A0A087XCT3_POEFO Loading...

Cingulin like 1

AlphaFold DB , UniProt , Accession A0A087XCT3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,257 aa.

						>A0A087XCT3_POEFO|A0A087XCT3
TQPSRHSRASSNGAGSYGLSIRVQGIDGHPYVVLNNQDSGHHPDSNGYPDTEGSFIENYQEYDFRRNKEAGSSDPFMEYRTRHNSGPQNGLPEPQAKKPSTLLNFQRHPELLQPYDPRTNSLNLKGFHSLPSRSSSLDRLLDRTQQENRQPPQTDLNTPKTKSPSLPPAQVPQHQSKAPAQPSQPIQPAQPQPKPTSKTPPVPAAHPQPPPVSSPPSDQRKASPTSTRSANSSLERTHHDPDVLPLRRTDSGEPVQSSSRSRHSSISSTSKSLIDEQMEALYTDAINRHENRRYIPFQPGSGRDIDTGSIPAVDELIDKFDGKDGGNQRRGRAGRRNRINPEDRKRSRSADSAFGSRSDSSFMDEFGPSRGTSKEHVLRPSQLRLQRTASGQDPWSTAVDGPSSQATSAPGSPQSSVSKYIGSLRGCTKLQSRPAIPPFKSSEETPSVRKVSTTSLSKLPPTADSKTSTGADVQVKLHNPTFHIQATPDLLKGQQELSQQTHEETAKQILFSYLKEGSNDNDDVTNKKVNLVFEKIQTLKSRATAGAQGDSKSVDLAAQTKALQEQNAELEKEILELKRQLEEQIKRKQKSQADRRAAAGLKELQQALQQSLDECRQLKEKLAKTEAELNSSVEELFQVKMEREQCQTEIRDLQDQLSEMHDELDSAKRAAADGEKDALMADMMQLKVEMQEVVIAKEELEELLRRRERELAALKGALKDEVAAHDQEVDKMKEQYEKEISRLQMSLEEAKQNSAAAIREKAEVEAAKGQAEGQAGRLNQEIERLRRRTNELENEVAKLNRIIDEAKLLESRLGDKAGRLEREKRQLEESLAEIREQEEEMSRANRMLNIRLEDVQKNLAKLDLENKDLEDRLQEEKSQKEQFKNMKNNIEDERRVLDRTVEKLQREMSDIVEASQSSTRELQEQIDIYKEKNRRELAELQRHLKEKGQELEKLVLTTRNLQEELSLREDELRRCKTERDEAVLKEQTLERKVHDLEMEAEKNKQTKDDKSRQMKLMENRIAQLELDLEEERQSGDQLMDRIDRGREQLLQLRGKVLAQRREWHCDKVPLVQHEAEIKEHILIYNLTNCYLNFESTLTMNLEVNLLHKNERGAFESREKSNLSLANRRLERRVKEMMMQIEEEHHTMQDQKDQLNLRLKALKRQMDEAEETIDRLEHNKKKLHRELDEQQEANEQLNSQLKALRSEMSQCRHKNTSAPLLNNLDDDDDDDDLSTDGEMYFSSSGYKRSSSATVDVTL
					

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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	T	35.7	Very low	38.4	Very low	199 Å²	199	142.1 Å²	142.1	100%	1.221	78%	0.782	S	S	*	*				0	136.1	0	-40.4	0	0	0	0	108.8
2	Q	39.5	Very low	38.2	Very low	179 Å²	179	144.8 Å²	144.8	84%	0.836	79%	0.794	S	S	*	*			trans	-83.2	-177.4	172.6	-112.5	-162.4	18.9	0	0	110.3
3	P	59.3	Low	37.8	Very low	93 Å²	93	138.6 Å²	138.6	60%	0.604	79%	0.785	S	S	*	*			cis	-140.3	162.3	4.7	38.2	-19.1	0	0	0	118.5
4	S	40.9	Very low	37.6	Very low	103 Å²	103	136.6 Å²	136.6	72%	0.72	79%	0.794	S	S	*	*			trans	66.3	171.3	139.1	72.1	0	0	0	0	120.2
5	R	36.4	Very low	37.3	Very low	207 Å²	207	132.7 Å²	132.7	78%	0.781	79%	0.794	S	S	*	*			cis	-145.2	164.7	14.4	-93.9	-168.5	150.4	139.7	2.5	114.3
6	H	33.4	Very low	37.2	Very low	147 Å²	147	131.9 Å²	131.9	68%	0.681	80%	0.798	S	S	*	*			trans	4.3	147.1	149.9	-43.4	-47.6	0	0	0	121.2
7	S	37.8	Very low	37.2	Very low	103 Å²	103	138.1 Å²	138.1	72%	0.72	81%	0.805	S	S	*	*			cis	108.9	147.9	14.2	82	0	0	0	0	117.1
8	R	34.6	Very low	37.3	Very low	244 Å²	244	134.7 Å²	134.7	92%	0.921	80%	0.804	S	S	*	*			trans	76.1	155.8	179.9	-74.6	-168.3	158.6	163.1	-5.5	117.9
9	A	36.3	Very low	37.6	Very low	82 Å²	82	136.4 Å²	136.4	68%	0.678	81%	0.808	S	S	*	*			cis	-170.8	-179.3	-19.9	0	0	0	0	0	112.4
10	S	33.5	Very low	37.8	Very low	113 Å²	113	134.3 Å²	134.3	79%	0.79	80%	0.801	S	S	*	*			trans	75.2	140.9	167.3	-77.2	0	0	0	0	118.9
11	S	35.3	Very low	38.1	Very low	93 Å²	93	134.9 Å²	134.9	65%	0.65	80%	0.798	S	S	*	*			cis	125.2	108.1	-7.6	70.3	0	0	0	0	113.7
12	N	35.5	Very low	38.7	Very low	174 Å²	174	136.1 Å²	136.1	93%	0.93	78%	0.78	S	S	*	*			trans	173.6	152.1	152	-89.3	-16.6	0	0	0	107.5
13	G	33	Very low	38.9	Very low	65 Å²	65	134 Å²	134	67%	0.67	78%	0.78	S	S	*	*			cis	156.2	119.2	-5.9	0	0	0	0	0	110.8
14	A	35.2	Very low	38.4	Very low	111 Å²	111	139.1 Å²	139.1	92%	0.917	80%	0.795	S	S	*	*			trans	62.6	154.5	-173.5	0	0	0	0	0	116
15	G	32.6	Very low	38.4	Very low	77 Å²	77	137.2 Å²	137.2	79%	0.794	79%	0.792	S	S	*	*			cis	144.6	100.1	-9	0	0	0	0	0	112.9
16	S	36.8	Very low	38.9	Very low	121 Å²	121	135.4 Å²	135.4	85%	0.846	80%	0.796	S	S	*	*			trans	-152.4	146.2	169.3	-170	0	0	0	0	110.9
17	Y	37	Very low	39.8	Very low	237 Å²	237	136.2 Å²	136.2	93%	0.929	81%	0.806	S	S	*	*			trans	-89.6	136.7	-174	-66.6	-101.7	0	0	0	110.9
18	G	38.5	Very low	40.5	Very low	76 Å²	76	134.6 Å²	134.6	78%	0.784	81%	0.805	S	S	*	*			trans	-134.3	119.7	-179.7	0	0	0	0	0	112.8
19	L	42.9	Very low	41	Very low	168 Å²	168	131.4 Å²	131.4	88%	0.88	80%	0.801	S	S	*	*			trans	-88.6	108.5	174.5	-71.7	165.2	0	0	0	110.2	I21	L19-I21 PolarHBondContact O-N 2.81Å
20	S	42.1	Very low	41.7	Very low	94 Å²	94	133.8 Å²	133.8	66%	0.657	81%	0.809	S	S	*	*			trans	-87.8	84.3	175.2	68.9	0	0	0	0	111.6
21	I	44.2	Very low	42.3	Very low	146 Å²	146	138 Å²	138	75%	0.749	81%	0.809	S	S	*	*			trans	-70.7	128.5	171.9	-55.8	175.5	0	0	0	108.8	L19 V23	L19-I21 PolarHBondContact O-N 2.81Å; I21-V23 HydrophobicContact CG2-CG2 4.01Å
22	R	48	Very low	42.9	Very low	225 Å²	225	139.8 Å²	139.8	85%	0.849	82%	0.816	S	S	*	*			trans	-120.6	114.8	169.2	-57.5	-175.6	-159.3	-121.1	2.8	108.4
23	V	43.1	Very low	43.4	Very low	136 Å²	136	137.2 Å²	137.2	82%	0.824	81%	0.806	S	S	*	*			trans	-101.4	116.9	173.2	-177	0	0	0	0	107.7	I21	I21-V23 HydrophobicContact CG2-CG2 4.01Å
24	Q	49	Very low	43.8	Very low	199 Å²	199	141.3 Å²	141.3	93%	0.93	81%	0.812	S	S	*	*			trans	-118.8	105.7	170.2	-173.1	161	-1.3	0	0	107.7
25	G	40.5	Very low	43.7	Very low	64 Å²	64	142.8 Å²	142.8	66%	0.66	80%	0.804	S	S	*	*			trans	-94	126.8	-166.7	0	0	0	0	0	114
26	I	48.2	Very low	43.8	Very low	168 Å²	168	146.2 Å²	146.2	86%	0.862	80%	0.804	S	S	*	*	S	Bend		-146.8	133.1	128.6	23	177.6	0	0	0	107.1
27	D	51.3	Low	43.6	Very low	164 Å²	164	148.2 Å²	148.2	88%	0.877	80%	0.8	S	S	*	*	S	Bend	trans	51.1	54.5	178.9	-68.1	-1.8	0	0	0	119.3	H29	D27-H29 PolarHBondContact O-N 2.87Å
28	G	52.1	Low	43.5	Very low	69 Å²	69	144.7 Å²	144.7	71%	0.711	80%	0.797	S	S	*	*				85	14.9	113.3	0	0	0	0	0	121.4
29	H	45.6	Very low	43.2	Very low	178 Å²	178	145.7 Å²	145.7	82%	0.824	79%	0.793	S	S	*	*			trans	-127.8	118.9	170.5	-75.1	-7.2	0	0	0	112.9	D27	D27-H29 PolarHBondContact O-N 2.87Å
30	P	50.5	Low	42.6	Very low	132 Å²	132	140.9 Å²	140.9	86%	0.857	78%	0.784	S	S	*	*			trans	-86.8	139.1	176.7	33.7	-32.8	0	0	0	112.4
31	Y	46.3	Very low	42.1	Very low	202 Å²	202	145.9 Å²	145.9	79%	0.792	80%	0.796	S	S	*	*			trans	-134.9	156.1	168.5	62.9	-89	0	0	0	111	V33	Y31-V33 HydrophobicContact CD2-CG2 4.17Å; Y31-V33 HydrophobicContact CE2-CG2 4.05Å
32	V	49.5	Very low	41.6	Very low	130 Å²	130	147.3 Å²	147.3	79%	0.788	80%	0.799	S	S	*	*			trans	-114.6	130.1	-175	179.9	0	0	0	0	109.6
33	V	45	Very low	41.8	Very low	120 Å²	120	141.4 Å²	141.4	73%	0.727	79%	0.79	S	S	*	*			trans	-105.2	118.9	173.1	-178	0	0	0	0	108.7	Y31	Y31-V33 HydrophobicContact CD2-CG2 4.17Å; Y31-V33 HydrophobicContact CE2-CG2 4.05Å
34	L	41	Very low	41.4	Very low	151 Å²	151	142.3 Å²	142.3	79%	0.791	79%	0.79	S	S	*	*			trans	-91.7	145.1	170.8	-73.2	167.7	0	0	0	109.9
35	N	33.9	Very low	40.4	Very low	142 Å²	142	137 Å²	137	76%	0.759	78%	0.775	S	S	*	*			trans	-113.6	113	-175.8	-178.3	35.3	0	0	0	110.2
36	N	33.6	Very low	40.2	Very low	149 Å²	149	142 Å²	142	80%	0.797	79%	0.787	S	S	*	*			trans	-110.6	131.2	174.8	-71.5	5.9	0	0	0	109.7
37	Q	34	Very low	39.3	Very low	163 Å²	163	137.8 Å²	137.8	76%	0.762	79%	0.785	S	S	*	*			trans	-95.3	143.5	166.6	-67	177.8	-23	0	0	109.3
38	D	33.4	Very low	38.3	Very low	162 Å²	162	140.7 Å²	140.7	87%	0.866	79%	0.785	S	S	*	*			trans	-161.1	156.9	146.8	-95	-35	0	0	0	110.1
39	S	32.7	Very low	38.4	Very low	98 Å²	98	142 Å²	142	69%	0.685	78%	0.782	S	S	*	*			cis	174.8	118.7	-49.8	-93.2	0	0	0	0	108.6
40	G	31.7	Very low	37.7	Very low	67 Å²	67	139.7 Å²	139.7	69%	0.691	78%	0.775	S	S	*	*			trans	81.1	158.2	173.5	0	0	0	0	0	115.6
41	H	30.8	Very low	36.9	Very low	199 Å²	199	140.4 Å²	140.4	92%	0.921	78%	0.777	S	S	*	*			cis	-150.8	156.2	-6.1	-102.3	-50.8	0	0	0	111
42	H	34.4	Very low	36.2	Very low	176 Å²	176	140.1 Å²	140.1	82%	0.815	78%	0.783	S	S	*	*			trans	-112.1	145.8	175.7	-135.5	-48.7	0	0	0	111.9
43	P	52.1	Low	35.4	Very low	101 Å²	101	137.7 Å²	137.7	66%	0.656	78%	0.784	S	S	*	*			trans	-135	174.6	138.3	38.8	-27.4	0	0	0	111.4
44	D	34	Very low	34.9	Very low	155 Å²	155	137 Å²	137	83%	0.829	78%	0.784	S	S	*	*			cis	-162.5	-177.8	-47.1	-148.4	-81.1	0	0	0	108.9
45	S	28.3	Very low	34.5	Very low	87 Å²	87	137.9 Å²	137.9	61%	0.608	78%	0.782	S	S	*	*			trans	64.6	96.3	150.2	-175.3	0	0	0	0	122
46	N	35.6	Very low	34.4	Very low	169 Å²	169	137 Å²	137	90%	0.904	78%	0.776	S	S	*	*			trans	54.2	130.6	131	-67.4	-13.8	0	0	0	123.3
47	G	29.9	Very low	34.3	Very low	80 Å²	80	136.7 Å²	136.7	83%	0.825	77%	0.77	S	S	*	*			trans	162.9	94.2	151.6	0	0	0	0	0	117.5
48	Y	30.2	Very low	34.2	Very low	224 Å²	224	133.8 Å²	133.8	88%	0.878	76%	0.76	S	S	*	*			trans	-110.1	166.7	157.6	-112.9	-101.7	0	0	0	107.4
49	P	54.6	Low	34.1	Very low	98 Å²	98	135.1 Å²	135.1	64%	0.636	75%	0.754	S	S	*	*			cis	-135.7	-175.8	8.4	44.8	-28.3	0	0	0	116.1
50	D	30	Very low	34.1	Very low	128 Å²	128	138.6 Å²	138.6	68%	0.684	76%	0.76	S	S	*	*			trans	20.3	134.8	146.6	-49.6	-27.2	0	0	0	122.5
51	T	34	Very low	34.2	Very low	148 Å²	148	144.1 Å²	144.1	91%	0.908	77%	0.767	S	S	*	*				-173.8	167.3	102.7	20.8	0	0	0	0	113.3
52	E	32.6	Very low	34.2	Very low	196 Å²	196	145.1 Å²	145.1	92%	0.916	77%	0.765	S	S	*	*			trans	-103	154.9	-171.9	-57.4	173.1	107.9	0	0	114.5
53	G	30.8	Very low	34.1	Very low	79 Å²	79	142.7 Å²	142.7	81%	0.814	76%	0.758	S	S	*	*			trans	80.2	169.9	157.1	0	0	0	0	0	117.5
54	S	35	Very low	33.1	Very low	104 Å²	104	145.8 Å²	145.8	73%	0.727	76%	0.761	S	S	*	*			cis	-163.9	158.6	-16.3	-162.8	0	0	0	0	110.9
55	F	32.5	Very low	33.1	Very low	170 Å²	170	149.1 Å²	149.1	75%	0.746	76%	0.762	S	S	*	*			trans	50.1	121.8	151.7	-95.8	-126.2	0	0	0	122.3
56	I	32.3	Very low	33	Very low	123 Å²	123	156.8 Å²	156.8	63%	0.631	78%	0.778	S	S	*	*				51	137	105.3	-79.9	160.7	0	0	0	118.9
57	E	32	Very low	32.7	Very low	144 Å²	144	154.6 Å²	154.6	67%	0.673	77%	0.766	S	S	*	*			cis	-176.1	166.3	-7.9	-160.8	-173.1	161.8	0	0	110.4
58	N	31.2	Very low	32.7	Very low	101 Å²	101	157.8 Å²	157.8	54%	0.54	76%	0.757	S	S	.	*			trans	80.9	128.7	143.6	-93.4	-28.8	0	0	0	126.2
59	Y	30.8	Very low	32.5	Very low	191 Å²	191	154.3 Å²	154.3	75%	0.749	75%	0.749	S	S	*	*			trans	90.7	137.1	135.2	-82.4	-54.5	0	0	0	125.8
60	Q	34	Very low	31.5	Very low	171 Å²	171	154.4 Å²	154.4	80%	0.799	76%	0.758	S	S	*	*			trans	74	139.8	162.2	-65.8	156.6	24.6	0	0	116.4
61	E	33.1	Very low	31.2	Very low	182 Å²	182	152.2 Å²	152.2	85%	0.85	77%	0.766	S	S	*	*			cis	-144.3	-172.2	2.6	-143.6	173.3	172	0	0	112.5
62	Y	30.2	Very low	31.2	Very low	221 Å²	221	150.7 Å²	150.7	87%	0.867	76%	0.761	S	S	*	*			trans	-87.4	151.1	-168.7	-94.2	-116.8	0	0	0	115.1
63	D	31.9	Very low	30.8	Very low	125 Å²	125	146.8 Å²	146.8	67%	0.668	76%	0.755	S	S	*	*				-170.4	162.6	101.1	-135.8	-14.3	0	0	0	118
64	F	31.9	Very low	30.9	Very low	166 Å²	166	149.6 Å²	149.6	73%	0.728	75%	0.752	S	S	*	*			trans	27.4	118.5	166.6	-70.7	-63.1	0	0	0	125.8
65	R	33.8	Very low	30.8	Very low	224 Å²	224	150.6 Å²	150.6	85%	0.845	76%	0.756	S	S	*	*	S	Bend	trans	59.1	86.3	136.3	-59.9	-129.6	-84.8	-148.8	-6.7	121
66	R	27.7	Very low	30.6	Very low	249 Å²	249	150.8 Å²	150.8	94%	0.94	76%	0.756	S	S	*	*				-173.9	102	98.3	-175.9	172.8	-73.1	179.6	-1.9	109.3
67	N	29	Very low	30.6	Very low	123 Å²	123	150.8 Å²	150.8	66%	0.658	76%	0.755	S	S	*	*			trans	-122.5	164.1	-155.7	-74	9.5	0	0	0	110.3
68	K	29.5	Very low	30.6	Very low	147 Å²	147	149.6 Å²	149.6	64%	0.639	75%	0.75	S	S	*	*			cis	-178.9	168.2	-7.8	-105.8	172.9	175.8	-91.1	0	105.1
69	E	25.6	Very low	30.5	Very low	151 Å²	151	152.8 Å²	152.8	71%	0.706	76%	0.755	S	S	*	*			cis	-156.1	-174.8	-9.9	-149	129.5	-138.7	0	0	108.2
70	A	33.3	Very low	30.5	Very low	100 Å²	100	152.8 Å²	152.8	83%	0.826	75%	0.754	S	S	*	*			trans	-85.6	165	162.7	0	0	0	0	0	111.6
71	G	24.3	Very low	30.3	Very low	82 Å²	82	150.3 Å²	150.3	85%	0.845	75%	0.751	S	S	*	*			trans	178	142.8	171.7	0	0	0	0	0	113.8
72	S	34.8	Very low	30	Very low	116 Å²	116	151.3 Å²	151.3	81%	0.811	75%	0.747	S	S	*	*			trans	-131.1	118.6	-180	56.7	0	0	0	0	111.3
73	S	24.2	Very low	30	Very low	114 Å²	114	148.2 Å²	148.2	80%	0.797	74%	0.74	S	S	*	*			trans	-168.1	124.2	165.9	56.4	0	0	0	0	112.4
74	D	32.8	Very low	29.8	Very low	138 Å²	138	149.2 Å²	149.2	74%	0.738	75%	0.745	S	S	*	*			trans	52.3	140.2	139.9	-143.5	48	0	0	0	122.5
75	P	32.4	Very low	29.7	Very low	125 Å²	125	145.4 Å²	145.4	81%	0.812	74%	0.739	S	S	*	*			trans	-135.9	148.5	143.4	37.8	-25.2	0	0	0	114.8
76	F	28.2	Very low	29.6	Very low	173 Å²	173	138 Å²	138	76%	0.759	73%	0.732	S	S	*	*			trans	-105.1	151.9	-171.4	-146.9	-133.4	0	0	0	112.4
77	M	32	Very low	30.4	Very low	123 Å²	123	131.6 Å²	131.6	61%	0.606	72%	0.723	S	S	*	*			trans	84.6	130.3	152.6	-61	-65.7	-112.9	0	0	124.8
78	E	31.8	Very low	30.5	Very low	120 Å²	120	130.2 Å²	130.2	56%	0.561	71%	0.713	S	S	*	*			trans	69.9	149	130.5	-69.2	174.8	159.4	0	0	121.9
79	Y	29.7	Very low	30.8	Very low	167 Å²	167	130.4 Å²	130.4	66%	0.655	72%	0.72	S	S	*	*			cis	-154.5	150.8	4.2	-125.5	-43.3	0	0	0	114.4
80	R	30.6	Very low	31.1	Very low	192 Å²	192	126.7 Å²	126.7	73%	0.725	72%	0.723	S	S	*	*			trans	81.1	86.8	135.6	-158.8	171	-66.5	-153.5	-1.1	122.9
81	T	29.6	Very low	31.3	Very low	119 Å²	119	130 Å²	130	73%	0.73	73%	0.726	S	S	*	*				53.4	122.7	111.4	-43	0	0	0	0	122.7
82	R	27.4	Very low	32.3	Very low	202 Å²	202	132.2 Å²	132.2	76%	0.762	73%	0.725	S	S	*	*				-178.7	133.5	117.7	-96.6	-76	170.3	175.5	-2.6	114.2
83	H	29	Very low	32.3	Very low	156 Å²	156	134.4 Å²	134.4	72%	0.722	72%	0.723	S	S	*	*			trans	72.9	164.9	164.6	-69.4	-70.6	0	0	0	121
84	N	27.5	Very low	33.5	Very low	147 Å²	147	134.1 Å²	134.1	79%	0.786	72%	0.718	S	S	*	*			trans	-123.6	169.3	-144.6	-73.7	6.8	0	0	0	115.7
85	S	30	Very low	33.6	Very low	86 Å²	86	135.4 Å²	135.4	60%	0.601	72%	0.719	S	S	*	*			trans	79.2	128.5	163	60.7	0	0	0	0	118.6	R1163	S85-R1163 PolarHBondContact OG-NH2 2.84Å
86	G	31.7	Very low	33.7	Very low	68 Å²	68	132.9 Å²	132.9	70%	0.701	71%	0.709	S	S	*	*			trans	-87.3	-147.5	170.4	0	0	0	0	0	112.3
87	P	45.3	Very low	34.1	Very low	114 Å²	114	134.7 Å²	134.7	74%	0.74	72%	0.717	S	S	*	*			cis	-109.7	140.3	29.1	2.4	21.8	0	0	0	114.3
88	Q	31.2	Very low	34.6	Very low	95 Å²	95	137.7 Å²	137.7	44%	0.444	73%	0.727	S	S	.	*				84.5	121.1	65.2	-174.5	-157.7	34	0	0	112.5	R835	Q88-R835 PolarHBondContact O-NH1 2.89Å; Q88-R835 PolarHBondContact O-NH2 3.42Å
89	N	35.5	Very low	35.6	Very low	150 Å²	150	137.8 Å²	137.8	80%	0.802	74%	0.738	S	S	*	*			cis	-158.1	160.7	-2.9	-103.2	-4	0	0	0	109.9
90	G	31	Very low	35.9	Very low	73 Å²	73	134.4 Å²	134.4	75%	0.753	74%	0.739	S	S	*	*			trans	164.4	143.4	170.1	0	0	0	0	0	114.2
91	L	38.6	Very low	36.2	Very low	171 Å²	171	131 Å²	131	90%	0.895	74%	0.739	S	S	*	*			trans	-109.6	171.7	-173	-70.3	84.3	0	0	0	112.4
92	P	44	Very low	36.5	Very low	128 Å²	128	133.1 Å²	133.1	83%	0.831	75%	0.745	S	S	*	*			cis	-131.8	-164.9	-23.7	28.8	-4.6	0	0	0	115.2
93	E	36	Very low	36.9	Very low	162 Å²	162	130.6 Å²	130.6	76%	0.757	75%	0.746	S	S	*	*			trans	-88.2	-176.9	-167.6	-132.9	-152.4	122.7	0	0	116.8	Q95	E93-Q95 PolarHBondContact OE1-N 3Å
94	P	49.4	Very low	37	Very low	107 Å²	107	130.6 Å²	130.6	70%	0.695	75%	0.751	S	S	*	*			cis	-126.3	-165	41	46.9	-31.8	0	0	0	114.8
95	Q	34.9	Very low	37.6	Very low	165 Å²	165	131.3 Å²	131.3	77%	0.771	75%	0.748	S	S	*	*			cis	-161.8	173.7	2.5	-150.2	-178.3	93.5	0	0	111.8	E93	E93-Q95 PolarHBondContact OE1-N 3Å
96	A	34.8	Very low	38	Very low	73 Å²	73	131.9 Å²	131.9	60%	0.603	74%	0.741	S	S	*	*			trans	-156	167.8	174.8	0	0	0	0	0	117.9
97	K	35.1	Very low	38.1	Very low	210 Å²	210	138 Å²	138	91%	0.913	74%	0.743	S	S	*	*			trans	-125.9	137.8	169.3	-72.1	-178	176.3	177.7	0	112.2
98	K	43.3	Very low	37.9	Very low	187 Å²	187	140.1 Å²	140.1	81%	0.813	74%	0.743	S	S	*	*			trans	-147.7	-178.9	-164.2	-53.6	175	-173.6	173.4	0	110.7
99	P	52.8	Low	39.1	Very low	122 Å²	122	140.1 Å²	140.1	79%	0.792	75%	0.751	S	S	*	*			cis	-113.7	-121.3	-1.5	21.5	5.9	0	0	0	113.7
100	S	35.3	Very low	39.2	Very low	96 Å²	96	141.1 Å²	141.1	67%	0.671	75%	0.751	S	S	*	*			cis	179.4	168	4	34.3	0	0	0	0	110.4
101	T	37.1	Very low	39.6	Very low	121 Å²	121	145.4 Å²	145.4	74%	0.742	76%	0.755	S	S	*	*			cis	-175.8	175.5	-21.7	37.2	0	0	0	0	111.2
102	L	36.2	Very low	39.5	Very low	162 Å²	162	145.2 Å²	145.2	85%	0.848	76%	0.755	S	S	*	*			trans	98.5	157.5	158.6	-50.6	-177.1	0	0	0	122.1
103	L	35.8	Very low	39.2	Very low	149 Å²	149	148 Å²	148	78%	0.78	76%	0.756	S	S	*	*			trans	-157.8	174.3	-173.3	-69.5	178.8	0	0	0	115.1	F105	L103-F105 HydrophobicContact CB-CE1 4.04Å; L103-F105 HydrophobicContact CB-CZ 3.79Å; L103-F105 HydrophobicContact CD1-CE1 4.35Å
104	N	32.5	Very low	39.7	Very low	156 Å²	156	146.3 Å²	146.3	83%	0.834	76%	0.76	S	S	*	*			trans	-132.5	153.7	165.9	-164.1	3.8	0	0	0	112.5
105	F	38.8	Very low	39	Very low	163 Å²	163	149.3 Å²	149.3	72%	0.715	76%	0.758	S	S	*	*			trans	-122.8	-165.6	-159.4	-52	-72.6	0	0	0	110.9	L103	L103-F105 HydrophobicContact CB-CE1 4.04Å; L103-F105 HydrophobicContact CB-CZ 3.79Å; L103-F105 HydrophobicContact CD1-CE1 4.35Å
106	Q	38.3	Very low	39.4	Very low	98 Å²	98	146.3 Å²	146.3	46%	0.458	75%	0.748	S	S	.	*			cis	-156.8	165.8	16.3	169.4	-98	36.4	0	0	109.4	H108	Q106-H108 PolarHBondContact NE2-CD2 2.95Å; Q106-H108 VanDerWaalsContact NE2-CD2 3.32Å; Q106-H108 PolarHBondContact NE2-ND1 2.83Å
107	R	33.9	Very low	39.9	Very low	195 Å²	195	148.7 Å²	148.7	74%	0.736	76%	0.757	S	S	*	*			trans	-144.6	162.2	155.4	-152.6	106.2	-49.8	-69.8	-0.2	111.3
108	H	42.1	Very low	40.4	Very low	160 Å²	160	148.9 Å²	148.9	74%	0.741	75%	0.752	S	S	*	*			trans	-171	168.5	-161.9	-104	38.2	0	0	0	108.8	Q106	Q106-H108 PolarHBondContact NE2-CD2 2.95Å; Q106-H108 VanDerWaalsContact NE2-CD2 3.32Å; Q106-H108 PolarHBondContact NE2-ND1 2.83Å
109	P	56.4	Low	40.3	Very low	95 Å²	95	145 Å²	145	62%	0.617	74%	0.744	S	S	*	*			cis	-137	-170.6	-3.1	37.4	-17.1	0	0	0	115.2
110	E	36.5	Very low	39.4	Very low	171 Å²	171	146.3 Å²	146.3	80%	0.799	74%	0.744	S	S	*	*			trans	72	136.6	163.1	-63.3	179.3	-127.7	0	0	117
111	L	39.5	Very low	39.3	Very low	162 Å²	162	146.9 Å²	146.9	85%	0.848	75%	0.748	S	S	*	*			cis	-127.3	167.1	0.7	-75	175	0	0	0	111.8
112	L	36.8	Very low	39.6	Very low	168 Å²	168	148.1 Å²	148.1	88%	0.88	75%	0.75	S	S	*	*			trans	-123.8	111.2	174	-175.9	105.3	0	0	0	110.6
113	Q	38.4	Very low	39.2	Very low	186 Å²	186	147.9 Å²	147.9	87%	0.869	75%	0.749	S	S	*	*			trans	-171.7	158.9	154.3	-108	177.3	18.3	0	0	111.1
114	P	46.8	Very low	39.2	Very low	127 Å²	127	147.3 Å²	147.3	83%	0.825	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-83.1	151	-173.2	34.1	-34.3	0	0	0	113
115	Y	34.7	Very low	39.2	Very low	169 Å²	169	149.3 Å²	149.3	66%	0.663	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-101.1	134.1	-179.7	-176.1	-108.9	0	0	0	112.1	T119	Y115-T119 PolarHBondContact OH-O 2.93Å
116	D	41.6	Very low	38.6	Very low	103 Å²	103	145.1 Å²	145.1	55%	0.551	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-95.3	125.6	-174.3	-175.3	-10.7	0	0	0	110.3	R118	D116-R118 PolarHBondContact O-N 3.12Å; D116-R118 WeakPolarHBondContact OD1-CG 3.37Å
117	P	47.1	Very low	38.3	Very low	123 Å²	123	148.7 Å²	148.7	80%	0.799	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	32.6	-168	31.2	-39.5	0	0	0	115.7
118	R	44.9	Very low	38	Very low	214 Å²	214	147.5 Å²	147.5	81%	0.808	77%	0.767	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.1	-5.9	-170.3	-56.6	-164.2	81.9	-167.8	4.3	116.5	D116	D116-R118 PolarHBondContact O-N 3.12Å; D116-R118 WeakPolarHBondContact OD1-CG 3.37Å
119	T	41.4	Very low	37.4	Very low	105 Å²	105	144.4 Å²	144.4	64%	0.644	76%	0.763	S	S	*	*			trans	-145.9	95.1	-174.5	55.7	0	0	0	0	115.5	Y115	Y115-T119 PolarHBondContact OH-O 2.93Å
120	N	32.6	Very low	36.4	Very low	149 Å²	149	147.7 Å²	147.7	80%	0.797	78%	0.775	S	S	*	*			trans	-155	127.3	142.3	-151.6	-19.6	0	0	0	112.9
121	S	34.3	Very low	36.6	Very low	109 Å²	109	145 Å²	145	76%	0.762	77%	0.772	S	S	*	*			trans	-146.2	98.8	-179.3	-66.9	0	0	0	0	112.2
122	L	42.6	Very low	36.1	Very low	147 Å²	147	142.2 Å²	142.2	77%	0.77	77%	0.766	S	S	*	*			trans	40.5	122.8	143.7	-54.8	176.5	0	0	0	120.9
123	N	27.9	Very low	35.7	Very low	156 Å²	156	145.1 Å²	145.1	83%	0.834	77%	0.765	S	S	*	*				-165.2	129.7	124.1	-103.6	-80.3	0	0	0	107.4
124	L	37	Very low	35.1	Very low	137 Å²	137	141 Å²	141	72%	0.717	76%	0.757	S	S	*	*			cis	88.7	91.4	16.3	-149.1	98.4	0	0	0	116.5
125	K	30.5	Very low	34.1	Very low	199 Å²	199	139.7 Å²	139.7	87%	0.865	75%	0.751	S	S	*	*			trans	-178.4	137	136.1	-104.3	165.8	-177.3	177.5	0	112.1
126	G	28.1	Very low	33.7	Very low	75 Å²	75	136.6 Å²	136.6	77%	0.773	75%	0.754	S	S	*	*			trans	157.7	60.3	176.4	0	0	0	0	0	115.3
127	F	30.6	Very low	33.1	Very low	172 Å²	172	139.2 Å²	139.2	75%	0.754	77%	0.767	S	S	*	*			trans	-70.6	145.6	171	-57.6	-96.1	0	0	0	109.7
128	H	28.3	Very low	32.3	Very low	170 Å²	170	139.7 Å²	139.7	79%	0.787	76%	0.763	S	S	*	*				-178.9	168	71.5	-87	-74.4	0	0	0	109.1
129	S	29.6	Very low	31.5	Very low	95 Å²	95	139 Å²	139	66%	0.664	76%	0.76	S	S	*	*			cis	-164.9	173.1	-5.6	-113.4	0	0	0	0	111.2
130	L	34.7	Very low	30.8	Very low	164 Å²	164	140.6 Å²	140.6	86%	0.859	77%	0.765	S	S	*	*			trans	-115.3	-174.1	160.2	-73.3	176.4	0	0	0	108.1
131	P	42.2	Very low	30.7	Very low	116 Å²	116	140.7 Å²	140.7	75%	0.753	76%	0.764	S	S	*	*			cis	-153.3	-162.3	22.6	46.5	-22.7	0	0	0	118.9
132	S	28.3	Very low	30.4	Very low	102 Å²	102	141.5 Å²	141.5	71%	0.713	76%	0.76	S	S	*	*			trans	-32.9	167.9	167.3	65.8	0	0	0	0	119.1
133	R	27.7	Very low	29.6	Very low	229 Å²	229	144.6 Å²	144.6	86%	0.864	76%	0.761	S	S	*	*			cis	-168.1	165	33.5	-154.7	179.5	-174.8	-159	2.9	113.8
134	S	26.8	Very low	29.6	Very low	100 Å²	100	143.4 Å²	143.4	70%	0.699	76%	0.76	S	S	*	*			trans	75.7	145.6	147.9	47.3	0	0	0	0	124.5
135	S	26.1	Very low	29.2	Very low	100 Å²	100	145.4 Å²	145.4	70%	0.699	77%	0.765	S	S	*	*			trans	73.4	94.4	147.9	59.9	0	0	0	0	123.1
136	S	25.6	Very low	29.2	Very low	103 Å²	103	144 Å²	144	72%	0.72	76%	0.762	S	S	*	*				65.1	134.8	118.4	66.2	0	0	0	0	124.2
137	L	29.6	Very low	29.2	Very low	159 Å²	159	147.4 Å²	147.4	83%	0.832	76%	0.758	S	S	*	*			trans	76.6	116.2	152.6	-70.7	165.1	0	0	0	120.1
138	D	29	Very low	29	Very low	132 Å²	132	145.5 Å²	145.5	71%	0.706	76%	0.756	S	S	*	*				32.7	137.9	116.5	-119.2	24.8	0	0	0	118.9
139	R	28	Very low	29	Very low	199 Å²	199	148.6 Å²	148.6	75%	0.751	76%	0.76	S	S	*	*			cis	-168.3	172.7	23.1	-156.6	175	-160.5	-135.5	1.4	112.4
140	L	27.3	Very low	28.9	Very low	140 Å²	140	152.7 Å²	152.7	73%	0.733	77%	0.769	S	S	*	*			trans	90.2	138.8	155.7	-65.6	169.9	0	0	0	120.8
141	L	30.4	Very low	29.7	Very low	151 Å²	151	150.5 Å²	150.5	79%	0.791	76%	0.764	S	S	*	*			trans	-7.7	126.8	169.3	-79.9	56.8	0	0	0	117.8
142	D	27.3	Very low	30	Very low	126 Å²	126	149.9 Å²	149.9	67%	0.674	76%	0.761	S	S	*	*				87.7	122.8	56.7	-172.8	41.9	0	0	0	114
143	R	27.2	Very low	29.9	Very low	212 Å²	212	153.1 Å²	153.1	80%	0.8	77%	0.765	S	S	*	*			trans	53	141.4	173.7	-73.3	148.8	98.1	168.5	6	117.1
144	T	27.9	Very low	30	Very low	130 Å²	130	147.5 Å²	147.5	80%	0.798	76%	0.756	S	S	*	*			cis	-148	162.3	38.9	-47.7	0	0	0	0	112.2
145	Q	28.9	Very low	30.1	Very low	179 Å²	179	149.3 Å²	149.3	84%	0.836	76%	0.757	S	S	*	*			trans	-69	142.5	172.2	-59.4	164.3	-21.1	0	0	112
146	Q	29.8	Very low	30.5	Very low	169 Å²	169	151.4 Å²	151.4	79%	0.79	76%	0.76	S	S	*	*				-166.6	147.5	118.6	-114.4	-179	-73.3	0	0	114.5
147	E	28.4	Very low	30.8	Very low	148 Å²	148	152.3 Å²	152.3	69%	0.692	76%	0.757	S	S	*	*			trans	20.6	114	155.5	-72.4	174.9	94.7	0	0	121.1
148	N	26.3	Very low	30.9	Very low	132 Å²	132	150.5 Å²	150.5	71%	0.706	75%	0.752	S	S	*	*				66.3	86.9	81.8	-177.9	28.6	0	0	0	115.6
149	R	27.2	Very low	32	Very low	234 Å²	234	148.6 Å²	148.6	88%	0.883	75%	0.748	S	S	*	*				-170.6	159.6	120.3	-105.6	170.3	-178.3	-108.9	-0.3	113.9
150	Q	28.5	Very low	32.4	Very low	181 Å²	181	148.1 Å²	148.1	85%	0.846	75%	0.751	S	S	*	*			trans	-80.9	179.7	170.6	-55.4	167.5	-48.9	0	0	111
151	P	50.7	Low	32.7	Very low	118 Å²	118	146.9 Å²	146.9	77%	0.766	75%	0.749	S	S	*	*				-122.1	-136.7	-53.6	38.2	-19.5	0	0	0	107.3
152	P	49.2	Very low	33	Very low	104 Å²	104	148.6 Å²	148.6	68%	0.675	75%	0.75	S	S	*	*			cis	-130.6	176.2	-27.4	39.9	-23.1	0	0	0	115.3
153	Q	26.3	Very low	33.2	Very low	170 Å²	170	147.4 Å²	147.4	79%	0.794	75%	0.752	S	S	*	*			trans	42.9	129.3	143.6	-74.1	-174.8	-36.7	0	0	124.6
154	T	29.8	Very low	34.5	Very low	110 Å²	110	142.6 Å²	142.6	68%	0.675	75%	0.748	S	S	*	*			trans	67.4	111.2	138.4	55.9	0	0	0	0	122.5
155	D	29.7	Very low	34.8	Very low	138 Å²	138	142 Å²	142	74%	0.738	75%	0.749	S	S	*	*				86.1	111.8	121.1	-63.8	-6.8	0	0	0	123.8
156	L	34.2	Very low	35.3	Very low	144 Å²	144	141.4 Å²	141.4	75%	0.754	75%	0.751	S	S	*	*			trans	90	127.2	130.3	-69.3	170.1	0	0	0	122.5
157	N	31.9	Very low	36.9	Very low	122 Å²	122	139 Å²	139	65%	0.652	75%	0.75	S	S	*	*			trans	96.6	90.5	137.4	-71.1	-20.3	0	0	0	123.8
158	T	31.6	Very low	38.4	Very low	121 Å²	121	137.2 Å²	137.2	74%	0.742	75%	0.752	S	S	*	*				72.4	164.7	119.8	56.9	0	0	0	0	121.9
159	P	51.1	Low	38.7	Very low	93 Å²	93	135.4 Å²	135.4	60%	0.604	76%	0.755	S	S	*	*			cis	-145.9	173.4	-30.1	36.1	-16.8	0	0	0	118.4
160	K	37	Very low	39	Very low	188 Å²	188	133.5 Å²	133.5	82%	0.817	76%	0.756	S	S	*	*			trans	74.7	153.2	148.1	-76	160.4	-175.2	174	0	119.3
161	T	34.2	Very low	39.4	Very low	115 Å²	115	131.4 Å²	131.4	71%	0.706	76%	0.755	S	S	*	*			cis	-161.5	153.6	7.3	-0.4	0	0	0	0	116.1
162	K	35.3	Very low	39.3	Very low	186 Å²	186	131.8 Å²	131.8	81%	0.809	76%	0.758	S	S	*	*			trans	76.1	109.8	140.2	-79.4	174.7	178.7	-174.6	0	126.6
163	S	32	Very low	38.6	Very low	102 Å²	102	134.6 Å²	134.6	71%	0.713	76%	0.762	S	S	*	*				45.6	162.4	118.8	62.8	0	0	0	0	125.2
164	P	55.6	Low	39	Very low	110 Å²	110	134 Å²	134	71%	0.714	76%	0.759	S	S	*	*			cis	-147.4	178.9	-27.4	38.8	-17.4	0	0	0	119.3
165	S	33.6	Very low	39	Very low	118 Å²	118	137.1 Å²	137.1	83%	0.825	77%	0.766	S	S	*	*			trans	81.2	165.8	148.6	46.6	0	0	0	0	125.3
166	L	39	Very low	39.1	Very low	167 Å²	167	135.2 Å²	135.2	87%	0.874	76%	0.763	S	S	*	*			trans	-123.5	-178.3	-164.6	-69.3	156.5	0	0	0	112.6
167	P	64.6	Low	38.8	Very low	118 Å²	118	138.4 Å²	138.4	77%	0.766	77%	0.771	S	S	*	*			cis	-124.2	-116.3	-7.9	26.5	1.5	0	0	0	112
168	P	58.9	Low	38.8	Very low	111 Å²	111	137 Å²	137	72%	0.721	78%	0.776	S	S	*	*			cis	-140.1	160.3	-35.8	37.6	-16.9	0	0	0	120.5
169	A	33.5	Very low	39.5	Very low	94 Å²	94	137 Å²	137	78%	0.777	78%	0.778	S	S	*	*			trans	63.4	139.7	138.5	0	0	0	0	0	128.6
170	Q	32.9	Very low	38.6	Very low	193 Å²	193	137.3 Å²	137.3	90%	0.902	79%	0.789	S	S	*	*			trans	71.6	158.1	156.8	-70.3	-179.9	-7.5	0	0	121.6
171	V	37.4	Very low	38.5	Very low	138 Å²	138	136.9 Å²	136.9	84%	0.836	79%	0.789	S	S	*	*			trans	-148.9	149.2	-155.7	-174.7	0	0	0	0	114
172	P	48.4	Very low	39.2	Very low	126 Å²	126	136.5 Å²	136.5	82%	0.818	79%	0.789	S	S	*	*			trans	-106.8	-167.1	-177.5	41.9	-37.2	0	0	0	117.3
173	Q	34.1	Very low	39.1	Very low	163 Å²	163	133.2 Å²	133.2	76%	0.762	79%	0.789	S	S	*	*			trans	-124.6	152.8	-172.2	-87.2	-179.2	-61.1	0	0	116.3
174	H	33.8	Very low	39.3	Very low	158 Å²	158	137 Å²	137	73%	0.731	80%	0.796	S	S	*	*			trans	60.4	148.7	140.6	-69.7	-49.2	0	0	0	127
175	Q	31	Very low	39.1	Very low	174 Å²	174	136.9 Å²	136.9	81%	0.813	80%	0.795	S	S	*	*			trans	103.1	93.8	137.1	-94	-177.1	67.4	0	0	124.1
176	S	31.5	Very low	39.1	Very low	98 Å²	98	139.1 Å²	139.1	69%	0.685	80%	0.796	S	S	*	*				97.9	141.1	113.3	80.9	0	0	0	0	124.7
177	K	28	Very low	39	Very low	212 Å²	212	139.6 Å²	139.6	92%	0.922	79%	0.794	S	S	*	*			trans	82.3	149.1	150.7	-79.2	178.7	176.2	177.4	0	122.6
178	A	30.7	Very low	38.4	Very low	92 Å²	92	139.8 Å²	139.8	76%	0.76	80%	0.795	S	S	*	*			trans	-115.2	-155.7	-178.7	0	0	0	0	0	109.5
179	P	47.9	Very low	37.1	Very low	121 Å²	121	139 Å²	139	79%	0.786	80%	0.798	S	S	*	*			cis	-150.1	-172.7	24.9	45.4	-23.4	0	0	0	119.3
180	A	31	Very low	37	Very low	100 Å²	100	142.6 Å²	142.6	83%	0.826	80%	0.799	S	S	*	*			trans	90.2	153.8	140.4	0	0	0	0	0	123.9
181	Q	34.8	Very low	37.9	Very low	178 Å²	178	138.4 Å²	138.4	83%	0.832	79%	0.789	S	S	*	*			trans	-111.5	-173.1	179.7	-116.9	-169.6	38.7	0	0	109.6
182	P	49.1	Very low	37.5	Very low	107 Å²	107	139 Å²	139	70%	0.695	78%	0.782	S	S	*	*			cis	-158.3	-179.7	36.9	45.7	-22.6	0	0	0	121.3
183	S	32.7	Very low	37.6	Very low	117 Å²	117	139 Å²	139	82%	0.818	78%	0.782	S	S	*	*			trans	67.9	158.9	141	-68.6	0	0	0	0	127.2
184	Q	37.9	Very low	37.5	Very low	181 Å²	181	140.1 Å²	140.1	85%	0.846	79%	0.785	S	S	*	*			trans	-90.8	179.9	-175.9	-71.6	-169.2	0.8	0	0	114
185	P	49.5	Very low	38.2	Very low	109 Å²	109	137.7 Å²	137.7	71%	0.708	78%	0.782	S	S	*	*			cis	-162.2	169.8	40.2	45.6	-21.1	0	0	0	124.7
186	I	35.2	Very low	38.1	Very low	165 Å²	165	135.4 Å²	135.4	85%	0.846	78%	0.781	S	S	*	*			trans	67.5	157.8	140.9	-67.9	167.8	0	0	0	124.2
187	Q	37.1	Very low	38	Very low	176 Å²	176	135.2 Å²	135.2	82%	0.822	78%	0.779	S	S	*	*			trans	-97.9	178	-166.7	-43.5	174.5	-9.6	0	0	116.1
188	P	50.7	Low	38	Very low	123 Å²	123	134.6 Å²	134.6	80%	0.799	78%	0.776	S	S	*	*				-163.3	168.9	81.2	43.5	-21.4	0	0	0	122.5
189	A	31.4	Very low	38.1	Very low	94 Å²	94	136.5 Å²	136.5	78%	0.777	78%	0.779	S	S	*	*			trans	77.1	113	140.2	0	0	0	0	0	129
190	Q	32.9	Very low	38.1	Very low	169 Å²	169	136.3 Å²	136.3	79%	0.79	78%	0.778	S	S	*	*				36.3	173	127.4	-88.8	-161	23.1	0	0	125.9
191	P	51.8	Low	39	Very low	106 Å²	106	137.4 Å²	137.4	69%	0.688	78%	0.776	S	S	*	*			cis	-145.9	164.6	17.4	43.2	-22.8	0	0	0	122.6
192	Q	28.2	Very low	38.6	Very low	150 Å²	150	135.3 Å²	135.3	70%	0.701	78%	0.776	S	S	*	*			trans	49.7	167.7	143.1	-66.5	-64.5	-45.3	0	0	123.7
193	P	51	Low	38.5	Very low	125 Å²	125	136.2 Å²	136.2	81%	0.812	78%	0.781	S	S	*	*			cis	-129	-156	2.9	40.9	-20.6	0	0	0	117.9
194	K	30.3	Very low	38.2	Very low	188 Å²	188	135 Å²	135	82%	0.817	78%	0.779	S	S	*	*			trans	-118.7	179.7	-163.3	-116.4	172.7	-173.1	172.4	0	112.8
195	P	49.1	Very low	37.7	Very low	106 Å²	106	131.3 Å²	131.3	69%	0.688	78%	0.779	S	S	*	*				-159.8	171	50.1	45.4	-22.5	0	0	0	122.2
196	T	28.4	Very low	36.9	Very low	127 Å²	127	135 Å²	135	78%	0.779	79%	0.787	S	S	*	*			trans	44	154.5	145.3	52.6	0	0	0	0	125.6
197	S	31.1	Very low	37.2	Very low	93 Å²	93	133.1 Å²	133.1	65%	0.65	79%	0.785	S	S	*	*			cis	176.8	157.9	-27.1	59.8	0	0	0	0	113.7
198	K	27.8	Very low	36.7	Very low	199 Å²	199	133 Å²	133	87%	0.865	78%	0.784	S	S	*	*			trans	99.7	155.2	158.3	-62.3	-179.1	-179.4	179.7	0	120.4
199	T	31.4	Very low	37	Very low	133 Å²	133	132.3 Å²	132.3	82%	0.816	78%	0.779	S	S	*	*			trans	-123.3	179	-176.5	47	0	0	0	0	109.8
200	P	48.3	Very low	38.3	Very low	117 Å²	117	133 Å²	133	76%	0.76	78%	0.776	S	S	*	*			cis	-111.8	-145.3	-8.1	44.2	-29.9	0	0	0	109.7
201	P	49.7	Very low	39.1	Very low	122 Å²	122	130 Å²	130	79%	0.792	77%	0.772	S	S	*	*			cis	-130.9	-160.8	-12.1	41.8	-22.1	0	0	0	114.5
202	V	27.1	Very low	38	Very low	135 Å²	135	131.2 Å²	131.2	82%	0.818	78%	0.776	S	S	*	*			trans	-149.5	151.4	172.5	70.1	0	0	0	0	110.6
203	P	47.4	Very low	38.1	Very low	126 Å²	126	129.7 Å²	129.7	82%	0.818	78%	0.782	S	S	*	*			trans	-105.6	-143.4	-167.7	42.8	-39.1	0	0	0	115.9
204	A	26.8	Very low	37.3	Very low	92 Å²	92	129.2 Å²	129.2	76%	0.76	78%	0.782	S	S	*	*			trans	-130	179.6	-168.8	0	0	0	0	0	112.8
205	A	26.6	Very low	38.6	Very low	103 Å²	103	125.9 Å²	125.9	85%	0.851	78%	0.78	S	S	*	*			trans	81.1	144.1	155.9	0	0	0	0	0	122.7
206	H	33	Very low	38.9	Very low	187 Å²	187	126.3 Å²	126.3	87%	0.866	78%	0.782	S	S	*	*			trans	-74.3	174	160.2	-84.6	-54	0	0	0	111.2
207	P	41.6	Very low	39.1	Very low	125 Å²	125	125 Å²	125	81%	0.812	78%	0.779	S	S	*	*			cis	-144.9	-158.9	29.2	43.4	-20.8	0	0	0	117.4
208	Q	26.8	Very low	39.2	Very low	174 Å²	174	124.9 Å²	124.9	81%	0.813	77%	0.771	S	S	*	*			trans	-87.4	-161.7	175.2	-56.9	-175.3	-16.5	0	0	112.8
209	P	57.1	Low	39.5	Very low	107 Å²	107	122.6 Å²	122.6	70%	0.695	76%	0.763	S	S	*	*				-119.6	-113.2	-56.7	31	-13	0	0	0	110.9
210	P	59	Low	39.5	Very low	109 Å²	109	124 Å²	124	71%	0.708	75%	0.754	S	S	*	*				-98.1	-139.3	-83.5	41.4	-25.5	0	0	0	111.1
211	P	47.9	Very low	38.9	Very low	107 Å²	107	128.7 Å²	128.7	70%	0.695	76%	0.762	S	S	*	*			cis	-137.1	151.8	-19.9	36	-15.9	0	0	0	118.9
212	V	29.6	Very low	38	Very low	130 Å²	130	126.7 Å²	126.7	79%	0.788	76%	0.755	S	S	*	*			trans	43	130.9	130.2	-170.1	0	0	0	0	124.3
213	S	30.9	Very low	38.5	Very low	118 Å²	118	125.7 Å²	125.7	83%	0.825	76%	0.755	S	S	*	*			trans	-161.7	159.5	147.5	-77.5	0	0	0	0	111
214	S	32.7	Very low	38.6	Very low	115 Å²	115	125.6 Å²	125.6	80%	0.804	75%	0.754	S	S	*	*			trans	-155.6	-53.3	-175.4	-46	0	0	0	0	123.4
215	P	58.2	Low	38.9	Very low	118 Å²	118	126.9 Å²	126.9	77%	0.766	75%	0.753	S	S	*	*			trans	-98	179.3	-155.2	39.7	-37.9	0	0	0	115
216	P	55.6	Low	39.3	Very low	115 Å²	115	127.2 Å²	127.2	75%	0.747	75%	0.748	S	S	*	*			cis	-139	-168.1	9.8	45	-26.3	0	0	0	117.3
217	S	33.2	Very low	39.3	Very low	101 Å²	101	124.4 Å²	124.4	71%	0.706	74%	0.744	S	S	*	*			trans	52.9	128.2	157.8	-79.4	0	0	0	0	121.4
218	D	32.9	Very low	38.9	Very low	90 Å²	90	129.6 Å²	129.6	48%	0.481	75%	0.748	S	S	.	*			cis	-168.8	173.3	11.8	-86.8	-19.4	0	0	0	110.2	R220	D218-R220 VanDerWaalsContact CG-NH2 3.35Å; D218-R220 IonicContact OD2-CZ 3.2Å; D218-R220 IonicContact OD2-NH1 2.93Å; D218-R220 PolarHBondContact OD2-NH1 2.7Å; D218-R220 IonicContact OD2-NH2 2.7Å; D218-R220 PolarHBondContact OD2-NH2 3.04Å
219	Q	33.8	Very low	39.2	Very low	150 Å²	150	126.4 Å²	126.4	70%	0.701	75%	0.745	S	S	*	*			cis	-154.3	-85.5	-24.2	-96.1	170	24.7	0	0	112
220	R	32	Very low	38.2	Very low	164 Å²	164	125.5 Å²	125.5	62%	0.619	75%	0.747	S	S	*	*			cis	-161.4	33.6	-14.1	-163.7	134.5	-91.8	160.6	0.2	117.4	D218	D218-R220 VanDerWaalsContact CG-NH2 3.35Å; D218-R220 IonicContact OD2-CZ 3.2Å; D218-R220 IonicContact OD2-NH1 2.93Å; D218-R220 PolarHBondContact OD2-NH1 2.7Å; D218-R220 IonicContact OD2-NH2 2.7Å; D218-R220 PolarHBondContact OD2-NH2 3.04Å
221	K	35.1	Very low	36.8	Very low	215 Å²	215	128.4 Å²	128.4	94%	0.935	76%	0.756	S	S	*	*			trans	78.3	148.3	171.8	-62.3	-176.2	178.5	-178.2	0	118.5
222	A	31.3	Very low	35.9	Very low	79 Å²	79	129.3 Å²	129.3	65%	0.653	77%	0.765	S	S	*	*			cis	-159.9	136	-9.1	0	0	0	0	0	111.2
223	S	36.3	Very low	36.1	Very low	115 Å²	115	128 Å²	128	80%	0.804	76%	0.762	S	S	*	*				75.9	151.2	104.8	-54.2	0	0	0	0	116.4
224	P	51.3	Low	36.2	Very low	123 Å²	123	129.4 Å²	129.4	80%	0.799	76%	0.759	S	S	*	*			cis	-122.5	-178.5	21.3	41.5	-27.2	0	0	0	115.4
225	T	32.7	Very low	36.2	Very low	120 Å²	120	130 Å²	130	74%	0.736	75%	0.749	S	S	*	*			cis	-165.8	141.9	-27.6	-85.9	0	0	0	0	110.4
226	S	35.3	Very low	35	Very low	109 Å²	109	133.7 Å²	133.7	76%	0.762	75%	0.748	S	S	*	*			trans	14.7	153.8	156.1	-50.3	0	0	0	0	123.1
227	T	32.2	Very low	33.8	Very low	128 Å²	128	134 Å²	134	79%	0.785	75%	0.748	S	S	*	*			cis	-141	150.9	29.4	46.8	0	0	0	0	111.4
228	R	33	Very low	33.8	Very low	235 Å²	235	136.6 Å²	136.6	89%	0.887	75%	0.748	S	S	*	*				67.5	136.1	63.2	-125.3	-166.8	169.4	-174.9	-2.7	113.2
229	S	33.8	Very low	33.7	Very low	106 Å²	106	140.5 Å²	140.5	74%	0.741	76%	0.763	S	S	*	*			cis	-150.9	173.4	10.8	-159.9	0	0	0	0	113
230	A	35.1	Very low	33.6	Very low	89 Å²	89	140.1 Å²	140.1	74%	0.736	77%	0.766	S	S	*	*			trans	-101.7	176.9	-178.1	0	0	0	0	0	114.7
231	N	29.5	Very low	34.9	Very low	169 Å²	169	137.1 Å²	137.1	90%	0.904	77%	0.768	S	S	*	*			trans	-138	135.8	169.3	-89	-26.5	0	0	0	111.4
232	S	30.1	Very low	34.6	Very low	126 Å²	126	133.9 Å²	133.9	88%	0.881	76%	0.761	S	S	*	*			trans	-175.5	129	166.6	176.6	0	0	0	0	111
233	S	32.6	Very low	34.9	Very low	103 Å²	103	136.6 Å²	136.6	72%	0.72	77%	0.769	S	S	*	*			trans	-179.6	162.3	148.1	-161.5	0	0	0	0	112.1
234	L	33.5	Very low	35	Very low	148 Å²	148	138.6 Å²	138.6	78%	0.775	77%	0.77	S	S	*	*			trans	69.8	146.9	168	-60.7	132	0	0	0	118.7
235	E	33.6	Very low	35.1	Very low	126 Å²	126	137.9 Å²	137.9	59%	0.589	77%	0.765	S	S	*	*			cis	-172	153.5	-38.7	-127.6	-166	163.1	0	0	111.6
236	R	33.3	Very low	35.1	Very low	196 Å²	196	139.8 Å²	139.8	74%	0.74	77%	0.77	S	S	*	*			trans	67.6	155.1	160.1	-59.4	168.4	-158.3	-89.2	-15.2	116.6
237	T	30.3	Very low	35	Very low	122 Å²	122	145 Å²	145	75%	0.748	77%	0.773	S	S	*	*			cis	-154.6	155.4	4.1	-6.7	0	0	0	0	112.5
238	H	33.4	Very low	35.2	Very low	155 Å²	155	148 Å²	148	72%	0.718	77%	0.77	S	S	*	*			trans	-16.1	155.6	162.6	-64.3	-109.9	0	0	0	120.2
239	H	30.3	Very low	35.3	Very low	173 Å²	173	143 Å²	143	80%	0.801	77%	0.766	S	S	*	*				-165	161.2	52	-116.4	-72.1	0	0	0	116.5
240	D	30.4	Very low	35	Very low	141 Å²	141	142.4 Å²	142.4	75%	0.754	75%	0.754	S	S	*	*			trans	-96.4	-173.9	172.2	-78.4	-54.4	0	0	0	113.4
241	P	59.5	Low	35.1	Very low	102 Å²	102	143.8 Å²	143.8	66%	0.662	76%	0.759	S	S	*	*			cis	-141.2	-165.5	-39.2	38.4	-18.1	0	0	0	115
242	D	30.2	Very low	35.3	Very low	146 Å²	146	139.7 Å²	139.7	78%	0.781	76%	0.756	S	S	*	*			trans	58.7	133.3	144.7	-74.3	-35.9	0	0	0	124.6
243	V	36.8	Very low	35.2	Very low	137 Å²	137	141.8 Å²	141.8	83%	0.83	75%	0.752	S	S	*	*				177.2	141.8	101.7	157.1	0	0	0	0	111.4
244	L	37.5	Very low	35.9	Very low	156 Å²	156	142.2 Å²	142.2	82%	0.817	75%	0.752	S	S	*	*			trans	-110	-166.8	178.9	-75.1	173.2	0	0	0	111
245	P	54.9	Low	35.6	Very low	109 Å²	109	139.7 Å²	139.7	71%	0.708	74%	0.743	S	S	*	*				-127.7	-177.3	-56.9	36.6	-22.7	0	0	0	111.8
246	L	31.7	Very low	35.5	Very low	159 Å²	159	142 Å²	142	83%	0.832	75%	0.753	S	S	*	*			trans	-162.2	112.2	147.1	-112.7	156	0	0	0	115
247	R	32.6	Very low	35.3	Very low	219 Å²	219	137.6 Å²	137.6	83%	0.826	75%	0.753	S	S	*	*			trans	40	129.4	154.5	-68.7	-178.5	179.3	-143	-2.6	121
248	R	36.3	Very low	35.2	Very low	192 Å²	192	135 Å²	135	73%	0.725	74%	0.74	S	S	*	*				68.2	142.9	63.2	-84.2	-174.2	179	-100.4	-1.3	113.4	D250	R248-D250 IonicContact CZ-OD1 3.16Å; R248-D250 IonicContact CZ-OD2 3.82Å; R248-D250 IonicContact NH1-OD1 3.9Å; R248-D250 PolarHBondContact NH1-OD1 2.69Å; R248-D250 IonicContact NH1-OD2 2.78Å; R248-D250 PolarHBondContact NH1-OD2 2.64Å; R248-D250 IonicContact NH2-OD1 2.72Å
249	T	35.6	Very low	34.9	Very low	130 Å²	130	131.4 Å²	131.4	80%	0.798	73%	0.732	S	S	*	*			cis	-100.6	-127.1	31.4	55.3	0	0	0	0	117.7
250	D	27.3	Very low	34.8	Very low	93 Å²	93	126.7 Å²	126.7	50%	0.497	71%	0.707	S	S	.	*			trans	-170	156.5	-135.4	-62.6	-102.8	0	0	0	106.6	R248	R248-D250 IonicContact CZ-OD1 3.16Å; R248-D250 IonicContact CZ-OD2 3.82Å; R248-D250 IonicContact NH1-OD1 3.9Å; R248-D250 PolarHBondContact NH1-OD1 2.69Å; R248-D250 IonicContact NH1-OD2 2.78Å; R248-D250 PolarHBondContact NH1-OD2 2.64Å; R248-D250 IonicContact NH2-OD1 2.72Å
251	S	36.7	Very low	34.6	Very low	118 Å²	118	122 Å²	122	83%	0.825	69%	0.686	S	S	*	*			cis	-172.7	145.5	-14.7	52	0	0	0	0	107.1
252	G	33.7	Very low	33.2	Very low	83 Å²	83	121.1 Å²	121.1	86%	0.856	67%	0.669	S	S	*	*			trans	-160.6	48.6	-170.4	0	0	0	0	0	118.8
253	E	29.6	Very low	33	Very low	170 Å²	170	120 Å²	120	79%	0.794	66%	0.659	S	S	*	*			trans	-78.8	171.3	154.5	-101.2	-168.6	145.4	0	0	110.2
254	P	47.3	Very low	32.4	Very low	111 Å²	111	117.7 Å²	117.7	72%	0.721	65%	0.649	S	S	*	*			cis	-143.6	150.3	28	34.9	-11.6	0	0	0	120.2
255	V	27.5	Very low	31.9	Very low	95 Å²	95	115.4 Å²	115.4	58%	0.576	65%	0.646	S	S	*	*				48.7	119.1	122.9	-173.3	0	0	0	0	121.7
256	Q	30.7	Very low	30.6	Very low	174 Å²	174	118 Å²	118	81%	0.813	65%	0.653	S	S	*	*			trans	29.9	132.5	137.3	-45.6	170.5	-1.3	0	0	119.5
257	S	28.7	Very low	30.3	Very low	104 Å²	104	115 Å²	115	73%	0.727	65%	0.645	S	S	*	*				171.1	179.2	69	52.9	0	0	0	0	107.6
258	S	28.5	Very low	30.2	Very low	68 Å²	68	108.7 Å²	108.7	48%	0.476	63%	0.634	S	S	.	*			cis	177	-179.9	41.2	-150.5	0	0	0	0	110.2	K1134	S258-K1134 VanDerWaalsContact CB-NZ 3.3Å; S258-K1134 WeakPolarHBondContact OG-CE 3.38Å; S258-K1134 PolarHBondContact OG-NZ 2.64Å
259	S	27.1	Very low	30.1	Very low	80 Å²	80	106.2 Å²	106.2	56%	0.559	64%	0.641	S	S	*	*			trans	67.7	102.4	162.6	-58.8	0	0	0	0	117
260	R	28	Very low	29.9	Very low	73 Å²	73	105.1 Å²	105.1	28%	0.275	64%	0.638	S	S	.	*			cis	95.3	137.1	22.9	-153.9	165.8	116.7	-79.1	20.3	113.7	V1133 K1134 M1137 E1141	R260-V1133 PolarHBondContact NH1-O 3.24Å; R260-V1133 PolarHBondContact NH2-O 2.91Å; R260-K1134 PolarHBondContact NH2-O 3.23Å; R260-M1137 HydrophobicContact CB-CE 4.33Å; R260-M1137 WeakPolarHBondContact O-CE 3.33Å; R260-E1141 WeakPolarHBondContact CD-OE2 3.39Å; R260-E1141 WeakPolarHBondContact CG-OE1 3.39Å; R260-E1141 WeakPolarHBondContact CG-OE2 3.4Å; R260-E1141 IonicContact NE-OE2 2.75Å; R260-E1141 PolarHBondContact NE-OE2 3.06Å; R260-E1141 VanDerWaalsContact NE-OE2 3.11Å
261	S	27.1	Very low	29.9	Very low	43 Å²	43	110.8 Å²	110.8	30%	0.301	66%	0.658	S	S	.	*			trans	33.7	153.9	170	3.7	0	0	0	0	124.9	M1137 E1141	S261-M1137 WeakPolarHBondContact O-CE 3.26Å; S261-M1137 WeakPolarHBondContact OG-CB 3.42Å; S261-M1137 VanDerWaalsContact OG-CE 3.25Å; S261-M1137 WeakPolarHBondContact OG-CE 3.04Å; S261-M1137 PolarHBondContact OG-O 2.8Å; S261-E1141 WeakPolarHBondContact CA-OE1 3.29Å; S261-E1141 WeakPolarHBondContact CB-OE1 3.13Å; S261-E1141 PolarHBondContact N-OE1 3.12Å; S261-E1141 VanDerWaalsContact N-OE1 3.11Å; S261-E1141 PolarHBondContact OG-OE1 3.29Å
262	R	29.9	Very low	29.7	Very low	83 Å²	83	110.4 Å²	110.4	31%	0.313	66%	0.656	S	S	.	*			trans	172.8	-166.2	137.2	-61.6	156	-150.5	-80.5	-15.1	114	I1140 E1141 H1144	R262-I1140 VanDerWaalsContact CZ-O 3.25Å; R262-I1140 PolarHBondContact NH1-O 2.85Å; R262-I1140 PolarHBondContact NH2-O 3.49Å; R262-E1141 VanDerWaalsContact NH2-CA 3.26Å; R262-H1144 VanDerWaalsContact NH2-CB 3.28Å
263	H	24.6	Very low	29.5	Very low	122 Å²	122	113.8 Å²	113.8	57%	0.565	65%	0.653	S	S	*	*			trans	-123	152.2	-142.4	-96.4	-67.7	0	0	0	116.7
264	S	25.1	Very low	29.6	Very low	89 Å²	89	112.1 Å²	112.1	62%	0.622	65%	0.648	S	S	*	*			trans	-29.9	155	154.7	50.4	0	0	0	0	120
265	S	27.9	Very low	28.8	Very low	108 Å²	108	113.9 Å²	113.9	76%	0.755	65%	0.652	S	S	*	*			trans	87.4	137.2	141.7	-67.9	0	0	0	0	121.2
266	I	26.5	Very low	29	Very low	165 Å²	165	116.7 Å²	116.7	85%	0.846	66%	0.659	S	S	*	*			trans	13.2	151.7	153	48.4	156.5	0	0	0	121.2
267	S	25.6	Very low	29.4	Very low	95 Å²	95	116.5 Å²	116.5	66%	0.664	66%	0.658	S	S	*	*			cis	-172.1	168.9	-10.3	174.6	0	0	0	0	108.3
268	S	30.6	Very low	29.4	Very low	87 Å²	87	120.1 Å²	120.1	61%	0.608	67%	0.665	S	S	*	*			trans	41	109.8	152.1	47.6	0	0	0	0	119.4
269	T	33.4	Very low	29.5	Very low	140 Å²	140	125.5 Å²	125.5	86%	0.859	68%	0.683	S	S	*	*				56.1	141.3	86.4	64.5	0	0	0	0	115
270	S	32.4	Very low	29.8	Very low	107 Å²	107	125.3 Å²	125.3	75%	0.748	69%	0.686	S	S	*	*			cis	-155.4	170.3	26.2	62.4	0	0	0	0	113.8
271	K	26.9	Very low	30	Very low	212 Å²	212	129.3 Å²	129.3	92%	0.922	71%	0.712	S	S	*	*				-162.1	145.9	129.8	-108.7	-169.7	180	-162.1	0	109.9
272	S	31.9	Very low	30.2	Very low	110 Å²	110	137.5 Å²	137.5	77%	0.769	74%	0.738	S	S	*	*			trans	-133.5	163.9	-174.8	51.7	0	0	0	0	110.8
273	L	29.6	Very low	30.4	Very low	153 Å²	153	139.5 Å²	139.5	80%	0.801	76%	0.76	S	S	*	*			trans	-173.1	156.6	145.7	-111.2	173	0	0	0	112.7
274	I	32.1	Very low	30.9	Very low	135 Å²	135	141 Å²	141	69%	0.692	77%	0.772	S	S	*	*			trans	82.8	116.7	163.4	-64.2	161.8	0	0	0	118
275	D	30.1	Very low	31.3	Very low	148 Å²	148	140.5 Å²	140.5	79%	0.791	77%	0.773	S	S	*	*			trans	59.4	136.5	151	-60.1	-1.9	0	0	0	121.3
276	E	32.2	Very low	31.6	Very low	154 Å²	154	142.6 Å²	142.6	72%	0.72	77%	0.774	S	S	*	*			cis	-156.4	170.2	-6.3	-150.4	-162	-173	0	0	110.7
277	Q	39.5	Very low	32.3	Very low	170 Å²	170	140.3 Å²	140.3	79%	0.794	76%	0.764	S	S	*	*			trans	79	139.1	165.8	-61	168.4	40.4	0	0	117.4
278	M	28	Very low	32.6	Very low	180 Å²	180	146.7 Å²	146.7	89%	0.887	77%	0.773	S	S	*	*			trans	-121.3	151.1	-163.6	-51.6	176	-67.2	0	0	112.1
279	E	32	Very low	33.1	Very low	182 Å²	182	149.4 Å²	149.4	85%	0.85	78%	0.776	S	S	*	*				-169.4	155.3	127	-156.4	58.9	-98.9	0	0	109.9
280	A	33.3	Very low	33.1	Very low	76 Å²	76	151.9 Å²	151.9	63%	0.628	78%	0.778	S	S	*	*			trans	3.5	119.4	168.2	0	0	0	0	0	118.9
281	L	31.9	Very low	33.9	Very low	157 Å²	157	153.9 Å²	153.9	82%	0.822	78%	0.78	S	S	*	*			cis	58.3	152	40.3	-79.6	172.3	0	0	0	116.6
282	Y	31.6	Very low	34.5	Very low	215 Å²	215	155.1 Å²	155.1	84%	0.843	78%	0.779	S	S	*	*			trans	76.4	129.7	-177.8	-58.9	-77.3	0	0	0	115.8
283	T	33.3	Very low	35.5	Very low	125 Å²	125	161.4 Å²	161.4	77%	0.767	79%	0.786	S	S	*	*			cis	-147.7	150.1	-0.2	25	0	0	0	0	111.4
284	D	34.6	Very low	35.7	Very low	153 Å²	153	163.8 Å²	163.8	82%	0.818	79%	0.786	S	S	*	*			trans	-82.6	144.3	152.4	174.8	30.8	0	0	0	110.2
285	A	33.4	Very low	36.5	Very low	79 Å²	79	164.2 Å²	164.2	65%	0.653	79%	0.788	S	S	*	*			trans	-163.5	86.9	168	0	0	0	0	0	113.2
286	I	34.6	Very low	36.7	Very low	152 Å²	152	162 Å²	162	78%	0.779	78%	0.782	S	S	*	*			trans	56.5	111.8	130.4	-59.6	165.9	0	0	0	118.5	R288	I286-R288 PolarHBondContact O-N 3.06Å
287	N	40.4	Very low	36.8	Very low	117 Å²	117	163.7 Å²	163.7	63%	0.626	79%	0.787	S	S	*	*			trans	-36	122.7	152.5	169.9	34.9	0	0	0	115.4	H289	N287-H289 PolarHBondContact OD1-CE1 2.88Å
288	R	33.6	Very low	36.5	Very low	229 Å²	229	164.8 Å²	164.8	86%	0.864	79%	0.792	S	S	*	*			trans	-152.5	145.6	134.1	-143	173.2	-178.4	90.8	0.7	113.3	I286	I286-R288 PolarHBondContact O-N 3.06Å
289	H	40.4	Very low	37	Very low	144 Å²	144	162.4 Å²	162.4	67%	0.667	79%	0.79	S	S	*	*			trans	-78.5	143.1	172.4	-27.8	-54.9	0	0	0	109.8	N287	N287-H289 PolarHBondContact OD1-CE1 2.88Å
290	E	33.9	Very low	37.3	Very low	191 Å²	191	157.6 Å²	157.6	89%	0.893	79%	0.79	S	S	*	*				-176.9	143.7	114	-101.5	175.2	-137.9	0	0	114.1	R292	E290-R292 PolarHBondContact O-N 3.42Å
291	N	49.3	Very low	37.6	Very low	150 Å²	150	160.1 Å²	160.1	80%	0.802	80%	0.803	S	S	*	*			trans	-43.2	109.5	175.1	171.4	18.9	0	0	0	115.1
292	R	38	Very low	37.9	Very low	237 Å²	237	156.1 Å²	156.1	89%	0.894	80%	0.799	S	S	*	*			trans	-146.3	141.4	148.7	-110.1	164.7	-152.8	-85.2	-3.9	112.5	E290 Y294	E290-R292 PolarHBondContact O-N 3.42Å; R292-Y294 PolarHBondContact O-N 2.79Å
293	R	54.3	Low	38.3	Very low	242 Å²	242	157.1 Å²	157.1	91%	0.913	80%	0.802	S	S	*	*			trans	-67.5	126.2	-177.2	-60.6	173.1	176.2	-149.9	-2.9	111.1
294	Y	32.6	Very low	38.6	Very low	204 Å²	204	159 Å²	159	80%	0.8	81%	0.807	S	S	*	*			trans	-147.1	142.2	156.5	-137	-93.2	0	0	0	110	R292 P296	R292-Y294 PolarHBondContact O-N 2.79Å; Y294-P296 HydrophobicContact CD1-CG 4.47Å
295	I	50.3	Low	39	Very low	143 Å²	143	159.2 Å²	159.2	73%	0.733	81%	0.806	S	S	*	*			trans	-121.8	93.5	169.7	-59.6	176.2	0	0	0	107
296	P	34	Very low	39.2	Very low	103 Å²	103	162.5 Å²	162.5	67%	0.669	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-85.1	126.7	162.9	28.9	-20.8	0	0	0	109.3	Y294	Y294-P296 HydrophobicContact CD1-CG 4.47Å
297	F	32.9	Very low	40.2	Very low	188 Å²	188	161.7 Å²	161.7	83%	0.825	82%	0.816	S	S	*	*	P	Polyproline II helix	trans	-73.4	144.6	176.9	-65.8	-101.6	0	0	0	110.9
298	Q	34.7	Very low	40.4	Very low	193 Å²	193	158.7 Å²	158.7	90%	0.902	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-90.6	132.4	157.1	-87	-171.7	-20.1	0	0	110
299	P	38.1	Very low	41.2	Very low	130 Å²	130	153.4 Å²	153.4	84%	0.844	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-84.7	156.5	178.8	34.9	-35.1	0	0	0	111.9
300	G	38.5	Very low	42	Very low	82 Å²	82	154.3 Å²	154.3	85%	0.845	82%	0.818	S	S	*	*			trans	129.1	50.1	161.2	0	0	0	0	0	118.2
301	S	40	Very low	43.2	Very low	128 Å²	128	149.4 Å²	149.4	90%	0.895	80%	0.803	S	S	*	*			trans	-146.3	121.6	149.4	-159.3	0	0	0	0	109.3
302	G	38.2	Very low	43.9	Very low	73 Å²	73	145.5 Å²	145.5	75%	0.753	79%	0.792	S	S	*	*			trans	-81.9	156.6	-167.7	0	0	0	0	0	114
303	R	38.7	Very low	44.9	Very low	236 Å²	236	139.4 Å²	139.4	89%	0.891	78%	0.78	S	S	*	*			trans	-124.2	146.5	142.5	-80.2	-172.8	172.6	169.8	-1.5	108.1	I305	R303-I305 PolarHBondContact O-N 3.43Å
304	D	40.7	Very low	45	Very low	165 Å²	165	133.5 Å²	133.5	88%	0.882	77%	0.767	S	S	*	*			trans	-65.2	130.8	-167.7	-46.2	-88.7	0	0	0	110.9
305	I	42.4	Very low	46.5	Very low	157 Å²	157	129.1 Å²	129.1	81%	0.805	75%	0.754	S	S	*	*			trans	-94.8	100.3	166.1	-57.8	-180	0	0	0	106.3	R303 T307	R303-I305 PolarHBondContact O-N 3.43Å; I305-T307 PolarHBondContact O-N 3.39Å
306	D	37.7	Very low	47.2	Very low	148 Å²	148	127.8 Å²	127.8	79%	0.791	75%	0.748	S	S	*	*			trans	-58.6	122.3	173.6	-175.7	10.5	0	0	0	110.1	G308	D306-G308 PolarHBondContact O-N 3.43Å
307	T	54.8	Low	48.6	Very low	136 Å²	136	127.5 Å²	127.5	83%	0.834	74%	0.74	S	S	*	*			trans	-84.2	48.9	-175.9	48.6	0	0	0	0	112.2	I305	I305-T307 PolarHBondContact O-N 3.39Å
308	G	46	Very low	49.8	Very low	54 Å²	54	125.2 Å²	125.2	56%	0.557	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-67.7	138.7	169.8	0	0	0	0	0	112.1	D306	D306-G308 PolarHBondContact O-N 3.43Å
309	S	50.6	Low	51	Low	118 Å²	118	122.3 Å²	122.3	83%	0.825	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-70.4	136.4	176.6	-65.9	0	0	0	0	111.5	P311	S309-P311 WeakPolarHBondContact O-CD 3.48Å
310	I	56.5	Low	51.9	Low	162 Å²	162	125 Å²	125	83%	0.831	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-69.6	122.5	-174.5	-58.3	169.2	0	0	0	110.5
311	P	58.3	Low	52.6	Low	88 Å²	88	128.1 Å²	128.1	57%	0.571	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-65.4	148.4	169.8	-19.8	33.4	0	0	0	111.8	S309	S309-P311 WeakPolarHBondContact O-CD 3.48Å
312	A	64.1	Low	52.6	Low	68 Å²	68	125 Å²	125	56%	0.562	70%	0.704	S	S	*	*	P	Polyproline II helix	trans	-62.2	149.7	-179.4	0	0	0	0	0	112.5	D314 E315	A312-D314 PolarHBondContact O-N 3.02Å; A312-D314 VanDerWaalsContact O-N 3.13Å; A312-E315 WeakPolarHBondContact O-CB 3.42Å; A312-E315 PolarHBondContact O-N 2.64Å; A312-E315 VanDerWaalsContact O-N 3.09Å
313	V	60	Low	53	Low	109 Å²	109	130.4 Å²	130.4	66%	0.661	71%	0.707	S	S	*	*	T	Hydrogen-bonded Turn	trans	-57.3	-32.5	-173.2	176.9	0	0	0	0	112.7	E315 L316 I317	V313-E315 VanDerWaalsContact C-N 3.26Å; V313-E315 PolarHBondContact O-N 3.41Å; V313-L316 WeakPolarHBondContact O-CB 2.98Å; V313-L316 PolarHBondContact O-N 3.45Å; V313-I317 HydrophobicContact CG1-CD1 4.29Å; V313-I317 PolarHBondContact O-N 3.09Å
314	D	56.3	Low	53.3	Low	118 Å²	118	126.7 Å²	126.7	63%	0.631	71%	0.705	S	S	*	*	H	α-helix	trans	-60.5	-35.2	-179.7	-50.1	-63.8	0	0	0	112.4	A312 L316 I317 D318	A312-D314 PolarHBondContact O-N 3.02Å; A312-D314 VanDerWaalsContact O-N 3.13Å; D314-L316 PolarHBondContact O-N 3.05Å; D314-I317 PolarHBondContact O-N 3.24Å; D314-D318 PolarHBondContact O-N 2.89Å
315	E	63.8	Low	53.3	Low	113 Å²	113	122.8 Å²	122.8	53%	0.528	70%	0.703	S	S	.	*	H	α-helix	trans	-67.8	-16.1	176.3	-113.2	-153.1	-136.4	0	0	113.4	A312 V313 K319	A312-E315 WeakPolarHBondContact O-CB 3.42Å; A312-E315 PolarHBondContact O-N 2.64Å; A312-E315 VanDerWaalsContact O-N 3.09Å; V313-E315 VanDerWaalsContact C-N 3.26Å; V313-E315 PolarHBondContact O-N 3.41Å; E315-K319 WeakPolarHBondContact O-CG 2.9Å; E315-K319 PolarHBondContact O-NZ 2.87Å; E315-K319 IonicContact OE2-NZ 3.91Å; E315-K319 PolarHBondContact OE2-NZ 3.3Å
316	L	64.3	Low	53.1	Low	115 Å²	115	119 Å²	119	60%	0.602	70%	0.703	S	S	*	*	H	α-helix	trans	-89	-25	176.3	-139.5	76	0	0	0	112.2	V313 D314 K319	V313-L316 WeakPolarHBondContact O-CB 2.98Å; V313-L316 PolarHBondContact O-N 3.45Å; D314-L316 PolarHBondContact O-N 3.05Å; L316-K319 PolarHBondContact O-N 3.17Å
317	I	63.2	Low	53.2	Low	97 Å²	97	118.5 Å²	118.5	50%	0.497	70%	0.701	S	S	.	*	H	α-helix	trans	-75.8	-44.8	-177.2	-65.1	172.2	0	0	0	110.4	V313 D314 K319 F320 D321	V313-I317 HydrophobicContact CG1-CD1 4.29Å; V313-I317 PolarHBondContact O-N 3.09Å; D314-I317 PolarHBondContact O-N 3.24Å; I317-K319 PolarHBondContact O-N 2.87Å; I317-F320 PolarHBondContact O-N 3.32Å; I317-D321 PolarHBondContact O-N 3.42Å
318	D	59.1	Low	52.4	Low	139 Å²	139	118.8 Å²	118.8	74%	0.743	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56	-23.9	173.7	-90.4	-2.5	0	0	0	113.4	D314	D314-D318 PolarHBondContact O-N 2.89Å
319	K	60.7	Low	52.1	Low	133 Å²	133	125.1 Å²	125.1	58%	0.578	70%	0.7	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-5.9	-179.7	-61.5	-177.2	-178.7	90.5	0	113.6	E315 L316 I317	E315-K319 WeakPolarHBondContact O-CG 2.9Å; E315-K319 PolarHBondContact O-NZ 2.87Å; E315-K319 IonicContact OE2-NZ 3.91Å; E315-K319 PolarHBondContact OE2-NZ 3.3Å; L316-K319 PolarHBondContact O-N 3.17Å; I317-K319 PolarHBondContact O-N 2.87Å
320	F	56.2	Low	51.6	Low	185 Å²	185	127.3 Å²	127.3	81%	0.811	69%	0.69	S	S	*	*	T	Hydrogen-bonded Turn	trans	-115.7	-25.2	179.8	-90.3	-81.8	0	0	0	115.3	I317 G322	I317-F320 PolarHBondContact O-N 3.32Å; F320-G322 PolarHBondContact O-N 3.22Å
321	D	52.6	Low	50.8	Low	148 Å²	148	123 Å²	123	79%	0.791	69%	0.686	S	S	*	*	S	Bend	trans	-87	8.5	172.9	-120.6	-24	0	0	0	113	I317 K323	I317-D321 PolarHBondContact O-N 3.42Å; D321-K323 PolarHBondContact O-N 3.2Å
322	G	41.1	Very low	50.1	Low	62 Å²	62	127.1 Å²	127.1	64%	0.639	69%	0.69	S	S	*	*			trans	-64.6	95.9	174.6	0	0	0	0	0	112.8	F320	F320-G322 PolarHBondContact O-N 3.22Å
323	K	45.7	Very low	49	Very low	187 Å²	187	127.5 Å²	127.5	81%	0.813	69%	0.693	S	S	*	*			trans	-67.1	147.5	178.4	-142.2	169.3	-171	167.4	0	112.4	D321	D321-K323 PolarHBondContact O-N 3.2Å
324	D	44.7	Very low	47.9	Very low	158 Å²	158	126.1 Å²	126.1	85%	0.845	70%	0.7	S	S	*	*			trans	66.4	140.6	176.6	-49.4	-41	0	0	0	115.7
325	G	40.5	Very low	47.2	Very low	83 Å²	83	130.4 Å²	130.4	86%	0.856	71%	0.708	S	S	*	*			cis	150.3	86.7	-2.5	0	0	0	0	0	112.1
326	G	38.2	Very low	46.1	Very low	78 Å²	78	136.7 Å²	136.7	80%	0.804	73%	0.727	S	S	*	*			trans	-143.8	33	-156.1	0	0	0	0	0	121.4
327	N	41.5	Very low	45	Very low	138 Å²	138	139.3 Å²	139.3	74%	0.738	74%	0.741	S	S	*	*			trans	32.5	108.7	157.5	-90.5	-42.9	0	0	0	123.1
328	Q	38	Very low	44.2	Very low	141 Å²	141	146.5 Å²	146.5	66%	0.659	76%	0.762	S	S	*	*				83.8	133.5	118.1	-85.9	-170.9	73.5	0	0	126
329	R	38.8	Very low	43.4	Very low	187 Å²	187	147.9 Å²	147.9	71%	0.706	77%	0.768	S	S	*	*			trans	78.8	150.5	142.2	-74.1	179.1	172.6	-146	-0.4	119.2
330	R	39.7	Very low	42.3	Very low	164 Å²	164	147 Å²	147	62%	0.619	77%	0.769	S	S	*	*			cis	-154	143.1	-3.2	-135.9	177.9	-174.2	-159.5	6.4	109.7
331	G	40.3	Very low	42	Very low	72 Å²	72	143.4 Å²	143.4	74%	0.742	76%	0.764	S	S	*	*				99.4	158.3	93.4	0	0	0	0	0	112
332	R	43.6	Very low	41.6	Very low	175 Å²	175	143.7 Å²	143.7	66%	0.66	76%	0.761	S	S	*	*			cis	-165.7	172.5	-0.9	-95.8	-177.7	168.6	-99.3	-2.7	107.4
333	A	40.8	Very low	41.9	Very low	75 Å²	75	148 Å²	148	62%	0.62	77%	0.77	S	S	*	*			cis	-178.8	136.5	-35.2	0	0	0	0	0	109.3
334	G	36.5	Very low	42	Very low	80 Å²	80	150 Å²	150	83%	0.825	77%	0.772	S	S	*	*			trans	-79.3	162.8	165.9	0	0	0	0	0	112.7
335	R	42.5	Very low	41.7	Very low	209 Å²	209	152 Å²	152	79%	0.789	77%	0.773	S	S	*	*			trans	-135.9	125	176.6	-75	-172.2	172.3	-85.8	15.5	113
336	R	40.1	Very low	41.7	Very low	245 Å²	245	159.7 Å²	159.7	93%	0.925	78%	0.776	S	S	*	*			trans	-106.4	155.6	145.5	-80.1	-177	169.8	-178.9	-3.7	108.1
337	N	41.4	Very low	41.5	Very low	170 Å²	170	161 Å²	161	91%	0.909	77%	0.773	S	S	*	*			trans	-73.2	130.5	-175.3	-68.5	-25.2	0	0	0	112.1
338	R	46.8	Very low	41.3	Very low	248 Å²	248	166 Å²	166	94%	0.936	78%	0.782	S	S	*	*			trans	-148.3	150.9	161.9	-152	168	-173.6	163.6	2.6	109.2
339	I	41.8	Very low	41.1	Very low	167 Å²	167	164.5 Å²	164.5	86%	0.856	79%	0.787	S	S	*	*			trans	-70.9	154.6	-156.5	-64.8	159.1	0	0	0	113.5
340	N	38	Very low	41.2	Very low	115 Å²	115	159.7 Å²	159.7	62%	0.615	79%	0.787	S	S	*	*			trans	-79.5	141.9	-174.7	-161.5	42.3	0	0	0	112.3
341	P	48.5	Very low	40.8	Very low	109 Å²	109	158.6 Å²	158.6	71%	0.708	79%	0.794	S	S	*	*	S	Bend	trans	-99.2	9	-171.3	38	-36.5	0	0	0	116.7
342	E	45.4	Very low	40.4	Very low	155 Å²	155	160 Å²	160	72%	0.724	79%	0.792	S	S	*	*			trans	-88.3	-9.7	-172.5	-73.9	-65.1	160.6	0	0	115.7	R344	E342-R344 PolarHBondContact O-N 2.9Å
343	D	48.2	Very low	39.9	Very low	153 Å²	153	155.8 Å²	155.8	82%	0.818	79%	0.794	S	S	*	*			trans	-77	57.5	-179.3	-64.7	-48.3	0	0	0	112.6
344	R	46.3	Very low	39.7	Very low	229 Å²	229	162.2 Å²	162.2	86%	0.864	81%	0.809	S	S	*	*			trans	-137.4	39.6	-175.1	-146.8	177.7	-179.8	102.6	-0.2	115.6	E342	E342-R344 PolarHBondContact O-N 2.9Å
345	K	39.8	Very low	39.4	Very low	199 Å²	199	162.5 Å²	162.5	87%	0.865	81%	0.811	S	S	*	*	S	Bend	trans	-133.7	133.2	157.1	-74.4	-171.4	179.2	174.9	0	111.6
346	R	40	Very low	39	Very low	245 Å²	245	158.3 Å²	158.3	93%	0.925	81%	0.814	S	S	*	*			trans	66.7	139.3	-169.1	-61.7	177	172	-103.3	-0.5	114.6
347	S	33.5	Very low	38.6	Very low	105 Å²	105	157.5 Å²	157.5	73%	0.734	81%	0.811	S	S	*	*			cis	173.3	140	-38.3	-100.9	0	0	0	0	107.7
348	R	37	Very low	37.9	Very low	243 Å²	243	154.8 Å²	154.8	92%	0.917	81%	0.806	S	S	*	*			trans	68.2	147.7	170.6	-59.6	170.7	171.3	-176.3	-6.2	115.4
349	S	33.8	Very low	37.1	Very low	109 Å²	109	149.8 Å²	149.8	76%	0.762	80%	0.797	S	S	*	*			cis	-162.7	155.5	-24.5	40.8	0	0	0	0	108.2
350	A	40.6	Very low	36.7	Very low	86 Å²	86	146.4 Å²	146.4	71%	0.711	79%	0.789	S	S	*	*			trans	-76.6	160.1	172.5	0	0	0	0	0	112
351	D	30.8	Very low	36.4	Very low	142 Å²	142	145.8 Å²	145.8	76%	0.759	79%	0.793	S	S	*	*			trans	62.4	128.9	159.4	-85.7	-66.5	0	0	0	122.2
352	S	33.1	Very low	35.5	Very low	100 Å²	100	149.4 Å²	149.4	70%	0.699	80%	0.798	S	S	*	*				37	114.8	119.2	-49.1	0	0	0	0	119.7
353	A	33.4	Very low	35	Very low	87 Å²	87	148.9 Å²	148.9	72%	0.719	80%	0.798	S	S	*	*	S	Bend	trans	58.2	115.2	145.6	0	0	0	0	0	120.2
354	F	35.3	Very low	34.1	Very low	211 Å²	211	147.8 Å²	147.8	93%	0.925	79%	0.792	S	S	*	*			trans	42.3	87.4	140.2	-65.1	-80.3	0	0	0	119.3
355	G	31.1	Very low	33.4	Very low	85 Å²	85	144.1 Å²	144.1	88%	0.876	78%	0.784	S	S	*	*				66.3	110.8	124.1	0	0	0	0	0	118.9
356	S	33.3	Very low	33	Very low	121 Å²	121	143.6 Å²	143.6	85%	0.846	78%	0.782	S	S	*	*			trans	-133.5	114.3	155.7	-176.8	0	0	0	0	110.6
357	R	31.8	Very low	32.6	Very low	229 Å²	229	135.3 Å²	135.3	86%	0.864	77%	0.773	S	S	*	*			trans	-160.1	86.2	157.6	-165.2	178	-178.9	-142.7	-7.7	111.9
358	S	27.5	Very low	33.3	Very low	113 Å²	113	136.1 Å²	136.1	79%	0.79	78%	0.776	S	S	*	*			trans	-136.1	153.9	142	-79.1	0	0	0	0	108.8
359	D	30.1	Very low	33.3	Very low	142 Å²	142	129.5 Å²	129.5	76%	0.759	77%	0.767	S	S	*	*			trans	-64.6	167.7	-176.5	-55.3	-60.5	0	0	0	113.1
360	S	34	Very low	33.5	Very low	97 Å²	97	135.9 Å²	135.9	68%	0.678	77%	0.774	S	S	*	*			cis	-171.6	-178.4	-17.9	52.3	0	0	0	0	109.7
361	S	30.5	Very low	33.3	Very low	102 Å²	102	134.9 Å²	134.9	71%	0.713	77%	0.772	S	S	*	*			trans	53	101	156.2	61.4	0	0	0	0	121.2
362	F	30.7	Very low	33.6	Very low	185 Å²	185	135.5 Å²	135.5	81%	0.811	78%	0.781	S	S	*	*				38.2	106.4	114.5	-168.3	-105.5	0	0	0	120.2
363	M	33.9	Very low	33.9	Very low	144 Å²	144	136.1 Å²	136.1	71%	0.709	79%	0.785	S	S	*	*			trans	-174.8	136.2	144.3	-94.1	-66.3	94.6	0	0	107.8
364	D	29.5	Very low	34.2	Very low	130 Å²	130	141 Å²	141	70%	0.695	79%	0.79	S	S	*	*				71	98.1	99	-145.9	54.4	0	0	0	113.5
365	E	32.8	Very low	34.4	Very low	151 Å²	151	138.2 Å²	138.2	71%	0.706	78%	0.78	S	S	*	*				86.2	150.1	87.6	-156.9	172.7	-130.6	0	0	114.1
366	F	30.8	Very low	34.9	Very low	188 Å²	188	142 Å²	142	83%	0.825	78%	0.775	S	S	*	*			trans	73.7	140.3	-178.6	-66.1	-85.7	0	0	0	119
367	G	31.8	Very low	35.3	Very low	71 Å²	71	140.5 Å²	140.5	73%	0.732	76%	0.76	S	S	*	*			trans	-108	-134	175.6	0	0	0	0	0	111.6
368	P	48	Very low	35.7	Very low	123 Å²	123	135.6 Å²	135.6	80%	0.799	75%	0.751	S	S	*	*			cis	-141.1	-168.3	3.8	41.8	-22.3	0	0	0	115.5
369	S	36.6	Very low	36.4	Very low	103 Å²	103	140.6 Å²	140.6	72%	0.72	75%	0.752	S	S	*	*			trans	115.7	148.7	138.2	82.5	0	0	0	0	120.2
370	R	38.8	Very low	37.5	Very low	244 Å²	244	139.2 Å²	139.2	92%	0.921	75%	0.751	S	S	*	*			trans	62.7	119.7	166.1	-64.4	174.4	172.2	-94.2	0	117.9
371	G	35.3	Very low	37.7	Very low	64 Å²	64	138.9 Å²	138.9	66%	0.66	75%	0.749	S	S	*	*			cis	128	132.2	-18.9	0	0	0	0	0	116.3
372	T	38.2	Very low	38.2	Very low	155 Å²	155	142.1 Å²	142.1	95%	0.951	75%	0.752	S	S	*	*			trans	67.1	156.7	167.2	64	0	0	0	0	116.9
373	S	39	Very low	38.4	Very low	113 Å²	113	140.3 Å²	140.3	79%	0.79	75%	0.75	S	S	*	*			cis	-137.8	-179.6	14.5	58.1	0	0	0	0	114.6
374	K	40.2	Very low	38.4	Very low	189 Å²	189	143.9 Å²	143.9	82%	0.822	76%	0.756	S	S	*	*			trans	-129.9	-175.5	175.5	-81.5	-172.8	175.2	-178.3	0	109.3
375	E	39.5	Very low	38.5	Very low	153 Å²	153	143.7 Å²	143.7	72%	0.715	75%	0.754	S	S	*	*			trans	79.7	145.4	168.7	-59.4	-169.3	87.3	0	0	113.3	V377	E375-V377 HydrophobicContact CB-CG2 4.39Å; E375-V377 WeakPolarHBondContact OE1-CG2 3.35Å
376	H	40.2	Very low	38.3	Very low	165 Å²	165	144.7 Å²	144.7	76%	0.764	76%	0.759	S	S	*	*			cis	-135.7	138.7	45.2	-83.1	-67.6	0	0	0	113.6
377	V	41.8	Very low	38.2	Very low	90 Å²	90	146.4 Å²	146.4	55%	0.545	76%	0.76	S	S	.	*				94.2	135.7	58.7	139.5	0	0	0	0	111.4	E375	E375-V377 HydrophobicContact CB-CG2 4.39Å; E375-V377 WeakPolarHBondContact OE1-CG2 3.35Å
378	L	39.8	Very low	38	Very low	126 Å²	126	149 Å²	149	66%	0.66	76%	0.762	S	S	*	*			cis	-163.9	145.7	-7	-93.4	171.2	0	0	0	112.4
379	R	43.9	Very low	37.1	Very low	217 Å²	217	147 Å²	147	82%	0.819	76%	0.756	S	S	*	*			trans	60.5	179.7	134.2	-77.1	-179.1	-179.9	-153.9	3.5	121.8
380	P	52.9	Low	36.7	Very low	113 Å²	113	148.5 Å²	148.5	73%	0.734	77%	0.766	S	S	*	*			cis	-123.7	-166.8	-41.4	36.8	-19.2	0	0	0	110
381	S	38.6	Very low	36.2	Very low	90 Å²	90	140.4 Å²	140.4	63%	0.629	76%	0.759	S	S	*	*			cis	-162.3	137.7	21.2	47.2	0	0	0	0	113.5
382	Q	39.5	Very low	35.9	Very low	170 Å²	170	146.6 Å²	146.6	79%	0.794	77%	0.771	S	S	*	*				57.4	148.1	125.7	-51.8	176	7.5	0	0	119.6
383	L	34.5	Very low	35.5	Very low	147 Å²	147	146.3 Å²	146.3	77%	0.77	76%	0.764	S	S	*	*			cis	-140.1	160.9	22.1	-80.2	170.1	0	0	0	114.5
384	R	33.8	Very low	35.8	Very low	219 Å²	219	145.4 Å²	145.4	83%	0.826	76%	0.755	S	S	*	*			trans	-11	156.4	146.4	-72	-179	154.1	165.3	-6.1	119.1
385	L	31.6	Very low	35.2	Very low	126 Å²	126	147.9 Å²	147.9	66%	0.66	76%	0.759	S	S	*	*			cis	-164.9	153	9.9	-122.3	165.7	0	0	0	113.8
386	Q	30	Very low	34.7	Very low	173 Å²	173	144.8 Å²	144.8	81%	0.808	76%	0.755	S	S	*	*			trans	74.3	145.3	147.8	-105.8	169.7	46.3	0	0	124.2
387	R	28.8	Very low	34.2	Very low	223 Å²	223	143.2 Å²	143.2	84%	0.842	76%	0.757	S	S	*	*			trans	-42.5	159.7	164.5	-71.3	174.8	162.1	157.8	-8	114.4
388	T	28	Very low	33.6	Very low	126 Å²	126	143.1 Å²	143.1	77%	0.773	77%	0.765	S	S	*	*			cis	-177.9	167	-2.6	29.3	0	0	0	0	107.1
389	A	28.6	Very low	33.1	Very low	82 Å²	82	143.3 Å²	143.3	68%	0.678	77%	0.772	S	S	*	*			cis	177.9	-169.6	-24.3	0	0	0	0	0	107.8
390	S	27.3	Very low	32.6	Very low	133 Å²	133	140.4 Å²	140.4	93%	0.93	77%	0.772	S	S	*	*			trans	70.8	158	-177.1	80.3	0	0	0	0	115.7
391	G	29.1	Very low	31.4	Very low	75 Å²	75	137.9 Å²	137.9	77%	0.773	77%	0.767	S	S	*	*			trans	130.9	142.4	-179.7	0	0	0	0	0	113.2
392	Q	28.6	Very low	32	Very low	194 Å²	194	139.6 Å²	139.6	91%	0.907	78%	0.776	S	S	*	*			trans	-97.2	176.3	-169.9	-60.3	176.1	-89.2	0	0	114.1
393	D	30.6	Very low	31.6	Very low	149 Å²	149	136.4 Å²	136.4	80%	0.797	77%	0.772	S	S	*	*			trans	-43.3	168.7	155.4	-53.8	-80.3	0	0	0	113.7
394	P	44.4	Very low	31.5	Very low	93 Å²	93	134.5 Å²	134.5	60%	0.604	77%	0.771	S	S	*	*			cis	-152	-178.8	27.7	44.6	-24	0	0	0	119.5
395	W	27	Very low	31.2	Very low	241 Å²	241	133.4 Å²	133.4	91%	0.913	78%	0.776	S	S	*	*			trans	59.9	162.4	148.7	-74	-25.9	0	0	0	119.6
396	S	29.6	Very low	31	Very low	89 Å²	89	131.6 Å²	131.6	62%	0.622	78%	0.779	S	S	*	*			cis	-166.2	149.7	-21.4	-96.9	0	0	0	0	112.5
397	T	29.6	Very low	31	Very low	131 Å²	131	129.8 Å²	129.8	80%	0.804	78%	0.78	S	S	*	*			trans	48.3	123.8	142.9	-45.3	0	0	0	0	124.2
398	A	28.4	Very low	31.1	Very low	88 Å²	88	125.4 Å²	125.4	73%	0.727	78%	0.783	S	S	*	*			trans	155.1	136.1	140.5	0	0	0	0	0	110.5
399	V	29.3	Very low	31.6	Very low	131 Å²	131	124.2 Å²	124.2	79%	0.794	79%	0.786	S	S	*	*			cis	86.3	121.9	35.6	176.7	0	0	0	0	111.8
400	D	33.8	Very low	32.2	Very low	155 Å²	155	126.2 Å²	126.2	83%	0.829	79%	0.792	S	S	*	*			cis	-147.7	-153.4	8.3	-152	-102.3	0	0	0	114.8
401	G	28.7	Very low	32.4	Very low	60 Å²	60	123.1 Å²	123.1	62%	0.619	78%	0.781	S	S	*	*			trans	-92.9	-143.7	-175.7	0	0	0	0	0	116.6
402	P	50.8	Low	32.7	Very low	126 Å²	126	125.6 Å²	125.6	82%	0.818	79%	0.787	S	S	*	*			cis	-141.8	-175.2	14.7	44.2	-25.5	0	0	0	118.1
403	S	29.9	Very low	33.4	Very low	104 Å²	104	121.2 Å²	121.2	73%	0.727	78%	0.775	S	S	*	*			trans	93	103.2	146.6	-152.6	0	0	0	0	123.1
404	S	33.8	Very low	33.5	Very low	106 Å²	106	123.2 Å²	123.2	74%	0.741	78%	0.78	S	S	*	*				83.7	124.6	125.5	-57.3	0	0	0	0	125.2
405	Q	27.6	Very low	32.7	Very low	197 Å²	197	123.8 Å²	123.8	92%	0.921	79%	0.785	S	S	*	*			trans	83.3	151.2	149.1	-75.7	-167.5	-7.5	0	0	122.6
406	A	27.7	Very low	32.8	Very low	88 Å²	88	117.2 Å²	117.2	73%	0.727	78%	0.777	S	S	*	*			trans	88.6	106.4	171.6	0	0	0	0	0	120.1
407	T	28.7	Very low	32.7	Very low	135 Å²	135	117.1 Å²	117.1	83%	0.828	77%	0.772	S	S	*	*			trans	54.6	103.3	141.2	54.6	0	0	0	0	121.5
408	S	32.6	Very low	32.6	Very low	131 Å²	131	113.6 Å²	113.6	92%	0.916	75%	0.752	S	S	*	*			trans	-164.8	116.6	141.6	-83.2	0	0	0	0	111.8
409	A	37.5	Very low	32.7	Very low	100 Å²	100	117.1 Å²	117.1	83%	0.826	75%	0.752	S	S	*	*			trans	-169.6	160.7	174.8	0	0	0	0	0	108.5
410	P	40.3	Very low	32.6	Very low	125 Å²	125	121.8 Å²	121.8	81%	0.812	76%	0.756	S	S	*	*			cis	-107.1	169.6	6.4	40.4	-32.2	0	0	0	113.5
411	G	31.5	Very low	32.4	Very low	68 Å²	68	122.3 Å²	122.3	70%	0.701	76%	0.758	S	S	*	*			cis	110.2	80.9	5.5	0	0	0	0	0	112.1	P413	G411-P413 WeakPolarHBondContact O-CD 3.38Å
412	S	36.8	Very low	32.4	Very low	127 Å²	127	122.7 Å²	122.7	89%	0.888	76%	0.761	S	S	*	*			trans	-73.1	124.2	-179	-172.4	0	0	0	0	111.7
413	P	42.6	Very low	31.5	Very low	101 Å²	101	121.7 Å²	121.7	66%	0.656	76%	0.757	S	S	*	*			trans	-104	162.6	175.1	37.8	-29.7	0	0	0	112	G411	G411-P413 WeakPolarHBondContact O-CD 3.38Å
414	Q	33.8	Very low	31.5	Very low	192 Å²	192	123.4 Å²	123.4	90%	0.897	76%	0.757	S	S	*	*				171.1	83.9	115.7	-81.9	-122.5	-43	0	0	110.9
415	S	25.8	Very low	31.4	Very low	104 Å²	104	129.6 Å²	129.6	73%	0.727	77%	0.765	S	S	*	*			trans	-94.2	130.6	153.5	56.3	0	0	0	0	109.8
416	S	29.2	Very low	31.4	Very low	104 Å²	104	123.4 Å²	123.4	73%	0.727	75%	0.754	S	S	*	*			trans	70.1	157.6	147.8	73.7	0	0	0	0	121.4
417	V	27.7	Very low	31.2	Very low	87 Å²	87	125 Å²	125	53%	0.527	76%	0.758	S	S	.	*			trans	72.3	124.9	163.4	-163.9	0	0	0	0	118.3	Y1084	V417-Y1084 HydrophobicContact CG1-CE2 4.48Å; V417-Y1084 WeakPolarHBondContact CG1-OH 3.43Å; V417-Y1084 HydrophobicContact CG2-CE2 4.13Å; V417-Y1084 WeakPolarHBondContact CG2-OH 3.48Å
418	S	27.7	Very low	30.9	Very low	56 Å²	56	124.8 Å²	124.8	39%	0.392	76%	0.757	S	S	.	*			trans	-108.8	143.2	158.8	-172.7	0	0	0	0	109.1
419	K	30.7	Very low	30.6	Very low	163 Å²	163	127.7 Å²	127.7	71%	0.709	75%	0.753	S	S	*	*			trans	75.6	101.1	171.2	-56.1	160.8	-172.9	169.9	0	118.1
420	Y	27	Very low	29.9	Very low	228 Å²	228	130.4 Å²	130.4	89%	0.894	75%	0.753	S	S	*	*				-93.9	157.1	108.4	-86.9	-113.2	0	0	0	106.4
421	I	29.2	Very low	29.3	Very low	167 Å²	167	132.4 Å²	132.4	86%	0.856	75%	0.751	S	S	*	*			cis	-125.6	150.8	34.5	-65.5	159.7	0	0	0	110.4
422	G	30.4	Very low	29.2	Very low	67 Å²	67	134.5 Å²	134.5	69%	0.691	76%	0.755	S	S	*	*			trans	-109.1	134.3	170.4	0	0	0	0	0	112.9
423	S	30.3	Very low	28.6	Very low	106 Å²	106	139.2 Å²	139.2	74%	0.741	75%	0.754	S	S	*	*			trans	-172.5	143.7	137.2	-159.6	0	0	0	0	111.5
424	L	30	Very low	28.6	Very low	139 Å²	139	140.1 Å²	140.1	73%	0.728	76%	0.76	S	S	*	*			trans	40.1	105.8	160.6	-62.7	165.1	0	0	0	118.7
425	R	31.2	Very low	28.3	Very low	236 Å²	236	134.9 Å²	134.9	89%	0.891	75%	0.749	S	S	*	*				74.9	109.3	65.8	-173.6	-154.5	-65.6	-105.6	4.5	114
426	G	27.6	Very low	28.6	Very low	67 Å²	67	137.6 Å²	137.6	69%	0.691	75%	0.754	S	S	*	*			trans	140.7	99	153	0	0	0	0	0	117.8
427	C	24.5	Very low	29.2	Very low	121 Å²	121	138 Å²	138	82%	0.818	75%	0.754	S	S	*	*			trans	45.6	123	148.3	-59.6	0	0	0	0	123.1
428	T	22.4	Very low	29.8	Very low	132 Å²	132	139.3 Å²	139.3	81%	0.81	76%	0.764	S	S	*	*			trans	67.2	85.5	138.1	55.6	0	0	0	0	121.6
429	K	26.1	Very low	29.6	Very low	191 Å²	191	144.7 Å²	144.7	83%	0.83	78%	0.781	S	S	*	*				54.1	108.6	117.8	-168.3	-171.1	-176.4	-178.5	0	119.9
430	L	22.5	Very low	29.4	Very low	157 Å²	157	144.5 Å²	144.5	82%	0.822	78%	0.78	S	S	*	*				-168.7	178.2	116.7	-105.5	171.1	0	0	0	112.7
431	Q	28.5	Very low	29.3	Very low	168 Å²	168	138.6 Å²	138.6	79%	0.785	77%	0.772	S	S	*	*			trans	-108	164.2	-168.1	-63.8	168.3	-78.5	0	0	114.4
432	S	28.4	Very low	29	Very low	112 Å²	112	135 Å²	135	78%	0.783	76%	0.761	S	S	*	*			trans	63.4	130.9	143	63.9	0	0	0	0	122.3
433	R	24.3	Very low	28.8	Very low	226 Å²	226	140.1 Å²	140.1	85%	0.853	77%	0.768	S	S	*	*			trans	-172.9	163.3	154.6	-150.9	82.6	-166.1	-95.1	-1.7	108.7
434	P	42.6	Very low	28.6	Very low	120 Å²	120	143.6 Å²	143.6	78%	0.779	77%	0.772	S	S	*	*			cis	-105.3	177.7	-28.7	5.8	18.6	0	0	0	112.3
435	A	28.6	Very low	28.4	Very low	81 Å²	81	142.9 Å²	142.9	67%	0.669	77%	0.774	S	S	*	*			cis	-108.4	-105.3	12.2	0	0	0	0	0	114.4
436	I	31	Very low	28.7	Very low	162 Å²	162	137 Å²	137	83%	0.831	77%	0.766	S	S	*	*			cis	-149	142.1	-9.7	-169.7	168.6	0	0	0	109.6
437	P	42.8	Very low	28.6	Very low	113 Å²	113	138.9 Å²	138.9	73%	0.734	77%	0.769	S	S	*	*			trans	-127.4	167.2	-172.9	40.9	-26.6	0	0	0	115.6
438	P	39.8	Very low	28.8	Very low	114 Å²	114	140 Å²	140	74%	0.74	77%	0.771	S	S	*	*			cis	-127.8	-167.7	21.5	46.6	-31.3	0	0	0	113.7
439	F	24.6	Very low	29	Very low	168 Å²	168	144.5 Å²	144.5	74%	0.737	77%	0.773	S	S	*	*			cis	-147.7	-64.7	7	-149.9	-6.6	0	0	0	116.4
440	K	25.6	Very low	29	Very low	160 Å²	160	143.3 Å²	143.3	70%	0.696	77%	0.768	S	S	*	*			trans	-159.1	155.4	-151.9	-81.6	165.5	179.5	167.1	0	110.9
441	S	24.2	Very low	29.3	Very low	104 Å²	104	140.4 Å²	140.4	73%	0.727	76%	0.757	S	S	*	*			cis	172.8	155	-16.9	50.8	0	0	0	0	107.7
442	S	23.1	Very low	29.3	Very low	91 Å²	91	136.3 Å²	136.3	64%	0.636	75%	0.747	S	S	*	*			cis	-172.9	167.8	-12.3	44.6	0	0	0	0	109.3
443	E	27	Very low	29.2	Very low	175 Å²	175	135.1 Å²	135.1	82%	0.818	74%	0.735	S	S	*	*			trans	65.5	146.4	162.3	-67.8	163.3	170.6	0	0	118.8
444	E	26.3	Very low	29.4	Very low	178 Å²	178	128.9 Å²	128.9	83%	0.832	72%	0.722	S	S	*	*			cis	-150.5	-163.6	-17.3	-131.5	-173.4	179.5	0	0	112.2
445	T	24.8	Very low	28.6	Very low	125 Å²	125	128 Å²	128	77%	0.767	72%	0.719	S	S	*	*			trans	-131.1	-167	-158.5	66.2	0	0	0	0	113.6
446	P	37.4	Very low	28.8	Very low	111 Å²	111	131.7 Å²	131.7	72%	0.721	73%	0.726	S	S	*	*			cis	-146.3	160.2	3.4	41.7	-20.2	0	0	0	121.7
447	S	26.6	Very low	28.7	Very low	108 Å²	108	128.7 Å²	128.7	76%	0.755	72%	0.72	S	S	*	*			trans	53.4	132.4	134.5	-163.7	0	0	0	0	125.2
448	V	28.3	Very low	28.1	Very low	143 Å²	143	132.1 Å²	132.1	87%	0.867	72%	0.723	S	S	*	*				-176.5	162.4	117	146.5	0	0	0	0	112.6
449	R	27.5	Very low	27.8	Very low	228 Å²	228	134.3 Å²	134.3	86%	0.86	73%	0.728	S	S	*	*			trans	-94.1	151.1	-165.7	-47.6	165.1	178.4	160.2	-3.8	116.1
450	K	26.3	Very low	29.2	Very low	165 Å²	165	131.7 Å²	131.7	72%	0.717	73%	0.728	S	S	*	*				-173.8	-178.5	125.5	-101.2	171.9	-176.3	-175.4	0	112.9	L601	K450-L601 HydrophobicContact CD-CD1 4.25Å
451	V	28.1	Very low	30.5	Very low	96 Å²	96	128.9 Å²	128.9	58%	0.582	73%	0.726	S	S	*	*			trans	-144.8	161.7	-130.2	161.3	0	0	0	0	114.9	L604	V451-L604 HydrophobicContact CB-CD1 4.06Å; V451-L604 HydrophobicContact CB-CD2 4.33Å; V451-L604 HydrophobicContact CG1-CD1 3.77Å; V451-L604 WeakPolarHBondContact O-CD1 3.28Å; V451-L604 WeakPolarHBondContact O-CD2 3.4Å
452	S	28.3	Very low	30.7	Very low	83 Å²	83	130.5 Å²	130.5	58%	0.58	73%	0.731	S	S	*	*			trans	47.5	154.3	157.1	-61.8	0	0	0	0	127.1
453	T	26.1	Very low	30.9	Very low	86 Å²	86	129.8 Å²	129.8	53%	0.528	73%	0.731	S	S	.	*			trans	75	156.5	139.9	44.6	0	0	0	0	119.8	A607	T453-A607 HydrophobicContact CG2-CB 3.62Å; T453-A607 VanDerWaalsContact OG1-CB 3.27Å; T453-A607 WeakPolarHBondContact OG1-CB 3.29Å
454	T	28	Very low	31	Very low	95 Å²	95	129 Å²	129	58%	0.583	73%	0.732	S	S	*	*			cis	-152.1	-167.7	10.9	-14.1	0	0	0	0	113.7	A607	T454-A607 HydrophobicContact CG2-CB 4.18Å
455	S	27.1	Very low	31.1	Very low	103 Å²	103	124.9 Å²	124.9	72%	0.72	72%	0.724	S	S	*	*			trans	-111.2	163	-166.6	-41.1	0	0	0	0	117.4
456	L	31.4	Very low	31.4	Very low	157 Å²	157	128.1 Å²	128.1	82%	0.822	73%	0.727	S	S	*	*			trans	49.5	110.9	142.1	-74.5	164.4	0	0	0	124.4
457	S	30.3	Very low	30.9	Very low	100 Å²	100	130 Å²	130	70%	0.699	74%	0.737	S	S	*	*				87	148.6	119.9	81.7	0	0	0	0	125.7
458	K	29.6	Very low	30.9	Very low	184 Å²	184	130.1 Å²	130.1	80%	0.8	74%	0.737	S	S	*	*			trans	81.2	117.1	152.2	-75	178.4	176.5	176.8	0	124.1
459	L	32.3	Very low	30.9	Very low	161 Å²	161	130 Å²	130	84%	0.843	74%	0.737	S	S	*	*				42.3	168.5	117.5	-67.5	173.4	0	0	0	121.5
460	P	54.1	Low	30.9	Very low	113 Å²	113	122.2 Å²	122.2	73%	0.734	73%	0.728	S	S	*	*			cis	-131.3	-152.7	10.5	47	-28.2	0	0	0	112.6
461	P	53.3	Low	31	Very low	101 Å²	101	119.2 Å²	119.2	66%	0.656	73%	0.734	S	S	*	*			cis	-137.3	169.7	-6	41.8	-23.3	0	0	0	119.1
462	T	28	Very low	31	Very low	137 Å²	137	121.6 Å²	121.6	84%	0.84	74%	0.743	S	S	*	*			trans	60.8	137.2	153.9	46.4	0	0	0	0	120.7
463	A	28.5	Very low	31.1	Very low	76 Å²	76	122.9 Å²	122.9	63%	0.628	75%	0.748	S	S	*	*			cis	-162.5	160	-9	0	0	0	0	0	111.8
464	D	29.1	Very low	31.3	Very low	158 Å²	158	126.6 Å²	126.6	85%	0.845	76%	0.759	S	S	*	*			trans	53.3	142.6	149.2	-60.1	-18	0	0	0	122.3
465	S	28.8	Very low	31.3	Very low	93 Å²	93	126.7 Å²	126.7	65%	0.65	76%	0.759	S	S	*	*			cis	-165.9	167.2	-13.8	63.4	0	0	0	0	112
466	K	30	Very low	31.4	Very low	192 Å²	192	130.9 Å²	130.9	84%	0.835	76%	0.764	S	S	*	*			trans	54.1	120.1	157.5	-64.3	172.3	-178.6	175.2	0	120.7
467	T	27.7	Very low	31.2	Very low	152 Å²	152	129.4 Å²	129.4	93%	0.933	76%	0.757	S	S	*	*			trans	-154.3	144.9	136.6	30.1	0	0	0	0	111.1
468	S	26.2	Very low	31	Very low	109 Å²	109	132.7 Å²	132.7	76%	0.762	76%	0.761	S	S	*	*			trans	-161.6	162.3	162.3	70	0	0	0	0	110.4
469	T	28	Very low	31.1	Very low	140 Å²	140	129.8 Å²	129.8	86%	0.859	75%	0.754	S	S	*	*			trans	83.1	128.8	165.1	-44.4	0	0	0	0	118.2
470	G	27.6	Very low	31.7	Very low	65 Å²	65	127.8 Å²	127.8	67%	0.67	75%	0.751	S	S	*	*			trans	87.4	124.8	170.3	0	0	0	0	0	114.4
471	A	29	Very low	30.4	Very low	102 Å²	102	125 Å²	125	84%	0.843	73%	0.732	S	S	*	*			cis	64	134.7	18.3	0	0	0	0	0	114.2
472	D	28.4	Very low	29.4	Very low	146 Å²	146	126.9 Å²	126.9	78%	0.781	73%	0.73	S	S	*	*			cis	-158.7	171.9	11.5	-155.5	-7.7	0	0	0	112.6
473	V	30.6	Very low	29.4	Very low	111 Å²	111	124.3 Å²	124.3	67%	0.673	71%	0.708	S	S	*	*			trans	68.1	140.8	155.5	157.6	0	0	0	0	119.1
474	Q	28.8	Very low	29.4	Very low	163 Å²	163	128.8 Å²	128.8	76%	0.762	72%	0.72	S	S	*	*			cis	-175.5	167	-16.9	-170.6	-173.1	94.7	0	0	110.8
475	V	28.6	Very low	29.4	Very low	98 Å²	98	129.1 Å²	129.1	59%	0.594	72%	0.716	S	S	*	*			trans	107.1	103.1	149	-169.9	0	0	0	0	119.7
476	K	28.2	Very low	29.5	Very low	190 Å²	190	128.9 Å²	128.9	83%	0.826	72%	0.72	S	S	*	*			trans	64.5	157.6	148.1	-69.6	175.2	-177.7	173.4	0	120.3
477	L	28.1	Very low	29.9	Very low	127 Å²	127	126.1 Å²	126.1	67%	0.665	72%	0.719	S	S	*	*			cis	-171.7	161	-27.5	-172.6	58.8	0	0	0	109.2
478	H	26.8	Very low	31.2	Very low	169 Å²	169	124.6 Å²	124.6	78%	0.782	71%	0.712	S	S	*	*			trans	84.8	112.2	166.8	-63.2	119.9	0	0	0	119.5
479	N	31.3	Very low	31.8	Very low	123 Å²	123	126.3 Å²	126.3	66%	0.658	71%	0.713	S	S	*	*			trans	-77.5	168.9	148	-151.9	7.3	0	0	0	108.7
480	P	44.4	Very low	32.2	Very low	119 Å²	119	126 Å²	126	77%	0.773	71%	0.705	S	S	*	*				-146	173.4	80.9	37.8	-19	0	0	0	117.3
481	T	27.9	Very low	32.5	Very low	54 Å²	54	129.5 Å²	129.5	33%	0.331	71%	0.707	S	S	.	*			trans	-67.1	153.4	-173.4	37.7	0	0	0	0	117.2	D892	T481-D892 PolarHBondContact OG1-OD2 3.26Å
482	F	32.4	Very low	32.9	Very low	140 Å²	140	134.1 Å²	134.1	61%	0.614	71%	0.709	S	S	*	*				-179.4	109	124.8	-95.6	-70.2	0	0	0	107.8	D892	F482-D892 HydrophobicContact CE1-CB 3.79Å; F482-D892 HydrophobicContact CZ-CB 3.78Å
483	H	27	Very low	33	Very low	83 Å²	83	130.8 Å²	130.8	38%	0.384	71%	0.709	S	S	.	*				65.3	118.8	79.9	-135.4	-98.7	0	0	0	115.7	N889 E893	H483-N889 PolarHBondContact CD2-ND2 3.02Å; H483-N889 PolarHBondContact NE2-ND2 2.73Å; H483-E893 IonicContact CE1-OE1 3.08Å; H483-E893 PolarHBondContact CE1-OE1 3.45Å; H483-E893 VanDerWaalsContact CE1-OE1 3.27Å
484	I	28	Very low	33.1	Very low	171 Å²	171	134.3 Å²	134.3	88%	0.877	72%	0.718	S	S	*	*			trans	-173.2	156.9	143.8	-101.4	158.3	0	0	0	110.4
485	Q	28.8	Very low	33.2	Very low	164 Å²	164	133.9 Å²	133.9	77%	0.766	72%	0.716	S	S	*	*			trans	-133.5	162.6	-166.9	-174.1	-171.3	-10.6	0	0	110.8
486	A	30.9	Very low	33.5	Very low	88 Å²	88	134.9 Å²	134.9	73%	0.727	71%	0.714	S	S	*	*			trans	78.5	128	157.5	0	0	0	0	0	120.4
487	T	39.6	Very low	34	Very low	135 Å²	135	134.2 Å²	134.2	83%	0.828	72%	0.719	S	S	*	*			trans	-67.8	150.4	140.9	27.7	0	0	0	0	109.7
488	P	54.5	Low	34.8	Very low	119 Å²	119	131.2 Å²	131.2	77%	0.773	71%	0.708	S	S	*	*				-154.3	164.1	65.3	41.6	-21.4	0	0	0	119.3
489	D	39.2	Very low	35.7	Very low	146 Å²	146	128.7 Å²	128.7	78%	0.781	70%	0.697	S	S	*	*			trans	43.5	158.4	137.8	-147.8	11	0	0	0	124.5
490	L	36.2	Very low	36.4	Very low	134 Å²	134	131 Å²	131	70%	0.702	70%	0.704	S	S	*	*			trans	83.5	118.7	161.8	-64.5	168.8	0	0	0	121.9
491	L	33.7	Very low	36.9	Very low	137 Å²	137	129.2 Å²	129.2	72%	0.717	69%	0.691	S	S	*	*			trans	71.7	99.4	137.4	-68.8	167.5	0	0	0	122.4
492	K	36.6	Very low	38.3	Very low	199 Å²	199	132.4 Å²	132.4	87%	0.865	70%	0.702	S	S	*	*				58.7	100.4	106.3	-174	-169.5	-179.6	-176.6	0	118.6
493	G	31.7	Very low	40.1	Very low	76 Å²	76	128.3 Å²	128.3	78%	0.784	68%	0.684	S	S	*	*			trans	-176.6	157.9	163.9	0	0	0	0	0	115.6
494	Q	31.5	Very low	42.1	Very low	185 Å²	185	130.9 Å²	130.9	86%	0.864	70%	0.697	S	S	*	*			trans	-29.2	129.6	178.9	-71.1	152.5	-67.5	0	0	116.3
495	Q	31.1	Very low	44.3	Very low	154 Å²	154	126.5 Å²	126.5	72%	0.72	68%	0.678	S	S	*	*				77.2	97.5	66.7	-170.2	168.3	20.5	0	0	114.8
496	E	35.1	Very low	46.3	Very low	119 Å²	119	120.6 Å²	120.6	56%	0.556	66%	0.657	S	S	*	*			trans	43.4	103.2	141.8	-58	178.6	116.2	0	0	120.2	Q499	E496-Q499 PolarHBondContact OE1-NE2 2.9Å
497	L	40.1	Very low	48.6	Very low	177 Å²	177	118.5 Å²	118.5	93%	0.927	63%	0.632	S	S	*	*	S	Bend	trans	-160.1	50	143.5	-116.3	172.4	0	0	0	115.2
498	S	43.1	Very low	50.3	Low	64 Å²	64	118.3 Å²	118.3	45%	0.448	62%	0.621	S	S	.	*			trans	-168.1	44.2	170.1	54.3	0	0	0	0	115.2	Q500 H502	S498-Q500 PolarHBondContact O-N 2.74Å; S498-H502 PolarHBondContact O-CD2 3.2Å; S498-H502 VanDerWaalsContact O-CD2 3.28Å; S498-H502 PolarHBondContact OG-NE2 3.32Å
499	Q	46.3	Very low	51.4	Low	115 Å²	115	116.9 Å²	116.9	54%	0.537	61%	0.606	S	S	.	*	H	α-helix	trans	-63.7	-10.7	-175.6	-83.8	-177.4	75.4	0	0	115.4	E496 K540	E496-Q499 PolarHBondContact OE1-NE2 2.9Å; Q499-K540 VanDerWaalsContact OE1-NZ 3.07Å
500	Q	46.8	Very low	53.2	Low	173 Å²	173	112.6 Å²	112.6	81%	0.808	58%	0.583	S	S	*	*	H	α-helix	trans	-86.6	-35.7	-173.1	-160.2	164.1	0.5	0	0	114.8	S498	S498-Q500 PolarHBondContact O-N 2.74Å
501	T	54.9	Low	55.4	Low	81 Å²	81	107.9 Å²	107.9	50%	0.497	56%	0.557	S	S	.	*	H	α-helix	trans	-81.6	-28.8	179.9	39	0	0	0	0	113.6	E503 T505	T501-E503 VanDerWaalsContact C-N 3.31Å; T501-T505 PolarHBondContact O-N 3.21Å; T501-T505 PolarHBondContact O-OG1 2.99Å
502	H	57.4	Low	57.6	Low	121 Å²	121	104.1 Å²	104.1	56%	0.56	54%	0.542	S	S	*	.	H	α-helix	trans	-71.4	-26.1	176.6	-64.4	-61	0	0	0	112.7	S498 A506	S498-H502 PolarHBondContact O-CD2 3.2Å; S498-H502 VanDerWaalsContact O-CD2 3.28Å; S498-H502 PolarHBondContact OG-NE2 3.32Å; H502-A506 VanDerWaalsContact O-CB 3.24Å; H502-A506 WeakPolarHBondContact O-CB 2.67Å; H502-A506 PolarHBondContact O-N 2.79Å
503	E	69	Low	59.7	Low	53 Å²	53	102.3 Å²	102.3	25%	0.248	53%	0.531	C	S	.	.	H	α-helix	trans	-66.4	-48.2	174.9	173.1	160.6	161.8	0	0	111.8	T501 T505 A506 K507 F533	T501-E503 VanDerWaalsContact C-N 3.31Å; E503-T505 PolarHBondContact O-N 3.01Å; E503-A506 PolarHBondContact O-N 3.15Å; E503-K507 HydrophobicContact CG-CD 4.15Å; E503-K507 WeakPolarHBondContact O-CB 3Å; E503-K507 WeakPolarHBondContact O-CG 2.75Å; E503-K507 PolarHBondContact O-N 3.21Å; E503-K507 WeakPolarHBondContact OE1-CE 2.81Å; E503-K507 IonicContact OE1-NZ 3.78Å; E503-K507 PolarHBondContact OE1-NZ 3Å; E503-F533 HydrophobicContact CB-CE1 4.05Å; E503-F533 HydrophobicContact CB-CZ 3.97Å; E503-F533 HydrophobicContact CG-CD1 3.92Å; E503-F533 HydrophobicContact CG-CE1 3.42Å; E503-F533 VanDerWaalsContact CG-CE1 3.42Å; E503-F533 HydrophobicContact CG-CE2 4.28Å; E503-F533 HydrophobicContact CG-CZ 3.63Å; E503-F533 VanDerWaalsContact OE2-CE1 3.27Å; E503-F533 WeakPolarHBondContact OE2-CE1 3.41Å
504	E	70	Confident	61.9	Low	138 Å²	138	101.8 Å²	101.8	65%	0.645	51%	0.51	S	S	*	.	H	α-helix	trans	-62.2	-43.5	175.5	-67.6	-174.1	132.4	0	0	111.5	A506 K507 Q508	E504-A506 VanDerWaalsContact C-N 3.34Å; E504-A506 PolarHBondContact O-N 3.26Å; E504-K507 PolarHBondContact O-N 2.83Å; E504-Q508 WeakPolarHBondContact O-CB 3.46Å; E504-Q508 PolarHBondContact O-N 2.71Å
505	T	73.7	Confident	64.1	Low	78 Å²	78	96.5 Å²	96.5	48%	0.479	48%	0.484	S	S	.	.	H	α-helix	trans	-59.9	-43.2	176.8	-51.3	0	0	0	0	111.8	T501 E503 Q508 I509	T501-T505 PolarHBondContact O-N 3.21Å; T501-T505 PolarHBondContact O-OG1 2.99Å; E503-T505 PolarHBondContact O-N 3.01Å; T505-Q508 WeakPolarHBondContact O-CB 3.42Å; T505-Q508 PolarHBondContact O-N 2.94Å; T505-I509 HydrophobicContact CG2-CD1 4.23Å; T505-I509 WeakPolarHBondContact O-CG1 3.21Å; T505-I509 PolarHBondContact O-N 3.29Å; T505-I509 VanDerWaalsContact O-N 3.08Å
506	A	70.9	Confident	66.2	Low	41 Å²	41	96.6 Å²	96.6	34%	0.339	49%	0.485	S	S	.	.	H	α-helix	trans	-68.6	-37.9	177.3	0	0	0	0	0	112.5	H502 E503 E504 I509 L510 F533	H502-A506 VanDerWaalsContact O-CB 3.24Å; H502-A506 WeakPolarHBondContact O-CB 2.67Å; H502-A506 PolarHBondContact O-N 2.79Å; E503-A506 PolarHBondContact O-N 3.15Å; E504-A506 VanDerWaalsContact C-N 3.34Å; E504-A506 PolarHBondContact O-N 3.26Å; A506-I509 PolarHBondContact O-N 3.4Å; A506-L510 WeakPolarHBondContact O-CB 3.29Å; A506-L510 PolarHBondContact O-N 3.18Å; A506-F533 HydrophobicContact CB-CE2 3.96Å
507	K	79.6	Confident	67.5	Low	43 Å²	43	94.2 Å²	94.2	19%	0.187	49%	0.492	C	S	.	.	H	α-helix	trans	-63.7	-40.3	172.5	-73.7	176.2	-176	177.5	0	111.5	E503 E504 L510 F511 V529 N530 F533	E503-K507 HydrophobicContact CG-CD 4.15Å; E503-K507 WeakPolarHBondContact O-CB 3Å; E503-K507 WeakPolarHBondContact O-CG 2.75Å; E503-K507 PolarHBondContact O-N 3.21Å; E503-K507 WeakPolarHBondContact OE1-CE 2.81Å; E503-K507 IonicContact OE1-NZ 3.78Å; E503-K507 PolarHBondContact OE1-NZ 3Å; E504-K507 PolarHBondContact O-N 2.83Å; K507-L510 PolarHBondContact O-N 3.06Å; K507-F511 WeakPolarHBondContact O-CB 3.04Å; K507-F511 PolarHBondContact O-N 3.46Å; K507-V529 HydrophobicContact CB-CG1 3.69Å; K507-V529 HydrophobicContact CG-CG1 3.82Å; K507-N530 WeakPolarHBondContact CE-OD1 3.45Å; K507-N530 PolarHBondContact NZ-OD1 3.32Å; K507-N530 VanDerWaalsContact NZ-OD1 3.11Å; K507-F533 HydrophobicContact CG-CD2 3.96Å; K507-F533 HydrophobicContact CG-CE2 4.39Å; K507-F533 HydrophobicContact CG-CG 4.42Å
508	Q	74.2	Confident	68.6	Low	131 Å²	131	87.7 Å²	87.7	61%	0.612	46%	0.461	S	S	*	.	H	α-helix	trans	-60.8	-47.3	176	-155.3	76.8	20.8	0	0	111.4	E504 T505 F511 S512	E504-Q508 WeakPolarHBondContact O-CB 3.46Å; E504-Q508 PolarHBondContact O-N 2.71Å; T505-Q508 WeakPolarHBondContact O-CB 3.42Å; T505-Q508 PolarHBondContact O-N 2.94Å; Q508-F511 WeakPolarHBondContact O-CB 3.46Å; Q508-F511 PolarHBondContact O-N 3.23Å; Q508-S512 PolarHBondContact O-N 3.36Å; Q508-S512 PolarHBondContact O-OG 3.44Å
509	I	78.8	Confident	69.9	Low	89 Å²	89	92.9 Å²	92.9	46%	0.456	48%	0.484	S	S	.	.	H	α-helix	trans	-64.8	-42.2	178	-67.6	165.2	0	0	0	111.2	T505 A506 F511 S512 Y513	T505-I509 HydrophobicContact CG2-CD1 4.23Å; T505-I509 WeakPolarHBondContact O-CG1 3.21Å; T505-I509 PolarHBondContact O-N 3.29Å; T505-I509 VanDerWaalsContact O-N 3.08Å; A506-I509 PolarHBondContact O-N 3.4Å; I509-F511 VanDerWaalsContact C-N 3.32Å; I509-F511 PolarHBondContact O-N 3.03Å; I509-S512 WeakPolarHBondContact O-CB 3.47Å; I509-S512 PolarHBondContact O-N 3.47Å; I509-Y513 HydrophobicContact CG2-CD2 3.84Å; I509-Y513 HydrophobicContact CG2-CE2 3.53Å; I509-Y513 WeakPolarHBondContact O-CD2 3.34Å; I509-Y513 PolarHBondContact O-N 3.36Å; I509-Y513 VanDerWaalsContact O-N 3.13Å
510	L	77.4	Confident	71.3	Confident	56 Å²	56	89.6 Å²	89.6	29%	0.293	47%	0.47	S	S	.	.	H	α-helix	trans	-67.6	-32.9	177.4	-161.5	73.6	0	0	0	112.1	A506 K507 L514 V529 V532	A506-L510 WeakPolarHBondContact O-CB 3.29Å; A506-L510 PolarHBondContact O-N 3.18Å; K507-L510 PolarHBondContact O-N 3.06Å; L510-L514 HydrophobicContact CG-CD1 4.12Å; L510-L514 VanDerWaalsContact O-CB 3.32Å; L510-L514 WeakPolarHBondContact O-CB 3.39Å; L510-L514 VanDerWaalsContact O-CG 3.29Å; L510-L514 WeakPolarHBondContact O-CG 3.37Å; L510-L514 PolarHBondContact O-N 3.42Å; L510-V529 HydrophobicContact CB-CG1 4.49Å; L510-V529 HydrophobicContact CB-CG2 4.48Å; L510-V529 HydrophobicContact CD2-CG1 4.43Å; L510-V532 HydrophobicContact CD2-CB 4.01Å; L510-V532 HydrophobicContact CD2-CG1 3.86Å
511	F	82.3	Confident	72.9	Confident	35 Å²	35	87.4 Å²	87.4	15%	0.154	46%	0.464	C	S	.	.	H	α-helix	trans	-63.3	-47.5	171.6	-177.9	-88.6	0	0	0	111.1	K507 Q508 I509 Y513 L514 K515 D522 T525 N526 V529	K507-F511 WeakPolarHBondContact O-CB 3.04Å; K507-F511 PolarHBondContact O-N 3.46Å; Q508-F511 WeakPolarHBondContact O-CB 3.46Å; Q508-F511 PolarHBondContact O-N 3.23Å; I509-F511 VanDerWaalsContact C-N 3.32Å; I509-F511 PolarHBondContact O-N 3.03Å; F511-Y513 PolarHBondContact O-N 2.74Å; F511-L514 PolarHBondContact O-N 3.16Å; F511-K515 HydrophobicContact CE1-CB 4.48Å; F511-K515 VanDerWaalsContact O-CB 3.3Å; F511-K515 WeakPolarHBondContact O-CB 3.41Å; F511-K515 PolarHBondContact O-N 3.31Å; F511-D522 HydrophobicContact CE2-CB 4.49Å; F511-D522 HydrophobicContact CZ-CB 4Å; F511-T525 HydrophobicContact CD2-CG2 3.64Å; F511-T525 HydrophobicContact CE2-CG2 3.68Å; F511-T525 HydrophobicContact CG-CG2 4.3Å; F511-T525 HydrophobicContact CZ-CG2 4.37Å; F511-N526 WeakPolarHBondContact CD2-OD1 3.39Å; F511-N526 HydrophobicContact CE2-CB 4.32Å; F511-N526 VanDerWaalsContact CE2-CG 3.47Å; F511-N526 VanDerWaalsContact CE2-ND2 3.27Å; F511-N526 WeakPolarHBondContact CE2-ND2 3.39Å; F511-V529 HydrophobicContact CB-CG2 3.92Å; F511-V529 HydrophobicContact CD2-CG2 4.31Å
512	S	79.5	Confident	74.2	Confident	59 Å²	59	87.5 Å²	87.5	41%	0.413	46%	0.462	S	S	.	.	H	α-helix	trans	-54.7	-54.6	176.2	-58.8	0	0	0	0	111.6	Q508 I509 L514 K515 E516	Q508-S512 PolarHBondContact O-N 3.36Å; Q508-S512 PolarHBondContact O-OG 3.44Å; I509-S512 WeakPolarHBondContact O-CB 3.47Å; I509-S512 PolarHBondContact O-N 3.47Å; S512-L514 VanDerWaalsContact C-N 3.35Å; S512-L514 PolarHBondContact O-N 2.99Å; S512-K515 PolarHBondContact O-N 3.07Å; S512-E516 WeakPolarHBondContact O-CG 3.47Å; S512-E516 PolarHBondContact O-N 3.49Å
513	Y	80.9	Confident	75.3	Confident	160 Å²	160	87.3 Å²	87.3	63%	0.627	47%	0.465	S	S	*	.	H	α-helix	trans	-64.7	-34.8	-179.1	-70.5	-50.2	0	0	0	113.7	I509 F511 K515 G517	I509-Y513 HydrophobicContact CG2-CD2 3.84Å; I509-Y513 HydrophobicContact CG2-CE2 3.53Å; I509-Y513 WeakPolarHBondContact O-CD2 3.34Å; I509-Y513 PolarHBondContact O-N 3.36Å; I509-Y513 VanDerWaalsContact O-N 3.13Å; F511-Y513 PolarHBondContact O-N 2.74Å; Y513-K515 VanDerWaalsContact C-N 3.3Å; Y513-G517 PolarHBondContact O-N 3.44Å
514	L	78	Confident	76	Confident	65 Å²	65	87.7 Å²	87.7	34%	0.34	47%	0.47	S	S	.	.	H	α-helix	trans	-73.4	-21.8	174.7	-73.7	170.9	0	0	0	112.9	L510 F511 S512 S518 T525 V529	L510-L514 HydrophobicContact CG-CD1 4.12Å; L510-L514 VanDerWaalsContact O-CB 3.32Å; L510-L514 WeakPolarHBondContact O-CB 3.39Å; L510-L514 VanDerWaalsContact O-CG 3.29Å; L510-L514 WeakPolarHBondContact O-CG 3.37Å; L510-L514 PolarHBondContact O-N 3.42Å; F511-L514 PolarHBondContact O-N 3.16Å; S512-L514 VanDerWaalsContact C-N 3.35Å; S512-L514 PolarHBondContact O-N 2.99Å; L514-S518 WeakPolarHBondContact O-CB 3.37Å; L514-S518 PolarHBondContact O-N 2.72Å; L514-T525 HydrophobicContact CB-CG2 3.83Å; L514-V529 HydrophobicContact CD1-CG2 3.77Å
515	K	78.2	Confident	76.7	Confident	74 Å²	74	81.1 Å²	81.1	32%	0.322	44%	0.44	S	S	.	.	H	α-helix	trans	-86.4	-38.8	175.9	-171.3	70.7	-167.8	-165	0	112.6	F511 S512 Y513 G517 S518 D520 D522	F511-K515 HydrophobicContact CE1-CB 4.48Å; F511-K515 VanDerWaalsContact O-CB 3.3Å; F511-K515 WeakPolarHBondContact O-CB 3.41Å; F511-K515 PolarHBondContact O-N 3.31Å; S512-K515 PolarHBondContact O-N 3.07Å; Y513-K515 VanDerWaalsContact C-N 3.3Å; K515-G517 PolarHBondContact O-N 3.26Å; K515-S518 PolarHBondContact O-N 2.91Å; K515-D520 PolarHBondContact NZ-O 2.97Å; K515-D522 WeakPolarHBondContact CE-OD1 3.28Å; K515-D522 IonicContact NZ-OD1 2.98Å; K515-D522 PolarHBondContact NZ-OD1 3.32Å
516	E	73.6	Confident	77.1	Confident	156 Å²	156	80.8 Å²	80.8	73%	0.729	44%	0.435	S	S	*	.	H	α-helix	trans	-60.7	-27	173.4	-73	-178.7	134.7	0	0	112.5	S512	S512-E516 WeakPolarHBondContact O-CG 3.47Å; S512-E516 PolarHBondContact O-N 3.49Å
517	G	62.1	Low	77.7	Confident	70 Å²	70	86 Å²	86	72%	0.722	45%	0.45	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.1	0.9	177.5	0	0	0	0	0	116.5	Y513 K515	Y513-G517 PolarHBondContact O-N 3.44Å; K515-G517 PolarHBondContact O-N 3.26Å
518	S	63.5	Low	77.9	Confident	39 Å²	39	88.1 Å²	88.1	27%	0.273	46%	0.46	S	S	.	.			trans	-151.4	136	-175.7	-168.6	0	0	0	0	115.2	L514 K515 D520	L514-S518 WeakPolarHBondContact O-CB 3.37Å; L514-S518 PolarHBondContact O-N 2.72Å; K515-S518 PolarHBondContact O-N 2.91Å; S518-D520 WeakPolarHBondContact CB-OD2 3.3Å; S518-D520 PolarHBondContact O-N 2.68Å; S518-D520 VanDerWaalsContact OG-CG 3.26Å; S518-D520 PolarHBondContact OG-N 2.66Å; S518-D520 PolarHBondContact OG-OD2 2.94Å
519	N	70.8	Confident	78.5	Confident	173 Å²	173	82 Å²	82	93%	0.925	43%	0.431	S	S	*	.			trans	-77.9	13.1	173.1	-68.9	-16.5	0	0	0	113.9
520	D	75.4	Confident	78.7	Confident	46 Å²	46	81.3 Å²	81.3	25%	0.246	43%	0.428	C	S	.	.			trans	-57.9	143.7	173.3	-72.3	-72.2	0	0	0	111.8	K515 S518 V524 K528	K515-D520 PolarHBondContact NZ-O 2.97Å; S518-D520 WeakPolarHBondContact CB-OD2 3.3Å; S518-D520 PolarHBondContact O-N 2.68Å; S518-D520 VanDerWaalsContact OG-CG 3.26Å; S518-D520 PolarHBondContact OG-N 2.66Å; S518-D520 PolarHBondContact OG-OD2 2.94Å; D520-V524 HydrophobicContact CB-CB 4.31Å; D520-V524 HydrophobicContact CB-CG1 4.32Å; D520-K528 IonicContact OD1-NZ 2.9Å; D520-K528 PolarHBondContact OD1-NZ 3.12Å; D520-K528 IonicContact OD2-NZ 2.85Å; D520-K528 PolarHBondContact OD2-NZ 3.46Å
521	N	81.4	Confident	79.1	Confident	127 Å²	127	84 Å²	84	68%	0.679	44%	0.442	S	S	*	.			trans	-63.3	148.8	168.8	-91.8	-0.8	0	0	0	111.5	D523 V524 T525	N521-D523 VanDerWaalsContact C-N 3.29Å; N521-D523 PolarHBondContact O-N 3.36Å; N521-D523 VanDerWaalsContact O-N 3.16Å; N521-V524 WeakPolarHBondContact O-CA 3.43Å; N521-V524 VanDerWaalsContact O-CB 3.31Å; N521-V524 WeakPolarHBondContact O-CB 3.17Å; N521-V524 PolarHBondContact O-N 3.02Å; N521-T525 PolarHBondContact O-N 3.13Å
522	D	82.4	Confident	79.1	Confident	84 Å²	84	85.2 Å²	85.2	45%	0.449	45%	0.452	S	S	.	.	H	α-helix	trans	-61.2	-33.1	-167.9	-60.5	-22.1	0	0	0	113.9	F511 K515 V524 T525 N526	F511-D522 HydrophobicContact CE2-CB 4.49Å; F511-D522 HydrophobicContact CZ-CB 4Å; K515-D522 WeakPolarHBondContact CE-OD1 3.28Å; K515-D522 IonicContact NZ-OD1 2.98Å; K515-D522 PolarHBondContact NZ-OD1 3.32Å; D522-V524 PolarHBondContact O-N 3.03Å; D522-T525 PolarHBondContact O-N 2.87Å; D522-N526 WeakPolarHBondContact O-CB 3.17Å; D522-N526 PolarHBondContact O-N 3.05Å; D522-N526 PolarHBondContact O-ND2 2.94Å
523	D	80.3	Confident	79	Confident	116 Å²	116	84.4 Å²	84.4	62%	0.62	44%	0.441	S	S	*	.	H	α-helix	trans	-61	-31.9	172.3	-72.7	-40.2	0	0	0	113.4	N521 K527	N521-D523 VanDerWaalsContact C-N 3.29Å; N521-D523 PolarHBondContact O-N 3.36Å; N521-D523 VanDerWaalsContact O-N 3.16Å; D523-K527 VanDerWaalsContact O-CD 3.24Å; D523-K527 WeakPolarHBondContact O-CD 3.43Å; D523-K527 WeakPolarHBondContact O-CG 3.4Å; D523-K527 PolarHBondContact O-N 2.94Å
524	V	83.1	Confident	79	Confident	61 Å²	61	82.5 Å²	82.5	37%	0.37	44%	0.438	S	S	.	.	H	α-helix	trans	-78.3	-43.2	179.2	-179.6	0	0	0	0	109.5	D520 N521 D522 K527 K528	D520-V524 HydrophobicContact CB-CB 4.31Å; D520-V524 HydrophobicContact CB-CG1 4.32Å; N521-V524 WeakPolarHBondContact O-CA 3.43Å; N521-V524 VanDerWaalsContact O-CB 3.31Å; N521-V524 WeakPolarHBondContact O-CB 3.17Å; N521-V524 PolarHBondContact O-N 3.02Å; D522-V524 PolarHBondContact O-N 3.03Å; V524-K527 PolarHBondContact O-N 2.66Å; V524-K528 HydrophobicContact CG1-CD 4.44Å; V524-K528 WeakPolarHBondContact O-CG 3.47Å; V524-K528 PolarHBondContact O-N 3.46Å
525	T	84.1	Confident	79.1	Confident	0 Å²	0	86.4 Å²	86.4	0%	0	45%	0.452	C	S	.	.	H	α-helix	trans	-63.2	-43	176.1	-52.1	0	0	0	0	111.4	F511 L514 N521 D522 K527 K528 V529	F511-T525 HydrophobicContact CD2-CG2 3.64Å; F511-T525 HydrophobicContact CE2-CG2 3.68Å; F511-T525 HydrophobicContact CG-CG2 4.3Å; F511-T525 HydrophobicContact CZ-CG2 4.37Å; L514-T525 HydrophobicContact CB-CG2 3.83Å; N521-T525 PolarHBondContact O-N 3.13Å; D522-T525 PolarHBondContact O-N 2.87Å; T525-K527 VanDerWaalsContact C-N 3.33Å; T525-K527 PolarHBondContact O-N 2.94Å; T525-K528 PolarHBondContact O-N 3.14Å; T525-K528 VanDerWaalsContact O-N 3.17Å; T525-V529 WeakPolarHBondContact O-CG2 3.49Å; T525-V529 PolarHBondContact O-N 3.15Å
526	N	82.7	Confident	78.9	Confident	72 Å²	72	87.6 Å²	87.6	39%	0.385	46%	0.461	S	S	.	.	H	α-helix	trans	-61.1	-37.1	174.2	-85.4	-55.9	0	0	0	113.3	F511 D522 N530	F511-N526 WeakPolarHBondContact CD2-OD1 3.39Å; F511-N526 HydrophobicContact CE2-CB 4.32Å; F511-N526 VanDerWaalsContact CE2-CG 3.47Å; F511-N526 VanDerWaalsContact CE2-ND2 3.27Å; F511-N526 WeakPolarHBondContact CE2-ND2 3.39Å; D522-N526 WeakPolarHBondContact O-CB 3.17Å; D522-N526 PolarHBondContact O-N 3.05Å; D522-N526 PolarHBondContact O-ND2 2.94Å; N526-N530 PolarHBondContact O-N 3.22Å; N526-N530 PolarHBondContact O-ND2 3.15Å
527	K	84.1	Confident	78.7	Confident	149 Å²	149	84.9 Å²	84.9	65%	0.648	45%	0.449	S	S	*	.	H	α-helix	trans	-68.4	-39.5	174.2	-73.7	164.6	-170.6	162.9	0	111.9	D523 V524 T525 L531	D523-K527 VanDerWaalsContact O-CD 3.24Å; D523-K527 WeakPolarHBondContact O-CD 3.43Å; D523-K527 WeakPolarHBondContact O-CG 3.4Å; D523-K527 PolarHBondContact O-N 2.94Å; V524-K527 PolarHBondContact O-N 2.66Å; T525-K527 VanDerWaalsContact C-N 3.33Å; T525-K527 PolarHBondContact O-N 2.94Å; K527-L531 WeakPolarHBondContact O-CB 3.16Å; K527-L531 PolarHBondContact O-N 3.33Å
528	K	83.5	Confident	78.9	Confident	89 Å²	89	85.7 Å²	85.7	39%	0.387	44%	0.44	S	S	.	.	H	α-helix	trans	-62.6	-45.3	174.6	-70.8	173.9	-176.6	177	0	111.7	D520 V524 T525 L531 V532	D520-K528 IonicContact OD1-NZ 2.9Å; D520-K528 PolarHBondContact OD1-NZ 3.12Å; D520-K528 IonicContact OD2-NZ 2.85Å; D520-K528 PolarHBondContact OD2-NZ 3.46Å; V524-K528 HydrophobicContact CG1-CD 4.44Å; V524-K528 WeakPolarHBondContact O-CG 3.47Å; V524-K528 PolarHBondContact O-N 3.46Å; T525-K528 PolarHBondContact O-N 3.14Å; T525-K528 VanDerWaalsContact O-N 3.17Å; K528-L531 PolarHBondContact O-N 2.99Å; K528-V532 WeakPolarHBondContact O-CG2 3.35Å; K528-V532 PolarHBondContact O-N 3.42Å
529	V	86.9	Confident	78.7	Confident	1 Å²	1	90 Å²	90	1%	0.006	46%	0.459	C	S	.	.	H	α-helix	trans	-57.6	-50.6	178.2	166.9	0	0	0	0	112.1	K507 L510 F511 L514 T525 L531 V532 F533	K507-V529 HydrophobicContact CB-CG1 3.69Å; K507-V529 HydrophobicContact CG-CG1 3.82Å; L510-V529 HydrophobicContact CB-CG1 4.49Å; L510-V529 HydrophobicContact CB-CG2 4.48Å; L510-V529 HydrophobicContact CD2-CG1 4.43Å; F511-V529 HydrophobicContact CB-CG2 3.92Å; F511-V529 HydrophobicContact CD2-CG2 4.31Å; L514-V529 HydrophobicContact CD1-CG2 3.77Å; T525-V529 WeakPolarHBondContact O-CG2 3.49Å; T525-V529 PolarHBondContact O-N 3.15Å; V529-L531 VanDerWaalsContact C-N 3.34Å; V529-L531 PolarHBondContact O-N 2.93Å; V529-V532 PolarHBondContact O-N 2.84Å; V529-F533 PolarHBondContact O-N 2.74Å
530	N	83.1	Confident	77.9	Confident	75 Å²	75	88 Å²	88	40%	0.401	44%	0.442	S	S	.	.	H	α-helix	trans	-65.1	-36.8	-179	-76.8	-70.2	0	0	0	112.6	K507 N526 V532 F533 E534	K507-N530 WeakPolarHBondContact CE-OD1 3.45Å; K507-N530 PolarHBondContact NZ-OD1 3.32Å; K507-N530 VanDerWaalsContact NZ-OD1 3.11Å; N526-N530 PolarHBondContact O-N 3.22Å; N526-N530 PolarHBondContact O-ND2 3.15Å; N530-V532 VanDerWaalsContact C-N 3.29Å; N530-V532 PolarHBondContact O-N 3.05Å; N530-F533 PolarHBondContact O-N 2.9Å; N530-E534 PolarHBondContact O-N 3.15Å
531	L	85.9	Confident	76.9	Confident	114 Å²	114	90.5 Å²	90.5	60%	0.597	46%	0.463	S	S	*	.	H	α-helix	trans	-66.2	-27.8	177.2	-174.1	63.5	0	0	0	113.4	K527 K528 V529	K527-L531 WeakPolarHBondContact O-CB 3.16Å; K527-L531 PolarHBondContact O-N 3.33Å; K528-L531 PolarHBondContact O-N 2.99Å; V529-L531 VanDerWaalsContact C-N 3.34Å; V529-L531 PolarHBondContact O-N 2.93Å
532	V	80.8	Confident	75.5	Confident	60 Å²	60	95.5 Å²	95.5	36%	0.364	47%	0.472	S	S	.	.	H	α-helix	trans	-72.7	-39.5	173.2	172.9	0	0	0	0	111	L510 K528 V529 N530 K535 I536	L510-V532 HydrophobicContact CD2-CB 4.01Å; L510-V532 HydrophobicContact CD2-CG1 3.86Å; K528-V532 WeakPolarHBondContact O-CG2 3.35Å; K528-V532 PolarHBondContact O-N 3.42Å; V529-V532 PolarHBondContact O-N 2.84Å; N530-V532 VanDerWaalsContact C-N 3.29Å; N530-V532 PolarHBondContact O-N 3.05Å; V532-K535 PolarHBondContact O-N 3.47Å; V532-I536 HydrophobicContact CG1-CD1 3.91Å; V532-I536 WeakPolarHBondContact O-CG1 3.28Å; V532-I536 PolarHBondContact O-N 3.17Å
533	F	78.8	Confident	73.7	Confident	41 Å²	41	95.4 Å²	95.4	18%	0.18	48%	0.483	C	S	.	.	H	α-helix	trans	-65.5	-44.3	-176.7	-140.8	-89.6	0	0	0	112.5	E503 A506 K507 V529 N530 K535 I536 Q537	E503-F533 HydrophobicContact CB-CE1 4.05Å; E503-F533 HydrophobicContact CB-CZ 3.97Å; E503-F533 HydrophobicContact CG-CD1 3.92Å; E503-F533 HydrophobicContact CG-CE1 3.42Å; E503-F533 VanDerWaalsContact CG-CE1 3.42Å; E503-F533 HydrophobicContact CG-CE2 4.28Å; E503-F533 HydrophobicContact CG-CZ 3.63Å; E503-F533 VanDerWaalsContact OE2-CE1 3.27Å; E503-F533 WeakPolarHBondContact OE2-CE1 3.41Å; A506-F533 HydrophobicContact CB-CE2 3.96Å; K507-F533 HydrophobicContact CG-CD2 3.96Å; K507-F533 HydrophobicContact CG-CE2 4.39Å; K507-F533 HydrophobicContact CG-CG 4.42Å; V529-F533 PolarHBondContact O-N 2.74Å; N530-F533 PolarHBondContact O-N 2.9Å; F533-K535 VanDerWaalsContact C-N 3.31Å; F533-K535 PolarHBondContact O-N 3.13Å; F533-I536 PolarHBondContact O-N 3.27Å; F533-Q537 PolarHBondContact O-N 3.5Å
534	E	81.4	Confident	71.8	Confident	120 Å²	120	96 Å²	96	56%	0.561	49%	0.491	S	S	*	.	H	α-helix	trans	-50.1	-46.5	171.2	-90.4	-72.6	150.9	0	0	113	N530 I536 Q537 T538	N530-E534 PolarHBondContact O-N 3.15Å; E534-I536 VanDerWaalsContact C-N 3.31Å; E534-I536 PolarHBondContact O-N 3.1Å; E534-Q537 PolarHBondContact O-N 3.38Å; E534-T538 PolarHBondContact O-N 2.98Å; E534-T538 PolarHBondContact O-OG1 3.16Å
535	K	79.7	Confident	69.7	Low	147 Å²	147	98.4 Å²	98.4	64%	0.639	52%	0.518	S	S	*	.	H	α-helix	trans	-67.6	-27.5	179	-81.8	-174.7	172.7	-179.3	0	113.8	V532 F533 T538 L539	V532-K535 PolarHBondContact O-N 3.47Å; F533-K535 VanDerWaalsContact C-N 3.31Å; F533-K535 PolarHBondContact O-N 3.13Å; K535-T538 WeakPolarHBondContact CA-OG1 3.47Å; K535-T538 PolarHBondContact O-OG1 3.39Å; K535-L539 WeakPolarHBondContact O-CD1 3.12Å; K535-L539 WeakPolarHBondContact O-CG 3.35Å
536	I	72.7	Confident	67.3	Low	99 Å²	99	102.3 Å²	102.3	51%	0.508	56%	0.558	S	S	.	*	H	α-helix	trans	-78.5	-42.3	176.6	-66.4	167.9	0	0	0	109.9	V532 F533 E534 T538 L539 K540	V532-I536 HydrophobicContact CG1-CD1 3.91Å; V532-I536 WeakPolarHBondContact O-CG1 3.28Å; V532-I536 PolarHBondContact O-N 3.17Å; F533-I536 PolarHBondContact O-N 3.27Å; E534-I536 VanDerWaalsContact C-N 3.31Å; E534-I536 PolarHBondContact O-N 3.1Å; I536-T538 PolarHBondContact O-N 3.21Å; I536-L539 PolarHBondContact O-N 3.03Å; I536-K540 PolarHBondContact O-N 3.38Å
537	Q	70.8	Confident	65.1	Low	100 Å²	100	104 Å²	104	47%	0.467	58%	0.582	S	S	.	*	H	α-helix	trans	-65.9	-39.5	-178.7	-147.7	175.4	72.7	0	0	111.9	F533 E534 L539 K540	F533-Q537 PolarHBondContact O-N 3.5Å; E534-Q537 PolarHBondContact O-N 3.38Å; Q537-L539 VanDerWaalsContact C-N 3.3Å; Q537-L539 PolarHBondContact O-N 2.95Å; Q537-K540 PolarHBondContact O-N 3.1Å
538	T	65.4	Low	62.7	Low	86 Å²	86	106.8 Å²	106.8	53%	0.528	60%	0.597	S	S	.	*	H	α-helix	trans	-69.2	-17.9	174.8	45.3	0	0	0	0	115	E534 K535 I536 S541	E534-T538 PolarHBondContact O-N 2.98Å; E534-T538 PolarHBondContact O-OG1 3.16Å; K535-T538 WeakPolarHBondContact CA-OG1 3.47Å; K535-T538 PolarHBondContact O-OG1 3.39Å; I536-T538 PolarHBondContact O-N 3.21Å; T538-S541 PolarHBondContact O-OG 3.24Å
539	L	60.7	Low	60.3	Low	130 Å²	130	105.7 Å²	105.7	68%	0.681	61%	0.611	S	S	*	*	H	α-helix	trans	-83.5	-35.5	171.1	-73.8	169.2	0	0	0	112.2	K535 I536 Q537 S541 R542	K535-L539 WeakPolarHBondContact O-CD1 3.12Å; K535-L539 WeakPolarHBondContact O-CG 3.35Å; I536-L539 PolarHBondContact O-N 3.03Å; Q537-L539 VanDerWaalsContact C-N 3.3Å; Q537-L539 PolarHBondContact O-N 2.95Å; L539-S541 VanDerWaalsContact C-N 3.29Å; L539-S541 PolarHBondContact O-N 2.95Å; L539-R542 PolarHBondContact O-N 3.14Å
540	K	53.6	Low	57.8	Low	132 Å²	132	113 Å²	113	57%	0.574	65%	0.65	S	S	*	*	H	α-helix	trans	-59.1	-37.8	-179.4	-171.6	-178.7	176.8	-173.7	0	112.3	Q499 I536 Q537 R542 A543	Q499-K540 VanDerWaalsContact OE1-NZ 3.07Å; I536-K540 PolarHBondContact O-N 3.38Å; Q537-K540 PolarHBondContact O-N 3.1Å; K540-R542 PolarHBondContact O-N 3.23Å; K540-A543 PolarHBondContact O-N 3.23Å
541	S	54.4	Low	55.5	Low	98 Å²	98	114.7 Å²	114.7	69%	0.685	67%	0.668	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.3	-5.2	-176.8	50.3	0	0	0	0	115.6	T538 L539	T538-S541 PolarHBondContact O-OG 3.24Å; L539-S541 VanDerWaalsContact C-N 3.29Å; L539-S541 PolarHBondContact O-N 2.95Å
542	R	50.7	Low	53.3	Low	231 Å²	231	117.6 Å²	117.6	87%	0.872	68%	0.676	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	-7.3	179.6	-163.9	172	178.4	-169.2	-1.1	114.4	L539 K540	L539-R542 PolarHBondContact O-N 3.14Å; K540-R542 PolarHBondContact O-N 3.23Å
543	A	44.5	Very low	52	Low	82 Å²	82	120.3 Å²	120.3	68%	0.678	70%	0.697	S	S	*	*	S	Bend	trans	-100.5	-7.6	-161.3	0	0	0	0	0	116.8	K540	K540-A543 PolarHBondContact O-N 3.23Å
544	T	41.1	Very low	50.9	Low	128 Å²	128	123.9 Å²	123.9	79%	0.785	72%	0.722	S	S	*	*			trans	-135.7	81.5	-165.7	54.9	0	0	0	0	114.3
545	A	38.5	Very low	49.5	Very low	112 Å²	112	124.9 Å²	124.9	93%	0.926	73%	0.731	S	S	*	*			trans	-157.3	120.5	164.2	0	0	0	0	0	112.5
546	G	34.4	Very low	48.3	Very low	83 Å²	83	122 Å²	122	86%	0.856	72%	0.722	S	S	*	*			trans	129.1	101.5	159	0	0	0	0	0	117.5
547	A	36.5	Very low	47.5	Very low	106 Å²	106	120.3 Å²	120.3	88%	0.876	72%	0.723	S	S	*	*			trans	-175.1	112.3	148.3	0	0	0	0	0	111.9
548	Q	32.7	Very low	47.1	Very low	209 Å²	209	118.8 Å²	118.8	98%	0.977	73%	0.728	S	S	*	*			trans	-166.9	146.2	163	-161	174.6	4.5	0	0	110.5
549	G	33.1	Very low	46.9	Very low	65 Å²	65	120.5 Å²	120.5	67%	0.67	73%	0.73	S	S	*	*			trans	115.2	67.6	155.8	0	0	0	0	0	120.2
550	D	34.9	Very low	47.1	Very low	156 Å²	156	118 Å²	118	83%	0.834	72%	0.72	S	S	*	*			trans	38.5	138.1	132.4	-63.7	-2.4	0	0	0	125.4
551	S	34.6	Very low	48	Very low	109 Å²	109	117.7 Å²	117.7	76%	0.762	72%	0.719	S	S	*	*			trans	70.5	86.9	135.3	-65.5	0	0	0	0	122
552	K	41.3	Very low	48.9	Very low	176 Å²	176	115.4 Å²	115.4	77%	0.765	71%	0.706	S	S	*	*			trans	-144.8	81.8	146.3	-71.3	-166.6	-179.1	176.8	0	113.5
553	S	52.1	Low	50.1	Low	116 Å²	116	108.4 Å²	108.4	81%	0.811	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	138.7	157.4	51.5	0	0	0	0	109.2
554	V	55.4	Low	51.6	Low	116 Å²	116	110.9 Å²	110.9	70%	0.703	68%	0.683	S	S	*	*	T	Hydrogen-bonded Turn	cis	-124.5	-24.1	32.6	169.3	0	0	0	0	114.9	L556 A557	V554-L556 PolarHBondContact O-N 3.22Å; V554-L556 VanDerWaalsContact O-N 3.13Å; V554-A557 WeakPolarHBondContact O-CB 3.41Å; V554-A557 PolarHBondContact O-N 3.41Å
555	D	52.9	Low	53.4	Low	142 Å²	142	110.1 Å²	110.1	76%	0.759	67%	0.67	S	S	*	*	H	α-helix	trans	-58.3	-31	-177.5	-82.1	-43.7	0	0	0	113.7	A557 A558 Q559	D555-A557 PolarHBondContact O-N 3.34Å; D555-A557 VanDerWaalsContact O-N 3.13Å; D555-A558 PolarHBondContact O-N 2.93Å; D555-A558 VanDerWaalsContact O-N 3.11Å; D555-Q559 PolarHBondContact O-N 2.77Å
556	L	54.2	Low	55.5	Low	85 Å²	85	110.6 Å²	110.6	45%	0.445	65%	0.653	S	S	.	*	H	α-helix	trans	-55.1	-29.7	173.7	-90.2	172.5	0	0	0	112.7	V554 Q559 T560	V554-L556 PolarHBondContact O-N 3.22Å; V554-L556 VanDerWaalsContact O-N 3.13Å; L556-Q559 PolarHBondContact O-N 3.31Å; L556-T560 WeakPolarHBondContact O-CB 3.49Å; L556-T560 VanDerWaalsContact O-CG2 3.29Å; L556-T560 WeakPolarHBondContact O-CG2 3.48Å; L556-T560 PolarHBondContact O-N 3.33Å; L556-T560 PolarHBondContact O-OG1 2.83Å
557	A	56.9	Low	57.4	Low	64 Å²	64	111 Å²	111	53%	0.529	64%	0.636	S	S	.	*	H	α-helix	trans	-69.2	-38.1	178.7	0	0	0	0	0	112.7	V554 D555 T560 K561	V554-A557 WeakPolarHBondContact O-CB 3.41Å; V554-A557 PolarHBondContact O-N 3.41Å; D555-A557 PolarHBondContact O-N 3.34Å; D555-A557 VanDerWaalsContact O-N 3.13Å; A557-T560 PolarHBondContact O-OG1 3.22Å; A557-K561 WeakPolarHBondContact O-CB 3.29Å; A557-K561 PolarHBondContact O-N 3.41Å
558	A	61.3	Low	59.7	Low	69 Å²	69	107.9 Å²	107.9	57%	0.57	61%	0.61	S	S	*	*	H	α-helix	trans	-71	-41.6	173.9	0	0	0	0	0	110.7	D555 K561 A562	D555-A558 PolarHBondContact O-N 2.93Å; D555-A558 VanDerWaalsContact O-N 3.11Å; A558-K561 PolarHBondContact O-N 3.48Å; A558-A562 WeakPolarHBondContact O-CB 3.32Å; A558-A562 PolarHBondContact O-N 2.85Å
559	Q	61.8	Low	62.3	Low	121 Å²	121	102.8 Å²	102.8	57%	0.565	59%	0.586	S	S	*	*	H	α-helix	trans	-67.9	-40.5	178.4	-164.5	174.1	38.4	0	0	112.6	D555 L556 K561 A562 L563	D555-Q559 PolarHBondContact O-N 2.77Å; L556-Q559 PolarHBondContact O-N 3.31Å; Q559-K561 VanDerWaalsContact C-N 3.33Å; Q559-A562 PolarHBondContact O-N 2.92Å; Q559-L563 HydrophobicContact CG-CD1 4.25Å; Q559-L563 WeakPolarHBondContact O-CB 3.29Å; Q559-L563 VanDerWaalsContact O-CG 3.31Å; Q559-L563 WeakPolarHBondContact O-CG 3.45Å; Q559-L563 PolarHBondContact O-N 2.96Å
560	T	63.6	Low	64.6	Low	77 Å²	77	103.8 Å²	103.8	47%	0.472	58%	0.576	S	S	.	*	H	α-helix	trans	-66.9	-34.6	172.5	53.8	0	0	0	0	111.5	L556 A557 L563 Q564	L556-T560 WeakPolarHBondContact O-CB 3.49Å; L556-T560 VanDerWaalsContact O-CG2 3.29Å; L556-T560 WeakPolarHBondContact O-CG2 3.48Å; L556-T560 PolarHBondContact O-N 3.33Å; L556-T560 PolarHBondContact O-OG1 2.83Å; A557-T560 PolarHBondContact O-OG1 3.22Å; T560-L563 PolarHBondContact O-N 3.34Å; T560-Q564 WeakPolarHBondContact O-CB 3.39Å; T560-Q564 PolarHBondContact O-N 2.99Å
561	K	72.8	Confident	66.8	Low	126 Å²	126	102.4 Å²	102.4	55%	0.548	56%	0.564	S	S	.	*	H	α-helix	trans	-69	-40.9	176.1	-164.8	180	178.9	-168.1	0	111.7	A557 A558 Q559 Q564 E565	A557-K561 WeakPolarHBondContact O-CB 3.29Å; A557-K561 PolarHBondContact O-N 3.41Å; A558-K561 PolarHBondContact O-N 3.48Å; Q559-K561 VanDerWaalsContact C-N 3.33Å; K561-Q564 PolarHBondContact O-N 2.92Å; K561-E565 WeakPolarHBondContact O-CB 3.44Å; K561-E565 WeakPolarHBondContact O-CG 3.48Å; K561-E565 PolarHBondContact O-N 3.43Å
562	A	74.3	Confident	69.4	Low	51 Å²	51	102.5 Å²	102.5	42%	0.421	55%	0.551	S	S	.	*	H	α-helix	trans	-65.2	-39.4	173	0	0	0	0	0	112.4	A558 Q559 Q564 E565 Q566	A558-A562 WeakPolarHBondContact O-CB 3.32Å; A558-A562 PolarHBondContact O-N 2.85Å; Q559-A562 PolarHBondContact O-N 2.92Å; A562-Q564 VanDerWaalsContact C-N 3.34Å; A562-E565 PolarHBondContact O-N 2.68Å; A562-Q566 WeakPolarHBondContact O-CB 3.38Å; A562-Q566 WeakPolarHBondContact O-CG 3.44Å; A562-Q566 PolarHBondContact O-N 2.87Å
563	L	74.4	Confident	71.7	Confident	84 Å²	84	99.4 Å²	99.4	44%	0.44	54%	0.539	S	S	.	.	H	α-helix	trans	-70.5	-28.1	172.8	-73.5	168.8	0	0	0	112.6	Q559 T560 N567	Q559-L563 HydrophobicContact CG-CD1 4.25Å; Q559-L563 WeakPolarHBondContact O-CB 3.29Å; Q559-L563 VanDerWaalsContact O-CG 3.31Å; Q559-L563 WeakPolarHBondContact O-CG 3.45Å; Q559-L563 PolarHBondContact O-N 2.96Å; T560-L563 PolarHBondContact O-N 3.34Å; L563-N567 VanDerWaalsContact O-CB 3.26Å; L563-N567 WeakPolarHBondContact O-CB 3.48Å; L563-N567 PolarHBondContact O-N 2.86Å; L563-N567 PolarHBondContact O-ND2 2.86Å
564	Q	76.3	Confident	73.1	Confident	133 Å²	133	98 Å²	98	62%	0.621	52%	0.522	S	S	*	.	H	α-helix	trans	-76.6	-34.9	174	-174.6	174.6	10.2	0	0	111.3	T560 K561 A562 A568	T560-Q564 WeakPolarHBondContact O-CB 3.39Å; T560-Q564 PolarHBondContact O-N 2.99Å; K561-Q564 PolarHBondContact O-N 2.92Å; A562-Q564 VanDerWaalsContact C-N 3.34Å; Q564-A568 VanDerWaalsContact O-CB 3.27Å; Q564-A568 WeakPolarHBondContact O-CB 3.48Å; Q564-A568 PolarHBondContact O-N 2.74Å
565	E	80.6	Confident	74.6	Confident	112 Å²	112	97.9 Å²	97.9	52%	0.523	52%	0.517	S	S	.	.	H	α-helix	trans	-67.7	-42.7	168.9	-76.8	169.5	-179.1	0	0	110.6	K561 A562 A568 E569	K561-E565 WeakPolarHBondContact O-CB 3.44Å; K561-E565 WeakPolarHBondContact O-CG 3.48Å; K561-E565 PolarHBondContact O-N 3.43Å; A562-E565 PolarHBondContact O-N 2.68Å; E565-A568 CarbonylContact O-C 3.51Å; E565-A568 PolarHBondContact O-N 3.02Å; E565-E569 WeakPolarHBondContact O-CB 3.12Å; E565-E569 PolarHBondContact O-N 3.31Å
566	Q	82.3	Confident	76.4	Confident	122 Å²	122	94.4 Å²	94.4	57%	0.57	50%	0.496	S	S	*	.	H	α-helix	trans	-64	-39	171.1	-77.2	-172.2	-23.6	0	0	113	A562 E569 L570	A562-Q566 WeakPolarHBondContact O-CB 3.38Å; A562-Q566 WeakPolarHBondContact O-CG 3.44Å; A562-Q566 PolarHBondContact O-N 2.87Å; Q566-E569 PolarHBondContact O-N 2.92Å; Q566-L570 WeakPolarHBondContact O-CB 3.46Å; Q566-L570 VanDerWaalsContact O-CG 3.29Å; Q566-L570 WeakPolarHBondContact O-CG 3.45Å; Q566-L570 PolarHBondContact O-N 3.35Å
567	N	74.3	Confident	78	Confident	93 Å²	93	95.4 Å²	95.4	50%	0.497	50%	0.501	S	S	.	.	H	α-helix	trans	-67.2	-36.7	173.3	-77.6	-20.5	0	0	0	111.5	L563 E569 L570 E571	L563-N567 VanDerWaalsContact O-CB 3.26Å; L563-N567 WeakPolarHBondContact O-CB 3.48Å; L563-N567 PolarHBondContact O-N 2.86Å; L563-N567 PolarHBondContact O-ND2 2.86Å; N567-E569 VanDerWaalsContact C-N 3.34Å; N567-L570 PolarHBondContact O-N 3.25Å; N567-E571 VanDerWaalsContact O-CB 3.3Å; N567-E571 WeakPolarHBondContact O-CB 3.47Å; N567-E571 VanDerWaalsContact O-CG 3.28Å; N567-E571 WeakPolarHBondContact O-CG 3.47Å; N567-E571 PolarHBondContact O-N 2.8Å
568	A	83.5	Confident	79.2	Confident	40 Å²	40	98 Å²	98	33%	0.331	50%	0.5	S	S	.	.	H	α-helix	trans	-69.7	-31.2	173.4	0	0	0	0	0	112.4	Q564 E565 K572	Q564-A568 VanDerWaalsContact O-CB 3.27Å; Q564-A568 WeakPolarHBondContact O-CB 3.48Å; Q564-A568 PolarHBondContact O-N 2.74Å; E565-A568 CarbonylContact O-C 3.51Å; E565-A568 PolarHBondContact O-N 3.02Å; A568-K572 WeakPolarHBondContact O-CB 3.48Å; A568-K572 WeakPolarHBondContact O-CE 3.46Å; A568-K572 WeakPolarHBondContact O-CG 3.44Å; A568-K572 PolarHBondContact O-N 2.96Å
569	E	86.9	Confident	80.4	Confident	101 Å²	101	100 Å²	100	47%	0.472	49%	0.493	S	S	.	.	H	α-helix	trans	-68.8	-46	170.9	-145.1	68.9	-100.7	0	0	110.7	E565 Q566 N567 E571 K572 E573	E565-E569 WeakPolarHBondContact O-CB 3.12Å; E565-E569 PolarHBondContact O-N 3.31Å; Q566-E569 PolarHBondContact O-N 2.92Å; N567-E569 VanDerWaalsContact C-N 3.34Å; E569-E571 PolarHBondContact O-N 2.74Å; E569-K572 VanDerWaalsContact CD-NZ 3.28Å; E569-K572 CarbonylContact O-C 3.57Å; E569-K572 WeakPolarHBondContact O-CA 3.38Å; E569-K572 WeakPolarHBondContact O-CB 3.3Å; E569-K572 PolarHBondContact O-N 3.38Å; E569-K572 WeakPolarHBondContact OE1-CE 3.28Å; E569-K572 IonicContact OE1-NZ 3.66Å; E569-K572 PolarHBondContact OE1-NZ 3.1Å; E569-K572 IonicContact OE2-NZ 2.89Å; E569-K572 PolarHBondContact OE2-NZ 3.49Å; E569-E573 WeakPolarHBondContact O-CG 3.27Å; E569-E573 PolarHBondContact O-N 3.08Å
570	L	82.8	Confident	81.6	Confident	86 Å²	86	98.2 Å²	98.2	45%	0.45	49%	0.485	S	S	.	.	H	α-helix	trans	-65.9	-34.6	174.4	-72.4	168.8	0	0	0	112.4	Q566 N567 E573 I574	Q566-L570 WeakPolarHBondContact O-CB 3.46Å; Q566-L570 VanDerWaalsContact O-CG 3.29Å; Q566-L570 WeakPolarHBondContact O-CG 3.45Å; Q566-L570 PolarHBondContact O-N 3.35Å; N567-L570 PolarHBondContact O-N 3.25Å; L570-E573 PolarHBondContact O-N 3.49Å; L570-I574 VanDerWaalsContact O-CB 3.26Å; L570-I574 WeakPolarHBondContact O-CB 3.4Å; L570-I574 WeakPolarHBondContact O-CD1 3.4Å; L570-I574 WeakPolarHBondContact O-CG1 3.43Å; L570-I574 PolarHBondContact O-N 3.16Å
571	E	81.6	Confident	82.6	Confident	127 Å²	127	99.6 Å²	99.6	59%	0.593	49%	0.489	S	S	*	.	H	α-helix	trans	-67.1	-39.8	171.1	-80.1	177.3	-176.7	0	0	111.1	N567 E569 I574 L575	N567-E571 VanDerWaalsContact O-CB 3.3Å; N567-E571 WeakPolarHBondContact O-CB 3.47Å; N567-E571 VanDerWaalsContact O-CG 3.28Å; N567-E571 WeakPolarHBondContact O-CG 3.47Å; N567-E571 PolarHBondContact O-N 2.8Å; E569-E571 PolarHBondContact O-N 2.74Å; E571-I574 PolarHBondContact O-N 3.44Å; E571-L575 VanDerWaalsContact O-CB 3.31Å; E571-L575 WeakPolarHBondContact O-CB 3.49Å; E571-L575 VanDerWaalsContact O-CG 3.22Å; E571-L575 WeakPolarHBondContact O-CG 3.45Å; E571-L575 PolarHBondContact O-N 2.96Å
572	K	88.1	Confident	83.1	Confident	112 Å²	112	100 Å²	100	49%	0.487	49%	0.493	S	S	.	.	H	α-helix	trans	-62.9	-43.8	170.3	-85.5	176.5	-82.2	157.7	0	111.8	A568 E569 L575 E576	A568-K572 WeakPolarHBondContact O-CB 3.48Å; A568-K572 WeakPolarHBondContact O-CE 3.46Å; A568-K572 WeakPolarHBondContact O-CG 3.44Å; A568-K572 PolarHBondContact O-N 2.96Å; E569-K572 VanDerWaalsContact CD-NZ 3.28Å; E569-K572 CarbonylContact O-C 3.57Å; E569-K572 WeakPolarHBondContact O-CA 3.38Å; E569-K572 WeakPolarHBondContact O-CB 3.3Å; E569-K572 PolarHBondContact O-N 3.38Å; E569-K572 WeakPolarHBondContact OE1-CE 3.28Å; E569-K572 IonicContact OE1-NZ 3.66Å; E569-K572 PolarHBondContact OE1-NZ 3.1Å; E569-K572 IonicContact OE2-NZ 2.89Å; E569-K572 PolarHBondContact OE2-NZ 3.49Å; K572-L575 PolarHBondContact O-N 2.84Å; K572-E576 VanDerWaalsContact O-CB 3.26Å; K572-E576 WeakPolarHBondContact O-CB 3.47Å; K572-E576 PolarHBondContact O-N 3.08Å
573	E	89.5	Confident	83.7	Confident	110 Å²	110	100.3 Å²	100.3	51%	0.514	49%	0.486	S	S	.	.	H	α-helix	trans	-65.5	-39.3	175	-73.8	-170.7	164.2	0	0	112	E569 L570 E576 L577	E569-E573 WeakPolarHBondContact O-CG 3.27Å; E569-E573 PolarHBondContact O-N 3.08Å; L570-E573 PolarHBondContact O-N 3.49Å; E573-E576 PolarHBondContact O-N 3.42Å; E573-L577 WeakPolarHBondContact O-CB 3.41Å; E573-L577 WeakPolarHBondContact O-CG 3.11Å; E573-L577 PolarHBondContact O-N 3.41Å
574	I	81.9	Confident	84.1	Confident	86 Å²	86	101.1 Å²	101.1	44%	0.441	49%	0.487	S	S	.	.	H	α-helix	trans	-67.7	-38.5	175.2	-73.9	164.4	0	0	0	110.8	L570 E571 K578	L570-I574 VanDerWaalsContact O-CB 3.26Å; L570-I574 WeakPolarHBondContact O-CB 3.4Å; L570-I574 WeakPolarHBondContact O-CD1 3.4Å; L570-I574 WeakPolarHBondContact O-CG1 3.43Å; L570-I574 PolarHBondContact O-N 3.16Å; E571-I574 PolarHBondContact O-N 3.44Å; I574-K578 HydrophobicContact CG2-CD 4.16Å; I574-K578 VanDerWaalsContact O-CB 3.27Å; I574-K578 WeakPolarHBondContact O-CB 3.45Å; I574-K578 WeakPolarHBondContact O-CG 3.4Å; I574-K578 PolarHBondContact O-N 3.42Å
575	L	87.2	Confident	84.4	Confident	114 Å²	114	98.4 Å²	98.4	60%	0.597	48%	0.476	S	S	*	.	H	α-helix	trans	-68.2	-40	173.6	-74.8	169.2	0	0	0	111.6	E571 K572 K578 R579	E571-L575 VanDerWaalsContact O-CB 3.31Å; E571-L575 WeakPolarHBondContact O-CB 3.49Å; E571-L575 VanDerWaalsContact O-CG 3.22Å; E571-L575 WeakPolarHBondContact O-CG 3.45Å; E571-L575 PolarHBondContact O-N 2.96Å; K572-L575 PolarHBondContact O-N 2.84Å; L575-K578 PolarHBondContact O-N 2.94Å; L575-R579 VanDerWaalsContact O-CB 3.27Å; L575-R579 WeakPolarHBondContact O-CB 3.38Å; L575-R579 PolarHBondContact O-N 3.3Å
576	E	90.5	Very high	84.7	Confident	70 Å²	70	100.6 Å²	100.6	33%	0.327	48%	0.484	S	S	.	.	H	α-helix	trans	-69	-41.1	175.9	177.2	54.8	-155.5	0	0	111.7	K572 E573 R579 Q580	K572-E576 VanDerWaalsContact O-CB 3.26Å; K572-E576 WeakPolarHBondContact O-CB 3.47Å; K572-E576 PolarHBondContact O-N 3.08Å; E573-E576 PolarHBondContact O-N 3.42Å; E576-R579 CarbonylContact O-C 3.59Å; E576-R579 WeakPolarHBondContact O-CB 3.4Å; E576-R579 PolarHBondContact O-N 3.02Å; E576-R579 IonicContact OE1-CZ 2.68Å; E576-R579 IonicContact OE1-NE 3.86Å; E576-R579 IonicContact OE1-NH2 3.24Å; E576-R579 PolarHBondContact OE1-NH2 3.45Å; E576-R579 IonicContact OE2-CZ 3.63Å; E576-R579 IonicContact OE2-NE 3.77Å; E576-R579 PolarHBondContact OE2-NE 2.88Å; E576-R579 IonicContact OE2-NH2 3.5Å; E576-R579 PolarHBondContact OE2-NH2 3.28Å; E576-Q580 WeakPolarHBondContact O-CB 3.47Å; E576-Q580 VanDerWaalsContact O-CG 3.26Å; E576-Q580 WeakPolarHBondContact O-CG 3.45Å; E576-Q580 PolarHBondContact O-N 3.29Å; E576-Q580 WeakPolarHBondContact OE1-CG 3.42Å; E576-Q580 PolarHBondContact OE1-NE2 2.9Å
577	L	87.2	Confident	84.6	Confident	106 Å²	106	101.8 Å²	101.8	56%	0.555	48%	0.483	S	S	*	.	H	α-helix	trans	-66.9	-37	173.3	-73.9	169.3	0	0	0	111.8	E573 Q580 L581	E573-L577 WeakPolarHBondContact O-CB 3.41Å; E573-L577 WeakPolarHBondContact O-CG 3.11Å; E573-L577 PolarHBondContact O-N 3.41Å; L577-Q580 PolarHBondContact O-N 2.94Å; L577-L581 VanDerWaalsContact O-CB 3.22Å; L577-L581 WeakPolarHBondContact O-CB 3.34Å; L577-L581 PolarHBondContact O-N 2.91Å
578	K	81.6	Confident	84.9	Confident	118 Å²	118	103.9 Å²	103.9	51%	0.513	49%	0.488	S	S	.	.	H	α-helix	trans	-62.7	-46.8	169	-79.5	170.8	180	176.7	0	111	I574 L575 Q580 L581 E582	I574-K578 HydrophobicContact CG2-CD 4.16Å; I574-K578 VanDerWaalsContact O-CB 3.27Å; I574-K578 WeakPolarHBondContact O-CB 3.45Å; I574-K578 WeakPolarHBondContact O-CG 3.4Å; I574-K578 PolarHBondContact O-N 3.42Å; L575-K578 PolarHBondContact O-N 2.94Å; K578-Q580 VanDerWaalsContact C-N 3.33Å; K578-Q580 PolarHBondContact O-N 3.19Å; K578-L581 CarbonylContact O-C 2.89Å; K578-L581 PolarHBondContact O-N 3.36Å; K578-L581 VanDerWaalsContact O-N 3.16Å; K578-E582 WeakPolarHBondContact O-CB 3.36Å; K578-E582 WeakPolarHBondContact O-CG 3.45Å; K578-E582 PolarHBondContact O-N 2.85Å
579	R	87.6	Confident	84.7	Confident	110 Å²	110	107.7 Å²	107.7	42%	0.415	50%	0.498	S	S	.	.	H	α-helix	trans	-60.4	-41.2	176.6	-164.8	-168.6	71.8	70.5	9.7	111.7	L575 E576 E583	L575-R579 VanDerWaalsContact O-CB 3.27Å; L575-R579 WeakPolarHBondContact O-CB 3.38Å; L575-R579 PolarHBondContact O-N 3.3Å; E576-R579 CarbonylContact O-C 3.59Å; E576-R579 WeakPolarHBondContact O-CB 3.4Å; E576-R579 PolarHBondContact O-N 3.02Å; E576-R579 IonicContact OE1-CZ 2.68Å; E576-R579 IonicContact OE1-NE 3.86Å; E576-R579 IonicContact OE1-NH2 3.24Å; E576-R579 PolarHBondContact OE1-NH2 3.45Å; E576-R579 IonicContact OE2-CZ 3.63Å; E576-R579 IonicContact OE2-NE 3.77Å; E576-R579 PolarHBondContact OE2-NE 2.88Å; E576-R579 IonicContact OE2-NH2 3.5Å; E576-R579 PolarHBondContact OE2-NH2 3.28Å; R579-E583 IonicContact CZ-OE1 2.75Å; R579-E583 IonicContact NH1-OE1 2.66Å; R579-E583 PolarHBondContact NH1-OE1 3.23Å; R579-E583 IonicContact NH1-OE2 2.94Å; R579-E583 WeakPolarHBondContact O-CB 3.49Å; R579-E583 WeakPolarHBondContact O-CG 3.47Å; R579-E583 PolarHBondContact O-N 2.71Å
580	Q	87	Confident	84.4	Confident	85 Å²	85	109.3 Å²	109.3	40%	0.397	50%	0.504	S	S	.	.	H	α-helix	trans	-69.3	-36.1	174.5	-73	178.3	23.6	0	0	112.4	E576 L577 K578 E583 Q584	E576-Q580 WeakPolarHBondContact O-CB 3.47Å; E576-Q580 VanDerWaalsContact O-CG 3.26Å; E576-Q580 WeakPolarHBondContact O-CG 3.45Å; E576-Q580 PolarHBondContact O-N 3.29Å; E576-Q580 WeakPolarHBondContact OE1-CG 3.42Å; E576-Q580 PolarHBondContact OE1-NE2 2.9Å; L577-Q580 PolarHBondContact O-N 2.94Å; K578-Q580 VanDerWaalsContact C-N 3.33Å; K578-Q580 PolarHBondContact O-N 3.19Å; Q580-E583 PolarHBondContact O-N 3.29Å; Q580-Q584 VanDerWaalsContact O-CB 3.3Å; Q580-Q584 WeakPolarHBondContact O-CB 3.49Å; Q580-Q584 WeakPolarHBondContact O-CG 3.46Å; Q580-Q584 PolarHBondContact O-N 3.41Å
581	L	84.6	Confident	84.1	Confident	106 Å²	106	107.5 Å²	107.5	56%	0.555	50%	0.498	S	S	*	.	H	α-helix	trans	-70.2	-41.1	174.9	-178.1	60.6	0	0	0	111.5	L577 K578 Q584 I585	L577-L581 VanDerWaalsContact O-CB 3.22Å; L577-L581 WeakPolarHBondContact O-CB 3.34Å; L577-L581 PolarHBondContact O-N 2.91Å; K578-L581 CarbonylContact O-C 2.89Å; K578-L581 PolarHBondContact O-N 3.36Å; K578-L581 VanDerWaalsContact O-N 3.16Å; L581-Q584 WeakPolarHBondContact O-CB 3.28Å; L581-Q584 PolarHBondContact O-N 2.84Å; L581-I585 HydrophobicContact CD1-CD1 4.33Å; L581-I585 HydrophobicContact CG-CD1 4.06Å; L581-I585 WeakPolarHBondContact O-CB 3.45Å; L581-I585 VanDerWaalsContact O-CG1 3.24Å; L581-I585 WeakPolarHBondContact O-CG1 3.48Å; L581-I585 PolarHBondContact O-N 3.5Å
582	E	82.4	Confident	84.1	Confident	133 Å²	133	106.1 Å²	106.1	62%	0.621	49%	0.492	S	S	*	.	H	α-helix	trans	-64.9	-41.2	171.7	-75.3	178.9	-163.5	0	0	111.3	K578 I585 K586	K578-E582 WeakPolarHBondContact O-CB 3.36Å; K578-E582 WeakPolarHBondContact O-CG 3.45Å; K578-E582 PolarHBondContact O-N 2.85Å; E582-I585 PolarHBondContact O-N 3.39Å; E582-K586 WeakPolarHBondContact O-CB 3.47Å; E582-K586 PolarHBondContact O-N 2.86Å
583	E	86.7	Confident	83.6	Confident	59 Å²	59	103.3 Å²	103.3	28%	0.276	49%	0.49	S	S	.	.	H	α-helix	trans	-63.5	-39.4	170.2	-80.5	-169	173.8	0	0	112.3	R579 Q580 K586 R587	R579-E583 IonicContact CZ-OE1 2.75Å; R579-E583 IonicContact NH1-OE1 2.66Å; R579-E583 PolarHBondContact NH1-OE1 3.23Å; R579-E583 IonicContact NH1-OE2 2.94Å; R579-E583 WeakPolarHBondContact O-CB 3.49Å; R579-E583 WeakPolarHBondContact O-CG 3.47Å; R579-E583 PolarHBondContact O-N 2.71Å; Q580-E583 PolarHBondContact O-N 3.29Å; E583-K586 PolarHBondContact O-N 3.33Å; E583-R587 WeakPolarHBondContact O-CB 3.48Å; E583-R587 WeakPolarHBondContact O-CG 3.29Å; E583-R587 PolarHBondContact O-N 2.87Å; E583-R587 IonicContact OE1-NH2 2.66Å; E583-R587 IonicContact OE2-CZ 2.67Å; E583-R587 IonicContact OE2-NH1 3.68Å; E583-R587 PolarHBondContact OE2-NH1 2.92Å; E583-R587 IonicContact OE2-NH2 3.43Å; E583-R587 PolarHBondContact OE2-NH2 2.75Å
584	Q	83.5	Confident	83.1	Confident	100 Å²	100	102.4 Å²	102.4	47%	0.467	49%	0.488	S	S	.	.	H	α-helix	trans	-62.4	-45.2	174.1	-80.9	-92.1	6.1	0	0	111.1	Q580 L581 R587 K588	Q580-Q584 VanDerWaalsContact O-CB 3.3Å; Q580-Q584 WeakPolarHBondContact O-CB 3.49Å; Q580-Q584 WeakPolarHBondContact O-CG 3.46Å; Q580-Q584 PolarHBondContact O-N 3.41Å; L581-Q584 WeakPolarHBondContact O-CB 3.28Å; L581-Q584 PolarHBondContact O-N 2.84Å; Q584-R587 PolarHBondContact O-N 2.87Å; Q584-K588 VanDerWaalsContact O-CB 3.31Å; Q584-K588 WeakPolarHBondContact O-CB 3.35Å; Q584-K588 VanDerWaalsContact O-CG 3.25Å; Q584-K588 WeakPolarHBondContact O-CG 3.39Å; Q584-K588 PolarHBondContact O-N 2.67Å
585	I	83.6	Confident	83	Confident	76 Å²	76	107 Å²	107	39%	0.39	50%	0.5	S	S	.	.	H	α-helix	trans	-63.9	-46.4	176	-70.9	164.4	0	0	0	109.8	L581 E582 R587 K588 Q589	L581-I585 HydrophobicContact CD1-CD1 4.33Å; L581-I585 HydrophobicContact CG-CD1 4.06Å; L581-I585 WeakPolarHBondContact O-CB 3.45Å; L581-I585 VanDerWaalsContact O-CG1 3.24Å; L581-I585 WeakPolarHBondContact O-CG1 3.48Å; L581-I585 PolarHBondContact O-N 3.5Å; E582-I585 PolarHBondContact O-N 3.39Å; I585-R587 PolarHBondContact O-N 3.04Å; I585-K588 PolarHBondContact O-N 3.36Å; I585-Q589 HydrophobicContact CG2-CG 4.23Å; I585-Q589 VanDerWaalsContact O-CB 3.31Å; I585-Q589 WeakPolarHBondContact O-CB 3.31Å; I585-Q589 VanDerWaalsContact O-CG 3.31Å; I585-Q589 WeakPolarHBondContact O-CG 3.18Å; I585-Q589 PolarHBondContact O-N 2.9Å
586	K	85.3	Confident	82.7	Confident	158 Å²	158	110 Å²	110	69%	0.687	50%	0.504	S	S	*	.	H	α-helix	trans	-66.3	-36.5	178.9	-165.6	169.9	-172.9	171.7	0	112.3	E582 E583 K590	E582-K586 WeakPolarHBondContact O-CB 3.47Å; E582-K586 PolarHBondContact O-N 2.86Å; E583-K586 PolarHBondContact O-N 3.33Å; K586-K590 WeakPolarHBondContact O-CB 3.34Å; K586-K590 PolarHBondContact O-N 3.43Å
587	R	81.8	Confident	82.1	Confident	148 Å²	148	109.8 Å²	109.8	56%	0.558	51%	0.513	S	S	*	.	H	α-helix	trans	-67.2	-42.4	170.8	-75.9	170.6	-177.7	124.6	11.7	111.6	E583 Q584 I585 S591	E583-R587 WeakPolarHBondContact O-CB 3.48Å; E583-R587 WeakPolarHBondContact O-CG 3.29Å; E583-R587 PolarHBondContact O-N 2.87Å; E583-R587 IonicContact OE1-NH2 2.66Å; E583-R587 IonicContact OE2-CZ 2.67Å; E583-R587 IonicContact OE2-NH1 3.68Å; E583-R587 PolarHBondContact OE2-NH1 2.92Å; E583-R587 IonicContact OE2-NH2 3.43Å; E583-R587 PolarHBondContact OE2-NH2 2.75Å; Q584-R587 PolarHBondContact O-N 2.87Å; I585-R587 PolarHBondContact O-N 3.04Å; R587-S591 VanDerWaalsContact O-CB 3.25Å; R587-S591 WeakPolarHBondContact O-CB 3.36Å; R587-S591 PolarHBondContact O-N 3.06Å
588	K	79.3	Confident	81.8	Confident	137 Å²	137	107.2 Å²	107.2	60%	0.596	51%	0.507	S	S	*	.	H	α-helix	trans	-67	-47.6	176.1	-76.7	174.4	-178.1	179	0	111.9	Q584 I585 S591 Q592	Q584-K588 VanDerWaalsContact O-CB 3.31Å; Q584-K588 WeakPolarHBondContact O-CB 3.35Å; Q584-K588 VanDerWaalsContact O-CG 3.25Å; Q584-K588 WeakPolarHBondContact O-CG 3.39Å; Q584-K588 PolarHBondContact O-N 2.67Å; I585-K588 PolarHBondContact O-N 3.36Å; K588-S591 PolarHBondContact O-N 2.66Å; K588-Q592 VanDerWaalsContact O-CB 3.22Å; K588-Q592 WeakPolarHBondContact O-CB 3.37Å; K588-Q592 PolarHBondContact O-N 2.84Å
589	Q	80.8	Confident	81.8	Confident	119 Å²	119	103.5 Å²	103.5	56%	0.556	50%	0.499	S	S	*	.	H	α-helix	trans	-60.8	-45.5	174.8	-75.5	177.6	-9	0	0	111.3	I585 Q592 A593	I585-Q589 HydrophobicContact CG2-CG 4.23Å; I585-Q589 VanDerWaalsContact O-CB 3.31Å; I585-Q589 WeakPolarHBondContact O-CB 3.31Å; I585-Q589 VanDerWaalsContact O-CG 3.31Å; I585-Q589 WeakPolarHBondContact O-CG 3.18Å; I585-Q589 PolarHBondContact O-N 2.9Å; Q589-Q592 PolarHBondContact O-N 2.88Å; Q589-A593 WeakPolarHBondContact O-CB 3.48Å; Q589-A593 PolarHBondContact O-N 3.19Å
590	K	80.1	Confident	81.5	Confident	136 Å²	136	99.8 Å²	99.8	59%	0.591	50%	0.495	S	S	*	.	H	α-helix	trans	-61.9	-48.8	174.4	-177.4	171.4	179.1	179.7	0	111.3	K586 Q592 A593 D594	K586-K590 WeakPolarHBondContact O-CB 3.34Å; K586-K590 PolarHBondContact O-N 3.43Å; K590-Q592 VanDerWaalsContact C-N 3.26Å; K590-Q592 PolarHBondContact O-N 3.47Å; K590-A593 CarbonylContact O-C 3.55Å; K590-A593 PolarHBondContact O-N 3.24Å; K590-A593 VanDerWaalsContact O-N 3.12Å; K590-D594 WeakPolarHBondContact CG-OD2 3.41Å; K590-D594 WeakPolarHBondContact O-CB 3.41Å; K590-D594 PolarHBondContact O-N 3.34Å
591	S	76	Confident	81.3	Confident	47 Å²	47	99.4 Å²	99.4	33%	0.329	50%	0.495	S	S	.	.	H	α-helix	trans	-61.3	-33.9	176.7	-170.2	0	0	0	0	112.7	R587 K588 R595	R587-S591 VanDerWaalsContact O-CB 3.25Å; R587-S591 WeakPolarHBondContact O-CB 3.36Å; R587-S591 PolarHBondContact O-N 3.06Å; K588-S591 PolarHBondContact O-N 2.66Å; S591-R595 VanDerWaalsContact O-CB 3.25Å; S591-R595 WeakPolarHBondContact O-CB 3.2Å; S591-R595 WeakPolarHBondContact O-CD 3.46Å; S591-R595 WeakPolarHBondContact O-CG 3.34Å; S591-R595 PolarHBondContact O-N 3.14Å
592	Q	80.8	Confident	81.2	Confident	99 Å²	99	101.3 Å²	101.3	46%	0.463	50%	0.499	S	S	.	.	H	α-helix	trans	-72.9	-36.6	175.1	-171.2	176.2	14.6	0	0	112.1	K588 Q589 K590 R596	K588-Q592 VanDerWaalsContact O-CB 3.22Å; K588-Q592 WeakPolarHBondContact O-CB 3.37Å; K588-Q592 PolarHBondContact O-N 2.84Å; Q589-Q592 PolarHBondContact O-N 2.88Å; K590-Q592 VanDerWaalsContact C-N 3.26Å; K590-Q592 PolarHBondContact O-N 3.47Å; Q592-R596 WeakPolarHBondContact O-CB 3.48Å; Q592-R596 VanDerWaalsContact O-CG 3.27Å; Q592-R596 WeakPolarHBondContact O-CG 3.32Å; Q592-R596 PolarHBondContact O-N 3.47Å
593	A	78.4	Confident	81.4	Confident	53 Å²	53	100.2 Å²	100.2	44%	0.438	49%	0.494	S	S	.	.	H	α-helix	trans	-68.1	-46.3	172.5	0	0	0	0	0	111.3	Q589 K590 R595 R596 A597	Q589-A593 WeakPolarHBondContact O-CB 3.48Å; Q589-A593 PolarHBondContact O-N 3.19Å; K590-A593 CarbonylContact O-C 3.55Å; K590-A593 PolarHBondContact O-N 3.24Å; K590-A593 VanDerWaalsContact O-N 3.12Å; A593-R595 VanDerWaalsContact C-N 3.32Å; A593-R595 PolarHBondContact O-N 2.87Å; A593-R596 PolarHBondContact O-N 3.1Å; A593-A597 WeakPolarHBondContact O-CB 3.45Å; A593-A597 PolarHBondContact O-N 3.36Å
594	D	78.3	Confident	81.2	Confident	90 Å²	90	98.6 Å²	98.6	48%	0.481	49%	0.487	S	S	.	.	H	α-helix	trans	-60.1	-41.3	174.9	-64.7	-23.6	0	0	0	110.7	K590 A598	K590-D594 WeakPolarHBondContact CG-OD2 3.41Å; K590-D594 WeakPolarHBondContact O-CB 3.41Å; K590-D594 PolarHBondContact O-N 3.34Å; D594-A598 VanDerWaalsContact O-CB 3.22Å; D594-A598 WeakPolarHBondContact O-CB 3.37Å; D594-A598 PolarHBondContact O-N 2.9Å
595	R	79.5	Confident	81.1	Confident	184 Å²	184	99.9 Å²	99.9	69%	0.694	49%	0.493	S	S	*	.	H	α-helix	trans	-66.2	-41.2	173.3	-76.7	169.9	-174.6	-167.5	1.6	112.9	S591 A593 A598 A599	S591-R595 VanDerWaalsContact O-CB 3.25Å; S591-R595 WeakPolarHBondContact O-CB 3.2Å; S591-R595 WeakPolarHBondContact O-CD 3.46Å; S591-R595 WeakPolarHBondContact O-CG 3.34Å; S591-R595 PolarHBondContact O-N 3.14Å; A593-R595 VanDerWaalsContact C-N 3.32Å; A593-R595 PolarHBondContact O-N 2.87Å; R595-A598 PolarHBondContact O-N 3.45Å; R595-A599 WeakPolarHBondContact O-CB 3.26Å; R595-A599 PolarHBondContact O-N 2.92Å
596	R	81.3	Confident	81.3	Confident	177 Å²	177	102 Å²	102	67%	0.668	50%	0.501	S	S	*	.	H	α-helix	trans	-66.7	-41.3	175.6	-79.7	172.2	169.9	172.2	-4.2	111.8	Q592 A593 A599 G600	Q592-R596 WeakPolarHBondContact O-CB 3.48Å; Q592-R596 VanDerWaalsContact O-CG 3.27Å; Q592-R596 WeakPolarHBondContact O-CG 3.32Å; Q592-R596 PolarHBondContact O-N 3.47Å; A593-R596 PolarHBondContact O-N 3.1Å; R596-A599 PolarHBondContact O-N 3.42Å; R596-G600 PolarHBondContact O-N 2.89Å
597	A	78.9	Confident	81.2	Confident	64 Å²	64	94.8 Å²	94.8	53%	0.529	47%	0.471	S	S	.	.	H	α-helix	trans	-65.6	-39.7	174.4	0	0	0	0	0	111.7	A593 L601	A593-A597 WeakPolarHBondContact O-CB 3.45Å; A593-A597 PolarHBondContact O-N 3.36Å; A597-L601 WeakPolarHBondContact O-CB 3.28Å; A597-L601 PolarHBondContact O-N 2.81Å
598	A	81.3	Confident	81.3	Confident	52 Å²	52	92.6 Å²	92.6	43%	0.43	47%	0.47	S	S	.	.	H	α-helix	trans	-69.6	-31.8	174	0	0	0	0	0	113.1	D594 R595 K602	D594-A598 VanDerWaalsContact O-CB 3.22Å; D594-A598 WeakPolarHBondContact O-CB 3.37Å; D594-A598 PolarHBondContact O-N 2.9Å; R595-A598 PolarHBondContact O-N 3.45Å; A598-K602 WeakPolarHBondContact O-CG 3.33Å; A598-K602 PolarHBondContact O-N 3.43Å; A598-K602 VanDerWaalsContact O-N 3.16Å
599	A	81.2	Confident	81.8	Confident	41 Å²	41	90.5 Å²	90.5	34%	0.339	46%	0.463	S	S	.	.	H	α-helix	trans	-68.3	-55.2	172	0	0	0	0	0	110.9	R595 R596 L601 K602 E603	R595-A599 WeakPolarHBondContact O-CB 3.26Å; R595-A599 PolarHBondContact O-N 2.92Å; R596-A599 PolarHBondContact O-N 3.42Å; A599-L601 VanDerWaalsContact C-N 3.27Å; A599-L601 PolarHBondContact O-N 2.89Å; A599-K602 CarbonylContact O-C 3.56Å; A599-K602 WeakPolarHBondContact O-CA 3.37Å; A599-K602 WeakPolarHBondContact O-CB 3.32Å; A599-K602 PolarHBondContact O-N 3.47Å; A599-E603 WeakPolarHBondContact O-CG 3.44Å; A599-E603 PolarHBondContact O-N 3.21Å
600	G	81.8	Confident	82.1	Confident	32 Å²	32	89 Å²	89	33%	0.33	46%	0.455	S	S	.	.	H	α-helix	trans	-59.5	-34.3	177.2	0	0	0	0	0	113.3	R596 E603 L604	R596-G600 PolarHBondContact O-N 2.89Å; G600-E603 PolarHBondContact O-N 3.12Å; G600-L604 WeakPolarHBondContact O-CB 3.33Å; G600-L604 PolarHBondContact O-N 3.44Å
601	L	82.4	Confident	82.2	Confident	77 Å²	77	85.2 Å²	85.2	40%	0.403	45%	0.446	S	S	.	.	H	α-helix	trans	-70.9	-28.9	173.9	-170.8	144.2	0	0	0	112.7	K450 A597 A599 Q605	K450-L601 HydrophobicContact CD-CD1 4.25Å; A597-L601 WeakPolarHBondContact O-CB 3.28Å; A597-L601 PolarHBondContact O-N 2.81Å; A599-L601 VanDerWaalsContact C-N 3.27Å; A599-L601 PolarHBondContact O-N 2.89Å; L601-Q605 VanDerWaalsContact O-CB 3.28Å; L601-Q605 WeakPolarHBondContact O-CB 3.28Å; L601-Q605 PolarHBondContact O-N 3.49Å
602	K	82.7	Confident	82.8	Confident	146 Å²	146	87.3 Å²	87.3	64%	0.635	45%	0.453	S	S	*	.	H	α-helix	trans	-75.5	-42.4	170.8	-80.1	-179.7	174.9	-171	0	112.4	A598 A599 Q605 Q606	A598-K602 WeakPolarHBondContact O-CG 3.33Å; A598-K602 PolarHBondContact O-N 3.43Å; A598-K602 VanDerWaalsContact O-N 3.16Å; A599-K602 CarbonylContact O-C 3.56Å; A599-K602 WeakPolarHBondContact O-CA 3.37Å; A599-K602 WeakPolarHBondContact O-CB 3.32Å; A599-K602 PolarHBondContact O-N 3.47Å; K602-Q605 CarbonylContact O-C 3.56Å; K602-Q605 PolarHBondContact O-N 3.16Å; K602-Q605 VanDerWaalsContact O-N 3.15Å; K602-Q606 VanDerWaalsContact O-CB 3.32Å; K602-Q606 WeakPolarHBondContact O-CB 3.38Å; K602-Q606 PolarHBondContact O-N 2.92Å
603	E	85.4	Confident	83.2	Confident	110 Å²	110	84.7 Å²	84.7	51%	0.514	44%	0.443	S	S	.	.	H	α-helix	trans	-59.7	-47.1	174.4	-71.3	161	-166.2	0	0	110.3	A599 G600 Q605 Q606 A607	A599-E603 WeakPolarHBondContact O-CG 3.44Å; A599-E603 PolarHBondContact O-N 3.21Å; G600-E603 PolarHBondContact O-N 3.12Å; E603-Q605 PolarHBondContact O-N 2.98Å; E603-Q606 PolarHBondContact O-N 2.88Å; E603-A607 WeakPolarHBondContact O-CB 3.44Å; E603-A607 PolarHBondContact O-N 2.83Å
604	L	82.6	Confident	83.7	Confident	24 Å²	24	87.5 Å²	87.5	13%	0.126	45%	0.446	C	S	.	.	H	α-helix	trans	-55	-47.5	169.3	166.8	59.3	0	0	0	112.6	V451 G600 Q606 A607 L608	V451-L604 HydrophobicContact CB-CD1 4.06Å; V451-L604 HydrophobicContact CB-CD2 4.33Å; V451-L604 HydrophobicContact CG1-CD1 3.77Å; V451-L604 WeakPolarHBondContact O-CD1 3.28Å; V451-L604 WeakPolarHBondContact O-CD2 3.4Å; G600-L604 WeakPolarHBondContact O-CB 3.33Å; G600-L604 PolarHBondContact O-N 3.44Å; L604-Q606 VanDerWaalsContact C-N 3.3Å; L604-Q606 PolarHBondContact O-N 2.87Å; L604-A607 PolarHBondContact O-N 3.4Å; L604-L608 VanDerWaalsContact O-CB 3.28Å; L604-L608 WeakPolarHBondContact O-CB 3.39Å; L604-L608 PolarHBondContact O-N 2.88Å
605	Q	82.6	Confident	84	Confident	127 Å²	127	86.1 Å²	86.1	59%	0.593	44%	0.443	S	S	*	.	H	α-helix	trans	-65.3	-36.1	179.6	-175.7	173.6	0.2	0	0	111.7	L601 K602 E603 Q609	L601-Q605 VanDerWaalsContact O-CB 3.28Å; L601-Q605 WeakPolarHBondContact O-CB 3.28Å; L601-Q605 PolarHBondContact O-N 3.49Å; K602-Q605 CarbonylContact O-C 3.56Å; K602-Q605 PolarHBondContact O-N 3.16Å; K602-Q605 VanDerWaalsContact O-N 3.15Å; E603-Q605 PolarHBondContact O-N 2.98Å; Q605-Q609 VanDerWaalsContact O-CB 3.3Å; Q605-Q609 WeakPolarHBondContact O-CB 3.24Å; Q605-Q609 PolarHBondContact O-N 3.43Å
606	Q	86.7	Confident	84.6	Confident	120 Å²	120	83.9 Å²	83.9	56%	0.561	44%	0.435	S	S	*	.	H	α-helix	trans	-70.8	-42.5	176.8	-178.3	172	-11.9	0	0	111.8	K602 E603 L604 Q609 Q610	K602-Q606 VanDerWaalsContact O-CB 3.32Å; K602-Q606 WeakPolarHBondContact O-CB 3.38Å; K602-Q606 PolarHBondContact O-N 2.92Å; E603-Q606 PolarHBondContact O-N 2.88Å; L604-Q606 VanDerWaalsContact C-N 3.3Å; L604-Q606 PolarHBondContact O-N 2.87Å; Q606-Q609 WeakPolarHBondContact O-CB 2.74Å; Q606-Q609 PolarHBondContact O-N 3.46Å; Q606-Q610 WeakPolarHBondContact O-CB 3.17Å; Q606-Q610 VanDerWaalsContact O-CG 3.29Å; Q606-Q610 WeakPolarHBondContact O-CG 3.17Å; Q606-Q610 PolarHBondContact O-N 2.86Å
607	A	84.1	Confident	84.9	Confident	8 Å²	8	80.5 Å²	80.5	7%	0.066	43%	0.427	C	S	.	.	H	α-helix	trans	-70.5	-34.5	176.5	0	0	0	0	0	112.5	T453 T454 E603 L604 Q610 S611	T453-A607 HydrophobicContact CG2-CB 3.62Å; T453-A607 VanDerWaalsContact OG1-CB 3.27Å; T453-A607 WeakPolarHBondContact OG1-CB 3.29Å; T454-A607 HydrophobicContact CG2-CB 4.18Å; E603-A607 WeakPolarHBondContact O-CB 3.44Å; E603-A607 PolarHBondContact O-N 2.83Å; L604-A607 PolarHBondContact O-N 3.4Å; A607-Q610 PolarHBondContact O-N 3.41Å; A607-S611 WeakPolarHBondContact O-CB 3.46Å; A607-S611 PolarHBondContact O-N 3.31Å
608	L	84	Confident	85.3	Confident	102 Å²	102	82.9 Å²	82.9	53%	0.534	43%	0.43	S	S	.	.	H	α-helix	trans	-64.3	-41.3	169.2	179.7	62.2	0	0	0	111.3	L604 S611 L612	L604-L608 VanDerWaalsContact O-CB 3.28Å; L604-L608 WeakPolarHBondContact O-CB 3.39Å; L604-L608 PolarHBondContact O-N 2.88Å; L608-S611 PolarHBondContact O-N 2.88Å; L608-L612 HydrophobicContact CD1-CD1 4.42Å; L608-L612 HydrophobicContact CD1-CG 4.49Å; L608-L612 HydrophobicContact CG-CD1 4.2Å; L608-L612 WeakPolarHBondContact O-CB 3.48Å; L608-L612 VanDerWaalsContact O-CG 3.26Å; L608-L612 WeakPolarHBondContact O-CG 3.44Å; L608-L612 PolarHBondContact O-N 3.41Å
609	Q	88.6	Confident	85.5	Confident	93 Å²	93	87.7 Å²	87.7	44%	0.435	44%	0.441	S	S	.	.	H	α-helix	trans	-64	-45.3	175.2	-178.1	61.1	44	0	0	111.4	Q605 Q606 L612 D613	Q605-Q609 VanDerWaalsContact O-CB 3.3Å; Q605-Q609 WeakPolarHBondContact O-CB 3.24Å; Q605-Q609 PolarHBondContact O-N 3.43Å; Q606-Q609 WeakPolarHBondContact O-CB 2.74Å; Q606-Q609 PolarHBondContact O-N 3.46Å; Q609-L612 PolarHBondContact O-N 2.76Å; Q609-D613 PolarHBondContact NE2-OD1 3.43Å; Q609-D613 PolarHBondContact NE2-OD2 2.88Å; Q609-D613 WeakPolarHBondContact O-CB 3.16Å; Q609-D613 PolarHBondContact O-N 2.87Å
610	Q	88.4	Confident	86	Confident	86 Å²	86	90.4 Å²	90.4	40%	0.402	45%	0.447	S	S	.	.	H	α-helix	trans	-57.6	-49.3	174.2	-75.1	166.4	-28	0	0	111.2	Q606 A607 L612 D613 E614	Q606-Q610 WeakPolarHBondContact O-CB 3.17Å; Q606-Q610 VanDerWaalsContact O-CG 3.29Å; Q606-Q610 WeakPolarHBondContact O-CG 3.17Å; Q606-Q610 PolarHBondContact O-N 2.86Å; A607-Q610 PolarHBondContact O-N 3.41Å; Q610-L612 VanDerWaalsContact C-N 3.31Å; Q610-L612 PolarHBondContact O-N 3.22Å; Q610-D613 CarbonylContact O-C 3.41Å; Q610-D613 PolarHBondContact O-N 3.48Å; Q610-D613 VanDerWaalsContact O-N 3.1Å; Q610-E614 WeakPolarHBondContact O-CB 3.48Å; Q610-E614 VanDerWaalsContact O-CG 3.3Å; Q610-E614 WeakPolarHBondContact O-CG 3.37Å; Q610-E614 PolarHBondContact O-N 2.85Å
611	S	80.8	Confident	86.4	Confident	57 Å²	57	95.1 Å²	95.1	40%	0.399	46%	0.458	S	S	.	.	H	α-helix	trans	-61.1	-36.6	176.5	-175.5	0	0	0	0	112.9	A607 L608 C615	A607-S611 WeakPolarHBondContact O-CB 3.46Å; A607-S611 PolarHBondContact O-N 3.31Å; L608-S611 PolarHBondContact O-N 2.88Å; S611-C615 VanDerWaalsContact O-CB 3.29Å; S611-C615 WeakPolarHBondContact O-CB 3.45Å; S611-C615 PolarHBondContact O-N 3.34Å; S611-C615 PolarHBondContact O-SG 2.8Å
612	L	88.7	Confident	86.6	Confident	92 Å²	92	95.9 Å²	95.9	48%	0.482	46%	0.462	S	S	.	.	H	α-helix	trans	-70.5	-33.8	173.9	-74.1	170.1	0	0	0	113	L608 Q609 Q610 R616	L608-L612 HydrophobicContact CD1-CD1 4.42Å; L608-L612 HydrophobicContact CD1-CG 4.49Å; L608-L612 HydrophobicContact CG-CD1 4.2Å; L608-L612 WeakPolarHBondContact O-CB 3.48Å; L608-L612 VanDerWaalsContact O-CG 3.26Å; L608-L612 WeakPolarHBondContact O-CG 3.44Å; L608-L612 PolarHBondContact O-N 3.41Å; Q609-L612 PolarHBondContact O-N 2.76Å; Q610-L612 VanDerWaalsContact C-N 3.31Å; Q610-L612 PolarHBondContact O-N 3.22Å; L612-R616 PolarHBondContact O-N 3.39Å
613	D	90.4	Very high	86.9	Confident	44 Å²	44	91.2 Å²	91.2	24%	0.235	45%	0.451	C	S	.	.	H	α-helix	trans	-75.5	-37.5	176.7	-68.1	-28.5	0	0	0	111.5	Q609 Q610 R616 Q617	Q609-D613 PolarHBondContact NE2-OD1 3.43Å; Q609-D613 PolarHBondContact NE2-OD2 2.88Å; Q609-D613 WeakPolarHBondContact O-CB 3.16Å; Q609-D613 PolarHBondContact O-N 2.87Å; Q610-D613 CarbonylContact O-C 3.41Å; Q610-D613 PolarHBondContact O-N 3.48Å; Q610-D613 VanDerWaalsContact O-N 3.1Å; D613-R616 WeakPolarHBondContact O-CB 3.25Å; D613-R616 PolarHBondContact O-N 3.42Å; D613-R616 IonicContact OD1-CZ 3.04Å; D613-R616 IonicContact OD1-NH1 2.67Å; D613-R616 PolarHBondContact OD1-NH1 2.76Å; D613-R616 IonicContact OD1-NH2 2.63Å; D613-R616 PolarHBondContact OD1-NH2 3.32Å; D613-Q617 WeakPolarHBondContact O-CG 3.29Å; D613-Q617 PolarHBondContact O-N 2.66Å
614	E	89.1	Confident	87.2	Confident	111 Å²	111	91 Å²	91	52%	0.519	45%	0.449	S	S	.	.	H	α-helix	trans	-61.8	-47.5	168	-73.1	163.1	-166.8	0	0	111	Q610 R616 Q617 L618	Q610-E614 WeakPolarHBondContact O-CB 3.48Å; Q610-E614 VanDerWaalsContact O-CG 3.3Å; Q610-E614 WeakPolarHBondContact O-CG 3.37Å; Q610-E614 PolarHBondContact O-N 2.85Å; E614-R616 PolarHBondContact O-N 3.44Å; E614-Q617 PolarHBondContact O-N 2.78Å; E614-Q617 VanDerWaalsContact O-N 3.16Å; E614-L618 WeakPolarHBondContact O-CB 3.3Å; E614-L618 WeakPolarHBondContact O-CG 3.19Å; E614-L618 PolarHBondContact O-N 3.23Å
615	C	84.1	Confident	87.4	Confident	62 Å²	62	93.5 Å²	93.5	42%	0.419	47%	0.465	S	S	.	.	H	α-helix	trans	-59.7	-30	173.2	-74.4	0	0	0	0	112.6	S611 K619	S611-C615 VanDerWaalsContact O-CB 3.29Å; S611-C615 WeakPolarHBondContact O-CB 3.45Å; S611-C615 PolarHBondContact O-N 3.34Å; S611-C615 PolarHBondContact O-SG 2.8Å; C615-K619 WeakPolarHBondContact O-CB 3.47Å; C615-K619 VanDerWaalsContact O-CG 3.27Å; C615-K619 WeakPolarHBondContact O-CG 3.36Å; C615-K619 PolarHBondContact O-N 3.41Å
616	R	91	Very high	87.7	Confident	136 Å²	136	92.3 Å²	92.3	51%	0.513	46%	0.459	S	S	.	.	H	α-helix	trans	-73.5	-46.2	173.5	-162.2	-177	-50	106	19.2	111.3	L612 D613 E614 L618 K619 E620	L612-R616 PolarHBondContact O-N 3.39Å; D613-R616 WeakPolarHBondContact O-CB 3.25Å; D613-R616 PolarHBondContact O-N 3.42Å; D613-R616 IonicContact OD1-CZ 3.04Å; D613-R616 IonicContact OD1-NH1 2.67Å; D613-R616 PolarHBondContact OD1-NH1 2.76Å; D613-R616 IonicContact OD1-NH2 2.63Å; D613-R616 PolarHBondContact OD1-NH2 3.32Å; E614-R616 PolarHBondContact O-N 3.44Å; R616-L618 VanDerWaalsContact C-N 3.33Å; R616-L618 PolarHBondContact O-N 3.4Å; R616-K619 PolarHBondContact O-N 3.47Å; R616-E620 WeakPolarHBondContact O-CB 3.46Å; R616-E620 PolarHBondContact O-N 3.17Å
617	Q	88.4	Confident	87.9	Confident	107 Å²	107	89.3 Å²	89.3	50%	0.5	46%	0.455	S	S	.	.	H	α-helix	trans	-62	-38.5	176.6	-71.4	174.5	42	0	0	112.5	D613 E614 E620 K621	D613-Q617 WeakPolarHBondContact O-CG 3.29Å; D613-Q617 PolarHBondContact O-N 2.66Å; E614-Q617 PolarHBondContact O-N 2.78Å; E614-Q617 VanDerWaalsContact O-N 3.16Å; Q617-E620 PolarHBondContact O-N 2.85Å; Q617-K621 WeakPolarHBondContact O-CB 3.47Å; Q617-K621 VanDerWaalsContact O-CG 3.3Å; Q617-K621 WeakPolarHBondContact O-CG 3.49Å; Q617-K621 PolarHBondContact O-N 3.29Å
618	L	87.2	Confident	88.2	Confident	114 Å²	114	94.9 Å²	94.9	60%	0.597	48%	0.48	S	S	*	.	H	α-helix	trans	-66.3	-40.9	175.3	-71.5	171.7	0	0	0	111.6	E614 R616 K621 L622	E614-L618 WeakPolarHBondContact O-CB 3.3Å; E614-L618 WeakPolarHBondContact O-CG 3.19Å; E614-L618 PolarHBondContact O-N 3.23Å; R616-L618 VanDerWaalsContact C-N 3.33Å; R616-L618 PolarHBondContact O-N 3.4Å; L618-K621 PolarHBondContact O-N 2.92Å; L618-L622 WeakPolarHBondContact O-CB 3.46Å; L618-L622 PolarHBondContact O-N 3.4Å
619	K	85.8	Confident	88.4	Confident	152 Å²	152	95 Å²	95	66%	0.661	48%	0.48	S	S	*	.	H	α-helix	trans	-67.3	-35.9	173.3	-74.8	175.7	179.6	-175.2	0	113	C615 R616 L622 A623	C615-K619 WeakPolarHBondContact O-CB 3.47Å; C615-K619 VanDerWaalsContact O-CG 3.27Å; C615-K619 WeakPolarHBondContact O-CG 3.36Å; C615-K619 PolarHBondContact O-N 3.41Å; R616-K619 PolarHBondContact O-N 3.47Å; K619-L622 PolarHBondContact O-N 2.74Å; K619-A623 WeakPolarHBondContact O-CB 3.25Å; K619-A623 PolarHBondContact O-N 2.78Å
620	E	91.1	Very high	88.4	Confident	98 Å²	98	95.3 Å²	95.3	46%	0.458	49%	0.485	S	S	.	.	H	α-helix	trans	-70.4	-38.2	176.2	-165	-168.5	136.8	0	0	111.7	R616 Q617 K624	R616-E620 WeakPolarHBondContact O-CB 3.46Å; R616-E620 PolarHBondContact O-N 3.17Å; Q617-E620 PolarHBondContact O-N 2.85Å; E620-K624 WeakPolarHBondContact O-CB 3.21Å; E620-K624 VanDerWaalsContact O-CG 3.3Å; E620-K624 WeakPolarHBondContact O-CG 3.34Å; E620-K624 PolarHBondContact O-N 2.96Å; E620-K624 WeakPolarHBondContact OE1-CE 3.41Å; E620-K624 IonicContact OE1-NZ 3.87Å; E620-K624 PolarHBondContact OE1-NZ 3.02Å
621	K	89.8	Confident	88.5	Confident	132 Å²	132	93.8 Å²	93.8	57%	0.574	48%	0.484	S	S	*	.	H	α-helix	trans	-63.4	-45.7	170.3	-75.6	173.6	179.7	-179.5	0	111.5	Q617 L618 K624 T625	Q617-K621 WeakPolarHBondContact O-CB 3.47Å; Q617-K621 VanDerWaalsContact O-CG 3.3Å; Q617-K621 WeakPolarHBondContact O-CG 3.49Å; Q617-K621 PolarHBondContact O-N 3.29Å; L618-K621 PolarHBondContact O-N 2.92Å; K621-K624 PolarHBondContact O-N 2.88Å; K621-T625 PolarHBondContact O-N 3.3Å; K621-T625 PolarHBondContact O-OG1 3.5Å
622	L	86.7	Confident	88.9	Confident	92 Å²	92	93.5 Å²	93.5	48%	0.482	48%	0.482	S	S	.	.	H	α-helix	trans	-58.2	-49.6	175.5	-178	65	0	0	0	111.1	L618 K619 K624 T625 E626	L618-L622 WeakPolarHBondContact O-CB 3.46Å; L618-L622 PolarHBondContact O-N 3.4Å; K619-L622 PolarHBondContact O-N 2.74Å; L622-K624 VanDerWaalsContact C-N 3.27Å; L622-K624 PolarHBondContact O-N 3.06Å; L622-T625 WeakPolarHBondContact CA-OG1 3.5Å; L622-T625 CarbonylContact O-C 3.44Å; L622-T625 PolarHBondContact O-N 3.29Å; L622-T625 VanDerWaalsContact O-N 3.15Å; L622-T625 PolarHBondContact O-OG1 2.85Å; L622-E626 HydrophobicContact CD1-CG 4.47Å; L622-E626 HydrophobicContact CG-CG 4.45Å; L622-E626 WeakPolarHBondContact O-CB 3.36Å; L622-E626 WeakPolarHBondContact O-CG 3.48Å; L622-E626 PolarHBondContact O-N 2.72Å
623	A	89.5	Confident	88.9	Confident	49 Å²	49	92.6 Å²	92.6	41%	0.405	48%	0.48	S	S	.	.	H	α-helix	trans	-62.3	-31.2	177.5	0	0	0	0	0	113.2	K619 A627	K619-A623 WeakPolarHBondContact O-CB 3.25Å; K619-A623 PolarHBondContact O-N 2.78Å; A623-A627 VanDerWaalsContact O-CB 3.27Å; A623-A627 WeakPolarHBondContact O-CB 3.47Å; A623-A627 PolarHBondContact O-N 3.42Å
624	K	91.9	Very high	88.9	Confident	106 Å²	106	97.1 Å²	97.1	46%	0.461	50%	0.5	S	S	.	.	H	α-helix	trans	-69.5	-46.9	171.4	-76.2	169.7	-175	171.7	0	111.5	E620 K621 L622 E626 A627 E628	E620-K624 WeakPolarHBondContact O-CB 3.21Å; E620-K624 VanDerWaalsContact O-CG 3.3Å; E620-K624 WeakPolarHBondContact O-CG 3.34Å; E620-K624 PolarHBondContact O-N 2.96Å; E620-K624 WeakPolarHBondContact OE1-CE 3.41Å; E620-K624 IonicContact OE1-NZ 3.87Å; E620-K624 PolarHBondContact OE1-NZ 3.02Å; K621-K624 PolarHBondContact O-N 2.88Å; L622-K624 VanDerWaalsContact C-N 3.27Å; L622-K624 PolarHBondContact O-N 3.06Å; K624-E626 VanDerWaalsContact C-N 3.29Å; K624-E626 PolarHBondContact O-N 3.4Å; K624-A627 CarbonylContact O-C 3.56Å; K624-A627 PolarHBondContact O-N 2.76Å; K624-A627 VanDerWaalsContact O-N 3.12Å; K624-E628 WeakPolarHBondContact O-CB 3.23Å; K624-E628 VanDerWaalsContact O-CG 3.27Å; K624-E628 WeakPolarHBondContact O-CG 3.32Å; K624-E628 PolarHBondContact O-N 2.88Å
625	T	87.8	Confident	89	Confident	76 Å²	76	96.7 Å²	96.7	47%	0.466	50%	0.498	S	S	.	.	H	α-helix	trans	-65.5	-30.4	174.7	51.1	0	0	0	0	113.1	K621 L622 L629	K621-T625 PolarHBondContact O-N 3.3Å; K621-T625 PolarHBondContact O-OG1 3.5Å; L622-T625 WeakPolarHBondContact CA-OG1 3.5Å; L622-T625 CarbonylContact O-C 3.44Å; L622-T625 PolarHBondContact O-N 3.29Å; L622-T625 VanDerWaalsContact O-N 3.15Å; L622-T625 PolarHBondContact O-OG1 2.85Å; T625-L629 WeakPolarHBondContact O-CB 3.33Å; T625-L629 PolarHBondContact O-N 3.47Å
626	E	87.8	Confident	89.1	Confident	101 Å²	101	98.2 Å²	98.2	47%	0.472	50%	0.501	S	S	.	.	H	α-helix	trans	-70.8	-38.3	171.1	-73.7	173.8	165.8	0	0	111.2	L622 K624 N630	L622-E626 HydrophobicContact CD1-CG 4.47Å; L622-E626 HydrophobicContact CG-CG 4.45Å; L622-E626 WeakPolarHBondContact O-CB 3.36Å; L622-E626 WeakPolarHBondContact O-CG 3.48Å; L622-E626 PolarHBondContact O-N 2.72Å; K624-E626 VanDerWaalsContact C-N 3.29Å; K624-E626 PolarHBondContact O-N 3.4Å; E626-N630 VanDerWaalsContact O-CB 3.29Å; E626-N630 WeakPolarHBondContact O-CB 3.44Å; E626-N630 PolarHBondContact O-N 2.91Å; E626-N630 PolarHBondContact O-ND2 2.93Å
627	A	91.1	Very high	89.2	Confident	58 Å²	58	96.4 Å²	96.4	48%	0.479	50%	0.497	S	S	.	.	H	α-helix	trans	-70.4	-39.6	174.8	0	0	0	0	0	112.5	A623 K624 N630 S631	A623-A627 VanDerWaalsContact O-CB 3.27Å; A623-A627 WeakPolarHBondContact O-CB 3.47Å; A623-A627 PolarHBondContact O-N 3.42Å; K624-A627 CarbonylContact O-C 3.56Å; K624-A627 PolarHBondContact O-N 2.76Å; K624-A627 VanDerWaalsContact O-N 3.12Å; A627-N630 PolarHBondContact O-N 3.14Å; A627-S631 WeakPolarHBondContact O-CB 3.47Å; A627-S631 PolarHBondContact O-N 3.45Å
628	E	90.6	Very high	89.2	Confident	125 Å²	125	94.4 Å²	94.4	58%	0.584	49%	0.488	S	S	*	.	H	α-helix	trans	-66.3	-41.1	173.4	-71.7	159.3	-162.8	0	0	110.9	K624 S631 S632	K624-E628 WeakPolarHBondContact O-CB 3.23Å; K624-E628 VanDerWaalsContact O-CG 3.27Å; K624-E628 WeakPolarHBondContact O-CG 3.32Å; K624-E628 PolarHBondContact O-N 2.88Å; E628-S631 PolarHBondContact O-N 2.89Å; E628-S632 WeakPolarHBondContact O-CB 3.34Å; E628-S632 PolarHBondContact O-N 2.9Å
629	L	88.2	Confident	89.2	Confident	104 Å²	104	93.3 Å²	93.3	55%	0.545	49%	0.486	S	S	.	.	H	α-helix	trans	-63.4	-46.6	172.1	-179.9	63.5	0	0	0	111	T625 S631 S632 V633	T625-L629 WeakPolarHBondContact O-CB 3.33Å; T625-L629 PolarHBondContact O-N 3.47Å; L629-S631 PolarHBondContact O-N 2.84Å; L629-S632 WeakPolarHBondContact CA-OG 3.35Å; L629-S632 CarbonylContact O-C 3.51Å; L629-S632 WeakPolarHBondContact O-CA 3.46Å; L629-S632 PolarHBondContact O-N 3.28Å; L629-S632 VanDerWaalsContact O-N 3.07Å; L629-S632 PolarHBondContact O-OG 2.78Å; L629-V633 HydrophobicContact CD1-CG2 4.42Å; L629-V633 WeakPolarHBondContact O-CG2 3.2Å; L629-V633 PolarHBondContact O-N 3.27Å
630	N	88.2	Confident	89.3	Confident	99 Å²	99	88.5 Å²	88.5	53%	0.529	47%	0.465	S	S	.	.	H	α-helix	trans	-61.9	-42.4	176.4	-76.1	-48.2	0	0	0	111.6	E626 A627 S632 V633 E634	E626-N630 VanDerWaalsContact O-CB 3.29Å; E626-N630 WeakPolarHBondContact O-CB 3.44Å; E626-N630 PolarHBondContact O-N 2.91Å; E626-N630 PolarHBondContact O-ND2 2.93Å; A627-N630 PolarHBondContact O-N 3.14Å; N630-S632 VanDerWaalsContact C-N 3.3Å; N630-S632 PolarHBondContact O-N 2.91Å; N630-V633 CarbonylContact O-C 3.57Å; N630-V633 PolarHBondContact O-N 2.85Å; N630-E634 WeakPolarHBondContact O-CB 3.36Å; N630-E634 PolarHBondContact O-N 2.87Å
631	S	91.1	Very high	89.2	Confident	55 Å²	55	86.5 Å²	86.5	39%	0.385	46%	0.456	S	S	.	.	H	α-helix	trans	-57	-45.5	170.1	-164.5	0	0	0	0	110.2	A627 E628 L629 V633 E634 E635	A627-S631 WeakPolarHBondContact O-CB 3.47Å; A627-S631 PolarHBondContact O-N 3.45Å; E628-S631 PolarHBondContact O-N 2.89Å; L629-S631 PolarHBondContact O-N 2.84Å; S631-V633 VanDerWaalsContact C-N 3.33Å; S631-V633 PolarHBondContact O-N 2.97Å; S631-E634 CarbonylContact O-C 3.56Å; S631-E634 VanDerWaalsContact O-C 3.27Å; S631-E634 WeakPolarHBondContact O-CA 3.48Å; S631-E634 PolarHBondContact O-N 2.92Å; S631-E635 WeakPolarHBondContact O-CA 3.36Å; S631-E635 VanDerWaalsContact O-CD 3.22Å; S631-E635 PolarHBondContact O-N 3.48Å; S631-E635 VanDerWaalsContact O-OE1 3.1Å; S631-E635 PolarHBondContact OG-OE1 2.68Å
632	S	88.6	Confident	89.2	Confident	51 Å²	51	81.8 Å²	81.8	36%	0.357	44%	0.436	S	S	.	.	H	α-helix	trans	-70.4	-21.5	179.5	77.5	0	0	0	0	114.8	E628 L629 N630 L636	E628-S632 WeakPolarHBondContact O-CB 3.34Å; E628-S632 PolarHBondContact O-N 2.9Å; L629-S632 WeakPolarHBondContact CA-OG 3.35Å; L629-S632 CarbonylContact O-C 3.51Å; L629-S632 WeakPolarHBondContact O-CA 3.46Å; L629-S632 PolarHBondContact O-N 3.28Å; L629-S632 VanDerWaalsContact O-N 3.07Å; L629-S632 PolarHBondContact O-OG 2.78Å; N630-S632 VanDerWaalsContact C-N 3.3Å; N630-S632 PolarHBondContact O-N 2.91Å; S632-L636 WeakPolarHBondContact O-CA 3.26Å; S632-L636 WeakPolarHBondContact O-CB 3.3Å; S632-L636 PolarHBondContact O-N 3.32Å
633	V	88.4	Confident	89.3	Confident	73 Å²	73	85.3 Å²	85.3	44%	0.442	44%	0.443	S	S	.	.	H	α-helix	trans	-92.6	-8.5	168.1	82.4	0	0	0	0	112.9	L629 N630 S631 L636 F637	L629-V633 HydrophobicContact CD1-CG2 4.42Å; L629-V633 WeakPolarHBondContact O-CG2 3.2Å; L629-V633 PolarHBondContact O-N 3.27Å; N630-V633 CarbonylContact O-C 3.57Å; N630-V633 PolarHBondContact O-N 2.85Å; S631-V633 VanDerWaalsContact C-N 3.33Å; S631-V633 PolarHBondContact O-N 2.97Å; V633-L636 WeakPolarHBondContact O-CA 3.38Å; V633-F637 VanDerWaalsContact O-CA 3.23Å; V633-F637 WeakPolarHBondContact O-CA 3.39Å; V633-F637 WeakPolarHBondContact O-CB 3.38Å
634	E	90.8	Very high	89.3	Confident	138 Å²	138	86.3 Å²	86.3	65%	0.645	44%	0.439	S	S	*	.	H	α-helix	trans	-89.3	-17.3	160	-157.8	158	-148.1	0	0	111.3	N630 S631 F637 Q638	N630-E634 WeakPolarHBondContact O-CB 3.36Å; N630-E634 PolarHBondContact O-N 2.87Å; S631-E634 CarbonylContact O-C 3.56Å; S631-E634 VanDerWaalsContact O-C 3.27Å; S631-E634 WeakPolarHBondContact O-CA 3.48Å; S631-E634 PolarHBondContact O-N 2.92Å; E634-F637 VanDerWaalsContact C-CA 3.47Å; E634-F637 CarbonylContact O-C 3.59Å; E634-F637 WeakPolarHBondContact O-CA 3.43Å; E634-Q638 WeakPolarHBondContact O-CB 3.37Å; E634-Q638 PolarHBondContact O-N 2.89Å
635	E	91.8	Very high	89.1	Confident	103 Å²	103	85.2 Å²	85.2	48%	0.481	44%	0.436	S	S	.	.	H	α-helix	trans	-70.3	-60.5	163.4	55.2	57	-158.2	0	0	112.1	S631 Q638 V639	S631-E635 WeakPolarHBondContact O-CA 3.36Å; S631-E635 VanDerWaalsContact O-CD 3.22Å; S631-E635 PolarHBondContact O-N 3.48Å; S631-E635 VanDerWaalsContact O-OE1 3.1Å; S631-E635 PolarHBondContact OG-OE1 2.68Å; E635-Q638 HydrophobicContact CB-CB 3.87Å; E635-Q638 CarbonylContact O-C 3.6Å; E635-Q638 VanDerWaalsContact O-CA 3.23Å; E635-Q638 WeakPolarHBondContact O-CA 3.17Å; E635-Q638 PolarHBondContact O-N 2.58Å; E635-V639 PolarHBondContact O-N 3.01Å; E635-V639 VanDerWaalsContact O-N 3.15Å
636	L	86.3	Confident	88.9	Confident	93 Å²	93	83.2 Å²	83.2	49%	0.487	43%	0.425	S	S	.	.	H	α-helix		30.7	-118.5	120.3	-70.6	134.8	0	0	0	118.4	S632 V633 V639 Y1090	S632-L636 WeakPolarHBondContact O-CA 3.26Å; S632-L636 WeakPolarHBondContact O-CB 3.3Å; S632-L636 PolarHBondContact O-N 3.32Å; V633-L636 WeakPolarHBondContact O-CA 3.38Å; L636-V639 HydrophobicContact CG-CG1 4.35Å; L636-V639 WeakPolarHBondContact O-CG1 3.17Å; L636-V639 PolarHBondContact O-N 3.26Å; L636-Y1090 CarbonylContact C-O 3.52Å
637	F	91.6	Very high	88.8	Confident	98 Å²	98	83.3 Å²	83.3	43%	0.43	43%	0.425	S	S	.	.	T	Hydrogen-bonded Turn		82.5	-53.7	56.3	-86.3	-69.8	0	0	0	109.1	V633 E634 C1089 Y1090 L1091	V633-F637 VanDerWaalsContact O-CA 3.23Å; V633-F637 WeakPolarHBondContact O-CA 3.39Å; V633-F637 WeakPolarHBondContact O-CB 3.38Å; E634-F637 VanDerWaalsContact C-CA 3.47Å; E634-F637 CarbonylContact O-C 3.59Å; E634-F637 WeakPolarHBondContact O-CA 3.43Å; F637-C1089 VanDerWaalsContact CD2-C 3.46Å; F637-C1089 PolarHBondContact N-O 3.21Å; F637-Y1090 CarbonylContact C-O 3.6Å; F637-Y1090 WeakPolarHBondContact CA-O 3.28Å; F637-Y1090 HydrophobicContact CE2-CG 4.43Å; F637-Y1090 VanDerWaalsContact N-C 3.3Å; F637-Y1090 PolarHBondContact N-O 3.37Å; F637-Y1090 CarbonylContact O-C 3.56Å; F637-L1091 HydrophobicContact CE1-CD2 4.08Å; F637-L1091 VanDerWaalsContact O-CA 3.23Å; F637-L1091 WeakPolarHBondContact O-CA 2.99Å; F637-L1091 WeakPolarHBondContact O-CB 2.98Å; F637-L1091 PolarHBondContact O-N 3.39Å
638	Q	89.3	Confident	88.4	Confident	65 Å²	65	82.8 Å²	82.8	30%	0.304	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.9	32.7	174.6	-133.3	37.5	42.3	0	0	110.4	E634 E635 E642 Y1090 L1091 N1092	E634-Q638 WeakPolarHBondContact O-CB 3.37Å; E634-Q638 PolarHBondContact O-N 2.89Å; E635-Q638 HydrophobicContact CB-CB 3.87Å; E635-Q638 CarbonylContact O-C 3.6Å; E635-Q638 VanDerWaalsContact O-CA 3.23Å; E635-Q638 WeakPolarHBondContact O-CA 3.17Å; E635-Q638 PolarHBondContact O-N 2.58Å; Q638-E642 PolarHBondContact NE2-OE1 2.67Å; Q638-Y1090 PolarHBondContact N-O 2.85Å; Q638-L1091 CarbonylContact C-O 3.52Å; Q638-L1091 VanDerWaalsContact CA-CA 3.5Å; Q638-N1092 HydrophobicContact CB-CB 3.98Å; Q638-N1092 HydrophobicContact CG-CB 3.52Å; Q638-N1092 PolarHBondContact NE2-OD1 3.08Å; Q638-N1092 WeakPolarHBondContact O-CA 3.31Å; Q638-N1092 WeakPolarHBondContact O-CB 3.25Å
639	V	87.3	Confident	88.5	Confident	91 Å²	91	81.7 Å²	81.7	55%	0.552	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-137	-15	160.9	69.3	0	0	0	0	117.5	E635 L636 Y1090 L1091	E635-V639 PolarHBondContact O-N 3.01Å; E635-V639 VanDerWaalsContact O-N 3.15Å; L636-V639 HydrophobicContact CG-CG1 4.35Å; L636-V639 WeakPolarHBondContact O-CG1 3.17Å; L636-V639 PolarHBondContact O-N 3.26Å; V639-Y1090 PolarHBondContact N-O 3.46Å; V639-L1091 CarbonylContact C-O 3.58Å; V639-L1091 WeakPolarHBondContact CA-O 3.13Å; V639-L1091 PolarHBondContact N-O 2.9Å; V639-L1091 VanDerWaalsContact N-O 3.16Å
640	K	88.6	Confident	88.4	Confident	52 Å²	52	81.2 Å²	81.2	23%	0.226	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-35.9	174.7	175.8	-45.6	141.7	-90.2	0	119.1	R643 E644 Y1090 L1091	K640-R643 WeakPolarHBondContact O-CA 3.36Å; K640-E644 IonicContact NZ-OE2 3.38Å; K640-E644 PolarHBondContact NZ-OE2 3.28Å; K640-E644 PolarHBondContact O-N 2.94Å; K640-Y1090 VanDerWaalsContact CA-C 3.42Å; K640-Y1090 WeakPolarHBondContact CA-O 3.23Å; K640-Y1090 HydrophobicContact CD-CD2 3.69Å; K640-Y1090 HydrophobicContact CD-CE2 3.74Å; K640-Y1090 HydrophobicContact CD-CG 4.32Å; K640-Y1090 PolarHBondContact N-O 3.15Å; K640-Y1090 PolarHBondContact NZ-OH 3.5Å; K640-L1091 CarbonylContact C-O 3.57Å; K640-L1091 PolarHBondContact N-O 3.2Å
641	M	89.1	Confident	88.5	Confident	56 Å²	56	81.8 Å²	81.8	28%	0.276	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	-125.8	-26.4	-164.1	-155.8	-163	91.1	0	0	116.7	E644 Q645 Y1090 L1091	M641-E644 VanDerWaalsContact C-N 3.32Å; M641-E644 HydrophobicContact CB-CB 4.22Å; M641-E644 HydrophobicContact CG-CB 3.6Å; M641-E644 HydrophobicContact CG-CG 4.35Å; M641-E644 CarbonylContact O-C 3.52Å; M641-E644 WeakPolarHBondContact O-CA 3.2Å; M641-E644 WeakPolarHBondContact O-CB 3.36Å; M641-E644 PolarHBondContact O-N 3.24Å; M641-Q645 VanDerWaalsContact O-CB 3.25Å; M641-Q645 WeakPolarHBondContact O-CB 3.47Å; M641-Q645 WeakPolarHBondContact O-CG 3.39Å; M641-Q645 PolarHBondContact O-N 3.34Å; M641-Q645 PolarHBondContact O-OE1 3.04Å; M641-Y1090 HydrophobicContact CB-CD1 3.53Å; M641-Y1090 HydrophobicContact CB-CE1 4Å; M641-Y1090 HydrophobicContact CB-CG 4.3Å; M641-Y1090 HydrophobicContact CG-CD1 3.65Å; M641-Y1090 HydrophobicContact CG-CE1 3.67Å; M641-Y1090 HydrophobicContact SD-CD1 3.67Å; M641-Y1090 HydrophobicContact SD-CE1 3.8Å; M641-L1091 HydrophobicContact CB-CB 4.27Å; M641-L1091 HydrophobicContact CB-CD2 3.64Å; M641-L1091 HydrophobicContact CB-CG 3.75Å; M641-L1091 VanDerWaalsContact CB-N 3.3Å; M641-L1091 HydrophobicContact CE-CD1 4.46Å; M641-L1091 HydrophobicContact CE-CD2 3.64Å; M641-L1091 HydrophobicContact CE-CG 4.05Å; M641-L1091 HydrophobicContact CG-CD2 4.22Å; M641-L1091 VanDerWaalsContact N-C 3.31Å; M641-L1091 PolarHBondContact N-O 3.24Å; M641-L1091 HydrophobicContact SD-CD2 3.63Å; M641-L1091 HydrophobicContact SD-CG 4.46Å
642	E	89.8	Confident	88.5	Confident	32 Å²	32	82.9 Å²	82.9	15%	0.15	40%	0.404	C	S	.	.	H	α-helix	trans	-33.5	-61	130.2	22	97.9	-101.3	0	0	109.6	Q638 E644 Q645 C646 L1091 N1092 F1093	Q638-E642 PolarHBondContact NE2-OE1 2.67Å; E642-E644 PolarHBondContact O-N 2.78Å; E642-Q645 HydrophobicContact CB-CB 3.73Å; E642-Q645 HydrophobicContact CB-CG 4.46Å; E642-Q645 HydrophobicContact CG-CB 4.07Å; E642-Q645 HydrophobicContact CG-CG 4.29Å; E642-Q645 CarbonylContact O-C 3.6Å; E642-Q645 WeakPolarHBondContact O-CA 3.44Å; E642-Q645 PolarHBondContact O-N 2.79Å; E642-C646 PolarHBondContact O-N 2.77Å; E642-L1091 WeakPolarHBondContact CA-O 3.06Å; E642-L1091 PolarHBondContact N-O 2.8Å; E642-N1092 VanDerWaalsContact CA-O 3.3Å; E642-N1092 WeakPolarHBondContact CA-O 3.45Å; E642-N1092 WeakPolarHBondContact CB-O 3.13Å; E642-N1092 VanDerWaalsContact N-N 3.17Å; E642-N1092 WeakPolarHBondContact OE1-CA 3.11Å; E642-N1092 PolarHBondContact OE1-N 2.83Å; E642-N1092 PolarHBondContact OE1-OD1 3.42Å; E642-F1093 HydrophobicContact CB-CB 3.7Å; E642-F1093 HydrophobicContact CG-CB 4.4Å; E642-F1093 PolarHBondContact OE1-N 3.12Å; E642-F1093 VanDerWaalsContact OE2-CA 3.29Å; E642-F1093 WeakPolarHBondContact OE2-CA 3.26Å; E642-F1093 PolarHBondContact OE2-N 2.93Å
643	R	88.8	Confident	88.5	Confident	166 Å²	166	84.4 Å²	84.4	63%	0.626	41%	0.408	S	S	*	.	H	α-helix	trans	-12.3	-74.3	146.5	163.5	-171.4	-153.8	-111.8	2	116.6	K640 Q645 Q647	K640-R643 WeakPolarHBondContact O-CA 3.36Å; R643-Q645 VanDerWaalsContact C-N 3.33Å; R643-Q647 VanDerWaalsContact O-CB 3.32Å; R643-Q647 WeakPolarHBondContact O-CB 3.25Å; R643-Q647 PolarHBondContact O-N 2.84Å; R643-Q647 VanDerWaalsContact O-N 3.14Å
644	E	89.1	Confident	88.3	Confident	70 Å²	70	86.4 Å²	86.4	33%	0.327	41%	0.412	S	S	.	.	H	α-helix	trans	-75.2	-21.9	-172.4	-161.5	166.2	158.7	0	0	112.5	K640 M641 E642 Q647 T648 Y1090	K640-E644 IonicContact NZ-OE2 3.38Å; K640-E644 PolarHBondContact NZ-OE2 3.28Å; K640-E644 PolarHBondContact O-N 2.94Å; M641-E644 VanDerWaalsContact C-N 3.32Å; M641-E644 HydrophobicContact CB-CB 4.22Å; M641-E644 HydrophobicContact CG-CB 3.6Å; M641-E644 HydrophobicContact CG-CG 4.35Å; M641-E644 CarbonylContact O-C 3.52Å; M641-E644 WeakPolarHBondContact O-CA 3.2Å; M641-E644 WeakPolarHBondContact O-CB 3.36Å; M641-E644 PolarHBondContact O-N 3.24Å; E642-E644 PolarHBondContact O-N 2.78Å; E644-Q647 CarbonylContact O-C 3.58Å; E644-Q647 VanDerWaalsContact O-C 3.32Å; E644-Q647 PolarHBondContact O-N 3.34Å; E644-T648 PolarHBondContact O-N 3.43Å; E644-Y1090 WeakPolarHBondContact OE2-CE1 3.41Å; E644-Y1090 PolarHBondContact OE2-OH 2.95Å
645	Q	86.3	Confident	88.2	Confident	83 Å²	83	84.5 Å²	84.5	39%	0.388	41%	0.407	S	S	.	.	H	α-helix	trans	-86	-41.4	179.8	-86.6	166	-105	0	0	111.9	M641 E642 R643 Q647 T648 E649	M641-Q645 VanDerWaalsContact O-CB 3.25Å; M641-Q645 WeakPolarHBondContact O-CB 3.47Å; M641-Q645 WeakPolarHBondContact O-CG 3.39Å; M641-Q645 PolarHBondContact O-N 3.34Å; M641-Q645 PolarHBondContact O-OE1 3.04Å; E642-Q645 HydrophobicContact CB-CB 3.73Å; E642-Q645 HydrophobicContact CB-CG 4.46Å; E642-Q645 HydrophobicContact CG-CB 4.07Å; E642-Q645 HydrophobicContact CG-CG 4.29Å; E642-Q645 CarbonylContact O-C 3.6Å; E642-Q645 WeakPolarHBondContact O-CA 3.44Å; E642-Q645 PolarHBondContact O-N 2.79Å; R643-Q645 VanDerWaalsContact C-N 3.33Å; Q645-Q647 PolarHBondContact O-N 3.02Å; Q645-T648 VanDerWaalsContact CA-OG1 3.31Å; Q645-T648 WeakPolarHBondContact CA-OG1 3.29Å; Q645-T648 PolarHBondContact O-N 3.15Å; Q645-T648 VanDerWaalsContact O-N 3.12Å; Q645-T648 PolarHBondContact O-OG1 2.97Å; Q645-E649 WeakPolarHBondContact O-CB 3.45Å; Q645-E649 PolarHBondContact O-N 2.95Å
646	C	84.2	Confident	88.1	Confident	35 Å²	35	84.6 Å²	84.6	24%	0.236	41%	0.407	C	S	.	.	H	α-helix	trans	-62	-31.4	162	-62.1	0	0	0	0	110.1	E642 I650	E642-C646 PolarHBondContact O-N 2.77Å; C646-I650 VanDerWaalsContact O-CB 3.31Å; C646-I650 WeakPolarHBondContact O-CB 3.38Å; C646-I650 WeakPolarHBondContact O-CD1 3.49Å; C646-I650 WeakPolarHBondContact O-CG1 3.44Å; C646-I650 PolarHBondContact O-N 3.18Å
647	Q	86.8	Confident	88	Confident	103 Å²	103	84.6 Å²	84.6	48%	0.481	41%	0.407	S	S	.	.	H	α-helix	trans	-78.3	-17.1	173.6	-164.4	173.4	-1.1	0	0	113.7	R643 E644 Q645 R651	R643-Q647 VanDerWaalsContact O-CB 3.32Å; R643-Q647 WeakPolarHBondContact O-CB 3.25Å; R643-Q647 PolarHBondContact O-N 2.84Å; R643-Q647 VanDerWaalsContact O-N 3.14Å; E644-Q647 CarbonylContact O-C 3.58Å; E644-Q647 VanDerWaalsContact O-C 3.32Å; E644-Q647 PolarHBondContact O-N 3.34Å; Q645-Q647 PolarHBondContact O-N 3.02Å; Q647-R651 VanDerWaalsContact O-CZ 3.28Å; Q647-R651 PolarHBondContact O-NE 2.88Å; Q647-R651 PolarHBondContact O-NH2 3.45Å
648	T	82.7	Confident	87.5	Confident	46 Å²	46	82.8 Å²	82.8	28%	0.282	41%	0.407	S	S	.	.	H	α-helix	trans	-79.8	-49.4	162.1	49	0	0	0	0	109.3	E644 Q645 I650 R651 D652	E644-T648 PolarHBondContact O-N 3.43Å; Q645-T648 VanDerWaalsContact CA-OG1 3.31Å; Q645-T648 WeakPolarHBondContact CA-OG1 3.29Å; Q645-T648 PolarHBondContact O-N 3.15Å; Q645-T648 VanDerWaalsContact O-N 3.12Å; Q645-T648 PolarHBondContact O-OG1 2.97Å; T648-I650 VanDerWaalsContact C-N 3.28Å; T648-I650 PolarHBondContact O-N 2.63Å; T648-R651 CarbonylContact O-C 3.57Å; T648-R651 VanDerWaalsContact O-CA 3.28Å; T648-R651 WeakPolarHBondContact O-CA 3.47Å; T648-R651 VanDerWaalsContact O-CB 3.3Å; T648-R651 WeakPolarHBondContact O-CB 3.28Å; T648-R651 PolarHBondContact O-N 2.83Å; T648-D652 VanDerWaalsContact C-OD2 3.3Å; T648-D652 PolarHBondContact O-N 2.71Å
649	E	92.2	Very high	87.5	Confident	103 Å²	103	85.6 Å²	85.6	48%	0.481	42%	0.42	S	S	.	.	H	α-helix	trans	-56.3	-40.1	-179.5	-172	177.3	-164.3	0	0	112.3	Q645 R651 D652 L653	Q645-E649 WeakPolarHBondContact O-CB 3.45Å; Q645-E649 PolarHBondContact O-N 2.95Å; E649-R651 VanDerWaalsContact C-N 3.32Å; E649-R651 PolarHBondContact O-N 3.32Å; E649-D652 PolarHBondContact O-N 3.24Å; E649-L653 HydrophobicContact CG-CD1 3.99Å; E649-L653 HydrophobicContact CG-CG 4.41Å; E649-L653 WeakPolarHBondContact O-CB 3.47Å; E649-L653 WeakPolarHBondContact O-CG 3.45Å; E649-L653 PolarHBondContact O-N 3Å
650	I	86.1	Confident	87.4	Confident	94 Å²	94	86.8 Å²	86.8	48%	0.482	42%	0.421	S	S	.	.	H	α-helix	trans	-63.6	-35	172.1	-72.9	165.6	0	0	0	112.3	C646 T648 Q654	C646-I650 VanDerWaalsContact O-CB 3.31Å; C646-I650 WeakPolarHBondContact O-CB 3.38Å; C646-I650 WeakPolarHBondContact O-CD1 3.49Å; C646-I650 WeakPolarHBondContact O-CG1 3.44Å; C646-I650 PolarHBondContact O-N 3.18Å; T648-I650 VanDerWaalsContact C-N 3.28Å; T648-I650 PolarHBondContact O-N 2.63Å; I650-Q654 VanDerWaalsContact O-CB 3.32Å; I650-Q654 WeakPolarHBondContact O-CB 3.29Å; I650-Q654 VanDerWaalsContact O-CD 3.32Å; I650-Q654 WeakPolarHBondContact O-CG 3.48Å; I650-Q654 PolarHBondContact O-N 2.86Å
651	R	90.6	Very high	87.3	Confident	110 Å²	110	90 Å²	90	42%	0.415	44%	0.436	S	S	.	.	H	α-helix	trans	-72.8	-48	172.8	-82.9	175.3	-74.9	140.1	-3.6	111.2	Q647 T648 E649 L653 Q654 D655	Q647-R651 VanDerWaalsContact O-CZ 3.28Å; Q647-R651 PolarHBondContact O-NE 2.88Å; Q647-R651 PolarHBondContact O-NH2 3.45Å; T648-R651 CarbonylContact O-C 3.57Å; T648-R651 VanDerWaalsContact O-CA 3.28Å; T648-R651 WeakPolarHBondContact O-CA 3.47Å; T648-R651 VanDerWaalsContact O-CB 3.3Å; T648-R651 WeakPolarHBondContact O-CB 3.28Å; T648-R651 PolarHBondContact O-N 2.83Å; E649-R651 VanDerWaalsContact C-N 3.32Å; E649-R651 PolarHBondContact O-N 3.32Å; R651-L653 PolarHBondContact O-N 3.47Å; R651-Q654 CarbonylContact O-C 3.47Å; R651-Q654 WeakPolarHBondContact O-CA 3.36Å; R651-Q654 WeakPolarHBondContact O-CB 3.34Å; R651-Q654 PolarHBondContact O-N 3.39Å; R651-D655 WeakPolarHBondContact O-CB 3.45Å; R651-D655 VanDerWaalsContact O-CG 3.3Å; R651-D655 PolarHBondContact O-N 3.28Å
652	D	90	Very high	87	Confident	78 Å²	78	92.6 Å²	92.6	42%	0.417	45%	0.451	S	S	.	.	H	α-helix	trans	-60.4	-34.4	179.5	-52.1	-30.1	0	0	0	110.8	T648 E649 Q656	T648-D652 VanDerWaalsContact C-OD2 3.3Å; T648-D652 PolarHBondContact O-N 2.71Å; E649-D652 PolarHBondContact O-N 3.24Å; D652-Q656 VanDerWaalsContact O-CB 3.31Å; D652-Q656 WeakPolarHBondContact O-CB 3.43Å; D652-Q656 WeakPolarHBondContact O-CG 3.47Å; D652-Q656 PolarHBondContact O-N 3.47Å; D652-Q656 PolarHBondContact O-NE2 3.24Å
653	L	89.3	Confident	86.6	Confident	83 Å²	83	96.8 Å²	96.8	44%	0.435	47%	0.471	S	S	.	.	H	α-helix	trans	-76.1	-33.5	171.8	-71.6	170.4	0	0	0	113.2	E649 R651 L657	E649-L653 HydrophobicContact CG-CD1 3.99Å; E649-L653 HydrophobicContact CG-CG 4.41Å; E649-L653 WeakPolarHBondContact O-CB 3.47Å; E649-L653 WeakPolarHBondContact O-CG 3.45Å; E649-L653 PolarHBondContact O-N 3Å; R651-L653 PolarHBondContact O-N 3.47Å; L653-L657 WeakPolarHBondContact O-CB 3.42Å; L653-L657 VanDerWaalsContact O-CG 3.22Å; L653-L657 WeakPolarHBondContact O-CG 3.43Å; L653-L657 PolarHBondContact O-N 3.49Å
654	Q	83.3	Confident	86.3	Confident	115 Å²	115	93.3 Å²	93.3	54%	0.537	46%	0.464	S	S	.	.	H	α-helix	trans	-68.1	-40.1	171.6	-79.6	166.6	-1.5	0	0	111.4	I650 R651 L657 S658	I650-Q654 VanDerWaalsContact O-CB 3.32Å; I650-Q654 WeakPolarHBondContact O-CB 3.29Å; I650-Q654 VanDerWaalsContact O-CD 3.32Å; I650-Q654 WeakPolarHBondContact O-CG 3.48Å; I650-Q654 PolarHBondContact O-N 2.86Å; R651-Q654 CarbonylContact O-C 3.47Å; R651-Q654 WeakPolarHBondContact O-CA 3.36Å; R651-Q654 WeakPolarHBondContact O-CB 3.34Å; R651-Q654 PolarHBondContact O-N 3.39Å; Q654-L657 PolarHBondContact O-N 2.89Å; Q654-S658 PolarHBondContact O-N 3.42Å
655	D	89.9	Confident	85.8	Confident	99 Å²	99	93.4 Å²	93.4	53%	0.529	47%	0.467	S	S	.	.	H	α-helix	trans	-67.8	-45.7	176.4	-68.5	-14.7	0	0	0	109.7	R651 L657 S658 E659	R651-D655 WeakPolarHBondContact O-CB 3.45Å; R651-D655 VanDerWaalsContact O-CG 3.3Å; R651-D655 PolarHBondContact O-N 3.28Å; D655-L657 VanDerWaalsContact C-N 3.34Å; D655-L657 PolarHBondContact O-N 3.12Å; D655-S658 CarbonylContact O-C 3.53Å; D655-S658 WeakPolarHBondContact O-CA 3.45Å; D655-S658 WeakPolarHBondContact O-CB 3.39Å; D655-S658 PolarHBondContact O-N 2.79Å; D655-S658 PolarHBondContact O-OG 3.16Å; D655-E659 WeakPolarHBondContact O-CB 3.43Å; D655-E659 PolarHBondContact O-N 2.71Å
656	Q	88.3	Confident	85.1	Confident	104 Å²	104	92 Å²	92	49%	0.486	47%	0.467	S	S	.	.	H	α-helix	trans	-59.3	-38.1	170.4	-80.6	165.4	74.6	0	0	113.3	D652 S658 E659 M660	D652-Q656 VanDerWaalsContact O-CB 3.31Å; D652-Q656 WeakPolarHBondContact O-CB 3.43Å; D652-Q656 WeakPolarHBondContact O-CG 3.47Å; D652-Q656 PolarHBondContact O-N 3.47Å; D652-Q656 PolarHBondContact O-NE2 3.24Å; Q656-S658 VanDerWaalsContact C-N 3.34Å; Q656-E659 PolarHBondContact O-N 3.28Å; Q656-M660 WeakPolarHBondContact O-CB 3.21Å; Q656-M660 WeakPolarHBondContact O-CG 3.19Å; Q656-M660 PolarHBondContact O-N 3.23Å
657	L	84.8	Confident	84.5	Confident	94 Å²	94	93 Å²	93	49%	0.492	48%	0.477	S	S	.	.	H	α-helix	trans	-68.7	-33.8	173.6	-77.6	168.3	0	0	0	111.7	L653 Q654 D655 M660 H661	L653-L657 WeakPolarHBondContact O-CB 3.42Å; L653-L657 VanDerWaalsContact O-CG 3.22Å; L653-L657 WeakPolarHBondContact O-CG 3.43Å; L653-L657 PolarHBondContact O-N 3.49Å; Q654-L657 PolarHBondContact O-N 2.89Å; D655-L657 VanDerWaalsContact C-N 3.34Å; D655-L657 PolarHBondContact O-N 3.12Å; L657-M660 HydrophobicContact CD2-CE 4.23Å; L657-H661 WeakPolarHBondContact O-CB 3.5Å; L657-H661 PolarHBondContact O-CD2 2.69Å; L657-H661 PolarHBondContact O-N 2.76Å
658	S	82.3	Confident	83.8	Confident	60 Å²	60	93.5 Å²	93.5	42%	0.42	48%	0.478	S	S	.	.	H	α-helix	trans	-69.7	-40.7	173.5	80.3	0	0	0	0	111.9	Q654 D655 Q656 H661 D662	Q654-S658 PolarHBondContact O-N 3.42Å; D655-S658 CarbonylContact O-C 3.53Å; D655-S658 WeakPolarHBondContact O-CA 3.45Å; D655-S658 WeakPolarHBondContact O-CB 3.39Å; D655-S658 PolarHBondContact O-N 2.79Å; D655-S658 PolarHBondContact O-OG 3.16Å; Q656-S658 VanDerWaalsContact C-N 3.34Å; S658-H661 WeakPolarHBondContact O-CB 3.45Å; S658-H661 PolarHBondContact O-N 2.94Å; S658-H661 VanDerWaalsContact O-N 3.13Å; S658-D662 PolarHBondContact O-N 3.34Å
659	E	89	Confident	83	Confident	123 Å²	123	98.2 Å²	98.2	58%	0.575	49%	0.49	S	S	*	.	H	α-helix	trans	-64.9	-45.9	175.2	-171.9	167	-138.7	0	0	110.4	D655 Q656 H661 D662 E663	D655-E659 WeakPolarHBondContact O-CB 3.43Å; D655-E659 PolarHBondContact O-N 2.71Å; Q656-E659 PolarHBondContact O-N 3.28Å; E659-H661 VanDerWaalsContact C-N 3.26Å; E659-H661 PolarHBondContact O-N 2.84Å; E659-D662 PolarHBondContact O-N 3.09Å; E659-E663 WeakPolarHBondContact O-CB 3.2Å; E659-E663 WeakPolarHBondContact O-CG 3.33Å; E659-E663 PolarHBondContact O-N 3.2Å
660	M	85.7	Confident	81.7	Confident	117 Å²	117	96.5 Å²	96.5	58%	0.576	49%	0.494	S	S	*	.	H	α-helix	trans	-63.8	-27.4	171.8	-75.3	-148	-54.9	0	0	113.5	Q656 L657 L664	Q656-M660 WeakPolarHBondContact O-CB 3.21Å; Q656-M660 WeakPolarHBondContact O-CG 3.19Å; Q656-M660 PolarHBondContact O-N 3.23Å; L657-M660 HydrophobicContact CD2-CE 4.23Å; M660-L664 WeakPolarHBondContact O-CB 3.28Å; M660-L664 PolarHBondContact O-N 2.86Å
661	H	85.1	Confident	80.5	Confident	118 Å²	118	94 Å²	94	55%	0.546	49%	0.488	S	S	.	.	H	α-helix	trans	-73.3	-42.5	172.2	-83.3	-50.8	0	0	0	112	L657 S658 E659 L664 D665	L657-H661 WeakPolarHBondContact O-CB 3.5Å; L657-H661 PolarHBondContact O-CD2 2.69Å; L657-H661 PolarHBondContact O-N 2.76Å; S658-H661 WeakPolarHBondContact O-CB 3.45Å; S658-H661 PolarHBondContact O-N 2.94Å; S658-H661 VanDerWaalsContact O-N 3.13Å; E659-H661 VanDerWaalsContact C-N 3.26Å; E659-H661 PolarHBondContact O-N 2.84Å; H661-L664 PolarHBondContact O-N 2.97Å; H661-D665 WeakPolarHBondContact O-CB 3.47Å; H661-D665 PolarHBondContact O-N 3.04Å
662	D	82.3	Confident	79.2	Confident	111 Å²	111	91.1 Å²	91.1	59%	0.594	49%	0.487	S	S	*	.	H	α-helix	trans	-68.4	-35.7	174.6	-87.9	-25.9	0	0	0	112.1	S658 E659 S666	S658-D662 PolarHBondContact O-N 3.34Å; E659-D662 PolarHBondContact O-N 3.09Å; D662-S666 WeakPolarHBondContact O-CB 3.44Å; D662-S666 PolarHBondContact O-N 3.31Å; D662-S666 PolarHBondContact O-OG 2.99Å
663	E	83.1	Confident	77.9	Confident	121 Å²	121	91.9 Å²	91.9	57%	0.565	49%	0.491	S	S	*	.	H	α-helix	trans	-64.2	-46.1	168.6	-76.2	-163.9	153	0	0	111.2	E659 D665 S666 A667	E659-E663 WeakPolarHBondContact O-CB 3.2Å; E659-E663 WeakPolarHBondContact O-CG 3.33Å; E659-E663 PolarHBondContact O-N 3.2Å; E663-D665 PolarHBondContact O-N 3.5Å; E663-S666 WeakPolarHBondContact CA-OG 3.49Å; E663-S666 PolarHBondContact O-N 3.49Å; E663-S666 PolarHBondContact O-OG 3.17Å; E663-A667 WeakPolarHBondContact O-CB 3.26Å; E663-A667 PolarHBondContact O-N 3.48Å
664	L	80.8	Confident	76.7	Confident	92 Å²	92	89.7 Å²	89.7	48%	0.482	49%	0.488	S	S	.	.	H	α-helix	trans	-63	-42.7	178	-172.9	75.2	0	0	0	111.6	M660 H661 K668	M660-L664 WeakPolarHBondContact O-CB 3.28Å; M660-L664 PolarHBondContact O-N 2.86Å; H661-L664 PolarHBondContact O-N 2.97Å; L664-K668 VanDerWaalsContact O-CG 3.3Å; L664-K668 WeakPolarHBondContact O-CG 3.15Å; L664-K668 PolarHBondContact O-N 2.88Å
665	D	78.4	Confident	75.6	Confident	73 Å²	73	90.8 Å²	90.8	39%	0.39	49%	0.494	S	S	.	.	H	α-helix	trans	-80.6	-23.3	-179.1	-78.4	-1.3	0	0	0	112.8	H661 E663 K668 R669	H661-D665 WeakPolarHBondContact O-CB 3.47Å; H661-D665 PolarHBondContact O-N 3.04Å; E663-D665 PolarHBondContact O-N 3.5Å; D665-K668 WeakPolarHBondContact OD1-CD 3.33Å; D665-K668 IonicContact OD1-NZ 3.81Å; D665-K668 PolarHBondContact OD1-NZ 3.45Å; D665-R669 WeakPolarHBondContact O-CG 3.35Å; D665-R669 PolarHBondContact O-N 3.28Å; D665-R669 PolarHBondContact O-NE 2.79Å
666	S	72.7	Confident	74.2	Confident	54 Å²	54	91.5 Å²	91.5	38%	0.378	49%	0.492	S	S	.	.	H	α-helix	trans	-78.3	-34.5	167.6	60.3	0	0	0	0	112.2	D662 E663 R669 A670	D662-S666 WeakPolarHBondContact O-CB 3.44Å; D662-S666 PolarHBondContact O-N 3.31Å; D662-S666 PolarHBondContact O-OG 2.99Å; E663-S666 WeakPolarHBondContact CA-OG 3.49Å; E663-S666 PolarHBondContact O-N 3.49Å; E663-S666 PolarHBondContact O-OG 3.17Å; S666-R669 PolarHBondContact O-N 3.45Å; S666-A670 WeakPolarHBondContact O-CB 3.45Å; S666-A670 PolarHBondContact O-N 3.35Å
667	A	71.5	Confident	73.1	Confident	55 Å²	55	91.9 Å²	91.9	46%	0.455	50%	0.497	S	S	.	.	H	α-helix	trans	-64.1	-41.4	169.4	0	0	0	0	0	111.6	E663 R669 A670 A671	E663-A667 WeakPolarHBondContact O-CB 3.26Å; E663-A667 PolarHBondContact O-N 3.48Å; A667-R669 PolarHBondContact O-N 2.83Å; A667-A670 PolarHBondContact O-N 3.38Å; A667-A671 VanDerWaalsContact O-CB 3.31Å; A667-A671 WeakPolarHBondContact O-CB 3.3Å; A667-A671 PolarHBondContact O-N 3.28Å
668	K	71.5	Confident	72.2	Confident	113 Å²	113	89.7 Å²	89.7	49%	0.491	49%	0.493	S	S	.	.	H	α-helix	trans	-60.4	-41.4	170.9	-75.8	172	-162.1	152.5	0	112.5	L664 D665 A672	L664-K668 VanDerWaalsContact O-CG 3.3Å; L664-K668 WeakPolarHBondContact O-CG 3.15Å; L664-K668 PolarHBondContact O-N 2.88Å; D665-K668 WeakPolarHBondContact OD1-CD 3.33Å; D665-K668 IonicContact OD1-NZ 3.81Å; D665-K668 PolarHBondContact OD1-NZ 3.45Å; K668-A672 WeakPolarHBondContact O-CB 3.29Å; K668-A672 PolarHBondContact O-N 3.44Å
669	R	65.4	Low	71.6	Confident	145 Å²	145	92.7 Å²	92.7	55%	0.547	50%	0.504	S	S	.	.	H	α-helix	trans	-65.4	-46.5	175.1	-78.7	171.3	-79.9	164.6	-5.7	111.4	D665 S666 A667 A671 A672 D673	D665-R669 WeakPolarHBondContact O-CG 3.35Å; D665-R669 PolarHBondContact O-N 3.28Å; D665-R669 PolarHBondContact O-NE 2.79Å; S666-R669 PolarHBondContact O-N 3.45Å; A667-R669 PolarHBondContact O-N 2.83Å; R669-A671 VanDerWaalsContact C-N 3.34Å; R669-A671 PolarHBondContact O-N 3.27Å; R669-A672 PolarHBondContact O-N 3.26Å; R669-D673 PolarHBondContact O-N 3.31Å
670	A	66.6	Low	70.9	Confident	68 Å²	68	92.5 Å²	92.5	56%	0.562	50%	0.504	S	S	*	.	H	α-helix	trans	-63.4	-36.8	177.8	0	0	0	0	0	112.8	S666 A667 G674	S666-A670 WeakPolarHBondContact O-CB 3.45Å; S666-A670 PolarHBondContact O-N 3.35Å; A667-A670 PolarHBondContact O-N 3.38Å; A670-G674 VanDerWaalsContact O-CA 3.25Å; A670-G674 WeakPolarHBondContact O-CA 3.45Å; A670-G674 PolarHBondContact O-N 3.5Å
671	A	60.9	Low	70.4	Confident	42 Å²	42	89.5 Å²	89.5	35%	0.347	50%	0.498	S	S	.	.	H	α-helix	trans	-69.7	-51	171.3	0	0	0	0	0	111.1	A667 R669 D673 G674 E675	A667-A671 VanDerWaalsContact O-CB 3.31Å; A667-A671 WeakPolarHBondContact O-CB 3.3Å; A667-A671 PolarHBondContact O-N 3.28Å; R669-A671 VanDerWaalsContact C-N 3.34Å; R669-A671 PolarHBondContact O-N 3.27Å; A671-D673 VanDerWaalsContact C-N 3.29Å; A671-D673 PolarHBondContact O-N 3.43Å; A671-G674 PolarHBondContact O-N 2.86Å; A671-E675 WeakPolarHBondContact O-CB 3.27Å; A671-E675 VanDerWaalsContact O-CG 3.31Å; A671-E675 WeakPolarHBondContact O-CG 3.47Å; A671-E675 PolarHBondContact O-N 3.26Å
672	A	63.3	Low	69.9	Low	49 Å²	49	89 Å²	89	41%	0.405	50%	0.499	S	S	.	.	H	α-helix	trans	-61.1	-34.7	-176	0	0	0	0	0	113.3	K668 R669 K676	K668-A672 WeakPolarHBondContact O-CB 3.29Å; K668-A672 PolarHBondContact O-N 3.44Å; R669-A672 PolarHBondContact O-N 3.26Å; A672-K676 WeakPolarHBondContact O-CG 3.44Å; A672-K676 PolarHBondContact O-NZ 2.92Å
673	D	62.5	Low	69.6	Low	93 Å²	93	88.9 Å²	88.9	50%	0.497	50%	0.497	S	S	.	.	H	α-helix	trans	-93.5	-37	177.1	-66.3	-26.3	0	0	0	112.4	R669 A671 E675 K676 D677	R669-D673 PolarHBondContact O-N 3.31Å; A671-D673 VanDerWaalsContact C-N 3.29Å; A671-D673 PolarHBondContact O-N 3.43Å; D673-E675 PolarHBondContact O-N 2.83Å; D673-K676 PolarHBondContact O-N 2.95Å; D673-K676 VanDerWaalsContact O-N 3.13Å; D673-K676 IonicContact OD1-NZ 3.01Å; D673-K676 PolarHBondContact OD1-NZ 3.32Å; D673-D677 PolarHBondContact O-N 3.44Å
674	G	62.7	Low	69.4	Low	37 Å²	37	89.9 Å²	89.9	38%	0.381	50%	0.503	S	S	.	.	H	α-helix	trans	-63.2	-38.3	175.1	0	0	0	0	0	113.5	A670 A671 A678	A670-G674 VanDerWaalsContact O-CA 3.25Å; A670-G674 WeakPolarHBondContact O-CA 3.45Å; A670-G674 PolarHBondContact O-N 3.5Å; A671-G674 PolarHBondContact O-N 2.86Å; G674-A678 WeakPolarHBondContact O-CB 3.46Å; G674-A678 PolarHBondContact O-N 3.27Å
675	E	61.2	Low	69.3	Low	138 Å²	138	90.3 Å²	90.3	65%	0.645	50%	0.503	S	S	*	.	H	α-helix	trans	-70.8	-29.7	173	-69.8	179.6	-179	0	0	112.2	A671 D673 L679	A671-E675 WeakPolarHBondContact O-CB 3.27Å; A671-E675 VanDerWaalsContact O-CG 3.31Å; A671-E675 WeakPolarHBondContact O-CG 3.47Å; A671-E675 PolarHBondContact O-N 3.26Å; D673-E675 PolarHBondContact O-N 2.83Å; E675-L679 WeakPolarHBondContact O-CB 3.37Å; E675-L679 PolarHBondContact O-N 2.86Å
676	K	59.5	Low	69.3	Low	115 Å²	115	91.9 Å²	91.9	50%	0.5	51%	0.51	S	S	.	.	H	α-helix	trans	-69.5	-46.7	173.1	-78.6	-169.8	-143.2	75.3	0	111.8	A672 D673 L679 M680	A672-K676 WeakPolarHBondContact O-CG 3.44Å; A672-K676 PolarHBondContact O-NZ 2.92Å; D673-K676 PolarHBondContact O-N 2.95Å; D673-K676 VanDerWaalsContact O-N 3.13Å; D673-K676 IonicContact OD1-NZ 3.01Å; D673-K676 PolarHBondContact OD1-NZ 3.32Å; K676-L679 PolarHBondContact O-N 3.13Å; K676-M680 VanDerWaalsContact O-CB 3.3Å; K676-M680 WeakPolarHBondContact O-CB 3.2Å; K676-M680 PolarHBondContact O-N 3.39Å
677	D	65.4	Low	69.3	Low	112 Å²	112	95.9 Å²	95.9	60%	0.599	52%	0.521	S	S	*	.	H	α-helix	trans	-69.7	-37.2	179.8	-77.2	-8.5	0	0	0	111.2	D673 M680 A681	D673-D677 PolarHBondContact O-N 3.44Å; D677-M680 PolarHBondContact O-N 2.75Å; D677-A681 WeakPolarHBondContact O-CB 3.49Å; D677-A681 PolarHBondContact O-N 3.2Å
678	A	66.7	Low	69.6	Low	48 Å²	48	96.6 Å²	96.6	40%	0.397	52%	0.519	S	S	.	.	H	α-helix	trans	-64.5	-46.7	171.3	0	0	0	0	0	112.1	G674 M680 A681 D682	G674-A678 WeakPolarHBondContact O-CB 3.46Å; G674-A678 PolarHBondContact O-N 3.27Å; A678-M680 VanDerWaalsContact C-N 3.28Å; A678-M680 PolarHBondContact O-N 2.92Å; A678-A681 PolarHBondContact O-N 2.83Å; A678-D682 WeakPolarHBondContact O-CB 3.31Å; A678-D682 PolarHBondContact O-N 2.81Å
679	L	69.2	Low	69.9	Low	123 Å²	123	95.4 Å²	95.4	64%	0.644	52%	0.516	S	S	*	.	H	α-helix	trans	-63.9	-33.4	176.5	-175.7	67.9	0	0	0	112	E675 K676 M683	E675-L679 WeakPolarHBondContact O-CB 3.37Å; E675-L679 PolarHBondContact O-N 2.86Å; K676-L679 PolarHBondContact O-N 3.13Å; L679-M683 WeakPolarHBondContact O-CB 3.24Å; L679-M683 PolarHBondContact O-N 2.98Å
680	M	74.3	Confident	70.5	Confident	118 Å²	118	94.1 Å²	94.1	58%	0.581	52%	0.517	S	S	*	.	H	α-helix	trans	-71	-38.7	175.2	-163.8	178.7	-51.9	0	0	111.8	K676 D677 A678 M683 M684	K676-M680 VanDerWaalsContact O-CB 3.3Å; K676-M680 WeakPolarHBondContact O-CB 3.2Å; K676-M680 PolarHBondContact O-N 3.39Å; D677-M680 PolarHBondContact O-N 2.75Å; A678-M680 VanDerWaalsContact C-N 3.28Å; A678-M680 PolarHBondContact O-N 2.92Å; M680-M683 HydrophobicContact CG-CE 4.48Å; M680-M684 WeakPolarHBondContact O-CB 3.39Å; M680-M684 PolarHBondContact O-N 3.38Å; M680-M684 VanDerWaalsContact O-N 3.12Å
681	A	75.1	Confident	71.1	Confident	55 Å²	55	97.3 Å²	97.3	46%	0.455	52%	0.521	S	S	.	.	H	α-helix	trans	-65.4	-48.8	172.1	0	0	0	0	0	111.6	D677 A678 M683 M684 Q685	D677-A681 WeakPolarHBondContact O-CB 3.49Å; D677-A681 PolarHBondContact O-N 3.2Å; A678-A681 PolarHBondContact O-N 2.83Å; A681-M683 VanDerWaalsContact C-N 3.35Å; A681-M683 PolarHBondContact O-N 3.14Å; A681-M684 CarbonylContact O-C 3.53Å; A681-M684 WeakPolarHBondContact O-CB 3.36Å; A681-M684 PolarHBondContact O-N 3.42Å; A681-M684 VanDerWaalsContact O-N 3.08Å; A681-Q685 WeakPolarHBondContact O-CB 3.45Å; A681-Q685 PolarHBondContact O-N 3.05Å
682	D	75.3	Confident	71.9	Confident	107 Å²	107	101.1 Å²	101.1	57%	0.572	53%	0.531	S	S	*	.	H	α-helix	trans	-64.5	-36	178.4	-77.7	-8.9	0	0	0	111.8	A678 M684 Q685 L686	A678-D682 WeakPolarHBondContact O-CB 3.31Å; A678-D682 PolarHBondContact O-N 2.81Å; D682-M684 VanDerWaalsContact C-N 3.32Å; D682-M684 PolarHBondContact O-N 3.11Å; D682-Q685 PolarHBondContact O-N 2.96Å; D682-L686 WeakPolarHBondContact O-CB 3.08Å; D682-L686 PolarHBondContact O-N 2.85Å
683	M	76	Confident	72.6	Confident	109 Å²	109	103.5 Å²	103.5	54%	0.537	54%	0.541	S	S	.	.	H	α-helix	trans	-66.6	-33.1	172.4	-178.7	-177.3	60.4	0	0	112.3	L679 M680 A681 K687	L679-M683 WeakPolarHBondContact O-CB 3.24Å; L679-M683 PolarHBondContact O-N 2.98Å; M680-M683 HydrophobicContact CG-CE 4.48Å; A681-M683 VanDerWaalsContact C-N 3.35Å; A681-M683 PolarHBondContact O-N 3.14Å; M683-K687 PolarHBondContact O-N 3.4Å
684	M	78.7	Confident	73.4	Confident	141 Å²	141	102.5 Å²	102.5	70%	0.695	54%	0.538	S	S	*	.	H	α-helix	trans	-75.7	-39.9	175.2	-177.5	165.7	159.8	0	0	111.6	M680 A681 D682 K687 V688	M680-M684 WeakPolarHBondContact O-CB 3.39Å; M680-M684 PolarHBondContact O-N 3.38Å; M680-M684 VanDerWaalsContact O-N 3.12Å; A681-M684 CarbonylContact O-C 3.53Å; A681-M684 WeakPolarHBondContact O-CB 3.36Å; A681-M684 PolarHBondContact O-N 3.42Å; A681-M684 VanDerWaalsContact O-N 3.08Å; D682-M684 VanDerWaalsContact C-N 3.32Å; D682-M684 PolarHBondContact O-N 3.11Å; M684-K687 PolarHBondContact O-N 2.87Å; M684-V688 PolarHBondContact O-N 3.01Å
685	Q	79.1	Confident	74.3	Confident	102 Å²	102	104.8 Å²	104.8	48%	0.477	54%	0.54	S	S	.	.	H	α-helix	trans	-60.9	-51.8	172.7	-176.3	68.7	23.3	0	0	110.9	A681 D682 K687 V688 E689	A681-Q685 WeakPolarHBondContact O-CB 3.45Å; A681-Q685 PolarHBondContact O-N 3.05Å; D682-Q685 PolarHBondContact O-N 2.96Å; Q685-K687 PolarHBondContact O-N 3.08Å; Q685-V688 WeakPolarHBondContact O-CA 3.16Å; Q685-V688 WeakPolarHBondContact O-CB 3.41Å; Q685-V688 PolarHBondContact O-N 3.37Å; Q685-E689 WeakPolarHBondContact CG-OE1 3.39Å; Q685-E689 PolarHBondContact NE2-OE1 3.28Å; Q685-E689 PolarHBondContact O-N 3.49Å
686	L	77.9	Confident	75.1	Confident	105 Å²	105	100.7 Å²	100.7	55%	0.55	53%	0.53	S	S	.	.	H	α-helix	trans	-61.8	-30.7	178.5	-176	63	0	0	0	112.4	D682 M690	D682-L686 WeakPolarHBondContact O-CB 3.08Å; D682-L686 PolarHBondContact O-N 2.85Å; L686-M690 WeakPolarHBondContact O-CB 3.42Å; L686-M690 PolarHBondContact O-N 3.23Å
687	K	71.6	Confident	75.8	Confident	138 Å²	138	101 Å²	101	60%	0.6	53%	0.531	S	S	*	.	H	α-helix	trans	-65.8	-40.3	170.8	-92.4	-176	174.1	179.5	0	112.9	M683 M684 Q685 Q691	M683-K687 PolarHBondContact O-N 3.4Å; M684-K687 PolarHBondContact O-N 2.87Å; Q685-K687 PolarHBondContact O-N 3.08Å; K687-Q691 WeakPolarHBondContact O-CB 3.38Å; K687-Q691 PolarHBondContact O-N 3.23Å; K687-Q691 VanDerWaalsContact O-N 3.15Å
688	V	78.5	Confident	76.4	Confident	70 Å²	70	101 Å²	101	42%	0.424	53%	0.528	S	S	.	.	H	α-helix	trans	-68.4	-50.2	175.8	175.4	0	0	0	0	109.9	M684 Q685 M690 Q691 E692	M684-V688 PolarHBondContact O-N 3.01Å; Q685-V688 WeakPolarHBondContact O-CA 3.16Å; Q685-V688 WeakPolarHBondContact O-CB 3.41Å; Q685-V688 PolarHBondContact O-N 3.37Å; V688-M690 VanDerWaalsContact C-N 3.34Å; V688-M690 PolarHBondContact O-N 3.4Å; V688-Q691 CarbonylContact O-C 3.46Å; V688-Q691 WeakPolarHBondContact O-CA 3.48Å; V688-Q691 PolarHBondContact O-N 3.24Å; V688-E692 HydrophobicContact CG1-CG 4.44Å; V688-E692 PolarHBondContact O-N 3.24Å
689	E	77.3	Confident	77	Confident	88 Å²	88	104.9 Å²	104.9	41%	0.411	54%	0.538	S	S	.	.	H	α-helix	trans	-61	-39.7	179.4	-68.7	177.8	-173.2	0	0	112.1	Q685 Q691 E692 V693	Q685-E689 WeakPolarHBondContact CG-OE1 3.39Å; Q685-E689 PolarHBondContact NE2-OE1 3.28Å; Q685-E689 PolarHBondContact O-N 3.49Å; E689-Q691 VanDerWaalsContact C-N 3.33Å; E689-Q691 PolarHBondContact O-N 2.92Å; E689-E692 PolarHBondContact O-N 3Å; E689-V693 WeakPolarHBondContact O-CB 3.45Å; E689-V693 VanDerWaalsContact O-CG2 3.28Å; E689-V693 WeakPolarHBondContact O-CG2 3.4Å; E689-V693 PolarHBondContact O-N 3.36Å
690	M	78.6	Confident	77.3	Confident	119 Å²	119	104.9 Å²	104.9	59%	0.586	54%	0.538	S	S	*	.	H	α-helix	trans	-64.1	-36.6	173	-174.7	179.2	69.2	0	0	112.1	L686 V688 V693 V694	L686-M690 WeakPolarHBondContact O-CB 3.42Å; L686-M690 PolarHBondContact O-N 3.23Å; V688-M690 VanDerWaalsContact C-N 3.34Å; V688-M690 PolarHBondContact O-N 3.4Å; M690-V693 PolarHBondContact O-N 2.87Å; M690-V694 WeakPolarHBondContact O-CG2 3.25Å; M690-V694 PolarHBondContact O-N 2.94Å
691	Q	80	Confident	77.4	Confident	135 Å²	135	102.2 Å²	102.2	63%	0.631	52%	0.524	S	S	*	.	H	α-helix	trans	-73.4	-34.6	177.3	-169.5	158.2	9.6	0	0	112.2	K687 V688 E689 V694 I695	K687-Q691 WeakPolarHBondContact O-CB 3.38Å; K687-Q691 PolarHBondContact O-N 3.23Å; K687-Q691 VanDerWaalsContact O-N 3.15Å; V688-Q691 CarbonylContact O-C 3.46Å; V688-Q691 WeakPolarHBondContact O-CA 3.48Å; V688-Q691 PolarHBondContact O-N 3.24Å; E689-Q691 VanDerWaalsContact C-N 3.33Å; E689-Q691 PolarHBondContact O-N 2.92Å; Q691-V694 PolarHBondContact O-N 3.47Å; Q691-I695 WeakPolarHBondContact O-CG1 3.46Å; Q691-I695 PolarHBondContact O-N 3.43Å; Q691-I695 VanDerWaalsContact O-N 3.09Å
692	E	77.9	Confident	77.7	Confident	121 Å²	121	104 Å²	104	57%	0.565	52%	0.523	S	S	*	.	H	α-helix	trans	-66.2	-39.7	170.1	-69.8	-179.2	173.6	0	0	111.9	V688 E689 V694 I695 A696	V688-E692 HydrophobicContact CG1-CG 4.44Å; V688-E692 PolarHBondContact O-N 3.24Å; E689-E692 PolarHBondContact O-N 3Å; E692-V694 VanDerWaalsContact C-N 3.34Å; E692-V694 PolarHBondContact O-N 2.98Å; E692-I695 PolarHBondContact O-N 2.9Å; E692-A696 WeakPolarHBondContact O-CB 3.34Å; E692-A696 PolarHBondContact O-N 3.47Å
693	V	77.8	Confident	77.9	Confident	100 Å²	100	103.8 Å²	103.8	61%	0.606	52%	0.521	S	S	*	.	H	α-helix	trans	-64.8	-35.5	173.5	167	0	0	0	0	112	E689 M690 K697	E689-V693 WeakPolarHBondContact O-CB 3.45Å; E689-V693 VanDerWaalsContact O-CG2 3.28Å; E689-V693 WeakPolarHBondContact O-CG2 3.4Å; E689-V693 PolarHBondContact O-N 3.36Å; M690-V693 PolarHBondContact O-N 2.87Å; V693-K697 WeakPolarHBondContact O-CB 3.44Å; V693-K697 PolarHBondContact O-N 3.18Å
694	V	78.3	Confident	78.1	Confident	72 Å²	72	103.3 Å²	103.3	44%	0.436	52%	0.52	S	S	.	.	H	α-helix	trans	-63.7	-46	171.8	167.2	0	0	0	0	111	M690 Q691 E692 K697 E698	M690-V694 WeakPolarHBondContact O-CG2 3.25Å; M690-V694 PolarHBondContact O-N 2.94Å; Q691-V694 PolarHBondContact O-N 3.47Å; E692-V694 VanDerWaalsContact C-N 3.34Å; E692-V694 PolarHBondContact O-N 2.98Å; V694-K697 WeakPolarHBondContact O-CB 3.34Å; V694-K697 PolarHBondContact O-N 3.01Å; V694-E698 WeakPolarHBondContact O-CG 3.24Å; V694-E698 PolarHBondContact O-N 2.8Å
695	I	82.1	Confident	78.2	Confident	84 Å²	84	102.2 Å²	102.2	43%	0.431	51%	0.508	S	S	.	.	H	α-helix	trans	-62.4	-45.3	177.1	-66.9	164.2	0	0	0	110.8	Q691 E692 K697 E698 E699	Q691-I695 WeakPolarHBondContact O-CG1 3.46Å; Q691-I695 PolarHBondContact O-N 3.43Å; Q691-I695 VanDerWaalsContact O-N 3.09Å; E692-I695 PolarHBondContact O-N 2.9Å; I695-K697 VanDerWaalsContact C-N 3.26Å; I695-K697 PolarHBondContact O-N 3.37Å; I695-E698 PolarHBondContact O-N 2.84Å; I695-E698 VanDerWaalsContact O-N 3.1Å; I695-E699 PolarHBondContact O-N 2.69Å
696	A	77.8	Confident	78.1	Confident	53 Å²	53	102.2 Å²	102.2	44%	0.438	50%	0.504	S	S	.	.	H	α-helix	trans	-61.8	-33.1	176.3	0	0	0	0	0	112.7	E692 L700	E692-A696 WeakPolarHBondContact O-CB 3.34Å; E692-A696 PolarHBondContact O-N 3.47Å; A696-L700 WeakPolarHBondContact O-CB 3.38Å; A696-L700 PolarHBondContact O-N 2.95Å
697	K	75.3	Confident	78	Confident	120 Å²	120	104.8 Å²	104.8	52%	0.522	51%	0.507	S	S	.	.	H	α-helix	trans	-70.1	-40.6	172.3	179	176.3	175.3	-68.7	0	111.9	V693 V694 I695 L700 E701	V693-K697 WeakPolarHBondContact O-CB 3.44Å; V693-K697 PolarHBondContact O-N 3.18Å; V694-K697 WeakPolarHBondContact O-CB 3.34Å; V694-K697 PolarHBondContact O-N 3.01Å; I695-K697 VanDerWaalsContact C-N 3.26Å; I695-K697 PolarHBondContact O-N 3.37Å; K697-L700 PolarHBondContact O-N 2.86Å; K697-E701 IonicContact NZ-OE1 3.18Å; K697-E701 PolarHBondContact NZ-OE1 2.79Å; K697-E701 WeakPolarHBondContact O-CB 3.44Å; K697-E701 WeakPolarHBondContact O-CG 3.36Å; K697-E701 PolarHBondContact O-N 3.47Å
698	E	77.3	Confident	78.3	Confident	114 Å²	114	103.3 Å²	103.3	53%	0.533	50%	0.502	S	S	.	.	H	α-helix	trans	-63.5	-43.4	174.6	-72.4	178.9	170.3	0	0	111.6	V694 I695 E701 E702	V694-E698 WeakPolarHBondContact O-CG 3.24Å; V694-E698 PolarHBondContact O-N 2.8Å; I695-E698 PolarHBondContact O-N 2.84Å; I695-E698 VanDerWaalsContact O-N 3.1Å; E698-E701 PolarHBondContact O-N 2.82Å; E698-E702 PolarHBondContact O-N 3.3Å
699	E	80.1	Confident	78.4	Confident	128 Å²	128	107.2 Å²	107.2	60%	0.598	51%	0.509	S	S	*	.	H	α-helix	trans	-60.9	-44.7	173.2	-71.6	-171.1	161.1	0	0	112	I695 E702 L703	I695-E699 PolarHBondContact O-N 2.69Å; E699-E702 PolarHBondContact O-N 3.22Å; E699-L703 WeakPolarHBondContact O-CB 3.21Å; E699-L703 PolarHBondContact O-N 2.85Å
700	L	73.8	Confident	78.4	Confident	124 Å²	124	107.9 Å²	107.9	65%	0.649	51%	0.512	S	S	*	.	H	α-helix	trans	-64.1	-42.2	176.9	-163.7	83.5	0	0	0	111.6	A696 K697 L703 L704	A696-L700 WeakPolarHBondContact O-CB 3.38Å; A696-L700 PolarHBondContact O-N 2.95Å; K697-L700 PolarHBondContact O-N 2.86Å; L700-L703 WeakPolarHBondContact O-CB 3.31Å; L700-L703 PolarHBondContact O-N 3Å; L700-L704 WeakPolarHBondContact O-CB 3.35Å; L700-L704 PolarHBondContact O-N 3.41Å
701	E	77.9	Confident	78.2	Confident	62 Å²	62	106.3 Å²	106.3	29%	0.29	51%	0.505	S	S	.	.	H	α-helix	trans	-65.6	-36.6	174.1	-77.3	-174.3	-158	0	0	112.3	K697 E698 L704 R705	K697-E701 IonicContact NZ-OE1 3.18Å; K697-E701 PolarHBondContact NZ-OE1 2.79Å; K697-E701 WeakPolarHBondContact O-CB 3.44Å; K697-E701 WeakPolarHBondContact O-CG 3.36Å; K697-E701 PolarHBondContact O-N 3.47Å; E698-E701 PolarHBondContact O-N 2.82Å; E701-L704 PolarHBondContact O-N 3.47Å; E701-R705 WeakPolarHBondContact O-CB 3.37Å; E701-R705 VanDerWaalsContact O-CG 3.23Å; E701-R705 WeakPolarHBondContact O-CG 3.42Å; E701-R705 PolarHBondContact O-N 2.84Å; E701-R705 IonicContact OE2-CZ 2.62Å; E701-R705 VanDerWaalsContact OE2-CZ 3.23Å; E701-R705 IonicContact OE2-NH1 3.11Å; E701-R705 PolarHBondContact OE2-NH1 2.89Å; E701-R705 IonicContact OE2-NH2 2.72Å; E701-R705 PolarHBondContact OE2-NH2 3.21Å
702	E	79.6	Confident	78.2	Confident	92 Å²	92	102.7 Å²	102.7	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-66.4	-39	171.9	-74.6	-149.5	126.8	0	0	111.9	E698 E699 L704 R705 R706	E698-E702 PolarHBondContact O-N 3.3Å; E699-E702 PolarHBondContact O-N 3.22Å; E702-L704 VanDerWaalsContact C-N 3.27Å; E702-L704 PolarHBondContact O-N 2.9Å; E702-R705 CarbonylContact O-C 3.42Å; E702-R705 PolarHBondContact O-N 3.3Å; E702-R706 WeakPolarHBondContact O-CB 3.48Å; E702-R706 VanDerWaalsContact O-CG 3.25Å; E702-R706 WeakPolarHBondContact O-CG 3.3Å; E702-R706 PolarHBondContact O-N 3.25Å; E702-R706 IonicContact OE1-NH2 2.71Å; E702-R706 IonicContact OE2-CZ 3.88Å; E702-R706 VanDerWaalsContact OE2-CZ 3.24Å; E702-R706 IonicContact OE2-NH1 2.62Å; E702-R706 PolarHBondContact OE2-NH1 3.24Å; E702-R706 IonicContact OE2-NH2 2.86Å; E702-R706 PolarHBondContact OE2-NH2 2.9Å
703	L	79.8	Confident	78.1	Confident	103 Å²	103	100 Å²	100	54%	0.539	50%	0.497	S	S	.	.	H	α-helix	trans	-63.1	-38.3	174.9	-136.7	168.5	0	0	0	110.5	E699 L700 R706 R707	E699-L703 WeakPolarHBondContact O-CB 3.21Å; E699-L703 PolarHBondContact O-N 2.85Å; L700-L703 WeakPolarHBondContact O-CB 3.31Å; L700-L703 PolarHBondContact O-N 3Å; L703-R706 WeakPolarHBondContact O-CB 3.27Å; L703-R706 PolarHBondContact O-N 3.38Å; L703-R707 PolarHBondContact O-N 3.11Å
704	L	80.7	Confident	78	Confident	98 Å²	98	100.7 Å²	100.7	51%	0.513	50%	0.497	S	S	.	.	H	α-helix	trans	-66.7	-44.2	172.5	-158.1	147	0	0	0	111	L700 E701 E702 R706 R707 E708	L700-L704 WeakPolarHBondContact O-CB 3.35Å; L700-L704 PolarHBondContact O-N 3.41Å; E701-L704 PolarHBondContact O-N 3.47Å; E702-L704 VanDerWaalsContact C-N 3.27Å; E702-L704 PolarHBondContact O-N 2.9Å; L704-R706 VanDerWaalsContact C-N 3.31Å; L704-R706 PolarHBondContact O-N 2.96Å; L704-R707 CarbonylContact O-C 3.48Å; L704-R707 WeakPolarHBondContact O-CA 3.49Å; L704-R707 WeakPolarHBondContact O-CB 3.43Å; L704-R707 PolarHBondContact O-N 3.34Å; L704-R707 VanDerWaalsContact O-N 3.15Å; L704-E708 HydrophobicContact CD2-CG 3.97Å; L704-E708 WeakPolarHBondContact O-CG 3.36Å; L704-E708 PolarHBondContact O-N 2.76Å
705	R	80.9	Confident	77.8	Confident	118 Å²	118	103.8 Å²	103.8	45%	0.445	51%	0.505	S	S	.	.	H	α-helix	trans	-64.9	-27.8	173.1	-72.2	168.2	-176.6	119	14.6	113.5	E701 E702 R709	E701-R705 WeakPolarHBondContact O-CB 3.37Å; E701-R705 VanDerWaalsContact O-CG 3.23Å; E701-R705 WeakPolarHBondContact O-CG 3.42Å; E701-R705 PolarHBondContact O-N 2.84Å; E701-R705 IonicContact OE2-CZ 2.62Å; E701-R705 VanDerWaalsContact OE2-CZ 3.23Å; E701-R705 IonicContact OE2-NH1 3.11Å; E701-R705 PolarHBondContact OE2-NH1 2.89Å; E701-R705 IonicContact OE2-NH2 2.72Å; E701-R705 PolarHBondContact OE2-NH2 3.21Å; E702-R705 CarbonylContact O-C 3.42Å; E702-R705 PolarHBondContact O-N 3.3Å; R705-R709 WeakPolarHBondContact O-CG 3.33Å; R705-R709 PolarHBondContact O-N 3.16Å; R705-R709 PolarHBondContact O-NE 3.35Å
706	R	76.9	Confident	77.5	Confident	103 Å²	103	101.1 Å²	101.1	39%	0.389	50%	0.497	S	S	.	.	H	α-helix	trans	-67.8	-51.1	169.7	-73.8	166.6	-177.7	107.4	11.7	109.1	E702 L703 L704 E708 R709 E710	E702-R706 WeakPolarHBondContact O-CB 3.48Å; E702-R706 VanDerWaalsContact O-CG 3.25Å; E702-R706 WeakPolarHBondContact O-CG 3.3Å; E702-R706 PolarHBondContact O-N 3.25Å; E702-R706 IonicContact OE1-NH2 2.71Å; E702-R706 IonicContact OE2-CZ 3.88Å; E702-R706 VanDerWaalsContact OE2-CZ 3.24Å; E702-R706 IonicContact OE2-NH1 2.62Å; E702-R706 PolarHBondContact OE2-NH1 3.24Å; E702-R706 IonicContact OE2-NH2 2.86Å; E702-R706 PolarHBondContact OE2-NH2 2.9Å; L703-R706 WeakPolarHBondContact O-CB 3.27Å; L703-R706 PolarHBondContact O-N 3.38Å; L704-R706 VanDerWaalsContact C-N 3.31Å; L704-R706 PolarHBondContact O-N 2.96Å; R706-E708 VanDerWaalsContact C-N 3.33Å; R706-E708 PolarHBondContact O-N 2.65Å; R706-R709 PolarHBondContact O-N 3.06Å; R706-R709 VanDerWaalsContact O-N 3.15Å; R706-E710 WeakPolarHBondContact O-CG 3.13Å; R706-E710 PolarHBondContact O-N 3.37Å
707	R	75.9	Confident	77.4	Confident	159 Å²	159	101.1 Å²	101.1	60%	0.6	50%	0.498	S	S	*	.	H	α-helix	trans	-59.3	-36.5	173.6	-93.2	-72.5	177.7	90.6	-0.5	114	L703 L704 E710 L711	L703-R707 PolarHBondContact O-N 3.11Å; L704-R707 CarbonylContact O-C 3.48Å; L704-R707 WeakPolarHBondContact O-CA 3.49Å; L704-R707 WeakPolarHBondContact O-CB 3.43Å; L704-R707 PolarHBondContact O-N 3.34Å; L704-R707 VanDerWaalsContact O-N 3.15Å; R707-E710 WeakPolarHBondContact CD-OE2 3.32Å; R707-E710 IonicContact NE-OE2 3.83Å; R707-E710 PolarHBondContact O-N 2.69Å; R707-L711 VanDerWaalsContact O-CB 3.26Å; R707-L711 WeakPolarHBondContact O-CB 3.47Å; R707-L711 WeakPolarHBondContact O-CG 3.31Å; R707-L711 PolarHBondContact O-N 3.32Å
708	E	78.9	Confident	77.4	Confident	107 Å²	107	100.6 Å²	100.6	50%	0.5	50%	0.5	S	S	.	.	H	α-helix	trans	-67.3	-38.7	175.4	-76	176.5	145	0	0	111.9	L704 R706 L711 A712	L704-E708 HydrophobicContact CD2-CG 3.97Å; L704-E708 WeakPolarHBondContact O-CG 3.36Å; L704-E708 PolarHBondContact O-N 2.76Å; R706-E708 VanDerWaalsContact C-N 3.33Å; R706-E708 PolarHBondContact O-N 2.65Å; E708-L711 PolarHBondContact O-N 3.5Å; E708-A712 VanDerWaalsContact O-CB 3.23Å; E708-A712 WeakPolarHBondContact O-CB 3.4Å; E708-A712 PolarHBondContact O-N 2.87Å
709	R	79.8	Confident	77.5	Confident	152 Å²	152	102.6 Å²	102.6	57%	0.574	51%	0.507	S	S	*	.	H	α-helix	trans	-69.2	-39	174.1	-78.2	174.8	-76.7	126.1	-12	112.1	R705 R706 A712 A713	R705-R709 WeakPolarHBondContact O-CG 3.33Å; R705-R709 PolarHBondContact O-N 3.16Å; R705-R709 PolarHBondContact O-NE 3.35Å; R706-R709 PolarHBondContact O-N 3.06Å; R706-R709 VanDerWaalsContact O-N 3.15Å; R709-A712 PolarHBondContact O-N 2.91Å; R709-A713 WeakPolarHBondContact O-CB 3.5Å; R709-A713 PolarHBondContact O-N 3.48Å
710	E	78.2	Confident	77.3	Confident	101 Å²	101	102.2 Å²	102.2	47%	0.472	51%	0.509	S	S	.	.	H	α-helix	trans	-61.3	-47.5	170.4	-70.6	162.4	-163.4	0	0	111.2	R706 R707 A712 A713 L714	R706-E710 WeakPolarHBondContact O-CG 3.13Å; R706-E710 PolarHBondContact O-N 3.37Å; R707-E710 WeakPolarHBondContact CD-OE2 3.32Å; R707-E710 IonicContact NE-OE2 3.83Å; R707-E710 PolarHBondContact O-N 2.69Å; E710-A712 VanDerWaalsContact C-N 3.31Å; E710-A712 PolarHBondContact O-N 3.31Å; E710-A713 PolarHBondContact O-N 3.02Å; E710-L714 WeakPolarHBondContact O-CB 3.21Å; E710-L714 VanDerWaalsContact O-CG 3.31Å; E710-L714 WeakPolarHBondContact O-CG 3.35Å; E710-L714 PolarHBondContact O-N 3.31Å
711	L	74.3	Confident	77.4	Confident	86 Å²	86	103.1 Å²	103.1	45%	0.45	51%	0.51	S	S	.	.	H	α-helix	trans	-65.8	-31	176	-73.9	168.1	0	0	0	112.6	R707 E708 K715	R707-L711 VanDerWaalsContact O-CB 3.26Å; R707-L711 WeakPolarHBondContact O-CB 3.47Å; R707-L711 WeakPolarHBondContact O-CG 3.31Å; R707-L711 PolarHBondContact O-N 3.32Å; E708-L711 PolarHBondContact O-N 3.5Å; L711-K715 VanDerWaalsContact O-CB 3.24Å; L711-K715 WeakPolarHBondContact O-CB 3.36Å; L711-K715 WeakPolarHBondContact O-CD 3.49Å; L711-K715 WeakPolarHBondContact O-CG 3.46Å; L711-K715 PolarHBondContact O-N 2.83Å
712	A	79.4	Confident	77.4	Confident	59 Å²	59	103.5 Å²	103.5	49%	0.488	52%	0.516	S	S	.	.	H	α-helix	trans	-71.3	-41.3	173.5	0	0	0	0	0	111.6	E708 R709 E710 K715 G716	E708-A712 VanDerWaalsContact O-CB 3.23Å; E708-A712 WeakPolarHBondContact O-CB 3.4Å; E708-A712 PolarHBondContact O-N 2.87Å; R709-A712 PolarHBondContact O-N 2.91Å; E710-A712 VanDerWaalsContact C-N 3.31Å; E710-A712 PolarHBondContact O-N 3.31Å; A712-K715 CarbonylContact O-C 3.48Å; A712-K715 PolarHBondContact O-N 3.13Å; A712-G716 PolarHBondContact O-N 3.38Å
713	A	75.8	Confident	77.3	Confident	65 Å²	65	101.6 Å²	101.6	54%	0.537	52%	0.516	S	S	.	.	H	α-helix	trans	-63.9	-44.1	173.3	0	0	0	0	0	111.7	R709 E710 K715 G716 A717	R709-A713 WeakPolarHBondContact O-CB 3.5Å; R709-A713 PolarHBondContact O-N 3.48Å; E710-A713 PolarHBondContact O-N 3.02Å; A713-K715 PolarHBondContact O-N 3.17Å; A713-G716 WeakPolarHBondContact O-CA 3.46Å; A713-G716 PolarHBondContact O-N 2.95Å; A713-A717 PolarHBondContact O-N 3.32Å
714	L	75.2	Confident	77.1	Confident	115 Å²	115	99.4 Å²	99.4	60%	0.602	51%	0.513	S	S	*	.	H	α-helix	trans	-64.6	-36.6	174.1	-70.5	168.8	0	0	0	112.3	E710 G716 L718	E710-L714 WeakPolarHBondContact O-CB 3.21Å; E710-L714 VanDerWaalsContact O-CG 3.31Å; E710-L714 WeakPolarHBondContact O-CG 3.35Å; E710-L714 PolarHBondContact O-N 3.31Å; L714-G716 VanDerWaalsContact C-N 3.29Å; L714-G716 PolarHBondContact O-N 3.46Å; L714-L718 WeakPolarHBondContact O-CB 3.23Å; L714-L718 PolarHBondContact O-N 2.94Å
715	K	75	Confident	76.8	Confident	137 Å²	137	100.4 Å²	100.4	60%	0.596	52%	0.515	S	S	*	.	H	α-helix	trans	-69.1	-24.2	170.5	-77	167.7	-177.3	176.1	0	113.2	L711 A712 A713 K719	L711-K715 VanDerWaalsContact O-CB 3.24Å; L711-K715 WeakPolarHBondContact O-CB 3.36Å; L711-K715 WeakPolarHBondContact O-CD 3.49Å; L711-K715 WeakPolarHBondContact O-CG 3.46Å; L711-K715 PolarHBondContact O-N 2.83Å; A712-K715 CarbonylContact O-C 3.48Å; A712-K715 PolarHBondContact O-N 3.13Å; A713-K715 PolarHBondContact O-N 3.17Å; K715-K719 VanDerWaalsContact O-CG 3.29Å; K715-K719 WeakPolarHBondContact O-CG 3.45Å; K715-K719 PolarHBondContact O-N 3.42Å
716	G	75.9	Confident	76.7	Confident	27 Å²	27	98.8 Å²	98.8	28%	0.278	52%	0.515	S	S	.	.	H	α-helix	trans	-70.2	-58.7	170.2	0	0	0	0	0	110.6	A712 A713 L714 L718 K719 D720	A712-G716 PolarHBondContact O-N 3.38Å; A713-G716 WeakPolarHBondContact O-CA 3.46Å; A713-G716 PolarHBondContact O-N 2.95Å; L714-G716 VanDerWaalsContact C-N 3.29Å; L714-G716 PolarHBondContact O-N 3.46Å; G716-L718 VanDerWaalsContact C-N 3.28Å; G716-L718 PolarHBondContact O-N 2.9Å; G716-K719 WeakPolarHBondContact O-CA 3.41Å; G716-K719 WeakPolarHBondContact O-CB 3.4Å; G716-K719 PolarHBondContact O-N 2.71Å; G716-D720 PolarHBondContact O-N 3.33Å
717	A	75.2	Confident	76.6	Confident	54 Å²	54	100.4 Å²	100.4	45%	0.446	53%	0.527	S	S	.	.	H	α-helix	trans	-54.1	-43.2	176.3	0	0	0	0	0	112.4	A713 K719 D720 E721	A713-A717 PolarHBondContact O-N 3.32Å; A717-K719 VanDerWaalsContact C-N 3.3Å; A717-K719 PolarHBondContact O-N 3.03Å; A717-D720 PolarHBondContact O-N 2.81Å; A717-E721 WeakPolarHBondContact O-CB 3.35Å; A717-E721 PolarHBondContact O-N 3.33Å
718	L	74.3	Confident	76.6	Confident	109 Å²	109	96.7 Å²	96.7	57%	0.571	52%	0.516	S	S	*	.	H	α-helix	trans	-63.7	-31.1	175.2	-177.3	63.4	0	0	0	113	L714 G716 V722	L714-L718 WeakPolarHBondContact O-CB 3.23Å; L714-L718 PolarHBondContact O-N 2.94Å; G716-L718 VanDerWaalsContact C-N 3.28Å; G716-L718 PolarHBondContact O-N 2.9Å; L718-V722 HydrophobicContact CD1-CG2 4.47Å; L718-V722 VanDerWaalsContact O-CB 3.25Å; L718-V722 WeakPolarHBondContact O-CB 3.47Å; L718-V722 WeakPolarHBondContact O-CG2 3.47Å; L718-V722 PolarHBondContact O-N 3.45Å
719	K	79.2	Confident	76.5	Confident	156 Å²	156	93.6 Å²	93.6	68%	0.678	50%	0.504	S	S	*	.	H	α-helix	trans	-74.1	-39.8	174.1	-83.4	177.8	174.7	-171.1	0	112.2	K715 G716 A717 E721 V722 A723	K715-K719 VanDerWaalsContact O-CG 3.29Å; K715-K719 WeakPolarHBondContact O-CG 3.45Å; K715-K719 PolarHBondContact O-N 3.42Å; G716-K719 WeakPolarHBondContact O-CA 3.41Å; G716-K719 WeakPolarHBondContact O-CB 3.4Å; G716-K719 PolarHBondContact O-N 2.71Å; A717-K719 VanDerWaalsContact C-N 3.3Å; A717-K719 PolarHBondContact O-N 3.03Å; K719-E721 VanDerWaalsContact C-N 3.33Å; K719-V722 PolarHBondContact O-N 3.07Å; K719-A723 WeakPolarHBondContact O-CB 3.15Å; K719-A723 PolarHBondContact O-N 2.8Å
720	D	77.1	Confident	76.3	Confident	120 Å²	120	90.7 Å²	90.7	64%	0.642	50%	0.501	S	S	*	.	H	α-helix	trans	-67.9	-38	177.3	-61.9	-29.9	0	0	0	110.6	G716 A717 A723 A724	G716-D720 PolarHBondContact O-N 3.33Å; A717-D720 PolarHBondContact O-N 2.81Å; D720-A723 PolarHBondContact O-N 3.13Å; D720-A724 PolarHBondContact O-N 2.87Å
721	E	75.4	Confident	76.2	Confident	143 Å²	143	91 Å²	91	67%	0.668	50%	0.5	S	S	*	.	H	α-helix	trans	-72	-34.4	173.3	-169.5	155.4	-152.4	0	0	112.5	A717 K719 A724 H725	A717-E721 WeakPolarHBondContact O-CB 3.35Å; A717-E721 PolarHBondContact O-N 3.33Å; K719-E721 VanDerWaalsContact C-N 3.33Å; E721-A724 PolarHBondContact O-N 2.87Å; E721-H725 VanDerWaalsContact O-CB 3.22Å; E721-H725 WeakPolarHBondContact O-CB 3.3Å; E721-H725 PolarHBondContact O-N 3.33Å
722	V	78.7	Confident	76.1	Confident	70 Å²	70	89.8 Å²	89.8	42%	0.424	49%	0.493	S	S	.	.	H	α-helix	trans	-64.9	-38.7	168	163.7	0	0	0	0	111.5	L718 K719 H725 D726	L718-V722 HydrophobicContact CD1-CG2 4.47Å; L718-V722 VanDerWaalsContact O-CB 3.25Å; L718-V722 WeakPolarHBondContact O-CB 3.47Å; L718-V722 WeakPolarHBondContact O-CG2 3.47Å; L718-V722 PolarHBondContact O-N 3.45Å; K719-V722 PolarHBondContact O-N 3.07Å; V722-H725 CarbonylContact O-C 3.57Å; V722-H725 WeakPolarHBondContact O-CB 3.27Å; V722-H725 PolarHBondContact O-N 2.81Å; V722-D726 WeakPolarHBondContact O-CB 3.2Å; V722-D726 VanDerWaalsContact O-CG 3.31Å; V722-D726 PolarHBondContact O-N 2.79Å
723	A	77.5	Confident	75.8	Confident	52 Å²	52	92.2 Å²	92.2	43%	0.43	49%	0.493	S	S	.	.	H	α-helix	trans	-68.9	-35.2	176.4	0	0	0	0	0	112.5	K719 D720 D726 Q727	K719-A723 WeakPolarHBondContact O-CB 3.15Å; K719-A723 PolarHBondContact O-N 2.8Å; D720-A723 PolarHBondContact O-N 3.13Å; A723-D726 PolarHBondContact O-N 3.45Å; A723-Q727 PolarHBondContact O-N 2.89Å; A723-Q727 VanDerWaalsContact O-N 3.12Å
724	A	74.9	Confident	75.6	Confident	57 Å²	57	94.7 Å²	94.7	47%	0.471	49%	0.493	S	S	.	.	H	α-helix	trans	-67.1	-41.4	170	0	0	0	0	0	111.6	D720 E721 D726 Q727 E728	D720-A724 PolarHBondContact O-N 2.87Å; E721-A724 PolarHBondContact O-N 2.87Å; A724-D726 VanDerWaalsContact C-N 3.31Å; A724-D726 PolarHBondContact O-N 3.11Å; A724-Q727 PolarHBondContact O-N 3.15Å; A724-E728 PolarHBondContact O-N 2.86Å
725	H	73.8	Confident	75.4	Confident	118 Å²	118	94.1 Å²	94.1	55%	0.546	49%	0.487	S	S	.	.	H	α-helix	trans	-64.3	-33.2	172.6	-178.6	-79.5	0	0	0	111.9	E721 V722 E728 V729	E721-H725 VanDerWaalsContact O-CB 3.22Å; E721-H725 WeakPolarHBondContact O-CB 3.3Å; E721-H725 PolarHBondContact O-N 3.33Å; V722-H725 CarbonylContact O-C 3.57Å; V722-H725 WeakPolarHBondContact O-CB 3.27Å; V722-H725 PolarHBondContact O-N 2.81Å; H725-E728 CarbonylContact O-C 3.12Å; H725-E728 PolarHBondContact O-N 3.29Å; H725-V729 VanDerWaalsContact CE1-CG2 3.46Å; H725-V729 WeakPolarHBondContact CE1-CG2 3.48Å; H725-V729 WeakPolarHBondContact O-CB 3.46Å; H725-V729 VanDerWaalsContact O-CG2 3.28Å; H725-V729 WeakPolarHBondContact O-CG2 3.48Å; H725-V729 PolarHBondContact O-N 2.73Å
726	D	78.8	Confident	74.8	Confident	84 Å²	84	93.2 Å²	93.2	45%	0.449	48%	0.481	S	S	.	.	H	α-helix	trans	-69.6	-38.5	175.4	-78	-24.5	0	0	0	111.6	V722 A723 A724 E728 V729 D730	V722-D726 WeakPolarHBondContact O-CB 3.2Å; V722-D726 VanDerWaalsContact O-CG 3.31Å; V722-D726 PolarHBondContact O-N 2.79Å; A723-D726 PolarHBondContact O-N 3.45Å; A724-D726 VanDerWaalsContact C-N 3.31Å; A724-D726 PolarHBondContact O-N 3.11Å; D726-E728 VanDerWaalsContact C-N 3.33Å; D726-V729 CarbonylContact O-C 3.59Å; D726-V729 WeakPolarHBondContact O-CB 3.42Å; D726-V729 PolarHBondContact O-N 3.1Å; D726-D730 PolarHBondContact O-N 2.84Å
727	Q	75.3	Confident	74.7	Confident	137 Å²	137	98.5 Å²	98.5	64%	0.64	50%	0.499	S	S	*	.	H	α-helix	trans	-65.3	-34.3	169	-74.2	-167	-0.3	0	0	112.8	A723 A724 D730 K731	A723-Q727 PolarHBondContact O-N 2.89Å; A723-Q727 VanDerWaalsContact O-N 3.12Å; A724-Q727 PolarHBondContact O-N 3.15Å; Q727-D730 PolarHBondContact O-N 3.46Å; Q727-K731 PolarHBondContact O-N 2.91Å
728	E	76.8	Confident	74.4	Confident	82 Å²	82	101.8 Å²	101.8	38%	0.383	50%	0.503	S	S	.	.	H	α-helix	trans	-70.9	-36.5	171.9	-161.5	59.5	-145.8	0	0	111.1	A724 H725 D726 D730 K731 M732	A724-E728 PolarHBondContact O-N 2.86Å; H725-E728 CarbonylContact O-C 3.12Å; H725-E728 PolarHBondContact O-N 3.29Å; D726-E728 VanDerWaalsContact C-N 3.33Å; E728-D730 VanDerWaalsContact C-N 3.29Å; E728-D730 PolarHBondContact O-N 3.38Å; E728-K731 CarbonylContact O-C 3.53Å; E728-K731 WeakPolarHBondContact O-CB 3.4Å; E728-K731 PolarHBondContact O-N 2.98Å; E728-K731 WeakPolarHBondContact OE2-CE 3.44Å; E728-K731 IonicContact OE2-NZ 2.68Å; E728-K731 PolarHBondContact OE2-NZ 3.01Å; E728-M732 WeakPolarHBondContact O-CB 3.37Å; E728-M732 VanDerWaalsContact O-CG 3.22Å; E728-M732 WeakPolarHBondContact O-CG 3.48Å; E728-M732 PolarHBondContact O-N 2.99Å
729	V	75.5	Confident	74.2	Confident	41 Å²	41	99.4 Å²	99.4	25%	0.248	49%	0.489	C	S	.	.	H	α-helix	trans	-63.2	-33.4	172.9	159.2	0	0	0	0	111.5	H725 D726 M732 K733	H725-V729 VanDerWaalsContact CE1-CG2 3.46Å; H725-V729 WeakPolarHBondContact CE1-CG2 3.48Å; H725-V729 WeakPolarHBondContact O-CB 3.46Å; H725-V729 VanDerWaalsContact O-CG2 3.28Å; H725-V729 WeakPolarHBondContact O-CG2 3.48Å; H725-V729 PolarHBondContact O-N 2.73Å; D726-V729 CarbonylContact O-C 3.59Å; D726-V729 WeakPolarHBondContact O-CB 3.42Å; D726-V729 PolarHBondContact O-N 3.1Å; V729-M732 CarbonylContact O-C 3.58Å; V729-M732 PolarHBondContact O-N 3.33Å; V729-K733 VanDerWaalsContact O-CG 3.31Å; V729-K733 WeakPolarHBondContact O-CG 3.32Å; V729-K733 PolarHBondContact O-N 3.22Å
730	D	77.1	Confident	73.7	Confident	92 Å²	92	96.3 Å²	96.3	49%	0.492	48%	0.478	S	S	.	.	H	α-helix	trans	-70.1	-39.1	172.6	-79	-16.1	0	0	0	112.6	D726 Q727 E728 M732 K733 E734	D726-D730 PolarHBondContact O-N 2.84Å; Q727-D730 PolarHBondContact O-N 3.46Å; E728-D730 VanDerWaalsContact C-N 3.29Å; E728-D730 PolarHBondContact O-N 3.38Å; D730-M732 VanDerWaalsContact C-N 3.31Å; D730-M732 PolarHBondContact O-N 3.17Å; D730-K733 WeakPolarHBondContact O-CB 3.29Å; D730-K733 PolarHBondContact O-N 3.38Å; D730-K733 WeakPolarHBondContact OD1-CD 3.48Å; D730-K733 WeakPolarHBondContact OD1-CE 3.25Å; D730-K733 IonicContact OD1-NZ 3.33Å; D730-K733 PolarHBondContact OD1-NZ 3.35Å; D730-E734 PolarHBondContact O-N 3.42Å; D730-E734 VanDerWaalsContact O-N 3.12Å
731	K	75.6	Confident	73.4	Confident	106 Å²	106	94.1 Å²	94.1	46%	0.461	47%	0.472	S	S	.	.	H	α-helix	trans	-63.9	-39.2	168.6	-62.8	171.7	-141.4	157.9	0	111.3	Q727 E728 K733 E734 Q735	Q727-K731 PolarHBondContact O-N 2.91Å; E728-K731 CarbonylContact O-C 3.53Å; E728-K731 WeakPolarHBondContact O-CB 3.4Å; E728-K731 PolarHBondContact O-N 2.98Å; E728-K731 WeakPolarHBondContact OE2-CE 3.44Å; E728-K731 IonicContact OE2-NZ 2.68Å; E728-K731 PolarHBondContact OE2-NZ 3.01Å; K731-K733 VanDerWaalsContact C-N 3.31Å; K731-K733 PolarHBondContact O-N 3.21Å; K731-E734 PolarHBondContact O-N 3.2Å; K731-Q735 WeakPolarHBondContact O-CG 3.35Å; K731-Q735 PolarHBondContact O-N 3.3Å
732	M	71.6	Confident	73.2	Confident	62 Å²	62	95 Å²	95	31%	0.305	47%	0.47	S	S	.	.	H	α-helix	trans	-66.4	-30.1	174.1	-69.3	-70.5	-67.3	0	0	111.5	E728 V729 D730 Q735 Y736	E728-M732 WeakPolarHBondContact O-CB 3.37Å; E728-M732 VanDerWaalsContact O-CG 3.22Å; E728-M732 WeakPolarHBondContact O-CG 3.48Å; E728-M732 PolarHBondContact O-N 2.99Å; V729-M732 CarbonylContact O-C 3.58Å; V729-M732 PolarHBondContact O-N 3.33Å; D730-M732 VanDerWaalsContact C-N 3.31Å; D730-M732 PolarHBondContact O-N 3.17Å; M732-Q735 CarbonylContact O-C 3.59Å; M732-Q735 WeakPolarHBondContact O-CB 3.44Å; M732-Q735 PolarHBondContact O-N 2.78Å; M732-Y736 VanDerWaalsContact C-CD2 3.5Å; M732-Y736 HydrophobicContact CB-CD2 4.31Å; M732-Y736 HydrophobicContact CB-CE2 3.89Å; M732-Y736 HydrophobicContact CE-CE1 4.3Å; M732-Y736 WeakPolarHBondContact O-CB 3.44Å; M732-Y736 WeakPolarHBondContact O-CD2 3.33Å; M732-Y736 PolarHBondContact O-N 3.07Å
733	K	74.1	Confident	72.6	Confident	109 Å²	109	96 Å²	96	47%	0.474	47%	0.472	S	S	.	.	H	α-helix	trans	-65.5	-41.4	169.9	-74	165.5	-161.2	155.5	0	111.6	V729 D730 K731 Q735 Y736 E737	V729-K733 VanDerWaalsContact O-CG 3.31Å; V729-K733 WeakPolarHBondContact O-CG 3.32Å; V729-K733 PolarHBondContact O-N 3.22Å; D730-K733 WeakPolarHBondContact O-CB 3.29Å; D730-K733 PolarHBondContact O-N 3.38Å; D730-K733 WeakPolarHBondContact OD1-CD 3.48Å; D730-K733 WeakPolarHBondContact OD1-CE 3.25Å; D730-K733 IonicContact OD1-NZ 3.33Å; D730-K733 PolarHBondContact OD1-NZ 3.35Å; K731-K733 VanDerWaalsContact C-N 3.31Å; K731-K733 PolarHBondContact O-N 3.21Å; K733-Q735 VanDerWaalsContact C-N 3.26Å; K733-Q735 PolarHBondContact O-N 3.24Å; K733-Y736 CarbonylContact O-C 3.48Å; K733-Y736 WeakPolarHBondContact O-CA 3.49Å; K733-Y736 PolarHBondContact O-N 3.38Å; K733-E737 PolarHBondContact O-N 3.2Å
734	E	70.9	Confident	72.2	Confident	118 Å²	118	99.8 Å²	99.8	55%	0.551	48%	0.481	S	S	*	.	H	α-helix	trans	-68.5	-25.9	174.4	-148.9	-145.4	133.9	0	0	112.5	D730 K731 K738	D730-E734 PolarHBondContact O-N 3.42Å; D730-E734 VanDerWaalsContact O-N 3.12Å; K731-E734 PolarHBondContact O-N 3.2Å; E734-K738 PolarHBondContact O-NZ 2.94Å; E734-K738 IonicContact OE1-NZ 2.63Å; E734-K738 PolarHBondContact OE1-NZ 3.31Å
735	Q	69.9	Low	71.8	Confident	102 Å²	102	104.2 Å²	104.2	48%	0.477	49%	0.494	S	S	.	.	H	α-helix	trans	-74.1	-38.2	163.9	-65.3	178	42.9	0	0	111.3	K731 M732 K733 E737 K738 E739	K731-Q735 WeakPolarHBondContact O-CG 3.35Å; K731-Q735 PolarHBondContact O-N 3.3Å; M732-Q735 CarbonylContact O-C 3.59Å; M732-Q735 WeakPolarHBondContact O-CB 3.44Å; M732-Q735 PolarHBondContact O-N 2.78Å; K733-Q735 VanDerWaalsContact C-N 3.26Å; K733-Q735 PolarHBondContact O-N 3.24Å; Q735-E737 VanDerWaalsContact C-N 3.34Å; Q735-E737 PolarHBondContact O-N 3.33Å; Q735-K738 CarbonylContact O-C 3.47Å; Q735-K738 WeakPolarHBondContact O-CA 3.38Å; Q735-K738 WeakPolarHBondContact O-CB 3.11Å; Q735-K738 PolarHBondContact O-N 2.59Å; Q735-K738 VanDerWaalsContact O-N 3.09Å; Q735-E739 WeakPolarHBondContact O-CB 3.49Å; Q735-E739 PolarHBondContact O-N 3.07Å
736	Y	62.5	Low	71.3	Confident	119 Å²	119	100.6 Å²	100.6	47%	0.467	48%	0.482	S	S	.	.	H	α-helix	trans	-69.2	-24.1	-178.6	-69.4	-46.8	0	0	0	113.2	M732 K733 E739 I740	M732-Y736 VanDerWaalsContact C-CD2 3.5Å; M732-Y736 HydrophobicContact CB-CD2 4.31Å; M732-Y736 HydrophobicContact CB-CE2 3.89Å; M732-Y736 HydrophobicContact CE-CE1 4.3Å; M732-Y736 WeakPolarHBondContact O-CB 3.44Å; M732-Y736 WeakPolarHBondContact O-CD2 3.33Å; M732-Y736 PolarHBondContact O-N 3.07Å; K733-Y736 CarbonylContact O-C 3.48Å; K733-Y736 WeakPolarHBondContact O-CA 3.49Å; K733-Y736 PolarHBondContact O-N 3.38Å; Y736-E739 HydrophobicContact CD1-CB 4.22Å; Y736-E739 HydrophobicContact CD1-CG 4.38Å; Y736-E739 CarbonylContact O-C 3.58Å; Y736-E739 PolarHBondContact O-N 3.39Å; Y736-I740 VanDerWaalsContact O-CB 3.31Å; Y736-I740 WeakPolarHBondContact O-CB 3.38Å; Y736-I740 WeakPolarHBondContact O-CD1 3.48Å; Y736-I740 WeakPolarHBondContact O-CG1 3.31Å; Y736-I740 PolarHBondContact O-N 3.25Å
737	E	73.9	Confident	70.7	Confident	138 Å²	138	101.5 Å²	101.5	65%	0.645	49%	0.486	S	S	*	.	H	α-helix	trans	-69.3	-37	168.5	-71.6	-168.2	125.5	0	0	112.2	K733 Q735 E739 I740 S741	K733-E737 PolarHBondContact O-N 3.2Å; Q735-E737 VanDerWaalsContact C-N 3.34Å; Q735-E737 PolarHBondContact O-N 3.33Å; E737-E739 VanDerWaalsContact C-N 3.34Å; E737-I740 PolarHBondContact O-N 3.29Å; E737-S741 PolarHBondContact O-N 3.38Å; E737-S741 PolarHBondContact O-OG 3.24Å
738	K	69.6	Low	70.5	Confident	123 Å²	123	100.2 Å²	100.2	54%	0.535	48%	0.48	S	S	.	.	H	α-helix	trans	-68.9	-38	172.4	-54.4	176.8	-175.9	82.7	0	109.7	E734 Q735 S741 R742	E734-K738 PolarHBondContact O-NZ 2.94Å; E734-K738 IonicContact OE1-NZ 2.63Å; E734-K738 PolarHBondContact OE1-NZ 3.31Å; Q735-K738 CarbonylContact O-C 3.47Å; Q735-K738 WeakPolarHBondContact O-CA 3.38Å; Q735-K738 WeakPolarHBondContact O-CB 3.11Å; Q735-K738 PolarHBondContact O-N 2.59Å; Q735-K738 VanDerWaalsContact O-N 3.09Å; K738-S741 WeakPolarHBondContact O-CB 3.33Å; K738-S741 PolarHBondContact O-N 3.26Å; K738-R742 PolarHBondContact O-N 3.45Å
739	E	70.7	Confident	70.2	Confident	59 Å²	59	102.5 Å²	102.5	28%	0.276	49%	0.491	S	S	.	.	H	α-helix	trans	-67.3	-34.6	172.2	-160.8	72.8	159.6	0	0	112.4	Q735 Y736 E737 S741 R742 L743	Q735-E739 WeakPolarHBondContact O-CB 3.49Å; Q735-E739 PolarHBondContact O-N 3.07Å; Y736-E739 HydrophobicContact CD1-CB 4.22Å; Y736-E739 HydrophobicContact CD1-CG 4.38Å; Y736-E739 CarbonylContact O-C 3.58Å; Y736-E739 PolarHBondContact O-N 3.39Å; E737-E739 VanDerWaalsContact C-N 3.34Å; E739-S741 VanDerWaalsContact C-N 3.26Å; E739-S741 PolarHBondContact O-N 3.49Å; E739-R742 VanDerWaalsContact CD-NE 3.33Å; E739-R742 CarbonylContact O-C 3.47Å; E739-R742 WeakPolarHBondContact O-CA 3.36Å; E739-R742 VanDerWaalsContact O-CB 3.29Å; E739-R742 WeakPolarHBondContact O-CB 3.44Å; E739-R742 PolarHBondContact O-N 3Å; E739-R742 IonicContact OE1-CZ 3.2Å; E739-R742 IonicContact OE1-NE 3.35Å; E739-R742 PolarHBondContact OE1-NE 3.04Å; E739-R742 IonicContact OE1-NH2 3.6Å; E739-R742 PolarHBondContact OE1-NH2 3.32Å; E739-R742 IonicContact OE2-CZ 3.4Å; E739-R742 IonicContact OE2-NE 3.87Å; E739-R742 PolarHBondContact OE2-NE 2.78Å; E739-R742 IonicContact OE2-NH2 2.65Å; E739-L743 HydrophobicContact CG-CD1 4.17Å; E739-L743 HydrophobicContact CG-CG 4.38Å; E739-L743 WeakPolarHBondContact O-CB 3.28Å; E739-L743 WeakPolarHBondContact O-CG 3.44Å; E739-L743 PolarHBondContact O-N 3.13Å
740	I	68.9	Low	69.5	Low	90 Å²	90	102.8 Å²	102.8	46%	0.462	50%	0.497	S	S	.	.	H	α-helix	trans	-63.6	-36.5	175.2	-80.6	160.2	0	0	0	110.2	Y736 E737 R742 L743 Q744	Y736-I740 VanDerWaalsContact O-CB 3.31Å; Y736-I740 WeakPolarHBondContact O-CB 3.38Å; Y736-I740 WeakPolarHBondContact O-CD1 3.48Å; Y736-I740 WeakPolarHBondContact O-CG1 3.31Å; Y736-I740 PolarHBondContact O-N 3.25Å; E737-I740 PolarHBondContact O-N 3.29Å; I740-R742 VanDerWaalsContact C-N 3.32Å; I740-L743 HydrophobicContact CG1-CD1 4.43Å; I740-L743 PolarHBondContact O-N 2.78Å; I740-Q744 WeakPolarHBondContact O-CG 3.43Å; I740-Q744 PolarHBondContact O-N 3.44Å
741	S	69.3	Low	69.1	Low	74 Å²	74	103.8 Å²	103.8	52%	0.517	50%	0.497	S	S	.	.	H	α-helix	trans	-65.3	-36.1	171	-54.1	0	0	0	0	111.9	E737 K738 E739	E737-S741 PolarHBondContact O-N 3.38Å; E737-S741 PolarHBondContact O-OG 3.24Å; K738-S741 WeakPolarHBondContact O-CB 3.33Å; K738-S741 PolarHBondContact O-N 3.26Å; E739-S741 VanDerWaalsContact C-N 3.26Å; E739-S741 PolarHBondContact O-N 3.49Å
742	R	72.1	Confident	68.7	Low	161 Å²	161	106.1 Å²	106.1	61%	0.608	51%	0.51	S	S	*	.	H	α-helix	trans	-70	-36.4	172.2	-163.3	168.8	81.8	101.6	-4.8	112.5	K738 E739 I740 Q744 M745 S746	K738-R742 PolarHBondContact O-N 3.45Å; E739-R742 VanDerWaalsContact CD-NE 3.33Å; E739-R742 CarbonylContact O-C 3.47Å; E739-R742 WeakPolarHBondContact O-CA 3.36Å; E739-R742 VanDerWaalsContact O-CB 3.29Å; E739-R742 WeakPolarHBondContact O-CB 3.44Å; E739-R742 PolarHBondContact O-N 3Å; E739-R742 IonicContact OE1-CZ 3.2Å; E739-R742 IonicContact OE1-NE 3.35Å; E739-R742 PolarHBondContact OE1-NE 3.04Å; E739-R742 IonicContact OE1-NH2 3.6Å; E739-R742 PolarHBondContact OE1-NH2 3.32Å; E739-R742 IonicContact OE2-CZ 3.4Å; E739-R742 IonicContact OE2-NE 3.87Å; E739-R742 PolarHBondContact OE2-NE 2.78Å; E739-R742 IonicContact OE2-NH2 2.65Å; I740-R742 VanDerWaalsContact C-N 3.32Å; R742-Q744 VanDerWaalsContact C-N 3.35Å; R742-M745 WeakPolarHBondContact O-CB 3.43Å; R742-M745 PolarHBondContact O-N 3.24Å; R742-S746 PolarHBondContact O-N 3.31Å
743	L	65.8	Low	68.4	Low	92 Å²	92	108.4 Å²	108.4	48%	0.482	52%	0.523	S	S	.	.	H	α-helix	trans	-72.8	-25.3	178	-71	163.6	0	0	0	112.2	E739 I740 M745 S746 L747	E739-L743 HydrophobicContact CG-CD1 4.17Å; E739-L743 HydrophobicContact CG-CG 4.38Å; E739-L743 WeakPolarHBondContact O-CB 3.28Å; E739-L743 WeakPolarHBondContact O-CG 3.44Å; E739-L743 PolarHBondContact O-N 3.13Å; I740-L743 HydrophobicContact CG1-CD1 4.43Å; I740-L743 PolarHBondContact O-N 2.78Å; L743-M745 VanDerWaalsContact C-N 3.3Å; L743-S746 WeakPolarHBondContact CA-OG 3.37Å; L743-S746 CarbonylContact O-C 3.5Å; L743-S746 PolarHBondContact O-N 2.8Å; L743-S746 PolarHBondContact O-OG 3.46Å; L743-L747 WeakPolarHBondContact O-CB 3.46Å; L743-L747 PolarHBondContact O-N 2.87Å
744	Q	68.3	Low	68	Low	132 Å²	132	106.1 Å²	106.1	62%	0.617	52%	0.521	S	S	*	.	H	α-helix	trans	-67.6	-30.5	168.5	-75.2	175.3	11.8	0	0	112.2	I740 R742 L747	I740-Q744 WeakPolarHBondContact O-CG 3.43Å; I740-Q744 PolarHBondContact O-N 3.44Å; R742-Q744 VanDerWaalsContact C-N 3.35Å; Q744-L747 WeakPolarHBondContact O-CB 3.37Å
745	M	66.9	Low	68	Low	149 Å²	149	102.9 Å²	102.9	73%	0.734	52%	0.515	S	S	*	.	H	α-helix	trans	-75.7	-44.4	170	-65.8	-179.3	63.2	0	0	111.4	R742 L743 L747 E748	R742-M745 WeakPolarHBondContact O-CB 3.43Å; R742-M745 PolarHBondContact O-N 3.24Å; L743-M745 VanDerWaalsContact C-N 3.3Å; M745-L747 PolarHBondContact O-N 2.95Å; M745-E748 PolarHBondContact O-N 3.04Å; M745-E748 VanDerWaalsContact O-N 3.15Å
746	S	62.9	Low	68.1	Low	43 Å²	43	100.4 Å²	100.4	30%	0.301	51%	0.512	S	S	.	.	H	α-helix	trans	-69.9	-12.7	176.3	80.3	0	0	0	0	113.6	R742 L743 E748 E749 A750	R742-S746 PolarHBondContact O-N 3.31Å; L743-S746 WeakPolarHBondContact CA-OG 3.37Å; L743-S746 CarbonylContact O-C 3.5Å; L743-S746 PolarHBondContact O-N 2.8Å; L743-S746 PolarHBondContact O-OG 3.46Å; S746-E748 VanDerWaalsContact C-N 3.28Å; S746-E748 PolarHBondContact O-N 3.38Å; S746-E749 PolarHBondContact O-N 3.29Å; S746-A750 WeakPolarHBondContact O-CB 3.47Å; S746-A750 PolarHBondContact O-N 2.92Å
747	L	67.2	Low	68.3	Low	102 Å²	102	97 Å²	97	53%	0.534	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-35.1	169.1	-170.8	74.8	0	0	0	111.9	L743 Q744 M745 A750 K751	L743-L747 WeakPolarHBondContact O-CB 3.46Å; L743-L747 PolarHBondContact O-N 2.87Å; Q744-L747 WeakPolarHBondContact O-CB 3.37Å; M745-L747 PolarHBondContact O-N 2.95Å; L747-A750 WeakPolarHBondContact O-CB 3.48Å; L747-A750 PolarHBondContact O-N 3.44Å; L747-K751 PolarHBondContact O-N 3.35Å
748	E	70.4	Confident	68.3	Low	111 Å²	111	95.7 Å²	95.7	52%	0.519	51%	0.505	S	S	.	.	H	α-helix	trans	-76.8	-36.1	179.3	-145.3	64.3	-147	0	0	111.3	M745 S746 A750 K751 Q752	M745-E748 PolarHBondContact O-N 3.04Å; M745-E748 VanDerWaalsContact O-N 3.15Å; S746-E748 VanDerWaalsContact C-N 3.28Å; S746-E748 PolarHBondContact O-N 3.38Å; E748-A750 VanDerWaalsContact C-N 3.32Å; E748-K751 WeakPolarHBondContact O-CB 3.34Å; E748-K751 PolarHBondContact O-N 2.97Å; E748-K751 WeakPolarHBondContact OE1-CD 3.29Å; E748-K751 IonicContact OE1-NZ 3.37Å; E748-K751 PolarHBondContact OE1-NZ 2.82Å; E748-K751 IonicContact OE2-NZ 2.77Å; E748-K751 PolarHBondContact OE2-NZ 3.42Å; E748-Q752 PolarHBondContact O-N 3.36Å
749	E	70.3	Confident	68.4	Low	129 Å²	129	98.3 Å²	98.3	60%	0.603	51%	0.511	S	S	*	.	H	α-helix	trans	-64.6	-37.8	166.3	-63.1	-176	135.2	0	0	111.2	S746 K751 Q752 N753	S746-E749 PolarHBondContact O-N 3.29Å; E749-K751 PolarHBondContact O-N 3.18Å; E749-Q752 PolarHBondContact O-N 2.81Å; E749-N753 PolarHBondContact O-N 2.84Å
750	A	62.4	Low	68.5	Low	47 Å²	47	101.5 Å²	101.5	39%	0.388	53%	0.526	S	S	.	.	H	α-helix	trans	-65.2	-24.2	176.2	0	0	0	0	0	112.9	S746 L747 E748 S754	S746-A750 WeakPolarHBondContact O-CB 3.47Å; S746-A750 PolarHBondContact O-N 2.92Å; L747-A750 WeakPolarHBondContact O-CB 3.48Å; L747-A750 PolarHBondContact O-N 3.44Å; E748-A750 VanDerWaalsContact C-N 3.32Å; A750-S754 VanDerWaalsContact O-CB 3.23Å; A750-S754 WeakPolarHBondContact O-CB 3.41Å; A750-S754 PolarHBondContact O-N 3.46Å
751	K	68.1	Low	68.6	Low	113 Å²	113	104 Å²	104	49%	0.491	53%	0.534	S	S	.	.	H	α-helix	trans	-71	-37.2	168.9	-72	163.6	178.3	167.4	0	112.2	L747 E748 E749 S754 A755	L747-K751 PolarHBondContact O-N 3.35Å; E748-K751 WeakPolarHBondContact O-CB 3.34Å; E748-K751 PolarHBondContact O-N 2.97Å; E748-K751 WeakPolarHBondContact OE1-CD 3.29Å; E748-K751 IonicContact OE1-NZ 3.37Å; E748-K751 PolarHBondContact OE1-NZ 2.82Å; E748-K751 IonicContact OE2-NZ 2.77Å; E748-K751 PolarHBondContact OE2-NZ 3.42Å; E749-K751 PolarHBondContact O-N 3.18Å; K751-S754 WeakPolarHBondContact O-CB 3.44Å; K751-S754 PolarHBondContact O-N 2.78Å; K751-A755 PolarHBondContact O-N 2.87Å
752	Q	66.7	Low	68.9	Low	156 Å²	156	103.1 Å²	103.1	73%	0.729	53%	0.531	S	S	*	.	H	α-helix	trans	-68.4	-42.8	171.4	-67.2	-165.9	-1.9	0	0	111.2	E748 E749 S754 A755 A756	E748-Q752 PolarHBondContact O-N 3.36Å; E749-Q752 PolarHBondContact O-N 2.81Å; Q752-S754 VanDerWaalsContact C-N 3.27Å; Q752-S754 PolarHBondContact O-N 3.11Å; Q752-A755 WeakPolarHBondContact O-CB 3.39Å; Q752-A755 PolarHBondContact O-N 2.94Å; Q752-A755 VanDerWaalsContact O-N 3.13Å; Q752-A756 PolarHBondContact O-N 3.5Å
753	N	65.4	Low	69.1	Low	109 Å²	109	102.1 Å²	102.1	58%	0.583	53%	0.533	S	S	*	.	H	α-helix	trans	-64.8	-29.8	173.6	-67.5	-26.9	0	0	0	112.2	E749 A755 A756 A757	E749-N753 PolarHBondContact O-N 2.84Å; N753-A755 VanDerWaalsContact C-N 3.33Å; N753-A755 PolarHBondContact O-N 2.82Å; N753-A756 WeakPolarHBondContact O-CB 3.3Å; N753-A756 PolarHBondContact O-N 3.34Å; N753-A756 VanDerWaalsContact O-N 3.16Å; N753-A757 WeakPolarHBondContact O-CB 3.33Å; N753-A757 PolarHBondContact O-N 2.62Å
754	S	65.8	Low	69.4	Low	61 Å²	61	102 Å²	102	43%	0.427	54%	0.536	S	S	.	.	H	α-helix	trans	-62.9	-38	172.3	-175.8	0	0	0	0	111.8	A750 K751 Q752 A756 A757 I758	A750-S754 VanDerWaalsContact O-CB 3.23Å; A750-S754 WeakPolarHBondContact O-CB 3.41Å; A750-S754 PolarHBondContact O-N 3.46Å; K751-S754 WeakPolarHBondContact O-CB 3.44Å; K751-S754 PolarHBondContact O-N 2.78Å; Q752-S754 VanDerWaalsContact C-N 3.27Å; Q752-S754 PolarHBondContact O-N 3.11Å; S754-A756 VanDerWaalsContact C-N 3.32Å; S754-A756 PolarHBondContact O-N 3.46Å; S754-A757 PolarHBondContact O-N 3.33Å; S754-I758 VanDerWaalsContact O-CG1 3.28Å; S754-I758 WeakPolarHBondContact O-CG1 3.49Å; S754-I758 PolarHBondContact O-N 3.28Å
755	A	71.3	Confident	69.7	Low	51 Å²	51	101.9 Å²	101.9	42%	0.421	54%	0.535	S	S	.	.	H	α-helix	trans	-68.2	-29.6	173.7	0	0	0	0	0	113	K751 Q752 N753	K751-A755 PolarHBondContact O-N 2.87Å; Q752-A755 WeakPolarHBondContact O-CB 3.39Å; Q752-A755 PolarHBondContact O-N 2.94Å; Q752-A755 VanDerWaalsContact O-N 3.13Å; N753-A755 VanDerWaalsContact C-N 3.33Å; N753-A755 PolarHBondContact O-N 2.82Å
756	A	71.5	Confident	70.2	Confident	50 Å²	50	97.4 Å²	97.4	41%	0.413	52%	0.522	S	S	.	.	H	α-helix	trans	-71.5	-47.6	169.4	0	0	0	0	0	111.4	Q752 N753 S754 I758 R759 E760	Q752-A756 PolarHBondContact O-N 3.5Å; N753-A756 WeakPolarHBondContact O-CB 3.3Å; N753-A756 PolarHBondContact O-N 3.34Å; N753-A756 VanDerWaalsContact O-N 3.16Å; S754-A756 VanDerWaalsContact C-N 3.32Å; S754-A756 PolarHBondContact O-N 3.46Å; A756-I758 PolarHBondContact O-N 3.32Å; A756-R759 WeakPolarHBondContact O-CA 3.34Å; A756-R759 WeakPolarHBondContact O-CB 3.34Å; A756-R759 PolarHBondContact O-N 3.49Å; A756-E760 PolarHBondContact O-N 3.25Å
757	A	67.1	Low	70.9	Confident	48 Å²	48	98 Å²	98	40%	0.397	53%	0.529	S	S	.	.	H	α-helix	trans	-61.7	-24.5	177.3	0	0	0	0	0	113.2	N753 S754 K761	N753-A757 WeakPolarHBondContact O-CB 3.33Å; N753-A757 PolarHBondContact O-N 2.62Å; S754-A757 PolarHBondContact O-N 3.33Å; A757-K761 WeakPolarHBondContact O-CB 3.43Å; A757-K761 PolarHBondContact O-N 3.22Å
758	I	73.5	Confident	71.3	Confident	110 Å²	110	98.4 Å²	98.4	56%	0.564	53%	0.527	S	S	*	.	H	α-helix	trans	-69.9	-34.5	170.7	-74.8	164.4	0	0	0	111.8	S754 A756 A762	S754-I758 VanDerWaalsContact O-CG1 3.28Å; S754-I758 WeakPolarHBondContact O-CG1 3.49Å; S754-I758 PolarHBondContact O-N 3.28Å; A756-I758 PolarHBondContact O-N 3.32Å; I758-A762 PolarHBondContact O-N 3.32Å; I758-A762 VanDerWaalsContact O-N 3.14Å
759	R	72.8	Confident	71.7	Confident	177 Å²	177	95 Å²	95	67%	0.668	52%	0.522	S	S	*	.	H	α-helix	trans	-73	-47.3	173	-62.4	-172.9	-176.7	115.1	0.8	111	A756 K761 A762 E763	A756-R759 WeakPolarHBondContact O-CA 3.34Å; A756-R759 WeakPolarHBondContact O-CB 3.34Å; A756-R759 PolarHBondContact O-N 3.49Å; R759-K761 VanDerWaalsContact C-N 3.27Å; R759-K761 PolarHBondContact O-N 3.23Å; R759-A762 WeakPolarHBondContact O-CA 3.29Å; R759-A762 WeakPolarHBondContact O-CB 3.39Å; R759-A762 PolarHBondContact O-N 3.33Å; R759-E763 PolarHBondContact O-N 3.39Å
760	E	71	Confident	72.2	Confident	127 Å²	127	95.3 Å²	95.3	59%	0.593	52%	0.523	S	S	*	.	H	α-helix	trans	-57.6	-41.4	174.4	-171.5	178.8	-173.7	0	0	111.2	A756 A762 E763 V764	A756-E760 PolarHBondContact O-N 3.25Å; E760-A762 VanDerWaalsContact C-N 3.34Å; E760-A762 PolarHBondContact O-N 3.5Å; E760-E763 PolarHBondContact O-N 3.46Å; E760-V764 HydrophobicContact CG-CG2 4.49Å; E760-V764 WeakPolarHBondContact O-CB 3.5Å; E760-V764 VanDerWaalsContact O-CG2 3.27Å; E760-V764 WeakPolarHBondContact O-CG2 3.45Å; E760-V764 PolarHBondContact O-N 3.38Å
761	K	72.7	Confident	73	Confident	143 Å²	143	95.5 Å²	95.5	62%	0.622	53%	0.525	S	S	*	.	H	α-helix	trans	-60.8	-38.7	172.5	-179.6	-175.9	174	-169.8	0	112.6	A757 R759 V764 E765	A757-K761 WeakPolarHBondContact O-CB 3.43Å; A757-K761 PolarHBondContact O-N 3.22Å; R759-K761 VanDerWaalsContact C-N 3.27Å; R759-K761 PolarHBondContact O-N 3.23Å; K761-V764 PolarHBondContact O-N 3.2Å; K761-E765 VanDerWaalsContact O-CB 3.28Å; K761-E765 WeakPolarHBondContact O-CB 3.45Å; K761-E765 PolarHBondContact O-N 3.43Å
762	A	75.6	Confident	73.5	Confident	55 Å²	55	95.2 Å²	95.2	46%	0.455	53%	0.525	S	S	.	.	H	α-helix	trans	-69.5	-36.4	176.7	0	0	0	0	0	111.9	I758 R759 E760 E765 A766	I758-A762 PolarHBondContact O-N 3.32Å; I758-A762 VanDerWaalsContact O-N 3.14Å; R759-A762 WeakPolarHBondContact O-CA 3.29Å; R759-A762 WeakPolarHBondContact O-CB 3.39Å; R759-A762 PolarHBondContact O-N 3.33Å; E760-A762 VanDerWaalsContact C-N 3.34Å; E760-A762 PolarHBondContact O-N 3.5Å; A762-E765 PolarHBondContact O-N 2.87Å; A762-A766 WeakPolarHBondContact O-CB 3.42Å; A762-A766 PolarHBondContact O-N 3.3Å
763	E	75.7	Confident	74.2	Confident	140 Å²	140	89.1 Å²	89.1	65%	0.654	51%	0.505	S	S	*	.	H	α-helix	trans	-69.8	-39	173.5	-69.6	173.7	-160.7	0	0	111.7	R759 E760 A766 A767	R759-E763 PolarHBondContact O-N 3.39Å; E760-E763 PolarHBondContact O-N 3.46Å; E763-A766 PolarHBondContact O-N 3.43Å; E763-A767 WeakPolarHBondContact O-CB 3.48Å; E763-A767 PolarHBondContact O-N 3.48Å
764	V	72.4	Confident	75	Confident	89 Å²	89	89 Å²	89	54%	0.539	50%	0.501	S	S	.	.	H	α-helix	trans	-68.1	-34.1	172.1	169.2	0	0	0	0	111.8	E760 K761 A767 K768	E760-V764 HydrophobicContact CG-CG2 4.49Å; E760-V764 WeakPolarHBondContact O-CB 3.5Å; E760-V764 VanDerWaalsContact O-CG2 3.27Å; E760-V764 WeakPolarHBondContact O-CG2 3.45Å; E760-V764 PolarHBondContact O-N 3.38Å; K761-V764 PolarHBondContact O-N 3.2Å; V764-A767 PolarHBondContact O-N 2.97Å; V764-K768 VanDerWaalsContact O-CB 3.23Å; V764-K768 WeakPolarHBondContact O-CB 3.46Å; V764-K768 PolarHBondContact O-N 2.84Å
765	E	73.9	Confident	75.7	Confident	130 Å²	130	88.3 Å²	88.3	61%	0.607	50%	0.498	S	S	*	.	H	α-helix	trans	-70.4	-38.1	172.5	-174.8	166.4	-125.7	0	0	111.5	K761 A762 K768 G769	K761-E765 VanDerWaalsContact O-CB 3.28Å; K761-E765 WeakPolarHBondContact O-CB 3.45Å; K761-E765 PolarHBondContact O-N 3.43Å; A762-E765 PolarHBondContact O-N 2.87Å; E765-K768 PolarHBondContact O-N 2.83Å; E765-G769 PolarHBondContact O-N 2.81Å
766	A	76.9	Confident	76.5	Confident	55 Å²	55	87.2 Å²	87.2	46%	0.455	49%	0.492	S	S	.	.	H	α-helix	trans	-64.2	-42.5	170.9	0	0	0	0	0	111.8	A762 E763 G769 Q770	A762-A766 WeakPolarHBondContact O-CB 3.42Å; A762-A766 PolarHBondContact O-N 3.3Å; E763-A766 PolarHBondContact O-N 3.43Å; A766-G769 PolarHBondContact O-N 3.1Å; A766-Q770 WeakPolarHBondContact O-CG 3.39Å; A766-Q770 PolarHBondContact O-N 3.21Å
767	A	78	Confident	77.2	Confident	55 Å²	55	92 Å²	92	46%	0.455	50%	0.499	S	S	.	.	H	α-helix	trans	-64.4	-39.6	173.8	0	0	0	0	0	111.9	E763 V764 Q770 A771	E763-A767 WeakPolarHBondContact O-CB 3.48Å; E763-A767 PolarHBondContact O-N 3.48Å; V764-A767 PolarHBondContact O-N 2.97Å; A767-Q770 PolarHBondContact O-N 2.94Å; A767-A771 WeakPolarHBondContact O-CB 3.45Å; A767-A771 PolarHBondContact O-N 3.49Å
768	K	76.3	Confident	78.2	Confident	110 Å²	110	95.2 Å²	95.2	48%	0.478	51%	0.509	S	S	.	.	H	α-helix	trans	-61.6	-45.3	172	178.6	179	176.3	-77.3	0	111.1	V764 E765 Q770 A771 E772	V764-K768 VanDerWaalsContact O-CB 3.23Å; V764-K768 WeakPolarHBondContact O-CB 3.46Å; V764-K768 PolarHBondContact O-N 2.84Å; E765-K768 PolarHBondContact O-N 2.83Å; K768-Q770 VanDerWaalsContact C-N 3.31Å; K768-Q770 PolarHBondContact O-N 3.06Å; K768-A771 CarbonylContact O-C 3.57Å; K768-A771 PolarHBondContact O-N 2.78Å; K768-A771 VanDerWaalsContact O-N 3.14Å; K768-E772 VanDerWaalsContact CE-OE1 3.31Å; K768-E772 WeakPolarHBondContact CE-OE1 3.33Å; K768-E772 HydrophobicContact CG-CG 4.34Å; K768-E772 IonicContact NZ-OE1 3.56Å; K768-E772 PolarHBondContact NZ-OE1 3.34Å; K768-E772 IonicContact NZ-OE2 2.67Å; K768-E772 PolarHBondContact NZ-OE2 3.44Å; K768-E772 WeakPolarHBondContact O-CB 3.24Å; K768-E772 WeakPolarHBondContact O-CG 3.48Å; K768-E772 PolarHBondContact O-N 3.25Å
769	G	78.6	Confident	78.9	Confident	40 Å²	40	94.7 Å²	94.7	41%	0.412	51%	0.508	S	S	.	.	H	α-helix	trans	-62.1	-36.2	174.7	0	0	0	0	0	112.9	E765 A766 G773	E765-G769 PolarHBondContact O-N 2.81Å; A766-G769 PolarHBondContact O-N 3.1Å; G769-G773 PolarHBondContact O-N 3.38Å
770	Q	79.9	Confident	79.8	Confident	136 Å²	136	92.7 Å²	92.7	64%	0.636	51%	0.506	S	S	*	.	H	α-helix	trans	-68.2	-39.4	171.4	-70.9	-175.9	19.8	0	0	112.5	A766 A767 K768 G773 Q774	A766-Q770 WeakPolarHBondContact O-CG 3.39Å; A766-Q770 PolarHBondContact O-N 3.21Å; A767-Q770 PolarHBondContact O-N 2.94Å; K768-Q770 VanDerWaalsContact C-N 3.31Å; K768-Q770 PolarHBondContact O-N 3.06Å; Q770-G773 CarbonylContact O-C 3.58Å; Q770-G773 PolarHBondContact O-N 2.93Å; Q770-Q774 WeakPolarHBondContact O-CG 3.29Å; Q770-Q774 PolarHBondContact O-N 2.84Å
771	A	79.1	Confident	80.8	Confident	51 Å²	51	90 Å²	90	42%	0.421	49%	0.494	S	S	.	.	H	α-helix	trans	-69.9	-40.8	176.9	0	0	0	0	0	112.5	A767 K768 G773 Q774 A775	A767-A771 WeakPolarHBondContact O-CB 3.45Å; A767-A771 PolarHBondContact O-N 3.49Å; K768-A771 CarbonylContact O-C 3.57Å; K768-A771 PolarHBondContact O-N 2.78Å; K768-A771 VanDerWaalsContact O-N 3.14Å; A771-G773 VanDerWaalsContact C-N 3.3Å; A771-G773 PolarHBondContact O-N 3.49Å; A771-Q774 WeakPolarHBondContact O-CB 3.5Å; A771-Q774 PolarHBondContact O-N 3.09Å; A771-Q774 VanDerWaalsContact O-N 3.13Å; A771-A775 WeakPolarHBondContact O-CB 3.3Å; A771-A775 PolarHBondContact O-N 2.92Å
772	E	80.2	Confident	81.6	Confident	106 Å²	106	86.6 Å²	86.6	50%	0.495	48%	0.481	S	S	.	.	H	α-helix	trans	-64.3	-36.5	170.9	-73	176.4	148.2	0	0	110.6	K768 A775 G776	K768-E772 VanDerWaalsContact CE-OE1 3.31Å; K768-E772 WeakPolarHBondContact CE-OE1 3.33Å; K768-E772 HydrophobicContact CG-CG 4.34Å; K768-E772 IonicContact NZ-OE1 3.56Å; K768-E772 PolarHBondContact NZ-OE1 3.34Å; K768-E772 IonicContact NZ-OE2 2.67Å; K768-E772 PolarHBondContact NZ-OE2 3.44Å; K768-E772 WeakPolarHBondContact O-CB 3.24Å; K768-E772 WeakPolarHBondContact O-CG 3.48Å; K768-E772 PolarHBondContact O-N 3.25Å; E772-A775 PolarHBondContact O-N 3.08Å; E772-G776 PolarHBondContact O-N 3.1Å
773	G	80.2	Confident	82.4	Confident	29 Å²	29	88 Å²	88	30%	0.299	48%	0.478	S	S	.	.	H	α-helix	trans	-65.2	-34.8	169.3	0	0	0	0	0	114	G769 Q770 A771 R777	G769-G773 PolarHBondContact O-N 3.38Å; Q770-G773 CarbonylContact O-C 3.58Å; Q770-G773 PolarHBondContact O-N 2.93Å; A771-G773 VanDerWaalsContact C-N 3.3Å; A771-G773 PolarHBondContact O-N 3.49Å; G773-R777 WeakPolarHBondContact O-CG 3.45Å; G773-R777 PolarHBondContact O-N 2.88Å; G773-R777 PolarHBondContact O-NH1 2.88Å
774	Q	82.4	Confident	83.3	Confident	107 Å²	107	87.3 Å²	87.3	50%	0.5	47%	0.47	S	S	.	.	H	α-helix	trans	-69.7	-46.7	172.3	-73.9	173.4	19.4	0	0	111.1	Q770 A771 G776 R777 L778	Q770-Q774 WeakPolarHBondContact O-CG 3.29Å; Q770-Q774 PolarHBondContact O-N 2.84Å; A771-Q774 WeakPolarHBondContact O-CB 3.5Å; A771-Q774 PolarHBondContact O-N 3.09Å; A771-Q774 VanDerWaalsContact O-N 3.13Å; Q774-G776 VanDerWaalsContact C-N 3.29Å; Q774-G776 PolarHBondContact O-N 3.17Å; Q774-R777 VanDerWaalsContact CG-NH2 3.35Å; Q774-R777 PolarHBondContact O-N 3.26Å; Q774-R777 VanDerWaalsContact O-N 3.12Å; Q774-L778 WeakPolarHBondContact O-CG 3.44Å; Q774-L778 PolarHBondContact O-N 2.89Å
775	A	81.8	Confident	84.2	Confident	45 Å²	45	87.3 Å²	87.3	37%	0.372	47%	0.466	S	S	.	.	H	α-helix	trans	-60.3	-38.6	174.8	0	0	0	0	0	111.8	A771 E772 L778 N779	A771-A775 WeakPolarHBondContact O-CB 3.3Å; A771-A775 PolarHBondContact O-N 2.92Å; E772-A775 PolarHBondContact O-N 3.08Å; A775-L778 PolarHBondContact O-N 3.16Å; A775-N779 WeakPolarHBondContact O-CB 3.18Å; A775-N779 VanDerWaalsContact O-CG 3.3Å; A775-N779 PolarHBondContact O-N 2.82Å; A775-N779 PolarHBondContact O-ND2 3.49Å
776	G	86.3	Confident	85.1	Confident	29 Å²	29	87.9 Å²	87.9	30%	0.299	46%	0.463	S	S	.	.	H	α-helix	trans	-60.1	-43.3	172.1	0	0	0	0	0	112.9	E772 Q774 N779 Q780	E772-G776 PolarHBondContact O-N 3.1Å; Q774-G776 VanDerWaalsContact C-N 3.29Å; Q774-G776 PolarHBondContact O-N 3.17Å; G776-N779 PolarHBondContact O-N 3.37Å; G776-Q780 WeakPolarHBondContact O-CB 3.44Å; G776-Q780 VanDerWaalsContact O-CG 3.26Å; G776-Q780 WeakPolarHBondContact O-CG 3.33Å; G776-Q780 PolarHBondContact O-N 3.39Å
777	R	88.1	Confident	85.9	Confident	150 Å²	150	92 Å²	92	57%	0.566	47%	0.467	S	S	*	.	H	α-helix	trans	-67.2	-40.6	174.3	-71.3	-171.9	-60.7	-85.2	14.5	112.5	G773 Q774 Q780 E781	G773-R777 WeakPolarHBondContact O-CG 3.45Å; G773-R777 PolarHBondContact O-N 2.88Å; G773-R777 PolarHBondContact O-NH1 2.88Å; Q774-R777 VanDerWaalsContact CG-NH2 3.35Å; Q774-R777 PolarHBondContact O-N 3.26Å; Q774-R777 VanDerWaalsContact O-N 3.12Å; R777-Q780 PolarHBondContact O-N 2.83Å; R777-E781 PolarHBondContact O-N 3.4Å
778	L	87.7	Confident	86.7	Confident	115 Å²	115	95.4 Å²	95.4	60%	0.602	47%	0.468	S	S	*	.	H	α-helix	trans	-64.5	-41.5	175.6	-70.5	172.6	0	0	0	111.6	Q774 A775 E781 I782	Q774-L778 WeakPolarHBondContact O-CG 3.44Å; Q774-L778 PolarHBondContact O-N 2.89Å; A775-L778 PolarHBondContact O-N 3.16Å; L778-E781 PolarHBondContact O-N 2.84Å; L778-I782 WeakPolarHBondContact O-CB 3.39Å; L778-I782 VanDerWaalsContact O-CG1 3.26Å; L778-I782 WeakPolarHBondContact O-CG1 3.44Å; L778-I782 PolarHBondContact O-N 2.9Å
779	N	88.2	Confident	87.4	Confident	99 Å²	99	93.5 Å²	93.5	53%	0.529	47%	0.466	S	S	.	.	H	α-helix	trans	-64.6	-39.6	174	-74.8	-23.7	0	0	0	112.1	A775 G776 E781 I782 E783	A775-N779 WeakPolarHBondContact O-CB 3.18Å; A775-N779 VanDerWaalsContact O-CG 3.3Å; A775-N779 PolarHBondContact O-N 2.82Å; A775-N779 PolarHBondContact O-ND2 3.49Å; G776-N779 PolarHBondContact O-N 3.37Å; N779-E781 VanDerWaalsContact C-N 3.33Å; N779-E781 PolarHBondContact O-N 3.15Å; N779-I782 PolarHBondContact O-N 3.32Å; N779-E783 WeakPolarHBondContact O-CG 3.16Å; N779-E783 PolarHBondContact O-N 3.37Å
780	Q	91.4	Very high	88.1	Confident	135 Å²	135	95.6 Å²	95.6	63%	0.631	47%	0.467	S	S	*	.	H	α-helix	trans	-63.2	-38.3	173.8	-75.1	170.2	7.9	0	0	112.3	G776 R777 E783 R784	G776-Q780 WeakPolarHBondContact O-CB 3.44Å; G776-Q780 VanDerWaalsContact O-CG 3.26Å; G776-Q780 WeakPolarHBondContact O-CG 3.33Å; G776-Q780 PolarHBondContact O-N 3.39Å; R777-Q780 PolarHBondContact O-N 2.83Å; Q780-E783 PolarHBondContact O-N 3.43Å; Q780-R784 WeakPolarHBondContact O-CB 3.46Å; Q780-R784 PolarHBondContact O-N 3.24Å
781	E	91	Very high	88.8	Confident	72 Å²	72	93.6 Å²	93.6	34%	0.336	46%	0.458	S	S	.	.	H	α-helix	trans	-73.9	-36.3	175	-173	58.5	-162.8	0	0	112.1	R777 L778 N779 E783 R784 L785	R777-E781 PolarHBondContact O-N 3.4Å; L778-E781 PolarHBondContact O-N 2.84Å; N779-E781 VanDerWaalsContact C-N 3.33Å; N779-E781 PolarHBondContact O-N 3.15Å; E781-E783 VanDerWaalsContact C-N 3.31Å; E781-E783 PolarHBondContact O-N 3.37Å; E781-R784 VanDerWaalsContact CD-NE 3.3Å; E781-R784 CarbonylContact O-C 3.41Å; E781-R784 WeakPolarHBondContact O-CB 3.44Å; E781-R784 PolarHBondContact O-N 3.32Å; E781-R784 VanDerWaalsContact O-N 3.09Å; E781-R784 IonicContact OE1-CZ 2.71Å; E781-R784 VanDerWaalsContact OE1-CZ 3.28Å; E781-R784 IonicContact OE1-NE 2.69Å; E781-R784 PolarHBondContact OE1-NE 3.38Å; E781-R784 IonicContact OE1-NH2 2.97Å; E781-R784 PolarHBondContact OE1-NH2 2.9Å; E781-R784 WeakPolarHBondContact OE2-CD 3.41Å; E781-R784 IonicContact OE2-CZ 3.03Å; E781-R784 IonicContact OE2-NE 3.27Å; E781-R784 PolarHBondContact OE2-NE 2.99Å; E781-R784 IonicContact OE2-NH2 2.94Å; E781-L785 HydrophobicContact CG-CD1 4.23Å; E781-L785 HydrophobicContact CG-CG 4.39Å; E781-L785 WeakPolarHBondContact O-CB 3.45Å; E781-L785 VanDerWaalsContact O-CG 3.28Å; E781-L785 WeakPolarHBondContact O-CG 3.46Å; E781-L785 PolarHBondContact O-N 3.49Å
782	I	89.5	Confident	89.5	Confident	71 Å²	71	95.6 Å²	95.6	36%	0.364	46%	0.461	S	S	.	.	H	α-helix	trans	-59.5	-43	170.2	-72.3	163.4	0	0	0	110.3	L778 N779 R784 L785 R786	L778-I782 WeakPolarHBondContact O-CB 3.39Å; L778-I782 VanDerWaalsContact O-CG1 3.26Å; L778-I782 WeakPolarHBondContact O-CG1 3.44Å; L778-I782 PolarHBondContact O-N 2.9Å; N779-I782 PolarHBondContact O-N 3.32Å; I782-R784 VanDerWaalsContact C-N 3.33Å; I782-L785 PolarHBondContact O-N 2.72Å; I782-R786 HydrophobicContact CG2-CG 4.47Å; I782-R786 WeakPolarHBondContact O-CB 3.3Å; I782-R786 VanDerWaalsContact O-CG 3.29Å; I782-R786 WeakPolarHBondContact O-CG 3.47Å; I782-R786 PolarHBondContact O-N 3.11Å
783	E	92.8	Very high	90	Very high	83 Å²	83	96 Å²	96	39%	0.388	46%	0.463	S	S	.	.	H	α-helix	trans	-72.2	-23.6	174.4	-72.5	-52.9	134	0	0	113.5	N779 Q780 E781 R786 R787	N779-E783 WeakPolarHBondContact O-CG 3.16Å; N779-E783 PolarHBondContact O-N 3.37Å; Q780-E783 PolarHBondContact O-N 3.43Å; E781-E783 VanDerWaalsContact C-N 3.31Å; E781-E783 PolarHBondContact O-N 3.37Å; E783-R786 VanDerWaalsContact OE1-CD 3.23Å; E783-R786 WeakPolarHBondContact OE1-CD 3.45Å; E783-R786 IonicContact OE1-CZ 2.72Å; E783-R786 IonicContact OE1-NE 3.42Å; E783-R786 IonicContact OE1-NH1 3.57Å; E783-R786 PolarHBondContact OE1-NH1 2.99Å; E783-R787 WeakPolarHBondContact O-CB 3.47Å; E783-R787 WeakPolarHBondContact O-CG 3.25Å; E783-R787 PolarHBondContact O-N 3Å; E783-R787 PolarHBondContact O-NE 2.91Å
784	R	94.3	Very high	90.7	Very high	127 Å²	127	99.1 Å²	99.1	48%	0.479	47%	0.473	S	S	.	.	H	α-helix	trans	-74.2	-41.4	170.2	-158.9	-172.5	72.3	81.6	5.6	111.2	Q780 E781 I782 R788	Q780-R784 WeakPolarHBondContact O-CB 3.46Å; Q780-R784 PolarHBondContact O-N 3.24Å; E781-R784 VanDerWaalsContact CD-NE 3.3Å; E781-R784 CarbonylContact O-C 3.41Å; E781-R784 WeakPolarHBondContact O-CB 3.44Å; E781-R784 PolarHBondContact O-N 3.32Å; E781-R784 VanDerWaalsContact O-N 3.09Å; E781-R784 IonicContact OE1-CZ 2.71Å; E781-R784 VanDerWaalsContact OE1-CZ 3.28Å; E781-R784 IonicContact OE1-NE 2.69Å; E781-R784 PolarHBondContact OE1-NE 3.38Å; E781-R784 IonicContact OE1-NH2 2.97Å; E781-R784 PolarHBondContact OE1-NH2 2.9Å; E781-R784 WeakPolarHBondContact OE2-CD 3.41Å; E781-R784 IonicContact OE2-CZ 3.03Å; E781-R784 IonicContact OE2-NE 3.27Å; E781-R784 PolarHBondContact OE2-NE 2.99Å; E781-R784 IonicContact OE2-NH2 2.94Å; I782-R784 VanDerWaalsContact C-N 3.33Å; R784-R788 WeakPolarHBondContact O-CB 3.38Å; R784-R788 PolarHBondContact O-N 2.83Å
785	L	92.9	Very high	91.4	Very high	89 Å²	89	98.2 Å²	98.2	47%	0.466	47%	0.468	S	S	.	.	H	α-helix	trans	-68.1	-43	175.5	-70.2	171.6	0	0	0	111.3	E781 I782 R788 T789	E781-L785 HydrophobicContact CG-CD1 4.23Å; E781-L785 HydrophobicContact CG-CG 4.39Å; E781-L785 WeakPolarHBondContact O-CB 3.45Å; E781-L785 VanDerWaalsContact O-CG 3.28Å; E781-L785 WeakPolarHBondContact O-CG 3.46Å; E781-L785 PolarHBondContact O-N 3.49Å; I782-L785 PolarHBondContact O-N 2.72Å; L785-R788 CarbonylContact O-C 3.51Å; L785-R788 WeakPolarHBondContact O-CA 3.35Å; L785-R788 PolarHBondContact O-N 3.44Å; L785-R788 VanDerWaalsContact O-N 3.09Å; L785-T789 PolarHBondContact O-N 3.34Å; L785-T789 PolarHBondContact O-OG1 3.3Å; L785-T789 VanDerWaalsContact O-OG1 3.11Å
786	R	92.7	Very high	91.9	Very high	142 Å²	142	99.6 Å²	99.6	54%	0.536	47%	0.472	S	S	.	.	H	α-helix	trans	-57.7	-49.9	172.1	-78.5	170.2	172.4	167.8	-0.9	111.6	I782 E783 R788 T789 N790	I782-R786 HydrophobicContact CG2-CG 4.47Å; I782-R786 WeakPolarHBondContact O-CB 3.3Å; I782-R786 VanDerWaalsContact O-CG 3.29Å; I782-R786 WeakPolarHBondContact O-CG 3.47Å; I782-R786 PolarHBondContact O-N 3.11Å; E783-R786 VanDerWaalsContact OE1-CD 3.23Å; E783-R786 WeakPolarHBondContact OE1-CD 3.45Å; E783-R786 IonicContact OE1-CZ 2.72Å; E783-R786 IonicContact OE1-NE 3.42Å; E783-R786 IonicContact OE1-NH1 3.57Å; E783-R786 PolarHBondContact OE1-NH1 2.99Å; R786-R788 VanDerWaalsContact C-N 3.27Å; R786-R788 PolarHBondContact O-N 3.17Å; R786-T789 PolarHBondContact O-N 3.15Å; R786-N790 VanDerWaalsContact O-CG 3.24Å; R786-N790 PolarHBondContact O-N 2.91Å; R786-N790 PolarHBondContact O-OD1 3.21Å
787	R	92.7	Very high	92.4	Very high	141 Å²	141	99.9 Å²	99.9	53%	0.532	47%	0.471	S	S	.	.	H	α-helix	trans	-57	-41.2	172.7	-78.7	175.5	-70.3	158	-1.4	111.9	E783 N790 E791	E783-R787 WeakPolarHBondContact O-CB 3.47Å; E783-R787 WeakPolarHBondContact O-CG 3.25Å; E783-R787 PolarHBondContact O-N 3Å; E783-R787 PolarHBondContact O-NE 2.91Å; R787-N790 PolarHBondContact O-N 2.82Å; R787-E791 WeakPolarHBondContact O-CB 3.1Å; R787-E791 VanDerWaalsContact O-CG 3.27Å; R787-E791 WeakPolarHBondContact O-CG 3.49Å; R787-E791 PolarHBondContact O-N 2.77Å
788	R	94.2	Very high	92.7	Very high	126 Å²	126	97.2 Å²	97.2	48%	0.475	46%	0.464	S	S	.	.	H	α-helix	trans	-67.9	-35.7	177.3	-171.5	54.3	176.7	177	5.2	113.6	R784 L785 R786 E791 L792	R784-R788 WeakPolarHBondContact O-CB 3.38Å; R784-R788 PolarHBondContact O-N 2.83Å; L785-R788 CarbonylContact O-C 3.51Å; L785-R788 WeakPolarHBondContact O-CA 3.35Å; L785-R788 PolarHBondContact O-N 3.44Å; L785-R788 VanDerWaalsContact O-N 3.09Å; R786-R788 VanDerWaalsContact C-N 3.27Å; R786-R788 PolarHBondContact O-N 3.17Å; R788-E791 WeakPolarHBondContact CD-OE2 3.25Å; R788-E791 IonicContact CZ-OE2 2.62Å; R788-E791 IonicContact NE-OE2 3.5Å; R788-E791 IonicContact NH1-OE2 2.86Å; R788-E791 PolarHBondContact NH1-OE2 3.12Å; R788-E791 PolarHBondContact O-N 2.81Å; R788-L792 HydrophobicContact CG-CD1 4.36Å; R788-L792 VanDerWaalsContact O-CG 3.27Å; R788-L792 WeakPolarHBondContact O-CG 3.4Å; R788-L792 PolarHBondContact O-N 3.45Å
789	T	91.4	Very high	93.1	Very high	71 Å²	71	96.1 Å²	96.1	44%	0.436	46%	0.458	S	S	.	.	H	α-helix	trans	-63.6	-50.7	171.4	-59.5	0	0	0	0	109.7	L785 R786 E791 L792 E793	L785-T789 PolarHBondContact O-N 3.34Å; L785-T789 PolarHBondContact O-OG1 3.3Å; L785-T789 VanDerWaalsContact O-OG1 3.11Å; R786-T789 PolarHBondContact O-N 3.15Å; T789-E791 VanDerWaalsContact C-N 3.29Å; T789-E791 PolarHBondContact O-N 3.33Å; T789-L792 CarbonylContact O-C 3.32Å; T789-L792 PolarHBondContact O-N 2.95Å; T789-E793 HydrophobicContact CG2-CG 4.29Å; T789-E793 WeakPolarHBondContact CG2-OE1 3.16Å; T789-E793 WeakPolarHBondContact O-CG 3.47Å; T789-E793 PolarHBondContact O-N 2.85Å
790	N	93.4	Very high	93.4	Very high	83 Å²	83	95.3 Å²	95.3	44%	0.444	45%	0.454	S	S	.	.	H	α-helix	trans	-61	-36.1	177.8	-62.5	18	0	0	0	112.1	R786 R787 N794	R786-N790 VanDerWaalsContact O-CG 3.24Å; R786-N790 PolarHBondContact O-N 2.91Å; R786-N790 PolarHBondContact O-OD1 3.21Å; R787-N790 PolarHBondContact O-N 2.82Å; N790-N794 WeakPolarHBondContact O-CB 3.31Å; N790-N794 PolarHBondContact O-N 2.86Å; N790-N794 PolarHBondContact O-ND2 3.39Å
791	E	95	Very high	93.6	Very high	95 Å²	95	96.9 Å²	96.9	44%	0.444	45%	0.454	S	S	.	.	H	α-helix	trans	-60.8	-46.8	171.6	-77.7	164.5	-156	0	0	111.5	R787 R788 T789 N794 E795	R787-E791 WeakPolarHBondContact O-CB 3.1Å; R787-E791 VanDerWaalsContact O-CG 3.27Å; R787-E791 WeakPolarHBondContact O-CG 3.49Å; R787-E791 PolarHBondContact O-N 2.77Å; R788-E791 WeakPolarHBondContact CD-OE2 3.25Å; R788-E791 IonicContact CZ-OE2 2.62Å; R788-E791 IonicContact NE-OE2 3.5Å; R788-E791 IonicContact NH1-OE2 2.86Å; R788-E791 PolarHBondContact NH1-OE2 3.12Å; R788-E791 PolarHBondContact O-N 2.81Å; T789-E791 VanDerWaalsContact C-N 3.29Å; T789-E791 PolarHBondContact O-N 3.33Å; E791-N794 PolarHBondContact O-N 3Å; E791-E795 PolarHBondContact O-N 3.19Å
792	L	92.9	Very high	93.8	Very high	92 Å²	92	98.2 Å²	98.2	48%	0.482	46%	0.462	S	S	.	.	H	α-helix	trans	-68.7	-39	179	-70	168.4	0	0	0	112.1	R788 T789 E795 V796	R788-L792 HydrophobicContact CG-CD1 4.36Å; R788-L792 VanDerWaalsContact O-CG 3.27Å; R788-L792 WeakPolarHBondContact O-CG 3.4Å; R788-L792 PolarHBondContact O-N 3.45Å; T789-L792 CarbonylContact O-C 3.32Å; T789-L792 PolarHBondContact O-N 2.95Å; L792-E795 PolarHBondContact O-N 3.34Å; L792-V796 WeakPolarHBondContact O-CG2 3.45Å; L792-V796 PolarHBondContact O-N 2.86Å
793	E	92.2	Very high	94.1	Very high	114 Å²	114	98.8 Å²	98.8	53%	0.533	47%	0.465	S	S	.	.	H	α-helix	trans	-61.9	-41.9	172.6	-72.7	172.5	174	0	0	111.5	T789 E795 V796 A797	T789-E793 HydrophobicContact CG2-CG 4.29Å; T789-E793 WeakPolarHBondContact CG2-OE1 3.16Å; T789-E793 WeakPolarHBondContact O-CG 3.47Å; T789-E793 PolarHBondContact O-N 2.85Å; E793-E795 VanDerWaalsContact C-N 3.33Å; E793-V796 PolarHBondContact O-N 3.42Å; E793-A797 WeakPolarHBondContact O-CB 3.47Å; E793-A797 PolarHBondContact O-N 3.38Å
794	N	94.8	Very high	94.2	Very high	96 Å²	96	99 Å²	99	51%	0.513	47%	0.469	S	S	.	.	H	α-helix	trans	-65.2	-35.9	173.5	-85.5	-77.3	0	0	0	112.1	N790 E791 A797 K798	N790-N794 WeakPolarHBondContact O-CB 3.31Å; N790-N794 PolarHBondContact O-N 2.86Å; N790-N794 PolarHBondContact O-ND2 3.39Å; E791-N794 PolarHBondContact O-N 3Å; N794-A797 PolarHBondContact O-N 2.86Å; N794-K798 WeakPolarHBondContact O-CG 3.42Å; N794-K798 PolarHBondContact O-N 3.27Å
795	E	95.8	Very high	94.4	Very high	87 Å²	87	98.8 Å²	98.8	41%	0.407	47%	0.473	S	S	.	.	H	α-helix	trans	-70.5	-41.9	175.6	-152.2	62.2	-145.3	0	0	111.8	E791 L792 E793 A797 K798 L799	E791-E795 PolarHBondContact O-N 3.19Å; L792-E795 PolarHBondContact O-N 3.34Å; E793-E795 VanDerWaalsContact C-N 3.33Å; E795-A797 VanDerWaalsContact C-N 3.29Å; E795-A797 PolarHBondContact O-N 3.32Å; E795-K798 WeakPolarHBondContact O-CB 3.3Å; E795-K798 PolarHBondContact O-N 3.28Å; E795-K798 VanDerWaalsContact O-N 3.12Å; E795-K798 IonicContact OE1-NZ 2.58Å; E795-K798 IonicContact OE2-NZ 3.78Å; E795-K798 PolarHBondContact OE2-NZ 2.93Å; E795-L799 WeakPolarHBondContact O-CG 3.19Å; E795-L799 PolarHBondContact O-N 3.11Å
796	V	93.4	Very high	94.4	Very high	75 Å²	75	97 Å²	97	46%	0.455	47%	0.472	S	S	.	.	H	α-helix	trans	-59.1	-40.6	170.5	169.2	0	0	0	0	110.8	L792 E793 K798 L799 N800	L792-V796 WeakPolarHBondContact O-CG2 3.45Å; L792-V796 PolarHBondContact O-N 2.86Å; E793-V796 PolarHBondContact O-N 3.42Å; V796-K798 VanDerWaalsContact C-N 3.35Å; V796-K798 PolarHBondContact O-N 2.74Å; V796-L799 PolarHBondContact O-N 3.43Å; V796-N800 WeakPolarHBondContact O-CB 3.46Å; V796-N800 PolarHBondContact O-N 3.16Å; V796-N800 PolarHBondContact O-ND2 3.46Å
797	A	95.3	Very high	94.5	Very high	34 Å²	34	95.5 Å²	95.5	28%	0.281	47%	0.469	S	S	.	.	H	α-helix	trans	-66.4	-31.7	175.4	0	0	0	0	0	113.3	E793 N794 E795 R801	E793-A797 WeakPolarHBondContact O-CB 3.47Å; E793-A797 PolarHBondContact O-N 3.38Å; N794-A797 PolarHBondContact O-N 2.86Å; E795-A797 VanDerWaalsContact C-N 3.29Å; E795-A797 PolarHBondContact O-N 3.32Å; A797-R801 VanDerWaalsContact O-CG 3.29Å; A797-R801 WeakPolarHBondContact O-CG 3.14Å; A797-R801 PolarHBondContact O-N 2.85Å
798	K	95.8	Very high	94.7	Very high	95 Å²	95	94.8 Å²	94.8	41%	0.413	48%	0.475	S	S	.	.	H	α-helix	trans	-70	-47.3	169.8	-67.2	169.5	-159.8	166.1	0	111.3	N794 E795 V796 N800 R801 I802	N794-K798 WeakPolarHBondContact O-CG 3.42Å; N794-K798 PolarHBondContact O-N 3.27Å; E795-K798 WeakPolarHBondContact O-CB 3.3Å; E795-K798 PolarHBondContact O-N 3.28Å; E795-K798 VanDerWaalsContact O-N 3.12Å; E795-K798 IonicContact OE1-NZ 2.58Å; E795-K798 IonicContact OE2-NZ 3.78Å; E795-K798 PolarHBondContact OE2-NZ 2.93Å; V796-K798 VanDerWaalsContact C-N 3.35Å; V796-K798 PolarHBondContact O-N 2.74Å; K798-N800 VanDerWaalsContact C-N 3.31Å; K798-N800 PolarHBondContact O-N 3.08Å; K798-R801 WeakPolarHBondContact O-CB 3.44Å; K798-R801 PolarHBondContact O-N 2.93Å; K798-R801 VanDerWaalsContact O-N 3.15Å; K798-I802 WeakPolarHBondContact O-CG1 3.3Å; K798-I802 PolarHBondContact O-N 3.11Å
799	L	94.9	Very high	94.8	Very high	91 Å²	91	92 Å²	92	48%	0.476	47%	0.47	S	S	.	.	H	α-helix	trans	-60.2	-41.8	179.6	-70.5	170.7	0	0	0	111.2	E795 V796 I802 I803	E795-L799 WeakPolarHBondContact O-CG 3.19Å; E795-L799 PolarHBondContact O-N 3.11Å; V796-L799 PolarHBondContact O-N 3.43Å; L799-I802 PolarHBondContact O-N 2.98Å; L799-I803 WeakPolarHBondContact O-CB 3.46Å; L799-I803 WeakPolarHBondContact O-CD1 3.44Å; L799-I803 VanDerWaalsContact O-CG1 3.23Å; L799-I803 WeakPolarHBondContact O-CG1 3.4Å; L799-I803 PolarHBondContact O-N 2.74Å
800	N	94.1	Very high	94.9	Very high	82 Å²	82	95.4 Å²	95.4	44%	0.439	48%	0.48	S	S	.	.	H	α-helix	trans	-61.5	-43.8	174.2	-71.3	-14.4	0	0	0	112	V796 K798 I802 I803 D804	V796-N800 WeakPolarHBondContact O-CB 3.46Å; V796-N800 PolarHBondContact O-N 3.16Å; V796-N800 PolarHBondContact O-ND2 3.46Å; K798-N800 VanDerWaalsContact C-N 3.31Å; K798-N800 PolarHBondContact O-N 3.08Å; N800-I802 VanDerWaalsContact C-N 3.35Å; N800-I802 PolarHBondContact O-N 3.44Å; N800-I803 WeakPolarHBondContact O-CB 3.34Å; N800-I803 PolarHBondContact O-N 3.45Å; N800-D804 VanDerWaalsContact O-CG 3.31Å; N800-D804 PolarHBondContact O-N 3.27Å
801	R	95.9	Very high	95	Very high	168 Å²	168	95.1 Å²	95.1	63%	0.634	49%	0.485	S	S	*	.	H	α-helix	trans	-60.5	-41.9	174.1	-71.5	168.9	-171.8	139.9	3.5	112.4	A797 K798 I803 D804 E805	A797-R801 VanDerWaalsContact O-CG 3.29Å; A797-R801 WeakPolarHBondContact O-CG 3.14Å; A797-R801 PolarHBondContact O-N 2.85Å; K798-R801 WeakPolarHBondContact O-CB 3.44Å; K798-R801 PolarHBondContact O-N 2.93Å; K798-R801 VanDerWaalsContact O-N 3.15Å; R801-I803 VanDerWaalsContact C-N 3.34Å; R801-D804 PolarHBondContact O-N 2.97Å; R801-E805 WeakPolarHBondContact O-CB 3.29Å; R801-E805 PolarHBondContact O-N 3.48Å
802	I	96.6	Very high	95.1	Very high	100 Å²	100	98.2 Å²	98.2	51%	0.513	49%	0.492	S	S	.	.	H	α-helix	trans	-65.1	-39.8	176.4	-67	164	0	0	0	110.7	K798 L799 N800 A806	K798-I802 WeakPolarHBondContact O-CG1 3.3Å; K798-I802 PolarHBondContact O-N 3.11Å; L799-I802 PolarHBondContact O-N 2.98Å; N800-I802 VanDerWaalsContact C-N 3.35Å; N800-I802 PolarHBondContact O-N 3.44Å; I802-A806 VanDerWaalsContact O-CB 3.23Å; I802-A806 WeakPolarHBondContact O-CB 3.35Å; I802-A806 PolarHBondContact O-N 2.84Å
803	I	94.9	Very high	95.2	Very high	84 Å²	84	99.2 Å²	99.2	43%	0.431	50%	0.497	S	S	.	.	H	α-helix	trans	-64.7	-42.1	175.4	-74	163.9	0	0	0	111	L799 N800 R801 A806 K807	L799-I803 WeakPolarHBondContact O-CB 3.46Å; L799-I803 WeakPolarHBondContact O-CD1 3.44Å; L799-I803 VanDerWaalsContact O-CG1 3.23Å; L799-I803 WeakPolarHBondContact O-CG1 3.4Å; L799-I803 PolarHBondContact O-N 2.74Å; N800-I803 WeakPolarHBondContact O-CB 3.34Å; N800-I803 PolarHBondContact O-N 3.45Å; R801-I803 VanDerWaalsContact C-N 3.34Å; I803-A806 PolarHBondContact O-N 3.23Å; I803-K807 HydrophobicContact CG2-CD 4.42Å; I803-K807 VanDerWaalsContact CG2-CE 3.46Å; I803-K807 VanDerWaalsContact O-CG 3.3Å; I803-K807 WeakPolarHBondContact O-CG 3.35Å; I803-K807 PolarHBondContact O-N 2.94Å
804	D	96.1	Very high	95.3	Very high	86 Å²	86	95.9 Å²	95.9	46%	0.46	49%	0.494	S	S	.	.	H	α-helix	trans	-74.4	-34.7	-180	-66.2	-28.3	0	0	0	112.4	N800 R801 K807 L808	N800-D804 VanDerWaalsContact O-CG 3.31Å; N800-D804 PolarHBondContact O-N 3.27Å; R801-D804 PolarHBondContact O-N 2.97Å; D804-K807 PolarHBondContact O-N 3.3Å; D804-K807 IonicContact OD1-NZ 2.68Å; D804-K807 PolarHBondContact OD1-NZ 2.81Å; D804-L808 WeakPolarHBondContact O-CB 3.29Å; D804-L808 PolarHBondContact O-N 2.91Å
805	E	96.4	Very high	95.3	Very high	123 Å²	123	95.6 Å²	95.6	58%	0.575	49%	0.492	S	S	*	.	H	α-helix	trans	-63.6	-42.5	167.8	-175.5	173	-168	0	0	111.2	R801 L808 L809	R801-E805 WeakPolarHBondContact O-CB 3.29Å; R801-E805 PolarHBondContact O-N 3.48Å; E805-L808 PolarHBondContact O-N 3.48Å; E805-L809 HydrophobicContact CG-CD1 4.24Å; E805-L809 WeakPolarHBondContact O-CB 3.36Å; E805-L809 VanDerWaalsContact O-CG 3.28Å; E805-L809 WeakPolarHBondContact O-CG 3.1Å; E805-L809 PolarHBondContact O-N 2.9Å
806	A	93.9	Very high	95.4	Very high	52 Å²	52	97.1 Å²	97.1	43%	0.43	50%	0.498	S	S	.	.	H	α-helix	trans	-62.1	-44.3	175.4	0	0	0	0	0	112.2	I802 I803 L808 L809 E810	I802-A806 VanDerWaalsContact O-CB 3.23Å; I802-A806 WeakPolarHBondContact O-CB 3.35Å; I802-A806 PolarHBondContact O-N 2.84Å; I803-A806 PolarHBondContact O-N 3.23Å; A806-L808 VanDerWaalsContact C-N 3.33Å; A806-L808 PolarHBondContact O-N 2.85Å; A806-L809 PolarHBondContact O-N 3.42Å; A806-E810 VanDerWaalsContact O-CB 3.32Å; A806-E810 WeakPolarHBondContact O-CB 3.38Å; A806-E810 PolarHBondContact O-N 3.43Å
807	K	95.4	Very high	95.3	Very high	111 Å²	111	96.1 Å²	96.1	48%	0.483	50%	0.497	S	S	.	.	H	α-helix	trans	-60.3	-39.8	172.8	-70.4	167.9	-164.7	157.8	0	112.2	I803 D804 E810 S811	I803-K807 HydrophobicContact CG2-CD 4.42Å; I803-K807 VanDerWaalsContact CG2-CE 3.46Å; I803-K807 VanDerWaalsContact O-CG 3.3Å; I803-K807 WeakPolarHBondContact O-CG 3.35Å; I803-K807 PolarHBondContact O-N 2.94Å; D804-K807 PolarHBondContact O-N 3.3Å; D804-K807 IonicContact OD1-NZ 2.68Å; D804-K807 PolarHBondContact OD1-NZ 2.81Å; K807-E810 PolarHBondContact O-N 2.91Å; K807-S811 VanDerWaalsContact O-CB 3.26Å; K807-S811 WeakPolarHBondContact O-CB 3.28Å; K807-S811 PolarHBondContact O-N 3.47Å
808	L	96.8	Very high	95.3	Very high	125 Å²	125	95.7 Å²	95.7	65%	0.654	50%	0.496	S	S	*	.	H	α-helix	trans	-68	-38.8	178	-177	63.4	0	0	0	111.5	D804 E805 A806 R812	D804-L808 WeakPolarHBondContact O-CB 3.29Å; D804-L808 PolarHBondContact O-N 2.91Å; E805-L808 PolarHBondContact O-N 3.48Å; A806-L808 VanDerWaalsContact C-N 3.33Å; A806-L808 PolarHBondContact O-N 2.85Å; L808-R812 VanDerWaalsContact O-CB 3.28Å; L808-R812 WeakPolarHBondContact O-CB 3.37Å; L808-R812 PolarHBondContact O-N 2.85Å
809	L	96.6	Very high	95.3	Very high	69 Å²	69	95.5 Å²	95.5	36%	0.361	49%	0.493	S	S	.	.	H	α-helix	trans	-66.3	-43.9	172.8	-70.4	172.3	0	0	0	111.8	E805 A806 R812 L813	E805-L809 HydrophobicContact CG-CD1 4.24Å; E805-L809 WeakPolarHBondContact O-CB 3.36Å; E805-L809 VanDerWaalsContact O-CG 3.28Å; E805-L809 WeakPolarHBondContact O-CG 3.1Å; E805-L809 PolarHBondContact O-N 2.9Å; A806-L809 PolarHBondContact O-N 3.42Å; L809-R812 PolarHBondContact O-N 3.48Å; L809-L813 WeakPolarHBondContact O-CB 3.36Å; L809-L813 VanDerWaalsContact O-CG 3.25Å; L809-L813 WeakPolarHBondContact O-CG 3.47Å; L809-L813 PolarHBondContact O-N 3.13Å
810	E	93.6	Very high	95.3	Very high	142 Å²	142	95.7 Å²	95.7	66%	0.664	49%	0.493	S	S	*	.	H	α-helix	trans	-60.5	-49.5	175.2	-178.9	176.1	-157.7	0	0	111.1	A806 K807 R812 L813 G814	A806-E810 VanDerWaalsContact O-CB 3.32Å; A806-E810 WeakPolarHBondContact O-CB 3.38Å; A806-E810 PolarHBondContact O-N 3.43Å; K807-E810 PolarHBondContact O-N 2.91Å; E810-R812 PolarHBondContact O-N 2.75Å; E810-L813 PolarHBondContact O-N 3.13Å; E810-G814 PolarHBondContact O-N 3.46Å
811	S	94.9	Very high	95.3	Very high	76 Å²	76	96.6 Å²	96.6	53%	0.531	50%	0.495	S	S	.	.	H	α-helix	trans	-54.2	-52.6	173.1	172.9	0	0	0	0	110.9	K807 L813 G814 D815	K807-S811 VanDerWaalsContact O-CB 3.26Å; K807-S811 WeakPolarHBondContact O-CB 3.28Å; K807-S811 PolarHBondContact O-N 3.47Å; S811-L813 VanDerWaalsContact C-N 3.27Å; S811-L813 PolarHBondContact O-N 3.35Å; S811-G814 PolarHBondContact O-N 3.19Å; S811-D815 WeakPolarHBondContact O-CB 3.15Å; S811-D815 PolarHBondContact O-N 2.92Å
812	R	96.8	Very high	95.4	Very high	161 Å²	161	94.8 Å²	94.8	61%	0.608	49%	0.488	S	S	*	.	H	α-helix	trans	-62.1	-31.4	179.4	-171.4	175.5	70.1	174.6	2.5	113.3	L808 L809 E810 K816	L808-R812 VanDerWaalsContact O-CB 3.28Å; L808-R812 WeakPolarHBondContact O-CB 3.37Å; L808-R812 PolarHBondContact O-N 2.85Å; L809-R812 PolarHBondContact O-N 3.48Å; E810-R812 PolarHBondContact O-N 2.75Å; R812-K816 WeakPolarHBondContact O-CB 3.37Å; R812-K816 PolarHBondContact O-N 3.41Å
813	L	95.4	Very high	95.3	Very high	112 Å²	112	94.5 Å²	94.5	59%	0.586	49%	0.485	S	S	*	.	H	α-helix	trans	-76.4	-41.3	174.6	-74.8	171.9	0	0	0	112	L809 E810 S811 D815 K816 A817	L809-L813 WeakPolarHBondContact O-CB 3.36Å; L809-L813 VanDerWaalsContact O-CG 3.25Å; L809-L813 WeakPolarHBondContact O-CG 3.47Å; L809-L813 PolarHBondContact O-N 3.13Å; E810-L813 PolarHBondContact O-N 3.13Å; S811-L813 VanDerWaalsContact C-N 3.27Å; S811-L813 PolarHBondContact O-N 3.35Å; L813-D815 VanDerWaalsContact C-N 3.32Å; L813-D815 PolarHBondContact O-N 2.75Å; L813-K816 CarbonylContact O-C 3.15Å; L813-K816 PolarHBondContact O-N 3.17Å; L813-A817 WeakPolarHBondContact O-CB 3.5Å; L813-A817 PolarHBondContact O-N 2.81Å
814	G	94.8	Very high	95.2	Very high	44 Å²	44	95.9 Å²	95.9	45%	0.454	49%	0.487	S	S	.	.	H	α-helix	trans	-60.8	-42.1	172.5	0	0	0	0	0	111.8	E810 S811 K816 A817 G818	E810-G814 PolarHBondContact O-N 3.46Å; S811-G814 PolarHBondContact O-N 3.19Å; G814-K816 VanDerWaalsContact C-N 3.31Å; G814-K816 PolarHBondContact O-N 2.76Å; G814-A817 PolarHBondContact O-N 3.4Å; G814-G818 PolarHBondContact O-N 3.31Å
815	D	94.9	Very high	95.2	Very high	91 Å²	91	97 Å²	97	49%	0.487	49%	0.485	S	S	.	.	H	α-helix	trans	-60.2	-39.6	173.5	-130.7	43.5	0	0	0	112.5	S811 L813 R819	S811-D815 WeakPolarHBondContact O-CB 3.15Å; S811-D815 PolarHBondContact O-N 2.92Å; L813-D815 VanDerWaalsContact C-N 3.32Å; L813-D815 PolarHBondContact O-N 2.75Å; D815-R819 WeakPolarHBondContact O-CG 3.44Å; D815-R819 VanDerWaalsContact O-CZ 3.24Å; D815-R819 PolarHBondContact O-N 2.95Å; D815-R819 VanDerWaalsContact O-N 3.12Å; D815-R819 PolarHBondContact O-NH1 2.86Å; D815-R819 IonicContact OD2-CZ 2.75Å; D815-R819 IonicContact OD2-NH1 3.27Å; D815-R819 PolarHBondContact OD2-NH1 3.18Å; D815-R819 IonicContact OD2-NH2 2.63Å
816	K	96	Very high	95.2	Very high	119 Å²	119	97 Å²	97	52%	0.517	49%	0.485	S	S	.	.	H	α-helix	trans	-71.9	-40.5	175	-173	-178.6	177.4	-176	0	111.5	R812 L813 G814 R819 L820	R812-K816 WeakPolarHBondContact O-CB 3.37Å; R812-K816 PolarHBondContact O-N 3.41Å; L813-K816 CarbonylContact O-C 3.15Å; L813-K816 PolarHBondContact O-N 3.17Å; G814-K816 VanDerWaalsContact C-N 3.31Å; G814-K816 PolarHBondContact O-N 2.76Å; K816-R819 PolarHBondContact O-N 3.28Å; K816-L820 HydrophobicContact CG-CD1 4.14Å; K816-L820 WeakPolarHBondContact O-CG 3.5Å; K816-L820 PolarHBondContact O-N 3.16Å
817	A	93.1	Very high	95.2	Very high	54 Å²	54	99.8 Å²	99.8	45%	0.446	49%	0.492	S	S	.	.	H	α-helix	trans	-62.5	-47.3	175.5	0	0	0	0	0	110.7	L813 G814 R819 L820 E821	L813-A817 WeakPolarHBondContact O-CB 3.5Å; L813-A817 PolarHBondContact O-N 2.81Å; G814-A817 PolarHBondContact O-N 3.4Å; A817-R819 VanDerWaalsContact C-N 3.29Å; A817-R819 PolarHBondContact O-N 2.92Å; A817-L820 CarbonylContact O-C 3.47Å; A817-L820 PolarHBondContact O-N 3.34Å; A817-L820 VanDerWaalsContact O-N 3.16Å; A817-E821 WeakPolarHBondContact O-CB 3.33Å; A817-E821 PolarHBondContact O-N 3.12Å
818	G	94.8	Very high	95.2	Very high	24 Å²	24	99.3 Å²	99.3	25%	0.247	49%	0.492	C	S	.	.	H	α-helix	trans	-65.6	-25.4	176.1	0	0	0	0	0	114.2	G814 R822	G814-G818 PolarHBondContact O-N 3.31Å; G818-R822 WeakPolarHBondContact O-CG 3.45Å; G818-R822 PolarHBondContact O-N 2.82Å; G818-R822 PolarHBondContact O-NE 3.23Å; G818-R822 PolarHBondContact O-NH2 2.91Å
819	R	95.6	Very high	95.1	Very high	92 Å²	92	98.7 Å²	98.7	35%	0.347	49%	0.486	S	S	.	.	H	α-helix	trans	-69.2	-54.4	166.1	-79.8	-176.1	-69.6	-83.8	-0.2	111.2	D815 K816 A817 E821 R822 E823	D815-R819 WeakPolarHBondContact O-CG 3.44Å; D815-R819 VanDerWaalsContact O-CZ 3.24Å; D815-R819 PolarHBondContact O-N 2.95Å; D815-R819 VanDerWaalsContact O-N 3.12Å; D815-R819 PolarHBondContact O-NH1 2.86Å; D815-R819 IonicContact OD2-CZ 2.75Å; D815-R819 IonicContact OD2-NH1 3.27Å; D815-R819 PolarHBondContact OD2-NH1 3.18Å; D815-R819 IonicContact OD2-NH2 2.63Å; K816-R819 PolarHBondContact O-N 3.28Å; A817-R819 VanDerWaalsContact C-N 3.29Å; A817-R819 PolarHBondContact O-N 2.92Å; R819-E821 VanDerWaalsContact C-N 3.26Å; R819-E821 PolarHBondContact O-N 3.33Å; R819-R822 PolarHBondContact O-N 3.48Å; R819-R822 VanDerWaalsContact O-N 3.09Å; R819-E823 WeakPolarHBondContact O-CG 3.26Å; R819-E823 PolarHBondContact O-N 3.18Å
820	L	94.9	Very high	95	Very high	94 Å²	94	97.5 Å²	97.5	49%	0.492	48%	0.483	S	S	.	.	H	α-helix	trans	-60.8	-32.1	179.5	-70	169.4	0	0	0	113.1	K816 A817 K824	K816-L820 HydrophobicContact CG-CD1 4.14Å; K816-L820 WeakPolarHBondContact O-CG 3.5Å; K816-L820 PolarHBondContact O-N 3.16Å; A817-L820 CarbonylContact O-C 3.47Å; A817-L820 PolarHBondContact O-N 3.34Å; A817-L820 VanDerWaalsContact O-N 3.16Å; L820-K824 WeakPolarHBondContact O-CB 3.33Å; L820-K824 PolarHBondContact O-N 2.83Å
821	E	94.6	Very high	95.1	Very high	102 Å²	102	94.5 Å²	94.5	48%	0.477	47%	0.471	S	S	.	.	H	α-helix	trans	-71.5	-37.7	175.6	-165.9	-153.7	117.8	0	0	111.8	A817 R819 R825	A817-E821 WeakPolarHBondContact O-CB 3.33Å; A817-E821 PolarHBondContact O-N 3.12Å; R819-E821 VanDerWaalsContact C-N 3.26Å; R819-E821 PolarHBondContact O-N 3.33Å; E821-R825 VanDerWaalsContact O-CB 3.29Å; E821-R825 WeakPolarHBondContact O-CB 3.29Å; E821-R825 PolarHBondContact O-N 2.88Å; E821-R825 IonicContact OE1-CZ 2.71Å; E821-R825 IonicContact OE1-NH1 3.45Å; E821-R825 PolarHBondContact OE1-NH1 3.09Å; E821-R825 IonicContact OE1-NH2 2.74Å; E821-R825 PolarHBondContact OE1-NH2 3.06Å
822	R	96.8	Very high	95.1	Very high	130 Å²	130	93.5 Å²	93.5	49%	0.491	47%	0.467	S	S	.	.	H	α-helix	trans	-69.8	-41.5	172.7	-78.9	-179.4	-80	100.1	-5.7	112	G818 R819 R825 Q826	G818-R822 WeakPolarHBondContact O-CG 3.45Å; G818-R822 PolarHBondContact O-N 2.82Å; G818-R822 PolarHBondContact O-NE 3.23Å; G818-R822 PolarHBondContact O-NH2 2.91Å; R819-R822 PolarHBondContact O-N 3.48Å; R819-R822 VanDerWaalsContact O-N 3.09Å; R822-R825 PolarHBondContact O-N 2.99Å; R822-Q826 WeakPolarHBondContact O-CB 3.39Å; R822-Q826 VanDerWaalsContact O-CG 3.3Å; R822-Q826 WeakPolarHBondContact O-CG 3.11Å; R822-Q826 PolarHBondContact O-N 3.35Å
823	E	95.3	Very high	95.2	Very high	93 Å²	93	91.1 Å²	91.1	44%	0.435	46%	0.463	S	S	.	.	H	α-helix	trans	-62.9	-43.7	173.4	-70.8	160.3	-150	0	0	110.9	R819 Q826 L827	R819-E823 WeakPolarHBondContact O-CG 3.26Å; R819-E823 PolarHBondContact O-N 3.18Å; E823-Q826 PolarHBondContact O-N 3.32Å; E823-L827 WeakPolarHBondContact O-CB 3.31Å; E823-L827 VanDerWaalsContact O-CG 3.3Å; E823-L827 WeakPolarHBondContact O-CG 3.47Å; E823-L827 PolarHBondContact O-N 2.88Å
824	K	91.9	Very high	95.2	Very high	113 Å²	113	90.2 Å²	90.2	49%	0.491	46%	0.458	S	S	.	.	H	α-helix	trans	-58	-48.9	171.9	176.1	-179.6	178.9	-79.2	0	111.4	L820 Q826 L827 E828	L820-K824 WeakPolarHBondContact O-CB 3.33Å; L820-K824 PolarHBondContact O-N 2.83Å; K824-Q826 PolarHBondContact O-N 2.95Å; K824-L827 PolarHBondContact O-N 2.71Å; K824-E828 VanDerWaalsContact CE-OE1 3.32Å; K824-E828 WeakPolarHBondContact CE-OE1 3.45Å; K824-E828 HydrophobicContact CG-CG 4.39Å; K824-E828 IonicContact NZ-OE1 3.67Å; K824-E828 PolarHBondContact NZ-OE1 3.35Å; K824-E828 IonicContact NZ-OE2 2.63Å; K824-E828 PolarHBondContact NZ-OE2 3.49Å; K824-E828 WeakPolarHBondContact O-CB 3.26Å; K824-E828 WeakPolarHBondContact O-CG 3.35Å; K824-E828 PolarHBondContact O-N 3.3Å
825	R	96.3	Very high	95.2	Very high	110 Å²	110	91.2 Å²	91.2	42%	0.415	45%	0.448	S	S	.	.	H	α-helix	trans	-60.2	-44.7	179.1	-178.3	179.9	-68.3	105	3.7	111.6	E821 R822 L827 E828 E829	E821-R825 VanDerWaalsContact O-CB 3.29Å; E821-R825 WeakPolarHBondContact O-CB 3.29Å; E821-R825 PolarHBondContact O-N 2.88Å; E821-R825 IonicContact OE1-CZ 2.71Å; E821-R825 IonicContact OE1-NH1 3.45Å; E821-R825 PolarHBondContact OE1-NH1 3.09Å; E821-R825 IonicContact OE1-NH2 2.74Å; E821-R825 PolarHBondContact OE1-NH2 3.06Å; R822-R825 PolarHBondContact O-N 2.99Å; R825-L827 VanDerWaalsContact C-N 3.33Å; R825-L827 PolarHBondContact O-N 3.44Å; R825-E828 PolarHBondContact O-N 3.01Å; R825-E829 WeakPolarHBondContact CG-OE1 3.11Å; R825-E829 WeakPolarHBondContact O-CB 3.43Å; R825-E829 VanDerWaalsContact O-CG 3.26Å; R825-E829 WeakPolarHBondContact O-CG 3.49Å; R825-E829 PolarHBondContact O-N 3.45Å
826	Q	96.1	Very high	95.3	Very high	124 Å²	124	92.4 Å²	92.4	58%	0.579	45%	0.45	S	S	*	.	H	α-helix	trans	-63.8	-36.3	175.4	-73.6	173.2	-22.7	0	0	112.6	R822 E823 K824 S830	R822-Q826 WeakPolarHBondContact O-CB 3.39Å; R822-Q826 VanDerWaalsContact O-CG 3.3Å; R822-Q826 WeakPolarHBondContact O-CG 3.11Å; R822-Q826 PolarHBondContact O-N 3.35Å; E823-Q826 PolarHBondContact O-N 3.32Å; K824-Q826 PolarHBondContact O-N 2.95Å; Q826-S830 WeakPolarHBondContact O-CB 3.49Å; Q826-S830 PolarHBondContact O-N 3.46Å; Q826-S830 PolarHBondContact O-OG 3.04Å
827	L	95.3	Very high	95.2	Very high	109 Å²	109	91.2 Å²	91.2	57%	0.571	45%	0.447	S	S	*	.	H	α-helix	trans	-69	-41.4	173	-72	170.1	0	0	0	111.7	E823 K824 R825 S830 L831	E823-L827 WeakPolarHBondContact O-CB 3.31Å; E823-L827 VanDerWaalsContact O-CG 3.3Å; E823-L827 WeakPolarHBondContact O-CG 3.47Å; E823-L827 PolarHBondContact O-N 2.88Å; K824-L827 PolarHBondContact O-N 2.71Å; R825-L827 VanDerWaalsContact C-N 3.33Å; R825-L827 PolarHBondContact O-N 3.44Å; L827-S830 WeakPolarHBondContact CA-OG 3.28Å; L827-S830 PolarHBondContact O-N 2.85Å; L827-S830 PolarHBondContact O-OG 3.11Å; L827-L831 WeakPolarHBondContact O-CB 3.29Å; L827-L831 VanDerWaalsContact O-CG 3.25Å; L827-L831 WeakPolarHBondContact O-CG 3.26Å; L827-L831 PolarHBondContact O-N 3.24Å
828	E	94.3	Very high	95.2	Very high	101 Å²	101	94.7 Å²	94.7	47%	0.472	45%	0.454	S	S	.	.	H	α-helix	trans	-63	-41	174.5	-73.2	174.7	140.7	0	0	111.9	K824 R825 L831 A832	K824-E828 VanDerWaalsContact CE-OE1 3.32Å; K824-E828 WeakPolarHBondContact CE-OE1 3.45Å; K824-E828 HydrophobicContact CG-CG 4.39Å; K824-E828 IonicContact NZ-OE1 3.67Å; K824-E828 PolarHBondContact NZ-OE1 3.35Å; K824-E828 IonicContact NZ-OE2 2.63Å; K824-E828 PolarHBondContact NZ-OE2 3.49Å; K824-E828 WeakPolarHBondContact O-CB 3.26Å; K824-E828 WeakPolarHBondContact O-CG 3.35Å; K824-E828 PolarHBondContact O-N 3.3Å; R825-E828 PolarHBondContact O-N 3.01Å; E828-L831 PolarHBondContact O-N 2.79Å; E828-A832 PolarHBondContact O-N 3.45Å
829	E	96.2	Very high	95.2	Very high	113 Å²	113	98.1 Å²	98.1	53%	0.528	46%	0.463	S	S	.	.	H	α-helix	trans	-61	-49.3	171.5	-73.3	162.1	-177	0	0	111.3	R825 L831 A832 E833	R825-E829 WeakPolarHBondContact CG-OE1 3.11Å; R825-E829 WeakPolarHBondContact O-CB 3.43Å; R825-E829 VanDerWaalsContact O-CG 3.26Å; R825-E829 WeakPolarHBondContact O-CG 3.49Å; R825-E829 PolarHBondContact O-N 3.45Å; E829-L831 VanDerWaalsContact C-N 3.31Å; E829-L831 PolarHBondContact O-N 2.88Å; E829-A832 WeakPolarHBondContact O-CB 3.33Å; E829-A832 PolarHBondContact O-N 2.62Å; E829-A832 VanDerWaalsContact O-N 3.11Å; E829-E833 PolarHBondContact O-N 3.39Å
830	S	94.5	Very high	95.2	Very high	44 Å²	44	99.1 Å²	99.1	31%	0.308	47%	0.472	S	S	.	.	H	α-helix	trans	-65.2	-32.8	177.8	73.4	0	0	0	0	113.3	Q826 L827 E833 I834	Q826-S830 WeakPolarHBondContact O-CB 3.49Å; Q826-S830 PolarHBondContact O-N 3.46Å; Q826-S830 PolarHBondContact O-OG 3.04Å; L827-S830 WeakPolarHBondContact CA-OG 3.28Å; L827-S830 PolarHBondContact O-N 2.85Å; L827-S830 PolarHBondContact O-OG 3.11Å; S830-E833 PolarHBondContact O-N 2.82Å; S830-I834 WeakPolarHBondContact O-CB 3.38Å; S830-I834 WeakPolarHBondContact O-CD1 3.27Å; S830-I834 VanDerWaalsContact O-CG1 3.24Å; S830-I834 WeakPolarHBondContact O-CG1 3.43Å; S830-I834 PolarHBondContact O-N 3.23Å
831	L	95.3	Very high	95	Very high	79 Å²	79	100.2 Å²	100.2	41%	0.414	48%	0.476	S	S	.	.	H	α-helix	trans	-71.7	-31.3	173.9	-75.6	169.8	0	0	0	111.6	L827 E828 E829 R835	L827-L831 WeakPolarHBondContact O-CB 3.29Å; L827-L831 VanDerWaalsContact O-CG 3.25Å; L827-L831 WeakPolarHBondContact O-CG 3.26Å; L827-L831 PolarHBondContact O-N 3.24Å; E828-L831 PolarHBondContact O-N 2.79Å; E829-L831 VanDerWaalsContact C-N 3.31Å; E829-L831 PolarHBondContact O-N 2.88Å; L831-R835 WeakPolarHBondContact O-CD 3.15Å; L831-R835 WeakPolarHBondContact O-CG 3.41Å; L831-R835 PolarHBondContact O-N 3.49Å; L831-R835 VanDerWaalsContact O-N 3.11Å; L831-R835 PolarHBondContact O-NE 2.85Å
832	A	95.3	Very high	95.1	Very high	54 Å²	54	97.7 Å²	97.7	45%	0.446	47%	0.47	S	S	.	.	H	α-helix	trans	-67.3	-45.9	171.1	0	0	0	0	0	111.2	E828 E829 I834 R835 E836	E828-A832 PolarHBondContact O-N 3.45Å; E829-A832 WeakPolarHBondContact O-CB 3.33Å; E829-A832 PolarHBondContact O-N 2.62Å; E829-A832 VanDerWaalsContact O-N 3.11Å; A832-I834 PolarHBondContact O-N 3.07Å; A832-R835 WeakPolarHBondContact O-CB 3.47Å; A832-R835 PolarHBondContact O-N 2.75Å; A832-R835 VanDerWaalsContact O-N 3.16Å; A832-E836 PolarHBondContact O-N 3.43Å
833	E	97.1	Very high	95.1	Very high	112 Å²	112	96.6 Å²	96.6	52%	0.523	47%	0.466	S	S	.	.	H	α-helix	trans	-59.7	-43.5	175.8	-165.6	-169.8	161.9	0	0	111.8	E829 S830 R835 E836 Q837	E829-E833 PolarHBondContact O-N 3.39Å; S830-E833 PolarHBondContact O-N 2.82Å; E833-R835 VanDerWaalsContact C-N 3.33Å; E833-R835 PolarHBondContact O-N 3.41Å; E833-E836 PolarHBondContact O-N 2.91Å; E833-Q837 WeakPolarHBondContact O-CG 3.22Å; E833-Q837 PolarHBondContact O-N 3.28Å; E833-Q837 PolarHBondContact OE1-NE2 2.81Å; E833-Q837 VanDerWaalsContact OE1-NE2 3.15Å
834	I	95.7	Very high	95.1	Very high	93 Å²	93	94.1 Å²	94.1	48%	0.477	46%	0.461	S	S	.	.	H	α-helix	trans	-63.5	-37.5	176.2	-70.9	165	0	0	0	111.7	S830 A832 Q837 E838	S830-I834 WeakPolarHBondContact O-CB 3.38Å; S830-I834 WeakPolarHBondContact O-CD1 3.27Å; S830-I834 VanDerWaalsContact O-CG1 3.24Å; S830-I834 WeakPolarHBondContact O-CG1 3.43Å; S830-I834 PolarHBondContact O-N 3.23Å; A832-I834 PolarHBondContact O-N 3.07Å; I834-Q837 PolarHBondContact O-N 3.42Å; I834-E838 WeakPolarHBondContact O-CB 3.3Å; I834-E838 PolarHBondContact O-N 2.77Å
835	R	95.4	Very high	95.3	Very high	64 Å²	64	92.6 Å²	92.6	24%	0.242	46%	0.458	C	S	.	.	H	α-helix	trans	-68.5	-39.3	175.3	-69	158.1	-164.6	-162.1	6.8	111.8	Q88 L831 A832 E833 Q837 E838 E839	Q88-R835 PolarHBondContact O-NH1 2.89Å; Q88-R835 PolarHBondContact O-NH2 3.42Å; L831-R835 WeakPolarHBondContact O-CD 3.15Å; L831-R835 WeakPolarHBondContact O-CG 3.41Å; L831-R835 PolarHBondContact O-N 3.49Å; L831-R835 VanDerWaalsContact O-N 3.11Å; L831-R835 PolarHBondContact O-NE 2.85Å; A832-R835 WeakPolarHBondContact O-CB 3.47Å; A832-R835 PolarHBondContact O-N 2.75Å; A832-R835 VanDerWaalsContact O-N 3.16Å; E833-R835 VanDerWaalsContact C-N 3.33Å; E833-R835 PolarHBondContact O-N 3.41Å; R835-Q837 VanDerWaalsContact C-N 3.35Å; R835-E838 PolarHBondContact O-N 3.25Å; R835-E839 WeakPolarHBondContact O-CG 3.47Å; R835-E839 PolarHBondContact O-N 2.84Å
836	E	96.1	Very high	95.3	Very high	116 Å²	116	94.4 Å²	94.4	54%	0.542	47%	0.465	S	S	.	.	H	α-helix	trans	-62	-44.3	174.6	-176.3	168.4	-151.9	0	0	110.8	A832 E833 E839 E840	A832-E836 PolarHBondContact O-N 3.43Å; E833-E836 PolarHBondContact O-N 2.91Å; E836-E839 PolarHBondContact O-N 2.81Å; E836-E840 WeakPolarHBondContact O-CG 3.22Å; E836-E840 PolarHBondContact O-N 3.41Å
837	Q	95.4	Very high	95.4	Very high	94 Å²	94	95 Å²	95	44%	0.439	47%	0.47	S	S	.	.	H	α-helix	trans	-63.7	-39.1	173.3	-68.2	174.5	21.8	0	0	112.6	E833 I834 R835 E840 M841	E833-Q837 WeakPolarHBondContact O-CG 3.22Å; E833-Q837 PolarHBondContact O-N 3.28Å; E833-Q837 PolarHBondContact OE1-NE2 2.81Å; E833-Q837 VanDerWaalsContact OE1-NE2 3.15Å; I834-Q837 PolarHBondContact O-N 3.42Å; R835-Q837 VanDerWaalsContact C-N 3.35Å; Q837-E840 PolarHBondContact O-N 2.81Å; Q837-M841 WeakPolarHBondContact O-CB 3.19Å; Q837-M841 VanDerWaalsContact O-CG 3.29Å; Q837-M841 WeakPolarHBondContact O-CG 3.27Å; Q837-M841 PolarHBondContact O-N 3.31Å
838	E	92.4	Very high	95.4	Very high	127 Å²	127	94.9 Å²	94.9	59%	0.593	47%	0.469	S	S	*	.	H	α-helix	trans	-63	-41.5	173.5	-175.5	-179.5	-175.2	0	0	111.4	I834 R835 S842	I834-E838 WeakPolarHBondContact O-CB 3.3Å; I834-E838 PolarHBondContact O-N 2.77Å; R835-E838 PolarHBondContact O-N 3.25Å; E838-S842 VanDerWaalsContact O-CB 3.25Å; E838-S842 WeakPolarHBondContact O-CB 3.31Å; E838-S842 PolarHBondContact O-N 2.83Å; E838-S842 PolarHBondContact O-OG 2.74Å
839	E	95.1	Very high	95.5	Very high	96 Å²	96	94.6 Å²	94.6	45%	0.449	47%	0.471	S	S	.	.	H	α-helix	trans	-68.2	-40.4	174.3	-76.5	-166	-150.6	0	0	112.6	R835 E836 S842 R843	R835-E839 WeakPolarHBondContact O-CG 3.47Å; R835-E839 PolarHBondContact O-N 2.84Å; E836-E839 PolarHBondContact O-N 2.81Å; E839-S842 CarbonylContact O-C 3.17Å; E839-S842 WeakPolarHBondContact O-CA 3.31Å; E839-S842 WeakPolarHBondContact O-CB 3.24Å; E839-S842 PolarHBondContact O-N 2.96Å; E839-S842 VanDerWaalsContact O-N 3.16Å; E839-R843 WeakPolarHBondContact O-CG 3.31Å; E839-R843 PolarHBondContact O-N 3.49Å; E839-R843 IonicContact OE2-CZ 2.87Å; E839-R843 IonicContact OE2-NH2 3.2Å; E839-R843 PolarHBondContact OE2-NH2 2.8Å
840	E	95.5	Very high	95.6	Very high	114 Å²	114	93.6 Å²	93.6	53%	0.533	47%	0.468	S	S	.	.	H	α-helix	trans	-61	-47.6	173.1	-76.6	-159.6	140.6	0	0	111.9	E836 Q837 S842 R843 A844	E836-E840 WeakPolarHBondContact O-CG 3.22Å; E836-E840 PolarHBondContact O-N 3.41Å; Q837-E840 PolarHBondContact O-N 2.81Å; E840-S842 PolarHBondContact O-N 3.23Å; E840-R843 WeakPolarHBondContact O-CB 3.1Å; E840-R843 PolarHBondContact O-N 2.77Å; E840-R843 VanDerWaalsContact O-N 3.08Å; E840-A844 WeakPolarHBondContact O-CB 3.43Å; E840-A844 PolarHBondContact O-N 3.44Å
841	M	91.4	Very high	95.7	Very high	117 Å²	117	100.1 Å²	100.1	58%	0.576	49%	0.486	S	S	*	.	H	α-helix	trans	-61.1	-33.5	173.1	-71.6	-62	-63.7	0	0	111.5	Q837 A844 N845	Q837-M841 WeakPolarHBondContact O-CB 3.19Å; Q837-M841 VanDerWaalsContact O-CG 3.29Å; Q837-M841 WeakPolarHBondContact O-CG 3.27Å; Q837-M841 PolarHBondContact O-N 3.31Å; M841-A844 PolarHBondContact O-N 2.87Å; M841-N845 VanDerWaalsContact O-CB 3.3Å; M841-N845 WeakPolarHBondContact O-CB 3.39Å; M841-N845 VanDerWaalsContact O-CG 3.25Å; M841-N845 PolarHBondContact O-N 3.36Å; M841-N845 PolarHBondContact O-ND2 3.42Å
842	S	94.8	Very high	95.7	Very high	49 Å²	49	100.8 Å²	100.8	34%	0.343	49%	0.489	S	S	.	.	H	α-helix	trans	-75.4	-26.8	174.1	-61.7	0	0	0	0	113.7	E838 E839 E840 R846	E838-S842 VanDerWaalsContact O-CB 3.25Å; E838-S842 WeakPolarHBondContact O-CB 3.31Å; E838-S842 PolarHBondContact O-N 2.83Å; E838-S842 PolarHBondContact O-OG 2.74Å; E839-S842 CarbonylContact O-C 3.17Å; E839-S842 WeakPolarHBondContact O-CA 3.31Å; E839-S842 WeakPolarHBondContact O-CB 3.24Å; E839-S842 PolarHBondContact O-N 2.96Å; E839-S842 VanDerWaalsContact O-N 3.16Å; E840-S842 PolarHBondContact O-N 3.23Å; S842-R846 WeakPolarHBondContact O-CB 3.42Å; S842-R846 VanDerWaalsContact O-CG 3.31Å; S842-R846 WeakPolarHBondContact O-CG 3.27Å; S842-R846 PolarHBondContact O-N 2.98Å; S842-R846 PolarHBondContact O-NE 2.97Å
843	R	97.6	Very high	95.8	Very high	106 Å²	106	102.5 Å²	102.5	40%	0.4	49%	0.488	S	S	.	.	H	α-helix	trans	-72	-44	169.2	-67.3	159.5	-158.4	149.7	-1.3	109.5	E839 E840 R846 M847	E839-R843 WeakPolarHBondContact O-CG 3.31Å; E839-R843 PolarHBondContact O-N 3.49Å; E839-R843 IonicContact OE2-CZ 2.87Å; E839-R843 IonicContact OE2-NH2 3.2Å; E839-R843 PolarHBondContact OE2-NH2 2.8Å; E840-R843 WeakPolarHBondContact O-CB 3.1Å; E840-R843 PolarHBondContact O-N 2.77Å; E840-R843 VanDerWaalsContact O-N 3.08Å; R843-R846 PolarHBondContact O-N 2.89Å; R843-M847 PolarHBondContact O-N 2.88Å
844	A	96.4	Very high	95.8	Very high	41 Å²	41	100.6 Å²	100.6	34%	0.339	48%	0.481	S	S	.	.	H	α-helix	trans	-63.4	-46.8	175.6	0	0	0	0	0	112.5	E840 M841 R846 M847 L848	E840-A844 WeakPolarHBondContact O-CB 3.43Å; E840-A844 PolarHBondContact O-N 3.44Å; M841-A844 PolarHBondContact O-N 2.87Å; A844-R846 VanDerWaalsContact C-N 3.35Å; A844-R846 PolarHBondContact O-N 3.28Å; A844-M847 WeakPolarHBondContact O-CB 3.42Å; A844-M847 PolarHBondContact O-N 3.26Å; A844-M847 VanDerWaalsContact O-N 3.15Å; A844-L848 WeakPolarHBondContact O-CG 3.27Å; A844-L848 PolarHBondContact O-N 2.81Å
845	N	94.6	Very high	95.9	Very high	81 Å²	81	100.2 Å²	100.2	43%	0.433	48%	0.483	S	S	.	.	H	α-helix	trans	-61.5	-40	176	-77.8	-27.5	0	0	0	112.2	M841 L848 N849	M841-N845 VanDerWaalsContact O-CB 3.3Å; M841-N845 WeakPolarHBondContact O-CB 3.39Å; M841-N845 VanDerWaalsContact O-CG 3.25Å; M841-N845 PolarHBondContact O-N 3.36Å; M841-N845 PolarHBondContact O-ND2 3.42Å; N845-L848 PolarHBondContact O-N 3.17Å; N845-N849 WeakPolarHBondContact O-CB 3.28Å; N845-N849 VanDerWaalsContact O-CG 3.31Å; N845-N849 PolarHBondContact O-N 2.78Å
846	R	97.1	Very high	95.9	Very high	148 Å²	148	102.4 Å²	102.4	56%	0.558	50%	0.496	S	S	*	.	H	α-helix	trans	-62	-42.9	172.3	-79.2	179	-72.6	171.1	-6.1	112.1	S842 R843 A844 N849 I850	S842-R846 WeakPolarHBondContact O-CB 3.42Å; S842-R846 VanDerWaalsContact O-CG 3.31Å; S842-R846 WeakPolarHBondContact O-CG 3.27Å; S842-R846 PolarHBondContact O-N 2.98Å; S842-R846 PolarHBondContact O-NE 2.97Å; R843-R846 PolarHBondContact O-N 2.89Å; A844-R846 VanDerWaalsContact C-N 3.35Å; A844-R846 PolarHBondContact O-N 3.28Å; R846-N849 PolarHBondContact O-N 3.22Å; R846-I850 WeakPolarHBondContact O-CG1 3.42Å; R846-I850 PolarHBondContact O-N 2.88Å
847	M	97.8	Very high	95.9	Very high	137 Å²	137	101.4 Å²	101.4	68%	0.675	49%	0.49	S	S	*	.	H	α-helix	trans	-64.7	-40	176.2	-171.1	-174.6	-65	0	0	112.5	R843 A844 I850 R851	R843-M847 PolarHBondContact O-N 2.88Å; A844-M847 WeakPolarHBondContact O-CB 3.42Å; A844-M847 PolarHBondContact O-N 3.26Å; A844-M847 VanDerWaalsContact O-N 3.15Å; M847-I850 PolarHBondContact O-N 2.79Å; M847-R851 WeakPolarHBondContact O-CB 3.28Å; M847-R851 PolarHBondContact O-N 3.5Å
848	L	96.5	Very high	96	Very high	107 Å²	107	100.7 Å²	100.7	56%	0.56	49%	0.489	S	S	*	.	H	α-helix	trans	-66.1	-39.4	175.2	-72.2	172.7	0	0	0	112	A844 N845 R851 L852	A844-L848 WeakPolarHBondContact O-CG 3.27Å; A844-L848 PolarHBondContact O-N 2.81Å; N845-L848 PolarHBondContact O-N 3.17Å; L848-R851 PolarHBondContact O-N 3.28Å; L848-L852 WeakPolarHBondContact O-CB 3.36Å; L848-L852 PolarHBondContact O-N 3.36Å
849	N	96.2	Very high	96.2	Very high	94 Å²	94	99.3 Å²	99.3	50%	0.503	49%	0.485	S	S	.	.	H	α-helix	trans	-64.3	-46.5	174.5	-74.6	-4.8	0	0	0	111.7	N845 R846 R851 L852 E853	N845-N849 WeakPolarHBondContact O-CB 3.28Å; N845-N849 VanDerWaalsContact O-CG 3.31Å; N845-N849 PolarHBondContact O-N 2.78Å; R846-N849 PolarHBondContact O-N 3.22Å; N849-R851 VanDerWaalsContact C-N 3.3Å; N849-R851 PolarHBondContact O-N 3.33Å; N849-L852 WeakPolarHBondContact O-CB 3.42Å; N849-L852 PolarHBondContact O-N 2.86Å; N849-L852 VanDerWaalsContact O-N 3.1Å; N849-E853 WeakPolarHBondContact O-CG 3.32Å; N849-E853 PolarHBondContact O-N 3.43Å
850	I	97.4	Very high	96.2	Very high	93 Å²	93	97.1 Å²	97.1	48%	0.477	48%	0.484	S	S	.	.	H	α-helix	trans	-58	-44.9	174.9	-67.4	163.2	0	0	0	110.5	R846 M847 L852 E853 D854	R846-I850 WeakPolarHBondContact O-CG1 3.42Å; R846-I850 PolarHBondContact O-N 2.88Å; M847-I850 PolarHBondContact O-N 2.79Å; I850-L852 VanDerWaalsContact C-N 3.33Å; I850-L852 PolarHBondContact O-N 2.8Å; I850-E853 PolarHBondContact O-N 2.87Å; I850-D854 WeakPolarHBondContact O-CB 3.48Å; I850-D854 PolarHBondContact O-N 3.18Å
851	R	97.2	Very high	96.3	Very high	181 Å²	181	96.9 Å²	96.9	68%	0.683	48%	0.481	S	S	*	.	H	α-helix	trans	-63.5	-36.9	176.1	-176.2	174.8	178.5	160.3	2.3	112.7	M847 L848 N849 D854 V855	M847-R851 WeakPolarHBondContact O-CB 3.28Å; M847-R851 PolarHBondContact O-N 3.5Å; L848-R851 PolarHBondContact O-N 3.28Å; N849-R851 VanDerWaalsContact C-N 3.3Å; N849-R851 PolarHBondContact O-N 3.33Å; R851-D854 PolarHBondContact O-N 2.76Å; R851-V855 WeakPolarHBondContact O-CB 3.25Å; R851-V855 VanDerWaalsContact O-CG2 3.3Å; R851-V855 WeakPolarHBondContact O-CG2 3.26Å; R851-V855 PolarHBondContact O-N 2.64Å
852	L	95.8	Very high	96.4	Very high	93 Å²	93	95.6 Å²	95.6	49%	0.487	48%	0.476	S	S	.	.	H	α-helix	trans	-67.1	-45.5	175.4	176.7	61.5	0	0	0	111.1	L848 N849 I850 D854 V855 Q856	L848-L852 WeakPolarHBondContact O-CB 3.36Å; L848-L852 PolarHBondContact O-N 3.36Å; N849-L852 WeakPolarHBondContact O-CB 3.42Å; N849-L852 PolarHBondContact O-N 2.86Å; N849-L852 VanDerWaalsContact O-N 3.1Å; I850-L852 VanDerWaalsContact C-N 3.33Å; I850-L852 PolarHBondContact O-N 2.8Å; L852-D854 VanDerWaalsContact C-N 3.31Å; L852-D854 PolarHBondContact O-N 2.7Å; L852-V855 PolarHBondContact O-N 3.2Å; L852-Q856 HydrophobicContact CD1-CG 4.47Å; L852-Q856 WeakPolarHBondContact O-CB 3.27Å; L852-Q856 VanDerWaalsContact O-CG 3.29Å; L852-Q856 WeakPolarHBondContact O-CG 3.37Å; L852-Q856 PolarHBondContact O-N 2.65Å
853	E	96.7	Very high	96.4	Very high	90 Å²	90	96.6 Å²	96.6	42%	0.421	48%	0.477	S	S	.	.	H	α-helix	trans	-59.6	-40.5	174	-71.1	177.5	-154.2	0	0	111.9	N849 I850 Q856 K857	N849-E853 WeakPolarHBondContact O-CG 3.32Å; N849-E853 PolarHBondContact O-N 3.43Å; I850-E853 PolarHBondContact O-N 2.87Å; E853-Q856 CarbonylContact O-C 2.78Å; E853-Q856 WeakPolarHBondContact O-CB 3.41Å; E853-Q856 PolarHBondContact O-N 3.36Å; E853-K857 WeakPolarHBondContact O-CB 3.34Å; E853-K857 WeakPolarHBondContact O-CD 3.45Å; E853-K857 WeakPolarHBondContact O-CE 3.49Å; E853-K857 WeakPolarHBondContact O-CG 3.28Å; E853-K857 PolarHBondContact O-N 2.98Å; E853-K857 IonicContact OE2-NZ 2.68Å; E853-K857 PolarHBondContact OE2-NZ 3.35Å; E853-K857 VanDerWaalsContact OE2-NZ 3.11Å
854	D	97.4	Very high	96.4	Very high	71 Å²	71	96.8 Å²	96.8	38%	0.38	49%	0.486	S	S	.	.	H	α-helix	trans	-71.7	-34.4	179	-70.1	-15.9	0	0	0	112.2	I850 R851 L852 K857 N858	I850-D854 WeakPolarHBondContact O-CB 3.48Å; I850-D854 PolarHBondContact O-N 3.18Å; R851-D854 PolarHBondContact O-N 2.76Å; L852-D854 VanDerWaalsContact C-N 3.31Å; L852-D854 PolarHBondContact O-N 2.7Å; D854-K857 PolarHBondContact O-N 2.77Å; D854-K857 WeakPolarHBondContact OD1-CD 3.19Å; D854-K857 IonicContact OD1-NZ 3.15Å; D854-K857 PolarHBondContact OD1-NZ 2.63Å; D854-N858 WeakPolarHBondContact O-CB 3.41Å; D854-N858 PolarHBondContact O-N 2.74Å; D854-N858 PolarHBondContact O-ND2 3.16Å
855	V	96.5	Very high	96.4	Very high	85 Å²	85	99.8 Å²	99.8	52%	0.515	49%	0.493	S	S	.	.	H	α-helix	trans	-64.4	-39.9	167.7	168.4	0	0	0	0	111.1	R851 L852 N858 L859	R851-V855 WeakPolarHBondContact O-CB 3.25Å; R851-V855 VanDerWaalsContact O-CG2 3.3Å; R851-V855 WeakPolarHBondContact O-CG2 3.26Å; R851-V855 PolarHBondContact O-N 2.64Å; L852-V855 PolarHBondContact O-N 3.2Å; V855-N858 PolarHBondContact O-N 3.11Å; V855-L859 WeakPolarHBondContact O-CB 3.38Å; V855-L859 PolarHBondContact O-N 2.89Å
856	Q	95.8	Very high	96.4	Very high	110 Å²	110	100 Å²	100	51%	0.514	49%	0.494	S	S	.	.	H	α-helix	trans	-66.4	-42.3	174.9	-73.5	170.6	-6.7	0	0	112.3	L852 E853 N858 L859 A860	L852-Q856 HydrophobicContact CD1-CG 4.47Å; L852-Q856 WeakPolarHBondContact O-CB 3.27Å; L852-Q856 VanDerWaalsContact O-CG 3.29Å; L852-Q856 WeakPolarHBondContact O-CG 3.37Å; L852-Q856 PolarHBondContact O-N 2.65Å; E853-Q856 CarbonylContact O-C 2.78Å; E853-Q856 WeakPolarHBondContact O-CB 3.41Å; E853-Q856 PolarHBondContact O-N 3.36Å; Q856-N858 VanDerWaalsContact C-N 3.31Å; Q856-N858 PolarHBondContact O-N 3.06Å; Q856-L859 PolarHBondContact O-N 3.48Å; Q856-A860 WeakPolarHBondContact O-CB 3.36Å; Q856-A860 PolarHBondContact O-N 3.26Å
857	K	96.9	Very high	96.4	Very high	96 Å²	96	98.1 Å²	98.1	42%	0.417	49%	0.49	S	S	.	.	H	α-helix	trans	-60.8	-40.9	173.8	-69.9	159.4	-149.4	157.4	0	110.8	E853 D854 K861	E853-K857 WeakPolarHBondContact O-CB 3.34Å; E853-K857 WeakPolarHBondContact O-CD 3.45Å; E853-K857 WeakPolarHBondContact O-CE 3.49Å; E853-K857 WeakPolarHBondContact O-CG 3.28Å; E853-K857 PolarHBondContact O-N 2.98Å; E853-K857 IonicContact OE2-NZ 2.68Å; E853-K857 PolarHBondContact OE2-NZ 3.35Å; E853-K857 VanDerWaalsContact OE2-NZ 3.11Å; D854-K857 PolarHBondContact O-N 2.77Å; D854-K857 WeakPolarHBondContact OD1-CD 3.19Å; D854-K857 IonicContact OD1-NZ 3.15Å; D854-K857 PolarHBondContact OD1-NZ 2.63Å; K857-K861 WeakPolarHBondContact O-CG 3.49Å; K857-K861 PolarHBondContact O-N 3.18Å
858	N	97.3	Very high	96.3	Very high	79 Å²	79	95.5 Å²	95.5	42%	0.422	48%	0.479	S	S	.	.	H	α-helix	trans	-75.5	-34.9	178.8	-68.9	-23.1	0	0	0	112.7	D854 V855 Q856 K861 L862	D854-N858 WeakPolarHBondContact O-CB 3.41Å; D854-N858 PolarHBondContact O-N 2.74Å; D854-N858 PolarHBondContact O-ND2 3.16Å; V855-N858 PolarHBondContact O-N 3.11Å; Q856-N858 VanDerWaalsContact C-N 3.31Å; Q856-N858 PolarHBondContact O-N 3.06Å; N858-K861 PolarHBondContact O-N 3.4Å; N858-K861 PolarHBondContact OD1-NZ 3.16Å; N858-L862 WeakPolarHBondContact O-CG 3.16Å; N858-L862 PolarHBondContact O-N 2.82Å
859	L	95.5	Very high	96.2	Very high	97 Å²	97	95.4 Å²	95.4	51%	0.508	48%	0.478	S	S	.	.	H	α-helix	trans	-61.6	-46.3	169.1	-179.9	61.9	0	0	0	110.7	V855 Q856 K861 L862 D863	V855-L859 WeakPolarHBondContact O-CB 3.38Å; V855-L859 PolarHBondContact O-N 2.89Å; Q856-L859 PolarHBondContact O-N 3.48Å; L859-K861 VanDerWaalsContact C-N 3.29Å; L859-K861 PolarHBondContact O-N 3.49Å; L859-L862 CarbonylContact O-C 3.6Å; L859-L862 PolarHBondContact O-N 2.75Å; L859-L862 VanDerWaalsContact O-N 3.13Å; L859-D863 WeakPolarHBondContact O-CB 3.49Å; L859-D863 VanDerWaalsContact O-CG 3.31Å; L859-D863 PolarHBondContact O-N 2.76Å
860	A	95.4	Very high	96.2	Very high	50 Å²	50	97.1 Å²	97.1	41%	0.413	48%	0.483	S	S	.	.	H	α-helix	trans	-63.7	-30.4	177.5	0	0	0	0	0	113.4	Q856 L864	Q856-A860 WeakPolarHBondContact O-CB 3.36Å; Q856-A860 PolarHBondContact O-N 3.26Å; A860-L864 WeakPolarHBondContact O-CG 3.43Å; A860-L864 PolarHBondContact O-N 3.33Å
861	K	97.4	Very high	96.1	Very high	110 Å²	110	98.2 Å²	98.2	48%	0.478	49%	0.49	S	S	.	.	H	α-helix	trans	-67.9	-49.6	168.9	-70.8	169.2	-166.3	164.2	0	111.3	K857 N858 L859 D863 L864 E865	K857-K861 WeakPolarHBondContact O-CG 3.49Å; K857-K861 PolarHBondContact O-N 3.18Å; N858-K861 PolarHBondContact O-N 3.4Å; N858-K861 PolarHBondContact OD1-NZ 3.16Å; L859-K861 VanDerWaalsContact C-N 3.29Å; L859-K861 PolarHBondContact O-N 3.49Å; K861-D863 PolarHBondContact O-N 2.79Å; K861-L864 CarbonylContact O-C 3.51Å; K861-L864 WeakPolarHBondContact O-CA 3.3Å; K861-L864 WeakPolarHBondContact O-CB 3.4Å; K861-L864 PolarHBondContact O-N 2.84Å; K861-E865 WeakPolarHBondContact O-CG 3.26Å; K861-E865 PolarHBondContact O-N 3.45Å
862	L	95	Very high	96	Very high	90 Å²	90	96.6 Å²	96.6	47%	0.471	48%	0.484	S	S	.	.	H	α-helix	trans	-60.3	-35.2	177	-70.4	168.2	0	0	0	111.8	N858 L859 L864 E865 N866	N858-L862 WeakPolarHBondContact O-CG 3.16Å; N858-L862 PolarHBondContact O-N 2.82Å; L859-L862 CarbonylContact O-C 3.6Å; L859-L862 PolarHBondContact O-N 2.75Å; L859-L862 VanDerWaalsContact O-N 3.13Å; L862-L864 VanDerWaalsContact C-N 3.29Å; L862-L864 PolarHBondContact O-N 3.48Å; L862-E865 PolarHBondContact O-N 3.38Å; L862-N866 WeakPolarHBondContact O-CB 3.37Å; L862-N866 PolarHBondContact O-N 2.8Å; L862-N866 PolarHBondContact O-ND2 2.76Å
863	D	95.1	Very high	96	Very high	69 Å²	69	96.9 Å²	96.9	37%	0.369	49%	0.485	S	S	.	.	H	α-helix	trans	-69.7	-22	173.7	-73.5	-21.6	0	0	0	113.3	L859 K861 K867	L859-D863 WeakPolarHBondContact O-CB 3.49Å; L859-D863 VanDerWaalsContact O-CG 3.31Å; L859-D863 PolarHBondContact O-N 2.76Å; K861-D863 PolarHBondContact O-N 2.79Å; D863-K867 WeakPolarHBondContact O-CD 3.26Å; D863-K867 VanDerWaalsContact O-CG 3.25Å; D863-K867 WeakPolarHBondContact O-CG 3.46Å; D863-K867 PolarHBondContact O-NZ 2.83Å
864	L	96.6	Very high	95.9	Very high	111 Å²	111	97.9 Å²	97.9	58%	0.581	49%	0.49	S	S	*	.	H	α-helix	trans	-84.6	-46.1	170.9	-72.9	166.3	0	0	0	110.4	A860 K861 L862 N866 K867 D868	A860-L864 WeakPolarHBondContact O-CG 3.43Å; A860-L864 PolarHBondContact O-N 3.33Å; K861-L864 CarbonylContact O-C 3.51Å; K861-L864 WeakPolarHBondContact O-CA 3.3Å; K861-L864 WeakPolarHBondContact O-CB 3.4Å; K861-L864 PolarHBondContact O-N 2.84Å; L862-L864 VanDerWaalsContact C-N 3.29Å; L862-L864 PolarHBondContact O-N 3.48Å; L864-N866 VanDerWaalsContact C-N 3.3Å; L864-N866 PolarHBondContact O-N 2.77Å; L864-K867 WeakPolarHBondContact O-CB 3.21Å; L864-K867 PolarHBondContact O-N 3.5Å; L864-D868 PolarHBondContact O-N 2.72Å
865	E	96.8	Very high	95.8	Very high	104 Å²	104	99.8 Å²	99.8	49%	0.486	50%	0.497	S	S	.	.	H	α-helix	trans	-58.6	-40.2	175.2	-70	166.7	-151	0	0	111.7	K861 L862 D868 L869	K861-E865 WeakPolarHBondContact O-CG 3.26Å; K861-E865 PolarHBondContact O-N 3.45Å; L862-E865 PolarHBondContact O-N 3.38Å; E865-D868 WeakPolarHBondContact O-CB 3.22Å; E865-D868 PolarHBondContact O-N 3.3Å; E865-L869 WeakPolarHBondContact O-CB 3.18Å; E865-L869 VanDerWaalsContact O-CG 3.23Å; E865-L869 WeakPolarHBondContact O-CG 3.37Å; E865-L869 PolarHBondContact O-N 3.18Å
866	N	94.5	Very high	95.6	Very high	86 Å²	86	101.4 Å²	101.4	46%	0.46	50%	0.498	S	S	.	.	H	α-helix	trans	-63.8	-38.9	173	-77.2	-36.5	0	0	0	112.2	L862 L864 L869 E870	L862-N866 WeakPolarHBondContact O-CB 3.37Å; L862-N866 PolarHBondContact O-N 2.8Å; L862-N866 PolarHBondContact O-ND2 2.76Å; L864-N866 VanDerWaalsContact C-N 3.3Å; L864-N866 PolarHBondContact O-N 2.77Å; N866-L869 PolarHBondContact O-N 3.38Å; N866-E870 WeakPolarHBondContact O-CB 3.13Å; N866-E870 WeakPolarHBondContact O-CG 3.38Å; N866-E870 PolarHBondContact O-N 2.79Å
867	K	96.2	Very high	95.5	Very high	107 Å²	107	100.9 Å²	100.9	47%	0.465	50%	0.495	S	S	.	.	H	α-helix	trans	-68.5	-44.1	175.7	-72.8	176.5	-168.6	88	0	111.6	D863 L864 L869 E870 D871	D863-K867 WeakPolarHBondContact O-CD 3.26Å; D863-K867 VanDerWaalsContact O-CG 3.25Å; D863-K867 WeakPolarHBondContact O-CG 3.46Å; D863-K867 PolarHBondContact O-NZ 2.83Å; L864-K867 WeakPolarHBondContact O-CB 3.21Å; L864-K867 PolarHBondContact O-N 3.5Å; K867-L869 PolarHBondContact O-N 3.44Å; K867-E870 PolarHBondContact O-N 2.86Å; K867-E870 VanDerWaalsContact O-N 3.13Å; K867-D871 WeakPolarHBondContact O-CB 3.36Å; K867-D871 PolarHBondContact O-N 2.91Å
868	D	96.6	Very high	95.4	Very high	83 Å²	83	98.6 Å²	98.6	44%	0.444	49%	0.491	S	S	.	.	H	α-helix	trans	-55.5	-38.2	171.7	-105.1	55.8	0	0	0	111.7	L864 E865 R872	L864-D868 PolarHBondContact O-N 2.72Å; E865-D868 WeakPolarHBondContact O-CB 3.22Å; E865-D868 PolarHBondContact O-N 3.3Å; D868-R872 WeakPolarHBondContact O-CB 3.25Å; D868-R872 WeakPolarHBondContact O-CD 3.14Å; D868-R872 WeakPolarHBondContact O-CG 3.31Å; D868-R872 PolarHBondContact O-N 3.12Å; D868-R872 VanDerWaalsContact O-N 3.07Å; D868-R872 PolarHBondContact O-NE 2.9Å; D868-R872 IonicContact OD2-NH2 3.85Å; D868-R872 PolarHBondContact OD2-NH2 2.8Å
869	L	94.4	Very high	95.2	Very high	105 Å²	105	97.9 Å²	97.9	55%	0.55	49%	0.485	S	S	.	.	H	α-helix	trans	-75.7	-36.4	175.6	-71.9	170	0	0	0	113	E865 N866 K867 L873	E865-L869 WeakPolarHBondContact O-CB 3.18Å; E865-L869 VanDerWaalsContact O-CG 3.23Å; E865-L869 WeakPolarHBondContact O-CG 3.37Å; E865-L869 PolarHBondContact O-N 3.18Å; N866-L869 PolarHBondContact O-N 3.38Å; K867-L869 PolarHBondContact O-N 3.44Å; L869-L873 WeakPolarHBondContact O-CB 3.35Å; L869-L873 PolarHBondContact O-N 3.29Å
870	E	95.1	Very high	95.2	Very high	130 Å²	130	100.8 Å²	100.8	61%	0.607	49%	0.493	S	S	*	.	H	α-helix	trans	-65.8	-42.9	173.6	-78.8	-177.2	160.2	0	0	111.7	N866 K867 L873 Q874	N866-E870 WeakPolarHBondContact O-CB 3.13Å; N866-E870 WeakPolarHBondContact O-CG 3.38Å; N866-E870 PolarHBondContact O-N 2.79Å; K867-E870 PolarHBondContact O-N 2.86Å; K867-E870 VanDerWaalsContact O-N 3.13Å; E870-L873 CarbonylContact O-C 3.27Å; E870-L873 PolarHBondContact O-N 3.3Å; E870-Q874 VanDerWaalsContact O-CB 3.31Å; E870-Q874 WeakPolarHBondContact O-CB 3.43Å; E870-Q874 PolarHBondContact O-N 3.42Å
871	D	95.9	Very high	95.2	Very high	115 Å²	115	103.6 Å²	103.6	62%	0.615	50%	0.498	S	S	*	.	H	α-helix	trans	-65.9	-44.5	175.8	-81.4	-21.1	0	0	0	111.1	K867 L873 Q874 E875	K867-D871 WeakPolarHBondContact O-CB 3.36Å; K867-D871 PolarHBondContact O-N 2.91Å; D871-L873 VanDerWaalsContact C-N 3.34Å; D871-L873 PolarHBondContact O-N 2.85Å; D871-Q874 CarbonylContact O-C 3.51Å; D871-Q874 WeakPolarHBondContact O-CB 3.12Å; D871-Q874 PolarHBondContact O-N 2.76Å; D871-Q874 VanDerWaalsContact O-N 3.11Å; D871-E875 PolarHBondContact O-N 2.84Å
872	R	95.6	Very high	95.1	Very high	148 Å²	148	104.4 Å²	104.4	56%	0.558	50%	0.503	S	S	*	.	H	α-helix	trans	-61.3	-41.1	172.1	-72.8	168.2	-156.5	-145.8	8.8	112.2	D868 Q874 E875 E876	D868-R872 WeakPolarHBondContact O-CB 3.25Å; D868-R872 WeakPolarHBondContact O-CD 3.14Å; D868-R872 WeakPolarHBondContact O-CG 3.31Å; D868-R872 PolarHBondContact O-N 3.12Å; D868-R872 VanDerWaalsContact O-N 3.07Å; D868-R872 PolarHBondContact O-NE 2.9Å; D868-R872 IonicContact OD2-NH2 3.85Å; D868-R872 PolarHBondContact OD2-NH2 2.8Å; R872-Q874 VanDerWaalsContact C-N 3.28Å; R872-Q874 PolarHBondContact O-N 2.87Å; R872-E875 PolarHBondContact O-N 2.88Å; R872-E876 WeakPolarHBondContact O-CB 3.39Å; R872-E876 WeakPolarHBondContact O-CG 3.25Å; R872-E876 PolarHBondContact O-N 2.93Å
873	L	94.8	Very high	95.1	Very high	98 Å²	98	107 Å²	107	51%	0.513	51%	0.511	S	S	.	.	H	α-helix	trans	-66.2	-31.6	175	176.8	62.3	0	0	0	111.6	L869 E870 D871 K877	L869-L873 WeakPolarHBondContact O-CB 3.35Å; L869-L873 PolarHBondContact O-N 3.29Å; E870-L873 CarbonylContact O-C 3.27Å; E870-L873 PolarHBondContact O-N 3.3Å; D871-L873 VanDerWaalsContact C-N 3.34Å; D871-L873 PolarHBondContact O-N 2.85Å; L873-K877 WeakPolarHBondContact O-CG 3.33Å; L873-K877 PolarHBondContact O-N 3.24Å
874	Q	95.5	Very high	95.2	Very high	112 Å²	112	109.3 Å²	109.3	52%	0.523	52%	0.518	S	S	.	.	H	α-helix	trans	-74.3	-37.7	174.6	-169.2	66.7	6.3	0	0	111.7	E870 D871 R872 K877 S878	E870-Q874 VanDerWaalsContact O-CB 3.31Å; E870-Q874 WeakPolarHBondContact O-CB 3.43Å; E870-Q874 PolarHBondContact O-N 3.42Å; D871-Q874 CarbonylContact O-C 3.51Å; D871-Q874 WeakPolarHBondContact O-CB 3.12Å; D871-Q874 PolarHBondContact O-N 2.76Å; D871-Q874 VanDerWaalsContact O-N 3.11Å; R872-Q874 VanDerWaalsContact C-N 3.28Å; R872-Q874 PolarHBondContact O-N 2.87Å; Q874-K877 PolarHBondContact O-N 3.5Å; Q874-K877 VanDerWaalsContact OE1-CD 3.27Å; Q874-S878 PolarHBondContact O-N 2.78Å
875	E	95.1	Very high	95.1	Very high	111 Å²	111	107.1 Å²	107.1	52%	0.519	51%	0.507	S	S	.	.	H	α-helix	trans	-62	-50.1	170.8	-165.7	-176.4	166.1	0	0	110.6	D871 R872 K877 S878 Q879	D871-E875 PolarHBondContact O-N 2.84Å; R872-E875 PolarHBondContact O-N 2.88Å; E875-K877 VanDerWaalsContact C-N 3.35Å; E875-K877 PolarHBondContact O-N 3.32Å; E875-S878 CarbonylContact O-C 3.07Å; E875-S878 WeakPolarHBondContact O-CA 3.14Å; E875-S878 WeakPolarHBondContact O-CB 3.25Å; E875-S878 PolarHBondContact O-N 3.44Å; E875-S878 PolarHBondContact O-OG 2.86Å; E875-Q879 HydrophobicContact CG-CG 4.45Å; E875-Q879 WeakPolarHBondContact O-CG 3.49Å; E875-Q879 PolarHBondContact O-N 3.35Å; E875-Q879 PolarHBondContact OE1-NE2 2.86Å; E875-Q879 VanDerWaalsContact OE1-NE2 3.1Å
876	E	91.4	Very high	95.1	Very high	118 Å²	118	107.4 Å²	107.4	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-56.7	-41.5	174.5	-83.5	-72.4	168	0	0	112.9	R872 S878 Q879 K880	R872-E876 WeakPolarHBondContact O-CB 3.39Å; R872-E876 WeakPolarHBondContact O-CG 3.25Å; R872-E876 PolarHBondContact O-N 2.93Å; E876-S878 VanDerWaalsContact C-N 3.32Å; E876-S878 PolarHBondContact O-N 3.26Å; E876-Q879 PolarHBondContact O-N 3.37Å; E876-K880 WeakPolarHBondContact O-CB 3.38Å; E876-K880 PolarHBondContact O-N 3.22Å
877	K	93.9	Very high	95.2	Very high	100 Å²	100	108.6 Å²	108.6	44%	0.435	51%	0.51	S	S	.	.	H	α-helix	trans	-60.3	-42.5	171	-72.9	164.1	-161.4	141.8	0	111.4	L873 Q874 E875 K880 E881	L873-K877 WeakPolarHBondContact O-CG 3.33Å; L873-K877 PolarHBondContact O-N 3.24Å; Q874-K877 PolarHBondContact O-N 3.5Å; Q874-K877 VanDerWaalsContact OE1-CD 3.27Å; E875-K877 VanDerWaalsContact C-N 3.35Å; E875-K877 PolarHBondContact O-N 3.32Å; K877-K880 PolarHBondContact O-N 2.9Å; K877-E881 WeakPolarHBondContact O-CB 3.41Å; K877-E881 PolarHBondContact O-N 2.85Å
878	S	94.9	Very high	95.2	Very high	48 Å²	48	105.9 Å²	105.9	34%	0.336	50%	0.501	S	S	.	.	H	α-helix	trans	-68.3	-41.1	179.8	84.6	0	0	0	0	112.2	Q874 E875 E876 E881 Q882	Q874-S878 PolarHBondContact O-N 2.78Å; E875-S878 CarbonylContact O-C 3.07Å; E875-S878 WeakPolarHBondContact O-CA 3.14Å; E875-S878 WeakPolarHBondContact O-CB 3.25Å; E875-S878 PolarHBondContact O-N 3.44Å; E875-S878 PolarHBondContact O-OG 2.86Å; E876-S878 VanDerWaalsContact C-N 3.32Å; E876-S878 PolarHBondContact O-N 3.26Å; S878-E881 PolarHBondContact O-N 2.91Å; S878-Q882 VanDerWaalsContact O-CG 3.31Å; S878-Q882 WeakPolarHBondContact O-CG 3.38Å; S878-Q882 PolarHBondContact O-N 2.94Å
879	Q	93.9	Very high	95.1	Very high	64 Å²	64	103.8 Å²	103.8	30%	0.299	49%	0.49	S	S	.	.	H	α-helix	trans	-63.7	-44.3	173.7	-67.3	-173.3	25.1	0	0	110.2	E875 E876 E881 Q882 F883	E875-Q879 HydrophobicContact CG-CG 4.45Å; E875-Q879 WeakPolarHBondContact O-CG 3.49Å; E875-Q879 PolarHBondContact O-N 3.35Å; E875-Q879 PolarHBondContact OE1-NE2 2.86Å; E875-Q879 VanDerWaalsContact OE1-NE2 3.1Å; E876-Q879 PolarHBondContact O-N 3.37Å; Q879-E881 VanDerWaalsContact C-N 3.29Å; Q879-E881 PolarHBondContact O-N 2.81Å; Q879-Q882 WeakPolarHBondContact O-CB 3.15Å; Q879-Q882 PolarHBondContact O-N 3.48Å; Q879-F883 HydrophobicContact CB-CD2 4.48Å; Q879-F883 HydrophobicContact CB-CE2 4.33Å; Q879-F883 WeakPolarHBondContact O-CD2 3.44Å; Q879-F883 PolarHBondContact O-N 3.45Å
880	K	95.2	Very high	95.2	Very high	157 Å²	157	103.3 Å²	103.3	68%	0.683	49%	0.487	S	S	*	.	H	α-helix	trans	-60.5	-35.5	173.9	-177.3	175.7	-178.4	174.3	0	112.9	E876 K877 K884	E876-K880 WeakPolarHBondContact O-CB 3.38Å; E876-K880 PolarHBondContact O-N 3.22Å; K877-K880 PolarHBondContact O-N 2.9Å; K880-K884 VanDerWaalsContact O-CB 3.26Å; K880-K884 WeakPolarHBondContact O-CB 3.29Å; K880-K884 PolarHBondContact O-N 2.83Å
881	E	95.6	Very high	95.1	Very high	109 Å²	109	100.9 Å²	100.9	51%	0.509	48%	0.475	S	S	.	.	H	α-helix	trans	-72.1	-40.1	173.3	-176.7	148.9	-127.6	0	0	112.2	K877 S878 Q879 K884 N885	K877-E881 WeakPolarHBondContact O-CB 3.41Å; K877-E881 PolarHBondContact O-N 2.85Å; S878-E881 PolarHBondContact O-N 2.91Å; Q879-E881 VanDerWaalsContact C-N 3.29Å; Q879-E881 PolarHBondContact O-N 2.81Å; E881-K884 WeakPolarHBondContact O-CB 3.35Å; E881-K884 PolarHBondContact O-N 3.45Å; E881-N885 WeakPolarHBondContact O-CB 3.48Å; E881-N885 VanDerWaalsContact O-CG 3.24Å; E881-N885 PolarHBondContact O-N 3.45Å; E881-N885 PolarHBondContact O-ND2 2.68Å
882	Q	93.9	Very high	95.1	Very high	127 Å²	127	96 Å²	96	59%	0.593	45%	0.449	S	S	*	.	H	α-helix	trans	-59.6	-46.9	170.9	-69.2	170.5	37	0	0	111.4	S878 Q879 K884 N885 M886	S878-Q882 VanDerWaalsContact O-CG 3.31Å; S878-Q882 WeakPolarHBondContact O-CG 3.38Å; S878-Q882 PolarHBondContact O-N 2.94Å; Q879-Q882 WeakPolarHBondContact O-CB 3.15Å; Q879-Q882 PolarHBondContact O-N 3.48Å; Q882-K884 PolarHBondContact O-N 3.45Å; Q882-N885 PolarHBondContact O-N 3.22Å; Q882-M886 WeakPolarHBondContact O-CB 3.34Å; Q882-M886 PolarHBondContact O-N 2.99Å
883	F	95.3	Very high	95.1	Very high	144 Å²	144	93.2 Å²	93.2	63%	0.632	44%	0.443	S	S	*	.	H	α-helix	trans	-63.5	-37.4	175	-74.2	-57.4	0	0	0	112.6	Q879 K887	Q879-F883 HydrophobicContact CB-CD2 4.48Å; Q879-F883 HydrophobicContact CB-CE2 4.33Å; Q879-F883 WeakPolarHBondContact O-CD2 3.44Å; Q879-F883 PolarHBondContact O-N 3.45Å; F883-K887 WeakPolarHBondContact O-CB 3.23Å; F883-K887 PolarHBondContact O-N 3.46Å
884	K	97	Very high	95.1	Very high	119 Å²	119	96 Å²	96	52%	0.517	45%	0.446	S	S	.	.	H	α-helix	trans	-64	-43.4	173.5	179	-170.8	171.1	-161.5	0	111.4	K880 E881 Q882 K887 N888	K880-K884 VanDerWaalsContact O-CB 3.26Å; K880-K884 WeakPolarHBondContact O-CB 3.29Å; K880-K884 PolarHBondContact O-N 2.83Å; E881-K884 WeakPolarHBondContact O-CB 3.35Å; E881-K884 PolarHBondContact O-N 3.45Å; Q882-K884 PolarHBondContact O-N 3.45Å; K884-K887 PolarHBondContact O-N 2.88Å; K884-N888 WeakPolarHBondContact O-CB 3.32Å; K884-N888 PolarHBondContact O-N 2.9Å; K884-N888 PolarHBondContact O-ND2 3Å; K884-N888 PolarHBondContact O-OD1 3.03Å
885	N	96.3	Very high	95	Very high	65 Å²	65	95.7 Å²	95.7	35%	0.348	44%	0.44	S	S	.	.	H	α-helix	trans	-69.3	-41.8	178.4	-68	-21.4	0	0	0	111.4	E881 Q882 N888 N889	E881-N885 WeakPolarHBondContact O-CB 3.48Å; E881-N885 VanDerWaalsContact O-CG 3.24Å; E881-N885 PolarHBondContact O-N 3.45Å; E881-N885 PolarHBondContact O-ND2 2.68Å; Q882-N885 PolarHBondContact O-N 3.22Å; N885-N888 PolarHBondContact O-N 2.94Å; N885-N889 VanDerWaalsContact O-CG 3.31Å; N885-N889 PolarHBondContact O-N 3.46Å; N885-N889 PolarHBondContact O-OD1 2.71Å
886	M	95.9	Very high	95	Very high	109 Å²	109	93.7 Å²	93.7	54%	0.537	44%	0.436	S	S	.	.	H	α-helix	trans	-60.7	-44.4	172.2	-174.1	61.4	70.4	0	0	111.7	Q882 N888 N889 I890	Q882-M886 WeakPolarHBondContact O-CB 3.34Å; Q882-M886 PolarHBondContact O-N 2.99Å; M886-N888 PolarHBondContact O-N 3.37Å; M886-N889 PolarHBondContact O-N 2.81Å; M886-I890 HydrophobicContact CG-CD1 4.02Å; M886-I890 WeakPolarHBondContact O-CG1 3.3Å; M886-I890 PolarHBondContact O-N 2.76Å; M886-I890 HydrophobicContact SD-CD1 4.38Å
887	K	95.9	Very high	95.1	Very high	111 Å²	111	93.3 Å²	93.3	48%	0.483	44%	0.437	S	S	.	.	H	α-helix	trans	-59.4	-45.2	173.4	176.6	177.7	-177.7	-76.4	0	111.6	F883 K884 N889 I890 E891	F883-K887 WeakPolarHBondContact O-CB 3.23Å; F883-K887 PolarHBondContact O-N 3.46Å; K884-K887 PolarHBondContact O-N 2.88Å; K887-N889 VanDerWaalsContact C-N 3.35Å; K887-N889 PolarHBondContact O-N 3.12Å; K887-I890 PolarHBondContact O-N 2.72Å; K887-E891 VanDerWaalsContact CE-OE1 3.29Å; K887-E891 WeakPolarHBondContact CE-OE1 3.42Å; K887-E891 HydrophobicContact CG-CG 4.47Å; K887-E891 IonicContact NZ-OE1 3.83Å; K887-E891 PolarHBondContact NZ-OE1 3.16Å; K887-E891 IonicContact NZ-OE2 3.07Å; K887-E891 PolarHBondContact NZ-OE2 2.87Å; K887-E891 WeakPolarHBondContact O-CB 3.16Å; K887-E891 WeakPolarHBondContact O-CG 3.3Å; K887-E891 PolarHBondContact O-N 2.82Å
888	N	96	Very high	95.2	Very high	51 Å²	51	91.3 Å²	91.3	27%	0.273	43%	0.431	S	S	.	.	H	α-helix	trans	-61.2	-43.9	177.9	-70.1	-11.4	0	0	0	111.1	K884 N885 M886 E891 D892	K884-N888 WeakPolarHBondContact O-CB 3.32Å; K884-N888 PolarHBondContact O-N 2.9Å; K884-N888 PolarHBondContact O-ND2 3Å; K884-N888 PolarHBondContact O-OD1 3.03Å; N885-N888 PolarHBondContact O-N 2.94Å; M886-N888 PolarHBondContact O-N 3.37Å; N888-E891 CarbonylContact O-C 3.58Å; N888-E891 PolarHBondContact O-N 3.47Å; N888-D892 WeakPolarHBondContact O-CB 3.36Å; N888-D892 PolarHBondContact O-N 2.77Å
889	N	96.1	Very high	95.3	Very high	39 Å²	39	95.3 Å²	95.3	21%	0.209	44%	0.439	C	S	.	.	H	α-helix	trans	-60.8	-46.1	175.6	-67.8	0.6	0	0	0	111.4	H483 N885 M886 K887 E891 D892 E893	H483-N889 PolarHBondContact CD2-ND2 3.02Å; H483-N889 PolarHBondContact NE2-ND2 2.73Å; N885-N889 VanDerWaalsContact O-CG 3.31Å; N885-N889 PolarHBondContact O-N 3.46Å; N885-N889 PolarHBondContact O-OD1 2.71Å; M886-N889 PolarHBondContact O-N 2.81Å; K887-N889 VanDerWaalsContact C-N 3.35Å; K887-N889 PolarHBondContact O-N 3.12Å; N889-E891 VanDerWaalsContact C-N 3.31Å; N889-E891 PolarHBondContact O-N 2.72Å; N889-D892 CarbonylContact O-C 3.57Å; N889-D892 WeakPolarHBondContact O-CB 3.33Å; N889-D892 PolarHBondContact O-N 3.43Å; N889-D892 VanDerWaalsContact O-N 3.12Å; N889-E893 WeakPolarHBondContact O-CB 3.47Å; N889-E893 WeakPolarHBondContact O-CG 3.43Å; N889-E893 PolarHBondContact O-N 2.78Å
890	I	95.1	Very high	95.3	Very high	95 Å²	95	95.3 Å²	95.3	49%	0.487	44%	0.443	S	S	.	.	H	α-helix	trans	-64.1	-36.1	176.5	-66.6	165.4	0	0	0	111.1	M886 K887 R894	M886-I890 HydrophobicContact CG-CD1 4.02Å; M886-I890 WeakPolarHBondContact O-CG1 3.3Å; M886-I890 PolarHBondContact O-N 2.76Å; M886-I890 HydrophobicContact SD-CD1 4.38Å; K887-I890 PolarHBondContact O-N 2.72Å; I890-R894 WeakPolarHBondContact O-CB 3.27Å; I890-R894 PolarHBondContact O-N 3.12Å
891	E	94.5	Very high	95.2	Very high	78 Å²	78	91.1 Å²	91.1	36%	0.364	43%	0.431	S	S	.	.	H	α-helix	trans	-72.7	-29.1	173.3	-75.1	-179.5	161.1	0	0	112.8	K887 N888 N889 R895	K887-E891 VanDerWaalsContact CE-OE1 3.29Å; K887-E891 WeakPolarHBondContact CE-OE1 3.42Å; K887-E891 HydrophobicContact CG-CG 4.47Å; K887-E891 IonicContact NZ-OE1 3.83Å; K887-E891 PolarHBondContact NZ-OE1 3.16Å; K887-E891 IonicContact NZ-OE2 3.07Å; K887-E891 PolarHBondContact NZ-OE2 2.87Å; K887-E891 WeakPolarHBondContact O-CB 3.16Å; K887-E891 WeakPolarHBondContact O-CG 3.3Å; K887-E891 PolarHBondContact O-N 2.82Å; N888-E891 CarbonylContact O-C 3.58Å; N888-E891 PolarHBondContact O-N 3.47Å; N889-E891 VanDerWaalsContact C-N 3.31Å; N889-E891 PolarHBondContact O-N 2.72Å; E891-R895 VanDerWaalsContact C-NH2 3.32Å; E891-R895 VanDerWaalsContact O-CB 3.29Å; E891-R895 WeakPolarHBondContact O-CB 3.46Å; E891-R895 VanDerWaalsContact O-CG 3.28Å; E891-R895 WeakPolarHBondContact O-CG 3.29Å; E891-R895 PolarHBondContact O-N 2.66Å; E891-R895 PolarHBondContact O-NE 2.85Å; E891-R895 PolarHBondContact O-NH2 2.86Å
892	D	95.4	Very high	95.2	Very high	13 Å²	13	90.6 Å²	90.6	7%	0.07	43%	0.428	C	S	.	.	H	α-helix	trans	-71.4	-48.5	173.1	-81	-28.1	0	0	0	110.2	T481 F482 N888 N889 R895 V896	T481-D892 PolarHBondContact OG1-OD2 3.26Å; F482-D892 HydrophobicContact CE1-CB 3.79Å; F482-D892 HydrophobicContact CZ-CB 3.78Å; N888-D892 WeakPolarHBondContact O-CB 3.36Å; N888-D892 PolarHBondContact O-N 2.77Å; N889-D892 CarbonylContact O-C 3.57Å; N889-D892 WeakPolarHBondContact O-CB 3.33Å; N889-D892 PolarHBondContact O-N 3.43Å; N889-D892 VanDerWaalsContact O-N 3.12Å; D892-R895 CarbonylContact O-C 3.58Å; D892-R895 PolarHBondContact O-N 3.41Å; D892-R895 VanDerWaalsContact O-N 3.15Å; D892-R895 IonicContact OD1-CZ 2.68Å; D892-R895 IonicContact OD1-NH1 3.88Å; D892-R895 PolarHBondContact OD1-NH1 3.31Å; D892-R895 IonicContact OD1-NH2 2.77Å; D892-R895 PolarHBondContact OD1-NH2 2.85Å; D892-V896 WeakPolarHBondContact O-CG2 3.38Å; D892-V896 PolarHBondContact O-N 3.15Å
893	E	95.2	Very high	95.3	Very high	90 Å²	90	89.6 Å²	89.6	42%	0.421	42%	0.422	S	S	.	.	H	α-helix	trans	-58.5	-46.8	172.3	-74.5	-177.7	169.9	0	0	111.3	H483 N889 R895 V896 L897	H483-E893 IonicContact CE1-OE1 3.08Å; H483-E893 PolarHBondContact CE1-OE1 3.45Å; H483-E893 VanDerWaalsContact CE1-OE1 3.27Å; N889-E893 WeakPolarHBondContact O-CB 3.47Å; N889-E893 WeakPolarHBondContact O-CG 3.43Å; N889-E893 PolarHBondContact O-N 2.78Å; E893-R895 VanDerWaalsContact C-N 3.33Å; E893-R895 PolarHBondContact O-N 3.41Å; E893-V896 CarbonylContact O-C 3.57Å; E893-V896 WeakPolarHBondContact O-CA 2.96Å; E893-V896 WeakPolarHBondContact O-CB 3.43Å; E893-V896 PolarHBondContact O-N 3.21Å; E893-L897 WeakPolarHBondContact O-CG 3.38Å; E893-L897 PolarHBondContact O-N 2.85Å
894	R	94.1	Very high	95.2	Very high	156 Å²	156	88 Å²	88	59%	0.589	42%	0.419	S	S	*	.	H	α-helix	trans	-60.4	-42.1	173.6	-168.5	-160.5	141.2	179.1	-3.8	111.2	I890 V896 L897 D898	I890-R894 WeakPolarHBondContact O-CB 3.27Å; I890-R894 PolarHBondContact O-N 3.12Å; R894-V896 PolarHBondContact O-N 3.41Å; R894-L897 PolarHBondContact O-N 3.05Å; R894-D898 IonicContact CZ-OD2 2.66Å; R894-D898 IonicContact NE-OD1 2.77Å; R894-D898 IonicContact NE-OD2 3.66Å; R894-D898 PolarHBondContact NE-OD2 3.01Å; R894-D898 IonicContact NH2-OD2 3.9Å; R894-D898 PolarHBondContact NH2-OD2 3.28Å; R894-D898 WeakPolarHBondContact O-CB 3.5Å; R894-D898 PolarHBondContact O-N 3.47Å
895	R	94.9	Very high	95	Very high	105 Å²	105	87.9 Å²	87.9	40%	0.396	42%	0.421	S	S	.	.	H	α-helix	trans	-66.3	-23.2	174.1	-82.1	175.4	-81.5	122.6	1.8	112.8	E891 D892 E893 R899	E891-R895 VanDerWaalsContact C-NH2 3.32Å; E891-R895 VanDerWaalsContact O-CB 3.29Å; E891-R895 WeakPolarHBondContact O-CB 3.46Å; E891-R895 VanDerWaalsContact O-CG 3.28Å; E891-R895 WeakPolarHBondContact O-CG 3.29Å; E891-R895 PolarHBondContact O-N 2.66Å; E891-R895 PolarHBondContact O-NE 2.85Å; E891-R895 PolarHBondContact O-NH2 2.86Å; D892-R895 CarbonylContact O-C 3.58Å; D892-R895 PolarHBondContact O-N 3.41Å; D892-R895 VanDerWaalsContact O-N 3.15Å; D892-R895 IonicContact OD1-CZ 2.68Å; D892-R895 IonicContact OD1-NH1 3.88Å; D892-R895 PolarHBondContact OD1-NH1 3.31Å; D892-R895 IonicContact OD1-NH2 2.77Å; D892-R895 PolarHBondContact OD1-NH2 2.85Å; E893-R895 VanDerWaalsContact C-N 3.33Å; E893-R895 PolarHBondContact O-N 3.41Å; R895-R899 WeakPolarHBondContact O-CD 3.46Å; R895-R899 WeakPolarHBondContact O-CG 3.38Å; R895-R899 PolarHBondContact O-N 3.47Å; R895-R899 PolarHBondContact O-NH1 3.15Å
896	V	94.6	Very high	95	Very high	70 Å²	70	90.9 Å²	90.9	42%	0.424	43%	0.427	S	S	.	.	H	α-helix	trans	-74.8	-47.2	168.2	172.8	0	0	0	0	110.3	D892 E893 R894 R899 T900	D892-V896 WeakPolarHBondContact O-CG2 3.38Å; D892-V896 PolarHBondContact O-N 3.15Å; E893-V896 CarbonylContact O-C 3.57Å; E893-V896 WeakPolarHBondContact O-CA 2.96Å; E893-V896 WeakPolarHBondContact O-CB 3.43Å; E893-V896 PolarHBondContact O-N 3.21Å; R894-V896 PolarHBondContact O-N 3.41Å; V896-R899 PolarHBondContact O-N 3.46Å; V896-T900 WeakPolarHBondContact O-CG2 3.34Å; V896-T900 PolarHBondContact O-N 3.03Å
897	L	93.6	Very high	94.9	Very high	109 Å²	109	89.1 Å²	89.1	57%	0.571	42%	0.418	S	S	*	.	H	α-helix	trans	-58.3	-49.9	176.8	-71.1	170.6	0	0	0	112	E893 R894 R899 T900 V901	E893-L897 WeakPolarHBondContact O-CG 3.38Å; E893-L897 PolarHBondContact O-N 2.85Å; R894-L897 PolarHBondContact O-N 3.05Å; L897-R899 VanDerWaalsContact C-N 3.3Å; L897-R899 PolarHBondContact O-N 2.79Å; L897-T900 WeakPolarHBondContact CA-OG1 3.22Å; L897-T900 CarbonylContact O-C 3.54Å; L897-T900 WeakPolarHBondContact O-CA 3.32Å; L897-T900 PolarHBondContact O-N 2.89Å; L897-T900 PolarHBondContact O-OG1 3.16Å; L897-V901 WeakPolarHBondContact O-CG2 3.38Å; L897-V901 PolarHBondContact O-N 2.89Å
898	D	95.5	Very high	94.8	Very high	59 Å²	59	89.7 Å²	89.7	32%	0.316	42%	0.423	S	S	.	.	H	α-helix	trans	-55.5	-43.7	177.2	-72.6	-17.9	0	0	0	110.4	R894 T900 V901 E902	R894-D898 IonicContact CZ-OD2 2.66Å; R894-D898 IonicContact NE-OD1 2.77Å; R894-D898 IonicContact NE-OD2 3.66Å; R894-D898 PolarHBondContact NE-OD2 3.01Å; R894-D898 IonicContact NH2-OD2 3.9Å; R894-D898 PolarHBondContact NH2-OD2 3.28Å; R894-D898 WeakPolarHBondContact O-CB 3.5Å; R894-D898 PolarHBondContact O-N 3.47Å; D898-T900 PolarHBondContact O-N 2.82Å; D898-V901 PolarHBondContact O-N 3.26Å; D898-E902 WeakPolarHBondContact O-CG 3.36Å; D898-E902 PolarHBondContact O-N 3.24Å
899	R	96.7	Very high	94.7	Very high	131 Å²	131	90.1 Å²	90.1	49%	0.494	43%	0.43	S	S	.	.	H	α-helix	trans	-65.6	-33.8	173.6	-70.7	176.2	-159	115.3	-16	114	R895 V896 L897 K903	R895-R899 WeakPolarHBondContact O-CD 3.46Å; R895-R899 WeakPolarHBondContact O-CG 3.38Å; R895-R899 PolarHBondContact O-N 3.47Å; R895-R899 PolarHBondContact O-NH1 3.15Å; V896-R899 PolarHBondContact O-N 3.46Å; L897-R899 VanDerWaalsContact C-N 3.3Å; L897-R899 PolarHBondContact O-N 2.79Å; R899-K903 WeakPolarHBondContact O-CB 3.44Å; R899-K903 PolarHBondContact O-N 2.96Å
900	T	94.1	Very high	94.6	Very high	65 Å²	65	92.9 Å²	92.9	40%	0.399	45%	0.445	S	S	.	.	H	α-helix	trans	-71.9	-35.7	173.8	61.1	0	0	0	0	111.8	V896 L897 D898 K903 L904	V896-T900 WeakPolarHBondContact O-CG2 3.34Å; V896-T900 PolarHBondContact O-N 3.03Å; L897-T900 WeakPolarHBondContact CA-OG1 3.22Å; L897-T900 CarbonylContact O-C 3.54Å; L897-T900 WeakPolarHBondContact O-CA 3.32Å; L897-T900 PolarHBondContact O-N 2.89Å; L897-T900 PolarHBondContact O-OG1 3.16Å; D898-T900 PolarHBondContact O-N 2.82Å; T900-K903 PolarHBondContact O-N 2.83Å; T900-L904 WeakPolarHBondContact O-CG 3.47Å; T900-L904 PolarHBondContact O-N 3.1Å
901	V	93.8	Very high	94.6	Very high	68 Å²	68	93.8 Å²	93.8	41%	0.412	45%	0.45	S	S	.	.	H	α-helix	trans	-65.8	-45.2	172.8	172	0	0	0	0	110.2	L897 D898 K903 L904 Q905	L897-V901 WeakPolarHBondContact O-CG2 3.38Å; L897-V901 PolarHBondContact O-N 2.89Å; D898-V901 PolarHBondContact O-N 3.26Å; V901-K903 VanDerWaalsContact C-N 3.26Å; V901-K903 PolarHBondContact O-N 2.79Å; V901-L904 PolarHBondContact O-N 2.85Å; V901-Q905 HydrophobicContact CG1-CG 4.29Å; V901-Q905 VanDerWaalsContact O-CB 3.31Å; V901-Q905 WeakPolarHBondContact O-CB 3.23Å; V901-Q905 VanDerWaalsContact O-CG 3.25Å; V901-Q905 WeakPolarHBondContact O-CG 3.4Å; V901-Q905 PolarHBondContact O-N 3.02Å
902	E	95.3	Very high	94.5	Very high	99 Å²	99	93.1 Å²	93.1	46%	0.463	45%	0.451	S	S	.	.	H	α-helix	trans	-58	-37.2	171.4	-73.3	174.1	-172.3	0	0	112.6	D898 R906	D898-E902 WeakPolarHBondContact O-CG 3.36Å; D898-E902 PolarHBondContact O-N 3.24Å; E902-R906 WeakPolarHBondContact O-CB 3.29Å; E902-R906 WeakPolarHBondContact O-CG 3.28Å; E902-R906 PolarHBondContact O-N 3.21Å; E902-R906 PolarHBondContact O-NE 2.89Å; E902-R906 IonicContact OE2-NH2 2.97Å
903	K	95.6	Very high	94.5	Very high	106 Å²	106	98.5 Å²	98.5	46%	0.461	48%	0.476	S	S	.	.	H	α-helix	trans	-68	-45.8	177.1	-174.9	173.4	-179.9	-72.4	0	111.4	R899 T900 V901 Q905 R906 E907	R899-K903 WeakPolarHBondContact O-CB 3.44Å; R899-K903 PolarHBondContact O-N 2.96Å; T900-K903 PolarHBondContact O-N 2.83Å; V901-K903 VanDerWaalsContact C-N 3.26Å; V901-K903 PolarHBondContact O-N 2.79Å; K903-Q905 VanDerWaalsContact C-N 3.33Å; K903-Q905 PolarHBondContact O-N 3.21Å; K903-R906 PolarHBondContact O-N 2.95Å; K903-E907 WeakPolarHBondContact CE-OE1 3.5Å; K903-E907 IonicContact NZ-OE1 3.28Å; K903-E907 PolarHBondContact NZ-OE1 2.94Å; K903-E907 IonicContact NZ-OE2 2.94Å; K903-E907 WeakPolarHBondContact O-CB 3.34Å; K903-E907 WeakPolarHBondContact O-CG 3.39Å; K903-E907 PolarHBondContact O-N 3.47Å
904	L	93.8	Very high	94.4	Very high	109 Å²	109	96.9 Å²	96.9	57%	0.571	48%	0.478	S	S	*	.	H	α-helix	trans	-66.6	-32.7	175	-69.2	169.7	0	0	0	112.4	T900 V901 M908	T900-L904 WeakPolarHBondContact O-CG 3.47Å; T900-L904 PolarHBondContact O-N 3.1Å; V901-L904 PolarHBondContact O-N 2.85Å; L904-M908 WeakPolarHBondContact O-CB 3.36Å; L904-M908 PolarHBondContact O-N 3.22Å
905	Q	93.4	Very high	94.2	Very high	117 Å²	117	93 Å²	93	55%	0.547	47%	0.474	S	S	.	.	H	α-helix	trans	-69.7	-39.5	173.4	-77.5	175	-5.8	0	0	112	V901 K903 S909	V901-Q905 HydrophobicContact CG1-CG 4.29Å; V901-Q905 VanDerWaalsContact O-CB 3.31Å; V901-Q905 WeakPolarHBondContact O-CB 3.23Å; V901-Q905 VanDerWaalsContact O-CG 3.25Å; V901-Q905 WeakPolarHBondContact O-CG 3.4Å; V901-Q905 PolarHBondContact O-N 3.02Å; K903-Q905 VanDerWaalsContact C-N 3.33Å; K903-Q905 PolarHBondContact O-N 3.21Å; Q905-S909 WeakPolarHBondContact O-CB 3.43Å; Q905-S909 PolarHBondContact O-N 3.34Å; Q905-S909 PolarHBondContact O-OG 2.92Å
906	R	94.9	Very high	94.1	Very high	129 Å²	129	92 Å²	92	49%	0.487	47%	0.474	S	S	.	.	H	α-helix	trans	-63.6	-52	170.9	-82.1	176.9	-86.2	105.5	-3.7	110.9	E902 K903 M908 S909 D910	E902-R906 WeakPolarHBondContact O-CB 3.29Å; E902-R906 WeakPolarHBondContact O-CG 3.28Å; E902-R906 PolarHBondContact O-N 3.21Å; E902-R906 PolarHBondContact O-NE 2.89Å; E902-R906 IonicContact OE2-NH2 2.97Å; K903-R906 PolarHBondContact O-N 2.95Å; R906-M908 VanDerWaalsContact C-N 3.3Å; R906-M908 PolarHBondContact O-N 3.08Å; R906-S909 CarbonylContact O-C 3.57Å; R906-S909 WeakPolarHBondContact O-CA 3.46Å; R906-S909 WeakPolarHBondContact O-CB 3.3Å; R906-S909 PolarHBondContact O-N 3.1Å; R906-D910 PolarHBondContact O-N 3.46Å
907	E	94.8	Very high	93.9	Very high	72 Å²	72	90.8 Å²	90.8	34%	0.336	47%	0.469	S	S	.	.	H	α-helix	trans	-58.1	-39.3	177	-73	166.2	-176.7	0	0	112.8	K903 I911	K903-E907 WeakPolarHBondContact CE-OE1 3.5Å; K903-E907 IonicContact NZ-OE1 3.28Å; K903-E907 PolarHBondContact NZ-OE1 2.94Å; K903-E907 IonicContact NZ-OE2 2.94Å; K903-E907 WeakPolarHBondContact O-CB 3.34Å; K903-E907 WeakPolarHBondContact O-CG 3.39Å; K903-E907 PolarHBondContact O-N 3.47Å; E907-I911 WeakPolarHBondContact O-CB 3.28Å; E907-I911 WeakPolarHBondContact O-CD1 3.38Å; E907-I911 WeakPolarHBondContact O-CG1 3.5Å; E907-I911 PolarHBondContact O-N 3.27Å
908	M	92.3	Very high	93.8	Very high	122 Å²	122	88.9 Å²	88.9	60%	0.601	46%	0.464	S	S	*	.	H	α-helix	trans	-64.9	-40.2	171.8	-178.4	67	72.6	0	0	112.1	L904 R906 I911 V912	L904-M908 WeakPolarHBondContact O-CB 3.36Å; L904-M908 PolarHBondContact O-N 3.22Å; R906-M908 VanDerWaalsContact C-N 3.3Å; R906-M908 PolarHBondContact O-N 3.08Å; M908-I911 PolarHBondContact O-N 3.19Å; M908-V912 WeakPolarHBondContact O-CB 3.43Å; M908-V912 VanDerWaalsContact O-CG2 3.25Å; M908-V912 WeakPolarHBondContact O-CG2 3.47Å; M908-V912 PolarHBondContact O-N 3.2Å; M908-V912 HydrophobicContact SD-CG2 4.49Å
909	S	94.1	Very high	93.5	Very high	60 Å²	60	90.1 Å²	90.1	42%	0.42	48%	0.475	S	S	.	.	H	α-helix	trans	-66.5	-45.1	177.1	-56.8	0	0	0	0	110.9	Q905 R906 I911 V912 E913	Q905-S909 WeakPolarHBondContact O-CB 3.43Å; Q905-S909 PolarHBondContact O-N 3.34Å; Q905-S909 PolarHBondContact O-OG 2.92Å; R906-S909 CarbonylContact O-C 3.57Å; R906-S909 WeakPolarHBondContact O-CA 3.46Å; R906-S909 WeakPolarHBondContact O-CB 3.3Å; R906-S909 PolarHBondContact O-N 3.1Å; S909-I911 VanDerWaalsContact C-N 3.33Å; S909-I911 PolarHBondContact O-N 3.47Å; S909-V912 CarbonylContact O-C 3.52Å; S909-V912 PolarHBondContact O-N 3.06Å; S909-V912 VanDerWaalsContact O-N 3.14Å; S909-E913 WeakPolarHBondContact O-CB 3.29Å; S909-E913 WeakPolarHBondContact O-CG 3.46Å; S909-E913 PolarHBondContact O-N 2.78Å
910	D	95.1	Very high	93.3	Very high	98 Å²	98	90.8 Å²	90.8	52%	0.524	48%	0.477	S	S	.	.	H	α-helix	trans	-59.7	-42.4	175.9	-57.2	-28	0	0	0	111	R906 E913 A914	R906-D910 PolarHBondContact O-N 3.46Å; D910-E913 PolarHBondContact O-N 2.9Å; D910-A914 VanDerWaalsContact O-CB 3.26Å; D910-A914 WeakPolarHBondContact O-CB 3.34Å; D910-A914 PolarHBondContact O-N 3.23Å
911	I	94.3	Very high	93.2	Very high	113 Å²	113	92.5 Å²	92.5	58%	0.579	48%	0.481	S	S	*	.	H	α-helix	trans	-65.9	-41	174.6	-71.9	164.9	0	0	0	111.4	E907 M908 S909 S915	E907-I911 WeakPolarHBondContact O-CB 3.28Å; E907-I911 WeakPolarHBondContact O-CD1 3.38Å; E907-I911 WeakPolarHBondContact O-CG1 3.5Å; E907-I911 PolarHBondContact O-N 3.27Å; M908-I911 PolarHBondContact O-N 3.19Å; S909-I911 VanDerWaalsContact C-N 3.33Å; S909-I911 PolarHBondContact O-N 3.47Å; I911-S915 WeakPolarHBondContact O-CB 3.42Å; I911-S915 PolarHBondContact O-N 3.44Å
912	V	94.1	Very high	93.1	Very high	64 Å²	64	94 Å²	94	39%	0.388	49%	0.485	S	S	.	.	H	α-helix	trans	-68	-40.1	176.7	166.2	0	0	0	0	111.1	M908 S909 S915 Q916	M908-V912 WeakPolarHBondContact O-CB 3.43Å; M908-V912 VanDerWaalsContact O-CG2 3.25Å; M908-V912 WeakPolarHBondContact O-CG2 3.47Å; M908-V912 PolarHBondContact O-N 3.2Å; M908-V912 HydrophobicContact SD-CG2 4.49Å; S909-V912 CarbonylContact O-C 3.52Å; S909-V912 PolarHBondContact O-N 3.06Å; S909-V912 VanDerWaalsContact O-N 3.14Å; V912-S915 PolarHBondContact O-N 3.4Å; V912-Q916 HydrophobicContact CG1-CG 4.4Å; V912-Q916 VanDerWaalsContact CG1-NE2 3.3Å; V912-Q916 WeakPolarHBondContact O-CB 3.47Å; V912-Q916 VanDerWaalsContact O-CG 3.23Å; V912-Q916 WeakPolarHBondContact O-CG 3.22Å; V912-Q916 PolarHBondContact O-N 2.85Å
913	E	94.5	Very high	92.9	Very high	127 Å²	127	93.5 Å²	93.5	59%	0.593	48%	0.483	S	S	*	.	H	α-helix	trans	-67.1	-43.2	175.7	-75.4	-170.1	-167.2	0	0	111.7	S909 D910 S915 Q916 S917	S909-E913 WeakPolarHBondContact O-CB 3.29Å; S909-E913 WeakPolarHBondContact O-CG 3.46Å; S909-E913 PolarHBondContact O-N 2.78Å; D910-E913 PolarHBondContact O-N 2.9Å; E913-S915 PolarHBondContact O-N 2.9Å; E913-Q916 CarbonylContact O-C 3.5Å; E913-Q916 PolarHBondContact O-N 3.47Å; E913-S917 WeakPolarHBondContact O-CB 3.26Å; E913-S917 PolarHBondContact O-N 2.87Å; E913-S917 PolarHBondContact O-OG 3.23Å
914	A	92.8	Very high	92.8	Very high	56 Å²	56	94.6 Å²	94.6	46%	0.463	49%	0.49	S	S	.	.	H	α-helix	trans	-64.2	-38	174	0	0	0	0	0	112.8	D910 S917 S918	D910-A914 VanDerWaalsContact O-CB 3.26Å; D910-A914 WeakPolarHBondContact O-CB 3.34Å; D910-A914 PolarHBondContact O-N 3.23Å; A914-S917 WeakPolarHBondContact CA-OG 3.41Å; A914-S917 PolarHBondContact O-OG 3.37Å; A914-S917 VanDerWaalsContact O-OG 3.06Å; A914-S918 VanDerWaalsContact O-CB 3.3Å; A914-S918 WeakPolarHBondContact O-CB 3.39Å; A914-S918 PolarHBondContact O-N 2.8Å
915	S	89.1	Confident	92.7	Very high	73 Å²	73	95.3 Å²	95.3	51%	0.51	49%	0.491	S	S	.	.	H	α-helix	trans	-67.4	-42.6	173.9	-177.7	0	0	0	0	111.5	I911 V912 E913 T919	I911-S915 WeakPolarHBondContact O-CB 3.42Å; I911-S915 PolarHBondContact O-N 3.44Å; V912-S915 PolarHBondContact O-N 3.4Å; E913-S915 PolarHBondContact O-N 2.9Å; S915-T919 VanDerWaalsContact O-CB 3.32Å; S915-T919 WeakPolarHBondContact O-CB 3.48Å; S915-T919 PolarHBondContact O-N 3.15Å; S915-T919 PolarHBondContact O-OG1 2.74Å
916	Q	92.9	Very high	92.6	Very high	84 Å²	84	93 Å²	93	39%	0.393	48%	0.481	S	S	.	.	H	α-helix	trans	-68.1	-37.4	174.9	-73.1	179.9	30.1	0	0	112.5	V912 E913 T919 R920	V912-Q916 HydrophobicContact CG1-CG 4.4Å; V912-Q916 VanDerWaalsContact CG1-NE2 3.3Å; V912-Q916 WeakPolarHBondContact O-CB 3.47Å; V912-Q916 VanDerWaalsContact O-CG 3.23Å; V912-Q916 WeakPolarHBondContact O-CG 3.22Å; V912-Q916 PolarHBondContact O-N 2.85Å; E913-Q916 CarbonylContact O-C 3.5Å; E913-Q916 PolarHBondContact O-N 3.47Å; Q916-T919 PolarHBondContact O-N 2.8Å; Q916-R920 WeakPolarHBondContact O-CB 3.27Å; Q916-R920 VanDerWaalsContact O-CG 3.25Å; Q916-R920 WeakPolarHBondContact O-CG 3.14Å; Q916-R920 PolarHBondContact O-N 3.17Å
917	S	90.9	Very high	92.4	Very high	45 Å²	45	90.1 Å²	90.1	32%	0.315	48%	0.475	S	S	.	.	H	α-helix	trans	-67.6	-47	176.8	71.3	0	0	0	0	110.3	E913 A914 T919 R920 E921	E913-S917 WeakPolarHBondContact O-CB 3.26Å; E913-S917 PolarHBondContact O-N 2.87Å; E913-S917 PolarHBondContact O-OG 3.23Å; A914-S917 WeakPolarHBondContact CA-OG 3.41Å; A914-S917 PolarHBondContact O-OG 3.37Å; A914-S917 VanDerWaalsContact O-OG 3.06Å; S917-T919 VanDerWaalsContact C-N 3.26Å; S917-T919 PolarHBondContact O-N 2.87Å; S917-R920 CarbonylContact O-C 3.44Å; S917-R920 WeakPolarHBondContact O-CA 3.27Å; S917-R920 WeakPolarHBondContact O-CB 3.3Å; S917-R920 PolarHBondContact O-N 2.78Å; S917-E921 WeakPolarHBondContact O-CG 3.36Å; S917-E921 PolarHBondContact O-N 3.36Å
918	S	91.2	Very high	92.3	Very high	69 Å²	69	91.9 Å²	91.9	48%	0.483	49%	0.486	S	S	.	.	H	α-helix	trans	-59.7	-36.3	173.5	-172.4	0	0	0	0	112.3	A914 L922	A914-S918 VanDerWaalsContact O-CB 3.3Å; A914-S918 WeakPolarHBondContact O-CB 3.39Å; A914-S918 PolarHBondContact O-N 2.8Å; S918-L922 WeakPolarHBondContact O-CB 3.35Å; S918-L922 PolarHBondContact O-N 3.39Å
919	T	90.6	Very high	92.3	Very high	86 Å²	86	92.9 Å²	92.9	53%	0.528	48%	0.484	S	S	.	.	H	α-helix	trans	-68.7	-37.3	173.2	-56.9	0	0	0	0	112.3	S915 Q916 S917 Q923	S915-T919 VanDerWaalsContact O-CB 3.32Å; S915-T919 WeakPolarHBondContact O-CB 3.48Å; S915-T919 PolarHBondContact O-N 3.15Å; S915-T919 PolarHBondContact O-OG1 2.74Å; Q916-T919 PolarHBondContact O-N 2.8Å; S917-T919 VanDerWaalsContact C-N 3.26Å; S917-T919 PolarHBondContact O-N 2.87Å; T919-Q923 WeakPolarHBondContact O-CB 3.45Å; T919-Q923 PolarHBondContact O-N 3.3Å
920	R	91.4	Very high	92.2	Very high	145 Å²	145	94.6 Å²	94.6	55%	0.547	48%	0.484	S	S	.	.	H	α-helix	trans	-67.9	-43.3	173.7	-73.9	171.2	-169.4	114	7.1	111.5	Q916 S917 L922 Q923 E924	Q916-R920 WeakPolarHBondContact O-CB 3.27Å; Q916-R920 VanDerWaalsContact O-CG 3.25Å; Q916-R920 WeakPolarHBondContact O-CG 3.14Å; Q916-R920 PolarHBondContact O-N 3.17Å; S917-R920 CarbonylContact O-C 3.44Å; S917-R920 WeakPolarHBondContact O-CA 3.27Å; S917-R920 WeakPolarHBondContact O-CB 3.3Å; S917-R920 PolarHBondContact O-N 2.78Å; R920-L922 VanDerWaalsContact C-N 3.33Å; R920-L922 PolarHBondContact O-N 3.43Å; R920-Q923 CarbonylContact O-C 3.57Å; R920-Q923 WeakPolarHBondContact O-CB 3.38Å; R920-Q923 PolarHBondContact O-N 2.83Å; R920-Q923 VanDerWaalsContact O-N 3.17Å; R920-E924 PolarHBondContact O-N 2.83Å
921	E	92.3	Very high	92	Very high	101 Å²	101	93.6 Å²	93.6	47%	0.472	48%	0.476	S	S	.	.	H	α-helix	trans	-59.9	-42.9	174	-71.5	162.8	-153.3	0	0	111.1	S917 E924 Q925	S917-E921 WeakPolarHBondContact O-CG 3.36Å; S917-E921 PolarHBondContact O-N 3.36Å; E921-E924 PolarHBondContact O-N 2.97Å; E921-Q925 WeakPolarHBondContact O-CB 3.42Å; E921-Q925 VanDerWaalsContact O-CG 3.29Å; E921-Q925 WeakPolarHBondContact O-CG 3.46Å; E921-Q925 PolarHBondContact O-N 2.95Å
922	L	91.6	Very high	91.9	Very high	98 Å²	98	93.1 Å²	93.1	51%	0.513	47%	0.47	S	S	.	.	H	α-helix	trans	-65.7	-39.4	174.4	-174.7	64.8	0	0	0	111.7	S918 R920 Q925 I926	S918-L922 WeakPolarHBondContact O-CB 3.35Å; S918-L922 PolarHBondContact O-N 3.39Å; R920-L922 VanDerWaalsContact C-N 3.33Å; R920-L922 PolarHBondContact O-N 3.43Å; L922-Q925 PolarHBondContact O-N 2.8Å; L922-I926 HydrophobicContact CG-CD1 4.06Å; L922-I926 WeakPolarHBondContact O-CB 3.41Å; L922-I926 WeakPolarHBondContact O-CD1 3.49Å; L922-I926 WeakPolarHBondContact O-CG1 3.4Å; L922-I926 PolarHBondContact O-N 2.8Å
923	Q	91.9	Very high	91.8	Very high	89 Å²	89	92.8 Å²	92.8	42%	0.416	47%	0.466	S	S	.	.	H	α-helix	trans	-64.8	-42.2	174.6	-179	63.2	42.5	0	0	111.8	T919 R920 I926 D927	T919-Q923 WeakPolarHBondContact O-CB 3.45Å; T919-Q923 PolarHBondContact O-N 3.3Å; R920-Q923 CarbonylContact O-C 3.57Å; R920-Q923 WeakPolarHBondContact O-CB 3.38Å; R920-Q923 PolarHBondContact O-N 2.83Å; R920-Q923 VanDerWaalsContact O-N 3.17Å; Q923-I926 WeakPolarHBondContact O-CB 3.44Å; Q923-I926 PolarHBondContact O-N 2.95Å; Q923-D927 VanDerWaalsContact NE2-CG 3.31Å; Q923-D927 PolarHBondContact NE2-OD1 3.03Å; Q923-D927 PolarHBondContact NE2-OD2 2.94Å; Q923-D927 WeakPolarHBondContact O-CB 3.08Å; Q923-D927 PolarHBondContact O-N 2.83Å
924	E	92.4	Very high	91.7	Very high	130 Å²	130	94.8 Å²	94.8	61%	0.607	47%	0.468	S	S	*	.	H	α-helix	trans	-63.5	-43.6	173	-76.3	-168.8	154.3	0	0	111.3	R920 E921 I926 D927 I928	R920-E924 PolarHBondContact O-N 2.83Å; E921-E924 PolarHBondContact O-N 2.97Å; E924-I926 VanDerWaalsContact C-N 3.31Å; E924-I926 PolarHBondContact O-N 2.88Å; E924-D927 PolarHBondContact O-N 3.18Å; E924-I928 VanDerWaalsContact O-CB 3.25Å; E924-I928 WeakPolarHBondContact O-CB 3.35Å; E924-I928 WeakPolarHBondContact O-CD1 3.37Å; E924-I928 WeakPolarHBondContact O-CG1 3.35Å; E924-I928 PolarHBondContact O-N 3.2Å
925	Q	92.2	Very high	91.6	Very high	124 Å²	124	97.5 Å²	97.5	58%	0.579	47%	0.466	S	S	*	.	H	α-helix	trans	-59.7	-41.8	173.4	-74.4	176.1	38.6	0	0	111.8	E921 L922 Y929	E921-Q925 WeakPolarHBondContact O-CB 3.42Å; E921-Q925 VanDerWaalsContact O-CG 3.29Å; E921-Q925 WeakPolarHBondContact O-CG 3.46Å; E921-Q925 PolarHBondContact O-N 2.95Å; L922-Q925 PolarHBondContact O-N 2.8Å; Q925-Y929 WeakPolarHBondContact O-CB 3.37Å; Q925-Y929 PolarHBondContact O-N 2.7Å
926	I	90.4	Very high	91.7	Very high	67 Å²	67	98 Å²	98	34%	0.344	46%	0.46	S	S	.	.	H	α-helix	trans	-63.7	-41.9	175.6	-76.5	167.1	0	0	0	111.3	L922 Q923 E924 Y929 K930	L922-I926 HydrophobicContact CG-CD1 4.06Å; L922-I926 WeakPolarHBondContact O-CB 3.41Å; L922-I926 WeakPolarHBondContact O-CD1 3.49Å; L922-I926 WeakPolarHBondContact O-CG1 3.4Å; L922-I926 PolarHBondContact O-N 2.8Å; Q923-I926 WeakPolarHBondContact O-CB 3.44Å; Q923-I926 PolarHBondContact O-N 2.95Å; E924-I926 VanDerWaalsContact C-N 3.31Å; E924-I926 PolarHBondContact O-N 2.88Å; I926-Y929 PolarHBondContact O-N 2.63Å; I926-K930 HydrophobicContact CG2-CD 4.35Å; I926-K930 VanDerWaalsContact O-CG 3.3Å; I926-K930 WeakPolarHBondContact O-CG 3.45Å; I926-K930 PolarHBondContact O-N 2.89Å
927	D	91.9	Very high	91.6	Very high	69 Å²	69	98.6 Å²	98.6	37%	0.369	47%	0.466	S	S	.	.	H	α-helix	trans	-78.5	-34.4	-178.9	-71.7	-26	0	0	0	112.5	Q923 E924 Y929 K930 E931	Q923-D927 VanDerWaalsContact NE2-CG 3.31Å; Q923-D927 PolarHBondContact NE2-OD1 3.03Å; Q923-D927 PolarHBondContact NE2-OD2 2.94Å; Q923-D927 WeakPolarHBondContact O-CB 3.08Å; Q923-D927 PolarHBondContact O-N 2.83Å; E924-D927 PolarHBondContact O-N 3.18Å; D927-Y929 VanDerWaalsContact C-N 3.3Å; D927-Y929 PolarHBondContact O-N 2.68Å; D927-K930 PolarHBondContact O-N 2.82Å; D927-K930 WeakPolarHBondContact OD1-CD 3.27Å; D927-K930 WeakPolarHBondContact OD1-CE 3.46Å; D927-K930 IonicContact OD1-NZ 3.73Å; D927-K930 PolarHBondContact OD1-NZ 2.91Å; D927-E931 WeakPolarHBondContact O-CB 3.47Å; D927-E931 PolarHBondContact O-N 3.41Å
928	I	93.1	Very high	91.6	Very high	109 Å²	109	98.7 Å²	98.7	56%	0.559	47%	0.47	S	S	*	.	H	α-helix	trans	-60.5	-40.6	166.6	-70.6	164.7	0	0	0	110.3	E924 E931 K932	E924-I928 VanDerWaalsContact O-CB 3.25Å; E924-I928 WeakPolarHBondContact O-CB 3.35Å; E924-I928 WeakPolarHBondContact O-CD1 3.37Å; E924-I928 WeakPolarHBondContact O-CG1 3.35Å; E924-I928 PolarHBondContact O-N 3.2Å; I928-E931 PolarHBondContact O-N 3.48Å; I928-K932 VanDerWaalsContact O-CB 3.24Å; I928-K932 WeakPolarHBondContact O-CB 3.47Å; I928-K932 PolarHBondContact O-N 3Å
929	Y	91.1	Very high	91.6	Very high	144 Å²	144	99.4 Å²	99.4	57%	0.565	47%	0.465	S	S	*	.	H	α-helix	trans	-67.4	-46.1	175.4	175	-105.7	0	0	0	112.2	Q925 I926 D927 E931 K932 N933	Q925-Y929 WeakPolarHBondContact O-CB 3.37Å; Q925-Y929 PolarHBondContact O-N 2.7Å; I926-Y929 PolarHBondContact O-N 2.63Å; D927-Y929 VanDerWaalsContact C-N 3.3Å; D927-Y929 PolarHBondContact O-N 2.68Å; Y929-E931 VanDerWaalsContact C-N 3.29Å; Y929-E931 PolarHBondContact O-N 3.01Å; Y929-K932 PolarHBondContact O-N 3.4Å; Y929-N933 WeakPolarHBondContact CE1-ND2 3.37Å; Y929-N933 WeakPolarHBondContact O-CB 3.34Å; Y929-N933 PolarHBondContact O-N 3.38Å; Y929-N933 PolarHBondContact O-OD1 2.96Å; Y929-N933 PolarHBondContact OH-ND2 2.7Å
930	K	92.1	Very high	91.6	Very high	95 Å²	95	100.8 Å²	100.8	41%	0.413	47%	0.469	S	S	.	.	H	α-helix	trans	-58.5	-41.7	172.6	-72.4	169.6	-161.5	155.1	0	111.8	I926 D927 N933 R934	I926-K930 HydrophobicContact CG2-CD 4.35Å; I926-K930 VanDerWaalsContact O-CG 3.3Å; I926-K930 WeakPolarHBondContact O-CG 3.45Å; I926-K930 PolarHBondContact O-N 2.89Å; D927-K930 PolarHBondContact O-N 2.82Å; D927-K930 WeakPolarHBondContact OD1-CD 3.27Å; D927-K930 WeakPolarHBondContact OD1-CE 3.46Å; D927-K930 IonicContact OD1-NZ 3.73Å; D927-K930 PolarHBondContact OD1-NZ 2.91Å; K930-N933 PolarHBondContact O-N 2.78Å; K930-R934 WeakPolarHBondContact O-CG 3.07Å; K930-R934 PolarHBondContact O-N 3.31Å
931	E	92	Very high	91.6	Very high	77 Å²	77	99 Å²	99	36%	0.36	47%	0.467	S	S	.	.	H	α-helix	trans	-75.3	-32.4	-178	-174.4	45.7	-138.1	0	0	112	D927 I928 Y929 R934 R935	D927-E931 WeakPolarHBondContact O-CB 3.47Å; D927-E931 PolarHBondContact O-N 3.41Å; I928-E931 PolarHBondContact O-N 3.48Å; Y929-E931 VanDerWaalsContact C-N 3.29Å; Y929-E931 PolarHBondContact O-N 3.01Å; E931-R934 PolarHBondContact O-N 2.84Å; E931-R935 PolarHBondContact O-N 3.43Å; E931-R935 PolarHBondContact O-NE 3.42Å; E931-R935 IonicContact OE1-NE 3.82Å; E931-R935 PolarHBondContact OE1-NE 3.49Å
932	K	92.4	Very high	91.6	Very high	103 Å²	103	99.7 Å²	99.7	45%	0.448	47%	0.465	S	S	.	.	H	α-helix	trans	-62.1	-50.6	166.8	179.7	176.8	170.4	179.4	0	110.5	I928 Y929 R934 R935 E936	I928-K932 VanDerWaalsContact O-CB 3.24Å; I928-K932 WeakPolarHBondContact O-CB 3.47Å; I928-K932 PolarHBondContact O-N 3Å; Y929-K932 PolarHBondContact O-N 3.4Å; K932-R934 VanDerWaalsContact C-N 3.27Å; K932-R934 PolarHBondContact O-N 2.89Å; K932-R935 PolarHBondContact O-N 3.07Å; K932-R935 VanDerWaalsContact O-N 3.12Å; K932-E936 WeakPolarHBondContact CE-OE1 3.43Å; K932-E936 HydrophobicContact CG-CG 4.44Å; K932-E936 IonicContact NZ-OE1 2.66Å; K932-E936 WeakPolarHBondContact O-CG 3.26Å; K932-E936 PolarHBondContact O-N 2.79Å
933	N	90.5	Very high	91.5	Very high	58 Å²	58	99.8 Å²	99.8	31%	0.31	46%	0.462	S	S	.	.	H	α-helix	trans	-60.4	-34.6	176.5	-72.9	5.2	0	0	0	112.5	Y929 K930 L937	Y929-N933 WeakPolarHBondContact CE1-ND2 3.37Å; Y929-N933 WeakPolarHBondContact O-CB 3.34Å; Y929-N933 PolarHBondContact O-N 3.38Å; Y929-N933 PolarHBondContact O-OD1 2.96Å; Y929-N933 PolarHBondContact OH-ND2 2.7Å; K930-N933 PolarHBondContact O-N 2.78Å; N933-L937 WeakPolarHBondContact O-CB 3.21Å; N933-L937 PolarHBondContact O-N 2.77Å
934	R	91.9	Very high	91.3	Very high	168 Å²	168	101.8 Å²	101.8	63%	0.634	48%	0.475	S	S	*	.	H	α-helix	trans	-65.5	-45	172.6	-84.5	-174.7	174.7	136.8	-0.6	112.5	K930 E931 K932 L937 A938	K930-R934 WeakPolarHBondContact O-CG 3.07Å; K930-R934 PolarHBondContact O-N 3.31Å; E931-R934 PolarHBondContact O-N 2.84Å; K932-R934 VanDerWaalsContact C-N 3.27Å; K932-R934 PolarHBondContact O-N 2.89Å; R934-L937 PolarHBondContact O-N 2.74Å; R934-A938 WeakPolarHBondContact O-CB 3.47Å; R934-A938 PolarHBondContact O-N 2.83Å
935	R	91.8	Very high	91.2	Very high	114 Å²	114	102.4 Å²	102.4	43%	0.43	48%	0.476	S	S	.	.	H	α-helix	trans	-64.2	-46.8	176.8	-80.7	175.4	-80.8	115.8	-6.4	111.7	E931 K932 L937 A938 E939	E931-R935 PolarHBondContact O-N 3.43Å; E931-R935 PolarHBondContact O-NE 3.42Å; E931-R935 IonicContact OE1-NE 3.82Å; E931-R935 PolarHBondContact OE1-NE 3.49Å; K932-R935 PolarHBondContact O-N 3.07Å; K932-R935 VanDerWaalsContact O-N 3.12Å; R935-L937 VanDerWaalsContact C-N 3.35Å; R935-L937 PolarHBondContact O-N 3.41Å; R935-A938 PolarHBondContact O-N 3.12Å; R935-A938 VanDerWaalsContact O-N 3.16Å; R935-E939 WeakPolarHBondContact O-CB 3.3Å; R935-E939 VanDerWaalsContact O-CG 3.28Å; R935-E939 WeakPolarHBondContact O-CG 3.48Å; R935-E939 PolarHBondContact O-N 2.91Å
936	E	90.8	Very high	91.2	Very high	82 Å²	82	99.9 Å²	99.9	38%	0.383	46%	0.464	S	S	.	.	H	α-helix	trans	-61.3	-41.1	175.5	-70.3	176.7	174.1	0	0	111.7	K932 E939 L940	K932-E936 WeakPolarHBondContact CE-OE1 3.43Å; K932-E936 HydrophobicContact CG-CG 4.44Å; K932-E936 IonicContact NZ-OE1 2.66Å; K932-E936 WeakPolarHBondContact O-CG 3.26Å; K932-E936 PolarHBondContact O-N 2.79Å; E936-E939 PolarHBondContact O-N 2.82Å; E936-L940 WeakPolarHBondContact O-CB 3.48Å; E936-L940 VanDerWaalsContact O-CG 3.29Å; E936-L940 WeakPolarHBondContact O-CG 3.48Å; E936-L940 PolarHBondContact O-N 3.16Å
937	L	91.3	Very high	91.1	Very high	97 Å²	97	102.1 Å²	102.1	51%	0.508	47%	0.472	S	S	.	.	H	α-helix	trans	-64.4	-41.2	173.5	-179.9	62.3	0	0	0	112.4	N933 R934 R935 E939 L940 Q941	N933-L937 WeakPolarHBondContact O-CB 3.21Å; N933-L937 PolarHBondContact O-N 2.77Å; R934-L937 PolarHBondContact O-N 2.74Å; R935-L937 VanDerWaalsContact C-N 3.35Å; R935-L937 PolarHBondContact O-N 3.41Å; L937-E939 VanDerWaalsContact C-N 3.34Å; L937-L940 PolarHBondContact O-N 3.2Å; L937-Q941 WeakPolarHBondContact O-CB 3.32Å; L937-Q941 VanDerWaalsContact O-CG 3.28Å; L937-Q941 WeakPolarHBondContact O-CG 3.42Å; L937-Q941 PolarHBondContact O-N 3.18Å
938	A	90.2	Very high	91	Very high	48 Å²	48	100.6 Å²	100.6	40%	0.397	47%	0.472	S	S	.	.	H	α-helix	trans	-68.1	-34	176.7	0	0	0	0	0	112.2	R934 R935 R942	R934-A938 WeakPolarHBondContact O-CB 3.47Å; R934-A938 PolarHBondContact O-N 2.83Å; R935-A938 PolarHBondContact O-N 3.12Å; R935-A938 VanDerWaalsContact O-N 3.16Å; A938-R942 WeakPolarHBondContact O-CB 3.43Å; A938-R942 PolarHBondContact O-N 3.15Å
939	E	92.4	Very high	90.8	Very high	83 Å²	83	100.4 Å²	100.4	39%	0.388	47%	0.469	S	S	.	.	H	α-helix	trans	-68.5	-45.4	173.6	-76.3	162	-169.7	0	0	111.5	R935 E936 L937 Q941 R942 H943	R935-E939 WeakPolarHBondContact O-CB 3.3Å; R935-E939 VanDerWaalsContact O-CG 3.28Å; R935-E939 WeakPolarHBondContact O-CG 3.48Å; R935-E939 PolarHBondContact O-N 2.91Å; E936-E939 PolarHBondContact O-N 2.82Å; L937-E939 VanDerWaalsContact C-N 3.34Å; E939-Q941 PolarHBondContact O-N 2.85Å; E939-R942 VanDerWaalsContact CG-NH2 3.27Å; E939-R942 WeakPolarHBondContact O-CB 3.27Å; E939-R942 PolarHBondContact O-N 2.72Å; E939-R942 VanDerWaalsContact O-N 3.1Å; E939-H943 PolarHBondContact O-CD2 3.35Å; E939-H943 PolarHBondContact O-N 3.03Å
940	L	90.8	Very high	90.7	Very high	116 Å²	116	97.5 Å²	97.5	61%	0.607	46%	0.46	S	S	*	.	H	α-helix	trans	-62	-40.3	172.3	-71.6	170.3	0	0	0	112.1	E936 L937 R942 H943 L944	E936-L940 WeakPolarHBondContact O-CB 3.48Å; E936-L940 VanDerWaalsContact O-CG 3.29Å; E936-L940 WeakPolarHBondContact O-CG 3.48Å; E936-L940 PolarHBondContact O-N 3.16Å; L937-L940 PolarHBondContact O-N 3.2Å; L940-R942 VanDerWaalsContact C-N 3.31Å; L940-R942 PolarHBondContact O-N 2.91Å; L940-H943 PolarHBondContact O-N 2.81Å; L940-L944 WeakPolarHBondContact O-CB 3.42Å; L940-L944 PolarHBondContact O-N 3.21Å
941	Q	89.9	Confident	90.4	Very high	106 Å²	106	98.4 Å²	98.4	50%	0.495	47%	0.469	S	S	.	.	H	α-helix	trans	-65.5	-32.5	172.7	-75.9	-179.9	10.5	0	0	112.6	L937 E939 K945	L937-Q941 WeakPolarHBondContact O-CB 3.32Å; L937-Q941 VanDerWaalsContact O-CG 3.28Å; L937-Q941 WeakPolarHBondContact O-CG 3.42Å; L937-Q941 PolarHBondContact O-N 3.18Å; E939-Q941 PolarHBondContact O-N 2.85Å; Q941-K945 WeakPolarHBondContact O-CG 2.84Å; Q941-K945 PolarHBondContact O-N 2.88Å; Q941-K945 VanDerWaalsContact O-N 3.14Å
942	R	92	Very high	90.3	Very high	117 Å²	117	100.7 Å²	100.7	44%	0.442	48%	0.48	S	S	.	.	H	α-helix	trans	-67.3	-50.2	173.6	-156.5	-163.3	-54.4	110.9	3	110.4	A938 E939 L940 L944 K945 E946	A938-R942 WeakPolarHBondContact O-CB 3.43Å; A938-R942 PolarHBondContact O-N 3.15Å; E939-R942 VanDerWaalsContact CG-NH2 3.27Å; E939-R942 WeakPolarHBondContact O-CB 3.27Å; E939-R942 PolarHBondContact O-N 2.72Å; E939-R942 VanDerWaalsContact O-N 3.1Å; L940-R942 VanDerWaalsContact C-N 3.31Å; L940-R942 PolarHBondContact O-N 2.91Å; R942-L944 VanDerWaalsContact C-N 3.3Å; R942-L944 PolarHBondContact O-N 3.33Å; R942-K945 CarbonylContact O-C 3.42Å; R942-K945 WeakPolarHBondContact O-CB 3.29Å; R942-K945 PolarHBondContact O-N 2.61Å; R942-E946 WeakPolarHBondContact CD-OE1 3.23Å; R942-E946 VanDerWaalsContact CG-OE1 3.26Å; R942-E946 WeakPolarHBondContact CG-OE1 3.45Å; R942-E946 WeakPolarHBondContact O-CG 3.37Å; R942-E946 PolarHBondContact O-N 2.95Å
943	H	89.8	Confident	90.2	Very high	99 Å²	99	101.9 Å²	101.9	46%	0.458	49%	0.485	S	S	.	.	H	α-helix	trans	-60.6	-35.9	176.3	-70.4	-37.5	0	0	0	113	E939 L940 E946 K947	E939-H943 PolarHBondContact O-CD2 3.35Å; E939-H943 PolarHBondContact O-N 3.03Å; L940-H943 PolarHBondContact O-N 2.81Å; H943-E946 WeakPolarHBondContact CA-OE2 3.47Å; H943-E946 IonicContact CE1-OE2 2.72Å; H943-E946 IonicContact CG-OE2 2.68Å; H943-E946 IonicContact ND1-OE2 3.64Å; H943-E946 PolarHBondContact ND1-OE2 3.43Å; H943-E946 PolarHBondContact O-N 2.86Å; H943-K947 WeakPolarHBondContact O-CB 3.39Å; H943-K947 VanDerWaalsContact O-CG 3.28Å; H943-K947 WeakPolarHBondContact O-CG 3.44Å; H943-K947 PolarHBondContact O-N 3.36Å
944	L	88.6	Confident	90.1	Very high	131 Å²	131	104 Å²	104	69%	0.686	50%	0.496	S	S	*	.	H	α-helix	trans	-65.8	-39.3	173.9	-168	152.9	0	0	0	111.7	L940 R942 G948	L940-L944 WeakPolarHBondContact O-CB 3.42Å; L940-L944 PolarHBondContact O-N 3.21Å; R942-L944 VanDerWaalsContact C-N 3.3Å; R942-L944 PolarHBondContact O-N 3.33Å; L944-G948 PolarHBondContact O-N 3.14Å
945	K	90.7	Very high	90.1	Very high	143 Å²	143	100.8 Å²	100.8	62%	0.622	49%	0.494	S	S	*	.	H	α-helix	trans	-68	-41.5	173.3	-73	173	179.9	177.7	0	112.5	Q941 R942 G948 Q949	Q941-K945 WeakPolarHBondContact O-CG 2.84Å; Q941-K945 PolarHBondContact O-N 2.88Å; Q941-K945 VanDerWaalsContact O-N 3.14Å; R942-K945 CarbonylContact O-C 3.42Å; R942-K945 WeakPolarHBondContact O-CB 3.29Å; R942-K945 PolarHBondContact O-N 2.61Å; K945-G948 PolarHBondContact O-N 2.69Å; K945-Q949 WeakPolarHBondContact O-CG 3.35Å; K945-Q949 PolarHBondContact O-N 2.67Å
946	E	91.8	Very high	90.1	Very high	71 Å²	71	99.9 Å²	99.9	33%	0.332	50%	0.497	S	S	.	.	H	α-helix	trans	-59.7	-47.4	174.8	-70.6	159.2	-169.8	0	0	110.7	R942 H943 G948 Q949 E950	R942-E946 WeakPolarHBondContact CD-OE1 3.23Å; R942-E946 VanDerWaalsContact CG-OE1 3.26Å; R942-E946 WeakPolarHBondContact CG-OE1 3.45Å; R942-E946 WeakPolarHBondContact O-CG 3.37Å; R942-E946 PolarHBondContact O-N 2.95Å; H943-E946 WeakPolarHBondContact CA-OE2 3.47Å; H943-E946 IonicContact CE1-OE2 2.72Å; H943-E946 IonicContact CG-OE2 2.68Å; H943-E946 IonicContact ND1-OE2 3.64Å; H943-E946 PolarHBondContact ND1-OE2 3.43Å; H943-E946 PolarHBondContact O-N 2.86Å; E946-G948 VanDerWaalsContact C-N 3.34Å; E946-G948 PolarHBondContact O-N 2.69Å; E946-Q949 PolarHBondContact O-N 2.64Å; E946-E950 WeakPolarHBondContact O-CG 3.04Å; E946-E950 PolarHBondContact O-N 3.05Å
947	K	88.8	Confident	89.8	Confident	115 Å²	115	99.5 Å²	99.5	50%	0.5	50%	0.501	S	S	.	.	H	α-helix	trans	-66.4	-33.5	174.8	-69.1	-73.6	167.5	-120.6	0	112.8	H943 E950 L951	H943-K947 WeakPolarHBondContact O-CB 3.39Å; H943-K947 VanDerWaalsContact O-CG 3.28Å; H943-K947 WeakPolarHBondContact O-CG 3.44Å; H943-K947 PolarHBondContact O-N 3.36Å; K947-E950 IonicContact NZ-OE1 3.84Å; K947-E950 PolarHBondContact NZ-OE1 2.76Å; K947-E950 IonicContact NZ-OE2 2.66Å; K947-E950 PolarHBondContact NZ-OE2 3.48Å; K947-E950 PolarHBondContact O-N 3.01Å; K947-L951 WeakPolarHBondContact O-CB 3.37Å; K947-L951 WeakPolarHBondContact O-CG 3.5Å; K947-L951 PolarHBondContact O-N 2.72Å
948	G	89	Confident	89.6	Confident	36 Å²	36	98.7 Å²	98.7	37%	0.371	50%	0.5	S	S	.	.	H	α-helix	trans	-60.5	-45.1	169.5	0	0	0	0	0	112.4	L944 K945 E946 L951 E952	L944-G948 PolarHBondContact O-N 3.14Å; K945-G948 PolarHBondContact O-N 2.69Å; E946-G948 VanDerWaalsContact C-N 3.34Å; E946-G948 PolarHBondContact O-N 2.69Å; G948-L951 PolarHBondContact O-N 2.88Å; G948-E952 WeakPolarHBondContact O-CB 3.2Å; G948-E952 PolarHBondContact O-N 3.31Å
949	Q	89.4	Confident	89.7	Confident	106 Å²	106	103.7 Å²	103.7	50%	0.495	51%	0.509	S	S	.	.	H	α-helix	trans	-69.7	-31.9	176	-70.6	176.2	-3.2	0	0	113.1	K945 E946 K953	K945-Q949 WeakPolarHBondContact O-CG 3.35Å; K945-Q949 PolarHBondContact O-N 2.67Å; E946-Q949 PolarHBondContact O-N 2.64Å; Q949-K953 WeakPolarHBondContact O-CB 3.38Å; Q949-K953 VanDerWaalsContact O-CD 3.31Å; Q949-K953 WeakPolarHBondContact O-CD 2.95Å; Q949-K953 WeakPolarHBondContact O-CG 3.23Å; Q949-K953 PolarHBondContact O-N 3.24Å
950	E	88.5	Confident	89.6	Confident	83 Å²	83	103.8 Å²	103.8	39%	0.388	51%	0.512	S	S	.	.	H	α-helix	trans	-65.1	-45.1	169.7	-74.2	172.6	-142.3	0	0	111.4	E946 K947 K953 L954	E946-E950 WeakPolarHBondContact O-CG 3.04Å; E946-E950 PolarHBondContact O-N 3.05Å; K947-E950 IonicContact NZ-OE1 3.84Å; K947-E950 PolarHBondContact NZ-OE1 2.76Å; K947-E950 IonicContact NZ-OE2 2.66Å; K947-E950 PolarHBondContact NZ-OE2 3.48Å; K947-E950 PolarHBondContact O-N 3.01Å; E950-K953 PolarHBondContact O-N 3.05Å; E950-L954 WeakPolarHBondContact O-CG 3.41Å; E950-L954 PolarHBondContact O-N 2.93Å
951	L	85.7	Confident	89.4	Confident	114 Å²	114	103.1 Å²	103.1	60%	0.597	51%	0.508	S	S	*	.	H	α-helix	trans	-63.5	-41.6	175.3	-73.6	168.7	0	0	0	112	K947 G948 K953 L954 V955	K947-L951 WeakPolarHBondContact O-CB 3.37Å; K947-L951 WeakPolarHBondContact O-CG 3.5Å; K947-L951 PolarHBondContact O-N 2.72Å; G948-L951 PolarHBondContact O-N 2.88Å; L951-K953 PolarHBondContact O-N 3.48Å; L951-L954 PolarHBondContact O-N 3.09Å; L951-V955 WeakPolarHBondContact O-CG2 3.31Å; L951-V955 PolarHBondContact O-N 3.18Å
952	E	89.8	Confident	89.3	Confident	124 Å²	124	104.5 Å²	104.5	58%	0.579	52%	0.515	S	S	*	.	H	α-helix	trans	-61.6	-43	175.7	-174.6	173.5	-149.1	0	0	111.7	G948 V955 L956	G948-E952 WeakPolarHBondContact O-CB 3.2Å; G948-E952 PolarHBondContact O-N 3.31Å; E952-V955 PolarHBondContact O-N 3.49Å; E952-L956 HydrophobicContact CG-CD1 4.41Å; E952-L956 WeakPolarHBondContact O-CG 3.32Å; E952-L956 PolarHBondContact O-N 3.05Å
953	K	91.5	Very high	89.3	Confident	129 Å²	129	103 Å²	103	56%	0.561	51%	0.513	S	S	*	.	H	α-helix	trans	-60.8	-43.5	171.9	-71.7	162	-169.5	167.3	0	111.9	Q949 E950 L951 L956 T957	Q949-K953 WeakPolarHBondContact O-CB 3.38Å; Q949-K953 VanDerWaalsContact O-CD 3.31Å; Q949-K953 WeakPolarHBondContact O-CD 2.95Å; Q949-K953 WeakPolarHBondContact O-CG 3.23Å; Q949-K953 PolarHBondContact O-N 3.24Å; E950-K953 PolarHBondContact O-N 3.05Å; L951-K953 PolarHBondContact O-N 3.48Å; K953-L956 PolarHBondContact O-N 2.9Å; K953-T957 PolarHBondContact O-N 2.76Å; K953-T957 PolarHBondContact O-OG1 3.39Å
954	L	87.6	Confident	89.2	Confident	103 Å²	103	104.1 Å²	104.1	54%	0.539	52%	0.518	S	S	.	.	H	α-helix	trans	-64.8	-39.6	177.8	-73.3	169.8	0	0	0	112.1	E950 L951 T957 T958	E950-L954 WeakPolarHBondContact O-CG 3.41Å; E950-L954 PolarHBondContact O-N 2.93Å; L951-L954 PolarHBondContact O-N 3.09Å; L954-T957 WeakPolarHBondContact CA-OG1 3.44Å; L954-T957 PolarHBondContact O-N 2.68Å; L954-T957 PolarHBondContact O-OG1 3.36Å; L954-T958 WeakPolarHBondContact O-CB 3.32Å; L954-T958 PolarHBondContact O-N 2.79Å; L954-T958 PolarHBondContact O-OG1 2.76Å
955	V	91.4	Very high	89	Confident	99 Å²	99	103.1 Å²	103.1	60%	0.6	51%	0.513	S	S	*	.	H	α-helix	trans	-63.6	-43.6	173.4	168.7	0	0	0	0	110.8	L951 E952 T958 R959	L951-V955 WeakPolarHBondContact O-CG2 3.31Å; L951-V955 PolarHBondContact O-N 3.18Å; E952-V955 PolarHBondContact O-N 3.49Å; V955-T958 PolarHBondContact O-N 3.11Å; V955-R959 WeakPolarHBondContact O-CB 3.17Å; V955-R959 PolarHBondContact O-N 2.83Å
956	L	91.3	Very high	88.8	Confident	95 Å²	95	98.9 Å²	98.9	50%	0.497	50%	0.502	S	S	.	.	H	α-helix	trans	-61.9	-44.8	174.4	-73.9	165.9	0	0	0	112.1	E952 K953 T958 R959 N960	E952-L956 HydrophobicContact CG-CD1 4.41Å; E952-L956 WeakPolarHBondContact O-CG 3.32Å; E952-L956 PolarHBondContact O-N 3.05Å; K953-L956 PolarHBondContact O-N 2.9Å; L956-T958 VanDerWaalsContact C-N 3.33Å; L956-T958 PolarHBondContact O-N 3.09Å; L956-R959 PolarHBondContact O-N 3.33Å; L956-N960 VanDerWaalsContact O-CG 3.31Å; L956-N960 PolarHBondContact O-N 3.32Å; L956-N960 PolarHBondContact O-OD1 3.45Å
957	T	85.4	Confident	88.9	Confident	74 Å²	74	100 Å²	100	45%	0.454	51%	0.51	S	S	.	.	H	α-helix	trans	-65.2	-36.5	175.2	51.4	0	0	0	0	112.5	K953 L954 N960 L961	K953-T957 PolarHBondContact O-N 2.76Å; K953-T957 PolarHBondContact O-OG1 3.39Å; L954-T957 WeakPolarHBondContact CA-OG1 3.44Å; L954-T957 PolarHBondContact O-N 2.68Å; L954-T957 PolarHBondContact O-OG1 3.36Å; T957-N960 PolarHBondContact O-N 2.75Å; T957-L961 WeakPolarHBondContact O-CB 3.1Å; T957-L961 VanDerWaalsContact O-CG 3.29Å; T957-L961 WeakPolarHBondContact O-CG 3.46Å; T957-L961 PolarHBondContact O-N 2.89Å
958	T	87.3	Confident	88.8	Confident	81 Å²	81	102 Å²	102	50%	0.497	51%	0.514	S	S	.	.	H	α-helix	trans	-65.5	-41.1	175.8	-55.4	0	0	0	0	110.8	L954 V955 L956 L961 Q962	L954-T958 WeakPolarHBondContact O-CB 3.32Å; L954-T958 PolarHBondContact O-N 2.79Å; L954-T958 PolarHBondContact O-OG1 2.76Å; V955-T958 PolarHBondContact O-N 3.11Å; L956-T958 VanDerWaalsContact C-N 3.33Å; L956-T958 PolarHBondContact O-N 3.09Å; T958-L961 PolarHBondContact O-N 2.78Å; T958-Q962 WeakPolarHBondContact O-CB 3.4Å; T958-Q962 PolarHBondContact O-N 3.33Å
959	R	91.6	Very high	88.7	Confident	152 Å²	152	106.2 Å²	106.2	57%	0.574	52%	0.524	S	S	*	.	H	α-helix	trans	-61.9	-48.5	175.3	-176	-178.4	178.2	103.2	21.6	111.5	V955 L956 L961 Q962 E963	V955-R959 WeakPolarHBondContact O-CB 3.17Å; V955-R959 PolarHBondContact O-N 2.83Å; L956-R959 PolarHBondContact O-N 3.33Å; R959-L961 VanDerWaalsContact C-N 3.32Å; R959-L961 PolarHBondContact O-N 3.41Å; R959-Q962 PolarHBondContact O-N 2.92Å; R959-Q962 VanDerWaalsContact O-N 3.08Å; R959-E963 HydrophobicContact CG-CG 4.48Å; R959-E963 IonicContact CZ-OE1 2.68Å; R959-E963 IonicContact NE-OE1 2.67Å; R959-E963 PolarHBondContact NE-OE1 3.33Å; R959-E963 IonicContact NH2-OE1 2.7Å; R959-E963 PolarHBondContact NH2-OE1 2.73Å; R959-E963 WeakPolarHBondContact O-CG 3.26Å; R959-E963 PolarHBondContact O-N 3.5Å
960	N	90.1	Very high	88.7	Confident	86 Å²	86	104.1 Å²	104.1	46%	0.46	52%	0.516	S	S	.	.	H	α-helix	trans	-59.5	-44	178.1	-67.3	7.8	0	0	0	111.3	L956 T957 Q962 E963 E964	L956-N960 VanDerWaalsContact O-CG 3.31Å; L956-N960 PolarHBondContact O-N 3.32Å; L956-N960 PolarHBondContact O-OD1 3.45Å; T957-N960 PolarHBondContact O-N 2.75Å; N960-Q962 VanDerWaalsContact C-N 3.3Å; N960-Q962 PolarHBondContact O-N 2.88Å; N960-E963 PolarHBondContact O-N 2.65Å; N960-E964 WeakPolarHBondContact O-CG 3.27Å; N960-E964 PolarHBondContact O-N 2.81Å
961	L	86.8	Confident	88.7	Confident	101 Å²	101	103.4 Å²	103.4	53%	0.529	51%	0.513	S	S	.	.	H	α-helix	trans	-63	-34.3	175.1	-71.6	168.5	0	0	0	112.6	T957 T958 R959 L965	T957-L961 WeakPolarHBondContact O-CB 3.1Å; T957-L961 VanDerWaalsContact O-CG 3.29Å; T957-L961 WeakPolarHBondContact O-CG 3.46Å; T957-L961 PolarHBondContact O-N 2.89Å; T958-L961 PolarHBondContact O-N 2.78Å; R959-L961 VanDerWaalsContact C-N 3.32Å; R959-L961 PolarHBondContact O-N 3.41Å; L961-L965 WeakPolarHBondContact O-CB 3.45Å; L961-L965 VanDerWaalsContact O-CG 3.28Å; L961-L965 WeakPolarHBondContact O-CG 3.42Å; L961-L965 PolarHBondContact O-N 3.4Å
962	Q	88.8	Confident	88.5	Confident	136 Å²	136	103.1 Å²	103.1	64%	0.636	51%	0.511	S	S	*	.	H	α-helix	trans	-75.3	-34.1	176.1	-170.2	165.3	4.8	0	0	112.6	T958 R959 N960 L965 S966	T958-Q962 WeakPolarHBondContact O-CB 3.4Å; T958-Q962 PolarHBondContact O-N 3.33Å; R959-Q962 PolarHBondContact O-N 2.92Å; R959-Q962 VanDerWaalsContact O-N 3.08Å; N960-Q962 VanDerWaalsContact C-N 3.3Å; N960-Q962 PolarHBondContact O-N 2.88Å; Q962-L965 PolarHBondContact O-N 2.71Å; Q962-S966 PolarHBondContact O-N 3.46Å
963	E	90.6	Very high	88.5	Confident	86 Å²	86	104.3 Å²	104.3	40%	0.402	51%	0.51	S	S	.	.	H	α-helix	trans	-67.2	-41.9	171.4	-71.5	176.1	-176.5	0	0	110.4	R959 N960 S966 L967	R959-E963 HydrophobicContact CG-CG 4.48Å; R959-E963 IonicContact CZ-OE1 2.68Å; R959-E963 IonicContact NE-OE1 2.67Å; R959-E963 PolarHBondContact NE-OE1 3.33Å; R959-E963 IonicContact NH2-OE1 2.7Å; R959-E963 PolarHBondContact NH2-OE1 2.73Å; R959-E963 WeakPolarHBondContact O-CG 3.26Å; R959-E963 PolarHBondContact O-N 3.5Å; N960-E963 PolarHBondContact O-N 2.65Å; E963-S966 PolarHBondContact O-N 3.33Å; E963-S966 PolarHBondContact O-OG 2.84Å; E963-L967 PolarHBondContact O-N 3.41Å
964	E	88	Confident	88.2	Confident	121 Å²	121	104 Å²	104	57%	0.565	51%	0.506	S	S	*	.	H	α-helix	trans	-59.5	-44.6	169.7	-76.8	-179	-160.3	0	0	112.8	N960 S966 L967 R968	N960-E964 WeakPolarHBondContact O-CG 3.27Å; N960-E964 PolarHBondContact O-N 2.81Å; E964-S966 PolarHBondContact O-N 3.01Å; E964-L967 WeakPolarHBondContact O-CB 3.23Å; E964-L967 PolarHBondContact O-N 3.24Å; E964-R968 WeakPolarHBondContact O-CG 3.29Å; E964-R968 PolarHBondContact O-N 3.2Å; E964-R968 VanDerWaalsContact O-N 3.1Å
965	L	84.6	Confident	88	Confident	110 Å²	110	102.7 Å²	102.7	58%	0.576	51%	0.505	S	S	*	.	H	α-helix	trans	-59.6	-45.9	175.2	-78.7	167.8	0	0	0	111.5	L961 Q962 L967 R968 E969	L961-L965 WeakPolarHBondContact O-CB 3.45Å; L961-L965 VanDerWaalsContact O-CG 3.28Å; L961-L965 WeakPolarHBondContact O-CG 3.42Å; L961-L965 PolarHBondContact O-N 3.4Å; Q962-L965 PolarHBondContact O-N 2.71Å; L965-L967 VanDerWaalsContact C-N 3.28Å; L965-L967 PolarHBondContact O-N 2.91Å; L965-R968 WeakPolarHBondContact O-CB 3.49Å; L965-R968 PolarHBondContact O-N 3.39Å; L965-R968 VanDerWaalsContact O-N 3.08Å; L965-E969 WeakPolarHBondContact O-CG 3.47Å; L965-E969 PolarHBondContact O-N 2.85Å
966	S	87.3	Confident	87.7	Confident	55 Å²	55	104.3 Å²	104.3	39%	0.385	50%	0.503	S	S	.	.	H	α-helix	trans	-62.1	-35	177.6	73.7	0	0	0	0	112.7	Q962 E963 E964 R968 E969 D970	Q962-S966 PolarHBondContact O-N 3.46Å; E963-S966 PolarHBondContact O-N 3.33Å; E963-S966 PolarHBondContact O-OG 2.84Å; E964-S966 PolarHBondContact O-N 3.01Å; S966-R968 PolarHBondContact O-N 3.43Å; S966-E969 PolarHBondContact O-N 3.12Å; S966-D970 WeakPolarHBondContact O-CB 3.29Å; S966-D970 PolarHBondContact O-N 2.78Å
967	L	92.9	Very high	87.4	Confident	95 Å²	95	103.6 Å²	103.6	50%	0.497	50%	0.503	S	S	.	.	H	α-helix	trans	-64.3	-39.4	173.7	-178.1	64.4	0	0	0	111.8	E963 E964 L965 D970 E971	E963-L967 PolarHBondContact O-N 3.41Å; E964-L967 WeakPolarHBondContact O-CB 3.23Å; E964-L967 PolarHBondContact O-N 3.24Å; L965-L967 VanDerWaalsContact C-N 3.28Å; L965-L967 PolarHBondContact O-N 2.91Å; L967-D970 PolarHBondContact O-N 3.25Å; L967-E971 WeakPolarHBondContact O-CG 3.19Å; L967-E971 PolarHBondContact O-N 2.81Å
968	R	87.1	Confident	87.5	Confident	156 Å²	156	106.2 Å²	106.2	59%	0.589	51%	0.51	S	S	*	.	H	α-helix	trans	-69.8	-37.8	175.3	-62.9	-49.1	-167.4	160.7	4.7	112.9	E964 L965 S966 D970 E971 L972	E964-R968 WeakPolarHBondContact O-CG 3.29Å; E964-R968 PolarHBondContact O-N 3.2Å; E964-R968 VanDerWaalsContact O-N 3.1Å; L965-R968 WeakPolarHBondContact O-CB 3.49Å; L965-R968 PolarHBondContact O-N 3.39Å; L965-R968 VanDerWaalsContact O-N 3.08Å; S966-R968 PolarHBondContact O-N 3.43Å; R968-D970 VanDerWaalsContact C-N 3.28Å; R968-D970 PolarHBondContact O-N 2.73Å; R968-E971 WeakPolarHBondContact CD-OE2 3.35Å; R968-E971 IonicContact CZ-OE2 2.72Å; R968-E971 IonicContact NE-OE2 2.68Å; R968-E971 IonicContact NH1-OE1 2.91Å; R968-E971 IonicContact NH1-OE2 3.19Å; R968-E971 PolarHBondContact NH1-OE2 2.77Å; R968-E971 PolarHBondContact O-N 2.78Å; R968-L972 WeakPolarHBondContact O-CG 3.27Å; R968-L972 PolarHBondContact O-N 3.33Å
969	E	88	Confident	87.4	Confident	125 Å²	125	109.9 Å²	109.9	58%	0.584	52%	0.515	S	S	*	.	H	α-helix	trans	-60.4	-41.3	171.3	-70	178.7	161.2	0	0	110.4	L965 S966 L972 R973	L965-E969 WeakPolarHBondContact O-CG 3.47Å; L965-E969 PolarHBondContact O-N 2.85Å; S966-E969 PolarHBondContact O-N 3.12Å; E969-L972 CarbonylContact O-C 3.59Å; E969-L972 WeakPolarHBondContact O-CB 3.43Å; E969-L972 PolarHBondContact O-N 2.93Å; E969-R973 WeakPolarHBondContact O-CG 3.46Å; E969-R973 PolarHBondContact O-N 2.94Å
970	D	88.4	Confident	87.1	Confident	62 Å²	62	105.9 Å²	105.9	33%	0.332	51%	0.505	S	S	.	.	H	α-helix	trans	-73.8	-28.5	178.6	-82.5	21.1	0	0	0	114.4	S966 L967 R968 R973 R974	S966-D970 WeakPolarHBondContact O-CB 3.29Å; S966-D970 PolarHBondContact O-N 2.78Å; L967-D970 PolarHBondContact O-N 3.25Å; R968-D970 VanDerWaalsContact C-N 3.28Å; R968-D970 PolarHBondContact O-N 2.73Å; D970-R973 IonicContact OD1-CZ 3.81Å; D970-R973 IonicContact OD1-NE 3.12Å; D970-R973 PolarHBondContact OD1-NE 2.73Å; D970-R973 IonicContact OD1-NH2 2.63Å; D970-R973 PolarHBondContact OD1-NH2 2.91Å; D970-R973 IonicContact OD2-CZ 3.68Å; D970-R973 IonicContact OD2-NH2 3.65Å; D970-R973 PolarHBondContact OD2-NH2 3.06Å; D970-R974 WeakPolarHBondContact O-CG 3.43Å; D970-R974 PolarHBondContact O-N 2.8Å; D970-R974 PolarHBondContact O-NE 2.97Å
971	E	88.1	Confident	87	Confident	68 Å²	68	106.9 Å²	106.9	32%	0.318	51%	0.507	S	S	.	.	H	α-helix	trans	-63	-47.9	163.9	-73.7	174.6	168.9	0	0	110.9	L967 R968 R973 R974 C975	L967-E971 WeakPolarHBondContact O-CG 3.19Å; L967-E971 PolarHBondContact O-N 2.81Å; R968-E971 WeakPolarHBondContact CD-OE2 3.35Å; R968-E971 IonicContact CZ-OE2 2.72Å; R968-E971 IonicContact NE-OE2 2.68Å; R968-E971 IonicContact NH1-OE1 2.91Å; R968-E971 IonicContact NH1-OE2 3.19Å; R968-E971 PolarHBondContact NH1-OE2 2.77Å; R968-E971 PolarHBondContact O-N 2.78Å; E971-R973 VanDerWaalsContact C-N 3.32Å; E971-R973 PolarHBondContact O-N 2.86Å; E971-R974 PolarHBondContact O-N 2.97Å; E971-C975 PolarHBondContact O-N 3.4Å; E971-C975 PolarHBondContact O-SG 2.66Å
972	L	83.1	Confident	86.7	Confident	108 Å²	108	104.5 Å²	104.5	57%	0.565	50%	0.502	S	S	*	.	H	α-helix	trans	-63.9	-33	177.7	-78.1	165.2	0	0	0	113.2	R968 E969 K976	R968-L972 WeakPolarHBondContact O-CG 3.27Å; R968-L972 PolarHBondContact O-N 3.33Å; E969-L972 CarbonylContact O-C 3.59Å; E969-L972 WeakPolarHBondContact O-CB 3.43Å; E969-L972 PolarHBondContact O-N 2.93Å; L972-K976 WeakPolarHBondContact O-CG 3.34Å; L972-K976 PolarHBondContact O-N 3.46Å
973	R	87.8	Confident	86.6	Confident	148 Å²	148	100.3 Å²	100.3	56%	0.558	49%	0.485	S	S	*	.	H	α-helix	trans	-66.7	-43.6	173.3	-69.8	-171.3	-53.1	116.7	-16.3	111.6	E969 D970 E971 K976 T977	E969-R973 WeakPolarHBondContact O-CG 3.46Å; E969-R973 PolarHBondContact O-N 2.94Å; D970-R973 IonicContact OD1-CZ 3.81Å; D970-R973 IonicContact OD1-NE 3.12Å; D970-R973 PolarHBondContact OD1-NE 2.73Å; D970-R973 IonicContact OD1-NH2 2.63Å; D970-R973 PolarHBondContact OD1-NH2 2.91Å; D970-R973 IonicContact OD2-CZ 3.68Å; D970-R973 IonicContact OD2-NH2 3.65Å; D970-R973 PolarHBondContact OD2-NH2 3.06Å; E971-R973 VanDerWaalsContact C-N 3.32Å; E971-R973 PolarHBondContact O-N 2.86Å; R973-K976 PolarHBondContact O-N 2.88Å; R973-T977 PolarHBondContact O-N 3.34Å; R973-T977 PolarHBondContact O-OG1 2.7Å
974	R	86.3	Confident	86.4	Confident	123 Å²	123	101.2 Å²	101.2	46%	0.464	49%	0.492	S	S	.	.	H	α-helix	trans	-64.1	-44.9	177.5	-76.3	174.8	-76.1	159.4	-5.8	112.8	D970 E971 K976 T977 E978	D970-R974 WeakPolarHBondContact O-CG 3.43Å; D970-R974 PolarHBondContact O-N 2.8Å; D970-R974 PolarHBondContact O-NE 2.97Å; E971-R974 PolarHBondContact O-N 2.97Å; R974-K976 PolarHBondContact O-N 3.21Å; R974-T977 WeakPolarHBondContact CA-OG1 3.29Å; R974-T977 PolarHBondContact O-N 3.3Å; R974-T977 VanDerWaalsContact O-N 3.14Å; R974-T977 PolarHBondContact O-OG1 2.74Å; R974-E978 WeakPolarHBondContact O-CG 3.18Å; R974-E978 PolarHBondContact O-N 3.12Å
975	C	84	Confident	86.3	Confident	76 Å²	76	101 Å²	101	51%	0.514	49%	0.49	S	S	.	.	H	α-helix	trans	-59.7	-32.2	177	-63.1	0	0	0	0	112.7	E971 R979	E971-C975 PolarHBondContact O-N 3.4Å; E971-C975 PolarHBondContact O-SG 2.66Å; C975-R979 WeakPolarHBondContact O-CB 3.3Å; C975-R979 PolarHBondContact O-N 2.96Å
976	K	84.5	Confident	86.2	Confident	132 Å²	132	101.1 Å²	101.1	57%	0.574	49%	0.487	S	S	*	.	H	α-helix	trans	-68.5	-49.9	173.7	-72.3	169.9	-178	178.2	0	111.4	L972 R973 R974 E978 R979 D980	L972-K976 WeakPolarHBondContact O-CG 3.34Å; L972-K976 PolarHBondContact O-N 3.46Å; R973-K976 PolarHBondContact O-N 2.88Å; R974-K976 PolarHBondContact O-N 3.21Å; K976-E978 VanDerWaalsContact C-N 3.33Å; K976-E978 PolarHBondContact O-N 3.17Å; K976-R979 WeakPolarHBondContact O-CB 3.12Å; K976-R979 PolarHBondContact O-N 2.96Å; K976-R979 VanDerWaalsContact O-N 3.17Å; K976-D980 PolarHBondContact O-N 2.86Å
977	T	85.7	Confident	85.9	Confident	81 Å²	81	102.7 Å²	102.7	50%	0.497	49%	0.489	S	S	.	.	H	α-helix	trans	-62.3	-37.9	179.8	45.3	0	0	0	0	113.1	R973 R974 R979 D980 E981	R973-T977 PolarHBondContact O-N 3.34Å; R973-T977 PolarHBondContact O-OG1 2.7Å; R974-T977 WeakPolarHBondContact CA-OG1 3.29Å; R974-T977 PolarHBondContact O-N 3.3Å; R974-T977 VanDerWaalsContact O-N 3.14Å; R974-T977 PolarHBondContact O-OG1 2.74Å; T977-R979 VanDerWaalsContact C-N 3.35Å; T977-R979 PolarHBondContact O-N 3.27Å; T977-D980 PolarHBondContact O-N 3.33Å; T977-E981 WeakPolarHBondContact O-CB 3.25Å; T977-E981 PolarHBondContact O-N 3.13Å
978	E	86.9	Confident	85.3	Confident	129 Å²	129	100.9 Å²	100.9	60%	0.603	48%	0.482	S	S	*	.	H	α-helix	trans	-64.9	-38.3	175.9	-71.3	169.1	-161.3	0	0	112.2	R974 K976 A982	R974-E978 WeakPolarHBondContact O-CG 3.18Å; R974-E978 PolarHBondContact O-N 3.12Å; K976-E978 VanDerWaalsContact C-N 3.33Å; K976-E978 PolarHBondContact O-N 3.17Å; E978-A982 PolarHBondContact O-N 3.49Å; E978-A982 VanDerWaalsContact O-N 3.1Å
979	R	84.8	Confident	85	Confident	157 Å²	157	98.8 Å²	98.8	59%	0.592	48%	0.481	S	S	*	.	H	α-helix	trans	-66.9	-42.3	174.2	-172.1	-149.9	76.8	103.5	-1.9	111.8	C975 K976 T977 A982 V983	C975-R979 WeakPolarHBondContact O-CB 3.3Å; C975-R979 PolarHBondContact O-N 2.96Å; K976-R979 WeakPolarHBondContact O-CB 3.12Å; K976-R979 PolarHBondContact O-N 2.96Å; K976-R979 VanDerWaalsContact O-N 3.17Å; T977-R979 VanDerWaalsContact C-N 3.35Å; T977-R979 PolarHBondContact O-N 3.27Å; R979-A982 WeakPolarHBondContact O-CB 3.49Å; R979-A982 PolarHBondContact O-N 3.44Å; R979-A982 VanDerWaalsContact O-N 3.16Å; R979-V983 PolarHBondContact O-N 3.49Å; R979-V983 VanDerWaalsContact O-N 3.13Å
980	D	86.4	Confident	84.6	Confident	68 Å²	68	98.4 Å²	98.4	36%	0.364	48%	0.48	S	S	.	.	H	α-helix	trans	-67.9	-37.5	179.9	-59.8	-19.7	0	0	0	111	K976 T977 A982 V983 L984	K976-D980 PolarHBondContact O-N 2.86Å; T977-D980 PolarHBondContact O-N 3.33Å; D980-A982 VanDerWaalsContact C-N 3.33Å; D980-A982 PolarHBondContact O-N 2.87Å; D980-V983 PolarHBondContact O-N 2.82Å; D980-L984 PolarHBondContact O-N 2.68Å; D980-L984 VanDerWaalsContact O-N 3.1Å
981	E	87.1	Confident	84.3	Confident	107 Å²	107	102.3 Å²	102.3	50%	0.5	49%	0.49	S	S	.	.	H	α-helix	trans	-60.4	-37.9	168.4	-93.2	-161.8	-141.7	0	0	113.4	T977 L984 K985	T977-E981 WeakPolarHBondContact O-CB 3.25Å; T977-E981 PolarHBondContact O-N 3.13Å; E981-L984 PolarHBondContact O-N 2.77Å; E981-K985 VanDerWaalsContact O-CD 3.28Å; E981-K985 WeakPolarHBondContact O-CD 3.15Å; E981-K985 WeakPolarHBondContact O-CE 3.23Å; E981-K985 VanDerWaalsContact O-CG 3.27Å; E981-K985 WeakPolarHBondContact O-CG 3.39Å; E981-K985 PolarHBondContact O-N 3.07Å; E981-K985 VanDerWaalsContact O-N 3.15Å; E981-K985 IonicContact OE2-NZ 3.94Å; E981-K985 PolarHBondContact OE2-NZ 2.72Å
982	A	79.9	Confident	84.1	Confident	52 Å²	52	105 Å²	105	43%	0.43	50%	0.5	S	S	.	.	H	α-helix	trans	-65.2	-43.3	177.5	0	0	0	0	0	111.4	E978 R979 D980 L984 K985 E986	E978-A982 PolarHBondContact O-N 3.49Å; E978-A982 VanDerWaalsContact O-N 3.1Å; R979-A982 WeakPolarHBondContact O-CB 3.49Å; R979-A982 PolarHBondContact O-N 3.44Å; R979-A982 VanDerWaalsContact O-N 3.16Å; D980-A982 VanDerWaalsContact C-N 3.33Å; D980-A982 PolarHBondContact O-N 2.87Å; A982-L984 VanDerWaalsContact C-N 3.35Å; A982-L984 PolarHBondContact O-N 3.39Å; A982-K985 WeakPolarHBondContact O-CB 3.47Å; A982-K985 PolarHBondContact O-N 2.81Å; A982-K985 VanDerWaalsContact O-N 3.14Å; A982-E986 PolarHBondContact O-N 2.73Å
983	V	87.6	Confident	84	Confident	47 Å²	47	103.9 Å²	103.9	29%	0.285	50%	0.498	S	S	.	.	H	α-helix	trans	-62.9	-38.7	175.8	175	0	0	0	0	111.7	R979 D980 K985 E986 Q987	R979-V983 PolarHBondContact O-N 3.49Å; R979-V983 VanDerWaalsContact O-N 3.13Å; D980-V983 PolarHBondContact O-N 2.82Å; V983-K985 VanDerWaalsContact C-N 3.3Å; V983-K985 PolarHBondContact O-N 2.8Å; V983-E986 WeakPolarHBondContact O-CB 3.16Å; V983-E986 PolarHBondContact O-N 3.49Å; V983-Q987 HydrophobicContact CG1-CG 4.48Å; V983-Q987 WeakPolarHBondContact O-CG 3.43Å; V983-Q987 PolarHBondContact O-N 2.81Å
984	L	85.8	Confident	83.7	Confident	105 Å²	105	100 Å²	100	55%	0.55	49%	0.486	S	S	.	.	H	α-helix	trans	-66.1	-31.5	174.8	-74.9	169.2	0	0	0	113	D980 E981 A982 T988	D980-L984 PolarHBondContact O-N 2.68Å; D980-L984 VanDerWaalsContact O-N 3.1Å; E981-L984 PolarHBondContact O-N 2.77Å; A982-L984 VanDerWaalsContact C-N 3.35Å; A982-L984 PolarHBondContact O-N 3.39Å; L984-T988 WeakPolarHBondContact O-CB 3.2Å; L984-T988 PolarHBondContact O-N 3.38Å; L984-T988 PolarHBondContact O-OG1 2.86Å
985	K	86.3	Confident	83.5	Confident	116 Å²	116	99.2 Å²	99.2	50%	0.504	49%	0.491	S	S	.	.	H	α-helix	trans	-71.9	-43	174.3	-68.2	157	-164.9	164.6	0	110.6	E981 A982 V983 T988 L989	E981-K985 VanDerWaalsContact O-CD 3.28Å; E981-K985 WeakPolarHBondContact O-CD 3.15Å; E981-K985 WeakPolarHBondContact O-CE 3.23Å; E981-K985 VanDerWaalsContact O-CG 3.27Å; E981-K985 WeakPolarHBondContact O-CG 3.39Å; E981-K985 PolarHBondContact O-N 3.07Å; E981-K985 VanDerWaalsContact O-N 3.15Å; E981-K985 IonicContact OE2-NZ 3.94Å; E981-K985 PolarHBondContact OE2-NZ 2.72Å; A982-K985 WeakPolarHBondContact O-CB 3.47Å; A982-K985 PolarHBondContact O-N 2.81Å; A982-K985 VanDerWaalsContact O-N 3.14Å; V983-K985 VanDerWaalsContact C-N 3.3Å; V983-K985 PolarHBondContact O-N 2.8Å; K985-T988 PolarHBondContact O-N 3.34Å; K985-T988 VanDerWaalsContact O-N 3.15Å; K985-L989 PolarHBondContact O-N 3.08Å; K985-L989 VanDerWaalsContact O-N 3.13Å
986	E	81.4	Confident	83.4	Confident	113 Å²	113	101 Å²	101	53%	0.528	50%	0.495	S	S	.	.	H	α-helix	trans	-55.9	-55.9	173.1	-174.3	170.1	-145.2	0	0	111.6	A982 V983 T988 L989 E990	A982-E986 PolarHBondContact O-N 2.73Å; V983-E986 WeakPolarHBondContact O-CB 3.16Å; V983-E986 PolarHBondContact O-N 3.49Å; E986-T988 PolarHBondContact O-N 3.46Å; E986-L989 WeakPolarHBondContact O-CA 3.33Å; E986-L989 WeakPolarHBondContact O-CB 3.3Å; E986-L989 PolarHBondContact O-N 2.86Å; E986-E990 PolarHBondContact O-N 3.48Å
987	Q	81.4	Confident	83.2	Confident	89 Å²	89	99.9 Å²	99.9	42%	0.416	49%	0.492	S	S	.	.	H	α-helix	trans	-58.6	-18.5	175.7	-71.2	178.6	-0.9	0	0	114.7	V983 E990 R991	V983-Q987 HydrophobicContact CG1-CG 4.48Å; V983-Q987 WeakPolarHBondContact O-CG 3.43Å; V983-Q987 PolarHBondContact O-N 2.81Å; Q987-E990 WeakPolarHBondContact CA-OE2 3.28Å; Q987-R991 VanDerWaalsContact O-CZ 3.32Å; Q987-R991 PolarHBondContact O-NE 3.43Å; Q987-R991 PolarHBondContact O-NH2 2.77Å
988	T	81.6	Confident	82.9	Confident	57 Å²	57	100 Å²	100	35%	0.35	49%	0.488	S	S	.	.	H	α-helix	trans	-91.2	-19.2	176.5	-57.4	0	0	0	0	112.3	L984 K985 E986 R991 K992	L984-T988 WeakPolarHBondContact O-CB 3.2Å; L984-T988 PolarHBondContact O-N 3.38Å; L984-T988 PolarHBondContact O-OG1 2.86Å; K985-T988 PolarHBondContact O-N 3.34Å; K985-T988 VanDerWaalsContact O-N 3.15Å; E986-T988 PolarHBondContact O-N 3.46Å; T988-R991 VanDerWaalsContact CA-NH2 3.35Å; T988-R991 PolarHBondContact OG1-NH2 2.81Å; T988-K992 WeakPolarHBondContact O-CG 3.08Å
989	L	79.7	Confident	82.5	Confident	111 Å²	111	100 Å²	100	58%	0.581	49%	0.488	S	S	*	.	H	α-helix	trans	-84.2	-41.8	168.5	-65.4	171.4	0	0	0	110.9	K985 E986 R991 K992 V993	K985-L989 PolarHBondContact O-N 3.08Å; K985-L989 VanDerWaalsContact O-N 3.13Å; E986-L989 WeakPolarHBondContact O-CA 3.33Å; E986-L989 WeakPolarHBondContact O-CB 3.3Å; E986-L989 PolarHBondContact O-N 2.86Å; L989-R991 PolarHBondContact O-N 2.81Å; L989-K992 WeakPolarHBondContact O-CB 3.31Å; L989-K992 PolarHBondContact O-N 3.36Å; L989-V993 PolarHBondContact O-N 2.86Å
990	E	78.9	Confident	82.1	Confident	118 Å²	118	95.4 Å²	95.4	55%	0.551	48%	0.483	S	S	*	.	H	α-helix	trans	-51.9	-49.9	175.7	-69.8	-179.1	135.6	0	0	112.3	E986 Q987 K992 V993 H994	E986-E990 PolarHBondContact O-N 3.48Å; Q987-E990 WeakPolarHBondContact CA-OE2 3.28Å; E990-K992 VanDerWaalsContact C-N 3.31Å; E990-K992 PolarHBondContact O-N 3.48Å; E990-V993 WeakPolarHBondContact O-CB 3.15Å; E990-V993 PolarHBondContact O-N 2.91Å; E990-V993 VanDerWaalsContact O-N 3.15Å; E990-H994 PolarHBondContact O-N 3.14Å
991	R	82.3	Confident	81.7	Confident	144 Å²	144	94 Å²	94	54%	0.543	48%	0.475	S	S	.	.	H	α-helix	trans	-57.7	-40.1	176.8	-82.8	174	-76.3	139.7	-3.5	113.1	Q987 T988 L989 H994 D995	Q987-R991 VanDerWaalsContact O-CZ 3.32Å; Q987-R991 PolarHBondContact O-NE 3.43Å; Q987-R991 PolarHBondContact O-NH2 2.77Å; T988-R991 VanDerWaalsContact CA-NH2 3.35Å; T988-R991 PolarHBondContact OG1-NH2 2.81Å; L989-R991 PolarHBondContact O-N 2.81Å; R991-H994 PolarHBondContact O-N 2.7Å; R991-D995 PolarHBondContact O-N 2.76Å
992	K	83.9	Confident	81.2	Confident	123 Å²	123	96.4 Å²	96.4	54%	0.535	48%	0.483	S	S	.	.	H	α-helix	trans	-69.7	-32.8	178.3	-68.6	175.7	-178.6	-179.8	0	112.8	T988 L989 E990 H994 L996	T988-K992 WeakPolarHBondContact O-CG 3.08Å; L989-K992 WeakPolarHBondContact O-CB 3.31Å; L989-K992 PolarHBondContact O-N 3.36Å; E990-K992 VanDerWaalsContact C-N 3.31Å; E990-K992 PolarHBondContact O-N 3.48Å; K992-H994 VanDerWaalsContact C-N 3.34Å; K992-L996 WeakPolarHBondContact O-CD1 3.48Å; K992-L996 VanDerWaalsContact O-CG 3.29Å; K992-L996 WeakPolarHBondContact O-CG 3.5Å; K992-L996 PolarHBondContact O-N 2.7Å
993	V	81.1	Confident	81.1	Confident	85 Å²	85	98.6 Å²	98.6	52%	0.515	49%	0.488	S	S	.	.	H	α-helix	trans	-63.3	-46.3	170.9	175	0	0	0	0	109.2	L989 E990 D995 L996 E997	L989-V993 PolarHBondContact O-N 2.86Å; E990-V993 WeakPolarHBondContact O-CB 3.15Å; E990-V993 PolarHBondContact O-N 2.91Å; E990-V993 VanDerWaalsContact O-N 3.15Å; V993-D995 PolarHBondContact O-N 2.76Å; V993-L996 WeakPolarHBondContact O-CB 3.34Å; V993-L996 PolarHBondContact O-N 2.82Å; V993-L996 VanDerWaalsContact O-N 3.16Å; V993-E997 WeakPolarHBondContact O-CG 3.22Å; V993-E997 PolarHBondContact O-N 3.41Å
994	H	83	Confident	80.5	Confident	67 Å²	67	100 Å²	100	31%	0.31	49%	0.49	S	S	.	.	H	α-helix	trans	-64.4	-39.9	-179.6	-166.9	50.5	0	0	0	113.9	E990 R991 K992 L996 E997 M998	E990-H994 PolarHBondContact O-N 3.14Å; R991-H994 PolarHBondContact O-N 2.7Å; K992-H994 VanDerWaalsContact C-N 3.34Å; H994-L996 VanDerWaalsContact C-N 3.27Å; H994-L996 PolarHBondContact O-N 3.42Å; H994-E997 IonicContact CE1-OE2 2.72Å; H994-E997 IonicContact CG-OE2 2.66Å; H994-E997 IonicContact ND1-OE2 3.98Å; H994-E997 PolarHBondContact ND1-OE2 2.84Å; H994-E997 WeakPolarHBondContact O-CB 3.47Å; H994-E997 PolarHBondContact O-N 2.97Å; H994-M998 WeakPolarHBondContact O-CG 3.41Å; H994-M998 PolarHBondContact O-N 3.44Å; H994-M998 VanDerWaalsContact O-N 3.07Å
995	D	81.9	Confident	80.1	Confident	107 Å²	107	98.1 Å²	98.1	57%	0.572	48%	0.478	S	S	*	.	H	α-helix	trans	-59	-39.1	173.7	-68.6	-36.4	0	0	0	111.7	R991 V993 M998 E999	R991-D995 PolarHBondContact O-N 2.76Å; V993-D995 PolarHBondContact O-N 2.76Å; D995-M998 PolarHBondContact O-N 2.81Å; D995-E999 PolarHBondContact O-N 2.82Å; D995-E999 VanDerWaalsContact O-N 3.12Å
996	L	81	Confident	79.5	Confident	114 Å²	114	95.5 Å²	95.5	60%	0.597	47%	0.472	S	S	*	.	H	α-helix	trans	-72.3	-34.6	177.6	-69.4	168.2	0	0	0	113	K992 V993 H994 E999 A1000	K992-L996 WeakPolarHBondContact O-CD1 3.48Å; K992-L996 VanDerWaalsContact O-CG 3.29Å; K992-L996 WeakPolarHBondContact O-CG 3.5Å; K992-L996 PolarHBondContact O-N 2.7Å; V993-L996 WeakPolarHBondContact O-CB 3.34Å; V993-L996 PolarHBondContact O-N 2.82Å; V993-L996 VanDerWaalsContact O-N 3.16Å; H994-L996 VanDerWaalsContact C-N 3.27Å; H994-L996 PolarHBondContact O-N 3.42Å; L996-E999 PolarHBondContact O-N 3.24Å; L996-A1000 WeakPolarHBondContact O-CB 3.44Å; L996-A1000 PolarHBondContact O-N 3.2Å
997	E	81.7	Confident	79.1	Confident	107 Å²	107	96.9 Å²	96.9	50%	0.5	48%	0.476	S	S	.	.	H	α-helix	trans	-60.4	-47.5	171.3	-69	173.4	152.6	0	0	110.9	V993 H994 E999 A1000 E1001	V993-E997 WeakPolarHBondContact O-CG 3.22Å; V993-E997 PolarHBondContact O-N 3.41Å; H994-E997 IonicContact CE1-OE2 2.72Å; H994-E997 IonicContact CG-OE2 2.66Å; H994-E997 IonicContact ND1-OE2 3.98Å; H994-E997 PolarHBondContact ND1-OE2 2.84Å; H994-E997 WeakPolarHBondContact O-CB 3.47Å; H994-E997 PolarHBondContact O-N 2.97Å; E997-E999 VanDerWaalsContact C-N 3.33Å; E997-E999 PolarHBondContact O-N 3.31Å; E997-A1000 PolarHBondContact O-N 2.98Å; E997-E1001 PolarHBondContact O-N 2.86Å
998	M	78.2	Confident	78.8	Confident	85 Å²	85	94.5 Å²	94.5	42%	0.419	47%	0.467	S	S	.	.	H	α-helix	trans	-62.5	-37.3	178.7	-69.3	-64.6	-64.2	0	0	112.5	H994 D995 K1002 R1032	H994-M998 WeakPolarHBondContact O-CG 3.41Å; H994-M998 PolarHBondContact O-N 3.44Å; H994-M998 VanDerWaalsContact O-N 3.07Å; D995-M998 PolarHBondContact O-N 2.81Å; M998-K1002 PolarHBondContact O-N 3.4Å; M998-R1032 HydrophobicContact CE-CB 4.05Å; M998-R1032 HydrophobicContact SD-CB 3.3Å; M998-R1032 WeakPolarHBondContact SD-CB 3.4Å; M998-R1032 HydrophobicContact SD-CG 3.99Å
999	E	79.8	Confident	78.5	Confident	129 Å²	129	95.4 Å²	95.4	60%	0.603	47%	0.469	S	S	*	.	H	α-helix	trans	-69.6	-38.4	174.8	-172.5	163.7	-135.1	0	0	112.3	D995 L996 E997 K1002 N1003	D995-E999 PolarHBondContact O-N 2.82Å; D995-E999 VanDerWaalsContact O-N 3.12Å; L996-E999 PolarHBondContact O-N 3.24Å; E997-E999 VanDerWaalsContact C-N 3.33Å; E997-E999 PolarHBondContact O-N 3.31Å; E999-K1002 PolarHBondContact O-N 2.8Å; E999-N1003 WeakPolarHBondContact O-CB 3.49Å; E999-N1003 PolarHBondContact O-N 3.26Å
1000	A	74.9	Confident	78.3	Confident	60 Å²	60	96.6 Å²	96.6	50%	0.496	47%	0.47	S	S	.	.	H	α-helix	trans	-63.6	-41.5	175	0	0	0	0	0	112.4	L996 E997 N1003 K1004	L996-A1000 WeakPolarHBondContact O-CB 3.44Å; L996-A1000 PolarHBondContact O-N 3.2Å; E997-A1000 PolarHBondContact O-N 2.98Å; A1000-N1003 WeakPolarHBondContact O-CB 3.44Å; A1000-N1003 PolarHBondContact O-N 2.91Å; A1000-N1003 VanDerWaalsContact O-N 3.15Å; A1000-K1004 PolarHBondContact O-N 3.14Å
1001	E	79	Confident	77.9	Confident	39 Å²	39	92.5 Å²	92.5	18%	0.182	45%	0.454	C	S	.	.	H	α-helix	trans	-63.2	-43.1	177.3	-158	74	-126.6	0	0	112	E997 N1003 K1004 Q1005 E1031 R1032	E997-E1001 PolarHBondContact O-N 2.86Å; E1001-N1003 VanDerWaalsContact C-N 3.29Å; E1001-N1003 PolarHBondContact O-N 3.32Å; E1001-K1004 WeakPolarHBondContact O-CB 3.47Å; E1001-K1004 PolarHBondContact O-N 2.75Å; E1001-K1004 VanDerWaalsContact OE1-CD 3.32Å; E1001-K1004 WeakPolarHBondContact OE1-CD 3.41Å; E1001-K1004 WeakPolarHBondContact OE1-CE 3.48Å; E1001-K1004 IonicContact OE1-NZ 3.59Å; E1001-K1004 PolarHBondContact OE1-NZ 2.81Å; E1001-Q1005 PolarHBondContact O-N 3.13Å; E1001-E1031 WeakPolarHBondContact CG-O 3.3Å; E1001-R1032 HydrophobicContact CB-CG 4.33Å; E1001-R1032 HydrophobicContact CG-CG 3.84Å; E1001-R1032 IonicContact OE1-CZ 2.71Å; E1001-R1032 IonicContact OE1-NH2 2.76Å; E1001-R1032 PolarHBondContact OE1-NH2 3.36Å; E1001-R1032 IonicContact OE2-CZ 3.65Å; E1001-R1032 IonicContact OE2-NE 3.6Å; E1001-R1032 PolarHBondContact OE2-NE 3.49Å; E1001-R1032 IonicContact OE2-NH2 3.12Å; E1001-R1032 PolarHBondContact OE2-NH2 2.98Å
1002	K	76.8	Confident	77.8	Confident	156 Å²	156	89.5 Å²	89.5	68%	0.678	44%	0.443	S	S	*	.	H	α-helix	trans	-61	-38.5	172.2	-176.1	-179	179.1	-176.1	0	111.9	M998 E999 Q1005 T1006	M998-K1002 PolarHBondContact O-N 3.4Å; E999-K1002 PolarHBondContact O-N 2.8Å; K1002-Q1005 PolarHBondContact O-N 2.89Å; K1002-T1006 PolarHBondContact O-N 3.48Å
1003	N	76.1	Confident	77.3	Confident	99 Å²	99	90.3 Å²	90.3	53%	0.529	45%	0.449	S	S	.	.	H	α-helix	trans	-67.7	-39.1	178.8	-149.2	-18.5	0	0	0	111.4	E999 A1000 E1001 T1006 K1007	E999-N1003 WeakPolarHBondContact O-CB 3.49Å; E999-N1003 PolarHBondContact O-N 3.26Å; A1000-N1003 WeakPolarHBondContact O-CB 3.44Å; A1000-N1003 PolarHBondContact O-N 2.91Å; A1000-N1003 VanDerWaalsContact O-N 3.15Å; E1001-N1003 VanDerWaalsContact C-N 3.29Å; E1001-N1003 PolarHBondContact O-N 3.32Å; N1003-T1006 PolarHBondContact O-N 2.9Å; N1003-T1006 PolarHBondContact O-OG1 2.66Å; N1003-K1007 PolarHBondContact O-N 2.82Å
1004	K	75.4	Confident	76.9	Confident	77 Å²	77	91.7 Å²	91.7	34%	0.335	45%	0.451	S	S	.	.	H	α-helix	trans	-56.8	-48.5	169.5	164.2	-176.3	155.7	-160	0	111.8	A1000 E1001 T1006 K1007 D1008 E1031	A1000-K1004 PolarHBondContact O-N 3.14Å; E1001-K1004 WeakPolarHBondContact O-CB 3.47Å; E1001-K1004 PolarHBondContact O-N 2.75Å; E1001-K1004 VanDerWaalsContact OE1-CD 3.32Å; E1001-K1004 WeakPolarHBondContact OE1-CD 3.41Å; E1001-K1004 WeakPolarHBondContact OE1-CE 3.48Å; E1001-K1004 IonicContact OE1-NZ 3.59Å; E1001-K1004 PolarHBondContact OE1-NZ 2.81Å; K1004-T1006 VanDerWaalsContact C-N 3.27Å; K1004-T1006 PolarHBondContact O-N 3.45Å; K1004-K1007 WeakPolarHBondContact O-CA 3.28Å; K1004-K1007 WeakPolarHBondContact O-CB 3.39Å; K1004-K1007 PolarHBondContact O-N 3.39Å; K1004-D1008 PolarHBondContact O-N 2.83Å; K1004-E1031 IonicContact NZ-OE2 3.91Å; K1004-E1031 PolarHBondContact NZ-OE2 2.78Å
1005	Q	77.3	Confident	76.4	Confident	64 Å²	64	89.8 Å²	89.8	30%	0.299	44%	0.442	S	S	.	.	H	α-helix	trans	-54	-41.4	176.6	-176.5	61.3	50.5	0	0	112.6	E1001 K1002 K1007 D1008 D1009 E1030	E1001-Q1005 PolarHBondContact O-N 3.13Å; K1002-Q1005 PolarHBondContact O-N 2.89Å; Q1005-K1007 PolarHBondContact O-N 2.76Å; Q1005-D1008 PolarHBondContact O-N 2.83Å; Q1005-D1009 PolarHBondContact NE2-OD2 2.78Å; Q1005-D1009 PolarHBondContact O-N 2.75Å; Q1005-E1030 PolarHBondContact OE1-O 3.12Å
1006	T	75.1	Confident	76	Confident	62 Å²	62	90.6 Å²	90.6	38%	0.38	45%	0.445	S	S	.	.	H	α-helix	trans	-70.4	-14.5	178	74.3	0	0	0	0	114.7	K1002 N1003 K1004 K1010	K1002-T1006 PolarHBondContact O-N 3.48Å; N1003-T1006 PolarHBondContact O-N 2.9Å; N1003-T1006 PolarHBondContact O-OG1 2.66Å; K1004-T1006 VanDerWaalsContact C-N 3.27Å; K1004-T1006 PolarHBondContact O-N 3.45Å; T1006-K1010 WeakPolarHBondContact O-CD 3.11Å; T1006-K1010 WeakPolarHBondContact O-CG 3.24Å
1007	K	72.2	Confident	75.4	Confident	141 Å²	141	91.2 Å²	91.2	61%	0.613	45%	0.447	S	S	*	.	H	α-helix	trans	-81.5	-39	170.3	-66.1	179.7	179	177.4	0	111.1	N1003 K1004 Q1005 K1010 S1011	N1003-K1007 PolarHBondContact O-N 2.82Å; K1004-K1007 WeakPolarHBondContact O-CA 3.28Å; K1004-K1007 WeakPolarHBondContact O-CB 3.39Å; K1004-K1007 PolarHBondContact O-N 3.39Å; Q1005-K1007 PolarHBondContact O-N 2.76Å; K1007-K1010 CarbonylContact O-C 2.78Å; K1007-K1010 WeakPolarHBondContact O-CB 3.36Å; K1007-K1010 PolarHBondContact O-N 2.85Å; K1007-S1011 PolarHBondContact O-N 2.87Å
1008	D	75.2	Confident	74.8	Confident	39 Å²	39	88.9 Å²	88.9	21%	0.209	44%	0.436	C	S	.	.	H	α-helix	trans	-65.3	-39.6	179.5	-73.8	-12.4	0	0	0	111.8	K1004 Q1005 K1010 S1011 R1012 E1030	K1004-D1008 PolarHBondContact O-N 2.83Å; Q1005-D1008 PolarHBondContact O-N 2.83Å; D1008-K1010 VanDerWaalsContact C-N 3.33Å; D1008-K1010 PolarHBondContact O-N 3.13Å; D1008-S1011 CarbonylContact O-C 3.59Å; D1008-S1011 WeakPolarHBondContact O-CA 3.16Å; D1008-S1011 VanDerWaalsContact O-CB 3.28Å; D1008-S1011 WeakPolarHBondContact O-CB 3.34Å; D1008-S1011 PolarHBondContact O-N 3.43Å; D1008-R1012 WeakPolarHBondContact O-CG 3.26Å; D1008-R1012 PolarHBondContact O-N 2.86Å; D1008-E1030 VanDerWaalsContact OD2-CA 3.29Å; D1008-E1030 WeakPolarHBondContact OD2-CA 3.47Å
1009	D	75.4	Confident	74.5	Confident	76 Å²	76	88.3 Å²	88.3	41%	0.406	44%	0.435	S	S	.	.	H	α-helix	trans	-67.2	-31.6	174.3	-71.7	-53.2	0	0	0	113.3	Q1005 R1012 Q1013	Q1005-D1009 PolarHBondContact NE2-OD2 2.78Å; Q1005-D1009 PolarHBondContact O-N 2.75Å; D1009-R1012 PolarHBondContact O-N 2.86Å; D1009-R1012 WeakPolarHBondContact OD1-CD 3.21Å; D1009-R1012 IonicContact OD1-CZ 2.71Å; D1009-R1012 IonicContact OD1-NE 2.74Å; D1009-R1012 IonicContact OD1-NH1 3.93Å; D1009-R1012 PolarHBondContact OD1-NH1 2.9Å; D1009-Q1013 PolarHBondContact O-N 3.43Å; D1009-Q1013 VanDerWaalsContact O-N 3.09Å
1010	K	75.4	Confident	74.2	Confident	137 Å²	137	89.4 Å²	89.4	60%	0.596	43%	0.433	S	S	*	.	H	α-helix	trans	-69.4	-34.6	169	-71	170.1	-175.3	165.7	0	111.7	T1006 K1007 D1008 Q1013 M1014	T1006-K1010 WeakPolarHBondContact O-CD 3.11Å; T1006-K1010 WeakPolarHBondContact O-CG 3.24Å; K1007-K1010 CarbonylContact O-C 2.78Å; K1007-K1010 WeakPolarHBondContact O-CB 3.36Å; K1007-K1010 PolarHBondContact O-N 2.85Å; D1008-K1010 VanDerWaalsContact C-N 3.33Å; D1008-K1010 PolarHBondContact O-N 3.13Å; K1010-Q1013 PolarHBondContact O-N 3.46Å; K1010-M1014 WeakPolarHBondContact O-CB 3.34Å; K1010-M1014 PolarHBondContact O-N 2.88Å
1011	S	71.2	Confident	73.9	Confident	32 Å²	32	91 Å²	91	22%	0.224	43%	0.432	C	S	.	.	H	α-helix	trans	-63.2	-48.4	171.6	-163.1	0	0	0	0	110.2	K1007 D1008 Q1013 M1014 K1015	K1007-S1011 PolarHBondContact O-N 2.87Å; D1008-S1011 CarbonylContact O-C 3.59Å; D1008-S1011 WeakPolarHBondContact O-CA 3.16Å; D1008-S1011 VanDerWaalsContact O-CB 3.28Å; D1008-S1011 WeakPolarHBondContact O-CB 3.34Å; D1008-S1011 PolarHBondContact O-N 3.43Å; S1011-Q1013 VanDerWaalsContact C-N 3.27Å; S1011-Q1013 PolarHBondContact O-N 2.96Å; S1011-M1014 CarbonylContact O-C 3.56Å; S1011-M1014 WeakPolarHBondContact O-CA 3.31Å; S1011-M1014 VanDerWaalsContact O-CB 3.3Å; S1011-M1014 WeakPolarHBondContact O-CB 3.31Å; S1011-M1014 PolarHBondContact O-N 3.42Å; S1011-K1015 WeakPolarHBondContact O-CB 3.4Å; S1011-K1015 WeakPolarHBondContact O-CD 3.27Å; S1011-K1015 WeakPolarHBondContact O-CG 3.38Å; S1011-K1015 PolarHBondContact O-N 3.27Å; S1011-K1015 WeakPolarHBondContact OG-CD 3.44Å; S1011-K1015 WeakPolarHBondContact OG-CE 3.46Å; S1011-K1015 PolarHBondContact OG-NZ 3.32Å
1012	R	79.8	Confident	73.5	Confident	80 Å²	80	89.3 Å²	89.3	30%	0.302	43%	0.425	S	S	.	.	H	α-helix	trans	-55.5	-39.7	175.4	-67.5	167.9	-178.7	165.1	-5.4	112.7	D1008 D1009 K1015 L1016 E1030	D1008-R1012 WeakPolarHBondContact O-CG 3.26Å; D1008-R1012 PolarHBondContact O-N 2.86Å; D1009-R1012 PolarHBondContact O-N 2.86Å; D1009-R1012 WeakPolarHBondContact OD1-CD 3.21Å; D1009-R1012 IonicContact OD1-CZ 2.71Å; D1009-R1012 IonicContact OD1-NE 2.74Å; D1009-R1012 IonicContact OD1-NH1 3.93Å; D1009-R1012 PolarHBondContact OD1-NH1 2.9Å; R1012-K1015 PolarHBondContact O-N 3.41Å; R1012-L1016 PolarHBondContact O-N 3.31Å; R1012-E1030 IonicContact CZ-OE1 3.67Å; R1012-E1030 IonicContact NE-OE1 2.73Å; R1012-E1030 IonicContact NH2-OE1 3.03Å; R1012-E1030 PolarHBondContact NH2-OE1 2.91Å; R1012-E1030 IonicContact NH2-OE2 3.59Å; R1012-E1030 PolarHBondContact NH2-OE2 3.36Å
1013	Q	73.4	Confident	73.2	Confident	141 Å²	141	86.9 Å²	86.9	66%	0.659	42%	0.416	S	S	*	.	H	α-helix	trans	-71.7	-38.8	175.4	-162.5	173.3	33.7	0	0	112.7	D1009 K1010 S1011 K1015 L1016 M1017	D1009-Q1013 PolarHBondContact O-N 3.43Å; D1009-Q1013 VanDerWaalsContact O-N 3.09Å; K1010-Q1013 PolarHBondContact O-N 3.46Å; S1011-Q1013 VanDerWaalsContact C-N 3.27Å; S1011-Q1013 PolarHBondContact O-N 2.96Å; Q1013-K1015 VanDerWaalsContact C-N 3.26Å; Q1013-K1015 PolarHBondContact O-N 2.84Å; Q1013-L1016 PolarHBondContact O-N 3.35Å; Q1013-M1017 PolarHBondContact O-N 2.79Å
1014	M	71.3	Confident	72.4	Confident	114 Å²	114	89.3 Å²	89.3	56%	0.562	43%	0.428	S	S	*	.	H	α-helix	trans	-58.2	-40.9	170.2	-176.7	173.3	-71.4	0	0	110.6	K1010 S1011 L1016 M1017 E1018	K1010-M1014 WeakPolarHBondContact O-CB 3.34Å; K1010-M1014 PolarHBondContact O-N 2.88Å; S1011-M1014 CarbonylContact O-C 3.56Å; S1011-M1014 WeakPolarHBondContact O-CA 3.31Å; S1011-M1014 VanDerWaalsContact O-CB 3.3Å; S1011-M1014 WeakPolarHBondContact O-CB 3.31Å; S1011-M1014 PolarHBondContact O-N 3.42Å; M1014-L1016 PolarHBondContact O-N 3.44Å; M1014-M1017 CarbonylContact O-C 3.58Å; M1014-M1017 WeakPolarHBondContact O-CA 3.12Å; M1014-M1017 WeakPolarHBondContact O-CB 3.41Å; M1014-M1017 PolarHBondContact O-N 2.93Å; M1014-E1018 HydrophobicContact CG-CG 4.42Å; M1014-E1018 WeakPolarHBondContact O-CG 3.37Å; M1014-E1018 PolarHBondContact O-N 3.49Å
1015	K	72.5	Confident	72.1	Confident	26 Å²	26	91.6 Å²	91.6	11%	0.113	44%	0.44	C	S	.	.	H	α-helix	trans	-70.5	-24.7	179.7	-79.7	145.2	155.5	175.4	0	114.9	S1011 R1012 Q1013 E1018 N1019 L1028 E1029	S1011-K1015 WeakPolarHBondContact O-CB 3.4Å; S1011-K1015 WeakPolarHBondContact O-CD 3.27Å; S1011-K1015 WeakPolarHBondContact O-CG 3.38Å; S1011-K1015 PolarHBondContact O-N 3.27Å; S1011-K1015 WeakPolarHBondContact OG-CD 3.44Å; S1011-K1015 WeakPolarHBondContact OG-CE 3.46Å; S1011-K1015 PolarHBondContact OG-NZ 3.32Å; R1012-K1015 PolarHBondContact O-N 3.41Å; Q1013-K1015 VanDerWaalsContact C-N 3.26Å; Q1013-K1015 PolarHBondContact O-N 2.84Å; K1015-E1018 WeakPolarHBondContact CA-OE2 3.39Å; K1015-E1018 WeakPolarHBondContact CG-OE2 3.32Å; K1015-N1019 WeakPolarHBondContact O-CB 3.46Å; K1015-N1019 PolarHBondContact O-N 3.11Å; K1015-N1019 PolarHBondContact O-ND2 2.56Å; K1015-L1028 VanDerWaalsContact CB-C 3.45Å; K1015-E1029 VanDerWaalsContact CB-N 3.32Å; K1015-E1029 VanDerWaalsContact CE-CA 3.47Å; K1015-E1029 VanDerWaalsContact CE-CD 3.44Å; K1015-E1029 VanDerWaalsContact CE-N 3.32Å; K1015-E1029 WeakPolarHBondContact CE-OE1 3.15Å; K1015-E1029 WeakPolarHBondContact CE-OE2 3.21Å; K1015-E1029 PolarHBondContact NZ-O 3.48Å; K1015-E1029 IonicContact NZ-OE1 2.74Å; K1015-E1029 PolarHBondContact NZ-OE1 3.46Å; K1015-E1029 IonicContact NZ-OE2 3.51Å
1016	L	73.7	Confident	71.5	Confident	124 Å²	124	94.9 Å²	94.9	65%	0.649	46%	0.459	S	S	*	.	H	α-helix	trans	-75.2	-29.7	166.3	-82.1	166.9	0	0	0	112.9	R1012 Q1013 M1014 N1019 R1020	R1012-L1016 PolarHBondContact O-N 3.31Å; Q1013-L1016 PolarHBondContact O-N 3.35Å; M1014-L1016 PolarHBondContact O-N 3.44Å; L1016-N1019 CarbonylContact O-C 3.59Å; L1016-R1020 PolarHBondContact O-N 2.7Å; L1016-R1020 VanDerWaalsContact O-N 3.12Å
1017	M	69.4	Low	70.9	Confident	127 Å²	127	96.5 Å²	96.5	63%	0.626	47%	0.466	S	S	*	.	H	α-helix	trans	-77.3	-39.2	172.2	-65.1	-68.9	-71	0	0	111.3	Q1013 M1014 R1020 I1021	Q1013-M1017 PolarHBondContact O-N 2.79Å; M1014-M1017 CarbonylContact O-C 3.58Å; M1014-M1017 WeakPolarHBondContact O-CA 3.12Å; M1014-M1017 WeakPolarHBondContact O-CB 3.41Å; M1014-M1017 PolarHBondContact O-N 2.93Å; M1017-R1020 CarbonylContact O-C 3.52Å; M1017-R1020 PolarHBondContact O-N 2.78Å; M1017-I1021 WeakPolarHBondContact O-CG1 3.41Å; M1017-I1021 PolarHBondContact O-N 3.24Å
1018	E	69.4	Low	70.3	Confident	59 Å²	59	95.5 Å²	95.5	28%	0.276	47%	0.466	S	S	.	.	H	α-helix	trans	-54.3	-60.7	167.2	-69	165.7	174.8	0	0	106.6	M1014 K1015 R1020 I1021 A1022 L1028	M1014-E1018 HydrophobicContact CG-CG 4.42Å; M1014-E1018 WeakPolarHBondContact O-CG 3.37Å; M1014-E1018 PolarHBondContact O-N 3.49Å; K1015-E1018 WeakPolarHBondContact CA-OE2 3.39Å; K1015-E1018 WeakPolarHBondContact CG-OE2 3.32Å; E1018-R1020 PolarHBondContact O-N 2.85Å; E1018-I1021 WeakPolarHBondContact O-CB 3.31Å; E1018-I1021 PolarHBondContact O-N 2.71Å; E1018-A1022 VanDerWaalsContact C-CB 3.41Å; E1018-A1022 WeakPolarHBondContact O-CB 3.13Å; E1018-A1022 PolarHBondContact O-N 3.11Å; E1018-A1022 VanDerWaalsContact O-N 3.12Å; E1018-L1028 HydrophobicContact CB-CB 3.44Å; E1018-L1028 VanDerWaalsContact CB-CB 3.44Å; E1018-L1028 HydrophobicContact CB-CD1 3.98Å; E1018-L1028 HydrophobicContact CB-CG 4.33Å; E1018-L1028 HydrophobicContact CG-CB 4.44Å; E1018-L1028 HydrophobicContact CG-CD1 4.29Å; E1018-L1028 WeakPolarHBondContact OE2-CB 3.44Å; E1018-L1028 WeakPolarHBondContact OE2-CD1 3.35Å
1019	N	70.7	Confident	69.5	Low	73 Å²	73	99.8 Å²	99.8	39%	0.39	49%	0.485	S	S	.	.	H	α-helix	trans	-55.3	2.1	169.6	-81.8	-60.9	0	0	0	117.1	K1015 L1016 A1022 L1028	K1015-N1019 WeakPolarHBondContact O-CB 3.46Å; K1015-N1019 PolarHBondContact O-N 3.11Å; K1015-N1019 PolarHBondContact O-ND2 2.56Å; L1016-N1019 CarbonylContact O-C 3.59Å; N1019-A1022 CarbonylContact C-O 3.55Å; N1019-A1022 WeakPolarHBondContact O-CB 3.45Å; N1019-L1028 WeakPolarHBondContact ND2-CA 3.44Å; N1019-L1028 PolarHBondContact ND2-O 3.44Å; N1019-L1028 VanDerWaalsContact OD1-CA 3.28Å; N1019-L1028 WeakPolarHBondContact OD1-CA 3.42Å; N1019-L1028 PolarHBondContact OD1-N 3.44Å
1020	R	73.6	Confident	68.6	Low	152 Å²	152	102.8 Å²	102.8	57%	0.574	50%	0.496	S	S	*	.	H	α-helix	trans	-117.7	-22.9	164.6	-174.3	55.7	176.6	-171.4	2	115.6	L1016 M1017 E1018 A1022 Q1023	L1016-R1020 PolarHBondContact O-N 2.7Å; L1016-R1020 VanDerWaalsContact O-N 3.12Å; M1017-R1020 CarbonylContact O-C 3.52Å; M1017-R1020 PolarHBondContact O-N 2.78Å; E1018-R1020 PolarHBondContact O-N 2.85Å; R1020-A1022 VanDerWaalsContact C-C 3.48Å; R1020-A1022 VanDerWaalsContact C-N 3.3Å; R1020-A1022 CarbonylContact O-C 3.14Å; R1020-Q1023 VanDerWaalsContact C-N 3.31Å; R1020-Q1023 PolarHBondContact O-N 3.16Å
1021	I	69.1	Low	67.4	Low	92 Å²	92	102.2 Å²	102.2	47%	0.472	50%	0.496	S	S	.	.	H	α-helix	trans	-58.7	-56.4	165.2	-74.1	162.3	0	0	0	106.1	M1017 E1018 Q1023 L1024 E1025	M1017-I1021 WeakPolarHBondContact O-CG1 3.41Å; M1017-I1021 PolarHBondContact O-N 3.24Å; E1018-I1021 WeakPolarHBondContact O-CB 3.31Å; E1018-I1021 PolarHBondContact O-N 2.71Å; I1021-Q1023 PolarHBondContact O-N 3.37Å; I1021-L1024 CarbonylContact O-C 3.59Å; I1021-L1024 WeakPolarHBondContact O-CA 3.14Å; I1021-L1024 WeakPolarHBondContact O-CB 3.21Å; I1021-L1024 PolarHBondContact O-N 3.08Å; I1021-E1025 CarbonylContact C-O 3.52Å; I1021-E1025 HydrophobicContact CG2-CG 3.95Å; I1021-E1025 WeakPolarHBondContact CG2-OE2 3.41Å; I1021-E1025 CarbonylContact O-C 3.58Å; I1021-E1025 WeakPolarHBondContact O-CA 3.31Å; I1021-E1025 WeakPolarHBondContact O-CB 3.31Å; I1021-E1025 PolarHBondContact O-N 3.43Å
1022	A	70.6	Confident	65.9	Low	4 Å²	4	108.2 Å²	108.2	3%	0.033	51%	0.514	C	S	.	.	T	Hydrogen-bonded Turn		-23.5	33.1	126.8	0	0	0	0	0	125.8	E1018 N1019 R1020 E1025 L1026 D1027	E1018-A1022 VanDerWaalsContact C-CB 3.41Å; E1018-A1022 WeakPolarHBondContact O-CB 3.13Å; E1018-A1022 PolarHBondContact O-N 3.11Å; E1018-A1022 VanDerWaalsContact O-N 3.12Å; N1019-A1022 CarbonylContact C-O 3.55Å; N1019-A1022 WeakPolarHBondContact O-CB 3.45Å; R1020-A1022 VanDerWaalsContact C-C 3.48Å; R1020-A1022 VanDerWaalsContact C-N 3.3Å; R1020-A1022 CarbonylContact O-C 3.14Å; A1022-E1025 CarbonylContact C-O 3.4Å; A1022-E1025 WeakPolarHBondContact CA-O 3.04Å; A1022-E1025 PolarHBondContact N-O 2.9Å; A1022-L1026 CarbonylContact O-C 3.47Å; A1022-D1027 VanDerWaalsContact C-CA 3.47Å; A1022-D1027 VanDerWaalsContact CA-CB 3.44Å; A1022-D1027 WeakPolarHBondContact CA-O 3.46Å; A1022-D1027 HydrophobicContact CB-CB 3.97Å; A1022-D1027 WeakPolarHBondContact CB-O 3.28Å; A1022-D1027 VanDerWaalsContact O-CA 3.29Å; A1022-D1027 WeakPolarHBondContact O-CA 3.25Å; A1022-D1027 PolarHBondContact O-N 2.87Å
1023	Q	69.6	Low	64.4	Low	105 Å²	105	114.6 Å²	114.6	49%	0.491	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-147.1	-9.9	139.3	-171.5	60.7	99.7	0	0	110.1	R1020 I1021 E1025 L1026	R1020-Q1023 VanDerWaalsContact C-N 3.31Å; R1020-Q1023 PolarHBondContact O-N 3.16Å; I1021-Q1023 PolarHBondContact O-N 3.37Å; Q1023-E1025 CarbonylContact C-O 3.59Å; Q1023-E1025 WeakPolarHBondContact CA-O 3.13Å; Q1023-E1025 PolarHBondContact N-O 2.73Å; Q1023-L1026 VanDerWaalsContact CA-C 3.46Å; Q1023-L1026 VanDerWaalsContact NE2-C 3.31Å; Q1023-L1026 VanDerWaalsContact NE2-CA 3.27Å; Q1023-L1026 PolarHBondContact NE2-O 2.63Å; Q1023-L1026 PolarHBondContact O-N 3.27Å
1024	L	61	Low	63.3	Low	150 Å²	150	116.8 Å²	116.8	79%	0.785	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.6	-53.4	172.8	-56.8	169.1	0	0	0	111.1	I1021 L1026	I1021-L1024 CarbonylContact O-C 3.59Å; I1021-L1024 WeakPolarHBondContact O-CA 3.14Å; I1021-L1024 WeakPolarHBondContact O-CB 3.21Å; I1021-L1024 PolarHBondContact O-N 3.08Å; L1024-L1026 VanDerWaalsContact C-N 3.27Å; L1024-L1026 PolarHBondContact O-N 2.75Å
1025	E	67.5	Low	61.8	Low	125 Å²	125	118.6 Å²	118.6	58%	0.584	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn		-63.1	96.8	123.8	-36.4	-178.4	152.1	0	0	104	I1021 A1022 Q1023 D1027	I1021-E1025 CarbonylContact C-O 3.52Å; I1021-E1025 HydrophobicContact CG2-CG 3.95Å; I1021-E1025 WeakPolarHBondContact CG2-OE2 3.41Å; I1021-E1025 CarbonylContact O-C 3.58Å; I1021-E1025 WeakPolarHBondContact O-CA 3.31Å; I1021-E1025 WeakPolarHBondContact O-CB 3.31Å; I1021-E1025 PolarHBondContact O-N 3.43Å; A1022-E1025 CarbonylContact C-O 3.4Å; A1022-E1025 WeakPolarHBondContact CA-O 3.04Å; A1022-E1025 PolarHBondContact N-O 2.9Å; Q1023-E1025 CarbonylContact C-O 3.59Å; Q1023-E1025 WeakPolarHBondContact CA-O 3.13Å; Q1023-E1025 PolarHBondContact N-O 2.73Å; E1025-D1027 WeakPolarHBondContact CA-OD2 3.42Å; E1025-D1027 HydrophobicContact CB-CB 4.2Å; E1025-D1027 WeakPolarHBondContact CB-OD2 3.15Å; E1025-D1027 WeakPolarHBondContact O-CB 3.3Å; E1025-D1027 PolarHBondContact O-N 2.79Å
1026	L	65.8	Low	60.1	Low	134 Å²	134	127.1 Å²	127.1	70%	0.702	67%	0.672	S	S	*	*	S	Bend	trans	25.3	0	141.7	155.3	-57.2	0	0	0	127.4	A1022 Q1023 L1024	A1022-L1026 CarbonylContact O-C 3.47Å; Q1023-L1026 VanDerWaalsContact CA-C 3.46Å; Q1023-L1026 VanDerWaalsContact NE2-C 3.31Å; Q1023-L1026 VanDerWaalsContact NE2-CA 3.27Å; Q1023-L1026 PolarHBondContact NE2-O 2.63Å; Q1023-L1026 PolarHBondContact O-N 3.27Å; L1024-L1026 VanDerWaalsContact C-N 3.27Å; L1024-L1026 PolarHBondContact O-N 2.75Å
1027	D	62.7	Low	59.5	Low	96 Å²	96	132.4 Å²	132.4	51%	0.513	69%	0.694	S	S	.	*				0	0	0	-32.8	-51.3	0	0	0	150.5	A1022 E1025	A1022-D1027 VanDerWaalsContact C-CA 3.47Å; A1022-D1027 VanDerWaalsContact CA-CB 3.44Å; A1022-D1027 WeakPolarHBondContact CA-O 3.46Å; A1022-D1027 HydrophobicContact CB-CB 3.97Å; A1022-D1027 WeakPolarHBondContact CB-O 3.28Å; A1022-D1027 VanDerWaalsContact O-CA 3.29Å; A1022-D1027 WeakPolarHBondContact O-CA 3.25Å; A1022-D1027 PolarHBondContact O-N 2.87Å; E1025-D1027 WeakPolarHBondContact CA-OD2 3.42Å; E1025-D1027 HydrophobicContact CB-CB 4.2Å; E1025-D1027 WeakPolarHBondContact CB-OD2 3.15Å; E1025-D1027 WeakPolarHBondContact O-CB 3.3Å; E1025-D1027 PolarHBondContact O-N 2.79Å
1028	L	59.4	Low	57.2	Low	119 Å²	119	137.7 Å²	137.7	62%	0.623	72%	0.723	S	S	*	*				0	0	0	-98.8	162.5	0	0	0	161.9	K1015 E1018 N1019	K1015-L1028 VanDerWaalsContact CB-C 3.45Å; E1018-L1028 HydrophobicContact CB-CB 3.44Å; E1018-L1028 VanDerWaalsContact CB-CB 3.44Å; E1018-L1028 HydrophobicContact CB-CD1 3.98Å; E1018-L1028 HydrophobicContact CB-CG 4.33Å; E1018-L1028 HydrophobicContact CG-CB 4.44Å; E1018-L1028 HydrophobicContact CG-CD1 4.29Å; E1018-L1028 WeakPolarHBondContact OE2-CB 3.44Å; E1018-L1028 WeakPolarHBondContact OE2-CD1 3.35Å; N1019-L1028 WeakPolarHBondContact ND2-CA 3.44Å; N1019-L1028 PolarHBondContact ND2-O 3.44Å; N1019-L1028 VanDerWaalsContact OD1-CA 3.28Å; N1019-L1028 WeakPolarHBondContact OD1-CA 3.42Å; N1019-L1028 PolarHBondContact OD1-N 3.44Å
1029	E	58.8	Low	54.9	Low	130 Å²	130	146.5 Å²	146.5	61%	0.607	77%	0.767	S	S	*	*				0	0	0	49.6	32.2	54.7	0	0	164.1	K1015	K1015-E1029 VanDerWaalsContact CB-N 3.32Å; K1015-E1029 VanDerWaalsContact CE-CA 3.47Å; K1015-E1029 VanDerWaalsContact CE-CD 3.44Å; K1015-E1029 VanDerWaalsContact CE-N 3.32Å; K1015-E1029 WeakPolarHBondContact CE-OE1 3.15Å; K1015-E1029 WeakPolarHBondContact CE-OE2 3.21Å; K1015-E1029 PolarHBondContact NZ-O 3.48Å; K1015-E1029 IonicContact NZ-OE1 2.74Å; K1015-E1029 PolarHBondContact NZ-OE1 3.46Å; K1015-E1029 IonicContact NZ-OE2 3.51Å
1030	E	56.6	Low	53.7	Low	138 Å²	138	151.5 Å²	151.5	65%	0.645	79%	0.794	S	S	*	*				0	0	0	-49.5	-30.8	101.5	0	0	163.9	Q1005 D1008 R1012	Q1005-E1030 PolarHBondContact OE1-O 3.12Å; D1008-E1030 VanDerWaalsContact OD2-CA 3.29Å; D1008-E1030 WeakPolarHBondContact OD2-CA 3.47Å; R1012-E1030 IonicContact CZ-OE1 3.67Å; R1012-E1030 IonicContact NE-OE1 2.73Å; R1012-E1030 IonicContact NH2-OE1 3.03Å; R1012-E1030 PolarHBondContact NH2-OE1 2.91Å; R1012-E1030 IonicContact NH2-OE2 3.59Å; R1012-E1030 PolarHBondContact NH2-OE2 3.36Å
1031	E	49.8	Very low	53.2	Low	126 Å²	126	155.1 Å²	155.1	59%	0.589	81%	0.808	S	S	*	*				0	0	0	64.9	57.2	72.3	0	0	163.3	E1001 K1004	E1001-E1031 WeakPolarHBondContact CG-O 3.3Å; K1004-E1031 IonicContact NZ-OE2 3.91Å; K1004-E1031 PolarHBondContact NZ-OE2 2.78Å
1032	R	39.1	Very low	52.7	Low	157 Å²	157	162 Å²	162	59%	0.592	84%	0.843	S	S	*	*				0	0	0	-46.2	-60.5	155.3	-97.5	-11.5	162.4	M998 E1001	M998-R1032 HydrophobicContact CE-CB 4.05Å; M998-R1032 HydrophobicContact SD-CB 3.3Å; M998-R1032 WeakPolarHBondContact SD-CB 3.4Å; M998-R1032 HydrophobicContact SD-CG 3.99Å; E1001-R1032 HydrophobicContact CB-CG 4.33Å; E1001-R1032 HydrophobicContact CG-CG 3.84Å; E1001-R1032 IonicContact OE1-CZ 2.71Å; E1001-R1032 IonicContact OE1-NH2 2.76Å; E1001-R1032 PolarHBondContact OE1-NH2 3.36Å; E1001-R1032 IonicContact OE2-CZ 3.65Å; E1001-R1032 IonicContact OE2-NE 3.6Å; E1001-R1032 PolarHBondContact OE2-NE 3.49Å; E1001-R1032 IonicContact OE2-NH2 3.12Å; E1001-R1032 PolarHBondContact OE2-NH2 2.98Å
1033	Q	47.5	Very low	52	Low	215 Å²	215	171.2 Å²	171.2	100%	1.005	89%	0.892	S	S	*	*				0	0	0	-100.2	55.5	-114.2	0	0	162.6
1034	S	50.7	Low	51.5	Low	187 Å²	187	177.8 Å²	177.8	100%	1.308	91%	0.912	S	S	*	*				0	0	0	-43.5	0	0	0	0	164.8
1035	G	39.7	Very low	51.5	Low	151 Å²	151	177.8 Å²	177.8	100%	1.557	95%	0.949	S	S	*	*				0	0	0	0	0	0	0	0	162.8
1036	D	37.1	Very low	51	Low	205 Å²	205	183.1 Å²	183.1	100%	1.096	96%	0.963	S	S	*	*				0	0	0	163.1	126.9	0	0	0	162.4
1037	Q	62	Low	50.3	Low	236 Å²	236	186.5 Å²	186.5	100%	1.103	98%	0.975	S	S	*	*				0	0	0	-61.1	143	103.1	0	0	162.5
1038	L	20.9	Very low	49.6	Very low	237 Å²	237	193.5 Å²	193.5	100%	1.241	100%	1.005	S	S	*	*				0	0	0	-101.4	-170.5	0	0	0	164.6
1039	M	20	Very low	48.9	Very low	244 Å²	244	198 Å²	198	100%	1.202	100%	1.028	S	S	*	*				0	0	0	-158.5	47.8	177.1	0	0	163
1040	D	45.2	Very low	48.8	Very low	179 Å²	179	199.9 Å²	199.9	96%	0.957	100%	1.042	S	S	*	*				0	0	0	158.3	122.7	0	0	0	161.8
1041	R	64.9	Low	48.2	Very low	228 Å²	228	202.9 Å²	202.9	86%	0.86	100%	1.056	S	S	*	*				0	0	0	-56.6	-38.3	101.1	-111.9	170.1	162.8
1042	I	58.7	Low	48	Very low	235 Å²	235	205.5 Å²	205.5	100%	1.205	100%	1.073	S	S	*	*				0	0	0	-141.3	162	0	0	0	162.8
1043	D	55.8	Low	48.1	Very low	198 Å²	198	210.2 Å²	210.2	100%	1.059	100%	1.091	S	S	*	*				0	0	0	-169.9	57.6	0	0	0	162.8
1044	R	59.2	Low	47.9	Very low	243 Å²	243	203.9 Å²	203.9	92%	0.917	100%	1.083	S	S	*	*				0	0	0	-55.4	-74.2	52.8	97.7	178	162.4
1045	G	59.1	Low	47.3	Very low	151 Å²	151	204.3 Å²	204.3	100%	1.557	100%	1.062	S	S	*	*				0	0	0	0	0	0	0	0	162.7
1046	R	57.8	Low	47	Very low	237 Å²	237	203.6 Å²	203.6	89%	0.894	100%	1.027	S	S	*	*				0	0	0	132.5	-54.5	169.1	-114.9	-5.1	162.4
1047	E	52.2	Low	47	Very low	204 Å²	204	201.5 Å²	201.5	95%	0.953	100%	1.014	S	S	*	*				0	0	0	-118.5	71.3	-82.8	0	0	162.4
1048	Q	46.7	Very low	45.6	Very low	243 Å²	243	194 Å²	194	100%	1.136	99%	0.993	S	S	*	*				0	0	0	-86.1	-66.5	-10.8	0	0	162.6
1049	L	45.4	Very low	46	Very low	213 Å²	213	191 Å²	191	100%	1.115	97%	0.973	S	S	*	*				0	0	0	-156.8	146.7	0	0	0	158.8
1050	L	56.7	Low	46.3	Very low	171 Å²	171	187.9 Å²	187.9	90%	0.895	95%	0.948	S	S	*	*				0	0	0	-145.8	-173.7	0	0	0	147.6
1051	Q	42.9	Very low	45.6	Very low	200 Å²	200	187.6 Å²	187.6	94%	0.935	93%	0.933	S	S	*	*				0	12.3	0	-132.6	-177.5	38.7	0	0	131.5
1052	L	47.4	Very low	43.7	Very low	182 Å²	182	183 Å²	183	95%	0.953	92%	0.921	S	S	*	*			trans	-127.5	30	-158.1	-108.7	165.2	0	0	0	121.4
1053	R	40.4	Very low	42.3	Very low	256 Å²	256	181.9 Å²	181.9	97%	0.966	90%	0.902	S	S	*	*	S	Bend	trans	-148.2	84.3	-175.2	-168.9	-176.9	-176.4	-159.9	1.5	114.2
1054	G	42.8	Very low	41	Very low	81 Å²	81	179.8 Å²	179.8	84%	0.835	89%	0.886	S	S	*	*	S	Bend	trans	170.7	12.6	178	0	0	0	0	0	119.2
1055	K	37.3	Very low	39.8	Very low	197 Å²	197	173.1 Å²	173.1	86%	0.857	88%	0.875	S	S	*	*			trans	-133.1	133	174.3	-78.7	-173.1	174.9	-177.4	0	110.1
1056	V	34.5	Very low	38.5	Very low	136 Å²	136	172.9 Å²	172.9	82%	0.824	84%	0.838	S	S	*	*			trans	68.5	128.1	162.9	178.2	0	0	0	0	113.4
1057	L	38	Very low	37.2	Very low	160 Å²	160	170.5 Å²	170.5	84%	0.838	83%	0.834	S	S	*	*			cis	-119.8	157.2	12.1	-63.1	154.6	0	0	0	110.1
1058	A	31.1	Very low	36.6	Very low	80 Å²	80	167.2 Å²	167.2	66%	0.661	83%	0.828	S	S	*	*			cis	97.9	132.6	19.9	0	0	0	0	0	116.1
1059	Q	29.2	Very low	36.4	Very low	173 Å²	173	161.3 Å²	161.3	81%	0.808	81%	0.81	S	S	*	*			trans	73.8	155.2	178.5	-46.5	-165.1	17.3	0	0	115.9
1060	R	28	Very low	35.8	Very low	179 Å²	179	159 Å²	159	68%	0.675	80%	0.798	S	S	*	*			cis	-161.5	137.8	12.1	-146.7	175.9	-171.1	-122	6.6	112.6
1061	R	29.4	Very low	34.7	Very low	173 Å²	173	155.6 Å²	155.6	65%	0.653	78%	0.784	S	S	*	*			trans	57.1	162.8	147.1	-72.9	173.1	177.5	-139.3	5.9	119.9
1062	E	25.6	Very low	34.6	Very low	131 Å²	131	152.8 Å²	152.8	61%	0.612	77%	0.771	S	S	*	*			cis	-150.6	172.4	-12	-128.4	139.4	-152.1	0	0	111.6
1063	W	28.3	Very low	33.9	Very low	212 Å²	212	150.8 Å²	150.8	80%	0.803	76%	0.757	S	S	*	*			trans	-49.5	152.7	-179.1	-57.3	50.5	0	0	0	115.4
1064	H	29.4	Very low	33.9	Very low	153 Å²	153	145.5 Å²	145.5	71%	0.708	74%	0.743	S	S	*	*				-176.7	150.7	68	-114.1	-70.1	0	0	0	115.5
1065	C	33.7	Very low	33.7	Very low	104 Å²	104	145.3 Å²	145.3	70%	0.703	73%	0.734	S	S	*	*			trans	19.5	145.3	151.9	-59.3	0	0	0	0	126
1066	D	31	Very low	33.6	Very low	146 Å²	146	144 Å²	144	78%	0.781	73%	0.731	S	S	*	*			trans	-46.4	142.6	157.8	-50.3	-83.7	0	0	0	114.2
1067	K	31.7	Very low	33.7	Very low	187 Å²	187	143.5 Å²	143.5	81%	0.813	72%	0.722	S	S	*	*				75.9	126.5	55.1	-97.1	-172.4	177.9	-179.7	0	116
1068	V	38.3	Very low	33.8	Very low	134 Å²	134	145 Å²	145	81%	0.812	72%	0.722	S	S	*	*			trans	72.8	137.6	161.6	175.5	0	0	0	0	113.9
1069	P	42.8	Very low	34.1	Very low	119 Å²	119	149.5 Å²	149.5	77%	0.773	73%	0.729	S	S	*	*			cis	-123	163.8	25.7	14.8	10.9	0	0	0	118.7
1070	L	32.4	Very low	34.5	Very low	164 Å²	164	149 Å²	149	86%	0.859	73%	0.727	S	S	*	*			trans	-89.1	168.5	156.5	-59.3	155	0	0	0	107.6
1071	V	34.7	Very low	34.7	Very low	100 Å²	100	146.8 Å²	146.8	61%	0.606	73%	0.727	S	S	*	*			cis	-163.7	146.3	12.5	85.7	0	0	0	0	110.5
1072	Q	40.5	Very low	34.7	Very low	141 Å²	141	145.6 Å²	145.6	66%	0.659	73%	0.732	S	S	*	*			trans	50.4	175.2	152.2	-74.7	157.6	-31.9	0	0	120.7
1073	H	33.5	Very low	35.1	Very low	140 Å²	140	143 Å²	143	65%	0.648	72%	0.722	S	S	*	*			cis	-126.3	119.3	-15.5	-128.8	-91.2	0	0	0	103.6
1074	E	39.1	Very low	35	Very low	145 Å²	145	139.9 Å²	139.9	68%	0.678	71%	0.711	S	S	*	*				90.1	151.6	62.1	-177.3	178.1	123.6	0	0	112.4
1075	A	38.4	Very low	35	Very low	77 Å²	77	137.3 Å²	137.3	64%	0.636	70%	0.703	S	S	*	*			trans	63.4	138.8	-177.3	0	0	0	0	0	116.7
1076	E	35.9	Very low	34.8	Very low	170 Å²	170	138.8 Å²	138.8	79%	0.794	70%	0.703	S	S	*	*			cis	-151.9	115.9	-17.4	-120.6	145.8	-142.9	0	0	106.6
1077	I	36.6	Very low	34.8	Very low	126 Å²	126	137.5 Å²	137.5	65%	0.646	70%	0.7	S	S	*	*				56.5	98.2	93.5	-62.2	-179.6	0	0	0	113.6
1078	K	40.3	Very low	34.7	Very low	190 Å²	190	135.7 Å²	135.7	83%	0.826	70%	0.7	S	S	*	*			trans	60.2	150.9	141.2	-52.7	166.9	-160.3	160.2	0	116.6
1079	E	38.1	Very low	34.2	Very low	175 Å²	175	132.1 Å²	132.1	82%	0.818	68%	0.68	S	S	*	*			cis	-145.7	122.9	25.2	-158.8	165.7	-164	0	0	107.4
1080	H	36.3	Very low	33.5	Very low	163 Å²	163	129.9 Å²	129.9	76%	0.755	66%	0.656	S	S	*	*				58.7	124.9	79	-132.9	-111.7	0	0	0	114.5
1081	I	31.9	Very low	33.5	Very low	132 Å²	132	123.9 Å²	123.9	68%	0.677	63%	0.625	S	S	*	*			trans	72.6	102.7	167.6	-59.2	162.9	0	0	0	114.7
1082	L	30.7	Very low	33.8	Very low	148 Å²	148	122.8 Å²	122.8	78%	0.775	62%	0.616	S	S	*	*			cis	89.6	148.1	48	-170.9	87.4	0	0	0	113.5
1083	I	32.9	Very low	33.7	Very low	76 Å²	76	122 Å²	122	39%	0.39	61%	0.61	S	S	.	*			trans	85.9	117.8	163	-26.9	168.8	0	0	0	118.3
1084	Y	27.6	Very low	34.4	Very low	148 Å²	148	119.9 Å²	119.9	58%	0.58	60%	0.601	S	S	*	*			trans	72.5	145.7	143.6	-92.1	-154.9	0	0	0	121.2	V417	V417-Y1084 HydrophobicContact CG1-CE2 4.48Å; V417-Y1084 WeakPolarHBondContact CG1-OH 3.43Å; V417-Y1084 HydrophobicContact CG2-CE2 4.13Å; V417-Y1084 WeakPolarHBondContact CG2-OH 3.48Å
1085	N	27.8	Very low	34.4	Very low	99 Å²	99	116.4 Å²	116.4	53%	0.529	59%	0.592	S	S	.	*			cis	-168	153.4	-14.7	-136.6	16.9	0	0	0	114.3
1086	L	31	Very low	33.5	Very low	135 Å²	135	118.8 Å²	118.8	71%	0.707	60%	0.599	S	S	*	*			trans	62	133.5	139.5	-125.5	73.5	0	0	0	125.1
1087	T	30.7	Very low	32.2	Very low	118 Å²	118	115.5 Å²	115.5	72%	0.724	59%	0.587	S	S	*	*			trans	70.2	0	145.4	38.1	0	0	0	0	124.1
1088	N	30.3	Very low	30.6	Very low	150 Å²	150	115.2 Å²	115.2	80%	0.802	59%	0.591	S	S	*	*				0	0	0	-123.4	-11.6	0	0	0	124.8
1089	C	27.3	Very low	28.8	Very low	58 Å²	58	112.3 Å²	112.3	39%	0.392	58%	0.582	S	S	.	*				0	0	0	65.4	0	0	0	0	129.8	F637	F637-C1089 VanDerWaalsContact CD2-C 3.46Å; F637-C1089 PolarHBondContact N-O 3.21Å
1090	Y	28.1	Very low	27.1	Very low	72 Å²	72	107.7 Å²	107.7	28%	0.282	56%	0.563	S	S	.	*				0	0	0	-114.8	-125.4	0	0	0	122.5	L636 F637 Q638 V639 K640 M641 E644	L636-Y1090 CarbonylContact C-O 3.52Å; F637-Y1090 CarbonylContact C-O 3.6Å; F637-Y1090 WeakPolarHBondContact CA-O 3.28Å; F637-Y1090 HydrophobicContact CE2-CG 4.43Å; F637-Y1090 VanDerWaalsContact N-C 3.3Å; F637-Y1090 PolarHBondContact N-O 3.37Å; F637-Y1090 CarbonylContact O-C 3.56Å; Q638-Y1090 PolarHBondContact N-O 2.85Å; V639-Y1090 PolarHBondContact N-O 3.46Å; K640-Y1090 VanDerWaalsContact CA-C 3.42Å; K640-Y1090 WeakPolarHBondContact CA-O 3.23Å; K640-Y1090 HydrophobicContact CD-CD2 3.69Å; K640-Y1090 HydrophobicContact CD-CE2 3.74Å; K640-Y1090 HydrophobicContact CD-CG 4.32Å; K640-Y1090 PolarHBondContact N-O 3.15Å; K640-Y1090 PolarHBondContact NZ-OH 3.5Å; M641-Y1090 HydrophobicContact CB-CD1 3.53Å; M641-Y1090 HydrophobicContact CB-CE1 4Å; M641-Y1090 HydrophobicContact CB-CG 4.3Å; M641-Y1090 HydrophobicContact CG-CD1 3.65Å; M641-Y1090 HydrophobicContact CG-CE1 3.67Å; M641-Y1090 HydrophobicContact SD-CD1 3.67Å; M641-Y1090 HydrophobicContact SD-CE1 3.8Å; E644-Y1090 WeakPolarHBondContact OE2-CE1 3.41Å; E644-Y1090 PolarHBondContact OE2-OH 2.95Å
1091	L	31.8	Very low	26.1	Very low	39 Å²	39	105.7 Å²	105.7	20%	0.204	56%	0.557	C	S	.	*				0	0	0	-69.9	-152.7	0	0	0	133.4	F637 Q638 V639 K640 M641 E642	F637-L1091 HydrophobicContact CE1-CD2 4.08Å; F637-L1091 VanDerWaalsContact O-CA 3.23Å; F637-L1091 WeakPolarHBondContact O-CA 2.99Å; F637-L1091 WeakPolarHBondContact O-CB 2.98Å; F637-L1091 PolarHBondContact O-N 3.39Å; Q638-L1091 CarbonylContact C-O 3.52Å; Q638-L1091 VanDerWaalsContact CA-CA 3.5Å; V639-L1091 CarbonylContact C-O 3.58Å; V639-L1091 WeakPolarHBondContact CA-O 3.13Å; V639-L1091 PolarHBondContact N-O 2.9Å; V639-L1091 VanDerWaalsContact N-O 3.16Å; K640-L1091 CarbonylContact C-O 3.57Å; K640-L1091 PolarHBondContact N-O 3.2Å; M641-L1091 HydrophobicContact CB-CB 4.27Å; M641-L1091 HydrophobicContact CB-CD2 3.64Å; M641-L1091 HydrophobicContact CB-CG 3.75Å; M641-L1091 VanDerWaalsContact CB-N 3.3Å; M641-L1091 HydrophobicContact CE-CD1 4.46Å; M641-L1091 HydrophobicContact CE-CD2 3.64Å; M641-L1091 HydrophobicContact CE-CG 4.05Å; M641-L1091 HydrophobicContact CG-CD2 4.22Å; M641-L1091 VanDerWaalsContact N-C 3.31Å; M641-L1091 PolarHBondContact N-O 3.24Å; M641-L1091 HydrophobicContact SD-CD2 3.63Å; M641-L1091 HydrophobicContact SD-CG 4.46Å; E642-L1091 WeakPolarHBondContact CA-O 3.06Å; E642-L1091 PolarHBondContact N-O 2.8Å
1092	N	41.3	Very low	25.1	Very low	76 Å²	76	103.8 Å²	103.8	41%	0.406	55%	0.545	S	S	.	.				0	90.2	0	-110.5	95.8	0	0	0	134.4	Q638 E642	Q638-N1092 HydrophobicContact CB-CB 3.98Å; Q638-N1092 HydrophobicContact CG-CB 3.52Å; Q638-N1092 PolarHBondContact NE2-OD1 3.08Å; Q638-N1092 WeakPolarHBondContact O-CA 3.31Å; Q638-N1092 WeakPolarHBondContact O-CB 3.25Å; E642-N1092 VanDerWaalsContact CA-O 3.3Å; E642-N1092 WeakPolarHBondContact CA-O 3.45Å; E642-N1092 WeakPolarHBondContact CB-O 3.13Å; E642-N1092 VanDerWaalsContact N-N 3.17Å; E642-N1092 WeakPolarHBondContact OE1-CA 3.11Å; E642-N1092 PolarHBondContact OE1-N 2.83Å; E642-N1092 PolarHBondContact OE1-OD1 3.42Å
1093	F	38.5	Very low	25.9	Very low	125 Å²	125	99.6 Å²	99.6	55%	0.548	53%	0.525	S	S	.	.			trans	-168.3	-152.3	161.5	-153.9	55.4	0	0	0	120.6	E642	E642-F1093 HydrophobicContact CB-CB 3.7Å; E642-F1093 HydrophobicContact CG-CB 4.4Å; E642-F1093 PolarHBondContact OE1-N 3.12Å; E642-F1093 VanDerWaalsContact OE2-CA 3.29Å; E642-F1093 WeakPolarHBondContact OE2-CA 3.26Å; E642-F1093 PolarHBondContact OE2-N 2.93Å
1094	E	47.3	Very low	26.4	Very low	96 Å²	96	103.2 Å²	103.2	45%	0.449	55%	0.546	S	S	.	.			trans	-157.8	-178.2	179.2	-143.8	-158.6	-35.5	0	0	111.2	R1157	E1094-R1157 IonicContact OE2-NH1 2.65Å; E1094-R1157 PolarHBondContact OE2-NH1 3.09Å; E1094-R1157 VanDerWaalsContact OE2-NH1 3.08Å
1095	S	40.3	Very low	26.4	Very low	71 Å²	71	100.8 Å²	100.8	50%	0.497	54%	0.542	S	S	.	.			cis	-169.9	161.3	-4.6	-153.5	0	0	0	0	113.3
1096	T	17.9	Very low	26.9	Very low	127 Å²	127	100.7 Å²	100.7	78%	0.779	54%	0.541	S	S	*	.			trans	-168.7	165.7	172.1	-164.5	0	0	0	0	118.8
1097	L	9	Very low	27.1	Very low	102 Å²	102	102.4 Å²	102.4	53%	0.534	55%	0.545	S	S	.	.			trans	-169.3	154.5	174.4	-133.7	-61.4	0	0	0	117
1098	T	2.7	Very low	27.8	Very low	119 Å²	119	105.3 Å²	105.3	73%	0.73	55%	0.548	S	S	*	.			trans	-156	168.1	175.1	55.3	0	0	0	0	116.5
1099	M	2.8	Very low	28.7	Very low	130 Å²	130	102.4 Å²	102.4	64%	0.64	53%	0.532	S	S	*	.			trans	-171.9	169.5	177.4	-120.7	-64.4	-67.5	0	0	117.1	E1143	M1099-E1143 HydrophobicContact CE-CG 3.83Å; M1099-E1143 VanDerWaalsContact CE-OE1 3.26Å; M1099-E1143 WeakPolarHBondContact CE-OE1 3.36Å
1100	N	2.6	Very low	29.6	Very low	78 Å²	78	104 Å²	104	42%	0.417	53%	0.534	S	S	.	.			trans	137.6	163.9	154.1	-177.1	-123.8	0	0	0	119	I1140 E1143	N1100-I1140 WeakPolarHBondContact ND2-CG2 3.47Å; N1100-E1143 WeakPolarHBondContact CA-OE2 3.44Å; N1100-E1143 PolarHBondContact ND2-OE2 3.24Å
1101	L	15.5	Very low	30.5	Very low	120 Å²	120	106.7 Å²	106.7	63%	0.628	54%	0.544	S	S	*	.			trans	172	-156.5	159.1	162.4	-32.5	0	0	0	114.3
1102	E	10.9	Very low	31.6	Very low	92 Å²	92	107.1 Å²	107.1	43%	0.43	56%	0.557	S	S	.	*			trans	132	151.6	-177.1	-83.3	-127	28.7	0	0	118.5	R1132 M1136	E1102-R1132 IonicContact OE1-CZ 2.95Å; E1102-R1132 IonicContact OE1-NE 4Å; E1102-R1132 PolarHBondContact OE1-NE 2.69Å; E1102-R1132 IonicContact OE1-NH2 2.82Å; E1102-R1132 PolarHBondContact OE1-NH2 2.95Å; E1102-R1132 IonicContact OE2-CZ 3.19Å; E1102-R1132 IonicContact OE2-NE 3Å; E1102-R1132 IonicContact OE2-NH2 3.69Å; E1102-R1132 PolarHBondContact OE2-NH2 2.93Å; E1102-M1136 HydrophobicContact CB-CG 4.46Å
1103	V	47.6	Very low	32.2	Very low	60 Å²	60	106.6 Å²	106.6	36%	0.364	56%	0.564	S	S	.	*			trans	145.4	-157.9	162.5	157.7	0	0	0	0	117.2	V1133 M1136	V1103-V1133 HydrophobicContact CG2-CG2 4.35Å; V1103-M1136 HydrophobicContact CB-CE 4.27Å; V1103-M1136 HydrophobicContact CG2-CG 4.44Å
1104	N	43.1	Very low	33.2	Very low	153 Å²	153	106.4 Å²	106.4	82%	0.818	56%	0.563	S	S	*	*			trans	153.1	-152.1	171.5	-179.1	-18.5	0	0	0	113.3
1105	L	29.1	Very low	33.6	Very low	97 Å²	97	104 Å²	104	51%	0.508	55%	0.552	S	S	.	*			trans	162.2	-164.6	-168.1	-65	162.6	0	0	0	114.4	L1129	L1105-L1129 HydrophobicContact CD1-CD1 4.24Å; L1105-L1129 HydrophobicContact CD2-CD1 3.81Å; L1105-L1129 HydrophobicContact CG-CD1 4.08Å
1106	L	38.1	Very low	34.6	Very low	97 Å²	97	105.4 Å²	105.4	51%	0.508	56%	0.561	S	S	.	*			trans	-123	-64.6	178.8	-135.3	174.1	0	0	0	113.8	L1122	L1106-L1122 HydrophobicContact CD1-CD2 3.86Å
1107	H	33.7	Very low	37.1	Very low	170 Å²	170	108 Å²	108	79%	0.787	56%	0.557	S	S	*	*	S	Bend	cis	37.6	-129.6	-28.6	-49	161.5	0	0	0	116.5
1108	K	46.5	Very low	40	Very low	179 Å²	179	104.2 Å²	104.2	78%	0.778	54%	0.536	S	S	*	.			cis	147.6	-168.6	-21.6	-46.5	82	166.3	177.9	0	111.2
1109	N	49.3	Very low	43.3	Very low	89 Å²	89	102.9 Å²	102.9	48%	0.476	52%	0.521	S	S	.	.			trans	-163.8	178.9	179.3	-174.6	33.1	0	0	0	112.6
1110	E	45.9	Very low	46.5	Very low	92 Å²	92	99.3 Å²	99.3	43%	0.43	51%	0.509	S	S	.	.			trans	84.4	109.3	150.9	-141	77.8	148.8	0	0	120.9	E1115 K1119	E1110-E1115 HydrophobicContact CG-CG 4.48Å; E1110-K1119 WeakPolarHBondContact OE1-CE 3.39Å; E1110-K1119 IonicContact OE1-NZ 2.7Å; E1110-K1119 PolarHBondContact OE1-NZ 2.74Å; E1110-K1119 WeakPolarHBondContact OE2-CE 3.37Å; E1110-K1119 IonicContact OE2-NZ 2.64Å; E1110-K1119 PolarHBondContact OE2-NZ 2.75Å
1111	R	47.3	Very low	50	Low	128 Å²	128	100.1 Å²	100.1	48%	0.483	51%	0.513	S	S	.	.			trans	-160.8	83.4	-178.8	-64.8	92.3	81.7	87.9	-0.4	118.1	F1114 E1115 E1118	R1111-F1114 HydrophobicContact CB-CD1 3.8Å; R1111-F1114 HydrophobicContact CB-CE1 3.87Å; R1111-F1114 HydrophobicContact CG-CE1 4.27Å; R1111-F1114 CarbonylContact O-C 3.36Å; R1111-F1114 WeakPolarHBondContact O-CA 3.37Å; R1111-F1114 WeakPolarHBondContact O-CD1 3.26Å; R1111-E1115 VanDerWaalsContact N-CG 3.32Å; R1111-E1115 PolarHBondContact O-N 2.99Å; R1111-E1118 IonicContact CZ-OE1 2.72Å; R1111-E1118 IonicContact CZ-OE2 3.16Å; R1111-E1118 IonicContact NE-OE1 3.42Å; R1111-E1118 IonicContact NE-OE2 3.83Å; R1111-E1118 PolarHBondContact NE-OE2 2.9Å; R1111-E1118 VanDerWaalsContact NH2-CD 3.33Å; R1111-E1118 IonicContact NH2-OE1 3.3Å; R1111-E1118 PolarHBondContact NH2-OE1 3.21Å; R1111-E1118 VanDerWaalsContact NH2-OE1 3.16Å; R1111-E1118 IonicContact NH2-OE2 2.66Å; R1111-E1118 PolarHBondContact NH2-OE2 3.2Å
1112	G	55	Low	52.8	Low	48 Å²	48	95.8 Å²	95.8	50%	0.495	49%	0.49	S	S	.	.	H	α-helix	trans	63.4	-148.7	166	0	0	0	0	0	119.4	F1114 E1115	G1112-F1114 VanDerWaalsContact C-N 3.33Å; G1112-F1114 CarbonylContact O-C 3.56Å; G1112-E1115 WeakPolarHBondContact CA-OE2 3.46Å; G1112-E1115 PolarHBondContact N-OE2 3.42Å; G1112-E1115 WeakPolarHBondContact O-CA 3.34Å; G1112-E1115 WeakPolarHBondContact O-CB 3.46Å; G1112-E1115 VanDerWaalsContact O-CG 3.27Å; G1112-E1115 WeakPolarHBondContact O-CG 3.39Å; G1112-E1115 PolarHBondContact O-N 3.14Å
1113	A	53.7	Low	55.8	Low	66 Å²	66	93.6 Å²	93.6	55%	0.545	49%	0.485	S	S	.	.	H	α-helix	trans	-87.5	-5.7	169.3	0	0	0	0	0	113.5	R1117	A1113-R1117 PolarHBondContact O-N 2.8Å
1114	F	58.2	Low	57.3	Low	120 Å²	120	94.2 Å²	94.2	53%	0.526	49%	0.486	S	S	.	.	H	α-helix		-22.1	-84.6	119	117.8	18.7	0	0	0	111.5	R1111 G1112 S1116 R1117 E1118	R1111-F1114 HydrophobicContact CB-CD1 3.8Å; R1111-F1114 HydrophobicContact CB-CE1 3.87Å; R1111-F1114 HydrophobicContact CG-CE1 4.27Å; R1111-F1114 CarbonylContact O-C 3.36Å; R1111-F1114 WeakPolarHBondContact O-CA 3.37Å; R1111-F1114 WeakPolarHBondContact O-CD1 3.26Å; G1112-F1114 VanDerWaalsContact C-N 3.33Å; G1112-F1114 CarbonylContact O-C 3.56Å; F1114-S1116 VanDerWaalsContact C-N 3.32Å; F1114-S1116 PolarHBondContact O-N 3.35Å; F1114-R1117 HydrophobicContact CB-CB 4.35Å; F1114-R1117 CarbonylContact O-C 3.54Å; F1114-R1117 WeakPolarHBondContact O-CA 3.25Å; F1114-R1117 WeakPolarHBondContact O-CB 3.49Å; F1114-R1117 PolarHBondContact O-N 2.98Å; F1114-E1118 HydrophobicContact CB-CB 4.14Å; F1114-E1118 HydrophobicContact CD1-CB 4.49Å; F1114-E1118 WeakPolarHBondContact CD1-OE1 3.38Å; F1114-E1118 WeakPolarHBondContact CE1-OE1 3.34Å; F1114-E1118 HydrophobicContact CG-CB 4.42Å; F1114-E1118 WeakPolarHBondContact O-CA 3.34Å; F1114-E1118 VanDerWaalsContact O-CB 3.23Å; F1114-E1118 WeakPolarHBondContact O-CB 3.3Å; F1114-E1118 PolarHBondContact O-N 2.97Å
1115	E	56.7	Low	59	Low	47 Å²	47	87.9 Å²	87.9	22%	0.22	46%	0.455	C	S	.	.	H	α-helix	trans	-40.8	-42.9	175.8	-56.8	152.5	76.3	0	0	115.6	E1110 R1111 G1112 R1117 E1118 K1119 S1120	E1110-E1115 HydrophobicContact CG-CG 4.48Å; R1111-E1115 VanDerWaalsContact N-CG 3.32Å; R1111-E1115 PolarHBondContact O-N 2.99Å; G1112-E1115 WeakPolarHBondContact CA-OE2 3.46Å; G1112-E1115 PolarHBondContact N-OE2 3.42Å; G1112-E1115 WeakPolarHBondContact O-CA 3.34Å; G1112-E1115 WeakPolarHBondContact O-CB 3.46Å; G1112-E1115 VanDerWaalsContact O-CG 3.27Å; G1112-E1115 WeakPolarHBondContact O-CG 3.39Å; G1112-E1115 PolarHBondContact O-N 3.14Å; E1115-R1117 PolarHBondContact O-N 2.91Å; E1115-E1118 CarbonylContact O-C 3.53Å; E1115-E1118 PolarHBondContact O-N 3.44Å; E1115-K1119 VanDerWaalsContact C-N 3.34Å; E1115-K1119 VanDerWaalsContact CA-N 3.33Å; E1115-K1119 HydrophobicContact CB-CB 4.29Å; E1115-K1119 HydrophobicContact CB-CD 3.86Å; E1115-K1119 HydrophobicContact CB-CG 3.78Å; E1115-K1119 HydrophobicContact CG-CD 4.24Å; E1115-K1119 HydrophobicContact CG-CG 4.19Å; E1115-K1119 CarbonylContact O-C 3.56Å; E1115-K1119 WeakPolarHBondContact O-CA 3.03Å; E1115-K1119 WeakPolarHBondContact O-CB 3.12Å; E1115-K1119 PolarHBondContact O-N 2.83Å; E1115-K1119 WeakPolarHBondContact OE1-CE 3.42Å; E1115-K1119 IonicContact OE1-NZ 2.76Å; E1115-K1119 PolarHBondContact OE1-NZ 3.49Å; E1115-S1120 PolarHBondContact O-N 3.43Å
1116	S	61.6	Low	61.2	Low	99 Å²	99	87.1 Å²	87.1	69%	0.692	45%	0.451	S	S	*	.	H	α-helix	trans	-64.1	-28.1	176.3	-60.5	0	0	0	0	112.7	F1114 S1120	F1114-S1116 VanDerWaalsContact C-N 3.32Å; F1114-S1116 PolarHBondContact O-N 3.35Å; S1116-S1120 WeakPolarHBondContact O-CB 3.48Å
1117	R	70.6	Confident	63.2	Low	181 Å²	181	89.4 Å²	89.4	68%	0.683	45%	0.453	S	S	*	.	H	α-helix	trans	-94.1	-9.6	165.3	-61.4	177.9	-175.7	125.9	1.5	114.4	A1113 F1114 E1115 N1121	A1113-R1117 PolarHBondContact O-N 2.8Å; F1114-R1117 HydrophobicContact CB-CB 4.35Å; F1114-R1117 CarbonylContact O-C 3.54Å; F1114-R1117 WeakPolarHBondContact O-CA 3.25Å; F1114-R1117 WeakPolarHBondContact O-CB 3.49Å; F1114-R1117 PolarHBondContact O-N 2.98Å; E1115-R1117 PolarHBondContact O-N 2.91Å; R1117-N1121 WeakPolarHBondContact O-CB 3.19Å; R1117-N1121 PolarHBondContact O-N 3.35Å; R1117-N1121 PolarHBondContact O-ND2 2.78Å; R1117-N1121 PolarHBondContact O-OD1 2.98Å
1118	E	68.3	Low	65.5	Low	23 Å²	23	89.1 Å²	89.1	11%	0.107	45%	0.445	C	S	.	.	H	α-helix	trans	-132.6	-23.7	-165.8	-142	-163	-84.3	0	0	115.2	R1111 F1114 E1115 S1120 N1121 L1122	R1111-E1118 IonicContact CZ-OE1 2.72Å; R1111-E1118 IonicContact CZ-OE2 3.16Å; R1111-E1118 IonicContact NE-OE1 3.42Å; R1111-E1118 IonicContact NE-OE2 3.83Å; R1111-E1118 PolarHBondContact NE-OE2 2.9Å; R1111-E1118 VanDerWaalsContact NH2-CD 3.33Å; R1111-E1118 IonicContact NH2-OE1 3.3Å; R1111-E1118 PolarHBondContact NH2-OE1 3.21Å; R1111-E1118 VanDerWaalsContact NH2-OE1 3.16Å; R1111-E1118 IonicContact NH2-OE2 2.66Å; R1111-E1118 PolarHBondContact NH2-OE2 3.2Å; F1114-E1118 HydrophobicContact CB-CB 4.14Å; F1114-E1118 HydrophobicContact CD1-CB 4.49Å; F1114-E1118 WeakPolarHBondContact CD1-OE1 3.38Å; F1114-E1118 WeakPolarHBondContact CE1-OE1 3.34Å; F1114-E1118 HydrophobicContact CG-CB 4.42Å; F1114-E1118 WeakPolarHBondContact O-CA 3.34Å; F1114-E1118 VanDerWaalsContact O-CB 3.23Å; F1114-E1118 WeakPolarHBondContact O-CB 3.3Å; F1114-E1118 PolarHBondContact O-N 2.97Å; E1115-E1118 CarbonylContact O-C 3.53Å; E1115-E1118 PolarHBondContact O-N 3.44Å; E1118-S1120 VanDerWaalsContact N-N 3.19Å; E1118-N1121 HydrophobicContact CB-CB 4.49Å; E1118-N1121 HydrophobicContact CG-CB 3.9Å; E1118-N1121 CarbonylContact O-C 3.51Å; E1118-L1122 HydrophobicContact CG-CD1 4.33Å; E1118-L1122 HydrophobicContact CG-CG 4.5Å; E1118-L1122 VanDerWaalsContact O-CA 3.25Å; E1118-L1122 WeakPolarHBondContact O-CA 3.42Å; E1118-L1122 WeakPolarHBondContact O-CB 3.38Å; E1118-L1122 VanDerWaalsContact O-CD1 3.27Å; E1118-L1122 WeakPolarHBondContact O-CD1 3.1Å; E1118-L1122 WeakPolarHBondContact O-CG 3.28Å; E1118-L1122 PolarHBondContact O-N 2.83Å
1119	K	72.1	Confident	67.2	Low	92 Å²	92	82.9 Å²	82.9	40%	0.4	42%	0.42	S	S	.	.	H	α-helix	trans	-67.3	-16.3	134.7	-64.4	171.2	-180	163.5	0	110.4	E1110 E1115 S1123	E1110-K1119 WeakPolarHBondContact OE1-CE 3.39Å; E1110-K1119 IonicContact OE1-NZ 2.7Å; E1110-K1119 PolarHBondContact OE1-NZ 2.74Å; E1110-K1119 WeakPolarHBondContact OE2-CE 3.37Å; E1110-K1119 IonicContact OE2-NZ 2.64Å; E1110-K1119 PolarHBondContact OE2-NZ 2.75Å; E1115-K1119 VanDerWaalsContact C-N 3.34Å; E1115-K1119 VanDerWaalsContact CA-N 3.33Å; E1115-K1119 HydrophobicContact CB-CB 4.29Å; E1115-K1119 HydrophobicContact CB-CD 3.86Å; E1115-K1119 HydrophobicContact CB-CG 3.78Å; E1115-K1119 HydrophobicContact CG-CD 4.24Å; E1115-K1119 HydrophobicContact CG-CG 4.19Å; E1115-K1119 CarbonylContact O-C 3.56Å; E1115-K1119 WeakPolarHBondContact O-CA 3.03Å; E1115-K1119 WeakPolarHBondContact O-CB 3.12Å; E1115-K1119 PolarHBondContact O-N 2.83Å; E1115-K1119 WeakPolarHBondContact OE1-CE 3.42Å; E1115-K1119 IonicContact OE1-NZ 2.76Å; E1115-K1119 PolarHBondContact OE1-NZ 3.49Å; K1119-S1123 VanDerWaalsContact O-CA 3.31Å; K1119-S1123 WeakPolarHBondContact O-CA 3.14Å; K1119-S1123 WeakPolarHBondContact O-CB 3.06Å; K1119-S1123 PolarHBondContact O-N 2.85Å
1120	S	70.8	Confident	68.6	Low	55 Å²	55	83 Å²	83	39%	0.385	42%	0.417	S	S	.	.	H	α-helix	trans	-78.1	-48.6	160.4	-174.5	0	0	0	0	111.5	E1115 S1116 E1118 L1122 S1123 L1124	E1115-S1120 PolarHBondContact O-N 3.43Å; S1116-S1120 WeakPolarHBondContact O-CB 3.48Å; E1118-S1120 VanDerWaalsContact N-N 3.19Å; S1120-L1122 VanDerWaalsContact C-N 3.26Å; S1120-L1122 PolarHBondContact O-N 3.07Å; S1120-S1123 CarbonylContact O-C 3.49Å; S1120-S1123 PolarHBondContact O-N 2.78Å; S1120-L1124 WeakPolarHBondContact O-CA 3.47Å; S1120-L1124 WeakPolarHBondContact O-CB 3.27Å; S1120-L1124 WeakPolarHBondContact O-CG 3.35Å; S1120-L1124 PolarHBondContact O-N 2.72Å
1121	N	77.3	Confident	70.6	Confident	95 Å²	95	84 Å²	84	51%	0.508	42%	0.417	S	S	.	.	H	α-helix	trans	-68.1	-20.6	173.5	-68.7	-25.8	0	0	0	113.7	R1117 E1118 L1124 A1125	R1117-N1121 WeakPolarHBondContact O-CB 3.19Å; R1117-N1121 PolarHBondContact O-N 3.35Å; R1117-N1121 PolarHBondContact O-ND2 2.78Å; R1117-N1121 PolarHBondContact O-OD1 2.98Å; E1118-N1121 HydrophobicContact CB-CB 4.49Å; E1118-N1121 HydrophobicContact CG-CB 3.9Å; E1118-N1121 CarbonylContact O-C 3.51Å; N1121-L1124 CarbonylContact O-C 3.54Å; N1121-A1125 WeakPolarHBondContact O-CA 3.45Å; N1121-A1125 WeakPolarHBondContact O-CB 3.39Å; N1121-A1125 PolarHBondContact O-N 3.1Å
1122	L	74.2	Confident	72.6	Confident	28 Å²	28	83 Å²	83	15%	0.147	41%	0.414	C	S	.	.	H	α-helix	trans	-107	-6.6	175.8	-59.9	157	0	0	0	113.1	L1106 E1118 S1120 A1125 N1126	L1106-L1122 HydrophobicContact CD1-CD2 3.86Å; E1118-L1122 HydrophobicContact CG-CD1 4.33Å; E1118-L1122 HydrophobicContact CG-CG 4.5Å; E1118-L1122 VanDerWaalsContact O-CA 3.25Å; E1118-L1122 WeakPolarHBondContact O-CA 3.42Å; E1118-L1122 WeakPolarHBondContact O-CB 3.38Å; E1118-L1122 VanDerWaalsContact O-CD1 3.27Å; E1118-L1122 WeakPolarHBondContact O-CD1 3.1Å; E1118-L1122 WeakPolarHBondContact O-CG 3.28Å; E1118-L1122 PolarHBondContact O-N 2.83Å; S1120-L1122 VanDerWaalsContact C-N 3.26Å; S1120-L1122 PolarHBondContact O-N 3.07Å; L1122-A1125 HydrophobicContact CB-CB 4.37Å; L1122-A1125 HydrophobicContact CD2-CB 3.77Å; L1122-A1125 HydrophobicContact CG-CB 4.46Å; L1122-N1126 WeakPolarHBondContact O-CA 3.46Å; L1122-N1126 WeakPolarHBondContact O-CB 3.45Å; L1122-N1126 PolarHBondContact O-N 2.9Å
1123	S	72.4	Confident	74.1	Confident	46 Å²	46	83.1 Å²	83.1	32%	0.322	40%	0.404	S	S	.	.	H	α-helix	trans	-84.4	-24	150.7	-173.7	0	0	0	0	109.9	K1119 S1120 R1127	K1119-S1123 VanDerWaalsContact O-CA 3.31Å; K1119-S1123 WeakPolarHBondContact O-CA 3.14Å; K1119-S1123 WeakPolarHBondContact O-CB 3.06Å; K1119-S1123 PolarHBondContact O-N 2.85Å; S1120-S1123 CarbonylContact O-C 3.49Å; S1120-S1123 PolarHBondContact O-N 2.78Å; S1123-R1127 WeakPolarHBondContact O-CA 3.12Å; S1123-R1127 WeakPolarHBondContact O-CB 3.25Å; S1123-R1127 VanDerWaalsContact O-CD 3.24Å; S1123-R1127 WeakPolarHBondContact O-CD 3.41Å; S1123-R1127 WeakPolarHBondContact O-CG 3.44Å; S1123-R1127 PolarHBondContact O-N 3.31Å
1124	L	79.2	Confident	75.9	Confident	74 Å²	74	83.2 Å²	83.2	39%	0.387	39%	0.393	S	S	.	.	H	α-helix	trans	-78.7	-31.6	163.8	-72.2	167.8	0	0	0	111.2	S1120 N1121 R1128	S1120-L1124 WeakPolarHBondContact O-CA 3.47Å; S1120-L1124 WeakPolarHBondContact O-CB 3.27Å; S1120-L1124 WeakPolarHBondContact O-CG 3.35Å; S1120-L1124 PolarHBondContact O-N 2.72Å; N1121-L1124 CarbonylContact O-C 3.54Å; L1124-R1128 WeakPolarHBondContact O-CB 3.49Å; L1124-R1128 WeakPolarHBondContact O-CD 3.42Å; L1124-R1128 WeakPolarHBondContact O-CG 3.39Å; L1124-R1128 PolarHBondContact O-N 2.95Å
1125	A	78.4	Confident	77.4	Confident	20 Å²	20	82.1 Å²	82.1	17%	0.165	39%	0.389	C	S	.	.	H	α-helix	trans	-75.9	-46.8	170.7	0	0	0	0	0	109.8	N1121 L1122 R1127 R1128 L1129	N1121-A1125 WeakPolarHBondContact O-CA 3.45Å; N1121-A1125 WeakPolarHBondContact O-CB 3.39Å; N1121-A1125 PolarHBondContact O-N 3.1Å; L1122-A1125 HydrophobicContact CB-CB 4.37Å; L1122-A1125 HydrophobicContact CD2-CB 3.77Å; L1122-A1125 HydrophobicContact CG-CB 4.46Å; A1125-R1127 PolarHBondContact O-N 3.19Å; A1125-R1128 CarbonylContact O-C 3.49Å; A1125-R1128 VanDerWaalsContact O-C 3.25Å; A1125-R1128 VanDerWaalsContact O-CA 3.29Å; A1125-R1128 WeakPolarHBondContact O-CA 3.35Å; A1125-R1128 WeakPolarHBondContact O-CB 3.26Å; A1125-R1128 PolarHBondContact O-N 3.48Å; A1125-L1129 HydrophobicContact CB-CD1 4.11Å; A1125-L1129 WeakPolarHBondContact O-CA 3.44Å; A1125-L1129 WeakPolarHBondContact O-CB 3.35Å; A1125-L1129 WeakPolarHBondContact O-CD1 3.42Å; A1125-L1129 WeakPolarHBondContact O-CG 3.28Å; A1125-L1129 PolarHBondContact O-N 3Å
1126	N	75.6	Confident	78.9	Confident	80 Å²	80	81.7 Å²	81.7	43%	0.428	39%	0.387	S	S	.	.	H	α-helix	trans	-57.2	-50.2	167.8	-85.9	11.9	0	0	0	109.9	L1122 R1128 L1129 E1130	L1122-N1126 WeakPolarHBondContact O-CA 3.46Å; L1122-N1126 WeakPolarHBondContact O-CB 3.45Å; L1122-N1126 PolarHBondContact O-N 2.9Å; N1126-R1128 PolarHBondContact O-N 3.39Å; N1126-L1129 CarbonylContact O-C 3.43Å; N1126-L1129 WeakPolarHBondContact O-CA 3.23Å; N1126-L1129 PolarHBondContact O-N 3.38Å; N1126-E1130 HydrophobicContact CB-CG 4.32Å; N1126-E1130 WeakPolarHBondContact CB-OE1 3.39Å; N1126-E1130 WeakPolarHBondContact O-CA 3.48Å; N1126-E1130 WeakPolarHBondContact O-CB 3.49Å; N1126-E1130 WeakPolarHBondContact O-CG 3.46Å; N1126-E1130 PolarHBondContact O-N 2.85Å
1127	R	80.8	Confident	80.2	Confident	145 Å²	145	78.6 Å²	78.6	55%	0.547	36%	0.362	S	S	.	.	H	α-helix	trans	-61.1	-21.2	173.4	-70.8	165.4	-172.4	-167.8	1.3	113.8	S1123 A1125 R1131	S1123-R1127 WeakPolarHBondContact O-CA 3.12Å; S1123-R1127 WeakPolarHBondContact O-CB 3.25Å; S1123-R1127 VanDerWaalsContact O-CD 3.24Å; S1123-R1127 WeakPolarHBondContact O-CD 3.41Å; S1123-R1127 WeakPolarHBondContact O-CG 3.44Å; S1123-R1127 PolarHBondContact O-N 3.31Å; A1125-R1127 PolarHBondContact O-N 3.19Å; R1127-R1131 WeakPolarHBondContact O-CB 3.31Å; R1127-R1131 WeakPolarHBondContact O-CG 3.48Å; R1127-R1131 PolarHBondContact O-N 3.37Å; R1127-R1131 PolarHBondContact O-NE 2.76Å; R1127-R1131 PolarHBondContact O-NH2 2.88Å; R1127-R1131 VanDerWaalsContact O-NH2 3.09Å
1128	R	82.1	Confident	81.1	Confident	165 Å²	165	74 Å²	74	62%	0.623	35%	0.35	S	S	*	.	H	α-helix	trans	-85.5	-15.8	169.5	-79.1	167	179.4	177.6	0.2	113.3	L1124 A1125 N1126 R1132	L1124-R1128 WeakPolarHBondContact O-CB 3.49Å; L1124-R1128 WeakPolarHBondContact O-CD 3.42Å; L1124-R1128 WeakPolarHBondContact O-CG 3.39Å; L1124-R1128 PolarHBondContact O-N 2.95Å; A1125-R1128 CarbonylContact O-C 3.49Å; A1125-R1128 VanDerWaalsContact O-C 3.25Å; A1125-R1128 VanDerWaalsContact O-CA 3.29Å; A1125-R1128 WeakPolarHBondContact O-CA 3.35Å; A1125-R1128 WeakPolarHBondContact O-CB 3.26Å; A1125-R1128 PolarHBondContact O-N 3.48Å; N1126-R1128 PolarHBondContact O-N 3.39Å; R1128-R1132 WeakPolarHBondContact O-CB 3.5Å; R1128-R1132 PolarHBondContact O-N 2.98Å
1129	L	81.4	Confident	82.2	Confident	48 Å²	48	77.3 Å²	77.3	25%	0.251	37%	0.365	S	S	.	.	H	α-helix	trans	-113.2	-37.9	-173.1	-69.5	165.8	0	0	0	111.1	L1105 A1125 N1126 R1131 R1132 V1133	L1105-L1129 HydrophobicContact CD1-CD1 4.24Å; L1105-L1129 HydrophobicContact CD2-CD1 3.81Å; L1105-L1129 HydrophobicContact CG-CD1 4.08Å; A1125-L1129 HydrophobicContact CB-CD1 4.11Å; A1125-L1129 WeakPolarHBondContact O-CA 3.44Å; A1125-L1129 WeakPolarHBondContact O-CB 3.35Å; A1125-L1129 WeakPolarHBondContact O-CD1 3.42Å; A1125-L1129 WeakPolarHBondContact O-CG 3.28Å; A1125-L1129 PolarHBondContact O-N 3Å; N1126-L1129 CarbonylContact O-C 3.43Å; N1126-L1129 WeakPolarHBondContact O-CA 3.23Å; N1126-L1129 PolarHBondContact O-N 3.38Å; L1129-R1131 PolarHBondContact O-N 3.37Å; L1129-R1132 HydrophobicContact CD2-CB 4.15Å; L1129-R1132 CarbonylContact O-C 3.6Å; L1129-R1132 PolarHBondContact O-N 3.26Å; L1129-V1133 WeakPolarHBondContact O-CA 3.43Å; L1129-V1133 WeakPolarHBondContact O-CB 3.45Å; L1129-V1133 WeakPolarHBondContact O-CG2 3.45Å; L1129-V1133 PolarHBondContact O-N 3.47Å
1130	E	79.5	Confident	83.1	Confident	90 Å²	90	73.5 Å²	73.5	42%	0.421	35%	0.349	S	S	.	.	H	α-helix	trans	-54.1	-27.8	144.8	-59.6	166	-161.1	0	0	112	N1126 K1134	N1126-E1130 HydrophobicContact CB-CG 4.32Å; N1126-E1130 WeakPolarHBondContact CB-OE1 3.39Å; N1126-E1130 WeakPolarHBondContact O-CA 3.48Å; N1126-E1130 WeakPolarHBondContact O-CB 3.49Å; N1126-E1130 WeakPolarHBondContact O-CG 3.46Å; N1126-E1130 PolarHBondContact O-N 2.85Å; E1130-K1134 WeakPolarHBondContact O-CA 3.39Å; E1130-K1134 WeakPolarHBondContact O-CD 3.37Å; E1130-K1134 WeakPolarHBondContact O-CG 3.49Å; E1130-K1134 PolarHBondContact O-N 2.87Å
1131	R	87.4	Confident	84	Confident	114 Å²	114	73 Å²	73	43%	0.43	34%	0.341	S	S	.	.	H	α-helix	trans	-83.5	-37.7	164.9	-86.7	-176.5	-77.6	98.6	4.5	113	R1127 L1129 V1133 K1134 E1135	R1127-R1131 WeakPolarHBondContact O-CB 3.31Å; R1127-R1131 WeakPolarHBondContact O-CG 3.48Å; R1127-R1131 PolarHBondContact O-N 3.37Å; R1127-R1131 PolarHBondContact O-NE 2.76Å; R1127-R1131 PolarHBondContact O-NH2 2.88Å; R1127-R1131 VanDerWaalsContact O-NH2 3.09Å; L1129-R1131 PolarHBondContact O-N 3.37Å; R1131-V1133 PolarHBondContact O-N 3.46Å; R1131-K1134 CarbonylContact O-C 3.6Å; R1131-K1134 WeakPolarHBondContact O-CA 3.15Å; R1131-K1134 PolarHBondContact O-N 3.09Å; R1131-E1135 VanDerWaalsContact O-CB 3.26Å; R1131-E1135 WeakPolarHBondContact O-CB 3.21Å; R1131-E1135 WeakPolarHBondContact O-CG 3.2Å; R1131-E1135 PolarHBondContact O-N 2.86Å
1132	R	89	Confident	84.7	Confident	108 Å²	108	73.2 Å²	73.2	41%	0.408	34%	0.339	S	S	.	.	H	α-helix	trans	-65.1	-25.9	172.1	-159.1	-177.2	-176.6	99.5	-7	112.6	E1102 R1128 L1129 M1136	E1102-R1132 IonicContact OE1-CZ 2.95Å; E1102-R1132 IonicContact OE1-NE 4Å; E1102-R1132 PolarHBondContact OE1-NE 2.69Å; E1102-R1132 IonicContact OE1-NH2 2.82Å; E1102-R1132 PolarHBondContact OE1-NH2 2.95Å; E1102-R1132 IonicContact OE2-CZ 3.19Å; E1102-R1132 IonicContact OE2-NE 3Å; E1102-R1132 IonicContact OE2-NH2 3.69Å; E1102-R1132 PolarHBondContact OE2-NH2 2.93Å; R1128-R1132 WeakPolarHBondContact O-CB 3.5Å; R1128-R1132 PolarHBondContact O-N 2.98Å; L1129-R1132 HydrophobicContact CD2-CB 4.15Å; L1129-R1132 CarbonylContact O-C 3.6Å; L1129-R1132 PolarHBondContact O-N 3.26Å; R1132-M1136 WeakPolarHBondContact O-CA 3.19Å; R1132-M1136 WeakPolarHBondContact O-CB 3.08Å; R1132-M1136 PolarHBondContact O-N 3.26Å
1133	V	88.1	Confident	85.5	Confident	49 Å²	49	73.1 Å²	73.1	30%	0.297	34%	0.337	S	S	.	.	H	α-helix	trans	-86.4	-37.9	169	172.1	0	0	0	0	109.5	R260 V1103 L1129 R1131 E1135 M1137	R260-V1133 PolarHBondContact NH1-O 3.24Å; R260-V1133 PolarHBondContact NH2-O 2.91Å; V1103-V1133 HydrophobicContact CG2-CG2 4.35Å; L1129-V1133 WeakPolarHBondContact O-CA 3.43Å; L1129-V1133 WeakPolarHBondContact O-CB 3.45Å; L1129-V1133 WeakPolarHBondContact O-CG2 3.45Å; L1129-V1133 PolarHBondContact O-N 3.47Å; R1131-V1133 PolarHBondContact O-N 3.46Å; V1133-E1135 PolarHBondContact O-N 3Å; V1133-E1135 VanDerWaalsContact O-N 3.12Å; V1133-M1137 HydrophobicContact CG1-CG 4.25Å; V1133-M1137 HydrophobicContact CG1-SD 3.44Å; V1133-M1137 WeakPolarHBondContact CG1-SD 3.13Å; V1133-M1137 WeakPolarHBondContact O-CB 3.34Å; V1133-M1137 PolarHBondContact O-N 3.13Å
1134	K	91.1	Very high	86.4	Confident	69 Å²	69	75.8 Å²	75.8	30%	0.3	35%	0.345	S	S	.	.	H	α-helix	trans	-41.7	-27.8	155.1	35.9	100.8	177.1	-159.3	0	114.6	S258 R260 E1130 R1131	S258-K1134 VanDerWaalsContact CB-NZ 3.3Å; S258-K1134 WeakPolarHBondContact OG-CE 3.38Å; S258-K1134 PolarHBondContact OG-NZ 2.64Å; R260-K1134 PolarHBondContact NH2-O 3.23Å; E1130-K1134 WeakPolarHBondContact O-CA 3.39Å; E1130-K1134 WeakPolarHBondContact O-CD 3.37Å; E1130-K1134 WeakPolarHBondContact O-CG 3.49Å; E1130-K1134 PolarHBondContact O-N 2.87Å; R1131-K1134 CarbonylContact O-C 3.6Å; R1131-K1134 WeakPolarHBondContact O-CA 3.15Å; R1131-K1134 PolarHBondContact O-N 3.09Å
1135	E	88.4	Confident	87	Confident	97 Å²	97	77.9 Å²	77.9	45%	0.453	35%	0.352	S	S	.	.	H	α-helix	trans	-108.7	-58.3	-177.4	-70.4	144.5	-157.4	0	0	109	R1131 V1133 M1137 M1138 Q1139	R1131-E1135 VanDerWaalsContact O-CB 3.26Å; R1131-E1135 WeakPolarHBondContact O-CB 3.21Å; R1131-E1135 WeakPolarHBondContact O-CG 3.2Å; R1131-E1135 PolarHBondContact O-N 2.86Å; V1133-E1135 PolarHBondContact O-N 3Å; V1133-E1135 VanDerWaalsContact O-N 3.12Å; E1135-M1137 PolarHBondContact O-N 3.37Å; E1135-M1138 CarbonylContact O-C 3.25Å; E1135-M1138 VanDerWaalsContact O-CA 3.31Å; E1135-M1138 WeakPolarHBondContact O-CA 3.48Å; E1135-M1138 VanDerWaalsContact O-CB 3.25Å; E1135-M1138 WeakPolarHBondContact O-CB 3.19Å; E1135-M1138 PolarHBondContact O-N 3.16Å; E1135-Q1139 PolarHBondContact O-N 2.75Å
1136	M	88.5	Confident	87.5	Confident	37 Å²	37	80.3 Å²	80.3	18%	0.182	37%	0.365	C	S	.	.	H	α-helix	trans	-53.4	-48.5	179.3	171.1	-104.6	-168.9	0	0	114.2	E1102 V1103 R1132 M1138 Q1139 I1140	E1102-M1136 HydrophobicContact CB-CG 4.46Å; V1103-M1136 HydrophobicContact CB-CE 4.27Å; V1103-M1136 HydrophobicContact CG2-CG 4.44Å; R1132-M1136 WeakPolarHBondContact O-CA 3.19Å; R1132-M1136 WeakPolarHBondContact O-CB 3.08Å; R1132-M1136 PolarHBondContact O-N 3.26Å; M1136-M1138 PolarHBondContact O-N 3.47Å; M1136-Q1139 PolarHBondContact O-N 2.87Å; M1136-I1140 HydrophobicContact CE-CD1 3.74Å; M1136-I1140 HydrophobicContact CG-CD1 4.15Å; M1136-I1140 WeakPolarHBondContact O-CD1 2.99Å; M1136-I1140 WeakPolarHBondContact O-CG1 3.16Å; M1136-I1140 PolarHBondContact O-N 3.03Å; M1136-I1140 HydrophobicContact SD-CD1 3.82Å
1137	M	88.3	Confident	88.1	Confident	34 Å²	34	80 Å²	80	17%	0.167	36%	0.362	C	S	.	.	H	α-helix	trans	-67	-16	175.5	-87.6	162.6	72.1	0	0	113.2	R260 S261 V1133 E1135 E1141	R260-M1137 HydrophobicContact CB-CE 4.33Å; R260-M1137 WeakPolarHBondContact O-CE 3.33Å; S261-M1137 WeakPolarHBondContact O-CE 3.26Å; S261-M1137 WeakPolarHBondContact OG-CB 3.42Å; S261-M1137 VanDerWaalsContact OG-CE 3.25Å; S261-M1137 WeakPolarHBondContact OG-CE 3.04Å; S261-M1137 PolarHBondContact OG-O 2.8Å; V1133-M1137 HydrophobicContact CG1-CG 4.25Å; V1133-M1137 HydrophobicContact CG1-SD 3.44Å; V1133-M1137 WeakPolarHBondContact CG1-SD 3.13Å; V1133-M1137 WeakPolarHBondContact O-CB 3.34Å; V1133-M1137 PolarHBondContact O-N 3.13Å; E1135-M1137 PolarHBondContact O-N 3.37Å; M1137-E1141 VanDerWaalsContact O-CB 3.26Å; M1137-E1141 WeakPolarHBondContact O-CB 3.46Å; M1137-E1141 WeakPolarHBondContact O-CG 3.4Å; M1137-E1141 PolarHBondContact O-N 3.34Å; M1137-E1141 VanDerWaalsContact O-N 3.08Å
1138	M	90.9	Very high	88.6	Confident	86 Å²	86	75.7 Å²	75.7	42%	0.424	35%	0.348	S	S	.	.	H	α-helix	trans	-92.7	-45.9	-179.3	-175.8	-175.8	83.1	0	0	108.7	E1135 M1136 I1140 E1141 E1142	E1135-M1138 CarbonylContact O-C 3.25Å; E1135-M1138 VanDerWaalsContact O-CA 3.31Å; E1135-M1138 WeakPolarHBondContact O-CA 3.48Å; E1135-M1138 VanDerWaalsContact O-CB 3.25Å; E1135-M1138 WeakPolarHBondContact O-CB 3.19Å; E1135-M1138 PolarHBondContact O-N 3.16Å; M1136-M1138 PolarHBondContact O-N 3.47Å; M1138-I1140 VanDerWaalsContact C-N 3.32Å; M1138-I1140 PolarHBondContact O-N 3.47Å; M1138-E1141 CarbonylContact O-C 3.09Å; M1138-E1141 WeakPolarHBondContact O-CA 3.44Å; M1138-E1141 WeakPolarHBondContact O-CB 3.35Å; M1138-E1141 PolarHBondContact O-N 3.29Å; M1138-E1141 VanDerWaalsContact O-N 3.07Å; M1138-E1142 WeakPolarHBondContact O-CB 3.23Å; M1138-E1142 VanDerWaalsContact O-CG 3.26Å; M1138-E1142 WeakPolarHBondContact O-CG 3.23Å; M1138-E1142 PolarHBondContact O-N 3.3Å
1139	Q	91.4	Very high	89.1	Confident	92 Å²	92	72.8 Å²	72.8	43%	0.43	35%	0.345	S	S	.	.	H	α-helix	trans	-53.2	-48.2	165.8	-175.3	-163.3	-37.1	0	0	110.5	E1135 M1136 E1141 E1142 E1143	E1135-Q1139 PolarHBondContact O-N 2.75Å; M1136-Q1139 PolarHBondContact O-N 2.87Å; Q1139-E1141 VanDerWaalsContact C-N 3.34Å; Q1139-E1142 CarbonylContact O-C 3.48Å; Q1139-E1142 WeakPolarHBondContact O-CB 3.36Å; Q1139-E1142 PolarHBondContact O-N 2.77Å; Q1139-E1142 VanDerWaalsContact O-N 3.16Å; Q1139-E1143 WeakPolarHBondContact CG-OE1 3.17Å; Q1139-E1143 PolarHBondContact NE2-OE1 2.75Å; Q1139-E1143 VanDerWaalsContact O-CG 3.3Å; Q1139-E1143 WeakPolarHBondContact O-CG 3.45Å; Q1139-E1143 PolarHBondContact O-N 3.44Å
1140	I	91.3	Very high	89.4	Confident	11 Å²	11	74 Å²	74	6%	0.056	35%	0.349	C	S	.	.	H	α-helix	trans	-79	-16.4	177.7	75.3	-154.5	0	0	0	113	R262 N1100 M1136 M1138 E1143 H1144	R262-I1140 VanDerWaalsContact CZ-O 3.25Å; R262-I1140 PolarHBondContact NH1-O 2.85Å; R262-I1140 PolarHBondContact NH2-O 3.49Å; N1100-I1140 WeakPolarHBondContact ND2-CG2 3.47Å; M1136-I1140 HydrophobicContact CE-CD1 3.74Å; M1136-I1140 HydrophobicContact CG-CD1 4.15Å; M1136-I1140 WeakPolarHBondContact O-CD1 2.99Å; M1136-I1140 WeakPolarHBondContact O-CG1 3.16Å; M1136-I1140 PolarHBondContact O-N 3.03Å; M1136-I1140 HydrophobicContact SD-CD1 3.82Å; M1138-I1140 VanDerWaalsContact C-N 3.32Å; M1138-I1140 PolarHBondContact O-N 3.47Å; I1140-E1143 HydrophobicContact CG2-CB 4.34Å; I1140-H1144 VanDerWaalsContact O-CB 3.28Å; I1140-H1144 WeakPolarHBondContact O-CB 3.24Å; I1140-H1144 PolarHBondContact O-N 2.65Å
1141	E	89.5	Confident	90.1	Very high	45 Å²	45	75.5 Å²	75.5	21%	0.21	35%	0.354	C	S	.	.	H	α-helix	trans	-69.9	-38.6	160.2	-86.3	166.9	170.9	0	0	112.3	R260 S261 R262 M1137 M1138 Q1139 H1144 H1145	R260-E1141 WeakPolarHBondContact CD-OE2 3.39Å; R260-E1141 WeakPolarHBondContact CG-OE1 3.39Å; R260-E1141 WeakPolarHBondContact CG-OE2 3.4Å; R260-E1141 IonicContact NE-OE2 2.75Å; R260-E1141 PolarHBondContact NE-OE2 3.06Å; R260-E1141 VanDerWaalsContact NE-OE2 3.11Å; S261-E1141 WeakPolarHBondContact CA-OE1 3.29Å; S261-E1141 WeakPolarHBondContact CB-OE1 3.13Å; S261-E1141 PolarHBondContact N-OE1 3.12Å; S261-E1141 VanDerWaalsContact N-OE1 3.11Å; S261-E1141 PolarHBondContact OG-OE1 3.29Å; R262-E1141 VanDerWaalsContact NH2-CA 3.26Å; M1137-E1141 VanDerWaalsContact O-CB 3.26Å; M1137-E1141 WeakPolarHBondContact O-CB 3.46Å; M1137-E1141 WeakPolarHBondContact O-CG 3.4Å; M1137-E1141 PolarHBondContact O-N 3.34Å; M1137-E1141 VanDerWaalsContact O-N 3.08Å; M1138-E1141 CarbonylContact O-C 3.09Å; M1138-E1141 WeakPolarHBondContact O-CA 3.44Å; M1138-E1141 WeakPolarHBondContact O-CB 3.35Å; M1138-E1141 PolarHBondContact O-N 3.29Å; M1138-E1141 VanDerWaalsContact O-N 3.07Å; Q1139-E1141 VanDerWaalsContact C-N 3.34Å; E1141-H1144 CarbonylContact O-C 3.56Å; E1141-H1144 PolarHBondContact O-N 3.39Å; E1141-H1145 PolarHBondContact O-N 3.12Å; E1141-H1145 PolarHBondContact O-ND1 3.35Å
1142	E	91.9	Very high	90.4	Very high	100 Å²	100	73.7 Å²	73.7	47%	0.467	35%	0.353	S	S	.	.	H	α-helix	trans	-68.7	-39	173.2	-69.6	157.9	-174.7	0	0	110.3	M1138 Q1139 H1144 H1145 T1146	M1138-E1142 WeakPolarHBondContact O-CB 3.23Å; M1138-E1142 VanDerWaalsContact O-CG 3.26Å; M1138-E1142 WeakPolarHBondContact O-CG 3.23Å; M1138-E1142 PolarHBondContact O-N 3.3Å; Q1139-E1142 CarbonylContact O-C 3.48Å; Q1139-E1142 WeakPolarHBondContact O-CB 3.36Å; Q1139-E1142 PolarHBondContact O-N 2.77Å; Q1139-E1142 VanDerWaalsContact O-N 3.16Å; E1142-H1144 VanDerWaalsContact C-N 3.33Å; E1142-H1145 PolarHBondContact O-N 3.05Å; E1142-T1146 WeakPolarHBondContact O-CB 3.45Å; E1142-T1146 WeakPolarHBondContact O-CG2 3.39Å; E1142-T1146 PolarHBondContact O-N 2.66Å; E1142-T1146 PolarHBondContact O-OG1 3.27Å
1143	E	89.4	Confident	90.5	Very high	25 Å²	25	73.8 Å²	73.8	12%	0.117	36%	0.358	C	S	.	.	H	α-helix	trans	-64.5	-36.1	169.5	-66	165.6	-163.8	0	0	110.9	M1099 N1100 Q1139 I1140 T1146 M1147	M1099-E1143 HydrophobicContact CE-CG 3.83Å; M1099-E1143 VanDerWaalsContact CE-OE1 3.26Å; M1099-E1143 WeakPolarHBondContact CE-OE1 3.36Å; N1100-E1143 WeakPolarHBondContact CA-OE2 3.44Å; N1100-E1143 PolarHBondContact ND2-OE2 3.24Å; Q1139-E1143 WeakPolarHBondContact CG-OE1 3.17Å; Q1139-E1143 PolarHBondContact NE2-OE1 2.75Å; Q1139-E1143 VanDerWaalsContact O-CG 3.3Å; Q1139-E1143 WeakPolarHBondContact O-CG 3.45Å; Q1139-E1143 PolarHBondContact O-N 3.44Å; I1140-E1143 HydrophobicContact CG2-CB 4.34Å; E1143-T1146 WeakPolarHBondContact CA-OG1 2.97Å; E1143-T1146 PolarHBondContact O-OG1 2.71Å; E1143-M1147 WeakPolarHBondContact O-CB 3.01Å; E1143-M1147 WeakPolarHBondContact O-CG 3.48Å; E1143-M1147 PolarHBondContact O-N 3.27Å
1144	H	92.3	Very high	90.8	Very high	103 Å²	103	74.5 Å²	74.5	48%	0.477	36%	0.36	S	S	.	.	H	α-helix	trans	-73.1	-38.3	174	-178.1	-72.4	0	0	0	112.7	R262 I1140 E1141 E1142 Q1148	R262-H1144 VanDerWaalsContact NH2-CB 3.28Å; I1140-H1144 VanDerWaalsContact O-CB 3.28Å; I1140-H1144 WeakPolarHBondContact O-CB 3.24Å; I1140-H1144 PolarHBondContact O-N 2.65Å; E1141-H1144 CarbonylContact O-C 3.56Å; E1141-H1144 PolarHBondContact O-N 3.39Å; E1142-H1144 VanDerWaalsContact C-N 3.33Å; H1144-Q1148 WeakPolarHBondContact O-CB 3.15Å; H1144-Q1148 PolarHBondContact O-N 2.63Å
1145	H	91.5	Very high	90.8	Very high	118 Å²	118	74.1 Å²	74.1	55%	0.546	36%	0.361	S	S	.	.	H	α-helix	trans	-66.7	-46.5	174.2	-76.8	85.1	0	0	0	110	E1141 E1142 M1147 Q1148 D1149	E1141-H1145 PolarHBondContact O-N 3.12Å; E1141-H1145 PolarHBondContact O-ND1 3.35Å; E1142-H1145 PolarHBondContact O-N 3.05Å; H1145-M1147 PolarHBondContact O-N 3.28Å; H1145-Q1148 CarbonylContact O-C 3.58Å; H1145-Q1148 PolarHBondContact O-N 2.63Å; H1145-Q1148 VanDerWaalsContact O-N 3.12Å; H1145-D1149 WeakPolarHBondContact O-CB 3.46Å; H1145-D1149 VanDerWaalsContact O-CG 3.23Å; H1145-D1149 PolarHBondContact O-N 2.74Å
1146	T	89.3	Confident	91.2	Very high	70 Å²	70	75.3 Å²	75.3	43%	0.429	37%	0.37	S	S	.	.	H	α-helix	trans	-67.3	-34.8	176.6	52.8	0	0	0	0	113.1	E1142 E1143 D1149 Q1150	E1142-T1146 WeakPolarHBondContact O-CB 3.45Å; E1142-T1146 WeakPolarHBondContact O-CG2 3.39Å; E1142-T1146 PolarHBondContact O-N 2.66Å; E1142-T1146 PolarHBondContact O-OG1 3.27Å; E1143-T1146 WeakPolarHBondContact CA-OG1 2.97Å; E1143-T1146 PolarHBondContact O-OG1 2.71Å; T1146-D1149 PolarHBondContact O-N 3.2Å; T1146-Q1150 VanDerWaalsContact O-CB 3.31Å; T1146-Q1150 WeakPolarHBondContact O-CB 3.08Å; T1146-Q1150 WeakPolarHBondContact O-CG 3.49Å; T1146-Q1150 PolarHBondContact O-N 3.26Å
1147	M	88.8	Confident	91.3	Very high	73 Å²	73	78.4 Å²	78.4	36%	0.36	38%	0.38	S	S	.	.	H	α-helix	trans	-68.7	-33.5	169.7	-75.1	-64.8	-61.3	0	0	112.2	E1143 H1145 K1151	E1143-M1147 WeakPolarHBondContact O-CB 3.01Å; E1143-M1147 WeakPolarHBondContact O-CG 3.48Å; E1143-M1147 PolarHBondContact O-N 3.27Å; H1145-M1147 PolarHBondContact O-N 3.28Å; M1147-K1151 WeakPolarHBondContact O-CB 3.33Å; M1147-K1151 PolarHBondContact O-N 3.37Å
1148	Q	91.4	Very high	91.5	Very high	56 Å²	56	82.2 Å²	82.2	26%	0.262	40%	0.4	S	S	.	.	H	α-helix	trans	-71.8	-38.6	173.5	179.6	57.9	37.1	0	0	111.4	H1144 H1145 K1151 D1152	H1144-Q1148 WeakPolarHBondContact O-CB 3.15Å; H1144-Q1148 PolarHBondContact O-N 2.63Å; H1145-Q1148 CarbonylContact O-C 3.58Å; H1145-Q1148 PolarHBondContact O-N 2.63Å; H1145-Q1148 VanDerWaalsContact O-N 3.12Å; Q1148-K1151 CarbonylContact O-C 3.55Å; Q1148-K1151 PolarHBondContact O-N 2.77Å; Q1148-D1152 PolarHBondContact NE2-OD1 2.89Å; Q1148-D1152 PolarHBondContact NE2-OD2 3.29Å; Q1148-D1152 WeakPolarHBondContact O-CB 3.08Å; Q1148-D1152 VanDerWaalsContact O-CG 3.32Å; Q1148-D1152 PolarHBondContact O-N 3.37Å
1149	D	91.8	Very high	91.7	Very high	104 Å²	104	83.5 Å²	83.5	56%	0.556	40%	0.404	S	S	*	.	H	α-helix	trans	-66.5	-41.3	173.2	-69.6	-29.4	0	0	0	111.3	H1145 T1146 D1152 Q1153	H1145-D1149 WeakPolarHBondContact O-CB 3.46Å; H1145-D1149 VanDerWaalsContact O-CG 3.23Å; H1145-D1149 PolarHBondContact O-N 2.74Å; T1146-D1149 PolarHBondContact O-N 3.2Å; D1149-D1152 PolarHBondContact O-N 2.9Å; D1149-Q1153 VanDerWaalsContact O-CB 3.24Å; D1149-Q1153 WeakPolarHBondContact O-CB 3.29Å; D1149-Q1153 PolarHBondContact O-N 2.79Å
1150	Q	88.6	Confident	91.5	Very high	74 Å²	74	81.5 Å²	81.5	35%	0.346	40%	0.402	S	S	.	.	H	α-helix	trans	-63.2	-46.7	172.1	-77.4	176	24.6	0	0	110.8	T1146 D1152 Q1153 L1154	T1146-Q1150 VanDerWaalsContact O-CB 3.31Å; T1146-Q1150 WeakPolarHBondContact O-CB 3.08Å; T1146-Q1150 WeakPolarHBondContact O-CG 3.49Å; T1146-Q1150 PolarHBondContact O-N 3.26Å; Q1150-D1152 VanDerWaalsContact C-N 3.34Å; Q1150-D1152 PolarHBondContact O-N 3.49Å; Q1150-Q1153 PolarHBondContact O-N 2.83Å; Q1150-L1154 WeakPolarHBondContact O-CB 3.46Å; Q1150-L1154 VanDerWaalsContact O-CG 3.27Å; Q1150-L1154 WeakPolarHBondContact O-CG 3.42Å; Q1150-L1154 PolarHBondContact O-N 3.15Å
1151	K	94.4	Very high	91.5	Very high	120 Å²	120	84.7 Å²	84.7	52%	0.522	42%	0.419	S	S	.	.	H	α-helix	trans	-59.8	-41.5	175	169.5	-178.6	155.3	-154.8	0	111.9	M1147 Q1148 L1154 N1155	M1147-K1151 WeakPolarHBondContact O-CB 3.33Å; M1147-K1151 PolarHBondContact O-N 3.37Å; Q1148-K1151 CarbonylContact O-C 3.55Å; Q1148-K1151 PolarHBondContact O-N 2.77Å; K1151-L1154 PolarHBondContact O-N 3.37Å; K1151-N1155 WeakPolarHBondContact O-CB 3.16Å; K1151-N1155 PolarHBondContact O-N 3.35Å
1152	D	93.3	Very high	91.6	Very high	77 Å²	77	88.1 Å²	88.1	41%	0.412	43%	0.434	S	S	.	.	H	α-helix	trans	-76.5	-31.5	179.5	-73.5	-17.6	0	0	0	112	Q1148 D1149 Q1150 N1155 L1156	Q1148-D1152 PolarHBondContact NE2-OD1 2.89Å; Q1148-D1152 PolarHBondContact NE2-OD2 3.29Å; Q1148-D1152 WeakPolarHBondContact O-CB 3.08Å; Q1148-D1152 VanDerWaalsContact O-CG 3.32Å; Q1148-D1152 PolarHBondContact O-N 3.37Å; D1149-D1152 PolarHBondContact O-N 2.9Å; Q1150-D1152 VanDerWaalsContact C-N 3.34Å; Q1150-D1152 PolarHBondContact O-N 3.49Å; D1152-N1155 PolarHBondContact O-N 2.85Å; D1152-L1156 VanDerWaalsContact O-CB 3.29Å; D1152-L1156 WeakPolarHBondContact O-CB 3.43Å; D1152-L1156 PolarHBondContact O-N 3.27Å
1153	Q	91	Very high	91.6	Very high	109 Å²	109	90.1 Å²	90.1	51%	0.509	44%	0.437	S	S	.	.	H	α-helix	trans	-65.7	-43.5	168.3	-173.3	178.3	112.4	0	0	111.4	D1149 Q1150 L1156 R1157	D1149-Q1153 VanDerWaalsContact O-CB 3.24Å; D1149-Q1153 WeakPolarHBondContact O-CB 3.29Å; D1149-Q1153 PolarHBondContact O-N 2.79Å; Q1150-Q1153 PolarHBondContact O-N 2.83Å; Q1153-L1156 PolarHBondContact O-N 2.86Å; Q1153-R1157 WeakPolarHBondContact O-CG 3.31Å; Q1153-R1157 PolarHBondContact O-N 2.88Å
1154	L	93.1	Very high	91.6	Very high	65 Å²	65	94.8 Å²	94.8	34%	0.34	46%	0.459	S	S	.	.	H	α-helix	trans	-65.7	-37.7	173.2	-73	169.6	0	0	0	111.3	Q1150 K1151 L1156 R1157 L1158	Q1150-L1154 WeakPolarHBondContact O-CB 3.46Å; Q1150-L1154 VanDerWaalsContact O-CG 3.27Å; Q1150-L1154 WeakPolarHBondContact O-CG 3.42Å; Q1150-L1154 PolarHBondContact O-N 3.15Å; K1151-L1154 PolarHBondContact O-N 3.37Å; L1154-L1156 VanDerWaalsContact C-N 3.33Å; L1154-L1156 PolarHBondContact O-N 3.25Å; L1154-R1157 PolarHBondContact O-N 2.71Å; L1154-L1158 VanDerWaalsContact O-CB 3.27Å; L1154-L1158 WeakPolarHBondContact O-CB 3.13Å; L1154-L1158 PolarHBondContact O-N 2.85Å
1155	N	92.3	Very high	91.6	Very high	60 Å²	60	95 Å²	95	32%	0.321	46%	0.461	S	S	.	.	H	α-helix	trans	-66.6	-35.7	174.7	-162.8	-86.3	0	0	0	111.5	K1151 D1152 K1159	K1151-N1155 WeakPolarHBondContact O-CB 3.16Å; K1151-N1155 PolarHBondContact O-N 3.35Å; D1152-N1155 PolarHBondContact O-N 2.85Å; N1155-K1159 WeakPolarHBondContact O-CB 3.49Å; N1155-K1159 WeakPolarHBondContact O-CD 3.13Å; N1155-K1159 VanDerWaalsContact O-CG 3.26Å; N1155-K1159 WeakPolarHBondContact O-CG 3.35Å; N1155-K1159 PolarHBondContact O-N 3.01Å; N1155-K1159 WeakPolarHBondContact OD1-CD 3.42Å; N1155-K1159 WeakPolarHBondContact OD1-CE 2.98Å; N1155-K1159 PolarHBondContact OD1-NZ 3.03Å
1156	L	95.5	Very high	91.6	Very high	122 Å²	122	92.3 Å²	92.3	64%	0.639	45%	0.451	S	S	*	.	H	α-helix	trans	-70.2	-40.5	173.4	-172.9	64	0	0	0	111.8	D1152 Q1153 L1154 K1159 A1160	D1152-L1156 VanDerWaalsContact O-CB 3.29Å; D1152-L1156 WeakPolarHBondContact O-CB 3.43Å; D1152-L1156 PolarHBondContact O-N 3.27Å; Q1153-L1156 PolarHBondContact O-N 2.86Å; L1154-L1156 VanDerWaalsContact C-N 3.33Å; L1154-L1156 PolarHBondContact O-N 3.25Å; L1156-K1159 PolarHBondContact O-N 2.73Å; L1156-A1160 PolarHBondContact O-N 2.82Å
1157	R	92.1	Very high	91.8	Very high	102 Å²	102	95 Å²	95	39%	0.385	46%	0.458	S	S	.	.	H	α-helix	trans	-61.4	-46.1	170.1	-71.9	-177	-164.7	173.3	8.2	111.2	E1094 Q1153 L1154 K1159 A1160 L1161	E1094-R1157 IonicContact OE2-NH1 2.65Å; E1094-R1157 PolarHBondContact OE2-NH1 3.09Å; E1094-R1157 VanDerWaalsContact OE2-NH1 3.08Å; Q1153-R1157 WeakPolarHBondContact O-CG 3.31Å; Q1153-R1157 PolarHBondContact O-N 2.88Å; L1154-R1157 PolarHBondContact O-N 2.71Å; R1157-K1159 VanDerWaalsContact C-N 3.33Å; R1157-K1159 PolarHBondContact O-N 3.48Å; R1157-A1160 CarbonylContact O-C 3.5Å; R1157-A1160 WeakPolarHBondContact O-CA 3.44Å; R1157-A1160 WeakPolarHBondContact O-CB 3.47Å; R1157-A1160 PolarHBondContact O-N 2.92Å; R1157-L1161 WeakPolarHBondContact O-CB 3.21Å; R1157-L1161 WeakPolarHBondContact O-CG 3.39Å; R1157-L1161 PolarHBondContact O-N 2.67Å
1158	L	91.9	Very high	91.8	Very high	114 Å²	114	93.5 Å²	93.5	60%	0.597	46%	0.458	S	S	*	.	H	α-helix	trans	-61.4	-38.4	176.3	-176.6	63.3	0	0	0	112.1	L1154 A1160 K1162	L1154-L1158 VanDerWaalsContact O-CB 3.27Å; L1154-L1158 WeakPolarHBondContact O-CB 3.13Å; L1154-L1158 PolarHBondContact O-N 2.85Å; L1158-A1160 VanDerWaalsContact C-N 3.3Å; L1158-A1160 PolarHBondContact O-N 2.61Å; L1158-K1162 WeakPolarHBondContact O-CB 3.29Å; L1158-K1162 PolarHBondContact O-N 2.82Å
1159	K	94.2	Very high	91.6	Very high	114 Å²	114	96.2 Å²	96.2	50%	0.496	47%	0.471	S	S	.	.	H	α-helix	trans	-70.2	-21.5	172.6	-78.9	165.1	173.1	157.6	0	114	N1155 L1156 R1157 R1163	N1155-K1159 WeakPolarHBondContact O-CB 3.49Å; N1155-K1159 WeakPolarHBondContact O-CD 3.13Å; N1155-K1159 VanDerWaalsContact O-CG 3.26Å; N1155-K1159 WeakPolarHBondContact O-CG 3.35Å; N1155-K1159 PolarHBondContact O-N 3.01Å; N1155-K1159 WeakPolarHBondContact OD1-CD 3.42Å; N1155-K1159 WeakPolarHBondContact OD1-CE 2.98Å; N1155-K1159 PolarHBondContact OD1-NZ 3.03Å; L1156-K1159 PolarHBondContact O-N 2.73Å; R1157-K1159 VanDerWaalsContact C-N 3.33Å; R1157-K1159 PolarHBondContact O-N 3.48Å; K1159-R1163 WeakPolarHBondContact O-CG 3.31Å; K1159-R1163 PolarHBondContact O-N 3.47Å
1160	A	87.8	Confident	91.7	Very high	49 Å²	49	96.4 Å²	96.4	41%	0.405	47%	0.468	S	S	.	.	H	α-helix	trans	-84.7	-49.2	173.3	0	0	0	0	0	111.1	L1156 R1157 L1158 K1162 R1163 Q1164	L1156-A1160 PolarHBondContact O-N 2.82Å; R1157-A1160 CarbonylContact O-C 3.5Å; R1157-A1160 WeakPolarHBondContact O-CA 3.44Å; R1157-A1160 WeakPolarHBondContact O-CB 3.47Å; R1157-A1160 PolarHBondContact O-N 2.92Å; L1158-A1160 VanDerWaalsContact C-N 3.3Å; L1158-A1160 PolarHBondContact O-N 2.61Å; A1160-K1162 VanDerWaalsContact C-N 3.31Å; A1160-K1162 PolarHBondContact O-N 2.77Å; A1160-R1163 WeakPolarHBondContact O-CB 3.41Å; A1160-R1163 PolarHBondContact O-N 3.24Å; A1160-R1163 VanDerWaalsContact O-N 3.08Å; A1160-Q1164 PolarHBondContact O-N 2.75Å
1161	L	91.8	Very high	91.9	Very high	78 Å²	78	95.7 Å²	95.7	41%	0.408	47%	0.469	S	S	.	.	H	α-helix	trans	-58.5	-41.2	173.4	-72.9	170.6	0	0	0	111.5	R1157 Q1164 M1165	R1157-L1161 WeakPolarHBondContact O-CB 3.21Å; R1157-L1161 WeakPolarHBondContact O-CG 3.39Å; R1157-L1161 PolarHBondContact O-N 2.67Å; L1161-Q1164 PolarHBondContact O-N 3.43Å; L1161-M1165 PolarHBondContact O-N 2.68Å
1162	K	91.6	Very high	91.6	Very high	118 Å²	118	94.7 Å²	94.7	51%	0.513	47%	0.468	S	S	.	.	H	α-helix	trans	-61.9	-45.8	172.3	177.9	162.3	-178.7	167.1	0	111.6	L1158 A1160 Q1164 M1165 D1166	L1158-K1162 WeakPolarHBondContact O-CB 3.29Å; L1158-K1162 PolarHBondContact O-N 2.82Å; A1160-K1162 VanDerWaalsContact C-N 3.31Å; A1160-K1162 PolarHBondContact O-N 2.77Å; K1162-Q1164 PolarHBondContact O-N 2.82Å; K1162-M1165 CarbonylContact O-C 3.53Å; K1162-M1165 WeakPolarHBondContact O-CA 3.34Å; K1162-M1165 WeakPolarHBondContact O-CB 3.48Å; K1162-M1165 PolarHBondContact O-N 3.22Å; K1162-D1166 WeakPolarHBondContact CE-OD1 3.28Å; K1162-D1166 WeakPolarHBondContact CG-OD2 3.46Å; K1162-D1166 IonicContact NZ-OD1 3.51Å; K1162-D1166 PolarHBondContact O-N 3.15Å
1163	R	92.6	Very high	91.6	Very high	142 Å²	142	96.2 Å²	96.2	54%	0.536	48%	0.476	S	S	.	.	H	α-helix	trans	-59.4	-34.3	174.7	-85	179.9	168.1	85.4	-10.4	113	S85 K1159 A1160 E1167	S85-R1163 PolarHBondContact OG-NH2 2.84Å; K1159-R1163 WeakPolarHBondContact O-CG 3.31Å; K1159-R1163 PolarHBondContact O-N 3.47Å; A1160-R1163 WeakPolarHBondContact O-CB 3.41Å; A1160-R1163 PolarHBondContact O-N 3.24Å; A1160-R1163 VanDerWaalsContact O-N 3.08Å; R1163-E1167 VanDerWaalsContact O-CB 3.29Å; R1163-E1167 WeakPolarHBondContact O-CB 3.35Å; R1163-E1167 PolarHBondContact O-N 3.45Å
1164	Q	87.9	Confident	91.8	Very high	123 Å²	123	97.2 Å²	97.2	58%	0.575	48%	0.475	S	S	*	.	H	α-helix	trans	-72.9	-32.8	174.7	-69.1	-179.4	-61.9	0	0	112.6	A1160 L1161 K1162 A1168	A1160-Q1164 PolarHBondContact O-N 2.75Å; L1161-Q1164 PolarHBondContact O-N 3.43Å; K1162-Q1164 PolarHBondContact O-N 2.82Å; Q1164-A1168 VanDerWaalsContact O-CB 3.22Å; Q1164-A1168 WeakPolarHBondContact O-CB 3.43Å; Q1164-A1168 PolarHBondContact O-N 2.75Å
1165	M	92.3	Very high	91.8	Very high	107 Å²	107	99.7 Å²	99.7	53%	0.527	49%	0.489	S	S	.	.	H	α-helix	trans	-65.3	-51	169.2	179.6	-166.9	-59.7	0	0	110.7	L1161 K1162 E1167 A1168 E1169	L1161-M1165 PolarHBondContact O-N 2.68Å; K1162-M1165 CarbonylContact O-C 3.53Å; K1162-M1165 WeakPolarHBondContact O-CA 3.34Å; K1162-M1165 WeakPolarHBondContact O-CB 3.48Å; K1162-M1165 PolarHBondContact O-N 3.22Å; M1165-E1167 VanDerWaalsContact C-N 3.31Å; M1165-E1167 PolarHBondContact O-N 3.01Å; M1165-A1168 PolarHBondContact O-N 2.89Å; M1165-A1168 VanDerWaalsContact O-N 3.12Å; M1165-E1169 WeakPolarHBondContact O-CG 3.14Å; M1165-E1169 PolarHBondContact O-N 3.18Å
1166	D	92.8	Very high	91.8	Very high	61 Å²	61	100.2 Å²	100.2	33%	0.326	49%	0.489	S	S	.	.	H	α-helix	trans	-56.5	-44.7	177.1	-54.6	-34.7	0	0	0	110.4	K1162 E1169 E1170	K1162-D1166 WeakPolarHBondContact CE-OD1 3.28Å; K1162-D1166 WeakPolarHBondContact CG-OD2 3.46Å; K1162-D1166 IonicContact NZ-OD1 3.51Å; K1162-D1166 PolarHBondContact O-N 3.15Å; D1166-E1169 PolarHBondContact O-N 2.93Å; D1166-E1170 PolarHBondContact O-N 3.41Å
1167	E	92.4	Very high	91.8	Very high	126 Å²	126	100.1 Å²	100.1	59%	0.589	49%	0.485	S	S	*	.	H	α-helix	trans	-67	-38.1	176.1	-176.8	169.7	-160.2	0	0	112.7	R1163 M1165 E1170 T1171	R1163-E1167 VanDerWaalsContact O-CB 3.29Å; R1163-E1167 WeakPolarHBondContact O-CB 3.35Å; R1163-E1167 PolarHBondContact O-N 3.45Å; M1165-E1167 VanDerWaalsContact C-N 3.31Å; M1165-E1167 PolarHBondContact O-N 3.01Å; E1167-E1170 PolarHBondContact O-N 2.69Å; E1167-T1171 WeakPolarHBondContact O-CG2 3.48Å; E1167-T1171 PolarHBondContact O-N 3.3Å
1168	A	88.6	Confident	91.9	Very high	43 Å²	43	99.2 Å²	99.2	36%	0.355	49%	0.488	S	S	.	.	H	α-helix	trans	-67	-43.2	174.9	0	0	0	0	0	111.8	Q1164 M1165 E1170 T1171 I1172	Q1164-A1168 VanDerWaalsContact O-CB 3.22Å; Q1164-A1168 WeakPolarHBondContact O-CB 3.43Å; Q1164-A1168 PolarHBondContact O-N 2.75Å; M1165-A1168 PolarHBondContact O-N 2.89Å; M1165-A1168 VanDerWaalsContact O-N 3.12Å; A1168-E1170 VanDerWaalsContact C-N 3.34Å; A1168-E1170 PolarHBondContact O-N 3.29Å; A1168-T1171 PolarHBondContact O-N 3.24Å; A1168-T1171 PolarHBondContact O-OG1 2.68Å; A1168-I1172 WeakPolarHBondContact O-CG1 3.43Å; A1168-I1172 PolarHBondContact O-N 2.69Å
1169	E	88.4	Confident	92	Very high	113 Å²	113	100.5 Å²	100.5	53%	0.528	49%	0.489	S	S	.	.	H	α-helix	trans	-59	-44.3	173.6	-73.4	-177.4	175.3	0	0	110.9	M1165 D1166 T1171 I1172 D1173	M1165-E1169 WeakPolarHBondContact O-CG 3.14Å; M1165-E1169 PolarHBondContact O-N 3.18Å; D1166-E1169 PolarHBondContact O-N 2.93Å; E1169-T1171 VanDerWaalsContact C-N 3.32Å; E1169-T1171 PolarHBondContact O-N 3.4Å; E1169-I1172 WeakPolarHBondContact O-CB 3.48Å; E1169-I1172 PolarHBondContact O-N 3.35Å; E1169-I1172 VanDerWaalsContact O-N 3.11Å; E1169-D1173 PolarHBondContact O-N 2.94Å
1170	E	92.6	Very high	92.1	Very high	108 Å²	108	99.7 Å²	99.7	51%	0.505	49%	0.485	S	S	.	.	H	α-helix	trans	-58.9	-38.9	171.4	-82.3	-161.5	-123.4	0	0	113	D1166 E1167 A1168 R1174	D1166-E1170 PolarHBondContact O-N 3.41Å; E1167-E1170 PolarHBondContact O-N 2.69Å; A1168-E1170 VanDerWaalsContact C-N 3.34Å; A1168-E1170 PolarHBondContact O-N 3.29Å; E1170-R1174 VanDerWaalsContact O-CD 3.27Å; E1170-R1174 WeakPolarHBondContact O-CD 3.18Å; E1170-R1174 WeakPolarHBondContact O-CG 3.43Å; E1170-R1174 PolarHBondContact O-N 2.77Å; E1170-R1174 PolarHBondContact O-NE 3.35Å; E1170-R1174 IonicContact OE2-CZ 3.87Å; E1170-R1174 IonicContact OE2-NE 3.81Å; E1170-R1174 IonicContact OE2-NH2 2.67Å; E1170-R1174 PolarHBondContact OE2-NH2 3.33Å
1171	T	92.4	Very high	92.4	Very high	59 Å²	59	102.3 Å²	102.3	36%	0.362	49%	0.487	S	S	.	.	H	α-helix	trans	-68.2	-35.6	174.4	64.2	0	0	0	0	112.8	E1167 A1168 E1169 R1174 L1175	E1167-T1171 WeakPolarHBondContact O-CG2 3.48Å; E1167-T1171 PolarHBondContact O-N 3.3Å; A1168-T1171 PolarHBondContact O-N 3.24Å; A1168-T1171 PolarHBondContact O-OG1 2.68Å; E1169-T1171 VanDerWaalsContact C-N 3.32Å; E1169-T1171 PolarHBondContact O-N 3.4Å; T1171-R1174 PolarHBondContact O-N 3.48Å; T1171-L1175 WeakPolarHBondContact O-CB 3.24Å; T1171-L1175 VanDerWaalsContact O-CG 3.28Å; T1171-L1175 WeakPolarHBondContact O-CG 3.43Å; T1171-L1175 PolarHBondContact O-N 3.49Å
1172	I	89.1	Confident	92.5	Very high	99 Å²	99	104 Å²	104	51%	0.508	50%	0.496	S	S	.	.	H	α-helix	trans	-65.2	-44.9	175.1	-69	165.3	0	0	0	110	A1168 E1169 R1174 L1175 E1176	A1168-I1172 WeakPolarHBondContact O-CG1 3.43Å; A1168-I1172 PolarHBondContact O-N 2.69Å; E1169-I1172 WeakPolarHBondContact O-CB 3.48Å; E1169-I1172 PolarHBondContact O-N 3.35Å; E1169-I1172 VanDerWaalsContact O-N 3.11Å; I1172-R1174 PolarHBondContact O-N 3.18Å; I1172-L1175 CarbonylContact O-C 3.56Å; I1172-L1175 PolarHBondContact O-N 2.99Å; I1172-L1175 VanDerWaalsContact O-N 3.16Å; I1172-E1176 HydrophobicContact CG2-CG 4.3Å; I1172-E1176 WeakPolarHBondContact O-CB 3.25Å; I1172-E1176 WeakPolarHBondContact O-CG 3.41Å; I1172-E1176 PolarHBondContact O-N 3.39Å
1173	D	93.5	Very high	92.6	Very high	108 Å²	108	103.6 Å²	103.6	58%	0.578	50%	0.496	S	S	*	.	H	α-helix	trans	-64.1	-38.5	177.5	-98	-17.4	0	0	0	112.7	E1169 E1176 H1177	E1169-D1173 PolarHBondContact O-N 2.94Å; D1173-E1176 PolarHBondContact O-N 3.4Å; D1173-H1177 WeakPolarHBondContact O-CB 3.31Å; D1173-H1177 PolarHBondContact O-N 3.41Å
1174	R	95.1	Very high	92.8	Very high	130 Å²	130	104.2 Å²	104.2	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-63.4	-41.1	172.6	-66.1	161.7	-160.9	169.5	2.3	111.3	E1170 T1171 I1172 H1177 N1178	E1170-R1174 VanDerWaalsContact O-CD 3.27Å; E1170-R1174 WeakPolarHBondContact O-CD 3.18Å; E1170-R1174 WeakPolarHBondContact O-CG 3.43Å; E1170-R1174 PolarHBondContact O-N 2.77Å; E1170-R1174 PolarHBondContact O-NE 3.35Å; E1170-R1174 IonicContact OE2-CZ 3.87Å; E1170-R1174 IonicContact OE2-NE 3.81Å; E1170-R1174 IonicContact OE2-NH2 2.67Å; E1170-R1174 PolarHBondContact OE2-NH2 3.33Å; T1171-R1174 PolarHBondContact O-N 3.48Å; I1172-R1174 PolarHBondContact O-N 3.18Å; R1174-H1177 PolarHBondContact O-N 2.89Å; R1174-N1178 WeakPolarHBondContact O-CB 3.37Å; R1174-N1178 VanDerWaalsContact O-CG 3.3Å; R1174-N1178 PolarHBondContact O-N 2.73Å; R1174-N1178 PolarHBondContact O-ND2 3.34Å
1175	L	92.2	Very high	93.1	Very high	118 Å²	118	102.6 Å²	102.6	62%	0.618	49%	0.491	S	S	*	.	H	α-helix	trans	-70.1	-39.3	176	-72.6	170.2	0	0	0	112.4	T1171 I1172 N1178 K1179	T1171-L1175 WeakPolarHBondContact O-CB 3.24Å; T1171-L1175 VanDerWaalsContact O-CG 3.28Å; T1171-L1175 WeakPolarHBondContact O-CG 3.43Å; T1171-L1175 PolarHBondContact O-N 3.49Å; I1172-L1175 CarbonylContact O-C 3.56Å; I1172-L1175 PolarHBondContact O-N 2.99Å; I1172-L1175 VanDerWaalsContact O-N 3.16Å; L1175-N1178 PolarHBondContact O-N 3.27Å; L1175-K1179 VanDerWaalsContact O-CB 3.28Å; L1175-K1179 WeakPolarHBondContact O-CB 3.26Å; L1175-K1179 PolarHBondContact O-N 2.83Å
1176	E	92.9	Very high	93.2	Very high	70 Å²	70	102.1 Å²	102.1	33%	0.327	49%	0.49	S	S	.	.	H	α-helix	trans	-59.9	-44.8	171.5	-83.5	-101.8	125	0	0	110.9	I1172 D1173 K1179 K1180	I1172-E1176 HydrophobicContact CG2-CG 4.3Å; I1172-E1176 WeakPolarHBondContact O-CB 3.25Å; I1172-E1176 WeakPolarHBondContact O-CG 3.41Å; I1172-E1176 PolarHBondContact O-N 3.39Å; D1173-E1176 PolarHBondContact O-N 3.4Å; E1176-K1179 PolarHBondContact O-N 2.98Å; E1176-K1180 WeakPolarHBondContact O-CB 3.4Å; E1176-K1180 VanDerWaalsContact O-CD 3.29Å; E1176-K1180 WeakPolarHBondContact O-CD 3.42Å; E1176-K1180 WeakPolarHBondContact O-CG 3.47Å; E1176-K1180 PolarHBondContact O-N 3.27Å; E1176-K1180 WeakPolarHBondContact OE2-CE 3.46Å; E1176-K1180 IonicContact OE2-NZ 2.8Å; E1176-K1180 PolarHBondContact OE2-NZ 2.89Å
1177	H	95.9	Very high	93.3	Very high	120 Å²	120	102.3 Å²	102.3	56%	0.556	49%	0.491	S	S	*	.	H	α-helix	trans	-62.3	-46.4	175.7	-172.2	100.6	0	0	0	111.3	D1173 R1174 K1179 K1180 K1181	D1173-H1177 WeakPolarHBondContact O-CB 3.31Å; D1173-H1177 PolarHBondContact O-N 3.41Å; R1174-H1177 PolarHBondContact O-N 2.89Å; H1177-K1179 PolarHBondContact O-N 3.23Å; H1177-K1180 PolarHBondContact O-N 3.48Å; H1177-K1181 PolarHBondContact O-N 3.41Å
1178	N	93.9	Very high	93.6	Very high	84 Å²	84	102.5 Å²	102.5	45%	0.449	49%	0.492	S	S	.	.	H	α-helix	trans	-62.9	-40.6	176.7	-73.5	-24.9	0	0	0	112.1	R1174 L1175 K1181 L1182	R1174-N1178 WeakPolarHBondContact O-CB 3.37Å; R1174-N1178 VanDerWaalsContact O-CG 3.3Å; R1174-N1178 PolarHBondContact O-N 2.73Å; R1174-N1178 PolarHBondContact O-ND2 3.34Å; L1175-N1178 PolarHBondContact O-N 3.27Å; N1178-K1181 PolarHBondContact O-N 3.37Å; N1178-L1182 WeakPolarHBondContact O-CB 3.18Å; N1178-L1182 WeakPolarHBondContact O-CG 3.25Å; N1178-L1182 PolarHBondContact O-N 2.89Å
1179	K	93.5	Very high	93.8	Very high	140 Å²	140	106 Å²	106	61%	0.609	50%	0.5	S	S	*	.	H	α-helix	trans	-61.2	-45.1	172.3	176.8	-175.4	172.4	-169.8	0	111.7	L1175 E1176 H1177 K1181 L1182 H1183	L1175-K1179 VanDerWaalsContact O-CB 3.28Å; L1175-K1179 WeakPolarHBondContact O-CB 3.26Å; L1175-K1179 PolarHBondContact O-N 2.83Å; E1176-K1179 PolarHBondContact O-N 2.98Å; H1177-K1179 PolarHBondContact O-N 3.23Å; K1179-K1181 VanDerWaalsContact C-N 3.32Å; K1179-K1181 PolarHBondContact O-N 3.37Å; K1179-L1182 PolarHBondContact O-N 3.26Å; K1179-H1183 WeakPolarHBondContact O-CB 3.39Å; K1179-H1183 PolarHBondContact O-N 2.89Å
1180	K	96.1	Very high	94	Very high	98 Å²	98	105.5 Å²	105.5	43%	0.426	50%	0.498	S	S	.	.	H	α-helix	trans	-65.2	-33.1	176.5	-69.7	159.1	-167.5	167.3	0	111.8	E1176 H1177 R1184	E1176-K1180 WeakPolarHBondContact O-CB 3.4Å; E1176-K1180 VanDerWaalsContact O-CD 3.29Å; E1176-K1180 WeakPolarHBondContact O-CD 3.42Å; E1176-K1180 WeakPolarHBondContact O-CG 3.47Å; E1176-K1180 PolarHBondContact O-N 3.27Å; E1176-K1180 WeakPolarHBondContact OE2-CE 3.46Å; E1176-K1180 IonicContact OE2-NZ 2.8Å; E1176-K1180 PolarHBondContact OE2-NZ 2.89Å; H1177-K1180 PolarHBondContact O-N 3.48Å; K1180-R1184 WeakPolarHBondContact O-CG 3.48Å; K1180-R1184 PolarHBondContact O-N 3.5Å
1181	K	95.4	Very high	94.1	Very high	104 Å²	104	105.7 Å²	105.7	45%	0.452	50%	0.499	S	S	.	.	H	α-helix	trans	-68.5	-53.6	171.4	-178.8	-178.5	-179.8	-75.7	0	111.5	H1177 N1178 K1179 H1183 R1184 E1185	H1177-K1181 PolarHBondContact O-N 3.41Å; N1178-K1181 PolarHBondContact O-N 3.37Å; K1179-K1181 VanDerWaalsContact C-N 3.32Å; K1179-K1181 PolarHBondContact O-N 3.37Å; K1181-H1183 PolarHBondContact O-N 3.25Å; K1181-R1184 PolarHBondContact O-N 3.06Å; K1181-R1184 VanDerWaalsContact O-N 3.12Å; K1181-E1185 IonicContact NZ-OE2 2.66Å; K1181-E1185 PolarHBondContact NZ-OE2 3.28Å; K1181-E1185 WeakPolarHBondContact O-CB 2.84Å; K1181-E1185 PolarHBondContact O-N 2.89Å
1182	L	93.8	Very high	94.2	Very high	112 Å²	112	104.7 Å²	104.7	59%	0.586	50%	0.497	S	S	*	.	H	α-helix	trans	-61.6	-31.7	-179.7	-71.7	170.5	0	0	0	112.5	N1178 K1179 L1186	N1178-L1182 WeakPolarHBondContact O-CB 3.18Å; N1178-L1182 WeakPolarHBondContact O-CG 3.25Å; N1178-L1182 PolarHBondContact O-N 2.89Å; K1179-L1182 PolarHBondContact O-N 3.26Å; L1182-L1186 VanDerWaalsContact O-CB 3.3Å; L1182-L1186 WeakPolarHBondContact O-CB 3.43Å; L1182-L1186 PolarHBondContact O-N 3.42Å
1183	H	94	Very high	94.2	Very high	111 Å²	111	104.1 Å²	104.1	51%	0.514	50%	0.495	S	S	.	.	H	α-helix	trans	-65.8	-47.7	172.5	-168.3	-17.4	0	0	0	111.6	K1179 K1181 E1185 L1186 D1187	K1179-H1183 WeakPolarHBondContact O-CB 3.39Å; K1179-H1183 PolarHBondContact O-N 2.89Å; K1181-H1183 PolarHBondContact O-N 3.25Å; H1183-E1185 VanDerWaalsContact C-N 3.32Å; H1183-E1185 PolarHBondContact O-N 2.87Å; H1183-L1186 WeakPolarHBondContact O-CB 3.46Å; H1183-L1186 PolarHBondContact O-N 2.81Å; H1183-D1187 IonicContact CE1-OD1 2.69Å; H1183-D1187 PolarHBondContact CE1-OD1 2.91Å; H1183-D1187 IonicContact CE1-OD2 3.11Å; H1183-D1187 PolarHBondContact CE1-OD2 2.94Å; H1183-D1187 IonicContact CG-OD2 3.23Å; H1183-D1187 VanDerWaalsContact ND1-CG 3.3Å; H1183-D1187 IonicContact ND1-OD1 2.93Å; H1183-D1187 PolarHBondContact ND1-OD1 3.46Å; H1183-D1187 IonicContact ND1-OD2 2.63Å; H1183-D1187 PolarHBondContact ND1-OD2 3.35Å; H1183-D1187 PolarHBondContact O-N 3.45Å
1184	R	95.5	Very high	94.3	Very high	155 Å²	155	105.5 Å²	105.5	59%	0.585	50%	0.498	S	S	*	.	H	α-helix	trans	-61.5	-41.6	175.1	-68.7	169.5	-173.2	153.7	2	112	K1180 K1181 L1186 D1187 E1188	K1180-R1184 WeakPolarHBondContact O-CG 3.48Å; K1180-R1184 PolarHBondContact O-N 3.5Å; K1181-R1184 PolarHBondContact O-N 3.06Å; K1181-R1184 VanDerWaalsContact O-N 3.12Å; R1184-L1186 VanDerWaalsContact C-N 3.3Å; R1184-L1186 PolarHBondContact O-N 2.88Å; R1184-D1187 PolarHBondContact O-N 3.5Å; R1184-D1187 VanDerWaalsContact O-N 3.17Å; R1184-E1188 WeakPolarHBondContact O-CB 3.31Å; R1184-E1188 VanDerWaalsContact O-CG 3.29Å; R1184-E1188 WeakPolarHBondContact O-CG 3.2Å; R1184-E1188 PolarHBondContact O-N 3.34Å
1185	E	94.9	Very high	94.3	Very high	88 Å²	88	104 Å²	104	41%	0.411	50%	0.496	S	S	.	.	H	α-helix	trans	-64.1	-36.4	177.5	-165.1	163.8	173	0	0	111.2	K1181 H1183 Q1189	K1181-E1185 IonicContact NZ-OE2 2.66Å; K1181-E1185 PolarHBondContact NZ-OE2 3.28Å; K1181-E1185 WeakPolarHBondContact O-CB 2.84Å; K1181-E1185 PolarHBondContact O-N 2.89Å; H1183-E1185 VanDerWaalsContact C-N 3.32Å; H1183-E1185 PolarHBondContact O-N 2.87Å; E1185-Q1189 WeakPolarHBondContact O-CB 3.18Å; E1185-Q1189 WeakPolarHBondContact O-CG 3.48Å; E1185-Q1189 PolarHBondContact O-N 3.36Å; E1185-Q1189 VanDerWaalsContact O-N 3.08Å
1186	L	94.8	Very high	94.3	Very high	98 Å²	98	102.9 Å²	102.9	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-68	-40.9	170.3	176.9	63	0	0	0	112.5	L1182 H1183 R1184 Q1189 Q1190	L1182-L1186 VanDerWaalsContact O-CB 3.3Å; L1182-L1186 WeakPolarHBondContact O-CB 3.43Å; L1182-L1186 PolarHBondContact O-N 3.42Å; H1183-L1186 WeakPolarHBondContact O-CB 3.46Å; H1183-L1186 PolarHBondContact O-N 2.81Å; R1184-L1186 VanDerWaalsContact C-N 3.3Å; R1184-L1186 PolarHBondContact O-N 2.88Å; L1186-Q1189 PolarHBondContact O-N 2.77Å; L1186-Q1190 WeakPolarHBondContact O-CG 3.39Å; L1186-Q1190 PolarHBondContact O-N 2.68Å
1187	D	95.3	Very high	94.1	Very high	65 Å²	65	103.4 Å²	103.4	35%	0.348	50%	0.496	S	S	.	.	H	α-helix	trans	-67.6	-40.8	179	-57.7	-21.2	0	0	0	111	H1183 R1184 Q1190 E1191	H1183-D1187 IonicContact CE1-OD1 2.69Å; H1183-D1187 PolarHBondContact CE1-OD1 2.91Å; H1183-D1187 IonicContact CE1-OD2 3.11Å; H1183-D1187 PolarHBondContact CE1-OD2 2.94Å; H1183-D1187 IonicContact CG-OD2 3.23Å; H1183-D1187 VanDerWaalsContact ND1-CG 3.3Å; H1183-D1187 IonicContact ND1-OD1 2.93Å; H1183-D1187 PolarHBondContact ND1-OD1 3.46Å; H1183-D1187 IonicContact ND1-OD2 2.63Å; H1183-D1187 PolarHBondContact ND1-OD2 3.35Å; H1183-D1187 PolarHBondContact O-N 3.45Å; R1184-D1187 PolarHBondContact O-N 3.5Å; R1184-D1187 VanDerWaalsContact O-N 3.17Å; D1187-Q1190 WeakPolarHBondContact O-CB 3.4Å; D1187-Q1190 PolarHBondContact O-N 2.94Å; D1187-E1191 PolarHBondContact O-N 2.68Å
1188	E	96.9	Very high	94	Very high	130 Å²	130	100.9 Å²	100.9	61%	0.607	49%	0.492	S	S	*	.	H	α-helix	trans	-62.2	-39.9	172.6	-74.3	169.7	-153.7	0	0	111.5	R1184 E1191 A1192	R1184-E1188 WeakPolarHBondContact O-CB 3.31Å; R1184-E1188 VanDerWaalsContact O-CG 3.29Å; R1184-E1188 WeakPolarHBondContact O-CG 3.2Å; R1184-E1188 PolarHBondContact O-N 3.34Å; E1188-E1191 PolarHBondContact O-N 3.15Å; E1188-A1192 WeakPolarHBondContact O-CB 3.13Å; E1188-A1192 PolarHBondContact O-N 2.96Å
1189	Q	92.9	Very high	94.1	Very high	115 Å²	115	102.2 Å²	102.2	54%	0.537	50%	0.495	S	S	.	.	H	α-helix	trans	-69.5	-31.2	173.3	-70.6	-68.6	-24.1	0	0	112.7	E1185 L1186 N1193	E1185-Q1189 WeakPolarHBondContact O-CB 3.18Å; E1185-Q1189 WeakPolarHBondContact O-CG 3.48Å; E1185-Q1189 PolarHBondContact O-N 3.36Å; E1185-Q1189 VanDerWaalsContact O-N 3.08Å; L1186-Q1189 PolarHBondContact O-N 2.77Å; Q1189-N1193 WeakPolarHBondContact O-CB 2.79Å; Q1189-N1193 PolarHBondContact O-N 2.72Å; Q1189-N1193 VanDerWaalsContact O-N 3.1Å; Q1189-N1193 PolarHBondContact O-ND2 3.21Å
1190	Q	92.2	Very high	94	Very high	103 Å²	103	99.8 Å²	99.8	48%	0.481	49%	0.488	S	S	.	.	H	α-helix	trans	-68.5	-47	170.9	-74.7	177	38.2	0	0	110.9	L1186 D1187 A1192 N1193 E1194	L1186-Q1190 WeakPolarHBondContact O-CG 3.39Å; L1186-Q1190 PolarHBondContact O-N 2.68Å; D1187-Q1190 WeakPolarHBondContact O-CB 3.4Å; D1187-Q1190 PolarHBondContact O-N 2.94Å; Q1190-A1192 VanDerWaalsContact C-N 3.35Å; Q1190-A1192 PolarHBondContact O-N 3.5Å; Q1190-N1193 CarbonylContact O-C 3.48Å; Q1190-N1193 WeakPolarHBondContact O-CA 3.07Å; Q1190-N1193 WeakPolarHBondContact O-CB 3.15Å; Q1190-N1193 PolarHBondContact O-N 2.74Å; Q1190-N1193 VanDerWaalsContact O-N 3.09Å; Q1190-E1194 PolarHBondContact O-N 2.75Å
1191	E	95.3	Very high	93.8	Very high	113 Å²	113	101.9 Å²	101.9	53%	0.528	50%	0.497	S	S	.	.	H	α-helix	trans	-60.1	-44.2	176.9	-159.8	-165	142.3	0	0	111.2	D1187 E1188 N1193 E1194 Q1195	D1187-E1191 PolarHBondContact O-N 2.68Å; E1188-E1191 PolarHBondContact O-N 3.15Å; E1191-N1193 VanDerWaalsContact C-N 3.3Å; E1191-N1193 PolarHBondContact O-N 2.68Å; E1191-E1194 PolarHBondContact O-N 3.37Å; E1191-E1194 VanDerWaalsContact O-N 3.11Å; E1191-Q1195 WeakPolarHBondContact O-CB 3.15Å; E1191-Q1195 VanDerWaalsContact O-CG 3.31Å; E1191-Q1195 WeakPolarHBondContact O-CG 3.06Å; E1191-Q1195 PolarHBondContact O-N 3.31Å; E1191-Q1195 PolarHBondContact OE1-NE2 2.62Å
1192	A	94	Very high	93.6	Very high	38 Å²	38	98.9 Å²	98.9	31%	0.314	49%	0.492	S	S	.	.	H	α-helix	trans	-58.8	-40.3	174.4	0	0	0	0	0	112.4	E1188 Q1190 Q1195 L1196	E1188-A1192 WeakPolarHBondContact O-CB 3.13Å; E1188-A1192 PolarHBondContact O-N 2.96Å; Q1190-A1192 VanDerWaalsContact C-N 3.35Å; Q1190-A1192 PolarHBondContact O-N 3.5Å; A1192-Q1195 PolarHBondContact O-N 3.37Å; A1192-L1196 WeakPolarHBondContact O-CB 2.92Å; A1192-L1196 WeakPolarHBondContact O-CG 3.21Å; A1192-L1196 PolarHBondContact O-N 2.98Å
1193	N	89.5	Confident	93.4	Very high	86 Å²	86	98.1 Å²	98.1	46%	0.46	49%	0.488	S	S	.	.	H	α-helix	trans	-68.5	-35.4	174	-87.9	-81.2	0	0	0	112.9	Q1189 Q1190 E1191 N1197	Q1189-N1193 WeakPolarHBondContact O-CB 2.79Å; Q1189-N1193 PolarHBondContact O-N 2.72Å; Q1189-N1193 VanDerWaalsContact O-N 3.1Å; Q1189-N1193 PolarHBondContact O-ND2 3.21Å; Q1190-N1193 CarbonylContact O-C 3.48Å; Q1190-N1193 WeakPolarHBondContact O-CA 3.07Å; Q1190-N1193 WeakPolarHBondContact O-CB 3.15Å; Q1190-N1193 PolarHBondContact O-N 2.74Å; Q1190-N1193 VanDerWaalsContact O-N 3.09Å; E1191-N1193 VanDerWaalsContact C-N 3.3Å; E1191-N1193 PolarHBondContact O-N 2.68Å; N1193-N1197 VanDerWaalsContact O-CB 3.28Å; N1193-N1197 WeakPolarHBondContact O-CB 3.02Å; N1193-N1197 PolarHBondContact O-N 2.64Å; N1193-N1197 PolarHBondContact O-ND2 2.67Å
1194	E	95.9	Very high	93.3	Very high	137 Å²	137	101.7 Å²	101.7	64%	0.64	50%	0.497	S	S	*	.	H	α-helix	trans	-70	-38.8	174.4	-71	-161.6	162.7	0	0	112.2	Q1190 E1191 N1197 S1198	Q1190-E1194 PolarHBondContact O-N 2.75Å; E1191-E1194 PolarHBondContact O-N 3.37Å; E1191-E1194 VanDerWaalsContact O-N 3.11Å; E1194-N1197 PolarHBondContact O-N 3.28Å; E1194-S1198 VanDerWaalsContact O-CB 3.27Å; E1194-S1198 WeakPolarHBondContact O-CB 3.38Å; E1194-S1198 PolarHBondContact O-N 2.94Å; E1194-S1198 PolarHBondContact O-OG 3.22Å
1195	Q	94.3	Very high	92.9	Very high	99 Å²	99	97.7 Å²	97.7	46%	0.463	49%	0.493	S	S	.	.	H	α-helix	trans	-62.2	-48.3	172.5	-70	179.5	22.1	0	0	110.9	E1191 A1192 S1198 Q1199	E1191-Q1195 WeakPolarHBondContact O-CB 3.15Å; E1191-Q1195 VanDerWaalsContact O-CG 3.31Å; E1191-Q1195 WeakPolarHBondContact O-CG 3.06Å; E1191-Q1195 PolarHBondContact O-N 3.31Å; E1191-Q1195 PolarHBondContact OE1-NE2 2.62Å; A1192-Q1195 PolarHBondContact O-N 3.37Å; Q1195-S1198 WeakPolarHBondContact O-CB 3.16Å; Q1195-S1198 PolarHBondContact O-N 2.79Å; Q1195-S1198 VanDerWaalsContact O-N 3.15Å; Q1195-Q1199 WeakPolarHBondContact O-CG 3.47Å; Q1195-Q1199 PolarHBondContact O-N 3.09Å
1196	L	92.6	Very high	92.6	Very high	94 Å²	94	98.9 Å²	98.9	49%	0.492	50%	0.498	S	S	.	.	H	α-helix	trans	-62.6	-43.1	175.5	-74.3	171.2	0	0	0	112.2	A1192 S1198 Q1199 L1200	A1192-L1196 WeakPolarHBondContact O-CB 2.92Å; A1192-L1196 WeakPolarHBondContact O-CG 3.21Å; A1192-L1196 PolarHBondContact O-N 2.98Å; L1196-S1198 VanDerWaalsContact C-N 3.26Å; L1196-S1198 PolarHBondContact O-N 2.68Å; L1196-Q1199 PolarHBondContact O-N 2.82Å; L1196-L1200 WeakPolarHBondContact O-CB 3.25Å; L1196-L1200 WeakPolarHBondContact O-CG 3.22Å; L1196-L1200 PolarHBondContact O-N 2.76Å
1197	N	89.8	Confident	91.9	Very high	82 Å²	82	100.8 Å²	100.8	44%	0.439	51%	0.506	S	S	.	.	H	α-helix	trans	-63.7	-32.6	174	-86.9	-75.2	0	0	0	112.3	N1193 E1194 K1201	N1193-N1197 VanDerWaalsContact O-CB 3.28Å; N1193-N1197 WeakPolarHBondContact O-CB 3.02Å; N1193-N1197 PolarHBondContact O-N 2.64Å; N1193-N1197 PolarHBondContact O-ND2 2.67Å; E1194-N1197 PolarHBondContact O-N 3.28Å; N1197-K1201 WeakPolarHBondContact O-CB 3.42Å; N1197-K1201 WeakPolarHBondContact O-CD 3.48Å; N1197-K1201 WeakPolarHBondContact O-CG 3.4Å; N1197-K1201 PolarHBondContact O-N 3.5Å
1198	S	94.1	Very high	91.1	Very high	67 Å²	67	100.4 Å²	100.4	47%	0.469	51%	0.509	S	S	.	.	H	α-helix	trans	-71.4	-40.2	175.5	-61.5	0	0	0	0	111.7	E1194 Q1195 L1196 K1201 A1202	E1194-S1198 VanDerWaalsContact O-CB 3.27Å; E1194-S1198 WeakPolarHBondContact O-CB 3.38Å; E1194-S1198 PolarHBondContact O-N 2.94Å; E1194-S1198 PolarHBondContact O-OG 3.22Å; Q1195-S1198 WeakPolarHBondContact O-CB 3.16Å; Q1195-S1198 PolarHBondContact O-N 2.79Å; Q1195-S1198 VanDerWaalsContact O-N 3.15Å; L1196-S1198 VanDerWaalsContact C-N 3.26Å; L1196-S1198 PolarHBondContact O-N 2.68Å; S1198-K1201 PolarHBondContact O-N 3.12Å; S1198-A1202 WeakPolarHBondContact O-CB 3.5Å; S1198-A1202 PolarHBondContact O-N 3.2Å
1199	Q	94.3	Very high	90.3	Very high	111 Å²	111	99.4 Å²	99.4	52%	0.519	50%	0.504	S	S	.	.	H	α-helix	trans	-62.9	-43.5	170.8	-68.3	173.4	22.5	0	0	111.6	Q1195 L1196 K1201 A1202 L1203	Q1195-Q1199 WeakPolarHBondContact O-CG 3.47Å; Q1195-Q1199 PolarHBondContact O-N 3.09Å; L1196-Q1199 PolarHBondContact O-N 2.82Å; Q1199-K1201 VanDerWaalsContact C-N 3.35Å; Q1199-K1201 PolarHBondContact O-N 2.76Å; Q1199-A1202 WeakPolarHBondContact O-CB 3.22Å; Q1199-A1202 PolarHBondContact O-N 3.41Å; Q1199-L1203 WeakPolarHBondContact O-CB 3.36Å; Q1199-L1203 WeakPolarHBondContact O-CG 3.2Å; Q1199-L1203 PolarHBondContact O-N 3.34Å
1200	L	91.7	Very high	89.4	Confident	90 Å²	90	97 Å²	97	47%	0.471	50%	0.499	S	S	.	.	H	α-helix	trans	-64.4	-36.2	175.3	-72.4	172.3	0	0	0	112.5	L1196 R1204	L1196-L1200 WeakPolarHBondContact O-CB 3.25Å; L1196-L1200 WeakPolarHBondContact O-CG 3.22Å; L1196-L1200 PolarHBondContact O-N 2.76Å; L1200-R1204 VanDerWaalsContact O-CB 3.3Å; L1200-R1204 WeakPolarHBondContact O-CB 3.45Å; L1200-R1204 WeakPolarHBondContact O-CD 3.42Å; L1200-R1204 WeakPolarHBondContact O-CG 3.46Å; L1200-R1204 PolarHBondContact O-N 2.82Å
1201	K	91.6	Very high	88.4	Confident	141 Å²	141	101.5 Å²	101.5	61%	0.613	51%	0.512	S	S	*	.	H	α-helix	trans	-66.4	-42.9	171.5	-75	164.9	-174.2	171.4	0	111.4	N1197 S1198 Q1199 R1204 S1205	N1197-K1201 WeakPolarHBondContact O-CB 3.42Å; N1197-K1201 WeakPolarHBondContact O-CD 3.48Å; N1197-K1201 WeakPolarHBondContact O-CG 3.4Å; N1197-K1201 PolarHBondContact O-N 3.5Å; S1198-K1201 PolarHBondContact O-N 3.12Å; Q1199-K1201 VanDerWaalsContact C-N 3.35Å; Q1199-K1201 PolarHBondContact O-N 2.76Å; K1201-R1204 PolarHBondContact O-N 3.44Å; K1201-S1205 WeakPolarHBondContact O-CB 3.27Å; K1201-S1205 PolarHBondContact O-N 2.94Å
1202	A	92.8	Very high	86.8	Confident	42 Å²	42	102.7 Å²	102.7	35%	0.347	52%	0.517	S	S	.	.	H	α-helix	trans	-60.1	-54.8	175.8	0	0	0	0	0	111.1	S1198 Q1199 R1204 S1205 E1206	S1198-A1202 WeakPolarHBondContact O-CB 3.5Å; S1198-A1202 PolarHBondContact O-N 3.2Å; Q1199-A1202 WeakPolarHBondContact O-CB 3.22Å; Q1199-A1202 PolarHBondContact O-N 3.41Å; A1202-R1204 VanDerWaalsContact C-N 3.31Å; A1202-R1204 PolarHBondContact O-N 3.24Å; A1202-S1205 CarbonylContact O-C 3.58Å; A1202-S1205 WeakPolarHBondContact O-CA 3.36Å; A1202-S1205 WeakPolarHBondContact O-CB 3.12Å; A1202-S1205 PolarHBondContact O-N 2.72Å; A1202-S1205 PolarHBondContact O-OG 3.26Å; A1202-E1206 PolarHBondContact O-N 2.99Å
1203	L	89.7	Confident	85.3	Confident	95 Å²	95	106.9 Å²	106.9	50%	0.497	53%	0.528	S	S	.	.	H	α-helix	trans	-58.7	-37.9	177.3	-70.6	169.3	0	0	0	112.8	Q1199 E1206 M1207	Q1199-L1203 WeakPolarHBondContact O-CB 3.36Å; Q1199-L1203 WeakPolarHBondContact O-CG 3.2Å; Q1199-L1203 PolarHBondContact O-N 3.34Å; L1203-E1206 PolarHBondContact O-N 3.12Å; L1203-M1207 WeakPolarHBondContact O-CB 2.94Å; L1203-M1207 VanDerWaalsContact O-CG 3.25Å; L1203-M1207 WeakPolarHBondContact O-CG 3.23Å; L1203-M1207 PolarHBondContact O-N 3.03Å
1204	R	90.6	Very high	83.5	Confident	187 Å²	187	109.3 Å²	109.3	71%	0.706	54%	0.541	S	S	*	.	H	α-helix	trans	-65.2	-39.6	172	-76.3	172	-175.4	-136.9	4	112.1	L1200 K1201 A1202 S1208	L1200-R1204 VanDerWaalsContact O-CB 3.3Å; L1200-R1204 WeakPolarHBondContact O-CB 3.45Å; L1200-R1204 WeakPolarHBondContact O-CD 3.42Å; L1200-R1204 WeakPolarHBondContact O-CG 3.46Å; L1200-R1204 PolarHBondContact O-N 2.82Å; K1201-R1204 PolarHBondContact O-N 3.44Å; A1202-R1204 VanDerWaalsContact C-N 3.31Å; A1202-R1204 PolarHBondContact O-N 3.24Å; R1204-S1208 WeakPolarHBondContact O-CB 3.39Å; R1204-S1208 PolarHBondContact O-N 3.18Å
1205	S	87.8	Confident	81.1	Confident	71 Å²	71	108 Å²	108	50%	0.497	54%	0.543	S	S	.	.	H	α-helix	trans	-68.6	-38.1	176.4	78.7	0	0	0	0	112.1	K1201 A1202 S1208 Q1209	K1201-S1205 WeakPolarHBondContact O-CB 3.27Å; K1201-S1205 PolarHBondContact O-N 2.94Å; A1202-S1205 CarbonylContact O-C 3.58Å; A1202-S1205 WeakPolarHBondContact O-CA 3.36Å; A1202-S1205 WeakPolarHBondContact O-CB 3.12Å; A1202-S1205 PolarHBondContact O-N 2.72Å; A1202-S1205 PolarHBondContact O-OG 3.26Å; S1205-S1208 PolarHBondContact O-N 2.87Å; S1205-Q1209 VanDerWaalsContact O-CB 3.29Å; S1205-Q1209 WeakPolarHBondContact O-CB 3.27Å; S1205-Q1209 PolarHBondContact O-N 3.32Å
1206	E	88.3	Confident	78.4	Confident	112 Å²	112	108 Å²	108	52%	0.523	55%	0.554	S	S	.	*	H	α-helix	trans	-67.4	-46	174.1	-71.2	-179.9	167.1	0	0	111.4	A1202 L1203 S1208 Q1209 C1210	A1202-E1206 PolarHBondContact O-N 2.99Å; L1203-E1206 PolarHBondContact O-N 3.12Å; E1206-S1208 VanDerWaalsContact C-N 3.3Å; E1206-S1208 PolarHBondContact O-N 2.92Å; E1206-Q1209 CarbonylContact O-C 3.51Å; E1206-Q1209 PolarHBondContact O-N 2.76Å; E1206-C1210 VanDerWaalsContact O-CB 3.3Å; E1206-C1210 WeakPolarHBondContact O-CB 3.49Å; E1206-C1210 PolarHBondContact O-N 2.61Å; E1206-C1210 PolarHBondContact O-SG 2.69Å; E1206-C1210 VanDerWaalsContact O-SG 3.34Å
1207	M	80.6	Confident	75.7	Confident	139 Å²	139	108 Å²	108	69%	0.685	57%	0.567	S	S	*	*	H	α-helix	trans	-59	-40.8	173.6	-76.1	-120.3	-72.1	0	0	112.3	L1203 R1211	L1203-M1207 WeakPolarHBondContact O-CB 2.94Å; L1203-M1207 VanDerWaalsContact O-CG 3.25Å; L1203-M1207 WeakPolarHBondContact O-CG 3.23Å; L1203-M1207 PolarHBondContact O-N 3.03Å; M1207-R1211 WeakPolarHBondContact O-CG 3.37Å; M1207-R1211 PolarHBondContact O-N 2.78Å
1208	S	78.8	Confident	73.9	Confident	56 Å²	56	109.4 Å²	109.4	39%	0.392	58%	0.58	S	S	.	*	H	α-helix	trans	-64.3	-48.4	173.7	-169.7	0	0	0	0	111.3	R1204 S1205 E1206 C1210 R1211 H1212	R1204-S1208 WeakPolarHBondContact O-CB 3.39Å; R1204-S1208 PolarHBondContact O-N 3.18Å; S1205-S1208 PolarHBondContact O-N 2.87Å; E1206-S1208 VanDerWaalsContact C-N 3.3Å; E1206-S1208 PolarHBondContact O-N 2.92Å; S1208-C1210 VanDerWaalsContact C-N 3.33Å; S1208-C1210 PolarHBondContact O-N 2.99Å; S1208-R1211 WeakPolarHBondContact O-CB 3.2Å; S1208-R1211 PolarHBondContact O-N 2.7Å; S1208-R1211 VanDerWaalsContact O-N 3.14Å; S1208-H1212 PolarHBondContact O-CD2 3.21Å; S1208-H1212 PolarHBondContact O-N 3.27Å
1209	Q	79	Confident	71	Confident	110 Å²	110	113.3 Å²	113.3	51%	0.514	60%	0.596	S	S	.	*	H	α-helix	trans	-67.7	-31.8	-178.9	-155.9	-174.5	64.3	0	0	112.4	S1205 E1206 H1212 K1213	S1205-Q1209 VanDerWaalsContact O-CB 3.29Å; S1205-Q1209 WeakPolarHBondContact O-CB 3.27Å; S1205-Q1209 PolarHBondContact O-N 3.32Å; E1206-Q1209 CarbonylContact O-C 3.51Å; E1206-Q1209 PolarHBondContact O-N 2.76Å; Q1209-H1212 CarbonylContact O-C 3.59Å; Q1209-H1212 PolarHBondContact O-N 3.23Å; Q1209-K1213 HydrophobicContact CG-CD 4.23Å; Q1209-K1213 WeakPolarHBondContact O-CB 3.16Å; Q1209-K1213 WeakPolarHBondContact O-CD 3.37Å; Q1209-K1213 WeakPolarHBondContact O-CG 3.12Å; Q1209-K1213 PolarHBondContact O-N 2.71Å
1210	C	74	Confident	68.4	Low	64 Å²	64	115 Å²	115	43%	0.432	61%	0.607	S	S	.	*	H	α-helix	trans	-69.8	-38	171.2	-73.8	0	0	0	0	111.9	E1206 S1208 H1212 K1213 N1214	E1206-C1210 VanDerWaalsContact O-CB 3.3Å; E1206-C1210 WeakPolarHBondContact O-CB 3.49Å; E1206-C1210 PolarHBondContact O-N 2.61Å; E1206-C1210 PolarHBondContact O-SG 2.69Å; E1206-C1210 VanDerWaalsContact O-SG 3.34Å; S1208-C1210 VanDerWaalsContact C-N 3.33Å; S1208-C1210 PolarHBondContact O-N 2.99Å; C1210-H1212 VanDerWaalsContact C-N 3.31Å; C1210-H1212 PolarHBondContact O-N 2.59Å; C1210-K1213 PolarHBondContact O-N 2.9Å; C1210-N1214 VanDerWaalsContact O-CB 3.28Å; C1210-N1214 WeakPolarHBondContact O-CB 3.5Å; C1210-N1214 PolarHBondContact O-N 3.16Å; C1210-N1214 PolarHBondContact O-OD1 2.66Å
1211	R	71.3	Confident	65.7	Low	198 Å²	198	117.5 Å²	117.5	75%	0.747	62%	0.621	S	S	*	*	H	α-helix	trans	-60.4	-40.8	169.2	-78.2	-178.3	171.7	-154.6	-3.4	112	M1207 S1208 T1215	M1207-R1211 WeakPolarHBondContact O-CG 3.37Å; M1207-R1211 PolarHBondContact O-N 2.78Å; S1208-R1211 WeakPolarHBondContact O-CB 3.2Å; S1208-R1211 PolarHBondContact O-N 2.7Å; S1208-R1211 VanDerWaalsContact O-N 3.14Å; R1211-T1215 PolarHBondContact O-OG1 2.93Å
1212	H	62.2	Low	63.1	Low	138 Å²	138	117.7 Å²	117.7	64%	0.639	63%	0.629	S	S	*	*	H	α-helix	trans	-73.9	-25.9	175.8	-69.5	-60.3	0	0	0	114.3	S1208 Q1209 C1210 T1215	S1208-H1212 PolarHBondContact O-CD2 3.21Å; S1208-H1212 PolarHBondContact O-N 3.27Å; Q1209-H1212 CarbonylContact O-C 3.59Å; Q1209-H1212 PolarHBondContact O-N 3.23Å; C1210-H1212 VanDerWaalsContact C-N 3.31Å; C1210-H1212 PolarHBondContact O-N 2.59Å; H1212-T1215 PolarHBondContact O-OG1 2.7Å
1213	K	61.8	Low	60.7	Low	126 Å²	126	122.6 Å²	122.6	55%	0.548	65%	0.649	S	S	.	*	H	α-helix	trans	-81.5	-34.2	175	-76.7	163.9	172.1	172.2	0	112.6	Q1209 C1210 T1215	Q1209-K1213 HydrophobicContact CG-CD 4.23Å; Q1209-K1213 WeakPolarHBondContact O-CB 3.16Å; Q1209-K1213 WeakPolarHBondContact O-CD 3.37Å; Q1209-K1213 WeakPolarHBondContact O-CG 3.12Å; Q1209-K1213 PolarHBondContact O-N 2.71Å; C1210-K1213 PolarHBondContact O-N 2.9Å; K1213-T1215 PolarHBondContact O-N 2.72Å
1214	N	52.5	Low	58.3	Low	136 Å²	136	124 Å²	124	73%	0.727	66%	0.657	S	S	*	*	S	Bend	trans	-78.6	2.7	179.9	-67.3	7.3	0	0	0	113.7	C1210	C1210-N1214 VanDerWaalsContact O-CB 3.28Å; C1210-N1214 WeakPolarHBondContact O-CB 3.5Å; C1210-N1214 PolarHBondContact O-N 3.16Å; C1210-N1214 PolarHBondContact O-OD1 2.66Å
1215	T	44.4	Very low	55.9	Low	110 Å²	110	121.4 Å²	121.4	68%	0.675	66%	0.657	S	S	*	*			trans	-115.8	50.1	-178.4	40.2	0	0	0	0	112.6	R1211 H1212 K1213	R1211-T1215 PolarHBondContact O-OG1 2.93Å; H1212-T1215 PolarHBondContact O-OG1 2.7Å; K1213-T1215 PolarHBondContact O-N 2.72Å
1216	S	38	Very low	53.9	Low	100 Å²	100	124.8 Å²	124.8	70%	0.699	67%	0.669	S	S	*	*			trans	-146.3	132	163.9	60.9	0	0	0	0	108.7
1217	A	36.7	Very low	51.9	Low	93 Å²	93	127.3 Å²	127.3	77%	0.769	69%	0.686	S	S	*	*			cis	-146	-167.3	-0.3	0	0	0	0	0	107.3
1218	P	51.4	Low	50.4	Low	111 Å²	111	127.8 Å²	127.8	72%	0.721	69%	0.691	S	S	*	*			cis	-138.5	-164.7	3.7	38.4	-15.4	0	0	0	115.3
1219	L	33.1	Very low	48.9	Very low	150 Å²	150	132.4 Å²	132.4	79%	0.785	71%	0.712	S	S	*	*			trans	77.6	123.3	172.6	-53.5	175.3	0	0	0	115.6
1220	L	39.9	Very low	47.4	Very low	146 Å²	146	134.2 Å²	134.2	76%	0.764	73%	0.725	S	S	*	*				81.6	83.4	63.5	-107.9	173.3	0	0	0	114
1221	N	34.4	Very low	46.1	Very low	142 Å²	142	138.7 Å²	138.7	76%	0.759	75%	0.745	S	S	*	*				-169.1	145.6	116.9	-100.3	6.4	0	0	0	111.4
1222	N	38.5	Very low	44.6	Very low	145 Å²	145	137 Å²	137	78%	0.775	75%	0.749	S	S	*	*			trans	-105.6	172.8	153.8	-66	-27.3	0	0	0	107.1
1223	L	41	Very low	43.6	Very low	146 Å²	146	135.7 Å²	135.7	76%	0.764	76%	0.756	S	S	*	*			trans	72.5	143.9	178.3	-40.2	169.4	0	0	0	113.8
1224	D	40	Very low	42.6	Very low	125 Å²	125	135.3 Å²	135.3	67%	0.668	76%	0.764	S	S	*	*			cis	-161.2	164.3	-20.8	-101.1	-16.5	0	0	0	107.9
1225	D	41.1	Very low	41.8	Very low	132 Å²	132	136.3 Å²	136.3	71%	0.706	77%	0.77	S	S	*	*			trans	47.5	139.6	152.9	-60.8	-11.7	0	0	0	124
1226	D	44.8	Very low	41.4	Very low	141 Å²	141	134.3 Å²	134.3	75%	0.754	77%	0.771	S	S	*	*			trans	51	121.5	138.2	-55	-11.3	0	0	0	122.7
1227	D	46.9	Very low	41.3	Very low	165 Å²	165	137.7 Å²	137.7	88%	0.882	78%	0.776	S	S	*	*				-157.1	155.3	104	-106.7	-27.8	0	0	0	110
1228	D	47.8	Very low	41.2	Very low	149 Å²	149	141.2 Å²	141.2	80%	0.797	78%	0.778	S	S	*	*			trans	-81.5	171.3	-173	-78.4	-61.4	0	0	0	115.1
1229	D	47.6	Very low	40.4	Very low	153 Å²	153	145.1 Å²	145.1	82%	0.818	78%	0.78	S	S	*	*				-178.7	99.3	127.2	-93.3	-10.8	0	0	0	112.8
1230	D	47.9	Very low	40.3	Very low	149 Å²	149	146.1 Å²	146.1	80%	0.797	78%	0.778	S	S	*	*			trans	75.3	155.5	134.4	-77.9	-16.7	0	0	0	127.6
1231	D	47.2	Very low	39.9	Very low	158 Å²	158	144.1 Å²	144.1	85%	0.845	78%	0.777	S	S	*	*			trans	76.2	78	162.7	-73.4	-11.6	0	0	0	122.1
1232	L	40.1	Very low	39.9	Very low	161 Å²	161	142.5 Å²	142.5	84%	0.843	78%	0.776	S	S	*	*			trans	-74.3	159.3	157.3	-62.9	157.7	0	0	0	113.4
1233	S	41.1	Very low	39.6	Very low	111 Å²	111	140.1 Å²	140.1	78%	0.776	77%	0.771	S	S	*	*			trans	67.3	168.8	147.1	-88.1	0	0	0	0	119.7
1234	T	39.5	Very low	39.3	Very low	118 Å²	118	136.3 Å²	136.3	72%	0.724	77%	0.767	S	S	*	*			cis	-171.4	141.3	-33.4	-90	0	0	0	0	108.3
1235	D	37.6	Very low	39	Very low	157 Å²	157	139 Å²	139	84%	0.84	77%	0.769	S	S	*	*			trans	63.5	171.2	168.2	-155.6	3.5	0	0	0	116.7
1236	G	35.2	Very low	38.8	Very low	68 Å²	68	141.4 Å²	141.4	70%	0.701	77%	0.773	S	S	*	*			trans	160.5	10.4	177.9	0	0	0	0	0	120.6
1237	E	34.9	Very low	38.3	Very low	171 Å²	171	146.3 Å²	146.3	80%	0.799	78%	0.781	S	S	*	*			trans	58.9	170.3	167.4	-67.6	-152.1	114	0	0	121.1
1238	M	35.9	Very low	37.9	Very low	167 Å²	167	143.5 Å²	143.5	82%	0.823	78%	0.775	S	S	*	*			trans	-77.3	170.6	171.3	-48.1	177.3	-172.6	0	0	111.2
1239	Y	33.8	Very low	37.3	Very low	193 Å²	193	141.2 Å²	141.2	76%	0.757	77%	0.77	S	S	*	*				-162.3	108.3	124.8	-105.4	-70.2	0	0	0	113.7
1240	F	30.4	Very low	36.7	Very low	172 Å²	172	139.5 Å²	139.5	75%	0.754	77%	0.77	S	S	*	*			trans	60.7	139.7	141.2	-89.2	-120.1	0	0	0	124
1241	S	32.4	Very low	36.2	Very low	104 Å²	104	136.4 Å²	136.4	73%	0.727	77%	0.765	S	S	*	*			trans	77.6	147.3	141.3	-71.7	0	0	0	0	121.4
1242	S	33.7	Very low	35.7	Very low	108 Å²	108	135 Å²	135	76%	0.755	76%	0.762	S	S	*	*			cis	-171.6	159.9	-24.8	-165.6	0	0	0	0	110.8
1243	S	33.2	Very low	35.6	Very low	95 Å²	95	133.8 Å²	133.8	66%	0.664	76%	0.761	S	S	*	*			trans	67.2	147.7	152.6	-160.1	0	0	0	0	118.9	Y1245	S1243-Y1245 WeakPolarHBondContact OG-CE2 3.4Å
1244	G	34.6	Very low	35.6	Very low	66 Å²	66	135.7 Å²	135.7	68%	0.68	76%	0.763	S	S	*	*			trans	-171.8	-20.8	-178.5	0	0	0	0	0	120.1
1245	Y	34.3	Very low	35.6	Very low	182 Å²	182	136 Å²	136	71%	0.714	76%	0.764	S	S	*	*			trans	65.2	115	174.6	-64.5	-96.4	0	0	0	116.6	S1243	S1243-Y1245 WeakPolarHBondContact OG-CE2 3.4Å
1246	K	36.5	Very low	36	Very low	182 Å²	182	134.4 Å²	134.4	79%	0.791	76%	0.761	S	S	*	*				57.3	127.7	95.6	-61.9	-174.5	-168.7	179.6	0	113.4
1247	R	34.7	Very low	36.2	Very low	244 Å²	244	142.7 Å²	142.7	92%	0.921	79%	0.788	S	S	*	*				-162.8	154	60.5	-135.2	170.9	-167.2	-119.2	6.1	113.9
1248	S	37.8	Very low	36.3	Very low	106 Å²	106	141.3 Å²	141.3	74%	0.741	79%	0.787	S	S	*	*			trans	-67.3	177.2	160.3	-38.2	0	0	0	0	110.9
1249	S	34.4	Very low	36.3	Very low	100 Å²	100	139.9 Å²	139.9	70%	0.699	79%	0.785	S	S	*	*			cis	-175.9	163.3	29.5	45.2	0	0	0	0	111.3
1250	S	35.8	Very low	36.5	Very low	118 Å²	118	137 Å²	137	83%	0.825	79%	0.787	S	S	*	*			trans	68.3	155.7	155.4	-66.3	0	0	0	0	117.4
1251	A	37.6	Very low	36.8	Very low	84 Å²	84	134.9 Å²	134.9	69%	0.694	79%	0.789	S	S	*	*			cis	-159.4	174.4	-20.2	0	0	0	0	0	110
1252	T	37	Very low	37.1	Very low	127 Å²	127	136.9 Å²	136.9	78%	0.779	79%	0.793	S	S	*	*			trans	-18.1	137.9	161.3	52.9	0	0	0	0	118
1253	V	38.2	Very low	37.3	Very low	136 Å²	136	138.8 Å²	138.8	82%	0.824	80%	0.795	S	S	*	*				-172.8	149.1	107	143.3	0	0	0	0	110
1254	D	40.3	Very low	37.6	Very low	152 Å²	152	141.9 Å²	141.9	81%	0.813	80%	0.804	S	S	*	*			trans	-74.8	-167.2	175.7	-87.4	-64.9	0	0	0	113.4
1255	V	38.7	Very low	37.8	Very low	123 Å²	123	147.8 Å²	147.8	75%	0.745	81%	0.814	S	S	*	*			trans	103.4	90.5	159.7	-172.8	0	0	0	0	116.1
1256	T	46.2	Very low	38.1	Very low	125 Å²	125	144.9 Å²	144.9	77%	0.767	82%	0.822	S	S	*	*			trans	46.6	120.6	144	63.7	0	0	0	0	120.8
1257	L	40.5	Very low	38.3	Very low	242 Å²	242	141.5 Å²	141.5	100%	1.267	83%	0.825	S	S	*	*				-150.7	0	107	-111.8	165.8	0	0	0	111

Retrieved 1,257 of 1,257 residues in 1466.6 ms (Link to these results)

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