A0A077ZE99_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZE99, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 1,204 aa.

						>A0A077ZE99_TRITR|A0A077ZE99
MTTAVFANQPTASNGESQSFESQQEVYGNELTTGRQNEAMNDEGNVVVVTPNDTTDNAPTIEQTDTEERETYELPPTAKLYKKSDNGLMNWPAEAERGNNSWQEARRHSDIHAAMDNDESISAPAASIGRTTADESELDVFNEEHLTSEDRSADENEFLDESTLANVDMPEEEELNEGTEENGSQEQSSVIEDVFDQEEESDRQPKFNSEPTEEANAYMDVKLEYQTSNGTASQEAAQVHYEIDEQSFAPIADAGAATEMSDAEKPKDEAPYMDIQTHYEQETMSDVLDDGQPVRESEEAEEPRKSSIITSAHEEPLEQPPVSENDFTPDEQQIAQEESSLHEQSVQEEQKTAAEEEEEDTTEERSATMADIQREQVDEDEDEDKYHNYDAMSLKKTSIEKQLNEEESGSVFEEEEGGEEELEDAEESVRSQDMKEQPEEVRRESVQEVAETEKPIEEEQAPSVEEVPMRKPSETTSASVEMAKKISDATFANESNVPAEESSALGSRKGSDVSSATTLSKQESARRLSELSNVSEAGSTGLEEEPYRGSILKKKSSEPIVTPLAPGKIGVKKFSLPTQQLPGLRSGSSSRKSSDVTPVESPSRRESLRSLSKLGSTPEMGGMEEVSERDVEMSAEYSLPAGKKSFGRKASEPGQTVAKKLSQTDHAKSIDIPAGTSSRKGSNATPAESTPRRESLRRHSKLSFASDLEEKEQEALAEQSIETPADYTQPTEEVLDRKTSETIASPPLTPSQMGSKPVEAPMEESSALSSRKSSSAAAEETTSRRESLKSLSTDSAAAPEALAGLKEEVQIEPDEIATAAQYEPEQVTSPTIEQEQPRMMEQPPVGKFYKEIPVEEEKLVTPSEPSPAKKSIDATPASAELETPTAQLVENKMENAEELRLEDAEIPKTEVTDKQLKPSEESYKEEEEGRDVEATAFVPITPKKTPTEAPVKTREVQASTEYRQYYPLYESRTPATMSVSSMASSYSSDYSRPYNHYVSVFDSHVTTGPFSQNNYFALRRSVSRERMSSSLSRVGSFSRFDSYHDFLPYTASRSTAQIPVRSTSFSRFMDYYDRVKDRLKRTYSRESLYRPKETHATYLYSNIYQPSTTYSSVYQPSVPSLYGYNYNYSYGTPRRNVYRTYSQENVYTPSYRSYSYPTRTYGAFNKIYDYYTSVRNRYTQSSFLSPFRRIRSFYRPWKFDNSLF
					

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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	36.2	Very low	37.2	Very low	233 Å²	233	134.6 Å²	134.6	100%	1.148	78%	0.776	S	S	*	*				0	143.8	0	-76.8	174.3	164.1	0	0	108
2	T	38.9	Very low	36.9	Very low	121 Å²	121	131.1 Å²	131.1	74%	0.742	78%	0.775	S	S	*	*			trans	38.9	93.5	158.3	50.5	0	0	0	0	117.5
3	T	38.2	Very low	36.7	Very low	125 Å²	125	128.7 Å²	128.7	77%	0.767	77%	0.769	S	S	*	*				69.6	119.7	87.9	58.6	0	0	0	0	113.6
4	A	36.6	Very low	36.6	Very low	91 Å²	91	128.2 Å²	128.2	75%	0.752	76%	0.761	S	S	*	*				75.6	158.3	55	0	0	0	0	0	112.5
5	V	38.1	Very low	36.6	Very low	116 Å²	116	124.2 Å²	124.2	70%	0.703	76%	0.757	S	S	*	*			cis	-159.8	146.9	19.7	83.4	0	0	0	0	110.9
6	F	36.7	Very low	36.6	Very low	185 Å²	185	128.1 Å²	128.1	81%	0.811	76%	0.764	S	S	*	*			trans	42.3	177.6	137.3	-70.3	-120.3	0	0	0	119.9
7	A	37.3	Very low	36.5	Very low	86 Å²	86	126.5 Å²	126.5	71%	0.711	76%	0.76	S	S	*	*			cis	-167.4	169.4	32	0	0	0	0	0	110
8	N	34.7	Very low	36.5	Very low	117 Å²	117	129.2 Å²	129.2	63%	0.626	76%	0.764	S	S	*	*			cis	-163.7	167.1	-15.7	-98.6	-2.4	0	0	0	109.4
9	Q	42	Very low	36.4	Very low	175 Å²	175	127.8 Å²	127.8	82%	0.818	76%	0.761	S	S	*	*			trans	-80.8	-176.1	162	-70.9	-172.5	-17.4	0	0	111.8
10	P	39.1	Very low	36.2	Very low	102 Å²	102	130.7 Å²	130.7	66%	0.662	76%	0.764	S	S	*	*				-152.5	153.9	109.1	39.3	-22.3	0	0	0	119.2
11	T	31.2	Very low	36.4	Very low	130 Å²	130	132.2 Å²	132.2	80%	0.798	76%	0.764	S	S	*	*			trans	58.6	119.6	140.3	57	0	0	0	0	123.9
12	A	34.1	Very low	36.4	Very low	92 Å²	92	125.1 Å²	125.1	76%	0.76	74%	0.737	S	S	*	*				-164.3	135.4	119.2	0	0	0	0	0	112.5
13	S	34.5	Very low	36.3	Very low	100 Å²	100	127.2 Å²	127.2	70%	0.699	74%	0.738	S	S	*	*			trans	13.3	128.3	157	54.6	0	0	0	0	120.3
14	N	34.5	Very low	36.2	Very low	122 Å²	122	128 Å²	128	65%	0.652	73%	0.733	S	S	*	*			cis	-136.2	162.4	1.9	-56	-56	0	0	0	107.5
15	G	37.3	Very low	36.2	Very low	68 Å²	68	130.8 Å²	130.8	70%	0.701	73%	0.731	S	S	*	*			cis	98.7	120.3	31.6	0	0	0	0	0	109.7
16	E	35.7	Very low	36	Very low	186 Å²	186	130.5 Å²	130.5	87%	0.869	73%	0.729	S	S	*	*			cis	-153.1	155.2	3.9	-75.3	179.1	79.7	0	0	112.6
17	S	35.3	Very low	35.9	Very low	101 Å²	101	132.3 Å²	132.3	71%	0.706	73%	0.732	S	S	*	*			trans	43.6	139.8	139.3	-56.8	0	0	0	0	124.2
18	Q	35.8	Very low	35.7	Very low	176 Å²	176	131.2 Å²	131.2	82%	0.822	73%	0.729	S	S	*	*			cis	-168	165.6	-21.5	-135.2	-175.1	39.3	0	0	113.7
19	S	36.2	Very low	35.7	Very low	102 Å²	102	131.8 Å²	131.8	71%	0.713	73%	0.732	S	S	*	*			trans	66.1	122.8	148.6	60.7	0	0	0	0	122.9
20	F	31.1	Very low	35.2	Very low	186 Å²	186	130.8 Å²	130.8	82%	0.816	73%	0.727	S	S	*	*			trans	-91.7	-165.3	150.4	-128.9	-107.9	0	0	0	109.3
21	E	40.7	Very low	35.2	Very low	162 Å²	162	133.6 Å²	133.6	76%	0.757	74%	0.736	S	S	*	*			trans	66.2	155.2	173.5	-88.3	71.6	-125	0	0	117.8
22	S	37.3	Very low	35.4	Very low	84 Å²	84	132.8 Å²	132.8	59%	0.587	73%	0.731	S	S	*	*			cis	-175.9	155.9	-37.8	55.5	0	0	0	0	111.1
23	Q	36.4	Very low	35.5	Very low	165 Å²	165	135.2 Å²	135.2	77%	0.771	74%	0.737	S	S	*	*			trans	62.5	115.1	141	-79	174.9	36.5	0	0	121.3
24	Q	35.3	Very low	35.4	Very low	141 Å²	141	134.1 Å²	134.1	66%	0.659	74%	0.741	S	S	*	*				110.7	122.9	108.5	-170.3	165.6	11.2	0	0	120.2
25	E	36.9	Very low	35.4	Very low	150 Å²	150	139 Å²	139	70%	0.701	75%	0.75	S	S	*	*			trans	46.4	109.7	152.5	-67.4	163.1	163.3	0	0	119.9
26	V	35	Very low	35.2	Very low	110 Å²	110	143 Å²	143	67%	0.667	75%	0.751	S	S	*	*				71	111	67.1	177	0	0	0	0	113.3
27	Y	33.8	Very low	35.1	Very low	224 Å²	224	138.9 Å²	138.9	88%	0.878	74%	0.735	S	S	*	*				-177.5	139	114.6	-104	-64.3	0	0	0	114.1
28	G	33.2	Very low	35.1	Very low	63 Å²	63	141.7 Å²	141.7	65%	0.649	74%	0.737	S	S	*	*			trans	99.5	141.6	155.9	0	0	0	0	0	117
29	N	34.3	Very low	34.9	Very low	128 Å²	128	137.8 Å²	137.8	68%	0.684	74%	0.735	S	S	*	*			cis	-160.7	149.7	-11.6	-137	28.9	0	0	0	112.2
30	E	32.2	Very low	34.9	Very low	154 Å²	154	141.4 Å²	141.4	72%	0.72	74%	0.742	S	S	*	*			trans	33.9	113.4	151.3	-62.8	167.4	-142.3	0	0	120.7
31	L	37.8	Very low	35.2	Very low	162 Å²	162	138.4 Å²	138.4	85%	0.848	74%	0.735	S	S	*	*				-168	101.2	122.3	-124.5	77.2	0	0	0	115.1
32	T	36.3	Very low	34.9	Very low	113 Å²	113	136.8 Å²	136.8	69%	0.693	73%	0.731	S	S	*	*			trans	17.4	141	139.3	58.4	0	0	0	0	124.4
33	T	35.1	Very low	35	Very low	143 Å²	143	142.3 Å²	142.3	88%	0.877	75%	0.748	S	S	*	*			trans	74.5	112.8	143.9	49.5	0	0	0	0	121
34	G	33.9	Very low	34.9	Very low	76 Å²	76	138.2 Å²	138.2	78%	0.784	75%	0.75	S	S	*	*			trans	-153.5	5.2	179.6	0	0	0	0	0	120.1
35	R	34.1	Very low	34.8	Very low	224 Å²	224	138.9 Å²	138.9	85%	0.845	76%	0.758	S	S	*	*			trans	68.8	127.5	-179	-77.8	178.7	174.7	162.5	0.3	115.5
36	Q	33.1	Very low	34.6	Very low	153 Å²	153	137.2 Å²	137.2	72%	0.715	76%	0.758	S	S	*	*				67.3	131.2	78.8	-66.6	-165.7	-86.5	0	0	113.1
37	N	33.3	Very low	34.7	Very low	100 Å²	100	138 Å²	138	54%	0.535	76%	0.762	S	S	.	*			cis	-153.5	175.3	13.2	-117.3	20.6	0	0	0	112.8
38	E	34.8	Very low	34.6	Very low	160 Å²	160	132.9 Å²	132.9	75%	0.748	75%	0.754	S	S	*	*			trans	19.4	130.9	150.7	-63.7	136.3	-178.3	0	0	120.3
39	A	33.3	Very low	34.8	Very low	94 Å²	94	136 Å²	136	78%	0.777	76%	0.76	S	S	*	*			cis	88	137.6	40.5	0	0	0	0	0	116.1
40	M	35.3	Very low	34.7	Very low	177 Å²	177	135.4 Å²	135.4	87%	0.872	76%	0.761	S	S	*	*			trans	77.4	120.1	169.8	-68.1	-175.5	169.7	0	0	120.3
41	N	37.3	Very low	35.2	Very low	123 Å²	123	132.8 Å²	132.8	66%	0.658	76%	0.758	S	S	*	*				72.7	127.6	129.5	-74.5	59.1	0	0	0	123.4
42	D	35.6	Very low	35.2	Very low	129 Å²	129	130.9 Å²	130.9	69%	0.69	75%	0.749	S	S	*	*			trans	72.1	126.8	133.5	-54.7	-25.9	0	0	0	122.2
43	E	38	Very low	35.3	Very low	199 Å²	199	131.2 Å²	131.2	93%	0.93	75%	0.746	S	S	*	*			trans	65.5	141.1	153.5	-62.5	176.7	-173.2	0	0	120.1
44	G	35.5	Very low	35.5	Very low	79 Å²	79	129.5 Å²	129.5	81%	0.814	74%	0.736	S	S	*	*			trans	136.6	42.4	156.3	0	0	0	0	0	121.5
45	N	32.4	Very low	35.8	Very low	155 Å²	155	131.2 Å²	131.2	83%	0.829	73%	0.731	S	S	*	*			trans	-4.7	147.6	156.7	-159.1	15.3	0	0	0	121.6
46	V	32.5	Very low	35.8	Very low	115 Å²	115	126.9 Å²	126.9	70%	0.697	73%	0.725	S	S	*	*			trans	78.2	119.5	162	-149.4	0	0	0	0	120.4
47	V	36.3	Very low	35.8	Very low	126 Å²	126	126.3 Å²	126.3	76%	0.764	73%	0.727	S	S	*	*				156.1	124.2	122	165.1	0	0	0	0	110.9
48	V	33.2	Very low	35.8	Very low	118 Å²	118	126 Å²	126	72%	0.715	74%	0.737	S	S	*	*			trans	-100.6	134	177.2	174.6	0	0	0	0	111.3
49	V	36.3	Very low	36	Very low	128 Å²	128	124.1 Å²	124.1	78%	0.776	74%	0.74	S	S	*	*			trans	-148.3	120.4	153.6	-177.1	0	0	0	0	110.5
50	T	33.5	Very low	36.4	Very low	115 Å²	115	126.6 Å²	126.6	71%	0.706	75%	0.745	S	S	*	*			trans	-110.1	161	156.4	49.2	0	0	0	0	110
51	P	43	Very low	36.2	Very low	100 Å²	100	125.1 Å²	125.1	65%	0.649	74%	0.739	S	S	*	*			trans	-138.1	125.8	136.1	32.8	-18.8	0	0	0	113.7
52	N	37.5	Very low	36.6	Very low	122 Å²	122	128.6 Å²	128.6	65%	0.652	75%	0.752	S	S	*	*				44.7	141.3	114.3	-62.3	55.4	0	0	0	119.8
53	D	37.7	Very low	36.6	Very low	119 Å²	119	131 Å²	131	64%	0.636	76%	0.759	S	S	*	*			cis	-160.9	151.1	10.9	-131.2	-44.1	0	0	0	115.7
54	T	39.6	Very low	36.8	Very low	107 Å²	107	127.6 Å²	127.6	66%	0.656	75%	0.751	S	S	*	*			trans	33.7	115.5	149.8	30.7	0	0	0	0	125.1
55	T	40	Very low	37.2	Very low	112 Å²	112	130.7 Å²	130.7	69%	0.687	75%	0.749	S	S	*	*				46.6	146.2	117.6	64.1	0	0	0	0	122.1
56	D	34.6	Very low	37.5	Very low	133 Å²	133	129.5 Å²	129.5	71%	0.711	75%	0.748	S	S	*	*			cis	-169.6	162.3	3.2	-122	-8.6	0	0	0	116.1
57	N	33.1	Very low	38.1	Very low	142 Å²	142	132.9 Å²	132.9	76%	0.759	76%	0.756	S	S	*	*			trans	74.4	143.2	144.8	-82.7	-59	0	0	0	126
58	A	33	Very low	38.4	Very low	92 Å²	92	133.7 Å²	133.7	76%	0.76	75%	0.752	S	S	*	*			trans	95.9	153	150.8	0	0	0	0	0	120.2
59	P	39	Very low	38.8	Very low	122 Å²	122	138 Å²	138	79%	0.792	76%	0.755	S	S	*	*				-140.7	177.2	-115.1	40.6	-20.4	0	0	0	118.2
60	T	40.9	Very low	38.9	Very low	145 Å²	145	138.8 Å²	138.8	89%	0.89	75%	0.75	S	S	*	*			trans	-145.2	155.2	172.1	-37.6	0	0	0	0	113.1
61	I	32	Very low	39	Very low	146 Å²	146	138 Å²	138	75%	0.749	75%	0.746	S	S	*	*			trans	-138.7	151.1	-172.9	-62.8	164.5	0	0	0	110.1
62	E	46	Very low	38.9	Very low	197 Å²	197	143.1 Å²	143.1	92%	0.921	75%	0.753	S	S	*	*			trans	-158.2	165.6	157.8	-120.2	165.9	-147.2	0	0	113.5
63	Q	34.1	Very low	39	Very low	180 Å²	180	144.6 Å²	144.6	84%	0.841	76%	0.756	S	S	*	*			trans	-145.2	167.5	-163.8	-59.7	179.3	-91	0	0	115.7
64	T	42	Very low	38.8	Very low	126 Å²	126	146.3 Å²	146.3	77%	0.773	76%	0.764	S	S	*	*			trans	-165.5	170.5	166.1	41.2	0	0	0	0	108.9
65	D	45.3	Very low	39.4	Very low	145 Å²	145	146.6 Å²	146.6	78%	0.775	77%	0.768	S	S	*	*			cis	-161	164	-20.6	-92	-14.8	0	0	0	108.4
66	T	38.9	Very low	39.4	Very low	129 Å²	129	146.6 Å²	146.6	79%	0.791	77%	0.77	S	S	*	*			trans	-148.5	-179.1	-165.2	48.5	0	0	0	0	118.2
67	E	43.5	Very low	39.7	Very low	186 Å²	186	146.4 Å²	146.4	87%	0.869	77%	0.774	S	S	*	*			trans	78.6	164.6	165.7	-64	-176.7	-111.5	0	0	120.4
68	E	43.2	Very low	39.8	Very low	144 Å²	144	143.1 Å²	143.1	67%	0.673	77%	0.767	S	S	*	*				-173.5	157.6	-52.5	-140.8	-57.8	84.8	0	0	109.4	E70	E68-E70 PolarHBondContact OE2-N 2.69Å
69	R	42.1	Very low	40	Very low	209 Å²	209	147.5 Å²	147.5	79%	0.789	77%	0.769	S	S	*	*			trans	-177	105.1	131.9	-108	-173.2	160.7	143.3	6	120.1
70	E	37.9	Very low	39.6	Very low	143 Å²	143	148.1 Å²	148.1	67%	0.668	76%	0.764	S	S	*	*				61.5	164.3	121.4	-63	-174.2	113	0	0	125.1	E68	E68-E70 PolarHBondContact OE2-N 2.69Å
71	T	36	Very low	39.3	Very low	100 Å²	100	151.8 Å²	151.8	61%	0.613	76%	0.764	S	S	*	*			trans	-144	172.8	-153.3	-26.4	0	0	0	0	114.5
72	Y	39.7	Very low	39.7	Very low	207 Å²	207	154.2 Å²	154.2	81%	0.812	77%	0.769	S	S	*	*			trans	-176	167	155.2	-118.4	-138	0	0	0	109.8
73	E	39.6	Very low	39.1	Very low	153 Å²	153	154.1 Å²	154.1	72%	0.715	77%	0.765	S	S	*	*			cis	-142.8	-129.1	-2.4	-160.8	-172.1	109.2	0	0	111.3
74	L	35.4	Very low	39	Very low	154 Å²	154	150.4 Å²	150.4	81%	0.806	76%	0.759	S	S	*	*			trans	-143.8	164.8	-160	-69.1	177.9	0	0	0	117.6
75	P	50.8	Low	38.7	Very low	113 Å²	113	151.8 Å²	151.8	73%	0.734	76%	0.762	S	S	*	*			trans	-114.3	179.4	-172.2	43.5	-36.7	0	0	0	116.7
76	P	41.3	Very low	38.1	Very low	113 Å²	113	152.1 Å²	152.1	73%	0.734	76%	0.763	S	S	*	*			trans	-115.5	159.2	157.4	38.1	-27.2	0	0	0	112.3
77	T	39.2	Very low	37.5	Very low	128 Å²	128	148.5 Å²	148.5	79%	0.785	75%	0.752	S	S	*	*			cis	-161.1	131.3	-3.1	13.4	0	0	0	0	107
78	A	35.7	Very low	37	Very low	74 Å²	74	147.4 Å²	147.4	61%	0.612	75%	0.751	S	S	*	*				68.6	139.7	86.6	0	0	0	0	0	115.5
79	K	37	Very low	36.3	Very low	184 Å²	184	148 Å²	148	80%	0.8	76%	0.756	S	S	*	*			cis	-165.9	155.8	1.6	-113.5	162.2	-159.5	169.5	0	111.5
80	L	32.1	Very low	36	Very low	134 Å²	134	145.2 Å²	145.2	70%	0.702	76%	0.756	S	S	*	*			trans	17.5	133	138.4	-53.7	167.5	0	0	0	119.5
81	Y	33.6	Very low	35.8	Very low	223 Å²	223	149.4 Å²	149.4	88%	0.875	77%	0.766	S	S	*	*				178.3	152.1	103.6	-105.9	-77.6	0	0	0	112.8
82	K	39.9	Very low	35.6	Very low	196 Å²	196	150.3 Å²	150.3	85%	0.852	77%	0.774	S	S	*	*			trans	-94	130.9	160	-79.7	-171.2	176.3	-175.6	0	110.2
83	K	34.4	Very low	35.1	Very low	196 Å²	196	143.3 Å²	143.3	85%	0.852	76%	0.758	S	S	*	*			trans	172.3	128.7	155	-94.3	162.3	178.3	-172.1	0	105.4
84	S	31.9	Very low	34.6	Very low	101 Å²	101	145.3 Å²	145.3	71%	0.706	77%	0.768	S	S	*	*			cis	85.6	73.1	42.4	84.6	0	0	0	0	114.5
85	D	35.8	Very low	34.6	Very low	156 Å²	156	142 Å²	142	83%	0.834	76%	0.762	S	S	*	*			trans	-104.3	133.5	149.6	-59	-43.3	0	0	0	106.1
86	N	33	Very low	33.9	Very low	151 Å²	151	143.8 Å²	143.8	81%	0.807	76%	0.761	S	S	*	*			cis	-123.9	159.9	-1	-69.9	-57.8	0	0	0	109.4
87	G	26.2	Very low	33.6	Very low	53 Å²	53	148.9 Å²	148.9	55%	0.546	77%	0.766	S	S	.	*			cis	107	115.1	5.5	0	0	0	0	0	112.1
88	L	33	Very low	33.3	Very low	163 Å²	163	145.7 Å²	145.7	85%	0.853	76%	0.759	S	S	*	*			trans	66.9	124.3	-177.6	-54.7	112.6	0	0	0	114
89	M	27	Very low	33.1	Very low	158 Å²	158	149.3 Å²	149.3	78%	0.778	77%	0.767	S	S	*	*				67.6	98.5	52.7	-58.8	-87.6	-77.7	0	0	112.8
90	N	36.9	Very low	32.7	Very low	149 Å²	149	147.5 Å²	147.5	80%	0.797	77%	0.767	S	S	*	*				-174.8	135.6	109.6	-85.6	-25.5	0	0	0	112.1
91	W	33.1	Very low	32.6	Very low	232 Å²	232	145.8 Å²	145.8	88%	0.879	77%	0.766	S	S	*	*			trans	-74.1	148.3	152.5	-80.1	55.5	0	0	0	108.3	A93	W91-A93 HydrophobicContact CE3-CB 4.35Å
92	P	32.6	Very low	32.3	Very low	119 Å²	119	145.8 Å²	145.8	77%	0.773	76%	0.764	S	S	*	*				-115.3	143.7	81.3	33.9	-30.4	0	0	0	111.7
93	A	28.9	Very low	31.8	Very low	59 Å²	59	143.1 Å²	143.1	49%	0.488	76%	0.755	S	S	.	*			cis	85.1	136.2	49.1	0	0	0	0	0	113.5	W91	W91-A93 HydrophobicContact CE3-CB 4.35Å
94	E	29.7	Very low	31.5	Very low	196 Å²	196	141.7 Å²	141.7	92%	0.916	75%	0.751	S	S	*	*			trans	68.1	133.6	175.7	-67.8	160.2	-153.9	0	0	115.5
95	A	34.8	Very low	31.5	Very low	83 Å²	83	141 Å²	141	69%	0.686	75%	0.751	S	S	*	*			cis	-150.2	163.9	6.3	0	0	0	0	0	113.2
96	E	36	Very low	31.2	Very low	152 Å²	152	144.1 Å²	144.1	71%	0.71	75%	0.752	S	S	*	*			trans	55.3	128.4	151.1	-74	-171.6	-121.2	0	0	120.4
97	R	35.9	Very low	31.4	Very low	219 Å²	219	147.1 Å²	147.1	83%	0.826	75%	0.752	S	S	*	*			cis	-140.9	140.4	-4.6	-55.3	-175.4	174.7	166.3	0	107.6
98	G	31.8	Very low	31.5	Very low	62 Å²	62	153.1 Å²	153.1	64%	0.639	77%	0.765	S	S	*	*				105.6	103.9	90.9	0	0	0	0	0	109.6
99	N	31.3	Very low	31.3	Very low	149 Å²	149	150.1 Å²	150.1	80%	0.797	76%	0.758	S	S	*	*				68.6	136.3	84.1	-72.1	-6.3	0	0	0	113.5
100	N	28.9	Very low	31.7	Very low	147 Å²	147	148.2 Å²	148.2	79%	0.786	75%	0.751	S	S	*	*			cis	-164.7	175.8	-20.5	-122.4	-14	0	0	0	108.1
101	S	30.1	Very low	31.6	Very low	97 Å²	97	147.1 Å²	147.1	68%	0.678	74%	0.743	S	S	*	*			trans	-90.2	170.1	169.2	64.8	0	0	0	0	112.5
102	W	26.8	Very low	32	Very low	223 Å²	223	144.2 Å²	144.2	85%	0.845	74%	0.739	S	S	*	*			trans	83.7	136.3	169.6	-78.3	55.3	0	0	0	120.4
103	Q	29.5	Very low	32.2	Very low	140 Å²	140	142.6 Å²	142.6	65%	0.654	74%	0.736	S	S	*	*			trans	68.9	106.4	153.2	-73.7	-174.3	-84.3	0	0	122.5
104	E	27.9	Very low	32.5	Very low	166 Å²	166	143.2 Å²	143.2	78%	0.776	74%	0.741	S	S	*	*				79.9	160.9	110	-155.1	167.9	176.2	0	0	118.9
105	A	33.4	Very low	32.8	Very low	86 Å²	86	141.4 Å²	141.4	71%	0.711	74%	0.735	S	S	*	*			trans	65.5	121.9	-168.7	0	0	0	0	0	114.5
106	R	29.3	Very low	33.2	Very low	223 Å²	223	142.3 Å²	142.3	84%	0.842	73%	0.728	S	S	*	*				74.5	125	62.4	-85.5	-177.6	163	167.2	-3.6	114.4
107	R	36.3	Very low	33.6	Very low	214 Å²	214	141.2 Å²	141.2	81%	0.808	73%	0.727	S	S	*	*			trans	82.2	119.6	170.5	-58.3	160.2	-177.8	164	-1.7	112.4
108	H	29.5	Very low	33.9	Very low	179 Å²	179	136 Å²	136	83%	0.829	72%	0.715	S	S	*	*			cis	67.7	134.1	46.1	-64.7	-80.2	0	0	0	113.9
109	S	28.2	Very low	34.2	Very low	99 Å²	99	141.7 Å²	141.7	69%	0.692	73%	0.726	S	S	*	*			trans	67.1	146.9	163	91.8	0	0	0	0	114.9
110	D	35.3	Very low	34.5	Very low	119 Å²	119	139.2 Å²	139.2	64%	0.636	72%	0.72	S	S	*	*			cis	-129.7	153.7	11.4	-84.5	-73.3	0	0	0	110.5
111	I	34.6	Very low	34.9	Very low	125 Å²	125	139 Å²	139	64%	0.641	72%	0.717	S	S	*	*				40.8	116.4	92.8	-38.1	176.6	0	0	0	110.3
112	H	41.6	Very low	35.1	Very low	171 Å²	171	140 Å²	140	79%	0.792	72%	0.724	S	S	*	*			cis	-115.5	162.1	40.7	-71.9	-97.5	0	0	0	112.1
113	A	36.2	Very low	35.2	Very low	85 Å²	85	133.9 Å²	133.9	70%	0.702	72%	0.721	S	S	*	*				57.7	146.7	50.2	0	0	0	0	0	111.7
114	A	35.9	Very low	35.9	Very low	73 Å²	73	133 Å²	133	60%	0.603	73%	0.728	S	S	*	*			cis	-146.1	159.8	18.2	0	0	0	0	0	109.8
115	M	36.4	Very low	36.2	Very low	158 Å²	158	129.8 Å²	129.8	78%	0.778	73%	0.729	S	S	*	*				63.3	139.4	102	-64.2	168.1	66.7	0	0	114.8
116	D	43.1	Very low	36.4	Very low	101 Å²	101	129.9 Å²	129.9	54%	0.54	73%	0.73	S	S	.	*			cis	-153.7	-177.6	-12.4	-91.9	-29.5	0	0	0	106.1
117	N	43.6	Very low	36.7	Very low	130 Å²	130	123.9 Å²	123.9	70%	0.695	72%	0.722	S	S	*	*				168.4	156.9	73.8	-81	-64.2	0	0	0	107.1
118	D	42.1	Very low	36.8	Very low	108 Å²	108	121.9 Å²	121.9	58%	0.578	73%	0.726	S	S	*	*			cis	-158.2	-174.2	-34.4	-142.4	-9	0	0	0	104.1	S120	D118-S120 PolarHBondContact OD1-N 3.04Å; D118-S120 VanDerWaalsContact OD1-N 3.07Å
119	E	38	Very low	37	Very low	183 Å²	183	116.4 Å²	116.4	86%	0.855	72%	0.717	S	S	*	*			cis	-125.3	126.8	20.5	-65.6	178.4	129.6	0	0	111.4
120	S	37.6	Very low	37.3	Very low	96 Å²	96	122.9 Å²	122.9	67%	0.671	73%	0.727	S	S	*	*			trans	-73.3	-174.9	149.2	-67.2	0	0	0	0	109.6	D118	D118-S120 PolarHBondContact OD1-N 3.04Å; D118-S120 VanDerWaalsContact OD1-N 3.07Å
121	I	36.6	Very low	37.2	Very low	143 Å²	143	123.2 Å²	123.2	73%	0.733	73%	0.734	S	S	*	*				177.2	135.6	68.4	-77.7	175.6	0	0	0	106.2
122	S	35.1	Very low	37.5	Very low	118 Å²	118	123.4 Å²	123.4	83%	0.825	74%	0.741	S	S	*	*				-178.8	123.9	121.6	-77.4	0	0	0	0	112.6
123	A	29	Very low	37.4	Very low	95 Å²	95	119.2 Å²	119.2	79%	0.785	74%	0.736	S	S	*	*			trans	-133.8	-150.6	167.2	0	0	0	0	0	105.6
124	P	44.9	Very low	37.4	Very low	121 Å²	121	122.1 Å²	122.1	79%	0.786	74%	0.739	S	S	*	*			cis	-140.1	-157.3	-9.4	42	-21.3	0	0	0	114.3
125	A	34.4	Very low	37.4	Very low	98 Å²	98	127 Å²	127	81%	0.81	75%	0.749	S	S	*	*			trans	91	141.3	160.6	0	0	0	0	0	118
126	A	36.8	Very low	37.6	Very low	88 Å²	88	124.5 Å²	124.5	73%	0.727	75%	0.748	S	S	*	*			cis	-150.2	148.6	8.7	0	0	0	0	0	116.3
127	S	36.3	Very low	37.6	Very low	97 Å²	97	128 Å²	128	68%	0.678	76%	0.761	S	S	*	*			trans	32	122.9	144.1	57.8	0	0	0	0	122.5
128	I	37.1	Very low	37.3	Very low	173 Å²	173	128.8 Å²	128.8	89%	0.887	76%	0.764	S	S	*	*				68.6	132.2	76	-60.2	157.6	0	0	0	114.2
129	G	34.4	Very low	37.1	Very low	63 Å²	63	130 Å²	130	65%	0.649	77%	0.771	S	S	*	*			cis	159.4	169.4	-6.6	0	0	0	0	0	114.7
130	R	33.9	Very low	37.2	Very low	235 Å²	235	125.7 Å²	125.7	89%	0.887	76%	0.757	S	S	*	*			trans	70	132.5	172.8	-59.1	174.8	173.7	160.1	-1.3	117.1
131	T	34.5	Very low	37.2	Very low	127 Å²	127	129.6 Å²	129.6	78%	0.779	76%	0.762	S	S	*	*			cis	82.4	140.2	25.3	76	0	0	0	0	115.3
132	T	39.7	Very low	37	Very low	129 Å²	129	128.2 Å²	128.2	79%	0.791	76%	0.756	S	S	*	*			cis	-155.6	165.4	28	50	0	0	0	0	115.5
133	A	39.2	Very low	37.1	Very low	83 Å²	83	129.8 Å²	129.8	69%	0.686	75%	0.75	S	S	*	*			trans	86.6	122.8	142.7	0	0	0	0	0	124.7
134	D	36.1	Very low	37.4	Very low	146 Å²	146	132.3 Å²	132.3	78%	0.781	75%	0.746	S	S	*	*				68.1	129.6	129.6	-59.3	-25.2	0	0	0	128.3
135	E	37.1	Very low	36.9	Very low	174 Å²	174	134 Å²	134	81%	0.813	74%	0.743	S	S	*	*			trans	79.1	143.2	137.1	-75.8	-177	-174.4	0	0	125.4
136	S	40.6	Very low	36.9	Very low	107 Å²	107	136.4 Å²	136.4	75%	0.748	74%	0.742	S	S	*	*			trans	60.4	110.5	170.2	57.8	0	0	0	0	117.6
137	E	42.3	Very low	36.9	Very low	173 Å²	173	138.8 Å²	138.8	81%	0.808	75%	0.747	S	S	*	*				94	137.9	60.5	-88.2	-164.6	170.7	0	0	113.8
138	L	37.4	Very low	37.2	Very low	148 Å²	148	139.2 Å²	139.2	78%	0.775	75%	0.75	S	S	*	*			trans	69.3	138.3	160.4	-67.3	165.6	0	0	0	117.5
139	D	39	Very low	37.5	Very low	132 Å²	132	140.4 Å²	140.4	71%	0.706	75%	0.752	S	S	*	*			cis	-162.5	169	-5.3	-159.1	3.2	0	0	0	112.5
140	V	39.6	Very low	37.8	Very low	94 Å²	94	143 Å²	143	57%	0.57	75%	0.751	S	S	*	*			trans	62.5	137.7	160.3	-118.8	0	0	0	0	123.2
141	F	36.3	Very low	38.1	Very low	177 Å²	177	141 Å²	141	78%	0.776	74%	0.744	S	S	*	*			trans	64.7	145.8	158.5	-64.1	-61.4	0	0	0	118.4
142	N	33.9	Very low	38.5	Very low	114 Å²	114	140.7 Å²	140.7	61%	0.61	75%	0.746	S	S	*	*			cis	-173.8	166.1	-29.4	-133.4	38.7	0	0	0	106.3
143	E	36.8	Very low	38.7	Very low	151 Å²	151	138.6 Å²	138.6	71%	0.706	74%	0.742	S	S	*	*			trans	62.6	114.6	159.8	-72.7	149.9	-117.2	0	0	116.2
144	E	35.6	Very low	38.6	Very low	149 Å²	149	141.7 Å²	141.7	70%	0.696	75%	0.747	S	S	*	*				79.3	134.9	79.5	-94.9	-171.9	153.2	0	0	116
145	H	34.8	Very low	38.9	Very low	155 Å²	155	142.6 Å²	142.6	72%	0.718	75%	0.747	S	S	*	*			trans	77.2	111.5	152.9	-61.9	-35.5	0	0	0	122.7
146	L	33.3	Very low	39	Very low	149 Å²	149	141.2 Å²	141.2	78%	0.78	75%	0.745	S	S	*	*				66.2	122.2	119.8	-59.2	171.4	0	0	0	119.9
147	T	36.9	Very low	39.1	Very low	138 Å²	138	144.3 Å²	144.3	85%	0.847	75%	0.747	S	S	*	*			trans	-101.8	107.2	159.7	49.4	0	0	0	0	110.7
148	S	41.9	Very low	38.9	Very low	106 Å²	106	145.2 Å²	145.2	74%	0.741	75%	0.749	S	S	*	*			trans	-153.2	89.3	162.9	-64.8	0	0	0	0	109.1
149	E	45.1	Very low	39	Very low	198 Å²	198	144.6 Å²	144.6	93%	0.925	75%	0.746	S	S	*	*				17.6	131.3	129.5	-65.8	168.7	99.3	0	0	119.7
150	D	40.8	Very low	39	Very low	117 Å²	117	145.7 Å²	145.7	63%	0.626	75%	0.752	S	S	*	*			trans	-158.3	135.2	148.1	-154.1	-13.6	0	0	0	111.5
151	R	39.4	Very low	38.9	Very low	195 Å²	195	150 Å²	150	74%	0.736	77%	0.766	S	S	*	*			trans	64.3	115.6	172.5	-46.4	-170.3	177.1	61.9	31.5	117.9
152	S	43.8	Very low	38.8	Very low	119 Å²	119	146.7 Å²	146.7	83%	0.832	77%	0.765	S	S	*	*			cis	82.9	132.7	21.6	96.1	0	0	0	0	117.9
153	A	42	Very low	39	Very low	85 Å²	85	146.9 Å²	146.9	70%	0.702	77%	0.77	S	S	*	*			trans	-173.9	151.6	157.4	0	0	0	0	0	111
154	D	38.8	Very low	39.2	Very low	149 Å²	149	147.4 Å²	147.4	80%	0.797	78%	0.777	S	S	*	*			trans	59.1	147.1	161.9	-57.3	5.6	0	0	0	120.4
155	E	41.2	Very low	39.3	Very low	165 Å²	165	143.9 Å²	143.9	77%	0.771	77%	0.773	S	S	*	*			cis	-169.4	131.7	-39.1	-132.1	179.8	-157.8	0	0	108.7
156	N	39	Very low	39.6	Very low	144 Å²	144	144 Å²	144	77%	0.77	78%	0.779	S	S	*	*			trans	167.7	128	137.5	-95.6	-61.8	0	0	0	111.9
157	E	42.7	Very low	39.8	Very low	172 Å²	172	142 Å²	142	80%	0.804	77%	0.773	S	S	*	*			trans	-130.8	135.8	162.8	177.8	176.4	-152.6	0	0	106.3
158	F	38.9	Very low	39.9	Very low	192 Å²	192	142.1 Å²	142.1	84%	0.842	77%	0.768	S	S	*	*			trans	-135.8	125.3	172.7	-109.8	-81	0	0	0	110.1
159	L	40	Very low	39.7	Very low	136 Å²	136	143.9 Å²	143.9	71%	0.712	77%	0.767	S	S	*	*			trans	-79.7	152	172.9	-63.9	155.3	0	0	0	109.6
160	D	37.6	Very low	39.6	Very low	155 Å²	155	140.3 Å²	140.3	83%	0.829	76%	0.761	S	S	*	*				-176	146.1	94.8	-96.4	-30.2	0	0	0	111.6
161	E	38.2	Very low	39.4	Very low	184 Å²	184	141.9 Å²	141.9	86%	0.86	76%	0.764	S	S	*	*			trans	-91.3	163.5	170.6	-71.9	-167	137.6	0	0	111.8
162	S	33.4	Very low	39.3	Very low	108 Å²	108	141.1 Å²	141.1	76%	0.755	77%	0.769	S	S	*	*			trans	91.5	157.8	159.6	85.6	0	0	0	0	119.6
163	T	39.7	Very low	39.3	Very low	118 Å²	118	144.5 Å²	144.5	72%	0.724	77%	0.772	S	S	*	*			trans	80.8	107.6	171.5	64	0	0	0	0	120.4
164	L	40.6	Very low	39.5	Very low	161 Å²	161	148.3 Å²	148.3	84%	0.843	78%	0.775	S	S	*	*				80	108.6	129.7	-66.2	169.3	0	0	0	121.4
165	A	37.9	Very low	39.7	Very low	76 Å²	76	147.4 Å²	147.4	63%	0.628	77%	0.77	S	S	*	*				67.9	96.1	122.3	0	0	0	0	0	119.4
166	N	41	Very low	39.3	Very low	156 Å²	156	146.9 Å²	146.9	83%	0.834	77%	0.772	S	S	*	*				164.7	147.8	113.5	-81.8	-14.7	0	0	0	109.8
167	V	38	Very low	39.5	Very low	107 Å²	107	148.6 Å²	148.6	65%	0.648	78%	0.775	S	S	*	*			cis	-164.1	156.5	-16	113.6	0	0	0	0	107.1
168	D	38	Very low	39.2	Very low	141 Å²	141	143.4 Å²	143.4	75%	0.754	77%	0.768	S	S	*	*			trans	14.6	146.9	153.5	-47.5	-31.2	0	0	0	121.4
169	M	38	Very low	39.3	Very low	143 Å²	143	140 Å²	140	70%	0.704	76%	0.764	S	S	*	*			cis	-146.9	171.7	9.3	-68.1	-167.5	-40.4	0	0	111.4	E171	M169-E171 HydrophobicContact CE-CB 4.02Å
170	P	42.4	Very low	39.3	Very low	124 Å²	124	142 Å²	142	81%	0.805	77%	0.769	S	S	*	*			trans	-105.4	108.2	145.5	34.5	-21.4	0	0	0	111.9
171	E	37.8	Very low	39.6	Very low	150 Å²	150	142.2 Å²	142.2	70%	0.701	77%	0.765	S	S	*	*			trans	-168.4	154.7	162.2	-114.5	157.5	-157.4	0	0	110.1	M169	M169-E171 HydrophobicContact CE-CB 4.02Å
172	E	35.9	Very low	39.6	Very low	179 Å²	179	140.4 Å²	140.4	84%	0.836	76%	0.762	S	S	*	*			trans	28.4	113.4	161.4	-57.7	176.6	-171.3	0	0	117.7
173	E	44.3	Very low	39.7	Very low	190 Å²	190	138.5 Å²	138.5	89%	0.888	76%	0.758	S	S	*	*				-155.2	154	74.5	-78.4	169.9	175.5	0	0	110
174	E	46.7	Very low	39.9	Very low	164 Å²	164	137.8 Å²	137.8	77%	0.766	76%	0.758	S	S	*	*			cis	-159.2	-178.5	-21.6	-139.9	-160.7	159.4	0	0	109.9
175	L	41.4	Very low	39.6	Very low	131 Å²	131	138.1 Å²	138.1	69%	0.686	76%	0.756	S	S	*	*			trans	33	105.6	159.9	-60.2	177.3	0	0	0	122.5
176	N	33	Very low	39.6	Very low	154 Å²	154	140.5 Å²	140.5	82%	0.824	75%	0.754	S	S	*	*			trans	-81.3	164.1	133	-159.2	9.8	0	0	0	108.7
177	E	42.9	Very low	39.6	Very low	179 Å²	179	140.7 Å²	140.7	84%	0.836	75%	0.75	S	S	*	*			trans	70.4	140.6	-169.1	-48.3	-179	165.1	0	0	114.1
178	G	37.7	Very low	39.5	Very low	64 Å²	64	140 Å²	140	66%	0.66	75%	0.75	S	S	*	*			cis	176.1	169.7	-6	0	0	0	0	0	113.3
179	T	39.7	Very low	39.8	Very low	121 Å²	121	138.8 Å²	138.8	74%	0.742	75%	0.752	S	S	*	*			trans	51.1	110.2	158	50.3	0	0	0	0	121.7
180	E	41.5	Very low	39.8	Very low	177 Å²	177	137.8 Å²	137.8	83%	0.827	75%	0.754	S	S	*	*				81.8	148.6	120.8	-68.2	170.4	-161.1	0	0	123.5
181	E	43.7	Very low	39.6	Very low	160 Å²	160	138.5 Å²	138.5	75%	0.748	75%	0.75	S	S	*	*			trans	59.5	107.6	160	-65	-143.6	95.5	0	0	123.2
182	N	38.2	Very low	39.9	Very low	146 Å²	146	138.7 Å²	138.7	78%	0.781	75%	0.75	S	S	*	*				60.4	114.9	120.4	-64.5	-36.5	0	0	0	121.5
183	G	35.5	Very low	40.2	Very low	67 Å²	67	136.9 Å²	136.9	69%	0.691	75%	0.746	S	S	*	*			trans	151.9	82.1	161.6	0	0	0	0	0	112.3
184	S	42.7	Very low	40.2	Very low	103 Å²	103	132.6 Å²	132.6	72%	0.72	73%	0.733	S	S	*	*				66.9	127.7	76.7	78.5	0	0	0	0	115
185	Q	35.9	Very low	39.9	Very low	168 Å²	168	133.1 Å²	133.1	79%	0.785	73%	0.733	S	S	*	*			trans	68.5	143.5	163.1	-82.5	177.6	-75.3	0	0	116.4
186	E	36.9	Very low	40	Very low	127 Å²	127	133 Å²	133	59%	0.593	73%	0.733	S	S	*	*			cis	-169.7	174.3	-7.3	-158.4	178	-100.3	0	0	109.6
187	Q	40.6	Very low	40.4	Very low	159 Å²	159	132 Å²	132	74%	0.743	72%	0.724	S	S	*	*			trans	71.2	157.2	160.2	-55.1	-172.5	17.6	0	0	117.9
188	S	36.8	Very low	40.4	Very low	94 Å²	94	130.4 Å²	130.4	66%	0.657	72%	0.716	S	S	*	*			cis	-174.2	129.4	-32.3	57.8	0	0	0	0	111.6
189	S	44.4	Very low	40.8	Very low	114 Å²	114	134.3 Å²	134.3	80%	0.797	72%	0.717	S	S	*	*			trans	173.8	121.1	144.6	52.2	0	0	0	0	109.6
190	V	38.5	Very low	41.1	Very low	123 Å²	123	136.3 Å²	136.3	75%	0.745	72%	0.718	S	S	*	*			cis	90.7	139.8	36.3	175.7	0	0	0	0	112.9
191	I	37.6	Very low	41	Very low	139 Å²	139	131.8 Å²	131.8	71%	0.713	71%	0.706	S	S	*	*			trans	73.8	136	173.3	-83.9	159.1	0	0	0	114
192	E	42.8	Very low	40.8	Very low	154 Å²	154	129.1 Å²	129.1	72%	0.72	70%	0.697	S	S	*	*			cis	-156	169.9	-3.2	-106.8	157.4	-134.3	0	0	106.4
193	D	43.8	Very low	40.7	Very low	140 Å²	140	132.3 Å²	132.3	75%	0.749	70%	0.698	S	S	*	*			cis	175.3	158.3	-30.9	-101.1	27.7	0	0	0	105.8
194	V	43.8	Very low	40.5	Very low	101 Å²	101	136.4 Å²	136.4	61%	0.612	70%	0.699	S	S	*	*			cis	-170.1	178.7	-14.9	62.7	0	0	0	0	108.1
195	F	39.5	Very low	40.3	Very low	174 Å²	174	137 Å²	137	76%	0.763	70%	0.701	S	S	*	*			trans	79.1	150.5	177.2	-51.7	-49.7	0	0	0	118
196	D	43.9	Very low	40.3	Very low	128 Å²	128	136 Å²	136	68%	0.684	69%	0.694	S	S	*	*			cis	-160.8	170.7	-24.2	-105.3	-7.8	0	0	0	113.4
197	Q	42.7	Very low	40	Very low	135 Å²	135	140.1 Å²	140.1	63%	0.631	71%	0.71	S	S	*	*			trans	-61	171	-168.9	-56.2	158.5	-110.5	0	0	120.9
198	E	42.4	Very low	39.5	Very low	144 Å²	144	138.2 Å²	138.2	67%	0.673	71%	0.705	S	S	*	*			trans	73.5	157.2	142.6	-77.4	149.1	-158.2	0	0	119
199	E	45.6	Very low	39.4	Very low	147 Å²	147	139.3 Å²	139.3	69%	0.687	71%	0.713	S	S	*	*			cis	-157.2	157.4	7.8	-135.9	173.1	-177.5	0	0	111.3
200	E	45.7	Very low	38.9	Very low	163 Å²	163	142.6 Å²	142.6	76%	0.762	72%	0.715	S	S	*	*			trans	36.7	160.7	137.3	-80.4	-154.7	144.2	0	0	124.9
201	S	39	Very low	39.2	Very low	81 Å²	81	142.5 Å²	142.5	57%	0.566	72%	0.717	S	S	*	*			cis	-169.7	-176.2	-11.5	-115	0	0	0	0	112.2
202	D	39.4	Very low	39.1	Very low	105 Å²	105	142.5 Å²	142.5	56%	0.561	72%	0.724	S	S	*	*			trans	92.6	114.8	141.6	-80.8	-27.6	0	0	0	125.1
203	R	36.9	Very low	38.7	Very low	212 Å²	212	144.2 Å²	144.2	80%	0.8	73%	0.732	S	S	*	*				87.6	91	124.7	-69.5	169.3	-155.8	166.4	22.2	123.1
204	Q	31.7	Very low	38.2	Very low	153 Å²	153	146.5 Å²	146.5	72%	0.715	74%	0.738	S	S	*	*				-24.2	159	118.8	-75.8	-91.5	-21.2	0	0	115.2
205	P	39	Very low	37.8	Very low	117 Å²	117	146.4 Å²	146.4	76%	0.76	75%	0.748	S	S	*	*			cis	-154.2	175	47.2	43.6	-22.1	0	0	0	121.1
206	K	34.7	Very low	37.3	Very low	146 Å²	146	146.3 Å²	146.3	64%	0.635	76%	0.756	S	S	*	*			trans	-31.7	159.5	159.7	-53.2	166.4	-178.2	177.6	0	117.4
207	F	30.5	Very low	36.8	Very low	213 Å²	213	144.2 Å²	144.2	93%	0.934	76%	0.756	S	S	*	*				-126.6	133.9	128.7	-119.6	-85.3	0	0	0	110.1
208	N	31.3	Very low	36.3	Very low	119 Å²	119	148.1 Å²	148.1	64%	0.636	77%	0.767	S	S	*	*			trans	-102.7	156.2	175.8	-62.3	-3.4	0	0	0	109.9
209	S	34.3	Very low	35.5	Very low	118 Å²	118	149.7 Å²	149.7	83%	0.825	78%	0.776	S	S	*	*			trans	-168.5	137.3	133.2	55.1	0	0	0	0	111.6
210	E	34	Very low	34.9	Very low	182 Å²	182	148.7 Å²	148.7	85%	0.85	78%	0.775	S	S	*	*			trans	-76.3	168.4	170.1	-84.2	169.8	113.3	0	0	112.6
211	P	44.6	Very low	34.3	Very low	121 Å²	121	147 Å²	147	79%	0.786	78%	0.776	S	S	*	*			trans	-83.1	154.5	179.9	34.2	-36.1	0	0	0	113.4
212	T	35.7	Very low	34	Very low	140 Å²	140	150.2 Å²	150.2	86%	0.859	78%	0.78	S	S	*	*			trans	-137.3	148.6	162.5	50.2	0	0	0	0	109.8
213	E	33.7	Very low	33.8	Very low	190 Å²	190	152.1 Å²	152.1	89%	0.888	79%	0.789	S	S	*	*			trans	-79.6	-168.9	176.5	-62.6	-175.2	111.7	0	0	112.3
214	E	34.9	Very low	33.8	Very low	187 Å²	187	147.3 Å²	147.3	87%	0.874	78%	0.776	S	S	*	*			trans	70.3	86	177.8	-57	-157.3	154	0	0	118.1
215	A	35.6	Very low	33.8	Very low	100 Å²	100	150.3 Å²	150.3	83%	0.826	78%	0.782	S	S	*	*			trans	-144.4	88.7	151.6	0	0	0	0	0	111.3	A217	A215-A217 PolarHBondContact O-N 3.21Å
216	N	28.5	Very low	33.5	Very low	171 Å²	171	150.8 Å²	150.8	91%	0.914	77%	0.774	S	S	*	*			trans	-69.3	93.5	176	-82.6	-58.9	0	0	0	112.1
217	A	32	Very low	33.5	Very low	84 Å²	84	149.5 Å²	149.5	69%	0.694	78%	0.778	S	S	*	*			trans	-165.3	77.7	164.9	0	0	0	0	0	114.6	A215	A215-A217 PolarHBondContact O-N 3.21Å
218	Y	32.7	Very low	33.3	Very low	218 Å²	218	143.8 Å²	143.8	86%	0.855	77%	0.765	S	S	*	*			trans	-177.2	71.3	133.9	-110.7	-71.2	0	0	0	112.5
219	M	25.4	Very low	33.4	Very low	176 Å²	176	146.4 Å²	146.4	87%	0.867	78%	0.779	S	S	*	*			trans	-87.2	171.6	147.4	-81.3	-97.3	-79.1	0	0	108.8
220	D	32.6	Very low	33.3	Very low	126 Å²	126	144.1 Å²	144.1	67%	0.674	78%	0.775	S	S	*	*			trans	59.2	83.8	179	-80.3	-32	0	0	0	117.2
221	V	33.8	Very low	32.9	Very low	127 Å²	127	142.6 Å²	142.6	77%	0.77	78%	0.778	S	S	*	*				-124.4	102.6	121.7	179.1	0	0	0	0	108.7
222	K	33.8	Very low	32.3	Very low	150 Å²	150	141.1 Å²	141.1	65%	0.652	78%	0.776	S	S	*	*			trans	-72.3	136.8	161.7	-72.4	-178.5	178.2	-179.4	0	110.4	E224	K222-E224 HydrophobicContact CB-CB 4.47Å
223	L	35	Very low	32.1	Very low	145 Å²	145	139.9 Å²	139.9	76%	0.759	77%	0.773	S	S	*	*			trans	-158.7	93.1	152.7	-96.8	172.1	0	0	0	103.8
224	E	36	Very low	32	Very low	111 Å²	111	139.5 Å²	139.5	52%	0.519	77%	0.771	S	S	.	*			cis	60.7	54.4	39.8	-156.4	169.4	173.2	0	0	113.5	K222 Q226	K222-E224 HydrophobicContact CB-CB 4.47Å; E224-Q226 HydrophobicContact CG-CG 3.93Å; E224-Q226 PolarHBondContact OE1-NE2 2.75Å
225	Y	32.8	Very low	31.8	Very low	215 Å²	215	139.3 Å²	139.3	84%	0.843	77%	0.77	S	S	*	*				-89.8	123.4	127.6	-77.5	-89.7	0	0	0	105.7
226	Q	32.9	Very low	31.6	Very low	128 Å²	128	139.4 Å²	139.4	60%	0.598	77%	0.771	S	S	*	*			cis	55.2	114.5	28.6	-71	-167.7	29	0	0	112.7	E224	E224-Q226 HydrophobicContact CG-CG 3.93Å; E224-Q226 PolarHBondContact OE1-NE2 2.75Å
227	T	32.6	Very low	31.8	Very low	118 Å²	118	135.6 Å²	135.6	72%	0.724	76%	0.763	S	S	*	*			cis	-157.7	158.1	1.5	-13.9	0	0	0	0	112.2
228	S	28.4	Very low	32	Very low	94 Å²	94	140.3 Å²	140.3	66%	0.657	77%	0.771	S	S	*	*			trans	-6.9	127.4	157.3	55.4	0	0	0	0	119.5
229	N	32.8	Very low	31.9	Very low	173 Å²	173	136 Å²	136	93%	0.925	77%	0.767	S	S	*	*			trans	-178.4	122.8	133	-90.4	-21.4	0	0	0	108.9
230	G	31.1	Very low	32.3	Very low	71 Å²	71	135 Å²	135	73%	0.732	76%	0.76	S	S	*	*			cis	170.3	127.2	-8.4	0	0	0	0	0	110.6
231	T	26.2	Very low	32.3	Very low	150 Å²	150	137 Å²	137	92%	0.92	76%	0.759	S	S	*	*			trans	-137.9	81.6	-176.1	50.6	0	0	0	0	112.6
232	A	33.2	Very low	32.5	Very low	89 Å²	89	136.4 Å²	136.4	74%	0.736	75%	0.748	S	S	*	*			trans	-162.2	108.7	167.5	0	0	0	0	0	106.3
233	S	30.2	Very low	32.6	Very low	115 Å²	115	136 Å²	136	80%	0.804	75%	0.752	S	S	*	*				72.8	69.6	80.6	76.3	0	0	0	0	115.1
234	Q	32.9	Very low	32.6	Very low	182 Å²	182	135 Å²	135	85%	0.85	75%	0.747	S	S	*	*			trans	-159	124.4	148.5	-107.3	168.8	-13.5	0	0	105.6
235	E	30.5	Very low	32.8	Very low	183 Å²	183	135.9 Å²	135.9	86%	0.855	75%	0.751	S	S	*	*			cis	76.8	123	33.4	-159.1	172.2	-123.5	0	0	113.5
236	A	29.7	Very low	32.8	Very low	101 Å²	101	132.8 Å²	132.8	84%	0.835	74%	0.744	S	S	*	*			trans	61.9	129.2	-167.4	0	0	0	0	0	114.8
237	A	33	Very low	32.7	Very low	92 Å²	92	130.4 Å²	130.4	76%	0.76	74%	0.741	S	S	*	*			cis	-155.5	175	16.3	0	0	0	0	0	114.1
238	Q	35.6	Very low	32.7	Very low	183 Å²	183	134 Å²	134	86%	0.855	75%	0.747	S	S	*	*			trans	81.2	56	148.3	-137.7	133.7	23.4	0	0	120.4
239	V	31.3	Very low	32.7	Very low	126 Å²	126	133.4 Å²	133.4	76%	0.764	75%	0.748	S	S	*	*				-36.4	137.4	121.4	166.7	0	0	0	0	110.4
240	H	34.8	Very low	32.9	Very low	155 Å²	155	130 Å²	130	72%	0.718	74%	0.735	S	S	*	*			cis	-154.5	174.9	-4.6	-132.5	-119.9	0	0	0	108
241	Y	31.9	Very low	33	Very low	169 Å²	169	134.5 Å²	134.5	66%	0.663	74%	0.741	S	S	*	*			trans	-98.2	133.7	139.4	-118.5	-84.8	0	0	0	108.2	Q834 E835	Y241-Q834 PolarHBondContact OH-O 3.07Å; Y241-E835 PolarHBondContact OH-N 2.78Å; Y241-E835 VanDerWaalsContact OH-N 3.15Å
242	E	37.5	Very low	33.4	Very low	114 Å²	114	131 Å²	131	53%	0.533	73%	0.727	S	S	.	*			trans	-95.5	171.7	-163.7	-159.7	160	-126.4	0	0	111.5
243	I	37	Very low	33.4	Very low	143 Å²	143	133.8 Å²	133.8	73%	0.733	73%	0.73	S	S	*	*			trans	92.1	114.7	164.3	-55.4	167.7	0	0	0	114.4
244	D	35	Very low	33.5	Very low	122 Å²	122	133 Å²	133	65%	0.652	73%	0.73	S	S	*	*			cis	-126.7	143	-5.4	-83.5	-44.7	0	0	0	108.4
245	E	39	Very low	33.3	Very low	130 Å²	130	127.7 Å²	127.7	61%	0.607	73%	0.725	S	S	*	*				61.7	107	62.6	-68.3	-77.7	92.9	0	0	111.7
246	Q	32.9	Very low	33.4	Very low	151 Å²	151	123.9 Å²	123.9	71%	0.706	72%	0.724	S	S	*	*				67.5	148.3	97.3	-75.8	-157.5	66.4	0	0	115.2
247	S	30.3	Very low	33.5	Very low	77 Å²	77	123.4 Å²	123.4	54%	0.538	72%	0.72	S	S	.	*			cis	-166.9	145.8	-20.1	43.7	0	0	0	0	105.5
248	F	33.3	Very low	33.5	Very low	194 Å²	194	124.1 Å²	124.1	85%	0.851	72%	0.716	S	S	*	*				174	150.8	84.9	-105.5	-81.8	0	0	0	110
249	A	27.8	Very low	33.4	Very low	81 Å²	81	122.7 Å²	122.7	67%	0.669	71%	0.709	S	S	*	*			trans	-89.1	-176.7	156.5	0	0	0	0	0	108.9
250	P	37.8	Very low	33.4	Very low	101 Å²	101	124.3 Å²	124.3	66%	0.656	71%	0.71	S	S	*	*			cis	-150.6	-176.3	15.3	46.1	-26.3	0	0	0	117.9
251	I	32.9	Very low	33.4	Very low	166 Å²	166	121.4 Å²	121.4	85%	0.851	71%	0.707	S	S	*	*			trans	59.2	134.7	147.3	-69.8	156.9	0	0	0	117.8
252	A	34.1	Very low	33.6	Very low	77 Å²	77	120.7 Å²	120.7	64%	0.636	72%	0.715	S	S	*	*			cis	-141.8	-174.6	-0.9	0	0	0	0	0	107.4
253	D	33.1	Very low	33.6	Very low	148 Å²	148	117.9 Å²	117.9	79%	0.791	71%	0.711	S	S	*	*			cis	-126.5	155.3	11.5	-70.6	-60	0	0	0	108.8
254	A	32.9	Very low	33.7	Very low	98 Å²	98	116.2 Å²	116.2	81%	0.81	70%	0.7	S	S	*	*				50.7	132.9	62.2	0	0	0	0	0	113.8
255	G	29.7	Very low	33.8	Very low	71 Å²	71	117.7 Å²	117.7	73%	0.732	70%	0.701	S	S	*	*			cis	158.2	143.4	-4.6	0	0	0	0	0	110.1
256	A	32.1	Very low	33.9	Very low	102 Å²	102	114.2 Å²	114.2	84%	0.843	69%	0.69	S	S	*	*			trans	69.9	147.1	176.3	0	0	0	0	0	118.6
257	A	31.9	Very low	34.1	Very low	92 Å²	92	114.2 Å²	114.2	76%	0.76	69%	0.687	S	S	*	*			trans	25.3	147.9	134.6	0	0	0	0	0	121.4
258	T	32.9	Very low	34.3	Very low	107 Å²	107	116.7 Å²	116.7	66%	0.656	69%	0.694	S	S	*	*			cis	-179.7	159	-4.7	-93.3	0	0	0	0	107.1
259	E	32.4	Very low	34.5	Very low	152 Å²	152	116.5 Å²	116.5	71%	0.71	70%	0.696	S	S	*	*			trans	65.7	116.4	162.7	-81.6	158	-132.3	0	0	121.4
260	M	32.4	Very low	35.2	Very low	160 Å²	160	117 Å²	117	79%	0.788	70%	0.7	S	S	*	*			trans	66.6	152.7	137	-51.9	-171.2	-68.9	0	0	119.2
261	S	34.9	Very low	35.4	Very low	94 Å²	94	117.5 Å²	117.5	66%	0.657	70%	0.703	S	S	*	*			cis	-147.2	160.3	7.5	-22.6	0	0	0	0	112.1
262	D	36.1	Very low	35.5	Very low	155 Å²	155	119.8 Å²	119.8	83%	0.829	70%	0.703	S	S	*	*			trans	36.5	138.5	139.5	-48.2	-31.8	0	0	0	122.2
263	A	36.8	Very low	35.5	Very low	55 Å²	55	122.6 Å²	122.6	46%	0.455	71%	0.705	S	S	.	*			cis	-140.3	-142.9	-14	0	0	0	0	0	108.3	D873	A263-D873 PolarHBondContact N-OD2 2.77Å
264	E	39.6	Very low	35.7	Very low	107 Å²	107	121.4 Å²	121.4	50%	0.5	70%	0.698	S	S	.	*			cis	-158.7	173.7	-8.7	-140.9	-59.9	81.9	0	0	107.2	I872	E264-I872 WeakPolarHBondContact O-CA 3.06Å; E264-I872 WeakPolarHBondContact O-CG1 3.5Å; E264-I872 PolarHBondContact O-N 2.88Å
265	K	37.6	Very low	35.9	Very low	154 Å²	154	122.5 Å²	122.5	67%	0.67	69%	0.689	S	S	*	*			trans	-85	-161.6	172.3	-109.5	167.9	-173.8	175.6	0	110.7	I872	K265-I872 PolarHBondContact O-N 3.18Å
266	P	41.4	Very low	36.3	Very low	57 Å²	57	127.3 Å²	127.3	37%	0.37	69%	0.692	S	S	.	*			cis	-141	164.2	13	45.6	-27.2	0	0	0	118.8	K870	P266-K870 WeakPolarHBondContact CD-O 3.41Å
267	K	36.1	Very low	36.5	Very low	150 Å²	150	127.9 Å²	127.9	65%	0.652	69%	0.686	S	S	*	*			trans	49.2	137.2	131.1	-63.7	-171.4	159.3	-132.1	0	122.3
268	D	33.6	Very low	36.7	Very low	129 Å²	129	131 Å²	131	69%	0.69	68%	0.684	S	S	*	*			cis	-128.3	-95	-13.6	-89.2	-46.4	0	0	0	111.9
269	E	38.2	Very low	36.8	Very low	190 Å²	190	135 Å²	135	89%	0.888	69%	0.689	S	S	*	*			cis	-162.1	153.4	-6.2	-167.4	175.5	-71.6	0	0	107.7
270	A	42	Very low	37.1	Very low	92 Å²	92	136 Å²	136	76%	0.76	69%	0.694	S	S	*	*			trans	-142.5	152.4	-178.9	0	0	0	0	0	113.2
271	P	42.9	Very low	37.3	Very low	111 Å²	111	135.6 Å²	135.6	72%	0.721	69%	0.69	S	S	*	*			trans	-150.7	147.2	147	37.9	-21	0	0	0	117.5
272	Y	34.6	Very low	37.3	Very low	214 Å²	214	138.3 Å²	138.3	84%	0.839	69%	0.692	S	S	*	*			trans	65.8	143.4	135.8	-78.1	-137.8	0	0	0	119
273	M	34	Very low	37	Very low	137 Å²	137	136.6 Å²	136.6	68%	0.675	69%	0.687	S	S	*	*			cis	-153.2	156.8	-4.4	-96.3	-95.2	-80	0	0	106.1
274	D	38.3	Very low	36.6	Very low	123 Å²	123	142.5 Å²	142.5	66%	0.658	71%	0.708	S	S	*	*				-173.3	160.5	71.6	-133.3	-18.9	0	0	0	113
275	I	37.1	Very low	36.4	Very low	121 Å²	121	142.4 Å²	142.4	62%	0.621	72%	0.719	S	S	*	*			trans	58.8	89.2	156	-60.8	165.8	0	0	0	117.3
276	Q	37	Very low	36.2	Very low	171 Å²	171	142 Å²	142	80%	0.799	72%	0.723	S	S	*	*				58.5	132.3	117.2	-64.3	161.5	-8.5	0	0	119.3
277	T	36.6	Very low	35.9	Very low	115 Å²	115	145.4 Å²	145.4	71%	0.706	74%	0.743	S	S	*	*			cis	-136.5	130.7	20.2	45.1	0	0	0	0	113.9
278	H	35.9	Very low	35.8	Very low	156 Å²	156	145.1 Å²	145.1	72%	0.722	75%	0.748	S	S	*	*			trans	53.7	116.4	153.7	-56	-65.7	0	0	0	119.4
279	Y	36.1	Very low	35.9	Very low	193 Å²	193	145.9 Å²	145.9	76%	0.757	75%	0.752	S	S	*	*				66.5	130.3	68.9	-78.9	-79.2	0	0	0	111.8
280	E	38.2	Very low	35.6	Very low	173 Å²	173	144.5 Å²	144.5	81%	0.808	75%	0.751	S	S	*	*			cis	-146.1	177.5	5.4	-162.1	146.6	-131.7	0	0	111.6
281	Q	36.2	Very low	35.1	Very low	151 Å²	151	143.2 Å²	143.2	71%	0.706	75%	0.746	S	S	*	*			trans	-122.4	145.6	-170.7	173.8	175.3	-14.1	0	0	112.4
282	E	34.7	Very low	34.4	Very low	150 Å²	150	146.5 Å²	146.5	70%	0.701	75%	0.752	S	S	*	*			trans	71.7	125.2	163.2	-86.6	163.3	-142.8	0	0	120.9
283	T	30.6	Very low	34.3	Very low	119 Å²	119	141.4 Å²	141.4	73%	0.73	75%	0.745	S	S	*	*			trans	69.5	115.1	149.2	57.9	0	0	0	0	120.7
284	M	28.7	Very low	34.2	Very low	180 Å²	180	140.9 Å²	140.9	89%	0.887	75%	0.749	S	S	*	*			trans	73.4	135.9	157.9	-55	-173.7	-176.7	0	0	118.3
285	S	34.9	Very low	34	Very low	105 Å²	105	144.6 Å²	144.6	73%	0.734	75%	0.754	S	S	*	*			trans	61.5	95	156.9	-61.4	0	0	0	0	119.2
286	D	34.1	Very low	33.8	Very low	144 Å²	144	146.1 Å²	146.1	77%	0.77	76%	0.759	S	S	*	*			trans	65.6	103.5	133.9	-48.7	-31.8	0	0	0	121.2
287	V	33.6	Very low	33.9	Very low	129 Å²	129	141.9 Å²	141.9	78%	0.782	75%	0.748	S	S	*	*				43.4	123.4	123.5	-176.3	0	0	0	0	119.2
288	L	35	Very low	34	Very low	145 Å²	145	140 Å²	140	76%	0.759	73%	0.731	S	S	*	*				-177.2	142.7	127.3	-102.4	162.8	0	0	0	112.4
289	D	34.3	Very low	34.3	Very low	144 Å²	144	138.7 Å²	138.7	77%	0.77	73%	0.725	S	S	*	*	S	Bend	trans	-144.5	152.2	144.3	-161.5	13.5	0	0	0	110.4	G291	D289-G291 PolarHBondContact O-N 2.82Å
290	D	32	Very low	34.6	Very low	162 Å²	162	132.5 Å²	132.5	87%	0.866	71%	0.714	S	S	*	*	S	Bend	trans	4.2	94.4	-176.7	-87.6	-19.3	0	0	0	119.4
291	G	32.4	Very low	34.7	Very low	64 Å²	64	132.7 Å²	132.7	66%	0.66	72%	0.715	S	S	*	*			trans	-163.4	15.3	172.6	0	0	0	0	0	117.4	D289	D289-G291 PolarHBondContact O-N 2.82Å
292	Q	28.7	Very low	35.2	Very low	180 Å²	180	130.7 Å²	130.7	84%	0.841	71%	0.706	S	S	*	*			trans	-62.3	149	178.8	-78.8	-163.7	0.4	0	0	112.6
293	P	31.1	Very low	35.7	Very low	108 Å²	108	126 Å²	126	70%	0.701	69%	0.689	S	S	*	*			cis	-137.3	-174.1	15	31.4	-7.9	0	0	0	115.8
294	V	33.5	Very low	36.2	Very low	125 Å²	125	125.8 Å²	125.8	76%	0.758	67%	0.674	S	S	*	*			trans	85.6	105	159.1	-168.6	0	0	0	0	117.8
295	R	33.1	Very low	36.8	Very low	202 Å²	202	122.8 Å²	122.8	76%	0.762	66%	0.656	S	S	*	*			trans	27.2	139.9	132.2	-71.7	175	147.3	124.2	6.1	121.6
296	E	33.7	Very low	37	Very low	152 Å²	152	123.3 Å²	123.3	71%	0.71	66%	0.66	S	S	*	*			trans	67.4	126.3	138.6	-66.9	151.9	-141	0	0	116.1
297	S	39	Very low	37.1	Very low	83 Å²	83	121.2 Å²	121.2	58%	0.58	66%	0.656	S	S	*	*			trans	68.6	150.7	169.7	-67.1	0	0	0	0	116
298	E	39.2	Very low	37.4	Very low	74 Å²	74	122.3 Å²	122.3	35%	0.346	66%	0.656	S	S	.	*			cis	-167.7	142.3	-6	-102.4	147.3	-157.5	0	0	107.8	T912 D913 K914	E298-T912 CarbonylContact C-O 3.44Å; E298-T912 VanDerWaalsContact CA-O 3.26Å; E298-T912 WeakPolarHBondContact CA-O 3.36Å; E298-T912 HydrophobicContact CG-CG2 3.93Å; E298-D913 WeakPolarHBondContact CB-OD2 3.33Å; E298-K914 VanDerWaalsContact C-NZ 3.35Å; E298-K914 HydrophobicContact CB-CD 4.3Å; E298-K914 VanDerWaalsContact CB-CE 3.43Å; E298-K914 HydrophobicContact CB-CG 3.93Å; E298-K914 HydrophobicContact CG-CG 4.08Å; E298-K914 PolarHBondContact O-NZ 3.34Å; E298-K914 WeakPolarHBondContact OE2-CE 3.27Å; E298-K914 WeakPolarHBondContact OE2-CG 3.4Å
299	E	41.3	Very low	37.4	Very low	129 Å²	129	122.5 Å²	122.5	60%	0.603	66%	0.656	S	S	*	*			trans	-84.7	-127.1	-160.8	-56.3	142.1	-146	0	0	119.4	T912 D913	E299-T912 WeakPolarHBondContact CB-O 3.26Å; E299-T912 WeakPolarHBondContact CG-O 3.38Å; E299-T912 PolarHBondContact N-O 3.14Å; E299-T912 VanDerWaalsContact OE1-C 3.28Å; E299-T912 PolarHBondContact OE1-N 3.25Å; E299-D913 HydrophobicContact CB-CB 3.98Å; E299-D913 PolarHBondContact N-OD2 3.26Å
300	A	41.7	Very low	37.5	Very low	63 Å²	63	121.2 Å²	121.2	52%	0.521	65%	0.654	S	S	.	*			trans	90.7	154.7	176	0	0	0	0	0	123.8	D913	A300-D913 HydrophobicContact CB-CB 3.95Å; A300-D913 VanDerWaalsContact CB-CG 3.48Å; A300-D913 WeakPolarHBondContact CB-OD1 3.35Å
301	E	41.7	Very low	37.8	Very low	178 Å²	178	118.6 Å²	118.6	83%	0.832	65%	0.648	S	S	*	*			trans	-114.6	141.9	-172.9	-69.3	-179.6	130.9	0	0	115.1
302	E	45.1	Very low	37.9	Very low	109 Å²	109	120 Å²	120	51%	0.509	65%	0.654	S	S	.	*			trans	68.5	153.2	140.6	-73.1	-102.9	123.2	0	0	122.3	E358 E359	E302-E358 WeakPolarHBondContact OE1-CA 3.41Å; E302-E359 PolarHBondContact OE1-N 3.36Å; E302-E359 VanDerWaalsContact OE1-N 3.1Å
303	P	46.9	Very low	38	Very low	52 Å²	52	119.5 Å²	119.5	34%	0.338	65%	0.651	S	S	.	*			trans	-128.4	154.7	-130.7	15.3	10.3	0	0	0	121.6	E356 E358	P303-E356 HydrophobicContact CB-CB 4.08Å; P303-E356 HydrophobicContact CB-CG 4.5Å; P303-E358 HydrophobicContact CG-CB 4.29Å
304	R	40.5	Very low	38.4	Very low	113 Å²	113	121.6 Å²	121.6	43%	0.426	65%	0.652	S	S	.	*			trans	87.7	87.4	131.7	-71.3	167	-179	168.8	-0.3	121.7	E356 E357 E358	R304-E356 WeakPolarHBondContact CA-OE2 3.31Å; R304-E356 PolarHBondContact N-OE1 3.36Å; R304-E356 PolarHBondContact N-OE2 3.35Å; R304-E357 IonicContact CZ-OE1 2.98Å; R304-E357 IonicContact NE-OE1 2.95Å; R304-E357 PolarHBondContact NE-OE1 3.15Å; R304-E357 IonicContact NH2-OE1 2.71Å; R304-E357 PolarHBondContact NH2-OE1 3.19Å; R304-E357 IonicContact NH2-OE2 3.14Å; R304-E357 PolarHBondContact NH2-OE2 3.47Å; R304-E358 IonicContact CZ-OE1 2.65Å; R304-E358 IonicContact CZ-OE2 2.74Å; R304-E358 IonicContact NH1-OE1 2.95Å; R304-E358 PolarHBondContact NH1-OE1 2.86Å; R304-E358 IonicContact NH1-OE2 3.2Å; R304-E358 PolarHBondContact NH1-OE2 2.87Å; R304-E358 IonicContact NH2-OE2 3.07Å; R304-E358 PolarHBondContact NH2-OE2 3.34Å
305	K	40.4	Very low	38.4	Very low	118 Å²	118	123.9 Å²	123.9	51%	0.513	65%	0.654	S	S	.	*				61.2	145.1	112.2	-65.9	171.1	174.5	91.5	0	123.3	E355 E356	K305-E355 VanDerWaalsContact CE-OE1 3.29Å; K305-E355 WeakPolarHBondContact CE-OE1 3.45Å; K305-E355 IonicContact NZ-OE1 2.67Å; K305-E355 PolarHBondContact NZ-OE1 3.25Å; K305-E356 IonicContact NZ-OE2 2.7Å; K305-E356 PolarHBondContact NZ-OE2 3.46Å
306	S	38.9	Very low	38.6	Very low	116 Å²	116	119.1 Å²	119.1	81%	0.811	65%	0.649	S	S	*	*			trans	87.6	147.9	155.9	85.7	0	0	0	0	118.9
307	S	36.9	Very low	38.8	Very low	99 Å²	99	118.3 Å²	118.3	69%	0.692	65%	0.649	S	S	*	*			cis	-147.9	124.7	-0.3	69.7	0	0	0	0	111.6
308	I	39.6	Very low	38.6	Very low	152 Å²	152	121.5 Å²	121.5	78%	0.779	66%	0.655	S	S	*	*				76.9	148.2	89.5	-59.4	157.2	0	0	0	115.3
309	I	35.3	Very low	38.4	Very low	149 Å²	149	123.9 Å²	123.9	76%	0.764	67%	0.666	S	S	*	*			trans	95.1	121.8	175.4	-56	-176.1	0	0	0	115.2
310	T	37.2	Very low	38	Very low	118 Å²	118	122.5 Å²	122.5	72%	0.724	67%	0.668	S	S	*	*			cis	-160.4	121.2	-14.3	25.4	0	0	0	0	112.6
311	S	38.6	Very low	37.9	Very low	106 Å²	106	126.1 Å²	126.1	74%	0.741	69%	0.686	S	S	*	*				45.3	124.1	128.2	71	0	0	0	0	125
312	A	32.8	Very low	37.6	Very low	94 Å²	94	122.3 Å²	122.3	78%	0.777	68%	0.675	S	S	*	*				95.7	131.4	119	0	0	0	0	0	124.1
313	H	32.3	Very low	37.1	Very low	170 Å²	170	121.9 Å²	121.9	79%	0.787	68%	0.684	S	S	*	*			trans	90.4	137	140.7	-145.3	16.9	0	0	0	120.4
314	E	38.7	Very low	36.9	Very low	152 Å²	152	126.5 Å²	126.5	71%	0.71	70%	0.701	S	S	*	*			trans	67.4	129.5	174.3	-67.3	174.7	162.4	0	0	113.7
315	E	33	Very low	36.9	Very low	173 Å²	173	126.2 Å²	126.2	81%	0.808	71%	0.708	S	S	*	*				59	123.6	66.2	-168.7	-176.9	-103.2	0	0	111.8
316	P	36.8	Very low	37.3	Very low	101 Å²	101	127.2 Å²	127.2	66%	0.656	72%	0.719	S	S	*	*			cis	-132.1	-163.9	-8.7	39.3	-20.1	0	0	0	113.5
317	L	38.3	Very low	37	Very low	136 Å²	136	129.8 Å²	129.8	71%	0.712	72%	0.716	S	S	*	*			trans	71.2	128.6	160.6	-63.8	169.2	0	0	0	115.4
318	E	35.3	Very low	37.1	Very low	149 Å²	149	130.3 Å²	130.3	70%	0.696	72%	0.715	S	S	*	*				56.6	126	71.4	-62.7	-162.2	134.7	0	0	112.8
319	Q	36.2	Very low	37	Very low	125 Å²	125	127.7 Å²	127.7	58%	0.584	71%	0.708	S	S	*	*			cis	-158.7	172.1	5.7	-107.6	164	25.1	0	0	108.4
320	P	31.8	Very low	37.1	Very low	100 Å²	100	127.5 Å²	127.5	65%	0.649	71%	0.708	S	S	*	*	S	Bend	trans	-53.5	161.3	167.9	22.9	-35.2	0	0	0	112.9	V322	P320-V322 WeakPolarHBondContact O-CG2 3.2Å; P320-V322 PolarHBondContact O-N 3.38Å
321	P	40.5	Very low	37.3	Very low	139 Å²	139	129.3 Å²	129.3	90%	0.903	71%	0.708	S	S	*	*	S	Bend	trans	-54.1	106.1	-169.6	19.8	-33.4	0	0	0	113.3
322	V	34.1	Very low	37.2	Very low	98 Å²	98	131.3 Å²	131.3	59%	0.594	71%	0.706	S	S	*	*			trans	-75.2	160	-167.3	-158.3	0	0	0	0	112.3	P320	P320-V322 WeakPolarHBondContact O-CG2 3.2Å; P320-V322 PolarHBondContact O-N 3.38Å
323	S	34.5	Very low	37.3	Very low	99 Å²	99	134.7 Å²	134.7	69%	0.692	71%	0.706	S	S	*	*			trans	107.6	132	138.1	79.6	0	0	0	0	117.6
324	E	43.8	Very low	37.5	Very low	150 Å²	150	133.9 Å²	133.9	70%	0.701	71%	0.706	S	S	*	*			cis	-167.3	158.4	-1.6	-124.1	175	-135.1	0	0	113.9
325	N	39.9	Very low	37.4	Very low	107 Å²	107	130.6 Å²	130.6	57%	0.572	70%	0.704	S	S	*	*			trans	66.8	144.5	151	-57.1	-26.5	0	0	0	120.2
326	D	47.9	Very low	37.4	Very low	138 Å²	138	130.9 Å²	130.9	74%	0.738	71%	0.706	S	S	*	*			cis	-132.7	130.7	2.9	-86.8	-52	0	0	0	108.9
327	F	34.2	Very low	37.2	Very low	170 Å²	170	129.9 Å²	129.9	75%	0.746	69%	0.692	S	S	*	*				55.7	131.2	87.6	-86.1	-109.4	0	0	0	114.9
328	T	37.8	Very low	37	Very low	111 Å²	111	129.3 Å²	129.3	68%	0.681	69%	0.686	S	S	*	*			cis	-177.4	-180	-1.2	14.5	0	0	0	0	107.8
329	P	38.8	Very low	36.7	Very low	97 Å²	97	125.2 Å²	125.2	63%	0.63	67%	0.674	S	S	*	*			cis	-136.8	-163.2	-27.6	36.6	-15.5	0	0	0	113.6
330	D	37.7	Very low	36.8	Very low	144 Å²	144	121.9 Å²	121.9	77%	0.77	66%	0.664	S	S	*	*			trans	85.1	113.2	149	-64.7	-16.6	0	0	0	123
331	E	39.5	Very low	36.9	Very low	156 Å²	156	121.9 Å²	121.9	73%	0.729	66%	0.659	S	S	*	*			trans	68.5	106.2	138.6	-65.7	-143.8	94	0	0	123.1
332	Q	36.5	Very low	36.6	Very low	149 Å²	149	119.6 Å²	119.6	70%	0.696	64%	0.636	S	S	*	*			trans	86.2	126.7	137	-61.5	179.5	35.5	0	0	120.7
333	Q	35.5	Very low	36.6	Very low	165 Å²	165	121.7 Å²	121.7	77%	0.771	64%	0.639	S	S	*	*			trans	90.2	114.1	157.8	-65.2	-176.4	22.5	0	0	120.6
334	I	36.6	Very low	36.4	Very low	152 Å²	152	124.7 Å²	124.7	78%	0.779	64%	0.642	S	S	*	*			trans	87.9	119.8	146.2	-61.2	158.7	0	0	0	118
335	A	36.2	Very low	36	Very low	83 Å²	83	122.8 Å²	122.8	69%	0.686	65%	0.646	S	S	*	*			trans	58	102.3	157.5	0	0	0	0	0	117.9
336	Q	33.7	Very low	35.7	Very low	179 Å²	179	122.3 Å²	122.3	84%	0.836	65%	0.646	S	S	*	*			trans	-116.6	139.7	146.6	-89.6	-171.7	-98.2	0	0	105.7
337	E	33.4	Very low	34.9	Very low	80 Å²	80	123.9 Å²	123.9	37%	0.374	65%	0.649	S	S	.	*			cis	63.3	96.9	28.2	-63.1	-169.3	148.1	0	0	113.5	E927 E928	E337-E927 CarbonylContact C-O 3.08Å; E337-E927 VanDerWaalsContact CA-O 3.29Å; E337-E927 WeakPolarHBondContact CA-O 3.11Å; E337-E928 WeakPolarHBondContact CB-O 3.29Å; E337-E928 VanDerWaalsContact CD-O 3.32Å; E337-E928 HydrophobicContact CG-CB 4.19Å; E337-E928 WeakPolarHBondContact CG-O 3.34Å
338	E	33.4	Very low	34.9	Very low	124 Å²	124	123.7 Å²	123.7	58%	0.579	65%	0.651	S	S	*	*			trans	90.8	98.9	149.1	-135.5	158.9	-127.4	0	0	119.7	E926 E927	E338-E926 WeakPolarHBondContact CA-O 3.36Å; E338-E927 WeakPolarHBondContact CA-O 3.41Å; E338-E927 WeakPolarHBondContact CB-O 3.29Å; E338-E927 PolarHBondContact N-O 2.95Å
339	S	29.8	Very low	35	Very low	64 Å²	64	125.9 Å²	125.9	45%	0.448	65%	0.653	S	S	.	*			trans	79.7	128.4	136.9	73.8	0	0	0	0	120.5	E925 E926	S339-E925 WeakPolarHBondContact CB-O 3.04Å; S339-E926 WeakPolarHBondContact CA-O 3.49Å; S339-E926 PolarHBondContact N-O 3.08Å
340	S	38	Very low	35.1	Very low	54 Å²	54	128.3 Å²	128.3	38%	0.378	66%	0.656	S	S	.	*			trans	66.7	103.8	135.6	149.4	0	0	0	0	116.7	K924 E925	S340-K924 PolarHBondContact OG-NZ 3.21Å; S340-E925 PolarHBondContact N-OE2 2.83Å; S340-E925 VanDerWaalsContact N-OE2 3.17Å
341	L	33.8	Very low	35.3	Very low	101 Å²	101	129.7 Å²	129.7	53%	0.529	66%	0.655	S	S	.	*			cis	60	132.8	14.4	-149.9	69.2	0	0	0	116.4	Y923 K924 E925	L341-Y923 HydrophobicContact CB-CD2 4.22Å; L341-Y923 HydrophobicContact CD2-CD2 3.44Å; L341-Y923 VanDerWaalsContact CD2-CD2 3.44Å; L341-Y923 HydrophobicContact CD2-CE2 3.6Å; L341-Y923 HydrophobicContact CD2-CG 4.1Å; L341-Y923 HydrophobicContact CG-CD2 3.61Å; L341-Y923 HydrophobicContact CG-CE2 3.75Å; L341-K924 WeakPolarHBondContact O-CE 3.33Å; L341-K924 PolarHBondContact O-NZ 3.34Å; L341-E925 WeakPolarHBondContact CB-OE2 3.43Å; L341-E925 WeakPolarHBondContact CD2-OE1 2.41Å; L341-E925 WeakPolarHBondContact CD2-OE2 3.27Å
342	H	32.6	Very low	35.1	Very low	90 Å²	90	128.3 Å²	128.3	42%	0.417	66%	0.658	S	S	.	*			trans	57.9	137.1	-169.3	-179.8	121.7	0	0	0	113	S922 Y923 K924	H342-S922 PolarHBondContact CE1-O 3.41Å; H342-S922 PolarHBondContact ND1-O 3.44Å; H342-Y923 HydrophobicContact CB-CD2 3.79Å; H342-Y923 HydrophobicContact CB-CE2 4.12Å; H342-K924 PolarHBondContact O-NZ 3.08Å
343	E	35.6	Very low	35.2	Very low	143 Å²	143	124.2 Å²	124.2	67%	0.668	65%	0.649	S	S	*	*	S	Bend	cis	-69.9	174.5	-8.4	-72.4	173.5	116.1	0	0	111.1
344	Q	30.5	Very low	35.8	Very low	161 Å²	161	118.6 Å²	118.6	75%	0.752	63%	0.631	S	S	*	*			cis	-158	176	-8	-119.3	166.6	37.5	0	0	106.6
345	S	34.7	Very low	36.1	Very low	111 Å²	111	117.9 Å²	117.9	78%	0.776	62%	0.624	S	S	*	*			trans	88.2	114.7	-170.3	-175.2	0	0	0	0	112.8
346	V	33.8	Very low	36.3	Very low	97 Å²	97	116.5 Å²	116.5	59%	0.588	60%	0.604	S	S	*	*			cis	-117	116.6	26.9	178.3	0	0	0	0	112.8
347	Q	30.6	Very low	36.6	Very low	170 Å²	170	113.5 Å²	113.5	79%	0.794	59%	0.59	S	S	*	*			trans	-98.9	134.2	157.2	-155.7	-178.9	31.8	0	0	108.2
348	E	34.8	Very low	36.9	Very low	167 Å²	167	114.2 Å²	114.2	78%	0.78	59%	0.593	S	S	*	*			trans	59.8	120.5	-180	-53.3	-176	119.1	0	0	114
349	E	40.1	Very low	37.2	Very low	157 Å²	157	116.3 Å²	116.3	73%	0.734	60%	0.603	S	S	*	*				-167.3	156.7	63.9	-116.5	-165.4	179.7	0	0	113.3
350	Q	40.5	Very low	37.6	Very low	147 Å²	147	119.5 Å²	119.5	69%	0.687	62%	0.615	S	S	*	*			trans	73.5	107.5	154	-66.1	178.9	56.5	0	0	121.5
351	K	41.4	Very low	37.6	Very low	173 Å²	173	123 Å²	123	75%	0.752	63%	0.634	S	S	*	*			trans	86.6	111	148.5	-62.1	-178.1	177.6	-179.5	0	118.3
352	T	35.2	Very low	37.6	Very low	128 Å²	128	124.2 Å²	124.2	79%	0.785	65%	0.646	S	S	*	*			cis	86.4	133.2	45.1	66.1	0	0	0	0	114.6
353	A	38.9	Very low	37.8	Very low	63 Å²	63	128.8 Å²	128.8	52%	0.521	67%	0.667	S	S	.	*			cis	-169.8	151.5	-9.1	0	0	0	0	0	113	K914	A353-K914 WeakPolarHBondContact O-CD 3.43Å; A353-K914 VanDerWaalsContact O-CE 3.22Å; A353-K914 WeakPolarHBondContact O-CE 3.18Å
354	A	47.8	Very low	37.9	Very low	47 Å²	47	131.6 Å²	131.6	39%	0.388	68%	0.68	S	S	.	*			trans	-170.4	129.2	144.2	0	0	0	0	0	105	K914	A354-K914 HydrophobicContact CB-CD 4.13Å; A354-K914 VanDerWaalsContact CB-NZ 3.28Å
355	E	42.8	Very low	38.4	Very low	136 Å²	136	135.3 Å²	135.3	64%	0.636	69%	0.688	S	S	*	*			cis	87.7	67.4	3.8	-154	155.4	-135.8	0	0	118.5	K305	K305-E355 VanDerWaalsContact CE-OE1 3.29Å; K305-E355 WeakPolarHBondContact CE-OE1 3.45Å; K305-E355 IonicContact NZ-OE1 2.67Å; K305-E355 PolarHBondContact NZ-OE1 3.25Å
356	E	41.2	Very low	38.4	Very low	54 Å²	54	135.6 Å²	135.6	25%	0.252	69%	0.69	S	S	.	*				46.4	111.5	115.7	-55.6	-175.2	161.8	0	0	119.5	P303 R304 K305	P303-E356 HydrophobicContact CB-CB 4.08Å; P303-E356 HydrophobicContact CB-CG 4.5Å; R304-E356 WeakPolarHBondContact CA-OE2 3.31Å; R304-E356 PolarHBondContact N-OE1 3.36Å; R304-E356 PolarHBondContact N-OE2 3.35Å; K305-E356 IonicContact NZ-OE2 2.7Å; K305-E356 PolarHBondContact NZ-OE2 3.46Å
357	E	40.9	Very low	38.5	Very low	116 Å²	116	135.2 Å²	135.2	54%	0.542	70%	0.697	S	S	.	*			trans	160.8	152.5	137.3	-89.4	162.6	-152.4	0	0	110.7	R304	R304-E357 IonicContact CZ-OE1 2.98Å; R304-E357 IonicContact NE-OE1 2.95Å; R304-E357 PolarHBondContact NE-OE1 3.15Å; R304-E357 IonicContact NH2-OE1 2.71Å; R304-E357 PolarHBondContact NH2-OE1 3.19Å; R304-E357 IonicContact NH2-OE2 3.14Å; R304-E357 PolarHBondContact NH2-OE2 3.47Å
358	E	39.9	Very low	38.9	Very low	95 Å²	95	133.7 Å²	133.7	44%	0.444	70%	0.699	S	S	.	*			cis	-178.2	132.1	-22.1	169.9	161.6	-114.7	0	0	107.8	E302 P303 R304	E302-E358 WeakPolarHBondContact OE1-CA 3.41Å; P303-E358 HydrophobicContact CG-CB 4.29Å; R304-E358 IonicContact CZ-OE1 2.65Å; R304-E358 IonicContact CZ-OE2 2.74Å; R304-E358 IonicContact NH1-OE1 2.95Å; R304-E358 PolarHBondContact NH1-OE1 2.86Å; R304-E358 IonicContact NH1-OE2 3.2Å; R304-E358 PolarHBondContact NH1-OE2 2.87Å; R304-E358 IonicContact NH2-OE2 3.07Å; R304-E358 PolarHBondContact NH2-OE2 3.34Å
359	E	38.6	Very low	38.7	Very low	168 Å²	168	135.5 Å²	135.5	79%	0.785	71%	0.71	S	S	*	*			trans	68.2	149.6	-179.8	-58.7	-179.2	136.4	0	0	115.6	E302	E302-E359 PolarHBondContact OE1-N 3.36Å; E302-E359 VanDerWaalsContact OE1-N 3.1Å
360	D	37.7	Very low	38.3	Very low	131 Å²	131	132.1 Å²	132.1	70%	0.701	71%	0.709	S	S	*	*			cis	-160.1	155.9	25.3	-160.2	3.3	0	0	0	114.9
361	T	38.6	Very low	38.1	Very low	127 Å²	127	132.4 Å²	132.4	78%	0.779	72%	0.715	S	S	*	*			trans	65.1	144.7	164.5	59	0	0	0	0	123.7
362	T	33.6	Very low	37.8	Very low	127 Å²	127	131 Å²	131	78%	0.779	72%	0.715	S	S	*	*			trans	-107.2	170.4	-167.1	51.7	0	0	0	0	115.9
363	E	36.4	Very low	37.7	Very low	186 Å²	186	132.8 Å²	132.8	87%	0.869	71%	0.714	S	S	*	*			trans	71.2	92.3	155.7	-71.3	-173.1	163.2	0	0	120.3
364	E	39.3	Very low	37.5	Very low	202 Å²	202	140.8 Å²	140.8	94%	0.944	73%	0.731	S	S	*	*				-165.3	141.9	117.6	-116	-172.1	-168.2	0	0	111.4
365	R	39.4	Very low	37	Very low	239 Å²	239	147 Å²	147	90%	0.902	75%	0.752	S	S	*	*			trans	-155.5	144	170.4	-154.4	167.8	-174.4	160.4	3.8	114.4
366	S	35.2	Very low	36.7	Very low	118 Å²	118	148.5 Å²	148.5	83%	0.825	76%	0.759	S	S	*	*			trans	61.8	83.3	168.8	50.8	0	0	0	0	117.8
367	A	36.5	Very low	36.4	Very low	88 Å²	88	151.4 Å²	151.4	73%	0.727	78%	0.78	S	S	*	*			trans	-89.1	174.8	146.1	0	0	0	0	0	110.9
368	T	37.4	Very low	36.3	Very low	138 Å²	138	153.7 Å²	153.7	85%	0.847	80%	0.796	S	S	*	*			trans	68.8	75	171.1	63.8	0	0	0	0	118.3
369	M	30.6	Very low	36.3	Very low	205 Å²	205	157.8 Å²	157.8	100%	1.01	82%	0.815	S	S	*	*				-131	117.7	118.2	-119.9	-172.2	179.5	0	0	108.5
370	A	33.3	Very low	36.2	Very low	87 Å²	87	157.2 Å²	157.2	72%	0.719	82%	0.817	S	S	*	*			trans	-132	164.9	-176.4	0	0	0	0	0	110.2
371	D	35	Very low	36.4	Very low	153 Å²	153	160.7 Å²	160.7	82%	0.818	83%	0.829	S	S	*	*			trans	73.1	136.8	175.3	-68.1	-24.9	0	0	0	119.3
372	I	35	Very low	36.4	Very low	144 Å²	144	161.9 Å²	161.9	74%	0.738	83%	0.831	S	S	*	*			trans	74.7	71.4	160.7	-53.3	147	0	0	0	116.8
373	Q	33.8	Very low	36.7	Very low	165 Å²	165	164.6 Å²	164.6	77%	0.771	84%	0.835	S	S	*	*				177	150.7	106.4	-98.3	165.9	67.8	0	0	114.2
374	R	34.3	Very low	37	Very low	231 Å²	231	163.5 Å²	163.5	87%	0.872	84%	0.835	S	S	*	*			trans	69.9	115.4	178.6	-54.5	176.2	-165.8	-174.3	3.6	112.8
375	E	38.2	Very low	37.3	Very low	176 Å²	176	162 Å²	162	82%	0.822	83%	0.826	S	S	*	*			cis	70.3	118.6	26	-157.1	179.3	-170.7	0	0	114.7
376	Q	35.1	Very low	37.3	Very low	168 Å²	168	156 Å²	156	79%	0.785	80%	0.803	S	S	*	*			trans	81.6	119.6	171	-81	177.5	24.9	0	0	121
377	V	36.2	Very low	37.4	Very low	116 Å²	116	155 Å²	155	70%	0.703	79%	0.786	S	S	*	*			trans	70.4	106.6	150.5	-175.1	0	0	0	0	117.9
378	D	37.7	Very low	37.5	Very low	164 Å²	164	157.8 Å²	157.8	88%	0.877	79%	0.789	S	S	*	*				-142.3	127.6	104.1	-88.4	-34.9	0	0	0	108.7
379	E	40.2	Very low	37.4	Very low	180 Å²	180	162 Å²	162	84%	0.841	79%	0.79	S	S	*	*			trans	-118.7	162.3	168.7	-74.4	-172.9	126.5	0	0	108.3
380	D	37.1	Very low	37.7	Very low	156 Å²	156	159.8 Å²	159.8	83%	0.834	78%	0.783	S	S	*	*			trans	64.1	94.9	173.1	-60.3	-23.4	0	0	0	118.7
381	E	42.5	Very low	38.1	Very low	204 Å²	204	160.2 Å²	160.2	95%	0.953	79%	0.786	S	S	*	*				-171.8	94.7	116.2	-103.4	-178.6	-166.4	0	0	111.2
382	D	38.5	Very low	38.3	Very low	153 Å²	153	160.6 Å²	160.6	82%	0.818	79%	0.785	S	S	*	*			trans	-138.4	45.2	177.5	-164.3	22	0	0	0	111.5
383	E	38.6	Very low	38.4	Very low	183 Å²	183	158.3 Å²	158.3	86%	0.855	78%	0.782	S	S	*	*			trans	-118	50.8	-176.1	-71.9	-143.5	139.4	0	0	114.7
384	D	43.7	Very low	38.6	Very low	164 Å²	164	158.2 Å²	158.2	88%	0.877	79%	0.786	S	S	*	*	S	Bend	trans	-147.2	29.3	174.1	-135.6	0.3	0	0	0	115.3
385	K	45.2	Very low	38.9	Very low	171 Å²	171	156.1 Å²	156.1	74%	0.743	78%	0.783	S	S	*	*	S	Bend	trans	-129.7	16.1	-170.3	-143.9	167.8	-170.3	166.9	0	117.2
386	Y	39.5	Very low	38.8	Very low	111 Å²	111	157.2 Å²	157.2	44%	0.435	79%	0.785	S	S	.	*			trans	-122.1	-142	169.9	-72.8	-95.3	0	0	0	110.2	N388 K521 E523	Y386-N388 PolarHBondContact O-N 3.06Å; Y386-K521 HydrophobicContact CD1-CD 3.69Å; Y386-K521 HydrophobicContact CD2-CD 3.59Å; Y386-K521 VanDerWaalsContact CD2-CE 3.46Å; Y386-K521 HydrophobicContact CE1-CD 3.71Å; Y386-K521 HydrophobicContact CE2-CD 3.69Å; Y386-K521 HydrophobicContact CG-CD 3.64Å; Y386-K521 HydrophobicContact CG-CG 4.4Å; Y386-K521 VanDerWaalsContact CZ-NZ 3.32Å; Y386-K521 PolarHBondContact OH-NZ 3.13Å; Y386-E523 WeakPolarHBondContact CA-OE1 3.43Å; Y386-E523 VanDerWaalsContact CB-CD 3.48Å; Y386-E523 WeakPolarHBondContact CB-OE1 3.22Å; Y386-E523 WeakPolarHBondContact CB-OE2 3.4Å
387	H	38	Very low	39	Very low	98 Å²	98	153.7 Å²	153.7	45%	0.454	78%	0.775	S	S	.	*			trans	45.7	59	-170.6	-80.5	-37.2	0	0	0	116.7	E523 S524	H387-E523 VanDerWaalsContact CD2-CG 3.49Å; H387-E523 WeakPolarHBondContact CD2-CG 3.47Å; H387-E523 IonicContact CD2-OE1 2.78Å; H387-E523 PolarHBondContact CD2-OE1 2.8Å; H387-E523 VanDerWaalsContact CD2-OE1 3.24Å; H387-E523 IonicContact CD2-OE2 2.86Å; H387-E523 PolarHBondContact CE1-O 3.13Å; H387-E523 VanDerWaalsContact CG-CD 3.41Å; H387-E523 IonicContact CG-OE1 3.77Å; H387-E523 IonicContact CG-OE2 3.57Å; H387-E523 PolarHBondContact N-OE1 3.44Å; H387-E523 PolarHBondContact N-OE2 3.06Å; H387-E523 IonicContact ND1-OE2 2.75Å; H387-E523 WeakPolarHBondContact NE2-CG 3.48Å; H387-E523 PolarHBondContact NE2-O 3.32Å; H387-S524 VanDerWaalsContact NE2-CA 3.27Å; H387-S524 WeakPolarHBondContact NE2-CA 3.33Å; H387-S524 WeakPolarHBondContact NE2-CB 3.47Å; H387-S524 PolarHBondContact NE2-N 3.38Å; H387-S524 PolarHBondContact NE2-OG 3.32Å
388	N	36.7	Very low	38.9	Very low	147 Å²	147	154 Å²	154	79%	0.786	78%	0.782	S	S	*	*			trans	-148.1	153.8	138.9	-102.7	-64.2	0	0	0	110.9	Y386	Y386-N388 PolarHBondContact O-N 3.06Å
389	Y	35.6	Very low	38.9	Very low	226 Å²	226	152.2 Å²	152.2	89%	0.886	77%	0.772	S	S	*	*	S	Bend	trans	67	74	-175.9	-48.6	-77.1	0	0	0	116.6
390	D	38.1	Very low	38.7	Very low	159 Å²	159	150 Å²	150	85%	0.85	76%	0.761	S	S	*	*				-153.5	115.7	106.5	-162	-3.3	0	0	0	111.3
391	A	40.8	Very low	38.8	Very low	95 Å²	95	149.9 Å²	149.9	79%	0.785	75%	0.753	S	S	*	*			trans	-167.1	49.3	-177.9	0	0	0	0	0	113.4
392	M	39	Very low	38.7	Very low	161 Å²	161	146.6 Å²	146.6	79%	0.793	74%	0.738	S	S	*	*	S	Bend	trans	-126.3	124.5	168.1	-87.4	-65.6	-70.8	0	0	112.7
393	S	37.6	Very low	38.7	Very low	97 Å²	97	145.8 Å²	145.8	68%	0.678	73%	0.733	S	S	*	*			trans	64	53.4	166.6	-61.7	0	0	0	0	118.2	K395	S393-K395 PolarHBondContact O-N 2.91Å
394	L	38.9	Very low	38.3	Very low	162 Å²	162	144.2 Å²	144.2	85%	0.848	73%	0.73	S	S	*	*			trans	-68	111.1	131.8	-95.6	173.1	0	0	0	108.3
395	K	39.7	Very low	38	Very low	187 Å²	187	145 Å²	145	81%	0.813	73%	0.728	S	S	*	*			trans	-126.1	122.3	161.7	-95	-172.3	175.8	178.8	0	109.3	S393	S393-K395 PolarHBondContact O-N 2.91Å
396	K	36.4	Very low	37.7	Very low	199 Å²	199	146 Å²	146	87%	0.865	74%	0.736	S	S	*	*			trans	60	81	176.1	-60.5	-171.3	174.9	-171.3	0	115
397	T	38.2	Very low	37.8	Very low	95 Å²	95	149 Å²	149	58%	0.583	75%	0.754	S	S	*	*			trans	-61.3	128.7	133	41.7	0	0	0	0	108.9	I399	T397-I399 HydrophobicContact CG2-CD1 3.73Å; T397-I399 HydrophobicContact CG2-CG1 4.1Å
398	S	34.4	Very low	37.9	Very low	122 Å²	122	149.9 Å²	149.9	85%	0.853	77%	0.771	S	S	*	*			trans	-116.4	62.4	145	-73.9	0	0	0	0	106.9
399	I	38.4	Very low	37.7	Very low	127 Å²	127	146.6 Å²	146.6	65%	0.651	77%	0.772	S	S	*	*			trans	-78.7	134.7	159.7	-74.2	176.6	0	0	0	104.1	T397	T397-I399 HydrophobicContact CG2-CD1 3.73Å; T397-I399 HydrophobicContact CG2-CG1 4.1Å
400	E	35.5	Very low	37.5	Very low	134 Å²	134	141.6 Å²	141.6	63%	0.626	77%	0.77	S	S	*	*			cis	162	-178.3	7	178.5	-171.6	-133.8	0	0	101.8
401	K	40.1	Very low	37.6	Very low	152 Å²	152	139.8 Å²	139.8	66%	0.661	76%	0.764	S	S	*	*			trans	80.2	134.5	158.5	-50.6	-167.5	179.6	-163.2	0	117.6
402	Q	39.3	Very low	37.2	Very low	136 Å²	136	143.7 Å²	143.7	64%	0.636	76%	0.764	S	S	*	*			cis	-158.5	154.3	-22.7	-129.3	146.1	-0.3	0	0	110.6
403	L	38.6	Very low	37.2	Very low	136 Å²	136	144 Å²	144	71%	0.712	76%	0.763	S	S	*	*			trans	6.5	121.4	143.3	-57.2	174.5	0	0	0	116.2
404	N	30	Very low	37.1	Very low	149 Å²	149	147.9 Å²	147.9	80%	0.797	77%	0.771	S	S	*	*				74.1	100.8	67.3	-72	24.5	0	0	0	113.2
405	E	38.9	Very low	37.1	Very low	180 Å²	180	147.8 Å²	147.8	84%	0.841	77%	0.766	S	S	*	*			trans	-152.7	136.9	155.9	-100.7	158.2	-166.9	0	0	103.8
406	E	37.9	Very low	36.9	Very low	192 Å²	192	145.5 Å²	145.5	90%	0.897	76%	0.758	S	S	*	*			cis	-135.8	173.4	9.3	-59	-173	112.3	0	0	112.4
407	E	42	Very low	36.7	Very low	176 Å²	176	138.7 Å²	138.7	82%	0.822	75%	0.745	S	S	*	*			trans	-135.6	136.2	178.2	-167.6	-162.6	140.2	0	0	111.4
408	S	39.8	Very low	36.6	Very low	115 Å²	115	136.9 Å²	136.9	80%	0.804	75%	0.745	S	S	*	*			trans	65.5	144.1	171.4	-64.8	0	0	0	0	118.1
409	G	31.7	Very low	36.5	Very low	78 Å²	78	139.4 Å²	139.4	80%	0.804	74%	0.743	S	S	*	*			cis	142.5	119.1	-5.4	0	0	0	0	0	113.4
410	S	32.9	Very low	36.6	Very low	121 Å²	121	142.3 Å²	142.3	85%	0.846	75%	0.754	S	S	*	*			trans	177.9	142.4	173	172.4	0	0	0	0	111.3
411	V	39.1	Very low	36.6	Very low	121 Å²	121	144 Å²	144	73%	0.733	76%	0.762	S	S	*	*			cis	-169.2	166.9	-28.4	100.6	0	0	0	0	109.3
412	F	33.1	Very low	36.4	Very low	177 Å²	177	143 Å²	143	78%	0.776	76%	0.763	S	S	*	*			trans	85.9	141.5	170	-86.9	-62.1	0	0	0	121.9
413	E	37.9	Very low	36.1	Very low	167 Å²	167	144 Å²	144	78%	0.78	77%	0.768	S	S	*	*			trans	57.2	122	163.3	-68.5	162.7	-158.6	0	0	117.5
414	E	35.6	Very low	36	Very low	179 Å²	179	145.4 Å²	145.4	84%	0.836	78%	0.776	S	S	*	*			cis	100.3	174	32.9	-160.3	153.9	-129.7	0	0	112.8
415	E	39.6	Very low	36.2	Very low	161 Å²	161	142.2 Å²	142.2	75%	0.752	77%	0.771	S	S	*	*			trans	67.3	165.6	-175	-79.9	-168.2	146.3	0	0	120.6	K789	E415-K789 PolarHBondContact O-NZ 3.43Å
416	E	35.3	Very low	36.3	Very low	138 Å²	138	142.3 Å²	142.3	65%	0.645	77%	0.771	S	S	*	*			trans	-112.7	-177	-161.4	-60.6	155.2	91.4	0	0	112.7	L791	E416-L791 HydrophobicContact CG-CD1 4.14Å; E416-L791 WeakPolarHBondContact OE1-CD1 3.1Å
417	G	33.2	Very low	36.5	Very low	57 Å²	57	141 Å²	141	59%	0.588	77%	0.765	S	S	*	*			trans	114.6	133	139.9	0	0	0	0	0	120.2
418	G	35.1	Very low	36.3	Very low	56 Å²	56	136.5 Å²	136.5	58%	0.577	75%	0.753	S	S	*	*			trans	84.6	113.5	168.4	0	0	0	0	0	114.4
419	E	33	Very low	36.3	Very low	176 Å²	176	136.5 Å²	136.5	82%	0.822	75%	0.747	S	S	*	*			cis	73.2	144.5	25.8	-51.9	-165.3	141.9	0	0	116.7
420	E	39.7	Very low	36.5	Very low	187 Å²	187	141.9 Å²	141.9	87%	0.874	74%	0.744	S	S	*	*			trans	64.7	114.7	179.4	-55.5	-179.1	172.8	0	0	114.4
421	E	34.9	Very low	36.9	Very low	169 Å²	169	140.9 Å²	140.9	79%	0.79	74%	0.737	S	S	*	*			cis	74	138.1	26	-142.6	-168.3	-159.4	0	0	115.7
422	L	37.5	Very low	36.8	Very low	132 Å²	132	141.2 Å²	141.2	69%	0.691	73%	0.73	S	S	*	*			trans	67.5	164.3	171.6	-52	-178.1	0	0	0	116.4
423	E	32	Very low	37	Very low	157 Å²	157	138.7 Å²	138.7	73%	0.734	73%	0.725	S	S	*	*			cis	-163.9	149.1	-48.6	-112.4	-179	173.5	0	0	105.9
424	D	37.9	Very low	36.9	Very low	165 Å²	165	137.9 Å²	137.9	88%	0.882	72%	0.723	S	S	*	*			trans	178.5	106.5	163.7	-98.3	-21.1	0	0	0	107.5
425	A	32.9	Very low	37	Very low	83 Å²	83	136 Å²	136	69%	0.686	71%	0.712	S	S	*	*			cis	89.5	44.1	7.9	0	0	0	0	0	119
426	E	41.8	Very low	36.9	Very low	182 Å²	182	134.8 Å²	134.8	85%	0.85	71%	0.706	S	S	*	*			trans	-151.7	150.5	153.8	-77.4	-170.5	169.4	0	0	107.3
427	E	41.5	Very low	36.9	Very low	165 Å²	165	136.3 Å²	136.3	77%	0.771	71%	0.713	S	S	*	*			cis	-160.8	167.6	-14.8	-105.3	-135.4	107.1	0	0	105.4
428	S	38.5	Very low	37.5	Very low	81 Å²	81	139.4 Å²	139.4	57%	0.566	72%	0.723	S	S	*	*			cis	171.9	165.6	-21.8	-177.3	0	0	0	0	107.9
429	V	38.9	Very low	37.5	Very low	114 Å²	114	145.5 Å²	145.5	69%	0.691	74%	0.737	S	S	*	*			trans	68.3	136	168.6	-163.6	0	0	0	0	114.8
430	R	37.4	Very low	37.8	Very low	192 Å²	192	145 Å²	145	73%	0.725	73%	0.734	S	S	*	*			cis	-144.3	146.8	17.8	-139.9	161.6	-174	114.9	5.3	107.9	Q432	R430-Q432 VanDerWaalsContact NE-OE1 3.09Å; R430-Q432 VanDerWaalsContact NH2-OE1 3.15Å
431	S	41	Very low	37.5	Very low	100 Å²	100	139.6 Å²	139.6	70%	0.699	71%	0.714	S	S	*	*			cis	-150.5	131.6	43.6	-66.4	0	0	0	0	110.1
432	Q	35.7	Very low	37.7	Very low	128 Å²	128	142.5 Å²	142.5	60%	0.598	72%	0.718	S	S	*	*				54.9	120.3	97.4	-64.8	-165.3	-123.6	0	0	113.6	R430	R430-Q432 VanDerWaalsContact NE-OE1 3.09Å; R430-Q432 VanDerWaalsContact NH2-OE1 3.15Å
433	D	37	Very low	37.7	Very low	123 Å²	123	144.5 Å²	144.5	66%	0.658	72%	0.716	S	S	*	*			cis	-141.1	152.5	26.1	-87	-36.7	0	0	0	114.8
434	M	36.8	Very low	38.1	Very low	151 Å²	151	144.9 Å²	144.9	74%	0.744	72%	0.718	S	S	*	*			trans	42.6	136.7	137.7	-54.6	-69.9	-163.6	0	0	120.1
435	K	36.8	Very low	38.2	Very low	139 Å²	139	141.9 Å²	141.9	60%	0.604	71%	0.71	S	S	*	*			cis	-171.9	161.9	16.2	-129	168	176.1	-80.6	0	110.2
436	E	38	Very low	38.2	Very low	135 Å²	135	144 Å²	144	63%	0.631	71%	0.714	S	S	*	*			trans	29.7	141.1	142.9	-68	157.9	-178	0	0	121.3
437	Q	36.1	Very low	37.9	Very low	170 Å²	170	143 Å²	143	79%	0.794	71%	0.709	S	S	*	*			cis	-171.1	159.8	-5.6	-113.6	-178.9	6.4	0	0	107.5
438	P	44.4	Very low	37.6	Very low	123 Å²	123	142.7 Å²	142.7	80%	0.799	71%	0.708	S	S	*	*			trans	-108	94.3	168.5	35.8	-26	0	0	0	113.1
439	E	35.9	Very low	37.2	Very low	184 Å²	184	144.9 Å²	144.9	86%	0.86	72%	0.717	S	S	*	*			trans	-168.3	166	152.8	-120.9	178.9	171	0	0	114.7
440	E	39.1	Very low	37.1	Very low	164 Å²	164	143.6 Å²	143.6	77%	0.766	72%	0.719	S	S	*	*			trans	61.5	113.5	160.6	-71.8	-141.4	113.5	0	0	124.2
441	V	33.8	Very low	36.8	Very low	75 Å²	75	143.3 Å²	143.3	46%	0.455	73%	0.726	S	S	.	*				69.4	103.4	124.5	-175.1	0	0	0	0	120.5	R443	V441-R443 HydrophobicContact CG1-CG 4.02Å
442	R	38.5	Very low	36.6	Very low	230 Å²	230	144.4 Å²	144.4	87%	0.868	73%	0.729	S	S	*	*				-164.4	142.9	120.2	-98.9	156	-169.4	81.9	-8.2	108.9
443	R	38.7	Very low	36.8	Very low	174 Å²	174	146.4 Å²	146.4	66%	0.657	74%	0.738	S	S	*	*			cis	151.5	132.4	-14.9	-108.3	-179.1	-169.5	-156.9	6.8	105.1	V441	V441-R443 HydrophobicContact CG1-CG 4.02Å
444	E	39.5	Very low	36.6	Very low	164 Å²	164	149.7 Å²	149.7	77%	0.766	75%	0.746	S	S	*	*			trans	61.4	146.7	161.2	-62.7	127.8	-138.2	0	0	116
445	S	39	Very low	36.9	Very low	103 Å²	103	148.1 Å²	148.1	72%	0.72	75%	0.747	S	S	*	*			cis	-151	141.4	5.4	50.2	0	0	0	0	107.9
446	V	33.1	Very low	36.8	Very low	126 Å²	126	148.1 Å²	148.1	76%	0.764	75%	0.753	S	S	*	*				55.3	98.1	66.2	-175.2	0	0	0	0	114.6
447	Q	36.3	Very low	36.8	Very low	162 Å²	162	150 Å²	150	76%	0.757	76%	0.761	S	S	*	*			trans	-179.7	115.5	140.6	-144.3	75.6	60.1	0	0	105.8
448	E	34.7	Very low	36.8	Very low	159 Å²	159	150.5 Å²	150.5	74%	0.743	76%	0.764	S	S	*	*				53.7	113.2	69.6	-85.5	-158.9	126.1	0	0	117.5
449	V	31.1	Very low	36.5	Very low	126 Å²	126	152 Å²	152	76%	0.764	76%	0.76	S	S	*	*			trans	56.1	99.1	142.4	-168.7	0	0	0	0	119.9
450	A	37	Very low	36.5	Very low	88 Å²	88	151 Å²	151	73%	0.727	76%	0.755	S	S	*	*			trans	-159.1	108.7	135.8	0	0	0	0	0	107.5
451	E	29.9	Very low	36.3	Very low	185 Å²	185	147.7 Å²	147.7	86%	0.864	76%	0.756	S	S	*	*				52.8	91.6	90.6	-69.9	-160.2	160.9	0	0	115.3
452	T	37.7	Very low	36.7	Very low	124 Å²	124	149.6 Å²	149.6	76%	0.761	77%	0.77	S	S	*	*			trans	-159.3	127	147.8	-11.3	0	0	0	0	111.9
453	E	39.2	Very low	36.6	Very low	170 Å²	170	144 Å²	144	79%	0.794	77%	0.766	S	S	*	*			trans	42.1	136	152.6	-63.8	167.8	140	0	0	121.8
454	K	32.5	Very low	36.5	Very low	191 Å²	191	141.3 Å²	141.3	83%	0.83	77%	0.769	S	S	*	*			cis	74.7	153.6	39.2	-74.8	-167.2	174.1	-175.4	0	115.1
455	P	44.7	Very low	36.3	Very low	118 Å²	118	141.1 Å²	141.1	77%	0.766	77%	0.768	S	S	*	*			cis	-140.3	-151	-31.2	40.6	-20.9	0	0	0	112.5
456	I	34.7	Very low	36.2	Very low	140 Å²	140	144.2 Å²	144.2	72%	0.718	77%	0.771	S	S	*	*			trans	-83	157.9	172.2	-68.4	158.5	0	0	0	111.5
457	E	37.8	Very low	36.3	Very low	173 Å²	173	144.3 Å²	144.3	81%	0.808	77%	0.771	S	S	*	*			trans	75.5	116.5	160	-85.5	154.6	-168.4	0	0	122
458	E	35.7	Very low	36.4	Very low	181 Å²	181	141.1 Å²	141.1	85%	0.846	77%	0.765	S	S	*	*				59.2	113.6	120.3	-164.8	170.4	-127.3	0	0	122
459	E	38.4	Very low	36.1	Very low	155 Å²	155	139.8 Å²	139.8	72%	0.724	76%	0.76	S	S	*	*				-171.5	166.7	109.2	-123.2	-159.4	-175.7	0	0	115
460	Q	34.2	Very low	36.1	Very low	163 Å²	163	144.2 Å²	144.2	76%	0.762	76%	0.763	S	S	*	*			trans	66.6	85.5	162.1	-68.5	169.6	44.7	0	0	119.2
461	A	35.8	Very low	36.3	Very low	95 Å²	95	149.4 Å²	149.4	79%	0.785	77%	0.769	S	S	*	*				70.9	152.2	68	0	0	0	0	0	116
462	P	42.5	Very low	36.7	Very low	115 Å²	115	146.1 Å²	146.1	75%	0.747	76%	0.764	S	S	*	*			cis	-139.3	-171.5	-16.2	37.8	-18.2	0	0	0	115.9
463	S	35.6	Very low	36.3	Very low	112 Å²	112	144.4 Å²	144.4	78%	0.783	76%	0.757	S	S	*	*			trans	86.5	143.8	155.7	84.6	0	0	0	0	117.8
464	V	37	Very low	35.8	Very low	118 Å²	118	144.1 Å²	144.1	72%	0.715	76%	0.756	S	S	*	*			cis	-159.1	170.1	-11	114.3	0	0	0	0	109.8
465	E	35.9	Very low	35.6	Very low	160 Å²	160	140.2 Å²	140.2	75%	0.748	75%	0.748	S	S	*	*			trans	-5.2	152.5	163.1	-59.2	160.1	135.2	0	0	119.9
466	E	36	Very low	35	Very low	168 Å²	168	140.6 Å²	140.6	79%	0.785	75%	0.748	S	S	*	*			cis	-160.1	167.9	5.1	-130.6	-177.6	161.9	0	0	110.7
467	V	36	Very low	34.8	Very low	127 Å²	127	137.5 Å²	137.5	77%	0.77	74%	0.739	S	S	*	*			trans	-108.9	134.3	158.9	-172.1	0	0	0	0	103.6
468	P	37.9	Very low	34.5	Very low	95 Å²	95	133.6 Å²	133.6	62%	0.617	74%	0.736	S	S	*	*				-169	-177	66.3	48.9	-26.9	0	0	0	121.2
469	M	29.3	Very low	34.4	Very low	132 Å²	132	130.1 Å²	130.1	65%	0.65	73%	0.732	S	S	*	*			trans	78.5	128.9	139.7	-67.8	-121.9	-118.2	0	0	125
470	R	31.2	Very low	34.2	Very low	218 Å²	218	128.8 Å²	128.8	82%	0.823	73%	0.734	S	S	*	*			trans	80.7	128.6	132.7	-76.2	173.9	179.5	153.2	4.1	122.4
471	K	39.7	Very low	34.2	Very low	197 Å²	197	129.6 Å²	129.6	86%	0.857	74%	0.738	S	S	*	*			trans	-67.4	159.1	149.6	-45	179.6	176.2	-178.2	0	109.4
472	P	38.2	Very low	34	Very low	117 Å²	117	133 Å²	133	76%	0.76	74%	0.74	S	S	*	*				-153	172.9	72.8	41.7	-21.6	0	0	0	118
473	S	29.8	Very low	33.7	Very low	87 Å²	87	131.5 Å²	131.5	61%	0.608	74%	0.737	S	S	*	*			trans	36	130.1	140.6	-68.1	0	0	0	0	124.7
474	E	28.6	Very low	33.8	Very low	165 Å²	165	135.3 Å²	135.3	77%	0.771	74%	0.739	S	S	*	*				50.7	150.8	112.3	-57.7	165.2	109.9	0	0	120.7
475	T	29.3	Very low	33.8	Very low	109 Å²	109	137.7 Å²	137.7	67%	0.669	74%	0.74	S	S	*	*			cis	-165.3	157.5	-0.9	13	0	0	0	0	111.4
476	T	30.5	Very low	33.8	Very low	126 Å²	126	136.5 Å²	136.5	77%	0.773	74%	0.737	S	S	*	*			trans	63.5	168.7	155.6	55.1	0	0	0	0	117.5
477	S	31.7	Very low	33.8	Very low	74 Å²	74	132.4 Å²	132.4	52%	0.517	73%	0.727	S	S	.	*			cis	-150.7	160.7	14.9	-38.4	0	0	0	0	114.6
478	A	30.9	Very low	33.7	Very low	91 Å²	91	133.9 Å²	133.9	75%	0.752	73%	0.731	S	S	*	*			trans	68.1	154.4	151	0	0	0	0	0	119.7
479	S	33.4	Very low	33.6	Very low	108 Å²	108	133.4 Å²	133.4	76%	0.755	74%	0.735	S	S	*	*			cis	-133.3	124.4	0.4	-113.3	0	0	0	0	110.1
480	V	33.9	Very low	33.7	Very low	128 Å²	128	132.4 Å²	132.4	78%	0.776	74%	0.736	S	S	*	*				74.9	111	80.9	173.2	0	0	0	0	113.9
481	E	34.1	Very low	33.8	Very low	179 Å²	179	130.9 Å²	130.9	84%	0.836	74%	0.736	S	S	*	*				-169.5	124	107.8	-144.8	176.2	-166	0	0	115.3
482	M	31.6	Very low	33.5	Very low	168 Å²	168	125.1 Å²	125.1	83%	0.828	73%	0.725	S	S	*	*			trans	41.8	111.4	148.3	-67.6	-65.1	-151.7	0	0	126
483	A	36.5	Very low	33.2	Very low	82 Å²	82	125.4 Å²	125.4	68%	0.678	72%	0.72	S	S	*	*				94.8	137.3	112.6	0	0	0	0	0	124.3
484	K	37.8	Very low	33.3	Very low	192 Å²	192	128.7 Å²	128.7	84%	0.835	73%	0.726	S	S	*	*			trans	77.3	136.7	166.3	-63.9	167.8	-177.4	161.5	0	115.7
485	K	38.3	Very low	33.4	Very low	169 Å²	169	125.3 Å²	125.3	74%	0.735	72%	0.72	S	S	*	*			cis	-164.7	142	9.1	-125.3	177.7	173.9	-168.9	0	111.8
486	I	35.2	Very low	33.5	Very low	135 Å²	135	127.5 Å²	127.5	69%	0.692	73%	0.728	S	S	*	*			trans	60.3	108.7	149.5	-61.1	159.9	0	0	0	116.5
487	S	36.8	Very low	33.5	Very low	82 Å²	82	127.7 Å²	127.7	57%	0.573	73%	0.729	S	S	*	*			cis	82.9	109.6	45.9	82.9	0	0	0	0	114.5
488	D	33.1	Very low	33.9	Very low	158 Å²	158	129.7 Å²	129.7	85%	0.845	74%	0.74	S	S	*	*				88.4	151.5	79.2	-66.7	-38	0	0	0	112.7
489	A	34.8	Very low	33.8	Very low	84 Å²	84	130 Å²	130	69%	0.694	74%	0.743	S	S	*	*			cis	-157.5	170.1	-4.8	0	0	0	0	0	112.9
490	T	31.3	Very low	33.8	Very low	112 Å²	112	133.2 Å²	133.2	69%	0.687	75%	0.746	S	S	*	*			trans	-39.6	170.2	154.9	38.6	0	0	0	0	116.3
491	F	33.5	Very low	33.7	Very low	185 Å²	185	134.9 Å²	134.9	81%	0.811	75%	0.745	S	S	*	*				-154.4	146.8	50.6	-88.9	-98.7	0	0	0	110.8
492	A	34.1	Very low	33.7	Very low	76 Å²	76	131 Å²	131	63%	0.628	74%	0.738	S	S	*	*				80.6	154.2	78	0	0	0	0	0	114.7
493	N	31.6	Very low	33.7	Very low	123 Å²	123	128 Å²	128	66%	0.658	73%	0.734	S	S	*	*			cis	-158.5	172.2	-1.5	-129.3	16.8	0	0	0	113.1
494	E	32.2	Very low	33.5	Very low	157 Å²	157	128.3 Å²	128.3	73%	0.734	74%	0.736	S	S	*	*			trans	28.2	149.8	145.7	-68	149.1	-171.9	0	0	122.6
495	S	31.2	Very low	33.3	Very low	93 Å²	93	127.6 Å²	127.6	65%	0.65	74%	0.74	S	S	*	*			cis	130.2	110.5	-10.7	67.5	0	0	0	0	113.5
496	N	31.3	Very low	33.1	Very low	156 Å²	156	123.1 Å²	123.1	83%	0.834	74%	0.742	S	S	*	*			trans	-178.8	121.1	152.8	-97.6	-29.8	0	0	0	110
497	V	30	Very low	33.1	Very low	130 Å²	130	121.5 Å²	121.5	79%	0.788	74%	0.743	S	S	*	*				86.8	136.9	98.2	170.1	0	0	0	0	114.1
498	P	41.1	Very low	33	Very low	116 Å²	116	128.4 Å²	128.4	75%	0.753	76%	0.756	S	S	*	*			trans	-124	-173.5	-159.9	43.8	-28.5	0	0	0	116.4
499	A	29.1	Very low	33.1	Very low	97 Å²	97	131 Å²	131	80%	0.802	76%	0.76	S	S	*	*			trans	73	142.9	-177.1	0	0	0	0	0	113.7
500	E	33	Very low	33	Very low	176 Å²	176	129.9 Å²	129.9	82%	0.822	76%	0.757	S	S	*	*			cis	-145.2	172	34.7	-89.6	-172.3	146.7	0	0	115.7
501	E	32.2	Very low	33.2	Very low	162 Å²	162	129.1 Å²	129.1	76%	0.757	76%	0.756	S	S	*	*			trans	42.2	122.9	143.1	-65.4	-133.3	131.6	0	0	124.8
502	S	32.2	Very low	33.3	Very low	99 Å²	99	127.5 Å²	127.5	69%	0.692	76%	0.756	S	S	*	*				94.9	163.9	128.4	87.2	0	0	0	0	122.1
503	S	32.7	Very low	33.3	Very low	105 Å²	105	129.7 Å²	129.7	73%	0.734	76%	0.761	S	S	*	*			trans	63.2	92.5	152.8	-53.5	0	0	0	0	117.4
504	A	33	Very low	33.5	Very low	88 Å²	88	128.5 Å²	128.5	73%	0.727	76%	0.763	S	S	*	*				78.2	141.1	58.3	0	0	0	0	0	116.2
505	L	33.8	Very low	33.4	Very low	176 Å²	176	126.5 Å²	126.5	92%	0.921	77%	0.766	S	S	*	*			trans	46	109.7	163.7	-79.6	76.2	0	0	0	119.3
506	G	32.8	Very low	33.5	Very low	76 Å²	76	126.4 Å²	126.4	78%	0.784	77%	0.77	S	S	*	*			trans	-175.2	45.9	171.4	0	0	0	0	0	115.6
507	S	34.8	Very low	33.5	Very low	100 Å²	100	123.5 Å²	123.5	70%	0.699	76%	0.758	S	S	*	*				55.3	109.9	98.4	-103.8	0	0	0	0	117.6
508	R	35.2	Very low	33.6	Very low	227 Å²	227	121.3 Å²	121.3	86%	0.857	75%	0.746	S	S	*	*			trans	94.2	136.1	139.8	-59.9	166.4	174	-169.7	-3.8	120.4
509	K	36.5	Very low	33.2	Very low	213 Å²	213	120.5 Å²	120.5	93%	0.926	74%	0.735	S	S	*	*			trans	68.3	137.2	162	-66.3	178.2	176	-174.1	0	116.2
510	G	32	Very low	33.5	Very low	61 Å²	61	117.6 Å²	117.6	63%	0.629	71%	0.708	S	S	*	*			cis	167	-176	-7.2	0	0	0	0	0	113.6
511	S	36	Very low	33.5	Very low	96 Å²	96	113.3 Å²	113.3	67%	0.671	69%	0.687	S	S	*	*			trans	54.1	117.8	160.5	51.2	0	0	0	0	118.8
512	D	33.9	Very low	33.7	Very low	151 Å²	151	112.5 Å²	112.5	81%	0.807	68%	0.683	S	S	*	*				69.3	157.2	123.8	-51.8	-19.9	0	0	0	118
513	V	35.6	Very low	33.9	Very low	121 Å²	121	110.8 Å²	110.8	73%	0.733	66%	0.664	S	S	*	*			cis	-158.4	169.4	-12.7	120	0	0	0	0	108.1
514	S	35.6	Very low	34.1	Very low	99 Å²	99	109.6 Å²	109.6	69%	0.692	66%	0.656	S	S	*	*			trans	68.5	112.9	165.4	-72.3	0	0	0	0	120.3
515	S	29.4	Very low	34.3	Very low	114 Å²	114	108.7 Å²	108.7	80%	0.797	65%	0.648	S	S	*	*				38.6	134.7	112.5	-48.9	0	0	0	0	122.3
516	A	32.5	Very low	34.8	Very low	91 Å²	91	106.4 Å²	106.4	75%	0.752	63%	0.628	S	S	*	*			trans	75.4	148.4	161.1	0	0	0	0	0	116.7
517	T	32.7	Very low	35.1	Very low	95 Å²	95	106.2 Å²	106.2	58%	0.583	60%	0.603	S	S	*	*			cis	-149	-177.6	7.2	-18.2	0	0	0	0	112.5
518	T	31.2	Very low	35.3	Very low	84 Å²	84	107 Å²	107	52%	0.515	60%	0.599	S	S	.	*			trans	-70.3	173.6	178.1	53.9	0	0	0	0	113.5	Y1178	T518-Y1178 WeakPolarHBondContact CA-OH 3.37Å
519	L	34	Very low	35.4	Very low	100 Å²	100	100 Å²	100	52%	0.524	59%	0.585	S	S	.	*			cis	-144.1	143.6	14.1	-76.1	165.8	0	0	0	113.3	V1174 Y1178	L519-V1174 WeakPolarHBondContact O-CG1 3.08Å; L519-Y1178 VanDerWaalsContact N-CE2 3.32Å
520	S	33.5	Very low	35.4	Very low	36 Å²	36	96.6 Å²	96.6	25%	0.252	57%	0.572	S	S	.	*			trans	73.5	174.3	138.7	77.3	0	0	0	0	120.2	Y1178	S520-Y1178 VanDerWaalsContact N-CE1 3.35Å; S520-Y1178 VanDerWaalsContact N-CZ 3.3Å
521	K	33.2	Very low	35.5	Very low	86 Å²	86	101.2 Å²	101.2	37%	0.374	58%	0.582	S	S	.	*			cis	-161.6	137.1	14.6	-142.3	145.8	-130.9	150.7	0	113.6	Y386	Y386-K521 HydrophobicContact CD1-CD 3.69Å; Y386-K521 HydrophobicContact CD2-CD 3.59Å; Y386-K521 VanDerWaalsContact CD2-CE 3.46Å; Y386-K521 HydrophobicContact CE1-CD 3.71Å; Y386-K521 HydrophobicContact CE2-CD 3.69Å; Y386-K521 HydrophobicContact CG-CD 3.64Å; Y386-K521 HydrophobicContact CG-CG 4.4Å; Y386-K521 VanDerWaalsContact CZ-NZ 3.32Å; Y386-K521 PolarHBondContact OH-NZ 3.13Å
522	Q	38	Very low	35.3	Very low	144 Å²	144	100.9 Å²	100.9	67%	0.673	58%	0.579	S	S	*	*			trans	163.8	100.4	148.6	-98.5	-178.4	-47.9	0	0	107
523	E	35.3	Very low	35.2	Very low	63 Å²	63	100.5 Å²	100.5	29%	0.294	58%	0.577	S	S	.	*			cis	82.8	118.7	45.9	-159.4	-171.5	-171.9	0	0	113.5	Y386 H387	Y386-E523 WeakPolarHBondContact CA-OE1 3.43Å; Y386-E523 VanDerWaalsContact CB-CD 3.48Å; Y386-E523 WeakPolarHBondContact CB-OE1 3.22Å; Y386-E523 WeakPolarHBondContact CB-OE2 3.4Å; H387-E523 VanDerWaalsContact CD2-CG 3.49Å; H387-E523 WeakPolarHBondContact CD2-CG 3.47Å; H387-E523 IonicContact CD2-OE1 2.78Å; H387-E523 PolarHBondContact CD2-OE1 2.8Å; H387-E523 VanDerWaalsContact CD2-OE1 3.24Å; H387-E523 IonicContact CD2-OE2 2.86Å; H387-E523 PolarHBondContact CE1-O 3.13Å; H387-E523 VanDerWaalsContact CG-CD 3.41Å; H387-E523 IonicContact CG-OE1 3.77Å; H387-E523 IonicContact CG-OE2 3.57Å; H387-E523 PolarHBondContact N-OE1 3.44Å; H387-E523 PolarHBondContact N-OE2 3.06Å; H387-E523 IonicContact ND1-OE2 2.75Å; H387-E523 WeakPolarHBondContact NE2-CG 3.48Å; H387-E523 PolarHBondContact NE2-O 3.32Å
524	S	37.3	Very low	35.1	Very low	81 Å²	81	101.8 Å²	101.8	57%	0.566	59%	0.585	S	S	*	*			trans	58.9	119.2	-177.8	79.4	0	0	0	0	117.2	H387	H387-S524 VanDerWaalsContact NE2-CA 3.27Å; H387-S524 WeakPolarHBondContact NE2-CA 3.33Å; H387-S524 WeakPolarHBondContact NE2-CB 3.47Å; H387-S524 PolarHBondContact NE2-N 3.38Å; H387-S524 PolarHBondContact NE2-OG 3.32Å
525	A	38	Very low	35.1	Very low	68 Å²	68	100.5 Å²	100.5	56%	0.562	58%	0.576	S	S	*	*				-172.1	88.8	89.2	0	0	0	0	0	113.4
526	R	43.6	Very low	35.5	Very low	129 Å²	129	101.6 Å²	101.6	49%	0.487	57%	0.569	S	S	.	*			trans	63.4	138.1	136.6	-54	148.9	172.2	-172.7	-0.7	115.9	L528 Y1072	R526-L528 HydrophobicContact CB-CD1 3.99Å; R526-L528 HydrophobicContact CB-CG 4.12Å; R526-L528 HydrophobicContact CG-CD1 3.79Å; R526-L528 HydrophobicContact CG-CG 4.07Å; R526-Y1072 HydrophobicContact CB-CE2 3.95Å; R526-Y1072 WeakPolarHBondContact CD-OH 3.09Å
527	R	38.4	Very low	35.7	Very low	72 Å²	72	102.1 Å²	102.1	27%	0.272	57%	0.572	S	S	.	*			cis	-135.9	131.3	43.4	-72	160.4	94.6	162.1	5.1	109.3	F1068 Y1072	R527-F1068 HydrophobicContact CB-CZ 4.44Å; R527-F1068 VanDerWaalsContact CZ-O 3.28Å; R527-F1068 VanDerWaalsContact NH1-CE1 3.29Å; R527-F1068 PolarHBondContact NH1-O 2.81Å; R527-F1068 PolarHBondContact NH2-O 3.31Å; R527-Y1072 HydrophobicContact CG-CD2 4.17Å; R527-Y1072 HydrophobicContact CG-CE2 3.96Å
528	L	40.3	Very low	35.6	Very low	116 Å²	116	100.7 Å²	100.7	61%	0.607	58%	0.577	S	S	*	*				54.9	123.3	69.8	-59.7	175.9	0	0	0	109.2	R526	R526-L528 HydrophobicContact CB-CD1 3.99Å; R526-L528 HydrophobicContact CB-CG 4.12Å; R526-L528 HydrophobicContact CG-CD1 3.79Å; R526-L528 HydrophobicContact CG-CG 4.07Å
529	S	36	Very low	35.8	Very low	80 Å²	80	102.3 Å²	102.3	56%	0.559	59%	0.591	S	S	*	*			cis	-179.4	173.9	16.9	-96.1	0	0	0	0	106.5
530	E	37.9	Very low	35.8	Very low	141 Å²	141	104.3 Å²	104.3	66%	0.659	61%	0.608	S	S	*	*			cis	-158.7	146.6	-1.3	-119.6	139.8	-128.3	0	0	106.9
531	L	34	Very low	35.8	Very low	159 Å²	159	105.7 Å²	105.7	83%	0.832	63%	0.628	S	S	*	*			trans	41.5	149.5	136	-57.1	177.8	0	0	0	123.1
532	S	31.5	Very low	36	Very low	88 Å²	88	109.1 Å²	109.1	62%	0.615	65%	0.649	S	S	*	*	S	Bend	trans	-62	172.6	173	52.8	0	0	0	0	115.8
533	N	30.4	Very low	36	Very low	144 Å²	144	108.9 Å²	108.9	77%	0.77	65%	0.649	S	S	*	*			trans	69.2	80.3	155.9	-57.3	-20.2	0	0	0	118.3
534	V	34	Very low	36.1	Very low	147 Å²	147	113.8 Å²	113.8	89%	0.891	67%	0.671	S	S	*	*			trans	-129.7	114.9	145.1	-179.2	0	0	0	0	109.4
535	S	36.6	Very low	36.2	Very low	73 Å²	73	116.2 Å²	116.2	51%	0.51	67%	0.674	S	S	.	*			trans	-83.6	144.6	167.5	-58.4	0	0	0	0	110.9	M977	S535-M977 VanDerWaalsContact OG-CE 3.25Å; S535-M977 WeakPolarHBondContact OG-CE 3.41Å
536	E	37.8	Very low	36.6	Very low	137 Å²	137	118.2 Å²	118.2	64%	0.64	68%	0.681	S	S	*	*	S	Bend	trans	56.7	136.7	144.9	-161.8	152.4	-126.2	0	0	121.2	S980	E536-S980 VanDerWaalsContact OE1-CB 3.3Å; E536-S980 WeakPolarHBondContact OE1-CB 3.44Å; E536-S980 PolarHBondContact OE1-OG 3.28Å
537	A	36.8	Very low	36.2	Very low	101 Å²	101	121.1 Å²	121.1	84%	0.835	69%	0.694	S	S	*	*			trans	54.3	103	166.7	0	0	0	0	0	117.8
538	G	30.7	Very low	36	Very low	65 Å²	65	129.3 Å²	129.3	67%	0.67	72%	0.724	S	S	*	*			cis	116.5	164	43.6	0	0	0	0	0	111.1
539	S	34.9	Very low	35.5	Very low	118 Å²	118	127 Å²	127	83%	0.825	73%	0.728	S	S	*	*			trans	71.8	151	172.3	85.5	0	0	0	0	117.7
540	T	34.6	Very low	35.4	Very low	143 Å²	143	127.5 Å²	127.5	88%	0.877	73%	0.732	S	S	*	*			cis	-165.9	163.7	-19.4	18	0	0	0	0	109.6
541	G	32.4	Very low	35.3	Very low	65 Å²	65	126.2 Å²	126.2	67%	0.67	73%	0.728	S	S	*	*			trans	135.7	149.4	140.7	0	0	0	0	0	118.6
542	L	36.8	Very low	35.5	Very low	157 Å²	157	123.7 Å²	123.7	82%	0.822	72%	0.715	S	S	*	*			trans	72.3	133.4	170.1	-49.4	178.3	0	0	0	115.3
543	E	39.8	Very low	35.7	Very low	140 Å²	140	127 Å²	127	65%	0.654	72%	0.718	S	S	*	*			cis	-151	143.7	5.1	-113.7	146.2	-142.9	0	0	110.7
544	E	36.2	Very low	35.9	Very low	165 Å²	165	128.3 Å²	128.3	77%	0.771	72%	0.717	S	S	*	*			trans	43.3	154.9	140.3	-60.2	176.2	170.8	0	0	121.3
545	E	39.8	Very low	35.8	Very low	132 Å²	132	130 Å²	130	62%	0.617	71%	0.712	S	S	*	*			cis	-170.9	175	-7.8	-106.4	-84.6	122.6	0	0	104.7	Y547	E545-Y547 VanDerWaalsContact OE1-CD2 3.23Å; E545-Y547 WeakPolarHBondContact OE1-CD2 3.47Å; E545-Y547 VanDerWaalsContact OE1-CE2 3.31Å; E545-Y547 WeakPolarHBondContact OE1-CE2 3.49Å
546	P	46.2	Very low	35.8	Very low	111 Å²	111	131.8 Å²	131.8	72%	0.721	73%	0.725	S	S	*	*			cis	-128.4	179.2	3.7	42.8	-26.9	0	0	0	116.7
547	Y	36.1	Very low	35.7	Very low	190 Å²	190	129.6 Å²	129.6	75%	0.745	73%	0.725	S	S	*	*			trans	-61.3	167.7	178.1	-84.9	-104	0	0	0	115.3	E545	E545-Y547 VanDerWaalsContact OE1-CD2 3.23Å; E545-Y547 WeakPolarHBondContact OE1-CD2 3.47Å; E545-Y547 VanDerWaalsContact OE1-CE2 3.31Å; E545-Y547 WeakPolarHBondContact OE1-CE2 3.49Å
548	R	32.8	Very low	35.3	Very low	244 Å²	244	133.4 Å²	133.4	92%	0.921	73%	0.725	S	S	*	*			cis	-166.2	145.3	47	-153.8	178.5	-151.9	-130.1	7.1	114.3
549	G	29.6	Very low	35.7	Very low	67 Å²	67	134.9 Å²	134.9	69%	0.691	72%	0.724	S	S	*	*			trans	129.6	128	160.6	0	0	0	0	0	116.6
550	S	34.1	Very low	35.4	Very low	90 Å²	90	136.3 Å²	136.3	63%	0.629	72%	0.72	S	S	*	*				-177.5	116.7	-59.4	50	0	0	0	0	111.3
551	I	36	Very low	35.4	Very low	115 Å²	115	134.6 Å²	134.6	59%	0.59	71%	0.71	S	S	*	*			trans	66.2	165.5	168.4	-38.4	157.3	0	0	0	110.6
552	L	38.2	Very low	35.2	Very low	106 Å²	106	137 Å²	137	56%	0.555	71%	0.711	S	S	*	*			cis	-97.2	-178.9	-0.3	-87.9	75.5	0	0	0	111.5	L716	L552-L716 HydrophobicContact CD1-CD1 3.83Å; L552-L716 HydrophobicContact CD1-CG 4.4Å; L552-L716 HydrophobicContact CD2-CD1 3.9Å; L552-L716 HydrophobicContact CG-CD1 4.5Å
553	K	35.2	Very low	35.3	Very low	157 Å²	157	134.7 Å²	134.7	68%	0.683	71%	0.705	S	S	*	*			cis	71.5	134.6	33.1	-47.9	172.2	-168.2	157.9	0	114.6
554	K	36.1	Very low	35	Very low	172 Å²	172	135.5 Å²	135.5	75%	0.748	71%	0.714	S	S	*	*			cis	-170.1	145.3	-8.6	-113.6	176.8	-175.6	178.2	0	108.1
555	K	32.3	Very low	34.7	Very low	181 Å²	181	131.7 Å²	131.7	79%	0.787	71%	0.71	S	S	*	*			trans	48.6	157.4	145.9	-65.7	-167.9	172.8	-164.6	0	120.9
556	S	35.5	Very low	34.6	Very low	111 Å²	111	131.5 Å²	131.5	78%	0.776	72%	0.72	S	S	*	*			trans	65.9	153.6	153.5	45	0	0	0	0	117.5
557	S	36.7	Very low	34.3	Very low	91 Å²	91	129.9 Å²	129.9	64%	0.636	72%	0.724	S	S	*	*			cis	-171.5	136.7	-23.4	48.5	0	0	0	0	108.7
558	E	26.9	Very low	34.3	Very low	181 Å²	181	129.9 Å²	129.9	85%	0.846	73%	0.728	S	S	*	*			trans	60	-173.2	161.6	-55.2	-168.1	111	0	0	112.8
559	P	38.7	Very low	34.4	Very low	97 Å²	97	125.6 Å²	125.6	63%	0.63	72%	0.722	S	S	*	*				-132.2	-135.8	-111.8	29.4	-2.8	0	0	0	109.6
560	I	29.1	Very low	34.6	Very low	147 Å²	147	125.7 Å²	125.7	75%	0.754	72%	0.723	S	S	*	*			trans	68.4	128.5	150.7	-73.8	164.2	0	0	0	114.9
561	V	35.6	Very low	34.7	Very low	108 Å²	108	126.7 Å²	126.7	66%	0.655	73%	0.725	S	S	*	*			cis	-173.1	145.5	-9.4	110.9	0	0	0	0	102.5
562	T	26.8	Very low	34.8	Very low	114 Å²	114	129.7 Å²	129.7	70%	0.699	73%	0.733	S	S	*	*				52.1	153.2	83.8	-0.9	0	0	0	0	113.9
563	P	39	Very low	34.8	Very low	109 Å²	109	132.7 Å²	132.7	71%	0.708	74%	0.742	S	S	*	*				-124.2	-105.2	-93	39.3	-25.5	0	0	0	113.1
564	L	34.3	Very low	34.9	Very low	158 Å²	158	133.6 Å²	133.6	83%	0.827	75%	0.746	S	S	*	*			trans	83.6	87.9	166.4	-67.3	154.2	0	0	0	118.7
565	A	30.5	Very low	34.9	Very low	84 Å²	84	131 Å²	131	69%	0.694	75%	0.75	S	S	*	*				-35.4	164	124.7	0	0	0	0	0	113.4
566	P	37.8	Very low	35.1	Very low	128 Å²	128	129.1 Å²	129.1	83%	0.831	75%	0.748	S	S	*	*			cis	-148.7	-177.8	35.5	41.9	-20.6	0	0	0	117.7
567	G	38.4	Very low	35.4	Very low	78 Å²	78	129.3 Å²	129.3	80%	0.804	75%	0.746	S	S	*	*			trans	-155.3	99	171.4	0	0	0	0	0	113.9
568	K	37.5	Very low	35.5	Very low	189 Å²	189	130.7 Å²	130.7	82%	0.822	75%	0.751	S	S	*	*			trans	-84.6	133.8	-177.6	-75	-179.6	178.1	176.8	0	113.7
569	I	35	Very low	35.8	Very low	154 Å²	154	130.6 Å²	130.6	79%	0.79	75%	0.75	S	S	*	*			trans	50.6	102	130.5	-49.4	167	0	0	0	118.7
570	G	33.7	Very low	35.6	Very low	69 Å²	69	134.3 Å²	134.3	71%	0.711	76%	0.76	S	S	*	*				102.8	139.3	94.8	0	0	0	0	0	124.1
571	V	35.7	Very low	35.9	Very low	111 Å²	111	135.2 Å²	135.2	67%	0.673	77%	0.765	S	S	*	*				84.5	108.3	123.6	178.9	0	0	0	0	122.4
572	K	38.6	Very low	36	Very low	178 Å²	178	136.3 Å²	136.3	77%	0.774	77%	0.774	S	S	*	*			trans	50.2	164	134.5	-57.2	176.5	-172.3	172.6	0	122.2
573	K	38.3	Very low	36.5	Very low	170 Å²	170	134.4 Å²	134.4	74%	0.739	78%	0.778	S	S	*	*			trans	-162	-177.2	139.2	-98.6	128.1	-157.7	148.6	0	110.3
574	F	36.9	Very low	36.1	Very low	175 Å²	175	137.2 Å²	137.2	77%	0.768	79%	0.786	S	S	*	*			trans	-148.6	162.3	-156.8	-133.7	-95.5	0	0	0	115	L576	F574-L576 HydrophobicContact CD1-CD1 4.23Å; F574-L576 HydrophobicContact CD1-CG 4.23Å; F574-L576 HydrophobicContact CE1-CD1 4.45Å; F574-L576 HydrophobicContact CE1-CG 4.35Å
575	S	35.8	Very low	36.2	Very low	117 Å²	117	141.4 Å²	141.4	82%	0.818	79%	0.79	S	S	*	*			trans	-142.9	143.7	162.8	60.4	0	0	0	0	113.6
576	L	36	Very low	36.4	Very low	143 Å²	143	141.9 Å²	141.9	75%	0.749	79%	0.789	S	S	*	*			trans	-144.8	162.7	-163.4	-103.9	164.8	0	0	0	108.4	F574	F574-L576 HydrophobicContact CD1-CD1 4.23Å; F574-L576 HydrophobicContact CD1-CG 4.23Å; F574-L576 HydrophobicContact CE1-CD1 4.45Å; F574-L576 HydrophobicContact CE1-CG 4.35Å
577	P	42.4	Very low	36.3	Very low	115 Å²	115	139 Å²	139	75%	0.747	78%	0.783	S	S	*	*				-160.8	164.7	74.6	42.1	-21.5	0	0	0	119.5
578	T	38.3	Very low	36.3	Very low	119 Å²	119	140.9 Å²	140.9	73%	0.73	78%	0.783	S	S	*	*	S	Bend	trans	-168.6	134	130.3	-75.2	0	0	0	0	110.4
579	Q	34.4	Very low	36.2	Very low	179 Å²	179	136.4 Å²	136.4	84%	0.836	78%	0.776	S	S	*	*	S	Bend	trans	59.5	139.2	170	-73.9	173.5	-6.7	0	0	120.4
580	Q	32.8	Very low	36.4	Very low	176 Å²	176	134.8 Å²	134.8	82%	0.822	78%	0.778	S	S	*	*			trans	45.1	85.8	167	-63.3	-179.7	-11	0	0	116.9
581	L	35.7	Very low	36.6	Very low	165 Å²	165	142.3 Å²	142.3	86%	0.864	79%	0.785	S	S	*	*				70.4	130.5	74.7	-67.7	169.8	0	0	0	114.8
582	P	39.2	Very low	36.6	Very low	131 Å²	131	146.3 Å²	146.3	85%	0.851	79%	0.793	S	S	*	*			cis	-104.9	171.9	-30.4	39.1	-28.5	0	0	0	110.8
583	G	37	Very low	36.5	Very low	75 Å²	75	143.1 Å²	143.1	77%	0.773	79%	0.794	S	S	*	*			cis	174.7	57.2	4.9	0	0	0	0	0	112
584	L	30.9	Very low	36.4	Very low	168 Å²	168	139.8 Å²	139.8	88%	0.88	79%	0.792	S	S	*	*			trans	-67.5	130.8	173.6	-74.2	171	0	0	0	111.5
585	R	35.1	Very low	36.4	Very low	245 Å²	245	138 Å²	138	93%	0.925	79%	0.79	S	S	*	*			trans	-154.5	132.3	154.7	-115.2	166.2	-167.2	-156.9	0.5	113.4
586	S	35.3	Very low	36.4	Very low	94 Å²	94	138.5 Å²	138.5	66%	0.657	79%	0.788	S	S	*	*			trans	-126.4	162.4	167.1	-53.4	0	0	0	0	108.8
587	G	35.5	Very low	36.3	Very low	68 Å²	68	137.6 Å²	137.6	70%	0.701	79%	0.789	S	S	*	*			trans	-172.5	161.9	169.6	0	0	0	0	0	111.1
588	S	37.8	Very low	36.2	Very low	117 Å²	117	137.4 Å²	137.4	82%	0.818	79%	0.787	S	S	*	*			cis	-162.1	135.9	-8.3	-109.6	0	0	0	0	112.7
589	S	36.3	Very low	35.8	Very low	96 Å²	96	138.1 Å²	138.1	67%	0.671	79%	0.792	S	S	*	*				34.3	111.2	126.2	161.3	0	0	0	0	118.6
590	S	39.1	Very low	35.8	Very low	120 Å²	120	138.7 Å²	138.7	84%	0.839	79%	0.794	S	S	*	*			trans	-72.7	151.7	145.2	-169	0	0	0	0	110.7
591	R	38.5	Very low	35.8	Very low	226 Å²	226	135.6 Å²	135.6	85%	0.853	79%	0.792	S	S	*	*			trans	-81.9	146.7	179.2	-67.4	167.6	170.1	161.3	-6.8	109.8
592	K	34.1	Very low	36	Very low	195 Å²	195	133.5 Å²	133.5	85%	0.848	79%	0.788	S	S	*	*			cis	88.4	142.4	26.4	-162.5	178.4	-174.9	-178.3	0	114.1
593	S	38.4	Very low	35.8	Very low	112 Å²	112	132.9 Å²	132.9	78%	0.783	79%	0.787	S	S	*	*			trans	98	159.1	-177.5	73.5	0	0	0	0	116.9
594	S	35.8	Very low	35.6	Very low	100 Å²	100	140.3 Å²	140.3	70%	0.699	79%	0.791	S	S	*	*				-173.4	-162.5	-90.3	53.4	0	0	0	0	108.6
595	D	35.7	Very low	35.7	Very low	136 Å²	136	142 Å²	142	73%	0.727	79%	0.786	S	S	*	*			cis	-167.7	176.5	12.6	-137.8	-48.8	0	0	0	112.6
596	V	36	Very low	35.6	Very low	128 Å²	128	137.5 Å²	137.5	78%	0.776	78%	0.776	S	S	*	*			trans	73.9	150.6	156.1	174.2	0	0	0	0	120.7
597	T	34.6	Very low	35.5	Very low	125 Å²	125	138.3 Å²	138.3	77%	0.767	78%	0.782	S	S	*	*			trans	-90.2	176.7	-176.4	56.9	0	0	0	0	113.4
598	P	39.7	Very low	35.5	Very low	110 Å²	110	141.6 Å²	141.6	71%	0.714	78%	0.782	S	S	*	*			cis	-129.7	-169.2	-5.5	43.9	-27.8	0	0	0	114
599	V	30.5	Very low	35.2	Very low	135 Å²	135	146.9 Å²	146.9	82%	0.818	78%	0.784	S	S	*	*			trans	29.9	104	156	-178.6	0	0	0	0	118.6
600	E	34.6	Very low	34.9	Very low	191 Å²	191	147.5 Å²	147.5	89%	0.893	79%	0.789	S	S	*	*				-155	-172.1	117.4	-126.3	176.7	-170.9	0	0	110.9
601	S	33.1	Very low	34.5	Very low	110 Å²	110	149.6 Å²	149.6	77%	0.769	79%	0.789	S	S	*	*			trans	-114.3	-171.6	-154.6	72.8	0	0	0	0	114.8
602	P	38.9	Very low	34.2	Very low	121 Å²	121	142.6 Å²	142.6	79%	0.786	78%	0.775	S	S	*	*				-129.7	165.8	-104.5	39	-21.8	0	0	0	116.1
603	S	34.2	Very low	34.3	Very low	118 Å²	118	142.1 Å²	142.1	83%	0.825	77%	0.773	S	S	*	*			trans	-162.4	120.6	150.9	48.8	0	0	0	0	116.8
604	R	32.7	Very low	34.3	Very low	231 Å²	231	144.9 Å²	144.9	87%	0.872	78%	0.779	S	S	*	*			trans	74.1	95.5	131.9	-161.8	173.2	-168.7	154.2	2.1	120.9
605	R	34.9	Very low	34.3	Very low	204 Å²	204	142.9 Å²	142.9	77%	0.77	77%	0.773	S	S	*	*			trans	59.4	144.2	134.9	-70.3	-167	132.9	134	9	119.4
606	E	32.5	Very low	34.3	Very low	150 Å²	150	141.9 Å²	141.9	70%	0.701	78%	0.777	S	S	*	*			cis	168.9	112.4	-13.6	-112.8	169.1	-175.5	0	0	103.1
607	S	31.6	Very low	34.3	Very low	112 Å²	112	142 Å²	142	78%	0.783	78%	0.778	S	S	*	*			trans	-170	156.7	151.8	-151	0	0	0	0	113.2
608	L	35.6	Very low	34.7	Very low	137 Å²	137	141.3 Å²	141.3	72%	0.717	78%	0.776	S	S	*	*			trans	65.9	97.8	163.5	-53.4	-170.6	0	0	0	121.4
609	R	31.8	Very low	34.6	Very low	227 Å²	227	144.5 Å²	144.5	86%	0.857	78%	0.781	S	S	*	*				66.5	123.6	118.4	-70.6	-179.9	172.1	174.7	-3.8	122.7
610	S	30.7	Very low	34.8	Very low	109 Å²	109	147 Å²	147	76%	0.762	79%	0.786	S	S	*	*			trans	82.4	174.9	131.6	83.5	0	0	0	0	121.5
611	L	31.5	Very low	34.8	Very low	164 Å²	164	141.6 Å²	141.6	86%	0.859	78%	0.782	S	S	*	*			trans	76.9	143.9	-164.2	-54.2	174.6	0	0	0	114.8
612	S	30.9	Very low	34.9	Very low	80 Å²	80	140.4 Å²	140.4	56%	0.559	79%	0.787	S	S	*	*			cis	-173.9	177.1	-14.5	53.9	0	0	0	0	110.4
613	K	37	Very low	34.5	Very low	185 Å²	185	143.6 Å²	143.6	80%	0.804	79%	0.794	S	S	*	*			trans	77.6	145.1	165.3	-62.1	163.9	-171.8	176.1	0	115.7
614	L	37.2	Very low	34.6	Very low	170 Å²	170	146.6 Å²	146.6	89%	0.89	80%	0.795	S	S	*	*			cis	-150.5	157.9	-3	-99.9	146.5	0	0	0	106.9
615	G	36.5	Very low	34.8	Very low	57 Å²	57	143.4 Å²	143.4	59%	0.588	79%	0.79	S	S	*	*			cis	-177.9	-163.5	2.6	0	0	0	0	0	112.5
616	S	35.8	Very low	34.7	Very low	115 Å²	115	139 Å²	139	80%	0.804	79%	0.785	S	S	*	*			trans	58.4	82.8	170.8	55.7	0	0	0	0	120.8
617	T	36.1	Very low	35	Very low	130 Å²	130	135.2 Å²	135.2	80%	0.798	78%	0.775	S	S	*	*				19.8	155.6	116.1	54.4	0	0	0	0	122.3
618	P	43.9	Very low	35.4	Very low	111 Å²	111	135.1 Å²	135.1	72%	0.721	76%	0.762	S	S	*	*			cis	-135.6	-159.1	-11	35.9	-13.2	0	0	0	114.5
619	E	36.1	Very low	35.5	Very low	177 Å²	177	135.2 Å²	135.2	83%	0.827	75%	0.753	S	S	*	*			trans	71	107.3	176.3	-60.7	-177.1	144.6	0	0	114.4
620	M	35.4	Very low	35.7	Very low	187 Å²	187	127 Å²	127	92%	0.921	73%	0.726	S	S	*	*			cis	61.6	123.9	26.4	-50.6	-80.3	-65.3	0	0	113.3
621	G	34	Very low	36.1	Very low	78 Å²	78	126.5 Å²	126.5	80%	0.804	72%	0.718	S	S	*	*			cis	-170.3	164.3	-5.8	0	0	0	0	0	107.2
622	G	36.4	Very low	36.1	Very low	85 Å²	85	126.6 Å²	126.6	88%	0.876	71%	0.714	S	S	*	*			cis	114.7	102.5	37.6	0	0	0	0	0	108.8
623	M	30.8	Very low	36.3	Very low	188 Å²	188	130.6 Å²	130.6	93%	0.926	73%	0.726	S	S	*	*			trans	-111.7	136.2	-173.9	-71.7	178.9	167.4	0	0	113.1
624	E	34.9	Very low	36.2	Very low	181 Å²	181	127.6 Å²	127.6	85%	0.846	73%	0.729	S	S	*	*			trans	166.9	152.2	153.9	-103	170.1	164	0	0	107.7
625	E	36.4	Very low	36	Very low	165 Å²	165	123 Å²	123	77%	0.771	72%	0.715	S	S	*	*			cis	-144.6	137.8	12.5	-103.6	169.5	174.1	0	0	107.7
626	V	34.7	Very low	35.7	Very low	112 Å²	112	127.5 Å²	127.5	68%	0.679	72%	0.721	S	S	*	*				86.6	144.6	73.9	171.6	0	0	0	0	117	K952	V626-K952 PolarHBondContact O-NZ 3.1Å
627	S	38.3	Very low	35.5	Very low	69 Å²	69	131.2 Å²	131.2	48%	0.483	72%	0.719	S	S	.	*			trans	82.1	92.3	158.5	65.3	0	0	0	0	125.1	K952	S627-K952 PolarHBondContact O-NZ 3.31Å
628	E	39.5	Very low	35.5	Very low	110 Å²	110	129.4 Å²	129.4	51%	0.514	71%	0.711	S	S	.	*				82.9	141.1	104.5	-74.9	-173.9	136	0	0	127.3	T953	E628-T953 WeakPolarHBondContact O-CB 3.2Å; E628-T953 PolarHBondContact O-OG1 3.11Å
629	R	38	Very low	34.8	Very low	140 Å²	140	131.7 Å²	131.7	53%	0.528	72%	0.716	S	S	.	*			trans	82.1	114.9	145.1	-94.5	-172.4	-149.4	71.7	25.9	124.7	T953 R954	R629-T953 VanDerWaalsContact O-CB 3.23Å; R629-T953 WeakPolarHBondContact O-CB 3.38Å; R629-R954 WeakPolarHBondContact O-CA 3.24Å; R629-R954 PolarHBondContact O-N 3.19Å; R629-R954 PolarHBondContact O-NH1 3.02Å
630	D	36.9	Very low	35.2	Very low	55 Å²	55	128.9 Å²	128.9	29%	0.294	71%	0.714	S	S	.	*			trans	117.6	113.1	146	-58.1	-8.1	0	0	0	112.9	R954	D630-R954 VanDerWaalsContact CG-NH1 3.34Å; D630-R954 IonicContact OD1-NH1 2.6Å; D630-R954 IonicContact OD2-CZ 3.71Å; D630-R954 IonicContact OD2-NH1 3.52Å; D630-R954 PolarHBondContact OD2-NH1 2.82Å; D630-R954 IonicContact OD2-NH2 3.39Å; D630-R954 PolarHBondContact OD2-NH2 3.25Å
631	V	37.7	Very low	35	Very low	98 Å²	98	124.9 Å²	124.9	59%	0.594	71%	0.711	S	S	*	*				93.8	126.4	62	154.4	0	0	0	0	109.1	V956	V631-V956 HydrophobicContact CG1-CG2 4.04Å
632	E	33	Very low	34.8	Very low	165 Å²	165	124.2 Å²	124.2	77%	0.771	70%	0.704	S	S	*	*			cis	-157.7	-173.2	8.4	-130.5	161.7	-137.1	0	0	112.7
633	M	34	Very low	34.8	Very low	165 Å²	165	130 Å²	130	81%	0.813	71%	0.705	S	S	*	*			trans	75.7	131	174.2	-48.5	-159.2	-56.5	0	0	115.8
634	S	35.4	Very low	35	Very low	122 Å²	122	130.4 Å²	130.4	85%	0.853	70%	0.701	S	S	*	*			cis	84.2	129.8	38.2	-59.2	0	0	0	0	113.1
635	A	32.5	Very low	35.1	Very low	74 Å²	74	126.7 Å²	126.7	61%	0.612	70%	0.695	S	S	*	*			cis	-160.4	168.2	-5.3	0	0	0	0	0	112.1
636	E	30.1	Very low	35	Very low	151 Å²	151	129.3 Å²	129.3	71%	0.706	70%	0.704	S	S	*	*			trans	62.6	171.3	160.3	-65.5	143.7	-146.7	0	0	117.2
637	Y	32.6	Very low	34.8	Very low	193 Å²	193	127.2 Å²	127.2	76%	0.757	71%	0.705	S	S	*	*			cis	-141.4	166.1	5.5	-112.1	-65.8	0	0	0	112
638	S	35	Very low	34.6	Very low	92 Å²	92	135.6 Å²	135.6	64%	0.643	73%	0.726	S	S	*	*			trans	47.1	141.8	148.9	-62.3	0	0	0	0	121.8
639	L	30.2	Very low	34.1	Very low	158 Å²	158	139.9 Å²	139.9	83%	0.827	74%	0.744	S	S	*	*				64.9	136.5	50.8	-62.4	178.7	0	0	0	112.4
640	P	43.1	Very low	33.9	Very low	119 Å²	119	138 Å²	138	77%	0.773	76%	0.757	S	S	*	*				-145.5	-157.6	54	42.8	-22.4	0	0	0	117.4
641	A	32.5	Very low	34.1	Very low	103 Å²	103	140.3 Å²	140.3	85%	0.851	78%	0.778	S	S	*	*			trans	-69.6	167	-171.3	0	0	0	0	0	115.1
642	G	29.2	Very low	33.9	Very low	64 Å²	64	143.6 Å²	143.6	66%	0.66	79%	0.787	S	S	*	*			cis	160.2	-142.6	1.8	0	0	0	0	0	112.4
643	K	36.2	Very low	34.3	Very low	206 Å²	206	141.7 Å²	141.7	90%	0.896	79%	0.789	S	S	*	*			trans	94	114.4	-175.8	-56.7	153.4	-177.6	155.2	0	116.2
644	K	35.8	Very low	34.4	Very low	197 Å²	197	136.3 Å²	136.3	86%	0.857	78%	0.776	S	S	*	*			trans	55.1	77.6	140.5	-59.7	-179.6	-179.7	177.1	0	119.6
645	S	35.3	Very low	34.3	Very low	103 Å²	103	139.4 Å²	139.4	72%	0.72	78%	0.777	S	S	*	*			trans	19.4	117.5	130.2	60.6	0	0	0	0	120.3
646	F	34.6	Very low	34.3	Very low	219 Å²	219	141 Å²	141	96%	0.961	78%	0.779	S	S	*	*			trans	-166	85.4	142.6	-114	-63.4	0	0	0	116.1
647	G	30	Very low	34.6	Very low	68 Å²	68	139 Å²	139	70%	0.701	78%	0.777	S	S	*	*			trans	64.4	163.3	142.7	0	0	0	0	0	123.1
648	R	34.4	Very low	34.4	Very low	245 Å²	245	134 Å²	134	93%	0.925	78%	0.776	S	S	*	*			trans	76.3	127.8	179.1	-51.1	176.8	-173.8	-139.7	-1.3	113.5
649	K	29.5	Very low	34.5	Very low	201 Å²	201	139.3 Å²	139.3	87%	0.874	79%	0.787	S	S	*	*			cis	91.5	135.7	36.6	-78.2	-80.2	-170.8	180	0	112.9
650	A	32.9	Very low	34.6	Very low	99 Å²	99	140.7 Å²	140.7	82%	0.818	79%	0.787	S	S	*	*			trans	69.6	152.3	-179.1	0	0	0	0	0	113.7
651	S	41.6	Very low	34.1	Very low	104 Å²	104	142.4 Å²	142.4	73%	0.727	79%	0.789	S	S	*	*			cis	-156.2	152.1	-13.6	40.8	0	0	0	0	107.4
652	E	33.9	Very low	34	Very low	167 Å²	167	142.6 Å²	142.6	78%	0.78	78%	0.783	S	S	*	*				37.1	143.2	83.4	-86.6	-159.8	147.5	0	0	115.9
653	P	42.4	Very low	34.1	Very low	125 Å²	125	147.8 Å²	147.8	81%	0.812	79%	0.791	S	S	*	*			cis	-100.6	168	10.5	39.1	-33.8	0	0	0	113.4
654	G	35.5	Very low	33.8	Very low	53 Å²	53	142.9 Å²	142.9	55%	0.546	78%	0.778	S	S	.	*			cis	109.6	146.1	3.2	0	0	0	0	0	113.5
655	Q	32.6	Very low	33.8	Very low	186 Å²	186	140.9 Å²	140.9	87%	0.869	78%	0.776	S	S	*	*			trans	68.6	141	166.4	-73.3	-168.1	20.9	0	0	119.2
656	T	32.8	Very low	33.7	Very low	107 Å²	107	143.7 Å²	143.7	66%	0.656	78%	0.778	S	S	*	*			cis	-170	167.1	-29	6.9	0	0	0	0	109.8
657	V	35.8	Very low	33.8	Very low	109 Å²	109	137.3 Å²	137.3	66%	0.661	77%	0.766	S	S	*	*			trans	53.8	96.3	144.3	174.1	0	0	0	0	116
658	A	30.2	Very low	34.2	Very low	89 Å²	89	143.1 Å²	143.1	74%	0.736	77%	0.772	S	S	*	*				55.3	117.3	67	0	0	0	0	0	116
659	K	35.4	Very low	34.3	Very low	204 Å²	204	135.5 Å²	135.5	89%	0.887	76%	0.756	S	S	*	*			trans	-176.4	157.3	142.5	-102.5	150.2	-171.5	175.4	0	112.5
660	K	32.6	Very low	34.5	Very low	187 Å²	187	133.8 Å²	133.8	81%	0.813	76%	0.755	S	S	*	*			trans	-96.6	166.6	174.1	-63.6	-175.9	175.6	-177.9	0	111.7
661	L	32.1	Very low	34.6	Very low	155 Å²	155	135.4 Å²	135.4	81%	0.812	75%	0.75	S	S	*	*			trans	85.5	134.8	143.2	-81.3	155.7	0	0	0	122.1
662	S	30.8	Very low	34.2	Very low	106 Å²	106	138.1 Å²	138.1	74%	0.741	75%	0.754	S	S	*	*			trans	68.6	150.8	163.6	76.2	0	0	0	0	116.6
663	Q	32.1	Very low	34.4	Very low	174 Å²	174	135 Å²	135	81%	0.813	75%	0.749	S	S	*	*			cis	-127.9	141.6	10.6	-73.3	177.1	-54.6	0	0	109.4
664	T	30.1	Very low	34	Very low	102 Å²	102	134.2 Å²	134.2	63%	0.626	75%	0.753	S	S	*	*				59.2	103.5	63.3	64.3	0	0	0	0	116.9
665	D	34.9	Very low	33.7	Very low	155 Å²	155	135 Å²	135	83%	0.829	76%	0.761	S	S	*	*			trans	-158	109.9	146	-108.9	-23.1	0	0	0	106.9
666	H	33.2	Very low	33.8	Very low	162 Å²	162	132.3 Å²	132.3	75%	0.75	76%	0.757	S	S	*	*				90.8	146.8	57.5	-76.3	-54.1	0	0	0	115.1
667	A	37	Very low	33.7	Very low	86 Å²	86	132.5 Å²	132.5	71%	0.711	76%	0.763	S	S	*	*			trans	73.4	133.5	177.2	0	0	0	0	0	118.2
668	K	37.7	Very low	33.5	Very low	190 Å²	190	132.3 Å²	132.3	83%	0.826	77%	0.767	S	S	*	*			cis	-159.5	133.3	-1.4	-119.2	166	-170.4	172.6	0	112.6
669	S	36.8	Very low	33.7	Very low	85 Å²	85	139.4 Å²	139.4	59%	0.594	77%	0.774	S	S	*	*			trans	8.5	132.4	144.7	59.8	0	0	0	0	120.4
670	I	34.3	Very low	33.8	Very low	165 Å²	165	138.9 Å²	138.9	85%	0.846	77%	0.772	S	S	*	*				-125.9	103.4	124.8	-62.6	-176.8	0	0	0	108.1
671	D	35.4	Very low	33.9	Very low	133 Å²	133	133.3 Å²	133.3	71%	0.711	77%	0.768	S	S	*	*			trans	-85.4	130.1	158.8	-75.9	-73.1	0	0	0	109.4
672	I	32.8	Very low	34	Very low	160 Å²	160	130.7 Å²	130.7	82%	0.821	76%	0.763	S	S	*	*			trans	-143.3	99.2	143.7	-54.8	-176.6	0	0	0	108.2
673	P	38.9	Very low	34.1	Very low	103 Å²	103	133.4 Å²	133.4	67%	0.669	77%	0.769	S	S	*	*			trans	-93.8	167.3	172.6	36.4	-34.3	0	0	0	113
674	A	32.6	Very low	34.2	Very low	108 Å²	108	129.8 Å²	129.8	89%	0.893	77%	0.768	S	S	*	*			trans	65.4	136.8	169	0	0	0	0	0	118
675	G	30.1	Very low	34.1	Very low	70 Å²	70	130.4 Å²	130.4	72%	0.722	77%	0.772	S	S	*	*			trans	168.1	53.5	178.8	0	0	0	0	0	118.8
676	T	34	Very low	34.2	Very low	128 Å²	128	128.6 Å²	128.6	79%	0.785	77%	0.769	S	S	*	*			trans	34.3	108.6	148.3	57	0	0	0	0	121.2
677	S	30.8	Very low	34.1	Very low	112 Å²	112	124.9 Å²	124.9	78%	0.783	77%	0.766	S	S	*	*				68.9	136.2	125.3	76.9	0	0	0	0	123.6
678	S	32.2	Very low	33.9	Very low	105 Å²	105	129.2 Å²	129.2	73%	0.734	77%	0.772	S	S	*	*			trans	72.3	90.7	133.5	-159	0	0	0	0	121.1
679	R	34.2	Very low	33.5	Very low	237 Å²	237	125.2 Å²	125.2	89%	0.894	77%	0.768	S	S	*	*				-134.5	128.2	115.6	-79.4	-167.8	173.2	178.7	-2.6	108.3
680	K	37	Very low	33.3	Very low	194 Å²	194	128.1 Å²	128.1	84%	0.843	78%	0.782	S	S	*	*			cis	84.2	110.3	46.6	-174.6	177.9	-175.2	170.7	0	110.7
681	G	34.3	Very low	33.4	Very low	70 Å²	70	125.9 Å²	125.9	72%	0.722	78%	0.778	S	S	*	*			cis	-165.1	-149.8	1.4	0	0	0	0	0	110.8
682	S	35.3	Very low	33.3	Very low	100 Å²	100	130.9 Å²	130.9	70%	0.699	79%	0.787	S	S	*	*			cis	-177.3	136.5	-3	42.2	0	0	0	0	110.9
683	N	32.9	Very low	33.4	Very low	163 Å²	163	133.8 Å²	133.8	87%	0.872	79%	0.788	S	S	*	*			trans	62	145.9	148.8	-52.9	14.1	0	0	0	118
684	A	33.9	Very low	33.3	Very low	97 Å²	97	136.1 Å²	136.1	80%	0.802	79%	0.79	S	S	*	*			cis	-153.8	154.8	7.9	0	0	0	0	0	113.3
685	T	27.1	Very low	33.5	Very low	116 Å²	116	135.9 Å²	135.9	71%	0.712	78%	0.782	S	S	*	*			trans	-101.5	175.8	150.6	14.1	0	0	0	0	108.9
686	P	38.3	Very low	33.7	Very low	116 Å²	116	140.3 Å²	140.3	75%	0.753	79%	0.788	S	S	*	*			cis	-134.7	-167	-7.1	37.9	-17.8	0	0	0	114.7
687	A	30.9	Very low	33.7	Very low	84 Å²	84	144.5 Å²	144.5	69%	0.694	79%	0.789	S	S	*	*			trans	87.2	132.7	140.4	0	0	0	0	0	123.5
688	E	33	Very low	34	Very low	177 Å²	177	148.7 Å²	148.7	83%	0.827	79%	0.788	S	S	*	*			trans	62.8	100.9	140.2	-66.3	-179	136.6	0	0	123.2
689	S	29.5	Very low	34.1	Very low	107 Å²	107	150.7 Å²	150.7	75%	0.748	79%	0.785	S	S	*	*				35.5	128.1	126	53.2	0	0	0	0	122.4
690	T	32.6	Very low	34	Very low	145 Å²	145	144.4 Å²	144.4	89%	0.89	78%	0.778	S	S	*	*			trans	-153	145.5	144.2	13.2	0	0	0	0	111.7
691	P	36.3	Very low	34	Very low	119 Å²	119	144 Å²	144	77%	0.773	78%	0.776	S	S	*	*			trans	-113.2	155.7	-172.1	40.2	-34.2	0	0	0	116.5
692	R	33.6	Very low	34	Very low	238 Å²	238	147.6 Å²	147.6	90%	0.898	78%	0.778	S	S	*	*			trans	-168.6	115	151.2	-108.1	177.2	164.3	94.7	-2.6	107.5
693	R	34.8	Very low	33.9	Very low	220 Å²	220	147.2 Å²	147.2	83%	0.83	78%	0.775	S	S	*	*				87.7	135.9	63.6	-166.6	176.2	-176.3	134.6	8.4	112.3
694	E	36.8	Very low	34	Very low	153 Å²	153	148.5 Å²	148.5	72%	0.715	77%	0.773	S	S	*	*			trans	79.2	85.6	171.9	-79.6	145.4	-130.8	0	0	121
695	S	35.5	Very low	34	Very low	103 Å²	103	148.1 Å²	148.1	72%	0.72	77%	0.77	S	S	*	*				66.9	123.4	125.3	67.3	0	0	0	0	123.8
696	L	33.9	Very low	34.5	Very low	162 Å²	162	147.4 Å²	147.4	85%	0.848	77%	0.77	S	S	*	*			trans	75	137	145.3	-103.4	75.5	0	0	0	121.9
697	R	35.7	Very low	34.6	Very low	217 Å²	217	147.6 Å²	147.6	82%	0.819	77%	0.765	S	S	*	*			trans	71.2	104.7	161.3	-76.9	-175	168.8	165.9	-1.7	119.9
698	R	36.3	Very low	35.1	Very low	200 Å²	200	149.3 Å²	149.3	76%	0.755	76%	0.761	S	S	*	*				85	118.7	123.1	-80.7	-173.9	174.1	-155.2	-0.1	120.5
699	H	33.7	Very low	35.4	Very low	147 Å²	147	147.4 Å²	147.4	68%	0.681	75%	0.752	S	S	*	*			trans	79.1	120.1	143.9	-55.6	-51.8	0	0	0	121
700	S	32.4	Very low	35.9	Very low	104 Å²	104	149.6 Å²	149.6	73%	0.727	75%	0.751	S	S	*	*			trans	76.4	109.3	131.7	63.8	0	0	0	0	122.3
701	K	36.8	Very low	36.1	Very low	186 Å²	186	149.3 Å²	149.3	81%	0.809	74%	0.737	S	S	*	*				85.2	127.1	121.9	-74.9	-174.4	176.7	-176	0	121
702	L	35	Very low	35.8	Very low	146 Å²	146	151.4 Å²	151.4	76%	0.764	74%	0.737	S	S	*	*			trans	79.1	106.2	137.2	-70.9	168.6	0	0	0	120.2
703	S	33	Very low	35.7	Very low	92 Å²	92	147.1 Å²	147.1	64%	0.643	73%	0.727	S	S	*	*				136.3	114.8	101.4	-82.2	0	0	0	0	118.3
704	F	35.4	Very low	35.6	Very low	190 Å²	190	143.3 Å²	143.3	83%	0.833	72%	0.719	S	S	*	*			trans	63.9	113.4	138.8	-74.6	-83.8	0	0	0	123.8
705	A	34	Very low	35.3	Very low	88 Å²	88	140.1 Å²	140.1	73%	0.727	72%	0.718	S	S	*	*				67.9	152.4	128.2	0	0	0	0	0	119.6
706	S	37.3	Very low	35	Very low	101 Å²	101	141.7 Å²	141.7	71%	0.706	72%	0.718	S	S	*	*			cis	-142.2	-162.4	7.8	-47.3	0	0	0	0	110
707	D	40.2	Very low	35	Very low	121 Å²	121	137.7 Å²	137.7	65%	0.647	71%	0.708	S	S	*	*			cis	-165.9	162.5	3	-134.7	-39.6	0	0	0	112.3
708	L	41.8	Very low	35	Very low	120 Å²	120	135.1 Å²	135.1	63%	0.628	71%	0.705	S	S	*	*			trans	59.7	149.2	158.5	-52.5	170.4	0	0	0	119.7
709	E	40.1	Very low	35	Very low	136 Å²	136	133 Å²	133	64%	0.636	70%	0.704	S	S	*	*			cis	-168.4	165	-10.3	-115.1	176.1	152.1	0	0	107	K711	E709-K711 IonicContact OE1-NZ 3.82Å; E709-K711 PolarHBondContact OE1-NZ 3.27Å
710	E	38	Very low	35.1	Very low	154 Å²	154	130.4 Å²	130.4	72%	0.72	70%	0.702	S	S	*	*			cis	-141.2	169.2	0.5	-69.1	-159	88.2	0	0	108.3
711	K	37.2	Very low	35.2	Very low	139 Å²	139	132.4 Å²	132.4	60%	0.604	70%	0.703	S	S	*	*			cis	-164.7	140.6	-32	-99.4	-171.3	-171.8	71.4	0	107.1	E709	E709-K711 IonicContact OE1-NZ 3.82Å; E709-K711 PolarHBondContact OE1-NZ 3.27Å
712	E	30.6	Very low	35	Very low	163 Å²	163	131.5 Å²	131.5	76%	0.762	70%	0.702	S	S	*	*			trans	-131.5	137	168.5	-93.6	-144.9	107.8	0	0	110.9
713	Q	31.1	Very low	35	Very low	147 Å²	147	130.5 Å²	130.5	69%	0.687	70%	0.702	S	S	*	*			trans	60.3	173.9	153.8	-55.6	178.4	36.3	0	0	115.5
714	E	32.6	Very low	35.6	Very low	141 Å²	141	132 Å²	132	66%	0.659	71%	0.709	S	S	*	*			cis	-138.2	-176.8	-5.4	-147.9	-176.1	170.9	0	0	109.8
715	A	30.7	Very low	35.6	Very low	86 Å²	86	127.8 Å²	127.8	71%	0.711	71%	0.71	S	S	*	*			trans	-85.4	165.3	-167.9	0	0	0	0	0	115.9
716	L	30	Very low	35.6	Very low	136 Å²	136	130.3 Å²	130.3	71%	0.712	71%	0.711	S	S	*	*				-176.7	168.4	113.9	-102.6	171.5	0	0	0	115.1	L552	L552-L716 HydrophobicContact CD1-CD1 3.83Å; L552-L716 HydrophobicContact CD1-CG 4.4Å; L552-L716 HydrophobicContact CD2-CD1 3.9Å; L552-L716 HydrophobicContact CG-CD1 4.5Å
717	A	33.4	Very low	35.4	Very low	77 Å²	77	135.6 Å²	135.6	64%	0.636	72%	0.717	S	S	*	*			trans	82	101.4	158.4	0	0	0	0	0	121.1
718	E	35.9	Very low	35.3	Very low	164 Å²	164	136.2 Å²	136.2	77%	0.766	73%	0.726	S	S	*	*				81.7	122.6	120.5	-71.9	-174.5	-130.4	0	0	124.4
719	Q	36.4	Very low	34.6	Very low	156 Å²	156	139 Å²	139	73%	0.729	74%	0.735	S	S	*	*			trans	76.6	100.8	137.6	-63.9	-171.2	56.5	0	0	122.5
720	S	35.6	Very low	34.6	Very low	92 Å²	92	137.1 Å²	137.1	64%	0.643	74%	0.735	S	S	*	*				72.6	120.8	112.8	-53.4	0	0	0	0	123
721	I	34.8	Very low	34.5	Very low	145 Å²	145	135.4 Å²	135.4	74%	0.744	74%	0.735	S	S	*	*				66.1	129.7	124	-65.4	170.2	0	0	0	117.9
722	E	32.4	Very low	34.6	Very low	168 Å²	168	137 Å²	137	79%	0.785	75%	0.745	S	S	*	*			cis	-159.7	174.1	1.9	-123.7	175.3	174.2	0	0	114
723	T	34.2	Very low	35	Very low	124 Å²	124	137.6 Å²	137.6	76%	0.761	75%	0.747	S	S	*	*			trans	-57.5	162.6	170.1	7.8	0	0	0	0	115.5
724	P	45.2	Very low	34.9	Very low	123 Å²	123	137 Å²	137	80%	0.799	75%	0.753	S	S	*	*				-159.6	163.1	80.6	42.2	-21.8	0	0	0	119.9
725	A	36.8	Very low	34.9	Very low	103 Å²	103	136.2 Å²	136.2	85%	0.851	75%	0.754	S	S	*	*			trans	-165.2	142.4	141.3	0	0	0	0	0	109.5
726	D	32.7	Very low	35.1	Very low	141 Å²	141	137.3 Å²	137.3	75%	0.754	75%	0.747	S	S	*	*			trans	-135.3	170.4	-159.8	-130.6	-36	0	0	0	114.2
727	Y	33.2	Very low	35.4	Very low	212 Å²	212	138.4 Å²	138.4	83%	0.831	74%	0.742	S	S	*	*			trans	72.7	144.4	177.2	-61.9	-81.2	0	0	0	117.5
728	T	38.7	Very low	35.4	Very low	134 Å²	134	142.6 Å²	142.6	82%	0.822	75%	0.746	S	S	*	*			cis	-129.3	144.3	19.2	52.1	0	0	0	0	116
729	Q	27.6	Very low	35.4	Very low	178 Å²	178	139.3 Å²	139.3	83%	0.832	74%	0.737	S	S	*	*			trans	-70.2	-177.7	159.9	-105.9	-172.9	5.6	0	0	112.4
730	P	39	Very low	35.6	Very low	97 Å²	97	136 Å²	136	63%	0.63	73%	0.731	S	S	*	*			cis	-139	-160.2	20.6	39.9	-17.4	0	0	0	116
731	T	36.2	Very low	35.8	Very low	118 Å²	118	136.6 Å²	136.6	72%	0.724	72%	0.724	S	S	*	*			trans	70.6	137.4	171	59.2	0	0	0	0	117.5
732	E	38.7	Very low	35.9	Very low	171 Å²	171	131.3 Å²	131.3	80%	0.799	70%	0.699	S	S	*	*			cis	-159.2	174.4	-24.1	-137.7	156.6	-156.3	0	0	109.6
733	E	39.5	Very low	36	Very low	176 Å²	176	127.5 Å²	127.5	82%	0.822	68%	0.683	S	S	*	*			trans	46.6	90	167.8	-59.4	-160.3	124.3	0	0	119.9
734	V	29.8	Very low	36	Very low	134 Å²	134	125 Å²	125	81%	0.812	67%	0.674	S	S	*	*			trans	41.8	96.7	134.5	-169.3	0	0	0	0	118.1
735	L	32.4	Very low	35.3	Very low	126 Å²	126	123.8 Å²	123.8	66%	0.66	67%	0.669	S	S	*	*				174.7	106.4	129	-97.9	168.7	0	0	0	111.5	F1016	L735-F1016 HydrophobicContact CB-CE2 3.67Å; L735-F1016 HydrophobicContact CB-CZ 3.81Å; L735-F1016 HydrophobicContact CD2-CD2 4.3Å; L735-F1016 HydrophobicContact CD2-CE2 3.51Å; L735-F1016 HydrophobicContact CD2-CZ 4.3Å; L735-F1016 HydrophobicContact CG-CE2 4.15Å; L735-F1016 VanDerWaalsContact O-CZ 3.3Å; L735-F1016 WeakPolarHBondContact O-CZ 3.41Å
736	D	34.2	Very low	35.1	Very low	109 Å²	109	124.3 Å²	124.3	58%	0.583	66%	0.664	S	S	*	*			trans	-173.3	153.7	164.1	-115	20.3	0	0	0	109.1	F1016	D736-F1016 VanDerWaalsContact CA-CE2 3.43Å; D736-F1016 VanDerWaalsContact N-CE2 3.33Å
737	R	37.1	Very low	35.3	Very low	158 Å²	158	122.3 Å²	122.3	60%	0.596	66%	0.658	S	S	*	*			cis	-161.7	104.7	-22.6	-129.9	177.9	-162.1	123.8	-1.6	111.5	F1016	R737-F1016 HydrophobicContact CB-CB 4.29Å; R737-F1016 HydrophobicContact CB-CG 4.23Å; R737-F1016 HydrophobicContact CG-CB 3.74Å; R737-F1016 HydrophobicContact CG-CD1 3.38Å; R737-F1016 HydrophobicContact CG-CD2 4.15Å; R737-F1016 HydrophobicContact CG-CE1 3.94Å; R737-F1016 HydrophobicContact CG-CG 3.49Å; R737-F1016 VanDerWaalsContact CG-CG 3.49Å; R737-F1016 HydrophobicContact CG-CZ 4.5Å
738	K	33	Very low	35.2	Very low	165 Å²	165	119.6 Å²	119.6	72%	0.717	66%	0.657	S	S	*	*			trans	165.7	137.7	148.2	-85.8	143.5	-167.1	170.1	0	109.3	Y1015 F1016	K738-Y1015 CarbonylContact C-O 3.52Å; K738-Y1015 VanDerWaalsContact C-O 3.28Å; K738-Y1015 PolarHBondContact N-O 3.37Å; K738-Y1015 CarbonylContact O-C 3.38Å; K738-Y1015 VanDerWaalsContact O-C 3.27Å; K738-F1016 VanDerWaalsContact C-N 3.25Å; K738-F1016 VanDerWaalsContact N-CB 3.33Å
739	T	36.4	Very low	35.3	Very low	96 Å²	96	119.2 Å²	119.2	59%	0.589	66%	0.655	S	S	*	*	B	Isolated β-bridge	cis	-145	174.1	-3.2	9.9	0	0	0	0	108.6	Y1015 F1016	T739-Y1015 VanDerWaalsContact N-C 3.35Å; T739-Y1015 CarbonylContact O-C 3.48Å; T739-Y1015 WeakPolarHBondContact O-CA 3.44Å; T739-F1016 CarbonylContact C-O 3.59Å; T739-F1016 VanDerWaalsContact CA-N 3.34Å; T739-F1016 WeakPolarHBondContact CA-O 3.49Å; T739-F1016 PolarHBondContact O-N 3.26Å
740	S	41.2	Very low	35.6	Very low	86 Å²	86	115.8 Å²	115.8	60%	0.601	65%	0.648	S	S	*	*			cis	-160.1	140.4	-11	42.4	0	0	0	0	112.2	F1016 A1017	S740-F1016 WeakPolarHBondContact CA-O 3.28Å; S740-F1016 PolarHBondContact N-O 3.1Å; S740-A1017 CarbonylContact C-O 3.52Å; S740-A1017 WeakPolarHBondContact CA-O 3.17Å
741	E	39.1	Very low	35.4	Very low	104 Å²	104	117 Å²	117	49%	0.486	66%	0.659	S	S	.	*			trans	71.8	38.6	135.5	-61.8	-66.9	113	0	0	123.3	A1017 L1018 R1019 R1020	E741-A1017 PolarHBondContact N-O 3.21Å; E741-L1018 WeakPolarHBondContact OE1-CA 3.39Å; E741-L1018 PolarHBondContact OE1-N 3.23Å; E741-R1019 PolarHBondContact OE1-N 3.47Å; E741-R1019 VanDerWaalsContact OE2-CA 3.29Å; E741-R1019 WeakPolarHBondContact OE2-CA 3.35Å; E741-R1019 PolarHBondContact OE2-N 2.9Å; E741-R1020 PolarHBondContact OE2-N 3.36Å
742	T	35.5	Very low	35.4	Very low	35 Å²	35	119.2 Å²	119.2	22%	0.215	66%	0.661	C	S	.	*			trans	86.1	132.9	138.3	-68.9	0	0	0	0	126	L1018 R1019 R1020	T742-L1018 WeakPolarHBondContact OG1-CA 3.42Å; T742-L1018 WeakPolarHBondContact OG1-CB 3.36Å; T742-L1018 WeakPolarHBondContact OG1-CG 3.36Å; T742-R1019 HydrophobicContact CG2-CB 4.38Å; T742-R1019 HydrophobicContact CG2-CG 3.63Å; T742-R1019 WeakPolarHBondContact OG1-CA 3.29Å; T742-R1019 WeakPolarHBondContact OG1-CG 3.07Å; T742-R1019 PolarHBondContact OG1-N 3.38Å; T742-R1020 HydrophobicContact CG2-CB 4.42Å; T742-R1020 HydrophobicContact CG2-CG 3.59Å
743	I	36.3	Very low	35.1	Very low	88 Å²	88	119.6 Å²	119.6	45%	0.451	67%	0.665	S	S	.	*			trans	21	106.1	134.1	-41.3	171.1	0	0	0	119.1	L1018 R1020	I743-L1018 HydrophobicContact CD1-CD2 3.84Å; I743-L1018 HydrophobicContact CG1-CD2 4.05Å; I743-R1020 VanDerWaalsContact O-CD 3.24Å; I743-R1020 WeakPolarHBondContact O-CD 3.22Å; I743-R1020 PolarHBondContact O-NE 3.33Å; I743-R1020 PolarHBondContact O-NH1 3.2Å
744	A	33.3	Very low	34.6	Very low	71 Å²	71	114.9 Å²	114.9	59%	0.587	66%	0.663	S	S	*	*				26.6	140.9	122.5	0	0	0	0	0	123.1	R1020	A744-R1020 PolarHBondContact O-NH1 3.36Å; A744-R1020 PolarHBondContact O-NH2 3.37Å; A744-R1020 VanDerWaalsContact O-NH2 3.16Å
745	S	30.2	Very low	34.9	Very low	98 Å²	98	113.6 Å²	113.6	69%	0.685	66%	0.661	S	S	*	*			trans	-23.8	162.5	150.5	-39.1	0	0	0	0	116.9
746	P	33.9	Very low	35.2	Very low	114 Å²	114	117.3 Å²	117.3	74%	0.74	67%	0.671	S	S	*	*			cis	-134.1	-122.2	24.7	28.4	-0.1	0	0	0	115
747	P	36.8	Very low	35.6	Very low	98 Å²	98	117.5 Å²	117.5	64%	0.636	68%	0.678	S	S	*	*				-134.9	-174.5	-106.1	44.7	-27.6	0	0	0	116.5
748	L	30.3	Very low	35.5	Very low	156 Å²	156	115.6 Å²	115.6	82%	0.817	68%	0.684	S	S	*	*			trans	64.7	123.5	151.3	-75.6	160.4	0	0	0	120.4
749	T	41.3	Very low	35.5	Very low	125 Å²	125	116 Å²	116	77%	0.767	69%	0.688	S	S	*	*			trans	-44	147.9	155.4	50.6	0	0	0	0	113.7
750	P	34.6	Very low	35.3	Very low	107 Å²	107	115.8 Å²	115.8	70%	0.695	70%	0.696	S	S	*	*				-153.3	147.6	94.4	38.4	-21.1	0	0	0	117.6
751	S	34.3	Very low	35.4	Very low	122 Å²	122	117.4 Å²	117.4	85%	0.853	71%	0.705	S	S	*	*			trans	169.8	112.4	152.5	-75.5	0	0	0	0	106.3
752	Q	34.7	Very low	35.2	Very low	164 Å²	164	121 Å²	121	77%	0.766	72%	0.724	S	S	*	*			cis	73.2	107.9	17.5	-154	177.4	19.6	0	0	115.4
753	M	33.2	Very low	35.1	Very low	180 Å²	180	127.2 Å²	127.2	89%	0.887	75%	0.751	S	S	*	*			trans	63.9	143.7	171.1	-66.1	158.4	57.4	0	0	117.1
754	G	28.3	Very low	35	Very low	76 Å²	76	131.4 Å²	131.4	78%	0.784	77%	0.768	S	S	*	*			cis	167.4	132	-9.4	0	0	0	0	0	113.9
755	S	37.2	Very low	35.1	Very low	108 Å²	108	133 Å²	133	76%	0.755	78%	0.775	S	S	*	*			trans	-152.8	100.9	171.1	53.1	0	0	0	0	109
756	K	38.2	Very low	35.2	Very low	204 Å²	204	133.5 Å²	133.5	89%	0.887	78%	0.779	S	S	*	*				81.8	134.6	103.3	-78.6	-173.7	175.8	-173.9	0	113.8
757	P	43.7	Very low	35.2	Very low	112 Å²	112	132.2 Å²	132.2	73%	0.727	78%	0.778	S	S	*	*			cis	-120.7	163.2	-17.7	43.6	-28.6	0	0	0	111.9
758	V	33.5	Very low	35.2	Very low	119 Å²	119	135.8 Å²	135.8	72%	0.721	79%	0.791	S	S	*	*				54.6	130.6	105.1	-173.3	0	0	0	0	113.4
759	E	33	Very low	35.4	Very low	173 Å²	173	133.4 Å²	133.4	81%	0.808	79%	0.787	S	S	*	*			cis	-137.5	140.3	24.4	-127.9	126	-138.5	0	0	108.7
760	A	32.6	Very low	35.3	Very low	91 Å²	91	132.2 Å²	132.2	75%	0.752	78%	0.783	S	S	*	*				89.1	149.1	63.9	0	0	0	0	0	114.7
761	P	44.1	Very low	35.3	Very low	121 Å²	121	137.9 Å²	137.9	79%	0.786	79%	0.791	S	S	*	*			trans	-120.4	173.8	-159.1	43	-32	0	0	0	115.4
762	M	33.9	Very low	35.4	Very low	180 Å²	180	141.6 Å²	141.6	89%	0.887	79%	0.792	S	S	*	*			trans	-170.2	178.7	136.8	-109.9	-176.4	78.7	0	0	114
763	E	33.8	Very low	35.4	Very low	165 Å²	165	138.7 Å²	138.7	77%	0.771	79%	0.789	S	S	*	*			trans	-93	174.5	-176.2	-62.6	171.2	119.6	0	0	113.8
764	E	34	Very low	35.5	Very low	175 Å²	175	135.4 Å²	135.4	82%	0.818	78%	0.784	S	S	*	*			trans	55.3	99.8	153.4	-72.4	-173.9	171.8	0	0	122.3
765	S	35.2	Very low	35.9	Very low	104 Å²	104	137.2 Å²	137.2	73%	0.727	79%	0.785	S	S	*	*				83.3	146	124.8	85.7	0	0	0	0	121.9
766	S	33.7	Very low	35.9	Very low	110 Å²	110	136.5 Å²	136.5	77%	0.769	79%	0.786	S	S	*	*			trans	75.1	115.9	149.8	-52.3	0	0	0	0	121.3
767	A	33.5	Very low	35.8	Very low	87 Å²	87	131.8 Å²	131.8	72%	0.719	78%	0.784	S	S	*	*			trans	72	109.4	139.2	0	0	0	0	0	122
768	L	35.3	Very low	35.5	Very low	173 Å²	173	129.9 Å²	129.9	91%	0.906	78%	0.779	S	S	*	*			trans	75.5	135.4	133.2	-62.6	170.2	0	0	0	122.1
769	S	35.9	Very low	35.8	Very low	106 Å²	106	132.8 Å²	132.8	74%	0.741	78%	0.784	S	S	*	*			trans	103.1	81.7	139.6	-146	0	0	0	0	121.5
770	S	38.1	Very low	36	Very low	99 Å²	99	132.7 Å²	132.7	69%	0.692	78%	0.784	S	S	*	*				98.7	148.8	119.5	83.9	0	0	0	0	122.1
771	R	35	Very low	36.1	Very low	226 Å²	226	133.2 Å²	133.2	85%	0.853	78%	0.778	S	S	*	*			trans	72	107.5	170.3	-61.3	-180	176.1	-169.7	-3.8	115.2
772	K	35.7	Very low	35.7	Very low	201 Å²	201	133.4 Å²	133.4	87%	0.874	78%	0.777	S	S	*	*				71.9	133.4	76.5	-73.1	-169.2	175.4	-169.3	0	111.4
773	S	35.3	Very low	35.6	Very low	102 Å²	102	130.6 Å²	130.6	71%	0.713	78%	0.775	S	S	*	*			cis	-150.4	158.4	34.3	-56.7	0	0	0	0	115.2
774	S	35.6	Very low	35.7	Very low	112 Å²	112	131.8 Å²	131.8	78%	0.783	77%	0.772	S	S	*	*			trans	55.9	138	150.7	53.5	0	0	0	0	120.3
775	S	36.2	Very low	35.7	Very low	114 Å²	114	133.1 Å²	133.1	80%	0.797	77%	0.77	S	S	*	*			cis	-174.2	149.5	-2.3	47.2	0	0	0	0	108.3
776	A	36.9	Very low	35.8	Very low	93 Å²	93	133.4 Å²	133.4	77%	0.769	76%	0.76	S	S	*	*			cis	-157.3	156.4	0.3	0	0	0	0	0	111.4
777	A	36.1	Very low	36	Very low	104 Å²	104	132.7 Å²	132.7	86%	0.86	76%	0.755	S	S	*	*			trans	53.5	144.6	154.5	0	0	0	0	0	120.5
778	A	38.3	Very low	36.1	Very low	73 Å²	73	135.9 Å²	135.9	60%	0.603	76%	0.759	S	S	*	*			cis	-167	129.6	-15.3	0	0	0	0	0	105.4
779	E	40.5	Very low	36.2	Very low	179 Å²	179	133.5 Å²	133.5	84%	0.836	74%	0.741	S	S	*	*				67.5	140.4	95.7	-64	162.9	169.8	0	0	113.8
780	E	35.4	Very low	36.3	Very low	171 Å²	171	131.3 Å²	131.3	80%	0.799	73%	0.726	S	S	*	*			cis	-153.1	163.9	4.6	-124.7	-175.2	158.2	0	0	114.7
781	T	35.1	Very low	36.2	Very low	103 Å²	103	132.5 Å²	132.5	63%	0.632	72%	0.724	S	S	*	*			trans	-37.2	149.1	167.7	45.7	0	0	0	0	118.7
782	T	35.7	Very low	36.1	Very low	125 Å²	125	126 Å²	126	77%	0.767	71%	0.713	S	S	*	*			cis	89.5	130.7	43.6	66.8	0	0	0	0	118.3
783	S	32.9	Very low	36	Very low	121 Å²	121	122.4 Å²	122.4	85%	0.846	71%	0.708	S	S	*	*			trans	75.7	-179.4	159	-57.5	0	0	0	0	119.3
784	R	34.5	Very low	35.9	Very low	189 Å²	189	124.4 Å²	124.4	71%	0.713	71%	0.711	S	S	*	*				173.6	164	-79.2	172.4	175.2	169.8	-165.9	-5.7	110.9	E786	R784-E786 IonicContact CZ-OE1 3.1Å; R784-E786 IonicContact NE-OE1 3.21Å; R784-E786 PolarHBondContact NE-OE1 3.24Å; R784-E786 IonicContact NH2-OE1 2.74Å; R784-E786 PolarHBondContact NH2-OE1 3.11Å; R784-E786 IonicContact NH2-OE2 3.53Å; R784-E786 PolarHBondContact NH2-OE2 2.86Å
785	R	35	Very low	35.8	Very low	204 Å²	204	124.1 Å²	124.1	77%	0.77	71%	0.709	S	S	*	*			trans	90.7	150.4	164.6	-89.3	176.2	158.5	-154.9	-24.9	116.9
786	E	37.2	Very low	35.7	Very low	109 Å²	109	123.3 Å²	123.3	51%	0.509	71%	0.709	S	S	.	*			cis	158.5	157.8	-25.8	-95.7	149.4	-123.3	0	0	105.8	R784	R784-E786 IonicContact CZ-OE1 3.1Å; R784-E786 IonicContact NE-OE1 3.21Å; R784-E786 PolarHBondContact NE-OE1 3.24Å; R784-E786 IonicContact NH2-OE1 2.74Å; R784-E786 PolarHBondContact NH2-OE1 3.11Å; R784-E786 IonicContact NH2-OE2 3.53Å; R784-E786 PolarHBondContact NH2-OE2 2.86Å
787	S	37.2	Very low	35.7	Very low	96 Å²	96	124 Å²	124	67%	0.671	71%	0.714	S	S	*	*			cis	172.9	155.9	-11.2	55.2	0	0	0	0	106.6
788	L	35.9	Very low	35.6	Very low	153 Å²	153	123.6 Å²	123.6	80%	0.801	71%	0.711	S	S	*	*			cis	-178	175.5	-2.4	-102.9	169.6	0	0	0	107.2
789	K	37.3	Very low	35.9	Very low	124 Å²	124	125.5 Å²	125.5	54%	0.539	72%	0.718	S	S	.	*			trans	105.6	156.4	169.3	-63.1	165.3	-177.9	175.1	0	115.7	E415	E415-K789 PolarHBondContact O-NZ 3.43Å
790	S	38.8	Very low	35.7	Very low	60 Å²	60	125.7 Å²	125.7	42%	0.42	72%	0.718	S	S	.	*			cis	-174.6	160.1	-15	49.4	0	0	0	0	113.8
791	L	36	Very low	35.6	Very low	124 Å²	124	121.8 Å²	121.8	65%	0.649	72%	0.716	S	S	*	*			trans	72.8	160.4	164.7	-56.1	146.1	0	0	0	115.9	E416	E416-L791 HydrophobicContact CG-CD1 4.14Å; E416-L791 WeakPolarHBondContact OE1-CD1 3.1Å
792	S	33.2	Very low	35.6	Very low	88 Å²	88	124.9 Å²	124.9	62%	0.615	73%	0.727	S	S	*	*			cis	-163.6	146	-26.3	-100.4	0	0	0	0	113.3
793	T	33.3	Very low	35.5	Very low	127 Å²	127	123.3 Å²	123.3	78%	0.779	73%	0.727	S	S	*	*			trans	48.6	126.5	149.4	60.5	0	0	0	0	123.2
794	D	33.2	Very low	35.5	Very low	144 Å²	144	121.1 Å²	121.1	77%	0.77	72%	0.723	S	S	*	*				133	142.7	109.4	-138.8	-26.5	0	0	0	117.7
795	S	32.9	Very low	35.4	Very low	106 Å²	106	120.4 Å²	120.4	74%	0.741	73%	0.733	S	S	*	*			trans	65.4	148.8	157.9	-72.8	0	0	0	0	121.3
796	A	34	Very low	35.6	Very low	96 Å²	96	118.9 Å²	118.9	79%	0.793	73%	0.732	S	S	*	*			cis	-167.6	144.4	-17	0	0	0	0	0	112.7
797	A	36.8	Very low	35.7	Very low	107 Å²	107	120.7 Å²	120.7	88%	0.884	74%	0.74	S	S	*	*			trans	-161.4	148	149.9	0	0	0	0	0	110.5
798	A	34.6	Very low	35.7	Very low	96 Å²	96	124 Å²	124	79%	0.793	75%	0.745	S	S	*	*			trans	-136.2	-172.4	-175.8	0	0	0	0	0	108.7
799	P	45.4	Very low	35.7	Very low	114 Å²	114	122.3 Å²	122.3	74%	0.74	74%	0.741	S	S	*	*			cis	-143.1	179.1	5.6	42.1	-22.2	0	0	0	117.7
800	E	35.1	Very low	35.5	Very low	182 Å²	182	123.3 Å²	123.3	85%	0.85	75%	0.748	S	S	*	*			trans	143.4	103.1	143.6	-78.9	-171.3	178.4	0	0	109.8
801	A	34.6	Very low	35.4	Very low	90 Å²	90	128 Å²	128	74%	0.744	77%	0.766	S	S	*	*				81.8	135.3	76.6	0	0	0	0	0	112.9
802	L	33.6	Very low	35.4	Very low	167 Å²	167	129.6 Å²	129.6	87%	0.874	77%	0.77	S	S	*	*			cis	-156.9	177.3	-4.3	-126.8	168.4	0	0	0	110.9
803	A	33.5	Very low	35.9	Very low	92 Å²	92	129.6 Å²	129.6	76%	0.76	77%	0.768	S	S	*	*			trans	-34.7	150.5	-175.2	0	0	0	0	0	119.7
804	G	33.8	Very low	35.9	Very low	75 Å²	75	130.4 Å²	130.4	77%	0.773	77%	0.768	S	S	*	*			trans	-91.6	-171.6	176.9	0	0	0	0	0	116.4
805	L	31.4	Very low	36.1	Very low	174 Å²	174	131.8 Å²	131.8	91%	0.911	77%	0.77	S	S	*	*			trans	57.4	82.1	170.6	-80.3	171.1	0	0	0	117.8
806	K	39.2	Very low	36.1	Very low	172 Å²	172	134.5 Å²	134.5	75%	0.748	77%	0.774	S	S	*	*				-175.9	146.5	129.5	-109.9	157.4	159.5	-86.5	0	113.4
807	E	40	Very low	36	Very low	148 Å²	148	134 Å²	134	69%	0.692	77%	0.77	S	S	*	*				57.1	120.8	128.5	-151.7	161.9	-167.2	0	0	117.2
808	E	37.1	Very low	35.7	Very low	165 Å²	165	135.7 Å²	135.7	77%	0.771	77%	0.769	S	S	*	*			cis	-169.3	170.1	-0.4	-160	-168.9	165.7	0	0	108.1
809	V	35.2	Very low	35.7	Very low	117 Å²	117	135.7 Å²	135.7	71%	0.709	77%	0.769	S	S	*	*			trans	66.7	117.4	166	-173.7	0	0	0	0	115.4
810	Q	33.5	Very low	35.2	Very low	146 Å²	146	134.4 Å²	134.4	68%	0.682	77%	0.768	S	S	*	*			cis	-141.1	-141.8	0	-146.9	-172.1	-33.3	0	0	108.6
811	I	37.1	Very low	35	Very low	157 Å²	157	134.1 Å²	134.1	81%	0.805	77%	0.767	S	S	*	*			cis	-124.6	-178.2	13.8	-66.5	173.4	0	0	0	109.4
812	E	35.5	Very low	35.1	Very low	158 Å²	158	140.7 Å²	140.7	74%	0.738	77%	0.774	S	S	*	*			trans	-72.8	172.9	-176.6	-107.9	-172.5	-176.5	0	0	116.3
813	P	44	Very low	35	Very low	89 Å²	89	140.9 Å²	140.9	58%	0.578	77%	0.771	S	S	*	*				-146.5	-163.2	-109.3	45.9	-25	0	0	0	116.2
814	D	33.3	Very low	35.6	Very low	143 Å²	143	141.1 Å²	141.1	77%	0.765	77%	0.765	S	S	*	*			trans	64.7	161.1	147.8	-61.8	-26.4	0	0	0	119.2
815	E	36.6	Very low	35.8	Very low	174 Å²	174	145.2 Å²	145.2	81%	0.813	76%	0.764	S	S	*	*			cis	-147.5	157.8	9.6	-153.8	173.9	-138.7	0	0	111.5
816	I	33	Very low	35.8	Very low	163 Å²	163	145.7 Å²	145.7	84%	0.836	76%	0.761	S	S	*	*			trans	-139.1	113.9	169.5	-59	-179.9	0	0	0	111.4
817	A	33.2	Very low	35.7	Very low	85 Å²	85	143.8 Å²	143.8	70%	0.702	76%	0.763	S	S	*	*			trans	47.5	132.3	159.7	0	0	0	0	0	119.1
818	T	30.5	Very low	35.5	Very low	142 Å²	142	142.9 Å²	142.9	87%	0.871	77%	0.768	S	S	*	*				-170.5	158.1	70.8	-57.1	0	0	0	0	110.5
819	A	35	Very low	35.2	Very low	96 Å²	96	140.1 Å²	140.1	79%	0.793	77%	0.767	S	S	*	*			trans	-81.7	157.3	-172.6	0	0	0	0	0	116.3
820	A	33.2	Very low	35.6	Very low	87 Å²	87	139.6 Å²	139.6	72%	0.719	77%	0.766	S	S	*	*				-177.6	136.2	129.6	0	0	0	0	0	115
821	Q	32	Very low	35.6	Very low	176 Å²	176	137.6 Å²	137.6	82%	0.822	76%	0.764	S	S	*	*			trans	52.2	121	147.8	-64.1	179.9	-40.5	0	0	121.6
822	Y	35.7	Very low	35.4	Very low	229 Å²	229	135.6 Å²	135.6	90%	0.898	75%	0.754	S	S	*	*				-162	144.4	95.7	-115.2	-84.1	0	0	0	112.2
823	E	33.1	Very low	35.5	Very low	171 Å²	171	135.2 Å²	135.2	80%	0.799	75%	0.752	S	S	*	*			trans	-93.6	174.5	174.2	-121.2	-167.9	153.1	0	0	110.3
824	P	45.5	Very low	35.3	Very low	97 Å²	97	136.3 Å²	136.3	63%	0.63	75%	0.75	S	S	*	*			cis	-150.6	-175	45.3	44.3	-23.2	0	0	0	118.4
825	E	38	Very low	35.5	Very low	161 Å²	161	135 Å²	135	75%	0.752	74%	0.739	S	S	*	*			trans	58.8	106.3	152.9	-74.2	159.4	-149.9	0	0	118.2
826	Q	30.6	Very low	35.4	Very low	183 Å²	183	136 Å²	136	86%	0.855	74%	0.743	S	S	*	*				58.4	123	81.7	-68.8	-169	44.2	0	0	115.8
827	V	37.2	Very low	35.8	Very low	132 Å²	132	131.8 Å²	131.8	80%	0.8	73%	0.727	S	S	*	*				172.6	118.4	127.6	151.9	0	0	0	0	111.1
828	T	35.5	Very low	36.1	Very low	129 Å²	129	138.6 Å²	138.6	79%	0.791	73%	0.734	S	S	*	*			trans	23	129	158.3	62.5	0	0	0	0	123.3
829	S	31.1	Very low	36.4	Very low	108 Å²	108	138.3 Å²	138.3	76%	0.755	73%	0.725	S	S	*	*			trans	-66.7	-172.3	147.5	55.1	0	0	0	0	111.4
830	P	43.6	Very low	36.7	Very low	106 Å²	106	140.5 Å²	140.5	69%	0.688	72%	0.72	S	S	*	*			cis	-150.1	-162.8	21.9	44.6	-21.2	0	0	0	117.7
831	T	33.7	Very low	36.9	Very low	103 Å²	103	143.4 Å²	143.4	63%	0.632	72%	0.719	S	S	*	*			trans	69.6	109.5	150.4	-58.2	0	0	0	0	116.8
832	I	32.6	Very low	37.1	Very low	115 Å²	115	142.5 Å²	142.5	59%	0.59	72%	0.715	S	S	*	*				69.1	137.1	60.9	-59.6	165.3	0	0	0	111.7
833	E	38.6	Very low	37.5	Very low	150 Å²	150	137 Å²	137	70%	0.701	71%	0.707	S	S	*	*			trans	-178.5	140	139.6	-102.5	-158.9	143.4	0	0	114.4
834	Q	38.9	Very low	38.2	Very low	113 Å²	113	134.1 Å²	134.1	53%	0.528	70%	0.703	S	S	.	*			trans	67.4	151	136.8	-68.4	-167.6	17.5	0	0	121.8	Y241	Y241-Q834 PolarHBondContact OH-O 3.07Å
835	E	39.2	Very low	37.7	Very low	116 Å²	116	136.4 Å²	136.4	54%	0.542	72%	0.715	S	S	.	*			cis	-159.6	164.9	-11.8	-132.1	-174.2	-165.6	0	0	111.7	Y241 P837	Y241-E835 PolarHBondContact OH-N 2.78Å; Y241-E835 VanDerWaalsContact OH-N 3.15Å; E835-P837 VanDerWaalsContact CD-CD 3.48Å; E835-P837 VanDerWaalsContact OE2-CD 3.22Å; E835-P837 WeakPolarHBondContact OE2-CD 3.33Å
836	Q	33	Very low	37.7	Very low	194 Å²	194	131.8 Å²	131.8	91%	0.907	71%	0.711	S	S	*	*				-164.8	128.7	114.2	-116	179.8	58.4	0	0	115.8
837	P	41.6	Very low	38.1	Very low	75 Å²	75	131.6 Å²	131.6	49%	0.487	71%	0.707	S	S	.	*			trans	-121	170	173.7	41.6	-32.1	0	0	0	113.7	E835	E835-P837 VanDerWaalsContact CD-CD 3.48Å; E835-P837 VanDerWaalsContact OE2-CD 3.22Å; E835-P837 WeakPolarHBondContact OE2-CD 3.33Å
838	R	40.1	Very low	38	Very low	227 Å²	227	134.2 Å²	134.2	86%	0.857	71%	0.708	S	S	*	*			trans	168.2	157.4	149.2	-97.1	155.5	-166.6	-148.3	1.5	111.3
839	M	37.4	Very low	37.8	Very low	137 Å²	137	138.2 Å²	138.2	68%	0.675	71%	0.71	S	S	*	*			cis	-127.4	152.3	8.9	-71.6	-164.8	-54.1	0	0	110.3
840	M	39.7	Very low	38.1	Very low	141 Å²	141	141.3 Å²	141.3	70%	0.695	71%	0.71	S	S	*	*				47	137.5	81.4	-61.1	-165.9	-59.8	0	0	115.4
841	E	37.4	Very low	37.9	Very low	148 Å²	148	143.6 Å²	143.6	69%	0.692	71%	0.711	S	S	*	*			cis	-162.6	148.2	26.8	-144.6	179.5	172.4	0	0	117.2
842	Q	36.5	Very low	38	Very low	157 Å²	157	146.3 Å²	146.3	73%	0.734	72%	0.72	S	S	*	*			trans	56.7	135.2	148.1	-84.1	179.6	63.5	0	0	126.8
843	P	43.9	Very low	38.4	Very low	113 Å²	113	146 Å²	146	73%	0.734	73%	0.726	S	S	*	*			trans	-116.2	-147.1	158.1	44.9	-33.3	0	0	0	111
844	P	48	Very low	38.1	Very low	112 Å²	112	143.9 Å²	143.9	73%	0.727	72%	0.723	S	S	*	*			cis	-127.9	-163.9	-33.5	40.1	-22.6	0	0	0	112.9
845	V	35	Very low	37.9	Very low	144 Å²	144	146.6 Å²	146.6	87%	0.873	74%	0.735	S	S	*	*			trans	161.3	140	138.2	153.6	0	0	0	0	116.2
846	G	38.1	Very low	37.8	Very low	64 Å²	64	149 Å²	149	66%	0.66	75%	0.747	S	S	*	*			trans	107.4	109	153.4	0	0	0	0	0	116.6
847	K	39.3	Very low	38	Very low	180 Å²	180	146.7 Å²	146.7	78%	0.783	74%	0.736	S	S	*	*			cis	82.5	107.4	48.3	-66.3	-175.3	179.7	178.3	0	116.4
848	F	35.1	Very low	37.5	Very low	187 Å²	187	151.2 Å²	151.2	82%	0.82	75%	0.748	S	S	*	*				170.3	173.4	107.8	-94.7	-67.8	0	0	0	113.6
849	Y	31.3	Very low	37.1	Very low	213 Å²	213	147.4 Å²	147.4	84%	0.835	74%	0.744	S	S	*	*			trans	-114.7	149.5	-157.3	-68.5	-108	0	0	0	115.9
850	K	38.2	Very low	36.8	Very low	172 Å²	172	146.5 Å²	146.5	75%	0.748	75%	0.746	S	S	*	*			trans	176.7	147.5	141	-101.2	164.4	165.4	-71.5	0	108.3
851	E	37.6	Very low	36.4	Very low	154 Å²	154	145.6 Å²	145.6	72%	0.72	75%	0.748	S	S	*	*			cis	-142.4	-177.2	-3.2	-153.3	124.3	-129.2	0	0	108.2
852	I	36.8	Very low	36.1	Very low	161 Å²	161	144.1 Å²	144.1	83%	0.826	75%	0.751	S	S	*	*			trans	-119.6	-177.5	-161.3	-4.5	179.2	0	0	0	113.4
853	P	40.5	Very low	36.1	Very low	109 Å²	109	141.7 Å²	141.7	71%	0.708	75%	0.752	S	S	*	*				-127.4	-140.5	-128.7	43	-21.3	0	0	0	114.2
854	V	32.1	Very low	35.7	Very low	104 Å²	104	144.2 Å²	144.2	63%	0.63	75%	0.754	S	S	*	*			trans	100.8	112.4	161.4	-179.6	0	0	0	0	117.7
855	E	35.2	Very low	35.3	Very low	170 Å²	170	145 Å²	145	79%	0.794	76%	0.759	S	S	*	*			trans	54.8	164	145.4	-66.3	155.7	-162.8	0	0	119.1
856	E	37.2	Very low	35.2	Very low	166 Å²	166	141.7 Å²	141.7	78%	0.776	74%	0.742	S	S	*	*			cis	-151	-173.8	-2.1	-137.8	174.8	-176.2	0	0	110.4
857	E	37.3	Very low	35.3	Very low	146 Å²	146	144.6 Å²	144.6	68%	0.682	75%	0.75	S	S	*	*			trans	46.5	117.3	160.6	-70.3	-140.3	105.1	0	0	122.6
858	K	30.5	Very low	35.1	Very low	170 Å²	170	139.6 Å²	139.6	74%	0.739	74%	0.742	S	S	*	*				50.2	139	106.9	-124.8	176.2	-169.6	169.7	0	121.1
859	L	33	Very low	35.2	Very low	147 Å²	147	138.1 Å²	138.1	77%	0.77	74%	0.735	S	S	*	*			trans	93.1	113.4	157.7	-59.4	163.6	0	0	0	119.5
860	V	30.7	Very low	35.3	Very low	119 Å²	119	136.5 Å²	136.5	72%	0.721	73%	0.732	S	S	*	*				62.4	107.9	128.1	-175.9	0	0	0	0	119.4
861	T	30.2	Very low	35.2	Very low	121 Å²	121	132.4 Å²	132.4	74%	0.742	73%	0.725	S	S	*	*			trans	5.2	143.7	141.2	59.2	0	0	0	0	119.2
862	P	32.7	Very low	34.9	Very low	117 Å²	117	130 Å²	130	76%	0.76	72%	0.716	S	S	*	*				-153.8	-159.6	51.7	44.1	-22.7	0	0	0	117
863	S	35.9	Very low	34.6	Very low	106 Å²	106	126.4 Å²	126.4	74%	0.741	70%	0.699	S	S	*	*			trans	66.4	100.1	160.7	55.2	0	0	0	0	120.2
864	E	35.7	Very low	34.1	Very low	167 Å²	167	124.6 Å²	124.6	78%	0.78	69%	0.693	S	S	*	*				8.4	149	116	-98.3	-167.1	129.4	0	0	120
865	P	38.9	Very low	34	Very low	128 Å²	128	126 Å²	126	83%	0.831	70%	0.702	S	S	*	*				-125.9	149.2	53.3	39.7	-29.4	0	0	0	118.3
866	S	34.1	Very low	34.2	Very low	74 Å²	74	123.4 Å²	123.4	52%	0.517	70%	0.7	S	S	.	*			trans	-75.4	-176.4	157.5	-145.2	0	0	0	0	110.3
867	P	39.5	Very low	34	Very low	126 Å²	126	119.5 Å²	119.5	82%	0.818	70%	0.696	S	S	*	*			cis	-103.5	175	36.5	39	-36.9	0	0	0	113.9
868	A	34.3	Very low	34	Very low	75 Å²	75	118 Å²	118	62%	0.62	70%	0.702	S	S	*	*			cis	178.1	150.5	-26.6	0	0	0	0	0	105.9
869	K	36.8	Very low	34.2	Very low	156 Å²	156	114.4 Å²	114.4	68%	0.678	70%	0.703	S	S	*	*			cis	-133.2	141.4	-19.6	-92.8	154.6	-177.3	177.4	0	105.4
870	K	34.7	Very low	34.5	Very low	178 Å²	178	116 Å²	116	77%	0.774	71%	0.707	S	S	*	*				59.8	104.8	74.3	-90	-162.8	173.4	-166.9	0	115.3	P266	P266-K870 WeakPolarHBondContact CD-O 3.41Å
871	S	35.5	Very low	34.9	Very low	86 Å²	86	117 Å²	117	60%	0.601	71%	0.708	S	S	*	*	S	Bend	trans	-64.6	155.4	149.6	56.2	0	0	0	0	112.6
872	I	31.7	Very low	35.2	Very low	104 Å²	104	119.3 Å²	119.3	53%	0.533	71%	0.71	S	S	.	*			trans	72.1	110.7	151.9	-60.2	159.2	0	0	0	117.2	E264 K265	E264-I872 WeakPolarHBondContact O-CA 3.06Å; E264-I872 WeakPolarHBondContact O-CG1 3.5Å; E264-I872 PolarHBondContact O-N 2.88Å; K265-I872 PolarHBondContact O-N 3.18Å
873	D	29.7	Very low	35.3	Very low	86 Å²	86	119.6 Å²	119.6	46%	0.46	71%	0.71	S	S	.	*			trans	71.5	117.8	146.7	-86.7	-58.4	0	0	0	123.9	A263	A263-D873 PolarHBondContact N-OD2 2.77Å
874	A	31.2	Very low	35.5	Very low	71 Å²	71	119.4 Å²	119.4	59%	0.587	71%	0.706	S	S	*	*				82.7	159.2	121.3	0	0	0	0	0	122.3
875	T	28.9	Very low	35.2	Very low	133 Å²	133	117.6 Å²	117.6	82%	0.816	71%	0.707	S	S	*	*			trans	75	153.5	165.9	72	0	0	0	0	118.1
876	P	39.7	Very low	34.8	Very low	116 Å²	116	115.6 Å²	115.6	75%	0.753	70%	0.701	S	S	*	*			cis	-139.7	168.4	-42.6	37.3	-22.7	0	0	0	114
877	A	33.9	Very low	34.8	Very low	84 Å²	84	120.6 Å²	120.6	69%	0.694	72%	0.716	S	S	*	*				149.4	147	111	0	0	0	0	0	115
878	S	35.5	Very low	34.5	Very low	115 Å²	115	121.8 Å²	121.8	80%	0.804	72%	0.715	S	S	*	*			trans	83.6	119.4	160.9	-37.8	0	0	0	0	117.7
879	A	36.4	Very low	34.4	Very low	93 Å²	93	123.3 Å²	123.3	77%	0.769	72%	0.716	S	S	*	*			trans	66.6	138.1	161.8	0	0	0	0	0	117.9
880	E	38.4	Very low	34.2	Very low	182 Å²	182	123.8 Å²	123.8	85%	0.85	72%	0.721	S	S	*	*			cis	-157.1	-158.6	-18.6	-133.8	166.7	-158.5	0	0	110.9
881	L	40.1	Very low	34.1	Very low	139 Å²	139	120.7 Å²	120.7	73%	0.728	71%	0.712	S	S	*	*			trans	-54.8	164.5	172.4	-81.5	59.8	0	0	0	112.4
882	E	35.6	Very low	34.1	Very low	169 Å²	169	124.7 Å²	124.7	79%	0.79	72%	0.719	S	S	*	*			cis	-154	-157.4	16.7	-140.8	160.4	-161.1	0	0	114.1
883	T	34.8	Very low	34.1	Very low	123 Å²	123	127.5 Å²	127.5	76%	0.755	73%	0.732	S	S	*	*			trans	-107.7	-177.2	-169.3	59.9	0	0	0	0	112.2
884	P	39.9	Very low	34.4	Very low	103 Å²	103	131.5 Å²	131.5	67%	0.669	75%	0.748	S	S	*	*				-136.5	-164.1	-50.4	38.7	-20.3	0	0	0	112.3
885	T	28.8	Very low	34.5	Very low	129 Å²	129	135.3 Å²	135.3	79%	0.791	76%	0.758	S	S	*	*			trans	46.7	109.6	146.1	-52.6	0	0	0	0	120.9
886	A	31	Very low	34.4	Very low	85 Å²	85	132.3 Å²	132.3	70%	0.702	75%	0.747	S	S	*	*			trans	71.8	159.2	154.3	0	0	0	0	0	118.7
887	Q	34.1	Very low	34.2	Very low	179 Å²	179	135.7 Å²	135.7	84%	0.836	75%	0.753	S	S	*	*			trans	70.8	137.1	-174.7	-51.2	-171.4	21.1	0	0	111.2
888	L	34.1	Very low	34.2	Very low	152 Å²	152	139.1 Å²	139.1	80%	0.796	75%	0.754	S	S	*	*				61.2	116.2	51.6	-163.6	165	0	0	0	109
889	V	30.8	Very low	34.1	Very low	106 Å²	106	139 Å²	139	64%	0.642	74%	0.744	S	S	*	*			cis	-166.3	163.5	-7	83.3	0	0	0	0	106
890	E	33.7	Very low	33.7	Very low	167 Å²	167	144.8 Å²	144.8	78%	0.78	75%	0.746	S	S	*	*			trans	63.5	172.5	166.5	-78.6	-179.8	-127.6	0	0	117.3
891	N	33.1	Very low	33.8	Very low	113 Å²	113	142 Å²	142	60%	0.604	74%	0.736	S	S	*	*			cis	-168.7	148.5	-44	-151.3	-15.5	0	0	0	109.5
892	K	35.1	Very low	33.8	Very low	169 Å²	169	142.6 Å²	142.6	74%	0.735	74%	0.735	S	S	*	*			trans	62.5	-177.8	167	-38.6	172.7	-175.8	173.7	0	114.3
893	M	31	Very low	33.7	Very low	163 Å²	163	141.7 Å²	141.7	80%	0.803	74%	0.736	S	S	*	*			cis	-163.6	143.5	-7.4	-141.8	156.9	60.4	0	0	109.9
894	E	36.6	Very low	33.7	Very low	170 Å²	170	139.9 Å²	139.9	79%	0.794	73%	0.733	S	S	*	*			trans	173.9	151.5	148.9	-104.6	174.7	179.6	0	0	109.2	A896	E894-A896 HydrophobicContact CG-CB 4.4Å
895	N	32	Very low	33.6	Very low	152 Å²	152	142.6 Å²	142.6	81%	0.813	74%	0.737	S	S	*	*			cis	-98.9	141.5	-2	-73.8	-96.4	0	0	0	109.4
896	A	28.4	Very low	33.6	Very low	70 Å²	70	140.8 Å²	140.8	58%	0.579	72%	0.722	S	S	*	*			cis	101.3	145.3	35.2	0	0	0	0	0	112.1	E894	E894-A896 HydrophobicContact CG-CB 4.4Å
897	E	34	Very low	33.9	Very low	186 Å²	186	142.6 Å²	142.6	87%	0.869	73%	0.726	S	S	*	*			trans	63.8	133.7	-155.6	-62.2	-175.8	172.2	0	0	113.5
898	E	35.1	Very low	33.9	Very low	157 Å²	157	141.3 Å²	141.3	73%	0.734	72%	0.718	S	S	*	*			cis	-151	-174.4	-18.6	-132.9	-164	150.3	0	0	110.7
899	L	33.5	Very low	33.6	Very low	112 Å²	112	138.9 Å²	138.9	59%	0.586	71%	0.709	S	S	*	*			trans	11	124.5	155.3	-62	165.6	0	0	0	118.5
900	R	28.1	Very low	33.5	Very low	214 Å²	214	141.6 Å²	141.6	81%	0.808	72%	0.715	S	S	*	*				67.1	143.9	64.3	-167.5	-164.3	-162.5	142.2	7.2	112.6
901	L	40.2	Very low	33.3	Very low	124 Å²	124	139.5 Å²	139.5	65%	0.649	71%	0.713	S	S	*	*			trans	89.6	126.8	-175.9	-54.4	159.1	0	0	0	110.5
902	E	39.9	Very low	33.4	Very low	151 Å²	151	135.1 Å²	135.1	71%	0.706	69%	0.691	S	S	*	*				65.9	99	101.9	-61.4	173.1	-179.1	0	0	109.3
903	D	33.3	Very low	33.2	Very low	151 Å²	151	128.7 Å²	128.7	81%	0.807	67%	0.665	S	S	*	*				90.7	145.2	83	-83.5	-34.7	0	0	0	109.6
904	A	35.8	Very low	33.9	Very low	84 Å²	84	123.6 Å²	123.6	69%	0.694	64%	0.638	S	S	*	*			trans	62	149.4	-175.5	0	0	0	0	0	115.3
905	E	37.1	Very low	33.5	Very low	161 Å²	161	121.6 Å²	121.6	75%	0.752	63%	0.629	S	S	*	*			cis	-145.6	144.8	-19	-110	160.8	159.2	0	0	104.2
906	I	29.7	Very low	34.1	Very low	90 Å²	90	121.2 Å²	121.2	46%	0.462	63%	0.626	S	S	.	*				46.9	112.7	86.8	-60.9	170.1	0	0	0	109.6	K908	I906-K908 HydrophobicContact CB-CG 4.44Å; I906-K908 HydrophobicContact CD1-CD 3.83Å; I906-K908 VanDerWaalsContact CD1-CE 3.47Å; I906-K908 HydrophobicContact CD1-CG 4.41Å; I906-K908 HydrophobicContact CG1-CD 4.05Å; I906-K908 HydrophobicContact CG1-CG 4.07Å; I906-K908 HydrophobicContact CG2-CB 3.58Å; I906-K908 HydrophobicContact CG2-CD 3.91Å; I906-K908 HydrophobicContact CG2-CG 3.74Å
907	P	35.9	Very low	34	Very low	123 Å²	123	126.4 Å²	126.4	80%	0.799	64%	0.635	S	S	*	*				-96.6	147.7	69	29	-36.2	0	0	0	114
908	K	34.5	Very low	34.1	Very low	152 Å²	152	122 Å²	122	66%	0.661	62%	0.623	S	S	*	*			cis	26.7	149.4	8.9	-37.6	176.3	-175.8	169.8	0	119.4	I906	I906-K908 HydrophobicContact CB-CG 4.44Å; I906-K908 HydrophobicContact CD1-CD 3.83Å; I906-K908 VanDerWaalsContact CD1-CE 3.47Å; I906-K908 HydrophobicContact CD1-CG 4.41Å; I906-K908 HydrophobicContact CG1-CD 4.05Å; I906-K908 HydrophobicContact CG1-CG 4.07Å; I906-K908 HydrophobicContact CG2-CB 3.58Å; I906-K908 HydrophobicContact CG2-CD 3.91Å; I906-K908 HydrophobicContact CG2-CG 3.74Å
909	T	27.5	Very low	33.7	Very low	101 Å²	101	118 Å²	118	62%	0.62	61%	0.613	S	S	*	*	S	Bend	trans	62.4	127.7	164.8	36	0	0	0	0	115
910	E	28.6	Very low	34.1	Very low	163 Å²	163	119.2 Å²	119.2	76%	0.762	62%	0.615	S	S	*	*			trans	61.2	101.1	146.6	-64.4	148.9	-128.4	0	0	117.1
911	V	30.6	Very low	34.3	Very low	123 Å²	123	114 Å²	114	75%	0.745	60%	0.6	S	S	*	*				170.4	114.5	123.2	154.3	0	0	0	0	106.3
912	T	34.7	Very low	33.9	Very low	22 Å²	22	111 Å²	111	14%	0.135	59%	0.59	C	S	.	*	S	Bend	cis	-168.2	128.3	0.4	19.4	0	0	0	0	111.6	E298 E299	E298-T912 CarbonylContact C-O 3.44Å; E298-T912 VanDerWaalsContact CA-O 3.26Å; E298-T912 WeakPolarHBondContact CA-O 3.36Å; E298-T912 HydrophobicContact CG-CG2 3.93Å; E299-T912 WeakPolarHBondContact CB-O 3.26Å; E299-T912 WeakPolarHBondContact CG-O 3.38Å; E299-T912 PolarHBondContact N-O 3.14Å; E299-T912 VanDerWaalsContact OE1-C 3.28Å; E299-T912 PolarHBondContact OE1-N 3.25Å
913	D	31.8	Very low	33.7	Very low	34 Å²	34	108.9 Å²	108.9	18%	0.182	58%	0.576	C	S	.	*	S	Bend		-102.2	165.9	123.1	-167.2	-137.1	0	0	0	110.1	E298 E299 A300 Q915	E298-D913 WeakPolarHBondContact CB-OD2 3.33Å; E299-D913 HydrophobicContact CB-CB 3.98Å; E299-D913 PolarHBondContact N-OD2 3.26Å; A300-D913 HydrophobicContact CB-CB 3.95Å; A300-D913 VanDerWaalsContact CB-CG 3.48Å; A300-D913 WeakPolarHBondContact CB-OD1 3.35Å; D913-Q915 VanDerWaalsContact C-N 3.29Å; D913-Q915 WeakPolarHBondContact O-CG 3.47Å; D913-Q915 PolarHBondContact O-N 2.79Å
914	K	44.8	Very low	34	Very low	56 Å²	56	107.3 Å²	107.3	24%	0.243	56%	0.562	C	S	.	*			trans	-35.2	94.8	143.5	-59.4	159.4	-131.6	85.5	0	107.1	E298 A353 A354	E298-K914 VanDerWaalsContact C-NZ 3.35Å; E298-K914 HydrophobicContact CB-CD 4.3Å; E298-K914 VanDerWaalsContact CB-CE 3.43Å; E298-K914 HydrophobicContact CB-CG 3.93Å; E298-K914 HydrophobicContact CG-CG 4.08Å; E298-K914 PolarHBondContact O-NZ 3.34Å; E298-K914 WeakPolarHBondContact OE2-CE 3.27Å; E298-K914 WeakPolarHBondContact OE2-CG 3.4Å; A353-K914 WeakPolarHBondContact O-CD 3.43Å; A353-K914 VanDerWaalsContact O-CE 3.22Å; A353-K914 WeakPolarHBondContact O-CE 3.18Å; A354-K914 HydrophobicContact CB-CD 4.13Å; A354-K914 VanDerWaalsContact CB-NZ 3.28Å
915	Q	28.6	Very low	34.2	Very low	127 Å²	127	107.1 Å²	107.1	59%	0.593	55%	0.547	S	S	*	.				38.3	145.5	63	-58.7	-163.9	25.1	0	0	112.2	D913	D913-Q915 VanDerWaalsContact C-N 3.29Å; D913-Q915 WeakPolarHBondContact O-CG 3.47Å; D913-Q915 PolarHBondContact O-N 2.79Å
916	L	43.2	Very low	34.1	Very low	144 Å²	144	106.8 Å²	106.8	75%	0.754	55%	0.545	S	S	*	.			trans	72	94.5	-174.2	-43.9	155.3	0	0	0	107.7
917	K	27.4	Very low	34.6	Very low	179 Å²	179	107.8 Å²	107.8	78%	0.778	55%	0.548	S	S	*	.				48.6	132.2	66.4	-49.1	-178.1	177.9	-174.4	0	110.4
918	P	35.6	Very low	34.6	Very low	93 Å²	93	108.1 Å²	108.1	60%	0.604	54%	0.538	S	S	*	.			cis	-126.8	159.3	34	47.6	-34.9	0	0	0	110.9	E920	P918-E920 HydrophobicContact CB-CB 4.34Å; P918-E920 HydrophobicContact CB-CG 3.96Å; P918-E920 HydrophobicContact CG-CB 4.23Å; P918-E920 HydrophobicContact CG-CG 3.95Å
919	S	26.6	Very low	34.8	Very low	75 Å²	75	103.2 Å²	103.2	52%	0.524	53%	0.531	S	S	.	.			cis	43.8	38.2	25.3	88	0	0	0	0	113	E921	S919-E921 VanDerWaalsContact O-CG 3.24Å; S919-E921 WeakPolarHBondContact O-CG 3.45Å
920	E	42.2	Very low	35.3	Very low	136 Å²	136	108.1 Å²	108.1	64%	0.636	54%	0.538	S	S	*	.			trans	-95.2	87.9	142.1	-82.9	-175.4	169.1	0	0	101.9	P918	P918-E920 HydrophobicContact CB-CB 4.34Å; P918-E920 HydrophobicContact CB-CG 3.96Å; P918-E920 HydrophobicContact CG-CB 4.23Å; P918-E920 HydrophobicContact CG-CG 3.95Å
921	E	32.4	Very low	35.6	Very low	104 Å²	104	106.8 Å²	106.8	49%	0.486	54%	0.536	S	S	.	.				59.8	115.1	76.6	-66	172.5	-164.8	0	0	108.5	S919 Y923	S919-E921 VanDerWaalsContact O-CG 3.24Å; S919-E921 WeakPolarHBondContact O-CG 3.45Å; E921-Y923 HydrophobicContact CB-CE1 4.2Å; E921-Y923 HydrophobicContact CG-CE1 4.27Å; E921-Y923 WeakPolarHBondContact OE2-CE1 3.34Å; E921-Y923 PolarHBondContact OE2-OH 3.47Å
922	S	31.4	Very low	35.8	Very low	63 Å²	63	106.9 Å²	106.9	44%	0.441	54%	0.537	S	S	.	.				58.6	159.2	61.7	97.4	0	0	0	0	111.5	H342	H342-S922 PolarHBondContact CE1-O 3.41Å; H342-S922 PolarHBondContact ND1-O 3.44Å
923	Y	35.4	Very low	35.7	Very low	105 Å²	105	114.4 Å²	114.4	41%	0.412	57%	0.57	S	S	.	*			cis	-89.5	-96.2	29.8	-45.1	-68.8	0	0	0	113	L341 H342 E921	L341-Y923 HydrophobicContact CB-CD2 4.22Å; L341-Y923 HydrophobicContact CD2-CD2 3.44Å; L341-Y923 VanDerWaalsContact CD2-CD2 3.44Å; L341-Y923 HydrophobicContact CD2-CE2 3.6Å; L341-Y923 HydrophobicContact CD2-CG 4.1Å; L341-Y923 HydrophobicContact CG-CD2 3.61Å; L341-Y923 HydrophobicContact CG-CE2 3.75Å; H342-Y923 HydrophobicContact CB-CD2 3.79Å; H342-Y923 HydrophobicContact CB-CE2 4.12Å; E921-Y923 HydrophobicContact CB-CE1 4.2Å; E921-Y923 HydrophobicContact CG-CE1 4.27Å; E921-Y923 WeakPolarHBondContact OE2-CE1 3.34Å; E921-Y923 PolarHBondContact OE2-OH 3.47Å
924	K	39.7	Very low	35.6	Very low	119 Å²	119	116.7 Å²	116.7	52%	0.517	59%	0.594	S	S	.	*			cis	-77.7	146.1	-16.5	-57	-106.1	70.5	-174.2	0	108.7	S340 L341 H342	S340-K924 PolarHBondContact OG-NZ 3.21Å; L341-K924 WeakPolarHBondContact O-CE 3.33Å; L341-K924 PolarHBondContact O-NZ 3.34Å; H342-K924 PolarHBondContact O-NZ 3.08Å
925	E	40.3	Very low	35	Very low	80 Å²	80	120.6 Å²	120.6	37%	0.374	62%	0.623	S	S	.	*			trans	-75.9	153.3	163.3	-61.4	153	144.8	0	0	109.1	S339 S340 L341	S339-E925 WeakPolarHBondContact CB-O 3.04Å; S340-E925 PolarHBondContact N-OE2 2.83Å; S340-E925 VanDerWaalsContact N-OE2 3.17Å; L341-E925 WeakPolarHBondContact CB-OE2 3.43Å; L341-E925 WeakPolarHBondContact CD2-OE1 2.41Å; L341-E925 WeakPolarHBondContact CD2-OE2 3.27Å
926	E	35	Very low	35	Very low	153 Å²	153	119.5 Å²	119.5	72%	0.715	64%	0.636	S	S	*	*			cis	91	149.6	19.7	-160.5	173.4	-118	0	0	115.4	E338 S339	E338-E926 WeakPolarHBondContact CA-O 3.36Å; S339-E926 WeakPolarHBondContact CA-O 3.49Å; S339-E926 PolarHBondContact N-O 3.08Å
927	E	39.9	Very low	34.6	Very low	111 Å²	111	122.4 Å²	122.4	52%	0.519	64%	0.642	S	S	.	*			trans	94.5	82.8	172.9	-65.5	-150.2	137.2	0	0	121.3	E337 E338	E337-E927 CarbonylContact C-O 3.08Å; E337-E927 VanDerWaalsContact CA-O 3.29Å; E337-E927 WeakPolarHBondContact CA-O 3.11Å; E338-E927 WeakPolarHBondContact CA-O 3.41Å; E338-E927 WeakPolarHBondContact CB-O 3.29Å; E338-E927 PolarHBondContact N-O 2.95Å
928	E	36.5	Very low	34.8	Very low	130 Å²	130	117.3 Å²	117.3	61%	0.607	63%	0.626	S	S	*	*			trans	65.7	138.4	133.8	-53.3	-162.3	131.7	0	0	120.2	E337	E337-E928 WeakPolarHBondContact CB-O 3.29Å; E337-E928 VanDerWaalsContact CD-O 3.32Å; E337-E928 HydrophobicContact CG-CB 4.19Å; E337-E928 WeakPolarHBondContact CG-O 3.34Å
929	G	39.2	Very low	34.8	Very low	49 Å²	49	116.8 Å²	116.8	51%	0.505	62%	0.623	S	S	.	*			trans	158.5	81.2	170.3	0	0	0	0	0	117.9
930	R	38.3	Very low	35.1	Very low	205 Å²	205	120.6 Å²	120.6	77%	0.774	64%	0.636	S	S	*	*			trans	64.6	122.5	160.5	-72	-168.2	-174.3	76.4	7.4	122
931	D	33.9	Very low	34.8	Very low	134 Å²	134	118.3 Å²	118.3	72%	0.717	63%	0.631	S	S	*	*				72.1	117.6	122.3	-61.5	-29.3	0	0	0	123.2
932	V	35.1	Very low	35	Very low	125 Å²	125	117.1 Å²	117.1	76%	0.758	63%	0.632	S	S	*	*			trans	86.1	101.2	140.4	179.6	0	0	0	0	119.8
933	E	31.6	Very low	35.2	Very low	180 Å²	180	122.2 Å²	122.2	84%	0.841	65%	0.647	S	S	*	*			trans	33.5	143.1	131.5	-53.9	-169.8	129.8	0	0	123.4
934	A	31.5	Very low	35.5	Very low	83 Å²	83	126.7 Å²	126.7	69%	0.686	67%	0.668	S	S	*	*			trans	77.7	85.1	143.3	0	0	0	0	0	120
935	T	30.3	Very low	35.6	Very low	137 Å²	137	128.3 Å²	128.3	84%	0.84	69%	0.688	S	S	*	*				45.7	129.7	123.3	58	0	0	0	0	121.3
936	A	30.5	Very low	35.8	Very low	104 Å²	104	127.3 Å²	127.3	86%	0.86	69%	0.689	S	S	*	*			trans	82.2	111.8	161.7	0	0	0	0	0	117.5
937	F	33.8	Very low	35.6	Very low	205 Å²	205	125.8 Å²	125.8	90%	0.899	69%	0.69	S	S	*	*			trans	-67.5	140.7	169.9	-107.3	-95.7	0	0	0	112.6
938	V	31.7	Very low	35.4	Very low	73 Å²	73	129.3 Å²	129.3	44%	0.442	71%	0.706	S	S	.	*			trans	157.8	132.7	138.5	153.8	0	0	0	0	110
939	P	35.9	Very low	35.1	Very low	81 Å²	81	127 Å²	127	53%	0.526	71%	0.709	S	S	.	*			cis	-135.5	-177.2	-20.3	38.2	-20	0	0	0	114.8	T941	P939-T941 PolarHBondContact O-N 3.12Å
940	I	32.5	Very low	35	Very low	155 Å²	155	129.8 Å²	129.8	80%	0.795	72%	0.719	S	S	*	*	S	Bend	trans	2	106.9	149.1	-54.9	172.9	0	0	0	116.5
941	T	35.4	Very low	34.7	Very low	89 Å²	89	123.9 Å²	123.9	55%	0.546	71%	0.705	S	S	.	*			trans	23.5	91.8	156.6	68.2	0	0	0	0	117.7	P939 K943	P939-T941 PolarHBondContact O-N 3.12Å; T941-K943 PolarHBondContact O-N 3.43Å
942	P	37.2	Very low	34.9	Very low	78 Å²	78	123.7 Å²	123.7	51%	0.506	70%	0.698	S	S	.	*			trans	-63.9	102.2	144.8	31.6	-34.1	0	0	0	107.4	K944 P946	P942-K944 PolarHBondContact O-N 2.89Å; P942-P946 VanDerWaalsContact C-CD 3.45Å; P942-P946 VanDerWaalsContact C-CG 3.47Å; P942-P946 HydrophobicContact CB-CB 3.91Å; P942-P946 HydrophobicContact CB-CG 3.68Å; P942-P946 WeakPolarHBondContact O-CD 3.3Å
943	K	36.3	Very low	34.8	Very low	170 Å²	170	120.8 Å²	120.8	74%	0.739	68%	0.681	S	S	*	*			trans	-74.2	121.6	-170.3	-68.8	174.8	-179.5	175.6	0	112.2	T941 P946	T941-K943 PolarHBondContact O-N 3.43Å; K943-P946 WeakPolarHBondContact O-CG 3.48Å
944	K	41.6	Very low	35	Very low	200 Å²	200	118 Å²	118	87%	0.87	66%	0.663	S	S	*	*	S	Bend	trans	57.6	92.5	173.7	-62.3	-170.3	176.3	-172.3	0	113.8	P942	P942-K944 PolarHBondContact O-N 2.89Å
945	T	41.1	Very low	35.2	Very low	152 Å²	152	120.8 Å²	120.8	93%	0.933	66%	0.661	S	S	*	*	S	Bend	trans	51.9	56	179.7	66.5	0	0	0	0	117.8
946	P	44.2	Very low	35.6	Very low	60 Å²	60	119 Å²	119	39%	0.39	65%	0.65	S	S	.	*			trans	-127.3	169.2	165	13.8	13.5	0	0	0	113.6	P942 K943	P942-P946 VanDerWaalsContact C-CD 3.45Å; P942-P946 VanDerWaalsContact C-CG 3.47Å; P942-P946 HydrophobicContact CB-CB 3.91Å; P942-P946 HydrophobicContact CB-CG 3.68Å; P942-P946 WeakPolarHBondContact O-CD 3.3Å; K943-P946 WeakPolarHBondContact O-CG 3.48Å
947	T	31.4	Very low	35.9	Very low	120 Å²	120	123.3 Å²	123.3	74%	0.736	65%	0.653	S	S	*	*			trans	-138.3	154.7	-164.6	-49.1	0	0	0	0	110.7
948	E	34.6	Very low	35.7	Very low	185 Å²	185	118.2 Å²	118.2	86%	0.864	65%	0.648	S	S	*	*			trans	74	148.6	165	-84.4	158.9	-172.4	0	0	121.8
949	A	30.8	Very low	36	Very low	81 Å²	81	119.8 Å²	119.8	67%	0.669	66%	0.662	S	S	*	*			trans	95.5	147.5	153.3	0	0	0	0	0	121.3
950	P	38.2	Very low	36	Very low	108 Å²	108	121.7 Å²	121.7	70%	0.701	67%	0.672	S	S	*	*			trans	-140.9	176.1	-135.7	42.4	-22.5	0	0	0	119.8
951	V	32.2	Very low	36.1	Very low	82 Å²	82	122.3 Å²	122.3	50%	0.497	67%	0.672	S	S	.	*			trans	40.7	117	160.9	179.5	0	0	0	0	121.5
952	K	36.5	Very low	35.9	Very low	129 Å²	129	128.5 Å²	128.5	56%	0.561	69%	0.687	S	S	*	*			trans	173.8	169.8	146.7	-90.2	140.1	-156.2	-74.5	0	111.6	V626 S627	V626-K952 PolarHBondContact O-NZ 3.1Å; S627-K952 PolarHBondContact O-NZ 3.31Å
953	T	32.8	Very low	35.5	Very low	64 Å²	64	135.2 Å²	135.2	39%	0.393	70%	0.702	S	S	.	*				-173.3	177.8	-74.4	32.7	0	0	0	0	112.7	E628 R629	E628-T953 WeakPolarHBondContact O-CB 3.2Å; E628-T953 PolarHBondContact O-OG1 3.11Å; R629-T953 VanDerWaalsContact O-CB 3.23Å; R629-T953 WeakPolarHBondContact O-CB 3.38Å
954	R	36	Very low	35.4	Very low	122 Å²	122	133.9 Å²	133.9	46%	0.46	70%	0.699	S	S	.	*			trans	90.4	147.9	173.5	-52.8	-122.6	55.6	49.1	-2.4	116.6	R629 D630	R629-R954 WeakPolarHBondContact O-CA 3.24Å; R629-R954 PolarHBondContact O-N 3.19Å; R629-R954 PolarHBondContact O-NH1 3.02Å; D630-R954 VanDerWaalsContact CG-NH1 3.34Å; D630-R954 IonicContact OD1-NH1 2.6Å; D630-R954 IonicContact OD2-CZ 3.71Å; D630-R954 IonicContact OD2-NH1 3.52Å; D630-R954 PolarHBondContact OD2-NH1 2.82Å; D630-R954 IonicContact OD2-NH2 3.39Å; D630-R954 PolarHBondContact OD2-NH2 3.25Å
955	E	36.9	Very low	34.9	Very low	141 Å²	141	133.3 Å²	133.3	66%	0.659	69%	0.692	S	S	*	*			cis	-172.1	165	-4.4	167.4	155.9	-131.4	0	0	112.5
956	V	38.9	Very low	34.3	Very low	99 Å²	99	136.8 Å²	136.8	60%	0.6	69%	0.69	S	S	*	*			trans	-103.9	131.2	-169.6	176.1	0	0	0	0	115.4	V631	V631-V956 HydrophobicContact CG1-CG2 4.04Å
957	Q	36.4	Very low	34.1	Very low	196 Å²	196	139 Å²	139	92%	0.916	70%	0.704	S	S	*	*			trans	-141.2	174.1	158.6	-75.6	-157.7	-13.2	0	0	112.7
958	A	30	Very low	34.3	Very low	97 Å²	97	141 Å²	141	80%	0.802	71%	0.71	S	S	*	*			trans	-158.5	143.5	-146.5	0	0	0	0	0	116.3
959	S	37.4	Very low	34	Very low	106 Å²	106	142.7 Å²	142.7	74%	0.741	71%	0.71	S	S	*	*			trans	-170.6	106	172.9	54.3	0	0	0	0	111.2
960	T	35.3	Very low	34.1	Very low	121 Å²	121	148.3 Å²	148.3	74%	0.742	72%	0.722	S	S	*	*				84	118.5	77	55.7	0	0	0	0	116.9
961	E	35.5	Very low	33.5	Very low	169 Å²	169	147.9 Å²	147.9	79%	0.79	72%	0.722	S	S	*	*			trans	72.8	137.5	154.9	-63.3	170	-168.3	0	0	116.9
962	Y	29.7	Very low	33.5	Very low	218 Å²	218	155.8 Å²	155.8	86%	0.855	74%	0.743	S	S	*	*			cis	-127.1	178.9	47.3	-109.2	-112.4	0	0	0	116.7
963	R	29.4	Very low	33	Very low	220 Å²	220	155.2 Å²	155.2	83%	0.83	75%	0.75	S	S	*	*			trans	-127.1	177.7	-174.5	-82.2	-179.6	163.8	-173.6	-3.8	112.5
964	Q	34.9	Very low	32.8	Very low	142 Å²	142	155.9 Å²	155.9	66%	0.664	76%	0.755	S	S	*	*			trans	90.1	135.8	162.3	-45	166.8	4.3	0	0	113.9
965	Y	31.7	Very low	32.4	Very low	188 Å²	188	153.6 Å²	153.6	74%	0.737	76%	0.763	S	S	*	*			cis	-138.4	126.4	8.2	-77.6	-90.2	0	0	0	113.5
966	Y	28.2	Very low	32.2	Very low	224 Å²	224	150.2 Å²	150.2	88%	0.878	75%	0.752	S	S	*	*			trans	37.6	160.5	131.8	-78.9	-50.8	0	0	0	124.5
967	P	39.6	Very low	31.6	Very low	107 Å²	107	152.4 Å²	152.4	70%	0.695	76%	0.757	S	S	*	*			trans	-128.8	169.9	-130	42.5	-26.1	0	0	0	115.9
968	L	34.9	Very low	31.3	Very low	162 Å²	162	148.2 Å²	148.2	85%	0.848	75%	0.75	S	S	*	*			trans	-132.3	163.6	158.5	-77.5	176.3	0	0	0	111.6
969	Y	28.1	Very low	31.3	Very low	220 Å²	220	150.6 Å²	150.6	86%	0.863	75%	0.754	S	S	*	*			trans	-66.4	153.8	-166.1	-61.8	-98.7	0	0	0	114.8
970	E	32.9	Very low	30.9	Very low	200 Å²	200	148.6 Å²	148.6	94%	0.935	74%	0.74	S	S	*	*			trans	-139.8	154.8	138.8	-148.1	170.8	-119.9	0	0	110.3
971	S	25.3	Very low	30.5	Very low	99 Å²	99	147.6 Å²	147.6	69%	0.692	74%	0.738	S	S	*	*			trans	-120.7	122	-166.5	61	0	0	0	0	113
972	R	32.4	Very low	30.1	Very low	247 Å²	247	148 Å²	148	93%	0.932	74%	0.742	S	S	*	*			trans	-175.9	164.4	130.6	-96.3	152.6	-168.7	-139.4	2.1	110.7
973	T	26.9	Very low	30.1	Very low	117 Å²	117	142.5 Å²	142.5	72%	0.718	74%	0.742	S	S	*	*			trans	-118.3	-163.3	-159.8	55	0	0	0	0	111.3
974	P	29.2	Very low	30	Very low	78 Å²	78	137 Å²	137	51%	0.506	74%	0.737	S	S	.	*			cis	-87.2	-156.6	-44.9	-20.9	34.6	0	0	0	114.7	Y994	P974-Y994 HydrophobicContact CB-CD1 4.06Å; P974-Y994 HydrophobicContact CB-CE1 4.21Å; P974-Y994 HydrophobicContact CB-CG 4.44Å; P974-Y994 VanDerWaalsContact CD-CG 3.46Å; P974-Y994 HydrophobicContact CG-CD1 4.17Å; P974-Y994 HydrophobicContact CG-CG 4.45Å; P974-Y994 WeakPolarHBondContact O-CD2 3.32Å; P974-Y994 WeakPolarHBondContact O-CE2 3.38Å
975	A	26.7	Very low	29.6	Very low	75 Å²	75	134.7 Å²	134.7	62%	0.62	74%	0.736	S	S	*	*			trans	-150.9	31.1	-177.4	0	0	0	0	0	117.3	Y994	A975-Y994 VanDerWaalsContact CA-OH 3.3Å; A975-Y994 WeakPolarHBondContact CA-OH 3Å
976	T	32.1	Very low	29.4	Very low	70 Å²	70	136.4 Å²	136.4	43%	0.429	74%	0.743	S	S	.	*			trans	61.3	127.1	174	35.8	0	0	0	0	117.7	R992 Y994	T976-R992 PolarHBondContact OG1-NH1 2.86Å; T976-R992 PolarHBondContact OG1-NH2 2.95Å; T976-Y994 WeakPolarHBondContact CB-OH 3.32Å; T976-Y994 HydrophobicContact CG2-CE1 4.3Å; T976-Y994 VanDerWaalsContact CG2-OH 3.23Å; T976-Y994 WeakPolarHBondContact CG2-OH 3.19Å; T976-Y994 PolarHBondContact N-OH 2.85Å; T976-Y994 PolarHBondContact OG1-OH 3.21Å; T976-Y994 VanDerWaalsContact OG1-OH 3.14Å
977	M	27.4	Very low	29.7	Very low	144 Å²	144	130.6 Å²	130.6	71%	0.709	74%	0.735	S	S	*	*			trans	-72.9	144.3	146.6	-67.7	-173.2	73.3	0	0	109.4	S535	S535-M977 VanDerWaalsContact OG-CE 3.25Å; S535-M977 WeakPolarHBondContact OG-CE 3.41Å
978	S	30.4	Very low	29.3	Very low	108 Å²	108	130.3 Å²	130.3	76%	0.755	74%	0.735	S	S	*	*			trans	-70.3	145.5	178.6	-53.5	0	0	0	0	112
979	V	30.3	Very low	28.9	Very low	147 Å²	147	129.9 Å²	129.9	89%	0.891	73%	0.734	S	S	*	*			trans	-110	130.6	157.4	-166.1	0	0	0	0	106.6
980	S	27.7	Very low	29.1	Very low	64 Å²	64	130.7 Å²	130.7	45%	0.448	74%	0.737	S	S	.	*			trans	-76.5	145	-151.4	-43.9	0	0	0	0	115.8	E536	E536-S980 VanDerWaalsContact OE1-CB 3.3Å; E536-S980 WeakPolarHBondContact OE1-CB 3.44Å; E536-S980 PolarHBondContact OE1-OG 3.28Å
981	S	26.6	Very low	29.1	Very low	101 Å²	101	126.8 Å²	126.8	71%	0.706	73%	0.732	S	S	*	*			trans	61.9	100.9	145.3	-59.5	0	0	0	0	120.6
982	M	28.3	Very low	29.3	Very low	178 Å²	178	129.7 Å²	129.7	88%	0.877	73%	0.728	S	S	*	*			trans	72.8	112.2	136.5	-57.3	-179.1	69.3	0	0	120.4
983	A	29.8	Very low	29.4	Very low	102 Å²	102	123.7 Å²	123.7	84%	0.843	72%	0.721	S	S	*	*			trans	69.5	143	146.4	0	0	0	0	0	118.4
984	S	26.3	Very low	29.3	Very low	104 Å²	104	120 Å²	120	73%	0.727	69%	0.694	S	S	*	*			cis	-164.3	159.5	-11.2	177.8	0	0	0	0	109.1
985	S	26.7	Very low	29.4	Very low	93 Å²	93	123.7 Å²	123.7	65%	0.65	71%	0.71	S	S	*	*			trans	63.6	105.9	163	-45.8	0	0	0	0	115.1
986	Y	28.6	Very low	29.5	Very low	225 Å²	225	126.1 Å²	126.1	88%	0.882	71%	0.708	S	S	*	*				-171.6	150.2	73.9	-106.4	-85.2	0	0	0	112.7
987	S	33	Very low	29.4	Very low	102 Å²	102	133.5 Å²	133.5	71%	0.713	73%	0.729	S	S	*	*			trans	69.4	131.7	156.6	-162.4	0	0	0	0	120.5
988	S	31.4	Very low	29.6	Very low	100 Å²	100	133.3 Å²	133.3	70%	0.699	74%	0.736	S	S	*	*			trans	54.7	94.3	151.9	52	0	0	0	0	118
989	D	27.9	Very low	30	Very low	154 Å²	154	133.2 Å²	133.2	82%	0.824	74%	0.735	S	S	*	*			trans	-54	138.2	150.5	-46.6	-94.7	0	0	0	111.2
990	Y	30.4	Very low	29.9	Very low	237 Å²	237	131.6 Å²	131.6	93%	0.929	73%	0.725	S	S	*	*			trans	-150.8	148.1	132.8	-103.8	-70.5	0	0	0	109.2
991	S	34.3	Very low	30.1	Very low	117 Å²	117	137.8 Å²	137.8	82%	0.818	75%	0.745	S	S	*	*			trans	-71.5	149.2	-166.3	-63.7	0	0	0	0	114.5
992	R	29.8	Very low	30.4	Very low	160 Å²	160	140.4 Å²	140.4	60%	0.604	75%	0.751	S	S	*	*			trans	-34.3	145.1	161	-75.9	175.5	179.3	-144.9	-9.5	112.6	T976 Y994	T976-R992 PolarHBondContact OG1-NH1 2.86Å; T976-R992 PolarHBondContact OG1-NH2 2.95Å; R992-Y994 VanDerWaalsContact CZ-OH 3.22Å; R992-Y994 PolarHBondContact NH1-OH 3.11Å; R992-Y994 PolarHBondContact NH2-OH 2.8Å
993	P	32.6	Very low	30.6	Very low	121 Å²	121	136.2 Å²	136.2	79%	0.786	74%	0.739	S	S	*	*				-139	164.9	58.4	40.4	-24.3	0	0	0	118.7
994	Y	25.9	Very low	31	Very low	40 Å²	40	140.2 Å²	140.2	16%	0.157	74%	0.74	C	S	.	*			trans	-27.8	123.9	169.9	-69.4	-86.9	0	0	0	118.2	P974 A975 T976 R992	P974-Y994 HydrophobicContact CB-CD1 4.06Å; P974-Y994 HydrophobicContact CB-CE1 4.21Å; P974-Y994 HydrophobicContact CB-CG 4.44Å; P974-Y994 VanDerWaalsContact CD-CG 3.46Å; P974-Y994 HydrophobicContact CG-CD1 4.17Å; P974-Y994 HydrophobicContact CG-CG 4.45Å; P974-Y994 WeakPolarHBondContact O-CD2 3.32Å; P974-Y994 WeakPolarHBondContact O-CE2 3.38Å; A975-Y994 VanDerWaalsContact CA-OH 3.3Å; A975-Y994 WeakPolarHBondContact CA-OH 3Å; T976-Y994 WeakPolarHBondContact CB-OH 3.32Å; T976-Y994 HydrophobicContact CG2-CE1 4.3Å; T976-Y994 VanDerWaalsContact CG2-OH 3.23Å; T976-Y994 WeakPolarHBondContact CG2-OH 3.19Å; T976-Y994 PolarHBondContact N-OH 2.85Å; T976-Y994 PolarHBondContact OG1-OH 3.21Å; T976-Y994 VanDerWaalsContact OG1-OH 3.14Å; R992-Y994 VanDerWaalsContact CZ-OH 3.22Å; R992-Y994 PolarHBondContact NH1-OH 3.11Å; R992-Y994 PolarHBondContact NH2-OH 2.8Å
995	N	31.6	Very low	31.6	Very low	156 Å²	156	141.4 Å²	141.4	83%	0.834	74%	0.742	S	S	*	*				-129.8	137.9	115.1	-76.7	-64.8	0	0	0	109
996	H	29.1	Very low	31.9	Very low	126 Å²	126	142.8 Å²	142.8	58%	0.583	75%	0.747	S	S	*	*			trans	-97.9	166.2	158.4	-81.9	-25.9	0	0	0	108.1
997	Y	28.6	Very low	32.3	Very low	225 Å²	225	139 Å²	139	88%	0.882	75%	0.747	S	S	*	*			trans	68.3	128.8	-157	-36.5	-63.5	0	0	0	110.6
998	V	33.1	Very low	32.2	Very low	140 Å²	140	137 Å²	137	85%	0.848	74%	0.743	S	S	*	*			cis	-137.6	136.8	7.1	175.5	0	0	0	0	109.6
999	S	37	Very low	32.4	Very low	105 Å²	105	137.5 Å²	137.5	73%	0.734	74%	0.744	S	S	*	*			trans	-176.3	105.4	141.2	-174.3	0	0	0	0	110.4
1000	V	29.6	Very low	32.6	Very low	113 Å²	113	138.3 Å²	138.3	69%	0.685	74%	0.741	S	S	*	*			trans	-111.4	157.4	155.6	-174.9	0	0	0	0	105.6
1001	F	32	Very low	33	Very low	195 Å²	195	133.2 Å²	133.2	86%	0.855	74%	0.739	S	S	*	*	S	Bend	trans	76.7	53	177.3	-45.9	-73	0	0	0	118.1
1002	D	31.5	Very low	33.1	Very low	155 Å²	155	132.8 Å²	132.8	83%	0.829	73%	0.725	S	S	*	*	S	Bend	trans	-144.6	39.3	148.5	-151.7	10.2	0	0	0	114.5
1003	S	33.9	Very low	33.2	Very low	91 Å²	91	131.1 Å²	131.1	64%	0.636	73%	0.728	S	S	*	*	S	Bend	trans	-150.5	163.5	163.9	64.3	0	0	0	0	111.4
1004	H	38	Very low	33.1	Very low	185 Å²	185	132.2 Å²	132.2	86%	0.856	73%	0.727	S	S	*	*			trans	74.7	7.1	-171.9	-49.3	-50.1	0	0	0	117.4	T1006	H1004-T1006 PolarHBondContact O-N 3.15Å
1005	V	39.5	Very low	33.2	Very low	129 Å²	129	136 Å²	136	78%	0.782	74%	0.742	S	S	*	*	S	Bend	trans	-73.2	82.7	154.1	-177.9	0	0	0	0	109.3	T1007	V1005-T1007 PolarHBondContact O-N 2.75Å
1006	T	31.7	Very low	33.3	Very low	122 Å²	122	130.2 Å²	130.2	75%	0.748	71%	0.709	S	S	*	*			trans	29.3	86.5	155.4	58.3	0	0	0	0	117.9	H1004	H1004-T1006 PolarHBondContact O-N 3.15Å
1007	T	38	Very low	33.5	Very low	145 Å²	145	126.1 Å²	126.1	89%	0.89	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-78	142.1	134	47.4	0	0	0	0	108.4	V1005	V1005-T1007 PolarHBondContact O-N 2.75Å
1008	G	29.5	Very low	33.7	Very low	61 Å²	61	119.9 Å²	119.9	63%	0.629	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-73.6	173.6	-164.6	0	0	0	0	0	115.6
1009	P	35.5	Very low	33.5	Very low	110 Å²	110	121.2 Å²	121.2	71%	0.714	67%	0.668	S	S	*	*	S	Bend	trans	-66.5	160.9	174.7	30.8	-36.1	0	0	0	112.1
1010	F	33.3	Very low	33.1	Very low	172 Å²	172	122.6 Å²	122.6	75%	0.754	66%	0.657	S	S	*	*			trans	76.2	70.6	174.3	-49.2	-75.1	0	0	0	117.6
1011	S	38	Very low	33.2	Very low	129 Å²	129	122.8 Å²	122.8	90%	0.902	66%	0.664	S	S	*	*			trans	-115.6	44.4	145.8	54.9	0	0	0	0	111.4
1012	Q	35.9	Very low	33	Very low	108 Å²	108	120.5 Å²	120.5	51%	0.505	67%	0.666	S	S	.	*			trans	-75.8	131.9	174.1	-66.8	171.8	-48.6	0	0	111.1	Y1015	Q1012-Y1015 HydrophobicContact CB-CE2 4.16Å; Q1012-Y1015 PolarHBondContact OE1-OH 3.23Å; Q1012-Y1015 VanDerWaalsContact OE1-OH 3.08Å
1013	N	32.5	Very low	33.1	Very low	126 Å²	126	118.6 Å²	118.6	67%	0.674	66%	0.664	S	S	*	*			trans	-177.1	146.9	144.2	-93	-30.9	0	0	0	108.7
1014	N	30.5	Very low	32.9	Very low	143 Å²	143	124.9 Å²	124.9	77%	0.765	67%	0.674	S	S	*	*			cis	-106.3	146.6	12.6	-77.5	-40.8	0	0	0	114.9
1015	Y	28.7	Very low	32.7	Very low	119 Å²	119	124.9 Å²	124.9	47%	0.467	67%	0.674	S	S	.	*			trans	-86.8	167.4	171.2	-85.7	-97.4	0	0	0	113	K738 T739 Q1012	K738-Y1015 CarbonylContact C-O 3.52Å; K738-Y1015 VanDerWaalsContact C-O 3.28Å; K738-Y1015 PolarHBondContact N-O 3.37Å; K738-Y1015 CarbonylContact O-C 3.38Å; K738-Y1015 VanDerWaalsContact O-C 3.27Å; T739-Y1015 VanDerWaalsContact N-C 3.35Å; T739-Y1015 CarbonylContact O-C 3.48Å; T739-Y1015 WeakPolarHBondContact O-CA 3.44Å; Q1012-Y1015 HydrophobicContact CB-CE2 4.16Å; Q1012-Y1015 PolarHBondContact OE1-OH 3.23Å; Q1012-Y1015 VanDerWaalsContact OE1-OH 3.08Å
1016	F	32.6	Very low	32.2	Very low	36 Å²	36	129.1 Å²	129.1	16%	0.158	68%	0.676	C	S	.	*	B	Isolated β-bridge		-179.8	165	116.6	-122.5	-88.9	0	0	0	117.4	L735 D736 R737 K738 T739 S740	L735-F1016 HydrophobicContact CB-CE2 3.67Å; L735-F1016 HydrophobicContact CB-CZ 3.81Å; L735-F1016 HydrophobicContact CD2-CD2 4.3Å; L735-F1016 HydrophobicContact CD2-CE2 3.51Å; L735-F1016 HydrophobicContact CD2-CZ 4.3Å; L735-F1016 HydrophobicContact CG-CE2 4.15Å; L735-F1016 VanDerWaalsContact O-CZ 3.3Å; L735-F1016 WeakPolarHBondContact O-CZ 3.41Å; D736-F1016 VanDerWaalsContact CA-CE2 3.43Å; D736-F1016 VanDerWaalsContact N-CE2 3.33Å; R737-F1016 HydrophobicContact CB-CB 4.29Å; R737-F1016 HydrophobicContact CB-CG 4.23Å; R737-F1016 HydrophobicContact CG-CB 3.74Å; R737-F1016 HydrophobicContact CG-CD1 3.38Å; R737-F1016 HydrophobicContact CG-CD2 4.15Å; R737-F1016 HydrophobicContact CG-CE1 3.94Å; R737-F1016 HydrophobicContact CG-CG 3.49Å; R737-F1016 VanDerWaalsContact CG-CG 3.49Å; R737-F1016 HydrophobicContact CG-CZ 4.5Å; K738-F1016 VanDerWaalsContact C-N 3.25Å; K738-F1016 VanDerWaalsContact N-CB 3.33Å; T739-F1016 CarbonylContact C-O 3.59Å; T739-F1016 VanDerWaalsContact CA-N 3.34Å; T739-F1016 WeakPolarHBondContact CA-O 3.49Å; T739-F1016 PolarHBondContact O-N 3.26Å; S740-F1016 WeakPolarHBondContact CA-O 3.28Å; S740-F1016 PolarHBondContact N-O 3.1Å
1017	A	34.8	Very low	32.2	Very low	39 Å²	39	132.5 Å²	132.5	32%	0.322	69%	0.686	S	S	.	*			trans	71.5	126.2	152.7	0	0	0	0	0	116.6	S740 E741	S740-A1017 CarbonylContact C-O 3.52Å; S740-A1017 WeakPolarHBondContact CA-O 3.17Å; E741-A1017 PolarHBondContact N-O 3.21Å
1018	L	31.4	Very low	31.7	Very low	94 Å²	94	130.4 Å²	130.4	49%	0.492	68%	0.677	S	S	.	*			trans	-127.5	123.3	-144.5	-92.7	74.2	0	0	0	113.6	E741 T742 I743	E741-L1018 WeakPolarHBondContact OE1-CA 3.39Å; E741-L1018 PolarHBondContact OE1-N 3.23Å; T742-L1018 WeakPolarHBondContact OG1-CA 3.42Å; T742-L1018 WeakPolarHBondContact OG1-CB 3.36Å; T742-L1018 WeakPolarHBondContact OG1-CG 3.36Å; I743-L1018 HydrophobicContact CD1-CD2 3.84Å; I743-L1018 HydrophobicContact CG1-CD2 4.05Å
1019	R	30	Very low	31.7	Very low	168 Å²	168	132.5 Å²	132.5	63%	0.634	68%	0.682	S	S	*	*				162.9	103.3	122.2	-87.1	162.2	-167.4	-101.5	-3.1	119.2	E741 T742	E741-R1019 PolarHBondContact OE1-N 3.47Å; E741-R1019 VanDerWaalsContact OE2-CA 3.29Å; E741-R1019 WeakPolarHBondContact OE2-CA 3.35Å; E741-R1019 PolarHBondContact OE2-N 2.9Å; T742-R1019 HydrophobicContact CG2-CB 4.38Å; T742-R1019 HydrophobicContact CG2-CG 3.63Å; T742-R1019 WeakPolarHBondContact OG1-CA 3.29Å; T742-R1019 WeakPolarHBondContact OG1-CG 3.07Å; T742-R1019 PolarHBondContact OG1-N 3.38Å
1020	R	28.1	Very low	31.4	Very low	135 Å²	135	132.3 Å²	132.3	51%	0.509	68%	0.684	S	S	.	*			trans	26.5	128	134.1	-70.7	166.1	102.2	157.4	5.9	119.4	E741 T742 I743 A744	E741-R1020 PolarHBondContact OE2-N 3.36Å; T742-R1020 HydrophobicContact CG2-CB 4.42Å; T742-R1020 HydrophobicContact CG2-CG 3.59Å; I743-R1020 VanDerWaalsContact O-CD 3.24Å; I743-R1020 WeakPolarHBondContact O-CD 3.22Å; I743-R1020 PolarHBondContact O-NE 3.33Å; I743-R1020 PolarHBondContact O-NH1 3.2Å; A744-R1020 PolarHBondContact O-NH1 3.36Å; A744-R1020 PolarHBondContact O-NH2 3.37Å; A744-R1020 VanDerWaalsContact O-NH2 3.16Å
1021	S	32.2	Very low	31.4	Very low	117 Å²	117	132.4 Å²	132.4	82%	0.818	69%	0.691	S	S	*	*			trans	-155.3	167.6	136.8	52.7	0	0	0	0	112.2
1022	V	28.4	Very low	31.1	Very low	147 Å²	147	131.2 Å²	131.2	89%	0.891	68%	0.683	S	S	*	*			trans	-134.8	122.7	175.6	179.1	0	0	0	0	108.4
1023	S	33	Very low	30.7	Very low	115 Å²	115	138.1 Å²	138.1	80%	0.804	70%	0.704	S	S	*	*			trans	-142.5	142.6	168.5	47.4	0	0	0	0	109.5
1024	R	30.3	Very low	30.7	Very low	223 Å²	223	138.8 Å²	138.8	84%	0.842	71%	0.712	S	S	*	*			trans	-127.1	111.1	-171.9	162	-144.1	-173.8	-179.2	3.7	106.4
1025	E	32.1	Very low	30.6	Very low	184 Å²	184	135.1 Å²	135.1	86%	0.86	71%	0.709	S	S	*	*			trans	-133.3	154.9	171.6	-156.1	139.8	-107.1	0	0	111.6
1026	R	30	Very low	30.6	Very low	219 Å²	219	135.1 Å²	135.1	83%	0.826	73%	0.726	S	S	*	*			trans	-110.3	123.3	-179.2	-69.6	161	157.7	164	-12.4	108
1027	M	30.7	Very low	30.2	Very low	192 Å²	192	143.9 Å²	143.9	95%	0.946	77%	0.765	S	S	*	*			trans	-142.9	159.4	147.5	-97.4	-57.7	161.3	0	0	110.6
1028	S	28.1	Very low	30	Very low	102 Å²	102	146.9 Å²	146.9	71%	0.713	78%	0.783	S	S	*	*			trans	-123.5	167.6	-166.6	58.4	0	0	0	0	113
1029	S	30.2	Very low	30	Very low	104 Å²	104	151.7 Å²	151.7	73%	0.727	80%	0.795	S	S	*	*			trans	92.6	101.6	156.5	76.5	0	0	0	0	120.5
1030	S	28.3	Very low	29.9	Very low	107 Å²	107	153.9 Å²	153.9	75%	0.748	81%	0.809	S	S	*	*				64.2	98	125.2	62.5	0	0	0	0	122.4
1031	L	34.3	Very low	29.9	Very low	174 Å²	174	153 Å²	153	91%	0.911	81%	0.814	S	S	*	*				-139.7	146.4	128.4	-76.5	101.4	0	0	0	108.4
1032	S	30.3	Very low	29.6	Very low	104 Å²	104	151.1 Å²	151.1	73%	0.727	80%	0.802	S	S	*	*			cis	-158.4	149.9	-18.9	56.8	0	0	0	0	109.7
1033	R	28.3	Very low	29.5	Very low	252 Å²	252	154.8 Å²	154.8	95%	0.951	80%	0.801	S	S	*	*			trans	-84.2	110	177.4	-82.1	176.8	166.4	167.5	-6.1	112.1
1034	V	33.4	Very low	29.3	Very low	140 Å²	140	156.2 Å²	156.2	85%	0.848	80%	0.795	S	S	*	*			trans	-150.4	115.6	150.1	-177.1	0	0	0	0	105
1035	G	27.2	Very low	29.1	Very low	67 Å²	67	151 Å²	151	69%	0.691	78%	0.783	S	S	*	*				99.1	130.6	80.8	0	0	0	0	0	108.7
1036	S	28.1	Very low	28.9	Very low	119 Å²	119	151.6 Å²	151.6	83%	0.832	78%	0.784	S	S	*	*			cis	-146	138.8	25.7	-61.3	0	0	0	0	113.1
1037	F	25.8	Very low	29	Very low	220 Å²	220	148.4 Å²	148.4	97%	0.965	78%	0.782	S	S	*	*			trans	-90.2	116.6	157.5	-78.9	-91.2	0	0	0	108.9
1038	S	30.3	Very low	28.9	Very low	101 Å²	101	144.4 Å²	144.4	71%	0.706	77%	0.771	S	S	*	*			trans	-163.2	104	160.2	-179.2	0	0	0	0	112.3
1039	R	30.2	Very low	29	Very low	196 Å²	196	151 Å²	151	74%	0.74	78%	0.781	S	S	*	*			trans	38.6	110.5	146.2	-60.1	-176.4	164.9	110.3	2.3	118.9	D1041	R1039-D1041 WeakPolarHBondContact CD-OD2 3.17Å; R1039-D1041 VanDerWaalsContact CG-OD2 3.25Å; R1039-D1041 WeakPolarHBondContact CG-OD2 3.37Å; R1039-D1041 IonicContact NE-OD2 3.24Å; R1039-D1041 PolarHBondContact NE-OD2 2.76Å
1040	F	29.5	Very low	28.8	Very low	214 Å²	214	152 Å²	152	94%	0.939	78%	0.783	S	S	*	*				-107.1	108.8	111.2	-97.9	-91.4	0	0	0	107.9
1041	D	26.5	Very low	28.8	Very low	115 Å²	115	151 Å²	151	62%	0.615	78%	0.781	S	S	*	*			trans	-85.8	161.7	161.2	-69.6	-55.7	0	0	0	108.1	R1039	R1039-D1041 WeakPolarHBondContact CD-OD2 3.17Å; R1039-D1041 VanDerWaalsContact CG-OD2 3.25Å; R1039-D1041 WeakPolarHBondContact CG-OD2 3.37Å; R1039-D1041 IonicContact NE-OD2 3.24Å; R1039-D1041 PolarHBondContact NE-OD2 2.76Å
1042	S	25.9	Very low	28.5	Very low	79 Å²	79	148.7 Å²	148.7	55%	0.552	78%	0.78	S	S	*	*			trans	73.2	126.7	-170.5	-162.3	0	0	0	0	113.6
1043	Y	27.2	Very low	28.7	Very low	223 Å²	223	151.2 Å²	151.2	88%	0.875	77%	0.773	S	S	*	*			cis	-116.9	144.5	25.2	-75.9	-101.8	0	0	0	116
1044	H	29.5	Very low	28.8	Very low	146 Å²	146	143.7 Å²	143.7	68%	0.676	76%	0.76	S	S	*	*			trans	-44	158.8	152.7	-69	-87.7	0	0	0	113.6
1045	D	25.4	Very low	29	Very low	112 Å²	112	143.7 Å²	143.7	60%	0.599	76%	0.76	S	S	*	*			cis	-154.9	161.3	-8.1	-101.4	-30.5	0	0	0	105.9
1046	F	28.8	Very low	29.5	Very low	198 Å²	198	142.3 Å²	142.3	87%	0.868	74%	0.742	S	S	*	*			cis	-142.9	134.9	48	-71.4	-97.3	0	0	0	114.2
1047	L	30.3	Very low	30.3	Very low	152 Å²	152	145.1 Å²	145.1	80%	0.796	74%	0.742	S	S	*	*			trans	26.5	114.3	150.5	-64.6	174.6	0	0	0	120.4
1048	P	30	Very low	31.2	Very low	108 Å²	108	139.3 Å²	139.3	70%	0.701	72%	0.72	S	S	*	*			trans	-86.5	145	171.3	35	-33.6	0	0	0	113.1
1049	Y	29.1	Very low	31.8	Very low	240 Å²	240	137.2 Å²	137.2	94%	0.941	70%	0.704	S	S	*	*			trans	-84.7	112.1	160.9	-113.7	-82.9	0	0	0	110.5	A1051	Y1049-A1051 PolarHBondContact O-N 3.47Å; Y1049-A1051 VanDerWaalsContact O-N 3.08Å
1050	T	25.8	Very low	32.5	Very low	125 Å²	125	133.9 Å²	133.9	77%	0.767	71%	0.705	S	S	*	*			trans	-78.6	92.1	-173	48.8	0	0	0	0	112.7
1051	A	29.3	Very low	33.2	Very low	85 Å²	85	134.6 Å²	134.6	70%	0.702	70%	0.701	S	S	*	*			trans	-111.6	77.8	168.7	0	0	0	0	0	111	Y1049 R1053	Y1049-A1051 PolarHBondContact O-N 3.47Å; Y1049-A1051 VanDerWaalsContact O-N 3.08Å; A1051-R1053 PolarHBondContact O-N 3.4Å
1052	S	27.5	Very low	34	Very low	126 Å²	126	130.7 Å²	130.7	88%	0.881	68%	0.683	S	S	*	*			trans	-69.8	71.4	177.5	44.3	0	0	0	0	112.6
1053	R	34.1	Very low	35	Very low	157 Å²	157	134 Å²	134	59%	0.592	70%	0.7	S	S	*	*			trans	-102.3	132.6	171.3	-79.1	-179.7	167.5	-116.5	4.3	110.4	A1051 T1055 T1082	A1051-R1053 PolarHBondContact O-N 3.4Å; R1053-T1055 PolarHBondContact O-N 2.79Å; R1053-T1082 VanDerWaalsContact CZ-CG2 3.42Å; R1053-T1082 VanDerWaalsContact NH1-CG2 3.25Å
1054	S	31.5	Very low	35.9	Very low	95 Å²	95	125.7 Å²	125.7	66%	0.664	68%	0.675	S	S	*	*			trans	-45.5	126.7	-177.5	58.4	0	0	0	0	112.7	A1056	S1054-A1056 VanDerWaalsContact C-N 3.29Å; S1054-A1056 PolarHBondContact O-N 3.05Å
1055	T	36.1	Very low	37.2	Very low	139 Å²	139	125.9 Å²	125.9	85%	0.853	67%	0.674	S	S	*	*			trans	-60.4	92	163.2	36.8	0	0	0	0	109	R1053 Q1057	R1053-T1055 PolarHBondContact O-N 2.79Å; T1055-Q1057 PolarHBondContact O-N 2.79Å
1056	A	38.8	Very low	38.9	Very low	38 Å²	38	124.4 Å²	124.4	31%	0.314	67%	0.673	S	S	.	*			trans	-67.5	100.9	170.8	0	0	0	0	0	107.1	S1054 I1058 Y1071	S1054-A1056 VanDerWaalsContact C-N 3.29Å; S1054-A1056 PolarHBondContact O-N 3.05Å; A1056-I1058 PolarHBondContact O-N 3.47Å; A1056-Y1071 PolarHBondContact O-OH 2.79Å
1057	Q	45.2	Very low	40.1	Very low	179 Å²	179	123 Å²	123	84%	0.836	66%	0.661	S	S	*	*			trans	-53.2	112.2	176.7	-78.1	179.3	-53.2	0	0	109.1	T1055 P1059	T1055-Q1057 PolarHBondContact O-N 2.79Å; Q1057-P1059 WeakPolarHBondContact O-CD 2.9Å
1058	I	44.2	Very low	41.7	Very low	97 Å²	97	119.3 Å²	119.3	50%	0.497	64%	0.639	S	S	.	*			trans	-59	128.2	169.5	-62.8	168.3	0	0	0	106.3	A1056 V1060 Y1071	A1056-I1058 PolarHBondContact O-N 3.47Å; I1058-V1060 WeakPolarHBondContact O-CG2 2.93Å; I1058-V1060 PolarHBondContact O-N 3.2Å; I1058-Y1071 HydrophobicContact CB-CE1 4.49Å; I1058-Y1071 HydrophobicContact CG1-CE1 4.18Å; I1058-Y1071 WeakPolarHBondContact CG1-OH 3.49Å; I1058-Y1071 HydrophobicContact CG2-CE1 4.36Å
1059	P	41.9	Very low	43.4	Very low	57 Å²	57	117.2 Å²	117.2	37%	0.37	62%	0.621	S	S	.	*			trans	-71.2	74.9	175.7	-22.5	36.4	0	0	0	111.7	Q1057 R1061 S1062 Y1071	Q1057-P1059 WeakPolarHBondContact O-CD 2.9Å; P1059-R1061 PolarHBondContact O-N 3.2Å; P1059-S1062 PolarHBondContact O-N 3.31Å; P1059-Y1071 HydrophobicContact CG-CD2 4.2Å; P1059-Y1071 HydrophobicContact CG-CG 4.37Å
1060	V	46.4	Very low	45	Very low	126 Å²	126	109.6 Å²	109.6	76%	0.764	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54	-18.1	-172.8	-171.2	0	0	0	0	113.5	I1058	I1058-V1060 WeakPolarHBondContact O-CG2 2.93Å; I1058-V1060 PolarHBondContact O-N 3.2Å
1061	R	44.1	Very low	46.7	Very low	229 Å²	229	106 Å²	106	86%	0.864	57%	0.569	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.4	40.4	175.5	-62.7	-173.3	173.8	117.8	2	113.9	P1059 T1063	P1059-R1061 PolarHBondContact O-N 3.2Å; R1061-T1063 PolarHBondContact O-N 3Å; R1061-T1063 VanDerWaalsContact O-N 3.11Å
1062	S	42.8	Very low	48.6	Very low	34 Å²	34	103.3 Å²	103.3	24%	0.238	54%	0.541	C	S	.	.			trans	-70.4	104.6	172.4	61	0	0	0	0	111.6	P1059 S1064	P1059-S1062 PolarHBondContact O-N 3.31Å; S1062-S1064 PolarHBondContact O-N 3.28Å
1063	T	46.2	Very low	50.4	Low	147 Å²	147	100.6 Å²	100.6	90%	0.902	52%	0.516	S	S	*	.	S	Bend	trans	-69.2	20.9	-173.9	52.2	0	0	0	0	116	R1061	R1061-T1063 PolarHBondContact O-N 3Å; R1061-T1063 VanDerWaalsContact O-N 3.11Å
1064	S	45.9	Very low	52	Low	50 Å²	50	100.5 Å²	100.5	35%	0.35	52%	0.516	S	S	.	.			trans	-149.8	128.2	178.9	41.4	0	0	0	0	111.7	S1062 S1066 R1067 F1068	S1062-S1064 PolarHBondContact O-N 3.28Å; S1064-S1066 VanDerWaalsContact C-N 3.31Å; S1064-S1066 PolarHBondContact O-N 2.97Å; S1064-R1067 PolarHBondContact O-N 2.73Å; S1064-R1067 VanDerWaalsContact O-N 3.13Å; S1064-F1068 PolarHBondContact O-N 2.84Å
1065	F	57.3	Low	53.7	Low	150 Å²	150	98.8 Å²	98.8	66%	0.658	50%	0.501	S	S	*	.	H	α-helix	trans	-55.7	-42.6	-178	179.6	-100.4	0	0	0	112.6	R1067 F1068 M1069	F1065-R1067 VanDerWaalsContact C-N 3.31Å; F1065-R1067 PolarHBondContact O-N 2.84Å; F1065-F1068 WeakPolarHBondContact O-CB 3.23Å; F1065-F1068 PolarHBondContact O-N 2.99Å; F1065-F1068 VanDerWaalsContact O-N 3.15Å; F1065-M1069 HydrophobicContact CD1-CG 4.07Å; F1065-M1069 HydrophobicContact CE1-CG 3.69Å; F1065-M1069 HydrophobicContact CE1-SD 4.32Å; F1065-M1069 HydrophobicContact CE2-CG 4.36Å; F1065-M1069 HydrophobicContact CE2-SD 4.28Å; F1065-M1069 HydrophobicContact CZ-CG 3.85Å; F1065-M1069 HydrophobicContact CZ-SD 3.88Å; F1065-M1069 WeakPolarHBondContact O-CG 3.06Å; F1065-M1069 PolarHBondContact O-N 2.96Å
1066	S	61.8	Low	55.3	Low	81 Å²	81	96 Å²	96	57%	0.566	48%	0.478	S	S	*	.	H	α-helix	trans	-56.4	-44.3	177.7	-36.5	0	0	0	0	112.1	S1064 F1068 M1069 D1070	S1064-S1066 VanDerWaalsContact C-N 3.31Å; S1064-S1066 PolarHBondContact O-N 2.97Å; S1066-F1068 VanDerWaalsContact C-N 3.3Å; S1066-F1068 PolarHBondContact O-N 3.19Å; S1066-M1069 CarbonylContact O-C 3.46Å; S1066-M1069 WeakPolarHBondContact O-CA 3.48Å; S1066-M1069 WeakPolarHBondContact O-CB 3.31Å; S1066-M1069 PolarHBondContact O-N 2.82Å; S1066-D1070 PolarHBondContact O-N 2.78Å
1067	R	54.1	Low	56.3	Low	167 Å²	167	97 Å²	97	63%	0.63	48%	0.478	S	S	*	.	H	α-helix	trans	-69.5	-30.2	-178.5	-142.5	176.8	-165.5	91.5	-4.3	112.5	S1064 F1065 Y1071	S1064-R1067 PolarHBondContact O-N 2.73Å; S1064-R1067 VanDerWaalsContact O-N 3.13Å; F1065-R1067 VanDerWaalsContact C-N 3.31Å; F1065-R1067 PolarHBondContact O-N 2.84Å; R1067-Y1071 PolarHBondContact O-N 2.85Å
1068	F	63.4	Low	56.8	Low	76 Å²	76	95 Å²	95	33%	0.333	46%	0.463	S	S	.	.	H	α-helix	trans	-69.2	-37.5	170.4	179	-118.3	0	0	0	111.2	R527 S1064 F1065 S1066 Y1072	R527-F1068 HydrophobicContact CB-CZ 4.44Å; R527-F1068 VanDerWaalsContact CZ-O 3.28Å; R527-F1068 VanDerWaalsContact NH1-CE1 3.29Å; R527-F1068 PolarHBondContact NH1-O 2.81Å; R527-F1068 PolarHBondContact NH2-O 3.31Å; S1064-F1068 PolarHBondContact O-N 2.84Å; F1065-F1068 WeakPolarHBondContact O-CB 3.23Å; F1065-F1068 PolarHBondContact O-N 2.99Å; F1065-F1068 VanDerWaalsContact O-N 3.15Å; S1066-F1068 VanDerWaalsContact C-N 3.3Å; S1066-F1068 PolarHBondContact O-N 3.19Å; F1068-Y1072 PolarHBondContact O-N 3.03Å
1069	M	66.1	Low	57.4	Low	64 Å²	64	93.3 Å²	93.3	32%	0.315	45%	0.454	S	S	.	.	H	α-helix	trans	-70.8	-42.9	172.9	-62.7	-59.6	-78	0	0	112.2	F1065 S1066 Y1071 Y1072 D1073	F1065-M1069 HydrophobicContact CD1-CG 4.07Å; F1065-M1069 HydrophobicContact CE1-CG 3.69Å; F1065-M1069 HydrophobicContact CE1-SD 4.32Å; F1065-M1069 HydrophobicContact CE2-CG 4.36Å; F1065-M1069 HydrophobicContact CE2-SD 4.28Å; F1065-M1069 HydrophobicContact CZ-CG 3.85Å; F1065-M1069 HydrophobicContact CZ-SD 3.88Å; F1065-M1069 WeakPolarHBondContact O-CG 3.06Å; F1065-M1069 PolarHBondContact O-N 2.96Å; S1066-M1069 CarbonylContact O-C 3.46Å; S1066-M1069 WeakPolarHBondContact O-CA 3.48Å; S1066-M1069 WeakPolarHBondContact O-CB 3.31Å; S1066-M1069 PolarHBondContact O-N 2.82Å; M1069-Y1071 PolarHBondContact O-N 2.67Å; M1069-Y1071 VanDerWaalsContact O-N 3.13Å; M1069-Y1072 WeakPolarHBondContact O-CA 3.43Å; M1069-Y1072 WeakPolarHBondContact O-CB 3.21Å; M1069-Y1072 PolarHBondContact O-N 3.5Å; M1069-D1073 PolarHBondContact O-N 3.43Å
1070	D	63.1	Low	58.1	Low	79 Å²	79	96.3 Å²	96.3	42%	0.422	46%	0.461	S	S	.	.	H	α-helix	trans	-59.5	-30.5	175.6	-54	-33.7	0	0	0	112.5	S1066 R1074	S1066-D1070 PolarHBondContact O-N 2.78Å; D1070-R1074 VanDerWaalsContact CB-NH2 3.26Å; D1070-R1074 WeakPolarHBondContact O-CB 3.25Å; D1070-R1074 WeakPolarHBondContact O-CG 3.3Å; D1070-R1074 PolarHBondContact O-N 2.02Å; D1070-R1074 PolarHBondContact O-NE 3.24Å
1071	Y	60.6	Low	58.2	Low	49 Å²	49	97.7 Å²	97.7	19%	0.192	45%	0.453	C	S	.	.	H	α-helix	trans	-71.8	-40.8	173	179.7	-103.2	0	0	0	111.5	A1056 I1058 P1059 R1067 M1069 R1074 V1075	A1056-Y1071 PolarHBondContact O-OH 2.79Å; I1058-Y1071 HydrophobicContact CB-CE1 4.49Å; I1058-Y1071 HydrophobicContact CG1-CE1 4.18Å; I1058-Y1071 WeakPolarHBondContact CG1-OH 3.49Å; I1058-Y1071 HydrophobicContact CG2-CE1 4.36Å; P1059-Y1071 HydrophobicContact CG-CD2 4.2Å; P1059-Y1071 HydrophobicContact CG-CG 4.37Å; R1067-Y1071 PolarHBondContact O-N 2.85Å; M1069-Y1071 PolarHBondContact O-N 2.67Å; M1069-Y1071 VanDerWaalsContact O-N 3.13Å; Y1071-R1074 PolarHBondContact O-N 3.08Å; Y1071-V1075 HydrophobicContact CD1-CG2 4.25Å; Y1071-V1075 HydrophobicContact CE1-CG2 3.75Å; Y1071-V1075 HydrophobicContact CE2-CG2 4.08Å; Y1071-V1075 WeakPolarHBondContact O-CG2 3.25Å; Y1071-V1075 PolarHBondContact O-N 3.05Å
1072	Y	69.3	Low	58.7	Low	30 Å²	30	88 Å²	88	12%	0.118	42%	0.419	C	S	.	.	H	α-helix	trans	-59.9	-52.1	179.5	-174.9	-114.9	0	0	0	112.7	R526 R527 F1068 M1069 R1074 V1075 K1076	R526-Y1072 HydrophobicContact CB-CE2 3.95Å; R526-Y1072 WeakPolarHBondContact CD-OH 3.09Å; R527-Y1072 HydrophobicContact CG-CD2 4.17Å; R527-Y1072 HydrophobicContact CG-CE2 3.96Å; F1068-Y1072 PolarHBondContact O-N 3.03Å; M1069-Y1072 WeakPolarHBondContact O-CA 3.43Å; M1069-Y1072 WeakPolarHBondContact O-CB 3.21Å; M1069-Y1072 PolarHBondContact O-N 3.5Å; Y1072-R1074 VanDerWaalsContact C-N 3.31Å; Y1072-R1074 PolarHBondContact O-N 2.67Å; Y1072-V1075 PolarHBondContact O-N 2.97Å; Y1072-V1075 VanDerWaalsContact O-N 3.08Å; Y1072-K1076 HydrophobicContact CE1-CD 4.37Å; Y1072-K1076 WeakPolarHBondContact O-CB 3.3Å; Y1072-K1076 PolarHBondContact O-N 2.82Å
1073	D	66.1	Low	58.7	Low	68 Å²	68	93.4 Å²	93.4	36%	0.364	44%	0.435	S	S	.	.	H	α-helix	trans	-69.9	-32.2	-177.7	-68.6	-53	0	0	0	111.2	M1069 V1075 K1076 D1077	M1069-D1073 PolarHBondContact O-N 3.43Å; D1073-V1075 VanDerWaalsContact C-N 3.35Å; D1073-V1075 PolarHBondContact O-N 3.01Å; D1073-K1076 PolarHBondContact O-N 2.85Å; D1073-K1076 IonicContact OD1-NZ 3.19Å; D1073-D1077 VanDerWaalsContact O-CB 3.31Å; D1073-D1077 WeakPolarHBondContact O-CB 3.47Å; D1073-D1077 PolarHBondContact O-N 3.21Å
1074	R	67.1	Low	58.7	Low	155 Å²	155	90 Å²	90	59%	0.585	42%	0.417	S	S	*	.	H	α-helix	trans	-62.9	-34.8	168.3	-80.3	-177.1	-85.5	-164.1	-9.5	113.6	D1070 Y1071 Y1072 R1078	D1070-R1074 VanDerWaalsContact CB-NH2 3.26Å; D1070-R1074 WeakPolarHBondContact O-CB 3.25Å; D1070-R1074 WeakPolarHBondContact O-CG 3.3Å; D1070-R1074 PolarHBondContact O-N 2.02Å; D1070-R1074 PolarHBondContact O-NE 3.24Å; Y1071-R1074 PolarHBondContact O-N 3.08Å; Y1072-R1074 VanDerWaalsContact C-N 3.31Å; Y1072-R1074 PolarHBondContact O-N 2.67Å; R1074-R1078 WeakPolarHBondContact O-CB 3.2Å; R1074-R1078 WeakPolarHBondContact O-CD 3.3Å; R1074-R1078 WeakPolarHBondContact O-CG 3.45Å; R1074-R1078 PolarHBondContact O-N 3.38Å; R1074-R1078 VanDerWaalsContact O-N 3.12Å
1075	V	67.5	Low	58.6	Low	59 Å²	59	95.9 Å²	95.9	36%	0.358	43%	0.432	S	S	.	.	H	α-helix	trans	-73	-46.1	172.9	169.8	0	0	0	0	111	Y1071 Y1072 D1073 D1077 R1078 L1079	Y1071-V1075 HydrophobicContact CD1-CG2 4.25Å; Y1071-V1075 HydrophobicContact CE1-CG2 3.75Å; Y1071-V1075 HydrophobicContact CE2-CG2 4.08Å; Y1071-V1075 WeakPolarHBondContact O-CG2 3.25Å; Y1071-V1075 PolarHBondContact O-N 3.05Å; Y1072-V1075 PolarHBondContact O-N 2.97Å; Y1072-V1075 VanDerWaalsContact O-N 3.08Å; D1073-V1075 VanDerWaalsContact C-N 3.35Å; D1073-V1075 PolarHBondContact O-N 3.01Å; V1075-D1077 VanDerWaalsContact C-N 3.3Å; V1075-D1077 PolarHBondContact O-N 3.47Å; V1075-R1078 PolarHBondContact O-N 2.87Å; V1075-R1078 VanDerWaalsContact O-N 3.1Å; V1075-L1079 WeakPolarHBondContact O-CB 3.23Å; V1075-L1079 PolarHBondContact O-N 2.81Å
1076	K	69.5	Low	58	Low	82 Å²	82	94.2 Å²	94.2	36%	0.357	43%	0.426	S	S	.	.	H	α-helix	trans	-55.6	-43.3	176.9	-170.1	178.7	-180	-177.2	0	111.7	Y1072 D1073 L1079 K1080	Y1072-K1076 HydrophobicContact CE1-CD 4.37Å; Y1072-K1076 WeakPolarHBondContact O-CB 3.3Å; Y1072-K1076 PolarHBondContact O-N 2.82Å; D1073-K1076 PolarHBondContact O-N 2.85Å; D1073-K1076 IonicContact OD1-NZ 3.19Å; K1076-L1079 PolarHBondContact O-N 2.91Å; K1076-K1080 WeakPolarHBondContact O-CG 2.97Å; K1076-K1080 PolarHBondContact O-N 2.98Å
1077	D	60.4	Low	57.2	Low	59 Å²	59	94.9 Å²	94.9	32%	0.316	43%	0.43	S	S	.	.	H	α-helix	trans	-79.8	-22.2	177.3	-87.7	8	0	0	0	114.3	D1073 V1075 K1080 R1081	D1073-D1077 VanDerWaalsContact O-CB 3.31Å; D1073-D1077 WeakPolarHBondContact O-CB 3.47Å; D1073-D1077 PolarHBondContact O-N 3.21Å; V1075-D1077 VanDerWaalsContact C-N 3.3Å; V1075-D1077 PolarHBondContact O-N 3.47Å; D1077-K1080 IonicContact OD1-NZ 2.72Å; D1077-K1080 PolarHBondContact OD1-NZ 2.67Å; D1077-R1081 VanDerWaalsContact O-CG 3.26Å; D1077-R1081 WeakPolarHBondContact O-CG 3.12Å; D1077-R1081 PolarHBondContact O-N 3.15Å; D1077-R1081 PolarHBondContact O-NH1 2.89Å
1078	R	54.4	Low	56.6	Low	137 Å²	137	93.3 Å²	93.3	52%	0.517	43%	0.434	S	S	.	.	H	α-helix	trans	-70.9	-37.5	166.7	-81.5	172.3	174.1	-160.5	-2.8	111.2	R1074 V1075 R1081 T1082	R1074-R1078 WeakPolarHBondContact O-CB 3.2Å; R1074-R1078 WeakPolarHBondContact O-CD 3.3Å; R1074-R1078 WeakPolarHBondContact O-CG 3.45Å; R1074-R1078 PolarHBondContact O-N 3.38Å; R1074-R1078 VanDerWaalsContact O-N 3.12Å; V1075-R1078 PolarHBondContact O-N 2.87Å; V1075-R1078 VanDerWaalsContact O-N 3.1Å; R1078-R1081 CarbonylContact O-C 3.55Å; R1078-R1081 PolarHBondContact O-N 2.88Å; R1078-T1082 PolarHBondContact O-N 3.37Å; R1078-T1082 VanDerWaalsContact O-N 3.14Å
1079	L	58.1	Low	55.3	Low	60 Å²	60	99.6 Å²	99.6	31%	0.314	46%	0.457	S	S	.	.	H	α-helix	trans	-70.4	-40.3	178.2	-170.4	68.1	0	0	0	112.3	V1075 K1076 R1081 T1082 Y1083	V1075-L1079 WeakPolarHBondContact O-CB 3.23Å; V1075-L1079 PolarHBondContact O-N 2.81Å; K1076-L1079 PolarHBondContact O-N 2.91Å; L1079-R1081 PolarHBondContact O-N 3.4Å; L1079-T1082 WeakPolarHBondContact CA-OG1 3.2Å; L1079-T1082 PolarHBondContact O-N 3.38Å; L1079-T1082 PolarHBondContact O-OG1 2.89Å; L1079-Y1083 HydrophobicContact CD1-CD2 4.38Å; L1079-Y1083 HydrophobicContact CD1-CE2 3.59Å; L1079-Y1083 HydrophobicContact CD2-CE2 4.27Å; L1079-Y1083 HydrophobicContact CG-CD2 4.18Å; L1079-Y1083 HydrophobicContact CG-CE2 3.62Å; L1079-Y1083 VanDerWaalsContact O-CD2 3.28Å; L1079-Y1083 WeakPolarHBondContact O-CD2 3.42Å; L1079-Y1083 PolarHBondContact O-N 3.33Å
1080	K	55.3	Low	54.1	Low	121 Å²	121	107.3 Å²	107.3	53%	0.526	48%	0.483	S	S	.	.	H	α-helix	trans	-56.9	-40.3	168.3	-70.5	174.4	-169.8	159.9	0	111.9	K1076 D1077 T1082 S1084	K1076-K1080 WeakPolarHBondContact O-CG 2.97Å; K1076-K1080 PolarHBondContact O-N 2.98Å; D1077-K1080 IonicContact OD1-NZ 2.72Å; D1077-K1080 PolarHBondContact OD1-NZ 2.67Å; K1080-T1082 VanDerWaalsContact C-N 3.34Å; K1080-T1082 PolarHBondContact O-N 3.13Å; K1080-S1084 WeakPolarHBondContact O-CB 3.23Å; K1080-S1084 PolarHBondContact O-N 3.47Å; K1080-S1084 VanDerWaalsContact O-N 3.08Å; K1080-S1084 PolarHBondContact O-OG 3.25Å
1081	R	49.8	Very low	52.7	Low	155 Å²	155	109.1 Å²	109.1	59%	0.585	50%	0.498	S	S	*	.	H	α-helix	trans	-76.7	-8.2	179.7	-71.6	178.6	-177.6	106.8	-7	114.9	D1077 R1078 L1079	D1077-R1081 VanDerWaalsContact O-CG 3.26Å; D1077-R1081 WeakPolarHBondContact O-CG 3.12Å; D1077-R1081 PolarHBondContact O-N 3.15Å; D1077-R1081 PolarHBondContact O-NH1 2.89Å; R1078-R1081 CarbonylContact O-C 3.55Å; R1078-R1081 PolarHBondContact O-N 2.88Å; L1079-R1081 PolarHBondContact O-N 3.4Å
1082	T	53.1	Low	51.4	Low	24 Å²	24	115.9 Å²	115.9	15%	0.147	53%	0.529	C	S	.	.	H	α-helix	trans	-85.5	-52.7	167.2	39.9	0	0	0	0	110.7	R1053 R1078 L1079 K1080 S1084 R1085 E1086	R1053-T1082 VanDerWaalsContact CZ-CG2 3.42Å; R1053-T1082 VanDerWaalsContact NH1-CG2 3.25Å; R1078-T1082 PolarHBondContact O-N 3.37Å; R1078-T1082 VanDerWaalsContact O-N 3.14Å; L1079-T1082 WeakPolarHBondContact CA-OG1 3.2Å; L1079-T1082 PolarHBondContact O-N 3.38Å; L1079-T1082 PolarHBondContact O-OG1 2.89Å; K1080-T1082 VanDerWaalsContact C-N 3.34Å; K1080-T1082 PolarHBondContact O-N 3.13Å; T1082-S1084 PolarHBondContact O-N 2.7Å; T1082-R1085 WeakPolarHBondContact O-CA 3.38Å; T1082-R1085 PolarHBondContact O-N 3.16Å; T1082-E1086 PolarHBondContact O-N 2.69Å; T1082-E1086 VanDerWaalsContact O-N 3.11Å
1083	Y	43	Very low	49.6	Very low	149 Å²	149	123.4 Å²	123.4	58%	0.584	57%	0.565	S	S	*	*	H	α-helix	trans	-63.3	-29.8	179.9	-61.8	-54	0	0	0	112.7	L1079 R1085 E1086	L1079-Y1083 HydrophobicContact CD1-CD2 4.38Å; L1079-Y1083 HydrophobicContact CD1-CE2 3.59Å; L1079-Y1083 HydrophobicContact CD2-CE2 4.27Å; L1079-Y1083 HydrophobicContact CG-CD2 4.18Å; L1079-Y1083 HydrophobicContact CG-CE2 3.62Å; L1079-Y1083 VanDerWaalsContact O-CD2 3.28Å; L1079-Y1083 WeakPolarHBondContact O-CD2 3.42Å; L1079-Y1083 PolarHBondContact O-N 3.33Å; Y1083-R1085 PolarHBondContact O-N 3.18Å; Y1083-E1086 WeakPolarHBondContact CD1-OE2 3.46Å
1084	S	47.1	Very low	47.9	Very low	75 Å²	75	125 Å²	125	52%	0.524	58%	0.577	S	S	.	*	H	α-helix	trans	-72.1	1.5	171.1	83.7	0	0	0	0	115.1	K1080 T1082	K1080-S1084 WeakPolarHBondContact O-CB 3.23Å; K1080-S1084 PolarHBondContact O-N 3.47Å; K1080-S1084 VanDerWaalsContact O-N 3.08Å; K1080-S1084 PolarHBondContact O-OG 3.25Å; T1082-S1084 PolarHBondContact O-N 2.7Å
1085	R	42.4	Very low	46	Very low	174 Å²	174	126.4 Å²	126.4	66%	0.657	59%	0.59	S	S	*	*	H	α-helix	trans	-121.1	-23.4	175.7	-90.7	-177.5	161.8	168.9	-5.1	113.5	T1082 Y1083 S1087 L1088	T1082-R1085 WeakPolarHBondContact O-CA 3.38Å; T1082-R1085 PolarHBondContact O-N 3.16Å; Y1083-R1085 PolarHBondContact O-N 3.18Å; R1085-S1087 PolarHBondContact O-N 2.98Å; R1085-L1088 WeakPolarHBondContact O-CB 2.99Å; R1085-L1088 PolarHBondContact O-N 3.24Å
1086	E	46.2	Very low	44	Very low	115 Å²	115	128 Å²	128	54%	0.537	61%	0.609	S	S	.	*	H	α-helix	trans	-70.5	-22.1	173.5	-72.2	168.7	163.7	0	0	112.6	T1082 Y1083 L1088 Y1089	T1082-E1086 PolarHBondContact O-N 2.69Å; T1082-E1086 VanDerWaalsContact O-N 3.11Å; Y1083-E1086 WeakPolarHBondContact CD1-OE2 3.46Å; E1086-L1088 PolarHBondContact O-N 2.89Å; E1086-L1088 VanDerWaalsContact O-N 3.1Å; E1086-Y1089 PolarHBondContact O-N 2.84Å
1087	S	44	Very low	42.1	Very low	94 Å²	94	129.2 Å²	129.2	66%	0.657	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.3	-11.6	169	57.4	0	0	0	0	114.8	R1085	R1085-S1087 PolarHBondContact O-N 2.98Å
1088	L	42.3	Very low	40.6	Very low	135 Å²	135	136.3 Å²	136.3	71%	0.707	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.4	-5.6	173.6	-74.3	149.3	0	0	0	113.6	R1085 E1086	R1085-L1088 WeakPolarHBondContact O-CB 2.99Å; R1085-L1088 PolarHBondContact O-N 3.24Å; E1086-L1088 PolarHBondContact O-N 2.89Å; E1086-L1088 VanDerWaalsContact O-N 3.1Å
1089	Y	36.5	Very low	39.2	Very low	207 Å²	207	136.5 Å²	136.5	81%	0.812	66%	0.658	S	S	*	*	S	Bend	trans	-118.2	19.3	-173	-95.1	-83.2	0	0	0	115.1	E1086	E1086-Y1089 PolarHBondContact O-N 2.84Å
1090	R	39.2	Very low	37.6	Very low	227 Å²	227	143.6 Å²	143.6	86%	0.857	68%	0.682	S	S	*	*	S	Bend	trans	-95.3	117.5	156.9	-79.8	-166.2	175.5	-164.8	0.1	110
1091	P	35	Very low	36.4	Very low	116 Å²	116	142.9 Å²	142.9	75%	0.753	69%	0.692	S	S	*	*			trans	-57	137.7	169	-24	34.6	0	0	0	111.3	E1093	P1091-E1093 PolarHBondContact O-N 3.33Å
1092	K	32.8	Very low	35.2	Very low	192 Å²	192	143 Å²	143	84%	0.835	71%	0.705	S	S	*	*			trans	-84.9	89.2	170.6	-71.5	-176.3	178.6	-179.8	0	109.6	T1094	K1092-T1094 PolarHBondContact O-N 2.98Å
1093	E	31.6	Very low	34.3	Very low	188 Å²	188	149 Å²	149	88%	0.879	73%	0.734	S	S	*	*			trans	-77.8	99.3	166.4	-69.2	-166.6	164.9	0	0	109.7	P1091	P1091-E1093 PolarHBondContact O-N 3.33Å
1094	T	30.2	Very low	33.4	Very low	101 Å²	101	152.7 Å²	152.7	62%	0.62	75%	0.749	S	S	*	*			trans	-133.4	107.2	178.4	53.2	0	0	0	0	111.5	K1092	K1092-T1094 PolarHBondContact O-N 2.98Å
1095	H	27.4	Very low	32.6	Very low	184 Å²	184	158 Å²	158	85%	0.852	77%	0.765	S	S	*	*			trans	75.6	116.1	160.8	-49.9	-67.1	0	0	0	120.8
1096	A	25.6	Very low	32.4	Very low	92 Å²	92	155.3 Å²	155.3	76%	0.76	77%	0.77	S	S	*	*			trans	67.6	160.9	144	0	0	0	0	0	117.9
1097	T	29.7	Very low	31.5	Very low	108 Å²	108	154.9 Å²	154.9	66%	0.663	78%	0.78	S	S	*	*			cis	-156.1	169.2	13.4	-31.3	0	0	0	0	111.2
1098	Y	28	Very low	31	Very low	209 Å²	209	156.1 Å²	156.1	82%	0.82	78%	0.784	S	S	*	*			trans	78	88.2	161.6	-59.9	-67.4	0	0	0	122.4
1099	L	25.6	Very low	30.5	Very low	140 Å²	140	155.1 Å²	155.1	73%	0.733	78%	0.784	S	S	*	*				35.2	143.2	115.4	-80.6	162.7	0	0	0	124.7
1100	Y	25.2	Very low	30.2	Very low	210 Å²	210	155.5 Å²	155.5	82%	0.824	79%	0.785	S	S	*	*			trans	70.8	120.2	162.1	-67.6	-66.8	0	0	0	118.2
1101	S	29.3	Very low	29.9	Very low	105 Å²	105	149 Å²	149	73%	0.734	77%	0.774	S	S	*	*				-158.1	162.9	57.2	55.3	0	0	0	0	114.6
1102	N	25.8	Very low	29.6	Very low	158 Å²	158	147.9 Å²	147.9	85%	0.845	77%	0.77	S	S	*	*			trans	-94.2	142.6	178.5	-66.1	-24	0	0	0	112.2
1103	I	32.3	Very low	29.7	Very low	149 Å²	149	144.7 Å²	144.7	76%	0.764	77%	0.766	S	S	*	*			trans	-136.2	114.3	162.8	-64.7	-173	0	0	0	109.9
1104	Y	26.1	Very low	29.8	Very low	227 Å²	227	146.8 Å²	146.8	89%	0.89	77%	0.767	S	S	*	*			trans	76.6	156.8	169.5	-82.8	-113.4	0	0	0	120.1
1105	Q	28.8	Very low	29.8	Very low	186 Å²	186	150.4 Å²	150.4	87%	0.869	78%	0.777	S	S	*	*			trans	-144.7	169	-159.1	-105.7	-168.9	-33.7	0	0	113
1106	P	38.7	Very low	30.3	Very low	118 Å²	118	146.5 Å²	146.5	77%	0.766	77%	0.768	S	S	*	*			trans	-110.2	-174.4	-165.6	43.6	-38	0	0	0	115.6
1107	S	27.5	Very low	30.4	Very low	106 Å²	106	147.5 Å²	147.5	74%	0.741	77%	0.769	S	S	*	*			trans	-156.4	166	158.7	68.6	0	0	0	0	109.6
1108	T	33.9	Very low	30.6	Very low	121 Å²	121	148.6 Å²	148.6	74%	0.742	78%	0.776	S	S	*	*			cis	-109	-88.1	-6.6	34.5	0	0	0	0	112.7
1109	T	31.4	Very low	30.7	Very low	114 Å²	114	144.5 Å²	144.5	70%	0.699	78%	0.775	S	S	*	*			cis	-152.6	167.5	-6.1	-53.9	0	0	0	0	109.5
1110	Y	30.9	Very low	31.1	Very low	214 Å²	214	143.2 Å²	143.2	84%	0.839	78%	0.777	S	S	*	*			trans	-114.1	161.4	-174.7	-74.4	-103	0	0	0	111.6
1111	S	31.3	Very low	31.3	Very low	90 Å²	90	140.3 Å²	140.3	63%	0.629	78%	0.775	S	S	*	*			cis	-171.9	144.5	-20.5	177.9	0	0	0	0	112.3
1112	S	30.6	Very low	31.3	Very low	94 Å²	94	146.2 Å²	146.2	66%	0.657	78%	0.783	S	S	*	*			trans	58.3	116.8	144.6	59.3	0	0	0	0	124.8
1113	V	33.4	Very low	31.4	Very low	124 Å²	124	142.4 Å²	142.4	75%	0.752	78%	0.781	S	S	*	*				72.8	106.6	127.5	-177.6	0	0	0	0	120.3
1114	Y	34.4	Very low	31	Very low	232 Å²	232	145.3 Å²	145.3	91%	0.91	78%	0.784	S	S	*	*				-153	-179.6	106.6	-112	-79.3	0	0	0	109.9
1115	Q	31	Very low	31.1	Very low	177 Å²	177	142.2 Å²	142.2	83%	0.827	78%	0.783	S	S	*	*			trans	-130.7	-171.7	-161.1	-138.7	-166.9	-21.4	0	0	113.1
1116	P	36.1	Very low	30.9	Very low	103 Å²	103	142.8 Å²	142.8	67%	0.669	78%	0.778	S	S	*	*				-113.4	160.5	-114.8	40.6	-26.6	0	0	0	116.1
1117	S	28.6	Very low	30.4	Very low	112 Å²	112	144.8 Å²	144.8	78%	0.783	78%	0.783	S	S	*	*			trans	-168.4	165.8	149.5	57.2	0	0	0	0	113.8
1118	V	33.2	Very low	30.2	Very low	131 Å²	131	149 Å²	149	79%	0.794	78%	0.784	S	S	*	*			trans	64.9	130.5	166.6	-163.5	0	0	0	0	118.4
1119	P	30.4	Very low	30	Very low	123 Å²	123	149 Å²	149	80%	0.799	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-94.3	131.8	172	35.3	-30.5	0	0	0	112.8
1120	S	34.2	Very low	29.7	Very low	113 Å²	113	153.4 Å²	153.4	79%	0.79	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-98.1	147.5	168	51.5	0	0	0	0	112.4
1121	L	29.7	Very low	29.8	Very low	149 Å²	149	146.5 Å²	146.5	78%	0.78	79%	0.788	S	S	*	*	S	Bend	trans	-68.4	166.3	161.9	-89.2	56.1	0	0	0	109.7
1122	Y	28.5	Very low	29.9	Very low	230 Å²	230	148 Å²	148	90%	0.902	79%	0.793	S	S	*	*			trans	69.5	61.5	-175.9	-60.8	-80.3	0	0	0	115.6	Y1124	Y1122-Y1124 PolarHBondContact O-N 2.9Å
1123	G	28.4	Very low	30.2	Very low	78 Å²	78	149.2 Å²	149.2	80%	0.804	80%	0.799	S	S	*	*			trans	-73.2	79.9	172.5	0	0	0	0	0	114.6
1124	Y	24.6	Very low	30.2	Very low	209 Å²	209	154.6 Å²	154.6	82%	0.82	81%	0.806	S	S	*	*			trans	-126.6	82.2	155.4	-89.8	-69.4	0	0	0	111	Y1122	Y1122-Y1124 PolarHBondContact O-N 2.9Å
1125	N	28.1	Very low	30.2	Very low	162 Å²	162	153.9 Å²	153.9	87%	0.866	80%	0.802	S	S	*	*			trans	-158.5	127	141	-104.1	-40.9	0	0	0	110.4
1126	Y	24.8	Very low	30.4	Very low	198 Å²	198	151.3 Å²	151.3	78%	0.776	79%	0.793	S	S	*	*			trans	-84.3	130.6	172.3	-73.6	-99.8	0	0	0	109.1
1127	N	28.1	Very low	30.1	Very low	160 Å²	160	152.7 Å²	152.7	86%	0.856	80%	0.8	S	S	*	*			trans	-154	111.4	148.6	-101.8	-40.7	0	0	0	111.4
1128	Y	22.9	Very low	30.1	Very low	194 Å²	194	157.7 Å²	157.7	76%	0.761	80%	0.803	S	S	*	*			trans	-81.1	132.7	164	-91.1	-98.7	0	0	0	108.8	Y1130	Y1128-Y1130 HydrophobicContact CD1-CD2 4.16Å; Y1128-Y1130 HydrophobicContact CD1-CE2 4.01Å; Y1128-Y1130 HydrophobicContact CE1-CE2 4.16Å
1129	S	28.6	Very low	30	Very low	122 Å²	122	162.6 Å²	162.6	85%	0.853	81%	0.807	S	S	*	*			trans	-140.5	97	164	-88.1	0	0	0	0	110.8
1130	Y	25.5	Very low	29.9	Very low	207 Å²	207	161.6 Å²	161.6	81%	0.812	80%	0.799	S	S	*	*			trans	-88.4	115.6	167.7	-90.1	-95.4	0	0	0	109.8	Y1128	Y1128-Y1130 HydrophobicContact CD1-CD2 4.16Å; Y1128-Y1130 HydrophobicContact CD1-CE2 4.01Å; Y1128-Y1130 HydrophobicContact CE1-CE2 4.16Å
1131	G	34	Very low	29.7	Very low	68 Å²	68	166.3 Å²	166.3	70%	0.701	80%	0.801	S	S	*	*			trans	-148.7	85.7	169.7	0	0	0	0	0	109.3
1132	T	31.9	Very low	30	Very low	122 Å²	122	164.8 Å²	164.8	75%	0.748	80%	0.803	S	S	*	*				68.5	158	66.4	83.5	0	0	0	0	113.1
1133	P	38.5	Very low	30.3	Very low	120 Å²	120	161.6 Å²	161.6	78%	0.779	80%	0.796	S	S	*	*				-124.2	165.3	-84.7	33.5	-17.4	0	0	0	113.4
1134	R	32.7	Very low	30.4	Very low	237 Å²	237	165.2 Å²	165.2	89%	0.894	79%	0.792	S	S	*	*			trans	-121.2	109.9	175	-85.3	-171	167.1	-172.5	-2.4	114.3
1135	R	35	Very low	30.8	Very low	217 Å²	217	163.3 Å²	163.3	82%	0.819	80%	0.796	S	S	*	*			trans	72	137.2	157.3	-54.5	177.2	84	149.8	-0.2	116.3
1136	N	34.2	Very low	30.9	Very low	122 Å²	122	161.7 Å²	161.7	65%	0.652	79%	0.792	S	S	*	*			cis	-151.9	155.6	-13.3	-119.9	8.2	0	0	0	111.8	Y1138	N1136-Y1138 PolarHBondContact O-N 3.08Å
1137	V	30	Very low	31.2	Very low	132 Å²	132	162.2 Å²	162.2	80%	0.8	79%	0.794	S	S	*	*			trans	-75.6	104.9	172.5	178.1	0	0	0	0	109.8
1138	Y	28.1	Very low	31.4	Very low	218 Å²	218	159.2 Å²	159.2	86%	0.855	78%	0.782	S	S	*	*			trans	-147	127.3	148.7	-80.6	-65.2	0	0	0	109.5	N1136	N1136-Y1138 PolarHBondContact O-N 3.08Å
1139	R	30.9	Very low	32.1	Very low	233 Å²	233	154.5 Å²	154.5	88%	0.879	78%	0.775	S	S	*	*			trans	-134	139.2	174.9	-170.4	-175.5	-169.6	-150.2	3.4	107
1140	T	29.4	Very low	32.1	Very low	103 Å²	103	153.1 Å²	153.1	63%	0.632	77%	0.765	S	S	*	*			trans	67.3	135.6	-163.3	73.4	0	0	0	0	111.8
1141	Y	29.8	Very low	32.2	Very low	211 Å²	211	153.6 Å²	153.6	83%	0.827	77%	0.767	S	S	*	*			cis	-128.4	-180	19	-72.1	-98.5	0	0	0	113.2
1142	S	35.5	Very low	32	Very low	118 Å²	118	160.5 Å²	160.5	83%	0.825	77%	0.772	S	S	*	*			trans	66.8	138.9	165	50.3	0	0	0	0	120.1
1143	Q	35	Very low	31.8	Very low	162 Å²	162	159.1 Å²	159.1	76%	0.757	77%	0.767	S	S	*	*			trans	-59.6	164.7	153.5	-64.7	156.2	-91.1	0	0	109.9
1144	E	31.6	Very low	31.3	Very low	155 Å²	155	164 Å²	164	72%	0.724	77%	0.772	S	S	*	*			cis	-155.7	143.9	-0	-131.9	148.1	-127.1	0	0	107.6
1145	N	32.1	Very low	31	Very low	168 Å²	168	156.7 Å²	156.7	90%	0.898	76%	0.757	S	S	*	*			trans	-172	152.4	142.3	-109.8	-29.8	0	0	0	111.6
1146	V	30.8	Very low	30.6	Very low	129 Å²	129	155.6 Å²	155.6	78%	0.782	75%	0.754	S	S	*	*			trans	-81.7	121.7	-168.7	-178	0	0	0	0	111.5	T1148	V1146-T1148 HydrophobicContact CG1-CG2 4.22Å
1147	Y	30.6	Very low	30.5	Very low	209 Å²	209	155.3 Å²	155.3	82%	0.82	76%	0.759	S	S	*	*			trans	-124.8	115.4	144.2	-163.6	-95.3	0	0	0	107.3	P1149	Y1147-P1149 VanDerWaalsContact O-CD 3.27Å; Y1147-P1149 WeakPolarHBondContact O-CD 3.14Å
1148	T	33.3	Very low	30.7	Very low	97 Å²	97	154.1 Å²	154.1	60%	0.595	75%	0.752	S	S	*	*			trans	-64.1	121.8	176.3	36.3	0	0	0	0	108.5	V1146 S1150	V1146-T1148 HydrophobicContact CG1-CG2 4.22Å; T1148-S1150 PolarHBondContact O-N 3.33Å
1149	P	35.8	Very low	31.2	Very low	95 Å²	95	154.8 Å²	154.8	62%	0.617	75%	0.753	S	S	*	*			trans	-66.8	91.9	155.3	30.2	-29.8	0	0	0	105.2	Y1147 Y1151	Y1147-P1149 VanDerWaalsContact O-CD 3.27Å; Y1147-P1149 WeakPolarHBondContact O-CD 3.14Å; P1149-Y1151 PolarHBondContact O-N 2.79Å
1150	S	28.7	Very low	31.6	Very low	93 Å²	93	148.9 Å²	148.9	65%	0.65	74%	0.743	S	S	*	*			trans	-51.2	117.6	150.5	57.1	0	0	0	0	104.6	T1148 R1152	T1148-S1150 PolarHBondContact O-N 3.33Å; S1150-R1152 PolarHBondContact O-N 2.83Å
1151	Y	28.5	Very low	32.1	Very low	216 Å²	216	152.1 Å²	152.1	85%	0.847	75%	0.745	S	S	*	*			trans	-69.8	72.7	162.9	-71.1	-93.2	0	0	0	105.4	P1149 S1153	P1149-Y1151 PolarHBondContact O-N 2.79Å; Y1151-S1153 PolarHBondContact O-N 2.72Å
1152	R	30.6	Very low	32.5	Very low	214 Å²	214	143.9 Å²	143.9	81%	0.808	72%	0.724	S	S	*	*			trans	-50.4	106.4	152.2	-176.2	178.4	-163.1	167.9	8	102.7	S1150 Y1154	S1150-R1152 PolarHBondContact O-N 2.83Å; R1152-Y1154 VanDerWaalsContact C-N 3.34Å; R1152-Y1154 PolarHBondContact O-N 2.96Å
1153	S	26.9	Very low	32.7	Very low	93 Å²	93	141.1 Å²	141.1	65%	0.65	71%	0.708	S	S	*	*			trans	-54.6	110.1	177.1	39.8	0	0	0	0	105.1	Y1151 S1155	Y1151-S1153 PolarHBondContact O-N 2.72Å; S1153-S1155 PolarHBondContact O-N 3.14Å; S1153-S1155 PolarHBondContact O-OG 2.76Å
1154	Y	28.2	Very low	33.2	Very low	222 Å²	222	140.1 Å²	140.1	87%	0.871	70%	0.702	S	S	*	*			trans	-62.9	77.6	141.9	-71.4	-85.1	0	0	0	104.7	R1152 Y1156	R1152-Y1154 VanDerWaalsContact C-N 3.34Å; R1152-Y1154 PolarHBondContact O-N 2.96Å; Y1154-Y1156 PolarHBondContact O-N 2.86Å
1155	S	26.6	Very low	33.7	Very low	83 Å²	83	136.3 Å²	136.3	58%	0.58	69%	0.686	S	S	*	*			trans	-38.9	123.3	130.5	46.2	0	0	0	0	105.2	S1153	S1153-S1155 PolarHBondContact O-N 3.14Å; S1153-S1155 PolarHBondContact O-OG 2.76Å
1156	Y	25.5	Very low	34.4	Very low	194 Å²	194	136 Å²	136	76%	0.761	68%	0.677	S	S	*	*			trans	-43.9	144.7	152.6	-67	-91.3	0	0	0	106.6	Y1154 T1158	Y1154-Y1156 PolarHBondContact O-N 2.86Å; Y1156-T1158 PolarHBondContact O-N 2.94Å
1157	P	32.3	Very low	35.4	Very low	116 Å²	116	134.1 Å²	134.1	75%	0.753	66%	0.661	S	S	*	*			trans	-55.9	96.7	151.1	26.7	-30.9	0	0	0	105.1	R1159	P1157-R1159 PolarHBondContact O-N 3.37Å
1158	T	35.6	Very low	36	Very low	107 Å²	107	131.9 Å²	131.9	66%	0.656	65%	0.653	S	S	*	*			trans	-59.6	86.7	163.1	36.5	0	0	0	0	102.8	Y1156 T1160	Y1156-T1158 PolarHBondContact O-N 2.94Å; T1158-T1160 WeakPolarHBondContact O-CA 3.47Å; T1158-T1160 PolarHBondContact O-N 3.45Å
1159	R	38	Very low	36.7	Very low	232 Å²	232	132 Å²	132	88%	0.875	65%	0.649	S	S	*	*			trans	-45.3	109.3	-166.4	-105.5	-174.4	165.3	-154.7	-2.8	106.5	P1157 Y1161	P1157-R1159 PolarHBondContact O-N 3.37Å; R1159-Y1161 PolarHBondContact O-N 2.6Å
1160	T	38.7	Very low	37.2	Very low	110 Å²	110	134.6 Å²	134.6	68%	0.675	65%	0.648	S	S	*	*			trans	-55.8	118.3	-144.4	25.6	0	0	0	0	109.5	T1158 G1162 A1163	T1158-T1160 WeakPolarHBondContact O-CA 3.47Å; T1158-T1160 PolarHBondContact O-N 3.45Å; T1160-G1162 PolarHBondContact O-N 2.66Å; T1160-A1163 PolarHBondContact O-N 3.41Å
1161	Y	39.7	Very low	38	Very low	171 Å²	171	135.9 Å²	135.9	67%	0.671	64%	0.639	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.8	-23.1	172.5	-90.4	-76.9	0	0	0	109.7	R1159 A1163 F1164 N1165	R1159-Y1161 PolarHBondContact O-N 2.6Å; Y1161-A1163 CarbonylContact O-C 3.57Å; Y1161-A1163 PolarHBondContact O-N 3.18Å; Y1161-F1164 HydrophobicContact CD1-CB 4.47Å; Y1161-F1164 CarbonylContact O-C 3.27Å; Y1161-F1164 PolarHBondContact O-N 2.92Å; Y1161-N1165 VanDerWaalsContact O-CB 3.29Å; Y1161-N1165 WeakPolarHBondContact O-CB 3.26Å; Y1161-N1165 VanDerWaalsContact O-CG 3.27Å; Y1161-N1165 PolarHBondContact O-N 2.94Å; Y1161-N1165 PolarHBondContact O-OD1 2.98Å
1162	G	39.4	Very low	39.2	Very low	37 Å²	37	128.7 Å²	128.7	38%	0.381	62%	0.618	S	S	.	*	H	α-helix	trans	-45.8	-14.2	162.1	0	0	0	0	0	118.4	T1160 K1166	T1160-G1162 PolarHBondContact O-N 2.66Å; G1162-K1166 WeakPolarHBondContact O-CB 3.42Å; G1162-K1166 WeakPolarHBondContact O-CD 3.4Å; G1162-K1166 WeakPolarHBondContact O-CG 3.29Å; G1162-K1166 PolarHBondContact O-N 3.25Å
1163	A	39.4	Very low	40.3	Very low	60 Å²	60	120.5 Å²	120.5	50%	0.496	59%	0.594	S	S	.	*	H	α-helix	trans	-82.8	-47.1	165.8	0	0	0	0	0	112.4	T1160 Y1161 I1167	T1160-A1163 PolarHBondContact O-N 3.41Å; Y1161-A1163 CarbonylContact O-C 3.57Å; Y1161-A1163 PolarHBondContact O-N 3.18Å; A1163-I1167 WeakPolarHBondContact O-CG1 3.24Å
1164	F	44.1	Very low	41.5	Very low	142 Å²	142	116.8 Å²	116.8	62%	0.623	57%	0.567	S	S	*	*	H	α-helix	trans	-74.9	-35.5	175.9	-94.2	-89.2	0	0	0	112.9	Y1161 I1167 Y1168	Y1161-F1164 HydrophobicContact CD1-CB 4.47Å; Y1161-F1164 CarbonylContact O-C 3.27Å; Y1161-F1164 PolarHBondContact O-N 2.92Å; F1164-I1167 CarbonylContact O-C 3.55Å; F1164-I1167 WeakPolarHBondContact O-CB 3.44Å; F1164-I1167 PolarHBondContact O-N 3.08Å; F1164-Y1168 PolarHBondContact O-N 3.39Å
1165	N	43.2	Very low	42.7	Very low	75 Å²	75	113.2 Å²	113.2	40%	0.401	55%	0.552	S	S	.	*	H	α-helix	trans	-66.6	-44.7	175.6	-66.5	17.9	0	0	0	110.2	Y1161 I1167 Y1168 D1169	Y1161-N1165 VanDerWaalsContact O-CB 3.29Å; Y1161-N1165 WeakPolarHBondContact O-CB 3.26Å; Y1161-N1165 VanDerWaalsContact O-CG 3.27Å; Y1161-N1165 PolarHBondContact O-N 2.94Å; Y1161-N1165 PolarHBondContact O-OD1 2.98Å; N1165-I1167 PolarHBondContact O-N 2.96Å; N1165-I1167 VanDerWaalsContact O-N 3.14Å; N1165-Y1168 CarbonylContact O-C 3.28Å; N1165-Y1168 WeakPolarHBondContact O-CA 3.07Å; N1165-Y1168 PolarHBondContact O-N 3.43Å; N1165-D1169 VanDerWaalsContact O-CB 3.3Å; N1165-D1169 WeakPolarHBondContact O-CB 3.22Å; N1165-D1169 PolarHBondContact O-N 2.58Å; N1165-D1169 VanDerWaalsContact O-OD2 3.09Å
1166	K	45.7	Very low	43.6	Very low	160 Å²	160	113.5 Å²	113.5	70%	0.696	55%	0.547	S	S	*	.	H	α-helix	trans	-57.8	-31.4	172.5	-81.5	-179	179.5	-171.5	0	112.9	G1162 Y1170	G1162-K1166 WeakPolarHBondContact O-CB 3.42Å; G1162-K1166 WeakPolarHBondContact O-CD 3.4Å; G1162-K1166 WeakPolarHBondContact O-CG 3.29Å; G1162-K1166 PolarHBondContact O-N 3.25Å; K1166-Y1170 VanDerWaalsContact O-CB 3.22Å; K1166-Y1170 WeakPolarHBondContact O-CB 3.41Å; K1166-Y1170 PolarHBondContact O-N 3.5Å; K1166-Y1170 VanDerWaalsContact O-N 3.13Å
1167	I	52.3	Low	44.7	Very low	90 Å²	90	109.7 Å²	109.7	46%	0.462	53%	0.531	S	S	.	.	H	α-helix	trans	-73.9	-43.8	172.7	-66	168.3	0	0	0	110.8	A1163 F1164 N1165 Y1170 Y1171	A1163-I1167 WeakPolarHBondContact O-CG1 3.24Å; F1164-I1167 CarbonylContact O-C 3.55Å; F1164-I1167 WeakPolarHBondContact O-CB 3.44Å; F1164-I1167 PolarHBondContact O-N 3.08Å; N1165-I1167 PolarHBondContact O-N 2.96Å; N1165-I1167 VanDerWaalsContact O-N 3.14Å; I1167-Y1170 PolarHBondContact O-N 3.18Å; I1167-Y1171 HydrophobicContact CG2-CD2 3.69Å; I1167-Y1171 HydrophobicContact CG2-CE2 3.77Å; I1167-Y1171 VanDerWaalsContact O-CD2 3.29Å; I1167-Y1171 WeakPolarHBondContact O-CD2 3.12Å; I1167-Y1171 PolarHBondContact O-N 2.82Å
1168	Y	43.5	Very low	45.1	Very low	163 Å²	163	109 Å²	109	64%	0.639	51%	0.514	S	S	*	.	H	α-helix	trans	-64.6	-43.1	176.1	-108.1	-92.4	0	0	0	113.4	F1164 N1165 Y1170 Y1171 T1172	F1164-Y1168 PolarHBondContact O-N 3.39Å; N1165-Y1168 CarbonylContact O-C 3.28Å; N1165-Y1168 WeakPolarHBondContact O-CA 3.07Å; N1165-Y1168 PolarHBondContact O-N 3.43Å; Y1168-Y1170 VanDerWaalsContact C-N 3.34Å; Y1168-Y1171 PolarHBondContact O-N 3.48Å; Y1168-T1172 WeakPolarHBondContact O-CB 3.42Å; Y1168-T1172 WeakPolarHBondContact O-CG2 3.35Å; Y1168-T1172 PolarHBondContact O-N 3.14Å; Y1168-T1172 PolarHBondContact O-OG1 2.95Å
1169	D	47.2	Very low	45.8	Very low	98 Å²	98	108.9 Å²	108.9	52%	0.524	51%	0.514	S	S	.	.	H	α-helix	trans	-63.3	-41.4	175	-61.1	-28.1	0	0	0	109.9	N1165 T1172 S1173	N1165-D1169 VanDerWaalsContact O-CB 3.3Å; N1165-D1169 WeakPolarHBondContact O-CB 3.22Å; N1165-D1169 PolarHBondContact O-N 2.58Å; N1165-D1169 VanDerWaalsContact O-OD2 3.09Å; D1169-T1172 WeakPolarHBondContact CA-OG1 3.42Å; D1169-T1172 PolarHBondContact O-OG1 2.67Å; D1169-S1173 WeakPolarHBondContact O-CB 3.08Å; D1169-S1173 PolarHBondContact O-N 2.74Å; D1169-S1173 PolarHBondContact O-OG 2.9Å
1170	Y	46.3	Very low	46.1	Very low	151 Å²	151	104.8 Å²	104.8	59%	0.592	51%	0.505	S	S	*	.	H	α-helix	trans	-61.8	-55.4	172.7	-174.1	-96.6	0	0	0	111.2	K1166 I1167 Y1168 T1172 S1173 V1174	K1166-Y1170 VanDerWaalsContact O-CB 3.22Å; K1166-Y1170 WeakPolarHBondContact O-CB 3.41Å; K1166-Y1170 PolarHBondContact O-N 3.5Å; K1166-Y1170 VanDerWaalsContact O-N 3.13Å; I1167-Y1170 PolarHBondContact O-N 3.18Å; Y1168-Y1170 VanDerWaalsContact C-N 3.34Å; Y1170-T1172 PolarHBondContact O-N 2.9Å; Y1170-S1173 PolarHBondContact O-N 2.72Å; Y1170-S1173 PolarHBondContact O-OG 2.86Å; Y1170-V1174 HydrophobicContact CD1-CG2 4.36Å; Y1170-V1174 HydrophobicContact CE1-CG2 4.1Å; Y1170-V1174 VanDerWaalsContact O-CG2 3.32Å; Y1170-V1174 WeakPolarHBondContact O-CG2 3.39Å; Y1170-V1174 PolarHBondContact O-N 2.72Å
1171	Y	46.1	Very low	46.1	Very low	119 Å²	119	102.8 Å²	102.8	47%	0.467	50%	0.495	S	S	.	.	H	α-helix	trans	-61	-38.3	-179.9	-88	-69.7	0	0	0	113.3	I1167 Y1168 V1174 R1175	I1167-Y1171 HydrophobicContact CG2-CD2 3.69Å; I1167-Y1171 HydrophobicContact CG2-CE2 3.77Å; I1167-Y1171 VanDerWaalsContact O-CD2 3.29Å; I1167-Y1171 WeakPolarHBondContact O-CD2 3.12Å; I1167-Y1171 PolarHBondContact O-N 2.82Å; Y1168-Y1171 PolarHBondContact O-N 3.48Å; Y1171-V1174 PolarHBondContact O-N 3.23Å; Y1171-R1175 WeakPolarHBondContact O-CB 3.06Å; Y1171-R1175 PolarHBondContact O-N 2.87Å
1172	T	53.4	Low	46.1	Very low	65 Å²	65	99.1 Å²	99.1	40%	0.399	49%	0.494	S	S	.	.	H	α-helix	trans	-72.2	-39.2	175.9	52.1	0	0	0	0	112.2	Y1168 D1169 Y1170 V1174 R1175 N1176	Y1168-T1172 WeakPolarHBondContact O-CB 3.42Å; Y1168-T1172 WeakPolarHBondContact O-CG2 3.35Å; Y1168-T1172 PolarHBondContact O-N 3.14Å; Y1168-T1172 PolarHBondContact O-OG1 2.95Å; D1169-T1172 WeakPolarHBondContact CA-OG1 3.42Å; D1169-T1172 PolarHBondContact O-OG1 2.67Å; Y1170-T1172 PolarHBondContact O-N 2.9Å; T1172-V1174 PolarHBondContact O-N 3.1Å; T1172-R1175 PolarHBondContact O-N 2.71Å; T1172-N1176 WeakPolarHBondContact O-CB 3.29Å; T1172-N1176 VanDerWaalsContact O-CG 3.29Å; T1172-N1176 PolarHBondContact O-N 2.85Å
1173	S	53.4	Low	46	Very low	42 Å²	42	106.9 Å²	106.9	29%	0.294	52%	0.518	S	S	.	.	H	α-helix	trans	-63.3	-30.1	173.4	81.8	0	0	0	0	113	D1169 Y1170 R1177	D1169-S1173 WeakPolarHBondContact O-CB 3.08Å; D1169-S1173 PolarHBondContact O-N 2.74Å; D1169-S1173 PolarHBondContact O-OG 2.9Å; Y1170-S1173 PolarHBondContact O-N 2.72Å; Y1170-S1173 PolarHBondContact O-OG 2.86Å; S1173-R1177 WeakPolarHBondContact O-CG 3.38Å; S1173-R1177 PolarHBondContact O-N 2.95Å; S1173-R1177 PolarHBondContact O-NE 2.7Å; S1173-R1177 PolarHBondContact OG-NH2 2.75Å
1174	V	54.1	Low	46	Very low	16 Å²	16	111.8 Å²	111.8	10%	0.097	54%	0.535	C	S	.	.	H	α-helix	trans	-78.2	-46.3	176.4	169.3	0	0	0	0	110.3	L519 Y1170 Y1171 T1172 N1176 R1177 Y1178	L519-V1174 WeakPolarHBondContact O-CG1 3.08Å; Y1170-V1174 HydrophobicContact CD1-CG2 4.36Å; Y1170-V1174 HydrophobicContact CE1-CG2 4.1Å; Y1170-V1174 VanDerWaalsContact O-CG2 3.32Å; Y1170-V1174 WeakPolarHBondContact O-CG2 3.39Å; Y1170-V1174 PolarHBondContact O-N 2.72Å; Y1171-V1174 PolarHBondContact O-N 3.23Å; T1172-V1174 PolarHBondContact O-N 3.1Å; V1174-N1176 VanDerWaalsContact C-N 3.33Å; V1174-N1176 PolarHBondContact O-N 3.46Å; V1174-R1177 PolarHBondContact O-N 2.84Å; V1174-Y1178 PolarHBondContact O-N 2.74Å
1175	R	51.7	Low	45.6	Very low	147 Å²	147	107.6 Å²	107.6	56%	0.555	52%	0.523	S	S	*	.	H	α-helix	trans	-61.9	-37.9	177.3	-156.4	175	-161.8	171.4	7.8	112.3	Y1171 T1172 Y1178 T1179	Y1171-R1175 WeakPolarHBondContact O-CB 3.06Å; Y1171-R1175 PolarHBondContact O-N 2.87Å; T1172-R1175 PolarHBondContact O-N 2.71Å; R1175-Y1178 WeakPolarHBondContact O-CB 3.22Å; R1175-Y1178 PolarHBondContact O-N 3.07Å; R1175-T1179 PolarHBondContact O-N 2.95Å; R1175-T1179 PolarHBondContact O-OG1 3.18Å
1176	N	46.9	Very low	45.4	Very low	88 Å²	88	108.9 Å²	108.9	47%	0.471	54%	0.536	S	S	.	.	H	α-helix	trans	-69.6	-33.1	176.1	-73.1	-12.9	0	0	0	113	T1172 V1174 Y1178 T1179 Q1180	T1172-N1176 WeakPolarHBondContact O-CB 3.29Å; T1172-N1176 VanDerWaalsContact O-CG 3.29Å; T1172-N1176 PolarHBondContact O-N 2.85Å; V1174-N1176 VanDerWaalsContact C-N 3.33Å; V1174-N1176 PolarHBondContact O-N 3.46Å; N1176-Y1178 PolarHBondContact O-N 2.89Å; N1176-T1179 PolarHBondContact O-N 3.03Å; N1176-T1179 PolarHBondContact O-OG1 2.92Å; N1176-Q1180 WeakPolarHBondContact O-CB 3.16Å; N1176-Q1180 WeakPolarHBondContact O-CG 3.38Å; N1176-Q1180 PolarHBondContact O-N 2.85Å
1177	R	47.8	Very low	45	Very low	115 Å²	115	109.4 Å²	109.4	43%	0.434	54%	0.538	S	S	.	.	H	α-helix	trans	-64.9	-27.5	171.4	-82	177.6	-87.1	-170.6	-4.5	112.4	S1173 V1174 S1181	S1173-R1177 WeakPolarHBondContact O-CG 3.38Å; S1173-R1177 PolarHBondContact O-N 2.95Å; S1173-R1177 PolarHBondContact O-NE 2.7Å; S1173-R1177 PolarHBondContact OG-NH2 2.75Å; V1174-R1177 PolarHBondContact O-N 2.84Å; R1177-S1181 WeakPolarHBondContact O-CB 3.34Å; R1177-S1181 PolarHBondContact O-N 2.8Å; R1177-S1181 PolarHBondContact O-OG 2.65Å
1178	Y	40.5	Very low	44.2	Very low	101 Å²	101	114.4 Å²	114.4	40%	0.396	55%	0.551	S	S	.	*	H	α-helix	trans	-76.9	-32.9	175.4	-96.9	-107.6	0	0	0	114.4	T518 L519 S520 V1174 R1175 N1176	T518-Y1178 WeakPolarHBondContact CA-OH 3.37Å; L519-Y1178 VanDerWaalsContact N-CE2 3.32Å; S520-Y1178 VanDerWaalsContact N-CE1 3.35Å; S520-Y1178 VanDerWaalsContact N-CZ 3.3Å; V1174-Y1178 PolarHBondContact O-N 2.74Å; R1175-Y1178 WeakPolarHBondContact O-CB 3.22Å; R1175-Y1178 PolarHBondContact O-N 3.07Å; N1176-Y1178 PolarHBondContact O-N 2.89Å
1179	T	51.2	Low	44	Very low	105 Å²	105	118 Å²	118	64%	0.644	56%	0.564	S	S	*	*	H	α-helix	trans	-88	-12.1	180	53.3	0	0	0	0	113.9	R1175 N1176	R1175-T1179 PolarHBondContact O-N 2.95Å; R1175-T1179 PolarHBondContact O-OG1 3.18Å; N1176-T1179 PolarHBondContact O-N 3.03Å; N1176-T1179 PolarHBondContact O-OG1 2.92Å
1180	Q	43.9	Very low	43.7	Very low	146 Å²	146	120 Å²	120	68%	0.682	57%	0.573	S	S	*	*	H	α-helix	trans	-108.9	-14.7	-176.9	-65.4	-175.9	-10	0	0	115.2	N1176 S1182	N1176-Q1180 WeakPolarHBondContact O-CB 3.16Å; N1176-Q1180 WeakPolarHBondContact O-CG 3.38Å; N1176-Q1180 PolarHBondContact O-N 2.85Å; Q1180-S1182 PolarHBondContact O-N 2.77Å; Q1180-S1182 PolarHBondContact O-OG 2.67Å; Q1180-S1182 VanDerWaalsContact O-OG 3.11Å
1181	S	38.5	Very low	43.1	Very low	67 Å²	67	123.3 Å²	123.3	47%	0.469	58%	0.584	S	S	.	*			trans	-74.4	65.7	-178.9	43.4	0	0	0	0	113.5	R1177 F1183	R1177-S1181 WeakPolarHBondContact O-CB 3.34Å; R1177-S1181 PolarHBondContact O-N 2.8Å; R1177-S1181 PolarHBondContact O-OG 2.65Å; S1181-F1183 PolarHBondContact O-N 3.47Å
1182	S	40	Very low	42.4	Very low	94 Å²	94	121.6 Å²	121.6	66%	0.657	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65.4	14.5	-168.4	-59.2	0	0	0	0	116.9	Q1180	Q1180-S1182 PolarHBondContact O-N 2.77Å; Q1180-S1182 PolarHBondContact O-OG 2.67Å; Q1180-S1182 VanDerWaalsContact O-OG 3.11Å
1183	F	37.6	Very low	41.6	Very low	200 Å²	200	127.5 Å²	127.5	88%	0.877	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.7	-12.3	-169.4	-79	-84.4	0	0	0	115.7	S1181 S1185	S1181-F1183 PolarHBondContact O-N 3.47Å; F1183-S1185 PolarHBondContact O-N 2.79Å
1184	L	39.3	Very low	40.8	Very low	164 Å²	164	136.6 Å²	136.6	86%	0.859	64%	0.64	S	S	*	*			trans	-91	75.2	175.3	-79.4	165.1	0	0	0	111.6
1185	S	34.8	Very low	40	Very low	53 Å²	53	146.4 Å²	146.4	37%	0.371	68%	0.675	S	S	.	*			trans	-142.2	81.7	178.3	160.2	0	0	0	0	111.9	F1183 F1187 R1188	F1183-S1185 PolarHBondContact O-N 2.79Å; S1185-F1187 PolarHBondContact O-N 3.05Å; S1185-R1188 PolarHBondContact O-N 3.4Å; S1185-R1188 WeakPolarHBondContact OG-CG 3.34Å
1186	P	38.2	Very low	39.7	Very low	103 Å²	103	145.2 Å²	145.2	67%	0.669	69%	0.686	S	S	*	*	G	3₁₀ helix	trans	-58.5	-35.6	172.9	-23	34.2	0	0	0	112.7	R1188 R1189	P1186-R1188 PolarHBondContact O-N 3.42Å; P1186-R1189 PolarHBondContact O-N 2.65Å
1187	F	38.1	Very low	39.3	Very low	170 Å²	170	151.8 Å²	151.8	75%	0.746	71%	0.705	S	S	*	*	G	3₁₀ helix	trans	-69	-3.6	-174.1	-64.2	-71.9	0	0	0	115.6	S1185 R1189	S1185-F1187 PolarHBondContact O-N 3.05Å; F1187-R1189 PolarHBondContact O-N 2.8Å
1188	R	36.6	Very low	38.9	Very low	196 Å²	196	154.2 Å²	154.2	74%	0.74	72%	0.718	S	S	*	*	G	3₁₀ helix	trans	-74.4	-1	172.4	-89	178.6	177.6	-169.7	0.3	114.5	S1185 P1186	S1185-R1188 PolarHBondContact O-N 3.4Å; S1185-R1188 WeakPolarHBondContact OG-CG 3.34Å; P1186-R1188 PolarHBondContact O-N 3.42Å
1189	R	38	Very low	38.9	Very low	238 Å²	238	157.7 Å²	157.7	90%	0.898	74%	0.736	S	S	*	*	G	3₁₀ helix	trans	-103.2	-5.8	175.5	-85	-175.1	176	162	1.6	116.6	P1186 F1187 R1191	P1186-R1189 PolarHBondContact O-N 2.65Å; F1187-R1189 PolarHBondContact O-N 2.8Å; R1189-R1191 PolarHBondContact O-N 2.75Å
1190	I	42.2	Very low	38.2	Very low	140 Å²	140	157.7 Å²	157.7	72%	0.718	73%	0.732	S	S	*	*			trans	-89.2	78.4	168.4	-51.9	-178.6	0	0	0	108.6
1191	R	33.7	Very low	38	Very low	221 Å²	221	157.1 Å²	157.1	83%	0.834	73%	0.733	S	S	*	*			trans	-122.9	69.2	179	-96.3	-174.3	167.9	174.2	-3.9	111.9	R1189	R1189-R1191 PolarHBondContact O-N 2.75Å
1192	S	31	Very low	38.1	Very low	83 Å²	83	158.5 Å²	158.5	58%	0.58	74%	0.743	S	S	*	*			trans	-170.6	163.6	159.5	42.4	0	0	0	0	109.4
1193	F	36.3	Very low	38.1	Very low	188 Å²	188	161.6 Å²	161.6	83%	0.825	75%	0.752	S	S	*	*	S	Bend	trans	63.4	46.3	173.5	-47.9	-72.9	0	0	0	117.8
1194	Y	36	Very low	38.1	Very low	233 Å²	233	164.3 Å²	164.3	91%	0.914	76%	0.764	S	S	*	*				-159.2	138.7	117.2	-106	-74.8	0	0	0	109.1
1195	R	38.3	Very low	38	Very low	223 Å²	223	164.3 Å²	164.3	84%	0.842	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-75.6	144.2	175.4	-75.8	-179.7	171.4	178.2	-3.6	109.4	W1197	R1195-W1197 PolarHBondContact O-N 3.17Å
1196	P	44.1	Very low	38.2	Very low	122 Å²	122	170.2 Å²	170.2	79%	0.792	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-58.9	131.5	153.8	28.8	-32.4	0	0	0	107.8	K1198	P1196-K1198 PolarHBondContact O-N 2.77Å
1197	W	39.5	Very low	38.2	Very low	225 Å²	225	173.9 Å²	173.9	85%	0.852	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-63.8	121.8	165.3	-89.7	36.1	0	0	0	107.7	R1195	R1195-W1197 PolarHBondContact O-N 3.17Å
1198	K	38.4	Very low	38.2	Very low	166 Å²	166	174.1 Å²	174.1	72%	0.722	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-68	126	149.3	-71.1	-170.2	170.1	-161.8	0	106.2	P1196 D1200	P1196-K1198 PolarHBondContact O-N 2.77Å; K1198-D1200 WeakPolarHBondContact CD-OD1 3.42Å
1199	F	40.5	Very low	38.3	Very low	175 Å²	175	172.8 Å²	172.8	77%	0.768	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-72.6	124.2	136.1	-87.6	-95.1	0	0	0	105.1
1200	D	37.4	Very low	38.3	Very low	105 Å²	105	168.4 Å²	168.4	56%	0.561	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-79.1	123.1	168.9	-68.4	-49	0	0	0	107	K1198 S1202	K1198-D1200 WeakPolarHBondContact CD-OD1 3.42Å; D1200-S1202 PolarHBondContact O-N 2.92Å
1201	N	38.9	Very low	38.1	Very low	133 Å²	133	170.4 Å²	170.4	71%	0.711	79%	0.788	S	S	*	*	S	Bend	trans	-73.1	65.7	169.1	-72.1	24.9	0	0	0	108.8
1202	S	40.7	Very low	38.4	Very low	97 Å²	97	166.5 Å²	166.5	68%	0.678	79%	0.785	S	S	*	*	S	Bend	trans	-130.5	27.6	172.6	71.4	0	0	0	0	110.2	D1200	D1200-S1202 PolarHBondContact O-N 2.92Å
1203	L	40.2	Very low	39	Very low	159 Å²	159	173.5 Å²	173.5	83%	0.832	80%	0.802	S	S	*	*			trans	-153.6	11.4	-177.2	-108	164.3	0	0	0	111.6
1204	F	38.2	Very low	39.3	Very low	256 Å²	256	172.2 Å²	172.2	100%	1.123	80%	0.8	S	S	*	*			trans	-124.1	0	154.1	-80.8	-82.4	0	0	0	104.7

Retrieved 1,204 of 1,204 residues in 107 ms (Link to these results)

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