A0A087YF27_POEFO Loading...

Plakophilin 2

AlphaFold DB , UniProt , Accession A0A087YF27, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 819 aa.

						>A0A087YF27_POEFO|A0A087YF27
MEKKIKLRPSEILSQQHTSLASPTEPTPKSNMTGAARNRTQPSLRKNGVSNGGDDSQHSIRSLYGSPSSTKGNGYNLDNLSSKSTQPQKMSMSPTAGMDQTVCVLVDWSDHVHLLHQSAVSESSPSAPTRASTHPPGKSRTNSLTPQSVRTKNPSGSAAGRDSLRNGQSQKHSYVKPGTQMVQWLRSTHMDRGLPQQAQISQRWESGRSISTNRFTNRFTNRQDVKTMKNRAQQSAEKLPEMTIKTAVKLLDKKNEKELISAAAYIQSQCFKKDVARFEVRWAHGAKKLVQLLKNDSEEVQRAAAAALRNVVYKDKGNKKEVTDENGLTIILNLLDKTHDKETVCQLAGVLWNLSSVDEIKDLFNENFLHVLTKVILVPFSHINGEAECKHDLIADPKAFLCATACLRNLSSDDNHRRNMRSCENLIDSLASCTTEAATKRTPDENLTENCVCILQNLTYEAEEDWIRQTTKNTEETQKNTTPKEMTCSCFPRRRANLEEDAKDKGEAEMMCLLQNNEDPLGVKWLWSGQLVRAYLSLLACSTNKMTLQATMGALQNLTVRKGEISESVARIIAEEKGPRKITAVLEKNITLKKPALLLMRNLSRFPELHPSIFDNLVATETTKSLLHLLDISAEESAELMPILCRILVNLSKNNVETAQRISRETAVNDMLQKKYEGKAKEAVEELRATLSPRSSHQHLEEDKTKNAKLLNLLPKSLQCRTGAKHEEIPSTIRYTKHHFFPLGVIFVLLFVVVHKEIWDEMFKLFMPFLVGVIEMIAKHFLGNHNEVSIPSHCSISKLELFLAKIMPALKKKIYIYIV
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	31.8	Very low	33	Very low	247 Å²	247	171.1 Å²	171.1	100%	1.217	82%	0.82	S	S	*	*				0	80.5	0	-80.4	169	151.9	0	0	108.2
2	E	36.2	Very low	33.1	Very low	191 Å²	191	167.9 Å²	167.9	89%	0.893	81%	0.809	S	S	*	*			trans	-138.5	104.6	-173.7	-66.8	-174.2	130.1	0	0	111.2
3	K	28	Very low	32.9	Very low	192 Å²	192	165.7 Å²	165.7	84%	0.835	80%	0.803	S	S	*	*			trans	-143.3	113.1	164.3	-85.8	-173.9	-179.8	170.7	0	110.6
4	K	32.9	Very low	32.6	Very low	182 Å²	182	160.9 Å²	160.9	79%	0.791	80%	0.795	S	S	*	*				46	126.8	127.7	-57.3	-179.5	176.9	-173	0	118.3
5	I	28.8	Very low	32.4	Very low	157 Å²	157	159.4 Å²	159.4	81%	0.805	79%	0.785	S	S	*	*				-166.3	116.5	111	-95.7	148.5	0	0	0	105.8
6	K	29.3	Very low	32.3	Very low	175 Å²	175	158.4 Å²	158.4	76%	0.761	78%	0.778	S	S	*	*				78	100.9	56.5	-169.5	-160	-173.7	-168.3	0	111.6
7	L	25.4	Very low	32.1	Very low	153 Å²	153	158.7 Å²	158.7	80%	0.801	78%	0.776	S	S	*	*				170.8	112.7	129.8	-89.8	160.4	0	0	0	113
8	R	37.2	Very low	31.9	Very low	235 Å²	235	156.9 Å²	156.9	89%	0.887	78%	0.776	S	S	*	*			trans	-97.4	163.1	133.2	-113.1	-171.2	-164.5	-164.3	6.5	105.6
9	P	45.9	Very low	31.6	Very low	100 Å²	100	153.3 Å²	153.3	65%	0.649	77%	0.768	S	S	*	*				-145.1	163.9	53.4	46.4	-26.9	0	0	0	114.5
10	S	33.3	Very low	31.4	Very low	94 Å²	94	154 Å²	154	66%	0.657	77%	0.773	S	S	*	*				74.7	153.3	108.2	74.4	0	0	0	0	114.3
11	E	34.1	Very low	31.3	Very low	156 Å²	156	151.2 Å²	151.2	73%	0.729	77%	0.774	S	S	*	*			cis	-146.8	140.7	39.5	-79.3	-160	140.8	0	0	111.6
12	I	34.1	Very low	31.1	Very low	133 Å²	133	144.9 Å²	144.9	68%	0.682	75%	0.754	S	S	*	*				73.7	135.6	98.4	-64.5	175.9	0	0	0	112.5
13	L	30.7	Very low	31.8	Very low	139 Å²	139	141.2 Å²	141.2	73%	0.728	75%	0.747	S	S	*	*			cis	-146.8	-178.9	-3.2	-113.6	167.1	0	0	0	105.8	Q15	L13-Q15 HydrophobicContact CD2-CB 4.3Å; L13-Q15 HydrophobicContact CD2-CG 4.38Å
14	S	28.3	Very low	31.9	Very low	99 Å²	99	139 Å²	139	69%	0.692	75%	0.75	S	S	*	*			cis	-142	179.8	4.6	66.7	0	0	0	0	108.8
15	Q	30.6	Very low	31.9	Very low	138 Å²	138	139 Å²	139	65%	0.645	75%	0.753	S	S	*	*			cis	74	132.3	19.3	-61.6	-164.3	-6.1	0	0	115.7	L13	L13-Q15 HydrophobicContact CD2-CB 4.3Å; L13-Q15 HydrophobicContact CD2-CG 4.38Å
16	Q	30	Very low	32.8	Very low	144 Å²	144	137 Å²	137	67%	0.673	75%	0.75	S	S	*	*			cis	-150.3	152.6	-3.2	-109.3	164	-0.9	0	0	108.1
17	H	29.9	Very low	33	Very low	163 Å²	163	134.6 Å²	134.6	76%	0.755	75%	0.75	S	S	*	*				39	139.4	92.6	-64.3	-101.5	0	0	0	115.4
18	T	28	Very low	34.1	Very low	126 Å²	126	131.9 Å²	131.9	77%	0.773	74%	0.742	S	S	*	*			cis	-160.4	-160.4	-4.5	18.7	0	0	0	0	106.9
19	S	26.9	Very low	33.7	Very low	88 Å²	88	130 Å²	130	62%	0.615	74%	0.74	S	S	*	*			cis	-166.1	156.1	15.7	59.3	0	0	0	0	113.6
20	L	27.4	Very low	33	Very low	167 Å²	167	129.8 Å²	129.8	87%	0.874	74%	0.741	S	S	*	*			trans	70.7	158.2	143	-79.8	157.9	0	0	0	122.5
21	A	27.9	Very low	32.8	Very low	96 Å²	96	131.9 Å²	131.9	79%	0.793	74%	0.744	S	S	*	*			trans	75.5	94.5	155.6	0	0	0	0	0	120.9
22	S	27.7	Very low	32.5	Very low	115 Å²	115	132.4 Å²	132.4	80%	0.804	75%	0.749	S	S	*	*			trans	-96.9	177.6	139.8	49.1	0	0	0	0	109.4
23	P	51.7	Low	32.4	Very low	114 Å²	114	132.6 Å²	132.6	74%	0.74	76%	0.757	S	S	*	*			cis	-131.1	162	-9.3	39.2	-24.3	0	0	0	115
24	T	29.9	Very low	32.3	Very low	146 Å²	146	129.7 Å²	129.7	90%	0.896	76%	0.76	S	S	*	*			trans	-160.8	130.1	154.5	7.7	0	0	0	0	114.5
25	E	32.7	Very low	32.4	Very low	181 Å²	181	129.6 Å²	129.6	85%	0.846	77%	0.766	S	S	*	*			trans	-97.3	173.8	149.4	-68.4	-167.6	139.6	0	0	108.3
26	P	46.8	Very low	32.4	Very low	115 Å²	115	127.5 Å²	127.5	75%	0.747	77%	0.772	S	S	*	*			cis	-134	-169.9	7.3	39.3	-18.8	0	0	0	116.2
27	T	34.4	Very low	32.5	Very low	125 Å²	125	131.7 Å²	131.7	77%	0.767	78%	0.781	S	S	*	*			trans	-56.9	174.3	169.6	64	0	0	0	0	113.7
28	P	48.8	Very low	32.5	Very low	96 Å²	96	130 Å²	130	62%	0.623	78%	0.778	S	S	*	*			cis	-153.1	-167.4	25.1	45.4	-23.5	0	0	0	119.1
29	K	29.5	Very low	32.7	Very low	195 Å²	195	134.6 Å²	134.6	85%	0.848	78%	0.781	S	S	*	*			trans	75.8	149.6	159.4	-71.8	168.3	-171	175.2	0	116.8
30	S	29.9	Very low	32.7	Very low	95 Å²	95	136.5 Å²	136.5	66%	0.664	79%	0.789	S	S	*	*			cis	-165	156.4	1	44.2	0	0	0	0	115.4
31	N	29.3	Very low	32.9	Very low	138 Å²	138	137.1 Å²	137.1	74%	0.738	79%	0.787	S	S	*	*			trans	74.8	124	140.6	-72	5.2	0	0	0	124.5
32	M	28.2	Very low	33.6	Very low	167 Å²	167	138.5 Å²	138.5	82%	0.823	79%	0.789	S	S	*	*			trans	63.2	141.6	138.6	-55.5	-179.5	80.1	0	0	118.4
33	T	32.6	Very low	33.6	Very low	138 Å²	138	137.8 Å²	137.8	85%	0.847	78%	0.783	S	S	*	*			cis	-144.2	179.7	28.3	47.9	0	0	0	0	110.9
34	G	27.9	Very low	32.5	Very low	78 Å²	78	139.2 Å²	139.2	80%	0.804	78%	0.784	S	S	*	*			cis	151.5	53.6	-10	0	0	0	0	0	117.2
35	A	31.2	Very low	32.4	Very low	97 Å²	97	142.4 Å²	142.4	80%	0.802	78%	0.78	S	S	*	*			trans	-162.9	138.4	161.7	0	0	0	0	0	110.2
36	A	29.9	Very low	32.2	Very low	94 Å²	94	142.2 Å²	142.2	78%	0.777	78%	0.776	S	S	*	*			cis	105.5	90.2	6.1	0	0	0	0	0	117.4
37	R	31.7	Very low	31.4	Very low	232 Å²	232	143.9 Å²	143.9	88%	0.875	78%	0.779	S	S	*	*				175.7	131.6	116.8	-98.3	171.1	172.8	170.6	-1.5	115.8
38	N	30.4	Very low	31.1	Very low	126 Å²	126	140.7 Å²	140.7	67%	0.674	77%	0.771	S	S	*	*			trans	50.7	123.1	134.5	-66.9	-2.8	0	0	0	121.3
39	R	31	Very low	30.3	Very low	223 Å²	223	143 Å²	143	84%	0.842	78%	0.783	S	S	*	*				64.3	136.2	84.4	-70.6	-173.4	174.7	-172.6	-0.1	113.5
40	T	28.6	Very low	30.4	Very low	129 Å²	129	138.5 Å²	138.5	79%	0.791	78%	0.776	S	S	*	*			cis	-160.7	175.4	9.1	0.6	0	0	0	0	112
41	Q	31.1	Very low	30.6	Very low	179 Å²	179	141.6 Å²	141.6	84%	0.836	79%	0.785	S	S	*	*			trans	-54.6	166.1	159.6	-79.6	-173.6	3.2	0	0	112.8
42	P	42.2	Very low	30.5	Very low	126 Å²	126	138.2 Å²	138.2	82%	0.818	78%	0.782	S	S	*	*			cis	-149.5	-145.2	40.6	45.5	-22.3	0	0	0	117.3
43	S	28.3	Very low	30.4	Very low	99 Å²	99	133.9 Å²	133.9	69%	0.692	78%	0.78	S	S	*	*			trans	-103.3	171.6	-159.8	54	0	0	0	0	116.3
44	L	28.7	Very low	30.3	Very low	145 Å²	145	134.8 Å²	134.8	76%	0.759	78%	0.78	S	S	*	*			trans	125.5	112.2	144	-74.6	159	0	0	0	119.7
45	R	26.6	Very low	30.4	Very low	212 Å²	212	137.7 Å²	137.7	80%	0.8	78%	0.777	S	S	*	*				61.4	136.5	127.5	-96.6	-177.6	173.2	-179.2	-1.8	123.9
46	K	30.2	Very low	30.5	Very low	178 Å²	178	137.3 Å²	137.3	77%	0.774	77%	0.769	S	S	*	*			trans	69.7	148.8	158	-60.9	-179.6	176.1	-173.2	0	115.2
47	N	28.8	Very low	30.5	Very low	150 Å²	150	140.4 Å²	140.4	80%	0.802	77%	0.767	S	S	*	*			cis	-155	179.7	-8.2	-114.7	34.7	0	0	0	107.3
48	G	28.5	Very low	30.4	Very low	58 Å²	58	137.3 Å²	137.3	60%	0.598	76%	0.762	S	S	*	*			cis	141.8	160.4	0.8	0	0	0	0	0	111.6
49	V	32.1	Very low	30.4	Very low	145 Å²	145	135.5 Å²	135.5	88%	0.879	76%	0.759	S	S	*	*			trans	76.3	130.1	177.6	-170.9	0	0	0	0	114.1
50	S	32.2	Very low	30.3	Very low	99 Å²	99	131.5 Å²	131.5	69%	0.692	75%	0.753	S	S	*	*			cis	-148.7	-168.2	-6.2	55	0	0	0	0	107.7
51	N	32.4	Very low	30.2	Very low	161 Å²	161	136.7 Å²	136.7	86%	0.861	76%	0.758	S	S	*	*			cis	-156.3	-179.3	1.9	-140.4	11.3	0	0	0	107.4
52	G	27.3	Very low	30	Very low	66 Å²	66	132.8 Å²	132.8	68%	0.68	75%	0.751	S	S	*	*			cis	177.8	162.6	-6	0	0	0	0	0	109.7
53	G	27.7	Very low	29.3	Very low	76 Å²	76	133.4 Å²	133.4	78%	0.784	75%	0.747	S	S	*	*			trans	137.1	127.2	174.7	0	0	0	0	0	115.3
54	D	30.3	Very low	29.2	Very low	157 Å²	157	139.2 Å²	139.2	84%	0.84	76%	0.755	S	S	*	*			trans	-85.2	174.8	178.8	-46.7	-83.4	0	0	0	111.4
55	D	30.3	Very low	29	Very low	139 Å²	139	136 Å²	136	74%	0.743	76%	0.756	S	S	*	*			cis	-137.9	146.5	14.4	-102.8	-66	0	0	0	108.9
56	S	31.9	Very low	28.9	Very low	89 Å²	89	131.6 Å²	131.6	62%	0.622	76%	0.758	S	S	*	*				61.9	131.2	74.9	108.4	0	0	0	0	114.4
57	Q	30.6	Very low	29.2	Very low	159 Å²	159	129.4 Å²	129.4	74%	0.743	76%	0.762	S	S	*	*			cis	-150.4	157.3	17.4	-58.3	-175.4	-4.1	0	0	114.7
58	H	30.1	Very low	29.1	Very low	168 Å²	168	127.1 Å²	127.1	78%	0.778	76%	0.758	S	S	*	*			trans	48.9	160	137.4	-67.9	-41.5	0	0	0	122.8
59	S	29.2	Very low	28.9	Very low	87 Å²	87	129.2 Å²	129.2	61%	0.608	76%	0.763	S	S	*	*			cis	179.8	165.7	-11.7	-95.9	0	0	0	0	108.8
60	I	29.1	Very low	28.6	Very low	140 Å²	140	127.3 Å²	127.3	72%	0.718	75%	0.752	S	S	*	*			cis	-166.2	155.5	-20.6	-110.4	172.2	0	0	0	109.6
61	R	27.2	Very low	28.3	Very low	238 Å²	238	132.4 Å²	132.4	90%	0.898	76%	0.762	S	S	*	*			trans	70.6	124.2	161.1	-93.7	174.5	-179.4	160.7	-0.3	123.6
62	S	26.2	Very low	27.9	Very low	97 Å²	97	127.7 Å²	127.7	68%	0.678	75%	0.751	S	S	*	*			trans	-33.5	150.3	142.2	178.8	0	0	0	0	118
63	L	27.3	Very low	27.8	Very low	139 Å²	139	131.9 Å²	131.9	73%	0.728	76%	0.758	S	S	*	*				178.1	155.3	112.5	-89.8	176.6	0	0	0	114.5
64	Y	25.7	Very low	27.7	Very low	221 Å²	221	131.1 Å²	131.1	87%	0.867	75%	0.75	S	S	*	*			trans	24.9	144.5	160.3	-68.8	-66.8	0	0	0	124
65	G	25.1	Very low	27.5	Very low	76 Å²	76	133.4 Å²	133.4	78%	0.784	75%	0.748	S	S	*	*			trans	152.3	104.6	140.4	0	0	0	0	0	117.8
66	S	25.9	Very low	27.3	Very low	120 Å²	120	133.5 Å²	133.5	84%	0.839	75%	0.749	S	S	*	*			trans	-86.7	162.8	156.1	-50.6	0	0	0	0	110.1
67	P	36	Very low	27	Very low	132 Å²	132	135.6 Å²	135.6	86%	0.857	75%	0.752	S	S	*	*				-139.2	174.5	119.7	38.4	-27.8	0	0	0	113.9
68	S	25.2	Very low	26.8	Very low	103 Å²	103	133.8 Å²	133.8	72%	0.72	75%	0.748	S	S	*	*			trans	-139.7	151.8	-174.8	55.3	0	0	0	0	112.4
69	S	25.6	Very low	26.5	Very low	102 Å²	102	132.1 Å²	132.1	71%	0.713	75%	0.745	S	S	*	*			trans	64	144.4	160.1	70.4	0	0	0	0	117.5
70	T	25.7	Very low	26.3	Very low	105 Å²	105	136.4 Å²	136.4	64%	0.644	76%	0.76	S	S	*	*				-176.1	154.4	60.3	28.7	0	0	0	0	111.6
71	K	26.2	Very low	26.1	Very low	206 Å²	206	134.7 Å²	134.7	90%	0.896	76%	0.761	S	S	*	*			trans	58.1	152.8	147.2	-62.5	163.8	-175.4	177	0	118.9
72	G	23.4	Very low	25.9	Very low	62 Å²	62	128.1 Å²	128.1	64%	0.639	75%	0.751	S	S	*	*			cis	169.4	168.8	-4.1	0	0	0	0	0	111.7
73	N	26.1	Very low	25.8	Very low	153 Å²	153	132.5 Å²	132.5	82%	0.818	76%	0.758	S	S	*	*			trans	68.3	152.2	-174.1	-52	-11.3	0	0	0	113
74	G	23.8	Very low	25.6	Very low	60 Å²	60	130.9 Å²	130.9	62%	0.619	76%	0.758	S	S	*	*			cis	114.7	129.2	24.6	0	0	0	0	0	107.4
75	Y	27.8	Very low	25.5	Very low	205 Å²	205	127.1 Å²	127.1	80%	0.804	76%	0.759	S	S	*	*			cis	-152.5	175.9	26	-57.9	-97.3	0	0	0	112.5
76	N	25.6	Very low	25.4	Very low	141 Å²	141	132.2 Å²	132.2	75%	0.754	76%	0.762	S	S	*	*			trans	-4.8	155.9	146.5	-63.7	2.5	0	0	0	120.1
77	L	25	Very low	25.3	Very low	133 Å²	133	132.4 Å²	132.4	70%	0.696	76%	0.76	S	S	*	*			cis	-167.3	166	-8.2	-110.2	167.7	0	0	0	109.6
78	D	25.9	Very low	24.7	Very low	121 Å²	121	135 Å²	135	65%	0.647	76%	0.761	S	S	*	*			trans	66.8	126.8	148.3	-72.1	-31.5	0	0	0	124.7
79	N	25	Very low	24.5	Very low	134 Å²	134	140.1 Å²	140.1	72%	0.717	77%	0.77	S	S	*	*			trans	58.3	111.6	135.5	-62.2	-43.7	0	0	0	121.7
80	L	25.4	Very low	24.3	Very low	176 Å²	176	144.6 Å²	144.6	92%	0.921	78%	0.782	S	S	*	*				-168.5	161.9	94.4	-103.2	166.4	0	0	0	114.1
81	S	23	Very low	24	Very low	105 Å²	105	144.7 Å²	144.7	73%	0.734	79%	0.787	S	S	*	*			trans	-88.1	141.6	-176.5	176.9	0	0	0	0	112.8
82	S	24.3	Very low	23.9	Very low	99 Å²	99	143.6 Å²	143.6	69%	0.692	79%	0.787	S	S	*	*				166.4	153.3	104.6	57	0	0	0	0	116.8
83	K	24.4	Very low	23.7	Very low	189 Å²	189	145.6 Å²	145.6	82%	0.822	79%	0.791	S	S	*	*			trans	58.2	97.6	146.2	-75.5	177.8	179.1	179	0	121.5
84	S	22.1	Very low	23.5	Very low	106 Å²	106	144.5 Å²	144.5	74%	0.741	79%	0.793	S	S	*	*				57.8	119.7	118	66.5	0	0	0	0	122.3
85	T	24.1	Very low	23.4	Very low	142 Å²	142	148.5 Å²	148.5	87%	0.871	81%	0.805	S	S	*	*			trans	-142.5	140.4	137.9	-38.6	0	0	0	0	109.8
86	Q	24	Very low	23.1	Very low	183 Å²	183	143.6 Å²	143.6	86%	0.855	81%	0.807	S	S	*	*			trans	-91.4	155.6	168.9	-73.4	-176.1	-20.6	0	0	111.2
87	P	23	Very low	23	Very low	123 Å²	123	140.7 Å²	140.7	80%	0.799	81%	0.811	S	S	*	*			trans	-113.1	110.2	148.4	30.8	-19.2	0	0	0	112.3
88	Q	23.2	Very low	22.9	Very low	188 Å²	188	143.4 Å²	143.4	88%	0.879	82%	0.822	S	S	*	*			trans	33.7	124.9	143.2	-64.7	176.2	-19.9	0	0	121.2
89	K	21.1	Very low	22.8	Very low	210 Å²	210	142.5 Å²	142.5	91%	0.913	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-70.9	141.1	154.7	-67.6	174.7	174.2	177.3	0	110.5
90	M	21.8	Very low	22.8	Very low	196 Å²	196	144 Å²	144	97%	0.966	82%	0.82	S	S	*	*	P	Polyproline II helix	trans	-98.4	147.8	147.6	-80.7	-169.1	169.6	0	0	109.9
91	S	19.6	Very low	23	Very low	106 Å²	106	138.6 Å²	138.6	74%	0.741	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-98.2	131.7	-175.7	53.9	0	0	0	0	112.2
92	M	22.6	Very low	23.5	Very low	183 Å²	183	137 Å²	137	90%	0.901	78%	0.78	S	S	*	*			trans	-124.1	142.4	161.3	-79.7	-75.5	102.7	0	0	109.6
93	S	21	Very low	23.9	Very low	104 Å²	104	134.2 Å²	134.2	73%	0.727	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-78.8	150.4	-177.2	47.7	0	0	0	0	112.5	T95	S93-T95 PolarHBondContact O-N 2.63Å
94	P	21.8	Very low	24.5	Very low	130 Å²	130	126.7 Å²	126.7	84%	0.844	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-79.2	122.9	-171.6	30.9	-34.9	0	0	0	113.4
95	T	21.6	Very low	25.1	Very low	144 Å²	144	124.7 Å²	124.7	88%	0.883	71%	0.711	S	S	*	*	P	Polyproline II helix	trans	-88.3	149.6	154	35.9	0	0	0	0	110	S93	S93-T95 PolarHBondContact O-N 2.63Å
96	A	21.5	Very low	25.8	Very low	102 Å²	102	118.9 Å²	118.9	84%	0.843	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-91.4	136	-160.7	0	0	0	0	0	114.9
97	G	23.4	Very low	25.9	Very low	81 Å²	81	117 Å²	117	84%	0.835	67%	0.671	S	S	*	*			trans	62.3	68.9	140.1	0	0	0	0	0	118.6
98	M	21.2	Very low	26.5	Very low	189 Å²	189	117.1 Å²	117.1	93%	0.931	66%	0.655	S	S	*	*			trans	-90.3	111.3	156.6	-72.7	-179.1	169.3	0	0	110	Q100	M98-Q100 PolarHBondContact O-N 3.09Å
99	D	25.2	Very low	26.7	Very low	103 Å²	103	111.4 Å²	111.4	55%	0.551	64%	0.636	S	S	*	*			trans	-59.7	127.2	168.5	-103.5	-39	0	0	0	109.1	T101 R646	D99-T101 VanDerWaalsContact C-N 3.35Å; D99-T101 PolarHBondContact O-N 3.1Å; D99-T101 PolarHBondContact O-OG1 3.42Å; D99-R646 IonicContact OD1-CZ 3.78Å; D99-R646 IonicContact OD1-NH1 2.76Å; D99-R646 IonicContact OD1-NH2 3.78Å; D99-R646 PolarHBondContact OD1-NH2 2.77Å; D99-R646 VanDerWaalsContact OD1-NH2 3.12Å; D99-R646 IonicContact OD2-CZ 3.21Å; D99-R646 IonicContact OD2-NH1 3.07Å; D99-R646 PolarHBondContact OD2-NH1 3.4Å; D99-R646 IonicContact OD2-NH2 2.68Å
100	Q	25.2	Very low	27	Very low	164 Å²	164	107.3 Å²	107.3	77%	0.766	62%	0.624	S	S	*	*			trans	-65.1	91.7	176.9	-74	-175.7	-24.2	0	0	110.4	M98 V102	M98-Q100 PolarHBondContact O-N 3.09Å; Q100-V102 PolarHBondContact O-N 3.16Å; Q100-V102 VanDerWaalsContact O-N 3.12Å
101	T	29.1	Very low	27.1	Very low	64 Å²	64	105.6 Å²	105.6	39%	0.393	61%	0.614	S	S	.	*			trans	-81.3	99.8	-173.7	-59.3	0	0	0	0	110	D99 C103 V560	D99-T101 VanDerWaalsContact C-N 3.35Å; D99-T101 PolarHBondContact O-N 3.1Å; D99-T101 PolarHBondContact O-OG1 3.42Å; T101-C103 PolarHBondContact O-N 2.74Å; T101-C103 VanDerWaalsContact O-N 3.07Å; T101-V560 HydrophobicContact CG2-CG1 4.01Å; T101-V560 HydrophobicContact CG2-CG2 4.42Å
102	V	33.3	Very low	27.4	Very low	71 Å²	71	104.6 Å²	104.6	43%	0.43	60%	0.603	S	S	.	*			trans	-62.7	111.1	171.3	-178.7	0	0	0	0	108.9	Q100 Q556 L598 R601	Q100-V102 PolarHBondContact O-N 3.16Å; Q100-V102 VanDerWaalsContact O-N 3.12Å; V102-Q556 PolarHBondContact O-NE2 3.25Å; V102-L598 HydrophobicContact CB-CD2 4.15Å; V102-L598 HydrophobicContact CG1-CD1 4.49Å; V102-L598 HydrophobicContact CG1-CD2 4.17Å; V102-R601 PolarHBondContact O-NH2 3.04Å
103	C	33.2	Very low	27.6	Very low	40 Å²	40	103.1 Å²	103.1	27%	0.27	59%	0.593	S	S	.	*			trans	-103.5	150.5	167.4	-61.3	0	0	0	0	108.6	T101 Y460 V560	T101-C103 PolarHBondContact O-N 2.74Å; T101-C103 VanDerWaalsContact O-N 3.07Å; C103-Y460 HydrophobicContact CB-CD2 4.11Å; C103-Y460 HydrophobicContact CB-CE2 3.56Å; C103-V560 WeakPolarHBondContact SG-CG2 3.4Å
104	V	37.6	Very low	27.9	Very low	31 Å²	31	105.8 Å²	105.8	19%	0.188	60%	0.598	C	S	.	*			trans	-104	89.8	-179.3	-175.6	0	0	0	0	109.9	V106 Q456 L598	V104-V106 HydrophobicContact CG1-CG2 4.33Å; V104-Q456 PolarHBondContact O-NE2 2.92Å; V104-L598 HydrophobicContact CG2-CD1 3.8Å
105	L	33.8	Very low	28	Very low	65 Å²	65	107.1 Å²	107.1	34%	0.34	60%	0.598	S	S	.	*			trans	-71.1	136.7	149.5	-154.7	78.1	0	0	0	107.2	D107 Y460	L105-D107 PolarHBondContact O-N 3.28Å; L105-Y460 HydrophobicContact CB-CE2 4.33Å; L105-Y460 HydrophobicContact CD1-CD1 4.13Å; L105-Y460 HydrophobicContact CD1-CD2 4.09Å; L105-Y460 HydrophobicContact CD1-CE1 4.35Å; L105-Y460 HydrophobicContact CD1-CE2 4.31Å; L105-Y460 HydrophobicContact CD1-CG 4.02Å
106	V	38.1	Very low	28	Very low	19 Å²	19	108.5 Å²	108.5	12%	0.115	59%	0.594	C	S	.	*			trans	-98.4	94.5	-179.8	-149.2	0	0	0	0	109.4	V104 W108 Q456	V104-V106 HydrophobicContact CG1-CG2 4.33Å; V106-W108 HydrophobicContact CG1-CZ2 3.89Å; V106-Q456 VanDerWaalsContact CG2-NE2 3.3Å
107	D	27.1	Very low	28	Very low	144 Å²	144	112.9 Å²	112.9	77%	0.77	60%	0.597	S	S	*	*			trans	-77.2	121.9	-179.3	-161.5	-2.3	0	0	0	110.7	L105	L105-D107 PolarHBondContact O-N 3.28Å
108	W	36.3	Very low	28	Very low	126 Å²	126	113.4 Å²	113.4	48%	0.477	59%	0.588	S	S	.	*			trans	-130.7	66.3	-165.7	-77.9	113.3	0	0	0	113.6	V106 M546	V106-W108 HydrophobicContact CG1-CZ2 3.89Å; W108-M546 HydrophobicContact CH2-CE 4.03Å; W108-M546 HydrophobicContact CZ2-CE 3.63Å
109	S	27	Very low	28	Very low	67 Å²	67	109.4 Å²	109.4	47%	0.469	59%	0.585	S	S	.	*	S	Bend	trans	-110.2	-41.2	166.7	-88.6	0	0	0	0	115
110	D	26.4	Very low	27.9	Very low	124 Å²	124	111.1 Å²	111.1	66%	0.663	60%	0.599	S	S	*	*	S	Bend	trans	-106.7	-17.6	-164.1	-75.5	-61.1	0	0	0	118.2	V112 H113	D110-V112 PolarHBondContact O-N 3.32Å; D110-V112 VanDerWaalsContact O-N 3.08Å; D110-H113 PolarHBondContact O-N 3.3Å; D110-H113 VanDerWaalsContact O-N 3.13Å
111	H	24	Very low	27.7	Very low	161 Å²	161	108.5 Å²	108.5	75%	0.745	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	16.8	-170.8	-82.5	30.6	0	0	0	116.5	R192	H111-R192 PolarHBondContact O-NH2 2.69Å
112	V	26.6	Very low	27.4	Very low	85 Å²	85	114.4 Å²	114.4	52%	0.515	62%	0.621	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.6	-18.5	164.2	-179.8	0	0	0	0	111.7	D110 R192	D110-V112 PolarHBondContact O-N 3.32Å; D110-V112 VanDerWaalsContact O-N 3.08Å; V112-R192 PolarHBondContact O-NH1 2.64Å
113	H	26.6	Very low	26.9	Very low	152 Å²	152	116.4 Å²	116.4	70%	0.704	64%	0.639	S	S	*	*	S	Bend	trans	-96.2	-8.8	-154.8	-107.4	-71.6	0	0	0	118.3	D110	D110-H113 PolarHBondContact O-N 3.3Å; D110-H113 VanDerWaalsContact O-N 3.13Å
114	L	26	Very low	26.4	Very low	159 Å²	159	119.9 Å²	119.9	83%	0.832	66%	0.664	S	S	*	*			trans	-119.4	96.5	179	-86.4	166.7	0	0	0	112.5
115	L	23.9	Very low	26	Very low	158 Å²	158	124.1 Å²	124.1	83%	0.827	69%	0.692	S	S	*	*			trans	-171.5	65.5	151.6	-110.7	172.9	0	0	0	111.6
116	H	22.4	Very low	25.5	Very low	173 Å²	173	127.1 Å²	127.1	80%	0.801	72%	0.718	S	S	*	*			trans	-167.5	93.5	156	-114.3	-78.2	0	0	0	111
117	Q	22.4	Very low	24.8	Very low	194 Å²	194	130.6 Å²	130.6	91%	0.907	75%	0.749	S	S	*	*			trans	-120.4	81.6	158.8	-80.5	-168.1	-7.4	0	0	108.7	A119	Q117-A119 PolarHBondContact O-N 3.16Å
118	S	22.2	Very low	25.1	Very low	92 Å²	92	129.4 Å²	129.4	64%	0.643	75%	0.749	S	S	*	*			trans	-84.2	100.1	166.7	49.8	0	0	0	0	108.6
119	A	22.1	Very low	24.5	Very low	106 Å²	106	128.7 Å²	128.7	88%	0.876	76%	0.759	S	S	*	*			trans	-61.7	134.8	175	0	0	0	0	0	110.8	Q117	Q117-A119 PolarHBondContact O-N 3.16Å
120	V	22.1	Very low	24.3	Very low	139 Å²	139	137 Å²	137	84%	0.842	78%	0.78	S	S	*	*			trans	-105.5	138.4	169.1	178	0	0	0	0	108.1
121	S	21.3	Very low	24.2	Very low	108 Å²	108	135.1 Å²	135.1	76%	0.755	78%	0.782	S	S	*	*			trans	-77.5	145	-168.4	53.2	0	0	0	0	114.8
122	E	22.3	Very low	24.2	Very low	188 Å²	188	132.8 Å²	132.8	88%	0.879	78%	0.783	S	S	*	*			trans	-132.7	144.3	153.3	-76.1	-165.8	146.9	0	0	112.3
123	S	23.6	Very low	24.2	Very low	114 Å²	114	134.8 Å²	134.8	80%	0.797	80%	0.796	S	S	*	*			trans	20.7	113.1	164.1	36.7	0	0	0	0	122.8
124	S	21.6	Very low	24.1	Very low	113 Å²	113	136.4 Å²	136.4	79%	0.79	80%	0.803	S	S	*	*			trans	-58.6	167.5	134.9	-60.2	0	0	0	0	111.5
125	P	30.5	Very low	24.9	Very low	120 Å²	120	134.5 Å²	134.5	78%	0.779	80%	0.8	S	S	*	*			cis	-147.2	164.4	25	42.5	-22.9	0	0	0	119.4
126	S	23	Very low	26	Very low	128 Å²	128	132.7 Å²	132.7	90%	0.895	80%	0.798	S	S	*	*				-178.1	159.8	128.6	40.9	0	0	0	0	112
127	A	23.4	Very low	26.2	Very low	92 Å²	92	127.5 Å²	127.5	76%	0.76	79%	0.792	S	S	*	*			trans	-137.4	178.3	178.8	0	0	0	0	0	107.9
128	P	32.5	Very low	26.6	Very low	118 Å²	118	128 Å²	128	77%	0.766	79%	0.791	S	S	*	*			cis	-130.5	-151.4	31.5	27.8	0.4	0	0	0	111.6
129	T	23.6	Very low	26.9	Very low	112 Å²	112	128.3 Å²	128.3	69%	0.687	79%	0.793	S	S	*	*			cis	-162.7	143.1	13.3	-29.6	0	0	0	0	112.7
130	R	23.8	Very low	27.1	Very low	241 Å²	241	134.1 Å²	134.1	91%	0.909	79%	0.792	S	S	*	*			trans	63.1	154.6	153.7	-95.7	177.5	166.5	160.7	-4.7	118.5
131	A	24.4	Very low	27.4	Very low	85 Å²	85	132.8 Å²	132.8	70%	0.702	78%	0.784	S	S	*	*			cis	-152.2	162.7	-4.2	0	0	0	0	0	112.9
132	S	23.7	Very low	27.7	Very low	112 Å²	112	134.7 Å²	134.7	78%	0.783	79%	0.786	S	S	*	*			trans	6.2	149.1	148.8	-122.4	0	0	0	0	121.1
133	T	25.9	Very low	27.9	Very low	126 Å²	126	130.3 Å²	130.3	77%	0.773	78%	0.777	S	S	*	*			cis	-155	160	40.3	49.5	0	0	0	0	116.3
134	H	25.8	Very low	28.1	Very low	186 Å²	186	132.8 Å²	132.8	86%	0.861	78%	0.78	S	S	*	*			trans	-117.3	-173	159.5	-85.7	-45.9	0	0	0	109
135	P	42.9	Very low	28.4	Very low	119 Å²	119	133.3 Å²	133.3	77%	0.773	78%	0.778	S	S	*	*			cis	-135.8	-128.1	10.3	29.9	-0.3	0	0	0	115.4
136	P	47	Very low	29.2	Very low	121 Å²	121	132.8 Å²	132.8	79%	0.786	78%	0.775	S	S	*	*				-139.3	176	-99.7	45.3	-27.9	0	0	0	120
137	G	26.6	Very low	29.3	Very low	64 Å²	64	136 Å²	136	66%	0.66	78%	0.776	S	S	*	*			trans	-176.4	118.4	155.3	0	0	0	0	0	111.7
138	K	29.6	Very low	29.5	Very low	204 Å²	204	136.6 Å²	136.6	89%	0.887	78%	0.775	S	S	*	*				66.8	132.9	75	-68.3	-176.2	-179.4	177.3	0	114.6
139	S	28.1	Very low	29.3	Very low	99 Å²	99	136.6 Å²	136.6	69%	0.692	77%	0.772	S	S	*	*			cis	-173	155.7	-7.9	-90.2	0	0	0	0	112.9
140	R	28	Very low	29.5	Very low	227 Å²	227	141.8 Å²	141.8	86%	0.857	78%	0.779	S	S	*	*			trans	60.4	120.2	147.8	-76.5	-176.2	173.9	171.9	-3	120.5
141	T	28.3	Very low	29.7	Very low	111 Å²	111	135.3 Å²	135.3	68%	0.681	77%	0.766	S	S	*	*				90	118.3	59.3	58.9	0	0	0	0	116.6
142	N	27.3	Very low	29.8	Very low	148 Å²	148	140.6 Å²	140.6	79%	0.791	77%	0.773	S	S	*	*				167	112.8	125	-86.3	0	0	0	0	117.2
143	S	25.6	Very low	30.1	Very low	97 Å²	97	142.8 Å²	142.8	68%	0.678	78%	0.776	S	S	*	*				26	143.7	129	64.1	0	0	0	0	126.3
144	L	27.8	Very low	31.1	Very low	165 Å²	165	142.6 Å²	142.6	86%	0.864	78%	0.778	S	S	*	*			trans	102.9	163	144.2	-74.9	159	0	0	0	121.9
145	T	29	Very low	31.3	Very low	124 Å²	124	139.5 Å²	139.5	76%	0.761	78%	0.777	S	S	*	*			trans	-139.4	-165.1	-157.1	55.3	0	0	0	0	111.1
146	P	46.8	Very low	30.5	Very low	109 Å²	109	137 Å²	137	71%	0.708	77%	0.772	S	S	*	*				-127	175.5	-50.7	32.4	-14.7	0	0	0	114
147	Q	26.1	Very low	29.6	Very low	196 Å²	196	137.4 Å²	137.4	92%	0.916	78%	0.778	S	S	*	*				163.6	155.5	128.7	-89.3	-166.9	12.7	0	0	117.8
148	S	27.1	Very low	29.7	Very low	105 Å²	105	138.5 Å²	138.5	73%	0.734	78%	0.781	S	S	*	*			trans	-45.7	165	175	-173.4	0	0	0	0	120.7
149	V	28.2	Very low	29.6	Very low	117 Å²	117	133.7 Å²	133.7	71%	0.709	78%	0.779	S	S	*	*				171.9	133	121	149	0	0	0	0	116.7
150	R	26.9	Very low	29.5	Very low	222 Å²	222	132.2 Å²	132.2	84%	0.838	78%	0.78	S	S	*	*			trans	63.5	160.3	155.4	-85.5	-177.3	160.6	142.9	-0.3	122.1
151	T	28.7	Very low	29.6	Very low	104 Å²	104	132.2 Å²	132.2	64%	0.638	78%	0.78	S	S	*	*			cis	-174.2	152.9	-36.2	26.8	0	0	0	0	111.5
152	K	27	Very low	29.5	Very low	196 Å²	196	132.1 Å²	132.1	85%	0.852	78%	0.775	S	S	*	*				145.1	138.2	126.6	-80.2	-170.7	-178	-178.5	0	115
153	N	30	Very low	29.4	Very low	158 Å²	158	129.4 Å²	129.4	85%	0.845	77%	0.768	S	S	*	*			trans	-106.4	165.4	158.6	-65.7	2.5	0	0	0	109.4
154	P	45.4	Very low	29.3	Very low	123 Å²	123	132 Å²	132	80%	0.799	77%	0.773	S	S	*	*				-142.3	-173.1	92.2	41.5	-26.9	0	0	0	111.4
155	S	30	Very low	29.2	Very low	120 Å²	120	134 Å²	134	84%	0.839	77%	0.769	S	S	*	*			cis	-171.5	163.1	-23.4	46	0	0	0	0	106.9
156	G	26.2	Very low	28.9	Very low	66 Å²	66	134.8 Å²	134.8	68%	0.68	77%	0.769	S	S	*	*			cis	161.8	171.3	-2.8	0	0	0	0	0	111.2
157	S	28.2	Very low	27.8	Very low	130 Å²	130	132.8 Å²	132.8	91%	0.909	77%	0.768	S	S	*	*			trans	67.1	150.2	166.3	-66.5	0	0	0	0	120
158	A	28.6	Very low	27.7	Very low	87 Å²	87	132.5 Å²	132.5	72%	0.719	77%	0.767	S	S	*	*			cis	-167.1	155.5	-20.7	0	0	0	0	0	112.8
159	A	29.1	Very low	27.5	Very low	103 Å²	103	132.7 Å²	132.7	85%	0.851	77%	0.768	S	S	*	*			trans	62.3	143.5	153.6	0	0	0	0	0	121
160	G	26	Very low	27.3	Very low	68 Å²	68	134.2 Å²	134.2	70%	0.701	77%	0.768	S	S	*	*			cis	143.8	174.2	-17.6	0	0	0	0	0	115.8
161	R	29.9	Very low	27	Very low	228 Å²	228	131 Å²	131	86%	0.86	76%	0.76	S	S	*	*			trans	73.4	153	161.1	-64	178.7	-179.9	-106.8	10.5	116.8
162	D	25.4	Very low	26.8	Very low	108 Å²	108	133.8 Å²	133.8	58%	0.578	77%	0.765	S	S	*	*			cis	-156.6	156.2	-5.9	-129.3	-52.5	0	0	0	112.4
163	S	25.7	Very low	26.6	Very low	92 Å²	92	128.4 Å²	128.4	64%	0.643	75%	0.752	S	S	*	*			trans	55.3	163.1	140.7	-71.7	0	0	0	0	123.1
164	L	23.6	Very low	26.2	Very low	152 Å²	152	131.5 Å²	131.5	80%	0.796	75%	0.754	S	S	*	*			cis	-170	155.4	-38.4	-117.2	168.4	0	0	0	111.4
165	R	25.1	Very low	25.1	Very low	207 Å²	207	131.6 Å²	131.6	78%	0.781	75%	0.751	S	S	*	*			trans	78.6	136.6	149.4	-107.7	-170.5	170.1	-163.2	-2.3	124.4
166	N	24	Very low	24.7	Very low	139 Å²	139	135.1 Å²	135.1	74%	0.743	75%	0.752	S	S	*	*			trans	60	147.8	149.1	-63.2	-3.6	0	0	0	121.3
167	G	22.5	Very low	24.7	Very low	68 Å²	68	138.4 Å²	138.4	70%	0.701	76%	0.761	S	S	*	*			cis	163.9	148.5	-12.6	0	0	0	0	0	115.5
168	Q	23.9	Very low	24.4	Very low	189 Å²	189	135.6 Å²	135.6	88%	0.883	75%	0.752	S	S	*	*			trans	71.5	117	170.6	-60.5	-173.9	-9.2	0	0	117.8
169	S	22.3	Very low	24.4	Very low	110 Å²	110	138.4 Å²	138.4	77%	0.769	76%	0.761	S	S	*	*				91.5	137	89	-64.2	0	0	0	0	113.6
170	Q	24.1	Very low	24.1	Very low	148 Å²	148	142.1 Å²	142.1	69%	0.692	76%	0.761	S	S	*	*			cis	-145.9	158.6	19.9	-69.4	-170.4	11	0	0	115.1
171	K	22.3	Very low	23.9	Very low	155 Å²	155	147.1 Å²	147.1	67%	0.674	77%	0.768	S	S	*	*			trans	68.9	125.5	140.7	-78.5	171.6	-175.8	154.6	0	124.6
172	H	23.9	Very low	23.6	Very low	162 Å²	162	141.9 Å²	141.9	75%	0.75	76%	0.761	S	S	*	*			trans	62.2	143.7	139.4	-60.8	-48.6	0	0	0	121
173	S	21.8	Very low	23.4	Very low	83 Å²	83	145.2 Å²	145.2	58%	0.58	77%	0.773	S	S	*	*			cis	-168.1	166.1	-13	-95.6	0	0	0	0	110.6
174	Y	22.1	Very low	23.3	Very low	224 Å²	224	152 Å²	152	88%	0.878	79%	0.785	S	S	*	*			trans	67	155.3	172	-70.7	-85.9	0	0	0	118.3
175	V	22.9	Very low	23.2	Very low	124 Å²	124	152.9 Å²	152.9	75%	0.752	79%	0.789	S	S	*	*				-161.9	147.9	-65.3	131	0	0	0	0	108
176	K	21.2	Very low	23	Very low	195 Å²	195	154.3 Å²	154.3	85%	0.848	80%	0.795	S	S	*	*			trans	-127.7	141	169.3	-69.9	-174.1	177.4	-175.8	0	110.2
177	P	25.4	Very low	22.9	Very low	134 Å²	134	153.2 Å²	153.2	87%	0.87	80%	0.798	S	S	*	*			trans	-65.7	139	160.8	-12.9	28.6	0	0	0	109.4
178	G	22.5	Very low	23	Very low	71 Å²	71	155.3 Å²	155.3	73%	0.732	80%	0.798	S	S	*	*			trans	-114.4	141	-176.1	0	0	0	0	0	113
179	T	28.1	Very low	22.9	Very low	146 Å²	146	154.9 Å²	154.9	90%	0.896	80%	0.795	S	S	*	*			trans	-58.2	138.5	168	-38.8	0	0	0	0	110.5
180	Q	23.8	Very low	23	Very low	181 Å²	181	158.8 Å²	158.8	85%	0.846	80%	0.803	S	S	*	*			trans	-123.3	135.3	162.6	-74	-161.3	-3.9	0	0	111.6
181	M	21.5	Very low	22.9	Very low	173 Å²	173	159 Å²	159	85%	0.852	81%	0.81	S	S	*	*			trans	-105	131.8	-178.3	-176.2	-177.7	75.7	0	0	107.9
182	V	23.7	Very low	23.3	Very low	118 Å²	118	160.7 Å²	160.7	72%	0.715	81%	0.811	S	S	*	*			trans	-126.3	126.1	174.4	-177.5	0	0	0	0	109.6
183	Q	20.3	Very low	23.4	Very low	178 Å²	178	156.2 Å²	156.2	83%	0.832	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-97	122.2	-172.5	-177.9	177	-4.9	0	0	110.2
184	W	23.8	Very low	23.8	Very low	235 Å²	235	157.8 Å²	157.8	89%	0.89	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-89	138.4	-179.8	-85	84.5	0	0	0	112.9
185	L	22.3	Very low	24	Very low	170 Å²	170	152.6 Å²	152.6	89%	0.89	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-91.1	144.2	169.7	-87.1	166.1	0	0	0	111.1
186	R	20.3	Very low	24.1	Very low	237 Å²	237	156 Å²	156	89%	0.894	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-87.5	123.6	-175.6	176.9	-166.7	-74.1	-173.3	-4.8	111.7
187	S	21.1	Very low	24.4	Very low	116 Å²	116	153.2 Å²	153.2	81%	0.811	80%	0.802	S	S	*	*			trans	-151.7	169.9	147.5	-157.5	0	0	0	0	110.3
188	T	24.6	Very low	24.3	Very low	113 Å²	113	150.8 Å²	150.8	69%	0.693	79%	0.793	S	S	*	*			trans	-110.2	173.1	-156.4	48.8	0	0	0	0	115.7
189	H	22.6	Very low	24.5	Very low	179 Å²	179	156.6 Å²	156.6	83%	0.829	80%	0.801	S	S	*	*			trans	75.6	112	179.7	-67.8	-89.1	0	0	0	116.9
190	M	24.7	Very low	24.3	Very low	192 Å²	192	156.8 Å²	156.8	95%	0.946	80%	0.795	S	S	*	*			trans	-128	129.8	159.6	-77.2	-68.9	167.7	0	0	107.8
191	D	21.5	Very low	24.2	Very low	154 Å²	154	153 Å²	153	82%	0.824	79%	0.788	S	S	*	*			trans	-90.5	169.3	174.1	-164.2	3.1	0	0	0	110.4	G193	D191-G193 PolarHBondContact O-N 3.48Å
192	R	31.4	Very low	24.4	Very low	189 Å²	189	153 Å²	153	71%	0.713	79%	0.787	S	S	*	*	S	Bend	trans	-64.8	89.3	-173.6	-72.6	174.5	161.8	-177.1	-7	112.7	H111 V112	H111-R192 PolarHBondContact O-NH2 2.69Å; V112-R192 PolarHBondContact O-NH1 2.64Å
193	G	25.1	Very low	24.3	Very low	69 Å²	69	157.8 Å²	157.8	71%	0.711	79%	0.792	S	S	*	*			trans	-152.2	139.1	173.6	0	0	0	0	0	114.5	D191	D191-G193 PolarHBondContact O-N 3.48Å
194	L	29.9	Very low	24.5	Very low	115 Å²	115	160.2 Å²	160.2	60%	0.602	79%	0.794	S	S	*	*			trans	-71.7	155.2	168.6	-87	142.7	0	0	0	110.8	W352 L401	L194-W352 HydrophobicContact CD1-CH2 4.11Å; L194-W352 HydrophobicContact CD1-CZ3 4.34Å; L194-L401 HydrophobicContact CD2-CD2 4.38Å
195	P	28.1	Very low	24.5	Very low	115 Å²	115	157.9 Å²	157.9	75%	0.747	79%	0.792	S	S	*	*			trans	-67.3	146	-162.2	25.1	-34.5	0	0	0	114.3	Q197	P195-Q197 PolarHBondContact O-N 3.42Å; P195-Q197 VanDerWaalsContact O-N 3.12Å
196	Q	24.3	Very low	24.6	Very low	197 Å²	197	155.4 Å²	155.4	92%	0.921	79%	0.79	S	S	*	*			trans	-66.4	103.8	-179.8	-172	172.9	68.9	0	0	111.1	A198	Q196-A198 PolarHBondContact O-N 3.44Å
197	Q	27.4	Very low	24.8	Very low	136 Å²	136	147.4 Å²	147.4	64%	0.636	78%	0.78	S	S	*	*			trans	-70.2	112	177.7	-166.5	166.3	1	0	0	109.8	P195	P195-Q197 PolarHBondContact O-N 3.42Å; P195-Q197 VanDerWaalsContact O-N 3.12Å
198	A	24.3	Very low	24.9	Very low	82 Å²	82	153.6 Å²	153.6	68%	0.678	79%	0.786	S	S	*	*			trans	-62.2	151.3	-177.5	0	0	0	0	0	112.3	Q196 I200	Q196-A198 PolarHBondContact O-N 3.44Å; A198-I200 PolarHBondContact O-N 3.17Å
199	Q	25.2	Very low	24.8	Very low	194 Å²	194	152.5 Å²	152.5	91%	0.907	78%	0.783	S	S	*	*			trans	-67.2	99.6	-174.9	-64.4	179.5	-83.3	0	0	112.4	S201	Q199-S201 PolarHBondContact O-N 3.39Å
200	I	23.8	Very low	24.9	Very low	150 Å²	150	150.9 Å²	150.9	77%	0.769	78%	0.779	S	S	*	*			trans	-76.7	84.6	160.1	-57.9	-178.7	0	0	0	107.8	A198 Q202	A198-I200 PolarHBondContact O-N 3.17Å; I200-Q202 HydrophobicContact CG2-CG 4.32Å; I200-Q202 PolarHBondContact O-N 2.88Å; I200-Q202 VanDerWaalsContact O-N 3.16Å
201	S	23.3	Very low	24.7	Very low	100 Å²	100	146.3 Å²	146.3	70%	0.699	77%	0.766	S	S	*	*			trans	-77.2	92.2	170.6	-173.6	0	0	0	0	109.1	Q199 R203	Q199-S201 PolarHBondContact O-N 3.39Å; S201-R203 PolarHBondContact O-N 3.15Å
202	Q	25.3	Very low	24.9	Very low	174 Å²	174	144.6 Å²	144.6	81%	0.813	76%	0.761	S	S	*	*			trans	-69.4	86.8	165.2	-77.6	-155.9	-5.4	0	0	109.4	I200	I200-Q202 HydrophobicContact CG2-CG 4.32Å; I200-Q202 PolarHBondContact O-N 2.88Å; I200-Q202 VanDerWaalsContact O-N 3.16Å
203	R	22.1	Very low	24.6	Very low	218 Å²	218	141.1 Å²	141.1	82%	0.823	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-74.4	124	171.1	-177.7	176.3	-177	159.5	0.4	108.6	S201 E205	S201-R203 PolarHBondContact O-N 3.15Å; R203-E205 PolarHBondContact O-N 3.44Å
204	W	23.7	Very low	24.6	Very low	230 Å²	230	147.2 Å²	147.2	87%	0.871	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-62.6	121.1	175.3	-68.7	61.3	0	0	0	109.8
205	E	23.5	Very low	24.3	Very low	185 Å²	185	150.5 Å²	150.5	86%	0.864	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-94.4	121.6	168.6	-67.9	-155.4	146.6	0	0	110.5	R203	R203-E205 PolarHBondContact O-N 3.44Å
206	S	24.3	Very low	24.3	Very low	119 Å²	119	151.3 Å²	151.3	83%	0.832	77%	0.771	S	S	*	*			trans	-126.9	129.1	158	-68.4	0	0	0	0	105.9
207	G	24.3	Very low	24.3	Very low	68 Å²	68	149.1 Å²	149.1	70%	0.701	77%	0.766	S	S	*	*			trans	-91.4	159	-146.6	0	0	0	0	0	117.3
208	R	24.5	Very low	24.3	Very low	247 Å²	247	154 Å²	154	93%	0.932	78%	0.778	S	S	*	*			trans	69.4	148.8	161.9	-53.1	-173.2	-177.9	-148.1	0.1	115
209	S	20.7	Very low	24.5	Very low	90 Å²	90	159.2 Å²	159.2	63%	0.629	79%	0.786	S	S	*	*			cis	-159.6	165.3	7	-137.5	0	0	0	0	112.4
210	I	24.9	Very low	24.7	Very low	144 Å²	144	155.5 Å²	155.5	74%	0.738	78%	0.777	S	S	*	*			trans	67.2	112.4	154.7	-62.4	158.8	0	0	0	116.1
211	S	21.5	Very low	25	Very low	97 Å²	97	155.8 Å²	155.8	68%	0.678	78%	0.78	S	S	*	*				61.6	135.3	87.4	134.1	0	0	0	0	114.8
212	T	25.2	Very low	25.8	Very low	118 Å²	118	161.6 Å²	161.6	72%	0.724	79%	0.786	S	S	*	*			cis	-157.6	168.1	17	7	0	0	0	0	113.5
213	N	25.7	Very low	26.4	Very low	115 Å²	115	161.7 Å²	161.7	62%	0.615	79%	0.787	S	S	*	*			trans	51.8	112.2	149.8	-78.7	-39	0	0	0	124.4
214	R	24.6	Very low	27.3	Very low	198 Å²	198	158.1 Å²	158.1	75%	0.747	78%	0.784	S	S	*	*				55.5	125.9	110	-94.2	-172.6	-72.9	-170.3	-6.8	123.5
215	F	23.4	Very low	28.1	Very low	183 Å²	183	153 Å²	153	80%	0.803	78%	0.778	S	S	*	*			trans	63	151.8	156.4	-69.3	-77.7	0	0	0	117.1
216	T	27.7	Very low	28.8	Very low	132 Å²	132	153 Å²	153	81%	0.81	78%	0.775	S	S	*	*			cis	-144.6	168.2	10.4	-18.9	0	0	0	0	111.4
217	N	26.2	Very low	29.6	Very low	152 Å²	152	153.3 Å²	153.3	81%	0.813	77%	0.772	S	S	*	*			trans	-71.4	141	172	-76.8	-40.4	0	0	0	113.4
218	R	27.1	Very low	30.2	Very low	238 Å²	238	158.1 Å²	158.1	90%	0.898	78%	0.778	S	S	*	*				177.2	158	110.3	-97.4	173.7	-177.5	166.5	2.5	114.9
219	F	27.6	Very low	30.6	Very low	192 Å²	192	153 Å²	153	84%	0.842	76%	0.763	S	S	*	*			trans	-57.5	158.6	160.9	-61.7	-105.3	0	0	0	110.6
220	T	30.1	Very low	31.3	Very low	116 Å²	116	154.4 Å²	154.4	71%	0.712	76%	0.763	S	S	*	*			cis	-154.4	162.5	12.3	-12.1	0	0	0	0	107.9
221	N	29.1	Very low	31.7	Very low	156 Å²	156	159 Å²	159	83%	0.834	77%	0.771	S	S	*	*				-158.8	158.9	84.1	-152.9	-3.7	0	0	0	113.3
222	R	40.5	Very low	32.3	Very low	221 Å²	221	158.3 Å²	158.3	83%	0.834	77%	0.771	S	S	*	*			trans	-115.2	105.3	-179.8	-81.4	177.5	165	179.1	-3.1	111.6
223	Q	37.2	Very low	32.9	Very low	176 Å²	176	159 Å²	159	82%	0.822	77%	0.767	S	S	*	*			trans	-162.2	169.9	145.3	-102.7	141.7	18.8	0	0	108.9	V225	Q223-V225 PolarHBondContact O-N 3.38Å
224	D	41.1	Very low	33.7	Very low	144 Å²	144	161.5 Å²	161.5	77%	0.77	77%	0.774	S	S	*	*	S	Bend	trans	79.9	-28.3	-179.1	-57.5	-16	0	0	0	120.8	K226 T227	D224-K226 PolarHBondContact O-N 3.19Å; D224-T227 PolarHBondContact O-N 3.1Å
225	V	40.8	Very low	34.5	Very low	122 Å²	122	158.2 Å²	158.2	74%	0.739	78%	0.782	S	S	*	*	H	α-helix	trans	-67.7	-3.5	-179.6	-168.9	0	0	0	0	113.9	Q223	Q223-V225 PolarHBondContact O-N 3.38Å
226	K	38.9	Very low	35.2	Very low	186 Å²	186	153.4 Å²	153.4	81%	0.809	78%	0.776	S	S	*	*	H	α-helix	trans	-76.6	-28	179.2	-93.5	-171.4	171.4	-174.5	0	114.6	D224	D224-K226 PolarHBondContact O-N 3.19Å
227	T	40.1	Very low	35.7	Very low	124 Å²	124	156 Å²	156	76%	0.761	78%	0.779	S	S	*	*	H	α-helix	trans	-89	-28.4	-166.9	-36.9	0	0	0	0	113.5	D224	D224-T227 PolarHBondContact O-N 3.1Å
228	M	37.8	Very low	36.5	Very low	170 Å²	170	158.3 Å²	158.3	84%	0.837	78%	0.782	S	S	*	*	H	α-helix	trans	-85.4	-21.2	176.7	-72.9	-170.2	171.7	0	0	114.1	N230	M228-N230 VanDerWaalsContact C-N 3.33Å; M228-N230 PolarHBondContact O-N 2.59Å
229	K	32.8	Very low	37.3	Very low	139 Å²	139	154.8 Å²	154.8	60%	0.604	78%	0.78	S	S	*	*	G	3₁₀ helix	trans	-68.7	-29.5	-172.3	-159	169.2	-173.3	176.9	0	113.8	R231	K229-R231 VanDerWaalsContact C-N 3.33Å; K229-R231 PolarHBondContact O-N 3.06Å
230	N	35.7	Very low	38.7	Very low	120 Å²	120	150.8 Å²	150.8	64%	0.642	77%	0.773	S	S	*	*	G	3₁₀ helix	trans	-74.2	-17.2	-175.2	-69.4	7.3	0	0	0	114.3	M228	M228-N230 VanDerWaalsContact C-N 3.33Å; M228-N230 PolarHBondContact O-N 2.59Å
231	R	33.8	Very low	40.8	Very low	240 Å²	240	153.6 Å²	153.6	91%	0.906	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-90	-8.3	-178.4	-128.7	175.4	-173.2	167.5	1.9	114.3	K229	K229-R231 VanDerWaalsContact C-N 3.33Å; K229-R231 PolarHBondContact O-N 3.06Å
232	A	34.1	Very low	43.4	Very low	82 Å²	82	148.8 Å²	148.8	68%	0.678	75%	0.752	S	S	*	*	G	3₁₀ helix	trans	-106.7	18.2	177	0	0	0	0	0	113.2
233	Q	37.3	Very low	45.9	Very low	134 Å²	134	141.1 Å²	141.1	63%	0.626	73%	0.729	S	S	*	*	S	Bend	trans	-115	10.4	-179.9	-66.3	-165.7	-97.3	0	0	114.1
234	Q	42.5	Very low	48.7	Very low	166 Å²	166	133 Å²	133	78%	0.776	69%	0.691	S	S	*	*	S	Bend	trans	-111	143.8	165.3	-66.9	176.7	-15.9	0	0	107.3
235	S	41.3	Very low	51.2	Low	129 Å²	129	132.5 Å²	132.5	90%	0.902	68%	0.683	S	S	*	*	S	Bend	trans	73.5	4.7	-170.8	83.4	0	0	0	0	119.2	E237	S235-E237 PolarHBondContact O-N 3.21Å
236	A	37.8	Very low	53.7	Low	83 Å²	83	129.2 Å²	129.2	69%	0.686	66%	0.663	S	S	*	*			trans	-81.9	89.7	155.7	0	0	0	0	0	109.3	K238	A236-K238 PolarHBondContact O-N 2.69Å
237	E	38.7	Very low	56.4	Low	186 Å²	186	120.4 Å²	120.4	87%	0.869	62%	0.624	S	S	*	*			trans	-56.6	125.2	167.3	-72.7	-167.3	136.9	0	0	109	S235 L239	S235-E237 PolarHBondContact O-N 3.21Å; E237-L239 PolarHBondContact O-N 3.18Å
238	K	41.4	Very low	59.1	Low	201 Å²	201	114.6 Å²	114.6	87%	0.874	59%	0.589	S	S	*	*			trans	-64.6	103.2	164.9	-93.8	-169.8	171.1	-171.3	0	107.1	A236 P240	A236-K238 PolarHBondContact O-N 2.69Å; K238-P240 VanDerWaalsContact O-N 3.12Å
239	L	46	Very low	61.8	Low	164 Å²	164	113.9 Å²	113.9	86%	0.859	58%	0.581	S	S	*	*			trans	-40.8	120.7	163	-92.1	159.4	0	0	0	108	E237 E241	E237-L239 PolarHBondContact O-N 3.18Å; L239-E241 PolarHBondContact O-N 2.99Å
240	P	56.7	Low	64.7	Low	108 Å²	108	108.6 Å²	108.6	70%	0.701	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-59.8	125.5	-168.4	21.4	-32.5	0	0	0	109.4	K238 M242	K238-P240 VanDerWaalsContact O-N 3.12Å; P240-M242 PolarHBondContact O-N 3.39Å; P240-M242 VanDerWaalsContact O-N 3.11Å
241	E	73.4	Confident	67.5	Low	175 Å²	175	103.3 Å²	103.3	82%	0.818	53%	0.531	S	S	*	.	P	Polyproline II helix	trans	-55.9	120.4	-175.3	-171.4	171.8	166.7	0	0	109.2	L239 T243	L239-E241 PolarHBondContact O-N 2.99Å; E241-T243 WeakPolarHBondContact O-CG2 3.44Å; E241-T243 PolarHBondContact O-N 3.21Å; E241-T243 VanDerWaalsContact O-N 3.17Å
242	M	84.5	Confident	70.3	Confident	55 Å²	55	96.6 Å²	96.6	27%	0.271	51%	0.513	S	S	.	.	P	Polyproline II helix	trans	-62.2	124.1	-174.4	-171.3	68.1	75.9	0	0	108.7	P240 T246 A247 L250 Y265	P240-M242 PolarHBondContact O-N 3.39Å; P240-M242 VanDerWaalsContact O-N 3.11Å; M242-T246 HydrophobicContact SD-CG2 3.86Å; M242-A247 HydrophobicContact CG-CB 4.34Å; M242-A247 HydrophobicContact SD-CB 4.06Å; M242-L250 HydrophobicContact CE-CD1 3.57Å; M242-L250 HydrophobicContact SD-CD1 3.86Å; M242-Y265 HydrophobicContact CB-CD2 3.85Å; M242-Y265 HydrophobicContact CB-CE2 3.65Å; M242-Y265 HydrophobicContact CB-CG 4.46Å; M242-Y265 HydrophobicContact CG-CD1 3.84Å; M242-Y265 HydrophobicContact CG-CD2 3.48Å; M242-Y265 VanDerWaalsContact CG-CD2 3.48Å; M242-Y265 HydrophobicContact CG-CE1 4.02Å; M242-Y265 HydrophobicContact CG-CE2 3.64Å; M242-Y265 HydrophobicContact CG-CG 3.59Å; M242-Y265 WeakPolarHBondContact O-CE2 3.39Å; M242-Y265 PolarHBondContact O-OH 2.92Å
243	T	93.2	Very high	72.9	Confident	60 Å²	60	97.1 Å²	97.1	37%	0.368	50%	0.5	S	S	.	.			trans	-113	164.1	174.2	74.9	0	0	0	0	109.7	E241 K245 T246 A247	E241-T243 WeakPolarHBondContact O-CG2 3.44Å; E241-T243 PolarHBondContact O-N 3.21Å; E241-T243 VanDerWaalsContact O-N 3.17Å; T243-K245 VanDerWaalsContact C-N 3.27Å; T243-K245 PolarHBondContact O-N 3.29Å; T243-K245 PolarHBondContact OG1-N 3.02Å; T243-T246 PolarHBondContact O-N 3.5Å; T243-T246 VanDerWaalsContact O-N 3.14Å; T243-T246 PolarHBondContact OG1-N 2.93Å; T243-T246 PolarHBondContact OG1-OG1 3.26Å; T243-A247 WeakPolarHBondContact O-CB 3.02Å; T243-A247 PolarHBondContact O-N 2.84Å
244	I	94.6	Very high	75.3	Confident	5 Å²	5	100.8 Å²	100.8	3%	0.026	51%	0.514	C	S	.	.	H	α-helix	trans	-54.9	-46	171.6	-63.6	-67.2	0	0	0	110.8	T246 A247 V248 Y265 Q269 A276 E279 V280	I244-T246 VanDerWaalsContact C-N 3.28Å; I244-T246 PolarHBondContact O-N 3.18Å; I244-A247 PolarHBondContact O-N 3.09Å; I244-V248 HydrophobicContact CG2-CG2 4.06Å; I244-V248 WeakPolarHBondContact O-CB 3.27Å; I244-V248 VanDerWaalsContact O-CG2 3.3Å; I244-V248 WeakPolarHBondContact O-CG2 3.39Å; I244-V248 PolarHBondContact O-N 3.47Å; I244-Y265 HydrophobicContact CD1-CE1 4.03Å; I244-Q269 HydrophobicContact CD1-CB 3.71Å; I244-Q269 HydrophobicContact CD1-CG 3.99Å; I244-A276 HydrophobicContact CD1-CB 4.09Å; I244-A276 HydrophobicContact CG1-CB 4.36Å; I244-E279 HydrophobicContact CB-CB 4.05Å; I244-E279 WeakPolarHBondContact CB-OE2 3.35Å; I244-E279 HydrophobicContact CG1-CB 4.21Å; I244-E279 WeakPolarHBondContact CG1-OE2 3.45Å; I244-E279 HydrophobicContact CG2-CB 3.76Å; I244-V280 HydrophobicContact CD1-CG2 4.25Å; I244-V280 HydrophobicContact CG2-CB 4.44Å; I244-V280 HydrophobicContact CG2-CG2 3.62Å
245	K	93.7	Very high	77.7	Confident	134 Å²	134	96.3 Å²	96.3	58%	0.583	50%	0.495	S	S	*	.	H	α-helix	trans	-64.3	-30.9	179.8	-63.8	-178.9	-178	178	0	112.8	T243 K249	T243-K245 VanDerWaalsContact C-N 3.27Å; T243-K245 PolarHBondContact O-N 3.29Å; T243-K245 PolarHBondContact OG1-N 3.02Å; K245-K249 VanDerWaalsContact O-CG 3.31Å; K245-K249 WeakPolarHBondContact O-CG 3.47Å
246	T	93.4	Very high	80.3	Confident	53 Å²	53	94.5 Å²	94.5	33%	0.325	47%	0.473	S	S	.	.	H	α-helix	trans	-73.3	-50	172.7	-48.7	0	0	0	0	110.7	M242 T243 I244 V248 K249 L250	M242-T246 HydrophobicContact SD-CG2 3.86Å; T243-T246 PolarHBondContact O-N 3.5Å; T243-T246 VanDerWaalsContact O-N 3.14Å; T243-T246 PolarHBondContact OG1-N 2.93Å; T243-T246 PolarHBondContact OG1-OG1 3.26Å; I244-T246 VanDerWaalsContact C-N 3.28Å; I244-T246 PolarHBondContact O-N 3.18Å; T246-V248 PolarHBondContact O-N 3.37Å; T246-K249 WeakPolarHBondContact O-CB 3.48Å; T246-K249 PolarHBondContact O-N 2.85Å; T246-K249 VanDerWaalsContact O-N 3.16Å; T246-L250 WeakPolarHBondContact O-CG 3.4Å; T246-L250 PolarHBondContact O-N 2.88Å
247	A	95.7	Very high	83	Confident	0 Å²	0	98.2 Å²	98.2	0%	0	47%	0.473	C	S	.	.	H	α-helix	trans	-60.3	-44.6	-179.4	0	0	0	0	0	112	M242 T243 I244 K249 L250 L251 A262 Y265 I266	M242-A247 HydrophobicContact CG-CB 4.34Å; M242-A247 HydrophobicContact SD-CB 4.06Å; T243-A247 WeakPolarHBondContact O-CB 3.02Å; T243-A247 PolarHBondContact O-N 2.84Å; I244-A247 PolarHBondContact O-N 3.09Å; A247-K249 VanDerWaalsContact C-N 3.27Å; A247-K249 PolarHBondContact O-N 3.25Å; A247-L250 WeakPolarHBondContact O-CA 3.44Å; A247-L250 WeakPolarHBondContact O-CB 3.34Å; A247-L250 PolarHBondContact O-N 2.93Å; A247-L251 PolarHBondContact O-N 3.4Å; A247-A262 HydrophobicContact CB-CB 4.31Å; A247-A262 WeakPolarHBondContact O-CB 3.45Å; A247-Y265 HydrophobicContact CB-CD1 3.69Å; A247-Y265 HydrophobicContact CB-CE1 4.36Å; A247-Y265 HydrophobicContact CB-CG 4.41Å; A247-I266 HydrophobicContact CB-CD1 4.01Å; A247-I266 HydrophobicContact CB-CG1 3.81Å
248	V	95.9	Very high	85.6	Confident	3 Å²	3	92.2 Å²	92.2	2%	0.018	45%	0.445	C	S	.	.	H	α-helix	trans	-64	-30.6	178.2	177.1	0	0	0	0	112.2	I244 T246 L251 I266 A283 K288	I244-V248 HydrophobicContact CG2-CG2 4.06Å; I244-V248 WeakPolarHBondContact O-CB 3.27Å; I244-V248 VanDerWaalsContact O-CG2 3.3Å; I244-V248 WeakPolarHBondContact O-CG2 3.39Å; I244-V248 PolarHBondContact O-N 3.47Å; T246-V248 PolarHBondContact O-N 3.37Å; V248-L251 WeakPolarHBondContact O-CB 3.48Å; V248-L251 PolarHBondContact O-N 3.38Å; V248-I266 HydrophobicContact CG2-CD1 3.69Å; V248-I266 HydrophobicContact CG2-CG1 4.37Å; V248-A283 HydrophobicContact CB-CB 3.98Å; V248-A283 HydrophobicContact CG1-CB 3.68Å; V248-A283 WeakPolarHBondContact CG1-O 3.31Å; V248-A283 HydrophobicContact CG2-CB 4.16Å; V248-K288 HydrophobicContact CG1-CD 3.58Å
249	K	94.8	Very high	88.2	Confident	155 Å²	155	82.8 Å²	82.8	67%	0.674	40%	0.404	S	S	*	.	H	α-helix	trans	-73.1	-27.5	170.5	-73.3	175.6	178	-173.6	0	113.5	K245 T246 A247 L251 D252	K245-K249 VanDerWaalsContact O-CG 3.31Å; K245-K249 WeakPolarHBondContact O-CG 3.47Å; T246-K249 WeakPolarHBondContact O-CB 3.48Å; T246-K249 PolarHBondContact O-N 2.85Å; T246-K249 VanDerWaalsContact O-N 3.16Å; A247-K249 VanDerWaalsContact C-N 3.27Å; A247-K249 PolarHBondContact O-N 3.25Å; K249-L251 VanDerWaalsContact C-N 3.27Å; K249-D252 PolarHBondContact O-N 3.33Å
250	L	94.8	Very high	90.7	Very high	28 Å²	28	76.8 Å²	76.8	15%	0.147	37%	0.373	C	S	.	.	H	α-helix	trans	-72.8	-22	175.1	-67.9	173.4	0	0	0	112.1	M242 T246 A247 D252 K253 A262	M242-L250 HydrophobicContact CE-CD1 3.57Å; M242-L250 HydrophobicContact SD-CD1 3.86Å; T246-L250 WeakPolarHBondContact O-CG 3.4Å; T246-L250 PolarHBondContact O-N 2.88Å; A247-L250 WeakPolarHBondContact O-CA 3.44Å; A247-L250 WeakPolarHBondContact O-CB 3.34Å; A247-L250 PolarHBondContact O-N 2.93Å; L250-D252 PolarHBondContact O-N 3Å; L250-K253 HydrophobicContact CD2-CD 3.78Å; L250-K253 WeakPolarHBondContact O-CB 3.4Å; L250-K253 PolarHBondContact O-N 3.14Å; L250-K253 VanDerWaalsContact O-N 3.1Å; L250-A262 HydrophobicContact CB-CB 3.73Å; L250-A262 HydrophobicContact CD1-CB 4.49Å
251	L	94.6	Very high	92.6	Very high	8 Å²	8	74.9 Å²	74.9	4%	0.042	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-16.2	172.7	-55.8	-177.1	0	0	0	113.8	A247 V248 K249 L259 A262 A263 I266 K288 L289 L292	A247-L251 PolarHBondContact O-N 3.4Å; V248-L251 WeakPolarHBondContact O-CB 3.48Å; V248-L251 PolarHBondContact O-N 3.38Å; K249-L251 VanDerWaalsContact C-N 3.27Å; L251-L259 WeakPolarHBondContact O-CD2 3.35Å; L251-A262 HydrophobicContact CD2-CB 3.72Å; L251-A263 HydrophobicContact CD2-CB 4.45Å; L251-I266 HydrophobicContact CD1-CD1 3.81Å; L251-I266 HydrophobicContact CD2-CD1 4.28Å; L251-I266 HydrophobicContact CG-CD1 4.22Å; L251-K288 HydrophobicContact CB-CB 4.19Å; L251-K288 HydrophobicContact CD1-CB 3.89Å; L251-L289 HydrophobicContact CD1-CD2 3.88Å; L251-L289 HydrophobicContact CD1-CG 3.94Å; L251-L289 HydrophobicContact CD2-CD2 4.3Å; L251-L292 HydrophobicContact CB-CD1 4.06Å; L251-L292 HydrophobicContact CD2-CD1 3.71Å; L251-L292 HydrophobicContact CG-CD1 4.3Å
252	D	91.6	Very high	93.7	Very high	99 Å²	99	66.5 Å²	66.5	53%	0.529	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-3.3	175.9	-60.8	-53	0	0	0	113.3	K249 L250 K288	K249-D252 PolarHBondContact O-N 3.33Å; L250-D252 PolarHBondContact O-N 3Å; D252-K288 IonicContact OD1-NZ 2.74Å; D252-K288 PolarHBondContact OD1-NZ 3.18Å; D252-K288 IonicContact OD2-NZ 3.83Å; D252-K288 PolarHBondContact OD2-NZ 3.1Å
253	K	89.4	Confident	94.3	Very high	93 Å²	93	64 Å²	64	40%	0.404	31%	0.31	S	S	.	.	S	Bend	trans	-83.4	156.8	179.8	-69.2	-169.4	171.7	-173.4	0	112.3	L250 E258 L259	L250-K253 HydrophobicContact CD2-CD 3.78Å; L250-K253 WeakPolarHBondContact O-CB 3.4Å; L250-K253 PolarHBondContact O-N 3.14Å; L250-K253 VanDerWaalsContact O-N 3.1Å; K253-E258 HydrophobicContact CD-CB 4.42Å; K253-E258 WeakPolarHBondContact CD-OE1 3.42Å; K253-E258 WeakPolarHBondContact CD-OE2 3.29Å; K253-E258 IonicContact NZ-OE1 2.69Å; K253-E258 PolarHBondContact NZ-OE1 3.08Å; K253-E258 IonicContact NZ-OE2 3.54Å; K253-L259 VanDerWaalsContact O-CD2 3.3Å; K253-L259 WeakPolarHBondContact O-CD2 3.37Å
254	K	87.1	Confident	94.5	Very high	211 Å²	211	63.1 Å²	63.1	92%	0.917	31%	0.309	S	S	*	.	S	Bend	trans	-87.7	-1.6	176.2	-63.9	-171	175.2	-172.6	0	115
255	N	93.8	Very high	94.7	Very high	72 Å²	72	65.6 Å²	65.6	39%	0.385	32%	0.319	S	S	.	.			trans	-92.6	109.4	-174.2	178.7	1.6	0	0	0	110.5	K257 E258 L259	N255-K257 PolarHBondContact O-N 3.42Å; N255-K257 VanDerWaalsContact O-N 3.15Å; N255-K257 PolarHBondContact OD1-N 3.29Å; N255-E258 HydrophobicContact CB-CB 4.24Å; N255-E258 HydrophobicContact CB-CG 4.25Å; N255-E258 WeakPolarHBondContact CB-OE2 3.43Å; N255-E258 WeakPolarHBondContact ND2-CG 3.3Å; N255-E258 PolarHBondContact ND2-OE2 3.07Å; N255-E258 PolarHBondContact O-N 3.32Å; N255-L259 PolarHBondContact O-N 3.32Å
256	E	94.8	Very high	94.9	Very high	92 Å²	92	59.2 Å²	59.2	43%	0.43	29%	0.291	S	S	.	.	H	α-helix	trans	-50.7	-41.1	-177.2	-63.4	176.6	-127.9	0	0	113.1	E258 L259 I260 S297 V300	E256-E258 VanDerWaalsContact C-N 3.3Å; E256-E258 PolarHBondContact O-N 2.93Å; E256-L259 WeakPolarHBondContact O-CB 3.27Å; E256-L259 PolarHBondContact O-N 2.94Å; E256-I260 HydrophobicContact CB-CD1 4.43Å; E256-I260 WeakPolarHBondContact O-CB 3.36Å; E256-I260 WeakPolarHBondContact O-CD1 3.38Å; E256-I260 WeakPolarHBondContact O-CG1 3.12Å; E256-I260 PolarHBondContact O-N 3.43Å; E256-S297 WeakPolarHBondContact OE2-CB 3.44Å; E256-S297 PolarHBondContact OE2-OG 3.11Å; E256-V300 HydrophobicContact CB-CG2 3.9Å; E256-V300 HydrophobicContact CG-CG2 3.89Å
257	K	94.3	Very high	95.1	Very high	161 Å²	161	59.4 Å²	59.4	70%	0.7	29%	0.288	S	S	*	.	H	α-helix	trans	-66.6	-31.7	179.9	-66.8	-176.9	178.6	179	0	112.9	N255 S261	N255-K257 PolarHBondContact O-N 3.42Å; N255-K257 VanDerWaalsContact O-N 3.15Å; N255-K257 PolarHBondContact OD1-N 3.29Å; K257-S261 WeakPolarHBondContact O-CB 3.31Å; K257-S261 PolarHBondContact O-N 2.97Å
258	E	94	Very high	95.2	Very high	59 Å²	59	61.7 Å²	61.7	28%	0.276	31%	0.305	S	S	.	.	H	α-helix	trans	-77.2	-37.7	173.6	-68.3	-177.6	96.6	0	0	111.5	K253 N255 E256 A262	K253-E258 HydrophobicContact CD-CB 4.42Å; K253-E258 WeakPolarHBondContact CD-OE1 3.42Å; K253-E258 WeakPolarHBondContact CD-OE2 3.29Å; K253-E258 IonicContact NZ-OE1 2.69Å; K253-E258 PolarHBondContact NZ-OE1 3.08Å; K253-E258 IonicContact NZ-OE2 3.54Å; N255-E258 HydrophobicContact CB-CB 4.24Å; N255-E258 HydrophobicContact CB-CG 4.25Å; N255-E258 WeakPolarHBondContact CB-OE2 3.43Å; N255-E258 WeakPolarHBondContact ND2-CG 3.3Å; N255-E258 PolarHBondContact ND2-OE2 3.07Å; N255-E258 PolarHBondContact O-N 3.32Å; E256-E258 VanDerWaalsContact C-N 3.3Å; E256-E258 PolarHBondContact O-N 2.93Å; E258-A262 WeakPolarHBondContact O-CB 3.45Å; E258-A262 PolarHBondContact O-N 3.07Å
259	L	96.6	Very high	95.2	Very high	3 Å²	3	63.2 Å²	63.2	2%	0.016	31%	0.311	C	S	.	.	H	α-helix	trans	-61	-51	174.6	-68.4	176.4	0	0	0	111.8	L251 K253 N255 E256 A262 A263 L292 V300	L251-L259 WeakPolarHBondContact O-CD2 3.35Å; K253-L259 VanDerWaalsContact O-CD2 3.3Å; K253-L259 WeakPolarHBondContact O-CD2 3.37Å; N255-L259 PolarHBondContact O-N 3.32Å; E256-L259 WeakPolarHBondContact O-CB 3.27Å; E256-L259 PolarHBondContact O-N 2.94Å; L259-A262 PolarHBondContact O-N 2.95Å; L259-A263 WeakPolarHBondContact O-CB 3.3Å; L259-A263 PolarHBondContact O-N 3.19Å; L259-L292 HydrophobicContact CD1-CD2 3.99Å; L259-L292 HydrophobicContact CD2-CD1 4.03Å; L259-L292 HydrophobicContact CD2-CD2 3.82Å; L259-L292 HydrophobicContact CG-CD2 4.47Å; L259-V300 HydrophobicContact CB-CG1 4.29Å; L259-V300 HydrophobicContact CB-CG2 4.31Å; L259-V300 HydrophobicContact CD1-CG1 4.07Å; L259-V300 HydrophobicContact CD1-CG2 4.26Å
260	I	97.2	Very high	95.3	Very high	39 Å²	39	55.9 Å²	55.9	20%	0.2	28%	0.279	C	S	.	.	H	α-helix	trans	-61.8	-45.7	178.7	-65.8	158.1	0	0	0	110.3	E256 A262 A263 A264 E299 V300 A303	E256-I260 HydrophobicContact CB-CD1 4.43Å; E256-I260 WeakPolarHBondContact O-CB 3.36Å; E256-I260 WeakPolarHBondContact O-CD1 3.38Å; E256-I260 WeakPolarHBondContact O-CG1 3.12Å; E256-I260 PolarHBondContact O-N 3.43Å; I260-A262 PolarHBondContact O-N 2.88Å; I260-A263 PolarHBondContact O-N 2.85Å; I260-A264 VanDerWaalsContact O-CB 3.24Å; I260-A264 WeakPolarHBondContact O-CB 3.41Å; I260-A264 PolarHBondContact O-N 3.23Å; I260-E299 HydrophobicContact CD1-CB 3.54Å; I260-E299 HydrophobicContact CG1-CB 4.27Å; I260-V300 HydrophobicContact CD1-CG2 4.29Å; I260-V300 HydrophobicContact CG1-CG2 4.07Å; I260-A303 HydrophobicContact CB-CB 4.45Å; I260-A303 HydrophobicContact CG1-CB 4.37Å; I260-A303 HydrophobicContact CG2-CB 4.2Å
261	S	96.4	Very high	95.2	Very high	67 Å²	67	61.8 Å²	61.8	47%	0.469	30%	0.304	S	S	.	.	H	α-helix	trans	-61.9	-42.9	178.1	-173.8	0	0	0	0	112.3	K257 Y265	K257-S261 WeakPolarHBondContact O-CB 3.31Å; K257-S261 PolarHBondContact O-N 2.97Å; S261-Y265 WeakPolarHBondContact O-CB 3.45Å; S261-Y265 PolarHBondContact O-N 3.2Å
262	A	97.5	Very high	95.1	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-66.9	-45.5	177.5	0	0	0	0	0	112.6	A247 L250 L251 E258 L259 I260 Y265 I266	A247-A262 HydrophobicContact CB-CB 4.31Å; A247-A262 WeakPolarHBondContact O-CB 3.45Å; L250-A262 HydrophobicContact CB-CB 3.73Å; L250-A262 HydrophobicContact CD1-CB 4.49Å; L251-A262 HydrophobicContact CD2-CB 3.72Å; E258-A262 WeakPolarHBondContact O-CB 3.45Å; E258-A262 PolarHBondContact O-N 3.07Å; L259-A262 PolarHBondContact O-N 2.95Å; I260-A262 PolarHBondContact O-N 2.88Å; A262-Y265 PolarHBondContact O-N 3.06Å; A262-I266 VanDerWaalsContact O-CG1 3.32Å; A262-I266 WeakPolarHBondContact O-CG1 3.41Å; A262-I266 PolarHBondContact O-N 2.98Å
263	A	98	Very high	95.1	Very high	1 Å²	1	69 Å²	69	1%	0.008	33%	0.33	C	S	.	.	H	α-helix	trans	-62.8	-47.1	176.8	0	0	0	0	0	111.5	L251 L259 I260 Y265 I266 Q267 L289 A303 A307	L251-A263 HydrophobicContact CD2-CB 4.45Å; L259-A263 WeakPolarHBondContact O-CB 3.3Å; L259-A263 PolarHBondContact O-N 3.19Å; I260-A263 PolarHBondContact O-N 2.85Å; A263-Y265 VanDerWaalsContact C-N 3.32Å; A263-Y265 PolarHBondContact O-N 3.34Å; A263-I266 PolarHBondContact O-N 3.11Å; A263-Q267 WeakPolarHBondContact O-CB 3.39Å; A263-Q267 PolarHBondContact O-N 3.41Å; A263-L289 HydrophobicContact CB-CD2 4.21Å; A263-A303 HydrophobicContact CB-CB 4Å; A263-A307 HydrophobicContact CB-CB 4.17Å; A263-A307 WeakPolarHBondContact O-CB 3.48Å
264	A	97.4	Very high	95.2	Very high	42 Å²	42	69.7 Å²	69.7	35%	0.347	34%	0.339	S	S	.	.	H	α-helix	trans	-62.2	-36	176.4	0	0	0	0	0	112.8	I260 S268	I260-A264 VanDerWaalsContact O-CB 3.24Å; I260-A264 WeakPolarHBondContact O-CB 3.41Å; I260-A264 PolarHBondContact O-N 3.23Å; A264-S268 WeakPolarHBondContact O-CB 3.39Å; A264-S268 PolarHBondContact O-N 2.88Å
265	Y	97.4	Very high	95.5	Very high	57 Å²	57	64.1 Å²	64.1	22%	0.224	32%	0.322	C	S	.	.	H	α-helix	trans	-63.2	-49.3	171.9	177.9	-84.8	0	0	0	111.4	M242 I244 A247 S261 A262 A263 Q267 S268 Q269	M242-Y265 HydrophobicContact CB-CD2 3.85Å; M242-Y265 HydrophobicContact CB-CE2 3.65Å; M242-Y265 HydrophobicContact CB-CG 4.46Å; M242-Y265 HydrophobicContact CG-CD1 3.84Å; M242-Y265 HydrophobicContact CG-CD2 3.48Å; M242-Y265 VanDerWaalsContact CG-CD2 3.48Å; M242-Y265 HydrophobicContact CG-CE1 4.02Å; M242-Y265 HydrophobicContact CG-CE2 3.64Å; M242-Y265 HydrophobicContact CG-CG 3.59Å; M242-Y265 WeakPolarHBondContact O-CE2 3.39Å; M242-Y265 PolarHBondContact O-OH 2.92Å; I244-Y265 HydrophobicContact CD1-CE1 4.03Å; A247-Y265 HydrophobicContact CB-CD1 3.69Å; A247-Y265 HydrophobicContact CB-CE1 4.36Å; A247-Y265 HydrophobicContact CB-CG 4.41Å; S261-Y265 WeakPolarHBondContact O-CB 3.45Å; S261-Y265 PolarHBondContact O-N 3.2Å; A262-Y265 PolarHBondContact O-N 3.06Å; A263-Y265 VanDerWaalsContact C-N 3.32Å; A263-Y265 PolarHBondContact O-N 3.34Å; Y265-Q267 PolarHBondContact O-N 3.2Å; Y265-S268 PolarHBondContact O-N 2.94Å; Y265-S268 VanDerWaalsContact O-N 3.16Å; Y265-Q269 HydrophobicContact CD1-CG 4.1Å; Y265-Q269 HydrophobicContact CE1-CG 3.5Å; Y265-Q269 HydrophobicContact CE2-CG 4.21Å; Y265-Q269 WeakPolarHBondContact O-CG 3.45Å; Y265-Q269 PolarHBondContact O-N 3.13Å; Y265-Q269 PolarHBondContact OH-NE2 3.27Å
266	I	98.1	Very high	95.6	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	31%	0.305	C	S	.	.	H	α-helix	trans	-59.4	-46.2	178.5	-69.8	163.1	0	0	0	110.7	A247 V248 L251 A262 A263 S268 Q269 C270 V280 L289 V311	A247-I266 HydrophobicContact CB-CD1 4.01Å; A247-I266 HydrophobicContact CB-CG1 3.81Å; V248-I266 HydrophobicContact CG2-CD1 3.69Å; V248-I266 HydrophobicContact CG2-CG1 4.37Å; L251-I266 HydrophobicContact CD1-CD1 3.81Å; L251-I266 HydrophobicContact CD2-CD1 4.28Å; L251-I266 HydrophobicContact CG-CD1 4.22Å; A262-I266 VanDerWaalsContact O-CG1 3.32Å; A262-I266 WeakPolarHBondContact O-CG1 3.41Å; A262-I266 PolarHBondContact O-N 2.98Å; A263-I266 PolarHBondContact O-N 3.11Å; I266-S268 VanDerWaalsContact C-N 3.31Å; I266-S268 PolarHBondContact O-N 3.12Å; I266-Q269 PolarHBondContact O-N 3.21Å; I266-C270 WeakPolarHBondContact O-CB 3.41Å; I266-C270 PolarHBondContact O-N 3.21Å; I266-C270 PolarHBondContact O-SG 3.46Å; I266-V280 HydrophobicContact CG2-CG2 3.78Å; I266-L289 HydrophobicContact CG2-CD1 4.29Å; I266-V311 HydrophobicContact CG2-CG2 3.69Å
267	Q	97.9	Very high	95.7	Very high	57 Å²	57	57 Å²	57	27%	0.266	29%	0.287	S	S	.	.	H	α-helix	trans	-52.5	-48.6	173.9	-174.3	-170.8	13.4	0	0	111.6	A263 Y265 F271 A307 N310	A263-Q267 WeakPolarHBondContact O-CB 3.39Å; A263-Q267 PolarHBondContact O-N 3.41Å; Y265-Q267 PolarHBondContact O-N 3.2Å; Q267-F271 WeakPolarHBondContact O-CB 3.25Å; Q267-F271 PolarHBondContact O-N 3.23Å; Q267-F271 VanDerWaalsContact O-N 3.09Å; Q267-A307 HydrophobicContact CB-CB 4Å; Q267-N310 WeakPolarHBondContact CG-ND2 3.46Å; Q267-N310 PolarHBondContact O-ND2 2.98Å
268	S	96.9	Very high	95.7	Very high	49 Å²	49	54 Å²	54	34%	0.343	27%	0.274	S	S	.	.	H	α-helix	trans	-68.5	-36.3	-176.2	-158.9	0	0	0	0	112.9	A264 Y265 I266 K272	A264-S268 WeakPolarHBondContact O-CB 3.39Å; A264-S268 PolarHBondContact O-N 2.88Å; Y265-S268 PolarHBondContact O-N 2.94Å; Y265-S268 VanDerWaalsContact O-N 3.16Å; I266-S268 VanDerWaalsContact C-N 3.31Å; I266-S268 PolarHBondContact O-N 3.12Å; S268-K272 VanDerWaalsContact O-CD 3.22Å; S268-K272 WeakPolarHBondContact O-CD 3.47Å; S268-K272 VanDerWaalsContact O-CG 3.28Å; S268-K272 WeakPolarHBondContact O-CG 3.49Å; S268-K272 PolarHBondContact OG-NZ 3.46Å
269	Q	97.2	Very high	95.8	Very high	35 Å²	35	54.6 Å²	54.6	16%	0.164	28%	0.277	C	S	.	.	H	α-helix	trans	-75.5	-43.5	176.4	-63.2	-59.8	-24.9	0	0	111.9	I244 Y265 I266 F271 K272 K273 A276	I244-Q269 HydrophobicContact CD1-CB 3.71Å; I244-Q269 HydrophobicContact CD1-CG 3.99Å; Y265-Q269 HydrophobicContact CD1-CG 4.1Å; Y265-Q269 HydrophobicContact CE1-CG 3.5Å; Y265-Q269 HydrophobicContact CE2-CG 4.21Å; Y265-Q269 WeakPolarHBondContact O-CG 3.45Å; Y265-Q269 PolarHBondContact O-N 3.13Å; Y265-Q269 PolarHBondContact OH-NE2 3.27Å; I266-Q269 PolarHBondContact O-N 3.21Å; Q269-F271 PolarHBondContact O-N 3.1Å; Q269-K272 PolarHBondContact O-N 2.83Å; Q269-K273 PolarHBondContact O-N 3.3Å; Q269-A276 HydrophobicContact CB-CB 3.82Å
270	C	96.4	Very high	95.8	Very high	0 Å²	0	54.5 Å²	54.5	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-67.7	-22.1	180	-63.9	0	0	0	0	113.2	I266 R277 N310 V311	I266-C270 WeakPolarHBondContact O-CB 3.41Å; I266-C270 PolarHBondContact O-N 3.21Å; I266-C270 PolarHBondContact O-SG 3.46Å; C270-R277 HydrophobicContact CB-CG 3.88Å; C270-R277 PolarHBondContact O-NE 3.46Å; C270-R277 VanDerWaalsContact O-NE 3.12Å; C270-R277 PolarHBondContact O-NH2 3.28Å; C270-N310 HydrophobicContact CB-CB 3.98Å; C270-V311 HydrophobicContact CB-CG2 4.32Å
271	F	92.9	Very high	95.7	Very high	153 Å²	153	56.8 Å²	56.8	67%	0.671	28%	0.282	S	S	*	.	H	α-helix	trans	-69.2	-36.2	167.1	-172.5	-101.2	0	0	0	112.9	Q267 Q269	Q267-F271 WeakPolarHBondContact O-CB 3.25Å; Q267-F271 PolarHBondContact O-N 3.23Å; Q267-F271 VanDerWaalsContact O-N 3.09Å; Q269-F271 PolarHBondContact O-N 3.1Å
272	K	92.4	Very high	95.6	Very high	135 Å²	135	62.5 Å²	62.5	59%	0.587	29%	0.293	S	S	*	.	H	α-helix	trans	-95.4	-24.8	-169.6	-67.6	167.4	-174	155.4	0	114.5	S268 Q269	S268-K272 VanDerWaalsContact O-CD 3.22Å; S268-K272 WeakPolarHBondContact O-CD 3.47Å; S268-K272 VanDerWaalsContact O-CG 3.28Å; S268-K272 WeakPolarHBondContact O-CG 3.49Å; S268-K272 PolarHBondContact OG-NZ 3.46Å; Q269-K272 PolarHBondContact O-N 2.83Å
273	K	91.6	Very high	95.5	Very high	122 Å²	122	63.7 Å²	63.7	53%	0.53	30%	0.304	S	S	.	.			trans	-143.3	123.3	-170.6	-61.6	175.4	-177.3	171.4	0	110.5	Q269 V275 A276	Q269-K273 PolarHBondContact O-N 3.3Å; K273-V275 VanDerWaalsContact C-N 3.25Å; K273-V275 PolarHBondContact O-N 3.46Å; K273-A276 HydrophobicContact CB-CB 4.07Å; K273-A276 WeakPolarHBondContact O-CB 3.36Å; K273-A276 PolarHBondContact O-N 3.31Å; K273-A276 VanDerWaalsContact O-N 3.1Å
274	D	90.9	Very high	95.4	Very high	108 Å²	108	69 Å²	69	58%	0.578	33%	0.328	S	S	*	.	H	α-helix	trans	-65	-33.4	172.3	-57.1	-46.2	0	0	0	111.4	A276 R277 F278	D274-A276 PolarHBondContact O-N 3.35Å; D274-R277 WeakPolarHBondContact O-CB 3.17Å; D274-R277 PolarHBondContact O-N 3.17Å; D274-R277 IonicContact OD1-CZ 2.85Å; D274-R277 IonicContact OD1-NH1 3.47Å; D274-R277 PolarHBondContact OD1-NH1 2.95Å; D274-R277 IonicContact OD1-NH2 2.76Å; D274-R277 PolarHBondContact OD1-NH2 2.97Å; D274-F278 PolarHBondContact O-N 3Å
275	V	94.3	Very high	95.4	Very high	94 Å²	94	67 Å²	67	57%	0.57	31%	0.311	S	S	*	.	H	α-helix	trans	-56	-31.3	172.2	-177	0	0	0	0	112.3	K273 R277 F278 E279	K273-V275 VanDerWaalsContact C-N 3.25Å; K273-V275 PolarHBondContact O-N 3.46Å; V275-R277 PolarHBondContact O-N 2.95Å; V275-F278 WeakPolarHBondContact O-CB 3.27Å; V275-F278 PolarHBondContact O-N 3.15Å; V275-E279 PolarHBondContact O-N 3.41Å
276	A	95.6	Very high	95.4	Very high	3 Å²	3	64.2 Å²	64.2	3%	0.025	30%	0.3	C	S	.	.	H	α-helix	trans	-68.7	-33.2	176.6	0	0	0	0	0	112.3	I244 Q269 K273 D274 F278 E279 V280	I244-A276 HydrophobicContact CD1-CB 4.09Å; I244-A276 HydrophobicContact CG1-CB 4.36Å; Q269-A276 HydrophobicContact CB-CB 3.82Å; K273-A276 HydrophobicContact CB-CB 4.07Å; K273-A276 WeakPolarHBondContact O-CB 3.36Å; K273-A276 PolarHBondContact O-N 3.31Å; K273-A276 VanDerWaalsContact O-N 3.1Å; D274-A276 PolarHBondContact O-N 3.35Å; A276-F278 VanDerWaalsContact C-N 3.33Å; A276-E279 PolarHBondContact O-N 3.12Å; A276-V280 VanDerWaalsContact O-CG2 3.28Å; A276-V280 WeakPolarHBondContact O-CG2 3.38Å; A276-V280 PolarHBondContact O-N 3.2Å
277	R	96	Very high	95.4	Very high	12 Å²	12	68.6 Å²	68.6	5%	0.045	32%	0.32	C	S	.	.	H	α-helix	trans	-66.9	-38.2	174.2	-59	-171.1	-152.5	106.5	31.4	111	C270 D274 V275 V280 R281 N310 Y313 D315 N318	C270-R277 HydrophobicContact CB-CG 3.88Å; C270-R277 PolarHBondContact O-NE 3.46Å; C270-R277 VanDerWaalsContact O-NE 3.12Å; C270-R277 PolarHBondContact O-NH2 3.28Å; D274-R277 WeakPolarHBondContact O-CB 3.17Å; D274-R277 PolarHBondContact O-N 3.17Å; D274-R277 IonicContact OD1-CZ 2.85Å; D274-R277 IonicContact OD1-NH1 3.47Å; D274-R277 PolarHBondContact OD1-NH1 2.95Å; D274-R277 IonicContact OD1-NH2 2.76Å; D274-R277 PolarHBondContact OD1-NH2 2.97Å; V275-R277 PolarHBondContact O-N 2.95Å; R277-V280 PolarHBondContact O-N 2.93Å; R277-R281 PolarHBondContact O-N 3.28Å; R277-N310 WeakPolarHBondContact CD-O 3.47Å; R277-N310 PolarHBondContact NE-O 3.47Å; R277-Y313 WeakPolarHBondContact CD-O 3.39Å; R277-Y313 PolarHBondContact NE-O 3.47Å; R277-Y313 PolarHBondContact NH1-O 3.2Å; R277-D315 HydrophobicContact CB-CB 4.31Å; R277-N318 PolarHBondContact O-ND2 3.24Å
278	F	95	Very high	95.4	Very high	98 Å²	98	68.4 Å²	68.4	43%	0.43	32%	0.318	S	S	.	.	H	α-helix	trans	-63.9	-44.5	172.3	-176.9	-89	0	0	0	112.1	D274 V275 A276 V280 R281 W282	D274-F278 PolarHBondContact O-N 3Å; V275-F278 WeakPolarHBondContact O-CB 3.27Å; V275-F278 PolarHBondContact O-N 3.15Å; A276-F278 VanDerWaalsContact C-N 3.33Å; F278-V280 PolarHBondContact O-N 3.09Å; F278-R281 VanDerWaalsContact CD2-NH2 3.3Å; F278-R281 WeakPolarHBondContact O-CB 3.18Å; F278-R281 PolarHBondContact O-N 3.12Å; F278-W282 AromaticContact CD1-CD1 3.6Å; F278-W282 AromaticContact CD1-NE1 3.89Å; F278-W282 AromaticContact CE1-CD1 3.36Å; F278-W282 AromaticContact CE1-NE1 3.19Å; F278-W282 AromaticContact CE2-NE1 3.73Å; F278-W282 AromaticContact CZ-CD1 3.73Å; F278-W282 AromaticContact CZ-NE1 3.11Å; F278-W282 PolarHBondContact O-N 3.41Å; F278-W282 VanDerWaalsContact O-N 3.09Å
279	E	95.8	Very high	95.5	Very high	72 Å²	72	66 Å²	66	34%	0.336	30%	0.301	S	S	.	.	H	α-helix	trans	-63	-38.5	174.5	-76	-177	-150.4	0	0	113	I244 V275 A276 W282 A283	I244-E279 HydrophobicContact CB-CB 4.05Å; I244-E279 WeakPolarHBondContact CB-OE2 3.35Å; I244-E279 HydrophobicContact CG1-CB 4.21Å; I244-E279 WeakPolarHBondContact CG1-OE2 3.45Å; I244-E279 HydrophobicContact CG2-CB 3.76Å; V275-E279 PolarHBondContact O-N 3.41Å; A276-E279 PolarHBondContact O-N 3.12Å; E279-W282 PolarHBondContact O-N 2.9Å; E279-A283 PolarHBondContact O-N 3.48Å
280	V	96.8	Very high	95.5	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.9	-43.9	174.3	167.2	0	0	0	0	110.7	I244 I266 A276 R277 F278 A283 H284 G285 V311	I244-V280 HydrophobicContact CD1-CG2 4.25Å; I244-V280 HydrophobicContact CG2-CB 4.44Å; I244-V280 HydrophobicContact CG2-CG2 3.62Å; I266-V280 HydrophobicContact CG2-CG2 3.78Å; A276-V280 VanDerWaalsContact O-CG2 3.28Å; A276-V280 WeakPolarHBondContact O-CG2 3.38Å; A276-V280 PolarHBondContact O-N 3.2Å; R277-V280 PolarHBondContact O-N 2.93Å; F278-V280 PolarHBondContact O-N 3.09Å; V280-A283 CarbonylContact O-C 3.54Å; V280-A283 PolarHBondContact O-N 3.22Å; V280-A283 VanDerWaalsContact O-N 3.1Å; V280-H284 PolarHBondContact O-N 3.43Å; V280-G285 PolarHBondContact O-N 2.77Å; V280-V311 HydrophobicContact CG1-CB 4.49Å; V280-V311 HydrophobicContact CG1-CG1 3.65Å; V280-V311 HydrophobicContact CG1-CG2 3.94Å; V280-V311 HydrophobicContact CG2-CG2 4.36Å
281	R	95.5	Very high	95.6	Very high	87 Å²	87	67.7 Å²	67.7	33%	0.328	31%	0.309	S	S	.	.	H	α-helix	trans	-58.7	-48.1	176.9	-163	170.1	56.2	150.5	-4.3	112.3	R277 F278 A283 H284 N318	R277-R281 PolarHBondContact O-N 3.28Å; F278-R281 VanDerWaalsContact CD2-NH2 3.3Å; F278-R281 WeakPolarHBondContact O-CB 3.18Å; F278-R281 PolarHBondContact O-N 3.12Å; R281-A283 PolarHBondContact O-N 2.79Å; R281-A283 VanDerWaalsContact O-N 3.16Å; R281-H284 PolarHBondContact O-N 3.15Å; R281-H284 VanDerWaalsContact O-N 3.09Å; R281-N318 WeakPolarHBondContact CA-OD1 3.36Å; R281-N318 WeakPolarHBondContact CB-OD1 3.33Å; R281-N318 WeakPolarHBondContact CG-OD1 3.49Å
282	W	94.7	Very high	95.8	Very high	187 Å²	187	61.3 Å²	61.3	71%	0.708	28%	0.282	S	S	*	.	H	α-helix	trans	-65.9	-13	176.9	-84.8	100.5	0	0	0	114.4	F278 E279	F278-W282 AromaticContact CD1-CD1 3.6Å; F278-W282 AromaticContact CD1-NE1 3.89Å; F278-W282 AromaticContact CE1-CD1 3.36Å; F278-W282 AromaticContact CE1-NE1 3.19Å; F278-W282 AromaticContact CE2-NE1 3.73Å; F278-W282 AromaticContact CZ-CD1 3.73Å; F278-W282 AromaticContact CZ-NE1 3.11Å; F278-W282 PolarHBondContact O-N 3.41Å; F278-W282 VanDerWaalsContact O-N 3.09Å; E279-W282 PolarHBondContact O-N 2.9Å
283	A	95.4	Very high	96.1	Very high	26 Å²	26	55 Å²	55	22%	0.215	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.4	6.3	175.6	0	0	0	0	0	113.3	V248 E279 V280 R281 G285	V248-A283 HydrophobicContact CB-CB 3.98Å; V248-A283 HydrophobicContact CG1-CB 3.68Å; V248-A283 WeakPolarHBondContact CG1-O 3.31Å; V248-A283 HydrophobicContact CG2-CB 4.16Å; E279-A283 PolarHBondContact O-N 3.48Å; V280-A283 CarbonylContact O-C 3.54Å; V280-A283 PolarHBondContact O-N 3.22Å; V280-A283 VanDerWaalsContact O-N 3.1Å; R281-A283 PolarHBondContact O-N 2.79Å; R281-A283 VanDerWaalsContact O-N 3.16Å; A283-G285 PolarHBondContact O-N 3.13Å
284	H	96.3	Very high	96.3	Very high	111 Å²	111	54.5 Å²	54.5	51%	0.514	25%	0.252	S	S	.	.	T	Hydrogen-bonded Turn	trans	52.7	38	-171.9	-62.9	-63.3	0	0	0	113.4	V280 R281 K288 E321	V280-H284 PolarHBondContact O-N 3.43Å; R281-H284 PolarHBondContact O-N 3.15Å; R281-H284 VanDerWaalsContact O-N 3.09Å; H284-K288 WeakPolarHBondContact O-CG 3.27Å; H284-K288 PolarHBondContact O-N 3.15Å; H284-E321 VanDerWaalsContact C-OE2 3.3Å; H284-E321 WeakPolarHBondContact CA-OE1 3.4Å; H284-E321 WeakPolarHBondContact CA-OE2 3.47Å; H284-E321 IonicContact CE1-OE1 3.53Å; H284-E321 IonicContact CG-OE1 2.71Å; H284-E321 IonicContact ND1-OE1 3.12Å; H284-E321 PolarHBondContact ND1-OE1 3.25Å
285	G	97.3	Very high	96.5	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-78.2	-25.3	-173.4	0	0	0	0	0	114.2	V280 A283 K288 L289	V280-G285 PolarHBondContact O-N 2.77Å; A283-G285 PolarHBondContact O-N 3.13Å; G285-K288 PolarHBondContact O-N 3.07Å; G285-L289 WeakPolarHBondContact O-CB 3.26Å; G285-L289 VanDerWaalsContact O-CG 3.27Å; G285-L289 WeakPolarHBondContact O-CG 3.33Å; G285-L289 PolarHBondContact O-N 3.31Å
286	A	97.8	Very high	96.5	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-70.5	-42.8	175.1	0	0	0	0	0	110	K288 L289 V290 L308 V311 N318 E321 V322	A286-K288 VanDerWaalsContact C-N 3.33Å; A286-K288 PolarHBondContact O-N 3.36Å; A286-L289 PolarHBondContact O-N 3.44Å; A286-V290 WeakPolarHBondContact O-CG2 3.42Å; A286-V290 PolarHBondContact O-N 3.11Å; A286-L308 HydrophobicContact CB-CD1 4.27Å; A286-V311 HydrophobicContact CB-CG1 3.8Å; A286-N318 HydrophobicContact CB-CB 4.46Å; A286-E321 WeakPolarHBondContact CA-OE2 3.2Å; A286-E321 HydrophobicContact CB-CB 4.31Å; A286-E321 HydrophobicContact CB-CG 4.16Å; A286-E321 VanDerWaalsContact CB-OE2 3.25Å; A286-E321 WeakPolarHBondContact CB-OE2 3.37Å; A286-E321 PolarHBondContact N-OE2 3.04Å; A286-V322 HydrophobicContact CB-CG2 4Å
287	K	97.5	Very high	96.6	Very high	92 Å²	92	55.6 Å²	55.6	40%	0.4	26%	0.256	S	S	.	.	H	α-helix	trans	-52.9	-47.1	170.2	171.8	176.1	180	100.9	0	112.2	V290 Q291 E321 E325	K287-V290 PolarHBondContact O-N 3.39Å; K287-Q291 PolarHBondContact O-N 3.2Å; K287-Q291 VanDerWaalsContact O-N 3.15Å; K287-E321 HydrophobicContact CB-CG 3.82Å; K287-E321 PolarHBondContact N-OE2 2.88Å; K287-E325 WeakPolarHBondContact CE-OE2 3.23Å; K287-E325 HydrophobicContact CG-CG 4.03Å; K287-E325 IonicContact NZ-OE2 2.63Å; K287-E325 PolarHBondContact NZ-OE2 2.93Å
288	K	97.8	Very high	96.6	Very high	52 Å²	52	59.3 Å²	59.3	23%	0.226	27%	0.274	C	S	.	.	H	α-helix	trans	-65.4	-44.8	178.4	-71.6	163.1	-173.6	-77.8	0	112.4	V248 L251 D252 H284 G285 A286 V290 Q291 L292	V248-K288 HydrophobicContact CG1-CD 3.58Å; L251-K288 HydrophobicContact CB-CB 4.19Å; L251-K288 HydrophobicContact CD1-CB 3.89Å; D252-K288 IonicContact OD1-NZ 2.74Å; D252-K288 PolarHBondContact OD1-NZ 3.18Å; D252-K288 IonicContact OD2-NZ 3.83Å; D252-K288 PolarHBondContact OD2-NZ 3.1Å; H284-K288 WeakPolarHBondContact O-CG 3.27Å; H284-K288 PolarHBondContact O-N 3.15Å; G285-K288 PolarHBondContact O-N 3.07Å; A286-K288 VanDerWaalsContact C-N 3.33Å; A286-K288 PolarHBondContact O-N 3.36Å; K288-V290 VanDerWaalsContact C-N 3.31Å; K288-V290 PolarHBondContact O-N 2.92Å; K288-Q291 PolarHBondContact O-N 3.32Å; K288-Q291 VanDerWaalsContact O-N 3.12Å; K288-L292 PolarHBondContact O-N 2.98Å; K288-L292 VanDerWaalsContact O-N 3.11Å
289	L	98.4	Very high	96.7	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.7	-38.8	175.2	-72	170.3	0	0	0	112.1	L251 A263 I266 G285 A286 Q291 L292 L293 A304 A307 L308 V311	L251-L289 HydrophobicContact CD1-CD2 3.88Å; L251-L289 HydrophobicContact CD1-CG 3.94Å; L251-L289 HydrophobicContact CD2-CD2 4.3Å; A263-L289 HydrophobicContact CB-CD2 4.21Å; I266-L289 HydrophobicContact CG2-CD1 4.29Å; G285-L289 WeakPolarHBondContact O-CB 3.26Å; G285-L289 VanDerWaalsContact O-CG 3.27Å; G285-L289 WeakPolarHBondContact O-CG 3.33Å; G285-L289 PolarHBondContact O-N 3.31Å; A286-L289 PolarHBondContact O-N 3.44Å; L289-Q291 VanDerWaalsContact C-N 3.33Å; L289-Q291 PolarHBondContact O-N 3.17Å; L289-L292 PolarHBondContact O-N 3.24Å; L289-L293 PolarHBondContact O-N 3.25Å; L289-A304 HydrophobicContact CD2-CB 4.35Å; L289-A307 HydrophobicContact CD1-CB 3.98Å; L289-A307 HydrophobicContact CD2-CB 3.9Å; L289-L308 HydrophobicContact CB-CB 4.43Å; L289-L308 HydrophobicContact CB-CD1 4.03Å; L289-L308 HydrophobicContact CD1-CD1 4.45Å; L289-V311 HydrophobicContact CD1-CG2 3.94Å
290	V	98.3	Very high	96.8	Very high	0 Å²	0	57 Å²	57	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.2	-36.6	173.4	167.5	0	0	0	0	112.2	A286 K287 K288 L293 L308 V322 E325 I330	A286-V290 WeakPolarHBondContact O-CG2 3.42Å; A286-V290 PolarHBondContact O-N 3.11Å; K287-V290 PolarHBondContact O-N 3.39Å; K288-V290 VanDerWaalsContact C-N 3.31Å; K288-V290 PolarHBondContact O-N 2.92Å; V290-L293 WeakPolarHBondContact O-CB 3.39Å; V290-L293 PolarHBondContact O-N 3.49Å; V290-L308 HydrophobicContact CG2-CD1 4.18Å; V290-L308 HydrophobicContact CG2-CD2 3.78Å; V290-V322 HydrophobicContact CG2-CB 4.29Å; V290-V322 HydrophobicContact CG2-CG1 3.94Å; V290-V322 HydrophobicContact CG2-CG2 3.88Å; V290-E325 HydrophobicContact CB-CG 4.33Å; V290-E325 HydrophobicContact CG1-CB 4.29Å; V290-E325 HydrophobicContact CG1-CG 3.83Å; V290-I330 HydrophobicContact CG1-CB 4.47Å; V290-I330 HydrophobicContact CG1-CD1 3.47Å; V290-I330 VanDerWaalsContact CG1-CD1 3.47Å; V290-I330 HydrophobicContact CG1-CG2 4.49Å
291	Q	97	Very high	96.8	Very high	70 Å²	70	58.1 Å²	58.1	33%	0.327	27%	0.27	S	S	.	.	H	α-helix	trans	-68.7	-34.5	173.2	-62.3	-49.5	-69.8	0	0	112.8	K287 K288 L289 L293 K294 E325	K287-Q291 PolarHBondContact O-N 3.2Å; K287-Q291 VanDerWaalsContact O-N 3.15Å; K288-Q291 PolarHBondContact O-N 3.32Å; K288-Q291 VanDerWaalsContact O-N 3.12Å; L289-Q291 VanDerWaalsContact C-N 3.33Å; L289-Q291 PolarHBondContact O-N 3.17Å; Q291-L293 PolarHBondContact O-N 2.85Å; Q291-K294 VanDerWaalsContact O-CB 3.31Å; Q291-K294 WeakPolarHBondContact O-CB 3.48Å; Q291-K294 PolarHBondContact O-N 3.18Å; Q291-E325 VanDerWaalsContact NE2-CG 3.32Å; Q291-E325 PolarHBondContact NE2-OE1 3.38Å
292	L	97.5	Very high	97	Very high	18 Å²	18	57 Å²	57	9%	0.094	27%	0.266	C	S	.	.	H	α-helix	trans	-68	-19	178.3	-68.3	179	0	0	0	113.8	L251 L259 K288 L289 K294 N295 V300 A304	L251-L292 HydrophobicContact CB-CD1 4.06Å; L251-L292 HydrophobicContact CD2-CD1 3.71Å; L251-L292 HydrophobicContact CG-CD1 4.3Å; L259-L292 HydrophobicContact CD1-CD2 3.99Å; L259-L292 HydrophobicContact CD2-CD1 4.03Å; L259-L292 HydrophobicContact CD2-CD2 3.82Å; L259-L292 HydrophobicContact CG-CD2 4.47Å; K288-L292 PolarHBondContact O-N 2.98Å; K288-L292 VanDerWaalsContact O-N 3.11Å; L289-L292 PolarHBondContact O-N 3.24Å; L292-K294 PolarHBondContact O-N 2.76Å; L292-N295 VanDerWaalsContact O-CB 3.23Å; L292-N295 WeakPolarHBondContact O-CB 3.39Å; L292-N295 PolarHBondContact O-N 2.87Å; L292-N295 VanDerWaalsContact O-N 3.12Å; L292-V300 HydrophobicContact CB-CG1 4.24Å; L292-V300 HydrophobicContact CD2-CG1 4.25Å; L292-A304 HydrophobicContact CB-CB 3.72Å
293	L	97.9	Very high	97.1	Very high	4 Å²	4	48.7 Å²	48.7	2%	0.021	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-14.1	168.1	-58.3	-178.6	0	0	0	113.2	L289 V290 Q291 A304 A305 L308 I330 I331 L334 L347	L289-L293 PolarHBondContact O-N 3.25Å; V290-L293 WeakPolarHBondContact O-CB 3.39Å; V290-L293 PolarHBondContact O-N 3.49Å; Q291-L293 PolarHBondContact O-N 2.85Å; L293-A304 HydrophobicContact CD2-CB 4Å; L293-A305 HydrophobicContact CD2-CB 3.91Å; L293-L308 HydrophobicContact CD1-CD2 4.04Å; L293-I330 HydrophobicContact CB-CG2 3.93Å; L293-I330 HydrophobicContact CD1-CG2 4.45Å; L293-I331 HydrophobicContact CD1-CG1 3.7Å; L293-L334 HydrophobicContact CB-CD2 4.03Å; L293-L334 HydrophobicContact CD2-CD2 4.07Å; L293-L347 HydrophobicContact CD1-CD2 4.16Å; L293-L347 HydrophobicContact CD2-CD2 4.2Å
294	K	96.6	Very high	97.3	Very high	111 Å²	111	47.5 Å²	47.5	48%	0.483	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-93.4	2.5	175.4	-53	172.3	-175.6	167.7	0	113.3	Q291 L292 I330	Q291-K294 VanDerWaalsContact O-CB 3.31Å; Q291-K294 WeakPolarHBondContact O-CB 3.48Å; Q291-K294 PolarHBondContact O-N 3.18Å; L292-K294 PolarHBondContact O-N 2.76Å; K294-I330 HydrophobicContact CG-CG2 3.93Å
295	N	95.9	Very high	97.4	Very high	45 Å²	45	42.2 Å²	42.2	24%	0.241	20%	0.203	C	C	.	.	S	Bend	trans	-73.8	146.8	177.7	-168.3	-79.4	0	0	0	110.5	L292 S297 V300 Q301	L292-N295 VanDerWaalsContact O-CB 3.23Å; L292-N295 WeakPolarHBondContact O-CB 3.39Å; L292-N295 PolarHBondContact O-N 2.87Å; L292-N295 VanDerWaalsContact O-N 3.12Å; N295-S297 VanDerWaalsContact C-N 3.29Å; N295-S297 PolarHBondContact O-N 2.96Å; N295-S297 VanDerWaalsContact OD1-CB 3.26Å; N295-S297 WeakPolarHBondContact OD1-CB 3.44Å; N295-S297 PolarHBondContact OD1-N 2.65Å; N295-V300 HydrophobicContact CB-CB 4.21Å; N295-V300 HydrophobicContact CB-CG1 3.8Å; N295-Q301 WeakPolarHBondContact O-CG 3.32Å; N295-Q301 PolarHBondContact O-NE2 3.34Å
296	D	94	Very high	97.5	Very high	161 Å²	161	42.5 Å²	42.5	86%	0.861	21%	0.205	S	C	*	.	S	Bend	trans	-73.2	-18.8	-179	-53.8	-68.6	0	0	0	113.7
297	S	96.4	Very high	97.5	Very high	22 Å²	22	42.5 Å²	42.5	15%	0.154	21%	0.205	C	C	.	.			trans	-84.5	117.4	-178.7	-179	0	0	0	0	112.1	E256 N295 E299 V300 Q301	E256-S297 WeakPolarHBondContact OE2-CB 3.44Å; E256-S297 PolarHBondContact OE2-OG 3.11Å; N295-S297 VanDerWaalsContact C-N 3.29Å; N295-S297 PolarHBondContact O-N 2.96Å; N295-S297 VanDerWaalsContact OD1-CB 3.26Å; N295-S297 WeakPolarHBondContact OD1-CB 3.44Å; N295-S297 PolarHBondContact OD1-N 2.65Å; S297-E299 PolarHBondContact O-N 2.86Å; S297-V300 PolarHBondContact O-N 2.94Å; S297-Q301 WeakPolarHBondContact O-CG 3.41Å; S297-Q301 PolarHBondContact O-N 3.05Å
298	E	95.8	Very high	97.6	Very high	90 Å²	90	38.1 Å²	38.1	42%	0.421	19%	0.186	S	C	.	.	H	α-helix	trans	-56.5	-33.1	175.7	-66.9	-168.9	167	0	0	112.8	Q301 R302	E298-Q301 PolarHBondContact O-N 2.93Å; E298-R302 WeakPolarHBondContact O-CB 3.28Å; E298-R302 PolarHBondContact O-N 3.2Å; E298-R302 PolarHBondContact O-NH1 3.17Å; E298-R302 IonicContact OE2-NH2 3.15Å
299	E	97.3	Very high	97.6	Very high	119 Å²	119	37.9 Å²	37.9	56%	0.556	18%	0.184	S	C	*	.	H	α-helix	trans	-66.1	-39.4	176.7	-65.9	-165.8	175.8	0	0	112	I260 S297 A303	I260-E299 HydrophobicContact CD1-CB 3.54Å; I260-E299 HydrophobicContact CG1-CB 4.27Å; S297-E299 PolarHBondContact O-N 2.86Å; E299-A303 VanDerWaalsContact O-CB 3.26Å; E299-A303 WeakPolarHBondContact O-CB 3.47Å; E299-A303 PolarHBondContact O-N 2.97Å
300	V	97.9	Very high	97.6	Very high	2 Å²	2	39.2 Å²	39.2	1%	0.012	19%	0.191	C	C	.	.	H	α-helix	trans	-68.4	-45.2	174.7	178.3	0	0	0	0	110.6	E256 L259 I260 L292 N295 S297 A303 A304	E256-V300 HydrophobicContact CB-CG2 3.9Å; E256-V300 HydrophobicContact CG-CG2 3.89Å; L259-V300 HydrophobicContact CB-CG1 4.29Å; L259-V300 HydrophobicContact CB-CG2 4.31Å; L259-V300 HydrophobicContact CD1-CG1 4.07Å; L259-V300 HydrophobicContact CD1-CG2 4.26Å; I260-V300 HydrophobicContact CD1-CG2 4.29Å; I260-V300 HydrophobicContact CG1-CG2 4.07Å; L292-V300 HydrophobicContact CB-CG1 4.24Å; L292-V300 HydrophobicContact CD2-CG1 4.25Å; N295-V300 HydrophobicContact CB-CB 4.21Å; N295-V300 HydrophobicContact CB-CG1 3.8Å; S297-V300 PolarHBondContact O-N 2.94Å; V300-A303 PolarHBondContact O-N 3.29Å; V300-A304 WeakPolarHBondContact O-CB 3.42Å; V300-A304 PolarHBondContact O-N 3.2Å
301	Q	98.2	Very high	97.6	Very high	24 Å²	24	39.2 Å²	39.2	11%	0.112	19%	0.191	C	C	.	.	H	α-helix	trans	-57.3	-51.5	176.2	-68.3	170.3	1.8	0	0	111.6	N295 S297 E298 A303 A304 A305 L334	N295-Q301 WeakPolarHBondContact O-CG 3.32Å; N295-Q301 PolarHBondContact O-NE2 3.34Å; S297-Q301 WeakPolarHBondContact O-CG 3.41Å; S297-Q301 PolarHBondContact O-N 3.05Å; E298-Q301 PolarHBondContact O-N 2.93Å; Q301-A303 PolarHBondContact O-N 2.96Å; Q301-A304 PolarHBondContact O-N 2.95Å; Q301-A305 WeakPolarHBondContact O-CB 3.46Å; Q301-A305 PolarHBondContact O-N 3.49Å; Q301-L334 HydrophobicContact CB-CD2 4.21Å; Q301-L334 HydrophobicContact CG-CD1 4.27Å; Q301-L334 HydrophobicContact CG-CD2 4.29Å
302	R	98.3	Very high	97.6	Very high	62 Å²	62	35.9 Å²	35.9	23%	0.234	18%	0.175	C	C	.	.	H	α-helix	trans	-59.8	-47.4	-179.7	-169.3	-173.3	-64.8	107.4	-3.6	111.4	E298 A306 D340 E342 T343	E298-R302 WeakPolarHBondContact O-CB 3.28Å; E298-R302 PolarHBondContact O-N 3.2Å; E298-R302 PolarHBondContact O-NH1 3.17Å; E298-R302 IonicContact OE2-NH2 3.15Å; R302-A306 VanDerWaalsContact O-CB 3.28Å; R302-A306 WeakPolarHBondContact O-CB 3.03Å; R302-A306 PolarHBondContact O-N 3.31Å; R302-D340 IonicContact CZ-OD1 3.89Å; R302-D340 IonicContact CZ-OD2 2.72Å; R302-D340 IonicContact NE-OD1 3.4Å; R302-D340 PolarHBondContact NE-OD1 2.99Å; R302-D340 IonicContact NE-OD2 2.77Å; R302-D340 PolarHBondContact NE-OD2 3.27Å; R302-D340 IonicContact NH2-OD1 3.87Å; R302-D340 PolarHBondContact NH2-OD1 3.35Å; R302-D340 IonicContact NH2-OD2 2.72Å; R302-D340 PolarHBondContact NH2-OD2 3.06Å; R302-E342 HydrophobicContact CG-CB 4.25Å; R302-E342 HydrophobicContact CG-CG 4.05Å; R302-T343 WeakPolarHBondContact CA-OG1 3.14Å; R302-T343 VanDerWaalsContact CB-OG1 3.31Å; R302-T343 WeakPolarHBondContact CB-OG1 3.17Å
303	A	98.3	Very high	97.6	Very high	14 Å²	14	39.8 Å²	39.8	12%	0.116	19%	0.19	C	C	.	.	H	α-helix	trans	-65.4	-41.3	177.7	0	0	0	0	0	112.2	I260 A263 E299 V300 Q301 A307	I260-A303 HydrophobicContact CB-CB 4.45Å; I260-A303 HydrophobicContact CG1-CB 4.37Å; I260-A303 HydrophobicContact CG2-CB 4.2Å; A263-A303 HydrophobicContact CB-CB 4Å; E299-A303 VanDerWaalsContact O-CB 3.26Å; E299-A303 WeakPolarHBondContact O-CB 3.47Å; E299-A303 PolarHBondContact O-N 2.97Å; V300-A303 PolarHBondContact O-N 3.29Å; Q301-A303 PolarHBondContact O-N 2.96Å; A303-A307 VanDerWaalsContact O-CB 3.31Å; A303-A307 WeakPolarHBondContact O-CB 3.34Å; A303-A307 PolarHBondContact O-N 2.84Å
304	A	98.6	Very high	97.4	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-65.8	-44.3	177.2	0	0	0	0	0	112.2	L289 L292 L293 V300 Q301 A307 L308	L289-A304 HydrophobicContact CD2-CB 4.35Å; L292-A304 HydrophobicContact CB-CB 3.72Å; L293-A304 HydrophobicContact CD2-CB 4Å; V300-A304 WeakPolarHBondContact O-CB 3.42Å; V300-A304 PolarHBondContact O-N 3.2Å; Q301-A304 PolarHBondContact O-N 2.95Å; A304-A307 PolarHBondContact O-N 3.08Å; A304-L308 VanDerWaalsContact O-CB 3.22Å; A304-L308 WeakPolarHBondContact O-CB 3.43Å; A304-L308 PolarHBondContact O-N 3.42Å
305	A	98.6	Very high	97.4	Very high	0 Å²	0	42.2 Å²	42.2	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-62.5	-45.4	176.5	0	0	0	0	0	112	L293 Q301 A307 L308 R309 Q346 L347	L293-A305 HydrophobicContact CD2-CB 3.91Å; Q301-A305 WeakPolarHBondContact O-CB 3.46Å; Q301-A305 PolarHBondContact O-N 3.49Å; A305-A307 PolarHBondContact O-N 3.29Å; A305-L308 PolarHBondContact O-N 2.89Å; A305-R309 PolarHBondContact O-N 3.35Å; A305-Q346 HydrophobicContact CB-CB 3.94Å; A305-L347 HydrophobicContact CB-CD2 3.74Å; A305-L347 HydrophobicContact CB-CG 4.13Å
306	A	98.4	Very high	97.4	Very high	7 Å²	7	45.6 Å²	45.6	6%	0.058	21%	0.214	C	C	.	.	H	α-helix	trans	-65.1	-38.2	178.7	0	0	0	0	0	112.4	R302 Q346	R302-A306 VanDerWaalsContact O-CB 3.28Å; R302-A306 WeakPolarHBondContact O-CB 3.03Å; R302-A306 PolarHBondContact O-N 3.31Å; A306-Q346 HydrophobicContact CB-CB 4.48Å; A306-Q346 HydrophobicContact CB-CG 3.86Å
307	A	98.6	Very high	97.5	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-66	-47.3	171.6	0	0	0	0	0	111.9	A263 Q267 L289 A303 A304 A305 R309 N310 V311	A263-A307 HydrophobicContact CB-CB 4.17Å; A263-A307 WeakPolarHBondContact O-CB 3.48Å; Q267-A307 HydrophobicContact CB-CB 4Å; L289-A307 HydrophobicContact CD1-CB 3.98Å; L289-A307 HydrophobicContact CD2-CB 3.9Å; A303-A307 VanDerWaalsContact O-CB 3.31Å; A303-A307 WeakPolarHBondContact O-CB 3.34Å; A303-A307 PolarHBondContact O-N 2.84Å; A304-A307 PolarHBondContact O-N 3.08Å; A305-A307 PolarHBondContact O-N 3.29Å; A307-R309 VanDerWaalsContact C-N 3.31Å; A307-R309 PolarHBondContact O-N 3.48Å; A307-N310 PolarHBondContact O-N 3.19Å; A307-N310 VanDerWaalsContact O-N 3.13Å; A307-V311 WeakPolarHBondContact O-CG2 3.32Å; A307-V311 PolarHBondContact O-N 2.89Å
308	L	98.7	Very high	97.5	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-58.9	-42.7	-177.8	-171.4	61.9	0	0	0	111.6	A286 L289 V290 L293 A304 A305 N310 V311 V312 V322 I331 V350	A286-L308 HydrophobicContact CB-CD1 4.27Å; L289-L308 HydrophobicContact CB-CB 4.43Å; L289-L308 HydrophobicContact CB-CD1 4.03Å; L289-L308 HydrophobicContact CD1-CD1 4.45Å; V290-L308 HydrophobicContact CG2-CD1 4.18Å; V290-L308 HydrophobicContact CG2-CD2 3.78Å; L293-L308 HydrophobicContact CD1-CD2 4.04Å; A304-L308 VanDerWaalsContact O-CB 3.22Å; A304-L308 WeakPolarHBondContact O-CB 3.43Å; A304-L308 PolarHBondContact O-N 3.42Å; A305-L308 PolarHBondContact O-N 2.89Å; L308-N310 VanDerWaalsContact C-N 3.29Å; L308-N310 PolarHBondContact O-N 3.45Å; L308-V311 WeakPolarHBondContact O-CB 3.35Å; L308-V311 PolarHBondContact O-N 3.12Å; L308-V312 HydrophobicContact CD1-CG1 4.35Å; L308-V312 WeakPolarHBondContact O-CG2 3.38Å; L308-V312 PolarHBondContact O-N 3.39Å; L308-V322 HydrophobicContact CD1-CG2 3.7Å; L308-V322 HydrophobicContact CG-CG2 4.45Å; L308-I331 HydrophobicContact CD2-CD1 4.42Å; L308-V350 HydrophobicContact CB-CG2 4.21Å; L308-V350 HydrophobicContact CD2-CG1 4.14Å; L308-V350 HydrophobicContact CD2-CG2 4.33Å; L308-V350 HydrophobicContact CG-CG1 4.29Å; L308-V350 HydrophobicContact CG-CG2 4.23Å
309	R	98.5	Very high	97.7	Very high	46 Å²	46	34 Å²	34	17%	0.174	16%	0.157	C	C	.	.	H	α-helix	trans	-53.3	-45.1	175.7	-175.9	-177.5	-175.4	160.3	8.2	112.4	A305 A307 Y313 C345 V350 N353 C402	A305-R309 PolarHBondContact O-N 3.35Å; A307-R309 VanDerWaalsContact C-N 3.31Å; A307-R309 PolarHBondContact O-N 3.48Å; R309-Y313 PolarHBondContact O-N 3.25Å; R309-C345 PolarHBondContact NH1-O 2.95Å; R309-V350 HydrophobicContact CB-CG2 3.87Å; R309-N353 PolarHBondContact O-ND2 3.01Å; R309-C402 PolarHBondContact NH2-SG 2.91Å
310	N	98.5	Very high	97.6	Very high	28 Å²	28	34.1 Å²	34.1	15%	0.15	16%	0.156	C	C	.	.	H	α-helix	trans	-75.9	-25.1	178.6	-72.9	0.2	0	0	0	112.9	Q267 C270 R277 A307 L308	Q267-N310 WeakPolarHBondContact CG-ND2 3.46Å; Q267-N310 PolarHBondContact O-ND2 2.98Å; C270-N310 HydrophobicContact CB-CB 3.98Å; R277-N310 WeakPolarHBondContact CD-O 3.47Å; R277-N310 PolarHBondContact NE-O 3.47Å; A307-N310 PolarHBondContact O-N 3.19Å; A307-N310 VanDerWaalsContact O-N 3.13Å; L308-N310 VanDerWaalsContact C-N 3.29Å; L308-N310 PolarHBondContact O-N 3.45Å
311	V	98.3	Very high	97.6	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-74.7	-39.5	177.2	164.4	0	0	0	0	111.9	I266 C270 V280 A286 L289 A307 L308 N318	I266-V311 HydrophobicContact CG2-CG2 3.69Å; C270-V311 HydrophobicContact CB-CG2 4.32Å; V280-V311 HydrophobicContact CG1-CB 4.49Å; V280-V311 HydrophobicContact CG1-CG1 3.65Å; V280-V311 HydrophobicContact CG1-CG2 3.94Å; V280-V311 HydrophobicContact CG2-CG2 4.36Å; A286-V311 HydrophobicContact CB-CG1 3.8Å; L289-V311 HydrophobicContact CD1-CG2 3.94Å; A307-V311 WeakPolarHBondContact O-CG2 3.32Å; A307-V311 PolarHBondContact O-N 2.89Å; L308-V311 WeakPolarHBondContact O-CB 3.35Å; L308-V311 PolarHBondContact O-N 3.12Å; V311-N318 HydrophobicContact CG1-CB 3.95Å; V311-N318 WeakPolarHBondContact O-CB 3.42Å; V311-N318 PolarHBondContact O-ND2 3.36Å
312	V	98.2	Very high	97.6	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-82.4	-9.3	177.7	-61	0	0	0	0	114.3	L308 K314 K319 V322 V350 N353 L354	L308-V312 HydrophobicContact CD1-CG1 4.35Å; L308-V312 WeakPolarHBondContact O-CG2 3.38Å; L308-V312 PolarHBondContact O-N 3.39Å; V312-K314 PolarHBondContact O-N 2.75Å; V312-K319 HydrophobicContact CB-CG 3.94Å; V312-K319 WeakPolarHBondContact O-CE 3.19Å; V312-K319 WeakPolarHBondContact O-CG 3.31Å; V312-V322 HydrophobicContact CG1-CG2 3.7Å; V312-V350 HydrophobicContact CG2-CG1 4.28Å; V312-N353 HydrophobicContact CG2-CB 3.54Å; V312-L354 HydrophobicContact CG1-CD2 4.44Å
313	Y	96.9	Very high	97.5	Very high	101 Å²	101	32 Å²	32	40%	0.396	15%	0.15	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66	119.7	-178.2	-175.5	-108.8	0	0	0	111.5	R277 R309 D315	R277-Y313 WeakPolarHBondContact CD-O 3.39Å; R277-Y313 PolarHBondContact NE-O 3.47Å; R277-Y313 PolarHBondContact NH1-O 3.2Å; R309-Y313 PolarHBondContact O-N 3.25Å; Y313-D315 PolarHBondContact O-N 3.37Å
314	K	93.8	Very high	97.4	Very high	141 Å²	141	36.4 Å²	36.4	61%	0.613	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.2	3	-178.3	-67.8	177.8	172.3	167.8	0	117.1	V312	V312-K314 PolarHBondContact O-N 2.75Å
315	D	95.8	Very high	97.3	Very high	24 Å²	24	38.3 Å²	38.3	13%	0.128	18%	0.18	C	C	.	.			trans	-104.1	99.7	178.4	-169.2	-48.3	0	0	0	111	R277 Y313 G317 N318 K319	R277-D315 HydrophobicContact CB-CB 4.31Å; Y313-D315 PolarHBondContact O-N 3.37Å; D315-G317 PolarHBondContact O-N 2.88Å; D315-G317 VanDerWaalsContact OD1-CA 3.27Å; D315-G317 WeakPolarHBondContact OD1-CA 3.4Å; D315-G317 PolarHBondContact OD1-N 3.5Å; D315-N318 HydrophobicContact CB-CB 4.13Å; D315-N318 PolarHBondContact O-N 3.47Å; D315-N318 PolarHBondContact OD1-N 2.93Å; D315-K319 WeakPolarHBondContact O-CG 3.34Å; D315-K319 PolarHBondContact O-N 2.88Å
316	K	95.6	Very high	97.2	Very high	117 Å²	117	43.6 Å²	43.6	51%	0.509	21%	0.209	S	C	.	.	H	α-helix	trans	-56.7	-28.8	176.8	-82.6	-155.3	173.3	-158.3	0	112.7	K320 V357 E359	K316-K320 PolarHBondContact O-N 3.33Å; K316-K320 VanDerWaalsContact O-N 3.08Å; K316-V357 HydrophobicContact CG-CG2 4.2Å; K316-E359 IonicContact NZ-OE1 3.54Å; K316-E359 PolarHBondContact NZ-OE1 2.85Å; K316-E359 IonicContact NZ-OE2 2.64Å; K316-E359 PolarHBondContact NZ-OE2 3.29Å
317	G	96.3	Very high	97.2	Very high	19 Å²	19	43.3 Å²	43.3	20%	0.196	21%	0.206	C	C	.	.	H	α-helix	trans	-74.1	-43.8	-179.7	0	0	0	0	0	113.1	D315 K320 E321	D315-G317 PolarHBondContact O-N 2.88Å; D315-G317 VanDerWaalsContact OD1-CA 3.27Å; D315-G317 WeakPolarHBondContact OD1-CA 3.4Å; D315-G317 PolarHBondContact OD1-N 3.5Å; G317-K320 PolarHBondContact O-N 3.49Å; G317-E321 PolarHBondContact O-N 3.05Å
318	N	97.8	Very high	97.1	Very high	0 Å²	0	44 Å²	44	0%	0	21%	0.21	C	C	.	.	H	α-helix	trans	-67.7	-37.9	173.5	-73.8	-27	0	0	0	111.7	R277 R281 A286 V311 D315 K320 E321 V322	R277-N318 PolarHBondContact O-ND2 3.24Å; R281-N318 WeakPolarHBondContact CA-OD1 3.36Å; R281-N318 WeakPolarHBondContact CB-OD1 3.33Å; R281-N318 WeakPolarHBondContact CG-OD1 3.49Å; A286-N318 HydrophobicContact CB-CB 4.46Å; V311-N318 HydrophobicContact CG1-CB 3.95Å; V311-N318 WeakPolarHBondContact O-CB 3.42Å; V311-N318 PolarHBondContact O-ND2 3.36Å; D315-N318 HydrophobicContact CB-CB 4.13Å; D315-N318 PolarHBondContact O-N 3.47Å; D315-N318 PolarHBondContact OD1-N 2.93Å; N318-K320 VanDerWaalsContact C-N 3.28Å; N318-K320 PolarHBondContact O-N 2.94Å; N318-E321 PolarHBondContact O-N 3.32Å; N318-V322 WeakPolarHBondContact O-CG2 3.22Å; N318-V322 PolarHBondContact O-N 2.85Å
319	K	98.2	Very high	97	Very high	11 Å²	11	47.7 Å²	47.7	5%	0.048	23%	0.232	C	C	.	.	H	α-helix	trans	-56.3	-44.6	171.8	-68.5	178.8	-171.6	-158.7	0	111.1	V312 D315 V322 T323 N353 L354 S356 V357 I360	V312-K319 HydrophobicContact CB-CG 3.94Å; V312-K319 WeakPolarHBondContact O-CE 3.19Å; V312-K319 WeakPolarHBondContact O-CG 3.31Å; D315-K319 WeakPolarHBondContact O-CG 3.34Å; D315-K319 PolarHBondContact O-N 2.88Å; K319-V322 PolarHBondContact O-N 3.36Å; K319-T323 PolarHBondContact O-N 3.05Å; K319-N353 WeakPolarHBondContact CD-O 3.35Å; K319-N353 WeakPolarHBondContact CE-O 3.19Å; K319-N353 PolarHBondContact NZ-O 2.85Å; K319-L354 HydrophobicContact CB-CD2 3.95Å; K319-L354 HydrophobicContact CG-CD2 4.13Å; K319-S356 PolarHBondContact NZ-O 2.86Å; K319-S356 PolarHBondContact NZ-OG 3.07Å; K319-V357 HydrophobicContact CD-CG2 3.3Å; K319-I360 HydrophobicContact CB-CD1 3.71Å
320	K	96.6	Very high	97	Very high	120 Å²	120	46.4 Å²	46.4	52%	0.522	23%	0.228	S	C	.	.	H	α-helix	trans	-66.7	-42.5	175.5	-178.8	165.4	179.3	167.2	0	113.5	K316 G317 N318 V322 T323 D324	K316-K320 PolarHBondContact O-N 3.33Å; K316-K320 VanDerWaalsContact O-N 3.08Å; G317-K320 PolarHBondContact O-N 3.49Å; N318-K320 VanDerWaalsContact C-N 3.28Å; N318-K320 PolarHBondContact O-N 2.94Å; K320-V322 PolarHBondContact O-N 2.95Å; K320-T323 WeakPolarHBondContact CA-OG1 3.24Å; K320-T323 PolarHBondContact O-N 3.22Å; K320-T323 PolarHBondContact O-OG1 3.04Å; K320-D324 VanDerWaalsContact CE-OD1 3.27Å; K320-D324 WeakPolarHBondContact CE-OD1 3.44Å; K320-D324 WeakPolarHBondContact CE-OD2 3.42Å; K320-D324 WeakPolarHBondContact CG-OD1 3.45Å; K320-D324 WeakPolarHBondContact CG-OD2 3.43Å; K320-D324 WeakPolarHBondContact O-CB 3.21Å; K320-D324 PolarHBondContact O-N 3.06Å
321	E	97.4	Very high	97	Very high	25 Å²	25	45 Å²	45	12%	0.117	22%	0.221	C	C	.	.	H	α-helix	trans	-59.3	-31	175.4	179.5	169.1	-96.5	0	0	112	H284 A286 K287 G317 N318 E325	H284-E321 VanDerWaalsContact C-OE2 3.3Å; H284-E321 WeakPolarHBondContact CA-OE1 3.4Å; H284-E321 WeakPolarHBondContact CA-OE2 3.47Å; H284-E321 IonicContact CE1-OE1 3.53Å; H284-E321 IonicContact CG-OE1 2.71Å; H284-E321 IonicContact ND1-OE1 3.12Å; H284-E321 PolarHBondContact ND1-OE1 3.25Å; A286-E321 WeakPolarHBondContact CA-OE2 3.2Å; A286-E321 HydrophobicContact CB-CB 4.31Å; A286-E321 HydrophobicContact CB-CG 4.16Å; A286-E321 VanDerWaalsContact CB-OE2 3.25Å; A286-E321 WeakPolarHBondContact CB-OE2 3.37Å; A286-E321 PolarHBondContact N-OE2 3.04Å; K287-E321 HydrophobicContact CB-CG 3.82Å; K287-E321 PolarHBondContact N-OE2 2.88Å; G317-E321 PolarHBondContact O-N 3.05Å; N318-E321 PolarHBondContact O-N 3.32Å; E321-E325 WeakPolarHBondContact O-CB 3.33Å; E321-E325 PolarHBondContact O-N 3.38Å
322	V	98.1	Very high	96.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-70.9	-41.1	173.1	173.7	0	0	0	0	112.2	A286 V290 L308 V312 N318 K319 K320 G327 I331 L354	A286-V322 HydrophobicContact CB-CG2 4Å; V290-V322 HydrophobicContact CG2-CB 4.29Å; V290-V322 HydrophobicContact CG2-CG1 3.94Å; V290-V322 HydrophobicContact CG2-CG2 3.88Å; L308-V322 HydrophobicContact CD1-CG2 3.7Å; L308-V322 HydrophobicContact CG-CG2 4.45Å; V312-V322 HydrophobicContact CG1-CG2 3.7Å; N318-V322 WeakPolarHBondContact O-CG2 3.22Å; N318-V322 PolarHBondContact O-N 2.85Å; K319-V322 PolarHBondContact O-N 3.36Å; K320-V322 PolarHBondContact O-N 2.95Å; V322-G327 WeakPolarHBondContact O-CA 3.34Å; V322-G327 PolarHBondContact O-N 3.44Å; V322-I331 HydrophobicContact CG1-CD1 4.33Å; V322-L354 HydrophobicContact CB-CD2 4.28Å; V322-L354 HydrophobicContact CG1-CD1 3.99Å; V322-L354 HydrophobicContact CG1-CD2 4.19Å
323	T	96.6	Very high	96.9	Very high	20 Å²	20	49.9 Å²	49.9	12%	0.123	25%	0.247	C	C	.	.	H	α-helix	trans	-69.6	-41.2	177.5	52.8	0	0	0	0	112.4	K319 K320 E325 N326 L328 I360 L363	K319-T323 PolarHBondContact O-N 3.05Å; K320-T323 WeakPolarHBondContact CA-OG1 3.24Å; K320-T323 PolarHBondContact O-N 3.22Å; K320-T323 PolarHBondContact O-OG1 3.04Å; T323-E325 PolarHBondContact O-N 3.05Å; T323-E325 VanDerWaalsContact O-N 3.17Å; T323-N326 PolarHBondContact O-N 2.61Å; T323-L328 HydrophobicContact CG2-CD1 4.41Å; T323-I360 HydrophobicContact CG2-CB 4.44Å; T323-I360 HydrophobicContact CG2-CD1 3.98Å; T323-I360 HydrophobicContact CG2-CG1 4.05Å; T323-I360 HydrophobicContact CG2-CG2 3.63Å; T323-L363 HydrophobicContact CG2-CD1 3.75Å
324	D	96.3	Very high	96.9	Very high	106 Å²	106	45.7 Å²	45.7	57%	0.567	23%	0.232	S	C	*	.	H	α-helix	trans	-65.8	-16.4	-179.2	-66.3	1.8	0	0	0	112.5	K320	K320-D324 VanDerWaalsContact CE-OD1 3.27Å; K320-D324 WeakPolarHBondContact CE-OD1 3.44Å; K320-D324 WeakPolarHBondContact CE-OD2 3.42Å; K320-D324 WeakPolarHBondContact CG-OD1 3.45Å; K320-D324 WeakPolarHBondContact CG-OD2 3.43Å; K320-D324 WeakPolarHBondContact O-CB 3.21Å; K320-D324 PolarHBondContact O-N 3.06Å
325	E	96.6	Very high	97	Very high	39 Å²	39	39 Å²	39	18%	0.182	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-99.9	18.5	175.5	-169.2	53.6	-142.8	0	0	113	K287 V290 Q291 E321 T323 G327 I330	K287-E325 WeakPolarHBondContact CE-OE2 3.23Å; K287-E325 HydrophobicContact CG-CG 4.03Å; K287-E325 IonicContact NZ-OE2 2.63Å; K287-E325 PolarHBondContact NZ-OE2 2.93Å; V290-E325 HydrophobicContact CB-CG 4.33Å; V290-E325 HydrophobicContact CG1-CB 4.29Å; V290-E325 HydrophobicContact CG1-CG 3.83Å; Q291-E325 VanDerWaalsContact NE2-CG 3.32Å; Q291-E325 PolarHBondContact NE2-OE1 3.38Å; E321-E325 WeakPolarHBondContact O-CB 3.33Å; E321-E325 PolarHBondContact O-N 3.38Å; T323-E325 PolarHBondContact O-N 3.05Å; T323-E325 VanDerWaalsContact O-N 3.17Å; E325-G327 PolarHBondContact O-N 2.98Å; E325-I330 VanDerWaalsContact O-CD1 3.29Å; E325-I330 WeakPolarHBondContact O-CD1 3.31Å
326	N	96.3	Very high	96.9	Very high	112 Å²	112	40.9 Å²	40.9	60%	0.599	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.9	29.5	-171.7	-64.9	21.5	0	0	0	113.3	T323 L328 T329 I330	T323-N326 PolarHBondContact O-N 2.61Å; N326-L328 VanDerWaalsContact C-N 3.3Å; N326-L328 PolarHBondContact O-N 3.24Å; N326-T329 PolarHBondContact O-N 3.18Å; N326-T329 VanDerWaalsContact O-N 3.1Å; N326-I330 PolarHBondContact O-N 3.28Å
327	G	97.2	Very high	96.8	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.8	-35.2	-170.8	0	0	0	0	0	114.3	V322 E325 T329 I330 I331	V322-G327 WeakPolarHBondContact O-CA 3.34Å; V322-G327 PolarHBondContact O-N 3.44Å; E325-G327 PolarHBondContact O-N 2.98Å; G327-T329 PolarHBondContact O-N 2.91Å; G327-I330 PolarHBondContact O-N 3.07Å; G327-I331 WeakPolarHBondContact O-CB 3.29Å; G327-I331 WeakPolarHBondContact O-CD1 3.1Å; G327-I331 WeakPolarHBondContact O-CG1 3.43Å; G327-I331 PolarHBondContact O-N 3.38Å
328	L	97.1	Very high	96.7	Very high	16 Å²	16	42 Å²	42	8%	0.084	21%	0.213	C	C	.	.	H	α-helix	trans	-58.8	-46.1	175.7	-72.3	170.8	0	0	0	112	T323 N326 I330 I331 L332 L351 L354 L363 F364	T323-L328 HydrophobicContact CG2-CD1 4.41Å; N326-L328 VanDerWaalsContact C-N 3.3Å; N326-L328 PolarHBondContact O-N 3.24Å; L328-I330 VanDerWaalsContact C-N 3.33Å; L328-I330 PolarHBondContact O-N 3.13Å; L328-I331 PolarHBondContact O-N 3.32Å; L328-L332 WeakPolarHBondContact O-CB 3.42Å; L328-L332 WeakPolarHBondContact O-CG 3.38Å; L328-L332 PolarHBondContact O-N 3.44Å; L328-L351 HydrophobicContact CD2-CD2 3.77Å; L328-L354 HydrophobicContact CD2-CD1 3.63Å; L328-L354 HydrophobicContact CG-CD1 4.38Å; L328-L363 HydrophobicContact CD1-CB 3.47Å; L328-L363 VanDerWaalsContact CD1-CB 3.47Å; L328-L363 HydrophobicContact CD1-CD1 4.24Å; L328-F364 HydrophobicContact CD1-CE2 4.49Å; L328-F364 HydrophobicContact CD2-CE1 3.98Å; L328-F364 HydrophobicContact CD2-CE2 4.27Å; L328-F364 HydrophobicContact CD2-CZ 3.83Å
329	T	97.1	Very high	96.3	Very high	76 Å²	76	48.6 Å²	48.6	47%	0.466	24%	0.243	S	C	.	.	H	α-helix	trans	-64.3	-38.7	176.7	-42.9	0	0	0	0	111.6	N326 G327 N333	N326-T329 PolarHBondContact O-N 3.18Å; N326-T329 VanDerWaalsContact O-N 3.1Å; G327-T329 PolarHBondContact O-N 2.91Å; T329-N333 VanDerWaalsContact O-CB 3.27Å; T329-N333 WeakPolarHBondContact O-CB 3.36Å; T329-N333 PolarHBondContact O-N 3.32Å; T329-N333 PolarHBondContact O-ND2 2.68Å
330	I	98.2	Very high	96	Very high	19 Å²	19	49.3 Å²	49.3	10%	0.097	25%	0.248	C	C	.	.	H	α-helix	trans	-68.7	-44.7	179.8	-62.7	160.8	0	0	0	110.7	V290 L293 K294 E325 N326 G327 L328 N333 L334	V290-I330 HydrophobicContact CG1-CB 4.47Å; V290-I330 HydrophobicContact CG1-CD1 3.47Å; V290-I330 VanDerWaalsContact CG1-CD1 3.47Å; V290-I330 HydrophobicContact CG1-CG2 4.49Å; L293-I330 HydrophobicContact CB-CG2 3.93Å; L293-I330 HydrophobicContact CD1-CG2 4.45Å; K294-I330 HydrophobicContact CG-CG2 3.93Å; E325-I330 VanDerWaalsContact O-CD1 3.29Å; E325-I330 WeakPolarHBondContact O-CD1 3.31Å; N326-I330 PolarHBondContact O-N 3.28Å; G327-I330 PolarHBondContact O-N 3.07Å; L328-I330 VanDerWaalsContact C-N 3.33Å; L328-I330 PolarHBondContact O-N 3.13Å; I330-N333 PolarHBondContact O-N 3.13Å; I330-L334 PolarHBondContact O-N 3.34Å; I330-L334 VanDerWaalsContact O-N 3.09Å
331	I	98.3	Very high	95.8	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-59.9	-46.2	175.7	-72.5	161.7	0	0	0	110.6	L293 L308 V322 G327 L328 L334 L335 L347 V350 L351 L354	L293-I331 HydrophobicContact CD1-CG1 3.7Å; L308-I331 HydrophobicContact CD2-CD1 4.42Å; V322-I331 HydrophobicContact CG1-CD1 4.33Å; G327-I331 WeakPolarHBondContact O-CB 3.29Å; G327-I331 WeakPolarHBondContact O-CD1 3.1Å; G327-I331 WeakPolarHBondContact O-CG1 3.43Å; G327-I331 PolarHBondContact O-N 3.38Å; L328-I331 PolarHBondContact O-N 3.32Å; I331-L334 PolarHBondContact O-N 3.13Å; I331-L335 VanDerWaalsContact O-CB 3.29Å; I331-L335 WeakPolarHBondContact O-CB 3.47Å; I331-L335 PolarHBondContact O-N 2.71Å; I331-L347 HydrophobicContact CG1-CD2 4.23Å; I331-L347 HydrophobicContact CG2-CB 4.19Å; I331-L347 HydrophobicContact CG2-CD2 4.08Å; I331-V350 HydrophobicContact CD1-CB 4.38Å; I331-V350 HydrophobicContact CD1-CG1 3.6Å; I331-L351 HydrophobicContact CG2-CD1 3.81Å; I331-L351 HydrophobicContact CG2-CD2 3.78Å; I331-L351 HydrophobicContact CG2-CG 3.76Å; I331-L354 HydrophobicContact CD1-CD1 4.18Å
332	L	97.2	Very high	95.6	Very high	12 Å²	12	48.6 Å²	48.6	6%	0.063	25%	0.245	C	C	.	.	H	α-helix	trans	-64.8	-44.1	177.7	-76.7	165.9	0	0	0	112.8	L328 L334 L335 D336 F368 V371	L328-L332 WeakPolarHBondContact O-CB 3.42Å; L328-L332 WeakPolarHBondContact O-CG 3.38Å; L328-L332 PolarHBondContact O-N 3.44Å; L332-L334 PolarHBondContact O-N 3.07Å; L332-L335 PolarHBondContact O-N 3.5Å; L332-D336 PolarHBondContact O-N 3.37Å; L332-F368 HydrophobicContact CD1-CB 3.87Å; L332-F368 HydrophobicContact CD1-CD2 4.4Å; L332-F368 HydrophobicContact CD2-CB 4.25Å; L332-F368 HydrophobicContact CD2-CD2 3.92Å; L332-V371 HydrophobicContact CD2-CB 3.95Å; L332-V371 HydrophobicContact CD2-CG1 3.91Å
333	N	97.1	Very high	95.6	Very high	89 Å²	89	48.6 Å²	48.6	48%	0.476	25%	0.245	S	C	.	.	H	α-helix	trans	-64.7	-24.5	178.2	-76.5	-18.2	0	0	0	113.4	T329 I330 K337	T329-N333 VanDerWaalsContact O-CB 3.27Å; T329-N333 WeakPolarHBondContact O-CB 3.36Å; T329-N333 PolarHBondContact O-N 3.32Å; T329-N333 PolarHBondContact O-ND2 2.68Å; I330-N333 PolarHBondContact O-N 3.13Å; N333-K337 VanDerWaalsContact O-CD 3.24Å; N333-K337 WeakPolarHBondContact O-CD 3.24Å; N333-K337 VanDerWaalsContact O-CG 3.31Å; N333-K337 WeakPolarHBondContact O-CG 3.31Å
334	L	97.5	Very high	95.6	Very high	14 Å²	14	47.7 Å²	47.7	7%	0.073	24%	0.239	C	C	.	.	H	α-helix	trans	-83.5	-42.6	170.9	177.7	58.7	0	0	0	111.2	L293 Q301 I330 I331 L332 D336 K337 T338 T343 L347	L293-L334 HydrophobicContact CB-CD2 4.03Å; L293-L334 HydrophobicContact CD2-CD2 4.07Å; Q301-L334 HydrophobicContact CB-CD2 4.21Å; Q301-L334 HydrophobicContact CG-CD1 4.27Å; Q301-L334 HydrophobicContact CG-CD2 4.29Å; I330-L334 PolarHBondContact O-N 3.34Å; I330-L334 VanDerWaalsContact O-N 3.09Å; I331-L334 PolarHBondContact O-N 3.13Å; L332-L334 PolarHBondContact O-N 3.07Å; L334-D336 VanDerWaalsContact C-N 3.32Å; L334-D336 PolarHBondContact O-N 3.34Å; L334-K337 PolarHBondContact O-N 3.29Å; L334-K337 VanDerWaalsContact O-N 3.07Å; L334-T338 WeakPolarHBondContact O-CB 3.32Å; L334-T338 WeakPolarHBondContact O-CG2 3.48Å; L334-T338 PolarHBondContact O-N 3.16Å; L334-T343 HydrophobicContact CD2-CG2 4.16Å; L334-T343 HydrophobicContact CG-CG2 4.47Å; L334-L347 HydrophobicContact CB-CD1 4.17Å; L334-L347 HydrophobicContact CD2-CD1 3.78Å; L334-L347 HydrophobicContact CD2-CD2 4.28Å; L334-L347 HydrophobicContact CG-CD1 3.76Å
335	L	96.1	Very high	95.5	Very high	0 Å²	0	42.8 Å²	42.8	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-59.6	-39.3	-179.9	-174.3	63.3	0	0	0	112.6	I331 L332 K337 V344 L347 L351 V371 L372 V375 I376	I331-L335 VanDerWaalsContact O-CB 3.29Å; I331-L335 WeakPolarHBondContact O-CB 3.47Å; I331-L335 PolarHBondContact O-N 2.71Å; L332-L335 PolarHBondContact O-N 3.5Å; L335-K337 PolarHBondContact O-N 3.16Å; L335-V344 HydrophobicContact CD1-CB 4.29Å; L335-V344 HydrophobicContact CD1-CG1 3.94Å; L335-V344 HydrophobicContact CD1-CG2 4.25Å; L335-L347 HydrophobicContact CB-CD1 4.27Å; L335-L347 HydrophobicContact CD1-CB 4.39Å; L335-L347 HydrophobicContact CD1-CD1 4.43Å; L335-L351 HydrophobicContact CD2-CD1 4.03Å; L335-V371 HydrophobicContact CB-CG1 4.43Å; L335-V371 HydrophobicContact CD2-CG1 4.23Å; L335-V371 HydrophobicContact CG-CG1 4.31Å; L335-L372 HydrophobicContact CD2-CD1 4.26Å; L335-V375 HydrophobicContact CD1-CG1 4.15Å; L335-V375 HydrophobicContact CG-CG1 4.27Å; L335-I376 HydrophobicContact CD1-CD1 4.32Å
336	D	94.3	Very high	95.6	Very high	63 Å²	63	41.5 Å²	41.5	34%	0.337	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-12.5	177.6	-162.6	57.2	0	0	0	114.2	L332 L334 V371 K374	L332-D336 PolarHBondContact O-N 3.37Å; L334-D336 VanDerWaalsContact C-N 3.32Å; L334-D336 PolarHBondContact O-N 3.34Å; D336-V371 HydrophobicContact CB-CG1 3.93Å; D336-V371 HydrophobicContact CB-CG2 4.4Å; D336-K374 IonicContact OD1-NZ 3.7Å; D336-K374 PolarHBondContact OD1-NZ 3.41Å; D336-K374 IonicContact OD2-NZ 3.79Å; D336-K374 PolarHBondContact OD2-NZ 2.98Å
337	K	93.4	Very high	95.7	Very high	153 Å²	153	36.2 Å²	36.2	67%	0.665	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	-115.7	-25.5	-172.8	-66	-177	-171.6	177.5	0	114.8	N333 L334 L335	N333-K337 VanDerWaalsContact O-CD 3.24Å; N333-K337 WeakPolarHBondContact O-CD 3.24Å; N333-K337 VanDerWaalsContact O-CG 3.31Å; N333-K337 WeakPolarHBondContact O-CG 3.31Å; L334-K337 PolarHBondContact O-N 3.29Å; L334-K337 VanDerWaalsContact O-N 3.07Å; L335-K337 PolarHBondContact O-N 3.16Å
338	T	92.5	Very high	95.8	Very high	8 Å²	8	36.2 Å²	36.2	5%	0.049	18%	0.179	C	C	.	.			trans	-79.4	143.1	-176	-170.7	0	0	0	0	111.5	L334 D340 T343 V344	L334-T338 WeakPolarHBondContact O-CB 3.32Å; L334-T338 WeakPolarHBondContact O-CG2 3.48Å; L334-T338 PolarHBondContact O-N 3.16Å; T338-D340 PolarHBondContact OG1-N 2.86Å; T338-T343 HydrophobicContact CG2-CG2 4.12Å; T338-V344 HydrophobicContact CG2-CG2 3.7Å
339	H	89.2	Confident	95.8	Very high	138 Å²	138	35.4 Å²	35.4	64%	0.639	18%	0.175	S	C	*	.			trans	-106	2.6	172.6	-60.9	-43.4	0	0	0	112.3	K341	H339-K341 PolarHBondContact O-N 2.78Å
340	D	91.9	Very high	95.9	Very high	26 Å²	26	31.8 Å²	31.8	14%	0.139	15%	0.153	C	C	.	.			trans	-85.5	111.1	-178.4	175.4	62.2	0	0	0	112.4	R302 T338 E342 T343 V344	R302-D340 IonicContact CZ-OD1 3.89Å; R302-D340 IonicContact CZ-OD2 2.72Å; R302-D340 IonicContact NE-OD1 3.4Å; R302-D340 PolarHBondContact NE-OD1 2.99Å; R302-D340 IonicContact NE-OD2 2.77Å; R302-D340 PolarHBondContact NE-OD2 3.27Å; R302-D340 IonicContact NH2-OD1 3.87Å; R302-D340 PolarHBondContact NH2-OD1 3.35Å; R302-D340 IonicContact NH2-OD2 2.72Å; R302-D340 PolarHBondContact NH2-OD2 3.06Å; T338-D340 PolarHBondContact OG1-N 2.86Å; D340-E342 PolarHBondContact O-N 2.85Å; D340-E342 VanDerWaalsContact O-N 3.16Å; D340-T343 PolarHBondContact O-N 2.68Å; D340-T343 VanDerWaalsContact O-N 3.12Å; D340-T343 WeakPolarHBondContact OD2-CB 3.42Å; D340-T343 PolarHBondContact OD2-N 3.12Å; D340-T343 PolarHBondContact OD2-OG1 2.93Å; D340-V344 WeakPolarHBondContact O-CG2 3.37Å; D340-V344 PolarHBondContact O-N 3.29Å
341	K	92.6	Very high	95.9	Very high	76 Å²	76	30.9 Å²	30.9	33%	0.33	15%	0.148	S	C	.	.	H	α-helix	trans	-50.4	-40.8	179.2	-70.7	-160.1	177.4	-159.8	0	113.8	H339 C345 L393 A395 D396	H339-K341 PolarHBondContact O-N 2.78Å; K341-C345 VanDerWaalsContact O-CB 3.28Å; K341-C345 WeakPolarHBondContact O-CB 3.48Å; K341-C345 PolarHBondContact O-N 3.09Å; K341-L393 WeakPolarHBondContact CE-O 3.33Å; K341-A395 PolarHBondContact NZ-O 3.07Å; K341-D396 HydrophobicContact CD-CB 4.39Å
342	E	94.6	Very high	95.9	Very high	53 Å²	53	34 Å²	34	25%	0.248	16%	0.159	C	C	.	.	H	α-helix	trans	-70.2	-43.1	-177.6	-172.4	63.2	-153.3	0	0	110.6	R302 D340 C345 Q346	R302-E342 HydrophobicContact CG-CB 4.25Å; R302-E342 HydrophobicContact CG-CG 4.05Å; D340-E342 PolarHBondContact O-N 2.85Å; D340-E342 VanDerWaalsContact O-N 3.16Å; E342-C345 WeakPolarHBondContact O-CB 2.95Å; E342-C345 PolarHBondContact O-N 2.92Å; E342-Q346 HydrophobicContact CG-CG 4.4Å; E342-Q346 WeakPolarHBondContact O-CB 3.2Å; E342-Q346 VanDerWaalsContact O-CG 3.23Å; E342-Q346 WeakPolarHBondContact O-CG 3.46Å; E342-Q346 PolarHBondContact O-N 3.02Å; E342-Q346 PolarHBondContact OE1-NE2 2.94Å
343	T	96.6	Very high	96	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-61	-45.8	173.7	-61.4	0	0	0	0	111.3	R302 L334 T338 D340 C345 Q346 L347	R302-T343 WeakPolarHBondContact CA-OG1 3.14Å; R302-T343 VanDerWaalsContact CB-OG1 3.31Å; R302-T343 WeakPolarHBondContact CB-OG1 3.17Å; L334-T343 HydrophobicContact CD2-CG2 4.16Å; L334-T343 HydrophobicContact CG-CG2 4.47Å; T338-T343 HydrophobicContact CG2-CG2 4.12Å; D340-T343 PolarHBondContact O-N 2.68Å; D340-T343 VanDerWaalsContact O-N 3.12Å; D340-T343 WeakPolarHBondContact OD2-CB 3.42Å; D340-T343 PolarHBondContact OD2-N 3.12Å; D340-T343 PolarHBondContact OD2-OG1 2.93Å; T343-C345 VanDerWaalsContact C-N 3.35Å; T343-C345 PolarHBondContact O-N 2.95Å; T343-Q346 PolarHBondContact O-N 3.33Å; T343-L347 HydrophobicContact CG2-CD1 3.75Å; T343-L347 HydrophobicContact CG2-CG 4.13Å; T343-L347 WeakPolarHBondContact O-CB 3.38Å; T343-L347 VanDerWaalsContact O-CG 3.24Å; T343-L347 WeakPolarHBondContact O-CG 3.2Å; T343-L347 PolarHBondContact O-N 2.73Å
344	V	96.6	Very high	96	Very high	1 Å²	1	29.9 Å²	29.9	1%	0.006	14%	0.138	C	C	.	.	H	α-helix	trans	-55.1	-49	173.1	174.9	0	0	0	0	111.1	L335 T338 D340 Q346 A348 V375 I376 I394 A399	L335-V344 HydrophobicContact CD1-CB 4.29Å; L335-V344 HydrophobicContact CD1-CG1 3.94Å; L335-V344 HydrophobicContact CD1-CG2 4.25Å; T338-V344 HydrophobicContact CG2-CG2 3.7Å; D340-V344 WeakPolarHBondContact O-CG2 3.37Å; D340-V344 PolarHBondContact O-N 3.29Å; V344-Q346 PolarHBondContact O-N 3.22Å; V344-A348 VanDerWaalsContact O-CB 3.31Å; V344-A348 WeakPolarHBondContact O-CB 3.06Å; V344-A348 PolarHBondContact O-N 3.4Å; V344-V375 HydrophobicContact CG1-CG1 4.38Å; V344-I376 HydrophobicContact CG1-CD1 3.76Å; V344-I376 HydrophobicContact CG1-CG1 3.7Å; V344-I394 HydrophobicContact CB-CG2 4.45Å; V344-I394 HydrophobicContact CG1-CG2 4.22Å; V344-I394 HydrophobicContact CG2-CG2 3.96Å; V344-A399 HydrophobicContact CG1-CB 4.05Å
345	C	95.9	Very high	96	Very high	3 Å²	3	29.2 Å²	29.2	2%	0.02	13%	0.134	C	C	.	.	H	α-helix	trans	-61	-41.8	177.3	174.1	0	0	0	0	113.2	R309 K341 E342 T343 G349 K398 A399	R309-C345 PolarHBondContact NH1-O 2.95Å; K341-C345 VanDerWaalsContact O-CB 3.28Å; K341-C345 WeakPolarHBondContact O-CB 3.48Å; K341-C345 PolarHBondContact O-N 3.09Å; E342-C345 WeakPolarHBondContact O-CB 2.95Å; E342-C345 PolarHBondContact O-N 2.92Å; T343-C345 VanDerWaalsContact C-N 3.35Å; T343-C345 PolarHBondContact O-N 2.95Å; C345-G349 PolarHBondContact O-N 3.03Å; C345-K398 VanDerWaalsContact SG-CB 3.58Å; C345-A399 HydrophobicContact CB-CB 4.25Å
346	Q	98.1	Very high	95.9	Very high	13 Å²	13	32 Å²	32	6%	0.061	15%	0.154	C	C	.	.	H	α-helix	trans	-72.8	-41.3	-179.5	-64	-62.1	-7.5	0	0	111.8	A305 A306 E342 T343 V344 G349 V350	A305-Q346 HydrophobicContact CB-CB 3.94Å; A306-Q346 HydrophobicContact CB-CB 4.48Å; A306-Q346 HydrophobicContact CB-CG 3.86Å; E342-Q346 HydrophobicContact CG-CG 4.4Å; E342-Q346 WeakPolarHBondContact O-CB 3.2Å; E342-Q346 VanDerWaalsContact O-CG 3.23Å; E342-Q346 WeakPolarHBondContact O-CG 3.46Å; E342-Q346 PolarHBondContact O-N 3.02Å; E342-Q346 PolarHBondContact OE1-NE2 2.94Å; T343-Q346 PolarHBondContact O-N 3.33Å; V344-Q346 PolarHBondContact O-N 3.22Å; Q346-G349 CarbonylContact O-C 3.51Å; Q346-G349 WeakPolarHBondContact O-CA 3.35Å; Q346-G349 PolarHBondContact O-N 2.91Å; Q346-G349 VanDerWaalsContact O-N 3.13Å; Q346-V350 WeakPolarHBondContact O-CG2 3.4Å; Q346-V350 PolarHBondContact O-N 3.02Å
347	L	98.6	Very high	95.9	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-64.6	-44.4	175.2	-67	174.6	0	0	0	112	L293 A305 I331 L334 L335 T343 G349 V350 L351	L293-L347 HydrophobicContact CD1-CD2 4.16Å; L293-L347 HydrophobicContact CD2-CD2 4.2Å; A305-L347 HydrophobicContact CB-CD2 3.74Å; A305-L347 HydrophobicContact CB-CG 4.13Å; I331-L347 HydrophobicContact CG1-CD2 4.23Å; I331-L347 HydrophobicContact CG2-CB 4.19Å; I331-L347 HydrophobicContact CG2-CD2 4.08Å; L334-L347 HydrophobicContact CB-CD1 4.17Å; L334-L347 HydrophobicContact CD2-CD1 3.78Å; L334-L347 HydrophobicContact CD2-CD2 4.28Å; L334-L347 HydrophobicContact CG-CD1 3.76Å; L335-L347 HydrophobicContact CB-CD1 4.27Å; L335-L347 HydrophobicContact CD1-CB 4.39Å; L335-L347 HydrophobicContact CD1-CD1 4.43Å; T343-L347 HydrophobicContact CG2-CD1 3.75Å; T343-L347 HydrophobicContact CG2-CG 4.13Å; T343-L347 WeakPolarHBondContact O-CB 3.38Å; T343-L347 VanDerWaalsContact O-CG 3.24Å; T343-L347 WeakPolarHBondContact O-CG 3.2Å; T343-L347 PolarHBondContact O-N 2.73Å; L347-G349 PolarHBondContact O-N 3.22Å; L347-V350 WeakPolarHBondContact O-CB 3.01Å; L347-V350 PolarHBondContact O-N 3.02Å; L347-L351 WeakPolarHBondContact O-CG 3.47Å; L347-L351 PolarHBondContact O-N 3.45Å
348	A	98.2	Very high	95.9	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-57.5	-37.2	171	0	0	0	0	0	111.6	V344 L351 W352 I376 C402	V344-A348 VanDerWaalsContact O-CB 3.31Å; V344-A348 WeakPolarHBondContact O-CB 3.06Å; V344-A348 PolarHBondContact O-N 3.4Å; A348-L351 PolarHBondContact O-N 3.37Å; A348-W352 PolarHBondContact O-N 3.16Å; A348-I376 HydrophobicContact CB-CD1 3.83Å; A348-C402 HydrophobicContact CB-CB 3.75Å
349	G	98.2	Very high	95.9	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-65.7	-34.8	172.1	0	0	0	0	0	114.9	C345 Q346 L347 N353	C345-G349 PolarHBondContact O-N 3.03Å; Q346-G349 CarbonylContact O-C 3.51Å; Q346-G349 WeakPolarHBondContact O-CA 3.35Å; Q346-G349 PolarHBondContact O-N 2.91Å; Q346-G349 VanDerWaalsContact O-N 3.13Å; L347-G349 PolarHBondContact O-N 3.22Å; G349-N353 PolarHBondContact O-N 2.99Å; G349-N353 VanDerWaalsContact O-N 3.17Å
350	V	98.6	Very high	96.1	Very high	0 Å²	0	25 Å²	25	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-66.7	-46.9	171.4	179.1	0	0	0	0	110	L308 R309 V312 I331 Q346 L347 W352 N353 L354	L308-V350 HydrophobicContact CB-CG2 4.21Å; L308-V350 HydrophobicContact CD2-CG1 4.14Å; L308-V350 HydrophobicContact CD2-CG2 4.33Å; L308-V350 HydrophobicContact CG-CG1 4.29Å; L308-V350 HydrophobicContact CG-CG2 4.23Å; R309-V350 HydrophobicContact CB-CG2 3.87Å; V312-V350 HydrophobicContact CG2-CG1 4.28Å; I331-V350 HydrophobicContact CD1-CB 4.38Å; I331-V350 HydrophobicContact CD1-CG1 3.6Å; Q346-V350 WeakPolarHBondContact O-CG2 3.4Å; Q346-V350 PolarHBondContact O-N 3.02Å; L347-V350 WeakPolarHBondContact O-CB 3.01Å; L347-V350 PolarHBondContact O-N 3.02Å; V350-W352 PolarHBondContact O-N 2.84Å; V350-N353 CarbonylContact O-C 3.59Å; V350-N353 PolarHBondContact O-N 3.49Å; V350-N353 VanDerWaalsContact O-N 3.09Å; V350-L354 HydrophobicContact CG1-CD1 3.87Å; V350-L354 HydrophobicContact CG1-CG 4.23Å; V350-L354 WeakPolarHBondContact O-CG 3.12Å; V350-L354 PolarHBondContact O-N 2.9Å
351	L	98.6	Very high	96.3	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-61.2	-42.5	-179.3	-67.1	161.6	0	0	0	111.9	L328 I331 L335 L347 A348 N353 L354 S355 F364 F368 L372 C406	L328-L351 HydrophobicContact CD2-CD2 3.77Å; I331-L351 HydrophobicContact CG2-CD1 3.81Å; I331-L351 HydrophobicContact CG2-CD2 3.78Å; I331-L351 HydrophobicContact CG2-CG 3.76Å; L335-L351 HydrophobicContact CD2-CD1 4.03Å; L347-L351 WeakPolarHBondContact O-CG 3.47Å; L347-L351 PolarHBondContact O-N 3.45Å; A348-L351 PolarHBondContact O-N 3.37Å; L351-N353 PolarHBondContact O-N 2.83Å; L351-L354 PolarHBondContact O-N 3.35Å; L351-S355 PolarHBondContact O-N 3.46Å; L351-S355 PolarHBondContact O-OG 3.19Å; L351-S355 VanDerWaalsContact O-OG 3.08Å; L351-F364 HydrophobicContact CB-CE1 4.47Å; L351-F364 HydrophobicContact CD2-CE1 4Å; L351-F368 HydrophobicContact CB-CE2 4.29Å; L351-F368 HydrophobicContact CD1-CE2 4.05Å; L351-F368 HydrophobicContact CD2-CD2 4.24Å; L351-F368 HydrophobicContact CD2-CE2 3.97Å; L351-F368 HydrophobicContact CG-CE2 4.31Å; L351-L372 HydrophobicContact CD1-CD1 4.42Å; L351-C406 PolarHBondContact O-SG 2.96Å
352	W	98.2	Very high	96.3	Very high	64 Å²	64	27.4 Å²	27.4	24%	0.242	14%	0.14	C	C	.	.	H	α-helix	trans	-60.5	-42.5	171.5	178	30.2	0	0	0	112.7	L194 A348 V350 L354 S355 C402 A405 C406 N409	L194-W352 HydrophobicContact CD1-CH2 4.11Å; L194-W352 HydrophobicContact CD1-CZ3 4.34Å; A348-W352 PolarHBondContact O-N 3.16Å; V350-W352 PolarHBondContact O-N 2.84Å; W352-L354 VanDerWaalsContact C-N 3.33Å; W352-L354 PolarHBondContact O-N 2.72Å; W352-S355 PolarHBondContact O-OG 3.03Å; W352-S355 VanDerWaalsContact O-OG 3.07Å; W352-C402 HydrophobicContact CE3-CB 4.38Å; W352-A405 VanDerWaalsContact CD1-C 3.47Å; W352-A405 HydrophobicContact CD2-CB 3.6Å; W352-A405 HydrophobicContact CE3-CB 4.24Å; W352-A405 HydrophobicContact CG-CB 3.81Å; W352-A405 HydrophobicContact CH2-CB 4.43Å; W352-A405 HydrophobicContact CZ2-CB 3.83Å; W352-C406 HydrophobicContact CB-CB 4.15Å; W352-N409 PolarHBondContact O-ND2 3.38Å
353	N	98.3	Very high	96.3	Very high	15 Å²	15	29.3 Å²	29.3	8%	0.08	15%	0.151	C	C	.	.	H	α-helix	trans	-67.2	-31.6	175.2	-78.6	-15.8	0	0	0	112.5	R309 V312 K319 G349 V350 L351 S356	R309-N353 PolarHBondContact O-ND2 3.01Å; V312-N353 HydrophobicContact CG2-CB 3.54Å; K319-N353 WeakPolarHBondContact CD-O 3.35Å; K319-N353 WeakPolarHBondContact CE-O 3.19Å; K319-N353 PolarHBondContact NZ-O 2.85Å; G349-N353 PolarHBondContact O-N 2.99Å; G349-N353 VanDerWaalsContact O-N 3.17Å; V350-N353 CarbonylContact O-C 3.59Å; V350-N353 PolarHBondContact O-N 3.49Å; V350-N353 VanDerWaalsContact O-N 3.09Å; L351-N353 PolarHBondContact O-N 2.83Å; N353-S356 PolarHBondContact O-OG 3.33Å
354	L	98.2	Very high	96.3	Very high	0 Å²	0	29.4 Å²	29.4	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-73.6	-45	177.4	-71	171.1	0	0	0	112.5	V312 K319 V322 L328 I331 V350 L351 W352 S356 V357 I360 F364	V312-L354 HydrophobicContact CG1-CD2 4.44Å; K319-L354 HydrophobicContact CB-CD2 3.95Å; K319-L354 HydrophobicContact CG-CD2 4.13Å; V322-L354 HydrophobicContact CB-CD2 4.28Å; V322-L354 HydrophobicContact CG1-CD1 3.99Å; V322-L354 HydrophobicContact CG1-CD2 4.19Å; L328-L354 HydrophobicContact CD2-CD1 3.63Å; L328-L354 HydrophobicContact CG-CD1 4.38Å; I331-L354 HydrophobicContact CD1-CD1 4.18Å; V350-L354 HydrophobicContact CG1-CD1 3.87Å; V350-L354 HydrophobicContact CG1-CG 4.23Å; V350-L354 WeakPolarHBondContact O-CG 3.12Å; V350-L354 PolarHBondContact O-N 2.9Å; L351-L354 PolarHBondContact O-N 3.35Å; W352-L354 VanDerWaalsContact C-N 3.33Å; W352-L354 PolarHBondContact O-N 2.72Å; L354-S356 PolarHBondContact O-N 3.22Å; L354-S356 VanDerWaalsContact O-N 3.08Å; L354-V357 PolarHBondContact O-N 2.97Å; L354-I360 HydrophobicContact CB-CG2 4.38Å; L354-F364 HydrophobicContact CB-CE2 4.46Å; L354-F364 HydrophobicContact CB-CZ 3.99Å
355	S	97.2	Very high	96.1	Very high	0 Å²	0	33.8 Å²	33.8	0%	0	18%	0.175	C	C	.	.	H	α-helix	trans	-65	-10.3	-177.8	52.9	0	0	0	0	115.6	L351 W352 V357 C406 N409	L351-S355 PolarHBondContact O-N 3.46Å; L351-S355 PolarHBondContact O-OG 3.19Å; L351-S355 VanDerWaalsContact O-OG 3.08Å; W352-S355 PolarHBondContact O-OG 3.03Å; W352-S355 VanDerWaalsContact O-OG 3.07Å; S355-V357 PolarHBondContact O-N 2.91Å; S355-C406 PolarHBondContact OG-SG 3.42Å; S355-N409 PolarHBondContact OG-ND2 3Å
356	S	95.2	Very high	96	Very high	59 Å²	59	39.7 Å²	39.7	41%	0.413	20%	0.202	S	C	.	.	S	Bend	trans	-86.9	41.3	173	49.1	0	0	0	0	112.7	K319 N353 L354	K319-S356 PolarHBondContact NZ-O 2.86Å; K319-S356 PolarHBondContact NZ-OG 3.07Å; N353-S356 PolarHBondContact O-OG 3.33Å; L354-S356 PolarHBondContact O-N 3.22Å; L354-S356 VanDerWaalsContact O-N 3.08Å
357	V	93.8	Very high	95.9	Very high	7 Å²	7	43.2 Å²	43.2	4%	0.042	22%	0.222	C	C	.	.	S	Bend	trans	-152.3	112.6	174.7	176.7	0	0	0	0	106.8	K316 K319 L354 S355 E359 I360 K361	K316-V357 HydrophobicContact CG-CG2 4.2Å; K319-V357 HydrophobicContact CD-CG2 3.3Å; L354-V357 PolarHBondContact O-N 2.97Å; S355-V357 PolarHBondContact O-N 2.91Å; V357-E359 HydrophobicContact CG1-CB 4.15Å; V357-E359 WeakPolarHBondContact CG1-OE2 3.44Å; V357-E359 PolarHBondContact O-N 3.49Å; V357-I360 HydrophobicContact CB-CB 4.14Å; V357-I360 HydrophobicContact CB-CD1 3.98Å; V357-I360 HydrophobicContact CB-CG1 4.09Å; V357-I360 HydrophobicContact CG1-CB 4.24Å; V357-I360 HydrophobicContact CG1-CD1 3.86Å; V357-I360 HydrophobicContact CG1-CG1 3.77Å; V357-I360 HydrophobicContact CG2-CD1 4.35Å; V357-I360 PolarHBondContact O-N 3.44Å; V357-K361 PolarHBondContact O-N 3.13Å
358	D	91.9	Very high	95.8	Very high	76 Å²	76	43.3 Å²	43.3	41%	0.406	22%	0.222	S	C	.	.	H	α-helix	trans	-59.2	-38.5	-175.5	-52.9	-64.1	0	0	0	111.6	I360 K361	D358-I360 PolarHBondContact O-N 3.09Å; D358-K361 PolarHBondContact O-N 3.17Å; D358-K361 WeakPolarHBondContact OD1-CE 3.46Å; D358-K361 IonicContact OD1-NZ 2.75Å; D358-K361 PolarHBondContact OD1-NZ 2.99Å
359	E	92.6	Very high	95.7	Very high	125 Å²	125	43.3 Å²	43.3	58%	0.584	22%	0.222	S	C	*	.	H	α-helix	trans	-63	-7.6	176	-46.8	101.1	117.5	0	0	114.5	K316 V357	K316-E359 IonicContact NZ-OE1 3.54Å; K316-E359 PolarHBondContact NZ-OE1 2.85Å; K316-E359 IonicContact NZ-OE2 2.64Å; K316-E359 PolarHBondContact NZ-OE2 3.29Å; V357-E359 HydrophobicContact CG1-CB 4.15Å; V357-E359 WeakPolarHBondContact CG1-OE2 3.44Å; V357-E359 PolarHBondContact O-N 3.49Å
360	I	95	Very high	95.6	Very high	8 Å²	8	48 Å²	48	4%	0.041	24%	0.244	C	C	.	.	H	α-helix	trans	-113.9	-19.1	178.1	-62.8	178.2	0	0	0	111.4	K319 T323 L354 V357 D358 D362 L363 F364	K319-I360 HydrophobicContact CB-CD1 3.71Å; T323-I360 HydrophobicContact CG2-CB 4.44Å; T323-I360 HydrophobicContact CG2-CD1 3.98Å; T323-I360 HydrophobicContact CG2-CG1 4.05Å; T323-I360 HydrophobicContact CG2-CG2 3.63Å; L354-I360 HydrophobicContact CB-CG2 4.38Å; V357-I360 HydrophobicContact CB-CB 4.14Å; V357-I360 HydrophobicContact CB-CD1 3.98Å; V357-I360 HydrophobicContact CB-CG1 4.09Å; V357-I360 HydrophobicContact CG1-CB 4.24Å; V357-I360 HydrophobicContact CG1-CD1 3.86Å; V357-I360 HydrophobicContact CG1-CG1 3.77Å; V357-I360 HydrophobicContact CG2-CD1 4.35Å; V357-I360 PolarHBondContact O-N 3.44Å; D358-I360 PolarHBondContact O-N 3.09Å; I360-D362 VanDerWaalsContact C-N 3.34Å; I360-D362 PolarHBondContact O-N 3.36Å; I360-L363 HydrophobicContact CG2-CD1 4.48Å; I360-L363 WeakPolarHBondContact O-CB 3.47Å; I360-L363 PolarHBondContact O-N 2.98Å; I360-L363 VanDerWaalsContact O-N 3.13Å; I360-F364 HydrophobicContact CG2-CE2 4.06Å; I360-F364 WeakPolarHBondContact O-CD2 3.49Å
361	K	94.9	Very high	95.5	Very high	14 Å²	14	48.3 Å²	48.3	6%	0.061	25%	0.246	C	C	.	.	H	α-helix	trans	-59.5	-42.4	-177.8	-68.2	-171.3	-167.5	161.2	0	112.2	V357 D358 L363 F364 N409 L410 S412 D413 H416	V357-K361 PolarHBondContact O-N 3.13Å; D358-K361 PolarHBondContact O-N 3.17Å; D358-K361 WeakPolarHBondContact OD1-CE 3.46Å; D358-K361 IonicContact OD1-NZ 2.75Å; D358-K361 PolarHBondContact OD1-NZ 2.99Å; K361-L363 PolarHBondContact O-N 3.48Å; K361-F364 WeakPolarHBondContact O-CB 3.38Å; K361-F364 WeakPolarHBondContact O-CD2 3.28Å; K361-F364 PolarHBondContact O-N 2.72Å; K361-N409 WeakPolarHBondContact CE-O 3.43Å; K361-N409 PolarHBondContact NZ-O 3.12Å; K361-L410 HydrophobicContact CB-CD2 3.93Å; K361-L410 HydrophobicContact CD-CD2 4.37Å; K361-L410 HydrophobicContact CG-CD2 3.91Å; K361-S412 PolarHBondContact NZ-OG 2.83Å; K361-D413 WeakPolarHBondContact CD-OD2 3.37Å; K361-D413 IonicContact NZ-OD1 3.82Å; K361-D413 PolarHBondContact NZ-OD1 3.39Å; K361-D413 IonicContact NZ-OD2 3.32Å; K361-H416 PolarHBondContact O-CE1 3.2Å; K361-H416 PolarHBondContact O-NE2 3.3Å
362	D	92.6	Very high	95.4	Very high	137 Å²	137	48.3 Å²	48.3	73%	0.733	25%	0.246	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-13.7	179.1	-69	-29.7	0	0	0	114.5	I360	I360-D362 VanDerWaalsContact C-N 3.34Å; I360-D362 PolarHBondContact O-N 3.36Å
363	L	95.1	Very high	95.3	Very high	93 Å²	93	45.4 Å²	45.4	49%	0.487	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.1	-8	176	-52.1	179.9	0	0	0	113.3	T323 L328 I360 K361 N365	T323-L363 HydrophobicContact CG2-CD1 3.75Å; L328-L363 HydrophobicContact CD1-CB 3.47Å; L328-L363 VanDerWaalsContact CD1-CB 3.47Å; L328-L363 HydrophobicContact CD1-CD1 4.24Å; I360-L363 HydrophobicContact CG2-CD1 4.48Å; I360-L363 WeakPolarHBondContact O-CB 3.47Å; I360-L363 PolarHBondContact O-N 2.98Å; I360-L363 VanDerWaalsContact O-N 3.13Å; K361-L363 PolarHBondContact O-N 3.48Å; L363-N365 PolarHBondContact O-N 2.72Å
364	F	96.1	Very high	95.1	Very high	3 Å²	3	48.8 Å²	48.8	1%	0.013	25%	0.249	C	C	.	.			trans	-87.4	81.3	178.7	-72.4	-99.1	0	0	0	111.5	L328 L351 L354 I360 K361 F368 L410 H416	L328-F364 HydrophobicContact CD1-CE2 4.49Å; L328-F364 HydrophobicContact CD2-CE1 3.98Å; L328-F364 HydrophobicContact CD2-CE2 4.27Å; L328-F364 HydrophobicContact CD2-CZ 3.83Å; L351-F364 HydrophobicContact CB-CE1 4.47Å; L351-F364 HydrophobicContact CD2-CE1 4Å; L354-F364 HydrophobicContact CB-CE2 4.46Å; L354-F364 HydrophobicContact CB-CZ 3.99Å; I360-F364 HydrophobicContact CG2-CE2 4.06Å; I360-F364 WeakPolarHBondContact O-CD2 3.49Å; K361-F364 WeakPolarHBondContact O-CB 3.38Å; K361-F364 WeakPolarHBondContact O-CD2 3.28Å; K361-F364 PolarHBondContact O-N 2.72Å; F364-F368 HydrophobicContact CB-CD1 4.16Å; F364-F368 HydrophobicContact CB-CG 4.42Å; F364-F368 AromaticContact CD1-CD1 3.74Å; F364-F368 HydrophobicContact CD1-CD1 3.74Å; F364-F368 AromaticContact CD1-CD2 3.53Å; F364-F368 HydrophobicContact CD1-CD2 3.53Å; F364-F368 AromaticContact CD1-CE1 3.72Å; F364-F368 HydrophobicContact CD1-CE1 3.72Å; F364-F368 AromaticContact CD1-CE2 3.51Å; F364-F368 HydrophobicContact CD1-CE2 3.51Å; F364-F368 AromaticContact CD1-CG 3.68Å; F364-F368 HydrophobicContact CD1-CG 3.68Å; F364-F368 AromaticContact CD1-CZ 3.61Å; F364-F368 HydrophobicContact CD1-CZ 3.61Å; F364-F368 AromaticContact CE1-CD2 3.95Å; F364-F368 HydrophobicContact CE1-CD2 3.95Å; F364-F368 HydrophobicContact CE1-CE1 4.4Å; F364-F368 AromaticContact CE1-CE2 3.58Å; F364-F368 HydrophobicContact CE1-CE2 3.58Å; F364-F368 AromaticContact CE1-CZ 3.83Å; F364-F368 HydrophobicContact CE1-CZ 3.83Å; F364-F368 HydrophobicContact CG-CD1 4.46Å; F364-L410 HydrophobicContact CB-CD1 3.97Å; F364-L410 HydrophobicContact CB-CD2 3.92Å; F364-L410 HydrophobicContact CD1-CD1 3.81Å; F364-L410 HydrophobicContact CD1-CD2 4.43Å; F364-L410 HydrophobicContact CD2-CD2 3.76Å; F364-L410 HydrophobicContact CE1-CD1 4.39Å; F364-L410 HydrophobicContact CE2-CD2 4.3Å; F364-L410 HydrophobicContact CG-CD1 3.91Å; F364-L410 HydrophobicContact CG-CD2 3.81Å; F364-H416 PolarHBondContact O-NE2 3.19Å
365	N	93	Very high	94.9	Very high	92 Å²	92	49 Å²	49	49%	0.492	25%	0.25	S	S	.	.			trans	-70.9	175.7	-178.4	68.7	15.4	0	0	0	114.8	L363 N367 F368	L363-N365 PolarHBondContact O-N 2.72Å; N365-N367 VanDerWaalsContact C-N 3.25Å; N365-N367 PolarHBondContact O-N 2.9Å; N365-N367 WeakPolarHBondContact OD1-CB 3.28Å; N365-N367 PolarHBondContact OD1-N 3.05Å; N365-F368 VanDerWaalsContact O-CB 3.31Å; N365-F368 WeakPolarHBondContact O-CB 3.26Å; N365-F368 PolarHBondContact O-N 2.92Å; N365-F368 PolarHBondContact OD1-N 3.49Å; N365-F368 VanDerWaalsContact OD1-N 3.12Å
366	E	93.7	Very high	94.8	Very high	127 Å²	127	49.3 Å²	49.3	59%	0.593	25%	0.252	S	S	*	.	H	α-helix	trans	-59	-33.6	179.8	-69.4	160.5	-154.1	0	0	113.4	F368 L369 H370 N419	E366-F368 VanDerWaalsContact C-N 3.29Å; E366-F368 PolarHBondContact O-N 3.03Å; E366-L369 WeakPolarHBondContact O-CB 3.42Å; E366-L369 PolarHBondContact O-N 3.01Å; E366-H370 PolarHBondContact O-N 3.36Å; E366-N419 HydrophobicContact CG-CB 4.11Å; E366-N419 VanDerWaalsContact CG-ND2 3.33Å; E366-N419 WeakPolarHBondContact CG-ND2 3.28Å; E366-N419 PolarHBondContact OE1-ND2 2.94Å
367	N	95.1	Very high	94.8	Very high	87 Å²	87	46.5 Å²	46.5	47%	0.465	23%	0.233	S	C	.	.	H	α-helix	trans	-65	-31.3	176.2	-177.5	87.2	0	0	0	112.4	N365 L369 V371	N365-N367 VanDerWaalsContact C-N 3.25Å; N365-N367 PolarHBondContact O-N 2.9Å; N365-N367 WeakPolarHBondContact OD1-CB 3.28Å; N365-N367 PolarHBondContact OD1-N 3.05Å; N367-L369 VanDerWaalsContact C-N 3.34Å; N367-V371 WeakPolarHBondContact O-CG2 3.39Å; N367-V371 PolarHBondContact O-N 3.11Å
368	F	96.9	Very high	94.8	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.009	24%	0.236	C	C	.	.	H	α-helix	trans	-59.8	-45.2	169.5	158.4	-89.9	0	0	0	111.2	L332 L351 F364 N365 E366 L372 L407 L410	L332-F368 HydrophobicContact CD1-CB 3.87Å; L332-F368 HydrophobicContact CD1-CD2 4.4Å; L332-F368 HydrophobicContact CD2-CB 4.25Å; L332-F368 HydrophobicContact CD2-CD2 3.92Å; L351-F368 HydrophobicContact CB-CE2 4.29Å; L351-F368 HydrophobicContact CD1-CE2 4.05Å; L351-F368 HydrophobicContact CD2-CD2 4.24Å; L351-F368 HydrophobicContact CD2-CE2 3.97Å; L351-F368 HydrophobicContact CG-CE2 4.31Å; F364-F368 HydrophobicContact CB-CD1 4.16Å; F364-F368 HydrophobicContact CB-CG 4.42Å; F364-F368 AromaticContact CD1-CD1 3.74Å; F364-F368 HydrophobicContact CD1-CD1 3.74Å; F364-F368 AromaticContact CD1-CD2 3.53Å; F364-F368 HydrophobicContact CD1-CD2 3.53Å; F364-F368 AromaticContact CD1-CE1 3.72Å; F364-F368 HydrophobicContact CD1-CE1 3.72Å; F364-F368 AromaticContact CD1-CE2 3.51Å; F364-F368 HydrophobicContact CD1-CE2 3.51Å; F364-F368 AromaticContact CD1-CG 3.68Å; F364-F368 HydrophobicContact CD1-CG 3.68Å; F364-F368 AromaticContact CD1-CZ 3.61Å; F364-F368 HydrophobicContact CD1-CZ 3.61Å; F364-F368 AromaticContact CE1-CD2 3.95Å; F364-F368 HydrophobicContact CE1-CD2 3.95Å; F364-F368 HydrophobicContact CE1-CE1 4.4Å; F364-F368 AromaticContact CE1-CE2 3.58Å; F364-F368 HydrophobicContact CE1-CE2 3.58Å; F364-F368 AromaticContact CE1-CZ 3.83Å; F364-F368 HydrophobicContact CE1-CZ 3.83Å; F364-F368 HydrophobicContact CG-CD1 4.46Å; N365-F368 VanDerWaalsContact O-CB 3.31Å; N365-F368 WeakPolarHBondContact O-CB 3.26Å; N365-F368 PolarHBondContact O-N 2.92Å; N365-F368 PolarHBondContact OD1-N 3.49Å; N365-F368 VanDerWaalsContact OD1-N 3.12Å; E366-F368 VanDerWaalsContact C-N 3.29Å; E366-F368 PolarHBondContact O-N 3.03Å; F368-L372 HydrophobicContact CE1-CD2 4.21Å; F368-L372 HydrophobicContact CE2-CD1 4.37Å; F368-L372 HydrophobicContact CE2-CD2 4.41Å; F368-L372 HydrophobicContact CZ-CD1 4.48Å; F368-L372 HydrophobicContact CZ-CD2 3.75Å; F368-L372 VanDerWaalsContact O-CB 3.26Å; F368-L372 WeakPolarHBondContact O-CB 3.38Å; F368-L372 PolarHBondContact O-N 2.94Å; F368-L407 HydrophobicContact CE1-CD2 4.22Å; F368-L410 HydrophobicContact CD1-CD1 4.25Å; F368-L410 HydrophobicContact CE1-CD1 3.46Å; F368-L410 VanDerWaalsContact CE1-CD1 3.46Å; F368-L410 HydrophobicContact CZ-CD1 3.96Å
369	L	97.3	Very high	94.7	Very high	1 Å²	1	43.8 Å²	43.8	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-63.9	-44.1	-179.9	-60.3	176	0	0	0	111.1	E366 N367 T373 L407 N419 M420 C423 L426	E366-L369 WeakPolarHBondContact O-CB 3.42Å; E366-L369 PolarHBondContact O-N 3.01Å; N367-L369 VanDerWaalsContact C-N 3.34Å; L369-T373 WeakPolarHBondContact O-CB 3.26Å; L369-T373 PolarHBondContact O-N 3.22Å; L369-T373 PolarHBondContact O-OG1 3.32Å; L369-L407 HydrophobicContact CD2-CD2 3.51Å; L369-N419 HydrophobicContact CD1-CB 3.72Å; L369-M420 HydrophobicContact CD1-CG 3.93Å; L369-M420 HydrophobicContact CD2-CE 4.1Å; L369-M420 HydrophobicContact CD2-CG 3.92Å; L369-C423 HydrophobicContact CB-CB 4.32Å; L369-L426 HydrophobicContact CB-CD1 4.37Å; L369-L426 HydrophobicContact CD2-CD1 4.28Å
370	H	96.1	Very high	94.6	Very high	98 Å²	98	39.8 Å²	39.8	45%	0.454	20%	0.199	S	C	.	.	H	α-helix	trans	-61.1	-51.4	177.8	-178.7	76.7	0	0	0	112.1	E366 L372 T373 K374	E366-H370 PolarHBondContact O-N 3.36Å; H370-L372 PolarHBondContact O-N 3.41Å; H370-T373 PolarHBondContact O-N 2.89Å; H370-K374 VanDerWaalsContact O-CB 3.24Å; H370-K374 WeakPolarHBondContact O-CB 3.19Å; H370-K374 PolarHBondContact O-N 3.08Å
371	V	96.4	Very high	94.3	Very high	6 Å²	6	39.6 Å²	39.6	4%	0.036	20%	0.199	C	C	.	.	H	α-helix	trans	-61.9	-45.6	179	172	0	0	0	0	111.4	L332 L335 D336 N367 T373 V375	L332-V371 HydrophobicContact CD2-CB 3.95Å; L332-V371 HydrophobicContact CD2-CG1 3.91Å; L335-V371 HydrophobicContact CB-CG1 4.43Å; L335-V371 HydrophobicContact CD2-CG1 4.23Å; L335-V371 HydrophobicContact CG-CG1 4.31Å; D336-V371 HydrophobicContact CB-CG1 3.93Å; D336-V371 HydrophobicContact CB-CG2 4.4Å; N367-V371 WeakPolarHBondContact O-CG2 3.39Å; N367-V371 PolarHBondContact O-N 3.11Å; V371-T373 VanDerWaalsContact C-N 3.3Å; V371-T373 PolarHBondContact O-N 3.3Å; V371-V375 HydrophobicContact CG1-CG2 4.22Å; V371-V375 WeakPolarHBondContact O-CB 3.36Å; V371-V375 VanDerWaalsContact O-CG2 3.27Å; V371-V375 WeakPolarHBondContact O-CG2 3.24Å; V371-V375 PolarHBondContact O-N 2.98Å
372	L	96.4	Very high	93.7	Very high	0 Å²	0	44.1 Å²	44.1	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62.2	-39.9	178.7	-164.8	81.2	0	0	0	111.4	L335 L351 F368 H370 I376 L377 A403 L407	L335-L372 HydrophobicContact CD2-CD1 4.26Å; L351-L372 HydrophobicContact CD1-CD1 4.42Å; F368-L372 HydrophobicContact CE1-CD2 4.21Å; F368-L372 HydrophobicContact CE2-CD1 4.37Å; F368-L372 HydrophobicContact CE2-CD2 4.41Å; F368-L372 HydrophobicContact CZ-CD1 4.48Å; F368-L372 HydrophobicContact CZ-CD2 3.75Å; F368-L372 VanDerWaalsContact O-CB 3.26Å; F368-L372 WeakPolarHBondContact O-CB 3.38Å; F368-L372 PolarHBondContact O-N 2.94Å; H370-L372 PolarHBondContact O-N 3.41Å; L372-I376 HydrophobicContact CD1-CD1 4Å; L372-I376 WeakPolarHBondContact O-CB 3.31Å; L372-I376 PolarHBondContact O-N 3.03Å; L372-L377 HydrophobicContact CD2-CD1 4.31Å; L372-L377 HydrophobicContact CG-CD1 4.17Å; L372-L377 WeakPolarHBondContact O-CD1 3.29Å; L372-L377 PolarHBondContact O-N 3.04Å; L372-A403 HydrophobicContact CD1-CB 3.87Å; L372-A403 HydrophobicContact CD2-CB 3.94Å; L372-A403 HydrophobicContact CG-CB 3.93Å; L372-L407 HydrophobicContact CD2-CD1 4.02Å; L372-L407 HydrophobicContact CD2-CD2 3.91Å; L372-L407 HydrophobicContact CD2-CG 3.78Å
373	T	96.1	Very high	93.3	Very high	4 Å²	4	40.1 Å²	40.1	3%	0.025	20%	0.198	C	C	.	.	I	π-helix	trans	-67.6	-51.9	-179.7	-59.1	0	0	0	0	111.2	L369 H370 V371 V375 L377 V378 N425 L426	L369-T373 WeakPolarHBondContact O-CB 3.26Å; L369-T373 PolarHBondContact O-N 3.22Å; L369-T373 PolarHBondContact O-OG1 3.32Å; H370-T373 PolarHBondContact O-N 2.89Å; V371-T373 VanDerWaalsContact C-N 3.3Å; V371-T373 PolarHBondContact O-N 3.3Å; T373-V375 PolarHBondContact O-N 2.86Å; T373-L377 HydrophobicContact CG2-CB 4.27Å; T373-L377 HydrophobicContact CG2-CD2 4.49Å; T373-L377 PolarHBondContact O-N 2.71Å; T373-V378 HydrophobicContact CG2-CG2 4.01Å; T373-V378 PolarHBondContact O-N 3.13Å; T373-N425 HydrophobicContact CG2-CB 4.19Å; T373-L426 HydrophobicContact CG2-CB 4.07Å
374	K	94.1	Very high	92.2	Very high	85 Å²	85	39 Å²	39	37%	0.37	19%	0.192	S	C	.	.	I	π-helix	trans	-56.5	-46.1	176.7	174.9	-168.8	169.2	-161.7	0	113	D336 H370 P379	D336-K374 IonicContact OD1-NZ 3.7Å; D336-K374 PolarHBondContact OD1-NZ 3.41Å; D336-K374 IonicContact OD2-NZ 3.79Å; D336-K374 PolarHBondContact OD2-NZ 2.98Å; H370-K374 VanDerWaalsContact O-CB 3.24Å; H370-K374 WeakPolarHBondContact O-CB 3.19Å; H370-K374 PolarHBondContact O-N 3.08Å; K374-P379 WeakPolarHBondContact O-CD 3.25Å; K374-P379 WeakPolarHBondContact O-CG 3.31Å
375	V	94.1	Very high	90.6	Very high	5 Å²	5	40.6 Å²	40.6	3%	0.03	21%	0.21	C	C	.	.	I	π-helix	trans	-86.5	-30	-171.2	179.1	0	0	0	0	113	L335 V344 V371 T373	L335-V375 HydrophobicContact CD1-CG1 4.15Å; L335-V375 HydrophobicContact CG-CG1 4.27Å; V344-V375 HydrophobicContact CG1-CG1 4.38Å; V371-V375 HydrophobicContact CG1-CG2 4.22Å; V371-V375 WeakPolarHBondContact O-CB 3.36Å; V371-V375 VanDerWaalsContact O-CG2 3.27Å; V371-V375 WeakPolarHBondContact O-CG2 3.24Å; V371-V375 PolarHBondContact O-N 2.98Å; T373-V375 PolarHBondContact O-N 2.86Å
376	I	94.9	Very high	88.7	Confident	7 Å²	7	44.9 Å²	44.9	4%	0.036	23%	0.227	C	C	.	.	I	π-helix	trans	-124.7	-43.8	-171.1	-60.6	173.9	0	0	0	113.8	L335 V344 A348 L372 F380 A399 F400 A403	L335-I376 HydrophobicContact CD1-CD1 4.32Å; V344-I376 HydrophobicContact CG1-CD1 3.76Å; V344-I376 HydrophobicContact CG1-CG1 3.7Å; A348-I376 HydrophobicContact CB-CD1 3.83Å; L372-I376 HydrophobicContact CD1-CD1 4Å; L372-I376 WeakPolarHBondContact O-CB 3.31Å; L372-I376 PolarHBondContact O-N 3.03Å; I376-F380 VanDerWaalsContact O-CB 3.27Å; I376-F380 WeakPolarHBondContact O-CB 3.4Å; I376-F380 PolarHBondContact O-N 3.01Å; I376-A399 HydrophobicContact CD1-CB 4.43Å; I376-A399 HydrophobicContact CG2-CB 4.28Å; I376-F400 HydrophobicContact CG2-CB 4.1Å; I376-F400 HydrophobicContact CG2-CD2 4.3Å; I376-A403 HydrophobicContact CB-CB 4.24Å; I376-A403 HydrophobicContact CD1-CB 4.12Å; I376-A403 HydrophobicContact CG2-CB 3.68Å
377	L	95.1	Very high	86.5	Confident	0 Å²	0	43 Å²	43	0%	0	23%	0.234	C	C	.	.	I	π-helix	trans	-75.6	-53.3	-173.8	-77.9	63	0	0	0	111.7	L372 T373 F380 S381 F400 A403 L407 L426	L372-L377 HydrophobicContact CD2-CD1 4.31Å; L372-L377 HydrophobicContact CG-CD1 4.17Å; L372-L377 WeakPolarHBondContact O-CD1 3.29Å; L372-L377 PolarHBondContact O-N 3.04Å; T373-L377 HydrophobicContact CG2-CB 4.27Å; T373-L377 HydrophobicContact CG2-CD2 4.49Å; T373-L377 PolarHBondContact O-N 2.71Å; L377-F380 PolarHBondContact O-N 2.67Å; L377-S381 WeakPolarHBondContact O-CB 3.12Å; L377-S381 PolarHBondContact O-N 3.13Å; L377-S381 PolarHBondContact O-OG 3.18Å; L377-F400 HydrophobicContact CB-CE2 4.3Å; L377-F400 HydrophobicContact CG-CD2 4.41Å; L377-F400 HydrophobicContact CG-CE2 3.98Å; L377-A403 HydrophobicContact CD1-CB 4.06Å; L377-L407 HydrophobicContact CD1-CD1 4.2Å; L377-L407 HydrophobicContact CD2-CD1 3.77Å; L377-L426 HydrophobicContact CD2-CG 4.02Å
378	V	93.3	Very high	84.4	Confident	20 Å²	20	44.6 Å²	44.6	12%	0.121	24%	0.238	C	C	.	.	H	α-helix	trans	-59.4	-46.6	-178.8	178	0	0	0	0	112.1	T373 F380 S381 H382 I383 N425	T373-V378 HydrophobicContact CG2-CG2 4.01Å; T373-V378 PolarHBondContact O-N 3.13Å; V378-F380 PolarHBondContact O-N 3.5Å; V378-S381 PolarHBondContact O-N 2.97Å; V378-S381 PolarHBondContact O-OG 2.61Å; V378-H382 PolarHBondContact O-N 2.9Å; V378-H382 VanDerWaalsContact O-N 3.16Å; V378-I383 HydrophobicContact CG1-CD1 4.43Å; V378-I383 HydrophobicContact CG1-CG1 4.05Å; V378-I383 HydrophobicContact CG2-CD1 4.19Å; V378-N425 HydrophobicContact CG2-CB 3.74Å
379	P	90.5	Very high	82	Confident	6 Å²	6	49 Å²	49	4%	0.039	27%	0.268	C	S	.	.	H	α-helix	trans	-72.3	-16.3	-178.8	-18.7	34.9	0	0	0	113.9	K374 H391 A395	K374-P379 WeakPolarHBondContact O-CD 3.25Å; K374-P379 WeakPolarHBondContact O-CG 3.31Å; P379-H391 HydrophobicContact CB-CB 3.92Å; P379-H391 WeakPolarHBondContact CB-O 3.09Å; P379-H391 HydrophobicContact CG-CB 3.68Å; P379-A395 VanDerWaalsContact O-CB 3.27Å; P379-A395 WeakPolarHBondContact O-CB 3.33Å
380	F	90.6	Very high	79.8	Confident	40 Å²	40	57.1 Å²	57.1	18%	0.175	30%	0.303	C	S	.	.	H	α-helix	trans	-91.4	-30.5	174.5	-173.9	-91.1	0	0	0	112.8	I376 L377 V378 H382 P397 F400 L447	I376-F380 VanDerWaalsContact O-CB 3.27Å; I376-F380 WeakPolarHBondContact O-CB 3.4Å; I376-F380 PolarHBondContact O-N 3.01Å; L377-F380 PolarHBondContact O-N 2.67Å; V378-F380 PolarHBondContact O-N 3.5Å; F380-H382 PolarHBondContact O-CE1 2.95Å; F380-H382 PolarHBondContact O-ND1 3.41Å; F380-P397 HydrophobicContact CE2-CB 4.09Å; F380-P397 HydrophobicContact CE2-CG 3.97Å; F380-F400 HydrophobicContact CB-CB 4.11Å; F380-F400 HydrophobicContact CB-CD2 3.67Å; F380-F400 HydrophobicContact CB-CE2 4.26Å; F380-F400 HydrophobicContact CB-CG 3.95Å; F380-F400 HydrophobicContact CD1-CB 3.92Å; F380-F400 AromaticContact CD1-CD1 3.26Å; F380-F400 HydrophobicContact CD1-CD1 3.26Å; F380-F400 AromaticContact CD1-CD2 3.55Å; F380-F400 HydrophobicContact CD1-CD2 3.55Å; F380-F400 AromaticContact CD1-CE1 3.53Å; F380-F400 HydrophobicContact CD1-CE1 3.53Å; F380-F400 AromaticContact CD1-CE2 3.77Å; F380-F400 HydrophobicContact CD1-CE2 3.77Å; F380-F400 AromaticContact CD1-CG 3.29Å; F380-F400 HydrophobicContact CD1-CG 3.29Å; F380-F400 AromaticContact CD1-CZ 3.78Å; F380-F400 HydrophobicContact CD1-CZ 3.78Å; F380-F400 HydrophobicContact CD2-CB 3.87Å; F380-F400 HydrophobicContact CD2-CG 4.18Å; F380-F400 HydrophobicContact CE1-CB 4.38Å; F380-F400 AromaticContact CE1-CD1 3.33Å; F380-F400 HydrophobicContact CE1-CD1 3.33Å; F380-F400 HydrophobicContact CE1-CD2 4.45Å; F380-F400 AromaticContact CE1-CE1 3.6Å; F380-F400 HydrophobicContact CE1-CE1 3.6Å; F380-F400 AromaticContact CE1-CG 3.83Å; F380-F400 HydrophobicContact CE1-CG 3.83Å; F380-F400 HydrophobicContact CE1-CZ 4.26Å; F380-F400 HydrophobicContact CE2-CB 4.33Å; F380-F400 HydrophobicContact CG-CB 3.66Å; F380-F400 AromaticContact CG-CD1 3.94Å; F380-F400 HydrophobicContact CG-CD1 3.94Å; F380-F400 AromaticContact CG-CD2 3.72Å; F380-F400 HydrophobicContact CG-CD2 3.72Å; F380-F400 HydrophobicContact CG-CE2 4.33Å; F380-F400 AromaticContact CG-CG 3.51Å; F380-F400 HydrophobicContact CG-CG 3.51Å; F380-F400 HydrophobicContact CZ-CD1 4.06Å; F380-F400 HydrophobicContact CZ-CG 4.47Å; F380-L447 HydrophobicContact CE1-CD1 3.97Å; F380-L447 HydrophobicContact CE2-CD1 4.49Å; F380-L447 HydrophobicContact CZ-CD1 3.55Å
381	S	88.3	Confident	77.7	Confident	4 Å²	4	56 Å²	56	3%	0.028	30%	0.298	C	S	.	.	H	α-helix	trans	-88.4	-10.2	-177.3	67	0	0	0	0	114	L377 V378 I383 S429 S432	L377-S381 WeakPolarHBondContact O-CB 3.12Å; L377-S381 PolarHBondContact O-N 3.13Å; L377-S381 PolarHBondContact O-OG 3.18Å; V378-S381 PolarHBondContact O-N 2.97Å; V378-S381 PolarHBondContact O-OG 2.61Å; S381-I383 PolarHBondContact O-N 3.41Å; S381-I383 VanDerWaalsContact O-N 3.09Å; S381-S429 WeakPolarHBondContact OG-CA 3.44Å; S381-S429 VanDerWaalsContact OG-CB 3.31Å; S381-S429 WeakPolarHBondContact OG-CB 3.37Å; S381-S429 PolarHBondContact OG-OG 3.5Å; S381-S432 PolarHBondContact O-OG 3.46Å; S381-S432 VanDerWaalsContact O-OG 3.13Å
382	H	82.5	Confident	75.7	Confident	109 Å²	109	58.2 Å²	58.2	51%	0.505	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.1	22.7	177	-48.6	88.5	0	0	0	114.7	V378 F380 N384 G385	V378-H382 PolarHBondContact O-N 2.9Å; V378-H382 VanDerWaalsContact O-N 3.16Å; F380-H382 PolarHBondContact O-CE1 2.95Å; F380-H382 PolarHBondContact O-ND1 3.41Å; H382-N384 PolarHBondContact O-N 2.86Å; H382-G385 WeakPolarHBondContact O-CA 3.2Å; H382-G385 PolarHBondContact O-N 3.35Å
383	I	82.8	Confident	73.9	Confident	54 Å²	54	64.7 Å²	64.7	28%	0.277	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-24.1	-174.3	56.8	167.7	0	0	0	114.1	V378 S381 G385 N425 D428	V378-I383 HydrophobicContact CG1-CD1 4.43Å; V378-I383 HydrophobicContact CG1-CG1 4.05Å; V378-I383 HydrophobicContact CG2-CD1 4.19Å; S381-I383 PolarHBondContact O-N 3.41Å; S381-I383 VanDerWaalsContact O-N 3.09Å; I383-G385 VanDerWaalsContact C-N 3.26Å; I383-G385 PolarHBondContact O-N 3.49Å; I383-N425 HydrophobicContact CD1-CB 3.87Å; I383-D428 HydrophobicContact CD1-CB 3.96Å
384	N	73.5	Confident	72.3	Confident	68 Å²	68	64.9 Å²	64.9	36%	0.364	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	1.2	175.4	-64.4	8.6	0	0	0	112.6	H382 E388	H382-N384 PolarHBondContact O-N 2.86Å; N384-E388 PolarHBondContact ND2-OE2 2.77Å
385	G	62.5	Low	71.5	Confident	37 Å²	37	62 Å²	62	38%	0.381	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	67.8	-174.2	-174	0	0	0	0	0	113.7	H382 I383 A387	H382-G385 WeakPolarHBondContact O-CA 3.2Å; H382-G385 PolarHBondContact O-N 3.35Å; I383-G385 VanDerWaalsContact C-N 3.26Å; I383-G385 PolarHBondContact O-N 3.49Å; G385-A387 PolarHBondContact O-N 3.4Å
386	E	52.3	Low	71.2	Confident	182 Å²	182	63.1 Å²	63.1	85%	0.85	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-68.1	5.3	179.3	-57.5	-178.9	175	0	0	113.8	C389	E386-C389 PolarHBondContact O-SG 2.93Å
387	A	47.8	Very low	71	Confident	89 Å²	89	66.3 Å²	66.3	74%	0.736	36%	0.364	S	S	*	.	G	3₁₀ helix	trans	-78.1	-28	-170.6	0	0	0	0	0	114.2	G385 C389	G385-A387 PolarHBondContact O-N 3.4Å; A387-C389 PolarHBondContact O-N 3.42Å
388	E	51.5	Low	70.9	Confident	119 Å²	119	70.8 Å²	70.8	56%	0.556	38%	0.383	S	S	*	.			trans	-101.7	50.8	-175.1	-64	-158.7	122.4	0	0	113.3	N384 K390	N384-E388 PolarHBondContact ND2-OE2 2.77Å; E388-K390 PolarHBondContact O-N 2.93Å
389	C	46.1	Very low	71	Confident	94 Å²	94	70 Å²	70	64%	0.635	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.4	51.9	-176.8	-85.6	0	0	0	0	117.2	E386 A387	E386-C389 PolarHBondContact O-SG 2.93Å; A387-C389 PolarHBondContact O-N 3.42Å
390	K	50.9	Low	71.2	Confident	173 Å²	173	69.7 Å²	69.7	75%	0.752	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-138.7	-33.7	170	-71.7	-171.5	-179.7	177.1	0	112.9	E388	E388-K390 PolarHBondContact O-N 2.93Å
391	H	51.8	Low	71.5	Confident	74 Å²	74	69.2 Å²	69.2	34%	0.343	38%	0.375	S	S	.	.	S	Bend	trans	-89.6	-19.1	-178.2	-77	-83.8	0	0	0	114	P379 L393 I394 A395	P379-H391 HydrophobicContact CB-CB 3.92Å; P379-H391 WeakPolarHBondContact CB-O 3.09Å; P379-H391 HydrophobicContact CG-CB 3.68Å; H391-L393 PolarHBondContact O-N 3.48Å; H391-I394 WeakPolarHBondContact O-CA 3.26Å; H391-I394 WeakPolarHBondContact O-CB 3.27Å; H391-I394 PolarHBondContact O-N 3.16Å; H391-A395 PolarHBondContact O-N 3.1Å
392	D	54.8	Low	71.9	Confident	53 Å²	53	69.1 Å²	69.1	28%	0.283	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-28.6	172.4	-39.8	-46.9	0	0	0	111.7	I394 A395	D392-I394 PolarHBondContact O-N 3.43Å; D392-I394 VanDerWaalsContact O-N 3.11Å; D392-A395 WeakPolarHBondContact O-CB 3.39Å; D392-A395 PolarHBondContact O-N 3.36Å
393	L	58.6	Low	72.6	Confident	135 Å²	135	64 Å²	64	71%	0.707	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-1.7	170.8	-65.4	177	0	0	0	113.9	K341 H391	K341-L393 WeakPolarHBondContact CE-O 3.33Å; H391-L393 PolarHBondContact O-N 3.48Å
394	I	62.6	Low	73.4	Confident	9 Å²	9	61.4 Å²	61.4	5%	0.046	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.8	-21.8	172.8	-59.7	178.6	0	0	0	111.7	V344 H391 D392 D396	V344-I394 HydrophobicContact CB-CG2 4.45Å; V344-I394 HydrophobicContact CG1-CG2 4.22Å; V344-I394 HydrophobicContact CG2-CG2 3.96Å; H391-I394 WeakPolarHBondContact O-CA 3.26Å; H391-I394 WeakPolarHBondContact O-CB 3.27Å; H391-I394 PolarHBondContact O-N 3.16Å; D392-I394 PolarHBondContact O-N 3.43Å; D392-I394 VanDerWaalsContact O-N 3.11Å; I394-D396 PolarHBondContact O-N 2.69Å; I394-D396 VanDerWaalsContact O-N 3.11Å
395	A	77.8	Confident	74.5	Confident	24 Å²	24	58.3 Å²	58.3	20%	0.198	32%	0.322	C	S	.	.			trans	-52.5	114.6	-178	0	0	0	0	0	113.2	K341 P379 H391 D392	K341-A395 PolarHBondContact NZ-O 3.07Å; P379-A395 VanDerWaalsContact O-CB 3.27Å; P379-A395 WeakPolarHBondContact O-CB 3.33Å; H391-A395 PolarHBondContact O-N 3.1Å; D392-A395 WeakPolarHBondContact O-CB 3.39Å; D392-A395 PolarHBondContact O-N 3.36Å
396	D	86.8	Confident	76.2	Confident	28 Å²	28	56.6 Å²	56.6	15%	0.15	30%	0.304	C	S	.	.			trans	-136.1	124.7	178.7	-172.6	-67.3	0	0	0	110	K341 I394 K398 A399 F400	K341-D396 HydrophobicContact CD-CB 4.39Å; I394-D396 PolarHBondContact O-N 2.69Å; I394-D396 VanDerWaalsContact O-N 3.11Å; D396-K398 PolarHBondContact O-N 2.91Å; D396-K398 VanDerWaalsContact O-N 3.14Å; D396-K398 WeakPolarHBondContact OD1-CA 3.24Å; D396-K398 WeakPolarHBondContact OD1-CB 3.25Å; D396-K398 WeakPolarHBondContact OD1-CG 3.28Å; D396-K398 PolarHBondContact OD1-N 3.4Å; D396-A399 HydrophobicContact CB-CB 4.04Å; D396-A399 WeakPolarHBondContact O-CB 3.22Å; D396-A399 PolarHBondContact O-N 2.96Å; D396-A399 PolarHBondContact OD1-N 3.49Å; D396-F400 PolarHBondContact O-N 2.96Å
397	P	91	Very high	78.4	Confident	75 Å²	75	47.9 Å²	47.9	49%	0.487	26%	0.263	S	S	.	.	H	α-helix	trans	-55.8	-30.1	179.6	-24.7	31.1	0	0	0	114.4	F380 L401 L447	F380-P397 HydrophobicContact CE2-CB 4.09Å; F380-P397 HydrophobicContact CE2-CG 3.97Å; P397-L401 VanDerWaalsContact O-CB 3.24Å; P397-L401 WeakPolarHBondContact O-CB 3.36Å; P397-L401 PolarHBondContact O-N 3.35Å; P397-L447 HydrophobicContact CB-CD1 4.38Å
398	K	92.8	Very high	80.7	Confident	94 Å²	94	45.7 Å²	45.7	41%	0.409	24%	0.236	S	C	.	.	H	α-helix	trans	-75.4	-38.4	177.2	-51	168.5	-170.3	161	0	111.4	C345 D396 L401 C402	C345-K398 VanDerWaalsContact SG-CB 3.58Å; D396-K398 PolarHBondContact O-N 2.91Å; D396-K398 VanDerWaalsContact O-N 3.14Å; D396-K398 WeakPolarHBondContact OD1-CA 3.24Å; D396-K398 WeakPolarHBondContact OD1-CB 3.25Å; D396-K398 WeakPolarHBondContact OD1-CG 3.28Å; D396-K398 PolarHBondContact OD1-N 3.4Å; K398-L401 PolarHBondContact O-N 3.27Å; K398-C402 PolarHBondContact O-N 2.74Å; K398-C402 PolarHBondContact O-SG 3.04Å
399	A	95.2	Very high	82.9	Confident	2 Å²	2	41.9 Å²	41.9	2%	0.017	22%	0.219	C	C	.	.	H	α-helix	trans	-63.2	-47	175.1	0	0	0	0	0	110	V344 C345 I376 D396 C402 A403	V344-A399 HydrophobicContact CG1-CB 4.05Å; C345-A399 HydrophobicContact CB-CB 4.25Å; I376-A399 HydrophobicContact CD1-CB 4.43Å; I376-A399 HydrophobicContact CG2-CB 4.28Å; D396-A399 HydrophobicContact CB-CB 4.04Å; D396-A399 WeakPolarHBondContact O-CB 3.22Å; D396-A399 PolarHBondContact O-N 2.96Å; D396-A399 PolarHBondContact OD1-N 3.49Å; A399-C402 PolarHBondContact O-N 3.35Å; A399-A403 WeakPolarHBondContact O-CB 3.48Å; A399-A403 PolarHBondContact O-N 3.4Å
400	F	95.8	Very high	85.3	Confident	0 Å²	0	37.4 Å²	37.4	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-63.9	-39.5	174.9	-173.3	-102.9	0	0	0	112.7	I376 L377 F380 D396 C402 A403 T404 C433 L447	I376-F400 HydrophobicContact CG2-CB 4.1Å; I376-F400 HydrophobicContact CG2-CD2 4.3Å; L377-F400 HydrophobicContact CB-CE2 4.3Å; L377-F400 HydrophobicContact CG-CD2 4.41Å; L377-F400 HydrophobicContact CG-CE2 3.98Å; F380-F400 HydrophobicContact CB-CB 4.11Å; F380-F400 HydrophobicContact CB-CD2 3.67Å; F380-F400 HydrophobicContact CB-CE2 4.26Å; F380-F400 HydrophobicContact CB-CG 3.95Å; F380-F400 HydrophobicContact CD1-CB 3.92Å; F380-F400 AromaticContact CD1-CD1 3.26Å; F380-F400 HydrophobicContact CD1-CD1 3.26Å; F380-F400 AromaticContact CD1-CD2 3.55Å; F380-F400 HydrophobicContact CD1-CD2 3.55Å; F380-F400 AromaticContact CD1-CE1 3.53Å; F380-F400 HydrophobicContact CD1-CE1 3.53Å; F380-F400 AromaticContact CD1-CE2 3.77Å; F380-F400 HydrophobicContact CD1-CE2 3.77Å; F380-F400 AromaticContact CD1-CG 3.29Å; F380-F400 HydrophobicContact CD1-CG 3.29Å; F380-F400 AromaticContact CD1-CZ 3.78Å; F380-F400 HydrophobicContact CD1-CZ 3.78Å; F380-F400 HydrophobicContact CD2-CB 3.87Å; F380-F400 HydrophobicContact CD2-CG 4.18Å; F380-F400 HydrophobicContact CE1-CB 4.38Å; F380-F400 AromaticContact CE1-CD1 3.33Å; F380-F400 HydrophobicContact CE1-CD1 3.33Å; F380-F400 HydrophobicContact CE1-CD2 4.45Å; F380-F400 AromaticContact CE1-CE1 3.6Å; F380-F400 HydrophobicContact CE1-CE1 3.6Å; F380-F400 AromaticContact CE1-CG 3.83Å; F380-F400 HydrophobicContact CE1-CG 3.83Å; F380-F400 HydrophobicContact CE1-CZ 4.26Å; F380-F400 HydrophobicContact CE2-CB 4.33Å; F380-F400 HydrophobicContact CG-CB 3.66Å; F380-F400 AromaticContact CG-CD1 3.94Å; F380-F400 HydrophobicContact CG-CD1 3.94Å; F380-F400 AromaticContact CG-CD2 3.72Å; F380-F400 HydrophobicContact CG-CD2 3.72Å; F380-F400 HydrophobicContact CG-CE2 4.33Å; F380-F400 AromaticContact CG-CG 3.51Å; F380-F400 HydrophobicContact CG-CG 3.51Å; F380-F400 HydrophobicContact CZ-CD1 4.06Å; F380-F400 HydrophobicContact CZ-CG 4.47Å; D396-F400 PolarHBondContact O-N 2.96Å; F400-C402 VanDerWaalsContact C-N 3.34Å; F400-C402 PolarHBondContact O-N 3.03Å; F400-A403 PolarHBondContact O-N 3.15Å; F400-T404 HydrophobicContact CD1-CG2 4.11Å; F400-T404 HydrophobicContact CD2-CG2 4.23Å; F400-T404 HydrophobicContact CE1-CG2 3.76Å; F400-T404 HydrophobicContact CE2-CG2 3.91Å; F400-T404 HydrophobicContact CG-CG2 4.33Å; F400-T404 HydrophobicContact CZ-CG2 3.65Å; F400-T404 WeakPolarHBondContact O-CB 3.19Å; F400-T404 WeakPolarHBondContact O-CG2 3.19Å; F400-T404 PolarHBondContact O-N 3.33Å; F400-T404 PolarHBondContact O-OG1 3.41Å; F400-C433 HydrophobicContact CZ-CB 4.31Å; F400-L447 HydrophobicContact CD1-CD1 4.2Å; F400-L447 HydrophobicContact CD1-CD2 3.76Å; F400-L447 HydrophobicContact CD1-CG 4.42Å; F400-L447 HydrophobicContact CE1-CD2 4.42Å
401	L	95.6	Very high	87.5	Confident	30 Å²	30	29.1 Å²	29.1	16%	0.157	15%	0.153	C	C	.	.	H	α-helix	trans	-58	-44	171.8	-179.3	65.3	0	0	0	112.1	L194 P397 K398 T404 A405 N446 L447 N450	L194-L401 HydrophobicContact CD2-CD2 4.38Å; P397-L401 VanDerWaalsContact O-CB 3.24Å; P397-L401 WeakPolarHBondContact O-CB 3.36Å; P397-L401 PolarHBondContact O-N 3.35Å; K398-L401 PolarHBondContact O-N 3.27Å; L401-T404 PolarHBondContact O-OG1 3.33Å; L401-A405 WeakPolarHBondContact O-CB 3.4Å; L401-A405 PolarHBondContact O-N 2.9Å; L401-N446 HydrophobicContact CD1-CB 3.72Å; L401-L447 HydrophobicContact CB-CD2 3.57Å; L401-L447 HydrophobicContact CD1-CD2 3.86Å; L401-L447 HydrophobicContact CG-CD2 4.3Å; L401-N450 PolarHBondContact O-ND2 3.16Å
402	C	97.4	Very high	89.5	Confident	3 Å²	3	26.5 Å²	26.5	2%	0.02	14%	0.143	C	C	.	.	H	α-helix	trans	-73.5	-40.3	-179.7	-61.7	0	0	0	0	112.1	R309 A348 W352 K398 A399 F400 A405 C406	R309-C402 PolarHBondContact NH2-SG 2.91Å; A348-C402 HydrophobicContact CB-CB 3.75Å; W352-C402 HydrophobicContact CE3-CB 4.38Å; K398-C402 PolarHBondContact O-N 2.74Å; K398-C402 PolarHBondContact O-SG 3.04Å; A399-C402 PolarHBondContact O-N 3.35Å; F400-C402 VanDerWaalsContact C-N 3.34Å; F400-C402 PolarHBondContact O-N 3.03Å; C402-A405 PolarHBondContact O-N 2.92Å; C402-C406 WeakPolarHBondContact O-CB 3.11Å; C402-C406 PolarHBondContact O-N 2.71Å
403	A	98.1	Very high	91.2	Very high	0 Å²	0	25.9 Å²	25.9	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-61.2	-49.8	175.4	0	0	0	0	0	111.4	L372 I376 L377 A399 F400 A405 C406 L407	L372-A403 HydrophobicContact CD1-CB 3.87Å; L372-A403 HydrophobicContact CD2-CB 3.94Å; L372-A403 HydrophobicContact CG-CB 3.93Å; I376-A403 HydrophobicContact CB-CB 4.24Å; I376-A403 HydrophobicContact CD1-CB 4.12Å; I376-A403 HydrophobicContact CG2-CB 3.68Å; L377-A403 HydrophobicContact CD1-CB 4.06Å; A399-A403 WeakPolarHBondContact O-CB 3.48Å; A399-A403 PolarHBondContact O-N 3.4Å; F400-A403 PolarHBondContact O-N 3.15Å; A403-A405 PolarHBondContact O-N 3.14Å; A403-C406 WeakPolarHBondContact O-CB 3.22Å; A403-C406 PolarHBondContact O-N 2.91Å; A403-L407 WeakPolarHBondContact O-CG 3.34Å; A403-L407 PolarHBondContact O-N 2.84Å
404	T	97.9	Very high	92.8	Very high	0 Å²	0	23.9 Å²	23.9	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-65.3	-36.9	176.5	56.7	0	0	0	0	112.3	F400 L401 C406 L407 R408 L430 N450 I454	F400-T404 HydrophobicContact CD1-CG2 4.11Å; F400-T404 HydrophobicContact CD2-CG2 4.23Å; F400-T404 HydrophobicContact CE1-CG2 3.76Å; F400-T404 HydrophobicContact CE2-CG2 3.91Å; F400-T404 HydrophobicContact CG-CG2 4.33Å; F400-T404 HydrophobicContact CZ-CG2 3.65Å; F400-T404 WeakPolarHBondContact O-CB 3.19Å; F400-T404 WeakPolarHBondContact O-CG2 3.19Å; F400-T404 PolarHBondContact O-N 3.33Å; F400-T404 PolarHBondContact O-OG1 3.41Å; L401-T404 PolarHBondContact O-OG1 3.33Å; T404-C406 VanDerWaalsContact C-N 3.3Å; T404-C406 PolarHBondContact O-N 3.15Å; T404-L407 PolarHBondContact O-N 2.88Å; T404-R408 WeakPolarHBondContact O-CB 3.42Å; T404-R408 PolarHBondContact O-N 3.46Å; T404-L430 HydrophobicContact CG2-CD2 3.99Å; T404-N450 WeakPolarHBondContact OG1-CB 3.27Å; T404-N450 PolarHBondContact OG1-ND2 2.96Å; T404-N450 VanDerWaalsContact OG1-ND2 3.16Å; T404-I454 HydrophobicContact CG2-CD1 4.27Å; T404-I454 WeakPolarHBondContact O-CD1 3.37Å
405	A	97.3	Very high	94.2	Very high	4 Å²	4	27 Å²	27	3%	0.033	15%	0.146	C	C	.	.	H	α-helix	trans	-66.9	-31.1	174.1	0	0	0	0	0	112.7	W352 L401 C402 A403 N409 N450	W352-A405 VanDerWaalsContact CD1-C 3.47Å; W352-A405 HydrophobicContact CD2-CB 3.6Å; W352-A405 HydrophobicContact CE3-CB 4.24Å; W352-A405 HydrophobicContact CG-CB 3.81Å; W352-A405 HydrophobicContact CH2-CB 4.43Å; W352-A405 HydrophobicContact CZ2-CB 3.83Å; L401-A405 WeakPolarHBondContact O-CB 3.4Å; L401-A405 PolarHBondContact O-N 2.9Å; C402-A405 PolarHBondContact O-N 2.92Å; A403-A405 PolarHBondContact O-N 3.14Å; A405-N409 PolarHBondContact O-N 3.45Å; A405-N409 PolarHBondContact O-OD1 3.47Å; A405-N450 PolarHBondContact N-ND2 3.47Å
406	C	98.3	Very high	95	Very high	0 Å²	0	26 Å²	26	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-67.4	-47	170.3	-168.1	0	0	0	0	111.7	L351 W352 S355 C402 A403 T404 R408 N409 L410	L351-C406 PolarHBondContact O-SG 2.96Å; W352-C406 HydrophobicContact CB-CB 4.15Å; S355-C406 PolarHBondContact OG-SG 3.42Å; C402-C406 WeakPolarHBondContact O-CB 3.11Å; C402-C406 PolarHBondContact O-N 2.71Å; A403-C406 WeakPolarHBondContact O-CB 3.22Å; A403-C406 PolarHBondContact O-N 2.91Å; T404-C406 VanDerWaalsContact C-N 3.3Å; T404-C406 PolarHBondContact O-N 3.15Å; C406-R408 VanDerWaalsContact C-N 3.29Å; C406-R408 PolarHBondContact O-N 3.13Å; C406-N409 WeakPolarHBondContact O-CB 3.48Å; C406-N409 PolarHBondContact O-N 3.05Å; C406-L410 WeakPolarHBondContact O-CG 3.23Å; C406-L410 PolarHBondContact O-N 3.32Å; C406-L410 VanDerWaalsContact O-N 3.11Å
407	L	98.4	Very high	95.5	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.7	-33.4	176.1	-66	173.3	0	0	0	112.2	F368 L369 L372 L377 A403 T404 L410 S411 M420 L426 I454	F368-L407 HydrophobicContact CE1-CD2 4.22Å; L369-L407 HydrophobicContact CD2-CD2 3.51Å; L372-L407 HydrophobicContact CD2-CD1 4.02Å; L372-L407 HydrophobicContact CD2-CD2 3.91Å; L372-L407 HydrophobicContact CD2-CG 3.78Å; L377-L407 HydrophobicContact CD1-CD1 4.2Å; L377-L407 HydrophobicContact CD2-CD1 3.77Å; A403-L407 WeakPolarHBondContact O-CG 3.34Å; A403-L407 PolarHBondContact O-N 2.84Å; T404-L407 PolarHBondContact O-N 2.88Å; L407-L410 PolarHBondContact O-N 2.78Å; L407-S411 WeakPolarHBondContact O-CB 3.46Å; L407-S411 PolarHBondContact O-N 3.2Å; L407-S411 PolarHBondContact O-OG 3.25Å; L407-M420 HydrophobicContact CB-CE 4.15Å; L407-M420 HydrophobicContact CB-SD 4.38Å; L407-M420 HydrophobicContact CD2-CE 3.6Å; L407-M420 HydrophobicContact CD2-SD 4.07Å; L407-M420 HydrophobicContact CG-CE 4.49Å; L407-L426 HydrophobicContact CD1-CD1 4.46Å; L407-L426 HydrophobicContact CD2-CD1 4.39Å; L407-I454 HydrophobicContact CB-CD1 3.8Å; L407-I454 HydrophobicContact CB-CG1 4.18Å
408	R	97.2	Very high	95.6	Very high	42 Å²	42	25.2 Å²	25.2	16%	0.158	12%	0.123	C	C	.	.	H	α-helix	trans	-63	-39.4	173.3	-176.6	176.9	175.5	176	1.1	112.3	T404 C406 S411 E449 N450 C453 I454	T404-R408 WeakPolarHBondContact O-CB 3.42Å; T404-R408 PolarHBondContact O-N 3.46Å; C406-R408 VanDerWaalsContact C-N 3.29Å; C406-R408 PolarHBondContact O-N 3.13Å; R408-S411 PolarHBondContact O-OG 3.4Å; R408-E449 IonicContact CZ-OE1 2.77Å; R408-E449 VanDerWaalsContact CZ-OE1 3.28Å; R408-E449 IonicContact NH1-OE1 3.35Å; R408-E449 PolarHBondContact NH1-OE1 3.08Å; R408-E449 IonicContact NH2-OE1 3.55Å; R408-E449 PolarHBondContact NH2-OE1 3.49Å; R408-N450 VanDerWaalsContact CD-OD1 3.32Å; R408-N450 WeakPolarHBondContact CD-OD1 3.26Å; R408-N450 PolarHBondContact NH1-OD1 2.86Å; R408-C453 HydrophobicContact CG-CB 4.09Å; R408-C453 VanDerWaalsContact CZ-SG 3.57Å; R408-I454 HydrophobicContact CB-CG1 4.1Å
409	N	96.8	Very high	95.7	Very high	39 Å²	39	21.6 Å²	21.6	21%	0.209	11%	0.108	C	C	.	.	H	α-helix	trans	-68.9	-37.9	174.9	-68.1	-12.1	0	0	0	112.9	W352 S355 K361 A405 C406 S412	W352-N409 PolarHBondContact O-ND2 3.38Å; S355-N409 PolarHBondContact OG-ND2 3Å; K361-N409 WeakPolarHBondContact CE-O 3.43Å; K361-N409 PolarHBondContact NZ-O 3.12Å; A405-N409 PolarHBondContact O-N 3.45Å; A405-N409 PolarHBondContact O-OD1 3.47Å; C406-N409 WeakPolarHBondContact O-CB 3.48Å; C406-N409 PolarHBondContact O-N 3.05Å; N409-S412 PolarHBondContact O-OG 3.29Å
410	L	97.5	Very high	95.8	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-77.9	-38.8	-178.1	-66.3	169.2	0	0	0	111.9	K361 F364 F368 C406 L407 S412 D413 H416 M420	K361-L410 HydrophobicContact CB-CD2 3.93Å; K361-L410 HydrophobicContact CD-CD2 4.37Å; K361-L410 HydrophobicContact CG-CD2 3.91Å; F364-L410 HydrophobicContact CB-CD1 3.97Å; F364-L410 HydrophobicContact CB-CD2 3.92Å; F364-L410 HydrophobicContact CD1-CD1 3.81Å; F364-L410 HydrophobicContact CD1-CD2 4.43Å; F364-L410 HydrophobicContact CD2-CD2 3.76Å; F364-L410 HydrophobicContact CE1-CD1 4.39Å; F364-L410 HydrophobicContact CE2-CD2 4.3Å; F364-L410 HydrophobicContact CG-CD1 3.91Å; F364-L410 HydrophobicContact CG-CD2 3.81Å; F368-L410 HydrophobicContact CD1-CD1 4.25Å; F368-L410 HydrophobicContact CE1-CD1 3.46Å; F368-L410 VanDerWaalsContact CE1-CD1 3.46Å; F368-L410 HydrophobicContact CZ-CD1 3.96Å; C406-L410 WeakPolarHBondContact O-CG 3.23Å; C406-L410 PolarHBondContact O-N 3.32Å; C406-L410 VanDerWaalsContact O-N 3.11Å; L407-L410 PolarHBondContact O-N 2.78Å; L410-S412 PolarHBondContact O-N 2.86Å; L410-D413 PolarHBondContact O-N 2.95Å; L410-H416 HydrophobicContact CB-CB 4.15Å; L410-H416 WeakPolarHBondContact O-CB 3.33Å; L410-M420 HydrophobicContact CB-CE 3.66Å
411	S	96.6	Very high	95.8	Very high	0 Å²	0	22.3 Å²	22.3	0%	0	11%	0.11	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-1.5	-176.9	57	0	0	0	0	115.2	L407 R408 D413 R417 N457	L407-S411 WeakPolarHBondContact O-CB 3.46Å; L407-S411 PolarHBondContact O-N 3.2Å; L407-S411 PolarHBondContact O-OG 3.25Å; R408-S411 PolarHBondContact O-OG 3.4Å; S411-D413 PolarHBondContact O-N 3.42Å; S411-R417 WeakPolarHBondContact O-CD 3.31Å; S411-R417 WeakPolarHBondContact O-CG 3.46Å; S411-N457 WeakPolarHBondContact O-CB 3.48Å; S411-N457 PolarHBondContact O-ND2 3.44Å; S411-N457 PolarHBondContact OG-ND2 3.14Å
412	S	92.6	Very high	95.8	Very high	19 Å²	19	24.6 Å²	24.6	13%	0.133	13%	0.129	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-36	163.3	48.7	0	0	0	0	111.7	K361 N409 L410 R417	K361-S412 PolarHBondContact NZ-OG 2.83Å; N409-S412 PolarHBondContact O-OG 3.29Å; L410-S412 PolarHBondContact O-N 2.86Å; S412-R417 PolarHBondContact O-NH1 2.67Å
413	D	91.9	Very high	95.7	Very high	40 Å²	40	25.1 Å²	25.1	21%	0.214	13%	0.133	C	C	.	.	S	Bend	trans	-96	138.8	-165	-21	-47.1	0	0	0	112.3	K361 L410 S411 N415 H416 R417	K361-D413 WeakPolarHBondContact CD-OD2 3.37Å; K361-D413 IonicContact NZ-OD1 3.82Å; K361-D413 PolarHBondContact NZ-OD1 3.39Å; K361-D413 IonicContact NZ-OD2 3.32Å; L410-D413 PolarHBondContact O-N 2.95Å; S411-D413 PolarHBondContact O-N 3.42Å; D413-N415 PolarHBondContact O-N 3.05Å; D413-N415 VanDerWaalsContact O-N 3.12Å; D413-H416 PolarHBondContact O-N 2.92Å; D413-H416 IonicContact OD2-CE1 2.59Å; D413-H416 PolarHBondContact OD2-CE1 3.29Å; D413-H416 IonicContact OD2-CG 2.78Å; D413-H416 IonicContact OD2-ND1 2.79Å; D413-H416 PolarHBondContact OD2-ND1 3.07Å; D413-R417 WeakPolarHBondContact O-CG 3.41Å; D413-R417 PolarHBondContact O-N 3.18Å
414	D	90.8	Very high	95.5	Very high	92 Å²	92	31.9 Å²	31.9	49%	0.492	16%	0.164	S	C	.	.	H	α-helix	trans	-55.3	-37.5	-171.3	-57.8	-5.4	0	0	0	113.6	R417 R418	D414-R417 IonicContact OD1-CZ 2.72Å; D414-R417 IonicContact OD1-NH1 2.71Å; D414-R417 PolarHBondContact OD1-NH1 3.11Å; D414-R417 IonicContact OD1-NH2 2.68Å; D414-R417 PolarHBondContact OD1-NH2 2.82Å; D414-R418 PolarHBondContact O-N 2.85Å; D414-R418 VanDerWaalsContact O-N 3.13Å
415	N	91.9	Very high	95.4	Very high	74 Å²	74	33.9 Å²	33.9	40%	0.396	18%	0.175	S	C	.	.	H	α-helix	trans	-70.3	-44.2	179.5	-156.9	64.1	0	0	0	111.7	D413 R417 R418 N419	D413-N415 PolarHBondContact O-N 3.05Å; D413-N415 VanDerWaalsContact O-N 3.12Å; N415-R417 PolarHBondContact O-N 3.48Å; N415-R418 PolarHBondContact O-N 3.23Å; N415-R418 VanDerWaalsContact OD1-CZ 3.29Å; N415-R418 PolarHBondContact OD1-NH1 2.88Å; N415-R418 PolarHBondContact OD1-NH2 3.42Å; N415-N419 WeakPolarHBondContact O-CB 3.35Å; N415-N419 PolarHBondContact O-N 2.83Å; N415-N419 PolarHBondContact O-OD1 3.37Å; N415-N419 VanDerWaalsContact O-OD1 3.05Å
416	H	95.5	Very high	95.4	Very high	5 Å²	5	33.7 Å²	33.7	2%	0.023	17%	0.173	C	C	.	.	H	α-helix	trans	-65.4	-36.7	174.9	-67.8	120.1	0	0	0	112.2	K361 F364 L410 D413 N419 M420	K361-H416 PolarHBondContact O-CE1 3.2Å; K361-H416 PolarHBondContact O-NE2 3.3Å; F364-H416 PolarHBondContact O-NE2 3.19Å; L410-H416 HydrophobicContact CB-CB 4.15Å; L410-H416 WeakPolarHBondContact O-CB 3.33Å; D413-H416 PolarHBondContact O-N 2.92Å; D413-H416 IonicContact OD2-CE1 2.59Å; D413-H416 PolarHBondContact OD2-CE1 3.29Å; D413-H416 IonicContact OD2-CG 2.78Å; D413-H416 IonicContact OD2-ND1 2.79Å; D413-H416 PolarHBondContact OD2-ND1 3.07Å; H416-N419 PolarHBondContact O-N 2.72Å; H416-M420 HydrophobicContact CB-CE 4.31Å; H416-M420 WeakPolarHBondContact O-CB 3.44Å; H416-M420 VanDerWaalsContact O-CG 3.26Å; H416-M420 WeakPolarHBondContact O-CG 3.44Å; H416-M420 PolarHBondContact O-N 2.68Å
417	R	96.3	Very high	95.4	Very high	2 Å²	2	33.7 Å²	33.7	1%	0.008	17%	0.173	C	C	.	.	H	α-helix	trans	-59.1	-48.3	172.7	-64.7	-158	-56.6	-75.2	-1	111.9	S411 S412 D413 D414 N415 M420 R421 N457 L458 E461	S411-R417 WeakPolarHBondContact O-CD 3.31Å; S411-R417 WeakPolarHBondContact O-CG 3.46Å; S412-R417 PolarHBondContact O-NH1 2.67Å; D413-R417 WeakPolarHBondContact O-CG 3.41Å; D413-R417 PolarHBondContact O-N 3.18Å; D414-R417 IonicContact OD1-CZ 2.72Å; D414-R417 IonicContact OD1-NH1 2.71Å; D414-R417 PolarHBondContact OD1-NH1 3.11Å; D414-R417 IonicContact OD1-NH2 2.68Å; D414-R417 PolarHBondContact OD1-NH2 2.82Å; N415-R417 PolarHBondContact O-N 3.48Å; R417-M420 PolarHBondContact O-N 3.03Å; R417-R421 WeakPolarHBondContact O-CG 3.37Å; R417-R421 PolarHBondContact O-N 3.19Å; R417-N457 WeakPolarHBondContact CD-O 3.48Å; R417-L458 HydrophobicContact CB-CD2 4.27Å; R417-L458 HydrophobicContact CG-CD2 4.47Å; R417-E461 IonicContact NH2-OE2 3.09Å
418	R	94	Very high	95.3	Very high	83 Å²	83	34.2 Å²	34.2	31%	0.313	18%	0.176	S	C	.	.	H	α-helix	trans	-61.1	-48.8	176.3	-76.3	-175.9	-76.9	92.8	-3.6	111.6	D414 N415 M420 R421 S422 D465	D414-R418 PolarHBondContact O-N 2.85Å; D414-R418 VanDerWaalsContact O-N 3.13Å; N415-R418 PolarHBondContact O-N 3.23Å; N415-R418 VanDerWaalsContact OD1-CZ 3.29Å; N415-R418 PolarHBondContact OD1-NH1 2.88Å; N415-R418 PolarHBondContact OD1-NH2 3.42Å; R418-M420 VanDerWaalsContact C-N 3.32Å; R418-M420 PolarHBondContact O-N 3.27Å; R418-R421 PolarHBondContact O-N 3.03Å; R418-R421 VanDerWaalsContact O-N 3.1Å; R418-S422 PolarHBondContact O-N 2.75Å; R418-S422 VanDerWaalsContact O-N 3.16Å; R418-D465 VanDerWaalsContact CG-OD2 3.28Å; R418-D465 WeakPolarHBondContact CG-OD2 3.26Å
419	N	95.2	Very high	95.3	Very high	19 Å²	19	32.2 Å²	32.2	10%	0.102	17%	0.168	C	C	.	.	H	α-helix	trans	-64.3	-35.3	-177.6	-67.6	17.6	0	0	0	112.3	E366 L369 N415 H416 S422 C423	E366-N419 HydrophobicContact CG-CB 4.11Å; E366-N419 VanDerWaalsContact CG-ND2 3.33Å; E366-N419 WeakPolarHBondContact CG-ND2 3.28Å; E366-N419 PolarHBondContact OE1-ND2 2.94Å; L369-N419 HydrophobicContact CD1-CB 3.72Å; N415-N419 WeakPolarHBondContact O-CB 3.35Å; N415-N419 PolarHBondContact O-N 2.83Å; N415-N419 PolarHBondContact O-OD1 3.37Å; N415-N419 VanDerWaalsContact O-OD1 3.05Å; H416-N419 PolarHBondContact O-N 2.72Å; N419-S422 PolarHBondContact O-N 3.12Å; N419-C423 PolarHBondContact O-N 2.86Å; N419-C423 VanDerWaalsContact O-N 3.07Å
420	M	97.6	Very high	95.3	Very high	0 Å²	0	30.3 Å²	30.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-69.6	-31.5	173.6	-73.6	-175.5	-155.7	0	0	113.6	L369 L407 L410 H416 R417 R418 S422 C423 L426 I454 L458	L369-M420 HydrophobicContact CD1-CG 3.93Å; L369-M420 HydrophobicContact CD2-CE 4.1Å; L369-M420 HydrophobicContact CD2-CG 3.92Å; L407-M420 HydrophobicContact CB-CE 4.15Å; L407-M420 HydrophobicContact CB-SD 4.38Å; L407-M420 HydrophobicContact CD2-CE 3.6Å; L407-M420 HydrophobicContact CD2-SD 4.07Å; L407-M420 HydrophobicContact CG-CE 4.49Å; L410-M420 HydrophobicContact CB-CE 3.66Å; H416-M420 HydrophobicContact CB-CE 4.31Å; H416-M420 WeakPolarHBondContact O-CB 3.44Å; H416-M420 VanDerWaalsContact O-CG 3.26Å; H416-M420 WeakPolarHBondContact O-CG 3.44Å; H416-M420 PolarHBondContact O-N 2.68Å; R417-M420 PolarHBondContact O-N 3.03Å; R418-M420 VanDerWaalsContact C-N 3.32Å; R418-M420 PolarHBondContact O-N 3.27Å; M420-S422 VanDerWaalsContact C-N 3.34Å; M420-C423 PolarHBondContact O-N 3.24Å; M420-L426 HydrophobicContact CB-CD1 4.21Å; M420-L426 HydrophobicContact CB-CD2 4.05Å; M420-L426 HydrophobicContact CG-CD1 3.94Å; M420-L426 HydrophobicContact CG-CD2 4.35Å; M420-I454 HydrophobicContact SD-CG2 4.36Å; M420-L458 HydrophobicContact CB-CD1 4.09Å; M420-L458 HydrophobicContact CB-CD2 3.66Å; M420-L458 HydrophobicContact CG-CD2 4.47Å; M420-L458 HydrophobicContact SD-CD2 4.12Å
421	R	95.9	Very high	95.2	Very high	16 Å²	16	30.3 Å²	30.3	6%	0.06	16%	0.159	C	C	.	.	H	α-helix	trans	-71.5	-28.7	173.9	-68.5	-179	-158.3	126.1	1.3	113.5	R417 R418 I427 L458 Y460 D465 V523 L526	R417-R421 WeakPolarHBondContact O-CG 3.37Å; R417-R421 PolarHBondContact O-N 3.19Å; R418-R421 PolarHBondContact O-N 3.03Å; R418-R421 VanDerWaalsContact O-N 3.1Å; R421-I427 HydrophobicContact CB-CD1 4.32Å; R421-I427 HydrophobicContact CG-CD1 4.06Å; R421-L458 VanDerWaalsContact CZ-O 3.27Å; R421-L458 PolarHBondContact NE-O 3.08Å; R421-L458 PolarHBondContact NH2-O 2.79Å; R421-Y460 PolarHBondContact NH2-O 3.27Å; R421-D465 IonicContact CZ-OD2 3.5Å; R421-D465 IonicContact NH1-OD2 3.12Å; R421-D465 PolarHBondContact NH1-OD2 3.23Å; R421-V523 HydrophobicContact CB-CB 4.49Å; R421-V523 HydrophobicContact CB-CG2 4.04Å; R421-V523 HydrophobicContact CG-CG2 4.05Å; R421-L526 HydrophobicContact CG-CD1 4.19Å
422	S	94.1	Very high	95.1	Very high	78 Å²	78	31.5 Å²	31.5	55%	0.545	17%	0.167	S	C	.	.	S	Bend	trans	-89.2	-5.6	174.8	-61.5	0	0	0	0	113.4	R418 N419 M420 E424	R418-S422 PolarHBondContact O-N 2.75Å; R418-S422 VanDerWaalsContact O-N 3.16Å; N419-S422 PolarHBondContact O-N 3.12Å; M420-S422 VanDerWaalsContact C-N 3.34Å; S422-E424 PolarHBondContact O-N 2.76Å
423	C	96.1	Very high	95.1	Very high	15 Å²	15	31.6 Å²	31.6	10%	0.101	17%	0.167	C	C	.	.	S	Bend	trans	-80.9	112.3	175.3	-171.4	0	0	0	0	110.4	L369 N419 M420 L426	L369-C423 HydrophobicContact CB-CB 4.32Å; N419-C423 PolarHBondContact O-N 2.86Å; N419-C423 VanDerWaalsContact O-N 3.07Å; M420-C423 PolarHBondContact O-N 3.24Å; C423-L426 HydrophobicContact CB-CB 3.89Å; C423-L426 HydrophobicContact CB-CD1 3.86Å; C423-L426 HydrophobicContact CB-CG 4.49Å; C423-L426 WeakPolarHBondContact O-CB 3.5Å; C423-L426 PolarHBondContact O-N 3.16Å
424	E	94.7	Very high	95.3	Very high	141 Å²	141	29.7 Å²	29.7	66%	0.659	16%	0.157	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.8	140.3	173.3	-159.6	-164.7	143.4	0	0	111.5	S422 L426	S422-E424 PolarHBondContact O-N 2.76Å; E424-L426 PolarHBondContact O-N 3.46Å
425	N	95.3	Very high	95.4	Very high	42 Å²	42	26.8 Å²	26.8	23%	0.225	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.3	-6.8	176.3	-60.4	-49.8	0	0	0	117.1	T373 V378 I383 D428 S429	T373-N425 HydrophobicContact CG2-CB 4.19Å; V378-N425 HydrophobicContact CG2-CB 3.74Å; I383-N425 HydrophobicContact CD1-CB 3.87Å; N425-D428 VanDerWaalsContact CA-OD2 3.31Å; N425-D428 WeakPolarHBondContact CA-OD2 3.24Å; N425-D428 PolarHBondContact N-OD2 3.18Å; N425-S429 WeakPolarHBondContact O-CB 3.31Å; N425-S429 PolarHBondContact O-N 3.07Å; N425-S429 PolarHBondContact O-OG 2.7Å
426	L	97.9	Very high	95.4	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-68.9	-51.5	-178.2	-176.3	155.9	0	0	0	111.1	L369 T373 L377 L407 M420 C423 E424 L430 L458	L369-L426 HydrophobicContact CB-CD1 4.37Å; L369-L426 HydrophobicContact CD2-CD1 4.28Å; T373-L426 HydrophobicContact CG2-CB 4.07Å; L377-L426 HydrophobicContact CD2-CG 4.02Å; L407-L426 HydrophobicContact CD1-CD1 4.46Å; L407-L426 HydrophobicContact CD2-CD1 4.39Å; M420-L426 HydrophobicContact CB-CD1 4.21Å; M420-L426 HydrophobicContact CB-CD2 4.05Å; M420-L426 HydrophobicContact CG-CD1 3.94Å; M420-L426 HydrophobicContact CG-CD2 4.35Å; C423-L426 HydrophobicContact CB-CB 3.89Å; C423-L426 HydrophobicContact CB-CD1 3.86Å; C423-L426 HydrophobicContact CB-CG 4.49Å; C423-L426 WeakPolarHBondContact O-CB 3.5Å; C423-L426 PolarHBondContact O-N 3.16Å; E424-L426 PolarHBondContact O-N 3.46Å; L426-L430 HydrophobicContact CD2-CD1 3.79Å; L426-L430 VanDerWaalsContact O-CG 3.32Å; L426-L430 WeakPolarHBondContact O-CG 3.47Å; L426-L430 PolarHBondContact O-N 3.41Å; L426-L458 HydrophobicContact CD2-CD1 4.19Å
427	I	97.8	Very high	95.2	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.14	C	C	.	.	H	α-helix	trans	-70.4	-38.8	179.5	-61.5	-179.6	0	0	0	110.1	R421 S429 L430 A431 L455 L458 G522 W525 L526	R421-I427 HydrophobicContact CB-CD1 4.32Å; R421-I427 HydrophobicContact CG-CD1 4.06Å; I427-S429 VanDerWaalsContact C-N 3.33Å; I427-S429 PolarHBondContact O-N 3.03Å; I427-L430 PolarHBondContact O-N 3.03Å; I427-L430 VanDerWaalsContact O-N 3.16Å; I427-A431 VanDerWaalsContact O-CB 3.27Å; I427-A431 WeakPolarHBondContact O-CB 3.36Å; I427-A431 PolarHBondContact O-N 3.42Å; I427-L455 HydrophobicContact CG2-CD2 4.03Å; I427-L458 HydrophobicContact CD1-CD1 4.09Å; I427-L458 HydrophobicContact CG1-CD1 3.87Å; I427-G522 WeakPolarHBondContact CG2-O 3.48Å; I427-W525 HydrophobicContact CG2-CB 3.62Å; I427-W525 HydrophobicContact CG2-CG 4.35Å; I427-L526 HydrophobicContact CD1-CD1 4.07Å; I427-L526 HydrophobicContact CD1-CD2 4.15Å; I427-L526 HydrophobicContact CD1-CG 4.09Å; I427-L526 HydrophobicContact CG2-CD2 3.89Å; I427-L526 HydrophobicContact CG2-CG 4.25Å
428	D	95.8	Very high	95	Very high	11 Å²	11	27 Å²	27	6%	0.059	14%	0.144	C	C	.	.	H	α-helix	trans	-57.6	-45.6	178.4	-48.3	-95.1	0	0	0	111.4	I383 N425 A431 S432 L521 G522 W525	I383-D428 HydrophobicContact CD1-CB 3.96Å; N425-D428 VanDerWaalsContact CA-OD2 3.31Å; N425-D428 WeakPolarHBondContact CA-OD2 3.24Å; N425-D428 PolarHBondContact N-OD2 3.18Å; D428-A431 PolarHBondContact O-N 3.4Å; D428-S432 VanDerWaalsContact O-CB 3.26Å; D428-S432 WeakPolarHBondContact O-CB 3.49Å; D428-S432 PolarHBondContact O-N 3.37Å; D428-L521 WeakPolarHBondContact OD1-CA 3.47Å; D428-G522 PolarHBondContact OD1-N 3.47Å; D428-G522 WeakPolarHBondContact OD2-CA 3.46Å; D428-G522 PolarHBondContact OD2-N 3.5Å; D428-W525 PolarHBondContact OD1-NE1 2.94Å
429	S	96.3	Very high	94.7	Very high	0 Å²	0	28.2 Å²	28.2	0%	0	16%	0.16	C	C	.	.	H	α-helix	trans	-62	-46.1	174.3	-67.7	0	0	0	0	112.9	S381 N425 I427 C433	S381-S429 WeakPolarHBondContact OG-CA 3.44Å; S381-S429 VanDerWaalsContact OG-CB 3.31Å; S381-S429 WeakPolarHBondContact OG-CB 3.37Å; S381-S429 PolarHBondContact OG-OG 3.5Å; N425-S429 WeakPolarHBondContact O-CB 3.31Å; N425-S429 PolarHBondContact O-N 3.07Å; N425-S429 PolarHBondContact O-OG 2.7Å; I427-S429 VanDerWaalsContact C-N 3.33Å; I427-S429 PolarHBondContact O-N 3.03Å; S429-C433 PolarHBondContact O-N 2.99Å; S429-C433 PolarHBondContact O-SG 3.02Å; S429-C433 VanDerWaalsContact O-SG 3.35Å
430	L	97.6	Very high	94	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	18%	0.183	C	C	.	.	H	α-helix	trans	-67.1	-37.7	179.9	-66.2	173.7	0	0	0	112	T404 L426 I427 T434 C451 I454 L455	T404-L430 HydrophobicContact CG2-CD2 3.99Å; L426-L430 HydrophobicContact CD2-CD1 3.79Å; L426-L430 VanDerWaalsContact O-CG 3.32Å; L426-L430 WeakPolarHBondContact O-CG 3.47Å; L426-L430 PolarHBondContact O-N 3.41Å; I427-L430 PolarHBondContact O-N 3.03Å; I427-L430 VanDerWaalsContact O-N 3.16Å; L430-T434 WeakPolarHBondContact O-CB 3.46Å; L430-T434 PolarHBondContact O-N 3Å; L430-T434 VanDerWaalsContact O-N 3.12Å; L430-T434 PolarHBondContact O-OG1 3.04Å; L430-C451 HydrophobicContact CD2-CB 4.21Å; L430-I454 HydrophobicContact CD1-CB 4.03Å; L430-I454 HydrophobicContact CD1-CD1 4.11Å; L430-I454 HydrophobicContact CD1-CG2 3.53Å; L430-I454 HydrophobicContact CD2-CD1 3.8Å; L430-L455 HydrophobicContact CB-CD1 4.21Å; L430-L455 HydrophobicContact CB-CD2 4.06Å; L430-L455 HydrophobicContact CB-CG 4.15Å
431	A	95.9	Very high	92.3	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-69.5	-46.1	177.5	0	0	0	0	0	111.1	I427 D428 C433 T434 T435 W525 L531	I427-A431 VanDerWaalsContact O-CB 3.27Å; I427-A431 WeakPolarHBondContact O-CB 3.36Å; I427-A431 PolarHBondContact O-N 3.42Å; D428-A431 PolarHBondContact O-N 3.4Å; A431-C433 PolarHBondContact O-N 3.29Å; A431-T434 CarbonylContact O-C 3.5Å; A431-T434 WeakPolarHBondContact O-CA 3.49Å; A431-T434 WeakPolarHBondContact O-CB 3.49Å; A431-T434 PolarHBondContact O-N 2.91Å; A431-T435 WeakPolarHBondContact O-CG2 3.36Å; A431-T435 PolarHBondContact O-N 2.91Å; A431-T435 PolarHBondContact O-OG1 3.48Å; A431-W525 HydrophobicContact CB-CB 4.08Å; A431-W525 HydrophobicContact CB-CD2 3.42Å; A431-W525 VanDerWaalsContact CB-CD2 3.42Å; A431-W525 HydrophobicContact CB-CE3 3.44Å; A431-W525 VanDerWaalsContact CB-CE3 3.44Å; A431-W525 HydrophobicContact CB-CG 3.74Å; A431-W525 HydrophobicContact CB-CZ3 4.07Å; A431-L531 HydrophobicContact CB-CD1 4.27Å; A431-L531 HydrophobicContact CB-CD2 4.43Å
432	S	93.4	Very high	91.6	Very high	25 Å²	25	45.3 Å²	45.3	18%	0.175	23%	0.233	C	C	.	.	H	α-helix	trans	-53.9	-51.8	173.2	178.6	0	0	0	0	111.8	S381 D428 T434 T435 E436	S381-S432 PolarHBondContact O-OG 3.46Å; S381-S432 VanDerWaalsContact O-OG 3.13Å; D428-S432 VanDerWaalsContact O-CB 3.26Å; D428-S432 WeakPolarHBondContact O-CB 3.49Å; D428-S432 PolarHBondContact O-N 3.37Å; S432-T434 PolarHBondContact O-N 2.91Å; S432-T435 PolarHBondContact O-N 2.9Å; S432-T435 PolarHBondContact O-OG1 2.95Å; S432-E436 WeakPolarHBondContact O-CB 3.42Å; S432-E436 PolarHBondContact O-N 3.36Å
433	C	93.4	Very high	91	Very high	20 Å²	20	42.1 Å²	42.1	14%	0.135	21%	0.21	C	C	.	.	H	α-helix	trans	-61.8	-29.6	176.4	-66.1	0	0	0	0	113.1	F400 S429 A431 A437	F400-C433 HydrophobicContact CZ-CB 4.31Å; S429-C433 PolarHBondContact O-N 2.99Å; S429-C433 PolarHBondContact O-SG 3.02Å; S429-C433 VanDerWaalsContact O-SG 3.35Å; A431-C433 PolarHBondContact O-N 3.29Å; C433-A437 WeakPolarHBondContact O-CB 3.32Å; C433-A437 PolarHBondContact O-N 2.81Å
434	T	95.6	Very high	90.6	Very high	0 Å²	0	44 Å²	44	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-78.1	-42.4	179.5	-59.3	0	0	0	0	112.3	L430 A431 S432 A438 V452 L455 L531 Y535 L538	L430-T434 WeakPolarHBondContact O-CB 3.46Å; L430-T434 PolarHBondContact O-N 3Å; L430-T434 VanDerWaalsContact O-N 3.12Å; L430-T434 PolarHBondContact O-OG1 3.04Å; A431-T434 CarbonylContact O-C 3.5Å; A431-T434 WeakPolarHBondContact O-CA 3.49Å; A431-T434 WeakPolarHBondContact O-CB 3.49Å; A431-T434 PolarHBondContact O-N 2.91Å; S432-T434 PolarHBondContact O-N 2.91Å; T434-A438 WeakPolarHBondContact O-CB 3.44Å; T434-A438 PolarHBondContact O-N 2.74Å; T434-A438 VanDerWaalsContact O-N 3.13Å; T434-V452 HydrophobicContact CG2-CG2 3.77Å; T434-L455 HydrophobicContact CG2-CD1 4.48Å; T434-L455 WeakPolarHBondContact OG1-CD1 3.39Å; T434-L531 HydrophobicContact CG2-CD1 3.9Å; T434-Y535 HydrophobicContact CG2-CE1 4.36Å; T434-L538 HydrophobicContact CG2-CD1 4.07Å
435	T	93.7	Very high	90.4	Very high	31 Å²	31	41.7 Å²	41.7	19%	0.19	21%	0.209	C	C	.	.	H	α-helix	trans	-69	-36.1	174.2	58.5	0	0	0	0	110.9	A431 S432 T439 W525 L531 A534	A431-T435 WeakPolarHBondContact O-CG2 3.36Å; A431-T435 PolarHBondContact O-N 2.91Å; A431-T435 PolarHBondContact O-OG1 3.48Å; S432-T435 PolarHBondContact O-N 2.9Å; S432-T435 PolarHBondContact O-OG1 2.95Å; T435-T439 WeakPolarHBondContact O-CB 3.4Å; T435-T439 WeakPolarHBondContact O-CG2 3.48Å; T435-T439 PolarHBondContact O-N 3.44Å; T435-T439 VanDerWaalsContact O-N 3.08Å; T435-T439 PolarHBondContact O-OG1 2.93Å; T435-W525 HydrophobicContact CG2-CZ3 4.36Å; T435-L531 HydrophobicContact CG2-CD1 4.49Å; T435-A534 HydrophobicContact CG2-CB 3.86Å
436	E	90.9	Very high	90.1	Very high	72 Å²	72	44 Å²	44	34%	0.336	22%	0.221	S	C	.	.	H	α-helix	trans	-60.9	-53.9	171.2	174	161	160.2	0	0	111.8	S432 A438 T439 K440	S432-E436 WeakPolarHBondContact O-CB 3.42Å; S432-E436 PolarHBondContact O-N 3.36Å; E436-A438 VanDerWaalsContact C-N 3.26Å; E436-A438 PolarHBondContact O-N 3.07Å; E436-T439 PolarHBondContact O-N 3.04Å; E436-T439 VanDerWaalsContact O-N 3.1Å; E436-T439 PolarHBondContact O-OG1 3.24Å; E436-K440 VanDerWaalsContact CD-CE 3.41Å; E436-K440 HydrophobicContact CG-CD 3.62Å; E436-K440 HydrophobicContact CG-CG 4.05Å; E436-K440 WeakPolarHBondContact O-CB 3.41Å; E436-K440 PolarHBondContact O-N 3.37Å; E436-K440 WeakPolarHBondContact OE1-CD 3.5Å; E436-K440 WeakPolarHBondContact OE1-CE 3.37Å; E436-K440 IonicContact OE1-NZ 2.63Å; E436-K440 PolarHBondContact OE1-NZ 3.4Å; E436-K440 IonicContact OE2-NZ 2.7Å; E436-K440 PolarHBondContact OE2-NZ 2.88Å
437	A	91.2	Very high	89.8	Confident	3 Å²	3	45 Å²	45	3%	0.025	23%	0.226	C	C	.	.	H	α-helix	trans	-61	-37	-178.5	0	0	0	0	0	112.4	C433 R441 T442 T448	C433-A437 WeakPolarHBondContact O-CB 3.32Å; C433-A437 PolarHBondContact O-N 2.81Å; A437-R441 PolarHBondContact O-N 3.12Å; A437-T442 PolarHBondContact O-N 3.16Å; A437-T442 VanDerWaalsContact O-N 3.16Å; A437-T448 HydrophobicContact CB-CG2 3.64Å; A437-T448 WeakPolarHBondContact CB-OG1 3.46Å
438	A	92	Very high	89.6	Confident	12 Å²	12	45.3 Å²	45.3	10%	0.099	23%	0.228	C	C	.	.	H	α-helix	trans	-64.9	-36.8	175.2	0	0	0	0	0	113.2	T434 E436 A534 L538	T434-A438 WeakPolarHBondContact O-CB 3.44Å; T434-A438 PolarHBondContact O-N 2.74Å; T434-A438 VanDerWaalsContact O-N 3.13Å; E436-A438 VanDerWaalsContact C-N 3.26Å; E436-A438 PolarHBondContact O-N 3.07Å; A438-A534 HydrophobicContact CB-CB 3.96Å; A438-L538 HydrophobicContact CB-CD2 4.1Å; A438-L538 HydrophobicContact CB-CG 4.18Å
439	T	88.1	Confident	89.6	Confident	107 Å²	107	46.1 Å²	46.1	66%	0.656	23%	0.231	S	C	*	.	H	α-helix	trans	-87.1	-45.2	-178.1	50.9	0	0	0	0	113.2	T435 E436 R441	T435-T439 WeakPolarHBondContact O-CB 3.4Å; T435-T439 WeakPolarHBondContact O-CG2 3.48Å; T435-T439 PolarHBondContact O-N 3.44Å; T435-T439 VanDerWaalsContact O-N 3.08Å; T435-T439 PolarHBondContact O-OG1 2.93Å; E436-T439 PolarHBondContact O-N 3.04Å; E436-T439 VanDerWaalsContact O-N 3.1Å; E436-T439 PolarHBondContact O-OG1 3.24Å; T439-R441 PolarHBondContact O-N 2.72Å
440	K	80	Confident	89.6	Confident	133 Å²	133	46.6 Å²	46.6	58%	0.578	23%	0.234	S	C	*	.	H	α-helix	trans	-77.1	-3.4	-179.6	-62	-171.2	-167.8	167.3	0	114	E436	E436-K440 VanDerWaalsContact CD-CE 3.41Å; E436-K440 HydrophobicContact CG-CD 3.62Å; E436-K440 HydrophobicContact CG-CG 4.05Å; E436-K440 WeakPolarHBondContact O-CB 3.41Å; E436-K440 PolarHBondContact O-N 3.37Å; E436-K440 WeakPolarHBondContact OE1-CD 3.5Å; E436-K440 WeakPolarHBondContact OE1-CE 3.37Å; E436-K440 IonicContact OE1-NZ 2.63Å; E436-K440 PolarHBondContact OE1-NZ 3.4Å; E436-K440 IonicContact OE2-NZ 2.7Å; E436-K440 PolarHBondContact OE2-NZ 2.88Å
441	R	62.2	Low	89.6	Confident	211 Å²	211	46.6 Å²	46.6	80%	0.796	23%	0.234	S	C	*	.	T	Hydrogen-bonded Turn	trans	63.6	43.9	179.1	-56.2	-177.6	177	179.7	-0.7	114.4	A437 T439 P443	A437-R441 PolarHBondContact O-N 3.12Å; T439-R441 PolarHBondContact O-N 2.72Å; R441-P443 VanDerWaalsContact O-CD 3.25Å; R441-P443 WeakPolarHBondContact O-CD 3.26Å
442	T	81.1	Confident	89.7	Confident	51 Å²	51	46.6 Å²	46.6	31%	0.313	23%	0.234	S	C	.	.			trans	-111.1	45.9	167.4	48.1	0	0	0	0	112.4	A437 D444 E445 T448	A437-T442 PolarHBondContact O-N 3.16Å; A437-T442 VanDerWaalsContact O-N 3.16Å; T442-D444 VanDerWaalsContact C-N 3.27Å; T442-D444 PolarHBondContact O-N 2.8Å; T442-E445 WeakPolarHBondContact CB-OE1 3.18Å; T442-E445 WeakPolarHBondContact CG2-OE1 3.24Å; T442-T448 PolarHBondContact O-OG1 3.12Å
443	P	82.3	Confident	89.9	Confident	10 Å²	10	45.8 Å²	45.8	7%	0.065	23%	0.228	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-18.8	-167.6	34.1	-40.9	0	0	0	114.7	R441 L538 C541	R441-P443 VanDerWaalsContact O-CD 3.25Å; R441-P443 WeakPolarHBondContact O-CD 3.26Å; P443-L538 HydrophobicContact CB-CD2 3.52Å; P443-C541 HydrophobicContact CG-CB 4.43Å
444	D	88.1	Confident	90.1	Very high	55 Å²	55	44.9 Å²	44.9	29%	0.294	22%	0.222	S	C	.	.	T	Hydrogen-bonded Turn	trans	-102.5	8.8	-170	-68.9	-23.8	0	0	0	113.2	T442 S542 T543 N544	T442-D444 VanDerWaalsContact C-N 3.27Å; T442-D444 PolarHBondContact O-N 2.8Å; D444-S542 VanDerWaalsContact OD1-CA 3.28Å; D444-S542 WeakPolarHBondContact OD1-CA 3.2Å; D444-S542 WeakPolarHBondContact OD1-CB 3.4Å; D444-S542 PolarHBondContact OD1-OG 3.45Å; D444-T543 VanDerWaalsContact CG-N 3.26Å; D444-T543 PolarHBondContact OD1-N 3.35Å; D444-T543 WeakPolarHBondContact OD2-CB 3.35Å; D444-T543 PolarHBondContact OD2-N 3.17Å; D444-T543 PolarHBondContact OD2-OG1 3.01Å; D444-N544 HydrophobicContact CB-CB 4.24Å; D444-N544 WeakPolarHBondContact OD1-CB 3.41Å; D444-N544 PolarHBondContact OD1-N 2.92Å
445	E	89.5	Confident	90.3	Very high	93 Å²	93	44.9 Å²	44.9	44%	0.435	22%	0.222	S	C	.	.	S	Bend	trans	-71.8	145.3	172.8	-66.8	-171.8	-165.6	0	0	111.8	T442 L447 T448 E449	T442-E445 WeakPolarHBondContact CB-OE1 3.18Å; T442-E445 WeakPolarHBondContact CG2-OE1 3.24Å; E445-L447 PolarHBondContact O-N 3.49Å; E445-T448 WeakPolarHBondContact O-CB 3.48Å; E445-T448 PolarHBondContact O-N 3Å; E445-E449 PolarHBondContact O-N 2.84Å
446	N	89.6	Confident	90.5	Very high	89 Å²	89	43.5 Å²	43.5	48%	0.476	21%	0.214	S	C	.	.	H	α-helix	trans	-58.9	-22.6	176.3	-62	-4.8	0	0	0	112.7	L401 N450	L401-N446 HydrophobicContact CD1-CB 3.72Å; N446-N450 PolarHBondContact O-N 3.5Å; N446-N450 VanDerWaalsContact O-N 3.09Å
447	L	91.8	Very high	90.8	Very high	22 Å²	22	40.4 Å²	40.4	12%	0.115	20%	0.199	C	C	.	.	H	α-helix	trans	-66.4	-50.8	172.7	-63.4	-172.9	0	0	0	111.3	F380 P397 F400 L401 E445 E449 N450 C451	F380-L447 HydrophobicContact CE1-CD1 3.97Å; F380-L447 HydrophobicContact CE2-CD1 4.49Å; F380-L447 HydrophobicContact CZ-CD1 3.55Å; P397-L447 HydrophobicContact CB-CD1 4.38Å; F400-L447 HydrophobicContact CD1-CD1 4.2Å; F400-L447 HydrophobicContact CD1-CD2 3.76Å; F400-L447 HydrophobicContact CD1-CG 4.42Å; F400-L447 HydrophobicContact CE1-CD2 4.42Å; L401-L447 HydrophobicContact CB-CD2 3.57Å; L401-L447 HydrophobicContact CD1-CD2 3.86Å; L401-L447 HydrophobicContact CG-CD2 4.3Å; E445-L447 PolarHBondContact O-N 3.49Å; L447-E449 VanDerWaalsContact C-N 3.32Å; L447-E449 PolarHBondContact O-N 3.44Å; L447-N450 PolarHBondContact O-N 3.48Å; L447-C451 PolarHBondContact O-N 3.15Å; L447-C451 PolarHBondContact O-SG 2.98Å
448	T	94.1	Very high	91.2	Very high	6 Å²	6	40.2 Å²	40.2	4%	0.037	20%	0.198	C	C	.	.	H	α-helix	trans	-60.9	-42.3	176.5	-44.6	0	0	0	0	110.8	A437 T442 E445 N450 C451 V452 L538 T547	A437-T448 HydrophobicContact CB-CG2 3.64Å; A437-T448 WeakPolarHBondContact CB-OG1 3.46Å; T442-T448 PolarHBondContact O-OG1 3.12Å; E445-T448 WeakPolarHBondContact O-CB 3.48Å; E445-T448 PolarHBondContact O-N 3Å; T448-N450 PolarHBondContact O-N 3.29Å; T448-C451 PolarHBondContact O-N 2.95Å; T448-V452 HydrophobicContact CG2-CG2 4.34Å; T448-V452 WeakPolarHBondContact O-CB 3.38Å; T448-V452 VanDerWaalsContact O-CG2 3.25Å; T448-V452 WeakPolarHBondContact O-CG2 3.16Å; T448-V452 PolarHBondContact O-N 3.08Å; T448-L538 HydrophobicContact CG2-CD1 4.27Å; T448-L538 HydrophobicContact CG2-CD2 4.12Å; T448-T547 HydrophobicContact CG2-CG2 4.22Å
449	E	95.1	Very high	91.4	Very high	28 Å²	28	39.9 Å²	39.9	13%	0.131	19%	0.194	C	C	.	.	H	α-helix	trans	-56.2	-52.5	173.9	-172.8	-170.9	134.2	0	0	111.4	R408 E445 L447 C451 V452 C453 N544 M546	R408-E449 IonicContact CZ-OE1 2.77Å; R408-E449 VanDerWaalsContact CZ-OE1 3.28Å; R408-E449 IonicContact NH1-OE1 3.35Å; R408-E449 PolarHBondContact NH1-OE1 3.08Å; R408-E449 IonicContact NH2-OE1 3.55Å; R408-E449 PolarHBondContact NH2-OE1 3.49Å; E445-E449 PolarHBondContact O-N 2.84Å; L447-E449 VanDerWaalsContact C-N 3.32Å; L447-E449 PolarHBondContact O-N 3.44Å; E449-C451 PolarHBondContact O-N 3.46Å; E449-V452 PolarHBondContact O-N 3.29Å; E449-C453 WeakPolarHBondContact O-CB 3.49Å; E449-C453 PolarHBondContact O-N 3.42Å; E449-C453 PolarHBondContact O-SG 3.28Å; E449-N544 PolarHBondContact OE2-ND2 2.91Å; E449-M546 HydrophobicContact CG-CB 3.54Å; E449-M546 WeakPolarHBondContact OE1-CB 3.16Å
450	N	96.1	Very high	91.7	Very high	11 Å²	11	37 Å²	37	6%	0.059	17%	0.172	C	C	.	.	H	α-helix	trans	-62.7	-45	-179.4	-80.4	-12.6	0	0	0	112.5	L401 T404 A405 R408 N446 L447 T448 V452 C453 I454	L401-N450 PolarHBondContact O-ND2 3.16Å; T404-N450 WeakPolarHBondContact OG1-CB 3.27Å; T404-N450 PolarHBondContact OG1-ND2 2.96Å; T404-N450 VanDerWaalsContact OG1-ND2 3.16Å; A405-N450 PolarHBondContact N-ND2 3.47Å; R408-N450 VanDerWaalsContact CD-OD1 3.32Å; R408-N450 WeakPolarHBondContact CD-OD1 3.26Å; R408-N450 PolarHBondContact NH1-OD1 2.86Å; N446-N450 PolarHBondContact O-N 3.5Å; N446-N450 VanDerWaalsContact O-N 3.09Å; L447-N450 PolarHBondContact O-N 3.48Å; T448-N450 PolarHBondContact O-N 3.29Å; N450-V452 PolarHBondContact O-N 3.33Å; N450-C453 PolarHBondContact O-N 3.33Å; N450-I454 WeakPolarHBondContact O-CD1 3.46Å; N450-I454 VanDerWaalsContact O-CG1 3.26Å; N450-I454 WeakPolarHBondContact O-CG1 3.35Å; N450-I454 PolarHBondContact O-N 3.18Å
451	C	97.8	Very high	92.3	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-60.3	-47.4	-179.9	-64	0	0	0	0	111.1	L430 L447 T448 E449 C453 I454 L455	L430-C451 HydrophobicContact CD2-CB 4.21Å; L447-C451 PolarHBondContact O-N 3.15Å; L447-C451 PolarHBondContact O-SG 2.98Å; T448-C451 PolarHBondContact O-N 2.95Å; E449-C451 PolarHBondContact O-N 3.46Å; C451-C453 PolarHBondContact O-N 3.16Å; C451-I454 PolarHBondContact O-N 3.2Å; C451-L455 WeakPolarHBondContact O-CB 3.27Å; C451-L455 VanDerWaalsContact O-CG 3.26Å; C451-L455 WeakPolarHBondContact O-CG 3.38Å; C451-L455 PolarHBondContact O-N 2.88Å
452	V	97.8	Very high	93.6	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-67.9	-35	178.7	179.8	0	0	0	0	111.7	T434 T448 E449 N450 L455 Q456 Y535 L538 T547 A550	T434-V452 HydrophobicContact CG2-CG2 3.77Å; T448-V452 HydrophobicContact CG2-CG2 4.34Å; T448-V452 WeakPolarHBondContact O-CB 3.38Å; T448-V452 VanDerWaalsContact O-CG2 3.25Å; T448-V452 WeakPolarHBondContact O-CG2 3.16Å; T448-V452 PolarHBondContact O-N 3.08Å; E449-V452 PolarHBondContact O-N 3.29Å; N450-V452 PolarHBondContact O-N 3.33Å; V452-L455 PolarHBondContact O-N 3.22Å; V452-Q456 WeakPolarHBondContact O-CB 3.36Å; V452-Q456 PolarHBondContact O-N 3.42Å; V452-Y535 HydrophobicContact CG1-CE1 4.24Å; V452-L538 HydrophobicContact CG2-CD1 3.68Å; V452-T547 HydrophobicContact CG2-CG2 4.47Å; V452-A550 HydrophobicContact CB-CB 4.48Å; V452-A550 HydrophobicContact CG1-CB 3.77Å
453	C	97.8	Very high	93.8	Very high	8 Å²	8	23.8 Å²	23.8	5%	0.054	12%	0.118	C	C	.	.	H	α-helix	trans	-64.7	-41.7	172.2	-74.8	0	0	0	0	112.9	R408 E449 N450 C451 Q456 N457	R408-C453 HydrophobicContact CG-CB 4.09Å; R408-C453 VanDerWaalsContact CZ-SG 3.57Å; E449-C453 WeakPolarHBondContact O-CB 3.49Å; E449-C453 PolarHBondContact O-N 3.42Å; E449-C453 PolarHBondContact O-SG 3.28Å; N450-C453 PolarHBondContact O-N 3.33Å; C451-C453 PolarHBondContact O-N 3.16Å; C453-Q456 PolarHBondContact O-N 2.86Å; C453-N457 PolarHBondContact O-N 2.77Å; C453-N457 VanDerWaalsContact O-N 3.12Å
454	I	98.6	Very high	93.9	Very high	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.126	C	C	.	.	H	α-helix	trans	-63.8	-46.8	174.3	-60.3	155.1	0	0	0	109.4	T404 L407 R408 M420 L430 N450 C451 Q456 N457 L458	T404-I454 HydrophobicContact CG2-CD1 4.27Å; T404-I454 WeakPolarHBondContact O-CD1 3.37Å; L407-I454 HydrophobicContact CB-CD1 3.8Å; L407-I454 HydrophobicContact CB-CG1 4.18Å; R408-I454 HydrophobicContact CB-CG1 4.1Å; M420-I454 HydrophobicContact SD-CG2 4.36Å; L430-I454 HydrophobicContact CD1-CB 4.03Å; L430-I454 HydrophobicContact CD1-CD1 4.11Å; L430-I454 HydrophobicContact CD1-CG2 3.53Å; L430-I454 HydrophobicContact CD2-CD1 3.8Å; N450-I454 WeakPolarHBondContact O-CD1 3.46Å; N450-I454 VanDerWaalsContact O-CG1 3.26Å; N450-I454 WeakPolarHBondContact O-CG1 3.35Å; N450-I454 PolarHBondContact O-N 3.18Å; C451-I454 PolarHBondContact O-N 3.2Å; I454-Q456 VanDerWaalsContact C-N 3.35Å; I454-Q456 PolarHBondContact O-N 2.9Å; I454-N457 CarbonylContact O-C 3.59Å; I454-N457 WeakPolarHBondContact O-CB 3.27Å; I454-N457 PolarHBondContact O-N 2.88Å; I454-N457 VanDerWaalsContact O-N 3.08Å; I454-L458 HydrophobicContact CG2-CD1 3.82Å; I454-L458 HydrophobicContact CG2-CG 3.98Å; I454-L458 WeakPolarHBondContact O-CG 3.27Å; I454-L458 PolarHBondContact O-N 2.75Å
455	L	98.6	Very high	93.7	Very high	0 Å²	0	24.5 Å²	24.5	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-67.2	-31.4	-179.2	-65.1	165.5	0	0	0	113	I427 L430 T434 C451 V452 L458 T459 L526 L531 Y535	I427-L455 HydrophobicContact CG2-CD2 4.03Å; L430-L455 HydrophobicContact CB-CD1 4.21Å; L430-L455 HydrophobicContact CB-CD2 4.06Å; L430-L455 HydrophobicContact CB-CG 4.15Å; T434-L455 HydrophobicContact CG2-CD1 4.48Å; T434-L455 WeakPolarHBondContact OG1-CD1 3.39Å; C451-L455 WeakPolarHBondContact O-CB 3.27Å; C451-L455 VanDerWaalsContact O-CG 3.26Å; C451-L455 WeakPolarHBondContact O-CG 3.38Å; C451-L455 PolarHBondContact O-N 2.88Å; V452-L455 PolarHBondContact O-N 3.22Å; L455-L458 PolarHBondContact O-N 3.33Å; L455-T459 WeakPolarHBondContact O-CB 3.4Å; L455-T459 WeakPolarHBondContact O-CG2 3.27Å; L455-T459 PolarHBondContact O-N 3.41Å; L455-T459 PolarHBondContact O-OG1 3.16Å; L455-L526 HydrophobicContact CD2-CD2 3.85Å; L455-L531 HydrophobicContact CD1-CD1 4.27Å; L455-L531 HydrophobicContact CD1-CD2 4.33Å; L455-L531 HydrophobicContact CD2-CD2 4.46Å; L455-Y535 VanDerWaalsContact CB-OH 3.27Å; L455-Y535 WeakPolarHBondContact CB-OH 3.32Å
456	Q	97.9	Very high	93.3	Very high	3 Å²	3	22.2 Å²	22.2	1%	0.014	11%	0.107	C	C	.	.	H	α-helix	trans	-58.2	-50.2	166.7	177	-168.7	-4.8	0	0	110.6	V104 V106 V452 C453 I454 T459 Y460 A550 A554 N557	V104-Q456 PolarHBondContact O-NE2 2.92Å; V106-Q456 VanDerWaalsContact CG2-NE2 3.3Å; V452-Q456 WeakPolarHBondContact O-CB 3.36Å; V452-Q456 PolarHBondContact O-N 3.42Å; C453-Q456 PolarHBondContact O-N 2.86Å; I454-Q456 VanDerWaalsContact C-N 3.35Å; I454-Q456 PolarHBondContact O-N 2.9Å; Q456-T459 WeakPolarHBondContact CA-OG1 3.38Å; Q456-T459 PolarHBondContact O-N 3.45Å; Q456-T459 PolarHBondContact O-OG1 2.78Å; Q456-Y460 PolarHBondContact O-N 3.42Å; Q456-A550 HydrophobicContact CB-CB 4.34Å; Q456-A550 VanDerWaalsContact OE1-CA 3.22Å; Q456-A554 HydrophobicContact CB-CB 4.32Å; Q456-N557 PolarHBondContact O-ND2 3.44Å
457	N	98	Very high	92.8	Very high	6 Å²	6	21.8 Å²	21.8	3%	0.032	10%	0.104	C	C	.	.	H	α-helix	trans	-62.1	-48.8	178	-72.9	-10.8	0	0	0	110.2	S411 R417 C453 I454 T459 Y460	S411-N457 WeakPolarHBondContact O-CB 3.48Å; S411-N457 PolarHBondContact O-ND2 3.44Å; S411-N457 PolarHBondContact OG-ND2 3.14Å; R417-N457 WeakPolarHBondContact CD-O 3.48Å; C453-N457 PolarHBondContact O-N 2.77Å; C453-N457 VanDerWaalsContact O-N 3.12Å; I454-N457 CarbonylContact O-C 3.59Å; I454-N457 WeakPolarHBondContact O-CB 3.27Å; I454-N457 PolarHBondContact O-N 2.88Å; I454-N457 VanDerWaalsContact O-N 3.08Å; N457-T459 VanDerWaalsContact C-N 3.29Å; N457-T459 PolarHBondContact O-N 3.01Å; N457-Y460 WeakPolarHBondContact O-CB 2.78Å; N457-Y460 PolarHBondContact O-N 3.04Å
458	L	98.1	Very high	92.2	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-65.1	-26.9	-178.5	-62.6	-174.8	0	0	0	113.7	R417 M420 R421 L426 I427 I454 L455 Y460 A462 L526	R417-L458 HydrophobicContact CB-CD2 4.27Å; R417-L458 HydrophobicContact CG-CD2 4.47Å; M420-L458 HydrophobicContact CB-CD1 4.09Å; M420-L458 HydrophobicContact CB-CD2 3.66Å; M420-L458 HydrophobicContact CG-CD2 4.47Å; M420-L458 HydrophobicContact SD-CD2 4.12Å; R421-L458 VanDerWaalsContact CZ-O 3.27Å; R421-L458 PolarHBondContact NE-O 3.08Å; R421-L458 PolarHBondContact NH2-O 2.79Å; L426-L458 HydrophobicContact CD2-CD1 4.19Å; I427-L458 HydrophobicContact CD1-CD1 4.09Å; I427-L458 HydrophobicContact CG1-CD1 3.87Å; I454-L458 HydrophobicContact CG2-CD1 3.82Å; I454-L458 HydrophobicContact CG2-CG 3.98Å; I454-L458 WeakPolarHBondContact O-CG 3.27Å; I454-L458 PolarHBondContact O-N 2.75Å; L455-L458 PolarHBondContact O-N 3.33Å; L458-Y460 VanDerWaalsContact C-N 3.34Å; L458-A462 WeakPolarHBondContact O-CB 3.32Å; L458-L526 HydrophobicContact CB-CD1 4.25Å; L458-L526 HydrophobicContact CB-CD2 3.88Å; L458-L526 WeakPolarHBondContact O-CD1 3.32Å
459	T	96.9	Very high	91.2	Very high	4 Å²	4	30.5 Å²	30.5	3%	0.025	14%	0.138	C	C	.	.	H	α-helix	trans	-72.7	-20.1	172	46	0	0	0	0	113.9	L455 Q456 N457 E461 A462 L526 L558	L455-T459 WeakPolarHBondContact O-CB 3.4Å; L455-T459 WeakPolarHBondContact O-CG2 3.27Å; L455-T459 PolarHBondContact O-N 3.41Å; L455-T459 PolarHBondContact O-OG1 3.16Å; Q456-T459 WeakPolarHBondContact CA-OG1 3.38Å; Q456-T459 PolarHBondContact O-N 3.45Å; Q456-T459 PolarHBondContact O-OG1 2.78Å; N457-T459 VanDerWaalsContact C-N 3.29Å; N457-T459 PolarHBondContact O-N 3.01Å; T459-E461 PolarHBondContact O-N 2.98Å; T459-A462 PolarHBondContact O-N 3.11Å; T459-L526 HydrophobicContact CG2-CB 4.02Å; T459-L526 HydrophobicContact CG2-CD2 4.23Å; T459-L558 HydrophobicContact CG2-CD1 4.21Å; T459-L558 HydrophobicContact CG2-CD2 3.93Å; T459-L558 HydrophobicContact CG2-CG 3.93Å
460	Y	95.7	Very high	90.1	Very high	46 Å²	46	31.3 Å²	31.3	18%	0.18	14%	0.144	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.7	114.6	178.1	-177.2	-82.5	0	0	0	111.1	C103 L105 R421 Q456 N457 L458 A462	C103-Y460 HydrophobicContact CB-CD2 4.11Å; C103-Y460 HydrophobicContact CB-CE2 3.56Å; L105-Y460 HydrophobicContact CB-CE2 4.33Å; L105-Y460 HydrophobicContact CD1-CD1 4.13Å; L105-Y460 HydrophobicContact CD1-CD2 4.09Å; L105-Y460 HydrophobicContact CD1-CE1 4.35Å; L105-Y460 HydrophobicContact CD1-CE2 4.31Å; L105-Y460 HydrophobicContact CD1-CG 4.02Å; R421-Y460 PolarHBondContact NH2-O 3.27Å; Q456-Y460 PolarHBondContact O-N 3.42Å; N457-Y460 WeakPolarHBondContact O-CB 2.78Å; N457-Y460 PolarHBondContact O-N 3.04Å; L458-Y460 VanDerWaalsContact C-N 3.34Å; Y460-A462 PolarHBondContact O-N 2.71Å
461	E	91.4	Very high	88.8	Confident	86 Å²	86	33.6 Å²	33.6	40%	0.402	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	60.7	16.9	-177	-63.8	167.4	177.1	0	0	115.1	R417 T459 E463 E464 D465	R417-E461 IonicContact NH2-OE2 3.09Å; T459-E461 PolarHBondContact O-N 2.98Å; E461-E463 VanDerWaalsContact C-N 3.34Å; E461-E463 PolarHBondContact O-N 2.94Å; E461-E464 WeakPolarHBondContact O-CB 3.33Å; E461-E464 PolarHBondContact O-N 3.23Å; E461-D465 PolarHBondContact O-N 3.48Å
462	A	90.4	Very high	87.5	Confident	2 Å²	2	39.6 Å²	39.6	2%	0.017	19%	0.185	C	C	.	.	H	α-helix	trans	-58.6	-40.5	-176.8	0	0	0	0	0	114.1	L458 T459 Y460 E464 W466 L526 W527	L458-A462 WeakPolarHBondContact O-CB 3.32Å; T459-A462 PolarHBondContact O-N 3.11Å; Y460-A462 PolarHBondContact O-N 2.71Å; A462-E464 VanDerWaalsContact C-N 3.3Å; A462-E464 PolarHBondContact O-N 3.44Å; A462-W466 WeakPolarHBondContact O-CB 3.33Å; A462-W466 PolarHBondContact O-N 2.97Å; A462-L526 HydrophobicContact CB-CD1 3.87Å; A462-W527 HydrophobicContact CB-CZ3 4.12Å
463	E	85.1	Confident	85.7	Confident	31 Å²	31	44.2 Å²	44.2	15%	0.145	21%	0.21	C	C	.	.	H	α-helix	trans	-60.9	-38.2	175.3	-179.7	-175.3	-107.2	0	0	111.5	E461 I467 R561 I565	E461-E463 VanDerWaalsContact C-N 3.34Å; E461-E463 PolarHBondContact O-N 2.94Å; E463-I467 HydrophobicContact CG-CD1 3.89Å; E463-I467 WeakPolarHBondContact O-CB 3.41Å; E463-I467 VanDerWaalsContact O-CG1 3.24Å; E463-I467 WeakPolarHBondContact O-CG1 3.35Å; E463-I467 PolarHBondContact O-N 3.17Å; E463-R561 VanDerWaalsContact OE2-CD 3.27Å; E463-R561 WeakPolarHBondContact OE2-CD 3.41Å; E463-R561 IonicContact OE2-CZ 3.9Å; E463-R561 IonicContact OE2-NE 2.67Å; E463-R561 IonicContact OE2-NH2 3.4Å; E463-R561 PolarHBondContact OE2-NH2 3.3Å; E463-I565 HydrophobicContact CB-CD1 4.18Å; E463-I565 HydrophobicContact CG-CD1 3.92Å
464	E	83.4	Confident	83.8	Confident	48 Å²	48	45.9 Å²	45.9	22%	0.224	22%	0.22	C	C	.	.	H	α-helix	trans	-68.6	-50.1	179.5	-64.6	-151.9	-161.5	0	0	112	E461 A462 W466 I467 R468 R561	E461-E464 WeakPolarHBondContact O-CB 3.33Å; E461-E464 PolarHBondContact O-N 3.23Å; A462-E464 VanDerWaalsContact C-N 3.3Å; A462-E464 PolarHBondContact O-N 3.44Å; E464-W466 VanDerWaalsContact C-N 3.28Å; E464-W466 PolarHBondContact O-N 3.23Å; E464-I467 PolarHBondContact O-N 3.26Å; E464-R468 VanDerWaalsContact O-CB 3.31Å; E464-R468 WeakPolarHBondContact O-CB 3.44Å; E464-R468 VanDerWaalsContact O-CD 3.29Å; E464-R468 WeakPolarHBondContact O-CD 3.48Å; E464-R468 WeakPolarHBondContact O-CG 3.43Å; E464-R468 PolarHBondContact O-N 3.2Å; E464-R468 IonicContact OE2-CZ 2.68Å; E464-R468 IonicContact OE2-NE 2.72Å; E464-R468 IonicContact OE2-NH2 2.83Å; E464-R468 PolarHBondContact OE2-NH2 2.78Å; E464-R561 VanDerWaalsContact CG-CZ 3.43Å; E464-R561 VanDerWaalsContact CG-NH1 3.27Å; E464-R561 IonicContact OE1-CZ 3.59Å; E464-R561 IonicContact OE1-NE 3.88Å; E464-R561 PolarHBondContact OE1-NE 3.29Å; E464-R561 VanDerWaalsContact OE1-NE 3.07Å; E464-R561 IonicContact OE1-NH1 3.63Å; E464-R561 PolarHBondContact OE1-NH1 2.86Å; E464-R561 IonicContact OE2-NH1 2.71Å
465	D	84.9	Confident	81.8	Confident	31 Å²	31	50.3 Å²	50.3	17%	0.166	24%	0.24	C	C	.	.	H	α-helix	trans	-63.5	-37	179.7	-81.9	-36.6	0	0	0	111.4	R418 R421 E461 R468 Q469	R418-D465 VanDerWaalsContact CG-OD2 3.28Å; R418-D465 WeakPolarHBondContact CG-OD2 3.26Å; R421-D465 IonicContact CZ-OD2 3.5Å; R421-D465 IonicContact NH1-OD2 3.12Å; R421-D465 PolarHBondContact NH1-OD2 3.23Å; E461-D465 PolarHBondContact O-N 3.48Å; D465-R468 PolarHBondContact O-N 3.12Å; D465-Q469 WeakPolarHBondContact O-CB 3.31Å; D465-Q469 VanDerWaalsContact O-CG 3.25Å; D465-Q469 WeakPolarHBondContact O-CG 3.48Å; D465-Q469 PolarHBondContact O-N 3.08Å
466	W	81.3	Confident	79.8	Confident	46 Å²	46	55.5 Å²	55.5	17%	0.174	27%	0.265	C	S	.	.	H	α-helix	trans	-63.9	-51.3	174.7	-177.3	75	0	0	0	112.2	A462 E464 R468 Q469 T470 M510 W527	A462-W466 WeakPolarHBondContact O-CB 3.33Å; A462-W466 PolarHBondContact O-N 2.97Å; E464-W466 VanDerWaalsContact C-N 3.28Å; E464-W466 PolarHBondContact O-N 3.23Å; W466-R468 VanDerWaalsContact C-N 3.29Å; W466-R468 PolarHBondContact O-N 3.28Å; W466-Q469 PolarHBondContact O-N 3.02Å; W466-Q469 VanDerWaalsContact O-N 3.15Å; W466-T470 PolarHBondContact O-N 2.89Å; W466-T470 PolarHBondContact O-OG1 2.9Å; W466-M510 HydrophobicContact CD2-CE 4.1Å; W466-M510 HydrophobicContact CE3-CE 3.62Å; W466-M510 HydrophobicContact CH2-CE 3.57Å; W466-M510 HydrophobicContact CZ2-CE 4.03Å; W466-M510 HydrophobicContact CZ3-CE 3.34Å; W466-W527 HydrophobicContact CB-CH2 4.02Å; W466-W527 HydrophobicContact CD2-CH2 4.36Å; W466-W527 HydrophobicContact CD2-CZ2 4.45Å; W466-W527 AromaticContact CG-CH2 3.87Å; W466-W527 HydrophobicContact CG-CH2 3.87Å; W466-W527 HydrophobicContact CG-CZ2 4.36Å
467	I	78.8	Confident	77.6	Confident	80 Å²	80	60 Å²	60	41%	0.41	29%	0.293	S	S	.	.	H	α-helix	trans	-59	-41.7	177.3	-67.6	168.4	0	0	0	110.9	E463 E464 T471	E463-I467 HydrophobicContact CG-CD1 3.89Å; E463-I467 WeakPolarHBondContact O-CB 3.41Å; E463-I467 VanDerWaalsContact O-CG1 3.24Å; E463-I467 WeakPolarHBondContact O-CG1 3.35Å; E463-I467 PolarHBondContact O-N 3.17Å; E464-I467 PolarHBondContact O-N 3.26Å; I467-T471 WeakPolarHBondContact O-CB 3.28Å; I467-T471 PolarHBondContact O-N 3.23Å; I467-T471 PolarHBondContact O-OG1 3.16Å
468	R	79.3	Confident	75.5	Confident	140 Å²	140	64 Å²	64	53%	0.528	31%	0.311	S	S	.	.	H	α-helix	trans	-64.5	-37.4	177.9	-70.4	164	-167.1	-99.4	9.4	112.2	E464 D465 W466 K472	E464-R468 VanDerWaalsContact O-CB 3.31Å; E464-R468 WeakPolarHBondContact O-CB 3.44Å; E464-R468 VanDerWaalsContact O-CD 3.29Å; E464-R468 WeakPolarHBondContact O-CD 3.48Å; E464-R468 WeakPolarHBondContact O-CG 3.43Å; E464-R468 PolarHBondContact O-N 3.2Å; E464-R468 IonicContact OE2-CZ 2.68Å; E464-R468 IonicContact OE2-NE 2.72Å; E464-R468 IonicContact OE2-NH2 2.83Å; E464-R468 PolarHBondContact OE2-NH2 2.78Å; D465-R468 PolarHBondContact O-N 3.12Å; W466-R468 VanDerWaalsContact C-N 3.29Å; W466-R468 PolarHBondContact O-N 3.28Å; R468-K472 WeakPolarHBondContact O-CG 3.33Å; R468-K472 PolarHBondContact O-N 3.27Å
469	Q	73.4	Confident	73.2	Confident	70 Å²	70	70.9 Å²	70.9	33%	0.327	34%	0.341	S	S	.	.	H	α-helix	trans	-70.3	-51.4	175.7	-76.1	176.2	2	0	0	111.5	D465 W466 T471 K472 N473	D465-Q469 WeakPolarHBondContact O-CB 3.31Å; D465-Q469 VanDerWaalsContact O-CG 3.25Å; D465-Q469 WeakPolarHBondContact O-CG 3.48Å; D465-Q469 PolarHBondContact O-N 3.08Å; W466-Q469 PolarHBondContact O-N 3.02Å; W466-Q469 VanDerWaalsContact O-N 3.15Å; Q469-T471 VanDerWaalsContact C-N 3.33Å; Q469-T471 PolarHBondContact O-N 3.34Å; Q469-K472 PolarHBondContact O-N 3.11Å; Q469-N473 VanDerWaalsContact O-CG 3.24Å; Q469-N473 PolarHBondContact O-N 2.87Å; Q469-N473 PolarHBondContact O-OD1 2.9Å
470	T	70.2	Confident	70.7	Confident	45 Å²	45	76.9 Å²	76.9	28%	0.276	37%	0.373	S	S	.	.	H	α-helix	trans	-55.9	-47.1	179.4	-57.9	0	0	0	0	111.5	W466 K472 N473 T474	W466-T470 PolarHBondContact O-N 2.89Å; W466-T470 PolarHBondContact O-OG1 2.9Å; T470-K472 PolarHBondContact O-N 2.81Å; T470-N473 PolarHBondContact O-N 3.19Å; T470-T474 PolarHBondContact O-N 3.2Å; T470-T474 VanDerWaalsContact O-N 3.13Å; T470-T474 PolarHBondContact O-OG1 3.19Å
471	T	70.7	Confident	68	Low	59 Å²	59	79.8 Å²	79.8	36%	0.362	40%	0.395	S	S	.	.	H	α-helix	trans	-60.2	-45.6	179.6	-52.9	0	0	0	0	112.4	I467 Q469 N473 T474 E475	I467-T471 WeakPolarHBondContact O-CB 3.28Å; I467-T471 PolarHBondContact O-N 3.23Å; I467-T471 PolarHBondContact O-OG1 3.16Å; Q469-T471 VanDerWaalsContact C-N 3.33Å; Q469-T471 PolarHBondContact O-N 3.34Å; T471-N473 PolarHBondContact O-N 3.42Å; T471-T474 WeakPolarHBondContact O-CB 3.47Å; T471-T474 PolarHBondContact O-N 3.34Å; T471-E475 PolarHBondContact O-N 2.67Å; T471-E475 VanDerWaalsContact O-N 3.13Å
472	K	68.9	Low	65.4	Low	127 Å²	127	81.5 Å²	81.5	55%	0.552	41%	0.412	S	S	*	.	H	α-helix	trans	-61.9	-44	177.5	-76.5	177.2	176.1	-172.1	0	112.3	R468 Q469 T470 T474 E475 E476	R468-K472 WeakPolarHBondContact O-CG 3.33Å; R468-K472 PolarHBondContact O-N 3.27Å; Q469-K472 PolarHBondContact O-N 3.11Å; T470-K472 PolarHBondContact O-N 2.81Å; K472-T474 VanDerWaalsContact C-N 3.26Å; K472-T474 PolarHBondContact O-N 2.63Å; K472-E475 PolarHBondContact O-N 2.87Å; K472-E475 VanDerWaalsContact O-N 3.13Å; K472-E476 PolarHBondContact O-N 3.19Å
473	N	61.4	Low	63	Low	97 Å²	97	87.4 Å²	87.4	52%	0.519	45%	0.45	S	S	.	.	H	α-helix	trans	-61.7	-36.9	-179.9	-66	-7.6	0	0	0	111.1	Q469 T470 T471 T477	Q469-N473 VanDerWaalsContact O-CG 3.24Å; Q469-N473 PolarHBondContact O-N 2.87Å; Q469-N473 PolarHBondContact O-OD1 2.9Å; T470-N473 PolarHBondContact O-N 3.19Å; T471-N473 PolarHBondContact O-N 3.42Å; N473-T477 WeakPolarHBondContact O-CB 3.29Å; N473-T477 PolarHBondContact O-N 2.98Å; N473-T477 PolarHBondContact O-OG1 2.86Å
474	T	57.3	Low	60.6	Low	43 Å²	43	94.9 Å²	94.9	26%	0.264	48%	0.482	S	S	.	.	H	α-helix	trans	-62.5	-49.4	171.9	-51.6	0	0	0	0	111.7	T470 T471 K472 E476 T477 Q478 A502	T470-T474 PolarHBondContact O-N 3.2Å; T470-T474 VanDerWaalsContact O-N 3.13Å; T470-T474 PolarHBondContact O-OG1 3.19Å; T471-T474 WeakPolarHBondContact O-CB 3.47Å; T471-T474 PolarHBondContact O-N 3.34Å; K472-T474 VanDerWaalsContact C-N 3.26Å; K472-T474 PolarHBondContact O-N 2.63Å; T474-E476 PolarHBondContact O-N 3.42Å; T474-T477 PolarHBondContact O-N 3.36Å; T474-Q478 WeakPolarHBondContact O-CG 3.49Å; T474-Q478 PolarHBondContact O-N 3.48Å; T474-Q478 VanDerWaalsContact O-N 3.11Å; T474-A502 HydrophobicContact CG2-CB 3.74Å
475	E	56.9	Low	58.5	Low	92 Å²	92	102.1 Å²	102.1	43%	0.43	52%	0.516	S	S	.	.	H	α-helix	trans	-62.2	-41.3	179.5	-76.9	-170.5	-136	0	0	113.7	T471 K472 Q478 K479	T471-E475 PolarHBondContact O-N 2.67Å; T471-E475 VanDerWaalsContact O-N 3.13Å; K472-E475 PolarHBondContact O-N 2.87Å; K472-E475 VanDerWaalsContact O-N 3.13Å; E475-Q478 PolarHBondContact O-N 2.91Å; E475-K479 WeakPolarHBondContact O-CD 3.07Å; E475-K479 WeakPolarHBondContact O-CG 3.47Å; E475-K479 PolarHBondContact O-N 3.5Å; E475-K479 VanDerWaalsContact O-N 3.15Å; E475-K479 IonicContact OE2-NZ 3.59Å; E475-K479 PolarHBondContact OE2-NZ 3.4Å
476	E	54.8	Low	56	Low	109 Å²	109	109.3 Å²	109.3	51%	0.509	55%	0.551	S	S	.	*	H	α-helix	trans	-71.1	-36.1	179.7	-71.2	179.9	-162.7	0	0	111.5	K472 T474 Q478 K479 N480	K472-E476 PolarHBondContact O-N 3.19Å; T474-E476 PolarHBondContact O-N 3.42Å; E476-Q478 VanDerWaalsContact C-N 3.32Å; E476-Q478 PolarHBondContact O-N 3.34Å; E476-K479 PolarHBondContact O-N 3.11Å; E476-N480 PolarHBondContact O-N 3.39Å; E476-N480 VanDerWaalsContact O-N 3.15Å; E476-N480 PolarHBondContact O-ND2 3.05Å
477	T	52.8	Low	53.6	Low	98 Å²	98	113.9 Å²	113.9	60%	0.601	58%	0.584	S	S	*	*	H	α-helix	trans	-61.7	-39.9	172.6	-58.2	0	0	0	0	111.5	N473 T474	N473-T477 WeakPolarHBondContact O-CB 3.29Å; N473-T477 PolarHBondContact O-N 2.98Å; N473-T477 PolarHBondContact O-OG1 2.86Å; T474-T477 PolarHBondContact O-N 3.36Å
478	Q	53.6	Low	51.7	Low	91 Å²	91	115.7 Å²	115.7	43%	0.425	60%	0.603	S	S	.	*	H	α-helix	trans	-68.9	-30.9	175.9	-70.6	179.4	4.5	0	0	113.5	T474 E475 E476 T481	T474-Q478 WeakPolarHBondContact O-CG 3.49Å; T474-Q478 PolarHBondContact O-N 3.48Å; T474-Q478 VanDerWaalsContact O-N 3.11Å; E475-Q478 PolarHBondContact O-N 2.91Å; E476-Q478 VanDerWaalsContact C-N 3.32Å; E476-Q478 PolarHBondContact O-N 3.34Å; Q478-T481 PolarHBondContact O-OG1 3.31Å; Q478-T481 VanDerWaalsContact O-OG1 3.13Å
479	K	49.9	Very low	49.3	Very low	143 Å²	143	113.7 Å²	113.7	62%	0.622	61%	0.61	S	S	*	*	H	α-helix	trans	-78.1	-25	179.7	-71	160.3	-167.8	158.9	0	112.9	E475 E476	E475-K479 WeakPolarHBondContact O-CD 3.07Å; E475-K479 WeakPolarHBondContact O-CG 3.47Å; E475-K479 PolarHBondContact O-N 3.5Å; E475-K479 VanDerWaalsContact O-N 3.15Å; E475-K479 IonicContact OE2-NZ 3.59Å; E475-K479 PolarHBondContact OE2-NZ 3.4Å; E476-K479 PolarHBondContact O-N 3.11Å
480	N	43.6	Very low	47.7	Very low	131 Å²	131	115.6 Å²	115.6	70%	0.701	63%	0.63	S	S	*	*	S	Bend	trans	-89.9	-3.8	-177.2	-72.9	-34.7	0	0	0	115	E476 T482	E476-N480 PolarHBondContact O-N 3.39Å; E476-N480 VanDerWaalsContact O-N 3.15Å; E476-N480 PolarHBondContact O-ND2 3.05Å; N480-T482 PolarHBondContact O-N 2.65Å
481	T	40.5	Very low	45.9	Very low	106 Å²	106	121.7 Å²	121.7	65%	0.65	65%	0.653	S	S	*	*			trans	-80.6	93.1	172.2	47.6	0	0	0	0	111.6	Q478	Q478-T481 PolarHBondContact O-OG1 3.31Å; Q478-T481 VanDerWaalsContact O-OG1 3.13Å
482	T	37.3	Very low	44.2	Very low	123 Å²	123	125 Å²	125	76%	0.755	68%	0.675	S	S	*	*			trans	-64.3	134.9	170.1	47.9	0	0	0	0	110.8	N480 K484	N480-T482 PolarHBondContact O-N 2.65Å; T482-K484 PolarHBondContact O-N 2.67Å
483	P	39.4	Very low	42.3	Very low	125 Å²	125	130.4 Å²	130.4	81%	0.812	69%	0.692	S	S	*	*			trans	-73.9	98.8	-178.7	29.3	-33.8	0	0	0	110.1	E485	P483-E485 PolarHBondContact O-N 3.15Å
484	K	34.9	Very low	41	Very low	189 Å²	189	136.8 Å²	136.8	82%	0.822	71%	0.709	S	S	*	*			trans	-62.3	130.5	163	-82.2	-174.5	173.8	179.2	0	109	T482 M486	T482-K484 PolarHBondContact O-N 2.67Å; K484-M486 PolarHBondContact O-N 2.89Å
485	E	39	Very low	40	Very low	199 Å²	199	147 Å²	147	93%	0.93	74%	0.742	S	S	*	*			trans	-57.5	121.2	176.2	-61.5	-179.2	130.2	0	0	110.2	P483	P483-E485 PolarHBondContact O-N 3.15Å
486	M	31.9	Very low	39.1	Very low	183 Å²	183	146 Å²	146	90%	0.901	75%	0.75	S	S	*	*			trans	-117.3	132.4	166	-83.3	-170.3	163	0	0	108.8	K484	K484-M486 PolarHBondContact O-N 2.89Å
487	T	31.4	Very low	38.3	Very low	142 Å²	142	145.3 Å²	145.3	87%	0.871	75%	0.75	S	S	*	*			trans	-69.8	158.7	-173.2	39.6	0	0	0	0	112.7	S489	T487-S489 PolarHBondContact O-N 3.12Å
488	C	38.5	Very low	37.8	Very low	118 Å²	118	146.9 Å²	146.9	80%	0.797	75%	0.754	S	S	*	*			trans	-54.2	127.8	-169.6	-174.5	0	0	0	0	114
489	S	28.2	Very low	37.2	Very low	98 Å²	98	149.3 Å²	149.3	69%	0.685	77%	0.765	S	S	*	*			trans	-142.7	116.3	165.4	-177.8	0	0	0	0	109.7	T487 F491	T487-S489 PolarHBondContact O-N 3.12Å; S489-F491 PolarHBondContact O-N 2.71Å; S489-F491 VanDerWaalsContact O-N 3.07Å
490	C	40.1	Very low	36.8	Very low	110 Å²	110	147.7 Å²	147.7	74%	0.743	76%	0.76	S	S	*	*			trans	-83.5	81.6	-165.5	-63.1	0	0	0	0	113.4
491	F	33.2	Very low	36.8	Very low	173 Å²	173	146 Å²	146	76%	0.759	75%	0.751	S	S	*	*			trans	-136.8	131	165.2	-76.6	-78.9	0	0	0	112.4	S489 R493	S489-F491 PolarHBondContact O-N 2.71Å; S489-F491 VanDerWaalsContact O-N 3.07Å; F491-R493 PolarHBondContact O-N 2.96Å
492	P	33.6	Very low	37	Very low	127 Å²	127	142.3 Å²	142.3	83%	0.825	73%	0.731	S	S	*	*			trans	-77.2	83.6	-179.9	31.9	-35.1	0	0	0	111.3	R494	P492-R494 PolarHBondContact O-N 2.96Å; P492-R494 VanDerWaalsContact O-N 3.16Å
493	R	31	Very low	37.4	Very low	241 Å²	241	142.4 Å²	142.4	91%	0.909	72%	0.721	S	S	*	*			trans	-63.7	113.7	166.4	-81.9	-172.5	173.2	-115.8	1.1	109.5	F491	F491-R493 PolarHBondContact O-N 2.96Å
494	R	32.4	Very low	37.8	Very low	232 Å²	232	141.1 Å²	141.1	88%	0.875	71%	0.708	S	S	*	*			trans	-57.9	138.8	161.7	-59.5	-179.3	-171	173.8	3.4	108.1	P492 A496	P492-R494 PolarHBondContact O-N 2.96Å; P492-R494 VanDerWaalsContact O-N 3.16Å; R494-A496 PolarHBondContact O-N 3.34Å; R494-A496 VanDerWaalsContact O-N 3.16Å
495	R	37.7	Very low	38.6	Very low	256 Å²	256	139.2 Å²	139.2	97%	0.966	70%	0.699	S	S	*	*			trans	-69.7	108.4	163.9	-66.3	-175.4	-174.3	-177.3	1.8	107.1
496	A	36.4	Very low	39.3	Very low	71 Å²	71	130.3 Å²	130.3	59%	0.587	66%	0.661	S	S	*	*			trans	-106.9	108.7	170.1	0	0	0	0	0	107.8	R494 L498	R494-A496 PolarHBondContact O-N 3.34Å; R494-A496 VanDerWaalsContact O-N 3.16Å; A496-L498 VanDerWaalsContact C-N 3.32Å; A496-L498 PolarHBondContact O-N 2.88Å
497	N	38.6	Very low	40.2	Very low	95 Å²	95	126.2 Å²	126.2	51%	0.508	64%	0.64	S	S	.	*			trans	39.9	39	141.3	-53.4	13.9	0	0	0	119.5	E499 E500 D501	N497-E499 PolarHBondContact O-N 3.34Å; N497-E500 HydrophobicContact CB-CB 4.22Å; N497-E500 HydrophobicContact CB-CG 4.11Å; N497-E500 VanDerWaalsContact CB-OE2 3.25Å; N497-E500 WeakPolarHBondContact CB-OE2 3.31Å; N497-E500 VanDerWaalsContact ND2-CD 3.32Å; N497-E500 PolarHBondContact ND2-OE2 3.42Å; N497-E500 PolarHBondContact O-N 3.45Å; N497-D501 PolarHBondContact O-N 2.87Å
498	L	42.1	Very low	41.3	Very low	131 Å²	131	122.4 Å²	122.4	69%	0.686	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.9	-7.5	170.3	-72.6	169.2	0	0	0	114.6	A496	A496-L498 VanDerWaalsContact C-N 3.32Å; A496-L498 PolarHBondContact O-N 2.88Å
499	E	42.1	Very low	42	Very low	142 Å²	142	121.3 Å²	121.3	66%	0.664	61%	0.606	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.9	-20.8	171.8	-67.4	175.9	-162	0	0	113.3	N497	N497-E499 PolarHBondContact O-N 3.34Å
500	E	41.5	Very low	43.3	Very low	110 Å²	110	117.2 Å²	117.2	51%	0.514	58%	0.576	S	S	.	*	H	α-helix	trans	-81	-50.6	173.1	-67.4	177	162.9	0	0	109.6	N497 A502 K503 D504	N497-E500 HydrophobicContact CB-CB 4.22Å; N497-E500 HydrophobicContact CB-CG 4.11Å; N497-E500 VanDerWaalsContact CB-OE2 3.25Å; N497-E500 WeakPolarHBondContact CB-OE2 3.31Å; N497-E500 VanDerWaalsContact ND2-CD 3.32Å; N497-E500 PolarHBondContact ND2-OE2 3.42Å; N497-E500 PolarHBondContact O-N 3.45Å; E500-A502 PolarHBondContact O-N 3.2Å; E500-K503 PolarHBondContact O-N 2.86Å; E500-D504 PolarHBondContact O-N 3.12Å
501	D	42.2	Very low	44	Very low	94 Å²	94	115.2 Å²	115.2	50%	0.503	56%	0.556	S	S	.	*	H	α-helix	trans	-50.7	-19.5	176.2	-78.8	-30	0	0	0	115.2	N497 K505	N497-D501 PolarHBondContact O-N 2.87Å; D501-K505 WeakPolarHBondContact O-CD 3.22Å; D501-K505 WeakPolarHBondContact O-CG 3.32Å
502	A	45.5	Very low	45	Very low	30 Å²	30	108.3 Å²	108.3	25%	0.248	53%	0.529	C	S	.	.	H	α-helix	trans	-93.3	-33	178.6	0	0	0	0	0	113.4	T474 E500	T474-A502 HydrophobicContact CG2-CB 3.74Å; E500-A502 PolarHBondContact O-N 3.2Å
503	K	46.1	Very low	45.9	Very low	124 Å²	124	103.3 Å²	103.3	54%	0.539	50%	0.495	S	S	.	.	H	α-helix	trans	-75.8	-46.8	174.8	-74.2	178.8	178.4	171.3	0	111	E500 K505 G506 E507	E500-K503 PolarHBondContact O-N 2.86Å; K503-K505 PolarHBondContact O-N 2.98Å; K503-G506 PolarHBondContact O-N 2.83Å; K503-E507 PolarHBondContact O-N 3.11Å
504	D	48.2	Very low	47	Very low	99 Å²	99	92.1 Å²	92.1	53%	0.529	45%	0.454	S	S	.	.	H	α-helix	trans	-50.9	-32	177	-74.9	26.3	0	0	0	112.3	E500 A508	E500-D504 PolarHBondContact O-N 3.12Å; D504-A508 WeakPolarHBondContact O-CB 3.2Å; D504-A508 PolarHBondContact O-N 2.94Å
505	K	50.8	Low	48.1	Very low	149 Å²	149	86.6 Å²	86.6	65%	0.648	44%	0.438	S	S	*	.	H	α-helix	trans	-74.2	-43.1	175.5	-74.1	176.1	-175.7	169.6	0	113.8	D501 K503 E507 A508 E509	D501-K505 WeakPolarHBondContact O-CD 3.22Å; D501-K505 WeakPolarHBondContact O-CG 3.32Å; K503-K505 PolarHBondContact O-N 2.98Å; K505-E507 VanDerWaalsContact C-N 3.33Å; K505-A508 PolarHBondContact O-N 3.43Å; K505-E509 VanDerWaalsContact O-CB 3.31Å; K505-E509 WeakPolarHBondContact O-CB 3.41Å; K505-E509 PolarHBondContact O-N 3.09Å
506	G	52.8	Low	48.7	Very low	12 Å²	12	78.9 Å²	78.9	12%	0.124	42%	0.415	C	S	.	.	H	α-helix	trans	-67.2	-37	176	0	0	0	0	0	112	K503 M510	K503-G506 PolarHBondContact O-N 2.83Å; G506-M510 VanDerWaalsContact O-CB 3.28Å; G506-M510 WeakPolarHBondContact O-CB 3.21Å; G506-M510 PolarHBondContact O-N 3.42Å
507	E	52	Low	49.3	Very low	97 Å²	97	83.1 Å²	83.1	45%	0.453	43%	0.428	S	S	.	.	H	α-helix	trans	-72.2	-40.1	176	-68	170.4	-162.8	0	0	110.8	K503 K505 M510 M511	K503-E507 PolarHBondContact O-N 3.11Å; K505-E507 VanDerWaalsContact C-N 3.33Å; E507-M510 WeakPolarHBondContact O-CB 3.25Å; E507-M510 PolarHBondContact O-N 2.89Å; E507-M511 WeakPolarHBondContact O-CB 3.48Å; E507-M511 VanDerWaalsContact O-CG 3.29Å; E507-M511 WeakPolarHBondContact O-CG 3.31Å; E507-M511 PolarHBondContact O-N 2.91Å
508	A	53.6	Low	50.4	Low	61 Å²	61	83.7 Å²	83.7	50%	0.504	43%	0.428	S	S	.	.	H	α-helix	trans	-65.5	-38.8	171.9	0	0	0	0	0	113.7	D504 K505 M511 C512	D504-A508 WeakPolarHBondContact O-CB 3.2Å; D504-A508 PolarHBondContact O-N 2.94Å; K505-A508 PolarHBondContact O-N 3.43Å; A508-M511 PolarHBondContact O-N 3.4Å; A508-C512 PolarHBondContact O-N 3.28Å
509	E	55	Low	52	Low	96 Å²	96	83.5 Å²	83.5	45%	0.449	43%	0.428	S	S	.	.	H	α-helix	trans	-67.7	-40.8	175.8	-171.2	-180	-178.7	0	0	111.3	K505 C512 L513 K524	K505-E509 VanDerWaalsContact O-CB 3.31Å; K505-E509 WeakPolarHBondContact O-CB 3.41Å; K505-E509 PolarHBondContact O-N 3.09Å; E509-C512 WeakPolarHBondContact O-CB 3.43Å; E509-C512 PolarHBondContact O-N 3.11Å; E509-L513 HydrophobicContact CG-CD1 4.42Å; E509-L513 WeakPolarHBondContact O-CD1 3.33Å; E509-L513 WeakPolarHBondContact O-CG 3.43Å; E509-L513 PolarHBondContact O-N 3.01Å; E509-K524 IonicContact OE1-NZ 3.61Å; E509-K524 PolarHBondContact OE1-NZ 3.43Å
510	M	55.4	Low	54.1	Low	11 Å²	11	77 Å²	77	5%	0.054	40%	0.398	C	S	.	.	H	α-helix	trans	-58.3	-49.3	170.5	-178.9	64.1	69.4	0	0	111.3	W466 G506 E507 C512 L513 L514 W527 I565	W466-M510 HydrophobicContact CD2-CE 4.1Å; W466-M510 HydrophobicContact CE3-CE 3.62Å; W466-M510 HydrophobicContact CH2-CE 3.57Å; W466-M510 HydrophobicContact CZ2-CE 4.03Å; W466-M510 HydrophobicContact CZ3-CE 3.34Å; G506-M510 VanDerWaalsContact O-CB 3.28Å; G506-M510 WeakPolarHBondContact O-CB 3.21Å; G506-M510 PolarHBondContact O-N 3.42Å; E507-M510 WeakPolarHBondContact O-CB 3.25Å; E507-M510 PolarHBondContact O-N 2.89Å; M510-C512 VanDerWaalsContact C-N 3.31Å; M510-C512 PolarHBondContact O-N 3.49Å; M510-L513 PolarHBondContact O-N 3.3Å; M510-L514 HydrophobicContact CG-CD1 3.78Å; M510-L514 VanDerWaalsContact O-CG 3.3Å; M510-L514 WeakPolarHBondContact O-CG 3.33Å; M510-L514 PolarHBondContact O-N 3.29Å; M510-L514 VanDerWaalsContact O-N 3.07Å; M510-L514 HydrophobicContact SD-CD1 3.98Å; M510-L514 HydrophobicContact SD-CG 4.32Å; M510-W527 HydrophobicContact CE-CZ2 3.69Å; M510-W527 HydrophobicContact SD-CZ2 4.43Å; M510-W527 PolarHBondContact SD-NE1 2.8Å; M510-I565 HydrophobicContact CE-CD1 3.74Å; M510-I565 HydrophobicContact CE-CG1 4.2Å; M510-I565 HydrophobicContact CG-CG1 4.37Å; M510-I565 HydrophobicContact SD-CD1 3.86Å; M510-I565 HydrophobicContact SD-CG1 3.69Å
511	M	53.1	Low	56.3	Low	69 Å²	69	77.5 Å²	77.5	34%	0.34	40%	0.403	S	S	.	.	H	α-helix	trans	-62.4	-34.6	178	-79	-80.2	-94.3	0	0	112.9	E507 A508 L514 Q515	E507-M511 WeakPolarHBondContact O-CB 3.48Å; E507-M511 VanDerWaalsContact O-CG 3.29Å; E507-M511 WeakPolarHBondContact O-CG 3.31Å; E507-M511 PolarHBondContact O-N 2.91Å; A508-M511 PolarHBondContact O-N 3.4Å; M511-L514 PolarHBondContact O-N 2.84Å; M511-Q515 WeakPolarHBondContact O-CB 3.43Å; M511-Q515 VanDerWaalsContact O-CG 3.27Å; M511-Q515 WeakPolarHBondContact O-CG 3.26Å; M511-Q515 PolarHBondContact O-N 3.48Å; M511-Q515 PolarHBondContact SD-NE2 3.18Å
512	C	54	Low	58.6	Low	28 Å²	28	73.9 Å²	73.9	19%	0.189	39%	0.388	C	S	.	.	H	α-helix	trans	-60.4	-50.3	172.6	-163.9	0	0	0	0	111.1	A508 E509 M510 L514 Q515 N516 E518	A508-C512 PolarHBondContact O-N 3.28Å; E509-C512 WeakPolarHBondContact O-CB 3.43Å; E509-C512 PolarHBondContact O-N 3.11Å; M510-C512 VanDerWaalsContact C-N 3.31Å; M510-C512 PolarHBondContact O-N 3.49Å; C512-L514 VanDerWaalsContact C-N 3.27Å; C512-L514 PolarHBondContact O-N 3.49Å; C512-Q515 PolarHBondContact O-N 2.91Å; C512-N516 WeakPolarHBondContact O-CB 3.43Å; C512-N516 PolarHBondContact O-N 3.42Å; C512-N516 PolarHBondContact SG-ND2 2.82Å; C512-E518 PolarHBondContact SG-OE2 3.09Å; C512-E518 VanDerWaalsContact SG-OE2 3.37Å
513	L	54.4	Low	60.8	Low	21 Å²	21	73.7 Å²	73.7	11%	0.11	38%	0.384	C	S	.	.	H	α-helix	trans	-71.1	-18	-177.5	-66.6	158.6	0	0	0	114.3	E509 M510 E518 K524	E509-L513 HydrophobicContact CG-CD1 4.42Å; E509-L513 WeakPolarHBondContact O-CD1 3.33Å; E509-L513 WeakPolarHBondContact O-CG 3.43Å; E509-L513 PolarHBondContact O-N 3.01Å; M510-L513 PolarHBondContact O-N 3.3Å; L513-E518 HydrophobicContact CD2-CB 4.29Å; L513-K524 HydrophobicContact CD1-CB 4.25Å; L513-K524 HydrophobicContact CD1-CD 3.48Å; L513-K524 VanDerWaalsContact CD1-CD 3.48Å; L513-K524 HydrophobicContact CD1-CG 3.85Å
514	L	53.8	Low	62.9	Low	7 Å²	7	70.2 Å²	70.2	4%	0.037	37%	0.369	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-2.5	175.7	-67.7	173.4	0	0	0	113.7	M510 M511 C512 I565 R571	M510-L514 HydrophobicContact CG-CD1 3.78Å; M510-L514 VanDerWaalsContact O-CG 3.3Å; M510-L514 WeakPolarHBondContact O-CG 3.33Å; M510-L514 PolarHBondContact O-N 3.29Å; M510-L514 VanDerWaalsContact O-N 3.07Å; M510-L514 HydrophobicContact SD-CD1 3.98Å; M510-L514 HydrophobicContact SD-CG 4.32Å; M511-L514 PolarHBondContact O-N 2.84Å; C512-L514 VanDerWaalsContact C-N 3.27Å; C512-L514 PolarHBondContact O-N 3.49Å; L514-I565 HydrophobicContact CD1-CG1 4.31Å; L514-R571 PolarHBondContact O-NH2 2.81Å; L514-R571 VanDerWaalsContact O-NH2 3.16Å
515	Q	55	Low	65.1	Low	116 Å²	116	66.7 Å²	66.7	54%	0.542	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-135.8	-36.8	-173.8	-61.1	-176.5	29.2	0	0	114.3	M511 C512	M511-Q515 WeakPolarHBondContact O-CB 3.43Å; M511-Q515 VanDerWaalsContact O-CG 3.27Å; M511-Q515 WeakPolarHBondContact O-CG 3.26Å; M511-Q515 PolarHBondContact O-N 3.48Å; M511-Q515 PolarHBondContact SD-NE2 3.18Å; C512-Q515 PolarHBondContact O-N 2.91Å
516	N	49.2	Very low	67.2	Low	93 Å²	93	59.6 Å²	59.6	50%	0.497	32%	0.317	S	S	.	.	S	Bend	trans	-104.3	151.6	-176.6	-63	-39.8	0	0	0	111.7	C512 E518	C512-N516 WeakPolarHBondContact O-CB 3.43Å; C512-N516 PolarHBondContact O-N 3.42Å; C512-N516 PolarHBondContact SG-ND2 2.82Å; N516-E518 PolarHBondContact O-N 3.25Å
517	N	50.9	Low	69.1	Low	160 Å²	160	59.2 Å²	59.2	86%	0.856	31%	0.312	S	S	*	.			trans	-83.2	52.8	178.9	-57.7	-54.8	0	0	0	112
518	E	60.9	Low	71	Confident	108 Å²	108	54.9 Å²	54.9	51%	0.505	29%	0.292	S	S	.	.	P	Polyproline II helix	trans	-79	145.4	164	-66.9	-174.4	157.5	0	0	109.2	C512 L513 N516 P520	C512-E518 PolarHBondContact SG-OE2 3.09Å; C512-E518 VanDerWaalsContact SG-OE2 3.37Å; L513-E518 HydrophobicContact CD2-CB 4.29Å; N516-E518 PolarHBondContact O-N 3.25Å; E518-P520 VanDerWaalsContact O-CD 3.29Å; E518-P520 WeakPolarHBondContact O-CD 3.42Å
519	D	76.3	Confident	72.8	Confident	127 Å²	127	52.6 Å²	52.6	68%	0.679	28%	0.275	S	S	*	.	P	Polyproline II helix	trans	-72	116.3	177.8	-70.3	-51.3	0	0	0	109.8
520	P	85.6	Confident	74.6	Confident	6 Å²	6	51.5 Å²	51.5	4%	0.039	27%	0.27	C	S	.	.	P	Polyproline II helix	trans	-70.3	149.4	-178.2	28.9	-33.6	0	0	0	110.7	E518 K524 W525	E518-P520 VanDerWaalsContact O-CD 3.29Å; E518-P520 WeakPolarHBondContact O-CD 3.42Å; P520-K524 HydrophobicContact CB-CB 4.31Å; P520-W525 HydrophobicContact CB-CD2 4.19Å; P520-W525 HydrophobicContact CB-CG 4.32Å; P520-W525 HydrophobicContact CG-CD2 3.59Å; P520-W525 HydrophobicContact CG-CE3 3.62Å; P520-W525 HydrophobicContact CG-CG 4.23Å; P520-W525 HydrophobicContact CG-CH2 3.84Å; P520-W525 HydrophobicContact CG-CZ2 3.81Å; P520-W525 HydrophobicContact CG-CZ3 3.75Å; P520-W525 PolarHBondContact O-NE1 2.72Å
521	L	87.2	Confident	76.5	Confident	120 Å²	120	51 Å²	51	63%	0.628	27%	0.267	S	S	*	.			trans	-131	138.2	-178.5	-66.3	173.9	0	0	0	111.8	D428 V523 K524	D428-L521 WeakPolarHBondContact OD1-CA 3.47Å; L521-V523 PolarHBondContact O-N 3.05Å; L521-K524 WeakPolarHBondContact O-CB 2.77Å; L521-K524 PolarHBondContact O-N 3.47Å
522	G	90.9	Very high	78.6	Confident	18 Å²	18	47.7 Å²	47.7	19%	0.186	25%	0.251	C	S	.	.	G	3₁₀ helix	trans	54.1	-129	178	0	0	0	0	0	112.6	I427 D428 K524 W525	I427-G522 WeakPolarHBondContact CG2-O 3.48Å; D428-G522 PolarHBondContact OD1-N 3.47Å; D428-G522 WeakPolarHBondContact OD2-CA 3.46Å; D428-G522 PolarHBondContact OD2-N 3.5Å; G522-K524 PolarHBondContact O-N 2.99Å; G522-K524 VanDerWaalsContact O-N 3.08Å; G522-W525 WeakPolarHBondContact O-CB 3.47Å; G522-W525 PolarHBondContact O-N 3.07Å; G522-W525 VanDerWaalsContact O-N 3.12Å
523	V	91.8	Very high	80.6	Confident	25 Å²	25	50.4 Å²	50.4	15%	0.152	26%	0.257	C	S	.	.	G	3₁₀ helix	trans	-55.9	-27.2	-178.3	74.5	0	0	0	0	114	R421 L521 W525 L526 W527	R421-V523 HydrophobicContact CB-CB 4.49Å; R421-V523 HydrophobicContact CB-CG2 4.04Å; R421-V523 HydrophobicContact CG-CG2 4.05Å; L521-V523 PolarHBondContact O-N 3.05Å; V523-W525 PolarHBondContact O-N 3.43Å; V523-L526 HydrophobicContact CG2-CD1 3.83Å; V523-L526 WeakPolarHBondContact O-CB 3.41Å; V523-L526 WeakPolarHBondContact O-CG 3.41Å; V523-L526 PolarHBondContact O-N 3.28Å; V523-L526 VanDerWaalsContact O-N 3.08Å; V523-W527 HydrophobicContact CG1-CH2 4.13Å; V523-W527 HydrophobicContact CG2-CH2 3.86Å; V523-W527 HydrophobicContact CG2-CZ3 4Å
524	K	90.2	Very high	82.6	Confident	52 Å²	52	49.7 Å²	49.7	23%	0.226	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-62.7	-24.1	179.8	-63.9	163.9	163.5	-174.4	0	113	E509 L513 P520 L521 G522 L526 S528	E509-K524 IonicContact OE1-NZ 3.61Å; E509-K524 PolarHBondContact OE1-NZ 3.43Å; L513-K524 HydrophobicContact CD1-CB 4.25Å; L513-K524 HydrophobicContact CD1-CD 3.48Å; L513-K524 VanDerWaalsContact CD1-CD 3.48Å; L513-K524 HydrophobicContact CD1-CG 3.85Å; P520-K524 HydrophobicContact CB-CB 4.31Å; L521-K524 WeakPolarHBondContact O-CB 2.77Å; L521-K524 PolarHBondContact O-N 3.47Å; G522-K524 PolarHBondContact O-N 2.99Å; G522-K524 VanDerWaalsContact O-N 3.08Å; K524-L526 PolarHBondContact O-N 3.2Å; K524-S528 PolarHBondContact O-N 2.7Å
525	W	93.9	Very high	84.7	Confident	25 Å²	25	49.4 Å²	49.4	10%	0.095	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-57.7	-35.5	172.9	-87.7	106.1	0	0	0	113.2	I427 D428 A431 T435 P520 G522 V523 W527 S528 Q530 L531	I427-W525 HydrophobicContact CG2-CB 3.62Å; I427-W525 HydrophobicContact CG2-CG 4.35Å; D428-W525 PolarHBondContact OD1-NE1 2.94Å; A431-W525 HydrophobicContact CB-CB 4.08Å; A431-W525 HydrophobicContact CB-CD2 3.42Å; A431-W525 VanDerWaalsContact CB-CD2 3.42Å; A431-W525 HydrophobicContact CB-CE3 3.44Å; A431-W525 VanDerWaalsContact CB-CE3 3.44Å; A431-W525 HydrophobicContact CB-CG 3.74Å; A431-W525 HydrophobicContact CB-CZ3 4.07Å; T435-W525 HydrophobicContact CG2-CZ3 4.36Å; P520-W525 HydrophobicContact CB-CD2 4.19Å; P520-W525 HydrophobicContact CB-CG 4.32Å; P520-W525 HydrophobicContact CG-CD2 3.59Å; P520-W525 HydrophobicContact CG-CE3 3.62Å; P520-W525 HydrophobicContact CG-CG 4.23Å; P520-W525 HydrophobicContact CG-CH2 3.84Å; P520-W525 HydrophobicContact CG-CZ2 3.81Å; P520-W525 HydrophobicContact CG-CZ3 3.75Å; P520-W525 PolarHBondContact O-NE1 2.72Å; G522-W525 WeakPolarHBondContact O-CB 3.47Å; G522-W525 PolarHBondContact O-N 3.07Å; G522-W525 VanDerWaalsContact O-N 3.12Å; V523-W525 PolarHBondContact O-N 3.43Å; W525-W527 PolarHBondContact O-N 3.02Å; W525-W527 VanDerWaalsContact O-N 3.09Å; W525-S528 PolarHBondContact O-N 3.2Å; W525-S528 PolarHBondContact O-OG 3.16Å; W525-Q530 HydrophobicContact CZ3-CB 4.01Å; W525-L531 HydrophobicContact CE3-CB 4.34Å; W525-L531 WeakPolarHBondContact O-CB 3.24Å; W525-L531 VanDerWaalsContact O-CD2 3.22Å; W525-L531 WeakPolarHBondContact O-CD2 3.36Å
526	L	95.4	Very high	86.8	Confident	0 Å²	0	43.9 Å²	43.9	0%	0	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	-58.9	-30.8	-169.1	-65.6	179.3	0	0	0	112.9	R421 I427 L455 L458 T459 A462 V523 K524 L558	R421-L526 HydrophobicContact CG-CD1 4.19Å; I427-L526 HydrophobicContact CD1-CD1 4.07Å; I427-L526 HydrophobicContact CD1-CD2 4.15Å; I427-L526 HydrophobicContact CD1-CG 4.09Å; I427-L526 HydrophobicContact CG2-CD2 3.89Å; I427-L526 HydrophobicContact CG2-CG 4.25Å; L455-L526 HydrophobicContact CD2-CD2 3.85Å; L458-L526 HydrophobicContact CB-CD1 4.25Å; L458-L526 HydrophobicContact CB-CD2 3.88Å; L458-L526 WeakPolarHBondContact O-CD1 3.32Å; T459-L526 HydrophobicContact CG2-CB 4.02Å; T459-L526 HydrophobicContact CG2-CD2 4.23Å; A462-L526 HydrophobicContact CB-CD1 3.87Å; V523-L526 HydrophobicContact CG2-CD1 3.83Å; V523-L526 WeakPolarHBondContact O-CB 3.41Å; V523-L526 WeakPolarHBondContact O-CG 3.41Å; V523-L526 PolarHBondContact O-N 3.28Å; V523-L526 VanDerWaalsContact O-N 3.08Å; K524-L526 PolarHBondContact O-N 3.2Å; L526-L558 WeakPolarHBondContact O-CD1 3.25Å; L526-L558 WeakPolarHBondContact O-CD2 3.24Å
527	W	92.1	Very high	89	Confident	4 Å²	4	41.6 Å²	41.6	2%	0.015	22%	0.218	C	C	.	.	G	3₁₀ helix	trans	-116.2	11.8	177.3	51.4	82.9	0	0	0	113.6	A462 W466 M510 V523 W525 L558 I565	A462-W527 HydrophobicContact CB-CZ3 4.12Å; W466-W527 HydrophobicContact CB-CH2 4.02Å; W466-W527 HydrophobicContact CD2-CH2 4.36Å; W466-W527 HydrophobicContact CD2-CZ2 4.45Å; W466-W527 AromaticContact CG-CH2 3.87Å; W466-W527 HydrophobicContact CG-CH2 3.87Å; W466-W527 HydrophobicContact CG-CZ2 4.36Å; M510-W527 HydrophobicContact CE-CZ2 3.69Å; M510-W527 HydrophobicContact SD-CZ2 4.43Å; M510-W527 PolarHBondContact SD-NE1 2.8Å; V523-W527 HydrophobicContact CG1-CH2 4.13Å; V523-W527 HydrophobicContact CG2-CH2 3.86Å; V523-W527 HydrophobicContact CG2-CZ3 4Å; W525-W527 PolarHBondContact O-N 3.02Å; W525-W527 VanDerWaalsContact O-N 3.09Å; W527-L558 HydrophobicContact CB-CD2 3.89Å; W527-I565 HydrophobicContact CB-CG2 3.64Å; W527-I565 HydrophobicContact CD2-CD1 3.99Å; W527-I565 HydrophobicContact CE3-CD1 4.28Å; W527-I565 HydrophobicContact CG-CD1 4.16Å; W527-I565 HydrophobicContact CG-CG2 4.18Å
528	S	92.4	Very high	91.2	Very high	5 Å²	5	34 Å²	34	4%	0.035	18%	0.177	C	C	.	.			trans	-68.5	144.9	-175.9	87.2	0	0	0	0	112.3	K524 W525 Q530 L531 V532	K524-S528 PolarHBondContact O-N 2.7Å; W525-S528 PolarHBondContact O-N 3.2Å; W525-S528 PolarHBondContact O-OG 3.16Å; S528-Q530 PolarHBondContact O-N 2.69Å; S528-Q530 VanDerWaalsContact O-N 3.08Å; S528-L531 PolarHBondContact O-N 2.79Å; S528-L531 VanDerWaalsContact O-N 3.12Å; S528-L531 PolarHBondContact OG-N 3.19Å; S528-V532 WeakPolarHBondContact O-CG2 3.49Å; S528-V532 PolarHBondContact O-N 3.22Å
529	G	92	Very high	92.9	Very high	13 Å²	13	28.8 Å²	28.8	13%	0.134	15%	0.153	C	C	.	.	H	α-helix	trans	-63.5	-13.9	176.7	0	0	0	0	0	114.3	R533	G529-R533 VanDerWaalsContact O-CG 3.26Å; G529-R533 WeakPolarHBondContact O-CG 3.35Å; G529-R533 PolarHBondContact O-NH1 2.93Å
530	Q	92.7	Very high	93.7	Very high	74 Å²	74	25.2 Å²	25.2	35%	0.346	14%	0.141	S	C	.	.	H	α-helix	trans	-76.9	-51.4	170.6	-56.7	-169.4	22.8	0	0	110.8	W525 S528 R533 A534	W525-Q530 HydrophobicContact CZ3-CB 4.01Å; S528-Q530 PolarHBondContact O-N 2.69Å; S528-Q530 VanDerWaalsContact O-N 3.08Å; Q530-R533 PolarHBondContact O-N 3.03Å; Q530-A534 PolarHBondContact O-N 3.21Å
531	L	95.5	Very high	94.1	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-69.4	-36.3	-176.4	-170.7	60.9	0	0	0	112.2	A431 T434 T435 L455 W525 S528 R533 A534 Y535	A431-L531 HydrophobicContact CB-CD1 4.27Å; A431-L531 HydrophobicContact CB-CD2 4.43Å; T434-L531 HydrophobicContact CG2-CD1 3.9Å; T435-L531 HydrophobicContact CG2-CD1 4.49Å; L455-L531 HydrophobicContact CD1-CD1 4.27Å; L455-L531 HydrophobicContact CD1-CD2 4.33Å; L455-L531 HydrophobicContact CD2-CD2 4.46Å; W525-L531 HydrophobicContact CE3-CB 4.34Å; W525-L531 WeakPolarHBondContact O-CB 3.24Å; W525-L531 VanDerWaalsContact O-CD2 3.22Å; W525-L531 WeakPolarHBondContact O-CD2 3.36Å; S528-L531 PolarHBondContact O-N 2.79Å; S528-L531 VanDerWaalsContact O-N 3.12Å; S528-L531 PolarHBondContact OG-N 3.19Å; L531-R533 VanDerWaalsContact C-N 3.32Å; L531-R533 PolarHBondContact O-N 3.48Å; L531-A534 WeakPolarHBondContact O-CB 3.46Å; L531-A534 PolarHBondContact O-N 3.25Å; L531-Y535 HydrophobicContact CD1-CE1 4.25Å; L531-Y535 HydrophobicContact CD2-CE2 4.21Å; L531-Y535 WeakPolarHBondContact CD2-OH 3.19Å; L531-Y535 HydrophobicContact CG-CD2 4.47Å; L531-Y535 HydrophobicContact CG-CE1 4.28Å; L531-Y535 HydrophobicContact CG-CE2 3.84Å; L531-Y535 WeakPolarHBondContact O-CD2 3.46Å; L531-Y535 PolarHBondContact O-N 2.69Å
532	V	96.8	Very high	94.4	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-60.3	-40.6	172.6	175.6	0	0	0	0	111.5	S528 Y535 L536 L555 L558 V569 I572 I573	S528-V532 WeakPolarHBondContact O-CG2 3.49Å; S528-V532 PolarHBondContact O-N 3.22Å; V532-Y535 PolarHBondContact O-N 3.04Å; V532-L536 HydrophobicContact CG1-CD1 3.97Å; V532-L536 WeakPolarHBondContact O-CD1 3.22Å; V532-L536 VanDerWaalsContact O-CG 3.29Å; V532-L536 WeakPolarHBondContact O-CG 3.39Å; V532-L536 PolarHBondContact O-N 3Å; V532-L555 HydrophobicContact CG1-CD2 4.08Å; V532-L558 HydrophobicContact CG2-CD1 4.28Å; V532-V569 HydrophobicContact CG1-CG1 4.32Å; V532-V569 HydrophobicContact CG2-CG1 4.34Å; V532-V569 HydrophobicContact CG2-CG2 4.13Å; V532-I572 HydrophobicContact CB-CG2 4.34Å; V532-I572 HydrophobicContact CG1-CB 4.19Å; V532-I572 HydrophobicContact CG1-CG2 3.68Å; V532-I573 HydrophobicContact CG1-CG1 4.42Å
533	R	95.9	Very high	94.6	Very high	84 Å²	84	25.8 Å²	25.8	32%	0.317	15%	0.148	S	C	.	.	H	α-helix	trans	-71.9	-32.1	175.9	-70.1	-176.3	-177.2	97.7	-4.8	112.5	G529 Q530 L531 L536 S537 I572 E575 E576	G529-R533 VanDerWaalsContact O-CG 3.26Å; G529-R533 WeakPolarHBondContact O-CG 3.35Å; G529-R533 PolarHBondContact O-NH1 2.93Å; Q530-R533 PolarHBondContact O-N 3.03Å; L531-R533 VanDerWaalsContact C-N 3.32Å; L531-R533 PolarHBondContact O-N 3.48Å; R533-L536 PolarHBondContact O-N 2.83Å; R533-S537 WeakPolarHBondContact O-CB 3.45Å; R533-S537 PolarHBondContact O-N 3.36Å; R533-S537 PolarHBondContact O-OG 3.08Å; R533-I572 HydrophobicContact CG-CG2 3.84Å; R533-E575 IonicContact CZ-OE2 2.71Å; R533-E575 IonicContact NH2-OE2 3.24Å; R533-E575 PolarHBondContact NH2-OE2 3.27Å; R533-E576 HydrophobicContact CG-CG 3.98Å; R533-E576 IonicContact NE-OE1 2.9Å
534	A	96.7	Very high	94.7	Very high	7 Å²	7	26 Å²	26	6%	0.058	15%	0.148	C	C	.	.	H	α-helix	trans	-63.5	-47.6	170.1	0	0	0	0	0	111.8	T435 A438 Q530 L531 L536 S537 L538	T435-A534 HydrophobicContact CG2-CB 3.86Å; A438-A534 HydrophobicContact CB-CB 3.96Å; Q530-A534 PolarHBondContact O-N 3.21Å; L531-A534 WeakPolarHBondContact O-CB 3.46Å; L531-A534 PolarHBondContact O-N 3.25Å; A534-L536 PolarHBondContact O-N 3.24Å; A534-S537 WeakPolarHBondContact O-CA 3.39Å; A534-S537 WeakPolarHBondContact O-CB 3.47Å; A534-S537 PolarHBondContact O-N 3.09Å; A534-S537 VanDerWaalsContact O-N 3.08Å; A534-L538 WeakPolarHBondContact O-CG 3.45Å; A534-L538 PolarHBondContact O-N 3.02Å
535	Y	98.2	Very high	95	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-54.8	-50	172.9	-67.7	-35.2	0	0	0	112	T434 V452 L455 L531 V532 S537 L538 L539 T551 A554 L555 L558	T434-Y535 HydrophobicContact CG2-CE1 4.36Å; V452-Y535 HydrophobicContact CG1-CE1 4.24Å; L455-Y535 VanDerWaalsContact CB-OH 3.27Å; L455-Y535 WeakPolarHBondContact CB-OH 3.32Å; L531-Y535 HydrophobicContact CD1-CE1 4.25Å; L531-Y535 HydrophobicContact CD2-CE2 4.21Å; L531-Y535 WeakPolarHBondContact CD2-OH 3.19Å; L531-Y535 HydrophobicContact CG-CD2 4.47Å; L531-Y535 HydrophobicContact CG-CE1 4.28Å; L531-Y535 HydrophobicContact CG-CE2 3.84Å; L531-Y535 WeakPolarHBondContact O-CD2 3.46Å; L531-Y535 PolarHBondContact O-N 2.69Å; V532-Y535 PolarHBondContact O-N 3.04Å; Y535-S537 PolarHBondContact O-N 2.98Å; Y535-L538 PolarHBondContact O-N 3.23Å; Y535-L538 VanDerWaalsContact O-N 3.11Å; Y535-L539 PolarHBondContact O-N 3.48Å; Y535-T551 HydrophobicContact CD1-CG2 4.15Å; Y535-T551 HydrophobicContact CG-CG2 4.19Å; Y535-T551 WeakPolarHBondContact O-CG2 3.29Å; Y535-A554 HydrophobicContact CD2-CB 4.34Å; Y535-A554 HydrophobicContact CE1-CB 4.17Å; Y535-A554 HydrophobicContact CE2-CB 3.76Å; Y535-L555 HydrophobicContact CD2-CD2 3.84Å; Y535-L555 HydrophobicContact CD2-CG 4.17Å; Y535-L555 HydrophobicContact CG-CD2 4.4Å; Y535-L555 HydrophobicContact CG-CG 4.43Å; Y535-L558 HydrophobicContact CE2-CD1 4.37Å
536	L	97.4	Very high	95	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-65.7	-24.4	179.3	-66.7	165.2	0	0	0	112.9	V532 R533 A534 L539 L555 I573 E576 K581	V532-L536 HydrophobicContact CG1-CD1 3.97Å; V532-L536 WeakPolarHBondContact O-CD1 3.22Å; V532-L536 VanDerWaalsContact O-CG 3.29Å; V532-L536 WeakPolarHBondContact O-CG 3.39Å; V532-L536 PolarHBondContact O-N 3Å; R533-L536 PolarHBondContact O-N 2.83Å; A534-L536 PolarHBondContact O-N 3.24Å; L536-L539 HydrophobicContact CD2-CD1 4.35Å; L536-L555 HydrophobicContact CD2-CD1 3.83Å; L536-L555 HydrophobicContact CG-CD1 4.24Å; L536-I573 HydrophobicContact CD1-CB 4.48Å; L536-I573 HydrophobicContact CD1-CG1 3.88Å; L536-I573 HydrophobicContact CD2-CG1 4.26Å; L536-E576 HydrophobicContact CB-CB 4.45Å; L536-E576 HydrophobicContact CD1-CB 3.64Å; L536-E576 HydrophobicContact CD1-CG 3.95Å; L536-K581 HydrophobicContact CB-CD 4.23Å; L536-K581 VanDerWaalsContact O-CD 3.32Å; L536-K581 WeakPolarHBondContact O-CD 3.3Å; L536-K581 WeakPolarHBondContact O-CE 3.27Å
537	S	96.6	Very high	95.1	Very high	44 Å²	44	28.8 Å²	28.8	31%	0.308	16%	0.162	S	C	.	.	H	α-helix	trans	-74.2	-43.2	170.8	-60.3	0	0	0	0	111.6	R533 A534 Y535 L539 A540 C541	R533-S537 WeakPolarHBondContact O-CB 3.45Å; R533-S537 PolarHBondContact O-N 3.36Å; R533-S537 PolarHBondContact O-OG 3.08Å; A534-S537 WeakPolarHBondContact O-CA 3.39Å; A534-S537 WeakPolarHBondContact O-CB 3.47Å; A534-S537 PolarHBondContact O-N 3.09Å; A534-S537 VanDerWaalsContact O-N 3.08Å; Y535-S537 PolarHBondContact O-N 2.98Å; S537-L539 VanDerWaalsContact C-N 3.33Å; S537-L539 PolarHBondContact O-N 3.07Å; S537-A540 WeakPolarHBondContact O-CB 3.29Å; S537-A540 PolarHBondContact O-N 2.83Å; S537-C541 PolarHBondContact O-N 3.24Å; S537-C541 VanDerWaalsContact O-N 3.09Å; S537-C541 PolarHBondContact O-SG 3.4Å
538	L	96.8	Very high	95.3	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.163	C	C	.	.	H	α-helix	trans	-59.2	-40	174.4	-66.7	176.9	0	0	0	112.1	T434 A438 P443 T448 V452 A534 Y535 A540 C541 S542 T547 T551	T434-L538 HydrophobicContact CG2-CD1 4.07Å; A438-L538 HydrophobicContact CB-CD2 4.1Å; A438-L538 HydrophobicContact CB-CG 4.18Å; P443-L538 HydrophobicContact CB-CD2 3.52Å; T448-L538 HydrophobicContact CG2-CD1 4.27Å; T448-L538 HydrophobicContact CG2-CD2 4.12Å; V452-L538 HydrophobicContact CG2-CD1 3.68Å; A534-L538 WeakPolarHBondContact O-CG 3.45Å; A534-L538 PolarHBondContact O-N 3.02Å; Y535-L538 PolarHBondContact O-N 3.23Å; Y535-L538 VanDerWaalsContact O-N 3.11Å; L538-A540 PolarHBondContact O-N 3.02Å; L538-C541 PolarHBondContact O-N 3.12Å; L538-S542 WeakPolarHBondContact O-CB 3.5Å; L538-S542 PolarHBondContact O-N 3.21Å; L538-T547 HydrophobicContact CD1-CG2 4.21Å; L538-T551 HydrophobicContact CB-CG2 4.32Å
539	L	96.2	Very high	95.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-59.8	-29.3	173.2	-63.9	-171	0	0	0	113.4	Y535 L536 S537 L548 T551 M552 L555 K581 I582 V585	Y535-L539 PolarHBondContact O-N 3.48Å; L536-L539 HydrophobicContact CD2-CD1 4.35Å; S537-L539 VanDerWaalsContact C-N 3.33Å; S537-L539 PolarHBondContact O-N 3.07Å; L539-L548 HydrophobicContact CD2-CD2 4.07Å; L539-T551 HydrophobicContact CD2-CG2 3.47Å; L539-T551 VanDerWaalsContact CD2-CG2 3.47Å; L539-T551 HydrophobicContact CG-CG2 3.67Å; L539-M552 HydrophobicContact CD1-CG 4.27Å; L539-M552 HydrophobicContact CD2-CG 3.7Å; L539-L555 HydrophobicContact CD1-CD1 4.04Å; L539-K581 HydrophobicContact CB-CB 4.25Å; L539-I582 HydrophobicContact CD1-CG1 3.95Å; L539-V585 HydrophobicContact CB-CG2 4.33Å; L539-V585 HydrophobicContact CD2-CG2 4.47Å; L539-V585 VanDerWaalsContact O-CG2 3.28Å; L539-V585 WeakPolarHBondContact O-CG2 3.39Å
540	A	94	Very high	95.8	Very high	51 Å²	51	30.6 Å²	30.6	42%	0.421	17%	0.167	S	C	.	.	H	α-helix	trans	-81.3	-38.8	179.2	0	0	0	0	0	112.7	S537 L538 K581	S537-A540 WeakPolarHBondContact O-CB 3.29Å; S537-A540 PolarHBondContact O-N 2.83Å; L538-A540 PolarHBondContact O-N 3.02Å; A540-K581 HydrophobicContact CB-CG 4.47Å
541	C	92.7	Very high	96.1	Very high	53 Å²	53	27.1 Å²	27.1	36%	0.358	15%	0.151	S	C	.	.	H	α-helix	trans	-107.1	-23	-169	68	0	0	0	0	116.3	P443 S537 L538	P443-C541 HydrophobicContact CG-CB 4.43Å; S537-C541 PolarHBondContact O-N 3.24Å; S537-C541 VanDerWaalsContact O-N 3.09Å; S537-C541 PolarHBondContact O-SG 3.4Å; L538-C541 PolarHBondContact O-N 3.12Å
542	S	94.8	Very high	96.2	Very high	2 Å²	2	27.1 Å²	27.1	1%	0.014	15%	0.151	C	C	.	.			trans	-74.1	149	-177.7	-176.1	0	0	0	0	112.8	D444 L538 N544	D444-S542 VanDerWaalsContact OD1-CA 3.28Å; D444-S542 WeakPolarHBondContact OD1-CA 3.2Å; D444-S542 WeakPolarHBondContact OD1-CB 3.4Å; D444-S542 PolarHBondContact OD1-OG 3.45Å; L538-S542 WeakPolarHBondContact O-CB 3.5Å; L538-S542 PolarHBondContact O-N 3.21Å; S542-N544 PolarHBondContact OG-N 3.22Å
543	T	93.8	Very high	96.3	Very high	101 Å²	101	27.1 Å²	27.1	62%	0.62	15%	0.151	S	C	*	.			trans	-116.4	-15.6	167	70.9	0	0	0	0	113.2	D444 K545	D444-T543 VanDerWaalsContact CG-N 3.26Å; D444-T543 PolarHBondContact OD1-N 3.35Å; D444-T543 WeakPolarHBondContact OD2-CB 3.35Å; D444-T543 PolarHBondContact OD2-N 3.17Å; D444-T543 PolarHBondContact OD2-OG1 3.01Å; T543-K545 PolarHBondContact O-N 3.13Å
544	N	94.7	Very high	96.4	Very high	30 Å²	30	23.1 Å²	23.1	16%	0.16	14%	0.136	C	C	.	.			trans	-65.4	117.7	174.6	-177.7	-18.6	0	0	0	110.5	D444 E449 S542 M546 T547 L548	D444-N544 HydrophobicContact CB-CB 4.24Å; D444-N544 WeakPolarHBondContact OD1-CB 3.41Å; D444-N544 PolarHBondContact OD1-N 2.92Å; E449-N544 PolarHBondContact OE2-ND2 2.91Å; S542-N544 PolarHBondContact OG-N 3.22Å; N544-M546 VanDerWaalsContact C-N 3.25Å; N544-M546 PolarHBondContact O-N 3.39Å; N544-M546 WeakPolarHBondContact OD1-CB 3.46Å; N544-M546 PolarHBondContact OD1-N 2.91Å; N544-T547 PolarHBondContact O-N 3.41Å; N544-L548 WeakPolarHBondContact O-CB 3.19Å; N544-L548 VanDerWaalsContact O-CG 3.31Å; N544-L548 WeakPolarHBondContact O-CG 3.25Å; N544-L548 PolarHBondContact O-N 3.41Å
545	K	95.6	Very high	96.4	Very high	92 Å²	92	22.9 Å²	22.9	40%	0.4	13%	0.134	S	C	.	.	H	α-helix	trans	-56.5	-37.7	179.4	-64.2	-162.2	-175.7	-153.6	0	113	T543 Q549 N589 T591	T543-K545 PolarHBondContact O-N 3.13Å; K545-Q549 VanDerWaalsContact O-CB 3.22Å; K545-Q549 WeakPolarHBondContact O-CB 3.48Å; K545-Q549 PolarHBondContact O-N 3.07Å; K545-N589 WeakPolarHBondContact CE-OD1 3.37Å; K545-N589 PolarHBondContact NZ-OD1 3.09Å; K545-T591 PolarHBondContact NZ-OG1 3.29Å
546	M	94.6	Very high	96.4	Very high	44 Å²	44	22.9 Å²	22.9	22%	0.217	13%	0.134	C	C	.	.	H	α-helix	trans	-74.1	-44.9	-177	-61.7	-48.5	-54	0	0	111.2	W108 E449 N544 L548 Q549 A550	W108-M546 HydrophobicContact CH2-CE 4.03Å; W108-M546 HydrophobicContact CZ2-CE 3.63Å; E449-M546 HydrophobicContact CG-CB 3.54Å; E449-M546 WeakPolarHBondContact OE1-CB 3.16Å; N544-M546 VanDerWaalsContact C-N 3.25Å; N544-M546 PolarHBondContact O-N 3.39Å; N544-M546 WeakPolarHBondContact OD1-CB 3.46Å; N544-M546 PolarHBondContact OD1-N 2.91Å; M546-L548 VanDerWaalsContact C-N 3.33Å; M546-L548 PolarHBondContact O-N 3.37Å; M546-Q549 PolarHBondContact O-N 3.46Å; M546-A550 VanDerWaalsContact O-CB 3.31Å; M546-A550 WeakPolarHBondContact O-CB 3.45Å; M546-A550 PolarHBondContact O-N 2.78Å
547	T	96.8	Very high	96.3	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-56.5	-48.8	171.8	-52.4	0	0	0	0	110.4	T448 V452 L538 N544 A550 T551	T448-T547 HydrophobicContact CG2-CG2 4.22Å; V452-T547 HydrophobicContact CG2-CG2 4.47Å; L538-T547 HydrophobicContact CD1-CG2 4.21Å; N544-T547 PolarHBondContact O-N 3.41Å; T547-A550 PolarHBondContact O-N 3.19Å; T547-T551 VanDerWaalsContact O-CB 3.23Å; T547-T551 WeakPolarHBondContact O-CB 3.27Å; T547-T551 PolarHBondContact O-N 3.48Å; T547-T551 PolarHBondContact O-OG1 2.97Å
548	L	97.5	Very high	96.3	Very high	5 Å²	5	22.1 Å²	22.1	3%	0.026	13%	0.126	C	C	.	.	H	α-helix	trans	-61.7	-45.3	178.4	-70.4	170	0	0	0	112.8	L539 N544 M546 M552 V585 L592	L539-L548 HydrophobicContact CD2-CD2 4.07Å; N544-L548 WeakPolarHBondContact O-CB 3.19Å; N544-L548 VanDerWaalsContact O-CG 3.31Å; N544-L548 WeakPolarHBondContact O-CG 3.25Å; N544-L548 PolarHBondContact O-N 3.41Å; M546-L548 VanDerWaalsContact C-N 3.33Å; M546-L548 PolarHBondContact O-N 3.37Å; L548-M552 WeakPolarHBondContact O-CE 3.47Å; L548-M552 WeakPolarHBondContact O-CG 3.49Å; L548-M552 PolarHBondContact O-N 3.37Å; L548-V585 HydrophobicContact CD1-CG1 4.21Å; L548-V585 HydrophobicContact CD2-CG1 4.5Å; L548-V585 HydrophobicContact CD2-CG2 3.82Å; L548-L592 HydrophobicContact CB-CD1 3.85Å; L548-L592 HydrophobicContact CD1-CD1 4.08Å
549	Q	97.1	Very high	96.2	Very high	54 Å²	54	22.1 Å²	22.1	25%	0.252	13%	0.126	S	C	.	.	H	α-helix	trans	-62.3	-46.7	177.1	176.2	170.8	-38.2	0	0	111.7	K545 M546 M552 G553 L592 P595	K545-Q549 VanDerWaalsContact O-CB 3.22Å; K545-Q549 WeakPolarHBondContact O-CB 3.48Å; K545-Q549 PolarHBondContact O-N 3.07Å; M546-Q549 PolarHBondContact O-N 3.46Å; Q549-M552 PolarHBondContact O-N 3.2Å; Q549-G553 PolarHBondContact O-N 3.3Å; Q549-L592 HydrophobicContact CB-CD2 4.14Å; Q549-P595 HydrophobicContact CG-CB 4.4Å; Q549-P595 HydrophobicContact CG-CG 4.23Å
550	A	97.8	Very high	95.9	Very high	1 Å²	1	23.2 Å²	23.2	1%	0.008	13%	0.133	C	C	.	.	H	α-helix	trans	-69.5	-36.2	-179	0	0	0	0	0	112.3	V452 Q456 M546 T547 G553 A554	V452-A550 HydrophobicContact CB-CB 4.48Å; V452-A550 HydrophobicContact CG1-CB 3.77Å; Q456-A550 HydrophobicContact CB-CB 4.34Å; Q456-A550 VanDerWaalsContact OE1-CA 3.22Å; M546-A550 VanDerWaalsContact O-CB 3.31Å; M546-A550 WeakPolarHBondContact O-CB 3.45Å; M546-A550 PolarHBondContact O-N 2.78Å; T547-A550 PolarHBondContact O-N 3.19Å; A550-G553 PolarHBondContact O-N 3.27Å; A550-A554 PolarHBondContact O-N 3.1Å
551	T	98.3	Very high	95.3	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-58.8	-47.5	171.5	-59.2	0	0	0	0	111.2	Y535 L538 L539 T547 G553 A554 L555	Y535-T551 HydrophobicContact CD1-CG2 4.15Å; Y535-T551 HydrophobicContact CG-CG2 4.19Å; Y535-T551 WeakPolarHBondContact O-CG2 3.29Å; L538-T551 HydrophobicContact CB-CG2 4.32Å; L539-T551 HydrophobicContact CD2-CG2 3.47Å; L539-T551 VanDerWaalsContact CD2-CG2 3.47Å; L539-T551 HydrophobicContact CG-CG2 3.67Å; T547-T551 VanDerWaalsContact O-CB 3.23Å; T547-T551 WeakPolarHBondContact O-CB 3.27Å; T547-T551 PolarHBondContact O-N 3.48Å; T547-T551 PolarHBondContact O-OG1 2.97Å; T551-G553 VanDerWaalsContact C-N 3.34Å; T551-A554 PolarHBondContact O-N 3.27Å; T551-L555 HydrophobicContact CG2-CD1 4.49Å; T551-L555 WeakPolarHBondContact O-CG 3.47Å; T551-L555 PolarHBondContact O-N 2.93Å
552	M	98.2	Very high	94.5	Very high	0 Å²	0	31.2 Å²	31.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-66.3	-35.2	175	-71.5	-175.5	-75.3	0	0	112.3	L539 L548 Q549 Q556 I582 V585 L592 P595 A596 L599	L539-M552 HydrophobicContact CD1-CG 4.27Å; L539-M552 HydrophobicContact CD2-CG 3.7Å; L548-M552 WeakPolarHBondContact O-CE 3.47Å; L548-M552 WeakPolarHBondContact O-CG 3.49Å; L548-M552 PolarHBondContact O-N 3.37Å; Q549-M552 PolarHBondContact O-N 3.2Å; M552-Q556 WeakPolarHBondContact O-CB 3.32Å; M552-Q556 PolarHBondContact O-N 2.58Å; M552-I582 HydrophobicContact SD-CG2 4.41Å; M552-V585 HydrophobicContact CE-CG1 4.07Å; M552-L592 HydrophobicContact CE-CB 4.11Å; M552-L592 HydrophobicContact CE-CD1 4.2Å; M552-P595 HydrophobicContact CB-CB 4.27Å; M552-P595 HydrophobicContact CE-CB 4.25Å; M552-P595 HydrophobicContact CE-CG 4Å; M552-A596 HydrophobicContact SD-CB 3.81Å; M552-L599 HydrophobicContact CB-CD2 4.15Å; M552-L599 HydrophobicContact CG-CD2 4.07Å
553	G	97.9	Very high	94	Very high	1 Å²	1	32.3 Å²	32.3	1%	0.01	16%	0.161	C	C	.	.	H	α-helix	trans	-65.4	-41.5	175.5	0	0	0	0	0	113.5	Q549 A550 T551 Q556 N557	Q549-G553 PolarHBondContact O-N 3.3Å; A550-G553 PolarHBondContact O-N 3.27Å; T551-G553 VanDerWaalsContact C-N 3.34Å; G553-Q556 WeakPolarHBondContact O-CB 3.34Å; G553-Q556 PolarHBondContact O-N 2.72Å; G553-N557 WeakPolarHBondContact O-CB 3.27Å; G553-N557 PolarHBondContact O-N 3.15Å; G553-N557 PolarHBondContact O-ND2 3.4Å
554	A	98.4	Very high	93.4	Very high	0 Å²	0	31.1 Å²	31.1	0%	0	15%	0.148	C	C	.	.	H	α-helix	trans	-64.4	-47.9	175.9	0	0	0	0	0	111.1	Q456 Y535 A550 T551 Q556 N557 L558	Q456-A554 HydrophobicContact CB-CB 4.32Å; Y535-A554 HydrophobicContact CD2-CB 4.34Å; Y535-A554 HydrophobicContact CE1-CB 4.17Å; Y535-A554 HydrophobicContact CE2-CB 3.76Å; A550-A554 PolarHBondContact O-N 3.1Å; T551-A554 PolarHBondContact O-N 3.27Å; A554-Q556 VanDerWaalsContact C-N 3.29Å; A554-Q556 PolarHBondContact O-N 3.18Å; A554-N557 PolarHBondContact O-N 2.71Å; A554-L558 WeakPolarHBondContact O-CG 3.36Å; A554-L558 PolarHBondContact O-N 2.91Å
555	L	98.2	Very high	93.1	Very high	1 Å²	1	30.1 Å²	30.1	1%	0.005	14%	0.143	C	C	.	.	H	α-helix	trans	-62.8	-34.3	173.8	-66	173.4	0	0	0	112.1	V532 Y535 L536 L539 T551 T559 I573 L599	V532-L555 HydrophobicContact CG1-CD2 4.08Å; Y535-L555 HydrophobicContact CD2-CD2 3.84Å; Y535-L555 HydrophobicContact CD2-CG 4.17Å; Y535-L555 HydrophobicContact CG-CD2 4.4Å; Y535-L555 HydrophobicContact CG-CG 4.43Å; L536-L555 HydrophobicContact CD2-CD1 3.83Å; L536-L555 HydrophobicContact CG-CD1 4.24Å; L539-L555 HydrophobicContact CD1-CD1 4.04Å; T551-L555 HydrophobicContact CG2-CD1 4.49Å; T551-L555 WeakPolarHBondContact O-CG 3.47Å; T551-L555 PolarHBondContact O-N 2.93Å; L555-T559 WeakPolarHBondContact O-CB 2.87Å; L555-T559 WeakPolarHBondContact O-CG2 3.47Å; L555-T559 PolarHBondContact O-N 3.13Å; L555-T559 PolarHBondContact O-OG1 3.37Å; L555-I573 HydrophobicContact CD2-CD1 4.21Å; L555-L599 HydrophobicContact CB-CD1 3.86Å; L555-L599 HydrophobicContact CB-CD2 3.96Å; L555-L599 HydrophobicContact CD1-CD2 4.28Å
556	Q	96.9	Very high	92.9	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	12%	0.124	C	C	.	.	H	α-helix	trans	-63.2	-53.1	174.2	176.4	-170.5	-18.5	0	0	109.7	V102 M552 G553 A554 L558 T559 V560 L598 L599 N602	V102-Q556 PolarHBondContact O-NE2 3.25Å; M552-Q556 WeakPolarHBondContact O-CB 3.32Å; M552-Q556 PolarHBondContact O-N 2.58Å; G553-Q556 WeakPolarHBondContact O-CB 3.34Å; G553-Q556 PolarHBondContact O-N 2.72Å; A554-Q556 VanDerWaalsContact C-N 3.29Å; A554-Q556 PolarHBondContact O-N 3.18Å; Q556-L558 PolarHBondContact O-N 3.35Å; Q556-T559 CarbonylContact O-C 3.55Å; Q556-T559 PolarHBondContact O-N 3.32Å; Q556-T559 PolarHBondContact O-OG1 2.92Å; Q556-T559 VanDerWaalsContact O-OG1 3.09Å; Q556-V560 WeakPolarHBondContact O-CG2 3.45Å; Q556-V560 PolarHBondContact O-N 3.46Å; Q556-V560 VanDerWaalsContact O-N 3.11Å; Q556-L598 HydrophobicContact CG-CB 4.49Å; Q556-L599 HydrophobicContact CB-CB 4.47Å; Q556-N602 PolarHBondContact O-ND2 3.16Å
557	N	96.7	Very high	92.7	Very high	15 Å²	15	27.3 Å²	27.3	8%	0.08	13%	0.131	C	C	.	.	H	α-helix	trans	-56.1	-48.4	-179.4	-71	-14.7	0	0	0	111.4	Q456 G553 A554 T559 V560	Q456-N557 PolarHBondContact O-ND2 3.44Å; G553-N557 WeakPolarHBondContact O-CB 3.27Å; G553-N557 PolarHBondContact O-N 3.15Å; G553-N557 PolarHBondContact O-ND2 3.4Å; A554-N557 PolarHBondContact O-N 2.71Å; N557-T559 PolarHBondContact O-N 3.21Å; N557-V560 WeakPolarHBondContact O-CB 3.34Å; N557-V560 PolarHBondContact O-N 2.95Å
558	L	95.8	Very high	92.4	Very high	15 Å²	15	27.8 Å²	27.8	8%	0.079	13%	0.134	C	C	.	.	H	α-helix	trans	-62.2	-22.4	176.4	-69.3	171.3	0	0	0	114.3	T459 L526 W527 V532 Y535 A554 Q556 V569	T459-L558 HydrophobicContact CG2-CD1 4.21Å; T459-L558 HydrophobicContact CG2-CD2 3.93Å; T459-L558 HydrophobicContact CG2-CG 3.93Å; L526-L558 WeakPolarHBondContact O-CD1 3.25Å; L526-L558 WeakPolarHBondContact O-CD2 3.24Å; W527-L558 HydrophobicContact CB-CD2 3.89Å; V532-L558 HydrophobicContact CG2-CD1 4.28Å; Y535-L558 HydrophobicContact CE2-CD1 4.37Å; A554-L558 WeakPolarHBondContact O-CG 3.36Å; A554-L558 PolarHBondContact O-N 2.91Å; Q556-L558 PolarHBondContact O-N 3.35Å; L558-V569 HydrophobicContact CB-CG1 4.13Å; L558-V569 HydrophobicContact CB-CG2 4.35Å
559	T	94.4	Very high	92.2	Very high	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-107	14.3	179.2	58.7	0	0	0	0	113.2	L555 Q556 N557 V569 I573 N602 L603 R605	L555-T559 WeakPolarHBondContact O-CB 2.87Å; L555-T559 WeakPolarHBondContact O-CG2 3.47Å; L555-T559 PolarHBondContact O-N 3.13Å; L555-T559 PolarHBondContact O-OG1 3.37Å; Q556-T559 CarbonylContact O-C 3.55Å; Q556-T559 PolarHBondContact O-N 3.32Å; Q556-T559 PolarHBondContact O-OG1 2.92Å; Q556-T559 VanDerWaalsContact O-OG1 3.09Å; N557-T559 PolarHBondContact O-N 3.21Å; T559-V569 HydrophobicContact CG2-CB 4.43Å; T559-V569 HydrophobicContact CG2-CG1 3.76Å; T559-I573 HydrophobicContact CG2-CD1 4.07Å; T559-N602 WeakPolarHBondContact O-CB 3.39Å; T559-N602 PolarHBondContact O-ND2 3.12Å; T559-N602 WeakPolarHBondContact OG1-CB 3.35Å; T559-L603 HydrophobicContact CG2-CD2 3.95Å; T559-R605 PolarHBondContact O-NH2 3.32Å
560	V	89.8	Confident	92.1	Very high	23 Å²	23	25 Å²	25	14%	0.139	12%	0.121	C	C	.	.	S	Bend	trans	-66.6	-49.5	179.5	157.5	0	0	0	0	112.6	T101 C103 Q556 N557 R605	T101-V560 HydrophobicContact CG2-CG1 4.01Å; T101-V560 HydrophobicContact CG2-CG2 4.42Å; C103-V560 WeakPolarHBondContact SG-CG2 3.4Å; Q556-V560 WeakPolarHBondContact O-CG2 3.45Å; Q556-V560 PolarHBondContact O-N 3.46Å; Q556-V560 VanDerWaalsContact O-N 3.11Å; N557-V560 WeakPolarHBondContact O-CB 3.34Å; N557-V560 PolarHBondContact O-N 2.95Å; V560-R605 VanDerWaalsContact O-CZ 3.31Å; V560-R605 PolarHBondContact O-NH1 3.14Å; V560-R605 PolarHBondContact O-NH2 3.11Å
561	R	81.4	Confident	91.9	Very high	96 Å²	96	29 Å²	29	36%	0.362	14%	0.136	S	C	.	.	S	Bend	trans	-83.7	-178	-173	-87.8	131.6	147.5	-69.7	161.5	112.1	E463 E464 S566 R605	E463-R561 VanDerWaalsContact OE2-CD 3.27Å; E463-R561 WeakPolarHBondContact OE2-CD 3.41Å; E463-R561 IonicContact OE2-CZ 3.9Å; E463-R561 IonicContact OE2-NE 2.67Å; E463-R561 IonicContact OE2-NH2 3.4Å; E463-R561 PolarHBondContact OE2-NH2 3.3Å; E464-R561 VanDerWaalsContact CG-CZ 3.43Å; E464-R561 VanDerWaalsContact CG-NH1 3.27Å; E464-R561 IonicContact OE1-CZ 3.59Å; E464-R561 IonicContact OE1-NE 3.88Å; E464-R561 PolarHBondContact OE1-NE 3.29Å; E464-R561 VanDerWaalsContact OE1-NE 3.07Å; E464-R561 IonicContact OE1-NH1 3.63Å; E464-R561 PolarHBondContact OE1-NH1 2.86Å; E464-R561 IonicContact OE2-NH1 2.71Å; R561-S566 PolarHBondContact O-OG 2.99Å; R561-R605 PolarHBondContact O-NH2 3.39Å
562	K	76.6	Confident	91.8	Very high	176 Å²	176	29.2 Å²	29.2	77%	0.765	14%	0.137	S	C	*	.			trans	-119.4	126.8	159.8	-174.4	-176	179.2	-174.6	0	106.6	S566 E567	K562-S566 WeakPolarHBondContact CA-OG 3.26Å; K562-E567 WeakPolarHBondContact CE-OE1 3.42Å; K562-E567 WeakPolarHBondContact CG-OE1 3.47Å; K562-E567 IonicContact NZ-OE1 2.7Å
563	G	82.8	Confident	91.7	Very high	24 Å²	24	29.3 Å²	29.3	25%	0.247	14%	0.137	C	C	.	.	S	Bend	trans	160.1	168.9	-168.4	0	0	0	0	0	110.3	I565 S566 E567	G563-I565 VanDerWaalsContact C-N 3.33Å; G563-I565 PolarHBondContact O-N 3.22Å; G563-S566 PolarHBondContact N-OG 3.43Å; G563-S566 PolarHBondContact O-N 3.29Å; G563-S566 PolarHBondContact O-OG 3.37Å; G563-E567 PolarHBondContact O-N 3.03Å
564	E	83.2	Confident	91.6	Very high	76 Å²	76	30.9 Å²	30.9	36%	0.355	15%	0.15	S	C	.	.	H	α-helix	trans	-58.4	-38.7	-165.1	-54.8	-170.6	138.7	0	0	114.3	S568	E564-S568 WeakPolarHBondContact O-CB 3.39Å; E564-S568 PolarHBondContact O-N 3.14Å; E564-S568 PolarHBondContact O-OG 3.15Å
565	I	87.4	Confident	91.4	Very high	9 Å²	9	35.6 Å²	35.6	5%	0.046	17%	0.172	C	C	.	.	H	α-helix	trans	-60.8	-54.3	173.6	-62.8	179.7	0	0	0	109.7	E463 M510 L514 W527 G563 E567 S568 V569	E463-I565 HydrophobicContact CB-CD1 4.18Å; E463-I565 HydrophobicContact CG-CD1 3.92Å; M510-I565 HydrophobicContact CE-CD1 3.74Å; M510-I565 HydrophobicContact CE-CG1 4.2Å; M510-I565 HydrophobicContact CG-CG1 4.37Å; M510-I565 HydrophobicContact SD-CD1 3.86Å; M510-I565 HydrophobicContact SD-CG1 3.69Å; L514-I565 HydrophobicContact CD1-CG1 4.31Å; W527-I565 HydrophobicContact CB-CG2 3.64Å; W527-I565 HydrophobicContact CD2-CD1 3.99Å; W527-I565 HydrophobicContact CE3-CD1 4.28Å; W527-I565 HydrophobicContact CG-CD1 4.16Å; W527-I565 HydrophobicContact CG-CG2 4.18Å; G563-I565 VanDerWaalsContact C-N 3.33Å; G563-I565 PolarHBondContact O-N 3.22Å; I565-E567 VanDerWaalsContact C-N 3.33Å; I565-E567 PolarHBondContact O-N 2.94Å; I565-S568 PolarHBondContact O-N 3.12Å; I565-V569 HydrophobicContact CG2-CG2 4.19Å; I565-V569 WeakPolarHBondContact O-CB 3.22Å; I565-V569 VanDerWaalsContact O-CG2 3.24Å; I565-V569 WeakPolarHBondContact O-CG2 3.31Å; I565-V569 PolarHBondContact O-N 3.5Å
566	S	91.3	Very high	91.3	Very high	1 Å²	1	38.3 Å²	38.3	1%	0.007	19%	0.185	C	C	.	.	H	α-helix	trans	-63	-37	-176	68	0	0	0	0	113.2	R561 K562 G563 A570	R561-S566 PolarHBondContact O-OG 2.99Å; K562-S566 WeakPolarHBondContact CA-OG 3.26Å; G563-S566 PolarHBondContact N-OG 3.43Å; G563-S566 PolarHBondContact O-N 3.29Å; G563-S566 PolarHBondContact O-OG 3.37Å; S566-A570 VanDerWaalsContact O-CB 3.28Å; S566-A570 WeakPolarHBondContact O-CB 3.48Å; S566-A570 PolarHBondContact O-N 3.23Å
567	E	91.2	Very high	91.2	Very high	77 Å²	77	45.4 Å²	45.4	36%	0.36	22%	0.215	S	C	.	.	H	α-helix	trans	-72.6	-39.4	176.7	-72	177.3	-173.4	0	0	111.2	K562 G563 I565 A570 R571 F606	K562-E567 WeakPolarHBondContact CE-OE1 3.42Å; K562-E567 WeakPolarHBondContact CG-OE1 3.47Å; K562-E567 IonicContact NZ-OE1 2.7Å; G563-E567 PolarHBondContact O-N 3.03Å; I565-E567 VanDerWaalsContact C-N 3.33Å; I565-E567 PolarHBondContact O-N 2.94Å; E567-A570 PolarHBondContact O-N 2.77Å; E567-R571 WeakPolarHBondContact O-CB 3.48Å; E567-R571 PolarHBondContact O-N 3.1Å; E567-F606 HydrophobicContact CB-CE1 4.44Å; E567-F606 HydrophobicContact CG-CD1 4.27Å; E567-F606 HydrophobicContact CG-CE1 3.74Å
568	S	90.3	Very high	91.1	Very high	9 Å²	9	44.7 Å²	44.7	6%	0.063	21%	0.212	C	C	.	.	H	α-helix	trans	-68.2	-38.6	174.6	-66.8	0	0	0	0	113	E564 I565 R571 I572	E564-S568 WeakPolarHBondContact O-CB 3.39Å; E564-S568 PolarHBondContact O-N 3.14Å; E564-S568 PolarHBondContact O-OG 3.15Å; I565-S568 PolarHBondContact O-N 3.12Å; S568-R571 VanDerWaalsContact CB-NH2 3.29Å; S568-R571 PolarHBondContact O-N 3.35Å; S568-R571 PolarHBondContact OG-NH2 3.26Å; S568-I572 WeakPolarHBondContact O-CG1 3.46Å; S568-I572 PolarHBondContact O-N 3.4Å
569	V	93.6	Very high	91.1	Very high	1 Å²	1	44 Å²	44	1%	0.006	21%	0.208	C	C	.	.	H	α-helix	trans	-66.4	-43.1	173.4	172.5	0	0	0	0	110.5	V532 L558 T559 I565 R571 I572 I573	V532-V569 HydrophobicContact CG1-CG1 4.32Å; V532-V569 HydrophobicContact CG2-CG1 4.34Å; V532-V569 HydrophobicContact CG2-CG2 4.13Å; L558-V569 HydrophobicContact CB-CG1 4.13Å; L558-V569 HydrophobicContact CB-CG2 4.35Å; T559-V569 HydrophobicContact CG2-CB 4.43Å; T559-V569 HydrophobicContact CG2-CG1 3.76Å; I565-V569 HydrophobicContact CG2-CG2 4.19Å; I565-V569 WeakPolarHBondContact O-CB 3.22Å; I565-V569 VanDerWaalsContact O-CG2 3.24Å; I565-V569 WeakPolarHBondContact O-CG2 3.31Å; I565-V569 PolarHBondContact O-N 3.5Å; V569-R571 PolarHBondContact O-N 3Å; V569-I572 PolarHBondContact O-N 3.28Å; V569-I573 HydrophobicContact CG1-CD1 3.74Å; V569-I573 HydrophobicContact CG1-CG1 4.41Å; V569-I573 WeakPolarHBondContact O-CB 3.43Å; V569-I573 WeakPolarHBondContact O-CG1 3.12Å; V569-I573 PolarHBondContact O-N 2.94Å
570	A	94.8	Very high	91	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-61	-42.2	175.5	0	0	0	0	0	112.5	S566 E567 I573 A574 F606 L609	S566-A570 VanDerWaalsContact O-CB 3.28Å; S566-A570 WeakPolarHBondContact O-CB 3.48Å; S566-A570 PolarHBondContact O-N 3.23Å; E567-A570 PolarHBondContact O-N 2.77Å; A570-I573 CarbonylContact O-C 3.57Å; A570-I573 WeakPolarHBondContact O-CB 3.34Å; A570-I573 PolarHBondContact O-N 3.46Å; A570-A574 PolarHBondContact O-N 3.39Å; A570-F606 HydrophobicContact CB-CB 4.18Å; A570-F606 HydrophobicContact CB-CD1 3.58Å; A570-F606 HydrophobicContact CB-CD2 3.72Å; A570-F606 HydrophobicContact CB-CE1 3.8Å; A570-F606 HydrophobicContact CB-CE2 3.92Å; A570-F606 HydrophobicContact CB-CG 3.55Å; A570-F606 HydrophobicContact CB-CZ 3.97Å; A570-L609 HydrophobicContact CB-CD1 4.23Å
571	R	94	Very high	91.2	Very high	86 Å²	86	49.1 Å²	49.1	33%	0.325	23%	0.226	S	C	.	.	H	α-helix	trans	-58.7	-47.9	173.3	170.8	173.3	53.8	77	-4.4	112.5	L514 E567 S568 V569 I573 A574 E575	L514-R571 PolarHBondContact O-NH2 2.81Å; L514-R571 VanDerWaalsContact O-NH2 3.16Å; E567-R571 WeakPolarHBondContact O-CB 3.48Å; E567-R571 PolarHBondContact O-N 3.1Å; S568-R571 VanDerWaalsContact CB-NH2 3.29Å; S568-R571 PolarHBondContact O-N 3.35Å; S568-R571 PolarHBondContact OG-NH2 3.26Å; V569-R571 PolarHBondContact O-N 3Å; R571-I573 VanDerWaalsContact C-N 3.32Å; R571-I573 PolarHBondContact O-N 3.04Å; R571-A574 WeakPolarHBondContact O-CB 3.37Å; R571-A574 PolarHBondContact O-N 3.43Å; R571-A574 VanDerWaalsContact O-N 3.08Å; R571-E575 WeakPolarHBondContact CG-OE1 3.4Å; R571-E575 IonicContact NH1-OE1 3.81Å; R571-E575 WeakPolarHBondContact O-CG 3.43Å; R571-E575 PolarHBondContact O-N 3.32Å
572	I	94.9	Very high	91.8	Very high	4 Å²	4	44.6 Å²	44.6	2%	0.021	21%	0.209	C	C	.	.	H	α-helix	trans	-63.5	-38.8	175.7	-65.7	171.4	0	0	0	111	V532 R533 S568 V569 A574 E575 E576	V532-I572 HydrophobicContact CB-CG2 4.34Å; V532-I572 HydrophobicContact CG1-CB 4.19Å; V532-I572 HydrophobicContact CG1-CG2 3.68Å; R533-I572 HydrophobicContact CG-CG2 3.84Å; S568-I572 WeakPolarHBondContact O-CG1 3.46Å; S568-I572 PolarHBondContact O-N 3.4Å; V569-I572 PolarHBondContact O-N 3.28Å; I572-A574 VanDerWaalsContact C-N 3.26Å; I572-A574 PolarHBondContact O-N 2.88Å; I572-E575 PolarHBondContact O-N 3.45Å; I572-E576 HydrophobicContact CG2-CG 4.41Å; I572-E576 VanDerWaalsContact O-CB 3.26Å; I572-E576 WeakPolarHBondContact O-CB 3.41Å; I572-E576 WeakPolarHBondContact O-CG 3.39Å; I572-E576 PolarHBondContact O-N 3.02Å
573	I	96.7	Very high	92.5	Very high	1 Å²	1	36.3 Å²	36.3	1%	0.005	17%	0.173	C	C	.	.	H	α-helix	trans	-62.3	-32.8	174.1	-70.2	169	0	0	0	111.5	V532 L536 L555 T559 V569 A570 R571 K577 G578 L603 L609	V532-I573 HydrophobicContact CG1-CG1 4.42Å; L536-I573 HydrophobicContact CD1-CB 4.48Å; L536-I573 HydrophobicContact CD1-CG1 3.88Å; L536-I573 HydrophobicContact CD2-CG1 4.26Å; L555-I573 HydrophobicContact CD2-CD1 4.21Å; T559-I573 HydrophobicContact CG2-CD1 4.07Å; V569-I573 HydrophobicContact CG1-CD1 3.74Å; V569-I573 HydrophobicContact CG1-CG1 4.41Å; V569-I573 WeakPolarHBondContact O-CB 3.43Å; V569-I573 WeakPolarHBondContact O-CG1 3.12Å; V569-I573 PolarHBondContact O-N 2.94Å; A570-I573 CarbonylContact O-C 3.57Å; A570-I573 WeakPolarHBondContact O-CB 3.34Å; A570-I573 PolarHBondContact O-N 3.46Å; R571-I573 VanDerWaalsContact C-N 3.32Å; R571-I573 PolarHBondContact O-N 3.04Å; I573-K577 PolarHBondContact O-N 3.22Å; I573-G578 WeakPolarHBondContact O-CA 3.47Å; I573-G578 PolarHBondContact O-N 3.36Å; I573-L603 HydrophobicContact CD1-CD2 3.73Å; I573-L603 HydrophobicContact CG2-CD1 3.88Å; I573-L603 HydrophobicContact CG2-CD2 4Å; I573-L609 HydrophobicContact CG2-CD1 4.35Å; I573-L609 HydrophobicContact CG2-CD2 4.35Å
574	A	95.1	Very high	92.9	Very high	34 Å²	34	36.1 Å²	36.1	28%	0.281	17%	0.169	S	C	.	.	H	α-helix	trans	-71.3	-50.5	174.4	0	0	0	0	0	112.2	A570 R571 I572 E576 K577 L609	A570-A574 PolarHBondContact O-N 3.39Å; R571-A574 WeakPolarHBondContact O-CB 3.37Å; R571-A574 PolarHBondContact O-N 3.43Å; R571-A574 VanDerWaalsContact O-N 3.08Å; I572-A574 VanDerWaalsContact C-N 3.26Å; I572-A574 PolarHBondContact O-N 2.88Å; A574-E576 PolarHBondContact O-N 3.36Å; A574-K577 PolarHBondContact O-N 2.84Å; A574-K577 VanDerWaalsContact O-N 3.08Å; A574-L609 HydrophobicContact CB-CD2 3.56Å; A574-L609 HydrophobicContact CB-CG 4.15Å
575	E	94.6	Very high	93.2	Very high	100 Å²	100	32.6 Å²	32.6	47%	0.467	15%	0.153	S	C	.	.	H	α-helix	trans	-49.7	-47.2	174.1	-68.1	164.1	-158.4	0	0	111.2	R533 R571 I572 K577	R533-E575 IonicContact CZ-OE2 2.71Å; R533-E575 IonicContact NH2-OE2 3.24Å; R533-E575 PolarHBondContact NH2-OE2 3.27Å; R571-E575 WeakPolarHBondContact CG-OE1 3.4Å; R571-E575 IonicContact NH1-OE1 3.81Å; R571-E575 WeakPolarHBondContact O-CG 3.43Å; R571-E575 PolarHBondContact O-N 3.32Å; I572-E575 PolarHBondContact O-N 3.45Å; E575-K577 VanDerWaalsContact C-N 3.29Å; E575-K577 PolarHBondContact O-N 3Å
576	E	95.1	Very high	93.3	Very high	58 Å²	58	32.7 Å²	32.7	27%	0.271	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.9	6.1	-176.8	-78.8	-67	158.7	0	0	115.1	R533 L536 I572 A574 G578 K581	R533-E576 HydrophobicContact CG-CG 3.98Å; R533-E576 IonicContact NE-OE1 2.9Å; L536-E576 HydrophobicContact CB-CB 4.45Å; L536-E576 HydrophobicContact CD1-CB 3.64Å; L536-E576 HydrophobicContact CD1-CG 3.95Å; I572-E576 HydrophobicContact CG2-CG 4.41Å; I572-E576 VanDerWaalsContact O-CB 3.26Å; I572-E576 WeakPolarHBondContact O-CB 3.41Å; I572-E576 WeakPolarHBondContact O-CG 3.39Å; I572-E576 PolarHBondContact O-N 3.02Å; A574-E576 PolarHBondContact O-N 3.36Å; E576-G578 PolarHBondContact O-N 2.82Å; E576-K581 WeakPolarHBondContact O-CD 3.23Å; E576-K581 WeakPolarHBondContact O-CE 3.45Å; E576-K581 PolarHBondContact O-NZ 3.27Å; E576-K581 IonicContact OE2-NZ 2.65Å; E576-K581 PolarHBondContact OE2-NZ 3.42Å
577	K	94.9	Very high	93	Very high	148 Å²	148	36.4 Å²	36.4	64%	0.643	17%	0.171	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.1	38.3	-179.2	-54.3	178.4	-177.2	177.9	0	113.1	I573 A574 E575 R580 K581	I573-K577 PolarHBondContact O-N 3.22Å; A574-K577 PolarHBondContact O-N 2.84Å; A574-K577 VanDerWaalsContact O-N 3.08Å; E575-K577 VanDerWaalsContact C-N 3.29Å; E575-K577 PolarHBondContact O-N 3Å; K577-R580 PolarHBondContact O-N 3.05Å; K577-K581 PolarHBondContact O-N 3.27Å
578	G	95.8	Very high	92.8	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-49.1	-44.4	-176.2	0	0	0	0	0	115.5	I573 E576 R580 K581 I582	I573-G578 WeakPolarHBondContact O-CA 3.47Å; I573-G578 PolarHBondContact O-N 3.36Å; E576-G578 PolarHBondContact O-N 2.82Å; G578-R580 VanDerWaalsContact C-N 3.29Å; G578-R580 PolarHBondContact O-N 2.95Å; G578-K581 WeakPolarHBondContact O-CA 3.49Å; G578-K581 WeakPolarHBondContact O-CB 3.28Å; G578-K581 PolarHBondContact O-N 2.92Å; G578-I582 WeakPolarHBondContact O-CG1 3.44Å; G578-I582 PolarHBondContact O-N 3Å
579	P	94.5	Very high	92.6	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-55.9	-38.1	176.1	-29.9	38.1	0	0	0	114	I582 T583 M600 L609 I613 N616	P579-I582 PolarHBondContact O-N 2.69Å; P579-T583 PolarHBondContact O-N 3.48Å; P579-T583 PolarHBondContact O-OG1 3.5Å; P579-T583 VanDerWaalsContact O-OG1 3.13Å; P579-M600 HydrophobicContact CB-CE 4.23Å; P579-M600 HydrophobicContact CB-SD 4.32Å; P579-L609 HydrophobicContact CG-CD2 4.01Å; P579-I613 HydrophobicContact CB-CG1 4.16Å; P579-I613 HydrophobicContact CG-CG1 3.82Å; P579-N616 HydrophobicContact CB-CB 4.32Å
580	R	92.8	Very high	92.1	Very high	96 Å²	96	43 Å²	43	36%	0.362	20%	0.2	S	C	.	.	H	α-helix	trans	-67	-39.4	174.4	-177.7	65.6	-160.1	143.4	12.8	111.8	K577 G578 T583 A584 E587 N616	K577-R580 PolarHBondContact O-N 3.05Å; G578-R580 VanDerWaalsContact C-N 3.29Å; G578-R580 PolarHBondContact O-N 2.95Å; R580-T583 PolarHBondContact O-N 3.36Å; R580-A584 VanDerWaalsContact O-CB 3.28Å; R580-A584 WeakPolarHBondContact O-CB 3.4Å; R580-A584 PolarHBondContact O-N 3.49Å; R580-E587 IonicContact CZ-OE1 2.84Å; R580-E587 VanDerWaalsContact CZ-OE1 3.24Å; R580-E587 IonicContact CZ-OE2 3.47Å; R580-E587 IonicContact NH1-OE1 4Å; R580-E587 PolarHBondContact NH1-OE1 3.02Å; R580-E587 IonicContact NH1-OE2 2.67Å; R580-E587 VanDerWaalsContact NH2-CD 3.28Å; R580-E587 IonicContact NH2-OE1 3.81Å; R580-E587 PolarHBondContact NH2-OE1 2.97Å; R580-E587 IonicContact NH2-OE2 3.57Å; R580-E587 PolarHBondContact NH2-OE2 3.36Å; R580-N616 WeakPolarHBondContact CA-OD1 3.47Å; R580-N616 WeakPolarHBondContact CB-OD1 3.38Å; R580-N616 WeakPolarHBondContact CD-OD1 3.41Å
581	K	94.8	Very high	91.8	Very high	36 Å²	36	47.3 Å²	47.3	16%	0.157	23%	0.227	C	C	.	.	H	α-helix	trans	-63.7	-43.5	177	-68.9	163.2	164.1	171.6	0	111	L536 L539 A540 E576 K577 G578 A584 V585	L536-K581 HydrophobicContact CB-CD 4.23Å; L536-K581 VanDerWaalsContact O-CD 3.32Å; L536-K581 WeakPolarHBondContact O-CD 3.3Å; L536-K581 WeakPolarHBondContact O-CE 3.27Å; L539-K581 HydrophobicContact CB-CB 4.25Å; A540-K581 HydrophobicContact CB-CG 4.47Å; E576-K581 WeakPolarHBondContact O-CD 3.23Å; E576-K581 WeakPolarHBondContact O-CE 3.45Å; E576-K581 PolarHBondContact O-NZ 3.27Å; E576-K581 IonicContact OE2-NZ 2.65Å; E576-K581 PolarHBondContact OE2-NZ 3.42Å; K577-K581 PolarHBondContact O-N 3.27Å; G578-K581 WeakPolarHBondContact O-CA 3.49Å; G578-K581 WeakPolarHBondContact O-CB 3.28Å; G578-K581 PolarHBondContact O-N 2.92Å; K581-A584 PolarHBondContact O-N 3.02Å; K581-V585 PolarHBondContact O-N 3.18Å
582	I	94.2	Very high	91.6	Very high	1 Å²	1	43.3 Å²	43.3	1%	0.005	21%	0.212	C	C	.	.	H	α-helix	trans	-64.4	-46.9	176	-61.7	160.4	0	0	0	111.1	L539 M552 G578 P579 A584 V585 L586 A596 L599 M600 L603	L539-I582 HydrophobicContact CD1-CG1 3.95Å; M552-I582 HydrophobicContact SD-CG2 4.41Å; G578-I582 WeakPolarHBondContact O-CG1 3.44Å; G578-I582 PolarHBondContact O-N 3Å; P579-I582 PolarHBondContact O-N 2.69Å; I582-A584 VanDerWaalsContact C-N 3.33Å; I582-A584 PolarHBondContact O-N 3.03Å; I582-V585 WeakPolarHBondContact O-CB 3.33Å; I582-V585 PolarHBondContact O-N 2.87Å; I582-V585 VanDerWaalsContact O-N 3.13Å; I582-L586 PolarHBondContact O-N 3.01Å; I582-A596 HydrophobicContact CG2-CB 3.77Å; I582-L599 HydrophobicContact CD1-CD2 3.54Å; I582-L599 HydrophobicContact CD1-CG 3.89Å; I582-L599 HydrophobicContact CG1-CD2 4.03Å; I582-M600 HydrophobicContact CB-SD 4.41Å; I582-M600 HydrophobicContact CD1-CG 4.34Å; I582-M600 HydrophobicContact CD1-SD 3.83Å; I582-M600 HydrophobicContact CG2-CG 3.92Å; I582-M600 HydrophobicContact CG2-SD 4.27Å; I582-L603 HydrophobicContact CD1-CD1 3.77Å
583	T	90.4	Very high	91.3	Very high	2 Å²	2	44 Å²	44	1%	0.012	22%	0.215	C	C	.	.	H	α-helix	trans	-60.4	-41.7	175.4	-61.5	0	0	0	0	111.6	P579 R580 V585 L586 E587 N616 S625	P579-T583 PolarHBondContact O-N 3.48Å; P579-T583 PolarHBondContact O-OG1 3.5Å; P579-T583 VanDerWaalsContact O-OG1 3.13Å; R580-T583 PolarHBondContact O-N 3.36Å; T583-V585 PolarHBondContact O-N 2.63Å; T583-L586 WeakPolarHBondContact O-CA 3.47Å; T583-L586 WeakPolarHBondContact O-CB 3.45Å; T583-L586 PolarHBondContact O-N 2.84Å; T583-E587 HydrophobicContact CG2-CG 4.24Å; T583-E587 WeakPolarHBondContact CG2-OE1 3.32Å; T583-E587 WeakPolarHBondContact O-CG 3.35Å; T583-E587 PolarHBondContact O-N 3.38Å; T583-N616 VanDerWaalsContact CG2-O 3.22Å; T583-N616 WeakPolarHBondContact CG2-O 3.41Å; T583-N616 PolarHBondContact OG1-O 2.9Å; T583-S625 WeakPolarHBondContact CG2-OG 3.41Å
584	A	90.8	Very high	91	Very high	20 Å²	20	47.8 Å²	47.8	17%	0.165	23%	0.231	C	C	.	.	H	α-helix	trans	-65.5	-20.2	177.5	0	0	0	0	0	114	R580 K581 I582 K588	R580-A584 VanDerWaalsContact O-CB 3.28Å; R580-A584 WeakPolarHBondContact O-CB 3.4Å; R580-A584 PolarHBondContact O-N 3.49Å; K581-A584 PolarHBondContact O-N 3.02Å; I582-A584 VanDerWaalsContact C-N 3.33Å; I582-A584 PolarHBondContact O-N 3.03Å; A584-K588 VanDerWaalsContact O-CD 3.26Å; A584-K588 WeakPolarHBondContact O-CD 3.28Å; A584-K588 WeakPolarHBondContact O-CE 3.36Å; A584-K588 VanDerWaalsContact O-CG 3.23Å; A584-K588 WeakPolarHBondContact O-CG 3.44Å
585	V	91.1	Very high	91	Very high	2 Å²	2	46.8 Å²	46.8	1%	0.012	22%	0.222	C	C	.	.	H	α-helix	trans	-74.3	-41.1	168.5	169.9	0	0	0	0	110.7	L539 L548 M552 K581 I582 T583 K588 N589 L592	L539-V585 HydrophobicContact CB-CG2 4.33Å; L539-V585 HydrophobicContact CD2-CG2 4.47Å; L539-V585 VanDerWaalsContact O-CG2 3.28Å; L539-V585 WeakPolarHBondContact O-CG2 3.39Å; L548-V585 HydrophobicContact CD1-CG1 4.21Å; L548-V585 HydrophobicContact CD2-CG1 4.5Å; L548-V585 HydrophobicContact CD2-CG2 3.82Å; M552-V585 HydrophobicContact CE-CG1 4.07Å; K581-V585 PolarHBondContact O-N 3.18Å; I582-V585 WeakPolarHBondContact O-CB 3.33Å; I582-V585 PolarHBondContact O-N 2.87Å; I582-V585 VanDerWaalsContact O-N 3.13Å; T583-V585 PolarHBondContact O-N 2.63Å; V585-K588 PolarHBondContact O-N 2.78Å; V585-N589 WeakPolarHBondContact O-CB 3.49Å; V585-N589 PolarHBondContact O-N 3.14Å; V585-L592 HydrophobicContact CG1-CB 4.42Å; V585-L592 HydrophobicContact CG1-CD1 3.61Å
586	L	87.9	Confident	90.9	Very high	10 Å²	10	42 Å²	42	5%	0.052	20%	0.2	C	C	.	.	H	α-helix	trans	-69.3	-41.2	178	-66.8	173.8	0	0	0	113.1	I582 T583 K588 N589 K593 A596 L629	I582-L586 PolarHBondContact O-N 3.01Å; T583-L586 WeakPolarHBondContact O-CA 3.47Å; T583-L586 WeakPolarHBondContact O-CB 3.45Å; T583-L586 PolarHBondContact O-N 2.84Å; L586-K588 PolarHBondContact O-N 3.31Å; L586-N589 PolarHBondContact O-N 3.44Å; L586-N589 VanDerWaalsContact O-N 3.16Å; L586-K593 HydrophobicContact CD2-CB 4.33Å; L586-A596 HydrophobicContact CD1-CB 3.75Å; L586-A596 HydrophobicContact CD2-CB 3.69Å; L586-A596 HydrophobicContact CG-CB 3.84Å; L586-L629 HydrophobicContact CD1-CD1 4Å; L586-L629 HydrophobicContact CD1-CD2 4Å; L586-L629 HydrophobicContact CD1-CG 4.34Å; L586-L629 HydrophobicContact CD2-CD2 4.43Å
587	E	85.9	Confident	90.8	Very high	80 Å²	80	39.4 Å²	39.4	37%	0.374	19%	0.187	S	C	.	.	H	α-helix	trans	-53.7	-32.7	172.3	-73.7	170.3	-171.2	0	0	112	R580 T583	R580-E587 IonicContact CZ-OE1 2.84Å; R580-E587 VanDerWaalsContact CZ-OE1 3.24Å; R580-E587 IonicContact CZ-OE2 3.47Å; R580-E587 IonicContact NH1-OE1 4Å; R580-E587 PolarHBondContact NH1-OE1 3.02Å; R580-E587 IonicContact NH1-OE2 2.67Å; R580-E587 VanDerWaalsContact NH2-CD 3.28Å; R580-E587 IonicContact NH2-OE1 3.81Å; R580-E587 PolarHBondContact NH2-OE1 2.97Å; R580-E587 IonicContact NH2-OE2 3.57Å; R580-E587 PolarHBondContact NH2-OE2 3.36Å; T583-E587 HydrophobicContact CG2-CG 4.24Å; T583-E587 WeakPolarHBondContact CG2-OE1 3.32Å; T583-E587 WeakPolarHBondContact O-CG 3.35Å; T583-E587 PolarHBondContact O-N 3.38Å
588	K	86.8	Confident	90.8	Very high	133 Å²	133	32.4 Å²	32.4	58%	0.578	16%	0.157	S	C	*	.	H	α-helix	trans	-90.5	-29.7	178.1	-64.3	168.7	-169.4	171.6	0	113.9	A584 V585 L586	A584-K588 VanDerWaalsContact O-CD 3.26Å; A584-K588 WeakPolarHBondContact O-CD 3.28Å; A584-K588 WeakPolarHBondContact O-CE 3.36Å; A584-K588 VanDerWaalsContact O-CG 3.23Å; A584-K588 WeakPolarHBondContact O-CG 3.44Å; V585-K588 PolarHBondContact O-N 2.78Å; L586-K588 PolarHBondContact O-N 3.31Å
589	N	85.1	Confident	90.8	Very high	30 Å²	30	32.4 Å²	32.4	16%	0.16	16%	0.157	C	C	.	.			trans	-154.4	68.9	-159.1	-143.3	-30.9	0	0	0	113.2	K545 V585 L586 T591 L592	K545-N589 WeakPolarHBondContact CE-OD1 3.37Å; K545-N589 PolarHBondContact NZ-OD1 3.09Å; V585-N589 WeakPolarHBondContact O-CB 3.49Å; V585-N589 PolarHBondContact O-N 3.14Å; L586-N589 PolarHBondContact O-N 3.44Å; L586-N589 VanDerWaalsContact O-N 3.16Å; N589-T591 PolarHBondContact O-N 3.2Å; N589-T591 PolarHBondContact OD1-OG1 3.41Å; N589-L592 HydrophobicContact CB-CD1 4.21Å; N589-L592 WeakPolarHBondContact O-CB 3.22Å; N589-L592 PolarHBondContact O-N 2.94Å
590	I	84.3	Confident	90.8	Very high	62 Å²	62	32.6 Å²	32.6	32%	0.318	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-57.1	-20.4	-172	-167.2	54	0	0	0	115.5	L592 K593 H628 L629	I590-L592 PolarHBondContact O-N 3.46Å; I590-K593 HydrophobicContact CD1-CB 4.23Å; I590-K593 HydrophobicContact CD1-CD 4.47Å; I590-K593 WeakPolarHBondContact O-CB 3.35Å; I590-K593 WeakPolarHBondContact O-CG 3.35Å; I590-K593 PolarHBondContact O-N 2.9Å; I590-H628 HydrophobicContact CD1-CB 3.8Å; I590-H628 HydrophobicContact CG1-CB 4.27Å; I590-L629 HydrophobicContact CD1-CD2 4.3Å
591	T	87.4	Confident	90.9	Very high	90 Å²	90	29.6 Å²	29.6	55%	0.552	15%	0.147	S	C	*	.	G	3₁₀ helix	trans	-61.1	-15.1	172.5	60.5	0	0	0	0	113.4	K545 N589 K593	K545-T591 PolarHBondContact NZ-OG1 3.29Å; N589-T591 PolarHBondContact O-N 3.2Å; N589-T591 PolarHBondContact OD1-OG1 3.41Å; T591-K593 VanDerWaalsContact C-N 3.32Å
592	L	90.3	Very high	91	Very high	3 Å²	3	28 Å²	28	2%	0.016	14%	0.14	C	C	.	.	G	3₁₀ helix	trans	-89.9	13.2	175.7	-60.7	178.3	0	0	0	113.5	L548 Q549 M552 V585 N589 I590 K594 P595 A596	L548-L592 HydrophobicContact CB-CD1 3.85Å; L548-L592 HydrophobicContact CD1-CD1 4.08Å; Q549-L592 HydrophobicContact CB-CD2 4.14Å; M552-L592 HydrophobicContact CE-CB 4.11Å; M552-L592 HydrophobicContact CE-CD1 4.2Å; V585-L592 HydrophobicContact CG1-CB 4.42Å; V585-L592 HydrophobicContact CG1-CD1 3.61Å; N589-L592 HydrophobicContact CB-CD1 4.21Å; N589-L592 WeakPolarHBondContact O-CB 3.22Å; N589-L592 PolarHBondContact O-N 2.94Å; I590-L592 PolarHBondContact O-N 3.46Å; L592-K594 VanDerWaalsContact C-N 3.31Å; L592-K594 PolarHBondContact O-N 2.92Å; L592-P595 HydrophobicContact CB-CG 4.35Å; L592-P595 HydrophobicContact CD2-CG 4.4Å; L592-P595 VanDerWaalsContact O-CD 3.24Å; L592-P595 WeakPolarHBondContact O-CD 3.39Å; L592-P595 WeakPolarHBondContact O-CG 3.4Å; L592-A596 WeakPolarHBondContact O-CB 3.39Å; L592-A596 PolarHBondContact O-N 3.32Å
593	K	89.6	Confident	91.1	Very high	18 Å²	18	28 Å²	28	8%	0.078	14%	0.14	C	C	.	.	H	α-helix	trans	-52.9	-41.8	178.3	58.1	-174.1	179.1	-178.9	0	114.1	L586 I590 T591 L597 L629 D631 E636 L640	L586-K593 HydrophobicContact CD2-CB 4.33Å; I590-K593 HydrophobicContact CD1-CB 4.23Å; I590-K593 HydrophobicContact CD1-CD 4.47Å; I590-K593 WeakPolarHBondContact O-CB 3.35Å; I590-K593 WeakPolarHBondContact O-CG 3.35Å; I590-K593 PolarHBondContact O-N 2.9Å; T591-K593 VanDerWaalsContact C-N 3.32Å; K593-L597 VanDerWaalsContact O-CB 3.27Å; K593-L597 WeakPolarHBondContact O-CB 3.43Å; K593-L597 VanDerWaalsContact O-CG 3.25Å; K593-L597 WeakPolarHBondContact O-CG 3.37Å; K593-L597 PolarHBondContact O-N 3.47Å; K593-L629 HydrophobicContact CB-CD2 3.54Å; K593-D631 PolarHBondContact NZ-O 3.24Å; K593-E636 VanDerWaalsContact CE-CD 3.47Å; K593-E636 WeakPolarHBondContact CE-OE1 3.28Å; K593-E636 WeakPolarHBondContact CE-OE2 3.2Å; K593-E636 VanDerWaalsContact NZ-CD 3.25Å; K593-E636 IonicContact NZ-OE1 2.63Å; K593-E636 PolarHBondContact NZ-OE1 3.02Å; K593-E636 VanDerWaalsContact NZ-OE1 3.12Å; K593-E636 IonicContact NZ-OE2 3.43Å; K593-E636 PolarHBondContact NZ-OE2 3.33Å; K593-L640 HydrophobicContact CD-CD1 3.75Å; K593-L640 HydrophobicContact CG-CD1 3.85Å
594	K	90.6	Very high	91.3	Very high	81 Å²	81	27.9 Å²	27.9	35%	0.352	14%	0.139	S	C	.	.	H	α-helix	trans	-61.9	-59.7	-179.7	-176.2	171.9	179	166.6	0	114	L592 A596 L597 L598 E639 L640	L592-K594 VanDerWaalsContact C-N 3.31Å; L592-K594 PolarHBondContact O-N 2.92Å; K594-A596 VanDerWaalsContact C-N 3.32Å; K594-A596 PolarHBondContact O-N 3.05Å; K594-L597 PolarHBondContact O-N 3.48Å; K594-L598 HydrophobicContact CG-CD1 4.07Å; K594-L598 WeakPolarHBondContact O-CG 3.47Å; K594-L598 PolarHBondContact O-N 2.93Å; K594-E639 WeakPolarHBondContact CD-OE2 3.4Å; K594-E639 VanDerWaalsContact CE-CD 3.46Å; K594-E639 WeakPolarHBondContact CE-OE1 3.32Å; K594-E639 WeakPolarHBondContact CE-OE2 3.49Å; K594-E639 IonicContact NZ-OE1 3.27Å; K594-E639 PolarHBondContact NZ-OE1 2.81Å; K594-E639 IonicContact NZ-OE2 3.31Å; K594-E639 PolarHBondContact NZ-OE2 3.38Å; K594-L640 HydrophobicContact CB-CD2 3.97Å; K594-L640 HydrophobicContact CG-CD2 4.12Å
595	P	93.7	Very high	91.4	Very high	13 Å²	13	31.7 Å²	31.7	8%	0.084	15%	0.149	C	C	.	.	H	α-helix	trans	-62.9	-36.3	179	23.6	-34.1	0	0	0	113	Q549 M552 L592 L598 L599	Q549-P595 HydrophobicContact CG-CB 4.4Å; Q549-P595 HydrophobicContact CG-CG 4.23Å; M552-P595 HydrophobicContact CB-CB 4.27Å; M552-P595 HydrophobicContact CE-CB 4.25Å; M552-P595 HydrophobicContact CE-CG 4Å; L592-P595 HydrophobicContact CB-CG 4.35Å; L592-P595 HydrophobicContact CD2-CG 4.4Å; L592-P595 VanDerWaalsContact O-CD 3.24Å; L592-P595 WeakPolarHBondContact O-CD 3.39Å; L592-P595 WeakPolarHBondContact O-CG 3.4Å; P595-L598 PolarHBondContact O-N 3.23Å; P595-L599 PolarHBondContact O-N 3.04Å
596	A	93.5	Very high	91.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.1	-45.5	176.5	0	0	0	0	0	112.4	M552 I582 L586 L592 K594 L599 M600	M552-A596 HydrophobicContact SD-CB 3.81Å; I582-A596 HydrophobicContact CG2-CB 3.77Å; L586-A596 HydrophobicContact CD1-CB 3.75Å; L586-A596 HydrophobicContact CD2-CB 3.69Å; L586-A596 HydrophobicContact CG-CB 3.84Å; L592-A596 WeakPolarHBondContact O-CB 3.39Å; L592-A596 PolarHBondContact O-N 3.32Å; K594-A596 VanDerWaalsContact C-N 3.32Å; K594-A596 PolarHBondContact O-N 3.05Å; A596-L599 PolarHBondContact O-N 2.87Å; A596-M600 WeakPolarHBondContact O-CB 3.13Å; A596-M600 WeakPolarHBondContact O-CG 3.15Å; A596-M600 PolarHBondContact O-N 2.93Å
597	L	92.4	Very high	91.6	Very high	2 Å²	2	35.9 Å²	35.9	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-65.3	-37.5	175.9	-76.3	172.6	0	0	0	112.1	K593 K594 M600 R601 L629 L640 I643 L644 I647	K593-L597 VanDerWaalsContact O-CB 3.27Å; K593-L597 WeakPolarHBondContact O-CB 3.43Å; K593-L597 VanDerWaalsContact O-CG 3.25Å; K593-L597 WeakPolarHBondContact O-CG 3.37Å; K593-L597 PolarHBondContact O-N 3.47Å; K594-L597 PolarHBondContact O-N 3.48Å; L597-M600 PolarHBondContact O-N 3.42Å; L597-R601 VanDerWaalsContact O-CB 3.26Å; L597-R601 WeakPolarHBondContact O-CB 3.36Å; L597-R601 PolarHBondContact O-N 3.08Å; L597-L629 HydrophobicContact CD1-CD2 4.14Å; L597-L629 HydrophobicContact CD2-CD1 4.23Å; L597-L629 HydrophobicContact CD2-CD2 4.45Å; L597-L629 HydrophobicContact CG-CD2 4.17Å; L597-L640 HydrophobicContact CD1-CB 4.33Å; L597-L640 HydrophobicContact CD1-CD2 4.28Å; L597-I643 HydrophobicContact CB-CG2 3.79Å; L597-I643 WeakPolarHBondContact O-CG2 3.26Å; L597-L644 HydrophobicContact CD2-CB 4.36Å; L597-L644 HydrophobicContact CD2-CD1 4.02Å; L597-I647 HydrophobicContact CD2-CD1 3.85Å
598	L	94.7	Very high	91.8	Very high	1 Å²	1	36.6 Å²	36.6	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-64.9	-42.1	176.7	-74.3	168.2	0	0	0	112.4	V102 V104 Q556 K594 P595 N602 I643	V102-L598 HydrophobicContact CB-CD2 4.15Å; V102-L598 HydrophobicContact CG1-CD1 4.49Å; V102-L598 HydrophobicContact CG1-CD2 4.17Å; V104-L598 HydrophobicContact CG2-CD1 3.8Å; Q556-L598 HydrophobicContact CG-CB 4.49Å; K594-L598 HydrophobicContact CG-CD1 4.07Å; K594-L598 WeakPolarHBondContact O-CG 3.47Å; K594-L598 PolarHBondContact O-N 2.93Å; P595-L598 PolarHBondContact O-N 3.23Å; L598-N602 PolarHBondContact O-N 3.03Å; L598-N602 PolarHBondContact O-OD1 3.2Å; L598-I643 HydrophobicContact CD2-CD1 3.75Å; L598-I643 HydrophobicContact CD2-CG1 4.46Å; L598-I643 HydrophobicContact CG-CD1 4.15Å
599	L	96.6	Very high	92.1	Very high	0 Å²	0	30.2 Å²	30.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.7	-50.4	171.9	175.9	55.1	0	0	0	111	M552 L555 Q556 I582 P595 A596 R601 N602 L603	M552-L599 HydrophobicContact CB-CD2 4.15Å; M552-L599 HydrophobicContact CG-CD2 4.07Å; L555-L599 HydrophobicContact CB-CD1 3.86Å; L555-L599 HydrophobicContact CB-CD2 3.96Å; L555-L599 HydrophobicContact CD1-CD2 4.28Å; Q556-L599 HydrophobicContact CB-CB 4.47Å; I582-L599 HydrophobicContact CD1-CD2 3.54Å; I582-L599 HydrophobicContact CD1-CG 3.89Å; I582-L599 HydrophobicContact CG1-CD2 4.03Å; P595-L599 PolarHBondContact O-N 3.04Å; A596-L599 PolarHBondContact O-N 2.87Å; L599-R601 VanDerWaalsContact C-N 3.26Å; L599-R601 PolarHBondContact O-N 2.84Å; L599-N602 WeakPolarHBondContact O-CB 3.41Å; L599-N602 PolarHBondContact O-N 2.7Å; L599-L603 HydrophobicContact CD1-CD1 3.97Å; L599-L603 HydrophobicContact CD1-CD2 4.29Å; L599-L603 HydrophobicContact CD1-CG 3.91Å; L599-L603 HydrophobicContact CG-CD1 3.94Å; L599-L603 HydrophobicContact CG-CG 4.3Å; L599-L603 WeakPolarHBondContact O-CG 3.4Å; L599-L603 PolarHBondContact O-N 3.08Å
600	M	94.7	Very high	92.5	Very high	4 Å²	4	30 Å²	30	2%	0.02	15%	0.149	C	C	.	.	H	α-helix	trans	-61.7	-31.8	179.6	-69.3	-74.9	-88.7	0	0	112.7	P579 I582 A596 L597 L603 S604 I613 L617 I647	P579-M600 HydrophobicContact CB-CE 4.23Å; P579-M600 HydrophobicContact CB-SD 4.32Å; I582-M600 HydrophobicContact CB-SD 4.41Å; I582-M600 HydrophobicContact CD1-CG 4.34Å; I582-M600 HydrophobicContact CD1-SD 3.83Å; I582-M600 HydrophobicContact CG2-CG 3.92Å; I582-M600 HydrophobicContact CG2-SD 4.27Å; A596-M600 WeakPolarHBondContact O-CB 3.13Å; A596-M600 WeakPolarHBondContact O-CG 3.15Å; A596-M600 PolarHBondContact O-N 2.93Å; L597-M600 PolarHBondContact O-N 3.42Å; M600-L603 PolarHBondContact O-N 2.91Å; M600-L603 HydrophobicContact SD-CD1 4.38Å; M600-S604 VanDerWaalsContact O-CB 3.3Å; M600-S604 WeakPolarHBondContact O-CB 3.23Å; M600-S604 PolarHBondContact O-N 2.84Å; M600-I613 HydrophobicContact CE-CB 4.39Å; M600-I613 HydrophobicContact CE-CG1 4.19Å; M600-I613 HydrophobicContact CE-CG2 3.89Å; M600-I613 HydrophobicContact SD-CG1 4.34Å; M600-L617 HydrophobicContact CE-CB 4.08Å; M600-L617 HydrophobicContact CE-CD1 4.44Å; M600-L617 HydrophobicContact CE-CD2 4.31Å; M600-I647 HydrophobicContact CB-CD1 3.82Å
601	R	95.1	Very high	92.8	Very high	34 Å²	34	30.8 Å²	30.8	13%	0.128	16%	0.158	C	C	.	.	H	α-helix	trans	-60.7	-50.1	169.3	178.5	-154.8	65.4	-165.9	-3.7	111.2	V102 L597 L599 L603 S604 I643 I647	V102-R601 PolarHBondContact O-NH2 3.04Å; L597-R601 VanDerWaalsContact O-CB 3.26Å; L597-R601 WeakPolarHBondContact O-CB 3.36Å; L597-R601 PolarHBondContact O-N 3.08Å; L599-R601 VanDerWaalsContact C-N 3.26Å; L599-R601 PolarHBondContact O-N 2.84Å; R601-L603 VanDerWaalsContact C-N 3.34Å; R601-L603 PolarHBondContact O-N 3.37Å; R601-S604 PolarHBondContact O-N 3.13Å; R601-S604 PolarHBondContact O-OG 3.01Å; R601-I643 HydrophobicContact CB-CG2 3.82Å; R601-I643 HydrophobicContact CG-CG2 4.34Å; R601-I647 HydrophobicContact CB-CD1 4.41Å; R601-I647 HydrophobicContact CB-CG1 4.07Å
602	N	96	Very high	93	Very high	2 Å²	2	28 Å²	28	1%	0.011	14%	0.143	C	C	.	.	H	α-helix	trans	-60.4	-46	177.8	-73.6	13.9	0	0	0	111	Q556 T559 L598 L599 S604 R605 F606	Q556-N602 PolarHBondContact O-ND2 3.16Å; T559-N602 WeakPolarHBondContact O-CB 3.39Å; T559-N602 PolarHBondContact O-ND2 3.12Å; T559-N602 WeakPolarHBondContact OG1-CB 3.35Å; L598-N602 PolarHBondContact O-N 3.03Å; L598-N602 PolarHBondContact O-OD1 3.2Å; L599-N602 WeakPolarHBondContact O-CB 3.41Å; L599-N602 PolarHBondContact O-N 2.7Å; N602-S604 PolarHBondContact O-N 3.02Å; N602-R605 PolarHBondContact O-N 2.78Å; N602-R605 PolarHBondContact O-NE 3.28Å; N602-R605 VanDerWaalsContact O-NE 3.11Å; N602-F606 WeakPolarHBondContact O-CE2 3.37Å
603	L	95.9	Very high	93.1	Very high	0 Å²	0	27.9 Å²	27.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.2	-32.5	178.5	-64.7	-179.4	0	0	0	113.7	T559 I573 I582 L599 M600 R601 R605 F606 L609 I613	T559-L603 HydrophobicContact CG2-CD2 3.95Å; I573-L603 HydrophobicContact CD1-CD2 3.73Å; I573-L603 HydrophobicContact CG2-CD1 3.88Å; I573-L603 HydrophobicContact CG2-CD2 4Å; I582-L603 HydrophobicContact CD1-CD1 3.77Å; L599-L603 HydrophobicContact CD1-CD1 3.97Å; L599-L603 HydrophobicContact CD1-CD2 4.29Å; L599-L603 HydrophobicContact CD1-CG 3.91Å; L599-L603 HydrophobicContact CG-CD1 3.94Å; L599-L603 HydrophobicContact CG-CG 4.3Å; L599-L603 WeakPolarHBondContact O-CG 3.4Å; L599-L603 PolarHBondContact O-N 3.08Å; M600-L603 PolarHBondContact O-N 2.91Å; M600-L603 HydrophobicContact SD-CD1 4.38Å; R601-L603 VanDerWaalsContact C-N 3.34Å; R601-L603 PolarHBondContact O-N 3.37Å; L603-R605 PolarHBondContact O-N 2.71Å; L603-F606 WeakPolarHBondContact O-CD2 3.25Å; L603-F606 PolarHBondContact O-N 3.49Å; L603-F606 VanDerWaalsContact O-N 3.14Å; L603-L609 HydrophobicContact CB-CD1 3.98Å; L603-L609 HydrophobicContact CD2-CD1 3.78Å; L603-L609 HydrophobicContact CG-CD1 4.31Å; L603-I613 HydrophobicContact CB-CD1 3.96Å
604	S	95	Very high	93.1	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	14%	0.139	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-8.9	179.2	72.5	0	0	0	0	114.6	M600 R601 N602 H610 N650	M600-S604 VanDerWaalsContact O-CB 3.3Å; M600-S604 WeakPolarHBondContact O-CB 3.23Å; M600-S604 PolarHBondContact O-N 2.84Å; R601-S604 PolarHBondContact O-N 3.13Å; R601-S604 PolarHBondContact O-OG 3.01Å; N602-S604 PolarHBondContact O-N 3.02Å; S604-H610 PolarHBondContact O-NE2 3.03Å; S604-N650 WeakPolarHBondContact O-CB 3.26Å; S604-N650 PolarHBondContact OG-ND2 3.2Å
605	R	93.3	Very high	92.9	Very high	101 Å²	101	26.9 Å²	26.9	38%	0.381	14%	0.141	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-12	177.6	-58.3	177.5	-57	163.2	18.8	113.4	T559 V560 R561 N602 L603	T559-R605 PolarHBondContact O-NH2 3.32Å; V560-R605 VanDerWaalsContact O-CZ 3.31Å; V560-R605 PolarHBondContact O-NH1 3.14Å; V560-R605 PolarHBondContact O-NH2 3.11Å; R561-R605 PolarHBondContact O-NH2 3.39Å; N602-R605 PolarHBondContact O-N 2.78Å; N602-R605 PolarHBondContact O-NE 3.28Å; N602-R605 VanDerWaalsContact O-NE 3.11Å; L603-R605 PolarHBondContact O-N 2.71Å
606	F	92.8	Very high	92.5	Very high	11 Å²	11	27.3 Å²	27.3	5%	0.048	14%	0.143	C	C	.	.	S	Bend	trans	-100.7	108.6	-178.5	-58.6	-84.3	0	0	0	109.3	E567 A570 N602 L603 E608 L609 H610	E567-F606 HydrophobicContact CB-CE1 4.44Å; E567-F606 HydrophobicContact CG-CD1 4.27Å; E567-F606 HydrophobicContact CG-CE1 3.74Å; A570-F606 HydrophobicContact CB-CB 4.18Å; A570-F606 HydrophobicContact CB-CD1 3.58Å; A570-F606 HydrophobicContact CB-CD2 3.72Å; A570-F606 HydrophobicContact CB-CE1 3.8Å; A570-F606 HydrophobicContact CB-CE2 3.92Å; A570-F606 HydrophobicContact CB-CG 3.55Å; A570-F606 HydrophobicContact CB-CZ 3.97Å; N602-F606 WeakPolarHBondContact O-CE2 3.37Å; L603-F606 WeakPolarHBondContact O-CD2 3.25Å; L603-F606 PolarHBondContact O-N 3.49Å; L603-F606 VanDerWaalsContact O-N 3.14Å; F606-E608 VanDerWaalsContact C-N 3.25Å; F606-E608 PolarHBondContact O-N 3.26Å; F606-L609 HydrophobicContact CB-CD1 4.28Å; F606-L609 PolarHBondContact O-N 2.93Å; F606-H610 PolarHBondContact O-CD2 2.97Å; F606-H610 VanDerWaalsContact O-CD2 3.27Å
607	P	90.6	Very high	92	Very high	88 Å²	88	27.4 Å²	27.4	57%	0.571	14%	0.143	S	C	*	.	G	3₁₀ helix	trans	-58	-31.4	-173.1	-26.6	36.3	0	0	0	114.9	L609 H610	P607-L609 PolarHBondContact O-N 2.67Å; P607-H610 VanDerWaalsContact O-CB 3.28Å; P607-H610 WeakPolarHBondContact O-CB 3.46Å; P607-H610 PolarHBondContact O-N 2.99Å
608	E	89.4	Confident	91.4	Very high	95 Å²	95	27.3 Å²	27.3	44%	0.444	14%	0.143	S	C	.	.	G	3₁₀ helix	trans	-61.2	-26.1	176.2	65.7	-86.4	-149.7	0	0	113.1	F606	F606-E608 VanDerWaalsContact C-N 3.25Å; F606-E608 PolarHBondContact O-N 3.26Å
609	L	93.5	Very high	90.3	Very high	0 Å²	0	29 Å²	29	0%	0	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-88.2	-11.6	174.8	-74.9	170.2	0	0	0	113	A570 I573 A574 P579 L603 F606 P607 S612 I613	A570-L609 HydrophobicContact CB-CD1 4.23Å; I573-L609 HydrophobicContact CG2-CD1 4.35Å; I573-L609 HydrophobicContact CG2-CD2 4.35Å; A574-L609 HydrophobicContact CB-CD2 3.56Å; A574-L609 HydrophobicContact CB-CG 4.15Å; P579-L609 HydrophobicContact CG-CD2 4.01Å; L603-L609 HydrophobicContact CB-CD1 3.98Å; L603-L609 HydrophobicContact CD2-CD1 3.78Å; L603-L609 HydrophobicContact CG-CD1 4.31Å; F606-L609 HydrophobicContact CB-CD1 4.28Å; F606-L609 PolarHBondContact O-N 2.93Å; P607-L609 PolarHBondContact O-N 2.67Å; L609-S612 PolarHBondContact O-N 3.05Å; L609-I613 HydrophobicContact CB-CD1 3.82Å; L609-I613 HydrophobicContact CB-CG1 4.27Å; L609-I613 WeakPolarHBondContact O-CB 3.32Å; L609-I613 VanDerWaalsContact O-CG1 3.3Å; L609-I613 WeakPolarHBondContact O-CG1 3.48Å; L609-I613 PolarHBondContact O-N 2.73Å
610	H	93	Very high	88.5	Confident	25 Å²	25	30 Å²	30	12%	0.116	16%	0.163	C	C	.	.	H	α-helix	trans	-56.9	-47.5	-174.4	-74.7	-163.9	0	0	0	114.2	S604 F606 P607 S612 I613 F614 N650 L651	S604-H610 PolarHBondContact O-NE2 3.03Å; F606-H610 PolarHBondContact O-CD2 2.97Å; F606-H610 VanDerWaalsContact O-CD2 3.27Å; P607-H610 VanDerWaalsContact O-CB 3.28Å; P607-H610 WeakPolarHBondContact O-CB 3.46Å; P607-H610 PolarHBondContact O-N 2.99Å; H610-S612 PolarHBondContact O-N 2.9Å; H610-I613 PolarHBondContact O-N 3.37Å; H610-F614 VanDerWaalsContact O-CB 3.31Å; H610-F614 WeakPolarHBondContact O-CB 3.46Å; H610-F614 PolarHBondContact O-N 2.85Å; H610-N650 PolarHBondContact CE1-O 2.76Å; H610-L651 HydrophobicContact CB-CD2 3.9Å
611	P	90.7	Very high	86.4	Confident	78 Å²	78	39.5 Å²	39.5	51%	0.506	21%	0.208	S	C	.	.	H	α-helix	trans	-63.2	-45	178.7	-20.4	33.4	0	0	0	111.2	I613 F614 D615	P611-I613 PolarHBondContact O-N 3.09Å; P611-F614 PolarHBondContact O-N 2.84Å; P611-D615 WeakPolarHBondContact O-CB 3.07Å; P611-D615 PolarHBondContact O-N 3.06Å
612	S	91.3	Very high	84.2	Confident	33 Å²	33	41 Å²	41	23%	0.231	22%	0.221	C	C	.	.	H	α-helix	trans	-64.9	-40.1	-179.9	-167.1	0	0	0	0	112.3	L609 H610 N616	L609-S612 PolarHBondContact O-N 3.05Å; H610-S612 PolarHBondContact O-N 2.9Å; S612-N616 VanDerWaalsContact O-CB 3.26Å; S612-N616 WeakPolarHBondContact O-CB 3.48Å; S612-N616 PolarHBondContact O-N 2.81Å; S612-N616 VanDerWaalsContact O-N 3.17Å; S612-N616 PolarHBondContact O-ND2 3.03Å
613	I	91.8	Very high	82	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-66.1	-46	174.3	-68.1	169.6	0	0	0	110.1	P579 M600 L603 L609 H610 P611 N616 L617 I647 L651	P579-I613 HydrophobicContact CB-CG1 4.16Å; P579-I613 HydrophobicContact CG-CG1 3.82Å; M600-I613 HydrophobicContact CE-CB 4.39Å; M600-I613 HydrophobicContact CE-CG1 4.19Å; M600-I613 HydrophobicContact CE-CG2 3.89Å; M600-I613 HydrophobicContact SD-CG1 4.34Å; L603-I613 HydrophobicContact CB-CD1 3.96Å; L609-I613 HydrophobicContact CB-CD1 3.82Å; L609-I613 HydrophobicContact CB-CG1 4.27Å; L609-I613 WeakPolarHBondContact O-CB 3.32Å; L609-I613 VanDerWaalsContact O-CG1 3.3Å; L609-I613 WeakPolarHBondContact O-CG1 3.48Å; L609-I613 PolarHBondContact O-N 2.73Å; H610-I613 PolarHBondContact O-N 3.37Å; P611-I613 PolarHBondContact O-N 3.09Å; I613-N616 PolarHBondContact O-N 2.95Å; I613-L617 HydrophobicContact CG2-CB 4.41Å; I613-L617 HydrophobicContact CG2-CD2 4.28Å; I613-L617 WeakPolarHBondContact O-CB 3.18Å; I613-L617 PolarHBondContact O-N 2.94Å; I613-I647 HydrophobicContact CG2-CG2 4.16Å; I613-L651 HydrophobicContact CB-CD2 4.05Å; I613-L651 HydrophobicContact CG2-CD1 3.91Å; I613-L651 HydrophobicContact CG2-CD2 3.91Å; I613-L651 HydrophobicContact CG2-CG 4.39Å
614	F	89.6	Confident	80.3	Confident	3 Å²	3	49.7 Å²	49.7	1%	0.013	26%	0.263	C	S	.	.	H	α-helix	trans	-61.1	-50.3	179.8	177.8	-90.9	0	0	0	111.9	H610 P611 N616 V618 A619 L651 T658 R661 I662	H610-F614 VanDerWaalsContact O-CB 3.31Å; H610-F614 WeakPolarHBondContact O-CB 3.46Å; H610-F614 PolarHBondContact O-N 2.85Å; P611-F614 PolarHBondContact O-N 2.84Å; F614-N616 VanDerWaalsContact C-N 3.26Å; F614-N616 PolarHBondContact O-N 3.27Å; F614-V618 HydrophobicContact CD2-CB 3.86Å; F614-V618 HydrophobicContact CD2-CG1 4.13Å; F614-V618 HydrophobicContact CD2-CG2 4.09Å; F614-V618 HydrophobicContact CE2-CB 3.77Å; F614-V618 HydrophobicContact CE2-CG1 3.55Å; F614-V618 HydrophobicContact CE2-CG2 4.35Å; F614-V618 HydrophobicContact CG-CB 4.49Å; F614-V618 HydrophobicContact CZ-CB 4.32Å; F614-V618 HydrophobicContact CZ-CG1 4.07Å; F614-V618 WeakPolarHBondContact O-CA 3.34Å; F614-V618 VanDerWaalsContact O-CB 3.31Å; F614-V618 WeakPolarHBondContact O-CB 3.28Å; F614-V618 PolarHBondContact O-N 3.4Å; F614-A619 HydrophobicContact CD1-CB 4.04Å; F614-A619 HydrophobicContact CE1-CB 3.25Å; F614-A619 HydrophobicContact CZ-CB 3.63Å; F614-A619 PolarHBondContact O-N 2.89Å; F614-L651 HydrophobicContact CB-CD1 4.5Å; F614-T658 HydrophobicContact CD2-CG2 3.8Å; F614-T658 HydrophobicContact CE2-CG2 4.37Å; F614-T658 HydrophobicContact CG-CG2 4.24Å; F614-R661 HydrophobicContact CE1-CB 4.38Å; F614-R661 VanDerWaalsContact CE1-NH2 3.31Å; F614-R661 HydrophobicContact CE2-CB 4.11Å; F614-R661 HydrophobicContact CZ-CB 3.62Å; F614-I662 HydrophobicContact CD2-CD1 4.25Å; F614-I662 HydrophobicContact CD2-CG1 3.85Å; F614-I662 HydrophobicContact CE2-CD1 4.4Å; F614-I662 HydrophobicContact CE2-CG1 3.52Å
615	D	86.8	Confident	78.9	Confident	74 Å²	74	50 Å²	50	40%	0.396	27%	0.266	S	S	.	.	H	α-helix	trans	-67.3	-24.5	-178.4	-66.6	-27.1	0	0	0	112.8	P611 T620 R661	P611-D615 WeakPolarHBondContact O-CB 3.07Å; P611-D615 PolarHBondContact O-N 3.06Å; D615-T620 WeakPolarHBondContact O-CG2 3.43Å; D615-T620 PolarHBondContact O-N 3.2Å; D615-R661 IonicContact OD1-NH2 2.64Å
616	N	86.1	Confident	77.7	Confident	22 Å²	22	45.4 Å²	45.4	12%	0.118	25%	0.248	C	C	.	.	H	α-helix	trans	-99.6	-24	-179.4	-73.6	-78.2	0	0	0	115.2	P579 R580 T583 S612 I613 F614	P579-N616 HydrophobicContact CB-CB 4.32Å; R580-N616 WeakPolarHBondContact CA-OD1 3.47Å; R580-N616 WeakPolarHBondContact CB-OD1 3.38Å; R580-N616 WeakPolarHBondContact CD-OD1 3.41Å; T583-N616 VanDerWaalsContact CG2-O 3.22Å; T583-N616 WeakPolarHBondContact CG2-O 3.41Å; T583-N616 PolarHBondContact OG1-O 2.9Å; S612-N616 VanDerWaalsContact O-CB 3.26Å; S612-N616 WeakPolarHBondContact O-CB 3.48Å; S612-N616 PolarHBondContact O-N 2.81Å; S612-N616 VanDerWaalsContact O-N 3.17Å; S612-N616 PolarHBondContact O-ND2 3.03Å; I613-N616 PolarHBondContact O-N 2.95Å; F614-N616 VanDerWaalsContact C-N 3.26Å; F614-N616 PolarHBondContact O-N 3.27Å
617	L	82.8	Confident	76.3	Confident	2 Å²	2	48.3 Å²	48.3	1%	0.01	26%	0.264	C	S	.	.	H	α-helix	trans	-102.5	-28.9	-179.6	-172.7	65.7	0	0	0	112.3	M600 I613 L626 L629 L644 I647	M600-L617 HydrophobicContact CE-CB 4.08Å; M600-L617 HydrophobicContact CE-CD1 4.44Å; M600-L617 HydrophobicContact CE-CD2 4.31Å; I613-L617 HydrophobicContact CG2-CB 4.41Å; I613-L617 HydrophobicContact CG2-CD2 4.28Å; I613-L617 WeakPolarHBondContact O-CB 3.18Å; I613-L617 PolarHBondContact O-N 2.94Å; L617-L626 WeakPolarHBondContact O-CB 3.16Å; L617-L629 HydrophobicContact CD1-CD1 3.43Å; L617-L629 VanDerWaalsContact CD1-CD1 3.43Å; L617-L644 HydrophobicContact CD2-CD1 4.3Å; L617-I647 HydrophobicContact CD2-CD1 4.35Å; L617-I647 HydrophobicContact CD2-CG2 3.67Å
618	V	79.3	Confident	75.2	Confident	1 Å²	1	48.1 Å²	48.1	1%	0.006	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-117.4	-63	-169.4	-173.4	0	0	0	0	111.3	F614 T620 L626 L648 E665	F614-V618 HydrophobicContact CD2-CB 3.86Å; F614-V618 HydrophobicContact CD2-CG1 4.13Å; F614-V618 HydrophobicContact CD2-CG2 4.09Å; F614-V618 HydrophobicContact CE2-CB 3.77Å; F614-V618 HydrophobicContact CE2-CG1 3.55Å; F614-V618 HydrophobicContact CE2-CG2 4.35Å; F614-V618 HydrophobicContact CG-CB 4.49Å; F614-V618 HydrophobicContact CZ-CB 4.32Å; F614-V618 HydrophobicContact CZ-CG1 4.07Å; F614-V618 WeakPolarHBondContact O-CA 3.34Å; F614-V618 VanDerWaalsContact O-CB 3.31Å; F614-V618 WeakPolarHBondContact O-CB 3.28Å; F614-V618 PolarHBondContact O-N 3.4Å; V618-T620 PolarHBondContact O-N 3.2Å; V618-L626 HydrophobicContact CG1-CD2 4.3Å; V618-L648 HydrophobicContact CG2-CD2 3.76Å; V618-E665 HydrophobicContact CG1-CG 3.65Å
619	A	71.2	Confident	74.2	Confident	37 Å²	37	43.7 Å²	43.7	31%	0.306	24%	0.235	S	C	.	.	S	Bend	trans	-96.9	21.8	-166.7	0	0	0	0	0	116	F614 E621	F614-A619 HydrophobicContact CD1-CB 4.04Å; F614-A619 HydrophobicContact CE1-CB 3.25Å; F614-A619 HydrophobicContact CZ-CB 3.63Å; F614-A619 PolarHBondContact O-N 2.89Å; A619-E621 PolarHBondContact O-N 3.01Å
620	T	59.6	Low	73	Confident	19 Å²	19	44.5 Å²	44.5	12%	0.117	24%	0.239	C	C	.	.			trans	-61.8	136.6	169.6	50	0	0	0	0	110.5	D615 V618 T622 T623	D615-T620 WeakPolarHBondContact O-CG2 3.43Å; D615-T620 PolarHBondContact O-N 3.2Å; V618-T620 PolarHBondContact O-N 3.2Å; T620-T622 CarbonylContact O-C 3.38Å; T620-T622 VanDerWaalsContact O-C 3.3Å; T620-T622 PolarHBondContact O-N 3.2Å; T620-T622 PolarHBondContact OG1-O 3.03Å; T620-T623 PolarHBondContact O-N 3.33Å; T620-T623 VanDerWaalsContact O-N 3.07Å
621	E	50.2	Low	72	Confident	205 Å²	205	49.7 Å²	49.7	96%	0.958	27%	0.267	S	S	*	.	S	Bend	trans	-52.6	-28.3	172.3	-62.2	-177.5	140.9	0	0	111.8	A619 T623	A619-E621 PolarHBondContact O-N 3.01Å; E621-T623 PolarHBondContact O-N 3.11Å
622	T	48.9	Very low	71	Confident	65 Å²	65	47.3 Å²	47.3	40%	0.399	25%	0.25	S	S	.	.	S	Bend	trans	-87.4	73.1	163.4	55.2	0	0	0	0	112	T620 K624 S625	T620-T622 CarbonylContact O-C 3.38Å; T620-T622 VanDerWaalsContact O-C 3.3Å; T620-T622 PolarHBondContact O-N 3.2Å; T620-T622 PolarHBondContact OG1-O 3.03Å; T622-K624 PolarHBondContact O-N 2.87Å; T622-S625 PolarHBondContact O-N 2.88Å
623	T	51.4	Low	70	Confident	57 Å²	57	48 Å²	48	35%	0.35	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.3	-15	174	52.2	0	0	0	0	114.8	T620 E621 S625 L626 L627	T620-T623 PolarHBondContact O-N 3.33Å; T620-T623 VanDerWaalsContact O-N 3.07Å; E621-T623 PolarHBondContact O-N 3.11Å; T623-S625 PolarHBondContact O-N 2.72Å; T623-S625 VanDerWaalsContact O-N 3.1Å; T623-L626 PolarHBondContact O-N 2.63Å; T623-L626 VanDerWaalsContact O-N 3.13Å; T623-L627 WeakPolarHBondContact O-CG 3.14Å; T623-L627 PolarHBondContact O-N 2.79Å
624	K	60.1	Low	68.9	Low	127 Å²	127	51.9 Å²	51.9	55%	0.552	29%	0.287	S	S	*	.	H	α-helix	trans	-33.4	-43.8	162.5	-61.7	-176.6	-178.4	178.5	0	114.5	T622 L626 L627 H628	T622-K624 PolarHBondContact O-N 2.87Å; K624-L626 PolarHBondContact O-N 3.35Å; K624-L627 PolarHBondContact O-N 3.43Å; K624-H628 VanDerWaalsContact O-CB 3.23Å; K624-H628 WeakPolarHBondContact O-CB 3.37Å; K624-H628 PolarHBondContact O-CD2 3.46Å; K624-H628 PolarHBondContact O-N 3.17Å
625	S	65.1	Low	67.9	Low	8 Å²	8	58.7 Å²	58.7	6%	0.056	32%	0.319	C	S	.	.	H	α-helix	trans	-63.8	-43.8	-176.6	-65.4	0	0	0	0	112.7	T583 T622 T623 L629	T583-S625 WeakPolarHBondContact CG2-OG 3.41Å; T622-S625 PolarHBondContact O-N 2.88Å; T623-S625 PolarHBondContact O-N 2.72Å; T623-S625 VanDerWaalsContact O-N 3.1Å; S625-L629 WeakPolarHBondContact O-CD1 3.36Å; S625-L629 VanDerWaalsContact O-CG 3.26Å; S625-L629 WeakPolarHBondContact O-CG 3.44Å; S625-L629 PolarHBondContact O-N 3.21Å
626	L	68.4	Low	67.4	Low	3 Å²	3	58.8 Å²	58.8	2%	0.016	32%	0.317	C	S	.	.	H	α-helix	trans	-72.6	-39.9	173.6	-169.8	55.6	0	0	0	111.6	L617 V618 T623 K624 L629 L630 L644 A667 V668	L617-L626 WeakPolarHBondContact O-CB 3.16Å; V618-L626 HydrophobicContact CG1-CD2 4.3Å; T623-L626 PolarHBondContact O-N 2.63Å; T623-L626 VanDerWaalsContact O-N 3.13Å; K624-L626 PolarHBondContact O-N 3.35Å; L626-L629 CarbonylContact O-C 3.57Å; L626-L629 WeakPolarHBondContact O-CB 3.3Å; L626-L629 PolarHBondContact O-N 2.94Å; L626-L630 HydrophobicContact CD1-CD1 4.29Å; L626-L630 HydrophobicContact CG-CD1 3.92Å; L626-L630 WeakPolarHBondContact O-CG 3.3Å; L626-L630 PolarHBondContact O-N 3.47Å; L626-L644 HydrophobicContact CD1-CD1 4.18Å; L626-L644 HydrophobicContact CD1-CD2 4.16Å; L626-A667 HydrophobicContact CD2-CB 4.15Å; L626-A667 HydrophobicContact CG-CB 4.38Å; L626-V668 HydrophobicContact CD2-CG2 3.84Å
627	L	62.7	Low	67	Low	73 Å²	73	58.5 Å²	58.5	38%	0.382	32%	0.317	S	S	.	.	H	α-helix	trans	-64.9	-43.2	-179.4	-72.4	168.3	0	0	0	112.6	T623 K624 L629 L630 D631 A667	T623-L627 WeakPolarHBondContact O-CG 3.14Å; T623-L627 PolarHBondContact O-N 2.79Å; K624-L627 PolarHBondContact O-N 3.43Å; L627-L629 PolarHBondContact O-N 2.63Å; L627-L630 CarbonylContact O-C 3.58Å; L627-L630 PolarHBondContact O-N 3.09Å; L627-D631 PolarHBondContact O-N 3.28Å; L627-A667 HydrophobicContact CD2-CB 3.61Å; L627-A667 HydrophobicContact CG-CB 4.19Å
628	H	67.9	Low	67	Low	84 Å²	84	61.2 Å²	61.2	39%	0.389	34%	0.34	S	S	.	.	H	α-helix	trans	-64.6	-30.4	173.8	-72.3	-152.4	0	0	0	111.7	I590 K624 L630	I590-H628 HydrophobicContact CD1-CB 3.8Å; I590-H628 HydrophobicContact CG1-CB 4.27Å; K624-H628 VanDerWaalsContact O-CB 3.23Å; K624-H628 WeakPolarHBondContact O-CB 3.37Å; K624-H628 PolarHBondContact O-CD2 3.46Å; K624-H628 PolarHBondContact O-N 3.17Å; H628-L630 VanDerWaalsContact C-N 3.31Å
629	L	67.3	Low	67.3	Low	1 Å²	1	65.4 Å²	65.4	1%	0.005	36%	0.359	C	S	.	.	H	α-helix	trans	-78.1	-13.7	173.1	-73.3	173	0	0	0	113.5	L586 I590 K593 L597 L617 S625 L626 L627 I632	L586-L629 HydrophobicContact CD1-CD1 4Å; L586-L629 HydrophobicContact CD1-CD2 4Å; L586-L629 HydrophobicContact CD1-CG 4.34Å; L586-L629 HydrophobicContact CD2-CD2 4.43Å; I590-L629 HydrophobicContact CD1-CD2 4.3Å; K593-L629 HydrophobicContact CB-CD2 3.54Å; L597-L629 HydrophobicContact CD1-CD2 4.14Å; L597-L629 HydrophobicContact CD2-CD1 4.23Å; L597-L629 HydrophobicContact CD2-CD2 4.45Å; L597-L629 HydrophobicContact CG-CD2 4.17Å; L617-L629 HydrophobicContact CD1-CD1 3.43Å; L617-L629 VanDerWaalsContact CD1-CD1 3.43Å; S625-L629 WeakPolarHBondContact O-CD1 3.36Å; S625-L629 VanDerWaalsContact O-CG 3.26Å; S625-L629 WeakPolarHBondContact O-CG 3.44Å; S625-L629 PolarHBondContact O-N 3.21Å; L626-L629 CarbonylContact O-C 3.57Å; L626-L629 WeakPolarHBondContact O-CB 3.3Å; L626-L629 PolarHBondContact O-N 2.94Å; L627-L629 PolarHBondContact O-N 2.63Å; L629-I632 WeakPolarHBondContact O-CD1 3.09Å; L629-I632 WeakPolarHBondContact O-CG1 3.37Å
630	L	68.8	Low	68.1	Low	18 Å²	18	63.9 Å²	63.9	9%	0.094	35%	0.346	C	S	.	.	H	α-helix	trans	-104.5	-9	175.3	-71.7	169.8	0	0	0	113.3	L626 L627 H628 I632 M641 L644 A667 M671	L626-L630 HydrophobicContact CD1-CD1 4.29Å; L626-L630 HydrophobicContact CG-CD1 3.92Å; L626-L630 WeakPolarHBondContact O-CG 3.3Å; L626-L630 PolarHBondContact O-N 3.47Å; L627-L630 CarbonylContact O-C 3.58Å; L627-L630 PolarHBondContact O-N 3.09Å; H628-L630 VanDerWaalsContact C-N 3.31Å; L630-I632 VanDerWaalsContact C-N 3.31Å; L630-I632 PolarHBondContact O-N 3.14Å; L630-I632 VanDerWaalsContact O-N 3.14Å; L630-M641 HydrophobicContact CD2-CE 3.66Å; L630-M641 HydrophobicContact CD2-SD 4.3Å; L630-L644 HydrophobicContact CD2-CD2 3.65Å; L630-L644 HydrophobicContact CG-CD2 4.13Å; L630-A667 HydrophobicContact CD1-CB 3.9Å; L630-A667 WeakPolarHBondContact CD1-O 3.26Å; L630-M671 HydrophobicContact CD1-CB 4.47Å; L630-M671 HydrophobicContact CD2-CB 4.14Å; L630-M671 HydrophobicContact CD2-CG 3.97Å; L630-M671 HydrophobicContact CD2-SD 3.74Å
631	D	71.9	Confident	69.6	Low	133 Å²	133	63 Å²	63	71%	0.711	34%	0.341	S	S	*	.			trans	-79.1	81.8	164	-164.1	25.3	0	0	0	108.8	K593 L627	K593-D631 PolarHBondContact NZ-O 3.24Å; L627-D631 PolarHBondContact O-N 3.28Å
632	I	70.5	Confident	71.6	Confident	29 Å²	29	54.8 Å²	54.8	15%	0.149	31%	0.305	C	S	.	.			trans	-125.7	139.1	-171.6	-46.9	174.9	0	0	0	108.7	L629 L630 E636 S637 L640 M641	L629-I632 WeakPolarHBondContact O-CD1 3.09Å; L629-I632 WeakPolarHBondContact O-CG1 3.37Å; L630-I632 VanDerWaalsContact C-N 3.31Å; L630-I632 PolarHBondContact O-N 3.14Å; L630-I632 VanDerWaalsContact O-N 3.14Å; I632-E636 VanDerWaalsContact CG2-C 3.48Å; I632-E636 HydrophobicContact CG2-CB 3.23Å; I632-E636 HydrophobicContact CG2-CG 4.39Å; I632-S637 VanDerWaalsContact CG2-N 3.3Å; I632-L640 HydrophobicContact CD1-CB 4.18Å; I632-L640 HydrophobicContact CG2-CD1 4.23Å; I632-M641 HydrophobicContact CD1-CE 4.48Å; I632-M641 HydrophobicContact CD1-CG 4.3Å; I632-M641 HydrophobicContact CD1-SD 4.29Å
633	S	70.1	Confident	73.7	Confident	46 Å²	46	52.4 Å²	52.4	32%	0.322	29%	0.289	S	S	.	.			trans	-66.1	164.6	171.9	91.6	0	0	0	0	111.7	E635 E636 S637	S633-E635 WeakPolarHBondContact CB-OE2 3.38Å; S633-E635 PolarHBondContact O-N 3.38Å; S633-E635 PolarHBondContact OG-N 3.11Å; S633-E635 PolarHBondContact OG-OE2 2.83Å; S633-E636 PolarHBondContact N-OE2 3.24Å; S633-E636 VanDerWaalsContact N-OE2 3.15Å; S633-E636 PolarHBondContact O-N 3.42Å; S633-E636 PolarHBondContact OG-N 3.4Å; S633-S637 WeakPolarHBondContact O-CB 3.48Å; S633-S637 PolarHBondContact O-N 2.87Å
634	A	67.4	Low	75.6	Confident	83 Å²	83	49.8 Å²	49.8	69%	0.686	27%	0.273	S	S	*	.	H	α-helix	trans	-60.1	-35.2	178.6	0	0	0	0	0	112.2
635	E	69.4	Low	77.2	Confident	145 Å²	145	43.7 Å²	43.7	68%	0.678	25%	0.247	S	C	*	.	H	α-helix	trans	-72.6	-51.9	179.8	-52.9	72.7	-159.4	0	0	111.3	S633 S637 A638	S633-E635 WeakPolarHBondContact CB-OE2 3.38Å; S633-E635 PolarHBondContact O-N 3.38Å; S633-E635 PolarHBondContact OG-N 3.11Å; S633-E635 PolarHBondContact OG-OE2 2.83Å; E635-S637 PolarHBondContact O-N 2.79Å; E635-A638 PolarHBondContact O-N 3.27Å
636	E	76.7	Confident	78.6	Confident	77 Å²	77	46.6 Å²	46.6	36%	0.36	26%	0.256	S	S	.	.	H	α-helix	trans	-62.5	-30.8	177.1	-70.1	-178.5	122.6	0	0	112	K593 I632 S633 A638 E639 L640	K593-E636 VanDerWaalsContact CE-CD 3.47Å; K593-E636 WeakPolarHBondContact CE-OE1 3.28Å; K593-E636 WeakPolarHBondContact CE-OE2 3.2Å; K593-E636 VanDerWaalsContact NZ-CD 3.25Å; K593-E636 IonicContact NZ-OE1 2.63Å; K593-E636 PolarHBondContact NZ-OE1 3.02Å; K593-E636 VanDerWaalsContact NZ-OE1 3.12Å; K593-E636 IonicContact NZ-OE2 3.43Å; K593-E636 PolarHBondContact NZ-OE2 3.33Å; I632-E636 VanDerWaalsContact CG2-C 3.48Å; I632-E636 HydrophobicContact CG2-CB 3.23Å; I632-E636 HydrophobicContact CG2-CG 4.39Å; S633-E636 PolarHBondContact N-OE2 3.24Å; S633-E636 VanDerWaalsContact N-OE2 3.15Å; S633-E636 PolarHBondContact O-N 3.42Å; S633-E636 PolarHBondContact OG-N 3.4Å; E636-A638 VanDerWaalsContact C-N 3.26Å; E636-A638 PolarHBondContact O-N 3.22Å; E636-E639 PolarHBondContact O-N 3.04Å; E636-E639 VanDerWaalsContact O-N 3.15Å; E636-L640 HydrophobicContact CB-CD1 4.38Å; E636-L640 WeakPolarHBondContact O-CG 3.25Å; E636-L640 PolarHBondContact O-N 3.47Å
637	S	78.2	Confident	79.8	Confident	16 Å²	16	46.5 Å²	46.5	11%	0.112	26%	0.256	C	S	.	.	H	α-helix	trans	-59.9	-36	-179.1	177.1	0	0	0	0	112	I632 S633 E635 E639 M641 Y676	I632-S637 VanDerWaalsContact CG2-N 3.3Å; S633-S637 WeakPolarHBondContact O-CB 3.48Å; S633-S637 PolarHBondContact O-N 2.87Å; E635-S637 PolarHBondContact O-N 2.79Å; S637-E639 VanDerWaalsContact C-N 3.26Å; S637-E639 PolarHBondContact O-N 2.59Å; S637-M641 VanDerWaalsContact O-CB 3.25Å; S637-M641 WeakPolarHBondContact O-CB 3.45Å; S637-M641 WeakPolarHBondContact O-CG 3.44Å; S637-M641 PolarHBondContact O-N 3.21Å; S637-M641 WeakPolarHBondContact OG-CG 3.29Å; S637-Y676 WeakPolarHBondContact OG-CE1 3.45Å
638	A	82.2	Confident	81.3	Confident	59 Å²	59	43 Å²	43	49%	0.488	24%	0.238	S	C	.	.	H	α-helix	trans	-64.6	-28.8	179.1	0	0	0	0	0	113.1	E635 E636	E635-A638 PolarHBondContact O-N 3.27Å; E636-A638 VanDerWaalsContact C-N 3.26Å; E636-A638 PolarHBondContact O-N 3.22Å
639	E	85.3	Confident	82.5	Confident	89 Å²	89	39 Å²	39	42%	0.416	22%	0.219	S	C	.	.	H	α-helix	trans	-94.2	-44.4	178.8	-176.8	174.7	-135.4	0	0	112.8	K594 E636 S637	K594-E639 WeakPolarHBondContact CD-OE2 3.4Å; K594-E639 VanDerWaalsContact CE-CD 3.46Å; K594-E639 WeakPolarHBondContact CE-OE1 3.32Å; K594-E639 WeakPolarHBondContact CE-OE2 3.49Å; K594-E639 IonicContact NZ-OE1 3.27Å; K594-E639 PolarHBondContact NZ-OE1 2.81Å; K594-E639 IonicContact NZ-OE2 3.31Å; K594-E639 PolarHBondContact NZ-OE2 3.38Å; E636-E639 PolarHBondContact O-N 3.04Å; E636-E639 VanDerWaalsContact O-N 3.15Å; S637-E639 VanDerWaalsContact C-N 3.26Å; S637-E639 PolarHBondContact O-N 2.59Å
640	L	88.6	Confident	83.8	Confident	4 Å²	4	40.1 Å²	40.1	2%	0.021	23%	0.225	C	C	.	.	H	α-helix	trans	-82.5	-30.7	-170.4	-61.6	-176.9	0	0	0	113.6	K593 K594 L597 I632 E636 I643 L644	K593-L640 HydrophobicContact CD-CD1 3.75Å; K593-L640 HydrophobicContact CG-CD1 3.85Å; K594-L640 HydrophobicContact CB-CD2 3.97Å; K594-L640 HydrophobicContact CG-CD2 4.12Å; L597-L640 HydrophobicContact CD1-CB 4.33Å; L597-L640 HydrophobicContact CD1-CD2 4.28Å; I632-L640 HydrophobicContact CD1-CB 4.18Å; I632-L640 HydrophobicContact CG2-CD1 4.23Å; E636-L640 HydrophobicContact CB-CD1 4.38Å; E636-L640 WeakPolarHBondContact O-CG 3.25Å; E636-L640 PolarHBondContact O-N 3.47Å; L640-I643 HydrophobicContact CD2-CD1 4.3Å; L640-I643 WeakPolarHBondContact O-CB 3.36Å; L640-I643 PolarHBondContact O-N 3.04Å; L640-I643 VanDerWaalsContact O-N 3.15Å; L640-L644 PolarHBondContact O-N 3.42Å
641	M	90	Very high	84.9	Confident	2 Å²	2	39.2 Å²	39.2	1%	0.01	22%	0.22	C	C	.	.	H	α-helix	trans	-64.7	-42.3	-177.9	-65.4	-92.6	50.8	0	0	113.5	L630 I632 S637 I643 L644 C645 M671 Y676 A680	L630-M641 HydrophobicContact CD2-CE 3.66Å; L630-M641 HydrophobicContact CD2-SD 4.3Å; I632-M641 HydrophobicContact CD1-CE 4.48Å; I632-M641 HydrophobicContact CD1-CG 4.3Å; I632-M641 HydrophobicContact CD1-SD 4.29Å; S637-M641 VanDerWaalsContact O-CB 3.25Å; S637-M641 WeakPolarHBondContact O-CB 3.45Å; S637-M641 WeakPolarHBondContact O-CG 3.44Å; S637-M641 PolarHBondContact O-N 3.21Å; S637-M641 WeakPolarHBondContact OG-CG 3.29Å; M641-I643 PolarHBondContact O-N 3.11Å; M641-L644 HydrophobicContact CE-CB 4.14Å; M641-L644 HydrophobicContact CE-CD2 3.83Å; M641-L644 HydrophobicContact CE-CG 4.36Å; M641-L644 PolarHBondContact O-N 3.24Å; M641-C645 VanDerWaalsContact O-CB 3.29Å; M641-C645 WeakPolarHBondContact O-CB 3.36Å; M641-C645 PolarHBondContact O-N 2.89Å; M641-C645 PolarHBondContact O-SG 3.2Å; M641-M671 HydrophobicContact CE-CG 4.13Å; M641-M671 HydrophobicContact CE-SD 3.59Å; M641-M671 VanDerWaalsContact CE-SD 3.59Å; M641-M671 HydrophobicContact SD-CG 4.25Å; M641-M671 HydrophobicContact SD-SD 4.46Å; M641-Y676 HydrophobicContact CG-CD1 4.29Å; M641-Y676 HydrophobicContact CG-CE1 3.75Å; M641-Y676 HydrophobicContact SD-CD1 4.48Å; M641-Y676 HydrophobicContact SD-CE1 3.47Å; M641-Y676 WeakPolarHBondContact SD-CE1 3.26Å; M641-Y676 VanDerWaalsContact SD-CZ 3.6Å; M641-Y676 PolarHBondContact SD-OH 3.46Å; M641-A680 HydrophobicContact CB-CB 3.9Å
642	P	92.9	Very high	85.8	Confident	31 Å²	31	33.2 Å²	33.2	20%	0.201	19%	0.189	C	C	.	.	H	α-helix	trans	-55	-35.7	171.4	-27.2	35.6	0	0	0	114	R646 K679 A683	P642-R646 WeakPolarHBondContact O-CB 3.41Å; P642-R646 PolarHBondContact O-N 3.37Å; P642-R646 VanDerWaalsContact O-N 3.1Å; P642-K679 HydrophobicContact CG-CB 3.94Å; P642-A683 HydrophobicContact CB-CB 4.17Å
643	I	93.2	Very high	86.5	Confident	16 Å²	16	35.4 Å²	35.4	8%	0.082	20%	0.197	C	C	.	.	H	α-helix	trans	-72.1	-49	-179.5	-53.3	170.9	0	0	0	110.2	L597 L598 R601 L640 M641 R646 I647	L597-I643 HydrophobicContact CB-CG2 3.79Å; L597-I643 WeakPolarHBondContact O-CG2 3.26Å; L598-I643 HydrophobicContact CD2-CD1 3.75Å; L598-I643 HydrophobicContact CD2-CG1 4.46Å; L598-I643 HydrophobicContact CG-CD1 4.15Å; R601-I643 HydrophobicContact CB-CG2 3.82Å; R601-I643 HydrophobicContact CG-CG2 4.34Å; L640-I643 HydrophobicContact CD2-CD1 4.3Å; L640-I643 WeakPolarHBondContact O-CB 3.36Å; L640-I643 PolarHBondContact O-N 3.04Å; L640-I643 VanDerWaalsContact O-N 3.15Å; M641-I643 PolarHBondContact O-N 3.11Å; I643-R646 PolarHBondContact O-N 2.97Å; I643-I647 WeakPolarHBondContact O-CG1 3.48Å; I643-I647 PolarHBondContact O-N 3.08Å; I643-I647 VanDerWaalsContact O-N 3.14Å
644	L	91.6	Very high	86.8	Confident	1 Å²	1	39.8 Å²	39.8	1%	0.005	22%	0.217	C	C	.	.	H	α-helix	trans	-66.1	-43.4	179.2	-178.3	57.3	0	0	0	112.2	L597 L617 L626 L630 L640 M641 R646 I647 L648	L597-L644 HydrophobicContact CD2-CB 4.36Å; L597-L644 HydrophobicContact CD2-CD1 4.02Å; L617-L644 HydrophobicContact CD2-CD1 4.3Å; L626-L644 HydrophobicContact CD1-CD1 4.18Å; L626-L644 HydrophobicContact CD1-CD2 4.16Å; L630-L644 HydrophobicContact CD2-CD2 3.65Å; L630-L644 HydrophobicContact CG-CD2 4.13Å; L640-L644 PolarHBondContact O-N 3.42Å; M641-L644 HydrophobicContact CE-CB 4.14Å; M641-L644 HydrophobicContact CE-CD2 3.83Å; M641-L644 HydrophobicContact CE-CG 4.36Å; M641-L644 PolarHBondContact O-N 3.24Å; L644-R646 VanDerWaalsContact C-N 3.33Å; L644-R646 PolarHBondContact O-N 3.43Å; L644-I647 WeakPolarHBondContact O-CB 3.26Å; L644-I647 PolarHBondContact O-N 2.93Å; L644-L648 HydrophobicContact CD1-CG 4.46Å; L644-L648 HydrophobicContact CG-CD1 4.35Å; L644-L648 PolarHBondContact O-N 3.28Å
645	C	92.6	Very high	87.5	Confident	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.2	C	C	.	.	H	α-helix	trans	-60.4	-42.1	175.3	-69.7	0	0	0	0	111.4	M641 I647 L648 V649 A683 L687	M641-C645 VanDerWaalsContact O-CB 3.29Å; M641-C645 WeakPolarHBondContact O-CB 3.36Å; M641-C645 PolarHBondContact O-N 2.89Å; M641-C645 PolarHBondContact O-SG 3.2Å; C645-I647 VanDerWaalsContact C-N 3.32Å; C645-I647 PolarHBondContact O-N 3.16Å; C645-L648 PolarHBondContact O-N 3.08Å; C645-V649 VanDerWaalsContact O-CB 3.25Å; C645-V649 WeakPolarHBondContact O-CB 3.38Å; C645-V649 VanDerWaalsContact O-CG2 3.23Å; C645-V649 WeakPolarHBondContact O-CG2 3.49Å; C645-V649 PolarHBondContact O-N 2.91Å; C645-A683 HydrophobicContact CB-CB 3.75Å; C645-A683 WeakPolarHBondContact CB-O 3.45Å; C645-L687 HydrophobicContact CB-CB 4.37Å; C645-L687 HydrophobicContact CB-CD2 4.44Å
646	R	95.3	Very high	88.3	Confident	69 Å²	69	36.5 Å²	36.5	26%	0.26	20%	0.196	S	C	.	.	H	α-helix	trans	-65.5	-32.3	177.3	-173.5	61.1	79	80.3	3.1	112.8	D99 P642 I643 L644 N650 E686	D99-R646 IonicContact OD1-CZ 3.78Å; D99-R646 IonicContact OD1-NH1 2.76Å; D99-R646 IonicContact OD1-NH2 3.78Å; D99-R646 PolarHBondContact OD1-NH2 2.77Å; D99-R646 VanDerWaalsContact OD1-NH2 3.12Å; D99-R646 IonicContact OD2-CZ 3.21Å; D99-R646 IonicContact OD2-NH1 3.07Å; D99-R646 PolarHBondContact OD2-NH1 3.4Å; D99-R646 IonicContact OD2-NH2 2.68Å; P642-R646 WeakPolarHBondContact O-CB 3.41Å; P642-R646 PolarHBondContact O-N 3.37Å; P642-R646 VanDerWaalsContact O-N 3.1Å; I643-R646 PolarHBondContact O-N 2.97Å; L644-R646 VanDerWaalsContact C-N 3.33Å; L644-R646 PolarHBondContact O-N 3.43Å; R646-N650 WeakPolarHBondContact O-CB 3.46Å; R646-N650 PolarHBondContact O-N 3.24Å; R646-N650 PolarHBondContact O-ND2 2.99Å; R646-N650 PolarHBondContact O-OD1 3.17Å; R646-E686 IonicContact NE-OE2 3.6Å; R646-E686 PolarHBondContact NE-OE2 3.28Å
647	I	94.1	Very high	88.6	Confident	0 Å²	0	38.6 Å²	38.6	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-61.8	-56.3	170	-66	161.6	0	0	0	110.3	L597 M600 R601 I613 L617 I643 L644 C645 V649 N650 L651	L597-I647 HydrophobicContact CD2-CD1 3.85Å; M600-I647 HydrophobicContact CB-CD1 3.82Å; R601-I647 HydrophobicContact CB-CD1 4.41Å; R601-I647 HydrophobicContact CB-CG1 4.07Å; I613-I647 HydrophobicContact CG2-CG2 4.16Å; L617-I647 HydrophobicContact CD2-CD1 4.35Å; L617-I647 HydrophobicContact CD2-CG2 3.67Å; I643-I647 WeakPolarHBondContact O-CG1 3.48Å; I643-I647 PolarHBondContact O-N 3.08Å; I643-I647 VanDerWaalsContact O-N 3.14Å; L644-I647 WeakPolarHBondContact O-CB 3.26Å; L644-I647 PolarHBondContact O-N 2.93Å; C645-I647 VanDerWaalsContact C-N 3.32Å; C645-I647 PolarHBondContact O-N 3.16Å; I647-V649 VanDerWaalsContact C-N 3.29Å; I647-V649 PolarHBondContact O-N 3.29Å; I647-N650 PolarHBondContact O-N 3.32Å; I647-L651 HydrophobicContact CG2-CD1 4.03Å; I647-L651 HydrophobicContact CG2-CG 4.4Å; I647-L651 WeakPolarHBondContact O-CG 3.45Å; I647-L651 PolarHBondContact O-N 3.22Å
648	L	93	Very high	89	Confident	1 Å²	1	38.4 Å²	38.4	1%	0.005	20%	0.204	C	C	.	.	H	α-helix	trans	-61.5	-37.7	-176.8	-65.9	173.8	0	0	0	112.3	V618 L644 C645 S652 I662 V668 M671 L687	V618-L648 HydrophobicContact CG2-CD2 3.76Å; L644-L648 HydrophobicContact CD1-CG 4.46Å; L644-L648 HydrophobicContact CG-CD1 4.35Å; L644-L648 PolarHBondContact O-N 3.28Å; C645-L648 PolarHBondContact O-N 3.08Å; L648-S652 WeakPolarHBondContact O-CB 3.43Å; L648-S652 PolarHBondContact O-N 2.98Å; L648-S652 VanDerWaalsContact O-N 3.11Å; L648-S652 PolarHBondContact O-OG 3.1Å; L648-I662 HydrophobicContact CD2-CD1 4.3Å; L648-I662 HydrophobicContact CD2-CG2 4.29Å; L648-V668 HydrophobicContact CD1-CG2 4.42Å; L648-M671 HydrophobicContact CD1-CE 4.02Å; L648-L687 HydrophobicContact CB-CD1 3.61Å; L648-L687 HydrophobicContact CB-CD2 4.07Å; L648-L687 HydrophobicContact CD1-CD2 3.82Å
649	V	93.9	Very high	89.3	Confident	0 Å²	0	36.2 Å²	36.2	0%	0	19%	0.186	C	C	.	.	H	α-helix	trans	-59.5	-47.2	171.5	160.5	0	0	0	0	111	C645 I647 S652 K653 E686 L687 T690	C645-V649 VanDerWaalsContact O-CB 3.25Å; C645-V649 WeakPolarHBondContact O-CB 3.38Å; C645-V649 VanDerWaalsContact O-CG2 3.23Å; C645-V649 WeakPolarHBondContact O-CG2 3.49Å; C645-V649 PolarHBondContact O-N 2.91Å; I647-V649 VanDerWaalsContact C-N 3.29Å; I647-V649 PolarHBondContact O-N 3.29Å; V649-S652 PolarHBondContact O-N 3.03Å; V649-K653 HydrophobicContact CG1-CD 3.68Å; V649-K653 HydrophobicContact CG1-CG 4.26Å; V649-K653 WeakPolarHBondContact O-CB 3.4Å; V649-K653 VanDerWaalsContact O-CG 3.32Å; V649-K653 WeakPolarHBondContact O-CG 3.49Å; V649-K653 PolarHBondContact O-N 2.81Å; V649-E686 WeakPolarHBondContact CG1-OE1 3.28Å; V649-E686 HydrophobicContact CG2-CG 4.19Å; V649-L687 HydrophobicContact CB-CD1 4.49Å; V649-L687 HydrophobicContact CG2-CB 3.86Å; V649-L687 HydrophobicContact CG2-CD1 3.7Å; V649-L687 HydrophobicContact CG2-CG 4.39Å; V649-T690 HydrophobicContact CG1-CG2 4.49Å
650	N	94.2	Very high	89.3	Confident	23 Å²	23	36.4 Å²	36.4	12%	0.123	19%	0.187	C	C	.	.	H	α-helix	trans	-66.6	-39.5	-178.7	-71.9	-13.5	0	0	0	112.4	S604 H610 R646 I647 S652 K653	S604-N650 WeakPolarHBondContact O-CB 3.26Å; S604-N650 PolarHBondContact OG-ND2 3.2Å; H610-N650 PolarHBondContact CE1-O 2.76Å; R646-N650 WeakPolarHBondContact O-CB 3.46Å; R646-N650 PolarHBondContact O-N 3.24Å; R646-N650 PolarHBondContact O-ND2 2.99Å; R646-N650 PolarHBondContact O-OD1 3.17Å; I647-N650 PolarHBondContact O-N 3.32Å; N650-S652 PolarHBondContact O-N 3.33Å; N650-K653 PolarHBondContact O-N 2.87Å
651	L	92.3	Very high	89.2	Confident	0 Å²	0	40.4 Å²	40.4	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-64.3	-27.2	173.6	-62.3	173.4	0	0	0	113.1	H610 I613 F614 I647 T658 I662	H610-L651 HydrophobicContact CB-CD2 3.9Å; I613-L651 HydrophobicContact CB-CD2 4.05Å; I613-L651 HydrophobicContact CG2-CD1 3.91Å; I613-L651 HydrophobicContact CG2-CD2 3.91Å; I613-L651 HydrophobicContact CG2-CG 4.39Å; F614-L651 HydrophobicContact CB-CD1 4.5Å; I647-L651 HydrophobicContact CG2-CD1 4.03Å; I647-L651 HydrophobicContact CG2-CG 4.4Å; I647-L651 WeakPolarHBondContact O-CG 3.45Å; I647-L651 PolarHBondContact O-N 3.22Å; L651-T658 HydrophobicContact CB-CG2 4.11Å; L651-T658 VanDerWaalsContact O-CG2 3.27Å; L651-T658 WeakPolarHBondContact O-CG2 3.47Å; L651-I662 HydrophobicContact CB-CD1 3.89Å; L651-I662 HydrophobicContact CD1-CD1 4.46Å
652	S	90.9	Very high	89.1	Confident	7 Å²	7	40.3 Å²	40.3	5%	0.049	20%	0.201	C	C	.	.	H	α-helix	trans	-88.3	-27.1	179.3	-55.8	0	0	0	0	112.9	L648 V649 N650 N654 N655 I662 L691	L648-S652 WeakPolarHBondContact O-CB 3.43Å; L648-S652 PolarHBondContact O-N 2.98Å; L648-S652 VanDerWaalsContact O-N 3.11Å; L648-S652 PolarHBondContact O-OG 3.1Å; V649-S652 PolarHBondContact O-N 3.03Å; N650-S652 PolarHBondContact O-N 3.33Å; S652-N654 PolarHBondContact O-N 2.99Å; S652-N654 VanDerWaalsContact O-N 3.08Å; S652-N655 PolarHBondContact O-N 3.04Å; S652-I662 WeakPolarHBondContact OG-CD1 3.48Å; S652-L691 VanDerWaalsContact OG-CD2 3.28Å; S652-L691 WeakPolarHBondContact OG-CD2 3.45Å
653	K	84.2	Confident	88.7	Confident	74 Å²	74	40.6 Å²	40.6	32%	0.322	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	112.8	-177.3	-88.5	168.2	177.3	162.1	0	109.7	V649 N650 N655 E686 T690	V649-K653 HydrophobicContact CG1-CD 3.68Å; V649-K653 HydrophobicContact CG1-CG 4.26Å; V649-K653 WeakPolarHBondContact O-CB 3.4Å; V649-K653 VanDerWaalsContact O-CG 3.32Å; V649-K653 WeakPolarHBondContact O-CG 3.49Å; V649-K653 PolarHBondContact O-N 2.81Å; N650-K653 PolarHBondContact O-N 2.87Å; K653-N655 VanDerWaalsContact C-N 3.29Å; K653-N655 PolarHBondContact O-N 3.4Å; K653-E686 IonicContact NZ-OE1 3.85Å; K653-E686 PolarHBondContact NZ-OE1 3.08Å; K653-T690 HydrophobicContact CG-CG2 4.38Å
654	N	76.6	Confident	88.3	Confident	139 Å²	139	47.5 Å²	47.5	74%	0.743	23%	0.229	S	C	*	.	T	Hydrogen-bonded Turn	trans	70.4	9.9	-179.3	-45.2	-34.3	0	0	0	116	S652	S652-N654 PolarHBondContact O-N 2.99Å; S652-N654 VanDerWaalsContact O-N 3.08Å
655	N	83.3	Confident	88	Confident	61 Å²	61	49.4 Å²	49.4	33%	0.326	24%	0.238	S	C	.	.			trans	-123.9	97.8	172.2	-170.7	-24.9	0	0	0	111.2	S652 K653 E657 T658 A659	S652-N655 PolarHBondContact O-N 3.04Å; K653-N655 VanDerWaalsContact C-N 3.29Å; K653-N655 PolarHBondContact O-N 3.4Å; N655-E657 VanDerWaalsContact C-N 3.33Å; N655-E657 PolarHBondContact O-N 3.12Å; N655-E657 PolarHBondContact OD1-N 2.99Å; N655-E657 VanDerWaalsContact OD1-N 3.14Å; N655-T658 VanDerWaalsContact CG-OG1 3.28Å; N655-T658 PolarHBondContact ND2-OG1 2.88Å; N655-T658 PolarHBondContact O-N 3.42Å; N655-T658 PolarHBondContact OD1-N 3.39Å; N655-T658 PolarHBondContact OD1-OG1 3.04Å; N655-A659 WeakPolarHBondContact O-CB 3.36Å; N655-A659 PolarHBondContact O-N 3.18Å
656	V	84.3	Confident	87.5	Confident	97 Å²	97	54 Å²	54	59%	0.588	27%	0.266	S	S	*	.	H	α-helix	trans	-66.6	-32.7	-177.6	-179.6	0	0	0	0	112.1	Q660	V656-Q660 WeakPolarHBondContact O-CB 3.49Å; V656-Q660 VanDerWaalsContact O-CG 3.3Å; V656-Q660 WeakPolarHBondContact O-CG 3.46Å; V656-Q660 PolarHBondContact O-N 2.84Å
657	E	85.1	Confident	86.8	Confident	121 Å²	121	51 Å²	51	57%	0.565	26%	0.256	S	S	*	.	H	α-helix	trans	-70.4	-48.4	178	-167	-161.5	128.6	0	0	110.8	N655 A659 Q660 R661	N655-E657 VanDerWaalsContact C-N 3.33Å; N655-E657 PolarHBondContact O-N 3.12Å; N655-E657 PolarHBondContact OD1-N 2.99Å; N655-E657 VanDerWaalsContact OD1-N 3.14Å; E657-A659 VanDerWaalsContact C-N 3.35Å; E657-A659 PolarHBondContact O-N 3.36Å; E657-Q660 PolarHBondContact O-N 2.97Å; E657-R661 WeakPolarHBondContact O-CG 3.35Å; E657-R661 PolarHBondContact O-N 3.31Å; E657-R661 IonicContact OE1-NH1 3.59Å; E657-R661 PolarHBondContact OE1-NH1 2.92Å
658	T	85.9	Confident	86.4	Confident	13 Å²	13	51 Å²	51	8%	0.08	26%	0.256	C	S	.	.	H	α-helix	trans	-62.5	-41.6	176.3	-61.3	0	0	0	0	111.3	F614 L651 N655 Q660 R661 I662	F614-T658 HydrophobicContact CD2-CG2 3.8Å; F614-T658 HydrophobicContact CE2-CG2 4.37Å; F614-T658 HydrophobicContact CG-CG2 4.24Å; L651-T658 HydrophobicContact CB-CG2 4.11Å; L651-T658 VanDerWaalsContact O-CG2 3.27Å; L651-T658 WeakPolarHBondContact O-CG2 3.47Å; N655-T658 VanDerWaalsContact CG-OG1 3.28Å; N655-T658 PolarHBondContact ND2-OG1 2.88Å; N655-T658 PolarHBondContact O-N 3.42Å; N655-T658 PolarHBondContact OD1-N 3.39Å; N655-T658 PolarHBondContact OD1-OG1 3.04Å; T658-Q660 PolarHBondContact O-N 3.39Å; T658-R661 PolarHBondContact O-N 2.87Å; T658-I662 HydrophobicContact CG2-CD1 3.84Å; T658-I662 HydrophobicContact CG2-CG1 4.31Å; T658-I662 VanDerWaalsContact O-CG1 3.31Å; T658-I662 WeakPolarHBondContact O-CG1 3.44Å; T658-I662 PolarHBondContact O-N 3.2Å
659	A	87.3	Confident	86	Confident	12 Å²	12	54 Å²	54	10%	0.099	27%	0.271	C	S	.	.	H	α-helix	trans	-58.5	-45.4	172.7	0	0	0	0	0	111.8	N655 E657 R661 I662 S663 L691	N655-A659 WeakPolarHBondContact O-CB 3.36Å; N655-A659 PolarHBondContact O-N 3.18Å; E657-A659 VanDerWaalsContact C-N 3.35Å; E657-A659 PolarHBondContact O-N 3.36Å; A659-R661 VanDerWaalsContact C-N 3.34Å; A659-R661 PolarHBondContact O-N 3.16Å; A659-I662 PolarHBondContact O-N 2.76Å; A659-S663 WeakPolarHBondContact O-CB 3.41Å; A659-S663 PolarHBondContact O-N 2.8Å; A659-S663 PolarHBondContact O-OG 3.08Å; A659-L691 HydrophobicContact CB-CD2 4.28Å
660	Q	86.2	Confident	85.5	Confident	94 Å²	94	58.7 Å²	58.7	44%	0.439	30%	0.297	S	S	.	.	H	α-helix	trans	-64.5	-34.1	175	-77.8	-176.3	30.3	0	0	113.6	V656 E657 T658 R664	V656-Q660 WeakPolarHBondContact O-CB 3.49Å; V656-Q660 VanDerWaalsContact O-CG 3.3Å; V656-Q660 WeakPolarHBondContact O-CG 3.46Å; V656-Q660 PolarHBondContact O-N 2.84Å; E657-Q660 PolarHBondContact O-N 2.97Å; T658-Q660 PolarHBondContact O-N 3.39Å; Q660-R664 WeakPolarHBondContact O-CD 3.28Å; Q660-R664 VanDerWaalsContact O-CG 3.27Å; Q660-R664 WeakPolarHBondContact O-CG 3.23Å; Q660-R664 PolarHBondContact O-N 3.18Å
661	R	86.9	Confident	85.1	Confident	88 Å²	88	57.7 Å²	57.7	33%	0.332	29%	0.291	S	S	.	.	H	α-helix	trans	-68.8	-49.4	175.1	-70.9	169.3	71.4	-178.5	-4.4	110.3	F614 D615 E657 T658 A659 S663 R664	F614-R661 HydrophobicContact CE1-CB 4.38Å; F614-R661 VanDerWaalsContact CE1-NH2 3.31Å; F614-R661 HydrophobicContact CE2-CB 4.11Å; F614-R661 HydrophobicContact CZ-CB 3.62Å; D615-R661 IonicContact OD1-NH2 2.64Å; E657-R661 WeakPolarHBondContact O-CG 3.35Å; E657-R661 PolarHBondContact O-N 3.31Å; E657-R661 IonicContact OE1-NH1 3.59Å; E657-R661 PolarHBondContact OE1-NH1 2.92Å; T658-R661 PolarHBondContact O-N 2.87Å; A659-R661 VanDerWaalsContact C-N 3.34Å; A659-R661 PolarHBondContact O-N 3.16Å; R661-S663 VanDerWaalsContact C-N 3.3Å; R661-S663 PolarHBondContact O-N 3.39Å; R661-R664 PolarHBondContact O-N 3.36Å
662	I	87.4	Confident	84.8	Confident	0 Å²	0	58.3 Å²	58.3	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-55.3	-44.2	174.6	-67.3	170.9	0	0	0	111.2	F614 L648 L651 S652 T658 A659 R664 E665 V668 L691	F614-I662 HydrophobicContact CD2-CD1 4.25Å; F614-I662 HydrophobicContact CD2-CG1 3.85Å; F614-I662 HydrophobicContact CE2-CD1 4.4Å; F614-I662 HydrophobicContact CE2-CG1 3.52Å; L648-I662 HydrophobicContact CD2-CD1 4.3Å; L648-I662 HydrophobicContact CD2-CG2 4.29Å; L651-I662 HydrophobicContact CB-CD1 3.89Å; L651-I662 HydrophobicContact CD1-CD1 4.46Å; S652-I662 WeakPolarHBondContact OG-CD1 3.48Å; T658-I662 HydrophobicContact CG2-CD1 3.84Å; T658-I662 HydrophobicContact CG2-CG1 4.31Å; T658-I662 VanDerWaalsContact O-CG1 3.31Å; T658-I662 WeakPolarHBondContact O-CG1 3.44Å; T658-I662 PolarHBondContact O-N 3.2Å; A659-I662 PolarHBondContact O-N 2.76Å; I662-R664 PolarHBondContact O-N 2.82Å; I662-E665 PolarHBondContact O-N 3.13Å; I662-V668 HydrophobicContact CG2-CG1 3.92Å; I662-V668 HydrophobicContact CG2-CG2 4.23Å; I662-L691 HydrophobicContact CB-CD2 3.91Å; I662-L691 HydrophobicContact CG2-CD1 3.78Å; I662-L691 HydrophobicContact CG2-CD2 3.65Å; I662-L691 HydrophobicContact CG2-CG 4.37Å
663	S	85.3	Confident	84.5	Confident	37 Å²	37	65.5 Å²	65.5	26%	0.259	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-12.4	177.8	-64	0	0	0	0	115.1	A659 R661 N669 L691	A659-S663 WeakPolarHBondContact O-CB 3.41Å; A659-S663 PolarHBondContact O-N 2.8Å; A659-S663 PolarHBondContact O-OG 3.08Å; R661-S663 VanDerWaalsContact C-N 3.3Å; R661-S663 PolarHBondContact O-N 3.39Å; S663-N669 PolarHBondContact O-ND2 3.18Å; S663-L691 WeakPolarHBondContact OG-CB 3.5Å; S663-L691 PolarHBondContact OG-O 3.47Å
664	R	84.7	Confident	84.6	Confident	161 Å²	161	67 Å²	67	61%	0.608	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-15	176	-72	166.3	-171.5	138.7	10.1	113.1	Q660 R661 I662 T666	Q660-R664 WeakPolarHBondContact O-CD 3.28Å; Q660-R664 VanDerWaalsContact O-CG 3.27Å; Q660-R664 WeakPolarHBondContact O-CG 3.23Å; Q660-R664 PolarHBondContact O-N 3.18Å; R661-R664 PolarHBondContact O-N 3.36Å; I662-R664 PolarHBondContact O-N 2.82Å; R664-T666 PolarHBondContact O-N 2.96Å
665	E	84.3	Confident	85	Confident	41 Å²	41	70.3 Å²	70.3	19%	0.192	34%	0.342	C	S	.	.			trans	-69.9	128.8	-179.5	-65.5	-58.4	155.9	0	0	111.5	V618 I662 A667 V668 N669	V618-E665 HydrophobicContact CG1-CG 3.65Å; I662-E665 PolarHBondContact O-N 3.13Å; E665-A667 PolarHBondContact O-N 2.94Å; E665-V668 HydrophobicContact CB-CB 4.07Å; E665-V668 HydrophobicContact CB-CG2 3.76Å; E665-V668 HydrophobicContact CG-CG2 4.49Å; E665-V668 PolarHBondContact O-N 3.49Å; E665-N669 PolarHBondContact O-N 3.28Å; E665-N669 PolarHBondContact O-ND2 3.18Å
666	T	81.8	Confident	85.2	Confident	96 Å²	96	68.9 Å²	68.9	59%	0.589	33%	0.332	S	S	*	.	H	α-helix	trans	-61.4	-46.1	-179.6	50.8	0	0	0	0	111.3	R664 V668 N669 D670	R664-T666 PolarHBondContact O-N 2.96Å; T666-V668 VanDerWaalsContact C-N 3.27Å; T666-V668 PolarHBondContact O-N 3Å; T666-N669 CarbonylContact O-C 3.3Å; T666-N669 PolarHBondContact O-N 3.23Å; T666-D670 PolarHBondContact O-N 3.41Å
667	A	81.6	Confident	85.4	Confident	6 Å²	6	72.5 Å²	72.5	5%	0.05	34%	0.342	C	S	.	.	H	α-helix	trans	-58.4	-36.2	178.6	0	0	0	0	0	113.3	L626 L627 L630 E665 M671	L626-A667 HydrophobicContact CD2-CB 4.15Å; L626-A667 HydrophobicContact CG-CB 4.38Å; L627-A667 HydrophobicContact CD2-CB 3.61Å; L627-A667 HydrophobicContact CG-CB 4.19Å; L630-A667 HydrophobicContact CD1-CB 3.9Å; L630-A667 WeakPolarHBondContact CD1-O 3.26Å; E665-A667 PolarHBondContact O-N 2.94Å; A667-M671 WeakPolarHBondContact O-CB 3.49Å; A667-M671 PolarHBondContact O-N 3.37Å; A667-M671 VanDerWaalsContact O-N 3.12Å
668	V	84.8	Confident	85.6	Confident	1 Å²	1	69.2 Å²	69.2	1%	0.006	34%	0.342	C	S	.	.	H	α-helix	trans	-73	-41.2	176	179.5	0	0	0	0	110.4	L626 L648 I662 E665 T666 M671 L672 L691	L626-V668 HydrophobicContact CD2-CG2 3.84Å; L648-V668 HydrophobicContact CD1-CG2 4.42Å; I662-V668 HydrophobicContact CG2-CG1 3.92Å; I662-V668 HydrophobicContact CG2-CG2 4.23Å; E665-V668 HydrophobicContact CB-CB 4.07Å; E665-V668 HydrophobicContact CB-CG2 3.76Å; E665-V668 HydrophobicContact CG-CG2 4.49Å; E665-V668 PolarHBondContact O-N 3.49Å; T666-V668 VanDerWaalsContact C-N 3.27Å; T666-V668 PolarHBondContact O-N 3Å; V668-M671 HydrophobicContact CG1-CE 3.93Å; V668-M671 WeakPolarHBondContact O-CB 3.45Å; V668-M671 PolarHBondContact O-N 2.91Å; V668-L672 HydrophobicContact CG1-CD1 4.17Å; V668-L672 HydrophobicContact CG1-CG 4.44Å; V668-L672 WeakPolarHBondContact O-CB 3.39Å; V668-L672 VanDerWaalsContact O-CG 3.26Å; V668-L672 WeakPolarHBondContact O-CG 3.31Å; V668-L672 PolarHBondContact O-N 3.49Å; V668-L691 HydrophobicContact CG1-CD1 4.05Å
669	N	84.5	Confident	85.7	Confident	62 Å²	62	74.8 Å²	74.8	33%	0.332	36%	0.364	S	S	.	.	H	α-helix	trans	-64.4	-45	175.7	-78.7	-76.6	0	0	0	112.1	S663 E665 T666 M671 L672 Q673	S663-N669 PolarHBondContact O-ND2 3.18Å; E665-N669 PolarHBondContact O-N 3.28Å; E665-N669 PolarHBondContact O-ND2 3.18Å; T666-N669 CarbonylContact O-C 3.3Å; T666-N669 PolarHBondContact O-N 3.23Å; N669-M671 VanDerWaalsContact C-N 3.31Å; N669-M671 PolarHBondContact O-N 3.13Å; N669-L672 CarbonylContact O-C 3.47Å; N669-L672 WeakPolarHBondContact O-CA 3.33Å; N669-L672 PolarHBondContact O-N 3.44Å; N669-Q673 WeakPolarHBondContact O-CG 3.11Å; N669-Q673 PolarHBondContact O-N 2.89Å
670	D	83.2	Confident	85.8	Confident	99 Å²	99	74.3 Å²	74.3	53%	0.529	36%	0.36	S	S	.	.	H	α-helix	trans	-59.5	-42.4	176	-68.4	-25.8	0	0	0	111.5	T666 Q673 K674	T666-D670 PolarHBondContact O-N 3.41Å; D670-Q673 PolarHBondContact O-N 3.26Å; D670-K674 WeakPolarHBondContact O-CG 3.46Å; D670-K674 PolarHBondContact O-N 3.44Å
671	M	85.7	Confident	86	Confident	2 Å²	2	75.2 Å²	75.2	1%	0.01	36%	0.363	C	S	.	.	H	α-helix	trans	-60.1	-46.8	170.5	176.7	-164	68.4	0	0	111.3	L630 M641 L648 A667 V668 N669 Q673 K674 Y676 L687	L630-M671 HydrophobicContact CD1-CB 4.47Å; L630-M671 HydrophobicContact CD2-CB 4.14Å; L630-M671 HydrophobicContact CD2-CG 3.97Å; L630-M671 HydrophobicContact CD2-SD 3.74Å; M641-M671 HydrophobicContact CE-CG 4.13Å; M641-M671 HydrophobicContact CE-SD 3.59Å; M641-M671 VanDerWaalsContact CE-SD 3.59Å; M641-M671 HydrophobicContact SD-CG 4.25Å; M641-M671 HydrophobicContact SD-SD 4.46Å; L648-M671 HydrophobicContact CD1-CE 4.02Å; A667-M671 WeakPolarHBondContact O-CB 3.49Å; A667-M671 PolarHBondContact O-N 3.37Å; A667-M671 VanDerWaalsContact O-N 3.12Å; V668-M671 HydrophobicContact CG1-CE 3.93Å; V668-M671 WeakPolarHBondContact O-CB 3.45Å; V668-M671 PolarHBondContact O-N 2.91Å; N669-M671 VanDerWaalsContact C-N 3.31Å; N669-M671 PolarHBondContact O-N 3.13Å; M671-Q673 PolarHBondContact O-N 3.49Å; M671-K674 PolarHBondContact O-N 3.37Å; M671-Y676 WeakPolarHBondContact O-CE2 3.23Å; M671-L687 HydrophobicContact CE-CD2 3.37Å
672	L	86.9	Confident	86.3	Confident	14 Å²	14	77.5 Å²	77.5	7%	0.073	38%	0.377	C	S	.	.	H	α-helix	trans	-65.3	-19.3	178.9	-71.3	173	0	0	0	114.1	V668 N669 V684 L687 R688 L691	V668-L672 HydrophobicContact CG1-CD1 4.17Å; V668-L672 HydrophobicContact CG1-CG 4.44Å; V668-L672 WeakPolarHBondContact O-CB 3.39Å; V668-L672 VanDerWaalsContact O-CG 3.26Å; V668-L672 WeakPolarHBondContact O-CG 3.31Å; V668-L672 PolarHBondContact O-N 3.49Å; N669-L672 CarbonylContact O-C 3.47Å; N669-L672 WeakPolarHBondContact O-CA 3.33Å; N669-L672 PolarHBondContact O-N 3.44Å; L672-V684 HydrophobicContact CD2-CG1 4.24Å; L672-L687 HydrophobicContact CD2-CD2 4.3Å; L672-L687 HydrophobicContact CD2-CG 4.36Å; L672-R688 HydrophobicContact CD2-CB 4.01Å; L672-R688 HydrophobicContact CD2-CG 4.38Å; L672-R688 PolarHBondContact O-NH2 3.11Å; L672-L691 HydrophobicContact CD1-CD1 4.04Å
673	Q	85.6	Confident	86.6	Confident	157 Å²	157	78.1 Å²	78.1	73%	0.734	38%	0.383	S	S	*	.	H	α-helix	trans	-92.4	-18	175	-61.8	-58	-25.6	0	0	113.9	N669 D670 M671	N669-Q673 WeakPolarHBondContact O-CG 3.11Å; N669-Q673 PolarHBondContact O-N 2.89Å; D670-Q673 PolarHBondContact O-N 3.26Å; M671-Q673 PolarHBondContact O-N 3.49Å
674	K	85.8	Confident	86.9	Confident	106 Å²	106	76.4 Å²	76.4	46%	0.461	37%	0.371	S	S	.	.	S	Bend	trans	-66.1	146.1	175.3	-78.5	171.3	-176.2	-179.9	0	111	D670 M671 Y676	D670-K674 WeakPolarHBondContact O-CG 3.46Å; D670-K674 PolarHBondContact O-N 3.44Å; M671-K674 PolarHBondContact O-N 3.37Å; K674-Y676 HydrophobicContact CB-CD2 4.29Å; K674-Y676 HydrophobicContact CB-CE2 3.49Å; K674-Y676 VanDerWaalsContact CB-CE2 3.49Å; K674-Y676 WeakPolarHBondContact O-CD2 3.45Å
675	K	85.4	Confident	87.2	Confident	209 Å²	209	72.8 Å²	72.8	91%	0.909	36%	0.361	S	S	*	.			trans	-85.2	133.6	170.8	-68.5	-177.1	179.9	178.5	0	109.5
676	Y	87.4	Confident	87.7	Confident	31 Å²	31	73.9 Å²	73.9	12%	0.122	37%	0.366	C	S	.	.			trans	-129.2	163	176.2	-62.2	-89	0	0	0	110.3	S637 M641 M671 K674 A680 K681 V684	S637-Y676 WeakPolarHBondContact OG-CE1 3.45Å; M641-Y676 HydrophobicContact CG-CD1 4.29Å; M641-Y676 HydrophobicContact CG-CE1 3.75Å; M641-Y676 HydrophobicContact SD-CD1 4.48Å; M641-Y676 HydrophobicContact SD-CE1 3.47Å; M641-Y676 WeakPolarHBondContact SD-CE1 3.26Å; M641-Y676 VanDerWaalsContact SD-CZ 3.6Å; M641-Y676 PolarHBondContact SD-OH 3.46Å; M671-Y676 WeakPolarHBondContact O-CE2 3.23Å; K674-Y676 HydrophobicContact CB-CD2 4.29Å; K674-Y676 HydrophobicContact CB-CE2 3.49Å; K674-Y676 VanDerWaalsContact CB-CE2 3.49Å; K674-Y676 WeakPolarHBondContact O-CD2 3.45Å; Y676-A680 HydrophobicContact CD1-CB 4.06Å; Y676-A680 HydrophobicContact CG-CB 4.35Å; Y676-K681 WeakPolarHBondContact O-CB 3.22Å; Y676-V684 HydrophobicContact CD2-CB 4.37Å; Y676-V684 HydrophobicContact CD2-CG1 4.3Å; Y676-V684 HydrophobicContact CD2-CG2 3.85Å; Y676-V684 HydrophobicContact CE2-CG1 4.46Å; Y676-V684 HydrophobicContact CE2-CG2 3.9Å; Y676-V684 HydrophobicContact CG-CG2 4.43Å
677	E	86.8	Confident	88.2	Confident	172 Å²	172	69.3 Å²	69.3	80%	0.804	34%	0.338	S	S	*	.			trans	-126.1	163.8	177.9	-60.1	-170.7	173.3	0	0	110.9	A680 K681	E677-A680 PolarHBondContact O-N 3.01Å; E677-K681 PolarHBondContact O-N 2.82Å
678	G	89.4	Confident	88.7	Confident	53 Å²	53	73 Å²	73	55%	0.546	35%	0.35	S	S	.	.	H	α-helix	trans	52.3	-142.3	-178.4	0	0	0	0	0	114.2	A680 K681 E682	G678-A680 PolarHBondContact O-N 3.38Å; G678-K681 WeakPolarHBondContact O-CB 3.41Å; G678-K681 PolarHBondContact O-N 2.77Å; G678-E682 PolarHBondContact O-N 3.17Å
679	K	88.5	Confident	88.9	Confident	129 Å²	129	76.1 Å²	76.1	56%	0.561	38%	0.377	S	S	*	.	H	α-helix	trans	-57.4	-31.4	-177.7	-63.9	-172.6	177.5	-173.1	0	113.7	P642 K681 E682 A683	P642-K679 HydrophobicContact CG-CB 3.94Å; K679-K681 VanDerWaalsContact C-N 3.33Å; K679-E682 PolarHBondContact O-N 3.46Å; K679-A683 PolarHBondContact O-N 2.9Å; K679-A683 VanDerWaalsContact O-N 3.11Å
680	A	89.1	Confident	89.2	Confident	2 Å²	2	74 Å²	74	2%	0.017	37%	0.366	C	S	.	.	H	α-helix	trans	-64.8	-39.1	177.7	0	0	0	0	0	111.4	M641 Y676 E677 G678 V684	M641-A680 HydrophobicContact CB-CB 3.9Å; Y676-A680 HydrophobicContact CD1-CB 4.06Å; Y676-A680 HydrophobicContact CG-CB 4.35Å; E677-A680 PolarHBondContact O-N 3.01Å; G678-A680 PolarHBondContact O-N 3.38Å; A680-V684 WeakPolarHBondContact O-CB 3.27Å; A680-V684 VanDerWaalsContact O-CG2 3.27Å; A680-V684 WeakPolarHBondContact O-CG2 3.28Å; A680-V684 PolarHBondContact O-N 3.09Å; A680-V684 VanDerWaalsContact O-N 3.11Å
681	K	91.4	Very high	89.4	Confident	114 Å²	114	70 Å²	70	50%	0.496	34%	0.344	S	S	.	.	H	α-helix	trans	-60.9	-52.3	173.1	-170.8	-175.8	173.5	-175.5	0	111.2	Y676 E677 G678 K679 A683 V684 E685	Y676-K681 WeakPolarHBondContact O-CB 3.22Å; E677-K681 PolarHBondContact O-N 2.82Å; G678-K681 WeakPolarHBondContact O-CB 3.41Å; G678-K681 PolarHBondContact O-N 2.77Å; K679-K681 VanDerWaalsContact C-N 3.33Å; K681-A683 VanDerWaalsContact C-N 3.28Å; K681-A683 PolarHBondContact O-N 3.27Å; K681-V684 PolarHBondContact O-N 2.98Å; K681-V684 VanDerWaalsContact O-N 3.13Å; K681-E685 HydrophobicContact CG-CG 4.47Å; K681-E685 WeakPolarHBondContact O-CG 3.26Å; K681-E685 PolarHBondContact O-N 3.01Å
682	E	92.6	Very high	89.1	Confident	135 Å²	135	72.7 Å²	72.7	63%	0.631	36%	0.364	S	S	*	.	H	α-helix	trans	-55.8	-42.8	-177.3	-64.6	169.8	168.2	0	0	112.1	G678 K679 E685 E686	G678-E682 PolarHBondContact O-N 3.17Å; K679-E682 PolarHBondContact O-N 3.46Å; E682-E685 PolarHBondContact O-N 3.26Å; E682-E686 PolarHBondContact O-N 2.82Å
683	A	93	Very high	87.9	Confident	13 Å²	13	78.2 Å²	78.2	11%	0.107	40%	0.4	C	S	.	.	H	α-helix	trans	-73.1	-33.3	178.8	0	0	0	0	0	113.7	P642 C645 K679 K681 E685 E686 L687	P642-A683 HydrophobicContact CB-CB 4.17Å; C645-A683 HydrophobicContact CB-CB 3.75Å; C645-A683 WeakPolarHBondContact CB-O 3.45Å; K679-A683 PolarHBondContact O-N 2.9Å; K679-A683 VanDerWaalsContact O-N 3.11Å; K681-A683 VanDerWaalsContact C-N 3.28Å; K681-A683 PolarHBondContact O-N 3.27Å; A683-E685 VanDerWaalsContact C-N 3.35Å; A683-E686 PolarHBondContact O-N 2.63Å; A683-L687 WeakPolarHBondContact O-CB 3.31Å; A683-L687 PolarHBondContact O-N 3.04Å
684	V	91.8	Very high	86.3	Confident	2 Å²	2	76.5 Å²	76.5	1%	0.012	39%	0.387	C	S	.	.	H	α-helix	trans	-68.1	-35.3	172.4	168	0	0	0	0	111	L672 Y676 A680 K681 R688	L672-V684 HydrophobicContact CD2-CG1 4.24Å; Y676-V684 HydrophobicContact CD2-CB 4.37Å; Y676-V684 HydrophobicContact CD2-CG1 4.3Å; Y676-V684 HydrophobicContact CD2-CG2 3.85Å; Y676-V684 HydrophobicContact CE2-CG1 4.46Å; Y676-V684 HydrophobicContact CE2-CG2 3.9Å; Y676-V684 HydrophobicContact CG-CG2 4.43Å; A680-V684 WeakPolarHBondContact O-CB 3.27Å; A680-V684 VanDerWaalsContact O-CG2 3.27Å; A680-V684 WeakPolarHBondContact O-CG2 3.28Å; A680-V684 PolarHBondContact O-N 3.09Å; A680-V684 VanDerWaalsContact O-N 3.11Å; K681-V684 PolarHBondContact O-N 2.98Å; K681-V684 VanDerWaalsContact O-N 3.13Å; V684-R688 WeakPolarHBondContact O-CB 3.48Å; V684-R688 PolarHBondContact O-N 3.48Å
685	E	92.4	Very high	84.3	Confident	85 Å²	85	74.9 Å²	74.9	40%	0.397	39%	0.389	S	S	.	.	H	α-helix	trans	-68.2	-43.2	170.7	-61.9	-57	148	0	0	112.3	K681 E682 A683 L687 R688 A689	K681-E685 HydrophobicContact CG-CG 4.47Å; K681-E685 WeakPolarHBondContact O-CG 3.26Å; K681-E685 PolarHBondContact O-N 3.01Å; E682-E685 PolarHBondContact O-N 3.26Å; A683-E685 VanDerWaalsContact C-N 3.35Å; E685-L687 VanDerWaalsContact C-N 3.27Å; E685-L687 PolarHBondContact O-N 3.24Å; E685-R688 PolarHBondContact O-N 3.44Å; E685-R688 IonicContact OE1-CZ 2.84Å; E685-R688 IonicContact OE1-NH1 2.71Å; E685-R688 PolarHBondContact OE1-NH1 3.27Å; E685-R688 IonicContact OE1-NH2 3.87Å; E685-R688 IonicContact OE2-CZ 3.28Å; E685-R688 IonicContact OE2-NH1 2.88Å; E685-R688 PolarHBondContact OE2-NH1 3.26Å; E685-A689 WeakPolarHBondContact O-CB 3.3Å; E685-A689 PolarHBondContact O-N 2.81Å
686	E	93.6	Very high	82.2	Confident	64 Å²	64	70.4 Å²	70.4	30%	0.299	38%	0.384	S	S	.	.	H	α-helix	trans	-56.4	-44.2	173.1	-170.7	-168.7	174.2	0	0	110.4	R646 V649 K653 E682 A683 A689 T690	R646-E686 IonicContact NE-OE2 3.6Å; R646-E686 PolarHBondContact NE-OE2 3.28Å; V649-E686 WeakPolarHBondContact CG1-OE1 3.28Å; V649-E686 HydrophobicContact CG2-CG 4.19Å; K653-E686 IonicContact NZ-OE1 3.85Å; K653-E686 PolarHBondContact NZ-OE1 3.08Å; E682-E686 PolarHBondContact O-N 2.82Å; A683-E686 PolarHBondContact O-N 2.63Å; E686-A689 PolarHBondContact O-N 2.87Å; E686-T690 WeakPolarHBondContact O-CB 3.39Å; E686-T690 PolarHBondContact O-N 3.03Å; E686-T690 PolarHBondContact O-OG1 3.28Å
687	L	92.8	Very high	79.9	Confident	0 Å²	0	75.6 Å²	75.6	0%	0	41%	0.409	C	S	.	.	H	α-helix	trans	-66.1	-45.6	178	-177.5	63.6	0	0	0	112	C645 L648 V649 M671 L672 A683 E685 A689 T690 L691	C645-L687 HydrophobicContact CB-CB 4.37Å; C645-L687 HydrophobicContact CB-CD2 4.44Å; L648-L687 HydrophobicContact CB-CD1 3.61Å; L648-L687 HydrophobicContact CB-CD2 4.07Å; L648-L687 HydrophobicContact CD1-CD2 3.82Å; V649-L687 HydrophobicContact CB-CD1 4.49Å; V649-L687 HydrophobicContact CG2-CB 3.86Å; V649-L687 HydrophobicContact CG2-CD1 3.7Å; V649-L687 HydrophobicContact CG2-CG 4.39Å; M671-L687 HydrophobicContact CE-CD2 3.37Å; L672-L687 HydrophobicContact CD2-CD2 4.3Å; L672-L687 HydrophobicContact CD2-CG 4.36Å; A683-L687 WeakPolarHBondContact O-CB 3.31Å; A683-L687 PolarHBondContact O-N 3.04Å; E685-L687 VanDerWaalsContact C-N 3.27Å; E685-L687 PolarHBondContact O-N 3.24Å; L687-A689 VanDerWaalsContact C-N 3.31Å; L687-A689 PolarHBondContact O-N 2.85Å; L687-T690 PolarHBondContact O-N 3.06Å; L687-T690 VanDerWaalsContact O-N 3.09Å; L687-L691 HydrophobicContact CD1-CD1 3.68Å; L687-L691 HydrophobicContact CD1-CD2 4.44Å; L687-L691 HydrophobicContact CD1-CG 3.76Å; L687-L691 HydrophobicContact CD2-CD1 4.3Å; L687-L691 HydrophobicContact CG-CD1 3.72Å; L687-L691 HydrophobicContact CG-CG 4.17Å; L687-L691 WeakPolarHBondContact O-CB 3.4Å; L687-L691 WeakPolarHBondContact O-CG 3.4Å; L687-L691 PolarHBondContact O-N 3.34Å
688	R	91.6	Very high	78	Confident	82 Å²	82	73.2 Å²	73.2	31%	0.309	40%	0.398	S	S	.	.	H	α-helix	trans	-61.1	-40.2	177.8	-160.6	-176.9	-63.6	124.2	-1.5	111.5	L672 V684 E685 T690 S692	L672-R688 HydrophobicContact CD2-CB 4.01Å; L672-R688 HydrophobicContact CD2-CG 4.38Å; L672-R688 PolarHBondContact O-NH2 3.11Å; V684-R688 WeakPolarHBondContact O-CB 3.48Å; V684-R688 PolarHBondContact O-N 3.48Å; E685-R688 PolarHBondContact O-N 3.44Å; E685-R688 IonicContact OE1-CZ 2.84Å; E685-R688 IonicContact OE1-NH1 2.71Å; E685-R688 PolarHBondContact OE1-NH1 3.27Å; E685-R688 IonicContact OE1-NH2 3.87Å; E685-R688 IonicContact OE2-CZ 3.28Å; E685-R688 IonicContact OE2-NH1 2.88Å; E685-R688 PolarHBondContact OE2-NH1 3.26Å; R688-T690 VanDerWaalsContact C-N 3.35Å; R688-S692 WeakPolarHBondContact O-CB 3.18Å; R688-S692 PolarHBondContact O-N 3.39Å; R688-S692 PolarHBondContact O-OG 3.1Å
689	A	90	Very high	75.9	Confident	68 Å²	68	75 Å²	75	56%	0.562	39%	0.392	S	S	*	.	H	α-helix	trans	-67.9	-31.9	174.6	0	0	0	0	0	113.2	E685 E686 L687	E685-A689 WeakPolarHBondContact O-CB 3.3Å; E685-A689 PolarHBondContact O-N 2.81Å; E686-A689 PolarHBondContact O-N 2.87Å; L687-A689 VanDerWaalsContact C-N 3.31Å; L687-A689 PolarHBondContact O-N 2.85Å
690	T	89.9	Confident	73.6	Confident	17 Å²	17	73.7 Å²	73.7	10%	0.104	39%	0.391	C	S	.	.	H	α-helix	trans	-76.6	-37.6	177.7	-57.7	0	0	0	0	112.5	V649 K653 E686 L687 R688	V649-T690 HydrophobicContact CG1-CG2 4.49Å; K653-T690 HydrophobicContact CG-CG2 4.38Å; E686-T690 WeakPolarHBondContact O-CB 3.39Å; E686-T690 PolarHBondContact O-N 3.03Å; E686-T690 PolarHBondContact O-OG1 3.28Å; L687-T690 PolarHBondContact O-N 3.06Å; L687-T690 VanDerWaalsContact O-N 3.09Å; R688-T690 VanDerWaalsContact C-N 3.35Å
691	L	87.4	Confident	71.4	Confident	14 Å²	14	78 Å²	78	7%	0.073	41%	0.41	C	S	.	.	H	α-helix	trans	-83.6	-18.4	180	-72.2	-178.8	0	0	0	114.2	S652 A659 I662 S663 V668 L672 L687	S652-L691 VanDerWaalsContact OG-CD2 3.28Å; S652-L691 WeakPolarHBondContact OG-CD2 3.45Å; A659-L691 HydrophobicContact CB-CD2 4.28Å; I662-L691 HydrophobicContact CB-CD2 3.91Å; I662-L691 HydrophobicContact CG2-CD1 3.78Å; I662-L691 HydrophobicContact CG2-CD2 3.65Å; I662-L691 HydrophobicContact CG2-CG 4.37Å; S663-L691 WeakPolarHBondContact OG-CB 3.5Å; S663-L691 PolarHBondContact OG-O 3.47Å; V668-L691 HydrophobicContact CG1-CD1 4.05Å; L672-L691 HydrophobicContact CD1-CD1 4.04Å; L687-L691 HydrophobicContact CD1-CD1 3.68Å; L687-L691 HydrophobicContact CD1-CD2 4.44Å; L687-L691 HydrophobicContact CD1-CG 3.76Å; L687-L691 HydrophobicContact CD2-CD1 4.3Å; L687-L691 HydrophobicContact CG-CD1 3.72Å; L687-L691 HydrophobicContact CG-CG 4.17Å; L687-L691 WeakPolarHBondContact O-CB 3.4Å; L687-L691 WeakPolarHBondContact O-CG 3.4Å; L687-L691 PolarHBondContact O-N 3.34Å
692	S	80	Confident	69	Low	60 Å²	60	77.5 Å²	77.5	42%	0.42	41%	0.41	S	S	.	.	S	Bend	trans	-57.3	137	173	-71.3	0	0	0	0	110.2	R688 R694	R688-S692 WeakPolarHBondContact O-CB 3.18Å; R688-S692 PolarHBondContact O-N 3.39Å; R688-S692 PolarHBondContact O-OG 3.1Å; S692-R694 PolarHBondContact O-N 3.47Å
693	P	61.7	Low	66.7	Low	129 Å²	129	74.5 Å²	74.5	84%	0.838	40%	0.398	S	S	*	.			trans	-64.6	99.9	-177.7	26.1	-34	0	0	0	110.3	S695	P693-S695 PolarHBondContact O-N 3.25Å
694	R	52.3	Low	64.4	Low	121 Å²	121	78.9 Å²	78.9	46%	0.457	42%	0.415	S	S	.	.			trans	-57	107.8	174.2	-74.6	-178.9	174.1	-179.1	-4.7	109.1	S692 S696	S692-R694 PolarHBondContact O-N 3.47Å; R694-S696 PolarHBondContact O-N 3.01Å
695	S	42.2	Very low	62.4	Low	72 Å²	72	82.8 Å²	82.8	50%	0.503	44%	0.439	S	S	.	.			trans	-54	135.5	172.5	69.1	0	0	0	0	109.6	P693 H697 Q698	P693-S695 PolarHBondContact O-N 3.25Å; S695-H697 PolarHBondContact O-N 3.32Å; S695-Q698 PolarHBondContact O-N 3Å
696	S	41.2	Very low	60.1	Low	115 Å²	115	84 Å²	84	80%	0.804	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-4.9	-166.1	-43.9	0	0	0	0	115.3	R694	R694-S696 PolarHBondContact O-N 3.01Å
697	H	40.9	Very low	57.9	Low	140 Å²	140	85.6 Å²	85.6	65%	0.648	45%	0.453	S	S	*	.	H	α-helix	trans	-75.6	-33.2	176.5	-72.7	-85.6	0	0	0	114.1	S695 L700 E701	S695-H697 PolarHBondContact O-N 3.32Å; H697-L700 WeakPolarHBondContact O-CB 3.42Å; H697-L700 PolarHBondContact O-N 3.03Å; H697-E701 PolarHBondContact O-N 3.2Å
698	Q	46.3	Very low	55.6	Low	123 Å²	123	87.9 Å²	87.9	58%	0.575	47%	0.472	S	S	*	.	H	α-helix	trans	-70.4	-37.9	-170.1	-79	-176.8	-31.2	0	0	113.9	S695 L700 E701 E702	S695-Q698 PolarHBondContact O-N 3Å; Q698-L700 PolarHBondContact O-N 3.4Å; Q698-E701 PolarHBondContact O-N 3Å; Q698-E702 PolarHBondContact O-N 3.13Å; Q698-E702 VanDerWaalsContact O-N 3.17Å
699	H	44	Very low	53.3	Low	90 Å²	90	91.6 Å²	91.6	42%	0.417	49%	0.491	S	S	.	.	H	α-helix	trans	-58.2	-36.6	174.2	-108.5	-80.9	0	0	0	112	E701 D703	H699-E701 VanDerWaalsContact C-N 3.35Å; H699-E701 PolarHBondContact O-N 3.33Å; H699-D703 PolarHBondContact O-N 3.48Å; H699-D703 VanDerWaalsContact O-N 3.14Å
700	L	41.4	Very low	51	Low	102 Å²	102	94.2 Å²	94.2	53%	0.534	50%	0.495	S	S	.	.	H	α-helix	trans	-67.7	-33.7	-178.7	-161.9	71.6	0	0	0	112.3	H697 Q698 K704	H697-L700 WeakPolarHBondContact O-CB 3.42Å; H697-L700 PolarHBondContact O-N 3.03Å; Q698-L700 PolarHBondContact O-N 3.4Å; L700-K704 WeakPolarHBondContact O-CB 3.4Å; L700-K704 VanDerWaalsContact O-CD 3.3Å; L700-K704 WeakPolarHBondContact O-CD 3.39Å; L700-K704 WeakPolarHBondContact O-CG 3.27Å; L700-K704 PolarHBondContact O-N 3.23Å; L700-K704 VanDerWaalsContact O-N 3.09Å
701	E	42.2	Very low	48.7	Very low	92 Å²	92	99.5 Å²	99.5	43%	0.43	52%	0.521	S	S	.	.	H	α-helix	trans	-81.5	-33.2	178.5	-59.4	-48.5	135.3	0	0	113.3	H697 Q698 H699 K704 T705	H697-E701 PolarHBondContact O-N 3.2Å; Q698-E701 PolarHBondContact O-N 3Å; H699-E701 VanDerWaalsContact C-N 3.35Å; H699-E701 PolarHBondContact O-N 3.33Å; E701-K704 IonicContact OE1-NZ 2.63Å; E701-K704 PolarHBondContact OE1-NZ 2.78Å; E701-K704 WeakPolarHBondContact OE2-CD 3.31Å; E701-K704 IonicContact OE2-NZ 2.72Å; E701-K704 PolarHBondContact OE2-NZ 2.97Å; E701-T705 WeakPolarHBondContact O-CB 3.39Å; E701-T705 WeakPolarHBondContact O-CG2 3.1Å; E701-T705 PolarHBondContact O-N 2.93Å; E701-T705 PolarHBondContact O-OG1 2.86Å
702	E	42.3	Very low	46.6	Very low	103 Å²	103	105.4 Å²	105.4	48%	0.481	55%	0.553	S	S	.	*	H	α-helix	trans	-65	-42	171.7	-76.6	-160.5	-175	0	0	112.1	Q698 T705 K706	Q698-E702 PolarHBondContact O-N 3.13Å; Q698-E702 VanDerWaalsContact O-N 3.17Å; E702-T705 WeakPolarHBondContact CA-OG1 3.45Å; E702-T705 PolarHBondContact O-N 3.44Å; E702-T705 PolarHBondContact O-OG1 3.18Å; E702-T705 VanDerWaalsContact O-OG1 3.05Å; E702-K706 WeakPolarHBondContact O-CD 3.3Å; E702-K706 VanDerWaalsContact O-CG 3.28Å; E702-K706 WeakPolarHBondContact O-CG 3.36Å; E702-K706 PolarHBondContact O-N 3.17Å; E702-K706 IonicContact OE2-NZ 2.76Å; E702-K706 PolarHBondContact OE2-NZ 3.1Å
703	D	44.5	Very low	44.8	Very low	72 Å²	72	109.2 Å²	109.2	39%	0.385	57%	0.568	S	S	.	*	H	α-helix	trans	-75.4	-31.5	179.1	-68.6	-20	0	0	0	112	H699 K706 N707	H699-D703 PolarHBondContact O-N 3.48Å; H699-D703 VanDerWaalsContact O-N 3.14Å; D703-K706 IonicContact OD1-NZ 3.18Å; D703-K706 PolarHBondContact OD1-NZ 2.97Å; D703-N707 WeakPolarHBondContact O-CB 3.41Å; D703-N707 PolarHBondContact O-N 3.45Å; D703-N707 PolarHBondContact O-ND2 3.45Å
704	K	44.5	Very low	43.5	Very low	105 Å²	105	109.3 Å²	109.3	46%	0.457	56%	0.561	S	S	.	*	H	α-helix	trans	-59	-47.3	166	-80.4	165.6	179.5	177.2	0	112	L700 E701 N707 A708	L700-K704 WeakPolarHBondContact O-CB 3.4Å; L700-K704 VanDerWaalsContact O-CD 3.3Å; L700-K704 WeakPolarHBondContact O-CD 3.39Å; L700-K704 WeakPolarHBondContact O-CG 3.27Å; L700-K704 PolarHBondContact O-N 3.23Å; L700-K704 VanDerWaalsContact O-N 3.09Å; E701-K704 IonicContact OE1-NZ 2.63Å; E701-K704 PolarHBondContact OE1-NZ 2.78Å; E701-K704 WeakPolarHBondContact OE2-CD 3.31Å; E701-K704 IonicContact OE2-NZ 2.72Å; E701-K704 PolarHBondContact OE2-NZ 2.97Å; K704-N707 PolarHBondContact O-N 3.21Å; K704-A708 VanDerWaalsContact O-CB 3.26Å; K704-A708 WeakPolarHBondContact O-CB 2.87Å; K704-A708 PolarHBondContact O-N 3.43Å
705	T	48.1	Very low	42.6	Very low	84 Å²	84	108.7 Å²	108.7	52%	0.515	57%	0.572	S	S	.	*	H	α-helix	trans	-72.1	-30.9	-176.9	48.4	0	0	0	0	113.2	E701 E702 K709	E701-T705 WeakPolarHBondContact O-CB 3.39Å; E701-T705 WeakPolarHBondContact O-CG2 3.1Å; E701-T705 PolarHBondContact O-N 2.93Å; E701-T705 PolarHBondContact O-OG1 2.86Å; E702-T705 WeakPolarHBondContact CA-OG1 3.45Å; E702-T705 PolarHBondContact O-N 3.44Å; E702-T705 PolarHBondContact O-OG1 3.18Å; E702-T705 VanDerWaalsContact O-OG1 3.05Å; T705-K709 PolarHBondContact O-N 2.93Å; T705-K709 VanDerWaalsContact O-N 3.16Å
706	K	45.9	Very low	42.3	Very low	111 Å²	111	115 Å²	115	48%	0.483	59%	0.591	S	S	.	*	H	α-helix	trans	-64.6	-49.9	168.2	-70.1	162.9	-162.4	154.9	0	111.5	E702 D703 A708 K709 L710	E702-K706 WeakPolarHBondContact O-CD 3.3Å; E702-K706 VanDerWaalsContact O-CG 3.28Å; E702-K706 WeakPolarHBondContact O-CG 3.36Å; E702-K706 PolarHBondContact O-N 3.17Å; E702-K706 IonicContact OE2-NZ 2.76Å; E702-K706 PolarHBondContact OE2-NZ 3.1Å; D703-K706 IonicContact OD1-NZ 3.18Å; D703-K706 PolarHBondContact OD1-NZ 2.97Å; K706-A708 PolarHBondContact O-N 3.47Å; K706-K709 PolarHBondContact O-N 2.86Å; K706-L710 PolarHBondContact O-N 3.28Å; K706-L710 VanDerWaalsContact O-N 3.08Å
707	N	45.8	Very low	41.8	Very low	97 Å²	97	114.1 Å²	114.1	52%	0.519	59%	0.585	S	S	.	*	H	α-helix	trans	-63.8	-38	178	-78.3	-68.4	0	0	0	112.7	D703 K704 K709 L710 L711	D703-N707 WeakPolarHBondContact O-CB 3.41Å; D703-N707 PolarHBondContact O-N 3.45Å; D703-N707 PolarHBondContact O-ND2 3.45Å; K704-N707 PolarHBondContact O-N 3.21Å; N707-K709 VanDerWaalsContact C-N 3.32Å; N707-K709 PolarHBondContact O-N 3Å; N707-L710 PolarHBondContact O-N 2.9Å; N707-L711 PolarHBondContact O-N 3.38Å
708	A	45	Very low	41.4	Very low	49 Å²	49	115.6 Å²	115.6	41%	0.405	60%	0.596	S	S	.	*	H	α-helix	trans	-64.9	-32.2	175.2	0	0	0	0	0	112.9	K704 K706 N712	K704-A708 VanDerWaalsContact O-CB 3.26Å; K704-A708 WeakPolarHBondContact O-CB 2.87Å; K704-A708 PolarHBondContact O-N 3.43Å; K706-A708 PolarHBondContact O-N 3.47Å; A708-N712 PolarHBondContact O-ND2 3Å
709	K	43.4	Very low	40.8	Very low	160 Å²	160	118.4 Å²	118.4	70%	0.696	61%	0.609	S	S	*	*	H	α-helix	trans	-70.7	-40.5	170.9	-78.3	-179.1	174.9	179.9	0	112	T705 K706 N707 L711 N712	T705-K709 PolarHBondContact O-N 2.93Å; T705-K709 VanDerWaalsContact O-N 3.16Å; K706-K709 PolarHBondContact O-N 2.86Å; N707-K709 VanDerWaalsContact C-N 3.32Å; N707-K709 PolarHBondContact O-N 3Å; K709-L711 PolarHBondContact O-N 2.71Å; K709-N712 PolarHBondContact O-N 2.9Å
710	L	42.4	Very low	39.9	Very low	123 Å²	123	120.1 Å²	120.1	64%	0.644	63%	0.63	S	S	*	*	H	α-helix	trans	-63	-41.3	179.7	-152.4	75.7	0	0	0	112.3	K706 N707 N712 L713	K706-L710 PolarHBondContact O-N 3.28Å; K706-L710 VanDerWaalsContact O-N 3.08Å; N707-L710 PolarHBondContact O-N 2.9Å; L710-N712 PolarHBondContact O-N 2.84Å; L710-L713 PolarHBondContact O-N 3.14Å
711	L	41.2	Very low	39.3	Very low	127 Å²	127	126.2 Å²	126.2	67%	0.665	65%	0.646	S	S	*	*	H	α-helix	trans	-62.9	-23.4	176.8	-82.2	163.7	0	0	0	114.3	N707 K709 L713	N707-L711 PolarHBondContact O-N 3.38Å; K709-L711 PolarHBondContact O-N 2.71Å; L711-L713 VanDerWaalsContact C-N 3.35Å
712	N	43.5	Very low	38.6	Very low	138 Å²	138	129 Å²	129	74%	0.738	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88	2.3	179.8	-79.6	-67.3	0	0	0	114	A708 K709 L710	A708-N712 PolarHBondContact O-ND2 3Å; K709-N712 PolarHBondContact O-N 2.9Å; L710-N712 PolarHBondContact O-N 2.84Å
713	L	40.9	Very low	37.8	Very low	140 Å²	140	128 Å²	128	73%	0.733	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.1	4.8	-178.6	-70.2	168.4	0	0	0	114.1	L710 L711	L710-L713 PolarHBondContact O-N 3.14Å; L711-L713 VanDerWaalsContact C-N 3.35Å
714	L	34.7	Very low	37	Very low	132 Å²	132	129.5 Å²	129.5	69%	0.691	71%	0.709	S	S	*	*	S	Bend	trans	-78.8	136.3	176.2	-74.1	167.7	0	0	0	112
715	P	34.6	Very low	36.1	Very low	107 Å²	107	133.6 Å²	133.6	70%	0.695	73%	0.727	S	S	*	*			trans	-64.9	143.5	-178.4	-23.6	34.5	0	0	0	114.5	S717	P715-S717 PolarHBondContact O-N 3.03Å
716	K	35.8	Very low	35.1	Very low	205 Å²	205	137.3 Å²	137.3	89%	0.891	74%	0.738	S	S	*	*	S	Bend	trans	-75.3	22.6	-180	-64	-178.1	176.1	178.4	0	114.8	L718	K716-L718 PolarHBondContact O-N 3.47Å
717	S	31.1	Very low	34.1	Very low	97 Å²	97	141.4 Å²	141.4	68%	0.678	76%	0.759	S	S	*	*			trans	-90.9	23.5	-163.1	58.3	0	0	0	0	116	P715	P715-S717 PolarHBondContact O-N 3.03Å
718	L	30.9	Very low	33.2	Very low	171 Å²	171	145 Å²	145	90%	0.895	77%	0.773	S	S	*	*			trans	-132.6	45.9	179.9	-76.2	172.9	0	0	0	112.9	K716	K716-L718 PolarHBondContact O-N 3.47Å
719	Q	35	Very low	32.2	Very low	181 Å²	181	150.5 Å²	150.5	85%	0.846	79%	0.794	S	S	*	*			trans	-125.8	76.3	171.5	-76.5	-167.5	-22.4	0	0	112.7
720	C	25.4	Very low	31.4	Very low	126 Å²	126	148.8 Å²	148.8	85%	0.851	80%	0.799	S	S	*	*			trans	-168.3	161.7	143.3	-97.4	0	0	0	0	110.4
721	R	28.1	Very low	31	Very low	230 Å²	230	148.2 Å²	148.2	87%	0.868	81%	0.805	S	S	*	*			cis	169.4	81.9	-30.5	-171.2	-176.3	-162.7	-163.3	6	107.8
722	T	27.6	Very low	30.4	Very low	151 Å²	151	148.7 Å²	148.7	93%	0.926	81%	0.814	S	S	*	*			trans	-150	149.9	161.3	43.6	0	0	0	0	108.9
723	G	25.7	Very low	29.6	Very low	81 Å²	81	150.6 Å²	150.6	84%	0.835	82%	0.822	S	S	*	*			cis	158.9	28.3	-4	0	0	0	0	0	116.3
724	A	26.3	Very low	28.9	Very low	105 Å²	105	154.7 Å²	154.7	87%	0.868	83%	0.828	S	S	*	*			trans	-137.5	167.6	179.5	0	0	0	0	0	111.6
725	K	26.4	Very low	28.7	Very low	191 Å²	191	159.8 Å²	159.8	83%	0.83	84%	0.839	S	S	*	*			trans	-117.1	150.7	-160.3	-80.4	-177	175.4	-177.8	0	114.6
726	H	26.4	Very low	28.4	Very low	161 Å²	161	160.6 Å²	160.6	75%	0.745	84%	0.842	S	S	*	*			trans	38.4	118.2	152	-74.5	-94.8	0	0	0	119.8
727	E	25.3	Very low	28.3	Very low	198 Å²	198	160.5 Å²	160.5	93%	0.925	84%	0.842	S	S	*	*				-148.9	164.7	105.6	-117.2	172.3	-172.5	0	0	110.2
728	E	27.8	Very low	28.5	Very low	173 Å²	173	163 Å²	163	81%	0.808	84%	0.843	S	S	*	*			trans	-99.7	136.4	-166.4	-59.8	-175.9	135.7	0	0	113.3
729	I	24.5	Very low	28.7	Very low	164 Å²	164	162.8 Å²	162.8	84%	0.841	84%	0.837	S	S	*	*			trans	-136.3	135	162.7	-60.1	-176.5	0	0	0	109
730	P	26.4	Very low	28.8	Very low	123 Å²	123	164.5 Å²	164.5	80%	0.799	84%	0.842	S	S	*	*			trans	-73.7	167.4	-169.4	-20.2	34.5	0	0	0	116.6	T732	P730-T732 PolarHBondContact O-N 2.87Å
731	S	32.7	Very low	29.6	Very low	112 Å²	112	164.9 Å²	164.9	78%	0.783	83%	0.829	S	S	*	*			trans	-70.2	116.7	-176.3	55.5	0	0	0	0	114.9
732	T	30.1	Very low	30.6	Very low	137 Å²	137	155.5 Å²	155.5	84%	0.84	80%	0.798	S	S	*	*				179.5	134.8	125.3	22	0	0	0	0	111.5	P730	P730-T732 PolarHBondContact O-N 2.87Å
733	I	25.6	Very low	31.5	Very low	177 Å²	177	155.1 Å²	155.1	91%	0.908	79%	0.79	S	S	*	*			trans	-163.2	148	145.4	-105.2	152.5	0	0	0	109.2
734	R	26.6	Very low	32.7	Very low	227 Å²	227	153.6 Å²	153.6	86%	0.857	77%	0.774	S	S	*	*			trans	-104.3	141.4	-173.7	-148.4	176.2	-71	163.5	-3.1	109.2	T736	R734-T736 PolarHBondContact O-N 3.06Å
735	Y	30.3	Very low	34	Very low	238 Å²	238	150 Å²	150	93%	0.933	74%	0.742	S	S	*	*			trans	-51.6	135.3	176.3	-90.6	-95	0	0	0	112.4
736	T	28.1	Very low	35.3	Very low	124 Å²	124	142.9 Å²	142.9	76%	0.761	71%	0.712	S	S	*	*			trans	-134	140.8	168.1	49.9	0	0	0	0	112	R734	R734-T736 PolarHBondContact O-N 3.06Å
737	K	34.3	Very low	36.6	Very low	203 Å²	203	142.3 Å²	142.3	88%	0.883	71%	0.707	S	S	*	*			trans	-90.8	96.8	179.7	-66.7	172.3	174.9	176.6	0	110.9
738	H	34.3	Very low	38	Very low	150 Å²	150	136.5 Å²	136.5	69%	0.694	69%	0.686	S	S	*	*			trans	-149.4	91.1	169.8	-83.3	-74.9	0	0	0	113.6
739	H	36.7	Very low	39.2	Very low	167 Å²	167	131.1 Å²	131.1	77%	0.773	66%	0.662	S	S	*	*	S	Bend	trans	-150	-14.3	160.8	-95.9	-65.9	0	0	0	115.7	F741 P742	H739-F741 VanDerWaalsContact C-N 3.34Å; H739-F741 PolarHBondContact O-N 3.26Å; H739-P742 WeakPolarHBondContact O-CD 3.34Å
740	F	37.2	Very low	40.6	Very low	217 Å²	217	128.6 Å²	128.6	95%	0.952	65%	0.649	S	S	*	*	S	Bend	trans	-84.7	6.4	-178.2	-104.4	-83.9	0	0	0	115.8
741	F	42	Very low	41.8	Very low	134 Å²	134	128.2 Å²	128.2	59%	0.588	64%	0.636	S	S	*	*			trans	-87.6	-22.4	-168.2	-138.2	-96.4	0	0	0	118.4	H739 V745 M776	H739-F741 VanDerWaalsContact C-N 3.34Å; H739-F741 PolarHBondContact O-N 3.26Å; F741-V745 HydrophobicContact CD1-CG2 4.11Å; F741-V745 HydrophobicContact CE1-CG2 4.13Å; F741-V745 WeakPolarHBondContact O-CG2 3.3Å; F741-M776 HydrophobicContact CE1-CE 3.91Å
742	P	47.8	Very low	42.8	Very low	33 Å²	33	125.9 Å²	125.9	21%	0.214	62%	0.616	C	S	.	*	H	α-helix	trans	-79.6	-35.1	-167.9	29.1	-33.8	0	0	0	114.9	H739 V745 I746	H739-P742 WeakPolarHBondContact O-CD 3.34Å; P742-V745 PolarHBondContact O-N 3.29Å; P742-I746 WeakPolarHBondContact O-CG1 3.39Å; P742-I746 PolarHBondContact O-N 3.17Å; P742-I746 VanDerWaalsContact O-N 3.11Å
743	L	47.1	Very low	43.9	Very low	142 Å²	142	124.3 Å²	124.3	74%	0.743	61%	0.606	S	S	*	*	H	α-helix	trans	-67.4	-48.7	-168.6	-82.2	164.4	0	0	0	113.7	V745 I746 F747	L743-V745 PolarHBondContact O-N 2.94Å; L743-I746 PolarHBondContact O-N 3.32Å; L743-F747 PolarHBondContact O-N 3.25Å
744	G	51.6	Low	45.1	Very low	49 Å²	49	120.9 Å²	120.9	51%	0.505	59%	0.594	S	S	.	*	H	α-helix	trans	-62.7	-32.4	178.4	0	0	0	0	0	112.9	F747 V748	G744-F747 PolarHBondContact O-N 3.03Å; G744-V748 WeakPolarHBondContact O-CG2 3.5Å; G744-V748 PolarHBondContact O-N 3.43Å
745	V	53.4	Low	46.3	Very low	31 Å²	31	114.1 Å²	114.1	19%	0.188	57%	0.571	C	S	.	*	H	α-helix	trans	-69.9	-41.3	177.5	175.2	0	0	0	0	111.6	F741 P742 L743 F747 V748 L749 I777	F741-V745 HydrophobicContact CD1-CG2 4.11Å; F741-V745 HydrophobicContact CE1-CG2 4.13Å; F741-V745 WeakPolarHBondContact O-CG2 3.3Å; P742-V745 PolarHBondContact O-N 3.29Å; L743-V745 PolarHBondContact O-N 2.94Å; V745-F747 VanDerWaalsContact C-N 3.31Å; V745-F747 PolarHBondContact O-N 3.5Å; V745-V748 PolarHBondContact O-N 3.31Å; V745-L749 HydrophobicContact CG1-CD1 4.48Å; V745-L749 WeakPolarHBondContact O-CG 3.37Å; V745-L749 PolarHBondContact O-N 3.37Å; V745-I777 HydrophobicContact CG1-CD1 3.28Å; V745-I777 HydrophobicContact CG1-CG1 3.72Å
746	I	53.9	Low	47.2	Very low	41 Å²	41	110.2 Å²	110.2	21%	0.21	56%	0.559	C	S	.	*	H	α-helix	trans	-63.1	-39.9	173.7	-68.4	166.2	0	0	0	110.6	P742 L743 L749 L750 I814	P742-I746 WeakPolarHBondContact O-CG1 3.39Å; P742-I746 PolarHBondContact O-N 3.17Å; P742-I746 VanDerWaalsContact O-N 3.11Å; L743-I746 PolarHBondContact O-N 3.32Å; I746-L749 PolarHBondContact O-N 3.07Å; I746-L750 HydrophobicContact CG2-CD1 3.97Å; I746-L750 WeakPolarHBondContact O-CG 3.39Å; I746-L750 PolarHBondContact O-N 3.01Å; I746-I814 HydrophobicContact CG1-CD1 4.39Å
747	F	53.6	Low	48.3	Very low	148 Å²	148	113.6 Å²	113.6	65%	0.649	57%	0.567	S	S	*	*	H	α-helix	trans	-62.4	-45	177.2	-162.5	-90.5	0	0	0	112.2	L743 G744 V745 L750 F751	L743-F747 PolarHBondContact O-N 3.25Å; G744-F747 PolarHBondContact O-N 3.03Å; V745-F747 VanDerWaalsContact C-N 3.31Å; V745-F747 PolarHBondContact O-N 3.5Å; F747-L750 PolarHBondContact O-N 3.47Å; F747-F751 WeakPolarHBondContact O-CB 3.43Å; F747-F751 PolarHBondContact O-N 3.39Å
748	V	54.5	Low	49.1	Very low	77 Å²	77	109.6 Å²	109.6	47%	0.467	55%	0.554	S	S	.	*	H	α-helix	trans	-61.2	-44.6	175.2	170.6	0	0	0	0	111.6	G744 V745 L750 F751 V752	G744-V748 WeakPolarHBondContact O-CG2 3.5Å; G744-V748 PolarHBondContact O-N 3.43Å; V745-V748 PolarHBondContact O-N 3.31Å; V748-L750 VanDerWaalsContact C-N 3.35Å; V748-L750 PolarHBondContact O-N 3.07Å; V748-F751 PolarHBondContact O-N 3.11Å; V748-V752 HydrophobicContact CG1-CG2 4.39Å; V748-V752 VanDerWaalsContact O-CG2 3.32Å; V748-V752 WeakPolarHBondContact O-CG2 3.4Å; V748-V752 PolarHBondContact O-N 3.35Å
749	L	52.5	Low	50.1	Low	60 Å²	60	105.6 Å²	105.6	31%	0.314	53%	0.532	S	S	.	.	H	α-helix	trans	-63	-38.5	178	-73.6	173.7	0	0	0	112.8	V745 I746 V753 I777	V745-L749 HydrophobicContact CG1-CD1 4.48Å; V745-L749 WeakPolarHBondContact O-CG 3.37Å; V745-L749 PolarHBondContact O-N 3.37Å; I746-L749 PolarHBondContact O-N 3.07Å; L749-V753 WeakPolarHBondContact O-CG2 3.42Å; L749-V753 PolarHBondContact O-N 3.06Å; L749-I777 HydrophobicContact CD1-CD1 4.23Å
750	L	54.3	Low	50.7	Low	110 Å²	110	103.8 Å²	103.8	58%	0.576	53%	0.529	S	S	*	.	H	α-helix	trans	-67.6	-44.2	174.8	-73.7	167.7	0	0	0	111.7	I746 F747 V748 V752 V753 V754	I746-L750 HydrophobicContact CG2-CD1 3.97Å; I746-L750 WeakPolarHBondContact O-CG 3.39Å; I746-L750 PolarHBondContact O-N 3.01Å; F747-L750 PolarHBondContact O-N 3.47Å; V748-L750 VanDerWaalsContact C-N 3.35Å; V748-L750 PolarHBondContact O-N 3.07Å; L750-V752 PolarHBondContact O-N 2.99Å; L750-V753 PolarHBondContact O-N 2.94Å; L750-V754 WeakPolarHBondContact O-CG2 3.45Å; L750-V754 PolarHBondContact O-N 3.39Å
751	F	51.7	Low	51.2	Low	116 Å²	116	100.1 Å²	100.1	51%	0.509	51%	0.514	S	S	.	.	H	α-helix	trans	-61.8	-42.7	-179.8	-167	-97.4	0	0	0	112.4	F747 V748 V753 V754 H755	F747-F751 WeakPolarHBondContact O-CB 3.43Å; F747-F751 PolarHBondContact O-N 3.39Å; V748-F751 PolarHBondContact O-N 3.11Å; F751-V753 VanDerWaalsContact C-N 3.29Å; F751-V753 PolarHBondContact O-N 3.34Å; F751-V754 PolarHBondContact O-N 3.41Å; F751-H755 PolarHBondContact O-N 3.49Å
752	V	53.3	Low	51.5	Low	63 Å²	63	97.8 Å²	97.8	38%	0.382	51%	0.506	S	S	.	.	H	α-helix	trans	-63.7	-30.8	176.3	168.9	0	0	0	0	112.6	V748 L750	V748-V752 HydrophobicContact CG1-CG2 4.39Å; V748-V752 VanDerWaalsContact O-CG2 3.32Å; V748-V752 WeakPolarHBondContact O-CG2 3.4Å; V748-V752 PolarHBondContact O-N 3.35Å; L750-V752 PolarHBondContact O-N 2.99Å
753	V	53.6	Low	51.6	Low	104 Å²	104	98.2 Å²	98.2	63%	0.63	51%	0.505	S	S	*	.	H	α-helix	trans	-77.1	-25.8	178.1	168.9	0	0	0	0	112.7	L749 L750 F751	L749-V753 WeakPolarHBondContact O-CG2 3.42Å; L749-V753 PolarHBondContact O-N 3.06Å; L750-V753 PolarHBondContact O-N 2.94Å; F751-V753 VanDerWaalsContact C-N 3.29Å; F751-V753 PolarHBondContact O-N 3.34Å
754	V	50.5	Low	51.8	Low	105 Å²	105	98.1 Å²	98.1	64%	0.636	50%	0.498	S	S	*	.	H	α-helix	trans	-86.6	-39.6	-174.9	172.7	0	0	0	0	112.9	L750 F751 K756	L750-V754 WeakPolarHBondContact O-CG2 3.45Å; L750-V754 PolarHBondContact O-N 3.39Å; F751-V754 PolarHBondContact O-N 3.41Å; V754-K756 PolarHBondContact O-N 2.74Å
755	H	51.8	Low	51.8	Low	85 Å²	85	102.5 Å²	102.5	39%	0.394	51%	0.509	S	S	.	.			trans	-103	62.6	-171.8	-74	-74.5	0	0	0	114.1	F751 E757 I758	F751-H755 PolarHBondContact O-N 3.49Å; H755-E757 VanDerWaalsContact C-N 3.29Å; H755-E757 PolarHBondContact O-N 3.41Å; H755-I758 HydrophobicContact CB-CD1 4.17Å
756	K	50.1	Low	51.9	Low	155 Å²	155	105.5 Å²	105.5	67%	0.674	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-23.2	-174.6	-165.1	165	-171.1	171.2	0	115	V754 E800	V754-K756 PolarHBondContact O-N 2.74Å; K756-E800 IonicContact NZ-OE1 2.66Å; K756-E800 PolarHBondContact NZ-OE1 3.32Å
757	E	50.1	Low	51.9	Low	196 Å²	196	105.3 Å²	105.3	92%	0.916	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-7.4	-170.2	-61.3	-179.3	154.8	0	0	115.1	H755	H755-E757 VanDerWaalsContact C-N 3.29Å; H755-E757 PolarHBondContact O-N 3.41Å
758	I	50.6	Low	52	Low	119 Å²	119	103 Å²	103	61%	0.61	52%	0.519	S	S	*	.	S	Bend	trans	-93	-7.2	-168.9	-64.2	179.4	0	0	0	112.9	H755	H755-I758 HydrophobicContact CB-CD1 4.17Å
759	W	55.9	Low	52.1	Low	65 Å²	65	106.5 Å²	106.5	25%	0.246	53%	0.528	C	S	.	.			trans	-115.5	-5.2	-147.2	-107	81.1	0	0	0	118.9	E761 M762 F763 F766	W759-E761 PolarHBondContact O-N 2.88Å; W759-M762 HydrophobicContact CD2-CB 3.92Å; W759-M762 HydrophobicContact CE3-CB 3.82Å; W759-M762 HydrophobicContact CG-CB 4.39Å; W759-M762 HydrophobicContact CZ3-CB 4.21Å; W759-M762 PolarHBondContact O-N 2.88Å; W759-M762 VanDerWaalsContact O-N 3.12Å; W759-F763 HydrophobicContact CB-CD2 4.09Å; W759-F763 HydrophobicContact CD2-CD2 4.38Å; W759-F763 HydrophobicContact CE3-CB 4.25Å; W759-F763 AromaticContact CE3-CD2 3.59Å; W759-F763 HydrophobicContact CE3-CD2 3.59Å; W759-F763 HydrophobicContact CE3-CE2 4.04Å; W759-F763 HydrophobicContact CE3-CG 4.01Å; W759-F763 HydrophobicContact CZ3-CD2 4.42Å; W759-F763 WeakPolarHBondContact O-CB 3.38Å; W759-F763 PolarHBondContact O-N 3.17Å; W759-F766 HydrophobicContact CH2-CB 4.01Å; W759-F766 HydrophobicContact CH2-CG 4.41Å; W759-F766 HydrophobicContact CZ3-CB 4.07Å
760	D	49.7	Very low	52.4	Low	130 Å²	130	105 Å²	105	70%	0.695	52%	0.52	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-35.3	-170.5	-87.1	-15.4	0	0	0	115.1
761	E	47.3	Very low	52.8	Low	139 Å²	139	100.5 Å²	100.5	65%	0.65	50%	0.497	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-28.3	173.7	-70.3	-55.7	138.4	0	0	113.3	W759 F763 K764	W759-E761 PolarHBondContact O-N 2.88Å; E761-F763 VanDerWaalsContact C-N 3.34Å; E761-K764 IonicContact OE1-NZ 2.63Å; E761-K764 PolarHBondContact OE1-NZ 3.34Å; E761-K764 IonicContact OE2-NZ 2.7Å; E761-K764 PolarHBondContact OE2-NZ 3.05Å
762	M	48.2	Very low	53.3	Low	86 Å²	86	97 Å²	97	42%	0.424	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-30.6	174.6	-73.6	-108.7	61.7	0	0	112.4	W759 K764 L765 F766	W759-M762 HydrophobicContact CD2-CB 3.92Å; W759-M762 HydrophobicContact CE3-CB 3.82Å; W759-M762 HydrophobicContact CG-CB 4.39Å; W759-M762 HydrophobicContact CZ3-CB 4.21Å; W759-M762 PolarHBondContact O-N 2.88Å; W759-M762 VanDerWaalsContact O-N 3.12Å; M762-K764 VanDerWaalsContact C-N 3.27Å; M762-K764 PolarHBondContact O-N 3.45Å; M762-L765 PolarHBondContact O-N 3.28Å; M762-F766 HydrophobicContact CE-CD2 4.02Å; M762-F766 HydrophobicContact CE-CE2 3.94Å; M762-F766 PolarHBondContact O-N 3.37Å
763	F	50.5	Low	53.7	Low	41 Å²	41	95.7 Å²	95.7	18%	0.18	49%	0.485	C	S	.	.	H	α-helix	trans	-56.7	-39.1	-177.1	-124.2	-75.1	0	0	0	113	W759 E761 L765 M767 L770 I796	W759-F763 HydrophobicContact CB-CD2 4.09Å; W759-F763 HydrophobicContact CD2-CD2 4.38Å; W759-F763 HydrophobicContact CE3-CB 4.25Å; W759-F763 AromaticContact CE3-CD2 3.59Å; W759-F763 HydrophobicContact CE3-CD2 3.59Å; W759-F763 HydrophobicContact CE3-CE2 4.04Å; W759-F763 HydrophobicContact CE3-CG 4.01Å; W759-F763 HydrophobicContact CZ3-CD2 4.42Å; W759-F763 WeakPolarHBondContact O-CB 3.38Å; W759-F763 PolarHBondContact O-N 3.17Å; E761-F763 VanDerWaalsContact C-N 3.34Å; F763-L765 VanDerWaalsContact C-N 3.29Å; F763-L765 PolarHBondContact O-N 3Å; F763-M767 HydrophobicContact CD1-CE 3.87Å; F763-M767 HydrophobicContact CD1-CG 3.83Å; F763-M767 HydrophobicContact CD1-SD 4.06Å; F763-M767 HydrophobicContact CE1-CE 3.71Å; F763-M767 HydrophobicContact CE1-CG 4.26Å; F763-M767 HydrophobicContact CE1-SD 3.88Å; F763-M767 WeakPolarHBondContact O-CG 3.34Å; F763-M767 PolarHBondContact O-N 2.97Å; F763-M767 VanDerWaalsContact O-N 3.15Å; F763-L770 HydrophobicContact CE1-CD2 4.5Å; F763-L770 HydrophobicContact CZ-CD2 4.47Å; F763-I796 HydrophobicContact CD1-CD1 4.22Å; F763-I796 HydrophobicContact CD1-CG1 4.29Å; F763-I796 HydrophobicContact CE1-CG1 4.26Å; F763-I796 HydrophobicContact CG-CD1 4.27Å
764	K	50	Low	54	Low	140 Å²	140	91.4 Å²	91.4	61%	0.609	46%	0.459	S	S	*	.	H	α-helix	trans	-65.6	-30.9	-174.1	-60.2	172.1	-164.1	166.5	0	112.8	E761 M762	E761-K764 IonicContact OE1-NZ 2.63Å; E761-K764 PolarHBondContact OE1-NZ 3.34Å; E761-K764 IonicContact OE2-NZ 2.7Å; E761-K764 PolarHBondContact OE2-NZ 3.05Å; M762-K764 VanDerWaalsContact C-N 3.27Å; M762-K764 PolarHBondContact O-N 3.45Å
765	L	51.9	Low	54.5	Low	141 Å²	141	88.2 Å²	88.2	74%	0.738	44%	0.437	S	S	*	.	H	α-helix	trans	-89.1	-31.7	-176.9	-146.2	75.7	0	0	0	112.9	M762 F763	M762-L765 PolarHBondContact O-N 3.28Å; F763-L765 VanDerWaalsContact C-N 3.29Å; F763-L765 PolarHBondContact O-N 3Å
766	F	55.8	Low	55	Low	95 Å²	95	88.7 Å²	88.7	42%	0.417	44%	0.441	S	S	.	.	H	α-helix	trans	-99.8	-10.6	-173.4	-87.4	-88.1	0	0	0	115.6	W759 M762 F769 L770	W759-F766 HydrophobicContact CH2-CB 4.01Å; W759-F766 HydrophobicContact CH2-CG 4.41Å; W759-F766 HydrophobicContact CZ3-CB 4.07Å; M762-F766 HydrophobicContact CE-CD2 4.02Å; M762-F766 HydrophobicContact CE-CE2 3.94Å; M762-F766 PolarHBondContact O-N 3.37Å; F766-F769 PolarHBondContact O-N 3.48Å; F766-F769 VanDerWaalsContact O-N 3.11Å; F766-L770 PolarHBondContact O-N 3.38Å
767	M	53.6	Low	55.5	Low	37 Å²	37	82 Å²	82	18%	0.182	41%	0.412	C	S	.	.	H	α-helix	trans	-44.2	-52	-179.2	-102.2	-66	-154.3	0	0	115.1	F763 F769 L770 V771 I796 L799	F763-M767 HydrophobicContact CD1-CE 3.87Å; F763-M767 HydrophobicContact CD1-CG 3.83Å; F763-M767 HydrophobicContact CD1-SD 4.06Å; F763-M767 HydrophobicContact CE1-CE 3.71Å; F763-M767 HydrophobicContact CE1-CG 4.26Å; F763-M767 HydrophobicContact CE1-SD 3.88Å; F763-M767 WeakPolarHBondContact O-CG 3.34Å; F763-M767 PolarHBondContact O-N 2.97Å; F763-M767 VanDerWaalsContact O-N 3.15Å; M767-F769 VanDerWaalsContact C-N 3.3Å; M767-F769 PolarHBondContact O-N 3.39Å; M767-L770 PolarHBondContact O-N 3.19Å; M767-V771 WeakPolarHBondContact O-CB 3.4Å; M767-V771 VanDerWaalsContact O-CG2 3.32Å; M767-V771 WeakPolarHBondContact O-CG2 3.48Å; M767-V771 PolarHBondContact O-N 3.46Å; M767-V771 HydrophobicContact SD-CG2 4.14Å; M767-I796 HydrophobicContact CE-CG1 3.9Å; M767-L799 HydrophobicContact CE-CD2 4.35Å; M767-L799 HydrophobicContact SD-CD2 4.32Å
768	P	56.7	Low	55.9	Low	99 Å²	99	72.9 Å²	72.9	64%	0.643	37%	0.37	S	S	*	.	H	α-helix	trans	-62.7	-37.1	-176.3	-22.8	34.4	0	0	0	113	G772	P768-G772 PolarHBondContact O-N 3.26Å; P768-G772 VanDerWaalsContact O-N 3.15Å
769	F	57.2	Low	56.5	Low	151 Å²	151	69.9 Å²	69.9	66%	0.662	35%	0.353	S	S	*	.	H	α-helix	trans	-72.5	-44	178.9	-169.2	-96.2	0	0	0	111.2	F766 M767 V771 G772 V773	F766-F769 PolarHBondContact O-N 3.48Å; F766-F769 VanDerWaalsContact O-N 3.11Å; M767-F769 VanDerWaalsContact C-N 3.3Å; M767-F769 PolarHBondContact O-N 3.39Å; F769-V771 PolarHBondContact O-N 3.46Å; F769-G772 PolarHBondContact O-N 3.35Å; F769-V773 HydrophobicContact CD1-CG2 4.21Å; F769-V773 HydrophobicContact CE1-CG2 3.99Å; F769-V773 HydrophobicContact CZ-CG2 4.42Å; F769-V773 WeakPolarHBondContact O-CG2 3.33Å; F769-V773 PolarHBondContact O-N 3.28Å
770	L	58.5	Low	56.6	Low	27 Å²	27	74.1 Å²	74.1	14%	0.141	38%	0.375	C	S	.	.	H	α-helix	trans	-64.3	-41.6	179	-166	71.9	0	0	0	111.7	F763 F766 M767 V773 I774	F763-L770 HydrophobicContact CE1-CD2 4.5Å; F763-L770 HydrophobicContact CZ-CD2 4.47Å; F766-L770 PolarHBondContact O-N 3.38Å; M767-L770 PolarHBondContact O-N 3.19Å; L770-V773 PolarHBondContact O-N 3.45Å; L770-I774 HydrophobicContact CG-CD1 4.05Å; L770-I774 WeakPolarHBondContact O-CB 3.36Å; L770-I774 VanDerWaalsContact O-CG1 3.27Å; L770-I774 WeakPolarHBondContact O-CG1 3.42Å; L770-I774 PolarHBondContact O-N 3.37Å
771	V	61.9	Low	56.8	Low	16 Å²	16	70.1 Å²	70.1	10%	0.097	35%	0.351	C	S	.	.	H	α-helix	trans	-61.9	-48.1	174.8	169.1	0	0	0	0	111.1	M767 F769 V773 I774 E775 I790	M767-V771 WeakPolarHBondContact O-CB 3.4Å; M767-V771 VanDerWaalsContact O-CG2 3.32Å; M767-V771 WeakPolarHBondContact O-CG2 3.48Å; M767-V771 PolarHBondContact O-N 3.46Å; M767-V771 HydrophobicContact SD-CG2 4.14Å; F769-V771 PolarHBondContact O-N 3.46Å; V771-V773 VanDerWaalsContact C-N 3.33Å; V771-V773 PolarHBondContact O-N 3.48Å; V771-I774 PolarHBondContact O-N 3.01Å; V771-E775 WeakPolarHBondContact O-CB 3.34Å; V771-E775 PolarHBondContact O-N 3.31Å; V771-I790 HydrophobicContact CG1-CB 3.75Å; V771-I790 HydrophobicContact CG1-CD1 4.26Å; V771-I790 HydrophobicContact CG1-CG2 3.84Å; V771-I790 HydrophobicContact CG2-CG2 4.5Å
772	G	61.4	Low	57.2	Low	42 Å²	42	66.3 Å²	66.3	43%	0.433	34%	0.335	S	S	.	.	H	α-helix	trans	-60.4	-39.7	177.5	0	0	0	0	0	113.3	P768 F769 M776	P768-G772 PolarHBondContact O-N 3.26Å; P768-G772 VanDerWaalsContact O-N 3.15Å; F769-G772 PolarHBondContact O-N 3.35Å; G772-M776 WeakPolarHBondContact O-CB 3.16Å; G772-M776 PolarHBondContact O-N 3.32Å
773	V	62.3	Low	57.4	Low	36 Å²	36	64.5 Å²	64.5	22%	0.218	34%	0.339	C	S	.	.	H	α-helix	trans	-65	-46.4	174.6	168.4	0	0	0	0	111.3	F769 L770 V771 E775 M776 I777	F769-V773 HydrophobicContact CD1-CG2 4.21Å; F769-V773 HydrophobicContact CE1-CG2 3.99Å; F769-V773 HydrophobicContact CZ-CG2 4.42Å; F769-V773 WeakPolarHBondContact O-CG2 3.33Å; F769-V773 PolarHBondContact O-N 3.28Å; L770-V773 PolarHBondContact O-N 3.45Å; V771-V773 VanDerWaalsContact C-N 3.33Å; V771-V773 PolarHBondContact O-N 3.48Å; V773-E775 PolarHBondContact O-N 3.24Å; V773-M776 PolarHBondContact O-N 2.9Å; V773-I777 HydrophobicContact CG1-CD1 3.64Å; V773-I777 HydrophobicContact CG1-CG1 4.5Å; V773-I777 VanDerWaalsContact O-CD1 3.27Å; V773-I777 WeakPolarHBondContact O-CD1 3.32Å; V773-I777 WeakPolarHBondContact O-CG1 3.37Å; V773-I777 PolarHBondContact O-N 3.05Å
774	I	59.5	Low	57.4	Low	15 Å²	15	68.3 Å²	68.3	8%	0.077	36%	0.361	C	S	.	.	H	α-helix	trans	-61.7	-42.4	177.4	-71	165.1	0	0	0	111.3	L770 V771 I777 A778 I790 L799 F802 L803	L770-I774 HydrophobicContact CG-CD1 4.05Å; L770-I774 WeakPolarHBondContact O-CB 3.36Å; L770-I774 VanDerWaalsContact O-CG1 3.27Å; L770-I774 WeakPolarHBondContact O-CG1 3.42Å; L770-I774 PolarHBondContact O-N 3.37Å; V771-I774 PolarHBondContact O-N 3.01Å; I774-I777 PolarHBondContact O-N 3.09Å; I774-A778 WeakPolarHBondContact O-CB 3.35Å; I774-A778 PolarHBondContact O-N 3.46Å; I774-I790 HydrophobicContact CG2-CD1 4.07Å; I774-L799 HydrophobicContact CD1-CD1 4.35Å; I774-F802 HydrophobicContact CG2-CE1 4.24Å; I774-L803 HydrophobicContact CD1-CD2 4.37Å; I774-L803 HydrophobicContact CG2-CD2 4.09Å
775	E	60.9	Low	57.4	Low	38 Å²	38	68.2 Å²	68.2	18%	0.178	36%	0.362	C	S	.	.	H	α-helix	trans	-66.9	-40.4	180	-155.3	-174.6	104.1	0	0	112.1	V771 V773 A778 K779 V788 S789 I790	V771-E775 WeakPolarHBondContact O-CB 3.34Å; V771-E775 PolarHBondContact O-N 3.31Å; V773-E775 PolarHBondContact O-N 3.24Å; E775-A778 PolarHBondContact O-N 3.5Å; E775-K779 HydrophobicContact CG-CD 4.5Å; E775-K779 WeakPolarHBondContact O-CB 3.32Å; E775-K779 WeakPolarHBondContact O-CG 3.18Å; E775-K779 PolarHBondContact O-N 2.91Å; E775-K779 IonicContact OE1-NZ 3.84Å; E775-K779 PolarHBondContact OE1-NZ 3.42Å; E775-V788 HydrophobicContact CG-CG1 3.83Å; E775-V788 WeakPolarHBondContact CG-O 3.27Å; E775-S789 WeakPolarHBondContact OE2-CA 3.43Å; E775-I790 PolarHBondContact OE2-N 2.64Å
776	M	62.8	Low	57.2	Low	95 Å²	95	69 Å²	69	47%	0.468	37%	0.367	S	S	.	.	H	α-helix	trans	-61.4	-45.2	173.1	-179.7	-178.1	67.6	0	0	111.9	F741 G772 V773 K779 H780	F741-M776 HydrophobicContact CE1-CE 3.91Å; G772-M776 WeakPolarHBondContact O-CB 3.16Å; G772-M776 PolarHBondContact O-N 3.32Å; V773-M776 PolarHBondContact O-N 2.9Å; M776-K779 PolarHBondContact O-N 3.15Å; M776-H780 WeakPolarHBondContact O-CB 3.27Å; M776-H780 PolarHBondContact O-N 3.48Å
777	I	60.9	Low	56.9	Low	15 Å²	15	73 Å²	73	8%	0.077	39%	0.387	C	S	.	.	H	α-helix	trans	-63.1	-45.5	177.5	-66.7	159.3	0	0	0	110.6	V745 L749 V773 I774 H780 F781 L810	V745-I777 HydrophobicContact CG1-CD1 3.28Å; V745-I777 HydrophobicContact CG1-CG1 3.72Å; L749-I777 HydrophobicContact CD1-CD1 4.23Å; V773-I777 HydrophobicContact CG1-CD1 3.64Å; V773-I777 HydrophobicContact CG1-CG1 4.5Å; V773-I777 VanDerWaalsContact O-CD1 3.27Å; V773-I777 WeakPolarHBondContact O-CD1 3.32Å; V773-I777 WeakPolarHBondContact O-CG1 3.37Å; V773-I777 PolarHBondContact O-N 3.05Å; I774-I777 PolarHBondContact O-N 3.09Å; I777-H780 PolarHBondContact O-N 3.39Å; I777-F781 HydrophobicContact CG2-CD2 3.98Å; I777-F781 HydrophobicContact CG2-CE2 4.49Å; I777-F781 PolarHBondContact O-N 3.15Å; I777-L810 HydrophobicContact CG2-CD1 4.33Å
778	A	58.4	Low	56.9	Low	3 Å²	3	72.1 Å²	72.1	3%	0.025	38%	0.384	C	S	.	.	H	α-helix	trans	-62.1	-46.4	179.2	0	0	0	0	0	111.5	I774 E775 H780 F781 L782 V788	I774-A778 WeakPolarHBondContact O-CB 3.35Å; I774-A778 PolarHBondContact O-N 3.46Å; E775-A778 PolarHBondContact O-N 3.5Å; A778-H780 PolarHBondContact O-N 3.35Å; A778-F781 PolarHBondContact O-N 3.01Å; A778-L782 HydrophobicContact CB-CD1 4.24Å; A778-L782 WeakPolarHBondContact O-CB 3.45Å; A778-L782 WeakPolarHBondContact O-CG 3.33Å; A778-L782 PolarHBondContact O-N 2.95Å; A778-V788 HydrophobicContact CB-CG1 3.71Å; A778-V788 HydrophobicContact CB-CG2 4.46Å
779	K	62.9	Low	56.7	Low	57 Å²	57	71.8 Å²	71.8	25%	0.248	38%	0.384	C	S	.	.	H	α-helix	trans	-58.5	-45.7	174.1	-77.6	167.9	171.9	160	0	111.9	E775 M776 G783 V788	E775-K779 HydrophobicContact CG-CD 4.5Å; E775-K779 WeakPolarHBondContact O-CB 3.32Å; E775-K779 WeakPolarHBondContact O-CG 3.18Å; E775-K779 PolarHBondContact O-N 2.91Å; E775-K779 IonicContact OE1-NZ 3.84Å; E775-K779 PolarHBondContact OE1-NZ 3.42Å; M776-K779 PolarHBondContact O-N 3.15Å; K779-G783 PolarHBondContact O-N 3.31Å; K779-V788 WeakPolarHBondContact CE-O 3.37Å; K779-V788 HydrophobicContact CG-CB 4.42Å; K779-V788 PolarHBondContact NZ-O 2.98Å
780	H	58.2	Low	56.6	Low	153 Å²	153	65.3 Å²	65.3	71%	0.708	36%	0.356	S	S	*	.	H	α-helix	trans	-66.6	-42.2	-179.1	-169.7	61.9	0	0	0	113.6	M776 I777 A778	M776-H780 WeakPolarHBondContact O-CB 3.27Å; M776-H780 PolarHBondContact O-N 3.48Å; I777-H780 PolarHBondContact O-N 3.39Å; A778-H780 PolarHBondContact O-N 3.35Å
781	F	53.3	Low	56.3	Low	46 Å²	46	68.3 Å²	68.3	20%	0.202	38%	0.377	C	S	.	.	H	α-helix	trans	-90.3	-22.8	-176.3	-81.7	-86.5	0	0	0	114.8	I777 A778 L810 K813	I777-F781 HydrophobicContact CG2-CD2 3.98Å; I777-F781 HydrophobicContact CG2-CE2 4.49Å; I777-F781 PolarHBondContact O-N 3.15Å; A778-F781 PolarHBondContact O-N 3.01Å; F781-L810 HydrophobicContact CB-CG 4.41Å; F781-L810 HydrophobicContact CG-CD2 4.46Å; F781-K813 WeakPolarHBondContact O-CD 3.49Å; F781-K813 WeakPolarHBondContact O-CE 2.98Å; F781-K813 PolarHBondContact O-NZ 2.63Å
782	L	56.2	Low	55.7	Low	60 Å²	60	72.7 Å²	72.7	31%	0.314	41%	0.408	S	S	.	.	H	α-helix	trans	-95.9	-20.9	-179.4	-60.7	170.8	0	0	0	113.7	A778 N784 I806 A809	A778-L782 HydrophobicContact CB-CD1 4.24Å; A778-L782 WeakPolarHBondContact O-CB 3.45Å; A778-L782 WeakPolarHBondContact O-CG 3.33Å; A778-L782 PolarHBondContact O-N 2.95Å; L782-N784 PolarHBondContact O-N 3.5Å; L782-N784 VanDerWaalsContact O-N 3.15Å; L782-I806 HydrophobicContact CD1-CD1 4.17Å; L782-I806 HydrophobicContact CD1-CG1 4.41Å; L782-I806 HydrophobicContact CD1-CG2 4.21Å; L782-A809 HydrophobicContact CD2-CB 4.45Å
783	G	53.2	Low	55.3	Low	48 Å²	48	79.3 Å²	79.3	50%	0.495	43%	0.428	S	S	.	.			trans	79.9	-21.2	170.7	0	0	0	0	0	116.3	K779 H785	K779-G783 PolarHBondContact O-N 3.31Å; G783-H785 PolarHBondContact O-N 2.98Å
784	N	49.7	Very low	54.8	Low	120 Å²	120	78.8 Å²	78.8	64%	0.642	43%	0.425	S	S	*	.			trans	-83	112.8	172.3	-80.9	3.8	0	0	0	110.7	L782 N786	L782-N784 PolarHBondContact O-N 3.5Å; L782-N784 VanDerWaalsContact O-N 3.15Å; N784-N786 PolarHBondContact O-N 3.03Å
785	H	49.5	Very low	54.6	Low	138 Å²	138	80.9 Å²	80.9	64%	0.639	44%	0.442	S	S	*	.	S	Bend	trans	-74.1	-17.4	-174.5	-90.6	-94.4	0	0	0	115.7	G783	G783-H785 PolarHBondContact O-N 2.98Å
786	N	47.6	Very low	54.2	Low	157 Å²	157	82.5 Å²	82.5	84%	0.84	45%	0.451	S	S	*	.	S	Bend	trans	-108.1	-8.8	-160	-70.5	5.4	0	0	0	117.2	N784	N784-N786 PolarHBondContact O-N 3.03Å
787	E	50.5	Low	53.7	Low	179 Å²	179	82.1 Å²	82.1	84%	0.836	46%	0.457	S	S	*	.	S	Bend	trans	-120.6	6.1	-174.7	-74	-163.3	137	0	0	115.6
788	V	52.9	Low	53.4	Low	19 Å²	19	88 Å²	88	12%	0.115	48%	0.482	C	S	.	.			trans	-107.3	94	173.8	-178.5	0	0	0	0	109.8	E775 A778 K779 F802	E775-V788 HydrophobicContact CG-CG1 3.83Å; E775-V788 WeakPolarHBondContact CG-O 3.27Å; A778-V788 HydrophobicContact CB-CG1 3.71Å; A778-V788 HydrophobicContact CB-CG2 4.46Å; K779-V788 WeakPolarHBondContact CE-O 3.37Å; K779-V788 HydrophobicContact CG-CB 4.42Å; K779-V788 PolarHBondContact NZ-O 2.98Å; V788-F802 HydrophobicContact CG1-CZ 3.91Å
789	S	53.7	Low	53.4	Low	93 Å²	93	88.1 Å²	88.1	65%	0.65	48%	0.483	S	S	*	.			trans	-134.9	124.4	168.7	-177.5	0	0	0	0	108.7	E775	E775-S789 WeakPolarHBondContact OE2-CA 3.43Å
790	I	54.6	Low	52.9	Low	14 Å²	14	89.8 Å²	89.8	7%	0.072	49%	0.491	C	S	.	.			trans	-102.1	121.3	177.7	-57.7	173.4	0	0	0	107.8	V771 I774 E775 S792 C794 L799 F802	V771-I790 HydrophobicContact CG1-CB 3.75Å; V771-I790 HydrophobicContact CG1-CD1 4.26Å; V771-I790 HydrophobicContact CG1-CG2 3.84Å; V771-I790 HydrophobicContact CG2-CG2 4.5Å; I774-I790 HydrophobicContact CG2-CD1 4.07Å; E775-I790 PolarHBondContact OE2-N 2.64Å; I790-S792 PolarHBondContact O-N 2.96Å; I790-C794 HydrophobicContact CG2-CB 3.83Å; I790-L799 HydrophobicContact CD1-CD1 4.18Å; I790-F802 HydrophobicContact CD1-CD1 3.96Å; I790-F802 HydrophobicContact CD1-CE1 3.61Å; I790-F802 HydrophobicContact CD1-CZ 4.13Å; I790-F802 HydrophobicContact CG1-CD1 4.5Å; I790-F802 HydrophobicContact CG1-CE1 4.11Å; I790-F802 HydrophobicContact CG1-CZ 4.14Å
791	P	51.3	Low	52.8	Low	91 Å²	91	88 Å²	88	59%	0.591	49%	0.486	S	S	*	.			trans	-55.8	136.1	177.8	-26.3	35	0	0	0	111.9	H793 C794	P791-H793 PolarHBondContact O-N 2.89Å; P791-C794 WeakPolarHBondContact O-CB 3.46Å; P791-C794 PolarHBondContact O-N 3.43Å; P791-C794 VanDerWaalsContact O-N 3.07Å
792	S	50.5	Low	53.3	Low	107 Å²	107	88.5 Å²	88.5	75%	0.748	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-22	-176.1	51.7	0	0	0	0	114.6	I790	I790-S792 PolarHBondContact O-N 2.96Å
793	H	52.7	Low	53.3	Low	181 Å²	181	88.5 Å²	88.5	84%	0.838	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.2	60.4	171.6	-63.1	-73.6	0	0	0	111.5	P791	P791-H793 PolarHBondContact O-N 2.89Å
794	C	51.5	Low	53.6	Low	25 Å²	25	89.4 Å²	89.4	17%	0.169	49%	0.491	C	S	.	.			trans	-85.1	130.9	173.2	-160.4	0	0	0	0	110.8	I790 P791 K798	I790-C794 HydrophobicContact CG2-CB 3.83Å; P791-C794 WeakPolarHBondContact O-CB 3.46Å; P791-C794 PolarHBondContact O-N 3.43Å; P791-C794 VanDerWaalsContact O-N 3.07Å; C794-K798 WeakPolarHBondContact SG-CB 3.43Å
795	S	54.8	Low	54	Low	60 Å²	60	91.8 Å²	91.8	42%	0.42	50%	0.496	S	S	.	.			trans	-75.9	150.8	173.4	59.3	0	0	0	0	111.3	S797 K798 L799	S795-S797 VanDerWaalsContact C-N 3.25Å; S795-S797 PolarHBondContact O-N 2.93Å; S795-K798 WeakPolarHBondContact O-CA 3.44Å; S795-K798 WeakPolarHBondContact O-CB 3.37Å; S795-K798 PolarHBondContact O-N 3.24Å; S795-L799 PolarHBondContact O-N 2.89Å; S795-L799 VanDerWaalsContact O-N 3.12Å
796	I	53.8	Low	54.3	Low	72 Å²	72	86.5 Å²	86.5	37%	0.369	47%	0.472	S	S	.	.	H	α-helix	trans	-51.1	-44.9	-177.3	-64.6	171.9	0	0	0	111.4	F763 M767 K798 L799 E800	F763-I796 HydrophobicContact CD1-CD1 4.22Å; F763-I796 HydrophobicContact CD1-CG1 4.29Å; F763-I796 HydrophobicContact CE1-CG1 4.26Å; F763-I796 HydrophobicContact CG-CD1 4.27Å; M767-I796 HydrophobicContact CE-CG1 3.9Å; I796-K798 VanDerWaalsContact C-N 3.27Å; I796-K798 PolarHBondContact O-N 3.27Å; I796-L799 WeakPolarHBondContact O-CB 3.35Å; I796-L799 PolarHBondContact O-N 3.18Å; I796-E800 HydrophobicContact CG2-CG 4.39Å; I796-E800 PolarHBondContact O-N 3.42Å
797	S	50.8	Low	54.8	Low	86 Å²	86	82.8 Å²	82.8	60%	0.601	45%	0.45	S	S	*	.	H	α-helix	trans	-61.9	-29.3	178.7	-36.9	0	0	0	0	114.1	S795 L801	S795-S797 VanDerWaalsContact C-N 3.25Å; S795-S797 PolarHBondContact O-N 2.93Å; S797-L801 WeakPolarHBondContact O-CB 3.46Å; S797-L801 PolarHBondContact O-N 3.11Å
798	K	55.5	Low	55.1	Low	138 Å²	138	78.3 Å²	78.3	60%	0.6	44%	0.437	S	S	*	.	H	α-helix	trans	-77.6	-35.8	173.9	-72.6	178.2	178.7	179	0	111.3	C794 S795 I796 L801 F802	C794-K798 WeakPolarHBondContact SG-CB 3.43Å; S795-K798 WeakPolarHBondContact O-CA 3.44Å; S795-K798 WeakPolarHBondContact O-CB 3.37Å; S795-K798 PolarHBondContact O-N 3.24Å; I796-K798 VanDerWaalsContact C-N 3.27Å; I796-K798 PolarHBondContact O-N 3.27Å; K798-L801 PolarHBondContact O-N 3.44Å; K798-F802 WeakPolarHBondContact O-CB 3.2Å; K798-F802 PolarHBondContact O-N 3.41Å
799	L	57.6	Low	55.2	Low	7 Å²	7	79.7 Å²	79.7	4%	0.037	45%	0.451	C	S	.	.	H	α-helix	trans	-68.4	-41.9	174.9	-172.9	63.6	0	0	0	111.7	M767 I774 I790 S795 I796 L801 F802 L803	M767-L799 HydrophobicContact CE-CD2 4.35Å; M767-L799 HydrophobicContact SD-CD2 4.32Å; I774-L799 HydrophobicContact CD1-CD1 4.35Å; I790-L799 HydrophobicContact CD1-CD1 4.18Å; S795-L799 PolarHBondContact O-N 2.89Å; S795-L799 VanDerWaalsContact O-N 3.12Å; I796-L799 WeakPolarHBondContact O-CB 3.35Å; I796-L799 PolarHBondContact O-N 3.18Å; L799-L801 PolarHBondContact O-N 3.32Å; L799-F802 PolarHBondContact O-N 3.34Å; L799-L803 HydrophobicContact CG-CD1 4.17Å; L799-L803 WeakPolarHBondContact O-CB 3.29Å; L799-L803 WeakPolarHBondContact O-CG 3.32Å; L799-L803 PolarHBondContact O-N 2.9Å
800	E	53.5	Low	55.2	Low	92 Å²	92	76.2 Å²	76.2	43%	0.43	43%	0.425	S	S	.	.	H	α-helix	trans	-58.5	-46	172.1	-73.8	-173.5	126.7	0	0	111.5	K756 I796 F802 L803 A804	K756-E800 IonicContact NZ-OE1 2.66Å; K756-E800 PolarHBondContact NZ-OE1 3.32Å; I796-E800 HydrophobicContact CG2-CG 4.39Å; I796-E800 PolarHBondContact O-N 3.42Å; E800-F802 VanDerWaalsContact C-N 3.33Å; E800-F802 PolarHBondContact O-N 3.44Å; E800-L803 PolarHBondContact O-N 3.25Å; E800-A804 VanDerWaalsContact O-CB 3.31Å; E800-A804 WeakPolarHBondContact O-CB 3.37Å; E800-A804 PolarHBondContact O-N 3.12Å
801	L	56.5	Low	55.2	Low	116 Å²	116	82.2 Å²	82.2	61%	0.607	45%	0.45	S	S	*	.	H	α-helix	trans	-64.7	-35	178.1	-172.1	66.3	0	0	0	112.8	S797 K798 L799 K805	S797-L801 WeakPolarHBondContact O-CB 3.46Å; S797-L801 PolarHBondContact O-N 3.11Å; K798-L801 PolarHBondContact O-N 3.44Å; L799-L801 PolarHBondContact O-N 3.32Å; L801-K805 PolarHBondContact O-N 3.15Å
802	F	62.3	Low	55.1	Low	56 Å²	56	85 Å²	85	25%	0.246	45%	0.453	C	S	.	.	H	α-helix	trans	-69.3	-48	175.2	178.6	-97.5	0	0	0	111.8	I774 V788 I790 K798 L799 E800 A804 K805 I806	I774-F802 HydrophobicContact CG2-CE1 4.24Å; V788-F802 HydrophobicContact CG1-CZ 3.91Å; I790-F802 HydrophobicContact CD1-CD1 3.96Å; I790-F802 HydrophobicContact CD1-CE1 3.61Å; I790-F802 HydrophobicContact CD1-CZ 4.13Å; I790-F802 HydrophobicContact CG1-CD1 4.5Å; I790-F802 HydrophobicContact CG1-CE1 4.11Å; I790-F802 HydrophobicContact CG1-CZ 4.14Å; K798-F802 WeakPolarHBondContact O-CB 3.2Å; K798-F802 PolarHBondContact O-N 3.41Å; L799-F802 PolarHBondContact O-N 3.34Å; E800-F802 VanDerWaalsContact C-N 3.33Å; E800-F802 PolarHBondContact O-N 3.44Å; F802-A804 VanDerWaalsContact C-N 3.32Å; F802-A804 PolarHBondContact O-N 2.93Å; F802-K805 PolarHBondContact O-N 2.85Å; F802-I806 HydrophobicContact CD1-CD1 4.21Å; F802-I806 HydrophobicContact CD2-CD1 4.36Å; F802-I806 HydrophobicContact CE1-CD1 3.55Å; F802-I806 HydrophobicContact CE2-CD1 3.74Å; F802-I806 HydrophobicContact CZ-CD1 3.29Å; F802-I806 PolarHBondContact O-N 3.24Å
803	L	57.3	Low	55.1	Low	60 Å²	60	85.1 Å²	85.1	31%	0.314	44%	0.44	S	S	.	.	H	α-helix	trans	-61.5	-39.6	176.1	-71.4	170.1	0	0	0	111.6	I774 L799 E800 K805 I806 M807	I774-L803 HydrophobicContact CD1-CD2 4.37Å; I774-L803 HydrophobicContact CG2-CD2 4.09Å; L799-L803 HydrophobicContact CG-CD1 4.17Å; L799-L803 WeakPolarHBondContact O-CB 3.29Å; L799-L803 WeakPolarHBondContact O-CG 3.32Å; L799-L803 PolarHBondContact O-N 2.9Å; E800-L803 PolarHBondContact O-N 3.25Å; L803-K805 VanDerWaalsContact C-N 3.29Å; L803-K805 PolarHBondContact O-N 3.29Å; L803-I806 PolarHBondContact O-N 2.9Å; L803-M807 VanDerWaalsContact O-CB 3.29Å; L803-M807 WeakPolarHBondContact O-CB 3.38Å; L803-M807 WeakPolarHBondContact O-CG 3.43Å; L803-M807 PolarHBondContact O-N 3.49Å
804	A	59	Low	55.1	Low	67 Å²	67	78.2 Å²	78.2	55%	0.554	41%	0.409	S	S	*	.	H	α-helix	trans	-59.8	-34.9	175.9	0	0	0	0	0	113.3	E800 F802 P808	E800-A804 VanDerWaalsContact O-CB 3.31Å; E800-A804 WeakPolarHBondContact O-CB 3.37Å; E800-A804 PolarHBondContact O-N 3.12Å; F802-A804 VanDerWaalsContact C-N 3.32Å; F802-A804 PolarHBondContact O-N 2.93Å; A804-P808 WeakPolarHBondContact O-CD 3.45Å
805	K	57.9	Low	54.7	Low	169 Å²	169	85 Å²	85	74%	0.735	43%	0.432	S	S	*	.	H	α-helix	trans	-70.8	-35.6	175	-78.2	-174.5	172.9	-174.2	0	113.3	L801 F802 L803	L801-K805 PolarHBondContact O-N 3.15Å; F802-K805 PolarHBondContact O-N 2.85Å; L803-K805 VanDerWaalsContact C-N 3.29Å; L803-K805 PolarHBondContact O-N 3.29Å
806	I	56.7	Low	54.4	Low	28 Å²	28	87.6 Å²	87.6	14%	0.144	44%	0.44	C	S	.	.	H	α-helix	trans	-93.1	-33	-170.7	-70.5	176.1	0	0	0	112.8	L782 F802 L803 P808 A809 L810	L782-I806 HydrophobicContact CD1-CD1 4.17Å; L782-I806 HydrophobicContact CD1-CG1 4.41Å; L782-I806 HydrophobicContact CD1-CG2 4.21Å; F802-I806 HydrophobicContact CD1-CD1 4.21Å; F802-I806 HydrophobicContact CD2-CD1 4.36Å; F802-I806 HydrophobicContact CE1-CD1 3.55Å; F802-I806 HydrophobicContact CE2-CD1 3.74Å; F802-I806 HydrophobicContact CZ-CD1 3.29Å; F802-I806 PolarHBondContact O-N 3.24Å; L803-I806 PolarHBondContact O-N 2.9Å; I806-P808 VanDerWaalsContact C-N 3.34Å; I806-A809 PolarHBondContact O-N 2.86Å; I806-A809 VanDerWaalsContact O-N 3.09Å; I806-L810 HydrophobicContact CG2-CB 4.44Å; I806-L810 HydrophobicContact CG2-CD1 3.59Å; I806-L810 PolarHBondContact O-N 3.29Å
807	M	57.8	Low	53.9	Low	78 Å²	78	91.3 Å²	91.3	38%	0.384	45%	0.451	S	S	.	.	H	α-helix	trans	-50.4	-38.6	-178.6	-85.1	-75.2	-87.5	0	0	115.4	L803 L810 K811	L803-M807 VanDerWaalsContact O-CB 3.29Å; L803-M807 WeakPolarHBondContact O-CB 3.38Å; L803-M807 WeakPolarHBondContact O-CG 3.43Å; L803-M807 PolarHBondContact O-N 3.49Å; M807-L810 PolarHBondContact O-N 2.66Å; M807-K811 VanDerWaalsContact O-CB 3.32Å; M807-K811 WeakPolarHBondContact O-CB 3.35Å; M807-K811 WeakPolarHBondContact O-CG 3.49Å; M807-K811 PolarHBondContact O-N 3.37Å
808	P	56.9	Low	53.6	Low	85 Å²	85	93.2 Å²	93.2	55%	0.552	45%	0.453	S	S	*	.	H	α-helix	trans	-63.1	-42.5	177	-23.9	35.1	0	0	0	113.4	A804 I806 K812	A804-P808 WeakPolarHBondContact O-CD 3.45Å; I806-P808 VanDerWaalsContact C-N 3.34Å; P808-K812 PolarHBondContact O-N 3.41Å; P808-K812 VanDerWaalsContact O-N 3.17Å
809	A	54.7	Low	52.7	Low	49 Å²	49	93.8 Å²	93.8	41%	0.405	47%	0.467	S	S	.	.	H	α-helix	trans	-70.6	-40.7	178.4	0	0	0	0	0	111.5	L782 I806 K812 K813	L782-A809 HydrophobicContact CD2-CB 4.45Å; I806-A809 PolarHBondContact O-N 2.86Å; I806-A809 VanDerWaalsContact O-N 3.09Å; A809-K812 PolarHBondContact O-N 2.91Å; A809-K813 PolarHBondContact O-N 3.43Å
810	L	54	Low	52.5	Low	20 Å²	20	98.1 Å²	98.1	11%	0.105	49%	0.489	C	S	.	.	H	α-helix	trans	-69.2	-40.2	180	-128.2	144.6	0	0	0	111.6	I777 F781 I806 M807 K812 K813 I814	I777-L810 HydrophobicContact CG2-CD1 4.33Å; F781-L810 HydrophobicContact CB-CG 4.41Å; F781-L810 HydrophobicContact CG-CD2 4.46Å; I806-L810 HydrophobicContact CG2-CB 4.44Å; I806-L810 HydrophobicContact CG2-CD1 3.59Å; I806-L810 PolarHBondContact O-N 3.29Å; M807-L810 PolarHBondContact O-N 2.66Å; L810-K812 VanDerWaalsContact C-N 3.35Å; L810-K812 PolarHBondContact O-N 3.19Å; L810-K813 PolarHBondContact O-N 3.25Å; L810-I814 HydrophobicContact CD2-CD1 3.65Å; L810-I814 HydrophobicContact CD2-CG1 4.2Å; L810-I814 WeakPolarHBondContact O-CB 3.31Å; L810-I814 WeakPolarHBondContact O-CG1 3.37Å; L810-I814 PolarHBondContact O-N 3.39Å
811	K	54.3	Low	52.4	Low	139 Å²	139	98.4 Å²	98.4	60%	0.604	49%	0.492	S	S	*	.	H	α-helix	trans	-58.5	-42.9	169.4	-80.1	-174	174.2	-173.3	0	112.3	M807 I814 Y815	M807-K811 VanDerWaalsContact O-CB 3.32Å; M807-K811 WeakPolarHBondContact O-CB 3.35Å; M807-K811 WeakPolarHBondContact O-CG 3.49Å; M807-K811 PolarHBondContact O-N 3.37Å; K811-I814 PolarHBondContact O-N 3.07Å; K811-Y815 WeakPolarHBondContact O-CB 3.38Å; K811-Y815 PolarHBondContact O-N 2.99Å
812	K	48.7	Very low	52.2	Low	151 Å²	151	97.4 Å²	97.4	66%	0.657	49%	0.486	S	S	*	.	H	α-helix	trans	-64	-41.3	178.8	-167.4	174.7	-177.5	179.7	0	112.1	P808 A809 L810 I816	P808-K812 PolarHBondContact O-N 3.41Å; P808-K812 VanDerWaalsContact O-N 3.17Å; A809-K812 PolarHBondContact O-N 2.91Å; L810-K812 VanDerWaalsContact C-N 3.35Å; L810-K812 PolarHBondContact O-N 3.19Å; K812-I816 HydrophobicContact CG-CD1 4.24Å; K812-I816 WeakPolarHBondContact O-CD1 3.49Å; K812-I816 VanDerWaalsContact O-CG1 3.3Å; K812-I816 WeakPolarHBondContact O-CG1 3.43Å; K812-I816 PolarHBondContact O-N 3.48Å
813	K	50.8	Low	51.6	Low	108 Å²	108	99.9 Å²	99.9	47%	0.47	50%	0.5	S	S	.	.	H	α-helix	trans	-70.9	-38.5	174.8	-76.9	-164.3	176.3	-171.7	0	113.4	F781 A809 L810 I816 Y817	F781-K813 WeakPolarHBondContact O-CD 3.49Å; F781-K813 WeakPolarHBondContact O-CE 2.98Å; F781-K813 PolarHBondContact O-NZ 2.63Å; A809-K813 PolarHBondContact O-N 3.43Å; L810-K813 PolarHBondContact O-N 3.25Å; K813-I816 PolarHBondContact O-N 3.34Å; K813-Y817 PolarHBondContact O-N 2.7Å; K813-Y817 VanDerWaalsContact O-N 3.17Å
814	I	52.7	Low	51.3	Low	36 Å²	36	102.4 Å²	102.4	19%	0.185	51%	0.511	C	S	.	.	H	α-helix	trans	-63.8	-41	175.6	-73.8	171	0	0	0	110.9	I746 L810 K811 I816 Y817 I818	I746-I814 HydrophobicContact CG1-CD1 4.39Å; L810-I814 HydrophobicContact CD2-CD1 3.65Å; L810-I814 HydrophobicContact CD2-CG1 4.2Å; L810-I814 WeakPolarHBondContact O-CB 3.31Å; L810-I814 WeakPolarHBondContact O-CG1 3.37Å; L810-I814 PolarHBondContact O-N 3.39Å; K811-I814 PolarHBondContact O-N 3.07Å; I814-I816 VanDerWaalsContact C-N 3.32Å; I814-I816 PolarHBondContact O-N 3.05Å; I814-Y817 CarbonylContact O-C 3.6Å; I814-Y817 PolarHBondContact O-N 3.12Å; I814-I818 HydrophobicContact CG2-CD1 3.56Å; I814-I818 HydrophobicContact CG2-CG1 4.34Å; I814-I818 WeakPolarHBondContact O-CG1 3.42Å; I814-I818 PolarHBondContact O-N 2.9Å; I814-I818 VanDerWaalsContact O-N 3.11Å
815	Y	44.4	Very low	50.8	Low	167 Å²	167	104.7 Å²	104.7	66%	0.655	51%	0.509	S	S	*	.	H	α-helix	trans	-60.7	-41.4	175.9	-169.6	-98	0	0	0	112	K811 Y817 I818 V819	K811-Y815 WeakPolarHBondContact O-CB 3.38Å; K811-Y815 PolarHBondContact O-N 2.99Å; Y815-Y817 PolarHBondContact O-N 3.25Å; Y815-I818 PolarHBondContact O-N 3.17Å; Y815-V819 HydrophobicContact CD1-CG2 4.3Å; Y815-V819 HydrophobicContact CE1-CG2 3.97Å; Y815-V819 HydrophobicContact CE2-CG2 4.43Å; Y815-V819 WeakPolarHBondContact O-CG2 3.48Å; Y815-V819 PolarHBondContact O-N 3Å; Y815-V819 VanDerWaalsContact O-N 3.1Å
816	I	47.7	Very low	50.3	Low	116 Å²	116	100.1 Å²	100.1	60%	0.595	49%	0.492	S	S	*	.	H	α-helix	trans	-71.5	-6.8	175.3	-65.3	165.8	0	0	0	113	K812 K813 I814	K812-I816 HydrophobicContact CG-CD1 4.24Å; K812-I816 WeakPolarHBondContact O-CD1 3.49Å; K812-I816 VanDerWaalsContact O-CG1 3.3Å; K812-I816 WeakPolarHBondContact O-CG1 3.43Å; K812-I816 PolarHBondContact O-N 3.48Å; K813-I816 PolarHBondContact O-N 3.34Å; I814-I816 VanDerWaalsContact C-N 3.32Å; I814-I816 PolarHBondContact O-N 3.05Å
817	Y	43.8	Very low	49.8	Very low	149 Å²	149	105.7 Å²	105.7	58%	0.584	52%	0.519	S	S	*	.	H	α-helix	trans	-107.9	-6.8	175.8	-163.9	-87.4	0	0	0	112.6	K813 I814 Y815	K813-Y817 PolarHBondContact O-N 2.7Å; K813-Y817 VanDerWaalsContact O-N 3.17Å; I814-Y817 CarbonylContact O-C 3.6Å; I814-Y817 PolarHBondContact O-N 3.12Å; Y815-Y817 PolarHBondContact O-N 3.25Å
818	I	42.9	Very low	49.1	Very low	127 Å²	127	108 Å²	108	65%	0.651	53%	0.53	S	S	*	.	H	α-helix	trans	-107.9	-26	179.1	-70.2	175.3	0	0	0	111.4	I814 Y815	I814-I818 HydrophobicContact CG2-CD1 3.56Å; I814-I818 HydrophobicContact CG2-CG1 4.34Å; I814-I818 WeakPolarHBondContact O-CG1 3.42Å; I814-I818 PolarHBondContact O-N 2.9Å; I814-I818 VanDerWaalsContact O-N 3.11Å; Y815-I818 PolarHBondContact O-N 3.17Å
819	V	38.3	Very low	48.4	Very low	149 Å²	149	110.1 Å²	110.1	90%	0.903	53%	0.528	S	S	*	.			trans	-87.7	0	167.1	179.5	0	0	0	0	109.7	Y815	Y815-V819 HydrophobicContact CD1-CG2 4.3Å; Y815-V819 HydrophobicContact CE1-CG2 3.97Å; Y815-V819 HydrophobicContact CE2-CG2 4.43Å; Y815-V819 WeakPolarHBondContact O-CG2 3.48Å; Y815-V819 PolarHBondContact O-N 3Å; Y815-V819 VanDerWaalsContact O-N 3.1Å

Retrieved 819 of 819 residues in 753.9 ms (Link to these results)

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