A0A087XKN0_POEFO Loading...

Spermatogenesis associated 13

AlphaFold DB , UniProt , Accession A0A087XKN0, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,268 aa.

						>A0A087XKN0_POEFO|A0A087XKN0
MSRAEQEDKVLSRSEDPLQCLHRPNPNPLIRSRPLGDVYPSQVVVDRSSVPYLLSGCGAQVQPVGAAPISDESRINGINPSAWSNPVICQAEGRPHNSRIMRLFSNSRKGVIPPSSPTADCPNNDSIGGPQPWTGLSGLVVVDSFKKLRSSVLQGIQSKGAATSSLGQNVPLADVEMPNGSAGSSSEREPADAAHHLTTAEGNFVSNGSLADQKSAMVQHYGSDIEDYDDEEAESGLTRNSRFSRSIRKAYGAGRITLLDTNNGRSDKNDTTSSTQIPNPSLKVDVETETQKENINVNVLSRLSKSAENLHIFRRKNHCPGPPSPQEDPQRITLSNGTPSIQRTASTSSVDLRGRRSPTKNKGPMIKLIGSMTDLTGRRKQSPSPSPTSPSPMSPLSRLHDDYSRRLPCLQSSERQRRPVAVTAQVSSVRCTPLIHAQPEDSADLQSHRGVADPLSSGPRDSPEQISADIAAQHELLPASTTSNAKQMVECVSPPLSEREASQQQPDFASIPNEVKSHFQEQESILQTEKVPPAGSSPPPDPTACLSSTPVSPIPPTDGAAASTETASVKPRQRSGRPRPRPISDYAQLVSRKHCIPEEVAETNYEERTSDAQLQENCSSSGNVSHPDNCSLNGEVQRHRPVSVIGAVDLFAADTELKEDRLPSPLSRPPIPSHKVPPYRGVSARFRPSALSQSTPIGLDRVGRRRLHRVLSAGVSECSATLDDSVSEEEEEEESSFEELADGTPYLQPGVELSVLNEWIISGYAVYAEALWDHVTMEEQELAFKAGDVIRLLDASHKDWWWGRGGDREAWFPSSFVRVRVNQEDSSTESVESVADQEDPAPRDKPSTQHKEQMRTNVVQEIMNTERIYIKHLKDICEGYIRQCRKNSSMFTELQLKTIFSNIEDIYRFQRQFVRELEKKYNKEEPHLSEIGSCFLMQGEGFSIYSEYCNTHPAACAELQRLMKMGKYKHFFEACRLLQQMIDISIAGFLLTPVQKICKYPLQLGELLKYTPKDHRDHAGVSEAYEAMKKVASLINERKRRLESIDTIAHWQVAILHWEGPDVLERSSDLIHSGELTRAVRQGKPQQRSFFLFDHQLVYCKKDVLRRDLLHYRGRLDMDEIEVVDVADGRDPDLGLTLKNALRLRNASTLEFMCMLCCRKVEDKQRWLEAFAKERQRVKEDQEMGIDISDEQRKQAIANARRPKHGKIKTVGYADSVPPHQNLPPLQQRHITIPTSVPQQQVFSLAEPPRRKPYHLLYSITRSAFFRK
					

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Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	33.3	Very low	30.8	Very low	248 Å²	248	148.7 Å²	148.7	100%	1.222	75%	0.748	S	S	*	*				0	128.2	0	-56.6	167.9	80.3	0	0	106.2
2	S	38.6	Very low	30.3	Very low	118 Å²	118	145.2 Å²	145.2	83%	0.825	75%	0.747	S	S	*	*			cis	-155.5	134.8	4.2	-174.2	0	0	0	0	106.6
3	R	29	Very low	30	Very low	234 Å²	234	152 Å²	152	88%	0.883	76%	0.758	S	S	*	*	S	Bend	cis	-163.6	136.3	-2.7	173.2	-171.9	-168.5	175.7	3.4	107.3
4	A	28.8	Very low	29.6	Very low	58 Å²	58	146.6 Å²	146.6	48%	0.479	74%	0.742	S	S	.	*			cis	-163.5	172.9	-15.6	0	0	0	0	0	109.1
5	E	29.1	Very low	29.3	Very low	165 Å²	165	147.3 Å²	147.3	77%	0.771	74%	0.741	S	S	*	*			trans	63.9	145.1	158.3	-68.7	122.9	-141.1	0	0	117.3
6	Q	29.2	Very low	29.6	Very low	149 Å²	149	147.7 Å²	147.7	70%	0.696	75%	0.746	S	S	*	*			cis	-152	159.4	-7.9	-129	168.4	-60.3	0	0	111.9
7	E	28.9	Very low	30.3	Very low	142 Å²	142	145.2 Å²	145.2	66%	0.664	74%	0.743	S	S	*	*			trans	15.9	153.8	145.4	-70.5	173.7	130.6	0	0	124.1
8	D	30.8	Very low	30.1	Very low	105 Å²	105	145.3 Å²	145.3	56%	0.561	74%	0.744	S	S	*	*			trans	84	127.8	146.1	-78.8	12.8	0	0	0	120.3
9	K	29.8	Very low	29.9	Very low	165 Å²	165	146.5 Å²	146.5	72%	0.717	75%	0.746	S	S	*	*			cis	87.6	166.3	44.1	-168.6	-157.1	-65.4	145.5	0	110.2
10	V	31.9	Very low	29.7	Very low	106 Å²	106	143.9 Å²	143.9	64%	0.642	74%	0.741	S	S	*	*			trans	78.8	94.7	174	-170.9	0	0	0	0	111.9
11	L	29.5	Very low	29.6	Very low	146 Å²	146	143.8 Å²	143.8	76%	0.764	74%	0.741	S	S	*	*				64.9	119.8	89.4	-64	160.3	0	0	0	111.9
12	S	25	Very low	29.3	Very low	106 Å²	106	140.6 Å²	140.6	74%	0.741	72%	0.723	S	S	*	*				57.1	98	64.7	-56.8	0	0	0	0	114.2
13	R	26.6	Very low	28.7	Very low	234 Å²	234	145.4 Å²	145.4	88%	0.883	72%	0.723	S	S	*	*				-169.3	158.6	115.1	-114.1	-171.3	158.3	121.8	-0.3	117.1
14	S	23.5	Very low	29.2	Very low	76 Å²	76	139.8 Å²	139.8	53%	0.531	72%	0.717	S	S	.	*			trans	-61.6	-177.7	173.9	49.5	0	0	0	0	117.4
15	E	25.7	Very low	29.3	Very low	158 Å²	158	142.7 Å²	142.7	74%	0.738	72%	0.724	S	S	*	*			trans	82.2	108.8	155.6	-72.3	142	-124.5	0	0	118.2
16	D	33.6	Very low	30	Very low	153 Å²	153	140 Å²	140	82%	0.818	72%	0.721	S	S	*	*				20.2	150.5	107.5	-77.6	-29.6	0	0	0	118.5
17	P	41.3	Very low	30.1	Very low	106 Å²	106	139 Å²	139	69%	0.688	72%	0.72	S	S	*	*			cis	-150.5	173.5	34	43.8	-24.1	0	0	0	118.8
18	L	26.3	Very low	30.8	Very low	146 Å²	146	137.2 Å²	137.2	76%	0.764	72%	0.721	S	S	*	*			trans	40.6	146.2	136.1	-66.7	171	0	0	0	124.4
19	Q	27.3	Very low	30.8	Very low	168 Å²	168	139.2 Å²	139.2	79%	0.785	73%	0.731	S	S	*	*			trans	76.1	154.3	156.8	-70.1	166.4	44.2	0	0	116.7
20	C	26.1	Very low	30.7	Very low	95 Å²	95	137.6 Å²	137.6	64%	0.642	73%	0.729	S	S	*	*			cis	-150.5	158.8	13.5	-142.6	0	0	0	0	114.7
21	L	26.4	Very low	30.5	Very low	142 Å²	142	143.4 Å²	143.4	74%	0.743	74%	0.739	S	S	*	*			trans	19.4	136.6	155.1	-60.8	165.6	0	0	0	120.8
22	H	28.1	Very low	30.4	Very low	180 Å²	180	141.4 Å²	141.4	83%	0.833	74%	0.737	S	S	*	*				-163.1	167.3	71.7	-123	-93.4	0	0	0	116.6
23	R	25.3	Very low	30.5	Very low	219 Å²	219	147.8 Å²	147.8	83%	0.826	75%	0.745	S	S	*	*			trans	-89.3	170.1	175.8	-102.1	179.1	176.8	171.8	-0.7	113
24	P	39.6	Very low	31.8	Very low	117 Å²	117	141.8 Å²	141.8	76%	0.76	74%	0.736	S	S	*	*			cis	-127	171	31.3	24.2	1.1	0	0	0	115
25	N	31.1	Very low	31.9	Very low	118 Å²	118	146.4 Å²	146.4	63%	0.631	75%	0.754	S	S	*	*			cis	74.7	138.6	41.6	-158	57.4	0	0	0	113.5
26	P	45.1	Very low	31.9	Very low	110 Å²	110	142.1 Å²	142.1	71%	0.714	75%	0.752	S	S	*	*			cis	-105.5	165.4	5.5	41	-30.7	0	0	0	114.8
27	N	29.5	Very low	31.5	Very low	127 Å²	127	142.5 Å²	142.5	68%	0.679	76%	0.755	S	S	*	*				68.5	143.5	53.3	-96.3	-39.5	0	0	0	114.4
28	P	44.5	Very low	30.8	Very low	104 Å²	104	144 Å²	144	68%	0.675	76%	0.761	S	S	*	*			cis	-143.3	149.9	32.7	37.4	-16.3	0	0	0	120.5
29	L	30.9	Very low	31.3	Very low	148 Å²	148	147.4 Å²	147.4	78%	0.775	77%	0.766	S	S	*	*			trans	64.2	150.3	142.3	-57.5	168.2	0	0	0	119.8
30	I	28.5	Very low	32.3	Very low	131 Å²	131	144.6 Å²	144.6	67%	0.672	76%	0.762	S	S	*	*			cis	-150.9	131.2	4.6	-123.1	154.3	0	0	0	109
31	R	27.2	Very low	32.4	Very low	228 Å²	228	144.9 Å²	144.9	86%	0.86	77%	0.765	S	S	*	*				59.1	142.7	110	-103.5	-173.9	-175.1	177.6	0.2	117.6
32	S	27.5	Very low	32.5	Very low	103 Å²	103	146.7 Å²	146.7	72%	0.72	77%	0.77	S	S	*	*			cis	-163.9	165.2	0.5	-4.3	0	0	0	0	112.6
33	R	27.3	Very low	32.6	Very low	240 Å²	240	144.3 Å²	144.3	91%	0.906	77%	0.767	S	S	*	*			trans	-98.6	-176.8	153.2	-70.1	-177.4	171.2	-178.4	-3.1	109.2
34	P	52.4	Low	32.8	Very low	108 Å²	108	139.8 Å²	139.8	70%	0.701	76%	0.764	S	S	*	*			cis	-133.3	-161.8	-13.1	22	5.2	0	0	0	113.4
35	L	26.6	Very low	32.4	Very low	173 Å²	173	141.1 Å²	141.1	91%	0.906	77%	0.77	S	S	*	*			trans	75.4	144.1	151.8	-86.3	151.5	0	0	0	120.9
36	G	25.2	Very low	32.3	Very low	68 Å²	68	140.5 Å²	140.5	70%	0.701	77%	0.766	S	S	*	*			trans	116.9	96.4	149.9	0	0	0	0	0	119.2
37	D	26.1	Very low	31.7	Very low	162 Å²	162	144.4 Å²	144.4	87%	0.866	77%	0.767	S	S	*	*			trans	34.6	155.3	130	-85.1	-43.7	0	0	0	126.2
38	V	26.4	Very low	31.7	Very low	136 Å²	136	143.5 Å²	143.5	82%	0.824	77%	0.77	S	S	*	*			trans	82.8	129.8	148.6	163.8	0	0	0	0	121.3
39	Y	36.1	Very low	31	Very low	219 Å²	219	144.1 Å²	144.1	86%	0.859	78%	0.777	S	S	*	*			trans	-74.1	158	163.3	-91.3	-100	0	0	0	111
40	P	49	Very low	30.9	Very low	109 Å²	109	142.6 Å²	142.6	71%	0.708	77%	0.774	S	S	*	*			cis	-157.5	-173.8	44	43.8	-20.9	0	0	0	118.7
41	S	27.7	Very low	31.9	Very low	101 Å²	101	142.3 Å²	142.3	71%	0.706	78%	0.781	S	S	*	*			trans	36.8	123.9	142.1	-60	0	0	0	0	126.3
42	Q	29.3	Very low	32.3	Very low	180 Å²	180	140.8 Å²	140.8	84%	0.841	78%	0.776	S	S	*	*				78.2	139.6	126.5	-80.2	-173.2	-13.7	0	0	125.5
43	V	28.7	Very low	32.7	Very low	129 Å²	129	143.2 Å²	143.2	78%	0.782	78%	0.78	S	S	*	*			trans	77.5	140.9	144.9	166.2	0	0	0	0	119.7
44	V	29.6	Very low	33.2	Very low	124 Å²	124	138.7 Å²	138.7	75%	0.752	77%	0.773	S	S	*	*			cis	-157.9	143.4	-26.1	144.9	0	0	0	0	107.5
45	V	31.8	Very low	32.3	Very low	146 Å²	146	138.9 Å²	138.9	89%	0.885	78%	0.777	S	S	*	*			trans	-151.6	-162.1	163.5	107.4	0	0	0	0	114.8
46	D	29.6	Very low	32.6	Very low	104 Å²	104	133.7 Å²	133.7	56%	0.556	77%	0.765	S	S	*	*			trans	-163.7	-177.7	-130.8	-137.3	-32.4	0	0	0	110.4
47	R	32.8	Very low	33.1	Very low	192 Å²	192	137.2 Å²	137.2	73%	0.725	78%	0.778	S	S	*	*			cis	-164.8	160.2	3.4	-166.1	165.5	-72.3	172.1	2.4	111
48	S	28.6	Very low	33.3	Very low	108 Å²	108	133.2 Å²	133.2	76%	0.755	77%	0.774	S	S	*	*			trans	63.9	151	156.2	46.9	0	0	0	0	120.2
49	S	28.9	Very low	33.6	Very low	118 Å²	118	131 Å²	131	83%	0.825	77%	0.77	S	S	*	*			cis	-162	175.6	-8.9	42.8	0	0	0	0	113.1
50	V	29.3	Very low	33.5	Very low	116 Å²	116	129.3 Å²	129.3	70%	0.703	77%	0.77	S	S	*	*			trans	-88.7	175.7	-168.2	-140.4	0	0	0	0	114.9	Y52	V50-Y52 HydrophobicContact CG1-CD2 4.4Å
51	P	50.6	Low	32.6	Very low	125 Å²	125	130.2 Å²	130.2	81%	0.812	77%	0.774	S	S	*	*				-139.3	167.3	105.3	39	-27.2	0	0	0	116.7
52	Y	35.8	Very low	32.9	Very low	196 Å²	196	133.5 Å²	133.5	77%	0.769	78%	0.778	S	S	*	*			trans	-90.1	169	-179.6	-90.3	-105.4	0	0	0	113	V50	V50-Y52 HydrophobicContact CG1-CD2 4.4Å
53	L	35.4	Very low	33.9	Very low	153 Å²	153	129.9 Å²	129.9	80%	0.801	77%	0.77	S	S	*	*				-175.3	158.3	73.8	-70.8	166.4	0	0	0	109.5
54	L	37.2	Very low	34.1	Very low	145 Å²	145	130.5 Å²	130.5	76%	0.759	77%	0.774	S	S	*	*			cis	-149.3	-90.2	-9.8	-130.2	176.1	0	0	0	115.1
55	S	34.8	Very low	34.1	Very low	112 Å²	112	128 Å²	128	78%	0.783	77%	0.772	S	S	*	*			trans	-174.7	165.4	-156	-170.4	0	0	0	0	110.6
56	G	32	Very low	33.9	Very low	64 Å²	64	126.2 Å²	126.2	66%	0.66	77%	0.774	S	S	*	*			cis	158.2	-153.2	-2.8	0	0	0	0	0	113.2
57	C	34.8	Very low	34	Very low	143 Å²	143	125.5 Å²	125.5	97%	0.966	78%	0.782	S	S	*	*			trans	68.9	128.5	-175.7	-66.6	0	0	0	0	117.3
58	G	32.1	Very low	34.9	Very low	77 Å²	77	121.6 Å²	121.6	79%	0.794	78%	0.782	S	S	*	*			cis	149.2	163.8	-4	0	0	0	0	0	111.7
59	A	32	Very low	34.9	Very low	89 Å²	89	124.2 Å²	124.2	74%	0.736	79%	0.785	S	S	*	*			cis	-171.4	177.9	-15.1	0	0	0	0	0	110.1
60	Q	34.1	Very low	35	Very low	184 Å²	184	123 Å²	123	86%	0.86	78%	0.777	S	S	*	*			trans	74.5	148.5	162.9	-60.1	-161.1	-13.5	0	0	119
61	V	30.2	Very low	35	Very low	128 Å²	128	124.8 Å²	124.8	78%	0.776	78%	0.783	S	S	*	*			cis	-155.2	165.3	-8.7	121.6	0	0	0	0	111.8
62	Q	33	Very low	34	Very low	170 Å²	170	126.6 Å²	126.6	79%	0.794	78%	0.78	S	S	*	*			trans	-100.7	-158.5	-179.8	-118.3	-174.2	16	0	0	111.4
63	P	50.3	Low	33.7	Very low	104 Å²	104	121.6 Å²	121.6	68%	0.675	77%	0.774	S	S	*	*			cis	-137.9	175.6	-1.2	37	-14.9	0	0	0	118.1
64	V	32.9	Very low	33.4	Very low	143 Å²	143	124.4 Å²	124.4	87%	0.867	77%	0.774	S	S	*	*			trans	36.1	136.4	139.2	178.1	0	0	0	0	123
65	G	29.9	Very low	33.2	Very low	70 Å²	70	123.8 Å²	123.8	72%	0.722	77%	0.77	S	S	*	*			trans	171.9	100.5	152	0	0	0	0	0	120.4
66	A	28.8	Very low	33.1	Very low	110 Å²	110	126.2 Å²	126.2	91%	0.909	77%	0.774	S	S	*	*			trans	50.7	165.4	142	0	0	0	0	0	125
67	A	29.8	Very low	33	Very low	89 Å²	89	126.1 Å²	126.1	74%	0.736	77%	0.773	S	S	*	*			trans	-122.9	-179	160	0	0	0	0	0	107.5
68	P	53.6	Low	32.8	Very low	110 Å²	110	127.9 Å²	127.9	71%	0.714	77%	0.771	S	S	*	*			cis	-139.8	-144.3	9.4	34.4	-7.8	0	0	0	113.2
69	I	28	Very low	32.9	Very low	162 Å²	162	131.2 Å²	131.2	83%	0.831	77%	0.771	S	S	*	*			trans	88.9	163.4	159.4	-69.1	159.3	0	0	0	117.9
70	S	30.4	Very low	33.8	Very low	94 Å²	94	132 Å²	132	66%	0.657	77%	0.768	S	S	*	*			trans	-107.3	176.3	-151.2	-47.5	0	0	0	0	116.1
71	D	29.3	Very low	33.7	Very low	152 Å²	152	129.1 Å²	129.1	81%	0.813	77%	0.769	S	S	*	*			trans	94.1	143.7	139.7	-74	-45.6	0	0	0	124
72	E	30.2	Very low	33.8	Very low	164 Å²	164	127.2 Å²	127.2	77%	0.766	77%	0.766	S	S	*	*			trans	38.4	93.5	153	-63.9	-148.5	99.6	0	0	123.9
73	S	28.8	Very low	33.6	Very low	90 Å²	90	130.6 Å²	130.6	63%	0.629	77%	0.772	S	S	*	*				87.2	153.5	106	87.1	0	0	0	0	123.3
74	R	30	Very low	32.7	Very low	212 Å²	212	129.7 Å²	129.7	80%	0.8	77%	0.768	S	S	*	*			trans	93.7	102.5	149.1	-70.1	-177.4	-174.1	-148.8	1.6	123.5
75	I	32	Very low	32.3	Very low	133 Å²	133	129.6 Å²	129.6	68%	0.682	76%	0.763	S	S	*	*				54.4	107.8	121.9	-48.2	158	0	0	0	119.4
76	N	32.3	Very low	33	Very low	163 Å²	163	132.4 Å²	132.4	87%	0.872	77%	0.768	S	S	*	*				163.3	140.5	120.7	-89.6	-56.2	0	0	0	109.3
77	G	29.6	Very low	33	Very low	62 Å²	62	133.9 Å²	133.9	64%	0.639	77%	0.765	S	S	*	*			cis	150.4	139.1	-6.4	0	0	0	0	0	111.2
78	I	32.1	Very low	32.8	Very low	179 Å²	179	137 Å²	137	92%	0.918	77%	0.768	S	S	*	*			trans	-168	153.3	159	-102	150.7	0	0	0	109.2
79	N	32.9	Very low	31.5	Very low	148 Å²	148	137.5 Å²	137.5	79%	0.791	77%	0.772	S	S	*	*			trans	-126.7	-171.6	-167.6	-128.1	-10.9	0	0	0	108.7
80	P	51	Low	31.4	Very low	105 Å²	105	138.8 Å²	138.8	68%	0.682	78%	0.775	S	S	*	*			cis	-136.7	168.5	-8.7	38	-19.8	0	0	0	116.4
81	S	33.1	Very low	31.2	Very low	124 Å²	124	138.6 Å²	138.6	87%	0.867	78%	0.779	S	S	*	*			trans	-163.8	158.2	136.8	0.1	0	0	0	0	111.3
82	A	31.1	Very low	31.1	Very low	87 Å²	87	138.5 Å²	138.5	72%	0.719	77%	0.774	S	S	*	*			trans	-97	139.7	-162.3	0	0	0	0	0	113.6
83	W	30.3	Very low	31.1	Very low	242 Å²	242	134.4 Å²	134.4	92%	0.917	78%	0.776	S	S	*	*				70.6	142.6	93.2	-72.9	25.6	0	0	0	115.4
84	S	29.8	Very low	31.4	Very low	85 Å²	85	138.7 Å²	138.7	59%	0.594	78%	0.778	S	S	*	*			cis	-171.4	157.2	-2.7	47.7	0	0	0	0	113.6
85	N	26.4	Very low	32.5	Very low	141 Å²	141	133.4 Å²	133.4	75%	0.754	77%	0.771	S	S	*	*			trans	66.9	145.8	150.8	-60.7	-13.3	0	0	0	122.3
86	P	43.8	Very low	32.8	Very low	128 Å²	128	135.5 Å²	135.5	83%	0.831	78%	0.778	S	S	*	*			trans	-128.9	140.1	137.2	36.7	-26.1	0	0	0	113.1
87	V	27.9	Very low	32.7	Very low	141 Å²	141	134.7 Å²	134.7	86%	0.855	77%	0.774	S	S	*	*			trans	-138.3	169.1	175.8	-179.9	0	0	0	0	110
88	I	27.1	Very low	33.1	Very low	156 Å²	156	136.7 Å²	136.7	80%	0.8	78%	0.778	S	S	*	*			trans	-102.1	155.4	-156.7	-62.2	163.3	0	0	0	113.4
89	C	24.7	Very low	33.2	Very low	119 Å²	119	139.2 Å²	139.2	80%	0.804	78%	0.776	S	S	*	*			trans	102.8	164.1	148.1	-118.3	0	0	0	0	121.3
90	Q	26.3	Very low	33.3	Very low	189 Å²	189	138.6 Å²	138.6	88%	0.883	77%	0.771	S	S	*	*			trans	78.1	158.9	178.3	-54.8	-169.6	9.2	0	0	118.6
91	A	27.1	Very low	32.2	Very low	90 Å²	90	141 Å²	141	74%	0.744	78%	0.775	S	S	*	*				-175.5	163.3	-72.6	0	0	0	0	0	111.1
92	E	27.7	Very low	32.1	Very low	151 Å²	151	145.7 Å²	145.7	71%	0.706	77%	0.774	S	S	*	*			trans	70.2	116.4	173.7	-50.5	-148.7	101	0	0	118	R94	E92-R94 VanDerWaalsContact CD-NH1 3.29Å; E92-R94 IonicContact OE1-CZ 2.75Å; E92-R94 IonicContact OE1-NH1 2.73Å; E92-R94 PolarHBondContact OE1-NH1 2.81Å; E92-R94 IonicContact OE1-NH2 3.56Å; E92-R94 PolarHBondContact OE1-NH2 3.43Å; E92-R94 IonicContact OE2-CZ 3.59Å; E92-R94 IonicContact OE2-NH1 3.56Å; E92-R94 IonicContact OE2-NH2 2.87Å; E92-R94 PolarHBondContact OE2-NH2 3.33Å
93	G	29.2	Very low	32	Very low	78 Å²	78	147.8 Å²	147.8	80%	0.804	77%	0.772	S	S	*	*			cis	145.5	27.4	-16.7	0	0	0	0	0	118.6
94	R	35.5	Very low	32	Very low	179 Å²	179	144.6 Å²	144.6	68%	0.675	77%	0.765	S	S	*	*			trans	-150.4	157.5	-167.4	-8.2	-175.7	-163.3	-81.5	-1.2	111.9	E92	E92-R94 VanDerWaalsContact CD-NH1 3.29Å; E92-R94 IonicContact OE1-CZ 2.75Å; E92-R94 IonicContact OE1-NH1 2.73Å; E92-R94 PolarHBondContact OE1-NH1 2.81Å; E92-R94 IonicContact OE1-NH2 3.56Å; E92-R94 PolarHBondContact OE1-NH2 3.43Å; E92-R94 IonicContact OE2-CZ 3.59Å; E92-R94 IonicContact OE2-NH1 3.56Å; E92-R94 IonicContact OE2-NH2 2.87Å; E92-R94 PolarHBondContact OE2-NH2 3.33Å
95	P	51.9	Low	31.9	Very low	102 Å²	102	145 Å²	145	66%	0.662	77%	0.768	S	S	*	*			cis	-142.7	130.8	-20.2	35.1	-13.5	0	0	0	117.5
96	H	39	Very low	31.9	Very low	176 Å²	176	145.1 Å²	145.1	82%	0.815	77%	0.769	S	S	*	*			trans	67.8	141.9	151.1	-58.4	101.7	0	0	0	121.8
97	N	29.7	Very low	31.2	Very low	147 Å²	147	144.5 Å²	144.5	79%	0.786	77%	0.767	S	S	*	*			cis	-138.6	134.6	33.1	-97.8	-40.4	0	0	0	116.2
98	S	37.8	Very low	31.2	Very low	104 Å²	104	149.1 Å²	149.1	73%	0.727	77%	0.769	S	S	*	*			trans	70.5	172.5	155.5	87	0	0	0	0	119.2
99	R	35.5	Very low	31.3	Very low	231 Å²	231	151 Å²	151	87%	0.872	77%	0.772	S	S	*	*			cis	-173.9	177.5	-27.9	-101.8	175	-173.7	158.2	1.2	108.9
100	I	34.5	Very low	31.2	Very low	135 Å²	135	147.7 Å²	147.7	69%	0.692	76%	0.757	S	S	*	*				-159.7	134.3	-63	-168.4	163.8	0	0	0	113.3
101	M	27.1	Very low	31.1	Very low	156 Å²	156	144.4 Å²	144.4	77%	0.768	75%	0.75	S	S	*	*			trans	58.4	144.9	160.3	-68.2	169.6	72.1	0	0	122.7
102	R	32.4	Very low	31.1	Very low	222 Å²	222	147.4 Å²	147.4	84%	0.838	75%	0.752	S	S	*	*			cis	96.6	139.7	12.3	-66.5	-178.4	179.2	-178.6	-0.3	117.1
103	L	29.3	Very low	31.9	Very low	132 Å²	132	145.8 Å²	145.8	69%	0.691	75%	0.754	S	S	*	*			cis	-175.3	179.1	-19.1	-122	176.6	0	0	0	112.7
104	F	29.8	Very low	32.5	Very low	175 Å²	175	148.1 Å²	148.1	77%	0.768	76%	0.755	S	S	*	*			trans	95.5	129.7	146.9	-70.1	-51	0	0	0	127.5
105	S	26.8	Very low	32	Very low	94 Å²	94	145.1 Å²	145.1	66%	0.657	76%	0.762	S	S	*	*				84.5	125.4	123	-63	0	0	0	0	129.9
106	N	27.2	Very low	30.7	Very low	143 Å²	143	145.5 Å²	145.5	77%	0.765	77%	0.767	S	S	*	*				66	122.8	127.3	-57.2	-10.2	0	0	0	129.4
107	S	28.6	Very low	30.8	Very low	115 Å²	115	142.1 Å²	142.1	80%	0.804	76%	0.761	S	S	*	*			trans	76	173	140.5	80.4	0	0	0	0	121.7
108	R	28.5	Very low	30.7	Very low	237 Å²	237	141.5 Å²	141.5	89%	0.894	76%	0.763	S	S	*	*			cis	-166.5	160.4	2.6	-144.3	171	-178.8	177	-0.5	114.3
109	K	28.5	Very low	30.4	Very low	197 Å²	197	140.7 Å²	140.7	86%	0.857	76%	0.762	S	S	*	*			trans	65.2	164.4	164.4	-139.5	-157	171.4	-116.2	0	118.1
110	G	23.9	Very low	29.9	Very low	48 Å²	48	136.7 Å²	136.7	50%	0.495	76%	0.758	S	S	.	*			cis	120.3	151	-22.4	0	0	0	0	0	117.7
111	V	23.8	Very low	29.5	Very low	120 Å²	120	135 Å²	135	73%	0.727	76%	0.757	S	S	*	*			cis	-169.1	139.6	-9.8	-169.4	0	0	0	0	109.1
112	I	25.7	Very low	30.3	Very low	153 Å²	153	131.1 Å²	131.1	79%	0.785	74%	0.744	S	S	*	*			trans	60.8	166.3	162.4	-78	167.3	0	0	0	117.6
113	P	46.4	Very low	30.1	Very low	117 Å²	117	127.1 Å²	127.1	76%	0.76	74%	0.739	S	S	*	*			cis	-109.9	-136.3	-11.2	29.1	-4.7	0	0	0	111.4
114	P	40.8	Very low	30.1	Very low	127 Å²	127	127 Å²	127	83%	0.825	74%	0.738	S	S	*	*			cis	-136.7	-134.3	-8.8	43.9	-20.5	0	0	0	116.8
115	S	25.7	Very low	30	Very low	117 Å²	117	124.5 Å²	124.5	82%	0.818	73%	0.733	S	S	*	*			trans	-122.7	-175.5	-156.6	54.6	0	0	0	0	119.2
116	S	24.3	Very low	30	Very low	109 Å²	109	124.5 Å²	124.5	76%	0.762	73%	0.734	S	S	*	*			trans	-87.1	-170.5	-168.2	52.7	0	0	0	0	115.6
117	P	41.4	Very low	29.9	Very low	106 Å²	106	125.5 Å²	125.5	69%	0.688	74%	0.737	S	S	*	*			cis	-149.6	-177.8	16.8	42.5	-18.3	0	0	0	122.1
118	T	27.2	Very low	29.7	Very low	134 Å²	134	123.6 Å²	123.6	82%	0.822	74%	0.736	S	S	*	*			trans	68.7	134.1	145.8	40.6	0	0	0	0	128.4
119	A	30.7	Very low	29.4	Very low	86 Å²	86	116.1 Å²	116.1	71%	0.711	73%	0.732	S	S	*	*			trans	90.9	112.2	131.6	0	0	0	0	0	126.3
120	D	25.5	Very low	29.7	Very low	148 Å²	148	113.1 Å²	113.1	79%	0.791	73%	0.733	S	S	*	*				89.4	147.3	121.3	-58.6	-4.6	0	0	0	127.6
121	C	26.4	Very low	29.8	Very low	99 Å²	99	119 Å²	119	67%	0.669	75%	0.747	S	S	*	*			trans	-97.6	-97.4	-152.2	-62.5	0	0	0	0	115.8	R239	C121-R239 PolarHBondContact O-NE 2.73Å; C121-R239 PolarHBondContact O-NH2 2.97Å
122	P	42.8	Very low	30.4	Very low	75 Å²	75	117.8 Å²	117.8	49%	0.487	74%	0.742	S	S	.	*			cis	-118.8	-178.7	-47.1	43.1	-30.7	0	0	0	114.5	R239	P122-R239 PolarHBondContact O-NH2 3.35Å
123	N	29.2	Very low	30.4	Very low	138 Å²	138	121.7 Å²	121.7	74%	0.738	75%	0.747	S	S	*	*			trans	59.1	144.2	165.7	-57.6	7.3	0	0	0	118.9
124	N	30	Very low	29.4	Very low	128 Å²	128	122.6 Å²	122.6	68%	0.684	75%	0.751	S	S	*	*			cis	-159.5	-165.5	-5.9	-115.7	35.1	0	0	0	107.7
125	D	26.3	Very low	28.6	Very low	123 Å²	123	120 Å²	120	66%	0.658	75%	0.747	S	S	*	*			cis	-163.1	167.4	9.6	-141.7	-62.1	0	0	0	112.5
126	S	26.5	Very low	28.7	Very low	95 Å²	95	122.1 Å²	122.1	66%	0.664	75%	0.748	S	S	*	*			trans	53.6	164.7	144.2	-77.5	0	0	0	0	124.2
127	I	26.1	Very low	28.7	Very low	164 Å²	164	122.6 Å²	122.6	84%	0.841	75%	0.752	S	S	*	*			cis	-172.6	158.7	-34.3	-163.1	164.5	0	0	0	110.6
128	G	24.5	Very low	27.9	Very low	75 Å²	75	120.8 Å²	120.8	77%	0.773	75%	0.752	S	S	*	*			trans	103.1	137.1	156.9	0	0	0	0	0	119.2
129	G	21.7	Very low	27.9	Very low	79 Å²	79	122.5 Å²	122.5	81%	0.814	76%	0.755	S	S	*	*			trans	-112.8	-163.2	173.6	0	0	0	0	0	113.6
130	P	35.7	Very low	27.7	Very low	134 Å²	134	124.4 Å²	124.4	87%	0.87	76%	0.758	S	S	*	*			cis	-134.6	-163.3	13.4	43.6	-25	0	0	0	116.4
131	Q	25	Very low	27.6	Very low	171 Å²	171	123.5 Å²	123.5	80%	0.799	76%	0.757	S	S	*	*			trans	-55.9	176.9	175.3	-72.7	-84.3	-18.7	0	0	116.2
132	P	36.8	Very low	27.6	Very low	96 Å²	96	124.9 Å²	124.9	62%	0.623	76%	0.762	S	S	*	*			cis	-125.7	-175.4	2.7	35.8	-14.4	0	0	0	114.6
133	W	26.2	Very low	26.7	Very low	234 Å²	234	128.9 Å²	128.9	89%	0.886	78%	0.78	S	S	*	*				-168	152.7	85.1	-97.4	75.3	0	0	0	112.4
134	T	25	Very low	26.5	Very low	137 Å²	137	127.9 Å²	127.9	84%	0.84	78%	0.784	S	S	*	*			trans	-91.8	156.9	176.4	50.5	0	0	0	0	113.2
135	G	24.2	Very low	26.3	Very low	72 Å²	72	131.7 Å²	131.7	74%	0.742	79%	0.794	S	S	*	*			trans	-177.1	49.5	-176.8	0	0	0	0	0	122.2
136	L	27.3	Very low	26.4	Very low	162 Å²	162	135.1 Å²	135.1	85%	0.848	80%	0.803	S	S	*	*			trans	61	122.5	153	-59.3	173.7	0	0	0	122.4
137	S	25.1	Very low	26.6	Very low	119 Å²	119	140.6 Å²	140.6	83%	0.832	82%	0.815	S	S	*	*				33.9	139.6	123.3	-47.6	0	0	0	0	122.2
138	G	24.6	Very low	26.6	Very low	67 Å²	67	140.8 Å²	140.8	69%	0.691	82%	0.817	S	S	*	*			cis	160.9	-179.3	0.7	0	0	0	0	0	113
139	L	26	Very low	26.7	Very low	170 Å²	170	148 Å²	148	89%	0.89	82%	0.821	S	S	*	*			trans	68.7	145.7	-175.8	-57.5	168.1	0	0	0	113.9
140	V	26.1	Very low	27.2	Very low	127 Å²	127	148.3 Å²	148.3	77%	0.77	81%	0.811	S	S	*	*			cis	-136.1	147.1	35.1	166	0	0	0	0	113.2
141	V	25.2	Very low	26.9	Very low	128 Å²	128	146.7 Å²	146.7	78%	0.776	80%	0.802	S	S	*	*			trans	-76.8	139.2	173.3	174.8	0	0	0	0	112.3
142	V	24.5	Very low	27.1	Very low	129 Å²	129	143.2 Å²	143.2	78%	0.782	79%	0.792	S	S	*	*			trans	-141.7	137.9	165.2	-163.8	0	0	0	0	111
143	D	24.4	Very low	26.9	Very low	159 Å²	159	141.7 Å²	141.7	85%	0.85	78%	0.779	S	S	*	*			trans	-63.7	140.1	-177.6	-61.9	-76.4	0	0	0	114.9
144	S	24.8	Very low	26.9	Very low	117 Å²	117	137 Å²	137	82%	0.818	77%	0.766	S	S	*	*			trans	-146.8	24.3	165.2	-152.6	0	0	0	0	117.3	K146	S144-K146 PolarHBondContact O-N 3.42Å
145	F	26.1	Very low	26.9	Very low	208 Å²	208	134 Å²	134	91%	0.912	76%	0.764	S	S	*	*			trans	-83.2	77.9	174.4	-94.7	-80.6	0	0	0	113.7
146	K	29.6	Very low	27.2	Very low	194 Å²	194	134.3 Å²	134.3	84%	0.843	75%	0.747	S	S	*	*			trans	-145.2	56.6	173	-73.7	-172.3	-177.3	157.7	0	115.2	S144	S144-K146 PolarHBondContact O-N 3.42Å
147	K	30.4	Very low	27.1	Very low	211 Å²	211	136 Å²	136	92%	0.917	75%	0.751	S	S	*	*			trans	-166.1	53.3	160	-116.1	166.2	-175.1	-176	0	116.6
148	L	24.6	Very low	27.3	Very low	167 Å²	167	136.1 Å²	136.1	87%	0.874	75%	0.752	S	S	*	*			trans	-121.3	120.6	159.5	-97.8	161.1	0	0	0	110
149	R	27.3	Very low	27.4	Very low	228 Å²	228	142.1 Å²	142.1	86%	0.86	76%	0.759	S	S	*	*			trans	-137.5	130.4	172.2	-100	-164.2	173.2	-134.1	-1.8	107.9
150	S	31.7	Very low	27.3	Very low	85 Å²	85	138 Å²	138	59%	0.594	76%	0.757	S	S	*	*			trans	42.1	80.5	152.8	57.6	0	0	0	0	117.1	Q1240	S150-Q1240 PolarHBondContact O-NE2 2.86Å
151	S	29.9	Very low	27.3	Very low	100 Å²	100	136.4 Å²	136.4	70%	0.699	76%	0.757	S	S	*	*			trans	-153.5	73	161.5	-168.7	0	0	0	0	111.5
152	V	29.8	Very low	27.2	Very low	97 Å²	97	135.2 Å²	135.2	59%	0.588	76%	0.761	S	S	*	*			trans	-133.7	11.4	176.1	-167.5	0	0	0	0	110.8	W772	V152-W772 HydrophobicContact CG1-CZ3 4.43Å
153	L	31.4	Very low	27.2	Very low	65 Å²	65	135.9 Å²	135.9	34%	0.34	77%	0.765	S	S	.	*			trans	-134.2	49.7	-164.2	-68	173.4	0	0	0	113.1	N1036	L153-N1036 HydrophobicContact CD1-CB 4.36Å; L153-N1036 WeakPolarHBondContact CD1-OD1 3.34Å; L153-N1036 HydrophobicContact CD2-CB 4.09Å
154	Q	26.6	Very low	27.3	Very low	134 Å²	134	133.8 Å²	133.8	63%	0.626	76%	0.764	S	S	*	*			trans	-159.5	106	163.8	-111.8	161.5	12.8	0	0	110.4	V1242	Q154-V1242 VanDerWaalsContact CD-CG2 3.44Å; Q154-V1242 HydrophobicContact CG-CG2 4.15Å
155	G	26.4	Very low	27.3	Very low	76 Å²	76	133.7 Å²	133.7	78%	0.784	76%	0.763	S	S	*	*			trans	-164.5	4.2	-179.1	0	0	0	0	0	116
156	I	29.8	Very low	27.3	Very low	77 Å²	77	132.6 Å²	132.6	40%	0.395	77%	0.765	S	S	.	*			trans	-137.9	75.1	-176.2	-51.1	-175.2	0	0	0	110.2	P1001 K1029	I156-P1001 HydrophobicContact CD1-CB 3.78Å; I156-P1001 HydrophobicContact CD1-CG 4.45Å; I156-K1029 HydrophobicContact CD1-CG 4.05Å; I156-K1029 HydrophobicContact CG2-CD 4.23Å; I156-K1029 VanDerWaalsContact CG2-CE 3.42Å; I156-K1029 HydrophobicContact CG2-CG 4.22Å
157	Q	26	Very low	27	Very low	197 Å²	197	127.3 Å²	127.3	92%	0.921	77%	0.766	S	S	*	*			trans	-149	94.7	161.5	-74.9	-164.4	-17.8	0	0	109.3
158	S	29.1	Very low	26.8	Very low	122 Å²	122	125.6 Å²	125.6	85%	0.853	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-96.2	152.7	169.8	46.6	0	0	0	0	110.7
159	K	26.5	Very low	26.7	Very low	194 Å²	194	124.7 Å²	124.7	84%	0.843	76%	0.757	S	S	*	*	P	Polyproline II helix	trans	-89.3	123.9	-166.9	-60.6	168.2	-175.5	167.9	0	111.7
160	G	23.5	Very low	26.6	Very low	83 Å²	83	120.2 Å²	120.2	86%	0.856	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-79.7	119.9	153.6	0	0	0	0	0	109.5
161	A	25.2	Very low	27.1	Very low	93 Å²	93	120.8 Å²	120.8	77%	0.769	76%	0.756	S	S	*	*			trans	-106.9	99.8	176.3	0	0	0	0	0	109.9
162	A	23.6	Very low	26.8	Very low	103 Å²	103	123.2 Å²	123.2	85%	0.851	76%	0.761	S	S	*	*			trans	-72.7	131.5	171.6	0	0	0	0	0	110.5
163	T	25	Very low	26.6	Very low	143 Å²	143	122.4 Å²	122.4	88%	0.877	76%	0.764	S	S	*	*			trans	-123.3	139.6	161.5	53.6	0	0	0	0	108.3
164	S	25.5	Very low	26.3	Very low	116 Å²	116	125.9 Å²	125.9	81%	0.811	78%	0.783	S	S	*	*			trans	-154.9	114.7	-173.2	62.5	0	0	0	0	112.2
165	S	26.3	Very low	26.3	Very low	114 Å²	114	125.3 Å²	125.3	80%	0.797	79%	0.788	S	S	*	*			trans	-156.3	105.4	165.6	56.8	0	0	0	0	112.1
166	L	25	Very low	26.2	Very low	186 Å²	186	130.2 Å²	130.2	97%	0.974	79%	0.791	S	S	*	*			trans	30.3	124.9	151.9	-94.3	61.7	0	0	0	120.3
167	G	24.4	Very low	26.2	Very low	82 Å²	82	134.4 Å²	134.4	85%	0.845	81%	0.811	S	S	*	*			trans	-172.4	119.8	159.1	0	0	0	0	0	111.9
168	Q	24.8	Very low	26.7	Very low	176 Å²	176	130.4 Å²	130.4	82%	0.822	80%	0.802	S	S	*	*			trans	-82.5	140	-174.4	-58	159.6	-49.8	0	0	112.4
169	N	23.7	Very low	26.4	Very low	148 Å²	148	132 Å²	132	79%	0.791	80%	0.801	S	S	*	*				165.3	173.8	112.3	-83.1	-42	0	0	0	114.2
170	V	24.6	Very low	26.3	Very low	133 Å²	133	126.5 Å²	126.5	81%	0.806	80%	0.799	S	S	*	*			trans	-162.6	158.5	-153.6	167.1	0	0	0	0	106.4
171	P	42.8	Very low	26.3	Very low	97 Å²	97	128.1 Å²	128.1	63%	0.63	80%	0.797	S	S	*	*			cis	-134.2	-157.1	-14.3	40.4	-20.6	0	0	0	114.6
172	L	23.6	Very low	26.2	Very low	151 Å²	151	128.8 Å²	128.8	79%	0.791	80%	0.802	S	S	*	*			trans	70.7	141	157.1	-91.2	48.6	0	0	0	116.1
173	A	25.1	Very low	26.3	Very low	80 Å²	80	127.8 Å²	127.8	66%	0.661	80%	0.803	S	S	*	*			cis	73.9	151.9	38.6	0	0	0	0	0	113.2
174	D	25.9	Very low	26.2	Very low	139 Å²	139	126.1 Å²	126.1	74%	0.743	80%	0.797	S	S	*	*			cis	-162.3	175.3	26.2	-144.1	-21.7	0	0	0	112.4
175	V	26.5	Very low	26.1	Very low	121 Å²	121	125.4 Å²	125.4	73%	0.733	79%	0.792	S	S	*	*			trans	65.4	138.3	151.2	161.9	0	0	0	0	117
176	E	24.4	Very low	26	Very low	180 Å²	180	125.2 Å²	125.2	84%	0.841	79%	0.79	S	S	*	*			cis	-133.7	151.5	43.1	-71	-174.9	139.2	0	0	116.5
177	M	29.7	Very low	25.9	Very low	165 Å²	165	123.4 Å²	123.4	81%	0.813	78%	0.777	S	S	*	*			trans	-110.9	154.9	153.4	-81.3	-80.9	-68.1	0	0	107.9
178	P	35.3	Very low	25.9	Very low	112 Å²	112	129 Å²	129	73%	0.727	77%	0.773	S	S	*	*				-141.9	145.8	115.1	35.3	-22.5	0	0	0	116.3
179	N	23.5	Very low	25.8	Very low	157 Å²	157	129.1 Å²	129.1	84%	0.84	77%	0.773	S	S	*	*			trans	11	135.1	147.7	-56	-22.7	0	0	0	120.4
180	G	24.3	Very low	26.9	Very low	77 Å²	77	127.4 Å²	127.4	79%	0.794	77%	0.77	S	S	*	*			trans	-137.1	-51.5	176	0	0	0	0	0	117.6
181	S	23.6	Very low	27	Very low	118 Å²	118	125 Å²	125	83%	0.825	76%	0.764	S	S	*	*			trans	56.3	107	171.8	-178.1	0	0	0	0	120
182	A	23.5	Very low	26.3	Very low	106 Å²	106	128.2 Å²	128.2	88%	0.876	78%	0.776	S	S	*	*			trans	67.8	159.9	146.6	0	0	0	0	0	120.3
183	G	24.3	Very low	26.6	Very low	83 Å²	83	125 Å²	125	86%	0.856	77%	0.771	S	S	*	*			trans	140.4	115.6	172.4	0	0	0	0	0	113.3
184	S	24.1	Very low	26.8	Very low	108 Å²	108	125 Å²	125	76%	0.755	77%	0.771	S	S	*	*			trans	-101.6	164.8	-178.3	59.4	0	0	0	0	113.7
185	S	22.7	Very low	26.9	Very low	101 Å²	101	126.5 Å²	126.5	71%	0.706	77%	0.773	S	S	*	*			trans	66.2	113	145.7	55.5	0	0	0	0	121.6
186	S	24.1	Very low	27	Very low	110 Å²	110	127.9 Å²	127.9	77%	0.769	77%	0.771	S	S	*	*				67.9	124	130	-57.7	0	0	0	0	124.2
187	E	23.8	Very low	27.2	Very low	147 Å²	147	126 Å²	126	69%	0.687	77%	0.766	S	S	*	*			trans	90.9	129.7	131.8	-86.2	-170.9	-158.1	0	0	124.1
188	R	24.4	Very low	27	Very low	201 Å²	201	123.1 Å²	123.1	76%	0.758	76%	0.758	S	S	*	*			trans	85.3	103.4	148	-69.7	175	-145.6	-142.8	1.2	122.8
189	E	23.3	Very low	26.6	Very low	178 Å²	178	123.8 Å²	123.8	83%	0.832	76%	0.76	S	S	*	*				65.1	164.7	119.3	-89.9	-167.3	173	0	0	122.4
190	P	45.3	Very low	26.8	Very low	111 Å²	111	120 Å²	120	72%	0.721	75%	0.751	S	S	*	*			cis	-133.8	-176.7	-7.8	31.2	-9.5	0	0	0	116.6
191	A	27.6	Very low	26.9	Very low	83 Å²	83	126 Å²	126	69%	0.686	76%	0.758	S	S	*	*			trans	99	119	142.8	0	0	0	0	0	122.5
192	D	26.9	Very low	27	Very low	164 Å²	164	123.6 Å²	123.6	88%	0.877	75%	0.752	S	S	*	*			trans	64.8	138.7	135.9	-68	-8.5	0	0	0	123
193	A	29.6	Very low	27.2	Very low	84 Å²	84	125.9 Å²	125.9	69%	0.694	75%	0.75	S	S	*	*			cis	-160.3	152.1	-4	0	0	0	0	0	114.8
194	A	29.5	Very low	27.2	Very low	79 Å²	79	130.5 Å²	130.5	65%	0.653	75%	0.747	S	S	*	*			trans	56.8	150	151	0	0	0	0	0	120.4
195	H	28.4	Very low	27.4	Very low	171 Å²	171	131.1 Å²	131.1	79%	0.792	75%	0.746	S	S	*	*			cis	-134.5	136.3	11.7	-83.4	-83.4	0	0	0	110.2
196	H	28.7	Very low	27.6	Very low	150 Å²	150	131.9 Å²	131.9	69%	0.694	75%	0.751	S	S	*	*				58.9	128.2	89.8	-84	-82.5	0	0	0	114.9
197	L	28.1	Very low	27.8	Very low	141 Å²	141	135 Å²	135	74%	0.738	76%	0.759	S	S	*	*			cis	-147.5	131	22.9	-87.2	126.4	0	0	0	111.4
198	T	26.9	Very low	27.9	Very low	104 Å²	104	131.9 Å²	131.9	64%	0.638	77%	0.766	S	S	*	*				54.9	141.5	100.4	68.3	0	0	0	0	116.8
199	T	26.6	Very low	27.9	Very low	126 Å²	126	128 Å²	128	77%	0.773	77%	0.77	S	S	*	*			cis	-164.4	135.5	10.8	9.4	0	0	0	0	106.5
200	A	27.1	Very low	28.1	Very low	79 Å²	79	127 Å²	127	65%	0.653	77%	0.77	S	S	*	*				87.5	129.7	69.2	0	0	0	0	0	115.6
201	E	26.1	Very low	27.2	Very low	201 Å²	201	125.6 Å²	125.6	94%	0.939	77%	0.768	S	S	*	*			trans	59.7	151.1	161.4	-60.9	172.2	-170.7	0	0	118.6
202	G	25.7	Very low	27.2	Very low	68 Å²	68	128.5 Å²	128.5	70%	0.701	77%	0.772	S	S	*	*			cis	171.3	174.6	-5.9	0	0	0	0	0	111.9
203	N	27.2	Very low	27.2	Very low	154 Å²	154	127.6 Å²	127.6	82%	0.824	76%	0.762	S	S	*	*			trans	71.3	131.8	162.7	-69.7	-28.3	0	0	0	123.4
204	F	25.5	Very low	27	Very low	181 Å²	181	131.4 Å²	131.4	79%	0.794	76%	0.763	S	S	*	*			trans	56.1	113.4	139.9	-79.6	-100.1	0	0	0	124.3
205	V	28.8	Very low	26.6	Very low	121 Å²	121	133.2 Å²	133.2	73%	0.733	77%	0.771	S	S	*	*				44.8	119.2	123.8	-176	0	0	0	0	120.4
206	S	26.3	Very low	26.4	Very low	117 Å²	117	130.1 Å²	130.1	82%	0.818	78%	0.775	S	S	*	*				-173.5	156.7	126.4	-84.7	0	0	0	0	114.1
207	N	26.9	Very low	26.2	Very low	174 Å²	174	131 Å²	131	93%	0.93	78%	0.781	S	S	*	*			trans	-76	154.3	169.3	-71.8	-23.9	0	0	0	111.7
208	G	26	Very low	26.1	Very low	82 Å²	82	130.6 Å²	130.6	85%	0.845	79%	0.785	S	S	*	*			trans	-171.8	145.4	169.1	0	0	0	0	0	112
209	S	25.8	Very low	26	Very low	120 Å²	120	132.6 Å²	132.6	84%	0.839	79%	0.787	S	S	*	*			trans	-136.2	168	-174.7	-172	0	0	0	0	112.1
210	L	26.1	Very low	25.9	Very low	157 Å²	157	132.4 Å²	132.4	82%	0.822	78%	0.777	S	S	*	*			trans	90.3	92.8	151	-150.7	70.3	0	0	0	120.2
211	A	27.4	Very low	25.9	Very low	82 Å²	82	138.6 Å²	138.6	68%	0.678	79%	0.785	S	S	*	*				71.7	147.3	125.4	0	0	0	0	0	124.6
212	D	26.9	Very low	25.8	Very low	144 Å²	144	132.5 Å²	132.5	77%	0.77	78%	0.776	S	S	*	*			trans	67.4	107.1	134.6	-91.4	17.1	0	0	0	123.2
213	Q	27.1	Very low	25.8	Very low	145 Å²	145	134.8 Å²	134.8	68%	0.678	78%	0.781	S	S	*	*				-178	140.3	94.1	-102.1	163	101.2	0	0	118.6
214	K	25.5	Very low	25.7	Very low	163 Å²	163	134.5 Å²	134.5	71%	0.709	78%	0.779	S	S	*	*			trans	54.5	114.5	137	-69.5	164.4	-173	161.5	0	122.9
215	S	22	Very low	25.9	Very low	118 Å²	118	134 Å²	134	83%	0.825	78%	0.784	S	S	*	*				43	129	107.3	-43.4	0	0	0	0	122.4
216	A	23.7	Very low	25.9	Very low	106 Å²	106	136 Å²	136	88%	0.876	79%	0.785	S	S	*	*				-165.9	153	120.5	0	0	0	0	0	112.7
217	M	25.4	Very low	25.8	Very low	167 Å²	167	136.3 Å²	136.3	82%	0.823	78%	0.777	S	S	*	*			trans	-107.6	143.2	175.9	78.9	-175.1	-166.2	0	0	112
218	V	25.2	Very low	26.1	Very low	134 Å²	134	138.4 Å²	138.4	81%	0.812	77%	0.774	S	S	*	*			trans	-160.6	125	151.6	176.9	0	0	0	0	104.3
219	Q	24.7	Very low	26.1	Very low	146 Å²	146	140.7 Å²	140.7	68%	0.682	77%	0.767	S	S	*	*			cis	97.4	135.1	30.2	-150.4	-169.4	19	0	0	114.4
220	H	25.1	Very low	26.3	Very low	121 Å²	121	142.4 Å²	142.4	56%	0.56	77%	0.766	S	S	*	*			trans	90.7	131.6	157.8	-85.6	-65.2	0	0	0	124.1
221	Y	26.7	Very low	26.6	Very low	210 Å²	210	142.8 Å²	142.8	82%	0.824	76%	0.764	S	S	*	*			trans	55.9	138.8	161.1	-57.7	-68.8	0	0	0	119.3
222	G	24.3	Very low	26.8	Very low	73 Å²	73	147.4 Å²	147.4	75%	0.753	77%	0.772	S	S	*	*			cis	120.5	126.5	-1.6	0	0	0	0	0	113.5
223	S	26	Very low	26.9	Very low	116 Å²	116	144.9 Å²	144.9	81%	0.811	77%	0.77	S	S	*	*			trans	-169.9	136.6	152.3	-168.6	0	0	0	0	110.2
224	D	24.6	Very low	27	Very low	147 Å²	147	146.6 Å²	146.6	79%	0.786	78%	0.778	S	S	*	*			trans	-76.8	164	162.7	-45.9	-86.8	0	0	0	110.5
225	I	29.7	Very low	27	Very low	172 Å²	172	143.7 Å²	143.7	88%	0.882	78%	0.779	S	S	*	*			trans	-153.6	151.6	145.7	-130.2	168.9	0	0	0	109.9
226	E	27.6	Very low	27.2	Very low	162 Å²	162	141.3 Å²	141.3	76%	0.757	77%	0.773	S	S	*	*			trans	-105.6	169.7	-158.4	-61.3	167	130.7	0	0	113.6
227	D	26.1	Very low	27.3	Very low	124 Å²	124	144 Å²	144	66%	0.663	77%	0.772	S	S	*	*			trans	50.5	128.3	150.5	-58.8	-6.7	0	0	0	121.5
228	Y	31.4	Very low	27.4	Very low	217 Å²	217	142.2 Å²	142.2	85%	0.851	77%	0.77	S	S	*	*				-165.8	149.7	87.6	-114.9	-85.8	0	0	0	112.9
229	D	27.5	Very low	27.6	Very low	131 Å²	131	143 Å²	143	70%	0.701	76%	0.758	S	S	*	*			trans	-79.1	159.1	179.7	-59.2	-69.3	0	0	0	114.1
230	D	30	Very low	27.7	Very low	155 Å²	155	142.3 Å²	142.3	83%	0.829	76%	0.76	S	S	*	*				-173.9	97.5	112.5	-105	-18.8	0	0	0	112.9
231	E	32.3	Very low	27.7	Very low	165 Å²	165	140.7 Å²	140.7	77%	0.771	76%	0.762	S	S	*	*				51.2	159.2	121.7	-81.4	-69.4	-173.5	0	0	126.5
232	E	31.3	Very low	27.7	Very low	180 Å²	180	140.9 Å²	140.9	84%	0.841	76%	0.761	S	S	*	*			trans	65.1	129.3	166.5	-73.6	-163	177.8	0	0	119.6
233	A	29.1	Very low	27.7	Very low	90 Å²	90	144.9 Å²	144.9	74%	0.744	76%	0.758	S	S	*	*			cis	-155.7	165.5	-3.5	0	0	0	0	0	113.6
234	E	28.1	Very low	27.8	Very low	181 Å²	181	145 Å²	145	85%	0.846	76%	0.759	S	S	*	*			trans	-67.4	-175.8	174.6	-48.4	-173.7	79.9	0	0	113.7
235	S	26.6	Very low	28	Very low	103 Å²	103	148.2 Å²	148.2	72%	0.72	76%	0.76	S	S	*	*			cis	-165.8	176	16.3	-153.7	0	0	0	0	113.9
236	G	26.1	Very low	27.9	Very low	68 Å²	68	145.6 Å²	145.6	70%	0.701	76%	0.757	S	S	*	*				104.6	71.6	128.7	0	0	0	0	0	118.7
237	L	26.7	Very low	27.9	Very low	163 Å²	163	144.6 Å²	144.6	85%	0.853	76%	0.756	S	S	*	*			trans	-61.6	143.8	153.8	-68	164.3	0	0	0	110.4
238	T	26.5	Very low	28	Very low	128 Å²	128	147.6 Å²	147.6	79%	0.785	76%	0.758	S	S	*	*				167.4	118.8	113.8	38.3	0	0	0	0	116.5
239	R	29.3	Very low	27.9	Very low	150 Å²	150	146.7 Å²	146.7	57%	0.566	76%	0.758	S	S	*	*				62.4	125.8	111.8	-140.2	-171.3	-177.9	167.8	4.4	121.1	C121 P122	C121-R239 PolarHBondContact O-NE 2.73Å; C121-R239 PolarHBondContact O-NH2 2.97Å; P122-R239 PolarHBondContact O-NH2 3.35Å
240	N	26.2	Very low	27.7	Very low	132 Å²	132	145 Å²	145	71%	0.706	76%	0.762	S	S	*	*				113.6	147	123.3	-134.9	-14.9	0	0	0	122.2
241	S	25.5	Very low	27.6	Very low	87 Å²	87	147.4 Å²	147.4	61%	0.608	76%	0.761	S	S	*	*			trans	76.1	84.3	144.7	-166.5	0	0	0	0	123.1
242	R	27.8	Very low	27.3	Very low	214 Å²	214	142.8 Å²	142.8	81%	0.808	76%	0.758	S	S	*	*				53.1	161.4	110.3	-63.5	178.7	172.4	-169.2	-0.6	122.8
243	F	24.2	Very low	27.1	Very low	157 Å²	157	139.6 Å²	139.6	69%	0.689	76%	0.762	S	S	*	*			trans	75.5	121.1	161	-91.7	-90.9	0	0	0	117
244	S	27.7	Very low	27	Very low	119 Å²	119	138.5 Å²	138.5	83%	0.832	76%	0.76	S	S	*	*				-156.6	159.4	68.6	-79.6	0	0	0	0	117.1
245	R	28.5	Very low	27.1	Very low	215 Å²	215	141.3 Å²	141.3	81%	0.811	76%	0.762	S	S	*	*			trans	-97.6	139.9	171	-51.6	173	179.8	-166.8	-0.9	110
246	S	28.5	Very low	27	Very low	117 Å²	117	143.2 Å²	143.2	82%	0.818	76%	0.763	S	S	*	*			trans	-164.3	140.1	165.6	-166.8	0	0	0	0	112.5
247	I	26.7	Very low	27	Very low	141 Å²	141	145.1 Å²	145.1	72%	0.723	76%	0.761	S	S	*	*			cis	-157.7	165.4	-38.1	-124.1	162.1	0	0	0	110.2
248	R	27.6	Very low	27	Very low	187 Å²	187	144.3 Å²	144.3	71%	0.706	76%	0.757	S	S	*	*			trans	-61	144.8	175.2	-63.3	161.6	-78.5	-149.7	-6.1	113.9
249	K	29.3	Very low	27	Very low	197 Å²	197	145 Å²	145	86%	0.857	76%	0.755	S	S	*	*				-175.5	160.7	127.9	-101	160.1	-177.9	179.6	0	110.1
250	A	23.8	Very low	26.8	Very low	95 Å²	95	143.6 Å²	143.6	79%	0.785	76%	0.759	S	S	*	*			cis	-127	173.8	12.4	0	0	0	0	0	114.3
251	Y	27.3	Very low	26.8	Very low	206 Å²	206	143 Å²	143	81%	0.808	76%	0.76	S	S	*	*			trans	-109	154.4	-176.7	-80.3	-107	0	0	0	112.6
252	G	25.9	Very low	26.9	Very low	69 Å²	69	145.4 Å²	145.4	71%	0.711	77%	0.766	S	S	*	*			trans	-173.3	114.2	155.2	0	0	0	0	0	107.6
253	A	28.2	Very low	26.9	Very low	112 Å²	112	142.8 Å²	142.8	93%	0.926	77%	0.768	S	S	*	*				60	119.5	51.6	0	0	0	0	0	112.4
254	G	26.7	Very low	27	Very low	67 Å²	67	138.1 Å²	138.1	69%	0.691	77%	0.765	S	S	*	*			cis	146.8	132.7	-5.9	0	0	0	0	0	112.5
255	R	29.1	Very low	27.1	Very low	240 Å²	240	143.9 Å²	143.9	91%	0.906	77%	0.768	S	S	*	*			trans	-163.1	131.4	166.6	-98.7	151	-172	175.3	2.5	107.7
256	I	26.3	Very low	27	Very low	143 Å²	143	138.4 Å²	138.4	73%	0.733	76%	0.763	S	S	*	*			cis	77.8	122.4	40.3	-60.2	167.4	0	0	0	110.9
257	T	26	Very low	26.9	Very low	109 Å²	109	137.6 Å²	137.6	67%	0.669	75%	0.75	S	S	*	*			cis	-164.5	174.9	-11.8	25	0	0	0	0	108.1
258	L	25	Very low	27	Very low	145 Å²	145	138.5 Å²	138.5	76%	0.759	75%	0.748	S	S	*	*				160.6	129.7	113.2	-81.2	172.7	0	0	0	114.6
259	L	27.6	Very low	27	Very low	142 Å²	142	135.7 Å²	135.7	74%	0.743	75%	0.747	S	S	*	*			trans	57.9	125.7	142.5	-60.7	173.8	0	0	0	120.6
260	D	24.3	Very low	26.8	Very low	122 Å²	122	132.3 Å²	132.3	65%	0.652	74%	0.739	S	S	*	*				93.9	117.5	55.2	-162.3	33.1	0	0	0	110.5
261	T	27.6	Very low	26.8	Very low	119 Å²	119	132.8 Å²	132.8	73%	0.73	73%	0.732	S	S	*	*				-170	165.1	77.5	27.5	0	0	0	0	115.1
262	N	26.6	Very low	26.7	Very low	137 Å²	137	129.5 Å²	129.5	73%	0.733	73%	0.733	S	S	*	*			trans	-46.1	172.7	164.3	-57.5	-53.2	0	0	0	115
263	N	27.6	Very low	26.7	Very low	159 Å²	159	131.3 Å²	131.3	85%	0.85	74%	0.735	S	S	*	*			cis	-158.8	175.7	17.3	-124.1	-21.9	0	0	0	108
264	G	27.7	Very low	26.6	Very low	60 Å²	60	129.6 Å²	129.6	62%	0.619	72%	0.716	S	S	*	*			cis	179.4	-174.1	4.7	0	0	0	0	0	111.5
265	R	28.6	Very low	26.8	Very low	239 Å²	239	131.6 Å²	131.6	90%	0.902	72%	0.715	S	S	*	*			trans	-66.7	179.4	-176.8	-50.3	170.4	170	159.5	-8	113.5
266	S	26.6	Very low	26.7	Very low	100 Å²	100	127.1 Å²	127.1	70%	0.699	70%	0.704	S	S	*	*			cis	-175.3	172.6	37.4	-105.5	0	0	0	0	109.4
267	D	27	Very low	27.1	Very low	101 Å²	101	125.1 Å²	125.1	54%	0.54	69%	0.694	S	S	.	*			cis	-170.6	157.1	-18	-112.8	53.6	0	0	0	110.1
268	K	28.2	Very low	27.9	Very low	160 Å²	160	124.8 Å²	124.8	70%	0.696	69%	0.694	S	S	*	*			trans	61.6	136.3	145.6	-69.4	-173.6	-175.6	80.8	0	125.5
269	N	27.6	Very low	28.3	Very low	128 Å²	128	123.5 Å²	123.5	68%	0.684	69%	0.688	S	S	*	*			trans	61.6	161	133.8	-64.9	48.1	0	0	0	120.6
270	D	24.9	Very low	29.3	Very low	126 Å²	126	120.9 Å²	120.9	67%	0.674	68%	0.679	S	S	*	*			cis	-154.6	138.3	-11.2	-109.4	-38.1	0	0	0	107.6
271	T	24.4	Very low	29.5	Very low	105 Å²	105	119.9 Å²	119.9	64%	0.644	68%	0.682	S	S	*	*				82.1	82.2	82.2	-52.7	0	0	0	0	117.9
272	T	25.8	Very low	29.6	Very low	137 Å²	137	121.6 Å²	121.6	84%	0.84	69%	0.686	S	S	*	*			trans	69.6	170.3	154.2	78.7	0	0	0	0	118.6
273	S	24.9	Very low	29.7	Very low	107 Å²	107	123.8 Å²	123.8	75%	0.748	69%	0.689	S	S	*	*			cis	-159.1	166	7.1	74.4	0	0	0	0	115
274	S	26	Very low	29.8	Very low	75 Å²	75	121.8 Å²	121.8	52%	0.524	68%	0.682	S	S	.	*			trans	81.1	153.5	143.8	-149.3	0	0	0	0	123.2	R685	S274-R685 PolarHBondContact OG-NH2 2.73Å
275	T	30.6	Very low	29.8	Very low	109 Å²	109	125.9 Å²	125.9	67%	0.669	69%	0.69	S	S	*	*			trans	-119	150.6	-160.4	-37.1	0	0	0	0	114.3	R685	T275-R685 PolarHBondContact O-NH2 3.46Å
276	Q	26.5	Very low	30	Very low	146 Å²	146	119.9 Å²	119.9	68%	0.682	68%	0.68	S	S	*	*			trans	-157.9	163.6	161.7	-116.6	163.3	-10.5	0	0	113.2
277	I	35	Very low	30.2	Very low	101 Å²	101	123.7 Å²	123.7	52%	0.518	69%	0.686	S	S	.	*			trans	-149.4	137.9	-167.8	-64.6	177.2	0	0	0	105.9	V682	I277-V682 HydrophobicContact CB-CG1 3.9Å; I277-V682 HydrophobicContact CG2-CG1 3.73Å; I277-V682 HydrophobicContact CG2-CG2 4.5Å
278	P	43	Very low	30.5	Very low	103 Å²	103	125.2 Å²	125.2	67%	0.669	70%	0.699	S	S	*	*				-155.1	159.8	68	38.9	-16.1	0	0	0	121.5
279	N	33.6	Very low	30.9	Very low	118 Å²	118	124.2 Å²	124.2	63%	0.631	70%	0.697	S	S	*	*			trans	14.4	163.4	134.9	-69.2	-16.2	0	0	0	122.6
280	P	48	Very low	31	Very low	86 Å²	86	124 Å²	124	56%	0.558	70%	0.701	S	S	*	*			cis	-144.9	178.6	16.3	36.2	-13.5	0	0	0	119.8
281	S	28.5	Very low	31.6	Very low	102 Å²	102	124.3 Å²	124.3	71%	0.713	70%	0.698	S	S	*	*			trans	66.6	154.3	145	45.9	0	0	0	0	121.7
282	L	30.2	Very low	32.1	Very low	154 Å²	154	125.8 Å²	125.8	81%	0.806	70%	0.696	S	S	*	*			cis	-160.8	165.7	-11.3	-109.7	167.1	0	0	0	112
283	K	30	Very low	32.6	Very low	183 Å²	183	125.2 Å²	125.2	80%	0.796	68%	0.684	S	S	*	*			trans	-14.4	156.8	172.1	-64.6	176.1	176.1	-171.4	0	122.9
284	V	29.4	Very low	33	Very low	118 Å²	118	125.8 Å²	125.8	72%	0.715	68%	0.678	S	S	*	*				164.7	121.8	111.7	157.5	0	0	0	0	113.5
285	D	26.8	Very low	33.1	Very low	145 Å²	145	128.6 Å²	128.6	78%	0.775	69%	0.686	S	S	*	*			trans	47.8	159.5	136.6	-51.1	-9.4	0	0	0	122.4
286	V	32	Very low	33	Very low	114 Å²	114	130.3 Å²	130.3	69%	0.691	69%	0.691	S	S	*	*			cis	-167.6	165.3	-5	120	0	0	0	0	114.1
287	E	30.9	Very low	33.1	Very low	180 Å²	180	128.6 Å²	128.6	84%	0.841	69%	0.69	S	S	*	*			trans	84.5	167.8	155.7	-93.5	154	-144.2	0	0	127.1
288	T	35	Very low	32.7	Very low	132 Å²	132	130.3 Å²	130.3	81%	0.81	70%	0.7	S	S	*	*			trans	-111.2	174.6	-144.9	46.5	0	0	0	0	118.1
289	E	36.1	Very low	31.9	Very low	139 Å²	139	130.7 Å²	130.7	65%	0.65	70%	0.701	S	S	*	*			cis	-124.5	-97.6	-10.1	-173.6	-140.1	177.3	0	0	112.9	Q291	E289-Q291 WeakPolarHBondContact OE1-CG 3.19Å; E289-Q291 PolarHBondContact OE1-NE2 3.37Å; E289-Q291 VanDerWaalsContact OE1-NE2 3.14Å
290	T	30.7	Very low	31.6	Very low	124 Å²	124	132.5 Å²	132.5	76%	0.761	71%	0.71	S	S	*	*			cis	-156.3	152.3	2.7	-48.6	0	0	0	0	112.7
291	Q	37.2	Very low	30.4	Very low	133 Å²	133	132.9 Å²	132.9	62%	0.621	71%	0.714	S	S	*	*			trans	-99	165.7	-178.2	-49.5	-171.4	11.2	0	0	114.6	E289	E289-Q291 WeakPolarHBondContact OE1-CG 3.19Å; E289-Q291 PolarHBondContact OE1-NE2 3.37Å; E289-Q291 VanDerWaalsContact OE1-NE2 3.14Å
292	K	34.8	Very low	30.4	Very low	136 Å²	136	138.8 Å²	138.8	59%	0.591	72%	0.721	S	S	*	*			cis	-151.2	-148.4	17.4	-138.9	154.2	166.4	-76.9	0	109.8
293	E	35.4	Very low	30.2	Very low	125 Å²	125	139.2 Å²	139.2	58%	0.584	72%	0.723	S	S	*	*			cis	-158	-175.5	11.6	-162.2	43.4	-71.4	0	0	113.2
294	N	32.6	Very low	30	Very low	118 Å²	118	135 Å²	135	63%	0.631	72%	0.716	S	S	*	*			trans	-107.3	170.5	-171.3	-72.8	-92.3	0	0	0	113.3
295	I	29.7	Very low	30	Very low	135 Å²	135	138.2 Å²	138.2	69%	0.692	72%	0.721	S	S	*	*			cis	-170.4	169.5	-4.5	-113.4	173.6	0	0	0	111.4
296	N	27.9	Very low	30	Very low	144 Å²	144	136.8 Å²	136.8	77%	0.77	72%	0.722	S	S	*	*			trans	128.4	148.8	137.3	-110.2	-21.6	0	0	0	124.7
297	V	27.6	Very low	29.8	Very low	111 Å²	111	135.4 Å²	135.4	67%	0.673	72%	0.723	S	S	*	*			trans	-64.1	-179.8	-175.1	-59.9	0	0	0	0	119.4
298	N	26.9	Very low	29.8	Very low	136 Å²	136	135.1 Å²	135.1	73%	0.727	72%	0.722	S	S	*	*			cis	-163.7	154.5	1	-124.9	-4.7	0	0	0	114.7
299	V	25.9	Very low	29.6	Very low	112 Å²	112	135.7 Å²	135.7	68%	0.679	72%	0.72	S	S	*	*			trans	36.7	122.8	141	-176.1	0	0	0	0	122.4
300	L	27.1	Very low	29.4	Very low	156 Å²	156	136.7 Å²	136.7	82%	0.817	73%	0.729	S	S	*	*				179.9	130.1	116.1	-99.9	-176.1	0	0	0	117.5
301	S	24.8	Very low	29.4	Very low	94 Å²	94	138.5 Å²	138.5	66%	0.657	73%	0.728	S	S	*	*			trans	79.9	129.2	134.2	80.3	0	0	0	0	125.4
302	R	26.5	Very low	29	Very low	226 Å²	226	140 Å²	140	85%	0.853	74%	0.739	S	S	*	*				77.5	136.6	126.6	-83.5	-179.2	175.6	-170.4	-1.1	123.3
303	L	27.4	Very low	28.7	Very low	163 Å²	163	141.7 Å²	141.7	85%	0.853	75%	0.747	S	S	*	*			trans	68.6	163.9	157.9	-60.9	163.6	0	0	0	116.8
304	S	25	Very low	28.3	Very low	93 Å²	93	145 Å²	145	65%	0.65	75%	0.753	S	S	*	*			cis	-171.4	154.9	-47.5	-148	0	0	0	0	109.4
305	K	28.7	Very low	28.1	Very low	186 Å²	186	148.8 Å²	148.8	81%	0.809	76%	0.759	S	S	*	*			trans	62.8	105.9	154.7	-73.3	-175.4	176.8	-174.8	0	122.4
306	S	27.1	Very low	28	Very low	115 Å²	115	149.9 Å²	149.9	80%	0.804	76%	0.759	S	S	*	*				64.5	170.3	120	64.6	0	0	0	0	123.5
307	A	29.4	Very low	28	Very low	86 Å²	86	147.7 Å²	147.7	71%	0.711	75%	0.747	S	S	*	*			trans	78.3	118	-172.2	0	0	0	0	0	113.9
308	E	30	Very low	28	Very low	173 Å²	173	150.2 Å²	150.2	81%	0.808	75%	0.751	S	S	*	*				74.6	100.7	62.6	-68.3	-178.3	165.3	0	0	112.2
309	N	30.2	Very low	28.2	Very low	145 Å²	145	149.4 Å²	149.4	78%	0.775	76%	0.755	S	S	*	*				73.9	113.5	84.9	-78.7	-35.8	0	0	0	114.1
310	L	32.2	Very low	29	Very low	159 Å²	159	150.4 Å²	150.4	83%	0.832	76%	0.764	S	S	*	*				173.3	167.7	114	-87.5	173.2	0	0	0	112.7
311	H	31.5	Very low	28.8	Very low	162 Å²	162	146.3 Å²	146.3	75%	0.75	76%	0.759	S	S	*	*			trans	-71.9	171.9	-172.6	-52.9	-117.1	0	0	0	114.8
312	I	27.8	Very low	30.7	Very low	165 Å²	165	148 Å²	148	85%	0.846	77%	0.768	S	S	*	*				-171.5	156.5	112.9	-95.4	157.3	0	0	0	114.8
313	F	28.8	Very low	32.1	Very low	172 Å²	172	143 Å²	143	75%	0.754	76%	0.764	S	S	*	*			trans	-66.4	162.7	-166.1	-69.5	-93.7	0	0	0	122.1
314	R	28	Very low	32.5	Very low	193 Å²	193	140.5 Å²	140.5	73%	0.728	76%	0.761	S	S	*	*				99.7	142.7	121.5	-102	172.3	176.9	-179.1	1.9	122.7
315	R	27.3	Very low	34.2	Very low	198 Å²	198	141 Å²	141	75%	0.747	76%	0.762	S	S	*	*			trans	75	154.6	141.4	-82.2	176.3	-180	-171.3	-1.3	118.3
316	K	28.1	Very low	34.1	Very low	159 Å²	159	139.4 Å²	139.4	69%	0.691	76%	0.757	S	S	*	*			cis	-172.7	155.4	-23.2	-142.8	-161.4	168.1	-155	0	110.1
317	N	27.3	Very low	34.3	Very low	98 Å²	98	141.9 Å²	141.9	52%	0.524	76%	0.756	S	S	.	*			trans	64.1	161.8	157.2	-71.3	17.6	0	0	0	117.6
318	H	27.4	Very low	34.4	Very low	164 Å²	164	144.5 Å²	144.5	76%	0.759	76%	0.758	S	S	*	*			cis	-158.1	-179.4	-19.4	-103.8	-15	0	0	0	111.5
319	C	32.7	Very low	35.4	Very low	118 Å²	118	140.3 Å²	140.3	80%	0.797	75%	0.746	S	S	*	*			trans	-80.7	179	-170.7	-42.3	0	0	0	0	116.1
320	P	41.5	Very low	35.5	Very low	134 Å²	134	140.9 Å²	140.9	87%	0.87	74%	0.744	S	S	*	*				-147.2	-178.3	101.2	39.4	-22.7	0	0	0	117.5
321	G	24.1	Very low	35.3	Very low	69 Å²	69	141 Å²	141	71%	0.711	73%	0.733	S	S	*	*			trans	-147.3	-159.8	172.4	0	0	0	0	0	110.6
322	P	64.3	Low	35.2	Very low	130 Å²	130	139.6 Å²	139.6	84%	0.844	73%	0.73	S	S	*	*			cis	-112.4	-110.7	6.6	32.6	-9.7	0	0	0	113.6
323	P	54.6	Low	35.2	Very low	120 Å²	120	137.7 Å²	137.7	78%	0.779	73%	0.726	S	S	*	*			cis	-132.8	-162	6.7	45.2	-24.6	0	0	0	117
324	S	37	Very low	35.2	Very low	112 Å²	112	136.8 Å²	136.8	78%	0.783	73%	0.728	S	S	*	*			trans	-168.4	-177.2	177.9	60.1	0	0	0	0	110.7
325	P	59.6	Low	35.1	Very low	103 Å²	103	132 Å²	132	67%	0.669	73%	0.725	S	S	*	*			cis	-140.5	-134.6	3	44.2	-20.6	0	0	0	114.6
326	Q	27.6	Very low	35.3	Very low	152 Å²	152	130.5 Å²	130.5	71%	0.71	73%	0.731	S	S	*	*			trans	78.6	151.2	162.1	-90.8	162.8	-62.4	0	0	119.5
327	E	30.8	Very low	35.3	Very low	167 Å²	167	126.1 Å²	126.1	78%	0.78	73%	0.731	S	S	*	*			cis	-155.6	178.3	-0.3	-152.3	152.7	-128.8	0	0	113.4
328	D	31.8	Very low	35.5	Very low	141 Å²	141	128.3 Å²	128.3	75%	0.754	75%	0.749	S	S	*	*			trans	-140.5	146.3	-173.2	-144.4	-21.3	0	0	0	109.7
329	P	51.8	Low	36.2	Very low	86 Å²	86	125.8 Å²	125.8	56%	0.558	75%	0.746	S	S	*	*				-156.7	112.2	116.3	36	-14.8	0	0	0	118.7	R331	P329-R331 PolarHBondContact O-NH2 3.34Å
330	Q	31.5	Very low	36	Very low	156 Å²	156	125 Å²	125	73%	0.729	74%	0.742	S	S	*	*			trans	70.4	-164	145.5	-50.1	144.7	2.1	0	0	115.1
331	R	28.5	Very low	35.5	Very low	163 Å²	163	124 Å²	124	62%	0.615	73%	0.729	S	S	*	*			cis	-172.5	164	17.8	-138.2	176.2	-76.7	87.7	15.8	106.9	P329	P329-R331 PolarHBondContact O-NH2 3.34Å
332	I	27.9	Very low	35.7	Very low	132 Å²	132	127.2 Å²	127.2	68%	0.677	73%	0.725	S	S	*	*			cis	-152.4	171.8	3.3	-11.7	170	0	0	0	108.6
333	T	28.5	Very low	34	Very low	125 Å²	125	130.3 Å²	130.3	77%	0.767	72%	0.72	S	S	*	*			trans	65.2	175.6	154.4	52.9	0	0	0	0	117.7
334	L	28.2	Very low	32.6	Very low	152 Å²	152	130.6 Å²	130.6	80%	0.796	72%	0.719	S	S	*	*			cis	-137.5	-89.7	4.1	-149.3	173.2	0	0	0	114.8
335	S	26.1	Very low	32.1	Very low	94 Å²	94	129.6 Å²	129.6	66%	0.657	72%	0.718	S	S	*	*			trans	-131.7	157.5	-169.1	56.4	0	0	0	0	112.1
336	N	32.4	Very low	30.3	Very low	166 Å²	166	129.7 Å²	129.7	89%	0.888	72%	0.721	S	S	*	*			cis	-159	142.9	-29.5	-113.7	-11.9	0	0	0	106
337	G	28.9	Very low	30.1	Very low	67 Å²	67	129.4 Å²	129.4	69%	0.691	73%	0.73	S	S	*	*			trans	-173.8	-20.9	-176	0	0	0	0	0	119.7
338	T	30.6	Very low	30	Very low	144 Å²	144	126.1 Å²	126.1	88%	0.883	73%	0.725	S	S	*	*			trans	65.8	154.1	177.2	28.5	0	0	0	0	116.3
339	P	43.1	Very low	29.6	Very low	110 Å²	110	123.9 Å²	123.9	71%	0.714	72%	0.721	S	S	*	*				-143.3	-156.9	-126.8	34.1	-8.6	0	0	0	115.4
340	S	28.4	Very low	28.6	Very low	101 Å²	101	124.2 Å²	124.2	71%	0.706	72%	0.721	S	S	*	*			trans	89.2	162.7	136.2	95.8	0	0	0	0	117.4
341	I	29.8	Very low	28.5	Very low	115 Å²	115	123.7 Å²	123.7	59%	0.59	72%	0.723	S	S	*	*			cis	-160.6	170.4	-16.1	-122.8	173.2	0	0	0	111.1
342	Q	28.2	Very low	28.9	Very low	136 Å²	136	120.8 Å²	120.8	64%	0.636	72%	0.72	S	S	*	*			trans	-14.7	162.4	157.6	-42.4	149.9	-2.7	0	0	118.2
343	R	28.5	Very low	29.6	Very low	195 Å²	195	125 Å²	125	74%	0.736	73%	0.727	S	S	*	*				164.7	168.8	90	-156.5	163.4	-69.7	146.8	-1.1	112.8
344	T	26.5	Very low	30.2	Very low	125 Å²	125	122.3 Å²	122.3	77%	0.767	72%	0.724	S	S	*	*			trans	-95.6	151.4	177.9	42	0	0	0	0	113.7
345	A	25.7	Very low	30.5	Very low	92 Å²	92	125.4 Å²	125.4	76%	0.76	73%	0.725	S	S	*	*			trans	68.6	158	154	0	0	0	0	0	120.5
346	S	21.6	Very low	30.6	Very low	105 Å²	105	130.4 Å²	130.4	73%	0.734	73%	0.73	S	S	*	*			trans	85.5	121.9	169.5	-42.6	0	0	0	0	117.4
347	T	23.5	Very low	30.4	Very low	146 Å²	146	127 Å²	127	90%	0.896	72%	0.719	S	S	*	*			trans	63	168.8	172.9	81.1	0	0	0	0	113.7
348	S	27.9	Very low	31.2	Very low	97 Å²	97	129.1 Å²	129.1	68%	0.678	72%	0.721	S	S	*	*			cis	-140	140.5	-8.3	95	0	0	0	0	107.2
349	S	24.4	Very low	31.1	Very low	95 Å²	95	128 Å²	128	66%	0.664	71%	0.714	S	S	*	*				62	123	93.8	-169.3	0	0	0	0	114.7
350	V	29.7	Very low	30.7	Very low	92 Å²	92	131.8 Å²	131.8	56%	0.558	72%	0.719	S	S	*	*			trans	70.8	116.4	146.3	163.3	0	0	0	0	115	L352	V350-L352 HydrophobicContact CG1-CD1 3.77Å; V350-L352 HydrophobicContact CG1-CD2 4.03Å; V350-L352 HydrophobicContact CG1-CG 3.56Å
351	D	30.4	Very low	31	Very low	145 Å²	145	133.1 Å²	133.1	78%	0.775	72%	0.718	S	S	*	*				65.2	158	74.6	-72.6	-62	0	0	0	111.7
352	L	37.5	Very low	31.2	Very low	103 Å²	103	136.4 Å²	136.4	54%	0.539	73%	0.728	S	S	.	*				-166.9	133.6	58.1	-76.7	167.2	0	0	0	113.7	V350	V350-L352 HydrophobicContact CG1-CD1 3.77Å; V350-L352 HydrophobicContact CG1-CD2 4.03Å; V350-L352 HydrophobicContact CG1-CG 3.56Å
353	R	42.5	Very low	31.4	Very low	219 Å²	219	133.2 Å²	133.2	83%	0.826	73%	0.732	S	S	*	*			trans	65.4	151.4	140.5	-56.9	169.9	-152	-85.6	5.1	116.7
354	G	41.6	Very low	32.1	Very low	69 Å²	69	129 Å²	129	71%	0.711	73%	0.73	S	S	*	*			cis	178.1	169.6	-3.1	0	0	0	0	0	108.8
355	R	33.8	Very low	32.1	Very low	218 Å²	218	130.4 Å²	130.4	82%	0.823	73%	0.73	S	S	*	*			cis	-152.3	165	26.1	-66.6	178.3	177.2	-156.6	-0.7	107.4
356	R	27.9	Very low	32.2	Very low	199 Å²	199	132.2 Å²	132.2	75%	0.751	73%	0.725	S	S	*	*			cis	-166.4	140.1	1.2	-125.4	176.9	-173.8	-174.2	-0.6	109.5
357	S	28.7	Very low	32.4	Very low	94 Å²	94	135.6 Å²	135.6	66%	0.657	73%	0.726	S	S	*	*			trans	31.5	160.3	132.2	63.2	0	0	0	0	123.9
358	P	45.5	Very low	32.5	Very low	112 Å²	112	135.3 Å²	135.3	73%	0.727	72%	0.719	S	S	*	*			cis	-147.2	160.8	-25.6	37.6	-17.2	0	0	0	118.7
359	T	29	Very low	32.5	Very low	120 Å²	120	137.3 Å²	137.3	74%	0.736	72%	0.72	S	S	*	*			trans	13.4	141.5	144.6	65.9	0	0	0	0	124.4
360	K	34.7	Very low	32.7	Very low	190 Å²	190	136.4 Å²	136.4	83%	0.826	73%	0.726	S	S	*	*				179.5	157	102.7	-99.1	173.2	-176.9	175.4	0	116.5
361	N	32.9	Very low	32.9	Very low	128 Å²	128	136.7 Å²	136.7	68%	0.684	73%	0.732	S	S	*	*			trans	73.3	118.6	154.8	-78.7	-14	0	0	0	123.3
362	K	34.8	Very low	33	Very low	184 Å²	184	137 Å²	137	80%	0.8	73%	0.731	S	S	*	*				53.8	124.7	123.6	-60	-177.8	-178	-175.8	0	120.6
363	G	33.1	Very low	33	Very low	70 Å²	70	136.7 Å²	136.7	72%	0.722	73%	0.733	S	S	*	*			trans	-72.8	162.5	141.8	0	0	0	0	0	111.1
364	P	42.9	Very low	32.4	Very low	106 Å²	106	132.6 Å²	132.6	69%	0.688	73%	0.728	S	S	*	*				-149.5	177.6	97.4	42.3	-28.1	0	0	0	115
365	M	26	Very low	31.8	Very low	155 Å²	155	136.4 Å²	136.4	76%	0.764	73%	0.731	S	S	*	*			trans	64.5	120.8	146.9	-78.8	-176.7	-74.2	0	0	118.9
366	I	27.5	Very low	31.7	Very low	130 Å²	130	132.3 Å²	132.3	67%	0.667	73%	0.731	S	S	*	*				75	112.8	75.9	-74.3	-178.6	0	0	0	112.5
367	K	26.4	Very low	31.7	Very low	175 Å²	175	126 Å²	126	76%	0.761	73%	0.728	S	S	*	*			trans	40.7	162.8	136.4	-48.6	175.9	-167.4	173.8	0	121.3
368	L	26.2	Very low	31.7	Very low	140 Å²	140	132.4 Å²	132.4	73%	0.733	74%	0.737	S	S	*	*				101.7	126.7	128.8	-127.7	74	0	0	0	117.8
369	I	27.7	Very low	30.9	Very low	139 Å²	139	136.3 Å²	136.3	71%	0.713	74%	0.738	S	S	*	*			trans	41	111.7	137.1	-66.9	173.3	0	0	0	117.5
370	G	27.9	Very low	30.8	Very low	77 Å²	77	137.4 Å²	137.4	79%	0.794	73%	0.732	S	S	*	*				-120.5	89.3	123.3	0	0	0	0	0	110.2
371	S	33.4	Very low	30.4	Very low	97 Å²	97	135.4 Å²	135.4	68%	0.678	73%	0.726	S	S	*	*			trans	58.8	153.4	152.8	-69.4	0	0	0	0	120.8
372	M	32.8	Very low	30.2	Very low	152 Å²	152	134.4 Å²	134.4	75%	0.749	73%	0.729	S	S	*	*			cis	-152.6	150.3	-1.7	-131	166	69.3	0	0	114.4
373	T	38.5	Very low	30.1	Very low	96 Å²	96	131.3 Å²	131.3	59%	0.589	73%	0.728	S	S	*	*			trans	43	100.7	146.9	48.4	0	0	0	0	120.5
374	D	28.7	Very low	29.8	Very low	133 Å²	133	133 Å²	133	71%	0.711	73%	0.728	S	S	*	*				69.9	143.4	95.7	-76.3	-37.8	0	0	0	122.8
375	L	28.6	Very low	29.6	Very low	149 Å²	149	132.9 Å²	132.9	78%	0.78	73%	0.728	S	S	*	*			trans	54	128.6	137.3	-59.6	168.8	0	0	0	118
376	T	32.6	Very low	29.6	Very low	133 Å²	133	130.6 Å²	130.6	82%	0.816	73%	0.727	S	S	*	*			cis	-149.7	155.9	40.1	40.3	0	0	0	0	111.2
377	G	27.9	Very low	30	Very low	67 Å²	67	129.4 Å²	129.4	69%	0.691	73%	0.728	S	S	*	*			trans	-101.8	155.4	164.9	0	0	0	0	0	111.2
378	R	28.9	Very low	29.9	Very low	227 Å²	227	126.7 Å²	126.7	86%	0.857	73%	0.726	S	S	*	*			trans	165.9	115.7	146.7	-98.2	179	179	-144.8	0.1	111.9
379	R	27.7	Very low	30	Very low	194 Å²	194	125.1 Å²	125.1	73%	0.732	73%	0.727	S	S	*	*				87.5	113.7	111.1	-165.2	-178	-158.9	-137.4	9.3	119.6
380	K	27.1	Very low	30.9	Very low	143 Å²	143	124.3 Å²	124.3	62%	0.622	73%	0.73	S	S	*	*			trans	84.7	137	138.6	-83.6	176.9	140.7	-141.8	0	121.2
381	Q	26.2	Very low	31.2	Very low	148 Å²	148	126.2 Å²	126.2	69%	0.692	73%	0.731	S	S	*	*			trans	73.5	126	133.4	-72.1	177.1	-76.1	0	0	120.9
382	S	28.8	Very low	31.9	Very low	108 Å²	108	126.9 Å²	126.9	76%	0.755	73%	0.734	S	S	*	*			trans	-55.3	149.5	144.1	41.8	0	0	0	0	110.7
383	P	33.1	Very low	32	Very low	119 Å²	119	128.2 Å²	128.2	77%	0.773	74%	0.74	S	S	*	*				-145.1	-175.4	57.9	39.5	-19	0	0	0	116.8
384	S	26.3	Very low	32.3	Very low	104 Å²	104	128 Å²	128	73%	0.727	74%	0.743	S	S	*	*			trans	-65	178	156.1	56.6	0	0	0	0	111.9
385	P	39.4	Very low	32.9	Very low	105 Å²	105	127 Å²	127	68%	0.682	74%	0.743	S	S	*	*			cis	-140.4	169.1	7.1	40.2	-21.8	0	0	0	117.8
386	S	25.1	Very low	33	Very low	107 Å²	107	127.7 Å²	127.7	75%	0.748	75%	0.747	S	S	*	*			trans	65	-167.6	146.8	67.5	0	0	0	0	117.4
387	P	37.7	Very low	32.8	Very low	105 Å²	105	125.3 Å²	125.3	68%	0.682	74%	0.736	S	S	*	*				-131.9	-178.5	-98.4	39.7	-20.2	0	0	0	116.6
388	T	22.8	Very low	33	Very low	117 Å²	117	132.7 Å²	132.7	72%	0.718	74%	0.743	S	S	*	*			trans	92.5	110.8	149.6	-48.5	0	0	0	0	120.6
389	S	28.7	Very low	33	Very low	108 Å²	108	127.5 Å²	127.5	76%	0.755	73%	0.732	S	S	*	*			trans	74	174.1	144.7	77.8	0	0	0	0	120.5
390	P	46.6	Very low	33.2	Very low	121 Å²	121	125.9 Å²	125.9	79%	0.786	73%	0.732	S	S	*	*				-137.4	-164.7	-67	42.8	-25.4	0	0	0	114.7
391	S	33.6	Very low	33.4	Very low	117 Å²	117	124.6 Å²	124.6	82%	0.818	73%	0.732	S	S	*	*			trans	-89.9	171.2	-172	-35.7	0	0	0	0	116.6
392	P	48.8	Very low	33.5	Very low	112 Å²	112	124 Å²	124	73%	0.727	73%	0.733	S	S	*	*			trans	-118.5	140	173.1	38.2	-26.3	0	0	0	116.5
393	M	35.3	Very low	33.5	Very low	179 Å²	179	129 Å²	129	88%	0.882	74%	0.737	S	S	*	*			trans	50.2	153.2	145.1	-55.1	-70.9	-83.8	0	0	122.1
394	S	43.7	Very low	33.2	Very low	92 Å²	92	127.5 Å²	127.5	64%	0.643	73%	0.73	S	S	*	*			cis	172.6	128.8	-27.4	-171.1	0	0	0	0	105.5
395	P	41.7	Very low	33.2	Very low	112 Å²	112	133 Å²	133	73%	0.727	73%	0.734	S	S	*	*				-151.9	147.6	84.5	38.9	-20.5	0	0	0	116.4
396	L	30.8	Very low	32.7	Very low	163 Å²	163	139.6 Å²	139.6	85%	0.853	75%	0.746	S	S	*	*			trans	59.7	137.6	164.3	-58.3	166.5	0	0	0	117.3
397	S	29.6	Very low	33	Very low	84 Å²	84	142.3 Å²	142.3	59%	0.587	75%	0.751	S	S	*	*			cis	-167.1	136	-17.8	56.6	0	0	0	0	109.6
398	R	31	Very low	33.1	Very low	222 Å²	222	141.9 Å²	141.9	84%	0.838	75%	0.748	S	S	*	*				61.6	162.5	124.8	-67.9	-179.5	156.9	174.3	-6.7	119.2
399	L	29.2	Very low	33.3	Very low	118 Å²	118	141.7 Å²	141.7	62%	0.618	75%	0.75	S	S	*	*			cis	-131.3	137.1	-25.7	-96.2	139	0	0	0	104.4
400	H	31.5	Very low	33.3	Very low	160 Å²	160	143.4 Å²	143.4	74%	0.741	75%	0.75	S	S	*	*				77.1	159.5	71	-120.3	-102.8	0	0	0	113.8
401	D	32.3	Very low	32.5	Very low	116 Å²	116	146.3 Å²	146.3	62%	0.62	75%	0.753	S	S	*	*			trans	70.3	120.1	161.6	-50.6	-29.4	0	0	0	119.4
402	D	27.2	Very low	32.3	Very low	135 Å²	135	145.2 Å²	145.2	72%	0.722	75%	0.746	S	S	*	*				12.1	125.8	126.4	-54	-27.8	0	0	0	117.4
403	Y	28.3	Very low	31.5	Very low	214 Å²	214	144.8 Å²	144.8	84%	0.839	75%	0.745	S	S	*	*				-162.1	154.5	87.1	-122.1	-93.2	0	0	0	115.3
404	S	26.8	Very low	31.2	Very low	87 Å²	87	144.5 Å²	144.5	61%	0.608	74%	0.742	S	S	*	*			trans	-68.6	150.1	176.2	-69.4	0	0	0	0	114.3
405	R	27.6	Very low	30.6	Very low	218 Å²	218	150.5 Å²	150.5	82%	0.823	75%	0.75	S	S	*	*			trans	71.4	111.7	158.9	-64.2	172.7	-78.9	-156.7	-5.3	117.5
406	R	28.8	Very low	30	Very low	244 Å²	244	151.7 Å²	151.7	92%	0.921	75%	0.746	S	S	*	*				-166.4	114.3	96.4	-96.8	163.1	-146.3	-107.1	6.3	114.2
407	L	31.3	Very low	29.9	Very low	165 Å²	165	154.7 Å²	154.7	86%	0.864	75%	0.746	S	S	*	*			trans	-70.3	173.6	137.2	-74.4	166.6	0	0	0	108.8
408	P	39.9	Very low	29.9	Very low	96 Å²	96	161.4 Å²	161.4	62%	0.623	76%	0.759	S	S	*	*			cis	-132.2	175.1	1	41.4	-26.8	0	0	0	114.6
409	C	25.9	Very low	30.1	Very low	112 Å²	112	156.7 Å²	156.7	76%	0.757	76%	0.757	S	S	*	*				-170.7	140.7	119.9	-95	0	0	0	0	107.6
410	L	28.7	Very low	29.9	Very low	145 Å²	145	157.1 Å²	157.1	76%	0.759	76%	0.764	S	S	*	*			cis	64	134.3	45.1	-57.9	171.4	0	0	0	110.8
411	Q	29.9	Very low	30.4	Very low	181 Å²	181	153.8 Å²	153.8	85%	0.846	76%	0.764	S	S	*	*			cis	-130.5	168.2	11.4	-78	-177.5	-43.4	0	0	109.2
412	S	30.1	Very low	30.2	Very low	95 Å²	95	155.2 Å²	155.2	66%	0.664	78%	0.777	S	S	*	*			cis	174.4	160.2	-20.5	60.6	0	0	0	0	105.7
413	S	33	Very low	30.3	Very low	102 Å²	102	154.3 Å²	154.3	71%	0.713	78%	0.776	S	S	*	*			cis	180	164.7	-17.1	48	0	0	0	0	106.6
414	E	29.1	Very low	30.2	Very low	174 Å²	174	148.7 Å²	148.7	81%	0.813	77%	0.774	S	S	*	*			trans	143.3	167.7	141.3	-78.7	-94.2	60	0	0	114.1
415	R	29.4	Very low	30.4	Very low	218 Å²	218	152.9 Å²	152.9	82%	0.823	78%	0.784	S	S	*	*			trans	-114	163.3	-174.2	-58.2	165.6	171	-169.8	-2.3	110.5
416	Q	29.9	Very low	30.6	Very low	137 Å²	137	149.5 Å²	149.5	64%	0.64	79%	0.788	S	S	*	*				141.6	133.2	120.7	-73.9	-159.1	57.6	0	0	115.5
417	R	29.6	Very low	30.8	Very low	226 Å²	226	142.4 Å²	142.4	85%	0.853	78%	0.775	S	S	*	*			trans	59.2	161.1	137.8	-64.8	-179.7	179.1	166.1	0.5	121.2
418	R	29.1	Very low	31.1	Very low	225 Å²	225	139.6 Å²	139.6	85%	0.849	77%	0.769	S	S	*	*			trans	-57.4	162.2	165.7	-64.2	176.7	169.2	170.9	-5	110.8
419	P	33.8	Very low	30.8	Very low	123 Å²	123	141.6 Å²	141.6	80%	0.799	78%	0.78	S	S	*	*				-132.8	157.4	95.1	39.5	-32.4	0	0	0	115.1
420	V	26.7	Very low	31	Very low	126 Å²	126	146.8 Å²	146.8	76%	0.764	78%	0.783	S	S	*	*			trans	-89.1	167.7	152.9	164.8	0	0	0	0	107
421	A	41.3	Very low	30.9	Very low	91 Å²	91	145.1 Å²	145.1	75%	0.752	78%	0.782	S	S	*	*			trans	-46.1	149.4	176.8	0	0	0	0	0	115.1
422	V	27.1	Very low	31.2	Very low	145 Å²	145	142.4 Å²	142.4	88%	0.879	78%	0.778	S	S	*	*			trans	-157.4	152.6	142.2	130.6	0	0	0	0	110.3
423	T	30	Very low	32.7	Very low	117 Å²	117	142.9 Å²	142.9	72%	0.718	78%	0.779	S	S	*	*			trans	-63.5	146.3	-167.2	50.1	0	0	0	0	118
424	A	27.1	Very low	33	Very low	96 Å²	96	144.4 Å²	144.4	79%	0.793	78%	0.779	S	S	*	*				-126.8	112.1	114.7	0	0	0	0	0	106.6
425	Q	30.7	Very low	33.4	Very low	175 Å²	175	142.8 Å²	142.8	82%	0.818	77%	0.774	S	S	*	*				50.8	97.4	87.7	-72.8	-166.3	-14.9	0	0	114
426	V	30.6	Very low	33.5	Very low	147 Å²	147	139.7 Å²	139.7	89%	0.891	77%	0.769	S	S	*	*				-154.5	159.1	107.1	142.1	0	0	0	0	108.5
427	S	34.1	Very low	33.8	Very low	95 Å²	95	137.1 Å²	137.1	66%	0.664	77%	0.771	S	S	*	*			trans	-84.1	137.2	-171.9	53.5	0	0	0	0	114.7
428	S	37.2	Very low	33.4	Very low	106 Å²	106	135.3 Å²	135.3	74%	0.741	77%	0.772	S	S	*	*			trans	68	171.7	135.7	69.4	0	0	0	0	121.4
429	V	33.3	Very low	35.3	Very low	138 Å²	138	129.3 Å²	129.3	84%	0.836	76%	0.762	S	S	*	*			trans	92.7	149.6	168.4	-171.1	0	0	0	0	116.9
430	R	29.6	Very low	35.4	Very low	221 Å²	221	131.9 Å²	131.9	83%	0.834	76%	0.763	S	S	*	*			trans	-97.5	170.5	-165.4	-46.6	163.5	167.2	148.7	-9.2	112
431	C	27.8	Very low	35.5	Very low	109 Å²	109	132.4 Å²	132.4	74%	0.736	76%	0.762	S	S	*	*			trans	69.1	132.7	143.8	-67.4	0	0	0	0	121.1
432	T	35.2	Very low	34.9	Very low	124 Å²	124	133.3 Å²	133.3	76%	0.761	76%	0.763	S	S	*	*				-10.9	168.8	120.9	35.7	0	0	0	0	119.3
433	P	62.2	Low	35	Very low	105 Å²	105	130.9 Å²	130.9	68%	0.682	76%	0.758	S	S	*	*			cis	-142.5	-163.2	-9.7	27.6	-1.3	0	0	0	115.2
434	L	39.8	Very low	35	Very low	135 Å²	135	132.6 Å²	132.6	71%	0.707	76%	0.763	S	S	*	*				104.5	159.5	126	-143.7	71.3	0	0	0	121.7
435	I	37.3	Very low	35.3	Very low	140 Å²	140	135.9 Å²	135.9	72%	0.718	77%	0.766	S	S	*	*			trans	85.4	142.9	159.7	-56.5	-173.5	0	0	0	117.3
436	H	32	Very low	35.7	Very low	153 Å²	153	136 Å²	136	71%	0.708	77%	0.766	S	S	*	*			cis	177.3	172.8	-33.7	-86.7	-31.7	0	0	0	108.3
437	A	34.6	Very low	36.1	Very low	82 Å²	82	134.2 Å²	134.2	68%	0.678	76%	0.761	S	S	*	*			cis	-176.1	-178.6	-32.7	0	0	0	0	0	110.1
438	Q	22.9	Very low	36.5	Very low	189 Å²	189	138.9 Å²	138.9	88%	0.883	77%	0.772	S	S	*	*			trans	77.7	159.5	166.3	-75.3	-92.7	-76.6	0	0	120.4
439	P	68.7	Low	36.4	Very low	99 Å²	99	144.6 Å²	144.6	64%	0.643	78%	0.777	S	S	*	*			trans	-122.4	-169.7	-164.5	45.4	-32.1	0	0	0	115.1
440	E	34.8	Very low	36.3	Very low	176 Å²	176	140.6 Å²	140.6	82%	0.822	76%	0.764	S	S	*	*			trans	177.8	149.7	134.1	-77.5	-132.4	137.4	0	0	113.9
441	D	30.1	Very low	36.4	Very low	137 Å²	137	136.6 Å²	136.6	73%	0.733	76%	0.764	S	S	*	*			trans	37.6	126.5	148.2	-76.9	22.9	0	0	0	129.7
442	S	28.1	Very low	36.5	Very low	111 Å²	111	135.6 Å²	135.6	78%	0.776	76%	0.763	S	S	*	*				93.8	126.6	123.8	74.7	0	0	0	0	126.2
443	A	29.4	Very low	36.2	Very low	94 Å²	94	137.1 Å²	137.1	78%	0.777	77%	0.767	S	S	*	*			trans	73.4	117.2	139.8	0	0	0	0	0	126.2
444	D	30	Very low	36	Very low	153 Å²	153	136.4 Å²	136.4	82%	0.818	76%	0.762	S	S	*	*			trans	49.9	106.9	137.5	-66.1	-7.1	0	0	0	125.1
445	L	32.3	Very low	35.6	Very low	165 Å²	165	137.9 Å²	137.9	86%	0.864	77%	0.77	S	S	*	*				178.9	154.5	102.2	-99.7	159.2	0	0	0	114.6
446	Q	39.9	Very low	35.4	Very low	176 Å²	176	135.6 Å²	135.6	82%	0.822	77%	0.766	S	S	*	*			trans	-30.4	142.5	-170	-68.3	174.7	-26.4	0	0	122.9
447	S	38.1	Very low	35.5	Very low	111 Å²	111	133.9 Å²	133.9	78%	0.776	77%	0.772	S	S	*	*			trans	116.3	110.9	142.4	74	0	0	0	0	120.3
448	H	43	Very low	35.4	Very low	193 Å²	193	133.4 Å²	133.4	89%	0.894	78%	0.775	S	S	*	*			trans	26.3	129.5	162.2	-58.4	-75	0	0	0	121
449	R	36.2	Very low	36.7	Very low	225 Å²	225	130.7 Å²	130.7	85%	0.849	77%	0.774	S	S	*	*			cis	-174.2	160.1	6.4	153.5	177.8	175.6	162.9	5.2	106.9
450	G	30.8	Very low	34.7	Very low	54 Å²	54	136.2 Å²	136.2	56%	0.557	78%	0.781	S	S	*	*			cis	109.5	147.1	7.8	0	0	0	0	0	113.5
451	V	31	Very low	34.4	Very low	138 Å²	138	133.7 Å²	133.7	84%	0.836	77%	0.774	S	S	*	*			cis	-175.5	162.7	-13.2	87.6	0	0	0	0	104.6
452	A	30.7	Very low	34.3	Very low	88 Å²	88	132.6 Å²	132.6	73%	0.727	78%	0.777	S	S	*	*			cis	-151.7	-177	3.6	0	0	0	0	0	110.4
453	D	27.7	Very low	35	Very low	155 Å²	155	132.6 Å²	132.6	83%	0.829	77%	0.774	S	S	*	*			trans	-163.7	-176.5	177.3	-148.7	19.8	0	0	0	107.5
454	P	59.3	Low	34.9	Very low	91 Å²	91	135.6 Å²	135.6	59%	0.591	77%	0.772	S	S	*	*			cis	-143	-179.9	-7	44	-25	0	0	0	118.4
455	L	31.7	Very low	34.7	Very low	166 Å²	166	135 Å²	135	87%	0.869	76%	0.764	S	S	*	*			trans	79.7	-152.8	141.4	-83.8	159.4	0	0	0	123
456	S	32.7	Very low	34.3	Very low	91 Å²	91	133.4 Å²	133.4	64%	0.636	76%	0.755	S	S	*	*			trans	-159.8	148	-132.1	178.6	0	0	0	0	117.7
457	S	33.7	Very low	33.5	Very low	118 Å²	118	130.3 Å²	130.3	83%	0.825	75%	0.753	S	S	*	*			trans	64.6	144.5	147.5	68.3	0	0	0	0	123.7
458	G	31.7	Very low	32.9	Very low	72 Å²	72	128.6 Å²	128.6	74%	0.742	75%	0.745	S	S	*	*			trans	120.9	163.2	171.4	0	0	0	0	0	113.1
459	P	51.7	Low	32.1	Very low	132 Å²	132	126.3 Å²	126.3	86%	0.857	74%	0.74	S	S	*	*			cis	-142.6	-167.3	24.9	43.8	-24.7	0	0	0	116.1
460	R	26.8	Very low	31.7	Very low	214 Å²	214	122.7 Å²	122.7	81%	0.808	74%	0.736	S	S	*	*			trans	-153.1	162.3	157.5	-147.3	-166.2	-172.8	-115.5	8.3	111.7
461	D	26.9	Very low	31.5	Very low	124 Å²	124	124.5 Å²	124.5	66%	0.663	75%	0.745	S	S	*	*			trans	76.8	139.2	163.8	-57.6	-26.8	0	0	0	119.3
462	S	27.7	Very low	31.3	Very low	114 Å²	114	122 Å²	122	80%	0.797	74%	0.74	S	S	*	*			trans	-85.7	173.9	179.9	-31.3	0	0	0	0	111.4
463	P	43.4	Very low	31.2	Very low	111 Å²	111	126 Å²	126	72%	0.721	74%	0.743	S	S	*	*				-157.2	165.9	69.3	44.1	-23.2	0	0	0	119.2
464	E	27.6	Very low	31.3	Very low	157 Å²	157	126.4 Å²	126.4	73%	0.734	74%	0.74	S	S	*	*			trans	63	125.2	134.4	-76.3	-166.1	121.1	0	0	126.7
465	Q	25.8	Very low	29.7	Very low	140 Å²	140	129.2 Å²	129.2	65%	0.654	75%	0.745	S	S	*	*				103.8	108.5	122.2	-79.1	-178.1	26.3	0	0	123.6
466	I	24.3	Very low	29.4	Very low	132 Å²	132	128 Å²	128	68%	0.677	74%	0.739	S	S	*	*				94.2	132.9	118.8	-73.2	171.2	0	0	0	122.5
467	S	23.6	Very low	29	Very low	110 Å²	110	130.9 Å²	130.9	77%	0.769	75%	0.746	S	S	*	*			trans	73.7	148.7	155.3	65.5	0	0	0	0	120.7
468	A	25.7	Very low	29.7	Very low	75 Å²	75	130.1 Å²	130.1	62%	0.62	74%	0.738	S	S	*	*			cis	-170.7	179.8	-23	0	0	0	0	0	110.5
469	D	25.9	Very low	29.6	Very low	146 Å²	146	131.1 Å²	131.1	78%	0.781	74%	0.74	S	S	*	*			trans	71.5	148.5	149.6	-66.7	-10.7	0	0	0	120.5
470	I	27.8	Very low	28.5	Very low	149 Å²	149	129.7 Å²	129.7	76%	0.764	73%	0.733	S	S	*	*			cis	-155.4	171.7	-23.5	-121.4	166	0	0	0	109.7
471	A	26	Very low	28.5	Very low	91 Å²	91	125.4 Å²	125.4	75%	0.752	73%	0.73	S	S	*	*			trans	-59.5	172.7	-179	0	0	0	0	0	115.4
472	A	27.1	Very low	28.5	Very low	87 Å²	87	125.8 Å²	125.8	72%	0.719	74%	0.737	S	S	*	*			cis	-173.4	-178	35.9	0	0	0	0	0	115.5
473	Q	27.5	Very low	28.6	Very low	172 Å²	172	125 Å²	125	80%	0.804	73%	0.732	S	S	*	*			trans	102.3	136.1	155.3	-54.9	-168.4	-3.8	0	0	119.9
474	H	30	Very low	28	Very low	162 Å²	162	127.5 Å²	127.5	75%	0.75	74%	0.739	S	S	*	*			trans	55.4	137.6	179.2	-62.4	-81.6	0	0	0	117.7
475	E	26.1	Very low	28.2	Very low	150 Å²	150	124.4 Å²	124.4	70%	0.701	74%	0.741	S	S	*	*			cis	-172.8	166.6	-31.2	-114	178.2	132.1	0	0	106.6
476	L	26.2	Very low	28.4	Very low	141 Å²	141	126.3 Å²	126.3	74%	0.738	75%	0.747	S	S	*	*			cis	-144.5	-158.4	3.8	-137.1	-178.3	0	0	0	109.3
477	L	23.1	Very low	28.7	Very low	151 Å²	151	126.5 Å²	126.5	79%	0.791	75%	0.745	S	S	*	*			trans	-160.5	-172.5	-170.9	-97.9	177.1	0	0	0	109.4
478	P	48.9	Very low	28.8	Very low	102 Å²	102	128.3 Å²	128.3	66%	0.662	74%	0.743	S	S	*	*			cis	-135.9	-176.7	-25.6	34.1	-14.2	0	0	0	114.4
479	A	29.2	Very low	28.9	Very low	93 Å²	93	129.8 Å²	129.8	77%	0.769	74%	0.744	S	S	*	*			trans	56.1	167.7	135.9	0	0	0	0	0	121.8
480	S	28.6	Very low	28.8	Very low	103 Å²	103	131 Å²	131	72%	0.72	75%	0.745	S	S	*	*			cis	-166.8	153.2	-18.2	44.6	0	0	0	0	112.2
481	T	26.9	Very low	28.6	Very low	123 Å²	123	129.5 Å²	129.5	76%	0.755	75%	0.747	S	S	*	*			trans	24.5	129	141.5	-37.9	0	0	0	0	122.1
482	T	28.1	Very low	28.6	Very low	132 Å²	132	132 Å²	132	81%	0.81	75%	0.752	S	S	*	*				175.4	139.9	119.5	29.2	0	0	0	0	118.4
483	S	28.9	Very low	28.4	Very low	99 Å²	99	132.9 Å²	132.9	69%	0.692	75%	0.753	S	S	*	*			trans	31.5	130.6	146.5	65.5	0	0	0	0	126.7
484	N	31.3	Very low	29.7	Very low	162 Å²	162	129.7 Å²	129.7	87%	0.866	75%	0.747	S	S	*	*			trans	30.8	126.5	130.8	-58.3	-6.8	0	0	0	122
485	A	30.6	Very low	30.4	Very low	92 Å²	92	127.3 Å²	127.3	76%	0.76	75%	0.746	S	S	*	*				172.7	146.5	97.1	0	0	0	0	0	116
486	K	30.9	Very low	30.5	Very low	180 Å²	180	127.3 Å²	127.3	78%	0.783	75%	0.75	S	S	*	*			trans	57.1	132.9	146.6	-84.8	-175.8	160.7	-154.3	0	124.2
487	Q	30	Very low	30.6	Very low	136 Å²	136	124.9 Å²	124.9	64%	0.636	75%	0.745	S	S	*	*			trans	77.4	119.1	136.2	-75.5	-179.1	-104.3	0	0	122.5
488	M	25.5	Very low	30.9	Very low	148 Å²	148	124.3 Å²	124.3	73%	0.729	74%	0.738	S	S	*	*				82.1	125.2	127	-74.6	178.1	68.6	0	0	122.5
489	V	28	Very low	29.9	Very low	107 Å²	107	127.4 Å²	127.4	65%	0.648	74%	0.737	S	S	*	*				98.8	138.1	127.7	160.3	0	0	0	0	120.2
490	E	24.8	Very low	29.7	Very low	172 Å²	172	129.7 Å²	129.7	80%	0.804	73%	0.731	S	S	*	*			trans	55.6	110.6	161.8	-78.7	160.6	157.7	0	0	123.5
491	C	23.3	Very low	29.6	Very low	117 Å²	117	129.1 Å²	129.1	79%	0.791	73%	0.733	S	S	*	*			trans	-12.8	140.5	130.1	-45.3	0	0	0	0	118.3
492	V	26	Very low	29.6	Very low	143 Å²	143	128.1 Å²	128.1	87%	0.867	73%	0.731	S	S	*	*			trans	-150.6	142.8	133.5	166.5	0	0	0	0	109.6
493	S	23.6	Very low	29.6	Very low	106 Å²	106	129 Å²	129	74%	0.741	73%	0.726	S	S	*	*			trans	-137	176.5	165	-40.8	0	0	0	0	108
494	P	54.9	Low	29.5	Very low	105 Å²	105	132.2 Å²	132.2	68%	0.682	73%	0.73	S	S	*	*			cis	-111	-125.2	-20	28.1	-4.2	0	0	0	109
495	P	43.8	Very low	29.1	Very low	112 Å²	112	132.8 Å²	132.8	73%	0.727	73%	0.727	S	S	*	*			cis	-105.3	170.5	27.9	6	19.8	0	0	0	113.3
496	L	27.4	Very low	29.9	Very low	149 Å²	149	132.7 Å²	132.7	78%	0.78	72%	0.719	S	S	*	*				65.4	145.6	53	-54.8	166.3	0	0	0	113
497	S	29.3	Very low	29.6	Very low	91 Å²	91	131.1 Å²	131.1	64%	0.636	72%	0.72	S	S	*	*			cis	-155.5	146.9	22.5	62.5	0	0	0	0	114.4
498	E	28.7	Very low	29.4	Very low	139 Å²	139	133.8 Å²	133.8	65%	0.65	73%	0.729	S	S	*	*				61	163.8	122.6	-61.3	-177.7	178	0	0	121.7
499	R	28.1	Very low	29.5	Very low	167 Å²	167	131 Å²	131	63%	0.63	73%	0.73	S	S	*	*			cis	-153.6	167	10.1	-143.1	165.3	169.4	101.6	18.7	115.7
500	E	25.8	Very low	29.4	Very low	140 Å²	140	130.5 Å²	130.5	65%	0.654	73%	0.731	S	S	*	*			trans	-14.4	154.5	162.7	-65	146.7	-172	0	0	120.5
501	A	27	Very low	29.6	Very low	91 Å²	91	130.3 Å²	130.3	75%	0.752	73%	0.734	S	S	*	*			cis	97.9	161.3	20.9	0	0	0	0	0	116.9
502	S	26.1	Very low	30.5	Very low	102 Å²	102	129.6 Å²	129.6	71%	0.713	73%	0.728	S	S	*	*			trans	86.3	142.5	-169.7	-58.5	0	0	0	0	115.5
503	Q	27.4	Very low	30.6	Very low	152 Å²	152	130.3 Å²	130.3	71%	0.71	73%	0.727	S	S	*	*			cis	-159.8	-168.8	-6.5	-114.5	168.3	74.7	0	0	107.6
504	Q	27.5	Very low	30.7	Very low	165 Å²	165	134 Å²	134	77%	0.771	73%	0.732	S	S	*	*			cis	-152.5	-144.7	14.8	-148.7	156.7	57	0	0	112.1
505	Q	22.3	Very low	29.3	Very low	174 Å²	174	134.8 Å²	134.8	81%	0.813	74%	0.735	S	S	*	*			trans	-163.9	-177.9	-174	-122.3	-174.7	-17.9	0	0	108.6
506	P	47.1	Very low	28.5	Very low	91 Å²	91	138.3 Å²	138.3	59%	0.591	74%	0.739	S	S	*	*			cis	-134.3	-178.9	-13.6	38.9	-20.3	0	0	0	114.6
507	D	24.9	Very low	28.4	Very low	147 Å²	147	136.2 Å²	136.2	79%	0.786	74%	0.736	S	S	*	*				177.8	-175.7	117.1	-97.9	-24.2	0	0	0	113.7
508	F	27.1	Very low	28.2	Very low	191 Å²	191	140.5 Å²	140.5	84%	0.838	75%	0.746	S	S	*	*			trans	-99.3	165.1	-144.7	-94.6	-101.7	0	0	0	119.9
509	A	27.1	Very low	28.1	Very low	89 Å²	89	143.1 Å²	143.1	74%	0.736	76%	0.756	S	S	*	*			trans	76.3	88.1	167.3	0	0	0	0	0	117.4
510	S	26.4	Very low	27.9	Very low	98 Å²	98	142 Å²	142	69%	0.685	76%	0.757	S	S	*	*			cis	72.1	131.7	17.4	84.1	0	0	0	0	117.7
511	I	28.2	Very low	27.8	Very low	168 Å²	168	143.8 Å²	143.8	86%	0.862	77%	0.766	S	S	*	*			trans	115.9	140.4	176.6	-69.1	164.1	0	0	0	112.8
512	P	42.8	Very low	27.7	Very low	102 Å²	102	146.5 Å²	146.5	66%	0.662	76%	0.763	S	S	*	*			cis	-122	177	-11.3	41.1	-27.4	0	0	0	116.5
513	N	26.8	Very low	27.7	Very low	158 Å²	158	150.6 Å²	150.6	85%	0.845	77%	0.771	S	S	*	*			trans	86	94.1	151.8	-69.7	-13.5	0	0	0	121.9
514	E	26	Very low	27.5	Very low	182 Å²	182	147.8 Å²	147.8	85%	0.85	77%	0.768	S	S	*	*			trans	-115.8	112.4	152.3	-172	174.6	-149.4	0	0	106.1
515	V	26.6	Very low	27.3	Very low	122 Å²	122	147 Å²	147	74%	0.739	77%	0.767	S	S	*	*				66	124.5	89.7	176.5	0	0	0	0	115.4
516	K	25.1	Very low	27.5	Very low	187 Å²	187	145.8 Å²	145.8	81%	0.813	77%	0.766	S	S	*	*			trans	84	111.1	165.4	-81.3	173.1	-178.8	173.6	0	121.4
517	S	26.3	Very low	26.4	Very low	104 Å²	104	149.3 Å²	149.3	73%	0.727	78%	0.775	S	S	*	*			trans	68.7	135	130.1	64.9	0	0	0	0	122
518	H	24.1	Very low	26.4	Very low	181 Å²	181	148.4 Å²	148.4	84%	0.838	78%	0.775	S	S	*	*			trans	-140.3	160.6	132.9	-129.9	-90.2	0	0	0	111.6
519	F	26.9	Very low	26.3	Very low	194 Å²	194	146.1 Å²	146.1	85%	0.851	77%	0.766	S	S	*	*			trans	-117.5	-170.8	-177.3	-124	-90.5	0	0	0	110.1
520	Q	24.6	Very low	26.1	Very low	143 Å²	143	149.1 Å²	149.1	67%	0.668	76%	0.763	S	S	*	*			trans	83.4	148.2	168.5	-131.5	152.8	-18	0	0	113.5	Q522	Q520-Q522 HydrophobicContact CG-CB 4.21Å
521	E	24.1	Very low	26.2	Very low	179 Å²	179	150.8 Å²	150.8	84%	0.836	77%	0.768	S	S	*	*			cis	-112.1	158.2	14.3	-72.1	166.2	129.5	0	0	112.5
522	Q	24.7	Very low	27.3	Very low	147 Å²	147	148 Å²	148	69%	0.687	76%	0.762	S	S	*	*			cis	96.6	118.6	22.3	-179.6	-176.8	-22.3	0	0	115.1	Q520	Q520-Q522 HydrophobicContact CG-CB 4.21Å
523	E	24.9	Very low	27.3	Very low	189 Å²	189	148.9 Å²	148.9	88%	0.883	77%	0.767	S	S	*	*			trans	-153.6	166.3	157.7	-131.2	-179.6	-160.9	0	0	114.3
524	S	23.4	Very low	27.3	Very low	92 Å²	92	146.3 Å²	146.3	64%	0.643	77%	0.768	S	S	*	*			trans	-62.1	148.5	-168.5	23.4	0	0	0	0	117
525	I	24.3	Very low	27.2	Very low	148 Å²	148	140.7 Å²	140.7	76%	0.759	76%	0.758	S	S	*	*			cis	85.8	118.8	47.9	-63.7	162.4	0	0	0	114.8
526	L	26.1	Very low	27.1	Very low	150 Å²	150	141.2 Å²	141.2	79%	0.785	77%	0.768	S	S	*	*			trans	165.6	107.6	144.5	-90.7	166.7	0	0	0	108.6
527	Q	23.9	Very low	27.2	Very low	165 Å²	165	137.4 Å²	137.4	77%	0.771	77%	0.765	S	S	*	*				53.4	125.8	89.9	-61.1	-172	0.5	0	0	114.9
528	T	24.6	Very low	28	Very low	128 Å²	128	138.1 Å²	138.1	79%	0.785	77%	0.767	S	S	*	*				-165.1	139.5	79.3	-64.4	0	0	0	0	115.2
529	E	24.3	Very low	29.4	Very low	142 Å²	142	134.7 Å²	134.7	66%	0.664	76%	0.76	S	S	*	*			trans	6.8	142.9	159	-57.9	-150.4	111.7	0	0	128
530	K	24.7	Very low	30	Very low	153 Å²	153	131.4 Å²	131.4	67%	0.665	76%	0.759	S	S	*	*				77.7	114	126.6	-80.2	173.3	-176.1	144.7	0	125.6
531	V	28.5	Very low	30	Very low	132 Å²	132	131.5 Å²	131.5	80%	0.8	76%	0.764	S	S	*	*				71.6	137	114.3	169.4	0	0	0	0	121.5
532	P	51.5	Low	31	Very low	111 Å²	111	128.4 Å²	128.4	72%	0.721	76%	0.759	S	S	*	*			trans	-82.9	-172.4	178.3	40.1	-43.1	0	0	0	113.1
533	P	42.6	Very low	31	Very low	119 Å²	119	127.5 Å²	127.5	77%	0.773	76%	0.764	S	S	*	*			cis	-150.5	-152.1	25.9	46.4	-22.8	0	0	0	117.4
534	A	25.3	Very low	31	Very low	105 Å²	105	122.7 Å²	122.7	87%	0.868	76%	0.757	S	S	*	*			trans	72.4	159.5	176.3	0	0	0	0	0	116.1
535	G	23.8	Very low	31.2	Very low	63 Å²	63	124.1 Å²	124.1	65%	0.649	77%	0.765	S	S	*	*			cis	145.2	158.5	-8.7	0	0	0	0	0	113.5
536	S	25.5	Very low	31.4	Very low	134 Å²	134	124.8 Å²	124.8	94%	0.937	77%	0.769	S	S	*	*			trans	81.9	159.9	173	83.3	0	0	0	0	120
537	S	26.3	Very low	31.5	Very low	107 Å²	107	122.4 Å²	122.4	75%	0.748	77%	0.765	S	S	*	*			trans	-169.2	174.1	-175.3	64.1	0	0	0	0	107.6
538	P	44.2	Very low	31.7	Very low	119 Å²	119	119.2 Å²	119.2	77%	0.773	76%	0.761	S	S	*	*			cis	-123.8	-106.3	-16	21	5.7	0	0	0	114.3
539	P	53.7	Low	32	Very low	108 Å²	108	119.3 Å²	119.3	70%	0.701	76%	0.762	S	S	*	*			trans	-121	-172.4	-137.2	40.7	-20.3	0	0	0	115.5
540	P	39.5	Very low	33.1	Very low	126 Å²	126	118.1 Å²	118.1	82%	0.818	77%	0.766	S	S	*	*				-149.6	171.5	99.3	40.4	-23.6	0	0	0	117.9
541	D	23.5	Very low	33.3	Very low	145 Å²	145	117.1 Å²	117.1	78%	0.775	77%	0.773	S	S	*	*			trans	-64	174.5	168.2	-88	-62.8	0	0	0	114.8
542	P	44.7	Very low	33.4	Very low	113 Å²	113	115.4 Å²	115.4	73%	0.734	77%	0.766	S	S	*	*			cis	-148.5	166.5	28.9	42.8	-21.6	0	0	0	121.6
543	T	24.9	Very low	33	Very low	129 Å²	129	116.3 Å²	116.3	79%	0.791	77%	0.772	S	S	*	*			trans	17.2	124.1	141.7	-37.3	0	0	0	0	122.3
544	A	26.3	Very low	32.7	Very low	88 Å²	88	117.8 Å²	117.8	73%	0.727	77%	0.772	S	S	*	*				159.6	127	115.3	0	0	0	0	0	117.4
545	C	27.1	Very low	34.4	Very low	122 Å²	122	117.2 Å²	117.2	82%	0.824	76%	0.76	S	S	*	*			trans	40.8	146.6	141.2	-54.5	0	0	0	0	125.9
546	L	28.1	Very low	35.8	Very low	162 Å²	162	120 Å²	120	85%	0.848	77%	0.766	S	S	*	*			trans	104.2	104.9	152.1	-55.5	-176.8	0	0	0	122
547	S	27.6	Very low	36.2	Very low	100 Å²	100	118.6 Å²	118.6	70%	0.699	75%	0.752	S	S	*	*			trans	47.7	107.6	133.1	63.1	0	0	0	0	125.6
548	S	29.1	Very low	36.4	Very low	98 Å²	98	120.6 Å²	120.6	69%	0.685	76%	0.755	S	S	*	*				56.7	121.9	123.5	66.3	0	0	0	0	126.2
549	T	30.3	Very low	35.6	Very low	130 Å²	130	118.1 Å²	118.1	80%	0.798	75%	0.751	S	S	*	*			trans	62.6	170.8	142.1	47.5	0	0	0	0	119.7
550	P	47.8	Very low	34.5	Very low	116 Å²	116	117.6 Å²	117.6	75%	0.753	76%	0.755	S	S	*	*			cis	-100.1	-127	1.8	38.9	-28.4	0	0	0	116.4
551	V	29.9	Very low	34.1	Very low	132 Å²	132	116.6 Å²	116.6	80%	0.8	76%	0.758	S	S	*	*			cis	-152.1	176.6	33.5	-150.5	0	0	0	0	112.2
552	S	30.2	Very low	34.4	Very low	96 Å²	96	113.8 Å²	113.8	67%	0.671	76%	0.755	S	S	*	*			trans	-139.1	-177.8	-179.5	-42.7	0	0	0	0	113.8
553	P	42.6	Very low	33.8	Very low	130 Å²	130	113.3 Å²	113.3	84%	0.844	75%	0.754	S	S	*	*			trans	-127.2	168.4	138.2	36.9	-27.2	0	0	0	114.3
554	I	35.3	Very low	34	Very low	151 Å²	151	113.1 Å²	113.1	77%	0.774	75%	0.753	S	S	*	*			trans	-140.2	-149	-152.1	-29.3	179.2	0	0	0	115.3
555	P	61.8	Low	34.1	Very low	92 Å²	92	117 Å²	117	60%	0.597	76%	0.756	S	S	*	*				-121.5	-159.1	-124.6	43.5	-22	0	0	0	116.2	T557	P555-T557 WeakPolarHBondContact CG-OG1 3.49Å
556	P	54.4	Low	34.2	Very low	121 Å²	121	117.1 Å²	117.1	79%	0.786	75%	0.753	S	S	*	*				-132.3	161.6	75	34.4	-17.7	0	0	0	115.6
557	T	33	Very low	34.3	Very low	105 Å²	105	114.2 Å²	114.2	64%	0.644	75%	0.753	S	S	*	*			cis	91.3	124.3	14.2	-65.3	0	0	0	0	115.9	P555	P555-T557 WeakPolarHBondContact CG-OG1 3.49Å
558	D	30.2	Very low	34.2	Very low	150 Å²	150	114.6 Å²	114.6	80%	0.802	76%	0.755	S	S	*	*			cis	-167.4	174.5	-9.6	-120.3	-70.9	0	0	0	114.3
559	G	27.7	Very low	34.1	Very low	67 Å²	67	116.4 Å²	116.4	69%	0.691	76%	0.762	S	S	*	*			trans	117.4	150.6	157.7	0	0	0	0	0	118
560	A	30.1	Very low	34.2	Very low	96 Å²	96	119.3 Å²	119.3	79%	0.793	76%	0.763	S	S	*	*			cis	-167.6	148.6	-13.7	0	0	0	0	0	112.8
561	A	31.7	Very low	34.3	Very low	106 Å²	106	118.9 Å²	118.9	88%	0.876	76%	0.76	S	S	*	*			trans	62.9	154	161.2	0	0	0	0	0	120.5
562	A	30.6	Very low	34.5	Very low	86 Å²	86	123.2 Å²	123.2	71%	0.711	76%	0.763	S	S	*	*			cis	-169.1	172	-19.7	0	0	0	0	0	113.3
563	S	30.8	Very low	34.5	Very low	103 Å²	103	125.4 Å²	125.4	72%	0.72	76%	0.762	S	S	*	*			trans	70.9	114.7	145.9	58.8	0	0	0	0	125.8
564	T	28.8	Very low	34	Very low	124 Å²	124	129.4 Å²	129.4	76%	0.761	76%	0.76	S	S	*	*			trans	54.7	131.3	130.3	53.4	0	0	0	0	127.2
565	E	29.4	Very low	33.7	Very low	169 Å²	169	127.9 Å²	127.9	79%	0.79	76%	0.763	S	S	*	*			trans	67.2	122.1	130.6	-63.6	-168	146	0	0	126.5
566	T	28.7	Very low	32.1	Very low	125 Å²	125	126.9 Å²	126.9	77%	0.767	77%	0.769	S	S	*	*			trans	49.4	121.7	137	65.7	0	0	0	0	125.7
567	A	29.8	Very low	31.3	Very low	102 Å²	102	133.1 Å²	133.1	84%	0.843	78%	0.777	S	S	*	*				86.5	146.2	125.9	0	0	0	0	0	124.7
568	S	26.6	Very low	31.7	Very low	107 Å²	107	134 Å²	134	75%	0.748	79%	0.785	S	S	*	*			trans	97.9	107	143.2	-147.1	0	0	0	0	123.4
569	V	26.8	Very low	32.2	Very low	137 Å²	137	138.2 Å²	138.2	83%	0.83	79%	0.79	S	S	*	*			trans	66.5	153.8	130.6	-177	0	0	0	0	122.5
570	K	32.8	Very low	32.6	Very low	191 Å²	191	141 Å²	141	83%	0.83	80%	0.796	S	S	*	*			trans	-84.9	-170.9	-173.4	-50.2	171.4	-178.3	171.3	0	111.9
571	P	49.3	Very low	32.9	Very low	106 Å²	106	147.7 Å²	147.7	69%	0.688	80%	0.8	S	S	*	*			cis	-151	-171.5	8.2	46.5	-25.7	0	0	0	119.5
572	R	32.9	Very low	33.9	Very low	224 Å²	224	148.2 Å²	148.2	85%	0.845	80%	0.795	S	S	*	*			trans	69.7	160	154.7	-78.7	-174.9	164.9	155.4	-4.4	118.9
573	Q	31.9	Very low	33.9	Very low	142 Å²	142	152.4 Å²	152.4	66%	0.664	80%	0.803	S	S	*	*			cis	-173.6	158.1	-25.8	-169.1	-172	55.6	0	0	111.2
574	R	31.2	Very low	33.9	Very low	213 Å²	213	151.9 Å²	151.9	80%	0.804	80%	0.8	S	S	*	*			trans	111.5	134.8	148	-64	-173.3	168.8	-169.5	-5.2	121.2
575	S	28.7	Very low	34	Very low	119 Å²	119	152.4 Å²	152.4	83%	0.832	80%	0.798	S	S	*	*			trans	34.1	145.4	145.1	58.9	0	0	0	0	124.2
576	G	28.7	Very low	34.1	Very low	71 Å²	71	154.5 Å²	154.5	73%	0.732	80%	0.8	S	S	*	*			cis	148.3	129.7	-13.7	0	0	0	0	0	117.6
577	R	36.7	Very low	34	Very low	252 Å²	252	151.7 Å²	151.7	95%	0.951	79%	0.789	S	S	*	*			trans	68.7	166	170.7	-66	-170.9	178.6	-150.2	0.7	116.3
578	P	42.1	Very low	34.2	Very low	124 Å²	124	155.2 Å²	155.2	81%	0.805	79%	0.788	S	S	*	*			cis	-123.5	-166.2	2.4	42.6	-27.2	0	0	0	115.5
579	R	40.6	Very low	34.4	Very low	238 Å²	238	156.7 Å²	156.7	90%	0.898	79%	0.787	S	S	*	*			trans	-91.7	157.2	166	-69.7	-179.7	172.1	169	-3.4	110.4
580	P	36	Very low	34.5	Very low	126 Å²	126	156.1 Å²	156.1	82%	0.818	78%	0.784	S	S	*	*				-142.1	-177.3	96.8	38.4	-23.7	0	0	0	115.7
581	R	37.5	Very low	34.4	Very low	237 Å²	237	152 Å²	152	89%	0.894	78%	0.779	S	S	*	*			trans	-138.3	179	160.3	-62.9	-172.4	-178.7	-177.8	-0.5	106.4
582	P	52	Low	33.4	Very low	116 Å²	116	156 Å²	156	75%	0.753	78%	0.781	S	S	*	*			cis	-125.9	-168.9	-12.8	41.6	-26.2	0	0	0	112.3
583	I	30.2	Very low	33.2	Very low	174 Å²	174	153.6 Å²	153.6	89%	0.892	78%	0.776	S	S	*	*			trans	-159.7	158.9	151.4	-102.2	151.9	0	0	0	107.9
584	S	30.3	Very low	33.1	Very low	92 Å²	92	155 Å²	155	64%	0.643	78%	0.782	S	S	*	*			trans	-125.7	162.6	175	53.3	0	0	0	0	111
585	D	32.8	Very low	32.7	Very low	135 Å²	135	150.5 Å²	150.5	72%	0.722	78%	0.782	S	S	*	*				166.7	155.1	122.8	-86.1	7.8	0	0	0	115.7
586	Y	29.6	Very low	33.1	Very low	213 Å²	213	151.9 Å²	151.9	84%	0.835	78%	0.779	S	S	*	*			trans	56.8	93.4	152.2	-89.3	-102.7	0	0	0	124.2
587	A	28.4	Very low	33.3	Very low	66 Å²	66	153.8 Å²	153.8	55%	0.545	78%	0.778	S	S	.	*				59.1	149.1	105.2	0	0	0	0	0	125.4
588	Q	33.3	Very low	32.8	Very low	176 Å²	176	150.4 Å²	150.4	82%	0.822	77%	0.773	S	S	*	*			trans	72	152.5	159.6	-61.3	-165.1	-7.4	0	0	118.4
589	L	30.6	Very low	32.3	Very low	139 Å²	139	153.4 Å²	153.4	73%	0.728	78%	0.776	S	S	*	*			cis	-163.9	170.1	-15.6	-113.5	176.1	0	0	0	112.3
590	V	28.5	Very low	31.9	Very low	125 Å²	125	149 Å²	149	76%	0.758	78%	0.776	S	S	*	*			trans	74.3	133.2	152.6	169.7	0	0	0	0	122.9
591	S	31.5	Very low	31.5	Very low	105 Å²	105	146.8 Å²	146.8	73%	0.734	77%	0.768	S	S	*	*			trans	-47.7	161.7	172.3	-36	0	0	0	0	121.3
592	R	28.7	Very low	31	Very low	190 Å²	190	144.9 Å²	144.9	72%	0.717	77%	0.769	S	S	*	*				-159.5	178.5	118.9	-106.9	175.4	-169.5	-123.9	-2.3	111.6	D628	R592-D628 IonicContact CZ-OD1 2.8Å; R592-D628 VanDerWaalsContact CZ-OD1 3.28Å; R592-D628 IonicContact NH1-OD1 2.86Å; R592-D628 PolarHBondContact NH1-OD1 2.92Å; R592-D628 VanDerWaalsContact NH2-CG 3.33Å; R592-D628 IonicContact NH2-OD1 3.08Å; R592-D628 PolarHBondContact NH2-OD1 3.42Å; R592-D628 IonicContact NH2-OD2 3.46Å; R592-D628 PolarHBondContact NH2-OD2 2.93Å; R592-D628 VanDerWaalsContact NH2-OD2 3.08Å
593	K	27.9	Very low	29.8	Very low	173 Å²	173	145.4 Å²	145.4	75%	0.752	77%	0.77	S	S	*	*			trans	-118.7	156.5	-169.3	-58.9	179.9	179.3	179.1	0	113.3
594	H	30.1	Very low	29.7	Very low	171 Å²	171	144.5 Å²	144.5	79%	0.792	77%	0.767	S	S	*	*			trans	68.1	158	164.5	-43.8	136.4	0	0	0	115.3
595	C	23.5	Very low	29.5	Very low	118 Å²	118	151.2 Å²	151.2	80%	0.797	78%	0.78	S	S	*	*			cis	-141.1	-176.8	6.3	-145.2	0	0	0	0	113.3
596	I	36.3	Very low	29.4	Very low	149 Å²	149	151.3 Å²	151.3	76%	0.764	78%	0.776	S	S	*	*			trans	-72.5	152.8	178	-64.8	157.2	0	0	0	111.5
597	P	33	Very low	29.4	Very low	111 Å²	111	148.2 Å²	148.2	72%	0.721	77%	0.769	S	S	*	*			trans	-121.9	139.6	134.7	35.9	-30.4	0	0	0	113.6
598	E	26.3	Very low	29.5	Very low	180 Å²	180	152.3 Å²	152.3	84%	0.841	77%	0.771	S	S	*	*			trans	28.6	128.2	157.1	-76.2	160.2	127.2	0	0	122.8
599	E	32	Very low	29.1	Very low	187 Å²	187	149.5 Å²	149.5	87%	0.874	77%	0.765	S	S	*	*			trans	-72.3	156	149.9	-59.4	179.7	135.7	0	0	110.5
600	V	30.7	Very low	29.3	Very low	147 Å²	147	147.5 Å²	147.5	89%	0.891	76%	0.763	S	S	*	*			trans	-121.7	126.8	154.5	179.3	0	0	0	0	107
601	A	27.9	Very low	29.2	Very low	78 Å²	78	149.3 Å²	149.3	65%	0.645	77%	0.769	S	S	*	*			trans	-93.2	158.8	-173.4	0	0	0	0	0	112.7
602	E	28.1	Very low	29	Very low	198 Å²	198	148.3 Å²	148.3	93%	0.925	77%	0.767	S	S	*	*			trans	-101	131	156.3	-67.5	-174.7	145.2	0	0	108.5
603	T	26.2	Very low	29.1	Very low	126 Å²	126	148.7 Å²	148.7	77%	0.773	78%	0.777	S	S	*	*			trans	-104.6	137.7	-171.5	49.3	0	0	0	0	112.7
604	N	28.5	Very low	29	Very low	155 Å²	155	148.6 Å²	148.6	83%	0.829	78%	0.783	S	S	*	*			trans	-68	165.1	171	-59.4	-67.6	0	0	0	112.2
605	Y	25.6	Very low	28.8	Very low	234 Å²	234	149 Å²	149	92%	0.918	79%	0.785	S	S	*	*			trans	-92	150.5	161.1	-82.9	-89.1	0	0	0	111.5
606	E	31.5	Very low	28.8	Very low	137 Å²	137	151.4 Å²	151.4	64%	0.64	79%	0.785	S	S	*	*			trans	-74.8	-175.5	-170.7	-53.5	-176.3	77.3	0	0	113.5	R608	E606-R608 IonicContact OE1-CZ 2.6Å; E606-R608 IonicContact OE1-NE 3.49Å; E606-R608 PolarHBondContact OE1-NE 3.06Å; E606-R608 IonicContact OE1-NH2 3.54Å; E606-R608 PolarHBondContact OE1-NH2 3.28Å; E606-R608 VanDerWaalsContact OE1-NH2 3.09Å; E606-R608 IonicContact OE2-CZ 2.64Å; E606-R608 IonicContact OE2-NE 3.43Å; E606-R608 IonicContact OE2-NH2 2.7Å; E606-R608 PolarHBondContact OE2-NH2 3.29Å
607	E	29.8	Very low	28.2	Very low	147 Å²	147	150.3 Å²	150.3	69%	0.687	78%	0.781	S	S	*	*			cis	-147.4	165	20.3	-69.4	-164.9	31	0	0	112.6
608	R	30	Very low	27.8	Very low	153 Å²	153	150 Å²	150	58%	0.577	78%	0.78	S	S	*	*			cis	-148.4	-132.3	-26.5	-100.1	174.9	-165	135.5	6.5	105.1	E606	E606-R608 IonicContact OE1-CZ 2.6Å; E606-R608 IonicContact OE1-NE 3.49Å; E606-R608 PolarHBondContact OE1-NE 3.06Å; E606-R608 IonicContact OE1-NH2 3.54Å; E606-R608 PolarHBondContact OE1-NH2 3.28Å; E606-R608 VanDerWaalsContact OE1-NH2 3.09Å; E606-R608 IonicContact OE2-CZ 2.64Å; E606-R608 IonicContact OE2-NE 3.43Å; E606-R608 IonicContact OE2-NH2 2.7Å; E606-R608 PolarHBondContact OE2-NH2 3.29Å
609	T	25.3	Very low	27.6	Very low	116 Å²	116	147.3 Å²	147.3	71%	0.712	78%	0.781	S	S	*	*			cis	-152.4	128.4	-0.8	50.2	0	0	0	0	106.9
610	S	33.5	Very low	27.2	Very low	97 Å²	97	143.2 Å²	143.2	68%	0.678	77%	0.773	S	S	*	*				72	131.8	101.1	-51.7	0	0	0	0	115.7
611	D	26.4	Very low	26.8	Very low	163 Å²	163	141.8 Å²	141.8	87%	0.872	77%	0.77	S	S	*	*			cis	-154.6	166.1	9.7	-114.9	-37.8	0	0	0	113.7
612	A	28.8	Very low	26.6	Very low	84 Å²	84	141.2 Å²	141.2	69%	0.694	77%	0.771	S	S	*	*			trans	-154.7	119.8	169.9	0	0	0	0	0	115.8
613	Q	29.8	Very low	26.4	Very low	198 Å²	198	139.7 Å²	139.7	93%	0.925	77%	0.769	S	S	*	*			trans	61.6	154.5	155.9	-65.2	-170.8	-58.6	0	0	121.2
614	L	25.6	Very low	26.4	Very low	171 Å²	171	139.5 Å²	139.5	90%	0.895	77%	0.768	S	S	*	*			trans	-109.9	167.9	173.3	-85.6	170.7	0	0	0	112
615	Q	25.3	Very low	26.2	Very low	179 Å²	179	137.7 Å²	137.7	84%	0.836	77%	0.768	S	S	*	*			trans	-80	162.6	-166.5	-55.1	163.4	-46	0	0	114.5
616	E	25.2	Very low	26	Very low	170 Å²	170	135.1 Å²	135.1	79%	0.794	76%	0.764	S	S	*	*				-160.7	133.8	117.5	-96.7	-144.4	106.7	0	0	113.1
617	N	23.2	Very low	26.4	Very low	126 Å²	126	133.1 Å²	133.1	67%	0.674	76%	0.762	S	S	*	*			trans	34.9	147.1	133.3	-65.2	-36.8	0	0	0	123.7
618	C	24	Very low	26.3	Very low	105 Å²	105	130.7 Å²	130.7	71%	0.709	75%	0.754	S	S	*	*			cis	-177	128.8	-28.1	-117.7	0	0	0	0	112
619	S	22.8	Very low	26.1	Very low	122 Å²	122	129.3 Å²	129.3	85%	0.853	76%	0.758	S	S	*	*			trans	63.8	165.4	160.9	84.2	0	0	0	0	118.3
620	S	23.9	Very low	26	Very low	101 Å²	101	129 Å²	129	71%	0.706	76%	0.759	S	S	*	*			cis	-152.5	167.6	0.7	66.6	0	0	0	0	112.1
621	S	22.6	Very low	25.5	Very low	118 Å²	118	129.3 Å²	129.3	83%	0.825	76%	0.761	S	S	*	*			trans	16.3	146.1	161.1	61.9	0	0	0	0	122.9
622	G	22.8	Very low	25.4	Very low	65 Å²	65	128.3 Å²	128.3	67%	0.67	76%	0.756	S	S	*	*			cis	150	157.5	-0.9	0	0	0	0	0	113
623	N	24	Very low	25.2	Very low	166 Å²	166	131.8 Å²	131.8	89%	0.888	76%	0.762	S	S	*	*			trans	66.3	149.8	173.9	-63.8	-18.3	0	0	0	116.8
624	V	25.5	Very low	25.1	Very low	123 Å²	123	126 Å²	126	75%	0.745	76%	0.755	S	S	*	*			cis	-159.7	159	-9.6	118.7	0	0	0	0	110
625	S	24.9	Very low	25.2	Very low	117 Å²	117	127 Å²	127	82%	0.818	76%	0.756	S	S	*	*			trans	120.2	150.7	148.9	75.7	0	0	0	0	120.6
626	H	21	Very low	25.4	Very low	180 Å²	180	124.5 Å²	124.5	83%	0.833	75%	0.753	S	S	*	*			trans	-91.8	-177.3	178.5	-103.3	-72.4	0	0	0	110.8
627	P	39.4	Very low	25.5	Very low	95 Å²	95	123.7 Å²	123.7	62%	0.617	75%	0.749	S	S	*	*			cis	-139.8	-168.7	-12.5	32.9	-9.7	0	0	0	115.1
628	D	27.5	Very low	25.8	Very low	96 Å²	96	127 Å²	127	51%	0.513	75%	0.752	S	S	.	*			trans	77.4	138.7	137.4	-80.3	-0.7	0	0	0	124.9	R592	R592-D628 IonicContact CZ-OD1 2.8Å; R592-D628 VanDerWaalsContact CZ-OD1 3.28Å; R592-D628 IonicContact NH1-OD1 2.86Å; R592-D628 PolarHBondContact NH1-OD1 2.92Å; R592-D628 VanDerWaalsContact NH2-CG 3.33Å; R592-D628 IonicContact NH2-OD1 3.08Å; R592-D628 PolarHBondContact NH2-OD1 3.42Å; R592-D628 IonicContact NH2-OD2 3.46Å; R592-D628 PolarHBondContact NH2-OD2 2.93Å; R592-D628 VanDerWaalsContact NH2-OD2 3.08Å
629	N	26.8	Very low	26.2	Very low	124 Å²	124	129.7 Å²	129.7	66%	0.663	75%	0.754	S	S	*	*			trans	41.9	130	146.4	-72.4	-20.9	0	0	0	124.4
630	C	23.6	Very low	27.3	Very low	109 Å²	109	134.1 Å²	134.1	74%	0.736	75%	0.752	S	S	*	*				17.8	130.9	125.8	-39.4	0	0	0	0	117.7
631	S	23.4	Very low	28.3	Very low	103 Å²	103	134.8 Å²	134.8	72%	0.72	75%	0.754	S	S	*	*				-178.6	169.6	66.7	-96.5	0	0	0	0	114.4
632	L	23.9	Very low	29	Very low	143 Å²	143	135.2 Å²	135.2	75%	0.749	75%	0.751	S	S	*	*			trans	68.9	118.3	150	-76.6	158	0	0	0	121
633	N	24.7	Very low	29.5	Very low	156 Å²	156	137 Å²	137	83%	0.834	75%	0.753	S	S	*	*			trans	62.7	114.3	144.3	-62.1	-11.5	0	0	0	120.3
634	G	27.8	Very low	29.9	Very low	76 Å²	76	135.4 Å²	135.4	78%	0.784	75%	0.749	S	S	*	*			trans	-174.5	67.9	171.6	0	0	0	0	0	114.6
635	E	25.8	Very low	30.1	Very low	192 Å²	192	137.9 Å²	137.9	90%	0.897	76%	0.756	S	S	*	*			trans	-68.5	142.5	146.6	-62.5	-174	121.5	0	0	106.9
636	V	29.9	Very low	30.2	Very low	128 Å²	128	135.4 Å²	135.4	78%	0.776	75%	0.75	S	S	*	*			cis	-143.4	-173.2	7.3	-118.9	0	0	0	0	107.6
637	Q	27.2	Very low	30.6	Very low	153 Å²	153	131.3 Å²	131.3	72%	0.715	75%	0.747	S	S	*	*			cis	-166.2	172.7	38.5	-167.4	151.6	-137.4	0	0	114
638	R	30.8	Very low	30.1	Very low	195 Å²	195	133 Å²	133	74%	0.736	76%	0.755	S	S	*	*			trans	-39	164	154.2	-38.9	166.9	-166.5	162.4	4.7	112.7
639	H	32.4	Very low	30.2	Very low	161 Å²	161	135.3 Å²	135.3	75%	0.745	77%	0.767	S	S	*	*			cis	-171.9	165.1	45.5	-136.8	-76.6	0	0	0	113.2
640	R	46	Very low	30.4	Very low	216 Å²	216	136.3 Å²	136.3	82%	0.815	77%	0.772	S	S	*	*			trans	-88.9	160.4	157.4	-67	-179.3	178.1	173.1	-2.9	111.7
641	P	44.9	Very low	30.7	Very low	115 Å²	115	141.1 Å²	141.1	75%	0.747	78%	0.781	S	S	*	*				-129.2	157.4	117.5	31.7	-18.6	0	0	0	112.4
642	V	35.8	Very low	30.9	Very low	127 Å²	127	141 Å²	141	77%	0.77	79%	0.786	S	S	*	*			cis	77.8	140.7	37.5	-168	0	0	0	0	111.7
643	S	34.2	Very low	31.3	Very low	102 Å²	102	138 Å²	138	71%	0.713	78%	0.782	S	S	*	*			cis	-103.5	-135.8	11.6	-44.3	0	0	0	0	114.7
644	V	32.9	Very low	31.6	Very low	132 Å²	132	137.9 Å²	137.9	80%	0.8	78%	0.781	S	S	*	*			cis	-148.9	178.6	13.8	-142.5	0	0	0	0	111.5
645	I	29.6	Very low	31.8	Very low	175 Å²	175	140 Å²	140	90%	0.897	78%	0.779	S	S	*	*			trans	-148.4	153.2	-166.9	-63.5	161.9	0	0	0	111.2
646	G	27.1	Very low	32.1	Very low	66 Å²	66	138.5 Å²	138.5	68%	0.68	77%	0.772	S	S	*	*			trans	162	122.4	152.1	0	0	0	0	0	119.7
647	A	27.8	Very low	32.2	Very low	94 Å²	94	138.9 Å²	138.9	78%	0.777	77%	0.769	S	S	*	*			trans	55.3	148.1	153.3	0	0	0	0	0	120.8
648	V	30.8	Very low	32.4	Very low	129 Å²	129	139.2 Å²	139.2	78%	0.782	77%	0.768	S	S	*	*			cis	76.2	127.3	26.5	-175	0	0	0	0	111.2
649	D	28.3	Very low	32.3	Very low	145 Å²	145	137.2 Å²	137.2	78%	0.775	77%	0.767	S	S	*	*			cis	-148.6	-172.9	40.9	-136.4	-35.8	0	0	0	115.5
650	L	31.1	Very low	32.2	Very low	146 Å²	146	135.9 Å²	135.9	76%	0.764	77%	0.766	S	S	*	*			trans	-91.9	154.9	178.8	-67.6	144.7	0	0	0	114.1
651	F	29.7	Very low	31.3	Very low	209 Å²	209	135.3 Å²	135.3	92%	0.917	76%	0.763	S	S	*	*			trans	174.8	145.7	130.9	-99.8	-64.9	0	0	0	114.5
652	A	28.7	Very low	30.7	Very low	100 Å²	100	137.6 Å²	137.6	83%	0.826	77%	0.768	S	S	*	*			trans	38.8	152.2	151.8	0	0	0	0	0	124.5
653	A	32	Very low	31.2	Very low	82 Å²	82	136.5 Å²	136.5	68%	0.678	76%	0.764	S	S	*	*			trans	-89.4	170.6	168.6	0	0	0	0	0	110.8
654	D	30.5	Very low	31.6	Very low	152 Å²	152	136.9 Å²	136.9	81%	0.813	77%	0.767	S	S	*	*			cis	-157.6	-172.2	45.1	-104.7	-45.3	0	0	0	113.8
655	T	32.3	Very low	32.4	Very low	120 Å²	120	136.8 Å²	136.8	74%	0.736	77%	0.769	S	S	*	*			trans	-27.6	151.3	166.9	33.4	0	0	0	0	117.8
656	E	31.8	Very low	32.7	Very low	162 Å²	162	136.6 Å²	136.6	76%	0.757	77%	0.769	S	S	*	*			cis	-163	158.9	32.8	-132.8	-176.3	-159.8	0	0	114.4
657	L	33.1	Very low	33.3	Very low	135 Å²	135	139.4 Å²	139.4	71%	0.707	78%	0.778	S	S	*	*			trans	51.3	135.8	150.4	-71.7	166.6	0	0	0	126.3
658	K	30.2	Very low	33.6	Very low	160 Å²	160	145.8 Å²	145.8	70%	0.696	78%	0.782	S	S	*	*			trans	81.1	136.3	143.7	-85.8	173.4	162.4	-86.2	0	123.4
659	E	29	Very low	34.4	Very low	154 Å²	154	145 Å²	145	72%	0.72	78%	0.78	S	S	*	*			trans	22.3	127.7	146.8	-61.9	156.3	131.1	0	0	118.6
660	D	30.8	Very low	35.7	Very low	132 Å²	132	144 Å²	144	71%	0.706	78%	0.781	S	S	*	*			cis	-170.9	165.5	49.9	-159.7	3.8	0	0	0	114
661	R	27.2	Very low	36	Very low	204 Å²	204	145 Å²	145	77%	0.77	79%	0.785	S	S	*	*			trans	24.2	128.5	158.6	-77	155.9	-163.1	-146.4	-3.1	126.3
662	L	31.9	Very low	36.9	Very low	163 Å²	163	140.6 Å²	140.6	85%	0.853	78%	0.777	S	S	*	*			trans	85.6	160.8	133.1	-66	173.6	0	0	0	121.9
663	P	46.1	Very low	37.3	Very low	105 Å²	105	141.2 Å²	141.2	68%	0.682	78%	0.776	S	S	*	*			trans	-134.9	174.9	-144.9	45.9	-31.5	0	0	0	120.4
664	S	42.4	Very low	37.5	Very low	110 Å²	110	144.6 Å²	144.6	77%	0.769	78%	0.777	S	S	*	*			trans	76.3	145	148.3	76.2	0	0	0	0	122.4
665	P	49.5	Very low	37.6	Very low	129 Å²	129	145.5 Å²	145.5	84%	0.838	77%	0.774	S	S	*	*			trans	-145.9	169	150.2	39.3	-23.1	0	0	0	116.8
666	L	36	Very low	37.8	Very low	172 Å²	172	146.5 Å²	146.5	90%	0.901	78%	0.78	S	S	*	*			trans	-147.9	153.6	174.4	-91.2	173.3	0	0	0	112.5
667	S	39.9	Very low	38.1	Very low	124 Å²	124	144.4 Å²	144.4	87%	0.867	78%	0.78	S	S	*	*			trans	132	156.3	148.5	-60	0	0	0	0	116.6
668	R	35.1	Very low	39.5	Very low	229 Å²	229	143.2 Å²	143.2	86%	0.864	78%	0.78	S	S	*	*			trans	-156.3	144.3	-164.7	175.3	179.1	167.1	-166.9	-3.7	115.7
669	P	45.9	Very low	39.5	Very low	113 Å²	113	144.9 Å²	144.9	73%	0.734	78%	0.784	S	S	*	*			trans	-102.4	174.9	179	39.4	-36.5	0	0	0	116.6
670	P	55.5	Low	39.7	Very low	124 Å²	124	145.6 Å²	145.6	81%	0.805	78%	0.78	S	S	*	*			trans	-116	166	-172.9	41.1	-32.1	0	0	0	118
671	I	38.5	Very low	39.7	Very low	166 Å²	166	142.9 Å²	142.9	85%	0.851	78%	0.783	S	S	*	*			trans	-147.9	156.6	-174.7	56.8	171.3	0	0	0	116.5
672	P	47.4	Very low	39.8	Very low	116 Å²	116	137 Å²	137	75%	0.753	77%	0.77	S	S	*	*			trans	-98.2	-178.1	174.7	40.9	-38	0	0	0	113.4
673	S	38.9	Very low	39.8	Very low	114 Å²	114	133.7 Å²	133.7	80%	0.797	76%	0.76	S	S	*	*			cis	-166.8	-162.7	-16.1	51.1	0	0	0	0	107.6
674	H	35.2	Very low	39	Very low	152 Å²	152	131.8 Å²	131.8	70%	0.704	75%	0.753	S	S	*	*			cis	-149.1	-102.7	7.2	-176.1	-140.3	0	0	0	114.4
675	K	33.5	Very low	38.5	Very low	171 Å²	171	133 Å²	133	74%	0.743	74%	0.741	S	S	*	*			trans	-151.1	140.7	-165.1	-72.5	-179.8	-171.1	174.3	0	117.2
676	V	36.6	Very low	37.5	Very low	141 Å²	141	135 Å²	135	86%	0.855	74%	0.737	S	S	*	*			trans	-155.7	141.6	159.2	-175.9	0	0	0	0	111
677	P	36.8	Very low	37.4	Very low	119 Å²	119	137.3 Å²	137.3	77%	0.773	73%	0.734	S	S	*	*			trans	-132.7	176.7	158.7	40.9	-25.3	0	0	0	113.2
678	P	64.1	Low	37.8	Very low	109 Å²	109	136.3 Å²	136.3	71%	0.708	72%	0.724	S	S	*	*				-134.4	-179	-125.2	40.1	-21.5	0	0	0	118
679	Y	30.2	Very low	37.5	Very low	196 Å²	196	130.9 Å²	130.9	77%	0.769	72%	0.721	S	S	*	*				178.6	166.5	129.4	-115.1	-112.4	0	0	0	117.6
680	R	31.2	Very low	36.7	Very low	169 Å²	169	129.4 Å²	129.4	64%	0.638	72%	0.718	S	S	*	*			trans	-25	161.3	176	-65.6	171.2	179.3	171.5	1.6	122.4
681	G	32.5	Very low	35.6	Very low	75 Å²	75	131.7 Å²	131.7	77%	0.773	72%	0.723	S	S	*	*			trans	178.5	54.9	154.9	0	0	0	0	0	124.4
682	V	28.1	Very low	35.1	Very low	81 Å²	81	128.4 Å²	128.4	49%	0.491	72%	0.715	S	S	.	*			trans	4.5	128.5	151.5	177	0	0	0	0	122.6	I277	I277-V682 HydrophobicContact CB-CG1 3.9Å; I277-V682 HydrophobicContact CG2-CG1 3.73Å; I277-V682 HydrophobicContact CG2-CG2 4.5Å
683	S	31.4	Very low	34.3	Very low	93 Å²	93	131.4 Å²	131.4	65%	0.65	72%	0.719	S	S	*	*			trans	64.4	165.8	155.1	-55.9	0	0	0	0	118.6
684	A	30.5	Very low	34	Very low	65 Å²	65	131.2 Å²	131.2	54%	0.537	72%	0.717	S	S	.	*			cis	-164.1	167.7	15.8	0	0	0	0	0	113.8
685	R	32.3	Very low	33.9	Very low	135 Å²	135	130.1 Å²	130.1	51%	0.509	72%	0.721	S	S	.	*			trans	56.9	123.2	143.8	-66.6	-177.1	-174.9	-165.7	6.6	120.1	S274 T275	S274-R685 PolarHBondContact OG-NH2 2.73Å; T275-R685 PolarHBondContact O-NH2 3.46Å
686	F	28.5	Very low	34.3	Very low	170 Å²	170	127.2 Å²	127.2	75%	0.746	72%	0.72	S	S	*	*				61.1	140.8	97.6	-71.1	-46.7	0	0	0	116.1
687	R	33.3	Very low	34	Very low	222 Å²	222	128.5 Å²	128.5	84%	0.838	72%	0.721	S	S	*	*			cis	-156.6	-177	18.5	-101.9	-115.7	179.5	173.6	-0.1	111.4
688	P	48.9	Very low	33.7	Very low	102 Å²	102	125.9 Å²	125.9	66%	0.662	72%	0.715	S	S	*	*			trans	-116.9	-163.8	-158.1	45.7	-38.9	0	0	0	116.8
689	S	28	Very low	31.9	Very low	116 Å²	116	128.9 Å²	128.9	81%	0.811	72%	0.724	S	S	*	*			trans	104.5	159	167.2	-39.4	0	0	0	0	115.1
690	A	29	Very low	32	Very low	81 Å²	81	124.1 Å²	124.1	67%	0.669	71%	0.712	S	S	*	*			cis	-178.8	149.5	-36.4	0	0	0	0	0	109.5
691	L	33.3	Very low	32.2	Very low	173 Å²	173	126 Å²	126	91%	0.906	72%	0.719	S	S	*	*			trans	65.8	159	166.4	-63.6	166.4	0	0	0	116.3
692	S	27.3	Very low	32.2	Very low	97 Å²	97	128.2 Å²	128.2	68%	0.678	72%	0.717	S	S	*	*			cis	-169.3	174.5	-17.3	-179.9	0	0	0	0	110.3
693	Q	31.3	Very low	32.4	Very low	179 Å²	179	127.6 Å²	127.6	84%	0.836	73%	0.727	S	S	*	*			trans	74.7	156	166.9	-55.7	-166.6	5.3	0	0	117.8
694	S	32.6	Very low	32.7	Very low	109 Å²	109	132.6 Å²	132.6	76%	0.762	73%	0.731	S	S	*	*			cis	-165.6	176.9	-8.4	40.6	0	0	0	0	113
695	T	32.6	Very low	32.8	Very low	129 Å²	129	138.7 Å²	138.7	79%	0.791	74%	0.741	S	S	*	*			trans	-81.8	160.6	-172.6	-14.5	0	0	0	0	117.8
696	P	41.4	Very low	32.7	Very low	111 Å²	111	141.4 Å²	141.4	72%	0.721	75%	0.751	S	S	*	*				-142.2	163.1	110.8	33.7	-16	0	0	0	113.3
697	I	30.6	Very low	32.7	Very low	168 Å²	168	141.3 Å²	141.3	86%	0.862	76%	0.757	S	S	*	*				68	127.4	51.2	-62.7	174.3	0	0	0	113.5
698	G	30.4	Very low	32.5	Very low	63 Å²	63	137.1 Å²	137.1	65%	0.649	75%	0.747	S	S	*	*			cis	170.4	-172.6	-4	0	0	0	0	0	113.2
699	L	26.9	Very low	31.5	Very low	173 Å²	173	141.2 Å²	141.2	91%	0.906	75%	0.749	S	S	*	*			trans	78.1	155.4	171.9	-57.6	167.3	0	0	0	119.8
700	D	31.4	Very low	31.6	Very low	95 Å²	95	142.3 Å²	142.3	51%	0.508	75%	0.751	S	S	.	*			cis	-170.9	121.4	-36.6	-160.9	52.6	0	0	0	114.3
701	R	35.4	Very low	31.7	Very low	209 Å²	209	144.5 Å²	144.5	79%	0.789	75%	0.751	S	S	*	*			trans	53.8	178.9	150	-60.1	172.9	-167.4	121.2	0.9	118.9
702	V	33.8	Very low	31.4	Very low	122 Å²	122	141.7 Å²	141.7	74%	0.739	75%	0.745	S	S	*	*			cis	-143.4	160.2	12.8	-77.5	0	0	0	0	110.4
703	G	32	Very low	31.3	Very low	67 Å²	67	142.1 Å²	142.1	69%	0.691	76%	0.755	S	S	*	*			cis	136.5	179.8	-5.1	0	0	0	0	0	114.3
704	R	36.1	Very low	31.1	Very low	198 Å²	198	136.9 Å²	136.9	75%	0.747	75%	0.748	S	S	*	*			trans	84.6	150.6	169.4	-50.4	-173.2	-177.2	-74.2	5.2	115.9
705	R	32.7	Very low	30.7	Very low	194 Å²	194	138.7 Å²	138.7	73%	0.732	76%	0.755	S	S	*	*			cis	-158.9	123.5	9.1	-136.2	166.9	-164.1	171.7	3.1	115.3
706	R	31.7	Very low	30.5	Very low	191 Å²	191	137.1 Å²	137.1	72%	0.721	75%	0.749	S	S	*	*			trans	41.8	128.1	136.3	-65.4	-178.3	170.2	-178.7	-5.7	123.5
707	L	28.8	Very low	29.9	Very low	168 Å²	168	139.7 Å²	139.7	88%	0.88	75%	0.751	S	S	*	*				-173.7	102.9	108.4	-98.4	144.9	0	0	0	108.8
708	H	27.9	Very low	29.8	Very low	135 Å²	135	137.4 Å²	137.4	63%	0.625	75%	0.749	S	S	*	*				58.7	140.9	84.5	-89.7	-111.6	0	0	0	116.5
709	R	28.4	Very low	29.8	Very low	187 Å²	187	139.4 Å²	139.4	71%	0.706	75%	0.753	S	S	*	*			cis	170.4	137.3	-24.3	158.1	-177.2	-83.2	-169.6	-5.8	108.2	L711	R709-L711 HydrophobicContact CG-CG 4.33Å
710	V	29.4	Very low	30	Very low	139 Å²	139	135.9 Å²	135.9	84%	0.842	75%	0.748	S	S	*	*			trans	168.4	144.6	144.8	143.8	0	0	0	0	109.9
711	L	31.3	Very low	29.9	Very low	128 Å²	128	136.8 Å²	136.8	67%	0.67	76%	0.758	S	S	*	*			cis	-168.4	165.3	-43.9	-118.5	174.2	0	0	0	110.6	R709	R709-L711 HydrophobicContact CG-CG 4.33Å
712	S	27.8	Very low	29.7	Very low	114 Å²	114	133.8 Å²	133.8	80%	0.797	76%	0.756	S	S	*	*			trans	74.5	124.9	173.8	-59.3	0	0	0	0	117.6
713	A	25.3	Very low	29.4	Very low	106 Å²	106	134.1 Å²	134.1	88%	0.876	75%	0.754	S	S	*	*	S	Bend	cis	-153.3	136.8	-11.6	0	0	0	0	0	110.1
714	G	26.3	Very low	29.1	Very low	68 Å²	68	137 Å²	137	70%	0.701	75%	0.754	S	S	*	*			trans	176.1	-86.7	-173.3	0	0	0	0	0	112.5
715	V	25.4	Very low	28.8	Very low	148 Å²	148	132.1 Å²	132.1	90%	0.897	75%	0.75	S	S	*	*			trans	75.9	121.2	175.7	-175.7	0	0	0	0	113.5
716	S	27.7	Very low	28.5	Very low	95 Å²	95	128.9 Å²	128.9	66%	0.664	75%	0.752	S	S	*	*			cis	-163	155.8	-2.1	-163.1	0	0	0	0	113.5
717	E	28.6	Very low	28.2	Very low	165 Å²	165	124.5 Å²	124.5	77%	0.771	75%	0.75	S	S	*	*			trans	-37.8	161	163.6	-60.9	124.6	-150.1	0	0	117.2
718	C	28.4	Very low	28.2	Very low	120 Å²	120	125.8 Å²	125.8	81%	0.811	75%	0.752	S	S	*	*			cis	78.3	149	31.4	-55.4	0	0	0	0	114.6
719	S	31.1	Very low	28.1	Very low	106 Å²	106	127.9 Å²	127.9	74%	0.741	76%	0.762	S	S	*	*			cis	-170.8	158.9	-14.4	42.9	0	0	0	0	111.6
720	A	29.9	Very low	28.1	Very low	98 Å²	98	128.5 Å²	128.5	81%	0.81	77%	0.773	S	S	*	*			trans	62	-177.9	168	0	0	0	0	0	116.2
721	T	29.3	Very low	28	Very low	114 Å²	114	131 Å²	131	70%	0.699	78%	0.775	S	S	*	*			cis	-157.9	150.5	20.5	48	0	0	0	0	113.3
722	L	31.4	Very low	27.9	Very low	146 Å²	146	133.8 Å²	133.8	76%	0.764	79%	0.785	S	S	*	*			trans	57	156	140.8	-58.7	167.2	0	0	0	119.7
723	D	26.8	Very low	27.9	Very low	130 Å²	130	137.7 Å²	137.7	70%	0.695	79%	0.79	S	S	*	*			cis	-154.4	178.3	-3.5	-122.1	-23.2	0	0	0	107.5
724	D	26.4	Very low	27.9	Very low	128 Å²	128	141 Å²	141	68%	0.684	79%	0.788	S	S	*	*			cis	-157	138.3	26.1	-173.5	11.7	0	0	0	110.7
725	S	29.1	Very low	28.1	Very low	95 Å²	95	144 Å²	144	66%	0.664	80%	0.798	S	S	*	*			trans	34.8	150.7	151.8	-54.3	0	0	0	0	122.6
726	V	26.5	Very low	28.5	Very low	126 Å²	126	141.8 Å²	141.8	76%	0.764	79%	0.789	S	S	*	*			cis	-139.5	133.8	24.2	171.6	0	0	0	0	111.1
727	S	27	Very low	28.5	Very low	99 Å²	99	144.8 Å²	144.8	69%	0.692	79%	0.79	S	S	*	*			trans	24.5	152.4	139.7	-43.7	0	0	0	0	121.6
728	E	28.5	Very low	28.6	Very low	194 Å²	194	146.7 Å²	146.7	91%	0.907	80%	0.799	S	S	*	*			cis	-121.2	149.7	19.2	-69.2	173.5	156.5	0	0	114
729	E	24.8	Very low	28.7	Very low	180 Å²	180	147.9 Å²	147.9	84%	0.841	79%	0.793	S	S	*	*			trans	-119.4	132.5	178	-63.3	165.9	143.8	0	0	107.9
730	E	29.2	Very low	28.7	Very low	200 Å²	200	149.3 Å²	149.3	94%	0.935	79%	0.791	S	S	*	*			trans	-123.6	140	149.3	-79.9	-165.6	157.7	0	0	106.6
731	E	28.1	Very low	28.6	Very low	192 Å²	192	149.1 Å²	149.1	90%	0.897	79%	0.79	S	S	*	*			trans	-83	156.1	-142.6	-66.5	173.3	122.8	0	0	115.9
732	E	28.1	Very low	28.6	Very low	185 Å²	185	147.8 Å²	147.8	86%	0.864	78%	0.779	S	S	*	*			trans	-75.7	146.5	169.9	-50.2	179.1	134.9	0	0	110.6
733	E	27.5	Very low	28.6	Very low	197 Å²	197	144.2 Å²	144.2	92%	0.921	78%	0.777	S	S	*	*			trans	-127.1	109.7	138.6	-83.9	-157.3	159.5	0	0	110.6
734	E	26.1	Very low	28.9	Very low	175 Å²	175	138.8 Å²	138.8	82%	0.818	75%	0.748	S	S	*	*			trans	10.5	113.4	161.4	-55.7	-166.4	130.8	0	0	120.6	S736	E734-S736 PolarHBondContact O-N 3.01Å
735	S	29.9	Very low	29.6	Very low	130 Å²	130	136.6 Å²	136.6	91%	0.909	74%	0.741	S	S	*	*				21.9	63.7	105.7	-173.3	0	0	0	0	119.1
736	S	34.3	Very low	30.3	Very low	102 Å²	102	135.8 Å²	135.8	71%	0.713	72%	0.724	S	S	*	*			trans	-148.4	92.8	155.8	-169.9	0	0	0	0	112.7	E734	E734-S736 PolarHBondContact O-N 3.01Å
737	F	28.1	Very low	31.1	Very low	159 Å²	159	130.8 Å²	130.8	70%	0.697	69%	0.693	S	S	*	*			trans	-159.1	50.3	167	-136.8	-143.7	0	0	0	115.6	E739 L740	F737-E739 PolarHBondContact O-N 3.29Å; F737-L740 HydrophobicContact CD1-CD1 4.2Å; F737-L740 HydrophobicContact CD1-CG 4.42Å; F737-L740 HydrophobicContact CE1-CD1 3.26Å; F737-L740 HydrophobicContact CE1-CG 3.67Å; F737-L740 HydrophobicContact CE2-CG 4.24Å; F737-L740 HydrophobicContact CZ-CD1 3.52Å; F737-L740 HydrophobicContact CZ-CD2 4.29Å; F737-L740 HydrophobicContact CZ-CG 3.55Å
738	E	30.2	Very low	31.9	Very low	205 Å²	205	129.8 Å²	129.8	96%	0.958	68%	0.677	S	S	*	*			trans	-87.1	31.1	163.5	-159.8	155.1	-164.6	0	0	111.6
739	E	30	Very low	32.2	Very low	145 Å²	145	126 Å²	126	68%	0.678	67%	0.67	S	S	*	*			trans	-130.6	45.7	-169.8	-157	-173	158.9	0	0	112.9	F737	F737-E739 PolarHBondContact O-N 3.29Å
740	L	31.5	Very low	33	Very low	135 Å²	135	121.3 Å²	121.3	71%	0.707	67%	0.67	S	S	*	*			trans	-135.5	10.1	170	-88.5	-166.3	0	0	0	115	F737	F737-L740 HydrophobicContact CD1-CD1 4.2Å; F737-L740 HydrophobicContact CD1-CG 4.42Å; F737-L740 HydrophobicContact CE1-CD1 3.26Å; F737-L740 HydrophobicContact CE1-CG 3.67Å; F737-L740 HydrophobicContact CE2-CG 4.24Å; F737-L740 HydrophobicContact CZ-CD1 3.52Å; F737-L740 HydrophobicContact CZ-CD2 4.29Å; F737-L740 HydrophobicContact CZ-CG 3.55Å
741	A	27.6	Very low	34.1	Very low	95 Å²	95	113.3 Å²	113.3	79%	0.785	64%	0.635	S	S	*	*	S	Bend	trans	-80.1	-23.7	-175.3	0	0	0	0	0	114.7
742	D	30.3	Very low	35.6	Very low	86 Å²	86	108 Å²	108	46%	0.46	61%	0.61	S	S	.	*			trans	-111.8	28.7	-167.9	-105.2	-51	0	0	0	116.2	T744 K798	D742-T744 PolarHBondContact O-N 3.33Å; D742-K798 IonicContact OD1-NZ 2.76Å; D742-K798 PolarHBondContact OD1-NZ 3.05Å
743	G	29.5	Very low	37.5	Very low	70 Å²	70	100.5 Å²	100.5	72%	0.722	58%	0.575	S	S	*	*			trans	-64.2	92	167.9	0	0	0	0	0	113.1	P745	G743-P745 WeakPolarHBondContact O-CD 3.37Å
744	T	35.1	Very low	39.3	Very low	16 Å²	16	94.3 Å²	94.3	10%	0.098	55%	0.554	C	S	.	*			trans	-79	113.8	173.3	-41.7	0	0	0	0	109.2	D742 Y746 L747	D742-T744 PolarHBondContact O-N 3.33Å; T744-Y746 PolarHBondContact O-N 3.42Å; T744-L747 PolarHBondContact O-N 2.85Å
745	P	40.4	Very low	41.7	Very low	83 Å²	83	88.2 Å²	88.2	54%	0.539	53%	0.528	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.7	19.2	-162.8	31.7	-38.1	0	0	0	115.8	G743	G743-P745 WeakPolarHBondContact O-CD 3.37Å
746	Y	44	Very low	43.8	Very low	77 Å²	77	82 Å²	82	30%	0.302	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.6	-3.2	174	-63.6	-87	0	0	0	112.4	T744 L771 S815 V817	T744-Y746 PolarHBondContact O-N 3.42Å; Y746-L771 HydrophobicContact CD1-CD1 4.24Å; Y746-L771 HydrophobicContact CE1-CD1 4.32Å; Y746-S815 WeakPolarHBondContact CE1-O 3.4Å; Y746-V817 WeakPolarHBondContact CD1-O 3.33Å
747	L	42.8	Very low	45.9	Very low	22 Å²	22	78.2 Å²	78.2	12%	0.115	46%	0.457	C	S	.	.	S	Bend	trans	-97.6	151.5	167.6	-55.6	-179.7	0	0	0	109.1	T744 V751 L753 L756 W801 V819	T744-L747 PolarHBondContact O-N 2.85Å; L747-V751 HydrophobicContact CB-CB 4.45Å; L747-V751 WeakPolarHBondContact CB-O 3.39Å; L747-V751 WeakPolarHBondContact CD1-O 3.42Å; L747-L753 HydrophobicContact CD1-CB 4.31Å; L747-L753 HydrophobicContact CD1-CD1 4.11Å; L747-L756 HydrophobicContact CD2-CD2 3.87Å; L747-W801 HydrophobicContact CD2-CH2 3.85Å; L747-W801 HydrophobicContact CD2-CZ2 4.35Å; L747-V819 HydrophobicContact CD2-CB 4.26Å; L747-V819 HydrophobicContact CD2-CG2 3.5Å
748	Q	44.3	Very low	48.3	Very low	77 Å²	77	76.6 Å²	76.6	36%	0.36	45%	0.451	S	S	.	.			trans	-67.8	151.1	172.4	-71	-72.7	8.3	0	0	110.2	G750 V751 V821	Q748-G750 PolarHBondContact O-N 3.18Å; Q748-V751 PolarHBondContact O-N 3.05Å; Q748-V821 HydrophobicContact CG-CG2 4.14Å
749	P	33.8	Very low	50.6	Low	115 Å²	115	70.9 Å²	70.9	75%	0.747	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	115.9	168.5	-21.1	32.9	0	0	0	109.7
750	G	41.2	Very low	53.1	Low	82 Å²	82	65.3 Å²	65.3	85%	0.845	40%	0.396	S	S	*	.	T	Hydrogen-bonded Turn	trans	109.1	-1.7	-175.1	0	0	0	0	0	116.2	Q748	Q748-G750 PolarHBondContact O-N 3.18Å
751	V	52.5	Low	55.3	Low	32 Å²	32	65.7 Å²	65.7	19%	0.194	40%	0.397	C	S	.	.			trans	-113.2	100.2	168.8	-174.9	0	0	0	0	110	L747 Q748 L756 W759	L747-V751 HydrophobicContact CB-CB 4.45Å; L747-V751 WeakPolarHBondContact CB-O 3.39Å; L747-V751 WeakPolarHBondContact CD1-O 3.42Å; Q748-V751 PolarHBondContact O-N 3.05Å; V751-L756 HydrophobicContact CG1-CB 4.29Å; V751-L756 HydrophobicContact CG1-CD1 4.12Å; V751-W759 HydrophobicContact CG1-CH2 4.44Å; V751-W759 HydrophobicContact CG1-CZ3 4.26Å; V751-W759 HydrophobicContact CG2-CH2 4.15Å; V751-W759 HydrophobicContact CG2-CZ3 4.45Å
752	E	60.6	Low	57.6	Low	80 Å²	80	65.2 Å²	65.2	37%	0.374	39%	0.388	S	S	.	.			trans	-61.5	148.8	166.8	-93.3	-103.3	123	0	0	111.5	S754 V755 L756	E752-S754 PolarHBondContact O-N 3.14Å; E752-S754 VanDerWaalsContact OE2-CB 3.25Å; E752-S754 WeakPolarHBondContact OE2-CB 3.27Å; E752-S754 PolarHBondContact OE2-OG 3.32Å; E752-V755 HydrophobicContact CB-CB 4.08Å; E752-V755 HydrophobicContact CB-CG2 3.86Å; E752-V755 PolarHBondContact O-N 3.32Å; E752-L756 PolarHBondContact O-N 3.3Å
753	L	67.6	Low	59.7	Low	27 Å²	27	63.7 Å²	63.7	14%	0.141	39%	0.392	C	S	.	.	H	α-helix	trans	-64.1	-29	170.3	-164	71.3	0	0	0	111.1	L747 L756 N757 W801	L747-L753 HydrophobicContact CD1-CB 4.31Å; L747-L753 HydrophobicContact CD1-CD1 4.11Å; L753-L756 HydrophobicContact CD1-CD2 4.15Å; L753-N757 PolarHBondContact O-N 3.22Å; L753-N757 PolarHBondContact O-ND2 3.11Å; L753-W801 HydrophobicContact CD1-CZ2 3.84Å
754	S	66.2	Low	62	Low	68 Å²	68	67.5 Å²	67.5	48%	0.476	39%	0.386	S	S	.	.	H	α-helix	trans	-58.1	-57.8	170.7	-43.3	0	0	0	0	111.1	E752 L756 N757 E758	E752-S754 PolarHBondContact O-N 3.14Å; E752-S754 VanDerWaalsContact OE2-CB 3.25Å; E752-S754 WeakPolarHBondContact OE2-CB 3.27Å; E752-S754 PolarHBondContact OE2-OG 3.32Å; S754-L756 VanDerWaalsContact C-N 3.33Å; S754-L756 PolarHBondContact O-N 2.98Å; S754-N757 PolarHBondContact O-N 2.77Å; S754-N757 VanDerWaalsContact O-N 3.09Å; S754-E758 PolarHBondContact O-N 3.28Å
755	V	74.9	Confident	64.2	Low	46 Å²	46	67.9 Å²	67.9	28%	0.279	39%	0.391	S	S	.	.	H	α-helix	trans	-60.9	-39.4	-179.7	173.3	0	0	0	0	111.8	E752 N757 E758 W759	E752-V755 HydrophobicContact CB-CB 4.08Å; E752-V755 HydrophobicContact CB-CG2 3.86Å; E752-V755 PolarHBondContact O-N 3.32Å; V755-N757 VanDerWaalsContact C-N 3.29Å; V755-N757 PolarHBondContact O-N 3.16Å; V755-E758 PolarHBondContact O-N 3.39Å; V755-W759 HydrophobicContact CG1-CD2 4.13Å; V755-W759 VanDerWaalsContact CG1-CE2 3.45Å; V755-W759 HydrophobicContact CG1-CH2 4.38Å; V755-W759 HydrophobicContact CG1-CZ2 3.61Å; V755-W759 VanDerWaalsContact O-CG 3.31Å; V755-W759 PolarHBondContact O-N 3.09Å
756	L	75.6	Confident	66.4	Low	0 Å²	0	64 Å²	64	0%	0	37%	0.366	C	S	.	.	H	α-helix	trans	-59.1	-40.7	175.5	-166.8	75	0	0	0	112.1	L747 V751 E752 L753 S754 I760 V766 L792 A795 W801 V819	L747-L756 HydrophobicContact CD2-CD2 3.87Å; V751-L756 HydrophobicContact CG1-CB 4.29Å; V751-L756 HydrophobicContact CG1-CD1 4.12Å; E752-L756 PolarHBondContact O-N 3.3Å; L753-L756 HydrophobicContact CD1-CD2 4.15Å; S754-L756 VanDerWaalsContact C-N 3.33Å; S754-L756 PolarHBondContact O-N 2.98Å; L756-I760 WeakPolarHBondContact O-CD1 3.21Å; L756-I760 VanDerWaalsContact O-CG1 3.32Å; L756-I760 WeakPolarHBondContact O-CG1 3.47Å; L756-I760 PolarHBondContact O-N 2.86Å; L756-V766 HydrophobicContact CD1-CG1 3.77Å; L756-L792 HydrophobicContact CD2-CD1 4.13Å; L756-A795 HydrophobicContact CD2-CB 3.76Å; L756-A795 HydrophobicContact CG-CB 4.35Å; L756-W801 HydrophobicContact CD2-CH2 4.13Å; L756-W801 HydrophobicContact CD2-CZ2 4.08Å; L756-V819 HydrophobicContact CD1-CG1 4.07Å; L756-V819 HydrophobicContact CD1-CG2 4.18Å; L756-V819 HydrophobicContact CD2-CG2 4.32Å
757	N	78.5	Confident	68.4	Low	22 Å²	22	62 Å²	62	12%	0.118	36%	0.358	C	S	.	.	H	α-helix	trans	-73.8	-37.7	175.8	-77.3	-71.3	0	0	0	112.1	L753 S754 V755 W759 I760 I761 A795 S796	L753-N757 PolarHBondContact O-N 3.22Å; L753-N757 PolarHBondContact O-ND2 3.11Å; S754-N757 PolarHBondContact O-N 2.77Å; S754-N757 VanDerWaalsContact O-N 3.09Å; V755-N757 VanDerWaalsContact C-N 3.29Å; V755-N757 PolarHBondContact O-N 3.16Å; N757-W759 VanDerWaalsContact C-N 3.3Å; N757-W759 PolarHBondContact O-N 2.95Å; N757-I760 PolarHBondContact O-N 3.31Å; N757-I761 WeakPolarHBondContact O-CB 3.42Å; N757-I761 WeakPolarHBondContact O-CD1 3.47Å; N757-I761 WeakPolarHBondContact O-CG1 3.46Å; N757-I761 PolarHBondContact O-N 3.33Å; N757-A795 PolarHBondContact ND2-O 3.35Å; N757-A795 VanDerWaalsContact OD1-CA 3.31Å; N757-A795 WeakPolarHBondContact OD1-CA 3.36Å; N757-A795 PolarHBondContact OD1-N 3.35Å; N757-S796 PolarHBondContact OD1-N 3.32Å
758	E	78.6	Confident	70.6	Confident	125 Å²	125	60.9 Å²	60.9	58%	0.584	35%	0.352	S	S	*	.	H	α-helix	trans	-60.8	-38.2	173.4	-71.1	-168.8	149.7	0	0	112.3	S754 V755 I761 S762	S754-E758 PolarHBondContact O-N 3.28Å; V755-E758 PolarHBondContact O-N 3.39Å; E758-I761 PolarHBondContact O-N 2.64Å; E758-S762 WeakPolarHBondContact O-CB 3.44Å; E758-S762 PolarHBondContact O-N 3.44Å; E758-S762 PolarHBondContact O-OG 3.36Å
759	W	78	Confident	72.5	Confident	86 Å²	86	58.7 Å²	58.7	33%	0.326	34%	0.342	S	S	.	.	H	α-helix	trans	-63.5	-45.4	174	-67.6	-6	0	0	0	112	V751 V755 N757 S762 G763 Y764 V766 Q823	V751-W759 HydrophobicContact CG1-CH2 4.44Å; V751-W759 HydrophobicContact CG1-CZ3 4.26Å; V751-W759 HydrophobicContact CG2-CH2 4.15Å; V751-W759 HydrophobicContact CG2-CZ3 4.45Å; V755-W759 HydrophobicContact CG1-CD2 4.13Å; V755-W759 VanDerWaalsContact CG1-CE2 3.45Å; V755-W759 HydrophobicContact CG1-CH2 4.38Å; V755-W759 HydrophobicContact CG1-CZ2 3.61Å; V755-W759 VanDerWaalsContact O-CG 3.31Å; V755-W759 PolarHBondContact O-N 3.09Å; N757-W759 VanDerWaalsContact C-N 3.3Å; N757-W759 PolarHBondContact O-N 2.95Å; W759-S762 PolarHBondContact O-N 2.79Å; W759-G763 PolarHBondContact O-N 2.82Å; W759-Y764 HydrophobicContact CB-CD2 4.4Å; W759-Y764 WeakPolarHBondContact O-CB 3.41Å; W759-Y764 PolarHBondContact O-N 3.02Å; W759-V766 HydrophobicContact CB-CG2 3.93Å; W759-V766 HydrophobicContact CE3-CG2 4.37Å; W759-Q823 VanDerWaalsContact CZ3-NE2 3.3Å
760	I	82.5	Confident	74.8	Confident	27 Å²	27	53.3 Å²	53.3	14%	0.138	31%	0.307	C	S	.	.	H	α-helix	trans	-61.8	-46.1	176.2	-68.6	166.7	0	0	0	110.8	L756 N757 S762 G763 V766 L792 L793 A795	L756-I760 WeakPolarHBondContact O-CD1 3.21Å; L756-I760 VanDerWaalsContact O-CG1 3.32Å; L756-I760 WeakPolarHBondContact O-CG1 3.47Å; L756-I760 PolarHBondContact O-N 2.86Å; N757-I760 PolarHBondContact O-N 3.31Å; I760-S762 VanDerWaalsContact C-N 3.32Å; I760-S762 PolarHBondContact O-N 2.88Å; I760-G763 PolarHBondContact O-N 2.65Å; I760-G763 VanDerWaalsContact O-N 3.08Å; I760-V766 HydrophobicContact CG1-CB 4.23Å; I760-V766 HydrophobicContact CG1-CG2 3.91Å; I760-L792 HydrophobicContact CD1-CB 3.79Å; I760-L792 HydrophobicContact CG1-CB 4.45Å; I760-L793 VanDerWaalsContact CG2-O 3.26Å; I760-L793 WeakPolarHBondContact CG2-O 3.19Å; I760-A795 HydrophobicContact CD1-CB 3.9Å
761	I	77.1	Confident	75.6	Confident	143 Å²	143	51.2 Å²	51.2	73%	0.733	28%	0.276	S	S	*	.	H	α-helix	trans	-66	-34.8	178.7	-69	164.7	0	0	0	111.4	N757 E758 G763	N757-I761 WeakPolarHBondContact O-CB 3.42Å; N757-I761 WeakPolarHBondContact O-CD1 3.47Å; N757-I761 WeakPolarHBondContact O-CG1 3.46Å; N757-I761 PolarHBondContact O-N 3.33Å; E758-I761 PolarHBondContact O-N 2.64Å; I761-G763 PolarHBondContact O-N 2.79Å
762	S	76.5	Confident	75.7	Confident	85 Å²	85	51.9 Å²	51.9	59%	0.594	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-0.6	174.4	-56.9	0	0	0	0	113.5	E758 W759 I760	E758-S762 WeakPolarHBondContact O-CB 3.44Å; E758-S762 PolarHBondContact O-N 3.44Å; E758-S762 PolarHBondContact O-OG 3.36Å; W759-S762 PolarHBondContact O-N 2.79Å; I760-S762 VanDerWaalsContact C-N 3.32Å; I760-S762 PolarHBondContact O-N 2.88Å
763	G	73.6	Confident	76.1	Confident	54 Å²	54	51.4 Å²	51.4	56%	0.557	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	89.6	4.6	173.7	0	0	0	0	0	116	W759 I760 I761	W759-G763 PolarHBondContact O-N 2.82Å; I760-G763 PolarHBondContact O-N 2.65Å; I760-G763 VanDerWaalsContact O-N 3.08Å; I761-G763 PolarHBondContact O-N 2.79Å
764	Y	78.6	Confident	76.3	Confident	150 Å²	150	51.1 Å²	51.1	59%	0.588	27%	0.274	S	S	*	.			trans	-66.7	142.9	177.1	-67.9	-84.2	0	0	0	111.6	W759 V766	W759-Y764 HydrophobicContact CB-CD2 4.4Å; W759-Y764 WeakPolarHBondContact O-CB 3.41Å; W759-Y764 PolarHBondContact O-N 3.02Å; Y764-V766 VanDerWaalsContact C-N 3.33Å; Y764-V766 PolarHBondContact O-N 3.18Å
765	A	80.9	Confident	76.4	Confident	25 Å²	25	53.1 Å²	53.1	21%	0.207	28%	0.283	C	S	.	.			trans	-83.2	74.2	-179.4	0	0	0	0	0	111.2	Y767	A765-Y767 HydrophobicContact CB-CE2 3.91Å; A765-Y767 WeakPolarHBondContact O-CD2 3.42Å; A765-Y767 WeakPolarHBondContact O-CE2 3.44Å; A765-Y767 PolarHBondContact O-N 3Å
766	V	86.3	Confident	76.2	Confident	0 Å²	0	52 Å²	52	0%	0	28%	0.276	C	S	.	.			trans	-70	126.7	177.7	-173.6	0	0	0	0	110.3	L756 W759 I760 Y764 L792 V819	L756-V766 HydrophobicContact CD1-CG1 3.77Å; W759-V766 HydrophobicContact CB-CG2 3.93Å; W759-V766 HydrophobicContact CE3-CG2 4.37Å; I760-V766 HydrophobicContact CG1-CB 4.23Å; I760-V766 HydrophobicContact CG1-CG2 3.91Å; Y764-V766 VanDerWaalsContact C-N 3.33Å; Y764-V766 PolarHBondContact O-N 3.18Å; V766-L792 HydrophobicContact CB-CB 4.31Å; V766-L792 HydrophobicContact CG1-CB 4.44Å; V766-L792 HydrophobicContact CG1-CD1 3.84Å; V766-L792 HydrophobicContact CG1-CG 4.24Å; V766-L792 PolarHBondContact O-N 3.18Å; V766-V819 HydrophobicContact CG1-CG1 4Å
767	Y	87.3	Confident	75	Confident	35 Å²	35	60.4 Å²	60.4	14%	0.137	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	142.1	178.2	-69.3	-71.7	0	0	0	112.2	A765 V789 R791 R820 D825	A765-Y767 HydrophobicContact CB-CE2 3.91Å; A765-Y767 WeakPolarHBondContact O-CD2 3.42Å; A765-Y767 WeakPolarHBondContact O-CE2 3.44Å; A765-Y767 PolarHBondContact O-N 3Å; Y767-V789 HydrophobicContact CD1-CG1 4Å; Y767-V789 HydrophobicContact CG-CG1 4.36Å; Y767-R791 HydrophobicContact CD1-CB 3.9Å; Y767-R791 HydrophobicContact CD1-CG 4.25Å; Y767-R791 HydrophobicContact CE1-CB 3.62Å; Y767-R791 HydrophobicContact CE1-CG 3.86Å; Y767-R820 PolarHBondContact O-N 2.96Å; Y767-D825 VanDerWaalsContact CE2-OD1 3.27Å; Y767-D825 WeakPolarHBondContact CE2-OD1 3.43Å; Y767-D825 PolarHBondContact OH-OD1 2.87Å
768	A	88.1	Confident	74.2	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	154.5	169.3	0	0	0	0	0	110.8	I790 L792 V817 R818	A768-I790 PolarHBondContact N-O 3.33Å; A768-I790 PolarHBondContact O-N 2.93Å; A768-L792 HydrophobicContact CB-CD1 4.49Å; A768-L792 HydrophobicContact CB-CD2 3.81Å; A768-L792 HydrophobicContact CB-CG 4.22Å; A768-V817 HydrophobicContact CB-CB 4Å; A768-V817 HydrophobicContact CB-CG2 3.86Å; A768-R818 CarbonylContact C-O 3.55Å; A768-R818 VanDerWaalsContact CA-O 3.28Å; A768-R818 WeakPolarHBondContact CA-O 3.33Å
769	E	84.5	Confident	73.9	Confident	30 Å²	30	67 Å²	67	14%	0.14	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	129.7	-179.2	178.7	167.6	-118.9	0	0	109.5	L771 V817 R818 R820	E769-L771 PolarHBondContact O-N 3.34Å; E769-V817 CarbonylContact O-C 3.58Å; E769-V817 VanDerWaalsContact O-CA 3.22Å; E769-V817 WeakPolarHBondContact O-CA 3.46Å; E769-R818 PolarHBondContact N-O 3.35Å; E769-R818 PolarHBondContact O-N 3.42Å; E769-R818 IonicContact OE2-CZ 3.94Å; E769-R818 IonicContact OE2-NE 3.89Å; E769-R818 IonicContact OE2-NH2 3.67Å; E769-R818 PolarHBondContact OE2-NH2 2.86Å; E769-R820 HydrophobicContact CB-CG 4Å; E769-R820 IonicContact OE1-CZ 3.31Å; E769-R820 IonicContact OE1-NE 3.45Å; E769-R820 PolarHBondContact OE1-NE 3.24Å; E769-R820 IonicContact OE1-NH2 2.71Å; E769-R820 PolarHBondContact OE1-NH2 2.98Å; E769-R820 IonicContact OE2-NE 2.63Å
770	A	82.3	Confident	73.9	Confident	3 Å²	3	68.5 Å²	68.5	3%	0.025	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.2	116.8	178.1	0	0	0	0	0	111.2	W772 F784 K785 A786 G787 D788 I790	A770-W772 VanDerWaalsContact C-N 3.32Å; A770-F784 HydrophobicContact CB-CD2 3.4Å; A770-F784 VanDerWaalsContact CB-CD2 3.4Å; A770-F784 HydrophobicContact CB-CE2 3.57Å; A770-F784 HydrophobicContact CB-CG 4.37Å; A770-K785 WeakPolarHBondContact CB-O 3.31Å; A770-A786 CarbonylContact O-C 3.58Å; A770-A786 WeakPolarHBondContact O-CA 3.48Å; A770-G787 PolarHBondContact O-N 3.44Å; A770-D788 HydrophobicContact CB-CB 4.4Å; A770-D788 PolarHBondContact N-O 3.13Å; A770-I790 HydrophobicContact CB-CD1 4.45Å
771	L	57.4	Low	74.1	Confident	37 Å²	37	69.3 Å²	69.3	19%	0.194	36%	0.361	C	S	.	.	S	Bend	trans	-77.8	-22.2	171.5	-65.6	-179.5	0	0	0	112.1	Y746 E769 F816 R818	Y746-L771 HydrophobicContact CD1-CD1 4.24Å; Y746-L771 HydrophobicContact CE1-CD1 4.32Å; E769-L771 PolarHBondContact O-N 3.34Å; L771-F816 PolarHBondContact N-O 3.28Å; L771-R818 HydrophobicContact CD1-CB 4.04Å; L771-R818 HydrophobicContact CD2-CB 3.85Å; L771-R818 HydrophobicContact CG-CB 3.86Å
772	W	55.5	Low	74.6	Confident	47 Å²	47	62.6 Å²	62.6	18%	0.178	33%	0.327	C	S	.	.	S	Bend	trans	-144.9	151.3	-174.9	-52.6	114	0	0	0	111	V152 A770 H774 F784 F816 Q995 K999	V152-W772 HydrophobicContact CG1-CZ3 4.43Å; A770-W772 VanDerWaalsContact C-N 3.32Å; W772-H774 PolarHBondContact O-N 2.94Å; W772-F784 WeakPolarHBondContact O-CE2 3.33Å; W772-F816 HydrophobicContact CB-CD1 3.79Å; W772-F816 HydrophobicContact CB-CE1 4.19Å; W772-F816 HydrophobicContact CB-CG 4.44Å; W772-F816 PolarHBondContact N-O 3.48Å; W772-Q995 HydrophobicContact CH2-CB 3.99Å; W772-Q995 HydrophobicContact CH2-CG 4.03Å; W772-Q995 HydrophobicContact CZ2-CB 4.2Å; W772-Q995 HydrophobicContact CZ2-CG 4.08Å; W772-K999 HydrophobicContact CH2-CG 4.25Å; W772-K999 VanDerWaalsContact CZ2-CE 3.43Å
773	D	68.6	Low	74.8	Confident	70 Å²	70	61.1 Å²	61.1	37%	0.374	32%	0.319	S	S	.	.			trans	-62.2	118.2	168.3	-87	45.8	0	0	0	111.2	V775 F784 K785 A786	D773-V775 HydrophobicContact CB-CG2 4.15Å; D773-F784 CarbonylContact C-O 3.52Å; D773-F784 WeakPolarHBondContact CA-O 3.31Å; D773-K785 VanDerWaalsContact OD1-CA 3.31Å; D773-K785 WeakPolarHBondContact OD1-CA 3.41Å; D773-K785 IonicContact OD1-NZ 2.75Å; D773-K785 IonicContact OD2-NZ 3.23Å; D773-K785 PolarHBondContact OD2-NZ 2.88Å; D773-A786 PolarHBondContact OD1-N 3.21Å
774	H	70.4	Confident	75.3	Confident	21 Å²	21	59.1 Å²	59.1	10%	0.097	30%	0.295	C	S	.	.	B	Isolated β-bridge	trans	-96.5	91.9	167	-174.2	41.2	0	0	0	109.2	W772 L782 A783 F784 P813 F816	W772-H774 PolarHBondContact O-N 2.94Å; H774-L782 PolarHBondContact CD2-O 2.95Å; H774-A783 WeakPolarHBondContact O-CA 3.48Å; H774-F784 HydrophobicContact CB-CD1 4.17Å; H774-F784 HydrophobicContact CB-CD2 3.85Å; H774-F784 HydrophobicContact CB-CE1 3.84Å; H774-F784 HydrophobicContact CB-CE2 3.49Å; H774-F784 VanDerWaalsContact CB-CE2 3.49Å; H774-F784 HydrophobicContact CB-CG 4.18Å; H774-F784 HydrophobicContact CB-CZ 3.49Å; H774-F784 VanDerWaalsContact CB-CZ 3.49Å; H774-F784 PolarHBondContact N-O 3.19Å; H774-F784 PolarHBondContact O-N 3.49Å; H774-F784 VanDerWaalsContact O-N 3.16Å; H774-P813 VanDerWaalsContact NE2-CD 3.35Å; H774-P813 WeakPolarHBondContact NE2-CD 3.38Å; H774-F816 HydrophobicContact CB-CD1 4.03Å
775	V	69.9	Low	75.1	Confident	110 Å²	110	55.4 Å²	55.4	67%	0.667	28%	0.282	S	S	*	.			trans	-94.1	100.2	180	-174.7	0	0	0	0	110.4	D773	D773-V775 HydrophobicContact CB-CG2 4.15Å
776	T	68.9	Low	74.4	Confident	21 Å²	21	56.7 Å²	56.7	13%	0.129	29%	0.293	C	S	.	.			trans	-109.9	163.5	176.9	-177.8	0	0	0	0	112.7	E778 E781 A783	T776-E778 PolarHBondContact OG1-N 3.43Å; T776-E778 VanDerWaalsContact OG1-N 3.08Å; T776-E781 WeakPolarHBondContact CB-OE2 3.41Å; T776-E781 HydrophobicContact CG2-CB 3.6Å; T776-E781 WeakPolarHBondContact OG1-CB 3.43Å; T776-E781 PolarHBondContact OG1-OE2 2.88Å; T776-A783 HydrophobicContact CG2-CB 3.8Å
777	M	52.1	Low	73.6	Confident	178 Å²	178	58.9 Å²	58.9	88%	0.877	32%	0.315	S	S	*	.			trans	-120.1	1.6	172.8	-64.8	-77.5	151.2	0	0	111.9
778	E	61.3	Low	73.3	Confident	121 Å²	121	60.4 Å²	60.4	57%	0.565	33%	0.326	S	S	*	.			trans	-95.6	137.5	-176	-52.4	-156.7	-177	0	0	109.9	T776 Q780 E781	T776-E778 PolarHBondContact OG1-N 3.43Å; T776-E778 VanDerWaalsContact OG1-N 3.08Å; E778-Q780 PolarHBondContact O-N 2.88Å; E778-E781 HydrophobicContact CB-CB 4.49Å; E778-E781 HydrophobicContact CB-CG 4.33Å; E778-E781 PolarHBondContact O-N 3.17Å
779	E	72.4	Confident	73.3	Confident	163 Å²	163	63.4 Å²	63.4	76%	0.762	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.9	-20.3	-173.2	-65.1	-176.8	161.7	0	0	112.3	R808	E779-R808 PolarHBondContact O-NH2 2.85Å
780	Q	78.3	Confident	73.7	Confident	119 Å²	119	62 Å²	62	56%	0.556	34%	0.337	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-10	179.7	-65.7	66.9	39.5	0	0	113.6	E778 A810 W811	E778-Q780 PolarHBondContact O-N 2.88Å; Q780-A810 WeakPolarHBondContact O-CB 3.13Å; Q780-W811 PolarHBondContact O-N 2.65Å
781	E	86.1	Confident	74.1	Confident	43 Å²	43	65.8 Å²	65.8	20%	0.201	35%	0.351	C	S	.	.	B	Isolated β-bridge	trans	-107.3	145.7	179.3	-67.7	-176	166.2	0	0	111.7	T776 E778 A783 W800 R808 W811	T776-E781 WeakPolarHBondContact CB-OE2 3.41Å; T776-E781 HydrophobicContact CG2-CB 3.6Å; T776-E781 WeakPolarHBondContact OG1-CB 3.43Å; T776-E781 PolarHBondContact OG1-OE2 2.88Å; E778-E781 HydrophobicContact CB-CB 4.49Å; E778-E781 HydrophobicContact CB-CG 4.33Å; E778-E781 PolarHBondContact O-N 3.17Å; E781-A783 PolarHBondContact O-N 3.39Å; E781-W800 HydrophobicContact CG-CH2 4.45Å; E781-W800 HydrophobicContact CG-CZ3 4.22Å; E781-W800 VanDerWaalsContact OE1-CH2 3.28Å; E781-W800 WeakPolarHBondContact OE1-CH2 3.5Å; E781-R808 PolarHBondContact O-NH2 2.78Å; E781-W811 CarbonylContact C-O 2.95Å; E781-W811 VanDerWaalsContact CA-O 3.24Å; E781-W811 WeakPolarHBondContact CA-O 3.38Å
782	L	87	Confident	75.7	Confident	3 Å²	3	64.1 Å²	64.1	2%	0.016	34%	0.343	C	S	.	.			trans	-90.9	100.7	-174.2	-168.3	69.1	0	0	0	110.7	H774 F784 I790 R808 A810 W811 F812	H774-L782 PolarHBondContact CD2-O 2.95Å; L782-F784 HydrophobicContact CB-CD1 4.34Å; L782-F784 HydrophobicContact CD2-CD1 4.14Å; L782-F784 HydrophobicContact CG-CD1 4.13Å; L782-F784 WeakPolarHBondContact O-CD1 3.28Å; L782-F784 WeakPolarHBondContact O-CE1 3.33Å; L782-F784 PolarHBondContact O-N 2.83Å; L782-I790 HydrophobicContact CD2-CD1 4.48Å; L782-I790 HydrophobicContact CD2-CG1 4.31Å; L782-I790 HydrophobicContact CD2-CG2 3.69Å; L782-R808 HydrophobicContact CD1-CB 4.02Å; L782-R808 WeakPolarHBondContact CD1-O 3.45Å; L782-A810 HydrophobicContact CB-CB 3.71Å; L782-A810 HydrophobicContact CD1-CB 4.1Å; L782-A810 VanDerWaalsContact N-CB 3.33Å; L782-W811 PolarHBondContact N-O 3.21Å; L782-F812 HydrophobicContact CB-CB 4.21Å; L782-F812 HydrophobicContact CB-CD1 4.03Å; L782-F812 HydrophobicContact CD2-CD1 3.73Å; L782-F812 HydrophobicContact CD2-CE1 4.03Å
783	A	80.6	Confident	77.3	Confident	53 Å²	53	64.3 Å²	64.3	44%	0.438	35%	0.347	S	S	.	.			trans	-72	123	175.2	0	0	0	0	0	111.5	H774 T776 E781	H774-A783 WeakPolarHBondContact O-CA 3.48Å; T776-A783 HydrophobicContact CG2-CB 3.8Å; E781-A783 PolarHBondContact O-N 3.39Å
784	F	83.8	Confident	78.3	Confident	12 Å²	12	63.4 Å²	63.4	5%	0.053	34%	0.342	C	S	.	.	B	Isolated β-bridge	trans	-147.6	169.2	178	56.6	-108	0	0	0	112.7	A770 W772 D773 H774 L782 D788 I790 F812 F816 V817	A770-F784 HydrophobicContact CB-CD2 3.4Å; A770-F784 VanDerWaalsContact CB-CD2 3.4Å; A770-F784 HydrophobicContact CB-CE2 3.57Å; A770-F784 HydrophobicContact CB-CG 4.37Å; W772-F784 WeakPolarHBondContact O-CE2 3.33Å; D773-F784 CarbonylContact C-O 3.52Å; D773-F784 WeakPolarHBondContact CA-O 3.31Å; H774-F784 HydrophobicContact CB-CD1 4.17Å; H774-F784 HydrophobicContact CB-CD2 3.85Å; H774-F784 HydrophobicContact CB-CE1 3.84Å; H774-F784 HydrophobicContact CB-CE2 3.49Å; H774-F784 VanDerWaalsContact CB-CE2 3.49Å; H774-F784 HydrophobicContact CB-CG 4.18Å; H774-F784 HydrophobicContact CB-CZ 3.49Å; H774-F784 VanDerWaalsContact CB-CZ 3.49Å; H774-F784 PolarHBondContact N-O 3.19Å; H774-F784 PolarHBondContact O-N 3.49Å; H774-F784 VanDerWaalsContact O-N 3.16Å; L782-F784 HydrophobicContact CB-CD1 4.34Å; L782-F784 HydrophobicContact CD2-CD1 4.14Å; L782-F784 HydrophobicContact CG-CD1 4.13Å; L782-F784 WeakPolarHBondContact O-CD1 3.28Å; L782-F784 WeakPolarHBondContact O-CE1 3.33Å; L782-F784 PolarHBondContact O-N 2.83Å; F784-D788 WeakPolarHBondContact CA-OD2 3.48Å; F784-D788 HydrophobicContact CB-CB 4.13Å; F784-D788 WeakPolarHBondContact CB-OD2 3.38Å; F784-I790 HydrophobicContact CB-CD1 4.41Å; F784-I790 HydrophobicContact CD1-CD1 3.41Å; F784-I790 VanDerWaalsContact CD1-CD1 3.41Å; F784-I790 HydrophobicContact CD1-CG1 4.34Å; F784-I790 HydrophobicContact CD2-CD1 4.1Å; F784-I790 HydrophobicContact CE1-CD1 3.45Å; F784-I790 VanDerWaalsContact CE1-CD1 3.45Å; F784-I790 HydrophobicContact CE2-CD1 4.14Å; F784-I790 HydrophobicContact CG-CD1 3.74Å; F784-I790 HydrophobicContact CZ-CD1 3.83Å; F784-F812 HydrophobicContact CE1-CB 3.54Å; F784-F812 HydrophobicContact CE1-CD1 4.34Å; F784-F812 AromaticContact CE1-CD2 3.92Å; F784-F812 HydrophobicContact CE1-CD2 3.92Å; F784-F812 AromaticContact CE1-CG 3.68Å; F784-F812 HydrophobicContact CE1-CG 3.68Å; F784-F812 HydrophobicContact CZ-CB 4.17Å; F784-F812 HydrophobicContact CZ-CD2 4.12Å; F784-F812 HydrophobicContact CZ-CG 4.3Å; F784-F816 HydrophobicContact CE2-CB 4.24Å; F784-F816 HydrophobicContact CZ-CB 4.11Å; F784-V817 HydrophobicContact CE2-CG1 4.25Å; F784-V817 HydrophobicContact CZ-CG1 3.82Å
785	K	74.6	Confident	79	Confident	73 Å²	73	62.4 Å²	62.4	32%	0.317	34%	0.337	S	S	.	.			trans	-113.8	156.4	-178.8	-46.7	-164.4	106.7	-59.2	0	111.1	A770 D773 G787 D788	A770-K785 WeakPolarHBondContact CB-O 3.31Å; D773-K785 VanDerWaalsContact OD1-CA 3.31Å; D773-K785 WeakPolarHBondContact OD1-CA 3.41Å; D773-K785 IonicContact OD1-NZ 2.75Å; D773-K785 IonicContact OD2-NZ 3.23Å; D773-K785 PolarHBondContact OD2-NZ 2.88Å; K785-G787 PolarHBondContact O-N 2.87Å; K785-D788 PolarHBondContact N-OD2 2.72Å; K785-D788 VanDerWaalsContact O-CB 3.28Å; K785-D788 WeakPolarHBondContact O-CB 3.34Å; K785-D788 PolarHBondContact O-N 2.76Å
786	A	67.4	Low	79.5	Confident	52 Å²	52	61 Å²	61	43%	0.43	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59	128.6	172.6	0	0	0	0	0	110.9	A770 D773	A770-A786 CarbonylContact O-C 3.58Å; A770-A786 WeakPolarHBondContact O-CA 3.48Å; D773-A786 PolarHBondContact OD1-N 3.21Å
787	G	68.4	Low	80	Confident	45 Å²	45	64.5 Å²	64.5	46%	0.464	35%	0.347	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.5	-11.7	-171.8	0	0	0	0	0	115.2	A770 K785	A770-G787 PolarHBondContact O-N 3.44Å; K785-G787 PolarHBondContact O-N 2.87Å
788	D	82.1	Confident	81	Confident	67 Å²	67	60.4 Å²	60.4	36%	0.358	32%	0.324	S	S	.	.			trans	-67.2	141	174.7	-70.7	-7.1	0	0	0	110.8	A770 F784 K785	A770-D788 HydrophobicContact CB-CB 4.4Å; A770-D788 PolarHBondContact N-O 3.13Å; F784-D788 WeakPolarHBondContact CA-OD2 3.48Å; F784-D788 HydrophobicContact CB-CB 4.13Å; F784-D788 WeakPolarHBondContact CB-OD2 3.38Å; K785-D788 PolarHBondContact N-OD2 2.72Å; K785-D788 VanDerWaalsContact O-CB 3.28Å; K785-D788 WeakPolarHBondContact O-CB 3.34Å; K785-D788 PolarHBondContact O-N 2.76Å
789	V	88.5	Confident	81.6	Confident	63 Å²	63	59.2 Å²	59.2	38%	0.382	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	129.9	177.1	-165.1	0	0	0	0	109.6	Y767	Y767-V789 HydrophobicContact CD1-CG1 4Å; Y767-V789 HydrophobicContact CG-CG1 4.36Å
790	I	91.7	Very high	82.3	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	124.6	-174.9	-56.6	157.7	0	0	0	107.8	A768 A770 L782 F784 R804 F812 V817	A768-I790 PolarHBondContact N-O 3.33Å; A768-I790 PolarHBondContact O-N 2.93Å; A770-I790 HydrophobicContact CB-CD1 4.45Å; L782-I790 HydrophobicContact CD2-CD1 4.48Å; L782-I790 HydrophobicContact CD2-CG1 4.31Å; L782-I790 HydrophobicContact CD2-CG2 3.69Å; F784-I790 HydrophobicContact CB-CD1 4.41Å; F784-I790 HydrophobicContact CD1-CD1 3.41Å; F784-I790 VanDerWaalsContact CD1-CD1 3.41Å; F784-I790 HydrophobicContact CD1-CG1 4.34Å; F784-I790 HydrophobicContact CD2-CD1 4.1Å; F784-I790 HydrophobicContact CE1-CD1 3.45Å; F784-I790 VanDerWaalsContact CE1-CD1 3.45Å; F784-I790 HydrophobicContact CE2-CD1 4.14Å; F784-I790 HydrophobicContact CG-CD1 3.74Å; F784-I790 HydrophobicContact CZ-CD1 3.83Å; I790-R804 WeakPolarHBondContact CA-O 3.14Å; I790-F812 HydrophobicContact CG2-CD1 4.45Å; I790-F812 HydrophobicContact CG2-CE1 3.59Å; I790-F812 HydrophobicContact CG2-CZ 3.72Å; I790-V817 HydrophobicContact CD1-CG1 3.79Å
791	R	91.8	Very high	83	Confident	82 Å²	82	50.1 Å²	50.1	31%	0.309	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	125.9	172.2	-172.4	171.4	168	158.2	-0.6	109.3	Y767 G803 R804	Y767-R791 HydrophobicContact CD1-CB 3.9Å; Y767-R791 HydrophobicContact CD1-CG 4.25Å; Y767-R791 HydrophobicContact CE1-CB 3.62Å; Y767-R791 HydrophobicContact CE1-CG 3.86Å; R791-G803 CarbonylContact O-C 3.54Å; R791-G803 WeakPolarHBondContact O-CA 3.27Å; R791-R804 HydrophobicContact CB-CB 4.4Å; R791-R804 PolarHBondContact N-O 2.96Å; R791-R804 PolarHBondContact O-N 3.17Å
792	L	91.3	Very high	83.2	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.016	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.5	143.3	173.4	-55.4	-169.2	0	0	0	110.2	L756 I760 V766 A768 W801 F812 V819	L756-L792 HydrophobicContact CD2-CD1 4.13Å; I760-L792 HydrophobicContact CD1-CB 3.79Å; I760-L792 HydrophobicContact CG1-CB 4.45Å; V766-L792 HydrophobicContact CB-CB 4.31Å; V766-L792 HydrophobicContact CG1-CB 4.44Å; V766-L792 HydrophobicContact CG1-CD1 3.84Å; V766-L792 HydrophobicContact CG1-CG 4.24Å; V766-L792 PolarHBondContact O-N 3.18Å; A768-L792 HydrophobicContact CB-CD1 4.49Å; A768-L792 HydrophobicContact CB-CD2 3.81Å; A768-L792 HydrophobicContact CB-CG 4.22Å; L792-W801 HydrophobicContact CD1-CE3 3.93Å; L792-W801 HydrophobicContact CD1-CZ3 4.02Å; L792-W801 HydrophobicContact CD2-CE3 3.84Å; L792-W801 HydrophobicContact CD2-CZ3 4.46Å; L792-F812 HydrophobicContact CD2-CE2 4.45Å; L792-F812 HydrophobicContact CD2-CZ 3.71Å; L792-V819 HydrophobicContact CD1-CG2 4.19Å
793	L	89	Confident	83.5	Confident	51 Å²	51	51.3 Å²	51.3	27%	0.267	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	-25	-179.6	-67.7	178.5	0	0	0	112.5	I760 W802 R804 E809	I760-L793 VanDerWaalsContact CG2-O 3.26Å; I760-L793 WeakPolarHBondContact CG2-O 3.19Å; L793-W802 PolarHBondContact N-O 3.38Å; L793-R804 HydrophobicContact CD1-CB 4.07Å; L793-E809 HydrophobicContact CD1-CG 3.73Å
794	D	88.3	Confident	84	Confident	51 Å²	51	54 Å²	54	27%	0.273	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	127.4	168.3	-174.1	-9.8	0	0	0	108.3	S796 W801 W802	D794-S796 WeakPolarHBondContact OD1-CB 3.45Å; D794-S796 PolarHBondContact OD1-N 3.11Å; D794-S796 PolarHBondContact OD1-OG 2.92Å; D794-S796 PolarHBondContact OD2-OG 2.84Å; D794-W801 CarbonylContact O-C 3.57Å; D794-W801 WeakPolarHBondContact O-CA 3.45Å; D794-W801 WeakPolarHBondContact O-CB 3.49Å; D794-W802 HydrophobicContact CB-CB 3.77Å; D794-W802 PolarHBondContact N-O 3.15Å; D794-W802 VanDerWaalsContact N-O 3.08Å; D794-W802 PolarHBondContact O-N 3.26Å
795	A	86.3	Confident	84.1	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	19.1	175.8	0	0	0	0	0	112.5	L756 N757 I760 H797 W801	L756-A795 HydrophobicContact CD2-CB 3.76Å; L756-A795 HydrophobicContact CG-CB 4.35Å; N757-A795 PolarHBondContact ND2-O 3.35Å; N757-A795 VanDerWaalsContact OD1-CA 3.31Å; N757-A795 WeakPolarHBondContact OD1-CA 3.36Å; N757-A795 PolarHBondContact OD1-N 3.35Å; I760-A795 HydrophobicContact CD1-CB 3.9Å; A795-H797 PolarHBondContact O-N 3.02Å; A795-W801 VanDerWaalsContact CA-CD1 3.48Å; A795-W801 HydrophobicContact CB-CD2 4.2Å; A795-W801 HydrophobicContact CB-CG 4.1Å
796	S	80.8	Confident	84.4	Confident	80 Å²	80	54.2 Å²	54.2	56%	0.559	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.6	-19	-172.4	60.7	0	0	0	0	114.2	N757 D794	N757-S796 PolarHBondContact OD1-N 3.32Å; D794-S796 WeakPolarHBondContact OD1-CB 3.45Å; D794-S796 PolarHBondContact OD1-N 3.11Å; D794-S796 PolarHBondContact OD1-OG 2.92Å; D794-S796 PolarHBondContact OD2-OG 2.84Å
797	H	79.1	Confident	84.8	Confident	94 Å²	94	60.2 Å²	60.2	44%	0.435	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	125.2	177.5	-175.8	-78	0	0	0	111.6	A795 D799 W800 W801	A795-H797 PolarHBondContact O-N 3.02Å; H797-D799 VanDerWaalsContact C-N 3.35Å; H797-D799 PolarHBondContact ND1-N 3.3Å; H797-D799 PolarHBondContact O-N 3.31Å; H797-W800 WeakPolarHBondContact CB-O 3.11Å; H797-W800 PolarHBondContact ND1-N 2.91Å; H797-W800 PolarHBondContact O-N 3.4Å; H797-W801 PolarHBondContact O-NE1 3.14Å
798	K	72.4	Confident	85.4	Confident	92 Å²	92	63 Å²	63	40%	0.4	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-45.4	-170.3	-166.9	160.4	-173.6	157.6	0	114.5	D742 S814	D742-K798 IonicContact OD1-NZ 2.76Å; D742-K798 PolarHBondContact OD1-NZ 3.05Å; K798-S814 PolarHBondContact O-OG 3.03Å
799	D	74.4	Confident	85.9	Confident	97 Å²	97	63.6 Å²	63.6	52%	0.519	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-9.5	-174	-57.4	-54.1	0	0	0	114.9	H797 P813 S814	H797-D799 VanDerWaalsContact C-N 3.35Å; H797-D799 PolarHBondContact ND1-N 3.3Å; H797-D799 PolarHBondContact O-N 3.31Å; D799-P813 CarbonylContact O-C 3.58Å; D799-P813 VanDerWaalsContact O-CA 3.23Å; D799-P813 WeakPolarHBondContact O-CA 3.39Å; D799-S814 VanDerWaalsContact C-OG 3.31Å; D799-S814 WeakPolarHBondContact CA-OG 3.36Å; D799-S814 PolarHBondContact O-N 3.34Å; D799-S814 PolarHBondContact O-OG 3.1Å
800	W	86.8	Confident	86	Confident	89 Å²	89	60.6 Å²	60.6	34%	0.337	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	124.6	-169.2	-76.7	90.2	0	0	0	110.9	E781 H797 W811 F812	E781-W800 HydrophobicContact CG-CH2 4.45Å; E781-W800 HydrophobicContact CG-CZ3 4.22Å; E781-W800 VanDerWaalsContact OE1-CH2 3.28Å; E781-W800 WeakPolarHBondContact OE1-CH2 3.5Å; H797-W800 WeakPolarHBondContact CB-O 3.11Å; H797-W800 PolarHBondContact ND1-N 2.91Å; H797-W800 PolarHBondContact O-N 3.4Å; W800-W811 HydrophobicContact CB-CE3 4.24Å; W800-W811 HydrophobicContact CE3-CB 4.02Å; W800-W811 HydrophobicContact CZ3-CB 4.37Å; W800-W811 WeakPolarHBondContact O-CZ3 3.43Å; W800-F812 CarbonylContact C-O 3.56Å; W800-F812 WeakPolarHBondContact CA-O 3.26Å
801	W	92.3	Very high	86	Confident	2 Å²	2	65 Å²	65	1%	0.008	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	149.4	-178.3	-62.5	-18.2	0	0	0	110.9	L747 L753 L756 L792 D794 A795 H797 W811 F812 V817 V819	L747-W801 HydrophobicContact CD2-CH2 3.85Å; L747-W801 HydrophobicContact CD2-CZ2 4.35Å; L753-W801 HydrophobicContact CD1-CZ2 3.84Å; L756-W801 HydrophobicContact CD2-CH2 4.13Å; L756-W801 HydrophobicContact CD2-CZ2 4.08Å; L792-W801 HydrophobicContact CD1-CE3 3.93Å; L792-W801 HydrophobicContact CD1-CZ3 4.02Å; L792-W801 HydrophobicContact CD2-CE3 3.84Å; L792-W801 HydrophobicContact CD2-CZ3 4.46Å; D794-W801 CarbonylContact O-C 3.57Å; D794-W801 WeakPolarHBondContact O-CA 3.45Å; D794-W801 WeakPolarHBondContact O-CB 3.49Å; A795-W801 VanDerWaalsContact CA-CD1 3.48Å; A795-W801 HydrophobicContact CB-CD2 4.2Å; A795-W801 HydrophobicContact CB-CG 4.1Å; H797-W801 PolarHBondContact O-NE1 3.14Å; W801-W811 CarbonylContact O-C 3.48Å; W801-W811 WeakPolarHBondContact O-CA 3.18Å; W801-F812 HydrophobicContact CB-CE2 4.12Å; W801-F812 HydrophobicContact CB-CZ 4.01Å; W801-F812 HydrophobicContact CE3-CE2 4.3Å; W801-F812 PolarHBondContact N-O 3.02Å; W801-F812 WeakPolarHBondContact O-CD1 3.32Å; W801-F812 PolarHBondContact O-N 3.31Å; W801-V817 HydrophobicContact CE3-CG2 3.84Å; W801-V817 HydrophobicContact CZ3-CG2 3.62Å; W801-V819 HydrophobicContact CH2-CG2 3.92Å; W801-V819 HydrophobicContact CZ3-CG2 3.88Å
802	W	91.5	Very high	85.9	Confident	70 Å²	70	61 Å²	61	27%	0.265	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	137.9	168.5	-170.4	-106.4	0	0	0	108.4	L793 D794 E809 A810 W811	L793-W802 PolarHBondContact N-O 3.38Å; D794-W802 HydrophobicContact CB-CB 3.77Å; D794-W802 PolarHBondContact N-O 3.15Å; D794-W802 VanDerWaalsContact N-O 3.08Å; D794-W802 PolarHBondContact O-N 3.26Å; W802-E809 HydrophobicContact CZ2-CB 3.66Å; W802-E809 PolarHBondContact NE1-OE2 3.32Å; W802-E809 VanDerWaalsContact NE1-OE2 3.15Å; W802-A810 VanDerWaalsContact CZ3-C 3.49Å; W802-W811 HydrophobicContact CB-CD2 4.44Å; W802-W811 HydrophobicContact CB-CE3 4.19Å; W802-W811 HydrophobicContact CB-CH2 4.11Å; W802-W811 HydrophobicContact CB-CZ2 4.38Å; W802-W811 HydrophobicContact CB-CZ3 4.03Å; W802-W811 HydrophobicContact CE3-CB 4.29Å; W802-W811 AromaticContact CE3-CD1 3.45Å; W802-W811 VanDerWaalsContact CE3-CD1 3.45Å; W802-W811 AromaticContact CE3-CD2 3.76Å; W802-W811 HydrophobicContact CE3-CD2 3.76Å; W802-W811 AromaticContact CE3-CE2 3.64Å; W802-W811 AromaticContact CE3-CG 3.6Å; W802-W811 HydrophobicContact CE3-CG 3.6Å; W802-W811 HydrophobicContact CE3-CZ2 4.33Å; W802-W811 VanDerWaalsContact CE3-N 3.3Å; W802-W811 AromaticContact CE3-NE1 3.45Å; W802-W811 AromaticContact CZ3-CD1 3.42Å; W802-W811 VanDerWaalsContact CZ3-CD1 3.42Å; W802-W811 HydrophobicContact CZ3-CD2 4.49Å; W802-W811 AromaticContact CZ3-CG 3.96Å; W802-W811 HydrophobicContact CZ3-CG 3.96Å; W802-W811 AromaticContact CZ3-NE1 3.6Å
803	G	91.9	Very high	85.5	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-168.1	172.1	177.4	0	0	0	0	0	113.6	R791 E809 A810	R791-G803 CarbonylContact O-C 3.54Å; R791-G803 WeakPolarHBondContact O-CA 3.27Å; G803-E809 WeakPolarHBondContact O-CA 3.41Å; G803-A810 PolarHBondContact N-O 2.86Å; G803-A810 PolarHBondContact O-N 3.36Å
804	R	91.9	Very high	85.2	Confident	109 Å²	109	59.2 Å²	59.2	41%	0.411	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	120.1	-173.7	-163.9	-177	-66.8	163.1	-0.5	110.9	I790 R791 L793 G806 R808 E809	I790-R804 WeakPolarHBondContact CA-O 3.14Å; R791-R804 HydrophobicContact CB-CB 4.4Å; R791-R804 PolarHBondContact N-O 2.96Å; R791-R804 PolarHBondContact O-N 3.17Å; L793-R804 HydrophobicContact CD1-CB 4.07Å; R804-G806 WeakPolarHBondContact CG-O 3.39Å; R804-R808 CarbonylContact C-O 3.55Å; R804-R808 VanDerWaalsContact CA-O 3.3Å; R804-R808 WeakPolarHBondContact CA-O 3.08Å; R804-E809 HydrophobicContact CB-CG 3.91Å; R804-E809 HydrophobicContact CG-CG 3.8Å; R804-E809 IonicContact CZ-OE1 3.71Å; R804-E809 IonicContact NE-OE1 3.81Å; R804-E809 PolarHBondContact NE-OE1 3.18Å; R804-E809 IonicContact NH2-OE1 2.7Å; R804-E809 PolarHBondContact NH2-OE1 3.03Å
805	G	85.4	Confident	84.6	Confident	25 Å²	25	58.7 Å²	58.7	26%	0.258	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	107.6	170.4	0	0	0	0	0	109.5	D807 R808	G805-D807 PolarHBondContact O-N 3.16Å; G805-R808 PolarHBondContact N-O 2.88Å; G805-R808 PolarHBondContact O-N 2.83Å
806	G	80.4	Confident	83.9	Confident	65 Å²	65	61.8 Å²	61.8	67%	0.67	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.8	-131	-169.2	0	0	0	0	0	111.9	R804 R808	R804-G806 WeakPolarHBondContact CG-O 3.39Å; G806-R808 VanDerWaalsContact C-N 3.26Å; G806-R808 PolarHBondContact O-N 3.28Å
807	D	75.8	Confident	83.9	Confident	179 Å²	179	58 Å²	58	96%	0.957	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	2.3	-179.1	-60.8	-26.9	0	0	0	114.6	G805	G805-D807 PolarHBondContact O-N 3.16Å
808	R	82.9	Confident	84	Confident	103 Å²	103	56.4 Å²	56.4	39%	0.389	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	136.5	-176.2	-75.1	-171.5	67.3	-144.2	-3.5	112.7	E779 E781 L782 R804 G805 G806	E779-R808 PolarHBondContact O-NH2 2.85Å; E781-R808 PolarHBondContact O-NH2 2.78Å; L782-R808 HydrophobicContact CD1-CB 4.02Å; L782-R808 WeakPolarHBondContact CD1-O 3.45Å; R804-R808 CarbonylContact C-O 3.55Å; R804-R808 VanDerWaalsContact CA-O 3.3Å; R804-R808 WeakPolarHBondContact CA-O 3.08Å; G805-R808 PolarHBondContact N-O 2.88Å; G805-R808 PolarHBondContact O-N 2.83Å; G806-R808 VanDerWaalsContact C-N 3.26Å; G806-R808 PolarHBondContact O-N 3.28Å
809	E	92.3	Very high	84.5	Confident	79 Å²	79	52.7 Å²	52.7	37%	0.369	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.6	135.4	163.2	-65.1	-178.6	-165.4	0	0	109.8	L793 W802 G803 R804	L793-E809 HydrophobicContact CD1-CG 3.73Å; W802-E809 HydrophobicContact CZ2-CB 3.66Å; W802-E809 PolarHBondContact NE1-OE2 3.32Å; W802-E809 VanDerWaalsContact NE1-OE2 3.15Å; G803-E809 WeakPolarHBondContact O-CA 3.41Å; R804-E809 HydrophobicContact CB-CG 3.91Å; R804-E809 HydrophobicContact CG-CG 3.8Å; R804-E809 IonicContact CZ-OE1 3.71Å; R804-E809 IonicContact NE-OE1 3.81Å; R804-E809 PolarHBondContact NE-OE1 3.18Å; R804-E809 IonicContact NH2-OE1 2.7Å; R804-E809 PolarHBondContact NH2-OE1 3.03Å
810	A	90.6	Very high	84.7	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.5	168.8	177.2	0	0	0	0	0	111.7	Q780 L782 W802 G803	Q780-A810 WeakPolarHBondContact O-CB 3.13Å; L782-A810 HydrophobicContact CB-CB 3.71Å; L782-A810 HydrophobicContact CD1-CB 4.1Å; L782-A810 VanDerWaalsContact N-CB 3.33Å; W802-A810 VanDerWaalsContact CZ3-C 3.49Å; G803-A810 PolarHBondContact N-O 2.86Å; G803-A810 PolarHBondContact O-N 3.36Å
811	W	91.3	Very high	83.2	Confident	93 Å²	93	51.1 Å²	51.1	35%	0.352	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	148	174.3	-73.1	105.1	0	0	0	111.3	Q780 E781 L782 W800 W801 W802	Q780-W811 PolarHBondContact O-N 2.65Å; E781-W811 CarbonylContact C-O 2.95Å; E781-W811 VanDerWaalsContact CA-O 3.24Å; E781-W811 WeakPolarHBondContact CA-O 3.38Å; L782-W811 PolarHBondContact N-O 3.21Å; W800-W811 HydrophobicContact CB-CE3 4.24Å; W800-W811 HydrophobicContact CE3-CB 4.02Å; W800-W811 HydrophobicContact CZ3-CB 4.37Å; W800-W811 WeakPolarHBondContact O-CZ3 3.43Å; W801-W811 CarbonylContact O-C 3.48Å; W801-W811 WeakPolarHBondContact O-CA 3.18Å; W802-W811 HydrophobicContact CB-CD2 4.44Å; W802-W811 HydrophobicContact CB-CE3 4.19Å; W802-W811 HydrophobicContact CB-CH2 4.11Å; W802-W811 HydrophobicContact CB-CZ2 4.38Å; W802-W811 HydrophobicContact CB-CZ3 4.03Å; W802-W811 HydrophobicContact CE3-CB 4.29Å; W802-W811 AromaticContact CE3-CD1 3.45Å; W802-W811 VanDerWaalsContact CE3-CD1 3.45Å; W802-W811 AromaticContact CE3-CD2 3.76Å; W802-W811 HydrophobicContact CE3-CD2 3.76Å; W802-W811 AromaticContact CE3-CE2 3.64Å; W802-W811 AromaticContact CE3-CG 3.6Å; W802-W811 HydrophobicContact CE3-CG 3.6Å; W802-W811 HydrophobicContact CE3-CZ2 4.33Å; W802-W811 VanDerWaalsContact CE3-N 3.3Å; W802-W811 AromaticContact CE3-NE1 3.45Å; W802-W811 AromaticContact CZ3-CD1 3.42Å; W802-W811 VanDerWaalsContact CZ3-CD1 3.42Å; W802-W811 HydrophobicContact CZ3-CD2 4.49Å; W802-W811 AromaticContact CZ3-CG 3.96Å; W802-W811 HydrophobicContact CZ3-CG 3.96Å; W802-W811 AromaticContact CZ3-NE1 3.6Å
812	F	89.2	Confident	81.5	Confident	0 Å²	0	53.3 Å²	53.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.3	156.7	170	59.3	-89.9	0	0	0	112.1	L782 F784 I790 L792 W800 W801 S814 V817	L782-F812 HydrophobicContact CB-CB 4.21Å; L782-F812 HydrophobicContact CB-CD1 4.03Å; L782-F812 HydrophobicContact CD2-CD1 3.73Å; L782-F812 HydrophobicContact CD2-CE1 4.03Å; F784-F812 HydrophobicContact CE1-CB 3.54Å; F784-F812 HydrophobicContact CE1-CD1 4.34Å; F784-F812 AromaticContact CE1-CD2 3.92Å; F784-F812 HydrophobicContact CE1-CD2 3.92Å; F784-F812 AromaticContact CE1-CG 3.68Å; F784-F812 HydrophobicContact CE1-CG 3.68Å; F784-F812 HydrophobicContact CZ-CB 4.17Å; F784-F812 HydrophobicContact CZ-CD2 4.12Å; F784-F812 HydrophobicContact CZ-CG 4.3Å; I790-F812 HydrophobicContact CG2-CD1 4.45Å; I790-F812 HydrophobicContact CG2-CE1 3.59Å; I790-F812 HydrophobicContact CG2-CZ 3.72Å; L792-F812 HydrophobicContact CD2-CE2 4.45Å; L792-F812 HydrophobicContact CD2-CZ 3.71Å; W800-F812 CarbonylContact C-O 3.56Å; W800-F812 WeakPolarHBondContact CA-O 3.26Å; W801-F812 HydrophobicContact CB-CE2 4.12Å; W801-F812 HydrophobicContact CB-CZ 4.01Å; W801-F812 HydrophobicContact CE3-CE2 4.3Å; W801-F812 PolarHBondContact N-O 3.02Å; W801-F812 WeakPolarHBondContact O-CD1 3.32Å; W801-F812 PolarHBondContact O-N 3.31Å; F812-S814 PolarHBondContact O-N 2.92Å; F812-V817 HydrophobicContact CD2-CG1 3.93Å; F812-V817 HydrophobicContact CE2-CB 4.44Å; F812-V817 HydrophobicContact CE2-CG1 3.67Å; F812-V817 HydrophobicContact CE2-CG2 3.86Å
813	P	82.9	Confident	80	Confident	12 Å²	12	52.5 Å²	52.5	8%	0.078	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	127.4	-179.8	25.6	-32.5	0	0	0	111.9	H774 D799 S815 F816	H774-P813 VanDerWaalsContact NE2-CD 3.35Å; H774-P813 WeakPolarHBondContact NE2-CD 3.38Å; D799-P813 CarbonylContact O-C 3.58Å; D799-P813 VanDerWaalsContact O-CA 3.23Å; D799-P813 WeakPolarHBondContact O-CA 3.39Å; P813-S815 PolarHBondContact O-N 3.13Å; P813-F816 HydrophobicContact CB-CD2 3.95Å; P813-F816 HydrophobicContact CG-CB 4.07Å; P813-F816 HydrophobicContact CG-CD2 3.49Å; P813-F816 VanDerWaalsContact CG-CD2 3.49Å; P813-F816 HydrophobicContact CG-CE2 4.06Å; P813-F816 HydrophobicContact CG-CG 3.78Å; P813-F816 PolarHBondContact O-N 3.41Å
814	S	83.8	Confident	77.9	Confident	3 Å²	3	58.3 Å²	58.3	2%	0.021	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-57.3	-37.1	179.9	59.7	0	0	0	0	112.3	K798 D799 F812 F816 V817	K798-S814 PolarHBondContact O-OG 3.03Å; D799-S814 VanDerWaalsContact C-OG 3.31Å; D799-S814 WeakPolarHBondContact CA-OG 3.36Å; D799-S814 PolarHBondContact O-N 3.34Å; D799-S814 PolarHBondContact O-OG 3.1Å; F812-S814 PolarHBondContact O-N 2.92Å; S814-F816 PolarHBondContact O-N 3.36Å; S814-F816 VanDerWaalsContact O-N 3.08Å; S814-V817 VanDerWaalsContact O-CG2 3.28Å; S814-V817 WeakPolarHBondContact O-CG2 3.32Å; S814-V817 PolarHBondContact O-N 2.84Å; S814-V817 VanDerWaalsContact O-N 3.09Å
815	S	73.9	Confident	75.4	Confident	40 Å²	40	57.7 Å²	57.7	28%	0.28	30%	0.301	S	S	.	.	G	3₁₀ helix	trans	-65	-5.9	176.2	58.2	0	0	0	0	115.9	Y746 P813	Y746-S815 WeakPolarHBondContact CE1-O 3.4Å; P813-S815 PolarHBondContact O-N 3.13Å
816	F	71.5	Confident	73.3	Confident	66 Å²	66	62 Å²	62	29%	0.289	33%	0.327	S	S	.	.	G	3₁₀ helix	trans	-94.7	-7.4	173.8	-82.2	-123	0	0	0	113.1	L771 W772 H774 F784 P813 S814	L771-F816 PolarHBondContact N-O 3.28Å; W772-F816 HydrophobicContact CB-CD1 3.79Å; W772-F816 HydrophobicContact CB-CE1 4.19Å; W772-F816 HydrophobicContact CB-CG 4.44Å; W772-F816 PolarHBondContact N-O 3.48Å; H774-F816 HydrophobicContact CB-CD1 4.03Å; F784-F816 HydrophobicContact CE2-CB 4.24Å; F784-F816 HydrophobicContact CZ-CB 4.11Å; P813-F816 HydrophobicContact CB-CD2 3.95Å; P813-F816 HydrophobicContact CG-CB 4.07Å; P813-F816 HydrophobicContact CG-CD2 3.49Å; P813-F816 VanDerWaalsContact CG-CD2 3.49Å; P813-F816 HydrophobicContact CG-CE2 4.06Å; P813-F816 HydrophobicContact CG-CG 3.78Å; P813-F816 PolarHBondContact O-N 3.41Å; S814-F816 PolarHBondContact O-N 3.36Å; S814-F816 VanDerWaalsContact O-N 3.08Å
817	V	80.9	Confident	71.4	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	171.2	-177.9	-53.8	0	0	0	0	112.1	Y746 A768 E769 F784 I790 W801 F812 S814	Y746-V817 WeakPolarHBondContact CD1-O 3.33Å; A768-V817 HydrophobicContact CB-CB 4Å; A768-V817 HydrophobicContact CB-CG2 3.86Å; E769-V817 CarbonylContact O-C 3.58Å; E769-V817 VanDerWaalsContact O-CA 3.22Å; E769-V817 WeakPolarHBondContact O-CA 3.46Å; F784-V817 HydrophobicContact CE2-CG1 4.25Å; F784-V817 HydrophobicContact CZ-CG1 3.82Å; I790-V817 HydrophobicContact CD1-CG1 3.79Å; W801-V817 HydrophobicContact CE3-CG2 3.84Å; W801-V817 HydrophobicContact CZ3-CG2 3.62Å; F812-V817 HydrophobicContact CD2-CG1 3.93Å; F812-V817 HydrophobicContact CE2-CB 4.44Å; F812-V817 HydrophobicContact CE2-CG1 3.67Å; F812-V817 HydrophobicContact CE2-CG2 3.86Å; S814-V817 VanDerWaalsContact O-CG2 3.28Å; S814-V817 WeakPolarHBondContact O-CG2 3.32Å; S814-V817 PolarHBondContact O-N 2.84Å; S814-V817 VanDerWaalsContact O-N 3.09Å
818	R	82	Confident	69.4	Low	61 Å²	61	61.2 Å²	61.2	23%	0.23	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	126.6	171.5	173.3	-179.3	69.2	172.4	12.4	107.9	A768 E769 L771 R820 E861	A768-R818 CarbonylContact C-O 3.55Å; A768-R818 VanDerWaalsContact CA-O 3.28Å; A768-R818 WeakPolarHBondContact CA-O 3.33Å; E769-R818 PolarHBondContact N-O 3.35Å; E769-R818 PolarHBondContact O-N 3.42Å; E769-R818 IonicContact OE2-CZ 3.94Å; E769-R818 IonicContact OE2-NE 3.89Å; E769-R818 IonicContact OE2-NH2 3.67Å; E769-R818 PolarHBondContact OE2-NH2 2.86Å; L771-R818 HydrophobicContact CD1-CB 4.04Å; L771-R818 HydrophobicContact CD2-CB 3.85Å; L771-R818 HydrophobicContact CG-CB 3.86Å; R818-R820 PolarHBondContact O-N 3.47Å; R818-E861 IonicContact CZ-OE1 2.73Å; R818-E861 IonicContact CZ-OE2 2.75Å; R818-E861 IonicContact NH1-OE1 2.78Å; R818-E861 PolarHBondContact NH1-OE1 3.4Å; R818-E861 IonicContact NH1-OE2 3.24Å; R818-E861 PolarHBondContact NH1-OE2 3.33Å
819	V	83.3	Confident	67.2	Low	14 Å²	14	65 Å²	65	9%	0.085	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.3	131.2	174	-178.8	0	0	0	0	109	L747 L756 V766 L792 W801	L747-V819 HydrophobicContact CD2-CB 4.26Å; L747-V819 HydrophobicContact CD2-CG2 3.5Å; L756-V819 HydrophobicContact CD1-CG1 4.07Å; L756-V819 HydrophobicContact CD1-CG2 4.18Å; L756-V819 HydrophobicContact CD2-CG2 4.32Å; V766-V819 HydrophobicContact CG1-CG1 4Å; L792-V819 HydrophobicContact CD1-CG2 4.19Å; W801-V819 HydrophobicContact CH2-CG2 3.92Å; W801-V819 HydrophobicContact CZ3-CG2 3.88Å
820	R	78.9	Confident	64.5	Low	72 Å²	72	66.8 Å²	66.8	27%	0.272	36%	0.364	S	S	.	.			trans	-75.8	140.1	179.7	-77	-173.7	160.7	-175.1	-0.9	110.2	Y767 E769 R818	Y767-R820 PolarHBondContact O-N 2.96Å; E769-R820 HydrophobicContact CB-CG 4Å; E769-R820 IonicContact OE1-CZ 3.31Å; E769-R820 IonicContact OE1-NE 3.45Å; E769-R820 PolarHBondContact OE1-NE 3.24Å; E769-R820 IonicContact OE1-NH2 2.71Å; E769-R820 PolarHBondContact OE1-NH2 2.98Å; E769-R820 IonicContact OE2-NE 2.63Å; R818-R820 PolarHBondContact O-N 3.47Å
821	V	54.2	Low	61.8	Low	81 Å²	81	73.5 Å²	73.5	49%	0.491	40%	0.404	S	S	.	.	S	Bend	trans	-70.2	-42.3	178.7	-176.1	0	0	0	0	110.6	Q748	Q748-V821 HydrophobicContact CG-CG2 4.14Å
822	N	57.2	Low	59.2	Low	47 Å²	47	78.1 Å²	78.1	25%	0.251	43%	0.43	S	S	.	.			trans	-90	121.2	171.7	-62.5	62.7	0	0	0	109.1	E824 H850	N822-E824 HydrophobicContact CB-CG 4.39Å; N822-E824 PolarHBondContact ND2-OE1 2.87Å; N822-H850 PolarHBondContact ND2-NE2 3.3Å
823	Q	59.9	Low	56.7	Low	53 Å²	53	83.1 Å²	83.1	25%	0.248	46%	0.464	C	S	.	.			trans	-99	10.1	179.6	-60.9	-175.8	32.3	0	0	113.1	W759	W759-Q823 VanDerWaalsContact CZ3-NE2 3.3Å
824	E	48.5	Very low	54.8	Low	123 Å²	123	88.9 Å²	88.9	58%	0.575	50%	0.499	S	S	*	.	S	Bend	trans	-87.6	137.1	-176.2	63.2	-151.9	141.8	0	0	112.6	N822 S826 H850	N822-E824 HydrophobicContact CB-CG 4.39Å; N822-E824 PolarHBondContact ND2-OE1 2.87Å; E824-S826 PolarHBondContact O-N 3.41Å; E824-S826 VanDerWaalsContact O-N 3.13Å; E824-H850 IonicContact OE1-NE2 2.79Å; E824-H850 PolarHBondContact OE1-NE2 2.92Å
825	D	39	Very low	52.6	Low	96 Å²	96	93.4 Å²	93.4	51%	0.513	54%	0.537	S	S	.	.			trans	-72.9	101.5	-175.4	-75.2	-48.9	0	0	0	111.9	Y767 S827	Y767-D825 VanDerWaalsContact CE2-OD1 3.27Å; Y767-D825 WeakPolarHBondContact CE2-OD1 3.43Å; Y767-D825 PolarHBondContact OH-OD1 2.87Å; D825-S827 PolarHBondContact O-N 3.38Å; D825-S827 PolarHBondContact O-OG 3.03Å
826	S	41.2	Very low	51.1	Low	114 Å²	114	98.1 Å²	98.1	80%	0.797	56%	0.559	S	S	*	*			trans	-70.4	69.6	172.6	68.5	0	0	0	0	111.8	E824	E824-S826 PolarHBondContact O-N 3.41Å; E824-S826 VanDerWaalsContact O-N 3.13Å
827	S	39.3	Very low	49.6	Very low	96 Å²	96	103.4 Å²	103.4	67%	0.671	58%	0.584	S	S	*	*			trans	-120.4	11.6	-173.6	58.2	0	0	0	0	113.4	D825	D825-S827 PolarHBondContact O-N 3.38Å; D825-S827 PolarHBondContact O-OG 3.03Å
828	T	34.5	Very low	47.7	Very low	132 Å²	132	112.5 Å²	112.5	81%	0.81	63%	0.627	S	S	*	*			trans	-121.8	42	-172.1	45.6	0	0	0	0	113.7
829	E	36.6	Very low	45.9	Very low	183 Å²	183	116.4 Å²	116.4	86%	0.855	65%	0.652	S	S	*	*			trans	-101.4	145.2	153.3	-76	-168.8	154.8	0	0	109.5
830	S	36.1	Very low	44	Very low	117 Å²	117	121.2 Å²	121.2	82%	0.818	68%	0.684	S	S	*	*			trans	82.4	66.4	175.4	-44.5	0	0	0	0	118.7
831	V	33.4	Very low	42.4	Very low	140 Å²	140	121 Å²	121	85%	0.848	70%	0.698	S	S	*	*				-140.3	119.8	116.9	-170.4	0	0	0	0	108.8
832	E	37.7	Very low	42.2	Very low	191 Å²	191	122.6 Å²	122.6	89%	0.893	71%	0.709	S	S	*	*			trans	-120.4	118.8	170.3	-176.2	175.8	-149.4	0	0	107.7
833	S	35.8	Very low	41.7	Very low	104 Å²	104	131 Å²	131	73%	0.727	74%	0.738	S	S	*	*			trans	-153.8	124.3	178.3	60.1	0	0	0	0	110.9
834	V	43.6	Very low	41.1	Very low	134 Å²	134	134.1 Å²	134.1	81%	0.812	76%	0.756	S	S	*	*			trans	-83.1	139	-166.2	179.2	0	0	0	0	113.5
835	A	38.2	Very low	41.3	Very low	97 Å²	97	136 Å²	136	80%	0.802	76%	0.762	S	S	*	*			trans	-156.9	139.7	149.5	0	0	0	0	0	109.8
836	D	41	Very low	42	Very low	140 Å²	140	135.6 Å²	135.6	75%	0.749	77%	0.765	S	S	*	*			trans	-83	139.6	-172.1	-50	-85.4	0	0	0	114.7
837	Q	41.3	Very low	43.1	Very low	177 Å²	177	133.1 Å²	133.1	83%	0.827	75%	0.748	S	S	*	*				-176.6	131.5	111.8	-102.2	160.2	94.7	0	0	115.4
838	E	41.1	Very low	44.7	Very low	190 Å²	190	131.8 Å²	131.8	89%	0.888	74%	0.735	S	S	*	*			trans	60.1	154.8	153.9	-54.4	-161.4	148.2	0	0	121.7
839	D	43.3	Very low	46.8	Very low	143 Å²	143	131.7 Å²	131.7	77%	0.765	73%	0.726	S	S	*	*			trans	-83.1	144.8	-162.4	-174.4	38.1	0	0	0	113.1	A841	D839-A841 PolarHBondContact OD1-N 2.89Å
840	P	44.3	Very low	49.1	Very low	116 Å²	116	127.8 Å²	127.8	75%	0.753	71%	0.707	S	S	*	*				-147.7	119.1	101.4	34.8	-16.3	0	0	0	117.1
841	A	44.1	Very low	51.5	Low	68 Å²	68	127.7 Å²	127.7	56%	0.562	69%	0.692	S	S	*	*			trans	76.4	143.7	147.7	0	0	0	0	0	119.6	D839 R843	D839-A841 PolarHBondContact OD1-N 2.89Å; A841-R843 PolarHBondContact O-N 3.46Å
842	P	49.4	Very low	54.2	Low	113 Å²	113	124.6 Å²	124.6	73%	0.734	67%	0.669	S	S	*	*			trans	-75.4	122.9	-167.8	29.1	-36	0	0	0	114
843	R	47.1	Very low	56.8	Low	223 Å²	223	120.3 Å²	120.3	84%	0.842	65%	0.649	S	S	*	*			trans	-120.9	32.6	179.6	-72.5	-168.9	173.7	-161.8	0.5	114.3	A841 K845 P846	A841-R843 PolarHBondContact O-N 3.46Å; R843-K845 VanDerWaalsContact C-N 3.28Å; R843-K845 PolarHBondContact O-N 3.08Å; R843-P846 WeakPolarHBondContact O-CD 3.36Å
844	D	48.1	Very low	59.4	Low	119 Å²	119	116.8 Å²	116.8	64%	0.636	62%	0.621	S	S	*	*			trans	-69.5	-20.9	-179.6	-58.7	-68.6	0	0	0	114.9	P846 S847	D844-P846 VanDerWaalsContact C-CD 3.42Å; D844-S847 PolarHBondContact O-N 3.35Å; D844-S847 PolarHBondContact O-OG 3.11Å
845	K	51.9	Low	61.9	Low	163 Å²	163	110.5 Å²	110.5	71%	0.709	58%	0.583	S	S	*	*	H	α-helix	trans	-52.7	-44	-170.3	-61.9	-172	178.9	-176.1	0	117.3	R843 S847 T848 Q849	R843-K845 VanDerWaalsContact C-N 3.28Å; R843-K845 PolarHBondContact O-N 3.08Å; K845-S847 VanDerWaalsContact C-N 3.29Å; K845-S847 PolarHBondContact O-N 2.81Å; K845-T848 PolarHBondContact O-N 2.89Å; K845-Q849 PolarHBondContact O-N 3.28Å
846	P	53.6	Low	64.6	Low	87 Å²	87	106.4 Å²	106.4	57%	0.565	55%	0.547	S	S	*	.	H	α-helix	trans	-69.2	-28	-173.7	28.3	-33.5	0	0	0	112.6	R843 D844 T848 H850	R843-P846 WeakPolarHBondContact O-CD 3.36Å; D844-P846 VanDerWaalsContact C-CD 3.42Å; P846-T848 VanDerWaalsContact C-N 3.32Å; P846-T848 PolarHBondContact O-N 2.81Å; P846-H850 WeakPolarHBondContact O-CB 3.33Å; P846-H850 PolarHBondContact O-N 2.78Å
847	S	65.2	Low	67	Low	62 Å²	62	101 Å²	101	43%	0.434	52%	0.519	S	S	.	.	H	α-helix	trans	-70.3	-29.1	-179.4	78.1	0	0	0	0	113.1	D844 K845 K851	D844-S847 PolarHBondContact O-N 3.35Å; D844-S847 PolarHBondContact O-OG 3.11Å; K845-S847 VanDerWaalsContact C-N 3.29Å; K845-S847 PolarHBondContact O-N 2.81Å; S847-K851 WeakPolarHBondContact O-CD 3.49Å; S847-K851 WeakPolarHBondContact O-CG 3.37Å
848	T	72.9	Confident	69.4	Low	68 Å²	68	93.1 Å²	93.1	42%	0.417	48%	0.482	S	S	.	.	H	α-helix	trans	-80.4	-47.6	177	-49	0	0	0	0	110.5	K845 P846 H850 K851 E852	K845-T848 PolarHBondContact O-N 2.89Å; P846-T848 VanDerWaalsContact C-N 3.32Å; P846-T848 PolarHBondContact O-N 2.81Å; T848-H850 VanDerWaalsContact C-N 3.28Å; T848-H850 PolarHBondContact O-N 2.91Å; T848-K851 WeakPolarHBondContact O-CB 3.24Å; T848-K851 PolarHBondContact O-N 3.03Å; T848-E852 WeakPolarHBondContact CG2-OE1 3.49Å; T848-E852 WeakPolarHBondContact O-CG 3.19Å; T848-E852 PolarHBondContact O-N 3.39Å
849	Q	79.1	Confident	72	Confident	130 Å²	130	84 Å²	84	61%	0.607	44%	0.44	S	S	*	.	H	α-helix	trans	-60.2	-36	177.8	-69.5	-174.6	-45.5	0	0	112.8	K845 E852 Q853	K845-Q849 PolarHBondContact O-N 3.28Å; Q849-E852 WeakPolarHBondContact CA-OE2 3.3Å; Q849-E852 PolarHBondContact O-N 3.07Å; Q849-Q853 WeakPolarHBondContact O-CB 3.24Å; Q849-Q853 PolarHBondContact O-N 3.37Å
850	H	84.7	Confident	74.4	Confident	101 Å²	101	80.5 Å²	80.5	47%	0.468	42%	0.419	S	S	.	.	H	α-helix	trans	-62.3	-43	172.6	-175.6	-92.5	0	0	0	112.4	N822 E824 P846 T848 Q853 M854	N822-H850 PolarHBondContact ND2-NE2 3.3Å; E824-H850 IonicContact OE1-NE2 2.79Å; E824-H850 PolarHBondContact OE1-NE2 2.92Å; P846-H850 WeakPolarHBondContact O-CB 3.33Å; P846-H850 PolarHBondContact O-N 2.78Å; T848-H850 VanDerWaalsContact C-N 3.28Å; T848-H850 PolarHBondContact O-N 2.91Å; H850-Q853 PolarHBondContact O-N 3.27Å; H850-M854 WeakPolarHBondContact O-CG 3.35Å; H850-M854 PolarHBondContact O-N 2.92Å
851	K	85.2	Confident	76.7	Confident	115 Å²	115	76.7 Å²	76.7	50%	0.5	39%	0.391	S	S	.	.	H	α-helix	trans	-67	-38.3	176.8	-69.8	166.6	-175	164.1	0	112.2	S847 T848 M854 R855	S847-K851 WeakPolarHBondContact O-CD 3.49Å; S847-K851 WeakPolarHBondContact O-CG 3.37Å; T848-K851 WeakPolarHBondContact O-CB 3.24Å; T848-K851 PolarHBondContact O-N 3.03Å; K851-M854 PolarHBondContact O-N 2.93Å; K851-R855 PolarHBondContact O-N 2.75Å
852	E	91.7	Very high	79.1	Confident	75 Å²	75	73.6 Å²	73.6	35%	0.35	37%	0.365	S	S	.	.	H	α-helix	trans	-64	-40.9	173.9	-70.2	162.1	171.2	0	0	111.5	T848 Q849 R855 T856 H927	T848-E852 WeakPolarHBondContact CG2-OE1 3.49Å; T848-E852 WeakPolarHBondContact O-CG 3.19Å; T848-E852 PolarHBondContact O-N 3.39Å; Q849-E852 WeakPolarHBondContact CA-OE2 3.3Å; Q849-E852 PolarHBondContact O-N 3.07Å; E852-R855 PolarHBondContact O-N 2.71Å; E852-T856 WeakPolarHBondContact O-CB 3.46Å; E852-T856 PolarHBondContact O-N 3.25Å; E852-T856 PolarHBondContact O-OG1 3.05Å; E852-H927 WeakPolarHBondContact O-CB 3.36Å
853	Q	91.9	Very high	81.3	Confident	102 Å²	102	68.3 Å²	68.3	48%	0.477	33%	0.331	S	S	.	.	H	α-helix	trans	-66.2	-40.9	172.8	-172.1	59.6	55.6	0	0	111.8	Q849 H850 T856 N857	Q849-Q853 WeakPolarHBondContact O-CB 3.24Å; Q849-Q853 PolarHBondContact O-N 3.37Å; H850-Q853 PolarHBondContact O-N 3.27Å; Q853-T856 WeakPolarHBondContact O-CB 3.41Å; Q853-T856 PolarHBondContact O-N 3.48Å; Q853-N857 PolarHBondContact NE2-OD1 3.13Å; Q853-N857 PolarHBondContact O-N 3.25Å; Q853-N857 PolarHBondContact O-OD1 2.75Å
854	M	89.5	Confident	83.4	Confident	29 Å²	29	60.3 Å²	60.3	14%	0.143	31%	0.305	C	S	.	.	H	α-helix	trans	-64.2	-40.2	175.3	-71.8	-61.3	-69.6	0	0	112.1	H850 K851 N857 V858 Y1010	H850-M854 WeakPolarHBondContact O-CG 3.35Å; H850-M854 PolarHBondContact O-N 2.92Å; K851-M854 PolarHBondContact O-N 2.93Å; M854-N857 PolarHBondContact O-N 2.98Å; M854-V858 WeakPolarHBondContact O-CG2 3.42Å; M854-V858 PolarHBondContact O-N 3.45Å; M854-V858 VanDerWaalsContact O-N 3.1Å; M854-Y1010 HydrophobicContact CB-CD1 3.71Å; M854-Y1010 HydrophobicContact CB-CD2 3.89Å; M854-Y1010 HydrophobicContact CB-CE1 3.95Å; M854-Y1010 HydrophobicContact CB-CE2 4.1Å; M854-Y1010 HydrophobicContact CB-CG 3.7Å; M854-Y1010 HydrophobicContact CE-CE1 4.18Å; M854-Y1010 HydrophobicContact CE-CE2 3.83Å; M854-Y1010 WeakPolarHBondContact CE-OH 3.5Å; M854-Y1010 HydrophobicContact CG-CD1 4.42Å; M854-Y1010 HydrophobicContact CG-CE1 4.25Å
855	R	95.8	Very high	85.4	Confident	3 Å²	3	56.5 Å²	56.5	1%	0.011	29%	0.286	C	S	.	.	H	α-helix	trans	-65.1	-40.7	172	-178.1	162.9	156.3	91.6	15.8	111.7	K851 E852 N857 V858 V859 H927 S929 L1007 T1011 H1015 D1017	K851-R855 PolarHBondContact O-N 2.75Å; E852-R855 PolarHBondContact O-N 2.71Å; R855-N857 PolarHBondContact O-N 2.63Å; R855-V858 PolarHBondContact O-N 2.75Å; R855-V859 HydrophobicContact CG-CG2 4.32Å; R855-V859 VanDerWaalsContact O-CG2 3.31Å; R855-V859 WeakPolarHBondContact O-CG2 3.37Å; R855-V859 PolarHBondContact O-N 3.04Å; R855-H927 HydrophobicContact CB-CB 4.35Å; R855-H927 HydrophobicContact CG-CB 4.34Å; R855-H927 PolarHBondContact NE-O 2.84Å; R855-H927 PolarHBondContact NH2-O 2.85Å; R855-S929 PolarHBondContact NH2-O 2.83Å; R855-L1007 HydrophobicContact CG-CD1 3.97Å; R855-T1011 PolarHBondContact NH1-OG1 3.2Å; R855-H1015 VanDerWaalsContact CZ-CE1 3.5Å; R855-H1015 PolarHBondContact NH2-CE1 2.99Å; R855-D1017 IonicContact CZ-OD2 3.66Å; R855-D1017 IonicContact NH1-OD2 2.61Å; R855-D1017 PolarHBondContact NH1-OD2 3.33Å; R855-D1017 IonicContact NH2-OD2 3.65Å; R855-D1017 PolarHBondContact NH2-OD2 2.72Å
856	T	95	Very high	87.5	Confident	10 Å²	10	48.8 Å²	48.8	6%	0.061	25%	0.252	C	S	.	.	H	α-helix	trans	-54.7	-50.2	171.6	-69.6	0	0	0	0	111.3	E852 Q853 V858 V859 Q860 P926 H927	E852-T856 WeakPolarHBondContact O-CB 3.46Å; E852-T856 PolarHBondContact O-N 3.25Å; E852-T856 PolarHBondContact O-OG1 3.05Å; Q853-T856 WeakPolarHBondContact O-CB 3.41Å; Q853-T856 PolarHBondContact O-N 3.48Å; T856-V858 PolarHBondContact O-N 3.03Å; T856-V859 PolarHBondContact O-N 2.73Å; T856-Q860 HydrophobicContact CG2-CG 4.48Å; T856-Q860 WeakPolarHBondContact O-CB 3.17Å; T856-Q860 WeakPolarHBondContact O-CG 3.37Å; T856-Q860 PolarHBondContact O-N 2.77Å; T856-P926 HydrophobicContact CG2-CB 4.03Å; T856-P926 HydrophobicContact CG2-CG 4.15Å; T856-H927 WeakPolarHBondContact OG1-CB 3.08Å; T856-H927 PolarHBondContact OG1-N 3.33Å
857	N	92	Very high	89.5	Confident	28 Å²	28	48.9 Å²	48.9	15%	0.15	24%	0.241	C	C	.	.	H	α-helix	trans	-58.8	-44.8	-180	-65	-9.1	0	0	0	111.7	Q853 M854 R855 E861	Q853-N857 PolarHBondContact NE2-OD1 3.13Å; Q853-N857 PolarHBondContact O-N 3.25Å; Q853-N857 PolarHBondContact O-OD1 2.75Å; M854-N857 PolarHBondContact O-N 2.98Å; R855-N857 PolarHBondContact O-N 2.63Å; N857-E861 WeakPolarHBondContact O-CB 3.48Å; N857-E861 PolarHBondContact O-N 3.33Å
858	V	90.9	Very high	90.6	Very high	10 Å²	10	49.8 Å²	49.8	6%	0.061	24%	0.24	C	C	.	.	H	α-helix	trans	-69.5	-41	179.2	177.8	0	0	0	0	112.2	M854 R855 T856 E861 I862 E1006 L1007 Y1010	M854-V858 WeakPolarHBondContact O-CG2 3.42Å; M854-V858 PolarHBondContact O-N 3.45Å; M854-V858 VanDerWaalsContact O-N 3.1Å; R855-V858 PolarHBondContact O-N 2.75Å; T856-V858 PolarHBondContact O-N 3.03Å; V858-E861 PolarHBondContact O-N 3.08Å; V858-I862 HydrophobicContact CG1-CD1 4.08Å; V858-I862 WeakPolarHBondContact O-CG1 3.35Å; V858-I862 PolarHBondContact O-N 2.95Å; V858-E1006 HydrophobicContact CG2-CG 4.13Å; V858-L1007 HydrophobicContact CB-CD1 4.35Å; V858-L1007 HydrophobicContact CG1-CB 3.84Å; V858-L1007 HydrophobicContact CG1-CD1 4.02Å; V858-Y1010 HydrophobicContact CG2-CD2 4.13Å; V858-Y1010 HydrophobicContact CG2-CE2 4.26Å
859	V	95.9	Very high	91.6	Very high	0 Å²	0	47 Å²	47	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-62.2	-46	175.7	172.7	0	0	0	0	110.5	R855 T856 E861 I862 M863 Y921 I931 L1007	R855-V859 HydrophobicContact CG-CG2 4.32Å; R855-V859 VanDerWaalsContact O-CG2 3.31Å; R855-V859 WeakPolarHBondContact O-CG2 3.37Å; R855-V859 PolarHBondContact O-N 3.04Å; T856-V859 PolarHBondContact O-N 2.73Å; V859-E861 PolarHBondContact O-N 3.26Å; V859-I862 PolarHBondContact O-N 3.06Å; V859-M863 WeakPolarHBondContact O-CG 3.31Å; V859-M863 PolarHBondContact O-N 2.6Å; V859-Y921 HydrophobicContact CG1-CD2 3.82Å; V859-Y921 HydrophobicContact CG1-CE2 3.88Å; V859-I931 HydrophobicContact CG1-CD1 4.32Å; V859-I931 HydrophobicContact CG2-CD1 4.19Å; V859-L1007 HydrophobicContact CG2-CD1 3.67Å
860	Q	93.1	Very high	92.5	Very high	69 Å²	69	42.2 Å²	42.2	32%	0.322	20%	0.2	S	C	.	.	H	α-helix	trans	-62.3	-40	176.5	-72.5	178.6	-9.4	0	0	112.2	T856 M863 N864 P926	T856-Q860 HydrophobicContact CG2-CG 4.48Å; T856-Q860 WeakPolarHBondContact O-CB 3.17Å; T856-Q860 WeakPolarHBondContact O-CG 3.37Å; T856-Q860 PolarHBondContact O-N 2.77Å; Q860-M863 PolarHBondContact O-N 2.94Å; Q860-N864 WeakPolarHBondContact O-CB 3.37Å; Q860-N864 VanDerWaalsContact O-CG 3.25Å; Q860-N864 PolarHBondContact O-N 3.41Å; Q860-N864 PolarHBondContact O-ND2 3.01Å; Q860-P926 HydrophobicContact CG-CB 4.39Å
861	E	93.5	Very high	92.9	Very high	36 Å²	36	43.4 Å²	43.4	17%	0.168	20%	0.204	C	C	.	.	H	α-helix	trans	-61.3	-44.1	174.2	-166.9	-150.7	172.6	0	0	112	R818 N857 V858 V859 N864 T865	R818-E861 IonicContact CZ-OE1 2.73Å; R818-E861 IonicContact CZ-OE2 2.75Å; R818-E861 IonicContact NH1-OE1 2.78Å; R818-E861 PolarHBondContact NH1-OE1 3.4Å; R818-E861 IonicContact NH1-OE2 3.24Å; R818-E861 PolarHBondContact NH1-OE2 3.33Å; N857-E861 WeakPolarHBondContact O-CB 3.48Å; N857-E861 PolarHBondContact O-N 3.33Å; V858-E861 PolarHBondContact O-N 3.08Å; V859-E861 PolarHBondContact O-N 3.26Å; E861-N864 PolarHBondContact O-N 3.18Å; E861-T865 HydrophobicContact CG-CG2 4.17Å; E861-T865 WeakPolarHBondContact O-CB 3.29Å; E861-T865 VanDerWaalsContact O-CG2 3.28Å; E861-T865 WeakPolarHBondContact O-CG2 3.07Å; E861-T865 PolarHBondContact O-N 3.39Å; E861-T865 PolarHBondContact O-OG1 3.48Å
862	I	93.6	Very high	93.1	Very high	2 Å²	2	39.5 Å²	39.5	1%	0.01	19%	0.188	C	C	.	.	H	α-helix	trans	-58.1	-53.9	175.9	-70.4	165.1	0	0	0	109.3	V858 V859 N864 T865 E866 I931 Q1003 L1007	V858-I862 HydrophobicContact CG1-CD1 4.08Å; V858-I862 WeakPolarHBondContact O-CG1 3.35Å; V858-I862 PolarHBondContact O-N 2.95Å; V859-I862 PolarHBondContact O-N 3.06Å; I862-N864 PolarHBondContact O-N 3.48Å; I862-T865 PolarHBondContact O-N 2.89Å; I862-T865 PolarHBondContact O-OG1 3.48Å; I862-T865 VanDerWaalsContact O-OG1 3.12Å; I862-E866 HydrophobicContact CG2-CG 4.47Å; I862-E866 WeakPolarHBondContact O-CG 3.34Å; I862-E866 PolarHBondContact O-N 3.12Å; I862-I931 HydrophobicContact CD1-CD1 3.91Å; I862-I931 HydrophobicContact CG2-CD1 4.25Å; I862-Q1003 HydrophobicContact CD1-CB 4.26Å; I862-Q1003 HydrophobicContact CG1-CB 4Å; I862-L1007 HydrophobicContact CD1-CD2 4.15Å
863	M	95.8	Very high	93.4	Very high	2 Å²	2	36 Å²	36	1%	0.01	17%	0.171	C	C	.	.	H	α-helix	trans	-59	-43.3	-179.4	-63.5	-52.1	-65.5	0	0	113	V859 Q860 E866 R867 L917 E918 Y921	V859-M863 WeakPolarHBondContact O-CG 3.31Å; V859-M863 PolarHBondContact O-N 2.6Å; Q860-M863 PolarHBondContact O-N 2.94Å; M863-E866 PolarHBondContact O-N 2.82Å; M863-R867 VanDerWaalsContact O-CG 3.29Å; M863-R867 WeakPolarHBondContact O-CG 3.28Å; M863-R867 PolarHBondContact O-N 2.99Å; M863-L917 HydrophobicContact CE-CB 4Å; M863-L917 HydrophobicContact SD-CB 3.94Å; M863-E918 HydrophobicContact CE-CB 4.22Å; M863-E918 HydrophobicContact CE-CG 3.38Å; M863-Y921 HydrophobicContact CE-CG 4.33Å; M863-Y921 HydrophobicContact CG-CD2 3.53Å; M863-Y921 HydrophobicContact CG-CE2 3.91Å; M863-Y921 HydrophobicContact CG-CG 4.17Å; M863-Y921 HydrophobicContact SD-CD2 4.27Å
864	N	91.3	Very high	93.6	Very high	56 Å²	56	35.1 Å²	35.1	30%	0.299	17%	0.166	S	C	.	.	H	α-helix	trans	-71.7	-40.3	-179.2	-69.4	-14.5	0	0	0	111.8	Q860 E861 I862 E866 R867 I868	Q860-N864 WeakPolarHBondContact O-CB 3.37Å; Q860-N864 VanDerWaalsContact O-CG 3.25Å; Q860-N864 PolarHBondContact O-N 3.41Å; Q860-N864 PolarHBondContact O-ND2 3.01Å; E861-N864 PolarHBondContact O-N 3.18Å; I862-N864 PolarHBondContact O-N 3.48Å; N864-E866 VanDerWaalsContact C-N 3.34Å; N864-E866 PolarHBondContact O-N 3.31Å; N864-R867 PolarHBondContact O-N 2.91Å; N864-R867 PolarHBondContact OD1-NH1 2.64Å; N864-I868 VanDerWaalsContact O-CG1 3.31Å; N864-I868 WeakPolarHBondContact O-CG1 3.39Å; N864-I868 PolarHBondContact O-N 3.35Å
865	T	91.3	Very high	93.7	Very high	38 Å²	38	34.4 Å²	34.4	23%	0.233	16%	0.163	C	C	.	.	H	α-helix	trans	-68.3	-31.3	175	59	0	0	0	0	112.7	E861 I862 Y869 K996 Q1003	E861-T865 HydrophobicContact CG-CG2 4.17Å; E861-T865 WeakPolarHBondContact O-CB 3.29Å; E861-T865 VanDerWaalsContact O-CG2 3.28Å; E861-T865 WeakPolarHBondContact O-CG2 3.07Å; E861-T865 PolarHBondContact O-N 3.39Å; E861-T865 PolarHBondContact O-OG1 3.48Å; I862-T865 PolarHBondContact O-N 2.89Å; I862-T865 PolarHBondContact O-OG1 3.48Å; I862-T865 VanDerWaalsContact O-OG1 3.12Å; T865-Y869 WeakPolarHBondContact O-CB 3.32Å; T865-Y869 PolarHBondContact O-N 2.78Å; T865-K996 PolarHBondContact OG1-NZ 3.25Å; T865-Q1003 PolarHBondContact OG1-NE2 3.26Å; T865-Q1003 VanDerWaalsContact OG1-NE2 3.08Å
866	E	95.9	Very high	93.7	Very high	1 Å²	1	34.2 Å²	34.2	1%	0.005	16%	0.162	C	C	.	.	H	α-helix	trans	-65.4	-45.5	169.5	-67.1	-29.5	133.4	0	0	112.4	I862 M863 N864 I868 Y869 I870 Q910 V914 L917 K996 Y1000	I862-E866 HydrophobicContact CG2-CG 4.47Å; I862-E866 WeakPolarHBondContact O-CG 3.34Å; I862-E866 PolarHBondContact O-N 3.12Å; M863-E866 PolarHBondContact O-N 2.82Å; N864-E866 VanDerWaalsContact C-N 3.34Å; N864-E866 PolarHBondContact O-N 3.31Å; E866-I868 PolarHBondContact O-N 2.84Å; E866-Y869 PolarHBondContact O-N 3.35Å; E866-I870 WeakPolarHBondContact O-CG2 3.44Å; E866-I870 PolarHBondContact O-N 3.45Å; E866-Q910 PolarHBondContact OE2-NE2 3.01Å; E866-V914 HydrophobicContact CB-CG2 3.93Å; E866-V914 HydrophobicContact CG-CG2 4.49Å; E866-L917 HydrophobicContact CG-CD1 3.69Å; E866-K996 VanDerWaalsContact CD-CE 3.41Å; E866-K996 WeakPolarHBondContact OE1-CE 3.37Å; E866-K996 IonicContact OE1-NZ 2.81Å; E866-K996 PolarHBondContact OE1-NZ 2.9Å; E866-K996 WeakPolarHBondContact OE2-CE 3.35Å; E866-K996 IonicContact OE2-NZ 2.92Å; E866-Y1000 WeakPolarHBondContact OE1-CE1 3.4Å; E866-Y1000 PolarHBondContact OE2-OH 3.31Å
867	R	94.3	Very high	93.8	Very high	89 Å²	89	34.3 Å²	34.3	34%	0.336	16%	0.163	S	C	.	.	H	α-helix	trans	-62.3	-41.7	179.6	-74.1	169.6	-177	138.3	1.8	112.2	M863 N864 I870 K871 E918	M863-R867 VanDerWaalsContact O-CG 3.29Å; M863-R867 WeakPolarHBondContact O-CG 3.28Å; M863-R867 PolarHBondContact O-N 2.99Å; N864-R867 PolarHBondContact O-N 2.91Å; N864-R867 PolarHBondContact OD1-NH1 2.64Å; R867-I870 WeakPolarHBondContact O-CG2 3.08Å; R867-K871 WeakPolarHBondContact O-CB 3.39Å; R867-K871 PolarHBondContact O-N 3.29Å; R867-K871 VanDerWaalsContact O-N 3.11Å; R867-E918 IonicContact CZ-OE1 3.55Å; R867-E918 VanDerWaalsContact CZ-OE1 3.24Å; R867-E918 IonicContact NE-OE1 2.73Å; R867-E918 PolarHBondContact NE-OE1 3.41Å; R867-E918 IonicContact NH2-OE1 2.91Å; R867-E918 PolarHBondContact NH2-OE1 3.26Å
868	I	88.8	Confident	93.9	Very high	81 Å²	81	35.8 Å²	35.8	42%	0.415	17%	0.169	S	C	.	.	H	α-helix	trans	-65	-44.6	173.8	-67.2	165.3	0	0	0	110.4	N864 E866 K871 H872	N864-I868 VanDerWaalsContact O-CG1 3.31Å; N864-I868 WeakPolarHBondContact O-CG1 3.39Å; N864-I868 PolarHBondContact O-N 3.35Å; E866-I868 PolarHBondContact O-N 2.84Å; I868-K871 WeakPolarHBondContact O-CB 3.5Å; I868-K871 PolarHBondContact O-N 3.32Å; I868-H872 WeakPolarHBondContact CG2-NE2 3.47Å; I868-H872 PolarHBondContact O-N 3.36Å
869	Y	95.1	Very high	94	Very high	11 Å²	11	35.3 Å²	35.3	4%	0.043	17%	0.166	C	C	.	.	H	α-helix	trans	-65.2	-44.2	-179.5	177.3	-124.8	0	0	0	113	T865 E866 K871 H872 L873 I906 Q910 Y945 P993 K996	T865-Y869 WeakPolarHBondContact O-CB 3.32Å; T865-Y869 PolarHBondContact O-N 2.78Å; E866-Y869 PolarHBondContact O-N 3.35Å; Y869-K871 VanDerWaalsContact C-N 3.33Å; Y869-K871 PolarHBondContact O-N 3.22Å; Y869-H872 PolarHBondContact O-N 3.11Å; Y869-L873 HydrophobicContact CD1-CD1 4.3Å; Y869-L873 HydrophobicContact CD2-CG 4.41Å; Y869-L873 HydrophobicContact CE1-CD1 3.75Å; Y869-L873 HydrophobicContact CE1-CG 4.41Å; Y869-L873 HydrophobicContact CE2-CD1 4.17Å; Y869-L873 HydrophobicContact CE2-CD2 4.03Å; Y869-L873 HydrophobicContact CE2-CG 3.94Å; Y869-L873 WeakPolarHBondContact O-CG 3.36Å; Y869-L873 PolarHBondContact O-N 3.14Å; Y869-I906 WeakPolarHBondContact OH-CG2 3.48Å; Y869-Q910 HydrophobicContact CD1-CG 4.02Å; Y869-Q910 HydrophobicContact CE1-CG 4.06Å; Y869-Y945 WeakPolarHBondContact CE1-OH 3.22Å; Y869-Y945 PolarHBondContact OH-OH 3Å; Y869-P993 HydrophobicContact CE2-CG 4.48Å; Y869-P993 WeakPolarHBondContact OH-CA 2.96Å; Y869-P993 WeakPolarHBondContact OH-CB 3.26Å; Y869-K996 HydrophobicContact CD1-CB 4.34Å; Y869-K996 HydrophobicContact CD1-CD 4.47Å; Y869-K996 HydrophobicContact CD1-CG 3.73Å; Y869-K996 HydrophobicContact CD2-CB 4.33Å; Y869-K996 HydrophobicContact CD2-CG 4.49Å; Y869-K996 HydrophobicContact CE1-CB 4.13Å; Y869-K996 HydrophobicContact CE1-CG 3.79Å; Y869-K996 HydrophobicContact CE2-CB 4.14Å; Y869-K996 HydrophobicContact CG-CB 4.44Å; Y869-K996 HydrophobicContact CG-CG 4.1Å
870	I	96.7	Very high	94	Very high	28 Å²	28	35.4 Å²	35.4	14%	0.144	17%	0.167	C	C	.	.	H	α-helix	trans	-67.5	-32.7	176.4	-165.4	174	0	0	0	112.3	E866 R867 L873 K874 Y907 Q910 R911 V914	E866-I870 WeakPolarHBondContact O-CG2 3.44Å; E866-I870 PolarHBondContact O-N 3.45Å; R867-I870 WeakPolarHBondContact O-CG2 3.08Å; I870-L873 PolarHBondContact O-N 3.36Å; I870-K874 WeakPolarHBondContact O-CB 3.37Å; I870-K874 PolarHBondContact O-N 3.06Å; I870-Y907 HydrophobicContact CD1-CE2 4.43Å; I870-Y907 HydrophobicContact CG1-CD2 4.11Å; I870-Y907 HydrophobicContact CG1-CE2 3.87Å; I870-Q910 HydrophobicContact CB-CG 4Å; I870-Q910 HydrophobicContact CD1-CG 4.33Å; I870-Q910 HydrophobicContact CG1-CG 4.14Å; I870-R911 HydrophobicContact CD1-CB 3.87Å; I870-R911 HydrophobicContact CD1-CG 3.94Å; I870-V914 HydrophobicContact CB-CG2 4.48Å; I870-V914 HydrophobicContact CD1-CB 4.41Å; I870-V914 HydrophobicContact CD1-CG2 4.26Å
871	K	92.6	Very high	94.2	Very high	126 Å²	126	32.3 Å²	32.3	55%	0.548	15%	0.152	S	C	.	.	H	α-helix	trans	-59.1	-49.9	168.9	178.5	178.7	176.4	-177.5	0	110.6	R867 I868 Y869 L873 K874 D875	R867-K871 WeakPolarHBondContact O-CB 3.39Å; R867-K871 PolarHBondContact O-N 3.29Å; R867-K871 VanDerWaalsContact O-N 3.11Å; I868-K871 WeakPolarHBondContact O-CB 3.5Å; I868-K871 PolarHBondContact O-N 3.32Å; Y869-K871 VanDerWaalsContact C-N 3.33Å; Y869-K871 PolarHBondContact O-N 3.22Å; K871-L873 VanDerWaalsContact C-N 3.34Å; K871-L873 PolarHBondContact O-N 3.34Å; K871-K874 WeakPolarHBondContact O-CB 3.4Å; K871-K874 PolarHBondContact O-N 2.85Å; K871-K874 VanDerWaalsContact O-N 3.16Å; K871-D875 WeakPolarHBondContact CG-OD2 3.27Å; K871-D875 VanDerWaalsContact O-CG 3.31Å; K871-D875 PolarHBondContact O-N 3.49Å
872	H	91.3	Very high	94.2	Very high	34 Å²	34	35.9 Å²	35.9	16%	0.157	16%	0.164	C	C	.	.	H	α-helix	trans	-59.5	-40.9	177.3	-64.4	-18	0	0	0	113	I868 Y869 D875 I876 F989	I868-H872 WeakPolarHBondContact CG2-NE2 3.47Å; I868-H872 PolarHBondContact O-N 3.36Å; Y869-H872 PolarHBondContact O-N 3.11Å; H872-D875 PolarHBondContact O-N 2.66Å; H872-I876 WeakPolarHBondContact O-CD1 3.5Å; H872-I876 VanDerWaalsContact O-CG1 3.23Å; H872-I876 WeakPolarHBondContact O-CG1 3.41Å; H872-I876 PolarHBondContact O-N 2.83Å; H872-F989 HydrophobicContact CB-CD1 4.29Å; H872-F989 HydrophobicContact CB-CE1 4.31Å; H872-F989 AromaticContact ND1-CE1 3.86Å
873	L	96.8	Very high	94.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61.7	-45.1	174.3	-69.5	177.1	0	0	0	112	Y869 I870 K871 I876 C877 I903 I906 Y907 Q910 P993	Y869-L873 HydrophobicContact CD1-CD1 4.3Å; Y869-L873 HydrophobicContact CD2-CG 4.41Å; Y869-L873 HydrophobicContact CE1-CD1 3.75Å; Y869-L873 HydrophobicContact CE1-CG 4.41Å; Y869-L873 HydrophobicContact CE2-CD1 4.17Å; Y869-L873 HydrophobicContact CE2-CD2 4.03Å; Y869-L873 HydrophobicContact CE2-CG 3.94Å; Y869-L873 WeakPolarHBondContact O-CG 3.36Å; Y869-L873 PolarHBondContact O-N 3.14Å; I870-L873 PolarHBondContact O-N 3.36Å; K871-L873 VanDerWaalsContact C-N 3.34Å; K871-L873 PolarHBondContact O-N 3.34Å; L873-I876 PolarHBondContact O-N 2.88Å; L873-C877 PolarHBondContact O-N 2.88Å; L873-C877 PolarHBondContact O-SG 2.97Å; L873-C877 VanDerWaalsContact O-SG 3.35Å; L873-I903 HydrophobicContact CD2-CD1 3.99Å; L873-I903 HydrophobicContact CD2-CG1 3.79Å; L873-I906 HydrophobicContact CD1-CG2 3.96Å; L873-I906 HydrophobicContact CD2-CG2 4.16Å; L873-Y907 HydrophobicContact CB-CD2 3.73Å; L873-Y907 HydrophobicContact CB-CG 4.19Å; L873-Q910 HydrophobicContact CD1-CB 3.74Å; L873-Q910 HydrophobicContact CD1-CG 3.93Å; L873-P993 HydrophobicContact CD2-CG 4.28Å
874	K	95.7	Very high	94.3	Very high	85 Å²	85	37.7 Å²	37.7	37%	0.37	17%	0.172	S	C	.	.	H	α-helix	trans	-57.9	-48.6	174.4	-178	-175.1	176	-169.6	0	111.2	I870 K871 I876 C877 E878 Y907	I870-K874 WeakPolarHBondContact O-CB 3.37Å; I870-K874 PolarHBondContact O-N 3.06Å; K871-K874 WeakPolarHBondContact O-CB 3.4Å; K871-K874 PolarHBondContact O-N 2.85Å; K871-K874 VanDerWaalsContact O-N 3.16Å; K874-I876 VanDerWaalsContact C-N 3.3Å; K874-I876 PolarHBondContact O-N 3.34Å; K874-C877 PolarHBondContact O-N 3.34Å; K874-C877 VanDerWaalsContact O-N 3.13Å; K874-E878 WeakPolarHBondContact CE-OE1 3.17Å; K874-E878 WeakPolarHBondContact CE-OE2 3.22Å; K874-E878 HydrophobicContact CG-CG 4.28Å; K874-E878 WeakPolarHBondContact CG-OE1 3.46Å; K874-E878 IonicContact NZ-OE2 2.77Å; K874-E878 WeakPolarHBondContact O-CB 3.13Å; K874-E878 PolarHBondContact O-N 3.24Å; K874-Y907 HydrophobicContact CB-CE2 3.82Å; K874-Y907 WeakPolarHBondContact CG-OH 3.36Å
875	D	92.6	Very high	94.5	Very high	13 Å²	13	41.3 Å²	41.3	7%	0.07	18%	0.182	C	C	.	.	H	α-helix	trans	-64.5	-33.1	-178.4	-68.1	-31	0	0	0	112.3	K871 H872 G879 Q979 M981	K871-D875 WeakPolarHBondContact CG-OD2 3.27Å; K871-D875 VanDerWaalsContact O-CG 3.31Å; K871-D875 PolarHBondContact O-N 3.49Å; H872-D875 PolarHBondContact O-N 2.66Å; D875-G879 WeakPolarHBondContact O-CA 3Å; D875-G879 PolarHBondContact O-N 3.08Å; D875-Q979 HydrophobicContact CB-CG 3.87Å; D875-Q979 PolarHBondContact OD1-NE2 2.74Å; D875-M981 HydrophobicContact CB-CG 3.87Å; D875-M981 HydrophobicContact CB-SD 3.87Å
876	I	95.8	Very high	94.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	20%	0.2	C	C	.	.	I	π-helix	trans	-67.1	-46.2	171.1	-62.9	158.6	0	0	0	110.9	H872 L873 K874 Y880 I881 F900 I903 F989 L990	H872-I876 WeakPolarHBondContact O-CD1 3.5Å; H872-I876 VanDerWaalsContact O-CG1 3.23Å; H872-I876 WeakPolarHBondContact O-CG1 3.41Å; H872-I876 PolarHBondContact O-N 2.83Å; L873-I876 PolarHBondContact O-N 2.88Å; K874-I876 VanDerWaalsContact C-N 3.3Å; K874-I876 PolarHBondContact O-N 3.34Å; I876-Y880 HydrophobicContact CG1-CD2 4.46Å; I876-Y880 HydrophobicContact CG2-CD2 4.49Å; I876-Y880 CarbonylContact O-C 3.41Å; I876-Y880 WeakPolarHBondContact O-CA 3.43Å; I876-Y880 WeakPolarHBondContact O-CB 3.4Å; I876-Y880 PolarHBondContact O-N 2.84Å; I876-I881 HydrophobicContact CG2-CD1 4.43Å; I876-I881 HydrophobicContact CG2-CG1 4.42Å; I876-I881 PolarHBondContact O-N 3.48Å; I876-F900 HydrophobicContact CG2-CD1 4.11Å; I876-F900 HydrophobicContact CG2-CE1 4.12Å; I876-I903 HydrophobicContact CD1-CD1 3.82Å; I876-I903 HydrophobicContact CG2-CD1 4.13Å; I876-F989 HydrophobicContact CD1-CB 3.91Å; I876-F989 HydrophobicContact CD1-CD1 4.45Å; I876-F989 HydrophobicContact CG1-CB 3.98Å; I876-F989 HydrophobicContact CG1-CD1 4.4Å; I876-F989 HydrophobicContact CG1-CG 4.43Å; I876-L990 HydrophobicContact CG2-CD2 4.2Å
877	C	96.4	Very high	94.4	Very high	12 Å²	12	48.5 Å²	48.5	8%	0.081	21%	0.213	C	C	.	.	I	π-helix	trans	-65	-48	179.7	-67.3	0	0	0	0	112.5	L873 K874 I881 R882 Y907	L873-C877 PolarHBondContact O-N 2.88Å; L873-C877 PolarHBondContact O-SG 2.97Å; L873-C877 VanDerWaalsContact O-SG 3.35Å; K874-C877 PolarHBondContact O-N 3.34Å; K874-C877 VanDerWaalsContact O-N 3.13Å; C877-I881 PolarHBondContact O-N 2.95Å; C877-R882 WeakPolarHBondContact O-CB 3.35Å; C877-R882 PolarHBondContact O-N 2.63Å; C877-Y907 HydrophobicContact CB-CD1 4.29Å
878	E	94.5	Very high	94.1	Very high	58 Å²	58	48.8 Å²	48.8	27%	0.271	23%	0.228	S	C	.	.	I	π-helix	trans	-86.6	-35.1	-173.3	-68.3	-179.3	-161.2	0	0	113.5	K874 R882	K874-E878 WeakPolarHBondContact CE-OE1 3.17Å; K874-E878 WeakPolarHBondContact CE-OE2 3.22Å; K874-E878 HydrophobicContact CG-CG 4.28Å; K874-E878 WeakPolarHBondContact CG-OE1 3.46Å; K874-E878 IonicContact NZ-OE2 2.77Å; K874-E878 WeakPolarHBondContact O-CB 3.13Å; K874-E878 PolarHBondContact O-N 3.24Å; E878-R882 VanDerWaalsContact O-CZ 3.24Å; E878-R882 PolarHBondContact O-NE 3.41Å; E878-R882 PolarHBondContact O-NH2 2.93Å
879	G	93.5	Very high	94.2	Very high	1 Å²	1	50 Å²	50	1%	0.01	24%	0.244	C	C	.	.	I	π-helix	trans	-86.4	-43.8	179.5	0	0	0	0	0	113.2	D875 Q883	D875-G879 WeakPolarHBondContact O-CA 3Å; D875-G879 PolarHBondContact O-N 3.08Å; G879-Q883 WeakPolarHBondContact O-CG 3.49Å
880	Y	95.8	Very high	94.1	Very high	2 Å²	2	50.9 Å²	50.9	1%	0.008	25%	0.249	C	C	.	.	I	π-helix	trans	-95.7	-65.3	179	-67.6	-56.3	0	0	0	113.5	I876 R882 Q883 C884 F972 C975 M981 I986 F989	I876-Y880 HydrophobicContact CG1-CD2 4.46Å; I876-Y880 HydrophobicContact CG2-CD2 4.49Å; I876-Y880 CarbonylContact O-C 3.41Å; I876-Y880 WeakPolarHBondContact O-CA 3.43Å; I876-Y880 WeakPolarHBondContact O-CB 3.4Å; I876-Y880 PolarHBondContact O-N 2.84Å; Y880-R882 PolarHBondContact O-N 3.34Å; Y880-Q883 PolarHBondContact O-N 3.21Å; Y880-Q883 VanDerWaalsContact O-N 3.11Å; Y880-C884 PolarHBondContact O-N 2.71Å; Y880-C884 PolarHBondContact O-SG 3.33Å; Y880-F972 AromaticContact CD1-CD1 3.75Å; Y880-F972 HydrophobicContact CD1-CD1 3.75Å; Y880-F972 HydrophobicContact CD1-CE1 4.34Å; Y880-F972 HydrophobicContact CE1-CB 4.34Å; Y880-F972 AromaticContact CE1-CD1 3.88Å; Y880-F972 HydrophobicContact CE1-CD1 3.88Å; Y880-F972 WeakPolarHBondContact CE1-O 3.43Å; Y880-C975 HydrophobicContact CD1-CB 3.5Å; Y880-C975 HydrophobicContact CE1-CB 3.55Å; Y880-M981 HydrophobicContact CD2-CE 3.93Å; Y880-M981 HydrophobicContact CD2-SD 4.39Å; Y880-M981 HydrophobicContact CE1-CE 4.35Å; Y880-M981 HydrophobicContact CE2-CE 3.56Å; Y880-M981 HydrophobicContact CE2-SD 3.79Å; Y880-M981 HydrophobicContact CG-CE 4.46Å; Y880-I986 HydrophobicContact CD1-CD1 3.91Å; Y880-I986 HydrophobicContact CD2-CB 4.47Å; Y880-I986 HydrophobicContact CD2-CD1 3.95Å; Y880-I986 HydrophobicContact CD2-CG1 3.98Å; Y880-I986 HydrophobicContact CE1-CB 4.22Å; Y880-I986 HydrophobicContact CE1-CD1 4.17Å; Y880-I986 HydrophobicContact CE1-CG1 4.48Å; Y880-I986 HydrophobicContact CE2-CB 3.87Å; Y880-I986 HydrophobicContact CE2-CD1 4.21Å; Y880-I986 HydrophobicContact CE2-CG1 3.87Å; Y880-I986 HydrophobicContact CG-CD1 3.8Å; Y880-I986 HydrophobicContact CG-CG1 4.34Å; Y880-F989 HydrophobicContact CE2-CD2 4.34Å
881	I	95.9	Very high	94	Very high	3 Å²	3	49.8 Å²	49.8	2%	0.015	24%	0.243	C	C	.	.	I	π-helix	trans	-60.8	-48	-167.3	-57.8	178.7	0	0	0	111.3	I876 C877 Q883 C884 R885 F900 I903 E904	I876-I881 HydrophobicContact CG2-CD1 4.43Å; I876-I881 HydrophobicContact CG2-CG1 4.42Å; I876-I881 PolarHBondContact O-N 3.48Å; C877-I881 PolarHBondContact O-N 2.95Å; I881-Q883 VanDerWaalsContact C-N 3.3Å; I881-Q883 PolarHBondContact O-N 3.4Å; I881-C884 PolarHBondContact O-N 2.83Å; I881-R885 HydrophobicContact CG2-CG 4.43Å; I881-R885 WeakPolarHBondContact O-CG 3.12Å; I881-R885 PolarHBondContact O-N 3.03Å; I881-F900 HydrophobicContact CD1-CB 3.86Å; I881-F900 HydrophobicContact CD1-CD1 3.77Å; I881-F900 HydrophobicContact CD1-CE1 4.47Å; I881-F900 HydrophobicContact CD1-CG 3.81Å; I881-F900 HydrophobicContact CG1-CB 4.2Å; I881-F900 HydrophobicContact CG1-CD1 3.44Å; I881-F900 VanDerWaalsContact CG1-CD1 3.44Å; I881-F900 HydrophobicContact CG1-CD2 3.95Å; I881-F900 HydrophobicContact CG1-CE1 3.67Å; I881-F900 HydrophobicContact CG1-CE2 4.16Å; I881-F900 HydrophobicContact CG1-CG 3.59Å; I881-F900 HydrophobicContact CG1-CZ 4.04Å; I881-I903 HydrophobicContact CD1-CG2 3.6Å; I881-E904 HydrophobicContact CD1-CG 3.75Å
882	R	95.3	Very high	94.1	Very high	111 Å²	111	47.5 Å²	47.5	42%	0.419	24%	0.239	S	C	.	.	H	α-helix	trans	-55.8	-40.4	176.7	-177.6	175.1	61.9	165.2	-4.4	112.7	C877 E878 Y880 K886	C877-R882 WeakPolarHBondContact O-CB 3.35Å; C877-R882 PolarHBondContact O-N 2.63Å; E878-R882 VanDerWaalsContact O-CZ 3.24Å; E878-R882 PolarHBondContact O-NE 3.41Å; E878-R882 PolarHBondContact O-NH2 2.93Å; Y880-R882 PolarHBondContact O-N 3.34Å; R882-K886 WeakPolarHBondContact O-CG 3.33Å; R882-K886 PolarHBondContact O-N 3.43Å
883	Q	95.1	Very high	94.2	Very high	42 Å²	42	54 Å²	54	20%	0.196	27%	0.27	C	S	.	.	H	α-helix	trans	-77.7	-36.4	179	-53.6	-64.9	15.8	0	0	111.9	G879 Y880 I881 K886 N887 F971	G879-Q883 WeakPolarHBondContact O-CG 3.49Å; Y880-Q883 PolarHBondContact O-N 3.21Å; Y880-Q883 VanDerWaalsContact O-N 3.11Å; I881-Q883 VanDerWaalsContact C-N 3.3Å; I881-Q883 PolarHBondContact O-N 3.4Å; Q883-K886 PolarHBondContact O-N 2.67Å; Q883-N887 PolarHBondContact O-N 2.8Å; Q883-N887 PolarHBondContact O-ND2 3.37Å; Q883-F971 HydrophobicContact CB-CZ 4.04Å
884	C	95.4	Very high	94	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.302	C	S	.	.	H	α-helix	trans	-63.8	-42.2	175.4	-60.8	0	0	0	0	111.2	Y880 I881 N887 F891 L896 F900	Y880-C884 PolarHBondContact O-N 2.71Å; Y880-C884 PolarHBondContact O-SG 3.33Å; I881-C884 PolarHBondContact O-N 2.83Å; C884-N887 CarbonylContact O-C 3.57Å; C884-N887 PolarHBondContact O-N 3.47Å; C884-N887 VanDerWaalsContact O-N 3.07Å; C884-F891 HydrophobicContact CB-CD2 3.83Å; C884-F891 HydrophobicContact CB-CE2 4.01Å; C884-F891 HydrophobicContact CB-CG 4.17Å; C884-F891 HydrophobicContact CB-CZ 4.47Å; C884-L896 HydrophobicContact CB-CD2 3.49Å; C884-L896 VanDerWaalsContact CB-CD2 3.49Å; C884-F900 HydrophobicContact CB-CE2 4.37Å
885	R	95.1	Very high	93.9	Very high	132 Å²	132	57.5 Å²	57.5	50%	0.498	29%	0.291	S	S	.	.	H	α-helix	trans	-61.1	-41.4	174.2	-76.3	-179.1	175.1	137.2	2.1	112.9	I881 N887 L896 E904	I881-R885 HydrophobicContact CG2-CG 4.43Å; I881-R885 WeakPolarHBondContact O-CG 3.12Å; I881-R885 PolarHBondContact O-N 3.03Å; R885-N887 PolarHBondContact O-N 2.7Å; R885-L896 HydrophobicContact CG-CD1 3.73Å; R885-E904 IonicContact CZ-OE1 3.28Å; R885-E904 IonicContact CZ-OE2 2.73Å; R885-E904 VanDerWaalsContact NH1-CD 3.33Å; R885-E904 IonicContact NH1-OE1 2.66Å; R885-E904 PolarHBondContact NH1-OE1 3.26Å; R885-E904 IonicContact NH1-OE2 2.84Å; R885-E904 PolarHBondContact NH1-OE2 3.04Å; R885-E904 IonicContact NH2-OE1 2.99Å; R885-E904 IonicContact NH2-OE2 3.68Å; R885-E904 PolarHBondContact NH2-OE2 3.49Å
886	K	94.1	Very high	94.1	Very high	139 Å²	139	57.8 Å²	57.8	60%	0.604	29%	0.292	S	S	*	.	H	α-helix	trans	-62.1	-23	173.3	-74.4	173.7	-179.4	-179.9	0	113.4	R882 Q883	R882-K886 WeakPolarHBondContact O-CG 3.33Å; R882-K886 PolarHBondContact O-N 3.43Å; Q883-K886 PolarHBondContact O-N 2.67Å
887	N	90.8	Very high	94.1	Very high	52 Å²	52	64.9 Å²	64.9	28%	0.278	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.8	56	-177	-72.7	-92.3	0	0	0	111.3	Q883 C884 R885 S889 M890 F891 F971	Q883-N887 PolarHBondContact O-N 2.8Å; Q883-N887 PolarHBondContact O-ND2 3.37Å; C884-N887 CarbonylContact O-C 3.57Å; C884-N887 PolarHBondContact O-N 3.47Å; C884-N887 VanDerWaalsContact O-N 3.07Å; R885-N887 PolarHBondContact O-N 2.7Å; N887-S889 PolarHBondContact O-N 2.87Å; N887-S889 VanDerWaalsContact O-N 3.15Å; N887-M890 HydrophobicContact CB-CB 4.29Å; N887-M890 WeakPolarHBondContact O-CA 3.46Å; N887-M890 WeakPolarHBondContact O-CB 3.37Å; N887-M890 PolarHBondContact O-N 3.39Å; N887-F891 HydrophobicContact CB-CD2 4.34Å; N887-F891 PolarHBondContact O-N 2.99Å; N887-F971 HydrophobicContact CB-CE2 4.13Å; N887-F971 HydrophobicContact CB-CZ 4.4Å
888	S	88.4	Confident	94	Very high	94 Å²	94	66.6 Å²	66.6	66%	0.657	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-24.2	179	57.1	0	0	0	0	114.3	M890	S888-M890 PolarHBondContact O-N 3.38Å
889	S	90.9	Very high	94.1	Very high	107 Å²	107	63.9 Å²	63.9	75%	0.748	32%	0.321	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.6	-11.8	171	64	0	0	0	0	114.1	N887	N887-S889 PolarHBondContact O-N 2.87Å; N887-S889 VanDerWaalsContact O-N 3.15Å
890	M	93.2	Very high	94.2	Very high	30 Å²	30	64.1 Å²	64.1	15%	0.148	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.8	-35.2	173.1	-68.1	-170.8	51	0	0	112.6	N887 S888 K967 Y968 F971	N887-M890 HydrophobicContact CB-CB 4.29Å; N887-M890 WeakPolarHBondContact O-CA 3.46Å; N887-M890 WeakPolarHBondContact O-CB 3.37Å; N887-M890 PolarHBondContact O-N 3.39Å; S888-M890 PolarHBondContact O-N 3.38Å; M890-K967 HydrophobicContact CE-CD 4.28Å; M890-K967 HydrophobicContact CE-CG 4.19Å; M890-Y968 HydrophobicContact CB-CE1 4.02Å; M890-Y968 HydrophobicContact CE-CD1 3.65Å; M890-Y968 HydrophobicContact CE-CE1 3.83Å; M890-Y968 HydrophobicContact CE-CG 4.28Å; M890-Y968 WeakPolarHBondContact O-CE1 3.44Å; M890-Y968 PolarHBondContact O-OH 2.91Å; M890-F971 HydrophobicContact CE-CB 3.8Å; M890-F971 HydrophobicContact CE-CD2 4.08Å; M890-F971 HydrophobicContact CE-CG 3.9Å; M890-F971 HydrophobicContact SD-CD2 4.14Å
891	F	95.2	Very high	94.2	Very high	4 Å²	4	65.3 Å²	65.3	2%	0.018	33%	0.33	C	S	.	.			trans	-126.3	122.5	-175.3	-55.8	-86	0	0	0	111.8	C884 N887 L896 L962 Y968 F971 F972	C884-F891 HydrophobicContact CB-CD2 3.83Å; C884-F891 HydrophobicContact CB-CE2 4.01Å; C884-F891 HydrophobicContact CB-CG 4.17Å; C884-F891 HydrophobicContact CB-CZ 4.47Å; N887-F891 HydrophobicContact CB-CD2 4.34Å; N887-F891 PolarHBondContact O-N 2.99Å; F891-L896 HydrophobicContact CB-CD2 3.59Å; F891-L896 HydrophobicContact CB-CG 4.07Å; F891-L896 HydrophobicContact CD1-CD2 4.24Å; F891-L896 HydrophobicContact CG-CD2 3.98Å; F891-L962 HydrophobicContact CD1-CD1 4.49Å; F891-L962 HydrophobicContact CE1-CD1 4.16Å; F891-Y968 HydrophobicContact CD1-CE1 4.25Å; F891-Y968 AromaticContact CE1-CD1 3.68Å; F891-Y968 HydrophobicContact CE1-CD1 3.68Å; F891-Y968 AromaticContact CE1-CE1 3.85Å; F891-Y968 HydrophobicContact CE1-CE1 3.85Å; F891-Y968 HydrophobicContact CE2-CD1 4.47Å; F891-Y968 AromaticContact CZ-CD1 3.67Å; F891-Y968 HydrophobicContact CZ-CD1 3.67Å; F891-Y968 HydrophobicContact CZ-CE1 4.03Å; F891-F971 AromaticContact CE2-CD1 3.81Å; F891-F971 HydrophobicContact CE2-CD1 3.81Å; F891-F971 AromaticContact CE2-CE1 3.46Å; F891-F971 HydrophobicContact CE2-CE1 3.46Å; F891-F971 VanDerWaalsContact CE2-CE1 3.46Å; F891-F971 HydrophobicContact CE2-CE2 4.43Å; F891-F971 HydrophobicContact CE2-CG 4.45Å; F891-F971 AromaticContact CE2-CZ 3.81Å; F891-F971 HydrophobicContact CE2-CZ 3.81Å; F891-F971 AromaticContact CZ-CD1 3.71Å; F891-F971 HydrophobicContact CZ-CD1 3.71Å; F891-F971 AromaticContact CZ-CE1 3.68Å; F891-F971 HydrophobicContact CZ-CE1 3.68Å; F891-F971 HydrophobicContact CZ-CZ 4.47Å; F891-F972 HydrophobicContact CE1-CE1 4.41Å; F891-F972 AromaticContact CE1-CE2 3.94Å; F891-F972 HydrophobicContact CE1-CE2 3.94Å; F891-F972 AromaticContact CE1-CZ 3.52Å; F891-F972 HydrophobicContact CE1-CZ 3.52Å; F891-F972 HydrophobicContact CZ-CE1 4.2Å; F891-F972 AromaticContact CZ-CE2 3.98Å; F891-F972 HydrophobicContact CZ-CE2 3.98Å; F891-F972 AromaticContact CZ-CZ 3.63Å; F891-F972 HydrophobicContact CZ-CZ 3.63Å
892	T	94.3	Very high	94.3	Very high	78 Å²	78	65.5 Å²	65.5	48%	0.479	33%	0.331	S	S	.	.			trans	-77.4	151.2	165.9	61.4	0	0	0	0	110.6	L894 Q895 L896	T892-L894 PolarHBondContact O-N 3.23Å; T892-Q895 WeakPolarHBondContact O-CA 3.4Å; T892-Q895 WeakPolarHBondContact O-CB 3.35Å; T892-Q895 PolarHBondContact O-N 3.34Å; T892-Q895 VanDerWaalsContact OG1-CG 3.28Å; T892-Q895 WeakPolarHBondContact OG1-CG 3.42Å; T892-Q895 PolarHBondContact OG1-OE1 2.79Å; T892-L896 PolarHBondContact O-N 2.94Å
893	E	92.8	Very high	94.4	Very high	170 Å²	170	60.2 Å²	60.2	79%	0.794	31%	0.311	S	S	*	.	H	α-helix	trans	-56.7	-37.5	180	-61.6	-179	166.1	0	0	112.8	Q895 L896 K897	E893-Q895 VanDerWaalsContact C-N 3.31Å; E893-Q895 PolarHBondContact O-N 3.29Å; E893-L896 WeakPolarHBondContact O-CB 3.39Å; E893-L896 PolarHBondContact O-N 3.05Å; E893-L896 VanDerWaalsContact O-N 3.15Å; E893-K897 PolarHBondContact O-N 3.32Å
894	L	92.9	Very high	94.5	Very high	130 Å²	130	60.5 Å²	60.5	68%	0.681	31%	0.313	S	S	*	.	H	α-helix	trans	-61.3	-38.4	174.8	-178.6	61.2	0	0	0	112.1	T892 T898	T892-L894 PolarHBondContact O-N 3.23Å; L894-T898 VanDerWaalsContact O-CB 3.32Å; L894-T898 WeakPolarHBondContact O-CB 3.05Å; L894-T898 PolarHBondContact O-N 2.95Å; L894-T898 PolarHBondContact O-OG1 2.99Å
895	Q	94.6	Very high	94.6	Very high	29 Å²	29	64 Å²	64	14%	0.136	33%	0.331	C	S	.	.	H	α-helix	trans	-68.9	-40.4	173.4	-67	169.7	-83.8	0	0	111.3	T892 E893 T898 I899 E958 R961	T892-Q895 WeakPolarHBondContact O-CA 3.4Å; T892-Q895 WeakPolarHBondContact O-CB 3.35Å; T892-Q895 PolarHBondContact O-N 3.34Å; T892-Q895 VanDerWaalsContact OG1-CG 3.28Å; T892-Q895 WeakPolarHBondContact OG1-CG 3.42Å; T892-Q895 PolarHBondContact OG1-OE1 2.79Å; E893-Q895 VanDerWaalsContact C-N 3.31Å; E893-Q895 PolarHBondContact O-N 3.29Å; Q895-T898 PolarHBondContact O-N 3.01Å; Q895-I899 HydrophobicContact CB-CD1 4.44Å; Q895-I899 WeakPolarHBondContact O-CB 3.34Å; Q895-I899 WeakPolarHBondContact O-CD1 3.44Å; Q895-I899 WeakPolarHBondContact O-CG1 3.49Å; Q895-I899 PolarHBondContact O-N 3.26Å; Q895-E958 WeakPolarHBondContact CG-OE1 3.41Å; Q895-E958 PolarHBondContact NE2-OE1 3.28Å; Q895-R961 VanDerWaalsContact NE2-NH2 3.17Å
896	L	95.5	Very high	94.7	Very high	19 Å²	19	57.7 Å²	57.7	10%	0.099	31%	0.308	C	S	.	.	H	α-helix	trans	-59.6	-47.9	175.5	-60.4	-178.3	0	0	0	110.9	C884 R885 F891 T892 E893 T898 I899 F900	C884-L896 HydrophobicContact CB-CD2 3.49Å; C884-L896 VanDerWaalsContact CB-CD2 3.49Å; R885-L896 HydrophobicContact CG-CD1 3.73Å; F891-L896 HydrophobicContact CB-CD2 3.59Å; F891-L896 HydrophobicContact CB-CG 4.07Å; F891-L896 HydrophobicContact CD1-CD2 4.24Å; F891-L896 HydrophobicContact CG-CD2 3.98Å; T892-L896 PolarHBondContact O-N 2.94Å; E893-L896 WeakPolarHBondContact O-CB 3.39Å; E893-L896 PolarHBondContact O-N 3.05Å; E893-L896 VanDerWaalsContact O-N 3.15Å; L896-T898 VanDerWaalsContact C-N 3.33Å; L896-T898 PolarHBondContact O-N 3.4Å; L896-I899 PolarHBondContact O-N 3.44Å; L896-F900 HydrophobicContact CD2-CD2 4.36Å; L896-F900 HydrophobicContact CD2-CE2 4.05Å; L896-F900 WeakPolarHBondContact O-CB 3.2Å; L896-F900 WeakPolarHBondContact O-CD2 3.48Å; L896-F900 PolarHBondContact O-N 3.4Å
897	K	95.3	Very high	94.9	Very high	150 Å²	150	53 Å²	53	65%	0.652	29%	0.287	S	S	*	.	H	α-helix	trans	-62.1	-38.2	175	-172.7	167.7	-177	170.1	0	112.2	E893 S901	E893-K897 PolarHBondContact O-N 3.32Å; K897-S901 VanDerWaalsContact O-CA 3.28Å; K897-S901 WeakPolarHBondContact O-CA 3.45Å; K897-S901 PolarHBondContact O-N 3.41Å
898	T	95.1	Very high	95.2	Very high	48 Å²	48	58.2 Å²	58.2	29%	0.294	30%	0.302	S	S	.	.	H	α-helix	trans	-67.7	-34.8	176.7	-57.4	0	0	0	0	112.8	L894 Q895 L896 A954 A955 E958	L894-T898 VanDerWaalsContact O-CB 3.32Å; L894-T898 WeakPolarHBondContact O-CB 3.05Å; L894-T898 PolarHBondContact O-N 2.95Å; L894-T898 PolarHBondContact O-OG1 2.99Å; Q895-T898 PolarHBondContact O-N 3.01Å; L896-T898 VanDerWaalsContact C-N 3.33Å; L896-T898 PolarHBondContact O-N 3.4Å; T898-A954 HydrophobicContact CG2-CB 4.33Å; T898-A955 WeakPolarHBondContact O-CA 3.43Å; T898-A955 VanDerWaalsContact O-CB 3.24Å; T898-A955 WeakPolarHBondContact O-CB 3.34Å; T898-A955 PolarHBondContact O-N 3.47Å; T898-E958 HydrophobicContact CG2-CB 4.11Å; T898-E958 HydrophobicContact CG2-CG 4.5Å
899	I	96.2	Very high	95.6	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-84.5	-46.3	-175.8	-70.9	165.5	0	0	0	112	Q895 L896 A955 E958 L959 L962 L990	Q895-I899 HydrophobicContact CB-CD1 4.44Å; Q895-I899 WeakPolarHBondContact O-CB 3.34Å; Q895-I899 WeakPolarHBondContact O-CD1 3.44Å; Q895-I899 WeakPolarHBondContact O-CG1 3.49Å; Q895-I899 PolarHBondContact O-N 3.26Å; L896-I899 PolarHBondContact O-N 3.44Å; I899-A955 VanDerWaalsContact O-CB 3.31Å; I899-A955 WeakPolarHBondContact O-CB 3.48Å; I899-E958 HydrophobicContact CD1-CG 3.91Å; I899-E958 HydrophobicContact CG1-CB 4.29Å; I899-E958 HydrophobicContact CG1-CG 3.71Å; I899-L959 HydrophobicContact CB-CD1 4.13Å; I899-L959 HydrophobicContact CD1-CD1 4.1Å; I899-L959 HydrophobicContact CG1-CD1 3.74Å; I899-L959 HydrophobicContact CG2-CD1 3.4Å; I899-L962 HydrophobicContact CD1-CD1 3.64Å; I899-L990 HydrophobicContact CG2-CD1 4.04Å
900	F	96.7	Very high	96	Very high	6 Å²	6	49.7 Å²	49.7	3%	0.026	24%	0.24	C	C	.	.	H	α-helix	trans	-101.3	-16.8	-170.6	-62.3	-73.2	0	0	0	113.2	I876 I881 C884 L896 N902 I903 I986 L990	I876-F900 HydrophobicContact CG2-CD1 4.11Å; I876-F900 HydrophobicContact CG2-CE1 4.12Å; I881-F900 HydrophobicContact CD1-CB 3.86Å; I881-F900 HydrophobicContact CD1-CD1 3.77Å; I881-F900 HydrophobicContact CD1-CE1 4.47Å; I881-F900 HydrophobicContact CD1-CG 3.81Å; I881-F900 HydrophobicContact CG1-CB 4.2Å; I881-F900 HydrophobicContact CG1-CD1 3.44Å; I881-F900 VanDerWaalsContact CG1-CD1 3.44Å; I881-F900 HydrophobicContact CG1-CD2 3.95Å; I881-F900 HydrophobicContact CG1-CE1 3.67Å; I881-F900 HydrophobicContact CG1-CE2 4.16Å; I881-F900 HydrophobicContact CG1-CG 3.59Å; I881-F900 HydrophobicContact CG1-CZ 4.04Å; C884-F900 HydrophobicContact CB-CE2 4.37Å; L896-F900 HydrophobicContact CD2-CD2 4.36Å; L896-F900 HydrophobicContact CD2-CE2 4.05Å; L896-F900 WeakPolarHBondContact O-CB 3.2Å; L896-F900 WeakPolarHBondContact O-CD2 3.48Å; L896-F900 PolarHBondContact O-N 3.4Å; F900-N902 PolarHBondContact O-N 2.92Å; F900-I903 HydrophobicContact CB-CG2 4.04Å; F900-I903 VanDerWaalsContact O-CB 3.3Å; F900-I903 WeakPolarHBondContact O-CB 3.47Å; F900-I903 WeakPolarHBondContact O-CG2 2.99Å; F900-I903 PolarHBondContact O-N 2.92Å; F900-I903 VanDerWaalsContact O-N 3.16Å; F900-I986 HydrophobicContact CE1-CD1 4.03Å; F900-I986 HydrophobicContact CZ-CD1 4.07Å; F900-L990 HydrophobicContact CD1-CD2 3.9Å; F900-L990 HydrophobicContact CE1-CD2 4.34Å
901	S	95.9	Very high	96.1	Very high	27 Å²	27	54.2 Å²	54.2	19%	0.189	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.5	-133.8	-177.2	-158.2	0	0	0	0	111.7	K897 T951	K897-S901 VanDerWaalsContact O-CA 3.28Å; K897-S901 WeakPolarHBondContact O-CA 3.45Å; K897-S901 PolarHBondContact O-N 3.41Å; S901-T951 VanDerWaalsContact CB-OG1 3.27Å; S901-T951 WeakPolarHBondContact CB-OG1 3.4Å; S901-T951 WeakPolarHBondContact OG-CB 3.44Å; S901-T951 PolarHBondContact OG-OG1 3.1Å
902	N	96.6	Very high	96.2	Very high	8 Å²	8	57.3 Å²	57.3	4%	0.043	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	27.7	179.3	65.5	-17.5	0	0	0	112.3	F900 E904 D905 I906 I944 E947 Y948	F900-N902 PolarHBondContact O-N 2.92Å; N902-E904 PolarHBondContact O-N 3.4Å; N902-D905 HydrophobicContact CB-CB 4.49Å; N902-D905 WeakPolarHBondContact O-CB 3.44Å; N902-D905 PolarHBondContact O-N 3.45Å; N902-I906 PolarHBondContact O-N 3.16Å; N902-I906 VanDerWaalsContact O-N 3.11Å; N902-I944 PolarHBondContact ND2-O 2.77Å; N902-E947 PolarHBondContact ND2-OE2 2.75Å; N902-Y948 WeakPolarHBondContact OD1-CB 3.25Å; N902-Y948 WeakPolarHBondContact OD1-CD2 3.28Å
903	I	97.8	Very high	96.3	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-63.5	-25.3	-177.4	-161	168.8	0	0	0	113.4	L873 I876 I881 F900 D905 I906 Y907 Y948 L990 P993	L873-I903 HydrophobicContact CD2-CD1 3.99Å; L873-I903 HydrophobicContact CD2-CG1 3.79Å; I876-I903 HydrophobicContact CD1-CD1 3.82Å; I876-I903 HydrophobicContact CG2-CD1 4.13Å; I881-I903 HydrophobicContact CD1-CG2 3.6Å; F900-I903 HydrophobicContact CB-CG2 4.04Å; F900-I903 VanDerWaalsContact O-CB 3.3Å; F900-I903 WeakPolarHBondContact O-CB 3.47Å; F900-I903 WeakPolarHBondContact O-CG2 2.99Å; F900-I903 PolarHBondContact O-N 2.92Å; F900-I903 VanDerWaalsContact O-N 3.16Å; I903-D905 VanDerWaalsContact C-N 3.27Å; I903-D905 PolarHBondContact O-N 2.87Å; I903-I906 PolarHBondContact O-N 3.46Å; I903-Y907 PolarHBondContact O-N 3.2Å; I903-Y948 HydrophobicContact CB-CD2 4.39Å; I903-Y948 HydrophobicContact CB-CE2 3.82Å; I903-Y948 HydrophobicContact CD1-CE2 4.28Å; I903-Y948 HydrophobicContact CG1-CE2 4.26Å; I903-L990 HydrophobicContact CD1-CD2 4.03Å; I903-P993 HydrophobicContact CD1-CG 4.06Å; I903-P993 HydrophobicContact CG1-CG 4.43Å
904	E	97.3	Very high	96.5	Very high	48 Å²	48	46 Å²	46	22%	0.224	21%	0.212	C	C	.	.	H	α-helix	trans	-67.6	-29.9	173.3	-61.4	-167.6	126.1	0	0	112	I881 R885 N902 Y907 R908	I881-E904 HydrophobicContact CD1-CG 3.75Å; R885-E904 IonicContact CZ-OE1 3.28Å; R885-E904 IonicContact CZ-OE2 2.73Å; R885-E904 VanDerWaalsContact NH1-CD 3.33Å; R885-E904 IonicContact NH1-OE1 2.66Å; R885-E904 PolarHBondContact NH1-OE1 3.26Å; R885-E904 IonicContact NH1-OE2 2.84Å; R885-E904 PolarHBondContact NH1-OE2 3.04Å; R885-E904 IonicContact NH2-OE1 2.99Å; R885-E904 IonicContact NH2-OE2 3.68Å; R885-E904 PolarHBondContact NH2-OE2 3.49Å; N902-E904 PolarHBondContact O-N 3.4Å; E904-Y907 PolarHBondContact O-N 3.34Å; E904-R908 VanDerWaalsContact O-CG 3.25Å; E904-R908 WeakPolarHBondContact O-CG 3.4Å; E904-R908 PolarHBondContact O-N 3.35Å
905	D	97.4	Very high	96.7	Very high	73 Å²	73	45 Å²	45	39%	0.39	20%	0.199	S	C	.	.	H	α-helix	trans	-79.4	-36.4	176	-53.9	-58.3	0	0	0	110.8	N902 I903 Y907 R908 F909	N902-D905 HydrophobicContact CB-CB 4.49Å; N902-D905 WeakPolarHBondContact O-CB 3.44Å; N902-D905 PolarHBondContact O-N 3.45Å; I903-D905 VanDerWaalsContact C-N 3.27Å; I903-D905 PolarHBondContact O-N 2.87Å; D905-Y907 VanDerWaalsContact C-N 3.3Å; D905-Y907 PolarHBondContact O-N 3.36Å; D905-R908 PolarHBondContact O-N 2.95Å; D905-R908 IonicContact OD1-NE 2.62Å; D905-F909 WeakPolarHBondContact O-CB 3.47Å; D905-F909 PolarHBondContact O-N 3.13Å
906	I	97.9	Very high	96.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-57.9	-43	166.6	-65.7	175.8	0	0	0	110.7	Y869 L873 N902 I903 F909 Q910 I944 Y945 Y948 P993	Y869-I906 WeakPolarHBondContact OH-CG2 3.48Å; L873-I906 HydrophobicContact CD1-CG2 3.96Å; L873-I906 HydrophobicContact CD2-CG2 4.16Å; N902-I906 PolarHBondContact O-N 3.16Å; N902-I906 VanDerWaalsContact O-N 3.11Å; I903-I906 PolarHBondContact O-N 3.46Å; I906-F909 PolarHBondContact O-N 3.18Å; I906-Q910 VanDerWaalsContact O-CB 3.26Å; I906-Q910 WeakPolarHBondContact O-CB 3.45Å; I906-Q910 PolarHBondContact O-N 3.25Å; I906-I944 HydrophobicContact CB-CD1 4.46Å; I906-I944 HydrophobicContact CG1-CD1 3.93Å; I906-I944 HydrophobicContact CG1-CG1 3.97Å; I906-Y945 HydrophobicContact CD1-CD1 4.21Å; I906-Y945 HydrophobicContact CD1-CE1 4.44Å; I906-Y945 HydrophobicContact CD1-CG 4.41Å; I906-Y945 HydrophobicContact CG2-CE1 4.01Å; I906-Y945 HydrophobicContact CG2-CE2 4.29Å; I906-Y948 HydrophobicContact CD1-CD1 4.38Å; I906-Y948 HydrophobicContact CD1-CD2 3.89Å; I906-Y948 HydrophobicContact CD1-CG 3.71Å; I906-P993 HydrophobicContact CD1-CB 4.18Å
907	Y	98.1	Very high	96.7	Very high	41 Å²	41	44.4 Å²	44.4	16%	0.161	20%	0.196	C	C	.	.	H	α-helix	trans	-64	-42.7	175.6	177.6	-134.6	0	0	0	112.6	I870 L873 K874 C877 I903 E904 D905 Q910 R911	I870-Y907 HydrophobicContact CD1-CE2 4.43Å; I870-Y907 HydrophobicContact CG1-CD2 4.11Å; I870-Y907 HydrophobicContact CG1-CE2 3.87Å; L873-Y907 HydrophobicContact CB-CD2 3.73Å; L873-Y907 HydrophobicContact CB-CG 4.19Å; K874-Y907 HydrophobicContact CB-CE2 3.82Å; K874-Y907 WeakPolarHBondContact CG-OH 3.36Å; C877-Y907 HydrophobicContact CB-CD1 4.29Å; I903-Y907 PolarHBondContact O-N 3.2Å; E904-Y907 PolarHBondContact O-N 3.34Å; D905-Y907 VanDerWaalsContact C-N 3.3Å; D905-Y907 PolarHBondContact O-N 3.36Å; Y907-Q910 PolarHBondContact O-N 3.38Å; Y907-R911 WeakPolarHBondContact O-CB 3.25Å; Y907-R911 PolarHBondContact O-N 3.01Å
908	R	97.4	Very high	96.8	Very high	161 Å²	161	41.4 Å²	41.4	61%	0.608	18%	0.184	S	C	*	.	H	α-helix	trans	-60.8	-47.9	175	-70.4	165.2	-168.4	-147.9	4.3	111.7	E904 D905 R911 Q912	E904-R908 VanDerWaalsContact O-CG 3.25Å; E904-R908 WeakPolarHBondContact O-CG 3.4Å; E904-R908 PolarHBondContact O-N 3.35Å; D905-R908 PolarHBondContact O-N 2.95Å; D905-R908 IonicContact OD1-NE 2.62Å; R908-R911 PolarHBondContact O-N 3.33Å; R908-Q912 PolarHBondContact O-N 2.89Å
909	F	97.3	Very high	96.8	Very high	22 Å²	22	46.5 Å²	46.5	10%	0.096	20%	0.202	C	C	.	.	H	α-helix	trans	-58.7	-52.4	175.8	168.7	-99.2	0	0	0	111.4	D905 I906 R911 Q912 F913 Q938 F942 I944 Y945	D905-F909 WeakPolarHBondContact O-CB 3.47Å; D905-F909 PolarHBondContact O-N 3.13Å; I906-F909 PolarHBondContact O-N 3.18Å; F909-R911 PolarHBondContact O-N 3.09Å; F909-Q912 WeakPolarHBondContact O-CA 3.39Å; F909-Q912 WeakPolarHBondContact O-CB 3.4Å; F909-Q912 PolarHBondContact O-N 3.43Å; F909-F913 HydrophobicContact CE1-CB 4.36Å; F909-F913 HydrophobicContact CZ-CB 4.35Å; F909-F913 PolarHBondContact O-N 3.19Å; F909-Q938 HydrophobicContact CE2-CB 3.94Å; F909-Q938 HydrophobicContact CE2-CG 3.86Å; F909-Q938 HydrophobicContact CZ-CB 4.13Å; F909-Q938 HydrophobicContact CZ-CG 3.98Å; F909-F942 AromaticContact CE1-CD1 3.68Å; F909-F942 HydrophobicContact CE1-CD1 3.68Å; F909-F942 AromaticContact CE1-CE1 3.63Å; F909-F942 HydrophobicContact CE1-CE1 3.63Å; F909-F942 HydrophobicContact CE1-CG 4.36Å; F909-F942 HydrophobicContact CE1-CZ 4.27Å; F909-F942 AromaticContact CZ-CD1 3.69Å; F909-F942 HydrophobicContact CZ-CD1 3.69Å; F909-F942 HydrophobicContact CZ-CD2 4.15Å; F909-F942 AromaticContact CZ-CE1 3.64Å; F909-F942 HydrophobicContact CZ-CE1 3.64Å; F909-F942 HydrophobicContact CZ-CE2 4.1Å; F909-F942 AromaticContact CZ-CG 3.96Å; F909-F942 HydrophobicContact CZ-CG 3.96Å; F909-F942 AromaticContact CZ-CZ 3.85Å; F909-F942 HydrophobicContact CZ-CZ 3.85Å; F909-I944 HydrophobicContact CB-CD1 3.54Å; F909-I944 HydrophobicContact CD1-CD1 4.2Å; F909-I944 HydrophobicContact CG-CD1 3.85Å; F909-Y945 HydrophobicContact CD1-CE2 4.04Å; F909-Y945 HydrophobicContact CE1-CE2 4.02Å
910	Q	97.8	Very high	96.8	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-59.3	-36.7	179.9	-166	69.1	22.5	0	0	111.1	E866 Y869 I870 L873 I906 Y907 Q912 F913 V914 Y945 Y1000	E866-Q910 PolarHBondContact OE2-NE2 3.01Å; Y869-Q910 HydrophobicContact CD1-CG 4.02Å; Y869-Q910 HydrophobicContact CE1-CG 4.06Å; I870-Q910 HydrophobicContact CB-CG 4Å; I870-Q910 HydrophobicContact CD1-CG 4.33Å; I870-Q910 HydrophobicContact CG1-CG 4.14Å; L873-Q910 HydrophobicContact CD1-CB 3.74Å; L873-Q910 HydrophobicContact CD1-CG 3.93Å; I906-Q910 VanDerWaalsContact O-CB 3.26Å; I906-Q910 WeakPolarHBondContact O-CB 3.45Å; I906-Q910 PolarHBondContact O-N 3.25Å; Y907-Q910 PolarHBondContact O-N 3.38Å; Q910-Q912 VanDerWaalsContact C-N 3.26Å; Q910-Q912 PolarHBondContact O-N 3.28Å; Q910-F913 PolarHBondContact O-N 3.25Å; Q910-V914 HydrophobicContact CG-CG2 4.11Å; Q910-V914 WeakPolarHBondContact O-CB 3.45Å; Q910-V914 VanDerWaalsContact O-CG2 3.32Å; Q910-V914 WeakPolarHBondContact O-CG2 3.09Å; Q910-V914 PolarHBondContact O-N 3.23Å; Q910-Y945 PolarHBondContact OE1-OH 3.46Å; Q910-Y1000 PolarHBondContact OE1-OH 3.26Å
911	R	96.9	Very high	96.8	Very high	125 Å²	125	51.6 Å²	51.6	47%	0.472	22%	0.224	S	C	.	.	H	α-helix	trans	-69.5	-15.7	174.5	-152.1	-170.3	81.5	-135.4	4	114.1	I870 Y907 R908 F909 R915	I870-R911 HydrophobicContact CD1-CB 3.87Å; I870-R911 HydrophobicContact CD1-CG 3.94Å; Y907-R911 WeakPolarHBondContact O-CB 3.25Å; Y907-R911 PolarHBondContact O-N 3.01Å; R908-R911 PolarHBondContact O-N 3.33Å; F909-R911 PolarHBondContact O-N 3.09Å; R911-R915 VanDerWaalsContact O-CZ 3.25Å; R911-R915 PolarHBondContact O-NE 2.98Å; R911-R915 PolarHBondContact O-NH2 3.37Å
912	Q	96.1	Very high	96.7	Very high	69 Å²	69	52.8 Å²	52.8	32%	0.322	23%	0.228	S	C	.	.	H	α-helix	trans	-86.3	-48.5	165.2	-171.8	65.4	44.1	0	0	110.6	R908 F909 Q910 V914 R915 E916	R908-Q912 PolarHBondContact O-N 2.89Å; F909-Q912 WeakPolarHBondContact O-CA 3.39Å; F909-Q912 WeakPolarHBondContact O-CB 3.4Å; F909-Q912 PolarHBondContact O-N 3.43Å; Q910-Q912 VanDerWaalsContact C-N 3.26Å; Q910-Q912 PolarHBondContact O-N 3.28Å; Q912-V914 PolarHBondContact O-N 2.87Å; Q912-R915 PolarHBondContact O-N 3.46Å; Q912-R915 VanDerWaalsContact O-N 3.07Å; Q912-E916 PolarHBondContact NE2-OE1 2.95Å; Q912-E916 PolarHBondContact O-N 3.21Å; Q912-E916 VanDerWaalsContact O-N 3.16Å
913	F	96.9	Very high	96.5	Very high	0 Å²	0	60 Å²	60	0%	0	26%	0.259	C	S	.	.	H	α-helix	trans	-56.7	-46.2	-177	-179.3	-121.4	0	0	0	113	F909 Q910 R915 E916 L917 C934 F935 Q938 F942 Y1000	F909-F913 HydrophobicContact CE1-CB 4.36Å; F909-F913 HydrophobicContact CZ-CB 4.35Å; F909-F913 PolarHBondContact O-N 3.19Å; Q910-F913 PolarHBondContact O-N 3.25Å; F913-R915 VanDerWaalsContact C-N 3.32Å; F913-R915 PolarHBondContact O-N 3.39Å; F913-E916 PolarHBondContact O-N 3.46Å; F913-L917 HydrophobicContact CD1-CD1 4.04Å; F913-L917 HydrophobicContact CE1-CD1 3.54Å; F913-L917 HydrophobicContact CE1-CG 4.46Å; F913-L917 HydrophobicContact CE2-CD1 4.15Å; F913-L917 HydrophobicContact CE2-CG 4.22Å; F913-L917 HydrophobicContact CZ-CD1 3.6Å; F913-L917 HydrophobicContact CZ-CD2 4.44Å; F913-L917 HydrophobicContact CZ-CG 4.12Å; F913-L917 PolarHBondContact O-N 2.87Å; F913-C934 HydrophobicContact CE2-CB 4.34Å; F913-F935 HydrophobicContact CE1-CE1 4.3Å; F913-F935 HydrophobicContact CE1-CZ 4.47Å; F913-F935 HydrophobicContact CE2-CD1 4.2Å; F913-F935 HydrophobicContact CE2-CD2 4.5Å; F913-F935 HydrophobicContact CE2-CE1 4.39Å; F913-F935 HydrophobicContact CE2-CG 4.27Å; F913-F935 AromaticContact CZ-CD1 3.77Å; F913-F935 HydrophobicContact CZ-CD1 3.77Å; F913-F935 HydrophobicContact CZ-CD2 4.28Å; F913-F935 AromaticContact CZ-CE1 3.53Å; F913-F935 HydrophobicContact CZ-CE1 3.53Å; F913-F935 HydrophobicContact CZ-CE2 4.05Å; F913-F935 HydrophobicContact CZ-CG 4.15Å; F913-F935 AromaticContact CZ-CZ 3.69Å; F913-F935 HydrophobicContact CZ-CZ 3.69Å; F913-Q938 HydrophobicContact CD2-CG 3.76Å; F913-Q938 HydrophobicContact CE2-CG 4.4Å; F913-F942 HydrophobicContact CD2-CZ 4.32Å; F913-F942 HydrophobicContact CE1-CZ 4.34Å; F913-F942 HydrophobicContact CE2-CZ 4.01Å; F913-F942 HydrophobicContact CZ-CZ 4.02Å; F913-Y1000 HydrophobicContact CE1-CE1 4.01Å
914	V	97.1	Very high	96.3	Very high	9 Å²	9	67.7 Å²	67.7	6%	0.055	30%	0.295	C	S	.	.	H	α-helix	trans	-63.7	-35.3	177.1	177.1	0	0	0	0	112.2	E866 I870 Q910 Q912 L917 E918	E866-V914 HydrophobicContact CB-CG2 3.93Å; E866-V914 HydrophobicContact CG-CG2 4.49Å; I870-V914 HydrophobicContact CB-CG2 4.48Å; I870-V914 HydrophobicContact CD1-CB 4.41Å; I870-V914 HydrophobicContact CD1-CG2 4.26Å; Q910-V914 HydrophobicContact CG-CG2 4.11Å; Q910-V914 WeakPolarHBondContact O-CB 3.45Å; Q910-V914 VanDerWaalsContact O-CG2 3.32Å; Q910-V914 WeakPolarHBondContact O-CG2 3.09Å; Q910-V914 PolarHBondContact O-N 3.23Å; Q912-V914 PolarHBondContact O-N 2.87Å; V914-L917 PolarHBondContact O-N 3.16Å; V914-E918 HydrophobicContact CG1-CG 4.22Å; V914-E918 WeakPolarHBondContact O-CB 2.99Å; V914-E918 WeakPolarHBondContact O-CG 3.36Å; V914-E918 PolarHBondContact O-N 3.11Å
915	R	95.9	Very high	96.1	Very high	110 Å²	110	70 Å²	70	42%	0.415	31%	0.306	S	S	.	.	H	α-helix	trans	-67.9	-36.8	177	-83.8	-176.6	-71	128.5	6.1	112.9	R911 Q912 F913 K919	R911-R915 VanDerWaalsContact O-CZ 3.25Å; R911-R915 PolarHBondContact O-NE 2.98Å; R911-R915 PolarHBondContact O-NH2 3.37Å; Q912-R915 PolarHBondContact O-N 3.46Å; Q912-R915 VanDerWaalsContact O-N 3.07Å; F913-R915 VanDerWaalsContact C-N 3.32Å; F913-R915 PolarHBondContact O-N 3.39Å; R915-K919 VanDerWaalsContact O-CB 3.28Å; R915-K919 WeakPolarHBondContact O-CB 3.28Å; R915-K919 PolarHBondContact O-N 3.44Å; R915-K919 VanDerWaalsContact O-N 3.15Å
916	E	95.6	Very high	95.9	Very high	36 Å²	36	67.1 Å²	67.1	17%	0.168	29%	0.291	C	S	.	.	H	α-helix	trans	-72.4	-35.9	174	-58.8	-49.6	137.6	0	0	111.8	Q912 F913 K919 K920 C934 M937	Q912-E916 PolarHBondContact NE2-OE1 2.95Å; Q912-E916 PolarHBondContact O-N 3.21Å; Q912-E916 VanDerWaalsContact O-N 3.16Å; F913-E916 PolarHBondContact O-N 3.46Å; E916-K919 PolarHBondContact O-N 2.97Å; E916-K919 IonicContact OE2-NZ 2.64Å; E916-K919 PolarHBondContact OE2-NZ 3.03Å; E916-K920 PolarHBondContact O-N 3.49Å; E916-K920 VanDerWaalsContact O-N 3.14Å; E916-C934 VanDerWaalsContact C-SG 3.57Å; E916-C934 PolarHBondContact O-SG 3.41Å; E916-M937 HydrophobicContact CB-CE 4.3Å
917	L	96	Very high	95.7	Very high	0 Å²	0	68.9 Å²	68.9	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-61.2	-48.4	171.1	-77	173.3	0	0	0	112.2	M863 E866 F913 V914 K919 K920 Y921 I931 C934 F935	M863-L917 HydrophobicContact CE-CB 4Å; M863-L917 HydrophobicContact SD-CB 3.94Å; E866-L917 HydrophobicContact CG-CD1 3.69Å; F913-L917 HydrophobicContact CD1-CD1 4.04Å; F913-L917 HydrophobicContact CE1-CD1 3.54Å; F913-L917 HydrophobicContact CE1-CG 4.46Å; F913-L917 HydrophobicContact CE2-CD1 4.15Å; F913-L917 HydrophobicContact CE2-CG 4.22Å; F913-L917 HydrophobicContact CZ-CD1 3.6Å; F913-L917 HydrophobicContact CZ-CD2 4.44Å; F913-L917 HydrophobicContact CZ-CG 4.12Å; F913-L917 PolarHBondContact O-N 2.87Å; V914-L917 PolarHBondContact O-N 3.16Å; L917-K919 PolarHBondContact O-N 3.47Å; L917-K920 CarbonylContact O-C 3.51Å; L917-K920 PolarHBondContact O-N 2.89Å; L917-Y921 WeakPolarHBondContact O-CB 3.26Å; L917-Y921 PolarHBondContact O-N 3.09Å; L917-I931 HydrophobicContact CD2-CB 3.82Å; L917-I931 HydrophobicContact CD2-CG2 3.99Å; L917-C934 HydrophobicContact CD2-CB 3.68Å; L917-C934 HydrophobicContact CG-CB 4.1Å; L917-F935 HydrophobicContact CD2-CE2 4.37Å
918	E	96.3	Very high	95.6	Very high	86 Å²	86	70.5 Å²	70.5	40%	0.402	31%	0.31	S	S	.	.	H	α-helix	trans	-66	-23.3	179.5	-72.1	-173.2	133.6	0	0	113.2	M863 R867 V914	M863-E918 HydrophobicContact CE-CB 4.22Å; M863-E918 HydrophobicContact CE-CG 3.38Å; R867-E918 IonicContact CZ-OE1 3.55Å; R867-E918 VanDerWaalsContact CZ-OE1 3.24Å; R867-E918 IonicContact NE-OE1 2.73Å; R867-E918 PolarHBondContact NE-OE1 3.41Å; R867-E918 IonicContact NH2-OE1 2.91Å; R867-E918 PolarHBondContact NH2-OE1 3.26Å; V914-E918 HydrophobicContact CG1-CG 4.22Å; V914-E918 WeakPolarHBondContact O-CB 2.99Å; V914-E918 WeakPolarHBondContact O-CG 3.36Å; V914-E918 PolarHBondContact O-N 3.11Å
919	K	95.9	Very high	95.6	Very high	155 Å²	155	62.9 Å²	62.9	67%	0.674	28%	0.281	S	S	*	.	H	α-helix	trans	-80.4	-20.1	172	174.2	178	154.5	-153.7	0	113.7	R915 E916 L917	R915-K919 VanDerWaalsContact O-CB 3.28Å; R915-K919 WeakPolarHBondContact O-CB 3.28Å; R915-K919 PolarHBondContact O-N 3.44Å; R915-K919 VanDerWaalsContact O-N 3.15Å; E916-K919 PolarHBondContact O-N 2.97Å; E916-K919 IonicContact OE2-NZ 2.64Å; E916-K919 PolarHBondContact OE2-NZ 3.03Å; L917-K919 PolarHBondContact O-N 3.47Å
920	K	95.3	Very high	95.5	Very high	70 Å²	70	63.8 Å²	63.8	30%	0.304	29%	0.286	S	S	.	.	H	α-helix	trans	-100.5	-9.1	173.8	-82.9	-62.3	-149.5	175	0	114	E916 L917 S929 E930 I931 S933 C934	E916-K920 PolarHBondContact O-N 3.49Å; E916-K920 VanDerWaalsContact O-N 3.14Å; L917-K920 CarbonylContact O-C 3.51Å; L917-K920 PolarHBondContact O-N 2.89Å; K920-S929 WeakPolarHBondContact O-CA 3.48Å; K920-S929 WeakPolarHBondContact O-CB 3.5Å; K920-E930 HydrophobicContact CD-CB 4.11Å; K920-E930 IonicContact NZ-OE2 2.76Å; K920-E930 PolarHBondContact NZ-OE2 2.79Å; K920-E930 PolarHBondContact O-N 2.91Å; K920-I931 HydrophobicContact CB-CG2 4.28Å; K920-S933 VanDerWaalsContact CE-OG 3.31Å; K920-S933 WeakPolarHBondContact CE-OG 3.02Å; K920-C934 VanDerWaalsContact CG-SG 3.54Å
921	Y	96.4	Very high	95.5	Very high	44 Å²	44	63.8 Å²	63.8	17%	0.173	29%	0.286	C	S	.	.			trans	-77.1	118.2	176.6	179.1	-100.9	0	0	0	111.2	V859 M863 L917 K923 P926	V859-Y921 HydrophobicContact CG1-CD2 3.82Å; V859-Y921 HydrophobicContact CG1-CE2 3.88Å; M863-Y921 HydrophobicContact CE-CG 4.33Å; M863-Y921 HydrophobicContact CG-CD2 3.53Å; M863-Y921 HydrophobicContact CG-CE2 3.91Å; M863-Y921 HydrophobicContact CG-CG 4.17Å; M863-Y921 HydrophobicContact SD-CD2 4.27Å; L917-Y921 WeakPolarHBondContact O-CB 3.26Å; L917-Y921 PolarHBondContact O-N 3.09Å; Y921-K923 HydrophobicContact CD1-CG 4.16Å; Y921-K923 HydrophobicContact CE1-CB 4.47Å; Y921-K923 HydrophobicContact CE1-CG 4.03Å; Y921-P926 HydrophobicContact CE2-CB 3.98Å
922	N	94.7	Very high	95.4	Very high	51 Å²	51	57.9 Å²	57.9	27%	0.273	26%	0.263	S	S	.	.			trans	-79.3	129	168.1	-173.4	-8.7	0	0	0	108.9	E924 E925 P926 S929	N922-E924 PolarHBondContact OD1-N 2.77Å; N922-E924 VanDerWaalsContact OD1-N 3.09Å; N922-E925 WeakPolarHBondContact CB-O 3.32Å; N922-E925 PolarHBondContact ND2-O 2.84Å; N922-E925 PolarHBondContact OD1-N 2.83Å; N922-P926 WeakPolarHBondContact O-CA 3.45Å; N922-S929 PolarHBondContact N-OG 2.74Å
923	K	92.5	Very high	95.4	Very high	160 Å²	160	56.1 Å²	56.1	70%	0.696	26%	0.259	S	S	*	.	S	Bend	trans	-80.3	-41.8	179.5	-69.4	-176.9	179.6	-178.6	0	112.5	Y921	Y921-K923 HydrophobicContact CD1-CG 4.16Å; Y921-K923 HydrophobicContact CE1-CB 4.47Å; Y921-K923 HydrophobicContact CE1-CG 4.03Å
924	E	92.8	Very high	95.3	Very high	162 Å²	162	56.1 Å²	56.1	76%	0.757	26%	0.259	S	S	*	.	S	Bend	trans	-79.6	-40.8	-173.3	-42.7	-48	130	0	0	110.8	N922	N922-E924 PolarHBondContact OD1-N 2.77Å; N922-E924 VanDerWaalsContact OD1-N 3.09Å
925	E	92.9	Very high	95.3	Very high	97 Å²	97	56 Å²	56	45%	0.453	26%	0.258	S	S	.	.			trans	-127.9	77.9	179.2	-61.3	173.4	114.6	0	0	110.8	N922 H927 L928	N922-E925 WeakPolarHBondContact CB-O 3.32Å; N922-E925 PolarHBondContact ND2-O 2.84Å; N922-E925 PolarHBondContact OD1-N 2.83Å; E925-H927 PolarHBondContact O-N 2.96Å; E925-H927 VanDerWaalsContact O-N 3.11Å; E925-L928 HydrophobicContact CB-CD1 3.94Å; E925-L928 HydrophobicContact CB-CG 4.09Å; E925-L928 HydrophobicContact CG-CD1 4.5Å; E925-L928 PolarHBondContact O-N 3.46Å; E925-L928 WeakPolarHBondContact OE2-CD1 3.28Å
926	P	94.4	Very high	95.2	Very high	12 Å²	12	53.7 Å²	53.7	8%	0.078	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-60.6	-27.7	-170.5	-25.6	34.9	0	0	0	114.5	T856 Q860 Y921 N922 L928 S929	T856-P926 HydrophobicContact CG2-CB 4.03Å; T856-P926 HydrophobicContact CG2-CG 4.15Å; Q860-P926 HydrophobicContact CG-CB 4.39Å; Y921-P926 HydrophobicContact CE2-CB 3.98Å; N922-P926 WeakPolarHBondContact O-CA 3.45Å; P926-L928 PolarHBondContact O-N 3.25Å; P926-S929 VanDerWaalsContact O-CB 3.27Å; P926-S929 WeakPolarHBondContact O-CB 3.21Å; P926-S929 PolarHBondContact O-N 3.01Å; P926-S929 VanDerWaalsContact O-N 3.16Å; P926-S929 PolarHBondContact O-OG 2.81Å
927	H	94	Very high	94.9	Very high	36 Å²	36	57.3 Å²	57.3	17%	0.167	27%	0.271	C	S	.	.	G	3₁₀ helix	trans	-59.3	-31.4	174.4	59.3	-84.1	0	0	0	113.2	E852 R855 T856 E925 S929 H1015	E852-H927 WeakPolarHBondContact O-CB 3.36Å; R855-H927 HydrophobicContact CB-CB 4.35Å; R855-H927 HydrophobicContact CG-CB 4.34Å; R855-H927 PolarHBondContact NE-O 2.84Å; R855-H927 PolarHBondContact NH2-O 2.85Å; T856-H927 WeakPolarHBondContact OG1-CB 3.08Å; T856-H927 PolarHBondContact OG1-N 3.33Å; E925-H927 PolarHBondContact O-N 2.96Å; E925-H927 VanDerWaalsContact O-N 3.11Å; H927-S929 PolarHBondContact O-N 3.32Å; H927-H1015 PolarHBondContact O-NE2 2.66Å
928	L	95.7	Very high	94.4	Very high	76 Å²	76	59 Å²	59	40%	0.398	28%	0.28	S	S	.	.	G	3₁₀ helix	trans	-78.4	-1.2	179	-58	-177	0	0	0	114.2	E925 P926 E930	E925-L928 HydrophobicContact CB-CD1 3.94Å; E925-L928 HydrophobicContact CB-CG 4.09Å; E925-L928 HydrophobicContact CG-CD1 4.5Å; E925-L928 PolarHBondContact O-N 3.46Å; E925-L928 WeakPolarHBondContact OE2-CD1 3.28Å; P926-L928 PolarHBondContact O-N 3.25Å; L928-E930 PolarHBondContact O-N 3.26Å
929	S	97.1	Very high	93.3	Very high	1 Å²	1	57.4 Å²	57.4	1%	0.007	29%	0.286	C	S	.	.			trans	-63.6	125.5	-177.6	-54.9	0	0	0	0	112.7	R855 K920 N922 P926 H927 I931	R855-S929 PolarHBondContact NH2-O 2.83Å; K920-S929 WeakPolarHBondContact O-CA 3.48Å; K920-S929 WeakPolarHBondContact O-CB 3.5Å; N922-S929 PolarHBondContact N-OG 2.74Å; P926-S929 VanDerWaalsContact O-CB 3.27Å; P926-S929 WeakPolarHBondContact O-CB 3.21Å; P926-S929 PolarHBondContact O-N 3.01Å; P926-S929 VanDerWaalsContact O-N 3.16Å; P926-S929 PolarHBondContact O-OG 2.81Å; H927-S929 PolarHBondContact O-N 3.32Å; S929-I931 VanDerWaalsContact C-N 3.35Å; S929-I931 PolarHBondContact O-N 2.87Å; S929-I931 VanDerWaalsContact O-N 3.13Å
930	E	96.3	Very high	92.5	Very high	41 Å²	41	58.1 Å²	58.1	19%	0.192	29%	0.292	C	S	.	.			trans	-90.2	57.9	-176.9	-64	-179.5	153.2	0	0	113.1	K920 L928 S933 R1016 D1017	K920-E930 HydrophobicContact CD-CB 4.11Å; K920-E930 IonicContact NZ-OE2 2.76Å; K920-E930 PolarHBondContact NZ-OE2 2.79Å; K920-E930 PolarHBondContact O-N 2.91Å; L928-E930 PolarHBondContact O-N 3.26Å; E930-S933 PolarHBondContact O-OG 2.99Å; E930-R1016 IonicContact OE1-CZ 3.15Å; E930-R1016 IonicContact OE1-NE 2.73Å; E930-R1016 PolarHBondContact OE1-NE 2.85Å; E930-R1016 IonicContact OE1-NH2 2.73Å; E930-R1016 PolarHBondContact OE1-NH2 2.72Å; E930-R1016 IonicContact OE2-NH2 3.78Å; E930-D1017 WeakPolarHBondContact CA-OD1 3.37Å; E930-D1017 HydrophobicContact CG-CB 4.49Å
931	I	96.6	Very high	92.2	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	29%	0.288	C	S	.	.			trans	-81	-16.3	-169.1	59.4	165.1	0	0	0	115.1	V859 I862 L917 K920 S929 S933 C934 L1007 D1017	V859-I931 HydrophobicContact CG1-CD1 4.32Å; V859-I931 HydrophobicContact CG2-CD1 4.19Å; I862-I931 HydrophobicContact CD1-CD1 3.91Å; I862-I931 HydrophobicContact CG2-CD1 4.25Å; L917-I931 HydrophobicContact CD2-CB 3.82Å; L917-I931 HydrophobicContact CD2-CG2 3.99Å; K920-I931 HydrophobicContact CB-CG2 4.28Å; S929-I931 VanDerWaalsContact C-N 3.35Å; S929-I931 PolarHBondContact O-N 2.87Å; S929-I931 VanDerWaalsContact O-N 3.13Å; I931-S933 PolarHBondContact O-N 2.84Å; I931-C934 WeakPolarHBondContact O-CB 3.22Å; I931-C934 PolarHBondContact O-N 3.22Å; I931-C934 VanDerWaalsContact O-N 3.11Å; I931-L1007 HydrophobicContact CD1-CD2 3.86Å; I931-L1007 HydrophobicContact CG1-CD2 4Å; I931-D1017 PolarHBondContact N-OD1 2.59Å; I931-D1017 PolarHBondContact N-OD2 2.74Å
932	G	95.9	Very high	91.9	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-59	-39.6	177.3	0	0	0	0	0	112.1	C934 F935 D1017	G932-C934 PolarHBondContact O-N 3.09Å; G932-F935 PolarHBondContact O-N 2.95Å; G932-D1017 PolarHBondContact N-OD1 2.93Å
933	S	94.9	Very high	91.6	Very high	32 Å²	32	54.6 Å²	54.6	22%	0.224	29%	0.289	C	S	.	.	H	α-helix	trans	-55.4	-33.1	175.6	67	0	0	0	0	114.1	K920 E930 I931 F935 L936 M937	K920-S933 VanDerWaalsContact CE-OG 3.31Å; K920-S933 WeakPolarHBondContact CE-OG 3.02Å; E930-S933 PolarHBondContact O-OG 2.99Å; I931-S933 PolarHBondContact O-N 2.84Å; S933-F935 VanDerWaalsContact C-N 3.32Å; S933-F935 PolarHBondContact O-N 2.74Å; S933-L936 PolarHBondContact O-N 2.86Å; S933-M937 WeakPolarHBondContact O-CG 3.28Å; S933-M937 PolarHBondContact O-N 3.23Å
934	C	96.2	Very high	91.6	Very high	0 Å²	0	49 Å²	49	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-68.4	-29.2	-178.5	-66.6	0	0	0	0	113.4	F913 E916 L917 K920 I931 G932 M937	F913-C934 HydrophobicContact CE2-CB 4.34Å; E916-C934 VanDerWaalsContact C-SG 3.57Å; E916-C934 PolarHBondContact O-SG 3.41Å; L917-C934 HydrophobicContact CD2-CB 3.68Å; L917-C934 HydrophobicContact CG-CB 4.1Å; K920-C934 VanDerWaalsContact CG-SG 3.54Å; I931-C934 WeakPolarHBondContact O-CB 3.22Å; I931-C934 PolarHBondContact O-N 3.22Å; I931-C934 VanDerWaalsContact O-N 3.11Å; G932-C934 PolarHBondContact O-N 3.09Å; C934-M937 HydrophobicContact CB-CE 4.48Å
935	F	96	Very high	91.6	Very high	7 Å²	7	41.3 Å²	41.3	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-72.5	-44.2	174.1	-71.1	-94.1	0	0	0	111.1	F913 L917 G932 S933 Q938 F942 Y1000 L1004 A1024 M1028	F913-F935 HydrophobicContact CE1-CE1 4.3Å; F913-F935 HydrophobicContact CE1-CZ 4.47Å; F913-F935 HydrophobicContact CE2-CD1 4.2Å; F913-F935 HydrophobicContact CE2-CD2 4.5Å; F913-F935 HydrophobicContact CE2-CE1 4.39Å; F913-F935 HydrophobicContact CE2-CG 4.27Å; F913-F935 AromaticContact CZ-CD1 3.77Å; F913-F935 HydrophobicContact CZ-CD1 3.77Å; F913-F935 HydrophobicContact CZ-CD2 4.28Å; F913-F935 AromaticContact CZ-CE1 3.53Å; F913-F935 HydrophobicContact CZ-CE1 3.53Å; F913-F935 HydrophobicContact CZ-CE2 4.05Å; F913-F935 HydrophobicContact CZ-CG 4.15Å; F913-F935 AromaticContact CZ-CZ 3.69Å; F913-F935 HydrophobicContact CZ-CZ 3.69Å; L917-F935 HydrophobicContact CD2-CE2 4.37Å; G932-F935 PolarHBondContact O-N 2.95Å; S933-F935 VanDerWaalsContact C-N 3.32Å; S933-F935 PolarHBondContact O-N 2.74Å; F935-Q938 PolarHBondContact O-N 2.82Å; F935-F942 HydrophobicContact CD1-CE2 4.38Å; F935-F942 AromaticContact CD1-CZ 4Å; F935-F942 HydrophobicContact CD1-CZ 4Å; F935-Y1000 AromaticContact CE1-CD1 3.51Å; F935-Y1000 HydrophobicContact CE1-CD1 3.51Å; F935-Y1000 AromaticContact CE1-CE1 3.92Å; F935-Y1000 HydrophobicContact CE1-CE1 3.92Å; F935-Y1000 HydrophobicContact CE1-CG 4.04Å; F935-Y1000 HydrophobicContact CZ-CD1 4.03Å; F935-Y1000 HydrophobicContact CZ-CE1 4.37Å; F935-L1004 HydrophobicContact CD1-CD1 3.94Å; F935-L1004 HydrophobicContact CD2-CD1 4.38Å; F935-L1004 HydrophobicContact CD2-CD2 3.97Å; F935-L1004 HydrophobicContact CE1-CD1 3.97Å; F935-L1004 HydrophobicContact CE1-CG 4.49Å; F935-L1004 HydrophobicContact CE2-CD1 4.43Å; F935-L1004 HydrophobicContact CE2-CD2 3.77Å; F935-L1004 HydrophobicContact CE2-CG 4.39Å; F935-L1004 HydrophobicContact CG-CD1 4.14Å; F935-L1004 HydrophobicContact CZ-CD1 4.22Å; F935-L1004 HydrophobicContact CZ-CD2 4.14Å; F935-L1004 HydrophobicContact CZ-CG 4.27Å; F935-A1024 HydrophobicContact CB-CB 3.74Å; F935-A1024 HydrophobicContact CD2-CB 4.5Å; F935-A1024 HydrophobicContact CG-CB 4.27Å; F935-M1028 HydrophobicContact CD1-CG 3.88Å; F935-M1028 HydrophobicContact CD1-SD 4.12Å; F935-M1028 HydrophobicContact CE1-CG 4.5Å
936	L	93.7	Very high	91.4	Very high	61 Å²	61	36.9 Å²	36.9	32%	0.319	21%	0.21	S	C	.	.	H	α-helix	trans	-64	-42.4	-179.6	-62.3	174.5	0	0	0	112	S933 Q938 G939 E1023 A1024 A1027	S933-L936 PolarHBondContact O-N 2.86Å; L936-Q938 PolarHBondContact O-N 3.09Å; L936-Q938 VanDerWaalsContact O-N 3.08Å; L936-G939 PolarHBondContact O-N 2.84Å; L936-G939 VanDerWaalsContact O-N 3.11Å; L936-E1023 HydrophobicContact CD1-CB 3.9Å; L936-E1023 HydrophobicContact CD2-CB 3.96Å; L936-A1024 HydrophobicContact CD2-CB 4.42Å; L936-A1024 HydrophobicContact CG-CB 4.35Å; L936-A1027 HydrophobicContact CD2-CB 4.23Å
937	M	89.5	Confident	91.2	Very high	112 Å²	112	40.8 Å²	40.8	55%	0.552	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-20.9	177.8	-76	-167.5	-63	0	0	114.4	E916 S933 C934	E916-M937 HydrophobicContact CB-CE 4.3Å; S933-M937 WeakPolarHBondContact O-CG 3.28Å; S933-M937 PolarHBondContact O-N 3.23Å; C934-M937 HydrophobicContact CB-CE 4.48Å
938	Q	84.9	Confident	91.2	Very high	37 Å²	37	39.1 Å²	39.1	17%	0.173	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-22.9	178.4	-62.2	-49.8	-50.2	0	0	113.6	F909 F913 F935 L936 E940 G941 F942	F909-Q938 HydrophobicContact CE2-CB 3.94Å; F909-Q938 HydrophobicContact CE2-CG 3.86Å; F909-Q938 HydrophobicContact CZ-CB 4.13Å; F909-Q938 HydrophobicContact CZ-CG 3.98Å; F913-Q938 HydrophobicContact CD2-CG 3.76Å; F913-Q938 HydrophobicContact CE2-CG 4.4Å; F935-Q938 PolarHBondContact O-N 2.82Å; L936-Q938 PolarHBondContact O-N 3.09Å; L936-Q938 VanDerWaalsContact O-N 3.08Å; Q938-E940 PolarHBondContact O-N 2.61Å; Q938-G941 PolarHBondContact O-N 2.7Å; Q938-F942 HydrophobicContact CB-CD2 4.15Å; Q938-F942 HydrophobicContact CB-CE2 3.82Å; Q938-F942 HydrophobicContact CG-CE2 4.24Å
939	G	73.1	Confident	90.8	Very high	52 Å²	52	36 Å²	36	54%	0.536	20%	0.204	S	C	.	.	G	3₁₀ helix	trans	46.9	-111	179.2	0	0	0	0	0	113.6	L936 G941	L936-G939 PolarHBondContact O-N 2.84Å; L936-G939 VanDerWaalsContact O-N 3.11Å; G939-G941 VanDerWaalsContact C-N 3.27Å; G939-G941 PolarHBondContact O-N 2.84Å
940	E	79.1	Confident	90.3	Very high	170 Å²	170	37.6 Å²	37.6	79%	0.794	21%	0.212	S	C	*	.	G	3₁₀ helix	trans	-73.3	-8.8	179.2	-61.2	-171.7	168.7	0	0	114.8	Q938 F942 S943	Q938-E940 PolarHBondContact O-N 2.61Å; E940-F942 PolarHBondContact O-N 3.1Å; E940-F942 VanDerWaalsContact O-N 3.14Å; E940-S943 WeakPolarHBondContact O-CB 3.4Å; E940-S943 PolarHBondContact O-N 2.84Å; E940-S943 PolarHBondContact O-OG 3.2Å
941	G	88.7	Confident	90	Very high	22 Å²	22	37.7 Å²	37.7	23%	0.227	22%	0.216	C	C	.	.	G	3₁₀ helix	trans	-57.5	-31.2	-175.6	0	0	0	0	0	114.3	Q938 G939 S943 I944	Q938-G941 PolarHBondContact O-N 2.7Å; G939-G941 VanDerWaalsContact C-N 3.27Å; G939-G941 PolarHBondContact O-N 2.84Å; G941-S943 PolarHBondContact O-N 3.06Å; G941-I944 WeakPolarHBondContact O-CG1 3.25Å
942	F	92	Very high	89.6	Confident	3 Å²	3	38.8 Å²	38.8	1%	0.013	22%	0.221	C	C	.	.	G	3₁₀ helix	trans	-72.7	-10.7	173.8	-66.9	-77.2	0	0	0	114.1	F909 F913 F935 Q938 E940 I944 Y945 I997 Y1000 M1028 V1031	F909-F942 AromaticContact CE1-CD1 3.68Å; F909-F942 HydrophobicContact CE1-CD1 3.68Å; F909-F942 AromaticContact CE1-CE1 3.63Å; F909-F942 HydrophobicContact CE1-CE1 3.63Å; F909-F942 HydrophobicContact CE1-CG 4.36Å; F909-F942 HydrophobicContact CE1-CZ 4.27Å; F909-F942 AromaticContact CZ-CD1 3.69Å; F909-F942 HydrophobicContact CZ-CD1 3.69Å; F909-F942 HydrophobicContact CZ-CD2 4.15Å; F909-F942 AromaticContact CZ-CE1 3.64Å; F909-F942 HydrophobicContact CZ-CE1 3.64Å; F909-F942 HydrophobicContact CZ-CE2 4.1Å; F909-F942 AromaticContact CZ-CG 3.96Å; F909-F942 HydrophobicContact CZ-CG 3.96Å; F909-F942 AromaticContact CZ-CZ 3.85Å; F909-F942 HydrophobicContact CZ-CZ 3.85Å; F913-F942 HydrophobicContact CD2-CZ 4.32Å; F913-F942 HydrophobicContact CE1-CZ 4.34Å; F913-F942 HydrophobicContact CE2-CZ 4.01Å; F913-F942 HydrophobicContact CZ-CZ 4.02Å; F935-F942 HydrophobicContact CD1-CE2 4.38Å; F935-F942 AromaticContact CD1-CZ 4Å; F935-F942 HydrophobicContact CD1-CZ 4Å; Q938-F942 HydrophobicContact CB-CD2 4.15Å; Q938-F942 HydrophobicContact CB-CE2 3.82Å; Q938-F942 HydrophobicContact CG-CE2 4.24Å; E940-F942 PolarHBondContact O-N 3.1Å; E940-F942 VanDerWaalsContact O-N 3.14Å; F942-I944 PolarHBondContact O-N 3.37Å; F942-Y945 HydrophobicContact CD1-CD2 4.48Å; F942-Y945 HydrophobicContact CD1-CE2 4.13Å; F942-Y945 WeakPolarHBondContact O-CB 3.43Å; F942-Y945 WeakPolarHBondContact O-CD2 3.12Å; F942-Y945 PolarHBondContact O-N 2.81Å; F942-I997 HydrophobicContact CB-CD1 4.3Å; F942-I997 HydrophobicContact CD1-CD1 3.95Å; F942-I997 HydrophobicContact CG-CD1 4.49Å; F942-Y1000 HydrophobicContact CD1-CE2 4.29Å; F942-Y1000 HydrophobicContact CE1-CD2 4.32Å; F942-Y1000 AromaticContact CE1-CE2 3.77Å; F942-Y1000 HydrophobicContact CE1-CE2 3.77Å; F942-M1028 HydrophobicContact CD1-CE 3.74Å; F942-M1028 HydrophobicContact CD2-CE 4.03Å; F942-M1028 HydrophobicContact CD2-SD 3.74Å; F942-M1028 HydrophobicContact CE1-CE 3.73Å; F942-M1028 HydrophobicContact CE1-SD 4.47Å; F942-M1028 HydrophobicContact CE2-CE 4.03Å; F942-M1028 HydrophobicContact CE2-SD 3.68Å; F942-M1028 HydrophobicContact CG-CE 3.89Å; F942-M1028 HydrophobicContact CG-SD 4.18Å; F942-M1028 HydrophobicContact CZ-CE 3.88Å; F942-M1028 HydrophobicContact CZ-SD 4.07Å; F942-V1031 HydrophobicContact CB-CG1 3.9Å; F942-V1031 HydrophobicContact CB-CG2 4.4Å
943	S	88.1	Confident	89.2	Confident	65 Å²	65	41.9 Å²	41.9	46%	0.455	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-63.1	-25.5	-179.3	68.7	0	0	0	0	113.6	E940 G941 Y945 S946	E940-S943 WeakPolarHBondContact O-CB 3.4Å; E940-S943 PolarHBondContact O-N 2.84Å; E940-S943 PolarHBondContact O-OG 3.2Å; G941-S943 PolarHBondContact O-N 3.06Å; S943-Y945 PolarHBondContact O-N 2.89Å; S943-S946 WeakPolarHBondContact O-CA 3.41Å; S943-S946 WeakPolarHBondContact O-CB 3.3Å; S943-S946 PolarHBondContact O-N 3.43Å
944	I	92.4	Very high	89	Confident	43 Å²	43	42.8 Å²	42.8	22%	0.221	25%	0.251	C	S	.	.	H	α-helix	trans	-59.2	-28.4	177.5	66.5	-175.7	0	0	0	112.9	N902 I906 F909 G941 F942 S946 E947 Y948	N902-I944 PolarHBondContact ND2-O 2.77Å; I906-I944 HydrophobicContact CB-CD1 4.46Å; I906-I944 HydrophobicContact CG1-CD1 3.93Å; I906-I944 HydrophobicContact CG1-CG1 3.97Å; F909-I944 HydrophobicContact CB-CD1 3.54Å; F909-I944 HydrophobicContact CD1-CD1 4.2Å; F909-I944 HydrophobicContact CG-CD1 3.85Å; G941-I944 WeakPolarHBondContact O-CG1 3.25Å; F942-I944 PolarHBondContact O-N 3.37Å; I944-S946 PolarHBondContact O-N 3.06Å; I944-E947 PolarHBondContact O-N 2.78Å; I944-Y948 PolarHBondContact O-N 2.77Å
945	Y	93.2	Very high	88.9	Confident	0 Å²	0	43 Å²	43	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-65	-21.6	173.8	-72.6	-101.4	0	0	0	112.1	Y869 I906 F909 Q910 F942 S943 Y948 C949 P993 I997	Y869-Y945 WeakPolarHBondContact CE1-OH 3.22Å; Y869-Y945 PolarHBondContact OH-OH 3Å; I906-Y945 HydrophobicContact CD1-CD1 4.21Å; I906-Y945 HydrophobicContact CD1-CE1 4.44Å; I906-Y945 HydrophobicContact CD1-CG 4.41Å; I906-Y945 HydrophobicContact CG2-CE1 4.01Å; I906-Y945 HydrophobicContact CG2-CE2 4.29Å; F909-Y945 HydrophobicContact CD1-CE2 4.04Å; F909-Y945 HydrophobicContact CE1-CE2 4.02Å; Q910-Y945 PolarHBondContact OE1-OH 3.46Å; F942-Y945 HydrophobicContact CD1-CD2 4.48Å; F942-Y945 HydrophobicContact CD1-CE2 4.13Å; F942-Y945 WeakPolarHBondContact O-CB 3.43Å; F942-Y945 WeakPolarHBondContact O-CD2 3.12Å; F942-Y945 PolarHBondContact O-N 2.81Å; S943-Y945 PolarHBondContact O-N 2.89Å; Y945-Y948 PolarHBondContact O-N 3.16Å; Y945-C949 WeakPolarHBondContact O-CB 3.39Å; Y945-C949 PolarHBondContact O-N 2.6Å; Y945-C949 PolarHBondContact O-SG 2.99Å; Y945-P993 HydrophobicContact CD1-CB 4.18Å; Y945-P993 HydrophobicContact CE1-CB 4.01Å; Y945-I997 HydrophobicContact CD1-CB 3.72Å; Y945-I997 HydrophobicContact CD1-CD1 4.3Å; Y945-I997 HydrophobicContact CD1-CG1 4.12Å; Y945-I997 HydrophobicContact CD1-CG2 4.26Å; Y945-I997 HydrophobicContact CD2-CD1 4.1Å; Y945-I997 HydrophobicContact CE1-CB 4.2Å; Y945-I997 HydrophobicContact CE2-CD1 4.48Å; Y945-I997 HydrophobicContact CG-CB 4.13Å; Y945-I997 HydrophobicContact CG-CD1 3.99Å; Y945-I997 HydrophobicContact CG-CG1 4Å
946	S	87.9	Confident	88.6	Confident	4 Å²	4	44.5 Å²	44.5	3%	0.028	26%	0.263	C	S	.	.	H	α-helix	trans	-66	-46.4	176	-163.7	0	0	0	0	111.7	S943 I944 C949 N950 R1038	S943-S946 WeakPolarHBondContact O-CA 3.41Å; S943-S946 WeakPolarHBondContact O-CB 3.3Å; S943-S946 PolarHBondContact O-N 3.43Å; I944-S946 PolarHBondContact O-N 3.06Å; S946-C949 PolarHBondContact O-N 2.87Å; S946-N950 WeakPolarHBondContact O-CB 3.42Å; S946-N950 PolarHBondContact O-N 3.49Å; S946-N950 PolarHBondContact O-ND2 2.74Å; S946-R1038 WeakPolarHBondContact OG-CD 2.8Å; S946-R1038 PolarHBondContact OG-NH1 2.91Å
947	E	89.1	Confident	88.5	Confident	95 Å²	95	44.5 Å²	44.5	44%	0.444	27%	0.272	S	S	.	.	H	α-helix	trans	-59.6	-48.4	173.2	178.2	-176.1	-173.2	0	0	110.2	N902 I944 C949 N950 T951	N902-E947 PolarHBondContact ND2-OE2 2.75Å; I944-E947 PolarHBondContact O-N 2.78Å; E947-C949 PolarHBondContact O-N 3.49Å; E947-N950 WeakPolarHBondContact O-CB 3.26Å; E947-N950 PolarHBondContact O-N 2.88Å; E947-N950 VanDerWaalsContact O-N 3.13Å; E947-T951 HydrophobicContact CG-CG2 4.4Å; E947-T951 PolarHBondContact O-N 2.64Å; E947-T951 PolarHBondContact O-OG1 3.32Å; E947-T951 VanDerWaalsContact O-OG1 3.09Å
948	Y	93.9	Very high	88.8	Confident	1 Å²	1	40.3 Å²	40.3	0%	0.004	25%	0.251	C	S	.	.	H	α-helix	trans	-57.6	-46.6	179.8	-164	-96.4	0	0	0	112.9	N902 I903 I906 I944 Y945 N950 T951 H952 L990 P993 V994	N902-Y948 WeakPolarHBondContact OD1-CB 3.25Å; N902-Y948 WeakPolarHBondContact OD1-CD2 3.28Å; I903-Y948 HydrophobicContact CB-CD2 4.39Å; I903-Y948 HydrophobicContact CB-CE2 3.82Å; I903-Y948 HydrophobicContact CD1-CE2 4.28Å; I903-Y948 HydrophobicContact CG1-CE2 4.26Å; I906-Y948 HydrophobicContact CD1-CD1 4.38Å; I906-Y948 HydrophobicContact CD1-CD2 3.89Å; I906-Y948 HydrophobicContact CD1-CG 3.71Å; I944-Y948 PolarHBondContact O-N 2.77Å; Y945-Y948 PolarHBondContact O-N 3.16Å; Y948-N950 VanDerWaalsContact C-N 3.26Å; Y948-N950 PolarHBondContact O-N 3.38Å; Y948-T951 PolarHBondContact O-N 2.71Å; Y948-T951 PolarHBondContact O-OG1 2.87Å; Y948-H952 HydrophobicContact CE1-CB 4.48Å; Y948-H952 AromaticContact CE1-ND1 3.96Å; Y948-H952 WeakPolarHBondContact O-CB 3.5Å; Y948-H952 PolarHBondContact O-N 3.29Å; Y948-L990 WeakPolarHBondContact CE1-O 3.5Å; Y948-L990 WeakPolarHBondContact OH-CD2 3.36Å; Y948-L990 PolarHBondContact OH-O 2.87Å; Y948-P993 HydrophobicContact CD1-CB 3.85Å; Y948-P993 HydrophobicContact CD1-CG 4.19Å; Y948-P993 HydrophobicContact CE1-CB 3.82Å; Y948-P993 HydrophobicContact CE1-CG 3.66Å; Y948-V994 HydrophobicContact CD1-CG2 3.97Å; Y948-V994 HydrophobicContact CE1-CG2 4Å
949	C	89.1	Confident	89.3	Confident	9 Å²	9	38.9 Å²	38.9	6%	0.061	24%	0.244	C	C	.	.	H	α-helix	trans	-67.5	-26.3	179.9	-68.2	0	0	0	0	113.2	Y945 S946 E947 I1035	Y945-C949 WeakPolarHBondContact O-CB 3.39Å; Y945-C949 PolarHBondContact O-N 2.6Å; Y945-C949 PolarHBondContact O-SG 2.99Å; S946-C949 PolarHBondContact O-N 2.87Å; E947-C949 PolarHBondContact O-N 3.49Å; C949-I1035 HydrophobicContact CB-CG2 3.62Å
950	N	85.3	Confident	90.2	Very high	35 Å²	35	42.5 Å²	42.5	19%	0.187	25%	0.247	C	C	.	.	H	α-helix	trans	-79.3	-35.6	175.8	-71.9	-33.9	0	0	0	112.5	S946 E947 Y948 P953 K1039 L1042	S946-N950 WeakPolarHBondContact O-CB 3.42Å; S946-N950 PolarHBondContact O-N 3.49Å; S946-N950 PolarHBondContact O-ND2 2.74Å; E947-N950 WeakPolarHBondContact O-CB 3.26Å; E947-N950 PolarHBondContact O-N 2.88Å; E947-N950 VanDerWaalsContact O-N 3.13Å; Y948-N950 VanDerWaalsContact C-N 3.26Å; Y948-N950 PolarHBondContact O-N 3.38Å; N950-P953 WeakPolarHBondContact O-CD 3.49Å; N950-K1039 WeakPolarHBondContact OD1-CA 3.34Å; N950-L1042 HydrophobicContact CB-CD2 3.97Å
951	T	90.2	Very high	91	Very high	44 Å²	44	39.7 Å²	39.7	27%	0.27	23%	0.23	S	C	.	.	H	α-helix	trans	-87.3	-28.9	-179.2	55.6	0	0	0	0	113.6	S901 E947 Y948 P953 A954 A955	S901-T951 VanDerWaalsContact CB-OG1 3.27Å; S901-T951 WeakPolarHBondContact CB-OG1 3.4Å; S901-T951 WeakPolarHBondContact OG-CB 3.44Å; S901-T951 PolarHBondContact OG-OG1 3.1Å; E947-T951 HydrophobicContact CG-CG2 4.4Å; E947-T951 PolarHBondContact O-N 2.64Å; E947-T951 PolarHBondContact O-OG1 3.32Å; E947-T951 VanDerWaalsContact O-OG1 3.09Å; Y948-T951 PolarHBondContact O-N 2.71Å; Y948-T951 PolarHBondContact O-OG1 2.87Å; T951-P953 VanDerWaalsContact C-N 3.33Å; T951-P953 VanDerWaalsContact O-N 3.15Å; T951-A954 WeakPolarHBondContact O-CA 3.44Å; T951-A954 WeakPolarHBondContact O-CB 3.4Å; T951-A954 PolarHBondContact O-N 3.06Å; T951-A955 PolarHBondContact O-N 3.24Å
952	H	89.4	Confident	91.3	Very high	22 Å²	22	38.7 Å²	38.7	10%	0.102	22%	0.219	C	C	.	.	H	α-helix	trans	-49.4	-38.3	-178.5	179.7	93.8	0	0	0	115	Y948 A954 A955 C956 L990 V994	Y948-H952 HydrophobicContact CE1-CB 4.48Å; Y948-H952 AromaticContact CE1-ND1 3.96Å; Y948-H952 WeakPolarHBondContact O-CB 3.5Å; Y948-H952 PolarHBondContact O-N 3.29Å; H952-A954 VanDerWaalsContact C-N 3.26Å; H952-A954 PolarHBondContact O-N 3.47Å; H952-A955 WeakPolarHBondContact O-CB 3.48Å; H952-A955 PolarHBondContact O-N 3.15Å; H952-A955 VanDerWaalsContact O-N 3.14Å; H952-C956 PolarHBondContact NE2-SG 3.46Å; H952-C956 PolarHBondContact O-N 3.08Å; H952-C956 PolarHBondContact O-SG 2.87Å; H952-L990 PolarHBondContact CE1-O 3.43Å; H952-L990 PolarHBondContact ND1-O 3.46Å; H952-V994 HydrophobicContact CB-CG2 4.41Å
953	P	86.8	Confident	91.4	Very high	66 Å²	66	41.9 Å²	41.9	43%	0.429	24%	0.235	S	C	.	.	H	α-helix	trans	-59.4	-32.4	173.5	-25	35.7	0	0	0	114.4	N950 T951 A957	N950-P953 WeakPolarHBondContact O-CD 3.49Å; T951-P953 VanDerWaalsContact C-N 3.33Å; T951-P953 VanDerWaalsContact O-N 3.15Å; P953-A957 PolarHBondContact O-N 3.12Å
954	A	90.1	Very high	91.6	Very high	51 Å²	51	46.8 Å²	46.8	42%	0.421	25%	0.248	S	C	.	.	H	α-helix	trans	-75.5	-39.5	174	0	0	0	0	0	111.4	T898 T951 H952 C956 A957 E958	T898-A954 HydrophobicContact CG2-CB 4.33Å; T951-A954 WeakPolarHBondContact O-CA 3.44Å; T951-A954 WeakPolarHBondContact O-CB 3.4Å; T951-A954 PolarHBondContact O-N 3.06Å; H952-A954 VanDerWaalsContact C-N 3.26Å; H952-A954 PolarHBondContact O-N 3.47Å; A954-C956 VanDerWaalsContact C-N 3.34Å; A954-C956 PolarHBondContact O-N 3.32Å; A954-A957 PolarHBondContact O-N 2.88Å; A954-A957 VanDerWaalsContact O-N 3.14Å; A954-E958 PolarHBondContact O-N 3.07Å
955	A	93.9	Very high	91.8	Very high	3 Å²	3	48.8 Å²	48.8	3%	0.025	26%	0.257	C	S	.	.	H	α-helix	trans	-55.3	-48.1	172.2	0	0	0	0	0	111.5	T898 I899 T951 H952 A957 E958 L959	T898-A955 WeakPolarHBondContact O-CA 3.43Å; T898-A955 VanDerWaalsContact O-CB 3.24Å; T898-A955 WeakPolarHBondContact O-CB 3.34Å; T898-A955 PolarHBondContact O-N 3.47Å; I899-A955 VanDerWaalsContact O-CB 3.31Å; I899-A955 WeakPolarHBondContact O-CB 3.48Å; T951-A955 PolarHBondContact O-N 3.24Å; H952-A955 WeakPolarHBondContact O-CB 3.48Å; H952-A955 PolarHBondContact O-N 3.15Å; H952-A955 VanDerWaalsContact O-N 3.14Å; A955-A957 VanDerWaalsContact C-N 3.33Å; A955-A957 PolarHBondContact O-N 3.13Å; A955-E958 PolarHBondContact O-N 3.48Å; A955-L959 WeakPolarHBondContact O-CB 3.23Å; A955-L959 PolarHBondContact O-N 3.34Å
956	C	90.4	Very high	91.8	Very high	39 Å²	39	50.8 Å²	50.8	26%	0.264	28%	0.278	S	S	.	.	H	α-helix	trans	-57.8	-42.6	175.2	-63.9	0	0	0	0	112.6	H952 A954 Q960	H952-C956 PolarHBondContact NE2-SG 3.46Å; H952-C956 PolarHBondContact O-N 3.08Å; H952-C956 PolarHBondContact O-SG 2.87Å; A954-C956 VanDerWaalsContact C-N 3.34Å; A954-C956 PolarHBondContact O-N 3.32Å; C956-Q960 WeakPolarHBondContact O-CB 3.47Å; C956-Q960 VanDerWaalsContact O-CG 3.27Å; C956-Q960 WeakPolarHBondContact O-CG 3.33Å; C956-Q960 PolarHBondContact O-N 3.26Å
957	A	92.3	Very high	92.2	Very high	61 Å²	61	55.5 Å²	55.5	50%	0.504	30%	0.298	S	S	.	.	H	α-helix	trans	-67	-39.2	-179.3	0	0	0	0	0	112.3	P953 A954 A955 R961	P953-A957 PolarHBondContact O-N 3.12Å; A954-A957 PolarHBondContact O-N 2.88Å; A954-A957 VanDerWaalsContact O-N 3.14Å; A955-A957 VanDerWaalsContact C-N 3.33Å; A955-A957 PolarHBondContact O-N 3.13Å; A957-R961 PolarHBondContact O-N 2.95Å; A957-R961 VanDerWaalsContact O-N 3.07Å
958	E	95.4	Very high	92.5	Very high	25 Å²	25	51.8 Å²	51.8	12%	0.117	28%	0.28	C	S	.	.	H	α-helix	trans	-71.2	-42.8	175.8	176.9	59.6	-174.9	0	0	111.8	Q895 T898 I899 A954 A955 Q960 R961 L962	Q895-E958 WeakPolarHBondContact CG-OE1 3.41Å; Q895-E958 PolarHBondContact NE2-OE1 3.28Å; T898-E958 HydrophobicContact CG2-CB 4.11Å; T898-E958 HydrophobicContact CG2-CG 4.5Å; I899-E958 HydrophobicContact CD1-CG 3.91Å; I899-E958 HydrophobicContact CG1-CB 4.29Å; I899-E958 HydrophobicContact CG1-CG 3.71Å; A954-E958 PolarHBondContact O-N 3.07Å; A955-E958 PolarHBondContact O-N 3.48Å; E958-Q960 PolarHBondContact O-N 2.91Å; E958-R961 VanDerWaalsContact CD-NH2 3.34Å; E958-R961 WeakPolarHBondContact O-CA 3.48Å; E958-R961 WeakPolarHBondContact O-CB 3.44Å; E958-R961 PolarHBondContact O-N 2.99Å; E958-R961 IonicContact OE1-CZ 3.71Å; E958-R961 IonicContact OE1-NE 2.67Å; E958-R961 IonicContact OE1-NH2 3.28Å; E958-R961 PolarHBondContact OE1-NH2 3.04Å; E958-R961 IonicContact OE2-CZ 3.96Å; E958-R961 IonicContact OE2-NE 3.71Å; E958-R961 PolarHBondContact OE2-NE 3.46Å; E958-R961 IonicContact OE2-NH2 2.69Å; E958-R961 PolarHBondContact OE2-NH2 3.4Å; E958-L962 HydrophobicContact CG-CD1 4.28Å; E958-L962 WeakPolarHBondContact O-CG 3.4Å; E958-L962 PolarHBondContact O-N 2.75Å
959	L	94.7	Very high	92.5	Very high	6 Å²	6	57.9 Å²	57.9	3%	0.031	31%	0.307	C	S	.	.	H	α-helix	trans	-56.1	-48.6	171	-110	62.7	0	0	0	111.4	I899 A955 R961 L962 M963 I986 A987 L990	I899-L959 HydrophobicContact CB-CD1 4.13Å; I899-L959 HydrophobicContact CD1-CD1 4.1Å; I899-L959 HydrophobicContact CG1-CD1 3.74Å; I899-L959 HydrophobicContact CG2-CD1 3.4Å; A955-L959 WeakPolarHBondContact O-CB 3.23Å; A955-L959 PolarHBondContact O-N 3.34Å; L959-R961 PolarHBondContact O-N 3.18Å; L959-L962 PolarHBondContact O-N 3.48Å; L959-M963 WeakPolarHBondContact O-CB 3.21Å; L959-M963 VanDerWaalsContact O-CG 3.25Å; L959-M963 WeakPolarHBondContact O-CG 3.42Å; L959-M963 PolarHBondContact O-N 2.92Å; L959-I986 HydrophobicContact CD2-CG1 4.31Å; L959-I986 HydrophobicContact CD2-CG2 3.86Å; L959-I986 HydrophobicContact CG-CG2 4.42Å; L959-A987 HydrophobicContact CD2-CB 3.91Å; L959-L990 HydrophobicContact CD1-CD1 4.36Å; L959-L990 HydrophobicContact CD2-CD1 3.89Å
960	Q	93.1	Very high	92.8	Very high	128 Å²	128	64.1 Å²	64.1	60%	0.598	33%	0.334	S	S	*	.	H	α-helix	trans	-63.3	-21.6	175.8	-75	-177.8	14.7	0	0	113	C956 E958 K964	C956-Q960 WeakPolarHBondContact O-CB 3.47Å; C956-Q960 VanDerWaalsContact O-CG 3.27Å; C956-Q960 WeakPolarHBondContact O-CG 3.33Å; C956-Q960 PolarHBondContact O-N 3.26Å; E958-Q960 PolarHBondContact O-N 2.91Å; Q960-K964 WeakPolarHBondContact O-CG 3.3Å; Q960-K964 PolarHBondContact O-NZ 3.2Å
961	R	95.5	Very high	93.3	Very high	112 Å²	112	63.9 Å²	63.9	42%	0.423	33%	0.332	S	S	.	.	H	α-helix	trans	-78.9	-45.2	172.2	-167.6	-171.8	66.4	81.5	-3.9	111.2	Q895 A957 E958 L959	Q895-R961 VanDerWaalsContact NE2-NH2 3.17Å; A957-R961 PolarHBondContact O-N 2.95Å; A957-R961 VanDerWaalsContact O-N 3.07Å; E958-R961 VanDerWaalsContact CD-NH2 3.34Å; E958-R961 WeakPolarHBondContact O-CA 3.48Å; E958-R961 WeakPolarHBondContact O-CB 3.44Å; E958-R961 PolarHBondContact O-N 2.99Å; E958-R961 IonicContact OE1-CZ 3.71Å; E958-R961 IonicContact OE1-NE 2.67Å; E958-R961 IonicContact OE1-NH2 3.28Å; E958-R961 PolarHBondContact OE1-NH2 3.04Å; E958-R961 IonicContact OE2-CZ 3.96Å; E958-R961 IonicContact OE2-NE 3.71Å; E958-R961 PolarHBondContact OE2-NE 3.46Å; E958-R961 IonicContact OE2-NH2 2.69Å; E958-R961 PolarHBondContact OE2-NH2 3.4Å; L959-R961 PolarHBondContact O-N 3.18Å
962	L	94.8	Very high	93.6	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-69.9	-39.4	-179.3	-65.9	179.4	0	0	0	112.9	F891 I899 E958 L959 K964 M965 Y968	F891-L962 HydrophobicContact CD1-CD1 4.49Å; F891-L962 HydrophobicContact CE1-CD1 4.16Å; I899-L962 HydrophobicContact CD1-CD1 3.64Å; E958-L962 HydrophobicContact CG-CD1 4.28Å; E958-L962 WeakPolarHBondContact O-CG 3.4Å; E958-L962 PolarHBondContact O-N 2.75Å; L959-L962 PolarHBondContact O-N 3.48Å; L962-K964 PolarHBondContact O-N 3.01Å; L962-K964 VanDerWaalsContact O-N 3.1Å; L962-M965 WeakPolarHBondContact O-CB 3.17Å; L962-M965 PolarHBondContact O-N 2.85Å; L962-Y968 HydrophobicContact CB-CD2 4.24Å; L962-Y968 HydrophobicContact CB-CG 4.08Å; L962-Y968 HydrophobicContact CD2-CD1 4.26Å; L962-Y968 HydrophobicContact CD2-CD2 3.98Å; L962-Y968 HydrophobicContact CD2-CE1 4.02Å; L962-Y968 HydrophobicContact CD2-CE2 3.71Å; L962-Y968 HydrophobicContact CD2-CG 4.24Å
963	M	93	Very high	93.8	Very high	71 Å²	71	64.3 Å²	64.3	35%	0.35	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-25.3	177.4	-77.1	-69.2	113.6	0	0	113.9	L959 M965 F972	L959-M963 WeakPolarHBondContact O-CB 3.21Å; L959-M963 VanDerWaalsContact O-CG 3.25Å; L959-M963 WeakPolarHBondContact O-CG 3.42Å; L959-M963 PolarHBondContact O-N 2.92Å; M963-M965 PolarHBondContact O-N 3.38Å; M963-F972 HydrophobicContact CE-CB 4.06Å; M963-F972 HydrophobicContact CE-CD2 3.36Å; M963-F972 HydrophobicContact CE-CE2 4.13Å; M963-F972 HydrophobicContact CE-CG 4.06Å
964	K	94.1	Very high	94.2	Very high	167 Å²	167	63.3 Å²	63.3	73%	0.726	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.8	-14.6	175.3	-64	178	178.5	91.7	0	113.4	Q960 L962	Q960-K964 WeakPolarHBondContact O-CG 3.3Å; Q960-K964 PolarHBondContact O-NZ 3.2Å; L962-K964 PolarHBondContact O-N 3.01Å; L962-K964 VanDerWaalsContact O-N 3.1Å
965	M	94.9	Very high	94.4	Very high	86 Å²	86	61.2 Å²	61.2	42%	0.424	31%	0.31	S	S	.	.	S	Bend	trans	-106.4	105.8	-178.8	-68.6	174.5	73.7	0	0	108.5	L962 M963 K967 Y968	L962-M965 WeakPolarHBondContact O-CB 3.17Å; L962-M965 PolarHBondContact O-N 2.85Å; M963-M965 PolarHBondContact O-N 3.38Å; M965-K967 PolarHBondContact O-N 3.16Å; M965-Y968 HydrophobicContact CB-CD2 3.71Å; M965-Y968 HydrophobicContact CB-CE2 4.04Å; M965-Y968 HydrophobicContact CE-CE2 3.97Å; M965-Y968 PolarHBondContact O-N 3.42Å; M965-Y968 HydrophobicContact SD-CD2 4.49Å; M965-Y968 HydrophobicContact SD-CE2 3.97Å
966	G	94.3	Very high	94.4	Very high	42 Å²	42	62.4 Å²	62.4	43%	0.433	31%	0.314	S	S	.	.	H	α-helix	trans	-49.2	-33.1	-168	0	0	0	0	0	115.8	Y968 K969 H970	G966-Y968 VanDerWaalsContact C-N 3.26Å; G966-Y968 PolarHBondContact O-N 3.35Å; G966-K969 PolarHBondContact O-N 3.06Å; G966-H970 PolarHBondContact O-N 3.34Å; G966-H970 VanDerWaalsContact O-N 3.15Å; G966-H970 PolarHBondContact O-ND1 3.21Å
967	K	95.3	Very high	94.5	Very high	103 Å²	103	65.4 Å²	65.4	45%	0.448	33%	0.327	S	S	.	.	H	α-helix	trans	-57.4	-35.8	176.5	74.3	169.6	-168	165.9	0	113.5	M890 M965 F971	M890-K967 HydrophobicContact CE-CD 4.28Å; M890-K967 HydrophobicContact CE-CG 4.19Å; M965-K967 PolarHBondContact O-N 3.16Å; K967-F971 VanDerWaalsContact O-CB 3.26Å; K967-F971 WeakPolarHBondContact O-CB 3.43Å; K967-F971 PolarHBondContact O-N 2.82Å; K967-F971 VanDerWaalsContact O-N 3.15Å
968	Y	95.9	Very high	94.5	Very high	16 Å²	16	68.9 Å²	68.9	6%	0.063	34%	0.336	C	S	.	.	H	α-helix	trans	-79.2	-35	177.6	-58.8	-83.7	0	0	0	112	M890 F891 L962 M965 G966 H970 F971 F972	M890-Y968 HydrophobicContact CB-CE1 4.02Å; M890-Y968 HydrophobicContact CE-CD1 3.65Å; M890-Y968 HydrophobicContact CE-CE1 3.83Å; M890-Y968 HydrophobicContact CE-CG 4.28Å; M890-Y968 WeakPolarHBondContact O-CE1 3.44Å; M890-Y968 PolarHBondContact O-OH 2.91Å; F891-Y968 HydrophobicContact CD1-CE1 4.25Å; F891-Y968 AromaticContact CE1-CD1 3.68Å; F891-Y968 HydrophobicContact CE1-CD1 3.68Å; F891-Y968 AromaticContact CE1-CE1 3.85Å; F891-Y968 HydrophobicContact CE1-CE1 3.85Å; F891-Y968 HydrophobicContact CE2-CD1 4.47Å; F891-Y968 AromaticContact CZ-CD1 3.67Å; F891-Y968 HydrophobicContact CZ-CD1 3.67Å; F891-Y968 HydrophobicContact CZ-CE1 4.03Å; L962-Y968 HydrophobicContact CB-CD2 4.24Å; L962-Y968 HydrophobicContact CB-CG 4.08Å; L962-Y968 HydrophobicContact CD2-CD1 4.26Å; L962-Y968 HydrophobicContact CD2-CD2 3.98Å; L962-Y968 HydrophobicContact CD2-CE1 4.02Å; L962-Y968 HydrophobicContact CD2-CE2 3.71Å; L962-Y968 HydrophobicContact CD2-CG 4.24Å; M965-Y968 HydrophobicContact CB-CD2 3.71Å; M965-Y968 HydrophobicContact CB-CE2 4.04Å; M965-Y968 HydrophobicContact CE-CE2 3.97Å; M965-Y968 PolarHBondContact O-N 3.42Å; M965-Y968 HydrophobicContact SD-CD2 4.49Å; M965-Y968 HydrophobicContact SD-CE2 3.97Å; G966-Y968 VanDerWaalsContact C-N 3.26Å; G966-Y968 PolarHBondContact O-N 3.35Å; Y968-H970 PolarHBondContact O-N 3.13Å; Y968-F971 PolarHBondContact O-N 3.06Å; Y968-F972 WeakPolarHBondContact O-CD2 3.3Å; Y968-F972 PolarHBondContact O-N 3.18Å
969	K	94.4	Very high	94.1	Very high	130 Å²	130	69.5 Å²	69.5	57%	0.565	34%	0.339	S	S	*	.	H	α-helix	trans	-56.8	-52.7	174.9	-172.5	-173.9	176.6	-173.7	0	110.4	G966 F971 F972 E973	G966-K969 PolarHBondContact O-N 3.06Å; K969-F971 VanDerWaalsContact C-N 3.34Å; K969-F971 PolarHBondContact O-N 3.38Å; K969-F972 PolarHBondContact O-N 2.71Å; K969-E973 WeakPolarHBondContact O-CB 3.34Å; K969-E973 PolarHBondContact O-N 3.49Å
970	H	95.5	Very high	93.7	Very high	139 Å²	139	77.6 Å²	77.6	64%	0.644	38%	0.377	S	S	*	.	H	α-helix	trans	-65.5	-36	178.6	-58.6	96.8	0	0	0	112.6	G966 Y968 E973 A974	G966-H970 PolarHBondContact O-N 3.34Å; G966-H970 VanDerWaalsContact O-N 3.15Å; G966-H970 PolarHBondContact O-ND1 3.21Å; Y968-H970 PolarHBondContact O-N 3.13Å; H970-E973 PolarHBondContact O-N 2.88Å; H970-A974 VanDerWaalsContact O-CB 3.32Å; H970-A974 WeakPolarHBondContact O-CB 3.3Å; H970-A974 PolarHBondContact O-N 2.79Å
971	F	96.4	Very high	93.1	Very high	30 Å²	30	72 Å²	72	13%	0.132	35%	0.351	C	S	.	.	H	α-helix	trans	-63.5	-48.9	176.3	176.6	-87.1	0	0	0	112.7	Q883 N887 M890 F891 K967 Y968 K969 E973 A974 C975	Q883-F971 HydrophobicContact CB-CZ 4.04Å; N887-F971 HydrophobicContact CB-CE2 4.13Å; N887-F971 HydrophobicContact CB-CZ 4.4Å; M890-F971 HydrophobicContact CE-CB 3.8Å; M890-F971 HydrophobicContact CE-CD2 4.08Å; M890-F971 HydrophobicContact CE-CG 3.9Å; M890-F971 HydrophobicContact SD-CD2 4.14Å; F891-F971 AromaticContact CE2-CD1 3.81Å; F891-F971 HydrophobicContact CE2-CD1 3.81Å; F891-F971 AromaticContact CE2-CE1 3.46Å; F891-F971 HydrophobicContact CE2-CE1 3.46Å; F891-F971 VanDerWaalsContact CE2-CE1 3.46Å; F891-F971 HydrophobicContact CE2-CE2 4.43Å; F891-F971 HydrophobicContact CE2-CG 4.45Å; F891-F971 AromaticContact CE2-CZ 3.81Å; F891-F971 HydrophobicContact CE2-CZ 3.81Å; F891-F971 AromaticContact CZ-CD1 3.71Å; F891-F971 HydrophobicContact CZ-CD1 3.71Å; F891-F971 AromaticContact CZ-CE1 3.68Å; F891-F971 HydrophobicContact CZ-CE1 3.68Å; F891-F971 HydrophobicContact CZ-CZ 4.47Å; K967-F971 VanDerWaalsContact O-CB 3.26Å; K967-F971 WeakPolarHBondContact O-CB 3.43Å; K967-F971 PolarHBondContact O-N 2.82Å; K967-F971 VanDerWaalsContact O-N 3.15Å; Y968-F971 PolarHBondContact O-N 3.06Å; K969-F971 VanDerWaalsContact C-N 3.34Å; K969-F971 PolarHBondContact O-N 3.38Å; F971-E973 VanDerWaalsContact C-N 3.31Å; F971-E973 PolarHBondContact O-N 2.82Å; F971-A974 PolarHBondContact O-N 2.82Å; F971-C975 VanDerWaalsContact CE1-SG 3.52Å; F971-C975 PolarHBondContact O-N 3.04Å; F971-C975 PolarHBondContact O-SG 2.69Å
972	F	95.3	Very high	92.3	Very high	5 Å²	5	70.1 Å²	70.1	2%	0.022	35%	0.349	C	S	.	.	H	α-helix	trans	-69.3	-31.1	178.9	-74.5	-63.2	0	0	0	111.9	Y880 F891 M963 Y968 K969 C975 R976 I986	Y880-F972 AromaticContact CD1-CD1 3.75Å; Y880-F972 HydrophobicContact CD1-CD1 3.75Å; Y880-F972 HydrophobicContact CD1-CE1 4.34Å; Y880-F972 HydrophobicContact CE1-CB 4.34Å; Y880-F972 AromaticContact CE1-CD1 3.88Å; Y880-F972 HydrophobicContact CE1-CD1 3.88Å; Y880-F972 WeakPolarHBondContact CE1-O 3.43Å; F891-F972 HydrophobicContact CE1-CE1 4.41Å; F891-F972 AromaticContact CE1-CE2 3.94Å; F891-F972 HydrophobicContact CE1-CE2 3.94Å; F891-F972 AromaticContact CE1-CZ 3.52Å; F891-F972 HydrophobicContact CE1-CZ 3.52Å; F891-F972 HydrophobicContact CZ-CE1 4.2Å; F891-F972 AromaticContact CZ-CE2 3.98Å; F891-F972 HydrophobicContact CZ-CE2 3.98Å; F891-F972 AromaticContact CZ-CZ 3.63Å; F891-F972 HydrophobicContact CZ-CZ 3.63Å; M963-F972 HydrophobicContact CE-CB 4.06Å; M963-F972 HydrophobicContact CE-CD2 3.36Å; M963-F972 HydrophobicContact CE-CE2 4.13Å; M963-F972 HydrophobicContact CE-CG 4.06Å; Y968-F972 WeakPolarHBondContact O-CD2 3.3Å; Y968-F972 PolarHBondContact O-N 3.18Å; K969-F972 PolarHBondContact O-N 2.71Å; F972-C975 PolarHBondContact O-N 2.97Å; F972-R976 PolarHBondContact O-N 3.14Å; F972-I986 HydrophobicContact CB-CG2 4.38Å; F972-I986 HydrophobicContact CD1-CD1 3.51Å; F972-I986 HydrophobicContact CD1-CG2 4.32Å; F972-I986 HydrophobicContact CE1-CD1 3.34Å; F972-I986 HydrophobicContact CG-CD1 4.43Å; F972-I986 HydrophobicContact CG-CG2 4.25Å; F972-I986 HydrophobicContact CZ-CD1 4.14Å
973	E	93.9	Very high	91.6	Very high	71 Å²	71	76.3 Å²	76.3	33%	0.332	38%	0.381	S	S	.	.	H	α-helix	trans	-68.2	-44.5	172	-168.4	56.4	-151.1	0	0	111.9	K969 H970 F971 C975 R976 L977	K969-E973 WeakPolarHBondContact O-CB 3.34Å; K969-E973 PolarHBondContact O-N 3.49Å; H970-E973 PolarHBondContact O-N 2.88Å; F971-E973 VanDerWaalsContact C-N 3.31Å; F971-E973 PolarHBondContact O-N 2.82Å; E973-C975 VanDerWaalsContact C-N 3.3Å; E973-C975 PolarHBondContact O-N 2.67Å; E973-R976 WeakPolarHBondContact O-CB 3.35Å; E973-R976 PolarHBondContact O-N 2.89Å; E973-R976 IonicContact OE1-CZ 3.59Å; E973-R976 IonicContact OE1-NE 3.18Å; E973-R976 PolarHBondContact OE1-NE 2.88Å; E973-R976 IonicContact OE1-NH2 3.64Å; E973-R976 PolarHBondContact OE1-NH2 2.87Å; E973-R976 IonicContact OE2-NE 2.71Å; E973-L977 HydrophobicContact CG-CD1 4.27Å; E973-L977 WeakPolarHBondContact O-CG 3.48Å; E973-L977 PolarHBondContact O-N 3.31Å
974	A	95.3	Very high	91.1	Very high	45 Å²	45	76 Å²	76	37%	0.372	38%	0.381	S	S	.	.	H	α-helix	trans	-60.3	-39.3	174.1	0	0	0	0	0	112.1	H970 F971 R976 L977 L978	H970-A974 VanDerWaalsContact O-CB 3.32Å; H970-A974 WeakPolarHBondContact O-CB 3.3Å; H970-A974 PolarHBondContact O-N 2.79Å; F971-A974 PolarHBondContact O-N 2.82Å; A974-R976 VanDerWaalsContact C-N 3.33Å; A974-R976 PolarHBondContact O-N 3.42Å; A974-L977 PolarHBondContact O-N 2.6Å; A974-L978 VanDerWaalsContact O-CB 3.26Å; A974-L978 WeakPolarHBondContact O-CB 3.31Å; A974-L978 WeakPolarHBondContact O-CD1 3.47Å; A974-L978 WeakPolarHBondContact O-CG 3.5Å; A974-L978 PolarHBondContact O-N 3.29Å
975	C	94.5	Very high	90.8	Very high	6 Å²	6	71.8 Å²	71.8	4%	0.041	37%	0.372	C	S	.	.	H	α-helix	trans	-64.6	-35.3	173.6	-65.3	0	0	0	0	112.7	Y880 F971 F972 E973 Q979	Y880-C975 HydrophobicContact CD1-CB 3.5Å; Y880-C975 HydrophobicContact CE1-CB 3.55Å; F971-C975 VanDerWaalsContact CE1-SG 3.52Å; F971-C975 PolarHBondContact O-N 3.04Å; F971-C975 PolarHBondContact O-SG 2.69Å; F972-C975 PolarHBondContact O-N 2.97Å; E973-C975 VanDerWaalsContact C-N 3.3Å; E973-C975 PolarHBondContact O-N 2.67Å; C975-Q979 WeakPolarHBondContact O-CB 3.45Å; C975-Q979 PolarHBondContact O-N 2.79Å
976	R	94.3	Very high	90.7	Very high	28 Å²	28	68 Å²	68	11%	0.106	35%	0.353	C	S	.	.	H	α-helix	trans	-64.1	-51.5	175.5	-165.7	-172.3	64.8	85.5	-15.6	111.1	F972 E973 A974 Q979 Q980 M981 D983	F972-R976 PolarHBondContact O-N 3.14Å; E973-R976 WeakPolarHBondContact O-CB 3.35Å; E973-R976 PolarHBondContact O-N 2.89Å; E973-R976 IonicContact OE1-CZ 3.59Å; E973-R976 IonicContact OE1-NE 3.18Å; E973-R976 PolarHBondContact OE1-NE 2.88Å; E973-R976 IonicContact OE1-NH2 3.64Å; E973-R976 PolarHBondContact OE1-NH2 2.87Å; E973-R976 IonicContact OE2-NE 2.71Å; A974-R976 VanDerWaalsContact C-N 3.33Å; A974-R976 PolarHBondContact O-N 3.42Å; R976-Q979 PolarHBondContact O-N 3.31Å; R976-Q980 PolarHBondContact O-N 3.24Å; R976-M981 HydrophobicContact CG-CB 3.73Å; R976-M981 PolarHBondContact NH1-O 3.08Å; R976-M981 PolarHBondContact O-N 3.19Å; R976-D983 IonicContact CZ-OD1 2.85Å; R976-D983 IonicContact NE-OD1 2.8Å; R976-D983 PolarHBondContact NE-OD1 2.88Å; R976-D983 IonicContact NH1-OD1 3.93Å; R976-D983 PolarHBondContact NH1-OD1 2.87Å; R976-D983 IonicContact NH2-OD1 3.72Å; R976-D983 PolarHBondContact NH2-OD1 2.76Å
977	L	92.1	Very high	90.5	Very high	103 Å²	103	68 Å²	68	54%	0.539	35%	0.35	S	S	.	.	H	α-helix	trans	-65.6	-43.5	-178.5	-64.5	170.6	0	0	0	112.3	E973 A974 Q979 Q980	E973-L977 HydrophobicContact CG-CD1 4.27Å; E973-L977 WeakPolarHBondContact O-CG 3.48Å; E973-L977 PolarHBondContact O-N 3.31Å; A974-L977 PolarHBondContact O-N 2.6Å; L977-Q979 VanDerWaalsContact C-N 3.31Å; L977-Q979 PolarHBondContact O-N 3.18Å; L977-Q980 PolarHBondContact O-N 2.75Å
978	L	91.1	Very high	90.1	Very high	133 Å²	133	64.2 Å²	64.2	70%	0.696	34%	0.339	S	S	*	.	H	α-helix	trans	-66.3	-28.5	-180	-74.1	169.9	0	0	0	113.9	A974 Q980	A974-L978 VanDerWaalsContact O-CB 3.26Å; A974-L978 WeakPolarHBondContact O-CB 3.31Å; A974-L978 WeakPolarHBondContact O-CD1 3.47Å; A974-L978 WeakPolarHBondContact O-CG 3.5Å; A974-L978 PolarHBondContact O-N 3.29Å; L978-Q980 VanDerWaalsContact C-N 3.33Å
979	Q	87.2	Confident	89.9	Confident	39 Å²	39	63.6 Å²	63.6	18%	0.182	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.2	3.7	174.8	-167.2	69.4	27.4	0	0	111.8	D875 C975 R976 L977 M981	D875-Q979 HydrophobicContact CB-CG 3.87Å; D875-Q979 PolarHBondContact OD1-NE2 2.74Å; C975-Q979 WeakPolarHBondContact O-CB 3.45Å; C975-Q979 PolarHBondContact O-N 2.79Å; R976-Q979 PolarHBondContact O-N 3.31Å; L977-Q979 VanDerWaalsContact C-N 3.31Å; L977-Q979 PolarHBondContact O-N 3.18Å; Q979-M981 HydrophobicContact CB-CE 3.59Å; Q979-M981 HydrophobicContact CB-CG 4.23Å; Q979-M981 HydrophobicContact CG-CE 3.81Å; Q979-M981 HydrophobicContact CG-CG 4.14Å; Q979-M981 PolarHBondContact O-N 3.3Å
980	Q	87.9	Confident	89.9	Confident	176 Å²	176	57.5 Å²	57.5	82%	0.822	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	34.9	-176.6	-56.6	178	-0.5	0	0	113.1	R976 L977 L978	R976-Q980 PolarHBondContact O-N 3.24Å; L977-Q980 PolarHBondContact O-N 2.75Å; L978-Q980 VanDerWaalsContact C-N 3.33Å
981	M	78.6	Confident	89.7	Confident	9 Å²	9	54 Å²	54	4%	0.044	30%	0.297	C	S	.	.			trans	-74.4	139.3	177.2	-80.5	-176.2	-92.9	0	0	111.1	D875 Y880 R976 Q979 F989	D875-M981 HydrophobicContact CB-CG 3.87Å; D875-M981 HydrophobicContact CB-SD 3.87Å; Y880-M981 HydrophobicContact CD2-CE 3.93Å; Y880-M981 HydrophobicContact CD2-SD 4.39Å; Y880-M981 HydrophobicContact CE1-CE 4.35Å; Y880-M981 HydrophobicContact CE2-CE 3.56Å; Y880-M981 HydrophobicContact CE2-SD 3.79Å; Y880-M981 HydrophobicContact CG-CE 4.46Å; R976-M981 HydrophobicContact CG-CB 3.73Å; R976-M981 PolarHBondContact NH1-O 3.08Å; R976-M981 PolarHBondContact O-N 3.19Å; Q979-M981 HydrophobicContact CB-CE 3.59Å; Q979-M981 HydrophobicContact CB-CG 4.23Å; Q979-M981 HydrophobicContact CG-CE 3.81Å; Q979-M981 HydrophobicContact CG-CG 4.14Å; Q979-M981 PolarHBondContact O-N 3.3Å; M981-F989 HydrophobicContact CB-CE2 4.06Å; M981-F989 HydrophobicContact CB-CZ 3.87Å; M981-F989 HydrophobicContact CG-CE2 4.3Å; M981-F989 HydrophobicContact CG-CZ 3.92Å; M981-F989 HydrophobicContact SD-CD2 4.18Å; M981-F989 HydrophobicContact SD-CE1 4.19Å; M981-F989 HydrophobicContact SD-CE2 3.75Å; M981-F989 HydrophobicContact SD-CZ 3.76Å
982	I	79.8	Confident	89.4	Confident	74 Å²	74	53.6 Å²	53.6	38%	0.379	30%	0.297	S	S	.	.			trans	-47.3	157	167.8	56.3	176.4	0	0	0	112.1	I984 F989	I982-I984 HydrophobicContact CD1-CD1 3.56Å; I982-I984 HydrophobicContact CD1-CG1 4.05Å; I982-I984 HydrophobicContact CG1-CD1 4.18Å; I982-I984 HydrophobicContact CG1-CG1 4.12Å; I982-I984 PolarHBondContact O-N 2.9Å; I982-F989 HydrophobicContact CD1-CZ 4.48Å; I982-F989 HydrophobicContact CG1-CE1 4.48Å; I982-F989 HydrophobicContact CG1-CZ 3.76Å
983	D	81	Confident	89.4	Confident	129 Å²	129	53.4 Å²	53.4	69%	0.69	30%	0.296	S	S	*	.	S	Bend	trans	-75.9	51.9	-172.5	-158.8	33.5	0	0	0	114.1	R976	R976-D983 IonicContact CZ-OD1 2.85Å; R976-D983 IonicContact NE-OD1 2.8Å; R976-D983 PolarHBondContact NE-OD1 2.88Å; R976-D983 IonicContact NH1-OD1 3.93Å; R976-D983 PolarHBondContact NH1-OD1 2.87Å; R976-D983 IonicContact NH2-OD1 3.72Å; R976-D983 PolarHBondContact NH2-OD1 2.76Å
984	I	82.3	Confident	89.2	Confident	66 Å²	66	51.6 Å²	51.6	34%	0.338	29%	0.289	S	S	.	.			trans	-105.4	129.1	171.6	-61.8	-174.5	0	0	0	107.4	I982 F989	I982-I984 HydrophobicContact CD1-CD1 3.56Å; I982-I984 HydrophobicContact CD1-CG1 4.05Å; I982-I984 HydrophobicContact CG1-CD1 4.18Å; I982-I984 HydrophobicContact CG1-CG1 4.12Å; I982-I984 PolarHBondContact O-N 2.9Å; I984-F989 HydrophobicContact CB-CD2 4.16Å; I984-F989 HydrophobicContact CB-CE2 3.84Å; I984-F989 HydrophobicContact CB-CZ 4.32Å; I984-F989 HydrophobicContact CG2-CD2 4.11Å; I984-F989 HydrophobicContact CG2-CE2 4.3Å; I984-F989 WeakPolarHBondContact O-CD2 3.38Å; I984-F989 WeakPolarHBondContact O-CE2 3.5Å
985	S	87.8	Confident	88.7	Confident	77 Å²	77	52.4 Å²	52.4	54%	0.538	29%	0.286	S	S	.	.			trans	-61.2	152.8	175	74.1	0	0	0	0	111.5	A987 G988 F989	S985-A987 PolarHBondContact O-N 3.32Å; S985-G988 WeakPolarHBondContact O-CA 3.07Å; S985-G988 PolarHBondContact O-N 3.2Å; S985-F989 PolarHBondContact O-N 2.91Å
986	I	91.9	Very high	88.7	Confident	6 Å²	6	52.7 Å²	52.7	3%	0.031	29%	0.286	C	S	.	.	H	α-helix	trans	-49.3	-30.8	174	-178	172.7	0	0	0	113.5	Y880 F900 L959 F972 G988 F989 L990	Y880-I986 HydrophobicContact CD1-CD1 3.91Å; Y880-I986 HydrophobicContact CD2-CB 4.47Å; Y880-I986 HydrophobicContact CD2-CD1 3.95Å; Y880-I986 HydrophobicContact CD2-CG1 3.98Å; Y880-I986 HydrophobicContact CE1-CB 4.22Å; Y880-I986 HydrophobicContact CE1-CD1 4.17Å; Y880-I986 HydrophobicContact CE1-CG1 4.48Å; Y880-I986 HydrophobicContact CE2-CB 3.87Å; Y880-I986 HydrophobicContact CE2-CD1 4.21Å; Y880-I986 HydrophobicContact CE2-CG1 3.87Å; Y880-I986 HydrophobicContact CG-CD1 3.8Å; Y880-I986 HydrophobicContact CG-CG1 4.34Å; F900-I986 HydrophobicContact CE1-CD1 4.03Å; F900-I986 HydrophobicContact CZ-CD1 4.07Å; L959-I986 HydrophobicContact CD2-CG1 4.31Å; L959-I986 HydrophobicContact CD2-CG2 3.86Å; L959-I986 HydrophobicContact CG-CG2 4.42Å; F972-I986 HydrophobicContact CB-CG2 4.38Å; F972-I986 HydrophobicContact CD1-CD1 3.51Å; F972-I986 HydrophobicContact CD1-CG2 4.32Å; F972-I986 HydrophobicContact CE1-CD1 3.34Å; F972-I986 HydrophobicContact CG-CD1 4.43Å; F972-I986 HydrophobicContact CG-CG2 4.25Å; F972-I986 HydrophobicContact CZ-CD1 4.14Å; I986-G988 VanDerWaalsContact C-N 3.34Å; I986-G988 PolarHBondContact O-N 2.96Å; I986-F989 PolarHBondContact O-N 3.16Å; I986-L990 HydrophobicContact CD1-CD1 4.42Å; I986-L990 HydrophobicContact CG1-CD1 3.93Å; I986-L990 HydrophobicContact CG1-CG 4.23Å; I986-L990 WeakPolarHBondContact O-CB 3.45Å; I986-L990 VanDerWaalsContact O-CG 3.29Å; I986-L990 WeakPolarHBondContact O-CG 3.42Å; I986-L990 PolarHBondContact O-N 3.4Å
987	A	90	Very high	88.5	Confident	43 Å²	43	51.4 Å²	51.4	36%	0.355	28%	0.281	S	S	.	.	H	α-helix	trans	-64.9	-34.9	175.1	0	0	0	0	0	113.4	L959 S985 L991	L959-A987 HydrophobicContact CD2-CB 3.91Å; S985-A987 PolarHBondContact O-N 3.32Å; A987-L991 PolarHBondContact O-N 2.87Å
988	G	87.3	Confident	88.1	Confident	23 Å²	23	48 Å²	48	24%	0.237	27%	0.265	C	S	.	.	H	α-helix	trans	-73.8	-43.4	174.8	0	0	0	0	0	111.9	S985 I986 L990 L991 T992	S985-G988 WeakPolarHBondContact O-CA 3.07Å; S985-G988 PolarHBondContact O-N 3.2Å; I986-G988 VanDerWaalsContact C-N 3.34Å; I986-G988 PolarHBondContact O-N 2.96Å; G988-L990 VanDerWaalsContact C-N 3.32Å; G988-L990 PolarHBondContact O-N 2.61Å; G988-L991 WeakPolarHBondContact O-CB 3.31Å; G988-L991 PolarHBondContact O-N 2.83Å; G988-T992 PolarHBondContact O-N 3.05Å
989	F	90.6	Very high	87.9	Confident	3 Å²	3	44.1 Å²	44.1	1%	0.013	24%	0.243	C	C	.	.	H	α-helix	trans	-56.2	-44.8	173.3	-84.6	-69	0	0	0	112.4	H872 I876 Y880 M981 I982 I984 S985 I986 L991 T992	H872-F989 HydrophobicContact CB-CD1 4.29Å; H872-F989 HydrophobicContact CB-CE1 4.31Å; H872-F989 AromaticContact ND1-CE1 3.86Å; I876-F989 HydrophobicContact CD1-CB 3.91Å; I876-F989 HydrophobicContact CD1-CD1 4.45Å; I876-F989 HydrophobicContact CG1-CB 3.98Å; I876-F989 HydrophobicContact CG1-CD1 4.4Å; I876-F989 HydrophobicContact CG1-CG 4.43Å; Y880-F989 HydrophobicContact CE2-CD2 4.34Å; M981-F989 HydrophobicContact CB-CE2 4.06Å; M981-F989 HydrophobicContact CB-CZ 3.87Å; M981-F989 HydrophobicContact CG-CE2 4.3Å; M981-F989 HydrophobicContact CG-CZ 3.92Å; M981-F989 HydrophobicContact SD-CD2 4.18Å; M981-F989 HydrophobicContact SD-CE1 4.19Å; M981-F989 HydrophobicContact SD-CE2 3.75Å; M981-F989 HydrophobicContact SD-CZ 3.76Å; I982-F989 HydrophobicContact CD1-CZ 4.48Å; I982-F989 HydrophobicContact CG1-CE1 4.48Å; I982-F989 HydrophobicContact CG1-CZ 3.76Å; I984-F989 HydrophobicContact CB-CD2 4.16Å; I984-F989 HydrophobicContact CB-CE2 3.84Å; I984-F989 HydrophobicContact CB-CZ 4.32Å; I984-F989 HydrophobicContact CG2-CD2 4.11Å; I984-F989 HydrophobicContact CG2-CE2 4.3Å; I984-F989 WeakPolarHBondContact O-CD2 3.38Å; I984-F989 WeakPolarHBondContact O-CE2 3.5Å; S985-F989 PolarHBondContact O-N 2.91Å; I986-F989 PolarHBondContact O-N 3.16Å; F989-L991 PolarHBondContact O-N 3.01Å; F989-T992 WeakPolarHBondContact O-CB 3.11Å; F989-T992 WeakPolarHBondContact O-CG2 3.39Å; F989-T992 PolarHBondContact O-N 2.64Å; F989-T992 PolarHBondContact O-OG1 2.91Å
990	L	94.3	Very high	88.2	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.016	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.1	-10.3	175.4	-65.8	172	0	0	0	114	I876 I899 F900 I903 Y948 H952 L959 I986 G988	I876-L990 HydrophobicContact CG2-CD2 4.2Å; I899-L990 HydrophobicContact CG2-CD1 4.04Å; F900-L990 HydrophobicContact CD1-CD2 3.9Å; F900-L990 HydrophobicContact CE1-CD2 4.34Å; I903-L990 HydrophobicContact CD1-CD2 4.03Å; Y948-L990 WeakPolarHBondContact CE1-O 3.5Å; Y948-L990 WeakPolarHBondContact OH-CD2 3.36Å; Y948-L990 PolarHBondContact OH-O 2.87Å; H952-L990 PolarHBondContact CE1-O 3.43Å; H952-L990 PolarHBondContact ND1-O 3.46Å; L959-L990 HydrophobicContact CD1-CD1 4.36Å; L959-L990 HydrophobicContact CD2-CD1 3.89Å; I986-L990 HydrophobicContact CD1-CD1 4.42Å; I986-L990 HydrophobicContact CG1-CD1 3.93Å; I986-L990 HydrophobicContact CG1-CG 4.23Å; I986-L990 WeakPolarHBondContact O-CB 3.45Å; I986-L990 VanDerWaalsContact O-CG 3.29Å; I986-L990 WeakPolarHBondContact O-CG 3.42Å; I986-L990 PolarHBondContact O-N 3.4Å; G988-L990 VanDerWaalsContact C-N 3.32Å; G988-L990 PolarHBondContact O-N 2.61Å
991	L	91.4	Very high	88.2	Confident	65 Å²	65	34 Å²	34	34%	0.34	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-84.8	-21.7	172.6	-171.9	62.9	0	0	0	112.1	A987 G988 F989 P993 V994 Q995	A987-L991 PolarHBondContact O-N 2.87Å; G988-L991 WeakPolarHBondContact O-CB 3.31Å; G988-L991 PolarHBondContact O-N 2.83Å; F989-L991 PolarHBondContact O-N 3.01Å; L991-P993 VanDerWaalsContact C-CD 3.45Å; L991-V994 HydrophobicContact CD1-CB 4.2Å; L991-V994 WeakPolarHBondContact O-CB 3.47Å; L991-V994 PolarHBondContact O-N 2.87Å; L991-Q995 HydrophobicContact CG-CG 4.15Å; L991-Q995 PolarHBondContact O-N 2.96Å; L991-Q995 VanDerWaalsContact O-N 3.08Å
992	T	91.1	Very high	88.5	Confident	22 Å²	22	38.4 Å²	38.4	14%	0.135	22%	0.219	C	C	.	.	H	α-helix	trans	-56.9	-36.4	-174.5	63.6	0	0	0	0	115.3	G988 F989 V994 Q995 K996	G988-T992 PolarHBondContact O-N 3.05Å; F989-T992 WeakPolarHBondContact O-CB 3.11Å; F989-T992 WeakPolarHBondContact O-CG2 3.39Å; F989-T992 PolarHBondContact O-N 2.64Å; F989-T992 PolarHBondContact O-OG1 2.91Å; T992-V994 PolarHBondContact O-N 2.84Å; T992-Q995 PolarHBondContact O-N 3.49Å; T992-K996 WeakPolarHBondContact O-CB 3.26Å; T992-K996 PolarHBondContact O-N 3.29Å
993	P	95.2	Very high	89	Confident	0 Å²	0	35.6 Å²	35.6	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-68.2	-35.6	176.4	-18.7	33.9	0	0	0	112.8	Y869 L873 I903 I906 Y945 Y948 L991 Q995 K996 I997	Y869-P993 HydrophobicContact CE2-CG 4.48Å; Y869-P993 WeakPolarHBondContact OH-CA 2.96Å; Y869-P993 WeakPolarHBondContact OH-CB 3.26Å; L873-P993 HydrophobicContact CD2-CG 4.28Å; I903-P993 HydrophobicContact CD1-CG 4.06Å; I903-P993 HydrophobicContact CG1-CG 4.43Å; I906-P993 HydrophobicContact CD1-CB 4.18Å; Y945-P993 HydrophobicContact CD1-CB 4.18Å; Y945-P993 HydrophobicContact CE1-CB 4.01Å; Y948-P993 HydrophobicContact CD1-CB 3.85Å; Y948-P993 HydrophobicContact CD1-CG 4.19Å; Y948-P993 HydrophobicContact CE1-CB 3.82Å; Y948-P993 HydrophobicContact CE1-CG 3.66Å; L991-P993 VanDerWaalsContact C-CD 3.45Å; P993-Q995 VanDerWaalsContact C-N 3.32Å; P993-K996 PolarHBondContact O-N 2.96Å; P993-I997 WeakPolarHBondContact O-CG2 3.44Å; P993-I997 PolarHBondContact O-N 3.27Å
994	V	88.9	Confident	89.6	Confident	33 Å²	33	29.5 Å²	29.5	20%	0.2	17%	0.172	C	C	.	.	H	α-helix	trans	-68.1	-35.1	176.9	-171.3	0	0	0	0	110.6	Y948 H952 L991 T992 C998	Y948-V994 HydrophobicContact CD1-CG2 3.97Å; Y948-V994 HydrophobicContact CE1-CG2 4Å; H952-V994 HydrophobicContact CB-CG2 4.41Å; L991-V994 HydrophobicContact CD1-CB 4.2Å; L991-V994 WeakPolarHBondContact O-CB 3.47Å; L991-V994 PolarHBondContact O-N 2.87Å; T992-V994 PolarHBondContact O-N 2.84Å; V994-C998 PolarHBondContact O-SG 3.38Å
995	Q	85.8	Confident	89.8	Confident	63 Å²	63	27.3 Å²	27.3	29%	0.294	17%	0.165	S	C	.	.	H	α-helix	trans	-70.9	-48.3	173	-70.8	169.4	-37.8	0	0	111.9	W772 L991 T992 P993 I997 C998 K999	W772-Q995 HydrophobicContact CH2-CB 3.99Å; W772-Q995 HydrophobicContact CH2-CG 4.03Å; W772-Q995 HydrophobicContact CZ2-CB 4.2Å; W772-Q995 HydrophobicContact CZ2-CG 4.08Å; L991-Q995 HydrophobicContact CG-CG 4.15Å; L991-Q995 PolarHBondContact O-N 2.96Å; L991-Q995 VanDerWaalsContact O-N 3.08Å; T992-Q995 PolarHBondContact O-N 3.49Å; P993-Q995 VanDerWaalsContact C-N 3.32Å; Q995-I997 PolarHBondContact O-N 3.08Å; Q995-C998 PolarHBondContact O-N 3.01Å; Q995-C998 VanDerWaalsContact O-N 3.15Å; Q995-K999 PolarHBondContact O-N 2.75Å; Q995-K999 VanDerWaalsContact O-N 3.16Å
996	K	93.6	Very high	89.9	Confident	11 Å²	11	26.4 Å²	26.4	5%	0.048	15%	0.153	C	C	.	.	H	α-helix	trans	-64.6	-41.5	-173	-174.2	58.6	172.9	169.8	0	112.5	T865 E866 Y869 T992 P993 C998 K999 Y1000	T865-K996 PolarHBondContact OG1-NZ 3.25Å; E866-K996 VanDerWaalsContact CD-CE 3.41Å; E866-K996 WeakPolarHBondContact OE1-CE 3.37Å; E866-K996 IonicContact OE1-NZ 2.81Å; E866-K996 PolarHBondContact OE1-NZ 2.9Å; E866-K996 WeakPolarHBondContact OE2-CE 3.35Å; E866-K996 IonicContact OE2-NZ 2.92Å; Y869-K996 HydrophobicContact CD1-CB 4.34Å; Y869-K996 HydrophobicContact CD1-CD 4.47Å; Y869-K996 HydrophobicContact CD1-CG 3.73Å; Y869-K996 HydrophobicContact CD2-CB 4.33Å; Y869-K996 HydrophobicContact CD2-CG 4.49Å; Y869-K996 HydrophobicContact CE1-CB 4.13Å; Y869-K996 HydrophobicContact CE1-CG 3.79Å; Y869-K996 HydrophobicContact CE2-CB 4.14Å; Y869-K996 HydrophobicContact CG-CB 4.44Å; Y869-K996 HydrophobicContact CG-CG 4.1Å; T992-K996 WeakPolarHBondContact O-CB 3.26Å; T992-K996 PolarHBondContact O-N 3.29Å; P993-K996 PolarHBondContact O-N 2.96Å; K996-C998 PolarHBondContact O-N 3.42Å; K996-K999 PolarHBondContact O-N 3.43Å; K996-Y1000 HydrophobicContact CD-CE1 4.26Å; K996-Y1000 VanDerWaalsContact CE-CE1 3.41Å; K996-Y1000 HydrophobicContact CG-CE1 4.37Å; K996-Y1000 HydrophobicContact CG-CE2 4Å; K996-Y1000 WeakPolarHBondContact O-CD2 3.16Å; K996-Y1000 PolarHBondContact O-N 2.97Å
997	I	90.6	Very high	90	Very high	2 Å²	2	26.1 Å²	26.1	1%	0.01	15%	0.151	C	C	.	.	H	α-helix	trans	-62.1	-27.4	177.2	-162.1	58.8	0	0	0	113	F942 Y945 P993 Q995 Y1000 M1028 V1031 I1035	F942-I997 HydrophobicContact CB-CD1 4.3Å; F942-I997 HydrophobicContact CD1-CD1 3.95Å; F942-I997 HydrophobicContact CG-CD1 4.49Å; Y945-I997 HydrophobicContact CD1-CB 3.72Å; Y945-I997 HydrophobicContact CD1-CD1 4.3Å; Y945-I997 HydrophobicContact CD1-CG1 4.12Å; Y945-I997 HydrophobicContact CD1-CG2 4.26Å; Y945-I997 HydrophobicContact CD2-CD1 4.1Å; Y945-I997 HydrophobicContact CE1-CB 4.2Å; Y945-I997 HydrophobicContact CE2-CD1 4.48Å; Y945-I997 HydrophobicContact CG-CB 4.13Å; Y945-I997 HydrophobicContact CG-CD1 3.99Å; Y945-I997 HydrophobicContact CG-CG1 4Å; P993-I997 WeakPolarHBondContact O-CG2 3.44Å; P993-I997 PolarHBondContact O-N 3.27Å; Q995-I997 PolarHBondContact O-N 3.08Å; I997-Y1000 HydrophobicContact CD1-CD2 4.04Å; I997-Y1000 HydrophobicContact CD1-CE2 4.2Å; I997-M1028 HydrophobicContact CD1-CE 3.99Å; I997-V1031 HydrophobicContact CD1-CG1 3.9Å; I997-V1031 HydrophobicContact CG1-CG1 4.32Å; I997-I1035 HydrophobicContact CD1-CD1 4.35Å; I997-I1035 HydrophobicContact CG1-CD1 3.54Å; I997-I1035 HydrophobicContact CG2-CD1 4.48Å
998	C	84.8	Confident	90.2	Very high	30 Å²	30	25.7 Å²	25.7	20%	0.203	14%	0.143	C	C	.	.	H	α-helix	trans	-83.1	-18.4	173.9	-59.7	0	0	0	0	113.6	V994 Q995 K996	V994-C998 PolarHBondContact O-SG 3.38Å; Q995-C998 PolarHBondContact O-N 3.01Å; Q995-C998 VanDerWaalsContact O-N 3.15Å; K996-C998 PolarHBondContact O-N 3.42Å
999	K	85.8	Confident	90.5	Very high	52 Å²	52	30.8 Å²	30.8	23%	0.226	16%	0.159	C	C	.	.	H	α-helix	trans	-81.5	-32.6	178.8	-76.3	-168.6	173.8	-165.2	0	113.5	W772 Q995 K996 L1002 Q1003	W772-K999 HydrophobicContact CH2-CG 4.25Å; W772-K999 VanDerWaalsContact CZ2-CE 3.43Å; Q995-K999 PolarHBondContact O-N 2.75Å; Q995-K999 VanDerWaalsContact O-N 3.16Å; K996-K999 PolarHBondContact O-N 3.43Å; K999-L1002 WeakPolarHBondContact O-CA 3.31Å; K999-L1002 WeakPolarHBondContact O-CB 3.48Å; K999-L1002 PolarHBondContact O-N 3.19Å; K999-Q1003 PolarHBondContact O-N 3.23Å
1000	Y	94.6	Very high	90.6	Very high	1 Å²	1	32.4 Å²	32.4	0%	0.004	17%	0.165	C	C	.	.	H	α-helix	trans	-53	-43.6	-176	-64.9	-60.9	0	0	0	114.6	E866 Q910 F913 F935 F942 K996 I997 L1002 Q1003 L1004 M1028	E866-Y1000 WeakPolarHBondContact OE1-CE1 3.4Å; E866-Y1000 PolarHBondContact OE2-OH 3.31Å; Q910-Y1000 PolarHBondContact OE1-OH 3.26Å; F913-Y1000 HydrophobicContact CE1-CE1 4.01Å; F935-Y1000 AromaticContact CE1-CD1 3.51Å; F935-Y1000 HydrophobicContact CE1-CD1 3.51Å; F935-Y1000 AromaticContact CE1-CE1 3.92Å; F935-Y1000 HydrophobicContact CE1-CE1 3.92Å; F935-Y1000 HydrophobicContact CE1-CG 4.04Å; F935-Y1000 HydrophobicContact CZ-CD1 4.03Å; F935-Y1000 HydrophobicContact CZ-CE1 4.37Å; F942-Y1000 HydrophobicContact CD1-CE2 4.29Å; F942-Y1000 HydrophobicContact CE1-CD2 4.32Å; F942-Y1000 AromaticContact CE1-CE2 3.77Å; F942-Y1000 HydrophobicContact CE1-CE2 3.77Å; K996-Y1000 HydrophobicContact CD-CE1 4.26Å; K996-Y1000 VanDerWaalsContact CE-CE1 3.41Å; K996-Y1000 HydrophobicContact CG-CE1 4.37Å; K996-Y1000 HydrophobicContact CG-CE2 4Å; K996-Y1000 WeakPolarHBondContact O-CD2 3.16Å; K996-Y1000 PolarHBondContact O-N 2.97Å; I997-Y1000 HydrophobicContact CD1-CD2 4.04Å; I997-Y1000 HydrophobicContact CD1-CE2 4.2Å; Y1000-L1002 VanDerWaalsContact C-N 3.28Å; Y1000-L1002 PolarHBondContact O-N 3.24Å; Y1000-Q1003 PolarHBondContact O-N 2.88Å; Y1000-L1004 WeakPolarHBondContact O-CB 3.21Å; Y1000-L1004 WeakPolarHBondContact O-CG 3.14Å; Y1000-L1004 PolarHBondContact O-N 3.09Å; Y1000-M1028 HydrophobicContact CD2-CE 3.4Å; Y1000-M1028 HydrophobicContact CE2-CE 4.17Å; Y1000-M1028 HydrophobicContact CG-CE 3.76Å
1001	P	88	Confident	90.7	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.006	17%	0.165	C	C	.	.	H	α-helix	trans	-60.5	-33.8	174.5	-25.7	36.7	0	0	0	114.1	I156 G1005 Y1025 M1028 K1029 A1032	I156-P1001 HydrophobicContact CD1-CB 3.78Å; I156-P1001 HydrophobicContact CD1-CG 4.45Å; P1001-G1005 PolarHBondContact O-N 3.11Å; P1001-Y1025 VanDerWaalsContact O-CD2 3.3Å; P1001-Y1025 WeakPolarHBondContact O-CD2 3.19Å; P1001-Y1025 VanDerWaalsContact O-CE2 3.24Å; P1001-Y1025 WeakPolarHBondContact O-CE2 3.38Å; P1001-M1028 HydrophobicContact CG-CB 4.18Å; P1001-K1029 HydrophobicContact CB-CG 3.99Å; P1001-A1032 HydrophobicContact CG-CB 4.15Å
1002	L	84.6	Confident	90.7	Very high	102 Å²	102	32.8 Å²	32.8	53%	0.534	17%	0.171	S	C	.	.	H	α-helix	trans	-73.6	-46.8	179.9	-53.9	177.9	0	0	0	110.4	K999 Y1000 L1004 G1005 E1006	K999-L1002 WeakPolarHBondContact O-CA 3.31Å; K999-L1002 WeakPolarHBondContact O-CB 3.48Å; K999-L1002 PolarHBondContact O-N 3.19Å; Y1000-L1002 VanDerWaalsContact C-N 3.28Å; Y1000-L1002 PolarHBondContact O-N 3.24Å; L1002-L1004 PolarHBondContact O-N 3.27Å; L1002-G1005 PolarHBondContact O-N 3.35Å; L1002-E1006 PolarHBondContact O-N 3.19Å
1003	Q	89.3	Confident	90.9	Very high	16 Å²	16	40.5 Å²	40.5	8%	0.075	20%	0.203	C	C	.	.	H	α-helix	trans	-63.5	-40.6	178.7	-62.8	-174.4	-86.6	0	0	111.6	I862 T865 K999 Y1000 L1007	I862-Q1003 HydrophobicContact CD1-CB 4.26Å; I862-Q1003 HydrophobicContact CG1-CB 4Å; T865-Q1003 PolarHBondContact OG1-NE2 3.26Å; T865-Q1003 VanDerWaalsContact OG1-NE2 3.08Å; K999-Q1003 PolarHBondContact O-N 3.23Å; Y1000-Q1003 PolarHBondContact O-N 2.88Å; Q1003-L1007 VanDerWaalsContact O-CB 3.32Å; Q1003-L1007 WeakPolarHBondContact O-CB 3.37Å; Q1003-L1007 PolarHBondContact O-N 2.93Å
1004	L	93.8	Very high	90.7	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-71.2	-32.1	175.3	-72.2	167	0	0	0	113.2	F935 Y1000 L1002 L1007 L1008 V1021 A1024 Y1025 M1028	F935-L1004 HydrophobicContact CD1-CD1 3.94Å; F935-L1004 HydrophobicContact CD2-CD1 4.38Å; F935-L1004 HydrophobicContact CD2-CD2 3.97Å; F935-L1004 HydrophobicContact CE1-CD1 3.97Å; F935-L1004 HydrophobicContact CE1-CG 4.49Å; F935-L1004 HydrophobicContact CE2-CD1 4.43Å; F935-L1004 HydrophobicContact CE2-CD2 3.77Å; F935-L1004 HydrophobicContact CE2-CG 4.39Å; F935-L1004 HydrophobicContact CG-CD1 4.14Å; F935-L1004 HydrophobicContact CZ-CD1 4.22Å; F935-L1004 HydrophobicContact CZ-CD2 4.14Å; F935-L1004 HydrophobicContact CZ-CG 4.27Å; Y1000-L1004 WeakPolarHBondContact O-CB 3.21Å; Y1000-L1004 WeakPolarHBondContact O-CG 3.14Å; Y1000-L1004 PolarHBondContact O-N 3.09Å; L1002-L1004 PolarHBondContact O-N 3.27Å; L1004-L1007 HydrophobicContact CD2-CD2 4.36Å; L1004-L1008 WeakPolarHBondContact O-CB 3.44Å; L1004-L1008 PolarHBondContact O-N 3.18Å; L1004-V1021 HydrophobicContact CD2-CG1 4.37Å; L1004-A1024 HydrophobicContact CD1-CB 4.02Å; L1004-A1024 HydrophobicContact CD2-CB 4.19Å; L1004-Y1025 HydrophobicContact CB-CD2 4.26Å; L1004-M1028 HydrophobicContact CD1-CB 4.06Å; L1004-M1028 HydrophobicContact CD1-CG 3.66Å
1005	G	87.3	Confident	91.1	Very high	20 Å²	20	47.1 Å²	47.1	21%	0.206	24%	0.236	C	C	.	.	H	α-helix	trans	-68.2	-45.3	176.1	0	0	0	0	0	112.8	P1001 L1002 L1007 L1008 K1009	P1001-G1005 PolarHBondContact O-N 3.11Å; L1002-G1005 PolarHBondContact O-N 3.35Å; G1005-L1007 VanDerWaalsContact C-N 3.32Å; G1005-L1008 PolarHBondContact O-N 3.25Å; G1005-K1009 PolarHBondContact O-N 2.9Å; G1005-K1009 VanDerWaalsContact O-N 3.13Å
1006	E	89.3	Confident	91.6	Very high	58 Å²	58	53.9 Å²	53.9	27%	0.271	26%	0.259	S	S	.	.	H	α-helix	trans	-70.8	-29.2	175.6	-168	66.9	-173.3	0	0	111.5	V858 L1002 K1009 Y1010	V858-E1006 HydrophobicContact CG2-CG 4.13Å; L1002-E1006 PolarHBondContact O-N 3.19Å; E1006-K1009 IonicContact OE1-NZ 3.53Å; E1006-K1009 PolarHBondContact OE1-NZ 2.84Å; E1006-K1009 WeakPolarHBondContact OE2-CD 3.43Å; E1006-K1009 IonicContact OE2-NZ 3.21Å; E1006-K1009 PolarHBondContact OE2-NZ 3.43Å; E1006-Y1010 HydrophobicContact CG-CE2 3.88Å; E1006-Y1010 WeakPolarHBondContact O-CD2 3.49Å; E1006-Y1010 WeakPolarHBondContact OE1-CE2 3.42Å; E1006-Y1010 VanDerWaalsContact OE1-CZ 3.27Å; E1006-Y1010 PolarHBondContact OE1-OH 3Å
1007	L	93.5	Very high	91.7	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-64.1	-49.2	169	-176.1	64.8	0	0	0	111.2	R855 V858 V859 I862 I931 Q1003 L1004 G1005 K1009 Y1010 T1011 V1021	R855-L1007 HydrophobicContact CG-CD1 3.97Å; V858-L1007 HydrophobicContact CB-CD1 4.35Å; V858-L1007 HydrophobicContact CG1-CB 3.84Å; V858-L1007 HydrophobicContact CG1-CD1 4.02Å; V859-L1007 HydrophobicContact CG2-CD1 3.67Å; I862-L1007 HydrophobicContact CD1-CD2 4.15Å; I931-L1007 HydrophobicContact CD1-CD2 3.86Å; I931-L1007 HydrophobicContact CG1-CD2 4Å; Q1003-L1007 VanDerWaalsContact O-CB 3.32Å; Q1003-L1007 WeakPolarHBondContact O-CB 3.37Å; Q1003-L1007 PolarHBondContact O-N 2.93Å; L1004-L1007 HydrophobicContact CD2-CD2 4.36Å; G1005-L1007 VanDerWaalsContact C-N 3.32Å; L1007-K1009 VanDerWaalsContact C-N 3.27Å; L1007-K1009 PolarHBondContact O-N 2.91Å; L1007-Y1010 PolarHBondContact O-N 3.43Å; L1007-T1011 PolarHBondContact O-N 2.62Å; L1007-T1011 PolarHBondContact O-OG1 2.76Å; L1007-V1021 HydrophobicContact CB-CG1 4.24Å; L1007-V1021 HydrophobicContact CD2-CG1 3.95Å; L1007-V1021 HydrophobicContact CD2-CG2 3.68Å; L1007-V1021 HydrophobicContact CG-CG1 4.05Å; L1007-V1021 HydrophobicContact CG-CG2 4.26Å
1008	L	95.2	Very high	92	Very high	35 Å²	35	55.7 Å²	55.7	18%	0.183	27%	0.268	C	S	.	.	H	α-helix	trans	-58	-39.6	-179.5	-173.1	59	0	0	0	112.1	L1004 G1005 Y1010 T1011 V1021 Y1025	L1004-L1008 WeakPolarHBondContact O-CB 3.44Å; L1004-L1008 PolarHBondContact O-N 3.18Å; G1005-L1008 PolarHBondContact O-N 3.25Å; L1008-Y1010 VanDerWaalsContact C-N 3.3Å; L1008-Y1010 PolarHBondContact O-N 2.73Å; L1008-T1011 PolarHBondContact O-N 3.22Å; L1008-V1021 HydrophobicContact CB-CG1 3.87Å; L1008-V1021 HydrophobicContact CD1-CB 4.41Å; L1008-V1021 HydrophobicContact CD1-CG1 4.14Å; L1008-Y1025 HydrophobicContact CD2-CD1 4.36Å
1009	K	93.2	Very high	92.6	Very high	130 Å²	130	57 Å²	57	57%	0.565	28%	0.28	S	S	*	.	H	α-helix	trans	-55.9	-36.8	177	177.7	-169.1	177.8	-173.4	0	113.9	G1005 E1006 L1007	G1005-K1009 PolarHBondContact O-N 2.9Å; G1005-K1009 VanDerWaalsContact O-N 3.13Å; E1006-K1009 IonicContact OE1-NZ 3.53Å; E1006-K1009 PolarHBondContact OE1-NZ 2.84Å; E1006-K1009 WeakPolarHBondContact OE2-CD 3.43Å; E1006-K1009 IonicContact OE2-NZ 3.21Å; E1006-K1009 PolarHBondContact OE2-NZ 3.43Å; L1007-K1009 VanDerWaalsContact C-N 3.27Å; L1007-K1009 PolarHBondContact O-N 2.91Å
1010	Y	93.4	Very high	93.1	Very high	36 Å²	36	55.3 Å²	55.3	14%	0.141	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	13.3	175.4	-50	-64.7	0	0	0	113.3	M854 V858 E1006 L1007 L1008 P1012	M854-Y1010 HydrophobicContact CB-CD1 3.71Å; M854-Y1010 HydrophobicContact CB-CD2 3.89Å; M854-Y1010 HydrophobicContact CB-CE1 3.95Å; M854-Y1010 HydrophobicContact CB-CE2 4.1Å; M854-Y1010 HydrophobicContact CB-CG 3.7Å; M854-Y1010 HydrophobicContact CE-CE1 4.18Å; M854-Y1010 HydrophobicContact CE-CE2 3.83Å; M854-Y1010 WeakPolarHBondContact CE-OH 3.5Å; M854-Y1010 HydrophobicContact CG-CD1 4.42Å; M854-Y1010 HydrophobicContact CG-CE1 4.25Å; V858-Y1010 HydrophobicContact CG2-CD2 4.13Å; V858-Y1010 HydrophobicContact CG2-CE2 4.26Å; E1006-Y1010 HydrophobicContact CG-CE2 3.88Å; E1006-Y1010 WeakPolarHBondContact O-CD2 3.49Å; E1006-Y1010 WeakPolarHBondContact OE1-CE2 3.42Å; E1006-Y1010 VanDerWaalsContact OE1-CZ 3.27Å; E1006-Y1010 PolarHBondContact OE1-OH 3Å; L1007-Y1010 PolarHBondContact O-N 3.43Å; L1008-Y1010 VanDerWaalsContact C-N 3.3Å; L1008-Y1010 PolarHBondContact O-N 2.73Å; Y1010-P1012 WeakPolarHBondContact O-CD 3.35Å
1011	T	94.8	Very high	93.3	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.031	28%	0.277	C	S	.	.	S	Bend	trans	-102	103.9	175.9	-54	0	0	0	0	108.9	R855 L1007 L1008 H1015 H1018	R855-T1011 PolarHBondContact NH1-OG1 3.2Å; L1007-T1011 PolarHBondContact O-N 2.62Å; L1007-T1011 PolarHBondContact O-OG1 2.76Å; L1008-T1011 PolarHBondContact O-N 3.22Å; T1011-H1015 HydrophobicContact CG2-CB 3.9Å; T1011-H1018 HydrophobicContact CG2-CB 3.88Å; T1011-H1018 PolarHBondContact O-CE1 3.42Å; T1011-H1018 PolarHBondContact O-ND1 2.81Å
1012	P	92.9	Very high	93.7	Very high	71 Å²	71	57.4 Å²	57.4	46%	0.461	29%	0.292	S	S	.	.			trans	-68.8	158.9	-179.6	33.3	-36.5	0	0	0	110.5	Y1010 D1014 H1015 H1018	Y1010-P1012 WeakPolarHBondContact O-CD 3.35Å; P1012-D1014 VanDerWaalsContact C-N 3.27Å; P1012-D1014 VanDerWaalsContact CB-OD1 3.27Å; P1012-D1014 WeakPolarHBondContact CB-OD1 3.25Å; P1012-D1014 PolarHBondContact O-N 2.84Å; P1012-H1015 HydrophobicContact CG-CB 4.05Å; P1012-H1015 WeakPolarHBondContact O-CB 3.28Å; P1012-H1015 PolarHBondContact O-N 3.33Å; P1012-H1018 PolarHBondContact O-ND1 2.73Å
1013	K	93.6	Very high	94.3	Very high	185 Å²	185	58.2 Å²	58.2	80%	0.804	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.3	-23	-163.7	-68.1	-177.6	177.5	178	0	114.6
1014	D	92.9	Very high	94.7	Very high	141 Å²	141	57.4 Å²	57.4	75%	0.754	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-17	174.2	57.7	-37.8	0	0	0	113	P1012 R1016	P1012-D1014 VanDerWaalsContact C-N 3.27Å; P1012-D1014 VanDerWaalsContact CB-OD1 3.27Å; P1012-D1014 WeakPolarHBondContact CB-OD1 3.25Å; P1012-D1014 PolarHBondContact O-N 2.84Å; D1014-R1016 PolarHBondContact O-N 2.89Å
1015	H	95.9	Very high	94.8	Very high	30 Å²	30	60.2 Å²	60.2	14%	0.139	30%	0.301	C	S	.	.	S	Bend	trans	-65.6	130.6	176.6	-171.7	-86.1	0	0	0	111	R855 H927 T1011 P1012 D1017 H1018	R855-H1015 VanDerWaalsContact CZ-CE1 3.5Å; R855-H1015 PolarHBondContact NH2-CE1 2.99Å; H927-H1015 PolarHBondContact O-NE2 2.66Å; T1011-H1015 HydrophobicContact CG2-CB 3.9Å; P1012-H1015 HydrophobicContact CG-CB 4.05Å; P1012-H1015 WeakPolarHBondContact O-CB 3.28Å; P1012-H1015 PolarHBondContact O-N 3.33Å; H1015-D1017 VanDerWaalsContact CE1-CB 3.44Å; H1015-D1017 WeakPolarHBondContact CE1-CB 3.16Å; H1015-D1017 VanDerWaalsContact ND1-CB 3.33Å; H1015-D1017 WeakPolarHBondContact ND1-CB 3.48Å; H1015-D1017 PolarHBondContact ND1-N 3.18Å; H1015-D1017 VanDerWaalsContact ND1-N 3.18Å; H1015-D1017 PolarHBondContact O-N 2.75Å; H1015-H1018 WeakPolarHBondContact O-CB 3.37Å; H1015-H1018 PolarHBondContact O-N 3.37Å
1016	R	95.8	Very high	95.1	Very high	206 Å²	206	63.9 Å²	63.9	78%	0.777	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.9	-33.8	-174.6	-69.5	168.4	48.9	145.5	-2.2	114.5	E930 D1014	E930-R1016 IonicContact OE1-CZ 3.15Å; E930-R1016 IonicContact OE1-NE 2.73Å; E930-R1016 PolarHBondContact OE1-NE 2.85Å; E930-R1016 IonicContact OE1-NH2 2.73Å; E930-R1016 PolarHBondContact OE1-NH2 2.72Å; E930-R1016 IonicContact OE2-NH2 3.78Å; D1014-R1016 PolarHBondContact O-N 2.89Å
1017	D	96.9	Very high	95.3	Very high	6 Å²	6	63 Å²	63	3%	0.032	32%	0.315	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	-6.8	178.9	-163.2	38.8	0	0	0	114	R855 E930 I931 G932 H1015 A1019 G1020 V1021	R855-D1017 IonicContact CZ-OD2 3.66Å; R855-D1017 IonicContact NH1-OD2 2.61Å; R855-D1017 PolarHBondContact NH1-OD2 3.33Å; R855-D1017 IonicContact NH2-OD2 3.65Å; R855-D1017 PolarHBondContact NH2-OD2 2.72Å; E930-D1017 WeakPolarHBondContact CA-OD1 3.37Å; E930-D1017 HydrophobicContact CG-CB 4.49Å; I931-D1017 PolarHBondContact N-OD1 2.59Å; I931-D1017 PolarHBondContact N-OD2 2.74Å; G932-D1017 PolarHBondContact N-OD1 2.93Å; H1015-D1017 VanDerWaalsContact CE1-CB 3.44Å; H1015-D1017 WeakPolarHBondContact CE1-CB 3.16Å; H1015-D1017 VanDerWaalsContact ND1-CB 3.33Å; H1015-D1017 WeakPolarHBondContact ND1-CB 3.48Å; H1015-D1017 PolarHBondContact ND1-N 3.18Å; H1015-D1017 VanDerWaalsContact ND1-N 3.18Å; H1015-D1017 PolarHBondContact O-N 2.75Å; D1017-A1019 PolarHBondContact O-N 2.96Å; D1017-G1020 PolarHBondContact O-N 3.36Å; D1017-V1021 HydrophobicContact CB-CG2 4.43Å; D1017-V1021 VanDerWaalsContact CG-CG2 3.5Å; D1017-V1021 WeakPolarHBondContact O-CG2 3.4Å; D1017-V1021 PolarHBondContact O-N 3.19Å; D1017-V1021 WeakPolarHBondContact OD2-CG2 3.33Å
1018	H	97.3	Very high	95.3	Very high	45 Å²	45	63.1 Å²	63.1	21%	0.208	32%	0.315	C	S	.	.	H	α-helix	trans	-59.1	-49	-171.8	-173.9	89.3	0	0	0	113	T1011 P1012 H1015 V1021 S1022	T1011-H1018 HydrophobicContact CG2-CB 3.88Å; T1011-H1018 PolarHBondContact O-CE1 3.42Å; T1011-H1018 PolarHBondContact O-ND1 2.81Å; P1012-H1018 PolarHBondContact O-ND1 2.73Å; H1015-H1018 WeakPolarHBondContact O-CB 3.37Å; H1015-H1018 PolarHBondContact O-N 3.37Å; H1018-V1021 PolarHBondContact O-N 3.43Å; H1018-S1022 WeakPolarHBondContact O-CB 3.45Å; H1018-S1022 PolarHBondContact O-N 2.95Å
1019	A	96.9	Very high	94.8	Very high	57 Å²	57	63.3 Å²	63.3	47%	0.471	32%	0.315	S	S	.	.	H	α-helix	trans	-61.9	-46.4	175.4	0	0	0	0	0	111.3	D1017 V1021 S1022 E1023	D1017-A1019 PolarHBondContact O-N 2.96Å; A1019-V1021 PolarHBondContact O-N 3.36Å; A1019-S1022 PolarHBondContact O-N 3.07Å; A1019-E1023 WeakPolarHBondContact O-CB 3.37Å; A1019-E1023 WeakPolarHBondContact O-CG 3.2Å; A1019-E1023 PolarHBondContact O-N 3.15Å
1020	G	96.7	Very high	94.5	Very high	16 Å²	16	62.4 Å²	62.4	17%	0.165	31%	0.311	C	S	.	.	H	α-helix	trans	-60.4	-40.4	179.3	0	0	0	0	0	113.6	D1017 A1024	D1017-G1020 PolarHBondContact O-N 3.36Å; G1020-A1024 WeakPolarHBondContact O-CB 3.44Å; G1020-A1024 PolarHBondContact O-N 3.21Å
1021	V	97.4	Very high	94.3	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-72.1	-39.8	175.4	175.7	0	0	0	0	111.3	L1004 L1007 L1008 D1017 H1018 A1019 A1024 Y1025	L1004-V1021 HydrophobicContact CD2-CG1 4.37Å; L1007-V1021 HydrophobicContact CB-CG1 4.24Å; L1007-V1021 HydrophobicContact CD2-CG1 3.95Å; L1007-V1021 HydrophobicContact CD2-CG2 3.68Å; L1007-V1021 HydrophobicContact CG-CG1 4.05Å; L1007-V1021 HydrophobicContact CG-CG2 4.26Å; L1008-V1021 HydrophobicContact CB-CG1 3.87Å; L1008-V1021 HydrophobicContact CD1-CB 4.41Å; L1008-V1021 HydrophobicContact CD1-CG1 4.14Å; D1017-V1021 HydrophobicContact CB-CG2 4.43Å; D1017-V1021 VanDerWaalsContact CG-CG2 3.5Å; D1017-V1021 WeakPolarHBondContact O-CG2 3.4Å; D1017-V1021 PolarHBondContact O-N 3.19Å; D1017-V1021 WeakPolarHBondContact OD2-CG2 3.33Å; H1018-V1021 PolarHBondContact O-N 3.43Å; A1019-V1021 PolarHBondContact O-N 3.36Å; V1021-A1024 PolarHBondContact O-N 3.27Å; V1021-Y1025 VanDerWaalsContact O-CB 3.26Å; V1021-Y1025 WeakPolarHBondContact O-CB 3.27Å; V1021-Y1025 PolarHBondContact O-N 2.99Å
1022	S	97.6	Very high	93.7	Very high	46 Å²	46	62.7 Å²	62.7	32%	0.322	32%	0.318	S	S	.	.	H	α-helix	trans	-63.8	-44	177.5	-171	0	0	0	0	112	H1018 A1019 E1026	H1018-S1022 WeakPolarHBondContact O-CB 3.45Å; H1018-S1022 PolarHBondContact O-N 2.95Å; A1019-S1022 PolarHBondContact O-N 3.07Å; S1022-E1026 PolarHBondContact O-N 3.19Å
1023	E	96.9	Very high	93.1	Very high	119 Å²	119	62.4 Å²	62.4	56%	0.556	32%	0.318	S	S	*	.	H	α-helix	trans	-68	-42.4	175	-72.3	176.5	-149.5	0	0	111.4	L936 A1019 Y1025 E1026 A1027	L936-E1023 HydrophobicContact CD1-CB 3.9Å; L936-E1023 HydrophobicContact CD2-CB 3.96Å; A1019-E1023 WeakPolarHBondContact O-CB 3.37Å; A1019-E1023 WeakPolarHBondContact O-CG 3.2Å; A1019-E1023 PolarHBondContact O-N 3.15Å; E1023-Y1025 VanDerWaalsContact C-N 3.32Å; E1023-Y1025 PolarHBondContact O-N 3.01Å; E1023-E1026 PolarHBondContact O-N 3.09Å; E1023-A1027 WeakPolarHBondContact O-CB 3.46Å; E1023-A1027 PolarHBondContact O-N 3.45Å
1024	A	96.9	Very high	92.5	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.291	C	S	.	.	H	α-helix	trans	-61.2	-39.6	176	0	0	0	0	0	112.3	F935 L936 L1004 G1020 V1021 A1027 M1028	F935-A1024 HydrophobicContact CB-CB 3.74Å; F935-A1024 HydrophobicContact CD2-CB 4.5Å; F935-A1024 HydrophobicContact CG-CB 4.27Å; L936-A1024 HydrophobicContact CD2-CB 4.42Å; L936-A1024 HydrophobicContact CG-CB 4.35Å; L1004-A1024 HydrophobicContact CD1-CB 4.02Å; L1004-A1024 HydrophobicContact CD2-CB 4.19Å; G1020-A1024 WeakPolarHBondContact O-CB 3.44Å; G1020-A1024 PolarHBondContact O-N 3.21Å; V1021-A1024 PolarHBondContact O-N 3.27Å; A1024-A1027 PolarHBondContact O-N 3.37Å; A1024-M1028 WeakPolarHBondContact O-CB 3.35Å; A1024-M1028 WeakPolarHBondContact O-CG 3.5Å; A1024-M1028 PolarHBondContact O-N 2.74Å
1025	Y	95.8	Very high	92	Very high	59 Å²	59	49.7 Å²	49.7	23%	0.231	26%	0.259	C	S	.	.	H	α-helix	trans	-59	-50.6	175.9	172.1	-110.9	0	0	0	111.1	P1001 L1004 L1008 V1021 E1023 M1028 K1029	P1001-Y1025 VanDerWaalsContact O-CD2 3.3Å; P1001-Y1025 WeakPolarHBondContact O-CD2 3.19Å; P1001-Y1025 VanDerWaalsContact O-CE2 3.24Å; P1001-Y1025 WeakPolarHBondContact O-CE2 3.38Å; L1004-Y1025 HydrophobicContact CB-CD2 4.26Å; L1008-Y1025 HydrophobicContact CD2-CD1 4.36Å; V1021-Y1025 VanDerWaalsContact O-CB 3.26Å; V1021-Y1025 WeakPolarHBondContact O-CB 3.27Å; V1021-Y1025 PolarHBondContact O-N 2.99Å; E1023-Y1025 VanDerWaalsContact C-N 3.32Å; E1023-Y1025 PolarHBondContact O-N 3.01Å; Y1025-M1028 PolarHBondContact O-N 2.86Å; Y1025-K1029 HydrophobicContact CD1-CD 3.78Å; Y1025-K1029 HydrophobicContact CD2-CD 4.03Å; Y1025-K1029 HydrophobicContact CE1-CD 3.52Å; Y1025-K1029 VanDerWaalsContact CE1-NZ 3.35Å; Y1025-K1029 HydrophobicContact CE2-CD 3.78Å; Y1025-K1029 HydrophobicContact CE2-CG 4.49Å; Y1025-K1029 HydrophobicContact CG-CD 4.04Å; Y1025-K1029 WeakPolarHBondContact O-CB 3.29Å; Y1025-K1029 WeakPolarHBondContact O-CD 3.34Å; Y1025-K1029 WeakPolarHBondContact O-CG 3.48Å; Y1025-K1029 PolarHBondContact O-N 3.17Å
1026	E	94.1	Very high	91.2	Very high	97 Å²	97	50.7 Å²	50.7	45%	0.453	27%	0.265	S	S	.	.	H	α-helix	trans	-67.5	-37.8	176.9	-63.7	-54.6	150.9	0	0	113	S1022 E1023 K1029 K1030	S1022-E1026 PolarHBondContact O-N 3.19Å; E1023-E1026 PolarHBondContact O-N 3.09Å; E1026-K1029 PolarHBondContact O-N 2.69Å; E1026-K1029 IonicContact OE1-NZ 2.87Å; E1026-K1029 PolarHBondContact OE1-NZ 3.39Å; E1026-K1029 VanDerWaalsContact OE2-CE 3.24Å; E1026-K1029 WeakPolarHBondContact OE2-CE 3.48Å; E1026-K1029 IonicContact OE2-NZ 2.88Å; E1026-K1029 PolarHBondContact OE2-NZ 2.89Å; E1026-K1030 WeakPolarHBondContact O-CB 3.28Å; E1026-K1030 PolarHBondContact O-N 3.34Å
1027	A	93.3	Very high	90.2	Very high	38 Å²	38	42.1 Å²	42.1	31%	0.314	23%	0.234	S	C	.	.	H	α-helix	trans	-60.4	-47.3	174.3	0	0	0	0	0	111.7	L936 E1023 A1024 K1029 K1030 V1031	L936-A1027 HydrophobicContact CD2-CB 4.23Å; E1023-A1027 WeakPolarHBondContact O-CB 3.46Å; E1023-A1027 PolarHBondContact O-N 3.45Å; A1024-A1027 PolarHBondContact O-N 3.37Å; A1027-K1029 PolarHBondContact O-N 2.99Å; A1027-K1030 WeakPolarHBondContact O-CB 3.5Å; A1027-K1030 PolarHBondContact O-N 3.34Å; A1027-V1031 WeakPolarHBondContact O-CG2 3.41Å; A1027-V1031 PolarHBondContact O-N 3.13Å
1028	M	93.1	Very high	89.3	Confident	3 Å²	3	45.5 Å²	45.5	2%	0.015	25%	0.246	C	C	.	.	H	α-helix	trans	-71.3	-29.6	179.3	-65.2	-51.5	-71.8	0	0	112.6	F935 F942 I997 Y1000 P1001 L1004 A1024 Y1025 V1031 A1032	F935-M1028 HydrophobicContact CD1-CG 3.88Å; F935-M1028 HydrophobicContact CD1-SD 4.12Å; F935-M1028 HydrophobicContact CE1-CG 4.5Å; F942-M1028 HydrophobicContact CD1-CE 3.74Å; F942-M1028 HydrophobicContact CD2-CE 4.03Å; F942-M1028 HydrophobicContact CD2-SD 3.74Å; F942-M1028 HydrophobicContact CE1-CE 3.73Å; F942-M1028 HydrophobicContact CE1-SD 4.47Å; F942-M1028 HydrophobicContact CE2-CE 4.03Å; F942-M1028 HydrophobicContact CE2-SD 3.68Å; F942-M1028 HydrophobicContact CG-CE 3.89Å; F942-M1028 HydrophobicContact CG-SD 4.18Å; F942-M1028 HydrophobicContact CZ-CE 3.88Å; F942-M1028 HydrophobicContact CZ-SD 4.07Å; I997-M1028 HydrophobicContact CD1-CE 3.99Å; Y1000-M1028 HydrophobicContact CD2-CE 3.4Å; Y1000-M1028 HydrophobicContact CE2-CE 4.17Å; Y1000-M1028 HydrophobicContact CG-CE 3.76Å; P1001-M1028 HydrophobicContact CG-CB 4.18Å; L1004-M1028 HydrophobicContact CD1-CB 4.06Å; L1004-M1028 HydrophobicContact CD1-CG 3.66Å; A1024-M1028 WeakPolarHBondContact O-CB 3.35Å; A1024-M1028 WeakPolarHBondContact O-CG 3.5Å; A1024-M1028 PolarHBondContact O-N 2.74Å; Y1025-M1028 PolarHBondContact O-N 2.86Å; M1028-V1031 PolarHBondContact O-N 2.91Å; M1028-V1031 HydrophobicContact SD-CG2 4.49Å; M1028-A1032 WeakPolarHBondContact O-CB 3.43Å; M1028-A1032 PolarHBondContact O-N 3.28Å
1029	K	86.4	Confident	88.2	Confident	40 Å²	40	45.9 Å²	45.9	17%	0.174	25%	0.247	C	C	.	.	H	α-helix	trans	-62.4	-44.7	167.3	-72.1	161.6	67.9	-170.4	0	111.4	I156 P1001 Y1025 E1026 A1027 V1031 A1032 S1033	I156-K1029 HydrophobicContact CD1-CG 4.05Å; I156-K1029 HydrophobicContact CG2-CD 4.23Å; I156-K1029 VanDerWaalsContact CG2-CE 3.42Å; I156-K1029 HydrophobicContact CG2-CG 4.22Å; P1001-K1029 HydrophobicContact CB-CG 3.99Å; Y1025-K1029 HydrophobicContact CD1-CD 3.78Å; Y1025-K1029 HydrophobicContact CD2-CD 4.03Å; Y1025-K1029 HydrophobicContact CE1-CD 3.52Å; Y1025-K1029 VanDerWaalsContact CE1-NZ 3.35Å; Y1025-K1029 HydrophobicContact CE2-CD 3.78Å; Y1025-K1029 HydrophobicContact CE2-CG 4.49Å; Y1025-K1029 HydrophobicContact CG-CD 4.04Å; Y1025-K1029 WeakPolarHBondContact O-CB 3.29Å; Y1025-K1029 WeakPolarHBondContact O-CD 3.34Å; Y1025-K1029 WeakPolarHBondContact O-CG 3.48Å; Y1025-K1029 PolarHBondContact O-N 3.17Å; E1026-K1029 PolarHBondContact O-N 2.69Å; E1026-K1029 IonicContact OE1-NZ 2.87Å; E1026-K1029 PolarHBondContact OE1-NZ 3.39Å; E1026-K1029 VanDerWaalsContact OE2-CE 3.24Å; E1026-K1029 WeakPolarHBondContact OE2-CE 3.48Å; E1026-K1029 IonicContact OE2-NZ 2.88Å; E1026-K1029 PolarHBondContact OE2-NZ 2.89Å; A1027-K1029 PolarHBondContact O-N 2.99Å; K1029-V1031 PolarHBondContact O-N 3.01Å; K1029-A1032 PolarHBondContact O-N 2.86Å; K1029-S1033 WeakPolarHBondContact O-CB 3.22Å; K1029-S1033 PolarHBondContact O-N 3.46Å
1030	K	86.6	Confident	87.5	Confident	111 Å²	111	46.4 Å²	46.4	48%	0.483	24%	0.237	S	C	.	.	H	α-helix	trans	-59.7	-44.9	175.3	-167.3	179.2	-179.7	-179.9	0	111.1	E1026 A1027 S1033 L1034 M1184	E1026-K1030 WeakPolarHBondContact O-CB 3.28Å; E1026-K1030 PolarHBondContact O-N 3.34Å; A1027-K1030 WeakPolarHBondContact O-CB 3.5Å; A1027-K1030 PolarHBondContact O-N 3.34Å; K1030-S1033 PolarHBondContact O-N 3.02Å; K1030-L1034 HydrophobicContact CG-CD1 4.38Å; K1030-L1034 WeakPolarHBondContact O-CB 3.26Å; K1030-L1034 WeakPolarHBondContact O-CG 3.42Å; K1030-L1034 PolarHBondContact O-N 3.03Å; K1030-M1184 HydrophobicContact CD-SD 4.35Å; K1030-M1184 WeakPolarHBondContact CE-SD 3.48Å; K1030-M1184 HydrophobicContact CG-CE 3.86Å; K1030-M1184 HydrophobicContact CG-SD 4.26Å
1031	V	88.3	Confident	86.6	Confident	25 Å²	25	45.7 Å²	45.7	15%	0.152	23%	0.229	C	C	.	.	H	α-helix	trans	-61.8	-49	175.6	170.9	0	0	0	0	112.3	F942 I997 A1027 M1028 K1029 S1033 L1034 I1035	F942-V1031 HydrophobicContact CB-CG1 3.9Å; F942-V1031 HydrophobicContact CB-CG2 4.4Å; I997-V1031 HydrophobicContact CD1-CG1 3.9Å; I997-V1031 HydrophobicContact CG1-CG1 4.32Å; A1027-V1031 WeakPolarHBondContact O-CG2 3.41Å; A1027-V1031 PolarHBondContact O-N 3.13Å; M1028-V1031 PolarHBondContact O-N 2.91Å; M1028-V1031 HydrophobicContact SD-CG2 4.49Å; K1029-V1031 PolarHBondContact O-N 3.01Å; V1031-S1033 VanDerWaalsContact C-N 3.31Å; V1031-S1033 PolarHBondContact O-N 2.89Å; V1031-L1034 WeakPolarHBondContact O-CB 3.06Å; V1031-L1034 PolarHBondContact O-N 2.87Å; V1031-I1035 HydrophobicContact CG1-CD1 3.92Å; V1031-I1035 WeakPolarHBondContact O-CG1 3.38Å; V1031-I1035 PolarHBondContact O-N 3.47Å
1032	A	83.2	Confident	85.6	Confident	21 Å²	21	48.2 Å²	48.2	17%	0.174	24%	0.242	C	C	.	.	H	α-helix	trans	-61.9	-39.6	178.2	0	0	0	0	0	111.8	P1001 M1028 K1029 I1035 N1036	P1001-A1032 HydrophobicContact CG-CB 4.15Å; M1028-A1032 WeakPolarHBondContact O-CB 3.43Å; M1028-A1032 PolarHBondContact O-N 3.28Å; K1029-A1032 PolarHBondContact O-N 2.86Å; A1032-I1035 PolarHBondContact O-N 3.47Å; A1032-N1036 WeakPolarHBondContact O-CB 3.31Å; A1032-N1036 PolarHBondContact O-N 2.93Å
1033	S	79.5	Confident	84.6	Confident	66 Å²	66	51.4 Å²	51.4	46%	0.462	25%	0.252	S	S	.	.	H	α-helix	trans	-66.5	-41.2	175.2	-165.3	0	0	0	0	112.5	K1029 K1030 V1031 I1035 N1036 E1037	K1029-S1033 WeakPolarHBondContact O-CB 3.22Å; K1029-S1033 PolarHBondContact O-N 3.46Å; K1030-S1033 PolarHBondContact O-N 3.02Å; V1031-S1033 VanDerWaalsContact C-N 3.31Å; V1031-S1033 PolarHBondContact O-N 2.89Å; S1033-I1035 PolarHBondContact O-N 3.32Å; S1033-N1036 PolarHBondContact O-N 3.49Å; S1033-E1037 VanDerWaalsContact O-CB 3.26Å; S1033-E1037 WeakPolarHBondContact O-CB 3.47Å; S1033-E1037 PolarHBondContact O-N 3.06Å
1034	L	80.9	Confident	84	Confident	45 Å²	45	46.7 Å²	46.7	24%	0.236	23%	0.232	C	C	.	.	H	α-helix	trans	-59	-43.7	174.4	-85	166.2	0	0	0	112.4	K1030 V1031 E1037 R1038 M1184 I1186	K1030-L1034 HydrophobicContact CG-CD1 4.38Å; K1030-L1034 WeakPolarHBondContact O-CB 3.26Å; K1030-L1034 WeakPolarHBondContact O-CG 3.42Å; K1030-L1034 PolarHBondContact O-N 3.03Å; V1031-L1034 WeakPolarHBondContact O-CB 3.06Å; V1031-L1034 PolarHBondContact O-N 2.87Å; L1034-E1037 PolarHBondContact O-N 3.04Å; L1034-R1038 WeakPolarHBondContact O-CB 3.35Å; L1034-R1038 PolarHBondContact O-N 3.37Å; L1034-M1184 HydrophobicContact CD1-CE 4.31Å; L1034-M1184 HydrophobicContact CD1-SD 4.26Å; L1034-M1184 HydrophobicContact CD2-CB 3.98Å; L1034-M1184 HydrophobicContact CD2-CE 3.68Å; L1034-M1184 HydrophobicContact CD2-CG 4.26Å; L1034-M1184 HydrophobicContact CD2-SD 3.73Å; L1034-M1184 HydrophobicContact CG-CE 3.66Å; L1034-M1184 HydrophobicContact CG-SD 4.07Å; L1034-I1186 HydrophobicContact CD2-CD1 4.05Å; L1034-I1186 HydrophobicContact CD2-CG1 4.25Å
1035	I	82.4	Confident	83.5	Confident	13 Å²	13	47 Å²	47	7%	0.067	23%	0.234	C	C	.	.	H	α-helix	trans	-69.5	-42.2	-179.1	-67.1	170.6	0	0	0	110.9	C949 I997 V1031 A1032 S1033 K1039	C949-I1035 HydrophobicContact CB-CG2 3.62Å; I997-I1035 HydrophobicContact CD1-CD1 4.35Å; I997-I1035 HydrophobicContact CG1-CD1 3.54Å; I997-I1035 HydrophobicContact CG2-CD1 4.48Å; V1031-I1035 HydrophobicContact CG1-CD1 3.92Å; V1031-I1035 WeakPolarHBondContact O-CG1 3.38Å; V1031-I1035 PolarHBondContact O-N 3.47Å; A1032-I1035 PolarHBondContact O-N 3.47Å; S1033-I1035 PolarHBondContact O-N 3.32Å; I1035-K1039 WeakPolarHBondContact O-CB 3.21Å; I1035-K1039 PolarHBondContact O-N 3.33Å
1036	N	78.5	Confident	83	Confident	51 Å²	51	47.6 Å²	47.6	27%	0.273	24%	0.241	S	C	.	.	H	α-helix	trans	-57.6	-51.4	171.5	-175.7	17.9	0	0	0	111.4	L153 A1032 S1033 K1039 R1040	L153-N1036 HydrophobicContact CD1-CB 4.36Å; L153-N1036 WeakPolarHBondContact CD1-OD1 3.34Å; L153-N1036 HydrophobicContact CD2-CB 4.09Å; A1032-N1036 WeakPolarHBondContact O-CB 3.31Å; A1032-N1036 PolarHBondContact O-N 2.93Å; S1033-N1036 PolarHBondContact O-N 3.49Å; N1036-K1039 WeakPolarHBondContact O-CB 3.46Å; N1036-K1039 PolarHBondContact O-N 2.99Å; N1036-R1040 WeakPolarHBondContact O-CB 3.23Å; N1036-R1040 PolarHBondContact O-N 3.49Å
1037	E	76.4	Confident	82.6	Confident	26 Å²	26	46 Å²	46	12%	0.121	24%	0.238	C	C	.	.	H	α-helix	trans	-69.2	-43.1	-174.1	179.6	57.6	-167.5	0	0	112.3	S1033 L1034 K1039 R1040 R1041 R1177 I1186	S1033-E1037 VanDerWaalsContact O-CB 3.26Å; S1033-E1037 WeakPolarHBondContact O-CB 3.47Å; S1033-E1037 PolarHBondContact O-N 3.06Å; L1034-E1037 PolarHBondContact O-N 3.04Å; E1037-K1039 VanDerWaalsContact C-N 3.28Å; E1037-K1039 PolarHBondContact O-N 2.76Å; E1037-R1040 PolarHBondContact O-N 3.22Å; E1037-R1040 VanDerWaalsContact O-N 3.15Å; E1037-R1040 IonicContact OE1-CZ 3.12Å; E1037-R1040 IonicContact OE1-NE 3.4Å; E1037-R1040 IonicContact OE1-NH2 3.32Å; E1037-R1040 PolarHBondContact OE1-NH2 3.28Å; E1037-R1040 IonicContact OE2-CZ 3.94Å; E1037-R1040 IonicContact OE2-NE 3.66Å; E1037-R1040 PolarHBondContact OE2-NE 3.35Å; E1037-R1040 IonicContact OE2-NH2 3.1Å; E1037-R1040 PolarHBondContact OE2-NH2 2.78Å; E1037-R1041 HydrophobicContact CG-CG 4.43Å; E1037-R1041 WeakPolarHBondContact O-CB 3.37Å; E1037-R1041 VanDerWaalsContact O-CG 3.28Å; E1037-R1041 WeakPolarHBondContact O-CG 3.5Å; E1037-R1041 PolarHBondContact O-N 2.72Å; E1037-R1041 IonicContact OE1-CZ 3.41Å; E1037-R1041 IonicContact OE1-NE 2.72Å; E1037-R1041 PolarHBondContact OE1-NE 2.87Å; E1037-R1041 IonicContact OE1-NH2 2.71Å; E1037-R1177 IonicContact OE1-CZ 3.09Å; E1037-R1177 IonicContact OE1-NE 2.84Å; E1037-R1177 PolarHBondContact OE1-NE 3.17Å; E1037-R1177 IonicContact OE1-NH2 3.92Å; E1037-R1177 PolarHBondContact OE1-NH2 3.39Å; E1037-I1186 HydrophobicContact CG-CD1 4.11Å
1038	R	77.3	Confident	82.6	Confident	78 Å²	78	44.3 Å²	44.3	29%	0.294	22%	0.224	S	C	.	.	H	α-helix	trans	-60.6	-40	175.2	-172	177	-77.6	151.1	-12	110.9	S946 L1034 R1041 L1042 I1186	S946-R1038 WeakPolarHBondContact OG-CD 2.8Å; S946-R1038 PolarHBondContact OG-NH1 2.91Å; L1034-R1038 WeakPolarHBondContact O-CB 3.35Å; L1034-R1038 PolarHBondContact O-N 3.37Å; R1038-R1041 PolarHBondContact O-N 3.15Å; R1038-L1042 HydrophobicContact CG-CD1 4Å; R1038-L1042 WeakPolarHBondContact O-CD1 3.33Å; R1038-L1042 PolarHBondContact O-N 3.37Å; R1038-I1186 HydrophobicContact CB-CG2 4.46Å; R1038-I1186 HydrophobicContact CG-CG2 4.44Å
1039	K	74.7	Confident	82.5	Confident	53 Å²	53	44.1 Å²	44.1	23%	0.23	22%	0.223	C	C	.	.	H	α-helix	trans	-62.9	-45.9	173.4	179.8	177	177.8	174.1	0	112.3	N950 I1035 N1036 E1037 R1041 L1042 E1043	N950-K1039 WeakPolarHBondContact OD1-CA 3.34Å; I1035-K1039 WeakPolarHBondContact O-CB 3.21Å; I1035-K1039 PolarHBondContact O-N 3.33Å; N1036-K1039 WeakPolarHBondContact O-CB 3.46Å; N1036-K1039 PolarHBondContact O-N 2.99Å; E1037-K1039 VanDerWaalsContact C-N 3.28Å; E1037-K1039 PolarHBondContact O-N 2.76Å; K1039-R1041 VanDerWaalsContact C-N 3.3Å; K1039-R1041 PolarHBondContact O-N 2.9Å; K1039-L1042 WeakPolarHBondContact O-CB 3.36Å; K1039-L1042 PolarHBondContact O-N 3.12Å; K1039-E1043 WeakPolarHBondContact CE-OE1 3.37Å; K1039-E1043 PolarHBondContact O-N 2.78Å; K1039-E1043 VanDerWaalsContact O-N 3.08Å
1040	R	81.1	Confident	82.6	Confident	67 Å²	67	45.5 Å²	45.5	25%	0.253	23%	0.23	S	C	.	.	H	α-helix	trans	-60.3	-39.9	176.5	-167.3	-171.1	70.8	87.4	-3.2	111.6	N1036 E1037 E1043 S1044 D1069	N1036-R1040 WeakPolarHBondContact O-CB 3.23Å; N1036-R1040 PolarHBondContact O-N 3.49Å; E1037-R1040 PolarHBondContact O-N 3.22Å; E1037-R1040 VanDerWaalsContact O-N 3.15Å; E1037-R1040 IonicContact OE1-CZ 3.12Å; E1037-R1040 IonicContact OE1-NE 3.4Å; E1037-R1040 IonicContact OE1-NH2 3.32Å; E1037-R1040 PolarHBondContact OE1-NH2 3.28Å; E1037-R1040 IonicContact OE2-CZ 3.94Å; E1037-R1040 IonicContact OE2-NE 3.66Å; E1037-R1040 PolarHBondContact OE2-NE 3.35Å; E1037-R1040 IonicContact OE2-NH2 3.1Å; E1037-R1040 PolarHBondContact OE2-NH2 2.78Å; R1040-E1043 PolarHBondContact O-N 3.11Å; R1040-S1044 WeakPolarHBondContact O-CB 3.45Å; R1040-S1044 PolarHBondContact O-N 3.11Å; R1040-S1044 PolarHBondContact O-OG 3.45Å; R1040-D1069 IonicContact CZ-OD1 3.83Å; R1040-D1069 IonicContact CZ-OD2 3.53Å; R1040-D1069 VanDerWaalsContact CZ-OD2 3.31Å; R1040-D1069 IonicContact NH1-OD1 3.14Å; R1040-D1069 PolarHBondContact NH1-OD1 3.48Å; R1040-D1069 IonicContact NH1-OD2 2.75Å; R1040-D1069 PolarHBondContact NH1-OD2 3.03Å; R1040-D1069 VanDerWaalsContact NH2-CG 3.34Å; R1040-D1069 IonicContact NH2-OD1 3.98Å; R1040-D1069 IonicContact NH2-OD2 2.72Å; R1040-D1069 PolarHBondContact NH2-OD2 2.84Å
1041	R	78.2	Confident	82.9	Confident	1 Å²	1	40.6 Å²	40.6	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-62.2	-46.6	173.1	-69.2	-72.8	-179.5	145.7	6.7	111.1	E1037 R1038 K1039 E1043 S1044 I1045 S1068 D1094 R1177 D1181 I1188	E1037-R1041 HydrophobicContact CG-CG 4.43Å; E1037-R1041 WeakPolarHBondContact O-CB 3.37Å; E1037-R1041 VanDerWaalsContact O-CG 3.28Å; E1037-R1041 WeakPolarHBondContact O-CG 3.5Å; E1037-R1041 PolarHBondContact O-N 2.72Å; E1037-R1041 IonicContact OE1-CZ 3.41Å; E1037-R1041 IonicContact OE1-NE 2.72Å; E1037-R1041 PolarHBondContact OE1-NE 2.87Å; E1037-R1041 IonicContact OE1-NH2 2.71Å; R1038-R1041 PolarHBondContact O-N 3.15Å; K1039-R1041 VanDerWaalsContact C-N 3.3Å; K1039-R1041 PolarHBondContact O-N 2.9Å; R1041-E1043 VanDerWaalsContact C-N 3.34Å; R1041-E1043 PolarHBondContact O-N 3.19Å; R1041-S1044 CarbonylContact O-C 3.58Å; R1041-S1044 WeakPolarHBondContact O-CA 3.45Å; R1041-S1044 WeakPolarHBondContact O-CB 3.36Å; R1041-S1044 PolarHBondContact O-N 3.13Å; R1041-I1045 VanDerWaalsContact O-CG1 3.29Å; R1041-I1045 WeakPolarHBondContact O-CG1 3.46Å; R1041-I1045 PolarHBondContact O-N 2.97Å; R1041-S1068 PolarHBondContact NH1-OG 2.91Å; R1041-D1094 IonicContact CZ-OD2 3.18Å; R1041-D1094 IonicContact NH1-OD2 2.71Å; R1041-D1094 PolarHBondContact NH1-OD2 3.1Å; R1041-R1177 VanDerWaalsContact NH2-CZ 3.28Å; R1041-D1181 IonicContact CZ-OD1 3.99Å; R1041-D1181 IonicContact CZ-OD2 2.77Å; R1041-D1181 IonicContact NH1-OD2 3.77Å; R1041-D1181 VanDerWaalsContact NH2-CG 3.31Å; R1041-D1181 IonicContact NH2-OD1 2.64Å; R1041-D1181 PolarHBondContact NH2-OD1 2.79Å; R1041-D1181 IonicContact NH2-OD2 3.89Å; R1041-D1181 PolarHBondContact NH2-OD2 3.38Å; R1041-I1188 HydrophobicContact CB-CD1 4.32Å
1042	L	76.9	Confident	83.2	Confident	53 Å²	53	39.8 Å²	39.8	28%	0.277	20%	0.203	S	C	.	.	H	α-helix	trans	-54.9	-45.8	175	-95.7	76.8	0	0	0	112.8	N950 R1038 K1039 S1044	N950-L1042 HydrophobicContact CB-CD2 3.97Å; R1038-L1042 HydrophobicContact CG-CD1 4Å; R1038-L1042 WeakPolarHBondContact O-CD1 3.33Å; R1038-L1042 PolarHBondContact O-N 3.37Å; K1039-L1042 WeakPolarHBondContact O-CB 3.36Å; K1039-L1042 PolarHBondContact O-N 3.12Å; L1042-S1044 VanDerWaalsContact C-N 3.28Å; L1042-S1044 PolarHBondContact O-N 3.42Å
1043	E	76.5	Confident	83.7	Confident	114 Å²	114	41.7 Å²	41.7	53%	0.533	21%	0.212	S	C	.	.	H	α-helix	trans	-68.3	-27.1	176	-64.7	-175.6	-162.8	0	0	112.7	K1039 R1040 R1041 T1047	K1039-E1043 WeakPolarHBondContact CE-OE1 3.37Å; K1039-E1043 PolarHBondContact O-N 2.78Å; K1039-E1043 VanDerWaalsContact O-N 3.08Å; R1040-E1043 PolarHBondContact O-N 3.11Å; R1041-E1043 VanDerWaalsContact C-N 3.34Å; R1041-E1043 PolarHBondContact O-N 3.19Å; E1043-T1047 PolarHBondContact O-OG1 2.98Å
1044	S	83.9	Confident	84.2	Confident	19 Å²	19	40.4 Å²	40.4	13%	0.133	21%	0.206	C	C	.	.	H	α-helix	trans	-76	-41.7	177.8	-58.5	0	0	0	0	112.6	R1040 R1041 L1042 D1046 T1047 I1048 S1068	R1040-S1044 WeakPolarHBondContact O-CB 3.45Å; R1040-S1044 PolarHBondContact O-N 3.11Å; R1040-S1044 PolarHBondContact O-OG 3.45Å; R1041-S1044 CarbonylContact O-C 3.58Å; R1041-S1044 WeakPolarHBondContact O-CA 3.45Å; R1041-S1044 WeakPolarHBondContact O-CB 3.36Å; R1041-S1044 PolarHBondContact O-N 3.13Å; L1042-S1044 VanDerWaalsContact C-N 3.28Å; L1042-S1044 PolarHBondContact O-N 3.42Å; S1044-D1046 PolarHBondContact O-N 2.9Å; S1044-T1047 WeakPolarHBondContact O-CB 3.33Å; S1044-T1047 PolarHBondContact O-N 3.2Å; S1044-T1047 VanDerWaalsContact O-N 3.08Å; S1044-I1048 VanDerWaalsContact O-CG1 3.31Å; S1044-I1048 WeakPolarHBondContact O-CG1 3.36Å; S1044-I1048 PolarHBondContact O-N 2.93Å; S1044-S1068 VanDerWaalsContact CB-O 3.29Å; S1044-S1068 WeakPolarHBondContact CB-O 3.43Å
1045	I	87.3	Confident	84.9	Confident	6 Å²	6	38.8 Å²	38.8	3%	0.031	20%	0.197	C	C	.	.	H	α-helix	trans	-52.1	-53.4	177.9	-64.3	161.1	0	0	0	110.6	R1041 T1047 I1048 A1049 L1064 I1188 A1196	R1041-I1045 VanDerWaalsContact O-CG1 3.29Å; R1041-I1045 WeakPolarHBondContact O-CG1 3.46Å; R1041-I1045 PolarHBondContact O-N 2.97Å; I1045-T1047 PolarHBondContact O-N 2.83Å; I1045-I1048 PolarHBondContact O-N 2.88Å; I1045-A1049 WeakPolarHBondContact O-CB 3.24Å; I1045-A1049 PolarHBondContact O-N 3.13Å; I1045-L1064 HydrophobicContact CB-CD2 4.26Å; I1045-L1064 HydrophobicContact CG1-CD2 4.37Å; I1045-L1064 HydrophobicContact CG2-CD1 3.62Å; I1045-L1064 HydrophobicContact CG2-CD2 3.94Å; I1045-L1064 HydrophobicContact CG2-CG 4.4Å; I1045-I1188 HydrophobicContact CD1-CB 4.32Å; I1045-I1188 HydrophobicContact CD1-CD1 3.83Å; I1045-I1188 HydrophobicContact CD1-CG1 3.99Å; I1045-I1188 HydrophobicContact CD1-CG2 3.38Å; I1045-I1188 HydrophobicContact CG1-CD1 4.06Å; I1045-I1188 HydrophobicContact CG1-CG2 4.28Å; I1045-A1196 HydrophobicContact CG2-CB 3.5Å
1046	D	84.1	Confident	85.4	Confident	73 Å²	73	41.3 Å²	41.3	39%	0.39	21%	0.21	S	C	.	.	H	α-helix	trans	-62.4	-33.4	-177.4	-130.1	13.3	0	0	0	111.4	S1044 H1050	S1044-D1046 PolarHBondContact O-N 2.9Å; D1046-H1050 PolarHBondContact O-N 3.1Å; D1046-H1050 PolarHBondContact O-ND1 2.98Å
1047	T	86.5	Confident	86.2	Confident	63 Å²	63	44.6 Å²	44.6	39%	0.387	22%	0.224	S	C	.	.	H	α-helix	trans	-73.5	-42.8	177.8	-55.1	0	0	0	0	111.8	E1043 S1044 I1045 H1050 W1051 I1233	E1043-T1047 PolarHBondContact O-OG1 2.98Å; S1044-T1047 WeakPolarHBondContact O-CB 3.33Å; S1044-T1047 PolarHBondContact O-N 3.2Å; S1044-T1047 VanDerWaalsContact O-N 3.08Å; I1045-T1047 PolarHBondContact O-N 2.83Å; T1047-H1050 PolarHBondContact O-N 3.45Å; T1047-W1051 PolarHBondContact O-N 3.44Å; T1047-I1233 HydrophobicContact CG2-CG2 3.71Å
1048	I	91.8	Very high	87.1	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.01	23%	0.227	C	C	.	.	H	α-helix	trans	-64.4	-44.4	176.6	-67.8	171.2	0	0	0	110.5	S1044 I1045 H1050 W1051 Q1052 V1063 L1064 S1068 F1093	S1044-I1048 VanDerWaalsContact O-CG1 3.31Å; S1044-I1048 WeakPolarHBondContact O-CG1 3.36Å; S1044-I1048 PolarHBondContact O-N 2.93Å; I1045-I1048 PolarHBondContact O-N 2.88Å; I1048-H1050 PolarHBondContact O-N 3.43Å; I1048-W1051 PolarHBondContact O-N 3.18Å; I1048-Q1052 PolarHBondContact O-N 2.88Å; I1048-V1063 HydrophobicContact CG2-CB 3.7Å; I1048-V1063 HydrophobicContact CG2-CG1 3.53Å; I1048-V1063 HydrophobicContact CG2-CG2 4.36Å; I1048-L1064 HydrophobicContact CB-CD2 3.99Å; I1048-L1064 HydrophobicContact CD1-CD2 4.3Å; I1048-L1064 HydrophobicContact CG2-CD2 3.79Å; I1048-L1064 HydrophobicContact CG2-CG 4.04Å; I1048-S1068 VanDerWaalsContact CD1-C 3.48Å; I1048-F1093 HydrophobicContact CD1-CD1 4.12Å; I1048-F1093 HydrophobicContact CD1-CE1 4.14Å; I1048-F1093 HydrophobicContact CG1-CE1 4.03Å; I1048-F1093 HydrophobicContact CG2-CE1 4.27Å
1049	A	92.3	Very high	87.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-57	-47.6	175.8	0	0	0	0	0	111.9	I1045 W1051 Q1052 V1053 L1064 A1196 I1197 A1200	I1045-A1049 WeakPolarHBondContact O-CB 3.24Å; I1045-A1049 PolarHBondContact O-N 3.13Å; A1049-W1051 VanDerWaalsContact C-N 3.34Å; A1049-W1051 PolarHBondContact O-N 2.85Å; A1049-Q1052 PolarHBondContact O-N 2.87Å; A1049-V1053 WeakPolarHBondContact O-CG2 3.32Å; A1049-V1053 PolarHBondContact O-N 3.4Å; A1049-V1053 VanDerWaalsContact O-N 3.15Å; A1049-L1064 HydrophobicContact CB-CD1 3.93Å; A1049-A1196 HydrophobicContact CB-CB 4.08Å; A1049-I1197 HydrophobicContact CB-CD1 3.96Å; A1049-I1197 HydrophobicContact CB-CG1 4.48Å; A1049-A1200 VanDerWaalsContact C-CB 3.47Å; A1049-A1200 HydrophobicContact CB-CB 3.79Å; A1049-A1200 WeakPolarHBondContact O-CB 3.39Å
1050	H	88.8	Confident	88.7	Confident	68 Å²	68	48 Å²	48	32%	0.315	26%	0.256	S	S	.	.	H	α-helix	trans	-64.7	-34.5	176.9	-82.1	91.1	0	0	0	113.4	D1046 T1047 I1048 A1054 K1204	D1046-H1050 PolarHBondContact O-N 3.1Å; D1046-H1050 PolarHBondContact O-ND1 2.98Å; T1047-H1050 PolarHBondContact O-N 3.45Å; I1048-H1050 PolarHBondContact O-N 3.43Å; H1050-A1054 PolarHBondContact O-N 3.01Å; H1050-K1204 PolarHBondContact NE2-NZ 2.87Å
1051	W	93.1	Very high	89.3	Confident	9 Å²	9	47.6 Å²	47.6	3%	0.034	26%	0.263	C	S	.	.	H	α-helix	trans	-68	-47	174.8	169.7	80.5	0	0	0	112.2	T1047 I1048 A1049 V1053 A1054 I1055 W1058 V1063 F1091 F1093 V1098 I1233	T1047-W1051 PolarHBondContact O-N 3.44Å; I1048-W1051 PolarHBondContact O-N 3.18Å; A1049-W1051 VanDerWaalsContact C-N 3.34Å; A1049-W1051 PolarHBondContact O-N 2.85Å; W1051-V1053 VanDerWaalsContact C-N 3.33Å; W1051-V1053 PolarHBondContact O-N 2.93Å; W1051-A1054 WeakPolarHBondContact O-CA 3.46Å; W1051-A1054 WeakPolarHBondContact O-CB 3.16Å; W1051-A1054 PolarHBondContact O-N 3.35Å; W1051-I1055 HydrophobicContact CD2-CD1 3.8Å; W1051-I1055 HydrophobicContact CE3-CD1 4.02Å; W1051-I1055 HydrophobicContact CH2-CD1 3.51Å; W1051-I1055 HydrophobicContact CZ2-CD1 3.25Å; W1051-I1055 HydrophobicContact CZ3-CD1 3.86Å; W1051-I1055 PolarHBondContact O-N 2.93Å; W1051-W1058 HydrophobicContact CH2-CZ3 4.36Å; W1051-W1058 HydrophobicContact CZ3-CH2 4.25Å; W1051-W1058 HydrophobicContact CZ3-CZ3 4.1Å; W1051-V1063 HydrophobicContact CE3-CG2 4.44Å; W1051-V1063 HydrophobicContact CZ3-CG2 3.86Å; W1051-F1091 HydrophobicContact CH2-CB 4.09Å; W1051-F1091 HydrophobicContact CH2-CD2 4.3Å; W1051-F1091 HydrophobicContact CH2-CG 4.09Å; W1051-F1091 HydrophobicContact CZ2-CB 3.92Å; W1051-F1091 AromaticContact CZ2-CD1 3.64Å; W1051-F1091 HydrophobicContact CZ2-CD1 3.64Å; W1051-F1091 AromaticContact CZ2-CD2 3.58Å; W1051-F1091 HydrophobicContact CZ2-CD2 3.58Å; W1051-F1091 HydrophobicContact CZ2-CE1 4.01Å; W1051-F1091 AromaticContact CZ2-CE2 3.94Å; W1051-F1091 HydrophobicContact CZ2-CE2 3.94Å; W1051-F1091 AromaticContact CZ2-CG 3.42Å; W1051-F1091 HydrophobicContact CZ2-CG 3.42Å; W1051-F1091 VanDerWaalsContact CZ2-CG 3.42Å; W1051-F1091 HydrophobicContact CZ2-CZ 4.15Å; W1051-F1091 AromaticContact NE1-CE1 3.73Å; W1051-F1093 AromaticContact CE3-CZ 3.9Å; W1051-F1093 HydrophobicContact CE3-CZ 3.9Å; W1051-F1093 AromaticContact CH2-CE2 3.67Å; W1051-F1093 HydrophobicContact CH2-CE2 3.67Å; W1051-F1093 AromaticContact CH2-CZ 3.59Å; W1051-F1093 HydrophobicContact CH2-CZ 3.59Å; W1051-F1093 HydrophobicContact CZ2-CZ 4.26Å; W1051-F1093 HydrophobicContact CZ3-CE1 4.48Å; W1051-F1093 AromaticContact CZ3-CE2 3.78Å; W1051-F1093 HydrophobicContact CZ3-CE2 3.78Å; W1051-F1093 AromaticContact CZ3-CZ 3.39Å; W1051-F1093 HydrophobicContact CZ3-CZ 3.39Å; W1051-V1098 HydrophobicContact CH2-CB 4.19Å; W1051-V1098 HydrophobicContact CH2-CG1 3.97Å; W1051-I1233 HydrophobicContact CB-CD1 3.63Å; W1051-I1233 HydrophobicContact CB-CG1 3.8Å; W1051-I1233 HydrophobicContact CD2-CD1 3.43Å; W1051-I1233 VanDerWaalsContact CD2-CD1 3.43Å; W1051-I1233 HydrophobicContact CD2-CG1 4.05Å; W1051-I1233 HydrophobicContact CE3-CD1 4.06Å; W1051-I1233 HydrophobicContact CG-CD1 3.24Å; W1051-I1233 HydrophobicContact CG-CG1 3.42Å; W1051-I1233 VanDerWaalsContact CG-CG1 3.42Å
1052	Q	93.7	Very high	90	Very high	7 Å²	7	49.4 Å²	49.4	3%	0.033	27%	0.273	C	S	.	.	H	α-helix	trans	-63.7	-41.5	-176.5	-163.1	-155.2	-49.6	0	0	111.2	I1048 A1049 A1054 I1055 W1058 D1062 V1063	I1048-Q1052 PolarHBondContact O-N 2.88Å; A1049-Q1052 PolarHBondContact O-N 2.87Å; Q1052-A1054 PolarHBondContact O-N 2.85Å; Q1052-I1055 PolarHBondContact O-N 3.39Å; Q1052-I1055 VanDerWaalsContact O-N 3.09Å; Q1052-W1058 HydrophobicContact CG-CD2 3.62Å; Q1052-W1058 HydrophobicContact CG-CE3 3.64Å; Q1052-W1058 HydrophobicContact CG-CG 4.34Å; Q1052-W1058 HydrophobicContact CG-CH2 3.82Å; Q1052-W1058 HydrophobicContact CG-CZ2 3.78Å; Q1052-W1058 HydrophobicContact CG-CZ3 3.74Å; Q1052-W1058 VanDerWaalsContact NE2-CE2 3.33Å; Q1052-W1058 VanDerWaalsContact NE2-NE1 3.12Å; Q1052-D1062 PolarHBondContact NE2-OD1 3.01Å; Q1052-V1063 HydrophobicContact CB-CG2 4.33Å; Q1052-V1063 HydrophobicContact CG-CG2 3.9Å
1053	V	93.1	Very high	90.8	Very high	62 Å²	62	46.9 Å²	46.9	38%	0.376	26%	0.26	S	S	.	.	H	α-helix	trans	-64	-21.9	174.1	173.3	0	0	0	0	112.6	A1049 W1051 A1200 R1201	A1049-V1053 WeakPolarHBondContact O-CG2 3.32Å; A1049-V1053 PolarHBondContact O-N 3.4Å; A1049-V1053 VanDerWaalsContact O-N 3.15Å; W1051-V1053 VanDerWaalsContact C-N 3.33Å; W1051-V1053 PolarHBondContact O-N 2.93Å; V1053-A1200 HydrophobicContact CB-CB 4.38Å; V1053-A1200 HydrophobicContact CG2-CB 3.86Å; V1053-R1201 HydrophobicContact CG1-CG 4.47Å; V1053-R1201 HydrophobicContact CG2-CG 3.61Å
1054	A	91.5	Very high	91.5	Very high	39 Å²	39	41.7 Å²	41.7	32%	0.322	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.6	-6.2	175.6	0	0	0	0	0	114	H1050 W1051 Q1052 I1231	H1050-A1054 PolarHBondContact O-N 3.01Å; W1051-A1054 WeakPolarHBondContact O-CA 3.46Å; W1051-A1054 WeakPolarHBondContact O-CB 3.16Å; W1051-A1054 PolarHBondContact O-N 3.35Å; Q1052-A1054 PolarHBondContact O-N 2.85Å; A1054-I1231 HydrophobicContact CB-CD1 3.71Å; A1054-I1231 HydrophobicContact CB-CG1 4.28Å; A1054-I1231 VanDerWaalsContact O-CD1 3.29Å; A1054-I1231 WeakPolarHBondContact O-CD1 3.29Å
1055	I	93.8	Very high	91.8	Very high	10 Å²	10	46.9 Å²	46.9	5%	0.051	26%	0.258	C	S	.	.	S	Bend	trans	-87.1	132.6	175.5	-72.4	173.2	0	0	0	110.8	W1051 Q1052 W1058 L1110	W1051-I1055 HydrophobicContact CD2-CD1 3.8Å; W1051-I1055 HydrophobicContact CE3-CD1 4.02Å; W1051-I1055 HydrophobicContact CH2-CD1 3.51Å; W1051-I1055 HydrophobicContact CZ2-CD1 3.25Å; W1051-I1055 HydrophobicContact CZ3-CD1 3.86Å; W1051-I1055 PolarHBondContact O-N 2.93Å; Q1052-I1055 PolarHBondContact O-N 3.39Å; Q1052-I1055 VanDerWaalsContact O-N 3.09Å; I1055-W1058 HydrophobicContact CB-CE3 4.28Å; I1055-W1058 HydrophobicContact CD1-CE3 4.37Å; I1055-W1058 HydrophobicContact CD1-CZ3 4.07Å; I1055-W1058 HydrophobicContact CG2-CE3 4.01Å; I1055-L1110 HydrophobicContact CG1-CB 4.08Å
1056	L	93.9	Very high	91.9	Very high	66 Å²	66	51.8 Å²	51.8	35%	0.346	28%	0.276	S	S	.	.	B	Isolated β-bridge	trans	-81.4	143.3	174	-58.8	-169.9	0	0	0	111.9	L1109 L1110 H1111 Y1112	L1056-L1109 HydrophobicContact CD1-CD1 3.85Å; L1056-L1109 HydrophobicContact CD1-CD2 3.71Å; L1056-L1109 HydrophobicContact CD1-CG 3.91Å; L1056-L1109 HydrophobicContact CD2-CD1 4.45Å; L1056-L1109 HydrophobicContact CG-CD1 3.91Å; L1056-L1109 HydrophobicContact CG-CG 4.3Å; L1056-L1110 PolarHBondContact N-O 2.86Å; L1056-H1111 WeakPolarHBondContact O-CA 3.32Å; L1056-Y1112 PolarHBondContact O-N 2.89Å
1057	H	94.8	Very high	92.2	Very high	120 Å²	120	48.4 Å²	48.4	56%	0.556	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.6	42.8	177.6	-43.4	-83.9	0	0	0	113.4	E1059 H1111 Y1112	H1057-E1059 PolarHBondContact O-N 3.31Å; H1057-H1111 AromaticContact CD2-CD2 3.45Å; H1057-H1111 PolarHBondContact CD2-CD2 3.48Å; H1057-H1111 VanDerWaalsContact CD2-CD2 3.45Å; H1057-H1111 AromaticContact NE2-CD2 3.65Å; H1057-Y1112 WeakPolarHBondContact O-CB 3.2Å
1058	W	95.1	Very high	92.3	Very high	51 Å²	51	46.1 Å²	46.1	19%	0.193	24%	0.244	C	C	.	.			trans	-58.3	133	171.9	-170.5	-94.3	0	0	0	111.1	W1051 Q1052 I1055 G1060 P1061 V1063 V1098 Y1112 R1115	W1051-W1058 HydrophobicContact CH2-CZ3 4.36Å; W1051-W1058 HydrophobicContact CZ3-CH2 4.25Å; W1051-W1058 HydrophobicContact CZ3-CZ3 4.1Å; Q1052-W1058 HydrophobicContact CG-CD2 3.62Å; Q1052-W1058 HydrophobicContact CG-CE3 3.64Å; Q1052-W1058 HydrophobicContact CG-CG 4.34Å; Q1052-W1058 HydrophobicContact CG-CH2 3.82Å; Q1052-W1058 HydrophobicContact CG-CZ2 3.78Å; Q1052-W1058 HydrophobicContact CG-CZ3 3.74Å; Q1052-W1058 VanDerWaalsContact NE2-CE2 3.33Å; Q1052-W1058 VanDerWaalsContact NE2-NE1 3.12Å; I1055-W1058 HydrophobicContact CB-CE3 4.28Å; I1055-W1058 HydrophobicContact CD1-CE3 4.37Å; I1055-W1058 HydrophobicContact CD1-CZ3 4.07Å; I1055-W1058 HydrophobicContact CG2-CE3 4.01Å; W1058-G1060 PolarHBondContact NE1-O 2.9Å; W1058-P1061 PolarHBondContact NE1-O 3.17Å; W1058-V1063 HydrophobicContact CH2-CG2 3.39Å; W1058-V1063 HydrophobicContact CZ2-CG2 3.61Å; W1058-V1063 HydrophobicContact CZ3-CG2 4.37Å; W1058-V1098 HydrophobicContact CH2-CG1 4.07Å; W1058-V1098 HydrophobicContact CH2-CG2 4.23Å; W1058-V1098 HydrophobicContact CZ3-CG1 4.04Å; W1058-Y1112 HydrophobicContact CD2-CD2 4.34Å; W1058-Y1112 AromaticContact CE3-CD2 3.74Å; W1058-Y1112 HydrophobicContact CE3-CD2 3.74Å; W1058-Y1112 HydrophobicContact CE3-CE2 4.3Å; W1058-Y1112 HydrophobicContact CE3-CG 4.42Å; W1058-Y1112 HydrophobicContact CH2-CD2 4.31Å; W1058-Y1112 HydrophobicContact CH2-CE2 4.18Å; W1058-Y1112 AromaticContact CZ3-CD2 3.73Å; W1058-Y1112 HydrophobicContact CZ3-CD2 3.73Å; W1058-Y1112 HydrophobicContact CZ3-CE2 4.08Å; W1058-R1115 VanDerWaalsContact CZ2-NH2 3.32Å
1059	E	94.2	Very high	92	Very high	121 Å²	121	46.2 Å²	46.2	57%	0.565	25%	0.245	S	C	*	.			trans	-132.3	141.1	180	-61.5	158.3	177.3	0	0	109.6	H1057 Y1112 R1115	H1057-E1059 PolarHBondContact O-N 3.31Å; E1059-Y1112 HydrophobicContact CB-CD1 4.01Å; E1059-Y1112 HydrophobicContact CB-CE1 3.66Å; E1059-Y1112 HydrophobicContact CG-CD1 4.25Å; E1059-Y1112 HydrophobicContact CG-CE1 4.34Å; E1059-Y1112 PolarHBondContact O-OH 3.16Å; E1059-R1115 PolarHBondContact O-NH2 3.49Å
1060	G	92.8	Very high	92	Very high	56 Å²	56	46.4 Å²	46.4	58%	0.577	25%	0.246	S	C	*	.	S	Bend	trans	80.8	-174.3	-174.6	0	0	0	0	0	113.9	W1058 R1115	W1058-G1060 PolarHBondContact NE1-O 2.9Å; G1060-R1115 VanDerWaalsContact C-NH2 3.32Å
1061	P	92.8	Very high	92	Very high	60 Å²	60	43.3 Å²	43.3	39%	0.39	23%	0.232	S	C	.	.	S	Bend	trans	-61.2	161.5	-171.9	22.3	-32.7	0	0	0	113.9	W1058 E1065 R1115	W1058-P1061 PolarHBondContact NE1-O 3.17Å; P1061-E1065 HydrophobicContact CB-CB 4.42Å; P1061-E1065 VanDerWaalsContact CB-CD 3.48Å; P1061-E1065 WeakPolarHBondContact CB-OE2 3.35Å; P1061-R1115 PolarHBondContact O-NH1 2.88Å; P1061-R1115 VanDerWaalsContact O-NH1 3.08Å; P1061-R1115 PolarHBondContact O-NH2 3Å
1062	D	93.4	Very high	92	Very high	39 Å²	39	44.8 Å²	44.8	21%	0.209	24%	0.239	C	C	.	.			trans	-65	147.1	173.6	-74	-26.7	0	0	0	109.6	Q1052 L1064 E1065 I1197 R1201	Q1052-D1062 PolarHBondContact NE2-OD1 3.01Å; D1062-L1064 PolarHBondContact O-N 2.77Å; D1062-E1065 VanDerWaalsContact O-CB 3.26Å; D1062-E1065 WeakPolarHBondContact O-CB 3.4Å; D1062-E1065 PolarHBondContact O-N 3.33Å; D1062-E1065 VanDerWaalsContact O-N 3.14Å; D1062-I1197 HydrophobicContact CB-CD1 4.14Å; D1062-I1197 HydrophobicContact CB-CG1 4.45Å; D1062-R1201 IonicContact OD1-NH2 3.38Å; D1062-R1201 PolarHBondContact OD1-NH2 2.82Å; D1062-R1201 IonicContact OD2-CZ 3.2Å; D1062-R1201 IonicContact OD2-NH1 2.67Å; D1062-R1201 IonicContact OD2-NH2 3.57Å; D1062-R1201 PolarHBondContact OD2-NH2 3.43Å
1063	V	93.1	Very high	92	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	25%	0.246	C	C	.	.	G	3₁₀ helix	trans	-57.4	-39.9	-176.7	178.9	0	0	0	0	110.7	I1048 W1051 Q1052 W1058 E1065 R1066 S1067 F1093 Q1096	I1048-V1063 HydrophobicContact CG2-CB 3.7Å; I1048-V1063 HydrophobicContact CG2-CG1 3.53Å; I1048-V1063 HydrophobicContact CG2-CG2 4.36Å; W1051-V1063 HydrophobicContact CE3-CG2 4.44Å; W1051-V1063 HydrophobicContact CZ3-CG2 3.86Å; Q1052-V1063 HydrophobicContact CB-CG2 4.33Å; Q1052-V1063 HydrophobicContact CG-CG2 3.9Å; W1058-V1063 HydrophobicContact CH2-CG2 3.39Å; W1058-V1063 HydrophobicContact CZ2-CG2 3.61Å; W1058-V1063 HydrophobicContact CZ3-CG2 4.37Å; V1063-E1065 PolarHBondContact O-N 2.74Å; V1063-E1065 VanDerWaalsContact O-N 3.1Å; V1063-R1066 PolarHBondContact O-N 3.4Å; V1063-S1067 WeakPolarHBondContact O-CB 3.48Å; V1063-S1067 PolarHBondContact O-N 2.9Å; V1063-F1093 HydrophobicContact CG1-CD1 3.95Å; V1063-F1093 HydrophobicContact CG1-CD2 4.28Å; V1063-F1093 HydrophobicContact CG1-CE1 4.02Å; V1063-F1093 HydrophobicContact CG1-CE2 4.34Å; V1063-F1093 HydrophobicContact CG1-CG 4.09Å; V1063-F1093 HydrophobicContact CG1-CZ 4.22Å; V1063-Q1096 PolarHBondContact O-NE2 3.27Å
1064	L	92.3	Very high	91.9	Very high	4 Å²	4	44 Å²	44	2%	0.021	24%	0.241	C	C	.	.	G	3₁₀ helix	trans	-67.8	-6.6	-176.6	-64.8	174.3	0	0	0	114.5	I1045 I1048 A1049 D1062 S1067 R1193 A1196 I1197	I1045-L1064 HydrophobicContact CB-CD2 4.26Å; I1045-L1064 HydrophobicContact CG1-CD2 4.37Å; I1045-L1064 HydrophobicContact CG2-CD1 3.62Å; I1045-L1064 HydrophobicContact CG2-CD2 3.94Å; I1045-L1064 HydrophobicContact CG2-CG 4.4Å; I1048-L1064 HydrophobicContact CB-CD2 3.99Å; I1048-L1064 HydrophobicContact CD1-CD2 4.3Å; I1048-L1064 HydrophobicContact CG2-CD2 3.79Å; I1048-L1064 HydrophobicContact CG2-CG 4.04Å; A1049-L1064 HydrophobicContact CB-CD1 3.93Å; D1062-L1064 PolarHBondContact O-N 2.77Å; L1064-S1067 WeakPolarHBondContact CA-O 3.2Å; L1064-R1193 HydrophobicContact CB-CB 4.29Å; L1064-R1193 HydrophobicContact CB-CG 4.47Å; L1064-R1193 VanDerWaalsContact O-CD 3.25Å; L1064-R1193 WeakPolarHBondContact O-CD 3.24Å; L1064-R1193 PolarHBondContact O-NH1 2.94Å; L1064-A1196 HydrophobicContact CD1-CB 4.3Å; L1064-I1197 HydrophobicContact CD1-CD1 4.05Å; L1064-I1197 HydrophobicContact CD1-CG1 4.01Å
1065	E	90.1	Very high	92	Very high	129 Å²	129	45.6 Å²	45.6	60%	0.603	24%	0.241	S	C	*	.	G	3₁₀ helix	trans	-69.2	-36.1	174.8	-158.7	171.7	123	0	0	111.6	P1061 D1062 V1063 R1193	P1061-E1065 HydrophobicContact CB-CB 4.42Å; P1061-E1065 VanDerWaalsContact CB-CD 3.48Å; P1061-E1065 WeakPolarHBondContact CB-OE2 3.35Å; D1062-E1065 VanDerWaalsContact O-CB 3.26Å; D1062-E1065 WeakPolarHBondContact O-CB 3.4Å; D1062-E1065 PolarHBondContact O-N 3.33Å; D1062-E1065 VanDerWaalsContact O-N 3.14Å; V1063-E1065 PolarHBondContact O-N 2.74Å; V1063-E1065 VanDerWaalsContact O-N 3.1Å; E1065-R1193 PolarHBondContact O-NH1 3.42Å
1066	R	88.6	Confident	92	Very high	109 Å²	109	45.2 Å²	45.2	41%	0.411	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-122.5	-15.9	177.5	-80.2	-177.8	64.6	-171	-3.8	115.7	V1063 H1095 D1117 D1119	V1063-R1066 PolarHBondContact O-N 3.4Å; R1066-H1095 HydrophobicContact CB-CB 4.48Å; R1066-H1095 PolarHBondContact O-CD2 3.44Å; R1066-D1117 IonicContact CZ-OD1 2.93Å; R1066-D1117 IonicContact CZ-OD2 2.76Å; R1066-D1117 VanDerWaalsContact CZ-OD2 3.28Å; R1066-D1117 IonicContact NH1-OD1 3.32Å; R1066-D1117 IonicContact NH1-OD2 2.84Å; R1066-D1117 PolarHBondContact NH1-OD2 3.21Å; R1066-D1117 VanDerWaalsContact NH2-CG 3.26Å; R1066-D1117 IonicContact NH2-OD1 2.72Å; R1066-D1117 PolarHBondContact NH2-OD1 3.43Å; R1066-D1117 IonicContact NH2-OD2 3.86Å; R1066-D1117 PolarHBondContact NH2-OD2 2.86Å; R1066-D1119 IonicContact CZ-OD2 2.69Å; R1066-D1119 IonicContact NH2-OD2 3.18Å; R1066-D1119 PolarHBondContact NH2-OD2 2.87Å
1067	S	90.8	Very high	92.1	Very high	2 Å²	2	44.3 Å²	44.3	1%	0.014	24%	0.237	C	C	.	.			trans	-123.7	158.1	-172.4	-55.8	0	0	0	0	112.3	V1063 L1064 D1094 Q1096	V1063-S1067 WeakPolarHBondContact O-CB 3.48Å; V1063-S1067 PolarHBondContact O-N 2.9Å; L1064-S1067 WeakPolarHBondContact CA-O 3.2Å; S1067-D1094 WeakPolarHBondContact CA-OD1 3.39Å; S1067-D1094 WeakPolarHBondContact CB-O 3.29Å; S1067-D1094 VanDerWaalsContact CB-OD1 3.26Å; S1067-D1094 WeakPolarHBondContact CB-OD1 3.43Å; S1067-D1094 PolarHBondContact OG-O 3.32Å; S1067-Q1096 WeakPolarHBondContact OG-CG 3.45Å; S1067-Q1096 PolarHBondContact OG-NE2 2.87Å
1068	S	87.7	Confident	92	Very high	15 Å²	15	40.4 Å²	40.4	11%	0.105	22%	0.217	C	C	.	.			trans	-149.2	5.6	172.7	55.2	0	0	0	0	115.9	R1041 S1044 I1048 D1094 I1188	R1041-S1068 PolarHBondContact NH1-OG 2.91Å; S1044-S1068 VanDerWaalsContact CB-O 3.29Å; S1044-S1068 WeakPolarHBondContact CB-O 3.43Å; I1048-S1068 VanDerWaalsContact CD1-C 3.48Å; S1068-D1094 VanDerWaalsContact N-CG 3.27Å; S1068-D1094 PolarHBondContact N-OD1 3.48Å; S1068-D1094 PolarHBondContact N-OD2 3.14Å; S1068-D1094 PolarHBondContact OG-OD2 3.22Å; S1068-I1188 VanDerWaalsContact OG-CD1 3.25Å; S1068-I1188 WeakPolarHBondContact OG-CD1 3.23Å
1069	D	87.3	Confident	91.8	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.016	21%	0.209	C	C	.	.			trans	-139.1	139	172.2	-173.3	25.1	0	0	0	112.4	R1040 I1071 F1093 D1094	R1040-D1069 IonicContact CZ-OD1 3.83Å; R1040-D1069 IonicContact CZ-OD2 3.53Å; R1040-D1069 VanDerWaalsContact CZ-OD2 3.31Å; R1040-D1069 IonicContact NH1-OD1 3.14Å; R1040-D1069 PolarHBondContact NH1-OD1 3.48Å; R1040-D1069 IonicContact NH1-OD2 2.75Å; R1040-D1069 PolarHBondContact NH1-OD2 3.03Å; R1040-D1069 VanDerWaalsContact NH2-CG 3.34Å; R1040-D1069 IonicContact NH2-OD1 3.98Å; R1040-D1069 IonicContact NH2-OD2 2.72Å; R1040-D1069 PolarHBondContact NH2-OD2 2.84Å; D1069-I1071 PolarHBondContact O-N 2.69Å; D1069-F1093 VanDerWaalsContact O-CA 3.25Å; D1069-F1093 WeakPolarHBondContact O-CA 3.35Å; D1069-F1093 WeakPolarHBondContact O-CB 3.34Å; D1069-F1093 WeakPolarHBondContact O-CD1 3.38Å; D1069-D1094 PolarHBondContact N-OD1 3.31Å; D1069-D1094 PolarHBondContact O-N 2.72Å; D1069-D1094 VanDerWaalsContact O-OD1 3.11Å
1070	L	90.4	Very high	91.6	Very high	4 Å²	4	34.5 Å²	34.5	2%	0.021	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	100.6	169	179.4	76.2	0	0	0	109.1	F1091 L1092 F1093 I1233 T1235 S1236	L1070-F1091 HydrophobicContact CD1-CB 3.8Å; L1070-F1091 HydrophobicContact CD1-CD1 4.28Å; L1070-F1091 HydrophobicContact CD2-CD1 4.46Å; L1070-L1092 WeakPolarHBondContact CD1-O 3.26Å; L1070-F1093 HydrophobicContact CB-CD1 4.06Å; L1070-F1093 HydrophobicContact CB-CE1 3.85Å; L1070-F1093 HydrophobicContact CD1-CD1 3.92Å; L1070-F1093 HydrophobicContact CD1-CD2 4.3Å; L1070-F1093 HydrophobicContact CD1-CE1 3.57Å; L1070-F1093 HydrophobicContact CD1-CE2 3.99Å; L1070-F1093 HydrophobicContact CD1-CG 4.26Å; L1070-F1093 HydrophobicContact CD1-CZ 3.61Å; L1070-F1093 HydrophobicContact CG-CE1 4.3Å; L1070-I1233 HydrophobicContact CB-CD1 4.46Å; L1070-I1233 HydrophobicContact CD1-CD1 4.49Å; L1070-I1233 HydrophobicContact CD2-CB 3.65Å; L1070-I1233 HydrophobicContact CD2-CD1 3.83Å; L1070-I1233 HydrophobicContact CD2-CG1 4.05Å; L1070-I1233 HydrophobicContact CD2-CG2 4.06Å; L1070-I1233 HydrophobicContact CG-CD1 4.47Å; L1070-T1235 HydrophobicContact CD2-CG2 4.14Å; L1070-S1236 WeakPolarHBondContact O-CA 3.29Å; L1070-S1236 WeakPolarHBondContact O-CB 3.41Å; L1070-S1236 PolarHBondContact O-N 3.18Å; L1070-S1236 PolarHBondContact O-OG 3.31Å
1071	I	90	Very high	91	Very high	4 Å²	4	38.1 Å²	38.1	2%	0.021	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	-46.8	-176	-65.6	170.5	0	0	0	111.1	D1069 L1092 D1094 K1173 E1174 R1177 S1236	D1069-I1071 PolarHBondContact O-N 2.69Å; I1071-L1092 HydrophobicContact CB-CG 4.5Å; I1071-L1092 HydrophobicContact CG2-CD2 4.43Å; I1071-L1092 PolarHBondContact N-O 2.96Å; I1071-D1094 HydrophobicContact CD1-CB 4.28Å; I1071-K1173 HydrophobicContact CG2-CB 4.47Å; I1071-K1173 HydrophobicContact CG2-CD 4.05Å; I1071-K1173 HydrophobicContact CG2-CG 4.27Å; I1071-E1174 HydrophobicContact CD1-CB 3.73Å; I1071-E1174 HydrophobicContact CD1-CG 3.59Å; I1071-E1174 HydrophobicContact CG2-CB 4.33Å; I1071-R1177 HydrophobicContact CD1-CB 4.16Å; I1071-R1177 HydrophobicContact CD1-CG 4.43Å; I1071-S1236 PolarHBondContact O-OG 3.43Å
1072	H	92.5	Very high	90.1	Very high	40 Å²	40	44.6 Å²	44.6	19%	0.185	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	160.1	176.4	-165.1	66.4	0	0	0	113.9	L1092 W1167 A1170	H1072-L1092 HydrophobicContact CB-CB 4.46Å; H1072-L1092 PolarHBondContact N-O 3.2Å; H1072-L1092 VanDerWaalsContact N-O 3.17Å; H1072-L1092 PolarHBondContact O-N 2.97Å; H1072-W1167 AromaticContact CD2-CD2 3.69Å; H1072-W1167 AromaticContact CD2-CE2 3.47Å; H1072-W1167 VanDerWaalsContact CD2-CE2 3.47Å; H1072-W1167 AromaticContact CD2-CE3 3.99Å; H1072-W1167 AromaticContact CD2-CH2 3.91Å; H1072-W1167 AromaticContact CD2-CZ2 3.62Å; H1072-W1167 AromaticContact CD2-NE1 3.9Å; H1072-W1167 AromaticContact NE2-CE2 3.83Å; H1072-W1167 AromaticContact NE2-NE1 3.77Å; H1072-A1170 HydrophobicContact CB-CB 3.49Å; H1072-A1170 VanDerWaalsContact CB-CB 3.49Å
1073	S	93.9	Very high	89.4	Confident	27 Å²	27	44.4 Å²	44.4	19%	0.189	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.7	151.3	173.9	75.1	0	0	0	0	112.2	F1090 F1091 T1235	S1073-F1090 CarbonylContact C-O 3.55Å; S1073-F1090 WeakPolarHBondContact CA-O 3.46Å; S1073-F1090 WeakPolarHBondContact CB-O 3.36Å; S1073-F1091 VanDerWaalsContact CB-CD1 3.49Å; S1073-T1235 VanDerWaalsContact OG-CG2 3.28Å; S1073-T1235 WeakPolarHBondContact OG-CG2 3.5Å
1074	G	91.9	Very high	89	Confident	25 Å²	25	53 Å²	53	26%	0.258	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	177.9	-179	-174	0	0	0	0	0	113.4	S1089 F1090	G1074-S1089 CarbonylContact O-C 3.56Å; G1074-S1089 WeakPolarHBondContact O-CA 3.33Å; G1074-F1090 PolarHBondContact N-O 2.84Å; G1074-F1090 PolarHBondContact O-N 2.81Å
1075	E	93	Very high	88.9	Confident	73 Å²	73	56.7 Å²	56.7	34%	0.341	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	121.2	176.3	-67.7	-173.6	-178.8	0	0	111.6	Q1087 R1088 K1102 R1159	E1075-Q1087 PolarHBondContact OE2-NE2 3.18Å; E1075-R1088 WeakPolarHBondContact CA-O 3.49Å; E1075-K1102 WeakPolarHBondContact OE1-CE 3.44Å; E1075-K1102 IonicContact OE1-NZ 3.31Å; E1075-K1102 PolarHBondContact OE1-NZ 3.14Å; E1075-R1159 IonicContact OE2-NH2 2.88Å
1076	L	94.3	Very high	89	Confident	2 Å²	2	53.8 Å²	53.8	1%	0.01	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	157.1	177	-60.7	175.4	0	0	0	110.9	Q1087 R1088 F1090 L1156 C1158 W1167	L1076-Q1087 WeakPolarHBondContact O-CA 3.37Å; L1076-R1088 PolarHBondContact N-O 3.3Å; L1076-R1088 PolarHBondContact O-N 3.33Å; L1076-F1090 HydrophobicContact CB-CD2 3.66Å; L1076-F1090 HydrophobicContact CB-CE2 3.77Å; L1076-F1090 HydrophobicContact CD1-CB 4.43Å; L1076-F1090 HydrophobicContact CD1-CD2 4.01Å; L1076-F1090 HydrophobicContact CD1-CE2 4.47Å; L1076-F1090 HydrophobicContact CD1-CG 4.2Å; L1076-F1090 HydrophobicContact CG-CD2 4.11Å; L1076-L1156 HydrophobicContact CD1-CB 4.14Å; L1076-L1156 HydrophobicContact CD1-CD1 3.92Å; L1076-L1156 HydrophobicContact CD1-CG 4.48Å; L1076-C1158 HydrophobicContact CD2-CB 4.32Å; L1076-C1158 WeakPolarHBondContact CD2-SG 3.49Å; L1076-W1167 HydrophobicContact CD1-CD2 3.82Å; L1076-W1167 HydrophobicContact CD1-CE3 4.23Å; L1076-W1167 HydrophobicContact CD1-CG 4.27Å; L1076-W1167 HydrophobicContact CD1-CH2 4.31Å; L1076-W1167 HydrophobicContact CD1-CZ2 3.89Å; L1076-W1167 HydrophobicContact CD1-CZ3 4.45Å; L1076-W1167 HydrophobicContact CD2-CG 4.41Å; L1076-W1167 HydrophobicContact CG-CZ2 4.19Å
1077	T	94.6	Very high	89.3	Confident	47 Å²	47	53 Å²	53	29%	0.288	27%	0.273	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	109.3	171.6	-53.2	0	0	0	0	109.4	P1085 C1157	T1077-P1085 HydrophobicContact CG2-CB 3.82Å; T1077-C1157 PolarHBondContact N-O 3.36Å; T1077-C1157 PolarHBondContact O-N 3.08Å
1078	R	93.6	Very high	89.5	Confident	38 Å²	38	54.6 Å²	54.6	14%	0.143	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	131.1	176.1	-173.9	-180	172.9	-157.9	-3.7	110.8	V1080 P1085 Q1086 F1090 Y1099 C1154 M1155 L1156	R1078-V1080 HydrophobicContact CG-CG2 4.22Å; R1078-P1085 CarbonylContact O-C 3.47Å; R1078-P1085 WeakPolarHBondContact O-CA 3.38Å; R1078-Q1086 PolarHBondContact N-O 3.34Å; R1078-Q1086 PolarHBondContact O-N 2.97Å; R1078-F1090 HydrophobicContact CB-CE2 4.46Å; R1078-F1090 HydrophobicContact CB-CZ 4.1Å; R1078-Y1099 PolarHBondContact NH1-OH 2.94Å; R1078-C1154 HydrophobicContact CG-CB 3.73Å; R1078-M1155 CarbonylContact C-O 3.56Å; R1078-M1155 WeakPolarHBondContact CA-O 3.44Å; R1078-L1156 HydrophobicContact CB-CD2 3.9Å; R1078-L1156 HydrophobicContact CG-CD2 3.95Å
1079	A	91.6	Very high	89.8	Confident	3 Å²	3	54.2 Å²	54.2	3%	0.025	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	146.6	169	0	0	0	0	0	110.7	L1134 L1136 C1154 M1155	A1079-L1134 HydrophobicContact CB-CD1 4.03Å; A1079-L1136 HydrophobicContact CB-CD1 3.99Å; A1079-C1154 WeakPolarHBondContact O-CA 3.48Å; A1079-C1154 VanDerWaalsContact O-CB 3.26Å; A1079-C1154 WeakPolarHBondContact O-CB 3.18Å; A1079-M1155 HydrophobicContact CB-CB 4.39Å; A1079-M1155 PolarHBondContact N-O 2.9Å; A1079-M1155 PolarHBondContact O-N 2.86Å
1080	V	89.1	Confident	90.3	Very high	44 Å²	44	54 Å²	54	27%	0.267	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	147.3	-174.4	-171.5	0	0	0	0	108	R1078 Q1082 G1083 C1154	R1078-V1080 HydrophobicContact CG-CG2 4.22Å; V1080-Q1082 PolarHBondContact O-N 2.97Å; V1080-G1083 PolarHBondContact O-N 2.89Å; V1080-C1154 HydrophobicContact CG2-CB 4Å
1081	R	81.1	Confident	90.6	Very high	132 Å²	132	54.4 Å²	54.4	50%	0.498	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	-47.7	-37.1	-171.6	-58	-166.9	-161.7	-110.6	15.9	114.5	D1133 L1134 F1152	R1081-D1133 IonicContact NH1-OD1 3.85Å; R1081-D1133 PolarHBondContact NH1-OD1 3.27Å; R1081-L1134 HydrophobicContact CB-CD2 4.42Å; R1081-L1134 HydrophobicContact CG-CD2 4.28Å; R1081-F1152 HydrophobicContact CG-CD1 3.65Å; R1081-F1152 HydrophobicContact CG-CE1 3.78Å
1082	Q	72.8	Confident	90.9	Very high	197 Å²	197	54.2 Å²	54.2	92%	0.921	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.3	42.1	-179.5	-61.3	-175.2	0.5	0	0	112.5	V1080	V1080-Q1082 PolarHBondContact O-N 2.97Å
1083	G	78.2	Confident	91	Very high	35 Å²	35	52.3 Å²	52.3	36%	0.361	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	143.6	-177.9	0	0	0	0	0	115.1	V1080	V1080-G1083 PolarHBondContact O-N 2.89Å
1084	K	86.1	Confident	90.9	Very high	179 Å²	179	51.2 Å²	51.2	78%	0.778	26%	0.259	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-59.9	144.4	167.8	-66.9	-177.6	-180	179.2	0	109.9	Q1086	K1084-Q1086 WeakPolarHBondContact O-CG 3.49Å; K1084-Q1086 PolarHBondContact O-NE2 3.43Å
1085	P	89.8	Confident	91	Very high	82 Å²	82	51.8 Å²	51.8	53%	0.532	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.1	139.3	176.8	24.7	-33.6	0	0	0	111.3	T1077 R1078	T1077-P1085 HydrophobicContact CG2-CB 3.82Å; R1078-P1085 CarbonylContact O-C 3.47Å; R1078-P1085 WeakPolarHBondContact O-CA 3.38Å
1086	Q	92.8	Very high	91.1	Very high	69 Å²	69	48.8 Å²	48.8	32%	0.322	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	110.1	-168.1	-79.1	164.6	70.2	0	0	111	R1078 K1084 R1088	R1078-Q1086 PolarHBondContact N-O 3.34Å; R1078-Q1086 PolarHBondContact O-N 2.97Å; K1084-Q1086 WeakPolarHBondContact O-CG 3.49Å; K1084-Q1086 PolarHBondContact O-NE2 3.43Å; Q1086-R1088 PolarHBondContact O-N 3.08Å
1087	Q	93.4	Very high	91.2	Very high	92 Å²	92	48.7 Å²	48.7	43%	0.43	24%	0.24	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	127.4	168.2	-167.9	-177.5	1.7	0	0	109.9	E1075 L1076	E1075-Q1087 PolarHBondContact OE2-NE2 3.18Å; L1076-Q1087 WeakPolarHBondContact O-CA 3.37Å
1088	R	95.3	Very high	91.3	Very high	35 Å²	35	46.5 Å²	46.5	13%	0.132	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	154.4	178.5	-62.9	-68.7	173.9	-102.1	3.9	109.6	E1075 L1076 Q1086 F1090 Y1099 C1100	E1075-R1088 WeakPolarHBondContact CA-O 3.49Å; L1076-R1088 PolarHBondContact N-O 3.3Å; L1076-R1088 PolarHBondContact O-N 3.33Å; Q1086-R1088 PolarHBondContact O-N 3.08Å; R1088-F1090 HydrophobicContact CB-CD2 4.03Å; R1088-F1090 HydrophobicContact CB-CE2 3.63Å; R1088-F1090 HydrophobicContact CB-CZ 4.32Å; R1088-F1090 HydrophobicContact CG-CE2 4.47Å; R1088-Y1099 HydrophobicContact CG-CD2 4.29Å; R1088-C1100 CarbonylContact C-O 3.48Å; R1088-C1100 WeakPolarHBondContact CA-O 3.49Å; R1088-C1100 WeakPolarHBondContact CB-O 3.35Å; R1088-C1100 WeakPolarHBondContact CD-O 3.24Å
1089	S	94.8	Very high	91.5	Very high	7 Å²	7	45.9 Å²	45.9	5%	0.049	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89	121.2	164.2	-61.6	0	0	0	0	107.9	G1074 Y1099 C1100 K1102	G1074-S1089 CarbonylContact O-C 3.56Å; G1074-S1089 WeakPolarHBondContact O-CA 3.33Å; S1089-Y1099 CarbonylContact O-C 3.47Å; S1089-Y1099 WeakPolarHBondContact O-CA 3.41Å; S1089-C1100 PolarHBondContact N-O 3.12Å; S1089-C1100 PolarHBondContact O-N 2.8Å; S1089-K1102 WeakPolarHBondContact OG-CE 3.48Å
1090	F	96.3	Very high	91.7	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	146.5	178.6	-77.8	-96.7	0	0	0	110.1	S1073 G1074 L1076 R1078 R1088 L1097 V1098 Y1099 L1156 W1167	S1073-F1090 CarbonylContact C-O 3.55Å; S1073-F1090 WeakPolarHBondContact CA-O 3.46Å; S1073-F1090 WeakPolarHBondContact CB-O 3.36Å; G1074-F1090 PolarHBondContact N-O 2.84Å; G1074-F1090 PolarHBondContact O-N 2.81Å; L1076-F1090 HydrophobicContact CB-CD2 3.66Å; L1076-F1090 HydrophobicContact CB-CE2 3.77Å; L1076-F1090 HydrophobicContact CD1-CB 4.43Å; L1076-F1090 HydrophobicContact CD1-CD2 4.01Å; L1076-F1090 HydrophobicContact CD1-CE2 4.47Å; L1076-F1090 HydrophobicContact CD1-CG 4.2Å; L1076-F1090 HydrophobicContact CG-CD2 4.11Å; R1078-F1090 HydrophobicContact CB-CE2 4.46Å; R1078-F1090 HydrophobicContact CB-CZ 4.1Å; R1088-F1090 HydrophobicContact CB-CD2 4.03Å; R1088-F1090 HydrophobicContact CB-CE2 3.63Å; R1088-F1090 HydrophobicContact CB-CZ 4.32Å; R1088-F1090 HydrophobicContact CG-CE2 4.47Å; F1090-L1097 HydrophobicContact CB-CD1 4.16Å; F1090-L1097 HydrophobicContact CD1-CD1 3.88Å; F1090-L1097 HydrophobicContact CD1-CD2 3.93Å; F1090-L1097 HydrophobicContact CD1-CG 3.87Å; F1090-L1097 HydrophobicContact CE1-CD2 4.24Å; F1090-L1097 HydrophobicContact CE1-CG 4.49Å; F1090-V1098 WeakPolarHBondContact CA-O 3.25Å; F1090-Y1099 HydrophobicContact CD1-CG 4.4Å; F1090-Y1099 HydrophobicContact CE1-CD1 4.03Å; F1090-Y1099 AromaticContact CE1-CG 3.93Å; F1090-Y1099 HydrophobicContact CE1-CG 3.93Å; F1090-Y1099 HydrophobicContact CZ-CG 4.29Å; F1090-L1156 HydrophobicContact CE1-CD1 4.26Å; F1090-L1156 HydrophobicContact CE1-CD2 3.87Å; F1090-L1156 HydrophobicContact CE2-CD2 3.89Å; F1090-L1156 HydrophobicContact CZ-CD1 4.46Å; F1090-L1156 HydrophobicContact CZ-CD2 3.34Å; F1090-W1167 HydrophobicContact CB-CH2 3.5Å; F1090-W1167 HydrophobicContact CB-CZ2 3.98Å; F1090-W1167 HydrophobicContact CB-CZ3 4.33Å
1091	F	96.8	Very high	92	Very high	12 Å²	12	47.6 Å²	47.6	5%	0.053	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	102.5	-178.1	-59.6	-92.9	0	0	0	107.3	W1051 L1070 S1073 F1093 V1098 C1100 L1110	W1051-F1091 HydrophobicContact CH2-CB 4.09Å; W1051-F1091 HydrophobicContact CH2-CD2 4.3Å; W1051-F1091 HydrophobicContact CH2-CG 4.09Å; W1051-F1091 HydrophobicContact CZ2-CB 3.92Å; W1051-F1091 AromaticContact CZ2-CD1 3.64Å; W1051-F1091 HydrophobicContact CZ2-CD1 3.64Å; W1051-F1091 AromaticContact CZ2-CD2 3.58Å; W1051-F1091 HydrophobicContact CZ2-CD2 3.58Å; W1051-F1091 HydrophobicContact CZ2-CE1 4.01Å; W1051-F1091 AromaticContact CZ2-CE2 3.94Å; W1051-F1091 HydrophobicContact CZ2-CE2 3.94Å; W1051-F1091 AromaticContact CZ2-CG 3.42Å; W1051-F1091 HydrophobicContact CZ2-CG 3.42Å; W1051-F1091 VanDerWaalsContact CZ2-CG 3.42Å; W1051-F1091 HydrophobicContact CZ2-CZ 4.15Å; W1051-F1091 AromaticContact NE1-CE1 3.73Å; L1070-F1091 HydrophobicContact CD1-CB 3.8Å; L1070-F1091 HydrophobicContact CD1-CD1 4.28Å; L1070-F1091 HydrophobicContact CD2-CD1 4.46Å; S1073-F1091 VanDerWaalsContact CB-CD1 3.49Å; F1091-F1093 HydrophobicContact CB-CD2 4.47Å; F1091-F1093 HydrophobicContact CB-CE2 3.66Å; F1091-F1093 HydrophobicContact CB-CZ 4.12Å; F1091-F1093 WeakPolarHBondContact O-CD2 3.41Å; F1091-V1098 PolarHBondContact N-O 3.47Å; F1091-V1098 PolarHBondContact O-N 2.71Å; F1091-C1100 HydrophobicContact CE2-CB 4.23Å; F1091-L1110 HydrophobicContact CE2-CD1 4.03Å; F1091-L1110 HydrophobicContact CZ-CD1 3.61Å
1092	L	96.2	Very high	92.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	112.8	178.1	179	62.5	0	0	0	108.5	L1070 I1071 H1072 L1097 M1118 W1167 A1170 F1171 E1174	L1070-L1092 WeakPolarHBondContact CD1-O 3.26Å; I1071-L1092 HydrophobicContact CB-CG 4.5Å; I1071-L1092 HydrophobicContact CG2-CD2 4.43Å; I1071-L1092 PolarHBondContact N-O 2.96Å; H1072-L1092 HydrophobicContact CB-CB 4.46Å; H1072-L1092 PolarHBondContact N-O 3.2Å; H1072-L1092 VanDerWaalsContact N-O 3.17Å; H1072-L1092 PolarHBondContact O-N 2.97Å; L1092-L1097 HydrophobicContact CB-CD1 3.9Å; L1092-L1097 HydrophobicContact CD1-CB 4.22Å; L1092-L1097 HydrophobicContact CD1-CD1 4.19Å; L1092-M1118 HydrophobicContact CD1-CG 3.81Å; L1092-M1118 HydrophobicContact CD1-SD 4.1Å; L1092-W1167 HydrophobicContact CB-CZ3 4.08Å; L1092-A1170 HydrophobicContact CD2-CB 3.99Å; L1092-A1170 WeakPolarHBondContact CD2-O 3.32Å; L1092-F1171 HydrophobicContact CD1-CD1 3.96Å; L1092-F1171 HydrophobicContact CD1-CE1 3.86Å; L1092-F1171 HydrophobicContact CD2-CD1 3.67Å; L1092-F1171 HydrophobicContact CD2-CE1 4Å; L1092-F1171 HydrophobicContact CD2-CG 4.32Å; L1092-F1171 HydrophobicContact CG-CD1 4.48Å; L1092-F1171 HydrophobicContact CG-CE1 4.5Å; L1092-E1174 HydrophobicContact CD1-CB 4.44Å; L1092-E1174 HydrophobicContact CD1-CG 3.96Å; L1092-E1174 HydrophobicContact CD2-CB 3.99Å; L1092-E1174 HydrophobicContact CD2-CG 4.36Å; L1092-E1174 HydrophobicContact CG-CB 4.3Å; L1092-E1174 HydrophobicContact CG-CG 4.13Å
1093	F	95.2	Very high	93.5	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	168.3	167.3	-55.9	-91.4	0	0	0	109.4	I1048 W1051 V1063 D1069 L1070 F1091 H1095 Q1096 V1098 E1174 I1233	I1048-F1093 HydrophobicContact CD1-CD1 4.12Å; I1048-F1093 HydrophobicContact CD1-CE1 4.14Å; I1048-F1093 HydrophobicContact CG1-CE1 4.03Å; I1048-F1093 HydrophobicContact CG2-CE1 4.27Å; W1051-F1093 AromaticContact CE3-CZ 3.9Å; W1051-F1093 HydrophobicContact CE3-CZ 3.9Å; W1051-F1093 AromaticContact CH2-CE2 3.67Å; W1051-F1093 HydrophobicContact CH2-CE2 3.67Å; W1051-F1093 AromaticContact CH2-CZ 3.59Å; W1051-F1093 HydrophobicContact CH2-CZ 3.59Å; W1051-F1093 HydrophobicContact CZ2-CZ 4.26Å; W1051-F1093 HydrophobicContact CZ3-CE1 4.48Å; W1051-F1093 AromaticContact CZ3-CE2 3.78Å; W1051-F1093 HydrophobicContact CZ3-CE2 3.78Å; W1051-F1093 AromaticContact CZ3-CZ 3.39Å; W1051-F1093 HydrophobicContact CZ3-CZ 3.39Å; V1063-F1093 HydrophobicContact CG1-CD1 3.95Å; V1063-F1093 HydrophobicContact CG1-CD2 4.28Å; V1063-F1093 HydrophobicContact CG1-CE1 4.02Å; V1063-F1093 HydrophobicContact CG1-CE2 4.34Å; V1063-F1093 HydrophobicContact CG1-CG 4.09Å; V1063-F1093 HydrophobicContact CG1-CZ 4.22Å; D1069-F1093 VanDerWaalsContact O-CA 3.25Å; D1069-F1093 WeakPolarHBondContact O-CA 3.35Å; D1069-F1093 WeakPolarHBondContact O-CB 3.34Å; D1069-F1093 WeakPolarHBondContact O-CD1 3.38Å; L1070-F1093 HydrophobicContact CB-CD1 4.06Å; L1070-F1093 HydrophobicContact CB-CE1 3.85Å; L1070-F1093 HydrophobicContact CD1-CD1 3.92Å; L1070-F1093 HydrophobicContact CD1-CD2 4.3Å; L1070-F1093 HydrophobicContact CD1-CE1 3.57Å; L1070-F1093 HydrophobicContact CD1-CE2 3.99Å; L1070-F1093 HydrophobicContact CD1-CG 4.26Å; L1070-F1093 HydrophobicContact CD1-CZ 3.61Å; L1070-F1093 HydrophobicContact CG-CE1 4.3Å; F1091-F1093 HydrophobicContact CB-CD2 4.47Å; F1091-F1093 HydrophobicContact CB-CE2 3.66Å; F1091-F1093 HydrophobicContact CB-CZ 4.12Å; F1091-F1093 WeakPolarHBondContact O-CD2 3.41Å; F1093-H1095 PolarHBondContact O-N 2.94Å; F1093-Q1096 HydrophobicContact CB-CG 4.37Å; F1093-Q1096 WeakPolarHBondContact CB-O 3.29Å; F1093-Q1096 HydrophobicContact CD2-CG 4.49Å; F1093-Q1096 PolarHBondContact N-O 3.46Å; F1093-Q1096 PolarHBondContact O-N 3.14Å; F1093-V1098 HydrophobicContact CD2-CG2 4.08Å; F1093-V1098 HydrophobicContact CE2-CB 4.14Å; F1093-V1098 HydrophobicContact CE2-CG2 3.93Å; F1093-E1174 WeakPolarHBondContact O-CG 3.39Å; F1093-I1233 HydrophobicContact CE1-CD1 4.33Å; F1093-I1233 HydrophobicContact CZ-CD1 4.22Å
1094	D	91.9	Very high	94	Very high	4 Å²	4	41.4 Å²	41.4	2%	0.021	20%	0.203	C	C	.	.	S	Bend	trans	-51.7	130.9	158	48.8	-29	0	0	0	110.4	R1041 S1067 S1068 D1069 I1071 Q1096 V1178	R1041-D1094 IonicContact CZ-OD2 3.18Å; R1041-D1094 IonicContact NH1-OD2 2.71Å; R1041-D1094 PolarHBondContact NH1-OD2 3.1Å; S1067-D1094 WeakPolarHBondContact CA-OD1 3.39Å; S1067-D1094 WeakPolarHBondContact CB-O 3.29Å; S1067-D1094 VanDerWaalsContact CB-OD1 3.26Å; S1067-D1094 WeakPolarHBondContact CB-OD1 3.43Å; S1067-D1094 PolarHBondContact OG-O 3.32Å; S1068-D1094 VanDerWaalsContact N-CG 3.27Å; S1068-D1094 PolarHBondContact N-OD1 3.48Å; S1068-D1094 PolarHBondContact N-OD2 3.14Å; S1068-D1094 PolarHBondContact OG-OD2 3.22Å; D1069-D1094 PolarHBondContact N-OD1 3.31Å; D1069-D1094 PolarHBondContact O-N 2.72Å; D1069-D1094 VanDerWaalsContact O-OD1 3.11Å; I1071-D1094 HydrophobicContact CD1-CB 4.28Å; D1094-Q1096 PolarHBondContact O-N 3.2Å; D1094-V1178 HydrophobicContact CB-CG2 4.28Å
1095	H	94.2	Very high	94.2	Very high	36 Å²	36	40.5 Å²	40.5	17%	0.167	21%	0.205	C	C	.	.	S	Bend	trans	67.1	-17.9	-178.7	-55.1	-83.5	0	0	0	117.5	R1066 F1093 M1118 D1119 E1174 V1178	R1066-H1095 HydrophobicContact CB-CB 4.48Å; R1066-H1095 PolarHBondContact O-CD2 3.44Å; F1093-H1095 PolarHBondContact O-N 2.94Å; H1095-M1118 PolarHBondContact O-N 3.41Å; H1095-D1119 IonicContact CE1-OD1 3.39Å; H1095-D1119 IonicContact CE1-OD2 2.74Å; H1095-D1119 IonicContact CG-OD2 3.21Å; H1095-D1119 VanDerWaalsContact ND1-CG 3.33Å; H1095-D1119 IonicContact ND1-OD1 3.6Å; H1095-D1119 PolarHBondContact ND1-OD1 3.04Å; H1095-D1119 VanDerWaalsContact ND1-OD1 3.12Å; H1095-D1119 IonicContact ND1-OD2 3.48Å; H1095-D1119 PolarHBondContact ND1-OD2 3.15Å; H1095-E1174 PolarHBondContact N-OE1 2.9Å; H1095-V1178 WeakPolarHBondContact CE1-CG1 3.26Å
1096	Q	95.4	Very high	94.1	Very high	11 Å²	11	41.6 Å²	41.6	5%	0.051	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	142.1	-178.2	73.6	-168.2	-59.2	0	0	115.9	V1063 S1067 F1093 D1094 V1098 L1116	V1063-Q1096 PolarHBondContact O-NE2 3.27Å; S1067-Q1096 WeakPolarHBondContact OG-CG 3.45Å; S1067-Q1096 PolarHBondContact OG-NE2 2.87Å; F1093-Q1096 HydrophobicContact CB-CG 4.37Å; F1093-Q1096 WeakPolarHBondContact CB-O 3.29Å; F1093-Q1096 HydrophobicContact CD2-CG 4.49Å; F1093-Q1096 PolarHBondContact N-O 3.46Å; F1093-Q1096 PolarHBondContact O-N 3.14Å; D1094-Q1096 PolarHBondContact O-N 3.2Å; Q1096-V1098 HydrophobicContact CG-CG2 4.32Å; Q1096-L1116 WeakPolarHBondContact CA-O 3.32Å
1097	L	96.7	Very high	93.7	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	102	176.1	176.6	65.6	0	0	0	110.6	F1090 L1092 R1115 L1116 M1118 L1144 L1156 W1167 F1171	F1090-L1097 HydrophobicContact CB-CD1 4.16Å; F1090-L1097 HydrophobicContact CD1-CD1 3.88Å; F1090-L1097 HydrophobicContact CD1-CD2 3.93Å; F1090-L1097 HydrophobicContact CD1-CG 3.87Å; F1090-L1097 HydrophobicContact CE1-CD2 4.24Å; F1090-L1097 HydrophobicContact CE1-CG 4.49Å; L1092-L1097 HydrophobicContact CB-CD1 3.9Å; L1092-L1097 HydrophobicContact CD1-CB 4.22Å; L1092-L1097 HydrophobicContact CD1-CD1 4.19Å; L1097-R1115 CarbonylContact O-C 3.59Å; L1097-R1115 WeakPolarHBondContact O-CA 3.49Å; L1097-L1116 HydrophobicContact CB-CB 4.34Å; L1097-L1116 HydrophobicContact CD2-CD1 4.36Å; L1097-L1116 PolarHBondContact N-O 2.92Å; L1097-L1116 PolarHBondContact O-N 2.68Å; L1097-M1118 HydrophobicContact CB-CG 4.08Å; L1097-M1118 HydrophobicContact CB-SD 3.65Å; L1097-M1118 HydrophobicContact CD2-SD 4.29Å; L1097-L1144 HydrophobicContact CD2-CD1 3.97Å; L1097-L1156 HydrophobicContact CD2-CD1 4.43Å; L1097-W1167 HydrophobicContact CD1-CZ3 4.13Å; L1097-F1171 HydrophobicContact CD2-CE1 4.04Å; L1097-F1171 HydrophobicContact CD2-CZ 4.04Å
1098	V	96.8	Very high	93.3	Very high	0 Å²	0	45 Å²	45	0%	0	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	141.9	178.5	-178	0	0	0	0	110.3	W1051 W1058 F1090 F1091 F1093 Q1096 Y1112 R1115	W1051-V1098 HydrophobicContact CH2-CB 4.19Å; W1051-V1098 HydrophobicContact CH2-CG1 3.97Å; W1058-V1098 HydrophobicContact CH2-CG1 4.07Å; W1058-V1098 HydrophobicContact CH2-CG2 4.23Å; W1058-V1098 HydrophobicContact CZ3-CG1 4.04Å; F1090-V1098 WeakPolarHBondContact CA-O 3.25Å; F1091-V1098 PolarHBondContact N-O 3.47Å; F1091-V1098 PolarHBondContact O-N 2.71Å; F1093-V1098 HydrophobicContact CD2-CG2 4.08Å; F1093-V1098 HydrophobicContact CE2-CB 4.14Å; F1093-V1098 HydrophobicContact CE2-CG2 3.93Å; Q1096-V1098 HydrophobicContact CG-CG2 4.32Å; V1098-Y1112 HydrophobicContact CG1-CD2 4.03Å; V1098-Y1112 HydrophobicContact CG1-CE2 3.97Å; V1098-R1115 HydrophobicContact CG2-CB 4.16Å
1099	Y	96.2	Very high	93.1	Very high	25 Å²	25	44.1 Å²	44.1	10%	0.098	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	137.3	176.6	63	-90.5	0	0	0	114.4	R1078 R1088 S1089 F1090 R1113 G1114 L1116	R1078-Y1099 PolarHBondContact NH1-OH 2.94Å; R1088-Y1099 HydrophobicContact CG-CD2 4.29Å; S1089-Y1099 CarbonylContact O-C 3.47Å; S1089-Y1099 WeakPolarHBondContact O-CA 3.41Å; F1090-Y1099 HydrophobicContact CD1-CG 4.4Å; F1090-Y1099 HydrophobicContact CE1-CD1 4.03Å; F1090-Y1099 AromaticContact CE1-CG 3.93Å; F1090-Y1099 HydrophobicContact CE1-CG 3.93Å; F1090-Y1099 HydrophobicContact CZ-CG 4.29Å; Y1099-R1113 HydrophobicContact CD2-CB 3.77Å; Y1099-R1113 VanDerWaalsContact CE2-C 3.43Å; Y1099-R1113 HydrophobicContact CE2-CB 3.67Å; Y1099-R1113 WeakPolarHBondContact CE2-O 3.33Å; Y1099-R1113 VanDerWaalsContact CZ-O 3.26Å; Y1099-R1113 PolarHBondContact O-N 2.96Å; Y1099-R1113 PolarHBondContact OH-O 3.36Å; Y1099-R1113 VanDerWaalsContact OH-O 3.04Å; Y1099-G1114 WeakPolarHBondContact CD1-O 3.04Å; Y1099-G1114 VanDerWaalsContact CE1-C 3.49Å; Y1099-G1114 PolarHBondContact N-O 3.36Å; Y1099-L1116 HydrophobicContact CE1-CG 4.26Å
1100	C	95.9	Very high	93.1	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	154.7	-171.9	-61.5	0	0	0	0	112	R1088 S1089 F1091 L1110 H1111	R1088-C1100 CarbonylContact C-O 3.48Å; R1088-C1100 WeakPolarHBondContact CA-O 3.49Å; R1088-C1100 WeakPolarHBondContact CB-O 3.35Å; R1088-C1100 WeakPolarHBondContact CD-O 3.24Å; S1089-C1100 PolarHBondContact N-O 3.12Å; S1089-C1100 PolarHBondContact O-N 2.8Å; F1091-C1100 HydrophobicContact CE2-CB 4.23Å; C1100-L1110 HydrophobicContact CB-CB 4.11Å; C1100-L1110 HydrophobicContact CB-CD2 4.14Å; C1100-H1111 CarbonylContact C-O 3.6Å; C1100-H1111 WeakPolarHBondContact CA-O 3.26Å; C1100-H1111 WeakPolarHBondContact CB-O 3.25Å
1101	K	95.6	Very high	93	Very high	83 Å²	83	45.4 Å²	45.4	36%	0.361	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	122.6	166.5	-177.5	-167.7	171.3	-166	0	108.7	H1111 R1113	K1101-H1111 PolarHBondContact N-O 3.49Å; K1101-H1111 PolarHBondContact O-N 2.94Å; K1101-R1113 HydrophobicContact CB-CG 3.8Å
1102	K	93.7	Very high	93.1	Very high	80 Å²	80	45.6 Å²	45.6	35%	0.348	21%	0.21	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	141.6	167.8	-77.1	179.1	172.6	175.9	0	110.7	E1075 S1089 L1109 L1110	E1075-K1102 WeakPolarHBondContact OE1-CE 3.44Å; E1075-K1102 IonicContact OE1-NZ 3.31Å; E1075-K1102 PolarHBondContact OE1-NZ 3.14Å; S1089-K1102 WeakPolarHBondContact OG-CE 3.48Å; K1102-L1109 WeakPolarHBondContact CA-O 3.31Å; K1102-L1110 HydrophobicContact CG-CD2 3.59Å
1103	D	92	Very high	93	Very high	41 Å²	41	51.1 Å²	51.1	22%	0.219	23%	0.231	C	C	.	.	P	Polyproline II helix	trans	-64.6	153.7	172.4	-177.2	-111.3	0	0	0	111.9	L1105 R1106 L1109 H1111	D1103-L1105 WeakPolarHBondContact OD1-CA 3.21Å; D1103-L1105 PolarHBondContact OD1-N 2.92Å; D1103-R1106 HydrophobicContact CB-CB 4.43Å; D1103-R1106 WeakPolarHBondContact CB-O 3.47Å; D1103-R1106 PolarHBondContact OD1-N 3.48Å; D1103-L1109 HydrophobicContact CB-CB 3.98Å; D1103-L1109 HydrophobicContact CB-CD2 4.07Å; D1103-L1109 HydrophobicContact CB-CG 4.39Å; D1103-L1109 PolarHBondContact N-O 2.9Å; D1103-H1111 IonicContact OD2-CE1 2.6Å
1104	V	89.5	Confident	93	Very high	114 Å²	114	51.7 Å²	51.7	69%	0.691	24%	0.237	S	C	*	.	S	Bend	trans	-73.8	-33.9	-176.8	-176.9	0	0	0	0	111.7
1105	L	89.2	Confident	93.2	Very high	159 Å²	159	54 Å²	54	83%	0.832	25%	0.246	S	C	*	.	S	Bend	trans	-98.3	-39.5	-178.4	-57.7	177.8	0	0	0	111.4	D1103	D1103-L1105 WeakPolarHBondContact OD1-CA 3.21Å; D1103-L1105 PolarHBondContact OD1-N 2.92Å
1106	R	89.2	Confident	93.2	Very high	105 Å²	105	53.2 Å²	53.2	40%	0.396	24%	0.242	S	C	.	.			trans	-114.1	88.8	-175.1	-58.8	-152.4	-58.3	163.6	8.7	111.3	D1103 D1108 L1109 Q1228	D1103-R1106 HydrophobicContact CB-CB 4.43Å; D1103-R1106 WeakPolarHBondContact CB-O 3.47Å; D1103-R1106 PolarHBondContact OD1-N 3.48Å; R1106-D1108 VanDerWaalsContact C-OD1 3.24Å; R1106-D1108 WeakPolarHBondContact CA-OD1 3.43Å; R1106-D1108 WeakPolarHBondContact CB-OD1 3.39Å; R1106-D1108 PolarHBondContact O-N 2.82Å; R1106-D1108 VanDerWaalsContact O-N 3.07Å; R1106-L1109 HydrophobicContact CB-CB 3.87Å; R1106-L1109 HydrophobicContact CB-CD2 4.48Å; R1106-L1109 VanDerWaalsContact O-CB 3.29Å; R1106-L1109 WeakPolarHBondContact O-CB 3.35Å; R1106-L1109 PolarHBondContact O-N 3.26Å; R1106-Q1228 VanDerWaalsContact CZ-NE2 3.3Å; R1106-Q1228 VanDerWaalsContact NH1-CD 3.26Å
1107	R	84.1	Confident	93.2	Very high	202 Å²	202	54.6 Å²	54.6	76%	0.762	25%	0.25	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-16.5	-174.7	-61.2	-171.5	-174.4	105.1	1.5	114.6
1108	D	83.8	Confident	93.1	Very high	31 Å²	31	54.7 Å²	54.7	17%	0.166	25%	0.25	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.3	-23.5	169.7	58.1	-63.5	0	0	0	113.2	R1106 Q1228 I1231	R1106-D1108 VanDerWaalsContact C-OD1 3.24Å; R1106-D1108 WeakPolarHBondContact CA-OD1 3.43Å; R1106-D1108 WeakPolarHBondContact CB-OD1 3.39Å; R1106-D1108 PolarHBondContact O-N 2.82Å; R1106-D1108 VanDerWaalsContact O-N 3.07Å; D1108-Q1228 PolarHBondContact OD2-NE2 2.85Å; D1108-I1231 VanDerWaalsContact O-CB 3.24Å; D1108-I1231 WeakPolarHBondContact O-CB 3.4Å; D1108-I1231 VanDerWaalsContact O-CD1 3.27Å; D1108-I1231 WeakPolarHBondContact O-CD1 3.17Å; D1108-I1231 WeakPolarHBondContact O-CG1 3.27Å
1109	L	91.4	Very high	93	Very high	16 Å²	16	57.7 Å²	57.7	8%	0.084	27%	0.267	C	S	.	.			trans	-89.7	127.4	-176.2	-169.9	69.1	0	0	0	111.2	L1056 K1102 D1103 R1106	L1056-L1109 HydrophobicContact CD1-CD1 3.85Å; L1056-L1109 HydrophobicContact CD1-CD2 3.71Å; L1056-L1109 HydrophobicContact CD1-CG 3.91Å; L1056-L1109 HydrophobicContact CD2-CD1 4.45Å; L1056-L1109 HydrophobicContact CG-CD1 3.91Å; L1056-L1109 HydrophobicContact CG-CG 4.3Å; K1102-L1109 WeakPolarHBondContact CA-O 3.31Å; D1103-L1109 HydrophobicContact CB-CB 3.98Å; D1103-L1109 HydrophobicContact CB-CD2 4.07Å; D1103-L1109 HydrophobicContact CB-CG 4.39Å; D1103-L1109 PolarHBondContact N-O 2.9Å; R1106-L1109 HydrophobicContact CB-CB 3.87Å; R1106-L1109 HydrophobicContact CB-CD2 4.48Å; R1106-L1109 VanDerWaalsContact O-CB 3.29Å; R1106-L1109 WeakPolarHBondContact O-CB 3.35Å; R1106-L1109 PolarHBondContact O-N 3.26Å
1110	L	94.2	Very high	92.9	Very high	3 Å²	3	61.9 Å²	61.9	2%	0.016	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	130.7	-178.4	-64.4	175.4	0	0	0	110.6	I1055 L1056 F1091 C1100 K1102 I1231	I1055-L1110 HydrophobicContact CG1-CB 4.08Å; L1056-L1110 PolarHBondContact N-O 2.86Å; F1091-L1110 HydrophobicContact CE2-CD1 4.03Å; F1091-L1110 HydrophobicContact CZ-CD1 3.61Å; C1100-L1110 HydrophobicContact CB-CB 4.11Å; C1100-L1110 HydrophobicContact CB-CD2 4.14Å; K1102-L1110 HydrophobicContact CG-CD2 3.59Å; L1110-I1231 HydrophobicContact CD1-CB 4.42Å; L1110-I1231 HydrophobicContact CD1-CG2 3.91Å
1111	H	95.9	Very high	92.8	Very high	32 Å²	32	62.4 Å²	62.4	15%	0.148	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	129	167.3	-60.6	63.8	0	0	0	108.5	L1056 H1057 C1100 K1101 D1103	L1056-H1111 WeakPolarHBondContact O-CA 3.32Å; H1057-H1111 AromaticContact CD2-CD2 3.45Å; H1057-H1111 PolarHBondContact CD2-CD2 3.48Å; H1057-H1111 VanDerWaalsContact CD2-CD2 3.45Å; H1057-H1111 AromaticContact NE2-CD2 3.65Å; C1100-H1111 CarbonylContact C-O 3.6Å; C1100-H1111 WeakPolarHBondContact CA-O 3.26Å; C1100-H1111 WeakPolarHBondContact CB-O 3.25Å; K1101-H1111 PolarHBondContact N-O 3.49Å; K1101-H1111 PolarHBondContact O-N 2.94Å; D1103-H1111 IonicContact OD2-CE1 2.6Å
1112	Y	97.3	Very high	92.7	Very high	15 Å²	15	61.9 Å²	61.9	6%	0.059	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	150.4	171.8	179.6	-96.9	0	0	0	111.2	L1056 H1057 W1058 E1059 V1098 G1114 R1115	L1056-Y1112 PolarHBondContact O-N 2.89Å; H1057-Y1112 WeakPolarHBondContact O-CB 3.2Å; W1058-Y1112 HydrophobicContact CD2-CD2 4.34Å; W1058-Y1112 AromaticContact CE3-CD2 3.74Å; W1058-Y1112 HydrophobicContact CE3-CD2 3.74Å; W1058-Y1112 HydrophobicContact CE3-CE2 4.3Å; W1058-Y1112 HydrophobicContact CE3-CG 4.42Å; W1058-Y1112 HydrophobicContact CH2-CD2 4.31Å; W1058-Y1112 HydrophobicContact CH2-CE2 4.18Å; W1058-Y1112 AromaticContact CZ3-CD2 3.73Å; W1058-Y1112 HydrophobicContact CZ3-CD2 3.73Å; W1058-Y1112 HydrophobicContact CZ3-CE2 4.08Å; E1059-Y1112 HydrophobicContact CB-CD1 4.01Å; E1059-Y1112 HydrophobicContact CB-CE1 3.66Å; E1059-Y1112 HydrophobicContact CG-CD1 4.25Å; E1059-Y1112 HydrophobicContact CG-CE1 4.34Å; E1059-Y1112 PolarHBondContact O-OH 3.16Å; V1098-Y1112 HydrophobicContact CG1-CD2 4.03Å; V1098-Y1112 HydrophobicContact CG1-CE2 3.97Å; Y1112-G1114 VanDerWaalsContact CE1-N 3.26Å; Y1112-G1114 WeakPolarHBondContact OH-CA 3.45Å; Y1112-R1115 PolarHBondContact OH-N 3.49Å; Y1112-R1115 PolarHBondContact OH-NE 3.37Å; Y1112-R1115 VanDerWaalsContact OH-NE 3.1Å
1113	R	95.4	Very high	92.8	Very high	117 Å²	117	60 Å²	60	44%	0.442	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	4.7	175.6	-67.8	-65.3	153	-176.2	-6.2	114.5	Y1099 K1101	Y1099-R1113 HydrophobicContact CD2-CB 3.77Å; Y1099-R1113 VanDerWaalsContact CE2-C 3.43Å; Y1099-R1113 HydrophobicContact CE2-CB 3.67Å; Y1099-R1113 WeakPolarHBondContact CE2-O 3.33Å; Y1099-R1113 VanDerWaalsContact CZ-O 3.26Å; Y1099-R1113 PolarHBondContact O-N 2.96Å; Y1099-R1113 PolarHBondContact OH-O 3.36Å; Y1099-R1113 VanDerWaalsContact OH-O 3.04Å; K1101-R1113 HydrophobicContact CB-CG 3.8Å
1114	G	94.9	Very high	92.9	Very high	11 Å²	11	59.7 Å²	59.7	11%	0.113	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	131.7	173.2	-178.2	0	0	0	0	0	112.8	Y1099 Y1112	Y1099-G1114 WeakPolarHBondContact CD1-O 3.04Å; Y1099-G1114 VanDerWaalsContact CE1-C 3.49Å; Y1099-G1114 PolarHBondContact N-O 3.36Å; Y1112-G1114 VanDerWaalsContact CE1-N 3.26Å; Y1112-G1114 WeakPolarHBondContact OH-CA 3.45Å
1115	R	95.1	Very high	93.2	Very high	54 Å²	54	58.6 Å²	58.6	20%	0.204	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	168.4	171.9	67.4	-173	76.3	-167.7	15	109.2	W1058 E1059 G1060 P1061 L1097 V1098 Y1112	W1058-R1115 VanDerWaalsContact CZ2-NH2 3.32Å; E1059-R1115 PolarHBondContact O-NH2 3.49Å; G1060-R1115 VanDerWaalsContact C-NH2 3.32Å; P1061-R1115 PolarHBondContact O-NH1 2.88Å; P1061-R1115 VanDerWaalsContact O-NH1 3.08Å; P1061-R1115 PolarHBondContact O-NH2 3Å; L1097-R1115 CarbonylContact O-C 3.59Å; L1097-R1115 WeakPolarHBondContact O-CA 3.49Å; V1098-R1115 HydrophobicContact CG2-CB 4.16Å; Y1112-R1115 PolarHBondContact OH-N 3.49Å; Y1112-R1115 PolarHBondContact OH-NE 3.37Å; Y1112-R1115 VanDerWaalsContact OH-NE 3.1Å
1116	L	94.8	Very high	93.3	Very high	19 Å²	19	52.2 Å²	52.2	10%	0.099	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.1	141.4	171.6	-69.1	174.3	0	0	0	107.8	Q1096 L1097 Y1099 I1121 L1144 M1153	Q1096-L1116 WeakPolarHBondContact CA-O 3.32Å; L1097-L1116 HydrophobicContact CB-CB 4.34Å; L1097-L1116 HydrophobicContact CD2-CD1 4.36Å; L1097-L1116 PolarHBondContact N-O 2.92Å; L1097-L1116 PolarHBondContact O-N 2.68Å; Y1099-L1116 HydrophobicContact CE1-CG 4.26Å; L1116-I1121 HydrophobicContact CB-CD1 3.73Å; L1116-I1121 HydrophobicContact CD1-CD1 4.24Å; L1116-I1121 HydrophobicContact CD2-CD1 4.24Å; L1116-I1121 HydrophobicContact CG-CD1 4.29Å; L1116-L1144 HydrophobicContact CD1-CD1 3.7Å; L1116-M1153 HydrophobicContact CD2-SD 4.22Å
1117	D	94.8	Very high	93.3	Very high	40 Å²	40	51.1 Å²	51.1	21%	0.214	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	124.6	175.6	-162.1	-38.3	0	0	0	109.3	R1066 D1119 E1120 I1121	R1066-D1117 IonicContact CZ-OD1 2.93Å; R1066-D1117 IonicContact CZ-OD2 2.76Å; R1066-D1117 VanDerWaalsContact CZ-OD2 3.28Å; R1066-D1117 IonicContact NH1-OD1 3.32Å; R1066-D1117 IonicContact NH1-OD2 2.84Å; R1066-D1117 PolarHBondContact NH1-OD2 3.21Å; R1066-D1117 VanDerWaalsContact NH2-CG 3.26Å; R1066-D1117 IonicContact NH2-OD1 2.72Å; R1066-D1117 PolarHBondContact NH2-OD1 3.43Å; R1066-D1117 IonicContact NH2-OD2 3.86Å; R1066-D1117 PolarHBondContact NH2-OD2 2.86Å; D1117-D1119 WeakPolarHBondContact OD1-CB 3.18Å; D1117-D1119 PolarHBondContact OD1-N 2.95Å; D1117-E1120 HydrophobicContact CB-CB 4.39Å; D1117-E1120 HydrophobicContact CB-CG 4.46Å; D1117-I1121 WeakPolarHBondContact O-CB 3.37Å; D1117-I1121 WeakPolarHBondContact O-CD1 3.19Å; D1117-I1121 WeakPolarHBondContact O-CG1 3.48Å
1118	M	95.4	Very high	93.7	Very high	1 Å²	1	45.3 Å²	45.3	1%	0.005	24%	0.239	C	C	.	.	S	Bend	trans	-86.9	-14.3	179.6	-66.7	-55.9	-46.1	0	0	112.9	L1092 H1095 L1097 I1121 V1123 F1171 E1174 R1175	L1092-M1118 HydrophobicContact CD1-CG 3.81Å; L1092-M1118 HydrophobicContact CD1-SD 4.1Å; H1095-M1118 PolarHBondContact O-N 3.41Å; L1097-M1118 HydrophobicContact CB-CG 4.08Å; L1097-M1118 HydrophobicContact CB-SD 3.65Å; L1097-M1118 HydrophobicContact CD2-SD 4.29Å; M1118-I1121 HydrophobicContact CE-CB 4.5Å; M1118-I1121 HydrophobicContact CE-CG2 4.24Å; M1118-V1123 HydrophobicContact CE-CG2 4.07Å; M1118-F1171 HydrophobicContact CE-CD1 3.58Å; M1118-F1171 HydrophobicContact CE-CE1 3.75Å; M1118-F1171 HydrophobicContact SD-CD1 4.37Å; M1118-F1171 HydrophobicContact SD-CE1 4Å; M1118-E1174 WeakPolarHBondContact CB-OE1 3.42Å; M1118-R1175 VanDerWaalsContact O-CZ 3.26Å
1119	D	94.1	Very high	94	Very high	64 Å²	64	45.5 Å²	45.5	34%	0.342	25%	0.247	S	C	.	.	S	Bend	trans	-76	-28.5	174.5	-59.4	-41.2	0	0	0	111.6	R1066 H1095 D1117 R1175	R1066-D1119 IonicContact CZ-OD2 2.69Å; R1066-D1119 IonicContact NH2-OD2 3.18Å; R1066-D1119 PolarHBondContact NH2-OD2 2.87Å; H1095-D1119 IonicContact CE1-OD1 3.39Å; H1095-D1119 IonicContact CE1-OD2 2.74Å; H1095-D1119 IonicContact CG-OD2 3.21Å; H1095-D1119 VanDerWaalsContact ND1-CG 3.33Å; H1095-D1119 IonicContact ND1-OD1 3.6Å; H1095-D1119 PolarHBondContact ND1-OD1 3.04Å; H1095-D1119 VanDerWaalsContact ND1-OD1 3.12Å; H1095-D1119 IonicContact ND1-OD2 3.48Å; H1095-D1119 PolarHBondContact ND1-OD2 3.15Å; D1117-D1119 WeakPolarHBondContact OD1-CB 3.18Å; D1117-D1119 PolarHBondContact OD1-N 2.95Å; D1119-R1175 IonicContact OD1-CZ 3.97Å; D1119-R1175 VanDerWaalsContact OD1-CZ 3.23Å; D1119-R1175 IonicContact OD1-NH1 3.99Å; D1119-R1175 PolarHBondContact OD1-NH1 3.28Å; D1119-R1175 IonicContact OD1-NH2 3.96Å; D1119-R1175 PolarHBondContact OD1-NH2 3.49Å
1120	E	94.1	Very high	93.8	Very high	113 Å²	113	54.2 Å²	54.2	53%	0.528	28%	0.279	S	S	.	.	S	Bend	trans	-92.5	-4.9	175.3	-63.5	-168.6	-179.3	0	0	114.5	D1117 N1146 A1147	D1117-E1120 HydrophobicContact CB-CB 4.39Å; D1117-E1120 HydrophobicContact CB-CG 4.46Å; E1120-N1146 CarbonylContact O-C 3.4Å; E1120-N1146 VanDerWaalsContact O-CA 3.28Å; E1120-N1146 WeakPolarHBondContact O-CA 3.33Å; E1120-N1146 PolarHBondContact OE2-ND2 2.98Å; E1120-A1147 PolarHBondContact O-N 3.05Å
1121	I	94.7	Very high	93.4	Very high	11 Å²	11	54.5 Å²	54.5	6%	0.056	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	128.2	-169.8	-74.7	177.1	0	0	0	113.2	L1116 D1117 M1118 L1144 R1145 M1153	L1116-I1121 HydrophobicContact CB-CD1 3.73Å; L1116-I1121 HydrophobicContact CD1-CD1 4.24Å; L1116-I1121 HydrophobicContact CD2-CD1 4.24Å; L1116-I1121 HydrophobicContact CG-CD1 4.29Å; D1117-I1121 WeakPolarHBondContact O-CB 3.37Å; D1117-I1121 WeakPolarHBondContact O-CD1 3.19Å; D1117-I1121 WeakPolarHBondContact O-CG1 3.48Å; M1118-I1121 HydrophobicContact CE-CB 4.5Å; M1118-I1121 HydrophobicContact CE-CG2 4.24Å; I1121-L1144 HydrophobicContact CG2-CB 4.04Å; I1121-L1144 HydrophobicContact CG2-CD2 4Å; I1121-L1144 HydrophobicContact CG2-CG 4.43Å; I1121-R1145 WeakPolarHBondContact CA-O 3.28Å; I1121-M1153 HydrophobicContact CD1-CG 4.49Å; I1121-M1153 HydrophobicContact CD1-SD 3.85Å; I1121-M1153 HydrophobicContact CG1-SD 4.16Å
1122	E	94.3	Very high	92.6	Very high	71 Å²	71	58.6 Å²	58.6	33%	0.332	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	133.6	166	-165.4	-165.8	156.3	0	0	110.6	V1124 R1145 A1147	E1122-V1124 HydrophobicContact CG-CG2 4.27Å; E1122-R1145 HydrophobicContact CB-CG 4.05Å; E1122-R1145 PolarHBondContact N-O 3.23Å; E1122-R1145 PolarHBondContact O-N 3.14Å; E1122-R1145 VanDerWaalsContact O-N 3.11Å; E1122-R1145 IonicContact OE1-CZ 3.53Å; E1122-R1145 IonicContact OE1-NE 3.22Å; E1122-R1145 IonicContact OE1-NH2 2.67Å; E1122-R1145 PolarHBondContact OE1-NH2 3.08Å; E1122-R1145 IonicContact OE2-CZ 3.88Å; E1122-R1145 IonicContact OE2-NE 3.96Å; E1122-R1145 PolarHBondContact OE2-NE 2.53Å; E1122-R1145 IonicContact OE2-NH2 3.67Å; E1122-R1145 PolarHBondContact OE2-NH2 3Å; E1122-A1147 HydrophobicContact CB-CB 4.19Å
1123	V	95.6	Very high	91.7	Very high	40 Å²	40	61.1 Å²	61.1	24%	0.242	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	107.8	176.9	-172.4	0	0	0	0	109.3	M1118 L1142 L1144 L1168 F1171	M1118-V1123 HydrophobicContact CE-CG2 4.07Å; V1123-L1142 HydrophobicContact CG1-CD1 4.09Å; V1123-L1144 HydrophobicContact CB-CD2 4.29Å; V1123-L1144 HydrophobicContact CG1-CD2 4.09Å; V1123-L1144 HydrophobicContact CG2-CD2 3.77Å; V1123-L1168 HydrophobicContact CG1-CD2 4.08Å; V1123-F1171 HydrophobicContact CB-CB 4.46Å; V1123-F1171 HydrophobicContact CB-CD2 4.43Å; V1123-F1171 HydrophobicContact CB-CG 4.46Å; V1123-F1171 HydrophobicContact CG1-CB 4.47Å; V1123-F1171 HydrophobicContact CG1-CD2 3.7Å; V1123-F1171 HydrophobicContact CG1-CE2 4.15Å; V1123-F1171 HydrophobicContact CG1-CG 4.2Å; V1123-F1171 HydrophobicContact CG2-CB 3.96Å; V1123-F1171 HydrophobicContact CG2-CD1 3.95Å; V1123-F1171 HydrophobicContact CG2-CD2 4.04Å; V1123-F1171 HydrophobicContact CG2-CE1 4.42Å; V1123-F1171 HydrophobicContact CG2-CG 3.75Å
1124	V	94.2	Very high	90.9	Very high	36 Å²	36	57 Å²	57	22%	0.218	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	128.4	-178.8	-179.2	0	0	0	0	109.8	E1122 R1143 R1145	E1122-V1124 HydrophobicContact CG-CG2 4.27Å; V1124-R1143 HydrophobicContact CB-CB 4.25Å; V1124-R1143 PolarHBondContact N-O 3.18Å; V1124-R1143 PolarHBondContact O-N 3.02Å; V1124-R1145 HydrophobicContact CG2-CG 4.32Å
1125	D	94.1	Very high	90.3	Very high	90 Å²	90	59.1 Å²	59.1	48%	0.481	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	140.4	173.6	-167.4	24.5	0	0	0	111.8	K1164 L1168	D1125-K1164 VanDerWaalsContact CG-NZ 3.35Å; D1125-K1164 WeakPolarHBondContact OD1-CE 3.37Å; D1125-K1164 IonicContact OD1-NZ 2.77Å; D1125-K1164 PolarHBondContact OD1-NZ 2.69Å; D1125-K1164 IonicContact OD2-NZ 3.57Å; D1125-K1164 PolarHBondContact OD2-NZ 2.98Å; D1125-L1168 HydrophobicContact CB-CD1 4.38Å
1126	V	92.1	Very high	89.8	Confident	25 Å²	25	59.6 Å²	59.6	15%	0.152	34%	0.34	C	S	.	.			trans	-126.6	128.1	-179.8	177.4	0	0	0	0	111	A1141 R1143 M1155 K1164	V1126-A1141 VanDerWaalsContact O-O 3.05Å; V1126-R1143 HydrophobicContact CG2-CB 3.64Å; V1126-M1155 HydrophobicContact CB-CE 3.82Å; V1126-M1155 HydrophobicContact CG1-CE 4.05Å; V1126-M1155 HydrophobicContact CG2-CE 3.66Å; V1126-M1155 HydrophobicContact CG2-SD 4.42Å; V1126-K1164 PolarHBondContact O-NZ 2.83Å
1127	A	90.1	Very high	89.5	Confident	82 Å²	82	63.3 Å²	63.3	68%	0.678	36%	0.363	S	S	*	.			trans	-68.8	151	175.8	0	0	0	0	0	112.3	G1129	A1127-G1129 PolarHBondContact O-N 3.24Å
1128	D	92.1	Very high	89.2	Confident	81 Å²	81	61.8 Å²	61.8	43%	0.433	36%	0.355	S	S	.	.	S	Bend	trans	-62	126.4	173.9	-89.8	38.2	0	0	0	110.7	K1139 N1140	D1128-K1139 WeakPolarHBondContact OD1-CA 3.32Å; D1128-K1139 WeakPolarHBondContact OD2-CA 3.47Å; D1128-K1139 VanDerWaalsContact OD2-CB 3.31Å; D1128-K1139 WeakPolarHBondContact OD2-CB 3.44Å; D1128-K1139 WeakPolarHBondContact OD2-CD 3.46Å; D1128-K1139 WeakPolarHBondContact OD2-CG 3.42Å; D1128-N1140 PolarHBondContact OD1-N 3.15Å
1129	G	89.9	Confident	89	Confident	34 Å²	34	68 Å²	68	35%	0.351	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	173.7	-168.9	-173.5	0	0	0	0	0	113.8	A1127 T1137 L1138	A1127-G1129 PolarHBondContact O-N 3.24Å; G1129-T1137 CarbonylContact O-C 3.48Å; G1129-T1137 WeakPolarHBondContact O-CA 3.5Å; G1129-L1138 PolarHBondContact N-O 3.07Å; G1129-L1138 VanDerWaalsContact N-O 3.12Å; G1129-L1138 PolarHBondContact O-N 2.85Å
1130	R	87.1	Confident	88.9	Confident	200 Å²	200	66.3 Å²	66.3	76%	0.755	37%	0.373	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.5	117	168	-177	-179.9	-66.9	-173.6	-0.6	108.9	L1136	R1130-L1136 WeakPolarHBondContact CA-O 3.43Å
1131	D	85.4	Confident	88.9	Confident	9 Å²	9	60.9 Å²	60.9	5%	0.048	35%	0.348	C	S	.	.			trans	-78.6	125.6	173.7	177.8	-71.4	0	0	0	109.3	D1133 L1134 G1135 L1136 L1138 R1143	D1131-D1133 WeakPolarHBondContact OD1-CA 3.43Å; D1131-D1133 WeakPolarHBondContact OD1-CB 3.02Å; D1131-D1133 PolarHBondContact OD1-N 3.26Å; D1131-L1134 WeakPolarHBondContact OD1-CB 3.4Å; D1131-L1134 WeakPolarHBondContact OD1-CG 3.35Å; D1131-L1134 PolarHBondContact OD1-N 3.42Å; D1131-G1135 WeakPolarHBondContact O-CA 3.43Å; D1131-G1135 PolarHBondContact O-N 2.74Å; D1131-L1136 PolarHBondContact N-O 3.25Å; D1131-L1138 HydrophobicContact CB-CD1 3.5Å; D1131-L1138 HydrophobicContact CB-CG 3.76Å; D1131-R1143 IonicContact OD2-CZ 2.94Å; D1131-R1143 IonicContact OD2-NH2 2.6Å; D1131-R1143 PolarHBondContact OD2-NH2 2.87Å
1132	P	78.4	Confident	88.9	Confident	117 Å²	117	60.4 Å²	60.4	76%	0.76	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.7	-27.8	-176.8	31.3	-34.9	0	0	0	112.9	L1134	P1132-L1134 VanDerWaalsContact C-N 3.33Å
1133	D	78.4	Confident	88.9	Confident	69 Å²	69	59.9 Å²	59.9	37%	0.369	34%	0.34	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-30.7	-180	-67.2	-71.5	0	0	0	112.3	R1081 D1131 R1143	R1081-D1133 IonicContact NH1-OD1 3.85Å; R1081-D1133 PolarHBondContact NH1-OD1 3.27Å; D1131-D1133 WeakPolarHBondContact OD1-CA 3.43Å; D1131-D1133 WeakPolarHBondContact OD1-CB 3.02Å; D1131-D1133 PolarHBondContact OD1-N 3.26Å; D1133-R1143 IonicContact OD2-CZ 2.85Å; D1133-R1143 IonicContact OD2-NH1 3.9Å; D1133-R1143 IonicContact OD2-NH2 3.74Å; D1133-R1143 PolarHBondContact OD2-NH2 2.99Å
1134	L	80.3	Confident	88.8	Confident	30 Å²	30	58 Å²	58	16%	0.157	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-107.7	-17.5	-178.5	-61.2	-175.8	0	0	0	113.9	A1079 R1081 D1131 P1132 L1136 F1152 M1155	A1079-L1134 HydrophobicContact CB-CD1 4.03Å; R1081-L1134 HydrophobicContact CB-CD2 4.42Å; R1081-L1134 HydrophobicContact CG-CD2 4.28Å; D1131-L1134 WeakPolarHBondContact OD1-CB 3.4Å; D1131-L1134 WeakPolarHBondContact OD1-CG 3.35Å; D1131-L1134 PolarHBondContact OD1-N 3.42Å; P1132-L1134 VanDerWaalsContact C-N 3.33Å; L1134-L1136 HydrophobicContact CB-CB 4.17Å; L1134-L1136 HydrophobicContact CB-CD1 4.23Å; L1134-L1136 HydrophobicContact CB-CG 4.04Å; L1134-L1136 HydrophobicContact CD1-CD1 4.34Å; L1134-L1136 PolarHBondContact O-N 3.26Å; L1134-F1152 HydrophobicContact CD1-CZ 4.24Å; L1134-F1152 HydrophobicContact CD2-CE1 4.23Å; L1134-F1152 HydrophobicContact CD2-CZ 4.02Å; L1134-F1152 HydrophobicContact CG-CZ 4.42Å; L1134-M1155 HydrophobicContact CD1-CB 4.04Å; L1134-M1155 HydrophobicContact CD1-CG 3.48Å; L1134-M1155 VanDerWaalsContact CD1-CG 3.48Å
1135	G	81.5	Confident	88.8	Confident	56 Å²	56	59.7 Å²	59.7	58%	0.577	33%	0.331	S	S	*	.			trans	65.3	9.9	-170	0	0	0	0	0	114.3	D1131	D1131-G1135 WeakPolarHBondContact O-CA 3.43Å; D1131-G1135 PolarHBondContact O-N 2.74Å
1136	L	84.7	Confident	88.8	Confident	64 Å²	64	56.1 Å²	56.1	34%	0.335	31%	0.312	S	S	.	.			trans	-94.9	147.1	-176.1	-65.7	179.9	0	0	0	111.3	A1079 R1130 D1131 L1134 L1138	A1079-L1136 HydrophobicContact CB-CD1 3.99Å; R1130-L1136 WeakPolarHBondContact CA-O 3.43Å; D1131-L1136 PolarHBondContact N-O 3.25Å; L1134-L1136 HydrophobicContact CB-CB 4.17Å; L1134-L1136 HydrophobicContact CB-CD1 4.23Å; L1134-L1136 HydrophobicContact CB-CG 4.04Å; L1134-L1136 HydrophobicContact CD1-CD1 4.34Å; L1134-L1136 PolarHBondContact O-N 3.26Å; L1136-L1138 HydrophobicContact CB-CD2 3.76Å; L1136-L1138 HydrophobicContact CD1-CD2 4.49Å; L1136-L1138 PolarHBondContact O-N 3.22Å
1137	T	87.2	Confident	88.8	Confident	97 Å²	97	57.4 Å²	57.4	60%	0.595	33%	0.325	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.1	107.7	165.2	-53.6	0	0	0	0	108.1	G1129	G1129-T1137 CarbonylContact O-C 3.48Å; G1129-T1137 WeakPolarHBondContact O-CA 3.5Å
1138	L	89.2	Confident	88.9	Confident	7 Å²	7	58.4 Å²	58.4	4%	0.037	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	142.8	-178.4	-55.7	-170.6	0	0	0	110.3	G1129 D1131 L1136 A1141 M1155	G1129-L1138 PolarHBondContact N-O 3.07Å; G1129-L1138 VanDerWaalsContact N-O 3.12Å; G1129-L1138 PolarHBondContact O-N 2.85Å; D1131-L1138 HydrophobicContact CB-CD1 3.5Å; D1131-L1138 HydrophobicContact CB-CG 3.76Å; L1136-L1138 HydrophobicContact CB-CD2 3.76Å; L1136-L1138 HydrophobicContact CD1-CD2 4.49Å; L1136-L1138 PolarHBondContact O-N 3.22Å; L1138-A1141 HydrophobicContact CB-CB 3.91Å; L1138-A1141 HydrophobicContact CD1-CB 4.21Å; L1138-M1155 HydrophobicContact CD1-CB 4.46Å; L1138-M1155 HydrophobicContact CD1-CE 3.68Å; L1138-M1155 HydrophobicContact CD1-CG 3.8Å; L1138-M1155 HydrophobicContact CD1-SD 4.23Å
1139	K	90.8	Very high	88.9	Confident	131 Å²	131	58.7 Å²	58.7	57%	0.57	33%	0.332	S	S	*	.	S	Bend	trans	-139.6	140.9	172.2	-65.4	-154.4	170.3	-152.9	0	110.6	D1128 A1141	D1128-K1139 WeakPolarHBondContact OD1-CA 3.32Å; D1128-K1139 WeakPolarHBondContact OD2-CA 3.47Å; D1128-K1139 VanDerWaalsContact OD2-CB 3.31Å; D1128-K1139 WeakPolarHBondContact OD2-CB 3.44Å; D1128-K1139 WeakPolarHBondContact OD2-CD 3.46Å; D1128-K1139 WeakPolarHBondContact OD2-CG 3.42Å; K1139-A1141 PolarHBondContact O-N 2.99Å
1140	N	92.9	Very high	88.8	Confident	29 Å²	29	62 Å²	62	16%	0.155	34%	0.341	C	S	.	.	S	Bend	trans	46.4	47.1	-175.6	-51.2	-64	0	0	0	111.6	D1128 C1158 K1160 V1161 K1164	D1128-N1140 PolarHBondContact OD1-N 3.15Å; N1140-C1158 HydrophobicContact CB-CB 3.93Å; N1140-C1158 WeakPolarHBondContact O-CB 3.48Å; N1140-C1158 PolarHBondContact O-N 2.93Å; N1140-K1160 WeakPolarHBondContact CB-O 3.14Å; N1140-V1161 WeakPolarHBondContact OD1-CA 3.4Å; N1140-V1161 WeakPolarHBondContact OD1-CB 3.26Å; N1140-V1161 PolarHBondContact OD1-N 3.27Å; N1140-K1164 HydrophobicContact CB-CB 4.13Å; N1140-K1164 HydrophobicContact CB-CD 4.33Å
1141	A	93.6	Very high	89	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	155.1	-171.9	0	0	0	0	0	112.8	V1126 L1138 K1139 M1155 L1156 K1164	V1126-A1141 VanDerWaalsContact O-O 3.05Å; L1138-A1141 HydrophobicContact CB-CB 3.91Å; L1138-A1141 HydrophobicContact CD1-CB 4.21Å; K1139-A1141 PolarHBondContact O-N 2.99Å; A1141-M1155 HydrophobicContact CB-CE 3.74Å; A1141-L1156 CarbonylContact C-O 3.59Å; A1141-L1156 WeakPolarHBondContact CA-O 3.31Å; A1141-K1164 PolarHBondContact O-NZ 3.31Å
1142	L	95	Very high	89.1	Confident	0 Å²	0	58.6 Å²	58.6	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	148.2	171.5	60.2	90.7	0	0	0	109.5	V1123 L1144 M1155 L1156 W1167 L1168 F1171	V1123-L1142 HydrophobicContact CG1-CD1 4.09Å; L1142-L1144 HydrophobicContact CD1-CD2 4.1Å; L1142-M1155 VanDerWaalsContact C-CE 3.4Å; L1142-M1155 VanDerWaalsContact O-CE 3.24Å; L1142-M1155 WeakPolarHBondContact O-CE 3.49Å; L1142-L1156 HydrophobicContact CD1-CB 3.86Å; L1142-L1156 HydrophobicContact CD1-CD1 4.03Å; L1142-L1156 HydrophobicContact CD1-CG 4.29Å; L1142-L1156 HydrophobicContact CG-CB 4.2Å; L1142-L1156 PolarHBondContact N-O 3.28Å; L1142-L1156 PolarHBondContact O-N 3.27Å; L1142-W1167 HydrophobicContact CD2-CB 3.94Å; L1142-L1168 HydrophobicContact CB-CD2 4.18Å; L1142-L1168 HydrophobicContact CD2-CD2 4.14Å; L1142-L1168 HydrophobicContact CD2-CG 4.34Å; L1142-F1171 HydrophobicContact CD1-CE2 3.9Å; L1142-F1171 HydrophobicContact CD2-CE2 4.32Å
1143	R	93.6	Very high	89.8	Confident	60 Å²	60	56 Å²	56	23%	0.226	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	126.8	-170.2	-177.1	176.4	-82.8	-152.6	-9.1	109.6	V1124 V1126 D1131 D1133 F1152 M1155	V1124-R1143 HydrophobicContact CB-CB 4.25Å; V1124-R1143 PolarHBondContact N-O 3.18Å; V1124-R1143 PolarHBondContact O-N 3.02Å; V1126-R1143 HydrophobicContact CG2-CB 3.64Å; D1131-R1143 IonicContact OD2-CZ 2.94Å; D1131-R1143 IonicContact OD2-NH2 2.6Å; D1131-R1143 PolarHBondContact OD2-NH2 2.87Å; D1133-R1143 IonicContact OD2-CZ 2.85Å; D1133-R1143 IonicContact OD2-NH1 3.9Å; D1133-R1143 IonicContact OD2-NH2 3.74Å; D1133-R1143 PolarHBondContact OD2-NH2 2.99Å; R1143-F1152 HydrophobicContact CG-CD2 4.07Å; R1143-F1152 HydrophobicContact CG-CE2 4.2Å; R1143-M1155 HydrophobicContact CB-CE 3.85Å; R1143-M1155 HydrophobicContact CB-SD 3.39Å; R1143-M1155 WeakPolarHBondContact CB-SD 3.36Å; R1143-M1155 HydrophobicContact CG-SD 3.6Å; R1143-M1155 VanDerWaalsContact CG-SD 3.6Å
1144	L	94.9	Very high	90.4	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	121.6	169.7	-57.2	-171.2	0	0	0	108.9	L1097 L1116 I1121 V1123 L1142 M1153 C1154 L1156 F1171	L1097-L1144 HydrophobicContact CD2-CD1 3.97Å; L1116-L1144 HydrophobicContact CD1-CD1 3.7Å; I1121-L1144 HydrophobicContact CG2-CB 4.04Å; I1121-L1144 HydrophobicContact CG2-CD2 4Å; I1121-L1144 HydrophobicContact CG2-CG 4.43Å; V1123-L1144 HydrophobicContact CB-CD2 4.29Å; V1123-L1144 HydrophobicContact CG1-CD2 4.09Å; V1123-L1144 HydrophobicContact CG2-CD2 3.77Å; L1142-L1144 HydrophobicContact CD1-CD2 4.1Å; L1144-M1153 HydrophobicContact CB-CB 4.41Å; L1144-M1153 WeakPolarHBondContact O-CB 3.32Å; L1144-M1153 PolarHBondContact O-N 3.16Å; L1144-C1154 PolarHBondContact N-O 3.24Å; L1144-C1154 PolarHBondContact O-N 2.94Å; L1144-L1156 HydrophobicContact CD1-CD1 3.72Å; L1144-L1156 HydrophobicContact CD1-CG 4.31Å; L1144-L1156 HydrophobicContact CG-CD1 4.12Å; L1144-L1156 HydrophobicContact CG-CG 4.44Å; L1144-F1171 HydrophobicContact CD2-CZ 4.41Å
1145	R	93.9	Very high	91	Very high	73 Å²	73	51.2 Å²	51.2	28%	0.275	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	153.1	170.7	66.7	178.7	177.7	-162.9	-5	110.4	I1121 E1122 V1124 E1151	I1121-R1145 WeakPolarHBondContact CA-O 3.28Å; E1122-R1145 HydrophobicContact CB-CG 4.05Å; E1122-R1145 PolarHBondContact N-O 3.23Å; E1122-R1145 PolarHBondContact O-N 3.14Å; E1122-R1145 VanDerWaalsContact O-N 3.11Å; E1122-R1145 IonicContact OE1-CZ 3.53Å; E1122-R1145 IonicContact OE1-NE 3.22Å; E1122-R1145 IonicContact OE1-NH2 2.67Å; E1122-R1145 PolarHBondContact OE1-NH2 3.08Å; E1122-R1145 IonicContact OE2-CZ 3.88Å; E1122-R1145 IonicContact OE2-NE 3.96Å; E1122-R1145 PolarHBondContact OE2-NE 2.53Å; E1122-R1145 IonicContact OE2-NH2 3.67Å; E1122-R1145 PolarHBondContact OE2-NH2 3Å; V1124-R1145 HydrophobicContact CG2-CG 4.32Å; R1145-E1151 CarbonylContact C-O 3.44Å; R1145-E1151 WeakPolarHBondContact CA-O 3.07Å; R1145-E1151 WeakPolarHBondContact CB-O 3.44Å
1146	N	93.6	Very high	91.7	Very high	14 Å²	14	48.6 Å²	48.6	8%	0.075	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.3	133.9	167.6	-178.4	-69.6	0	0	0	108.8	E1120 S1148 T1149 L1150 E1151	E1120-N1146 CarbonylContact O-C 3.4Å; E1120-N1146 VanDerWaalsContact O-CA 3.28Å; E1120-N1146 WeakPolarHBondContact O-CA 3.33Å; E1120-N1146 PolarHBondContact OE2-ND2 2.98Å; N1146-S1148 VanDerWaalsContact C-N 3.35Å; N1146-S1148 PolarHBondContact O-N 2.91Å; N1146-S1148 WeakPolarHBondContact OD1-CA 3.22Å; N1146-S1148 PolarHBondContact OD1-N 2.8Å; N1146-S1148 PolarHBondContact OD1-OG 2.86Å; N1146-T1149 WeakPolarHBondContact CB-OG1 3.13Å; N1146-T1149 PolarHBondContact OD1-N 2.84Å; N1146-T1149 PolarHBondContact OD1-OG1 3.21Å; N1146-L1150 WeakPolarHBondContact O-CA 3.28Å; N1146-L1150 PolarHBondContact O-N 2.9Å; N1146-E1151 PolarHBondContact N-O 3.1Å
1147	A	91.8	Very high	92.1	Very high	53 Å²	53	46.5 Å²	46.5	44%	0.438	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-70.9	-28.5	-174.8	0	0	0	0	0	113.2	E1120 E1122	E1120-A1147 PolarHBondContact O-N 3.05Å; E1122-A1147 HydrophobicContact CB-CB 4.19Å
1148	S	92.7	Very high	92.4	Very high	102 Å²	102	42.4 Å²	42.4	71%	0.713	23%	0.225	S	C	*	.	T	Hydrogen-bonded Turn	trans	-89.9	-41.7	-177.4	71.5	0	0	0	0	113.4	N1146	N1146-S1148 VanDerWaalsContact C-N 3.35Å; N1146-S1148 PolarHBondContact O-N 2.91Å; N1146-S1148 WeakPolarHBondContact OD1-CA 3.22Å; N1146-S1148 PolarHBondContact OD1-N 2.8Å; N1146-S1148 PolarHBondContact OD1-OG 2.86Å
1149	T	91.3	Very high	92.5	Very high	88 Å²	88	50.4 Å²	50.4	54%	0.54	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.4	-8.8	-178.3	64.9	0	0	0	0	113.5	N1146 E1151	N1146-T1149 WeakPolarHBondContact CB-OG1 3.13Å; N1146-T1149 PolarHBondContact OD1-N 2.84Å; N1146-T1149 PolarHBondContact OD1-OG1 3.21Å; T1149-E1151 PolarHBondContact O-N 2.98Å; T1149-E1151 VanDerWaalsContact O-N 3.09Å; T1149-E1151 VanDerWaalsContact OG1-CB 3.25Å; T1149-E1151 WeakPolarHBondContact OG1-CB 3.5Å; T1149-E1151 PolarHBondContact OG1-N 2.89Å
1150	L	89.4	Confident	92.6	Very high	102 Å²	102	49.5 Å²	49.5	53%	0.534	25%	0.251	S	S	.	.			trans	55.8	15	-168	-55.8	177.9	0	0	0	113.8	N1146 F1152	N1146-L1150 WeakPolarHBondContact O-CA 3.28Å; N1146-L1150 PolarHBondContact O-N 2.9Å; L1150-F1152 PolarHBondContact O-N 3.04Å
1151	E	89.8	Confident	92.6	Very high	122 Å²	122	52.4 Å²	52.4	57%	0.57	27%	0.269	S	S	*	.			trans	-66.9	126	-177.4	-174.8	177.5	-167.8	0	0	111.4	R1145 N1146 T1149 M1153	R1145-E1151 CarbonylContact C-O 3.44Å; R1145-E1151 WeakPolarHBondContact CA-O 3.07Å; R1145-E1151 WeakPolarHBondContact CB-O 3.44Å; N1146-E1151 PolarHBondContact N-O 3.1Å; T1149-E1151 PolarHBondContact O-N 2.98Å; T1149-E1151 VanDerWaalsContact O-N 3.09Å; T1149-E1151 VanDerWaalsContact OG1-CB 3.25Å; T1149-E1151 WeakPolarHBondContact OG1-CB 3.5Å; T1149-E1151 PolarHBondContact OG1-N 2.89Å; E1151-M1153 PolarHBondContact O-N 3.46Å
1152	F	89.1	Confident	92.6	Very high	17 Å²	17	57.1 Å²	57.1	8%	0.075	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.5	116.4	174	173.9	-89.1	0	0	0	111.6	R1081 L1134 R1143 L1150 C1154 M1155	R1081-F1152 HydrophobicContact CG-CD1 3.65Å; R1081-F1152 HydrophobicContact CG-CE1 3.78Å; L1134-F1152 HydrophobicContact CD1-CZ 4.24Å; L1134-F1152 HydrophobicContact CD2-CE1 4.23Å; L1134-F1152 HydrophobicContact CD2-CZ 4.02Å; L1134-F1152 HydrophobicContact CG-CZ 4.42Å; R1143-F1152 HydrophobicContact CG-CD2 4.07Å; R1143-F1152 HydrophobicContact CG-CE2 4.2Å; L1150-F1152 PolarHBondContact O-N 3.04Å; F1152-C1154 VanDerWaalsContact CZ-C 3.49Å; F1152-M1155 HydrophobicContact CE2-CG 3.72Å; F1152-M1155 HydrophobicContact CE2-SD 3.84Å; F1152-M1155 HydrophobicContact CZ-CB 4.48Å; F1152-M1155 HydrophobicContact CZ-CG 3.9Å
1153	M	91.5	Very high	92.5	Very high	61 Å²	61	59.3 Å²	59.3	30%	0.3	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	-50.4	177.5	-57.1	-127.5	92.3	0	0	111.9	L1116 I1121 L1144 E1151	L1116-M1153 HydrophobicContact CD2-SD 4.22Å; I1121-M1153 HydrophobicContact CD1-CG 4.49Å; I1121-M1153 HydrophobicContact CD1-SD 3.85Å; I1121-M1153 HydrophobicContact CG1-SD 4.16Å; L1144-M1153 HydrophobicContact CB-CB 4.41Å; L1144-M1153 WeakPolarHBondContact O-CB 3.32Å; L1144-M1153 PolarHBondContact O-N 3.16Å; E1151-M1153 PolarHBondContact O-N 3.46Å
1154	C	92.4	Very high	92.5	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-169.2	161.7	170.5	59.1	0	0	0	0	113.5	R1078 A1079 V1080 L1144 F1152	R1078-C1154 HydrophobicContact CG-CB 3.73Å; A1079-C1154 WeakPolarHBondContact O-CA 3.48Å; A1079-C1154 VanDerWaalsContact O-CB 3.26Å; A1079-C1154 WeakPolarHBondContact O-CB 3.18Å; V1080-C1154 HydrophobicContact CG2-CB 4Å; L1144-C1154 PolarHBondContact N-O 3.24Å; L1144-C1154 PolarHBondContact O-N 2.94Å; F1152-C1154 VanDerWaalsContact CZ-C 3.49Å
1155	M	92.9	Very high	92.5	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	141.7	158.1	-69.3	-52.8	-60.8	0	0	109.6	R1078 A1079 V1126 L1134 L1138 A1141 L1142 R1143 F1152	R1078-M1155 CarbonylContact C-O 3.56Å; R1078-M1155 WeakPolarHBondContact CA-O 3.44Å; A1079-M1155 HydrophobicContact CB-CB 4.39Å; A1079-M1155 PolarHBondContact N-O 2.9Å; A1079-M1155 PolarHBondContact O-N 2.86Å; V1126-M1155 HydrophobicContact CB-CE 3.82Å; V1126-M1155 HydrophobicContact CG1-CE 4.05Å; V1126-M1155 HydrophobicContact CG2-CE 3.66Å; V1126-M1155 HydrophobicContact CG2-SD 4.42Å; L1134-M1155 HydrophobicContact CD1-CB 4.04Å; L1134-M1155 HydrophobicContact CD1-CG 3.48Å; L1134-M1155 VanDerWaalsContact CD1-CG 3.48Å; L1138-M1155 HydrophobicContact CD1-CB 4.46Å; L1138-M1155 HydrophobicContact CD1-CE 3.68Å; L1138-M1155 HydrophobicContact CD1-CG 3.8Å; L1138-M1155 HydrophobicContact CD1-SD 4.23Å; A1141-M1155 HydrophobicContact CB-CE 3.74Å; L1142-M1155 VanDerWaalsContact C-CE 3.4Å; L1142-M1155 VanDerWaalsContact O-CE 3.24Å; L1142-M1155 WeakPolarHBondContact O-CE 3.49Å; R1143-M1155 HydrophobicContact CB-CE 3.85Å; R1143-M1155 HydrophobicContact CB-SD 3.39Å; R1143-M1155 WeakPolarHBondContact CB-SD 3.36Å; R1143-M1155 HydrophobicContact CG-SD 3.6Å; R1143-M1155 VanDerWaalsContact CG-SD 3.6Å; F1152-M1155 HydrophobicContact CE2-CG 3.72Å; F1152-M1155 HydrophobicContact CE2-SD 3.84Å; F1152-M1155 HydrophobicContact CZ-CB 4.48Å; F1152-M1155 HydrophobicContact CZ-CG 3.9Å
1156	L	94.8	Very high	92.6	Very high	0 Å²	0	64.6 Å²	64.6	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	122.6	168.2	-59.9	-178.6	0	0	0	108.9	L1076 R1078 F1090 L1097 A1141 L1142 L1144	L1076-L1156 HydrophobicContact CD1-CB 4.14Å; L1076-L1156 HydrophobicContact CD1-CD1 3.92Å; L1076-L1156 HydrophobicContact CD1-CG 4.48Å; R1078-L1156 HydrophobicContact CB-CD2 3.9Å; R1078-L1156 HydrophobicContact CG-CD2 3.95Å; F1090-L1156 HydrophobicContact CE1-CD1 4.26Å; F1090-L1156 HydrophobicContact CE1-CD2 3.87Å; F1090-L1156 HydrophobicContact CE2-CD2 3.89Å; F1090-L1156 HydrophobicContact CZ-CD1 4.46Å; F1090-L1156 HydrophobicContact CZ-CD2 3.34Å; L1097-L1156 HydrophobicContact CD2-CD1 4.43Å; A1141-L1156 CarbonylContact C-O 3.59Å; A1141-L1156 WeakPolarHBondContact CA-O 3.31Å; L1142-L1156 HydrophobicContact CD1-CB 3.86Å; L1142-L1156 HydrophobicContact CD1-CD1 4.03Å; L1142-L1156 HydrophobicContact CD1-CG 4.29Å; L1142-L1156 HydrophobicContact CG-CB 4.2Å; L1142-L1156 PolarHBondContact N-O 3.28Å; L1142-L1156 PolarHBondContact O-N 3.27Å; L1144-L1156 HydrophobicContact CD1-CD1 3.72Å; L1144-L1156 HydrophobicContact CD1-CG 4.31Å; L1144-L1156 HydrophobicContact CG-CD1 4.12Å; L1144-L1156 HydrophobicContact CG-CG 4.44Å
1157	C	93.2	Very high	92.7	Very high	21 Å²	21	64.3 Å²	64.3	14%	0.142	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	125.2	-179.3	-53.1	0	0	0	0	110.9	T1077	T1077-C1157 PolarHBondContact N-O 3.36Å; T1077-C1157 PolarHBondContact O-N 3.08Å
1158	C	94	Very high	92.9	Very high	10 Å²	10	63.4 Å²	63.4	7%	0.068	31%	0.313	C	S	.	.			trans	-85.4	159.8	175.8	-59.5	0	0	0	0	111.3	L1076 N1140 K1160 D1163 K1164	L1076-C1158 HydrophobicContact CD2-CB 4.32Å; L1076-C1158 WeakPolarHBondContact CD2-SG 3.49Å; N1140-C1158 HydrophobicContact CB-CB 3.93Å; N1140-C1158 WeakPolarHBondContact O-CB 3.48Å; N1140-C1158 PolarHBondContact O-N 2.93Å; C1158-K1160 WeakPolarHBondContact CB-O 3.43Å; C1158-D1163 HydrophobicContact CB-CB 4.16Å; C1158-K1164 HydrophobicContact CB-CB 4.02Å; C1158-K1164 WeakPolarHBondContact SG-CA 3.35Å
1159	R	91	Very high	93	Very high	175 Å²	175	63.5 Å²	63.5	66%	0.66	30%	0.302	S	S	*	.	S	Bend	trans	-78.6	-23.4	174.6	-68.3	-175.8	178.2	-166.5	1.2	113.2	E1075	E1075-R1159 IonicContact OE2-NH2 2.88Å
1160	K	92.7	Very high	93.2	Very high	113 Å²	113	59.7 Å²	59.7	49%	0.491	28%	0.279	S	S	.	.	S	Bend	trans	-142.7	167.5	-179	-41	177.1	175.2	-176	0	111.5	N1140 C1158 E1162 D1163 K1164	N1140-K1160 WeakPolarHBondContact CB-O 3.14Å; C1158-K1160 WeakPolarHBondContact CB-O 3.43Å; K1160-E1162 WeakPolarHBondContact CB-OE2 3.47Å; K1160-E1162 WeakPolarHBondContact CD-OE2 3.35Å; K1160-D1163 WeakPolarHBondContact CG-OD2 3.25Å; K1160-K1164 PolarHBondContact O-N 2.82Å
1161	V	93.4	Very high	93.6	Very high	89 Å²	89	55.1 Å²	55.1	54%	0.539	26%	0.255	S	S	.	.	H	α-helix	trans	-73.8	-35.8	179	70.6	0	0	0	0	112.1	N1140 D1163 K1164 Q1165	N1140-V1161 WeakPolarHBondContact OD1-CA 3.4Å; N1140-V1161 WeakPolarHBondContact OD1-CB 3.26Å; N1140-V1161 PolarHBondContact OD1-N 3.27Å; V1161-D1163 VanDerWaalsContact C-N 3.28Å; V1161-D1163 PolarHBondContact O-N 2.83Å; V1161-K1164 WeakPolarHBondContact O-CB 3.27Å; V1161-K1164 PolarHBondContact O-N 2.78Å; V1161-Q1165 PolarHBondContact O-N 3.24Å
1162	E	93.7	Very high	93.8	Very high	99 Å²	99	52.4 Å²	52.4	46%	0.463	25%	0.254	S	S	.	.	H	α-helix	trans	-69.6	-30.9	178.5	-43.1	91.2	143.8	0	0	111.2	K1160 R1166	K1160-E1162 WeakPolarHBondContact CB-OE2 3.47Å; K1160-E1162 WeakPolarHBondContact CD-OE2 3.35Å; E1162-R1166 WeakPolarHBondContact O-CD 3.35Å; E1162-R1166 VanDerWaalsContact O-CG 3.23Å; E1162-R1166 WeakPolarHBondContact O-CG 3.11Å; E1162-R1166 PolarHBondContact O-N 3.08Å; E1162-R1166 VanDerWaalsContact O-N 3.13Å
1163	D	92.4	Very high	94	Very high	46 Å²	46	56 Å²	56	25%	0.246	27%	0.269	C	S	.	.	H	α-helix	trans	-71.1	-41	172.9	-61.8	-30.8	0	0	0	110.5	C1158 K1160 V1161 R1166 W1167	C1158-D1163 HydrophobicContact CB-CB 4.16Å; K1160-D1163 WeakPolarHBondContact CG-OD2 3.25Å; V1161-D1163 VanDerWaalsContact C-N 3.28Å; V1161-D1163 PolarHBondContact O-N 2.83Å; D1163-R1166 PolarHBondContact O-N 2.92Å; D1163-R1166 IonicContact OD1-NH1 2.72Å; D1163-R1166 PolarHBondContact OD1-NH1 3.06Å; D1163-R1166 VanDerWaalsContact OD1-NH1 3.14Å; D1163-W1167 VanDerWaalsContact O-CD1 3.23Å; D1163-W1167 PolarHBondContact O-N 2.88Å; D1163-W1167 VanDerWaalsContact O-N 3.1Å
1164	K	94.8	Very high	94.1	Very high	20 Å²	20	53 Å²	53	9%	0.087	26%	0.255	C	S	.	.	H	α-helix	trans	-58.2	-48.4	172.2	163.3	177.8	166.5	168.7	0	111.6	D1125 V1126 N1140 A1141 C1158 K1160 V1161 R1166 W1167 L1168	D1125-K1164 VanDerWaalsContact CG-NZ 3.35Å; D1125-K1164 WeakPolarHBondContact OD1-CE 3.37Å; D1125-K1164 IonicContact OD1-NZ 2.77Å; D1125-K1164 PolarHBondContact OD1-NZ 2.69Å; D1125-K1164 IonicContact OD2-NZ 3.57Å; D1125-K1164 PolarHBondContact OD2-NZ 2.98Å; V1126-K1164 PolarHBondContact O-NZ 2.83Å; N1140-K1164 HydrophobicContact CB-CB 4.13Å; N1140-K1164 HydrophobicContact CB-CD 4.33Å; A1141-K1164 PolarHBondContact O-NZ 3.31Å; C1158-K1164 HydrophobicContact CB-CB 4.02Å; C1158-K1164 WeakPolarHBondContact SG-CA 3.35Å; K1160-K1164 PolarHBondContact O-N 2.82Å; V1161-K1164 WeakPolarHBondContact O-CB 3.27Å; V1161-K1164 PolarHBondContact O-N 2.78Å; K1164-R1166 PolarHBondContact O-N 3.43Å; K1164-W1167 PolarHBondContact O-N 2.84Å; K1164-W1167 VanDerWaalsContact O-N 3.13Å; K1164-L1168 HydrophobicContact CG-CD1 4.14Å; K1164-L1168 PolarHBondContact O-N 2.85Å
1165	Q	95.2	Very high	94.2	Very high	96 Å²	96	57.1 Å²	57.1	45%	0.449	27%	0.27	S	S	.	.	H	α-helix	trans	-58.3	-47.3	179.7	-178.8	58.7	25.4	0	0	111.5	V1161 W1167 L1168 E1169	V1161-Q1165 PolarHBondContact O-N 3.24Å; Q1165-W1167 VanDerWaalsContact C-N 3.29Å; Q1165-W1167 PolarHBondContact O-N 3.14Å; Q1165-L1168 PolarHBondContact O-N 3.32Å; Q1165-E1169 VanDerWaalsContact CG-OE1 3.3Å; Q1165-E1169 WeakPolarHBondContact CG-OE1 3.31Å; Q1165-E1169 PolarHBondContact NE2-OE1 3.38Å; Q1165-E1169 WeakPolarHBondContact O-CB 3.43Å; Q1165-E1169 WeakPolarHBondContact O-CG 3.34Å; Q1165-E1169 PolarHBondContact O-N 2.8Å
1166	R	94.7	Very high	94.2	Very high	129 Å²	129	61.3 Å²	61.3	49%	0.487	29%	0.29	S	S	.	.	H	α-helix	trans	-59.6	-35.4	175.1	-72.9	164.2	178.5	157.5	-2.7	113.8	E1162 D1163 K1164 A1170	E1162-R1166 WeakPolarHBondContact O-CD 3.35Å; E1162-R1166 VanDerWaalsContact O-CG 3.23Å; E1162-R1166 WeakPolarHBondContact O-CG 3.11Å; E1162-R1166 PolarHBondContact O-N 3.08Å; E1162-R1166 VanDerWaalsContact O-N 3.13Å; D1163-R1166 PolarHBondContact O-N 2.92Å; D1163-R1166 IonicContact OD1-NH1 2.72Å; D1163-R1166 PolarHBondContact OD1-NH1 3.06Å; D1163-R1166 VanDerWaalsContact OD1-NH1 3.14Å; K1164-R1166 PolarHBondContact O-N 3.43Å; R1166-A1170 WeakPolarHBondContact O-CB 3.45Å; R1166-A1170 PolarHBondContact O-N 3.5Å
1167	W	95.8	Very high	93.8	Very high	7 Å²	7	62.3 Å²	62.3	3%	0.027	29%	0.294	C	S	.	.	H	α-helix	trans	-70.8	-41.8	176.1	-86.4	99.3	0	0	0	111.8	H1072 L1076 F1090 L1092 L1097 L1142 D1163 K1164 Q1165 A1170 F1171	H1072-W1167 AromaticContact CD2-CD2 3.69Å; H1072-W1167 AromaticContact CD2-CE2 3.47Å; H1072-W1167 VanDerWaalsContact CD2-CE2 3.47Å; H1072-W1167 AromaticContact CD2-CE3 3.99Å; H1072-W1167 AromaticContact CD2-CH2 3.91Å; H1072-W1167 AromaticContact CD2-CZ2 3.62Å; H1072-W1167 AromaticContact CD2-NE1 3.9Å; H1072-W1167 AromaticContact NE2-CE2 3.83Å; H1072-W1167 AromaticContact NE2-NE1 3.77Å; L1076-W1167 HydrophobicContact CD1-CD2 3.82Å; L1076-W1167 HydrophobicContact CD1-CE3 4.23Å; L1076-W1167 HydrophobicContact CD1-CG 4.27Å; L1076-W1167 HydrophobicContact CD1-CH2 4.31Å; L1076-W1167 HydrophobicContact CD1-CZ2 3.89Å; L1076-W1167 HydrophobicContact CD1-CZ3 4.45Å; L1076-W1167 HydrophobicContact CD2-CG 4.41Å; L1076-W1167 HydrophobicContact CG-CZ2 4.19Å; F1090-W1167 HydrophobicContact CB-CH2 3.5Å; F1090-W1167 HydrophobicContact CB-CZ2 3.98Å; F1090-W1167 HydrophobicContact CB-CZ3 4.33Å; L1092-W1167 HydrophobicContact CB-CZ3 4.08Å; L1097-W1167 HydrophobicContact CD1-CZ3 4.13Å; L1142-W1167 HydrophobicContact CD2-CB 3.94Å; D1163-W1167 VanDerWaalsContact O-CD1 3.23Å; D1163-W1167 PolarHBondContact O-N 2.88Å; D1163-W1167 VanDerWaalsContact O-N 3.1Å; K1164-W1167 PolarHBondContact O-N 2.84Å; K1164-W1167 VanDerWaalsContact O-N 3.13Å; Q1165-W1167 VanDerWaalsContact C-N 3.29Å; Q1165-W1167 PolarHBondContact O-N 3.14Å; W1167-A1170 PolarHBondContact O-N 3.2Å; W1167-F1171 HydrophobicContact CB-CE2 4.39Å; W1167-F1171 AromaticContact CE3-CE2 3.88Å; W1167-F1171 HydrophobicContact CE3-CE2 3.88Å; W1167-F1171 AromaticContact CE3-CZ 3.87Å; W1167-F1171 HydrophobicContact CE3-CZ 3.87Å; W1167-F1171 HydrophobicContact CZ3-CZ 4.23Å; W1167-F1171 WeakPolarHBondContact O-CD2 3.17Å; W1167-F1171 WeakPolarHBondContact O-CG 3.43Å; W1167-F1171 PolarHBondContact O-N 3.13Å
1168	L	95.9	Very high	93.7	Very high	35 Å²	35	61.5 Å²	61.5	18%	0.183	29%	0.288	C	S	.	.	H	α-helix	trans	-61.4	-46	173.4	-66.5	171.6	0	0	0	111.5	V1123 D1125 L1142 K1164 Q1165 A1170 F1171 A1172	V1123-L1168 HydrophobicContact CG1-CD2 4.08Å; D1125-L1168 HydrophobicContact CB-CD1 4.38Å; L1142-L1168 HydrophobicContact CB-CD2 4.18Å; L1142-L1168 HydrophobicContact CD2-CD2 4.14Å; L1142-L1168 HydrophobicContact CD2-CG 4.34Å; K1164-L1168 HydrophobicContact CG-CD1 4.14Å; K1164-L1168 PolarHBondContact O-N 2.85Å; Q1165-L1168 PolarHBondContact O-N 3.32Å; L1168-A1170 VanDerWaalsContact C-N 3.32Å; L1168-A1170 PolarHBondContact O-N 3.17Å; L1168-F1171 PolarHBondContact O-N 3.49Å; L1168-A1172 PolarHBondContact O-N 3.43Å
1169	E	96.1	Very high	93.4	Very high	104 Å²	104	66 Å²	66	49%	0.486	31%	0.307	S	S	.	.	H	α-helix	trans	-59.6	-39.6	173.4	-72.5	166.1	-177.8	0	0	112.2	Q1165 A1172 K1173	Q1165-E1169 VanDerWaalsContact CG-OE1 3.3Å; Q1165-E1169 WeakPolarHBondContact CG-OE1 3.31Å; Q1165-E1169 PolarHBondContact NE2-OE1 3.38Å; Q1165-E1169 WeakPolarHBondContact O-CB 3.43Å; Q1165-E1169 WeakPolarHBondContact O-CG 3.34Å; Q1165-E1169 PolarHBondContact O-N 2.8Å; E1169-A1172 PolarHBondContact O-N 3.33Å; E1169-K1173 VanDerWaalsContact O-CB 3.26Å; E1169-K1173 WeakPolarHBondContact O-CB 3.48Å; E1169-K1173 PolarHBondContact O-N 3.33Å
1170	A	94.8	Very high	93.1	Very high	7 Å²	7	60.7 Å²	60.7	6%	0.058	29%	0.289	C	S	.	.	H	α-helix	trans	-67.2	-39.3	177.2	0	0	0	0	0	112.8	H1072 L1092 R1166 W1167 L1168 E1174	H1072-A1170 HydrophobicContact CB-CB 3.49Å; H1072-A1170 VanDerWaalsContact CB-CB 3.49Å; L1092-A1170 HydrophobicContact CD2-CB 3.99Å; L1092-A1170 WeakPolarHBondContact CD2-O 3.32Å; R1166-A1170 WeakPolarHBondContact O-CB 3.45Å; R1166-A1170 PolarHBondContact O-N 3.5Å; W1167-A1170 PolarHBondContact O-N 3.2Å; L1168-A1170 VanDerWaalsContact C-N 3.32Å; L1168-A1170 PolarHBondContact O-N 3.17Å; A1170-E1174 VanDerWaalsContact O-CB 3.31Å; A1170-E1174 WeakPolarHBondContact O-CB 3.28Å; A1170-E1174 PolarHBondContact O-N 3.2Å
1171	F	96.4	Very high	92.6	Very high	6 Å²	6	56.4 Å²	56.4	3%	0.026	27%	0.272	C	S	.	.	H	α-helix	trans	-68	-41.4	174.4	-70.6	-59.9	0	0	0	112	L1092 L1097 M1118 V1123 L1142 L1144 W1167 L1168 E1174 R1175	L1092-F1171 HydrophobicContact CD1-CD1 3.96Å; L1092-F1171 HydrophobicContact CD1-CE1 3.86Å; L1092-F1171 HydrophobicContact CD2-CD1 3.67Å; L1092-F1171 HydrophobicContact CD2-CE1 4Å; L1092-F1171 HydrophobicContact CD2-CG 4.32Å; L1092-F1171 HydrophobicContact CG-CD1 4.48Å; L1092-F1171 HydrophobicContact CG-CE1 4.5Å; L1097-F1171 HydrophobicContact CD2-CE1 4.04Å; L1097-F1171 HydrophobicContact CD2-CZ 4.04Å; M1118-F1171 HydrophobicContact CE-CD1 3.58Å; M1118-F1171 HydrophobicContact CE-CE1 3.75Å; M1118-F1171 HydrophobicContact SD-CD1 4.37Å; M1118-F1171 HydrophobicContact SD-CE1 4Å; V1123-F1171 HydrophobicContact CB-CB 4.46Å; V1123-F1171 HydrophobicContact CB-CD2 4.43Å; V1123-F1171 HydrophobicContact CB-CG 4.46Å; V1123-F1171 HydrophobicContact CG1-CB 4.47Å; V1123-F1171 HydrophobicContact CG1-CD2 3.7Å; V1123-F1171 HydrophobicContact CG1-CE2 4.15Å; V1123-F1171 HydrophobicContact CG1-CG 4.2Å; V1123-F1171 HydrophobicContact CG2-CB 3.96Å; V1123-F1171 HydrophobicContact CG2-CD1 3.95Å; V1123-F1171 HydrophobicContact CG2-CD2 4.04Å; V1123-F1171 HydrophobicContact CG2-CE1 4.42Å; V1123-F1171 HydrophobicContact CG2-CG 3.75Å; L1142-F1171 HydrophobicContact CD1-CE2 3.9Å; L1142-F1171 HydrophobicContact CD2-CE2 4.32Å; L1144-F1171 HydrophobicContact CD2-CZ 4.41Å; W1167-F1171 HydrophobicContact CB-CE2 4.39Å; W1167-F1171 AromaticContact CE3-CE2 3.88Å; W1167-F1171 HydrophobicContact CE3-CE2 3.88Å; W1167-F1171 AromaticContact CE3-CZ 3.87Å; W1167-F1171 HydrophobicContact CE3-CZ 3.87Å; W1167-F1171 HydrophobicContact CZ3-CZ 4.23Å; W1167-F1171 WeakPolarHBondContact O-CD2 3.17Å; W1167-F1171 WeakPolarHBondContact O-CG 3.43Å; W1167-F1171 PolarHBondContact O-N 3.13Å; L1168-F1171 PolarHBondContact O-N 3.49Å; F1171-E1174 PolarHBondContact O-N 2.9Å; F1171-R1175 PolarHBondContact O-N 3.46Å; F1171-R1175 VanDerWaalsContact O-N 3.1Å
1172	A	95.5	Very high	92.1	Very high	66 Å²	66	59 Å²	59	55%	0.545	28%	0.278	S	S	.	.	H	α-helix	trans	-62.8	-44.3	173.8	0	0	0	0	0	111.8	L1168 E1169 E1174 Q1176	L1168-A1172 PolarHBondContact O-N 3.43Å; E1169-A1172 PolarHBondContact O-N 3.33Å; A1172-E1174 VanDerWaalsContact C-N 3.26Å; A1172-E1174 PolarHBondContact O-N 2.81Å; A1172-Q1176 WeakPolarHBondContact O-CB 3.32Å; A1172-Q1176 PolarHBondContact O-N 3.15Å
1173	K	92.6	Very high	91.4	Very high	91 Å²	91	59.9 Å²	59.9	40%	0.396	28%	0.282	S	S	.	.	H	α-helix	trans	-59.5	-36.2	172.8	-177.8	-176.3	172.4	-164.7	0	111.8	I1071 E1169 R1177 S1236	I1071-K1173 HydrophobicContact CG2-CB 4.47Å; I1071-K1173 HydrophobicContact CG2-CD 4.05Å; I1071-K1173 HydrophobicContact CG2-CG 4.27Å; E1169-K1173 VanDerWaalsContact O-CB 3.26Å; E1169-K1173 WeakPolarHBondContact O-CB 3.48Å; E1169-K1173 PolarHBondContact O-N 3.33Å; K1173-R1177 VanDerWaalsContact O-CB 3.3Å; K1173-R1177 WeakPolarHBondContact O-CB 3.41Å; K1173-R1177 PolarHBondContact O-N 2.67Å; K1173-S1236 PolarHBondContact NZ-OG 2.72Å
1174	E	94.4	Very high	90.3	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-70.1	-46	-178.8	-175	-88.1	160.5	0	0	112.9	I1071 L1092 F1093 H1095 M1118 A1170 F1171 A1172 Q1176 R1177 V1178	I1071-E1174 HydrophobicContact CD1-CB 3.73Å; I1071-E1174 HydrophobicContact CD1-CG 3.59Å; I1071-E1174 HydrophobicContact CG2-CB 4.33Å; L1092-E1174 HydrophobicContact CD1-CB 4.44Å; L1092-E1174 HydrophobicContact CD1-CG 3.96Å; L1092-E1174 HydrophobicContact CD2-CB 3.99Å; L1092-E1174 HydrophobicContact CD2-CG 4.36Å; L1092-E1174 HydrophobicContact CG-CB 4.3Å; L1092-E1174 HydrophobicContact CG-CG 4.13Å; F1093-E1174 WeakPolarHBondContact O-CG 3.39Å; H1095-E1174 PolarHBondContact N-OE1 2.9Å; M1118-E1174 WeakPolarHBondContact CB-OE1 3.42Å; A1170-E1174 VanDerWaalsContact O-CB 3.31Å; A1170-E1174 WeakPolarHBondContact O-CB 3.28Å; A1170-E1174 PolarHBondContact O-N 3.2Å; F1171-E1174 PolarHBondContact O-N 2.9Å; A1172-E1174 VanDerWaalsContact C-N 3.26Å; A1172-E1174 PolarHBondContact O-N 2.81Å; E1174-Q1176 VanDerWaalsContact C-N 3.32Å; E1174-Q1176 PolarHBondContact O-N 3.15Å; E1174-R1177 PolarHBondContact O-N 2.78Å; E1174-V1178 WeakPolarHBondContact O-CG2 3.38Å; E1174-V1178 PolarHBondContact O-N 3.01Å
1175	R	94.8	Very high	89.1	Confident	85 Å²	85	61.4 Å²	61.4	32%	0.321	30%	0.301	S	S	.	.	H	α-helix	trans	-62.3	-38.9	172.4	-63.6	-68.4	83.8	-156.6	7	112.3	M1118 D1119 F1171 K1179	M1118-R1175 VanDerWaalsContact O-CZ 3.26Å; D1119-R1175 IonicContact OD1-CZ 3.97Å; D1119-R1175 VanDerWaalsContact OD1-CZ 3.23Å; D1119-R1175 IonicContact OD1-NH1 3.99Å; D1119-R1175 PolarHBondContact OD1-NH1 3.28Å; D1119-R1175 IonicContact OD1-NH2 3.96Å; D1119-R1175 PolarHBondContact OD1-NH2 3.49Å; F1171-R1175 PolarHBondContact O-N 3.46Å; F1171-R1175 VanDerWaalsContact O-N 3.1Å; R1175-K1179 PolarHBondContact O-N 3.18Å; R1175-K1179 VanDerWaalsContact O-N 3.16Å
1176	Q	91.6	Very high	87.8	Confident	89 Å²	89	57.9 Å²	57.9	42%	0.416	29%	0.285	S	S	.	.	H	α-helix	trans	-63.4	-43.4	172.9	174.8	59.8	23.4	0	0	112	A1172 E1174 V1178 K1179 E1180	A1172-Q1176 WeakPolarHBondContact O-CB 3.32Å; A1172-Q1176 PolarHBondContact O-N 3.15Å; E1174-Q1176 VanDerWaalsContact C-N 3.32Å; E1174-Q1176 PolarHBondContact O-N 3.15Å; Q1176-V1178 PolarHBondContact O-N 2.91Å; Q1176-K1179 PolarHBondContact O-N 2.85Å; Q1176-E1180 WeakPolarHBondContact CG-OE1 3.33Å; Q1176-E1180 PolarHBondContact NE2-OE1 2.8Å; Q1176-E1180 WeakPolarHBondContact O-CG 3.34Å; Q1176-E1180 PolarHBondContact O-N 3.04Å
1177	R	87.1	Confident	86.4	Confident	20 Å²	20	58.2 Å²	58.2	8%	0.075	30%	0.296	C	S	.	.	H	α-helix	trans	-64.5	-40.9	179.9	-161.3	77.2	-157.5	68.2	23.4	111.7	E1037 R1041 I1071 K1173 E1174 E1180 D1181	E1037-R1177 IonicContact OE1-CZ 3.09Å; E1037-R1177 IonicContact OE1-NE 2.84Å; E1037-R1177 PolarHBondContact OE1-NE 3.17Å; E1037-R1177 IonicContact OE1-NH2 3.92Å; E1037-R1177 PolarHBondContact OE1-NH2 3.39Å; R1041-R1177 VanDerWaalsContact NH2-CZ 3.28Å; I1071-R1177 HydrophobicContact CD1-CB 4.16Å; I1071-R1177 HydrophobicContact CD1-CG 4.43Å; K1173-R1177 VanDerWaalsContact O-CB 3.3Å; K1173-R1177 WeakPolarHBondContact O-CB 3.41Å; K1173-R1177 PolarHBondContact O-N 2.67Å; E1174-R1177 PolarHBondContact O-N 2.78Å; R1177-E1180 WeakPolarHBondContact CD-OE2 3.42Å; R1177-E1180 IonicContact CZ-OE2 3.64Å; R1177-E1180 IonicContact NE-OE2 3.2Å; R1177-E1180 IonicContact NH1-OE2 3.83Å; R1177-E1180 PolarHBondContact NH1-OE2 2.92Å; R1177-E1180 WeakPolarHBondContact O-CB 3.43Å; R1177-E1180 PolarHBondContact O-N 3Å; R1177-D1181 IonicContact CZ-OD1 3.71Å; R1177-D1181 IonicContact CZ-OD2 3.33Å; R1177-D1181 IonicContact NH1-OD1 3.62Å; R1177-D1181 PolarHBondContact NH1-OD1 2.86Å; R1177-D1181 VanDerWaalsContact NH1-OD1 3.1Å; R1177-D1181 IonicContact NH1-OD2 3.14Å; R1177-D1181 IonicContact NH2-OD1 2.77Å; R1177-D1181 PolarHBondContact NH2-OD1 2.81Å; R1177-D1181 IonicContact NH2-OD2 2.74Å; R1177-D1181 VanDerWaalsContact O-CG 3.26Å; R1177-D1181 PolarHBondContact O-N 3.39Å
1178	V	89.9	Confident	85.4	Confident	5 Å²	5	58.4 Å²	58.4	3%	0.03	30%	0.298	C	S	.	.	H	α-helix	trans	-62	-42.8	174.8	166.1	0	0	0	0	111.9	D1094 H1095 E1174 Q1176 D1181 Q1182	D1094-V1178 HydrophobicContact CB-CG2 4.28Å; H1095-V1178 WeakPolarHBondContact CE1-CG1 3.26Å; E1174-V1178 WeakPolarHBondContact O-CG2 3.38Å; E1174-V1178 PolarHBondContact O-N 3.01Å; Q1176-V1178 PolarHBondContact O-N 2.91Å; V1178-D1181 PolarHBondContact O-N 3.34Å; V1178-Q1182 WeakPolarHBondContact O-CG 3.34Å; V1178-Q1182 PolarHBondContact O-N 2.99Å; V1178-Q1182 VanDerWaalsContact O-N 3.13Å
1179	K	89.1	Confident	84.7	Confident	104 Å²	104	59.8 Å²	59.8	45%	0.452	31%	0.31	S	S	.	.	H	α-helix	trans	-62.3	-44.8	174.4	-177.6	174.5	-178.7	-70.6	0	112	R1175 Q1176 Q1182 E1183	R1175-K1179 PolarHBondContact O-N 3.18Å; R1175-K1179 VanDerWaalsContact O-N 3.16Å; Q1176-K1179 PolarHBondContact O-N 2.85Å; K1179-Q1182 PolarHBondContact O-N 2.9Å; K1179-E1183 WeakPolarHBondContact CE-OE1 3.37Å; K1179-E1183 IonicContact NZ-OE1 3Å; K1179-E1183 PolarHBondContact NZ-OE1 3.18Å; K1179-E1183 WeakPolarHBondContact O-CG 3.33Å; K1179-E1183 PolarHBondContact O-N 2.81Å
1180	E	83.9	Confident	83.9	Confident	63 Å²	63	59.1 Å²	59.1	29%	0.294	31%	0.31	S	S	.	.	H	α-helix	trans	-61.6	-42.8	175.3	-73.1	164.8	-177.2	0	0	112.4	Q1176 R1177 Q1182 E1183 M1184	Q1176-E1180 WeakPolarHBondContact CG-OE1 3.33Å; Q1176-E1180 PolarHBondContact NE2-OE1 2.8Å; Q1176-E1180 WeakPolarHBondContact O-CG 3.34Å; Q1176-E1180 PolarHBondContact O-N 3.04Å; R1177-E1180 WeakPolarHBondContact CD-OE2 3.42Å; R1177-E1180 IonicContact CZ-OE2 3.64Å; R1177-E1180 IonicContact NE-OE2 3.2Å; R1177-E1180 IonicContact NH1-OE2 3.83Å; R1177-E1180 PolarHBondContact NH1-OE2 2.92Å; R1177-E1180 WeakPolarHBondContact O-CB 3.43Å; R1177-E1180 PolarHBondContact O-N 3Å; E1180-Q1182 VanDerWaalsContact C-N 3.31Å; E1180-Q1182 PolarHBondContact O-N 3.09Å; E1180-E1183 PolarHBondContact O-N 3.25Å; E1180-M1184 WeakPolarHBondContact O-CB 3.39Å; E1180-M1184 WeakPolarHBondContact O-CG 3.4Å; E1180-M1184 PolarHBondContact O-N 3.42Å
1181	D	82.6	Confident	83.4	Confident	24 Å²	24	64.3 Å²	64.3	13%	0.128	33%	0.333	C	S	.	.	H	α-helix	trans	-65.3	-35.8	179.8	-69.4	-34.2	0	0	0	112.1	R1041 R1177 V1178 M1184 G1185	R1041-D1181 IonicContact CZ-OD1 3.99Å; R1041-D1181 IonicContact CZ-OD2 2.77Å; R1041-D1181 IonicContact NH1-OD2 3.77Å; R1041-D1181 VanDerWaalsContact NH2-CG 3.31Å; R1041-D1181 IonicContact NH2-OD1 2.64Å; R1041-D1181 PolarHBondContact NH2-OD1 2.79Å; R1041-D1181 IonicContact NH2-OD2 3.89Å; R1041-D1181 PolarHBondContact NH2-OD2 3.38Å; R1177-D1181 IonicContact CZ-OD1 3.71Å; R1177-D1181 IonicContact CZ-OD2 3.33Å; R1177-D1181 IonicContact NH1-OD1 3.62Å; R1177-D1181 PolarHBondContact NH1-OD1 2.86Å; R1177-D1181 VanDerWaalsContact NH1-OD1 3.1Å; R1177-D1181 IonicContact NH1-OD2 3.14Å; R1177-D1181 IonicContact NH2-OD1 2.77Å; R1177-D1181 PolarHBondContact NH2-OD1 2.81Å; R1177-D1181 IonicContact NH2-OD2 2.74Å; R1177-D1181 VanDerWaalsContact O-CG 3.26Å; R1177-D1181 PolarHBondContact O-N 3.39Å; V1178-D1181 PolarHBondContact O-N 3.34Å; D1181-M1184 PolarHBondContact O-N 3.02Å; D1181-G1185 PolarHBondContact O-N 3.4Å; D1181-G1185 VanDerWaalsContact O-N 3.09Å
1182	Q	82.4	Confident	82.8	Confident	143 Å²	143	67.9 Å²	67.9	67%	0.668	35%	0.35	S	S	*	.	H	α-helix	trans	-65.4	-43.8	171.5	-70.2	171.5	1	0	0	112.2	V1178 K1179 E1180 M1184	V1178-Q1182 WeakPolarHBondContact O-CG 3.34Å; V1178-Q1182 PolarHBondContact O-N 2.99Å; V1178-Q1182 VanDerWaalsContact O-N 3.13Å; K1179-Q1182 PolarHBondContact O-N 2.9Å; E1180-Q1182 VanDerWaalsContact C-N 3.31Å; E1180-Q1182 PolarHBondContact O-N 3.09Å; Q1182-M1184 PolarHBondContact O-N 3.43Å
1183	E	79.4	Confident	82.3	Confident	117 Å²	117	67.1 Å²	67.1	55%	0.547	33%	0.333	S	S	.	.	H	α-helix	trans	-69.8	-17.4	177	-74.7	174.8	-173.4	0	0	114.1	K1179 E1180	K1179-E1183 WeakPolarHBondContact CE-OE1 3.37Å; K1179-E1183 IonicContact NZ-OE1 3Å; K1179-E1183 PolarHBondContact NZ-OE1 3.18Å; K1179-E1183 WeakPolarHBondContact O-CG 3.33Å; K1179-E1183 PolarHBondContact O-N 2.81Å; E1180-E1183 PolarHBondContact O-N 3.25Å
1184	M	70.2	Confident	82.1	Confident	54 Å²	54	68.5 Å²	68.5	27%	0.266	34%	0.339	S	S	.	.	H	α-helix	trans	-113	-6.6	-170.8	-67.3	-72.4	-120.2	0	0	114.1	K1030 L1034 E1180 D1181 Q1182 I1186	K1030-M1184 HydrophobicContact CD-SD 4.35Å; K1030-M1184 WeakPolarHBondContact CE-SD 3.48Å; K1030-M1184 HydrophobicContact CG-CE 3.86Å; K1030-M1184 HydrophobicContact CG-SD 4.26Å; L1034-M1184 HydrophobicContact CD1-CE 4.31Å; L1034-M1184 HydrophobicContact CD1-SD 4.26Å; L1034-M1184 HydrophobicContact CD2-CB 3.98Å; L1034-M1184 HydrophobicContact CD2-CE 3.68Å; L1034-M1184 HydrophobicContact CD2-CG 4.26Å; L1034-M1184 HydrophobicContact CD2-SD 3.73Å; L1034-M1184 HydrophobicContact CG-CE 3.66Å; L1034-M1184 HydrophobicContact CG-SD 4.07Å; E1180-M1184 WeakPolarHBondContact O-CB 3.39Å; E1180-M1184 WeakPolarHBondContact O-CG 3.4Å; E1180-M1184 PolarHBondContact O-N 3.42Å; D1181-M1184 PolarHBondContact O-N 3.02Å; Q1182-M1184 PolarHBondContact O-N 3.43Å; M1184-I1186 VanDerWaalsContact C-N 3.28Å; M1184-I1186 HydrophobicContact CB-CD1 3.91Å; M1184-I1186 HydrophobicContact CB-CG1 3.65Å; M1184-I1186 PolarHBondContact O-N 3.46Å
1185	G	68.3	Low	81.7	Confident	45 Å²	45	73.4 Å²	73.4	46%	0.464	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	55.7	39.1	176.8	0	0	0	0	0	113.5	D1181 D1187	D1181-G1185 PolarHBondContact O-N 3.4Å; D1181-G1185 VanDerWaalsContact O-N 3.09Å; G1185-D1187 PolarHBondContact O-N 3.43Å
1186	I	67.9	Low	81.4	Confident	21 Å²	21	69.6 Å²	69.6	11%	0.108	35%	0.349	C	S	.	.			trans	-82.2	61	-175.5	-45.1	-175.6	0	0	0	110.5	L1034 E1037 R1038 M1184 I1188	L1034-I1186 HydrophobicContact CD2-CD1 4.05Å; L1034-I1186 HydrophobicContact CD2-CG1 4.25Å; E1037-I1186 HydrophobicContact CG-CD1 4.11Å; R1038-I1186 HydrophobicContact CB-CG2 4.46Å; R1038-I1186 HydrophobicContact CG-CG2 4.44Å; M1184-I1186 VanDerWaalsContact C-N 3.28Å; M1184-I1186 HydrophobicContact CB-CD1 3.91Å; M1184-I1186 HydrophobicContact CB-CG1 3.65Å; M1184-I1186 PolarHBondContact O-N 3.46Å; I1186-I1188 PolarHBondContact O-N 3.42Å
1187	D	65.3	Low	81.3	Confident	137 Å²	137	65.8 Å²	65.8	73%	0.733	33%	0.331	S	S	*	.	P	Polyproline II helix	trans	-68.4	120	175.7	-85	-48.3	0	0	0	111.6	G1185	G1185-D1187 PolarHBondContact O-N 3.43Å
1188	I	75.2	Confident	81.4	Confident	11 Å²	11	66.8 Å²	66.8	6%	0.056	34%	0.343	C	S	.	.	P	Polyproline II helix	trans	-87.6	124.2	168.6	-68.2	158.6	0	0	0	107.4	R1041 I1045 S1068 I1186 D1190 Q1192 R1193	R1041-I1188 HydrophobicContact CB-CD1 4.32Å; I1045-I1188 HydrophobicContact CD1-CB 4.32Å; I1045-I1188 HydrophobicContact CD1-CD1 3.83Å; I1045-I1188 HydrophobicContact CD1-CG1 3.99Å; I1045-I1188 HydrophobicContact CD1-CG2 3.38Å; I1045-I1188 HydrophobicContact CG1-CD1 4.06Å; I1045-I1188 HydrophobicContact CG1-CG2 4.28Å; S1068-I1188 VanDerWaalsContact OG-CD1 3.25Å; S1068-I1188 WeakPolarHBondContact OG-CD1 3.23Å; I1186-I1188 PolarHBondContact O-N 3.42Å; I1188-D1190 PolarHBondContact O-N 2.87Å; I1188-Q1192 HydrophobicContact CG2-CB 4.31Å; I1188-R1193 HydrophobicContact CG2-CG 3.8Å; I1188-R1193 PolarHBondContact O-NE 3.4Å; I1188-R1193 PolarHBondContact O-NH2 2.9Å
1189	S	80.5	Confident	81.3	Confident	64 Å²	64	69.1 Å²	69.1	45%	0.448	36%	0.356	S	S	.	.	P	Polyproline II helix	trans	-62.1	136.5	-177.8	179.2	0	0	0	0	111.4	E1191 Q1192 R1193	S1189-E1191 PolarHBondContact O-N 3.25Å; S1189-E1191 VanDerWaalsContact O-N 3.14Å; S1189-E1191 PolarHBondContact OG-N 3.15Å; S1189-Q1192 VanDerWaalsContact N-OE1 3.12Å; S1189-Q1192 WeakPolarHBondContact O-CA 3.01Å; S1189-Q1192 WeakPolarHBondContact O-CB 3.21Å; S1189-Q1192 PolarHBondContact O-N 2.8Å; S1189-R1193 PolarHBondContact O-N 3.07Å; S1189-R1193 VanDerWaalsContact O-N 3.12Å
1190	D	81.2	Confident	81.3	Confident	90 Å²	90	64.8 Å²	64.8	48%	0.481	34%	0.339	S	S	.	.	H	α-helix	trans	-48.3	-37.7	172.9	-110.2	27.6	0	0	0	113.8	I1188 R1193 K1194	I1188-D1190 PolarHBondContact O-N 2.87Å; D1190-R1193 PolarHBondContact O-N 2.97Å; D1190-K1194 WeakPolarHBondContact O-CB 3.38Å; D1190-K1194 WeakPolarHBondContact O-CD 3.4Å; D1190-K1194 WeakPolarHBondContact O-CG 3.35Å; D1190-K1194 PolarHBondContact O-N 3.34Å; D1190-K1194 IonicContact OD2-NZ 3.5Å; D1190-K1194 PolarHBondContact OD2-NZ 3.47Å
1191	E	82.8	Confident	81.5	Confident	115 Å²	115	68.4 Å²	68.4	54%	0.537	35%	0.35	S	S	.	.	H	α-helix	trans	-67.8	-36.8	177.5	-176.6	53.2	-149.7	0	0	111.5	S1189 Q1195	S1189-E1191 PolarHBondContact O-N 3.25Å; S1189-E1191 VanDerWaalsContact O-N 3.14Å; S1189-E1191 PolarHBondContact OG-N 3.15Å; E1191-Q1195 WeakPolarHBondContact O-CB 3.45Å; E1191-Q1195 PolarHBondContact O-N 3.24Å
1192	Q	83.7	Confident	81.7	Confident	81 Å²	81	75 Å²	75	38%	0.379	37%	0.373	S	S	.	.	H	α-helix	trans	-65.9	-41.3	174.3	-63.7	170.5	-41.8	0	0	111.2	I1188 S1189 Q1195 A1196	I1188-Q1192 HydrophobicContact CG2-CB 4.31Å; S1189-Q1192 VanDerWaalsContact N-OE1 3.12Å; S1189-Q1192 WeakPolarHBondContact O-CA 3.01Å; S1189-Q1192 WeakPolarHBondContact O-CB 3.21Å; S1189-Q1192 PolarHBondContact O-N 2.8Å; Q1192-Q1195 PolarHBondContact O-N 3.1Å; Q1192-A1196 WeakPolarHBondContact O-CB 3.48Å; Q1192-A1196 PolarHBondContact O-N 2.72Å
1193	R	86.7	Confident	80.9	Confident	51 Å²	51	72.4 Å²	72.4	19%	0.192	37%	0.369	C	S	.	.	H	α-helix	trans	-60.9	-52.1	176.1	-57.1	169.2	-169.3	-137.9	19.7	110.7	L1064 E1065 I1188 S1189 D1190 Q1195 A1196 I1197	L1064-R1193 HydrophobicContact CB-CB 4.29Å; L1064-R1193 HydrophobicContact CB-CG 4.47Å; L1064-R1193 VanDerWaalsContact O-CD 3.25Å; L1064-R1193 WeakPolarHBondContact O-CD 3.24Å; L1064-R1193 PolarHBondContact O-NH1 2.94Å; E1065-R1193 PolarHBondContact O-NH1 3.42Å; I1188-R1193 HydrophobicContact CG2-CG 3.8Å; I1188-R1193 PolarHBondContact O-NE 3.4Å; I1188-R1193 PolarHBondContact O-NH2 2.9Å; S1189-R1193 PolarHBondContact O-N 3.07Å; S1189-R1193 VanDerWaalsContact O-N 3.12Å; D1190-R1193 PolarHBondContact O-N 2.97Å; R1193-Q1195 PolarHBondContact O-N 2.77Å; R1193-A1196 PolarHBondContact O-N 3.1Å; R1193-I1197 WeakPolarHBondContact O-CG1 3.31Å; R1193-I1197 PolarHBondContact O-N 2.96Å; R1193-I1197 VanDerWaalsContact O-N 3.13Å
1194	K	87.3	Confident	79.8	Confident	120 Å²	120	75.1 Å²	75.1	52%	0.522	38%	0.379	S	S	.	.	H	α-helix	trans	-61.1	-43.6	178.3	-69.7	161.1	-165.5	164	0	111.4	D1190 I1197 A1198	D1190-K1194 WeakPolarHBondContact O-CB 3.38Å; D1190-K1194 WeakPolarHBondContact O-CD 3.4Å; D1190-K1194 WeakPolarHBondContact O-CG 3.35Å; D1190-K1194 PolarHBondContact O-N 3.34Å; D1190-K1194 IonicContact OD2-NZ 3.5Å; D1190-K1194 PolarHBondContact OD2-NZ 3.47Å; K1194-I1197 PolarHBondContact O-N 2.69Å; K1194-A1198 WeakPolarHBondContact O-CB 3.35Å; K1194-A1198 PolarHBondContact O-N 3.47Å
1195	Q	86.8	Confident	78.5	Confident	103 Å²	103	80 Å²	80	48%	0.481	40%	0.401	S	S	.	.	H	α-helix	trans	-66.9	-41.2	179.5	-173.9	175.6	109.3	0	0	112.8	E1191 Q1192 R1193 A1198 N1199	E1191-Q1195 WeakPolarHBondContact O-CB 3.45Å; E1191-Q1195 PolarHBondContact O-N 3.24Å; Q1192-Q1195 PolarHBondContact O-N 3.1Å; R1193-Q1195 PolarHBondContact O-N 2.77Å; Q1195-A1198 PolarHBondContact O-N 2.9Å; Q1195-N1199 VanDerWaalsContact O-CB 3.31Å; Q1195-N1199 WeakPolarHBondContact O-CB 3.44Å; Q1195-N1199 PolarHBondContact O-N 3.27Å; Q1195-N1199 PolarHBondContact O-ND2 2.91Å
1196	A	87.7	Confident	77.3	Confident	5 Å²	5	80.8 Å²	80.8	4%	0.041	41%	0.408	C	S	.	.	H	α-helix	trans	-63.8	-45.4	175.9	0	0	0	0	0	111.8	I1045 A1049 L1064 Q1192 R1193 A1198 N1199 A1200	I1045-A1196 HydrophobicContact CG2-CB 3.5Å; A1049-A1196 HydrophobicContact CB-CB 4.08Å; L1064-A1196 HydrophobicContact CD1-CB 4.3Å; Q1192-A1196 WeakPolarHBondContact O-CB 3.48Å; Q1192-A1196 PolarHBondContact O-N 2.72Å; R1193-A1196 PolarHBondContact O-N 3.1Å; A1196-A1198 PolarHBondContact O-N 2.77Å; A1196-N1199 PolarHBondContact O-N 2.93Å; A1196-A1200 WeakPolarHBondContact O-CB 3.46Å; A1196-A1200 PolarHBondContact O-N 3.26Å
1197	I	89.4	Confident	75.9	Confident	8 Å²	8	89.5 Å²	89.5	4%	0.041	45%	0.445	C	S	.	.	H	α-helix	trans	-59.5	-45.2	173	-69.9	-67.7	0	0	0	111.2	A1049 D1062 L1064 R1193 K1194 N1199 A1200 R1201	A1049-I1197 HydrophobicContact CB-CD1 3.96Å; A1049-I1197 HydrophobicContact CB-CG1 4.48Å; D1062-I1197 HydrophobicContact CB-CD1 4.14Å; D1062-I1197 HydrophobicContact CB-CG1 4.45Å; L1064-I1197 HydrophobicContact CD1-CD1 4.05Å; L1064-I1197 HydrophobicContact CD1-CG1 4.01Å; R1193-I1197 WeakPolarHBondContact O-CG1 3.31Å; R1193-I1197 PolarHBondContact O-N 2.96Å; R1193-I1197 VanDerWaalsContact O-N 3.13Å; K1194-I1197 PolarHBondContact O-N 2.69Å; I1197-N1199 PolarHBondContact O-N 2.69Å; I1197-A1200 PolarHBondContact O-N 2.94Å; I1197-R1201 HydrophobicContact CG2-CG 4.41Å; I1197-R1201 WeakPolarHBondContact O-CB 3.44Å; I1197-R1201 VanDerWaalsContact O-CG 3.31Å; I1197-R1201 WeakPolarHBondContact O-CG 3.49Å; I1197-R1201 PolarHBondContact O-N 3.02Å
1198	A	88.7	Confident	74.8	Confident	41 Å²	41	90.1 Å²	90.1	34%	0.339	45%	0.447	S	S	.	.	H	α-helix	trans	-62.8	-40	176.2	0	0	0	0	0	112.1	K1194 Q1195 A1196 R1201 R1202	K1194-A1198 WeakPolarHBondContact O-CB 3.35Å; K1194-A1198 PolarHBondContact O-N 3.47Å; Q1195-A1198 PolarHBondContact O-N 2.9Å; A1196-A1198 PolarHBondContact O-N 2.77Å; A1198-R1201 PolarHBondContact O-N 2.79Å; A1198-R1202 VanDerWaalsContact O-CG 3.24Å; A1198-R1202 WeakPolarHBondContact O-CG 3.24Å; A1198-R1202 PolarHBondContact O-N 2.89Å
1199	N	88.3	Confident	72.8	Confident	54 Å²	54	98.6 Å²	98.6	29%	0.289	48%	0.484	S	S	.	.	H	α-helix	trans	-66.1	-38	176	-76.6	-24.2	0	0	0	112.8	Q1195 A1196 I1197 R1202	Q1195-N1199 VanDerWaalsContact O-CB 3.31Å; Q1195-N1199 WeakPolarHBondContact O-CB 3.44Å; Q1195-N1199 PolarHBondContact O-N 3.27Å; Q1195-N1199 PolarHBondContact O-ND2 2.91Å; A1196-N1199 PolarHBondContact O-N 2.93Å; I1197-N1199 PolarHBondContact O-N 2.69Å; N1199-R1202 PolarHBondContact OD1-NH1 2.89Å
1200	A	88.8	Confident	70.4	Confident	13 Å²	13	102.1 Å²	102.1	11%	0.107	50%	0.503	C	S	.	.	H	α-helix	trans	-70.3	-38.4	174.1	0	0	0	0	0	112.7	A1049 V1053 A1196 I1197	A1049-A1200 VanDerWaalsContact C-CB 3.47Å; A1049-A1200 HydrophobicContact CB-CB 3.79Å; A1049-A1200 WeakPolarHBondContact O-CB 3.39Å; V1053-A1200 HydrophobicContact CB-CB 4.38Å; V1053-A1200 HydrophobicContact CG2-CB 3.86Å; A1196-A1200 WeakPolarHBondContact O-CB 3.46Å; A1196-A1200 PolarHBondContact O-N 3.26Å; I1197-A1200 PolarHBondContact O-N 2.94Å
1201	R	88.8	Confident	68	Low	140 Å²	140	103.8 Å²	103.8	53%	0.528	52%	0.516	S	S	.	.	H	α-helix	trans	-74.1	-24	177.1	-70.5	178.3	-175.2	156	10.8	113.2	V1053 D1062 I1197 A1198 P1203	V1053-R1201 HydrophobicContact CG1-CG 4.47Å; V1053-R1201 HydrophobicContact CG2-CG 3.61Å; D1062-R1201 IonicContact OD1-NH2 3.38Å; D1062-R1201 PolarHBondContact OD1-NH2 2.82Å; D1062-R1201 IonicContact OD2-CZ 3.2Å; D1062-R1201 IonicContact OD2-NH1 2.67Å; D1062-R1201 IonicContact OD2-NH2 3.57Å; D1062-R1201 PolarHBondContact OD2-NH2 3.43Å; I1197-R1201 HydrophobicContact CG2-CG 4.41Å; I1197-R1201 WeakPolarHBondContact O-CB 3.44Å; I1197-R1201 VanDerWaalsContact O-CG 3.31Å; I1197-R1201 WeakPolarHBondContact O-CG 3.49Å; I1197-R1201 PolarHBondContact O-N 3.02Å; A1198-R1201 PolarHBondContact O-N 2.79Å; R1201-P1203 WeakPolarHBondContact O-CD 3.5Å
1202	R	86.5	Confident	65.4	Low	162 Å²	162	101.3 Å²	101.3	61%	0.611	52%	0.521	S	S	*	.	S	Bend	trans	-60.3	119.7	175.2	-84.6	164.8	-178.5	171.2	-4.1	110	A1198 N1199 K1204	A1198-R1202 VanDerWaalsContact O-CG 3.24Å; A1198-R1202 WeakPolarHBondContact O-CG 3.24Å; A1198-R1202 PolarHBondContact O-N 2.89Å; N1199-R1202 PolarHBondContact OD1-NH1 2.89Å; R1202-K1204 PolarHBondContact O-N 3.45Å
1203	P	66.6	Low	62.8	Low	89 Å²	89	108.6 Å²	108.6	58%	0.578	55%	0.547	S	S	*	.			trans	-61.2	135.3	176.6	26.4	-34	0	0	0	109.2	R1201 H1205	R1201-P1203 WeakPolarHBondContact O-CD 3.5Å; P1203-H1205 PolarHBondContact O-N 3.07Å
1204	K	56.1	Low	60.1	Low	173 Å²	173	109.8 Å²	109.8	75%	0.752	57%	0.568	S	S	*	*			trans	-72.4	74.5	172.9	-74.4	173	-177.8	162.6	0	109.3	H1050 R1202 G1206	H1050-K1204 PolarHBondContact NE2-NZ 2.87Å; R1202-K1204 PolarHBondContact O-N 3.45Å; K1204-G1206 PolarHBondContact O-N 2.82Å
1205	H	43.2	Very low	57.1	Low	158 Å²	158	111.4 Å²	111.4	73%	0.731	58%	0.582	S	S	*	*			trans	-52.6	106.3	162.1	-69.7	-20.1	0	0	0	107.3	P1203 K1207	P1203-H1205 PolarHBondContact O-N 3.07Å; H1205-K1207 PolarHBondContact O-N 2.92Å
1206	G	41.6	Very low	54.3	Low	60 Å²	60	111.8 Å²	111.8	62%	0.619	60%	0.596	S	S	*	*			trans	-55.4	131.1	170.3	0	0	0	0	0	107.8	K1204 I1208	K1204-G1206 PolarHBondContact O-N 2.82Å; G1206-I1208 PolarHBondContact O-N 2.7Å
1207	K	39.7	Very low	51.5	Low	204 Å²	204	118 Å²	118	89%	0.887	63%	0.633	S	S	*	*			trans	-72.9	64.8	-179.5	-68.3	-172.9	177.6	-176.8	0	110.9	H1205 K1209	H1205-K1207 PolarHBondContact O-N 2.92Å; K1207-K1209 PolarHBondContact O-N 3.45Å; K1207-K1209 VanDerWaalsContact O-N 3.13Å
1208	I	41.5	Very low	48.9	Very low	150 Å²	150	123.2 Å²	123.2	77%	0.769	67%	0.667	S	S	*	*			trans	-61.4	108.7	158.6	-59.2	176.5	0	0	0	104.9	G1206 T1210	G1206-I1208 PolarHBondContact O-N 2.7Å; I1208-T1210 PolarHBondContact O-N 3.3Å
1209	K	33.9	Very low	46.3	Very low	189 Å²	189	126.9 Å²	126.9	82%	0.822	69%	0.688	S	S	*	*			trans	-71.6	108.1	173.2	-70.8	-177.1	176.7	-177.1	0	107.6	K1207 V1211	K1207-K1209 PolarHBondContact O-N 3.45Å; K1207-K1209 VanDerWaalsContact O-N 3.13Å; K1209-V1211 PolarHBondContact O-N 2.94Å
1210	T	28.7	Very low	43.7	Very low	139 Å²	139	133 Å²	133	85%	0.853	71%	0.714	S	S	*	*			trans	-64.8	116.4	170.6	-50.3	0	0	0	0	109.3	I1208	I1208-T1210 PolarHBondContact O-N 3.3Å
1211	V	30.4	Very low	40.9	Very low	125 Å²	125	140.8 Å²	140.8	76%	0.758	75%	0.749	S	S	*	*			trans	-126.9	129.5	163.8	-178.7	0	0	0	0	104.9	K1209	K1209-V1211 PolarHBondContact O-N 2.94Å
1212	G	29	Very low	38.1	Very low	62 Å²	62	142.1 Å²	142.1	64%	0.639	77%	0.766	S	S	*	*			trans	-62	154.8	173.5	0	0	0	0	0	110.9
1213	Y	30	Very low	35.5	Very low	234 Å²	234	141.6 Å²	141.6	92%	0.918	77%	0.774	S	S	*	*			cis	-144.4	-177.2	37.9	-136.3	-108.4	0	0	0	112.2
1214	A	28.3	Very low	33.7	Very low	77 Å²	77	142.3 Å²	142.3	64%	0.636	78%	0.779	S	S	*	*			trans	-64.4	167.2	167.3	0	0	0	0	0	111.3
1215	D	24.6	Very low	32.6	Very low	153 Å²	153	140.4 Å²	140.4	82%	0.818	78%	0.784	S	S	*	*			cis	-158.6	-177.4	27.1	-152.5	-16.7	0	0	0	112.9
1216	S	28.6	Very low	32	Very low	111 Å²	111	140.8 Å²	140.8	78%	0.776	79%	0.791	S	S	*	*			trans	87.6	148.7	169.6	79.6	0	0	0	0	120.2
1217	V	28.4	Very low	31.6	Very low	137 Å²	137	146.5 Å²	146.5	83%	0.83	80%	0.802	S	S	*	*			trans	-152.2	148.3	-170.6	167.4	0	0	0	0	105
1218	P	36.1	Very low	31.4	Very low	116 Å²	116	141.3 Å²	141.3	75%	0.753	78%	0.78	S	S	*	*			cis	-130.2	-158	28.9	20.4	8.7	0	0	0	112.3
1219	P	34.3	Very low	31.2	Very low	118 Å²	118	144.8 Å²	144.8	77%	0.766	78%	0.784	S	S	*	*			cis	-127.4	-179.2	-1.8	42.1	-25.4	0	0	0	116.2
1220	H	31.8	Very low	31.2	Very low	183 Å²	183	143.2 Å²	143.2	85%	0.847	78%	0.779	S	S	*	*			trans	-60.8	139.6	-177.9	-60.9	-87.1	0	0	0	115.3
1221	Q	30.1	Very low	31.9	Very low	177 Å²	177	138.3 Å²	138.3	83%	0.827	75%	0.747	S	S	*	*			trans	-129.5	133.7	147.9	-69.6	-168.3	-1.1	0	0	109.8	L1223	Q1221-L1223 PolarHBondContact O-N 3.35Å
1222	N	30.2	Very low	32.3	Very low	167 Å²	167	137.3 Å²	137.3	89%	0.893	74%	0.742	S	S	*	*			trans	-81.9	114.2	172.1	-74	-65.5	0	0	0	109.3
1223	L	31.7	Very low	32.9	Very low	151 Å²	151	134.9 Å²	134.9	79%	0.791	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-102	140.9	166.1	-74.6	168.6	0	0	0	109.6	Q1221	Q1221-L1223 PolarHBondContact O-N 3.35Å
1224	P	28.7	Very low	33.1	Very low	104 Å²	104	127.3 Å²	127.3	68%	0.675	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-72.2	154.9	-176.9	30.5	-35.6	0	0	0	111.9	L1226	P1224-L1226 PolarHBondContact O-N 2.75Å
1225	P	33.7	Very low	33.7	Very low	133 Å²	133	124.9 Å²	124.9	86%	0.864	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-56.7	128.1	175.1	-25.2	35	0	0	0	112.3
1226	L	30.2	Very low	34.4	Very low	166 Å²	166	119 Å²	119	87%	0.869	64%	0.642	S	S	*	*	P	Polyproline II helix	trans	-66.5	133.2	-179.9	-82.6	158.1	0	0	0	111.8	P1224 Q1228	P1224-L1226 PolarHBondContact O-N 2.75Å; L1226-Q1228 PolarHBondContact O-N 3.3Å; L1226-Q1228 VanDerWaalsContact O-N 3.13Å
1227	Q	34.5	Very low	34.6	Very low	181 Å²	181	117.4 Å²	117.4	85%	0.846	63%	0.627	S	S	*	*			trans	-6	93.8	170.4	-67.5	175	-27	0	0	116.2	R1229	Q1227-R1229 PolarHBondContact O-N 2.89Å
1228	Q	34.4	Very low	34.5	Very low	94 Å²	94	115 Å²	115	44%	0.439	61%	0.614	S	S	.	*	P	Polyproline II helix	trans	-63.6	122.6	159.8	-170.2	166	-63.1	0	0	108.1	R1106 D1108 L1226	R1106-Q1228 VanDerWaalsContact CZ-NE2 3.3Å; R1106-Q1228 VanDerWaalsContact NH1-CD 3.26Å; D1108-Q1228 PolarHBondContact OD2-NE2 2.85Å; L1226-Q1228 PolarHBondContact O-N 3.3Å; L1226-Q1228 VanDerWaalsContact O-N 3.13Å
1229	R	37.3	Very low	34.2	Very low	224 Å²	224	117 Å²	117	85%	0.845	61%	0.613	S	S	*	*	P	Polyproline II helix	trans	-74.7	143.7	-178.2	-64.5	-177.8	178.4	-169.8	-2.3	109.8	Q1227 I1231	Q1227-R1229 PolarHBondContact O-N 2.89Å; R1229-I1231 PolarHBondContact O-N 3.13Å
1230	H	34.2	Very low	33.8	Very low	155 Å²	155	116.8 Å²	116.8	72%	0.718	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-55.1	125	173.8	-83.3	-138.4	0	0	0	110.4	T1232	H1230-T1232 PolarHBondContact O-N 2.73Å
1231	I	43.8	Very low	33.4	Very low	36 Å²	36	114.7 Å²	114.7	19%	0.185	59%	0.593	C	S	.	*			trans	-75.1	97.7	170.7	-53.5	178.1	0	0	0	107.9	A1054 D1108 L1110 R1229	A1054-I1231 HydrophobicContact CB-CD1 3.71Å; A1054-I1231 HydrophobicContact CB-CG1 4.28Å; A1054-I1231 VanDerWaalsContact O-CD1 3.29Å; A1054-I1231 WeakPolarHBondContact O-CD1 3.29Å; D1108-I1231 VanDerWaalsContact O-CB 3.24Å; D1108-I1231 WeakPolarHBondContact O-CB 3.4Å; D1108-I1231 VanDerWaalsContact O-CD1 3.27Å; D1108-I1231 WeakPolarHBondContact O-CD1 3.17Å; D1108-I1231 WeakPolarHBondContact O-CG1 3.27Å; L1110-I1231 HydrophobicContact CD1-CB 4.42Å; L1110-I1231 HydrophobicContact CD1-CG2 3.91Å; R1229-I1231 PolarHBondContact O-N 3.13Å
1232	T	38.9	Very low	33.2	Very low	105 Å²	105	110 Å²	110	64%	0.644	58%	0.576	S	S	*	*			trans	-138	107.1	167.4	-58.9	0	0	0	0	105.2	H1230	H1230-T1232 PolarHBondContact O-N 2.73Å
1233	I	42.1	Very low	33	Very low	11 Å²	11	108.7 Å²	108.7	6%	0.056	56%	0.563	C	S	.	*	P	Polyproline II helix	trans	-62	134.1	155.3	-30	-168.2	0	0	0	104.8	T1047 W1051 L1070 F1093 T1235	T1047-I1233 HydrophobicContact CG2-CG2 3.71Å; W1051-I1233 HydrophobicContact CB-CD1 3.63Å; W1051-I1233 HydrophobicContact CB-CG1 3.8Å; W1051-I1233 HydrophobicContact CD2-CD1 3.43Å; W1051-I1233 VanDerWaalsContact CD2-CD1 3.43Å; W1051-I1233 HydrophobicContact CD2-CG1 4.05Å; W1051-I1233 HydrophobicContact CE3-CD1 4.06Å; W1051-I1233 HydrophobicContact CG-CD1 3.24Å; W1051-I1233 HydrophobicContact CG-CG1 3.42Å; W1051-I1233 VanDerWaalsContact CG-CG1 3.42Å; L1070-I1233 HydrophobicContact CB-CD1 4.46Å; L1070-I1233 HydrophobicContact CD1-CD1 4.49Å; L1070-I1233 HydrophobicContact CD2-CB 3.65Å; L1070-I1233 HydrophobicContact CD2-CD1 3.83Å; L1070-I1233 HydrophobicContact CD2-CG1 4.05Å; L1070-I1233 HydrophobicContact CD2-CG2 4.06Å; L1070-I1233 HydrophobicContact CG-CD1 4.47Å; F1093-I1233 HydrophobicContact CE1-CD1 4.33Å; F1093-I1233 HydrophobicContact CZ-CD1 4.22Å; I1233-T1235 PolarHBondContact O-N 3.13Å
1234	P	33.9	Very low	32.6	Very low	74 Å²	74	105.7 Å²	105.7	48%	0.481	56%	0.555	S	S	.	*	P	Polyproline II helix	trans	-53.5	126.6	151.5	26.5	-33.4	0	0	0	107.5	P1238	P1234-P1238 HydrophobicContact CB-CG 4.4Å
1235	T	40	Very low	32.5	Very low	27 Å²	27	108.3 Å²	108.3	17%	0.166	56%	0.562	C	S	.	*	P	Polyproline II helix	trans	-49.7	158.1	154.6	40.8	0	0	0	0	109.4	L1070 S1073 I1233 V1237 P1238	L1070-T1235 HydrophobicContact CD2-CG2 4.14Å; S1073-T1235 VanDerWaalsContact OG-CG2 3.28Å; S1073-T1235 WeakPolarHBondContact OG-CG2 3.5Å; I1233-T1235 PolarHBondContact O-N 3.13Å; T1235-V1237 CarbonylContact O-C 3.6Å; T1235-V1237 WeakPolarHBondContact O-CA 3.45Å; T1235-V1237 PolarHBondContact O-N 3.25Å; T1235-V1237 PolarHBondContact OG1-O 3.19Å; T1235-P1238 WeakPolarHBondContact O-CD 3.24Å; T1235-P1238 VanDerWaalsContact O-N 3.09Å
1236	S	39.2	Very low	32.1	Very low	29 Å²	29	106.3 Å²	106.3	20%	0.203	56%	0.557	C	S	.	*	S	Bend	trans	-53.3	-9.6	172.8	64	0	0	0	0	114	L1070 I1071 K1173 P1238	L1070-S1236 WeakPolarHBondContact O-CA 3.29Å; L1070-S1236 WeakPolarHBondContact O-CB 3.41Å; L1070-S1236 PolarHBondContact O-N 3.18Å; L1070-S1236 PolarHBondContact O-OG 3.31Å; I1071-S1236 PolarHBondContact O-OG 3.43Å; K1173-S1236 PolarHBondContact NZ-OG 2.72Å; S1236-P1238 VanDerWaalsContact C-CD 3.42Å; S1236-P1238 WeakPolarHBondContact O-CD 3.39Å
1237	V	33.6	Very low	32	Very low	77 Å²	77	107.3 Å²	107.3	47%	0.467	56%	0.557	S	S	.	*			trans	-99.9	88.9	154.6	-173	0	0	0	0	110.4	T1235 Q1239	T1235-V1237 CarbonylContact O-C 3.6Å; T1235-V1237 WeakPolarHBondContact O-CA 3.45Å; T1235-V1237 PolarHBondContact O-N 3.25Å; T1235-V1237 PolarHBondContact OG1-O 3.19Å; V1237-Q1239 HydrophobicContact CG1-CB 4.07Å; V1237-Q1239 HydrophobicContact CG1-CG 3.9Å
1238	P	25.6	Very low	31.7	Very low	87 Å²	87	104.2 Å²	104.2	57%	0.565	55%	0.553	S	S	*	*				-75.2	114.1	113.9	32.4	-17.6	0	0	0	106.8	P1234 T1235 S1236 Q1240	P1234-P1238 HydrophobicContact CB-CG 4.4Å; T1235-P1238 WeakPolarHBondContact O-CD 3.24Å; T1235-P1238 VanDerWaalsContact O-N 3.09Å; S1236-P1238 VanDerWaalsContact C-CD 3.42Å; S1236-P1238 WeakPolarHBondContact O-CD 3.39Å; P1238-Q1240 PolarHBondContact O-N 2.8Å
1239	Q	29.2	Very low	31.3	Very low	157 Å²	157	105.6 Å²	105.6	73%	0.734	57%	0.57	S	S	*	*			trans	-68.2	91.9	157.9	-105.1	170.4	-11.1	0	0	106.8	V1237 Q1241	V1237-Q1239 HydrophobicContact CG1-CB 4.07Å; V1237-Q1239 HydrophobicContact CG1-CG 3.9Å; Q1239-Q1241 PolarHBondContact O-N 3.49Å
1240	Q	27.4	Very low	30.9	Very low	115 Å²	115	106.8 Å²	106.8	54%	0.537	57%	0.574	S	S	.	*				-50.1	127.4	126.2	-91.2	179.6	-72.9	0	0	105.1	S150 P1238 V1242	S150-Q1240 PolarHBondContact O-NE2 2.86Å; P1238-Q1240 PolarHBondContact O-N 2.8Å; Q1240-V1242 PolarHBondContact O-N 2.79Å
1241	Q	22.7	Very low	30.6	Very low	139 Å²	139	111.1 Å²	111.1	65%	0.65	58%	0.584	S	S	*	*			trans	-64.9	104.6	-179.9	-70.1	176.3	-91.2	0	0	107.6	Q1239 F1243	Q1239-Q1241 PolarHBondContact O-N 3.49Å; Q1241-F1243 VanDerWaalsContact C-N 3.28Å; Q1241-F1243 HydrophobicContact CB-CD2 4.28Å; Q1241-F1243 HydrophobicContact CB-CE2 4.21Å; Q1241-F1243 HydrophobicContact CB-CZ 4.47Å; Q1241-F1243 WeakPolarHBondContact O-CD2 3.48Å; Q1241-F1243 PolarHBondContact O-N 3.08Å
1242	V	26	Very low	29.8	Very low	77 Å²	77	118.6 Å²	118.6	47%	0.467	62%	0.615	S	S	.	*			trans	-53.6	106.8	147.3	177.8	0	0	0	0	104.2	Q154 Q1240 S1244	Q154-V1242 VanDerWaalsContact CD-CG2 3.44Å; Q154-V1242 HydrophobicContact CG-CG2 4.15Å; Q1240-V1242 PolarHBondContact O-N 2.79Å; V1242-S1244 PolarHBondContact O-N 3.14Å
1243	F	24.7	Very low	29.2	Very low	140 Å²	140	119.3 Å²	119.3	61%	0.614	62%	0.622	S	S	*	*			trans	-71.9	72.8	-177.4	-84	-88.4	0	0	0	109.8	Q1241 L1245	Q1241-F1243 VanDerWaalsContact C-N 3.28Å; Q1241-F1243 HydrophobicContact CB-CD2 4.28Å; Q1241-F1243 HydrophobicContact CB-CE2 4.21Å; Q1241-F1243 HydrophobicContact CB-CZ 4.47Å; Q1241-F1243 WeakPolarHBondContact O-CD2 3.48Å; Q1241-F1243 PolarHBondContact O-N 3.08Å; F1243-L1245 PolarHBondContact O-N 3.46Å
1244	S	24.1	Very low	28.5	Very low	89 Å²	89	128.6 Å²	128.6	62%	0.622	66%	0.657	S	S	*	*			trans	-64.1	109.1	157.5	-67.3	0	0	0	0	107.1	V1242 A1246	V1242-S1244 PolarHBondContact O-N 3.14Å; S1244-A1246 PolarHBondContact O-N 2.75Å; S1244-A1246 VanDerWaalsContact O-N 3.14Å
1245	L	26.5	Very low	28.3	Very low	159 Å²	159	132.8 Å²	132.8	83%	0.832	67%	0.671	S	S	*	*			trans	-64.4	112.8	-177.2	-74.9	165.5	0	0	0	110.9	F1243	F1243-L1245 PolarHBondContact O-N 3.46Å
1246	A	26.5	Very low	27.5	Very low	91 Å²	91	139.1 Å²	139.1	75%	0.752	70%	0.703	S	S	*	*			trans	-148.2	138.2	161.3	0	0	0	0	0	107	S1244	S1244-A1246 PolarHBondContact O-N 2.75Å; S1244-A1246 VanDerWaalsContact O-N 3.14Å
1247	E	26.3	Very low	26.8	Very low	187 Å²	187	144.8 Å²	144.8	87%	0.874	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-61.6	140.6	-167.1	-70.7	-175.1	88.6	0	0	114.7	P1249	E1247-P1249 WeakPolarHBondContact O-CD 3.41Å
1248	P	30.1	Very low	26.4	Very low	116 Å²	116	151.2 Å²	151.2	75%	0.753	75%	0.747	S	S	*	*	P	Polyproline II helix	trans	-83	122.6	173.6	31.9	-32.4	0	0	0	112.2	R1250	P1248-R1250 PolarHBondContact O-N 2.8Å
1249	P	25.5	Very low	26.3	Very low	123 Å²	123	151.3 Å²	151.3	80%	0.799	75%	0.75	S	S	*	*	P	Polyproline II helix	trans	-70.7	118.8	176.9	27.5	-33.8	0	0	0	111.9	E1247 R1251	E1247-P1249 WeakPolarHBondContact O-CD 3.41Å; P1249-R1251 PolarHBondContact O-N 2.73Å
1250	R	28.2	Very low	26.2	Very low	249 Å²	249	152.2 Å²	152.2	94%	0.94	76%	0.758	S	S	*	*	P	Polyproline II helix	trans	-50.2	119.6	-176.9	-67.7	176	172.4	171.3	-3.2	113.7	P1248	P1248-R1250 PolarHBondContact O-N 2.8Å
1251	R	27.9	Very low	26.1	Very low	245 Å²	245	152 Å²	152	93%	0.925	76%	0.764	S	S	*	*			trans	-136.7	144.7	160.9	-75.3	-167.2	170.8	-179.2	-0.9	111.9	P1249	P1249-R1251 PolarHBondContact O-N 2.73Å
1252	K	26.7	Very low	26.3	Very low	193 Å²	193	153.7 Å²	153.7	84%	0.839	77%	0.765	S	S	*	*			trans	-93.5	150.1	-171.5	-61.7	-176	179.1	-173.7	0	112.2
1253	P	27.8	Very low	26.3	Very low	121 Å²	121	155.7 Å²	155.7	79%	0.786	78%	0.782	S	S	*	*			trans	-80.5	157	178.3	33.9	-36.2	0	0	0	112.6
1254	Y	27.2	Very low	26.3	Very low	205 Å²	205	152.8 Å²	152.8	80%	0.804	78%	0.784	S	S	*	*			trans	-144.6	133.9	164.2	-92.3	-67.9	0	0	0	112.3
1255	H	27.9	Very low	26.6	Very low	163 Å²	163	156.8 Å²	156.8	76%	0.755	79%	0.791	S	S	*	*			trans	59	85	162.8	-63.5	-60.7	0	0	0	120.1
1256	L	24.9	Very low	26.6	Very low	160 Å²	160	156 Å²	156	84%	0.838	78%	0.781	S	S	*	*			trans	-60.6	121	140	-168.7	176.1	0	0	0	109.5
1257	L	24.5	Very low	26.4	Very low	148 Å²	148	162.9 Å²	162.9	78%	0.775	79%	0.787	S	S	*	*			trans	-169.9	102.3	154.6	-115.2	173.6	0	0	0	112.1
1258	Y	25	Very low	26.3	Very low	211 Å²	211	167.2 Å²	167.2	83%	0.827	80%	0.803	S	S	*	*				-170.1	158.9	126.2	-125.9	-95.7	0	0	0	111.9
1259	S	24.1	Very low	26.1	Very low	89 Å²	89	169.8 Å²	169.8	62%	0.622	81%	0.806	S	S	*	*			trans	69.8	64.3	168.6	-166.8	0	0	0	0	118.7
1260	I	26	Very low	26.1	Very low	177 Å²	177	172.2 Å²	172.2	91%	0.908	81%	0.806	S	S	*	*				-114	84.4	126.5	-59.2	-175.4	0	0	0	108.8
1261	T	25.6	Very low	26	Very low	109 Å²	109	167.9 Å²	167.9	67%	0.669	80%	0.799	S	S	*	*			trans	-141.1	132.2	159.9	54	0	0	0	0	105.4
1262	R	27.1	Very low	25.9	Very low	176 Å²	176	163.4 Å²	163.4	66%	0.664	79%	0.791	S	S	*	*			cis	-161.4	128.6	16.2	-171.2	-179.7	-176.6	-143.1	7.8	109.9
1263	S	25.9	Very low	25.8	Very low	118 Å²	118	161.6 Å²	161.6	83%	0.825	79%	0.788	S	S	*	*			trans	-142.9	45.4	168.2	62.6	0	0	0	0	112.9
1264	A	24.6	Very low	25.7	Very low	80 Å²	80	164.3 Å²	164.3	66%	0.661	79%	0.788	S	S	*	*	S	Bend	trans	-112.2	115.1	148.4	0	0	0	0	0	107.4
1265	F	29.3	Very low	25.6	Very low	173 Å²	173	161.4 Å²	161.4	76%	0.759	79%	0.787	S	S	*	*			trans	-102.3	150.3	177.8	-81.3	-113.2	0	0	0	108.4
1266	F	27.5	Very low	25.4	Very low	142 Å²	142	161.2 Å²	161.2	62%	0.623	79%	0.79	S	S	*	*			cis	-164.3	-177.8	-16.9	-138.3	-100.1	0	0	0	107.5
1267	R	22.8	Very low	25.4	Very low	236 Å²	236	161.3 Å²	161.3	89%	0.891	79%	0.786	S	S	*	*			trans	90	97.1	174.5	-59	-177.6	167.8	-173.8	-3.1	117.5
1268	K	22.9	Very low	25.5	Very low	277 Å²	277	162.5 Å²	162.5	100%	1.204	79%	0.787	S	S	*	*				-136.7	0	83.8	-133.2	172.8	-173.1	173.3	0	109.6

Retrieved 1,268 of 1,268 residues in 631 ms (Link to these results)

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