A0A096NBP8_PAPAN Loading...

RNA-binding protein 44

Component of intercellular bridges during meiosis. Intercellular bridges are evolutionarily conserved structures that connect differentiating germ cells. Not required for fertility.

AlphaFold DB , UniProt , Accession A0A096NBP8, Species PAPAN (Papio anubis, Olive baboon), Gene RBM44, Length 1,055 aa.

						>A0A096NBP8_PAPAN|A0A096NBP8|RBM44
VMQATAVVETASGKGYHSNGGNLQKDKPSNPKKENLLLSSNGCDEVKLTFPDDDWDSSTLEQRANNKEINNIDKMDLLEPFFSVSQDTNTESTHFQSSELEDSTDYAFLNETYSIHYPESKLKKESLISLSSELDLEVQKKEEVFFDILEHQDKTVGLERIYNISDANYRESAEDTQKHDTDEDSQQEYHSAEEQEYISNHLSFDQTKTLGISNPEVVELRNLGYEVKCASNVEDNHVNSGSGSIISSDSFDVYGQEESLHVSKFQNSVMLREYHDLKHEKCKEKETSSVYHTVFDGSVLRSNSPGNQESQSKSGSLSPQKVLKMKTYTEHMKSQINESKDFCGNKIAENKILLHLENPSTLPQDKALETLPQPCKDCQTSWTSVFDDSIISACGYSHYESLQNTPDSALDFSAMLPKIAVRNNQAIEDNTCLKVAHSSTTKKTCFHNTEGTCTNSLTDAASCTVTINQTVDVSTDFRACFTTSRATSARPSVVSTSSNTDITMMNKKRPDEWQNEKQKSVACSTDWSYSEDCIDTQMAMTKGSGKSPSVDSLKPNGNFLNKDFLELRKPCGITDLKKHPEREVQLFKDTEKDLPSMCCQKIMQRAINAELHLLNVHYQMCRRHCCDIYKLVMENREGLNMNLSSNSAKKEVGSALLSLLGDLKVRYVTLKEKIHKGIPLEELPPLSVESKLLSTFSTFASRLMKKETHVFSEADAERDDQRTQDFDVSSNLKKTISQMSLSSDNSRATQNISPKKDDFKNGDINADFSQLKLDDKDCRHYQEMSEDWSDAKENLTGVDISGTQENQIEQDRWNLDLTLEMKNVEPSQRDKGYLIHVGGLCPSVSEADLRSHFQKYQVSEISIYDSSTNYRYASLTFTKNSDAKIAVKEMNGIEINGKSVNVRPVKILGEYTSPLSSKNGNRISSNNLEKSTNKEIHSAFSISRLPRTRPRQLGSEQDSEVFPSNQGVKKNCKQIESAKLLPDTPVQFIPPNTLNLRSFTKIIKKLAELHPEVSRDHIINALQEVRMRHKGFLNGLSINTIVEMTSSLLKNSASS
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	V	33.8	Very low	32.7	Very low	192 Å²	192	140.3 Å²	140.3	100%	1.164	84%	0.843	S	S	*	*				0	127.6	0	175.6	0	0	0	0	108
2	M	36.2	Very low	32.6	Very low	178 Å²	178	139.3 Å²	139.3	88%	0.877	85%	0.848	S	S	*	*			trans	-93.7	140.8	165.4	-85.9	-179.5	156.6	0	0	109.4
3	Q	34.3	Very low	32.3	Very low	188 Å²	188	133.4 Å²	133.4	88%	0.879	83%	0.832	S	S	*	*			trans	172.6	157.1	154.2	-97.6	149.4	22.3	0	0	107.9
4	A	33.7	Very low	32.3	Very low	79 Å²	79	138.8 Å²	138.8	65%	0.653	84%	0.837	S	S	*	*			cis	-143.1	135.9	8.8	0	0	0	0	0	108.4
5	T	33.6	Very low	32	Very low	133 Å²	133	134 Å²	134	82%	0.816	83%	0.827	S	S	*	*				43	132.5	89.8	56.1	0	0	0	0	115.4
6	A	31.8	Very low	32	Very low	90 Å²	90	137.4 Å²	137.4	74%	0.744	82%	0.822	S	S	*	*			cis	-157.2	171.6	-2	0	0	0	0	0	111.2
7	V	32.2	Very low	32	Very low	151 Å²	151	138.8 Å²	138.8	92%	0.915	82%	0.818	S	S	*	*	P	Polyproline II helix	trans	-88.9	147.7	178.7	177.1	0	0	0	0	111.3
8	V	32.5	Very low	32	Very low	137 Å²	137	135.8 Å²	135.8	83%	0.83	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-93.7	154.8	-166.8	172.9	0	0	0	0	113.7
9	E	30	Very low	32	Very low	163 Å²	163	137.5 Å²	137.5	76%	0.762	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-79.5	160.2	-174	-80.7	-174.2	102.6	0	0	117.6
10	T	30.2	Very low	31.8	Very low	134 Å²	134	134.3 Å²	134.3	82%	0.822	81%	0.807	S	S	*	*			trans	70	155.8	145.2	55.3	0	0	0	0	121.2
11	A	31.7	Very low	31.7	Very low	98 Å²	98	131.7 Å²	131.7	81%	0.81	81%	0.808	S	S	*	*			trans	-122.4	149.7	172.7	0	0	0	0	0	110.4
12	S	31.2	Very low	31.6	Very low	129 Å²	129	129.8 Å²	129.8	90%	0.902	79%	0.791	S	S	*	*			trans	177	138.2	145.5	-174.3	0	0	0	0	112.8
13	G	28.3	Very low	31.4	Very low	62 Å²	62	127.8 Å²	127.8	64%	0.639	78%	0.784	S	S	*	*				115.2	90.7	126.9	0	0	0	0	0	121.9
14	K	32.7	Very low	31.4	Very low	209 Å²	209	125.1 Å²	125.1	91%	0.909	77%	0.771	S	S	*	*			trans	64.1	124	132.6	-64.7	178.9	175.9	177.1	0	123
15	G	28.4	Very low	31.1	Very low	67 Å²	67	129 Å²	129	69%	0.691	77%	0.773	S	S	*	*			trans	98.4	155	131.4	0	0	0	0	0	117.5
16	Y	31	Very low	30.8	Very low	189 Å²	189	129.7 Å²	129.7	74%	0.741	77%	0.772	S	S	*	*			cis	-167.8	147.4	-5.9	-113.1	-63.5	0	0	0	110.9
17	H	32	Very low	30.9	Very low	161 Å²	161	134.7 Å²	134.7	75%	0.745	78%	0.777	S	S	*	*			trans	62.5	162.3	153.4	-68.2	-43.1	0	0	0	119.8
18	S	31.7	Very low	31.8	Very low	85 Å²	85	132.8 Å²	132.8	59%	0.594	77%	0.767	S	S	*	*			cis	-167.6	162.1	-26.5	55.8	0	0	0	0	110.8
19	N	32	Very low	31.6	Very low	167 Å²	167	132 Å²	132	89%	0.893	77%	0.768	S	S	*	*			trans	56	150	159.1	-60	-7.3	0	0	0	120.2
20	G	29	Very low	31.4	Very low	74 Å²	74	131.4 Å²	131.4	76%	0.763	77%	0.77	S	S	*	*			cis	160	130.3	-10.1	0	0	0	0	0	114
21	G	29.6	Very low	32.4	Very low	80 Å²	80	130 Å²	130	83%	0.825	76%	0.763	S	S	*	*			trans	78.1	171.3	167.6	0	0	0	0	0	116.7
22	N	32.2	Very low	32.3	Very low	151 Å²	151	134.1 Å²	134.1	81%	0.807	76%	0.763	S	S	*	*			cis	-166.5	-176.8	-15.9	-160.4	-10.5	0	0	0	108.5
23	L	31.8	Very low	32.3	Very low	137 Å²	137	136.3 Å²	136.3	72%	0.717	76%	0.756	S	S	*	*			trans	75.8	151.3	166.9	-54.7	173.6	0	0	0	116.9
24	Q	33.6	Very low	32.3	Very low	131 Å²	131	139.7 Å²	139.7	61%	0.612	76%	0.755	S	S	*	*			cis	-168.1	143.1	-38.7	-128.3	-175.7	38.1	0	0	108.6
25	K	28.6	Very low	32.5	Very low	161 Å²	161	136.7 Å²	136.7	70%	0.7	75%	0.749	S	S	*	*			trans	65.3	161.5	154.3	-72.4	167.7	-174.8	157.6	0	117
26	D	26.8	Very low	32.8	Very low	148 Å²	148	142.1 Å²	142.1	79%	0.791	76%	0.761	S	S	*	*			cis	-137.1	171.1	9.1	-112.3	-37.3	0	0	0	114
27	K	33.1	Very low	32.7	Very low	195 Å²	195	141.3 Å²	141.3	85%	0.848	77%	0.769	S	S	*	*			trans	-120.2	178.8	164.8	-108.3	-179.6	179.5	176.8	0	106.9
28	P	51.8	Low	32.9	Very low	110 Å²	110	142.3 Å²	142.3	71%	0.714	78%	0.779	S	S	*	*			cis	-147.1	-164.2	21.6	41	-18.4	0	0	0	116.6
29	S	27.9	Very low	32.7	Very low	120 Å²	120	143.8 Å²	143.8	84%	0.839	79%	0.789	S	S	*	*			trans	107.3	139	138.6	73.4	0	0	0	0	121.3
30	N	26.7	Very low	32.5	Very low	152 Å²	152	140.4 Å²	140.4	81%	0.813	78%	0.779	S	S	*	*			trans	-105.1	177.1	-178.4	-126.2	-19.9	0	0	0	108.1
31	P	50.5	Low	32.4	Very low	104 Å²	104	144.3 Å²	144.3	68%	0.675	78%	0.782	S	S	*	*			cis	-157.1	-179.2	39.9	45.6	-24.1	0	0	0	120
32	K	29.1	Very low	32.1	Very low	184 Å²	184	143.8 Å²	143.8	80%	0.8	78%	0.777	S	S	*	*			trans	84.7	120.2	154.8	-65.9	176.5	-178.5	176.3	0	121.3
33	K	31.3	Very low	31.8	Very low	175 Å²	175	143 Å²	143	76%	0.761	78%	0.782	S	S	*	*			trans	65.7	147.2	147.7	-77.4	-171.5	168	-134.3	0	118
34	E	28.8	Very low	31.7	Very low	133 Å²	133	144.7 Å²	144.7	62%	0.621	79%	0.791	S	S	*	*			cis	-151.5	144.5	-2.8	-145.8	144.4	-139.5	0	0	111.9
35	N	36.6	Very low	31.5	Very low	146 Å²	146	147.1 Å²	147.1	78%	0.781	80%	0.803	S	S	*	*			trans	32.7	105.6	160.7	-59.7	-12.5	0	0	0	121.9
36	L	34.9	Very low	31.5	Very low	181 Å²	181	146.5 Å²	146.5	95%	0.948	81%	0.812	S	S	*	*			trans	-159.6	146.6	143.7	-105.1	157.2	0	0	0	108.6
37	L	29.1	Very low	31.7	Very low	173 Å²	173	148.3 Å²	148.3	91%	0.906	81%	0.813	S	S	*	*			trans	-109.4	126	-162.2	-72.3	167.5	0	0	0	114.3
38	L	35.2	Very low	31.3	Very low	181 Å²	181	145.9 Å²	145.9	95%	0.948	81%	0.809	S	S	*	*			trans	-166.4	125.8	160.1	-109.5	172.1	0	0	0	111.2
39	S	27.2	Very low	29.9	Very low	116 Å²	116	145.8 Å²	145.8	81%	0.811	81%	0.806	S	S	*	*			trans	178.7	154.3	172.2	179.9	0	0	0	0	108
40	S	28.1	Very low	29.7	Very low	97 Å²	97	149.4 Å²	149.4	68%	0.678	81%	0.807	S	S	*	*			cis	157.4	146.9	-23.1	173.5	0	0	0	0	106.3
41	N	27.4	Very low	30.7	Very low	156 Å²	156	146.4 Å²	146.4	83%	0.834	80%	0.796	S	S	*	*			trans	-14.6	136.4	170.4	-56.8	-9.6	0	0	0	119.9
42	G	23.4	Very low	29.7	Very low	68 Å²	68	147.9 Å²	147.9	70%	0.701	80%	0.798	S	S	*	*				86.7	114.5	102.8	0	0	0	0	0	120.4
43	C	26.7	Very low	29.7	Very low	136 Å²	136	144.7 Å²	144.7	92%	0.919	79%	0.79	S	S	*	*			trans	64.9	129.6	156.5	-58.3	0	0	0	0	119.7
44	D	28.1	Very low	30	Very low	172 Å²	172	141.9 Å²	141.9	92%	0.92	78%	0.783	S	S	*	*				-155.3	166.2	111.1	-127.2	-20.1	0	0	0	112.1
45	E	31	Very low	30.1	Very low	182 Å²	182	145.8 Å²	145.8	85%	0.85	79%	0.792	S	S	*	*			trans	-109.8	124.6	-166.1	-178.9	-176.2	-146	0	0	113.7
46	V	28	Very low	29.6	Very low	148 Å²	148	145 Å²	145	90%	0.897	79%	0.788	S	S	*	*			trans	-139.3	152.8	168.3	-174.9	0	0	0	0	110.9
47	K	29.8	Very low	29	Very low	185 Å²	185	140.3 Å²	140.3	80%	0.804	77%	0.77	S	S	*	*			trans	-116.1	160.9	-161.1	-159.5	-178.3	-173.9	171	0	112.7
48	L	25.3	Very low	28.8	Very low	145 Å²	145	136.4 Å²	136.4	76%	0.759	76%	0.758	S	S	*	*			trans	91.1	123.5	163.7	-66.9	164.3	0	0	0	119.7
49	T	23	Very low	28.3	Very low	107 Å²	107	133.5 Å²	133.5	66%	0.656	75%	0.747	S	S	*	*			trans	57.6	114.3	142.7	54.5	0	0	0	0	121.2
50	F	23.3	Very low	28	Very low	196 Å²	196	135.2 Å²	135.2	86%	0.86	75%	0.747	S	S	*	*				49.3	151.8	121.8	-73.7	-60.5	0	0	0	121.5
51	P	46.8	Very low	27.9	Very low	90 Å²	90	138.1 Å²	138.1	58%	0.584	75%	0.749	S	S	*	*			cis	-134.4	-160.3	-11.4	38.6	-17.9	0	0	0	112.3
52	D	29.6	Very low	27.8	Very low	135 Å²	135	138.8 Å²	138.8	72%	0.722	75%	0.748	S	S	*	*			trans	60.4	136.4	153.6	-53.5	-14	0	0	0	119.2
53	D	30.2	Very low	27.8	Very low	117 Å²	117	146.5 Å²	146.5	63%	0.626	76%	0.756	S	S	*	*			cis	-155.7	178.5	-1.2	-130.3	-27.1	0	0	0	112.9
54	D	36.9	Very low	27.8	Very low	115 Å²	115	143.7 Å²	143.7	62%	0.615	74%	0.742	S	S	*	*			trans	63.8	94.9	166.1	-64.3	-18.4	0	0	0	117.2
55	W	30.4	Very low	27.7	Very low	215 Å²	215	142.1 Å²	142.1	81%	0.814	73%	0.734	S	S	*	*				83.9	131.6	72.4	-69.1	14.2	0	0	0	113.1
56	D	26.9	Very low	27.8	Very low	130 Å²	130	139.7 Å²	139.7	70%	0.695	73%	0.726	S	S	*	*			cis	-153	159.8	-12.9	-145.2	-8.2	0	0	0	113.5
57	S	23.4	Very low	27.8	Very low	82 Å²	82	140 Å²	140	57%	0.573	72%	0.716	S	S	*	*			trans	-12.2	137	144.2	-50.4	0	0	0	0	116.1
58	S	24.4	Very low	27.8	Very low	92 Å²	92	138.2 Å²	138.2	64%	0.643	71%	0.71	S	S	*	*			cis	74.7	144.5	39.7	98.2	0	0	0	0	115.9
59	T	23.4	Very low	28	Very low	119 Å²	119	138.4 Å²	138.4	73%	0.73	71%	0.71	S	S	*	*			trans	68.7	156.1	159.6	60.7	0	0	0	0	120.2
60	L	21.5	Very low	28	Very low	153 Å²	153	139.4 Å²	139.4	80%	0.801	71%	0.712	S	S	*	*			trans	64.9	155.3	176.2	-87	63.2	0	0	0	115.4
61	E	26.6	Very low	28.2	Very low	157 Å²	157	136 Å²	136	73%	0.734	70%	0.702	S	S	*	*			cis	-134.6	125.8	-1	-154	164.9	-148.3	0	0	113.9	R63	E61-R63 PolarHBondContact O-N 3.4Å
62	Q	24	Very low	27.3	Very low	170 Å²	170	138.3 Å²	138.3	79%	0.794	71%	0.709	S	S	*	*			trans	-23.8	109.1	144.3	173.9	-164.9	79.8	0	0	115.5
63	R	24.1	Very low	27.2	Very low	231 Å²	231	137.2 Å²	137.2	87%	0.872	70%	0.703	S	S	*	*			trans	-172.5	146	133	-113	169.6	-171	171.9	6.6	116.3	E61	E61-R63 PolarHBondContact O-N 3.4Å
64	A	26.6	Very low	27.1	Very low	77 Å²	77	139.6 Å²	139.6	64%	0.636	71%	0.708	S	S	*	*			trans	64.5	139.3	144.7	0	0	0	0	0	119
65	N	27.2	Very low	26.6	Very low	138 Å²	138	141.7 Å²	141.7	74%	0.738	72%	0.716	S	S	*	*			cis	-160.6	162.2	-7.9	-116.5	-8.1	0	0	0	111
66	N	31.5	Very low	26.4	Very low	131 Å²	131	137.5 Å²	137.5	70%	0.701	71%	0.709	S	S	*	*			trans	67	105.6	164.6	-56.6	-21	0	0	0	115.2
67	K	29.6	Very low	26.5	Very low	155 Å²	155	138.2 Å²	138.2	67%	0.674	71%	0.712	S	S	*	*				75.1	103.7	77.7	-79.7	-169.7	161.1	-77.2	0	111.5
68	E	28.3	Very low	26.7	Very low	147 Å²	147	141.1 Å²	141.1	69%	0.687	72%	0.721	S	S	*	*				75.9	164.5	80.4	-78.9	-175.3	140.1	0	0	113
69	I	29.2	Very low	26.9	Very low	149 Å²	149	145 Å²	145	76%	0.764	73%	0.729	S	S	*	*			trans	80.8	124.9	173.9	-48.3	172.6	0	0	0	113.1
70	N	24.9	Very low	27.9	Very low	128 Å²	128	143.2 Å²	143.2	68%	0.684	72%	0.719	S	S	*	*			cis	176.5	168.7	-31.2	-106.9	-5.9	0	0	0	106.3
71	N	27.7	Very low	28	Very low	124 Å²	124	143.9 Å²	143.9	66%	0.663	72%	0.716	S	S	*	*			trans	70.9	141.3	154.4	-66.7	-0.8	0	0	0	116.5
72	I	27	Very low	28	Very low	140 Å²	140	145.3 Å²	145.3	72%	0.718	72%	0.72	S	S	*	*			cis	83.4	134.4	40.8	-63.3	164.7	0	0	0	112.5
73	D	27.7	Very low	28.1	Very low	112 Å²	112	142 Å²	142	60%	0.599	72%	0.715	S	S	*	*			trans	87.9	99.7	161.5	-84.4	10.9	0	0	0	122.4
74	K	26.8	Very low	28.2	Very low	166 Å²	166	137.3 Å²	137.3	72%	0.722	71%	0.712	S	S	*	*				78.9	162.2	110.5	-75.1	-175.7	-173.8	82.3	0	121.5
75	M	27.9	Very low	28.3	Very low	160 Å²	160	137.4 Å²	137.4	79%	0.788	71%	0.708	S	S	*	*			trans	83.6	94.6	157	-83.6	176.8	156.7	0	0	119.5
76	D	25.3	Very low	28.6	Very low	127 Å²	127	138.5 Å²	138.5	68%	0.679	71%	0.709	S	S	*	*				68.2	124.4	105.7	-67.2	-10	0	0	0	121.9
77	L	28.5	Very low	28.5	Very low	144 Å²	144	137.9 Å²	137.9	75%	0.754	71%	0.706	S	S	*	*			trans	78.4	125.8	132	-70.5	170.8	0	0	0	121
78	L	28.3	Very low	28.5	Very low	144 Å²	144	136.1 Å²	136.1	75%	0.754	71%	0.708	S	S	*	*			trans	77.9	107.3	145.5	-61.6	163.9	0	0	0	118.9
79	E	29	Very low	28.5	Very low	174 Å²	174	136.6 Å²	136.6	81%	0.813	72%	0.715	S	S	*	*				8.7	167.9	101.4	-98	-161.1	179.2	0	0	119.2
80	P	43.8	Very low	28.5	Very low	81 Å²	81	135.9 Å²	135.9	53%	0.526	72%	0.718	S	S	.	*			cis	-145.1	-168	21.8	19.2	11.3	0	0	0	116.6
81	F	24	Very low	28.6	Very low	166 Å²	166	138.5 Å²	138.5	73%	0.728	73%	0.726	S	S	*	*			trans	87.8	99.4	152.3	-62.6	-58.1	0	0	0	122.2
82	F	26	Very low	28.7	Very low	188 Å²	188	137.3 Å²	137.3	83%	0.825	73%	0.728	S	S	*	*				40	137.3	105.3	-74.1	-95.4	0	0	0	118.5
83	S	26.3	Very low	28.7	Very low	99 Å²	99	136.3 Å²	136.3	69%	0.692	73%	0.728	S	S	*	*				177.2	165.4	63.1	49.1	0	0	0	0	113.1
84	V	27.7	Very low	28.8	Very low	134 Å²	134	138.7 Å²	138.7	81%	0.812	74%	0.735	S	S	*	*			trans	52.4	145.7	134.2	165	0	0	0	0	120.9
85	S	28.4	Very low	28.7	Very low	79 Å²	79	139 Å²	139	55%	0.552	74%	0.737	S	S	*	*			cis	-179.4	158.6	-32.7	62.6	0	0	0	0	109.2
86	Q	33.1	Very low	28.8	Very low	161 Å²	161	139.3 Å²	139.3	75%	0.752	74%	0.736	S	S	*	*			trans	65.4	165.7	158.8	-76.6	-179.3	-98.5	0	0	116.1
87	D	28.4	Very low	28.9	Very low	118 Å²	118	137.6 Å²	137.6	63%	0.631	73%	0.734	S	S	*	*			cis	-158.8	179.3	1.2	-119.6	-5.2	0	0	0	110.7
88	T	29.8	Very low	28.9	Very low	118 Å²	118	135.7 Å²	135.7	72%	0.724	73%	0.733	S	S	*	*			trans	75.1	158.3	161.8	76.3	0	0	0	0	119.4
89	N	28.2	Very low	29.2	Very low	157 Å²	157	137.1 Å²	137.1	84%	0.84	74%	0.736	S	S	*	*			cis	-162.4	169.6	-31.7	-97.6	-17.9	0	0	0	111.4
90	T	28.9	Very low	29.1	Very low	134 Å²	134	136.7 Å²	136.7	82%	0.822	74%	0.739	S	S	*	*			trans	-98.1	150.5	178.6	37.9	0	0	0	0	115.7
91	E	28.3	Very low	28.5	Very low	182 Å²	182	141.4 Å²	141.4	85%	0.85	75%	0.753	S	S	*	*			trans	-164.5	132	151.8	-134	178.8	-175.4	0	0	117.2
92	S	28.5	Very low	28.6	Very low	100 Å²	100	140.1 Å²	140.1	70%	0.699	75%	0.754	S	S	*	*			trans	61.3	163.6	149.2	81.8	0	0	0	0	121.6
93	T	28.1	Very low	28.6	Very low	118 Å²	118	135.3 Å²	135.3	72%	0.724	74%	0.744	S	S	*	*			cis	-158.7	137.2	-1.3	-3.2	0	0	0	0	114.5
94	H	29.3	Very low	28.7	Very low	162 Å²	162	137 Å²	137	75%	0.75	75%	0.75	S	S	*	*			trans	38.7	159.4	141.8	-78.5	-78.5	0	0	0	129.4
95	F	25.8	Very low	28.6	Very low	173 Å²	173	137.8 Å²	137.8	76%	0.759	75%	0.75	S	S	*	*			trans	87.2	121.2	168.2	-57.9	-76.8	0	0	0	117.3
96	Q	28.5	Very low	28.5	Very low	166 Å²	166	145 Å²	145	78%	0.776	77%	0.766	S	S	*	*				76.1	135.8	54.2	-80.6	-168.4	-63	0	0	115.3
97	S	28.7	Very low	28.2	Very low	91 Å²	91	140.8 Å²	140.8	64%	0.636	76%	0.76	S	S	*	*			cis	-178.4	160.8	-26	42.2	0	0	0	0	110.4
98	S	28.7	Very low	28.1	Very low	105 Å²	105	144.7 Å²	144.7	73%	0.734	77%	0.771	S	S	*	*			trans	72.3	150.2	169.4	92.1	0	0	0	0	117.4
99	E	33.2	Very low	28.1	Very low	173 Å²	173	146.3 Å²	146.3	81%	0.808	78%	0.775	S	S	*	*			cis	-162.7	137.2	-7.6	-132.6	161.4	-128.1	0	0	111.8
100	L	26.9	Very low	28.1	Very low	166 Å²	166	144.4 Å²	144.4	87%	0.869	76%	0.764	S	S	*	*				-177.1	159.2	127.9	-127.7	79.9	0	0	0	111.9
101	E	30.8	Very low	28	Very low	179 Å²	179	142.6 Å²	142.6	84%	0.836	75%	0.747	S	S	*	*			trans	-84.5	172.6	174.7	-55.6	162.3	129.4	0	0	110.2
102	D	26.9	Very low	28	Very low	140 Å²	140	138.6 Å²	138.6	75%	0.749	74%	0.735	S	S	*	*			cis	-160.2	161.2	18.5	-163.8	8	0	0	0	113.5
103	S	26.1	Very low	27.9	Very low	87 Å²	87	142.4 Å²	142.4	61%	0.608	74%	0.735	S	S	*	*			trans	79.2	148.3	147.9	80.6	0	0	0	0	123.3
104	T	27.5	Very low	27.8	Very low	134 Å²	134	141.3 Å²	141.3	82%	0.822	73%	0.732	S	S	*	*			trans	73.8	81.6	165.1	56.8	0	0	0	0	119.8
105	D	26.5	Very low	27.6	Very low	150 Å²	150	140.7 Å²	140.7	80%	0.802	73%	0.733	S	S	*	*			trans	-58.4	147.4	152.3	-63.3	-81.1	0	0	0	112.9
106	Y	26.4	Very low	27.4	Very low	230 Å²	230	140.2 Å²	140.2	90%	0.902	73%	0.733	S	S	*	*			trans	-148.8	101.3	136.2	-119.8	-73.9	0	0	0	110.4
107	A	27	Very low	27.2	Very low	74 Å²	74	141.7 Å²	141.7	61%	0.612	73%	0.732	S	S	*	*			trans	-96	139	-179.7	0	0	0	0	0	111.9
108	F	25.8	Very low	27.1	Very low	200 Å²	200	143.7 Å²	143.7	88%	0.877	74%	0.743	S	S	*	*			trans	-138	95	151.4	-104	-73.7	0	0	0	109.6
109	L	29.8	Very low	26.9	Very low	152 Å²	152	146.6 Å²	146.6	80%	0.796	75%	0.745	S	S	*	*			trans	-74.3	126	158.9	-69	168	0	0	0	106.8
110	N	28	Very low	26.7	Very low	116 Å²	116	143 Å²	143	62%	0.62	74%	0.739	S	S	*	*				79.2	114.1	59.7	177.7	56.7	0	0	0	113.1
111	E	27.3	Very low	26.6	Very low	97 Å²	97	144.3 Å²	144.3	45%	0.453	74%	0.738	S	S	.	*			trans	-167.5	115.3	140.5	-100.5	-178.7	150.3	0	0	106.2	S488	E111-S488 VanDerWaalsContact CD-CB 3.5Å; E111-S488 WeakPolarHBondContact OE1-CB 3.36Å; E111-S488 PolarHBondContact OE1-OG 3.06Å; E111-S488 WeakPolarHBondContact OE2-CA 3.37Å; E111-S488 WeakPolarHBondContact OE2-CB 3.44Å; E111-S488 PolarHBondContact OE2-N 2.8Å; E111-S488 PolarHBondContact OE2-OG 2.99Å
112	T	28.4	Very low	26.3	Very low	97 Å²	97	143.6 Å²	143.6	60%	0.595	74%	0.739	S	S	*	*				73.1	103.3	64.5	-61.4	0	0	0	0	113.5
113	Y	25.3	Very low	26.3	Very low	181 Å²	181	146.2 Å²	146.2	71%	0.71	74%	0.744	S	S	*	*				-151.6	107.3	129.9	-117.1	-76	0	0	0	110.7	I115 R490	Y113-I115 HydrophobicContact CD1-CG1 4.46Å; Y113-R490 PolarHBondContact OH-NH2 3.36Å; Y113-R490 VanDerWaalsContact OH-NH2 3.09Å
114	S	26.3	Very low	26.2	Very low	94 Å²	94	150.3 Å²	150.3	66%	0.657	75%	0.751	S	S	*	*			trans	-103.7	132.4	166.2	-66.7	0	0	0	0	109.1
115	I	24.9	Very low	26	Very low	150 Å²	150	151.4 Å²	151.4	77%	0.769	75%	0.746	S	S	*	*			trans	-126.2	88.7	157.5	-58	-180	0	0	0	104.5	Y113	Y113-I115 HydrophobicContact CD1-CG1 4.46Å
116	H	22.8	Very low	26	Very low	162 Å²	162	149.2 Å²	149.2	75%	0.75	74%	0.743	S	S	*	*				61.2	108.4	91	-81.4	-79.2	0	0	0	113.9
117	Y	23.9	Very low	26	Very low	197 Å²	197	145.8 Å²	145.8	77%	0.773	74%	0.739	S	S	*	*			trans	-54	149.5	164.2	-84.2	-115.9	0	0	0	112.3	E119	Y117-E119 VanDerWaalsContact C-N 3.32Å; Y117-E119 HydrophobicContact CD1-CG 4.45Å; Y117-E119 PolarHBondContact O-N 3.06Å
118	P	26.5	Very low	26	Very low	133 Å²	133	149.2 Å²	149.2	86%	0.864	75%	0.746	S	S	*	*			trans	-82.6	76.2	148.9	35	-31	0	0	0	110.6
119	E	24	Very low	26	Very low	166 Å²	166	143.9 Å²	143.9	78%	0.776	73%	0.733	S	S	*	*			trans	-90.5	141.9	148.6	-81.2	-162.6	154.4	0	0	108	Y117	Y117-E119 VanDerWaalsContact C-N 3.32Å; Y117-E119 HydrophobicContact CD1-CG 4.45Å; Y117-E119 PolarHBondContact O-N 3.06Å
120	S	29.5	Very low	25.9	Very low	98 Å²	98	144.6 Å²	144.6	69%	0.685	74%	0.737	S	S	*	*			cis	-162.1	168.2	-8.3	57.1	0	0	0	0	108.7
121	K	24.2	Very low	25.7	Very low	193 Å²	193	144 Å²	144	84%	0.839	74%	0.742	S	S	*	*			trans	-164.7	126.5	139.6	-112.9	161.9	-171.7	175.4	0	115
122	L	25	Very low	25.9	Very low	165 Å²	165	144.6 Å²	144.6	86%	0.864	76%	0.757	S	S	*	*			trans	68.5	128.7	150	-73.7	161.7	0	0	0	121.2
123	K	26.1	Very low	25.7	Very low	195 Å²	195	149 Å²	149	85%	0.848	77%	0.771	S	S	*	*			trans	-73.7	140.5	170.2	-51.1	162	179.3	175.8	0	110.8
124	K	23.9	Very low	25.8	Very low	173 Å²	173	147.3 Å²	147.3	75%	0.752	77%	0.773	S	S	*	*			trans	179.8	130.7	131.8	-99.8	170.7	172.5	-84.3	0	107.3
125	E	24.9	Very low	25.8	Very low	156 Å²	156	149.3 Å²	149.3	73%	0.729	78%	0.776	S	S	*	*				61.3	110.9	79.3	-169.7	-178.7	-114.2	0	0	109.9
126	S	26.1	Very low	25.9	Very low	104 Å²	104	148.8 Å²	148.8	73%	0.727	78%	0.775	S	S	*	*			cis	-143.8	-173.5	7.4	57.3	0	0	0	0	108.8
127	L	26.1	Very low	26.1	Very low	158 Å²	158	148.1 Å²	148.1	83%	0.827	77%	0.772	S	S	*	*			cis	-167.4	-177.8	47.4	-132.4	169.4	0	0	0	110.5
128	I	26.8	Very low	26.5	Very low	146 Å²	146	144.8 Å²	144.8	75%	0.749	77%	0.772	S	S	*	*			trans	-121.4	128.3	-169.3	-73.2	169	0	0	0	111.2
129	S	25.9	Very low	26.7	Very low	88 Å²	88	144.6 Å²	144.6	62%	0.615	76%	0.759	S	S	*	*			trans	46.4	139.1	152	79.4	0	0	0	0	123.1
130	L	28.2	Very low	27.1	Very low	168 Å²	168	145.1 Å²	145.1	88%	0.88	76%	0.759	S	S	*	*			trans	65.3	153.9	143.2	-64.8	163.9	0	0	0	117.1
131	S	24.6	Very low	27	Very low	104 Å²	104	148 Å²	148	73%	0.727	76%	0.759	S	S	*	*			cis	-148	165.1	2.7	45.2	0	0	0	0	112.3
132	S	30.6	Very low	27.2	Very low	109 Å²	109	144.8 Å²	144.8	76%	0.762	75%	0.747	S	S	*	*			trans	-22.1	147.8	166.2	55.2	0	0	0	0	120.7
133	E	24.5	Very low	27.2	Very low	188 Å²	188	143.5 Å²	143.5	88%	0.879	74%	0.737	S	S	*	*				-144	176.4	128.3	-155.3	144.1	-140.4	0	0	111.5
134	L	27.8	Very low	27.2	Very low	147 Å²	147	139.4 Å²	139.4	77%	0.77	73%	0.728	S	S	*	*			trans	-89.4	-176.6	-156.1	-63.2	153.7	0	0	0	112.8
135	D	24.8	Very low	27.2	Very low	135 Å²	135	139 Å²	139	72%	0.722	73%	0.726	S	S	*	*			cis	-162.2	-169.8	20.3	-150.5	-13.2	0	0	0	113.5
136	L	27	Very low	27.3	Very low	140 Å²	140	138.6 Å²	138.6	73%	0.733	72%	0.722	S	S	*	*			trans	90.1	87.6	169.3	-66.3	164.5	0	0	0	118.1
137	E	27.9	Very low	27.3	Very low	147 Å²	147	139.9 Å²	139.9	69%	0.687	72%	0.721	S	S	*	*				41	143.2	113.5	-56.6	-171.9	128.7	0	0	119.8
138	V	31.6	Very low	27.4	Very low	127 Å²	127	139.8 Å²	139.8	77%	0.77	72%	0.72	S	S	*	*			cis	-139.8	115.3	32	170.5	0	0	0	0	107.8
139	Q	31.9	Very low	27.4	Very low	129 Å²	129	140.2 Å²	140.2	60%	0.603	72%	0.723	S	S	*	*				82.7	95.2	71.3	-172.8	-170	-11.9	0	0	116
140	K	30.8	Very low	27.3	Very low	178 Å²	178	144.8 Å²	144.8	77%	0.774	74%	0.735	S	S	*	*			trans	66.1	165.5	140.2	-56.8	175.2	-171.5	169.8	0	116.9
141	K	28.2	Very low	27.2	Very low	157 Å²	157	145.4 Å²	145.4	68%	0.683	73%	0.732	S	S	*	*			cis	-147.1	161.3	16.7	-153.9	177	175.9	-151.6	0	114.2
142	E	28.7	Very low	27.3	Very low	127 Å²	127	148.6 Å²	148.6	59%	0.593	74%	0.736	S	S	*	*			trans	-33.4	176.3	168.5	-69	129.7	130.5	0	0	118.3
143	E	25.4	Very low	27.1	Very low	138 Å²	138	148.4 Å²	148.4	65%	0.645	73%	0.726	S	S	*	*			cis	-153.1	138.7	29.7	-122.4	113.4	-156.6	0	0	110
144	V	25.3	Very low	27.2	Very low	108 Å²	108	147.3 Å²	147.3	66%	0.655	72%	0.719	S	S	*	*				70.3	102	86.2	166.8	0	0	0	0	113.1
145	F	24.2	Very low	27	Very low	164 Å²	164	146.5 Å²	146.5	72%	0.719	72%	0.72	S	S	*	*				74.9	160	104.1	-75.9	-60.7	0	0	0	115.5
146	F	27.6	Very low	27.2	Very low	148 Å²	148	146.2 Å²	146.2	65%	0.649	72%	0.723	S	S	*	*			cis	-156.9	159.2	3	-120.1	-49.4	0	0	0	110.7
147	D	25.3	Very low	27.1	Very low	131 Å²	131	142.8 Å²	142.8	70%	0.701	72%	0.721	S	S	*	*			trans	61	169.9	152	-58.2	-30.7	0	0	0	119.3
148	I	27.4	Very low	27.2	Very low	156 Å²	156	142.5 Å²	142.5	80%	0.8	72%	0.724	S	S	*	*			cis	-135.1	141.5	16.4	-67.8	170.1	0	0	0	113.1
149	L	26.9	Very low	26.9	Very low	155 Å²	155	139.7 Å²	139.7	81%	0.812	70%	0.702	S	S	*	*			trans	1.6	138.3	144.1	-146	82.4	0	0	0	120.3
150	E	24.7	Very low	26.8	Very low	185 Å²	185	140.3 Å²	140.3	86%	0.864	70%	0.699	S	S	*	*				-165.6	171.5	112.5	-124	-177.7	-179.6	0	0	114
151	H	26.8	Very low	26.7	Very low	180 Å²	180	138.1 Å²	138.1	83%	0.833	69%	0.694	S	S	*	*			trans	-148.4	154.5	-168.1	-130.5	1.7	0	0	0	112.4
152	Q	26.9	Very low	26.4	Very low	171 Å²	171	138.5 Å²	138.5	80%	0.799	69%	0.693	S	S	*	*			trans	91.7	137.7	166.1	-61.5	-166.3	-3.9	0	0	121.9
153	D	25.2	Very low	26.3	Very low	106 Å²	106	139 Å²	139	57%	0.567	70%	0.699	S	S	*	*			trans	67.9	114.3	145.4	-83.4	1.6	0	0	0	124
154	K	26.9	Very low	26.4	Very low	164 Å²	164	140.4 Å²	140.4	71%	0.713	71%	0.709	S	S	*	*				51.6	128.6	127.6	-55.7	158.9	-170.6	141.7	0	116.9
155	T	23.8	Very low	26.5	Very low	130 Å²	130	140.1 Å²	140.1	80%	0.798	71%	0.712	S	S	*	*				-168.5	168.6	63.9	-55.9	0	0	0	0	111.7
156	V	27.7	Very low	26.6	Very low	130 Å²	130	138.9 Å²	138.9	79%	0.788	71%	0.713	S	S	*	*			trans	-39.7	136.1	171.5	179.5	0	0	0	0	115.2
157	G	25.2	Very low	26.7	Very low	67 Å²	67	136.8 Å²	136.8	69%	0.691	72%	0.723	S	S	*	*			trans	168.5	104	160.7	0	0	0	0	0	117
158	L	29.9	Very low	26.8	Very low	141 Å²	141	137.1 Å²	137.1	74%	0.738	73%	0.725	S	S	*	*			trans	-76.4	155.7	142.7	-76.7	158.4	0	0	0	106.5	N926	L158-N926 WeakPolarHBondContact O-CB 3.18Å; L158-N926 PolarHBondContact O-ND2 2.9Å
159	E	26.9	Very low	26.8	Very low	68 Å²	68	140.8 Å²	140.8	32%	0.318	73%	0.73	S	S	.	*				177	148.8	51.6	-154.5	-168.4	138.4	0	0	110.8	S925 N926	E159-S925 PolarHBondContact OE1-N 3.44Å; E159-S925 VanDerWaalsContact OE1-N 3.11Å; E159-S925 WeakPolarHBondContact OE2-CA 3.39Å; E159-S925 PolarHBondContact OE2-N 3.27Å; E159-N926 HydrophobicContact CB-CB 4.32Å; E159-N926 PolarHBondContact OE2-N 3.39Å
160	R	28.7	Very low	27	Very low	143 Å²	143	142.2 Å²	142.2	54%	0.54	73%	0.725	S	S	.	*			trans	68.8	144	151.9	-134.9	178.1	-81.4	-119.4	-3.8	115.6	S924	R160-S924 WeakPolarHBondContact CD-OG 3.32Å; R160-S924 PolarHBondContact NE-OG 3.2Å; R160-S924 PolarHBondContact NH1-OG 3.36Å
161	I	28.4	Very low	27.1	Very low	132 Å²	132	139.9 Å²	139.9	68%	0.677	71%	0.714	S	S	*	*				-164.2	134.5	61.7	-84.1	177.8	0	0	0	112.5
162	Y	23.2	Very low	27.3	Very low	165 Å²	165	137 Å²	137	65%	0.647	72%	0.715	S	S	*	*			trans	40.5	119.1	147.9	-75.2	-113.3	0	0	0	123.9
163	N	26.9	Very low	27.4	Very low	136 Å²	136	133.2 Å²	133.2	73%	0.727	71%	0.712	S	S	*	*				44.3	160.1	109	-60.8	16.7	0	0	0	123.1
164	I	26.5	Very low	27.8	Very low	168 Å²	168	137.9 Å²	137.9	86%	0.862	73%	0.73	S	S	*	*			trans	88.4	129.7	174.4	-54.5	170.4	0	0	0	111.3
165	S	27	Very low	27.9	Very low	103 Å²	103	136.9 Å²	136.9	72%	0.72	73%	0.733	S	S	*	*			cis	-144.1	169	6.9	48.4	0	0	0	0	114
166	D	26.1	Very low	28.5	Very low	138 Å²	138	137.1 Å²	137.1	74%	0.738	74%	0.735	S	S	*	*			trans	-29.1	145	159.9	-78.7	-71	0	0	0	118.1
167	A	30.7	Very low	28.5	Very low	104 Å²	104	138 Å²	138	86%	0.86	73%	0.73	S	S	*	*			trans	-146.5	119	144.8	0	0	0	0	0	109.3
168	N	27.8	Very low	28.9	Very low	138 Å²	138	143 Å²	143	74%	0.738	73%	0.733	S	S	*	*			trans	-82.9	145.7	-177.9	-77.8	-93.3	0	0	0	111.7
169	Y	27.3	Very low	28.8	Very low	232 Å²	232	144.2 Å²	144.2	91%	0.91	73%	0.734	S	S	*	*			trans	-142	132.7	140.6	-140.5	-103.7	0	0	0	112.8
170	R	29.7	Very low	29	Very low	186 Å²	186	146.8 Å²	146.8	70%	0.702	75%	0.75	S	S	*	*			trans	-79.3	172.3	173.2	-91.3	-175.4	173.7	-112.7	-5.7	109.5
171	E	27.3	Very low	29.2	Very low	135 Å²	135	146.2 Å²	146.2	63%	0.631	76%	0.763	S	S	*	*			cis	176.4	140.8	-14.5	166.4	177.5	-132.6	0	0	105.9
172	S	30.3	Very low	29.1	Very low	121 Å²	121	146.3 Å²	146.3	85%	0.846	77%	0.765	S	S	*	*			trans	-158	86.4	157	61.7	0	0	0	0	108.7
173	A	30.5	Very low	29.4	Very low	90 Å²	90	146 Å²	146	74%	0.744	77%	0.769	S	S	*	*			trans	-89.8	132.3	166	0	0	0	0	0	108.7
174	E	33.1	Very low	29.7	Very low	204 Å²	204	146.5 Å²	146.5	95%	0.953	77%	0.772	S	S	*	*			trans	-133.9	141	150.7	-113.8	170.8	-156.6	0	0	106.9
175	D	29.7	Very low	30.2	Very low	144 Å²	144	143.7 Å²	143.7	77%	0.77	77%	0.767	S	S	*	*			trans	-134	120.9	-154.3	176.3	16.4	0	0	0	110.2
176	T	35.1	Very low	30.5	Very low	135 Å²	135	147.9 Å²	147.9	83%	0.828	78%	0.775	S	S	*	*			trans	-144.8	79.6	170.2	-37.5	0	0	0	0	111.7
177	Q	28.1	Very low	30.8	Very low	149 Å²	149	149 Å²	149	70%	0.696	78%	0.776	S	S	*	*			trans	60	119.3	130.5	-168.7	166.8	-14.3	0	0	119.6
178	K	34.2	Very low	30.7	Very low	170 Å²	170	151.4 Å²	151.4	74%	0.739	77%	0.769	S	S	*	*			trans	-67.5	156.4	167.7	-53.5	179.2	175.4	-167.8	0	112.8
179	H	28.3	Very low	30.7	Very low	168 Å²	168	154.4 Å²	154.4	78%	0.778	77%	0.772	S	S	*	*			trans	-139.8	126.2	136.9	-92.6	-83.5	0	0	0	110
180	D	30.5	Very low	30.8	Very low	122 Å²	122	150.5 Å²	150.5	65%	0.652	76%	0.762	S	S	*	*			trans	-97.7	175.3	161	-68.5	-69	0	0	0	107.8
181	T	31.6	Very low	30.8	Very low	130 Å²	130	147.3 Å²	147.3	80%	0.798	77%	0.768	S	S	*	*			trans	67.2	147.6	-175	44.7	0	0	0	0	114.6
182	D	27.7	Very low	31	Very low	135 Å²	135	145.3 Å²	145.3	72%	0.722	77%	0.774	S	S	*	*			cis	-149.4	168.3	15.9	-136.2	-12.2	0	0	0	116.1
183	E	29.5	Very low	31.1	Very low	158 Å²	158	147.1 Å²	147.1	74%	0.738	77%	0.769	S	S	*	*			trans	62.6	138.4	156.4	-77	-66	-173.4	0	0	124
184	D	32.5	Very low	31.1	Very low	146 Å²	146	151.9 Å²	151.9	78%	0.781	78%	0.776	S	S	*	*			trans	-72.7	158.4	157	-103.8	-49.7	0	0	0	109.7
185	S	36.9	Very low	30.9	Very low	109 Å²	109	149.2 Å²	149.2	76%	0.762	76%	0.764	S	S	*	*			trans	-146.5	102.6	167.5	-80.7	0	0	0	0	111.6	Q187	S185-Q187 PolarHBondContact O-N 3.33Å
186	Q	34.6	Very low	30.9	Very low	192 Å²	192	150.9 Å²	150.9	90%	0.897	77%	0.767	S	S	*	*			trans	-65.4	126.7	176.1	-58.7	-179.5	6.5	0	0	109.8	E188	Q186-E188 PolarHBondContact O-N 3.14Å
187	Q	31.1	Very low	30.5	Very low	162 Å²	162	155.3 Å²	155.3	76%	0.757	77%	0.77	S	S	*	*			trans	-94.3	95.9	167.6	-72.3	-165.9	-11.9	0	0	110	S185 Y189	S185-Q187 PolarHBondContact O-N 3.33Å; Q187-Y189 HydrophobicContact CB-CE2 4.46Å; Q187-Y189 PolarHBondContact O-N 3.46Å; Q187-Y189 VanDerWaalsContact O-N 3.16Å
188	E	28.5	Very low	30.7	Very low	153 Å²	153	154.9 Å²	154.9	72%	0.715	77%	0.771	S	S	*	*			trans	-64	104	168.6	-173.9	-176	167.4	0	0	109.8	Q186 H190	Q186-E188 PolarHBondContact O-N 3.14Å; E188-H190 PolarHBondContact O-N 3.32Å; E188-H190 IonicContact OE1-CE1 2.6Å; E188-H190 PolarHBondContact OE1-CE1 3.25Å; E188-H190 IonicContact OE1-ND1 2.61Å; E188-H190 PolarHBondContact OE1-ND1 3.19Å; E188-H190 IonicContact OE2-CE1 2.69Å
189	Y	28	Very low	30.1	Very low	202 Å²	202	151 Å²	151	79%	0.792	77%	0.765	S	S	*	*			trans	-82.7	99.2	168.8	-90.6	-92.5	0	0	0	109.3	Q187	Q187-Y189 HydrophobicContact CB-CE2 4.46Å; Q187-Y189 PolarHBondContact O-N 3.46Å; Q187-Y189 VanDerWaalsContact O-N 3.16Å
190	H	28.7	Very low	30.1	Very low	150 Å²	150	150.6 Å²	150.6	69%	0.694	77%	0.769	S	S	*	*			trans	-60.5	135.9	176.3	-60.8	-50	0	0	0	111.9	E188 A192	E188-H190 PolarHBondContact O-N 3.32Å; E188-H190 IonicContact OE1-CE1 2.6Å; E188-H190 PolarHBondContact OE1-CE1 3.25Å; E188-H190 IonicContact OE1-ND1 2.61Å; E188-H190 PolarHBondContact OE1-ND1 3.19Å; E188-H190 IonicContact OE2-CE1 2.69Å; H190-A192 PolarHBondContact O-N 3.41Å
191	S	30.6	Very low	30	Very low	119 Å²	119	153.1 Å²	153.1	83%	0.832	78%	0.776	S	S	*	*			trans	-65.6	121.1	173.1	-53.7	0	0	0	0	111.3
192	A	32.4	Very low	29.9	Very low	93 Å²	93	154.8 Å²	154.8	77%	0.769	78%	0.78	S	S	*	*			trans	-87.5	112.2	162	0	0	0	0	0	109.1	H190 E194	H190-A192 PolarHBondContact O-N 3.41Å; A192-E194 PolarHBondContact O-N 3.36Å; A192-E194 VanDerWaalsContact O-N 3.14Å
193	E	30.8	Very low	30	Very low	158 Å²	158	153.3 Å²	153.3	74%	0.738	78%	0.78	S	S	*	*			trans	-74.1	94	170	-67.7	-174.3	137.6	0	0	110.1	Q195	E193-Q195 HydrophobicContact CB-CG 4.41Å; E193-Q195 PolarHBondContact O-N 3.49Å
194	E	31.4	Very low	29.9	Very low	190 Å²	190	154.4 Å²	154.4	89%	0.888	78%	0.783	S	S	*	*			trans	-78.9	109.5	159.6	-69.7	-157.4	148.1	0	0	109	A192	A192-E194 PolarHBondContact O-N 3.36Å; A192-E194 VanDerWaalsContact O-N 3.14Å
195	Q	29.2	Very low	29.7	Very low	149 Å²	149	154.2 Å²	154.2	70%	0.696	78%	0.782	S	S	*	*			trans	-81	135.7	-167	-71.2	156.9	-8.4	0	0	112.4	E193 Y197	E193-Q195 HydrophobicContact CB-CG 4.41Å; E193-Q195 PolarHBondContact O-N 3.49Å; Q195-Y197 PolarHBondContact O-N 3Å
196	E	29.8	Very low	29.4	Very low	179 Å²	179	155.4 Å²	155.4	84%	0.836	78%	0.775	S	S	*	*			trans	-63	106.3	179.7	-66.2	-172.3	127.9	0	0	112.1	I198	E196-I198 VanDerWaalsContact C-N 3.28Å; E196-I198 PolarHBondContact O-N 3.14Å
197	Y	26.4	Very low	29.1	Very low	227 Å²	227	151.5 Å²	151.5	89%	0.89	77%	0.765	S	S	*	*			trans	-84.3	63.4	-179.6	-137.8	-84.3	0	0	0	112.5	Q195 S199	Q195-Y197 PolarHBondContact O-N 3Å; Y197-S199 PolarHBondContact O-N 2.87Å
198	I	31.2	Very low	29.1	Very low	140 Å²	140	152.1 Å²	152.1	72%	0.718	77%	0.765	S	S	*	*			trans	-84	106.8	171.8	-61.5	-178	0	0	0	109.5	E196	E196-I198 VanDerWaalsContact C-N 3.28Å; E196-I198 PolarHBondContact O-N 3.14Å
199	S	23.3	Very low	29.2	Very low	88 Å²	88	150.3 Å²	150.3	62%	0.615	76%	0.764	S	S	*	*			trans	-74.2	131.4	175.2	54.4	0	0	0	0	112	Y197	Y197-S199 PolarHBondContact O-N 2.87Å
200	N	28.2	Very low	29.2	Very low	161 Å²	161	148.3 Å²	148.3	86%	0.861	77%	0.767	S	S	*	*			trans	-154.4	130.7	146.2	-97.1	-51.1	0	0	0	109.9
201	H	27.5	Very low	29	Very low	174 Å²	174	144.3 Å²	144.3	81%	0.806	77%	0.766	S	S	*	*			trans	-84.1	146.8	-178.7	-60	-98.4	0	0	0	111.2
202	L	30.3	Very low	28.9	Very low	166 Å²	166	146 Å²	146	87%	0.869	76%	0.764	S	S	*	*			trans	-170.4	133.6	131.4	-106	158.8	0	0	0	114.9
203	S	28.3	Very low	28.5	Very low	104 Å²	104	146.4 Å²	146.4	73%	0.727	76%	0.761	S	S	*	*			trans	54.4	126.9	152.8	51.3	0	0	0	0	122.6
204	F	28	Very low	28.4	Very low	181 Å²	181	146 Å²	146	79%	0.794	76%	0.763	S	S	*	*			trans	-70.8	147.7	158.8	-93.7	-129.4	0	0	0	112.6
205	D	28.1	Very low	29.3	Very low	141 Å²	141	141.8 Å²	141.8	75%	0.754	75%	0.753	S	S	*	*				-178.1	120.3	109.7	-95.8	-24.9	0	0	0	108.5
206	Q	30.8	Very low	29.1	Very low	134 Å²	134	142.9 Å²	142.9	63%	0.626	76%	0.758	S	S	*	*				76.3	93.1	56.7	-159	-161	142	0	0	114.7
207	T	28.5	Very low	29	Very low	111 Å²	111	140 Å²	140	68%	0.681	75%	0.753	S	S	*	*				176.7	128.4	119.3	27.7	0	0	0	0	114.3
208	K	32.1	Very low	29.1	Very low	174 Å²	174	135.5 Å²	135.5	76%	0.757	75%	0.748	S	S	*	*				46.8	145.9	123.4	-60.8	178.1	-176.7	169.6	0	120.1
209	T	29.2	Very low	28.9	Very low	115 Å²	115	135.6 Å²	135.6	71%	0.706	75%	0.745	S	S	*	*			cis	-168.7	158.9	10.1	3.1	0	0	0	0	111.7
210	L	28.2	Very low	29.2	Very low	161 Å²	161	137.4 Å²	137.4	84%	0.843	75%	0.748	S	S	*	*			trans	61.2	153.5	160.9	-89.7	64.5	0	0	0	117.8
211	G	24.7	Very low	29.1	Very low	65 Å²	65	140 Å²	140	67%	0.67	75%	0.745	S	S	*	*			cis	149.5	141.3	-14.2	0	0	0	0	0	115.6
212	I	28.6	Very low	29.3	Very low	156 Å²	156	138.5 Å²	138.5	80%	0.8	74%	0.743	S	S	*	*			trans	84.4	116.6	148.6	-60.8	167.2	0	0	0	120.2
213	S	24.8	Very low	29.3	Very low	100 Å²	100	138.2 Å²	138.2	70%	0.699	74%	0.742	S	S	*	*			trans	52.2	133.4	151.3	66.8	0	0	0	0	122.6
214	N	27.2	Very low	29.3	Very low	149 Å²	149	136 Å²	136	80%	0.797	74%	0.736	S	S	*	*				58.1	152.8	64.2	-83.7	17.5	0	0	0	115.3
215	P	50.5	Low	29.3	Very low	102 Å²	102	137.2 Å²	137.2	66%	0.662	74%	0.736	S	S	*	*			cis	-146.9	-171.8	-23.1	36.6	-13.9	0	0	0	116.3
216	E	25.7	Very low	29.2	Very low	173 Å²	173	138 Å²	138	81%	0.808	74%	0.735	S	S	*	*			trans	88.2	158.9	132.8	-128.6	168.2	-158.4	0	0	125.7
217	V	27	Very low	29	Very low	119 Å²	119	137 Å²	137	72%	0.721	74%	0.739	S	S	*	*			trans	64.1	143	168.1	-121.2	0	0	0	0	116.4
218	V	28.8	Very low	28.9	Very low	131 Å²	131	140.6 Å²	140.6	79%	0.794	75%	0.745	S	S	*	*			cis	-158.3	158.9	35.1	175.3	0	0	0	0	109
219	E	27.9	Very low	28.6	Very low	142 Å²	142	138.3 Å²	138.3	66%	0.664	75%	0.749	S	S	*	*			cis	-178	163.7	-33.4	-158.3	-155.8	140.8	0	0	108.5
220	L	28.4	Very low	28.3	Very low	127 Å²	127	138 Å²	138	67%	0.665	76%	0.758	S	S	*	*			trans	70.1	153.7	165.5	-56.1	165.8	0	0	0	117.8
221	R	26.9	Very low	28.2	Very low	214 Å²	214	135.5 Å²	135.5	81%	0.808	75%	0.754	S	S	*	*			cis	-157	167	2.8	-136.4	167.8	-159.6	-140.6	6.2	112.8
222	N	30.5	Very low	28.3	Very low	143 Å²	143	139.3 Å²	139.3	77%	0.765	76%	0.759	S	S	*	*			trans	-112.6	175.7	173.3	-49.2	43.4	0	0	0	109.8
223	L	31.1	Very low	28.4	Very low	161 Å²	161	137.7 Å²	137.7	84%	0.843	76%	0.756	S	S	*	*			cis	-126.7	-152.7	2.9	-48.9	73.4	0	0	0	108.2
224	G	29.3	Very low	28.5	Very low	58 Å²	58	140.8 Å²	140.8	60%	0.598	76%	0.76	S	S	*	*			cis	145.5	176.3	1.7	0	0	0	0	0	112
225	Y	27.6	Very low	28.6	Very low	205 Å²	205	139.4 Å²	139.4	80%	0.804	75%	0.752	S	S	*	*			trans	66.6	154	170.5	-79.4	-106	0	0	0	116.4
226	E	26.4	Very low	27.5	Very low	157 Å²	157	140.6 Å²	140.6	73%	0.734	75%	0.753	S	S	*	*			cis	-157.9	-171.4	-23.2	-135.1	-158.7	139.1	0	0	113.7
227	V	26.6	Very low	27.6	Very low	115 Å²	115	139.9 Å²	139.9	70%	0.697	75%	0.749	S	S	*	*			trans	-40.2	154.6	-177	164.6	0	0	0	0	121.7
228	K	24.6	Very low	27.4	Very low	186 Å²	186	139.5 Å²	139.5	81%	0.809	75%	0.747	S	S	*	*			trans	-13.4	137.5	162.8	-69.4	179.2	175.1	177.5	0	122
229	C	26.5	Very low	27.3	Very low	125 Å²	125	140.3 Å²	140.3	85%	0.845	75%	0.747	S	S	*	*			trans	61.6	118.8	131.2	-58	0	0	0	0	122.2
230	A	23.1	Very low	27.1	Very low	109 Å²	109	139.5 Å²	139.5	90%	0.901	76%	0.757	S	S	*	*			trans	-146.8	151.5	141.8	0	0	0	0	0	110.3
231	S	26.4	Very low	26.9	Very low	108 Å²	108	136.8 Å²	136.8	76%	0.755	76%	0.76	S	S	*	*			trans	-109.3	172.5	-179	53.6	0	0	0	0	112.5
232	N	25.8	Very low	26.8	Very low	145 Å²	145	132.9 Å²	132.9	78%	0.775	77%	0.765	S	S	*	*			trans	159.5	141.6	157.7	-81.4	-10.8	0	0	0	106.4
233	V	30.9	Very low	26.5	Very low	122 Å²	122	129.6 Å²	129.6	74%	0.739	77%	0.766	S	S	*	*			cis	-138.9	127.8	13.5	-176.4	0	0	0	0	104.8
234	E	28.3	Very low	26.1	Very low	165 Å²	165	127.4 Å²	127.4	77%	0.771	76%	0.764	S	S	*	*				56	139.4	82.4	-75.6	173.7	158.7	0	0	114.6
235	D	27.4	Very low	25.8	Very low	120 Å²	120	131.5 Å²	131.5	64%	0.642	77%	0.77	S	S	*	*			cis	-164.2	166.2	-15.1	-166.1	14.1	0	0	0	111
236	N	27.3	Very low	25.6	Very low	127 Å²	127	128.5 Å²	128.5	68%	0.679	77%	0.767	S	S	*	*			trans	67.9	157.5	161.8	-65.4	-64.3	0	0	0	122.2
237	H	27.8	Very low	25.5	Very low	158 Å²	158	126 Å²	126	73%	0.731	77%	0.767	S	S	*	*				-171.1	160.2	-51.4	-125.3	-77.6	0	0	0	111.4
238	V	24.8	Very low	25.6	Very low	112 Å²	112	125.6 Å²	125.6	68%	0.679	77%	0.769	S	S	*	*			trans	78.8	117	157.3	174.1	0	0	0	0	120.9
239	N	25.8	Very low	25.6	Very low	147 Å²	147	124.3 Å²	124.3	79%	0.786	77%	0.771	S	S	*	*			trans	46.3	127.2	148.7	-61.6	-9	0	0	0	123.3
240	S	23.6	Very low	25.8	Very low	125 Å²	125	121.8 Å²	121.8	87%	0.874	75%	0.754	S	S	*	*				178.7	157.8	108.3	-79.6	0	0	0	0	113.9
241	G	24.2	Very low	26	Very low	70 Å²	70	125 Å²	125	72%	0.722	75%	0.748	S	S	*	*			trans	78.1	128.2	170.7	0	0	0	0	0	115.2
242	S	24.6	Very low	26.2	Very low	132 Å²	132	126.2 Å²	126.2	92%	0.923	75%	0.747	S	S	*	*			cis	65.8	128.9	6.7	-146.7	0	0	0	0	117
243	G	24.3	Very low	26.4	Very low	75 Å²	75	124.7 Å²	124.7	77%	0.773	74%	0.742	S	S	*	*			trans	107.2	133.5	153.7	0	0	0	0	0	117.6
244	S	23.3	Very low	26.2	Very low	114 Å²	114	129.1 Å²	129.1	80%	0.797	75%	0.747	S	S	*	*			trans	-79.6	160.3	146.8	175.6	0	0	0	0	109
245	I	23.3	Very low	26.1	Very low	145 Å²	145	124.7 Å²	124.7	74%	0.744	75%	0.746	S	S	*	*			trans	141.4	120.2	149.2	-74.9	158.7	0	0	0	112.8
246	I	23.1	Very low	26	Very low	142 Å²	142	125.6 Å²	125.6	73%	0.728	75%	0.746	S	S	*	*			trans	21.9	120.4	135.1	-32.4	170.4	0	0	0	116
247	S	22.8	Very low	26	Very low	104 Å²	104	127.2 Å²	127.2	73%	0.727	75%	0.75	S	S	*	*				-169.3	140.3	75.5	-55.6	0	0	0	0	108.6
248	S	30.5	Very low	25.9	Very low	106 Å²	106	128 Å²	128	74%	0.741	75%	0.754	S	S	*	*				55.2	98.2	74.8	-53.1	0	0	0	0	114.5
249	D	24.2	Very low	26	Very low	159 Å²	159	127.4 Å²	127.4	85%	0.85	76%	0.755	S	S	*	*			trans	-176.7	150.3	157.7	-112.6	7.6	0	0	0	107.8
250	S	30.2	Very low	26	Very low	72 Å²	72	127.6 Å²	127.6	50%	0.503	76%	0.755	S	S	.	*			cis	-166.8	-177.8	-13.7	34.6	0	0	0	0	109.9
251	F	27.3	Very low	26.2	Very low	177 Å²	177	128.7 Å²	128.7	78%	0.776	75%	0.746	S	S	*	*			trans	75.6	138.7	175.5	-54.7	-84.1	0	0	0	116
252	D	30.6	Very low	26.5	Very low	134 Å²	134	131.3 Å²	131.3	72%	0.717	75%	0.748	S	S	*	*			cis	-149.9	154.9	10.7	-135.2	-24.5	0	0	0	116.3
253	V	29.8	Very low	26.8	Very low	113 Å²	113	129.6 Å²	129.6	69%	0.685	74%	0.736	S	S	*	*			trans	61.2	116.6	163.1	-167.3	0	0	0	0	122.5
254	Y	27.2	Very low	26.9	Very low	214 Å²	214	132.9 Å²	132.9	84%	0.839	73%	0.729	S	S	*	*			trans	-6.4	149.8	145.3	-61.6	-103.3	0	0	0	119.3
255	G	26.8	Very low	26.9	Very low	73 Å²	73	133.2 Å²	133.2	75%	0.753	72%	0.716	S	S	*	*			cis	159.3	-172	12.5	0	0	0	0	0	109.2
256	Q	25.6	Very low	27	Very low	138 Å²	138	134 Å²	134	65%	0.645	72%	0.716	S	S	*	*			cis	-168.6	154.2	-11.5	179.3	168.2	-30.1	0	0	109.5
257	E	26.5	Very low	27	Very low	161 Å²	161	134.2 Å²	134.2	75%	0.752	72%	0.719	S	S	*	*			trans	71.6	149.1	161.5	-97.9	139.8	-137.3	0	0	124.3
258	E	25.3	Very low	27	Very low	175 Å²	175	134.8 Å²	134.8	82%	0.818	72%	0.723	S	S	*	*			trans	57.7	113.7	157.7	-64.6	-159	141	0	0	125.3
259	S	26.6	Very low	26.9	Very low	100 Å²	100	135.9 Å²	135.9	70%	0.699	73%	0.725	S	S	*	*				100.9	134.2	124.3	80.4	0	0	0	0	121.5
260	L	26.3	Very low	27.4	Very low	151 Å²	151	136.5 Å²	136.5	79%	0.791	73%	0.725	S	S	*	*			trans	53.8	149.2	145.1	-86.6	88.2	0	0	0	121.1
261	H	28.7	Very low	27.1	Very low	148 Å²	148	140.4 Å²	140.4	69%	0.685	74%	0.74	S	S	*	*			cis	-177.1	140.2	-23.2	-136.3	-140.8	0	0	0	109.3
262	V	29.6	Very low	27	Very low	124 Å²	124	141.2 Å²	141.2	75%	0.752	74%	0.737	S	S	*	*			trans	60.8	172.5	136.9	169.8	0	0	0	0	115.8
263	S	30.8	Very low	26.8	Very low	97 Å²	97	140.2 Å²	140.2	68%	0.678	73%	0.728	S	S	*	*			cis	-133.5	154.1	-11.3	29.4	0	0	0	0	107.4
264	K	27.5	Very low	26.5	Very low	144 Å²	144	143.7 Å²	143.7	63%	0.626	73%	0.731	S	S	*	*				61.3	125.6	59	-85.4	-150.7	178.6	-155.4	0	117.1	D388	K264-D388 WeakPolarHBondContact CE-OD2 3.37Å; K264-D388 IonicContact NZ-OD2 3.76Å; K264-D388 PolarHBondContact NZ-OD2 3.36Å
265	F	23.1	Very low	26.5	Very low	121 Å²	121	141.9 Å²	141.9	53%	0.531	73%	0.729	S	S	.	*			trans	84.2	148.9	134.2	-89.7	-130.8	0	0	0	123.6	D388	F265-D388 WeakPolarHBondContact CE2-OD2 3.49Å; F265-D388 VanDerWaalsContact CZ-OD2 3.25Å; F265-D388 WeakPolarHBondContact CZ-OD2 3.18Å
266	Q	24.8	Very low	26.8	Very low	160 Å²	160	143.7 Å²	143.7	75%	0.748	72%	0.722	S	S	*	*			trans	75.2	102	150	-79.7	167.1	-4.1	0	0	121
267	N	22.4	Very low	26.8	Very low	148 Å²	148	143.1 Å²	143.1	79%	0.791	72%	0.722	S	S	*	*				20.1	144.3	103.4	-79.4	-25.5	0	0	0	118.7
268	S	23.3	Very low	26.8	Very low	115 Å²	115	143 Å²	143	80%	0.804	72%	0.719	S	S	*	*			trans	74.9	148.9	159.1	81.1	0	0	0	0	117.3
269	V	27.6	Very low	26.8	Very low	129 Å²	129	142 Å²	142	78%	0.782	71%	0.714	S	S	*	*			cis	-167.7	146	-38.9	106.3	0	0	0	0	108.2
270	M	34.8	Very low	26.9	Very low	173 Å²	173	144.2 Å²	144.2	85%	0.852	71%	0.714	S	S	*	*			trans	56	84.2	159.7	-65.5	-80.9	-79.1	0	0	120
271	L	25.4	Very low	27	Very low	154 Å²	154	144.5 Å²	144.5	81%	0.806	71%	0.708	S	S	*	*			trans	-146.5	142.6	146.9	-74.2	-179.1	0	0	0	108.2
272	R	24.9	Very low	26.9	Very low	194 Å²	194	142.5 Å²	142.5	73%	0.732	71%	0.71	S	S	*	*			cis	-158.6	141	-20.7	-136.8	-174.4	-152	-119.3	10.7	109
273	E	25.3	Very low	26.8	Very low	112 Å²	112	144.6 Å²	144.6	52%	0.523	71%	0.709	S	S	.	*			trans	46.7	139.9	139.8	-82.1	174.7	139.5	0	0	124.3
274	Y	24.8	Very low	26.5	Very low	187 Å²	187	145.7 Å²	145.7	73%	0.733	70%	0.703	S	S	*	*			trans	66.3	87.9	161.4	-55.3	-59.3	0	0	0	119.5
275	H	27.6	Very low	26.4	Very low	176 Å²	176	147 Å²	147	82%	0.815	71%	0.709	S	S	*	*	S	Bend		-137.3	159.4	93	-105	-72.8	0	0	0	112.5
276	D	32.6	Very low	26.9	Very low	111 Å²	111	149.3 Å²	149.3	59%	0.594	72%	0.722	S	S	*	*			trans	-26.5	128.1	178.8	-62.7	-71.4	0	0	0	118.3
277	L	25.6	Very low	26.9	Very low	126 Å²	126	148.1 Å²	148.1	66%	0.66	73%	0.726	S	S	*	*				69.6	132.1	79.8	-89.1	75	0	0	0	113.5
278	K	25.1	Very low	27	Very low	157 Å²	157	146.5 Å²	146.5	68%	0.683	73%	0.726	S	S	*	*			cis	-172.1	155.4	-5.4	-139.2	175.7	-152	165.8	0	110.1
279	H	26.1	Very low	27.1	Very low	155 Å²	155	145.5 Å²	145.5	72%	0.718	72%	0.719	S	S	*	*			trans	67.8	154.6	177.1	-60.9	-93.8	0	0	0	115.8
280	E	28.9	Very low	27.1	Very low	147 Å²	147	144.6 Å²	144.6	69%	0.687	71%	0.713	S	S	*	*			cis	-131.9	-170.5	-0.7	-165.2	124.9	-145.7	0	0	113.1
281	K	28.2	Very low	26.6	Very low	156 Å²	156	144.8 Å²	144.8	68%	0.678	71%	0.706	S	S	*	*			trans	-100	173.2	-152.4	-58.2	153.7	-175.8	135.3	0	114
282	C	26.6	Very low	26.7	Very low	107 Å²	107	144.4 Å²	144.4	72%	0.723	70%	0.699	S	S	*	*			trans	38.3	129.4	132.8	-63.4	0	0	0	0	120.4
283	K	27.2	Very low	26.9	Very low	168 Å²	168	140.3 Å²	140.3	73%	0.73	70%	0.696	S	S	*	*				73.2	128.8	56.9	-163.8	-145.3	178	-150.7	0	113
284	E	25.1	Very low	27	Very low	119 Å²	119	141.4 Å²	141.4	56%	0.556	71%	0.71	S	S	*	*			trans	99.3	136.1	164.5	-56.5	-166	-174	0	0	120.1
285	K	24	Very low	27.4	Very low	172 Å²	172	141.8 Å²	141.8	75%	0.748	72%	0.716	S	S	*	*			trans	82.6	133.1	149.9	-76.8	157.4	-178.4	133.2	0	121
286	E	34.5	Very low	27.4	Very low	169 Å²	169	141.3 Å²	141.3	79%	0.79	72%	0.719	S	S	*	*			trans	-48.2	150.7	155.3	-51.4	142	106.5	0	0	111.6
287	T	24.6	Very low	27.2	Very low	136 Å²	136	138.3 Å²	138.3	83%	0.834	72%	0.715	S	S	*	*				178.1	175.6	122.9	26.9	0	0	0	0	110.5
288	S	25.8	Very low	27.4	Very low	114 Å²	114	138.1 Å²	138.1	80%	0.797	72%	0.724	S	S	*	*			trans	66	112.2	-171.9	70.8	0	0	0	0	113.5
289	S	23.4	Very low	27.5	Very low	93 Å²	93	137.4 Å²	137.4	65%	0.65	73%	0.733	S	S	*	*			cis	73.6	93.8	28.8	-169.3	0	0	0	0	115.9
290	V	27.7	Very low	27.8	Very low	110 Å²	110	137.6 Å²	137.6	67%	0.667	74%	0.738	S	S	*	*				55	158	126.3	-159	0	0	0	0	119.1
291	Y	26.1	Very low	27.7	Very low	177 Å²	177	141.3 Å²	141.3	69%	0.694	75%	0.746	S	S	*	*			trans	88.4	144	164.5	-52.3	-65.1	0	0	0	116.2
292	H	27.4	Very low	27.6	Very low	146 Å²	146	138.4 Å²	138.4	68%	0.676	75%	0.745	S	S	*	*			cis	-148.1	135	-4.2	-123.4	-57	0	0	0	111.9
293	T	28.1	Very low	27.5	Very low	108 Å²	108	140.1 Å²	140.1	66%	0.663	75%	0.747	S	S	*	*			trans	5.9	151.5	143	57.7	0	0	0	0	122.2
294	V	27.5	Very low	27.7	Very low	136 Å²	136	137.3 Å²	137.3	82%	0.824	75%	0.749	S	S	*	*				169.1	156.8	114.9	154.6	0	0	0	0	112
295	F	33.3	Very low	28.7	Very low	195 Å²	195	137.4 Å²	137.4	86%	0.855	76%	0.76	S	S	*	*			trans	-76.2	151.5	175.9	-83.4	-115.5	0	0	0	114.5
296	D	28.3	Very low	28.7	Very low	165 Å²	165	132.6 Å²	132.6	88%	0.882	76%	0.759	S	S	*	*				-175.2	168.1	110.2	-127	-12.1	0	0	0	109.6
297	G	27.7	Very low	28.5	Very low	49 Å²	49	131.9 Å²	131.9	51%	0.505	76%	0.761	S	S	.	*			cis	173.3	165.4	-2	0	0	0	0	0	112.8
298	S	29	Very low	28.6	Very low	121 Å²	121	133.7 Å²	133.7	85%	0.846	76%	0.76	S	S	*	*			trans	67.6	158.6	176.8	80.6	0	0	0	0	116.7
299	V	28.4	Very low	28.8	Very low	142 Å²	142	136.1 Å²	136.1	86%	0.861	76%	0.759	S	S	*	*			cis	-125.6	170.2	15.5	177.8	0	0	0	0	111.8
300	L	31.5	Very low	29.4	Very low	160 Å²	160	135.8 Å²	135.8	84%	0.838	76%	0.756	S	S	*	*			trans	-125.1	173.6	-163.7	-122.1	159.9	0	0	0	113.4
301	R	26.7	Very low	29.8	Very low	225 Å²	225	137 Å²	137	85%	0.849	76%	0.755	S	S	*	*			trans	78.4	152.2	167.9	-91.8	177	172.9	174.7	-1.8	117.5
302	S	26.9	Very low	30	Very low	95 Å²	95	133.3 Å²	133.3	66%	0.664	75%	0.754	S	S	*	*			cis	-147.8	139.9	11.5	53.9	0	0	0	0	116.8
303	N	23.6	Very low	30.5	Very low	143 Å²	143	134.6 Å²	134.6	77%	0.765	76%	0.758	S	S	*	*			trans	63.7	131.4	136.3	-57.9	7	0	0	0	123.1
304	S	32	Very low	30.5	Very low	109 Å²	109	135 Å²	135	76%	0.762	77%	0.765	S	S	*	*			trans	-92.5	-167.4	152.6	66.9	0	0	0	0	109.2
305	P	45.8	Very low	30.5	Very low	120 Å²	120	132 Å²	132	78%	0.779	76%	0.762	S	S	*	*			cis	-138.6	-174	11.5	44.3	-25.2	0	0	0	116.7
306	G	25.4	Very low	30.3	Very low	72 Å²	72	128 Å²	128	74%	0.742	76%	0.758	S	S	*	*			trans	-172.9	120.8	164.5	0	0	0	0	0	112.2
307	N	28.7	Very low	30.2	Very low	153 Å²	153	128.3 Å²	128.3	82%	0.818	76%	0.759	S	S	*	*			trans	-121.7	144.8	-176.9	-71.8	-12.7	0	0	0	111.8
308	Q	28	Very low	30.6	Very low	175 Å²	175	130.5 Å²	130.5	82%	0.818	77%	0.767	S	S	*	*			trans	-172.7	128.7	135	-98.8	166.5	-4.3	0	0	106.4
309	E	29.8	Very low	31.4	Very low	165 Å²	165	130 Å²	130	77%	0.771	76%	0.76	S	S	*	*				73.6	136	59.6	-73.1	-163.7	123.8	0	0	113.6
310	S	36.5	Very low	31.4	Very low	85 Å²	85	130.6 Å²	130.6	59%	0.594	75%	0.754	S	S	*	*			cis	-169.1	152	5.1	47.4	0	0	0	0	115.9
311	Q	35.3	Very low	31.6	Very low	137 Å²	137	131.5 Å²	131.5	64%	0.64	75%	0.751	S	S	*	*			trans	67.4	159.8	146.3	-69.2	173.7	71.6	0	0	118
312	S	31.3	Very low	31.6	Very low	98 Å²	98	126.8 Å²	126.8	69%	0.685	75%	0.747	S	S	*	*			cis	-142.8	133.5	22.1	-57	0	0	0	0	112.1
313	K	36.3	Very low	31.8	Very low	173 Å²	173	128.8 Å²	128.8	75%	0.752	75%	0.749	S	S	*	*				69.5	146.5	101.6	-67.2	168.4	171.4	148.9	0	116
314	S	29.7	Very low	32	Very low	116 Å²	116	130.3 Å²	130.3	81%	0.811	75%	0.749	S	S	*	*			cis	-149.6	142.9	15.8	51.7	0	0	0	0	116.3
315	G	27.2	Very low	31.7	Very low	73 Å²	73	132.1 Å²	132.1	75%	0.753	75%	0.748	S	S	*	*			trans	90.6	-178.6	155.8	0	0	0	0	0	116.9
316	S	28.7	Very low	30.8	Very low	113 Å²	113	134.7 Å²	134.7	79%	0.79	75%	0.746	S	S	*	*			cis	172.2	141.7	-27.8	45	0	0	0	0	109.5
317	L	26.5	Very low	30.8	Very low	170 Å²	170	136.8 Å²	136.8	89%	0.89	75%	0.745	S	S	*	*			cis	-160.1	-172.5	-11.4	-126.1	176.5	0	0	0	109
318	S	35.2	Very low	30.6	Very low	96 Å²	96	139.8 Å²	139.8	67%	0.671	75%	0.746	S	S	*	*			trans	-148.9	169.7	172.3	65.9	0	0	0	0	111.9
319	P	46.1	Very low	30.6	Very low	110 Å²	110	137 Å²	137	71%	0.714	74%	0.741	S	S	*	*				-149.1	-176.9	103.2	45.6	-29.8	0	0	0	112.8
320	Q	29	Very low	30.4	Very low	155 Å²	155	136.7 Å²	136.7	72%	0.724	74%	0.74	S	S	*	*			cis	-159.5	135.4	7.4	-147.8	167.6	56.5	0	0	113
321	K	35	Very low	30.1	Very low	179 Å²	179	139.7 Å²	139.7	78%	0.778	74%	0.744	S	S	*	*			trans	42.3	152.4	146.3	-58.2	173.5	-173.8	173.5	0	120.4
322	V	27.4	Very low	29.7	Very low	126 Å²	126	141 Å²	141	76%	0.764	75%	0.752	S	S	*	*				-161.5	127.2	52.7	168.6	0	0	0	0	113.4
323	L	30	Very low	29.8	Very low	136 Å²	136	145.9 Å²	145.9	71%	0.712	76%	0.761	S	S	*	*			trans	34	133.2	144.3	-61.1	173.7	0	0	0	125.6
324	K	28.8	Very low	29.4	Very low	176 Å²	176	142.8 Å²	142.8	77%	0.765	76%	0.761	S	S	*	*			trans	73.3	159	137.7	-71.4	172.4	179.8	-177.8	0	119.7
325	M	25	Very low	29.4	Very low	147 Å²	147	145.4 Å²	145.4	72%	0.724	76%	0.761	S	S	*	*			cis	-175.8	135.1	-26.4	177.4	72.7	88.2	0	0	110.5
326	K	27	Very low	29.4	Very low	173 Å²	173	148.2 Å²	148.2	75%	0.752	76%	0.757	S	S	*	*			trans	52.1	108.3	157.8	-75.2	-178.9	178.3	-169.6	0	123.1
327	T	26.7	Very low	29.2	Very low	117 Å²	117	149.3 Å²	149.3	72%	0.718	75%	0.754	S	S	*	*				42.2	128.7	115.8	62.1	0	0	0	0	124
328	Y	24.3	Very low	29.4	Very low	216 Å²	216	150.1 Å²	150.1	85%	0.847	75%	0.753	S	S	*	*			trans	82.7	170.6	136	-104.9	-98.2	0	0	0	122.2
329	T	26.3	Very low	29	Very low	116 Å²	116	151.5 Å²	151.5	71%	0.712	76%	0.763	S	S	*	*			trans	72.2	141.5	168.9	47.6	0	0	0	0	118.7
330	E	26.5	Very low	28.4	Very low	158 Å²	158	154.9 Å²	154.9	74%	0.738	77%	0.767	S	S	*	*			cis	-169	161.2	-23.6	-134.8	179.2	167.9	0	0	113.7
331	H	29.5	Very low	28.3	Very low	148 Å²	148	152.9 Å²	152.9	69%	0.685	76%	0.761	S	S	*	*			trans	57.8	156.5	141.5	-114	-79.6	0	0	0	126
332	M	28.2	Very low	27.9	Very low	165 Å²	165	154.2 Å²	154.2	81%	0.813	77%	0.767	S	S	*	*			trans	94.7	151.2	149.5	-82	-60.8	177	0	0	122.4
333	K	33.4	Very low	27.9	Very low	201 Å²	201	153.9 Å²	153.9	87%	0.874	77%	0.769	S	S	*	*			trans	-129.7	151.4	-173.3	-66.8	178.2	176.8	177.7	0	111.2
334	S	27.9	Very low	27.8	Very low	108 Å²	108	150.5 Å²	150.5	76%	0.755	77%	0.767	S	S	*	*			trans	-149.2	110.1	160.5	52.4	0	0	0	0	107.8
335	Q	28.3	Very low	28	Very low	171 Å²	171	148.7 Å²	148.7	80%	0.799	77%	0.766	S	S	*	*				87.8	111.5	84.1	-95	-165	-33	0	0	114.9
336	I	26.8	Very low	28.4	Very low	132 Å²	132	150.2 Å²	150.2	68%	0.677	77%	0.768	S	S	*	*				78.6	130.3	129.7	-67.8	174.8	0	0	0	120.8
337	N	25.3	Very low	28.8	Very low	136 Å²	136	149.7 Å²	149.7	73%	0.727	77%	0.772	S	S	*	*			trans	60.6	117.8	157.8	-69.5	13.6	0	0	0	123.6
338	E	30.3	Very low	28.9	Very low	186 Å²	186	147.9 Å²	147.9	87%	0.869	77%	0.769	S	S	*	*				17.3	124.6	126.4	-56.6	-172.9	137.7	0	0	120
339	S	28.3	Very low	29.6	Very low	126 Å²	126	144.4 Å²	144.4	88%	0.881	76%	0.76	S	S	*	*			trans	-139.1	148.7	143.8	65.8	0	0	0	0	110
340	K	31.5	Very low	29.8	Very low	180 Å²	180	143.9 Å²	143.9	78%	0.783	75%	0.753	S	S	*	*			trans	-98	156.2	-169.9	-103.1	-179.2	170.5	-171.5	0	113.4
341	D	27.7	Very low	30.4	Very low	114 Å²	114	143.3 Å²	143.3	61%	0.61	75%	0.749	S	S	*	*			trans	40.6	120.6	144.8	-43.1	-28.5	0	0	0	119.5
342	F	26	Very low	30.8	Very low	207 Å²	207	143.1 Å²	143.1	91%	0.908	75%	0.751	S	S	*	*				-173.6	166.3	93.7	-112.6	-84.8	0	0	0	115.2
343	C	27.8	Very low	31.2	Very low	119 Å²	119	142.1 Å²	142.1	80%	0.804	75%	0.748	S	S	*	*			trans	-91.1	149.4	-164.7	170	0	0	0	0	116.2
344	G	28.9	Very low	31.5	Very low	65 Å²	65	138 Å²	138	67%	0.67	74%	0.735	S	S	*	*			trans	130.1	153.2	145.6	0	0	0	0	0	117.2
345	N	32.2	Very low	31.7	Very low	138 Å²	138	140.3 Å²	140.3	74%	0.738	73%	0.734	S	S	*	*			cis	-169.2	157	-4	-146.3	-24.1	0	0	0	113.2
346	K	33.4	Very low	31.8	Very low	179 Å²	179	137.4 Å²	137.4	78%	0.778	72%	0.723	S	S	*	*			trans	69.1	147.2	163.3	-61.4	174.1	178.9	178.9	0	117.3
347	I	35.5	Very low	31.7	Very low	161 Å²	161	137.4 Å²	137.4	83%	0.826	72%	0.72	S	S	*	*			cis	-155.9	172.2	-1.2	-129	168.9	0	0	0	107.1
348	A	29.8	Very low	31.9	Very low	79 Å²	79	137.9 Å²	137.9	65%	0.653	72%	0.723	S	S	*	*			cis	-125.8	-161.1	17.2	0	0	0	0	0	110.5
349	E	37.3	Very low	32.8	Very low	143 Å²	143	134.6 Å²	134.6	67%	0.668	72%	0.717	S	S	*	*			cis	73.1	142	12.3	-68.4	-143.9	158.1	0	0	118.7	K351	E349-K351 IonicContact OE1-NZ 3.93Å; E349-K351 PolarHBondContact OE1-NZ 3.37Å; E349-K351 IonicContact OE2-NZ 2.62Å
350	N	31.4	Very low	32.7	Very low	106 Å²	106	133.5 Å²	133.5	57%	0.567	71%	0.71	S	S	*	*			cis	-134.3	131.3	1.1	-100.5	-51	0	0	0	111.1
351	K	39.7	Very low	32.5	Very low	146 Å²	146	131.8 Å²	131.8	64%	0.635	72%	0.715	S	S	*	*				68.4	147.4	95.7	-69.3	-167	-163.2	105.9	0	115.2	E349	E349-K351 IonicContact OE1-NZ 3.93Å; E349-K351 PolarHBondContact OE1-NZ 3.37Å; E349-K351 IonicContact OE2-NZ 2.62Å
352	I	37.2	Very low	32.6	Very low	143 Å²	143	133.5 Å²	133.5	73%	0.733	72%	0.723	S	S	*	*			cis	-161.6	162.5	28.1	-134.4	149.4	0	0	0	107.1
353	L	36.2	Very low	33.1	Very low	144 Å²	144	129.5 Å²	129.5	75%	0.754	72%	0.718	S	S	*	*			cis	-169.8	164.2	-1.7	-156.6	175.6	0	0	0	107.6
354	L	39.8	Very low	33.2	Very low	115 Å²	115	132 Å²	132	60%	0.602	72%	0.718	S	S	*	*			cis	-117.5	-83.5	-10.3	-145.4	173.2	0	0	0	110.8	L356	L354-L356 HydrophobicContact CD2-CD1 3.9Å
355	H	31.7	Very low	33	Very low	156 Å²	156	134.9 Å²	134.9	72%	0.722	72%	0.718	S	S	*	*			cis	-170.1	150.9	-29.5	-113.7	-42.4	0	0	0	105.2
356	L	30.3	Very low	32.8	Very low	111 Å²	111	136.8 Å²	136.8	58%	0.581	72%	0.719	S	S	*	*			cis	-166.4	165.4	-36.5	-132.7	68.8	0	0	0	105.7	L354	L354-L356 HydrophobicContact CD2-CD1 3.9Å
357	E	25.5	Very low	32.3	Very low	131 Å²	131	132.3 Å²	132.3	61%	0.612	72%	0.716	S	S	*	*			cis	-149.6	83	4.2	-175.9	60.8	-73	0	0	111.7
358	N	29.9	Very low	31.8	Very low	146 Å²	146	132.4 Å²	132.4	78%	0.781	72%	0.717	S	S	*	*			trans	63.2	161.4	148.5	-76.6	-49.5	0	0	0	125.2
359	P	49.2	Very low	31.5	Very low	117 Å²	117	136.9 Å²	136.9	76%	0.76	73%	0.725	S	S	*	*			trans	-128.5	-178.9	-176.4	44.3	-28.7	0	0	0	115.9
360	S	26.4	Very low	30.8	Very low	103 Å²	103	135.7 Å²	135.7	72%	0.72	73%	0.727	S	S	*	*			trans	-158.7	113.6	169.3	47.6	0	0	0	0	111.8
361	T	27.5	Very low	30.6	Very low	145 Å²	145	137.3 Å²	137.3	89%	0.89	74%	0.735	S	S	*	*				89.4	139.7	87.7	55.1	0	0	0	0	117.7
362	L	28.4	Very low	30.4	Very low	149 Å²	149	136.4 Å²	136.4	78%	0.78	74%	0.744	S	S	*	*			trans	-93.4	165.2	177	-123	159.5	0	0	0	111.1
363	P	37.9	Very low	29.9	Very low	123 Å²	123	136.2 Å²	136.2	80%	0.799	74%	0.74	S	S	*	*				-151.9	-172.9	98	40.2	-21.2	0	0	0	116.1
364	Q	28.3	Very low	29.6	Very low	172 Å²	172	135.6 Å²	135.6	80%	0.804	75%	0.745	S	S	*	*			trans	-106.6	-175.3	178.9	-67.4	-177	-68.1	0	0	113.3
365	D	25.6	Very low	28.8	Very low	126 Å²	126	134.3 Å²	134.3	67%	0.674	74%	0.744	S	S	*	*			trans	71.2	166.2	162	-82.7	-19.4	0	0	0	117.2
366	K	27.9	Very low	28.6	Very low	177 Å²	177	135.9 Å²	135.9	77%	0.77	75%	0.749	S	S	*	*			cis	-177.9	171.8	-42.5	-114.6	-165.6	-155.4	101.2	0	106.9
367	A	23.1	Very low	28.3	Very low	85 Å²	85	136.4 Å²	136.4	70%	0.702	75%	0.753	S	S	*	*			trans	71.5	120.3	169.6	0	0	0	0	0	114.8
368	L	25.4	Very low	28.3	Very low	163 Å²	163	134.8 Å²	134.8	85%	0.853	75%	0.754	S	S	*	*				69.9	114.7	85.6	-67.3	164.6	0	0	0	114.3
369	E	23.4	Very low	28.1	Very low	174 Å²	174	135.6 Å²	135.6	81%	0.813	75%	0.754	S	S	*	*				179.1	134.8	105.4	-91.8	-152	99.6	0	0	114.3
370	T	22.4	Very low	27	Very low	118 Å²	118	135.5 Å²	135.5	72%	0.724	75%	0.751	S	S	*	*			trans	59.4	130.2	131.1	-43	0	0	0	0	123.1
371	L	26.8	Very low	27	Very low	140 Å²	140	135.8 Å²	135.8	73%	0.733	75%	0.753	S	S	*	*			trans	-57.8	166.4	168.5	-105.4	75.1	0	0	0	113.7
372	P	35.2	Very low	26.7	Very low	127 Å²	127	140.7 Å²	140.7	83%	0.825	76%	0.755	S	S	*	*				-152	-174.3	50.8	41.8	-18.7	0	0	0	119.8
373	Q	26.3	Very low	26.5	Very low	138 Å²	138	140 Å²	140	65%	0.645	76%	0.758	S	S	*	*			trans	-67	166.8	-176	-114.7	156	-46.3	0	0	116.1	C375	Q373-C375 PolarHBondContact NE2-SG 2.92Å
374	P	29.8	Very low	25.9	Very low	132 Å²	132	138.9 Å²	138.9	86%	0.857	75%	0.753	S	S	*	*				-132.9	159.2	86.9	37.7	-26.9	0	0	0	115.4
375	C	23.9	Very low	25.7	Very low	87 Å²	87	137.1 Å²	137.1	59%	0.588	75%	0.753	S	S	*	*			trans	-106.1	158.4	-177.9	-94.6	0	0	0	0	114.3	Q373	Q373-C375 PolarHBondContact NE2-SG 2.92Å
376	K	27.6	Very low	25.7	Very low	190 Å²	190	140.6 Å²	140.6	83%	0.826	76%	0.763	S	S	*	*				-131.3	108.1	129.7	-68.5	-165	175.5	-173.8	0	106.6
377	D	24.3	Very low	25.4	Very low	122 Å²	122	138.7 Å²	138.7	65%	0.652	76%	0.761	S	S	*	*				87.1	138.5	87.2	-67.5	-36.3	0	0	0	111.6
378	C	25.6	Very low	25.5	Very low	96 Å²	96	137.6 Å²	137.6	65%	0.649	74%	0.743	S	S	*	*			cis	-174.4	146.4	-19.1	-104.3	0	0	0	0	104.1
379	Q	25.2	Very low	25.7	Very low	163 Å²	163	134 Å²	134	76%	0.762	73%	0.732	S	S	*	*			cis	-159	174.8	-5.1	-101.9	175.3	67.5	0	0	104.5
380	T	25.9	Very low	26.1	Very low	116 Å²	116	133.5 Å²	133.5	71%	0.712	73%	0.733	S	S	*	*			cis	-165.5	173.1	8.1	11	0	0	0	0	105.5
381	S	25.3	Very low	26.5	Very low	108 Å²	108	134.9 Å²	134.9	76%	0.755	74%	0.735	S	S	*	*			cis	-162	156.7	0.9	34.3	0	0	0	0	109.1
382	W	22.5	Very low	26.6	Very low	248 Å²	248	133.7 Å²	133.7	94%	0.939	74%	0.738	S	S	*	*			trans	-79.6	169.3	164.1	-85.2	26.3	0	0	0	112.3
383	T	24.3	Very low	26.3	Very low	135 Å²	135	131.5 Å²	131.5	83%	0.828	73%	0.73	S	S	*	*			trans	128.9	153.8	151.9	54.4	0	0	0	0	113.2
384	S	24	Very low	26.3	Very low	99 Å²	99	130.8 Å²	130.8	69%	0.692	74%	0.74	S	S	*	*			cis	-178.6	-158	-40.2	55.1	0	0	0	0	106.8
385	V	24.2	Very low	26.2	Very low	135 Å²	135	127.6 Å²	127.6	82%	0.818	73%	0.73	S	S	*	*			trans	90.8	137	162.8	-177.3	0	0	0	0	117.4
386	F	25.8	Very low	26.3	Very low	200 Å²	200	133.1 Å²	133.1	88%	0.877	74%	0.74	S	S	*	*			trans	-94.4	165.5	168.4	-96.2	-98.4	0	0	0	110.1
387	D	23.1	Very low	26.4	Very low	136 Å²	136	128.9 Å²	128.9	73%	0.727	74%	0.735	S	S	*	*			trans	94.8	155.3	149.7	-143.8	5.4	0	0	0	119.1
388	D	24.3	Very low	26.5	Very low	63 Å²	63	130 Å²	130	34%	0.337	74%	0.735	S	S	.	*			trans	63.7	89.4	169.1	-91.7	-30.3	0	0	0	123.4	K264 F265	K264-D388 WeakPolarHBondContact CE-OD2 3.37Å; K264-D388 IonicContact NZ-OD2 3.76Å; K264-D388 PolarHBondContact NZ-OD2 3.36Å; F265-D388 WeakPolarHBondContact CE2-OD2 3.49Å; F265-D388 VanDerWaalsContact CZ-OD2 3.25Å; F265-D388 WeakPolarHBondContact CZ-OD2 3.18Å
389	S	30	Very low	26.5	Very low	88 Å²	88	134 Å²	134	62%	0.615	74%	0.738	S	S	*	*				55.7	107.8	102	-51.3	0	0	0	0	122.8
390	I	30.8	Very low	26.6	Very low	162 Å²	162	134.3 Å²	134.3	83%	0.831	74%	0.74	S	S	*	*			trans	56.6	157.1	138.7	26	172.3	0	0	0	120.6
391	I	31.4	Very low	26.6	Very low	148 Å²	148	133 Å²	133	76%	0.759	74%	0.735	S	S	*	*			cis	-139.3	172.3	4.5	-38.1	160.1	0	0	0	109.9
392	S	28.8	Very low	26.6	Very low	114 Å²	114	134.3 Å²	134.3	80%	0.797	73%	0.733	S	S	*	*			trans	88.1	145.6	148.5	-97.4	0	0	0	0	119.4
393	A	28.7	Very low	26.8	Very low	81 Å²	81	129.8 Å²	129.8	67%	0.669	72%	0.722	S	S	*	*			cis	-149.2	161.4	-0.7	0	0	0	0	0	113.1
394	C	26.6	Very low	26.8	Very low	124 Å²	124	131.1 Å²	131.1	84%	0.838	72%	0.724	S	S	*	*			trans	26.1	143.6	150.6	-56.9	0	0	0	0	122
395	G	28.1	Very low	26.9	Very low	64 Å²	64	132 Å²	132	66%	0.66	73%	0.725	S	S	*	*			cis	147.9	178.8	0.4	0	0	0	0	0	112.7
396	Y	25.5	Very low	27.4	Very low	204 Å²	204	131 Å²	131	80%	0.8	72%	0.722	S	S	*	*			trans	66.1	150	175.3	-67.9	-87.6	0	0	0	116.7	H398	Y396-H398 AromaticContact CD1-NE2 3.62Å; Y396-H398 AromaticContact CE1-NE2 3.59Å
397	S	29.4	Very low	27.4	Very low	101 Å²	101	129.6 Å²	129.6	71%	0.706	72%	0.724	S	S	*	*			cis	-140.7	151.6	2.9	37.1	0	0	0	0	113.4
398	H	28	Very low	27.6	Very low	144 Å²	144	128.2 Å²	128.2	67%	0.667	73%	0.725	S	S	*	*			trans	12.4	137.4	149	-51.6	-69.6	0	0	0	120.3	Y396	Y396-H398 AromaticContact CD1-NE2 3.62Å; Y396-H398 AromaticContact CE1-NE2 3.59Å
399	Y	25.3	Very low	27.7	Very low	182 Å²	182	130.2 Å²	130.2	71%	0.714	75%	0.75	S	S	*	*				56.2	139.9	68.9	-90.9	-107.4	0	0	0	112.8	S401	Y399-S401 WeakPolarHBondContact CE1-O 3.23Å
400	E	26.2	Very low	27.6	Very low	169 Å²	169	133.2 Å²	133.2	79%	0.79	76%	0.758	S	S	*	*			cis	-117	139.4	30	-63.7	173.8	110.7	0	0	116.6
401	S	26.1	Very low	27.4	Very low	89 Å²	89	130.7 Å²	130.7	62%	0.622	75%	0.746	S	S	*	*			trans	-128.9	117.3	138.8	175.4	0	0	0	0	105.9	Y399	Y399-S401 WeakPolarHBondContact CE1-O 3.23Å
402	L	26	Very low	27	Very low	135 Å²	135	131.9 Å²	131.9	71%	0.707	75%	0.747	S	S	*	*			trans	-95.1	109.3	176.2	-90.4	170.4	0	0	0	110.1
403	Q	27.3	Very low	26.8	Very low	152 Å²	152	132 Å²	132	71%	0.71	75%	0.748	S	S	*	*			trans	-71.9	140.2	163.2	-63.3	172.9	-22.2	0	0	108.9
404	N	22.5	Very low	26.6	Very low	163 Å²	163	131.9 Å²	131.9	87%	0.872	75%	0.746	S	S	*	*			trans	-103.8	105.6	159	-79.4	-31.6	0	0	0	108.5
405	T	26.1	Very low	26.4	Very low	117 Å²	117	134.2 Å²	134.2	72%	0.718	75%	0.747	S	S	*	*			trans	-131.4	157.7	164.7	47.2	0	0	0	0	108.1
406	P	36.5	Very low	26.6	Very low	115 Å²	115	138.6 Å²	138.6	75%	0.747	75%	0.754	S	S	*	*			trans	-94.5	156.3	-134.4	35	-37.9	0	0	0	114.9
407	D	24.5	Very low	27.1	Very low	170 Å²	170	133.5 Å²	133.5	91%	0.909	75%	0.746	S	S	*	*			trans	-94.7	140	158	-104.9	-44	0	0	0	110.9
408	S	27.1	Very low	27.3	Very low	108 Å²	108	138.3 Å²	138.3	76%	0.755	76%	0.755	S	S	*	*			trans	-116.5	108.4	178.3	-68.3	0	0	0	0	110.8
409	A	26.1	Very low	27.1	Very low	105 Å²	105	139.7 Å²	139.7	87%	0.868	77%	0.765	S	S	*	*			trans	-107.5	102.3	165.1	0	0	0	0	0	109.3
410	L	29.7	Very low	27.1	Very low	150 Å²	150	135.4 Å²	135.4	79%	0.785	77%	0.767	S	S	*	*			trans	-75	162.1	163.2	-70.3	166.7	0	0	0	108.6
411	D	24.5	Very low	27.4	Very low	109 Å²	109	133.6 Å²	133.6	58%	0.583	77%	0.768	S	S	*	*			cis	-161.3	175.1	22.7	-147.8	-22.3	0	0	0	113.4
412	F	24.8	Very low	27.3	Very low	174 Å²	174	140.9 Å²	140.9	76%	0.763	78%	0.782	S	S	*	*			trans	77.6	118.5	157.6	-65.3	-59.7	0	0	0	122.9
413	S	24.1	Very low	27.3	Very low	117 Å²	117	140.7 Å²	140.7	82%	0.818	78%	0.781	S	S	*	*				80	133.6	128.3	-163.6	0	0	0	0	119.5
414	A	24.7	Very low	27.3	Very low	78 Å²	78	140 Å²	140	65%	0.645	78%	0.782	S	S	*	*			cis	-167.5	172.1	-14.5	0	0	0	0	0	111.8
415	M	22.5	Very low	27.6	Very low	172 Å²	172	140.4 Å²	140.4	85%	0.847	78%	0.779	S	S	*	*			trans	67.5	109.4	145.2	-89.2	179.9	65	0	0	122.2
416	L	32.7	Very low	27.6	Very low	156 Å²	156	139 Å²	139	82%	0.817	78%	0.779	S	S	*	*				-38.1	153	127.1	-73	164.3	0	0	0	112
417	P	35.9	Very low	27.2	Very low	97 Å²	97	140.8 Å²	140.8	63%	0.63	78%	0.781	S	S	*	*				-158.5	-174.8	53.2	44.1	-22.4	0	0	0	118.9
418	K	32.9	Very low	27.3	Very low	203 Å²	203	141 Å²	141	88%	0.883	78%	0.777	S	S	*	*			trans	6.7	136.3	147.3	-60.4	176.1	178.1	179.1	0	119
419	I	23.6	Very low	27.5	Very low	172 Å²	172	142.1 Å²	142.1	88%	0.882	77%	0.774	S	S	*	*			trans	-129.8	139.4	149.8	-63.9	-178.5	0	0	0	110
420	A	24.5	Very low	27.4	Very low	92 Å²	92	142.8 Å²	142.8	76%	0.76	76%	0.763	S	S	*	*			trans	-141.9	122.2	164.8	0	0	0	0	0	110.5
421	V	34.3	Very low	27.2	Very low	132 Å²	132	141.1 Å²	141.1	80%	0.8	76%	0.759	S	S	*	*			trans	38.3	111.3	156.6	-170.2	0	0	0	0	119.6
422	R	23.2	Very low	27.3	Very low	242 Å²	242	141.4 Å²	141.4	91%	0.913	77%	0.769	S	S	*	*			trans	-158.1	146.4	134.8	-164.6	162.2	-69.4	-160.8	-1.1	112.1
423	N	26.3	Very low	27.5	Very low	130 Å²	130	139.9 Å²	139.9	70%	0.695	77%	0.767	S	S	*	*			trans	-98	150.1	178	-54.8	-18.1	0	0	0	112.1
424	N	27.8	Very low	27.7	Very low	138 Å²	138	142.6 Å²	142.6	74%	0.738	77%	0.765	S	S	*	*				155	140.4	118.4	-81.1	-15.5	0	0	0	114.1
425	Q	26.7	Very low	27.8	Very low	171 Å²	171	144.7 Å²	144.7	80%	0.799	77%	0.769	S	S	*	*			trans	54	122.1	160	-75.8	150.3	-42.7	0	0	118.3
426	A	26.9	Very low	28	Very low	88 Å²	88	140.1 Å²	140.1	73%	0.727	76%	0.759	S	S	*	*				68.2	128.3	56	0	0	0	0	0	112
427	I	27.4	Very low	27.7	Very low	153 Å²	153	140.5 Å²	140.5	79%	0.785	76%	0.756	S	S	*	*				-160	-175.2	69.5	-95	168.9	0	0	0	110.5
428	E	26.8	Very low	27.2	Very low	175 Å²	175	140.3 Å²	140.3	82%	0.818	76%	0.757	S	S	*	*			trans	79.5	134.9	170.9	-82.6	165.6	-152.4	0	0	118.4
429	D	31.3	Very low	26.9	Very low	130 Å²	130	135.3 Å²	135.3	70%	0.695	75%	0.748	S	S	*	*			cis	-164.2	172.5	-20.8	-145.2	4.7	0	0	0	116
430	N	24.6	Very low	27.1	Very low	120 Å²	120	132.7 Å²	132.7	64%	0.642	74%	0.74	S	S	*	*			trans	78.1	100.5	149.6	-78.5	-58	0	0	0	124.5
431	T	25.8	Very low	27.4	Very low	114 Å²	114	134.2 Å²	134.2	70%	0.699	74%	0.74	S	S	*	*				68.5	97.1	108.9	-50.4	0	0	0	0	122.2
432	C	25.8	Very low	27	Very low	116 Å²	116	137.5 Å²	137.5	78%	0.784	74%	0.743	S	S	*	*				56.8	154.9	118.9	-106.9	0	0	0	0	121.6
433	L	30.2	Very low	27.3	Very low	141 Å²	141	134.4 Å²	134.4	74%	0.738	74%	0.736	S	S	*	*			cis	-168	144.1	36.1	-128.4	176	0	0	0	107.5
434	K	26.8	Very low	27.2	Very low	175 Å²	175	133.3 Å²	133.3	76%	0.761	73%	0.734	S	S	*	*				173.8	141.9	86.2	-107.3	-168.3	179	179.3	0	113.8
435	V	26.9	Very low	27.1	Very low	122 Å²	122	130.8 Å²	130.8	74%	0.739	73%	0.727	S	S	*	*			trans	58.6	129.2	135.1	174	0	0	0	0	119.3
436	A	27.1	Very low	27	Very low	76 Å²	76	131.2 Å²	131.2	63%	0.628	73%	0.726	S	S	*	*			cis	-163.7	-158.5	-9.2	0	0	0	0	0	107.2
437	H	26.3	Very low	27	Very low	164 Å²	164	134.5 Å²	134.5	76%	0.759	73%	0.726	S	S	*	*			cis	-151.5	135	13.9	-94.3	-72.3	0	0	0	107.8
438	S	25.6	Very low	26.9	Very low	92 Å²	92	134.3 Å²	134.3	64%	0.643	73%	0.727	S	S	*	*				49.9	128.5	84.7	77.2	0	0	0	0	117.5
439	S	27.4	Very low	27	Very low	99 Å²	99	131.8 Å²	131.8	69%	0.692	72%	0.724	S	S	*	*			cis	177.3	161.2	-13.5	41.8	0	0	0	0	111.7
440	T	27.8	Very low	26.7	Very low	117 Å²	117	135 Å²	135	72%	0.718	73%	0.734	S	S	*	*			trans	116.5	105.5	148.1	66.3	0	0	0	0	122
441	T	30.3	Very low	26.6	Very low	124 Å²	124	132.1 Å²	132.1	76%	0.761	73%	0.733	S	S	*	*			trans	59.9	146.6	135.9	70.7	0	0	0	0	120.9
442	K	26.7	Very low	26.4	Very low	200 Å²	200	132.9 Å²	132.9	87%	0.87	74%	0.738	S	S	*	*			cis	-151.2	171.3	29.8	-66.5	171.3	-177.7	169.5	0	109.5
443	K	28.8	Very low	26.3	Very low	178 Å²	178	132.3 Å²	132.3	77%	0.774	73%	0.734	S	S	*	*			cis	167	120.7	-24	-176.1	-141	178.9	-165.1	0	104.2
444	T	23.9	Very low	26	Very low	106 Å²	106	131 Å²	131	65%	0.65	73%	0.732	S	S	*	*				-147.5	-170.5	65.1	53.8	0	0	0	0	110.9
445	C	26	Very low	25.8	Very low	86 Å²	86	129.5 Å²	129.5	58%	0.581	73%	0.732	S	S	*	*			cis	75.8	143.6	16.7	-23.2	0	0	0	0	115.8
446	F	23.8	Very low	25.7	Very low	180 Å²	180	128.4 Å²	128.4	79%	0.789	73%	0.73	S	S	*	*			cis	-145.5	164.8	-4.1	-98.5	-56	0	0	0	110.6
447	H	28.1	Very low	25.5	Very low	157 Å²	157	132.1 Å²	132.1	73%	0.727	74%	0.738	S	S	*	*			trans	18.7	132.3	154.5	-71.6	-80.4	0	0	0	120.1
448	N	24.5	Very low	25.6	Very low	149 Å²	149	130 Å²	130	80%	0.797	74%	0.737	S	S	*	*				-167.3	-173.1	69.5	-118.2	-13.9	0	0	0	114.9
449	T	28.8	Very low	25.6	Very low	122 Å²	122	132.7 Å²	132.7	75%	0.748	74%	0.744	S	S	*	*			trans	-85.5	166.5	179.5	47.2	0	0	0	0	115.1
450	E	25.7	Very low	25.7	Very low	197 Å²	197	132 Å²	132	92%	0.921	75%	0.745	S	S	*	*			trans	75.2	152.9	155.4	-165	169.4	-154	0	0	118
451	G	23	Very low	25.6	Very low	59 Å²	59	131 Å²	131	61%	0.608	75%	0.748	S	S	*	*			trans	101	93	148.8	0	0	0	0	0	120
452	T	21.8	Very low	25.4	Very low	131 Å²	131	129.9 Å²	129.9	80%	0.804	75%	0.745	S	S	*	*				48.3	100	107.9	-47.7	0	0	0	0	120.2
453	C	22.4	Very low	25.4	Very low	104 Å²	104	126 Å²	126	70%	0.703	74%	0.742	S	S	*	*				79.4	131.9	127.2	-68.2	0	0	0	0	125.1
454	T	24	Very low	25.3	Very low	113 Å²	113	123.1 Å²	123.1	69%	0.693	74%	0.74	S	S	*	*				83.5	151.8	126.9	57	0	0	0	0	123.6
455	N	24.1	Very low	25.5	Very low	144 Å²	144	123.9 Å²	123.9	77%	0.77	74%	0.744	S	S	*	*			trans	77.5	146.1	157.6	-58.3	-30.3	0	0	0	118.3
456	S	23.7	Very low	25.5	Very low	99 Å²	99	125.5 Å²	125.5	69%	0.692	75%	0.751	S	S	*	*			cis	-174.5	148.1	-16.8	52.5	0	0	0	0	113.3
457	L	23.5	Very low	25.7	Very low	154 Å²	154	123.4 Å²	123.4	81%	0.806	75%	0.747	S	S	*	*			trans	72.8	151.1	140.1	-163.6	63.6	0	0	0	121.8
458	T	27.5	Very low	25.6	Very low	119 Å²	119	122 Å²	122	73%	0.73	74%	0.744	S	S	*	*			trans	68.8	143.2	167	30.4	0	0	0	0	117.9
459	D	26.3	Very low	25.9	Very low	149 Å²	149	122.7 Å²	122.7	80%	0.797	74%	0.743	S	S	*	*			cis	-160.5	174.7	-12.8	-154.9	0.5	0	0	0	112.2
460	A	28.2	Very low	25.8	Very low	85 Å²	85	122.9 Å²	122.9	70%	0.702	74%	0.744	S	S	*	*			trans	45.9	137.9	148.5	0	0	0	0	0	121.2
461	A	27.1	Very low	25.9	Very low	94 Å²	94	119.3 Å²	119.3	78%	0.777	74%	0.735	S	S	*	*			cis	-165.8	160.4	4.3	0	0	0	0	0	108.6
462	S	25.6	Very low	26.1	Very low	101 Å²	101	124 Å²	124	71%	0.706	75%	0.746	S	S	*	*			cis	-167.3	161.6	-3.5	44.9	0	0	0	0	111.1
463	C	27.2	Very low	26.6	Very low	118 Å²	118	123 Å²	123	80%	0.797	74%	0.74	S	S	*	*			trans	72	131.4	170.1	-59.4	0	0	0	0	116.4
464	T	25.6	Very low	27	Very low	119 Å²	119	122.2 Å²	122.2	73%	0.73	74%	0.736	S	S	*	*			cis	-148.7	131.4	0.2	14.4	0	0	0	0	108.5
465	V	28.7	Very low	27.4	Very low	122 Å²	122	123.3 Å²	123.3	74%	0.739	74%	0.743	S	S	*	*				58.5	125	94.1	180	0	0	0	0	112.7
466	T	27.2	Very low	27.6	Very low	120 Å²	120	121.2 Å²	121.2	74%	0.736	73%	0.731	S	S	*	*			cis	-137.6	150	10	24.2	0	0	0	0	109.3
467	I	26	Very low	27.9	Very low	136 Å²	136	126.7 Å²	126.7	70%	0.697	74%	0.743	S	S	*	*			cis	98.2	110	40.6	-71	175.3	0	0	0	114.9
468	N	26.4	Very low	28.3	Very low	127 Å²	127	128.9 Å²	128.9	68%	0.679	74%	0.741	S	S	*	*			trans	69	107.5	145.2	-67	8.9	0	0	0	125.1
469	Q	31.4	Very low	28.5	Very low	164 Å²	164	127.9 Å²	127.9	77%	0.766	75%	0.745	S	S	*	*				73.8	163	113.5	-72.6	-172.3	-34.3	0	0	123
470	T	25.9	Very low	28.6	Very low	125 Å²	125	125.4 Å²	125.4	77%	0.767	74%	0.738	S	S	*	*			trans	73.4	121.5	162.3	38.3	0	0	0	0	119.5
471	V	28.4	Very low	28.6	Very low	122 Å²	122	132 Å²	132	74%	0.739	75%	0.751	S	S	*	*			trans	46.9	113.4	137.2	-171.8	0	0	0	0	117.3	V473	V471-V473 HydrophobicContact CG1-CB 4.47Å; V471-V473 HydrophobicContact CG1-CG2 3.82Å
472	D	27.2	Very low	28.8	Very low	157 Å²	157	133.1 Å²	133.1	84%	0.84	75%	0.749	S	S	*	*			trans	-110.9	127	149.2	-169.4	-3.4	0	0	0	109.2
473	V	32.7	Very low	29.2	Very low	110 Å²	110	135 Å²	135	67%	0.667	76%	0.755	S	S	*	*			trans	-145.6	128.9	170.8	178.8	0	0	0	0	108.1	V471	V471-V473 HydrophobicContact CG1-CB 4.47Å; V471-V473 HydrophobicContact CG1-CG2 3.82Å
474	S	31.3	Very low	29.5	Very low	89 Å²	89	135.3 Å²	135.3	62%	0.622	76%	0.759	S	S	*	*			trans	75.9	130.4	160.3	68.4	0	0	0	0	120.5
475	T	30.5	Very low	29.6	Very low	136 Å²	136	141 Å²	141	83%	0.834	77%	0.767	S	S	*	*			trans	68.9	146.7	145.2	51.4	0	0	0	0	119.4
476	D	29.3	Very low	29.8	Very low	100 Å²	100	139.6 Å²	139.6	54%	0.535	77%	0.769	S	S	.	*			cis	-164.6	145.3	-16.5	169.6	24.5	0	0	0	106.1	R478	D476-R478 PolarHBondContact OD1-N 3.04Å
477	F	30.5	Very low	29.9	Very low	214 Å²	214	140 Å²	140	94%	0.939	77%	0.771	S	S	*	*			trans	-155.5	90.2	147.3	-95.3	-59.5	0	0	0	112
478	R	31.5	Very low	30	Very low	200 Å²	200	136.5 Å²	136.5	76%	0.755	76%	0.759	S	S	*	*			trans	-46.4	137	161	-66.2	160	153	-97.1	-0.1	113.5	D476	D476-R478 PolarHBondContact OD1-N 3.04Å
479	A	32.1	Very low	30	Very low	98 Å²	98	134.9 Å²	134.9	81%	0.81	76%	0.763	S	S	*	*			trans	-171.6	81.8	132.1	0	0	0	0	0	113.7
480	C	27	Very low	29.8	Very low	97 Å²	97	136.5 Å²	136.5	66%	0.655	76%	0.762	S	S	*	*			trans	-3.5	130.9	149.7	-51.2	0	0	0	0	120.3
481	F	28.6	Very low	29.8	Very low	222 Å²	222	136.3 Å²	136.3	97%	0.974	76%	0.763	S	S	*	*			trans	-145.8	100.6	134.7	-96.2	-69.3	0	0	0	110.8
482	T	32.7	Very low	29.5	Very low	119 Å²	119	135.2 Å²	135.2	73%	0.73	76%	0.761	S	S	*	*			trans	-114.7	123.2	180	48.6	0	0	0	0	111.8	S484	T482-S484 PolarHBondContact O-N 2.92Å
483	T	33.2	Very low	29.5	Very low	139 Å²	139	133.7 Å²	133.7	85%	0.853	76%	0.757	S	S	*	*			trans	24.7	93.2	145.5	57.1	0	0	0	0	117.7	R485	T483-R485 PolarHBondContact O-N 3.36Å
484	S	32.6	Very low	29.2	Very low	125 Å²	125	134.3 Å²	134.3	87%	0.874	76%	0.761	S	S	*	*			trans	-84.9	89.4	171.9	57	0	0	0	0	112.3	T482	T482-S484 PolarHBondContact O-N 2.92Å
485	R	28.8	Very low	29.1	Very low	238 Å²	238	134.9 Å²	134.9	90%	0.898	77%	0.765	S	S	*	*			trans	-75.5	125.2	158.7	-175.4	-177.1	-175.3	-168.2	1.8	107.9	T483	T483-R485 PolarHBondContact O-N 3.36Å
486	A	31.8	Very low	29	Very low	93 Å²	93	135.1 Å²	135.1	77%	0.769	77%	0.766	S	S	*	*			trans	-77.8	139.5	-175.5	0	0	0	0	0	113.2
487	T	29.4	Very low	29.1	Very low	129 Å²	129	135.1 Å²	135.1	79%	0.791	77%	0.774	S	S	*	*			trans	-155.6	138.6	157.9	-42.3	0	0	0	0	105.4
488	S	29.5	Very low	28.9	Very low	63 Å²	63	129.7 Å²	129.7	44%	0.441	76%	0.763	S	S	.	*			trans	-105.5	159.4	-170	138.8	0	0	0	0	112.8	E111	E111-S488 VanDerWaalsContact CD-CB 3.5Å; E111-S488 WeakPolarHBondContact OE1-CB 3.36Å; E111-S488 PolarHBondContact OE1-OG 3.06Å; E111-S488 WeakPolarHBondContact OE2-CA 3.37Å; E111-S488 WeakPolarHBondContact OE2-CB 3.44Å; E111-S488 PolarHBondContact OE2-N 2.8Å; E111-S488 PolarHBondContact OE2-OG 2.99Å
489	A	25.2	Very low	28.7	Very low	93 Å²	93	127.3 Å²	127.3	77%	0.769	77%	0.765	S	S	*	*			trans	-154.1	127.7	158.4	0	0	0	0	0	107.7
490	R	28.5	Very low	28.7	Very low	197 Å²	197	129.3 Å²	129.3	74%	0.743	77%	0.767	S	S	*	*			trans	-93.1	143.9	-179.7	-74	-178.9	170.9	-171	-2.1	112.3	Y113	Y113-R490 PolarHBondContact OH-NH2 3.36Å; Y113-R490 VanDerWaalsContact OH-NH2 3.09Å
491	P	25.5	Very low	29.2	Very low	121 Å²	121	132 Å²	132	79%	0.786	78%	0.775	S	S	*	*				-116.3	139.7	114.9	-4.7	24.8	0	0	0	110.5
492	S	21.9	Very low	29.2	Very low	99 Å²	99	129.1 Å²	129.1	69%	0.692	77%	0.768	S	S	*	*				76.4	85.4	64.2	-161.4	0	0	0	0	112.5
493	V	26.7	Very low	29.2	Very low	125 Å²	125	129 Å²	129	76%	0.758	77%	0.767	S	S	*	*				102.6	157.4	97.1	160	0	0	0	0	111.7
494	V	27.9	Very low	28.9	Very low	124 Å²	124	129.2 Å²	129.2	75%	0.752	76%	0.761	S	S	*	*			trans	72.9	119.7	-172.5	-162.8	0	0	0	0	112.7
495	S	27.6	Very low	28.5	Very low	101 Å²	101	130.3 Å²	130.3	71%	0.706	75%	0.754	S	S	*	*			cis	106.8	140.8	20.4	-66.2	0	0	0	0	113.4
496	T	28.6	Very low	28.6	Very low	141 Å²	141	124.3 Å²	124.3	87%	0.865	74%	0.739	S	S	*	*			trans	64.2	148.4	169.1	45.3	0	0	0	0	117.6
497	S	31	Very low	28.5	Very low	99 Å²	99	127.6 Å²	127.6	69%	0.692	74%	0.736	S	S	*	*			cis	-157.3	143.7	-2.9	46.5	0	0	0	0	113.4
498	S	28	Very low	28.5	Very low	101 Å²	101	131.1 Å²	131.1	71%	0.706	74%	0.741	S	S	*	*			trans	37.4	122.4	132.1	-43.8	0	0	0	0	122.5
499	N	26.4	Very low	28.7	Very low	150 Å²	150	138.2 Å²	138.2	80%	0.802	76%	0.758	S	S	*	*			trans	55.1	116.6	137.4	-53.5	-0.6	0	0	0	120.8
500	T	32.8	Very low	29.1	Very low	139 Å²	139	139.8 Å²	139.8	85%	0.853	76%	0.76	S	S	*	*				-169.3	139.7	112.2	11.8	0	0	0	0	112.6
501	D	36.5	Very low	29	Very low	155 Å²	155	136.9 Å²	136.9	83%	0.829	76%	0.759	S	S	*	*			trans	-76.4	138.3	162.4	-71.2	-66.9	0	0	0	110.5
502	I	29.4	Very low	29	Very low	161 Å²	161	139.4 Å²	139.4	83%	0.826	76%	0.76	S	S	*	*			trans	-132.1	130	160.1	-61	-176.6	0	0	0	108.4
503	T	31.3	Very low	29.2	Very low	116 Å²	116	144.6 Å²	144.6	71%	0.712	77%	0.765	S	S	*	*			trans	-122.9	177.7	-176.1	50.8	0	0	0	0	111.1
504	M	26.9	Very low	29.1	Very low	144 Å²	144	144.9 Å²	144.9	71%	0.709	76%	0.758	S	S	*	*			trans	95.6	105.7	157.5	-60.2	-78.6	-80	0	0	120.7
505	M	25.7	Very low	29	Very low	148 Å²	148	145 Å²	145	73%	0.729	76%	0.755	S	S	*	*				70.8	163.8	127.2	-55.8	-64.1	173.9	0	0	118.2
506	N	29.5	Very low	29.1	Very low	112 Å²	112	148.8 Å²	148.8	60%	0.599	76%	0.761	S	S	*	*			cis	-161.7	151.6	26.4	-138	-24.7	0	0	0	115.9
507	K	30.2	Very low	29.1	Very low	161 Å²	161	151.4 Å²	151.4	70%	0.7	76%	0.76	S	S	*	*			trans	59.8	107.5	148.3	-78.4	150.4	-164.9	162.6	0	123.9
508	K	30.8	Very low	29.1	Very low	203 Å²	203	156.2 Å²	156.2	88%	0.883	77%	0.772	S	S	*	*				85.5	145.3	120.4	-71.7	-169	172.8	-165.5	0	122
509	R	33.6	Very low	29	Very low	213 Å²	213	160 Å²	160	80%	0.804	78%	0.776	S	S	*	*			trans	-90.6	172.2	-179.8	-71.5	-175.2	-178.3	156.7	-1.7	113.6
510	P	33	Very low	29	Very low	126 Å²	126	159 Å²	159	82%	0.818	78%	0.78	S	S	*	*				-114.7	171	112.8	35.6	-35.4	0	0	0	113.8
511	D	25.5	Very low	28.9	Very low	135 Å²	135	156.5 Å²	156.5	72%	0.722	77%	0.765	S	S	*	*			trans	-96.7	161.4	-170	-48.3	-80.9	0	0	0	113.4
512	E	26.2	Very low	28.4	Very low	174 Å²	174	153.6 Å²	153.6	81%	0.813	76%	0.762	S	S	*	*				-171.5	162.1	121.9	-162.7	141.7	-143.9	0	0	112.4
513	W	25.4	Very low	28.4	Very low	209 Å²	209	151.1 Å²	151.1	79%	0.792	76%	0.758	S	S	*	*			trans	-54.6	167.7	177.2	-87.6	-45.4	0	0	0	117.8
514	Q	25.8	Very low	28.3	Very low	131 Å²	131	150.3 Å²	150.3	61%	0.612	76%	0.757	S	S	*	*			cis	-151.1	156	-1.7	-82.7	-128.8	-13.8	0	0	111.1
515	N	25.8	Very low	28.4	Very low	126 Å²	126	149.8 Å²	149.8	67%	0.674	76%	0.762	S	S	*	*			trans	57.4	169.9	151.6	-55.2	-14.5	0	0	0	118.1
516	E	28.1	Very low	28.6	Very low	180 Å²	180	149.6 Å²	149.6	84%	0.841	76%	0.764	S	S	*	*			cis	-136.8	176.4	-5.1	-149	167.3	154.4	0	0	111.3
517	K	29.9	Very low	28.4	Very low	196 Å²	196	156.7 Å²	156.7	85%	0.852	78%	0.783	S	S	*	*			trans	-80.5	137.6	179.7	-56.7	167.4	-174.7	168.1	0	111.5
518	Q	30.1	Very low	28.3	Very low	201 Å²	201	154.2 Å²	154.2	94%	0.939	79%	0.785	S	S	*	*			trans	-150.4	153.8	132.2	-111.7	169.9	41.7	0	0	110.3
519	K	26.6	Very low	28.1	Very low	181 Å²	181	154.5 Å²	154.5	79%	0.787	78%	0.782	S	S	*	*			trans	-130.4	92.7	-158.6	-174	-161.9	-175.8	-167.2	0	110.8	V521	K519-V521 HydrophobicContact CD-CG2 3.78Å; K519-V521 HydrophobicContact CG-CG2 3.84Å; K519-V521 PolarHBondContact O-N 3.09Å
520	S	27	Very low	27.6	Very low	128 Å²	128	149.6 Å²	149.6	90%	0.895	78%	0.781	S	S	*	*			trans	-76.4	106.4	167.8	31.4	0	0	0	0	109.8
521	V	29.5	Very low	27.3	Very low	87 Å²	87	150.8 Å²	150.8	53%	0.527	78%	0.776	S	S	.	*			trans	-92.4	117.3	177.5	-177.3	0	0	0	0	109.4	K519	K519-V521 HydrophobicContact CD-CG2 3.78Å; K519-V521 HydrophobicContact CG-CG2 3.84Å; K519-V521 PolarHBondContact O-N 3.09Å
522	A	26.6	Very low	27.3	Very low	93 Å²	93	151.5 Å²	151.5	77%	0.769	78%	0.779	S	S	*	*			trans	-82.6	116.6	157.5	0	0	0	0	0	107.9	S524	A522-S524 PolarHBondContact O-N 3.47Å
523	C	28.1	Very low	27.2	Very low	110 Å²	110	148 Å²	148	74%	0.743	77%	0.773	S	S	*	*			trans	-84.2	88.4	179.2	-69	0	0	0	0	111
524	S	30.8	Very low	27.3	Very low	99 Å²	99	145.1 Å²	145.1	69%	0.692	77%	0.771	S	S	*	*			trans	-69.8	122	156.7	49.5	0	0	0	0	109.2	A522 D526	A522-S524 PolarHBondContact O-N 3.47Å; S524-D526 PolarHBondContact O-N 3.2Å; S524-D526 VanDerWaalsContact O-N 3.09Å
525	T	29.2	Very low	27.3	Very low	133 Å²	133	145.7 Å²	145.7	82%	0.816	78%	0.779	S	S	*	*			trans	-84.8	75.1	-178.4	51.5	0	0	0	0	112
526	D	29	Very low	27.4	Very low	143 Å²	143	145 Å²	145	77%	0.765	78%	0.779	S	S	*	*			trans	-106.2	114.1	161.6	-74.3	-52.3	0	0	0	108.8	S524 S528	S524-D526 PolarHBondContact O-N 3.2Å; S524-D526 VanDerWaalsContact O-N 3.09Å; D526-S528 PolarHBondContact O-N 3.07Å
527	W	25.1	Very low	27.3	Very low	262 Å²	262	144.7 Å²	144.7	99%	0.992	78%	0.778	S	S	*	*			trans	-89.5	99.9	175.7	-81.8	-26.5	0	0	0	110.9
528	S	27.9	Very low	27.1	Very low	108 Å²	108	144 Å²	144	76%	0.755	78%	0.78	S	S	*	*			trans	-90.3	121.9	160.4	59.8	0	0	0	0	110.1	D526	D526-S528 PolarHBondContact O-N 3.07Å
529	Y	26.2	Very low	26.9	Very low	209 Å²	209	138.9 Å²	138.9	82%	0.82	77%	0.771	S	S	*	*			trans	-60.6	140.8	172.1	-159.2	-96.5	0	0	0	110.3
530	S	23.4	Very low	26.9	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	77%	0.774	S	S	*	*			trans	-135	124.3	-176.8	62	0	0	0	0	110.6
531	E	26.7	Very low	26.8	Very low	151 Å²	151	138.2 Å²	138.2	71%	0.706	77%	0.768	S	S	*	*			trans	-135	121.4	179.5	-165	160.2	-176.7	0	0	109.7
532	D	25.6	Very low	26.7	Very low	150 Å²	150	144 Å²	144	80%	0.802	79%	0.786	S	S	*	*			trans	22.3	145.3	149.2	-73.1	15	0	0	0	122.3
533	C	25.1	Very low	26.7	Very low	100 Å²	100	143 Å²	143	68%	0.676	78%	0.784	S	S	*	*			cis	-172.2	174.4	-16.5	-162.5	0	0	0	0	107.8
534	I	26.9	Very low	26.5	Very low	148 Å²	148	144 Å²	144	76%	0.759	79%	0.793	S	S	*	*			trans	70.1	137.9	167.8	-57.9	168	0	0	0	112.2
535	D	26.3	Very low	26.3	Very low	143 Å²	143	142.3 Å²	142.3	77%	0.765	79%	0.791	S	S	*	*			cis	-149.9	-157.6	39.3	-148.4	-24.8	0	0	0	114.8
536	T	26.8	Very low	26.3	Very low	111 Å²	111	146.1 Å²	146.1	68%	0.681	80%	0.796	S	S	*	*			trans	-133.8	161.2	-148.9	-32	0	0	0	0	113.6
537	Q	26.5	Very low	26	Very low	174 Å²	174	144.5 Å²	144.5	81%	0.813	80%	0.796	S	S	*	*			trans	83	123.2	159.9	-55.4	-164.9	9.4	0	0	122.1
538	M	25.4	Very low	26.5	Very low	183 Å²	183	137.4 Å²	137.4	90%	0.901	78%	0.784	S	S	*	*			trans	17.1	125.4	138	-55.8	-172.5	-175.8	0	0	122.2
539	A	26.7	Very low	26.3	Very low	92 Å²	92	137 Å²	137	76%	0.76	78%	0.781	S	S	*	*				173.4	125.8	108.7	0	0	0	0	0	110.4
540	M	25.1	Very low	26.4	Very low	172 Å²	172	133.2 Å²	133.2	85%	0.847	78%	0.779	S	S	*	*				45	89.7	75.3	-78.6	-69.6	-173.4	0	0	113.4
541	T	26.2	Very low	26.5	Very low	123 Å²	123	134.5 Å²	134.5	76%	0.755	78%	0.777	S	S	*	*				177.3	154.2	77	34.6	0	0	0	0	114.9
542	K	27.6	Very low	26.5	Very low	210 Å²	210	132.2 Å²	132.2	91%	0.913	78%	0.778	S	S	*	*			trans	9.3	128.3	151.3	-59.4	174	179.4	175.3	0	121.7
543	G	25.4	Very low	26.7	Very low	71 Å²	71	133.6 Å²	133.6	73%	0.732	78%	0.784	S	S	*	*			trans	160.8	119.3	151.6	0	0	0	0	0	111.1
544	S	25.3	Very low	26.9	Very low	132 Å²	132	138 Å²	138	92%	0.923	79%	0.792	S	S	*	*				50	107	60	-177.8	0	0	0	0	112.6
545	G	25.1	Very low	27.6	Very low	63 Å²	63	136.2 Å²	136.2	65%	0.649	79%	0.79	S	S	*	*			cis	155.2	-164.9	6.1	0	0	0	0	0	110.4
546	K	29.8	Very low	27.5	Very low	213 Å²	213	136.5 Å²	136.5	93%	0.926	79%	0.791	S	S	*	*			trans	80.2	113.8	176.7	-53.3	176.4	179.3	177	0	117.6
547	S	24.1	Very low	27.7	Very low	109 Å²	109	134.5 Å²	134.5	76%	0.762	79%	0.793	S	S	*	*			trans	-68	158.9	143	54.2	0	0	0	0	110.2
548	P	34.5	Very low	27.7	Very low	113 Å²	113	132 Å²	132	73%	0.734	79%	0.786	S	S	*	*				-122.1	163.4	63.9	9.7	14.9	0	0	0	112.3
549	S	23.8	Very low	27.7	Very low	100 Å²	100	132.3 Å²	132.3	70%	0.699	78%	0.782	S	S	*	*			cis	77.8	142	36.3	88.9	0	0	0	0	115.9
550	V	28	Very low	27.8	Very low	129 Å²	129	135.2 Å²	135.2	78%	0.782	78%	0.784	S	S	*	*			trans	71.2	131.9	170.9	179.9	0	0	0	0	114.4
551	D	25.3	Very low	27.9	Very low	138 Å²	138	133.1 Å²	133.1	74%	0.738	78%	0.776	S	S	*	*			cis	-159.3	171.7	-22.2	-123	-50.1	0	0	0	112.1
552	S	26.5	Very low	28	Very low	102 Å²	102	134.5 Å²	134.5	71%	0.713	77%	0.772	S	S	*	*			trans	-32.4	141	172.1	64	0	0	0	0	118.7
553	L	30.1	Very low	28	Very low	180 Å²	180	130.7 Å²	130.7	94%	0.942	76%	0.762	S	S	*	*			trans	-137.3	129.5	143.6	-106.7	172.5	0	0	0	112.1
554	K	29.6	Very low	28.1	Very low	192 Å²	192	136.7 Å²	136.7	84%	0.835	77%	0.768	S	S	*	*			trans	-82.7	178.4	174.5	-113.1	173.2	-174.9	175.7	0	109.8
555	P	41.5	Very low	28.2	Very low	111 Å²	111	138.2 Å²	138.2	72%	0.721	77%	0.765	S	S	*	*			cis	-141.7	-176.3	-6.6	42.1	-24.2	0	0	0	116.1
556	N	23.9	Very low	28.4	Very low	148 Å²	148	143.9 Å²	143.9	79%	0.791	77%	0.774	S	S	*	*			trans	70.2	138.3	141.2	-145.2	14.2	0	0	0	121.7
557	G	30.6	Very low	28.4	Very low	70 Å²	70	142.5 Å²	142.5	72%	0.722	78%	0.776	S	S	*	*			trans	162.1	116.6	173	0	0	0	0	0	111.2
558	N	27.7	Very low	28.5	Very low	122 Å²	122	148.4 Å²	148.4	65%	0.652	78%	0.781	S	S	*	*			trans	-111	156.5	-170.5	-62.9	-23.9	0	0	0	113.1
559	F	25.3	Very low	28.2	Very low	189 Å²	189	152.3 Å²	152.3	83%	0.829	79%	0.787	S	S	*	*			trans	70.1	145.6	165	-57.1	-71.5	0	0	0	117.7
560	L	28.6	Very low	28.5	Very low	152 Å²	152	153.4 Å²	153.4	80%	0.796	79%	0.792	S	S	*	*			cis	-103	-127.6	-11.6	-69.5	86.7	0	0	0	109.2
561	N	26.9	Very low	28.5	Very low	128 Å²	128	153.7 Å²	153.7	68%	0.684	80%	0.798	S	S	*	*			cis	-155.1	156.7	-9.4	-139.3	51.2	0	0	0	105.3
562	K	28.8	Very low	28.5	Very low	153 Å²	153	150.4 Å²	150.4	67%	0.665	80%	0.796	S	S	*	*			cis	60.1	128.7	46.3	-71.6	-163.9	149.1	-122.7	0	114.8
563	D	26.9	Very low	28.8	Very low	130 Å²	130	153.4 Å²	153.4	70%	0.695	80%	0.803	S	S	*	*			cis	-146	178	-3.2	-95.6	-38.8	0	0	0	109.8
564	F	28.2	Very low	28.8	Very low	197 Å²	197	150.9 Å²	150.9	86%	0.864	80%	0.795	S	S	*	*			trans	-77.1	168.4	173	-89.5	-102.5	0	0	0	112.9
565	L	27.3	Very low	28.7	Very low	163 Å²	163	148.8 Å²	148.8	85%	0.853	79%	0.793	S	S	*	*			trans	66.1	102.5	174.7	-84.2	69.4	0	0	0	116.8
566	E	28.7	Very low	28.2	Very low	183 Å²	183	149.8 Å²	149.8	86%	0.855	79%	0.792	S	S	*	*				-164.8	99.8	123.9	-118	-169.4	-164.5	0	0	112.4
567	L	29	Very low	28.7	Very low	184 Å²	184	151.7 Å²	151.7	96%	0.963	79%	0.793	S	S	*	*			trans	-140.2	70.5	161.6	-91.6	-177.3	0	0	0	111
568	R	27.4	Very low	28.7	Very low	232 Å²	232	158.3 Å²	158.3	88%	0.875	80%	0.802	S	S	*	*			trans	-140.2	80.4	162.7	-165.7	-168.5	-170.1	-152.2	3.8	112
569	K	28.1	Very low	28.7	Very low	196 Å²	196	159.6 Å²	159.6	85%	0.852	80%	0.803	S	S	*	*			trans	-159.1	147.4	149.3	-101.9	137.4	-171.7	174.5	0	110.6
570	P	30.4	Very low	29.5	Very low	123 Å²	123	155.6 Å²	155.6	80%	0.799	80%	0.796	S	S	*	*			trans	-83.4	147	-178.5	33.8	-34.4	0	0	0	111.7	G572	P570-G572 PolarHBondContact O-N 2.74Å
571	C	27.5	Very low	29.7	Very low	135 Å²	135	156.6 Å²	156.6	91%	0.912	80%	0.797	S	S	*	*			trans	-71.3	115.4	166.7	-72.3	0	0	0	0	110.2
572	G	25.6	Very low	29.9	Very low	68 Å²	68	162.2 Å²	162.2	70%	0.701	81%	0.809	S	S	*	*			trans	-75.5	160.8	169.5	0	0	0	0	0	112.4	P570	P570-G572 PolarHBondContact O-N 2.74Å
573	I	32.2	Very low	30	Very low	165 Å²	165	163.1 Å²	163.1	85%	0.846	82%	0.815	S	S	*	*			trans	-92.2	106.3	-178.1	-59.9	172.1	0	0	0	110.6
574	T	29.9	Very low	30.1	Very low	128 Å²	128	163 Å²	163	79%	0.785	82%	0.819	S	S	*	*			trans	-149.6	135	159.2	48.9	0	0	0	0	106.6
575	D	28.7	Very low	30.1	Very low	147 Å²	147	161.5 Å²	161.5	79%	0.786	82%	0.815	S	S	*	*			cis	-122.2	149.9	19.3	-103.3	-49.4	0	0	0	113.8
576	L	31.6	Very low	30.3	Very low	133 Å²	133	159.9 Å²	159.9	70%	0.696	81%	0.806	S	S	*	*			trans	-126.2	97.2	166.7	-171.1	79.8	0	0	0	110.1
577	K	32.6	Very low	30.2	Very low	187 Å²	187	160 Å²	160	81%	0.813	80%	0.804	S	S	*	*			trans	-140.9	84.2	172	-81.8	-170.6	176.5	169.2	0	113.6
578	K	31.5	Very low	30.8	Very low	210 Å²	210	159.4 Å²	159.4	91%	0.913	79%	0.794	S	S	*	*			trans	-175.8	80.5	140.5	-99.8	158.7	-175	-180	0	111.6
579	H	26.9	Very low	31	Very low	148 Å²	148	154.7 Å²	154.7	69%	0.685	79%	0.786	S	S	*	*			trans	-72.5	171.5	152.1	-69.5	-68.3	0	0	0	109.2
580	P	43.8	Very low	31.6	Very low	105 Å²	105	151 Å²	151	68%	0.682	78%	0.78	S	S	*	*			cis	-130.4	-174.6	17.6	25	1.1	0	0	0	113.8
581	E	31.1	Very low	32	Very low	174 Å²	174	153.7 Å²	153.7	81%	0.813	78%	0.782	S	S	*	*			cis	-164.2	128.2	-17.4	-107.5	153.4	-140.1	0	0	108.5
582	R	31.4	Very low	32.9	Very low	245 Å²	245	155.2 Å²	155.2	93%	0.925	77%	0.773	S	S	*	*			trans	-170.4	140.2	135.6	-162.6	156.3	-69.4	-155.9	-2.6	109.9
583	E	31.4	Very low	34.1	Very low	173 Å²	173	159.6 Å²	159.6	81%	0.808	78%	0.781	S	S	*	*			trans	-72.1	160.8	176.5	-66.3	155.8	126.6	0	0	110.5
584	V	28.2	Very low	35	Very low	128 Å²	128	158.4 Å²	158.4	78%	0.776	78%	0.775	S	S	*	*				-152.5	143.7	60	161.6	0	0	0	0	112.9
585	Q	29.6	Very low	36.3	Very low	164 Å²	164	156 Å²	156	77%	0.766	76%	0.762	S	S	*	*			trans	37.9	134.4	163.5	-100.3	60.6	0.1	0	0	123.1
586	L	30	Very low	38.5	Very low	130 Å²	130	151.9 Å²	151.9	68%	0.681	74%	0.744	S	S	*	*			trans	-64.9	152.6	160.1	-72.8	63.6	0	0	0	111.1
587	F	28.2	Very low	40.4	Very low	185 Å²	185	151.2 Å²	151.2	81%	0.811	74%	0.739	S	S	*	*				-126.6	139.7	108.8	-106.1	-91.8	0	0	0	109.6
588	K	41.1	Very low	42.2	Very low	171 Å²	171	146.1 Å²	146.1	74%	0.743	73%	0.726	S	S	*	*			trans	-119.1	73.8	171.9	-85.9	-168.2	173.7	-173.4	0	107.8	T590	K588-T590 PolarHBondContact O-N 3.48Å
589	D	32.1	Very low	44.4	Very low	133 Å²	133	139.2 Å²	139.2	71%	0.711	70%	0.704	S	S	*	*			trans	-77.9	112.6	167.1	-74	-50.4	0	0	0	108.8	E591	D589-E591 PolarHBondContact O-N 2.95Å; D589-E591 VanDerWaalsContact O-N 3.07Å
590	T	39.9	Very low	47	Very low	119 Å²	119	137.1 Å²	137.1	73%	0.73	69%	0.694	S	S	*	*			trans	-79.5	83.1	167.2	-54	0	0	0	0	105.8	K588 K592	K588-T590 PolarHBondContact O-N 3.48Å; T590-K592 PolarHBondContact O-N 3.11Å
591	E	38.9	Very low	48.9	Very low	180 Å²	180	138.9 Å²	138.9	84%	0.841	69%	0.691	S	S	*	*			trans	-64.5	85.8	171.3	-170.5	160.5	-148.6	0	0	108	D589	D589-E591 PolarHBondContact O-N 2.95Å; D589-E591 VanDerWaalsContact O-N 3.07Å
592	K	46.8	Very low	51.6	Low	166 Å²	166	135.3 Å²	135.3	72%	0.722	68%	0.677	S	S	*	*			trans	-58.7	134.7	163.3	-59.9	171.4	-176.4	173	0	106.1	T590 L594	T590-K592 PolarHBondContact O-N 3.11Å; K592-L594 VanDerWaalsContact C-N 3.27Å; K592-L594 PolarHBondContact O-N 2.88Å
593	D	49.9	Very low	54.1	Low	161 Å²	161	129 Å²	129	86%	0.861	66%	0.659	S	S	*	*			trans	-53.8	91.3	174.2	-59	-83	0	0	0	110.7	P595	D593-P595 VanDerWaalsContact O-CD 3.32Å; D593-P595 WeakPolarHBondContact O-CD 3.48Å
594	L	52.2	Low	56.8	Low	139 Å²	139	125.6 Å²	125.6	73%	0.728	64%	0.643	S	S	*	*			trans	-77.7	112.8	178.1	-152	75.8	0	0	0	104.8	K592 S596	K592-L594 VanDerWaalsContact C-N 3.27Å; K592-L594 PolarHBondContact O-N 2.88Å; L594-S596 PolarHBondContact O-N 3.41Å
595	P	56.5	Low	59.7	Low	77 Å²	77	128.5 Å²	128.5	50%	0.5	64%	0.64	S	S	.	*			trans	-56.4	122	-177.2	23.6	-33.3	0	0	0	107.3	D593 C599	D593-P595 VanDerWaalsContact O-CD 3.32Å; D593-P595 WeakPolarHBondContact O-CD 3.48Å; P595-C599 HydrophobicContact CB-CB 4.14Å
596	S	74.7	Confident	62.5	Low	61 Å²	61	123.2 Å²	123.2	43%	0.427	63%	0.625	S	S	.	*			trans	-47.7	153.6	-164.1	76	0	0	0	0	112.3	L594 C598 C599 Q600	L594-S596 PolarHBondContact O-N 3.41Å; S596-C598 CarbonylContact O-C 3.54Å; S596-C598 PolarHBondContact O-N 3.29Å; S596-C598 PolarHBondContact OG-N 3.07Å; S596-C599 WeakPolarHBondContact O-CA 3.49Å; S596-C599 PolarHBondContact O-N 3.28Å; S596-C599 PolarHBondContact OG-N 3.21Å; S596-C599 PolarHBondContact OG-SG 3.32Å; S596-Q600 PolarHBondContact O-N 2.96Å
597	M	70.8	Confident	65.3	Low	119 Å²	119	118.2 Å²	118.2	59%	0.586	60%	0.598	S	S	*	*	H	α-helix	trans	-56.3	-13.6	178.8	-64.9	-57.9	-63.7	0	0	113.6	K601	M597-K601 WeakPolarHBondContact O-CD 3.48Å; M597-K601 WeakPolarHBondContact O-CE 3.21Å; M597-K601 WeakPolarHBondContact O-CG 3.28Å
598	C	72.2	Confident	68.2	Low	80 Å²	80	113.5 Å²	113.5	54%	0.541	58%	0.581	S	S	.	*	H	α-helix	trans	-78	-57.1	164.7	-168	0	0	0	0	111.9	S596 Q600 K601 I602	S596-C598 CarbonylContact O-C 3.54Å; S596-C598 PolarHBondContact O-N 3.29Å; S596-C598 PolarHBondContact OG-N 3.07Å; C598-Q600 VanDerWaalsContact C-N 3.32Å; C598-Q600 PolarHBondContact O-N 3.02Å; C598-K601 WeakPolarHBondContact O-CB 2.75Å; C598-K601 PolarHBondContact O-N 2.94Å; C598-K601 VanDerWaalsContact O-N 3.08Å; C598-I602 WeakPolarHBondContact O-CG1 3.38Å; C598-I602 PolarHBondContact O-N 3.07Å
599	C	76.7	Confident	70.6	Confident	65 Å²	65	108.1 Å²	108.1	44%	0.439	57%	0.569	S	S	.	*	H	α-helix	trans	-54	-43.5	178.2	-59.8	0	0	0	0	113	P595 S596 K601 I602 M603	P595-C599 HydrophobicContact CB-CB 4.14Å; S596-C599 WeakPolarHBondContact O-CA 3.49Å; S596-C599 PolarHBondContact O-N 3.28Å; S596-C599 PolarHBondContact OG-N 3.21Å; S596-C599 PolarHBondContact OG-SG 3.32Å; C599-K601 PolarHBondContact O-N 2.8Å; C599-I602 PolarHBondContact O-N 2.97Å; C599-M603 PolarHBondContact O-N 3.32Å
600	Q	80.7	Confident	73.3	Confident	105 Å²	105	104 Å²	104	49%	0.491	55%	0.545	S	S	.	.	H	α-helix	trans	-63.4	-39.5	177.8	-165.4	-175.5	26.3	0	0	112.2	S596 C598 M603 Q604	S596-Q600 PolarHBondContact O-N 2.96Å; C598-Q600 VanDerWaalsContact C-N 3.32Å; C598-Q600 PolarHBondContact O-N 3.02Å; Q600-M603 PolarHBondContact O-N 2.66Å; Q600-Q604 WeakPolarHBondContact O-CB 3.43Å; Q600-Q604 PolarHBondContact O-N 2.81Å
601	K	85.5	Confident	75.8	Confident	142 Å²	142	99.7 Å²	99.7	62%	0.617	52%	0.518	S	S	*	.	H	α-helix	trans	-66.6	-37.2	174.9	-72.2	173.3	-169.7	177.2	0	112	M597 C598 C599 R605	M597-K601 WeakPolarHBondContact O-CD 3.48Å; M597-K601 WeakPolarHBondContact O-CE 3.21Å; M597-K601 WeakPolarHBondContact O-CG 3.28Å; C598-K601 WeakPolarHBondContact O-CB 2.75Å; C598-K601 PolarHBondContact O-N 2.94Å; C598-K601 VanDerWaalsContact O-N 3.08Å; C599-K601 PolarHBondContact O-N 2.8Å; K601-R605 WeakPolarHBondContact O-CB 3.46Å; K601-R605 PolarHBondContact O-N 2.93Å
602	I	86.8	Confident	78.2	Confident	98 Å²	98	97.1 Å²	97.1	50%	0.503	51%	0.506	S	S	.	.	H	α-helix	trans	-66.8	-46.2	176.1	-64.3	170.9	0	0	0	110.4	C598 C599 Q604 R605 A606	C598-I602 WeakPolarHBondContact O-CG1 3.38Å; C598-I602 PolarHBondContact O-N 3.07Å; C599-I602 PolarHBondContact O-N 2.97Å; I602-Q604 PolarHBondContact O-N 3.24Å; I602-R605 WeakPolarHBondContact O-CB 3.41Å; I602-R605 PolarHBondContact O-N 3.32Å; I602-A606 PolarHBondContact O-N 3.06Å
603	M	84.7	Confident	80.3	Confident	113 Å²	113	94 Å²	94	56%	0.557	50%	0.496	S	S	*	.	H	α-helix	trans	-61.5	-43.9	176.7	-169.6	179.5	-172	0	0	111.8	C599 Q600 R605 A606 I607	C599-M603 PolarHBondContact O-N 3.32Å; Q600-M603 PolarHBondContact O-N 2.66Å; M603-R605 VanDerWaalsContact C-N 3.33Å; M603-R605 PolarHBondContact O-N 3.39Å; M603-A606 PolarHBondContact O-N 3.19Å; M603-I607 HydrophobicContact CE-CD1 4.43Å; M603-I607 HydrophobicContact CG-CD1 4.11Å; M603-I607 WeakPolarHBondContact O-CG1 3.47Å; M603-I607 PolarHBondContact O-N 3.06Å
604	Q	86.5	Confident	82.3	Confident	102 Å²	102	86.4 Å²	86.4	48%	0.477	46%	0.456	S	S	.	.	H	α-helix	trans	-64.1	-37	175.3	-169.3	63.5	60.6	0	0	112.2	Q600 I602 N608	Q600-Q604 WeakPolarHBondContact O-CB 3.43Å; Q600-Q604 PolarHBondContact O-N 2.81Å; I602-Q604 PolarHBondContact O-N 3.24Å; Q604-N608 PolarHBondContact NE2-OD1 2.93Å; Q604-N608 VanDerWaalsContact O-CB 3.3Å; Q604-N608 WeakPolarHBondContact O-CB 3.49Å; Q604-N608 PolarHBondContact O-N 3.13Å; Q604-N608 PolarHBondContact O-OD1 3.37Å
605	R	89.9	Confident	84.2	Confident	188 Å²	188	82.4 Å²	82.4	71%	0.709	44%	0.435	S	S	*	.	H	α-helix	trans	-63.7	-41.7	174.4	-176	-175	-70.8	166.7	-6	111.6	K601 I602 M603 N608 A609	K601-R605 WeakPolarHBondContact O-CB 3.46Å; K601-R605 PolarHBondContact O-N 2.93Å; I602-R605 WeakPolarHBondContact O-CB 3.41Å; I602-R605 PolarHBondContact O-N 3.32Å; M603-R605 VanDerWaalsContact C-N 3.33Å; M603-R605 PolarHBondContact O-N 3.39Å; R605-N608 PolarHBondContact O-N 3.47Å; R605-A609 WeakPolarHBondContact O-CB 3.16Å; R605-A609 PolarHBondContact O-N 3.3Å
606	A	88.6	Confident	85.8	Confident	54 Å²	54	81.5 Å²	81.5	45%	0.446	43%	0.428	S	S	.	.	H	α-helix	trans	-63.1	-52.2	175.9	0	0	0	0	0	111.6	I602 M603 N608 A609 E610	I602-A606 PolarHBondContact O-N 3.06Å; M603-A606 PolarHBondContact O-N 3.19Å; A606-N608 VanDerWaalsContact C-N 3.28Å; A606-N608 PolarHBondContact O-N 2.8Å; A606-A609 WeakPolarHBondContact O-CB 3.36Å; A606-A609 PolarHBondContact O-N 3.32Å; A606-E610 PolarHBondContact O-N 2.91Å
607	I	89.1	Confident	86.5	Confident	24 Å²	24	81.4 Å²	81.4	12%	0.123	42%	0.421	C	S	.	.	H	α-helix	trans	-55	-43.8	176.2	-70.5	168.4	0	0	0	111	M603 A609 E610 L611 I674	M603-I607 HydrophobicContact CE-CD1 4.43Å; M603-I607 HydrophobicContact CG-CD1 4.11Å; M603-I607 WeakPolarHBondContact O-CG1 3.47Å; M603-I607 PolarHBondContact O-N 3.06Å; I607-A609 PolarHBondContact O-N 3.4Å; I607-E610 PolarHBondContact O-N 2.74Å; I607-L611 HydrophobicContact CG2-CD1 3.84Å; I607-L611 WeakPolarHBondContact O-CB 3.43Å; I607-L611 WeakPolarHBondContact O-CD1 3.24Å; I607-L611 WeakPolarHBondContact O-CG 3.43Å; I607-L611 PolarHBondContact O-N 3.29Å; I607-I674 HydrophobicContact CG2-CG2 4.3Å
608	N	88.8	Confident	87.4	Confident	86 Å²	86	76.2 Å²	76.2	46%	0.46	40%	0.395	S	S	.	.	H	α-helix	trans	-64.9	-38.4	177.1	-70.6	0.8	0	0	0	112.7	Q604 R605 A606 H612	Q604-N608 PolarHBondContact NE2-OD1 2.93Å; Q604-N608 VanDerWaalsContact O-CB 3.3Å; Q604-N608 WeakPolarHBondContact O-CB 3.49Å; Q604-N608 PolarHBondContact O-N 3.13Å; Q604-N608 PolarHBondContact O-OD1 3.37Å; R605-N608 PolarHBondContact O-N 3.47Å; A606-N608 VanDerWaalsContact C-N 3.28Å; A606-N608 PolarHBondContact O-N 2.8Å; N608-H612 WeakPolarHBondContact O-CB 3.08Å; N608-H612 PolarHBondContact O-N 3.46Å
609	A	90.4	Very high	88.3	Confident	59 Å²	59	75.7 Å²	75.7	49%	0.488	38%	0.384	S	S	.	.	H	α-helix	trans	-68.2	-41.5	178.3	0	0	0	0	0	112.2	R605 A606 I607 H612 L613	R605-A609 WeakPolarHBondContact O-CB 3.16Å; R605-A609 PolarHBondContact O-N 3.3Å; A606-A609 WeakPolarHBondContact O-CB 3.36Å; A606-A609 PolarHBondContact O-N 3.32Å; I607-A609 PolarHBondContact O-N 3.4Å; A609-H612 WeakPolarHBondContact O-CB 3.17Å; A609-H612 PolarHBondContact O-N 3.49Å; A609-L613 PolarHBondContact O-N 2.95Å
610	E	90.2	Very high	88.8	Confident	45 Å²	45	78.1 Å²	78.1	21%	0.21	39%	0.391	C	S	.	.	H	α-helix	trans	-67.2	-39.8	174.8	-66.8	-166.2	135	0	0	112.4	A606 I607 H612 L613 L614 I674 P679 L680	A606-E610 PolarHBondContact O-N 2.91Å; I607-E610 PolarHBondContact O-N 2.74Å; E610-H612 VanDerWaalsContact C-N 3.3Å; E610-H612 PolarHBondContact O-N 2.82Å; E610-L613 PolarHBondContact O-N 3.48Å; E610-L614 WeakPolarHBondContact O-CB 3.4Å; E610-L614 PolarHBondContact O-N 2.56Å; E610-I674 HydrophobicContact CB-CD1 4.22Å; E610-I674 HydrophobicContact CB-CG2 3.8Å; E610-P679 WeakPolarHBondContact OE1-CA 3.47Å; E610-P679 WeakPolarHBondContact OE1-CB 3.33Å; E610-P679 WeakPolarHBondContact OE2-CA 3.24Å; E610-L680 PolarHBondContact OE1-N 3.38Å
611	L	91.2	Very high	89.1	Confident	30 Å²	30	73.8 Å²	73.8	16%	0.157	37%	0.372	C	S	.	.	H	α-helix	trans	-60.8	-39.9	172.7	-75.9	168.7	0	0	0	112.1	I607 N615 K671 I674 H675	I607-L611 HydrophobicContact CG2-CD1 3.84Å; I607-L611 WeakPolarHBondContact O-CB 3.43Å; I607-L611 WeakPolarHBondContact O-CD1 3.24Å; I607-L611 WeakPolarHBondContact O-CG 3.43Å; I607-L611 PolarHBondContact O-N 3.29Å; L611-N615 WeakPolarHBondContact O-CB 3.46Å; L611-N615 PolarHBondContact O-N 3.43Å; L611-K671 HydrophobicContact CD2-CB 4.43Å; L611-K671 HydrophobicContact CD2-CG 3.71Å; L611-I674 HydrophobicContact CD2-CB 4.19Å; L611-I674 HydrophobicContact CD2-CD1 4.5Å; L611-I674 HydrophobicContact CD2-CG2 4.12Å; L611-I674 HydrophobicContact CG-CB 4.46Å; L611-I674 HydrophobicContact CG-CG2 3.83Å; L611-H675 VanDerWaalsContact CD1-CE1 3.42Å; L611-H675 WeakPolarHBondContact CD1-CE1 3.3Å; L611-H675 VanDerWaalsContact CD2-CE1 3.44Å; L611-H675 WeakPolarHBondContact CD2-CE1 3.25Å
612	H	89.9	Confident	89.1	Confident	125 Å²	125	72.7 Å²	72.7	58%	0.579	36%	0.364	S	S	*	.	H	α-helix	trans	-64.2	-47.6	174.2	-175.9	-98.1	0	0	0	111.3	N608 A609 E610 L614 N615 V616	N608-H612 WeakPolarHBondContact O-CB 3.08Å; N608-H612 PolarHBondContact O-N 3.46Å; A609-H612 WeakPolarHBondContact O-CB 3.17Å; A609-H612 PolarHBondContact O-N 3.49Å; E610-H612 VanDerWaalsContact C-N 3.3Å; E610-H612 PolarHBondContact O-N 2.82Å; H612-L614 PolarHBondContact O-N 3.09Å; H612-N615 PolarHBondContact O-N 2.93Å; H612-V616 WeakPolarHBondContact O-CG2 3.47Å; H612-V616 PolarHBondContact O-N 3.17Å
613	L	91.9	Very high	89.1	Confident	101 Å²	101	74.8 Å²	74.8	53%	0.529	37%	0.365	S	S	.	.	H	α-helix	trans	-60.8	-43	177.8	-178.2	56	0	0	0	112.3	A609 E610 V616 H617 L680	A609-L613 PolarHBondContact O-N 2.95Å; E610-L613 PolarHBondContact O-N 3.48Å; L613-V616 PolarHBondContact O-N 2.96Å; L613-H617 WeakPolarHBondContact O-CB 3.44Å; L613-H617 PolarHBondContact O-N 2.93Å; L613-L680 HydrophobicContact CB-CD2 4.26Å; L613-L680 HydrophobicContact CD2-CD2 3.85Å; L613-L680 HydrophobicContact CG-CD2 3.83Å
614	L	91	Very high	89	Confident	1 Å²	1	73.7 Å²	73.7	1%	0.005	36%	0.359	C	S	.	.	H	α-helix	trans	-62.5	-41.3	174.4	177.2	66.1	0	0	0	112.1	E610 H612 H617 Y618 Y667 L670 K671 I674 L680	E610-L614 WeakPolarHBondContact O-CB 3.4Å; E610-L614 PolarHBondContact O-N 2.56Å; H612-L614 PolarHBondContact O-N 3.09Å; L614-H617 PolarHBondContact O-N 3.25Å; L614-Y618 WeakPolarHBondContact O-CB 3.49Å; L614-Y618 PolarHBondContact O-N 2.65Å; L614-Y667 HydrophobicContact CD1-CD2 4.3Å; L614-Y667 HydrophobicContact CD2-CD2 4Å; L614-Y667 HydrophobicContact CD2-CE2 4.07Å; L614-Y667 HydrophobicContact CG-CD2 3.79Å; L614-Y667 HydrophobicContact CG-CE2 3.89Å; L614-L670 HydrophobicContact CD1-CB 3.9Å; L614-L670 HydrophobicContact CD1-CD1 3.88Å; L614-L670 HydrophobicContact CD2-CB 3.64Å; L614-L670 HydrophobicContact CG-CB 4.45Å; L614-K671 HydrophobicContact CD2-CB 4.15Å; L614-I674 HydrophobicContact CB-CD1 3.97Å; L614-I674 HydrophobicContact CD2-CD1 3.64Å; L614-I674 HydrophobicContact CG-CD1 4.36Å; L614-L680 HydrophobicContact CD1-CD1 4.26Å
615	N	92.1	Very high	88.8	Confident	56 Å²	56	68.8 Å²	68.8	30%	0.299	34%	0.336	S	S	.	.	H	α-helix	trans	-65.5	-42.7	176.3	178	47.5	0	0	0	111.8	L611 H612 H617 Y618 Q619 Y667	L611-N615 WeakPolarHBondContact O-CB 3.46Å; L611-N615 PolarHBondContact O-N 3.43Å; H612-N615 PolarHBondContact O-N 2.93Å; N615-H617 VanDerWaalsContact C-N 3.35Å; N615-H617 PolarHBondContact O-N 2.96Å; N615-Y618 PolarHBondContact O-N 2.83Å; N615-Q619 WeakPolarHBondContact O-CG 3.46Å; N615-Q619 PolarHBondContact O-N 3.11Å; N615-Y667 HydrophobicContact CB-CE2 4.43Å
616	V	91.2	Very high	88.4	Confident	57 Å²	57	62 Å²	62	35%	0.345	32%	0.316	S	S	.	.	H	α-helix	trans	-59.5	-46.1	173.8	172.4	0	0	0	0	110.5	H612 L613 Y618 Q619 M620	H612-V616 WeakPolarHBondContact O-CG2 3.47Å; H612-V616 PolarHBondContact O-N 3.17Å; L613-V616 PolarHBondContact O-N 2.96Å; V616-Y618 PolarHBondContact O-N 3.47Å; V616-Q619 PolarHBondContact O-N 3.28Å; V616-M620 HydrophobicContact CG1-CE 4.23Å; V616-M620 HydrophobicContact CG1-SD 4.49Å; V616-M620 WeakPolarHBondContact O-CG 3.31Å; V616-M620 PolarHBondContact O-N 3.46Å
617	H	87.9	Confident	88	Confident	59 Å²	59	62.1 Å²	62.1	27%	0.273	31%	0.31	S	S	.	.	H	α-helix	trans	-58.3	-45.3	175.2	-158	155.8	0	0	0	111.4	L613 L614 N615 Q619 M620 C621	L613-H617 WeakPolarHBondContact O-CB 3.44Å; L613-H617 PolarHBondContact O-N 2.93Å; L614-H617 PolarHBondContact O-N 3.25Å; N615-H617 VanDerWaalsContact C-N 3.35Å; N615-H617 PolarHBondContact O-N 2.96Å; H617-Q619 PolarHBondContact O-N 3.4Å; H617-M620 PolarHBondContact O-N 3.06Å; H617-C621 PolarHBondContact CD2-SG 3.01Å; H617-C621 WeakPolarHBondContact O-CB 3.44Å; H617-C621 PolarHBondContact O-N 3.36Å; H617-C621 PolarHBondContact O-SG 3.01Å; H617-C621 VanDerWaalsContact O-SG 3.42Å
618	Y	90.6	Very high	87.6	Confident	10 Å²	10	62.8 Å²	62.8	4%	0.039	31%	0.313	C	S	.	.	H	α-helix	trans	-60	-43.4	176.1	172.1	-110	0	0	0	113.3	L614 N615 V616 R622 L663 K664 Y667 L686	L614-Y618 WeakPolarHBondContact O-CB 3.49Å; L614-Y618 PolarHBondContact O-N 2.65Å; N615-Y618 PolarHBondContact O-N 2.83Å; V616-Y618 PolarHBondContact O-N 3.47Å; Y618-R622 WeakPolarHBondContact O-CB 3.48Å; Y618-R622 PolarHBondContact O-N 3.03Å; Y618-L663 HydrophobicContact CD2-CD2 4.21Å; Y618-L663 HydrophobicContact CD2-CG 3.9Å; Y618-L663 HydrophobicContact CE2-CD2 4.19Å; Y618-L663 HydrophobicContact CE2-CG 3.92Å; Y618-K664 HydrophobicContact CE2-CB 4.37Å; Y618-Y667 HydrophobicContact CD1-CD1 4.09Å; Y618-Y667 HydrophobicContact CD1-CD2 4.39Å; Y618-Y667 HydrophobicContact CD1-CE1 4.18Å; Y618-Y667 HydrophobicContact CD1-CE2 4.5Å; Y618-Y667 HydrophobicContact CD1-CG 4.2Å; Y618-Y667 HydrophobicContact CD2-CD1 4.18Å; Y618-Y667 HydrophobicContact CD2-CD2 4.29Å; Y618-Y667 AromaticContact CD2-CG 3.77Å; Y618-Y667 HydrophobicContact CD2-CG 3.77Å; Y618-Y667 HydrophobicContact CE1-CD1 4.19Å; Y618-Y667 HydrophobicContact CE1-CE1 4.34Å; Y618-Y667 HydrophobicContact CE2-CD1 4.28Å; Y618-Y667 HydrophobicContact CE2-CG 4.25Å; Y618-Y667 HydrophobicContact CG-CD1 4.09Å; Y618-Y667 AromaticContact CG-CD2 3.88Å; Y618-Y667 HydrophobicContact CG-CD2 3.88Å; Y618-Y667 HydrophobicContact CG-CE2 4.35Å; Y618-Y667 AromaticContact CG-CG 3.73Å; Y618-Y667 HydrophobicContact CG-CG 3.73Å; Y618-L686 VanDerWaalsContact CA-CD2 3.42Å; Y618-L686 HydrophobicContact CD2-CD2 4.28Å
619	Q	89.8	Confident	87.1	Confident	70 Å²	70	59.9 Å²	59.9	33%	0.327	30%	0.296	S	S	.	.	H	α-helix	trans	-68.2	-38.3	176.3	-59.4	-57.5	-20.8	0	0	112.2	N615 V616 H617 R622 R623	N615-Q619 WeakPolarHBondContact O-CG 3.46Å; N615-Q619 PolarHBondContact O-N 3.11Å; V616-Q619 PolarHBondContact O-N 3.28Å; H617-Q619 PolarHBondContact O-N 3.4Å; Q619-R622 PolarHBondContact O-N 3.16Å; Q619-R623 VanDerWaalsContact O-CB 3.27Å; Q619-R623 WeakPolarHBondContact O-CB 3.22Å; Q619-R623 PolarHBondContact O-N 3.04Å
620	M	88.1	Confident	86.7	Confident	115 Å²	115	61 Å²	61	57%	0.567	29%	0.29	S	S	*	.	H	α-helix	trans	-61.4	-49.5	174.3	-70.4	-168	-60	0	0	111.6	V616 H617 R622 R623 H624	V616-M620 HydrophobicContact CG1-CE 4.23Å; V616-M620 HydrophobicContact CG1-SD 4.49Å; V616-M620 WeakPolarHBondContact O-CG 3.31Å; V616-M620 PolarHBondContact O-N 3.46Å; H617-M620 PolarHBondContact O-N 3.06Å; M620-R622 PolarHBondContact O-N 3.49Å; M620-R623 PolarHBondContact O-N 2.82Å; M620-H624 WeakPolarHBondContact O-CB 3.29Å; M620-H624 PolarHBondContact O-N 3.19Å
621	C	86.3	Confident	86.1	Confident	14 Å²	14	63.3 Å²	63.3	10%	0.095	30%	0.303	C	S	.	.	H	α-helix	trans	-59.8	-45.9	176.5	-73.1	0	0	0	0	112.1	H617 R623 H624 C625 L663 L686 V688	H617-C621 PolarHBondContact CD2-SG 3.01Å; H617-C621 WeakPolarHBondContact O-CB 3.44Å; H617-C621 PolarHBondContact O-N 3.36Å; H617-C621 PolarHBondContact O-SG 3.01Å; H617-C621 VanDerWaalsContact O-SG 3.42Å; C621-R623 VanDerWaalsContact C-N 3.32Å; C621-R623 PolarHBondContact O-N 3.17Å; C621-H624 PolarHBondContact O-N 2.98Å; C621-C625 PolarHBondContact O-N 3.36Å; C621-C625 PolarHBondContact O-SG 3.07Å; C621-L663 HydrophobicContact CB-CD1 3.95Å; C621-L663 HydrophobicContact CB-CD2 3.84Å; C621-L686 PolarHBondContact SG-O 2.7Å; C621-V688 HydrophobicContact CB-CG2 3.65Å
622	R	86.4	Confident	85.1	Confident	119 Å²	119	63.4 Å²	63.4	45%	0.449	31%	0.305	S	S	.	.	H	α-helix	trans	-60.7	-40.1	176.3	175.5	172.1	174.8	-117.9	-0.8	112	Y618 Q619 M620 C626 L660 L663	Y618-R622 WeakPolarHBondContact O-CB 3.48Å; Y618-R622 PolarHBondContact O-N 3.03Å; Q619-R622 PolarHBondContact O-N 3.16Å; M620-R622 PolarHBondContact O-N 3.49Å; R622-C626 PolarHBondContact O-N 2.96Å; R622-C626 PolarHBondContact O-SG 2.64Å; R622-C626 VanDerWaalsContact O-SG 3.36Å; R622-L660 HydrophobicContact CB-CD2 4.4Å; R622-L660 HydrophobicContact CG-CD2 4.01Å; R622-L663 HydrophobicContact CB-CD2 4.14Å
623	R	85.8	Confident	84.3	Confident	142 Å²	142	58.8 Å²	58.8	54%	0.536	28%	0.284	S	S	.	.	H	α-helix	trans	-67.3	-44.4	177.2	-175.3	68.4	-150.4	-134.8	-8	111.5	Q619 M620 C621 C625 C626 D627	Q619-R623 VanDerWaalsContact O-CB 3.27Å; Q619-R623 WeakPolarHBondContact O-CB 3.22Å; Q619-R623 PolarHBondContact O-N 3.04Å; M620-R623 PolarHBondContact O-N 2.82Å; C621-R623 VanDerWaalsContact C-N 3.32Å; C621-R623 PolarHBondContact O-N 3.17Å; R623-C625 PolarHBondContact O-N 3.13Å; R623-C626 PolarHBondContact O-N 2.86Å; R623-C626 VanDerWaalsContact O-N 3.1Å; R623-D627 IonicContact CZ-OD1 3.24Å; R623-D627 IonicContact CZ-OD2 3.57Å; R623-D627 VanDerWaalsContact CZ-OD2 3.3Å; R623-D627 IonicContact NE-OD1 2.84Å; R623-D627 PolarHBondContact NE-OD1 2.79Å; R623-D627 IonicContact NE-OD2 3.03Å; R623-D627 PolarHBondContact NE-OD2 3.3Å; R623-D627 IonicContact NH2-OD1 2.74Å; R623-D627 PolarHBondContact NH2-OD1 3.27Å; R623-D627 IonicContact NH2-OD2 3.61Å; R623-D627 PolarHBondContact NH2-OD2 3.18Å; R623-D627 PolarHBondContact O-N 3.39Å
624	H	83.9	Confident	83.2	Confident	90 Å²	90	59.3 Å²	59.3	42%	0.417	28%	0.284	S	S	.	.	H	α-helix	trans	-58.9	-43.8	176.2	-175.5	74.5	0	0	0	112.2	M620 C621 C626 D627 I628	M620-H624 WeakPolarHBondContact O-CB 3.29Å; M620-H624 PolarHBondContact O-N 3.19Å; C621-H624 PolarHBondContact O-N 2.98Å; H624-C626 VanDerWaalsContact C-N 3.32Å; H624-C626 PolarHBondContact O-N 3.36Å; H624-D627 PolarHBondContact O-N 3.39Å; H624-I628 WeakPolarHBondContact NE2-CD1 3.31Å; H624-I628 WeakPolarHBondContact O-CG1 3.45Å; H624-I628 PolarHBondContact O-N 3.39Å
625	C	81.8	Confident	81.7	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-53.2	-47.3	171.2	-65.9	0	0	0	0	112.4	C621 R623 Y629 L656 L660 V688	C621-C625 PolarHBondContact O-N 3.36Å; C621-C625 PolarHBondContact O-SG 3.07Å; R623-C625 PolarHBondContact O-N 3.13Å; C625-Y629 WeakPolarHBondContact O-CB 3.47Å; C625-Y629 PolarHBondContact O-N 3.48Å; C625-Y629 VanDerWaalsContact O-N 3.14Å; C625-L656 HydrophobicContact CB-CD1 3.79Å; C625-L660 HydrophobicContact CB-CD2 3.93Å; C625-V688 WeakPolarHBondContact SG-CG1 3.44Å
626	C	81.5	Confident	80.1	Confident	44 Å²	44	63 Å²	63	30%	0.297	30%	0.3	S	S	.	.	H	α-helix	trans	-70.3	-37	-177.4	-68.2	0	0	0	0	113.2	R622 R623 H624 Y629 K630	R622-C626 PolarHBondContact O-N 2.96Å; R622-C626 PolarHBondContact O-SG 2.64Å; R622-C626 VanDerWaalsContact O-SG 3.36Å; R623-C626 PolarHBondContact O-N 2.86Å; R623-C626 VanDerWaalsContact O-N 3.1Å; H624-C626 VanDerWaalsContact C-N 3.32Å; H624-C626 PolarHBondContact O-N 3.36Å; C626-Y629 WeakPolarHBondContact O-CB 3.41Å; C626-Y629 PolarHBondContact O-N 2.91Å; C626-K630 WeakPolarHBondContact O-CG 3.5Å; C626-K630 PolarHBondContact O-N 2.86Å
627	D	80.6	Confident	78.2	Confident	57 Å²	57	66.3 Å²	66.3	31%	0.305	31%	0.312	S	S	.	.	H	α-helix	trans	-78.4	-30.9	-178.7	-69.7	-30.6	0	0	0	112.5	R623 H624 K630 L631	R623-D627 IonicContact CZ-OD1 3.24Å; R623-D627 IonicContact CZ-OD2 3.57Å; R623-D627 VanDerWaalsContact CZ-OD2 3.3Å; R623-D627 IonicContact NE-OD1 2.84Å; R623-D627 PolarHBondContact NE-OD1 2.79Å; R623-D627 IonicContact NE-OD2 3.03Å; R623-D627 PolarHBondContact NE-OD2 3.3Å; R623-D627 IonicContact NH2-OD1 2.74Å; R623-D627 PolarHBondContact NH2-OD1 3.27Å; R623-D627 IonicContact NH2-OD2 3.61Å; R623-D627 PolarHBondContact NH2-OD2 3.18Å; R623-D627 PolarHBondContact O-N 3.39Å; H624-D627 PolarHBondContact O-N 3.39Å; D627-K630 PolarHBondContact O-N 3.07Å; D627-K630 IonicContact OD1-NZ 2.68Å; D627-K630 PolarHBondContact OD1-NZ 2.89Å; D627-L631 PolarHBondContact O-N 3.41Å
628	I	80	Confident	76.1	Confident	39 Å²	39	66.8 Å²	66.8	20%	0.2	33%	0.333	C	S	.	.	H	α-helix	trans	-68.4	-38.1	167.8	-60.1	177.5	0	0	0	110.8	H624 K630 L631 V632 L692 F696	H624-I628 WeakPolarHBondContact NE2-CD1 3.31Å; H624-I628 WeakPolarHBondContact O-CG1 3.45Å; H624-I628 PolarHBondContact O-N 3.39Å; I628-K630 VanDerWaalsContact C-N 3.33Å; I628-K630 PolarHBondContact O-N 3.28Å; I628-L631 PolarHBondContact O-N 3.21Å; I628-V632 HydrophobicContact CG2-CG2 4.31Å; I628-V632 WeakPolarHBondContact O-CG2 3.37Å; I628-V632 PolarHBondContact O-N 2.89Å; I628-L692 HydrophobicContact CD1-CD1 4.17Å; I628-L692 HydrophobicContact CD1-CD2 3.69Å; I628-L692 HydrophobicContact CG2-CD2 4.39Å; I628-F696 HydrophobicContact CB-CE2 4.21Å; I628-F696 HydrophobicContact CG2-CD2 3.83Å; I628-F696 HydrophobicContact CG2-CE2 3.34Å; I628-F696 HydrophobicContact CG2-CZ 3.89Å
629	Y	78.8	Confident	74.1	Confident	25 Å²	25	71.8 Å²	71.8	10%	0.098	36%	0.36	C	S	.	.	H	α-helix	trans	-57.4	-45.8	173.4	173.6	-99.2	0	0	0	112	C625 C626 V632 M633 V652 L656 F768	C625-Y629 WeakPolarHBondContact O-CB 3.47Å; C625-Y629 PolarHBondContact O-N 3.48Å; C625-Y629 VanDerWaalsContact O-N 3.14Å; C626-Y629 WeakPolarHBondContact O-CB 3.41Å; C626-Y629 PolarHBondContact O-N 2.91Å; Y629-V632 PolarHBondContact O-N 3.49Å; Y629-M633 HydrophobicContact CD1-CG 4.39Å; Y629-M633 HydrophobicContact CD2-CG 4.41Å; Y629-M633 HydrophobicContact CE1-CG 3.94Å; Y629-M633 HydrophobicContact CE2-CG 3.96Å; Y629-M633 HydrophobicContact CE2-SD 4.22Å; Y629-M633 VanDerWaalsContact O-CG 3.22Å; Y629-M633 WeakPolarHBondContact O-CG 3.42Å; Y629-M633 PolarHBondContact O-N 2.95Å; Y629-M633 VanDerWaalsContact O-N 3.12Å; Y629-V652 HydrophobicContact CD2-CG1 3.83Å; Y629-V652 HydrophobicContact CE2-CB 4.44Å; Y629-V652 HydrophobicContact CE2-CG1 3.86Å; Y629-L656 HydrophobicContact CD1-CD2 4.13Å; Y629-L656 HydrophobicContact CD2-CD2 3.87Å; Y629-L656 HydrophobicContact CG-CD2 3.65Å; Y629-F768 HydrophobicContact CE1-CE1 4.31Å; Y629-F768 HydrophobicContact CE1-CZ 4.19Å; Y629-F768 AromaticContact CZ-CZ 3.91Å; Y629-F768 VanDerWaalsContact OH-CZ 3.27Å; Y629-F768 WeakPolarHBondContact OH-CZ 3.2Å
630	K	80.9	Confident	71.8	Confident	83 Å²	83	75.6 Å²	75.6	36%	0.361	38%	0.382	S	S	.	.	H	α-helix	trans	-57.1	-52.4	172.8	-73.8	176.5	-165.6	159.9	0	111.8	C626 D627 I628 V632 M633 E634	C626-K630 WeakPolarHBondContact O-CG 3.5Å; C626-K630 PolarHBondContact O-N 2.86Å; D627-K630 PolarHBondContact O-N 3.07Å; D627-K630 IonicContact OD1-NZ 2.68Å; D627-K630 PolarHBondContact OD1-NZ 2.89Å; I628-K630 VanDerWaalsContact C-N 3.33Å; I628-K630 PolarHBondContact O-N 3.28Å; K630-V632 PolarHBondContact O-N 3.42Å; K630-M633 CarbonylContact O-C 3.37Å; K630-M633 WeakPolarHBondContact O-CA 3.41Å; K630-M633 WeakPolarHBondContact O-CB 3.36Å; K630-M633 PolarHBondContact O-N 3.32Å; K630-E634 WeakPolarHBondContact O-CB 3.5Å; K630-E634 WeakPolarHBondContact O-CG 3.01Å; K630-E634 PolarHBondContact O-N 3.32Å
631	L	77.9	Confident	69.8	Low	92 Å²	92	74.8 Å²	74.8	48%	0.482	38%	0.379	S	S	.	.	H	α-helix	trans	-55.6	-39.2	-179.3	-177.6	62.5	0	0	0	112.4	D627 I628 M633 N635	D627-L631 PolarHBondContact O-N 3.41Å; I628-L631 PolarHBondContact O-N 3.21Å; L631-M633 VanDerWaalsContact C-N 3.32Å; L631-N635 WeakPolarHBondContact CD1-ND2 3.33Å; L631-N635 VanDerWaalsContact O-CB 3.28Å; L631-N635 WeakPolarHBondContact O-CB 3.16Å; L631-N635 VanDerWaalsContact O-CG 3.25Å; L631-N635 PolarHBondContact O-N 3.44Å; L631-N635 VanDerWaalsContact O-N 3.11Å; L631-N635 PolarHBondContact O-ND2 3.35Å
632	V	71.5	Confident	67.7	Low	32 Å²	32	81.2 Å²	81.2	19%	0.194	41%	0.412	C	S	.	.	H	α-helix	trans	-73.9	-22.7	177.6	172.4	0	0	0	0	112.9	I628 Y629 K630 F696 F699	I628-V632 HydrophobicContact CG2-CG2 4.31Å; I628-V632 WeakPolarHBondContact O-CG2 3.37Å; I628-V632 PolarHBondContact O-N 2.89Å; Y629-V632 PolarHBondContact O-N 3.49Å; K630-V632 PolarHBondContact O-N 3.42Å; V632-F696 HydrophobicContact CB-CD1 4.33Å; V632-F696 HydrophobicContact CB-CE1 3.9Å; V632-F696 HydrophobicContact CG1-CD1 4.03Å; V632-F696 HydrophobicContact CG1-CE1 3.83Å; V632-F696 HydrophobicContact CG2-CD1 3.75Å; V632-F696 HydrophobicContact CG2-CE1 3.66Å; V632-F696 HydrophobicContact CG2-CG 4.36Å; V632-F696 HydrophobicContact CG2-CZ 4.18Å; V632-F699 HydrophobicContact CG1-CD1 4.01Å; V632-F699 HydrophobicContact CG1-CE1 3.8Å
633	M	71.4	Confident	65.8	Low	28 Å²	28	78 Å²	78	14%	0.138	40%	0.404	C	S	.	.	H	α-helix	trans	-84.7	-45.8	173.8	-67.5	-73.5	-68	0	0	111.9	Y629 K630 L631 R636 E637 K649	Y629-M633 HydrophobicContact CD1-CG 4.39Å; Y629-M633 HydrophobicContact CD2-CG 4.41Å; Y629-M633 HydrophobicContact CE1-CG 3.94Å; Y629-M633 HydrophobicContact CE2-CG 3.96Å; Y629-M633 HydrophobicContact CE2-SD 4.22Å; Y629-M633 VanDerWaalsContact O-CG 3.22Å; Y629-M633 WeakPolarHBondContact O-CG 3.42Å; Y629-M633 PolarHBondContact O-N 2.95Å; Y629-M633 VanDerWaalsContact O-N 3.12Å; K630-M633 CarbonylContact O-C 3.37Å; K630-M633 WeakPolarHBondContact O-CA 3.41Å; K630-M633 WeakPolarHBondContact O-CB 3.36Å; K630-M633 PolarHBondContact O-N 3.32Å; L631-M633 VanDerWaalsContact C-N 3.32Å; M633-R636 VanDerWaalsContact O-CB 3.26Å; M633-R636 WeakPolarHBondContact O-CB 3.31Å; M633-R636 PolarHBondContact O-N 2.88Å; M633-E637 PolarHBondContact O-N 3.14Å; M633-K649 HydrophobicContact CE-CB 4.36Å; M633-K649 HydrophobicContact CE-CD 3.62Å; M633-K649 HydrophobicContact CE-CG 3.81Å; M633-K649 HydrophobicContact SD-CG 4.16Å
634	E	69.6	Low	64.1	Low	113 Å²	113	76.3 Å²	76.3	53%	0.528	41%	0.413	S	S	.	.	H	α-helix	trans	-65.9	-39.6	-178.8	-70	162.8	-170.6	0	0	111.7	K630 R636 E637 G638	K630-E634 WeakPolarHBondContact O-CB 3.5Å; K630-E634 WeakPolarHBondContact O-CG 3.01Å; K630-E634 PolarHBondContact O-N 3.32Å; E634-R636 PolarHBondContact O-N 3.47Å; E634-R636 VanDerWaalsContact O-N 3.08Å; E634-E637 PolarHBondContact O-N 2.96Å; E634-G638 PolarHBondContact O-N 2.82Å; E634-G638 VanDerWaalsContact O-N 3.09Å
635	N	60.8	Low	62.7	Low	94 Å²	94	73.5 Å²	73.5	50%	0.503	40%	0.404	S	S	.	.	H	α-helix	trans	-60	-19.4	172.4	-80	-44.6	0	0	0	113.6	L631 L639	L631-N635 WeakPolarHBondContact CD1-ND2 3.33Å; L631-N635 VanDerWaalsContact O-CB 3.28Å; L631-N635 WeakPolarHBondContact O-CB 3.16Å; L631-N635 VanDerWaalsContact O-CG 3.25Å; L631-N635 PolarHBondContact O-N 3.44Å; L631-N635 VanDerWaalsContact O-N 3.11Å; L631-N635 PolarHBondContact O-ND2 3.35Å; N635-L639 PolarHBondContact O-N 2.88Å
636	R	57.2	Low	61.7	Low	39 Å²	39	79 Å²	79	15%	0.147	43%	0.433	C	S	.	.	H	α-helix	trans	-88.8	-18.5	176.5	-172.8	-177.2	176.5	174.9	-0.1	113.2	M633 E634 L639 L643 S645	M633-R636 VanDerWaalsContact O-CB 3.26Å; M633-R636 WeakPolarHBondContact O-CB 3.31Å; M633-R636 PolarHBondContact O-N 2.88Å; E634-R636 PolarHBondContact O-N 3.47Å; E634-R636 VanDerWaalsContact O-N 3.08Å; R636-L639 VanDerWaalsContact O-O 3.09Å; R636-L643 PolarHBondContact NH2-O 3.06Å; R636-S645 PolarHBondContact NH2-O 3.37Å; R636-S645 PolarHBondContact NH2-OG 3.24Å
637	E	50.9	Low	60.8	Low	127 Å²	127	81.1 Å²	81.1	59%	0.593	45%	0.448	S	S	*	.	H	α-helix	trans	-88.2	-24.2	169.5	-90	103.5	-134.1	0	0	111.7	M633 E634 K649	M633-E637 PolarHBondContact O-N 3.14Å; E634-E637 PolarHBondContact O-N 2.96Å; E637-K649 IonicContact OE1-NZ 3.39Å; E637-K649 PolarHBondContact OE1-NZ 2.68Å
638	G	44.8	Very low	60	Low	70 Å²	70	79.1 Å²	79.1	72%	0.722	44%	0.44	S	S	*	.	H	α-helix	trans	-77.2	-35.5	171.9	0	0	0	0	0	114.9	E634	E634-G638 PolarHBondContact O-N 2.82Å; E634-G638 VanDerWaalsContact O-N 3.09Å
639	L	48.2	Very low	59.6	Low	114 Å²	114	80.5 Å²	80.5	60%	0.597	44%	0.444	S	S	*	.	S	Bend	trans	-84.1	117.1	169.3	-67.1	173	0	0	0	109	N635 R636 M641	N635-L639 PolarHBondContact O-N 2.88Å; R636-L639 VanDerWaalsContact O-O 3.09Å; L639-M641 PolarHBondContact O-N 2.99Å
640	N	41.1	Very low	59.4	Low	150 Å²	150	87.2 Å²	87.2	80%	0.802	47%	0.474	S	S	*	.			trans	-75.3	50.5	-173.2	-161.9	0.2	0	0	0	113.6
641	M	45.6	Very low	59	Low	99 Å²	99	87.2 Å²	87.2	49%	0.488	48%	0.475	S	S	.	.			trans	-96.4	108.7	-177.8	-81	-69.6	-170.3	0	0	110	L639 L643 E707	L639-M641 PolarHBondContact O-N 2.99Å; M641-L643 PolarHBondContact O-N 3.37Å; M641-E707 HydrophobicContact CE-CG 4.31Å; M641-E707 WeakPolarHBondContact CE-OE1 3.42Å
642	N	43.1	Very low	58.8	Low	149 Å²	149	83.4 Å²	83.4	80%	0.797	46%	0.456	S	S	*	.			trans	-69.8	33.2	-179.3	-79.8	-66.5	0	0	0	115.1	S644	N642-S644 PolarHBondContact O-N 2.77Å
643	L	45.8	Very low	59.2	Low	52 Å²	52	82.1 Å²	82.1	27%	0.272	45%	0.449	S	S	.	.			trans	-72.7	76.1	164.2	-85.4	66	0	0	0	109.2	R636 M641 S645 K706	R636-L643 PolarHBondContact NH2-O 3.06Å; M641-L643 PolarHBondContact O-N 3.37Å; L643-S645 PolarHBondContact O-N 3.25Å; L643-K706 HydrophobicContact CD2-CD 3.87Å; L643-K706 HydrophobicContact CD2-CG 4.3Å; L643-K706 HydrophobicContact CG-CD 4.44Å
644	S	50.8	Low	59.5	Low	106 Å²	106	84 Å²	84	74%	0.741	47%	0.466	S	S	*	.			trans	-74.7	46.5	166.5	-163.7	0	0	0	0	111.8	N642 N646	N642-S644 PolarHBondContact O-N 2.77Å; S644-N646 PolarHBondContact O-N 3.09Å
645	S	54.5	Low	60	Low	30 Å²	30	80.1 Å²	80.1	21%	0.21	45%	0.453	C	S	.	.			trans	-81.8	91.2	173.8	52	0	0	0	0	109.8	R636 L643 S647 A648 K649	R636-S645 PolarHBondContact NH2-O 3.37Å; R636-S645 PolarHBondContact NH2-OG 3.24Å; L643-S645 PolarHBondContact O-N 3.25Å; S645-S647 PolarHBondContact O-N 3.05Å; S645-A648 WeakPolarHBondContact O-CB 3.37Å; S645-A648 PolarHBondContact O-N 3.26Å; S645-A648 WeakPolarHBondContact OG-CB 3.36Å; S645-K649 PolarHBondContact O-N 2.81Å
646	N	61	Low	61	Low	117 Å²	117	76.5 Å²	76.5	63%	0.626	43%	0.433	S	S	*	.	H	α-helix	trans	-55.7	-28.9	170.5	-70.7	-17.4	0	0	0	111.8	S644 A648 K649 K650	S644-N646 PolarHBondContact O-N 3.09Å; N646-A648 VanDerWaalsContact C-N 3.32Å; N646-A648 PolarHBondContact O-N 2.99Å; N646-K649 PolarHBondContact O-N 3.01Å; N646-K650 WeakPolarHBondContact O-CB 3.46Å; N646-K650 PolarHBondContact O-N 3.3Å
647	S	62.1	Low	62.2	Low	88 Å²	88	78.1 Å²	78.1	62%	0.615	44%	0.444	S	S	*	.	H	α-helix	trans	-57	-38.9	169.9	51.1	0	0	0	0	113.5	S645 K650 E651	S645-S647 PolarHBondContact O-N 3.05Å; S647-K650 PolarHBondContact O-N 3.39Å; S647-E651 WeakPolarHBondContact O-CB 3.49Å; S647-E651 PolarHBondContact O-N 2.8Å
648	A	63.9	Low	63.8	Low	15 Å²	15	75.6 Å²	75.6	12%	0.124	44%	0.44	C	S	.	.	H	α-helix	trans	-73.8	-39	178	0	0	0	0	0	112.2	S645 N646 K650 E651 V652 F699	S645-A648 WeakPolarHBondContact O-CB 3.37Å; S645-A648 PolarHBondContact O-N 3.26Å; S645-A648 WeakPolarHBondContact OG-CB 3.36Å; N646-A648 VanDerWaalsContact C-N 3.32Å; N646-A648 PolarHBondContact O-N 2.99Å; A648-K650 VanDerWaalsContact C-N 3.29Å; A648-K650 PolarHBondContact O-N 3.08Å; A648-E651 PolarHBondContact O-N 3.3Å; A648-V652 WeakPolarHBondContact O-CG2 3.37Å; A648-V652 PolarHBondContact O-N 3.49Å; A648-V652 VanDerWaalsContact O-N 3.14Å; A648-F699 HydrophobicContact CB-CE2 4.31Å
649	K	70.9	Confident	65.6	Low	67 Å²	67	72.8 Å²	72.8	29%	0.291	41%	0.409	S	S	.	.	H	α-helix	trans	-62	-39.2	172.1	-67.6	-167.4	165.7	-164.7	0	110.3	M633 E637 S645 N646 G653	M633-K649 HydrophobicContact CE-CB 4.36Å; M633-K649 HydrophobicContact CE-CD 3.62Å; M633-K649 HydrophobicContact CE-CG 3.81Å; M633-K649 HydrophobicContact SD-CG 4.16Å; E637-K649 IonicContact OE1-NZ 3.39Å; E637-K649 PolarHBondContact OE1-NZ 2.68Å; S645-K649 PolarHBondContact O-N 2.81Å; N646-K649 PolarHBondContact O-N 3.01Å; K649-G653 PolarHBondContact O-N 3.19Å; K649-G653 VanDerWaalsContact O-N 3.13Å
650	K	75.4	Confident	67.4	Low	166 Å²	166	68.6 Å²	68.6	72%	0.722	39%	0.387	S	S	*	.	H	α-helix	trans	-68	-42.9	174.9	-172.3	175.7	-177.7	177.2	0	113.6	N646 S647 A648 G653 S654	N646-K650 WeakPolarHBondContact O-CB 3.46Å; N646-K650 PolarHBondContact O-N 3.3Å; S647-K650 PolarHBondContact O-N 3.39Å; A648-K650 VanDerWaalsContact C-N 3.29Å; A648-K650 PolarHBondContact O-N 3.08Å; K650-G653 PolarHBondContact O-N 3.23Å; K650-S654 WeakPolarHBondContact O-CB 3.34Å; K650-S654 PolarHBondContact O-N 3.17Å; K650-S654 PolarHBondContact O-OG 3.15Å
651	E	73.3	Confident	69.5	Low	83 Å²	83	62.6 Å²	62.6	39%	0.388	36%	0.361	S	S	.	.	H	α-helix	trans	-63.7	-51.2	179.9	-175.5	173.7	-149.2	0	0	111.1	S647 A648 G653 S654 A655 R702	S647-E651 WeakPolarHBondContact O-CB 3.49Å; S647-E651 PolarHBondContact O-N 2.8Å; A648-E651 PolarHBondContact O-N 3.3Å; E651-G653 VanDerWaalsContact C-N 3.34Å; E651-G653 PolarHBondContact O-N 3.16Å; E651-S654 PolarHBondContact O-N 3.49Å; E651-S654 VanDerWaalsContact O-N 3.13Å; E651-S654 PolarHBondContact O-OG 3.05Å; E651-A655 PolarHBondContact O-N 2.99Å; E651-R702 IonicContact OE1-CZ 3.91Å; E651-R702 IonicContact OE1-NH1 2.71Å; E651-R702 PolarHBondContact OE1-NH1 2.95Å; E651-R702 IonicContact OE1-NH2 3.72Å; E651-R702 IonicContact OE2-NH1 3.64Å; E651-R702 PolarHBondContact OE2-NH1 3.15Å
652	V	73.8	Confident	71.4	Confident	12 Å²	12	60.3 Å²	60.3	7%	0.073	35%	0.351	C	S	.	.	H	α-helix	trans	-63	-40	177.8	-178.8	0	0	0	0	111.3	Y629 A648 S654 A655 L656 F696 F699	Y629-V652 HydrophobicContact CD2-CG1 3.83Å; Y629-V652 HydrophobicContact CE2-CB 4.44Å; Y629-V652 HydrophobicContact CE2-CG1 3.86Å; A648-V652 WeakPolarHBondContact O-CG2 3.37Å; A648-V652 PolarHBondContact O-N 3.49Å; A648-V652 VanDerWaalsContact O-N 3.14Å; V652-S654 PolarHBondContact O-N 2.97Å; V652-A655 PolarHBondContact O-N 3.49Å; V652-L656 PolarHBondContact O-N 2.86Å; V652-F696 HydrophobicContact CG1-CE1 3.85Å; V652-F699 HydrophobicContact CG2-CD2 3.46Å; V652-F699 VanDerWaalsContact CG2-CD2 3.46Å; V652-F699 HydrophobicContact CG2-CE2 3.49Å; V652-F699 VanDerWaalsContact CG2-CE2 3.49Å; V652-F699 HydrophobicContact CG2-CG 4.06Å; V652-F699 HydrophobicContact CG2-CZ 4.1Å
653	G	78.4	Confident	73.5	Confident	6 Å²	6	53.3 Å²	53.3	6%	0.062	31%	0.313	C	S	.	.	H	α-helix	trans	-61.4	-39.5	172.9	0	0	0	0	0	113.4	K649 K650 E651 L656 L657	K649-G653 PolarHBondContact O-N 3.19Å; K649-G653 VanDerWaalsContact O-N 3.13Å; K650-G653 PolarHBondContact O-N 3.23Å; E651-G653 VanDerWaalsContact C-N 3.34Å; E651-G653 PolarHBondContact O-N 3.16Å; G653-L656 PolarHBondContact O-N 3.03Å; G653-L657 WeakPolarHBondContact O-CG 3.27Å; G653-L657 PolarHBondContact O-N 3.5Å
654	S	78.4	Confident	75.6	Confident	68 Å²	68	53.1 Å²	53.1	48%	0.476	31%	0.31	S	S	.	.	H	α-helix	trans	-69.4	-36.7	176.6	71.4	0	0	0	0	113	K650 E651 V652 L657 S658	K650-S654 WeakPolarHBondContact O-CB 3.34Å; K650-S654 PolarHBondContact O-N 3.17Å; K650-S654 PolarHBondContact O-OG 3.15Å; E651-S654 PolarHBondContact O-N 3.49Å; E651-S654 VanDerWaalsContact O-N 3.13Å; E651-S654 PolarHBondContact O-OG 3.05Å; V652-S654 PolarHBondContact O-N 2.97Å; S654-L657 PolarHBondContact O-N 2.99Å; S654-S658 PolarHBondContact O-N 3.26Å
655	A	79.8	Confident	77.4	Confident	31 Å²	31	52.5 Å²	52.5	26%	0.256	30%	0.302	S	S	.	.	H	α-helix	trans	-65.4	-41.9	174	0	0	0	0	0	111.6	E651 V652 S658 L659 T695	E651-A655 PolarHBondContact O-N 2.99Å; V652-A655 PolarHBondContact O-N 3.49Å; A655-S658 PolarHBondContact O-N 3.32Å; A655-L659 WeakPolarHBondContact O-CB 3.4Å; A655-L659 PolarHBondContact O-N 2.94Å; A655-T695 HydrophobicContact CB-CG2 4.26Å
656	L	82.1	Confident	79	Confident	18 Å²	18	55.2 Å²	55.2	9%	0.094	31%	0.307	C	S	.	.	H	α-helix	trans	-60.7	-44	173.4	179.7	69.8	0	0	0	111.8	C625 Y629 V652 G653 L659 L660	C625-L656 HydrophobicContact CB-CD1 3.79Å; Y629-L656 HydrophobicContact CD1-CD2 4.13Å; Y629-L656 HydrophobicContact CD2-CD2 3.87Å; Y629-L656 HydrophobicContact CG-CD2 3.65Å; V652-L656 PolarHBondContact O-N 2.86Å; G653-L656 PolarHBondContact O-N 3.03Å; L656-L659 PolarHBondContact O-N 2.99Å; L656-L660 HydrophobicContact CD1-CD1 4.29Å; L656-L660 HydrophobicContact CD1-CG 4.39Å; L656-L660 HydrophobicContact CG-CD1 4.01Å; L656-L660 HydrophobicContact CG-CG 4.47Å; L656-L660 WeakPolarHBondContact O-CB 3.43Å; L656-L660 WeakPolarHBondContact O-CG 3.13Å; L656-L660 PolarHBondContact O-N 3.18Å
657	L	82.6	Confident	80.4	Confident	72 Å²	72	51.5 Å²	51.5	38%	0.377	29%	0.285	S	S	.	.	H	α-helix	trans	-63.9	-42.4	178.3	-77.2	166.5	0	0	0	112.4	G653 S654 L660 G661 L771	G653-L657 WeakPolarHBondContact O-CG 3.27Å; G653-L657 PolarHBondContact O-N 3.5Å; S654-L657 PolarHBondContact O-N 2.99Å; L657-L660 PolarHBondContact O-N 2.96Å; L657-G661 PolarHBondContact O-N 3.29Å; L657-L771 HydrophobicContact CD1-CD1 4.04Å; L657-L771 HydrophobicContact CD1-CD2 3.71Å; L657-L771 HydrophobicContact CD1-CG 4.5Å; L657-L771 HydrophobicContact CD2-CB 4.35Å; L657-L771 HydrophobicContact CD2-CD1 4.18Å; L657-L771 HydrophobicContact CD2-CD2 4.03Å; L657-L771 HydrophobicContact CD2-CG 4.42Å; L657-L771 HydrophobicContact CG-CD1 4.49Å
658	S	84.2	Confident	81.8	Confident	74 Å²	74	50.8 Å²	50.8	52%	0.517	28%	0.277	S	S	.	.	H	α-helix	trans	-60.5	-45.3	174.1	-168.5	0	0	0	0	111.5	S654 A655 L660 G661 D662	S654-S658 PolarHBondContact O-N 3.26Å; A655-S658 PolarHBondContact O-N 3.32Å; S658-L660 PolarHBondContact O-N 3.48Å; S658-G661 WeakPolarHBondContact O-CA 3.44Å; S658-G661 PolarHBondContact O-N 3.47Å; S658-D662 PolarHBondContact O-N 2.95Å
659	L	83.6	Confident	83.1	Confident	12 Å²	12	53 Å²	53	6%	0.063	29%	0.289	C	S	.	.	H	α-helix	trans	-63.8	-39.1	177.8	-178.6	66.7	0	0	0	113.2	A655 L656 D662 L663 V688 K691 L692	A655-L659 WeakPolarHBondContact O-CB 3.4Å; A655-L659 PolarHBondContact O-N 2.94Å; L656-L659 PolarHBondContact O-N 2.99Å; L659-D662 PolarHBondContact O-N 3.47Å; L659-L663 WeakPolarHBondContact O-CB 3.34Å; L659-L663 PolarHBondContact O-N 3.44Å; L659-V688 HydrophobicContact CD1-CG1 4.18Å; L659-V688 HydrophobicContact CD2-CG1 3.83Å; L659-V688 HydrophobicContact CG-CG1 4.23Å; L659-K691 HydrophobicContact CD1-CB 3.79Å; L659-L692 HydrophobicContact CD2-CB 3.85Å; L659-L692 HydrophobicContact CD2-CD1 3.82Å; L659-L692 HydrophobicContact CD2-CG 4.21Å
660	L	85.1	Confident	84	Confident	25 Å²	25	50.4 Å²	50.4	13%	0.131	28%	0.278	C	S	.	.	H	α-helix	trans	-69.9	-32.6	174.4	-72.3	173.4	0	0	0	112	R622 C625 L656 L657 S658 L663 K664	R622-L660 HydrophobicContact CB-CD2 4.4Å; R622-L660 HydrophobicContact CG-CD2 4.01Å; C625-L660 HydrophobicContact CB-CD2 3.93Å; L656-L660 HydrophobicContact CD1-CD1 4.29Å; L656-L660 HydrophobicContact CD1-CG 4.39Å; L656-L660 HydrophobicContact CG-CD1 4.01Å; L656-L660 HydrophobicContact CG-CG 4.47Å; L656-L660 WeakPolarHBondContact O-CB 3.43Å; L656-L660 WeakPolarHBondContact O-CG 3.13Å; L656-L660 PolarHBondContact O-N 3.18Å; L657-L660 PolarHBondContact O-N 2.96Å; S658-L660 PolarHBondContact O-N 3.48Å; L660-L663 HydrophobicContact CD2-CD2 4.32Å; L660-L663 PolarHBondContact O-N 2.95Å; L660-K664 PolarHBondContact O-N 2.82Å
661	G	84.3	Confident	84.8	Confident	25 Å²	25	45.8 Å²	45.8	26%	0.258	26%	0.258	S	S	.	.	H	α-helix	trans	-61.8	-53.7	168.5	0	0	0	0	0	112	L657 S658 L663 K664 V665	L657-G661 PolarHBondContact O-N 3.29Å; S658-G661 WeakPolarHBondContact O-CA 3.44Å; S658-G661 PolarHBondContact O-N 3.47Å; G661-L663 PolarHBondContact O-N 3.23Å; G661-K664 PolarHBondContact O-N 2.69Å; G661-K664 VanDerWaalsContact O-N 3.09Å; G661-V665 WeakPolarHBondContact O-CG2 3.45Å; G661-V665 PolarHBondContact O-N 3.31Å
662	D	85.6	Confident	85.7	Confident	51 Å²	51	46.5 Å²	46.5	27%	0.273	26%	0.261	S	S	.	.	H	α-helix	trans	-56.3	-34.1	174.8	-80.1	-24.2	0	0	0	113	S658 L659 R666 K691	S658-D662 PolarHBondContact O-N 2.95Å; L659-D662 PolarHBondContact O-N 3.47Å; D662-R666 WeakPolarHBondContact O-CB 3.17Å; D662-R666 WeakPolarHBondContact O-CG 3.48Å; D662-R666 PolarHBondContact O-N 2.9Å; D662-R666 PolarHBondContact O-NE 3.07Å; D662-K691 IonicContact OD1-NZ 3.12Å; D662-K691 WeakPolarHBondContact OD2-CD 3.3Å; D662-K691 IonicContact OD2-NZ 2.79Å; D662-K691 PolarHBondContact OD2-NZ 2.81Å
663	L	88.1	Confident	86.5	Confident	1 Å²	1	49.6 Å²	49.6	1%	0.005	27%	0.274	C	S	.	.	H	α-helix	trans	-70.9	-45.6	175.4	-173.8	65.7	0	0	0	111.2	Y618 C621 R622 L659 L660 G661 R666 Y667 L686 V688	Y618-L663 HydrophobicContact CD2-CD2 4.21Å; Y618-L663 HydrophobicContact CD2-CG 3.9Å; Y618-L663 HydrophobicContact CE2-CD2 4.19Å; Y618-L663 HydrophobicContact CE2-CG 3.92Å; C621-L663 HydrophobicContact CB-CD1 3.95Å; C621-L663 HydrophobicContact CB-CD2 3.84Å; R622-L663 HydrophobicContact CB-CD2 4.14Å; L659-L663 WeakPolarHBondContact O-CB 3.34Å; L659-L663 PolarHBondContact O-N 3.44Å; L660-L663 HydrophobicContact CD2-CD2 4.32Å; L660-L663 PolarHBondContact O-N 2.95Å; G661-L663 PolarHBondContact O-N 3.23Å; L663-R666 PolarHBondContact O-N 3.45Å; L663-Y667 WeakPolarHBondContact O-CB 3.38Å; L663-Y667 PolarHBondContact O-N 2.9Å; L663-L686 HydrophobicContact CD1-CD1 3.98Å; L663-L686 HydrophobicContact CD1-CD2 3.92Å; L663-L686 HydrophobicContact CD1-CG 3.66Å; L663-V688 HydrophobicContact CD1-CG2 4.05Å; L663-V688 HydrophobicContact CD2-CG2 4.49Å
664	K	89.5	Confident	87	Confident	49 Å²	49	49.3 Å²	49.3	21%	0.213	27%	0.271	C	S	.	.	H	α-helix	trans	-63.8	-41.7	176.5	179.2	168	172.8	169.7	0	112	Y618 L660 G661 Y667 V668 L773 D775	Y618-K664 HydrophobicContact CE2-CB 4.37Å; L660-K664 PolarHBondContact O-N 2.82Å; G661-K664 PolarHBondContact O-N 2.69Å; G661-K664 VanDerWaalsContact O-N 3.09Å; K664-Y667 PolarHBondContact O-N 3.41Å; K664-V668 WeakPolarHBondContact O-CG2 3.16Å; K664-V668 PolarHBondContact O-N 2.95Å; K664-L773 HydrophobicContact CD-CD1 4.23Å; K664-D775 IonicContact NZ-OD1 3.62Å; K664-D775 PolarHBondContact NZ-OD1 3.07Å
665	V	88.9	Confident	87.4	Confident	93 Å²	93	51.4 Å²	51.4	56%	0.564	27%	0.273	S	S	*	.	H	α-helix	trans	-59.9	-50.7	176.5	172.5	0	0	0	0	110.5	G661 Y667 V668 T669	G661-V665 WeakPolarHBondContact O-CG2 3.45Å; G661-V665 PolarHBondContact O-N 3.31Å; V665-Y667 PolarHBondContact O-N 3.28Å; V665-V668 PolarHBondContact O-N 2.86Å; V665-T669 PolarHBondContact O-N 3.13Å; V665-T669 PolarHBondContact O-OG1 2.89Å
666	R	88.1	Confident	87.8	Confident	87 Å²	87	56.4 Å²	56.4	33%	0.328	29%	0.289	S	S	.	.	H	α-helix	trans	-64.1	-38.1	179.1	-70.3	-179.4	-63.9	150.2	4.3	112.8	D662 L663 T669 L670 L686 S687	D662-R666 WeakPolarHBondContact O-CB 3.17Å; D662-R666 WeakPolarHBondContact O-CG 3.48Å; D662-R666 PolarHBondContact O-N 2.9Å; D662-R666 PolarHBondContact O-NE 3.07Å; L663-R666 PolarHBondContact O-N 3.45Å; R666-T669 PolarHBondContact O-N 3.16Å; R666-L670 WeakPolarHBondContact O-CB 3.4Å; R666-L670 VanDerWaalsContact O-CG 3.28Å; R666-L670 WeakPolarHBondContact O-CG 3.42Å; R666-L670 PolarHBondContact O-N 2.78Å; R666-L686 HydrophobicContact CB-CD1 4.07Å; R666-S687 VanDerWaalsContact CZ-O 3.3Å; R666-S687 PolarHBondContact NH1-O 2.94Å; R666-S687 PolarHBondContact NH2-O 3.19Å
667	Y	91	Very high	87.9	Confident	38 Å²	38	57.3 Å²	57.3	15%	0.149	30%	0.302	C	S	.	.	H	α-helix	trans	-58.7	-46	171.6	166.8	-113.3	0	0	0	112.1	L614 N615 Y618 L663 K664 V665 L670 K671	L614-Y667 HydrophobicContact CD1-CD2 4.3Å; L614-Y667 HydrophobicContact CD2-CD2 4Å; L614-Y667 HydrophobicContact CD2-CE2 4.07Å; L614-Y667 HydrophobicContact CG-CD2 3.79Å; L614-Y667 HydrophobicContact CG-CE2 3.89Å; N615-Y667 HydrophobicContact CB-CE2 4.43Å; Y618-Y667 HydrophobicContact CD1-CD1 4.09Å; Y618-Y667 HydrophobicContact CD1-CD2 4.39Å; Y618-Y667 HydrophobicContact CD1-CE1 4.18Å; Y618-Y667 HydrophobicContact CD1-CE2 4.5Å; Y618-Y667 HydrophobicContact CD1-CG 4.2Å; Y618-Y667 HydrophobicContact CD2-CD1 4.18Å; Y618-Y667 HydrophobicContact CD2-CD2 4.29Å; Y618-Y667 AromaticContact CD2-CG 3.77Å; Y618-Y667 HydrophobicContact CD2-CG 3.77Å; Y618-Y667 HydrophobicContact CE1-CD1 4.19Å; Y618-Y667 HydrophobicContact CE1-CE1 4.34Å; Y618-Y667 HydrophobicContact CE2-CD1 4.28Å; Y618-Y667 HydrophobicContact CE2-CG 4.25Å; Y618-Y667 HydrophobicContact CG-CD1 4.09Å; Y618-Y667 AromaticContact CG-CD2 3.88Å; Y618-Y667 HydrophobicContact CG-CD2 3.88Å; Y618-Y667 HydrophobicContact CG-CE2 4.35Å; Y618-Y667 AromaticContact CG-CG 3.73Å; Y618-Y667 HydrophobicContact CG-CG 3.73Å; L663-Y667 WeakPolarHBondContact O-CB 3.38Å; L663-Y667 PolarHBondContact O-N 2.9Å; K664-Y667 PolarHBondContact O-N 3.41Å; V665-Y667 PolarHBondContact O-N 3.28Å; Y667-L670 PolarHBondContact O-N 2.96Å; Y667-K671 VanDerWaalsContact O-CB 3.28Å; Y667-K671 WeakPolarHBondContact O-CB 3.48Å; Y667-K671 PolarHBondContact O-N 3.45Å
668	V	91.2	Very high	88.1	Confident	74 Å²	74	56.6 Å²	56.6	45%	0.448	30%	0.298	S	S	.	.	H	α-helix	trans	-64.5	-42.5	177.2	172.2	0	0	0	0	111.6	K664 V665 L670 K671 E672	K664-V668 WeakPolarHBondContact O-CG2 3.16Å; K664-V668 PolarHBondContact O-N 2.95Å; V665-V668 PolarHBondContact O-N 2.86Å; V668-L670 PolarHBondContact O-N 3.27Å; V668-K671 WeakPolarHBondContact O-CB 3.34Å; V668-K671 PolarHBondContact O-N 2.91Å; V668-E672 WeakPolarHBondContact O-CB 3.17Å; V668-E672 PolarHBondContact O-N 3.4Å
669	T	91	Very high	88.1	Confident	62 Å²	62	55.1 Å²	55.1	38%	0.38	29%	0.287	S	S	.	.	H	α-helix	trans	-63.3	-40.1	175.7	-54.4	0	0	0	0	112.5	V665 R666 E672 K673	V665-T669 PolarHBondContact O-N 3.13Å; V665-T669 PolarHBondContact O-OG1 2.89Å; R666-T669 PolarHBondContact O-N 3.16Å; T669-E672 PolarHBondContact O-N 2.94Å; T669-K673 WeakPolarHBondContact O-CG 3.44Å; T669-K673 PolarHBondContact O-N 2.61Å; T669-K673 VanDerWaalsContact O-N 3.14Å
670	L	90.1	Very high	88.2	Confident	11 Å²	11	56 Å²	56	6%	0.058	29%	0.292	C	S	.	.	H	α-helix	trans	-68.1	-42.5	175.4	-71.2	168.7	0	0	0	111.2	L614 R666 Y667 V668 E672 K673 I674 L683 L686	L614-L670 HydrophobicContact CD1-CB 3.9Å; L614-L670 HydrophobicContact CD1-CD1 3.88Å; L614-L670 HydrophobicContact CD2-CB 3.64Å; L614-L670 HydrophobicContact CG-CB 4.45Å; R666-L670 WeakPolarHBondContact O-CB 3.4Å; R666-L670 VanDerWaalsContact O-CG 3.28Å; R666-L670 WeakPolarHBondContact O-CG 3.42Å; R666-L670 PolarHBondContact O-N 2.78Å; Y667-L670 PolarHBondContact O-N 2.96Å; V668-L670 PolarHBondContact O-N 3.27Å; L670-E672 VanDerWaalsContact C-N 3.29Å; L670-E672 PolarHBondContact O-N 2.96Å; L670-K673 PolarHBondContact O-N 3.46Å; L670-K673 VanDerWaalsContact O-N 3.1Å; L670-I674 WeakPolarHBondContact O-CG1 3.5Å; L670-I674 PolarHBondContact O-N 3.43Å; L670-L683 HydrophobicContact CD2-CB 3.66Å; L670-L683 HydrophobicContact CD2-CD1 3.84Å; L670-L683 HydrophobicContact CD2-CD2 4.48Å; L670-L683 HydrophobicContact CD2-CG 4.2Å; L670-L686 HydrophobicContact CD1-CB 4.39Å; L670-L686 HydrophobicContact CD1-CD1 3.73Å
671	K	92.1	Very high	88.1	Confident	69 Å²	69	64 Å²	64	30%	0.3	33%	0.328	S	S	.	.	H	α-helix	trans	-55.2	-45.8	173.7	-176.3	-177.9	179.2	-174.5	0	110.8	L611 L614 Y667 V668 K673 I674 H675	L611-K671 HydrophobicContact CD2-CB 4.43Å; L611-K671 HydrophobicContact CD2-CG 3.71Å; L614-K671 HydrophobicContact CD2-CB 4.15Å; Y667-K671 VanDerWaalsContact O-CB 3.28Å; Y667-K671 WeakPolarHBondContact O-CB 3.48Å; Y667-K671 PolarHBondContact O-N 3.45Å; V668-K671 WeakPolarHBondContact O-CB 3.34Å; V668-K671 PolarHBondContact O-N 2.91Å; K671-K673 PolarHBondContact O-N 3.42Å; K671-I674 PolarHBondContact O-N 3.48Å; K671-H675 PolarHBondContact O-N 3.2Å; K671-H675 VanDerWaalsContact O-N 3.13Å; K671-H675 PolarHBondContact O-ND1 3.01Å
672	E	91.2	Very high	88.1	Confident	98 Å²	98	69.7 Å²	69.7	46%	0.458	35%	0.348	S	S	.	.	H	α-helix	trans	-64.2	-35.8	177.6	-162.5	-162	152.1	0	0	112.8	V668 T669 L670 K676	V668-E672 WeakPolarHBondContact O-CB 3.17Å; V668-E672 PolarHBondContact O-N 3.4Å; T669-E672 PolarHBondContact O-N 2.94Å; L670-E672 VanDerWaalsContact C-N 3.29Å; L670-E672 PolarHBondContact O-N 2.96Å; E672-K676 WeakPolarHBondContact O-CG 3.48Å; E672-K676 PolarHBondContact O-N 2.89Å; E672-K676 WeakPolarHBondContact OE1-CE 3.32Å; E672-K676 IonicContact OE1-NZ 2.68Å; E672-K676 PolarHBondContact OE1-NZ 3.26Å
673	K	90.4	Very high	88.1	Confident	78 Å²	78	68 Å²	68	34%	0.339	34%	0.339	S	S	.	.	H	α-helix	trans	-70.8	-39.1	176.8	-72.9	-176	-179.6	-169.3	0	113.1	T669 L670 K671 H675 K676 G677 I678 L683	T669-K673 WeakPolarHBondContact O-CG 3.44Å; T669-K673 PolarHBondContact O-N 2.61Å; T669-K673 VanDerWaalsContact O-N 3.14Å; L670-K673 PolarHBondContact O-N 3.46Å; L670-K673 VanDerWaalsContact O-N 3.1Å; K671-K673 PolarHBondContact O-N 3.42Å; K673-H675 VanDerWaalsContact C-N 3.34Å; K673-K676 CarbonylContact O-C 3.54Å; K673-K676 WeakPolarHBondContact O-CA 3.48Å; K673-K676 WeakPolarHBondContact O-CB 3.17Å; K673-K676 PolarHBondContact O-N 3.46Å; K673-G677 PolarHBondContact O-N 2.84Å; K673-I678 HydrophobicContact CB-CB 4.5Å; K673-I678 HydrophobicContact CB-CD1 4.1Å; K673-I678 HydrophobicContact CD-CD1 4.47Å; K673-I678 HydrophobicContact CG-CD1 4.21Å; K673-I678 PolarHBondContact O-N 3.28Å; K673-L683 HydrophobicContact CB-CD1 3.9Å; K673-L683 HydrophobicContact CB-CD2 4.08Å; K673-L683 HydrophobicContact CD-CD2 3.46Å; K673-L683 VanDerWaalsContact CD-CD2 3.46Å; K673-L683 HydrophobicContact CG-CD2 4.42Å
674	I	90.5	Very high	87.7	Confident	0 Å²	0	72.1 Å²	72.1	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-65.1	-38.6	174.3	-61.9	168.2	0	0	0	110.7	I607 E610 L611 L614 L670 K671 K676 G677 L680 L683	I607-I674 HydrophobicContact CG2-CG2 4.3Å; E610-I674 HydrophobicContact CB-CD1 4.22Å; E610-I674 HydrophobicContact CB-CG2 3.8Å; L611-I674 HydrophobicContact CD2-CB 4.19Å; L611-I674 HydrophobicContact CD2-CD1 4.5Å; L611-I674 HydrophobicContact CD2-CG2 4.12Å; L611-I674 HydrophobicContact CG-CB 4.46Å; L611-I674 HydrophobicContact CG-CG2 3.83Å; L614-I674 HydrophobicContact CB-CD1 3.97Å; L614-I674 HydrophobicContact CD2-CD1 3.64Å; L614-I674 HydrophobicContact CG-CD1 4.36Å; L670-I674 WeakPolarHBondContact O-CG1 3.5Å; L670-I674 PolarHBondContact O-N 3.43Å; K671-I674 PolarHBondContact O-N 3.48Å; I674-K676 PolarHBondContact O-N 3.37Å; I674-K676 VanDerWaalsContact O-N 3.17Å; I674-G677 PolarHBondContact O-N 2.92Å; I674-L680 HydrophobicContact CD1-CD1 4.29Å; I674-L683 HydrophobicContact CG1-CD1 4.03Å
675	H	86.9	Confident	87.3	Confident	111 Å²	111	74.5 Å²	74.5	51%	0.514	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-16.8	172	-74.6	78	0	0	0	113.7	L611 K671 K673	L611-H675 VanDerWaalsContact CD1-CE1 3.42Å; L611-H675 WeakPolarHBondContact CD1-CE1 3.3Å; L611-H675 VanDerWaalsContact CD2-CE1 3.44Å; L611-H675 WeakPolarHBondContact CD2-CE1 3.25Å; K671-H675 PolarHBondContact O-N 3.2Å; K671-H675 VanDerWaalsContact O-N 3.13Å; K671-H675 PolarHBondContact O-ND1 3.01Å; K673-H675 VanDerWaalsContact C-N 3.34Å
676	K	88.3	Confident	86.9	Confident	137 Å²	137	70.2 Å²	70.2	60%	0.596	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	4.8	172.3	-67.8	168.7	-174.2	174.9	0	113	E672 K673 I674	E672-K676 WeakPolarHBondContact O-CG 3.48Å; E672-K676 PolarHBondContact O-N 2.89Å; E672-K676 WeakPolarHBondContact OE1-CE 3.32Å; E672-K676 IonicContact OE1-NZ 2.68Å; E672-K676 PolarHBondContact OE1-NZ 3.26Å; K673-K676 CarbonylContact O-C 3.54Å; K673-K676 WeakPolarHBondContact O-CA 3.48Å; K673-K676 WeakPolarHBondContact O-CB 3.17Å; K673-K676 PolarHBondContact O-N 3.46Å; I674-K676 PolarHBondContact O-N 3.37Å; I674-K676 VanDerWaalsContact O-N 3.17Å
677	G	82.7	Confident	86.3	Confident	37 Å²	37	68 Å²	68	38%	0.381	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	16.9	178.3	0	0	0	0	0	115.1	K673 I674	K673-G677 PolarHBondContact O-N 2.84Å; I674-G677 PolarHBondContact O-N 2.92Å
678	I	86.9	Confident	85.2	Confident	56 Å²	56	66.4 Å²	66.4	29%	0.287	35%	0.353	S	S	.	.			trans	-86.2	120.2	172.6	-56.7	163	0	0	0	108.3	K673 E682 L683	K673-I678 HydrophobicContact CB-CB 4.5Å; K673-I678 HydrophobicContact CB-CD1 4.1Å; K673-I678 HydrophobicContact CD-CD1 4.47Å; K673-I678 HydrophobicContact CG-CD1 4.21Å; K673-I678 PolarHBondContact O-N 3.28Å; I678-E682 HydrophobicContact CG2-CB 4.05Å; I678-L683 HydrophobicContact CB-CD2 4.42Å; I678-L683 HydrophobicContact CG2-CD2 3.64Å; I678-L683 HydrophobicContact CG2-CG 4.01Å
679	P	84.9	Confident	83.8	Confident	43 Å²	43	68.4 Å²	68.4	28%	0.279	36%	0.357	S	S	.	.			trans	-68.6	153.1	-175.5	29.1	-35.6	0	0	0	112.1	E610 E681 E682 L683	E610-P679 WeakPolarHBondContact OE1-CA 3.47Å; E610-P679 WeakPolarHBondContact OE1-CB 3.33Å; E610-P679 WeakPolarHBondContact OE2-CA 3.24Å; P679-E681 PolarHBondContact O-N 3.45Å; P679-E681 VanDerWaalsContact O-N 3.16Å; P679-E682 HydrophobicContact CG-CB 4.24Å; P679-E682 HydrophobicContact CG-CG 3.85Å; P679-E682 WeakPolarHBondContact CG-OE1 3.49Å; P679-E682 PolarHBondContact O-N 2.98Å; P679-E682 VanDerWaalsContact O-N 3.13Å; P679-L683 WeakPolarHBondContact O-CG 3.41Å
680	L	84.9	Confident	82.5	Confident	32 Å²	32	70.1 Å²	70.1	17%	0.168	37%	0.371	C	S	.	.	G	3₁₀ helix	trans	-63.6	-24.4	-174.7	-176.2	60.6	0	0	0	113.1	E610 L613 L614 I674 L683	E610-L680 PolarHBondContact OE1-N 3.38Å; L613-L680 HydrophobicContact CB-CD2 4.26Å; L613-L680 HydrophobicContact CD2-CD2 3.85Å; L613-L680 HydrophobicContact CG-CD2 3.83Å; L614-L680 HydrophobicContact CD1-CD1 4.26Å; I674-L680 HydrophobicContact CD1-CD1 4.29Å; L680-L683 PolarHBondContact O-N 2.98Å
681	E	83.9	Confident	81.3	Confident	192 Å²	192	74.6 Å²	74.6	90%	0.897	39%	0.39	S	S	*	.	G	3₁₀ helix	trans	-71	-30.3	177.1	-173	167.7	-168.1	0	0	113.3	P679 L683	P679-E681 PolarHBondContact O-N 3.45Å; P679-E681 VanDerWaalsContact O-N 3.16Å; E681-L683 PolarHBondContact O-N 2.88Å
682	E	83.8	Confident	80.1	Confident	145 Å²	145	71.5 Å²	71.5	68%	0.678	38%	0.377	S	S	*	.	G	3₁₀ helix	trans	-78.8	-6	174.1	-72.2	177.4	-156.9	0	0	112.9	I678 P679	I678-E682 HydrophobicContact CG2-CB 4.05Å; P679-E682 HydrophobicContact CG-CB 4.24Å; P679-E682 HydrophobicContact CG-CG 3.85Å; P679-E682 WeakPolarHBondContact CG-OE1 3.49Å; P679-E682 PolarHBondContact O-N 2.98Å; P679-E682 VanDerWaalsContact O-N 3.13Å
683	L	85.1	Confident	78.9	Confident	14 Å²	14	72.4 Å²	72.4	7%	0.073	38%	0.384	C	S	.	.	S	Bend	trans	-102.8	143.3	-173.6	-62.5	-179.7	0	0	0	112.1	L670 K673 I674 I678 P679 L680 E681	L670-L683 HydrophobicContact CD2-CB 3.66Å; L670-L683 HydrophobicContact CD2-CD1 3.84Å; L670-L683 HydrophobicContact CD2-CD2 4.48Å; L670-L683 HydrophobicContact CD2-CG 4.2Å; K673-L683 HydrophobicContact CB-CD1 3.9Å; K673-L683 HydrophobicContact CB-CD2 4.08Å; K673-L683 HydrophobicContact CD-CD2 3.46Å; K673-L683 VanDerWaalsContact CD-CD2 3.46Å; K673-L683 HydrophobicContact CG-CD2 4.42Å; I674-L683 HydrophobicContact CG1-CD1 4.03Å; I678-L683 HydrophobicContact CB-CD2 4.42Å; I678-L683 HydrophobicContact CG2-CD2 3.64Å; I678-L683 HydrophobicContact CG2-CG 4.01Å; P679-L683 WeakPolarHBondContact O-CG 3.41Å; L680-L683 PolarHBondContact O-N 2.98Å; E681-L683 PolarHBondContact O-N 2.88Å
684	P	81.3	Confident	77.8	Confident	88 Å²	88	72 Å²	72	57%	0.571	39%	0.392	S	S	*	.	P	Polyproline II helix	trans	-63	132.3	178	26.2	-34.2	0	0	0	110.3
685	P	80	Confident	76.7	Confident	100 Å²	100	74.8 Å²	74.8	65%	0.649	41%	0.408	S	S	*	.	P	Polyproline II helix	trans	-63.9	152.6	-174.8	25.6	-34.8	0	0	0	112	S687	P685-S687 PolarHBondContact O-N 3.21Å
686	L	81.8	Confident	75.7	Confident	3 Å²	3	71.1 Å²	71.1	2%	0.016	39%	0.391	C	S	.	.			trans	-75.7	48	-175.5	-165.7	77.1	0	0	0	113	Y618 C621 L663 R666 L670	Y618-L686 VanDerWaalsContact CA-CD2 3.42Å; Y618-L686 HydrophobicContact CD2-CD2 4.28Å; C621-L686 PolarHBondContact SG-O 2.7Å; L663-L686 HydrophobicContact CD1-CD1 3.98Å; L663-L686 HydrophobicContact CD1-CD2 3.92Å; L663-L686 HydrophobicContact CD1-CG 3.66Å; R666-L686 HydrophobicContact CB-CD1 4.07Å; L670-L686 HydrophobicContact CD1-CB 4.39Å; L670-L686 HydrophobicContact CD1-CD1 3.73Å
687	S	74.1	Confident	74.8	Confident	40 Å²	40	68 Å²	68	28%	0.28	39%	0.387	S	S	.	.			trans	-69.1	146.6	-177.3	176.2	0	0	0	0	113.1	R666 P685 E689	R666-S687 VanDerWaalsContact CZ-O 3.3Å; R666-S687 PolarHBondContact NH1-O 2.94Å; R666-S687 PolarHBondContact NH2-O 3.19Å; P685-S687 PolarHBondContact O-N 3.21Å; S687-E689 PolarHBondContact OG-N 3.48Å; S687-E689 PolarHBondContact OG-OE2 2.94Å
688	V	67.9	Low	74.1	Confident	5 Å²	5	69.3 Å²	69.3	3%	0.03	39%	0.388	C	S	.	.			trans	-104.7	-22.3	177.3	177.3	0	0	0	0	111.4	C621 C625 L659 L663 S690 L692	C621-V688 HydrophobicContact CB-CG2 3.65Å; C625-V688 WeakPolarHBondContact SG-CG1 3.44Å; L659-V688 HydrophobicContact CD1-CG1 4.18Å; L659-V688 HydrophobicContact CD2-CG1 3.83Å; L659-V688 HydrophobicContact CG-CG1 4.23Å; L663-V688 HydrophobicContact CD1-CG2 4.05Å; L663-V688 HydrophobicContact CD2-CG2 4.49Å; V688-S690 PolarHBondContact O-N 3.17Å; V688-L692 HydrophobicContact CG1-CB 3.91Å; V688-L692 HydrophobicContact CG1-CD1 3.72Å; V688-L692 HydrophobicContact CG1-CG 4.43Å; V688-L692 WeakPolarHBondContact O-CB 3.4Å; V688-L692 PolarHBondContact O-N 3.22Å
689	E	63.3	Low	73.1	Confident	115 Å²	115	68.4 Å²	68.4	54%	0.537	38%	0.381	S	S	.	.	H	α-helix	trans	-67.4	-43.8	-149.5	-63.2	155	136.6	0	0	113.2	S687 K691 L692 L693	S687-E689 PolarHBondContact OG-N 3.48Å; S687-E689 PolarHBondContact OG-OE2 2.94Å; E689-K691 PolarHBondContact O-N 3.13Å; E689-L692 PolarHBondContact O-N 3.41Å; E689-L693 HydrophobicContact CB-CD1 4.22Å; E689-L693 VanDerWaalsContact O-CB 3.31Å; E689-L693 WeakPolarHBondContact O-CB 3.48Å; E689-L693 VanDerWaalsContact O-CG 3.28Å; E689-L693 WeakPolarHBondContact O-CG 3.45Å; E689-L693 PolarHBondContact O-N 3.49Å
690	S	62.6	Low	72.1	Confident	98 Å²	98	68.6 Å²	68.6	69%	0.685	39%	0.387	S	S	*	.	H	α-helix	trans	-62.3	-39.6	-173.3	58	0	0	0	0	113.9	V688 S694	V688-S690 PolarHBondContact O-N 3.17Å; S690-S694 WeakPolarHBondContact O-CB 3.4Å; S690-S694 PolarHBondContact O-N 2.73Å
691	K	64.7	Low	71.1	Confident	105 Å²	105	69.8 Å²	69.8	46%	0.457	40%	0.398	S	S	.	.	H	α-helix	trans	-76.4	-40.5	175.5	-76.8	-176.9	169.2	-179.3	0	111.7	L659 D662 E689 S694 T695	L659-K691 HydrophobicContact CD1-CB 3.79Å; D662-K691 IonicContact OD1-NZ 3.12Å; D662-K691 WeakPolarHBondContact OD2-CD 3.3Å; D662-K691 IonicContact OD2-NZ 2.79Å; D662-K691 PolarHBondContact OD2-NZ 2.81Å; E689-K691 PolarHBondContact O-N 3.13Å; K691-S694 PolarHBondContact O-N 2.78Å; K691-T695 PolarHBondContact O-N 3.2Å; K691-T695 VanDerWaalsContact O-N 3.09Å; K691-T695 PolarHBondContact O-OG1 2.85Å
692	L	66.4	Low	70	Confident	5 Å²	5	66.9 Å²	66.9	3%	0.026	38%	0.379	C	S	.	.	H	α-helix	trans	-68.5	-44.2	-177.3	-179.1	145.8	0	0	0	112.7	I628 L659 V688 E689 S694 T695 F696	I628-L692 HydrophobicContact CD1-CD1 4.17Å; I628-L692 HydrophobicContact CD1-CD2 3.69Å; I628-L692 HydrophobicContact CG2-CD2 4.39Å; L659-L692 HydrophobicContact CD2-CB 3.85Å; L659-L692 HydrophobicContact CD2-CD1 3.82Å; L659-L692 HydrophobicContact CD2-CG 4.21Å; V688-L692 HydrophobicContact CG1-CB 3.91Å; V688-L692 HydrophobicContact CG1-CD1 3.72Å; V688-L692 HydrophobicContact CG1-CG 4.43Å; V688-L692 WeakPolarHBondContact O-CB 3.4Å; V688-L692 PolarHBondContact O-N 3.22Å; E689-L692 PolarHBondContact O-N 3.41Å; L692-S694 VanDerWaalsContact C-N 3.3Å; L692-S694 PolarHBondContact O-N 3.01Å; L692-T695 PolarHBondContact O-N 3.31Å; L692-T695 PolarHBondContact O-OG1 3.01Å; L692-T695 VanDerWaalsContact O-OG1 3.06Å; L692-F696 HydrophobicContact CD1-CE2 4.02Å; L692-F696 HydrophobicContact CD2-CD2 3.65Å; L692-F696 HydrophobicContact CD2-CE2 3.84Å; L692-F696 HydrophobicContact CG-CD2 3.72Å; L692-F696 HydrophobicContact CG-CE2 3.6Å; L692-F696 WeakPolarHBondContact O-CD2 3.36Å; L692-F696 PolarHBondContact O-N 3.31Å
693	L	66.1	Low	68.8	Low	116 Å²	116	63.6 Å²	63.6	61%	0.607	37%	0.365	S	S	*	.	H	α-helix	trans	-65.8	-34.9	176.2	-68.2	169.6	0	0	0	111.4	E689 S697	E689-L693 HydrophobicContact CB-CD1 4.22Å; E689-L693 VanDerWaalsContact O-CB 3.31Å; E689-L693 WeakPolarHBondContact O-CB 3.48Å; E689-L693 VanDerWaalsContact O-CG 3.28Å; E689-L693 WeakPolarHBondContact O-CG 3.45Å; E689-L693 PolarHBondContact O-N 3.49Å; L693-S697 WeakPolarHBondContact O-CB 3.45Å; L693-S697 PolarHBondContact O-N 2.9Å
694	S	67.9	Low	67.5	Low	70 Å²	70	68.7 Å²	68.7	49%	0.49	39%	0.39	S	S	.	.	H	α-helix	trans	-66.2	-45.7	176.3	-177.2	0	0	0	0	112.7	S690 K691 L692 T698	S690-S694 WeakPolarHBondContact O-CB 3.4Å; S690-S694 PolarHBondContact O-N 2.73Å; K691-S694 PolarHBondContact O-N 2.78Å; L692-S694 VanDerWaalsContact C-N 3.3Å; L692-S694 PolarHBondContact O-N 3.01Å; S694-T698 WeakPolarHBondContact O-CB 3.37Å; S694-T698 PolarHBondContact O-N 3.02Å; S694-T698 PolarHBondContact O-OG1 2.84Å
695	T	66.9	Low	66.3	Low	58 Å²	58	71.7 Å²	71.7	36%	0.356	39%	0.394	S	S	.	.	H	α-helix	trans	-67.7	-41.5	178	53.7	0	0	0	0	112	A655 K691 L692 T698 F699	A655-T695 HydrophobicContact CB-CG2 4.26Å; K691-T695 PolarHBondContact O-N 3.2Å; K691-T695 VanDerWaalsContact O-N 3.09Å; K691-T695 PolarHBondContact O-OG1 2.85Å; L692-T695 PolarHBondContact O-N 3.31Å; L692-T695 PolarHBondContact O-OG1 3.01Å; L692-T695 VanDerWaalsContact O-OG1 3.06Å; T695-T698 PolarHBondContact O-N 3.09Å; T695-F699 WeakPolarHBondContact O-CB 3.42Å; T695-F699 PolarHBondContact O-N 3.32Å
696	F	66.9	Low	64.9	Low	34 Å²	34	72.7 Å²	72.7	15%	0.149	39%	0.388	C	S	.	.	H	α-helix	trans	-72.3	-34.8	177	-70.6	-53	0	0	0	113.6	I628 V632 V652 L692 F699 A700	I628-F696 HydrophobicContact CB-CE2 4.21Å; I628-F696 HydrophobicContact CG2-CD2 3.83Å; I628-F696 HydrophobicContact CG2-CE2 3.34Å; I628-F696 HydrophobicContact CG2-CZ 3.89Å; V632-F696 HydrophobicContact CB-CD1 4.33Å; V632-F696 HydrophobicContact CB-CE1 3.9Å; V632-F696 HydrophobicContact CG1-CD1 4.03Å; V632-F696 HydrophobicContact CG1-CE1 3.83Å; V632-F696 HydrophobicContact CG2-CD1 3.75Å; V632-F696 HydrophobicContact CG2-CE1 3.66Å; V632-F696 HydrophobicContact CG2-CG 4.36Å; V632-F696 HydrophobicContact CG2-CZ 4.18Å; V652-F696 HydrophobicContact CG1-CE1 3.85Å; L692-F696 HydrophobicContact CD1-CE2 4.02Å; L692-F696 HydrophobicContact CD2-CD2 3.65Å; L692-F696 HydrophobicContact CD2-CE2 3.84Å; L692-F696 HydrophobicContact CG-CD2 3.72Å; L692-F696 HydrophobicContact CG-CE2 3.6Å; L692-F696 WeakPolarHBondContact O-CD2 3.36Å; L692-F696 PolarHBondContact O-N 3.31Å; F696-F699 PolarHBondContact O-N 2.73Å; F696-A700 WeakPolarHBondContact O-CB 3.19Å; F696-A700 PolarHBondContact O-N 3.44Å
697	S	69.5	Low	63.2	Low	72 Å²	72	77 Å²	77	50%	0.503	41%	0.408	S	S	.	.	H	α-helix	trans	-62.9	-42.5	170.7	178.7	0	0	0	0	111.7	L693 F699 A700 S701	L693-S697 WeakPolarHBondContact O-CB 3.45Å; L693-S697 PolarHBondContact O-N 2.9Å; S697-F699 VanDerWaalsContact C-N 3.33Å; S697-F699 PolarHBondContact O-N 2.82Å; S697-A700 PolarHBondContact O-N 3.47Å; S697-S701 VanDerWaalsContact O-CB 3.25Å; S697-S701 WeakPolarHBondContact O-CB 3.46Å; S697-S701 PolarHBondContact O-N 3.36Å; S697-S701 PolarHBondContact O-OG 2.89Å
698	T	67.8	Low	61.6	Low	65 Å²	65	80.1 Å²	80.1	40%	0.399	43%	0.426	S	S	.	.	H	α-helix	trans	-62.5	-40.4	174.1	-58.1	0	0	0	0	111.5	S694 T695 R702	S694-T698 WeakPolarHBondContact O-CB 3.37Å; S694-T698 PolarHBondContact O-N 3.02Å; S694-T698 PolarHBondContact O-OG1 2.84Å; T695-T698 PolarHBondContact O-N 3.09Å; T698-R702 WeakPolarHBondContact O-CG 3.46Å; T698-R702 PolarHBondContact O-N 2.71Å; T698-R702 VanDerWaalsContact O-N 3.15Å
699	F	65.5	Low	60.3	Low	36 Å²	36	87.4 Å²	87.4	16%	0.158	46%	0.459	C	S	.	.	H	α-helix	trans	-66.2	-49.7	177	-178.4	-102.5	0	0	0	112.4	V632 A648 V652 T695 F696 S697 S701 R702 L703	V632-F699 HydrophobicContact CG1-CD1 4.01Å; V632-F699 HydrophobicContact CG1-CE1 3.8Å; A648-F699 HydrophobicContact CB-CE2 4.31Å; V652-F699 HydrophobicContact CG2-CD2 3.46Å; V652-F699 VanDerWaalsContact CG2-CD2 3.46Å; V652-F699 HydrophobicContact CG2-CE2 3.49Å; V652-F699 VanDerWaalsContact CG2-CE2 3.49Å; V652-F699 HydrophobicContact CG2-CG 4.06Å; V652-F699 HydrophobicContact CG2-CZ 4.1Å; T695-F699 WeakPolarHBondContact O-CB 3.42Å; T695-F699 PolarHBondContact O-N 3.32Å; F696-F699 PolarHBondContact O-N 2.73Å; S697-F699 VanDerWaalsContact C-N 3.33Å; S697-F699 PolarHBondContact O-N 2.82Å; F699-S701 VanDerWaalsContact C-N 3.3Å; F699-S701 PolarHBondContact O-N 3.05Å; F699-R702 PolarHBondContact O-N 3.02Å; F699-L703 PolarHBondContact O-N 3.1Å
700	A	63.4	Low	59.3	Low	47 Å²	47	87.4 Å²	87.4	39%	0.388	47%	0.467	S	S	.	.	H	α-helix	trans	-59.2	-41.5	175.9	0	0	0	0	0	111.7	F696 S697 R702 L703 M704	F696-A700 WeakPolarHBondContact O-CB 3.19Å; F696-A700 PolarHBondContact O-N 3.44Å; S697-A700 PolarHBondContact O-N 3.47Å; A700-R702 VanDerWaalsContact C-N 3.25Å; A700-R702 PolarHBondContact O-N 2.98Å; A700-L703 WeakPolarHBondContact O-CB 3.41Å; A700-L703 PolarHBondContact O-N 3.35Å; A700-L703 VanDerWaalsContact O-N 3.1Å; A700-M704 WeakPolarHBondContact O-CG 3.36Å; A700-M704 PolarHBondContact O-N 2.87Å; A700-M704 VanDerWaalsContact O-N 3.08Å
701	S	63.4	Low	58	Low	58 Å²	58	91.6 Å²	91.6	41%	0.406	47%	0.473	S	S	.	.	H	α-helix	trans	-61.6	-29.5	175	-62.7	0	0	0	0	113.5	S697 F699 K705	S697-S701 VanDerWaalsContact O-CB 3.25Å; S697-S701 WeakPolarHBondContact O-CB 3.46Å; S697-S701 PolarHBondContact O-N 3.36Å; S697-S701 PolarHBondContact O-OG 2.89Å; F699-S701 VanDerWaalsContact C-N 3.3Å; F699-S701 PolarHBondContact O-N 3.05Å; S701-K705 WeakPolarHBondContact O-CB 3.41Å; S701-K705 WeakPolarHBondContact O-CD 3.48Å; S701-K705 WeakPolarHBondContact O-CG 3.44Å; S701-K705 PolarHBondContact O-N 3.32Å
702	R	60.7	Low	56.7	Low	131 Å²	131	92.1 Å²	92.1	49%	0.494	49%	0.49	S	S	.	.	H	α-helix	trans	-81.9	-29.3	173.3	-72	179.8	-174.2	-179.4	6.9	112.9	E651 T698 F699 A700	E651-R702 IonicContact OE1-CZ 3.91Å; E651-R702 IonicContact OE1-NH1 2.71Å; E651-R702 PolarHBondContact OE1-NH1 2.95Å; E651-R702 IonicContact OE1-NH2 3.72Å; E651-R702 IonicContact OE2-NH1 3.64Å; E651-R702 PolarHBondContact OE2-NH1 3.15Å; T698-R702 WeakPolarHBondContact O-CG 3.46Å; T698-R702 PolarHBondContact O-N 2.71Å; T698-R702 VanDerWaalsContact O-N 3.15Å; F699-R702 PolarHBondContact O-N 3.02Å; A700-R702 VanDerWaalsContact C-N 3.25Å; A700-R702 PolarHBondContact O-N 2.98Å
703	L	60	Low	55.2	Low	75 Å²	75	101.4 Å²	101.4	39%	0.393	53%	0.533	S	S	.	.	H	α-helix	trans	-62.9	-56.6	174.5	-163.6	82.4	0	0	0	109.9	F699 A700 K705 K706	F699-L703 PolarHBondContact O-N 3.1Å; A700-L703 WeakPolarHBondContact O-CB 3.41Å; A700-L703 PolarHBondContact O-N 3.35Å; A700-L703 VanDerWaalsContact O-N 3.1Å; L703-K705 VanDerWaalsContact C-N 3.31Å; L703-K705 PolarHBondContact O-N 3.42Å; L703-K706 PolarHBondContact O-N 3.22Å
704	M	57	Low	53.6	Low	121 Å²	121	100.1 Å²	100.1	60%	0.596	54%	0.54	S	S	*	.	H	α-helix	trans	-58.6	-40	-179.5	-61.4	-60.6	-172.6	0	0	112.5	A700 K706 E707	A700-M704 WeakPolarHBondContact O-CG 3.36Å; A700-M704 PolarHBondContact O-N 2.87Å; A700-M704 VanDerWaalsContact O-N 3.08Å; M704-K706 PolarHBondContact O-N 3.47Å; M704-K706 VanDerWaalsContact O-N 3.16Å; M704-E707 PolarHBondContact O-N 3.46Å
705	K	57	Low	51.8	Low	152 Å²	152	104.9 Å²	104.9	66%	0.661	56%	0.559	S	S	*	*	H	α-helix	trans	-67.1	-10.4	177.3	-76.3	178.6	-178.2	-175.2	0	114.9	S701 L703 T708	S701-K705 WeakPolarHBondContact O-CB 3.41Å; S701-K705 WeakPolarHBondContact O-CD 3.48Å; S701-K705 WeakPolarHBondContact O-CG 3.44Å; S701-K705 PolarHBondContact O-N 3.32Å; L703-K705 VanDerWaalsContact C-N 3.31Å; L703-K705 PolarHBondContact O-N 3.42Å; K705-T708 PolarHBondContact O-OG1 3.2Å
706	K	50.8	Low	50.2	Low	120 Å²	120	107.2 Å²	107.2	52%	0.522	58%	0.584	S	S	.	*	H	α-helix	trans	-97.3	-13.9	177.6	-173.6	151.7	175.3	167.5	0	113.1	L643 L703 M704	L643-K706 HydrophobicContact CD2-CD 3.87Å; L643-K706 HydrophobicContact CD2-CG 4.3Å; L643-K706 HydrophobicContact CG-CD 4.44Å; L703-K706 PolarHBondContact O-N 3.22Å; M704-K706 PolarHBondContact O-N 3.47Å; M704-K706 VanDerWaalsContact O-N 3.16Å
707	E	45.2	Very low	48.8	Very low	94 Å²	94	114.3 Å²	114.3	44%	0.439	62%	0.618	S	S	.	*	H	α-helix	trans	-78.9	-31.7	178.6	-163.2	158.4	-149.3	0	0	112.1	M641 M704 H709	M641-E707 HydrophobicContact CE-CG 4.31Å; M641-E707 WeakPolarHBondContact CE-OE1 3.42Å; M704-E707 PolarHBondContact O-N 3.46Å; E707-H709 PolarHBondContact O-N 2.92Å; E707-H709 VanDerWaalsContact O-N 3.14Å
708	T	41.5	Very low	47	Very low	105 Å²	105	121.4 Å²	121.4	64%	0.644	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-4.3	-177	55.8	0	0	0	0	115.8	K705	K705-T708 PolarHBondContact O-OG1 3.2Å
709	H	40	Very low	45.1	Very low	159 Å²	159	125.6 Å²	125.6	74%	0.736	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.9	5.7	-174.1	-78.3	-70	0	0	0	114.8	E707	E707-H709 PolarHBondContact O-N 2.92Å; E707-H709 VanDerWaalsContact O-N 3.14Å
710	V	42.2	Very low	43.5	Very low	114 Å²	114	130.6 Å²	130.6	69%	0.691	68%	0.682	S	S	*	*	S	Bend	trans	-106	-10.3	-173.2	-175.6	0	0	0	0	113.4
711	F	34.8	Very low	42.1	Very low	187 Å²	187	135.9 Å²	135.9	82%	0.82	70%	0.699	S	S	*	*	S	Bend	trans	-111.2	25.3	-169.9	-72.1	-73.1	0	0	0	115.4
712	S	37.3	Very low	40.3	Very low	116 Å²	116	144.8 Å²	144.8	81%	0.811	72%	0.724	S	S	*	*	S	Bend	trans	-136.8	23.8	-172.5	-168.1	0	0	0	0	115.4
713	E	35.3	Very low	38.8	Very low	199 Å²	199	144.6 Å²	144.6	93%	0.93	74%	0.737	S	S	*	*			trans	-141.1	60.6	179.7	-162.8	163.7	-150.3	0	0	112.2
714	A	32.9	Very low	37.3	Very low	90 Å²	90	149.1 Å²	149.1	74%	0.744	76%	0.756	S	S	*	*			trans	-159.2	81.5	169.6	0	0	0	0	0	111.1
715	D	30.7	Very low	35.9	Very low	170 Å²	170	150.4 Å²	150.4	91%	0.909	77%	0.765	S	S	*	*			trans	168.4	92.8	148.6	-92.3	-18	0	0	0	111.2
716	A	33	Very low	34.6	Very low	106 Å²	106	152.6 Å²	152.6	88%	0.876	78%	0.775	S	S	*	*			trans	178.3	94.9	153.5	0	0	0	0	0	112.3
717	E	36.5	Very low	33.9	Very low	184 Å²	184	153.9 Å²	153.9	86%	0.86	79%	0.788	S	S	*	*			trans	-152	147.8	156.9	-146	-175.9	-134.8	0	0	111
718	R	32.6	Very low	33.3	Very low	221 Å²	221	155.9 Å²	155.9	83%	0.834	81%	0.806	S	S	*	*			trans	83.6	138	-170.8	-53.9	178.3	-168.6	-166.5	1.9	114.2
719	D	26.9	Very low	32.7	Very low	152 Å²	152	155.2 Å²	155.2	81%	0.813	81%	0.806	S	S	*	*			cis	-136	176	24.1	-98.8	-34.3	0	0	0	115.2
720	D	33.2	Very low	32.2	Very low	141 Å²	141	153.4 Å²	153.4	75%	0.754	81%	0.811	S	S	*	*			trans	-74.7	161.7	-161.4	-67.2	-31.1	0	0	0	120.5
721	Q	33.4	Very low	31.9	Very low	158 Å²	158	154.2 Å²	154.2	74%	0.738	81%	0.812	S	S	*	*			trans	38.7	127.5	145.6	-97.3	68.8	-15.8	0	0	122.1
722	R	26.1	Very low	31.5	Very low	246 Å²	246	152.2 Å²	152.2	93%	0.928	81%	0.808	S	S	*	*				-165.6	151.3	95	-102	171.4	-159.2	-125	0.6	114.7
723	T	28.7	Very low	31	Very low	126 Å²	126	155.4 Å²	155.4	77%	0.773	81%	0.808	S	S	*	*			trans	-84	157.3	176.1	50.6	0	0	0	0	113.2
724	Q	28.6	Very low	30.9	Very low	171 Å²	171	155.5 Å²	155.5	80%	0.799	81%	0.805	S	S	*	*				180	129.1	111.9	-175.9	159.1	14.7	0	0	112.7
725	D	27.4	Very low	30.8	Very low	147 Å²	147	156.9 Å²	156.9	79%	0.786	81%	0.805	S	S	*	*			trans	-88.5	156.5	171.9	-53.5	-74.8	0	0	0	112.8
726	F	29	Very low	30.9	Very low	199 Å²	199	156.6 Å²	156.6	87%	0.873	80%	0.801	S	S	*	*			trans	-164.1	131.3	142.8	-110.6	-68	0	0	0	112.6
727	D	36.8	Very low	30.8	Very low	146 Å²	146	155.8 Å²	155.8	78%	0.781	79%	0.789	S	S	*	*			trans	-74.9	141.3	-177.9	-81.1	-61.8	0	0	0	115.1
728	V	32.3	Very low	30.7	Very low	136 Å²	136	154.9 Å²	154.9	82%	0.824	79%	0.785	S	S	*	*			trans	-138.7	104.4	157	-179.3	0	0	0	0	112.5
729	S	29.9	Very low	30.3	Very low	91 Å²	91	151.6 Å²	151.6	64%	0.636	78%	0.781	S	S	*	*	S	Bend	trans	45.6	89.2	153.9	71	0	0	0	0	121.3
730	S	28.1	Very low	30.1	Very low	121 Å²	121	149.8 Å²	149.8	85%	0.846	78%	0.78	S	S	*	*			trans	-142.1	76.4	133.8	65.9	0	0	0	0	109.8
731	N	36.5	Very low	30.3	Very low	132 Å²	132	151.5 Å²	151.5	71%	0.706	79%	0.788	S	S	*	*			trans	-114.8	140.3	-158.5	-92.3	-42.9	0	0	0	115.7
732	L	26.3	Very low	29.7	Very low	144 Å²	144	149.5 Å²	149.5	75%	0.754	79%	0.792	S	S	*	*	S	Bend	trans	65.3	117.7	174.7	-98	61.3	0	0	0	117.3
733	K	27	Very low	29.7	Very low	184 Å²	184	142.3 Å²	142.3	80%	0.8	78%	0.779	S	S	*	*			cis	-164.7	153.8	-14.9	-130	175.3	-166.8	177.7	0	109.5
734	K	34.1	Very low	29.4	Very low	200 Å²	200	142.3 Å²	142.3	87%	0.87	78%	0.775	S	S	*	*			trans	72.7	121.3	-173.2	-51	176.3	177.8	-178.8	0	112.3
735	T	30.3	Very low	29.2	Very low	120 Å²	120	140.5 Å²	140.5	74%	0.736	77%	0.771	S	S	*	*				-147	82.5	54	-59.2	0	0	0	0	112.4
736	I	31.4	Very low	29	Very low	163 Å²	163	137.3 Å²	137.3	84%	0.836	76%	0.759	S	S	*	*			trans	-143.2	111.2	156.4	-53.6	178.6	0	0	0	105.5
737	S	31.8	Very low	28.9	Very low	90 Å²	90	138.8 Å²	138.8	63%	0.629	76%	0.759	S	S	*	*			cis	62.9	85.4	-1.4	-60.2	0	0	0	0	115.6
738	Q	35	Very low	28.2	Very low	165 Å²	165	135.9 Å²	135.9	77%	0.771	76%	0.756	S	S	*	*			cis	-142.9	157.5	9.4	-74.4	-179	-55.7	0	0	114.2
739	M	24.1	Very low	27.9	Very low	152 Å²	152	135.5 Å²	135.5	75%	0.749	75%	0.754	S	S	*	*			trans	-25.4	145.6	159.1	-66.9	87.6	81.5	0	0	115.9
740	S	22.9	Very low	27.6	Very low	113 Å²	113	138.8 Å²	138.8	79%	0.79	76%	0.759	S	S	*	*	S	Bend	cis	54.6	94	7	-61	0	0	0	0	117.1
741	L	35.9	Very low	27.3	Very low	177 Å²	177	139.6 Å²	139.6	93%	0.927	75%	0.754	S	S	*	*			trans	10.6	115.6	153.4	-67	163.1	0	0	0	118.1
742	S	22	Very low	26.9	Very low	117 Å²	117	140.9 Å²	140.9	82%	0.818	76%	0.759	S	S	*	*			trans	-83.6	105.8	149.4	56.2	0	0	0	0	109.6
743	S	26.5	Very low	27.3	Very low	95 Å²	95	139 Å²	139	66%	0.664	76%	0.758	S	S	*	*			trans	-70.3	-179.1	155.1	-176.7	0	0	0	0	110
744	D	20.9	Very low	27.7	Very low	126 Å²	126	135.5 Å²	135.5	67%	0.674	75%	0.754	S	S	*	*			trans	80.9	128.7	161.9	-66.8	25.2	0	0	0	115.7
745	N	24.3	Very low	27.2	Very low	133 Å²	133	135.7 Å²	135.7	71%	0.711	76%	0.755	S	S	*	*			cis	-159.5	156.7	-1.6	-121	-37.7	0	0	0	109.6
746	S	24.8	Very low	27.5	Very low	79 Å²	79	138.5 Å²	138.5	55%	0.552	76%	0.757	S	S	*	*			cis	-162.4	169.9	11.5	65.7	0	0	0	0	112.6
747	R	26.2	Very low	27.2	Very low	230 Å²	230	138.1 Å²	138.1	87%	0.868	76%	0.756	S	S	*	*			trans	70	129.7	162.6	-63.9	170.9	179.7	-170.3	-1.4	115.4
748	A	23.2	Very low	27.2	Very low	86 Å²	86	139.6 Å²	139.6	71%	0.711	76%	0.758	S	S	*	*			cis	85.4	151.2	44.2	0	0	0	0	0	113.9
749	T	24.8	Very low	27	Very low	127 Å²	127	141.7 Å²	141.7	78%	0.779	76%	0.764	S	S	*	*			trans	59	102.8	-165.2	35.5	0	0	0	0	113.8
750	Q	23.7	Very low	27.2	Very low	161 Å²	161	143.5 Å²	143.5	75%	0.752	77%	0.768	S	S	*	*				73.4	141.1	76.2	-77.1	-168.7	-7	0	0	114.5
751	N	22	Very low	27.5	Very low	138 Å²	138	146.1 Å²	146.1	74%	0.738	77%	0.773	S	S	*	*			trans	73.9	145.3	166.7	-51.8	-41.6	0	0	0	114.4
752	I	27.9	Very low	27	Very low	159 Å²	159	140.7 Å²	140.7	82%	0.815	76%	0.76	S	S	*	*			cis	-150	160.5	7.2	-120.1	152.9	0	0	0	109.6
753	S	35.4	Very low	27.4	Very low	103 Å²	103	142 Å²	142	72%	0.72	76%	0.758	S	S	*	*			trans	-83.2	164.4	175.5	63.3	0	0	0	0	113.5
754	P	34.8	Very low	27.7	Very low	111 Å²	111	144.5 Å²	144.5	72%	0.721	76%	0.762	S	S	*	*				-150.3	141.4	120.8	35.1	-18.2	0	0	0	117.7
755	K	24.3	Very low	28.3	Very low	205 Å²	205	145 Å²	145	89%	0.891	77%	0.765	S	S	*	*			trans	61.7	151.5	139.9	-67.3	-176.5	177.4	179.7	0	122.3
756	K	36.8	Very low	28.6	Very low	178 Å²	178	140.8 Å²	140.8	77%	0.774	75%	0.749	S	S	*	*			trans	-67.3	165.8	177.2	-46.6	172.4	174.7	-175.2	0	112.7
757	D	24.4	Very low	29	Very low	155 Å²	155	141.7 Å²	141.7	83%	0.829	75%	0.747	S	S	*	*				-154.6	169.2	104.3	-97.9	-12.3	0	0	0	112.4
758	D	31.5	Very low	29.8	Very low	122 Å²	122	136 Å²	136	65%	0.652	73%	0.729	S	S	*	*			trans	-74.4	132.8	-152.4	-66.1	-29.6	0	0	0	116.8
759	F	29.9	Very low	30.8	Very low	209 Å²	209	135.5 Å²	135.5	92%	0.917	72%	0.721	S	S	*	*			trans	-111.2	122.8	143.5	-80	-80.2	0	0	0	109.2	N761	F759-N761 PolarHBondContact O-N 2.96Å
760	K	28.3	Very low	31.4	Very low	190 Å²	190	136.3 Å²	136.3	83%	0.826	72%	0.715	S	S	*	*			trans	-77.5	122.4	-171.4	-67.7	-178.7	178.9	177.2	0	111.8	G762	K760-G762 PolarHBondContact O-N 3.23Å; K760-G762 VanDerWaalsContact O-N 3.08Å
761	N	31.1	Very low	32.4	Very low	168 Å²	168	132.7 Å²	132.7	90%	0.898	70%	0.701	S	S	*	*			trans	-63.2	107	163.7	-81	-16.5	0	0	0	109.7	F759 D763	F759-N761 PolarHBondContact O-N 2.96Å; N761-D763 PolarHBondContact O-N 3.36Å
762	G	25.1	Very low	33	Very low	63 Å²	63	134.3 Å²	134.3	65%	0.649	70%	0.701	S	S	*	*			trans	-78	103.3	162.5	0	0	0	0	0	109.3	K760 I764	K760-G762 PolarHBondContact O-N 3.23Å; K760-G762 VanDerWaalsContact O-N 3.08Å; G762-I764 VanDerWaalsContact C-N 3.31Å; G762-I764 PolarHBondContact O-N 2.75Å
763	D	29.6	Very low	33.8	Very low	144 Å²	144	131.2 Å²	131.2	77%	0.77	69%	0.686	S	S	*	*			trans	-71.6	86.2	174.1	-175.6	13.8	0	0	0	110.3	N761 N765	N761-D763 PolarHBondContact O-N 3.36Å; D763-N765 PolarHBondContact O-N 2.84Å; D763-N765 VanDerWaalsContact O-N 3.11Å; D763-N765 PolarHBondContact OD1-N 3.32Å
764	I	33.9	Very low	33.9	Very low	147 Å²	147	131.2 Å²	131.2	75%	0.754	68%	0.678	S	S	*	*			trans	-86.3	65.8	173.2	-52.7	179.8	0	0	0	108.5	G762 A766	G762-I764 VanDerWaalsContact C-N 3.31Å; G762-I764 PolarHBondContact O-N 2.75Å; I764-A766 HydrophobicContact CG2-CB 3.79Å; I764-A766 PolarHBondContact O-N 3.48Å
765	N	32.6	Very low	34.4	Very low	136 Å²	136	127.7 Å²	127.7	73%	0.727	65%	0.653	S	S	*	*			trans	-72.4	71.2	156.9	-169.6	8.7	0	0	0	108.5	D763 D767	D763-N765 PolarHBondContact O-N 2.84Å; D763-N765 VanDerWaalsContact O-N 3.11Å; D763-N765 PolarHBondContact OD1-N 3.32Å; N765-D767 PolarHBondContact O-N 3.45Å
766	A	30.2	Very low	35.5	Very low	46 Å²	46	125 Å²	125	38%	0.38	64%	0.641	S	S	.	*			trans	-71.7	91.2	-178.5	0	0	0	0	0	110.4	I764 F768	I764-A766 HydrophobicContact CG2-CB 3.79Å; I764-A766 PolarHBondContact O-N 3.48Å; A766-F768 PolarHBondContact O-N 2.82Å
767	D	32.6	Very low	35.6	Very low	98 Å²	98	123.1 Å²	123.1	52%	0.524	64%	0.64	S	S	.	*			trans	-49.7	130.5	159.3	174.4	31.6	0	0	0	109.6	N765 S769 Q770	N765-D767 PolarHBondContact O-N 3.45Å; D767-S769 PolarHBondContact O-N 3.06Å; D767-S769 VanDerWaalsContact OD2-CB 3.26Å; D767-S769 WeakPolarHBondContact OD2-CB 3.27Å; D767-S769 PolarHBondContact OD2-OG 2.85Å; D767-Q770 PolarHBondContact O-N 3.46Å
768	F	44.9	Very low	36.3	Very low	110 Å²	110	119.4 Å²	119.4	48%	0.482	63%	0.625	S	S	.	*	G	3₁₀ helix	trans	-64.5	-13.3	-170.1	-83.5	-103.2	0	0	0	113	Y629 A766 Q770 L771	Y629-F768 HydrophobicContact CE1-CE1 4.31Å; Y629-F768 HydrophobicContact CE1-CZ 4.19Å; Y629-F768 AromaticContact CZ-CZ 3.91Å; Y629-F768 VanDerWaalsContact OH-CZ 3.27Å; Y629-F768 WeakPolarHBondContact OH-CZ 3.2Å; A766-F768 PolarHBondContact O-N 2.82Å; F768-Q770 PolarHBondContact O-N 3.45Å; F768-Q770 VanDerWaalsContact O-N 3.14Å; F768-L771 HydrophobicContact CD1-CD1 3.55Å; F768-L771 HydrophobicContact CE1-CD1 3.88Å; F768-L771 HydrophobicContact CG-CD1 4.24Å; F768-L771 PolarHBondContact O-N 3.07Å
769	S	42.9	Very low	36.6	Very low	76 Å²	76	121.5 Å²	121.5	53%	0.531	62%	0.624	S	S	.	*	G	3₁₀ helix	trans	-55.6	-21.8	169.2	69.9	0	0	0	0	114.5	D767	D767-S769 PolarHBondContact O-N 3.06Å; D767-S769 VanDerWaalsContact OD2-CB 3.26Å; D767-S769 WeakPolarHBondContact OD2-CB 3.27Å; D767-S769 PolarHBondContact OD2-OG 2.85Å
770	Q	38.4	Very low	36.8	Very low	143 Å²	143	119.2 Å²	119.2	67%	0.668	62%	0.615	S	S	*	*	G	3₁₀ helix	trans	-89.5	-9.5	-177.5	-57.9	-168.4	29.9	0	0	114.3	D767 F768 K772	D767-Q770 PolarHBondContact O-N 3.46Å; F768-Q770 PolarHBondContact O-N 3.45Å; F768-Q770 VanDerWaalsContact O-N 3.14Å; Q770-K772 PolarHBondContact O-N 3.3Å
771	L	43	Very low	37.2	Very low	86 Å²	86	120.3 Å²	120.3	45%	0.45	62%	0.616	S	S	.	*			trans	-79.1	61.5	-179	-73.2	165.4	0	0	0	112.5	L657 F768 L773	L657-L771 HydrophobicContact CD1-CD1 4.04Å; L657-L771 HydrophobicContact CD1-CD2 3.71Å; L657-L771 HydrophobicContact CD1-CG 4.5Å; L657-L771 HydrophobicContact CD2-CB 4.35Å; L657-L771 HydrophobicContact CD2-CD1 4.18Å; L657-L771 HydrophobicContact CD2-CD2 4.03Å; L657-L771 HydrophobicContact CD2-CG 4.42Å; L657-L771 HydrophobicContact CG-CD1 4.49Å; F768-L771 HydrophobicContact CD1-CD1 3.55Å; F768-L771 HydrophobicContact CE1-CD1 3.88Å; F768-L771 HydrophobicContact CG-CD1 4.24Å; F768-L771 PolarHBondContact O-N 3.07Å; L771-L773 PolarHBondContact O-N 3.25Å
772	K	36.1	Very low	37.3	Very low	172 Å²	172	119.3 Å²	119.3	75%	0.748	61%	0.606	S	S	*	*			trans	-78.2	106.8	171.5	-68.4	177.2	-178.2	170.9	0	110.1	Q770 D774	Q770-K772 PolarHBondContact O-N 3.3Å; K772-D774 PolarHBondContact O-N 3.38Å
773	L	43.8	Very low	37.7	Very low	93 Å²	93	125.7 Å²	125.7	49%	0.487	62%	0.619	S	S	.	*			trans	-54.8	132.5	141.2	-72.2	163.7	0	0	0	106.8	K664 L771 D775	K664-L773 HydrophobicContact CD-CD1 4.23Å; L771-L773 PolarHBondContact O-N 3.25Å; L773-D775 VanDerWaalsContact C-N 3.28Å; L773-D775 PolarHBondContact O-N 3.35Å
774	D	38.8	Very low	37.5	Very low	103 Å²	103	125.9 Å²	125.9	55%	0.551	62%	0.617	S	S	*	*			trans	-71.9	89.6	177.9	-169.7	30.3	0	0	0	109.3	K772 K776	K772-D774 PolarHBondContact O-N 3.38Å; D774-K776 WeakPolarHBondContact OD2-CE 3.45Å; D774-K776 IonicContact OD2-NZ 2.64Å; D774-K776 PolarHBondContact OD2-NZ 3.43Å
775	D	43.6	Very low	37.5	Very low	38 Å²	38	123 Å²	123	20%	0.203	61%	0.61	C	S	.	*			trans	-106.3	71.1	-171.7	-141.7	24.9	0	0	0	108.8	K664 L773 D777 C778	K664-D775 IonicContact NZ-OD1 3.62Å; K664-D775 PolarHBondContact NZ-OD1 3.07Å; L773-D775 VanDerWaalsContact C-N 3.28Å; L773-D775 PolarHBondContact O-N 3.35Å; D775-D777 PolarHBondContact O-N 2.93Å; D775-C778 HydrophobicContact CB-CB 4.18Å; D775-C778 PolarHBondContact O-N 2.75Å; D775-C778 WeakPolarHBondContact OD2-CB 3.44Å; D775-C778 PolarHBondContact OD2-SG 2.91Å
776	K	47.3	Very low	37.5	Very low	147 Å²	147	124.5 Å²	124.5	64%	0.639	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-62.8	-30.9	179.2	-74.4	170.1	173.8	139.9	0	111.9	D774 C778	D774-K776 WeakPolarHBondContact OD2-CE 3.45Å; D774-K776 IonicContact OD2-NZ 2.64Å; D774-K776 PolarHBondContact OD2-NZ 3.43Å; K776-C778 VanDerWaalsContact C-N 3.29Å; K776-C778 PolarHBondContact O-N 3.38Å
777	D	39	Very low	37.7	Very low	139 Å²	139	128.8 Å²	128.8	74%	0.743	63%	0.629	S	S	*	*	G	3₁₀ helix	trans	-71.3	-17.2	177	-63.9	12.9	0	0	0	113.9	D775	D775-D777 PolarHBondContact O-N 2.93Å
778	C	39.5	Very low	38	Very low	77 Å²	77	134.3 Å²	134.3	52%	0.52	64%	0.643	S	S	.	*	G	3₁₀ helix	trans	-100.9	20.9	-178	-76.1	0	0	0	0	113.7	D775 K776	D775-C778 HydrophobicContact CB-CB 4.18Å; D775-C778 PolarHBondContact O-N 2.75Å; D775-C778 WeakPolarHBondContact OD2-CB 3.44Å; D775-C778 PolarHBondContact OD2-SG 2.91Å; K776-C778 VanDerWaalsContact C-N 3.29Å; K776-C778 PolarHBondContact O-N 3.38Å
779	R	37.2	Very low	37.2	Very low	166 Å²	166	134.6 Å²	134.6	63%	0.626	66%	0.658	S	S	*	*	S	Bend	trans	-129.3	44.3	179	-67.1	-148.8	-55.7	-78.7	1.8	115.5
780	H	35.6	Very low	36.8	Very low	161 Å²	161	137.7 Å²	137.7	75%	0.745	67%	0.669	S	S	*	*			trans	-156.2	78.8	147.9	-127.3	-80.9	0	0	0	113.8
781	Y	35.6	Very low	36.3	Very low	214 Å²	214	135.6 Å²	135.6	84%	0.839	68%	0.676	S	S	*	*			trans	-133.7	95	147.3	-88.2	-72.5	0	0	0	109	M784	Y781-M784 HydrophobicContact CD1-SD 4.35Å; Y781-M784 HydrophobicContact CE1-SD 4.06Å
782	Q	33.4	Very low	35.7	Very low	147 Å²	147	139.2 Å²	139.2	69%	0.687	69%	0.688	S	S	*	*			trans	-64.8	144.6	151	176.9	173.8	-29.5	0	0	107.3	M784	Q782-M784 PolarHBondContact O-N 3.36Å
783	E	33.7	Very low	35.4	Very low	196 Å²	196	138.5 Å²	138.5	92%	0.916	69%	0.687	S	S	*	*			trans	-52.2	94.9	177.4	-166.8	167	-141.4	0	0	110.7
784	M	25.4	Very low	34.6	Very low	148 Å²	148	139.7 Å²	139.7	73%	0.729	69%	0.694	S	S	*	*			trans	-83.8	146.4	168.7	-74.9	173.3	59.6	0	0	108.3	Y781 Q782	Y781-M784 HydrophobicContact CD1-SD 4.35Å; Y781-M784 HydrophobicContact CE1-SD 4.06Å; Q782-M784 PolarHBondContact O-N 3.36Å
785	S	33.4	Very low	34.2	Very low	88 Å²	88	141.5 Å²	141.5	62%	0.615	70%	0.703	S	S	*	*			trans	-59.8	146.6	-174.6	37.3	0	0	0	0	112.8	D787	S785-D787 WeakPolarHBondContact CB-OD1 3.48Å; S785-D787 PolarHBondContact O-N 3.48Å; S785-D787 PolarHBondContact OG-OD1 3.1Å
786	E	33.5	Very low	33.5	Very low	167 Å²	167	146.8 Å²	146.8	78%	0.78	74%	0.737	S	S	*	*			trans	-69.4	79	161.4	-66.4	-171.8	165.9	0	0	108.8	W788	E786-W788 VanDerWaalsContact C-N 3.28Å; E786-W788 VanDerWaalsContact O-CD1 3.25Å; E786-W788 PolarHBondContact O-N 2.92Å; E786-W788 PolarHBondContact OE2-NE1 3.48Å
787	D	33.2	Very low	32.6	Very low	135 Å²	135	143.2 Å²	143.2	72%	0.722	74%	0.742	S	S	*	*			trans	-71.3	85.5	175.3	-73.3	1.6	0	0	0	109.3	S785 S789	S785-D787 WeakPolarHBondContact CB-OD1 3.48Å; S785-D787 PolarHBondContact O-N 3.48Å; S785-D787 PolarHBondContact OG-OD1 3.1Å; D787-S789 PolarHBondContact O-N 3.14Å; D787-S789 VanDerWaalsContact O-N 3.16Å
788	W	39.6	Very low	32.1	Very low	215 Å²	215	142.9 Å²	142.9	81%	0.814	74%	0.744	S	S	*	*			trans	-62.7	107.7	178.1	-77.9	29.8	0	0	0	111.8	E786	E786-W788 VanDerWaalsContact C-N 3.28Å; E786-W788 VanDerWaalsContact O-CD1 3.25Å; E786-W788 PolarHBondContact O-N 2.92Å; E786-W788 PolarHBondContact OE2-NE1 3.48Å
789	S	27.8	Very low	31.4	Very low	115 Å²	115	145.9 Å²	145.9	80%	0.804	76%	0.756	S	S	*	*			trans	-171.3	151.1	158.8	-82.1	0	0	0	0	109.3	D787	D787-S789 PolarHBondContact O-N 3.14Å; D787-S789 VanDerWaalsContact O-N 3.16Å
790	D	34.7	Very low	30.9	Very low	141 Å²	141	145.2 Å²	145.2	75%	0.754	76%	0.763	S	S	*	*			cis	-148	141.6	3.5	-154.2	-19.7	0	0	0	110.2
791	A	27.3	Very low	30.4	Very low	99 Å²	99	143.3 Å²	143.3	82%	0.818	77%	0.767	S	S	*	*			trans	-164.6	59.8	176.8	0	0	0	0	0	111.7	E793	A791-E793 PolarHBondContact O-N 3.5Å
792	K	30.9	Very low	29.8	Very low	163 Å²	163	136 Å²	136	71%	0.709	76%	0.757	S	S	*	*			trans	-75.9	90	179.9	-173	176.9	178.1	179.3	0	112.8	N794	K792-N794 WeakPolarHBondContact CE-OD1 3.38Å; K792-N794 PolarHBondContact O-N 2.64Å
793	E	30.8	Very low	29.6	Very low	157 Å²	157	135.1 Å²	135.1	73%	0.734	76%	0.762	S	S	*	*			trans	-73	114	165.1	-172.4	-179.7	148.5	0	0	110	A791 L795	A791-E793 PolarHBondContact O-N 3.5Å; E793-L795 HydrophobicContact CG-CG 4.36Å; E793-L795 VanDerWaalsContact OE1-CD1 3.25Å; E793-L795 WeakPolarHBondContact OE1-CD1 3.22Å
794	N	26.8	Very low	29.1	Very low	117 Å²	117	133.4 Å²	133.4	63%	0.626	75%	0.754	S	S	*	*			trans	-96.3	110.2	170.5	-60.4	-63.1	0	0	0	109.1	K792	K792-N794 WeakPolarHBondContact CE-OD1 3.38Å; K792-N794 PolarHBondContact O-N 2.64Å
795	L	31	Very low	29.1	Very low	142 Å²	142	134.5 Å²	134.5	74%	0.743	76%	0.757	S	S	*	*			trans	-125	97.4	164.4	-75.7	-177.4	0	0	0	110.6	E793 G797	E793-L795 HydrophobicContact CG-CG 4.36Å; E793-L795 VanDerWaalsContact OE1-CD1 3.25Å; E793-L795 WeakPolarHBondContact OE1-CD1 3.22Å; L795-G797 PolarHBondContact O-N 2.69Å
796	T	28.4	Very low	28.6	Very low	148 Å²	148	136.2 Å²	136.2	91%	0.908	76%	0.76	S	S	*	*			trans	-74.4	108	161.7	-51.6	0	0	0	0	107.9
797	G	27.1	Very low	28.3	Very low	72 Å²	72	136.7 Å²	136.7	74%	0.742	76%	0.762	S	S	*	*			trans	-136.2	124.8	177.2	0	0	0	0	0	110.2	L795	L795-G797 PolarHBondContact O-N 2.69Å
798	V	28.4	Very low	28.1	Very low	132 Å²	132	137.2 Å²	137.2	80%	0.8	76%	0.763	S	S	*	*			trans	-83	154.4	-171.6	174.2	0	0	0	0	111.8
799	D	26.1	Very low	27.4	Very low	141 Å²	141	135.2 Å²	135.2	75%	0.754	76%	0.763	S	S	*	*			trans	-57.3	162.2	-178.8	-53.2	-89.9	0	0	0	115.8
800	I	26.9	Very low	27.2	Very low	151 Å²	151	138 Å²	138	77%	0.774	76%	0.763	S	S	*	*				169	132.2	109.9	-85.9	164.4	0	0	0	111.5
801	S	24.5	Very low	26.6	Very low	121 Å²	121	137.8 Å²	137.8	85%	0.846	76%	0.762	S	S	*	*			trans	65	152.4	162.1	74.2	0	0	0	0	119.2
802	G	23.8	Very low	26.5	Very low	60 Å²	60	141.7 Å²	141.7	62%	0.619	76%	0.756	S	S	*	*			cis	167.9	162.6	-10.1	0	0	0	0	0	113.4
803	T	27.6	Very low	26.2	Very low	130 Å²	130	144 Å²	144	80%	0.798	76%	0.76	S	S	*	*			trans	62	119.4	169.8	37.8	0	0	0	0	117.1
804	Q	24.3	Very low	25.8	Very low	159 Å²	159	144.1 Å²	144.1	74%	0.743	77%	0.766	S	S	*	*				79.1	128.3	91.4	-161.7	170.8	-22.1	0	0	111
805	E	25	Very low	25.7	Very low	171 Å²	171	146.5 Å²	146.5	80%	0.799	78%	0.778	S	S	*	*				-150.3	-178.6	53.4	-168.1	151.5	-138.1	0	0	114.5
806	N	23.7	Very low	25.3	Very low	125 Å²	125	145.3 Å²	145.3	67%	0.668	77%	0.772	S	S	*	*			trans	-112.5	156.4	-172.4	-75.2	-70.6	0	0	0	113.7
807	Q	25.9	Very low	25.2	Very low	176 Å²	176	146.4 Å²	146.4	82%	0.822	77%	0.771	S	S	*	*			trans	64.7	157.9	160.7	-64.7	143.6	30.4	0	0	113.9
808	I	29.4	Very low	25.1	Very low	146 Å²	146	148.3 Å²	148.3	75%	0.749	77%	0.769	S	S	*	*			cis	-137	128.9	28.9	-66.7	160	0	0	0	105.5
809	E	24.8	Very low	24.9	Very low	174 Å²	174	149.7 Å²	149.7	81%	0.813	77%	0.771	S	S	*	*				66.1	152.7	72.5	-154.4	174	-120.4	0	0	114.6
810	Q	24.7	Very low	25	Very low	174 Å²	174	150 Å²	150	81%	0.813	77%	0.768	S	S	*	*			trans	70.5	148	-177.5	-60.7	-175.2	12.1	0	0	117.8
811	D	22.2	Very low	25	Very low	135 Å²	135	150.5 Å²	150.5	72%	0.722	77%	0.769	S	S	*	*			cis	-163.7	153.4	-32.4	-160.7	-5.2	0	0	0	109.3
812	R	24.9	Very low	25.2	Very low	182 Å²	182	152.5 Å²	152.5	69%	0.687	76%	0.762	S	S	*	*			trans	59.7	156.2	176.4	-61.8	171.6	154.8	-141.1	-1.1	115.4
813	W	23.6	Very low	25.2	Very low	212 Å²	212	156.3 Å²	156.3	80%	0.803	77%	0.768	S	S	*	*			cis	-131.5	146.6	16.5	-76.2	71.9	0	0	0	112.1
814	N	22.4	Very low	25.3	Very low	159 Å²	159	156.4 Å²	156.4	85%	0.85	77%	0.768	S	S	*	*			trans	-83.1	144.9	157.6	-73.2	-66.2	0	0	0	109.5
815	L	26	Very low	25.2	Very low	167 Å²	167	157 Å²	157	87%	0.874	77%	0.771	S	S	*	*			trans	-134.7	108.1	161.6	-125.3	165.9	0	0	0	108.6
816	D	22.8	Very low	25.5	Very low	117 Å²	117	153 Å²	153	63%	0.626	76%	0.76	S	S	*	*			trans	-79.3	126.8	-175.7	178.6	4.7	0	0	0	110.5	T818	D816-T818 WeakPolarHBondContact OD1-CB 3.47Å; D816-T818 PolarHBondContact OD1-N 2.82Å; D816-T818 PolarHBondContact OD1-OG1 2.99Å
817	L	25.4	Very low	25.7	Very low	171 Å²	171	150 Å²	150	90%	0.895	75%	0.749	S	S	*	*			trans	-132.9	64	163.4	-84.8	176.9	0	0	0	110	L819	L817-L819 PolarHBondContact O-N 3.25Å
818	T	24.3	Very low	26.2	Very low	112 Å²	112	150.2 Å²	150.2	69%	0.687	75%	0.75	S	S	*	*			trans	-58	114.6	167.9	-66.3	0	0	0	0	111.2	D816	D816-T818 WeakPolarHBondContact OD1-CB 3.47Å; D816-T818 PolarHBondContact OD1-N 2.82Å; D816-T818 PolarHBondContact OD1-OG1 2.99Å
819	L	25.8	Very low	26.5	Very low	161 Å²	161	151 Å²	151	84%	0.843	74%	0.743	S	S	*	*			trans	-133	109.8	160.7	-167	76.8	0	0	0	109	L817 M821	L817-L819 PolarHBondContact O-N 3.25Å; L819-M821 PolarHBondContact O-N 2.66Å
820	E	26.8	Very low	27.5	Very low	147 Å²	147	150 Å²	150	69%	0.687	74%	0.744	S	S	*	*			trans	-70	110.1	179.5	-74.7	-163.1	109.6	0	0	111.7	K822	E820-K822 WeakPolarHBondContact OE1-CE 3.28Å; E820-K822 IonicContact OE1-NZ 2.64Å; E820-K822 IonicContact OE2-NZ 2.71Å
821	M	26.4	Very low	28.9	Very low	162 Å²	162	151.2 Å²	151.2	80%	0.798	75%	0.746	S	S	*	*			trans	-108.7	110	150.8	-94.8	-173.4	146.5	0	0	109.3	L819 N823	L819-M821 PolarHBondContact O-N 2.66Å; M821-N823 PolarHBondContact O-N 3.09Å
822	K	30.1	Very low	30.9	Very low	163 Å²	163	146.2 Å²	146.2	71%	0.709	73%	0.727	S	S	*	*			trans	-75.2	70.6	179.3	-72.5	178.8	179.3	164.1	0	111.7	E820 V824	E820-K822 WeakPolarHBondContact OE1-CE 3.28Å; E820-K822 IonicContact OE1-NZ 2.64Å; E820-K822 IonicContact OE2-NZ 2.71Å; K822-V824 PolarHBondContact O-N 3.08Å; K822-V824 VanDerWaalsContact O-N 3.09Å
823	N	24	Very low	33.6	Very low	139 Å²	139	141.3 Å²	141.3	74%	0.743	71%	0.709	S	S	*	*			trans	-70.9	98	161.6	-72.4	-51.3	0	0	0	108.4	M821 E825	M821-N823 PolarHBondContact O-N 3.09Å; N823-E825 PolarHBondContact O-N 3.02Å
824	V	29.4	Very low	36.6	Very low	133 Å²	133	133.9 Å²	133.9	81%	0.806	69%	0.685	S	S	*	*			trans	-73.3	83.2	164	-179.1	0	0	0	0	106.8	K822 P826	K822-V824 PolarHBondContact O-N 3.08Å; K822-V824 VanDerWaalsContact O-N 3.09Å; V824-P826 WeakPolarHBondContact O-CD 3.36Å
825	E	22.8	Very low	39.9	Very low	170 Å²	170	126.4 Å²	126.4	79%	0.794	65%	0.645	S	S	*	*			trans	-62.7	118.8	170.9	-174.2	172.1	-157.8	0	0	108.2	N823 S827	N823-E825 PolarHBondContact O-N 3.02Å; E825-S827 PolarHBondContact O-N 3.09Å
826	P	29.8	Very low	42.9	Very low	88 Å²	88	120.7 Å²	120.7	57%	0.571	61%	0.613	S	S	*	*			trans	-67.2	108.2	178.5	26.9	-32.2	0	0	0	108.1	V824 Q828	V824-P826 WeakPolarHBondContact O-CD 3.36Å; P826-Q828 PolarHBondContact O-N 3.05Å
827	S	28.7	Very low	46.1	Very low	62 Å²	62	115.1 Å²	115.1	43%	0.434	58%	0.584	S	S	.	*			trans	-33.3	133.7	175.3	56.2	0	0	0	0	112.4	E825 R829	E825-S827 PolarHBondContact O-N 3.09Å; S827-R829 VanDerWaalsContact C-N 3.26Å; S827-R829 WeakPolarHBondContact O-CG 3.46Å; S827-R829 PolarHBondContact O-N 3.3Å; S827-R829 PolarHBondContact OG-NE 3.11Å; S827-R829 PolarHBondContact OG-NH2 2.77Å
828	Q	36.5	Very low	49	Very low	181 Å²	181	107 Å²	107	85%	0.846	54%	0.541	S	S	*	.			trans	-60	81.6	176	-172.6	176.5	40.2	0	0	111.6	P826	P826-Q828 PolarHBondContact O-N 3.05Å
829	R	36	Very low	51.8	Low	162 Å²	162	102.8 Å²	102.8	61%	0.611	52%	0.52	S	S	*	.			trans	-87.7	161.4	176.9	-69	178	-156.6	-173.2	15.3	110.6	S827	S827-R829 VanDerWaalsContact C-N 3.26Å; S827-R829 WeakPolarHBondContact O-CG 3.46Å; S827-R829 PolarHBondContact O-N 3.3Å; S827-R829 PolarHBondContact OG-NE 3.11Å; S827-R829 PolarHBondContact OG-NH2 2.77Å
830	D	44.5	Very low	54.7	Low	154 Å²	154	95.2 Å²	95.2	82%	0.824	48%	0.481	S	S	*	.			trans	-50.9	158.3	172.3	-57.7	-77.7	0	0	0	112.5	G832	D830-G832 PolarHBondContact O-N 2.9Å
831	K	54.8	Low	57.3	Low	198 Å²	198	89.3 Å²	89.3	86%	0.861	46%	0.455	S	S	*	.			trans	-60.4	78.4	-175.1	-64.3	175.9	-179.1	175.9	0	112.1
832	G	64.6	Low	59.9	Low	31 Å²	31	85.8 Å²	85.8	32%	0.32	45%	0.445	S	S	.	.	P	Polyproline II helix	trans	-64	137.9	-173.2	0	0	0	0	0	111.9	D830 L834 F877	D830-G832 PolarHBondContact O-N 2.9Å; G832-L834 PolarHBondContact O-N 3.12Å; G832-F877 WeakPolarHBondContact CA-O 3.38Å
833	Y	80.8	Confident	62.4	Low	78 Å²	78	81.7 Å²	81.7	31%	0.306	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	116.1	179.3	-67.2	-86	0	0	0	108.8	F877 K879 N880 A883 I907	Y833-F877 PolarHBondContact N-O 2.91Å; Y833-F877 WeakPolarHBondContact O-CD2 3.42Å; Y833-F877 PolarHBondContact O-N 3.49Å; Y833-K879 VanDerWaalsContact CD2-C 3.43Å; Y833-N880 HydrophobicContact CD1-CB 4Å; Y833-N880 HydrophobicContact CD2-CB 4.07Å; Y833-N880 VanDerWaalsContact CD2-N 3.25Å; Y833-N880 HydrophobicContact CE1-CB 3.62Å; Y833-N880 VanDerWaalsContact CE1-ND2 3.32Å; Y833-N880 WeakPolarHBondContact CE1-ND2 3.34Å; Y833-N880 HydrophobicContact CE2-CB 3.68Å; Y833-N880 HydrophobicContact CG-CB 4.21Å; Y833-N880 VanDerWaalsContact CZ-CB 3.45Å; Y833-A883 HydrophobicContact CG-CB 4.49Å; Y833-I907 HydrophobicContact CD1-CD1 4.27Å
834	L	87.3	Confident	65.4	Low	56 Å²	56	75.1 Å²	75.1	29%	0.293	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	127.3	-171.4	-172.5	70.4	0	0	0	110.9	G832 T876 V905	G832-L834 PolarHBondContact O-N 3.12Å; L834-T876 HydrophobicContact CD1-CG2 3.78Å; L834-V905 HydrophobicContact CB-CB 4.18Å; L834-V905 HydrophobicContact CB-CG2 4.36Å; L834-V905 HydrophobicContact CD2-CB 4.03Å; L834-V905 HydrophobicContact CD2-CG1 4.1Å; L834-V905 HydrophobicContact CD2-CG2 3.9Å; L834-V905 HydrophobicContact CG-CB 4.14Å; L834-V905 HydrophobicContact CG-CG2 3.85Å; L834-V905 WeakPolarHBondContact O-CB 3.44Å; L834-V905 PolarHBondContact O-N 3.13Å
835	I	90.3	Very high	68.1	Low	2 Å²	2	71 Å²	71	1%	0.01	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	134.4	176.6	-68.2	177	0	0	0	109.3	V837 S874 L875 F877 A883 A886 V887 V902 R903	I835-V837 HydrophobicContact CG2-CG2 3.96Å; I835-S874 WeakPolarHBondContact O-CA 3.07Å; I835-L875 PolarHBondContact N-O 2.78Å; I835-L875 PolarHBondContact O-N 2.76Å; I835-F877 HydrophobicContact CB-CE2 3.87Å; I835-F877 HydrophobicContact CD1-CD2 4.04Å; I835-F877 HydrophobicContact CD1-CE1 4.32Å; I835-F877 HydrophobicContact CD1-CE2 3.6Å; I835-F877 HydrophobicContact CD1-CZ 3.76Å; I835-F877 HydrophobicContact CG1-CD2 4.29Å; I835-F877 HydrophobicContact CG1-CE2 3.96Å; I835-A883 HydrophobicContact CD1-CB 3.71Å; I835-A883 VanDerWaalsContact CD1-O 3.23Å; I835-A883 WeakPolarHBondContact CD1-O 3.41Å; I835-A883 HydrophobicContact CG1-CB 4.37Å; I835-A886 HydrophobicContact CD1-CB 4.2Å; I835-V887 HydrophobicContact CD1-CG2 3.61Å; I835-V887 HydrophobicContact CG1-CG2 4.04Å; I835-V887 HydrophobicContact CG2-CG2 4.41Å; I835-V902 HydrophobicContact CG2-CG1 3.44Å; I835-V902 VanDerWaalsContact CG2-CG1 3.44Å; I835-R903 WeakPolarHBondContact CA-O 3.28Å; I835-R903 WeakPolarHBondContact CG2-O 3.31Å
836	H	89.9	Confident	71.2	Confident	47 Å²	47	66.9 Å²	66.9	22%	0.218	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	130.9	172	174.2	-74.4	0	0	0	110.1	Y872 R903 V905	H836-Y872 AromaticContact CD2-CD2 3.61Å; H836-Y872 AromaticContact NE2-CD2 3.31Å; H836-Y872 VanDerWaalsContact NE2-CD2 3.31Å; H836-Y872 WeakPolarHBondContact NE2-CD2 3.48Å; H836-Y872 AromaticContact NE2-CG 3.55Å; H836-R903 PolarHBondContact N-O 3.2Å; H836-R903 PolarHBondContact O-N 3.38Å; H836-V905 HydrophobicContact CB-CG2 3.97Å
837	V	89.1	Confident	73.8	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	96	-174.1	175.5	0	0	0	0	108.2	I835 L840 L849 F853 Y872 A873 L875 V900 V902	I835-V837 HydrophobicContact CG2-CG2 3.96Å; V837-L840 HydrophobicContact CG1-CD1 4.49Å; V837-L840 HydrophobicContact CG1-CD2 3.94Å; V837-L840 HydrophobicContact CG1-CG 4.42Å; V837-L849 HydrophobicContact CG1-CD2 4.5Å; V837-F853 HydrophobicContact CG1-CZ 4.34Å; V837-F853 HydrophobicContact CG2-CE1 4.42Å; V837-F853 HydrophobicContact CG2-CZ 3.92Å; V837-Y872 CarbonylContact O-C 3.48Å; V837-Y872 VanDerWaalsContact O-CA 3.25Å; V837-Y872 WeakPolarHBondContact O-CA 3.21Å; V837-A873 HydrophobicContact CB-CB 4.45Å; V837-A873 PolarHBondContact N-O 2.99Å; V837-A873 PolarHBondContact O-N 3.48Å; V837-L875 HydrophobicContact CB-CD1 3.87Å; V837-L875 HydrophobicContact CG2-CD1 3.48Å; V837-L875 VanDerWaalsContact CG2-CD1 3.48Å; V837-V900 HydrophobicContact CG1-CG1 3.29Å; V837-V902 HydrophobicContact CG1-CG2 4.41Å; V837-V902 HydrophobicContact CG2-CG1 4.15Å; V837-V902 HydrophobicContact CG2-CG2 4.2Å
838	G	87.6	Confident	76.7	Confident	0 Å²	0	65.2 Å²	65.2	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	158.7	-173.8	0	0	0	0	0	114.2	Y870 N901	G838-Y870 WeakPolarHBondContact CA-OH 3.32Å; G838-N901 PolarHBondContact N-O 3Å; G838-N901 PolarHBondContact O-N 2.89Å
839	G	82.9	Confident	79.1	Confident	24 Å²	24	56.6 Å²	56.6	25%	0.247	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88.3	18.3	175.9	0	0	0	0	0	114.7	R871	G839-R871 PolarHBondContact N-O 2.78Å
840	L	86.4	Confident	81.7	Confident	3 Å²	3	54.4 Å²	54.4	2%	0.016	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	151.9	-176.4	-63.1	177.8	0	0	0	112.4	V837 V844 L849 R871 A873 V900	V837-L840 HydrophobicContact CG1-CD1 4.49Å; V837-L840 HydrophobicContact CG1-CD2 3.94Å; V837-L840 HydrophobicContact CG1-CG 4.42Å; L840-V844 HydrophobicContact CD2-CG1 4.42Å; L840-L849 HydrophobicContact CD1-CD1 3.96Å; L840-L849 HydrophobicContact CD1-CD2 4.2Å; L840-L849 HydrophobicContact CD2-CD2 3.9Å; L840-R871 HydrophobicContact CB-CB 4.1Å; L840-R871 HydrophobicContact CB-CG 3.88Å; L840-R871 HydrophobicContact CD1-CG 4.26Å; L840-R871 PolarHBondContact N-O 2.61Å; L840-A873 HydrophobicContact CD1-CB 3.75Å; L840-V900 HydrophobicContact CD2-CG1 3.86Å; L840-V900 HydrophobicContact CD2-CG2 3.92Å
841	C	81.5	Confident	83.7	Confident	22 Å²	22	50.2 Å²	50.2	15%	0.149	28%	0.284	C	S	.	.			trans	-76.9	143	170	-153.7	0	0	0	0	109.7	S843 V844 N896 K898	C841-S843 PolarHBondContact O-N 3.25Å; C841-V844 HydrophobicContact CB-CG2 3.92Å; C841-V844 WeakPolarHBondContact O-CB 3.5Å; C841-V844 WeakPolarHBondContact O-CG2 3.28Å; C841-V844 PolarHBondContact O-N 3.43Å; C841-N896 HydrophobicContact CB-CB 4.25Å; C841-K898 HydrophobicContact CB-CD 3.94Å; C841-K898 HydrophobicContact CB-CG 4.12Å
842	P	81.7	Confident	85.1	Confident	89 Å²	89	44.3 Å²	44.3	58%	0.578	26%	0.259	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-18.4	174.9	-27.5	36.5	0	0	0	114.5	R871	P842-R871 PolarHBondContact O-NH1 3.43Å; P842-R871 VanDerWaalsContact O-NH1 3.15Å
843	S	81.4	Confident	86.2	Confident	76 Å²	76	42.9 Å²	42.9	53%	0.531	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-79.6	-8.3	172.6	57.1	0	0	0	0	114.9	C841 S845 N896	C841-S843 PolarHBondContact O-N 3.25Å; S843-S845 PolarHBondContact O-N 3.45Å; S843-N896 PolarHBondContact O-ND2 3.42Å
844	V	86.6	Confident	86.4	Confident	1 Å²	1	46.4 Å²	46.4	1%	0.006	26%	0.263	C	S	.	.			trans	-79.1	117.4	179.1	180	0	0	0	0	109.8	L840 C841 D848 L849 R871 I895 N896	L840-V844 HydrophobicContact CD2-CG1 4.42Å; C841-V844 HydrophobicContact CB-CG2 3.92Å; C841-V844 WeakPolarHBondContact O-CB 3.5Å; C841-V844 WeakPolarHBondContact O-CG2 3.28Å; C841-V844 PolarHBondContact O-N 3.43Å; V844-D848 HydrophobicContact CG1-CB 4.09Å; V844-L849 HydrophobicContact CG1-CD1 4.49Å; V844-L849 HydrophobicContact CG1-CD2 3.83Å; V844-L849 HydrophobicContact CG1-CG 3.76Å; V844-R871 PolarHBondContact O-NH1 3.06Å; V844-I895 HydrophobicContact CG1-CG2 4.13Å; V844-I895 HydrophobicContact CG2-CG2 3.77Å; V844-N896 HydrophobicContact CG2-CB 3.93Å
845	S	86.1	Confident	86.5	Confident	48 Å²	48	50.3 Å²	50.3	34%	0.336	28%	0.278	S	S	.	.			trans	-88.4	171.2	173.8	72.5	0	0	0	0	112.6	S843 A847 D848 L849	S843-S845 PolarHBondContact O-N 3.45Å; S845-A847 VanDerWaalsContact C-N 3.26Å; S845-A847 PolarHBondContact O-N 3.36Å; S845-A847 PolarHBondContact OG-N 3.31Å; S845-D848 VanDerWaalsContact CB-OD2 3.31Å; S845-D848 WeakPolarHBondContact CB-OD2 3.43Å; S845-D848 PolarHBondContact N-OD2 3.09Å; S845-D848 PolarHBondContact O-N 3.39Å; S845-D848 PolarHBondContact OG-N 2.89Å; S845-D848 PolarHBondContact OG-OD2 3.14Å; S845-L849 PolarHBondContact O-N 3.45Å
846	E	88.8	Confident	86.3	Confident	82 Å²	82	50.5 Å²	50.5	38%	0.383	28%	0.279	S	S	.	.	H	α-helix	trans	-59.8	-39.1	170.6	-164	-142.7	123.4	0	0	111.3	D848 L849 R850 I861 I863	E846-D848 VanDerWaalsContact C-N 3.35Å; E846-D848 PolarHBondContact O-N 3.47Å; E846-L849 PolarHBondContact O-N 2.92Å; E846-R850 VanDerWaalsContact O-CB 3.27Å; E846-R850 WeakPolarHBondContact O-CB 3.42Å; E846-R850 PolarHBondContact O-N 3.47Å; E846-R850 IonicContact OE1-CZ 3.07Å; E846-R850 IonicContact OE1-NH1 3.01Å; E846-R850 PolarHBondContact OE1-NH1 3.08Å; E846-I861 HydrophobicContact CG-CB 3.75Å; E846-I861 HydrophobicContact CG-CD1 4.38Å; E846-I861 HydrophobicContact CG-CG2 3.82Å; E846-I863 HydrophobicContact CB-CD1 4.31Å
847	A	85.2	Confident	85.9	Confident	65 Å²	65	53.8 Å²	53.8	54%	0.537	29%	0.294	S	S	.	.	H	α-helix	trans	-64.5	-37.4	179.7	0	0	0	0	0	112.5	S845 R850 S851	S845-A847 VanDerWaalsContact C-N 3.26Å; S845-A847 PolarHBondContact O-N 3.36Å; S845-A847 PolarHBondContact OG-N 3.31Å; A847-R850 PolarHBondContact O-N 2.96Å; A847-S851 PolarHBondContact O-N 3.1Å; A847-S851 PolarHBondContact O-OG 3.46Å
848	D	87.8	Confident	85.7	Confident	50 Å²	50	54.8 Å²	54.8	27%	0.267	30%	0.3	S	S	.	.	H	α-helix	trans	-63.4	-49.7	175.8	-57.6	-51	0	0	0	110.2	V844 S845 E846 R850 S851 H852	V844-D848 HydrophobicContact CG1-CB 4.09Å; S845-D848 VanDerWaalsContact CB-OD2 3.31Å; S845-D848 WeakPolarHBondContact CB-OD2 3.43Å; S845-D848 PolarHBondContact N-OD2 3.09Å; S845-D848 PolarHBondContact O-N 3.39Å; S845-D848 PolarHBondContact OG-N 2.89Å; S845-D848 PolarHBondContact OG-OD2 3.14Å; E846-D848 VanDerWaalsContact C-N 3.35Å; E846-D848 PolarHBondContact O-N 3.47Å; D848-R850 VanDerWaalsContact C-N 3.29Å; D848-R850 PolarHBondContact O-N 3.17Å; D848-S851 PolarHBondContact O-N 3.29Å; D848-S851 PolarHBondContact O-OG 2.93Å; D848-H852 PolarHBondContact O-CD2 2.96Å; D848-H852 PolarHBondContact O-N 3.32Å
849	L	88	Confident	85.4	Confident	0 Å²	0	56.4 Å²	56.4	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-58.8	-41.1	173.2	-65.5	177.7	0	0	0	111.7	V837 L840 V844 S845 E846 S851 H852 F853 I861 I863 A873 I895	V837-L849 HydrophobicContact CG1-CD2 4.5Å; L840-L849 HydrophobicContact CD1-CD1 3.96Å; L840-L849 HydrophobicContact CD1-CD2 4.2Å; L840-L849 HydrophobicContact CD2-CD2 3.9Å; V844-L849 HydrophobicContact CG1-CD1 4.49Å; V844-L849 HydrophobicContact CG1-CD2 3.83Å; V844-L849 HydrophobicContact CG1-CG 3.76Å; S845-L849 PolarHBondContact O-N 3.45Å; E846-L849 PolarHBondContact O-N 2.92Å; L849-S851 VanDerWaalsContact C-N 3.32Å; L849-S851 PolarHBondContact O-N 2.86Å; L849-H852 PolarHBondContact O-N 3.43Å; L849-F853 HydrophobicContact CD2-CE2 4.37Å; L849-F853 WeakPolarHBondContact O-CB 3.26Å; L849-F853 WeakPolarHBondContact O-CD2 3.48Å; L849-F853 PolarHBondContact O-N 3.09Å; L849-I861 HydrophobicContact CB-CD1 4.04Å; L849-I861 HydrophobicContact CB-CG2 4.24Å; L849-I861 HydrophobicContact CD1-CG2 3.77Å; L849-I863 HydrophobicContact CD1-CD1 3.86Å; L849-I863 HydrophobicContact CD1-CG1 3.97Å; L849-A873 HydrophobicContact CD1-CB 3.54Å; L849-I895 HydrophobicContact CD2-CD1 4.22Å
850	R	89.4	Confident	85.5	Confident	117 Å²	117	59.4 Å²	59.4	44%	0.442	32%	0.319	S	S	.	.	H	α-helix	trans	-65.6	-33.9	-178.9	-156	168.5	-162.8	127.9	8.1	112.6	E846 A847 D848 Q854 I861	E846-R850 VanDerWaalsContact O-CB 3.27Å; E846-R850 WeakPolarHBondContact O-CB 3.42Å; E846-R850 PolarHBondContact O-N 3.47Å; E846-R850 IonicContact OE1-CZ 3.07Å; E846-R850 IonicContact OE1-NH1 3.01Å; E846-R850 PolarHBondContact OE1-NH1 3.08Å; A847-R850 PolarHBondContact O-N 2.96Å; D848-R850 VanDerWaalsContact C-N 3.29Å; D848-R850 PolarHBondContact O-N 3.17Å; R850-Q854 WeakPolarHBondContact O-CA 3.4Å; R850-Q854 WeakPolarHBondContact O-CB 3.5Å; R850-Q854 PolarHBondContact O-N 3.4Å; R850-I861 HydrophobicContact CB-CD1 3.75Å; R850-I861 HydrophobicContact CG-CD1 4.04Å
851	S	86.4	Confident	85.6	Confident	66 Å²	66	60 Å²	60	46%	0.462	32%	0.322	S	S	.	.	H	α-helix	trans	-73.4	-49.2	172.6	70.7	0	0	0	0	112	A847 D848 L849 F853 Q854	A847-S851 PolarHBondContact O-N 3.1Å; A847-S851 PolarHBondContact O-OG 3.46Å; D848-S851 PolarHBondContact O-N 3.29Å; D848-S851 PolarHBondContact O-OG 2.93Å; L849-S851 VanDerWaalsContact C-N 3.32Å; L849-S851 PolarHBondContact O-N 2.86Å; S851-F853 VanDerWaalsContact C-N 3.28Å; S851-F853 PolarHBondContact O-N 3.49Å; S851-Q854 VanDerWaalsContact O-CB 3.27Å; S851-Q854 WeakPolarHBondContact O-CB 3.37Å; S851-Q854 PolarHBondContact O-N 3.28Å; S851-Q854 VanDerWaalsContact O-N 3.13Å
852	H	85.2	Confident	85.8	Confident	73 Å²	73	60.5 Å²	60.5	34%	0.338	33%	0.326	S	S	.	.	H	α-helix	trans	-60.7	-34.1	178.8	-80.8	-65.5	0	0	0	113.3	D848 L849 M890 I895	D848-H852 PolarHBondContact O-CD2 2.96Å; D848-H852 PolarHBondContact O-N 3.32Å; L849-H852 PolarHBondContact O-N 3.43Å; H852-M890 HydrophobicContact CB-CE 3.92Å; H852-I895 HydrophobicContact CB-CD1 4.07Å
853	F	88.1	Confident	86.2	Confident	1 Å²	1	58.6 Å²	58.6	0%	0.004	31%	0.31	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	8.3	177.8	-69	-101.5	0	0	0	113.8	V837 L849 S851 K855 Y856 V858 L875 F877 A886 M890 I895 V902	V837-F853 HydrophobicContact CG1-CZ 4.34Å; V837-F853 HydrophobicContact CG2-CE1 4.42Å; V837-F853 HydrophobicContact CG2-CZ 3.92Å; L849-F853 HydrophobicContact CD2-CE2 4.37Å; L849-F853 WeakPolarHBondContact O-CB 3.26Å; L849-F853 WeakPolarHBondContact O-CD2 3.48Å; L849-F853 PolarHBondContact O-N 3.09Å; S851-F853 VanDerWaalsContact C-N 3.28Å; S851-F853 PolarHBondContact O-N 3.49Å; F853-K855 PolarHBondContact O-N 3.24Å; F853-K855 VanDerWaalsContact O-N 3.13Å; F853-Y856 HydrophobicContact CB-CD2 4.05Å; F853-Y856 AromaticContact CD1-CD2 3.9Å; F853-Y856 HydrophobicContact CD1-CD2 3.9Å; F853-Y856 HydrophobicContact CD1-CE2 4.14Å; F853-Y856 HydrophobicContact CG-CD2 4.34Å; F853-Y856 WeakPolarHBondContact O-CD2 3.49Å; F853-Y856 PolarHBondContact O-N 3.42Å; F853-V858 HydrophobicContact CB-CG2 3.72Å; F853-L875 HydrophobicContact CB-CD2 4.06Å; F853-L875 HydrophobicContact CD1-CD2 3.98Å; F853-L875 HydrophobicContact CD2-CD2 3.85Å; F853-L875 HydrophobicContact CE1-CD2 4.35Å; F853-L875 HydrophobicContact CE2-CD2 4.25Å; F853-L875 HydrophobicContact CG-CD2 3.7Å; F853-L875 HydrophobicContact CZ-CD2 4.49Å; F853-F877 AromaticContact CD1-CZ 3.97Å; F853-F877 HydrophobicContact CD1-CZ 3.97Å; F853-F877 HydrophobicContact CE1-CZ 4.49Å; F853-A886 HydrophobicContact CD1-CB 4.22Å; F853-A886 HydrophobicContact CE1-CB 4.3Å; F853-M890 HydrophobicContact CD1-CG 4.04Å; F853-M890 HydrophobicContact CD2-CE 4.3Å; F853-M890 HydrophobicContact CE1-CB 3.79Å; F853-M890 HydrophobicContact CE1-CG 3.61Å; F853-M890 HydrophobicContact CE2-CE 4.03Å; F853-M890 HydrophobicContact CZ-CB 3.77Å; F853-M890 HydrophobicContact CZ-CE 4.22Å; F853-M890 HydrophobicContact CZ-CG 3.91Å; F853-I895 HydrophobicContact CE2-CD1 4.31Å; F853-V902 HydrophobicContact CE1-CG1 4.43Å; F853-V902 HydrophobicContact CZ-CG2 4.16Å
854	Q	85.7	Confident	86.3	Confident	153 Å²	153	59.7 Å²	59.7	72%	0.715	30%	0.303	S	S	*	.	G	3₁₀ helix	trans	-55.4	-35.6	-178.1	-170.2	176.2	0.1	0	0	112.7	R850 S851 Y856 Q857	R850-Q854 WeakPolarHBondContact O-CA 3.4Å; R850-Q854 WeakPolarHBondContact O-CB 3.5Å; R850-Q854 PolarHBondContact O-N 3.4Å; S851-Q854 VanDerWaalsContact O-CB 3.27Å; S851-Q854 WeakPolarHBondContact O-CB 3.37Å; S851-Q854 PolarHBondContact O-N 3.28Å; S851-Q854 VanDerWaalsContact O-N 3.13Å; Q854-Y856 PolarHBondContact O-N 3.49Å; Q854-Q857 PolarHBondContact O-N 2.92Å
855	K	87.8	Confident	86.2	Confident	138 Å²	138	64.7 Å²	64.7	60%	0.6	33%	0.33	S	S	*	.	G	3₁₀ helix	trans	-52.9	-25	176.9	-169.9	-177.6	-178.4	-165.2	0	113.9	F853 E889	F853-K855 PolarHBondContact O-N 3.24Å; F853-K855 VanDerWaalsContact O-N 3.13Å; K855-E889 IonicContact NZ-OE1 2.58Å; K855-E889 PolarHBondContact NZ-OE1 3.32Å; K855-E889 IonicContact NZ-OE2 2.68Å; K855-E889 PolarHBondContact NZ-OE2 3.18Å
856	Y	85.9	Confident	85.5	Confident	6 Å²	6	64.2 Å²	64.2	2%	0.024	33%	0.327	C	S	.	.	G	3₁₀ helix	trans	-113.7	13.6	-167.2	-43.4	-69.9	0	0	0	114.5	F853 Q854 V858 F877 D882 I885 A886 E889 M890	F853-Y856 HydrophobicContact CB-CD2 4.05Å; F853-Y856 AromaticContact CD1-CD2 3.9Å; F853-Y856 HydrophobicContact CD1-CD2 3.9Å; F853-Y856 HydrophobicContact CD1-CE2 4.14Å; F853-Y856 HydrophobicContact CG-CD2 4.34Å; F853-Y856 WeakPolarHBondContact O-CD2 3.49Å; F853-Y856 PolarHBondContact O-N 3.42Å; Q854-Y856 PolarHBondContact O-N 3.49Å; Y856-V858 PolarHBondContact O-N 3.16Å; Y856-F877 HydrophobicContact CD2-CE1 4.49Å; Y856-F877 HydrophobicContact CG-CE1 4.27Å; Y856-F877 WeakPolarHBondContact O-CD1 3.18Å; Y856-D882 WeakPolarHBondContact O-CB 3.37Å; Y856-I885 HydrophobicContact CD1-CG2 4.34Å; Y856-I885 HydrophobicContact CE1-CB 4.46Å; Y856-I885 HydrophobicContact CE1-CG2 3.83Å; Y856-A886 HydrophobicContact CD1-CB 4.03Å; Y856-A886 HydrophobicContact CD2-CB 3.71Å; Y856-A886 HydrophobicContact CE1-CB 4.29Å; Y856-A886 HydrophobicContact CE2-CB 4Å; Y856-A886 HydrophobicContact CG-CB 3.74Å; Y856-E889 WeakPolarHBondContact OH-CB 3.46Å; Y856-E889 WeakPolarHBondContact OH-CG 3.4Å; Y856-E889 PolarHBondContact OH-OE2 3.14Å; Y856-M890 HydrophobicContact CE2-CG 3.65Å; Y856-M890 HydrophobicContact CE2-SD 3.88Å
857	Q	82.1	Confident	84.1	Confident	116 Å²	116	66.4 Å²	66.4	54%	0.542	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.7	49.8	174.2	-55.7	-173.5	-3.4	0	0	114.1	Q854 S859	Q854-Q857 PolarHBondContact O-N 2.92Å; Q857-S859 PolarHBondContact O-N 3.23Å
858	V	85.1	Confident	82.8	Confident	21 Å²	21	68.5 Å²	68.5	13%	0.127	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	129.2	175.2	178.9	0	0	0	0	111	F853 Y856 E860 I861 L875 T876 F877	F853-V858 HydrophobicContact CB-CG2 3.72Å; Y856-V858 PolarHBondContact O-N 3.16Å; V858-E860 VanDerWaalsContact CG1-O 3.31Å; V858-E860 WeakPolarHBondContact CG1-O 3.44Å; V858-I861 HydrophobicContact CG1-CD1 4.12Å; V858-I861 HydrophobicContact CG1-CG1 3.59Å; V858-L875 HydrophobicContact CG1-CB 4.15Å; V858-L875 HydrophobicContact CG1-CD2 4.25Å; V858-L875 HydrophobicContact CG1-CG 4.44Å; V858-L875 HydrophobicContact CG2-CD2 4.23Å; V858-T876 WeakPolarHBondContact CA-O 3.49Å; V858-F877 HydrophobicContact CG2-CD1 4.08Å; V858-F877 HydrophobicContact CG2-CE1 3.66Å; V858-F877 HydrophobicContact CG2-CE2 4.18Å; V858-F877 HydrophobicContact CG2-CZ 3.7Å
859	S	81.2	Confident	81.8	Confident	34 Å²	34	73.8 Å²	73.8	24%	0.238	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	-41.7	-179.6	-67.7	0	0	0	0	112.7	Q857 T876 T878	Q857-S859 PolarHBondContact O-N 3.23Å; S859-T876 WeakPolarHBondContact CB-OG1 3.46Å; S859-T876 PolarHBondContact N-O 2.95Å; S859-T878 VanDerWaalsContact OG-CG2 3.26Å; S859-T878 WeakPolarHBondContact OG-CG2 3.41Å
860	E	84.5	Confident	81.4	Confident	87 Å²	87	78 Å²	78	41%	0.407	40%	0.403	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	146.1	-171.8	-161.1	178.2	174.1	0	0	110	V858 L875 T876	V858-E860 VanDerWaalsContact CG1-O 3.31Å; V858-E860 WeakPolarHBondContact CG1-O 3.44Å; E860-L875 WeakPolarHBondContact O-CA 3.44Å; E860-T876 HydrophobicContact CB-CG2 4.36Å; E860-T876 WeakPolarHBondContact CB-OG1 3.28Å; E860-T876 PolarHBondContact N-OG1 2.9Å; E860-T876 PolarHBondContact O-N 2.6Å
861	I	88.8	Confident	81.2	Confident	14 Å²	14	74.6 Å²	74.6	7%	0.072	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	117.9	178.7	-56.6	-178	0	0	0	106.8	E846 L849 R850 V858 I863 L875	E846-I861 HydrophobicContact CG-CB 3.75Å; E846-I861 HydrophobicContact CG-CD1 4.38Å; E846-I861 HydrophobicContact CG-CG2 3.82Å; L849-I861 HydrophobicContact CB-CD1 4.04Å; L849-I861 HydrophobicContact CB-CG2 4.24Å; L849-I861 HydrophobicContact CD1-CG2 3.77Å; R850-I861 HydrophobicContact CB-CD1 3.75Å; R850-I861 HydrophobicContact CG-CD1 4.04Å; V858-I861 HydrophobicContact CG1-CD1 4.12Å; V858-I861 HydrophobicContact CG1-CG1 3.59Å; I861-I863 HydrophobicContact CG2-CG1 4.35Å; I861-L875 HydrophobicContact CB-CG 4.49Å; I861-L875 HydrophobicContact CD1-CD2 4.29Å; I861-L875 HydrophobicContact CG1-CD2 4.22Å; I861-L875 HydrophobicContact CG1-CG 4.04Å; I861-L875 HydrophobicContact CG2-CG 4.21Å
862	S	86.7	Confident	81.3	Confident	34 Å²	34	74.6 Å²	74.6	24%	0.238	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	123.6	172	53.4	0	0	0	0	109.8	Y864 A873 S874	S862-Y864 WeakPolarHBondContact CB-OH 3.42Å; S862-Y864 WeakPolarHBondContact O-CE2 3.22Å; S862-Y864 WeakPolarHBondContact OG-CE2 3.5Å; S862-Y864 PolarHBondContact OG-OH 3.16Å; S862-A873 CarbonylContact O-C 3.46Å; S862-A873 WeakPolarHBondContact O-CA 3.32Å; S862-A873 WeakPolarHBondContact O-CB 3.37Å; S862-S874 PolarHBondContact N-O 2.87Å; S862-S874 PolarHBondContact O-N 2.93Å; S862-S874 PolarHBondContact OG-O 3.37Å
863	I	89.1	Confident	81.6	Confident	49 Å²	49	71.1 Å²	71.1	25%	0.251	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	136.7	178.3	-56.8	-177.2	0	0	0	108.9	E846 L849 I861 R871 A873	E846-I863 HydrophobicContact CB-CD1 4.31Å; L849-I863 HydrophobicContact CD1-CD1 3.86Å; L849-I863 HydrophobicContact CD1-CG1 3.97Å; I861-I863 HydrophobicContact CG2-CG1 4.35Å; I863-R871 HydrophobicContact CG2-CG 3.73Å; I863-A873 HydrophobicContact CG1-CB 4.1Å
864	Y	84.9	Confident	81.6	Confident	98 Å²	98	71.9 Å²	71.9	38%	0.384	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	124.4	-178.5	-57.3	-86.6	0	0	0	110.2	S862 Y872	S862-Y864 WeakPolarHBondContact CB-OH 3.42Å; S862-Y864 WeakPolarHBondContact O-CE2 3.22Å; S862-Y864 WeakPolarHBondContact OG-CE2 3.5Å; S862-Y864 PolarHBondContact OG-OH 3.16Å; Y864-Y872 AromaticContact CD2-CD2 3.84Å; Y864-Y872 HydrophobicContact CD2-CD2 3.84Å; Y864-Y872 AromaticContact CD2-CE2 3.39Å; Y864-Y872 HydrophobicContact CD2-CE2 3.39Å; Y864-Y872 AromaticContact CD2-CZ 3.96Å; Y864-Y872 HydrophobicContact CE2-CE2 4.22Å; Y864-Y872 HydrophobicContact CG-CD2 4.34Å; Y864-Y872 HydrophobicContact CG-CE1 4.41Å; Y864-Y872 AromaticContact CG-CE2 3.68Å; Y864-Y872 HydrophobicContact CG-CE2 3.68Å; Y864-Y872 AromaticContact CG-CZ 3.72Å; Y864-Y872 PolarHBondContact N-O 3.41Å; Y864-Y872 PolarHBondContact O-N 3.35Å
865	D	83.3	Confident	81.9	Confident	107 Å²	107	64.6 Å²	64.6	57%	0.572	34%	0.335	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	109.1	176	-73.9	-47.6	0	0	0	110.1	R871	D865-R871 WeakPolarHBondContact OD1-CG 3.44Å; D865-R871 IonicContact OD1-CZ 3.46Å; D865-R871 IonicContact OD1-NE 3.32Å; D865-R871 PolarHBondContact OD1-NE 3.06Å; D865-R871 IonicContact OD1-NH2 3.3Å; D865-R871 PolarHBondContact OD1-NH2 3.38Å; D865-R871 IonicContact OD2-CZ 2.84Å; D865-R871 IonicContact OD2-NE 2.73Å; D865-R871 IonicContact OD2-NH2 3.02Å; D865-R871 PolarHBondContact OD2-NH2 3.5Å
866	S	71.8	Confident	81.9	Confident	38 Å²	38	59.5 Å²	59.5	27%	0.266	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	142	174.3	-43.9	0	0	0	0	109.9	T868 N869 Y870 Y872	S866-T868 PolarHBondContact O-N 3.5Å; S866-N869 PolarHBondContact O-N 2.91Å; S866-Y870 WeakPolarHBondContact CB-O 3.49Å; S866-Y870 PolarHBondContact N-O 2.76Å; S866-Y870 VanDerWaalsContact N-O 3.09Å; S866-Y870 PolarHBondContact OG-O 2.97Å; S866-Y872 WeakPolarHBondContact OG-CE1 3.33Å
867	S	58.3	Low	82	Confident	128 Å²	128	59.3 Å²	59.3	90%	0.895	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.9	-13	178.1	53	0	0	0	0	114.8
868	T	58.2	Low	82.1	Confident	109 Å²	109	57.4 Å²	57.4	67%	0.669	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	35	-177.3	50	0	0	0	0	113.8	S866 Y870	S866-T868 PolarHBondContact O-N 3.5Å; T868-Y870 PolarHBondContact O-N 3.15Å; T868-Y870 VanDerWaalsContact O-N 3.12Å
869	N	67.6	Low	82.1	Confident	160 Å²	160	60.4 Å²	60.4	86%	0.856	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	17.9	-177.1	-65.9	-52.5	0	0	0	115	S866	S866-N869 PolarHBondContact O-N 2.91Å
870	Y	78.8	Confident	82.3	Confident	90 Å²	90	60.7 Å²	60.7	35%	0.353	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	97.3	-175.5	-174.1	-100.1	0	0	0	110.8	G838 S866 T868 Y872	G838-Y870 WeakPolarHBondContact CA-OH 3.32Å; S866-Y870 WeakPolarHBondContact CB-O 3.49Å; S866-Y870 PolarHBondContact N-O 2.76Å; S866-Y870 VanDerWaalsContact N-O 3.09Å; S866-Y870 PolarHBondContact OG-O 2.97Å; T868-Y870 PolarHBondContact O-N 3.15Å; T868-Y870 VanDerWaalsContact O-N 3.12Å; Y870-Y872 AromaticContact CD1-CD1 3.99Å; Y870-Y872 HydrophobicContact CD1-CD1 3.99Å; Y870-Y872 AromaticContact CE1-CD1 4Å; Y870-Y872 HydrophobicContact CE1-CD1 4Å; Y870-Y872 HydrophobicContact CE1-CG 4.31Å
871	R	85.6	Confident	82.3	Confident	45 Å²	45	59.4 Å²	59.4	17%	0.17	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	132.7	169.1	-178.4	175.5	-93	-168.3	-3.6	109.7	G839 L840 P842 V844 I863 D865	G839-R871 PolarHBondContact N-O 2.78Å; L840-R871 HydrophobicContact CB-CB 4.1Å; L840-R871 HydrophobicContact CB-CG 3.88Å; L840-R871 HydrophobicContact CD1-CG 4.26Å; L840-R871 PolarHBondContact N-O 2.61Å; P842-R871 PolarHBondContact O-NH1 3.43Å; P842-R871 VanDerWaalsContact O-NH1 3.15Å; V844-R871 PolarHBondContact O-NH1 3.06Å; I863-R871 HydrophobicContact CG2-CG 3.73Å; D865-R871 WeakPolarHBondContact OD1-CG 3.44Å; D865-R871 IonicContact OD1-CZ 3.46Å; D865-R871 IonicContact OD1-NE 3.32Å; D865-R871 PolarHBondContact OD1-NE 3.06Å; D865-R871 IonicContact OD1-NH2 3.3Å; D865-R871 PolarHBondContact OD1-NH2 3.38Å; D865-R871 IonicContact OD2-CZ 2.84Å; D865-R871 IonicContact OD2-NE 2.73Å; D865-R871 IonicContact OD2-NH2 3.02Å; D865-R871 PolarHBondContact OD2-NH2 3.5Å
872	Y	89.3	Confident	82.3	Confident	65 Å²	65	59.8 Å²	59.8	26%	0.255	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	166.1	169.2	68	-84.9	0	0	0	110.3	H836 V837 Y864 S866 Y870	H836-Y872 AromaticContact CD2-CD2 3.61Å; H836-Y872 AromaticContact NE2-CD2 3.31Å; H836-Y872 VanDerWaalsContact NE2-CD2 3.31Å; H836-Y872 WeakPolarHBondContact NE2-CD2 3.48Å; H836-Y872 AromaticContact NE2-CG 3.55Å; V837-Y872 CarbonylContact O-C 3.48Å; V837-Y872 VanDerWaalsContact O-CA 3.25Å; V837-Y872 WeakPolarHBondContact O-CA 3.21Å; Y864-Y872 AromaticContact CD2-CD2 3.84Å; Y864-Y872 HydrophobicContact CD2-CD2 3.84Å; Y864-Y872 AromaticContact CD2-CE2 3.39Å; Y864-Y872 HydrophobicContact CD2-CE2 3.39Å; Y864-Y872 AromaticContact CD2-CZ 3.96Å; Y864-Y872 HydrophobicContact CE2-CE2 4.22Å; Y864-Y872 HydrophobicContact CG-CD2 4.34Å; Y864-Y872 HydrophobicContact CG-CE1 4.41Å; Y864-Y872 AromaticContact CG-CE2 3.68Å; Y864-Y872 HydrophobicContact CG-CE2 3.68Å; Y864-Y872 AromaticContact CG-CZ 3.72Å; Y864-Y872 PolarHBondContact N-O 3.41Å; Y864-Y872 PolarHBondContact O-N 3.35Å; S866-Y872 WeakPolarHBondContact OG-CE1 3.33Å; Y870-Y872 AromaticContact CD1-CD1 3.99Å; Y870-Y872 HydrophobicContact CD1-CD1 3.99Å; Y870-Y872 AromaticContact CE1-CD1 4Å; Y870-Y872 HydrophobicContact CE1-CD1 4Å; Y870-Y872 HydrophobicContact CE1-CG 4.31Å
873	A	90.2	Very high	82.4	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	152.8	171.8	0	0	0	0	0	110.6	V837 L840 L849 S862 I863 L875	V837-A873 HydrophobicContact CB-CB 4.45Å; V837-A873 PolarHBondContact N-O 2.99Å; V837-A873 PolarHBondContact O-N 3.48Å; L840-A873 HydrophobicContact CD1-CB 3.75Å; L849-A873 HydrophobicContact CD1-CB 3.54Å; S862-A873 CarbonylContact O-C 3.46Å; S862-A873 WeakPolarHBondContact O-CA 3.32Å; S862-A873 WeakPolarHBondContact O-CB 3.37Å; I863-A873 HydrophobicContact CG1-CB 4.1Å; A873-L875 HydrophobicContact CB-CD1 3.84Å
874	S	89.9	Confident	82.3	Confident	18 Å²	18	61.3 Å²	61.3	13%	0.126	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	131.7	167.3	-62.2	0	0	0	0	108.5	I835 S862	I835-S874 WeakPolarHBondContact O-CA 3.07Å; S862-S874 PolarHBondContact N-O 2.87Å; S862-S874 PolarHBondContact O-N 2.93Å; S862-S874 PolarHBondContact OG-O 3.37Å
875	L	90.3	Very high	82.4	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	132.9	-178.1	-68.5	78	0	0	0	109.2	I835 V837 F853 V858 E860 I861 A873 F877	I835-L875 PolarHBondContact N-O 2.78Å; I835-L875 PolarHBondContact O-N 2.76Å; V837-L875 HydrophobicContact CB-CD1 3.87Å; V837-L875 HydrophobicContact CG2-CD1 3.48Å; V837-L875 VanDerWaalsContact CG2-CD1 3.48Å; F853-L875 HydrophobicContact CB-CD2 4.06Å; F853-L875 HydrophobicContact CD1-CD2 3.98Å; F853-L875 HydrophobicContact CD2-CD2 3.85Å; F853-L875 HydrophobicContact CE1-CD2 4.35Å; F853-L875 HydrophobicContact CE2-CD2 4.25Å; F853-L875 HydrophobicContact CG-CD2 3.7Å; F853-L875 HydrophobicContact CZ-CD2 4.49Å; V858-L875 HydrophobicContact CG1-CB 4.15Å; V858-L875 HydrophobicContact CG1-CD2 4.25Å; V858-L875 HydrophobicContact CG1-CG 4.44Å; V858-L875 HydrophobicContact CG2-CD2 4.23Å; E860-L875 WeakPolarHBondContact O-CA 3.44Å; I861-L875 HydrophobicContact CB-CG 4.49Å; I861-L875 HydrophobicContact CD1-CD2 4.29Å; I861-L875 HydrophobicContact CG1-CD2 4.22Å; I861-L875 HydrophobicContact CG1-CG 4.04Å; I861-L875 HydrophobicContact CG2-CG 4.21Å; A873-L875 HydrophobicContact CB-CD1 3.84Å; L875-F877 HydrophobicContact CB-CD2 4.4Å; L875-F877 HydrophobicContact CB-CE2 3.56Å; L875-F877 HydrophobicContact CB-CZ 4.23Å
876	T	89	Confident	82.7	Confident	31 Å²	31	55.5 Å²	55.5	19%	0.19	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	135.8	176.7	68.7	0	0	0	0	111	L834 V858 S859 E860	L834-T876 HydrophobicContact CD1-CG2 3.78Å; V858-T876 WeakPolarHBondContact CA-O 3.49Å; S859-T876 WeakPolarHBondContact CB-OG1 3.46Å; S859-T876 PolarHBondContact N-O 2.95Å; E860-T876 HydrophobicContact CB-CG2 4.36Å; E860-T876 WeakPolarHBondContact CB-OG1 3.28Å; E860-T876 PolarHBondContact N-OG1 2.9Å; E860-T876 PolarHBondContact O-N 2.6Å
877	F	86.7	Confident	83.5	Confident	1 Å²	1	55.2 Å²	55.2	0%	0.004	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	140.5	-175	-65	-116	0	0	0	109.9	G832 Y833 I835 F853 Y856 V858 L875 K879 D882 A883 A886	G832-F877 WeakPolarHBondContact CA-O 3.38Å; Y833-F877 PolarHBondContact N-O 2.91Å; Y833-F877 WeakPolarHBondContact O-CD2 3.42Å; Y833-F877 PolarHBondContact O-N 3.49Å; I835-F877 HydrophobicContact CB-CE2 3.87Å; I835-F877 HydrophobicContact CD1-CD2 4.04Å; I835-F877 HydrophobicContact CD1-CE1 4.32Å; I835-F877 HydrophobicContact CD1-CE2 3.6Å; I835-F877 HydrophobicContact CD1-CZ 3.76Å; I835-F877 HydrophobicContact CG1-CD2 4.29Å; I835-F877 HydrophobicContact CG1-CE2 3.96Å; F853-F877 AromaticContact CD1-CZ 3.97Å; F853-F877 HydrophobicContact CD1-CZ 3.97Å; F853-F877 HydrophobicContact CE1-CZ 4.49Å; Y856-F877 HydrophobicContact CD2-CE1 4.49Å; Y856-F877 HydrophobicContact CG-CE1 4.27Å; Y856-F877 WeakPolarHBondContact O-CD1 3.18Å; V858-F877 HydrophobicContact CG2-CD1 4.08Å; V858-F877 HydrophobicContact CG2-CE1 3.66Å; V858-F877 HydrophobicContact CG2-CE2 4.18Å; V858-F877 HydrophobicContact CG2-CZ 3.7Å; L875-F877 HydrophobicContact CB-CD2 4.4Å; L875-F877 HydrophobicContact CB-CE2 3.56Å; L875-F877 HydrophobicContact CB-CZ 4.23Å; F877-K879 VanDerWaalsContact C-N 3.28Å; F877-K879 PolarHBondContact O-N 2.97Å; F877-D882 HydrophobicContact CD1-CB 4.48Å; F877-A883 HydrophobicContact CB-CB 4.02Å; F877-A883 HydrophobicContact CD1-CB 4.26Å; F877-A883 HydrophobicContact CD2-CB 4.39Å; F877-A883 HydrophobicContact CG-CB 3.99Å; F877-A886 HydrophobicContact CE1-CB 3.57Å; F877-A886 HydrophobicContact CZ-CB 3.86Å
878	T	85.9	Confident	84.9	Confident	77 Å²	77	58 Å²	58	47%	0.472	29%	0.294	S	S	.	.	S	Bend	trans	-66.1	-27.4	176.5	52.7	0	0	0	0	113.3	S859	S859-T878 VanDerWaalsContact OG-CG2 3.26Å; S859-T878 WeakPolarHBondContact OG-CG2 3.41Å
879	K	85	Confident	86.3	Confident	83 Å²	83	56.9 Å²	56.9	36%	0.361	28%	0.28	S	S	.	.			trans	-131.8	146.2	-175.3	-43.9	-168	-152.6	80.1	0	113.6	Y833 F877 S881 D882 A883	Y833-K879 VanDerWaalsContact CD2-C 3.43Å; F877-K879 VanDerWaalsContact C-N 3.28Å; F877-K879 PolarHBondContact O-N 2.97Å; K879-S881 VanDerWaalsContact C-N 3.33Å; K879-S881 WeakPolarHBondContact CB-OG 3.46Å; K879-S881 PolarHBondContact O-N 3.3Å; K879-D882 HydrophobicContact CB-CB 4.34Å; K879-D882 IonicContact NZ-OD1 3.77Å; K879-D882 IonicContact NZ-OD2 2.65Å; K879-D882 PolarHBondContact NZ-OD2 2.95Å; K879-D882 PolarHBondContact O-N 3.22Å; K879-A883 PolarHBondContact O-N 3.38Å
880	N	85.6	Confident	87.2	Confident	41 Å²	41	49.7 Å²	49.7	22%	0.219	24%	0.242	C	C	.	.	H	α-helix	trans	-63.4	-38.2	175.4	-155.2	-17.3	0	0	0	112	Y833 K884 E910	Y833-N880 HydrophobicContact CD1-CB 4Å; Y833-N880 HydrophobicContact CD2-CB 4.07Å; Y833-N880 VanDerWaalsContact CD2-N 3.25Å; Y833-N880 HydrophobicContact CE1-CB 3.62Å; Y833-N880 VanDerWaalsContact CE1-ND2 3.32Å; Y833-N880 WeakPolarHBondContact CE1-ND2 3.34Å; Y833-N880 HydrophobicContact CE2-CB 3.68Å; Y833-N880 HydrophobicContact CG-CB 4.21Å; Y833-N880 VanDerWaalsContact CZ-CB 3.45Å; N880-K884 PolarHBondContact ND2-NZ 2.98Å; N880-K884 VanDerWaalsContact O-CB 3.32Å; N880-K884 WeakPolarHBondContact O-CB 3.35Å; N880-K884 WeakPolarHBondContact O-CG 3.35Å; N880-K884 PolarHBondContact O-N 3.28Å; N880-K884 WeakPolarHBondContact OD1-CD 3.39Å; N880-K884 WeakPolarHBondContact OD1-CE 3.2Å; N880-K884 PolarHBondContact OD1-NZ 2.98Å; N880-E910 PolarHBondContact ND2-OE1 2.92Å
881	S	83.3	Confident	87.7	Confident	59 Å²	59	49.4 Å²	49.4	41%	0.413	25%	0.247	S	C	.	.	H	α-helix	trans	-56.3	-52.6	174.5	44.8	0	0	0	0	111.4	K879 A883 K884 I885	K879-S881 VanDerWaalsContact C-N 3.33Å; K879-S881 WeakPolarHBondContact CB-OG 3.46Å; K879-S881 PolarHBondContact O-N 3.3Å; S881-A883 VanDerWaalsContact C-N 3.34Å; S881-A883 PolarHBondContact O-N 2.74Å; S881-K884 PolarHBondContact O-N 2.71Å; S881-I885 VanDerWaalsContact O-CG1 3.24Å; S881-I885 WeakPolarHBondContact O-CG1 3.47Å; S881-I885 PolarHBondContact O-N 3.47Å
882	D	88.6	Confident	87.6	Confident	23 Å²	23	49.7 Å²	49.7	12%	0.123	26%	0.263	C	S	.	.	H	α-helix	trans	-72	-37.2	-168.2	-51.4	3.6	0	0	0	109.3	Y856 F877 K879 A886	Y856-D882 WeakPolarHBondContact O-CB 3.37Å; F877-D882 HydrophobicContact CD1-CB 4.48Å; K879-D882 HydrophobicContact CB-CB 4.34Å; K879-D882 IonicContact NZ-OD1 3.77Å; K879-D882 IonicContact NZ-OD2 2.65Å; K879-D882 PolarHBondContact NZ-OD2 2.95Å; K879-D882 PolarHBondContact O-N 3.22Å; D882-A886 VanDerWaalsContact O-CB 3.28Å; D882-A886 WeakPolarHBondContact O-CB 3.25Å; D882-A886 PolarHBondContact O-N 3.4Å
883	A	88.9	Confident	87.4	Confident	6 Å²	6	49.8 Å²	49.8	5%	0.05	27%	0.267	C	S	.	.	H	α-helix	trans	-60.1	-52.5	167.1	0	0	0	0	0	112.9	Y833 I835 F877 K879 S881 I885 A886 V887	Y833-A883 HydrophobicContact CG-CB 4.49Å; I835-A883 HydrophobicContact CD1-CB 3.71Å; I835-A883 VanDerWaalsContact CD1-O 3.23Å; I835-A883 WeakPolarHBondContact CD1-O 3.41Å; I835-A883 HydrophobicContact CG1-CB 4.37Å; F877-A883 HydrophobicContact CB-CB 4.02Å; F877-A883 HydrophobicContact CD1-CB 4.26Å; F877-A883 HydrophobicContact CD2-CB 4.39Å; F877-A883 HydrophobicContact CG-CB 3.99Å; K879-A883 PolarHBondContact O-N 3.38Å; S881-A883 VanDerWaalsContact C-N 3.34Å; S881-A883 PolarHBondContact O-N 2.74Å; A883-I885 VanDerWaalsContact C-N 3.28Å; A883-I885 PolarHBondContact O-N 3.35Å; A883-A886 PolarHBondContact O-N 3.37Å; A883-A886 VanDerWaalsContact O-N 3.14Å; A883-V887 PolarHBondContact O-N 3.47Å
884	K	87	Confident	87.2	Confident	108 Å²	108	56.1 Å²	56.1	47%	0.47	30%	0.297	S	S	.	.	H	α-helix	trans	-64.5	-30.8	-178.2	-77.7	171.3	173.4	155	0	112.5	N880 S881 K888 E910	N880-K884 PolarHBondContact ND2-NZ 2.98Å; N880-K884 VanDerWaalsContact O-CB 3.32Å; N880-K884 WeakPolarHBondContact O-CB 3.35Å; N880-K884 WeakPolarHBondContact O-CG 3.35Å; N880-K884 PolarHBondContact O-N 3.28Å; N880-K884 WeakPolarHBondContact OD1-CD 3.39Å; N880-K884 WeakPolarHBondContact OD1-CE 3.2Å; N880-K884 PolarHBondContact OD1-NZ 2.98Å; S881-K884 PolarHBondContact O-N 2.71Å; K884-K888 PolarHBondContact O-N 2.64Å; K884-E910 VanDerWaalsContact NZ-CD 3.33Å; K884-E910 IonicContact NZ-OE1 2.63Å; K884-E910 PolarHBondContact NZ-OE1 2.89Å; K884-E910 IonicContact NZ-OE2 2.7Å; K884-E910 PolarHBondContact NZ-OE2 2.88Å
885	I	87.3	Confident	86.9	Confident	83 Å²	83	55.3 Å²	55.3	43%	0.426	29%	0.291	S	S	.	.	H	α-helix	trans	-72	-46.1	170.9	-61.3	161.8	0	0	0	110.4	Y856 S881 A883 V887 K888 E889	Y856-I885 HydrophobicContact CD1-CG2 4.34Å; Y856-I885 HydrophobicContact CE1-CB 4.46Å; Y856-I885 HydrophobicContact CE1-CG2 3.83Å; S881-I885 VanDerWaalsContact O-CG1 3.24Å; S881-I885 WeakPolarHBondContact O-CG1 3.47Å; S881-I885 PolarHBondContact O-N 3.47Å; A883-I885 VanDerWaalsContact C-N 3.28Å; A883-I885 PolarHBondContact O-N 3.35Å; I885-V887 VanDerWaalsContact C-N 3.32Å; I885-V887 PolarHBondContact O-N 2.98Å; I885-K888 PolarHBondContact O-N 3.02Å; I885-E889 WeakPolarHBondContact O-CB 3.38Å; I885-E889 PolarHBondContact O-N 2.94Å
886	A	89.6	Confident	86.3	Confident	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-58.1	-40.4	178.1	0	0	0	0	0	112.9	I835 F853 Y856 F877 D882 A883 M890	I835-A886 HydrophobicContact CD1-CB 4.2Å; F853-A886 HydrophobicContact CD1-CB 4.22Å; F853-A886 HydrophobicContact CE1-CB 4.3Å; Y856-A886 HydrophobicContact CD1-CB 4.03Å; Y856-A886 HydrophobicContact CD2-CB 3.71Å; Y856-A886 HydrophobicContact CE1-CB 4.29Å; Y856-A886 HydrophobicContact CE2-CB 4Å; Y856-A886 HydrophobicContact CG-CB 3.74Å; F877-A886 HydrophobicContact CE1-CB 3.57Å; F877-A886 HydrophobicContact CZ-CB 3.86Å; D882-A886 VanDerWaalsContact O-CB 3.28Å; D882-A886 WeakPolarHBondContact O-CB 3.25Å; D882-A886 PolarHBondContact O-N 3.4Å; A883-A886 PolarHBondContact O-N 3.37Å; A883-A886 VanDerWaalsContact O-N 3.14Å; A886-M890 WeakPolarHBondContact O-CB 3.27Å; A886-M890 WeakPolarHBondContact O-CG 3.31Å; A886-M890 PolarHBondContact O-N 3.25Å
887	V	88.5	Confident	85.8	Confident	32 Å²	32	60.4 Å²	60.4	19%	0.194	33%	0.332	C	S	.	.	H	α-helix	trans	-59.2	-46.1	171.3	172.4	0	0	0	0	111.4	I835 A883 I885 N891 V902 P904	I835-V887 HydrophobicContact CD1-CG2 3.61Å; I835-V887 HydrophobicContact CG1-CG2 4.04Å; I835-V887 HydrophobicContact CG2-CG2 4.41Å; A883-V887 PolarHBondContact O-N 3.47Å; I885-V887 VanDerWaalsContact C-N 3.32Å; I885-V887 PolarHBondContact O-N 2.98Å; V887-N891 WeakPolarHBondContact O-CB 3.41Å; V887-N891 PolarHBondContact O-N 3.45Å; V887-V902 HydrophobicContact CG2-CG1 4.4Å; V887-P904 HydrophobicContact CG2-CB 4.2Å; V887-P904 HydrophobicContact CG2-CG 4.4Å
888	K	86.9	Confident	85.6	Confident	188 Å²	188	64.4 Å²	64.4	82%	0.817	35%	0.35	S	S	*	.	H	α-helix	trans	-70.5	-35.8	-175.4	-174.1	-178.3	176	-172.9	0	112.8	K884 I885	K884-K888 PolarHBondContact O-N 2.64Å; I885-K888 PolarHBondContact O-N 3.02Å
889	E	87.6	Confident	85.6	Confident	84 Å²	84	64.3 Å²	64.3	39%	0.393	35%	0.352	S	S	.	.	H	α-helix	trans	-92.9	-40.4	-172.6	-169.5	171.2	169.4	0	0	112.6	K855 Y856 I885 I893	K855-E889 IonicContact NZ-OE1 2.58Å; K855-E889 PolarHBondContact NZ-OE1 3.32Å; K855-E889 IonicContact NZ-OE2 2.68Å; K855-E889 PolarHBondContact NZ-OE2 3.18Å; Y856-E889 WeakPolarHBondContact OH-CB 3.46Å; Y856-E889 WeakPolarHBondContact OH-CG 3.4Å; Y856-E889 PolarHBondContact OH-OE2 3.14Å; I885-E889 WeakPolarHBondContact O-CB 3.38Å; I885-E889 PolarHBondContact O-N 2.94Å; E889-I893 WeakPolarHBondContact O-CD1 3.48Å; E889-I893 WeakPolarHBondContact O-CG1 3.36Å
890	M	86.9	Confident	85.8	Confident	10 Å²	10	60.5 Å²	60.5	5%	0.049	34%	0.336	C	S	.	.	H	α-helix	trans	-89.4	-15.2	-174.5	-55.9	-61.9	-63.1	0	0	114.1	H852 F853 Y856 A886 G892 I893 V902	H852-M890 HydrophobicContact CB-CE 3.92Å; F853-M890 HydrophobicContact CD1-CG 4.04Å; F853-M890 HydrophobicContact CD2-CE 4.3Å; F853-M890 HydrophobicContact CE1-CB 3.79Å; F853-M890 HydrophobicContact CE1-CG 3.61Å; F853-M890 HydrophobicContact CE2-CE 4.03Å; F853-M890 HydrophobicContact CZ-CB 3.77Å; F853-M890 HydrophobicContact CZ-CE 4.22Å; F853-M890 HydrophobicContact CZ-CG 3.91Å; Y856-M890 HydrophobicContact CE2-CG 3.65Å; Y856-M890 HydrophobicContact CE2-SD 3.88Å; A886-M890 WeakPolarHBondContact O-CB 3.27Å; A886-M890 WeakPolarHBondContact O-CG 3.31Å; A886-M890 PolarHBondContact O-N 3.25Å; M890-G892 PolarHBondContact O-N 3.01Å; M890-I893 HydrophobicContact CE-CG2 4.49Å; M890-I893 PolarHBondContact O-N 2.97Å; M890-I893 HydrophobicContact SD-CD1 4.02Å; M890-V902 HydrophobicContact CB-CG2 3.93Å
891	N	89.3	Confident	85.8	Confident	84 Å²	84	61.1 Å²	61.1	45%	0.449	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.6	113.8	178.7	-176.5	53.6	0	0	0	111.4	V887 V902	V887-N891 WeakPolarHBondContact O-CB 3.41Å; V887-N891 PolarHBondContact O-N 3.45Å; N891-V902 HydrophobicContact CB-CB 3.94Å; N891-V902 PolarHBondContact OD1-N 2.82Å; N891-V902 PolarHBondContact OD1-O 3.49Å
892	G	82.9	Confident	86.1	Confident	50 Å²	50	58.4 Å²	58.4	52%	0.515	32%	0.32	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.2	-7.6	-176.2	0	0	0	0	0	114.4	M890 V900	M890-G892 PolarHBondContact O-N 3.01Å; G892-V900 PolarHBondContact N-O 3.3Å
893	I	85.6	Confident	86	Confident	67 Å²	67	64.3 Å²	64.3	34%	0.344	34%	0.341	S	S	.	.			trans	-68.4	141.9	174.1	-70.2	-169.8	0	0	0	110.2	E889 M890 V900	E889-I893 WeakPolarHBondContact O-CD1 3.48Å; E889-I893 WeakPolarHBondContact O-CG1 3.36Å; M890-I893 HydrophobicContact CE-CG2 4.49Å; M890-I893 PolarHBondContact O-N 2.97Å; M890-I893 HydrophobicContact SD-CD1 4.02Å; I893-V900 PolarHBondContact O-N 3.05Å
894	E	85.7	Confident	85.7	Confident	133 Å²	133	68.3 Å²	68.3	62%	0.621	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-82.2	125.8	174.1	-63.5	-171.7	177	0	0	111.7	K898	E894-K898 CarbonylContact C-O 3.58Å; E894-K898 VanDerWaalsContact CA-O 3.29Å; E894-K898 WeakPolarHBondContact CA-O 3.04Å
895	I	83.8	Confident	85.4	Confident	2 Å²	2	66 Å²	66	1%	0.01	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	124.4	169.6	-59.2	-177	0	0	0	107.3	V844 L849 H852 F853 G897 K898 V900	V844-I895 HydrophobicContact CG1-CG2 4.13Å; V844-I895 HydrophobicContact CG2-CG2 3.77Å; L849-I895 HydrophobicContact CD2-CD1 4.22Å; H852-I895 HydrophobicContact CB-CD1 4.07Å; F853-I895 HydrophobicContact CE2-CD1 4.31Å; I895-G897 PolarHBondContact O-N 2.94Å; I895-K898 PolarHBondContact N-O 3.38Å; I895-K898 PolarHBondContact O-N 2.99Å; I895-K898 VanDerWaalsContact O-N 3.15Å; I895-V900 HydrophobicContact CB-CG2 3.79Å; I895-V900 HydrophobicContact CD1-CG2 4.04Å; I895-V900 HydrophobicContact CG1-CG2 3.81Å
896	N	78.5	Confident	83.9	Confident	75 Å²	75	71.3 Å²	71.3	40%	0.401	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	46.8	43.2	-175.5	-65.3	-3.4	0	0	0	113.8	C841 S843 V844	C841-N896 HydrophobicContact CB-CB 4.25Å; S843-N896 PolarHBondContact O-ND2 3.42Å; V844-N896 HydrophobicContact CG2-CB 3.93Å
897	G	78.4	Confident	81.9	Confident	63 Å²	63	75 Å²	75	65%	0.649	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.4	18.7	176.2	0	0	0	0	0	115.6	I895	I895-G897 PolarHBondContact O-N 2.94Å
898	K	82.9	Confident	79.5	Confident	84 Å²	84	81.8 Å²	81.8	37%	0.365	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	134	168.7	-66.2	-166.1	-176.1	-178.2	0	111	C841 E894 I895 V900	C841-K898 HydrophobicContact CB-CD 3.94Å; C841-K898 HydrophobicContact CB-CG 4.12Å; E894-K898 CarbonylContact C-O 3.58Å; E894-K898 VanDerWaalsContact CA-O 3.29Å; E894-K898 WeakPolarHBondContact CA-O 3.04Å; I895-K898 PolarHBondContact N-O 3.38Å; I895-K898 PolarHBondContact O-N 2.99Å; I895-K898 VanDerWaalsContact O-N 3.15Å; K898-V900 WeakPolarHBondContact O-CG2 3.21Å
899	S	85.3	Confident	77.1	Confident	76 Å²	76	75.7 Å²	75.7	53%	0.531	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	129.9	174.4	50.4	0	0	0	0	111.5
900	V	89.2	Confident	74.4	Confident	3 Å²	3	76.9 Å²	76.9	2%	0.018	43%	0.43	C	S	.	.			trans	-104	134	-168.8	-177.1	0	0	0	0	111.2	V837 L840 G892 I893 I895 K898 V902	V837-V900 HydrophobicContact CG1-CG1 3.29Å; L840-V900 HydrophobicContact CD2-CG1 3.86Å; L840-V900 HydrophobicContact CD2-CG2 3.92Å; G892-V900 PolarHBondContact N-O 3.3Å; I893-V900 PolarHBondContact O-N 3.05Å; I895-V900 HydrophobicContact CB-CG2 3.79Å; I895-V900 HydrophobicContact CD1-CG2 4.04Å; I895-V900 HydrophobicContact CG1-CG2 3.81Å; K898-V900 WeakPolarHBondContact O-CG2 3.21Å; V900-V902 HydrophobicContact CG1-CG2 4.03Å
901	N	86.3	Confident	71.4	Confident	53 Å²	53	86.9 Å²	86.9	28%	0.283	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	101.2	-174	179.9	2.5	0	0	0	109.8	G838 R903	G838-N901 PolarHBondContact N-O 3Å; G838-N901 PolarHBondContact O-N 2.89Å; N901-R903 PolarHBondContact ND2-NH2 3.43Å; N901-R903 VanDerWaalsContact ND2-NH2 3.18Å; N901-R903 PolarHBondContact OD1-NE 2.98Å; N901-R903 PolarHBondContact OD1-NH2 3.38Å
902	V	89.3	Confident	68.5	Low	3 Å²	3	88.3 Å²	88.3	2%	0.018	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	119.1	-170.3	-176.4	0	0	0	0	109.5	I835 V837 F853 V887 M890 N891 V900	I835-V902 HydrophobicContact CG2-CG1 3.44Å; I835-V902 VanDerWaalsContact CG2-CG1 3.44Å; V837-V902 HydrophobicContact CG1-CG2 4.41Å; V837-V902 HydrophobicContact CG2-CG1 4.15Å; V837-V902 HydrophobicContact CG2-CG2 4.2Å; F853-V902 HydrophobicContact CE1-CG1 4.43Å; F853-V902 HydrophobicContact CZ-CG2 4.16Å; V887-V902 HydrophobicContact CG2-CG1 4.4Å; M890-V902 HydrophobicContact CB-CG2 3.93Å; N891-V902 HydrophobicContact CB-CB 3.94Å; N891-V902 PolarHBondContact OD1-N 2.82Å; N891-V902 PolarHBondContact OD1-O 3.49Å; V900-V902 HydrophobicContact CG1-CG2 4.03Å
903	R	86.4	Confident	65.8	Low	147 Å²	147	91.1 Å²	91.1	56%	0.555	49%	0.492	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-133.1	137.4	-173.3	-61.3	-175.4	-179.1	-170.8	-4.6	111.5	I835 H836 N901 V905	I835-R903 WeakPolarHBondContact CA-O 3.28Å; I835-R903 WeakPolarHBondContact CG2-O 3.31Å; H836-R903 PolarHBondContact N-O 3.2Å; H836-R903 PolarHBondContact O-N 3.38Å; N901-R903 PolarHBondContact ND2-NH2 3.43Å; N901-R903 VanDerWaalsContact ND2-NH2 3.18Å; N901-R903 PolarHBondContact OD1-NE 2.98Å; N901-R903 PolarHBondContact OD1-NH2 3.38Å; R903-V905 PolarHBondContact O-N 3.28Å
904	P	82.8	Confident	63.1	Low	90 Å²	90	94 Å²	94	58%	0.584	52%	0.516	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.3	133.2	170.3	30.2	-31.3	0	0	0	109	V887	V887-P904 HydrophobicContact CG2-CB 4.2Å; V887-P904 HydrophobicContact CG2-CG 4.4Å
905	V	79.4	Confident	60.4	Low	59 Å²	59	95.9 Å²	95.9	36%	0.358	53%	0.529	S	S	.	.			trans	-75.9	132.8	167.2	-176	0	0	0	0	107.4	L834 H836 R903 I907	L834-V905 HydrophobicContact CB-CB 4.18Å; L834-V905 HydrophobicContact CB-CG2 4.36Å; L834-V905 HydrophobicContact CD2-CB 4.03Å; L834-V905 HydrophobicContact CD2-CG1 4.1Å; L834-V905 HydrophobicContact CD2-CG2 3.9Å; L834-V905 HydrophobicContact CG-CB 4.14Å; L834-V905 HydrophobicContact CG-CG2 3.85Å; L834-V905 WeakPolarHBondContact O-CB 3.44Å; L834-V905 PolarHBondContact O-N 3.13Å; H836-V905 HydrophobicContact CB-CG2 3.97Å; R903-V905 PolarHBondContact O-N 3.28Å; V905-I907 VanDerWaalsContact C-N 3.32Å; V905-I907 PolarHBondContact O-N 3.06Å
906	K	57.1	Low	57.6	Low	195 Å²	195	100.9 Å²	100.9	85%	0.848	56%	0.564	S	S	*	*			trans	-73.1	86	-178.6	-171.7	-179.1	178.8	-179.2	0	110.4	L908	K906-L908 PolarHBondContact O-N 3.13Å
907	I	47.7	Very low	55.2	Low	78 Å²	78	103 Å²	103	40%	0.4	59%	0.585	S	S	.	*			trans	-60.1	124.3	169.3	-59.9	175.8	0	0	0	108.1	Y833 V905 G909	Y833-I907 HydrophobicContact CD1-CD1 4.27Å; V905-I907 VanDerWaalsContact C-N 3.32Å; V905-I907 PolarHBondContact O-N 3.06Å; I907-G909 PolarHBondContact O-N 3.02Å
908	L	37	Very low	52.8	Low	174 Å²	174	108.2 Å²	108.2	91%	0.911	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	92.5	177.1	-173.1	65.3	0	0	0	108.8	K906	K906-L908 PolarHBondContact O-N 3.13Å
909	G	37.1	Very low	50	Low	59 Å²	59	111.7 Å²	111.7	61%	0.608	61%	0.612	S	S	*	*	T	Hydrogen-bonded Turn	trans	178.2	-27.8	-177.2	0	0	0	0	0	116.1	I907 Y911	I907-G909 PolarHBondContact O-N 3.02Å; G909-Y911 PolarHBondContact O-N 3.32Å
910	E	30.3	Very low	47.2	Very low	109 Å²	109	111 Å²	111	51%	0.509	62%	0.618	S	S	.	*			trans	-76.6	85.9	171.7	-70.8	-167.3	170.9	0	0	110.6	N880 K884 T912	N880-E910 PolarHBondContact ND2-OE1 2.92Å; K884-E910 VanDerWaalsContact NZ-CD 3.33Å; K884-E910 IonicContact NZ-OE1 2.63Å; K884-E910 PolarHBondContact NZ-OE1 2.89Å; K884-E910 IonicContact NZ-OE2 2.7Å; K884-E910 PolarHBondContact NZ-OE2 2.88Å; E910-T912 VanDerWaalsContact C-N 3.3Å; E910-T912 PolarHBondContact O-N 3.46Å
911	Y	25.2	Very low	44.2	Very low	220 Å²	220	118.4 Å²	118.4	86%	0.863	66%	0.657	S	S	*	*			trans	-67.5	89	160.2	-94	-84.6	0	0	0	109.1	G909 S913	G909-Y911 PolarHBondContact O-N 3.32Å; Y911-S913 PolarHBondContact O-N 3.17Å; Y911-S913 VanDerWaalsContact O-N 3.1Å
912	T	28	Very low	41.3	Very low	115 Å²	115	125.8 Å²	125.8	71%	0.706	68%	0.681	S	S	*	*			trans	-71.7	100.3	169.4	52.9	0	0	0	0	109.6	E910	E910-T912 VanDerWaalsContact C-N 3.3Å; E910-T912 PolarHBondContact O-N 3.46Å
913	S	25.2	Very low	38.5	Very low	108 Å²	108	133.3 Å²	133.3	76%	0.755	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-53.4	130.6	169.8	-56.1	0	0	0	0	110.2	Y911 L915	Y911-S913 PolarHBondContact O-N 3.17Å; Y911-S913 VanDerWaalsContact O-N 3.1Å; S913-L915 PolarHBondContact O-N 2.92Å
914	P	30.1	Very low	35.6	Very low	129 Å²	129	128.8 Å²	128.8	84%	0.838	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-69.8	117.2	-174.2	26.8	-33.8	0	0	0	110.9	S916	P914-S916 PolarHBondContact O-N 2.92Å
915	L	28.2	Very low	33	Very low	172 Å²	172	127.4 Å²	127.4	90%	0.901	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-67.7	127	173.6	-105.9	166	0	0	0	110.4	S913 S917	S913-L915 PolarHBondContact O-N 2.92Å; L915-S917 PolarHBondContact O-N 3.17Å
916	S	26.3	Very low	30.5	Very low	106 Å²	106	128.7 Å²	128.7	74%	0.741	71%	0.708	S	S	*	*	P	Polyproline II helix	trans	-59.9	119.7	-177.6	178.4	0	0	0	0	112.7	P914	P914-S916 PolarHBondContact O-N 2.92Å
917	S	26.8	Very low	29.1	Very low	121 Å²	121	127 Å²	127	85%	0.846	71%	0.708	S	S	*	*			trans	-114.1	87	163.2	64.8	0	0	0	0	109.8	L915	L915-S917 PolarHBondContact O-N 3.17Å
918	K	27.6	Very low	28.1	Very low	172 Å²	172	129.3 Å²	129.3	75%	0.748	72%	0.721	S	S	*	*			trans	-104.7	117.6	-179.1	-167.2	169.1	-174.9	174.3	0	111.8
919	N	25.2	Very low	27.7	Very low	156 Å²	156	127.1 Å²	127.1	83%	0.834	71%	0.706	S	S	*	*			trans	70.9	137.4	174.9	-58.3	-6.3	0	0	0	116.3
920	G	26	Very low	27.2	Very low	63 Å²	63	131.9 Å²	131.9	65%	0.649	71%	0.71	S	S	*	*			cis	173	178.1	-7.5	0	0	0	0	0	115.6
921	N	25.5	Very low	27	Very low	158 Å²	158	131 Å²	131	85%	0.845	72%	0.715	S	S	*	*			trans	66.8	147.4	-179.5	-61.9	-25.5	0	0	0	116.3
922	R	27	Very low	27	Very low	207 Å²	207	125.9 Å²	125.9	78%	0.781	71%	0.707	S	S	*	*			cis	-176.9	168.6	-37	-125.4	-174.8	-176.5	-131.4	3.1	105.7
923	I	28.9	Very low	26.8	Very low	161 Å²	161	127.5 Å²	127.5	83%	0.826	71%	0.712	S	S	*	*			trans	76.2	143.1	171.6	-53.4	144.5	0	0	0	114.2
924	S	25.6	Very low	27.1	Very low	53 Å²	53	130.9 Å²	130.9	37%	0.371	71%	0.712	S	S	.	*			cis	177.1	148.8	-36	-178.8	0	0	0	0	108.5	R160	R160-S924 WeakPolarHBondContact CD-OG 3.32Å; R160-S924 PolarHBondContact NE-OG 3.2Å; R160-S924 PolarHBondContact NH1-OG 3.36Å
925	S	28.1	Very low	26.8	Very low	60 Å²	60	131.6 Å²	131.6	42%	0.42	71%	0.705	S	S	.	*			trans	62.2	105.8	149.2	43.4	0	0	0	0	118.5	E159	E159-S925 PolarHBondContact OE1-N 3.44Å; E159-S925 VanDerWaalsContact OE1-N 3.11Å; E159-S925 WeakPolarHBondContact OE2-CA 3.39Å; E159-S925 PolarHBondContact OE2-N 3.27Å
926	N	27.1	Very low	26.6	Very low	86 Å²	86	131.4 Å²	131.4	46%	0.46	70%	0.703	S	S	.	*			trans	-49.8	162	147.5	-60.1	-28.7	0	0	0	112.7	L158 E159	L158-N926 WeakPolarHBondContact O-CB 3.18Å; L158-N926 PolarHBondContact O-ND2 2.9Å; E159-N926 HydrophobicContact CB-CB 4.32Å; E159-N926 PolarHBondContact OE2-N 3.39Å
927	N	27.9	Very low	26.5	Very low	161 Å²	161	134.1 Å²	134.1	86%	0.861	70%	0.703	S	S	*	*			trans	-157.7	169.7	139.9	-116.6	-56.3	0	0	0	112.4
928	L	28	Very low	26.4	Very low	126 Å²	126	133.3 Å²	133.3	66%	0.66	70%	0.698	S	S	*	*			trans	-121.6	150.8	-162.8	175.4	62.9	0	0	0	112.6
929	E	27.7	Very low	26.3	Very low	128 Å²	128	128 Å²	128	60%	0.598	69%	0.687	S	S	*	*			trans	73.3	145.9	160.1	-90.8	-174.1	170.1	0	0	122
930	K	27.2	Very low	26.4	Very low	159 Å²	159	130 Å²	130	69%	0.691	69%	0.688	S	S	*	*			trans	48.6	145.9	140.4	-65.5	167.7	-169.5	152.1	0	120.4
931	S	25.5	Very low	26.4	Very low	90 Å²	90	131 Å²	131	63%	0.629	69%	0.685	S	S	*	*			cis	-172.1	148.1	-14.2	48.2	0	0	0	0	110
932	T	24.8	Very low	26.4	Very low	113 Å²	113	130.2 Å²	130.2	69%	0.693	68%	0.679	S	S	*	*			trans	48.4	119.6	149.5	56	0	0	0	0	121.1
933	N	24.9	Very low	26.2	Very low	149 Å²	149	125.6 Å²	125.6	80%	0.797	68%	0.679	S	S	*	*			trans	92.7	130.7	133.4	-62.9	-14.7	0	0	0	121.9
934	K	30.1	Very low	26.1	Very low	178 Å²	178	129 Å²	129	77%	0.774	68%	0.681	S	S	*	*			trans	83.2	108.5	151.6	-70.5	-177.4	176.9	-168.2	0	121.3
935	E	24.6	Very low	26.2	Very low	145 Å²	145	134.3 Å²	134.3	68%	0.678	70%	0.704	S	S	*	*				57.1	101.5	126.8	-63.7	170.3	107.8	0	0	119.2
936	I	23.8	Very low	26.5	Very low	167 Å²	167	136.4 Å²	136.4	86%	0.856	72%	0.717	S	S	*	*			trans	-96.5	125.6	139.3	-64.8	174.3	0	0	0	107.5
937	H	23.8	Very low	26.5	Very low	163 Å²	163	142.7 Å²	142.7	76%	0.755	73%	0.734	S	S	*	*			trans	-109.7	115.6	162.2	-109.1	-61.1	0	0	0	109.5
938	S	26	Very low	26.5	Very low	104 Å²	104	140.5 Å²	140.5	73%	0.727	73%	0.727	S	S	*	*			trans	62.9	164.2	166.1	-73.6	0	0	0	0	118.9
939	A	25.7	Very low	26.4	Very low	62 Å²	62	146 Å²	146	51%	0.512	74%	0.739	S	S	.	*			cis	-177.6	164	-37.2	0	0	0	0	0	108.3
940	F	25.7	Very low	27.7	Very low	196 Å²	196	145 Å²	145	86%	0.86	74%	0.743	S	S	*	*			trans	67.7	153.4	167.7	-56	-69.2	0	0	0	115.9
941	S	26	Very low	27.7	Very low	84 Å²	84	147.6 Å²	147.6	59%	0.587	75%	0.749	S	S	*	*			cis	-156.5	137.9	-6.3	-120.3	0	0	0	0	113.8
942	I	25.8	Very low	27.7	Very low	143 Å²	143	150.1 Å²	150.1	73%	0.733	75%	0.75	S	S	*	*			trans	39.2	118.9	130.5	-50.5	168.3	0	0	0	119.4
943	S	23.5	Very low	27.7	Very low	109 Å²	109	152.2 Å²	152.2	76%	0.762	76%	0.757	S	S	*	*				-179.6	123.3	114.7	40.4	0	0	0	0	118.3
944	R	26.3	Very low	27.6	Very low	234 Å²	234	148.2 Å²	148.2	88%	0.883	75%	0.751	S	S	*	*			trans	47.2	117.1	130.5	-57.8	-177.3	177	-165	-1.6	123.5
945	L	27.2	Very low	27.6	Very low	163 Å²	163	145.3 Å²	145.3	85%	0.853	75%	0.752	S	S	*	*				12	150.4	119	-73	166.1	0	0	0	119.5
946	P	35.7	Very low	27.6	Very low	105 Å²	105	147.2 Å²	147.2	68%	0.682	76%	0.761	S	S	*	*			cis	-156.7	178.9	41.9	43.8	-22.3	0	0	0	121
947	R	27.5	Very low	27.8	Very low	217 Å²	217	147.2 Å²	147.2	82%	0.819	76%	0.758	S	S	*	*			trans	77.9	123.3	136.2	-102.1	-172.9	161.1	98.3	-1	126.3
948	T	27	Very low	27.9	Very low	116 Å²	116	145.6 Å²	145.6	71%	0.712	76%	0.755	S	S	*	*			trans	57.9	109	133.2	48.1	0	0	0	0	126
949	R	25.5	Very low	27.9	Very low	241 Å²	241	146.8 Å²	146.8	91%	0.909	76%	0.763	S	S	*	*				22	157.2	106.9	-120.9	-167.2	-169.2	-171.3	5	120
950	P	55.5	Low	28	Very low	106 Å²	106	152.5 Å²	152.5	69%	0.688	78%	0.779	S	S	*	*				-131	-156.1	-68	43.3	-25.6	0	0	0	113
951	R	26.3	Very low	27.9	Very low	215 Å²	215	149.9 Å²	149.9	81%	0.811	78%	0.779	S	S	*	*			trans	95.8	161.3	175.1	-63.4	174.5	154.3	-161.6	3.8	115.3
952	Q	26.6	Very low	27.8	Very low	142 Å²	142	154.8 Å²	154.8	66%	0.664	79%	0.79	S	S	*	*			cis	-153.7	-167.1	-3.8	-130.9	170.6	-66.1	0	0	113.2
953	L	25.3	Very low	28.4	Very low	158 Å²	158	153.4 Å²	153.4	83%	0.827	79%	0.79	S	S	*	*			trans	-51.7	166.6	165.1	-75.3	62.5	0	0	0	113.4
954	G	22.4	Very low	28.4	Very low	65 Å²	65	153.1 Å²	153.1	67%	0.67	79%	0.788	S	S	*	*			cis	162.5	165.5	-4.8	0	0	0	0	0	114.3
955	S	29.1	Very low	28.4	Very low	116 Å²	116	149.1 Å²	149.1	81%	0.811	78%	0.784	S	S	*	*			trans	44.2	117.2	151.9	59.2	0	0	0	0	124.5
956	E	24.7	Very low	28.5	Very low	185 Å²	185	150.5 Å²	150.5	86%	0.864	79%	0.786	S	S	*	*			trans	-178.1	134.8	135.8	-96.9	163.6	170.3	0	0	105.9
957	Q	28.7	Very low	28.1	Very low	168 Å²	168	148.8 Å²	148.8	79%	0.785	79%	0.788	S	S	*	*				68.3	129.7	56.8	-70	-159.1	-86.4	0	0	113.5
958	D	24.9	Very low	28	Very low	128 Å²	128	145 Å²	145	68%	0.684	79%	0.789	S	S	*	*			cis	-147.9	164	5.9	-82	-44.2	0	0	0	112.5
959	S	26.8	Very low	28.3	Very low	129 Å²	129	148.1 Å²	148.1	90%	0.902	79%	0.792	S	S	*	*			trans	174.2	156.7	137.3	-78	0	0	0	0	113
960	E	26.5	Very low	28.7	Very low	183 Å²	183	144.9 Å²	144.9	86%	0.855	79%	0.785	S	S	*	*			trans	-95.1	154.5	-161.9	-55.9	173	106	0	0	116.4
961	V	25.2	Very low	27.4	Very low	140 Å²	140	146.1 Å²	146.1	85%	0.848	79%	0.786	S	S	*	*				169.4	143.2	121.1	156	0	0	0	0	110.9
962	F	23.2	Very low	27.4	Very low	188 Å²	188	141 Å²	141	83%	0.825	78%	0.782	S	S	*	*			trans	-104	176.7	-175.5	-77.9	-79.6	0	0	0	112.1
963	P	37.9	Very low	27.6	Very low	113 Å²	113	141.9 Å²	141.9	73%	0.734	78%	0.783	S	S	*	*			cis	-138.3	173.2	11.3	44.3	-27.4	0	0	0	117.9
964	S	24.3	Very low	27.7	Very low	104 Å²	104	141.8 Å²	141.8	73%	0.727	78%	0.779	S	S	*	*			trans	36.9	142.9	144.9	-98	0	0	0	0	122.5
965	N	26	Very low	28	Very low	150 Å²	150	145.2 Å²	145.2	80%	0.802	78%	0.78	S	S	*	*			cis	-161.7	178.9	11.2	-149.3	-19.4	0	0	0	111.6
966	Q	29.9	Very low	27.8	Very low	191 Å²	191	146.5 Å²	146.5	89%	0.893	77%	0.773	S	S	*	*			trans	71.2	127.3	161.1	-157.1	173.9	30.4	0	0	117.2
967	G	26.9	Very low	28	Very low	69 Å²	69	142.6 Å²	142.6	71%	0.711	77%	0.766	S	S	*	*			cis	-177.6	138.6	-9.3	0	0	0	0	0	112.1
968	V	26	Very low	28	Very low	138 Å²	138	139.5 Å²	139.5	84%	0.836	77%	0.769	S	S	*	*			trans	-125.1	106.9	-173.2	178.7	0	0	0	0	112.4
969	K	32.8	Very low	28.2	Very low	181 Å²	181	143.4 Å²	143.4	79%	0.787	78%	0.78	S	S	*	*				28.6	114.1	129.8	-165.6	-173.3	-170.5	172.1	0	117.6
970	K	34.2	Very low	28.3	Very low	173 Å²	173	145.5 Å²	145.5	75%	0.752	78%	0.78	S	S	*	*				167.5	137	126.2	-93.2	162.3	-171.9	177.3	0	117.8
971	N	28.1	Very low	28.3	Very low	133 Å²	133	144 Å²	144	71%	0.711	78%	0.778	S	S	*	*			trans	81.1	129.8	131.5	-67.5	2.6	0	0	0	124.9
972	C	26.9	Very low	28.6	Very low	107 Å²	107	142.9 Å²	142.9	72%	0.723	77%	0.773	S	S	*	*			trans	71.7	148.5	140.8	-68.2	0	0	0	0	119
973	K	30.7	Very low	28.8	Very low	161 Å²	161	141.7 Å²	141.7	70%	0.7	78%	0.775	S	S	*	*			cis	-163.9	138.7	-9.9	-122.4	174	173.7	-167.3	0	109.8
974	Q	27.7	Very low	28.4	Very low	156 Å²	156	142.3 Å²	142.3	73%	0.729	78%	0.777	S	S	*	*			trans	61.4	177	166.9	-61.2	148.3	-117.8	0	0	112.6
975	I	27.4	Very low	28.8	Very low	136 Å²	136	143.2 Å²	143.2	70%	0.697	78%	0.781	S	S	*	*			cis	-147.9	164.1	-8.9	-134.4	167.9	0	0	0	105.5
976	E	24.7	Very low	28.9	Very low	143 Å²	143	142.2 Å²	142.2	67%	0.668	78%	0.78	S	S	*	*			cis	-149.2	-173.1	25.1	-168.4	34.4	-99.1	0	0	111
977	S	30.1	Very low	28.8	Very low	103 Å²	103	140.4 Å²	140.4	72%	0.72	77%	0.771	S	S	*	*			trans	-71	137.7	-179.4	-54.3	0	0	0	0	115.6
978	A	28.3	Very low	28.9	Very low	103 Å²	103	146.3 Å²	146.3	85%	0.851	78%	0.778	S	S	*	*			trans	-134.3	145.4	155.5	0	0	0	0	0	109.4
979	K	29.8	Very low	29	Very low	210 Å²	210	146.7 Å²	146.7	91%	0.913	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-91.3	132.5	-164.5	-64.2	173	-178	173.9	0	112.4
980	L	28.3	Very low	28.9	Very low	173 Å²	173	142.1 Å²	142.1	91%	0.906	76%	0.763	S	S	*	*	P	Polyproline II helix	trans	-65.3	129.5	160.2	-83.5	151.7	0	0	0	109.8
981	L	26.4	Very low	28.8	Very low	153 Å²	153	139.6 Å²	139.6	80%	0.801	76%	0.764	S	S	*	*	P	Polyproline II helix	trans	-77.8	141.7	155.2	-131.9	78.8	0	0	0	107.6
982	P	30.4	Very low	29.1	Very low	115 Å²	115	139.1 Å²	139.1	75%	0.747	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-78.2	124.3	171.5	30.3	-31.9	0	0	0	110.4	T984	P982-T984 PolarHBondContact O-N 3.41Å
983	D	27.8	Very low	29.7	Very low	163 Å²	163	139 Å²	139	87%	0.872	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-60.9	129.2	168	-74.9	-50.5	0	0	0	110.3
984	T	29.4	Very low	30.3	Very low	126 Å²	126	139.8 Å²	139.8	77%	0.773	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-62.3	134.6	177.1	29.7	0	0	0	0	111.3	P982 V986	P982-T984 PolarHBondContact O-N 3.41Å; T984-V986 PolarHBondContact O-N 3.37Å; T984-V986 VanDerWaalsContact O-N 3.17Å
985	P	32.7	Very low	31.5	Very low	124 Å²	124	136.2 Å²	136.2	81%	0.805	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-66	117.8	-179.9	27	-33.9	0	0	0	110.7	Q987	P985-Q987 PolarHBondContact O-N 2.81Å; P985-Q987 VanDerWaalsContact O-N 3.15Å
986	V	29.1	Very low	33.3	Very low	129 Å²	129	134.7 Å²	134.7	78%	0.782	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-59.2	117.5	178	177.6	0	0	0	0	109.9	T984 F988	T984-V986 PolarHBondContact O-N 3.37Å; T984-V986 VanDerWaalsContact O-N 3.17Å; V986-F988 PolarHBondContact O-N 3.25Å
987	Q	27.8	Very low	35.6	Very low	152 Å²	152	137.4 Å²	137.4	71%	0.71	75%	0.751	S	S	*	*			trans	-71.1	101.6	-177.4	-168	176.4	40.9	0	0	110.2	P985 I989	P985-Q987 PolarHBondContact O-N 2.81Å; P985-Q987 VanDerWaalsContact O-N 3.15Å; Q987-I989 PolarHBondContact O-N 3.33Å; Q987-I989 VanDerWaalsContact O-N 3.15Å
988	F	28	Very low	37.8	Very low	193 Å²	193	133.4 Å²	133.4	85%	0.846	72%	0.723	S	S	*	*			trans	-62	113.7	-178.5	-109.8	-93.3	0	0	0	111.8	V986	V986-F988 PolarHBondContact O-N 3.25Å
989	I	29.7	Very low	40.5	Very low	147 Å²	147	132.8 Å²	132.8	75%	0.754	70%	0.701	S	S	*	*			trans	-87.2	121.2	172.6	-58.5	178.8	0	0	0	108.5	Q987	Q987-I989 PolarHBondContact O-N 3.33Å; Q987-I989 VanDerWaalsContact O-N 3.15Å
990	P	29.7	Very low	43.1	Very low	85 Å²	85	127.1 Å²	127.1	55%	0.552	68%	0.684	S	S	*	*			trans	-68.5	147.3	-179.8	-21.9	34.2	0	0	0	113.3	N992	P990-N992 PolarHBondContact O-N 3.29Å
991	P	32.7	Very low	45.9	Very low	119 Å²	119	123.9 Å²	123.9	77%	0.773	66%	0.663	S	S	*	*	S	Bend	trans	-72.7	95.3	-179.7	29.8	-34.9	0	0	0	111.6
992	N	34.3	Very low	48.8	Very low	123 Å²	123	117.2 Å²	117.2	66%	0.658	63%	0.628	S	S	*	*			trans	-141.8	54.5	165.7	-98.2	-38.4	0	0	0	109.2	P990 L994	P990-N992 PolarHBondContact O-N 3.29Å; N992-L994 PolarHBondContact O-N 3.21Å
993	T	39.7	Very low	51.6	Low	106 Å²	106	112.5 Å²	112.5	65%	0.65	60%	0.596	S	S	*	*			trans	-73.2	8.7	-170.2	35	0	0	0	0	115.5	N995 L996	T993-N995 PolarHBondContact O-N 2.94Å; T993-N995 VanDerWaalsContact O-N 3.09Å; T993-L996 HydrophobicContact CG2-CD1 4.17Å; T993-L996 HydrophobicContact CG2-CG 4.38Å
994	L	42.8	Very low	54.5	Low	176 Å²	176	111 Å²	111	92%	0.921	58%	0.582	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	23.1	173.1	-77.4	179.1	0	0	0	114.9	N992	N992-L994 PolarHBondContact O-N 3.21Å
995	N	53.5	Low	57.3	Low	82 Å²	82	108.8 Å²	108.8	44%	0.439	56%	0.562	S	S	.	*	T	Hydrogen-bonded Turn	trans	-153.3	31	159.9	-133.3	-16.1	0	0	0	118.4	T993 R997 S998 F999	T993-N995 PolarHBondContact O-N 2.94Å; T993-N995 VanDerWaalsContact O-N 3.09Å; N995-R997 PolarHBondContact O-N 3.03Å; N995-R997 VanDerWaalsContact O-N 3.14Å; N995-S998 VanDerWaalsContact CG-CB 3.46Å; N995-S998 PolarHBondContact O-N 3.2Å; N995-S998 WeakPolarHBondContact OD1-CB 3.44Å; N995-S998 PolarHBondContact OD1-N 3.1Å; N995-S998 PolarHBondContact OD1-OG 2.63Å; N995-F999 PolarHBondContact O-N 2.89Å
996	L	64	Low	60	Low	103 Å²	103	102.9 Å²	102.9	54%	0.539	52%	0.523	S	S	.	.	H	α-helix	trans	-51.6	-39	174.9	-69.2	177.2	0	0	0	112.4	T993 S998 F999 T1000	T993-L996 HydrophobicContact CG2-CD1 4.17Å; T993-L996 HydrophobicContact CG2-CG 4.38Å; L996-S998 PolarHBondContact O-N 3.36Å; L996-F999 PolarHBondContact O-N 2.85Å; L996-T1000 PolarHBondContact O-N 3.48Å; L996-T1000 PolarHBondContact O-OG1 2.85Å; L996-T1000 VanDerWaalsContact O-OG1 3.13Å
997	R	72.6	Confident	62.8	Low	201 Å²	201	99 Å²	99	76%	0.758	51%	0.505	S	S	*	.	H	α-helix	trans	-63	-34.6	177.4	-164.4	177.6	-171.6	-165.7	4.5	113.5	N995 K1001	N995-R997 PolarHBondContact O-N 3.03Å; N995-R997 VanDerWaalsContact O-N 3.14Å; R997-K1001 VanDerWaalsContact O-CG 3.3Å; R997-K1001 WeakPolarHBondContact O-CG 3.26Å; R997-K1001 PolarHBondContact O-N 3Å
998	S	76.6	Confident	65.7	Low	19 Å²	19	97.4 Å²	97.4	13%	0.133	50%	0.497	C	S	.	.	H	α-helix	trans	-87.4	-30.4	175.6	-51.8	0	0	0	0	112.8	N995 L996 T1000 K1001 I1002	N995-S998 VanDerWaalsContact CG-CB 3.46Å; N995-S998 PolarHBondContact O-N 3.2Å; N995-S998 WeakPolarHBondContact OD1-CB 3.44Å; N995-S998 PolarHBondContact OD1-N 3.1Å; N995-S998 PolarHBondContact OD1-OG 2.63Å; L996-S998 PolarHBondContact O-N 3.36Å; S998-T1000 VanDerWaalsContact C-N 3.35Å; S998-K1001 WeakPolarHBondContact O-CB 3.41Å; S998-K1001 PolarHBondContact O-N 3.43Å; S998-I1002 WeakPolarHBondContact O-CB 3.27Å; S998-I1002 WeakPolarHBondContact O-CD1 3.43Å; S998-I1002 WeakPolarHBondContact O-CG1 3.07Å; S998-I1002 PolarHBondContact O-N 2.74Å
999	F	84.4	Confident	68.4	Low	89 Å²	89	93.2 Å²	93.2	39%	0.39	48%	0.483	S	S	.	.	H	α-helix	trans	-58.5	-47.8	170.3	179	-105.8	0	0	0	110.8	N995 L996 K1001 I1002 I1003 L1022	N995-F999 PolarHBondContact O-N 2.89Å; L996-F999 PolarHBondContact O-N 2.85Å; F999-K1001 VanDerWaalsContact C-N 3.33Å; F999-K1001 PolarHBondContact O-N 2.93Å; F999-I1002 PolarHBondContact O-N 2.82Å; F999-I1002 VanDerWaalsContact O-N 3.17Å; F999-I1003 HydrophobicContact CD1-CG1 4.25Å; F999-I1003 HydrophobicContact CD2-CG1 4.27Å; F999-I1003 HydrophobicContact CE1-CD1 4.46Å; F999-I1003 HydrophobicContact CE1-CG1 3.85Å; F999-I1003 HydrophobicContact CE2-CD1 4.02Å; F999-I1003 HydrophobicContact CE2-CG1 3.87Å; F999-I1003 HydrophobicContact CG-CG1 4.45Å; F999-I1003 HydrophobicContact CZ-CD1 3.82Å; F999-I1003 HydrophobicContact CZ-CG1 3.64Å; F999-I1003 WeakPolarHBondContact O-CB 3.46Å; F999-I1003 WeakPolarHBondContact O-CG1 3.49Å; F999-I1003 PolarHBondContact O-N 3.36Å; F999-L1022 HydrophobicContact CE2-CD1 4.29Å
1000	T	85.1	Confident	71	Confident	92 Å²	92	87.1 Å²	87.1	56%	0.564	45%	0.452	S	S	*	.	H	α-helix	trans	-62.3	-36.4	174.7	-58.5	0	0	0	0	112.6	L996 S998 K1004	L996-T1000 PolarHBondContact O-N 3.48Å; L996-T1000 PolarHBondContact O-OG1 2.85Å; L996-T1000 VanDerWaalsContact O-OG1 3.13Å; S998-T1000 VanDerWaalsContact C-N 3.35Å; T1000-K1004 VanDerWaalsContact O-CB 3.24Å; T1000-K1004 WeakPolarHBondContact O-CB 3.44Å; T1000-K1004 PolarHBondContact O-N 3.14Å
1001	K	86.8	Confident	73.4	Confident	105 Å²	105	88.2 Å²	88.2	46%	0.457	46%	0.459	S	S	.	.	H	α-helix	trans	-65.6	-40.6	172.4	-75.7	173	176.2	-172.5	0	113	R997 S998 F999 K1005 I1038	R997-K1001 VanDerWaalsContact O-CG 3.3Å; R997-K1001 WeakPolarHBondContact O-CG 3.26Å; R997-K1001 PolarHBondContact O-N 3Å; S998-K1001 WeakPolarHBondContact O-CB 3.41Å; S998-K1001 PolarHBondContact O-N 3.43Å; F999-K1001 VanDerWaalsContact C-N 3.33Å; F999-K1001 PolarHBondContact O-N 2.93Å; K1001-K1005 WeakPolarHBondContact O-CB 3.27Å; K1001-K1005 PolarHBondContact O-N 3.24Å; K1001-I1038 HydrophobicContact CD-CD1 4.23Å
1002	I	88.5	Confident	75.8	Confident	13 Å²	13	91.7 Å²	91.7	7%	0.067	47%	0.465	C	S	.	.	H	α-helix	trans	-66.8	-48.9	178.8	-71.7	161.4	0	0	0	109.8	S998 F999 K1004 K1005 L1006 L1022 I1038 I1041 V1042	S998-I1002 WeakPolarHBondContact O-CB 3.27Å; S998-I1002 WeakPolarHBondContact O-CD1 3.43Å; S998-I1002 WeakPolarHBondContact O-CG1 3.07Å; S998-I1002 PolarHBondContact O-N 2.74Å; F999-I1002 PolarHBondContact O-N 2.82Å; F999-I1002 VanDerWaalsContact O-N 3.17Å; I1002-K1004 PolarHBondContact O-N 2.82Å; I1002-K1005 PolarHBondContact O-N 2.99Å; I1002-L1006 HydrophobicContact CG2-CD1 3.68Å; I1002-L1006 WeakPolarHBondContact O-CB 3.33Å; I1002-L1006 WeakPolarHBondContact O-CD1 3.43Å; I1002-L1006 WeakPolarHBondContact O-CG 3.34Å; I1002-L1006 PolarHBondContact O-N 3.25Å; I1002-L1022 HydrophobicContact CG2-CD1 4.04Å; I1002-L1022 HydrophobicContact CG2-CD2 3.6Å; I1002-L1022 HydrophobicContact CG2-CG 4.46Å; I1002-I1038 HydrophobicContact CG1-CG1 4.48Å; I1002-I1038 HydrophobicContact CG1-CG2 3.9Å; I1002-I1041 HydrophobicContact CD1-CB 4.39Å; I1002-I1041 HydrophobicContact CD1-CD1 3.93Å; I1002-I1041 HydrophobicContact CD1-CG2 4.1Å; I1002-I1041 HydrophobicContact CG2-CG2 4.08Å; I1002-V1042 HydrophobicContact CB-CG2 4.4Å; I1002-V1042 HydrophobicContact CG1-CG2 4.36Å; I1002-V1042 HydrophobicContact CG2-CG2 4.13Å
1003	I	88.7	Confident	78.2	Confident	16 Å²	16	87.5 Å²	87.5	8%	0.082	44%	0.443	C	S	.	.	H	α-helix	trans	-59.9	-45.1	175.2	-67.6	-71	0	0	0	111.1	F999 L1006 A1007 I1018 I1019 L1022	F999-I1003 HydrophobicContact CD1-CG1 4.25Å; F999-I1003 HydrophobicContact CD2-CG1 4.27Å; F999-I1003 HydrophobicContact CE1-CD1 4.46Å; F999-I1003 HydrophobicContact CE1-CG1 3.85Å; F999-I1003 HydrophobicContact CE2-CD1 4.02Å; F999-I1003 HydrophobicContact CE2-CG1 3.87Å; F999-I1003 HydrophobicContact CG-CG1 4.45Å; F999-I1003 HydrophobicContact CZ-CD1 3.82Å; F999-I1003 HydrophobicContact CZ-CG1 3.64Å; F999-I1003 WeakPolarHBondContact O-CB 3.46Å; F999-I1003 WeakPolarHBondContact O-CG1 3.49Å; F999-I1003 PolarHBondContact O-N 3.36Å; I1003-L1006 PolarHBondContact O-N 2.75Å; I1003-A1007 WeakPolarHBondContact O-CB 3.24Å; I1003-A1007 PolarHBondContact O-N 3.48Å; I1003-I1018 HydrophobicContact CD1-CG2 4.15Å; I1003-I1019 HydrophobicContact CD1-CG1 3.84Å; I1003-L1022 HydrophobicContact CD1-CD1 3.45Å; I1003-L1022 VanDerWaalsContact CD1-CD1 3.45Å; I1003-L1022 HydrophobicContact CG1-CD1 4.29Å
1004	K	88.6	Confident	80.4	Confident	131 Å²	131	85.9 Å²	85.9	57%	0.57	44%	0.436	S	S	*	.	H	α-helix	trans	-60.7	-51.3	177	178	162.8	175.5	166.6	0	111.5	T1000 I1002 L1006 A1007 E1008	T1000-K1004 VanDerWaalsContact O-CB 3.24Å; T1000-K1004 WeakPolarHBondContact O-CB 3.44Å; T1000-K1004 PolarHBondContact O-N 3.14Å; I1002-K1004 PolarHBondContact O-N 2.82Å; K1004-L1006 VanDerWaalsContact C-N 3.28Å; K1004-L1006 PolarHBondContact O-N 3.35Å; K1004-A1007 PolarHBondContact O-N 2.83Å; K1004-E1008 WeakPolarHBondContact CE-OE1 3.36Å; K1004-E1008 HydrophobicContact CG-CG 4.37Å; K1004-E1008 WeakPolarHBondContact CG-OE1 3.38Å; K1004-E1008 IonicContact NZ-OE1 3.77Å; K1004-E1008 WeakPolarHBondContact O-CB 3.28Å; K1004-E1008 VanDerWaalsContact O-CG 3.28Å; K1004-E1008 WeakPolarHBondContact O-CG 3.32Å; K1004-E1008 PolarHBondContact O-N 2.82Å
1005	K	87.9	Confident	82.5	Confident	80 Å²	80	85.2 Å²	85.2	35%	0.348	42%	0.421	S	S	.	.	H	α-helix	trans	-58.9	-36.2	176.5	-81.9	-163.2	169.1	-158	0	113.3	K1001 I1002 E1008 L1009 N1039 V1042	K1001-K1005 WeakPolarHBondContact O-CB 3.27Å; K1001-K1005 PolarHBondContact O-N 3.24Å; I1002-K1005 PolarHBondContact O-N 2.99Å; K1005-E1008 WeakPolarHBondContact CA-OE2 3.43Å; K1005-L1009 WeakPolarHBondContact O-CB 3.23Å; K1005-L1009 WeakPolarHBondContact O-CD1 3.46Å; K1005-L1009 VanDerWaalsContact O-CG 3.23Å; K1005-L1009 WeakPolarHBondContact O-CG 3.31Å; K1005-L1009 PolarHBondContact O-N 2.9Å; K1005-N1039 PolarHBondContact NZ-OD1 3.07Å; K1005-V1042 HydrophobicContact CB-CG1 4.21Å; K1005-V1042 HydrophobicContact CB-CG2 3.93Å; K1005-V1042 HydrophobicContact CD-CG2 4.33Å
1006	L	89.1	Confident	83.8	Confident	0 Å²	0	86.3 Å²	86.3	0%	0	43%	0.428	C	S	.	.	H	α-helix	trans	-74	-37.3	178.8	-76	161.4	0	0	0	112.5	I1002 I1003 K1004 E1008 L1009 H1010 I1018 L1022 V1042 T1045 L1049	I1002-L1006 HydrophobicContact CG2-CD1 3.68Å; I1002-L1006 WeakPolarHBondContact O-CB 3.33Å; I1002-L1006 WeakPolarHBondContact O-CD1 3.43Å; I1002-L1006 WeakPolarHBondContact O-CG 3.34Å; I1002-L1006 PolarHBondContact O-N 3.25Å; I1003-L1006 PolarHBondContact O-N 2.75Å; K1004-L1006 VanDerWaalsContact C-N 3.28Å; K1004-L1006 PolarHBondContact O-N 3.35Å; L1006-E1008 VanDerWaalsContact C-N 3.34Å; L1006-L1009 PolarHBondContact O-N 3Å; L1006-H1010 PolarHBondContact O-CD2 2.88Å; L1006-H1010 PolarHBondContact O-N 2.72Å; L1006-I1018 HydrophobicContact CB-CD1 4.32Å; L1006-I1018 HydrophobicContact CB-CG2 3.57Å; L1006-I1018 HydrophobicContact CD1-CG2 3.78Å; L1006-I1018 HydrophobicContact CG-CG2 4.24Å; L1006-L1022 HydrophobicContact CD1-CD1 3.97Å; L1006-L1022 HydrophobicContact CD1-CD2 3.97Å; L1006-L1022 HydrophobicContact CD1-CG 4.01Å; L1006-V1042 HydrophobicContact CD2-CG1 4Å; L1006-V1042 HydrophobicContact CG-CG1 4.19Å; L1006-V1042 HydrophobicContact CG-CG2 4.21Å; L1006-T1045 HydrophobicContact CD1-CG2 3.81Å; L1006-T1045 HydrophobicContact CD2-CG2 4Å; L1006-L1049 HydrophobicContact CD2-CD1 4.31Å
1007	A	88.4	Confident	84.9	Confident	47 Å²	47	85.1 Å²	85.1	39%	0.388	42%	0.419	S	S	.	.	H	α-helix	trans	-67.4	-35.2	172.1	0	0	0	0	0	112.2	I1003 K1004 I1018	I1003-A1007 WeakPolarHBondContact O-CB 3.24Å; I1003-A1007 PolarHBondContact O-N 3.48Å; K1004-A1007 PolarHBondContact O-N 2.83Å; A1007-I1018 HydrophobicContact CB-CD1 4.36Å
1008	E	87.8	Confident	85.7	Confident	119 Å²	119	75.7 Å²	75.7	56%	0.556	38%	0.383	S	S	*	.	H	α-helix	trans	-66.7	-34.6	173.1	-72.4	166.7	164.1	0	0	112.7	K1004 K1005 L1006	K1004-E1008 WeakPolarHBondContact CE-OE1 3.36Å; K1004-E1008 HydrophobicContact CG-CG 4.37Å; K1004-E1008 WeakPolarHBondContact CG-OE1 3.38Å; K1004-E1008 IonicContact NZ-OE1 3.77Å; K1004-E1008 WeakPolarHBondContact O-CB 3.28Å; K1004-E1008 VanDerWaalsContact O-CG 3.28Å; K1004-E1008 WeakPolarHBondContact O-CG 3.32Å; K1004-E1008 PolarHBondContact O-N 2.82Å; K1005-E1008 WeakPolarHBondContact CA-OE2 3.43Å; L1006-E1008 VanDerWaalsContact C-N 3.34Å
1009	L	85.1	Confident	86.2	Confident	105 Å²	105	76.6 Å²	76.6	55%	0.55	39%	0.387	S	S	.	.	H	α-helix	trans	-88.1	-21.8	-179.3	-72.5	170.1	0	0	0	114.4	K1005 L1006 V1042	K1005-L1009 WeakPolarHBondContact O-CB 3.23Å; K1005-L1009 WeakPolarHBondContact O-CD1 3.46Å; K1005-L1009 VanDerWaalsContact O-CG 3.23Å; K1005-L1009 WeakPolarHBondContact O-CG 3.31Å; K1005-L1009 PolarHBondContact O-N 2.9Å; L1006-L1009 PolarHBondContact O-N 3Å; L1009-V1042 HydrophobicContact CD1-CG1 3.49Å; L1009-V1042 VanDerWaalsContact CD1-CG1 3.49Å
1010	H	83.7	Confident	86.4	Confident	19 Å²	19	76.6 Å²	76.6	9%	0.088	39%	0.39	C	S	.	.			trans	-137.1	64.4	-178.1	-51.2	-97	0	0	0	110.8	L1006 E1012 V1013 S1046 L1049	L1006-H1010 PolarHBondContact O-CD2 2.88Å; L1006-H1010 PolarHBondContact O-N 2.72Å; H1010-E1012 PolarHBondContact O-N 3.4Å; H1010-E1012 VanDerWaalsContact O-N 3.14Å; H1010-V1013 HydrophobicContact CB-CB 4.01Å; H1010-V1013 HydrophobicContact CB-CG2 3.78Å; H1010-V1013 WeakPolarHBondContact O-CB 3.37Å; H1010-V1013 PolarHBondContact O-N 3.33Å; H1010-S1046 WeakPolarHBondContact NE2-CA 3.47Å; H1010-S1046 WeakPolarHBondContact NE2-CB 3.48Å; H1010-S1046 PolarHBondContact NE2-OG 3.3Å; H1010-L1049 HydrophobicContact CB-CD1 4.35Å
1011	P	81.9	Confident	86.6	Confident	108 Å²	108	72.6 Å²	72.6	70%	0.701	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-19	-176.7	27.2	-36.3	0	0	0	113.6	V1013	P1011-V1013 VanDerWaalsContact C-N 3.27Å
1012	E	83	Confident	86.7	Confident	192 Å²	192	68.1 Å²	68.1	90%	0.897	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.7	-12.6	175	-63	172.6	-167.3	0	0	113.1	H1010	H1010-E1012 PolarHBondContact O-N 3.4Å; H1010-E1012 VanDerWaalsContact O-N 3.14Å
1013	V	85	Confident	86.7	Confident	35 Å²	35	71.6 Å²	71.6	21%	0.212	36%	0.364	C	S	.	.	S	Bend	trans	-102.8	130.4	-172.1	-179.6	0	0	0	0	111.1	H1010 P1011 H1017 I1018 L1049	H1010-V1013 HydrophobicContact CB-CB 4.01Å; H1010-V1013 HydrophobicContact CB-CG2 3.78Å; H1010-V1013 WeakPolarHBondContact O-CB 3.37Å; H1010-V1013 PolarHBondContact O-N 3.33Å; P1011-V1013 VanDerWaalsContact C-N 3.27Å; V1013-H1017 HydrophobicContact CG1-CB 3.79Å; V1013-I1018 HydrophobicContact CB-CG1 4.31Å; V1013-I1018 HydrophobicContact CG1-CG1 3.77Å; V1013-L1049 HydrophobicContact CG1-CD2 3.94Å
1014	S	85.9	Confident	86.6	Confident	72 Å²	72	74.8 Å²	74.8	50%	0.503	38%	0.378	S	S	.	.			trans	-63.8	146.2	177.1	73.2	0	0	0	0	112.3	D1016 H1017 I1018	S1014-D1016 PolarHBondContact O-N 3.14Å; S1014-D1016 VanDerWaalsContact O-N 3.11Å; S1014-H1017 PolarHBondContact O-N 2.92Å; S1014-H1017 PolarHBondContact OG-N 3.43Å; S1014-I1018 PolarHBondContact O-N 3.19Å
1015	R	85.2	Confident	86.6	Confident	161 Å²	161	68.6 Å²	68.6	61%	0.608	35%	0.351	S	S	*	.	H	α-helix	trans	-51	-37.7	178.5	179.2	177.3	175.3	135	-3.3	112.7	I1018 I1019	R1015-I1018 WeakPolarHBondContact O-CB 3.41Å; R1015-I1018 PolarHBondContact O-N 3.47Å; R1015-I1019 HydrophobicContact CG-CD1 4Å; R1015-I1019 VanDerWaalsContact O-CG1 3.31Å; R1015-I1019 WeakPolarHBondContact O-CG1 3.47Å; R1015-I1019 PolarHBondContact O-N 3.13Å
1016	D	82.4	Confident	86.6	Confident	106 Å²	106	70 Å²	70	57%	0.567	36%	0.355	S	S	*	.	H	α-helix	trans	-73.5	-34.3	-178	-51.7	-46.7	0	0	0	111.8	S1014 I1019 N1020	S1014-D1016 PolarHBondContact O-N 3.14Å; S1014-D1016 VanDerWaalsContact O-N 3.11Å; D1016-I1019 PolarHBondContact O-N 3.42Å; D1016-N1020 WeakPolarHBondContact O-CB 3.16Å; D1016-N1020 PolarHBondContact O-N 3.47Å; D1016-N1020 PolarHBondContact O-ND2 2.9Å
1017	H	85.8	Confident	86.4	Confident	77 Å²	77	77 Å²	77	36%	0.356	39%	0.389	S	S	.	.	H	α-helix	trans	-69.6	-35.6	172.7	-162.4	66.1	0	0	0	111.9	V1013 S1014 I1019 N1020 A1021 S1052	V1013-H1017 HydrophobicContact CG1-CB 3.79Å; S1014-H1017 PolarHBondContact O-N 2.92Å; S1014-H1017 PolarHBondContact OG-N 3.43Å; H1017-I1019 VanDerWaalsContact C-N 3.35Å; H1017-N1020 PolarHBondContact O-N 3.41Å; H1017-A1021 WeakPolarHBondContact O-CB 3.43Å; H1017-A1021 PolarHBondContact O-N 3.43Å; H1017-S1052 PolarHBondContact NE2-OG 3.19Å
1018	I	88.9	Confident	86.2	Confident	3 Å²	3	82.3 Å²	82.3	2%	0.015	40%	0.399	C	S	.	.	H	α-helix	trans	-60.8	-43.4	169	-60.5	176.2	0	0	0	110.9	I1003 L1006 A1007 V1013 S1014 R1015 A1021 L1022 L1049	I1003-I1018 HydrophobicContact CD1-CG2 4.15Å; L1006-I1018 HydrophobicContact CB-CD1 4.32Å; L1006-I1018 HydrophobicContact CB-CG2 3.57Å; L1006-I1018 HydrophobicContact CD1-CG2 3.78Å; L1006-I1018 HydrophobicContact CG-CG2 4.24Å; A1007-I1018 HydrophobicContact CB-CD1 4.36Å; V1013-I1018 HydrophobicContact CB-CG1 4.31Å; V1013-I1018 HydrophobicContact CG1-CG1 3.77Å; S1014-I1018 PolarHBondContact O-N 3.19Å; R1015-I1018 WeakPolarHBondContact O-CB 3.41Å; R1015-I1018 PolarHBondContact O-N 3.47Å; I1018-A1021 PolarHBondContact O-N 3.13Å; I1018-L1022 HydrophobicContact CG2-CD1 4.24Å; I1018-L1022 WeakPolarHBondContact O-CG 3.26Å; I1018-L1022 PolarHBondContact O-N 2.72Å; I1018-L1049 HydrophobicContact CG1-CD1 4.03Å
1019	I	88.6	Confident	85.9	Confident	39 Å²	39	79.7 Å²	79.7	20%	0.2	39%	0.387	C	S	.	.	H	α-helix	trans	-65.6	-41.8	177.2	-71.8	165.6	0	0	0	111.1	I1003 R1015 D1016 H1017 L1022 Q1023	I1003-I1019 HydrophobicContact CD1-CG1 3.84Å; R1015-I1019 HydrophobicContact CG-CD1 4Å; R1015-I1019 VanDerWaalsContact O-CG1 3.31Å; R1015-I1019 WeakPolarHBondContact O-CG1 3.47Å; R1015-I1019 PolarHBondContact O-N 3.13Å; D1016-I1019 PolarHBondContact O-N 3.42Å; H1017-I1019 VanDerWaalsContact C-N 3.35Å; I1019-L1022 WeakPolarHBondContact O-CB 3.41Å; I1019-L1022 PolarHBondContact O-N 2.68Å; I1019-Q1023 WeakPolarHBondContact O-CG 3.42Å; I1019-Q1023 PolarHBondContact O-N 3.38Å
1020	N	88.4	Confident	85.5	Confident	88 Å²	88	84.3 Å²	84.3	47%	0.471	40%	0.402	S	S	.	.	H	α-helix	trans	-62.7	-44.3	176.3	-68.4	-23	0	0	0	111.5	D1016 H1017 L1022 Q1023 E1024	D1016-N1020 WeakPolarHBondContact O-CB 3.16Å; D1016-N1020 PolarHBondContact O-N 3.47Å; D1016-N1020 PolarHBondContact O-ND2 2.9Å; H1017-N1020 PolarHBondContact O-N 3.41Å; N1020-L1022 PolarHBondContact O-N 2.68Å; N1020-Q1023 WeakPolarHBondContact O-CB 3.45Å; N1020-Q1023 PolarHBondContact O-N 2.88Å; N1020-E1024 PolarHBondContact O-N 2.92Å
1021	A	88.8	Confident	85.2	Confident	8 Å²	8	84.3 Å²	84.3	7%	0.066	41%	0.407	C	S	.	.	H	α-helix	trans	-63.4	-39	174.7	0	0	0	0	0	112.3	H1017 I1018 E1024 V1025 T1045 L1048 L1049	H1017-A1021 WeakPolarHBondContact O-CB 3.43Å; H1017-A1021 PolarHBondContact O-N 3.43Å; I1018-A1021 PolarHBondContact O-N 3.13Å; A1021-E1024 WeakPolarHBondContact O-CB 3.41Å; A1021-E1024 PolarHBondContact O-N 2.84Å; A1021-E1024 VanDerWaalsContact O-N 3.17Å; A1021-V1025 WeakPolarHBondContact O-CG2 3.4Å; A1021-V1025 PolarHBondContact O-N 2.81Å; A1021-T1045 HydrophobicContact CB-CG2 3.61Å; A1021-L1048 HydrophobicContact CB-CB 4.41Å; A1021-L1049 HydrophobicContact CB-CD2 3.58Å; A1021-L1049 HydrophobicContact CB-CG 3.99Å
1022	L	89.3	Confident	84.9	Confident	12 Å²	12	84.1 Å²	84.1	6%	0.063	40%	0.396	C	S	.	.	H	α-helix	trans	-63.3	-39.2	172.6	-81	166.2	0	0	0	112.6	F999 I1002 I1003 L1006 I1018 I1019 N1020 E1024 V1025 R1026 I1041 T1045	F999-L1022 HydrophobicContact CE2-CD1 4.29Å; I1002-L1022 HydrophobicContact CG2-CD1 4.04Å; I1002-L1022 HydrophobicContact CG2-CD2 3.6Å; I1002-L1022 HydrophobicContact CG2-CG 4.46Å; I1003-L1022 HydrophobicContact CD1-CD1 3.45Å; I1003-L1022 VanDerWaalsContact CD1-CD1 3.45Å; I1003-L1022 HydrophobicContact CG1-CD1 4.29Å; L1006-L1022 HydrophobicContact CD1-CD1 3.97Å; L1006-L1022 HydrophobicContact CD1-CD2 3.97Å; L1006-L1022 HydrophobicContact CD1-CG 4.01Å; I1018-L1022 HydrophobicContact CG2-CD1 4.24Å; I1018-L1022 WeakPolarHBondContact O-CG 3.26Å; I1018-L1022 PolarHBondContact O-N 2.72Å; I1019-L1022 WeakPolarHBondContact O-CB 3.41Å; I1019-L1022 PolarHBondContact O-N 2.68Å; N1020-L1022 PolarHBondContact O-N 2.68Å; L1022-E1024 VanDerWaalsContact C-N 3.3Å; L1022-V1025 PolarHBondContact O-N 3.34Å; L1022-R1026 WeakPolarHBondContact O-CB 3.35Å; L1022-R1026 PolarHBondContact O-N 3.47Å; L1022-I1041 HydrophobicContact CD2-CG2 3.76Å; L1022-T1045 HydrophobicContact CD2-CG2 4.21Å; L1022-T1045 VanDerWaalsContact CD2-OG1 3.31Å; L1022-T1045 WeakPolarHBondContact CD2-OG1 3.46Å; L1022-T1045 HydrophobicContact CG-CG2 3.96Å
1023	Q	87.6	Confident	84.6	Confident	85 Å²	85	76.7 Å²	76.7	40%	0.397	36%	0.362	S	S	.	.	H	α-helix	trans	-63.5	-38.4	172.4	-70.7	179.4	29.8	0	0	110.9	I1019 N1020 R1026 M1027	I1019-Q1023 WeakPolarHBondContact O-CG 3.42Å; I1019-Q1023 PolarHBondContact O-N 3.38Å; N1020-Q1023 WeakPolarHBondContact O-CB 3.45Å; N1020-Q1023 PolarHBondContact O-N 2.88Å; Q1023-R1026 WeakPolarHBondContact O-CB 3.42Å; Q1023-R1026 PolarHBondContact O-N 3.15Å; Q1023-M1027 VanDerWaalsContact O-CG 3.31Å; Q1023-M1027 WeakPolarHBondContact O-CG 3.49Å; Q1023-M1027 PolarHBondContact O-N 2.63Å
1024	E	87.4	Confident	84	Confident	83 Å²	83	81.5 Å²	81.5	39%	0.388	39%	0.386	S	S	.	.	H	α-helix	trans	-66.9	-43.5	176.1	-153.7	-157.6	142.3	0	0	112.6	N1020 A1021 L1022 R1026 M1027 R1028 L1048	N1020-E1024 PolarHBondContact O-N 2.92Å; A1021-E1024 WeakPolarHBondContact O-CB 3.41Å; A1021-E1024 PolarHBondContact O-N 2.84Å; A1021-E1024 VanDerWaalsContact O-N 3.17Å; L1022-E1024 VanDerWaalsContact C-N 3.3Å; E1024-R1026 VanDerWaalsContact C-N 3.28Å; E1024-R1026 PolarHBondContact O-N 2.87Å; E1024-M1027 PolarHBondContact O-N 3.14Å; E1024-R1028 WeakPolarHBondContact O-CG 3.11Å; E1024-R1028 PolarHBondContact O-N 3.3Å; E1024-R1028 IonicContact OE1-CZ 2.78Å; E1024-R1028 IonicContact OE1-NE 3.74Å; E1024-R1028 PolarHBondContact OE1-NE 2.99Å; E1024-R1028 IonicContact OE1-NH2 3.8Å; E1024-R1028 PolarHBondContact OE1-NH2 3.46Å; E1024-L1048 HydrophobicContact CB-CD1 3.93Å; E1024-L1048 HydrophobicContact CG-CD1 4.33Å
1025	V	87.3	Confident	83.4	Confident	1 Å²	1	82.2 Å²	82.2	1%	0.006	41%	0.405	C	S	.	.	H	α-helix	trans	-59.1	-41.8	171.8	-178.6	0	0	0	0	110.5	A1021 L1022 M1027 R1028 H1029 L1033 M1044 L1048	A1021-V1025 WeakPolarHBondContact O-CG2 3.4Å; A1021-V1025 PolarHBondContact O-N 2.81Å; L1022-V1025 PolarHBondContact O-N 3.34Å; V1025-M1027 PolarHBondContact O-N 3.36Å; V1025-R1028 PolarHBondContact O-N 3.5Å; V1025-H1029 PolarHBondContact O-CD2 2.84Å; V1025-H1029 PolarHBondContact O-N 2.76Å; V1025-L1033 HydrophobicContact CG1-CD2 3.88Å; V1025-M1044 HydrophobicContact CG1-CB 4.07Å; V1025-M1044 HydrophobicContact CG2-CB 4.18Å; V1025-L1048 HydrophobicContact CG2-CD1 3.59Å; V1025-L1048 HydrophobicContact CG2-CG 4.43Å
1026	R	87.9	Confident	83.1	Confident	111 Å²	111	77.1 Å²	77.1	42%	0.419	39%	0.39	S	S	.	.	H	α-helix	trans	-61.7	-40.7	175.8	-177.2	-178.2	176.9	-159.6	-7.5	112.3	L1022 Q1023 E1024 H1029 G1031 L1033	L1022-R1026 WeakPolarHBondContact O-CB 3.35Å; L1022-R1026 PolarHBondContact O-N 3.47Å; Q1023-R1026 WeakPolarHBondContact O-CB 3.42Å; Q1023-R1026 PolarHBondContact O-N 3.15Å; E1024-R1026 VanDerWaalsContact C-N 3.28Å; E1024-R1026 PolarHBondContact O-N 2.87Å; R1026-H1029 CarbonylContact O-C 3.56Å; R1026-H1029 PolarHBondContact O-N 2.91Å; R1026-G1031 WeakPolarHBondContact CG-O 3.21Å; R1026-G1031 PolarHBondContact NE-O 3.41Å; R1026-G1031 PolarHBondContact NH2-O 2.7Å; R1026-G1031 VanDerWaalsContact O-CA 3.27Å; R1026-G1031 WeakPolarHBondContact O-CA 3.36Å; R1026-G1031 PolarHBondContact O-N 3.15Å; R1026-L1033 HydrophobicContact CB-CD1 4.29Å; R1026-L1033 HydrophobicContact CB-CD2 4.28Å; R1026-L1033 HydrophobicContact CB-CG 4.13Å; R1026-L1033 HydrophobicContact CG-CG 4.38Å
1027	M	85.8	Confident	83.2	Confident	147 Å²	147	75 Å²	75	72%	0.724	38%	0.383	S	S	*	.	H	α-helix	trans	-67.1	-42.2	175.5	-70.6	-62.3	-73.6	0	0	111.8	Q1023 E1024 V1025 H1029 K1030	Q1023-M1027 VanDerWaalsContact O-CG 3.31Å; Q1023-M1027 WeakPolarHBondContact O-CG 3.49Å; Q1023-M1027 PolarHBondContact O-N 2.63Å; E1024-M1027 PolarHBondContact O-N 3.14Å; V1025-M1027 PolarHBondContact O-N 3.36Å; M1027-H1029 PolarHBondContact O-N 2.78Å; M1027-K1030 PolarHBondContact O-N 3.47Å
1028	R	83.7	Confident	83.2	Confident	158 Å²	158	73.7 Å²	73.7	60%	0.596	38%	0.379	S	S	*	.	H	α-helix	trans	-60.2	-32	173.2	-69.4	171.1	178.7	-128.4	6	112	E1024 V1025 K1030	E1024-R1028 WeakPolarHBondContact O-CG 3.11Å; E1024-R1028 PolarHBondContact O-N 3.3Å; E1024-R1028 IonicContact OE1-CZ 2.78Å; E1024-R1028 IonicContact OE1-NE 3.74Å; E1024-R1028 PolarHBondContact OE1-NE 2.99Å; E1024-R1028 IonicContact OE1-NH2 3.8Å; E1024-R1028 PolarHBondContact OE1-NH2 3.46Å; V1025-R1028 PolarHBondContact O-N 3.5Å; R1028-K1030 PolarHBondContact O-N 2.78Å
1029	H	82.2	Confident	83	Confident	63 Å²	63	77.3 Å²	77.3	29%	0.292	40%	0.398	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.2	46.9	175.8	-76.8	-93.1	0	0	0	114.4	V1025 R1026 M1027 G1031 F1032 L1033 M1044	V1025-H1029 PolarHBondContact O-CD2 2.84Å; V1025-H1029 PolarHBondContact O-N 2.76Å; R1026-H1029 CarbonylContact O-C 3.56Å; R1026-H1029 PolarHBondContact O-N 2.91Å; M1027-H1029 PolarHBondContact O-N 2.78Å; H1029-G1031 PolarHBondContact O-N 3.05Å; H1029-F1032 WeakPolarHBondContact CB-O 3.43Å; H1029-F1032 PolarHBondContact O-N 2.82Å; H1029-L1033 HydrophobicContact CB-CD2 4.3Å; H1029-M1044 WeakPolarHBondContact NE2-CE 3.14Å
1030	K	77	Confident	82.8	Confident	202 Å²	202	77.7 Å²	77.7	88%	0.878	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	23.9	171.7	-53.5	180	-179.9	177.9	0	114.8	M1027 R1028	M1027-K1030 PolarHBondContact O-N 3.47Å; R1028-K1030 PolarHBondContact O-N 2.78Å
1031	G	76.4	Confident	82.8	Confident	19 Å²	19	73.9 Å²	73.9	20%	0.196	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	88.9	0.8	-179.7	0	0	0	0	0	115.8	R1026 H1029	R1026-G1031 WeakPolarHBondContact CG-O 3.21Å; R1026-G1031 PolarHBondContact NE-O 3.41Å; R1026-G1031 PolarHBondContact NH2-O 2.7Å; R1026-G1031 VanDerWaalsContact O-CA 3.27Å; R1026-G1031 WeakPolarHBondContact O-CA 3.36Å; R1026-G1031 PolarHBondContact O-N 3.15Å; H1029-G1031 PolarHBondContact O-N 3.05Å
1032	F	75.4	Confident	82.8	Confident	105 Å²	105	73.8 Å²	73.8	46%	0.461	38%	0.38	S	S	.	.			trans	-137.5	141.2	-177.5	-61	-83.8	0	0	0	112.5	H1029	H1029-F1032 WeakPolarHBondContact CB-O 3.43Å; H1029-F1032 PolarHBondContact O-N 2.82Å
1033	L	77.9	Confident	82.7	Confident	36 Å²	36	78.4 Å²	78.4	19%	0.188	40%	0.402	C	S	.	.			trans	-105.9	5.6	173.5	-60.6	176.7	0	0	0	112.4	V1025 R1026 H1029 L1036 I1041	V1025-L1033 HydrophobicContact CG1-CD2 3.88Å; R1026-L1033 HydrophobicContact CB-CD1 4.29Å; R1026-L1033 HydrophobicContact CB-CD2 4.28Å; R1026-L1033 HydrophobicContact CB-CG 4.13Å; R1026-L1033 HydrophobicContact CG-CG 4.38Å; H1029-L1033 HydrophobicContact CB-CD2 4.3Å; L1033-L1036 HydrophobicContact CD2-CD1 4.16Å; L1033-L1036 PolarHBondContact O-N 3.05Å; L1033-I1041 HydrophobicContact CB-CD1 4Å; L1033-I1041 HydrophobicContact CB-CG1 4.47Å; L1033-I1041 HydrophobicContact CD1-CG2 4.04Å
1034	N	71.9	Confident	82.6	Confident	135 Å²	135	77.5 Å²	77.5	72%	0.722	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.9	134.8	179.8	-65	-4.2	0	0	0	110
1035	G	73.8	Confident	82.7	Confident	87 Å²	87	73.5 Å²	73.5	90%	0.897	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	91.2	-12.3	-175.7	0	0	0	0	0	115
1036	L	79.1	Confident	82.8	Confident	54 Å²	54	74.1 Å²	74.1	28%	0.283	38%	0.383	S	S	.	.	S	Bend	trans	-85.2	149.4	168.6	-63.8	177.7	0	0	0	111.1	L1033 I1041	L1033-L1036 HydrophobicContact CD2-CD1 4.16Å; L1033-L1036 PolarHBondContact O-N 3.05Å; L1036-I1041 HydrophobicContact CB-CD1 4.04Å; L1036-I1041 HydrophobicContact CB-CG1 3.75Å; L1036-I1041 HydrophobicContact CD1-CG1 4.1Å
1037	S	84.3	Confident	82.7	Confident	61 Å²	61	71.9 Å²	71.9	43%	0.427	39%	0.385	S	S	.	.			trans	-72.7	152.3	171.6	94.9	0	0	0	0	111.2	N1039 T1040 I1041	S1037-N1039 PolarHBondContact O-N 3.28Å; S1037-N1039 PolarHBondContact OG-N 3.07Å; S1037-T1040 PolarHBondContact O-N 2.8Å; S1037-T1040 PolarHBondContact OG-N 3.41Å; S1037-T1040 PolarHBondContact OG-OG1 2.95Å; S1037-I1041 WeakPolarHBondContact O-CG1 3.48Å; S1037-I1041 PolarHBondContact O-N 2.93Å
1038	I	84.9	Confident	82.7	Confident	51 Å²	51	65.8 Å²	65.8	26%	0.262	36%	0.355	S	S	.	.	H	α-helix	trans	-56	-40.3	175.5	-71.4	172.8	0	0	0	111.2	K1001 I1002 V1042	K1001-I1038 HydrophobicContact CD-CD1 4.23Å; I1002-I1038 HydrophobicContact CG1-CG1 4.48Å; I1002-I1038 HydrophobicContact CG1-CG2 3.9Å; I1038-V1042 VanDerWaalsContact O-CG2 3.24Å; I1038-V1042 WeakPolarHBondContact O-CG2 3.31Å; I1038-V1042 PolarHBondContact O-N 2.68Å; I1038-V1042 VanDerWaalsContact O-N 3.13Å
1039	N	84.9	Confident	82.8	Confident	78 Å²	78	58.3 Å²	58.3	42%	0.417	33%	0.327	S	S	.	.	H	α-helix	trans	-67.4	-44.4	179.3	-67.9	-7.6	0	0	0	110.9	K1005 S1037 I1041 V1042 E1043	K1005-N1039 PolarHBondContact NZ-OD1 3.07Å; S1037-N1039 PolarHBondContact O-N 3.28Å; S1037-N1039 PolarHBondContact OG-N 3.07Å; N1039-I1041 VanDerWaalsContact C-N 3.34Å; N1039-I1041 PolarHBondContact O-N 3.09Å; N1039-V1042 CarbonylContact O-C 3.37Å; N1039-V1042 WeakPolarHBondContact O-CA 3.25Å; N1039-V1042 WeakPolarHBondContact O-CB 3.38Å; N1039-V1042 PolarHBondContact O-N 3.18Å; N1039-E1043 WeakPolarHBondContact O-CG 3.09Å; N1039-E1043 PolarHBondContact O-N 2.91Å
1040	T	85.7	Confident	82.8	Confident	48 Å²	48	62 Å²	62	29%	0.294	34%	0.342	S	S	.	.	H	α-helix	trans	-59.7	-42.3	177.8	-47	0	0	0	0	112	S1037 V1042 E1043 M1044	S1037-T1040 PolarHBondContact O-N 2.8Å; S1037-T1040 PolarHBondContact OG-N 3.41Å; S1037-T1040 PolarHBondContact OG-OG1 2.95Å; T1040-V1042 VanDerWaalsContact C-N 3.33Å; T1040-V1042 PolarHBondContact O-N 2.92Å; T1040-E1043 PolarHBondContact O-N 2.57Å; T1040-M1044 HydrophobicContact CG2-SD 4.36Å; T1040-M1044 WeakPolarHBondContact O-CB 3.13Å; T1040-M1044 VanDerWaalsContact O-CG 3.29Å; T1040-M1044 WeakPolarHBondContact O-CG 3.33Å; T1040-M1044 PolarHBondContact O-N 3.21Å
1041	I	88.3	Confident	82.5	Confident	8 Å²	8	57.7 Å²	57.7	4%	0.041	33%	0.329	C	S	.	.	H	α-helix	trans	-62.6	-42.3	175.1	-62.9	162.9	0	0	0	110.7	I1002 L1022 L1033 L1036 S1037 N1039 T1045	I1002-I1041 HydrophobicContact CD1-CB 4.39Å; I1002-I1041 HydrophobicContact CD1-CD1 3.93Å; I1002-I1041 HydrophobicContact CD1-CG2 4.1Å; I1002-I1041 HydrophobicContact CG2-CG2 4.08Å; L1022-I1041 HydrophobicContact CD2-CG2 3.76Å; L1033-I1041 HydrophobicContact CB-CD1 4Å; L1033-I1041 HydrophobicContact CB-CG1 4.47Å; L1033-I1041 HydrophobicContact CD1-CG2 4.04Å; L1036-I1041 HydrophobicContact CB-CD1 4.04Å; L1036-I1041 HydrophobicContact CB-CG1 3.75Å; L1036-I1041 HydrophobicContact CD1-CG1 4.1Å; S1037-I1041 WeakPolarHBondContact O-CG1 3.48Å; S1037-I1041 PolarHBondContact O-N 2.93Å; N1039-I1041 VanDerWaalsContact C-N 3.34Å; N1039-I1041 PolarHBondContact O-N 3.09Å; I1041-T1045 WeakPolarHBondContact O-CB 3.43Å; I1041-T1045 PolarHBondContact O-N 3.21Å; I1041-T1045 PolarHBondContact O-OG1 2.8Å
1042	V	88.2	Confident	81.9	Confident	6 Å²	6	59.2 Å²	59.2	4%	0.036	34%	0.337	C	S	.	.	H	α-helix	trans	-65.8	-42.1	177.5	168.7	0	0	0	0	111.5	I1002 K1005 L1006 L1009 I1038 N1039 T1040 S1046	I1002-V1042 HydrophobicContact CB-CG2 4.4Å; I1002-V1042 HydrophobicContact CG1-CG2 4.36Å; I1002-V1042 HydrophobicContact CG2-CG2 4.13Å; K1005-V1042 HydrophobicContact CB-CG1 4.21Å; K1005-V1042 HydrophobicContact CB-CG2 3.93Å; K1005-V1042 HydrophobicContact CD-CG2 4.33Å; L1006-V1042 HydrophobicContact CD2-CG1 4Å; L1006-V1042 HydrophobicContact CG-CG1 4.19Å; L1006-V1042 HydrophobicContact CG-CG2 4.21Å; L1009-V1042 HydrophobicContact CD1-CG1 3.49Å; L1009-V1042 VanDerWaalsContact CD1-CG1 3.49Å; I1038-V1042 VanDerWaalsContact O-CG2 3.24Å; I1038-V1042 WeakPolarHBondContact O-CG2 3.31Å; I1038-V1042 PolarHBondContact O-N 2.68Å; I1038-V1042 VanDerWaalsContact O-N 3.13Å; N1039-V1042 CarbonylContact O-C 3.37Å; N1039-V1042 WeakPolarHBondContact O-CA 3.25Å; N1039-V1042 WeakPolarHBondContact O-CB 3.38Å; N1039-V1042 PolarHBondContact O-N 3.18Å; T1040-V1042 VanDerWaalsContact C-N 3.33Å; T1040-V1042 PolarHBondContact O-N 2.92Å; V1042-S1046 WeakPolarHBondContact O-CB 3.25Å; V1042-S1046 PolarHBondContact O-N 3.15Å; V1042-S1046 PolarHBondContact O-OG 2.93Å
1043	E	87	Confident	81.1	Confident	109 Å²	109	58.2 Å²	58.2	51%	0.509	35%	0.347	S	S	.	.	H	α-helix	trans	-64.8	-47	177.7	-73.4	152.7	-159.6	0	0	112.2	N1039 T1040 S1046 S1047	N1039-E1043 WeakPolarHBondContact O-CG 3.09Å; N1039-E1043 PolarHBondContact O-N 2.91Å; T1040-E1043 PolarHBondContact O-N 2.57Å; E1043-S1046 WeakPolarHBondContact O-CB 3.44Å; E1043-S1046 PolarHBondContact O-N 2.88Å; E1043-S1047 PolarHBondContact O-N 3.41Å; E1043-S1047 PolarHBondContact O-OG 2.88Å
1044	M	86.6	Confident	79.8	Confident	65 Å²	65	61.5 Å²	61.5	32%	0.32	37%	0.373	S	S	.	.	H	α-helix	trans	-63.5	-43.2	177.6	-69.1	-170.6	73	0	0	111.5	V1025 H1029 T1040 S1047 L1048	V1025-M1044 HydrophobicContact CG1-CB 4.07Å; V1025-M1044 HydrophobicContact CG2-CB 4.18Å; H1029-M1044 WeakPolarHBondContact NE2-CE 3.14Å; T1040-M1044 HydrophobicContact CG2-SD 4.36Å; T1040-M1044 WeakPolarHBondContact O-CB 3.13Å; T1040-M1044 VanDerWaalsContact O-CG 3.29Å; T1040-M1044 WeakPolarHBondContact O-CG 3.33Å; T1040-M1044 PolarHBondContact O-N 3.21Å; M1044-S1047 WeakPolarHBondContact O-CB 3.13Å; M1044-S1047 PolarHBondContact O-N 2.79Å; M1044-L1048 PolarHBondContact O-N 3.18Å
1045	T	89.3	Confident	78.4	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-65.7	-43.8	175.6	-49.7	0	0	0	0	111.1	L1006 A1021 L1022 I1041 S1047 L1048 L1049	L1006-T1045 HydrophobicContact CD1-CG2 3.81Å; L1006-T1045 HydrophobicContact CD2-CG2 4Å; A1021-T1045 HydrophobicContact CB-CG2 3.61Å; L1022-T1045 HydrophobicContact CD2-CG2 4.21Å; L1022-T1045 VanDerWaalsContact CD2-OG1 3.31Å; L1022-T1045 WeakPolarHBondContact CD2-OG1 3.46Å; L1022-T1045 HydrophobicContact CG-CG2 3.96Å; I1041-T1045 WeakPolarHBondContact O-CB 3.43Å; I1041-T1045 PolarHBondContact O-N 3.21Å; I1041-T1045 PolarHBondContact O-OG1 2.8Å; T1045-S1047 PolarHBondContact O-N 2.88Å; T1045-L1048 PolarHBondContact O-N 3.12Å; T1045-L1048 VanDerWaalsContact O-N 3.07Å; T1045-L1049 HydrophobicContact CG2-CD1 4.3Å; T1045-L1049 HydrophobicContact CG2-CG 4.4Å; T1045-L1049 WeakPolarHBondContact O-CG 3.29Å; T1045-L1049 PolarHBondContact O-N 3.43Å
1046	S	88.3	Confident	78.6	Confident	13 Å²	13	61.6 Å²	61.6	9%	0.091	37%	0.368	C	S	.	.	H	α-helix	trans	-58.1	-32.6	176.8	-66.2	0	0	0	0	113	H1010 V1042 E1043 K1050	H1010-S1046 WeakPolarHBondContact NE2-CA 3.47Å; H1010-S1046 WeakPolarHBondContact NE2-CB 3.48Å; H1010-S1046 PolarHBondContact NE2-OG 3.3Å; V1042-S1046 WeakPolarHBondContact O-CB 3.25Å; V1042-S1046 PolarHBondContact O-N 3.15Å; V1042-S1046 PolarHBondContact O-OG 2.93Å; E1043-S1046 WeakPolarHBondContact O-CB 3.44Å; E1043-S1046 PolarHBondContact O-N 2.88Å; S1046-K1050 WeakPolarHBondContact O-CB 3.43Å; S1046-K1050 WeakPolarHBondContact O-CG 3.16Å; S1046-K1050 PolarHBondContact O-N 3.11Å
1047	S	86.3	Confident	78.6	Confident	64 Å²	64	62 Å²	62	45%	0.448	37%	0.373	S	S	.	.	H	α-helix	trans	-70.6	-40.7	176.8	-57.1	0	0	0	0	111.5	E1043 M1044 T1045 N1051	E1043-S1047 PolarHBondContact O-N 3.41Å; E1043-S1047 PolarHBondContact O-OG 2.88Å; M1044-S1047 WeakPolarHBondContact O-CB 3.13Å; M1044-S1047 PolarHBondContact O-N 2.79Å; T1045-S1047 PolarHBondContact O-N 2.88Å; S1047-N1051 WeakPolarHBondContact O-CB 3.36Å; S1047-N1051 PolarHBondContact O-N 3.37Å; S1047-N1051 VanDerWaalsContact O-N 3.07Å; S1047-N1051 PolarHBondContact O-ND2 2.58Å; S1047-N1051 PolarHBondContact O-OD1 3.11Å
1048	L	85.9	Confident	78.3	Confident	19 Å²	19	62.1 Å²	62.1	10%	0.099	37%	0.37	C	S	.	.	H	α-helix	trans	-65.3	-43.5	173	-59.8	-177.6	0	0	0	111.7	A1021 E1024 V1025 M1044 T1045 N1051 S1052	A1021-L1048 HydrophobicContact CB-CB 4.41Å; E1024-L1048 HydrophobicContact CB-CD1 3.93Å; E1024-L1048 HydrophobicContact CG-CD1 4.33Å; V1025-L1048 HydrophobicContact CG2-CD1 3.59Å; V1025-L1048 HydrophobicContact CG2-CG 4.43Å; M1044-L1048 PolarHBondContact O-N 3.18Å; T1045-L1048 PolarHBondContact O-N 3.12Å; T1045-L1048 VanDerWaalsContact O-N 3.07Å; L1048-N1051 PolarHBondContact O-N 3.08Å; L1048-S1052 WeakPolarHBondContact O-CB 3.49Å; L1048-S1052 PolarHBondContact O-N 3.31Å; L1048-S1052 PolarHBondContact O-OG 2.92Å
1049	L	85.6	Confident	77.9	Confident	1 Å²	1	62.7 Å²	62.7	1%	0.005	38%	0.376	C	S	.	.	H	α-helix	trans	-60.2	-49.5	178.3	-68.2	179.4	0	0	0	111.8	L1006 H1010 V1013 I1018 A1021 T1045 N1051 S1052 A1053	L1006-L1049 HydrophobicContact CD2-CD1 4.31Å; H1010-L1049 HydrophobicContact CB-CD1 4.35Å; V1013-L1049 HydrophobicContact CG1-CD2 3.94Å; I1018-L1049 HydrophobicContact CG1-CD1 4.03Å; A1021-L1049 HydrophobicContact CB-CD2 3.58Å; A1021-L1049 HydrophobicContact CB-CG 3.99Å; T1045-L1049 HydrophobicContact CG2-CD1 4.3Å; T1045-L1049 HydrophobicContact CG2-CG 4.4Å; T1045-L1049 WeakPolarHBondContact O-CG 3.29Å; T1045-L1049 PolarHBondContact O-N 3.43Å; L1049-N1051 VanDerWaalsContact C-N 3.34Å; L1049-N1051 PolarHBondContact O-N 3.46Å; L1049-S1052 PolarHBondContact O-N 3.19Å; L1049-S1052 VanDerWaalsContact O-N 3.11Å; L1049-S1052 PolarHBondContact O-OG 2.94Å; L1049-A1053 PolarHBondContact O-N 3.29Å
1050	K	82.6	Confident	77.4	Confident	140 Å²	140	61.8 Å²	61.8	61%	0.609	37%	0.373	S	S	*	.	H	α-helix	trans	-60.3	-40.4	175.8	-75.8	174.2	176.9	-176.4	0	112.9	S1046 S1052 A1053 S1054	S1046-K1050 WeakPolarHBondContact O-CB 3.43Å; S1046-K1050 WeakPolarHBondContact O-CG 3.16Å; S1046-K1050 PolarHBondContact O-N 3.11Å; K1050-S1052 VanDerWaalsContact C-N 3.33Å; K1050-S1052 PolarHBondContact O-N 2.92Å; K1050-A1053 PolarHBondContact O-N 3.2Å; K1050-S1054 PolarHBondContact O-N 3.16Å
1051	N	71.4	Confident	76.9	Confident	112 Å²	112	62.7 Å²	62.7	60%	0.599	38%	0.379	S	S	*	.	H	α-helix	trans	-66.6	-35.1	175.8	-68	-14.5	0	0	0	111.9	S1047 L1048 L1049 A1053 S1054	S1047-N1051 WeakPolarHBondContact O-CB 3.36Å; S1047-N1051 PolarHBondContact O-N 3.37Å; S1047-N1051 VanDerWaalsContact O-N 3.07Å; S1047-N1051 PolarHBondContact O-ND2 2.58Å; S1047-N1051 PolarHBondContact O-OD1 3.11Å; L1048-N1051 PolarHBondContact O-N 3.08Å; L1049-N1051 VanDerWaalsContact C-N 3.34Å; L1049-N1051 PolarHBondContact O-N 3.46Å; N1051-A1053 VanDerWaalsContact C-N 3.34Å; N1051-S1054 PolarHBondContact O-N 2.62Å
1052	S	63.3	Low	76.1	Confident	52 Å²	52	66.6 Å²	66.6	36%	0.364	40%	0.403	S	S	.	.	H	α-helix	trans	-73.5	-21.8	177.3	73.9	0	0	0	0	114.3	H1017 L1048 L1049 K1050 S1054	H1017-S1052 PolarHBondContact NE2-OG 3.19Å; L1048-S1052 WeakPolarHBondContact O-CB 3.49Å; L1048-S1052 PolarHBondContact O-N 3.31Å; L1048-S1052 PolarHBondContact O-OG 2.92Å; L1049-S1052 PolarHBondContact O-N 3.19Å; L1049-S1052 VanDerWaalsContact O-N 3.11Å; L1049-S1052 PolarHBondContact O-OG 2.94Å; K1050-S1052 VanDerWaalsContact C-N 3.33Å; K1050-S1052 PolarHBondContact O-N 2.92Å; S1052-S1054 VanDerWaalsContact C-N 3.34Å
1053	A	58.4	Low	75.1	Confident	83 Å²	83	71.2 Å²	71.2	69%	0.686	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	-2.1	173.3	0	0	0	0	0	113.4	L1049 K1050 N1051	L1049-A1053 PolarHBondContact O-N 3.29Å; K1050-A1053 PolarHBondContact O-N 3.2Å; N1051-A1053 VanDerWaalsContact C-N 3.34Å
1054	S	50.8	Low	74.2	Confident	105 Å²	105	68.1 Å²	68.1	73%	0.734	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.5	18.5	-178.7	-175	0	0	0	0	112.7	K1050 N1051 S1052	K1050-S1054 PolarHBondContact O-N 3.16Å; N1051-S1054 PolarHBondContact O-N 2.62Å; S1052-S1054 VanDerWaalsContact C-N 3.34Å
1055	S	41.5	Very low	73	Confident	163 Å²	163	68.4 Å²	68.4	100%	1.14	43%	0.434	S	S	*	.			trans	-135	0	-178.4	-175.1	0	0	0	0	112.2

Retrieved 1,055 of 1,055 residues in 114.6 ms (Link to these results)

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