A0A087XAM3_POEFO Loading...

Zinc finger transcription factor Trps1

AlphaFold DB , UniProt , Accession A0A087XAM3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 1,213 aa.

						>A0A087XAM3_POEFO|A0A087XAM3
MVRKKNPPIRSVGGEEEEEEEGKKPTGEEEDEGDEEERVAAEADRINRPSEPESSERIRGNEEQDEEDEAETPRVLSRQEGREESTSDTPALSSSPSPKLQDFKCNVCGYGYYGNDPADLVKHFRKYHLGLHNRTRQDAALDTQILALHNMVPQHTNLGQGARSQTKELGKTRADGQNQQQRTVMMNGAYDIQVTLGGTLIGIGRKTSDCQGNTKYFRCKFCNFTYMGSNSSELEQHFLSSHPNKVKSPPTTPLLATNSLATHDSQLKGRSVMLDAGERVAVRAEDDSVVGYFIPVRAGSDSSGWTGEAGRGPIQACYWCKLCSWSCEWSEGSAKLLEHYEQRHKAPAGVAMSPNSSGLRDENVGKVHLRDPKSGDSEAVVTSYNCQLCDFRYSMAHSADVIIVAPLLLHYQHNHSIHRCCIQHCMYCPQGLCQPQKHLGEVSHPFACRKPTCSKCCSNVISGSTFHPSNPAHPVVAQGVTHLCDQCAFATTDIDVLLQHYESCHSMIKLKGAPPQVKAEEETEGDKEGGRGGAGETEHTCTKCSFVTQVEEELFRHYRRVHACCRCRHCDFTAPDSSALLDHFNSAHCQDASPSLGSQPTLMTPSLALSANGCSAPSTLAIKEESKGDLRLLYSLAPPEGRLAEGGREEPGGVVKSEGVEEKEREREKGWALGETRGPGERGGEQAHGLLWVPKERMGPERVAERGAGGGSPSLFPSPLSLSFVSANHEGSQQKRGMASPGMVYLADTKPFLGDTKTFLGGGRPGGATAGGGGGGEKQSQIPSQQKEESQSLLRRRRGSGVFCANCLTTKTSLWRKNANGGYVCNACGLYQKLHSTPRPLNIIKQNNGEQIIRRRTRKRLNPDTLSSENPAPKQQRITSEERLNGEELDTRSCPSVKSQQPSPRSRSPRSTQAFLANQTLEIHRRMPPLLLPSHPSPGSMVAESNGGITDGGLTSKLEVGKGGGSERGSPIEKYMRPSKPSSYSPPGSPIEKYQYPLLPLPLPLTLSPDLTPESDWLRFWTKYKMAATSGVPGSISNHQQSYTVPYCASPYSPLPPPPAPSHYPPPPPHHAQTLSSASPENDTPLDLAIRQRDTSNANMYVSNGSERKRKESPQSEKEREEMAEEGKRESSIVSNCSKADAATQDDLANRCTHCGIYFLDEVMYALHMSCHGDKEPYQCGFCLHVCADRYDFTTHIQRGLHKTLPPPPPPQQ
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.5	Very low	36.2	Very low	221 Å²	221	159.2 Å²	159.2	100%	1.089	79%	0.788	S	S	*	*				0	134.4	0	-79.6	55	170.5	0	0	107.4
2	V	30.1	Very low	35.7	Very low	114 Å²	114	158.3 Å²	158.3	69%	0.691	80%	0.797	S	S	*	*				68.9	121.8	57.8	170.1	0	0	0	0	110.1
3	R	30.8	Very low	35.1	Very low	205 Å²	205	150.9 Å²	150.9	77%	0.774	79%	0.785	S	S	*	*			cis	-167.8	149.2	-0.9	-112	177.5	-165.6	149.9	-2.6	110.6
4	K	32.8	Very low	34.9	Very low	180 Å²	180	144.9 Å²	144.9	78%	0.783	78%	0.778	S	S	*	*			trans	58.2	156.5	140.3	-69	-172.8	174.3	-171.6	0	123
5	K	34.7	Very low	34.7	Very low	196 Å²	196	145.7 Å²	145.7	85%	0.852	78%	0.775	S	S	*	*			trans	96.8	97.6	142.2	-90.5	-179.1	173.5	-167.7	0	121.7
6	N	30.4	Very low	34.6	Very low	151 Å²	151	146 Å²	146	81%	0.807	77%	0.77	S	S	*	*				-53.1	174.9	129.3	-93.6	-8.7	0	0	0	113.3
7	P	62	Low	34.7	Very low	103 Å²	103	146.6 Å²	146.6	67%	0.669	77%	0.768	S	S	*	*			cis	-125.4	-157.8	-19.5	35.8	-14.7	0	0	0	110.4
8	P	49.8	Very low	34.6	Very low	112 Å²	112	147.6 Å²	147.6	73%	0.727	77%	0.768	S	S	*	*				-146.5	136.9	77.6	42.6	-24.2	0	0	0	114.9
9	I	32.3	Very low	34.5	Very low	141 Å²	141	148.5 Å²	148.5	72%	0.723	77%	0.768	S	S	*	*				97.6	111.9	91.8	-74.5	175.6	0	0	0	116.5
10	R	32	Very low	34.5	Very low	231 Å²	231	148.8 Å²	148.8	87%	0.872	77%	0.766	S	S	*	*			trans	66.2	156.5	138.9	-72.1	-173.1	162.5	176	-7.4	123
11	S	33.4	Very low	34.3	Very low	97 Å²	97	147.9 Å²	147.9	68%	0.678	76%	0.758	S	S	*	*			cis	178.7	174.9	-28.3	-97.9	0	0	0	0	112
12	V	30.7	Very low	34.3	Very low	149 Å²	149	140.4 Å²	140.4	90%	0.903	74%	0.738	S	S	*	*			trans	83.5	137.1	160.7	-163.1	0	0	0	0	114.8
13	G	27.6	Very low	34.2	Very low	62 Å²	62	142.8 Å²	142.8	64%	0.639	74%	0.739	S	S	*	*			cis	-143.7	169.8	-7.3	0	0	0	0	0	108.8
14	G	32.2	Very low	34.2	Very low	66 Å²	66	141.8 Å²	141.8	68%	0.68	74%	0.74	S	S	*	*				91.2	136.7	59.5	0	0	0	0	0	108.6
15	E	32	Very low	34.9	Very low	157 Å²	157	138.2 Å²	138.2	73%	0.734	74%	0.735	S	S	*	*			cis	-155.3	139.1	4	-95.2	117.4	-143	0	0	107.3
16	E	34.1	Very low	34.7	Very low	151 Å²	151	133.8 Å²	133.8	71%	0.706	73%	0.725	S	S	*	*				86.5	119.7	109.5	-67	170.5	179.2	0	0	113.4
17	E	35.1	Very low	34.7	Very low	157 Å²	157	129.3 Å²	129.3	73%	0.734	72%	0.715	S	S	*	*				82.5	161	95.3	-67	168.3	170.9	0	0	112.1
18	E	33.1	Very low	33.4	Very low	163 Å²	163	130.8 Å²	130.8	76%	0.762	71%	0.712	S	S	*	*			cis	-148.6	-151.4	11.5	-149.5	166.2	-155	0	0	112.1
19	E	32.6	Very low	32.7	Very low	165 Å²	165	133.8 Å²	133.8	77%	0.771	72%	0.717	S	S	*	*			trans	-85	-155.9	-168.9	-56	174.7	126.9	0	0	112.7
20	E	33.9	Very low	33	Very low	155 Å²	155	135.4 Å²	135.4	72%	0.724	72%	0.721	S	S	*	*			cis	-159.9	178.6	6.3	-146.6	-154.8	150.8	0	0	110.8
21	E	31.2	Very low	33.1	Very low	130 Å²	130	131.5 Å²	131.5	61%	0.607	72%	0.718	S	S	*	*			trans	49.2	149.5	159.9	-76.3	-129.2	92.7	0	0	122	K23	E21-K23 IonicContact OE1-NZ 3.19Å; E21-K23 PolarHBondContact OE1-NZ 3.24Å; E21-K23 IonicContact OE2-NZ 2.75Å; E21-K23 PolarHBondContact OE2-NZ 2.7Å
22	G	29.4	Very low	33.1	Very low	64 Å²	64	136 Å²	136	66%	0.66	73%	0.728	S	S	*	*			cis	165.9	-175.5	-3.9	0	0	0	0	0	114.6
23	K	28.5	Very low	33.2	Very low	163 Å²	163	131.3 Å²	131.3	71%	0.709	71%	0.71	S	S	*	*			trans	64	88	163.1	-65.2	177.6	177.6	68.4	0	119.8	E21	E21-K23 IonicContact OE1-NZ 3.19Å; E21-K23 PolarHBondContact OE1-NZ 3.24Å; E21-K23 IonicContact OE2-NZ 2.75Å; E21-K23 PolarHBondContact OE2-NZ 2.7Å
24	K	31.5	Very low	33.3	Very low	185 Å²	185	136.6 Å²	136.6	80%	0.804	72%	0.723	S	S	*	*				-47.1	163.9	129.6	-154.2	-166.8	-177.2	-164	0	110.6
25	P	45.9	Very low	33.3	Very low	104 Å²	104	142.8 Å²	142.8	68%	0.675	74%	0.735	S	S	*	*				-153.2	167.5	101	39.5	-22.3	0	0	0	116.9
26	T	31.2	Very low	33.3	Very low	103 Å²	103	141.5 Å²	141.5	63%	0.632	73%	0.729	S	S	*	*			trans	49.4	144.7	147.2	53.3	0	0	0	0	121.6
27	G	31	Very low	33.1	Very low	58 Å²	58	141.2 Å²	141.2	60%	0.598	73%	0.728	S	S	*	*			cis	-163	152.5	-0.2	0	0	0	0	0	110.3
28	E	33.4	Very low	33	Very low	133 Å²	133	142.5 Å²	142.5	62%	0.621	73%	0.726	S	S	*	*				85.2	113.1	68.6	-71	139.2	-136.7	0	0	110.2
29	E	36	Very low	32.8	Very low	175 Å²	175	141 Å²	141	82%	0.818	73%	0.727	S	S	*	*				94.5	166.7	63.7	-79.6	163.1	-157.8	0	0	111.1
30	E	38	Very low	32.7	Very low	175 Å²	175	137.5 Å²	137.5	82%	0.818	73%	0.726	S	S	*	*			cis	-101.5	-159.3	-11.7	-43.9	91.8	156.8	0	0	111.6
31	D	34.2	Very low	32.4	Very low	149 Å²	149	134.9 Å²	134.9	80%	0.797	73%	0.731	S	S	*	*			cis	-134.1	-125.8	-13.3	-165.5	17.9	0	0	0	109.9
32	E	34	Very low	32.2	Very low	191 Å²	191	137 Å²	137	89%	0.893	74%	0.741	S	S	*	*			cis	-159.3	143.2	4	174.7	-170.1	-100.1	0	0	106.5
33	G	31.8	Very low	32.3	Very low	51 Å²	51	137.3 Å²	137.3	53%	0.526	74%	0.738	S	S	.	*			cis	-179.4	161.8	-8.1	0	0	0	0	0	111
34	D	30.6	Very low	32.7	Very low	173 Å²	173	136 Å²	136	93%	0.925	74%	0.738	S	S	*	*			trans	55.7	135.2	172.3	-56.8	-26.1	0	0	0	119.9
35	E	32.5	Very low	32.7	Very low	197 Å²	197	136.7 Å²	136.7	92%	0.921	74%	0.736	S	S	*	*			cis	-146	-143.4	10.4	-155.5	-169	171.3	0	0	112.4
36	E	31.4	Very low	32.1	Very low	129 Å²	129	138.3 Å²	138.3	60%	0.603	74%	0.738	S	S	*	*			trans	-97.3	-131.3	179.3	-123.9	-118.8	56.2	0	0	112.8	R38	E36-R38 WeakPolarHBondContact OE1-CG 3.42Å; E36-R38 IonicContact OE1-NE 3.15Å; E36-R38 PolarHBondContact OE1-NE 2.68Å; E36-R38 IonicContact OE2-CZ 2.64Å; E36-R38 VanDerWaalsContact OE2-CZ 3.26Å; E36-R38 IonicContact OE2-NE 3.1Å; E36-R38 PolarHBondContact OE2-NE 3.19Å; E36-R38 IonicContact OE2-NH2 3.58Å; E36-R38 PolarHBondContact OE2-NH2 2.58Å
37	E	29.8	Very low	31.9	Very low	146 Å²	146	140.7 Å²	140.7	68%	0.682	75%	0.746	S	S	*	*			cis	-146.5	179	7.1	-142.3	-78.6	95	0	0	110
38	R	33.7	Very low	32	Very low	183 Å²	183	148.5 Å²	148.5	69%	0.691	76%	0.758	S	S	*	*			trans	-100.3	-163.4	-162.9	-48.2	176.6	178.1	-167.3	-2.9	111.4	E36	E36-R38 WeakPolarHBondContact OE1-CG 3.42Å; E36-R38 IonicContact OE1-NE 3.15Å; E36-R38 PolarHBondContact OE1-NE 2.68Å; E36-R38 IonicContact OE2-CZ 2.64Å; E36-R38 VanDerWaalsContact OE2-CZ 3.26Å; E36-R38 IonicContact OE2-NE 3.1Å; E36-R38 PolarHBondContact OE2-NE 3.19Å; E36-R38 IonicContact OE2-NH2 3.58Å; E36-R38 PolarHBondContact OE2-NH2 2.58Å
39	V	28.7	Very low	32.9	Very low	132 Å²	132	147.3 Å²	147.3	80%	0.8	76%	0.762	S	S	*	*			cis	-150.2	165.5	39	171.1	0	0	0	0	110.2
40	A	29.3	Very low	32.4	Very low	91 Å²	91	144 Å²	144	75%	0.752	76%	0.758	S	S	*	*			trans	-105.1	-161	-174.6	0	0	0	0	0	114.8
41	A	28.6	Very low	32	Very low	100 Å²	100	144.6 Å²	144.6	83%	0.826	76%	0.761	S	S	*	*			trans	83.8	155.6	174.4	0	0	0	0	0	117.6
42	E	27.2	Very low	32.5	Very low	174 Å²	174	142.8 Å²	142.8	81%	0.813	76%	0.757	S	S	*	*			cis	-167	156.7	-28	176.7	56.8	-175.9	0	0	110.7
43	A	31.3	Very low	32.1	Very low	72 Å²	72	141.7 Å²	141.7	60%	0.595	75%	0.752	S	S	*	*			trans	26.6	123.2	162	0	0	0	0	0	125.1
44	D	35.9	Very low	31.9	Very low	134 Å²	134	143.6 Å²	143.6	72%	0.717	76%	0.757	S	S	*	*				52.6	123.5	124.3	-170.6	36.4	0	0	0	123.1
45	R	32.3	Very low	31.8	Very low	200 Å²	200	140.1 Å²	140.1	76%	0.755	75%	0.746	S	S	*	*				166.3	135	119.3	-91.6	174.6	-179.3	-160.5	-1.5	118.2
46	I	34.4	Very low	31.5	Very low	139 Å²	139	138.4 Å²	138.4	71%	0.713	74%	0.738	S	S	*	*			trans	69.9	141.3	140.7	-64.5	168	0	0	0	116.9
47	N	26.2	Very low	31.3	Very low	152 Å²	152	141.6 Å²	141.6	81%	0.813	75%	0.745	S	S	*	*			cis	-148	179.9	19.6	-143.5	-24	0	0	0	115.7
48	R	33.8	Very low	31.2	Very low	222 Å²	222	140.9 Å²	140.9	84%	0.838	75%	0.745	S	S	*	*			trans	-85.6	-170.7	173.7	-113	178.2	167.6	-171.5	-4.1	113.4
49	P	50.5	Low	30.8	Very low	108 Å²	108	143.9 Å²	143.9	70%	0.701	76%	0.756	S	S	*	*			cis	-125.4	-164.4	-25.6	28	-2.8	0	0	0	110.9
50	S	26.5	Very low	30.8	Very low	107 Å²	107	140.6 Å²	140.6	75%	0.748	75%	0.749	S	S	*	*			cis	-164.3	165	35.8	-60.2	0	0	0	0	114
51	E	28.6	Very low	30.7	Very low	187 Å²	187	142.8 Å²	142.8	87%	0.874	75%	0.748	S	S	*	*			trans	-102.3	-148.6	173.6	-42.9	179.6	117.7	0	0	110.8
52	P	44.8	Very low	30.8	Very low	110 Å²	110	145.1 Å²	145.1	71%	0.714	74%	0.741	S	S	*	*			cis	-103	-155.7	7.4	46	-39.1	0	0	0	112.4
53	E	26.5	Very low	31.1	Very low	168 Å²	168	144.5 Å²	144.5	79%	0.785	74%	0.739	S	S	*	*			cis	-154.7	164.9	5.4	-109.2	-152	75.1	0	0	107.4
54	S	26.6	Very low	31.2	Very low	91 Å²	91	149.5 Å²	149.5	64%	0.636	75%	0.75	S	S	*	*			cis	-163.6	-79.4	-17.9	46.1	0	0	0	0	114.1
55	S	28.8	Very low	31	Very low	100 Å²	100	149.4 Å²	149.4	70%	0.699	75%	0.749	S	S	*	*			trans	-158	170	-154.3	57	0	0	0	0	114
56	E	26.6	Very low	30.9	Very low	161 Å²	161	147.5 Å²	147.5	75%	0.752	75%	0.749	S	S	*	*			cis	-144.4	-129.9	4.2	-144.6	-176.3	168.8	0	0	116
57	R	28.4	Very low	30.8	Very low	196 Å²	196	148.8 Å²	148.8	74%	0.74	75%	0.752	S	S	*	*			trans	-136.4	148.5	-149.8	-80.5	166.4	162.7	160	-8.5	116
58	I	26	Very low	31.2	Very low	132 Å²	132	148.1 Å²	148.1	68%	0.677	75%	0.748	S	S	*	*			trans	66.7	140.5	136.2	-68.4	169.7	0	0	0	120.3
59	R	27	Very low	31	Very low	246 Å²	246	145.2 Å²	145.2	93%	0.928	74%	0.744	S	S	*	*			trans	69	155.6	176.1	-68	158.1	-158.8	-167	5.8	114.7
60	G	27	Very low	30.1	Very low	63 Å²	63	143.5 Å²	143.5	65%	0.649	74%	0.739	S	S	*	*			cis	154.7	154.7	-7.2	0	0	0	0	0	111.6
61	N	27.9	Very low	30.1	Very low	136 Å²	136	147.5 Å²	147.5	73%	0.727	75%	0.746	S	S	*	*			trans	69	145	178.7	-82.5	38.5	0	0	0	115.2
62	E	31.3	Very low	29.9	Very low	149 Å²	149	144.5 Å²	144.5	70%	0.696	74%	0.741	S	S	*	*				60.7	125.2	70.3	-56.6	172.9	158.2	0	0	110.7
63	E	32.2	Very low	30.1	Very low	161 Å²	161	143.1 Å²	143.1	75%	0.752	73%	0.732	S	S	*	*			cis	-139.3	163.2	4	-94.6	138.5	144.9	0	0	109
64	Q	34	Very low	30.2	Very low	177 Å²	177	146 Å²	146	83%	0.827	74%	0.735	S	S	*	*				69.7	174.6	76.1	-142.4	159.2	-28.2	0	0	115.5
65	D	30.7	Very low	30.2	Very low	132 Å²	132	147.5 Å²	147.5	71%	0.706	74%	0.741	S	S	*	*			trans	75	146	-179.1	-48.4	-24.6	0	0	0	116.9
66	E	30.9	Very low	29.9	Very low	160 Å²	160	150.4 Å²	150.4	75%	0.748	75%	0.747	S	S	*	*			cis	-155.6	162.2	-0.9	-130	170.5	-158.7	0	0	113.2
67	E	33.6	Very low	29.8	Very low	167 Å²	167	148.3 Å²	148.3	78%	0.78	75%	0.75	S	S	*	*			trans	5.9	160.5	144.4	-72.3	179	-169	0	0	123.6
68	D	32.9	Very low	29.7	Very low	137 Å²	137	148 Å²	148	73%	0.733	75%	0.749	S	S	*	*			cis	-169.1	177.8	-22.8	-154.5	-3.4	0	0	0	112
69	E	30.4	Very low	29.8	Very low	162 Å²	162	147.5 Å²	147.5	76%	0.757	74%	0.744	S	S	*	*			trans	73.3	134.2	149	-84.3	-71.7	71.7	0	0	128.3
70	A	30.8	Very low	29.8	Very low	72 Å²	72	143.7 Å²	143.7	60%	0.595	74%	0.737	S	S	*	*			trans	71.2	125.1	134	0	0	0	0	0	129.1
71	E	27.6	Very low	30	Very low	190 Å²	190	144.1 Å²	144.1	89%	0.888	74%	0.741	S	S	*	*			trans	72.1	175.7	138.5	-63.3	-136.9	117.7	0	0	125.1
72	T	23.2	Very low	30.2	Very low	124 Å²	124	145.1 Å²	145.1	76%	0.761	73%	0.734	S	S	*	*			trans	-154.9	-151	-154	63.8	0	0	0	0	112.8
73	P	49.5	Very low	30.1	Very low	81 Å²	81	144.3 Å²	144.3	53%	0.526	73%	0.731	S	S	.	*			cis	-141.1	-172.9	-24.3	30.3	-5.3	0	0	0	117.4
74	R	28.5	Very low	30.2	Very low	228 Å²	228	143.5 Å²	143.5	86%	0.86	73%	0.727	S	S	*	*			trans	78.8	170.7	157.9	-26.8	-176.2	-170.6	106.1	7.7	118.4
75	V	26.7	Very low	29.9	Very low	124 Å²	124	139.9 Å²	139.9	75%	0.752	72%	0.721	S	S	*	*			cis	-164.2	158.8	-3.1	91.5	0	0	0	0	115.9
76	L	23.2	Very low	29.7	Very low	160 Å²	160	140.6 Å²	140.6	84%	0.838	73%	0.731	S	S	*	*			trans	63.9	-178.4	157	-69.5	170.4	0	0	0	124.4
77	S	24	Very low	29.7	Very low	117 Å²	117	138.4 Å²	138.4	82%	0.818	73%	0.733	S	S	*	*			trans	-161.4	-173.7	-170.9	-63.4	0	0	0	0	111.6
78	R	25.8	Very low	29.1	Very low	190 Å²	190	137.8 Å²	137.8	72%	0.717	74%	0.735	S	S	*	*				162.3	129.3	67.7	175.6	-150.2	132.4	-94.2	-7.9	115.1
79	Q	28.5	Very low	28.9	Very low	121 Å²	121	137.4 Å²	137.4	57%	0.565	74%	0.738	S	S	*	*			trans	63.6	164.7	156.1	-75.2	-170.1	-63.1	0	0	121.2
80	E	27.6	Very low	29.7	Very low	167 Å²	167	135.6 Å²	135.6	78%	0.78	74%	0.74	S	S	*	*			cis	175	151.8	-24.1	-177.5	171.5	-71.9	0	0	113.4
81	G	30.1	Very low	29.2	Very low	71 Å²	71	136.9 Å²	136.9	73%	0.732	75%	0.751	S	S	*	*			trans	123.6	138	155.2	0	0	0	0	0	120.9
82	R	32.4	Very low	29.2	Very low	157 Å²	157	136.4 Å²	136.4	59%	0.592	75%	0.753	S	S	*	*			trans	87.8	160.1	164.4	-154.8	56.3	-94.7	-90.5	24.4	120	E84	R82-E84 IonicContact CZ-OE2 3.01Å; R82-E84 VanDerWaalsContact CZ-OE2 3.24Å; R82-E84 IonicContact NH1-OE2 2.68Å; R82-E84 PolarHBondContact NH1-OE2 3.25Å; R82-E84 IonicContact NH2-OE1 2.89Å; R82-E84 PolarHBondContact NH2-OE1 2.91Å; R82-E84 IonicContact NH2-OE2 2.69Å; R82-E84 PolarHBondContact NH2-OE2 2.95Å
83	E	30.4	Very low	29.8	Very low	132 Å²	132	135.7 Å²	135.7	62%	0.617	75%	0.753	S	S	*	*			trans	-130.9	-176.3	-176.3	-36.4	89.4	-99.3	0	0	109.8
84	E	33	Very low	28.7	Very low	145 Å²	145	137.2 Å²	137.2	68%	0.678	77%	0.766	S	S	*	*			cis	-166.4	175.5	15.2	63	-128.6	-49.8	0	0	108.3	R82	R82-E84 IonicContact CZ-OE2 3.01Å; R82-E84 VanDerWaalsContact CZ-OE2 3.24Å; R82-E84 IonicContact NH1-OE2 2.68Å; R82-E84 PolarHBondContact NH1-OE2 3.25Å; R82-E84 IonicContact NH2-OE1 2.89Å; R82-E84 PolarHBondContact NH2-OE1 2.91Å; R82-E84 IonicContact NH2-OE2 2.69Å; R82-E84 PolarHBondContact NH2-OE2 2.95Å
85	S	27.6	Very low	28.5	Very low	101 Å²	101	131.3 Å²	131.3	71%	0.706	76%	0.759	S	S	*	*			cis	-164.2	-159.8	-28.5	58.8	0	0	0	0	109.7
86	T	26.9	Very low	28.9	Very low	147 Å²	147	131.2 Å²	131.2	90%	0.902	76%	0.762	S	S	*	*	S	Bend	trans	62.3	157	-158.6	62.4	0	0	0	0	114.3
87	S	31.3	Very low	29.1	Very low	113 Å²	113	128.7 Å²	128.7	79%	0.79	76%	0.757	S	S	*	*	S	Bend	trans	-102.3	109.2	-155.3	56.3	0	0	0	0	114.8
88	D	21.4	Very low	29.6	Very low	154 Å²	154	129.5 Å²	129.5	82%	0.824	76%	0.76	S	S	*	*	S	Bend	trans	-161.1	128.7	136.2	-112.5	-31.5	0	0	0	111.6
89	T	29.1	Very low	30	Very low	130 Å²	130	130 Å²	130	80%	0.798	77%	0.767	S	S	*	*	S	Bend	trans	64.4	-175.3	174.3	-20.4	0	0	0	0	115.3
90	P	45.2	Very low	30.5	Very low	124 Å²	124	130.6 Å²	130.6	81%	0.805	77%	0.774	S	S	*	*				-100.3	160.8	-114.7	39.4	-28	0	0	0	116.4
91	A	22.2	Very low	31.5	Very low	99 Å²	99	128.7 Å²	128.7	82%	0.818	76%	0.764	S	S	*	*			trans	-147.1	175.2	179.4	0	0	0	0	0	114.8
92	L	26.2	Very low	32.5	Very low	180 Å²	180	128.6 Å²	128.6	94%	0.942	75%	0.747	S	S	*	*			trans	-110.7	-156.9	-160.1	-66.8	168.1	0	0	0	115.4
93	S	36.4	Very low	33.8	Very low	109 Å²	109	122.3 Å²	122.3	76%	0.762	72%	0.724	S	S	*	*			trans	-115.9	-169.8	-145.6	62.5	0	0	0	0	117.6
94	S	25.6	Very low	35.2	Very low	112 Å²	112	119.9 Å²	119.9	78%	0.783	71%	0.712	S	S	*	*			trans	87.1	158.7	-172.5	88.1	0	0	0	0	114.2
95	S	25.6	Very low	37	Very low	104 Å²	104	113 Å²	113	73%	0.727	68%	0.679	S	S	*	*			cis	-145.6	173.4	22.8	-93.9	0	0	0	0	112.7
96	P	33.8	Very low	38.5	Very low	123 Å²	123	113.4 Å²	113.4	80%	0.799	67%	0.674	S	S	*	*	P	Polyproline II helix	trans	-92.6	168.9	-161.1	36.7	-38.1	0	0	0	117.1
97	S	29.1	Very low	40.1	Very low	107 Å²	107	109.6 Å²	109.6	75%	0.748	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-56.2	152.2	176.4	-49.6	0	0	0	0	114.7
98	P	33.6	Very low	41.8	Very low	133 Å²	133	106 Å²	106	86%	0.864	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-67.4	144.4	-175.7	27.7	-35.5	0	0	0	113.1
99	K	33.3	Very low	43.6	Very low	200 Å²	200	101 Å²	101	87%	0.87	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-80.3	147.5	-177	-65.2	174	-178.7	172.8	0	111.8
100	L	39	Very low	45.2	Very low	135 Å²	135	101.2 Å²	101.2	71%	0.707	60%	0.597	S	S	*	*	P	Polyproline II helix	trans	-60.1	145.7	166.9	-67.7	165.5	0	0	0	110.5
101	Q	49.8	Very low	45.9	Very low	126 Å²	126	96.4 Å²	96.4	59%	0.589	57%	0.569	S	S	*	*			trans	-107.2	105	-179.8	-159.9	165.4	19.1	0	0	109.7	F103	Q101-F103 HydrophobicContact CB-CE1 4.47Å; Q101-F103 HydrophobicContact CB-CZ 4.08Å; Q101-F103 HydrophobicContact CG-CE1 4.06Å; Q101-F103 HydrophobicContact CG-CZ 4.14Å; Q101-F103 WeakPolarHBondContact O-CD2 3.25Å; Q101-F103 PolarHBondContact O-N 2.97Å; Q101-F103 VanDerWaalsContact O-N 3.17Å
102	D	51.3	Low	48	Very low	70 Å²	70	93.9 Å²	93.9	37%	0.374	54%	0.539	S	S	.	.			trans	-73.1	100.8	-176.9	-78.3	20.1	0	0	0	111.3	K104 Y113	D102-K104 PolarHBondContact O-N 2.81Å; D102-K104 VanDerWaalsContact O-N 3.12Å; D102-Y113 WeakPolarHBondContact OD1-CE1 3.46Å; D102-Y113 WeakPolarHBondContact OD2-CE1 3.29Å; D102-Y113 PolarHBondContact OD2-OH 2.83Å
103	F	58.7	Low	49	Very low	25 Å²	25	93.5 Å²	93.5	11%	0.11	53%	0.526	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	99.9	177.3	-62.2	-61.5	0	0	0	111.2	Q101 Y112 G114 L120 M151	Q101-F103 HydrophobicContact CB-CE1 4.47Å; Q101-F103 HydrophobicContact CB-CZ 4.08Å; Q101-F103 HydrophobicContact CG-CE1 4.06Å; Q101-F103 HydrophobicContact CG-CZ 4.14Å; Q101-F103 WeakPolarHBondContact O-CD2 3.25Å; Q101-F103 PolarHBondContact O-N 2.97Å; Q101-F103 VanDerWaalsContact O-N 3.17Å; F103-Y112 PolarHBondContact N-O 3.32Å; F103-Y112 PolarHBondContact O-N 3.3Å; F103-G114 WeakPolarHBondContact CD2-O 3.17Å; F103-G114 WeakPolarHBondContact CE2-O 3.42Å; F103-L120 HydrophobicContact CB-CD2 4.34Å; F103-M151 HydrophobicContact CD1-CE 4.18Å; F103-M151 HydrophobicContact CE1-CE 3.28Å; F103-M151 HydrophobicContact CE1-SD 4.01Å; F103-M151 HydrophobicContact CZ-CE 3.58Å
104	K	61.3	Low	50	Low	80 Å²	80	89.9 Å²	89.9	35%	0.348	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	136.4	177.1	-56.5	-162.9	178.2	-171.8	0	111.5	D102 N106 Y110	D102-K104 PolarHBondContact O-N 2.81Å; D102-K104 VanDerWaalsContact O-N 3.12Å; K104-N106 PolarHBondContact O-N 3.16Å; K104-Y110 WeakPolarHBondContact CA-O 3.42Å
105	C	69.6	Low	51.2	Low	0 Å²	0	90.9 Å²	90.9	0%	0	50%	0.503	C	S	.	.			trans	-78.6	113.9	174.5	-176.4	0	0	0	0	110.9	V107 C108 G109 Y110 L120	C105-V107 PolarHBondContact O-N 3.01Å; C105-C108 PolarHBondContact O-N 2.9Å; C105-G109 WeakPolarHBondContact O-CA 3.44Å; C105-G109 PolarHBondContact O-N 2.81Å; C105-Y110 PolarHBondContact N-O 2.94Å; C105-L120 HydrophobicContact CB-CD1 3.49Å; C105-L120 VanDerWaalsContact CB-CD1 3.49Å
106	N	58.6	Low	53.1	Low	111 Å²	111	89.5 Å²	89.5	59%	0.594	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.8	-23.8	-177.5	-60.5	-16.2	0	0	0	114.6	K104 L148 H149	K104-N106 PolarHBondContact O-N 3.16Å; N106-L148 PolarHBondContact ND2-O 2.9Å; N106-H149 VanDerWaalsContact CG-ND1 3.34Å; N106-H149 PolarHBondContact N-CE1 3.46Å; N106-H149 PolarHBondContact ND2-ND1 3.48Å
107	V	61.9	Low	54.7	Low	66 Å²	66	85.7 Å²	85.7	40%	0.4	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-46.6	-178.5	-179.5	0	0	0	0	111.7	C105 F124 K215	C105-V107 PolarHBondContact O-N 3.01Å; V107-F124 HydrophobicContact CG2-CE2 3.65Å; V107-F124 HydrophobicContact CG2-CZ 3.95Å; V107-K215 PolarHBondContact O-NZ 3.42Å
108	C	65.9	Low	56.8	Low	37 Å²	37	82.1 Å²	82.1	25%	0.25	44%	0.44	C	S	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-10.1	-171.9	67.8	0	0	0	0	115.7	C105 Y110 H123	C105-C108 PolarHBondContact O-N 2.9Å; C108-Y110 VanDerWaalsContact C-N 3.26Å; C108-Y110 PolarHBondContact O-N 3.44Å; C108-Y110 VanDerWaalsContact SG-CB 3.51Å; C108-Y110 PolarHBondContact SG-N 3.07Å; C108-Y110 VanDerWaalsContact SG-N 3.4Å; C108-H123 PolarHBondContact SG-NE2 3.17Å
109	G	59.4	Low	58.8	Low	49 Å²	49	79.1 Å²	79.1	51%	0.505	42%	0.416	S	S	.	.			trans	77.8	-3.1	-176	0	0	0	0	0	115.5	C105 G111	C105-G109 WeakPolarHBondContact O-CA 3.44Å; C105-G109 PolarHBondContact O-N 2.81Å; G109-G111 PolarHBondContact O-N 2.84Å
110	Y	63.8	Low	60.9	Low	136 Å²	136	69.8 Å²	69.8	53%	0.533	38%	0.376	S	S	.	.			trans	-66.4	123.5	-175.9	-162.6	-72.9	0	0	0	111	K104 C105 C108 Y112 H123	K104-Y110 WeakPolarHBondContact CA-O 3.42Å; C105-Y110 PolarHBondContact N-O 2.94Å; C108-Y110 VanDerWaalsContact C-N 3.26Å; C108-Y110 PolarHBondContact O-N 3.44Å; C108-Y110 VanDerWaalsContact SG-CB 3.51Å; C108-Y110 PolarHBondContact SG-N 3.07Å; C108-Y110 VanDerWaalsContact SG-N 3.4Å; Y110-Y112 HydrophobicContact CD1-CD2 4.01Å; Y110-Y112 HydrophobicContact CD1-CE1 4.22Å; Y110-Y112 AromaticContact CD1-CE2 3.39Å; Y110-Y112 HydrophobicContact CD1-CE2 3.39Å; Y110-Y112 AromaticContact CD1-CZ 3.5Å; Y110-Y112 VanDerWaalsContact CD1-CZ 3.5Å; Y110-Y112 HydrophobicContact CE1-CD1 4.48Å; Y110-Y112 AromaticContact CE1-CE1 3.88Å; Y110-Y112 HydrophobicContact CE1-CE1 3.88Å; Y110-Y112 AromaticContact CE1-CE2 3.93Å; Y110-Y112 HydrophobicContact CE1-CE2 3.93Å; Y110-Y112 AromaticContact CE1-CZ 3.55Å; Y110-Y112 HydrophobicContact CG-CE2 4.34Å; Y110-H123 AromaticContact CG-CE1 3.93Å
111	G	57.9	Low	62.7	Low	22 Å²	22	63.8 Å²	63.8	23%	0.227	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	139.2	-179.8	0	0	0	0	0	113.8	G109	G109-G111 PolarHBondContact O-N 2.84Å
112	Y	67.4	Low	64	Low	46 Å²	46	62.4 Å²	62.4	18%	0.18	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	111.9	174	-74.2	-80.6	0	0	0	109.8	F103 Y110 G114 D119 H123	F103-Y112 PolarHBondContact N-O 3.32Å; F103-Y112 PolarHBondContact O-N 3.3Å; Y110-Y112 HydrophobicContact CD1-CD2 4.01Å; Y110-Y112 HydrophobicContact CD1-CE1 4.22Å; Y110-Y112 AromaticContact CD1-CE2 3.39Å; Y110-Y112 HydrophobicContact CD1-CE2 3.39Å; Y110-Y112 AromaticContact CD1-CZ 3.5Å; Y110-Y112 VanDerWaalsContact CD1-CZ 3.5Å; Y110-Y112 HydrophobicContact CE1-CD1 4.48Å; Y110-Y112 AromaticContact CE1-CE1 3.88Å; Y110-Y112 HydrophobicContact CE1-CE1 3.88Å; Y110-Y112 AromaticContact CE1-CE2 3.93Å; Y110-Y112 HydrophobicContact CE1-CE2 3.93Å; Y110-Y112 AromaticContact CE1-CZ 3.55Å; Y110-Y112 HydrophobicContact CG-CE2 4.34Å; Y112-G114 PolarHBondContact O-N 3Å; Y112-D119 HydrophobicContact CD1-CB 3.74Å; Y112-D119 HydrophobicContact CE1-CB 4.2Å; Y112-D119 HydrophobicContact CG-CB 4.21Å; Y112-H123 HydrophobicContact CE2-CB 3.59Å; Y112-H123 AromaticContact CE2-CG 3.76Å; Y112-H123 AromaticContact CE2-ND1 3.58Å; Y112-H123 AromaticContact CZ-ND1 3.63Å; Y112-H123 PolarHBondContact OH-ND1 3.43Å
113	Y	47	Very low	65.4	Low	172 Å²	172	59.7 Å²	59.7	68%	0.675	32%	0.322	S	S	*	.			trans	-86.1	99.6	176.7	-72.6	-77.9	0	0	0	110.1	D102	D102-Y113 WeakPolarHBondContact OD1-CE1 3.46Å; D102-Y113 WeakPolarHBondContact OD2-CE1 3.29Å; D102-Y113 PolarHBondContact OD2-OH 2.83Å
114	G	57.9	Low	66.3	Low	34 Å²	34	59.7 Å²	59.7	35%	0.351	32%	0.322	S	S	.	.	S	Bend	trans	152.2	152.3	174.6	0	0	0	0	0	113.2	F103 Y112 D116	F103-G114 WeakPolarHBondContact CD2-O 3.17Å; F103-G114 WeakPolarHBondContact CE2-O 3.42Å; Y112-G114 PolarHBondContact O-N 3Å; G114-D116 PolarHBondContact O-N 3.14Å
115	N	51.2	Low	67.1	Low	132 Å²	132	56.8 Å²	56.8	71%	0.706	31%	0.309	S	S	*	.	S	Bend	trans	-74.2	15.8	-171.5	-60.3	-15.6	0	0	0	115.1	P117	N115-P117 VanDerWaalsContact O-CD 3.26Å; N115-P117 WeakPolarHBondContact O-CD 3.29Å
116	D	64.9	Low	67.4	Low	76 Å²	76	61.5 Å²	61.5	41%	0.406	33%	0.329	S	S	.	.			trans	-101	100	178.6	-179.7	19.3	0	0	0	111.7	G114 A118 D119 K122	G114-D116 PolarHBondContact O-N 3.14Å; D116-A118 PolarHBondContact O-N 2.86Å; D116-A118 WeakPolarHBondContact OD1-CB 3.33Å; D116-A118 PolarHBondContact OD1-N 3.35Å; D116-D119 PolarHBondContact O-N 3.19Å; D116-K122 IonicContact OD2-NZ 3.81Å; D116-K122 PolarHBondContact OD2-NZ 3.09Å
117	P	67.5	Low	68	Low	42 Å²	42	62.8 Å²	62.8	27%	0.273	33%	0.327	S	S	.	.	H	α-helix	trans	-58.5	-18.6	174.6	21.2	-31.8	0	0	0	113.6	N115 D119 L120 V121 L146 M151	N115-P117 VanDerWaalsContact O-CD 3.26Å; N115-P117 WeakPolarHBondContact O-CD 3.29Å; P117-D119 VanDerWaalsContact C-N 3.26Å; P117-D119 PolarHBondContact O-N 3.04Å; P117-L120 PolarHBondContact O-N 2.96Å; P117-V121 PolarHBondContact O-N 3.15Å; P117-L146 HydrophobicContact CB-CD1 4.25Å; P117-L146 HydrophobicContact CB-CD2 3.56Å; P117-M151 HydrophobicContact CB-CE 4.43Å
118	A	73.3	Confident	68.6	Low	33 Å²	33	62.8 Å²	62.8	27%	0.273	32%	0.322	S	S	.	.	H	α-helix	trans	-67.4	-22.7	179.6	0	0	0	0	0	113	D116 V121 K122	D116-A118 PolarHBondContact O-N 2.86Å; D116-A118 WeakPolarHBondContact OD1-CB 3.33Å; D116-A118 PolarHBondContact OD1-N 3.35Å; A118-V121 PolarHBondContact O-N 3.36Å; A118-K122 WeakPolarHBondContact O-CB 3.29Å; A118-K122 WeakPolarHBondContact O-CD 3.41Å; A118-K122 WeakPolarHBondContact O-CE 3.46Å; A118-K122 WeakPolarHBondContact O-CG 3.44Å; A118-K122 PolarHBondContact O-N 2.93Å
119	D	75.1	Confident	68.9	Low	69 Å²	69	64.6 Å²	64.6	37%	0.369	33%	0.329	S	S	.	.	H	α-helix	trans	-71.3	-36.5	175.8	-88.1	-17.6	0	0	0	113	Y112 D116 P117 K122 H123	Y112-D119 HydrophobicContact CD1-CB 3.74Å; Y112-D119 HydrophobicContact CE1-CB 4.2Å; Y112-D119 HydrophobicContact CG-CB 4.21Å; D116-D119 PolarHBondContact O-N 3.19Å; P117-D119 VanDerWaalsContact C-N 3.26Å; P117-D119 PolarHBondContact O-N 3.04Å; D119-K122 PolarHBondContact O-N 2.99Å; D119-K122 VanDerWaalsContact OD1-CD 3.29Å; D119-K122 WeakPolarHBondContact OD1-CD 3.49Å; D119-K122 WeakPolarHBondContact OD1-CE 3.2Å; D119-K122 IonicContact OD1-NZ 2.68Å; D119-K122 PolarHBondContact OD1-NZ 3.1Å; D119-H123 WeakPolarHBondContact O-CB 3.32Å; D119-H123 PolarHBondContact O-N 2.75Å
120	L	77.1	Confident	69	Low	5 Å²	5	64.9 Å²	64.9	3%	0.026	33%	0.332	C	S	.	.	H	α-helix	trans	-63	-42.6	170.2	176.4	56.1	0	0	0	111.2	F103 C105 P117 H123 F124 H149	F103-L120 HydrophobicContact CB-CD2 4.34Å; C105-L120 HydrophobicContact CB-CD1 3.49Å; C105-L120 VanDerWaalsContact CB-CD1 3.49Å; P117-L120 PolarHBondContact O-N 2.96Å; L120-H123 WeakPolarHBondContact O-CB 3.06Å; L120-H123 PolarHBondContact O-N 3.28Å; L120-F124 PolarHBondContact O-N 3.34Å; L120-H149 HydrophobicContact CD2-CB 3.88Å
121	V	76.8	Confident	69.4	Low	8 Å²	8	62.1 Å²	62.1	5%	0.048	33%	0.326	C	S	.	.	H	α-helix	trans	-63.6	-45.5	174.4	170.1	0	0	0	0	111.9	P117 A118 H123 F124 R125 D142 I145 L146	P117-V121 PolarHBondContact O-N 3.15Å; A118-V121 PolarHBondContact O-N 3.36Å; V121-H123 VanDerWaalsContact C-N 3.27Å; V121-H123 PolarHBondContact O-N 3.05Å; V121-F124 PolarHBondContact O-N 2.71Å; V121-R125 HydrophobicContact CG1-CG 4.46Å; V121-R125 WeakPolarHBondContact O-CB 3.49Å; V121-R125 VanDerWaalsContact O-CG 3.22Å; V121-R125 WeakPolarHBondContact O-CG 3.48Å; V121-R125 PolarHBondContact O-N 2.74Å; V121-D142 HydrophobicContact CG1-CB 4.09Å; V121-D142 WeakPolarHBondContact CG1-OD1 3.18Å; V121-I145 HydrophobicContact CG1-CD1 4.47Å; V121-I145 HydrophobicContact CG2-CB 4.36Å; V121-I145 HydrophobicContact CG2-CG2 3.98Å; V121-L146 HydrophobicContact CG2-CD1 4.12Å; V121-L146 HydrophobicContact CG2-CD2 3.74Å; V121-L146 HydrophobicContact CG2-CG 3.71Å
122	K	76.9	Confident	69.5	Low	98 Å²	98	67.8 Å²	67.8	43%	0.426	35%	0.346	S	S	.	.	H	α-helix	trans	-58.6	-39.3	174.2	-72.2	160.1	-132.1	147.8	0	110.9	D116 A118 D119 K126	D116-K122 IonicContact OD2-NZ 3.81Å; D116-K122 PolarHBondContact OD2-NZ 3.09Å; A118-K122 WeakPolarHBondContact O-CB 3.29Å; A118-K122 WeakPolarHBondContact O-CD 3.41Å; A118-K122 WeakPolarHBondContact O-CE 3.46Å; A118-K122 WeakPolarHBondContact O-CG 3.44Å; A118-K122 PolarHBondContact O-N 2.93Å; D119-K122 PolarHBondContact O-N 2.99Å; D119-K122 VanDerWaalsContact OD1-CD 3.29Å; D119-K122 WeakPolarHBondContact OD1-CD 3.49Å; D119-K122 WeakPolarHBondContact OD1-CE 3.2Å; D119-K122 IonicContact OD1-NZ 2.68Å; D119-K122 PolarHBondContact OD1-NZ 3.1Å; K122-K126 WeakPolarHBondContact O-CB 3.48Å; K122-K126 PolarHBondContact O-N 2.93Å
123	H	80.9	Confident	68.7	Low	12 Å²	12	72.4 Å²	72.4	6%	0.056	37%	0.374	C	S	.	.	H	α-helix	trans	-62.3	-56.7	174.7	-176.5	103.9	0	0	0	111.5	C108 Y110 Y112 D119 L120 V121 R125 K126 Y127 H128	C108-H123 PolarHBondContact SG-NE2 3.17Å; Y110-H123 AromaticContact CG-CE1 3.93Å; Y112-H123 HydrophobicContact CE2-CB 3.59Å; Y112-H123 AromaticContact CE2-CG 3.76Å; Y112-H123 AromaticContact CE2-ND1 3.58Å; Y112-H123 AromaticContact CZ-ND1 3.63Å; Y112-H123 PolarHBondContact OH-ND1 3.43Å; D119-H123 WeakPolarHBondContact O-CB 3.32Å; D119-H123 PolarHBondContact O-N 2.75Å; L120-H123 WeakPolarHBondContact O-CB 3.06Å; L120-H123 PolarHBondContact O-N 3.28Å; V121-H123 VanDerWaalsContact C-N 3.27Å; V121-H123 PolarHBondContact O-N 3.05Å; H123-R125 VanDerWaalsContact C-N 3.35Å; H123-R125 PolarHBondContact O-N 3.43Å; H123-K126 PolarHBondContact O-N 3.23Å; H123-Y127 AromaticContact CD2-CD2 3.98Å; H123-Y127 AromaticContact CE1-CD2 3.57Å; H123-Y127 AromaticContact CG-CD2 3.82Å; H123-Y127 AromaticContact ND1-CD2 3.56Å; H123-Y127 AromaticContact ND1-CE2 3.89Å; H123-Y127 AromaticContact NE2-CD2 3.8Å; H123-Y127 WeakPolarHBondContact O-CD2 3.22Å; H123-Y127 PolarHBondContact O-N 2.97Å; H123-H128 AromaticContact NE2-NE2 3.7Å
124	F	77.6	Confident	69.1	Low	26 Å²	26	73.1 Å²	73.1	11%	0.114	38%	0.375	C	S	.	.	H	α-helix	trans	-59.1	-46.8	-173.6	-154.2	-74.8	0	0	0	111.3	V107 L120 V121 K126 H128 L129 I145 H149	V107-F124 HydrophobicContact CG2-CE2 3.65Å; V107-F124 HydrophobicContact CG2-CZ 3.95Å; L120-F124 PolarHBondContact O-N 3.34Å; V121-F124 PolarHBondContact O-N 2.71Å; F124-K126 VanDerWaalsContact C-N 3.34Å; F124-K126 PolarHBondContact O-N 3.45Å; F124-H128 HydrophobicContact CD1-CB 4.03Å; F124-H128 HydrophobicContact CE1-CB 4.02Å; F124-H128 HydrophobicContact CG-CB 4.42Å; F124-H128 HydrophobicContact CZ-CB 4.42Å; F124-H128 WeakPolarHBondContact O-CA 3.34Å; F124-H128 WeakPolarHBondContact O-CB 3.27Å; F124-H128 PolarHBondContact O-N 2.58Å; F124-L129 HydrophobicContact CD1-CD1 3.89Å; F124-L129 HydrophobicContact CD1-CG 3.92Å; F124-L129 HydrophobicContact CE1-CD1 4.23Å; F124-L129 HydrophobicContact CE1-CD2 4.27Å; F124-L129 HydrophobicContact CE1-CG 4.08Å; F124-L129 PolarHBondContact O-N 3.37Å; F124-L129 VanDerWaalsContact O-N 3.1Å; F124-I145 HydrophobicContact CB-CD1 4.15Å; F124-I145 HydrophobicContact CB-CG1 4.43Å; F124-I145 HydrophobicContact CB-CG2 3.9Å; F124-I145 HydrophobicContact CD1-CD1 4.1Å; F124-I145 HydrophobicContact CD1-CG1 3.99Å; F124-I145 HydrophobicContact CD2-CG2 4.21Å; F124-I145 HydrophobicContact CG-CD1 4.33Å; F124-I145 HydrophobicContact CG-CG1 4.19Å; F124-I145 HydrophobicContact CG-CG2 4.02Å; F124-H149 AromaticContact CD2-NE2 3.49Å; F124-H149 WeakPolarHBondContact CD2-NE2 3.5Å; F124-H149 AromaticContact CE2-NE2 3.67Å
125	R	78.8	Confident	69.1	Low	18 Å²	18	75.6 Å²	75.6	7%	0.068	38%	0.384	C	S	.	.	H	α-helix	trans	-53.6	-48.1	172.9	-73.4	174.1	161.8	-66.5	-20	113.1	V121 H123 L129 G130 L131 D138 L141 D142 I145	V121-R125 HydrophobicContact CG1-CG 4.46Å; V121-R125 WeakPolarHBondContact O-CB 3.49Å; V121-R125 VanDerWaalsContact O-CG 3.22Å; V121-R125 WeakPolarHBondContact O-CG 3.48Å; V121-R125 PolarHBondContact O-N 2.74Å; H123-R125 VanDerWaalsContact C-N 3.35Å; H123-R125 PolarHBondContact O-N 3.43Å; R125-L129 CarbonylContact O-C 3.54Å; R125-G130 PolarHBondContact O-N 3.34Å; R125-G130 VanDerWaalsContact O-N 3.07Å; R125-L131 PolarHBondContact O-N 3.48Å; R125-D138 IonicContact CZ-OD1 3.17Å; R125-D138 IonicContact NH1-OD1 2.68Å; R125-D138 PolarHBondContact NH1-OD1 2.87Å; R125-D138 IonicContact NH1-OD2 3.26Å; R125-D138 PolarHBondContact NH2-O 2.96Å; R125-D138 IonicContact NH2-OD1 2.91Å; R125-D138 PolarHBondContact NH2-OD1 3.47Å; R125-L141 VanDerWaalsContact NH2-CD2 3.27Å; R125-D142 IonicContact CZ-OD1 2.73Å; R125-D142 IonicContact NE-OD1 3.65Å; R125-D142 PolarHBondContact NE-OD1 3.29Å; R125-D142 IonicContact NH2-OD1 3.06Å; R125-D142 PolarHBondContact NH2-OD1 3.42Å; R125-D142 IonicContact NH2-OD2 3.27Å; R125-I145 HydrophobicContact CG-CD1 4.24Å
126	K	75.1	Confident	68.7	Low	99 Å²	99	81 Å²	81	43%	0.43	39%	0.394	S	S	.	.	H	α-helix	trans	-78	-36.7	-170.7	-170.5	-171.7	171.7	-159.1	0	113.3	K122 H123 F124	K122-K126 WeakPolarHBondContact O-CB 3.48Å; K122-K126 PolarHBondContact O-N 2.93Å; H123-K126 PolarHBondContact O-N 3.23Å; F124-K126 VanDerWaalsContact C-N 3.34Å; F124-K126 PolarHBondContact O-N 3.45Å
127	Y	71.3	Confident	68.2	Low	138 Å²	138	83.1 Å²	83.1	54%	0.541	40%	0.402	S	S	.	.	H	α-helix	trans	-114.6	-13.6	-169.5	-58.7	-65	0	0	0	114.9	H123	H123-Y127 AromaticContact CD2-CD2 3.98Å; H123-Y127 AromaticContact CE1-CD2 3.57Å; H123-Y127 AromaticContact CG-CD2 3.82Å; H123-Y127 AromaticContact ND1-CD2 3.56Å; H123-Y127 AromaticContact ND1-CE2 3.89Å; H123-Y127 AromaticContact NE2-CD2 3.8Å; H123-Y127 WeakPolarHBondContact O-CD2 3.22Å; H123-Y127 PolarHBondContact O-N 2.97Å
128	H	74.1	Confident	68	Low	66 Å²	66	81.8 Å²	81.8	31%	0.306	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-117.6	-25	176.1	-61.7	-41	0	0	0	113.8	H123 F124	H123-H128 AromaticContact NE2-NE2 3.7Å; F124-H128 HydrophobicContact CD1-CB 4.03Å; F124-H128 HydrophobicContact CE1-CB 4.02Å; F124-H128 HydrophobicContact CG-CB 4.42Å; F124-H128 HydrophobicContact CZ-CB 4.42Å; F124-H128 WeakPolarHBondContact O-CA 3.34Å; F124-H128 WeakPolarHBondContact O-CB 3.27Å; F124-H128 PolarHBondContact O-N 2.58Å
129	L	72.4	Confident	67.6	Low	76 Å²	76	83 Å²	83	40%	0.398	40%	0.403	S	S	.	.	S	Bend	trans	-112.7	-7.1	179	-58.3	175	0	0	0	114.6	F124 R125 L131 L141 I145	F124-L129 HydrophobicContact CD1-CD1 3.89Å; F124-L129 HydrophobicContact CD1-CG 3.92Å; F124-L129 HydrophobicContact CE1-CD1 4.23Å; F124-L129 HydrophobicContact CE1-CD2 4.27Å; F124-L129 HydrophobicContact CE1-CG 4.08Å; F124-L129 PolarHBondContact O-N 3.37Å; F124-L129 VanDerWaalsContact O-N 3.1Å; R125-L129 CarbonylContact O-C 3.54Å; L129-L131 HydrophobicContact CB-CD1 4.15Å; L129-L131 HydrophobicContact CB-CG 4.18Å; L129-L131 HydrophobicContact CD1-CD1 4.49Å; L129-L131 PolarHBondContact O-N 3.19Å; L129-L131 VanDerWaalsContact O-N 3.07Å; L129-L141 HydrophobicContact CD1-CD1 4.38Å; L129-L141 HydrophobicContact CD1-CD2 3.8Å; L129-I145 HydrophobicContact CD1-CD1 4.25Å
130	G	62.9	Low	67.3	Low	54 Å²	54	82.9 Å²	82.9	56%	0.557	41%	0.411	S	S	*	.			trans	65.1	6	-177.8	0	0	0	0	0	115.6	R125 H132	R125-G130 PolarHBondContact O-N 3.34Å; R125-G130 VanDerWaalsContact O-N 3.07Å; G130-H132 PolarHBondContact O-N 3.05Å
131	L	71.6	Confident	67.1	Low	78 Å²	78	85.1 Å²	85.1	41%	0.408	42%	0.423	S	S	.	.			trans	-82.1	108.5	-173.6	-68.6	173.4	0	0	0	111.1	R125 L129	R125-L131 PolarHBondContact O-N 3.48Å; L129-L131 HydrophobicContact CB-CD1 4.15Å; L129-L131 HydrophobicContact CB-CG 4.18Å; L129-L131 HydrophobicContact CD1-CD1 4.49Å; L129-L131 PolarHBondContact O-N 3.19Å; L129-L131 VanDerWaalsContact O-N 3.07Å
132	H	60.3	Low	67	Low	142 Å²	142	85.3 Å²	85.3	66%	0.657	42%	0.423	S	S	*	.			trans	-101.2	-12.1	-179.6	-70.3	-10.5	0	0	0	115.2	G130	G130-H132 PolarHBondContact O-N 3.05Å
133	N	50.8	Low	67	Low	142 Å²	142	85.2 Å²	85.2	76%	0.759	43%	0.431	S	S	*	.	S	Bend	trans	-113.6	135.6	175.9	-69.7	-37.6	0	0	0	109.7
134	R	55.5	Low	66.5	Low	187 Å²	187	90.6 Å²	90.6	71%	0.706	46%	0.456	S	S	*	.			trans	-98.6	119.5	176.5	-158.6	-177.8	-168.9	-168.2	4.1	110	D138 D142	R134-D138 VanDerWaalsContact CA-OD2 3.3Å; R134-D138 WeakPolarHBondContact CA-OD2 3.21Å; R134-D138 HydrophobicContact CG-CB 3.92Å; R134-D142 IonicContact CZ-OD2 2.7Å; R134-D142 IonicContact NE-OD2 3.71Å; R134-D142 PolarHBondContact NE-OD2 2.96Å; R134-D142 IonicContact NH2-OD2 2.64Å; R134-D142 PolarHBondContact NH2-OD2 3.42Å
135	T	56.6	Low	66.2	Low	86 Å²	86	89.6 Å²	89.6	53%	0.528	45%	0.452	S	S	.	.			trans	-94.3	-174.2	174.4	69.1	0	0	0	0	110.5	D138	T135-D138 PolarHBondContact N-OD2 3.11Å; T135-D138 PolarHBondContact OG1-OD2 3.01Å; T135-D138 VanDerWaalsContact OG1-OD2 3.04Å
136	R	44.3	Very low	65.8	Low	247 Å²	247	91 Å²	91	93%	0.932	46%	0.461	S	S	*	.	S	Bend	trans	-80.9	-27.8	173.7	-101.7	-171.5	174.9	-136	2.2	114.1	D138	R136-D138 PolarHBondContact O-N 3.33Å
137	Q	52.6	Low	65.4	Low	120 Å²	120	89.2 Å²	89.2	56%	0.561	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.5	-19	179.5	-74.5	153.8	-20.3	0	0	112.4	A139 A140 T1029	Q137-A139 PolarHBondContact O-N 2.86Å; Q137-A139 VanDerWaalsContact O-N 3.11Å; Q137-A140 PolarHBondContact O-N 3.4Å; Q137-T1029 PolarHBondContact NE2-O 3.39Å
138	D	63.8	Low	65.1	Low	13 Å²	13	88.1 Å²	88.1	7%	0.07	47%	0.468	C	S	.	.	H	α-helix	trans	-59.7	-20.1	-178.4	-87.9	-46.3	0	0	0	116	R125 R134 T135 R136 A140 L141 D142	R125-D138 IonicContact CZ-OD1 3.17Å; R125-D138 IonicContact NH1-OD1 2.68Å; R125-D138 PolarHBondContact NH1-OD1 2.87Å; R125-D138 IonicContact NH1-OD2 3.26Å; R125-D138 PolarHBondContact NH2-O 2.96Å; R125-D138 IonicContact NH2-OD1 2.91Å; R125-D138 PolarHBondContact NH2-OD1 3.47Å; R134-D138 VanDerWaalsContact CA-OD2 3.3Å; R134-D138 WeakPolarHBondContact CA-OD2 3.21Å; R134-D138 HydrophobicContact CG-CB 3.92Å; T135-D138 PolarHBondContact N-OD2 3.11Å; T135-D138 PolarHBondContact OG1-OD2 3.01Å; T135-D138 VanDerWaalsContact OG1-OD2 3.04Å; R136-D138 PolarHBondContact O-N 3.33Å; D138-A140 VanDerWaalsContact C-N 3.32Å; D138-A140 PolarHBondContact O-N 3.02Å; D138-L141 PolarHBondContact O-N 3.4Å; D138-D142 PolarHBondContact O-N 3.27Å
139	A	65.6	Low	64.6	Low	60 Å²	60	86.5 Å²	86.5	50%	0.496	46%	0.46	S	S	.	.	H	α-helix	trans	-63.7	-35.5	179	0	0	0	0	0	112.8	Q137 D142 T143	Q137-A139 PolarHBondContact O-N 2.86Å; Q137-A139 VanDerWaalsContact O-N 3.11Å; A139-D142 PolarHBondContact O-N 3Å; A139-T143 PolarHBondContact O-N 2.98Å; A139-T143 VanDerWaalsContact O-N 3.07Å; A139-T143 PolarHBondContact O-OG1 3.42Å; A139-T143 VanDerWaalsContact O-OG1 3.12Å
140	A	67.3	Low	63.8	Low	66 Å²	66	89.5 Å²	89.5	55%	0.545	48%	0.476	S	S	.	.	H	α-helix	trans	-68.2	-40	176.2	0	0	0	0	0	111.5	Q137 D138 T143 Q144	Q137-A140 PolarHBondContact O-N 3.4Å; D138-A140 VanDerWaalsContact C-N 3.32Å; D138-A140 PolarHBondContact O-N 3.02Å; A140-T143 PolarHBondContact O-N 3.43Å; A140-Q144 WeakPolarHBondContact O-CG 3.12Å; A140-Q144 PolarHBondContact O-N 2.9Å
141	L	73.3	Confident	63.2	Low	51 Å²	51	91.2 Å²	91.2	27%	0.267	47%	0.471	S	S	.	.	H	α-helix	trans	-70.4	-32.3	176.5	-173.9	133.8	0	0	0	111.9	R125 L129 D138 Q144 I145	R125-L141 VanDerWaalsContact NH2-CD2 3.27Å; L129-L141 HydrophobicContact CD1-CD1 4.38Å; L129-L141 HydrophobicContact CD1-CD2 3.8Å; D138-L141 PolarHBondContact O-N 3.4Å; L141-Q144 PolarHBondContact O-N 3.11Å; L141-I145 HydrophobicContact CD2-CD1 3.58Å; L141-I145 HydrophobicContact CD2-CG1 4.44Å; L141-I145 HydrophobicContact CG-CD1 4.36Å; L141-I145 WeakPolarHBondContact O-CD1 3.45Å; L141-I145 VanDerWaalsContact O-CG1 3.27Å; L141-I145 WeakPolarHBondContact O-CG1 3.23Å; L141-I145 PolarHBondContact O-N 3.19Å
142	D	76.1	Confident	61.2	Low	12 Å²	12	93.7 Å²	93.7	6%	0.064	49%	0.489	C	S	.	.	H	α-helix	trans	-62.5	-45.9	169.9	-66.7	-20.1	0	0	0	111	V121 R125 R134 D138 A139 Q144 I145 L146	V121-D142 HydrophobicContact CG1-CB 4.09Å; V121-D142 WeakPolarHBondContact CG1-OD1 3.18Å; R125-D142 IonicContact CZ-OD1 2.73Å; R125-D142 IonicContact NE-OD1 3.65Å; R125-D142 PolarHBondContact NE-OD1 3.29Å; R125-D142 IonicContact NH2-OD1 3.06Å; R125-D142 PolarHBondContact NH2-OD1 3.42Å; R125-D142 IonicContact NH2-OD2 3.27Å; R134-D142 IonicContact CZ-OD2 2.7Å; R134-D142 IonicContact NE-OD2 3.71Å; R134-D142 PolarHBondContact NE-OD2 2.96Å; R134-D142 IonicContact NH2-OD2 2.64Å; R134-D142 PolarHBondContact NH2-OD2 3.42Å; D138-D142 PolarHBondContact O-N 3.27Å; A139-D142 PolarHBondContact O-N 3Å; D142-Q144 PolarHBondContact O-N 3.23Å; D142-I145 PolarHBondContact O-N 3.07Å; D142-L146 WeakPolarHBondContact O-CG 3.22Å; D142-L146 PolarHBondContact O-N 2.85Å
143	T	75.2	Confident	60	Low	97 Å²	97	92.5 Å²	92.5	60%	0.595	49%	0.494	S	S	*	.	H	α-helix	trans	-62.2	-40	174.5	-57.5	0	0	0	0	112	A139 A140 L146 A147	A139-T143 PolarHBondContact O-N 2.98Å; A139-T143 VanDerWaalsContact O-N 3.07Å; A139-T143 PolarHBondContact O-OG1 3.42Å; A139-T143 VanDerWaalsContact O-OG1 3.12Å; A140-T143 PolarHBondContact O-N 3.43Å; T143-L146 PolarHBondContact O-N 3.01Å; T143-A147 WeakPolarHBondContact O-CB 3.44Å; T143-A147 PolarHBondContact O-N 3.49Å
144	Q	70.4	Confident	58.8	Low	124 Å²	124	93.8 Å²	93.8	58%	0.579	50%	0.495	S	S	*	.	H	α-helix	trans	-66.1	-41.3	176.1	-75.1	174.2	-23.7	0	0	112.8	A140 L141 D142 L146 A147 L148	A140-Q144 WeakPolarHBondContact O-CG 3.12Å; A140-Q144 PolarHBondContact O-N 2.9Å; L141-Q144 PolarHBondContact O-N 3.11Å; D142-Q144 PolarHBondContact O-N 3.23Å; Q144-L146 VanDerWaalsContact C-N 3.28Å; Q144-L146 PolarHBondContact O-N 3.25Å; Q144-A147 PolarHBondContact O-N 3.01Å; Q144-L148 WeakPolarHBondContact O-CB 3.47Å; Q144-L148 WeakPolarHBondContact O-CG 3.41Å; Q144-L148 PolarHBondContact O-N 3.11Å
145	I	71.7	Confident	57.3	Low	5 Å²	5	94.1 Å²	94.1	3%	0.026	50%	0.504	C	S	.	.	H	α-helix	trans	-60.7	-39.9	173.4	-69.8	161.1	0	0	0	110.6	V121 F124 R125 L129 L141 D142 H149	V121-I145 HydrophobicContact CG1-CD1 4.47Å; V121-I145 HydrophobicContact CG2-CB 4.36Å; V121-I145 HydrophobicContact CG2-CG2 3.98Å; F124-I145 HydrophobicContact CB-CD1 4.15Å; F124-I145 HydrophobicContact CB-CG1 4.43Å; F124-I145 HydrophobicContact CB-CG2 3.9Å; F124-I145 HydrophobicContact CD1-CD1 4.1Å; F124-I145 HydrophobicContact CD1-CG1 3.99Å; F124-I145 HydrophobicContact CD2-CG2 4.21Å; F124-I145 HydrophobicContact CG-CD1 4.33Å; F124-I145 HydrophobicContact CG-CG1 4.19Å; F124-I145 HydrophobicContact CG-CG2 4.02Å; R125-I145 HydrophobicContact CG-CD1 4.24Å; L129-I145 HydrophobicContact CD1-CD1 4.25Å; L141-I145 HydrophobicContact CD2-CD1 3.58Å; L141-I145 HydrophobicContact CD2-CG1 4.44Å; L141-I145 HydrophobicContact CG-CD1 4.36Å; L141-I145 WeakPolarHBondContact O-CD1 3.45Å; L141-I145 VanDerWaalsContact O-CG1 3.27Å; L141-I145 WeakPolarHBondContact O-CG1 3.23Å; L141-I145 PolarHBondContact O-N 3.19Å; D142-I145 PolarHBondContact O-N 3.07Å; I145-H149 PolarHBondContact O-CD2 2.82Å; I145-H149 PolarHBondContact O-N 2.96Å
146	L	71.3	Confident	55.9	Low	47 Å²	47	95.6 Å²	95.6	25%	0.246	51%	0.514	C	S	.	.	H	α-helix	trans	-73.2	-34.9	178.7	-67.2	172.9	0	0	0	112.8	P117 V121 D142 T143 Q144 H149 N150	P117-L146 HydrophobicContact CB-CD1 4.25Å; P117-L146 HydrophobicContact CB-CD2 3.56Å; V121-L146 HydrophobicContact CG2-CD1 4.12Å; V121-L146 HydrophobicContact CG2-CD2 3.74Å; V121-L146 HydrophobicContact CG2-CG 3.71Å; D142-L146 WeakPolarHBondContact O-CG 3.22Å; D142-L146 PolarHBondContact O-N 2.85Å; T143-L146 PolarHBondContact O-N 3.01Å; Q144-L146 VanDerWaalsContact C-N 3.28Å; Q144-L146 PolarHBondContact O-N 3.25Å; L146-H149 CarbonylContact O-C 3.45Å; L146-H149 PolarHBondContact O-N 2.93Å; L146-N150 PolarHBondContact O-N 3.17Å
147	A	67.1	Low	55.1	Low	62 Å²	62	91.3 Å²	91.3	51%	0.512	51%	0.509	S	S	.	.	H	α-helix	trans	-65.1	-43.2	171.9	0	0	0	0	0	111.9	T143 Q144 H149 N150	T143-A147 WeakPolarHBondContact O-CB 3.44Å; T143-A147 PolarHBondContact O-N 3.49Å; Q144-A147 PolarHBondContact O-N 3.01Å; A147-H149 PolarHBondContact O-N 3.03Å; A147-N150 PolarHBondContact O-N 2.94Å; A147-N150 PolarHBondContact O-OD1 2.85Å
148	L	63.7	Low	53.8	Low	116 Å²	116	94.4 Å²	94.4	61%	0.607	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.4	-12.5	173.1	-80	163.8	0	0	0	114.2	N106 Q144	N106-L148 PolarHBondContact ND2-O 2.9Å; Q144-L148 WeakPolarHBondContact O-CB 3.47Å; Q144-L148 WeakPolarHBondContact O-CG 3.41Å; Q144-L148 PolarHBondContact O-N 3.11Å
149	H	63.7	Low	51.9	Low	31 Å²	31	96.9 Å²	96.9	14%	0.144	56%	0.557	C	S	.	*	T	Hydrogen-bonded Turn	trans	-115.4	18.2	175.9	-64.7	-44.8	0	0	0	113.3	N106 L120 F124 I145 L146 A147	N106-H149 VanDerWaalsContact CG-ND1 3.34Å; N106-H149 PolarHBondContact N-CE1 3.46Å; N106-H149 PolarHBondContact ND2-ND1 3.48Å; L120-H149 HydrophobicContact CD2-CB 3.88Å; F124-H149 AromaticContact CD2-NE2 3.49Å; F124-H149 WeakPolarHBondContact CD2-NE2 3.5Å; F124-H149 AromaticContact CE2-NE2 3.67Å; I145-H149 PolarHBondContact O-CD2 2.82Å; I145-H149 PolarHBondContact O-N 2.96Å; L146-H149 CarbonylContact O-C 3.45Å; L146-H149 PolarHBondContact O-N 2.93Å; A147-H149 PolarHBondContact O-N 3.03Å
150	N	55.2	Low	50.1	Low	139 Å²	139	103.9 Å²	103.9	74%	0.743	58%	0.579	S	S	*	*			trans	48.2	89.4	165.8	-82	-23.8	0	0	0	117.1	L146 A147	L146-N150 PolarHBondContact O-N 3.17Å; A147-N150 PolarHBondContact O-N 2.94Å; A147-N150 PolarHBondContact O-OD1 2.85Å
151	M	51.9	Low	48.1	Very low	91 Å²	91	104.6 Å²	104.6	45%	0.448	59%	0.594	S	S	.	*			trans	-113.2	95.2	168.1	-72.1	-82.1	-142.1	0	0	110.7	F103 P117	F103-M151 HydrophobicContact CD1-CE 4.18Å; F103-M151 HydrophobicContact CE1-CE 3.28Å; F103-M151 HydrophobicContact CE1-SD 4.01Å; F103-M151 HydrophobicContact CZ-CE 3.58Å; P117-M151 HydrophobicContact CB-CE 4.43Å
152	V	28.4	Very low	45.9	Very low	129 Å²	129	107.2 Å²	107.2	78%	0.782	62%	0.623	S	S	*	*			trans	-138.5	115.9	172.3	-179.9	0	0	0	0	110.5
153	P	35.1	Very low	43.5	Very low	117 Å²	117	118.1 Å²	118.1	76%	0.76	66%	0.663	S	S	*	*			trans	-88	126.6	168.7	32.8	-29.7	0	0	0	111.5
154	Q	26	Very low	41.1	Very low	169 Å²	169	119 Å²	119	79%	0.79	67%	0.673	S	S	*	*			trans	32.8	118.3	158.1	-56.4	-169.2	8.8	0	0	119.8
155	H	24.6	Very low	39	Very low	194 Å²	194	120.8 Å²	120.8	90%	0.898	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-102.1	132.2	134.8	-96	-99.8	0	0	0	109.1
156	T	26.1	Very low	36.9	Very low	118 Å²	118	127.1 Å²	127.1	72%	0.724	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-77.2	151.4	174.3	40.6	0	0	0	0	111.1
157	N	27.5	Very low	34.8	Very low	156 Å²	156	132.6 Å²	132.6	83%	0.834	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-67.3	133.8	177.8	-75.6	-70.9	0	0	0	111.9
158	L	25.6	Very low	32.9	Very low	186 Å²	186	135.8 Å²	135.8	97%	0.974	75%	0.746	S	S	*	*			trans	-102.5	113.4	139.2	-76.3	169.8	0	0	0	105.7
159	G	25.4	Very low	31.1	Very low	64 Å²	64	137 Å²	137	66%	0.66	75%	0.753	S	S	*	*			trans	-120.6	176	-170	0	0	0	0	0	113.4
160	Q	26.5	Very low	29.5	Very low	207 Å²	207	138.1 Å²	138.1	97%	0.967	77%	0.772	S	S	*	*			trans	-143.9	141.4	160.9	-94.8	165.1	-0.5	0	0	107
161	G	25.4	Very low	28.5	Very low	82 Å²	82	140.8 Å²	140.8	85%	0.845	78%	0.777	S	S	*	*			trans	-122.3	165.7	-169.7	0	0	0	0	0	113.6
162	A	27	Very low	27.2	Very low	106 Å²	106	142.3 Å²	142.3	88%	0.876	79%	0.792	S	S	*	*			trans	-150.6	161.6	167.7	0	0	0	0	0	112.1
163	R	26.5	Very low	27.2	Very low	241 Å²	241	146.8 Å²	146.8	91%	0.909	80%	0.795	S	S	*	*			trans	-62	166.9	172.5	-61.4	164.1	173.6	157	-5.5	110.3
164	S	24.8	Very low	26.7	Very low	115 Å²	115	145.1 Å²	145.1	80%	0.804	79%	0.791	S	S	*	*			cis	-158.3	179.9	27	-153	0	0	0	0	114.5
165	Q	26.8	Very low	26.6	Very low	162 Å²	162	142.7 Å²	142.7	76%	0.757	78%	0.783	S	S	*	*			trans	-81.4	155	176.9	-53.8	170.2	5.5	0	0	113
166	T	26.4	Very low	26.8	Very low	137 Å²	137	136.9 Å²	136.9	84%	0.84	78%	0.776	S	S	*	*				162.7	171.2	119.1	38.3	0	0	0	0	112.1
167	K	28.3	Very low	27.1	Very low	162 Å²	162	138.9 Å²	138.9	70%	0.704	78%	0.777	S	S	*	*				-167.4	162.5	-62.9	-150.6	177.3	-179.9	-110.3	0	109.6
168	E	26.1	Very low	27	Very low	130 Å²	130	139.3 Å²	139.3	61%	0.607	78%	0.779	S	S	*	*			trans	65.5	174.1	168.6	-50.2	-52.7	147.1	0	0	117.3
169	L	26.7	Very low	27.1	Very low	142 Å²	142	137 Å²	137	74%	0.743	76%	0.764	S	S	*	*			cis	-175.7	152.4	-48.4	-173.4	70.7	0	0	0	108
170	G	29.9	Very low	27.5	Very low	53 Å²	53	141.7 Å²	141.7	55%	0.546	77%	0.768	S	S	.	*			cis	146.8	144.1	-11.6	0	0	0	0	0	114
171	K	32.9	Very low	27.5	Very low	196 Å²	196	140.3 Å²	140.3	85%	0.852	76%	0.762	S	S	*	*			trans	83.8	161	179.1	-48.3	160.1	-179.4	171.1	0	115
172	T	26.1	Very low	27.7	Very low	123 Å²	123	146.7 Å²	146.7	76%	0.755	76%	0.761	S	S	*	*			cis	-128.9	147.3	1.8	43.9	0	0	0	0	110.6
173	R	27	Very low	27.7	Very low	222 Å²	222	147.9 Å²	147.9	84%	0.838	76%	0.757	S	S	*	*				59	137.3	75.6	-120.1	-168.8	170.2	165.2	-0.1	114.5
174	A	24.9	Very low	27.9	Very low	82 Å²	82	142.3 Å²	142.3	68%	0.678	75%	0.749	S	S	*	*			cis	-147.5	166.5	16.3	0	0	0	0	0	116.9
175	D	24.3	Very low	28.5	Very low	118 Å²	118	144.9 Å²	144.9	63%	0.631	75%	0.751	S	S	*	*			trans	-24.6	163.2	154.4	-53.6	-83.3	0	0	0	117.6
176	G	28.4	Very low	28.6	Very low	73 Å²	73	144.9 Å²	144.9	75%	0.753	75%	0.753	S	S	*	*			cis	146.2	-177.8	7	0	0	0	0	0	109.9
177	Q	33.2	Very low	28.9	Very low	160 Å²	160	144.4 Å²	144.4	75%	0.748	75%	0.745	S	S	*	*			cis	-154.7	151.4	-5.8	-56.6	178.4	-96.5	0	0	109.3
178	N	24.2	Very low	29.8	Very low	164 Å²	164	139.1 Å²	139.1	88%	0.877	74%	0.736	S	S	*	*			trans	-149.1	152.7	143.8	-154.3	-10.6	0	0	0	110.5
179	Q	29.1	Very low	30.7	Very low	139 Å²	139	135.5 Å²	135.5	65%	0.65	73%	0.729	S	S	*	*			trans	-159.7	144	-158.3	-137.3	-167.8	54	0	0	106.1
180	Q	32.3	Very low	32	Very low	161 Å²	161	135.1 Å²	135.1	75%	0.752	72%	0.719	S	S	*	*			cis	-147	172.3	38.1	-81.5	176.7	12.4	0	0	108.3
181	Q	26.8	Very low	33.6	Very low	179 Å²	179	136.3 Å²	136.3	84%	0.836	71%	0.712	S	S	*	*			cis	-148.6	147	41	-160.2	173.8	21.6	0	0	112.8
182	R	30.6	Very low	35.5	Very low	216 Å²	216	129.8 Å²	129.8	82%	0.815	69%	0.686	S	S	*	*			trans	-141.1	128.4	-173.8	-163.4	-171.8	-160.4	-160.2	8.8	109.1
183	T	26.7	Very low	37.9	Very low	131 Å²	131	130.4 Å²	130.4	80%	0.804	68%	0.68	S	S	*	*			trans	-130	80.6	171.1	-45	0	0	0	0	106.5
184	V	30.8	Very low	40.4	Very low	123 Å²	123	120.1 Å²	120.1	75%	0.745	64%	0.642	S	S	*	*				71.9	116.7	95.5	173.3	0	0	0	0	111
185	M	37.3	Very low	43.1	Very low	170 Å²	170	120.1 Å²	120.1	84%	0.837	63%	0.634	S	S	*	*			trans	-93.4	143	-171.6	-52.7	173.5	-170.7	0	0	111.6
186	M	29.5	Very low	45.5	Very low	162 Å²	162	116.8 Å²	116.8	80%	0.798	62%	0.616	S	S	*	*			trans	-158.4	135.5	156.6	-110.4	-67.5	174.3	0	0	110.5
187	N	32.9	Very low	47.5	Very low	127 Å²	127	116.7 Å²	116.7	68%	0.679	62%	0.615	S	S	*	*	S	Bend	trans	52.1	76.9	161	-62.3	-18.8	0	0	0	120.2
188	G	46.5	Very low	49.4	Very low	50 Å²	50	112.7 Å²	112.7	52%	0.515	62%	0.616	S	S	.	*	S	Bend	trans	76.7	106.3	136.5	0	0	0	0	0	118
189	A	44.4	Very low	51.7	Low	55 Å²	55	107 Å²	107	46%	0.455	59%	0.588	S	S	.	*			trans	73.5	141.3	175.5	0	0	0	0	0	118	K206 T207	A189-K206 CarbonylContact C-O 3.59Å; A189-K206 WeakPolarHBondContact CA-O 3.41Å; A189-K206 WeakPolarHBondContact CB-O 3.47Å; A189-T207 HydrophobicContact CB-CG2 4.28Å
190	Y	54.8	Low	54.1	Low	134 Å²	134	102.3 Å²	102.3	53%	0.525	57%	0.567	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-138.6	150	177.8	57	-93.3	0	0	0	113.5	I192 K206	Y190-I192 HydrophobicContact CD2-CD1 4.42Å; Y190-I192 HydrophobicContact CD2-CG1 3.79Å; Y190-I192 HydrophobicContact CE2-CD1 3.92Å; Y190-I192 HydrophobicContact CE2-CG1 3.76Å; Y190-K206 HydrophobicContact CD1-CB 4.49Å; Y190-K206 HydrophobicContact CD2-CB 4.11Å; Y190-K206 HydrophobicContact CE1-CB 4.29Å; Y190-K206 HydrophobicContact CE1-CD 4.23Å; Y190-K206 HydrophobicContact CE2-CB 3.88Å; Y190-K206 HydrophobicContact CE2-CD 3.84Å; Y190-K206 HydrophobicContact CE2-CG 4.48Å; Y190-K206 HydrophobicContact CG-CB 4.43Å; Y190-K206 VanDerWaalsContact CZ-CD 3.49Å; Y190-K206 PolarHBondContact N-O 3.09Å; Y190-K206 PolarHBondContact O-N 3.25Å; Y190-K206 WeakPolarHBondContact OH-CD 3.2Å
191	D	62.8	Low	56.6	Low	78 Å²	78	94.6 Å²	94.6	42%	0.417	53%	0.531	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.7	103.8	-177.6	-77.3	21.9	0	0	0	109.9	I203 G204 R205	D191-I203 HydrophobicContact CB-CG2 3.71Å; D191-G204 CarbonylContact C-O 3.59Å; D191-R205 VanDerWaalsContact CG-NE 3.32Å; D191-R205 VanDerWaalsContact OD1-CD 3.28Å; D191-R205 WeakPolarHBondContact OD1-CD 3.45Å; D191-R205 WeakPolarHBondContact OD1-CG 3.39Å; D191-R205 IonicContact OD1-CZ 2.68Å; D191-R205 IonicContact OD1-NE 3.15Å; D191-R205 PolarHBondContact OD1-NE 3.26Å; D191-R205 IonicContact OD1-NH2 2.79Å; D191-R205 IonicContact OD2-CZ 2.7Å; D191-R205 IonicContact OD2-NE 2.64Å; D191-R205 PolarHBondContact OD2-NE 2.97Å; D191-R205 IonicContact OD2-NH2 3.49Å; D191-R205 PolarHBondContact OD2-NH2 3.46Å
192	I	73.8	Confident	59.3	Low	59 Å²	59	86.1 Å²	86.1	30%	0.303	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	124.7	173.9	-54.7	178.3	0	0	0	108.7	Y190 I203 G204 K206 T214	Y190-I192 HydrophobicContact CD2-CD1 4.42Å; Y190-I192 HydrophobicContact CD2-CG1 3.79Å; Y190-I192 HydrophobicContact CE2-CD1 3.92Å; Y190-I192 HydrophobicContact CE2-CG1 3.76Å; I192-I203 CarbonylContact O-C 3.41Å; I192-I203 WeakPolarHBondContact O-CA 3.26Å; I192-G204 PolarHBondContact N-O 3.3Å; I192-G204 PolarHBondContact O-N 3.1Å; I192-K206 HydrophobicContact CD1-CB 4.23Å; I192-K206 HydrophobicContact CD1-CD 4.2Å; I192-T214 HydrophobicContact CD1-CG2 3.94Å
193	Q	76.3	Confident	61.7	Low	135 Å²	135	79 Å²	79	63%	0.631	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.9	130.2	172	-73.2	-174.1	54.8	0	0	110.4	L200	Q193-L200 HydrophobicContact CB-CD1 3.64Å; Q193-L200 HydrophobicContact CG-CD1 3.95Å
194	V	78.4	Confident	64.1	Low	7 Å²	7	72.8 Å²	72.8	4%	0.042	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	119.8	176.6	-178.3	0	0	0	0	109.2	I201 G202 F217 L234 E235	V194-I201 HydrophobicContact CB-CG1 4.23Å; V194-I201 HydrophobicContact CG1-CD1 3.87Å; V194-I201 HydrophobicContact CG1-CG1 3.8Å; V194-I201 VanDerWaalsContact O-CG1 3.26Å; V194-I201 WeakPolarHBondContact O-CG1 3.29Å; V194-I201 PolarHBondContact O-N 3.42Å; V194-G202 PolarHBondContact N-O 3.48Å; V194-G202 PolarHBondContact O-N 3.33Å; V194-F217 HydrophobicContact CG2-CD1 3.67Å; V194-F217 HydrophobicContact CG2-CE1 3.59Å; V194-L234 HydrophobicContact CB-CD2 3.84Å; V194-L234 HydrophobicContact CG1-CD2 4.03Å; V194-L234 HydrophobicContact CG2-CD2 3.99Å; V194-E235 HydrophobicContact CG1-CG 4.1Å
195	T	81.4	Confident	65.8	Low	81 Å²	81	71.5 Å²	71.5	50%	0.497	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	134	-177.6	48.3	0	0	0	0	111.4	T199 L200	T195-T199 CarbonylContact C-O 3.56Å; T195-T199 WeakPolarHBondContact CA-O 3.49Å; T195-L200 HydrophobicContact CG2-CB 4.24Å; T195-L200 HydrophobicContact CG2-CD1 4.09Å
196	L	76	Confident	66.6	Low	49 Å²	49	65.6 Å²	65.6	26%	0.257	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	127.2	172.9	-168.4	70.6	0	0	0	108.8	G198 T199 I201 E235 F238 L239	L196-G198 PolarHBondContact O-N 3.42Å; L196-T199 PolarHBondContact N-O 3.47Å; L196-T199 WeakPolarHBondContact O-CB 3.15Å; L196-T199 PolarHBondContact O-N 3.32Å; L196-I201 HydrophobicContact CB-CD1 4.19Å; L196-I201 HydrophobicContact CB-CG2 4.04Å; L196-E235 HydrophobicContact CD1-CG 4.38Å; L196-F238 HydrophobicContact CD2-CD1 4.03Å; L196-L239 HydrophobicContact CD2-CD1 4.15Å; L196-L239 HydrophobicContact CD2-CD2 3.81Å; L196-L239 HydrophobicContact CD2-CG 3.86Å
197	G	69.9	Low	67.6	Low	70 Å²	70	59.8 Å²	59.8	72%	0.722	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	33	-175.5	0	0	0	0	0	114.1	T199	G197-T199 PolarHBondContact O-N 3.25Å
198	G	72	Confident	68.2	Low	76 Å²	76	57.9 Å²	57.9	78%	0.784	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	76.2	-8.4	-173.7	0	0	0	0	0	115.4	L196	L196-G198 PolarHBondContact O-N 3.42Å
199	T	72.8	Confident	68.2	Low	46 Å²	46	60.5 Å²	60.5	28%	0.282	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	127.6	176.2	-67.1	0	0	0	0	110.7	T195 L196 G197 I201 F221	T195-T199 CarbonylContact C-O 3.56Å; T195-T199 WeakPolarHBondContact CA-O 3.49Å; L196-T199 PolarHBondContact N-O 3.47Å; L196-T199 WeakPolarHBondContact O-CB 3.15Å; L196-T199 PolarHBondContact O-N 3.32Å; G197-T199 PolarHBondContact O-N 3.25Å; T199-I201 HydrophobicContact CG2-CG2 4.44Å; T199-I201 PolarHBondContact O-N 3.33Å; T199-I201 VanDerWaalsContact O-N 3.16Å; T199-F221 HydrophobicContact CG2-CE2 4.5Å; T199-F221 HydrophobicContact CG2-CZ 4.2Å
200	L	81.3	Confident	68	Low	39 Å²	39	63.3 Å²	63.3	20%	0.204	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	104.3	173.6	179.7	65.2	0	0	0	110.9	Q193 T195 G202 K220	Q193-L200 HydrophobicContact CB-CD1 3.64Å; Q193-L200 HydrophobicContact CG-CD1 3.95Å; T195-L200 HydrophobicContact CG2-CB 4.24Å; T195-L200 HydrophobicContact CG2-CD1 4.09Å; L200-G202 WeakPolarHBondContact CD1-O 3.42Å; L200-K220 HydrophobicContact CD2-CD 4.38Å; L200-K220 HydrophobicContact CG-CD 4.25Å; L200-K220 VanDerWaalsContact O-CD 3.31Å; L200-K220 WeakPolarHBondContact O-CD 3.1Å
201	I	83.4	Confident	67.4	Low	0 Å²	0	65.9 Å²	65.9	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	-23.2	-175.8	63.9	162.9	0	0	0	113.7	V194 L196 T199 K220 F221 L234 E235 F238	V194-I201 HydrophobicContact CB-CG1 4.23Å; V194-I201 HydrophobicContact CG1-CD1 3.87Å; V194-I201 HydrophobicContact CG1-CG1 3.8Å; V194-I201 VanDerWaalsContact O-CG1 3.26Å; V194-I201 WeakPolarHBondContact O-CG1 3.29Å; V194-I201 PolarHBondContact O-N 3.42Å; L196-I201 HydrophobicContact CB-CD1 4.19Å; L196-I201 HydrophobicContact CB-CG2 4.04Å; T199-I201 HydrophobicContact CG2-CG2 4.44Å; T199-I201 PolarHBondContact O-N 3.33Å; T199-I201 VanDerWaalsContact O-N 3.16Å; I201-K220 VanDerWaalsContact O-CB 3.31Å; I201-K220 WeakPolarHBondContact O-CB 3.43Å; I201-K220 PolarHBondContact O-N 2.68Å; I201-F221 HydrophobicContact CG2-CE2 4.42Å; I201-L234 HydrophobicContact CD1-CG 3.97Å; I201-L234 HydrophobicContact CG1-CD2 4.44Å; I201-L234 HydrophobicContact CG1-CG 4.33Å; I201-E235 HydrophobicContact CD1-CB 4.19Å; I201-E235 HydrophobicContact CD1-CG 3.56Å; I201-F238 HydrophobicContact CB-CB 4.33Å; I201-F238 HydrophobicContact CB-CD1 4.34Å; I201-F238 HydrophobicContact CB-CD2 4.2Å; I201-F238 HydrophobicContact CB-CG 4.03Å; I201-F238 HydrophobicContact CD1-CB 4.04Å; I201-F238 HydrophobicContact CD1-CG 4.44Å; I201-F238 HydrophobicContact CG2-CB 4.35Å; I201-F238 HydrophobicContact CG2-CD1 3.47Å; I201-F238 VanDerWaalsContact CG2-CD1 3.47Å; I201-F238 HydrophobicContact CG2-CD2 3.89Å; I201-F238 HydrophobicContact CG2-CE1 3.58Å; I201-F238 HydrophobicContact CG2-CE2 4.03Å; I201-F238 HydrophobicContact CG2-CG 3.62Å; I201-F238 HydrophobicContact CG2-CZ 3.87Å
202	G	83	Confident	66.7	Low	0 Å²	0	64 Å²	64	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-179.4	-172.7	178.7	0	0	0	0	0	114.5	V194 L200 R218	V194-G202 PolarHBondContact N-O 3.48Å; V194-G202 PolarHBondContact O-N 3.33Å; L200-G202 WeakPolarHBondContact CD1-O 3.42Å; G202-R218 CarbonylContact C-O 3.57Å; G202-R218 WeakPolarHBondContact CA-O 3.48Å
203	I	81.5	Confident	65.7	Low	67 Å²	67	65.5 Å²	65.5	34%	0.344	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	129.2	-177.8	-56.8	176.8	0	0	0	109.1	D191 I192 R218	D191-I203 HydrophobicContact CB-CG2 3.71Å; I192-I203 CarbonylContact O-C 3.41Å; I192-I203 WeakPolarHBondContact O-CA 3.26Å; I203-R218 PolarHBondContact N-O 3.13Å; I203-R218 PolarHBondContact O-N 2.89Å
204	G	78.3	Confident	64.9	Low	0 Å²	0	59.7 Å²	59.7	0%	0	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	132	171.2	0	0	0	0	0	111.8	D191 I192 Y216	D191-G204 CarbonylContact C-O 3.59Å; I192-G204 PolarHBondContact N-O 3.3Å; I192-G204 PolarHBondContact O-N 3.1Å; G204-Y216 CarbonylContact C-O 3.48Å; G204-Y216 VanDerWaalsContact CA-O 3.28Å; G204-Y216 WeakPolarHBondContact CA-O 3.42Å
205	R	64.8	Low	64	Low	97 Å²	97	63.6 Å²	63.6	37%	0.366	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.9	125.5	174.2	-71.1	-136.6	162	103	6.7	110.8	D191 T214 K215 Y216	D191-R205 VanDerWaalsContact CG-NE 3.32Å; D191-R205 VanDerWaalsContact OD1-CD 3.28Å; D191-R205 WeakPolarHBondContact OD1-CD 3.45Å; D191-R205 WeakPolarHBondContact OD1-CG 3.39Å; D191-R205 IonicContact OD1-CZ 2.68Å; D191-R205 IonicContact OD1-NE 3.15Å; D191-R205 PolarHBondContact OD1-NE 3.26Å; D191-R205 IonicContact OD1-NH2 2.79Å; D191-R205 IonicContact OD2-CZ 2.7Å; D191-R205 IonicContact OD2-NE 2.64Å; D191-R205 PolarHBondContact OD2-NE 2.97Å; D191-R205 IonicContact OD2-NH2 3.49Å; D191-R205 PolarHBondContact OD2-NH2 3.46Å; R205-T214 CarbonylContact O-C 3.38Å; R205-T214 WeakPolarHBondContact O-CA 3.47Å; R205-K215 PolarHBondContact O-N 3.08Å; R205-Y216 HydrophobicContact CB-CE1 4.26Å; R205-Y216 HydrophobicContact CB-CE2 4.13Å; R205-Y216 WeakPolarHBondContact CD-OH 3.44Å; R205-Y216 HydrophobicContact CG-CE2 3.79Å; R205-Y216 PolarHBondContact N-O 2.91Å; R205-Y216 PolarHBondContact NH1-OH 3.42Å; R205-Y216 VanDerWaalsContact NH1-OH 3.08Å
206	K	54.4	Low	63.6	Low	46 Å²	46	62.1 Å²	62.1	20%	0.2	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	121	175	-146.5	-175.9	-149.4	-174.8	0	110.2	A189 Y190 I192 G212 N213 T214	A189-K206 CarbonylContact C-O 3.59Å; A189-K206 WeakPolarHBondContact CA-O 3.41Å; A189-K206 WeakPolarHBondContact CB-O 3.47Å; Y190-K206 HydrophobicContact CD1-CB 4.49Å; Y190-K206 HydrophobicContact CD2-CB 4.11Å; Y190-K206 HydrophobicContact CE1-CB 4.29Å; Y190-K206 HydrophobicContact CE1-CD 4.23Å; Y190-K206 HydrophobicContact CE2-CB 3.88Å; Y190-K206 HydrophobicContact CE2-CD 3.84Å; Y190-K206 HydrophobicContact CE2-CG 4.48Å; Y190-K206 HydrophobicContact CG-CB 4.43Å; Y190-K206 VanDerWaalsContact CZ-CD 3.49Å; Y190-K206 PolarHBondContact N-O 3.09Å; Y190-K206 PolarHBondContact O-N 3.25Å; Y190-K206 WeakPolarHBondContact OH-CD 3.2Å; I192-K206 HydrophobicContact CD1-CB 4.23Å; I192-K206 HydrophobicContact CD1-CD 4.2Å; K206-G212 WeakPolarHBondContact CE-O 3.37Å; K206-G212 PolarHBondContact NZ-O 3Å; K206-N213 VanDerWaalsContact CG-O 3.31Å; K206-N213 WeakPolarHBondContact CG-O 3.49Å; K206-T214 HydrophobicContact CB-CG2 4.22Å; K206-T214 HydrophobicContact CG-CG2 4.09Å
207	T	50.7	Low	63.9	Low	40 Å²	40	60.2 Å²	60.2	25%	0.245	36%	0.359	C	S	.	.			trans	-86	163	173.5	44.1	0	0	0	0	111.2	A189 D209 K215	A189-T207 HydrophobicContact CB-CG2 4.28Å; T207-D209 VanDerWaalsContact C-N 3.3Å; T207-D209 VanDerWaalsContact CB-OD2 3.31Å; T207-D209 WeakPolarHBondContact CB-OD2 3.09Å; T207-K215 HydrophobicContact CG2-CD 4.05Å
208	S	46.3	Very low	64.4	Low	87 Å²	87	62.1 Å²	62.1	61%	0.608	35%	0.345	S	S	*	.	S	Bend	trans	-82.6	-12	-179.5	32.2	0	0	0	0	113.6	C210	S208-C210 PolarHBondContact O-N 2.91Å
209	D	46.8	Very low	64.9	Low	104 Å²	104	58.5 Å²	58.5	56%	0.556	31%	0.308	S	S	*	.	S	Bend	trans	-98.9	91.1	-157.7	9.4	-56.7	0	0	0	108.9	T207	T207-D209 VanDerWaalsContact C-N 3.3Å; T207-D209 VanDerWaalsContact CB-OD2 3.31Å; T207-D209 WeakPolarHBondContact CB-OD2 3.09Å
210	C	39.7	Very low	65.2	Low	115 Å²	115	62.1 Å²	62.1	78%	0.777	32%	0.32	S	S	*	.	S	Bend	trans	71.1	133.5	176.3	-62.6	0	0	0	0	117.7	S208 G212	S208-C210 PolarHBondContact O-N 2.91Å; C210-G212 PolarHBondContact O-N 3.05Å
211	Q	42.2	Very low	64.9	Low	188 Å²	188	63.3 Å²	63.3	88%	0.879	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.3	2.1	163.5	-65.3	-175.2	-14.8	0	0	119.6	N213	Q211-N213 PolarHBondContact O-N 3.43Å
212	G	48	Very low	64.7	Low	39 Å²	39	65.9 Å²	65.9	40%	0.402	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	66.6	36.6	161.1	0	0	0	0	0	114.9	K206 C210	K206-G212 WeakPolarHBondContact CE-O 3.37Å; K206-G212 PolarHBondContact NZ-O 3Å; C210-G212 PolarHBondContact O-N 3.05Å
213	N	52	Low	64.2	Low	90 Å²	90	70.2 Å²	70.2	48%	0.481	36%	0.364	S	S	.	.			trans	-95.1	159.8	164.5	-73.7	-36.4	0	0	0	111.1	K206 Q211	K206-N213 VanDerWaalsContact CG-O 3.31Å; K206-N213 WeakPolarHBondContact CG-O 3.49Å; Q211-N213 PolarHBondContact O-N 3.43Å
214	T	59.8	Low	63.8	Low	13 Å²	13	72.5 Å²	72.5	8%	0.08	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.3	138	170	34.8	0	0	0	0	111.1	I192 R205 K206 F217 G228 S229	I192-T214 HydrophobicContact CD1-CG2 3.94Å; R205-T214 CarbonylContact O-C 3.38Å; R205-T214 WeakPolarHBondContact O-CA 3.47Å; K206-T214 HydrophobicContact CB-CG2 4.22Å; K206-T214 HydrophobicContact CG-CG2 4.09Å; T214-F217 HydrophobicContact CG2-CE1 4.24Å; T214-F217 HydrophobicContact CG2-CE2 4.05Å; T214-F217 HydrophobicContact CG2-CZ 3.66Å; T214-F217 WeakPolarHBondContact OG1-CE2 3.38Å; T214-F217 WeakPolarHBondContact OG1-CZ 3.36Å; T214-G228 PolarHBondContact OG1-O 3.46Å; T214-S229 PolarHBondContact OG1-O 3.25Å
215	K	60.3	Low	63.8	Low	88 Å²	88	75 Å²	75	38%	0.383	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.2	-33.6	179.2	-167.4	177.8	-175.1	177.2	0	112.1	V107 R205 T207	V107-K215 PolarHBondContact O-NZ 3.42Å; R205-K215 PolarHBondContact O-N 3.08Å; T207-K215 HydrophobicContact CG2-CD 4.05Å
216	Y	72.8	Confident	64.2	Low	51 Å²	51	72.8 Å²	72.8	20%	0.2	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-166.6	155.6	170.5	54.3	-94	0	0	0	112.3	G204 R205 T225 Y226	G204-Y216 CarbonylContact C-O 3.48Å; G204-Y216 VanDerWaalsContact CA-O 3.28Å; G204-Y216 WeakPolarHBondContact CA-O 3.42Å; R205-Y216 HydrophobicContact CB-CE1 4.26Å; R205-Y216 HydrophobicContact CB-CE2 4.13Å; R205-Y216 WeakPolarHBondContact CD-OH 3.44Å; R205-Y216 HydrophobicContact CG-CE2 3.79Å; R205-Y216 PolarHBondContact N-O 2.91Å; R205-Y216 PolarHBondContact NH1-OH 3.42Å; R205-Y216 VanDerWaalsContact NH1-OH 3.08Å; Y216-T225 HydrophobicContact CD2-CG2 3.74Å; Y216-T225 HydrophobicContact CG-CG2 3.95Å; Y216-Y226 CarbonylContact C-O 3.48Å; Y216-Y226 WeakPolarHBondContact CA-O 3.45Å; Y216-Y226 VanDerWaalsContact CB-O 3.22Å; Y216-Y226 WeakPolarHBondContact CB-O 3.48Å
217	F	81.8	Confident	65	Low	8 Å²	8	78.6 Å²	78.6	4%	0.035	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	136	166.5	-71	-83.4	0	0	0	110.8	V194 T214 T225 Y226 G228 N230 L234	V194-F217 HydrophobicContact CG2-CD1 3.67Å; V194-F217 HydrophobicContact CG2-CE1 3.59Å; T214-F217 HydrophobicContact CG2-CE1 4.24Å; T214-F217 HydrophobicContact CG2-CE2 4.05Å; T214-F217 HydrophobicContact CG2-CZ 3.66Å; T214-F217 WeakPolarHBondContact OG1-CE2 3.38Å; T214-F217 WeakPolarHBondContact OG1-CZ 3.36Å; F217-T225 CarbonylContact O-C 3.55Å; F217-T225 VanDerWaalsContact O-CA 3.28Å; F217-T225 WeakPolarHBondContact O-CA 3.31Å; F217-Y226 PolarHBondContact N-O 2.79Å; F217-Y226 PolarHBondContact O-N 3.05Å; F217-G228 WeakPolarHBondContact CE2-O 3.45Å; F217-N230 WeakPolarHBondContact CD2-O 3.45Å; F217-N230 WeakPolarHBondContact CE2-O 3.11Å; F217-L234 HydrophobicContact CB-CB 4.11Å; F217-L234 HydrophobicContact CB-CD2 4.04Å; F217-L234 HydrophobicContact CD1-CD2 4.21Å
218	R	79.5	Confident	65.4	Low	110 Å²	110	76.9 Å²	76.9	42%	0.415	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	125.5	-179.9	-174.2	174	-174.7	100	-9.8	111.7	G202 I203 N223 F224 T225	G202-R218 CarbonylContact C-O 3.57Å; G202-R218 WeakPolarHBondContact CA-O 3.48Å; I203-R218 PolarHBondContact N-O 3.13Å; I203-R218 PolarHBondContact O-N 2.89Å; R218-N223 VanDerWaalsContact CZ-OD1 3.28Å; R218-N223 PolarHBondContact NE-OD1 2.67Å; R218-N223 PolarHBondContact NH1-O 2.94Å; R218-N223 PolarHBondContact NH2-OD1 3.11Å; R218-F224 WeakPolarHBondContact CA-O 3.46Å; R218-T225 HydrophobicContact CB-CG2 4.45Å; R218-T225 WeakPolarHBondContact CG-OG1 3.22Å; R218-T225 PolarHBondContact NH1-OG1 3.32Å
219	C	82.6	Confident	66.1	Low	1 Å²	1	76.2 Å²	76.2	1%	0.007	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	131	177.1	-175.2	0	0	0	0	111.4	F221 C222 N223 F224 L234	C219-F221 PolarHBondContact O-N 3Å; C219-C222 WeakPolarHBondContact CB-SG 3.43Å; C219-C222 VanDerWaalsContact SG-SG 3.69Å; C219-N223 VanDerWaalsContact O-CA 3.26Å; C219-N223 WeakPolarHBondContact O-CA 3.41Å; C219-N223 PolarHBondContact O-N 3.5Å; C219-N223 VanDerWaalsContact O-N 3.07Å; C219-F224 PolarHBondContact N-O 2.9Å; C219-L234 VanDerWaalsContact CA-CD1 3.49Å; C219-L234 HydrophobicContact CB-CD1 3.5Å; C219-L234 VanDerWaalsContact CB-CD1 3.5Å
220	K	79.7	Confident	67.1	Low	122 Å²	122	74.6 Å²	74.6	53%	0.53	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67	-23.2	-180	-171.4	178.5	178.9	-177.4	0	113.1	L200 I201	L200-K220 HydrophobicContact CD2-CD 4.38Å; L200-K220 HydrophobicContact CG-CD 4.25Å; L200-K220 VanDerWaalsContact O-CD 3.31Å; L200-K220 WeakPolarHBondContact O-CD 3.1Å; I201-K220 VanDerWaalsContact O-CB 3.31Å; I201-K220 WeakPolarHBondContact O-CB 3.43Å; I201-K220 PolarHBondContact O-N 2.68Å
221	F	75.6	Confident	68.8	Low	64 Å²	64	71.1 Å²	71.1	28%	0.281	36%	0.363	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-32.6	-167	-64.6	-66.2	0	0	0	114.6	T199 I201 C219 F238 H242 K245	T199-F221 HydrophobicContact CG2-CE2 4.5Å; T199-F221 HydrophobicContact CG2-CZ 4.2Å; I201-F221 HydrophobicContact CG2-CE2 4.42Å; C219-F221 PolarHBondContact O-N 3Å; F221-F238 AromaticContact CD2-CD2 3.65Å; F221-F238 HydrophobicContact CD2-CD2 3.65Å; F221-F238 AromaticContact CD2-CE2 3.42Å; F221-F238 HydrophobicContact CD2-CE2 3.42Å; F221-F238 VanDerWaalsContact CD2-CE2 3.42Å; F221-F238 AromaticContact CE2-CD2 3.87Å; F221-F238 HydrophobicContact CE2-CD2 3.87Å; F221-F238 AromaticContact CE2-CE2 3.29Å; F221-F238 HydrophobicContact CE2-CE2 3.29Å; F221-F238 HydrophobicContact CE2-CZ 4.05Å; F221-F238 HydrophobicContact CG-CE2 4.43Å; F221-F238 HydrophobicContact CZ-CE2 4.22Å; F221-H242 WeakPolarHBondContact CB-CD2 3.49Å; F221-H242 VanDerWaalsContact CB-NE2 3.34Å; F221-H242 WeakPolarHBondContact CB-NE2 3.47Å; F221-K245 HydrophobicContact CD1-CD 3.74Å; F221-K245 HydrophobicContact CE1-CD 4Å; F221-K245 HydrophobicContact CG-CD 4.09Å
222	C	78	Confident	70.5	Confident	54 Å²	54	64.8 Å²	64.8	37%	0.365	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.9	-7.9	176.5	63.3	0	0	0	0	114	C219 F224 H237 H242	C219-C222 WeakPolarHBondContact CB-SG 3.43Å; C219-C222 VanDerWaalsContact SG-SG 3.69Å; C222-F224 PolarHBondContact O-N 3.5Å; C222-F224 WeakPolarHBondContact SG-CB 3.32Å; C222-F224 PolarHBondContact SG-N 3.35Å; C222-H237 PolarHBondContact SG-NE2 2.78Å; C222-H242 WeakPolarHBondContact CB-NE2 3.31Å
223	N	72.3	Confident	71.9	Confident	90 Å²	90	66.4 Å²	66.4	48%	0.481	34%	0.336	S	S	.	.			trans	63.1	4.4	-170.8	-83.4	-85.9	0	0	0	116.5	R218 C219 T225	R218-N223 VanDerWaalsContact CZ-OD1 3.28Å; R218-N223 PolarHBondContact NE-OD1 2.67Å; R218-N223 PolarHBondContact NH1-O 2.94Å; R218-N223 PolarHBondContact NH2-OD1 3.11Å; C219-N223 VanDerWaalsContact O-CA 3.26Å; C219-N223 WeakPolarHBondContact O-CA 3.41Å; C219-N223 PolarHBondContact O-N 3.5Å; C219-N223 VanDerWaalsContact O-N 3.07Å; N223-T225 PolarHBondContact O-OG1 3.34Å
224	F	73.6	Confident	73.2	Confident	115 Å²	115	62.1 Å²	62.1	50%	0.504	31%	0.314	S	S	.	.			trans	-58.7	146.2	172.3	-158.5	-83	0	0	0	110.7	R218 C219 C222 Y226	R218-F224 WeakPolarHBondContact CA-O 3.46Å; C219-F224 PolarHBondContact N-O 2.9Å; C222-F224 PolarHBondContact O-N 3.5Å; C222-F224 WeakPolarHBondContact SG-CB 3.32Å; C222-F224 PolarHBondContact SG-N 3.35Å; F224-Y226 HydrophobicContact CD1-CD2 4.03Å; F224-Y226 AromaticContact CD1-CE1 3.99Å; F224-Y226 HydrophobicContact CD1-CE1 3.99Å; F224-Y226 AromaticContact CD1-CE2 3.45Å; F224-Y226 HydrophobicContact CD1-CE2 3.45Å; F224-Y226 VanDerWaalsContact CD1-CE2 3.45Å; F224-Y226 HydrophobicContact CD1-CG 4.5Å; F224-Y226 AromaticContact CD1-CZ 3.39Å; F224-Y226 WeakPolarHBondContact CD1-OH 3.48Å; F224-Y226 HydrophobicContact CE1-CD1 4.25Å; F224-Y226 AromaticContact CE1-CE1 3.71Å; F224-Y226 HydrophobicContact CE1-CE1 3.71Å; F224-Y226 HydrophobicContact CE1-CE2 4.07Å; F224-Y226 AromaticContact CE1-CZ 3.57Å; F224-Y226 HydrophobicContact CG-CE2 4.4Å
225	T	78.5	Confident	74.2	Confident	53 Å²	53	64 Å²	64	33%	0.325	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	121.7	-170.7	-54.9	0	0	0	0	110.6	Y216 F217 R218 N223	Y216-T225 HydrophobicContact CD2-CG2 3.74Å; Y216-T225 HydrophobicContact CG-CG2 3.95Å; F217-T225 CarbonylContact O-C 3.55Å; F217-T225 VanDerWaalsContact O-CA 3.28Å; F217-T225 WeakPolarHBondContact O-CA 3.31Å; R218-T225 HydrophobicContact CB-CG2 4.45Å; R218-T225 WeakPolarHBondContact CG-OG1 3.22Å; R218-T225 PolarHBondContact NH1-OG1 3.32Å; N223-T225 PolarHBondContact O-OG1 3.34Å
226	Y	73.3	Confident	75.1	Confident	50 Å²	50	66.6 Å²	66.6	20%	0.196	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	143.2	-179.2	-68.7	-82.2	0	0	0	110.8	Y216 F217 F224 E233 H237	Y216-Y226 CarbonylContact C-O 3.48Å; Y216-Y226 WeakPolarHBondContact CA-O 3.45Å; Y216-Y226 VanDerWaalsContact CB-O 3.22Å; Y216-Y226 WeakPolarHBondContact CB-O 3.48Å; F217-Y226 PolarHBondContact N-O 2.79Å; F217-Y226 PolarHBondContact O-N 3.05Å; F224-Y226 HydrophobicContact CD1-CD2 4.03Å; F224-Y226 AromaticContact CD1-CE1 3.99Å; F224-Y226 HydrophobicContact CD1-CE1 3.99Å; F224-Y226 AromaticContact CD1-CE2 3.45Å; F224-Y226 HydrophobicContact CD1-CE2 3.45Å; F224-Y226 VanDerWaalsContact CD1-CE2 3.45Å; F224-Y226 HydrophobicContact CD1-CG 4.5Å; F224-Y226 AromaticContact CD1-CZ 3.39Å; F224-Y226 WeakPolarHBondContact CD1-OH 3.48Å; F224-Y226 HydrophobicContact CE1-CD1 4.25Å; F224-Y226 AromaticContact CE1-CE1 3.71Å; F224-Y226 HydrophobicContact CE1-CE1 3.71Å; F224-Y226 HydrophobicContact CE1-CE2 4.07Å; F224-Y226 AromaticContact CE1-CZ 3.57Å; F224-Y226 HydrophobicContact CG-CE2 4.4Å; Y226-E233 HydrophobicContact CD1-CB 4.22Å; Y226-E233 HydrophobicContact CG-CB 4.31Å; Y226-H237 HydrophobicContact CE2-CB 3.68Å; Y226-H237 AromaticContact CE2-CD2 3.81Å; Y226-H237 AromaticContact CE2-CG 3.63Å; Y226-H237 AromaticContact CZ-CG 3.71Å; Y226-H237 WeakPolarHBondContact OH-CB 3.43Å; Y226-H237 PolarHBondContact OH-ND1 2.92Å
227	M	70.8	Confident	75.4	Confident	168 Å²	168	65.1 Å²	65.1	83%	0.828	33%	0.33	S	S	*	.			trans	-105.3	63.5	173.3	-73.9	-176.9	57.5	0	0	110.4
228	G	60.6	Low	75.3	Confident	5 Å²	5	64.9 Å²	64.9	5%	0.052	33%	0.329	C	S	.	.			trans	-111.7	154.5	-179.4	0	0	0	0	0	113.6	T214 F217 N230	T214-G228 PolarHBondContact OG1-O 3.46Å; F217-G228 WeakPolarHBondContact CE2-O 3.45Å; G228-N230 VanDerWaalsContact C-N 3.33Å
229	S	59.3	Low	75.3	Confident	72 Å²	72	63.9 Å²	63.9	50%	0.503	33%	0.331	S	S	.	.	S	Bend	trans	-80.4	-11.9	176.4	54.4	0	0	0	0	113.8	T214	T214-S229 PolarHBondContact OG1-O 3.25Å
230	N	68.3	Low	75	Confident	71 Å²	71	67.7 Å²	67.7	38%	0.38	36%	0.358	S	S	.	.	S	Bend	trans	-135.4	158.2	-175.3	58.1	31.3	0	0	0	111.9	F217 G228 S232	F217-N230 WeakPolarHBondContact CD2-O 3.45Å; F217-N230 WeakPolarHBondContact CE2-O 3.11Å; G228-N230 VanDerWaalsContact C-N 3.33Å; N230-S232 VanDerWaalsContact C-N 3.29Å; N230-S232 PolarHBondContact ND2-OG 2.84Å; N230-S232 PolarHBondContact O-N 3.36Å; N230-S232 PolarHBondContact OD1-OG 2.92Å
231	S	76.6	Confident	74.5	Confident	41 Å²	41	64.7 Å²	64.7	29%	0.287	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78	-13.5	-177	56.4	0	0	0	0	114	E233 L234 E235	S231-E233 VanDerWaalsContact C-N 3.31Å; S231-E233 PolarHBondContact O-N 3.1Å; S231-L234 WeakPolarHBondContact O-CB 3.43Å; S231-L234 PolarHBondContact O-N 3.4Å; S231-E235 WeakPolarHBondContact CB-OE1 3.48Å; S231-E235 PolarHBondContact O-N 3.18Å; S231-E235 PolarHBondContact OG-OE1 3.45Å
232	S	76.8	Confident	74.5	Confident	56 Å²	56	63.3 Å²	63.3	39%	0.392	35%	0.347	S	S	.	.	H	α-helix	trans	-58.3	-34.6	-175.4	30.9	0	0	0	0	114.1	N230 L234 E235 Q236	N230-S232 VanDerWaalsContact C-N 3.29Å; N230-S232 PolarHBondContact ND2-OG 2.84Å; N230-S232 PolarHBondContact O-N 3.36Å; N230-S232 PolarHBondContact OD1-OG 2.92Å; S232-L234 VanDerWaalsContact C-N 3.34Å; S232-L234 PolarHBondContact O-N 3.01Å; S232-E235 PolarHBondContact O-N 2.87Å; S232-Q236 WeakPolarHBondContact O-CB 3.24Å; S232-Q236 PolarHBondContact O-N 3.16Å
233	E	78.6	Confident	73.8	Confident	73 Å²	73	64.3 Å²	64.3	34%	0.341	35%	0.352	S	S	.	.	H	α-helix	trans	-61.7	-42	174.5	-67	174.7	-166.3	0	0	111.8	Y226 S231 H237	Y226-E233 HydrophobicContact CD1-CB 4.22Å; Y226-E233 HydrophobicContact CG-CB 4.31Å; S231-E233 VanDerWaalsContact C-N 3.31Å; S231-E233 PolarHBondContact O-N 3.1Å; E233-H237 VanDerWaalsContact O-CB 3.25Å; E233-H237 WeakPolarHBondContact O-CB 3.5Å; E233-H237 PolarHBondContact O-N 3.06Å
234	L	78.1	Confident	73.1	Confident	0 Å²	0	67.4 Å²	67.4	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-70.5	-34.6	177.2	166	63.6	0	0	0	111.6	V194 I201 F217 C219 S231 S232 F238	V194-L234 HydrophobicContact CB-CD2 3.84Å; V194-L234 HydrophobicContact CG1-CD2 4.03Å; V194-L234 HydrophobicContact CG2-CD2 3.99Å; I201-L234 HydrophobicContact CD1-CG 3.97Å; I201-L234 HydrophobicContact CG1-CD2 4.44Å; I201-L234 HydrophobicContact CG1-CG 4.33Å; F217-L234 HydrophobicContact CB-CB 4.11Å; F217-L234 HydrophobicContact CB-CD2 4.04Å; F217-L234 HydrophobicContact CD1-CD2 4.21Å; C219-L234 VanDerWaalsContact CA-CD1 3.49Å; C219-L234 HydrophobicContact CB-CD1 3.5Å; C219-L234 VanDerWaalsContact CB-CD1 3.5Å; S231-L234 WeakPolarHBondContact O-CB 3.43Å; S231-L234 PolarHBondContact O-N 3.4Å; S232-L234 VanDerWaalsContact C-N 3.34Å; S232-L234 PolarHBondContact O-N 3.01Å; L234-F238 WeakPolarHBondContact O-CB 3.47Å; L234-F238 PolarHBondContact O-N 2.93Å
235	E	80.6	Confident	72.3	Confident	52 Å²	52	66.5 Å²	66.5	24%	0.243	37%	0.365	C	S	.	.	H	α-helix	trans	-68.8	-47.5	175.5	-67.9	163.7	-133	0	0	111.3	V194 L196 I201 S231 S232 H237 F238 L239	V194-E235 HydrophobicContact CG1-CG 4.1Å; L196-E235 HydrophobicContact CD1-CG 4.38Å; I201-E235 HydrophobicContact CD1-CB 4.19Å; I201-E235 HydrophobicContact CD1-CG 3.56Å; S231-E235 WeakPolarHBondContact CB-OE1 3.48Å; S231-E235 PolarHBondContact O-N 3.18Å; S231-E235 PolarHBondContact OG-OE1 3.45Å; S232-E235 PolarHBondContact O-N 2.87Å; E235-H237 VanDerWaalsContact C-N 3.33Å; E235-H237 PolarHBondContact O-N 3.12Å; E235-F238 PolarHBondContact O-N 3.37Å; E235-F238 VanDerWaalsContact O-N 3.17Å; E235-L239 WeakPolarHBondContact O-CG 3.3Å; E235-L239 PolarHBondContact O-N 3.07Å
236	Q	79	Confident	71.6	Confident	143 Å²	143	67.9 Å²	67.9	67%	0.668	37%	0.373	S	S	*	.	H	α-helix	trans	-62.7	-38.8	174.8	-172.3	177.3	5.2	0	0	111.8	S232 L239 S240	S232-Q236 WeakPolarHBondContact O-CB 3.24Å; S232-Q236 PolarHBondContact O-N 3.16Å; Q236-L239 PolarHBondContact O-N 2.85Å; Q236-S240 WeakPolarHBondContact O-CB 3.5Å; Q236-S240 PolarHBondContact O-N 2.82Å; Q236-S240 PolarHBondContact O-OG 2.79Å
237	H	80.9	Confident	70.3	Confident	19 Å²	19	73.1 Å²	73.1	9%	0.088	40%	0.396	C	S	.	.	H	α-helix	trans	-62.6	-44.4	171.6	174.4	61.5	0	0	0	112.3	C222 Y226 E233 E235 L239 S240 S241	C222-H237 PolarHBondContact SG-NE2 2.78Å; Y226-H237 HydrophobicContact CE2-CB 3.68Å; Y226-H237 AromaticContact CE2-CD2 3.81Å; Y226-H237 AromaticContact CE2-CG 3.63Å; Y226-H237 AromaticContact CZ-CG 3.71Å; Y226-H237 WeakPolarHBondContact OH-CB 3.43Å; Y226-H237 PolarHBondContact OH-ND1 2.92Å; E233-H237 VanDerWaalsContact O-CB 3.25Å; E233-H237 WeakPolarHBondContact O-CB 3.5Å; E233-H237 PolarHBondContact O-N 3.06Å; E235-H237 VanDerWaalsContact C-N 3.33Å; E235-H237 PolarHBondContact O-N 3.12Å; H237-L239 PolarHBondContact O-N 3Å; H237-S240 WeakPolarHBondContact CA-OG 3.41Å; H237-S240 PolarHBondContact O-N 2.68Å; H237-S240 PolarHBondContact O-OG 2.99Å; H237-S241 VanDerWaalsContact CE1-CB 3.46Å; H237-S241 WeakPolarHBondContact CE1-CB 3.32Å; H237-S241 PolarHBondContact CE1-OG 3.15Å; H237-S241 PolarHBondContact ND1-OG 2.99Å; H237-S241 VanDerWaalsContact ND1-OG 3.12Å; H237-S241 VanDerWaalsContact O-CB 3.22Å; H237-S241 WeakPolarHBondContact O-CB 3.49Å; H237-S241 PolarHBondContact O-N 3.48Å; H237-S241 PolarHBondContact O-OG 3.39Å
238	F	79.7	Confident	68.7	Low	3 Å²	3	70.2 Å²	70.2	1%	0.013	39%	0.393	C	S	.	.	H	α-helix	trans	-63.1	-42	177.9	177	-107.3	0	0	0	111.9	L196 I201 F221 L234 E235 H242 K245 V246	L196-F238 HydrophobicContact CD2-CD1 4.03Å; I201-F238 HydrophobicContact CB-CB 4.33Å; I201-F238 HydrophobicContact CB-CD1 4.34Å; I201-F238 HydrophobicContact CB-CD2 4.2Å; I201-F238 HydrophobicContact CB-CG 4.03Å; I201-F238 HydrophobicContact CD1-CB 4.04Å; I201-F238 HydrophobicContact CD1-CG 4.44Å; I201-F238 HydrophobicContact CG2-CB 4.35Å; I201-F238 HydrophobicContact CG2-CD1 3.47Å; I201-F238 VanDerWaalsContact CG2-CD1 3.47Å; I201-F238 HydrophobicContact CG2-CD2 3.89Å; I201-F238 HydrophobicContact CG2-CE1 3.58Å; I201-F238 HydrophobicContact CG2-CE2 4.03Å; I201-F238 HydrophobicContact CG2-CG 3.62Å; I201-F238 HydrophobicContact CG2-CZ 3.87Å; F221-F238 AromaticContact CD2-CD2 3.65Å; F221-F238 HydrophobicContact CD2-CD2 3.65Å; F221-F238 AromaticContact CD2-CE2 3.42Å; F221-F238 HydrophobicContact CD2-CE2 3.42Å; F221-F238 VanDerWaalsContact CD2-CE2 3.42Å; F221-F238 AromaticContact CE2-CD2 3.87Å; F221-F238 HydrophobicContact CE2-CD2 3.87Å; F221-F238 AromaticContact CE2-CE2 3.29Å; F221-F238 HydrophobicContact CE2-CE2 3.29Å; F221-F238 HydrophobicContact CE2-CZ 4.05Å; F221-F238 HydrophobicContact CG-CE2 4.43Å; F221-F238 HydrophobicContact CZ-CE2 4.22Å; L234-F238 WeakPolarHBondContact O-CB 3.47Å; L234-F238 PolarHBondContact O-N 2.93Å; E235-F238 PolarHBondContact O-N 3.37Å; E235-F238 VanDerWaalsContact O-N 3.17Å; F238-H242 HydrophobicContact CD2-CB 3.8Å; F238-H242 HydrophobicContact CE2-CB 3.86Å; F238-H242 CarbonylContact O-C 3.45Å; F238-H242 VanDerWaalsContact O-CA 3.3Å; F238-H242 WeakPolarHBondContact O-CA 3.4Å; F238-H242 WeakPolarHBondContact O-CB 3.42Å; F238-H242 PolarHBondContact O-N 3.33Å; F238-K245 HydrophobicContact CE2-CB 3.96Å; F238-K245 HydrophobicContact CZ-CB 4Å; F238-V246 HydrophobicContact CD1-CG2 4.41Å; F238-V246 HydrophobicContact CE1-CG2 3.8Å; F238-V246 HydrophobicContact CZ-CG2 4.34Å
239	L	79.5	Confident	67.3	Low	89 Å²	89	75 Å²	75	47%	0.466	42%	0.423	S	S	.	.	H	α-helix	trans	-65.9	-44.1	177.7	-69.7	172	0	0	0	112.7	L196 E235 Q236 H237 V246	L196-L239 HydrophobicContact CD2-CD1 4.15Å; L196-L239 HydrophobicContact CD2-CD2 3.81Å; L196-L239 HydrophobicContact CD2-CG 3.86Å; E235-L239 WeakPolarHBondContact O-CG 3.3Å; E235-L239 PolarHBondContact O-N 3.07Å; Q236-L239 PolarHBondContact O-N 2.85Å; H237-L239 PolarHBondContact O-N 3Å; L239-V246 HydrophobicContact CD2-CG2 3.94Å
240	S	74.5	Confident	65.9	Low	81 Å²	81	77.4 Å²	77.4	57%	0.566	44%	0.437	S	S	*	.	H	α-helix	trans	-74.3	-45.2	-179.8	53.8	0	0	0	0	113.5	Q236 H237	Q236-S240 WeakPolarHBondContact O-CB 3.5Å; Q236-S240 PolarHBondContact O-N 2.82Å; Q236-S240 PolarHBondContact O-OG 2.79Å; H237-S240 WeakPolarHBondContact CA-OG 3.41Å; H237-S240 PolarHBondContact O-N 2.68Å; H237-S240 PolarHBondContact O-OG 2.99Å
241	S	71	Confident	64	Low	60 Å²	60	80.7 Å²	80.7	42%	0.42	46%	0.46	S	S	.	.	H	α-helix	trans	-93.7	-19.1	-171.4	-57.4	0	0	0	0	113.6	H237 P243	H237-S241 VanDerWaalsContact CE1-CB 3.46Å; H237-S241 WeakPolarHBondContact CE1-CB 3.32Å; H237-S241 PolarHBondContact CE1-OG 3.15Å; H237-S241 PolarHBondContact ND1-OG 2.99Å; H237-S241 VanDerWaalsContact ND1-OG 3.12Å; H237-S241 VanDerWaalsContact O-CB 3.22Å; H237-S241 WeakPolarHBondContact O-CB 3.49Å; H237-S241 PolarHBondContact O-N 3.48Å; H237-S241 PolarHBondContact O-OG 3.39Å; S241-P243 VanDerWaalsContact C-CD 3.45Å
242	H	73.9	Confident	61.7	Low	35 Å²	35	85.1 Å²	85.1	16%	0.162	49%	0.485	C	S	.	.			trans	-131.8	42.3	-178.1	-59.8	-31.5	0	0	0	114.8	F221 C222 F238 N244 K245	F221-H242 WeakPolarHBondContact CB-CD2 3.49Å; F221-H242 VanDerWaalsContact CB-NE2 3.34Å; F221-H242 WeakPolarHBondContact CB-NE2 3.47Å; C222-H242 WeakPolarHBondContact CB-NE2 3.31Å; F238-H242 HydrophobicContact CD2-CB 3.8Å; F238-H242 HydrophobicContact CE2-CB 3.86Å; F238-H242 CarbonylContact O-C 3.45Å; F238-H242 VanDerWaalsContact O-CA 3.3Å; F238-H242 WeakPolarHBondContact O-CA 3.4Å; F238-H242 WeakPolarHBondContact O-CB 3.42Å; F238-H242 PolarHBondContact O-N 3.33Å; H242-N244 VanDerWaalsContact C-N 3.25Å; H242-N244 PolarHBondContact O-N 3.24Å; H242-N244 VanDerWaalsContact O-N 3.14Å; H242-K245 HydrophobicContact CB-CB 4.38Å; H242-K245 PolarHBondContact O-N 3.21Å
243	P	64.1	Low	59.5	Low	74 Å²	74	87.6 Å²	87.6	48%	0.481	50%	0.5	S	S	.	.	G	3₁₀ helix	trans	-56	-37.9	-176.7	23.2	-34.4	0	0	0	112.9	S241 K245 V246	S241-P243 VanDerWaalsContact C-CD 3.45Å; P243-K245 PolarHBondContact O-N 3.05Å; P243-V246 WeakPolarHBondContact O-CB 3.4Å; P243-V246 PolarHBondContact O-N 3.13Å
244	N	58	Low	57.1	Low	155 Å²	155	91.9 Å²	91.9	83%	0.829	52%	0.524	S	S	*	.	G	3₁₀ helix	trans	-66.9	-2.5	177	-67.9	-46.8	0	0	0	115.1	H242	H242-N244 VanDerWaalsContact C-N 3.25Å; H242-N244 PolarHBondContact O-N 3.24Å; H242-N244 VanDerWaalsContact O-N 3.14Å
245	K	57	Low	54.6	Low	97 Å²	97	100.5 Å²	100.5	42%	0.422	57%	0.57	S	S	.	*	G	3₁₀ helix	trans	-108.1	-2.8	173.5	-66.3	-171.5	178	176.4	0	113.6	F221 F238 H242 P243 K247	F221-K245 HydrophobicContact CD1-CD 3.74Å; F221-K245 HydrophobicContact CE1-CD 4Å; F221-K245 HydrophobicContact CG-CD 4.09Å; F238-K245 HydrophobicContact CE2-CB 3.96Å; F238-K245 HydrophobicContact CZ-CB 4Å; H242-K245 HydrophobicContact CB-CB 4.38Å; H242-K245 PolarHBondContact O-N 3.21Å; P243-K245 PolarHBondContact O-N 3.05Å; K245-K247 VanDerWaalsContact C-N 3.34Å; K245-K247 PolarHBondContact O-N 3.38Å
246	V	62.6	Low	52	Low	81 Å²	81	102 Å²	102	49%	0.491	59%	0.59	S	S	.	*			trans	-74.3	89.8	168.4	-173.1	0	0	0	0	107.7	F238 L239 P243	F238-V246 HydrophobicContact CD1-CG2 4.41Å; F238-V246 HydrophobicContact CE1-CG2 3.8Å; F238-V246 HydrophobicContact CZ-CG2 4.34Å; L239-V246 HydrophobicContact CD2-CG2 3.94Å; P243-V246 WeakPolarHBondContact O-CB 3.4Å; P243-V246 PolarHBondContact O-N 3.13Å
247	K	46.3	Very low	49.4	Very low	160 Å²	160	101.1 Å²	101.1	70%	0.696	60%	0.595	S	S	*	*			trans	-107.5	131.5	176.1	-73.5	-169.9	172.7	-171.9	0	110.4	K245	K245-K247 VanDerWaalsContact C-N 3.34Å; K245-K247 PolarHBondContact O-N 3.38Å
248	S	36.5	Very low	46.8	Very low	107 Å²	107	107.6 Å²	107.6	75%	0.748	63%	0.63	S	S	*	*	P	Polyproline II helix	trans	-58.6	150.7	165.5	43.6	0	0	0	0	110.9
249	P	32.3	Very low	44.3	Very low	105 Å²	105	113 Å²	113	68%	0.682	67%	0.669	S	S	*	*	P	Polyproline II helix	trans	-64.9	148.8	176.7	27.9	-35	0	0	0	111.2
250	P	29.9	Very low	41.7	Very low	123 Å²	123	117.4 Å²	117.4	80%	0.799	69%	0.692	S	S	*	*	P	Polyproline II helix	trans	-77.4	130.5	178.8	31.2	-33.7	0	0	0	111.7
251	T	28.4	Very low	39.2	Very low	141 Å²	141	117.6 Å²	117.6	87%	0.865	70%	0.698	S	S	*	*			trans	-83.6	112	172.4	-44.7	0	0	0	0	110.4
252	T	27.1	Very low	37.1	Very low	133 Å²	133	121 Å²	121	82%	0.816	72%	0.716	S	S	*	*			trans	-86.2	135.9	168	8.7	0	0	0	0	110.7
253	P	32.5	Very low	34.9	Very low	108 Å²	108	127.3 Å²	127.3	70%	0.701	75%	0.746	S	S	*	*			trans	-87.8	140	-174.5	32.8	-34.4	0	0	0	114.4
254	L	26.9	Very low	32.9	Very low	164 Å²	164	130 Å²	130	86%	0.859	76%	0.756	S	S	*	*			trans	56.3	117.9	147.7	-57	175.5	0	0	0	120.2
255	L	25.2	Very low	31.3	Very low	181 Å²	181	126.6 Å²	126.6	95%	0.948	75%	0.745	S	S	*	*				-153.9	159.6	103.4	-106.3	166.7	0	0	0	109.9
256	A	25.7	Very low	30	Very low	82 Å²	82	129.7 Å²	129.7	68%	0.678	76%	0.76	S	S	*	*			trans	-114.4	156.7	-168.9	0	0	0	0	0	112.7
257	T	26.2	Very low	28.2	Very low	125 Å²	125	132.4 Å²	132.4	77%	0.767	77%	0.772	S	S	*	*				-175.2	146.8	122.9	20.3	0	0	0	0	114.2
258	N	26.5	Very low	27.4	Very low	155 Å²	155	134.5 Å²	134.5	83%	0.829	78%	0.781	S	S	*	*			trans	65.1	126.8	149.7	-59.6	-11.6	0	0	0	122
259	S	26.2	Very low	26.8	Very low	118 Å²	118	132.9 Å²	132.9	83%	0.825	78%	0.781	S	S	*	*			trans	-95.5	165.2	174.6	-37.5	0	0	0	0	112.3
260	L	24.2	Very low	26.5	Very low	181 Å²	181	138.8 Å²	138.8	95%	0.948	79%	0.79	S	S	*	*			trans	-150.2	163.7	131.8	-152	54.8	0	0	0	111.4
261	A	23.3	Very low	26.3	Very low	84 Å²	84	138.7 Å²	138.7	69%	0.694	79%	0.792	S	S	*	*			trans	-82.6	177.9	-171.8	0	0	0	0	0	112.4
262	T	27.2	Very low	26.2	Very low	131 Å²	131	136.8 Å²	136.8	80%	0.804	78%	0.78	S	S	*	*				-155.4	137	53.8	46.5	0	0	0	0	116.1
263	H	25.8	Very low	26.2	Very low	168 Å²	168	138.9 Å²	138.9	78%	0.778	78%	0.782	S	S	*	*			trans	51.3	110.4	130.3	-130.4	-96.6	0	0	0	119.9
264	D	22.6	Very low	25.9	Very low	130 Å²	130	141.6 Å²	141.6	70%	0.695	79%	0.79	S	S	*	*				63	127.8	84.8	-119.8	-58.9	0	0	0	114
265	S	25.8	Very low	25.9	Very low	85 Å²	85	141.5 Å²	141.5	59%	0.594	79%	0.791	S	S	*	*			cis	-144.6	-166.7	21.1	-51.5	0	0	0	0	111.8
266	Q	27.7	Very low	26.1	Very low	161 Å²	161	136.7 Å²	136.7	75%	0.752	78%	0.777	S	S	*	*			cis	-163.4	-177.8	4.2	-145.7	171.5	97	0	0	112.1
267	L	26.8	Very low	26.6	Very low	139 Å²	139	136.5 Å²	136.5	73%	0.728	78%	0.783	S	S	*	*			trans	77.2	107	151.7	-76.2	170.1	0	0	0	122.4
268	K	28.9	Very low	27.4	Very low	203 Å²	203	138 Å²	138	88%	0.883	78%	0.782	S	S	*	*			trans	86.9	124.1	137.8	-140.1	87.1	173.8	-170.9	0	119.2
269	G	24.6	Very low	28.7	Very low	73 Å²	73	138.7 Å²	138.7	75%	0.753	77%	0.772	S	S	*	*			trans	125.4	6.3	141.5	0	0	0	0	0	120.7	S271	G269-S271 PolarHBondContact O-N 3.48Å
270	R	25.7	Very low	30.9	Very low	230 Å²	230	136.7 Å²	136.7	87%	0.868	76%	0.755	S	S	*	*			trans	-18.9	115.3	174.6	179.1	-177.4	-180	170.2	0.7	116.2	V272	R270-V272 HydrophobicContact CG-CG2 4.34Å
271	S	24.1	Very low	33.3	Very low	121 Å²	121	130 Å²	130	85%	0.846	73%	0.726	S	S	*	*			trans	-114.4	158.1	147.4	-168.5	0	0	0	0	109.1	G269	G269-S271 PolarHBondContact O-N 3.48Å
272	V	26.5	Very low	35.8	Very low	101 Å²	101	127 Å²	127	61%	0.612	70%	0.699	S	S	*	*			trans	-106.4	138.9	-164.5	172	0	0	0	0	111.3	R270	R270-V272 HydrophobicContact CG-CG2 4.34Å
273	M	28.8	Very low	38.2	Very low	176 Å²	176	127 Å²	127	87%	0.867	68%	0.684	S	S	*	*			trans	-66.8	137.7	171.6	-61.8	-144.3	73.1	0	0	111.2
274	L	25.6	Very low	40.6	Very low	166 Å²	166	119.4 Å²	119.4	87%	0.869	65%	0.65	S	S	*	*			trans	-131.7	138.4	157.4	-90.9	172.2	0	0	0	109.2
275	D	26.6	Very low	42.8	Very low	162 Å²	162	121.9 Å²	121.9	87%	0.866	66%	0.658	S	S	*	*			trans	-100.5	-172.4	-160.8	-158.9	-1.3	0	0	0	112.3
276	A	29.8	Very low	44.8	Very low	79 Å²	79	122 Å²	122	65%	0.653	65%	0.651	S	S	*	*			trans	-57.1	160.4	-178.6	0	0	0	0	0	114.5	E278	A276-E278 PolarHBondContact O-N 3.36Å
277	G	36.3	Very low	46.6	Very low	79 Å²	79	119.2 Å²	119.2	81%	0.814	64%	0.642	S	S	*	*			trans	-68.5	88.6	175.2	0	0	0	0	0	112.4
278	E	41.8	Very low	48.6	Very low	157 Å²	157	114.2 Å²	114.2	73%	0.734	62%	0.618	S	S	*	*			trans	-71.4	145.7	179.9	-168.4	169.6	-142.6	0	0	112.6	A276	A276-E278 PolarHBondContact O-N 3.36Å
279	R	53.5	Low	51	Low	168 Å²	168	106 Å²	106	63%	0.634	59%	0.585	S	S	*	*			trans	-92.7	109.9	174.8	-68.5	179.3	173.4	176.2	-2.3	109.4	I294	R279-I294 HydrophobicContact CG-CG1 4.18Å
280	V	73.4	Confident	53.6	Low	76 Å²	76	102.5 Å²	102.5	46%	0.461	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	134.1	-177.8	-173.8	0	0	0	0	109.9	Y292 F293	V280-Y292 CarbonylContact O-C 3.17Å; V280-Y292 WeakPolarHBondContact O-CA 3.2Å; V280-F293 HydrophobicContact CB-CD1 4.06Å; V280-F293 HydrophobicContact CG2-CD1 4.31Å; V280-F293 PolarHBondContact N-O 3.27Å; V280-F293 PolarHBondContact O-N 3.29Å
281	A	74.9	Confident	56.3	Low	42 Å²	42	91.6 Å²	91.6	35%	0.347	51%	0.508	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	131.9	175.4	0	0	0	0	0	110.8	V289 Y292	A281-V289 HydrophobicContact CB-CG1 4.07Å; A281-V289 HydrophobicContact CB-CG2 4.45Å; A281-Y292 HydrophobicContact CB-CD1 4.16Å; A281-Y292 HydrophobicContact CB-CE1 4.19Å
282	V	76.5	Confident	58.9	Low	19 Å²	19	89.4 Å²	89.4	12%	0.115	48%	0.482	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	131.4	174.3	-177.1	0	0	0	0	108.6	V290 G291 F293 Y318 L336 L337	V282-V290 PolarHBondContact O-N 3.14Å; V282-G291 PolarHBondContact N-O 3.09Å; V282-G291 PolarHBondContact O-N 3.23Å; V282-F293 HydrophobicContact CG2-CB 4.11Å; V282-Y318 HydrophobicContact CG2-CD1 4.19Å; V282-Y318 HydrophobicContact CG2-CE1 4.41Å; V282-L336 HydrophobicContact CB-CD2 4.04Å; V282-L336 HydrophobicContact CG1-CD2 4.21Å; V282-L336 HydrophobicContact CG2-CD2 4.11Å; V282-L337 HydrophobicContact CG1-CD1 3.6Å
283	R	75.8	Confident	61.2	Low	133 Å²	133	86.7 Å²	86.7	50%	0.502	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	151.5	-175.3	-59.9	-174	178.1	-130.3	4	111.7	D287 S288 V289	R283-D287 WeakPolarHBondContact CD-O 3.4Å; R283-D287 WeakPolarHBondContact CD-OD1 3.47Å; R283-D287 IonicContact CZ-OD1 3.52Å; R283-D287 IonicContact NE-OD1 3.42Å; R283-D287 PolarHBondContact NH1-O 2.99Å; R283-D287 IonicContact NH1-OD1 3.38Å; R283-D287 PolarHBondContact NH1-OD1 3.06Å; R283-S288 CarbonylContact C-O 3.49Å; R283-S288 WeakPolarHBondContact CA-O 3.3Å; R283-V289 HydrophobicContact CG-CG2 4.17Å
284	A	76.5	Confident	63.3	Low	8 Å²	8	81 Å²	81	7%	0.066	44%	0.435	C	S	.	.			trans	-83.1	172.5	167.6	0	0	0	0	0	111.4	D286 D287 S288 V290	A284-D286 VanDerWaalsContact CB-OD1 3.29Å; A284-D286 WeakPolarHBondContact CB-OD1 3.42Å; A284-D286 PolarHBondContact O-N 3.07Å; A284-D287 WeakPolarHBondContact O-CA 3.32Å; A284-D287 PolarHBondContact O-N 3.47Å; A284-S288 PolarHBondContact N-O 3.03Å; A284-V290 HydrophobicContact CB-CG2 3.74Å
285	E	69.3	Low	64.6	Low	182 Å²	182	75.7 Å²	75.7	85%	0.85	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.5	-29.6	175.1	-61.6	-62.7	124.7	0	0	113.3	D287	E285-D287 PolarHBondContact O-N 2.85Å
286	D	68.5	Low	65.9	Low	86 Å²	86	70.9 Å²	70.9	46%	0.46	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.2	18.7	173.5	55.1	-75.3	0	0	0	113.9	A284 S288 K345	A284-D286 VanDerWaalsContact CB-OD1 3.29Å; A284-D286 WeakPolarHBondContact CB-OD1 3.42Å; A284-D286 PolarHBondContact O-N 3.07Å; D286-S288 PolarHBondContact O-N 3.29Å; D286-S288 WeakPolarHBondContact OD2-CB 3.22Å; D286-S288 PolarHBondContact OD2-OG 3.43Å; D286-K345 WeakPolarHBondContact OD1-CE 3.48Å; D286-K345 IonicContact OD1-NZ 2.7Å; D286-K345 PolarHBondContact OD1-NZ 2.83Å
287	D	64	Low	66.6	Low	104 Å²	104	78.1 Å²	78.1	56%	0.556	40%	0.397	S	S	*	.	S	Bend	trans	59.7	5.7	179.5	-146	-11.5	0	0	0	114.6	R283 A284 E285	R283-D287 WeakPolarHBondContact CD-O 3.4Å; R283-D287 WeakPolarHBondContact CD-OD1 3.47Å; R283-D287 IonicContact CZ-OD1 3.52Å; R283-D287 IonicContact NE-OD1 3.42Å; R283-D287 PolarHBondContact NH1-O 2.99Å; R283-D287 IonicContact NH1-OD1 3.38Å; R283-D287 PolarHBondContact NH1-OD1 3.06Å; A284-D287 WeakPolarHBondContact O-CA 3.32Å; A284-D287 PolarHBondContact O-N 3.47Å; E285-D287 PolarHBondContact O-N 2.85Å
288	S	70.4	Confident	66.5	Low	33 Å²	33	79 Å²	79	23%	0.231	40%	0.396	C	S	.	.			trans	-77.5	137.1	-179.4	70.5	0	0	0	0	111.9	R283 A284 D286 V290	R283-S288 CarbonylContact C-O 3.49Å; R283-S288 WeakPolarHBondContact CA-O 3.3Å; A284-S288 PolarHBondContact N-O 3.03Å; D286-S288 PolarHBondContact O-N 3.29Å; D286-S288 WeakPolarHBondContact OD2-CB 3.22Å; D286-S288 PolarHBondContact OD2-OG 3.43Å; S288-V290 PolarHBondContact O-N 2.88Å; S288-V290 VanDerWaalsContact O-N 3.15Å
289	V	78.9	Confident	66.1	Low	31 Å²	31	75.2 Å²	75.2	19%	0.188	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.6	105.4	-178.5	-179.8	0	0	0	0	110.5	A281 R283 Y292 K321	A281-V289 HydrophobicContact CB-CG1 4.07Å; A281-V289 HydrophobicContact CB-CG2 4.45Å; R283-V289 HydrophobicContact CG-CG2 4.17Å; V289-Y292 HydrophobicContact CG1-CE1 4.15Å; V289-K321 HydrophobicContact CG1-CD 4.34Å; V289-K321 WeakPolarHBondContact O-CD 3.35Å
290	V	78.4	Confident	65	Low	0 Å²	0	72.7 Å²	72.7	0%	0	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	-40.1	177.6	167.2	0	0	0	0	112	V282 A284 S288 K321 L336 L337 Y340	V282-V290 PolarHBondContact O-N 3.14Å; A284-V290 HydrophobicContact CB-CG2 3.74Å; S288-V290 PolarHBondContact O-N 2.88Å; S288-V290 VanDerWaalsContact O-N 3.15Å; V290-K321 WeakPolarHBondContact O-CB 3.39Å; V290-K321 PolarHBondContact O-N 3.02Å; V290-L336 HydrophobicContact CG1-CD1 4.17Å; V290-L336 HydrophobicContact CG1-CG 3.9Å; V290-L337 HydrophobicContact CB-CD1 4.29Å; V290-L337 HydrophobicContact CG1-CD1 4.22Å; V290-L337 HydrophobicContact CG2-CD1 4.12Å; V290-Y340 HydrophobicContact CB-CD2 4.17Å; V290-Y340 HydrophobicContact CB-CG 4.21Å; V290-Y340 HydrophobicContact CG1-CD1 4.38Å; V290-Y340 HydrophobicContact CG1-CD2 3.74Å; V290-Y340 HydrophobicContact CG1-CG 3.65Å; V290-Y340 HydrophobicContact CG2-CD1 3.8Å; V290-Y340 HydrophobicContact CG2-CD2 4.19Å; V290-Y340 HydrophobicContact CG2-CE1 4.01Å; V290-Y340 HydrophobicContact CG2-CE2 4.36Å; V290-Y340 HydrophobicContact CG2-CG 3.9Å
291	G	82.4	Confident	62.8	Low	0 Å²	0	77 Å²	77	0%	0	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	179.6	-158.2	-171.8	0	0	0	0	0	112.1	V282 W319	V282-G291 PolarHBondContact N-O 3.09Å; V282-G291 PolarHBondContact O-N 3.23Å; G291-W319 CarbonylContact C-O 3.27Å; G291-W319 VanDerWaalsContact CA-O 3.23Å; G291-W319 WeakPolarHBondContact CA-O 3.45Å
292	Y	79.9	Confident	60.7	Low	76 Å²	76	80.8 Å²	80.8	30%	0.298	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	162.5	-172.1	-56.1	-79.4	0	0	0	111.6	V280 A281 V289 Y318 W319 K321	V280-Y292 CarbonylContact O-C 3.17Å; V280-Y292 WeakPolarHBondContact O-CA 3.2Å; A281-Y292 HydrophobicContact CB-CD1 4.16Å; A281-Y292 HydrophobicContact CB-CE1 4.19Å; V289-Y292 HydrophobicContact CG1-CE1 4.15Å; Y292-Y318 WeakPolarHBondContact O-CA 3.23Å; Y292-W319 VanDerWaalsContact C-CD1 3.49Å; Y292-W319 PolarHBondContact N-O 3.27Å; Y292-W319 PolarHBondContact O-N 2.95Å; Y292-W319 PolarHBondContact O-NE1 2.96Å; Y292-K321 HydrophobicContact CE2-CB 4.35Å; Y292-K321 HydrophobicContact CE2-CG 4.31Å
293	F	73.5	Confident	58.7	Low	44 Å²	44	86.1 Å²	86.1	19%	0.193	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	134.7	176.5	162.1	-130.8	0	0	0	109.5	V280 V282 P295 A316 C317 Y318	V280-F293 HydrophobicContact CB-CD1 4.06Å; V280-F293 HydrophobicContact CG2-CD1 4.31Å; V280-F293 PolarHBondContact N-O 3.27Å; V280-F293 PolarHBondContact O-N 3.29Å; V282-F293 HydrophobicContact CG2-CB 4.11Å; F293-P295 HydrophobicContact CE1-CB 4.4Å; F293-P295 HydrophobicContact CE2-CB 4.22Å; F293-P295 HydrophobicContact CZ-CB 3.7Å; F293-P295 HydrophobicContact CZ-CG 4.29Å; F293-A316 HydrophobicContact CD2-CB 4.19Å; F293-A316 HydrophobicContact CE2-CB 3.45Å; F293-A316 VanDerWaalsContact CE2-CB 3.45Å; F293-A316 HydrophobicContact CZ-CB 4.24Å; F293-C317 WeakPolarHBondContact CA-O 3.47Å; F293-Y318 HydrophobicContact CB-CD1 3.88Å; F293-Y318 HydrophobicContact CB-CE1 3.75Å; F293-Y318 HydrophobicContact CD2-CD1 4.24Å; F293-Y318 AromaticContact CD2-CE1 3.78Å; F293-Y318 HydrophobicContact CD2-CE1 3.78Å; F293-Y318 HydrophobicContact CD2-CE2 4.25Å; F293-Y318 AromaticContact CD2-CZ 3.8Å; F293-Y318 HydrophobicContact CG-CD1 4.32Å; F293-Y318 AromaticContact CG-CE1 3.79Å; F293-Y318 HydrophobicContact CG-CE1 3.79Å
294	I	73.4	Confident	56.6	Low	56 Å²	56	82.7 Å²	82.7	29%	0.287	50%	0.497	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	122.5	166.3	-67.6	164	0	0	0	109.1	R279 C317 W319	R279-I294 HydrophobicContact CG-CG1 4.18Å; I294-C317 PolarHBondContact N-O 3.46Å; I294-C317 PolarHBondContact O-N 2.87Å; I294-C317 VanDerWaalsContact O-N 3.09Å; I294-W319 HydrophobicContact CD1-CH2 4.2Å; I294-W319 HydrophobicContact CD1-CZ2 3.39Å; I294-W319 HydrophobicContact CG1-CZ2 3.76Å
295	P	52.4	Low	54.1	Low	55 Å²	55	93.9 Å²	93.9	36%	0.357	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	122.5	166.5	28.8	-31.2	0	0	0	110.4	F293 I314	F293-P295 HydrophobicContact CE1-CB 4.4Å; F293-P295 HydrophobicContact CE2-CB 4.22Å; F293-P295 HydrophobicContact CZ-CB 3.7Å; F293-P295 HydrophobicContact CZ-CG 4.29Å; P295-I314 HydrophobicContact CB-CG2 4.49Å
296	V	53.7	Low	52.2	Low	61 Å²	61	91 Å²	91	37%	0.37	53%	0.532	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.4	114.2	173.9	-178.5	0	0	0	0	109.1	Q315 C317	V296-Q315 PolarHBondContact N-O 2.89Å; V296-C317 WeakPolarHBondContact CG2-SG 3.38Å
297	R	44.8	Very low	50.4	Low	231 Å²	231	90.7 Å²	90.7	87%	0.872	55%	0.549	S	S	*	.	P	Polyproline II helix	trans	-83.8	121.3	164	-84.4	-175.7	170.8	159	-0.6	108.9	G299	R297-G299 PolarHBondContact O-N 3.06Å
298	A	35.3	Very low	48.6	Very low	96 Å²	96	95.5 Å²	95.5	79%	0.793	57%	0.568	S	S	*	*	P	Polyproline II helix	trans	-61.7	125.6	166.2	0	0	0	0	0	109.6
299	G	31.7	Very low	47.1	Very low	79 Å²	79	99.2 Å²	99.2	81%	0.814	60%	0.601	S	S	*	*	P	Polyproline II helix	trans	-92.7	119.1	170.6	0	0	0	0	0	109.6	R297	R297-G299 PolarHBondContact O-N 3.06Å
300	S	31.2	Very low	44.8	Very low	114 Å²	114	101.2 Å²	101.2	80%	0.797	63%	0.628	S	S	*	*	P	Polyproline II helix	trans	-85.6	129.2	176.7	-55.2	0	0	0	0	110.9
301	D	28.2	Very low	43.1	Very low	166 Å²	166	113.4 Å²	113.4	89%	0.888	67%	0.674	S	S	*	*			trans	-149.4	86.2	153	-113.9	-28.1	0	0	0	110.9
302	S	29	Very low	40.7	Very low	122 Å²	122	116.6 Å²	116.6	85%	0.853	71%	0.707	S	S	*	*			trans	-165.8	121.5	164.5	-77.6	0	0	0	0	107.5
303	S	35.3	Very low	38.7	Very low	131 Å²	131	118.1 Å²	118.1	92%	0.916	73%	0.726	S	S	*	*			trans	-123.9	133	175.5	59.9	0	0	0	0	109.6
304	G	31	Very low	37.4	Very low	62 Å²	62	121.9 Å²	121.9	64%	0.639	75%	0.747	S	S	*	*			cis	168.4	-169.7	-6.5	0	0	0	0	0	109.8
305	W	23.8	Very low	36.6	Very low	243 Å²	243	125.8 Å²	125.8	92%	0.92	76%	0.764	S	S	*	*			trans	174.3	152.6	133.7	-103.3	54.3	0	0	0	111.5
306	T	29.5	Very low	37	Very low	122 Å²	122	123.5 Å²	123.5	75%	0.748	75%	0.75	S	S	*	*			trans	44.7	76.4	160.7	52	0	0	0	0	120.2
307	G	31.7	Very low	37.6	Very low	79 Å²	79	121.8 Å²	121.8	81%	0.814	74%	0.741	S	S	*	*				54.6	101.2	111.6	0	0	0	0	0	122.2
308	E	26.6	Very low	39.3	Very low	205 Å²	205	111.9 Å²	111.9	96%	0.958	70%	0.703	S	S	*	*			trans	-148	165.3	130.3	-131.5	-170.8	149.3	0	0	110.5
309	A	38.9	Very low	41.2	Very low	110 Å²	110	111 Å²	111	91%	0.909	68%	0.68	S	S	*	*			trans	-102.9	88.4	-168.6	0	0	0	0	0	113.7
310	G	29.2	Very low	43.6	Very low	74 Å²	74	107.9 Å²	107.9	76%	0.763	65%	0.645	S	S	*	*			trans	-111.5	137.1	176.3	0	0	0	0	0	114	G312	G310-G312 PolarHBondContact O-N 3.44Å
311	R	44.2	Very low	45.9	Very low	255 Å²	255	108 Å²	108	96%	0.962	63%	0.631	S	S	*	*			trans	-81.2	107.9	172.3	-80.4	-168.5	-74.5	-112.6	0.6	111.2
312	G	30.3	Very low	48	Very low	67 Å²	67	105 Å²	105	69%	0.691	61%	0.614	S	S	*	*	P	Polyproline II helix	trans	-78	143.1	163.7	0	0	0	0	0	112	G310	G310-G312 PolarHBondContact O-N 3.44Å
313	P	39.2	Very low	50.2	Low	109 Å²	109	101.2 Å²	101.2	71%	0.708	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-75.6	149.1	176.4	31.6	-34.6	0	0	0	111.9	Q315	P313-Q315 PolarHBondContact O-N 3.31Å
314	I	46.9	Very low	51.9	Low	123 Å²	123	100.2 Å²	100.2	63%	0.631	58%	0.581	S	S	*	*	P	Polyproline II helix	trans	-73.4	123.3	173.2	-61.4	172.3	0	0	0	108.5	P295	P295-I314 HydrophobicContact CB-CG2 4.49Å
315	Q	55.6	Low	54.1	Low	137 Å²	137	101.4 Å²	101.4	64%	0.64	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-74.2	141	171.8	-78.2	178.9	-32.5	0	0	110.7	V296 P313	V296-Q315 PolarHBondContact N-O 2.89Å; P313-Q315 PolarHBondContact O-N 3.31Å
316	A	61	Low	56.9	Low	8 Å²	8	93.7 Å²	93.7	7%	0.066	55%	0.549	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	116.5	-160.9	0	0	0	0	0	110.1	F293 Y318 E328	F293-A316 HydrophobicContact CD2-CB 4.19Å; F293-A316 HydrophobicContact CE2-CB 3.45Å; F293-A316 VanDerWaalsContact CE2-CB 3.45Å; F293-A316 HydrophobicContact CZ-CB 4.24Å; A316-Y318 HydrophobicContact CB-CD2 4.42Å; A316-Y318 HydrophobicContact CB-CE2 3.59Å; A316-Y318 WeakPolarHBondContact O-CD2 3.43Å; A316-E328 WeakPolarHBondContact O-CA 3.42Å
317	C	67.2	Low	59	Low	25 Å²	25	88.9 Å²	88.9	17%	0.169	52%	0.52	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	121.8	-176.2	-47.1	0	0	0	0	109.9	F293 I294 V296 E328	F293-C317 WeakPolarHBondContact CA-O 3.47Å; I294-C317 PolarHBondContact N-O 3.46Å; I294-C317 PolarHBondContact O-N 2.87Å; I294-C317 VanDerWaalsContact O-N 3.09Å; V296-C317 WeakPolarHBondContact CG2-SG 3.38Å; C317-E328 HydrophobicContact CB-CG 4.35Å; C317-E328 PolarHBondContact SG-OE1 2.95Å
318	Y	80.1	Confident	60.8	Low	23 Å²	23	90.7 Å²	90.7	9%	0.09	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	135.4	-177.9	-64.8	-89.5	0	0	0	110	V282 Y292 F293 A316 S326 C327 G332 L336	V282-Y318 HydrophobicContact CG2-CD1 4.19Å; V282-Y318 HydrophobicContact CG2-CE1 4.41Å; Y292-Y318 WeakPolarHBondContact O-CA 3.23Å; F293-Y318 HydrophobicContact CB-CD1 3.88Å; F293-Y318 HydrophobicContact CB-CE1 3.75Å; F293-Y318 HydrophobicContact CD2-CD1 4.24Å; F293-Y318 AromaticContact CD2-CE1 3.78Å; F293-Y318 HydrophobicContact CD2-CE1 3.78Å; F293-Y318 HydrophobicContact CD2-CE2 4.25Å; F293-Y318 AromaticContact CD2-CZ 3.8Å; F293-Y318 HydrophobicContact CG-CD1 4.32Å; F293-Y318 AromaticContact CG-CE1 3.79Å; F293-Y318 HydrophobicContact CG-CE1 3.79Å; A316-Y318 HydrophobicContact CB-CD2 4.42Å; A316-Y318 HydrophobicContact CB-CE2 3.59Å; A316-Y318 WeakPolarHBondContact O-CD2 3.43Å; Y318-S326 CarbonylContact O-C 3.53Å; Y318-S326 WeakPolarHBondContact O-CA 3.47Å; Y318-S326 WeakPolarHBondContact O-CB 3.4Å; Y318-C327 PolarHBondContact N-O 3.43Å; Y318-C327 PolarHBondContact O-N 3.19Å; Y318-G332 VanDerWaalsContact CD2-CA 3.41Å; Y318-G332 VanDerWaalsContact CG-C 3.46Å; Y318-L336 HydrophobicContact CD1-CD2 4.44Å
319	W	74.2	Confident	62.1	Low	78 Å²	78	90 Å²	90	30%	0.295	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	129.8	-165.5	42	-51.2	0	0	0	111.5	G291 Y292 I294	G291-W319 CarbonylContact C-O 3.27Å; G291-W319 VanDerWaalsContact CA-O 3.23Å; G291-W319 WeakPolarHBondContact CA-O 3.45Å; Y292-W319 VanDerWaalsContact C-CD1 3.49Å; Y292-W319 PolarHBondContact N-O 3.27Å; Y292-W319 PolarHBondContact O-N 2.95Å; Y292-W319 PolarHBondContact O-NE1 2.96Å; I294-W319 HydrophobicContact CD1-CH2 4.2Å; I294-W319 HydrophobicContact CD1-CZ2 3.39Å; I294-W319 HydrophobicContact CG1-CZ2 3.76Å
320	C	82.3	Confident	62.8	Low	13 Å²	13	89.5 Å²	89.5	9%	0.088	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	146	-174.6	-169.2	0	0	0	0	112.3	W325 L336	C320-W325 PolarHBondContact N-O 2.81Å; C320-L336 HydrophobicContact CB-CD1 3.93Å
321	K	79.5	Confident	64.1	Low	115 Å²	115	92.4 Å²	92.4	50%	0.5	48%	0.48	S	S	.	.	S	Bend	trans	-80.3	-27.2	176.1	-174.5	-176.7	173.6	-168.6	0	113.4	V289 V290 Y292	V289-K321 HydrophobicContact CG1-CD 4.34Å; V289-K321 WeakPolarHBondContact O-CD 3.35Å; V290-K321 WeakPolarHBondContact O-CB 3.39Å; V290-K321 PolarHBondContact O-N 3.02Å; Y292-K321 HydrophobicContact CE2-CB 4.35Å; Y292-K321 HydrophobicContact CE2-CG 4.31Å
322	L	72.3	Confident	65	Low	103 Å²	103	80.2 Å²	80.2	54%	0.539	43%	0.434	S	S	.	.	S	Bend	trans	-100.9	-19.5	-171.2	-65.9	-180	0	0	0	114.1	Y340 H344	L322-Y340 HydrophobicContact CD1-CD2 4.06Å; L322-Y340 HydrophobicContact CD1-CE2 3.44Å; L322-Y340 VanDerWaalsContact CD1-CE2 3.44Å; L322-Y340 HydrophobicContact CG-CE2 4.12Å; L322-H344 HydrophobicContact CD1-CB 3.58Å
323	C	75.4	Confident	67	Low	43 Å²	43	79.4 Å²	79.4	29%	0.291	42%	0.418	S	S	.	.	S	Bend	trans	-143.8	168.6	177.1	73.5	0	0	0	0	110.8	W325 H339	C323-W325 PolarHBondContact O-N 3.32Å; C323-W325 VanDerWaalsContact O-N 3.11Å; C323-W325 WeakPolarHBondContact SG-CB 3.41Å; C323-H339 PolarHBondContact SG-NE2 2.98Å
324	S	71.5	Confident	68.6	Low	110 Å²	110	77 Å²	77	77%	0.769	41%	0.407	S	S	*	.	S	Bend	trans	-82.1	28.9	179.4	-56.1	0	0	0	0	113.9
325	W	77.5	Confident	70	Confident	88 Å²	88	74.9 Å²	74.9	33%	0.333	39%	0.393	S	S	.	.			trans	-84.8	137	174.9	-175.1	89.4	0	0	0	111.2	C320 C323 C327 K335 L336 H339	C320-W325 PolarHBondContact N-O 2.81Å; C323-W325 PolarHBondContact O-N 3.32Å; C323-W325 VanDerWaalsContact O-N 3.11Å; C323-W325 WeakPolarHBondContact SG-CB 3.41Å; W325-C327 HydrophobicContact CH2-CB 3.63Å; W325-C327 WeakPolarHBondContact CH2-SG 3.24Å; W325-C327 HydrophobicContact CZ2-CB 3.91Å; W325-C327 HydrophobicContact CZ3-CB 4.19Å; W325-K335 HydrophobicContact CH2-CB 4.24Å; W325-L336 HydrophobicContact CE3-CD1 4.28Å; W325-L336 HydrophobicContact CZ3-CB 4.22Å; W325-L336 HydrophobicContact CZ3-CD1 4.06Å; W325-H339 AromaticContact CD1-CE1 3.78Å; W325-H339 AromaticContact CD1-ND1 3.89Å; W325-H339 HydrophobicContact CD2-CB 4.5Å; W325-H339 AromaticContact CD2-CE1 3.73Å; W325-H339 AromaticContact CD2-CG 3.86Å; W325-H339 AromaticContact CD2-ND1 3.46Å; W325-H339 AromaticContact CE2-ND1 3.69Å; W325-H339 HydrophobicContact CE3-CB 4.18Å; W325-H339 AromaticContact CE3-CG 3.82Å; W325-H339 AromaticContact CE3-ND1 3.92Å; W325-H339 AromaticContact CG-CE1 3.38Å; W325-H339 AromaticContact CG-ND1 3.6Å; W325-H339 AromaticContact CG-NE2 4Å; W325-H339 HydrophobicContact CH2-CB 4.16Å; W325-H339 HydrophobicContact CZ2-CB 4.49Å; W325-H339 HydrophobicContact CZ3-CB 4.02Å; W325-H339 AromaticContact NE1-ND1 3.93Å
326	S	81.3	Confident	71	Confident	80 Å²	80	68.4 Å²	68.4	56%	0.559	36%	0.363	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.1	153.1	173.3	54.4	0	0	0	0	111	Y318	Y318-S326 CarbonylContact O-C 3.53Å; Y318-S326 WeakPolarHBondContact O-CA 3.47Å; Y318-S326 WeakPolarHBondContact O-CB 3.4Å
327	C	74.3	Confident	71.9	Confident	21 Å²	21	69.8 Å²	69.8	14%	0.142	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	151.5	167.6	67.1	0	0	0	0	110.8	Y318 W325	Y318-C327 PolarHBondContact N-O 3.43Å; Y318-C327 PolarHBondContact O-N 3.19Å; W325-C327 HydrophobicContact CH2-CB 3.63Å; W325-C327 WeakPolarHBondContact CH2-SG 3.24Å; W325-C327 HydrophobicContact CZ2-CB 3.91Å; W325-C327 HydrophobicContact CZ3-CB 4.19Å
328	E	69.5	Low	72.4	Confident	118 Å²	118	73.5 Å²	73.5	55%	0.551	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.8	144	164.7	-53.9	-174.4	152.8	0	0	106.9	A316 C317	A316-E328 WeakPolarHBondContact O-CA 3.42Å; C317-E328 HydrophobicContact CB-CG 4.35Å; C317-E328 PolarHBondContact SG-OE1 2.95Å
329	W	53.9	Low	72.5	Confident	189 Å²	189	73.6 Å²	73.6	72%	0.716	39%	0.385	S	S	*	.	S	Bend	trans	151.5	164.3	165.4	-80.9	10.3	0	0	0	109.3	E331 G332	W329-E331 PolarHBondContact O-N 3.4Å; W329-E331 VanDerWaalsContact O-N 3.1Å; W329-G332 PolarHBondContact O-N 3.09Å
330	S	52.8	Low	72.7	Confident	100 Å²	100	71.5 Å²	71.5	70%	0.699	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-18.9	-174.5	-51.5	0	0	0	0	115.7
331	E	56.7	Low	72.5	Confident	135 Å²	135	74.9 Å²	74.9	63%	0.631	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	16.9	177.1	-61	180	137.9	0	0	112.5	W329 S333 A334 K335	W329-E331 PolarHBondContact O-N 3.4Å; W329-E331 VanDerWaalsContact O-N 3.1Å; E331-S333 PolarHBondContact O-N 3.32Å; E331-S333 VanDerWaalsContact O-N 3.09Å; E331-A334 PolarHBondContact O-N 3.35Å; E331-K335 PolarHBondContact O-N 3.34Å
332	G	63.7	Low	72.1	Confident	0 Å²	0	74.6 Å²	74.6	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-62.4	-19.6	-172	0	0	0	0	0	115	Y318 W329 L336	Y318-G332 VanDerWaalsContact CD2-CA 3.41Å; Y318-G332 VanDerWaalsContact CG-C 3.46Å; W329-G332 PolarHBondContact O-N 3.09Å; G332-L336 WeakPolarHBondContact O-CB 3.44Å; G332-L336 PolarHBondContact O-N 3.45Å
333	S	71.3	Confident	71.9	Confident	50 Å²	50	77.8 Å²	77.8	35%	0.35	40%	0.397	S	S	.	.	H	α-helix	trans	-65	-42.2	169.8	48.3	0	0	0	0	112.7	E331 L336 L337	E331-S333 PolarHBondContact O-N 3.32Å; E331-S333 VanDerWaalsContact O-N 3.09Å; S333-L336 PolarHBondContact O-N 2.75Å; S333-L337 PolarHBondContact O-N 2.92Å
334	A	73.9	Confident	71.7	Confident	59 Å²	59	79.1 Å²	79.1	49%	0.488	40%	0.399	S	S	.	.	H	α-helix	trans	-68.5	-45.4	178.9	0	0	0	0	0	111	E331 L336 L337 E338	E331-A334 PolarHBondContact O-N 3.35Å; A334-L336 VanDerWaalsContact C-N 3.27Å; A334-L336 PolarHBondContact O-N 3.02Å; A334-L337 PolarHBondContact O-N 3.02Å; A334-E338 WeakPolarHBondContact O-CB 3.23Å; A334-E338 PolarHBondContact O-N 3.1Å
335	K	75.6	Confident	71.3	Confident	78 Å²	78	77.9 Å²	77.9	34%	0.339	38%	0.38	S	S	.	.	H	α-helix	trans	-64.2	-31.2	175.4	-66.2	-175.7	179.2	179.9	0	112.8	W325 E331 H339	W325-K335 HydrophobicContact CH2-CB 4.24Å; E331-K335 PolarHBondContact O-N 3.34Å; K335-H339 WeakPolarHBondContact O-CB 3.25Å; K335-H339 PolarHBondContact O-N 2.74Å
336	L	78.1	Confident	69.6	Low	0 Å²	0	77.2 Å²	77.2	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-70.5	-39	173.7	173.7	61.9	0	0	0	112.4	V282 V290 Y318 C320 W325 G332 S333 A334 Y340	V282-L336 HydrophobicContact CB-CD2 4.04Å; V282-L336 HydrophobicContact CG1-CD2 4.21Å; V282-L336 HydrophobicContact CG2-CD2 4.11Å; V290-L336 HydrophobicContact CG1-CD1 4.17Å; V290-L336 HydrophobicContact CG1-CG 3.9Å; Y318-L336 HydrophobicContact CD1-CD2 4.44Å; C320-L336 HydrophobicContact CB-CD1 3.93Å; W325-L336 HydrophobicContact CE3-CD1 4.28Å; W325-L336 HydrophobicContact CZ3-CB 4.22Å; W325-L336 HydrophobicContact CZ3-CD1 4.06Å; G332-L336 WeakPolarHBondContact O-CB 3.44Å; G332-L336 PolarHBondContact O-N 3.45Å; S333-L336 PolarHBondContact O-N 2.75Å; A334-L336 VanDerWaalsContact C-N 3.27Å; A334-L336 PolarHBondContact O-N 3.02Å; L336-Y340 WeakPolarHBondContact O-CB 3.36Å; L336-Y340 PolarHBondContact O-N 3.48Å; L336-Y340 VanDerWaalsContact O-N 3.14Å
337	L	78.2	Confident	68	Low	38 Å²	38	79.2 Å²	79.2	20%	0.199	40%	0.404	C	S	.	.	H	α-helix	trans	-63.9	-52.7	169.9	-103.9	64.9	0	0	0	110.7	V282 V290 S333 A334 H339 Y340 E341	V282-L337 HydrophobicContact CG1-CD1 3.6Å; V290-L337 HydrophobicContact CB-CD1 4.29Å; V290-L337 HydrophobicContact CG1-CD1 4.22Å; V290-L337 HydrophobicContact CG2-CD1 4.12Å; S333-L337 PolarHBondContact O-N 2.92Å; A334-L337 PolarHBondContact O-N 3.02Å; L337-H339 VanDerWaalsContact C-N 3.31Å; L337-H339 PolarHBondContact O-N 3.16Å; L337-Y340 CarbonylContact O-C 3.19Å; L337-Y340 WeakPolarHBondContact O-CA 3.49Å; L337-Y340 WeakPolarHBondContact O-CB 3.4Å; L337-Y340 PolarHBondContact O-N 3.48Å; L337-E341 WeakPolarHBondContact O-CG 3.42Å; L337-E341 PolarHBondContact O-N 3.49Å
338	E	79.6	Confident	66.2	Low	102 Å²	102	83.6 Å²	83.6	48%	0.477	44%	0.442	S	S	.	.	H	α-helix	trans	-52.5	-48.1	178.3	-177	-171.7	-178.9	0	0	111.8	A334 Y340 E341 Q342	A334-E338 WeakPolarHBondContact O-CB 3.23Å; A334-E338 PolarHBondContact O-N 3.1Å; E338-Y340 VanDerWaalsContact C-N 3.35Å; E338-Y340 PolarHBondContact O-N 2.95Å; E338-E341 PolarHBondContact O-N 2.85Å; E338-Q342 HydrophobicContact CG-CG 4.37Å; E338-Q342 WeakPolarHBondContact O-CB 3.13Å; E338-Q342 VanDerWaalsContact O-CG 3.29Å; E338-Q342 WeakPolarHBondContact O-CG 3.48Å; E338-Q342 PolarHBondContact O-N 3.16Å; E338-Q342 PolarHBondContact OE1-NE2 2.93Å
339	H	81.8	Confident	64.4	Low	25 Å²	25	81.2 Å²	81.2	12%	0.116	45%	0.449	C	S	.	.	H	α-helix	trans	-56.5	-47	175.1	175.1	96.5	0	0	0	112.2	C323 W325 K335 L337 R343	C323-H339 PolarHBondContact SG-NE2 2.98Å; W325-H339 AromaticContact CD1-CE1 3.78Å; W325-H339 AromaticContact CD1-ND1 3.89Å; W325-H339 HydrophobicContact CD2-CB 4.5Å; W325-H339 AromaticContact CD2-CE1 3.73Å; W325-H339 AromaticContact CD2-CG 3.86Å; W325-H339 AromaticContact CD2-ND1 3.46Å; W325-H339 AromaticContact CE2-ND1 3.69Å; W325-H339 HydrophobicContact CE3-CB 4.18Å; W325-H339 AromaticContact CE3-CG 3.82Å; W325-H339 AromaticContact CE3-ND1 3.92Å; W325-H339 AromaticContact CG-CE1 3.38Å; W325-H339 AromaticContact CG-ND1 3.6Å; W325-H339 AromaticContact CG-NE2 4Å; W325-H339 HydrophobicContact CH2-CB 4.16Å; W325-H339 HydrophobicContact CZ2-CB 4.49Å; W325-H339 HydrophobicContact CZ3-CB 4.02Å; W325-H339 AromaticContact NE1-ND1 3.93Å; K335-H339 WeakPolarHBondContact O-CB 3.25Å; K335-H339 PolarHBondContact O-N 2.74Å; L337-H339 VanDerWaalsContact C-N 3.31Å; L337-H339 PolarHBondContact O-N 3.16Å; H339-R343 VanDerWaalsContact O-CB 3.27Å; H339-R343 WeakPolarHBondContact O-CB 3.46Å; H339-R343 WeakPolarHBondContact O-CG 3.22Å; H339-R343 PolarHBondContact O-N 3.22Å
340	Y	77.5	Confident	63.3	Low	35 Å²	35	78.1 Å²	78.1	14%	0.137	45%	0.451	C	S	.	.	H	α-helix	trans	-66.2	-41.1	179.9	-180	-86.5	0	0	0	111.8	V290 L322 L336 L337 E338 H344 K345	V290-Y340 HydrophobicContact CB-CD2 4.17Å; V290-Y340 HydrophobicContact CB-CG 4.21Å; V290-Y340 HydrophobicContact CG1-CD1 4.38Å; V290-Y340 HydrophobicContact CG1-CD2 3.74Å; V290-Y340 HydrophobicContact CG1-CG 3.65Å; V290-Y340 HydrophobicContact CG2-CD1 3.8Å; V290-Y340 HydrophobicContact CG2-CD2 4.19Å; V290-Y340 HydrophobicContact CG2-CE1 4.01Å; V290-Y340 HydrophobicContact CG2-CE2 4.36Å; V290-Y340 HydrophobicContact CG2-CG 3.9Å; L322-Y340 HydrophobicContact CD1-CD2 4.06Å; L322-Y340 HydrophobicContact CD1-CE2 3.44Å; L322-Y340 VanDerWaalsContact CD1-CE2 3.44Å; L322-Y340 HydrophobicContact CG-CE2 4.12Å; L336-Y340 WeakPolarHBondContact O-CB 3.36Å; L336-Y340 PolarHBondContact O-N 3.48Å; L336-Y340 VanDerWaalsContact O-N 3.14Å; L337-Y340 CarbonylContact O-C 3.19Å; L337-Y340 WeakPolarHBondContact O-CA 3.49Å; L337-Y340 WeakPolarHBondContact O-CB 3.4Å; L337-Y340 PolarHBondContact O-N 3.48Å; E338-Y340 VanDerWaalsContact C-N 3.35Å; E338-Y340 PolarHBondContact O-N 2.95Å; Y340-H344 HydrophobicContact CD2-CB 4.18Å; Y340-H344 HydrophobicContact CE2-CB 4.35Å; Y340-H344 HydrophobicContact CG-CB 4.42Å; Y340-H344 CarbonylContact O-C 3.6Å; Y340-H344 VanDerWaalsContact O-CA 3.29Å; Y340-H344 WeakPolarHBondContact O-CA 3.44Å; Y340-H344 VanDerWaalsContact O-CB 3.32Å; Y340-H344 WeakPolarHBondContact O-CB 3.45Å; Y340-H344 PolarHBondContact O-N 2.58Å; Y340-K345 HydrophobicContact CD1-CB 4.49Å; Y340-K345 HydrophobicContact CE1-CB 4.45Å; Y340-K345 HydrophobicContact CE1-CD 4.4Å; Y340-K345 PolarHBondContact O-N 2.82Å; Y340-K345 VanDerWaalsContact O-N 3.07Å
341	E	78.4	Confident	62.5	Low	84 Å²	84	78 Å²	78	39%	0.393	46%	0.456	S	S	.	.	I	π-helix	trans	-69.3	-44.4	179.5	-60.7	-155.4	131.9	0	0	111.6	L337 E338 R343 K345	L337-E341 WeakPolarHBondContact O-CG 3.42Å; L337-E341 PolarHBondContact O-N 3.49Å; E338-E341 PolarHBondContact O-N 2.85Å; E341-R343 PolarHBondContact O-N 2.94Å; E341-K345 HydrophobicContact CB-CB 4.35Å; E341-K345 HydrophobicContact CB-CD 4.44Å; E341-K345 HydrophobicContact CG-CB 4.45Å; E341-K345 HydrophobicContact CG-CD 3.79Å; E341-K345 PolarHBondContact O-N 3.33Å; E341-K345 VanDerWaalsContact OE1-CD 3.25Å; E341-K345 WeakPolarHBondContact OE1-CD 3.34Å; E341-K345 WeakPolarHBondContact OE1-CE 3.45Å; E341-K345 IonicContact OE1-NZ 2.69Å; E341-K345 PolarHBondContact OE1-NZ 2.94Å
342	Q	71.8	Confident	61.1	Low	108 Å²	108	79.3 Å²	79.3	51%	0.505	46%	0.464	S	S	.	.	I	π-helix	trans	-67.7	-27.8	177.3	-70.6	178.4	10.5	0	0	114.5	E338	E338-Q342 HydrophobicContact CG-CG 4.37Å; E338-Q342 WeakPolarHBondContact O-CB 3.13Å; E338-Q342 VanDerWaalsContact O-CG 3.29Å; E338-Q342 WeakPolarHBondContact O-CG 3.48Å; E338-Q342 PolarHBondContact O-N 3.16Å; E338-Q342 PolarHBondContact OE1-NE2 2.93Å
343	R	67	Low	59.3	Low	171 Å²	171	84.6 Å²	84.6	65%	0.645	50%	0.501	S	S	*	.	I	π-helix	trans	-116.7	-16	-171.7	-54.6	-58.7	172.1	93.9	-0.1	115.3	H339 E341	H339-R343 VanDerWaalsContact O-CB 3.27Å; H339-R343 WeakPolarHBondContact O-CB 3.46Å; H339-R343 WeakPolarHBondContact O-CG 3.22Å; H339-R343 PolarHBondContact O-N 3.22Å; E341-R343 PolarHBondContact O-N 2.94Å
344	H	72.4	Confident	57.6	Low	71 Å²	71	87.8 Å²	87.8	33%	0.329	52%	0.52	S	S	.	.	I	π-helix	trans	-136.2	-14.1	-172.9	-57.8	-45.2	0	0	0	115.1	L322 Y340	L322-H344 HydrophobicContact CD1-CB 3.58Å; Y340-H344 HydrophobicContact CD2-CB 4.18Å; Y340-H344 HydrophobicContact CE2-CB 4.35Å; Y340-H344 HydrophobicContact CG-CB 4.42Å; Y340-H344 CarbonylContact O-C 3.6Å; Y340-H344 VanDerWaalsContact O-CA 3.29Å; Y340-H344 WeakPolarHBondContact O-CA 3.44Å; Y340-H344 VanDerWaalsContact O-CB 3.32Å; Y340-H344 WeakPolarHBondContact O-CB 3.45Å; Y340-H344 PolarHBondContact O-N 2.58Å
345	K	62.1	Low	55.3	Low	84 Å²	84	92 Å²	92	37%	0.365	53%	0.534	S	S	.	.	I	π-helix	trans	-105.5	-9.4	179.1	-153.4	173.5	178.3	173.4	0	114.1	D286 Y340 E341 P347	D286-K345 WeakPolarHBondContact OD1-CE 3.48Å; D286-K345 IonicContact OD1-NZ 2.7Å; D286-K345 PolarHBondContact OD1-NZ 2.83Å; Y340-K345 HydrophobicContact CD1-CB 4.49Å; Y340-K345 HydrophobicContact CE1-CB 4.45Å; Y340-K345 HydrophobicContact CE1-CD 4.4Å; Y340-K345 PolarHBondContact O-N 2.82Å; Y340-K345 VanDerWaalsContact O-N 3.07Å; E341-K345 HydrophobicContact CB-CB 4.35Å; E341-K345 HydrophobicContact CB-CD 4.44Å; E341-K345 HydrophobicContact CG-CB 4.45Å; E341-K345 HydrophobicContact CG-CD 3.79Å; E341-K345 PolarHBondContact O-N 3.33Å; E341-K345 VanDerWaalsContact OE1-CD 3.25Å; E341-K345 WeakPolarHBondContact OE1-CD 3.34Å; E341-K345 WeakPolarHBondContact OE1-CE 3.45Å; E341-K345 IonicContact OE1-NZ 2.69Å; E341-K345 PolarHBondContact OE1-NZ 2.94Å; K345-P347 WeakPolarHBondContact O-CD 3.38Å
346	A	42.7	Very low	52.9	Low	74 Å²	74	93 Å²	93	61%	0.612	55%	0.551	S	S	*	*	P	Polyproline II helix	trans	-74.4	120.8	178.8	0	0	0	0	0	112.4
347	P	47.4	Very low	50.4	Low	122 Å²	122	98.5 Å²	98.5	79%	0.792	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-74.5	162.3	168.7	33	-34.7	0	0	0	111.1	K345	K345-P347 WeakPolarHBondContact O-CD 3.38Å
348	A	36.2	Very low	47.9	Very low	113 Å²	113	100.5 Å²	100.5	93%	0.934	62%	0.62	S	S	*	*	S	Bend	trans	-75.6	127.9	-173.8	0	0	0	0	0	113.6
349	G	31.9	Very low	45.4	Very low	68 Å²	68	104.3 Å²	104.3	70%	0.701	64%	0.642	S	S	*	*			trans	126.4	146.5	154.3	0	0	0	0	0	116.6
350	V	31.2	Very low	42.9	Very low	124 Å²	124	114.3 Å²	114.3	75%	0.752	68%	0.679	S	S	*	*			trans	66	101.2	167.6	-167.4	0	0	0	0	116.2	M352	V350-M352 HydrophobicContact CG1-CE 3.7Å; V350-M352 HydrophobicContact CG1-CG 4.07Å
351	A	36	Very low	40.4	Very low	98 Å²	98	120.5 Å²	120.5	81%	0.81	71%	0.714	S	S	*	*			trans	-77.3	144	158.5	0	0	0	0	0	110.4
352	M	26.7	Very low	38.1	Very low	162 Å²	162	124.3 Å²	124.3	80%	0.798	73%	0.732	S	S	*	*			trans	-139	127.3	168.3	-78.8	-65.6	151.8	0	0	111.1	V350	V350-M352 HydrophobicContact CG1-CE 3.7Å; V350-M352 HydrophobicContact CG1-CG 4.07Å
353	S	24.9	Very low	36	Very low	111 Å²	111	125.7 Å²	125.7	78%	0.776	74%	0.743	S	S	*	*			trans	-100.6	152.3	153.3	-71.4	0	0	0	0	108.4
354	P	36.8	Very low	34.1	Very low	116 Å²	116	123.9 Å²	123.9	75%	0.753	75%	0.751	S	S	*	*			trans	-85.9	131.2	-165.5	31.8	-34.4	0	0	0	113.5
355	N	25.7	Very low	31.9	Very low	148 Å²	148	124.3 Å²	124.3	79%	0.791	77%	0.774	S	S	*	*				-178.1	154.3	107	-109.2	-32	0	0	0	117.1
356	S	24.2	Very low	30.3	Very low	98 Å²	98	129.1 Å²	129.1	69%	0.685	80%	0.795	S	S	*	*			trans	67.1	142	145.8	58.4	0	0	0	0	123.4
357	S	25.7	Very low	29.5	Very low	117 Å²	117	132.3 Å²	132.3	82%	0.818	81%	0.806	S	S	*	*			trans	55	93.4	154.6	51.1	0	0	0	0	118.5
358	G	25.6	Very low	28.6	Very low	80 Å²	80	134 Å²	134	83%	0.825	80%	0.804	S	S	*	*			trans	-97.2	-168.8	166.2	0	0	0	0	0	113.9
359	L	28.3	Very low	28.5	Very low	181 Å²	181	135.9 Å²	135.9	95%	0.948	80%	0.797	S	S	*	*			trans	-143.7	163.1	164	-112.1	164	0	0	0	108.8
360	R	28.3	Very low	28.1	Very low	236 Å²	236	144.2 Å²	144.2	89%	0.891	81%	0.807	S	S	*	*			trans	-98.5	148.1	-179.3	-57.1	172.2	180	172	-2.3	109.8
361	D	25.8	Very low	27.9	Very low	164 Å²	164	145 Å²	145	88%	0.877	81%	0.808	S	S	*	*				-157.1	168.2	123.9	-132.7	-40.6	0	0	0	111.7
362	E	29.7	Very low	27.6	Very low	165 Å²	165	146.1 Å²	146.1	77%	0.771	81%	0.806	S	S	*	*			trans	-108.6	161.7	-176.9	-69.5	-166.5	80	0	0	114.4
363	N	27.5	Very low	27.9	Very low	136 Å²	136	148.5 Å²	148.5	73%	0.727	81%	0.812	S	S	*	*				118.6	145.9	120.2	-131.1	-22.4	0	0	0	120.2
364	V	27.2	Very low	28.1	Very low	134 Å²	134	148.8 Å²	148.8	81%	0.812	81%	0.814	S	S	*	*			trans	53.5	119.1	165	-161.7	0	0	0	0	120
365	G	26.6	Very low	27.9	Very low	79 Å²	79	146.6 Å²	146.6	81%	0.814	81%	0.813	S	S	*	*			trans	-178.1	45.2	169.4	0	0	0	0	0	117.3
366	K	27.7	Very low	28	Very low	185 Å²	185	147.2 Å²	147.2	80%	0.804	82%	0.816	S	S	*	*			trans	-93.6	111.2	-168.5	179.8	-173.8	176.5	-179.2	0	114.7
367	V	26.3	Very low	28.8	Very low	141 Å²	141	146.4 Å²	146.4	86%	0.855	81%	0.811	S	S	*	*			trans	-139.9	153.5	159.7	-174.6	0	0	0	0	109.9
368	H	28.6	Very low	29.4	Very low	158 Å²	158	149 Å²	149	73%	0.731	81%	0.81	S	S	*	*			trans	-100	135.2	-175.9	-79.3	8.4	0	0	0	114.9
369	L	33.2	Very low	30.4	Very low	152 Å²	152	148.3 Å²	148.3	80%	0.796	80%	0.796	S	S	*	*			trans	20.4	125.1	138.3	-157.2	80.8	0	0	0	120.1
370	R	23.9	Very low	31.4	Very low	243 Å²	243	142.4 Å²	142.4	92%	0.917	77%	0.768	S	S	*	*			trans	-162.9	134.5	143.7	-109.9	175	-165	-152.7	3.1	112
371	D	27.3	Very low	32.4	Very low	142 Å²	142	135.5 Å²	135.5	76%	0.759	75%	0.752	S	S	*	*			trans	-78.4	149.9	179.2	-49.5	-98	0	0	0	114.3
372	P	29.9	Very low	33.7	Very low	121 Å²	121	129.3 Å²	129.3	79%	0.786	72%	0.72	S	S	*	*			trans	-110.6	111.1	155.6	34	-23.1	0	0	0	111.7
373	K	32	Very low	34.8	Very low	212 Å²	212	125 Å²	125	92%	0.922	71%	0.708	S	S	*	*			trans	-74	126.4	165.2	-79.2	-175.8	175.3	-179.5	0	110.5
374	S	28.9	Very low	36.4	Very low	116 Å²	116	120.8 Å²	120.8	81%	0.811	68%	0.682	S	S	*	*			trans	-156.9	118.6	161	61.7	0	0	0	0	114.8
375	G	33	Very low	37.8	Very low	71 Å²	71	118.5 Å²	118.5	73%	0.732	67%	0.665	S	S	*	*			trans	73.3	46.9	144.3	0	0	0	0	0	118.7	S377	G375-S377 PolarHBondContact O-N 3.13Å; G375-S377 PolarHBondContact O-OG 2.93Å
376	D	29.3	Very low	39.5	Very low	161 Å²	161	115.3 Å²	115.3	86%	0.861	63%	0.63	S	S	*	*			trans	-59.1	133.1	168.3	-163	-1.8	0	0	0	110.8
377	S	40.6	Very low	40.9	Very low	81 Å²	81	114.9 Å²	114.9	57%	0.566	63%	0.631	S	S	*	*			trans	-120.3	86.2	-175.2	-61.6	0	0	0	0	107.7	G375 A379	G375-S377 PolarHBondContact O-N 3.13Å; G375-S377 PolarHBondContact O-OG 2.93Å; S377-A379 PolarHBondContact O-N 3.1Å; S377-A379 VanDerWaalsContact O-N 3.13Å
378	E	37.5	Very low	42.1	Very low	170 Å²	170	113 Å²	113	79%	0.794	62%	0.616	S	S	*	*			trans	-38	110.9	-167.4	-168.4	174.3	-162.1	0	0	113.4	V380	E378-V380 PolarHBondContact O-N 3.32Å
379	A	47.2	Very low	43.5	Very low	66 Å²	66	107.9 Å²	107.9	55%	0.545	60%	0.597	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76	113.6	-177.6	0	0	0	0	0	110.2	S377	S377-A379 PolarHBondContact O-N 3.1Å; S377-A379 VanDerWaalsContact O-N 3.13Å
380	V	49.7	Very low	44.4	Very low	57 Å²	57	108.4 Å²	108.4	35%	0.345	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-81.4	125	-179.2	-178.9	0	0	0	0	109	E378 A396 H397 A399	E378-V380 PolarHBondContact O-N 3.32Å; V380-A396 WeakPolarHBondContact O-CA 3.33Å; V380-H397 PolarHBondContact N-O 3.45Å; V380-H397 PolarHBondContact O-CE1 3.48Å; V380-H397 PolarHBondContact O-N 3.18Å; V380-H397 PolarHBondContact O-ND1 3.22Å; V380-H397 VanDerWaalsContact O-ND1 3.12Å; V380-A399 HydrophobicContact CG2-CB 3.89Å
381	V	47.9	Very low	45.6	Very low	92 Å²	92	100.8 Å²	100.8	56%	0.558	57%	0.574	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.7	107	171.2	-175.7	0	0	0	0	108.7	A396	V381-A396 HydrophobicContact CG2-CB 4.04Å
382	T	54.2	Low	46.9	Very low	34 Å²	34	100.7 Å²	100.7	21%	0.209	56%	0.563	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-85.4	129.2	165.3	50.8	0	0	0	0	108.5	Y384 S394 M395 H397	T382-Y384 VanDerWaalsContact OG1-CE2 3.24Å; T382-Y384 WeakPolarHBondContact OG1-CE2 3.31Å; T382-S394 VanDerWaalsContact O-CA 3.31Å; T382-S394 WeakPolarHBondContact O-CA 3.46Å; T382-M395 PolarHBondContact N-O 3.3Å; T382-M395 PolarHBondContact O-N 3.45Å; T382-H397 VanDerWaalsContact CG2-CE1 3.46Å; T382-H397 WeakPolarHBondContact CG2-CE1 3.41Å; T382-H397 PolarHBondContact N-CE1 3.06Å; T382-H397 PolarHBondContact OG1-CE1 2.81Å
383	S	53.1	Low	48.2	Very low	74 Å²	74	96.8 Å²	96.8	52%	0.517	53%	0.533	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	131.9	162.3	51.7	0	0	0	0	109.2	Y393	S383-Y393 CarbonylContact C-O 3.59Å; S383-Y393 WeakPolarHBondContact CA-O 3.4Å
384	Y	60.6	Low	49.2	Very low	47 Å²	47	90.1 Å²	90.1	18%	0.184	51%	0.513	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	117.1	172.9	-57.8	-80.8	0	0	0	108.2	T382 Y393 I402 I403 V404 L407	T382-Y384 VanDerWaalsContact OG1-CE2 3.24Å; T382-Y384 WeakPolarHBondContact OG1-CE2 3.31Å; Y384-Y393 HydrophobicContact CD2-CD1 4.09Å; Y384-Y393 PolarHBondContact N-O 3.34Å; Y384-Y393 PolarHBondContact O-N 3.16Å; Y384-I402 WeakPolarHBondContact OH-CG2 3.16Å; Y384-I403 WeakPolarHBondContact CE2-O 3.41Å; Y384-V404 HydrophobicContact CE1-CG1 4.49Å; Y384-L407 HydrophobicContact CD1-CD2 4.01Å; Y384-L407 HydrophobicContact CG-CD2 3.96Å
385	N	56.7	Low	50.6	Low	87 Å²	87	88.7 Å²	88.7	47%	0.465	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	142.7	165.9	-61.5	-1	0	0	0	108.3	R392	N385-R392 HydrophobicContact CB-CG 4.3Å; N385-R392 WeakPolarHBondContact OD1-CG 3.41Å; N385-R392 PolarHBondContact OD1-NE 3.26Å
386	C	61.3	Low	51.4	Low	12 Å²	12	88 Å²	88	8%	0.081	48%	0.482	C	S	.	.			trans	-63.4	151.9	158.9	-169.4	0	0	0	0	109.4	L388 C389 F391 H410 Y411 H415	C386-L388 PolarHBondContact SG-N 2.95Å; C386-L388 VanDerWaalsContact SG-N 3.45Å; C386-C389 WeakPolarHBondContact CB-O 3.31Å; C386-F391 HydrophobicContact CB-CB 4.19Å; C386-F391 PolarHBondContact N-O 3.45Å; C386-H410 PolarHBondContact SG-NE2 2.83Å; C386-H410 VanDerWaalsContact SG-NE2 3.36Å; C386-Y411 WeakPolarHBondContact SG-CE1 3.43Å; C386-H415 PolarHBondContact SG-NE2 2.99Å
387	Q	57.4	Low	52.6	Low	175 Å²	175	81.3 Å²	81.3	82%	0.818	45%	0.446	S	S	*	.	S	Bend	trans	-97.9	0.9	175.5	-64.6	-178	21.6	0	0	112.4	Y411	Q387-Y411 PolarHBondContact N-OH 3.17Å
388	L	52.1	Low	52.7	Low	102 Å²	102	80.6 Å²	80.6	53%	0.534	44%	0.441	S	S	.	.	S	Bend	trans	-128.3	-9	-170.1	-57.1	174.4	0	0	0	113.4	C386 Y411 H415 I417	C386-L388 PolarHBondContact SG-N 2.95Å; C386-L388 VanDerWaalsContact SG-N 3.45Å; L388-Y411 HydrophobicContact CD1-CD1 4.22Å; L388-Y411 HydrophobicContact CD1-CE1 3.96Å; L388-Y411 HydrophobicContact CG-CE1 4.31Å; L388-H415 HydrophobicContact CD1-CB 4.17Å; L388-I417 HydrophobicContact CD1-CD1 3.36Å
389	C	57	Low	53.2	Low	51 Å²	51	76.2 Å²	76.2	35%	0.345	43%	0.433	S	S	.	.	S	Bend	trans	-158.1	174.6	166.2	68	0	0	0	0	110	C386 F391 H410 H415	C386-C389 WeakPolarHBondContact CB-O 3.31Å; C389-F391 PolarHBondContact O-N 3.15Å; C389-F391 VanDerWaalsContact SG-CB 3.58Å; C389-H410 PolarHBondContact SG-CE1 2.79Å; C389-H410 PolarHBondContact SG-NE2 2.97Å; C389-H410 VanDerWaalsContact SG-NE2 3.38Å; C389-H415 PolarHBondContact SG-NE2 3.06Å
390	D	53.1	Low	52.6	Low	162 Å²	162	80.7 Å²	80.7	87%	0.866	45%	0.448	S	S	*	.	S	Bend	trans	-74.9	13.8	-179.4	-60.3	-65.5	0	0	0	115	R392	D390-R392 WeakPolarHBondContact O-CG 3.25Å; D390-R392 PolarHBondContact O-N 3.19Å
391	F	49.3	Very low	52.3	Low	83 Å²	83	80.5 Å²	80.5	36%	0.364	45%	0.447	S	S	.	.			trans	-66.8	129.8	174.6	-177.4	-97.1	0	0	0	111.4	C386 C389 H410	C386-F391 HydrophobicContact CB-CB 4.19Å; C386-F391 PolarHBondContact N-O 3.45Å; C389-F391 PolarHBondContact O-N 3.15Å; C389-F391 VanDerWaalsContact SG-CB 3.58Å; F391-H410 WeakPolarHBondContact CB-CE1 3.33Å; F391-H410 WeakPolarHBondContact CB-NE2 3.49Å; F391-H410 HydrophobicContact CD1-CB 3.95Å; F391-H410 AromaticContact CD1-CD2 3.53Å; F391-H410 AromaticContact CD1-CE1 3.8Å; F391-H410 AromaticContact CD1-CG 3.33Å; F391-H410 AromaticContact CD1-ND1 3.52Å; F391-H410 AromaticContact CD1-NE2 3.82Å; F391-H410 AromaticContact CD2-ND1 3.83Å; F391-H410 HydrophobicContact CE1-CB 3.71Å; F391-H410 AromaticContact CE1-CG 3.63Å; F391-H410 AromaticContact CE1-ND1 3.97Å; F391-H410 AromaticContact CG-CE1 3.47Å; F391-H410 VanDerWaalsContact CG-CE1 3.47Å; F391-H410 WeakPolarHBondContact CG-CE1 3Å; F391-H410 AromaticContact CG-CG 3.78Å; F391-H410 AromaticContact CG-ND1 3.43Å; F391-H410 WeakPolarHBondContact CG-ND1 3.12Å; F391-H410 AromaticContact CG-NE2 3.82Å; F391-H410 HydrophobicContact CZ-CB 4.28Å
392	R	53.9	Low	52.3	Low	140 Å²	140	80.9 Å²	80.9	53%	0.528	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	121.7	-177.2	-61.1	178.8	63.8	-136.1	-5.6	109.9	N385 D390	N385-R392 HydrophobicContact CB-CG 4.3Å; N385-R392 WeakPolarHBondContact OD1-CG 3.41Å; N385-R392 PolarHBondContact OD1-NE 3.26Å; D390-R392 WeakPolarHBondContact O-CG 3.25Å; D390-R392 PolarHBondContact O-N 3.19Å
393	Y	57.4	Low	52.3	Low	39 Å²	39	82 Å²	82	15%	0.153	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131.4	176.9	170.7	-104.7	0	0	0	109.8	S383 Y384 M395 P406	S383-Y393 CarbonylContact C-O 3.59Å; S383-Y393 WeakPolarHBondContact CA-O 3.4Å; Y384-Y393 HydrophobicContact CD2-CD1 4.09Å; Y384-Y393 PolarHBondContact N-O 3.34Å; Y384-Y393 PolarHBondContact O-N 3.16Å; Y393-M395 HydrophobicContact CE1-CB 4.15Å; Y393-M395 HydrophobicContact CE2-CB 4.42Å; Y393-M395 HydrophobicContact CE2-CE 4.28Å; Y393-M395 WeakPolarHBondContact OH-CB 3.26Å; Y393-P406 HydrophobicContact CD1-CB 4.25Å; Y393-P406 HydrophobicContact CD2-CB 4.05Å; Y393-P406 HydrophobicContact CE1-CB 4.12Å; Y393-P406 HydrophobicContact CE1-CG 4Å; Y393-P406 HydrophobicContact CE2-CB 3.92Å; Y393-P406 HydrophobicContact CE2-CG 3.95Å; Y393-P406 HydrophobicContact CG-CB 4.22Å
394	S	53.5	Low	52.4	Low	72 Å²	72	79.6 Å²	79.6	50%	0.503	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	133.5	177.7	56.5	0	0	0	0	111.7	T382	T382-S394 VanDerWaalsContact O-CA 3.31Å; T382-S394 WeakPolarHBondContact O-CA 3.46Å
395	M	58.5	Low	52.2	Low	87 Å²	87	79.6 Å²	79.6	43%	0.429	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.4	138.4	-177.4	-170.8	60.6	73.1	0	0	111.5	T382 Y393 H397	T382-M395 PolarHBondContact N-O 3.3Å; T382-M395 PolarHBondContact O-N 3.45Å; Y393-M395 HydrophobicContact CE1-CB 4.15Å; Y393-M395 HydrophobicContact CE2-CB 4.42Å; Y393-M395 HydrophobicContact CE2-CE 4.28Å; Y393-M395 WeakPolarHBondContact OH-CB 3.26Å; M395-H397 PolarHBondContact O-ND1 3.41Å; M395-H397 VanDerWaalsContact O-ND1 3.1Å
396	A	48.4	Very low	52.3	Low	55 Å²	55	77.6 Å²	77.6	46%	0.455	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	139	174.2	0	0	0	0	0	110.9	V380 V381	V380-A396 WeakPolarHBondContact O-CA 3.33Å; V381-A396 HydrophobicContact CG2-CB 4.04Å
397	H	55.8	Low	52.3	Low	21 Å²	21	77.8 Å²	77.8	10%	0.097	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.9	162.6	177.9	51.9	-78.7	0	0	0	110.2	V380 T382 M395 V401	V380-H397 PolarHBondContact N-O 3.45Å; V380-H397 PolarHBondContact O-CE1 3.48Å; V380-H397 PolarHBondContact O-N 3.18Å; V380-H397 PolarHBondContact O-ND1 3.22Å; V380-H397 VanDerWaalsContact O-ND1 3.12Å; T382-H397 VanDerWaalsContact CG2-CE1 3.46Å; T382-H397 WeakPolarHBondContact CG2-CE1 3.41Å; T382-H397 PolarHBondContact N-CE1 3.06Å; T382-H397 PolarHBondContact OG1-CE1 2.81Å; M395-H397 PolarHBondContact O-ND1 3.41Å; M395-H397 VanDerWaalsContact O-ND1 3.1Å; H397-V401 PolarHBondContact CD2-O 2.73Å; H397-V401 VanDerWaalsContact CG-O 3.25Å
398	S	42.4	Very low	52.5	Low	67 Å²	67	70.6 Å²	70.6	47%	0.469	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	146.9	169.3	53.4	0	0	0	0	110.3	D400 V401	S398-D400 PolarHBondContact O-N 2.99Å; S398-V401 PolarHBondContact O-N 3.26Å
399	A	46.9	Very low	53	Low	77 Å²	77	69.2 Å²	69.2	64%	0.636	39%	0.393	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.7	-12.1	-172.5	0	0	0	0	0	116.4	V380	V380-A399 HydrophobicContact CG2-CB 3.89Å
400	D	35.6	Very low	53.5	Low	160 Å²	160	67.3 Å²	67.3	86%	0.856	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.3	-8.4	178.1	-68.4	-50.2	0	0	0	114.7	S398	S398-D400 PolarHBondContact O-N 2.99Å
401	V	43.1	Very low	53.8	Low	53 Å²	53	60.4 Å²	60.4	32%	0.321	34%	0.341	S	S	.	.			trans	-128.8	105.3	-167.3	-175.6	0	0	0	0	113.4	H397 S398 I403 F446	H397-V401 PolarHBondContact CD2-O 2.73Å; H397-V401 VanDerWaalsContact CG-O 3.25Å; S398-V401 PolarHBondContact O-N 3.26Å; V401-I403 HydrophobicContact CG1-CG1 4.31Å; V401-F446 HydrophobicContact CG1-CD2 4.17Å
402	I	48.8	Very low	54.4	Low	100 Å²	100	57.8 Å²	57.8	51%	0.513	33%	0.33	S	S	.	.			trans	-95.8	109.2	-176.4	-50.8	-178.4	0	0	0	111.8	Y384 V404 F446	Y384-I402 WeakPolarHBondContact OH-CG2 3.16Å; I402-V404 HydrophobicContact CG2-CG2 3.73Å; I402-F446 WeakPolarHBondContact O-CZ 3.45Å
403	I	53.5	Low	54.4	Low	58 Å²	58	58 Å²	58	30%	0.297	34%	0.336	S	S	.	.			trans	-94.9	102.7	-178	-53.7	176.9	0	0	0	111	Y384 V401	Y384-I403 WeakPolarHBondContact CE2-O 3.41Å; V401-I403 HydrophobicContact CG1-CG1 4.31Å
404	V	55	Low	54.3	Low	24 Å²	24	61.2 Å²	61.2	15%	0.145	36%	0.356	C	S	.	.			trans	-112.1	-3.5	-178.5	-154.2	0	0	0	0	113.7	Y384 I402 L407 L408 I422	Y384-V404 HydrophobicContact CE1-CG1 4.49Å; I402-V404 HydrophobicContact CG2-CG2 3.73Å; V404-L407 HydrophobicContact CG1-CB 4.28Å; V404-L407 HydrophobicContact CG1-CD2 4.01Å; V404-L407 PolarHBondContact O-N 3.19Å; V404-L408 PolarHBondContact O-N 3.08Å; V404-I422 HydrophobicContact CB-CD1 3.85Å; V404-I422 HydrophobicContact CG1-CD1 3.56Å; V404-I422 HydrophobicContact CG1-CG1 4.06Å; V404-I422 HydrophobicContact CG2-CD1 4.34Å
405	A	56.5	Low	54.6	Low	47 Å²	47	59.9 Å²	59.9	39%	0.388	34%	0.342	S	S	.	.	H	α-helix	trans	-59.5	-43.4	-172.5	0	0	0	0	0	114.7	L407 L408 L409	A405-L407 VanDerWaalsContact C-N 3.3Å; A405-L407 PolarHBondContact O-N 2.97Å; A405-L408 PolarHBondContact O-N 3.02Å; A405-L408 VanDerWaalsContact O-N 3.15Å; A405-L409 PolarHBondContact O-N 2.91Å
406	P	58.1	Low	54.3	Low	44 Å²	44	60 Å²	60	29%	0.286	35%	0.351	S	S	.	.	H	α-helix	trans	-64.8	-31.5	179	-26.4	39.3	0	0	0	113.7	Y393 H410	Y393-P406 HydrophobicContact CD1-CB 4.25Å; Y393-P406 HydrophobicContact CD2-CB 4.05Å; Y393-P406 HydrophobicContact CE1-CB 4.12Å; Y393-P406 HydrophobicContact CE1-CG 4Å; Y393-P406 HydrophobicContact CE2-CB 3.92Å; Y393-P406 HydrophobicContact CE2-CG 3.95Å; Y393-P406 HydrophobicContact CG-CB 4.22Å; P406-H410 WeakPolarHBondContact O-CB 3.46Å; P406-H410 PolarHBondContact O-N 3.21Å
407	L	61.3	Low	54.6	Low	16 Å²	16	59.7 Å²	59.7	8%	0.084	34%	0.341	C	S	.	.	H	α-helix	trans	-68.5	-40.6	174.2	-174.1	74.8	0	0	0	111.4	Y384 V404 A405 H410 Y411	Y384-L407 HydrophobicContact CD1-CD2 4.01Å; Y384-L407 HydrophobicContact CG-CD2 3.96Å; V404-L407 HydrophobicContact CG1-CB 4.28Å; V404-L407 HydrophobicContact CG1-CD2 4.01Å; V404-L407 PolarHBondContact O-N 3.19Å; A405-L407 VanDerWaalsContact C-N 3.3Å; A405-L407 PolarHBondContact O-N 2.97Å; L407-H410 PolarHBondContact O-N 3.35Å; L407-Y411 HydrophobicContact CD1-CD2 4.42Å; L407-Y411 HydrophobicContact CD1-CE2 3.96Å; L407-Y411 HydrophobicContact CD2-CE2 4.03Å; L407-Y411 HydrophobicContact CG-CD2 3.97Å; L407-Y411 HydrophobicContact CG-CE2 3.73Å; L407-Y411 VanDerWaalsContact O-CD2 3.22Å; L407-Y411 WeakPolarHBondContact O-CD2 3.38Å; L407-Y411 PolarHBondContact O-N 3.17Å
408	L	62.3	Low	54.4	Low	25 Å²	25	63.5 Å²	63.5	13%	0.131	36%	0.359	C	S	.	.	H	α-helix	trans	-64	-44.1	175.4	-74.8	174.8	0	0	0	111.9	V404 A405 H410 Y411 Q412 I422	V404-L408 PolarHBondContact O-N 3.08Å; A405-L408 PolarHBondContact O-N 3.02Å; A405-L408 VanDerWaalsContact O-N 3.15Å; L408-H410 VanDerWaalsContact C-N 3.33Å; L408-H410 PolarHBondContact O-N 2.99Å; L408-Y411 PolarHBondContact O-N 3.12Å; L408-Q412 WeakPolarHBondContact O-CB 3.39Å; L408-Q412 PolarHBondContact O-N 3.2Å; L408-I422 HydrophobicContact CD1-CD1 3.76Å; L408-I422 HydrophobicContact CD2-CD1 3.91Å; L408-I422 HydrophobicContact CD2-CG1 4.06Å; L408-I422 HydrophobicContact CG-CD1 3.92Å
409	L	62.7	Low	54.8	Low	73 Å²	73	68.3 Å²	68.3	38%	0.382	37%	0.367	S	S	.	.	H	α-helix	trans	-60	-42.6	174.8	-78.7	159.2	0	0	0	111.5	A405 Q412 H413 L439	A405-L409 PolarHBondContact O-N 2.91Å; L409-Q412 PolarHBondContact O-N 2.79Å; L409-H413 PolarHBondContact O-N 2.85Å; L409-L439 HydrophobicContact CD2-CD1 4.38Å
410	H	67.6	Low	54.8	Low	11 Å²	11	65.1 Å²	65.1	5%	0.051	34%	0.339	C	S	.	.	H	α-helix	trans	-59.9	-49.5	174.2	169.3	74.2	0	0	0	112.5	C386 C389 F391 P406 L407 L408 Q412 H413 N414 H415	C386-H410 PolarHBondContact SG-NE2 2.83Å; C386-H410 VanDerWaalsContact SG-NE2 3.36Å; C389-H410 PolarHBondContact SG-CE1 2.79Å; C389-H410 PolarHBondContact SG-NE2 2.97Å; C389-H410 VanDerWaalsContact SG-NE2 3.38Å; F391-H410 WeakPolarHBondContact CB-CE1 3.33Å; F391-H410 WeakPolarHBondContact CB-NE2 3.49Å; F391-H410 HydrophobicContact CD1-CB 3.95Å; F391-H410 AromaticContact CD1-CD2 3.53Å; F391-H410 AromaticContact CD1-CE1 3.8Å; F391-H410 AromaticContact CD1-CG 3.33Å; F391-H410 AromaticContact CD1-ND1 3.52Å; F391-H410 AromaticContact CD1-NE2 3.82Å; F391-H410 AromaticContact CD2-ND1 3.83Å; F391-H410 HydrophobicContact CE1-CB 3.71Å; F391-H410 AromaticContact CE1-CG 3.63Å; F391-H410 AromaticContact CE1-ND1 3.97Å; F391-H410 AromaticContact CG-CE1 3.47Å; F391-H410 VanDerWaalsContact CG-CE1 3.47Å; F391-H410 WeakPolarHBondContact CG-CE1 3Å; F391-H410 AromaticContact CG-CG 3.78Å; F391-H410 AromaticContact CG-ND1 3.43Å; F391-H410 WeakPolarHBondContact CG-ND1 3.12Å; F391-H410 AromaticContact CG-NE2 3.82Å; F391-H410 HydrophobicContact CZ-CB 4.28Å; P406-H410 WeakPolarHBondContact O-CB 3.46Å; P406-H410 PolarHBondContact O-N 3.21Å; L407-H410 PolarHBondContact O-N 3.35Å; L408-H410 VanDerWaalsContact C-N 3.33Å; L408-H410 PolarHBondContact O-N 2.99Å; H410-Q412 VanDerWaalsContact C-N 3.27Å; H410-Q412 PolarHBondContact O-N 3.12Å; H410-H413 PolarHBondContact O-N 3.07Å; H410-N414 PolarHBondContact ND1-ND2 2.94Å; H410-N414 VanDerWaalsContact ND1-ND2 3.13Å; H410-N414 WeakPolarHBondContact O-CB 3.21Å; H410-N414 PolarHBondContact O-N 3.32Å; H410-N414 PolarHBondContact O-ND2 3.17Å; H410-H415 AromaticContact NE2-CD2 3.7Å; H410-H415 AromaticContact NE2-NE2 3.48Å; H410-H415 PolarHBondContact NE2-NE2 3.26Å
411	Y	59.9	Low	55.5	Low	17 Å²	17	60.4 Å²	60.4	7%	0.067	32%	0.318	C	S	.	.	H	α-helix	trans	-60.7	-33.5	176	-83.7	-66.1	0	0	0	113	C386 Q387 L388 L407 L408 I417 C421	C386-Y411 WeakPolarHBondContact SG-CE1 3.43Å; Q387-Y411 PolarHBondContact N-OH 3.17Å; L388-Y411 HydrophobicContact CD1-CD1 4.22Å; L388-Y411 HydrophobicContact CD1-CE1 3.96Å; L388-Y411 HydrophobicContact CG-CE1 4.31Å; L407-Y411 HydrophobicContact CD1-CD2 4.42Å; L407-Y411 HydrophobicContact CD1-CE2 3.96Å; L407-Y411 HydrophobicContact CD2-CE2 4.03Å; L407-Y411 HydrophobicContact CG-CD2 3.97Å; L407-Y411 HydrophobicContact CG-CE2 3.73Å; L407-Y411 VanDerWaalsContact O-CD2 3.22Å; L407-Y411 WeakPolarHBondContact O-CD2 3.38Å; L407-Y411 PolarHBondContact O-N 3.17Å; L408-Y411 PolarHBondContact O-N 3.12Å; Y411-I417 HydrophobicContact CD1-CD1 4.21Å; Y411-I417 PolarHBondContact O-N 2.92Å; Y411-I417 VanDerWaalsContact O-N 3.09Å; Y411-C421 HydrophobicContact CE2-CB 4.47Å
412	Q	60.7	Low	55.9	Low	28 Å²	28	60.5 Å²	60.5	13%	0.131	32%	0.317	C	S	.	.	H	α-helix	trans	-69.7	-51.9	176.5	-177.1	-173.6	-37	0	0	111.8	L408 L409 H410 S416 P435 Q436	L408-Q412 WeakPolarHBondContact O-CB 3.39Å; L408-Q412 PolarHBondContact O-N 3.2Å; L409-Q412 PolarHBondContact O-N 2.79Å; H410-Q412 VanDerWaalsContact C-N 3.27Å; H410-Q412 PolarHBondContact O-N 3.12Å; Q412-S416 WeakPolarHBondContact O-CA 3.26Å; Q412-S416 PolarHBondContact O-N 3.38Å; Q412-P435 HydrophobicContact CB-CG 4.2Å; Q412-P435 HydrophobicContact CG-CG 4.25Å; Q412-P435 VanDerWaalsContact OE1-CB 3.22Å; Q412-Q436 VanDerWaalsContact NE2-NE2 3.18Å
413	H	53.7	Low	55.6	Low	144 Å²	144	63.5 Å²	63.5	67%	0.667	33%	0.328	S	S	*	.	H	α-helix	trans	-77.8	-40.1	-173.4	-85.8	-100.5	0	0	0	113.7	L409 H410	L409-H413 PolarHBondContact O-N 2.85Å; H410-H413 PolarHBondContact O-N 3.07Å
414	N	57.3	Low	55.2	Low	106 Å²	106	66.4 Å²	66.4	57%	0.567	34%	0.341	S	S	*	.	H	α-helix	trans	-97.3	-14.3	-168.9	-58.5	-91.4	0	0	0	113.5	H410	H410-N414 PolarHBondContact ND1-ND2 2.94Å; H410-N414 VanDerWaalsContact ND1-ND2 3.13Å; H410-N414 WeakPolarHBondContact O-CB 3.21Å; H410-N414 PolarHBondContact O-N 3.32Å; H410-N414 PolarHBondContact O-ND2 3.17Å
415	H	59.1	Low	54.9	Low	45 Å²	45	66.1 Å²	66.1	21%	0.208	34%	0.339	C	S	.	.	H	α-helix	trans	-132.8	7.8	-177.7	-60.9	-57.9	0	0	0	113.4	C386 L388 C389 H410 I417	C386-H415 PolarHBondContact SG-NE2 2.99Å; L388-H415 HydrophobicContact CD1-CB 4.17Å; C389-H415 PolarHBondContact SG-NE2 3.06Å; H410-H415 AromaticContact NE2-CD2 3.7Å; H410-H415 AromaticContact NE2-NE2 3.48Å; H410-H415 PolarHBondContact NE2-NE2 3.26Å; H415-I417 HydrophobicContact CB-CD1 4.1Å; H415-I417 HydrophobicContact CB-CG1 3.8Å; H415-I417 WeakPolarHBondContact O-CG1 3.49Å; H415-I417 PolarHBondContact O-N 2.91Å
416	S	52	Low	54.4	Low	89 Å²	89	71.9 Å²	71.9	62%	0.622	36%	0.36	S	S	*	.			trans	48.5	26.7	-177.5	57.8	0	0	0	0	115.2	Q412 H418	Q412-S416 WeakPolarHBondContact O-CA 3.26Å; Q412-S416 PolarHBondContact O-N 3.38Å; S416-H418 PolarHBondContact O-CD2 2.89Å; S416-H418 PolarHBondContact O-N 3.34Å
417	I	55.2	Low	53.8	Low	48 Å²	48	78.8 Å²	78.8	25%	0.246	38%	0.382	C	S	.	.			trans	-83.2	87.4	-175.1	-51.6	-165.7	0	0	0	110.6	L388 Y411 H415 R419	L388-I417 HydrophobicContact CD1-CD1 3.36Å; Y411-I417 HydrophobicContact CD1-CD1 4.21Å; Y411-I417 PolarHBondContact O-N 2.92Å; Y411-I417 VanDerWaalsContact O-N 3.09Å; H415-I417 HydrophobicContact CB-CD1 4.1Å; H415-I417 HydrophobicContact CB-CG1 3.8Å; H415-I417 WeakPolarHBondContact O-CG1 3.49Å; H415-I417 PolarHBondContact O-N 2.91Å; I417-R419 HydrophobicContact CG2-CB 4.16Å; I417-R419 WeakPolarHBondContact CG2-O 3.03Å; I417-R419 PolarHBondContact O-N 3.45Å
418	H	51.2	Low	53.3	Low	101 Å²	101	78.8 Å²	78.8	47%	0.468	38%	0.383	S	S	.	.			trans	-70.5	24.9	171.9	-58.4	-77	0	0	0	114.3	S416 Q434	S416-H418 PolarHBondContact O-CD2 2.89Å; S416-H418 PolarHBondContact O-N 3.34Å; H418-Q434 HydrophobicContact CB-CG 4.44Å; H418-Q434 WeakPolarHBondContact O-CA 3.34Å
419	R	49.6	Very low	52.7	Low	169 Å²	169	82.9 Å²	82.9	64%	0.638	41%	0.411	S	S	*	.	S	Bend	trans	-133.1	126.4	-179	-74.4	-174.6	175.1	114.6	1.8	110	I417 C421 G431	I417-R419 HydrophobicContact CG2-CB 4.16Å; I417-R419 WeakPolarHBondContact CG2-O 3.03Å; I417-R419 PolarHBondContact O-N 3.45Å; R419-C421 PolarHBondContact O-N 2.85Å; R419-G431 WeakPolarHBondContact CA-O 2.91Å; R419-G431 VanDerWaalsContact CB-O 3.31Å; R419-G431 WeakPolarHBondContact CB-O 3.34Å
420	C	48.5	Very low	52	Low	9 Å²	9	87.2 Å²	87.2	6%	0.061	43%	0.429	C	S	.	.			trans	-64.8	107.4	-177.2	-174.4	0	0	0	0	112.3	I422 G431 C433 H438	C420-I422 PolarHBondContact O-N 3.26Å; C420-G431 PolarHBondContact N-O 2.99Å; C420-C433 WeakPolarHBondContact CB-SG 3.43Å; C420-C433 PolarHBondContact N-O 2.88Å; C420-H438 PolarHBondContact SG-NE2 3.42Å
421	C	50.1	Low	51.3	Low	61 Å²	61	87.5 Å²	87.5	41%	0.412	44%	0.435	S	S	.	.			trans	-67.4	-10.2	179.9	-55.6	0	0	0	0	114.4	Y411 R419 Q423	Y411-C421 HydrophobicContact CE2-CB 4.47Å; R419-C421 PolarHBondContact O-N 2.85Å; C421-Q423 PolarHBondContact O-N 3.47Å; C421-Q423 VanDerWaalsContact O-N 3.12Å
422	I	51.4	Low	50.8	Low	56 Å²	56	93 Å²	93	29%	0.287	47%	0.465	S	S	.	.			trans	-74.5	104.8	-173.5	-57.7	173.2	0	0	0	110.1	V404 L408 C420 H424 C425	V404-I422 HydrophobicContact CB-CD1 3.85Å; V404-I422 HydrophobicContact CG1-CD1 3.56Å; V404-I422 HydrophobicContact CG1-CG1 4.06Å; V404-I422 HydrophobicContact CG2-CD1 4.34Å; L408-I422 HydrophobicContact CD1-CD1 3.76Å; L408-I422 HydrophobicContact CD2-CD1 3.91Å; L408-I422 HydrophobicContact CD2-CG1 4.06Å; L408-I422 HydrophobicContact CG-CD1 3.92Å; C420-I422 PolarHBondContact O-N 3.26Å; I422-H424 PolarHBondContact O-N 3.28Å; I422-C425 HydrophobicContact CB-CB 4.28Å; I422-C425 HydrophobicContact CG2-CB 4.36Å; I422-C425 PolarHBondContact O-N 2.88Å
423	Q	42.9	Very low	50.1	Low	162 Å²	162	92.4 Å²	92.4	76%	0.757	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	124.8	166.1	-65.6	-167.3	9.8	0	0	109.4	C421	C421-Q423 PolarHBondContact O-N 3.47Å; C421-Q423 VanDerWaalsContact O-N 3.12Å
424	H	45	Very low	49.7	Very low	120 Å²	120	90.3 Å²	90.3	56%	0.556	45%	0.454	S	S	*	.	T	Hydrogen-bonded Turn	trans	72.3	27.2	-177.4	-43.5	79.8	0	0	0	116.5	I422 M426 N842 K845	I422-H424 PolarHBondContact O-N 3.28Å; H424-M426 PolarHBondContact O-N 3.43Å; H424-M426 VanDerWaalsContact O-N 3.1Å; H424-N842 PolarHBondContact NE2-ND2 3.05Å; H424-N842 VanDerWaalsContact NE2-ND2 3.12Å; H424-N842 PolarHBondContact NE2-OD1 3.03Å; H424-K845 PolarHBondContact NE2-NZ 2.81Å
425	C	46.9	Very low	49.2	Very low	17 Å²	17	85.5 Å²	85.5	12%	0.115	43%	0.429	C	S	.	.			trans	-53.2	118.3	162.5	179.8	0	0	0	0	111	I422 Y427 C428 H438	I422-C425 HydrophobicContact CB-CB 4.28Å; I422-C425 HydrophobicContact CG2-CB 4.36Å; I422-C425 PolarHBondContact O-N 2.88Å; C425-Y427 VanDerWaalsContact C-N 3.29Å; C425-Y427 PolarHBondContact O-N 3.46Å; C425-C428 HydrophobicContact CB-CB 4.38Å; C425-C428 CarbonylContact O-C 3.29Å; C425-C428 VanDerWaalsContact O-C 3.27Å; C425-C428 PolarHBondContact O-N 2.61Å; C425-C428 VanDerWaalsContact O-N 3.1Å; C425-H438 PolarHBondContact SG-CE1 3.12Å; C425-H438 PolarHBondContact SG-NE2 2.77Å
426	M	46.7	Very low	48.6	Very low	169 Å²	169	87.8 Å²	87.8	83%	0.833	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-33.9	-174.4	-74.9	-97.2	58.6	0	0	113.2	H424	H424-M426 PolarHBondContact O-N 3.43Å; H424-M426 VanDerWaalsContact O-N 3.1Å
427	Y	45.9	Very low	48.3	Very low	189 Å²	189	91.1 Å²	91.1	74%	0.741	44%	0.443	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.1	-12.9	178.3	-57.2	-80.7	0	0	0	113.3	C425	C425-Y427 VanDerWaalsContact C-N 3.29Å; C425-Y427 PolarHBondContact O-N 3.46Å
428	C	50.3	Low	47.9	Very low	15 Å²	15	91.3 Å²	91.3	10%	0.101	44%	0.443	C	S	.	.			trans	-151.4	67.6	-171.3	-176.8	0	0	0	0	112.3	C425 Q430 G431 C433	C425-C428 HydrophobicContact CB-CB 4.38Å; C425-C428 CarbonylContact O-C 3.29Å; C425-C428 VanDerWaalsContact O-C 3.27Å; C425-C428 PolarHBondContact O-N 2.61Å; C425-C428 VanDerWaalsContact O-N 3.1Å; C428-Q430 PolarHBondContact O-N 3.5Å; C428-G431 PolarHBondContact O-N 3.47Å; C428-C433 HydrophobicContact CB-CB 3.9Å; C428-C433 WeakPolarHBondContact CB-SG 3.34Å; C428-C433 WeakPolarHBondContact SG-CB 3.49Å; C428-C433 PolarHBondContact SG-N 2.71Å; C428-C433 VanDerWaalsContact SG-N 3.38Å; C428-C433 CovalentContact SG-SG 2.02Å; C428-C433 PolarHBondContact SG-SG 3.24Å
429	P	49.3	Very low	47.6	Very low	111 Å²	111	90.2 Å²	90.2	72%	0.721	44%	0.44	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.5	9.9	-173.5	29.8	-37.6	0	0	0	115.4
430	Q	49.6	Very low	46.8	Very low	165 Å²	165	85.3 Å²	85.3	77%	0.771	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-131.4	4.4	176.4	-62.3	-166.6	59.7	0	0	113.9	C428 L432	C428-Q430 PolarHBondContact O-N 3.5Å; Q430-L432 HydrophobicContact CB-CG 4.41Å; Q430-L432 PolarHBondContact O-N 3.42Å; Q430-L432 VanDerWaalsContact O-N 3.15Å
431	G	51.1	Low	46	Very low	17 Å²	17	93.5 Å²	93.5	18%	0.175	48%	0.479	C	S	.	.	S	Bend	trans	69.5	6.3	174.8	0	0	0	0	0	116.7	R419 C420 C428 C433	R419-G431 WeakPolarHBondContact CA-O 2.91Å; R419-G431 VanDerWaalsContact CB-O 3.31Å; R419-G431 WeakPolarHBondContact CB-O 3.34Å; C420-G431 PolarHBondContact N-O 2.99Å; C428-G431 PolarHBondContact O-N 3.47Å; G431-C433 VanDerWaalsContact C-N 3.27Å; G431-C433 PolarHBondContact O-N 2.86Å
432	L	49.3	Very low	45.4	Very low	132 Å²	132	97.2 Å²	97.2	69%	0.691	50%	0.5	S	S	*	.			trans	-85	9.3	-176.2	-58.6	179.6	0	0	0	114.7	Q430	Q430-L432 HydrophobicContact CB-CG 4.41Å; Q430-L432 PolarHBondContact O-N 3.42Å; Q430-L432 VanDerWaalsContact O-N 3.15Å
433	C	46.6	Very low	44.5	Very low	16 Å²	16	98.7 Å²	98.7	11%	0.108	52%	0.515	C	S	.	.	S	Bend	trans	-91	132.6	178.4	43.2	0	0	0	0	110.9	C420 C428 G431 H438	C420-C433 WeakPolarHBondContact CB-SG 3.43Å; C420-C433 PolarHBondContact N-O 2.88Å; C428-C433 HydrophobicContact CB-CB 3.9Å; C428-C433 WeakPolarHBondContact CB-SG 3.34Å; C428-C433 WeakPolarHBondContact SG-CB 3.49Å; C428-C433 PolarHBondContact SG-N 2.71Å; C428-C433 VanDerWaalsContact SG-N 3.38Å; C428-C433 CovalentContact SG-SG 2.02Å; C428-C433 PolarHBondContact SG-SG 3.24Å; G431-C433 VanDerWaalsContact C-N 3.27Å; G431-C433 PolarHBondContact O-N 2.86Å; C433-H438 PolarHBondContact SG-NE2 3.31Å
434	Q	45.9	Very low	44	Very low	99 Å²	99	99.7 Å²	99.7	46%	0.463	52%	0.519	S	S	.	.			trans	-63.9	143.2	161.9	-71.3	166.6	-44	0	0	109.7	H418 Q436 K437	H418-Q434 HydrophobicContact CB-CG 4.44Å; H418-Q434 WeakPolarHBondContact O-CA 3.34Å; Q434-Q436 PolarHBondContact O-N 3.26Å; Q434-Q436 VanDerWaalsContact O-N 3.16Å; Q434-K437 PolarHBondContact O-N 3.03Å
435	P	46.6	Very low	43.5	Very low	5 Å²	5	99 Å²	99	3%	0.032	53%	0.525	C	S	.	.	G	3₁₀ helix	trans	-56.6	-30.6	-179.6	-25.8	34.2	0	0	0	114.2	Q412 K437 H438 L439	Q412-P435 HydrophobicContact CB-CG 4.2Å; Q412-P435 HydrophobicContact CG-CG 4.25Å; Q412-P435 VanDerWaalsContact OE1-CB 3.22Å; P435-K437 PolarHBondContact O-N 3.37Å; P435-K437 VanDerWaalsContact O-N 3.13Å; P435-H438 WeakPolarHBondContact O-CA 3.28Å; P435-H438 WeakPolarHBondContact O-CB 3.31Å; P435-H438 PolarHBondContact O-N 3.16Å; P435-L439 PolarHBondContact O-N 3.1Å
436	Q	45.6	Very low	42.8	Very low	94 Å²	94	104.5 Å²	104.5	44%	0.439	55%	0.548	S	S	.	.	G	3₁₀ helix	trans	-53.3	-31.9	172.7	-72.8	76.1	5.9	0	0	112.6	Q412 Q434 H438 L439 G440	Q412-Q436 VanDerWaalsContact NE2-NE2 3.18Å; Q434-Q436 PolarHBondContact O-N 3.26Å; Q434-Q436 VanDerWaalsContact O-N 3.16Å; Q436-H438 PolarHBondContact O-N 3.13Å; Q436-L439 CarbonylContact O-C 3.49Å; Q436-L439 PolarHBondContact O-N 2.83Å; Q436-G440 PolarHBondContact O-N 2.8Å
437	K	46.7	Very low	42.2	Very low	159 Å²	159	100.7 Å²	100.7	69%	0.691	54%	0.543	S	S	*	.	G	3₁₀ helix	trans	-81.1	3.8	176.3	-59.3	-169.5	179.3	-174.7	0	113.9	Q434 P435	Q434-K437 PolarHBondContact O-N 3.03Å; P435-K437 PolarHBondContact O-N 3.37Å; P435-K437 VanDerWaalsContact O-N 3.13Å
438	H	46.7	Very low	41.7	Very low	52 Å²	52	95.2 Å²	95.2	24%	0.241	53%	0.531	C	S	.	.	G	3₁₀ helix	trans	-109.1	-4.1	162.5	-66	-29.5	0	0	0	112.6	C420 C425 C433 P435 Q436	C420-H438 PolarHBondContact SG-NE2 3.42Å; C425-H438 PolarHBondContact SG-CE1 3.12Å; C425-H438 PolarHBondContact SG-NE2 2.77Å; C433-H438 PolarHBondContact SG-NE2 3.31Å; P435-H438 WeakPolarHBondContact O-CA 3.28Å; P435-H438 WeakPolarHBondContact O-CB 3.31Å; P435-H438 PolarHBondContact O-N 3.16Å; Q436-H438 PolarHBondContact O-N 3.13Å
439	L	45.8	Very low	41	Very low	77 Å²	77	106.1 Å²	106.1	40%	0.403	57%	0.571	S	S	.	*	S	Bend	trans	-116.6	25.1	178.3	-62.4	170.4	0	0	0	111.2	L409 P435 Q436 E441	L409-L439 HydrophobicContact CD2-CD1 4.38Å; P435-L439 PolarHBondContact O-N 3.1Å; Q436-L439 CarbonylContact O-C 3.49Å; Q436-L439 PolarHBondContact O-N 2.83Å; L439-E441 PolarHBondContact O-N 2.91Å; L439-E441 VanDerWaalsContact O-N 3.09Å
440	G	31.1	Very low	40.4	Very low	66 Å²	66	108.4 Å²	108.4	68%	0.68	57%	0.569	S	S	*	*	S	Bend	trans	-69.1	105.4	176.5	0	0	0	0	0	110.4	Q436	Q436-G440 PolarHBondContact O-N 2.8Å
441	E	31.4	Very low	40	Very low	181 Å²	181	107 Å²	107	85%	0.846	58%	0.575	S	S	*	*	S	Bend	trans	52.2	103.3	178.6	-71.6	171.1	-154	0	0	114.8	L439 S443	L439-E441 PolarHBondContact O-N 2.91Å; L439-E441 VanDerWaalsContact O-N 3.09Å; E441-S443 VanDerWaalsContact C-N 3.3Å; E441-S443 PolarHBondContact O-N 3.35Å
442	V	38.2	Very low	39.7	Very low	140 Å²	140	112.2 Å²	112.2	85%	0.848	60%	0.603	S	S	*	*			trans	-77	78.6	-175.8	-174	0	0	0	0	111.1
443	S	33.6	Very low	39.2	Very low	87 Å²	87	107.7 Å²	107.7	61%	0.608	58%	0.582	S	S	*	*	S	Bend	trans	-132.3	100.9	162.4	61.3	0	0	0	0	110.3	E441	E441-S443 VanDerWaalsContact C-N 3.3Å; E441-S443 PolarHBondContact O-N 3.35Å
444	H	31.7	Very low	39.1	Very low	182 Å²	182	111.1 Å²	111.1	84%	0.843	61%	0.606	S	S	*	*			trans	73.7	107.2	173.4	-47.6	-70.2	0	0	0	117.9
445	P	35.2	Very low	38.9	Very low	105 Å²	105	113.8 Å²	113.8	68%	0.682	62%	0.616	S	S	*	*			trans	-85.5	129	173.4	33.4	-32.9	0	0	0	113.3
446	F	32.4	Very low	38.9	Very low	134 Å²	134	116.3 Å²	116.3	59%	0.588	63%	0.633	S	S	*	*			trans	75.8	138.5	167.8	-48	-64.5	0	0	0	118.6	V401 I402	V401-F446 HydrophobicContact CG1-CD2 4.17Å; I402-F446 WeakPolarHBondContact O-CZ 3.45Å
447	A	32.9	Very low	38.7	Very low	89 Å²	89	115.7 Å²	115.7	74%	0.736	64%	0.638	S	S	*	*			trans	-104.3	127.6	-170.8	0	0	0	0	0	113.3
448	C	34.9	Very low	38.4	Very low	73 Å²	73	111.5 Å²	111.5	49%	0.493	63%	0.629	S	S	.	*			trans	-71.2	143.8	166.4	-167.6	0	0	0	0	110.8
449	R	36.5	Very low	38	Very low	244 Å²	244	115.5 Å²	115.5	92%	0.921	65%	0.652	S	S	*	*			trans	-110.4	16.4	-179.7	-82.3	-171.4	166.4	-151.7	-4.1	115
450	K	35.4	Very low	37.7	Very low	160 Å²	160	117.4 Å²	117.4	70%	0.696	67%	0.667	S	S	*	*			trans	-116	124.1	174.7	-68.3	178.4	-178.9	171.9	0	109.7	T452 C453	K450-T452 PolarHBondContact O-N 3.36Å; K450-C453 HydrophobicContact CB-CB 4.46Å
451	P	43	Very low	38	Very low	136 Å²	136	120.3 Å²	120.3	88%	0.883	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	3	-179	30.3	-35.9	0	0	0	114.5
452	T	43.7	Very low	38.1	Very low	125 Å²	125	117.1 Å²	117.1	77%	0.767	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-134.9	28.3	-173.7	51.2	0	0	0	0	113	K450 S454	K450-T452 PolarHBondContact O-N 3.36Å; T452-S454 PolarHBondContact O-N 3.38Å
453	C	40.2	Very low	37.8	Very low	38 Å²	38	112.7 Å²	112.7	26%	0.257	65%	0.646	S	S	.	*			trans	-79.9	100.9	-179.6	-169.4	0	0	0	0	112.4	K450 K455 C456 C457	K450-C453 HydrophobicContact CB-CB 4.46Å; C453-K455 PolarHBondContact O-N 3.21Å; C453-C456 HydrophobicContact CB-CB 4.18Å; C453-C456 WeakPolarHBondContact O-CB 3.46Å; C453-C456 PolarHBondContact O-N 2.89Å; C453-C456 VanDerWaalsContact SG-SG 3.6Å; C453-C457 PolarHBondContact O-N 3.32Å
454	S	43.5	Very low	37.5	Very low	87 Å²	87	113.8 Å²	113.8	61%	0.608	65%	0.654	S	S	*	*	H	α-helix	trans	-56.4	-41	-178	54.2	0	0	0	0	114.3	T452 C456 C457 S458	T452-S454 PolarHBondContact O-N 3.38Å; S454-C456 PolarHBondContact O-N 2.02Å; S454-C457 PolarHBondContact O-N 3.15Å; S454-C457 VanDerWaalsContact O-N 3.08Å; S454-S458 PolarHBondContact O-N 2.73Å; S454-S458 VanDerWaalsContact O-N 3.1Å; S454-S458 PolarHBondContact O-OG 2.35Å
455	K	42.2	Very low	37.3	Very low	155 Å²	155	110.6 Å²	110.6	67%	0.674	65%	0.647	S	S	*	*	H	α-helix	trans	-64.1	-22.5	176.7	-80.8	-174.2	174	-179.2	0	113.6	C453	C453-K455 PolarHBondContact O-N 3.21Å
456	C	46.9	Very low	36.9	Very low	59 Å²	59	115 Å²	115	40%	0.399	66%	0.656	S	S	.	*	H	α-helix	trans	-77.3	-39.2	171.5	-63.8	0	0	0	0	111.3	C453 S454 S458 N459	C453-C456 HydrophobicContact CB-CB 4.18Å; C453-C456 WeakPolarHBondContact O-CB 3.46Å; C453-C456 PolarHBondContact O-N 2.89Å; C453-C456 VanDerWaalsContact SG-SG 3.6Å; S454-C456 PolarHBondContact O-N 2.02Å; C456-S458 PolarHBondContact O-N 2.86Å; C456-N459 PolarHBondContact O-N 3.12Å
457	C	40.7	Very low	36.7	Very low	80 Å²	80	116.6 Å²	116.6	54%	0.541	67%	0.665	S	S	.	*	H	α-helix	trans	-64.3	-37.9	177.4	-57.1	0	0	0	0	112.5	C453 S454 V460	C453-C457 PolarHBondContact O-N 3.32Å; S454-C457 PolarHBondContact O-N 3.15Å; S454-C457 VanDerWaalsContact O-N 3.08Å; C457-V460 PolarHBondContact O-N 3.32Å
458	S	40.9	Very low	36.7	Very low	71 Å²	71	118.2 Å²	118.2	50%	0.497	67%	0.668	S	S	.	*	H	α-helix	trans	-63.3	-40.6	177.4	-56.9	0	0	0	0	113.1	S454 C456 V460 I461	S454-S458 PolarHBondContact O-N 2.73Å; S454-S458 VanDerWaalsContact O-N 3.1Å; S454-S458 PolarHBondContact O-OG 2.35Å; C456-S458 PolarHBondContact O-N 2.86Å; S458-V460 VanDerWaalsContact C-N 3.27Å; S458-V460 PolarHBondContact O-N 3.13Å; S458-I461 PolarHBondContact O-N 3.49Å
459	N	38.3	Very low	36.4	Very low	137 Å²	137	120 Å²	120	73%	0.733	68%	0.681	S	S	*	*	H	α-helix	trans	-78	-7.8	-175.6	-74.4	12.2	0	0	0	114.1	C456 I461	C456-N459 PolarHBondContact O-N 3.12Å; N459-I461 VanDerWaalsContact C-N 3.35Å
460	V	38.6	Very low	35.9	Very low	116 Å²	116	114.4 Å²	114.4	70%	0.703	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.6	-18.3	171.4	173	0	0	0	0	111.7	C457 S458	C457-V460 PolarHBondContact O-N 3.32Å; S458-V460 VanDerWaalsContact C-N 3.27Å; S458-V460 PolarHBondContact O-N 3.13Å
461	I	36.8	Very low	36	Very low	127 Å²	127	111.9 Å²	111.9	65%	0.651	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.4	-16.3	-171.1	-63.8	170.9	0	0	0	112.8	S458 N459	S458-I461 PolarHBondContact O-N 3.49Å; N459-I461 VanDerWaalsContact C-N 3.35Å
462	S	34.6	Very low	35.4	Very low	114 Å²	114	108.1 Å²	108.1	80%	0.797	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.5	7.5	-179.3	-53.6	0	0	0	0	114.6
463	G	31.3	Very low	34.8	Very low	48 Å²	48	109.4 Å²	109.4	50%	0.495	65%	0.647	S	S	.	*	S	Bend	trans	-118.6	101.8	-178.2	0	0	0	0	0	112.3
464	S	27.5	Very low	34.3	Very low	110 Å²	110	113.7 Å²	113.7	77%	0.769	67%	0.674	S	S	*	*			trans	55.1	86.1	176.6	59.1	0	0	0	0	116.9
465	T	28.4	Very low	33.6	Very low	115 Å²	115	116.1 Å²	116.1	71%	0.706	69%	0.685	S	S	*	*			trans	-84.7	107.2	150.9	-60.3	0	0	0	0	108.7
466	F	25.7	Very low	33.1	Very low	197 Å²	197	114.5 Å²	114.5	86%	0.864	69%	0.688	S	S	*	*			trans	-110.2	104.1	163	-98.2	-76.7	0	0	0	109.5
467	H	28.6	Very low	32.3	Very low	167 Å²	167	116.3 Å²	116.3	77%	0.773	71%	0.707	S	S	*	*			trans	-85.2	129	162.9	-108.3	-90.4	0	0	0	108.8	S469	H467-S469 PolarHBondContact O-N 3.13Å
468	P	33.8	Very low	32.4	Very low	124 Å²	124	121.8 Å²	121.8	81%	0.805	73%	0.725	S	S	*	*			trans	-88.2	108.5	-176.3	32	-32.7	0	0	0	112.2
469	S	27.2	Very low	32.5	Very low	109 Å²	109	120.6 Å²	120.6	76%	0.762	72%	0.724	S	S	*	*			trans	-157.4	114.8	166.3	60.4	0	0	0	0	113.9	H467	H467-S469 PolarHBondContact O-N 3.13Å
470	N	27.5	Very low	33.1	Very low	127 Å²	127	119.1 Å²	119.1	68%	0.679	72%	0.719	S	S	*	*			trans	67.6	151	169.5	-105.4	51.7	0	0	0	120.1	E675	N470-E675 PolarHBondContact ND2-OE1 2.88Å; N470-E675 PolarHBondContact ND2-OE2 2.8Å
471	P	36.3	Very low	34.3	Very low	107 Å²	107	117.6 Å²	117.6	70%	0.695	71%	0.71	S	S	*	*			trans	-123.2	75.8	-162.9	38.6	-19.1	0	0	0	113.3
472	A	31.7	Very low	35.9	Very low	57 Å²	57	114.2 Å²	114.2	47%	0.471	69%	0.692	S	S	.	*			trans	-143.4	135	170.6	0	0	0	0	0	111.3
473	H	30.1	Very low	37.7	Very low	152 Å²	152	114.2 Å²	114.2	70%	0.704	68%	0.683	S	S	*	*			trans	60.2	108.4	179.7	-64.8	-88.6	0	0	0	117.5	V475	H473-V475 PolarHBondContact O-N 3.48Å; H473-V475 VanDerWaalsContact O-N 3.16Å
474	P	28.9	Very low	39.7	Very low	129 Å²	129	112.5 Å²	112.5	84%	0.838	66%	0.663	S	S	*	*			trans	-74.9	100.2	162	31.2	-31.3	0	0	0	110	V476	P474-V476 PolarHBondContact O-N 2.83Å
475	V	30.5	Very low	42	Very low	138 Å²	138	113.1 Å²	113.1	84%	0.836	66%	0.657	S	S	*	*			trans	-81.4	113.1	168.4	179.6	0	0	0	0	108.5	H473 A477	H473-V475 PolarHBondContact O-N 3.48Å; H473-V475 VanDerWaalsContact O-N 3.16Å; V475-A477 PolarHBondContact O-N 3.17Å
476	V	30.5	Very low	43.7	Very low	121 Å²	121	112 Å²	112	73%	0.733	64%	0.644	S	S	*	*			trans	-70.8	115	-176.2	176.8	0	0	0	0	110.6	P474	P474-V476 PolarHBondContact O-N 2.83Å
477	A	30.8	Very low	45.8	Very low	96 Å²	96	105.1 Å²	105.1	79%	0.793	62%	0.62	S	S	*	*			trans	-69.9	129.7	161.4	0	0	0	0	0	109	V475 G479	V475-A477 PolarHBondContact O-N 3.17Å; A477-G479 PolarHBondContact O-N 2.9Å
478	Q	42.3	Very low	47.8	Very low	195 Å²	195	102.4 Å²	102.4	91%	0.911	63%	0.627	S	S	*	*			trans	-72.8	101.4	-164.9	-68.5	168.4	-33	0	0	112.6
479	G	43.6	Very low	49.7	Very low	47 Å²	47	99.8 Å²	99.8	49%	0.485	60%	0.603	S	S	.	*			trans	-67.9	147.8	152.9	0	0	0	0	0	110.1	A477 T481	A477-G479 PolarHBondContact O-N 2.9Å; G479-T481 PolarHBondContact O-N 3.15Å; G479-T481 VanDerWaalsContact O-N 3.17Å
480	V	51.3	Low	51.8	Low	105 Å²	105	97.3 Å²	97.3	64%	0.636	59%	0.589	S	S	*	*			trans	-69	113.4	175.8	178	0	0	0	0	108.7	H482	V480-H482 PolarHBondContact O-CD2 2.98Å; V480-H482 VanDerWaalsContact O-CD2 3.29Å; V480-H482 PolarHBondContact O-N 3.2Å
481	T	62.5	Low	54.1	Low	84 Å²	84	92.2 Å²	92.2	52%	0.515	56%	0.562	S	S	.	*			trans	-79.9	108.6	173.1	51.8	0	0	0	0	109.4	G479 L483 T491 T492	G479-T481 PolarHBondContact O-N 3.15Å; G479-T481 VanDerWaalsContact O-N 3.17Å; T481-L483 PolarHBondContact O-N 3.02Å; T481-T491 CarbonylContact C-O 3.24Å; T481-T492 HydrophobicContact CG2-CG2 4.21Å
482	H	71.6	Confident	55.5	Low	56 Å²	56	92.1 Å²	92.1	26%	0.259	56%	0.56	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.5	115.2	172	-60.9	-79.5	0	0	0	108.9	V480 T491 I494 L497	V480-H482 PolarHBondContact O-CD2 2.98Å; V480-H482 VanDerWaalsContact O-CD2 3.29Å; V480-H482 PolarHBondContact O-N 3.2Å; H482-T491 WeakPolarHBondContact CA-O 3.37Å; H482-T491 PolarHBondContact N-O 3.3Å; H482-T491 PolarHBondContact O-N 2.79Å; H482-I494 WeakPolarHBondContact NE2-CG1 3.45Å; H482-L497 HydrophobicContact CB-CD2 3.67Å
483	L	71.4	Confident	57.3	Low	115 Å²	115	93 Å²	93	60%	0.602	56%	0.557	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-97.7	143.6	-179.2	-66.3	167.2	0	0	0	110	T481 A490	T481-L483 PolarHBondContact O-N 3.02Å; L483-A490 HydrophobicContact CD2-CB 3.55Å
484	C	74.8	Confident	59.2	Low	12 Å²	12	90.1 Å²	90.1	8%	0.081	55%	0.545	C	S	.	.			trans	-74.8	138.5	164.8	-175	0	0	0	0	110.1	Q486 C487 F489 L497 H500 Y501 H505	C484-Q486 PolarHBondContact SG-N 2.91Å; C484-Q486 VanDerWaalsContact SG-N 3.37Å; C484-C487 WeakPolarHBondContact CB-O 3.29Å; C484-C487 VanDerWaalsContact O-O 3.06Å; C484-F489 HydrophobicContact CB-CB 4.09Å; C484-F489 PolarHBondContact N-O 3.34Å; C484-L497 HydrophobicContact CB-CD1 3.88Å; C484-H500 PolarHBondContact SG-NE2 3.07Å; C484-Y501 VanDerWaalsContact SG-CE1 3.55Å; C484-H505 PolarHBondContact SG-NE2 2.85Å
485	D	74.1	Confident	61.3	Low	123 Å²	123	89.5 Å²	89.5	66%	0.658	54%	0.535	S	S	*	.	S	Bend	trans	-78.4	-19.4	173.9	70.1	-21.4	0	0	0	113.6	Y501	D485-Y501 VanDerWaalsContact CG-OH 3.24Å; D485-Y501 PolarHBondContact N-OH 3.35Å; D485-Y501 WeakPolarHBondContact OD1-CE1 3.31Å; D485-Y501 PolarHBondContact OD1-OH 3.08Å
486	Q	64.4	Low	63.3	Low	90 Å²	90	86.1 Å²	86.1	42%	0.421	51%	0.514	S	S	.	.	S	Bend	trans	-104.9	-9.5	-174.8	-79	155.8	86.8	0	0	114.3	C484 H505	C484-Q486 PolarHBondContact SG-N 2.91Å; C484-Q486 VanDerWaalsContact SG-N 3.37Å; Q486-H505 WeakPolarHBondContact CB-ND1 3.4Å
487	C	70.3	Confident	65.4	Low	54 Å²	54	81.2 Å²	81.2	37%	0.365	48%	0.484	S	S	.	.	S	Bend	trans	-159.2	172.7	167.2	77.8	0	0	0	0	112	C484 F489 H500	C484-C487 WeakPolarHBondContact CB-O 3.29Å; C484-C487 VanDerWaalsContact O-O 3.06Å; C487-F489 PolarHBondContact O-N 2.8Å; C487-H500 PolarHBondContact SG-CE1 3.02Å; C487-H500 PolarHBondContact SG-NE2 2.96Å
488	A	71	Confident	67.4	Low	110 Å²	110	80.9 Å²	80.9	91%	0.909	47%	0.469	S	S	*	.	S	Bend	trans	-71.5	23	-178.2	0	0	0	0	0	115.6
489	F	72.5	Confident	68.8	Low	69 Å²	69	77.2 Å²	77.2	30%	0.303	45%	0.451	S	S	.	.			trans	-75.7	133.6	177	-175.6	-101.5	0	0	0	111.2	C484 C487 T491 V496 L497 H500	C484-F489 HydrophobicContact CB-CB 4.09Å; C484-F489 PolarHBondContact N-O 3.34Å; C487-F489 PolarHBondContact O-N 2.8Å; F489-T491 HydrophobicContact CD1-CG2 4.35Å; F489-T491 HydrophobicContact CE1-CG2 3.67Å; F489-T491 HydrophobicContact CZ-CG2 4.42Å; F489-V496 HydrophobicContact CE1-CG1 4.34Å; F489-V496 HydrophobicContact CZ-CG1 3.99Å; F489-L497 HydrophobicContact CD1-CD1 3.94Å; F489-L497 HydrophobicContact CE1-CD1 4.34Å; F489-H500 WeakPolarHBondContact CB-NE2 3.4Å; F489-H500 HydrophobicContact CD1-CB 3.76Å; F489-H500 AromaticContact CD1-CD2 3.49Å; F489-H500 VanDerWaalsContact CD1-CD2 3.49Å; F489-H500 WeakPolarHBondContact CD1-CD2 3.49Å; F489-H500 AromaticContact CD1-CG 3.38Å; F489-H500 AromaticContact CD1-ND1 3.86Å; F489-H500 HydrophobicContact CE1-CB 3.55Å; F489-H500 AromaticContact CE1-CG 3.72Å; F489-H500 HydrophobicContact CG-CB 4.48Å; F489-H500 AromaticContact CG-CD2 3.83Å; F489-H500 AromaticContact CG-CE1 3.79Å; F489-H500 AromaticContact CG-CG 3.74Å; F489-H500 AromaticContact CG-ND1 3.71Å; F489-H500 AromaticContact CG-NE2 3.87Å; F489-H500 HydrophobicContact CZ-CB 4.14Å
490	A	72.7	Confident	70.4	Confident	57 Å²	57	75.9 Å²	75.9	47%	0.471	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.4	134.1	-177.6	0	0	0	0	0	110.1	L483	L483-A490 HydrophobicContact CD2-CB 3.55Å
491	T	75.1	Confident	71.3	Confident	19 Å²	19	73.8 Å²	73.8	12%	0.117	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	148.7	178.3	168.8	0	0	0	0	110.4	T481 H482 F489 D493 V496 L497	T481-T491 CarbonylContact C-O 3.24Å; H482-T491 WeakPolarHBondContact CA-O 3.37Å; H482-T491 PolarHBondContact N-O 3.3Å; H482-T491 PolarHBondContact O-N 2.79Å; F489-T491 HydrophobicContact CD1-CG2 4.35Å; F489-T491 HydrophobicContact CE1-CG2 3.67Å; F489-T491 HydrophobicContact CZ-CG2 4.42Å; T491-D493 WeakPolarHBondContact CG2-O 3.49Å; T491-D493 PolarHBondContact OG1-N 3.49Å; T491-D493 PolarHBondContact OG1-O 3.12Å; T491-D493 VanDerWaalsContact OG1-O 3.11Å; T491-V496 HydrophobicContact CG2-CB 4.38Å; T491-V496 HydrophobicContact CG2-CG1 4.33Å; T491-L497 HydrophobicContact CG2-CB 3.63Å; T491-L497 HydrophobicContact CG2-CD1 4.44Å
492	T	65.9	Low	71.8	Confident	105 Å²	105	76 Å²	76	64%	0.644	42%	0.418	S	S	*	.	S	Bend	trans	-84.3	2.2	171.6	51	0	0	0	0	113.1	T481	T481-T492 HydrophobicContact CG2-CG2 4.21Å
493	D	68.3	Low	71.7	Confident	77 Å²	77	77.2 Å²	77.2	41%	0.412	43%	0.433	S	S	.	.			trans	-124.8	128.3	-175.8	-169.1	-39.6	0	0	0	110.4	T491 D495 V496 L497	T491-D493 WeakPolarHBondContact CG2-O 3.49Å; T491-D493 PolarHBondContact OG1-N 3.49Å; T491-D493 PolarHBondContact OG1-O 3.12Å; T491-D493 VanDerWaalsContact OG1-O 3.11Å; D493-D495 PolarHBondContact OD1-N 3.41Å; D493-V496 HydrophobicContact CB-CB 4.15Å; D493-V496 HydrophobicContact CB-CG2 3.88Å; D493-L497 PolarHBondContact O-N 3.13Å
494	I	70.7	Confident	71.3	Confident	90 Å²	90	75.1 Å²	75.1	46%	0.462	43%	0.427	S	S	.	.	H	α-helix	trans	-70.3	-38.6	-177.3	-65.5	176.4	0	0	0	111.5	H482 V496 L497 L498	H482-I494 WeakPolarHBondContact NE2-CG1 3.45Å; I494-V496 VanDerWaalsContact C-N 3.28Å; I494-V496 PolarHBondContact O-N 3.47Å; I494-L497 WeakPolarHBondContact O-CB 3.26Å; I494-L497 PolarHBondContact O-N 3.37Å; I494-L498 HydrophobicContact CG2-CD1 4.03Å; I494-L498 HydrophobicContact CG2-CG 4.33Å; I494-L498 WeakPolarHBondContact O-CG 3.46Å; I494-L498 PolarHBondContact O-N 2.87Å
495	D	73.4	Confident	70.8	Confident	117 Å²	117	75.6 Å²	75.6	63%	0.626	43%	0.428	S	S	*	.	H	α-helix	trans	-70	-33.8	-176.2	-67.5	-23.9	0	0	0	110	D493 L498 Q499	D493-D495 PolarHBondContact OD1-N 3.41Å; D495-L498 PolarHBondContact O-N 3.36Å; D495-Q499 WeakPolarHBondContact O-CB 3.48Å; D495-Q499 PolarHBondContact O-N 2.79Å
496	V	73	Confident	69.9	Low	66 Å²	66	73.2 Å²	73.2	40%	0.4	42%	0.421	S	S	.	.	H	α-helix	trans	-65.4	-35.7	169.8	178.8	0	0	0	0	111.8	F489 T491 D493 I494 H500	F489-V496 HydrophobicContact CE1-CG1 4.34Å; F489-V496 HydrophobicContact CZ-CG1 3.99Å; T491-V496 HydrophobicContact CG2-CB 4.38Å; T491-V496 HydrophobicContact CG2-CG1 4.33Å; D493-V496 HydrophobicContact CB-CB 4.15Å; D493-V496 HydrophobicContact CB-CG2 3.88Å; I494-V496 VanDerWaalsContact C-N 3.28Å; I494-V496 PolarHBondContact O-N 3.47Å; V496-H500 WeakPolarHBondContact O-CB 3.48Å; V496-H500 PolarHBondContact O-N 2.82Å
497	L	73.4	Confident	69.1	Low	18 Å²	18	77.1 Å²	77.1	9%	0.094	44%	0.441	C	S	.	.	H	α-helix	trans	-70.8	-40.8	175.4	-177.2	58.5	0	0	0	111.7	H482 C484 F489 T491 D493 I494 H500 Y501	H482-L497 HydrophobicContact CB-CD2 3.67Å; C484-L497 HydrophobicContact CB-CD1 3.88Å; F489-L497 HydrophobicContact CD1-CD1 3.94Å; F489-L497 HydrophobicContact CE1-CD1 4.34Å; T491-L497 HydrophobicContact CG2-CB 3.63Å; T491-L497 HydrophobicContact CG2-CD1 4.44Å; D493-L497 PolarHBondContact O-N 3.13Å; I494-L497 WeakPolarHBondContact O-CB 3.26Å; I494-L497 PolarHBondContact O-N 3.37Å; L497-H500 WeakPolarHBondContact O-CB 3.43Å; L497-H500 PolarHBondContact O-N 3.43Å; L497-Y501 HydrophobicContact CD1-CD2 4.09Å; L497-Y501 HydrophobicContact CD1-CE2 3.81Å; L497-Y501 HydrophobicContact CD2-CE2 4.06Å; L497-Y501 HydrophobicContact CG-CD2 3.9Å; L497-Y501 HydrophobicContact CG-CE2 3.71Å; L497-Y501 VanDerWaalsContact O-CD2 3.26Å; L497-Y501 WeakPolarHBondContact O-CD2 3.33Å; L497-Y501 PolarHBondContact O-N 2.94Å
498	L	73.1	Confident	67.9	Low	90 Å²	90	79.7 Å²	79.7	47%	0.471	45%	0.45	S	S	.	.	H	α-helix	trans	-62.6	-44.6	175.1	-70.2	171	0	0	0	110.8	I494 D495 H500 Y501 E502	I494-L498 HydrophobicContact CG2-CD1 4.03Å; I494-L498 HydrophobicContact CG2-CG 4.33Å; I494-L498 WeakPolarHBondContact O-CG 3.46Å; I494-L498 PolarHBondContact O-N 2.87Å; D495-L498 PolarHBondContact O-N 3.36Å; L498-H500 VanDerWaalsContact C-N 3.28Å; L498-H500 PolarHBondContact O-N 3.28Å; L498-Y501 WeakPolarHBondContact O-CB 3.11Å; L498-Y501 PolarHBondContact O-N 3.17Å; L498-Y501 VanDerWaalsContact O-N 3.11Å; L498-E502 PolarHBondContact O-N 3.26Å
499	Q	72.6	Confident	66.3	Low	118 Å²	118	84 Å²	84	55%	0.551	45%	0.448	S	S	*	.	H	α-helix	trans	-61.4	-35.8	174.4	-167.7	69.9	92.9	0	0	112.4	D495 E502 S503	D495-Q499 WeakPolarHBondContact O-CB 3.48Å; D495-Q499 PolarHBondContact O-N 2.79Å; Q499-E502 PolarHBondContact O-N 2.95Å; Q499-S503 WeakPolarHBondContact O-CB 3.34Å; Q499-S503 PolarHBondContact O-N 3.33Å; Q499-S503 PolarHBondContact O-OG 3.38Å
500	H	76.9	Confident	64.6	Low	18 Å²	18	88.1 Å²	88.1	8%	0.083	47%	0.473	C	S	.	.	H	α-helix	trans	-66.1	-41.7	172	170.1	72.6	0	0	0	112.5	C484 C487 F489 V496 L497 L498 E502 S503 C504 H505	C484-H500 PolarHBondContact SG-NE2 3.07Å; C487-H500 PolarHBondContact SG-CE1 3.02Å; C487-H500 PolarHBondContact SG-NE2 2.96Å; F489-H500 WeakPolarHBondContact CB-NE2 3.4Å; F489-H500 HydrophobicContact CD1-CB 3.76Å; F489-H500 AromaticContact CD1-CD2 3.49Å; F489-H500 VanDerWaalsContact CD1-CD2 3.49Å; F489-H500 WeakPolarHBondContact CD1-CD2 3.49Å; F489-H500 AromaticContact CD1-CG 3.38Å; F489-H500 AromaticContact CD1-ND1 3.86Å; F489-H500 HydrophobicContact CE1-CB 3.55Å; F489-H500 AromaticContact CE1-CG 3.72Å; F489-H500 HydrophobicContact CG-CB 4.48Å; F489-H500 AromaticContact CG-CD2 3.83Å; F489-H500 AromaticContact CG-CE1 3.79Å; F489-H500 AromaticContact CG-CG 3.74Å; F489-H500 AromaticContact CG-ND1 3.71Å; F489-H500 AromaticContact CG-NE2 3.87Å; F489-H500 HydrophobicContact CZ-CB 4.14Å; V496-H500 WeakPolarHBondContact O-CB 3.48Å; V496-H500 PolarHBondContact O-N 2.82Å; L497-H500 WeakPolarHBondContact O-CB 3.43Å; L497-H500 PolarHBondContact O-N 3.43Å; L498-H500 VanDerWaalsContact C-N 3.28Å; L498-H500 PolarHBondContact O-N 3.28Å; H500-E502 PolarHBondContact O-N 3.09Å; H500-S503 PolarHBondContact O-N 3.2Å; H500-S503 PolarHBondContact O-OG 3.23Å; H500-C504 VanDerWaalsContact CE1-SG 3.56Å; H500-C504 PolarHBondContact ND1-SG 2.87Å; H500-C504 VanDerWaalsContact ND1-SG 3.4Å; H500-C504 VanDerWaalsContact O-CB 3.29Å; H500-C504 WeakPolarHBondContact O-CB 2.97Å; H500-C504 PolarHBondContact O-N 3.16Å; H500-H505 AromaticContact CD2-CD2 3.98Å; H500-H505 AromaticContact CD2-NE2 3.87Å; H500-H505 AromaticContact CE1-NE2 3.62Å; H500-H505 AromaticContact NE2-CD2 3.55Å; H500-H505 AromaticContact NE2-NE2 3Å; H500-H505 PolarHBondContact NE2-NE2 3.03Å
501	Y	68.9	Low	62.7	Low	61 Å²	61	95.2 Å²	95.2	24%	0.239	49%	0.493	C	S	.	.	I	π-helix	trans	-60.5	-44.4	172.8	-85.3	-66.5	0	0	0	112.5	C484 D485 L497 L498 S503 H505 S506	C484-Y501 VanDerWaalsContact SG-CE1 3.55Å; D485-Y501 VanDerWaalsContact CG-OH 3.24Å; D485-Y501 PolarHBondContact N-OH 3.35Å; D485-Y501 WeakPolarHBondContact OD1-CE1 3.31Å; D485-Y501 PolarHBondContact OD1-OH 3.08Å; L497-Y501 HydrophobicContact CD1-CD2 4.09Å; L497-Y501 HydrophobicContact CD1-CE2 3.81Å; L497-Y501 HydrophobicContact CD2-CE2 4.06Å; L497-Y501 HydrophobicContact CG-CD2 3.9Å; L497-Y501 HydrophobicContact CG-CE2 3.71Å; L497-Y501 VanDerWaalsContact O-CD2 3.26Å; L497-Y501 WeakPolarHBondContact O-CD2 3.33Å; L497-Y501 PolarHBondContact O-N 2.94Å; L498-Y501 WeakPolarHBondContact O-CB 3.11Å; L498-Y501 PolarHBondContact O-N 3.17Å; L498-Y501 VanDerWaalsContact O-N 3.11Å; Y501-S503 PolarHBondContact O-N 3.36Å; Y501-H505 HydrophobicContact CD1-CB 4.11Å; Y501-H505 AromaticContact CD1-CD2 3.83Å; Y501-H505 CarbonylContact O-C 3.57Å; Y501-H505 WeakPolarHBondContact O-CA 3.43Å; Y501-H505 PolarHBondContact O-N 2.96Å; Y501-S506 PolarHBondContact O-N 3.22Å
502	E	74.1	Confident	60.5	Low	131 Å²	131	97.7 Å²	97.7	61%	0.612	52%	0.523	S	S	*	.	I	π-helix	trans	-71.1	-28.8	-178.8	-70	-179.5	174.7	0	0	113.2	L498 Q499 H500 S506	L498-E502 PolarHBondContact O-N 3.26Å; Q499-E502 PolarHBondContact O-N 2.95Å; H500-E502 PolarHBondContact O-N 3.09Å; E502-S506 VanDerWaalsContact O-CB 3.22Å; E502-S506 WeakPolarHBondContact O-CB 3.38Å; E502-S506 PolarHBondContact O-OG 3.41Å
503	S	69.2	Low	58.7	Low	81 Å²	81	97.4 Å²	97.4	57%	0.566	53%	0.531	S	S	*	.	I	π-helix	trans	-92.5	-32.1	179.3	54.9	0	0	0	0	114.7	Q499 H500 Y501	Q499-S503 WeakPolarHBondContact O-CB 3.34Å; Q499-S503 PolarHBondContact O-N 3.33Å; Q499-S503 PolarHBondContact O-OG 3.38Å; H500-S503 PolarHBondContact O-N 3.2Å; H500-S503 PolarHBondContact O-OG 3.23Å; Y501-S503 PolarHBondContact O-N 3.36Å
504	C	63.3	Low	57.2	Low	72 Å²	72	99.3 Å²	99.3	49%	0.486	55%	0.548	S	S	.	.	I	π-helix	trans	-105	-26.9	-175.8	-61.5	0	0	0	0	114.3	H500	H500-C504 VanDerWaalsContact CE1-SG 3.56Å; H500-C504 PolarHBondContact ND1-SG 2.87Å; H500-C504 VanDerWaalsContact ND1-SG 3.4Å; H500-C504 VanDerWaalsContact O-CB 3.29Å; H500-C504 WeakPolarHBondContact O-CB 2.97Å; H500-C504 PolarHBondContact O-N 3.16Å
505	H	63.9	Low	56.1	Low	22 Å²	22	100.9 Å²	100.9	10%	0.102	56%	0.564	C	S	.	*	I	π-helix	trans	-124.7	-9	-168.6	-56.5	-65.7	0	0	0	114.9	C484 Q486 H500 Y501 M507 I508	C484-H505 PolarHBondContact SG-NE2 2.85Å; Q486-H505 WeakPolarHBondContact CB-ND1 3.4Å; H500-H505 AromaticContact CD2-CD2 3.98Å; H500-H505 AromaticContact CD2-NE2 3.87Å; H500-H505 AromaticContact CE1-NE2 3.62Å; H500-H505 AromaticContact NE2-CD2 3.55Å; H500-H505 AromaticContact NE2-NE2 3Å; H500-H505 PolarHBondContact NE2-NE2 3.03Å; Y501-H505 HydrophobicContact CD1-CB 4.11Å; Y501-H505 AromaticContact CD1-CD2 3.83Å; Y501-H505 CarbonylContact O-C 3.57Å; Y501-H505 WeakPolarHBondContact O-CA 3.43Å; Y501-H505 PolarHBondContact O-N 2.96Å; H505-M507 PolarHBondContact O-N 3.45Å; H505-I508 HydrophobicContact CB-CD1 4.31Å; H505-I508 WeakPolarHBondContact O-CB 2.99Å; H505-I508 PolarHBondContact O-N 3.5Å; H505-I508 VanDerWaalsContact O-N 3.07Å
506	S	55.2	Low	53.8	Low	72 Å²	72	104.7 Å²	104.7	50%	0.503	58%	0.578	S	S	.	*	G	3₁₀ helix	trans	-58.2	-30.6	179.3	57.6	0	0	0	0	113.8	Y501 E502 I508	Y501-S506 PolarHBondContact O-N 3.22Å; E502-S506 VanDerWaalsContact O-CB 3.22Å; E502-S506 WeakPolarHBondContact O-CB 3.38Å; E502-S506 PolarHBondContact O-OG 3.41Å; S506-I508 PolarHBondContact O-N 2.86Å
507	M	48.8	Very low	51.9	Low	173 Å²	173	108.2 Å²	108.2	85%	0.852	60%	0.599	S	S	*	*	G	3₁₀ helix	trans	-64.8	-13.6	177.1	-65.9	-99.1	-79.2	0	0	114	H505	H505-M507 PolarHBondContact O-N 3.45Å
508	I	44.3	Very low	49.6	Very low	107 Å²	107	115.7 Å²	115.7	55%	0.549	63%	0.631	S	S	.	*	G	3₁₀ helix	trans	-89.2	-15.9	-169.7	-58.5	176.1	0	0	0	112.7	H505 S506 L510	H505-I508 HydrophobicContact CB-CD1 4.31Å; H505-I508 WeakPolarHBondContact O-CB 2.99Å; H505-I508 PolarHBondContact O-N 3.5Å; H505-I508 VanDerWaalsContact O-N 3.07Å; S506-I508 PolarHBondContact O-N 2.86Å; I508-L510 VanDerWaalsContact C-N 3.32Å; I508-L510 PolarHBondContact O-N 3Å
509	K	37.2	Very low	47.9	Very low	200 Å²	200	116 Å²	116	87%	0.87	65%	0.646	S	S	*	*	S	Bend	trans	-89	27.6	-174.4	-84.2	-176.6	177.5	172.7	0	116
510	L	37.7	Very low	46	Very low	157 Å²	157	117.6 Å²	117.6	82%	0.822	65%	0.654	S	S	*	*	S	Bend	trans	-128.5	109	169.4	-108.7	164.3	0	0	0	112.5	I508	I508-L510 VanDerWaalsContact C-N 3.32Å; I508-L510 PolarHBondContact O-N 3Å
511	K	32.6	Very low	43.9	Very low	205 Å²	205	125.9 Å²	125.9	89%	0.891	69%	0.692	S	S	*	*			trans	76	118.6	163.6	-148.9	170.9	-172.8	175.8	0	116.5
512	G	28.4	Very low	42.2	Very low	72 Å²	72	131.4 Å²	131.4	74%	0.742	72%	0.72	S	S	*	*			trans	-95.9	130.8	179	0	0	0	0	0	114.2
513	A	27.8	Very low	40	Very low	99 Å²	99	132.1 Å²	132.1	82%	0.818	73%	0.734	S	S	*	*			trans	63.8	157.4	152.9	0	0	0	0	0	120.1
514	P	36.2	Very low	38.2	Very low	117 Å²	117	137.9 Å²	137.9	76%	0.76	75%	0.752	S	S	*	*			cis	-125.8	168.6	-33.4	34.3	-18.5	0	0	0	112.6
515	P	47.2	Very low	36.5	Very low	123 Å²	123	138.1 Å²	138.1	80%	0.799	77%	0.766	S	S	*	*			trans	-86.8	147.3	-176.9	34.1	-34.8	0	0	0	113.6
516	Q	26.8	Very low	35	Very low	197 Å²	197	143.6 Å²	143.6	92%	0.921	80%	0.797	S	S	*	*			trans	-136.5	139.1	157.3	-75.6	-158.1	10.5	0	0	113.3
517	V	31.9	Very low	33.9	Very low	140 Å²	140	149.3 Å²	149.3	85%	0.848	81%	0.813	S	S	*	*			trans	-50.7	137	-179.1	-141.8	0	0	0	0	114.6
518	K	26	Very low	33.1	Very low	175 Å²	175	150.4 Å²	150.4	76%	0.761	82%	0.815	S	S	*	*				-172.7	156.8	114.4	-105	-174.1	165.1	-136.6	0	111.8	E520	K518-E520 IonicContact NZ-OE1 2.68Å; K518-E520 PolarHBondContact NZ-OE1 3.33Å
519	A	38	Very low	32.4	Very low	96 Å²	96	149 Å²	149	79%	0.793	83%	0.828	S	S	*	*			trans	-141.8	119.1	176.3	0	0	0	0	0	109.7
520	E	31.7	Very low	32.1	Very low	152 Å²	152	142.8 Å²	142.8	71%	0.71	82%	0.82	S	S	*	*			trans	-148.4	104.6	170.5	-63.5	172	-155.9	0	0	102.2	K518	K518-E520 IonicContact NZ-OE1 2.68Å; K518-E520 PolarHBondContact NZ-OE1 3.33Å
521	E	33.3	Very low	31.7	Very low	191 Å²	191	147.5 Å²	147.5	89%	0.893	83%	0.827	S	S	*	*				85.2	158	86.7	-156.5	166.3	142.1	0	0	113
522	E	32.5	Very low	31.7	Very low	177 Å²	177	141.2 Å²	141.2	83%	0.827	82%	0.821	S	S	*	*			trans	-73.7	153.8	-147.6	-54.4	178.6	151.2	0	0	117.2
523	T	28.6	Very low	32	Very low	147 Å²	147	141.8 Å²	141.8	90%	0.902	83%	0.827	S	S	*	*				-164	140.4	129.8	4.4	0	0	0	0	112.4
524	E	31.2	Very low	32.3	Very low	201 Å²	201	141.2 Å²	141.2	94%	0.939	82%	0.822	S	S	*	*			trans	-74.8	156.8	170.9	-59.2	175.4	103.4	0	0	111.7
525	G	28	Very low	32.4	Very low	77 Å²	77	139.1 Å²	139.1	79%	0.794	82%	0.821	S	S	*	*			trans	165.7	52.9	173.1	0	0	0	0	0	118.5	K527	G525-K527 PolarHBondContact O-N 3.11Å
526	D	31.8	Very low	32.4	Very low	138 Å²	138	139.7 Å²	139.7	74%	0.738	81%	0.813	S	S	*	*			trans	-6.1	108.6	165.2	174.6	38.7	0	0	0	118.2
527	K	32.8	Very low	33.7	Very low	192 Å²	192	134.7 Å²	134.7	84%	0.835	80%	0.796	S	S	*	*				-163.4	134.3	128.9	-105.9	140.8	-164.8	149.6	0	113	G525	G525-K527 PolarHBondContact O-N 3.11Å
528	E	31.2	Very low	35.3	Very low	195 Å²	195	133.7 Å²	133.7	91%	0.911	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-66.6	143.4	-170.4	-158.8	165.1	-152.1	0	0	113.4
529	G	30.2	Very low	37.4	Very low	78 Å²	78	127.5 Å²	127.5	80%	0.804	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-76.7	142.2	-167.6	0	0	0	0	0	114.3
530	G	30.5	Very low	39.3	Very low	69 Å²	69	126.9 Å²	126.9	71%	0.711	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-100.8	168.7	172.1	0	0	0	0	0	114
531	R	30.1	Very low	41.2	Very low	256 Å²	256	120.2 Å²	120.2	97%	0.966	71%	0.713	S	S	*	*			trans	85.8	133.1	169.8	-53.9	172.6	176.3	-88.6	-3.7	117.2
532	G	32.1	Very low	43.1	Very low	74 Å²	74	117.5 Å²	117.5	76%	0.763	71%	0.709	S	S	*	*			trans	109.8	37.2	137.8	0	0	0	0	0	116.8	A534	G532-A534 PolarHBondContact O-N 3.12Å
533	G	34.1	Very low	44.2	Very low	84 Å²	84	114.3 Å²	114.3	87%	0.866	69%	0.693	S	S	*	*			trans	-54.6	109.4	174.1	0	0	0	0	0	112.2
534	A	35	Very low	46.2	Very low	86 Å²	86	109.7 Å²	109.7	71%	0.711	67%	0.665	S	S	*	*			trans	-59.9	144.4	145.3	0	0	0	0	0	107.4	G532 E536	G532-A534 PolarHBondContact O-N 3.12Å; A534-E536 PolarHBondContact O-N 2.96Å
535	G	37.9	Very low	47.9	Very low	73 Å²	73	106.2 Å²	106.2	75%	0.753	66%	0.663	S	S	*	*			trans	-67	99.4	176.5	0	0	0	0	0	110	T537	G535-T537 PolarHBondContact O-N 3.28Å; G535-T537 VanDerWaalsContact O-N 3.1Å
536	E	47.8	Very low	50	Low	135 Å²	135	105.9 Å²	105.9	63%	0.631	64%	0.64	S	S	*	*			trans	-58.3	112.3	174.1	-66.7	172	153.2	0	0	108.2	A534 E538 Q549	A534-E536 PolarHBondContact O-N 2.96Å; E536-E538 PolarHBondContact O-N 2.96Å; E536-Q549 HydrophobicContact CB-CG 4.26Å; E536-Q549 PolarHBondContact OE2-NE2 3.27Å
537	T	53.6	Low	52.1	Low	92 Å²	92	102.4 Å²	102.4	56%	0.564	62%	0.624	S	S	*	*			trans	-73.7	93.1	-178.3	45.4	0	0	0	0	109	G535 H539	G535-T537 PolarHBondContact O-N 3.28Å; G535-T537 VanDerWaalsContact O-N 3.1Å; T537-H539 PolarHBondContact O-CD2 2.93Å; T537-H539 PolarHBondContact O-N 2.84Å; T537-H539 PolarHBondContact O-NE2 2.89Å; T537-H539 PolarHBondContact OG1-NE2 3.22Å; T537-H539 VanDerWaalsContact OG1-NE2 3.17Å
538	E	65.4	Low	54.4	Low	119 Å²	119	93.9 Å²	93.9	56%	0.556	59%	0.588	S	S	*	*			trans	-65.9	102	178.4	-73.5	-167.3	164.2	0	0	111.3	E536 T540 V547 Q549	E536-E538 PolarHBondContact O-N 2.96Å; E538-T540 PolarHBondContact O-N 3.26Å; E538-V547 HydrophobicContact CB-CG1 3.73Å; E538-V547 HydrophobicContact CG-CG1 4.22Å; E538-Q549 HydrophobicContact CG-CG 4.21Å
539	H	70.3	Confident	56.4	Low	46 Å²	46	89.1 Å²	89.1	21%	0.213	57%	0.566	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.1	88.2	178.9	-64	-81.3	0	0	0	109.5	T537 T548 E551 L554	T537-H539 PolarHBondContact O-CD2 2.93Å; T537-H539 PolarHBondContact O-N 2.84Å; T537-H539 PolarHBondContact O-NE2 2.89Å; T537-H539 PolarHBondContact OG1-NE2 3.22Å; T537-H539 VanDerWaalsContact OG1-NE2 3.17Å; H539-T548 WeakPolarHBondContact CA-O 3.33Å; H539-T548 WeakPolarHBondContact CB-O 3.31Å; H539-T548 PolarHBondContact N-O 2.85Å; H539-T548 PolarHBondContact O-N 3.19Å; H539-E551 PolarHBondContact CD2-N 2.77Å; H539-L554 HydrophobicContact CB-CB 3.99Å; H539-L554 HydrophobicContact CB-CD2 3.8Å; H539-L554 HydrophobicContact CB-CG 4.48Å
540	T	76.9	Confident	58.4	Low	83 Å²	83	89 Å²	89	51%	0.509	55%	0.549	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73	144.7	176.1	65.5	0	0	0	0	112.3	E538 V547 L554	E538-T540 PolarHBondContact O-N 3.26Å; T540-V547 HydrophobicContact CG2-CB 4.48Å; T540-V547 HydrophobicContact CG2-CG1 3.92Å; T540-V547 HydrophobicContact CG2-CG2 3.89Å; T540-L554 WeakPolarHBondContact O-CD2 3.42Å
541	C	73	Confident	60.1	Low	12 Å²	12	90.8 Å²	90.8	8%	0.081	54%	0.539	C	S	.	.			trans	-84.4	128.6	175.5	-163.5	0	0	0	0	112.2	K543 C544 F546 L554 H562	C541-K543 PolarHBondContact O-N 2.85Å; C541-K543 VanDerWaalsContact O-N 3.08Å; C541-C544 WeakPolarHBondContact CB-O 3.28Å; C541-F546 HydrophobicContact CB-CB 4.25Å; C541-F546 PolarHBondContact N-O 2.75Å; C541-L554 HydrophobicContact CB-CD1 3.62Å; C541-H562 VanDerWaalsContact SG-CD2 3.53Å
542	T	72.6	Confident	62	Low	133 Å²	133	84 Å²	84	82%	0.816	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.1	2.7	178.6	54.7	0	0	0	0	114.6
543	K	55.5	Low	63.7	Low	111 Å²	111	84.3 Å²	84.3	48%	0.483	50%	0.5	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126	-15.7	-176.7	-77.3	-177.3	174.7	174.1	0	115.2	C541 Y558 H562	C541-K543 PolarHBondContact O-N 2.85Å; C541-K543 VanDerWaalsContact O-N 3.08Å; K543-Y558 HydrophobicContact CD-CD2 4.49Å; K543-Y558 HydrophobicContact CD-CE2 3.7Å; K543-Y558 WeakPolarHBondContact CE-OH 3.36Å; K543-Y558 HydrophobicContact CG-CE2 4.43Å; K543-Y558 PolarHBondContact NZ-OH 3.29Å; K543-H562 VanDerWaalsContact CB-NE2 3.34Å; K543-H562 WeakPolarHBondContact CB-NE2 3.1Å; K543-H562 HydrophobicContact CD-CB 3.78Å
544	C	69.8	Low	65.7	Low	49 Å²	49	81.8 Å²	81.8	33%	0.331	47%	0.466	S	S	.	.	S	Bend	trans	-156.9	168.2	171.5	72.4	0	0	0	0	110.1	C541 F546 H557 H562	C541-C544 WeakPolarHBondContact CB-O 3.28Å; C544-F546 PolarHBondContact O-N 2.84Å; C544-H557 VanDerWaalsContact SG-CE1 3.54Å; C544-H557 PolarHBondContact SG-NE2 2.91Å; C544-H562 PolarHBondContact SG-NE2 2.78Å; C544-H562 VanDerWaalsContact SG-NE2 3.35Å
545	S	68.4	Low	67	Low	128 Å²	128	83 Å²	83	90%	0.895	46%	0.456	S	S	*	.	S	Bend	trans	-74.2	32.3	-178.2	61.5	0	0	0	0	114.6
546	F	71.1	Confident	68.5	Low	71 Å²	71	83 Å²	83	31%	0.311	43%	0.433	S	S	.	.			trans	-85	137.5	173	-178.2	-97.4	0	0	0	110.4	C541 C544 T548 H557	C541-F546 HydrophobicContact CB-CB 4.25Å; C541-F546 PolarHBondContact N-O 2.75Å; C544-F546 PolarHBondContact O-N 2.84Å; F546-T548 HydrophobicContact CE1-CG2 3.69Å; F546-T548 HydrophobicContact CZ-CG2 4.35Å; F546-H557 WeakPolarHBondContact CB-CE1 3.46Å; F546-H557 HydrophobicContact CD1-CB 3.79Å; F546-H557 AromaticContact CD1-CD2 3.74Å; F546-H557 AromaticContact CD1-CE1 3.78Å; F546-H557 AromaticContact CD1-CG 3.32Å; F546-H557 AromaticContact CD1-ND1 3.34Å; F546-H557 VanDerWaalsContact CD1-ND1 3.34Å; F546-H557 WeakPolarHBondContact CD1-ND1 3.46Å; F546-H557 AromaticContact CD2-ND1 3.68Å; F546-H557 HydrophobicContact CE1-CB 3.58Å; F546-H557 AromaticContact CE1-CG 3.65Å; F546-H557 AromaticContact CE1-ND1 3.78Å; F546-H557 AromaticContact CG-CE1 3.43Å; F546-H557 VanDerWaalsContact CG-CE1 3.43Å; F546-H557 WeakPolarHBondContact CG-CE1 3.34Å; F546-H557 AromaticContact CG-CG 3.79Å; F546-H557 AromaticContact CG-ND1 3.28Å; F546-H557 VanDerWaalsContact CG-ND1 3.28Å; F546-H557 WeakPolarHBondContact CG-ND1 3.47Å; F546-H557 AromaticContact CG-NE2 3.98Å; F546-H557 HydrophobicContact CZ-CB 4.26Å
547	V	75.4	Confident	69.8	Low	64 Å²	64	77.4 Å²	77.4	39%	0.388	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	140.8	-179.7	-170.6	0	0	0	0	108	E538 T540	E538-V547 HydrophobicContact CB-CG1 3.73Å; E538-V547 HydrophobicContact CG-CG1 4.22Å; T540-V547 HydrophobicContact CG2-CB 4.48Å; T540-V547 HydrophobicContact CG2-CG1 3.92Å; T540-V547 HydrophobicContact CG2-CG2 3.89Å
548	T	82.6	Confident	70.4	Confident	13 Å²	13	77.3 Å²	77.3	8%	0.08	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.2	149.4	173.7	174.2	0	0	0	0	109.5	H539 F546 V550 E553 L554	H539-T548 WeakPolarHBondContact CA-O 3.33Å; H539-T548 WeakPolarHBondContact CB-O 3.31Å; H539-T548 PolarHBondContact N-O 2.85Å; H539-T548 PolarHBondContact O-N 3.19Å; F546-T548 HydrophobicContact CE1-CG2 3.69Å; F546-T548 HydrophobicContact CZ-CG2 4.35Å; T548-V550 VanDerWaalsContact C-N 3.25Å; T548-V550 WeakPolarHBondContact CG2-O 3.47Å; T548-V550 PolarHBondContact OG1-N 2.88Å; T548-E553 HydrophobicContact CG2-CB 3.66Å; T548-E553 WeakPolarHBondContact OG1-CB 3.5Å; T548-E553 PolarHBondContact OG1-OE2 3.45Å; T548-L554 HydrophobicContact CG2-CB 3.99Å
549	Q	72.5	Confident	70.3	Confident	96 Å²	96	78.9 Å²	78.9	45%	0.449	40%	0.398	S	S	.	.	S	Bend	trans	-82.4	-5	177.3	-62.3	171.8	-24.8	0	0	112.3	E536 E538	E536-Q549 HydrophobicContact CB-CG 4.26Å; E536-Q549 PolarHBondContact OE2-NE2 3.27Å; E538-Q549 HydrophobicContact CG-CG 4.21Å
550	V	70.9	Confident	69.8	Low	74 Å²	74	85.3 Å²	85.3	45%	0.448	42%	0.42	S	S	.	.			trans	-112.2	113.6	-179.9	-179.1	0	0	0	0	109.9	T548 E552 E553 L554	T548-V550 VanDerWaalsContact C-N 3.25Å; T548-V550 WeakPolarHBondContact CG2-O 3.47Å; T548-V550 PolarHBondContact OG1-N 2.88Å; V550-E552 VanDerWaalsContact C-N 3.25Å; V550-E552 HydrophobicContact CG1-CB 4.37Å; V550-E552 PolarHBondContact O-N 2.93Å; V550-E553 HydrophobicContact CB-CB 4.13Å; V550-E553 HydrophobicContact CB-CG 4.21Å; V550-E553 HydrophobicContact CG1-CB 4.48Å; V550-E553 HydrophobicContact CG1-CG 4.38Å; V550-E553 WeakPolarHBondContact O-CA 3.2Å; V550-E553 VanDerWaalsContact O-CB 3.31Å; V550-E553 WeakPolarHBondContact O-CB 3.47Å; V550-E553 PolarHBondContact O-N 3.39Å; V550-L554 PolarHBondContact O-N 3.4Å
551	E	66.4	Low	69	Low	108 Å²	108	84.7 Å²	84.7	51%	0.505	42%	0.416	S	S	.	.	H	α-helix	trans	-54.4	-40.7	-178.5	-165.8	-177.4	-175.1	0	0	112.9	H539 E553 L554 F555	H539-E551 PolarHBondContact CD2-N 2.77Å; E551-E553 PolarHBondContact O-N 3.3Å; E551-L554 WeakPolarHBondContact O-CA 3.33Å; E551-L554 WeakPolarHBondContact O-CB 3.33Å; E551-L554 PolarHBondContact O-N 3.13Å; E551-F555 HydrophobicContact CG-CD2 4.09Å; E551-F555 HydrophobicContact CG-CE2 3.8Å; E551-F555 WeakPolarHBondContact O-CD2 3.45Å; E551-F555 PolarHBondContact O-N 2.94Å
552	E	70	Confident	68.4	Low	114 Å²	114	85.9 Å²	85.9	53%	0.533	42%	0.42	S	S	.	.	H	α-helix	trans	-67.4	-25	178.6	-151.3	-152.2	-138.1	0	0	112.6	V550 F555 R556	V550-E552 VanDerWaalsContact C-N 3.25Å; V550-E552 HydrophobicContact CG1-CB 4.37Å; V550-E552 PolarHBondContact O-N 2.93Å; E552-F555 PolarHBondContact O-N 3.41Å; E552-R556 WeakPolarHBondContact O-CB 3.42Å; E552-R556 VanDerWaalsContact O-CG 3.32Å; E552-R556 WeakPolarHBondContact O-CG 3.44Å; E552-R556 PolarHBondContact O-N 2.91Å; E552-R556 PolarHBondContact O-NE 2.87Å; E552-R556 IonicContact OE2-CZ 3.96Å; E552-R556 IonicContact OE2-NE 2.75Å; E552-R556 PolarHBondContact OE2-NE 2.75Å; E552-R556 IonicContact OE2-NH2 2.66Å; E552-R556 PolarHBondContact OE2-NH2 2.98Å
553	E	68.5	Low	67.7	Low	79 Å²	79	81.5 Å²	81.5	37%	0.369	40%	0.397	S	S	.	.	H	α-helix	trans	-70	-35.8	168	-84.6	-164.6	161	0	0	112.5	T548 V550 E551 F555 R556 H557	T548-E553 HydrophobicContact CG2-CB 3.66Å; T548-E553 WeakPolarHBondContact OG1-CB 3.5Å; T548-E553 PolarHBondContact OG1-OE2 3.45Å; V550-E553 HydrophobicContact CB-CB 4.13Å; V550-E553 HydrophobicContact CB-CG 4.21Å; V550-E553 HydrophobicContact CG1-CB 4.48Å; V550-E553 HydrophobicContact CG1-CG 4.38Å; V550-E553 WeakPolarHBondContact O-CA 3.2Å; V550-E553 VanDerWaalsContact O-CB 3.31Å; V550-E553 WeakPolarHBondContact O-CB 3.47Å; V550-E553 PolarHBondContact O-N 3.39Å; E551-E553 PolarHBondContact O-N 3.3Å; E553-F555 VanDerWaalsContact C-N 3.31Å; E553-F555 PolarHBondContact O-N 2.88Å; E553-R556 CarbonylContact O-C 3.53Å; E553-R556 PolarHBondContact O-N 3.27Å; E553-R556 IonicContact OE1-NH1 2.97Å; E553-H557 VanDerWaalsContact O-CB 3.23Å; E553-H557 WeakPolarHBondContact O-CB 3.48Å; E553-H557 PolarHBondContact O-N 2.68Å
554	L	75.6	Confident	67.7	Low	32 Å²	32	78.3 Å²	78.3	17%	0.168	39%	0.388	C	S	.	.	H	α-helix	trans	-64.1	-40.6	173	-179	61.7	0	0	0	110.3	H539 T540 C541 T548 V550 E551 H557 Y558	H539-L554 HydrophobicContact CB-CB 3.99Å; H539-L554 HydrophobicContact CB-CD2 3.8Å; H539-L554 HydrophobicContact CB-CG 4.48Å; T540-L554 WeakPolarHBondContact O-CD2 3.42Å; C541-L554 HydrophobicContact CB-CD1 3.62Å; T548-L554 HydrophobicContact CG2-CB 3.99Å; V550-L554 PolarHBondContact O-N 3.4Å; E551-L554 WeakPolarHBondContact O-CA 3.33Å; E551-L554 WeakPolarHBondContact O-CB 3.33Å; E551-L554 PolarHBondContact O-N 3.13Å; L554-H557 PolarHBondContact O-N 2.99Å; L554-Y558 VanDerWaalsContact O-CB 3.25Å; L554-Y558 WeakPolarHBondContact O-CB 3.38Å; L554-Y558 PolarHBondContact O-N 3.42Å
555	F	62.9	Low	67.3	Low	112 Å²	112	78 Å²	78	49%	0.491	39%	0.386	S	S	.	.	H	α-helix	trans	-68.2	-30.1	173.4	-75.6	-67.7	0	0	0	114	E551 E552 E553 R559	E551-F555 HydrophobicContact CG-CD2 4.09Å; E551-F555 HydrophobicContact CG-CE2 3.8Å; E551-F555 WeakPolarHBondContact O-CD2 3.45Å; E551-F555 PolarHBondContact O-N 2.94Å; E552-F555 PolarHBondContact O-N 3.41Å; E553-F555 VanDerWaalsContact C-N 3.31Å; E553-F555 PolarHBondContact O-N 2.88Å; F555-R559 WeakPolarHBondContact O-CB 3.39Å; F555-R559 WeakPolarHBondContact O-CG 3.34Å; F555-R559 PolarHBondContact O-N 3.05Å; F555-R559 PolarHBondContact O-NE 2.88Å; F555-R559 VanDerWaalsContact O-NE 3.15Å
556	R	68.9	Low	67	Low	71 Å²	71	78.3 Å²	78.3	27%	0.268	37%	0.368	S	S	.	.	H	α-helix	trans	-76.1	-39.8	172.9	-76.9	-177.8	-95.8	121.5	-7.7	111.7	E552 E553 R559 R560	E552-R556 WeakPolarHBondContact O-CB 3.42Å; E552-R556 VanDerWaalsContact O-CG 3.32Å; E552-R556 WeakPolarHBondContact O-CG 3.44Å; E552-R556 PolarHBondContact O-N 2.91Å; E552-R556 PolarHBondContact O-NE 2.87Å; E552-R556 IonicContact OE2-CZ 3.96Å; E552-R556 IonicContact OE2-NE 2.75Å; E552-R556 PolarHBondContact OE2-NE 2.75Å; E552-R556 IonicContact OE2-NH2 2.66Å; E552-R556 PolarHBondContact OE2-NH2 2.98Å; E553-R556 CarbonylContact O-C 3.53Å; E553-R556 PolarHBondContact O-N 3.27Å; E553-R556 IonicContact OE1-NH1 2.97Å; R556-R559 PolarHBondContact O-N 2.88Å; R556-R560 WeakPolarHBondContact O-CB 3.3Å; R556-R560 VanDerWaalsContact O-CG 3.24Å; R556-R560 WeakPolarHBondContact O-CG 3.49Å; R556-R560 PolarHBondContact O-N 2.76Å
557	H	76.4	Confident	66.7	Low	19 Å²	19	75.5 Å²	75.5	9%	0.088	36%	0.357	C	S	.	.	H	α-helix	trans	-61	-53	171.8	168.2	90.9	0	0	0	110.6	C544 F546 E553 L554 R559 R560 V561 H562	C544-H557 VanDerWaalsContact SG-CE1 3.54Å; C544-H557 PolarHBondContact SG-NE2 2.91Å; F546-H557 WeakPolarHBondContact CB-CE1 3.46Å; F546-H557 HydrophobicContact CD1-CB 3.79Å; F546-H557 AromaticContact CD1-CD2 3.74Å; F546-H557 AromaticContact CD1-CE1 3.78Å; F546-H557 AromaticContact CD1-CG 3.32Å; F546-H557 AromaticContact CD1-ND1 3.34Å; F546-H557 VanDerWaalsContact CD1-ND1 3.34Å; F546-H557 WeakPolarHBondContact CD1-ND1 3.46Å; F546-H557 AromaticContact CD2-ND1 3.68Å; F546-H557 HydrophobicContact CE1-CB 3.58Å; F546-H557 AromaticContact CE1-CG 3.65Å; F546-H557 AromaticContact CE1-ND1 3.78Å; F546-H557 AromaticContact CG-CE1 3.43Å; F546-H557 VanDerWaalsContact CG-CE1 3.43Å; F546-H557 WeakPolarHBondContact CG-CE1 3.34Å; F546-H557 AromaticContact CG-CG 3.79Å; F546-H557 AromaticContact CG-ND1 3.28Å; F546-H557 VanDerWaalsContact CG-ND1 3.28Å; F546-H557 WeakPolarHBondContact CG-ND1 3.47Å; F546-H557 AromaticContact CG-NE2 3.98Å; F546-H557 HydrophobicContact CZ-CB 4.26Å; E553-H557 VanDerWaalsContact O-CB 3.23Å; E553-H557 WeakPolarHBondContact O-CB 3.48Å; E553-H557 PolarHBondContact O-N 2.68Å; L554-H557 PolarHBondContact O-N 2.99Å; H557-R559 PolarHBondContact O-N 3.17Å; H557-R560 PolarHBondContact O-N 3.31Å; H557-V561 WeakPolarHBondContact O-CB 3.28Å; H557-V561 WeakPolarHBondContact O-CG2 3.22Å; H557-V561 PolarHBondContact O-N 3.37Å; H557-H562 AromaticContact NE2-CD2 3.68Å; H557-H562 AromaticContact NE2-NE2 3.6Å
558	Y	65.8	Low	66.3	Low	90 Å²	90	83.8 Å²	83.8	35%	0.353	38%	0.381	S	S	.	.	I	π-helix	trans	-59.6	-37.3	180	-169.6	-87.2	0	0	0	111.2	K543 L554 H562 A563	K543-Y558 HydrophobicContact CD-CD2 4.49Å; K543-Y558 HydrophobicContact CD-CE2 3.7Å; K543-Y558 WeakPolarHBondContact CE-OH 3.36Å; K543-Y558 HydrophobicContact CG-CE2 4.43Å; K543-Y558 PolarHBondContact NZ-OH 3.29Å; L554-Y558 VanDerWaalsContact O-CB 3.25Å; L554-Y558 WeakPolarHBondContact O-CB 3.38Å; L554-Y558 PolarHBondContact O-N 3.42Å; Y558-H562 HydrophobicContact CD1-CB 4.48Å; Y558-H562 HydrophobicContact CD2-CB 3.89Å; Y558-H562 HydrophobicContact CE2-CB 4.06Å; Y558-H562 HydrophobicContact CG-CB 4.13Å; Y558-H562 CarbonylContact O-C 3.59Å; Y558-H562 VanDerWaalsContact O-C 3.24Å; Y558-H562 VanDerWaalsContact O-CA 3.26Å; Y558-H562 WeakPolarHBondContact O-CA 3.42Å; Y558-H562 WeakPolarHBondContact O-CB 3.5Å; Y558-H562 PolarHBondContact O-N 3.42Å; Y558-A563 PolarHBondContact O-N 2.99Å
559	R	63.4	Low	65.5	Low	151 Å²	151	89.3 Å²	89.3	57%	0.57	41%	0.406	S	S	*	.	I	π-helix	trans	-65.8	-45.6	171.6	-81.1	-177.3	-79.2	179.7	-6.2	113.5	F555 R556 H557	F555-R559 WeakPolarHBondContact O-CB 3.39Å; F555-R559 WeakPolarHBondContact O-CG 3.34Å; F555-R559 PolarHBondContact O-N 3.05Å; F555-R559 PolarHBondContact O-NE 2.88Å; F555-R559 VanDerWaalsContact O-NE 3.15Å; R556-R559 PolarHBondContact O-N 2.88Å; H557-R559 PolarHBondContact O-N 3.17Å
560	R	59.4	Low	65.7	Low	182 Å²	182	87.2 Å²	87.2	69%	0.687	40%	0.401	S	S	*	.	I	π-helix	trans	-71.9	-33	-178.4	-69.1	167.7	-172.6	162.3	-1.2	114.3	R556 H557	R556-R560 WeakPolarHBondContact O-CB 3.3Å; R556-R560 VanDerWaalsContact O-CG 3.24Å; R556-R560 WeakPolarHBondContact O-CG 3.49Å; R556-R560 PolarHBondContact O-N 2.76Å; H557-R560 PolarHBondContact O-N 3.31Å
561	V	59	Low	65.5	Low	69 Å²	69	89.6 Å²	89.6	42%	0.418	41%	0.411	S	S	.	.	I	π-helix	trans	-113.1	-23.5	-167.9	-171.7	0	0	0	0	112.7	H557	H557-V561 WeakPolarHBondContact O-CB 3.28Å; H557-V561 WeakPolarHBondContact O-CG2 3.22Å; H557-V561 PolarHBondContact O-N 3.37Å
562	H	60.3	Low	65.5	Low	38 Å²	38	88.8 Å²	88.8	18%	0.176	41%	0.407	C	S	.	.	I	π-helix	trans	-134.9	-6.4	-168.8	-64.5	-38.9	0	0	0	116.4	C541 K543 C544 H557 Y558	C541-H562 VanDerWaalsContact SG-CD2 3.53Å; K543-H562 VanDerWaalsContact CB-NE2 3.34Å; K543-H562 WeakPolarHBondContact CB-NE2 3.1Å; K543-H562 HydrophobicContact CD-CB 3.78Å; C544-H562 PolarHBondContact SG-NE2 2.78Å; C544-H562 VanDerWaalsContact SG-NE2 3.35Å; H557-H562 AromaticContact NE2-CD2 3.68Å; H557-H562 AromaticContact NE2-NE2 3.6Å; Y558-H562 HydrophobicContact CD1-CB 4.48Å; Y558-H562 HydrophobicContact CD2-CB 3.89Å; Y558-H562 HydrophobicContact CE2-CB 4.06Å; Y558-H562 HydrophobicContact CG-CB 4.13Å; Y558-H562 CarbonylContact O-C 3.59Å; Y558-H562 VanDerWaalsContact O-C 3.24Å; Y558-H562 VanDerWaalsContact O-CA 3.26Å; Y558-H562 WeakPolarHBondContact O-CA 3.42Å; Y558-H562 WeakPolarHBondContact O-CB 3.5Å; Y558-H562 PolarHBondContact O-N 3.42Å
563	A	58.1	Low	65.3	Low	40 Å²	40	86 Å²	86	33%	0.331	40%	0.398	S	S	.	.			trans	-90.1	10.3	166	0	0	0	0	0	112.1	Y558 C565	Y558-A563 PolarHBondContact O-N 2.99Å; A563-C565 PolarHBondContact O-N 3.3Å; A563-C565 VanDerWaalsContact O-N 3.09Å; A563-C565 PolarHBondContact O-SG 2.83Å
564	C	57	Low	65.5	Low	44 Å²	44	82.3 Å²	82.3	30%	0.297	38%	0.38	S	S	.	.			trans	-61	113.3	177.3	59.4	0	0	0	0	110.8	R566 T573 A574	C564-R566 PolarHBondContact O-N 3.1Å; C564-T573 HydrophobicContact CB-CG2 3.63Å; C564-T573 VanDerWaalsContact SG-CG2 3.58Å; C564-A574 CarbonylContact C-O 3.54Å; C564-A574 WeakPolarHBondContact CA-O 3.29Å; C564-A574 WeakPolarHBondContact CB-O 3.39Å
565	C	61.1	Low	64.7	Low	42 Å²	42	85 Å²	85	28%	0.284	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	107.8	-174.5	-66.4	0	0	0	0	109.3	A563 A574 L580	A563-C565 PolarHBondContact O-N 3.3Å; A563-C565 VanDerWaalsContact O-N 3.09Å; A563-C565 PolarHBondContact O-SG 2.83Å; C565-A574 PolarHBondContact N-O 3.42Å; C565-A574 PolarHBondContact O-N 3.36Å; C565-L580 HydrophobicContact CB-CB 3.88Å; C565-L580 HydrophobicContact CB-CD2 3.61Å; C565-L580 HydrophobicContact CB-CG 4.31Å
566	R	61.6	Low	64.7	Low	135 Å²	135	82.5 Å²	82.5	51%	0.509	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	137.4	177.7	-73.4	-175.6	58.9	92.2	-9.5	111.8	C564 D571 F572 T573	C564-R566 PolarHBondContact O-N 3.1Å; R566-D571 IonicContact CZ-OD1 3.46Å; R566-D571 PolarHBondContact NH1-O 2.73Å; R566-D571 IonicContact NH2-OD1 2.71Å; R566-D571 PolarHBondContact NH2-OD1 2.89Å; R566-F572 WeakPolarHBondContact CA-O 3.28Å; R566-T573 HydrophobicContact CG-CG2 3.78Å; R566-T573 WeakPolarHBondContact CG-OG1 2.84Å; R566-T573 PolarHBondContact NH1-OG1 3.3Å
567	C	65	Low	64.6	Low	13 Å²	13	83.4 Å²	83.4	9%	0.088	41%	0.408	C	S	.	.			trans	-65.8	146.9	169.9	-169.1	0	0	0	0	110.5	H569 C570 F572 L580 H588	C567-H569 VanDerWaalsContact C-N 3.35Å; C567-H569 PolarHBondContact SG-N 3.26Å; C567-H569 VanDerWaalsContact SG-N 3.42Å; C567-C570 WeakPolarHBondContact CB-O 3.31Å; C567-F572 HydrophobicContact CB-CB 4.39Å; C567-F572 PolarHBondContact N-O 3.15Å; C567-L580 HydrophobicContact CB-CD1 3.75Å; C567-H588 PolarHBondContact SG-CD2 3.4Å; C567-H588 PolarHBondContact SG-NE2 2.91Å
568	R	67.6	Low	64.4	Low	237 Å²	237	86.2 Å²	86.2	89%	0.894	43%	0.43	S	S	*	.	S	Bend	trans	-88.5	-4	174.2	-72.1	-179.8	61.8	104.3	0.3	113.3
569	H	64.5	Low	64.8	Low	129 Å²	129	83.5 Å²	83.5	60%	0.597	43%	0.426	S	S	*	.	S	Bend	trans	-120.2	-12.5	-172.6	-63.3	-96.9	0	0	0	113.5	C567 F584 H588	C567-H569 VanDerWaalsContact C-N 3.35Å; C567-H569 PolarHBondContact SG-N 3.26Å; C567-H569 VanDerWaalsContact SG-N 3.42Å; H569-F584 AromaticContact CD2-CE2 3.73Å; H569-F584 AromaticContact NE2-CE2 3.93Å; H569-H588 WeakPolarHBondContact CB-NE2 3.49Å
570	C	76.4	Confident	65.4	Low	52 Å²	52	78.1 Å²	78.1	35%	0.351	41%	0.409	S	S	.	.	S	Bend	trans	-155.9	174.6	164.4	69.9	0	0	0	0	110.4	C567 F572 H583 H588	C567-C570 WeakPolarHBondContact CB-O 3.31Å; C570-F572 PolarHBondContact O-N 2.68Å; C570-F572 VanDerWaalsContact O-N 3.13Å; C570-F572 VanDerWaalsContact SG-CB 3.56Å; C570-H583 VanDerWaalsContact SG-CE1 3.56Å; C570-H583 PolarHBondContact SG-NE2 2.7Å; C570-H583 VanDerWaalsContact SG-NE2 3.37Å; C570-H588 PolarHBondContact SG-NE2 3.4Å; C570-H588 VanDerWaalsContact SG-NE2 3.39Å
571	D	67.7	Low	66.2	Low	124 Å²	124	74.2 Å²	74.2	66%	0.663	40%	0.401	S	S	*	.	S	Bend	trans	-71.8	2.5	-179.4	-74.7	-73.5	0	0	0	115.7	R566 T573	R566-D571 IonicContact CZ-OD1 3.46Å; R566-D571 PolarHBondContact NH1-O 2.73Å; R566-D571 IonicContact NH2-OD1 2.71Å; R566-D571 PolarHBondContact NH2-OD1 2.89Å; D571-T573 PolarHBondContact O-N 2.93Å; D571-T573 PolarHBondContact O-OG1 3Å
572	F	66.3	Low	67.1	Low	92 Å²	92	76.2 Å²	76.2	40%	0.404	41%	0.409	S	S	.	.			trans	-57.2	137.4	176.9	-172.9	-97.3	0	0	0	111.5	R566 C567 C570 A574 H583	R566-F572 WeakPolarHBondContact CA-O 3.28Å; C567-F572 HydrophobicContact CB-CB 4.39Å; C567-F572 PolarHBondContact N-O 3.15Å; C570-F572 PolarHBondContact O-N 2.68Å; C570-F572 VanDerWaalsContact O-N 3.13Å; C570-F572 VanDerWaalsContact SG-CB 3.56Å; F572-A574 HydrophobicContact CD1-CB 4.36Å; F572-A574 HydrophobicContact CE1-CB 3.75Å; F572-H583 WeakPolarHBondContact CB-CE1 3.49Å; F572-H583 WeakPolarHBondContact CB-NE2 3.47Å; F572-H583 HydrophobicContact CD1-CB 3.68Å; F572-H583 AromaticContact CD1-CD2 3.42Å; F572-H583 VanDerWaalsContact CD1-CD2 3.42Å; F572-H583 WeakPolarHBondContact CD1-CD2 3.18Å; F572-H583 AromaticContact CD1-CE1 3.79Å; F572-H583 AromaticContact CD1-CG 3.16Å; F572-H583 AromaticContact CD1-ND1 3.42Å; F572-H583 WeakPolarHBondContact CD1-ND1 3.46Å; F572-H583 AromaticContact CD1-NE2 3.8Å; F572-H583 AromaticContact CD2-ND1 3.92Å; F572-H583 HydrophobicContact CE1-CB 3.45Å; F572-H583 VanDerWaalsContact CE1-CB 3.45Å; F572-H583 AromaticContact CE1-CG 3.49Å; F572-H583 VanDerWaalsContact CE1-CG 3.49Å; F572-H583 AromaticContact CE1-ND1 3.84Å; F572-H583 AromaticContact CG-CD2 3.93Å; F572-H583 AromaticContact CG-CE1 3.51Å; F572-H583 AromaticContact CG-CG 3.71Å; F572-H583 AromaticContact CG-ND1 3.45Å; F572-H583 WeakPolarHBondContact CG-ND1 3.46Å; F572-H583 AromaticContact CG-NE2 3.8Å; F572-H583 HydrophobicContact CZ-CB 4.22Å
573	T	66.8	Low	68.2	Low	56 Å²	56	75.4 Å²	75.4	34%	0.344	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	94.7	-168.5	-57.9	0	0	0	0	107.8	C564 R566 D571	C564-T573 HydrophobicContact CB-CG2 3.63Å; C564-T573 VanDerWaalsContact SG-CG2 3.58Å; R566-T573 HydrophobicContact CG-CG2 3.78Å; R566-T573 WeakPolarHBondContact CG-OG1 2.84Å; R566-T573 PolarHBondContact NH1-OG1 3.3Å; D571-T573 PolarHBondContact O-N 2.93Å; D571-T573 PolarHBondContact O-OG1 3Å
574	A	70.9	Confident	68.9	Low	0 Å²	0	77 Å²	77	0%	0	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.6	151.6	-176.2	0	0	0	0	0	111.2	C564 C565 F572 D576 A579 L580	C564-A574 CarbonylContact C-O 3.54Å; C564-A574 WeakPolarHBondContact CA-O 3.29Å; C564-A574 WeakPolarHBondContact CB-O 3.39Å; C565-A574 PolarHBondContact N-O 3.42Å; C565-A574 PolarHBondContact O-N 3.36Å; F572-A574 HydrophobicContact CD1-CB 4.36Å; F572-A574 HydrophobicContact CE1-CB 3.75Å; A574-D576 VanDerWaalsContact C-N 3.29Å; A574-D576 PolarHBondContact O-N 3.24Å; A574-A579 HydrophobicContact CB-CB 4.04Å; A574-L580 HydrophobicContact CB-CB 3.73Å; A574-L580 VanDerWaalsContact CB-N 3.3Å
575	P	59.4	Low	69.9	Low	88 Å²	88	78.4 Å²	78.4	57%	0.571	41%	0.41	S	S	*	.	S	Bend	trans	-68.9	-26.4	177.3	28.4	-35.2	0	0	0	113.4	A579	P575-A579 HydrophobicContact CG-CB 4.38Å
576	D	63.4	Low	70.7	Confident	61 Å²	61	79 Å²	79	33%	0.326	42%	0.415	S	S	.	.	S	Bend	trans	-146.4	178.5	-176.2	80.8	-58.9	0	0	0	112	A574 S578 A579 L580	A574-D576 VanDerWaalsContact C-N 3.29Å; A574-D576 PolarHBondContact O-N 3.24Å; D576-S578 WeakPolarHBondContact OD2-CA 2.99Å; D576-S578 VanDerWaalsContact OD2-CB 3.23Å; D576-S578 WeakPolarHBondContact OD2-CB 3.3Å; D576-S578 PolarHBondContact OD2-N 2.97Å; D576-S578 PolarHBondContact OD2-OG 3.45Å; D576-A579 WeakPolarHBondContact OD1-CB 3.28Å; D576-A579 PolarHBondContact OD1-N 3.12Å; D576-A579 VanDerWaalsContact OD1-N 3.12Å; D576-L580 PolarHBondContact O-N 2.93Å; D576-L580 VanDerWaalsContact O-N 3.16Å
577	S	67.4	Low	71	Confident	89 Å²	89	75.2 Å²	75.2	62%	0.622	41%	0.412	S	S	*	.	H	α-helix	trans	-74.6	-26.2	-179	52	0	0	0	0	114.1	L581	S577-L581 WeakPolarHBondContact O-CB 3.33Å; S577-L581 PolarHBondContact O-N 3.34Å
578	S	72.4	Confident	71.4	Confident	79 Å²	79	77.9 Å²	77.9	55%	0.552	42%	0.423	S	S	*	.	H	α-helix	trans	-74	-46.5	176.8	74.8	0	0	0	0	111.2	D576 L580 L581 D582	D576-S578 WeakPolarHBondContact OD2-CA 2.99Å; D576-S578 VanDerWaalsContact OD2-CB 3.23Å; D576-S578 WeakPolarHBondContact OD2-CB 3.3Å; D576-S578 PolarHBondContact OD2-N 2.97Å; D576-S578 PolarHBondContact OD2-OG 3.45Å; S578-L580 VanDerWaalsContact C-N 3.28Å; S578-L580 PolarHBondContact O-N 3.3Å; S578-L581 PolarHBondContact O-N 3.44Å; S578-L581 VanDerWaalsContact O-N 3.13Å; S578-D582 WeakPolarHBondContact O-CB 3.5Å; S578-D582 PolarHBondContact O-N 3.33Å
579	A	73.6	Confident	71.3	Confident	32 Å²	32	70.6 Å²	70.6	26%	0.264	41%	0.407	S	S	.	.	H	α-helix	trans	-66.8	-27.7	174.1	0	0	0	0	0	112.7	A574 P575 D576 H583	A574-A579 HydrophobicContact CB-CB 4.04Å; P575-A579 HydrophobicContact CG-CB 4.38Å; D576-A579 WeakPolarHBondContact OD1-CB 3.28Å; D576-A579 PolarHBondContact OD1-N 3.12Å; D576-A579 VanDerWaalsContact OD1-N 3.12Å; A579-H583 WeakPolarHBondContact O-CB 3.47Å; A579-H583 PolarHBondContact O-N 3.42Å
580	L	76.7	Confident	70.8	Confident	38 Å²	38	72.2 Å²	72.2	20%	0.199	42%	0.415	C	S	.	.	H	α-helix	trans	-68.9	-42	169.9	179.2	59.1	0	0	0	111.6	C565 C567 A574 D576 S578 H583 F584	C565-L580 HydrophobicContact CB-CB 3.88Å; C565-L580 HydrophobicContact CB-CD2 3.61Å; C565-L580 HydrophobicContact CB-CG 4.31Å; C567-L580 HydrophobicContact CB-CD1 3.75Å; A574-L580 HydrophobicContact CB-CB 3.73Å; A574-L580 VanDerWaalsContact CB-N 3.3Å; D576-L580 PolarHBondContact O-N 2.93Å; D576-L580 VanDerWaalsContact O-N 3.16Å; S578-L580 VanDerWaalsContact C-N 3.28Å; S578-L580 PolarHBondContact O-N 3.3Å; L580-H583 PolarHBondContact O-N 3.08Å; L580-F584 WeakPolarHBondContact O-CB 3.23Å; L580-F584 PolarHBondContact O-N 2.79Å
581	L	75.7	Confident	69.2	Low	101 Å²	101	77 Å²	77	53%	0.529	44%	0.438	S	S	.	.	H	α-helix	trans	-68.5	-40.1	-179.9	-174.4	60.1	0	0	0	111.3	S577 S578 F584 N585	S577-L581 WeakPolarHBondContact O-CB 3.33Å; S577-L581 PolarHBondContact O-N 3.34Å; S578-L581 PolarHBondContact O-N 3.44Å; S578-L581 VanDerWaalsContact O-N 3.13Å; L581-F584 PolarHBondContact O-N 2.95Å; L581-N585 WeakPolarHBondContact O-CB 3.31Å; L581-N585 PolarHBondContact O-N 2.83Å; L581-N585 PolarHBondContact O-ND2 3.26Å; L581-N585 PolarHBondContact O-OD1 2.64Å
582	D	78.1	Confident	67.6	Low	110 Å²	110	75 Å²	75	59%	0.588	44%	0.438	S	S	*	.	H	α-helix	trans	-65	-42.2	174.2	-169.8	52.8	0	0	0	111.8	S578 N585 S586	S578-D582 WeakPolarHBondContact O-CB 3.5Å; S578-D582 PolarHBondContact O-N 3.33Å; D582-N585 PolarHBondContact O-N 3.26Å; D582-S586 VanDerWaalsContact O-CB 3.31Å; D582-S586 WeakPolarHBondContact O-CB 3.45Å; D582-S586 PolarHBondContact O-N 2.63Å; D582-S586 PolarHBondContact O-OG 2.91Å
583	H	82.8	Confident	65.8	Low	22 Å²	22	73.2 Å²	73.2	10%	0.102	44%	0.437	C	S	.	.	H	α-helix	trans	-59.5	-45	168.9	164.7	75.7	0	0	0	112.4	C570 F572 A579 L580 N585 S586 A587 H588	C570-H583 VanDerWaalsContact SG-CE1 3.56Å; C570-H583 PolarHBondContact SG-NE2 2.7Å; C570-H583 VanDerWaalsContact SG-NE2 3.37Å; F572-H583 WeakPolarHBondContact CB-CE1 3.49Å; F572-H583 WeakPolarHBondContact CB-NE2 3.47Å; F572-H583 HydrophobicContact CD1-CB 3.68Å; F572-H583 AromaticContact CD1-CD2 3.42Å; F572-H583 VanDerWaalsContact CD1-CD2 3.42Å; F572-H583 WeakPolarHBondContact CD1-CD2 3.18Å; F572-H583 AromaticContact CD1-CE1 3.79Å; F572-H583 AromaticContact CD1-CG 3.16Å; F572-H583 AromaticContact CD1-ND1 3.42Å; F572-H583 WeakPolarHBondContact CD1-ND1 3.46Å; F572-H583 AromaticContact CD1-NE2 3.8Å; F572-H583 AromaticContact CD2-ND1 3.92Å; F572-H583 HydrophobicContact CE1-CB 3.45Å; F572-H583 VanDerWaalsContact CE1-CB 3.45Å; F572-H583 AromaticContact CE1-CG 3.49Å; F572-H583 VanDerWaalsContact CE1-CG 3.49Å; F572-H583 AromaticContact CE1-ND1 3.84Å; F572-H583 AromaticContact CG-CD2 3.93Å; F572-H583 AromaticContact CG-CE1 3.51Å; F572-H583 AromaticContact CG-CG 3.71Å; F572-H583 AromaticContact CG-ND1 3.45Å; F572-H583 WeakPolarHBondContact CG-ND1 3.46Å; F572-H583 AromaticContact CG-NE2 3.8Å; F572-H583 HydrophobicContact CZ-CB 4.22Å; A579-H583 WeakPolarHBondContact O-CB 3.47Å; A579-H583 PolarHBondContact O-N 3.42Å; L580-H583 PolarHBondContact O-N 3.08Å; H583-N585 VanDerWaalsContact C-N 3.34Å; H583-N585 PolarHBondContact O-N 3Å; H583-S586 WeakPolarHBondContact CA-OG 3.41Å; H583-S586 PolarHBondContact O-N 3.36Å; H583-S586 PolarHBondContact O-OG 2.84Å; H583-A587 VanDerWaalsContact CE1-CB 3.47Å; H583-A587 WeakPolarHBondContact CE1-CB 3.5Å; H583-A587 WeakPolarHBondContact O-CA 3.48Å; H583-A587 WeakPolarHBondContact O-CB 3.29Å; H583-A587 PolarHBondContact O-N 2.68Å; H583-H588 AromaticContact NE2-CD2 3.82Å; H583-H588 AromaticContact NE2-NE2 3.45Å; H583-H588 PolarHBondContact NE2-NE2 3.49Å
584	F	73.4	Confident	65.1	Low	72 Å²	72	73.6 Å²	73.6	32%	0.316	44%	0.44	S	S	.	.	H	α-helix	trans	-63	-42.7	180	178.8	-95.5	0	0	0	111.1	H569 L580 L581 H588 C589	H569-F584 AromaticContact CD2-CE2 3.73Å; H569-F584 AromaticContact NE2-CE2 3.93Å; L580-F584 WeakPolarHBondContact O-CB 3.23Å; L580-F584 PolarHBondContact O-N 2.79Å; L581-F584 PolarHBondContact O-N 2.95Å; F584-H588 HydrophobicContact CD2-CB 4.19Å; F584-H588 HydrophobicContact CE2-CB 4.3Å; F584-H588 CarbonylContact O-C 3.57Å; F584-H588 WeakPolarHBondContact O-CA 3.24Å; F584-H588 WeakPolarHBondContact O-CB 3.44Å; F584-H588 PolarHBondContact O-N 2.65Å; F584-C589 PolarHBondContact O-N 3.23Å; F584-C589 VanDerWaalsContact O-N 3.13Å
585	N	76.7	Confident	63.2	Low	75 Å²	75	78.8 Å²	78.8	40%	0.401	48%	0.477	S	S	.	.	H	α-helix	trans	-65.4	-47	176.7	-65.4	-19.2	0	0	0	111.5	L581 D582 H583 C589 Q590	L581-N585 WeakPolarHBondContact O-CB 3.31Å; L581-N585 PolarHBondContact O-N 2.83Å; L581-N585 PolarHBondContact O-ND2 3.26Å; L581-N585 PolarHBondContact O-OD1 2.64Å; D582-N585 PolarHBondContact O-N 3.26Å; H583-N585 VanDerWaalsContact C-N 3.34Å; H583-N585 PolarHBondContact O-N 3Å; N585-C589 CarbonylContact O-C 3.55Å; N585-C589 VanDerWaalsContact O-CA 3.28Å; N585-C589 WeakPolarHBondContact O-CA 3.4Å; N585-C589 WeakPolarHBondContact O-CB 3.19Å; N585-C589 PolarHBondContact O-N 3.29Å; N585-C589 VanDerWaalsContact O-N 3.12Å; N585-Q590 PolarHBondContact O-N 3.25Å
586	S	77.8	Confident	62	Low	55 Å²	55	82.9 Å²	82.9	39%	0.385	49%	0.493	S	S	.	.	H	α-helix	trans	-77.8	-33.7	-176	58.7	0	0	0	0	114.8	D582 H583 Q590	D582-S586 VanDerWaalsContact O-CB 3.31Å; D582-S586 WeakPolarHBondContact O-CB 3.45Å; D582-S586 PolarHBondContact O-N 2.63Å; D582-S586 PolarHBondContact O-OG 2.91Å; H583-S586 WeakPolarHBondContact CA-OG 3.41Å; H583-S586 PolarHBondContact O-N 3.36Å; H583-S586 PolarHBondContact O-OG 2.84Å; S586-Q590 PolarHBondContact O-NE2 2.94Å
587	A	68.1	Low	60.3	Low	55 Å²	55	83.6 Å²	83.6	46%	0.455	52%	0.515	S	S	.	.	H	α-helix	trans	-101.8	-18.1	-176.4	0	0	0	0	0	114.2	H583	H583-A587 VanDerWaalsContact CE1-CB 3.47Å; H583-A587 WeakPolarHBondContact CE1-CB 3.5Å; H583-A587 WeakPolarHBondContact O-CA 3.48Å; H583-A587 WeakPolarHBondContact O-CB 3.29Å; H583-A587 PolarHBondContact O-N 2.68Å
588	H	74.2	Confident	58.6	Low	69 Å²	69	85.3 Å²	85.3	32%	0.319	53%	0.527	S	S	.	.	H	α-helix	trans	-130.9	-4.1	-177.3	-56.1	-47.2	0	0	0	114.6	C567 H569 C570 H583 F584	C567-H588 PolarHBondContact SG-CD2 3.4Å; C567-H588 PolarHBondContact SG-NE2 2.91Å; H569-H588 WeakPolarHBondContact CB-NE2 3.49Å; C570-H588 PolarHBondContact SG-NE2 3.4Å; C570-H588 VanDerWaalsContact SG-NE2 3.39Å; H583-H588 AromaticContact NE2-CD2 3.82Å; H583-H588 AromaticContact NE2-NE2 3.45Å; H583-H588 PolarHBondContact NE2-NE2 3.49Å; F584-H588 HydrophobicContact CD2-CB 4.19Å; F584-H588 HydrophobicContact CE2-CB 4.3Å; F584-H588 CarbonylContact O-C 3.57Å; F584-H588 WeakPolarHBondContact O-CA 3.24Å; F584-H588 WeakPolarHBondContact O-CB 3.44Å; F584-H588 PolarHBondContact O-N 2.65Å
589	C	65.9	Low	56.6	Low	84 Å²	84	90 Å²	90	57%	0.568	54%	0.54	S	S	*	.			trans	-130.4	28.7	-179.6	-133.7	0	0	0	0	113.9	F584 N585 D591	F584-C589 PolarHBondContact O-N 3.23Å; F584-C589 VanDerWaalsContact O-N 3.13Å; N585-C589 CarbonylContact O-C 3.55Å; N585-C589 VanDerWaalsContact O-CA 3.28Å; N585-C589 WeakPolarHBondContact O-CA 3.4Å; N585-C589 WeakPolarHBondContact O-CB 3.19Å; N585-C589 PolarHBondContact O-N 3.29Å; N585-C589 VanDerWaalsContact O-N 3.12Å; C589-D591 PolarHBondContact O-N 2.79Å
590	Q	53	Low	55.2	Low	162 Å²	162	93.1 Å²	93.1	76%	0.757	56%	0.557	S	S	*	*			trans	-79.9	103.5	161.1	-76.5	-172.1	65.6	0	0	109.7	N585 S586	N585-Q590 PolarHBondContact O-N 3.25Å; S586-Q590 PolarHBondContact O-NE2 2.94Å
591	D	42.2	Very low	53.1	Low	154 Å²	154	96.4 Å²	96.4	82%	0.824	58%	0.579	S	S	*	*			trans	-72.2	173.4	159.5	-126.8	-39.5	0	0	0	110.4	C589	C589-D591 PolarHBondContact O-N 2.79Å
592	A	35.2	Very low	51	Low	82 Å²	82	98.4 Å²	98.4	68%	0.678	59%	0.59	S	S	*	*			trans	73.4	131.9	-170.9	0	0	0	0	0	115.2
593	S	27.2	Very low	48.7	Very low	54 Å²	54	100.3 Å²	100.3	38%	0.378	60%	0.597	S	S	.	*			cis	71.7	110.3	-11.2	-41.9	0	0	0	0	118.1	W692 V693	S593-W692 CarbonylContact C-O 3.59Å; S593-W692 VanDerWaalsContact C-O 3.29Å; S593-W692 WeakPolarHBondContact CB-O 3.47Å; S593-W692 VanDerWaalsContact O-O 3.11Å; S593-V693 VanDerWaalsContact OG-CG1 3.28Å; S593-V693 WeakPolarHBondContact OG-CG1 3.06Å; S593-V693 WeakPolarHBondContact OG-CG2 3.4Å
594	P	54.1	Low	46.5	Very low	63 Å²	63	105.1 Å²	105.1	41%	0.409	63%	0.628	S	S	.	*			cis	-126	-177.5	-32.3	46.5	-36.4	0	0	0	112	W692 V693 P694	P594-W692 WeakPolarHBondContact CD-O 3.39Å; P594-V693 HydrophobicContact CB-CG1 4.42Å; P594-V693 VanDerWaalsContact CG-O 3.3Å; P594-V693 WeakPolarHBondContact CG-O 3.47Å; P594-P694 VanDerWaalsContact CB-O 3.29Å; P594-P694 WeakPolarHBondContact CB-O 3.28Å
595	S	30.6	Very low	44.7	Very low	110 Å²	110	107.3 Å²	107.3	77%	0.769	65%	0.649	S	S	*	*				169.7	173.4	115.9	51.9	0	0	0	0	113
596	L	32.9	Very low	42.4	Very low	174 Å²	174	108.4 Å²	108.4	91%	0.911	66%	0.663	S	S	*	*			trans	-64.1	150.5	-170	-69.4	59.3	0	0	0	112.1
597	G	28.7	Very low	40.2	Very low	76 Å²	76	114 Å²	114	78%	0.784	69%	0.687	S	S	*	*			cis	149.2	124	10.2	0	0	0	0	0	111.6
598	S	31.1	Very low	38.3	Very low	125 Å²	125	115 Å²	115	87%	0.874	70%	0.696	S	S	*	*			trans	-160.8	134.6	156.6	54	0	0	0	0	111.2
599	Q	31	Very low	35.9	Very low	177 Å²	177	119.3 Å²	119.3	83%	0.827	72%	0.72	S	S	*	*			trans	-117.4	164.3	165.9	-94.3	-91.6	-46.8	0	0	107
600	P	44.1	Very low	34.1	Very low	98 Å²	98	121 Å²	121	64%	0.636	73%	0.733	S	S	*	*			cis	-117.1	-147.4	18.3	28.1	-3.2	0	0	0	111
601	T	33.2	Very low	33	Very low	107 Å²	107	118 Å²	118	66%	0.656	74%	0.737	S	S	*	*			cis	-158.8	149.3	12.1	-20.4	0	0	0	0	113.6
602	L	31.1	Very low	32.5	Very low	143 Å²	143	119 Å²	119	75%	0.749	74%	0.742	S	S	*	*			trans	10.1	111.3	141.6	-80.6	163.7	0	0	0	119.6
603	M	29.9	Very low	32.1	Very low	150 Å²	150	118.7 Å²	118.7	74%	0.739	75%	0.747	S	S	*	*				165.4	131.5	92	-88.3	-105.8	76.7	0	0	113.1
604	T	35	Very low	32.1	Very low	122 Å²	122	122.2 Å²	122.2	75%	0.748	77%	0.77	S	S	*	*			trans	-116.8	139.8	153.3	-21	0	0	0	0	108
605	P	37.7	Very low	30.9	Very low	118 Å²	118	125.1 Å²	125.1	77%	0.766	79%	0.792	S	S	*	*			trans	-111.2	142.5	143.5	33.9	-28.6	0	0	0	110.4
606	S	28.1	Very low	30.8	Very low	99 Å²	99	124.2 Å²	124.2	69%	0.692	79%	0.791	S	S	*	*			trans	-92.2	-178.7	174.9	-56	0	0	0	0	111.2
607	L	30	Very low	31.1	Very low	171 Å²	171	121.2 Å²	121.2	90%	0.895	78%	0.782	S	S	*	*			trans	80.7	151.8	165.6	-47.7	178.4	0	0	0	115.8
608	A	28.2	Very low	31.1	Very low	76 Å²	76	122.6 Å²	122.6	63%	0.628	78%	0.779	S	S	*	*			cis	-169.8	167.3	-25.9	0	0	0	0	0	110.3
609	L	25.4	Very low	31.1	Very low	160 Å²	160	122.1 Å²	122.1	84%	0.838	77%	0.771	S	S	*	*			trans	62	118.8	160	-94.2	70.8	0	0	0	120.1
610	S	27.9	Very low	31.1	Very low	119 Å²	119	121.5 Å²	121.5	83%	0.832	77%	0.773	S	S	*	*				36.9	115.2	126.5	-51.4	0	0	0	0	121.5
611	A	29.4	Very low	30.5	Very low	101 Å²	101	121 Å²	121	84%	0.835	78%	0.777	S	S	*	*			trans	-148.4	141.1	131.3	0	0	0	0	0	110.3
612	N	31.5	Very low	30.5	Very low	174 Å²	174	123.7 Å²	123.7	93%	0.93	79%	0.785	S	S	*	*			trans	-78.7	139.7	168.9	-72.2	-24.8	0	0	0	109.5
613	G	28.1	Very low	30.4	Very low	76 Å²	76	124 Å²	124	78%	0.784	78%	0.781	S	S	*	*			trans	-153.9	81.4	179.5	0	0	0	0	0	111.9	S615	G613-S615 PolarHBondContact O-N 3.15Å
614	C	25.8	Very low	30.6	Very low	127 Å²	127	123.3 Å²	123.3	86%	0.858	78%	0.776	S	S	*	*			trans	-71.7	125.1	176.4	-57.9	0	0	0	0	110.9
615	S	29.6	Very low	30.8	Very low	125 Å²	125	126 Å²	126	87%	0.874	78%	0.78	S	S	*	*			trans	-172.3	111.4	143.3	-104.4	0	0	0	0	111.9	G613	G613-S615 PolarHBondContact O-N 3.15Å
616	A	28.2	Very low	30.7	Very low	90 Å²	90	126 Å²	126	74%	0.744	78%	0.783	S	S	*	*			trans	-75.3	167.7	145.9	0	0	0	0	0	107.8
617	P	40.3	Very low	31.2	Very low	112 Å²	112	131.7 Å²	131.7	73%	0.727	80%	0.795	S	S	*	*			cis	-143.4	-170.2	36.1	42.6	-22	0	0	0	115.8
618	S	28.8	Very low	31.1	Very low	104 Å²	104	126.9 Å²	126.9	73%	0.727	79%	0.787	S	S	*	*			trans	50.2	140.1	141.1	-65.7	0	0	0	0	121.1
619	T	30.8	Very low	31.3	Very low	115 Å²	115	130 Å²	130	71%	0.706	79%	0.793	S	S	*	*			cis	-167.2	156.4	10.4	7.5	0	0	0	0	111.3
620	L	30.6	Very low	31.6	Very low	164 Å²	164	130.5 Å²	130.5	86%	0.859	80%	0.795	S	S	*	*			trans	28.2	116.7	142.9	-59.1	168.3	0	0	0	121.5
621	A	31	Very low	31.8	Very low	88 Å²	88	135 Å²	135	73%	0.727	79%	0.794	S	S	*	*			trans	179.6	131.6	134.5	0	0	0	0	0	107.9
622	I	33.2	Very low	32	Very low	163 Å²	163	137.2 Å²	137.2	84%	0.836	79%	0.791	S	S	*	*				61.1	129.3	60.4	-55.4	168.4	0	0	0	111.3
623	K	28.5	Very low	31.9	Very low	149 Å²	149	136 Å²	136	65%	0.648	78%	0.784	S	S	*	*			cis	-178.7	160.2	-17.2	173.8	174.5	164.1	-101.6	0	105.6
624	E	35.3	Very low	31.8	Very low	137 Å²	137	141.5 Å²	141.5	64%	0.64	78%	0.782	S	S	*	*			trans	66.1	138.6	171.3	-81.5	142.6	163.4	0	0	115.6
625	E	38.6	Very low	32.2	Very low	178 Å²	178	140.4 Å²	140.4	83%	0.832	78%	0.776	S	S	*	*			cis	109.5	111.8	32.8	-82.5	-134.6	126.3	0	0	111.7
626	S	35.7	Very low	32.1	Very low	118 Å²	118	142.4 Å²	142.4	83%	0.825	78%	0.776	S	S	*	*			trans	167.6	133.4	155.7	35.4	0	0	0	0	106.7
627	K	39.4	Very low	32.1	Very low	219 Å²	219	142.6 Å²	142.6	95%	0.952	78%	0.777	S	S	*	*			cis	80.2	102.2	20.8	-157.7	178.4	-178.1	178.8	0	115.2
628	G	27.6	Very low	33	Very low	70 Å²	70	142.5 Å²	142.5	72%	0.722	78%	0.777	S	S	*	*			trans	162.5	91.7	175.3	0	0	0	0	0	106.8
629	D	32.8	Very low	33.8	Very low	142 Å²	142	143.1 Å²	143.1	76%	0.759	78%	0.778	S	S	*	*				67.7	114.5	66.9	-169.7	25.5	0	0	0	113.3
630	L	30.6	Very low	33.6	Very low	169 Å²	169	146.5 Å²	146.5	89%	0.885	79%	0.786	S	S	*	*			trans	-167.7	140.1	147.6	-107.6	159.2	0	0	0	110.3
631	R	31.8	Very low	33.5	Very low	214 Å²	214	141.9 Å²	141.9	81%	0.808	78%	0.779	S	S	*	*			trans	-96.5	166.6	-178.4	-58.4	156.5	88.2	165.7	5.6	109.9
632	L	33.5	Very low	33.4	Very low	148 Å²	148	148.9 Å²	148.9	78%	0.775	79%	0.786	S	S	*	*				171	122	116.4	-89.3	167.1	0	0	0	112.8
633	L	31.1	Very low	33.1	Very low	148 Å²	148	147.4 Å²	147.4	78%	0.775	78%	0.779	S	S	*	*			trans	61.2	162.3	145.7	-60.8	173.1	0	0	0	118.5
634	Y	25.9	Very low	33.1	Very low	192 Å²	192	144.5 Å²	144.5	75%	0.753	78%	0.783	S	S	*	*			cis	-139.2	157.7	8.5	-161.8	-93.2	0	0	0	110.5	L636	Y634-L636 HydrophobicContact CE1-CD2 4.23Å; Y634-L636 HydrophobicContact CE1-CG 4.41Å
635	S	33.3	Very low	32.9	Very low	103 Å²	103	147.6 Å²	147.6	72%	0.72	80%	0.797	S	S	*	*			trans	-113	147.2	179.4	-54	0	0	0	0	112
636	L	27.2	Very low	32.6	Very low	168 Å²	168	142.9 Å²	142.9	88%	0.88	80%	0.796	S	S	*	*			trans	-136.7	156.7	158.2	-76.9	-178.6	0	0	0	110.6	Y634	Y634-L636 HydrophobicContact CE1-CD2 4.23Å; Y634-L636 HydrophobicContact CE1-CG 4.41Å
637	A	28.2	Very low	32.7	Very low	93 Å²	93	140.7 Å²	140.7	77%	0.769	79%	0.792	S	S	*	*			trans	-131.7	-165.4	-160.7	0	0	0	0	0	110.8
638	P	60	Low	32.7	Very low	110 Å²	110	141 Å²	141	71%	0.714	79%	0.788	S	S	*	*			trans	-94.7	-173.2	-156.3	42.4	-42.5	0	0	0	115
639	P	44.4	Very low	33.3	Very low	117 Å²	117	144.9 Å²	144.9	76%	0.76	79%	0.787	S	S	*	*				-111	142.1	121.6	-7	26.7	0	0	0	110.6
640	E	27.3	Very low	33.9	Very low	186 Å²	186	145.8 Å²	145.8	87%	0.869	79%	0.786	S	S	*	*				60.8	131.8	62.1	-59.5	-166.1	159.9	0	0	114.1
641	G	28.2	Very low	35.2	Very low	68 Å²	68	143.7 Å²	143.7	70%	0.701	78%	0.783	S	S	*	*			cis	140	143.2	-11.7	0	0	0	0	0	114.2
642	R	29.3	Very low	35.6	Very low	234 Å²	234	136.7 Å²	136.7	88%	0.883	78%	0.777	S	S	*	*			trans	66.1	167.1	167.4	-64	-178.9	171.7	-117.6	1.1	115
643	L	25.7	Very low	36	Very low	133 Å²	133	133.1 Å²	133.1	70%	0.696	78%	0.777	S	S	*	*			cis	-161	162.8	-23.7	-110.6	173.1	0	0	0	111.1
644	A	28.9	Very low	36.4	Very low	87 Å²	87	132.5 Å²	132.5	72%	0.719	78%	0.779	S	S	*	*			trans	52.4	128.1	141.8	0	0	0	0	0	124.2
645	E	30.9	Very low	37.2	Very low	203 Å²	203	129.7 Å²	129.7	95%	0.949	78%	0.781	S	S	*	*				-143.2	155.5	122.8	-80.6	-164.5	100.7	0	0	106.6
646	G	32.2	Very low	37.3	Very low	78 Å²	78	133.8 Å²	133.8	80%	0.804	79%	0.786	S	S	*	*			cis	143.7	138	1.9	0	0	0	0	0	108.6
647	G	38.2	Very low	38	Very low	72 Å²	72	129.6 Å²	129.6	74%	0.742	77%	0.771	S	S	*	*			cis	176.9	-165.1	-3.1	0	0	0	0	0	108.6
648	R	40.2	Very low	38.6	Very low	227 Å²	227	134.6 Å²	134.6	86%	0.857	78%	0.778	S	S	*	*			trans	69.4	143.4	167.4	-80.7	-165.1	-167.1	-97.3	1.1	117.3
649	E	38.9	Very low	37.6	Very low	150 Å²	150	132.5 Å²	132.5	70%	0.701	78%	0.777	S	S	*	*			cis	-140.8	170.2	-7.5	-60.5	-146.5	108.6	0	0	113
650	E	46.6	Very low	37.1	Very low	161 Å²	161	132.9 Å²	132.9	75%	0.752	78%	0.777	S	S	*	*			trans	-46.1	156.6	154.7	-85.2	-69.3	131.8	0	0	113.5	G652	E650-G652 PolarHBondContact OE2-N 2.78Å
651	P	57.7	Low	37.9	Very low	125 Å²	125	132.8 Å²	132.8	81%	0.812	78%	0.776	S	S	*	*				-141.9	160.9	52.7	39.8	-21.2	0	0	0	118.5
652	G	40.4	Very low	38.5	Very low	67 Å²	67	136.6 Å²	136.6	69%	0.691	78%	0.776	S	S	*	*			trans	-80.7	172.4	168.4	0	0	0	0	0	115.8	E650	E650-G652 PolarHBondContact OE2-N 2.78Å
653	G	41.1	Very low	38.8	Very low	74 Å²	74	133.2 Å²	133.2	76%	0.763	77%	0.767	S	S	*	*			trans	162.6	75.8	174.9	0	0	0	0	0	119.1
654	V	39.6	Very low	39.2	Very low	135 Å²	135	134.4 Å²	134.4	82%	0.818	77%	0.77	S	S	*	*			trans	43.5	104.2	140.8	-176.7	0	0	0	0	121.2
655	V	42.5	Very low	39.4	Very low	132 Å²	132	139.2 Å²	139.2	80%	0.8	77%	0.769	S	S	*	*				50.6	119.6	127.6	-173.5	0	0	0	0	121.7
656	K	35.8	Very low	39.5	Very low	190 Å²	190	135.5 Å²	135.5	83%	0.826	75%	0.751	S	S	*	*				-167.7	151.9	114.9	-118.9	-172.6	176.7	-178.1	0	117.6
657	S	42	Very low	39.5	Very low	80 Å²	80	141 Å²	141	56%	0.559	75%	0.748	S	S	*	*			trans	-7.2	158.6	151.1	57.8	0	0	0	0	121.6
658	E	40.7	Very low	39.3	Very low	197 Å²	197	144.3 Å²	144.3	92%	0.921	74%	0.744	S	S	*	*			cis	-174.5	163.3	-11.4	-105.7	177.6	135.4	0	0	108
659	G	38.1	Very low	39.2	Very low	67 Å²	67	143.1 Å²	143.1	69%	0.691	75%	0.745	S	S	*	*			trans	138.7	118.1	149.2	0	0	0	0	0	120.2
660	V	35.2	Very low	38.9	Very low	125 Å²	125	139.4 Å²	139.4	76%	0.758	75%	0.747	S	S	*	*			trans	69.4	111	137.1	-175.1	0	0	0	0	120.7
661	E	44	Very low	37.9	Very low	183 Å²	183	143.9 Å²	143.9	86%	0.855	76%	0.757	S	S	*	*			trans	46.7	146.3	135.9	-54.7	179	137.7	0	0	121.5
662	E	41.2	Very low	36.7	Very low	148 Å²	148	142 Å²	142	69%	0.692	75%	0.753	S	S	*	*			cis	-153.4	167.2	6.6	-154.1	-139.7	138.7	0	0	111.2
663	K	35.5	Very low	36.1	Very low	163 Å²	163	145.7 Å²	145.7	71%	0.709	76%	0.756	S	S	*	*			trans	108.6	121.2	138.2	-146.1	168	-138.3	71.7	0	122.4
664	E	33.3	Very low	35.5	Very low	159 Å²	159	145.9 Å²	145.9	74%	0.743	76%	0.757	S	S	*	*			trans	-52.5	171	163.6	-82.9	-161	111.6	0	0	118
665	R	33.4	Very low	35	Very low	188 Å²	188	144.3 Å²	144.3	71%	0.709	74%	0.741	S	S	*	*			cis	-168.1	162.3	-12.2	167.8	167.3	176.6	-131.7	-9	112.4
666	E	31.9	Very low	34.5	Very low	124 Å²	124	143.7 Å²	143.7	58%	0.579	74%	0.738	S	S	*	*			trans	-20.7	152.2	170.3	-57.4	177.6	89.8	0	0	123.9
667	R	32.5	Very low	34.1	Very low	194 Å²	194	146.3 Å²	146.3	73%	0.732	74%	0.742	S	S	*	*				108.2	157.7	123	-103.8	175.8	172.6	-71.2	-12.9	121.9
668	E	35.2	Very low	33.2	Very low	141 Å²	141	146.1 Å²	146.1	66%	0.659	75%	0.753	S	S	*	*			trans	-66.8	134.8	-164.8	-54.8	162.5	75.6	0	0	115.2
669	K	37.2	Very low	33.2	Very low	203 Å²	203	143.4 Å²	143.4	88%	0.883	75%	0.753	S	S	*	*				173	115.5	111.4	-93.5	166.5	-178	177.3	0	114
670	G	32.7	Very low	32.6	Very low	72 Å²	72	143.7 Å²	143.7	74%	0.742	76%	0.755	S	S	*	*			trans	86.7	161.7	145.4	0	0	0	0	0	120.4
671	W	26	Very low	32.3	Very low	255 Å²	255	144 Å²	144	97%	0.966	75%	0.748	S	S	*	*			trans	70.4	131.4	157.4	-66.8	92	0	0	0	123.1
672	A	32	Very low	31.8	Very low	86 Å²	86	140.9 Å²	140.9	71%	0.711	73%	0.729	S	S	*	*			trans	77.3	110.1	135.3	0	0	0	0	0	122.8
673	L	28.6	Very low	31.1	Very low	144 Å²	144	137 Å²	137	75%	0.754	73%	0.728	S	S	*	*				55.4	128	113.9	-141.8	83.9	0	0	0	121.1
674	G	28.7	Very low	30.8	Very low	77 Å²	77	132.3 Å²	132.3	79%	0.794	73%	0.727	S	S	*	*			trans	173.2	123.9	162.7	0	0	0	0	0	113.4
675	E	28.7	Very low	30.6	Very low	103 Å²	103	132 Å²	132	48%	0.481	73%	0.725	S	S	.	*			trans	-92.9	160.2	-178.9	-59.7	-179	65.8	0	0	113.4	N470	N470-E675 PolarHBondContact ND2-OE1 2.88Å; N470-E675 PolarHBondContact ND2-OE2 2.8Å
676	T	31.3	Very low	30.6	Very low	119 Å²	119	130.7 Å²	130.7	73%	0.73	73%	0.727	S	S	*	*				176.4	137.9	101.8	31.5	0	0	0	0	116.7
677	R	27.5	Very low	30.5	Very low	244 Å²	244	128.5 Å²	128.5	92%	0.921	73%	0.73	S	S	*	*			trans	73.5	139.4	149.3	-70.8	176.7	169.6	175.4	-3.3	121.5
678	G	24.3	Very low	30.2	Very low	76 Å²	76	128.2 Å²	128.2	78%	0.784	74%	0.737	S	S	*	*			trans	-104.3	-129.2	178	0	0	0	0	0	113.1
679	P	40.9	Very low	29.9	Very low	141 Å²	141	124.7 Å²	124.7	92%	0.916	74%	0.738	S	S	*	*			cis	-136.6	-177.1	15.9	43.1	-25.6	0	0	0	116.6
680	G	25.1	Very low	29.8	Very low	72 Å²	72	122.6 Å²	122.6	74%	0.742	74%	0.736	S	S	*	*			trans	166.8	92.4	164.1	0	0	0	0	0	121.3
681	E	29.3	Very low	29.7	Very low	131 Å²	131	125.5 Å²	125.5	61%	0.612	73%	0.733	S	S	*	*			trans	49.4	122.1	133.7	-63	-104.2	71.6	0	0	125.9
682	R	32.5	Very low	29.6	Very low	119 Å²	119	122.3 Å²	122.3	45%	0.449	72%	0.721	S	S	.	*			trans	68.5	125.7	138.4	-55.7	170.7	-160.2	-134.6	17.9	124.5	L930 L931	R682-L930 WeakPolarHBondContact CD-O 3.19Å; R682-L930 WeakPolarHBondContact CG-O 3.48Å; R682-L930 PolarHBondContact NE-O 3.47Å; R682-L930 PolarHBondContact NH1-O 3.16Å; R682-L931 HydrophobicContact CG-CD2 4.47Å; R682-L931 HydrophobicContact CG-CG 4.25Å; R682-L931 VanDerWaalsContact CZ-CD1 3.44Å
683	G	26.9	Very low	29.7	Very low	65 Å²	65	121.9 Å²	121.9	67%	0.67	71%	0.71	S	S	*	*			trans	172	161.9	160.4	0	0	0	0	0	111.7	L930	G683-L930 VanDerWaalsContact C-CD1 3.41Å; G683-L930 WeakPolarHBondContact O-CD1 3.4Å
684	G	28.9	Very low	30.7	Very low	66 Å²	66	119.6 Å²	119.6	68%	0.68	70%	0.703	S	S	*	*			cis	-174.8	174.2	-4	0	0	0	0	0	111.1
685	E	29.4	Very low	30.7	Very low	152 Å²	152	123.5 Å²	123.5	71%	0.71	70%	0.699	S	S	*	*			trans	-145.9	155.8	-171.7	-99.1	-166.1	91.3	0	0	116.9
686	Q	32.1	Very low	31	Very low	161 Å²	161	124.4 Å²	124.4	75%	0.752	70%	0.703	S	S	*	*			trans	66	119.7	148.2	-72.9	-171.6	50.9	0	0	126.3
687	A	30.3	Very low	31.3	Very low	78 Å²	78	127 Å²	127	65%	0.645	70%	0.699	S	S	*	*				80.8	129.6	116.2	0	0	0	0	0	126.5
688	H	26	Very low	31.4	Very low	188 Å²	188	123.8 Å²	123.8	87%	0.87	70%	0.696	S	S	*	*			trans	58.8	122.8	138.4	-81.7	-109.8	0	0	0	125
689	G	29	Very low	31.6	Very low	66 Å²	66	122.9 Å²	122.9	68%	0.68	69%	0.688	S	S	*	*				127.2	102.8	102.5	0	0	0	0	0	124.9
690	L	35.3	Very low	32.6	Very low	160 Å²	160	121 Å²	121	84%	0.838	68%	0.675	S	S	*	*				75.9	152	125.3	-62.8	174.5	0	0	0	126.8
691	L	30.2	Very low	33	Very low	133 Å²	133	122.8 Å²	122.8	70%	0.696	66%	0.664	S	S	*	*			trans	90.6	159.1	155.2	-60.8	133.3	0	0	0	120.2
692	W	24.3	Very low	33.2	Very low	188 Å²	188	123.3 Å²	123.3	71%	0.712	66%	0.661	S	S	*	*			cis	-157.7	162.5	29.4	-118.3	107.4	0	0	0	118.1	S593 P594	S593-W692 CarbonylContact C-O 3.59Å; S593-W692 VanDerWaalsContact C-O 3.29Å; S593-W692 WeakPolarHBondContact CB-O 3.47Å; S593-W692 VanDerWaalsContact O-O 3.11Å; P594-W692 WeakPolarHBondContact CD-O 3.39Å
693	V	35	Very low	33.2	Very low	77 Å²	77	121.4 Å²	121.4	47%	0.467	66%	0.662	S	S	.	*			trans	-54.5	-178.9	159.8	-115.2	0	0	0	0	116.4	S593 P594	S593-V693 VanDerWaalsContact OG-CG1 3.28Å; S593-V693 WeakPolarHBondContact OG-CG1 3.06Å; S593-V693 WeakPolarHBondContact OG-CG2 3.4Å; P594-V693 HydrophobicContact CB-CG1 4.42Å; P594-V693 VanDerWaalsContact CG-O 3.3Å; P594-V693 WeakPolarHBondContact CG-O 3.47Å
694	P	48.3	Very low	33.5	Very low	95 Å²	95	122.6 Å²	122.6	62%	0.617	67%	0.666	S	S	*	*			cis	-132	-141.8	6.4	44.1	-22.6	0	0	0	114.5	P594	P594-P694 VanDerWaalsContact CB-O 3.29Å; P594-P694 WeakPolarHBondContact CB-O 3.28Å
695	K	28.8	Very low	33.5	Very low	160 Å²	160	126.6 Å²	126.6	70%	0.696	67%	0.667	S	S	*	*				-165.7	143.2	-91.3	179.9	162.9	157.7	48.6	0	115.5
696	E	35.6	Very low	33.6	Very low	121 Å²	121	129.8 Å²	129.8	57%	0.565	67%	0.672	S	S	*	*			trans	89.5	179.1	152	-109.8	171.8	-108.4	0	0	124.2
697	R	36.5	Very low	33.3	Very low	175 Å²	175	125.7 Å²	125.7	66%	0.66	67%	0.673	S	S	*	*			cis	-122.8	-147.8	33.9	-135.6	88.9	-100	178.1	-1.4	115.2
698	M	29.9	Very low	33.3	Very low	175 Å²	175	127.2 Å²	127.2	86%	0.862	69%	0.686	S	S	*	*			cis	-146.9	-112.3	15.3	-167.5	52.1	86.5	0	0	116.6
699	G	30.2	Very low	33.4	Very low	58 Å²	58	122.3 Å²	122.3	60%	0.598	69%	0.686	S	S	*	*			trans	171.2	-152.8	-167.8	0	0	0	0	0	113.1
700	P	61.6	Low	33.4	Very low	101 Å²	101	123.3 Å²	123.3	66%	0.656	70%	0.696	S	S	*	*			cis	-149.4	177.6	-9	48.4	-29.3	0	0	0	118.2
701	E	33.1	Very low	33	Very low	110 Å²	110	119.4 Å²	119.4	51%	0.514	70%	0.695	S	S	.	*			trans	61.5	153.5	148.3	-51.8	-101.2	137	0	0	124.9	R907	E701-R907 IonicContact OE1-CZ 2.63Å; E701-R907 IonicContact OE1-NE 2.65Å; E701-R907 IonicContact OE1-NH1 2.68Å; E701-R907 PolarHBondContact OE1-NH1 2.81Å
702	R	34.1	Very low	33.1	Very low	141 Å²	141	119 Å²	119	53%	0.532	70%	0.703	S	S	.	*			cis	-161.5	144.5	-31.3	-107.5	-153.3	-138.8	-117.3	-5.5	118.8	S906	R702-S906 VanDerWaalsContact CA-OG 3.28Å; R702-S906 WeakPolarHBondContact CA-OG 3.13Å
703	V	31.8	Very low	33.6	Very low	80 Å²	80	114.7 Å²	114.7	49%	0.485	70%	0.699	S	S	.	*			trans	54.4	117.5	135.2	177.7	0	0	0	0	127.7	S906	V703-S906 WeakPolarHBondContact CG2-OG 3.49Å; V703-S906 PolarHBondContact N-OG 3.01Å; V703-S906 VanDerWaalsContact N-OG 3.14Å
704	A	32.7	Very low	33.3	Very low	90 Å²	90	116.9 Å²	116.9	74%	0.744	72%	0.718	S	S	*	*			trans	55.2	163.9	130.3	0	0	0	0	0	124.9
705	E	30.1	Very low	32.3	Very low	150 Å²	150	119.5 Å²	119.5	70%	0.701	73%	0.726	S	S	*	*			cis	-161.7	164.4	3.6	-135.2	-84.4	87.4	0	0	113.2
706	R	30.2	Very low	32.5	Very low	218 Å²	218	121.1 Å²	121.1	82%	0.823	73%	0.734	S	S	*	*			trans	69.2	130.9	166.9	-56.2	-166.9	177.3	-167.7	-0.5	123.1
707	G	26.6	Very low	32.8	Very low	75 Å²	75	120.8 Å²	120.8	77%	0.773	74%	0.742	S	S	*	*			trans	155.7	56.3	150.5	0	0	0	0	0	123.1
708	A	29.8	Very low	32.5	Very low	110 Å²	110	117.4 Å²	117.4	91%	0.909	75%	0.745	S	S	*	*			trans	59.6	138.6	157.2	0	0	0	0	0	122.5
709	G	28.6	Very low	33.1	Very low	85 Å²	85	114.1 Å²	114.1	88%	0.876	74%	0.737	S	S	*	*			trans	84.7	140.8	170.6	0	0	0	0	0	115
710	G	28.6	Very low	32.9	Very low	87 Å²	87	119 Å²	119	90%	0.897	75%	0.748	S	S	*	*			cis	156.5	81.6	-4.7	0	0	0	0	0	111.8
711	G	27.9	Very low	31.2	Very low	78 Å²	78	118.8 Å²	118.8	80%	0.804	75%	0.749	S	S	*	*			trans	-167.8	107.2	-174.3	0	0	0	0	0	114.5
712	S	31.3	Very low	30.8	Very low	125 Å²	125	121 Å²	121	87%	0.874	76%	0.764	S	S	*	*			trans	-51.9	168.4	-173.7	-63	0	0	0	0	118.8
713	P	34.7	Very low	30.4	Very low	98 Å²	98	119.4 Å²	119.4	64%	0.636	77%	0.774	S	S	*	*			trans	-122.9	-178.9	-149.2	44.4	-33.4	0	0	0	115.6	L715	P713-L715 HydrophobicContact CB-CG 4.14Å; P713-L715 HydrophobicContact CG-CD1 3.91Å; P713-L715 HydrophobicContact CG-CG 4.03Å
714	S	28.9	Very low	30	Very low	122 Å²	122	124.8 Å²	124.8	85%	0.853	79%	0.791	S	S	*	*			trans	-127.1	131.7	145.3	58	0	0	0	0	109.6
715	L	28.1	Very low	29.5	Very low	150 Å²	150	125.5 Å²	125.5	79%	0.785	79%	0.786	S	S	*	*			trans	-118.8	123.9	-164.1	-77.2	164.4	0	0	0	112	P713	P713-L715 HydrophobicContact CB-CG 4.14Å; P713-L715 HydrophobicContact CG-CD1 3.91Å; P713-L715 HydrophobicContact CG-CG 4.03Å
716	F	33.2	Very low	29.2	Very low	195 Å²	195	122.4 Å²	122.4	86%	0.855	78%	0.781	S	S	*	*			trans	-69.3	153.3	132.5	-80.2	-77.6	0	0	0	107.8
717	P	40.3	Very low	28.9	Very low	113 Å²	113	115.9 Å²	115.9	73%	0.734	77%	0.774	S	S	*	*			cis	-146.2	-174.1	37.3	42.2	-22.2	0	0	0	116.3
718	S	31.6	Very low	28.9	Very low	104 Å²	104	118.2 Å²	118.2	73%	0.727	77%	0.769	S	S	*	*			trans	-68.7	156.2	151.3	-43.2	0	0	0	0	109.9
719	P	42.3	Very low	28.7	Very low	107 Å²	107	120.3 Å²	120.3	70%	0.695	76%	0.759	S	S	*	*				-152.1	157.4	90.4	37.9	-19.8	0	0	0	117.3
720	L	26.2	Very low	28.5	Very low	161 Å²	161	124.8 Å²	124.8	84%	0.843	76%	0.757	S	S	*	*			trans	60.2	132.1	141	-68.4	170.3	0	0	0	123.2
721	S	25.3	Very low	28.7	Very low	96 Å²	96	124.2 Å²	124.2	67%	0.671	75%	0.751	S	S	*	*			trans	92.4	114.8	133.1	-71.1	0	0	0	0	123.2
722	L	25.7	Very low	28.9	Very low	157 Å²	157	124.8 Å²	124.8	82%	0.822	74%	0.743	S	S	*	*			trans	87	135.1	132	-66.9	171.2	0	0	0	122.7
723	S	24.6	Very low	28.9	Very low	107 Å²	107	126.8 Å²	126.8	75%	0.748	74%	0.738	S	S	*	*			trans	57.1	128.3	154.8	44.5	0	0	0	0	120.4
724	F	23	Very low	28.6	Very low	193 Å²	193	127.8 Å²	127.8	85%	0.846	74%	0.735	S	S	*	*				83.7	92.5	55.4	-113.7	-97.8	0	0	0	115.9
725	V	23	Very low	29.1	Very low	105 Å²	105	132.3 Å²	132.3	64%	0.636	74%	0.739	S	S	*	*				51.3	115.1	129.1	-175	0	0	0	0	120.6
726	S	23.8	Very low	29.2	Very low	85 Å²	85	136.7 Å²	136.7	59%	0.594	75%	0.745	S	S	*	*			trans	88.7	150	141	-77.9	0	0	0	0	123.8
727	A	24.3	Very low	29.3	Very low	81 Å²	81	130 Å²	130	67%	0.669	73%	0.731	S	S	*	*			trans	79.9	121	151.4	0	0	0	0	0	120.3
728	N	26.8	Very low	28.6	Very low	124 Å²	124	133 Å²	133	66%	0.663	74%	0.737	S	S	*	*				14	141.6	120	-55.3	23.1	0	0	0	116.5
729	H	24.8	Very low	28.4	Very low	153 Å²	153	132.3 Å²	132.3	71%	0.708	74%	0.738	S	S	*	*			cis	-168.7	170.4	38.1	-155.2	-127.8	0	0	0	111.5
730	E	24.3	Very low	27.7	Very low	180 Å²	180	132.7 Å²	132.7	84%	0.841	74%	0.743	S	S	*	*			trans	62.9	158.3	168.8	-43.1	-163	125.7	0	0	116.4
731	G	31.9	Very low	28.3	Very low	74 Å²	74	130.4 Å²	130.4	76%	0.763	74%	0.738	S	S	*	*			cis	-152.2	-162.3	-14.5	0	0	0	0	0	106.9
732	S	33.4	Very low	28.5	Very low	90 Å²	90	129.5 Å²	129.5	63%	0.629	74%	0.744	S	S	*	*			cis	-166	153.7	-10.9	-173.3	0	0	0	0	107.5
733	Q	31.8	Very low	28.6	Very low	168 Å²	168	129 Å²	129	79%	0.785	74%	0.739	S	S	*	*			trans	51.4	146.9	148.8	-72.6	160.5	-25.5	0	0	122.1
734	Q	27.6	Very low	28.8	Very low	119 Å²	119	129.3 Å²	129.3	56%	0.556	74%	0.737	S	S	*	*			cis	-164.5	76.3	-17.6	-168.2	163	-9.1	0	0	111.4
735	K	38.8	Very low	28.8	Very low	216 Å²	216	130 Å²	130	94%	0.939	74%	0.735	S	S	*	*	S	Bend	trans	-140	103.7	168.5	-78.4	-175.9	178.3	177.3	0	111
736	R	29.9	Very low	29	Very low	242 Å²	242	132.1 Å²	132.1	91%	0.913	74%	0.742	S	S	*	*	S	Bend	cis	-158.6	109.3	-22.1	-127.8	-171.4	-164.7	-172.1	4.9	105.5
737	G	35.2	Very low	29	Very low	55 Å²	55	132 Å²	132	57%	0.567	75%	0.747	S	S	*	*			cis	168.1	145.2	-11.1	0	0	0	0	0	110.2
738	M	26.3	Very low	29.2	Very low	176 Å²	176	134.3 Å²	134.3	87%	0.867	75%	0.748	S	S	*	*			trans	66.8	144.8	-178.1	-61.4	160.7	162	0	0	114.7
739	A	27.7	Very low	29.2	Very low	90 Å²	90	135 Å²	135	74%	0.744	76%	0.757	S	S	*	*			cis	-159.2	169.9	-19.7	0	0	0	0	0	108.9
740	S	27.6	Very low	29.4	Very low	115 Å²	115	136.1 Å²	136.1	80%	0.804	76%	0.759	S	S	*	*			trans	-65.2	162.6	156.1	-52.4	0	0	0	0	110.1
741	P	38	Very low	30.4	Very low	112 Å²	112	132.7 Å²	132.7	73%	0.727	75%	0.752	S	S	*	*				-140	166.9	98.6	39.2	-28.9	0	0	0	113.9
742	G	29.1	Very low	30.1	Very low	78 Å²	78	137.9 Å²	137.9	80%	0.804	75%	0.754	S	S	*	*			trans	-82	130.2	155.7	0	0	0	0	0	110.4
743	M	29.3	Very low	30.1	Very low	145 Å²	145	141.1 Å²	141.1	71%	0.714	76%	0.764	S	S	*	*			trans	-129.7	141.3	163.7	-78.5	-85.8	-80.3	0	0	105.2
744	V	28.2	Very low	29.9	Very low	115 Å²	115	136.4 Å²	136.4	70%	0.697	76%	0.76	S	S	*	*				58.2	136.3	68.2	-168.4	0	0	0	0	111.3
745	Y	23.8	Very low	29.8	Very low	207 Å²	207	137.6 Å²	137.6	81%	0.812	77%	0.77	S	S	*	*			trans	75.4	136.7	-161.5	-75.2	-104.3	0	0	0	113.6
746	L	25.9	Very low	29.6	Very low	149 Å²	149	132.9 Å²	132.9	78%	0.78	76%	0.759	S	S	*	*			cis	78.7	113.5	10.5	-138.3	-177.3	0	0	0	115.3
747	A	24.9	Very low	29.6	Very low	84 Å²	84	130.3 Å²	130.3	69%	0.694	76%	0.755	S	S	*	*			trans	64.5	167.7	172.7	0	0	0	0	0	115.4
748	D	28.8	Very low	29.1	Very low	129 Å²	129	133.7 Å²	133.7	69%	0.69	77%	0.765	S	S	*	*			cis	-154.4	158.1	2.7	-152.1	-7	0	0	0	112.5
749	T	25.1	Very low	29.1	Very low	139 Å²	139	134.2 Å²	134.2	85%	0.853	76%	0.763	S	S	*	*			trans	-108.3	87.4	159.9	50.5	0	0	0	0	110
750	K	30.3	Very low	29.1	Very low	176 Å²	176	138 Å²	138	77%	0.765	77%	0.769	S	S	*	*			trans	-51	161.6	169.3	-81.4	-177.8	178.6	177.4	0	112.8
751	P	44.1	Very low	29	Very low	107 Å²	107	136 Å²	136	70%	0.695	77%	0.767	S	S	*	*			cis	-144	-173	29.3	30.2	-4.4	0	0	0	118.2
752	F	26.1	Very low	28.4	Very low	184 Å²	184	134.9 Å²	134.9	81%	0.807	78%	0.776	S	S	*	*			trans	91.7	116.3	160.6	-86.9	-90.9	0	0	0	121.9
753	L	33.1	Very low	28.1	Very low	158 Å²	158	135 Å²	135	83%	0.827	78%	0.777	S	S	*	*			trans	35.1	135.8	150.8	-60.3	173	0	0	0	121.4
754	G	26.9	Very low	28.1	Very low	68 Å²	68	139.4 Å²	139.4	70%	0.701	79%	0.786	S	S	*	*			cis	173.9	164.1	-2.7	0	0	0	0	0	115.3
755	D	27.3	Very low	28.9	Very low	145 Å²	145	139.8 Å²	139.8	78%	0.775	79%	0.791	S	S	*	*			trans	44.2	121.9	159.1	-65.7	-33.7	0	0	0	125.6
756	T	32.9	Very low	28.9	Very low	116 Å²	116	133.8 Å²	133.8	71%	0.712	79%	0.791	S	S	*	*				37.3	140.1	129.6	80.1	0	0	0	0	121.1
757	K	30.3	Very low	28.9	Very low	189 Å²	189	130.1 Å²	130.1	82%	0.822	79%	0.789	S	S	*	*			cis	-162.1	168.1	47.6	-79	-174.9	176.7	172.7	0	113.3
758	T	24.7	Very low	29.2	Very low	125 Å²	125	131 Å²	131	77%	0.767	80%	0.797	S	S	*	*			trans	-68.3	135.8	157.6	49.7	0	0	0	0	113.1
759	F	27.5	Very low	29	Very low	188 Å²	188	131.2 Å²	131.2	83%	0.825	80%	0.803	S	S	*	*			trans	-171.8	131.4	138.9	-109.3	-65.7	0	0	0	112.2
760	L	27.7	Very low	29.2	Very low	169 Å²	169	129.4 Å²	129.4	89%	0.885	80%	0.802	S	S	*	*			trans	62	155.7	168	-50.4	-179.1	0	0	0	117.3
761	G	25.4	Very low	29	Very low	74 Å²	74	125.1 Å²	125.1	76%	0.763	81%	0.808	S	S	*	*			cis	160.7	91	-12.7	0	0	0	0	0	115.4
762	G	24	Very low	28.1	Very low	88 Å²	88	123.9 Å²	123.9	91%	0.907	82%	0.815	S	S	*	*			trans	79.9	167.6	162.4	0	0	0	0	0	117.5
763	G	24.4	Very low	28.1	Very low	80 Å²	80	119.5 Å²	119.5	83%	0.825	82%	0.822	S	S	*	*			trans	123.2	107.5	162.4	0	0	0	0	0	117.9
764	R	28.4	Very low	27.8	Very low	238 Å²	238	116.2 Å²	116.2	90%	0.898	83%	0.825	S	S	*	*			trans	-83.5	177.5	132.1	-53.4	167.8	70.9	-152.2	6.1	106.4
765	P	45.6	Very low	27.9	Very low	123 Å²	123	117.1 Å²	117.1	80%	0.799	84%	0.835	S	S	*	*			cis	-137.8	-152	0.6	44.4	-25.4	0	0	0	112.1
766	G	23.7	Very low	27.9	Very low	80 Å²	80	114 Å²	114	83%	0.825	84%	0.837	S	S	*	*			trans	99.7	163.5	146.7	0	0	0	0	0	116.5
767	G	26.4	Very low	27.6	Very low	72 Å²	72	115.7 Å²	115.7	74%	0.742	84%	0.837	S	S	*	*			trans	-161.9	180	179.7	0	0	0	0	0	112.8
768	A	29.6	Very low	27.5	Very low	103 Å²	103	115.3 Å²	115.3	85%	0.851	84%	0.835	S	S	*	*			trans	68.6	149.8	-166.5	0	0	0	0	0	113.2
769	T	26.6	Very low	27.7	Very low	133 Å²	133	119.2 Å²	119.2	82%	0.816	85%	0.845	S	S	*	*			cis	-141	163.1	20.3	43.4	0	0	0	0	114.4
770	A	29	Very low	27.8	Very low	101 Å²	101	115.2 Å²	115.2	84%	0.835	84%	0.84	S	S	*	*			trans	48.8	117.3	144.5	0	0	0	0	0	123.5
771	G	25.6	Very low	27.9	Very low	86 Å²	86	116.5 Å²	116.5	89%	0.887	84%	0.841	S	S	*	*				110.8	128.7	111.3	0	0	0	0	0	120
772	G	25.9	Very low	28.2	Very low	82 Å²	82	120.3 Å²	120.3	85%	0.845	84%	0.843	S	S	*	*			trans	125.3	83.6	148.2	0	0	0	0	0	119.8
773	G	25.5	Very low	28.7	Very low	92 Å²	92	121.7 Å²	121.7	95%	0.948	84%	0.836	S	S	*	*			trans	37.7	124.6	140.8	0	0	0	0	0	123.7
774	G	27.3	Very low	29.3	Very low	88 Å²	88	122.8 Å²	122.8	91%	0.907	83%	0.831	S	S	*	*			trans	174.5	128.5	160.8	0	0	0	0	0	111
775	G	27.9	Very low	29.6	Very low	88 Å²	88	120.4 Å²	120.4	91%	0.907	83%	0.83	S	S	*	*			trans	-121.8	156.1	-170.4	0	0	0	0	0	114.9
776	G	26.7	Very low	29	Very low	78 Å²	78	122.7 Å²	122.7	80%	0.804	83%	0.83	S	S	*	*			trans	173.7	92.4	178.6	0	0	0	0	0	114.8
777	E	27.7	Very low	29.4	Very low	153 Å²	153	126.3 Å²	126.3	72%	0.715	82%	0.823	S	S	*	*			trans	24.2	125.3	156.8	-56	-156.1	84.5	0	0	123.9
778	K	28.9	Very low	29.6	Very low	180 Å²	180	130.5 Å²	130.5	78%	0.783	82%	0.823	S	S	*	*			trans	56.9	100.8	133.8	-60.3	167.1	-179.9	153.8	0	120.6
779	Q	28.1	Very low	29.7	Very low	208 Å²	208	132.4 Å²	132.4	97%	0.972	81%	0.814	S	S	*	*				-158.3	171.7	110.5	-120.2	-179.1	7.3	0	0	112.4
780	S	30.1	Very low	30.1	Very low	104 Å²	104	129.1 Å²	129.1	73%	0.727	80%	0.797	S	S	*	*			trans	-129.7	132.4	-165.2	177.9	0	0	0	0	113.2
781	Q	29	Very low	30.4	Very low	195 Å²	195	130 Å²	130	91%	0.911	78%	0.784	S	S	*	*			trans	-148	146.8	160.7	-67.1	-164.1	13	0	0	110.9
782	I	31.7	Very low	30.8	Very low	155 Å²	155	129.3 Å²	129.3	80%	0.795	77%	0.765	S	S	*	*			trans	-131.9	138.4	174.4	-67.1	178.7	0	0	0	107.9
783	P	34.2	Very low	31.6	Very low	117 Å²	117	130.1 Å²	130.1	76%	0.76	75%	0.749	S	S	*	*			trans	-79.8	150.6	-168.1	30.3	-35.9	0	0	0	115.7
784	S	37.4	Very low	32.1	Very low	103 Å²	103	131.1 Å²	131.1	72%	0.72	73%	0.732	S	S	*	*			trans	-48.3	125	178.9	51	0	0	0	0	118
785	Q	33.9	Very low	32.4	Very low	187 Å²	187	137.8 Å²	137.8	87%	0.874	73%	0.73	S	S	*	*			trans	-121.4	-21	149.1	-75.7	-173.2	-21.2	0	0	113.9	K787	Q785-K787 PolarHBondContact O-N 3.15Å
786	Q	33.6	Very low	33.1	Very low	172 Å²	172	143.4 Å²	143.4	80%	0.804	72%	0.724	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-3.1	-174.2	-67.1	179.9	-26.8	0	0	116.3	S790	Q786-S790 PolarHBondContact O-OG 2.89Å
787	K	31.3	Very low	33.7	Very low	156 Å²	156	150.2 Å²	150.2	68%	0.678	73%	0.726	S	S	*	*	H	α-helix	trans	-79.9	-21	-169.1	-158.8	171.5	-176	177.9	0	113.9	Q785 Q791	Q785-K787 PolarHBondContact O-N 3.15Å; K787-Q791 WeakPolarHBondContact O-CG 3.46Å; K787-Q791 PolarHBondContact O-NE2 3.19Å
788	E	30.8	Very low	34.2	Very low	159 Å²	159	153.3 Å²	153.3	74%	0.743	73%	0.731	S	S	*	*	H	α-helix	trans	-89.7	-46.6	-174.2	-162.3	166.5	170.6	0	0	112.7	S790 Q791 S792	E788-S790 PolarHBondContact O-N 3.2Å; E788-Q791 WeakPolarHBondContact O-CB 3.11Å; E788-Q791 PolarHBondContact O-N 3.18Å; E788-S792 PolarHBondContact O-N 3.33Å; E788-S792 VanDerWaalsContact O-N 3.14Å
789	E	33.1	Very low	35.2	Very low	144 Å²	144	148.8 Å²	148.8	67%	0.673	74%	0.735	S	S	*	*	H	α-helix	trans	-57.5	-40.6	173.3	-166.9	-176.8	158.7	0	0	111.2	Q791 S792 L793	E789-Q791 VanDerWaalsContact C-N 3.27Å; E789-Q791 PolarHBondContact O-N 3.33Å; E789-S792 WeakPolarHBondContact O-CB 3.47Å; E789-S792 PolarHBondContact O-N 3.25Å; E789-S792 VanDerWaalsContact O-N 3.08Å; E789-S792 PolarHBondContact O-OG 3.48Å; E789-L793 PolarHBondContact O-N 2.81Å; E789-L793 VanDerWaalsContact O-N 3.13Å
790	S	34.9	Very low	36.1	Very low	63 Å²	63	142.7 Å²	142.7	44%	0.441	72%	0.716	S	S	.	*	H	α-helix	trans	-53.2	-39.8	172.2	-65.2	0	0	0	0	113	Q786 E788 L794	Q786-S790 PolarHBondContact O-OG 2.89Å; E788-S790 PolarHBondContact O-N 3.2Å; S790-L794 WeakPolarHBondContact O-CB 3.47Å; S790-L794 VanDerWaalsContact O-CG 3.28Å; S790-L794 WeakPolarHBondContact O-CG 3.37Å; S790-L794 PolarHBondContact O-N 2.86Å
791	Q	33.7	Very low	37.9	Very low	120 Å²	120	141.2 Å²	141.2	56%	0.561	72%	0.716	S	S	*	*	H	α-helix	trans	-74.6	-33	178.1	-72.7	-175.2	58	0	0	112.6	K787 E788 E789 L793 L794 R795	K787-Q791 WeakPolarHBondContact O-CG 3.46Å; K787-Q791 PolarHBondContact O-NE2 3.19Å; E788-Q791 WeakPolarHBondContact O-CB 3.11Å; E788-Q791 PolarHBondContact O-N 3.18Å; E789-Q791 VanDerWaalsContact C-N 3.27Å; E789-Q791 PolarHBondContact O-N 3.33Å; Q791-L793 VanDerWaalsContact C-N 3.31Å; Q791-L793 PolarHBondContact O-N 2.79Å; Q791-L794 PolarHBondContact O-N 2.96Å; Q791-R795 PolarHBondContact O-N 3.05Å
792	S	34.8	Very low	40.3	Very low	71 Å²	71	133.5 Å²	133.5	50%	0.497	68%	0.683	S	S	.	*	H	α-helix	trans	-60.7	-41.4	173	86.7	0	0	0	0	111.7	E788 E789	E788-S792 PolarHBondContact O-N 3.33Å; E788-S792 VanDerWaalsContact O-N 3.14Å; E789-S792 WeakPolarHBondContact O-CB 3.47Å; E789-S792 PolarHBondContact O-N 3.25Å; E789-S792 VanDerWaalsContact O-N 3.08Å; E789-S792 PolarHBondContact O-OG 3.48Å
793	L	42	Very low	43.1	Very low	99 Å²	99	131.8 Å²	131.8	52%	0.518	67%	0.67	S	S	.	*	H	α-helix	trans	-73.3	-35.5	177.6	-64.5	178.6	0	0	0	112.2	E789 Q791 R796 R797	E789-L793 PolarHBondContact O-N 2.81Å; E789-L793 VanDerWaalsContact O-N 3.13Å; Q791-L793 VanDerWaalsContact C-N 3.31Å; Q791-L793 PolarHBondContact O-N 2.79Å; L793-R796 WeakPolarHBondContact O-CB 3.49Å; L793-R796 PolarHBondContact O-N 3.27Å; L793-R796 VanDerWaalsContact O-N 3.1Å; L793-R797 PolarHBondContact O-N 3.28Å
794	L	36.4	Very low	45.9	Very low	113 Å²	113	126.2 Å²	126.2	59%	0.592	63%	0.634	S	S	*	*	H	α-helix	trans	-67.1	-36.7	174.7	-75.5	167.5	0	0	0	112.6	S790 Q791 R796 R797 R798	S790-L794 WeakPolarHBondContact O-CB 3.47Å; S790-L794 VanDerWaalsContact O-CG 3.28Å; S790-L794 WeakPolarHBondContact O-CG 3.37Å; S790-L794 PolarHBondContact O-N 2.86Å; Q791-L794 PolarHBondContact O-N 2.96Å; L794-R796 PolarHBondContact O-N 2.88Å; L794-R797 PolarHBondContact O-N 2.97Å; L794-R798 PolarHBondContact O-N 2.95Å
795	R	34.6	Very low	48.5	Very low	228 Å²	228	124 Å²	124	86%	0.86	62%	0.621	S	S	*	*	H	α-helix	trans	-63.6	-18.5	170.1	-83	-158.6	174.7	-120.1	1.7	113.5	Q791	Q791-R795 PolarHBondContact O-N 3.05Å
796	R	41.1	Very low	51.1	Low	206 Å²	206	116.5 Å²	116.5	78%	0.777	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.5	-9.6	172.5	-164	168.9	-68.8	-142.2	0.6	114	L793 L794	L793-R796 WeakPolarHBondContact O-CB 3.49Å; L793-R796 PolarHBondContact O-N 3.27Å; L793-R796 VanDerWaalsContact O-N 3.1Å; L794-R796 PolarHBondContact O-N 2.88Å
797	R	40.5	Very low	53.7	Low	222 Å²	222	108.6 Å²	108.6	84%	0.838	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	-11	179.5	-74	-171.8	179.6	-107	4.7	115.4	L793 L794	L793-R797 PolarHBondContact O-N 3.28Å; L794-R797 PolarHBondContact O-N 2.97Å
798	R	37.2	Very low	56.4	Low	217 Å²	217	104.2 Å²	104.2	82%	0.819	54%	0.535	S	S	*	.	S	Bend	trans	-76.8	141.9	156.2	-65.5	-169.5	-173.2	-145.3	0.9	108.7	L794 S800	L794-R798 PolarHBondContact O-N 2.95Å; R798-S800 PolarHBondContact O-N 3.09Å
799	G	50.1	Low	59.1	Low	85 Å²	85	97.6 Å²	97.6	88%	0.876	51%	0.505	S	S	*	.			trans	-70.4	91.3	-172.8	0	0	0	0	0	112.7
800	S	48.1	Very low	61.7	Low	81 Å²	81	94.4 Å²	94.4	57%	0.566	50%	0.496	S	S	*	.			trans	-58.7	139.1	162.5	56.6	0	0	0	0	109.2	R798 V802	R798-S800 PolarHBondContact O-N 3.09Å; S800-V802 PolarHBondContact O-N 3.33Å
801	G	66.8	Low	64.1	Low	72 Å²	72	99.5 Å²	99.5	74%	0.742	51%	0.51	S	S	*	.			trans	-68.6	19.5	-172.2	0	0	0	0	0	115.8	F803	G801-F803 WeakPolarHBondContact O-CD1 3.23Å; G801-F803 PolarHBondContact O-N 2.86Å
802	V	81	Confident	66.8	Low	34 Å²	34	96.1 Å²	96.1	21%	0.206	50%	0.497	C	S	.	.			trans	-70.4	124	-175.1	-174	0	0	0	0	110	S800 W815 Y823	S800-V802 PolarHBondContact O-N 3.33Å; V802-W815 HydrophobicContact CB-CH2 4.35Å; V802-W815 HydrophobicContact CB-CZ2 4.07Å; V802-W815 HydrophobicContact CG1-CD2 3.91Å; V802-W815 HydrophobicContact CG1-CE3 3.87Å; V802-W815 HydrophobicContact CG1-CH2 3.86Å; V802-W815 HydrophobicContact CG1-CZ2 3.91Å; V802-W815 HydrophobicContact CG1-CZ3 3.85Å; V802-W815 VanDerWaalsContact O-CH2 3.27Å; V802-W815 WeakPolarHBondContact O-CH2 3.44Å; V802-W815 WeakPolarHBondContact O-CZ2 3.38Å; V802-Y823 VanDerWaalsContact CG1-CB 3.45Å; V802-Y823 HydrophobicContact CG1-CD1 4.34Å; V802-Y823 HydrophobicContact CG1-CD2 3.8Å; V802-Y823 HydrophobicContact CG1-CG 3.6Å
803	F	90.6	Very high	69.4	Low	119 Å²	119	98 Å²	98	52%	0.522	51%	0.51	S	S	.	.			trans	-118.7	149.8	171.7	54.5	-94.2	0	0	0	109.6	G801 A805 L808 T809 T810	G801-F803 WeakPolarHBondContact O-CD1 3.23Å; G801-F803 PolarHBondContact O-N 2.86Å; F803-A805 PolarHBondContact O-N 2.91Å; F803-L808 HydrophobicContact CD2-CD2 3.5Å; F803-L808 HydrophobicContact CE2-CD2 4.03Å; F803-L808 HydrophobicContact CG-CD2 4.34Å; F803-T809 WeakPolarHBondContact CA-O 3.36Å; F803-T810 HydrophobicContact CB-CG2 4.3Å
804	C	92.9	Very high	71.7	Confident	0 Å²	0	97.3 Å²	97.3	0%	0	51%	0.507	C	S	.	.			trans	-71.2	117.6	176.1	171.8	0	0	0	0	110.7	N806 C807 L808 T809 W815 Y823 V824 C825	C804-N806 PolarHBondContact O-N 3.4Å; C804-C807 PolarHBondContact O-N 3.38Å; C804-C807 PolarHBondContact SG-N 3.43Å; C804-C807 VanDerWaalsContact SG-N 3.42Å; C804-C807 VanDerWaalsContact SG-SG 3.63Å; C804-L808 WeakPolarHBondContact O-CA 3.47Å; C804-L808 WeakPolarHBondContact O-CD2 3.44Å; C804-L808 PolarHBondContact O-N 2.9Å; C804-T809 HydrophobicContact CB-CG2 3.94Å; C804-T809 PolarHBondContact N-O 2.84Å; C804-W815 HydrophobicContact CB-CZ3 4Å; C804-Y823 CarbonylContact C-O 3.57Å; C804-Y823 WeakPolarHBondContact CA-O 3.3Å; C804-V824 VanDerWaalsContact SG-CA 3.59Å; C804-C825 HydrophobicContact CB-CB 4Å; C804-C825 PolarHBondContact SG-N 3.15Å
805	A	91.6	Very high	74.4	Confident	55 Å²	55	95.7 Å²	95.7	46%	0.455	49%	0.493	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.4	-27.1	-179.2	0	0	0	0	0	114.6	F803 Y823 V824	F803-A805 PolarHBondContact O-N 2.91Å; A805-Y823 PolarHBondContact N-O 2.81Å; A805-V824 HydrophobicContact CB-CG1 4.29Å
806	N	87.9	Confident	77.2	Confident	31 Å²	31	89.3 Å²	89.3	17%	0.166	47%	0.469	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	-68.5	172.7	173.8	-65.7	0	0	0	112.3	C804 C828 P838 R839 I844	C804-N806 PolarHBondContact O-N 3.4Å; N806-C828 HydrophobicContact CB-CB 4.09Å; N806-C828 PolarHBondContact OD1-SG 3.3Å; N806-C828 VanDerWaalsContact OD1-SG 3.38Å; N806-P838 WeakPolarHBondContact ND2-CB 3.37Å; N806-R839 PolarHBondContact ND2-N 3.39Å; N806-R839 VanDerWaalsContact ND2-N 3.17Å; N806-R839 PolarHBondContact ND2-O 3.25Å; N806-R839 PolarHBondContact OD1-O 3.38Å; N806-I844 WeakPolarHBondContact OD1-CD1 3.48Å
807	C	89	Confident	79.5	Confident	6 Å²	6	86.2 Å²	86.2	4%	0.041	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-9.6	-167.8	74.6	0	0	0	0	114.8	C804 T809 I844 I852 R856	C804-C807 PolarHBondContact O-N 3.38Å; C804-C807 PolarHBondContact SG-N 3.43Å; C804-C807 VanDerWaalsContact SG-N 3.42Å; C804-C807 VanDerWaalsContact SG-SG 3.63Å; C807-T809 PolarHBondContact O-N 2.79Å; C807-T809 WeakPolarHBondContact SG-CG2 3.07Å; C807-I844 HydrophobicContact CB-CD1 3.72Å; C807-I844 HydrophobicContact CB-CG1 4.44Å; C807-I844 HydrophobicContact CB-CG2 4.14Å; C807-I852 VanDerWaalsContact O-CG2 3.31Å; C807-I852 WeakPolarHBondContact O-CG2 3.41Å; C807-R856 VanDerWaalsContact C-NH2 3.32Å; C807-R856 PolarHBondContact O-NH2 3.24Å
808	L	88.1	Confident	81.7	Confident	64 Å²	64	77.2 Å²	77.2	34%	0.335	43%	0.429	S	S	.	.			trans	58.4	20.6	-173.2	-53.7	179.3	0	0	0	115.1	F803 C804 R856	F803-L808 HydrophobicContact CD2-CD2 3.5Å; F803-L808 HydrophobicContact CE2-CD2 4.03Å; F803-L808 HydrophobicContact CG-CD2 4.34Å; C804-L808 WeakPolarHBondContact O-CA 3.47Å; C804-L808 WeakPolarHBondContact O-CD2 3.44Å; C804-L808 PolarHBondContact O-N 2.9Å; L808-R856 HydrophobicContact CD1-CG 3.83Å
809	T	86.2	Confident	83.9	Confident	19 Å²	19	71.9 Å²	71.9	12%	0.117	43%	0.432	C	S	.	.			trans	-62.7	140.1	165.6	-167.9	0	0	0	0	110.3	F803 C804 C807 K811 W815 C825	F803-T809 WeakPolarHBondContact CA-O 3.36Å; C804-T809 HydrophobicContact CB-CG2 3.94Å; C804-T809 PolarHBondContact N-O 2.84Å; C807-T809 PolarHBondContact O-N 2.79Å; C807-T809 WeakPolarHBondContact SG-CG2 3.07Å; T809-K811 VanDerWaalsContact CG2-O 3.23Å; T809-K811 WeakPolarHBondContact CG2-O 3.35Å; T809-K811 PolarHBondContact OG1-N 2.86Å; T809-K811 VanDerWaalsContact OG1-N 3.15Å; T809-K811 PolarHBondContact OG1-O 3.41Å; T809-W815 WeakPolarHBondContact O-CH2 3.34Å; T809-C825 HydrophobicContact CG2-CB 3.53Å
810	T	87.8	Confident	85.2	Confident	78 Å²	78	74.2 Å²	74.2	48%	0.479	42%	0.424	S	S	.	.	S	Bend	trans	-100.1	0.6	168.9	54.2	0	0	0	0	112.4	F803	F803-T810 HydrophobicContact CB-CG2 4.3Å
811	K	85.7	Confident	86.8	Confident	170 Å²	170	72.5 Å²	72.5	74%	0.739	42%	0.419	S	S	*	.			trans	-125.7	131.6	175.3	-65.4	-171.1	178.5	-173.7	0	110.4	T809	T809-K811 VanDerWaalsContact CG2-O 3.23Å; T809-K811 WeakPolarHBondContact CG2-O 3.35Å; T809-K811 PolarHBondContact OG1-N 2.86Å; T809-K811 VanDerWaalsContact OG1-N 3.15Å; T809-K811 PolarHBondContact OG1-O 3.41Å
812	T	91.1	Very high	87.8	Confident	48 Å²	48	70.3 Å²	70.3	29%	0.294	40%	0.397	S	S	.	.			trans	-157	157.4	175.1	-171.5	0	0	0	0	110	L814 W815 C825 N826	T812-L814 VanDerWaalsContact C-N 3.34Å; T812-L814 VanDerWaalsContact CG2-O 3.3Å; T812-L814 WeakPolarHBondContact CG2-O 3.3Å; T812-L814 PolarHBondContact OG1-O 2.73Å; T812-W815 HydrophobicContact CG2-CD2 3.5Å; T812-W815 VanDerWaalsContact CG2-CD2 3.5Å; T812-W815 HydrophobicContact CG2-CE3 3.85Å; T812-W815 HydrophobicContact CG2-CG 3.88Å; T812-W815 HydrophobicContact CG2-CH2 4.35Å; T812-W815 HydrophobicContact CG2-CZ2 4.03Å; T812-W815 HydrophobicContact CG2-CZ3 4.26Å; T812-C825 HydrophobicContact CG2-CB 4.13Å; T812-C825 WeakPolarHBondContact OG1-CB 3.34Å; T812-N826 PolarHBondContact OG1-N 3.41Å; T812-N826 VanDerWaalsContact OG1-N 3.15Å
813	S	88.6	Confident	88.3	Confident	110 Å²	110	73.8 Å²	73.8	77%	0.769	41%	0.407	S	S	*	.	S	Bend	trans	-71.7	-28.4	172.4	48.8	0	0	0	0	113
814	L	89.8	Confident	88.5	Confident	86 Å²	86	68.2 Å²	68.2	45%	0.45	38%	0.382	S	S	.	.			trans	-150	133.5	176.2	-179.6	64.5	0	0	0	110.5	T812 R816 N826	T812-L814 VanDerWaalsContact C-N 3.34Å; T812-L814 VanDerWaalsContact CG2-O 3.3Å; T812-L814 WeakPolarHBondContact CG2-O 3.3Å; T812-L814 PolarHBondContact OG1-O 2.73Å; L814-R816 HydrophobicContact CD2-CG 4.44Å; L814-N826 HydrophobicContact CB-CB 4.08Å; L814-N826 WeakPolarHBondContact O-CA 3.41Å; L814-N826 WeakPolarHBondContact O-CB 3.31Å; L814-N826 PolarHBondContact O-N 3.43Å
815	W	93.6	Very high	88.6	Confident	79 Å²	79	68.5 Å²	68.5	30%	0.299	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	128.3	167	-67.9	110.7	0	0	0	109.6	V802 C804 T809 T812 Y823	V802-W815 HydrophobicContact CB-CH2 4.35Å; V802-W815 HydrophobicContact CB-CZ2 4.07Å; V802-W815 HydrophobicContact CG1-CD2 3.91Å; V802-W815 HydrophobicContact CG1-CE3 3.87Å; V802-W815 HydrophobicContact CG1-CH2 3.86Å; V802-W815 HydrophobicContact CG1-CZ2 3.91Å; V802-W815 HydrophobicContact CG1-CZ3 3.85Å; V802-W815 VanDerWaalsContact O-CH2 3.27Å; V802-W815 WeakPolarHBondContact O-CH2 3.44Å; V802-W815 WeakPolarHBondContact O-CZ2 3.38Å; C804-W815 HydrophobicContact CB-CZ3 4Å; T809-W815 WeakPolarHBondContact O-CH2 3.34Å; T812-W815 HydrophobicContact CG2-CD2 3.5Å; T812-W815 VanDerWaalsContact CG2-CD2 3.5Å; T812-W815 HydrophobicContact CG2-CE3 3.85Å; T812-W815 HydrophobicContact CG2-CG 3.88Å; T812-W815 HydrophobicContact CG2-CH2 4.35Å; T812-W815 HydrophobicContact CG2-CZ2 4.03Å; T812-W815 HydrophobicContact CG2-CZ3 4.26Å; W815-Y823 HydrophobicContact CB-CD1 4.41Å
816	R	92.8	Very high	88.7	Confident	93 Å²	93	67.5 Å²	67.5	35%	0.351	37%	0.372	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	157.1	168.9	-62.3	178.9	-178.5	-89.9	-3.8	108.4	L814 Y823 V824 N826	L814-R816 HydrophobicContact CD2-CG 4.44Å; R816-Y823 CarbonylContact O-C 3.54Å; R816-Y823 WeakPolarHBondContact O-CA 3.48Å; R816-V824 HydrophobicContact CB-CG2 4.06Å; R816-V824 PolarHBondContact N-O 3Å; R816-V824 PolarHBondContact O-N 3.32Å; R816-N826 PolarHBondContact NE-OD1 3.33Å; R816-N826 PolarHBondContact NH2-OD1 2.96Å
817	K	91.4	Very high	88.9	Confident	142 Å²	142	68.2 Å²	68.2	62%	0.617	38%	0.382	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	144.1	163.3	-64.8	-174.5	-179.9	-177.1	0	108.8	G822 Y823	K817-G822 WeakPolarHBondContact CA-O 3.43Å; K817-Y823 HydrophobicContact CG-CD1 4.19Å; K817-Y823 HydrophobicContact CG-CE1 4.02Å
818	N	86	Confident	89.1	Confident	32 Å²	32	68 Å²	68	17%	0.171	38%	0.381	C	S	.	.			trans	-87.9	174.6	166.3	68.6	5.9	0	0	0	110.3	N820 G821 G822 V824	N818-N820 PolarHBondContact O-N 2.95Å; N818-N820 WeakPolarHBondContact OD1-CA 3.48Å; N818-N820 WeakPolarHBondContact OD1-CB 3.46Å; N818-N820 PolarHBondContact OD1-N 3.37Å; N818-G821 PolarHBondContact O-N 3.46Å; N818-G821 PolarHBondContact OD1-N 2.93Å; N818-G822 PolarHBondContact N-O 3.22Å; N818-G822 WeakPolarHBondContact OD1-CA 3.47Å; N818-G822 PolarHBondContact OD1-N 2.81Å; N818-G822 PolarHBondContact OD1-O 3.14Å; N818-G822 VanDerWaalsContact OD1-O 3.1Å; N818-V824 HydrophobicContact CB-CG1 4.08Å; N818-V824 HydrophobicContact CB-CG2 4.36Å
819	A	82.1	Confident	89.4	Confident	105 Å²	105	65.6 Å²	65.6	87%	0.868	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-31.1	177.8	0	0	0	0	0	112.6	G821	A819-G821 PolarHBondContact O-N 2.68Å; A819-G821 VanDerWaalsContact O-N 3.16Å
820	N	77.8	Confident	89.7	Confident	135 Å²	135	68.5 Å²	68.5	72%	0.722	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	14.2	176.7	-41.8	71.7	0	0	0	113.5	N818 G822	N818-N820 PolarHBondContact O-N 2.95Å; N818-N820 WeakPolarHBondContact OD1-CA 3.48Å; N818-N820 WeakPolarHBondContact OD1-CB 3.46Å; N818-N820 PolarHBondContact OD1-N 3.37Å; N820-G822 PolarHBondContact O-N 3.3Å
821	G	82.8	Confident	90	Very high	45 Å²	45	67.5 Å²	67.5	46%	0.464	37%	0.373	S	S	.	.	S	Bend	trans	72.4	-15.4	-179.2	0	0	0	0	0	116.1	N818 A819	N818-G821 PolarHBondContact O-N 3.46Å; N818-G821 PolarHBondContact OD1-N 2.93Å; A819-G821 PolarHBondContact O-N 2.68Å; A819-G821 VanDerWaalsContact O-N 3.16Å
822	G	86.5	Confident	90.1	Very high	26 Å²	26	62 Å²	62	27%	0.268	35%	0.35	S	S	.	.			trans	-73	146.5	-177.5	0	0	0	0	0	113.8	K817 N818 N820	K817-G822 WeakPolarHBondContact CA-O 3.43Å; N818-G822 PolarHBondContact N-O 3.22Å; N818-G822 WeakPolarHBondContact OD1-CA 3.47Å; N818-G822 PolarHBondContact OD1-N 2.81Å; N818-G822 PolarHBondContact OD1-O 3.14Å; N818-G822 VanDerWaalsContact OD1-O 3.1Å; N820-G822 PolarHBondContact O-N 3.3Å
823	Y	92.3	Very high	90	Very high	106 Å²	106	68.6 Å²	68.6	42%	0.416	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	134	177.1	-67.2	-76.7	0	0	0	111.8	V802 C804 A805 W815 R816 K817	V802-Y823 VanDerWaalsContact CG1-CB 3.45Å; V802-Y823 HydrophobicContact CG1-CD1 4.34Å; V802-Y823 HydrophobicContact CG1-CD2 3.8Å; V802-Y823 HydrophobicContact CG1-CG 3.6Å; C804-Y823 CarbonylContact C-O 3.57Å; C804-Y823 WeakPolarHBondContact CA-O 3.3Å; A805-Y823 PolarHBondContact N-O 2.81Å; W815-Y823 HydrophobicContact CB-CD1 4.41Å; R816-Y823 CarbonylContact O-C 3.54Å; R816-Y823 WeakPolarHBondContact O-CA 3.48Å; K817-Y823 HydrophobicContact CG-CD1 4.19Å; K817-Y823 HydrophobicContact CG-CE1 4.02Å
824	V	93.7	Very high	90.1	Very high	2 Å²	2	69.7 Å²	69.7	1%	0.012	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	148.7	172.5	-64	0	0	0	0	110.8	C804 A805 R816 N818 C828	C804-V824 VanDerWaalsContact SG-CA 3.59Å; A805-V824 HydrophobicContact CB-CG1 4.29Å; R816-V824 HydrophobicContact CB-CG2 4.06Å; R816-V824 PolarHBondContact N-O 3Å; R816-V824 PolarHBondContact O-N 3.32Å; N818-V824 HydrophobicContact CB-CG1 4.08Å; N818-V824 HydrophobicContact CB-CG2 4.36Å; V824-C828 HydrophobicContact CB-CB 4.35Å
825	C	95.4	Very high	90	Very high	6 Å²	6	70 Å²	70	4%	0.041	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.7	156.6	175.9	72.5	0	0	0	0	110.8	C804 T809 T812 A827 C828 G829	C804-C825 HydrophobicContact CB-CB 4Å; C804-C825 PolarHBondContact SG-N 3.15Å; T809-C825 HydrophobicContact CG2-CB 3.53Å; T812-C825 HydrophobicContact CG2-CB 4.13Å; T812-C825 WeakPolarHBondContact OG1-CB 3.34Å; C825-A827 VanDerWaalsContact C-N 3.26Å; C825-A827 PolarHBondContact O-N 2.75Å; C825-A827 VanDerWaalsContact O-N 3.12Å; C825-C828 PolarHBondContact O-N 3.1Å; C825-C828 PolarHBondContact SG-SG 3.21Å; C825-G829 PolarHBondContact O-N 2.98Å
826	N	94.6	Very high	89.7	Confident	35 Å²	35	71.5 Å²	71.5	19%	0.187	39%	0.393	C	S	.	.	H	α-helix	trans	-48.7	-46.4	-175.3	-167	35.5	0	0	0	112.7	T812 L814 R816 C828 G829 L830	T812-N826 PolarHBondContact OG1-N 3.41Å; T812-N826 VanDerWaalsContact OG1-N 3.15Å; L814-N826 HydrophobicContact CB-CB 4.08Å; L814-N826 WeakPolarHBondContact O-CA 3.41Å; L814-N826 WeakPolarHBondContact O-CB 3.31Å; L814-N826 PolarHBondContact O-N 3.43Å; R816-N826 PolarHBondContact NE-OD1 3.33Å; R816-N826 PolarHBondContact NH2-OD1 2.96Å; N826-C828 PolarHBondContact O-N 3.25Å; N826-G829 PolarHBondContact O-N 3.38Å; N826-L830 VanDerWaalsContact O-CB 3.3Å; N826-L830 WeakPolarHBondContact O-CB 3.33Å; N826-L830 VanDerWaalsContact O-CG 3.24Å; N826-L830 WeakPolarHBondContact O-CG 3.27Å; N826-L830 PolarHBondContact O-N 3.09Å
827	A	92	Very high	89.4	Confident	46 Å²	46	70.3 Å²	70.3	38%	0.38	40%	0.396	S	S	.	.	H	α-helix	trans	-67.1	-31	-179.5	0	0	0	0	0	114.2	C825 Y831	C825-A827 VanDerWaalsContact C-N 3.26Å; C825-A827 PolarHBondContact O-N 2.75Å; C825-A827 VanDerWaalsContact O-N 3.12Å; A827-Y831 WeakPolarHBondContact O-CB 3.47Å; A827-Y831 PolarHBondContact O-N 3.33Å
828	C	93.7	Very high	89.1	Confident	2 Å²	2	67.7 Å²	67.7	1%	0.014	39%	0.393	C	S	.	.	H	α-helix	trans	-80.5	-39.3	176.2	-65.8	0	0	0	0	111.6	N806 V824 C825 N826 Y831 Q832 R839	N806-C828 HydrophobicContact CB-CB 4.09Å; N806-C828 PolarHBondContact OD1-SG 3.3Å; N806-C828 VanDerWaalsContact OD1-SG 3.38Å; V824-C828 HydrophobicContact CB-CB 4.35Å; C825-C828 PolarHBondContact O-N 3.1Å; C825-C828 PolarHBondContact SG-SG 3.21Å; N826-C828 PolarHBondContact O-N 3.25Å; C828-Y831 PolarHBondContact O-N 2.82Å; C828-Q832 WeakPolarHBondContact O-CB 3.39Å; C828-Q832 PolarHBondContact O-N 3.44Å; C828-R839 HydrophobicContact CB-CB 4.47Å
829	G	93.8	Very high	89.2	Confident	12 Å²	12	67.8 Å²	67.8	12%	0.124	39%	0.391	C	S	.	.	H	α-helix	trans	-68.7	-36.2	176.1	0	0	0	0	0	113.3	C825 N826 K833	C825-G829 PolarHBondContact O-N 2.98Å; N826-G829 PolarHBondContact O-N 3.38Å; G829-K833 PolarHBondContact O-N 3.47Å
830	L	92.8	Very high	89.2	Confident	81 Å²	81	65.3 Å²	65.3	42%	0.424	37%	0.366	S	S	.	.	H	α-helix	trans	-67	-45.3	172.9	-74.1	171.8	0	0	0	111.8	N826 Q832 K833 L834	N826-L830 VanDerWaalsContact O-CB 3.3Å; N826-L830 WeakPolarHBondContact O-CB 3.33Å; N826-L830 VanDerWaalsContact O-CG 3.24Å; N826-L830 WeakPolarHBondContact O-CG 3.27Å; N826-L830 PolarHBondContact O-N 3.09Å; L830-Q832 VanDerWaalsContact C-N 3.34Å; L830-Q832 PolarHBondContact O-N 2.7Å; L830-K833 PolarHBondContact O-N 3.07Å; L830-L834 WeakPolarHBondContact O-CB 3.31Å; L830-L834 PolarHBondContact O-N 3.07Å
831	Y	92.8	Very high	89.1	Confident	57 Å²	57	62.7 Å²	62.7	22%	0.224	35%	0.352	C	S	.	.	H	α-helix	trans	-59.9	-44.3	175.5	-172.3	-78.5	0	0	0	111.6	A827 C828 K833 L834 H835 T837 R839 P840	A827-Y831 WeakPolarHBondContact O-CB 3.47Å; A827-Y831 PolarHBondContact O-N 3.33Å; C828-Y831 PolarHBondContact O-N 2.82Å; Y831-K833 VanDerWaalsContact C-N 3.32Å; Y831-K833 PolarHBondContact O-N 2.92Å; Y831-L834 PolarHBondContact O-N 3.46Å; Y831-L834 VanDerWaalsContact O-N 3.15Å; Y831-H835 HydrophobicContact CD1-CB 4.32Å; Y831-H835 AromaticContact CD1-CD2 3.9Å; Y831-H835 AromaticContact CD2-CD2 3.49Å; Y831-H835 VanDerWaalsContact CD2-CD2 3.49Å; Y831-H835 WeakPolarHBondContact CD2-CD2 3.33Å; Y831-H835 AromaticContact CD2-NE2 3.96Å; Y831-H835 HydrophobicContact CE1-CB 3.93Å; Y831-H835 AromaticContact CE1-CD2 3.8Å; Y831-H835 AromaticContact CE2-CD2 3.37Å; Y831-H835 WeakPolarHBondContact CE2-CD2 3.31Å; Y831-H835 AromaticContact CE2-NE2 3.75Å; Y831-H835 AromaticContact CG-CD2 3.76Å; Y831-H835 AromaticContact CZ-CD2 3.53Å; Y831-H835 PolarHBondContact O-N 2.9Å; Y831-T837 WeakPolarHBondContact CD1-O 3.48Å; Y831-R839 HydrophobicContact CD1-CB 3.78Å; Y831-R839 HydrophobicContact CD1-CG 4.24Å; Y831-R839 HydrophobicContact CD2-CB 4.4Å; Y831-R839 HydrophobicContact CD2-CG 3.99Å; Y831-R839 HydrophobicContact CE1-CB 4.43Å; Y831-R839 HydrophobicContact CE2-CG 4.49Å; Y831-R839 HydrophobicContact CG-CB 3.76Å; Y831-R839 HydrophobicContact CG-CG 3.85Å; Y831-P840 VanDerWaalsContact CZ-CD 3.48Å; Y831-P840 WeakPolarHBondContact OH-CD 3.46Å
832	Q	89.6	Confident	88.1	Confident	55 Å²	55	64.5 Å²	64.5	26%	0.257	35%	0.351	S	S	.	.	H	α-helix	trans	-65.3	-32.5	177.8	-170.1	174.9	11.1	0	0	112.8	C828 L830 S836 T837	C828-Q832 WeakPolarHBondContact O-CB 3.39Å; C828-Q832 PolarHBondContact O-N 3.44Å; L830-Q832 VanDerWaalsContact C-N 3.34Å; L830-Q832 PolarHBondContact O-N 2.7Å; Q832-S836 VanDerWaalsContact O-CA 3.29Å; Q832-S836 WeakPolarHBondContact O-CA 3.28Å; Q832-S836 PolarHBondContact O-N 3.22Å; Q832-T837 VanDerWaalsContact CA-O 3.31Å; Q832-T837 WeakPolarHBondContact CA-O 3.47Å
833	K	88.6	Confident	86.9	Confident	185 Å²	185	67.2 Å²	67.2	80%	0.804	36%	0.358	S	S	*	.	H	α-helix	trans	-72.9	-30	172.8	-170.9	174	-179.4	-176.9	0	112.9	G829 L830 Y831	G829-K833 PolarHBondContact O-N 3.47Å; L830-K833 PolarHBondContact O-N 3.07Å; Y831-K833 VanDerWaalsContact C-N 3.32Å; Y831-K833 PolarHBondContact O-N 2.92Å
834	L	91	Very high	85.5	Confident	134 Å²	134	62.7 Å²	62.7	70%	0.702	34%	0.341	S	S	*	.	H	α-helix	trans	-87.2	-34.1	-176.9	-175.7	60.6	0	0	0	113.8	L830 Y831	L830-L834 WeakPolarHBondContact O-CB 3.31Å; L830-L834 PolarHBondContact O-N 3.07Å; Y831-L834 PolarHBondContact O-N 3.46Å; Y831-L834 VanDerWaalsContact O-N 3.15Å
835	H	86.9	Confident	83.7	Confident	93 Å²	93	66.8 Å²	66.8	43%	0.431	36%	0.359	S	S	.	.	H	α-helix	trans	-118.8	9.9	-173.4	-57.2	-70.6	0	0	0	113.7	Y831 T837	Y831-H835 HydrophobicContact CD1-CB 4.32Å; Y831-H835 AromaticContact CD1-CD2 3.9Å; Y831-H835 AromaticContact CD2-CD2 3.49Å; Y831-H835 VanDerWaalsContact CD2-CD2 3.49Å; Y831-H835 WeakPolarHBondContact CD2-CD2 3.33Å; Y831-H835 AromaticContact CD2-NE2 3.96Å; Y831-H835 HydrophobicContact CE1-CB 3.93Å; Y831-H835 AromaticContact CE1-CD2 3.8Å; Y831-H835 AromaticContact CE2-CD2 3.37Å; Y831-H835 WeakPolarHBondContact CE2-CD2 3.31Å; Y831-H835 AromaticContact CE2-NE2 3.75Å; Y831-H835 AromaticContact CG-CD2 3.76Å; Y831-H835 AromaticContact CZ-CD2 3.53Å; Y831-H835 PolarHBondContact O-N 2.9Å; H835-T837 WeakPolarHBondContact O-CB 3.29Å; H835-T837 WeakPolarHBondContact O-CG2 3.42Å; H835-T837 PolarHBondContact O-N 3.37Å; H835-T837 PolarHBondContact O-OG1 3.07Å
836	S	87.7	Confident	81.5	Confident	110 Å²	110	75 Å²	75	77%	0.769	40%	0.397	S	S	*	.	S	Bend	trans	55.6	6.2	-176.9	-54.9	0	0	0	0	115.9	Q832	Q832-S836 VanDerWaalsContact O-CA 3.29Å; Q832-S836 WeakPolarHBondContact O-CA 3.28Å; Q832-S836 PolarHBondContact O-N 3.22Å
837	T	85.9	Confident	79.1	Confident	68 Å²	68	77.6 Å²	77.6	42%	0.417	41%	0.411	S	S	.	.	S	Bend	trans	-133.5	151	-166	48	0	0	0	0	111.1	Y831 Q832 H835 R839	Y831-T837 WeakPolarHBondContact CD1-O 3.48Å; Q832-T837 VanDerWaalsContact CA-O 3.31Å; Q832-T837 WeakPolarHBondContact CA-O 3.47Å; H835-T837 WeakPolarHBondContact O-CB 3.29Å; H835-T837 WeakPolarHBondContact O-CG2 3.42Å; H835-T837 PolarHBondContact O-N 3.37Å; H835-T837 PolarHBondContact O-OG1 3.07Å; T837-R839 PolarHBondContact O-N 3.04Å
838	P	85.6	Confident	77.2	Confident	87 Å²	87	82.1 Å²	82.1	57%	0.565	43%	0.428	S	S	*	.	P	Polyproline II helix	trans	-65.5	134.3	178.5	26.7	-34	0	0	0	111.2	N806 P840	N806-P838 WeakPolarHBondContact ND2-CB 3.37Å; P838-P840 VanDerWaalsContact O-N 3.15Å
839	R	87.6	Confident	75	Confident	34 Å²	34	82 Å²	82	13%	0.128	43%	0.428	C	S	.	.	P	Polyproline II helix	trans	-49.9	121	177.8	-169.9	177.5	178.1	-155.3	-1.4	110.6	N806 C828 Y831 T837 I844 N847	N806-R839 PolarHBondContact ND2-N 3.39Å; N806-R839 VanDerWaalsContact ND2-N 3.17Å; N806-R839 PolarHBondContact ND2-O 3.25Å; N806-R839 PolarHBondContact OD1-O 3.38Å; C828-R839 HydrophobicContact CB-CB 4.47Å; Y831-R839 HydrophobicContact CD1-CB 3.78Å; Y831-R839 HydrophobicContact CD1-CG 4.24Å; Y831-R839 HydrophobicContact CD2-CB 4.4Å; Y831-R839 HydrophobicContact CD2-CG 3.99Å; Y831-R839 HydrophobicContact CE1-CB 4.43Å; Y831-R839 HydrophobicContact CE2-CG 4.49Å; Y831-R839 HydrophobicContact CG-CB 3.76Å; Y831-R839 HydrophobicContact CG-CG 3.85Å; T837-R839 PolarHBondContact O-N 3.04Å; R839-I844 HydrophobicContact CB-CD1 4.16Å; R839-I844 HydrophobicContact CG-CD1 3.89Å; R839-I844 HydrophobicContact CG-CG1 4.05Å; R839-N847 PolarHBondContact NH1-OD1 2.98Å; R839-N847 PolarHBondContact NH2-OD1 3.38Å
840	P	83.2	Confident	72.9	Confident	53 Å²	53	87.2 Å²	87.2	34%	0.344	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-70.6	135.8	-173.7	26.5	-34.5	0	0	0	111.1	Y831 P838 N842 I843 I844	Y831-P840 VanDerWaalsContact CZ-CD 3.48Å; Y831-P840 WeakPolarHBondContact OH-CD 3.46Å; P838-P840 VanDerWaalsContact O-N 3.15Å; P840-N842 PolarHBondContact O-N 2.94Å; P840-N842 VanDerWaalsContact O-N 3.13Å; P840-I843 HydrophobicContact CG-CB 4.35Å; P840-I843 HydrophobicContact CG-CD1 3.68Å; P840-I843 HydrophobicContact CG-CG1 3.95Å; P840-I843 PolarHBondContact O-N 3.27Å; P840-I843 VanDerWaalsContact O-N 3.13Å; P840-I844 PolarHBondContact O-N 2.9Å
841	L	74.1	Confident	71.1	Confident	79 Å²	79	89.8 Å²	89.8	41%	0.414	46%	0.459	S	S	.	.	H	α-helix	trans	-63.3	-22.8	-171.5	-64.7	178	0	0	0	113.9	I844 K845	L841-I844 HydrophobicContact CD2-CD1 4Å; L841-I844 WeakPolarHBondContact O-CB 3.46Å; L841-I844 PolarHBondContact O-N 2.84Å; L841-K845 PolarHBondContact O-N 3.5Å
842	N	63.3	Low	69.2	Low	84 Å²	84	88.5 Å²	88.5	45%	0.449	46%	0.455	S	S	.	.	H	α-helix	trans	-70.3	-39.1	175.7	-74.2	-24.9	0	0	0	112.4	H424 P840 I844 K845	H424-N842 PolarHBondContact NE2-ND2 3.05Å; H424-N842 VanDerWaalsContact NE2-ND2 3.12Å; H424-N842 PolarHBondContact NE2-OD1 3.03Å; P840-N842 PolarHBondContact O-N 2.94Å; P840-N842 VanDerWaalsContact O-N 3.13Å; N842-I844 PolarHBondContact O-N 3.1Å; N842-K845 WeakPolarHBondContact O-CB 3.33Å; N842-K845 PolarHBondContact O-N 2.93Å; N842-K845 VanDerWaalsContact O-N 3.12Å; N842-K845 PolarHBondContact OD1-NZ 3Å
843	I	60.3	Low	67.5	Low	82 Å²	82	89.2 Å²	89.2	42%	0.421	46%	0.46	S	S	.	.	H	α-helix	trans	-67.6	-22.9	174	-59.8	-177.3	0	0	0	111.2	P840	P840-I843 HydrophobicContact CG-CB 4.35Å; P840-I843 HydrophobicContact CG-CD1 3.68Å; P840-I843 HydrophobicContact CG-CG1 3.95Å; P840-I843 PolarHBondContact O-N 3.27Å; P840-I843 VanDerWaalsContact O-N 3.13Å
844	I	63.1	Low	66	Low	11 Å²	11	86.7 Å²	86.7	6%	0.056	45%	0.445	C	S	.	.	H	α-helix	trans	-76.8	-28.1	174.5	-69.3	155.6	0	0	0	111.9	N806 C807 R839 P840 L841 N842 N847 G849	N806-I844 WeakPolarHBondContact OD1-CD1 3.48Å; C807-I844 HydrophobicContact CB-CD1 3.72Å; C807-I844 HydrophobicContact CB-CG1 4.44Å; C807-I844 HydrophobicContact CB-CG2 4.14Å; R839-I844 HydrophobicContact CB-CD1 4.16Å; R839-I844 HydrophobicContact CG-CD1 3.89Å; R839-I844 HydrophobicContact CG-CG1 4.05Å; P840-I844 PolarHBondContact O-N 2.9Å; L841-I844 HydrophobicContact CD2-CD1 4Å; L841-I844 WeakPolarHBondContact O-CB 3.46Å; L841-I844 PolarHBondContact O-N 2.84Å; N842-I844 PolarHBondContact O-N 3.1Å; I844-N847 PolarHBondContact O-N 3.35Å; I844-G849 VanDerWaalsContact O-CA 3.29Å; I844-G849 WeakPolarHBondContact O-CA 3.13Å; I844-G849 PolarHBondContact O-N 2.91Å
845	K	55.2	Low	64.1	Low	89 Å²	89	86.9 Å²	86.9	39%	0.387	44%	0.437	S	S	.	.	I	π-helix	trans	-60.2	-51.4	177.7	-72.5	171.9	178.8	165.1	0	111.9	H424 L841 N842 N847 G849 I853	H424-K845 PolarHBondContact NE2-NZ 2.81Å; L841-K845 PolarHBondContact O-N 3.5Å; N842-K845 WeakPolarHBondContact O-CB 3.33Å; N842-K845 PolarHBondContact O-N 2.93Å; N842-K845 VanDerWaalsContact O-N 3.12Å; N842-K845 PolarHBondContact OD1-NZ 3Å; K845-N847 PolarHBondContact O-N 3.38Å; K845-G849 PolarHBondContact O-N 2.96Å; K845-G849 VanDerWaalsContact O-N 3.11Å; K845-I853 HydrophobicContact CG-CD1 3.86Å
846	Q	50.2	Low	62.3	Low	179 Å²	179	86.1 Å²	86.1	84%	0.836	43%	0.43	S	S	*	.	I	π-helix	trans	-65	-4.8	-178.6	-66.5	179	-21.6	0	0	114.4
847	N	43.7	Very low	60.3	Low	89 Å²	89	85.6 Å²	85.6	48%	0.476	42%	0.422	S	S	.	.	I	π-helix	trans	-122.4	50.9	-170.2	179.3	-138	0	0	0	110.5	R839 I844 K845 G849	R839-N847 PolarHBondContact NH1-OD1 2.98Å; R839-N847 PolarHBondContact NH2-OD1 3.38Å; I844-N847 PolarHBondContact O-N 3.35Å; K845-N847 PolarHBondContact O-N 3.38Å; N847-G849 VanDerWaalsContact C-N 3.35Å
848	N	51.3	Low	58.3	Low	141 Å²	141	92.5 Å²	92.5	75%	0.754	44%	0.441	S	S	*	.	I	π-helix	trans	66.9	24.3	-173.8	-52.8	-19.4	0	0	0	115	E850	N848-E850 VanDerWaalsContact C-N 3.3Å; N848-E850 PolarHBondContact O-N 3.34Å
849	G	48.5	Very low	56.1	Low	0 Å²	0	97.4 Å²	97.4	0%	0	45%	0.453	C	S	.	.	I	π-helix	trans	-68.1	-22	-174.6	0	0	0	0	0	115.3	I844 K845 N847 Q851 I852 I853	I844-G849 VanDerWaalsContact O-CA 3.29Å; I844-G849 WeakPolarHBondContact O-CA 3.13Å; I844-G849 PolarHBondContact O-N 2.91Å; K845-G849 PolarHBondContact O-N 2.96Å; K845-G849 VanDerWaalsContact O-N 3.11Å; N847-G849 VanDerWaalsContact C-N 3.35Å; G849-Q851 PolarHBondContact O-N 2.92Å; G849-I852 WeakPolarHBondContact O-CA 3.44Å; G849-I852 WeakPolarHBondContact O-CB 3.27Å; G849-I852 PolarHBondContact O-N 2.93Å; G849-I853 WeakPolarHBondContact O-CG1 3.47Å; G849-I853 PolarHBondContact O-N 3.32Å
850	E	50.7	Low	53.7	Low	120 Å²	120	106.4 Å²	106.4	56%	0.561	49%	0.487	S	S	*	.	H	α-helix	trans	-63.4	-34.1	-174.1	-106	-158.9	99.6	0	0	115	N848 I852 R854	N848-E850 VanDerWaalsContact C-N 3.3Å; N848-E850 PolarHBondContact O-N 3.34Å; E850-I852 VanDerWaalsContact C-N 3.33Å; E850-R854 WeakPolarHBondContact O-CG 3.45Å; E850-R854 PolarHBondContact O-N 3.23Å; E850-R854 PolarHBondContact O-NH1 2.82Å; E850-R854 VanDerWaalsContact O-NH1 3.15Å; E850-R854 IonicContact OE1-CZ 3.81Å; E850-R854 IonicContact OE1-NH1 2.77Å; E850-R854 PolarHBondContact OE1-NH1 2.93Å; E850-R854 IonicContact OE1-NH2 3.62Å; E850-R854 PolarHBondContact OE1-NH2 3.48Å
851	Q	53.3	Low	51.4	Low	136 Å²	136	111.5 Å²	111.5	64%	0.636	51%	0.511	S	S	*	.	H	α-helix	trans	-74.1	-26.1	172.8	-69.7	-161.9	10.1	0	0	112.4	G849	G849-Q851 PolarHBondContact O-N 2.92Å
852	I	53.9	Low	49.2	Very low	30 Å²	30	114.9 Å²	114.9	15%	0.154	53%	0.529	C	S	.	.	H	α-helix	trans	-77.4	-39.9	179	-51.1	175.8	0	0	0	109.5	C807 G849 E850 R855 R856	C807-I852 VanDerWaalsContact O-CG2 3.31Å; C807-I852 WeakPolarHBondContact O-CG2 3.41Å; G849-I852 WeakPolarHBondContact O-CA 3.44Å; G849-I852 WeakPolarHBondContact O-CB 3.27Å; G849-I852 PolarHBondContact O-N 2.93Å; E850-I852 VanDerWaalsContact C-N 3.33Å; I852-R855 PolarHBondContact O-N 2.93Å; I852-R856 PolarHBondContact O-N 3.48Å
853	I	54.3	Low	47.8	Very low	69 Å²	69	115.1 Å²	115.1	35%	0.354	54%	0.535	S	S	.	.	H	α-helix	trans	-67.2	-40.2	176.8	-65.7	166.9	0	0	0	111.3	K845 G849 R855 R856 T857	K845-I853 HydrophobicContact CG-CD1 3.86Å; G849-I853 WeakPolarHBondContact O-CG1 3.47Å; G849-I853 PolarHBondContact O-N 3.32Å; I853-R855 PolarHBondContact O-N 2.68Å; I853-R856 WeakPolarHBondContact O-CA 3.15Å; I853-R856 VanDerWaalsContact O-CB 3.23Å; I853-R856 WeakPolarHBondContact O-CB 3.42Å; I853-R856 PolarHBondContact O-N 3.5Å; I853-T857 PolarHBondContact O-N 2.77Å
854	R	55.2	Low	46.4	Very low	133 Å²	133	118.6 Å²	118.6	50%	0.502	56%	0.555	S	S	.	*	H	α-helix	trans	-62.8	-20.3	174.5	-74.3	-178.5	-178.2	78.8	-5.3	114.2	E850 R858	E850-R854 WeakPolarHBondContact O-CG 3.45Å; E850-R854 PolarHBondContact O-N 3.23Å; E850-R854 PolarHBondContact O-NH1 2.82Å; E850-R854 VanDerWaalsContact O-NH1 3.15Å; E850-R854 IonicContact OE1-CZ 3.81Å; E850-R854 IonicContact OE1-NH1 2.77Å; E850-R854 PolarHBondContact OE1-NH1 2.93Å; E850-R854 IonicContact OE1-NH2 3.62Å; E850-R854 PolarHBondContact OE1-NH2 3.48Å; R854-R858 WeakPolarHBondContact O-CG 3.29Å
855	R	52.2	Low	45	Very low	137 Å²	137	124.5 Å²	124.5	52%	0.517	59%	0.591	S	S	.	*	H	α-helix	trans	-85.2	-18.7	169.7	-67.2	-178.5	-172.9	133	13.5	113.4	I852 I853	I852-R855 PolarHBondContact O-N 2.93Å; I853-R855 PolarHBondContact O-N 2.68Å
856	R	49.3	Very low	44	Very low	78 Å²	78	128.5 Å²	128.5	29%	0.294	62%	0.616	S	S	.	*	H	α-helix	trans	-76	-34.5	179.6	-170.1	-179.9	-64.1	-145.4	-5.3	112.2	C807 L808 I852 I853	C807-R856 VanDerWaalsContact C-NH2 3.32Å; C807-R856 PolarHBondContact O-NH2 3.24Å; L808-R856 HydrophobicContact CD1-CG 3.83Å; I852-R856 PolarHBondContact O-N 3.48Å; I853-R856 WeakPolarHBondContact O-CA 3.15Å; I853-R856 VanDerWaalsContact O-CB 3.23Å; I853-R856 WeakPolarHBondContact O-CB 3.42Å; I853-R856 PolarHBondContact O-N 3.5Å
857	T	46	Very low	42.9	Very low	99 Å²	99	125.5 Å²	125.5	61%	0.607	62%	0.615	S	S	*	*	H	α-helix	trans	-79.7	-46.8	175.5	38.2	0	0	0	0	112.9	I853 K859 R860	I853-T857 PolarHBondContact O-N 2.77Å; T857-K859 PolarHBondContact O-N 3.04Å; T857-R860 PolarHBondContact O-N 2.92Å
858	R	44.3	Very low	42.1	Very low	213 Å²	213	126 Å²	126	80%	0.804	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.4	4.8	-179.3	-64.3	-170.9	-168.2	-165.3	3.5	115.7	R854	R854-R858 WeakPolarHBondContact O-CG 3.29Å
859	K	39.3	Very low	40.9	Very low	189 Å²	189	128.9 Å²	128.9	82%	0.822	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.9	20.4	-178.1	-130.5	-172.9	-176.4	-162	0	114.7	T857	T857-K859 PolarHBondContact O-N 3.04Å
860	R	36.2	Very low	40.1	Very low	223 Å²	223	135.1 Å²	135.1	84%	0.842	67%	0.668	S	S	*	*	S	Bend	trans	-116.1	4.5	167.7	-78.2	-169.2	174.9	-91.7	4.3	113.9	T857	T857-R860 PolarHBondContact O-N 2.92Å
861	L	35	Very low	39.3	Very low	160 Å²	160	135.3 Å²	135.3	84%	0.838	68%	0.679	S	S	*	*	S	Bend	trans	-133.9	75.6	175.9	-67	175.7	0	0	0	109.9
862	N	28.6	Very low	38.1	Very low	151 Å²	151	132.4 Å²	132.4	81%	0.807	68%	0.679	S	S	*	*				170.7	142.3	127.3	-155.5	53.5	0	0	0	109.5
863	P	33.5	Very low	37.4	Very low	89 Å²	89	134.6 Å²	134.6	58%	0.578	70%	0.695	S	S	*	*			trans	-76.4	157.3	169.5	-13.3	30.3	0	0	0	113.6
864	D	30.7	Very low	36.3	Very low	155 Å²	155	138.3 Å²	138.3	83%	0.829	71%	0.709	S	S	*	*			trans	53.5	142.3	146.3	-52.8	-39.4	0	0	0	123.6
865	T	33.2	Very low	35.1	Very low	134 Å²	134	139 Å²	139	82%	0.822	72%	0.717	S	S	*	*			trans	-151.7	104.4	173.6	54.1	0	0	0	0	110.9
866	L	34.3	Very low	34.1	Very low	173 Å²	173	139.5 Å²	139.5	91%	0.906	73%	0.726	S	S	*	*			trans	-154.5	155.5	159.6	-72.2	-175	0	0	0	106.3
867	S	27.2	Very low	33.2	Very low	117 Å²	117	145.5 Å²	145.5	82%	0.818	75%	0.748	S	S	*	*			cis	-143.3	-168.2	3	-142.5	0	0	0	0	110.6
868	S	26.8	Very low	32.3	Very low	100 Å²	100	147 Å²	147	70%	0.699	75%	0.752	S	S	*	*			trans	-130.9	140.3	-178.4	157.3	0	0	0	0	110.7
869	E	27.1	Very low	31.4	Very low	200 Å²	200	143 Å²	143	94%	0.935	75%	0.751	S	S	*	*			trans	-167.4	-175.3	130.9	-110	-179.3	108.2	0	0	114
870	N	30.5	Very low	30.7	Very low	132 Å²	132	138.2 Å²	138.2	71%	0.706	74%	0.741	S	S	*	*			trans	-120.9	167.4	-158.1	-147.2	-17.3	0	0	0	110.4
871	P	34.7	Very low	30.2	Very low	123 Å²	123	136.1 Å²	136.1	80%	0.799	74%	0.741	S	S	*	*				-145.7	172.5	79	36.4	-16.9	0	0	0	116.2
872	A	27.3	Very low	29.8	Very low	76 Å²	76	135.3 Å²	135.3	63%	0.628	73%	0.733	S	S	*	*			trans	-89.5	-161.3	179.7	0	0	0	0	0	111.3
873	P	40.4	Very low	29.8	Very low	76 Å²	76	137.6 Å²	137.6	49%	0.494	73%	0.73	S	S	.	*			cis	-147.3	-175.6	29	44.8	-23.5	0	0	0	118.3
874	K	30.2	Very low	29.6	Very low	146 Å²	146	141.3 Å²	141.3	64%	0.635	74%	0.744	S	S	*	*			trans	76.6	141.9	165.8	-59.9	168.4	-173.2	175.6	0	115.3
875	Q	31.1	Very low	29.4	Very low	147 Å²	147	141.9 Å²	141.9	69%	0.687	75%	0.747	S	S	*	*			cis	-148.6	156.1	3.4	-131	167.1	-67.1	0	0	114
876	Q	31.3	Very low	29.2	Very low	148 Å²	148	138.4 Å²	138.4	69%	0.692	74%	0.738	S	S	*	*			trans	10.6	153.3	141.4	-70.4	170	-30.6	0	0	121.6
877	R	28.6	Very low	28.8	Very low	204 Å²	204	138.8 Å²	138.8	77%	0.77	74%	0.735	S	S	*	*			cis	-169.3	125.4	-15.9	-175	177.1	-165.7	174.2	3.7	110.1
878	I	28.1	Very low	28.7	Very low	132 Å²	132	140.9 Å²	140.9	68%	0.677	73%	0.732	S	S	*	*			trans	28	143.2	138	-34.3	165.8	0	0	0	120.2
879	T	25.8	Very low	28.9	Very low	128 Å²	128	142.4 Å²	142.4	79%	0.785	73%	0.732	S	S	*	*			trans	68.5	147.6	156.6	37.2	0	0	0	0	117.6
880	S	24.7	Very low	29	Very low	88 Å²	88	139.2 Å²	139.2	62%	0.615	72%	0.721	S	S	*	*			cis	-170.4	176.4	-14.4	44.3	0	0	0	0	110.2
881	E	25.5	Very low	28.8	Very low	180 Å²	180	137.8 Å²	137.8	84%	0.841	72%	0.717	S	S	*	*			trans	20.7	137.1	138.3	-69.3	161.7	-180	0	0	119.5
882	E	26	Very low	28.6	Very low	142 Å²	142	142.4 Å²	142.4	66%	0.664	72%	0.719	S	S	*	*			cis	-172.4	167	2.7	-169.8	-162.9	58.3	0	0	109.2
883	R	27.7	Very low	28.6	Very low	200 Å²	200	144.1 Å²	144.1	76%	0.755	73%	0.727	S	S	*	*			trans	82	156.5	158.8	-44.4	-179.2	104.6	98.6	-6.6	121.1
884	L	30.5	Very low	27.9	Very low	166 Å²	166	146.4 Å²	146.4	87%	0.869	74%	0.743	S	S	*	*			trans	102.8	136.4	156.2	-53.2	-174.1	0	0	0	119
885	N	26.1	Very low	28.5	Very low	167 Å²	167	145.5 Å²	145.5	89%	0.893	75%	0.752	S	S	*	*			trans	-98.2	175.2	-171	-69.3	-4.7	0	0	0	113
886	G	28.7	Very low	28.2	Very low	62 Å²	62	143.7 Å²	143.7	64%	0.639	76%	0.755	S	S	*	*			trans	106.7	106.3	165.5	0	0	0	0	0	111.5
887	E	26.8	Very low	28.1	Very low	181 Å²	181	142 Å²	142	85%	0.846	76%	0.755	S	S	*	*				73	116.7	50.9	-57.8	-174.7	116.2	0	0	114.4
888	E	25.5	Very low	28	Very low	160 Å²	160	141.6 Å²	141.6	75%	0.748	76%	0.759	S	S	*	*			trans	56	139.7	135.1	-62.6	-70.8	91.7	0	0	120.1
889	L	30.6	Very low	27.9	Very low	132 Å²	132	139.8 Å²	139.8	69%	0.691	76%	0.758	S	S	*	*			cis	-161.6	-169.9	-5.5	-175.1	53.9	0	0	0	108.4
890	D	28.1	Very low	28	Very low	133 Å²	133	142.6 Å²	142.6	71%	0.711	76%	0.762	S	S	*	*			trans	80.8	141.3	163.3	-77.9	-49.8	0	0	0	117.2
891	T	27.2	Very low	28.2	Very low	102 Å²	102	146.4 Å²	146.4	63%	0.626	77%	0.77	S	S	*	*			cis	-156.8	131.2	43.5	-52.9	0	0	0	0	115
892	R	30.2	Very low	28.7	Very low	220 Å²	220	143.4 Å²	143.4	83%	0.83	77%	0.766	S	S	*	*			trans	68.1	107.4	151.8	-69.1	166.9	-155.4	165	7.2	124.1
893	S	27.6	Very low	28.9	Very low	113 Å²	113	141.3 Å²	141.3	79%	0.79	77%	0.767	S	S	*	*				71.9	114.8	111.4	-54	0	0	0	0	125.6
894	C	25.8	Very low	29.4	Very low	123 Å²	123	138.1 Å²	138.1	83%	0.831	77%	0.773	S	S	*	*			trans	-25	170.8	138.2	-58.4	0	0	0	0	118.5
895	P	42.3	Very low	29.4	Very low	127 Å²	127	141.3 Å²	141.3	83%	0.825	77%	0.773	S	S	*	*			cis	-142.3	-163.4	29.2	38.5	-15.4	0	0	0	115.8
896	S	25.4	Very low	29.5	Very low	109 Å²	109	136 Å²	136	76%	0.762	75%	0.749	S	S	*	*			cis	-171.2	178.3	-45.5	-174.9	0	0	0	0	110.5
897	V	29.1	Very low	29.5	Very low	114 Å²	114	139.3 Å²	139.3	69%	0.691	74%	0.742	S	S	*	*			trans	97	99.1	158	-168.2	0	0	0	0	121.8
898	K	26.7	Very low	29.7	Very low	195 Å²	195	135.2 Å²	135.2	85%	0.848	73%	0.734	S	S	*	*			trans	48.2	130.7	136.8	-53.6	174.4	-176	176	0	123.6
899	S	25.3	Very low	30.6	Very low	93 Å²	93	132.9 Å²	132.9	65%	0.65	73%	0.733	S	S	*	*				143.8	131.9	102.2	-158.2	0	0	0	0	118.3
900	Q	28.3	Very low	30.6	Very low	188 Å²	188	138 Å²	138	88%	0.879	74%	0.743	S	S	*	*			trans	70	159.4	146.1	-76.4	171	60.7	0	0	124.9
901	Q	28.8	Very low	30.7	Very low	167 Å²	167	136 Å²	136	78%	0.78	74%	0.739	S	S	*	*			trans	-88	176	175.4	-91.6	-106.9	-18.2	0	0	111.1
902	P	36.6	Very low	31	Very low	118 Å²	118	136.3 Å²	136.3	77%	0.766	74%	0.741	S	S	*	*			cis	-145.6	-160.5	30.1	43.3	-20.8	0	0	0	117.3
903	S	30.3	Very low	31	Very low	98 Å²	98	133.5 Å²	133.5	69%	0.685	74%	0.737	S	S	*	*			trans	-102.2	164	175.4	-51.6	0	0	0	0	114.6
904	P	38	Very low	31	Very low	133 Å²	133	131.6 Å²	131.6	86%	0.864	73%	0.728	S	S	*	*				-141.3	-171.1	125.8	36.4	-20.8	0	0	0	115.2
905	R	30.2	Very low	30.9	Very low	232 Å²	232	134.6 Å²	134.6	88%	0.875	73%	0.727	S	S	*	*			trans	-117.3	177.6	-166.3	-79.8	-176.6	165.4	-158.2	-2.5	115.2
906	S	28.9	Very low	30.3	Very low	57 Å²	57	136 Å²	136	40%	0.399	73%	0.728	S	S	.	*			trans	100.5	159.2	146.2	80.8	0	0	0	0	118.2	R702 V703	R702-S906 VanDerWaalsContact CA-OG 3.28Å; R702-S906 WeakPolarHBondContact CA-OG 3.13Å; V703-S906 WeakPolarHBondContact CG2-OG 3.49Å; V703-S906 PolarHBondContact N-OG 3.01Å; V703-S906 VanDerWaalsContact N-OG 3.14Å
907	R	27.5	Very low	30.6	Very low	130 Å²	130	135 Å²	135	49%	0.491	73%	0.725	S	S	.	*			cis	-155.6	161	-4.8	-129.9	167.5	-164.5	-139.5	-7	110.2	E701	E701-R907 IonicContact OE1-CZ 2.63Å; E701-R907 IonicContact OE1-NE 2.65Å; E701-R907 IonicContact OE1-NH1 2.68Å; E701-R907 PolarHBondContact OE1-NH1 2.81Å
908	S	32.1	Very low	30.5	Very low	96 Å²	96	136.5 Å²	136.5	67%	0.671	73%	0.73	S	S	*	*			trans	-79.4	169.5	176.4	173.7	0	0	0	0	113.7
909	P	43.3	Very low	30.5	Very low	111 Å²	111	134.5 Å²	134.5	72%	0.721	72%	0.723	S	S	*	*				-149.2	154.4	119	38.8	-23.3	0	0	0	118.9
910	R	30.3	Very low	30.6	Very low	240 Å²	240	135.6 Å²	135.6	91%	0.906	73%	0.726	S	S	*	*			trans	68.3	163.8	148.9	-76.3	-173.2	161.4	177.9	-5.6	120.1
911	S	30.9	Very low	31	Very low	90 Å²	90	133.9 Å²	133.9	63%	0.629	72%	0.722	S	S	*	*			cis	172.9	155.7	-25.5	-165.7	0	0	0	0	108.4
912	T	33.8	Very low	31.4	Very low	108 Å²	108	133 Å²	133	66%	0.663	72%	0.718	S	S	*	*			cis	-122.9	-109	6.3	-33.5	0	0	0	0	111.7
913	Q	29	Very low	31.2	Very low	162 Å²	162	133 Å²	133	76%	0.757	71%	0.71	S	S	*	*			cis	-160.7	146.5	-11.8	-134.8	136.7	-82.2	0	0	105.7
914	A	29	Very low	31.1	Very low	73 Å²	73	135.7 Å²	135.7	60%	0.603	71%	0.712	S	S	*	*			cis	80.7	132	28.6	0	0	0	0	0	114.1
915	F	23.8	Very low	30.8	Very low	185 Å²	185	137.8 Å²	137.8	81%	0.811	70%	0.702	S	S	*	*			cis	-163.6	154.8	12.6	-146.4	-135	0	0	0	114.7
916	L	28.9	Very low	30.9	Very low	158 Å²	158	137.3 Å²	137.3	83%	0.827	70%	0.701	S	S	*	*			trans	61.2	172.1	156.2	-81.9	178.4	0	0	0	122.8
917	A	31.4	Very low	30.7	Very low	87 Å²	87	143.1 Å²	143.1	72%	0.719	72%	0.724	S	S	*	*			trans	-143.8	177.6	-161.1	0	0	0	0	0	113.9
918	N	26.6	Very low	31.1	Very low	145 Å²	145	142.3 Å²	142.3	78%	0.775	74%	0.735	S	S	*	*			trans	-155.2	150.7	174.6	-90.2	-52.9	0	0	0	107.6
919	Q	28.5	Very low	31.5	Very low	154 Å²	154	141.7 Å²	141.7	72%	0.72	73%	0.729	S	S	*	*			cis	-166.5	116.6	-11.7	-160.3	170.5	96.6	0	0	105.4
920	T	27.4	Very low	31.1	Very low	116 Å²	116	140.4 Å²	140.4	71%	0.712	72%	0.716	S	S	*	*				35.2	129.4	99.3	37.3	0	0	0	0	115.5
921	L	36.6	Very low	30.9	Very low	152 Å²	152	134.7 Å²	134.7	80%	0.796	70%	0.703	S	S	*	*			cis	-151.8	158.9	11.8	-91.4	156.2	0	0	0	111.4
922	E	37.3	Very low	30.8	Very low	149 Å²	149	137.6 Å²	137.6	70%	0.696	71%	0.71	S	S	*	*			trans	177.9	161.7	143.3	-84.7	-35.5	-102.5	0	0	109
923	I	30.7	Very low	30.7	Very low	117 Å²	117	137.7 Å²	137.7	60%	0.6	71%	0.713	S	S	*	*			cis	94.8	126.9	14	-61.4	-179.8	0	0	0	113.9
924	H	30	Very low	30.4	Very low	154 Å²	154	135.1 Å²	135.1	71%	0.713	71%	0.712	S	S	*	*			cis	-151	130.6	-6	-135.1	-135.4	0	0	0	114.4
925	R	30.8	Very low	30.6	Very low	177 Å²	177	140.3 Å²	140.3	67%	0.668	72%	0.724	S	S	*	*			trans	51.6	134.8	133.6	-80.5	-168	170.2	113.8	-3.9	126
926	R	31.6	Very low	30.9	Very low	222 Å²	222	137 Å²	137	84%	0.838	72%	0.721	S	S	*	*			trans	116.4	141.4	136.6	-81.5	163.6	178	129.3	-4.9	119.5
927	M	24.8	Very low	31.2	Very low	179 Å²	179	135.1 Å²	135.1	88%	0.882	72%	0.721	S	S	*	*			trans	-105.6	173.9	173.6	-115	-175.3	-79.6	0	0	109.3
928	P	36.5	Very low	31.3	Very low	113 Å²	113	136.5 Å²	136.5	73%	0.734	72%	0.723	S	S	*	*			cis	-147.5	-141.7	39.3	41.8	-17.6	0	0	0	113.3
929	P	40.4	Very low	31.2	Very low	84 Å²	84	132.6 Å²	132.6	55%	0.545	72%	0.716	S	S	.	*				-122.6	-177	-52.4	28.2	-7.3	0	0	0	114.5
930	L	34.9	Very low	31.1	Very low	84 Å²	84	131.4 Å²	131.4	44%	0.44	73%	0.725	S	S	.	*			trans	-61.4	159.4	173.6	-62	178.2	0	0	0	115.7	R682 G683	R682-L930 WeakPolarHBondContact CD-O 3.19Å; R682-L930 WeakPolarHBondContact CG-O 3.48Å; R682-L930 PolarHBondContact NE-O 3.47Å; R682-L930 PolarHBondContact NH1-O 3.16Å; G683-L930 VanDerWaalsContact C-CD1 3.41Å; G683-L930 WeakPolarHBondContact O-CD1 3.4Å
931	L	25.2	Very low	31.2	Very low	120 Å²	120	134.4 Å²	134.4	63%	0.628	73%	0.733	S	S	*	*			trans	-170	156.7	142.9	-111.3	-169.5	0	0	0	114.1	R682	R682-L931 HydrophobicContact CG-CD2 4.47Å; R682-L931 HydrophobicContact CG-CG 4.25Å; R682-L931 VanDerWaalsContact CZ-CD1 3.44Å
932	L	30.3	Very low	30.8	Very low	150 Å²	150	133.3 Å²	133.3	79%	0.785	73%	0.733	S	S	*	*			trans	-93.1	171.9	153.7	-71.9	99.3	0	0	0	108.4
933	P	32	Very low	30.5	Very low	111 Å²	111	130 Å²	130	72%	0.721	73%	0.731	S	S	*	*			cis	-147.2	-152.1	20.4	44.7	-22.7	0	0	0	115.3
934	S	21.8	Very low	30.4	Very low	107 Å²	107	132.1 Å²	132.1	75%	0.748	74%	0.739	S	S	*	*			trans	89.9	130.6	151.5	69.4	0	0	0	0	120.5
935	H	33	Very low	30.6	Very low	183 Å²	183	129.5 Å²	129.5	85%	0.847	74%	0.738	S	S	*	*			trans	-72	156.2	158	-56.5	-93.8	0	0	0	109.4
936	P	30.1	Very low	30.7	Very low	114 Å²	114	127.5 Å²	127.5	74%	0.74	74%	0.74	S	S	*	*				-142.9	157	93.4	38.3	-25.9	0	0	0	114.9
937	S	35.6	Very low	30.6	Very low	120 Å²	120	120.9 Å²	120.9	84%	0.839	74%	0.741	S	S	*	*			trans	-94.7	129.8	154.5	-54.3	0	0	0	0	109.3
938	P	32.5	Very low	30.7	Very low	116 Å²	116	115.4 Å²	115.4	75%	0.753	73%	0.731	S	S	*	*			trans	-130.5	-177.2	148.9	34.7	-20.7	0	0	0	112.6
939	G	24.7	Very low	30.4	Very low	62 Å²	62	118.1 Å²	118.1	64%	0.639	74%	0.737	S	S	*	*			trans	-58.1	159.1	-172.3	0	0	0	0	0	116.1
940	S	27.9	Very low	30	Very low	129 Å²	129	120.3 Å²	120.3	90%	0.902	75%	0.749	S	S	*	*			cis	74.1	78.6	48.3	-175.8	0	0	0	0	113.8
941	M	27.8	Very low	29.8	Very low	179 Å²	179	123.9 Å²	123.9	88%	0.882	77%	0.768	S	S	*	*			trans	-162.3	140.8	157.6	52.2	-173.5	176.4	0	0	106
942	V	29.6	Very low	29.9	Very low	129 Å²	129	121.7 Å²	121.7	78%	0.782	78%	0.775	S	S	*	*			cis	-121.9	150.6	11.1	-71	0	0	0	0	109.4
943	A	30.1	Very low	29.7	Very low	81 Å²	81	118 Å²	118	67%	0.669	77%	0.773	S	S	*	*				61.9	132.4	53.5	0	0	0	0	0	112.2
944	E	29.6	Very low	29.5	Very low	161 Å²	161	120.3 Å²	120.3	75%	0.752	78%	0.778	S	S	*	*			cis	-150.2	178.5	3.8	-126.3	175.1	119.2	0	0	107.9	N946	E944-N946 PolarHBondContact OE1-ND2 3.43Å
945	S	32.5	Very low	29.7	Very low	99 Å²	99	121.3 Å²	121.3	69%	0.692	78%	0.78	S	S	*	*			cis	-171.1	168.6	13.2	41.7	0	0	0	0	107.3
946	N	34.2	Very low	29.5	Very low	134 Å²	134	117.2 Å²	117.2	72%	0.717	77%	0.772	S	S	*	*			cis	-161.8	137.5	-25.5	-91.8	-35.7	0	0	0	104.1	E944	E944-N946 PolarHBondContact OE1-ND2 3.43Å
947	G	28.6	Very low	29.4	Very low	83 Å²	83	120.6 Å²	120.6	86%	0.856	78%	0.775	S	S	*	*				114.9	155.9	77.7	0	0	0	0	0	109.2
948	G	28.2	Very low	28.9	Very low	65 Å²	65	121.4 Å²	121.4	67%	0.67	77%	0.769	S	S	*	*			cis	170.3	168.5	-7.5	0	0	0	0	0	110.7
949	I	29.1	Very low	28.6	Very low	170 Å²	170	123.2 Å²	123.2	87%	0.872	77%	0.768	S	S	*	*			trans	59.9	141.2	166.8	14.9	-176	0	0	0	116.5
950	T	31.8	Very low	28.7	Very low	130 Å²	130	126.5 Å²	126.5	80%	0.798	78%	0.775	S	S	*	*			cis	-139.8	160.5	28.9	55.8	0	0	0	0	115.7
951	D	30.7	Very low	28.6	Very low	158 Å²	158	123.8 Å²	123.8	85%	0.845	77%	0.767	S	S	*	*			trans	-58.1	175.9	167	-72.7	-80.7	0	0	0	115.4
952	G	27.9	Very low	28.6	Very low	75 Å²	75	125.3 Å²	125.3	77%	0.773	77%	0.769	S	S	*	*			trans	-172.2	-28.2	165.7	0	0	0	0	0	123.1
953	G	26.8	Very low	28.3	Very low	71 Å²	71	122.9 Å²	122.9	73%	0.732	77%	0.77	S	S	*	*			trans	67.5	134.2	163.7	0	0	0	0	0	122.3
954	L	27.5	Very low	28.1	Very low	160 Å²	160	123.2 Å²	123.2	84%	0.838	78%	0.782	S	S	*	*			trans	77.6	129.2	135	-64.6	166.9	0	0	0	123.5
955	T	26.1	Very low	27.9	Very low	129 Å²	129	118.9 Å²	118.9	79%	0.791	78%	0.78	S	S	*	*			trans	69.8	146.1	147.2	54	0	0	0	0	120.6
956	S	27.8	Very low	27.7	Very low	97 Å²	97	119.2 Å²	119.2	68%	0.678	78%	0.782	S	S	*	*			cis	-170.6	155	-16.7	56.2	0	0	0	0	114.1
957	K	28.3	Very low	27.5	Very low	185 Å²	185	118.9 Å²	118.9	80%	0.804	78%	0.776	S	S	*	*			trans	67.9	142	142.4	-92	-176.5	163.5	-172.9	0	122.6
958	L	26	Very low	27.5	Very low	136 Å²	136	125.7 Å²	125.7	71%	0.712	78%	0.776	S	S	*	*			trans	64.8	155.8	153.8	-90.1	81.5	0	0	0	117.9
959	E	25.1	Very low	27.3	Very low	155 Å²	155	126.2 Å²	126.2	72%	0.724	78%	0.782	S	S	*	*			cis	-164.7	170.2	-29.3	-138.5	-179.3	-141.7	0	0	110.4
960	V	26	Very low	27.6	Very low	131 Å²	131	123.8 Å²	123.8	79%	0.794	78%	0.779	S	S	*	*			trans	63	140.3	155.3	172.8	0	0	0	0	120.3
961	G	26.4	Very low	28.2	Very low	71 Å²	71	122.9 Å²	122.9	73%	0.732	78%	0.776	S	S	*	*			trans	112.9	124.4	156.7	0	0	0	0	0	115.2
962	K	27.7	Very low	27.9	Very low	212 Å²	212	123 Å²	123	92%	0.922	78%	0.775	S	S	*	*			cis	109.2	95.5	8.2	-169.3	-174.4	174.8	-176.6	0	115.1
963	G	23.7	Very low	27.9	Very low	77 Å²	77	127.6 Å²	127.6	79%	0.794	78%	0.776	S	S	*	*			trans	118	141.8	142.9	0	0	0	0	0	119.5
964	G	25.6	Very low	27.9	Very low	89 Å²	89	132 Å²	132	92%	0.918	78%	0.775	S	S	*	*			trans	74.5	150.5	164.4	0	0	0	0	0	116.7
965	G	26.1	Very low	28	Very low	69 Å²	69	133.5 Å²	133.5	71%	0.711	77%	0.771	S	S	*	*			cis	-150.5	157.1	-10	0	0	0	0	0	108.6
966	S	28.8	Very low	28.1	Very low	107 Å²	107	136 Å²	136	75%	0.748	78%	0.776	S	S	*	*				54.5	130	81.5	-102	0	0	0	0	114.3
967	E	29.9	Very low	28.3	Very low	126 Å²	126	141.9 Å²	141.9	59%	0.589	78%	0.783	S	S	*	*			cis	-170.5	161.3	-0.3	41.9	-168.2	77.8	0	0	115.1
968	R	27.5	Very low	28.5	Very low	227 Å²	227	138.5 Å²	138.5	86%	0.857	78%	0.78	S	S	*	*			trans	52.7	131.6	150.1	-69.8	160.6	172	155.9	-10.9	121.2
969	G	25.4	Very low	28.6	Very low	76 Å²	76	137.2 Å²	137.2	78%	0.784	78%	0.783	S	S	*	*			trans	150.3	113.9	151.6	0	0	0	0	0	116.9
970	S	35	Very low	28.9	Very low	118 Å²	118	139.4 Å²	139.4	83%	0.825	79%	0.79	S	S	*	*			trans	-142.4	170.3	165.1	-55.9	0	0	0	0	106.6
971	P	44.1	Very low	29.3	Very low	112 Å²	112	139 Å²	139	73%	0.727	79%	0.79	S	S	*	*			cis	-145.4	-158.9	16.9	42.8	-21	0	0	0	115.8
972	I	24.4	Very low	29.3	Very low	160 Å²	160	141.2 Å²	141.2	82%	0.821	79%	0.794	S	S	*	*			trans	88	156.3	158.4	-72.9	167.7	0	0	0	118
973	E	28.3	Very low	29.3	Very low	172 Å²	172	137.1 Å²	137.1	80%	0.804	79%	0.792	S	S	*	*			trans	-106.1	-177.7	-151.3	-50.1	174.1	113.5	0	0	114.9
974	K	26.7	Very low	29.5	Very low	164 Å²	164	144.1 Å²	144.1	71%	0.713	80%	0.796	S	S	*	*			trans	84.8	131	175.1	-54.8	-179.3	172	-175.5	0	114.1
975	Y	29.6	Very low	29.6	Very low	191 Å²	191	144.4 Å²	144.4	75%	0.749	78%	0.784	S	S	*	*			cis	-141.2	-175.8	-5.7	-84	-43.8	0	0	0	107.5
976	M	28.2	Very low	31.2	Very low	182 Å²	182	146.2 Å²	146.2	90%	0.897	78%	0.783	S	S	*	*			cis	-140	-156.6	17	-56.6	170.9	69.7	0	0	111.2
977	R	32.6	Very low	31.4	Very low	219 Å²	219	147.4 Å²	147.4	83%	0.826	79%	0.789	S	S	*	*			trans	-147	145	169.2	-177.4	-161.9	-66.8	135	-3.2	108.4
978	P	32.3	Very low	31.1	Very low	114 Å²	114	144.8 Å²	144.8	74%	0.74	80%	0.795	S	S	*	*			trans	-134.3	168.8	132.4	37.9	-28.1	0	0	0	111.5
979	S	27.5	Very low	31.7	Very low	109 Å²	109	139.7 Å²	139.7	76%	0.762	80%	0.795	S	S	*	*			cis	-160.2	161.9	-34.5	-88.2	0	0	0	0	107.3
980	K	31.9	Very low	32.6	Very low	202 Å²	202	141.4 Å²	141.4	88%	0.878	79%	0.792	S	S	*	*			trans	-117.7	146.1	171.3	-77.7	-168.4	174.4	-169.3	0	110.2
981	P	33.3	Very low	32.2	Very low	122 Å²	122	143 Å²	143	79%	0.792	79%	0.79	S	S	*	*				-121.8	167.9	105.6	35.5	-32.1	0	0	0	111.6
982	S	27.8	Very low	31.6	Very low	117 Å²	117	144.9 Å²	144.9	82%	0.818	79%	0.789	S	S	*	*			cis	110.8	95.6	4.3	-167.1	0	0	0	0	115.4
983	S	26.9	Very low	31.8	Very low	126 Å²	126	146.8 Å²	146.8	88%	0.881	79%	0.791	S	S	*	*			trans	-155.6	165.5	156.9	50.5	0	0	0	0	109
984	Y	27.1	Very low	31.9	Very low	225 Å²	225	149.1 Å²	149.1	88%	0.882	79%	0.794	S	S	*	*			trans	-134.3	168.7	-160.7	-161.9	-98.4	0	0	0	113.5
985	S	28.5	Very low	31.7	Very low	95 Å²	95	149.5 Å²	149.5	66%	0.664	80%	0.798	S	S	*	*			trans	-94.4	-159.7	-171.8	-17.5	0	0	0	0	112.7
986	P	60.3	Low	31.9	Very low	107 Å²	107	150.5 Å²	150.5	70%	0.695	80%	0.802	S	S	*	*			cis	-137.3	175.9	-40.3	37.4	-21.1	0	0	0	114.9
987	P	32.3	Very low	32.3	Very low	132 Å²	132	147.5 Å²	147.5	86%	0.857	80%	0.796	S	S	*	*			trans	-112.9	173.7	139.8	37.2	-29.9	0	0	0	111.5
988	G	24.5	Very low	32	Very low	71 Å²	71	144.8 Å²	144.8	73%	0.732	80%	0.797	S	S	*	*			cis	171.3	157.1	-4.7	0	0	0	0	0	110.9
989	S	38.5	Very low	32.2	Very low	120 Å²	120	146.8 Å²	146.8	84%	0.839	80%	0.801	S	S	*	*			trans	-149.5	156	-179.4	-58.1	0	0	0	0	112
990	P	44.4	Very low	32.6	Very low	111 Å²	111	147.5 Å²	147.5	72%	0.721	80%	0.803	S	S	*	*			trans	-152.2	144.1	133.2	34.8	-16.1	0	0	0	118.2
991	I	27.7	Very low	32.6	Very low	153 Å²	153	144.9 Å²	144.9	79%	0.785	80%	0.798	S	S	*	*			trans	64.9	144.6	131.3	-62.6	173.5	0	0	0	119.9
992	E	31.5	Very low	32.7	Very low	151 Å²	151	145 Å²	145	71%	0.706	80%	0.799	S	S	*	*			cis	-171.1	153.9	-22.6	-99	-168.5	135.2	0	0	109.2
993	K	27.6	Very low	33	Very low	199 Å²	199	145.4 Å²	145.4	87%	0.865	79%	0.791	S	S	*	*				166.3	145.3	123.1	-90.7	162.6	-175.5	171.5	0	113.9
994	Y	31.5	Very low	33.4	Very low	222 Å²	222	145.5 Å²	145.5	87%	0.871	79%	0.788	S	S	*	*			trans	-110.2	156.9	177.5	-82.7	-97.4	0	0	0	111.9
995	Q	22.7	Very low	33.5	Very low	172 Å²	172	141 Å²	141	80%	0.804	78%	0.779	S	S	*	*				-170.7	152.7	125.8	-153.2	60.3	14.9	0	0	112.5
996	Y	34	Very low	33.4	Very low	212 Å²	212	143.4 Å²	143.4	83%	0.831	79%	0.79	S	S	*	*			trans	-137.4	149.5	166.5	-105.4	-80.3	0	0	0	109.8
997	P	36.3	Very low	31.9	Very low	118 Å²	118	145 Å²	145	77%	0.766	79%	0.792	S	S	*	*			trans	-137.8	-168.5	140.7	31	-12	0	0	0	113.5
998	L	26	Very low	31.6	Very low	163 Å²	163	144.1 Å²	144.1	85%	0.853	79%	0.789	S	S	*	*			trans	-119.7	152.4	-158.9	-61.9	162	0	0	0	114.6
999	L	36.3	Very low	32.4	Very low	155 Å²	155	146.9 Å²	146.9	81%	0.812	79%	0.794	S	S	*	*			trans	22.1	144.1	145.7	-71.2	167.9	0	0	0	121.2
1000	P	34.8	Very low	32.1	Very low	125 Å²	125	148.8 Å²	148.8	81%	0.812	80%	0.795	S	S	*	*				-149.6	-164.6	54.2	42.1	-20	0	0	0	118.9
1001	L	32.6	Very low	31.6	Very low	146 Å²	146	149.9 Å²	149.9	76%	0.764	79%	0.794	S	S	*	*			trans	-63.3	166.1	-174	-84.6	168.5	0	0	0	116.9
1002	P	35.1	Very low	32.3	Very low	125 Å²	125	147.6 Å²	147.6	81%	0.812	79%	0.787	S	S	*	*				-144.9	-165.8	50.4	42.5	-20.4	0	0	0	119.3
1003	L	34.6	Very low	33.4	Very low	125 Å²	125	143.2 Å²	143.2	65%	0.654	77%	0.771	S	S	*	*			trans	-82.7	177	-167.5	-55.8	166.4	0	0	0	114.1	L1005	L1003-L1005 HydrophobicContact CD1-CD1 4.41Å; L1003-L1005 HydrophobicContact CD1-CG 4.49Å
1004	P	35.3	Very low	34.3	Very low	128 Å²	128	139.1 Å²	139.1	83%	0.831	76%	0.755	S	S	*	*				-131.2	162	81.9	38.9	-30	0	0	0	115.2
1005	L	28.8	Very low	35.4	Very low	132 Å²	132	131.8 Å²	131.8	69%	0.691	74%	0.737	S	S	*	*			trans	-102.2	144.9	172.3	-69.1	163.5	0	0	0	110.2	L1003	L1003-L1005 HydrophobicContact CD1-CD1 4.41Å; L1003-L1005 HydrophobicContact CD1-CG 4.49Å
1006	T	27.2	Very low	37	Very low	144 Å²	144	125.6 Å²	125.6	88%	0.883	71%	0.709	S	S	*	*			trans	-114.3	118.3	160.9	48.4	0	0	0	0	109.2
1007	L	28.8	Very low	38.1	Very low	142 Å²	142	116.5 Å²	116.5	74%	0.743	67%	0.673	S	S	*	*			trans	-95.6	145.6	177.7	-67.3	168.2	0	0	0	110
1008	S	24.9	Very low	39.1	Very low	112 Å²	112	115.4 Å²	115.4	78%	0.783	66%	0.661	S	S	*	*			trans	-121.2	132.5	160.1	-59.3	0	0	0	0	107.8	D1010	S1008-D1010 PolarHBondContact O-N 3.1Å
1009	P	41.1	Very low	40.6	Very low	129 Å²	129	116.2 Å²	116.2	84%	0.838	65%	0.652	S	S	*	*			trans	-87.9	95.1	-171.3	33.6	-33.1	0	0	0	111.3
1010	D	33.2	Very low	41.6	Very low	161 Å²	161	109.4 Å²	109.4	86%	0.861	62%	0.616	S	S	*	*			trans	-151.8	99.2	156.9	-115.1	-30.5	0	0	0	109.3	S1008	S1008-D1010 PolarHBondContact O-N 3.1Å
1011	L	33.8	Very low	42.5	Very low	134 Å²	134	106 Å²	106	70%	0.702	59%	0.587	S	S	*	*			trans	-128.9	111.8	178.9	-70.4	179.3	0	0	0	109.6	P1013	L1011-P1013 WeakPolarHBondContact O-CD 3.42Å
1012	T	41.8	Very low	43.6	Very low	105 Å²	105	103.2 Å²	103.2	64%	0.644	58%	0.576	S	S	*	*			trans	-61.7	115	167.4	49	0	0	0	0	109.1	E1014 S1015	T1012-E1014 VanDerWaalsContact C-N 3.33Å; T1012-E1014 PolarHBondContact O-N 2.9Å; T1012-S1015 PolarHBondContact O-OG 3.1Å
1013	P	54.3	Low	44.4	Very low	58 Å²	58	102.3 Å²	102.3	38%	0.377	56%	0.56	S	S	.	*	H	α-helix	trans	-66.2	-35.5	-167.7	23.8	-33.6	0	0	0	113	L1011 S1015 D1016 W1017 I1157	L1011-P1013 WeakPolarHBondContact O-CD 3.42Å; P1013-S1015 VanDerWaalsContact C-N 3.35Å; P1013-S1015 PolarHBondContact O-N 3.38Å; P1013-D1016 PolarHBondContact O-N 2.73Å; P1013-W1017 PolarHBondContact O-N 3.06Å; P1013-I1157 HydrophobicContact CB-CG2 4.06Å; P1013-I1157 HydrophobicContact CG-CG2 4.25Å
1014	E	47.8	Very low	45.2	Very low	113 Å²	113	100 Å²	100	53%	0.528	54%	0.543	S	S	.	.	H	α-helix	trans	-53.3	-44.1	-172.5	-172	180	-157	0	0	113.9	T1012 D1016 W1017 L1018	T1012-E1014 VanDerWaalsContact C-N 3.33Å; T1012-E1014 PolarHBondContact O-N 2.9Å; E1014-D1016 VanDerWaalsContact C-N 3.31Å; E1014-D1016 PolarHBondContact O-N 3.23Å; E1014-W1017 PolarHBondContact O-N 3.01Å; E1014-L1018 PolarHBondContact O-N 3Å
1015	S	53.9	Low	45.6	Very low	69 Å²	69	101.2 Å²	101.2	48%	0.483	54%	0.535	S	S	.	.	H	α-helix	trans	-66.8	-29.5	-176	53.7	0	0	0	0	113.8	T1012 P1013 R1019	T1012-S1015 PolarHBondContact O-OG 3.1Å; P1013-S1015 VanDerWaalsContact C-N 3.35Å; P1013-S1015 PolarHBondContact O-N 3.38Å; S1015-R1019 WeakPolarHBondContact O-CB 3.37Å; S1015-R1019 PolarHBondContact O-N 3.3Å
1016	D	57.2	Low	45.9	Very low	42 Å²	42	100.8 Å²	100.8	23%	0.225	53%	0.531	C	S	.	.	H	α-helix	trans	-87.5	-29.9	177.5	-88.4	-8.1	0	0	0	112	P1013 E1014 R1019 F1020 Q1198	P1013-D1016 PolarHBondContact O-N 2.73Å; E1014-D1016 VanDerWaalsContact C-N 3.31Å; E1014-D1016 PolarHBondContact O-N 3.23Å; D1016-R1019 CarbonylContact O-C 3.36Å; D1016-R1019 WeakPolarHBondContact O-CB 3.47Å; D1016-R1019 PolarHBondContact O-N 3.47Å; D1016-R1019 IonicContact OD1-NH1 3.24Å; D1016-F1020 WeakPolarHBondContact O-CB 3.12Å; D1016-F1020 PolarHBondContact O-N 2.69Å; D1016-Q1198 PolarHBondContact OD2-NE2 3.45Å
1017	W	56.7	Low	46.5	Very low	20 Å²	20	97.2 Å²	97.2	8%	0.076	52%	0.516	C	S	.	.	H	α-helix	trans	-63.8	-43	169.9	-76.2	111.6	0	0	0	112.5	P1013 E1014 R1019 F1020 W1021 I1157 F1159 M1164 H1168 I1197	P1013-W1017 PolarHBondContact O-N 3.06Å; E1014-W1017 PolarHBondContact O-N 3.01Å; W1017-R1019 PolarHBondContact O-N 3.05Å; W1017-F1020 HydrophobicContact CE3-CD1 4.09Å; W1017-F1020 HydrophobicContact CZ3-CD1 4.21Å; W1017-F1020 HydrophobicContact CZ3-CE1 4.5Å; W1017-F1020 WeakPolarHBondContact O-CB 3.44Å; W1017-F1020 PolarHBondContact O-N 2.82Å; W1017-W1021 PolarHBondContact O-N 2.64Å; W1017-I1157 HydrophobicContact CZ2-CD1 3.75Å; W1017-F1159 AromaticContact CD1-CE1 3.95Å; W1017-F1159 HydrophobicContact CD2-CE1 4.47Å; W1017-F1159 HydrophobicContact CG-CE1 4.26Å; W1017-M1164 HydrophobicContact CB-CE 3.82Å; W1017-H1168 AromaticContact CH2-CE1 3.61Å; W1017-H1168 AromaticContact CH2-ND1 3.13Å; W1017-H1168 WeakPolarHBondContact CH2-ND1 3.49Å; W1017-H1168 AromaticContact CZ2-CE1 3.54Å; W1017-H1168 AromaticContact CZ2-ND1 3.33Å; W1017-H1168 VanDerWaalsContact CZ2-ND1 3.33Å; W1017-H1168 WeakPolarHBondContact CZ2-ND1 3.47Å; W1017-H1168 AromaticContact CZ3-ND1 3.72Å; W1017-I1197 HydrophobicContact CE3-CG2 4.49Å; W1017-I1197 HydrophobicContact CH2-CB 4.33Å; W1017-I1197 HydrophobicContact CH2-CG2 3.57Å; W1017-I1197 HydrophobicContact CZ3-CG2 3.44Å; W1017-I1197 VanDerWaalsContact CZ3-CG2 3.44Å
1018	L	55.9	Low	47	Very low	96 Å²	96	93.8 Å²	93.8	50%	0.503	51%	0.508	S	S	.	.	H	α-helix	trans	-60.4	-35.3	173	-119.4	67.4	0	0	0	112.2	E1014 T1022 M1164	E1014-L1018 PolarHBondContact O-N 3Å; L1018-T1022 WeakPolarHBondContact O-CB 3.16Å; L1018-T1022 PolarHBondContact O-N 2.87Å; L1018-T1022 PolarHBondContact O-OG1 3.05Å; L1018-M1164 HydrophobicContact CD1-CE 3.61Å; L1018-M1164 HydrophobicContact CD1-SD 4.04Å
1019	R	57.7	Low	47.6	Very low	180 Å²	180	91.6 Å²	91.6	68%	0.679	49%	0.49	S	S	*	.	H	α-helix	trans	-75.2	-36.2	180	-158.7	175.4	-173.5	-173.4	1.8	112	S1015 D1016 W1017 K1023	S1015-R1019 WeakPolarHBondContact O-CB 3.37Å; S1015-R1019 PolarHBondContact O-N 3.3Å; D1016-R1019 CarbonylContact O-C 3.36Å; D1016-R1019 WeakPolarHBondContact O-CB 3.47Å; D1016-R1019 PolarHBondContact O-N 3.47Å; D1016-R1019 IonicContact OD1-NH1 3.24Å; W1017-R1019 PolarHBondContact O-N 3.05Å; R1019-K1023 PolarHBondContact O-N 2.69Å; R1019-K1023 VanDerWaalsContact O-N 3.14Å
1020	F	58.8	Low	47.2	Very low	12 Å²	12	90.3 Å²	90.3	5%	0.053	48%	0.484	C	S	.	.	H	α-helix	trans	-60.4	-53.6	167.9	167.2	-100	0	0	0	111	D1016 W1017 T1022 K1023 Y1024 F1182 I1197 H1202	D1016-F1020 WeakPolarHBondContact O-CB 3.12Å; D1016-F1020 PolarHBondContact O-N 2.69Å; W1017-F1020 HydrophobicContact CE3-CD1 4.09Å; W1017-F1020 HydrophobicContact CZ3-CD1 4.21Å; W1017-F1020 HydrophobicContact CZ3-CE1 4.5Å; W1017-F1020 WeakPolarHBondContact O-CB 3.44Å; W1017-F1020 PolarHBondContact O-N 2.82Å; F1020-T1022 VanDerWaalsContact C-N 3.29Å; F1020-T1022 PolarHBondContact O-N 3.38Å; F1020-K1023 CarbonylContact O-C 3.57Å; F1020-K1023 WeakPolarHBondContact O-CA 3.06Å; F1020-K1023 WeakPolarHBondContact O-CB 3.15Å; F1020-K1023 PolarHBondContact O-N 3.34Å; F1020-Y1024 PolarHBondContact O-N 3.36Å; F1020-F1182 HydrophobicContact CE1-CE2 4.46Å; F1020-F1182 HydrophobicContact CZ-CD2 4.37Å; F1020-F1182 HydrophobicContact CZ-CE2 4.11Å; F1020-I1197 HydrophobicContact CD1-CG2 4.36Å; F1020-I1197 HydrophobicContact CD2-CG2 3.91Å; F1020-I1197 WeakPolarHBondContact CD2-O 3.5Å; F1020-I1197 HydrophobicContact CE1-CG2 4.19Å; F1020-I1197 HydrophobicContact CE2-CG2 3.71Å; F1020-I1197 WeakPolarHBondContact CE2-O 3.28Å; F1020-I1197 HydrophobicContact CG-CG2 4.23Å; F1020-I1197 HydrophobicContact CZ-CG2 3.86Å; F1020-H1202 AromaticContact CE2-NE2 3.55Å
1021	W	52.4	Low	47.3	Very low	52 Å²	52	85.8 Å²	85.8	20%	0.197	48%	0.476	C	S	.	.	H	α-helix	trans	-61.7	-36.1	179.6	-84.8	104.9	0	0	0	113.1	W1017 K1023 Y1024 K1025 L1167 F1182	W1017-W1021 PolarHBondContact O-N 2.64Å; W1021-K1023 VanDerWaalsContact C-N 3.26Å; W1021-K1023 PolarHBondContact O-N 3.45Å; W1021-Y1024 AromaticContact CE3-CD1 3.68Å; W1021-Y1024 HydrophobicContact CE3-CD1 3.68Å; W1021-Y1024 HydrophobicContact CE3-CE1 4.33Å; W1021-Y1024 HydrophobicContact CE3-CG 4.28Å; W1021-Y1024 HydrophobicContact CH2-CD1 4.21Å; W1021-Y1024 HydrophobicContact CH2-CE1 4.19Å; W1021-Y1024 AromaticContact CZ3-CD1 3.33Å; W1021-Y1024 HydrophobicContact CZ3-CD1 3.33Å; W1021-Y1024 AromaticContact CZ3-CE1 3.53Å; W1021-Y1024 HydrophobicContact CZ3-CE1 3.53Å; W1021-Y1024 HydrophobicContact CZ3-CG 4.11Å; W1021-Y1024 PolarHBondContact O-N 3.42Å; W1021-K1025 WeakPolarHBondContact O-CB 3.27Å; W1021-K1025 PolarHBondContact O-N 3.06Å; W1021-L1167 HydrophobicContact CH2-CD2 3.68Å; W1021-L1167 HydrophobicContact CZ2-CB 3.69Å; W1021-L1167 HydrophobicContact CZ2-CD2 3.66Å; W1021-L1167 HydrophobicContact CZ2-CG 4.17Å; W1021-L1167 HydrophobicContact CZ3-CD2 4.18Å; W1021-F1182 HydrophobicContact CH2-CZ 4.04Å; W1021-F1182 HydrophobicContact CZ2-CZ 4.3Å
1022	T	56.2	Low	47.3	Very low	88 Å²	88	85.9 Å²	85.9	54%	0.54	48%	0.482	S	S	.	.	H	α-helix	trans	-62.3	-32.5	171.5	-59.5	0	0	0	0	112.5	L1018 F1020 M1026	L1018-T1022 WeakPolarHBondContact O-CB 3.16Å; L1018-T1022 PolarHBondContact O-N 2.87Å; L1018-T1022 PolarHBondContact O-OG1 3.05Å; F1020-T1022 VanDerWaalsContact C-N 3.29Å; F1020-T1022 PolarHBondContact O-N 3.38Å; T1022-M1026 WeakPolarHBondContact O-CG 3.41Å
1023	K	51.5	Low	46.9	Very low	107 Å²	107	86.8 Å²	86.8	47%	0.465	49%	0.49	S	S	.	.	H	α-helix	trans	-79.9	-44.3	176.5	-171.2	-176.6	176.7	-173.8	0	111.9	R1019 F1020 W1021 K1025 M1026 A1027 R1199 G1200	R1019-K1023 PolarHBondContact O-N 2.69Å; R1019-K1023 VanDerWaalsContact O-N 3.14Å; F1020-K1023 CarbonylContact O-C 3.57Å; F1020-K1023 WeakPolarHBondContact O-CA 3.06Å; F1020-K1023 WeakPolarHBondContact O-CB 3.15Å; F1020-K1023 PolarHBondContact O-N 3.34Å; W1021-K1023 VanDerWaalsContact C-N 3.26Å; W1021-K1023 PolarHBondContact O-N 3.45Å; K1023-K1025 PolarHBondContact O-N 3.21Å; K1023-M1026 PolarHBondContact O-N 3.31Å; K1023-M1026 VanDerWaalsContact O-N 3.1Å; K1023-A1027 PolarHBondContact O-N 3.04Å; K1023-A1027 VanDerWaalsContact O-N 3.16Å; K1023-R1199 PolarHBondContact NZ-O 2.77Å; K1023-G1200 PolarHBondContact NZ-O 3.28Å
1024	Y	51.6	Low	45.7	Very low	76 Å²	76	87.7 Å²	87.7	30%	0.298	51%	0.509	S	S	.	.	H	α-helix	trans	-55.9	-47.4	176.7	175.4	-95.4	0	0	0	111.8	F1020 W1021 M1026 A1027 A1028 F1182	F1020-Y1024 PolarHBondContact O-N 3.36Å; W1021-Y1024 AromaticContact CE3-CD1 3.68Å; W1021-Y1024 HydrophobicContact CE3-CD1 3.68Å; W1021-Y1024 HydrophobicContact CE3-CE1 4.33Å; W1021-Y1024 HydrophobicContact CE3-CG 4.28Å; W1021-Y1024 HydrophobicContact CH2-CD1 4.21Å; W1021-Y1024 HydrophobicContact CH2-CE1 4.19Å; W1021-Y1024 AromaticContact CZ3-CD1 3.33Å; W1021-Y1024 HydrophobicContact CZ3-CD1 3.33Å; W1021-Y1024 AromaticContact CZ3-CE1 3.53Å; W1021-Y1024 HydrophobicContact CZ3-CE1 3.53Å; W1021-Y1024 HydrophobicContact CZ3-CG 4.11Å; W1021-Y1024 PolarHBondContact O-N 3.42Å; Y1024-M1026 PolarHBondContact O-N 3.32Å; Y1024-M1026 VanDerWaalsContact O-N 3.08Å; Y1024-A1027 PolarHBondContact O-N 3.17Å; Y1024-A1028 HydrophobicContact CE1-CB 4.5Å; Y1024-A1028 PolarHBondContact O-N 3.48Å; Y1024-F1182 AromaticContact CE2-CD1 3.58Å; Y1024-F1182 HydrophobicContact CE2-CD1 3.58Å; Y1024-F1182 AromaticContact CE2-CE1 3.72Å; Y1024-F1182 HydrophobicContact CE2-CE1 3.72Å; Y1024-F1182 HydrophobicContact CE2-CG 4.05Å; Y1024-F1182 HydrophobicContact CE2-CZ 4.3Å; Y1024-F1182 AromaticContact CZ-CE1 3.8Å
1025	K	45	Very low	44.7	Very low	153 Å²	153	87.5 Å²	87.5	67%	0.665	52%	0.52	S	S	*	.	H	α-helix	trans	-60	-20.6	178.3	-173.5	164.3	-176.1	166.8	0	114.1	W1021 K1023 T1029	W1021-K1025 WeakPolarHBondContact O-CB 3.27Å; W1021-K1025 PolarHBondContact O-N 3.06Å; K1023-K1025 PolarHBondContact O-N 3.21Å; K1025-T1029 WeakPolarHBondContact O-CG2 3.48Å; K1025-T1029 PolarHBondContact O-OG1 3.22Å
1026	M	34.6	Very low	43.4	Very low	123 Å²	123	92.6 Å²	92.6	61%	0.606	54%	0.54	S	S	*	.	H	α-helix	trans	-91	-30.2	174.7	-57.2	-68.8	169	0	0	112.2	T1022 K1023 Y1024 T1029 S1030	T1022-M1026 WeakPolarHBondContact O-CG 3.41Å; K1023-M1026 PolarHBondContact O-N 3.31Å; K1023-M1026 VanDerWaalsContact O-N 3.1Å; Y1024-M1026 PolarHBondContact O-N 3.32Å; Y1024-M1026 VanDerWaalsContact O-N 3.08Å; M1026-T1029 PolarHBondContact O-OG1 3.12Å; M1026-S1030 PolarHBondContact O-OG 3.12Å
1027	A	38.4	Very low	41.9	Very low	69 Å²	69	95.1 Å²	95.1	57%	0.57	56%	0.561	S	S	*	*	H	α-helix	trans	-73.6	-48.1	177.9	0	0	0	0	0	112	K1023 Y1024 T1029 S1030	K1023-A1027 PolarHBondContact O-N 3.04Å; K1023-A1027 VanDerWaalsContact O-N 3.16Å; Y1024-A1027 PolarHBondContact O-N 3.17Å; A1027-T1029 PolarHBondContact O-N 3.04Å; A1027-T1029 VanDerWaalsContact O-N 3.11Å; A1027-S1030 PolarHBondContact O-N 3.23Å
1028	A	39.9	Very low	40.5	Very low	71 Å²	71	101.2 Å²	101.2	59%	0.587	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.1	-24	179.6	0	0	0	0	0	113.3	Y1024	Y1024-A1028 HydrophobicContact CE1-CB 4.5Å; Y1024-A1028 PolarHBondContact O-N 3.48Å
1029	T	38	Very low	39	Very low	66 Å²	66	105.8 Å²	105.8	41%	0.405	61%	0.614	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.9	1.6	178	48.9	0	0	0	0	115.2	Q137 K1025 M1026 A1027	Q137-T1029 PolarHBondContact NE2-O 3.39Å; K1025-T1029 WeakPolarHBondContact O-CG2 3.48Å; K1025-T1029 PolarHBondContact O-OG1 3.22Å; M1026-T1029 PolarHBondContact O-OG1 3.12Å; A1027-T1029 PolarHBondContact O-N 3.04Å; A1027-T1029 VanDerWaalsContact O-N 3.11Å
1030	S	32.6	Very low	37.6	Very low	101 Å²	101	105.1 Å²	105.1	71%	0.706	62%	0.618	S	S	*	*	S	Bend	trans	-110.7	4.3	-168.2	-65.4	0	0	0	0	116.2	M1026 A1027	M1026-S1030 PolarHBondContact O-OG 3.12Å; A1027-S1030 PolarHBondContact O-N 3.23Å
1031	G	35.4	Very low	36.1	Very low	67 Å²	67	113.1 Å²	113.1	69%	0.691	66%	0.656	S	S	*	*			trans	-122.5	45.3	-164.2	0	0	0	0	0	118.2
1032	V	33.3	Very low	34.8	Very low	136 Å²	136	115 Å²	115	82%	0.824	68%	0.677	S	S	*	*			trans	-146.6	124.6	169.8	-174.3	0	0	0	0	112.8
1033	P	33.2	Very low	33.4	Very low	124 Å²	124	121.1 Å²	121.1	81%	0.805	69%	0.692	S	S	*	*			trans	-97.1	141.5	149.6	34.8	-27.2	0	0	0	111
1034	G	29.2	Very low	32.2	Very low	76 Å²	76	122.1 Å²	122.1	78%	0.784	71%	0.707	S	S	*	*			trans	-91.3	-159.9	174.8	0	0	0	0	0	112.9
1035	S	27.8	Very low	31.2	Very low	110 Å²	110	124.8 Å²	124.8	77%	0.769	73%	0.731	S	S	*	*			cis	-171.5	127.9	-1.9	169.6	0	0	0	0	108.9
1036	I	25.1	Very low	30.8	Very low	176 Å²	176	123.1 Å²	123.1	90%	0.903	74%	0.735	S	S	*	*			trans	-136	151.9	168	-61	-175.8	0	0	0	109.4
1037	S	26.7	Very low	30.3	Very low	94 Å²	94	127.4 Å²	127.4	66%	0.657	75%	0.746	S	S	*	*			trans	-111	162.3	-151.6	-49.8	0	0	0	0	116.3
1038	N	26.9	Very low	29.7	Very low	149 Å²	149	128.4 Å²	128.4	80%	0.797	75%	0.748	S	S	*	*			trans	59.1	114.9	149.3	-67.9	-13.5	0	0	0	120.1
1039	H	25.5	Very low	29.1	Very low	191 Å²	191	129 Å²	129	88%	0.884	75%	0.753	S	S	*	*				-138.4	158.8	99.6	-130.7	-87.5	0	0	0	111.5
1040	Q	26.9	Very low	28.5	Very low	166 Å²	166	131.3 Å²	131.3	78%	0.776	77%	0.772	S	S	*	*			trans	-123.4	163	-177.3	-169.4	174.7	14.9	0	0	110.2
1041	Q	28.5	Very low	29	Very low	181 Å²	181	131.5 Å²	131.5	85%	0.846	77%	0.771	S	S	*	*			trans	93	141.3	179.3	-55.3	171.5	7.4	0	0	114.8
1042	S	25.3	Very low	28.7	Very low	90 Å²	90	138.6 Å²	138.6	63%	0.629	78%	0.778	S	S	*	*			cis	-170.1	139.3	-20.7	52.8	0	0	0	0	113.7
1043	Y	26.8	Very low	28.4	Very low	218 Å²	218	137 Å²	137	86%	0.855	77%	0.773	S	S	*	*			trans	69.3	155.1	154.5	-67.9	-61.1	0	0	0	123.3
1044	T	24.9	Very low	29.3	Very low	128 Å²	128	136.2 Å²	136.2	79%	0.785	77%	0.768	S	S	*	*			trans	78	109.4	156.3	32.2	0	0	0	0	122.8
1045	V	30.9	Very low	29.1	Very low	132 Å²	132	140.2 Å²	140.2	80%	0.8	77%	0.77	S	S	*	*			trans	-7.8	155.2	139.1	-91.3	0	0	0	0	119.1
1046	P	35.9	Very low	29.6	Very low	118 Å²	118	140.5 Å²	140.5	77%	0.766	77%	0.77	S	S	*	*			cis	-153.2	-174	47.1	39.9	-16.1	0	0	0	120.3
1047	Y	24.2	Very low	31	Very low	213 Å²	213	137.8 Å²	137.8	84%	0.835	76%	0.764	S	S	*	*			trans	-30.3	162.5	142.9	-122.1	-144.7	0	0	0	114.6
1048	C	26.9	Very low	31.6	Very low	89 Å²	89	139.2 Å²	139.2	60%	0.601	77%	0.771	S	S	*	*			cis	-169.8	176.3	1.3	-149.7	0	0	0	0	112.9
1049	A	26.5	Very low	32.3	Very low	84 Å²	84	138.1 Å²	138.1	69%	0.694	77%	0.772	S	S	*	*			trans	56.5	129.5	141.1	0	0	0	0	0	124.5
1050	S	26.5	Very low	32.5	Very low	114 Å²	114	133.5 Å²	133.5	80%	0.797	77%	0.767	S	S	*	*			trans	50.5	133	130.1	-152.3	0	0	0	0	123.1
1051	P	43.3	Very low	33.4	Very low	105 Å²	105	131.6 Å²	131.6	68%	0.682	77%	0.768	S	S	*	*			trans	-108.7	131.6	170.7	37.1	-27.5	0	0	0	115.2
1052	Y	28.2	Very low	33.6	Very low	216 Å²	216	127.1 Å²	127.1	85%	0.847	76%	0.757	S	S	*	*				174.8	141.4	110.4	-113.8	-84.7	0	0	0	115.8
1053	S	28	Very low	33.9	Very low	103 Å²	103	131.1 Å²	131.1	72%	0.72	77%	0.766	S	S	*	*			trans	67.1	157.1	157.3	-78.9	0	0	0	0	121.1
1054	P	51	Low	34	Very low	107 Å²	107	131 Å²	131	70%	0.695	77%	0.765	S	S	*	*			cis	-141.3	-173.9	-25.9	37.5	-17.5	0	0	0	116.1
1055	L	26.1	Very low	35	Very low	160 Å²	160	130.3 Å²	130.3	84%	0.838	76%	0.763	S	S	*	*			trans	79.9	165.8	163.9	-56.3	163.1	0	0	0	118.7
1056	P	37.9	Very low	36	Very low	116 Å²	116	129.1 Å²	129.1	75%	0.753	76%	0.758	S	S	*	*				-131	179	-50.7	38.9	-22.5	0	0	0	114.7
1057	P	54.8	Low	36.7	Very low	120 Å²	120	128.9 Å²	128.9	78%	0.779	76%	0.756	S	S	*	*			trans	-110.1	171.1	-165	42.3	-36.3	0	0	0	117.4
1058	P	38.6	Very low	37.5	Very low	124 Å²	124	124.6 Å²	124.6	81%	0.805	76%	0.755	S	S	*	*				-155.6	-170.1	106.7	42.2	-24.7	0	0	0	115
1059	P	41.3	Very low	38.4	Very low	126 Å²	126	125 Å²	125	82%	0.818	76%	0.756	S	S	*	*			cis	-123.5	-170.4	-34.3	32	-11	0	0	0	114.2
1060	A	29.8	Very low	38.6	Very low	94 Å²	94	128.9 Å²	128.9	78%	0.777	76%	0.76	S	S	*	*			trans	-125.5	-163.1	-179.9	0	0	0	0	0	111.4
1061	P	46.5	Very low	38.8	Very low	125 Å²	125	131 Å²	131	81%	0.812	76%	0.757	S	S	*	*			cis	-122.5	-163.1	3.3	44.5	-26.9	0	0	0	113.1
1062	S	31.7	Very low	38.1	Very low	88 Å²	88	129.5 Å²	129.5	62%	0.615	75%	0.753	S	S	*	*			cis	-150.9	171.9	18.7	47.5	0	0	0	0	110.5
1063	H	32.5	Very low	38.1	Very low	174 Å²	174	126.9 Å²	126.9	81%	0.806	75%	0.749	S	S	*	*			cis	-143	-174.4	30.7	-83.5	-92.8	0	0	0	113.7
1064	Y	28.8	Very low	38.1	Very low	215 Å²	215	127.8 Å²	127.8	84%	0.843	75%	0.75	S	S	*	*			trans	-152.3	179	-170.8	-120.4	-109.9	0	0	0	108.4
1065	P	46.1	Very low	36.9	Very low	114 Å²	114	130 Å²	130	74%	0.74	76%	0.755	S	S	*	*			cis	-142.5	-141.2	18.1	52.5	-30.7	0	0	0	114.8
1066	P	51.5	Low	36.9	Very low	107 Å²	107	127 Å²	127	70%	0.695	75%	0.748	S	S	*	*			trans	-133.4	-135.2	-139.9	40.4	-12	0	0	0	112.9
1067	P	51.2	Low	36.4	Very low	112 Å²	112	126.8 Å²	126.8	73%	0.727	75%	0.749	S	S	*	*			cis	-123.1	-171.3	-31.3	44	-27.5	0	0	0	112.7
1068	P	40.1	Very low	35	Very low	124 Å²	124	125.1 Å²	125.1	81%	0.805	75%	0.745	S	S	*	*				-150.5	-178.1	83.4	38.5	-17.2	0	0	0	115.9
1069	P	46	Very low	34.3	Very low	98 Å²	98	124.3 Å²	124.3	64%	0.636	74%	0.742	S	S	*	*			trans	-129.7	175.2	-167.7	42.9	-29.2	0	0	0	118.7
1070	H	30	Very low	33.8	Very low	165 Å²	165	123.5 Å²	123.5	76%	0.764	74%	0.737	S	S	*	*			trans	72.7	159.5	161	-57.7	-55.1	0	0	0	118.5
1071	H	31	Very low	33.6	Very low	158 Å²	158	128.3 Å²	128.3	73%	0.731	74%	0.743	S	S	*	*			cis	-155.9	157.2	3.5	-141.4	-66.2	0	0	0	112.3
1072	A	28.8	Very low	32.6	Very low	73 Å²	73	129.2 Å²	129.2	60%	0.603	74%	0.741	S	S	*	*			trans	66.2	155.6	151.6	0	0	0	0	0	119.1
1073	Q	28.1	Very low	32.3	Very low	162 Å²	162	130.9 Å²	130.9	76%	0.757	74%	0.743	S	S	*	*			cis	-162.9	152.4	-12.9	-113.6	170.8	63.6	0	0	108.9
1074	T	27.5	Very low	32.3	Very low	121 Å²	121	128.2 Å²	128.2	74%	0.742	74%	0.74	S	S	*	*			trans	55.3	141.9	156.1	51.1	0	0	0	0	119.6
1075	L	27.4	Very low	32.3	Very low	154 Å²	154	123.8 Å²	123.8	81%	0.806	74%	0.737	S	S	*	*			cis	-151.3	170.2	16.2	-122.7	152.7	0	0	0	111.4
1076	S	25.8	Very low	31.4	Very low	98 Å²	98	125.2 Å²	125.2	69%	0.685	74%	0.738	S	S	*	*			trans	-37.9	156.5	158.5	-59	0	0	0	0	115.4
1077	S	26.8	Very low	30.4	Very low	111 Å²	111	125.6 Å²	125.6	78%	0.776	73%	0.734	S	S	*	*			cis	-166.2	174.5	-4.5	40.3	0	0	0	0	111.9
1078	A	25.7	Very low	29.3	Very low	85 Å²	85	126.6 Å²	126.6	70%	0.702	73%	0.733	S	S	*	*			trans	-45	159.6	162.5	0	0	0	0	0	114.1
1079	S	24.6	Very low	28.7	Very low	106 Å²	106	125.2 Å²	125.2	74%	0.741	73%	0.731	S	S	*	*			cis	-140.3	138.6	20.7	-153.8	0	0	0	0	114.8
1080	P	30.5	Very low	27.9	Very low	109 Å²	109	126.6 Å²	126.6	71%	0.708	73%	0.732	S	S	*	*			trans	-67	159.1	147.3	33.5	-33.3	0	0	0	109.6
1081	E	24.3	Very low	27.7	Very low	196 Å²	196	129.9 Å²	129.9	92%	0.916	74%	0.738	S	S	*	*			trans	-75.1	136.7	-179.9	-64.4	161.7	178.6	0	0	110.2
1082	N	25.5	Very low	27.5	Very low	143 Å²	143	130.8 Å²	130.8	77%	0.765	74%	0.742	S	S	*	*			trans	-115.6	93.7	175.3	-153.6	100.9	0	0	0	111
1083	D	26.3	Very low	27.4	Very low	123 Å²	123	138 Å²	138	66%	0.658	75%	0.754	S	S	*	*			trans	64.7	135.9	158.5	-62.8	-58.5	0	0	0	120.4
1084	T	31.8	Very low	27.3	Very low	119 Å²	119	138.4 Å²	138.4	73%	0.73	76%	0.761	S	S	*	*				-6.3	146	126	1.4	0	0	0	0	116
1085	P	29.8	Very low	27.4	Very low	121 Å²	121	139.2 Å²	139.2	79%	0.786	77%	0.766	S	S	*	*				-146.8	159.1	83	44.9	-30.7	0	0	0	116.9
1086	L	26.4	Very low	27.5	Very low	144 Å²	144	137.1 Å²	137.1	75%	0.754	77%	0.765	S	S	*	*			trans	-53.5	163.3	146.2	-134.9	72.4	0	0	0	108.9
1087	D	30.4	Very low	27.7	Very low	116 Å²	116	140.3 Å²	140.3	62%	0.62	77%	0.774	S	S	*	*			cis	-164.5	-175.2	17.8	-166.3	-2.7	0	0	0	106.9
1088	L	29.2	Very low	27.7	Very low	133 Å²	133	139.5 Å²	139.5	70%	0.696	77%	0.774	S	S	*	*				162.4	107.2	110.6	-85.4	175.8	0	0	0	111.2	I1090	L1088-I1090 HydrophobicContact CB-CG1 4.31Å; L1088-I1090 HydrophobicContact CD1-CD1 4.37Å
1089	A	26.9	Very low	28	Very low	94 Å²	94	143 Å²	143	78%	0.777	78%	0.781	S	S	*	*			trans	-73.2	129.5	153.6	0	0	0	0	0	110.1
1090	I	28.4	Very low	28.1	Very low	128 Å²	128	145.1 Å²	145.1	66%	0.656	78%	0.781	S	S	*	*			trans	-134.8	116.8	171	-57.8	-179.3	0	0	0	111.1	L1088	L1088-I1090 HydrophobicContact CB-CG1 4.31Å; L1088-I1090 HydrophobicContact CD1-CD1 4.37Å
1091	R	26.3	Very low	28	Very low	233 Å²	233	150 Å²	150	88%	0.879	79%	0.786	S	S	*	*			trans	-149.4	74.8	146.3	-70.5	-150.9	85.8	146.7	9.6	113
1092	Q	27.1	Very low	28.2	Very low	177 Å²	177	147 Å²	147	83%	0.827	78%	0.781	S	S	*	*			trans	-157.6	113.2	150.2	-105.2	157.3	82.4	0	0	105.3
1093	R	27.1	Very low	28.4	Very low	226 Å²	226	144.4 Å²	144.4	85%	0.853	77%	0.774	S	S	*	*				63.3	97.2	66.3	-80.5	-161.7	172	117.9	-4.1	114
1094	D	26.2	Very low	28.3	Very low	169 Å²	169	146.6 Å²	146.6	90%	0.904	79%	0.786	S	S	*	*				-151.7	159	128	-111.6	-33	0	0	0	110
1095	T	28.4	Very low	28	Very low	139 Å²	139	145 Å²	145	85%	0.853	79%	0.793	S	S	*	*			trans	-148.3	116.7	-175	51.2	0	0	0	0	114.9
1096	S	29.1	Very low	27.7	Very low	110 Å²	110	144.2 Å²	144.2	77%	0.769	79%	0.791	S	S	*	*			trans	-148.4	146.5	154.7	52	0	0	0	0	106.5
1097	N	30.3	Very low	27.6	Very low	165 Å²	165	144 Å²	144	88%	0.882	79%	0.786	S	S	*	*	S	Bend	cis	-108.5	-169.7	25.1	-72.9	-34.5	0	0	0	115
1098	A	28.3	Very low	27.3	Very low	94 Å²	94	148.4 Å²	148.4	78%	0.777	79%	0.794	S	S	*	*			trans	-99.9	131.2	-147.7	0	0	0	0	0	117.6
1099	N	31.7	Very low	27.1	Very low	159 Å²	159	150.5 Å²	150.5	85%	0.85	80%	0.797	S	S	*	*			trans	65.3	141.7	136.4	-100.1	-5.6	0	0	0	124.5
1100	M	25.8	Very low	27.1	Very low	150 Å²	150	155.9 Å²	155.9	74%	0.739	80%	0.798	S	S	*	*			trans	84.8	95.8	157.7	-60.7	-135.9	66.1	0	0	121.5
1101	Y	28.6	Very low	26.9	Very low	210 Å²	210	157.8 Å²	157.8	82%	0.824	80%	0.801	S	S	*	*				49	123.5	120	-89.7	-94.6	0	0	0	121.7
1102	V	29.5	Very low	26.7	Very low	134 Å²	134	152.5 Å²	152.5	81%	0.812	79%	0.786	S	S	*	*				-175.1	144.3	103.6	148.9	0	0	0	0	113.1
1103	S	28.4	Very low	26.6	Very low	88 Å²	88	149 Å²	149	62%	0.615	78%	0.782	S	S	*	*			trans	-9.5	146.9	168.5	-48.6	0	0	0	0	126
1104	N	25	Very low	27.3	Very low	169 Å²	169	143 Å²	143	90%	0.904	77%	0.772	S	S	*	*			trans	61.5	141.4	136.4	-61.7	-4.8	0	0	0	122.6
1105	G	25.3	Very low	27.5	Very low	85 Å²	85	142.9 Å²	142.9	88%	0.876	77%	0.766	S	S	*	*			trans	168.7	109.4	160.2	0	0	0	0	0	116.5
1106	S	23.5	Very low	27.4	Very low	105 Å²	105	140.4 Å²	140.4	73%	0.734	75%	0.754	S	S	*	*			trans	-89.4	166.5	-176	49.7	0	0	0	0	116.4
1107	E	23.8	Very low	27.6	Very low	139 Å²	139	142.3 Å²	142.3	65%	0.65	75%	0.751	S	S	*	*			trans	84.8	124.7	150.8	-71.2	-168.3	112.7	0	0	124.7
1108	R	25.5	Very low	27.7	Very low	210 Å²	210	141.4 Å²	141.4	79%	0.792	74%	0.739	S	S	*	*				55.5	122.2	126.1	-60.8	178.7	171.9	160.6	-11.1	123.6
1109	K	24.7	Very low	27.9	Very low	177 Å²	177	142.2 Å²	142.2	77%	0.77	73%	0.727	S	S	*	*				83.9	120.4	120.5	-177.9	-173.2	177.6	-176.5	0	121.8
1110	R	25.6	Very low	28	Very low	207 Å²	207	143.1 Å²	143.1	78%	0.781	72%	0.718	S	S	*	*			trans	62.9	166.3	170.9	-67.8	179.8	168.8	-174.9	-7.7	113
1111	K	25.8	Very low	28.1	Very low	168 Å²	168	142.5 Å²	142.5	73%	0.73	71%	0.714	S	S	*	*			cis	-151.5	162.4	9.4	-116.1	-130.6	169	-139.2	0	107.2
1112	E	22	Very low	28.1	Very low	122 Å²	122	140 Å²	140	57%	0.57	71%	0.709	S	S	*	*			cis	-172.7	-162.4	-29.9	-128.9	166.7	-110	0	0	109.3
1113	S	23.7	Very low	28.1	Very low	104 Å²	104	140.9 Å²	140.9	73%	0.727	71%	0.706	S	S	*	*			trans	-58.3	179.3	178.1	-39.6	0	0	0	0	116.6
1114	P	43.1	Very low	28	Very low	100 Å²	100	141.1 Å²	141.1	65%	0.649	71%	0.714	S	S	*	*			cis	-149.9	178.9	17.2	45.6	-25.1	0	0	0	121.1
1115	Q	29	Very low	28.2	Very low	165 Å²	165	141.3 Å²	141.3	77%	0.771	71%	0.709	S	S	*	*			trans	71	154.2	145.4	-82.7	165.8	-65.1	0	0	120.9
1116	S	27.2	Very low	28.4	Very low	87 Å²	87	143.4 Å²	143.4	61%	0.608	70%	0.696	S	S	*	*			cis	-168	145.4	-2.2	41.5	0	0	0	0	114.7
1117	E	32.8	Very low	28.6	Very low	150 Å²	150	142 Å²	142	70%	0.701	70%	0.698	S	S	*	*			trans	68.3	155.8	140.3	-68.7	171.3	-134.2	0	0	119.6
1118	K	32.9	Very low	28.7	Very low	147 Å²	147	142.7 Å²	142.7	64%	0.639	70%	0.699	S	S	*	*			cis	-172	172.3	-0.6	-107.5	170.6	-175.8	-69.9	0	108.7
1119	E	31.5	Very low	28.7	Very low	110 Å²	110	143.6 Å²	143.6	51%	0.514	70%	0.702	S	S	.	*			cis	-172.1	150.7	-35.8	-123.9	-173.4	105.6	0	0	110.9
1120	R	33.4	Very low	28.8	Very low	179 Å²	179	143 Å²	143	68%	0.675	70%	0.703	S	S	*	*			trans	70.1	161.3	155.2	-62.5	-170.4	-173.7	-74.7	-29	121.4
1121	E	29.4	Very low	28.8	Very low	137 Å²	137	138 Å²	138	64%	0.64	70%	0.699	S	S	*	*			cis	-173.8	155	-36.7	-105	156	-166.6	0	0	112.1
1122	E	28.4	Very low	28.7	Very low	158 Å²	158	135 Å²	135	74%	0.738	70%	0.699	S	S	*	*			trans	62.9	169	156.3	-70.5	-80.3	48.9	0	0	120.3
1123	M	28.6	Very low	28.9	Very low	152 Å²	152	136.2 Å²	136.2	75%	0.749	71%	0.708	S	S	*	*			cis	-158.1	161.7	1.3	-140.3	179.5	-163.9	0	0	113.8
1124	A	27.9	Very low	29.2	Very low	93 Å²	93	136.4 Å²	136.4	77%	0.769	71%	0.705	S	S	*	*			trans	53.7	147	148.5	0	0	0	0	0	122.6
1125	E	28.2	Very low	28.4	Very low	172 Å²	172	137.1 Å²	137.1	80%	0.804	71%	0.712	S	S	*	*			cis	-153	-174.2	-8.6	-145.5	-151.4	175.4	0	0	111.9
1126	E	28.7	Very low	28.5	Very low	130 Å²	130	136.4 Å²	136.4	61%	0.607	71%	0.713	S	S	*	*			trans	-24.1	144.3	-174.8	-55.6	-166.4	139.4	0	0	120.2	K1128	E1126-K1128 VanDerWaalsContact CD-CE 3.48Å; E1126-K1128 WeakPolarHBondContact OE1-CE 3.15Å; E1126-K1128 IonicContact OE1-NZ 3.39Å; E1126-K1128 PolarHBondContact OE1-NZ 3.1Å; E1126-K1128 WeakPolarHBondContact OE2-CE 3.37Å; E1126-K1128 IonicContact OE2-NZ 3.72Å; E1126-K1128 PolarHBondContact OE2-NZ 2.97Å
1127	G	28	Very low	28.4	Very low	75 Å²	75	138.2 Å²	138.2	77%	0.773	72%	0.724	S	S	*	*			cis	176.8	-153.2	11.4	0	0	0	0	0	110.1
1128	K	26.7	Very low	28.1	Very low	153 Å²	153	135.7 Å²	135.7	67%	0.665	72%	0.724	S	S	*	*			cis	-172	147	-7.4	-116.6	164.9	-179.6	170.9	0	108.7	E1126	E1126-K1128 VanDerWaalsContact CD-CE 3.48Å; E1126-K1128 WeakPolarHBondContact OE1-CE 3.15Å; E1126-K1128 IonicContact OE1-NZ 3.39Å; E1126-K1128 PolarHBondContact OE1-NZ 3.1Å; E1126-K1128 WeakPolarHBondContact OE2-CE 3.37Å; E1126-K1128 IonicContact OE2-NZ 3.72Å; E1126-K1128 PolarHBondContact OE2-NZ 2.97Å
1129	R	24.9	Very low	28	Very low	229 Å²	229	138.3 Å²	138.3	86%	0.864	74%	0.735	S	S	*	*			trans	69.3	136.7	-171.2	-53.6	-178.2	-169.4	-129.7	7.4	114.4
1130	E	26.2	Very low	27.9	Very low	166 Å²	166	137.4 Å²	137.4	78%	0.776	75%	0.746	S	S	*	*			cis	-141	162.5	-4.2	-111.3	151.8	-136.2	0	0	109.8
1131	S	26.5	Very low	27.6	Very low	101 Å²	101	136.5 Å²	136.5	71%	0.706	76%	0.755	S	S	*	*			trans	-90.4	164.1	-168.8	64.1	0	0	0	0	113
1132	S	24.6	Very low	28	Very low	104 Å²	104	135.1 Å²	135.1	73%	0.727	77%	0.767	S	S	*	*			cis	74.4	153.1	20.4	94.8	0	0	0	0	115.3
1133	I	25.7	Very low	28.4	Very low	148 Å²	148	132 Å²	132	76%	0.759	77%	0.768	S	S	*	*			cis	-144.2	127.6	6	-164.8	162.7	0	0	0	114.9
1134	V	29.8	Very low	28.9	Very low	109 Å²	109	131 Å²	131	66%	0.661	77%	0.77	S	S	*	*			trans	4.3	139.3	139.5	179	0	0	0	0	119.9
1135	S	26.7	Very low	29.1	Very low	115 Å²	115	135.9 Å²	135.9	80%	0.804	78%	0.777	S	S	*	*			trans	-172.2	98.2	135.3	-84.1	0	0	0	0	116.4
1136	N	29.9	Very low	29.5	Very low	149 Å²	149	134.5 Å²	134.5	80%	0.797	78%	0.776	S	S	*	*			trans	24.5	133.9	139.2	-53.6	-16.3	0	0	0	123.2
1137	C	25.6	Very low	30.3	Very low	125 Å²	125	135.2 Å²	135.2	85%	0.845	78%	0.783	S	S	*	*				-154.1	118	128.6	-158.8	0	0	0	0	115.3
1138	S	26.3	Very low	31.5	Very low	98 Å²	98	138.9 Å²	138.9	69%	0.685	79%	0.785	S	S	*	*			trans	12.5	114.9	151	-51.8	0	0	0	0	124.5
1139	K	30.8	Very low	32.9	Very low	202 Å²	202	134.5 Å²	134.5	88%	0.878	78%	0.777	S	S	*	*			trans	69.9	148.8	130.9	-64.1	-176.3	177.1	-178.6	0	122.1
1140	A	29.2	Very low	34.9	Very low	90 Å²	90	125.7 Å²	125.7	74%	0.744	75%	0.747	S	S	*	*			trans	70.5	140.3	178.2	0	0	0	0	0	114.7
1141	D	27.2	Very low	37.5	Very low	161 Å²	161	123.3 Å²	123.3	86%	0.861	73%	0.731	S	S	*	*			cis	-127.3	161.6	1.8	-89.3	-55.2	0	0	0	112.4
1142	A	38.9	Very low	40.2	Very low	107 Å²	107	118.5 Å²	118.5	88%	0.884	70%	0.697	S	S	*	*			trans	-111.9	91.7	-178.9	0	0	0	0	0	111.6
1143	A	36.4	Very low	42.7	Very low	92 Å²	92	118.7 Å²	118.7	76%	0.76	69%	0.694	S	S	*	*			trans	-150.9	17.1	-174.9	0	0	0	0	0	117.7
1144	T	38.6	Very low	45.2	Very low	131 Å²	131	115.3 Å²	115.3	80%	0.804	68%	0.675	S	S	*	*			trans	-153.6	102.1	167.9	46.7	0	0	0	0	111.5
1145	Q	33.2	Very low	47.5	Very low	197 Å²	197	110.2 Å²	110.2	92%	0.921	64%	0.644	S	S	*	*			trans	-151.7	44.8	173.2	-156	179.9	-13	0	0	113.6
1146	D	36.6	Very low	49.7	Very low	143 Å²	143	105.3 Å²	105.3	77%	0.765	61%	0.611	S	S	*	*			trans	-117.2	-14.4	177.9	-94.3	-56.9	0	0	0	114.6	L1148	D1146-L1148 PolarHBondContact O-N 3.33Å
1147	D	44.9	Very low	52	Low	144 Å²	144	99.3 Å²	99.3	77%	0.77	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73	9.3	-171.4	-68.3	-72.5	0	0	0	116.5
1148	L	51.8	Low	54.7	Low	153 Å²	153	100.1 Å²	100.1	80%	0.801	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.4	-11.5	-176.2	-73.7	173.7	0	0	0	115.6	D1146 N1150	D1146-L1148 PolarHBondContact O-N 3.33Å; L1148-N1150 PolarHBondContact O-N 3.04Å
1149	A	56.3	Low	57.3	Low	61 Å²	61	96.3 Å²	96.3	50%	0.504	54%	0.537	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-38.1	-170.5	0	0	0	0	0	114.3
1150	N	67.2	Low	59.5	Low	43 Å²	43	94.1 Å²	94.1	23%	0.23	53%	0.534	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	26.3	-166.3	-68.1	-24.2	0	0	0	114.9	L1148 F1159	L1148-N1150 PolarHBondContact O-N 3.04Å; N1150-F1159 HydrophobicContact CB-CB 4.28Å; N1150-F1159 WeakPolarHBondContact CB-O 3.46Å; N1150-F1159 PolarHBondContact O-N 3.48Å
1151	R	80.6	Confident	62	Low	116 Å²	116	93.6 Å²	93.6	44%	0.438	52%	0.518	S	S	.	.	B	Isolated β-bridge	trans	-104.8	121.7	176.6	-166.7	-168.5	-170.4	-177	7.6	111.6	T1153 Y1158	R1151-T1153 PolarHBondContact O-N 3.45Å; R1151-Y1158 HydrophobicContact CB-CD1 4.02Å; R1151-Y1158 HydrophobicContact CB-CE1 4.04Å; R1151-Y1158 VanDerWaalsContact CD-CZ 3.49Å; R1151-Y1158 HydrophobicContact CG-CD1 3.99Å; R1151-Y1158 HydrophobicContact CG-CD2 4.25Å; R1151-Y1158 HydrophobicContact CG-CE1 3.84Å; R1151-Y1158 HydrophobicContact CG-CE2 4.1Å; R1151-Y1158 HydrophobicContact CG-CG 4.2Å; R1151-Y1158 VanDerWaalsContact NE-CZ 3.34Å; R1151-Y1158 PolarHBondContact NE-OH 3.06Å
1152	C	83.9	Confident	64.4	Low	0 Å²	0	92.9 Å²	92.9	0%	0	51%	0.51	C	S	.	.			trans	-63.4	122.2	170.7	-179	0	0	0	0	111.4	H1154 C1155 G1156 I1157 F1159 Y1165 H1168 M1169	C1152-H1154 VanDerWaalsContact C-N 3.35Å; C1152-C1155 HydrophobicContact CB-CB 4.23Å; C1152-C1155 PolarHBondContact SG-N 3.13Å; C1152-G1156 WeakPolarHBondContact O-CA 3.34Å; C1152-G1156 PolarHBondContact O-N 3.25Å; C1152-I1157 PolarHBondContact N-O 3.35Å; C1152-F1159 HydrophobicContact CB-CE2 4.3Å; C1152-Y1165 HydrophobicContact CB-CE2 4.49Å; C1152-H1168 WeakPolarHBondContact CB-NE2 3.38Å; C1152-H1168 PolarHBondContact SG-NE2 3.04Å; C1152-M1169 HydrophobicContact CB-CE 3.81Å; C1152-M1169 WeakPolarHBondContact SG-CE 3.27Å
1153	T	77.6	Confident	66.3	Low	108 Å²	108	92 Å²	92	66%	0.663	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-35	177.5	51.2	0	0	0	0	112.6	R1151	R1151-T1153 PolarHBondContact O-N 3.45Å
1154	H	76.9	Confident	68.3	Low	78 Å²	78	89 Å²	89	36%	0.361	46%	0.464	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	-49.8	-176.7	-53.8	-48.4	0	0	0	113	C1152 P1177	C1152-H1154 VanDerWaalsContact C-N 3.35Å; H1154-P1177 HydrophobicContact CB-CB 3.94Å; H1154-P1177 VanDerWaalsContact CG-CB 3.48Å; H1154-P1177 WeakPolarHBondContact ND1-CB 3.46Å
1155	C	77.9	Confident	70.4	Confident	1 Å²	1	85.3 Å²	85.3	1%	0.007	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	-7.9	179.1	-68.3	0	0	0	0	114.3	C1152 I1157 H1168 H1172 R1190 F1193	C1152-C1155 HydrophobicContact CB-CB 4.23Å; C1152-C1155 PolarHBondContact SG-N 3.13Å; C1155-I1157 HydrophobicContact CB-CD1 3.94Å; C1155-I1157 HydrophobicContact CB-CG1 4.11Å; C1155-I1157 PolarHBondContact O-N 3.47Å; C1155-H1168 WeakPolarHBondContact CB-NE2 3.16Å; C1155-H1172 PolarHBondContact SG-CE1 2.72Å; C1155-H1172 PolarHBondContact SG-NE2 2.87Å; C1155-H1172 VanDerWaalsContact SG-NE2 3.43Å; C1155-R1190 VanDerWaalsContact C-CZ 3.5Å; C1155-R1190 VanDerWaalsContact C-NE 3.29Å; C1155-R1190 PolarHBondContact O-NE 3.46Å; C1155-R1190 PolarHBondContact O-NH2 3Å; C1155-F1193 WeakPolarHBondContact SG-CD1 3.33Å; C1155-F1193 WeakPolarHBondContact SG-CE1 3.38Å
1156	G	74.3	Confident	72.6	Confident	12 Å²	12	78.6 Å²	78.6	12%	0.124	41%	0.414	C	S	.	.			trans	61.2	7.1	179.6	0	0	0	0	0	115.9	C1152	C1152-G1156 WeakPolarHBondContact O-CA 3.34Å; C1152-G1156 PolarHBondContact O-N 3.25Å
1157	I	78.3	Confident	74.7	Confident	24 Å²	24	74.4 Å²	74.4	12%	0.123	39%	0.391	C	S	.	.			trans	-78	137.6	-179	-62.2	166.6	0	0	0	109.1	P1013 W1017 C1152 C1155 F1159	P1013-I1157 HydrophobicContact CB-CG2 4.06Å; P1013-I1157 HydrophobicContact CG-CG2 4.25Å; W1017-I1157 HydrophobicContact CZ2-CD1 3.75Å; C1152-I1157 PolarHBondContact N-O 3.35Å; C1155-I1157 HydrophobicContact CB-CD1 3.94Å; C1155-I1157 HydrophobicContact CB-CG1 4.11Å; C1155-I1157 PolarHBondContact O-N 3.47Å; I1157-F1159 HydrophobicContact CB-CE2 3.8Å; I1157-F1159 HydrophobicContact CB-CZ 3.98Å; I1157-F1159 HydrophobicContact CG2-CD2 4.23Å; I1157-F1159 HydrophobicContact CG2-CE1 4.06Å; I1157-F1159 HydrophobicContact CG2-CE2 3.54Å; I1157-F1159 HydrophobicContact CG2-CZ 3.44Å; I1157-F1159 VanDerWaalsContact CG2-CZ 3.44Å
1158	Y	81.9	Confident	76.6	Confident	141 Å²	141	67.5 Å²	67.5	55%	0.553	35%	0.354	S	S	*	.	B	Isolated β-bridge	trans	-94.2	140.2	171.7	-66.9	-99.9	0	0	0	110.2	R1151	R1151-Y1158 HydrophobicContact CB-CD1 4.02Å; R1151-Y1158 HydrophobicContact CB-CE1 4.04Å; R1151-Y1158 VanDerWaalsContact CD-CZ 3.49Å; R1151-Y1158 HydrophobicContact CG-CD1 3.99Å; R1151-Y1158 HydrophobicContact CG-CD2 4.25Å; R1151-Y1158 HydrophobicContact CG-CE1 3.84Å; R1151-Y1158 HydrophobicContact CG-CE2 4.1Å; R1151-Y1158 HydrophobicContact CG-CG 4.2Å; R1151-Y1158 VanDerWaalsContact NE-CZ 3.34Å; R1151-Y1158 PolarHBondContact NE-OH 3.06Å
1159	F	81.6	Confident	78	Confident	18 Å²	18	62.7 Å²	62.7	8%	0.079	33%	0.328	C	S	.	.			trans	-119.2	153	175.1	-60.7	-90.9	0	0	0	109.6	W1017 N1150 C1152 I1157 M1164 Y1165 H1168	W1017-F1159 AromaticContact CD1-CE1 3.95Å; W1017-F1159 HydrophobicContact CD2-CE1 4.47Å; W1017-F1159 HydrophobicContact CG-CE1 4.26Å; N1150-F1159 HydrophobicContact CB-CB 4.28Å; N1150-F1159 WeakPolarHBondContact CB-O 3.46Å; N1150-F1159 PolarHBondContact O-N 3.48Å; C1152-F1159 HydrophobicContact CB-CE2 4.3Å; I1157-F1159 HydrophobicContact CB-CE2 3.8Å; I1157-F1159 HydrophobicContact CB-CZ 3.98Å; I1157-F1159 HydrophobicContact CG2-CD2 4.23Å; I1157-F1159 HydrophobicContact CG2-CE1 4.06Å; I1157-F1159 HydrophobicContact CG2-CE2 3.54Å; I1157-F1159 HydrophobicContact CG2-CZ 3.44Å; I1157-F1159 VanDerWaalsContact CG2-CZ 3.44Å; F1159-M1164 HydrophobicContact CD1-CB 3.99Å; F1159-Y1165 HydrophobicContact CD2-CD2 4.02Å; F1159-H1168 HydrophobicContact CE1-CB 3.93Å; F1159-H1168 HydrophobicContact CE2-CB 3.99Å; F1159-H1168 AromaticContact CE2-CD2 3.3Å; F1159-H1168 WeakPolarHBondContact CE2-CD2 3.39Å; F1159-H1168 AromaticContact CE2-CG 3.72Å; F1159-H1168 AromaticContact CE2-NE2 3.98Å; F1159-H1168 HydrophobicContact CZ-CB 3.48Å; F1159-H1168 VanDerWaalsContact CZ-CB 3.48Å; F1159-H1168 AromaticContact CZ-CD2 3.35Å; F1159-H1168 WeakPolarHBondContact CZ-CD2 3.4Å; F1159-H1168 AromaticContact CZ-CG 3.28Å; F1159-H1168 AromaticContact CZ-ND1 3.85Å; F1159-H1168 AromaticContact CZ-NE2 3.94Å
1160	L	75.6	Confident	79.1	Confident	156 Å²	156	62.4 Å²	62.4	82%	0.817	32%	0.323	S	S	*	.	S	Bend	trans	-97.6	-3.7	176.2	-61.4	176.4	0	0	0	112.7
1161	D	81.5	Confident	79.8	Confident	79 Å²	79	60.3 Å²	60.3	42%	0.422	31%	0.312	S	S	.	.			trans	-140.6	126.4	-172.8	176.1	2.2	0	0	0	108.8	V1163 M1164 Y1165	D1161-V1163 PolarHBondContact O-N 3.32Å; D1161-V1163 WeakPolarHBondContact OD1-CB 3.14Å; D1161-V1163 WeakPolarHBondContact OD1-CG2 3.39Å; D1161-V1163 PolarHBondContact OD1-N 2.98Å; D1161-M1164 HydrophobicContact CB-CB 4.13Å; D1161-M1164 HydrophobicContact CB-CG 4.06Å; D1161-M1164 WeakPolarHBondContact O-CB 3.09Å; D1161-M1164 PolarHBondContact O-N 3.03Å; D1161-M1164 VanDerWaalsContact O-N 3.09Å; D1161-Y1165 PolarHBondContact O-N 3.05Å
1162	E	77.9	Confident	79.9	Confident	146 Å²	146	55.7 Å²	55.7	68%	0.682	30%	0.295	S	S	*	.	H	α-helix	trans	-58.9	-33.9	177.2	-173.1	-174.7	-173.1	0	0	111.5	Y1165 A1166	E1162-Y1165 WeakPolarHBondContact O-CB 3.09Å; E1162-Y1165 PolarHBondContact O-N 2.92Å; E1162-A1166 WeakPolarHBondContact O-CB 3.3Å; E1162-A1166 PolarHBondContact O-N 2.88Å
1163	V	79.7	Confident	79.7	Confident	90 Å²	90	56.3 Å²	56.3	55%	0.545	30%	0.301	S	S	.	.	H	α-helix	trans	-65.6	-41.4	176	-176.9	0	0	0	0	110.4	D1161 A1166 L1167	D1161-V1163 PolarHBondContact O-N 3.32Å; D1161-V1163 WeakPolarHBondContact OD1-CB 3.14Å; D1161-V1163 WeakPolarHBondContact OD1-CG2 3.39Å; D1161-V1163 PolarHBondContact OD1-N 2.98Å; V1163-A1166 PolarHBondContact O-N 3.33Å; V1163-L1167 HydrophobicContact CG1-CD1 4.02Å; V1163-L1167 HydrophobicContact CG1-CG 4.46Å; V1163-L1167 VanDerWaalsContact O-CB 3.29Å; V1163-L1167 WeakPolarHBondContact O-CB 3.35Å; V1163-L1167 WeakPolarHBondContact O-CD1 3.22Å; V1163-L1167 WeakPolarHBondContact O-CG 3.49Å; V1163-L1167 PolarHBondContact O-N 2.76Å
1164	M	78.3	Confident	79.2	Confident	27 Å²	27	59.4 Å²	59.4	13%	0.133	31%	0.314	C	S	.	.	H	α-helix	trans	-69.1	-34.8	175.9	-71.8	-71.9	-72.5	0	0	111.9	W1017 L1018 F1159 D1161 H1168	W1017-M1164 HydrophobicContact CB-CE 3.82Å; L1018-M1164 HydrophobicContact CD1-CE 3.61Å; L1018-M1164 HydrophobicContact CD1-SD 4.04Å; F1159-M1164 HydrophobicContact CD1-CB 3.99Å; D1161-M1164 HydrophobicContact CB-CB 4.13Å; D1161-M1164 HydrophobicContact CB-CG 4.06Å; D1161-M1164 WeakPolarHBondContact O-CB 3.09Å; D1161-M1164 PolarHBondContact O-N 3.03Å; D1161-M1164 VanDerWaalsContact O-N 3.09Å; M1164-H1168 WeakPolarHBondContact O-CB 3.46Å; M1164-H1168 PolarHBondContact O-N 2.89Å
1165	Y	81.6	Confident	78.5	Confident	54 Å²	54	64.8 Å²	64.8	21%	0.212	34%	0.336	C	S	.	.	H	α-helix	trans	-63.8	-50.3	172	174.7	-112	0	0	0	111.9	C1152 F1159 D1161 E1162 L1167 H1168 M1169	C1152-Y1165 HydrophobicContact CB-CE2 4.49Å; F1159-Y1165 HydrophobicContact CD2-CD2 4.02Å; D1161-Y1165 PolarHBondContact O-N 3.05Å; E1162-Y1165 WeakPolarHBondContact O-CB 3.09Å; E1162-Y1165 PolarHBondContact O-N 2.92Å; Y1165-L1167 PolarHBondContact O-N 2.86Å; Y1165-H1168 CarbonylContact O-C 3.51Å; Y1165-H1168 WeakPolarHBondContact O-CA 3.39Å; Y1165-H1168 WeakPolarHBondContact O-CB 3.35Å; Y1165-H1168 PolarHBondContact O-N 3.01Å; Y1165-H1168 VanDerWaalsContact O-N 3.09Å; Y1165-M1169 HydrophobicContact CD2-CE 4.43Å; Y1165-M1169 HydrophobicContact CE1-CG 4.18Å; Y1165-M1169 HydrophobicContact CE2-CE 3.92Å; Y1165-M1169 HydrophobicContact CE2-CG 4.17Å; Y1165-M1169 HydrophobicContact CE2-SD 4.11Å; Y1165-M1169 WeakPolarHBondContact O-CG 3.29Å; Y1165-M1169 PolarHBondContact O-N 2.7Å
1166	A	79.8	Confident	78.2	Confident	56 Å²	56	69.2 Å²	69.2	46%	0.463	36%	0.356	S	S	.	.	H	α-helix	trans	-62.5	-40.5	177.5	0	0	0	0	0	112.6	E1162 V1163 H1168 M1169 S1170	E1162-A1166 WeakPolarHBondContact O-CB 3.3Å; E1162-A1166 PolarHBondContact O-N 2.88Å; V1163-A1166 PolarHBondContact O-N 3.33Å; A1166-H1168 VanDerWaalsContact C-N 3.31Å; A1166-H1168 PolarHBondContact O-N 3.08Å; A1166-M1169 PolarHBondContact O-N 3.37Å; A1166-S1170 PolarHBondContact O-N 3.38Å
1167	L	81.3	Confident	78.1	Confident	55 Å²	55	71.1 Å²	71.1	29%	0.288	37%	0.367	S	S	.	.	H	α-helix	trans	-62.9	-37.2	172.5	-73.6	171.3	0	0	0	111.8	W1021 V1163 Y1165 S1170 C1171	W1021-L1167 HydrophobicContact CH2-CD2 3.68Å; W1021-L1167 HydrophobicContact CZ2-CB 3.69Å; W1021-L1167 HydrophobicContact CZ2-CD2 3.66Å; W1021-L1167 HydrophobicContact CZ2-CG 4.17Å; W1021-L1167 HydrophobicContact CZ3-CD2 4.18Å; V1163-L1167 HydrophobicContact CG1-CD1 4.02Å; V1163-L1167 HydrophobicContact CG1-CG 4.46Å; V1163-L1167 VanDerWaalsContact O-CB 3.29Å; V1163-L1167 WeakPolarHBondContact O-CB 3.35Å; V1163-L1167 WeakPolarHBondContact O-CD1 3.22Å; V1163-L1167 WeakPolarHBondContact O-CG 3.49Å; V1163-L1167 PolarHBondContact O-N 2.76Å; Y1165-L1167 PolarHBondContact O-N 2.86Å; L1167-S1170 PolarHBondContact O-N 3.06Å; L1167-S1170 PolarHBondContact O-OG 3.05Å; L1167-C1171 PolarHBondContact O-SG 2.83Å
1168	H	83.9	Confident	78.2	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	38%	0.375	C	S	.	.	H	α-helix	trans	-69.3	-37.2	172.4	176.4	64.4	0	0	0	112.4	W1017 C1152 C1155 F1159 M1164 Y1165 A1166 S1170 C1171 H1172	W1017-H1168 AromaticContact CH2-CE1 3.61Å; W1017-H1168 AromaticContact CH2-ND1 3.13Å; W1017-H1168 WeakPolarHBondContact CH2-ND1 3.49Å; W1017-H1168 AromaticContact CZ2-CE1 3.54Å; W1017-H1168 AromaticContact CZ2-ND1 3.33Å; W1017-H1168 VanDerWaalsContact CZ2-ND1 3.33Å; W1017-H1168 WeakPolarHBondContact CZ2-ND1 3.47Å; W1017-H1168 AromaticContact CZ3-ND1 3.72Å; C1152-H1168 WeakPolarHBondContact CB-NE2 3.38Å; C1152-H1168 PolarHBondContact SG-NE2 3.04Å; C1155-H1168 WeakPolarHBondContact CB-NE2 3.16Å; F1159-H1168 HydrophobicContact CE1-CB 3.93Å; F1159-H1168 HydrophobicContact CE2-CB 3.99Å; F1159-H1168 AromaticContact CE2-CD2 3.3Å; F1159-H1168 WeakPolarHBondContact CE2-CD2 3.39Å; F1159-H1168 AromaticContact CE2-CG 3.72Å; F1159-H1168 AromaticContact CE2-NE2 3.98Å; F1159-H1168 HydrophobicContact CZ-CB 3.48Å; F1159-H1168 VanDerWaalsContact CZ-CB 3.48Å; F1159-H1168 AromaticContact CZ-CD2 3.35Å; F1159-H1168 WeakPolarHBondContact CZ-CD2 3.4Å; F1159-H1168 AromaticContact CZ-CG 3.28Å; F1159-H1168 AromaticContact CZ-ND1 3.85Å; F1159-H1168 AromaticContact CZ-NE2 3.94Å; M1164-H1168 WeakPolarHBondContact O-CB 3.46Å; M1164-H1168 PolarHBondContact O-N 2.89Å; Y1165-H1168 CarbonylContact O-C 3.51Å; Y1165-H1168 WeakPolarHBondContact O-CA 3.39Å; Y1165-H1168 WeakPolarHBondContact O-CB 3.35Å; Y1165-H1168 PolarHBondContact O-N 3.01Å; Y1165-H1168 VanDerWaalsContact O-N 3.09Å; A1166-H1168 VanDerWaalsContact C-N 3.31Å; A1166-H1168 PolarHBondContact O-N 3.08Å; H1168-S1170 VanDerWaalsContact C-N 3.28Å; H1168-S1170 PolarHBondContact O-N 3.22Å; H1168-C1171 WeakPolarHBondContact O-CB 3.49Å; H1168-C1171 PolarHBondContact O-N 3.11Å; H1168-C1171 PolarHBondContact O-SG 3.27Å; H1168-H1172 AromaticContact CE1-NE2 3.95Å; H1168-H1172 AromaticContact NE2-NE2 3.79Å
1169	M	82.2	Confident	78.2	Confident	51 Å²	51	68.6 Å²	68.6	25%	0.251	36%	0.357	S	S	.	.	H	α-helix	trans	-60	-39	173.6	-69.6	-59.5	91.5	0	0	111.5	C1152 Y1165 A1166 C1171 H1172	C1152-M1169 HydrophobicContact CB-CE 3.81Å; C1152-M1169 WeakPolarHBondContact SG-CE 3.27Å; Y1165-M1169 HydrophobicContact CD2-CE 4.43Å; Y1165-M1169 HydrophobicContact CE1-CG 4.18Å; Y1165-M1169 HydrophobicContact CE2-CE 3.92Å; Y1165-M1169 HydrophobicContact CE2-CG 4.17Å; Y1165-M1169 HydrophobicContact CE2-SD 4.11Å; Y1165-M1169 WeakPolarHBondContact O-CG 3.29Å; Y1165-M1169 PolarHBondContact O-N 2.7Å; A1166-M1169 PolarHBondContact O-N 3.37Å; M1169-C1171 PolarHBondContact O-N 2.66Å; M1169-H1172 WeakPolarHBondContact O-CB 3.33Å; M1169-H1172 PolarHBondContact O-N 2.75Å
1170	S	79.6	Confident	78.3	Confident	55 Å²	55	67.7 Å²	67.7	39%	0.385	35%	0.353	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-8.5	173.6	78.8	0	0	0	0	115.2	A1166 L1167 H1168	A1166-S1170 PolarHBondContact O-N 3.38Å; L1167-S1170 PolarHBondContact O-N 3.06Å; L1167-S1170 PolarHBondContact O-OG 3.05Å; H1168-S1170 VanDerWaalsContact C-N 3.28Å; H1168-S1170 PolarHBondContact O-N 3.22Å
1171	C	81.2	Confident	78.5	Confident	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-22.5	171.6	-56.6	0	0	0	0	112.7	L1167 H1168 M1169 C1180 G1181 F1182 F1193 I1197	L1167-C1171 PolarHBondContact O-SG 2.83Å; H1168-C1171 WeakPolarHBondContact O-CB 3.49Å; H1168-C1171 PolarHBondContact O-N 3.11Å; H1168-C1171 PolarHBondContact O-SG 3.27Å; M1169-C1171 PolarHBondContact O-N 2.66Å; C1171-C1180 CarbonylContact O-C 3.46Å; C1171-C1180 WeakPolarHBondContact O-CA 3.48Å; C1171-G1181 PolarHBondContact O-N 3.29Å; C1171-F1182 HydrophobicContact CB-CE2 4.18Å; C1171-F1193 HydrophobicContact CB-CZ 4.23Å; C1171-F1193 WeakPolarHBondContact O-CZ 3.26Å; C1171-I1197 HydrophobicContact CB-CD1 4.02Å
1172	H	83.1	Confident	78.3	Confident	19 Å²	19	60.7 Å²	60.7	9%	0.088	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	152.9	177.6	-66.5	-85.9	0	0	0	110.9	C1155 H1168 M1169 P1177 Q1179 F1193	C1155-H1172 PolarHBondContact SG-CE1 2.72Å; C1155-H1172 PolarHBondContact SG-NE2 2.87Å; C1155-H1172 VanDerWaalsContact SG-NE2 3.43Å; H1168-H1172 AromaticContact CE1-NE2 3.95Å; H1168-H1172 AromaticContact NE2-NE2 3.79Å; M1169-H1172 WeakPolarHBondContact O-CB 3.33Å; M1169-H1172 PolarHBondContact O-N 2.75Å; H1172-P1177 PolarHBondContact CE1-O 3.05Å; H1172-P1177 VanDerWaalsContact CE1-O 3.23Å; H1172-P1177 PolarHBondContact ND1-O 3.43Å; H1172-Q1179 CarbonylContact C-O 3.54Å; H1172-F1193 AromaticContact CE1-CE1 3.39Å; H1172-F1193 WeakPolarHBondContact CE1-CE1 3.33Å; H1172-F1193 AromaticContact CE1-CZ 3.62Å; H1172-F1193 AromaticContact CG-CZ 3.97Å; H1172-F1193 AromaticContact ND1-CE1 3.84Å; H1172-F1193 AromaticContact ND1-CZ 3.57Å; H1172-F1193 AromaticContact NE2-CE1 3.75Å
1173	G	79.1	Confident	78.5	Confident	12 Å²	12	54.7 Å²	54.7	12%	0.124	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	145.6	175.7	0	0	0	0	0	111.8	K1175 E1176 Q1179	G1173-K1175 PolarHBondContact O-N 2.7Å; G1173-E1176 PolarHBondContact O-N 2.85Å; G1173-Q1179 PolarHBondContact N-O 2.97Å
1174	D	67.4	Low	78.6	Confident	174 Å²	174	55.8 Å²	55.8	93%	0.93	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-9.8	-172.8	-46.4	-49.3	0	0	0	115.7
1175	K	62.1	Low	78.6	Confident	190 Å²	190	59.4 Å²	59.4	83%	0.826	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.1	-21.8	-174.2	-61.9	-174.1	-179.1	-178	0	114.8	G1173	G1173-K1175 PolarHBondContact O-N 2.7Å
1176	E	72.4	Confident	78.6	Confident	94 Å²	94	60.4 Å²	60.4	44%	0.439	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	128.7	-178.9	-75.1	-165.3	154.9	0	0	112.1	G1173 Y1178 Q1179 V1186	G1173-E1176 PolarHBondContact O-N 2.85Å; E1176-Y1178 PolarHBondContact O-N 3.42Å; E1176-Y1178 VanDerWaalsContact O-N 3.1Å; E1176-Q1179 HydrophobicContact CB-CB 3.92Å; E1176-Q1179 PolarHBondContact O-N 2.9Å; E1176-V1186 WeakPolarHBondContact OE2-CG1 3.33Å; E1176-V1186 WeakPolarHBondContact OE2-CG2 3.46Å
1177	P	72.5	Confident	78.7	Confident	52 Å²	52	58.2 Å²	58.2	34%	0.338	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71	-8.4	-173.1	30.1	-37.1	0	0	0	114.3	H1154 H1172	H1154-P1177 HydrophobicContact CB-CB 3.94Å; H1154-P1177 VanDerWaalsContact CG-CB 3.48Å; H1154-P1177 WeakPolarHBondContact ND1-CB 3.46Å; H1172-P1177 PolarHBondContact CE1-O 3.05Å; H1172-P1177 VanDerWaalsContact CE1-O 3.23Å; H1172-P1177 PolarHBondContact ND1-O 3.43Å
1178	Y	79.8	Confident	78.6	Confident	74 Å²	74	60 Å²	60	29%	0.29	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	12.8	173	-55	-52.7	0	0	0	113	E1176 C1187 R1190 F1193	E1176-Y1178 PolarHBondContact O-N 3.42Å; E1176-Y1178 VanDerWaalsContact O-N 3.1Å; Y1178-C1187 WeakPolarHBondContact CB-O 3.32Å; Y1178-C1187 WeakPolarHBondContact O-CB 3.37Å; Y1178-C1187 PolarHBondContact O-N 3.34Å; Y1178-R1190 HydrophobicContact CD1-CB 4.49Å; Y1178-R1190 HydrophobicContact CE1-CB 3.68Å; Y1178-R1190 HydrophobicContact CE1-CG 4.4Å; Y1178-F1193 HydrophobicContact CD1-CB 4.06Å; Y1178-F1193 HydrophobicContact CD1-CG 4.34Å; Y1178-F1193 WeakPolarHBondContact O-CD2 3.42Å
1179	Q	82.3	Confident	78.3	Confident	38 Å²	38	63.6 Å²	63.6	18%	0.178	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	129.2	166.8	-176.1	169.8	57.5	0	0	110.3	H1172 G1173 E1176 G1181 L1184 V1186	H1172-Q1179 CarbonylContact C-O 3.54Å; G1173-Q1179 PolarHBondContact N-O 2.97Å; E1176-Q1179 HydrophobicContact CB-CB 3.92Å; E1176-Q1179 PolarHBondContact O-N 2.9Å; Q1179-G1181 PolarHBondContact O-N 3.37Å; Q1179-L1184 PolarHBondContact NE2-O 2.93Å; Q1179-V1186 HydrophobicContact CB-CG2 4.24Å; Q1179-V1186 HydrophobicContact CG-CG2 4.15Å
1180	C	83.2	Confident	78.1	Confident	0 Å²	0	66.9 Å²	66.9	0%	0	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	110	175.5	173.7	0	0	0	0	111.2	C1171 F1182 C1183 L1184 H1185 F1193 I1197	C1171-C1180 CarbonylContact O-C 3.46Å; C1171-C1180 WeakPolarHBondContact O-CA 3.48Å; C1180-F1182 PolarHBondContact O-N 2.92Å; C1180-C1183 PolarHBondContact O-N 3.49Å; C1180-C1183 VanDerWaalsContact SG-SG 3.63Å; C1180-L1184 WeakPolarHBondContact O-CA 3.41Å; C1180-L1184 PolarHBondContact O-N 3.38Å; C1180-H1185 PolarHBondContact N-O 3.31Å; C1180-F1193 HydrophobicContact CB-CE2 4.43Å; C1180-I1197 HydrophobicContact CB-CD1 4.3Å
1181	G	79.1	Confident	78.1	Confident	31 Å²	31	71 Å²	71	32%	0.32	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-33.2	-179.7	0	0	0	0	0	114.5	C1171 Q1179	C1171-G1181 PolarHBondContact O-N 3.29Å; Q1179-G1181 PolarHBondContact O-N 3.37Å
1182	F	78.2	Confident	78.1	Confident	57 Å²	57	74.5 Å²	74.5	25%	0.25	38%	0.384	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.2	-15.9	-179.7	-55.7	-64.1	0	0	0	116.5	F1020 W1021 Y1024 C1171 C1180	F1020-F1182 HydrophobicContact CE1-CE2 4.46Å; F1020-F1182 HydrophobicContact CZ-CD2 4.37Å; F1020-F1182 HydrophobicContact CZ-CE2 4.11Å; W1021-F1182 HydrophobicContact CH2-CZ 4.04Å; W1021-F1182 HydrophobicContact CZ2-CZ 4.3Å; Y1024-F1182 AromaticContact CE2-CD1 3.58Å; Y1024-F1182 HydrophobicContact CE2-CD1 3.58Å; Y1024-F1182 AromaticContact CE2-CE1 3.72Å; Y1024-F1182 HydrophobicContact CE2-CE1 3.72Å; Y1024-F1182 HydrophobicContact CE2-CG 4.05Å; Y1024-F1182 HydrophobicContact CE2-CZ 4.3Å; Y1024-F1182 AromaticContact CZ-CE1 3.8Å; C1171-F1182 HydrophobicContact CB-CE2 4.18Å; C1180-F1182 PolarHBondContact O-N 2.92Å
1183	C	81.9	Confident	78	Confident	20 Å²	20	73.6 Å²	73.6	14%	0.135	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-149.4	8.3	-178.8	67.1	0	0	0	0	115.2	C1180 H1185 H1196 H1202	C1180-C1183 PolarHBondContact O-N 3.49Å; C1180-C1183 VanDerWaalsContact SG-SG 3.63Å; C1183-H1185 PolarHBondContact O-N 3.05Å; C1183-H1196 PolarHBondContact SG-NE2 3.12Å; C1183-H1202 HydrophobicContact CB-CB 4Å; C1183-H1202 PolarHBondContact SG-ND1 2.91Å
1184	L	80.8	Confident	78	Confident	113 Å²	113	75 Å²	75	59%	0.592	39%	0.386	S	S	*	.			trans	57	11.9	178.6	-52.5	-179.7	0	0	0	115.5	Q1179 C1180 V1186	Q1179-L1184 PolarHBondContact NE2-O 2.93Å; C1180-L1184 WeakPolarHBondContact O-CA 3.41Å; C1180-L1184 PolarHBondContact O-N 3.38Å; L1184-V1186 PolarHBondContact O-N 2.92Å
1185	H	78.9	Confident	78.7	Confident	103 Å²	103	67 Å²	67	48%	0.477	34%	0.344	S	S	.	.			trans	-67.8	114	175.3	-173.4	65.7	0	0	0	110.4	C1180 C1183 H1196	C1180-H1185 PolarHBondContact N-O 3.31Å; C1183-H1185 PolarHBondContact O-N 3.05Å; H1185-H1196 AromaticContact CD2-CE1 3.47Å; H1185-H1196 PolarHBondContact CD2-CE1 3.42Å; H1185-H1196 VanDerWaalsContact CD2-CE1 3.47Å; H1185-H1196 AromaticContact CD2-ND1 3.25Å; H1185-H1196 PolarHBondContact CD2-ND1 3.11Å; H1185-H1196 AromaticContact CG-CE1 3.84Å; H1185-H1196 AromaticContact NE2-ND1 3.97Å
1186	V	82.6	Confident	79.6	Confident	75 Å²	75	59.1 Å²	59.1	46%	0.455	31%	0.31	S	S	.	.	B	Isolated β-bridge	trans	-77.7	122.9	172.9	-177.2	0	0	0	0	108.7	E1176 Q1179 L1184	E1176-V1186 WeakPolarHBondContact OE2-CG1 3.33Å; E1176-V1186 WeakPolarHBondContact OE2-CG2 3.46Å; Q1179-V1186 HydrophobicContact CB-CG2 4.24Å; Q1179-V1186 HydrophobicContact CG-CG2 4.15Å; L1184-V1186 PolarHBondContact O-N 2.92Å
1187	C	81.4	Confident	80.1	Confident	9 Å²	9	54.7 Å²	54.7	6%	0.061	29%	0.289	C	S	.	.			trans	-98	144.3	176	-56.7	0	0	0	0	109.4	Y1178 D1189 D1192 F1193	Y1178-C1187 WeakPolarHBondContact CB-O 3.32Å; Y1178-C1187 WeakPolarHBondContact O-CB 3.37Å; Y1178-C1187 PolarHBondContact O-N 3.34Å; C1187-D1189 PolarHBondContact O-N 3.21Å; C1187-D1192 HydrophobicContact CB-CB 3.97Å; C1187-F1193 HydrophobicContact CB-CB 3.89Å
1188	A	79.3	Confident	80.3	Confident	92 Å²	92	56.6 Å²	56.6	76%	0.76	29%	0.294	S	S	*	.	S	Bend	trans	-70.2	-31.8	-175.4	0	0	0	0	0	113.1
1189	D	77.3	Confident	80.2	Confident	77 Å²	77	59.3 Å²	59.3	41%	0.412	30%	0.303	S	S	.	.	S	Bend	trans	-146.8	-179.7	176.9	73.4	30.8	0	0	0	113.2	C1187 Y1191 D1192 F1193	C1187-D1189 PolarHBondContact O-N 3.21Å; D1189-Y1191 VanDerWaalsContact C-N 3.32Å; D1189-Y1191 PolarHBondContact O-N 2.64Å; D1189-Y1191 VanDerWaalsContact OD1-CA 3.31Å; D1189-Y1191 WeakPolarHBondContact OD1-CA 3.35Å; D1189-Y1191 WeakPolarHBondContact OD1-CB 3.44Å; D1189-Y1191 PolarHBondContact OD1-N 3.08Å; D1189-D1192 PolarHBondContact O-N 3.28Å; D1189-D1192 PolarHBondContact OD1-N 2.8Å; D1189-F1193 WeakPolarHBondContact O-CB 3.48Å; D1189-F1193 PolarHBondContact O-N 3.37Å
1190	R	79.1	Confident	79.6	Confident	119 Å²	119	58.2 Å²	58.2	45%	0.449	30%	0.302	S	S	.	.	H	α-helix	trans	-61.7	-31.5	178.3	176.5	175.7	163.1	-171.1	-5.2	114	C1155 Y1178 T1194	C1155-R1190 VanDerWaalsContact C-CZ 3.5Å; C1155-R1190 VanDerWaalsContact C-NE 3.29Å; C1155-R1190 PolarHBondContact O-NE 3.46Å; C1155-R1190 PolarHBondContact O-NH2 3Å; Y1178-R1190 HydrophobicContact CD1-CB 4.49Å; Y1178-R1190 HydrophobicContact CE1-CB 3.68Å; Y1178-R1190 HydrophobicContact CE1-CG 4.4Å; R1190-T1194 VanDerWaalsContact O-CB 3.29Å; R1190-T1194 WeakPolarHBondContact O-CB 3.4Å; R1190-T1194 PolarHBondContact O-N 3.06Å; R1190-T1194 PolarHBondContact O-OG1 3.29Å
1191	Y	79.5	Confident	78.7	Confident	143 Å²	143	63.9 Å²	63.9	56%	0.561	33%	0.332	S	S	*	.	H	α-helix	trans	-78.8	-42.6	179.5	179.7	-97	0	0	0	111.1	D1189 F1193 T1194 T1195	D1189-Y1191 VanDerWaalsContact C-N 3.32Å; D1189-Y1191 PolarHBondContact O-N 2.64Å; D1189-Y1191 VanDerWaalsContact OD1-CA 3.31Å; D1189-Y1191 WeakPolarHBondContact OD1-CA 3.35Å; D1189-Y1191 WeakPolarHBondContact OD1-CB 3.44Å; D1189-Y1191 PolarHBondContact OD1-N 3.08Å; Y1191-F1193 VanDerWaalsContact C-N 3.34Å; Y1191-T1194 PolarHBondContact O-N 3.14Å; Y1191-T1195 HydrophobicContact CD1-CG2 4.36Å; Y1191-T1195 HydrophobicContact CD2-CG2 4.35Å; Y1191-T1195 HydrophobicContact CE1-CG2 4.03Å; Y1191-T1195 HydrophobicContact CE2-CG2 4.02Å; Y1191-T1195 WeakPolarHBondContact O-CB 3.01Å; Y1191-T1195 VanDerWaalsContact O-CG2 3.31Å; Y1191-T1195 WeakPolarHBondContact O-CG2 3.41Å; Y1191-T1195 PolarHBondContact O-N 3.27Å; Y1191-T1195 PolarHBondContact O-OG1 2.95Å
1192	D	79.5	Confident	78.4	Confident	72 Å²	72	64.9 Å²	64.9	39%	0.385	33%	0.328	S	S	.	.	H	α-helix	trans	-59.8	-44.9	169.7	-89.5	-11	0	0	0	110.8	C1187 D1189 T1195 H1196	C1187-D1192 HydrophobicContact CB-CB 3.97Å; D1189-D1192 PolarHBondContact O-N 3.28Å; D1189-D1192 PolarHBondContact OD1-N 2.8Å; D1192-T1195 PolarHBondContact O-N 3.2Å; D1192-T1195 PolarHBondContact O-OG1 3.02Å; D1192-H1196 WeakPolarHBondContact O-CB 3.41Å; D1192-H1196 PolarHBondContact O-N 3.06Å
1193	F	82.2	Confident	77.1	Confident	0 Å²	0	70.8 Å²	70.8	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-60.6	-51.4	175	-177.3	-97.1	0	0	0	112.4	C1155 C1171 H1172 Y1178 C1180 C1187 D1189 Y1191 T1195 H1196 I1197	C1155-F1193 WeakPolarHBondContact SG-CD1 3.33Å; C1155-F1193 WeakPolarHBondContact SG-CE1 3.38Å; C1171-F1193 HydrophobicContact CB-CZ 4.23Å; C1171-F1193 WeakPolarHBondContact O-CZ 3.26Å; H1172-F1193 AromaticContact CE1-CE1 3.39Å; H1172-F1193 WeakPolarHBondContact CE1-CE1 3.33Å; H1172-F1193 AromaticContact CE1-CZ 3.62Å; H1172-F1193 AromaticContact CG-CZ 3.97Å; H1172-F1193 AromaticContact ND1-CE1 3.84Å; H1172-F1193 AromaticContact ND1-CZ 3.57Å; H1172-F1193 AromaticContact NE2-CE1 3.75Å; Y1178-F1193 HydrophobicContact CD1-CB 4.06Å; Y1178-F1193 HydrophobicContact CD1-CG 4.34Å; Y1178-F1193 WeakPolarHBondContact O-CD2 3.42Å; C1180-F1193 HydrophobicContact CB-CE2 4.43Å; C1187-F1193 HydrophobicContact CB-CB 3.89Å; D1189-F1193 WeakPolarHBondContact O-CB 3.48Å; D1189-F1193 PolarHBondContact O-N 3.37Å; Y1191-F1193 VanDerWaalsContact C-N 3.34Å; F1193-T1195 VanDerWaalsContact C-N 3.32Å; F1193-T1195 PolarHBondContact O-N 2.99Å; F1193-H1196 WeakPolarHBondContact O-CB 3.48Å; F1193-H1196 PolarHBondContact O-N 2.98Å; F1193-I1197 HydrophobicContact CD1-CG1 4.43Å; F1193-I1197 HydrophobicContact CE1-CG1 4.12Å; F1193-I1197 HydrophobicContact CE2-CD1 4.47Å; F1193-I1197 HydrophobicContact CE2-CG1 4.41Å; F1193-I1197 HydrophobicContact CZ-CD1 4.31Å; F1193-I1197 HydrophobicContact CZ-CG1 4.13Å; F1193-I1197 WeakPolarHBondContact O-CG1 3.13Å; F1193-I1197 PolarHBondContact O-N 3.27Å
1194	T	79.1	Confident	75.3	Confident	41 Å²	41	75.9 Å²	75.9	25%	0.252	39%	0.385	S	S	.	.	H	α-helix	trans	-59.8	-44.2	-180	-58.1	0	0	0	0	111	R1190 Y1191 Q1198	R1190-T1194 VanDerWaalsContact O-CB 3.29Å; R1190-T1194 WeakPolarHBondContact O-CB 3.4Å; R1190-T1194 PolarHBondContact O-N 3.06Å; R1190-T1194 PolarHBondContact O-OG1 3.29Å; Y1191-T1194 PolarHBondContact O-N 3.14Å; T1194-Q1198 VanDerWaalsContact O-CB 3.28Å; T1194-Q1198 WeakPolarHBondContact O-CB 3.28Å; T1194-Q1198 PolarHBondContact O-N 3.41Å
1195	T	81.1	Confident	73.6	Confident	8 Å²	8	77.2 Å²	77.2	5%	0.049	39%	0.391	C	S	.	.	H	α-helix	trans	-75.9	-27.4	179.6	63.8	0	0	0	0	113.1	Y1191 D1192 F1193 R1199	Y1191-T1195 HydrophobicContact CD1-CG2 4.36Å; Y1191-T1195 HydrophobicContact CD2-CG2 4.35Å; Y1191-T1195 HydrophobicContact CE1-CG2 4.03Å; Y1191-T1195 HydrophobicContact CE2-CG2 4.02Å; Y1191-T1195 WeakPolarHBondContact O-CB 3.01Å; Y1191-T1195 VanDerWaalsContact O-CG2 3.31Å; Y1191-T1195 WeakPolarHBondContact O-CG2 3.41Å; Y1191-T1195 PolarHBondContact O-N 3.27Å; Y1191-T1195 PolarHBondContact O-OG1 2.95Å; D1192-T1195 PolarHBondContact O-N 3.2Å; D1192-T1195 PolarHBondContact O-OG1 3.02Å; F1193-T1195 VanDerWaalsContact C-N 3.32Å; F1193-T1195 PolarHBondContact O-N 2.99Å; T1195-R1199 WeakPolarHBondContact O-CB 3.49Å; T1195-R1199 VanDerWaalsContact O-CD 3.27Å; T1195-R1199 WeakPolarHBondContact O-CD 3.46Å; T1195-R1199 WeakPolarHBondContact O-CG 3.1Å; T1195-R1199 PolarHBondContact O-N 2.86Å; T1195-R1199 PolarHBondContact OG1-NH1 3.49Å
1196	H	82.4	Confident	71.6	Confident	23 Å²	23	77.4 Å²	77.4	11%	0.106	40%	0.402	C	S	.	.	H	α-helix	trans	-60.9	-51.7	169.9	173.7	93	0	0	0	110.8	C1183 H1185 D1192 F1193 G1200 H1202	C1183-H1196 PolarHBondContact SG-NE2 3.12Å; H1185-H1196 AromaticContact CD2-CE1 3.47Å; H1185-H1196 PolarHBondContact CD2-CE1 3.42Å; H1185-H1196 VanDerWaalsContact CD2-CE1 3.47Å; H1185-H1196 AromaticContact CD2-ND1 3.25Å; H1185-H1196 PolarHBondContact CD2-ND1 3.11Å; H1185-H1196 AromaticContact CG-CE1 3.84Å; H1185-H1196 AromaticContact NE2-ND1 3.97Å; D1192-H1196 WeakPolarHBondContact O-CB 3.41Å; D1192-H1196 PolarHBondContact O-N 3.06Å; F1193-H1196 WeakPolarHBondContact O-CB 3.48Å; F1193-H1196 PolarHBondContact O-N 2.98Å; H1196-G1200 PolarHBondContact O-N 3.33Å; H1196-H1202 AromaticContact CD2-CE1 3.65Å; H1196-H1202 AromaticContact CD2-ND1 3.85Å; H1196-H1202 AromaticContact CE1-ND1 3.92Å; H1196-H1202 AromaticContact NE2-CE1 3.35Å; H1196-H1202 PolarHBondContact NE2-CE1 3.06Å; H1196-H1202 AromaticContact NE2-ND1 3.06Å; H1196-H1202 PolarHBondContact NE2-ND1 3.27Å
1197	I	81.4	Confident	69.6	Low	1 Å²	1	79.3 Å²	79.3	1%	0.005	42%	0.416	C	S	.	.	H	α-helix	trans	-63.3	-50.7	178	-59.5	-69.6	0	0	0	110.6	W1017 F1020 C1171 C1180 F1193 R1199 G1200	W1017-I1197 HydrophobicContact CE3-CG2 4.49Å; W1017-I1197 HydrophobicContact CH2-CB 4.33Å; W1017-I1197 HydrophobicContact CH2-CG2 3.57Å; W1017-I1197 HydrophobicContact CZ3-CG2 3.44Å; W1017-I1197 VanDerWaalsContact CZ3-CG2 3.44Å; F1020-I1197 HydrophobicContact CD1-CG2 4.36Å; F1020-I1197 HydrophobicContact CD2-CG2 3.91Å; F1020-I1197 WeakPolarHBondContact CD2-O 3.5Å; F1020-I1197 HydrophobicContact CE1-CG2 4.19Å; F1020-I1197 HydrophobicContact CE2-CG2 3.71Å; F1020-I1197 WeakPolarHBondContact CE2-O 3.28Å; F1020-I1197 HydrophobicContact CG-CG2 4.23Å; F1020-I1197 HydrophobicContact CZ-CG2 3.86Å; C1171-I1197 HydrophobicContact CB-CD1 4.02Å; C1180-I1197 HydrophobicContact CB-CD1 4.3Å; F1193-I1197 HydrophobicContact CD1-CG1 4.43Å; F1193-I1197 HydrophobicContact CE1-CG1 4.12Å; F1193-I1197 HydrophobicContact CE2-CD1 4.47Å; F1193-I1197 HydrophobicContact CE2-CG1 4.41Å; F1193-I1197 HydrophobicContact CZ-CD1 4.31Å; F1193-I1197 HydrophobicContact CZ-CG1 4.13Å; F1193-I1197 WeakPolarHBondContact O-CG1 3.13Å; F1193-I1197 PolarHBondContact O-N 3.27Å; I1197-R1199 VanDerWaalsContact C-N 3.33Å; I1197-R1199 PolarHBondContact O-N 3.31Å; I1197-G1200 WeakPolarHBondContact O-CA 3.41Å; I1197-G1200 PolarHBondContact O-N 3.07Å
1198	Q	77.7	Confident	68.1	Low	92 Å²	92	84.3 Å²	84.3	43%	0.43	45%	0.448	S	S	.	.	H	α-helix	trans	-60.4	-38.3	-180	-168.3	-166.9	30.8	0	0	112.7	D1016 T1194 G1200	D1016-Q1198 PolarHBondContact OD2-NE2 3.45Å; T1194-Q1198 VanDerWaalsContact O-CB 3.28Å; T1194-Q1198 WeakPolarHBondContact O-CB 3.28Å; T1194-Q1198 PolarHBondContact O-N 3.41Å; Q1198-G1200 VanDerWaalsContact C-N 3.3Å
1199	R	77.9	Confident	66.7	Low	132 Å²	132	85.3 Å²	85.3	50%	0.498	45%	0.447	S	S	.	.	H	α-helix	trans	-69.7	-28.4	173.4	-70.8	167	-174.6	137.5	3.7	111.5	K1023 T1195 I1197 L1201	K1023-R1199 PolarHBondContact NZ-O 2.77Å; T1195-R1199 WeakPolarHBondContact O-CB 3.49Å; T1195-R1199 VanDerWaalsContact O-CD 3.27Å; T1195-R1199 WeakPolarHBondContact O-CD 3.46Å; T1195-R1199 WeakPolarHBondContact O-CG 3.1Å; T1195-R1199 PolarHBondContact O-N 2.86Å; T1195-R1199 PolarHBondContact OG1-NH1 3.49Å; I1197-R1199 VanDerWaalsContact C-N 3.33Å; I1197-R1199 PolarHBondContact O-N 3.31Å; R1199-L1201 HydrophobicContact CB-CD1 4.05Å; R1199-L1201 HydrophobicContact CB-CG 4.06Å; R1199-L1201 PolarHBondContact O-N 3.14Å
1200	G	68.9	Low	65.3	Low	15 Å²	15	87 Å²	87	16%	0.155	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	56.6	50.8	178.7	0	0	0	0	0	111.7	K1023 H1196 I1197 Q1198	K1023-G1200 PolarHBondContact NZ-O 3.28Å; H1196-G1200 PolarHBondContact O-N 3.33Å; I1197-G1200 WeakPolarHBondContact O-CA 3.41Å; I1197-G1200 PolarHBondContact O-N 3.07Å; Q1198-G1200 VanDerWaalsContact C-N 3.3Å
1201	L	64.8	Low	64.2	Low	118 Å²	118	87.2 Å²	87.2	62%	0.618	48%	0.479	S	S	*	.			trans	-104.3	45	-177.9	-70.2	175.3	0	0	0	111.3	R1199 K1203	R1199-L1201 HydrophobicContact CB-CD1 4.05Å; R1199-L1201 HydrophobicContact CB-CG 4.06Å; R1199-L1201 PolarHBondContact O-N 3.14Å; L1201-K1203 VanDerWaalsContact C-N 3.33Å; L1201-K1203 PolarHBondContact O-N 3Å
1202	H	72.3	Confident	62.7	Low	53 Å²	53	89.3 Å²	89.3	25%	0.245	49%	0.494	C	S	.	.			trans	-70.8	86.3	178.3	-49.2	-51.8	0	0	0	110.3	F1020 C1183 H1196 T1204	F1020-H1202 AromaticContact CE2-NE2 3.55Å; C1183-H1202 HydrophobicContact CB-CB 4Å; C1183-H1202 PolarHBondContact SG-ND1 2.91Å; H1196-H1202 AromaticContact CD2-CE1 3.65Å; H1196-H1202 AromaticContact CD2-ND1 3.85Å; H1196-H1202 AromaticContact CE1-ND1 3.92Å; H1196-H1202 AromaticContact NE2-CE1 3.35Å; H1196-H1202 PolarHBondContact NE2-CE1 3.06Å; H1196-H1202 AromaticContact NE2-ND1 3.06Å; H1196-H1202 PolarHBondContact NE2-ND1 3.27Å; H1202-T1204 PolarHBondContact O-N 2.68Å
1203	K	51.8	Low	60.7	Low	180 Å²	180	98.7 Å²	98.7	78%	0.783	54%	0.535	S	S	*	.	P	Polyproline II helix	trans	-72.5	117	164.8	-65.6	-179.6	-178.7	178.2	0	107.4	L1201 L1205	L1201-K1203 VanDerWaalsContact C-N 3.33Å; L1201-K1203 PolarHBondContact O-N 3Å; K1203-L1205 PolarHBondContact O-N 2.89Å
1204	T	44.2	Very low	59.6	Low	128 Å²	128	103.6 Å²	103.6	79%	0.785	56%	0.562	S	S	*	*	P	Polyproline II helix	trans	-60.1	121.6	166.2	49.1	0	0	0	0	108.6	H1202	H1202-T1204 PolarHBondContact O-N 2.68Å
1205	L	43.4	Very low	58.6	Low	140 Å²	140	106.9 Å²	106.9	73%	0.733	58%	0.578	S	S	*	*	P	Polyproline II helix	trans	-60.2	148.7	163.7	-95	73.6	0	0	0	109	K1203	K1203-L1205 PolarHBondContact O-N 2.89Å
1206	P	38.5	Very low	57.3	Low	107 Å²	107	112.4 Å²	112.4	70%	0.695	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-59.9	149.3	163.5	29.4	-34.4	0	0	0	109.2
1207	P	40.6	Very low	55.9	Low	116 Å²	116	117.6 Å²	117.6	75%	0.753	64%	0.637	S	S	*	*	P	Polyproline II helix	trans	-59.6	147.8	173.3	27.4	-34.7	0	0	0	110
1208	P	49.5	Very low	54.3	Low	113 Å²	113	124.9 Å²	124.9	73%	0.734	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-59.5	149	170.4	27.8	-34.6	0	0	0	109.7
1209	P	48.5	Very low	52.7	Low	114 Å²	114	127.1 Å²	127.1	74%	0.74	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-58.7	145.8	171.4	27.4	-34.4	0	0	0	109.6
1210	P	49.5	Very low	50.9	Low	111 Å²	111	126.8 Å²	126.8	72%	0.721	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-60.5	145.4	175.7	27.1	-34.5	0	0	0	110.1	Q1212	P1210-Q1212 PolarHBondContact O-N 3.16Å
1211	P	54.8	Low	49.5	Very low	124 Å²	124	135.4 Å²	135.4	81%	0.805	75%	0.749	S	S	*	*	P	Polyproline II helix	trans	-60.3	136.9	173.4	27	-34.1	0	0	0	109.8	Q1213	P1211-Q1213 PolarHBondContact O-N 3.45Å; P1211-Q1213 VanDerWaalsContact O-N 3.16Å
1212	Q	48.7	Very low	48.3	Very low	187 Å²	187	136.8 Å²	136.8	87%	0.874	76%	0.76	S	S	*	*			trans	-78.5	97.1	176.1	-73.8	-176.5	-20.7	0	0	110.9	P1210	P1210-Q1212 PolarHBondContact O-N 3.16Å
1213	Q	37.2	Very low	46.1	Very low	269 Å²	269	144.5 Å²	144.5	100%	1.257	81%	0.807	S	S	*	*			trans	-163.6	0	154	-114.9	150.3	86.6	0	0	110.6	P1211	P1211-Q1213 PolarHBondContact O-N 3.45Å; P1211-Q1213 VanDerWaalsContact O-N 3.16Å

Retrieved 1,213 of 1,213 residues in 145.8 ms (Link to these results)

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