101 IonicContact OD2-CZ 3.11Å; D971-R1101 IonicContact OD2-NH2 3.36Å; D971-R1101 PolarHBondContact OD2-NH2 3.2Å; D971-K1102 WeakPolarHBondContact OD1-CE 3.29Å; D971-K1102 IonicContact OD1-NZ 3.28Å; D971-K1102 PolarHBondContact OD1-NZ 3.23Å; D971-K1102 VanDerWaalsContact OD2-CE 3.29Å; D971-K1102 WeakPolarHBondContact OD2-CE 3.47Å; D971-K1102 IonicContact OD2-NZ 4Å; D971-K1102 PolarHBondContact OD2-NZ 3.38Å
972	V	94.4	Very high	94.2	Very high	23 Å²	23	51.3 Å²	51.3	14%	0.139	25%	0.249	C	C	.	.	H	α-helix	trans	-61.3	-39.5	175.5	169.2	0	0	0	0	111.5	F968 L969 Q976	F968-V972 HydrophobicContact CD1-CG2 4.29Å; F968-V972 HydrophobicContact CE1-CG2 3.87Å; F968-V972 HydrophobicContact CE2-CG2 4.2Å; F968-V972 HydrophobicContact CZ-CG2 3.82Å; F968-V972 WeakPolarHBondContact O-CG2 3.48Å; F968-V972 PolarHBondContact O-N 3Å; L969-V972 PolarHBondContact O-N 3.38Å; V972-Q976 WeakPolarHBondContact O-CB 3.36Å; V972-Q976 PolarHBondContact O-N 2.87Å
973	C	95.6	Very high	94.7	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-64.3	-48.1	173.4	-66.2	0	0	0	0	111.2	L969 D971 E975 H977 V980 M981 F1091	L969-C973 WeakPolarHBondContact O-CB 3.49Å; L969-C973 PolarHBondContact O-N 3.48Å; L969-C973 PolarHBondContact O-SG 2.84Å; D971-C973 VanDerWaalsContact C-N 3.31Å; D971-C973 PolarHBondContact O-N 3.25Å; C973-E975 VanDerWaalsContact C-N 3.31Å; C973-E975 PolarHBondContact O-N 2.93Å; C973-H977 CarbonylContact O-C 3.6Å; C973-H977 VanDerWaalsContact O-CA 3.3Å; C973-H977 WeakPolarHBondContact O-CA 3.37Å; C973-H977 PolarHBondContact O-N 3.3Å; C973-V980 HydrophobicContact CB-CB 4.36Å; C973-V980 HydrophobicContact CB-CG1 4.27Å; C973-M981 HydrophobicContact CB-SD 3.88Å; C973-F1091 HydrophobicContact CB-CZ 4.28Å
974	N	93.1	Very high	94.9	Very high	60 Å²	60	42 Å²	42	32%	0.321	21%	0.21	S	C	.	.	H	α-helix	trans	-63.1	-34.5	-178.4	-165.5	38.9	0	0	0	113.2	A970 D971 M981	A970-N974 WeakPolarHBondContact O-CB 3.49Å; A970-N974 PolarHBondContact O-N 3.49Å; D971-N974 PolarHBondContact O-N 2.72Å; N974-M981 HydrophobicContact CB-CE 3.75Å; N974-M981 HydrophobicContact CB-SD 3.86Å
975	E	91.9	Very high	94.8	Very high	117 Å²	117	47.9 Å²	47.9	55%	0.547	24%	0.236	S	C	.	.	H	α-helix	trans	-85.9	-41.4	-179	-71.4	176.5	-169.1	0	0	114.1	D971 C973 K1102	D971-E975 WeakPolarHBondContact O-CB 3.46Å; D971-E975 WeakPolarHBondContact O-CG 3.32Å; D971-E975 PolarHBondContact O-N 3.34Å; C973-E975 VanDerWaalsContact C-N 3.31Å; C973-E975 PolarHBondContact O-N 2.93Å; E975-K1102 WeakPolarHBondContact OE1-CE 3.21Å; E975-K1102 IonicContact OE1-NZ 2.7Å; E975-K1102 PolarHBondContact OE1-NZ 3.12Å
976	Q	93.5	Very high	94.7	Very high	125 Å²	125	50.3 Å²	50.3	58%	0.584	25%	0.247	S	C	*	.	H	α-helix	trans	-111.2	-21.8	-168.2	-54.5	-173.2	24.6	0	0	113.3	V972	V972-Q976 WeakPolarHBondContact O-CB 3.36Å; V972-Q976 PolarHBondContact O-N 2.87Å
977	H	93	Very high	94.6	Very high	55 Å²	55	50.4 Å²	50.4	26%	0.255	25%	0.247	S	C	.	.			trans	-136.9	60.1	-178	-54.6	-42.1	0	0	0	112.2	I925 C973 D979 V980	I925-H977 HydrophobicContact CD1-CB 4.34Å; I925-H977 WeakPolarHBondContact CD1-CD2 3.45Å; C973-H977 CarbonylContact O-C 3.6Å; C973-H977 VanDerWaalsContact O-CA 3.3Å; C973-H977 WeakPolarHBondContact O-CA 3.37Å; C973-H977 PolarHBondContact O-N 3.3Å; H977-D979 WeakPolarHBondContact CA-OD1 3.37Å; H977-D979 PolarHBondContact O-N 3.06Å; H977-V980 HydrophobicContact CB-CB 4.4Å; H977-V980 HydrophobicContact CB-CG2 3.76Å; H977-V980 VanDerWaalsContact O-CB 3.28Å; H977-V980 WeakPolarHBondContact O-CB 3.49Å; H977-V980 PolarHBondContact O-N 3.12Å
978	P	92.8	Very high	94.6	Very high	77 Å²	77	54.5 Å²	54.5	50%	0.5	27%	0.269	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-17.2	-171.6	-20.7	33.6	0	0	0	114.2	V980 M981	P978-V980 VanDerWaalsContact C-N 3.3Å; P978-M981 WeakPolarHBondContact O-CB 3.29Å; P978-M981 PolarHBondContact O-N 3.34Å
979	D	91.5	Very high	94.6	Very high	72 Å²	72	51.8 Å²	51.8	39%	0.385	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-35.9	169.8	60.2	-45.2	0	0	0	112.4	T918 K921 H977 M981 K982	T918-D979 WeakPolarHBondContact CG2-O 3.48Å; K921-D979 WeakPolarHBondContact CD-OD2 3.47Å; K921-D979 IonicContact NZ-OD1 3.88Å; K921-D979 PolarHBondContact NZ-OD1 2.64Å; K921-D979 IonicContact NZ-OD2 2.72Å; K921-D979 PolarHBondContact NZ-OD2 2.81Å; H977-D979 WeakPolarHBondContact CA-OD1 3.37Å; H977-D979 PolarHBondContact O-N 3.06Å; D979-M981 PolarHBondContact O-N 3.16Å; D979-K982 PolarHBondContact O-N 2.8Å
980	V	94	Very high	94.7	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-61.2	-31.5	177.7	177.2	0	0	0	0	111.8	K921 L922 I925 C973 H977 P978 K982 F983	K921-V980 HydrophobicContact CB-CG2 4.11Å; K921-V980 HydrophobicContact CD-CG2 3.59Å; K921-V980 HydrophobicContact CG-CG2 3.78Å; L922-V980 HydrophobicContact CB-CG1 3.76Å; L922-V980 HydrophobicContact CD1-CG1 4.07Å; L922-V980 HydrophobicContact CD2-CG1 4.38Å; L922-V980 HydrophobicContact CG-CG1 4.28Å; I925-V980 HydrophobicContact CD1-CG2 4.02Å; C973-V980 HydrophobicContact CB-CB 4.36Å; C973-V980 HydrophobicContact CB-CG1 4.27Å; H977-V980 HydrophobicContact CB-CB 4.4Å; H977-V980 HydrophobicContact CB-CG2 3.76Å; H977-V980 VanDerWaalsContact O-CB 3.28Å; H977-V980 WeakPolarHBondContact O-CB 3.49Å; H977-V980 PolarHBondContact O-N 3.12Å; P978-V980 VanDerWaalsContact C-N 3.3Å; V980-K982 PolarHBondContact O-N 3.07Å; V980-F983 WeakPolarHBondContact O-CD1 3.46Å; V980-F983 PolarHBondContact O-N 3.11Å
981	M	93.9	Very high	94.7	Very high	41 Å²	41	56.1 Å²	56.1	20%	0.202	28%	0.278	C	S	.	.	G	3₁₀ helix	trans	-60.8	-17.1	-175.3	-57.5	-62.5	-71.7	0	0	113.6	C973 N974 P978 D979 P984 F1091 V1095	C973-M981 HydrophobicContact CB-SD 3.88Å; N974-M981 HydrophobicContact CB-CE 3.75Å; N974-M981 HydrophobicContact CB-SD 3.86Å; P978-M981 WeakPolarHBondContact O-CB 3.29Å; P978-M981 PolarHBondContact O-N 3.34Å; D979-M981 PolarHBondContact O-N 3.16Å; M981-P984 WeakPolarHBondContact O-CD 3.14Å; M981-F1091 HydrophobicContact CE-CE1 4.45Å; M981-F1091 HydrophobicContact SD-CE1 4.2Å; M981-F1091 HydrophobicContact SD-CZ 4.23Å; M981-V1095 HydrophobicContact CE-CB 4.36Å; M981-V1095 HydrophobicContact CE-CG1 3.75Å; M981-V1095 HydrophobicContact CE-CG2 3.57Å
982	K	92.6	Very high	94.7	Very high	120 Å²	120	60.9 Å²	60.9	52%	0.522	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-84.5	-7.9	178.1	-60.3	-174.7	178.3	-175.1	0	114.6	D979 V980 P984 E985 E986	D979-K982 PolarHBondContact O-N 2.8Å; V980-K982 PolarHBondContact O-N 3.07Å; K982-P984 VanDerWaalsContact O-N 3.08Å; K982-E985 WeakPolarHBondContact O-CA 3.32Å; K982-E985 VanDerWaalsContact O-CB 3.3Å; K982-E985 WeakPolarHBondContact O-CB 3.46Å; K982-E985 PolarHBondContact O-N 3.36Å; K982-E986 PolarHBondContact O-N 3.36Å
983	F	95.6	Very high	94.9	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-53.1	-31.4	-178.7	93.9	-93.1	0	0	0	114.8	T918 F919 L922 V980 E985 E986 L987 F1087 I1088 F1091	T918-F983 VanDerWaalsContact OG1-CA 3.3Å; T918-F983 WeakPolarHBondContact OG1-CA 3.33Å; T918-F983 VanDerWaalsContact OG1-CB 3.28Å; T918-F983 WeakPolarHBondContact OG1-CB 3.31Å; F919-F983 HydrophobicContact CB-CB 4.27Å; F919-F983 HydrophobicContact CB-CD2 4.33Å; F919-F983 AromaticContact CD2-CD2 3.68Å; F919-F983 HydrophobicContact CD2-CD2 3.68Å; F919-F983 AromaticContact CD2-CE2 3.87Å; F919-F983 HydrophobicContact CD2-CE2 3.87Å; F919-F983 HydrophobicContact CD2-CG 4.46Å; F919-F983 HydrophobicContact CE2-CE2 4.32Å; F919-F983 HydrophobicContact CG-CD2 4.46Å; L922-F983 HydrophobicContact CD2-CD1 3.65Å; L922-F983 HydrophobicContact CD2-CD2 4.48Å; L922-F983 HydrophobicContact CD2-CE1 3.31Å; L922-F983 HydrophobicContact CD2-CE2 4.18Å; L922-F983 HydrophobicContact CD2-CG 4.25Å; L922-F983 HydrophobicContact CD2-CZ 3.61Å; V980-F983 WeakPolarHBondContact O-CD1 3.46Å; V980-F983 PolarHBondContact O-N 3.11Å; F983-E985 VanDerWaalsContact C-N 3.28Å; F983-E985 PolarHBondContact O-N 3.3Å; F983-E986 PolarHBondContact O-N 3.34Å; F983-L987 HydrophobicContact CD2-CD1 3.83Å; F983-L987 HydrophobicContact CE2-CD1 4.32Å; F983-L987 VanDerWaalsContact O-CG 3.32Å; F983-L987 WeakPolarHBondContact O-CG 3.48Å; F983-L987 PolarHBondContact O-N 3.18Å; F983-F1087 HydrophobicContact CE2-CD1 4.39Å; F983-F1087 AromaticContact CE2-CE1 3.98Å; F983-F1087 HydrophobicContact CE2-CE1 3.98Å; F983-F1087 HydrophobicContact CZ-CD1 4.29Å; F983-F1087 AromaticContact CZ-CE1 3.65Å; F983-F1087 HydrophobicContact CZ-CE1 3.65Å; F983-F1087 HydrophobicContact CZ-CZ 4.35Å; F983-I1088 HydrophobicContact CE2-CG1 3.77Å; F983-I1088 HydrophobicContact CZ-CG1 4.42Å; F983-F1091 AromaticContact CE1-CD1 3.64Å; F983-F1091 HydrophobicContact CE1-CD1 3.64Å; F983-F1091 HydrophobicContact CE1-CD2 4.2Å; F983-F1091 AromaticContact CE1-CE1 3.8Å; F983-F1091 HydrophobicContact CE1-CE1 3.8Å; F983-F1091 HydrophobicContact CE1-CE2 4.34Å; F983-F1091 AromaticContact CE1-CG 3.86Å; F983-F1091 HydrophobicContact CE1-CG 3.86Å; F983-F1091 HydrophobicContact CE1-CZ 4.15Å; F983-F1091 HydrophobicContact CZ-CB 4.27Å; F983-F1091 HydrophobicContact CZ-CD1 4.21Å; F983-F1091 HydrophobicContact CZ-CG 4.08Å
984	P	96.4	Very high	95	Very high	19 Å²	19	60.9 Å²	60.9	12%	0.123	30%	0.298	C	S	.	.	H	α-helix	trans	-69	-23.7	173.9	-21.2	36.6	0	0	0	114.2	M981 K982 E986 I1088 Q1092	M981-P984 WeakPolarHBondContact O-CD 3.14Å; K982-P984 VanDerWaalsContact O-N 3.08Å; P984-E986 VanDerWaalsContact C-N 3.35Å; P984-I1088 HydrophobicContact CB-CG2 3.88Å; P984-I1088 HydrophobicContact CG-CG2 4.32Å; P984-Q1092 HydrophobicContact CB-CG 4.41Å; P984-Q1092 HydrophobicContact CG-CG 4.12Å
985	E	93.8	Very high	95.1	Very high	141 Å²	141	66.3 Å²	66.3	66%	0.659	31%	0.314	S	S	*	.	H	α-helix	trans	-80.1	-19.6	176.4	-52.5	178.7	166.1	0	0	111.7	K982 F983 I988	K982-E985 WeakPolarHBondContact O-CA 3.32Å; K982-E985 VanDerWaalsContact O-CB 3.3Å; K982-E985 WeakPolarHBondContact O-CB 3.46Å; K982-E985 PolarHBondContact O-N 3.36Å; F983-E985 VanDerWaalsContact C-N 3.28Å; F983-E985 PolarHBondContact O-N 3.3Å; E985-I988 WeakPolarHBondContact O-CG2 3.43Å
986	E	95.3	Very high	95.3	Very high	67 Å²	67	61 Å²	61	31%	0.313	29%	0.29	S	S	.	.	H	α-helix	trans	-86.1	-15	175	-68.8	173.7	-141	0	0	113.2	E912 S916 T918 K982 F983 P984	E912-E986 VanDerWaalsContact CB-O 3.31Å; E912-E986 WeakPolarHBondContact CB-O 3.38Å; E912-E986 VanDerWaalsContact CG-O 3.3Å; E912-E986 WeakPolarHBondContact CG-O 3.25Å; S916-E986 WeakPolarHBondContact CA-OE2 3.28Å; S916-E986 WeakPolarHBondContact CB-OE2 3.44Å; S916-E986 PolarHBondContact OG-OE2 3.12Å; T918-E986 WeakPolarHBondContact CB-OE1 3.23Å; T918-E986 WeakPolarHBondContact CG2-OE1 3.21Å; T918-E986 PolarHBondContact OG1-OE1 3.05Å; T918-E986 PolarHBondContact OG1-OE2 3.24Å; K982-E986 PolarHBondContact O-N 3.36Å; F983-E986 PolarHBondContact O-N 3.34Å; P984-E986 VanDerWaalsContact C-N 3.35Å
987	L	96.6	Very high	95.4	Very high	5 Å²	5	56.9 Å²	56.9	3%	0.026	28%	0.275	C	S	.	.			trans	-116.6	36.6	-169.9	-60.2	-176.9	0	0	0	113.4	E912 L913 F919 F983 H989 V990 I1088	E912-L987 HydrophobicContact CB-CD2 4.06Å; E912-L987 WeakPolarHBondContact OE2-CA 3.27Å; L913-L987 HydrophobicContact CB-CD2 4.14Å; L913-L987 HydrophobicContact CD1-CD1 3.97Å; L913-L987 HydrophobicContact CD1-CD2 3.87Å; F919-L987 HydrophobicContact CD2-CD1 4.34Å; F919-L987 HydrophobicContact CG-CD1 4.48Å; F983-L987 HydrophobicContact CD2-CD1 3.83Å; F983-L987 HydrophobicContact CE2-CD1 4.32Å; F983-L987 VanDerWaalsContact O-CG 3.32Å; F983-L987 WeakPolarHBondContact O-CG 3.48Å; F983-L987 PolarHBondContact O-N 3.18Å; L987-H989 VanDerWaalsContact C-N 3.29Å; L987-H989 PolarHBondContact O-N 3.48Å; L987-V990 HydrophobicContact CB-CG2 3.89Å; L987-V990 WeakPolarHBondContact O-CB 3.34Å; L987-V990 PolarHBondContact O-N 3.45Å; L987-I1088 HydrophobicContact CB-CD1 4.12Å; L987-I1088 HydrophobicContact CD1-CD1 3.93Å; L987-I1088 HydrophobicContact CD1-CG1 4.5Å
988	I	95.8	Very high	95.3	Very high	108 Å²	108	55.4 Å²	55.4	55%	0.554	27%	0.272	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-20.3	-168.7	59.5	167.8	0	0	0	115.2	E912 E985	E912-I988 VanDerWaalsContact OE1-CG1 3.26Å; E912-I988 WeakPolarHBondContact OE1-CG1 3.17Å; E912-I988 PolarHBondContact OE2-N 3.26Å; E912-I988 VanDerWaalsContact OE2-N 3.1Å; E985-I988 WeakPolarHBondContact O-CG2 3.43Å
989	H	98.1	Very high	95.3	Very high	41 Å²	41	57.4 Å²	57.4	19%	0.19	28%	0.275	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	-10.7	176.8	-72.8	90.3	0	0	0	113.8	A908 A909 E912 L987 E991 K992 A993	A908-H989 HydrophobicContact CB-CB 3.91Å; A909-H989 HydrophobicContact CB-CB 4.04Å; E912-H989 IonicContact OE1-CE1 2.77Å; E912-H989 IonicContact OE1-CG 3.29Å; E912-H989 IonicContact OE1-ND1 3.74Å; E912-H989 PolarHBondContact OE1-ND1 3.37Å; E912-H989 WeakPolarHBondContact OE2-CB 3.27Å; E912-H989 PolarHBondContact OE2-N 3.23Å; E912-H989 IonicContact OE2-ND1 3.6Å; L987-H989 VanDerWaalsContact C-N 3.29Å; L987-H989 PolarHBondContact O-N 3.48Å; H989-E991 VanDerWaalsContact C-N 3.34Å; H989-E991 PolarHBondContact O-N 3.47Å; H989-K992 WeakPolarHBondContact O-CB 3.43Å; H989-K992 PolarHBondContact O-N 2.92Å; H989-A993 PolarHBondContact O-N 2.91Å
990	V	97.9	Very high	95.4	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-59.6	-37.5	-178.3	170.1	0	0	0	0	113	A909 L987 K992 A993 S994 F1081 L1084 H1085 I1088	A909-V990 HydrophobicContact CB-CG2 4.14Å; L987-V990 HydrophobicContact CB-CG2 3.89Å; L987-V990 WeakPolarHBondContact O-CB 3.34Å; L987-V990 PolarHBondContact O-N 3.45Å; V990-K992 VanDerWaalsContact C-N 3.28Å; V990-K992 PolarHBondContact O-N 2.97Å; V990-A993 PolarHBondContact O-N 3.37Å; V990-S994 WeakPolarHBondContact O-CB 3.25Å; V990-S994 PolarHBondContact O-N 3.37Å; V990-S994 PolarHBondContact O-OG 3.39Å; V990-F1081 HydrophobicContact CB-CD1 4.38Å; V990-F1081 HydrophobicContact CG1-CB 4.4Å; V990-F1081 HydrophobicContact CG1-CD1 4.05Å; V990-F1081 HydrophobicContact CG2-CD1 3.96Å; V990-F1081 HydrophobicContact CG2-CE1 4.19Å; V990-L1084 HydrophobicContact CG1-CB 4.14Å; V990-L1084 HydrophobicContact CG1-CD2 3.89Å; V990-L1084 HydrophobicContact CG1-CG 3.98Å; V990-L1084 HydrophobicContact CG2-CD2 3.91Å; V990-H1085 HydrophobicContact CG1-CB 4.06Å; V990-I1088 HydrophobicContact CB-CD1 4.32Å; V990-I1088 HydrophobicContact CG1-CD1 3.99Å
991	E	97.2	Very high	95.4	Very high	92 Å²	92	57.3 Å²	57.3	43%	0.43	28%	0.277	S	S	.	.	H	α-helix	trans	-65.6	-29.9	174.4	-179.2	176.8	173	0	0	113	H989 S994 R995 H1085	H989-E991 VanDerWaalsContact C-N 3.34Å; H989-E991 PolarHBondContact O-N 3.47Å; E991-S994 PolarHBondContact O-OG 3.38Å; E991-R995 WeakPolarHBondContact O-CD 3.39Å; E991-R995 WeakPolarHBondContact O-CG 3.37Å; E991-R995 PolarHBondContact O-NE 2.89Å; E991-R995 IonicContact OE1-CZ 3.59Å; E991-R995 IonicContact OE1-NE 2.68Å; E991-R995 IonicContact OE1-NH2 3.55Å; E991-R995 PolarHBondContact OE1-NH2 3.45Å; E991-H1085 VanDerWaalsContact CG-CE1 3.49Å; E991-H1085 WeakPolarHBondContact CG-CE1 3.35Å; E991-H1085 IonicContact OE2-CE1 2.76Å
992	K	96.6	Very high	95.4	Very high	116 Å²	116	58.6 Å²	58.6	50%	0.504	28%	0.283	S	S	.	.	H	α-helix	trans	-78.5	-47.5	177	-65	172.2	-172.9	164.2	0	109.5	A905 H989 V990 S994 R995 V996	A905-K992 HydrophobicContact CB-CB 3.79Å; H989-K992 WeakPolarHBondContact O-CB 3.43Å; H989-K992 PolarHBondContact O-N 2.92Å; V990-K992 VanDerWaalsContact C-N 3.28Å; V990-K992 PolarHBondContact O-N 2.97Å; K992-S994 VanDerWaalsContact C-N 3.27Å; K992-S994 PolarHBondContact O-N 2.97Å; K992-R995 WeakPolarHBondContact O-CB 3.39Å; K992-R995 PolarHBondContact O-N 2.89Å; K992-V996 WeakPolarHBondContact O-CG2 3.48Å; K992-V996 PolarHBondContact O-N 3.38Å
993	A	97.8	Very high	95.6	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-58.3	-35.5	178.6	0	0	0	0	0	113.1	V906 A909 H989 V990 R995 V996 F1081	V906-A993 HydrophobicContact CG2-CB 4.05Å; A909-A993 HydrophobicContact CB-CB 3.61Å; H989-A993 PolarHBondContact O-N 2.91Å; V990-A993 PolarHBondContact O-N 3.37Å; A993-R995 PolarHBondContact O-N 3.24Å; A993-R995 VanDerWaalsContact O-N 3.16Å; A993-V996 PolarHBondContact O-N 2.94Å; A993-F1081 HydrophobicContact CB-CB 4.01Å; A993-F1081 HydrophobicContact CB-CD1 4.33Å; A993-F1081 HydrophobicContact CB-CD2 3.66Å; A993-F1081 HydrophobicContact CB-CE2 4.19Å; A993-F1081 HydrophobicContact CB-CG 3.74Å
994	S	97.5	Very high	95.5	Very high	22 Å²	22	61 Å²	61	15%	0.154	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-11.6	175.1	68.4	0	0	0	0	115.1	V990 E991 K992 F1081	V990-S994 WeakPolarHBondContact O-CB 3.25Å; V990-S994 PolarHBondContact O-N 3.37Å; V990-S994 PolarHBondContact O-OG 3.39Å; E991-S994 PolarHBondContact O-OG 3.38Å; K992-S994 VanDerWaalsContact C-N 3.27Å; K992-S994 PolarHBondContact O-N 2.97Å; S994-F1081 VanDerWaalsContact CB-C 3.43Å; S994-F1081 WeakPolarHBondContact CB-O 3.49Å
995	R	96.1	Very high	95.4	Very high	174 Å²	174	60.2 Å²	60.2	66%	0.657	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106	-6.1	178.6	-57.4	169.8	-172.5	-88.5	8.4	112.6	E991 K992 A993	E991-R995 WeakPolarHBondContact O-CD 3.39Å; E991-R995 WeakPolarHBondContact O-CG 3.37Å; E991-R995 PolarHBondContact O-NE 2.89Å; E991-R995 IonicContact OE1-CZ 3.59Å; E991-R995 IonicContact OE1-NE 2.68Å; E991-R995 IonicContact OE1-NH2 3.55Å; E991-R995 PolarHBondContact OE1-NH2 3.45Å; K992-R995 WeakPolarHBondContact O-CB 3.39Å; K992-R995 PolarHBondContact O-N 2.89Å; A993-R995 PolarHBondContact O-N 3.24Å; A993-R995 VanDerWaalsContact O-N 3.16Å
996	V	96.3	Very high	95.5	Very high	6 Å²	6	57.3 Å²	57.3	4%	0.036	28%	0.277	C	S	.	.			trans	-89.4	121.1	-175.9	168	0	0	0	0	110.8	D902 V906 K992 A993 A998 I1001	D902-V996 HydrophobicContact CB-CB 4.39Å; D902-V996 HydrophobicContact CB-CG1 3.79Å; D902-V996 HydrophobicContact CB-CG2 3.66Å; V906-V996 HydrophobicContact CG2-CB 3.82Å; V906-V996 HydrophobicContact CG2-CG1 3.62Å; V906-V996 HydrophobicContact CG2-CG2 4.21Å; K992-V996 WeakPolarHBondContact O-CG2 3.48Å; K992-V996 PolarHBondContact O-N 3.38Å; A993-V996 PolarHBondContact O-N 2.94Å; V996-A998 PolarHBondContact O-N 2.89Å; V996-I1001 HydrophobicContact CG1-CD1 3.44Å; V996-I1001 VanDerWaalsContact CG1-CD1 3.44Å; V996-I1001 HydrophobicContact CG1-CG1 4.43Å
997	S	94.8	Very high	95.5	Very high	38 Å²	38	58.3 Å²	58.3	27%	0.266	28%	0.282	S	S	.	.			trans	-88.1	108.3	174.6	-179	0	0	0	0	112.1	E999 T1000 I1001 E1078	S997-E999 VanDerWaalsContact C-N 3.3Å; S997-E999 PolarHBondContact O-N 3.39Å; S997-T1000 WeakPolarHBondContact CB-OG1 3Å; S997-T1000 WeakPolarHBondContact O-CB 3.28Å; S997-T1000 PolarHBondContact O-N 3.29Å; S997-T1000 PolarHBondContact OG-OG1 3.41Å; S997-T1000 VanDerWaalsContact OG-OG1 3.12Å; S997-I1001 PolarHBondContact O-N 3.31Å; S997-I1001 VanDerWaalsContact O-N 3.12Å; S997-E1078 VanDerWaalsContact CA-OE1 3.28Å; S997-E1078 WeakPolarHBondContact CA-OE1 3.41Å; S997-E1078 PolarHBondContact OG-OE1 3.1Å
998	A	90.8	Very high	95.4	Very high	24 Å²	24	58.1 Å²	58.1	20%	0.198	28%	0.281	C	S	.	.	H	α-helix	trans	-60.6	-38.4	179.7	0	0	0	0	0	112.3	V996 T1000 I1001 Q1002 V1077	V996-A998 PolarHBondContact O-N 2.89Å; A998-T1000 VanDerWaalsContact C-N 3.26Å; A998-T1000 PolarHBondContact O-N 3.18Å; A998-I1001 PolarHBondContact O-N 3.12Å; A998-Q1002 PolarHBondContact O-N 3.4Å; A998-V1077 HydrophobicContact CB-CB 4.29Å; A998-V1077 HydrophobicContact CB-CG2 4.06Å
999	E	92.4	Very high	95.4	Very high	120 Å²	120	53.1 Å²	53.1	56%	0.561	26%	0.257	S	S	*	.	H	α-helix	trans	-63	-33.7	176.3	-157.2	-155	-178.3	0	0	112	S997 K1003	S997-E999 VanDerWaalsContact C-N 3.3Å; S997-E999 PolarHBondContact O-N 3.39Å; E999-K1003 VanDerWaalsContact CD-CE 3.45Å; E999-K1003 HydrophobicContact CG-CD 4.48Å; E999-K1003 WeakPolarHBondContact O-CB 3.5Å; E999-K1003 WeakPolarHBondContact O-CD 3.34Å; E999-K1003 VanDerWaalsContact O-CG 3.28Å; E999-K1003 WeakPolarHBondContact O-CG 3.36Å; E999-K1003 PolarHBondContact O-N 3.11Å; E999-K1003 VanDerWaalsContact O-N 3.11Å; E999-K1003 WeakPolarHBondContact OE1-CE 3.25Å; E999-K1003 IonicContact OE1-NZ 2.75Å; E999-K1003 PolarHBondContact OE1-NZ 2.82Å; E999-K1003 IonicContact OE2-NZ 2.85Å; E999-K1003 PolarHBondContact OE2-NZ 3.1Å
1000	T	94.2	Very high	95.3	Very high	66 Å²	66	57.8 Å²	57.8	41%	0.405	27%	0.272	S	S	.	.	H	α-helix	trans	-72.9	-41.8	178.7	-57.8	0	0	0	0	111.4	S997 A998 N1004	S997-T1000 WeakPolarHBondContact CB-OG1 3Å; S997-T1000 WeakPolarHBondContact O-CB 3.28Å; S997-T1000 PolarHBondContact O-N 3.29Å; S997-T1000 PolarHBondContact OG-OG1 3.41Å; S997-T1000 VanDerWaalsContact OG-OG1 3.12Å; A998-T1000 VanDerWaalsContact C-N 3.26Å; A998-T1000 PolarHBondContact O-N 3.18Å; T1000-N1004 WeakPolarHBondContact O-CB 3.47Å; T1000-N1004 PolarHBondContact O-N 3.23Å; T1000-N1004 VanDerWaalsContact O-N 3.1Å; T1000-N1004 PolarHBondContact O-ND2 3.23Å
1001	I	94.2	Very high	95.2	Very high	4 Å²	4	60 Å²	60	2%	0.021	28%	0.283	C	S	.	.	H	α-helix	trans	-57.4	-52	172.5	-67.4	165.5	0	0	0	110.5	I899 D902 V903 V996 S997 A998 K1003 N1004 L1005 H1054 M1057	I899-I1001 HydrophobicContact CG2-CG2 3.86Å; D902-I1001 HydrophobicContact CB-CD1 3.98Å; D902-I1001 HydrophobicContact CB-CG1 4.39Å; V903-I1001 HydrophobicContact CG2-CD1 4.04Å; V903-I1001 HydrophobicContact CG2-CG2 3.86Å; V996-I1001 HydrophobicContact CG1-CD1 3.44Å; V996-I1001 VanDerWaalsContact CG1-CD1 3.44Å; V996-I1001 HydrophobicContact CG1-CG1 4.43Å; S997-I1001 PolarHBondContact O-N 3.31Å; S997-I1001 VanDerWaalsContact O-N 3.12Å; A998-I1001 PolarHBondContact O-N 3.12Å; I1001-K1003 PolarHBondContact O-N 2.84Å; I1001-N1004 PolarHBondContact O-N 2.67Å; I1001-L1005 HydrophobicContact CG2-CD1 3.69Å; I1001-L1005 HydrophobicContact CG2-CG 4.24Å; I1001-L1005 PolarHBondContact O-N 3.48Å; I1001-H1054 WeakPolarHBondContact CG2-CD2 3.38Å; I1001-M1057 HydrophobicContact CD1-SD 4.39Å
1002	Q	94	Very high	95.1	Very high	68 Å²	68	55.6 Å²	55.6	32%	0.318	26%	0.262	S	S	.	.	H	α-helix	trans	-57.7	-47.5	-177.8	176.6	60.2	18.3	0	0	111.8	A998 N1004 L1005 E1006 H1054	A998-Q1002 PolarHBondContact O-N 3.4Å; Q1002-N1004 VanDerWaalsContact C-N 3.34Å; Q1002-N1004 PolarHBondContact O-N 3.12Å; Q1002-L1005 PolarHBondContact O-N 2.87Å; Q1002-E1006 PolarHBondContact NE2-OE1 2.95Å; Q1002-E1006 WeakPolarHBondContact O-CG 3.3Å; Q1002-E1006 PolarHBondContact O-N 3.45Å; Q1002-H1054 PolarHBondContact OE1-CE1 3.11Å; Q1002-H1054 VanDerWaalsContact OE1-CE1 3.3Å
1003	K	95.3	Very high	95	Very high	101 Å²	101	56.2 Å²	56.2	44%	0.439	27%	0.265	S	S	.	.	H	α-helix	trans	-58.6	-43.4	177	-75.6	167.7	-177.4	166.9	0	112.4	E999 I1001 Q1007	E999-K1003 VanDerWaalsContact CD-CE 3.45Å; E999-K1003 HydrophobicContact CG-CD 4.48Å; E999-K1003 WeakPolarHBondContact O-CB 3.5Å; E999-K1003 WeakPolarHBondContact O-CD 3.34Å; E999-K1003 VanDerWaalsContact O-CG 3.28Å; E999-K1003 WeakPolarHBondContact O-CG 3.36Å; E999-K1003 PolarHBondContact O-N 3.11Å; E999-K1003 VanDerWaalsContact O-N 3.11Å; E999-K1003 WeakPolarHBondContact OE1-CE 3.25Å; E999-K1003 IonicContact OE1-NZ 2.75Å; E999-K1003 PolarHBondContact OE1-NZ 2.82Å; E999-K1003 IonicContact OE2-NZ 2.85Å; E999-K1003 PolarHBondContact OE2-NZ 3.1Å; I1001-K1003 PolarHBondContact O-N 2.84Å; K1003-Q1007 WeakPolarHBondContact O-CB 3.29Å; K1003-Q1007 PolarHBondContact O-N 2.97Å
1004	N	94.1	Very high	94.8	Very high	68 Å²	68	59.3 Å²	59.3	36%	0.364	29%	0.286	S	S	.	.	H	α-helix	trans	-69.8	-41.5	-178.9	-68.6	-15.6	0	0	0	111.9	I899 T1000 I1001 Q1002 Q1007 M1008	I899-N1004 HydrophobicContact CD1-CB 3.73Å; I899-N1004 HydrophobicContact CG1-CB 3.99Å; T1000-N1004 WeakPolarHBondContact O-CB 3.47Å; T1000-N1004 PolarHBondContact O-N 3.23Å; T1000-N1004 VanDerWaalsContact O-N 3.1Å; T1000-N1004 PolarHBondContact O-ND2 3.23Å; I1001-N1004 PolarHBondContact O-N 2.67Å; Q1002-N1004 VanDerWaalsContact C-N 3.34Å; Q1002-N1004 PolarHBondContact O-N 3.12Å; N1004-Q1007 PolarHBondContact O-N 3.22Å; N1004-M1008 PolarHBondContact O-N 3.21Å
1005	L	95.1	Very high	94.7	Very high	3 Å²	3	58.7 Å²	58.7	2%	0.016	28%	0.282	C	S	.	.	H	α-helix	trans	-63	-46.5	174.3	-80	174	0	0	0	112.2	I899 I1001 Q1002 Q1007 M1008 G1009 Y1047 L1050 H1054	I899-L1005 HydrophobicContact CD1-CD2 4.29Å; I899-L1005 HydrophobicContact CD1-CG 4.39Å; I899-L1005 HydrophobicContact CG2-CD2 4.29Å; I899-L1005 HydrophobicContact CG2-CG 4.18Å; I1001-L1005 HydrophobicContact CG2-CD1 3.69Å; I1001-L1005 HydrophobicContact CG2-CG 4.24Å; I1001-L1005 PolarHBondContact O-N 3.48Å; Q1002-L1005 PolarHBondContact O-N 2.87Å; L1005-Q1007 VanDerWaalsContact C-N 3.27Å; L1005-Q1007 PolarHBondContact O-N 2.82Å; L1005-M1008 PolarHBondContact O-N 3.2Å; L1005-G1009 PolarHBondContact O-N 2.78Å; L1005-Y1047 HydrophobicContact CD2-CD2 4.48Å; L1005-Y1047 HydrophobicContact CD2-CE2 4.32Å; L1005-Y1047 WeakPolarHBondContact O-CE2 3.22Å; L1005-L1050 HydrophobicContact CD2-CB 4.39Å; L1005-L1050 HydrophobicContact CD2-CD2 3.71Å; L1005-L1050 HydrophobicContact CD2-CG 3.86Å; L1005-H1054 HydrophobicContact CD1-CB 3.56Å
1006	E	95.1	Very high	94.6	Very high	80 Å²	80	53.4 Å²	53.4	37%	0.374	26%	0.264	S	S	.	.	H	α-helix	trans	-61.2	-37.9	175.1	-73.2	-177.2	-163.8	0	0	112.2	Q1002 R1010	Q1002-E1006 PolarHBondContact NE2-OE1 2.95Å; Q1002-E1006 WeakPolarHBondContact O-CG 3.3Å; Q1002-E1006 PolarHBondContact O-N 3.45Å; E1006-R1010 VanDerWaalsContact CB-NH2 3.33Å; E1006-R1010 WeakPolarHBondContact O-CB 3.37Å; E1006-R1010 VanDerWaalsContact O-CG 3.25Å; E1006-R1010 WeakPolarHBondContact O-CG 3.42Å; E1006-R1010 PolarHBondContact O-N 2.92Å; E1006-R1010 PolarHBondContact O-NE 3.28Å; E1006-R1010 IonicContact OE2-CZ 2.78Å; E1006-R1010 IonicContact OE2-NH1 3.35Å; E1006-R1010 PolarHBondContact OE2-NH1 3.14Å; E1006-R1010 IonicContact OE2-NH2 2.74Å
1007	Q	94.8	Very high	94.4	Very high	88 Å²	88	60 Å²	60	41%	0.411	29%	0.293	S	S	.	.	H	α-helix	trans	-63.2	-49.7	175.8	177.1	174.9	-38.5	0	0	111	K1003 N1004 L1005 G1009 R1010 Q1011	K1003-Q1007 WeakPolarHBondContact O-CB 3.29Å; K1003-Q1007 PolarHBondContact O-N 2.97Å; N1004-Q1007 PolarHBondContact O-N 3.22Å; L1005-Q1007 VanDerWaalsContact C-N 3.27Å; L1005-Q1007 PolarHBondContact O-N 2.82Å; Q1007-G1009 PolarHBondContact O-N 2.93Å; Q1007-R1010 WeakPolarHBondContact O-CB 3.46Å; Q1007-R1010 PolarHBondContact O-N 3.48Å; Q1007-R1010 VanDerWaalsContact O-N 3.16Å; Q1007-Q1011 HydrophobicContact CG-CG 4.49Å; Q1007-Q1011 WeakPolarHBondContact O-CG 3.41Å; Q1007-Q1011 PolarHBondContact O-N 3.39Å
1008	M	95.8	Very high	94.1	Very high	1 Å²	1	60.1 Å²	60.1	1%	0.005	29%	0.29	C	S	.	.	H	α-helix	trans	-56.3	-49	176.2	-175.9	-177.1	-72.6	0	0	111.2	F888 F892 Q895 Q896 I899 N1004 L1005 R1010 Q1011 I1012 Y1047	F888-M1008 HydrophobicContact CE2-CG 4.45Å; F888-M1008 HydrophobicContact CZ-CG 4.46Å; F892-M1008 HydrophobicContact CD2-CE 4.37Å; F892-M1008 HydrophobicContact CD2-CG 4.31Å; F892-M1008 HydrophobicContact CD2-SD 4.37Å; F892-M1008 HydrophobicContact CE2-CE 4.1Å; F892-M1008 HydrophobicContact CE2-CG 3.81Å; F892-M1008 HydrophobicContact CE2-SD 3.61Å; F892-M1008 HydrophobicContact CZ-SD 4.23Å; Q895-M1008 HydrophobicContact CB-CE 3.57Å; Q896-M1008 HydrophobicContact CB-CE 4.48Å; I899-M1008 HydrophobicContact CD1-CE 4.03Å; N1004-M1008 PolarHBondContact O-N 3.21Å; L1005-M1008 PolarHBondContact O-N 3.2Å; M1008-R1010 VanDerWaalsContact C-N 3.32Å; M1008-R1010 PolarHBondContact O-N 3.39Å; M1008-Q1011 PolarHBondContact O-N 2.93Å; M1008-Q1011 VanDerWaalsContact O-N 3.13Å; M1008-I1012 HydrophobicContact CG-CD1 4.08Å; M1008-I1012 WeakPolarHBondContact O-CG1 3.39Å; M1008-I1012 PolarHBondContact O-N 2.98Å; M1008-Y1047 HydrophobicContact CB-CD2 4.35Å; M1008-Y1047 HydrophobicContact CG-CD2 4.04Å; M1008-Y1047 HydrophobicContact SD-CD2 3.95Å
1009	G	95.6	Very high	94.1	Very high	4 Å²	4	60.1 Å²	60.1	4%	0.041	29%	0.286	C	S	.	.	H	α-helix	trans	-63	-32.2	176.9	0	0	0	0	0	114.1	L1005 Q1007 K1013	L1005-G1009 PolarHBondContact O-N 2.78Å; Q1007-G1009 PolarHBondContact O-N 2.93Å; G1009-K1013 WeakPolarHBondContact O-CB 3.35Å; G1009-K1013 WeakPolarHBondContact O-CD 3.28Å; G1009-K1013 VanDerWaalsContact O-CG 3.28Å; G1009-K1013 WeakPolarHBondContact O-CG 3.43Å; G1009-K1013 PolarHBondContact O-N 2.94Å
1010	R	95.8	Very high	94	Very high	138 Å²	138	62 Å²	62	52%	0.521	30%	0.295	S	S	.	.	H	α-helix	trans	-69.2	-42.3	170.9	-77.4	-179.9	-70.1	-108.4	-1.2	111.8	E1006 Q1007 M1008 K1013 S1014	E1006-R1010 VanDerWaalsContact CB-NH2 3.33Å; E1006-R1010 WeakPolarHBondContact O-CB 3.37Å; E1006-R1010 VanDerWaalsContact O-CG 3.25Å; E1006-R1010 WeakPolarHBondContact O-CG 3.42Å; E1006-R1010 PolarHBondContact O-N 2.92Å; E1006-R1010 PolarHBondContact O-NE 3.28Å; E1006-R1010 IonicContact OE2-CZ 2.78Å; E1006-R1010 IonicContact OE2-NH1 3.35Å; E1006-R1010 PolarHBondContact OE2-NH1 3.14Å; E1006-R1010 IonicContact OE2-NH2 2.74Å; Q1007-R1010 WeakPolarHBondContact O-CB 3.46Å; Q1007-R1010 PolarHBondContact O-N 3.48Å; Q1007-R1010 VanDerWaalsContact O-N 3.16Å; M1008-R1010 VanDerWaalsContact C-N 3.32Å; M1008-R1010 PolarHBondContact O-N 3.39Å; R1010-K1013 PolarHBondContact O-N 3.31Å; R1010-S1014 PolarHBondContact O-N 3.31Å
1011	Q	94.9	Very high	93.6	Very high	47 Å²	47	63.2 Å²	63.2	22%	0.22	30%	0.303	C	S	.	.	H	α-helix	trans	-65.5	-42.8	179.5	-70.5	-176.6	-95.7	0	0	111.8	F888 Q1007 M1008 S1014 L1015	F888-Q1011 HydrophobicContact CD1-CB 4.12Å; F888-Q1011 HydrophobicContact CD2-CB 3.67Å; F888-Q1011 HydrophobicContact CD2-CG 4.19Å; F888-Q1011 HydrophobicContact CE1-CB 4.13Å; F888-Q1011 HydrophobicContact CE2-CB 3.66Å; F888-Q1011 HydrophobicContact CE2-CG 4.46Å; F888-Q1011 HydrophobicContact CG-CB 3.92Å; F888-Q1011 HydrophobicContact CZ-CB 3.92Å; Q1007-Q1011 HydrophobicContact CG-CG 4.49Å; Q1007-Q1011 WeakPolarHBondContact O-CG 3.41Å; Q1007-Q1011 PolarHBondContact O-N 3.39Å; M1008-Q1011 PolarHBondContact O-N 2.93Å; M1008-Q1011 VanDerWaalsContact O-N 3.13Å; Q1011-S1014 PolarHBondContact O-N 3.16Å; Q1011-L1015 PolarHBondContact O-N 3.44Å
1012	I	96.3	Very high	93.5	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-61.4	-47.9	175.9	-62.3	165	0	0	0	111.1	F888 F892 M1008 S1014 L1015 Q1016 V1040 A1043 Q1044 Y1047	F888-I1012 HydrophobicContact CE1-CG1 3.72Å; F888-I1012 HydrophobicContact CZ-CD1 4.36Å; F888-I1012 HydrophobicContact CZ-CG1 3.53Å; F892-I1012 HydrophobicContact CE2-CD1 4.29Å; M1008-I1012 HydrophobicContact CG-CD1 4.08Å; M1008-I1012 WeakPolarHBondContact O-CG1 3.39Å; M1008-I1012 PolarHBondContact O-N 2.98Å; I1012-S1014 VanDerWaalsContact C-N 3.31Å; I1012-S1014 PolarHBondContact O-N 3.13Å; I1012-L1015 PolarHBondContact O-N 2.9Å; I1012-L1015 VanDerWaalsContact O-N 3.14Å; I1012-Q1016 HydrophobicContact CG2-CG 4.46Å; I1012-Q1016 WeakPolarHBondContact O-CG 3.25Å; I1012-Q1016 PolarHBondContact O-N 3.36Å; I1012-V1040 HydrophobicContact CG2-CG2 3.96Å; I1012-A1043 HydrophobicContact CD1-CB 4.25Å; I1012-A1043 WeakPolarHBondContact CD1-O 3.46Å; I1012-A1043 HydrophobicContact CG1-CB 4.19Å; I1012-Q1044 HydrophobicContact CG2-CB 4.26Å; I1012-Q1044 VanDerWaalsContact CG2-OE1 3.23Å; I1012-Y1047 VanDerWaalsContact CD1-CB 3.42Å; I1012-Y1047 HydrophobicContact CD1-CD1 4.28Å; I1012-Y1047 HydrophobicContact CD1-CD2 4.34Å; I1012-Y1047 HydrophobicContact CD1-CG 3.75Å
1013	K	94.6	Very high	93.1	Very high	128 Å²	128	62.9 Å²	62.9	56%	0.557	30%	0.304	S	S	*	.	H	α-helix	trans	-63.7	-34.3	178.7	-73	171.2	-177.2	171.7	0	113.1	G1009 R1010 K1017	G1009-K1013 WeakPolarHBondContact O-CB 3.35Å; G1009-K1013 WeakPolarHBondContact O-CD 3.28Å; G1009-K1013 VanDerWaalsContact O-CG 3.28Å; G1009-K1013 WeakPolarHBondContact O-CG 3.43Å; G1009-K1013 PolarHBondContact O-N 2.94Å; R1010-K1013 PolarHBondContact O-N 3.31Å; K1013-K1017 PolarHBondContact O-N 2.79Å
1014	S	92.7	Very high	92.6	Very high	65 Å²	65	63.4 Å²	63.4	46%	0.455	32%	0.318	S	S	.	.	H	α-helix	trans	-65.1	-46.7	172.1	-160.6	0	0	0	0	110.9	R1010 Q1011 I1012 Q1016 K1017 D1018	R1010-S1014 PolarHBondContact O-N 3.31Å; Q1011-S1014 PolarHBondContact O-N 3.16Å; I1012-S1014 VanDerWaalsContact C-N 3.31Å; I1012-S1014 PolarHBondContact O-N 3.13Å; S1014-Q1016 PolarHBondContact O-N 2.68Å; S1014-K1017 PolarHBondContact O-N 3.39Å; S1014-D1018 WeakPolarHBondContact O-CB 3.49Å; S1014-D1018 PolarHBondContact O-N 2.9Å
1015	L	94.8	Very high	92.4	Very high	10 Å²	10	63.3 Å²	63.3	5%	0.052	33%	0.327	C	S	.	.	H	α-helix	trans	-62.7	-41.8	-180	-178.7	55.7	0	0	0	112.4	A885 F888 Q1011 I1012 K1017 D1018 L1019 M1036 F1039 V1040	A885-L1015 HydrophobicContact CB-CD1 3.58Å; F888-L1015 HydrophobicContact CD1-CD2 4.32Å; Q1011-L1015 PolarHBondContact O-N 3.44Å; I1012-L1015 PolarHBondContact O-N 2.9Å; I1012-L1015 VanDerWaalsContact O-N 3.14Å; L1015-K1017 PolarHBondContact O-N 3Å; L1015-D1018 PolarHBondContact O-N 2.76Å; L1015-L1019 HydrophobicContact CD1-CD1 3.99Å; L1015-L1019 HydrophobicContact CD1-CG 4.09Å; L1015-L1019 HydrophobicContact CG-CD1 3.97Å; L1015-L1019 WeakPolarHBondContact O-CB 3.49Å; L1015-L1019 VanDerWaalsContact O-CG 3.27Å; L1015-L1019 WeakPolarHBondContact O-CG 3.42Å; L1015-L1019 PolarHBondContact O-N 3.09Å; L1015-M1036 HydrophobicContact CD1-CB 4.44Å; L1015-F1039 HydrophobicContact CD2-CD1 3.74Å; L1015-F1039 HydrophobicContact CD2-CE1 3.74Å; L1015-V1040 HydrophobicContact CB-CG2 4.09Å; L1015-V1040 HydrophobicContact CD2-CB 3.96Å; L1015-V1040 HydrophobicContact CD2-CG2 3.87Å; L1015-V1040 HydrophobicContact CG-CB 4.18Å; L1015-V1040 HydrophobicContact CG-CG2 3.86Å
1016	Q	94.2	Very high	92	Very high	63 Å²	63	65.3 Å²	65.3	29%	0.294	34%	0.336	S	S	.	.	H	α-helix	trans	-54.5	-52.9	173.8	-72.5	164.9	-13.9	0	0	111	I1012 S1014 D1018 L1019 E1020 V1040	I1012-Q1016 HydrophobicContact CG2-CG 4.46Å; I1012-Q1016 WeakPolarHBondContact O-CG 3.25Å; I1012-Q1016 PolarHBondContact O-N 3.36Å; S1014-Q1016 PolarHBondContact O-N 2.68Å; Q1016-D1018 PolarHBondContact O-N 2.75Å; Q1016-L1019 PolarHBondContact O-N 2.89Å; Q1016-E1020 WeakPolarHBondContact O-CG 3.13Å; Q1016-E1020 PolarHBondContact O-N 3.47Å; Q1016-V1040 HydrophobicContact CG-CG1 4.48Å; Q1016-V1040 HydrophobicContact CG-CG2 3.64Å
1017	K	91.9	Very high	91.7	Very high	145 Å²	145	65 Å²	65	63%	0.63	34%	0.337	S	S	*	.	H	α-helix	trans	-66.6	-36.3	-179.7	-174.5	-179.6	178	-176.6	0	113.7	K1013 S1014 L1015 L1019 T1021	K1013-K1017 PolarHBondContact O-N 2.79Å; S1014-K1017 PolarHBondContact O-N 3.39Å; L1015-K1017 PolarHBondContact O-N 3Å; K1017-L1019 VanDerWaalsContact C-N 3.3Å; K1017-T1021 PolarHBondContact O-N 3.49Å; K1017-T1021 PolarHBondContact O-OG1 3.32Å
1018	D	88.6	Confident	91.3	Very high	39 Å²	39	69.4 Å²	69.4	21%	0.209	36%	0.357	C	S	.	.	H	α-helix	trans	-67.4	-33	175.1	-88.3	-55.7	0	0	0	111.6	R878 S1014 L1015 Q1016 T1021 F1022	R878-D1018 IonicContact CZ-OD1 3.58Å; R878-D1018 VanDerWaalsContact CZ-OD1 3.28Å; R878-D1018 IonicContact NH1-OD1 2.71Å; R878-D1018 PolarHBondContact NH1-OD1 2.99Å; R878-D1018 PolarHBondContact NH2-O 3.19Å; R878-D1018 IonicContact NH2-OD1 3.13Å; R878-D1018 PolarHBondContact NH2-OD1 3.02Å; S1014-D1018 WeakPolarHBondContact O-CB 3.49Å; S1014-D1018 PolarHBondContact O-N 2.9Å; L1015-D1018 PolarHBondContact O-N 2.76Å; Q1016-D1018 PolarHBondContact O-N 2.75Å; D1018-T1021 PolarHBondContact O-OG1 2.91Å; D1018-F1022 WeakPolarHBondContact O-CB 3.49Å; D1018-F1022 WeakPolarHBondContact O-CD2 3.44Å; D1018-F1022 PolarHBondContact O-N 3.03Å
1019	L	91.9	Very high	90.9	Very high	24 Å²	24	72.3 Å²	72.3	13%	0.126	37%	0.373	C	S	.	.	H	α-helix	trans	-72.4	-42.6	174.7	-72.5	167.2	0	0	0	112.8	L1015 Q1016 K1017 T1021 F1022 F1032 V1033 M1036 V1040	L1015-L1019 HydrophobicContact CD1-CD1 3.99Å; L1015-L1019 HydrophobicContact CD1-CG 4.09Å; L1015-L1019 HydrophobicContact CG-CD1 3.97Å; L1015-L1019 WeakPolarHBondContact O-CB 3.49Å; L1015-L1019 VanDerWaalsContact O-CG 3.27Å; L1015-L1019 WeakPolarHBondContact O-CG 3.42Å; L1015-L1019 PolarHBondContact O-N 3.09Å; Q1016-L1019 PolarHBondContact O-N 2.89Å; K1017-L1019 VanDerWaalsContact C-N 3.3Å; L1019-T1021 PolarHBondContact O-N 3.09Å; L1019-T1021 VanDerWaalsContact O-N 3.1Å; L1019-F1022 WeakPolarHBondContact O-CB 3.36Å; L1019-F1022 PolarHBondContact O-N 2.98Å; L1019-F1022 VanDerWaalsContact O-N 3.14Å; L1019-F1032 HydrophobicContact CD2-CE1 4.25Å; L1019-V1033 HydrophobicContact CD2-CG1 4.48Å; L1019-M1036 HydrophobicContact CD1-CB 4.1Å; L1019-M1036 HydrophobicContact CD2-CB 3.91Å; L1019-V1040 HydrophobicContact CD1-CB 4.25Å; L1019-V1040 HydrophobicContact CD1-CG1 3.81Å
1020	E	89.3	Confident	90.8	Very high	159 Å²	159	72.3 Å²	72.3	74%	0.743	37%	0.372	S	S	*	.	H	α-helix	trans	-52.9	-30.5	173.2	-74	172.5	176.7	0	0	113.2	Q1016	Q1016-E1020 WeakPolarHBondContact O-CG 3.13Å; Q1016-E1020 PolarHBondContact O-N 3.47Å
1021	T	87.4	Confident	90.7	Very high	93 Å²	93	69.1 Å²	69.1	57%	0.571	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	14.2	-175.4	56.8	0	0	0	0	113.2	K1017 D1018 L1019	K1017-T1021 PolarHBondContact O-N 3.49Å; K1017-T1021 PolarHBondContact O-OG1 3.32Å; D1018-T1021 PolarHBondContact O-OG1 2.91Å; L1019-T1021 PolarHBondContact O-N 3.09Å; L1019-T1021 VanDerWaalsContact O-N 3.1Å
1022	F	90.4	Very high	90.7	Very high	25 Å²	25	67 Å²	67	11%	0.11	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-81.3	136.5	-174.8	-142.9	-94.8	0	0	0	112.1	R878 R882 D1018 L1019 F1032 V1033	R878-F1022 HydrophobicContact CB-CE2 3.76Å; R878-F1022 HydrophobicContact CB-CZ 3.76Å; R878-F1022 HydrophobicContact CG-CE2 4.29Å; R878-F1022 HydrophobicContact CG-CZ 4.45Å; R882-F1022 HydrophobicContact CG-CE2 4.42Å; R882-F1022 HydrophobicContact CG-CZ 3.72Å; D1018-F1022 WeakPolarHBondContact O-CB 3.49Å; D1018-F1022 WeakPolarHBondContact O-CD2 3.44Å; D1018-F1022 PolarHBondContact O-N 3.03Å; L1019-F1022 WeakPolarHBondContact O-CB 3.36Å; L1019-F1022 PolarHBondContact O-N 2.98Å; L1019-F1022 VanDerWaalsContact O-N 3.14Å; F1022-F1032 HydrophobicContact CD1-CD1 4.12Å; F1022-F1032 HydrophobicContact CD1-CE1 4.35Å; F1022-F1032 HydrophobicContact CD2-CE1 4.03Å; F1022-F1032 AromaticContact CE1-CD1 3.59Å; F1022-F1032 HydrophobicContact CE1-CD1 3.59Å; F1022-F1032 AromaticContact CE1-CE1 3.91Å; F1022-F1032 HydrophobicContact CE1-CE1 3.91Å; F1022-F1032 HydrophobicContact CE2-CD1 4.14Å; F1022-F1032 AromaticContact CE2-CE1 3.57Å; F1022-F1032 HydrophobicContact CE2-CE1 3.57Å; F1022-F1032 HydrophobicContact CE2-CZ 4.33Å; F1022-F1032 HydrophobicContact CG-CE1 4.41Å; F1022-F1032 AromaticContact CZ-CD1 3.61Å; F1022-F1032 HydrophobicContact CZ-CD1 3.61Å; F1022-F1032 AromaticContact CZ-CE1 3.5Å; F1022-F1032 HydrophobicContact CZ-CE1 3.5Å; F1022-F1032 HydrophobicContact CZ-CZ 4.36Å; F1022-V1033 HydrophobicContact CB-CG2 4.32Å; F1022-V1033 HydrophobicContact CD1-CG2 3.62Å; F1022-V1033 HydrophobicContact CE1-CG2 4.36Å; F1022-V1033 HydrophobicContact CG-CG2 4.25Å
1023	P	86.1	Confident	90.6	Very high	39 Å²	39	69.2 Å²	69.2	25%	0.253	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-66.4	150.7	175.7	28	-35.8	0	0	0	111.6	R878	R878-P1023 HydrophobicContact CG-CG 4.34Å
1024	P	86.2	Confident	90.5	Very high	113 Å²	113	67.8 Å²	67.8	73%	0.734	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-54.9	155.5	172.8	-26.4	35	0	0	0	113.6	Q1026	P1024-Q1026 PolarHBondContact O-N 3.36Å
1025	A	89.2	Confident	90.6	Very high	65 Å²	65	68.3 Å²	68.3	54%	0.537	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-46.6	128	178.5	0	0	0	0	0	112.2	D1030	A1025-D1030 HydrophobicContact CB-CB 4.05Å
1026	Q	86	Confident	90.6	Very high	46 Å²	46	67.9 Å²	67.9	22%	0.215	36%	0.356	C	S	.	.	S	Bend	trans	-77.6	-25.4	-173.5	-65.7	164.9	100	0	0	113.6	K877 P1024 D1030	K877-Q1026 HydrophobicContact CD-CG 3.86Å; K877-Q1026 HydrophobicContact CG-CG 4.43Å; P1024-Q1026 PolarHBondContact O-N 3.36Å; Q1026-D1030 WeakPolarHBondContact CB-OD2 3.38Å; Q1026-D1030 VanDerWaalsContact CG-OD2 3.31Å; Q1026-D1030 WeakPolarHBondContact CG-OD2 3.49Å; Q1026-D1030 PolarHBondContact N-OD2 2.71Å; Q1026-D1030 PolarHBondContact NE2-OD2 2.79Å
1027	N	89	Confident	90.6	Very high	72 Å²	72	67.1 Å²	67.1	39%	0.385	36%	0.358	S	S	.	.	S	Bend	trans	-165.7	177.2	179.9	57.9	62.6	0	0	0	108.7	N1029 D1030	N1027-N1029 PolarHBondContact O-N 3.44Å; N1027-N1029 VanDerWaalsContact O-N 3.09Å; N1027-N1029 WeakPolarHBondContact OD1-CB 3.32Å; N1027-N1029 PolarHBondContact OD1-N 2.91Å; N1027-D1030 WeakPolarHBondContact O-CB 3.4Å; N1027-D1030 PolarHBondContact O-N 3.48Å; N1027-D1030 VanDerWaalsContact O-N 3.08Å
1028	E	87.2	Confident	90.8	Very high	182 Å²	182	66.3 Å²	66.3	85%	0.85	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-17.4	-176.3	-60.7	177.9	169.1	0	0	114.8	H1031	E1028-H1031 PolarHBondContact O-CE1 3Å
1029	N	86.4	Confident	91.2	Very high	61 Å²	61	65.1 Å²	65.1	33%	0.326	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-3.1	177.8	-66.4	-64	0	0	0	113.8	L825 Q826 N1027 H1031	L825-N1029 CarbonylContact C-O 3.57Å; Q826-N1029 WeakPolarHBondContact CA-O 3.31Å; Q826-N1029 HydrophobicContact CG-CB 3.99Å; Q826-N1029 VanDerWaalsContact CG-O 3.22Å; Q826-N1029 WeakPolarHBondContact CG-O 3.35Å; Q826-N1029 PolarHBondContact N-O 3.29Å; Q826-N1029 PolarHBondContact NE2-OD1 3.44Å; N1027-N1029 PolarHBondContact O-N 3.44Å; N1027-N1029 VanDerWaalsContact O-N 3.09Å; N1027-N1029 WeakPolarHBondContact OD1-CB 3.32Å; N1027-N1029 PolarHBondContact OD1-N 2.91Å; N1029-H1031 VanDerWaalsContact C-N 3.33Å; N1029-H1031 PolarHBondContact O-N 2.94Å; N1029-H1031 VanDerWaalsContact O-N 3.08Å
1030	D	94.3	Very high	91.4	Very high	4 Å²	4	64.6 Å²	64.6	2%	0.021	35%	0.35	C	S	.	.			trans	-88.3	61.6	-171.5	-164.6	-0.2	0	0	0	113.1	L825 R882 A1025 Q1026 N1027 F1032	L825-D1030 HydrophobicContact CD2-CB 4.35Å; R882-D1030 IonicContact CZ-OD1 3.28Å; R882-D1030 IonicContact CZ-OD2 2.78Å; R882-D1030 IonicContact NH1-OD1 2.69Å; R882-D1030 PolarHBondContact NH1-OD1 3.31Å; R882-D1030 IonicContact NH2-OD1 3.86Å; R882-D1030 PolarHBondContact NH2-OD1 2.9Å; R882-D1030 IonicContact NH2-OD2 2.68Å; R882-D1030 PolarHBondContact NH2-OD2 3.43Å; A1025-D1030 HydrophobicContact CB-CB 4.05Å; Q1026-D1030 WeakPolarHBondContact CB-OD2 3.38Å; Q1026-D1030 VanDerWaalsContact CG-OD2 3.31Å; Q1026-D1030 WeakPolarHBondContact CG-OD2 3.49Å; Q1026-D1030 PolarHBondContact N-OD2 2.71Å; Q1026-D1030 PolarHBondContact NE2-OD2 2.79Å; N1027-D1030 WeakPolarHBondContact O-CB 3.4Å; N1027-D1030 PolarHBondContact O-N 3.48Å; N1027-D1030 VanDerWaalsContact O-N 3.08Å; D1030-F1032 PolarHBondContact O-N 3.21Å; D1030-F1032 VanDerWaalsContact O-N 3.16Å
1031	H	94.3	Very high	91.7	Very high	72 Å²	72	61.7 Å²	61.7	33%	0.333	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.4	13.6	-178.7	-51	-49.4	0	0	0	114.5	L825 E1028 N1029 D1034 K1035	L825-H1031 PolarHBondContact O-N 3.48Å; L825-H1031 VanDerWaalsContact O-N 3.16Å; E1028-H1031 PolarHBondContact O-CE1 3Å; N1029-H1031 VanDerWaalsContact C-N 3.33Å; N1029-H1031 PolarHBondContact O-N 2.94Å; N1029-H1031 VanDerWaalsContact O-N 3.08Å; H1031-D1034 PolarHBondContact O-N 2.99Å; H1031-K1035 PolarHBondContact O-N 2.7Å; H1031-K1035 VanDerWaalsContact O-N 3.09Å
1032	F	94.6	Very high	92.2	Very high	3 Å²	3	61.5 Å²	61.5	1%	0.013	33%	0.333	C	S	.	.	H	α-helix	trans	-63.1	-46.2	-172.3	174.6	-92	0	0	0	112.5	L825 V827 R882 A885 I886 L1019 F1022 D1030 M1036	L825-F1032 PolarHBondContact O-N 2.97Å; V827-F1032 HydrophobicContact CG2-CB 4.33Å; V827-F1032 HydrophobicContact CG2-CD2 3.76Å; V827-F1032 HydrophobicContact CG2-CG 4.49Å; R882-F1032 HydrophobicContact CB-CD2 4.17Å; R882-F1032 HydrophobicContact CB-CE2 3.81Å; R882-F1032 HydrophobicContact CB-CZ 4.24Å; R882-F1032 HydrophobicContact CG-CD1 4.32Å; R882-F1032 HydrophobicContact CG-CD2 3.91Å; R882-F1032 HydrophobicContact CG-CE1 4.22Å; R882-F1032 HydrophobicContact CG-CE2 3.8Å; R882-F1032 HydrophobicContact CG-CG 4.17Å; R882-F1032 HydrophobicContact CG-CZ 3.96Å; A885-F1032 HydrophobicContact CB-CE2 3.92Å; A885-F1032 HydrophobicContact CB-CZ 3.7Å; I886-F1032 HydrophobicContact CG1-CE2 4.36Å; L1019-F1032 HydrophobicContact CD2-CE1 4.25Å; F1022-F1032 HydrophobicContact CD1-CD1 4.12Å; F1022-F1032 HydrophobicContact CD1-CE1 4.35Å; F1022-F1032 HydrophobicContact CD2-CE1 4.03Å; F1022-F1032 AromaticContact CE1-CD1 3.59Å; F1022-F1032 HydrophobicContact CE1-CD1 3.59Å; F1022-F1032 AromaticContact CE1-CE1 3.91Å; F1022-F1032 HydrophobicContact CE1-CE1 3.91Å; F1022-F1032 HydrophobicContact CE2-CD1 4.14Å; F1022-F1032 AromaticContact CE2-CE1 3.57Å; F1022-F1032 HydrophobicContact CE2-CE1 3.57Å; F1022-F1032 HydrophobicContact CE2-CZ 4.33Å; F1022-F1032 HydrophobicContact CG-CE1 4.41Å; F1022-F1032 AromaticContact CZ-CD1 3.61Å; F1022-F1032 HydrophobicContact CZ-CD1 3.61Å; F1022-F1032 AromaticContact CZ-CE1 3.5Å; F1022-F1032 HydrophobicContact CZ-CE1 3.5Å; F1022-F1032 HydrophobicContact CZ-CZ 4.36Å; D1030-F1032 PolarHBondContact O-N 3.21Å; D1030-F1032 VanDerWaalsContact O-N 3.16Å; F1032-M1036 HydrophobicContact CD1-CG 4.45Å; F1032-M1036 HydrophobicContact CD2-CE 4.33Å; F1032-M1036 HydrophobicContact CD2-CG 3.92Å; F1032-M1036 HydrophobicContact CE1-CG 4.19Å; F1032-M1036 HydrophobicContact CE2-CE 3.86Å; F1032-M1036 HydrophobicContact CE2-CG 3.62Å; F1032-M1036 HydrophobicContact CG-CG 4.33Å; F1032-M1036 HydrophobicContact CZ-CB 4.49Å; F1032-M1036 HydrophobicContact CZ-CG 3.77Å; F1032-M1036 WeakPolarHBondContact O-CB 3.27Å; F1032-M1036 VanDerWaalsContact O-CG 3.27Å; F1032-M1036 WeakPolarHBondContact O-CG 3.21Å; F1032-M1036 PolarHBondContact O-N 3.38Å
1033	V	93.7	Very high	92.5	Very high	45 Å²	45	60.3 Å²	60.3	27%	0.273	33%	0.328	S	S	.	.	H	α-helix	trans	-64.3	-46.4	-179.5	179	0	0	0	0	110.4	L1019 F1022 K1035 M1036 S1037	L1019-V1033 HydrophobicContact CD2-CG1 4.48Å; F1022-V1033 HydrophobicContact CB-CG2 4.32Å; F1022-V1033 HydrophobicContact CD1-CG2 3.62Å; F1022-V1033 HydrophobicContact CE1-CG2 4.36Å; F1022-V1033 HydrophobicContact CG-CG2 4.25Å; V1033-K1035 PolarHBondContact O-N 3.29Å; V1033-M1036 PolarHBondContact O-N 3.48Å; V1033-S1037 VanDerWaalsContact O-CB 3.25Å; V1033-S1037 WeakPolarHBondContact O-CB 3.27Å; V1033-S1037 PolarHBondContact O-N 3.01Å; V1033-S1037 PolarHBondContact O-OG 2.86Å
1034	D	91.9	Very high	93	Very high	99 Å²	99	60.3 Å²	60.3	53%	0.529	32%	0.324	S	S	.	.	H	α-helix	trans	-57	-52.8	179.8	-49.7	-41.2	0	0	0	111.5	H1031 I1038	H1031-D1034 PolarHBondContact O-N 2.99Å; D1034-I1038 WeakPolarHBondContact O-CG1 3.43Å; D1034-I1038 PolarHBondContact O-N 2.71Å
1035	K	95	Very high	93.5	Very high	76 Å²	76	59.2 Å²	59.2	33%	0.33	31%	0.309	S	S	.	.	H	α-helix	trans	-69	-39.6	-178.7	-78.8	-178.3	166.2	-176.5	0	113.2	Q826 V827 H1031 V1033 F1039	Q826-K1035 WeakPolarHBondContact O-CD 3.45Å; Q826-K1035 WeakPolarHBondContact O-CE 3.29Å; Q826-K1035 PolarHBondContact O-NZ 3.29Å; V827-K1035 HydrophobicContact CB-CD 3.79Å; V827-K1035 HydrophobicContact CG1-CD 4.39Å; V827-K1035 PolarHBondContact O-NZ 3.49Å; H1031-K1035 PolarHBondContact O-N 2.7Å; H1031-K1035 VanDerWaalsContact O-N 3.09Å; V1033-K1035 PolarHBondContact O-N 3.29Å; K1035-F1039 WeakPolarHBondContact O-CB 3.3Å; K1035-F1039 PolarHBondContact O-N 3.08Å
1036	M	95.8	Very high	93.8	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-75.9	-26.6	-179.7	-69.1	-57.9	-179.6	0	0	112.7	V827 A885 I886 K889 L1015 L1019 F1032 V1033 F1039 V1040	V827-M1036 HydrophobicContact CG1-CE 3.97Å; V827-M1036 HydrophobicContact CG2-CE 4.15Å; A885-M1036 HydrophobicContact CB-CE 4.05Å; A885-M1036 HydrophobicContact CB-SD 4.3Å; I886-M1036 HydrophobicContact CB-CE 4.17Å; I886-M1036 HydrophobicContact CG1-CE 3.48Å; I886-M1036 VanDerWaalsContact CG1-CE 3.48Å; K889-M1036 HydrophobicContact CB-CE 4.26Å; K889-M1036 HydrophobicContact CB-SD 4.38Å; K889-M1036 HydrophobicContact CD-CE 4.21Å; K889-M1036 HydrophobicContact CD-SD 4.12Å; L1015-M1036 HydrophobicContact CD1-CB 4.44Å; L1019-M1036 HydrophobicContact CD1-CB 4.1Å; L1019-M1036 HydrophobicContact CD2-CB 3.91Å; F1032-M1036 HydrophobicContact CD1-CG 4.45Å; F1032-M1036 HydrophobicContact CD2-CE 4.33Å; F1032-M1036 HydrophobicContact CD2-CG 3.92Å; F1032-M1036 HydrophobicContact CE1-CG 4.19Å; F1032-M1036 HydrophobicContact CE2-CE 3.86Å; F1032-M1036 HydrophobicContact CE2-CG 3.62Å; F1032-M1036 HydrophobicContact CG-CG 4.33Å; F1032-M1036 HydrophobicContact CZ-CB 4.49Å; F1032-M1036 HydrophobicContact CZ-CG 3.77Å; F1032-M1036 WeakPolarHBondContact O-CB 3.27Å; F1032-M1036 VanDerWaalsContact O-CG 3.27Å; F1032-M1036 WeakPolarHBondContact O-CG 3.21Å; F1032-M1036 PolarHBondContact O-N 3.38Å; V1033-M1036 PolarHBondContact O-N 3.48Å; M1036-F1039 HydrophobicContact SD-CD1 4Å; M1036-V1040 VanDerWaalsContact O-CB 3.3Å; M1036-V1040 WeakPolarHBondContact O-CB 3.35Å; M1036-V1040 WeakPolarHBondContact O-CG1 3.48Å; M1036-V1040 PolarHBondContact O-N 3.47Å
1037	S	94.4	Very high	94.3	Very high	48 Å²	48	56.9 Å²	56.9	34%	0.336	29%	0.286	S	S	.	.	H	α-helix	trans	-68.6	-44.8	172	-57.6	0	0	0	0	110.9	V1033 V1040 T1041	V1033-S1037 VanDerWaalsContact O-CB 3.25Å; V1033-S1037 WeakPolarHBondContact O-CB 3.27Å; V1033-S1037 PolarHBondContact O-N 3.01Å; V1033-S1037 PolarHBondContact O-OG 2.86Å; S1037-V1040 PolarHBondContact O-N 2.86Å; S1037-T1041 PolarHBondContact O-N 3.34Å; S1037-T1041 PolarHBondContact O-OG1 3.01Å
1038	I	95.4	Very high	94.7	Very high	128 Å²	128	58.6 Å²	58.6	66%	0.656	29%	0.292	S	S	*	.	H	α-helix	trans	-60.3	-47.4	172.8	-65.2	165.6	0	0	0	110.6	D1034 Y1042	D1034-I1038 WeakPolarHBondContact O-CG1 3.43Å; D1034-I1038 PolarHBondContact O-N 2.71Å; I1038-Y1042 PolarHBondContact O-N 3Å
1039	F	97.1	Very high	95.1	Very high	14 Å²	14	55 Å²	55	6%	0.061	27%	0.274	C	S	.	.	H	α-helix	trans	-64.4	-42.3	179.6	166.8	-107	0	0	0	112.9	F888 K889 F892 L1015 K1035 M1036 T1041 Y1042 A1043	F888-F1039 AromaticContact CD1-CE1 3.73Å; F888-F1039 HydrophobicContact CD1-CE1 3.73Å; F888-F1039 AromaticContact CD1-CZ 3.99Å; F888-F1039 HydrophobicContact CD1-CZ 3.99Å; F888-F1039 AromaticContact CE1-CE1 3.79Å; F888-F1039 HydrophobicContact CE1-CE1 3.79Å; F888-F1039 AromaticContact CE1-CZ 3.82Å; F888-F1039 HydrophobicContact CE1-CZ 3.82Å; F888-F1039 HydrophobicContact CZ-CZ 4.42Å; K889-F1039 VanDerWaalsContact CA-CZ 3.5Å; K889-F1039 HydrophobicContact CB-CD1 3.88Å; K889-F1039 HydrophobicContact CB-CD2 4.26Å; K889-F1039 HydrophobicContact CB-CE1 3.73Å; K889-F1039 HydrophobicContact CB-CE2 4.11Å; K889-F1039 HydrophobicContact CB-CG 4.16Å; K889-F1039 HydrophobicContact CB-CZ 3.87Å; K889-F1039 HydrophobicContact CD-CB 3.99Å; K889-F1039 HydrophobicContact CD-CD1 4.2Å; K889-F1039 HydrophobicContact CD-CD2 4.03Å; K889-F1039 HydrophobicContact CD-CG 3.77Å; K889-F1039 HydrophobicContact CG-CD1 4.26Å; K889-F1039 HydrophobicContact CG-CD2 3.91Å; K889-F1039 HydrophobicContact CG-CE1 4.43Å; K889-F1039 HydrophobicContact CG-CE2 4.08Å; K889-F1039 HydrophobicContact CG-CG 4.02Å; K889-F1039 HydrophobicContact CG-CZ 4.36Å; F892-F1039 HydrophobicContact CB-CE2 3.92Å; F892-F1039 HydrophobicContact CB-CZ 3.88Å; F892-F1039 HydrophobicContact CD1-CE2 4.08Å; F892-F1039 HydrophobicContact CD2-CZ 4.35Å; F892-F1039 AromaticContact CG-CE2 3.95Å; F892-F1039 HydrophobicContact CG-CE2 3.95Å; F892-F1039 HydrophobicContact CG-CZ 4.01Å; L1015-F1039 HydrophobicContact CD2-CD1 3.74Å; L1015-F1039 HydrophobicContact CD2-CE1 3.74Å; K1035-F1039 WeakPolarHBondContact O-CB 3.3Å; K1035-F1039 PolarHBondContact O-N 3.08Å; M1036-F1039 HydrophobicContact SD-CD1 4Å; F1039-T1041 VanDerWaalsContact C-N 3.34Å; F1039-T1041 PolarHBondContact O-N 3.24Å; F1039-Y1042 PolarHBondContact O-N 3.32Å; F1039-A1043 HydrophobicContact CD2-CB 4.46Å; F1039-A1043 HydrophobicContact CE1-CB 4.31Å; F1039-A1043 HydrophobicContact CE2-CB 3.93Å; F1039-A1043 HydrophobicContact CZ-CB 3.82Å; F1039-A1043 VanDerWaalsContact O-CB 3.29Å; F1039-A1043 WeakPolarHBondContact O-CB 3.48Å; F1039-A1043 PolarHBondContact O-N 3.08Å
1040	V	96.2	Very high	95.6	Very high	12 Å²	12	52.2 Å²	52.2	7%	0.073	26%	0.259	C	S	.	.	H	α-helix	trans	-70.6	-31.3	-176.3	82.6	0	0	0	0	112.2	I1012 L1015 Q1016 L1019 M1036 S1037 Q1044	I1012-V1040 HydrophobicContact CG2-CG2 3.96Å; L1015-V1040 HydrophobicContact CB-CG2 4.09Å; L1015-V1040 HydrophobicContact CD2-CB 3.96Å; L1015-V1040 HydrophobicContact CD2-CG2 3.87Å; L1015-V1040 HydrophobicContact CG-CB 4.18Å; L1015-V1040 HydrophobicContact CG-CG2 3.86Å; Q1016-V1040 HydrophobicContact CG-CG1 4.48Å; Q1016-V1040 HydrophobicContact CG-CG2 3.64Å; L1019-V1040 HydrophobicContact CD1-CB 4.25Å; L1019-V1040 HydrophobicContact CD1-CG1 3.81Å; M1036-V1040 VanDerWaalsContact O-CB 3.3Å; M1036-V1040 WeakPolarHBondContact O-CB 3.35Å; M1036-V1040 WeakPolarHBondContact O-CG1 3.48Å; M1036-V1040 PolarHBondContact O-N 3.47Å; S1037-V1040 PolarHBondContact O-N 2.86Å; V1040-Q1044 VanDerWaalsContact O-CB 3.27Å; V1040-Q1044 WeakPolarHBondContact O-CB 3.38Å; V1040-Q1044 PolarHBondContact O-N 3.48Å
1041	T	95.9	Very high	95.7	Very high	98 Å²	98	53.7 Å²	53.7	60%	0.601	27%	0.266	S	S	*	.	H	α-helix	trans	-64.2	-48.3	169.5	-61.1	0	0	0	0	111.2	S1037 F1039 Q1044 E1045	S1037-T1041 PolarHBondContact O-N 3.34Å; S1037-T1041 PolarHBondContact O-OG1 3.01Å; F1039-T1041 VanDerWaalsContact C-N 3.34Å; F1039-T1041 PolarHBondContact O-N 3.24Å; T1041-Q1044 PolarHBondContact O-N 2.86Å; T1041-E1045 PolarHBondContact O-N 3.17Å; T1041-E1045 VanDerWaalsContact O-N 3.08Å
1042	Y	96.5	Very high	95.8	Very high	89 Å²	89	52 Å²	52	35%	0.349	27%	0.269	S	S	.	.	H	α-helix	trans	-60.4	-46.8	175.7	171.3	-103.3	0	0	0	112.2	F892 I1038 F1039 Q1044 E1045 Q1046	F892-Y1042 HydrophobicContact CD1-CE1 4.32Å; F892-Y1042 HydrophobicContact CE1-CD1 4.45Å; F892-Y1042 HydrophobicContact CE1-CE1 4.1Å; I1038-Y1042 PolarHBondContact O-N 3Å; F1039-Y1042 PolarHBondContact O-N 3.32Å; Y1042-Q1044 PolarHBondContact O-N 3.34Å; Y1042-E1045 PolarHBondContact O-N 3.16Å; Y1042-Q1046 HydrophobicContact CD1-CG 4.36Å; Y1042-Q1046 HydrophobicContact CD2-CG 4.07Å; Y1042-Q1046 HydrophobicContact CE1-CG 3.96Å; Y1042-Q1046 HydrophobicContact CE2-CG 3.64Å; Y1042-Q1046 HydrophobicContact CG-CG 4.42Å; Y1042-Q1046 WeakPolarHBondContact O-CG 3.41Å; Y1042-Q1046 PolarHBondContact O-N 3.16Å
1043	A	96.6	Very high	96	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-63.8	-39.8	-179	0	0	0	0	0	112	F892 I1012 F1039 Y1047	F892-A1043 HydrophobicContact CD2-CB 4.21Å; F892-A1043 HydrophobicContact CE1-CB 4.18Å; F892-A1043 HydrophobicContact CE2-CB 3.81Å; F892-A1043 HydrophobicContact CZ-CB 3.8Å; I1012-A1043 HydrophobicContact CD1-CB 4.25Å; I1012-A1043 WeakPolarHBondContact CD1-O 3.46Å; I1012-A1043 HydrophobicContact CG1-CB 4.19Å; F1039-A1043 HydrophobicContact CD2-CB 4.46Å; F1039-A1043 HydrophobicContact CE1-CB 4.31Å; F1039-A1043 HydrophobicContact CE2-CB 3.93Å; F1039-A1043 HydrophobicContact CZ-CB 3.82Å; F1039-A1043 VanDerWaalsContact O-CB 3.29Å; F1039-A1043 WeakPolarHBondContact O-CB 3.48Å; F1039-A1043 PolarHBondContact O-N 3.08Å; A1043-Y1047 WeakPolarHBondContact O-CB 3.47Å; A1043-Y1047 PolarHBondContact O-N 3.4Å
1044	Q	96.8	Very high	96.1	Very high	39 Å²	39	52.8 Å²	52.8	18%	0.182	27%	0.27	C	S	.	.	H	α-helix	trans	-60.9	-47.8	172.8	-176.8	69.9	34.1	0	0	111.2	I1012 V1040 T1041 Y1042 Q1046 Y1047 E1048	I1012-Q1044 HydrophobicContact CG2-CB 4.26Å; I1012-Q1044 VanDerWaalsContact CG2-OE1 3.23Å; V1040-Q1044 VanDerWaalsContact O-CB 3.27Å; V1040-Q1044 WeakPolarHBondContact O-CB 3.38Å; V1040-Q1044 PolarHBondContact O-N 3.48Å; T1041-Q1044 PolarHBondContact O-N 2.86Å; Y1042-Q1044 PolarHBondContact O-N 3.34Å; Q1044-Q1046 PolarHBondContact O-N 2.81Å; Q1044-Y1047 PolarHBondContact O-N 2.85Å; Q1044-E1048 PolarHBondContact NE2-OE1 3.38Å; Q1044-E1048 WeakPolarHBondContact O-CB 3.43Å; Q1044-E1048 WeakPolarHBondContact O-CG 3.28Å; Q1044-E1048 PolarHBondContact O-N 3.49Å
1045	E	96.4	Very high	96.4	Very high	90 Å²	90	53.3 Å²	53.3	42%	0.421	27%	0.268	S	S	.	.	H	α-helix	trans	-62.7	-41.6	179.7	-167.2	-159.4	148.6	0	0	112.4	T1041 Y1042 K1049	T1041-E1045 PolarHBondContact O-N 3.17Å; T1041-E1045 VanDerWaalsContact O-N 3.08Å; Y1042-E1045 PolarHBondContact O-N 3.16Å; E1045-K1049 VanDerWaalsContact O-CG 3.32Å; E1045-K1049 WeakPolarHBondContact O-CG 3.26Å; E1045-K1049 PolarHBondContact O-N 3.32Å; E1045-K1049 WeakPolarHBondContact OE1-CE 3.29Å; E1045-K1049 IonicContact OE1-NZ 2.76Å; E1045-K1049 PolarHBondContact OE1-NZ 3.31Å
1046	Q	96.2	Very high	96.5	Very high	34 Å²	34	52.6 Å²	52.6	16%	0.159	27%	0.268	C	S	.	.	H	α-helix	trans	-69.6	-38.2	176.4	-67.7	-50.9	-48.7	0	0	112.3	F892 Y1042 Q1044 L1050	F892-Q1046 HydrophobicContact CE1-CB 3.9Å; F892-Q1046 HydrophobicContact CE1-CG 4.28Å; F892-Q1046 HydrophobicContact CZ-CB 3.82Å; Y1042-Q1046 HydrophobicContact CD1-CG 4.36Å; Y1042-Q1046 HydrophobicContact CD2-CG 4.07Å; Y1042-Q1046 HydrophobicContact CE1-CG 3.96Å; Y1042-Q1046 HydrophobicContact CE2-CG 3.64Å; Y1042-Q1046 HydrophobicContact CG-CG 4.42Å; Y1042-Q1046 WeakPolarHBondContact O-CG 3.41Å; Y1042-Q1046 PolarHBondContact O-N 3.16Å; Q1044-Q1046 PolarHBondContact O-N 2.81Å; Q1046-L1050 WeakPolarHBondContact O-CB 3.36Å; Q1046-L1050 PolarHBondContact O-N 3.48Å; Q1046-L1050 VanDerWaalsContact O-N 3.16Å
1047	Y	97	Very high	96.6	Very high	29 Å²	29	52.8 Å²	52.8	11%	0.114	27%	0.269	C	S	.	.	H	α-helix	trans	-65.5	-47	175.3	168.6	-101.4	0	0	0	111.8	L1005 M1008 I1012 A1043 Q1044 K1049 L1050 D1051	L1005-Y1047 HydrophobicContact CD2-CD2 4.48Å; L1005-Y1047 HydrophobicContact CD2-CE2 4.32Å; L1005-Y1047 WeakPolarHBondContact O-CE2 3.22Å; M1008-Y1047 HydrophobicContact CB-CD2 4.35Å; M1008-Y1047 HydrophobicContact CG-CD2 4.04Å; M1008-Y1047 HydrophobicContact SD-CD2 3.95Å; I1012-Y1047 VanDerWaalsContact CD1-CB 3.42Å; I1012-Y1047 HydrophobicContact CD1-CD1 4.28Å; I1012-Y1047 HydrophobicContact CD1-CD2 4.34Å; I1012-Y1047 HydrophobicContact CD1-CG 3.75Å; A1043-Y1047 WeakPolarHBondContact O-CB 3.47Å; A1043-Y1047 PolarHBondContact O-N 3.4Å; Q1044-Y1047 PolarHBondContact O-N 2.85Å; Y1047-K1049 VanDerWaalsContact C-N 3.29Å; Y1047-K1049 PolarHBondContact O-N 2.96Å; Y1047-L1050 PolarHBondContact O-N 2.97Å; Y1047-D1051 HydrophobicContact CE1-CB 4.39Å; Y1047-D1051 HydrophobicContact CE2-CB 4.3Å; Y1047-D1051 VanDerWaalsContact O-CB 3.29Å; Y1047-D1051 WeakPolarHBondContact O-CB 3.4Å; Y1047-D1051 PolarHBondContact O-N 2.69Å
1048	E	96.9	Very high	96.7	Very high	108 Å²	108	54.6 Å²	54.6	51%	0.505	27%	0.272	S	S	.	.	H	α-helix	trans	-59.8	-38.5	178.2	-76.4	176	-176.1	0	0	112.3	Q1044 G1052	Q1044-E1048 PolarHBondContact NE2-OE1 3.38Å; Q1044-E1048 WeakPolarHBondContact O-CB 3.43Å; Q1044-E1048 WeakPolarHBondContact O-CG 3.28Å; Q1044-E1048 PolarHBondContact O-N 3.49Å; E1048-G1052 PolarHBondContact O-N 3.05Å
1049	K	95.9	Very high	96.8	Very high	106 Å²	106	54 Å²	54	46%	0.461	26%	0.264	S	S	.	.	H	α-helix	trans	-62.8	-43.3	172.9	-73.1	169.5	-175.7	174.4	0	112	E1045 Y1047 M1053	E1045-K1049 VanDerWaalsContact O-CG 3.32Å; E1045-K1049 WeakPolarHBondContact O-CG 3.26Å; E1045-K1049 PolarHBondContact O-N 3.32Å; E1045-K1049 WeakPolarHBondContact OE1-CE 3.29Å; E1045-K1049 IonicContact OE1-NZ 2.76Å; E1045-K1049 PolarHBondContact OE1-NZ 3.31Å; Y1047-K1049 VanDerWaalsContact C-N 3.29Å; Y1047-K1049 PolarHBondContact O-N 2.96Å; K1049-M1053 VanDerWaalsContact O-CG 3.3Å; K1049-M1053 WeakPolarHBondContact O-CG 3.5Å; K1049-M1053 PolarHBondContact O-N 3.19Å
1050	L	96.3	Very high	96.8	Very high	3 Å²	3	54.5 Å²	54.5	2%	0.016	27%	0.267	C	S	.	.	H	α-helix	trans	-75.5	-39.2	-176.6	-169.2	65.7	0	0	0	112.8	Q896 I899 K900 L1005 Q1046 Y1047 G1052 M1053 H1054	Q896-L1050 HydrophobicContact CG-CD2 4.35Å; I899-L1050 HydrophobicContact CB-CD2 4.02Å; I899-L1050 HydrophobicContact CD1-CD2 4.33Å; I899-L1050 HydrophobicContact CG2-CD1 4.35Å; I899-L1050 HydrophobicContact CG2-CD2 3.85Å; I899-L1050 HydrophobicContact CG2-CG 4.24Å; K900-L1050 HydrophobicContact CB-CD1 3.78Å; K900-L1050 HydrophobicContact CG-CD1 4.03Å; L1005-L1050 HydrophobicContact CD2-CB 4.39Å; L1005-L1050 HydrophobicContact CD2-CD2 3.71Å; L1005-L1050 HydrophobicContact CD2-CG 3.86Å; Q1046-L1050 WeakPolarHBondContact O-CB 3.36Å; Q1046-L1050 PolarHBondContact O-N 3.48Å; Q1046-L1050 VanDerWaalsContact O-N 3.16Å; Y1047-L1050 PolarHBondContact O-N 2.97Å; L1050-G1052 VanDerWaalsContact C-N 3.35Å; L1050-M1053 PolarHBondContact O-N 2.88Å; L1050-H1054 PolarHBondContact O-N 2.8Å
1051	D	96.6	Very high	96.8	Very high	34 Å²	34	54.5 Å²	54.5	18%	0.182	27%	0.266	C	S	.	.	H	α-helix	trans	-63.1	-39	170.4	168.1	84.4	0	0	0	111.4	Y1047 H1054 K1055	Y1047-D1051 HydrophobicContact CE1-CB 4.39Å; Y1047-D1051 HydrophobicContact CE2-CB 4.3Å; Y1047-D1051 VanDerWaalsContact O-CB 3.29Å; Y1047-D1051 WeakPolarHBondContact O-CB 3.4Å; Y1047-D1051 PolarHBondContact O-N 2.69Å; D1051-H1054 PolarHBondContact O-N 2.93Å; D1051-K1055 WeakPolarHBondContact O-CG 3.42Å; D1051-K1055 PolarHBondContact O-N 3.27Å; D1051-K1055 WeakPolarHBondContact OD1-CE 3.46Å; D1051-K1055 IonicContact OD1-NZ 3.2Å; D1051-K1055 PolarHBondContact OD1-NZ 3.4Å; D1051-K1055 WeakPolarHBondContact OD2-CE 3.18Å; D1051-K1055 IonicContact OD2-NZ 2.81Å; D1051-K1055 PolarHBondContact OD2-NZ 3.28Å
1052	G	97.3	Very high	96.9	Very high	38 Å²	38	53.1 Å²	53.1	39%	0.392	26%	0.257	S	S	.	.	H	α-helix	trans	-63	-42.9	170.7	0	0	0	0	0	113.2	E1048 L1050 N1056	E1048-G1052 PolarHBondContact O-N 3.05Å; L1050-G1052 VanDerWaalsContact C-N 3.35Å; G1052-N1056 PolarHBondContact O-N 3.08Å; G1052-N1056 VanDerWaalsContact O-N 3.1Å
1053	M	97.2	Very high	96.8	Very high	59 Å²	59	51.6 Å²	51.6	29%	0.291	25%	0.253	S	S	.	.	H	α-helix	trans	-62.7	-43.1	173.3	-71.6	171.5	64	0	0	111.8	K900 V903 V904 K1049 L1050 N1056 M1057	K900-M1053 HydrophobicContact CG-CE 4.31Å; V903-M1053 HydrophobicContact CG1-CB 3.82Å; V904-M1053 HydrophobicContact CG2-CE 3.43Å; V904-M1053 VanDerWaalsContact CG2-CE 3.43Å; K1049-M1053 VanDerWaalsContact O-CG 3.3Å; K1049-M1053 WeakPolarHBondContact O-CG 3.5Å; K1049-M1053 PolarHBondContact O-N 3.19Å; L1050-M1053 PolarHBondContact O-N 2.88Å; M1053-N1056 PolarHBondContact O-N 3.22Å; M1053-M1057 PolarHBondContact O-N 2.89Å
1054	H	97.5	Very high	96.8	Very high	4 Å²	4	51.6 Å²	51.6	2%	0.019	25%	0.253	C	S	.	.	H	α-helix	trans	-61.7	-46	177.2	-175.3	-101.5	0	0	0	112.3	I1001 Q1002 L1005 L1050 D1051 N1056 M1057 E1058	I1001-H1054 WeakPolarHBondContact CG2-CD2 3.38Å; Q1002-H1054 PolarHBondContact OE1-CE1 3.11Å; Q1002-H1054 VanDerWaalsContact OE1-CE1 3.3Å; L1005-H1054 HydrophobicContact CD1-CB 3.56Å; L1050-H1054 PolarHBondContact O-N 2.8Å; D1051-H1054 PolarHBondContact O-N 2.93Å; H1054-N1056 VanDerWaalsContact C-N 3.25Å; H1054-N1056 PolarHBondContact O-N 2.98Å; H1054-M1057 VanDerWaalsContact CD2-CE 3.46Å; H1054-M1057 WeakPolarHBondContact CD2-CE 3.3Å; H1054-M1057 WeakPolarHBondContact NE2-CE 3.42Å; H1054-M1057 WeakPolarHBondContact O-CA 3.32Å; H1054-M1057 VanDerWaalsContact O-CB 3.29Å; H1054-M1057 WeakPolarHBondContact O-CB 3.35Å; H1054-M1057 PolarHBondContact O-N 3.43Å; H1054-E1058 IonicContact CE1-OE1 2.96Å; H1054-E1058 IonicContact CE1-OE2 2.69Å; H1054-E1058 PolarHBondContact CE1-OE2 3.14Å; H1054-E1058 IonicContact ND1-OE2 2.7Å; H1054-E1058 PolarHBondContact ND1-OE2 3.42Å; H1054-E1058 VanDerWaalsContact ND1-OE2 3.11Å; H1054-E1058 WeakPolarHBondContact O-CG 3.37Å; H1054-E1058 PolarHBondContact O-N 3.33Å
1055	K	97.3	Very high	96.7	Very high	110 Å²	110	49.9 Å²	49.9	48%	0.478	25%	0.246	S	C	.	.	H	α-helix	trans	-64.2	-31.3	177.5	-73.3	164.7	-176.2	164.3	0	112.5	D1051 K1059	D1051-K1055 WeakPolarHBondContact O-CG 3.42Å; D1051-K1055 PolarHBondContact O-N 3.27Å; D1051-K1055 WeakPolarHBondContact OD1-CE 3.46Å; D1051-K1055 IonicContact OD1-NZ 3.2Å; D1051-K1055 PolarHBondContact OD1-NZ 3.4Å; D1051-K1055 WeakPolarHBondContact OD2-CE 3.18Å; D1051-K1055 IonicContact OD2-NZ 2.81Å; D1051-K1055 PolarHBondContact OD2-NZ 3.28Å; K1055-K1059 WeakPolarHBondContact O-CB 3.5Å; K1055-K1059 PolarHBondContact O-N 3.21Å; K1055-K1059 VanDerWaalsContact O-N 3.09Å
1056	N	97.2	Very high	96.5	Very high	61 Å²	61	51.7 Å²	51.7	33%	0.326	26%	0.259	S	S	.	.	H	α-helix	trans	-68.8	-42.7	170.4	-176	75.5	0	0	0	112	G1052 M1053 H1054 K1059 Q1060	G1052-N1056 PolarHBondContact O-N 3.08Å; G1052-N1056 VanDerWaalsContact O-N 3.1Å; M1053-N1056 PolarHBondContact O-N 3.22Å; H1054-N1056 VanDerWaalsContact C-N 3.25Å; H1054-N1056 PolarHBondContact O-N 2.98Å; N1056-K1059 PolarHBondContact O-N 3.1Å; N1056-Q1060 PolarHBondContact ND2-NE2 3.5Å; N1056-Q1060 WeakPolarHBondContact O-CB 3.49Å; N1056-Q1060 WeakPolarHBondContact O-CG 3.47Å; N1056-Q1060 PolarHBondContact O-N 3.46Å
1057	M	97.8	Very high	96.4	Very high	4 Å²	4	55.8 Å²	55.8	2%	0.02	27%	0.273	C	S	.	.	H	α-helix	trans	-58.4	-50.9	175.3	-177	-156.4	77.8	0	0	111.9	V903 V906 T907 I1001 M1053 H1054 K1059 Q1060 Y1061	V903-M1057 HydrophobicContact CB-SD 4.33Å; V903-M1057 HydrophobicContact CG1-CB 4.22Å; V903-M1057 HydrophobicContact CG1-SD 4.19Å; V903-M1057 HydrophobicContact CG2-SD 4.31Å; V906-M1057 HydrophobicContact CB-CG 3.7Å; V906-M1057 HydrophobicContact CB-SD 3.68Å; V906-M1057 HydrophobicContact CG1-CG 3.41Å; V906-M1057 VanDerWaalsContact CG1-CG 3.41Å; V906-M1057 HydrophobicContact CG1-SD 3.78Å; V906-M1057 HydrophobicContact CG2-SD 4.25Å; T907-M1057 WeakPolarHBondContact OG1-CB 3.29Å; I1001-M1057 HydrophobicContact CD1-SD 4.39Å; M1053-M1057 PolarHBondContact O-N 2.89Å; H1054-M1057 VanDerWaalsContact CD2-CE 3.46Å; H1054-M1057 WeakPolarHBondContact CD2-CE 3.3Å; H1054-M1057 WeakPolarHBondContact NE2-CE 3.42Å; H1054-M1057 WeakPolarHBondContact O-CA 3.32Å; H1054-M1057 VanDerWaalsContact O-CB 3.29Å; H1054-M1057 WeakPolarHBondContact O-CB 3.35Å; H1054-M1057 PolarHBondContact O-N 3.43Å; M1057-K1059 VanDerWaalsContact C-N 3.33Å; M1057-K1059 PolarHBondContact O-N 3.18Å; M1057-Q1060 PolarHBondContact O-N 2.7Å; M1057-Y1061 PolarHBondContact O-N 3.49Å
1058	E	96.8	Very high	96.3	Very high	86 Å²	86	55.7 Å²	55.7	40%	0.402	27%	0.274	S	S	.	.	H	α-helix	trans	-58.9	-43	176	-69.5	-179.6	109	0	0	112	H1054 T1062	H1054-E1058 IonicContact CE1-OE1 2.96Å; H1054-E1058 IonicContact CE1-OE2 2.69Å; H1054-E1058 PolarHBondContact CE1-OE2 3.14Å; H1054-E1058 IonicContact ND1-OE2 2.7Å; H1054-E1058 PolarHBondContact ND1-OE2 3.42Å; H1054-E1058 VanDerWaalsContact ND1-OE2 3.11Å; H1054-E1058 WeakPolarHBondContact O-CG 3.37Å; H1054-E1058 PolarHBondContact O-N 3.33Å; E1058-T1062 WeakPolarHBondContact O-CB 3.39Å; E1058-T1062 PolarHBondContact O-N 2.96Å; E1058-T1062 PolarHBondContact O-OG1 2.81Å
1059	K	97	Very high	96.2	Very high	116 Å²	116	56.6 Å²	56.6	50%	0.504	29%	0.286	S	S	.	.	H	α-helix	trans	-62.5	-48.2	176.3	178.3	-170.9	162.7	-169.7	0	111.3	K1055 N1056 M1057 Y1061 T1062 E1063	K1055-K1059 WeakPolarHBondContact O-CB 3.5Å; K1055-K1059 PolarHBondContact O-N 3.21Å; K1055-K1059 VanDerWaalsContact O-N 3.09Å; N1056-K1059 PolarHBondContact O-N 3.1Å; M1057-K1059 VanDerWaalsContact C-N 3.33Å; M1057-K1059 PolarHBondContact O-N 3.18Å; K1059-Y1061 VanDerWaalsContact C-N 3.35Å; K1059-Y1061 PolarHBondContact O-N 2.88Å; K1059-T1062 WeakPolarHBondContact O-CB 3.38Å; K1059-T1062 PolarHBondContact O-N 3.33Å; K1059-T1062 VanDerWaalsContact O-N 3.14Å; K1059-E1063 WeakPolarHBondContact CE-OE1 3.48Å; K1059-E1063 IonicContact NZ-OE1 3.24Å; K1059-E1063 PolarHBondContact O-N 3.5Å
1060	Q	97.1	Very high	96.1	Very high	25 Å²	25	53.2 Å²	53.2	12%	0.117	27%	0.271	C	S	.	.	H	α-helix	trans	-64.4	-38.7	180	-74.6	-179.4	-5.1	0	0	112.2	T907 C910 E911 N1056 M1057 T1062 E1063 L1064	T907-Q1060 VanDerWaalsContact CG2-OE1 3.24Å; T907-Q1060 PolarHBondContact O-OE1 2.93Å; C910-Q1060 HydrophobicContact CB-CB 3.88Å; E911-Q1060 PolarHBondContact OE1-NE2 2.95Å; N1056-Q1060 PolarHBondContact ND2-NE2 3.5Å; N1056-Q1060 WeakPolarHBondContact O-CB 3.49Å; N1056-Q1060 WeakPolarHBondContact O-CG 3.47Å; N1056-Q1060 PolarHBondContact O-N 3.46Å; M1057-Q1060 PolarHBondContact O-N 2.7Å; Q1060-T1062 VanDerWaalsContact C-N 3.31Å; Q1060-T1062 PolarHBondContact O-N 3.02Å; Q1060-E1063 PolarHBondContact O-N 3.29Å; Q1060-L1064 PolarHBondContact O-N 3.09Å
1061	Y	97.5	Very high	95.9	Very high	12 Å²	12	55.6 Å²	55.6	5%	0.047	28%	0.284	C	S	.	.	H	α-helix	trans	-65.2	-35.7	172.9	-175.6	-113.5	0	0	0	112.1	M1057 K1059 L1064 G1065 F1070 P1072 M1075 S1076 V1077 F1080 F1081	M1057-Y1061 PolarHBondContact O-N 3.49Å; K1059-Y1061 VanDerWaalsContact C-N 3.35Å; K1059-Y1061 PolarHBondContact O-N 2.88Å; Y1061-L1064 WeakPolarHBondContact O-CB 3.36Å; Y1061-L1064 PolarHBondContact O-N 3.27Å; Y1061-G1065 PolarHBondContact O-N 3.42Å; Y1061-G1065 VanDerWaalsContact O-N 3.09Å; Y1061-F1070 HydrophobicContact CE1-CE2 4.42Å; Y1061-F1070 HydrophobicContact CE2-CE2 4.04Å; Y1061-F1070 AromaticContact CE2-CZ 3.92Å; Y1061-F1070 HydrophobicContact CE2-CZ 3.92Å; Y1061-F1070 AromaticContact CZ-CE2 3.77Å; Y1061-P1072 HydrophobicContact CD1-CB 4.04Å; Y1061-P1072 HydrophobicContact CE1-CB 3.8Å; Y1061-M1075 PolarHBondContact OH-O 3.46Å; Y1061-S1076 PolarHBondContact OH-O 2.92Å; Y1061-S1076 VanDerWaalsContact OH-O 3.1Å; Y1061-V1077 HydrophobicContact CD1-CG2 3.79Å; Y1061-V1077 HydrophobicContact CD2-CG2 4.14Å; Y1061-V1077 HydrophobicContact CE1-CG2 3.9Å; Y1061-V1077 HydrophobicContact CE2-CG2 4.25Å; Y1061-V1077 HydrophobicContact CG-CG2 3.92Å; Y1061-F1080 HydrophobicContact CE2-CB 3.91Å; Y1061-F1080 AromaticContact CE2-CD1 3.89Å; Y1061-F1080 HydrophobicContact CE2-CD1 3.89Å; Y1061-F1080 AromaticContact CE2-CG 3.96Å; Y1061-F1080 HydrophobicContact CE2-CG 3.96Å; Y1061-F1080 WeakPolarHBondContact OH-CB 3.39Å; Y1061-F1081 HydrophobicContact CD2-CE2 4.33Å
1062	T	96.6	Very high	95.7	Very high	69 Å²	69	55.8 Å²	55.8	42%	0.423	29%	0.287	S	S	.	.	H	α-helix	trans	-65.4	-43.9	172.6	-55.1	0	0	0	0	111.7	E1058 K1059 Q1060 L1064 G1065 D1066	E1058-T1062 WeakPolarHBondContact O-CB 3.39Å; E1058-T1062 PolarHBondContact O-N 2.96Å; E1058-T1062 PolarHBondContact O-OG1 2.81Å; K1059-T1062 WeakPolarHBondContact O-CB 3.38Å; K1059-T1062 PolarHBondContact O-N 3.33Å; K1059-T1062 VanDerWaalsContact O-N 3.14Å; Q1060-T1062 VanDerWaalsContact C-N 3.31Å; Q1060-T1062 PolarHBondContact O-N 3.02Å; T1062-L1064 VanDerWaalsContact C-N 3.3Å; T1062-L1064 PolarHBondContact O-N 2.91Å; T1062-G1065 WeakPolarHBondContact O-CA 3.49Å; T1062-G1065 PolarHBondContact O-N 3.31Å; T1062-D1066 PolarHBondContact O-N 3.06Å; T1062-D1066 VanDerWaalsContact O-N 3.09Å
1063	E	95.3	Very high	95.4	Very high	57 Å²	57	65.1 Å²	65.1	27%	0.266	31%	0.311	S	S	.	.	H	α-helix	trans	-68.2	-25.2	176.4	-69.9	-175.6	-166.5	0	0	113	R914 K1059 Q1060 Y1067	R914-E1063 IonicContact CZ-OE2 3.89Å; R914-E1063 IonicContact NH1-OE2 3.12Å; R914-E1063 PolarHBondContact NH1-OE2 3.26Å; R914-E1063 IonicContact NH2-OE2 2.6Å; R914-E1063 PolarHBondContact NH2-OE2 3.14Å; K1059-E1063 WeakPolarHBondContact CE-OE1 3.48Å; K1059-E1063 IonicContact NZ-OE1 3.24Å; K1059-E1063 PolarHBondContact O-N 3.5Å; Q1060-E1063 PolarHBondContact O-N 3.29Å; E1063-Y1067 VanDerWaalsContact O-CB 3.24Å; E1063-Y1067 WeakPolarHBondContact O-CB 3.42Å; E1063-Y1067 PolarHBondContact O-N 3.1Å
1064	L	95.7	Very high	95.2	Very high	0 Å²	0	70.2 Å²	70.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-66.9	-38.5	165	-77.3	-167.9	0	0	0	112.1	C910 L913 R914 Q1060 Y1061 T1062 D1066 Y1067 F1068 F1070 F1080 F1081	C910-L1064 HydrophobicContact CB-CD1 4.13Å; C910-L1064 HydrophobicContact CB-CG 4.49Å; L913-L1064 HydrophobicContact CD2-CD1 4.12Å; R914-L1064 HydrophobicContact CB-CD2 3.88Å; R914-L1064 HydrophobicContact CG-CD2 4.26Å; Q1060-L1064 PolarHBondContact O-N 3.09Å; Y1061-L1064 WeakPolarHBondContact O-CB 3.36Å; Y1061-L1064 PolarHBondContact O-N 3.27Å; T1062-L1064 VanDerWaalsContact C-N 3.3Å; T1062-L1064 PolarHBondContact O-N 2.91Å; L1064-D1066 VanDerWaalsContact C-N 3.35Å; L1064-Y1067 PolarHBondContact O-N 3.5Å; L1064-F1068 HydrophobicContact CD2-CD2 4.09Å; L1064-F1068 HydrophobicContact CD2-CE2 3.83Å; L1064-F1068 PolarHBondContact O-N 2.91Å; L1064-F1070 HydrophobicContact CB-CE1 4.21Å; L1064-F1070 HydrophobicContact CB-CZ 4.2Å; L1064-F1070 WeakPolarHBondContact O-CE1 3.44Å; L1064-F1080 HydrophobicContact CD1-CE1 3.95Å; L1064-F1080 HydrophobicContact CD1-CZ 4.4Å; L1064-F1081 HydrophobicContact CD1-CZ 4.11Å
1065	G	94.2	Very high	95	Very high	2 Å²	2	71.5 Å²	71.5	2%	0.021	34%	0.338	C	S	.	.	H	α-helix	trans	-55.9	-47.6	172.8	0	0	0	0	0	112.4	Y1061 T1062 V1069 F1070	Y1061-G1065 PolarHBondContact O-N 3.42Å; Y1061-G1065 VanDerWaalsContact O-N 3.09Å; T1062-G1065 WeakPolarHBondContact O-CA 3.49Å; T1062-G1065 PolarHBondContact O-N 3.31Å; G1065-V1069 CarbonylContact O-C 3.6Å; G1065-V1069 WeakPolarHBondContact O-CA 3.23Å; G1065-V1069 PolarHBondContact O-N 2.99Å; G1065-F1070 PolarHBondContact O-N 2.9Å
1066	D	94.1	Very high	94.9	Very high	129 Å²	129	68.5 Å²	68.5	69%	0.69	33%	0.331	S	S	*	.	H	α-helix	trans	-66.5	-40	175.3	-68.8	-36.6	0	0	0	112.3	T1062 L1064	T1062-D1066 PolarHBondContact O-N 3.06Å; T1062-D1066 VanDerWaalsContact O-N 3.09Å; L1064-D1066 VanDerWaalsContact C-N 3.35Å
1067	Y	93.6	Very high	94.8	Very high	119 Å²	119	66 Å²	66	47%	0.467	32%	0.318	S	S	.	.	H	α-helix	trans	-73	-40	-176.2	-175	-110.4	0	0	0	113.8	R914 E1063 L1064	R914-Y1067 HydrophobicContact CG-CD1 4.31Å; R914-Y1067 HydrophobicContact CG-CE1 4.38Å; E1063-Y1067 VanDerWaalsContact O-CB 3.24Å; E1063-Y1067 WeakPolarHBondContact O-CB 3.42Å; E1063-Y1067 PolarHBondContact O-N 3.1Å; L1064-Y1067 PolarHBondContact O-N 3.5Å
1068	F	94.6	Very high	94.7	Very high	28 Å²	28	68.3 Å²	68.3	12%	0.123	33%	0.328	C	S	.	.	H	α-helix	trans	-103	6.1	179	-65.5	-59.3	0	0	0	113.9	L913 F919 L923 I947 L1064 F1070 F1080	L913-F1068 HydrophobicContact CD2-CD2 4.48Å; L913-F1068 HydrophobicContact CD2-CE2 3.8Å; L913-F1068 HydrophobicContact CG-CE2 3.77Å; L913-F1068 HydrophobicContact CG-CZ 4.13Å; F919-F1068 HydrophobicContact CD1-CZ 4.4Å; F919-F1068 HydrophobicContact CE1-CE1 4.38Å; F919-F1068 HydrophobicContact CE1-CZ 4.15Å; L923-F1068 HydrophobicContact CD1-CD1 4.21Å; L923-F1068 HydrophobicContact CD1-CE1 3.74Å; I947-F1068 HydrophobicContact CD1-CB 3.72Å; I947-F1068 HydrophobicContact CD1-CD1 3.64Å; I947-F1068 HydrophobicContact CD1-CD2 3.7Å; I947-F1068 HydrophobicContact CD1-CE1 4.08Å; I947-F1068 HydrophobicContact CD1-CE2 4.13Å; I947-F1068 HydrophobicContact CD1-CG 3.42Å; I947-F1068 VanDerWaalsContact CD1-CG 3.42Å; I947-F1068 HydrophobicContact CD1-CZ 4.31Å; I947-F1068 HydrophobicContact CG1-CB 4.4Å; I947-F1068 HydrophobicContact CG1-CG 4.46Å; L1064-F1068 HydrophobicContact CD2-CD2 4.09Å; L1064-F1068 HydrophobicContact CD2-CE2 3.83Å; L1064-F1068 PolarHBondContact O-N 2.91Å; F1068-F1070 HydrophobicContact CB-CD1 4.03Å; F1068-F1070 HydrophobicContact CB-CE1 4.24Å; F1068-F1080 HydrophobicContact CD2-CZ 4.41Å
1069	V	94.2	Very high	94.6	Very high	127 Å²	127	68.9 Å²	68.9	77%	0.77	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.6	55.1	173.7	-160.1	0	0	0	0	113.1	G1065	G1065-V1069 CarbonylContact O-C 3.6Å; G1065-V1069 WeakPolarHBondContact O-CA 3.23Å; G1065-V1069 PolarHBondContact O-N 2.99Å
1070	F	94	Very high	94.6	Very high	34 Å²	34	63.4 Å²	63.4	15%	0.149	31%	0.307	C	S	.	.			trans	-123.1	171.6	168.5	70.7	-91.1	0	0	0	111.5	Y1061 L1064 G1065 F1068 P1072 F1080	Y1061-F1070 HydrophobicContact CE1-CE2 4.42Å; Y1061-F1070 HydrophobicContact CE2-CE2 4.04Å; Y1061-F1070 AromaticContact CE2-CZ 3.92Å; Y1061-F1070 HydrophobicContact CE2-CZ 3.92Å; Y1061-F1070 AromaticContact CZ-CE2 3.77Å; L1064-F1070 HydrophobicContact CB-CE1 4.21Å; L1064-F1070 HydrophobicContact CB-CZ 4.2Å; L1064-F1070 WeakPolarHBondContact O-CE1 3.44Å; G1065-F1070 PolarHBondContact O-N 2.9Å; F1068-F1070 HydrophobicContact CB-CD1 4.03Å; F1068-F1070 HydrophobicContact CB-CE1 4.24Å; F1070-P1072 HydrophobicContact CE2-CG 4.19Å; F1070-P1072 WeakPolarHBondContact O-CD 3.45Å; F1070-F1080 HydrophobicContact CD1-CD2 4.28Å; F1070-F1080 AromaticContact CD1-CE2 3.84Å; F1070-F1080 HydrophobicContact CD1-CE2 3.84Å; F1070-F1080 AromaticContact CE1-CD2 3.79Å; F1070-F1080 HydrophobicContact CE1-CD2 3.79Å; F1070-F1080 AromaticContact CE1-CE2 3.29Å; F1070-F1080 HydrophobicContact CE1-CE2 3.29Å; F1070-F1080 AromaticContact CE1-CZ 3.78Å; F1070-F1080 HydrophobicContact CE1-CZ 3.78Å; F1070-F1080 HydrophobicContact CE2-CD2 4.08Å; F1070-F1080 HydrophobicContact CE2-CE2 4.42Å; F1070-F1080 AromaticContact CZ-CD2 3.69Å; F1070-F1080 HydrophobicContact CZ-CD2 3.69Å; F1070-F1080 AromaticContact CZ-CE2 3.64Å; F1070-F1080 HydrophobicContact CZ-CE2 3.64Å; F1070-F1080 HydrophobicContact CZ-CG 4.18Å; F1070-F1080 HydrophobicContact CZ-CZ 4.08Å
1071	D	93	Very high	94.7	Very high	54 Å²	54	62.2 Å²	62.2	29%	0.289	30%	0.302	S	S	.	.			trans	-104.3	105.4	179.8	-176.1	-17.3	0	0	0	110.4	R1073 K1074 M1075	D1071-R1073 PolarHBondContact O-N 2.98Å; D1071-R1073 VanDerWaalsContact OD1-CB 3.32Å; D1071-R1073 WeakPolarHBondContact OD1-CB 3.33Å; D1071-R1073 WeakPolarHBondContact OD1-CG 3.36Å; D1071-R1073 PolarHBondContact OD1-N 3.09Å; D1071-K1074 HydrophobicContact CB-CB 4.24Å; D1071-K1074 HydrophobicContact CB-CD 4.45Å; D1071-K1074 HydrophobicContact CB-CG 4.22Å; D1071-K1074 PolarHBondContact O-N 3.4Å; D1071-K1074 IonicContact OD2-NZ 2.75Å; D1071-K1074 PolarHBondContact OD2-NZ 2.88Å; D1071-M1075 PolarHBondContact O-N 3.16Å
1072	P	92.6	Very high	94.7	Very high	37 Å²	37	62.3 Å²	62.3	24%	0.24	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-8.6	-178.7	-24.3	35.3	0	0	0	114.9	Y1061 F1070	Y1061-P1072 HydrophobicContact CD1-CB 4.04Å; Y1061-P1072 HydrophobicContact CE1-CB 3.8Å; F1070-P1072 HydrophobicContact CE2-CG 4.19Å; F1070-P1072 WeakPolarHBondContact O-CD 3.45Å
1073	R	90.9	Very high	94.6	Very high	234 Å²	234	61 Å²	61	88%	0.883	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	-13.5	177.3	-44.5	179.1	-157	-174.1	5.5	112.9	D1071	D1071-R1073 PolarHBondContact O-N 2.98Å; D1071-R1073 VanDerWaalsContact OD1-CB 3.32Å; D1071-R1073 WeakPolarHBondContact OD1-CB 3.33Å; D1071-R1073 WeakPolarHBondContact OD1-CG 3.36Å; D1071-R1073 PolarHBondContact OD1-N 3.09Å
1074	K	93.1	Very high	94.8	Very high	166 Å²	166	58.3 Å²	58.3	72%	0.722	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	-20.5	177.6	-67.9	-167	-174.2	82.5	0	113.4	D1071	D1071-K1074 HydrophobicContact CB-CB 4.24Å; D1071-K1074 HydrophobicContact CB-CD 4.45Å; D1071-K1074 HydrophobicContact CB-CG 4.22Å; D1071-K1074 PolarHBondContact O-N 3.4Å; D1071-K1074 IonicContact OD2-NZ 2.75Å; D1071-K1074 PolarHBondContact OD2-NZ 2.88Å
1075	M	93.1	Very high	94.9	Very high	31 Å²	31	60.2 Å²	60.2	15%	0.153	29%	0.293	C	S	.	.	S	Bend	trans	-126.3	119.4	179.4	177.4	169.5	-87.2	0	0	108.3	Y1061 D1071 E1079 F1080	Y1061-M1075 PolarHBondContact OH-O 3.46Å; D1071-M1075 PolarHBondContact O-N 3.16Å; M1075-E1079 WeakPolarHBondContact CA-OE2 3.32Å; M1075-E1079 HydrophobicContact CE-CG 4.22Å; M1075-E1079 HydrophobicContact CG-CB 4.13Å; M1075-E1079 HydrophobicContact CG-CG 4.06Å; M1075-F1080 HydrophobicContact CG-CB 3.93Å; M1075-F1080 HydrophobicContact SD-CB 3.92Å; M1075-F1080 HydrophobicContact SD-CD2 3.88Å; M1075-F1080 HydrophobicContact SD-CG 4.41Å
1076	S	94.4	Very high	95	Very high	48 Å²	48	64 Å²	64	34%	0.336	31%	0.313	S	S	.	.			trans	-79.1	166.7	-178.7	69.7	0	0	0	0	112	Y1061 E1078 E1079 F1080	Y1061-S1076 PolarHBondContact OH-O 2.92Å; Y1061-S1076 VanDerWaalsContact OH-O 3.1Å; S1076-E1078 VanDerWaalsContact C-N 3.33Å; S1076-E1078 VanDerWaalsContact CB-OE2 3.23Å; S1076-E1078 WeakPolarHBondContact CB-OE2 3.35Å; S1076-E1078 PolarHBondContact O-N 3.03Å; S1076-E1078 WeakPolarHBondContact OG-CG 3.38Å; S1076-E1078 PolarHBondContact OG-OE2 3.38Å; S1076-E1078 VanDerWaalsContact OG-OE2 3.12Å; S1076-E1079 PolarHBondContact N-OE2 3.2Å; S1076-E1079 PolarHBondContact O-N 2.96Å; S1076-E1079 VanDerWaalsContact O-N 3.15Å; S1076-E1079 PolarHBondContact OG-N 3.49Å; S1076-F1080 PolarHBondContact O-N 3Å
1077	V	96	Very high	95.2	Very high	9 Å²	9	58 Å²	58	6%	0.055	28%	0.28	C	S	.	.	H	α-helix	trans	-58.6	-47.3	-179	173.4	0	0	0	0	110.7	V906 A998 Y1061 E1079 F1080 F1081	V906-V1077 HydrophobicContact CB-CG1 4.28Å; V906-V1077 HydrophobicContact CG1-CG1 3.52Å; V906-V1077 HydrophobicContact CG2-CG1 3.67Å; A998-V1077 HydrophobicContact CB-CB 4.29Å; A998-V1077 HydrophobicContact CB-CG2 4.06Å; Y1061-V1077 HydrophobicContact CD1-CG2 3.79Å; Y1061-V1077 HydrophobicContact CD2-CG2 4.14Å; Y1061-V1077 HydrophobicContact CE1-CG2 3.9Å; Y1061-V1077 HydrophobicContact CE2-CG2 4.25Å; Y1061-V1077 HydrophobicContact CG-CG2 3.92Å; V1077-E1079 VanDerWaalsContact C-N 3.31Å; V1077-E1079 PolarHBondContact O-N 3.48Å; V1077-F1080 PolarHBondContact O-N 2.98Å; V1077-F1081 HydrophobicContact CG1-CD2 3.79Å; V1077-F1081 HydrophobicContact CG1-CE2 4.08Å; V1077-F1081 WeakPolarHBondContact O-CD2 3.3Å; V1077-F1081 PolarHBondContact O-N 2.89Å
1078	E	94.8	Very high	95.4	Very high	52 Å²	52	52.9 Å²	52.9	24%	0.243	26%	0.261	C	S	.	.	H	α-helix	trans	-63.9	-32.9	177.2	53.7	-87.7	-119	0	0	112.8	S997 S1076 G1082	S997-E1078 VanDerWaalsContact CA-OE1 3.28Å; S997-E1078 WeakPolarHBondContact CA-OE1 3.41Å; S997-E1078 PolarHBondContact OG-OE1 3.1Å; S1076-E1078 VanDerWaalsContact C-N 3.33Å; S1076-E1078 VanDerWaalsContact CB-OE2 3.23Å; S1076-E1078 WeakPolarHBondContact CB-OE2 3.35Å; S1076-E1078 PolarHBondContact O-N 3.03Å; S1076-E1078 WeakPolarHBondContact OG-CG 3.38Å; S1076-E1078 PolarHBondContact OG-OE2 3.38Å; S1076-E1078 VanDerWaalsContact OG-OE2 3.12Å; E1078-G1082 WeakPolarHBondContact O-CA 3.31Å; E1078-G1082 PolarHBondContact O-N 3.13Å
1079	E	95.4	Very high	95.6	Very high	97 Å²	97	54.8 Å²	54.8	45%	0.453	28%	0.275	S	S	.	.	H	α-helix	trans	-72.4	-49.4	176.3	-173.4	-177.4	-176.6	0	0	111.7	M1075 S1076 V1077 G1082 D1083	M1075-E1079 WeakPolarHBondContact CA-OE2 3.32Å; M1075-E1079 HydrophobicContact CE-CG 4.22Å; M1075-E1079 HydrophobicContact CG-CB 4.13Å; M1075-E1079 HydrophobicContact CG-CG 4.06Å; S1076-E1079 PolarHBondContact N-OE2 3.2Å; S1076-E1079 PolarHBondContact O-N 2.96Å; S1076-E1079 VanDerWaalsContact O-N 3.15Å; S1076-E1079 PolarHBondContact OG-N 3.49Å; V1077-E1079 VanDerWaalsContact C-N 3.31Å; V1077-E1079 PolarHBondContact O-N 3.48Å; E1079-G1082 PolarHBondContact O-N 3.42Å; E1079-D1083 PolarHBondContact O-N 2.92Å
1080	F	97.1	Very high	95.7	Very high	2 Å²	2	50.2 Å²	50.2	1%	0.009	25%	0.246	C	C	.	.	H	α-helix	trans	-61.7	-52	-179.7	175.8	-98.1	0	0	0	112.2	L913 I947 Y1061 L1064 F1068 F1070 M1075 S1076 V1077 G1082 D1083 L1084	L913-F1080 HydrophobicContact CD2-CE1 3.5Å; L913-F1080 HydrophobicContact CD2-CZ 3.58Å; I947-F1080 HydrophobicContact CB-CE2 4.43Å; I947-F1080 HydrophobicContact CD1-CE2 4.2Å; I947-F1080 HydrophobicContact CD1-CZ 4.22Å; I947-F1080 HydrophobicContact CG2-CE2 4.04Å; Y1061-F1080 HydrophobicContact CE2-CB 3.91Å; Y1061-F1080 AromaticContact CE2-CD1 3.89Å; Y1061-F1080 HydrophobicContact CE2-CD1 3.89Å; Y1061-F1080 AromaticContact CE2-CG 3.96Å; Y1061-F1080 HydrophobicContact CE2-CG 3.96Å; Y1061-F1080 WeakPolarHBondContact OH-CB 3.39Å; L1064-F1080 HydrophobicContact CD1-CE1 3.95Å; L1064-F1080 HydrophobicContact CD1-CZ 4.4Å; F1068-F1080 HydrophobicContact CD2-CZ 4.41Å; F1070-F1080 HydrophobicContact CD1-CD2 4.28Å; F1070-F1080 AromaticContact CD1-CE2 3.84Å; F1070-F1080 HydrophobicContact CD1-CE2 3.84Å; F1070-F1080 AromaticContact CE1-CD2 3.79Å; F1070-F1080 HydrophobicContact CE1-CD2 3.79Å; F1070-F1080 AromaticContact CE1-CE2 3.29Å; F1070-F1080 HydrophobicContact CE1-CE2 3.29Å; F1070-F1080 AromaticContact CE1-CZ 3.78Å; F1070-F1080 HydrophobicContact CE1-CZ 3.78Å; F1070-F1080 HydrophobicContact CE2-CD2 4.08Å; F1070-F1080 HydrophobicContact CE2-CE2 4.42Å; F1070-F1080 AromaticContact CZ-CD2 3.69Å; F1070-F1080 HydrophobicContact CZ-CD2 3.69Å; F1070-F1080 AromaticContact CZ-CE2 3.64Å; F1070-F1080 HydrophobicContact CZ-CE2 3.64Å; F1070-F1080 HydrophobicContact CZ-CG 4.18Å; F1070-F1080 HydrophobicContact CZ-CZ 4.08Å; M1075-F1080 HydrophobicContact CG-CB 3.93Å; M1075-F1080 HydrophobicContact SD-CB 3.92Å; M1075-F1080 HydrophobicContact SD-CD2 3.88Å; M1075-F1080 HydrophobicContact SD-CG 4.41Å; S1076-F1080 PolarHBondContact O-N 3Å; V1077-F1080 PolarHBondContact O-N 2.98Å; F1080-G1082 VanDerWaalsContact C-N 3.28Å; F1080-G1082 PolarHBondContact O-N 3.43Å; F1080-D1083 PolarHBondContact O-N 2.79Å; F1080-L1084 PolarHBondContact O-N 2.91Å; F1080-L1084 VanDerWaalsContact O-N 3.1Å
1081	F	98	Very high	95.9	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-72.2	-24.2	177.7	-71.4	-65.4	0	0	0	112	V906 A909 L913 V990 A993 S994 Y1061 L1064 V1077 L1084 H1085	V906-F1081 HydrophobicContact CG1-CE2 4.28Å; A909-F1081 HydrophobicContact CB-CD1 4.13Å; A909-F1081 HydrophobicContact CB-CE1 3.63Å; A909-F1081 HydrophobicContact CB-CE2 4.35Å; A909-F1081 HydrophobicContact CB-CZ 3.76Å; L913-F1081 HydrophobicContact CD2-CE1 4.26Å; V990-F1081 HydrophobicContact CB-CD1 4.38Å; V990-F1081 HydrophobicContact CG1-CB 4.4Å; V990-F1081 HydrophobicContact CG1-CD1 4.05Å; V990-F1081 HydrophobicContact CG2-CD1 3.96Å; V990-F1081 HydrophobicContact CG2-CE1 4.19Å; A993-F1081 HydrophobicContact CB-CB 4.01Å; A993-F1081 HydrophobicContact CB-CD1 4.33Å; A993-F1081 HydrophobicContact CB-CD2 3.66Å; A993-F1081 HydrophobicContact CB-CE2 4.19Å; A993-F1081 HydrophobicContact CB-CG 3.74Å; S994-F1081 VanDerWaalsContact CB-C 3.43Å; S994-F1081 WeakPolarHBondContact CB-O 3.49Å; Y1061-F1081 HydrophobicContact CD2-CE2 4.33Å; L1064-F1081 HydrophobicContact CD1-CZ 4.11Å; V1077-F1081 HydrophobicContact CG1-CD2 3.79Å; V1077-F1081 HydrophobicContact CG1-CE2 4.08Å; V1077-F1081 WeakPolarHBondContact O-CD2 3.3Å; V1077-F1081 PolarHBondContact O-N 2.89Å; F1081-L1084 HydrophobicContact CD1-CD2 4.22Å; F1081-H1085 VanDerWaalsContact O-CB 3.24Å; F1081-H1085 WeakPolarHBondContact O-CB 3.43Å; F1081-H1085 PolarHBondContact O-N 3.35Å
1082	G	97.4	Very high	96.1	Very high	14 Å²	14	50.3 Å²	50.3	14%	0.144	25%	0.245	C	C	.	.	H	α-helix	trans	-62.2	-52.6	169.6	0	0	0	0	0	112.6	E1078 E1079 F1080 L1084 H1085 N1086	E1078-G1082 WeakPolarHBondContact O-CA 3.31Å; E1078-G1082 PolarHBondContact O-N 3.13Å; E1079-G1082 PolarHBondContact O-N 3.42Å; F1080-G1082 VanDerWaalsContact C-N 3.28Å; F1080-G1082 PolarHBondContact O-N 3.43Å; G1082-L1084 VanDerWaalsContact C-N 3.3Å; G1082-L1084 PolarHBondContact O-N 3.36Å; G1082-H1085 PolarHBondContact O-N 2.83Å; G1082-N1086 WeakPolarHBondContact O-CB 3.21Å; G1082-N1086 PolarHBondContact O-N 3.44Å; G1082-N1086 PolarHBondContact O-ND2 3.45Å
1083	D	96.2	Very high	96.3	Very high	41 Å²	41	52.8 Å²	52.8	22%	0.219	25%	0.253	C	S	.	.	H	α-helix	trans	-58.8	-42	175.1	-115.8	1.5	0	0	0	111.2	S948 C951 E1079 F1080 N1086 F1087	S948-D1083 VanDerWaalsContact CA-OD2 3.31Å; S948-D1083 WeakPolarHBondContact CA-OD2 3.19Å; S948-D1083 WeakPolarHBondContact CB-OD2 3.41Å; C951-D1083 PolarHBondContact SG-O 2.85Å; C951-D1083 PolarHBondContact SG-OD1 3.11Å; E1079-D1083 PolarHBondContact O-N 2.92Å; F1080-D1083 PolarHBondContact O-N 2.79Å; D1083-N1086 PolarHBondContact O-N 3.26Å; D1083-F1087 PolarHBondContact O-N 3Å
1084	L	97.6	Very high	96.6	Very high	0 Å²	0	41.7 Å²	41.7	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-67.2	-43.3	178	-174.5	64.4	0	0	0	113.2	L913 F919 V990 F1080 F1081 G1082 N1086 F1087 I1088	L913-L1084 HydrophobicContact CD1-CD1 4.42Å; L913-L1084 HydrophobicContact CD1-CD2 3.54Å; L913-L1084 HydrophobicContact CD2-CD2 3.6Å; L913-L1084 HydrophobicContact CG-CD2 4.13Å; F919-L1084 HydrophobicContact CE2-CD1 3.74Å; F919-L1084 HydrophobicContact CZ-CD1 3.63Å; V990-L1084 HydrophobicContact CG1-CB 4.14Å; V990-L1084 HydrophobicContact CG1-CD2 3.89Å; V990-L1084 HydrophobicContact CG1-CG 3.98Å; V990-L1084 HydrophobicContact CG2-CD2 3.91Å; F1080-L1084 PolarHBondContact O-N 2.91Å; F1080-L1084 VanDerWaalsContact O-N 3.1Å; F1081-L1084 HydrophobicContact CD1-CD2 4.22Å; G1082-L1084 VanDerWaalsContact C-N 3.3Å; G1082-L1084 PolarHBondContact O-N 3.36Å; L1084-N1086 VanDerWaalsContact C-N 3.34Å; L1084-F1087 HydrophobicContact CD1-CD1 4.44Å; L1084-F1087 PolarHBondContact O-N 3.46Å; L1084-I1088 HydrophobicContact CG-CD1 4.16Å; L1084-I1088 WeakPolarHBondContact O-CG1 3.21Å; L1084-I1088 PolarHBondContact O-N 2.86Å
1085	H	98	Very high	96.7	Very high	40 Å²	40	35.5 Å²	35.5	19%	0.185	19%	0.188	C	C	.	.	H	α-helix	trans	-62.8	-41.1	175.3	176.7	63.7	0	0	0	111.7	V990 E991 F1081 G1082 F1087 I1088 T1089	V990-H1085 HydrophobicContact CG1-CB 4.06Å; E991-H1085 VanDerWaalsContact CG-CE1 3.49Å; E991-H1085 WeakPolarHBondContact CG-CE1 3.35Å; E991-H1085 IonicContact OE2-CE1 2.76Å; F1081-H1085 VanDerWaalsContact O-CB 3.24Å; F1081-H1085 WeakPolarHBondContact O-CB 3.43Å; F1081-H1085 PolarHBondContact O-N 3.35Å; G1082-H1085 PolarHBondContact O-N 2.83Å; H1085-F1087 VanDerWaalsContact C-N 3.34Å; H1085-F1087 PolarHBondContact O-N 3.34Å; H1085-I1088 PolarHBondContact O-N 2.88Å; H1085-T1089 WeakPolarHBondContact O-CB 3.33Å; H1085-T1089 PolarHBondContact O-N 2.74Å; H1085-T1089 PolarHBondContact O-OG1 3.34Å
1086	N	97.4	Very high	96.8	Very high	83 Å²	83	40.4 Å²	40.4	44%	0.444	21%	0.208	S	C	.	.	H	α-helix	trans	-60.3	-43.8	173.2	-73.8	-37	0	0	0	111.1	G1082 D1083 L1084 T1089 M1090	G1082-N1086 WeakPolarHBondContact O-CB 3.21Å; G1082-N1086 PolarHBondContact O-N 3.44Å; G1082-N1086 PolarHBondContact O-ND2 3.45Å; D1083-N1086 PolarHBondContact O-N 3.26Å; L1084-N1086 VanDerWaalsContact C-N 3.34Å; N1086-T1089 PolarHBondContact O-N 2.9Å; N1086-M1090 HydrophobicContact CB-CE 4.24Å; N1086-M1090 WeakPolarHBondContact O-CB 3.39Å; N1086-M1090 WeakPolarHBondContact O-CE 3.49Å; N1086-M1090 VanDerWaalsContact O-CG 3.31Å; N1086-M1090 WeakPolarHBondContact O-CG 3.47Å; N1086-M1090 PolarHBondContact O-N 3.25Å
1087	F	98.1	Very high	96.7	Very high	1 Å²	1	42.7 Å²	42.7	0%	0.004	21%	0.213	C	C	.	.	H	α-helix	trans	-62.4	-48	174.7	171.1	-109.9	0	0	0	113	F919 L922 I926 L950 L953 L966 F983 D1083 L1084 H1085 T1089 M1090 F1091	F919-F1087 HydrophobicContact CE2-CD1 4.38Å; F919-F1087 HydrophobicContact CE2-CE1 4.11Å; L922-F1087 HydrophobicContact CD2-CE1 3.9Å; L922-F1087 HydrophobicContact CD2-CZ 3.87Å; I926-F1087 HydrophobicContact CD1-CZ 4.46Å; L950-F1087 HydrophobicContact CB-CB 4.03Å; L950-F1087 HydrophobicContact CB-CD1 4.2Å; L950-F1087 HydrophobicContact CB-CD2 3.61Å; L950-F1087 HydrophobicContact CB-CE2 4.08Å; L950-F1087 HydrophobicContact CB-CG 3.66Å; L950-F1087 HydrophobicContact CD1-CD1 3.86Å; L950-F1087 HydrophobicContact CD1-CE1 4.1Å; L950-F1087 HydrophobicContact CD1-CG 4.17Å; L950-F1087 HydrophobicContact CD2-CE1 4.39Å; L950-F1087 HydrophobicContact CD2-CE2 4.23Å; L950-F1087 HydrophobicContact CD2-CZ 4.12Å; L950-F1087 HydrophobicContact CG-CD1 4.49Å; L950-F1087 HydrophobicContact CG-CG 4.42Å; L953-F1087 HydrophobicContact CD1-CE2 4.07Å; L966-F1087 HydrophobicContact CD1-CD2 4.45Å; L966-F1087 HydrophobicContact CD1-CE2 3.74Å; F983-F1087 HydrophobicContact CE2-CD1 4.39Å; F983-F1087 AromaticContact CE2-CE1 3.98Å; F983-F1087 HydrophobicContact CE2-CE1 3.98Å; F983-F1087 HydrophobicContact CZ-CD1 4.29Å; F983-F1087 AromaticContact CZ-CE1 3.65Å; F983-F1087 HydrophobicContact CZ-CE1 3.65Å; F983-F1087 HydrophobicContact CZ-CZ 4.35Å; D1083-F1087 PolarHBondContact O-N 3Å; L1084-F1087 HydrophobicContact CD1-CD1 4.44Å; L1084-F1087 PolarHBondContact O-N 3.46Å; H1085-F1087 VanDerWaalsContact C-N 3.34Å; H1085-F1087 PolarHBondContact O-N 3.34Å; F1087-T1089 VanDerWaalsContact C-N 3.28Å; F1087-T1089 PolarHBondContact O-N 3.26Å; F1087-M1090 PolarHBondContact O-N 2.94Å; F1087-F1091 HydrophobicContact CE2-CB 4.47Å; F1087-F1091 HydrophobicContact CE2-CD2 4.45Å; F1087-F1091 HydrophobicContact CZ-CB 4.44Å; F1087-F1091 HydrophobicContact CZ-CD2 4.09Å; F1087-F1091 WeakPolarHBondContact O-CB 3.22Å; F1087-F1091 PolarHBondContact O-N 3.3Å
1088	I	97.7	Very high	96.6	Very high	13 Å²	13	42.3 Å²	42.3	7%	0.067	21%	0.211	C	C	.	.	H	α-helix	trans	-54.3	-48.4	177	-69.8	160.9	0	0	0	110.2	F983 P984 L987 V990 L1084 H1085 F1091 Q1092	F983-I1088 HydrophobicContact CE2-CG1 3.77Å; F983-I1088 HydrophobicContact CZ-CG1 4.42Å; P984-I1088 HydrophobicContact CB-CG2 3.88Å; P984-I1088 HydrophobicContact CG-CG2 4.32Å; L987-I1088 HydrophobicContact CB-CD1 4.12Å; L987-I1088 HydrophobicContact CD1-CD1 3.93Å; L987-I1088 HydrophobicContact CD1-CG1 4.5Å; V990-I1088 HydrophobicContact CB-CD1 4.32Å; V990-I1088 HydrophobicContact CG1-CD1 3.99Å; L1084-I1088 HydrophobicContact CG-CD1 4.16Å; L1084-I1088 WeakPolarHBondContact O-CG1 3.21Å; L1084-I1088 PolarHBondContact O-N 2.86Å; H1085-I1088 PolarHBondContact O-N 2.88Å; I1088-F1091 PolarHBondContact O-N 3.15Å; I1088-Q1092 WeakPolarHBondContact O-CG 3.4Å; I1088-Q1092 PolarHBondContact O-N 2.93Å
1089	T	97.8	Very high	96.5	Very high	67 Å²	67	44 Å²	44	41%	0.411	22%	0.219	S	C	.	.	H	α-helix	trans	-62.4	-45	179.5	-55.8	0	0	0	0	111.7	H1085 N1086 F1087 Q1093	H1085-T1089 WeakPolarHBondContact O-CB 3.33Å; H1085-T1089 PolarHBondContact O-N 2.74Å; H1085-T1089 PolarHBondContact O-OG1 3.34Å; N1086-T1089 PolarHBondContact O-N 2.9Å; F1087-T1089 VanDerWaalsContact C-N 3.28Å; F1087-T1089 PolarHBondContact O-N 3.26Å; T1089-Q1093 WeakPolarHBondContact O-CB 3.28Å; T1089-Q1093 PolarHBondContact O-N 3.5Å
1090	M	97.6	Very high	96.2	Very high	32 Å²	32	45.9 Å²	45.9	16%	0.158	23%	0.226	C	C	.	.	H	α-helix	trans	-67.4	-35	177.4	-73.2	-173.4	-74	0	0	112.9	C951 R954 L966 N1086 F1087 A1094	C951-M1090 HydrophobicContact CB-CE 3.87Å; R954-M1090 PolarHBondContact NH1-SD 2.89Å; L966-M1090 HydrophobicContact CD2-CB 3.74Å; N1086-M1090 HydrophobicContact CB-CE 4.24Å; N1086-M1090 WeakPolarHBondContact O-CB 3.39Å; N1086-M1090 WeakPolarHBondContact O-CE 3.49Å; N1086-M1090 VanDerWaalsContact O-CG 3.31Å; N1086-M1090 WeakPolarHBondContact O-CG 3.47Å; N1086-M1090 PolarHBondContact O-N 3.25Å; F1087-M1090 PolarHBondContact O-N 2.94Å; M1090-A1094 WeakPolarHBondContact O-CB 3.44Å; M1090-A1094 PolarHBondContact O-N 3.45Å
1091	F	97.9	Very high	95.8	Very high	4 Å²	4	48.4 Å²	48.4	2%	0.018	24%	0.235	C	C	.	.	H	α-helix	trans	-66.9	-50.5	175.4	-174.4	-81.6	0	0	0	110.7	L922 L966 A970 C973 M981 F983 F1087 I1088 Q1093 A1094 V1095	L922-F1091 HydrophobicContact CD1-CE2 4.06Å; L922-F1091 HydrophobicContact CD2-CD2 4.46Å; L922-F1091 HydrophobicContact CD2-CE2 4.24Å; L966-F1091 HydrophobicContact CD1-CB 4.46Å; L966-F1091 HydrophobicContact CD1-CD2 4Å; A970-F1091 HydrophobicContact CB-CD2 4.47Å; A970-F1091 HydrophobicContact CB-CE2 4.06Å; A970-F1091 HydrophobicContact CB-CZ 4.14Å; C973-F1091 HydrophobicContact CB-CZ 4.28Å; M981-F1091 HydrophobicContact CE-CE1 4.45Å; M981-F1091 HydrophobicContact SD-CE1 4.2Å; M981-F1091 HydrophobicContact SD-CZ 4.23Å; F983-F1091 AromaticContact CE1-CD1 3.64Å; F983-F1091 HydrophobicContact CE1-CD1 3.64Å; F983-F1091 HydrophobicContact CE1-CD2 4.2Å; F983-F1091 AromaticContact CE1-CE1 3.8Å; F983-F1091 HydrophobicContact CE1-CE1 3.8Å; F983-F1091 HydrophobicContact CE1-CE2 4.34Å; F983-F1091 AromaticContact CE1-CG 3.86Å; F983-F1091 HydrophobicContact CE1-CG 3.86Å; F983-F1091 HydrophobicContact CE1-CZ 4.15Å; F983-F1091 HydrophobicContact CZ-CB 4.27Å; F983-F1091 HydrophobicContact CZ-CD1 4.21Å; F983-F1091 HydrophobicContact CZ-CG 4.08Å; F1087-F1091 HydrophobicContact CE2-CB 4.47Å; F1087-F1091 HydrophobicContact CE2-CD2 4.45Å; F1087-F1091 HydrophobicContact CZ-CB 4.44Å; F1087-F1091 HydrophobicContact CZ-CD2 4.09Å; F1087-F1091 WeakPolarHBondContact O-CB 3.22Å; F1087-F1091 PolarHBondContact O-N 3.3Å; I1088-F1091 PolarHBondContact O-N 3.15Å; F1091-Q1093 PolarHBondContact O-N 3.03Å; F1091-A1094 PolarHBondContact O-N 3.29Å; F1091-A1094 VanDerWaalsContact O-N 3.12Å; F1091-V1095 HydrophobicContact CD1-CG2 3.98Å; F1091-V1095 HydrophobicContact CE1-CG2 3.7Å; F1091-V1095 HydrophobicContact CZ-CG2 4.42Å; F1091-V1095 WeakPolarHBondContact O-CG2 3.26Å; F1091-V1095 PolarHBondContact O-N 3.19Å
1092	Q	96.9	Very high	95.3	Very high	86 Å²	86	51 Å²	51	40%	0.402	25%	0.247	S	C	.	.	H	α-helix	trans	-58.6	-36.1	176.2	-74.1	-176.3	-18.4	0	0	112.6	P984 I1088 K1096	P984-Q1092 HydrophobicContact CB-CG 4.41Å; P984-Q1092 HydrophobicContact CG-CG 4.12Å; I1088-Q1092 WeakPolarHBondContact O-CG 3.4Å; I1088-Q1092 PolarHBondContact O-N 2.93Å; Q1092-K1096 WeakPolarHBondContact O-CG 3.34Å; Q1092-K1096 PolarHBondContact O-N 3.19Å
1093	Q	96.4	Very high	94.8	Very high	88 Å²	88	55.6 Å²	55.6	41%	0.411	26%	0.264	S	S	.	.	H	α-helix	trans	-68.9	-43.9	175	-176.3	58.9	21.7	0	0	111.8	T1089 F1091 V1095 K1096 E1097	T1089-Q1093 WeakPolarHBondContact O-CB 3.28Å; T1089-Q1093 PolarHBondContact O-N 3.5Å; F1091-Q1093 PolarHBondContact O-N 3.03Å; Q1093-V1095 VanDerWaalsContact C-N 3.29Å; Q1093-V1095 PolarHBondContact O-N 3.43Å; Q1093-K1096 WeakPolarHBondContact O-CB 3.3Å; Q1093-K1096 PolarHBondContact O-N 3.4Å; Q1093-K1096 VanDerWaalsContact O-N 3.1Å; Q1093-E1097 VanDerWaalsContact CG-OE1 3.29Å; Q1093-E1097 WeakPolarHBondContact CG-OE1 3.25Å; Q1093-E1097 PolarHBondContact NE2-OE1 2.9Å; Q1093-E1097 PolarHBondContact O-N 3.22Å
1094	A	96.8	Very high	94.2	Very high	2 Å²	2	55.9 Å²	55.9	2%	0.017	27%	0.273	C	S	.	.	H	α-helix	trans	-61.8	-34.5	176.4	0	0	0	0	0	112.8	L966 H967 A970 M1090 F1091 E1097 N1098	L966-A1094 HydrophobicContact CD2-CB 4.41Å; L966-A1094 HydrophobicContact CG-CB 4.1Å; H967-A1094 PolarHBondContact CD2-O 3.03Å; A970-A1094 HydrophobicContact CB-CB 4.3Å; M1090-A1094 WeakPolarHBondContact O-CB 3.44Å; M1090-A1094 PolarHBondContact O-N 3.45Å; F1091-A1094 PolarHBondContact O-N 3.29Å; F1091-A1094 VanDerWaalsContact O-N 3.12Å; A1094-E1097 PolarHBondContact O-N 3.45Å; A1094-N1098 WeakPolarHBondContact O-CB 3.21Å; A1094-N1098 VanDerWaalsContact O-CG 3.23Å; A1094-N1098 PolarHBondContact O-N 3.25Å
1095	V	95.8	Very high	93.6	Very high	35 Å²	35	61 Å²	61	21%	0.212	30%	0.297	C	S	.	.	H	α-helix	trans	-62	-43.7	172.3	173.7	0	0	0	0	111.5	A970 M981 F1091 Q1093 Q1099	A970-V1095 HydrophobicContact CB-CG2 3.88Å; M981-V1095 HydrophobicContact CE-CB 4.36Å; M981-V1095 HydrophobicContact CE-CG1 3.75Å; M981-V1095 HydrophobicContact CE-CG2 3.57Å; F1091-V1095 HydrophobicContact CD1-CG2 3.98Å; F1091-V1095 HydrophobicContact CE1-CG2 3.7Å; F1091-V1095 HydrophobicContact CZ-CG2 4.42Å; F1091-V1095 WeakPolarHBondContact O-CG2 3.26Å; F1091-V1095 PolarHBondContact O-N 3.19Å; Q1093-V1095 VanDerWaalsContact C-N 3.29Å; Q1093-V1095 PolarHBondContact O-N 3.43Å; V1095-Q1099 PolarHBondContact O-N 2.69Å
1096	K	94.8	Very high	92.9	Very high	134 Å²	134	62.8 Å²	62.8	58%	0.583	31%	0.305	S	S	*	.	H	α-helix	trans	-66.7	-42.1	177.4	-67.4	168.9	-174.3	172.3	0	112.1	Q1092 Q1093 Q1099 K1100	Q1092-K1096 WeakPolarHBondContact O-CG 3.34Å; Q1092-K1096 PolarHBondContact O-N 3.19Å; Q1093-K1096 WeakPolarHBondContact O-CB 3.3Å; Q1093-K1096 PolarHBondContact O-N 3.4Å; Q1093-K1096 VanDerWaalsContact O-N 3.1Å; K1096-Q1099 PolarHBondContact O-N 2.98Å; K1096-K1100 PolarHBondContact O-N 3.49Å
1097	E	93.9	Very high	92.1	Very high	96 Å²	96	64.6 Å²	64.6	45%	0.449	31%	0.309	S	S	.	.	H	α-helix	trans	-65.8	-40.1	177.6	-74.2	177	-150	0	0	111.6	H967 Q1093 A1094 R1101	H967-E1097 IonicContact CE1-OE2 3.58Å; H967-E1097 WeakPolarHBondContact NE2-CB 3.3Å; H967-E1097 IonicContact NE2-OE2 3.96Å; H967-E1097 PolarHBondContact NE2-OE2 3.45Å; Q1093-E1097 VanDerWaalsContact CG-OE1 3.29Å; Q1093-E1097 WeakPolarHBondContact CG-OE1 3.25Å; Q1093-E1097 PolarHBondContact NE2-OE1 2.9Å; Q1093-E1097 PolarHBondContact O-N 3.22Å; A1094-E1097 PolarHBondContact O-N 3.45Å; E1097-R1101 WeakPolarHBondContact O-CB 3.05Å; E1097-R1101 PolarHBondContact O-N 2.87Å
1098	N	93.8	Very high	91.5	Very high	1 Å²	1	70 Å²	70	1%	0.005	34%	0.337	C	S	.	.	H	α-helix	trans	-61	-43.1	171.1	-78	-12.7	0	0	0	112.8	H967 D971 A1094 R1101 K1102	H967-N1098 WeakPolarHBondContact CB-OD1 3.48Å; H967-N1098 PolarHBondContact CD2-OD1 3.07Å; H967-N1098 VanDerWaalsContact CD2-OD1 3.31Å; H967-N1098 PolarHBondContact O-ND2 2.99Å; D971-N1098 VanDerWaalsContact CG-CG 3.46Å; D971-N1098 PolarHBondContact N-ND2 3.47Å; D971-N1098 WeakPolarHBondContact OD1-CB 3.29Å; D971-N1098 PolarHBondContact OD1-ND2 3.23Å; D971-N1098 PolarHBondContact OD2-ND2 3.08Å; A1094-N1098 WeakPolarHBondContact O-CB 3.21Å; A1094-N1098 VanDerWaalsContact O-CG 3.23Å; A1094-N1098 PolarHBondContact O-N 3.25Å; N1098-R1101 WeakPolarHBondContact O-CB 3.49Å; N1098-R1101 PolarHBondContact O-N 3.2Å; N1098-R1101 PolarHBondContact OD1-NH2 3.17Å; N1098-R1101 VanDerWaalsContact OD1-NH2 3.16Å; N1098-K1102 WeakPolarHBondContact O-CB 3.47Å; N1098-K1102 WeakPolarHBondContact O-CG 3.45Å; N1098-K1102 PolarHBondContact O-N 2.71Å
1099	Q	91.3	Very high	90.8	Very high	87 Å²	87	75.5 Å²	75.5	41%	0.407	36%	0.357	S	S	.	.	H	α-helix	trans	-63.8	-50.6	179.7	-177.7	60.3	27.2	0	0	111.1	V1095 K1096 R1101 K1102 E1103	V1095-Q1099 PolarHBondContact O-N 2.69Å; K1096-Q1099 PolarHBondContact O-N 2.98Å; Q1099-R1101 VanDerWaalsContact C-N 3.27Å; Q1099-R1101 PolarHBondContact O-N 3.44Å; Q1099-K1102 PolarHBondContact O-N 3.48Å; Q1099-K1102 VanDerWaalsContact O-N 3.11Å; Q1099-E1103 WeakPolarHBondContact CG-OE1 3.48Å; Q1099-E1103 PolarHBondContact NE2-OE1 3.08Å; Q1099-E1103 WeakPolarHBondContact O-CG 3.41Å; Q1099-E1103 PolarHBondContact O-N 3.26Å
1100	K	90.5	Very high	89.9	Confident	137 Å²	137	77.7 Å²	77.7	60%	0.596	36%	0.36	S	S	*	.	H	α-helix	trans	-61	-35.2	176.1	-177.5	159.5	-176.9	155.2	0	112	D395 K1096 A1104	D395-K1100 IonicContact OD2-NZ 2.76Å; K1096-K1100 PolarHBondContact O-N 3.49Å; K1100-A1104 WeakPolarHBondContact O-CB 3.34Å; K1100-A1104 PolarHBondContact O-N 3.35Å
1101	R	87.9	Confident	89	Confident	55 Å²	55	77.7 Å²	77.7	21%	0.208	37%	0.365	C	S	.	.	H	α-helix	trans	-62.1	-50.5	171.5	175.3	-176.8	67.6	-173.7	4.5	111.8	Q963 D971 E1097 N1098 Q1099 E1103 A1104 E1105	Q963-R1101 VanDerWaalsContact CD-NH1 3.29Å; D971-R1101 IonicContact OD2-CZ 3.11Å; D971-R1101 IonicContact OD2-NH2 3.36Å; D971-R1101 PolarHBondContact OD2-NH2 3.2Å; E1097-R1101 WeakPolarHBondContact O-CB 3.05Å; E1097-R1101 PolarHBondContact O-N 2.87Å; N1098-R1101 WeakPolarHBondContact O-CB 3.49Å; N1098-R1101 PolarHBondContact O-N 3.2Å; N1098-R1101 PolarHBondContact OD1-NH2 3.17Å; N1098-R1101 VanDerWaalsContact OD1-NH2 3.16Å; Q1099-R1101 VanDerWaalsContact C-N 3.27Å; Q1099-R1101 PolarHBondContact O-N 3.44Å; R1101-E1103 VanDerWaalsContact C-N 3.31Å; R1101-E1103 PolarHBondContact O-N 3.33Å; R1101-A1104 PolarHBondContact O-N 2.99Å; R1101-E1105 WeakPolarHBondContact CD-OE1 3.49Å; R1101-E1105 HydrophobicContact CG-CG 4.22Å; R1101-E1105 VanDerWaalsContact CG-OE1 3.3Å; R1101-E1105 WeakPolarHBondContact CG-OE1 3.42Å; R1101-E1105 WeakPolarHBondContact O-CB 3.48Å; R1101-E1105 WeakPolarHBondContact O-CG 3.45Å; R1101-E1105 PolarHBondContact O-N 3.13Å
1102	K	87.8	Confident	87.9	Confident	56 Å²	56	83.4 Å²	83.4	24%	0.243	39%	0.39	C	S	.	.	H	α-helix	trans	-61.6	-39.5	-178.8	-79.1	171.2	166.7	176.4	0	111.9	D971 E975 N1098 Q1099 E1106	D971-K1102 WeakPolarHBondContact OD1-CE 3.29Å; D971-K1102 IonicContact OD1-NZ 3.28Å; D971-K1102 PolarHBondContact OD1-NZ 3.23Å; D971-K1102 VanDerWaalsContact OD2-CE 3.29Å; D971-K1102 WeakPolarHBondContact OD2-CE 3.47Å; D971-K1102 IonicContact OD2-NZ 4Å; D971-K1102 PolarHBondContact OD2-NZ 3.38Å; E975-K1102 WeakPolarHBondContact OE1-CE 3.21Å; E975-K1102 IonicContact OE1-NZ 2.7Å; E975-K1102 PolarHBondContact OE1-NZ 3.12Å; N1098-K1102 WeakPolarHBondContact O-CB 3.47Å; N1098-K1102 WeakPolarHBondContact O-CG 3.45Å; N1098-K1102 PolarHBondContact O-N 2.71Å; Q1099-K1102 PolarHBondContact O-N 3.48Å; Q1099-K1102 VanDerWaalsContact O-N 3.11Å; K1102-E1106 WeakPolarHBondContact O-CB 3.48Å; K1102-E1106 PolarHBondContact O-N 2.68Å
1103	E	87.3	Confident	86.9	Confident	109 Å²	109	83.5 Å²	83.5	51%	0.509	39%	0.393	S	S	.	.	H	α-helix	trans	-62.9	-45.6	173.7	-71.3	162.7	178.2	0	0	111.9	Q1099 R1101 E1106 K1107	Q1099-E1103 WeakPolarHBondContact CG-OE1 3.48Å; Q1099-E1103 PolarHBondContact NE2-OE1 3.08Å; Q1099-E1103 WeakPolarHBondContact O-CG 3.41Å; Q1099-E1103 PolarHBondContact O-N 3.26Å; R1101-E1103 VanDerWaalsContact C-N 3.31Å; R1101-E1103 PolarHBondContact O-N 3.33Å; E1103-E1106 PolarHBondContact O-N 3.07Å; E1103-K1107 WeakPolarHBondContact O-CB 3.33Å; E1103-K1107 PolarHBondContact O-N 2.81Å
1104	A	83.7	Confident	85.9	Confident	48 Å²	48	81.5 Å²	81.5	40%	0.397	39%	0.391	S	S	.	.	H	α-helix	trans	-65.4	-44.4	176.5	0	0	0	0	0	112.5	K1100 R1101 E1106 K1107 I1108	K1100-A1104 WeakPolarHBondContact O-CB 3.34Å; K1100-A1104 PolarHBondContact O-N 3.35Å; R1101-A1104 PolarHBondContact O-N 2.99Å; A1104-E1106 VanDerWaalsContact C-N 3.3Å; A1104-E1106 PolarHBondContact O-N 3.37Å; A1104-K1107 PolarHBondContact O-N 3.23Å; A1104-I1108 WeakPolarHBondContact O-CB 3.31Å; A1104-I1108 VanDerWaalsContact O-CG1 3.27Å; A1104-I1108 WeakPolarHBondContact O-CG1 3.28Å; A1104-I1108 PolarHBondContact O-N 3.4Å
1105	E	84.6	Confident	84.7	Confident	108 Å²	108	90.1 Å²	90.1	51%	0.505	42%	0.424	S	S	.	.	H	α-helix	trans	-62.3	-37.4	175.2	-74.5	177.9	-175.1	0	0	111.3	R1101 R1109	R1101-E1105 WeakPolarHBondContact CD-OE1 3.49Å; R1101-E1105 HydrophobicContact CG-CG 4.22Å; R1101-E1105 VanDerWaalsContact CG-OE1 3.3Å; R1101-E1105 WeakPolarHBondContact CG-OE1 3.42Å; R1101-E1105 WeakPolarHBondContact O-CB 3.48Å; R1101-E1105 WeakPolarHBondContact O-CG 3.45Å; R1101-E1105 PolarHBondContact O-N 3.13Å; E1105-R1109 VanDerWaalsContact O-CB 3.23Å; E1105-R1109 WeakPolarHBondContact O-CB 3.4Å; E1105-R1109 PolarHBondContact O-N 3.15Å
1106	E	82.5	Confident	83.6	Confident	76 Å²	76	92.7 Å²	92.7	36%	0.355	43%	0.433	S	S	.	.	H	α-helix	trans	-74.1	-36.5	175.1	-141.2	-146.9	167.3	0	0	113.3	K1102 E1103 A1104 R1109 K1110	K1102-E1106 WeakPolarHBondContact O-CB 3.48Å; K1102-E1106 PolarHBondContact O-N 2.68Å; E1103-E1106 PolarHBondContact O-N 3.07Å; A1104-E1106 VanDerWaalsContact C-N 3.3Å; A1104-E1106 PolarHBondContact O-N 3.37Å; E1106-R1109 PolarHBondContact O-N 2.9Å; E1106-R1109 IonicContact OE1-CZ 2.71Å; E1106-R1109 IonicContact OE1-NH2 3.88Å; E1106-R1109 PolarHBondContact OE1-NH2 3.47Å; E1106-K1110 HydrophobicContact CG-CD 4.45Å; E1106-K1110 VanDerWaalsContact O-CB 3.3Å; E1106-K1110 WeakPolarHBondContact O-CB 3.24Å; E1106-K1110 VanDerWaalsContact O-CG 3.29Å; E1106-K1110 WeakPolarHBondContact O-CG 3.41Å; E1106-K1110 PolarHBondContact O-N 2.92Å; E1106-K1110 WeakPolarHBondContact OE1-CE 3.43Å; E1106-K1110 IonicContact OE1-NZ 2.56Å; E1106-K1110 PolarHBondContact OE1-NZ 3.46Å; E1106-K1110 WeakPolarHBondContact OE2-CE 2.95Å; E1106-K1110 IonicContact OE2-NZ 2.69Å; E1106-K1110 PolarHBondContact OE2-NZ 3.24Å
1107	K	82.1	Confident	82.5	Confident	121 Å²	121	92.7 Å²	92.7	53%	0.526	43%	0.433	S	S	.	.	H	α-helix	trans	-59.3	-48.1	171.7	-172.3	173.3	-179.6	179.4	0	110	E1103 A1104 R1109 K1110 A1111	E1103-K1107 WeakPolarHBondContact O-CB 3.33Å; E1103-K1107 PolarHBondContact O-N 2.81Å; A1104-K1107 PolarHBondContact O-N 3.23Å; K1107-R1109 PolarHBondContact O-N 3Å; K1107-K1110 PolarHBondContact O-N 3.35Å; K1107-A1111 WeakPolarHBondContact O-CB 3.46Å; K1107-A1111 PolarHBondContact O-N 3.29Å
1108	I	84	Confident	81.1	Confident	116 Å²	116	89.4 Å²	89.4	60%	0.595	42%	0.422	S	S	*	.	H	α-helix	trans	-62.1	-42.7	175.7	-67.8	165.1	0	0	0	111.5	A1104 K1112	A1104-I1108 WeakPolarHBondContact O-CB 3.31Å; A1104-I1108 VanDerWaalsContact O-CG1 3.27Å; A1104-I1108 WeakPolarHBondContact O-CG1 3.28Å; A1104-I1108 PolarHBondContact O-N 3.4Å; I1108-K1112 VanDerWaalsContact O-CB 3.3Å; I1108-K1112 WeakPolarHBondContact O-CB 3.23Å; I1108-K1112 PolarHBondContact O-N 3.26Å
1109	R	83.1	Confident	79.7	Confident	128 Å²	128	94.5 Å²	94.5	48%	0.483	45%	0.446	S	S	.	.	H	α-helix	trans	-64.6	-41.3	177.3	-172.4	-171.8	71.1	87.6	-0.9	112.1	E1105 E1106 K1107 L1113	E1105-R1109 VanDerWaalsContact O-CB 3.23Å; E1105-R1109 WeakPolarHBondContact O-CB 3.4Å; E1105-R1109 PolarHBondContact O-N 3.15Å; E1106-R1109 PolarHBondContact O-N 2.9Å; E1106-R1109 IonicContact OE1-CZ 2.71Å; E1106-R1109 IonicContact OE1-NH2 3.88Å; E1106-R1109 PolarHBondContact OE1-NH2 3.47Å; K1107-R1109 PolarHBondContact O-N 3Å; R1109-L1113 HydrophobicContact CG-CD1 4.17Å; R1109-L1113 WeakPolarHBondContact O-CB 3.42Å; R1109-L1113 WeakPolarHBondContact O-CG 3.46Å; R1109-L1113 PolarHBondContact O-N 2.69Å
1110	K	79.5	Confident	78.4	Confident	113 Å²	113	96.7 Å²	96.7	49%	0.491	45%	0.454	S	S	.	.	H	α-helix	trans	-63.8	-51.4	175.8	-79.1	163.8	168.3	161.4	0	110.6	E1106 K1107 K1112 L1113 A1114	E1106-K1110 HydrophobicContact CG-CD 4.45Å; E1106-K1110 VanDerWaalsContact O-CB 3.3Å; E1106-K1110 WeakPolarHBondContact O-CB 3.24Å; E1106-K1110 VanDerWaalsContact O-CG 3.29Å; E1106-K1110 WeakPolarHBondContact O-CG 3.41Å; E1106-K1110 PolarHBondContact O-N 2.92Å; E1106-K1110 WeakPolarHBondContact OE1-CE 3.43Å; E1106-K1110 IonicContact OE1-NZ 2.56Å; E1106-K1110 PolarHBondContact OE1-NZ 3.46Å; E1106-K1110 WeakPolarHBondContact OE2-CE 2.95Å; E1106-K1110 IonicContact OE2-NZ 2.69Å; E1106-K1110 PolarHBondContact OE2-NZ 3.24Å; K1107-K1110 PolarHBondContact O-N 3.35Å; K1110-K1112 VanDerWaalsContact C-N 3.34Å; K1110-K1112 PolarHBondContact O-N 3.47Å; K1110-L1113 PolarHBondContact O-N 3.4Å; K1110-A1114 VanDerWaalsContact O-CB 3.3Å; K1110-A1114 WeakPolarHBondContact O-CB 3.49Å; K1110-A1114 PolarHBondContact O-N 3.39Å
1111	A	77.8	Confident	76.8	Confident	32 Å²	32	93.2 Å²	93.2	26%	0.264	44%	0.44	S	S	.	.	H	α-helix	trans	-58.9	-41.7	176.1	0	0	0	0	0	112.4	K1107 A1114 R1115	K1107-A1111 WeakPolarHBondContact O-CB 3.46Å; K1107-A1111 PolarHBondContact O-N 3.29Å; A1111-A1114 PolarHBondContact O-N 2.81Å; A1111-R1115 VanDerWaalsContact O-CB 3.26Å; A1111-R1115 WeakPolarHBondContact O-CB 3.36Å; A1111-R1115 PolarHBondContact O-N 3.34Å
1112	K	75.1	Confident	75.2	Confident	124 Å²	124	97 Å²	97	54%	0.539	46%	0.458	S	S	.	.	H	α-helix	trans	-64.6	-44.4	176.4	-172.1	170.3	-173.4	-72.8	0	112.6	I1108 K1110 R1115 E1116	I1108-K1112 VanDerWaalsContact O-CB 3.3Å; I1108-K1112 WeakPolarHBondContact O-CB 3.23Å; I1108-K1112 PolarHBondContact O-N 3.26Å; K1110-K1112 VanDerWaalsContact C-N 3.34Å; K1110-K1112 PolarHBondContact O-N 3.47Å; K1112-R1115 PolarHBondContact O-N 2.78Å; K1112-E1116 IonicContact NZ-OE1 3.72Å; K1112-E1116 PolarHBondContact NZ-OE1 3.28Å; K1112-E1116 WeakPolarHBondContact O-CB 3.18Å; K1112-E1116 WeakPolarHBondContact O-CG 3.46Å; K1112-E1116 PolarHBondContact O-N 3.44Å
1113	L	77.4	Confident	73.5	Confident	88 Å²	88	99.4 Å²	99.4	46%	0.461	47%	0.47	S	S	.	.	H	α-helix	trans	-68.5	-36.2	176.4	-75.2	168.7	0	0	0	112.4	R1109 K1110 K1117	R1109-L1113 HydrophobicContact CG-CD1 4.17Å; R1109-L1113 WeakPolarHBondContact O-CB 3.42Å; R1109-L1113 WeakPolarHBondContact O-CG 3.46Å; R1109-L1113 PolarHBondContact O-N 2.69Å; K1110-L1113 PolarHBondContact O-N 3.4Å; L1113-K1117 VanDerWaalsContact O-CB 3.25Å; L1113-K1117 WeakPolarHBondContact O-CB 3.32Å; L1113-K1117 PolarHBondContact O-N 3.48Å
1114	A	73.7	Confident	71.8	Confident	45 Å²	45	99.6 Å²	99.6	37%	0.372	47%	0.471	S	S	.	.	H	α-helix	trans	-62.6	-47.5	172.7	0	0	0	0	0	110.5	K1110 A1111 K1117 A1118	K1110-A1114 VanDerWaalsContact O-CB 3.3Å; K1110-A1114 WeakPolarHBondContact O-CB 3.49Å; K1110-A1114 PolarHBondContact O-N 3.39Å; A1111-A1114 PolarHBondContact O-N 2.81Å; A1114-K1117 PolarHBondContact O-N 3.07Å; A1114-A1118 WeakPolarHBondContact O-CB 3.43Å; A1114-A1118 PolarHBondContact O-N 3.32Å
1115	R	72.3	Confident	70	Confident	184 Å²	184	103 Å²	103	69%	0.694	48%	0.477	S	S	*	.	H	α-helix	trans	-60.7	-49.4	175.8	-178.2	173.4	174.4	157.3	0.6	112.7	A1111 K1112 K1117 A1118 E1119	A1111-R1115 VanDerWaalsContact O-CB 3.26Å; A1111-R1115 WeakPolarHBondContact O-CB 3.36Å; A1111-R1115 PolarHBondContact O-N 3.34Å; K1112-R1115 PolarHBondContact O-N 2.78Å; R1115-K1117 VanDerWaalsContact C-N 3.34Å; R1115-K1117 PolarHBondContact O-N 3.2Å; R1115-A1118 PolarHBondContact O-N 2.83Å; R1115-E1119 VanDerWaalsContact O-CB 3.23Å; R1115-E1119 WeakPolarHBondContact O-CB 3.14Å; R1115-E1119 PolarHBondContact O-N 3.22Å
1116	E	72.4	Confident	68.2	Low	89 Å²	89	103 Å²	103	42%	0.416	48%	0.48	S	S	.	.	H	α-helix	trans	-61.9	-40.1	178	-75.4	172.8	178.7	0	0	112.2	K1112 K1120	K1112-E1116 IonicContact NZ-OE1 3.72Å; K1112-E1116 PolarHBondContact NZ-OE1 3.28Å; K1112-E1116 WeakPolarHBondContact O-CB 3.18Å; K1112-E1116 WeakPolarHBondContact O-CG 3.46Å; K1112-E1116 PolarHBondContact O-N 3.44Å; E1116-K1120 WeakPolarHBondContact O-CB 3.01Å; E1116-K1120 PolarHBondContact O-N 2.92Å
1117	K	71.6	Confident	66.7	Low	133 Å²	133	106.4 Å²	106.4	58%	0.578	49%	0.494	S	S	*	.	H	α-helix	trans	-67.2	-43	174.2	-177	175.5	-178.8	-79.2	0	111.7	L1113 A1114 R1115 K1120 E1121	L1113-K1117 VanDerWaalsContact O-CB 3.25Å; L1113-K1117 WeakPolarHBondContact O-CB 3.32Å; L1113-K1117 PolarHBondContact O-N 3.48Å; A1114-K1117 PolarHBondContact O-N 3.07Å; R1115-K1117 VanDerWaalsContact C-N 3.34Å; R1115-K1117 PolarHBondContact O-N 3.2Å; K1117-K1120 PolarHBondContact O-N 3.43Å; K1117-E1121 IonicContact NZ-OE1 3.86Å; K1117-E1121 PolarHBondContact NZ-OE1 2.9Å; K1117-E1121 WeakPolarHBondContact O-CB 3.47Å; K1117-E1121 PolarHBondContact O-N 3.11Å
1118	A	65.9	Low	64.9	Low	27 Å²	27	111.5 Å²	111.5	22%	0.223	51%	0.51	C	S	.	.	H	α-helix	trans	-67.1	-36.2	179	0	0	0	0	0	112.1	A1114 R1115 K1122 P1164	A1114-A1118 WeakPolarHBondContact O-CB 3.43Å; A1114-A1118 PolarHBondContact O-N 3.32Å; R1115-A1118 PolarHBondContact O-N 2.83Å; A1118-K1122 WeakPolarHBondContact O-CB 3.45Å; A1118-K1122 PolarHBondContact O-N 3.29Å; A1118-P1164 HydrophobicContact CB-CB 4Å; A1118-P1164 HydrophobicContact CB-CG 4.02Å
1119	E	63.9	Low	63	Low	108 Å²	108	108.8 Å²	108.8	51%	0.505	50%	0.501	S	S	.	.	H	α-helix	trans	-67.2	-42.9	174.6	-172.4	154.6	-134.1	0	0	111.2	R1115 K1122 E1123	R1115-E1119 VanDerWaalsContact O-CB 3.23Å; R1115-E1119 WeakPolarHBondContact O-CB 3.14Å; R1115-E1119 PolarHBondContact O-N 3.22Å; E1119-K1122 WeakPolarHBondContact O-CB 3.34Å; E1119-K1122 PolarHBondContact O-N 3.44Å; E1119-E1123 PolarHBondContact O-N 2.93Å
1120	K	63.5	Low	61.1	Low	133 Å²	133	111.3 Å²	111.3	58%	0.578	52%	0.518	S	S	*	.	H	α-helix	trans	-66.3	-43.2	173.1	-170.4	174.6	-179.9	179.7	0	113	E1116 K1117 K1122 E1123 E1124	E1116-K1120 WeakPolarHBondContact O-CB 3.01Å; E1116-K1120 PolarHBondContact O-N 2.92Å; K1117-K1120 PolarHBondContact O-N 3.43Å; K1120-K1122 VanDerWaalsContact C-N 3.27Å; K1120-K1122 PolarHBondContact O-N 3.34Å; K1120-E1123 PolarHBondContact O-N 3.48Å; K1120-E1124 WeakPolarHBondContact CE-OE1 3.37Å; K1120-E1124 PolarHBondContact O-N 3.24Å
1121	E	56.9	Low	59.7	Low	64 Å²	64	112 Å²	112	30%	0.299	53%	0.526	S	S	.	.	H	α-helix	trans	-65.1	-31.4	172.9	-79.5	-169.9	-139	0	0	112.4	K1117 E1124 K1125	K1117-E1121 IonicContact NZ-OE1 3.86Å; K1117-E1121 PolarHBondContact NZ-OE1 2.9Å; K1117-E1121 WeakPolarHBondContact O-CB 3.47Å; K1117-E1121 PolarHBondContact O-N 3.11Å; E1121-E1124 PolarHBondContact O-N 3.21Å; E1121-K1125 VanDerWaalsContact O-CB 3.29Å; E1121-K1125 WeakPolarHBondContact O-CB 3.27Å; E1121-K1125 WeakPolarHBondContact O-CD 3.5Å; E1121-K1125 WeakPolarHBondContact O-CG 3.47Å; E1121-K1125 PolarHBondContact O-N 3.19Å; E1121-K1125 IonicContact OE2-NZ 2.95Å; E1121-K1125 PolarHBondContact OE2-NZ 2.88Å
1122	K	53.3	Low	58.2	Low	135 Å²	135	115.2 Å²	115.2	59%	0.587	54%	0.544	S	S	*	.	H	α-helix	trans	-66.8	-44.2	173.7	177.7	-177.4	178	-176.6	0	110.6	A1118 E1119 K1120 K1125 L1126	A1118-K1122 WeakPolarHBondContact O-CB 3.45Å; A1118-K1122 PolarHBondContact O-N 3.29Å; E1119-K1122 WeakPolarHBondContact O-CB 3.34Å; E1119-K1122 PolarHBondContact O-N 3.44Å; K1120-K1122 VanDerWaalsContact C-N 3.27Å; K1120-K1122 PolarHBondContact O-N 3.34Å; K1122-K1125 PolarHBondContact O-N 2.72Å; K1122-L1126 WeakPolarHBondContact O-CB 3.13Å; K1122-L1126 PolarHBondContact O-N 2.98Å
1123	E	52.4	Low	56.8	Low	107 Å²	107	112.6 Å²	112.6	50%	0.5	54%	0.537	S	S	.	.	H	α-helix	trans	-58.8	-47.6	171.5	-80.8	-159.5	-163.7	0	0	112.6	E1119 K1120 K1125 L1126 K1127	E1119-E1123 PolarHBondContact O-N 2.93Å; K1120-E1123 PolarHBondContact O-N 3.48Å; E1123-K1125 VanDerWaalsContact C-N 3.34Å; E1123-K1125 PolarHBondContact O-N 3.23Å; E1123-L1126 PolarHBondContact O-N 2.92Å; E1123-K1127 WeakPolarHBondContact O-CD 3.26Å; E1123-K1127 VanDerWaalsContact O-CG 3.25Å; E1123-K1127 WeakPolarHBondContact O-CG 3.14Å; E1123-K1127 PolarHBondContact O-N 3.37Å; E1123-K1127 VanDerWaalsContact O-N 3.15Å; E1123-K1127 IonicContact OE2-NZ 3.84Å; E1123-K1127 PolarHBondContact OE2-NZ 3.39Å
1124	E	51.4	Low	55.4	Low	113 Å²	113	109 Å²	109	53%	0.528	52%	0.518	S	S	.	.	H	α-helix	trans	-67.6	-31.9	-178.4	-72.2	178.4	-167.6	0	0	112.5	K1120 E1121	K1120-E1124 WeakPolarHBondContact CE-OE1 3.37Å; K1120-E1124 PolarHBondContact O-N 3.24Å; E1121-E1124 PolarHBondContact O-N 3.21Å
1125	K	45.8	Very low	54	Low	120 Å²	120	111.9 Å²	111.9	52%	0.522	53%	0.527	S	S	.	.	H	α-helix	trans	-80.1	-35.8	175	-71.2	165.6	-169.7	161.5	0	112.9	E1121 K1122 E1123 K1127 R1128 S1129	E1121-K1125 VanDerWaalsContact O-CB 3.29Å; E1121-K1125 WeakPolarHBondContact O-CB 3.27Å; E1121-K1125 WeakPolarHBondContact O-CD 3.5Å; E1121-K1125 WeakPolarHBondContact O-CG 3.47Å; E1121-K1125 PolarHBondContact O-N 3.19Å; E1121-K1125 IonicContact OE2-NZ 2.95Å; E1121-K1125 PolarHBondContact OE2-NZ 2.88Å; K1122-K1125 PolarHBondContact O-N 2.72Å; E1123-K1125 VanDerWaalsContact C-N 3.34Å; E1123-K1125 PolarHBondContact O-N 3.23Å; K1125-K1127 VanDerWaalsContact C-N 3.32Å; K1125-K1127 PolarHBondContact O-N 2.91Å; K1125-R1128 CarbonylContact O-C 3.5Å; K1125-R1128 PolarHBondContact O-N 2.94Å; K1125-S1129 PolarHBondContact O-N 2.91Å; K1125-S1129 PolarHBondContact O-OG 3.46Å
1126	L	48.2	Very low	52.7	Low	108 Å²	108	106.7 Å²	106.7	57%	0.565	52%	0.523	S	S	*	.	H	α-helix	trans	-62.9	-40.3	176	-171.1	69.8	0	0	0	111	K1122 E1123 R1128	K1122-L1126 WeakPolarHBondContact O-CB 3.13Å; K1122-L1126 PolarHBondContact O-N 2.98Å; E1123-L1126 PolarHBondContact O-N 2.92Å; L1126-R1128 PolarHBondContact O-N 3.5Å; L1126-R1128 VanDerWaalsContact O-N 3.1Å
1127	K	49.7	Very low	51.5	Low	147 Å²	147	103.2 Å²	103.2	64%	0.639	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-3.2	172.7	-68.7	163.9	-169	160.2	0	114.3	E1123 K1125	E1123-K1127 WeakPolarHBondContact O-CD 3.26Å; E1123-K1127 VanDerWaalsContact O-CG 3.25Å; E1123-K1127 WeakPolarHBondContact O-CG 3.14Å; E1123-K1127 PolarHBondContact O-N 3.37Å; E1123-K1127 VanDerWaalsContact O-N 3.15Å; E1123-K1127 IonicContact OE2-NZ 3.84Å; E1123-K1127 PolarHBondContact OE2-NZ 3.39Å; K1125-K1127 VanDerWaalsContact C-N 3.32Å; K1125-K1127 PolarHBondContact O-N 2.91Å
1128	R	45	Very low	50.1	Low	228 Å²	228	106.3 Å²	106.3	86%	0.86	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-128.5	3.5	-170.9	-153.8	177	-177.1	-174.5	0.8	114.4	K1125 L1126	K1125-R1128 CarbonylContact O-C 3.5Å; K1125-R1128 PolarHBondContact O-N 2.94Å; L1126-R1128 PolarHBondContact O-N 3.5Å; L1126-R1128 VanDerWaalsContact O-N 3.1Å
1129	S	43.7	Very low	49.3	Very low	58 Å²	58	107 Å²	107	41%	0.406	54%	0.536	S	S	.	.			trans	-138.8	38	-173.6	57.1	0	0	0	0	113.4	K1125 L1131	K1125-S1129 PolarHBondContact O-N 2.91Å; K1125-S1129 PolarHBondContact O-OG 3.46Å; S1129-L1131 PolarHBondContact O-N 2.89Å
1130	Q	42.8	Very low	48.8	Very low	182 Å²	182	106.6 Å²	106.6	85%	0.85	54%	0.537	S	S	*	.			trans	-73.3	109.8	170.9	-73.6	178.2	-32.4	0	0	110
1131	L	50.8	Low	48.7	Very low	126 Å²	126	104.6 Å²	104.6	66%	0.66	53%	0.53	S	S	*	.			trans	-72.5	161.7	151.2	-73.9	166.1	0	0	0	108.7	S1129 D1133	S1129-L1131 PolarHBondContact O-N 2.89Å; L1131-D1133 PolarHBondContact O-N 3.39Å; L1131-D1133 VanDerWaalsContact O-N 3.08Å
1132	P	46.1	Very low	49.2	Very low	100 Å²	100	103.3 Å²	103.3	65%	0.649	53%	0.526	S	S	*	.			trans	-61.3	112.3	176.3	-21.6	33.8	0	0	0	111.3
1133	D	45.3	Very low	50.1	Low	70 Å²	70	98 Å²	98	37%	0.374	51%	0.51	S	S	.	.			trans	-84.4	119.1	173.5	172.8	5.7	0	0	0	109.2	L1131 N1135 A1136 A1137	L1131-D1133 PolarHBondContact O-N 3.39Å; L1131-D1133 VanDerWaalsContact O-N 3.08Å; D1133-N1135 PolarHBondContact O-N 2.98Å; D1133-N1135 WeakPolarHBondContact OD1-CB 3.3Å; D1133-N1135 PolarHBondContact OD1-N 3.5Å; D1133-N1135 PolarHBondContact OD1-ND2 3.17Å; D1133-A1136 HydrophobicContact CB-CB 3.8Å; D1133-A1136 PolarHBondContact O-N 3.19Å; D1133-A1137 PolarHBondContact O-N 2.95Å; D1133-A1137 VanDerWaalsContact O-N 3.08Å
1134	I	48.4	Very low	51.3	Low	13 Å²	13	94.3 Å²	94.3	7%	0.067	49%	0.493	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-18.8	-178.2	-38.4	-179.9	0	0	0	112	M235 L276 D277 H278	M235-I1134 HydrophobicContact CE-CG2 3.91Å; M235-I1134 HydrophobicContact SD-CG2 3.56Å; M235-I1134 VanDerWaalsContact SD-CG2 3.56Å; L276-I1134 HydrophobicContact CB-CD1 4.07Å; L276-I1134 HydrophobicContact CD2-CD1 3.78Å; L276-I1134 HydrophobicContact CD2-CG1 4.49Å; L276-I1134 HydrophobicContact CG-CD1 4.36Å; D277-I1134 WeakPolarHBondContact O-CD1 3.46Å; D277-I1134 WeakPolarHBondContact O-CG1 3.41Å; H278-I1134 HydrophobicContact CB-CD1 4.3Å
1135	N	44.9	Very low	52.8	Low	105 Å²	105	88.9 Å²	88.9	56%	0.561	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.2	-22.2	-179.4	-44.8	-83.4	0	0	0	112.6	D1133	D1133-N1135 PolarHBondContact O-N 2.98Å; D1133-N1135 WeakPolarHBondContact OD1-CB 3.3Å; D1133-N1135 PolarHBondContact OD1-N 3.5Å; D1133-N1135 PolarHBondContact OD1-ND2 3.17Å
1136	A	45.4	Very low	54.6	Low	75 Å²	75	86.3 Å²	86.3	62%	0.62	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-26.7	172.4	0	0	0	0	0	112.1	D1133 E1138	D1133-A1136 HydrophobicContact CB-CB 3.8Å; D1133-A1136 PolarHBondContact O-N 3.19Å; A1136-E1138 PolarHBondContact O-N 3.02Å; A1136-E1138 VanDerWaalsContact O-N 3.09Å
1137	A	46.1	Very low	56.2	Low	16 Å²	16	82.9 Å²	82.9	13%	0.132	45%	0.451	C	S	.	.			trans	-78.7	81.3	172.6	0	0	0	0	0	111.6	M235 D1133 G1139	M235-A1137 HydrophobicContact CE-CB 3.94Å; D1133-A1137 PolarHBondContact O-N 2.95Å; D1133-A1137 VanDerWaalsContact O-N 3.08Å; A1137-G1139 PolarHBondContact O-N 2.57Å
1138	E	43.6	Very low	57.8	Low	198 Å²	198	77.2 Å²	77.2	93%	0.925	43%	0.427	S	S	*	.			trans	-72	3.4	164.9	-66.3	-166.3	134.5	0	0	113.1	A1136	A1136-E1138 PolarHBondContact O-N 3.02Å; A1136-E1138 VanDerWaalsContact O-N 3.09Å
1139	G	47.7	Very low	59.7	Low	41 Å²	41	67 Å²	67	42%	0.423	39%	0.389	S	S	.	.	S	Bend	trans	-101.2	161.5	-178.2	0	0	0	0	0	115.2	A1137 E1141	A1137-G1139 PolarHBondContact O-N 2.57Å; G1139-E1141 PolarHBondContact O-N 3Å
1140	D	54.3	Low	61.7	Low	100 Å²	100	70.7 Å²	70.7	54%	0.535	40%	0.401	S	S	.	.			trans	-73.8	62.7	179.6	-73.4	-56.5	0	0	0	113.4	L182	L182-D1140 HydrophobicContact CD1-CB 3.98Å; L182-D1140 HydrophobicContact CD2-CB 3.69Å; L182-D1140 HydrophobicContact CG-CB 4.49Å
1141	E	61.4	Low	63.6	Low	91 Å²	91	63.2 Å²	63.2	43%	0.425	37%	0.37	S	S	.	.			trans	-76	141.5	-176.7	-69.7	-169.4	176.2	0	0	114.2	M235 G1139 I1144	M235-E1141 PolarHBondContact N-O 3.32Å; M235-E1141 VanDerWaalsContact N-O 3.09Å; G1139-E1141 PolarHBondContact O-N 3Å; E1141-I1144 HydrophobicContact CB-CD1 3.96Å; E1141-I1144 HydrophobicContact CB-CG1 4.22Å
1142	T	67.6	Low	65.4	Low	36 Å²	36	57.2 Å²	57.2	22%	0.221	34%	0.338	C	S	.	.	B	Isolated β-bridge	trans	-135.6	154.2	-175.7	46.2	0	0	0	0	110.4	N106 N234 I1144	N106-T1142 PolarHBondContact OD1-OG1 3.33Å; N234-T1142 HydrophobicContact CB-CG2 4.31Å; N234-T1142 WeakPolarHBondContact OD1-CG2 3.45Å; T1142-I1144 VanDerWaalsContact C-N 3.32Å
1143	G	72.1	Confident	67.2	Low	24 Å²	24	56.4 Å²	56.4	25%	0.247	33%	0.326	C	S	.	.	S	Bend	trans	81.9	4.8	-173.2	0	0	0	0	0	114.9	N233 M1145 D1146 G1147	N233-G1143 PolarHBondContact O-N 3.4Å; N233-G1143 VanDerWaalsContact OD1-C 3.25Å; N233-G1143 WeakPolarHBondContact OD1-CA 2.98Å; G1143-M1145 VanDerWaalsContact C-N 3.33Å; G1143-M1145 PolarHBondContact O-N 2.59Å; G1143-D1146 PolarHBondContact O-N 3.12Å; G1143-G1147 PolarHBondContact O-N 3.45Å
1144	I	76.8	Confident	69.1	Low	29 Å²	29	56.4 Å²	56.4	15%	0.149	33%	0.331	C	S	.	.	H	α-helix	trans	-56.3	-44.8	-175	-59.2	166.5	0	0	0	111.6	M235 I238 E1141 T1142 G1147 L1148	M235-I1144 HydrophobicContact CB-CD1 3.83Å; M235-I1144 HydrophobicContact CE-CD1 3.75Å; M235-I1144 HydrophobicContact SD-CD1 4.2Å; I238-I1144 HydrophobicContact CD1-CB 4.07Å; I238-I1144 HydrophobicContact CD1-CD1 4.38Å; I238-I1144 HydrophobicContact CD1-CG2 3.67Å; E1141-I1144 HydrophobicContact CB-CD1 3.96Å; E1141-I1144 HydrophobicContact CB-CG1 4.22Å; T1142-I1144 VanDerWaalsContact C-N 3.32Å; I1144-G1147 PolarHBondContact O-N 2.79Å; I1144-L1148 HydrophobicContact CG2-CD1 3.9Å; I1144-L1148 VanDerWaalsContact O-CG 3.31Å; I1144-L1148 WeakPolarHBondContact O-CG 3.47Å; I1144-L1148 PolarHBondContact O-N 3.2Å
1145	M	83.8	Confident	70.6	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-73	-40.9	-173.4	-160.3	64.8	168.7	0	0	112	M232 N233 L269 A272 G1143 G1147 L1148 L1149	M232-M1145 HydrophobicContact CB-CG 4.31Å; M232-M1145 HydrophobicContact CE-CE 3.58Å; M232-M1145 HydrophobicContact CE-SD 4.22Å; M232-M1145 HydrophobicContact SD-CE 4.16Å; N233-M1145 HydrophobicContact CB-CB 4.28Å; N233-M1145 WeakPolarHBondContact OD1-CB 3.39Å; N233-M1145 PolarHBondContact OD1-N 2.87Å; N233-M1145 VanDerWaalsContact OD1-N 3.11Å; L269-M1145 HydrophobicContact CB-CE 4.36Å; L269-M1145 HydrophobicContact CD2-CE 3.45Å; L269-M1145 VanDerWaalsContact CD2-CE 3.45Å; L269-M1145 HydrophobicContact CD2-CG 4.4Å; A272-M1145 HydrophobicContact CB-CE 3.5Å; A272-M1145 VanDerWaalsContact CB-CE 3.5Å; A272-M1145 HydrophobicContact CB-SD 3.83Å; G1143-M1145 VanDerWaalsContact C-N 3.33Å; G1143-M1145 PolarHBondContact O-N 2.59Å; M1145-G1147 VanDerWaalsContact C-N 3.34Å; M1145-L1148 PolarHBondContact O-N 3.31Å; M1145-L1148 HydrophobicContact SD-CD1 4.39Å; M1145-L1149 WeakPolarHBondContact O-CB 3.39Å; M1145-L1149 WeakPolarHBondContact O-CG 3.15Å; M1145-L1149 PolarHBondContact O-N 3.24Å
1146	D	83.6	Confident	72.3	Confident	66 Å²	66	53.7 Å²	53.7	35%	0.353	33%	0.326	S	S	.	.	H	α-helix	trans	-67.1	-35.5	173.6	-77.3	-42.9	0	0	0	112	K229 N233 G1143 L1149 E1150	K229-D1146 WeakPolarHBondContact CE-OD1 3.44Å; K229-D1146 IonicContact NZ-OD1 3.32Å; K229-D1146 PolarHBondContact NZ-OD1 2.61Å; N233-D1146 PolarHBondContact ND2-OD2 3.35Å; N233-D1146 PolarHBondContact OD1-N 3.14Å; G1143-D1146 PolarHBondContact O-N 3.12Å; D1146-L1149 PolarHBondContact O-N 3.08Å; D1146-E1150 WeakPolarHBondContact O-CB 3.39Å; D1146-E1150 PolarHBondContact O-N 3.17Å
1147	G	80.2	Confident	74	Confident	36 Å²	36	51.1 Å²	51.1	37%	0.371	31%	0.305	S	S	.	.	H	α-helix	trans	-62.9	-41.8	173	0	0	0	0	0	113.4	G1143 I1144 M1145 L1149 E1150 A1151	G1143-G1147 PolarHBondContact O-N 3.45Å; I1144-G1147 PolarHBondContact O-N 2.79Å; M1145-G1147 VanDerWaalsContact C-N 3.34Å; G1147-L1149 VanDerWaalsContact C-N 3.34Å; G1147-E1150 PolarHBondContact O-N 3.13Å; G1147-A1151 WeakPolarHBondContact O-CB 3.43Å; G1147-A1151 PolarHBondContact O-N 3.47Å
1148	L	83.8	Confident	75.7	Confident	28 Å²	28	50.9 Å²	50.9	15%	0.147	30%	0.301	C	S	.	.	H	α-helix	trans	-63.8	-40	172.8	-71.1	162.6	0	0	0	111.7	A272 I275 L276 I1144 M1145 A1151 L1152	A272-L1148 HydrophobicContact CB-CB 4.22Å; I275-L1148 HydrophobicContact CD1-CB 4.42Å; I275-L1148 HydrophobicContact CD1-CD2 3.77Å; I275-L1148 HydrophobicContact CG1-CD2 4.28Å; L276-L1148 HydrophobicContact CD2-CD1 3.4Å; L276-L1148 VanDerWaalsContact CD2-CD1 3.4Å; L276-L1148 HydrophobicContact CG-CD1 4.19Å; I1144-L1148 HydrophobicContact CG2-CD1 3.9Å; I1144-L1148 VanDerWaalsContact O-CG 3.31Å; I1144-L1148 WeakPolarHBondContact O-CG 3.47Å; I1144-L1148 PolarHBondContact O-N 3.2Å; M1145-L1148 PolarHBondContact O-N 3.31Å; M1145-L1148 HydrophobicContact SD-CD1 4.39Å; L1148-A1151 PolarHBondContact O-N 2.83Å; L1148-L1152 WeakPolarHBondContact O-CB 3.07Å; L1148-L1152 WeakPolarHBondContact O-CD1 3.14Å; L1148-L1152 VanDerWaalsContact O-CG 3.23Å; L1148-L1152 WeakPolarHBondContact O-CG 3.47Å; L1148-L1152 PolarHBondContact O-N 2.91Å
1149	L	86.1	Confident	76.8	Confident	12 Å²	12	51.4 Å²	51.4	6%	0.063	29%	0.294	C	S	.	.	H	α-helix	trans	-67.1	-37.6	176.8	-70.7	175.9	0	0	0	112.8	K229 K268 A272 M1145 D1146 G1147 L1152 Q1153	K229-L1149 HydrophobicContact CD-CD1 4.24Å; K229-L1149 VanDerWaalsContact CE-CD1 3.44Å; K268-L1149 HydrophobicContact CB-CD2 3.72Å; K268-L1149 VanDerWaalsContact O-CD2 3.26Å; K268-L1149 WeakPolarHBondContact O-CD2 3.4Å; A272-L1149 HydrophobicContact CB-CD2 4.32Å; M1145-L1149 WeakPolarHBondContact O-CB 3.39Å; M1145-L1149 WeakPolarHBondContact O-CG 3.15Å; M1145-L1149 PolarHBondContact O-N 3.24Å; D1146-L1149 PolarHBondContact O-N 3.08Å; G1147-L1149 VanDerWaalsContact C-N 3.34Å; L1149-L1152 HydrophobicContact CD2-CD1 4.25Å; L1149-L1152 PolarHBondContact O-N 2.76Å; L1149-Q1153 VanDerWaalsContact O-CB 3.26Å; L1149-Q1153 WeakPolarHBondContact O-CB 3.42Å; L1149-Q1153 PolarHBondContact O-N 3.33Å
1150	E	85.4	Confident	77.3	Confident	137 Å²	137	52 Å²	52	64%	0.64	28%	0.284	S	S	*	.	H	α-helix	trans	-66.7	-41.2	172.9	-175	167.9	-151.4	0	0	111.2	D1146 G1147 L1152 Q1153 S1154	D1146-E1150 WeakPolarHBondContact O-CB 3.39Å; D1146-E1150 PolarHBondContact O-N 3.17Å; G1147-E1150 PolarHBondContact O-N 3.13Å; E1150-L1152 VanDerWaalsContact C-N 3.34Å; E1150-L1152 PolarHBondContact O-N 3.33Å; E1150-Q1153 PolarHBondContact O-N 3.15Å; E1150-S1154 WeakPolarHBondContact O-CB 3.47Å; E1150-S1154 PolarHBondContact O-N 3.45Å; E1150-S1154 PolarHBondContact O-OG 2.98Å
1151	A	82.7	Confident	77	Confident	24 Å²	24	54.8 Å²	54.8	20%	0.198	29%	0.291	C	S	.	.	H	α-helix	trans	-64.7	-34.5	174.4	0	0	0	0	0	112.9	G1147 L1148 S1154 G1155 A1156 A1157	G1147-A1151 WeakPolarHBondContact O-CB 3.43Å; G1147-A1151 PolarHBondContact O-N 3.47Å; L1148-A1151 PolarHBondContact O-N 2.83Å; A1151-S1154 PolarHBondContact O-OG 3.46Å; A1151-G1155 CarbonylContact O-C 3.51Å; A1151-G1155 PolarHBondContact O-N 3.05Å; A1151-A1156 PolarHBondContact O-N 2.93Å; A1151-A1157 HydrophobicContact CB-CB 3.99Å; A1151-A1157 WeakPolarHBondContact O-CB 3.33Å; A1151-A1157 PolarHBondContact O-N 2.62Å
1152	L	87.3	Confident	76.1	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-71.6	-45.2	172.9	-73.7	160.3	0	0	0	112	A272 I275 Q322 Q367 L1148 L1149 E1150 G1155 A1157 F1158	A272-L1152 HydrophobicContact CB-CD1 3.97Å; I275-L1152 HydrophobicContact CD1-CD1 3.86Å; I275-L1152 HydrophobicContact CD1-CD2 3.77Å; I275-L1152 HydrophobicContact CD1-CG 3.64Å; I275-L1152 HydrophobicContact CG1-CD1 4.33Å; I275-L1152 HydrophobicContact CG1-CD2 4.29Å; I275-L1152 HydrophobicContact CG1-CG 4.47Å; I275-L1152 HydrophobicContact CG2-CD2 4.03Å; Q322-L1152 HydrophobicContact CG-CB 4.1Å; Q367-L1152 PolarHBondContact NE2-O 2.72Å; L1148-L1152 WeakPolarHBondContact O-CB 3.07Å; L1148-L1152 WeakPolarHBondContact O-CD1 3.14Å; L1148-L1152 VanDerWaalsContact O-CG 3.23Å; L1148-L1152 WeakPolarHBondContact O-CG 3.47Å; L1148-L1152 PolarHBondContact O-N 2.91Å; L1149-L1152 HydrophobicContact CD2-CD1 4.25Å; L1149-L1152 PolarHBondContact O-N 2.76Å; E1150-L1152 VanDerWaalsContact C-N 3.34Å; E1150-L1152 PolarHBondContact O-N 3.33Å; L1152-G1155 PolarHBondContact O-N 2.93Å; L1152-G1155 VanDerWaalsContact O-N 3.11Å; L1152-A1157 HydrophobicContact CD2-CB 4.09Å; L1152-A1157 HydrophobicContact CG-CB 4.19Å; L1152-F1158 HydrophobicContact CD2-CD1 4.37Å; L1152-F1158 HydrophobicContact CD2-CE1 3.44Å; L1152-F1158 VanDerWaalsContact CD2-CE1 3.44Å; L1152-F1158 HydrophobicContact CD2-CE2 4.01Å; L1152-F1158 HydrophobicContact CD2-CZ 3.25Å; L1152-F1158 HydrophobicContact CG-CZ 4.48Å
1153	Q	85.3	Confident	74.8	Confident	84 Å²	84	60.4 Å²	60.4	39%	0.393	32%	0.321	S	S	.	.	H	α-helix	trans	-67.5	-36.3	-177.2	-167.8	173.8	3.6	0	0	112.2	E363 L1149 E1150 G1155	E363-Q1153 VanDerWaalsContact CD-NE2 3.33Å; E363-Q1153 HydrophobicContact CG-CG 3.83Å; E363-Q1153 PolarHBondContact OE2-NE2 3.1Å; L1149-Q1153 VanDerWaalsContact O-CB 3.26Å; L1149-Q1153 WeakPolarHBondContact O-CB 3.42Å; L1149-Q1153 PolarHBondContact O-N 3.33Å; E1150-Q1153 PolarHBondContact O-N 3.15Å; Q1153-G1155 VanDerWaalsContact C-N 3.29Å
1154	S	83.8	Confident	73	Confident	70 Å²	70	63.3 Å²	63.3	49%	0.49	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.9	-5.4	172.5	60.7	0	0	0	0	114.3	E1150 A1151 A1156	E1150-S1154 WeakPolarHBondContact O-CB 3.47Å; E1150-S1154 PolarHBondContact O-N 3.45Å; E1150-S1154 PolarHBondContact O-OG 2.98Å; A1151-S1154 PolarHBondContact O-OG 3.46Å; S1154-A1156 PolarHBondContact O-N 3.35Å
1155	G	81.1	Confident	71.1	Confident	7 Å²	7	67.4 Å²	67.4	7%	0.072	35%	0.349	C	S	.	.	S	Bend	trans	72.7	-2.7	-176.4	0	0	0	0	0	115.2	A1151 L1152 Q1153 A1157 F1158	A1151-G1155 CarbonylContact O-C 3.51Å; A1151-G1155 PolarHBondContact O-N 3.05Å; L1152-G1155 PolarHBondContact O-N 2.93Å; L1152-G1155 VanDerWaalsContact O-N 3.11Å; Q1153-G1155 VanDerWaalsContact C-N 3.29Å; G1155-A1157 VanDerWaalsContact C-N 3.27Å; G1155-A1157 PolarHBondContact O-N 3.28Å; G1155-F1158 PolarHBondContact O-N 2.8Å; G1155-F1158 VanDerWaalsContact O-N 3.11Å
1156	A	80.3	Confident	68.5	Low	54 Å²	54	75.1 Å²	75.1	45%	0.446	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-58.6	-36.3	-179.7	0	0	0	0	0	113	A1151 S1154 F1158 R1159	A1151-A1156 PolarHBondContact O-N 2.93Å; S1154-A1156 PolarHBondContact O-N 3.35Å; A1156-F1158 PolarHBondContact O-N 3.17Å; A1156-R1159 PolarHBondContact O-N 2.82Å
1157	A	81.3	Confident	66.1	Low	21 Å²	21	77.3 Å²	77.3	17%	0.174	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-64.9	-18.7	178.3	0	0	0	0	0	114.4	I275 A1151 L1152 G1155	I275-A1157 HydrophobicContact CD1-CB 3.66Å; A1151-A1157 HydrophobicContact CB-CB 3.99Å; A1151-A1157 WeakPolarHBondContact O-CB 3.33Å; A1151-A1157 PolarHBondContact O-N 2.62Å; L1152-A1157 HydrophobicContact CD2-CB 4.09Å; L1152-A1157 HydrophobicContact CG-CB 4.19Å; G1155-A1157 VanDerWaalsContact C-N 3.27Å; G1155-A1157 PolarHBondContact O-N 3.28Å
1158	F	80.9	Confident	65.4	Low	10 Å²	10	79.4 Å²	79.4	4%	0.044	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-97.5	1	-175	-56.7	-56.5	0	0	0	113.9	Q322 N325 A326 S329 Q367 V370 Q374 L1152 G1155 A1156 R1160	Q322-F1158 HydrophobicContact CG-CZ 4.27Å; N325-F1158 HydrophobicContact CB-CD1 4.4Å; N325-F1158 HydrophobicContact CB-CD2 4.5Å; N325-F1158 HydrophobicContact CB-CE1 3.93Å; N325-F1158 HydrophobicContact CB-CE2 4.05Å; N325-F1158 HydrophobicContact CB-CZ 3.71Å; A326-F1158 HydrophobicContact CB-CE1 4.09Å; S329-F1158 WeakPolarHBondContact OG-CD1 3.5Å; Q367-F1158 VanDerWaalsContact OE1-CE2 3.22Å; V370-F1158 HydrophobicContact CB-CD2 4.34Å; V370-F1158 HydrophobicContact CG1-CB 3.54Å; V370-F1158 HydrophobicContact CG1-CD2 3.63Å; V370-F1158 HydrophobicContact CG1-CE2 4.43Å; V370-F1158 HydrophobicContact CG1-CG 3.71Å; V370-F1158 HydrophobicContact CG2-CB 4.27Å; V370-F1158 HydrophobicContact CG2-CD2 3.97Å; Q374-F1158 PolarHBondContact NE2-O 3.5Å; L1152-F1158 HydrophobicContact CD2-CD1 4.37Å; L1152-F1158 HydrophobicContact CD2-CE1 3.44Å; L1152-F1158 VanDerWaalsContact CD2-CE1 3.44Å; L1152-F1158 HydrophobicContact CD2-CE2 4.01Å; L1152-F1158 HydrophobicContact CD2-CZ 3.25Å; L1152-F1158 HydrophobicContact CG-CZ 4.48Å; G1155-F1158 PolarHBondContact O-N 2.8Å; G1155-F1158 VanDerWaalsContact O-N 3.11Å; A1156-F1158 PolarHBondContact O-N 3.17Å; F1158-R1160 PolarHBondContact O-N 3.23Å
1159	R	66.3	Low	64.4	Low	209 Å²	209	82.1 Å²	82.1	79%	0.789	43%	0.429	S	S	*	.			trans	-72.4	92.1	176.2	-69.9	-176.4	175.5	-107.1	-6.5	110.4	A1156	A1156-R1159 PolarHBondContact O-N 2.82Å
1160	R	59	Low	63.2	Low	55 Å²	55	86 Å²	86	21%	0.208	45%	0.449	C	S	.	.			trans	-55.9	142.2	-179.8	-63.6	-175.8	-170.3	158	1.6	111.8	R337 D378 F1158 R1162	R337-R1160 VanDerWaalsContact CD-NH2 3.27Å; D378-R1160 IonicContact OD1-CZ 2.78Å; D378-R1160 IonicContact OD1-NH1 2.63Å; D378-R1160 PolarHBondContact OD1-NH1 3.29Å; D378-R1160 IonicContact OD1-NH2 2.87Å; D378-R1160 IonicContact OD2-NH1 2.85Å; D378-R1160 IonicContact OD2-NH2 3.04Å; D378-R1160 PolarHBondContact OD2-NH2 3.44Å; F1158-R1160 PolarHBondContact O-N 3.23Å; R1160-R1162 PolarHBondContact O-N 2.67Å
1161	K	47.9	Very low	61.9	Low	157 Å²	157	83 Å²	83	68%	0.683	44%	0.438	S	S	*	.			trans	-66.1	94.2	165.3	-73.3	172.6	-179.9	163.6	0	108.3	G1163	K1161-G1163 PolarHBondContact O-N 2.93Å
1162	R	42	Very low	60.6	Low	191 Å²	191	86.7 Å²	86.7	72%	0.721	45%	0.453	S	S	*	.			trans	-61.5	97.5	168.5	-76.3	-170.7	178.9	176.6	2.5	109.3	D377 R1160	D377-R1162 IonicContact OD1-CZ 2.65Å; D377-R1162 VanDerWaalsContact OD1-CZ 3.28Å; D377-R1162 IonicContact OD1-NE 2.75Å; D377-R1162 PolarHBondContact OD1-NE 3.11Å; D377-R1162 IonicContact OD1-NH2 3.17Å; D377-R1162 PolarHBondContact OD1-NH2 3.46Å; D377-R1162 IonicContact OD2-NE 2.67Å; R1160-R1162 PolarHBondContact O-N 2.67Å
1163	G	40	Very low	58.8	Low	54 Å²	54	92.5 Å²	92.5	56%	0.557	48%	0.483	S	S	*	.	P	Polyproline II helix	trans	-63.4	150.5	164.5	0	0	0	0	0	110	K1161 R1165	K1161-G1163 PolarHBondContact O-N 2.93Å; G1163-R1165 PolarHBondContact O-N 3.15Å
1164	P	35.2	Very low	56.9	Low	85 Å²	85	93.1 Å²	93.1	55%	0.552	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-67	130.1	172.9	28.8	-32.7	0	0	0	109.6	A1118	A1118-P1164 HydrophobicContact CB-CB 4Å; A1118-P1164 HydrophobicContact CB-CG 4.02Å
1165	R	37.6	Very low	54.9	Low	116 Å²	116	94.8 Å²	94.8	44%	0.438	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-59	155.6	168.6	-65.9	-178.9	-179.8	143.6	6.8	109.9	D380 D381 G1163	D380-R1165 VanDerWaalsContact C-NH2 3.32Å; D380-R1165 PolarHBondContact O-NH2 3.5Å; D380-R1165 IonicContact OD2-CZ 3.09Å; D380-R1165 IonicContact OD2-NH1 2.64Å; D380-R1165 PolarHBondContact OD2-NH1 3.41Å; D380-R1165 IonicContact OD2-NH2 3.72Å; D380-R1165 PolarHBondContact OD2-NH2 3.18Å; D381-R1165 IonicContact OD1-CZ 2.73Å; D381-R1165 IonicContact OD1-NE 3.59Å; D381-R1165 PolarHBondContact OD1-NE 3.01Å; D381-R1165 VanDerWaalsContact OD1-NE 3.13Å; D381-R1165 IonicContact OD1-NH2 3.62Å; D381-R1165 PolarHBondContact OD1-NH2 2.62Å; G1163-R1165 PolarHBondContact O-N 3.15Å
1166	Q	29.4	Very low	52.7	Low	162 Å²	162	102.2 Å²	102.2	76%	0.757	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-68	143.1	169.7	-55.4	-169.2	38.6	0	0	108.6
1167	A	32.1	Very low	50.2	Low	112 Å²	112	106.5 Å²	106.5	93%	0.926	53%	0.531	S	S	*	.			trans	-169	0	-175.6	0	0	0	0	0	111.4

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