A0A5K4FEK0_SCHMA Loading...

CUB domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FEK0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,523 aa.

						>A0A5K4FEK0_SCHMA|A0A5K4FEK0
MVQSYNSLTNMFITNWRNIINRYIWITALLVIHVQCETDLFKSNKLIIGSLIEMDYWSLYRLPNQSTVCNQFINSYYLDDLKEDGRSVPLSKSSLSSGISSSSTSSSSIPTSSSSSSSSSSTSSSLSGSTNLRDRNNPTNWVDTIEFDPIGIGGLMQLPKQEKSHLFDYNQRLKTVLRNRQPTLFTFTSPLYPDNYPPNTDCIKVIKAPQKDQQIILDFRGPFQFEPSADCINDYLEVRDGEYGFSPLIGRFCSDNRQLHSIKSTGQWLRLRFHSDFSIEKAGFQAVYYFSKLRNIDEPLPQKPIVTTTIIIDNEMIFETKDLIKLWNDYTETLIKTKSHPVDRLIEVIIDFRTNQSDLMLMIHLKFVKFQFIDPECKNNLIEIYDEFFLSNRDTILPIPSVLLKRSKVQIPINEQFTPRVLKACNQPYLEPFIHKLGRSIVRILISPEIRTTESIEYGHMNISKPITKLPEIKIIITALKKAFCENDWVPCVRPTDYVAYKEYFNLTVRSKSRDKQINSDHNNNDNDKQNNKFSKLQTTTPLTMTTIKSNEMITNPIVLKHHSTLPKIIYCLSPNLICNNRINCPNGEDEEMCPRPPGGLEAFDIPVHKHDSIDDLNIQTTEQTSTTRKIDSLSSTSEDDDEFRHHTPIIAGLLGFCAICGLISAGMTLVNRSKKQKHPNFGSVCNSILFESGTSLITALESSGSLSNFKTLQINDFKCENLNFVDNLNQKTQCNEVPFNVSSVTTIGTFVSKTTLTTTTTNVTGTLKKEDNKPSETSCKCTYFSCTNLCSNNTSTIPTLNKQTTLTIDDNDDDNGVDDVEDQEQTSDIDNVIKYDLKSTTTGLAEIFDRATKPLGYIHKLDSSPAWNQSINYHSNTIHQLREVQKKKPTYNSFNLYEYPTNRSLGQLPNTLVIPVAKLSKGSHSPTVKQQTTPKPYYKSEVSRSDPFSLKEQSKFHETNDGRSHWDEHLKFDNLRRSFSVRPIKTNNSAFTPYISCTSLKQKILPNELLELNLNDKNNLKTYYQPRYSLEQQLNSDINIFSILNTEHQQQQQHQSQQWKREQKRKHFKGIAPKRAKHENNFMFQEQSQLRNIPLHQRIGIPQKDLSQYTQEPHSTPRELFTLNKLSQFTNGELLDMENENYPHHYKLSKKEIKHILPSLTNMTMMKPTTTTVSVTPVTSTTNNIMSNVRYHHTKLYHPHVVVPPSTALPSSSSPSNWIIIPNQKQRDNQKQNCHHGGDESSSCISQNDNESETTSDGNDLRQQNSKFKYKILPRGIDQSMDPMKTIRKSAKRMKYYESDSANIDQDSISRELLNNNVARKNSSPTTHSLITSTTNINNNICKPIFENLHLFESSSDIFQCNCKLSSNSKYHFPSSYSVIDGTLSDVKTRDGNAGGSIVRKNASWNDMSYKNEYLCYHDDDDVEEDDEEDDDELDEQTNGNTEQSSEVDDSSVERVEDPNGFINLQDNQLPDATLSPDSSTSEESQCQLNMSSHTTPMRRSHETAVVIITSKGRTVQSTKTT
					

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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	35.4	Very low	36.4	Very low	235 Å²	235	148.9 Å²	148.9	100%	1.158	79%	0.785	S	S	*	*				0	132.9	0	-74.8	-164.3	-131.5	0	0	108.2
2	V	42	Very low	36.8	Very low	129 Å²	129	151.1 Å²	151.1	78%	0.782	78%	0.784	S	S	*	*			cis	-126.4	87.7	-6.5	-173.2	0	0	0	0	109
3	Q	27.5	Very low	37.4	Very low	179 Å²	179	147.4 Å²	147.4	84%	0.836	76%	0.764	S	S	*	*			trans	-73.5	167.5	154.6	-70	161	-61.4	0	0	108.7
4	S	29.7	Very low	37.9	Very low	103 Å²	103	144.2 Å²	144.2	72%	0.72	76%	0.755	S	S	*	*			trans	66	95.6	-171.7	-58.6	0	0	0	0	114.2
5	Y	36.8	Very low	38.3	Very low	217 Å²	217	142.8 Å²	142.8	85%	0.851	75%	0.748	S	S	*	*	S	Bend	trans	-165.2	-25.4	132.4	-117.2	-76	0	0	0	113	S7	Y5-S7 VanDerWaalsContact C-N 3.3Å; Y5-S7 PolarHBondContact O-N 2.67Å
6	N	32.2	Very low	38.7	Very low	146 Å²	146	144.8 Å²	144.8	78%	0.781	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	27.3	178.7	-81.7	-19.3	0	0	0	115.6
7	S	36.1	Very low	39.1	Very low	104 Å²	104	147.1 Å²	147.1	73%	0.727	74%	0.74	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.9	5.5	-179.3	-163.4	0	0	0	0	114.8	Y5	Y5-S7 VanDerWaalsContact C-N 3.3Å; Y5-S7 PolarHBondContact O-N 2.67Å
8	L	38.4	Very low	39.5	Very low	166 Å²	166	145.1 Å²	145.1	87%	0.869	73%	0.732	S	S	*	*	S	Bend	trans	-110.7	-2.2	178.3	-94.5	156.6	0	0	0	114
9	T	44.6	Very low	40.4	Very low	80 Å²	80	142.8 Å²	142.8	49%	0.491	72%	0.721	S	S	.	*	S	Bend	trans	-90.2	-13.7	178.2	41.4	0	0	0	0	114	M11	T9-M11 PolarHBondContact O-N 2.76Å
10	N	36.9	Very low	41.5	Very low	117 Å²	117	140.2 Å²	140.2	63%	0.626	71%	0.708	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	1.2	-171	-85.5	-29.6	0	0	0	116.3
11	M	40.8	Very low	41.7	Very low	162 Å²	162	137.7 Å²	137.7	80%	0.798	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103	-7.7	177.8	-152.8	168.8	75	0	0	114.6	T9	T9-M11 PolarHBondContact O-N 2.76Å
12	F	41.6	Very low	42.6	Very low	175 Å²	175	135.9 Å²	135.9	77%	0.768	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.9	-13.2	175.4	-94.7	-93.1	0	0	0	114.2
13	I	44	Very low	42.8	Very low	103 Å²	103	137.9 Å²	137.9	53%	0.528	67%	0.671	S	S	.	*	H	α-helix	trans	-83.2	-22.3	-176.1	-67.9	174.9	0	0	0	112.5	N15	I13-N15 PolarHBondContact O-N 3.24Å
14	T	45.4	Very low	44.1	Very low	103 Å²	103	133.6 Å²	133.6	63%	0.632	65%	0.654	S	S	*	*	H	α-helix	trans	-72.2	-20.6	179.4	37.3	0	0	0	0	114.6
15	N	43.8	Very low	44.7	Very low	123 Å²	123	137.3 Å²	137.3	66%	0.658	65%	0.652	S	S	*	*	H	α-helix	trans	-95.4	-25.1	179.5	-140.9	-1.8	0	0	0	113.4	I13	I13-N15 PolarHBondContact O-N 3.24Å
16	W	44.7	Very low	45.2	Very low	175 Å²	175	132.4 Å²	132.4	66%	0.663	64%	0.639	S	S	*	*	H	α-helix	trans	-76.4	-26.1	174.9	-99.2	67.7	0	0	0	113.8	N18 I19 I20	W16-N18 PolarHBondContact O-N 3.45Å; W16-I19 PolarHBondContact O-N 2.79Å; W16-I20 HydrophobicContact CE3-CD1 4.18Å; W16-I20 PolarHBondContact O-N 3.32Å
17	R	44.1	Very low	45.8	Very low	183 Å²	183	130.2 Å²	130.2	69%	0.691	63%	0.631	S	S	*	*	H	α-helix	trans	-64.9	-19.8	-180	-151.6	168.7	-173.5	171.6	0.6	113.6
18	N	47.7	Very low	46.1	Very low	112 Å²	112	128.2 Å²	128.2	60%	0.599	62%	0.621	S	S	*	*	H	α-helix	trans	-85.7	-11.9	174.5	-75.4	-23.1	0	0	0	114.5	W16	W16-N18 PolarHBondContact O-N 3.45Å
19	I	56.5	Low	46.3	Very low	101 Å²	101	125.8 Å²	125.8	52%	0.518	61%	0.608	S	S	.	*	H	α-helix	trans	-93	-45.2	176.7	-65.5	177.1	0	0	0	110.2	W16 N21 R22 Y23	W16-I19 PolarHBondContact O-N 2.79Å; I19-N21 PolarHBondContact O-N 3.17Å; I19-R22 PolarHBondContact O-N 3.4Å; I19-R22 VanDerWaalsContact O-N 3.16Å; I19-Y23 PolarHBondContact O-N 3.22Å
20	I	61.6	Low	46	Very low	90 Å²	90	128.3 Å²	128.3	46%	0.462	62%	0.618	S	S	.	*	H	α-helix	trans	-66.2	-40.5	179.5	-66.7	175.9	0	0	0	111.7	W16 R22 Y23 I24	W16-I20 HydrophobicContact CE3-CD1 4.18Å; W16-I20 PolarHBondContact O-N 3.32Å; I20-R22 PolarHBondContact O-N 3.47Å; I20-Y23 PolarHBondContact O-N 3.21Å; I20-I24 HydrophobicContact CG2-CD1 3.81Å; I20-I24 HydrophobicContact CG2-CG1 4.36Å; I20-I24 PolarHBondContact O-N 3.44Å
21	N	46	Very low	46.1	Very low	88 Å²	88	129.1 Å²	129.1	47%	0.471	63%	0.627	S	S	.	*	H	α-helix	trans	-67.5	-18.2	175.7	-83.7	-2.7	0	0	0	113.9	I19 W25	I19-N21 PolarHBondContact O-N 3.17Å; N21-W25 PolarHBondContact O-N 3.34Å
22	R	53.3	Low	45.8	Very low	197 Å²	197	128.9 Å²	128.9	74%	0.743	63%	0.627	S	S	*	*	H	α-helix	trans	-81.9	-19.3	170.3	-83.7	-172.5	168.7	-165.4	-3.1	113.8	I19 I20 I26	I19-R22 PolarHBondContact O-N 3.4Å; I19-R22 VanDerWaalsContact O-N 3.16Å; I20-R22 PolarHBondContact O-N 3.47Å; R22-I26 WeakPolarHBondContact O-CD1 3.36Å; R22-I26 WeakPolarHBondContact O-CG1 3.28Å
23	Y	47.3	Very low	45.4	Very low	171 Å²	171	128.1 Å²	128.1	67%	0.671	63%	0.626	S	S	*	*	H	α-helix	trans	-85.7	-38.7	169.5	-101.3	-90.3	0	0	0	112.5	I19 I20 W25 I26 T27	I19-Y23 PolarHBondContact O-N 3.22Å; I20-Y23 PolarHBondContact O-N 3.21Å; Y23-W25 VanDerWaalsContact C-N 3.33Å; Y23-W25 PolarHBondContact O-N 3.37Å; Y23-I26 PolarHBondContact O-N 3.04Å; Y23-I26 VanDerWaalsContact O-N 3.1Å; Y23-T27 PolarHBondContact O-N 3.5Å; Y23-T27 PolarHBondContact O-OG1 3.33Å
24	I	54	Low	45.2	Very low	90 Å²	90	128.9 Å²	128.9	46%	0.462	64%	0.635	S	S	.	*	H	α-helix	trans	-65.1	-35.7	177.6	-66.4	174.3	0	0	0	111.6	I20 I26 T27 A28	I20-I24 HydrophobicContact CG2-CD1 3.81Å; I20-I24 HydrophobicContact CG2-CG1 4.36Å; I20-I24 PolarHBondContact O-N 3.44Å; I24-I26 VanDerWaalsContact C-N 3.28Å; I24-I26 PolarHBondContact O-N 3.05Å; I24-T27 PolarHBondContact O-N 3.25Å; I24-A28 VanDerWaalsContact O-CB 3.23Å; I24-A28 WeakPolarHBondContact O-CB 3.4Å; I24-A28 PolarHBondContact O-N 3.01Å
25	W	43.4	Very low	44.3	Very low	181 Å²	181	131.8 Å²	131.8	69%	0.686	64%	0.641	S	S	*	*	H	α-helix	trans	-75.4	-8.2	174	-92.2	68.7	0	0	0	115.2	N21 Y23 L29	N21-W25 PolarHBondContact O-N 3.34Å; Y23-W25 VanDerWaalsContact C-N 3.33Å; Y23-W25 PolarHBondContact O-N 3.37Å; W25-L29 HydrophobicContact CE3-CD1 3.63Å; W25-L29 HydrophobicContact CZ3-CD1 3.85Å
26	I	47.7	Very low	43.5	Very low	113 Å²	113	129.8 Å²	129.8	58%	0.579	64%	0.636	S	S	*	*	H	α-helix	trans	-95.3	-20.9	174.4	-71.2	176.9	0	0	0	111.7	R22 Y23 I24	R22-I26 WeakPolarHBondContact O-CD1 3.36Å; R22-I26 WeakPolarHBondContact O-CG1 3.28Å; Y23-I26 PolarHBondContact O-N 3.04Å; Y23-I26 VanDerWaalsContact O-N 3.1Å; I24-I26 VanDerWaalsContact C-N 3.28Å; I24-I26 PolarHBondContact O-N 3.05Å
27	T	43.9	Very low	42.7	Very low	100 Å²	100	129.8 Å²	129.8	61%	0.613	64%	0.644	S	S	*	*	H	α-helix	trans	-104	-20.3	174.7	53.1	0	0	0	0	114.6	Y23 I24	Y23-T27 PolarHBondContact O-N 3.5Å; Y23-T27 PolarHBondContact O-OG1 3.33Å; I24-T27 PolarHBondContact O-N 3.25Å
28	A	41.7	Very low	42.2	Very low	63 Å²	63	126.8 Å²	126.8	52%	0.521	65%	0.646	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79	-22.9	173.1	0	0	0	0	0	113.8	I24	I24-A28 VanDerWaalsContact O-CB 3.23Å; I24-A28 WeakPolarHBondContact O-CB 3.4Å; I24-A28 PolarHBondContact O-N 3.01Å
29	L	42.8	Very low	41.3	Very low	114 Å²	114	126.1 Å²	126.1	60%	0.597	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.8	5.5	177.8	-89.3	168.5	0	0	0	114.2	W25	W25-L29 HydrophobicContact CE3-CD1 3.63Å; W25-L29 HydrophobicContact CZ3-CD1 3.85Å
30	L	38.5	Very low	39.9	Very low	134 Å²	134	128.3 Å²	128.3	70%	0.702	65%	0.654	S	S	*	*	S	Bend	trans	-127	104.8	167.4	-75.4	169.4	0	0	0	108.2
31	V	38.4	Very low	38.2	Very low	134 Å²	134	132.3 Å²	132.3	81%	0.812	67%	0.669	S	S	*	*	S	Bend	trans	98.1	23.4	174.4	-166.7	0	0	0	0	117.8
32	I	34.6	Very low	37.4	Very low	156 Å²	156	136.4 Å²	136.4	80%	0.8	68%	0.682	S	S	*	*	S	Bend	trans	-129.2	47	138.8	-43.9	-178.2	0	0	0	111.1
33	H	33.9	Very low	36.4	Very low	160 Å²	160	132.2 Å²	132.2	74%	0.741	68%	0.683	S	S	*	*	S	Bend	trans	-161.3	129.9	158.7	-114.2	-92.2	0	0	0	103.9
34	V	39.1	Very low	35.5	Very low	119 Å²	119	131.8 Å²	131.8	72%	0.721	69%	0.692	S	S	*	*			cis	-124.9	133.3	3.2	167.8	0	0	0	0	109.7
35	Q	27.9	Very low	34.4	Very low	163 Å²	163	135.7 Å²	135.7	76%	0.762	71%	0.706	S	S	*	*			trans	-116.6	104.4	155.7	-175.6	83.5	67.2	0	0	106.9
36	C	26.7	Very low	33.7	Very low	82 Å²	82	134.4 Å²	134.4	55%	0.554	71%	0.712	S	S	*	*			trans	35	112.4	161.2	-50.8	0	0	0	0	119
37	E	28	Very low	32.8	Very low	175 Å²	175	136 Å²	136	82%	0.818	72%	0.72	S	S	*	*				-170.9	156.5	94.7	-97.8	162.7	-164.4	0	0	110.8
38	T	33.8	Very low	32	Very low	120 Å²	120	139 Å²	139	74%	0.736	73%	0.731	S	S	*	*	S	Bend	trans	60.9	131.9	-172.3	68.4	0	0	0	0	116.6
39	D	28.1	Very low	31.2	Very low	98 Å²	98	139.3 Å²	139.3	52%	0.524	74%	0.74	S	S	.	*	S	Bend	cis	-143.1	165.5	-25.8	-86.4	-50.3	0	0	0	109.4	I1381	D39-I1381 HydrophobicContact CB-CD1 3.87Å; D39-I1381 HydrophobicContact CB-CG1 4.09Å; D39-I1381 VanDerWaalsContact OD2-CD1 3.32Å; D39-I1381 WeakPolarHBondContact OD2-CD1 3.31Å
40	L	26.1	Very low	30.6	Very low	146 Å²	146	139.3 Å²	139.3	76%	0.764	75%	0.749	S	S	*	*			trans	70.8	155.6	-168.9	-69	78.7	0	0	0	115.3
41	F	28	Very low	29.9	Very low	174 Å²	174	140.8 Å²	140.8	76%	0.763	76%	0.757	S	S	*	*	S	Bend	trans	72.8	101.4	174.6	-97.3	-100	0	0	0	119.9
42	K	28.4	Very low	29.4	Very low	175 Å²	175	142 Å²	142	76%	0.761	76%	0.758	S	S	*	*			trans	58.1	100.4	136.4	-63.5	-168.9	-179.9	-174.1	0	119.4
43	S	31.9	Very low	29.2	Very low	108 Å²	108	143.7 Å²	143.7	76%	0.755	76%	0.762	S	S	*	*			trans	-36.6	130.7	155.3	-33.9	0	0	0	0	115.2
44	N	29.7	Very low	28.7	Very low	162 Å²	162	143.9 Å²	143.9	87%	0.866	77%	0.765	S	S	*	*				-176.8	143.3	101.2	-88.5	-8.5	0	0	0	110.9
45	K	30.5	Very low	28.2	Very low	172 Å²	172	144.5 Å²	144.5	75%	0.748	76%	0.764	S	S	*	*			trans	-149.6	106.2	-176.5	-166.4	179.8	-172.9	-179.7	0	111.6
46	L	28.3	Very low	28.1	Very low	155 Å²	155	147.6 Å²	147.6	81%	0.812	77%	0.771	S	S	*	*			trans	63	163.1	171.5	-98.6	63.7	0	0	0	114.7
47	I	29.5	Very low	28.1	Very low	147 Å²	147	155 Å²	155	75%	0.754	79%	0.787	S	S	*	*			cis	-132.2	135.9	20	-67	173	0	0	0	112
48	I	25.9	Very low	28.1	Very low	162 Å²	162	151.9 Å²	151.9	83%	0.831	78%	0.784	S	S	*	*			trans	13.5	120	145.3	-49.3	171.1	0	0	0	118.6
49	G	25	Very low	27.9	Very low	70 Å²	70	154.4 Å²	154.4	72%	0.722	79%	0.792	S	S	*	*			trans	139.4	115.5	169.8	0	0	0	0	0	110.1
50	S	29.9	Very low	28	Very low	113 Å²	113	160.2 Å²	160.2	79%	0.79	81%	0.809	S	S	*	*			cis	-139	153	17.7	-58.9	0	0	0	0	113
51	L	25.1	Very low	28.2	Very low	165 Å²	165	163.6 Å²	163.6	86%	0.864	81%	0.811	S	S	*	*			trans	-97.9	161.1	144.7	-99.8	75.8	0	0	0	107.8
52	I	27.3	Very low	28.6	Very low	161 Å²	161	159.4 Å²	159.4	83%	0.826	80%	0.796	S	S	*	*			trans	77.1	98.7	-163.8	-48.1	158.4	0	0	0	108.6
53	E	29.6	Very low	29.2	Very low	190 Å²	190	155.4 Å²	155.4	89%	0.888	79%	0.788	S	S	*	*				-131.9	144.4	57.4	-72.5	175.5	140.9	0	0	114.4
54	M	25.2	Very low	30	Very low	164 Å²	164	155.8 Å²	155.8	81%	0.808	78%	0.782	S	S	*	*			trans	-108.9	166.2	160.7	-91.2	-179.4	54.3	0	0	109.3
55	D	27.2	Very low	31.1	Very low	132 Å²	132	152.8 Å²	152.8	71%	0.706	76%	0.763	S	S	*	*			trans	93.1	160.5	165.9	-55.2	-29	0	0	0	118.6
56	Y	25.5	Very low	32.4	Very low	229 Å²	229	147.6 Å²	147.6	90%	0.898	75%	0.748	S	S	*	*	S	Bend	trans	73.1	10.9	175.3	-85.9	-83	0	0	0	122.6
57	W	28.3	Very low	34.3	Very low	238 Å²	238	144.4 Å²	144.4	90%	0.902	74%	0.735	S	S	*	*	S	Bend	trans	-133	1	162.9	-93.6	91	0	0	0	117.1
58	S	27.3	Very low	36.6	Very low	108 Å²	108	138.4 Å²	138.4	76%	0.755	71%	0.705	S	S	*	*	S	Bend	trans	-95.5	3.4	-170.4	-69.9	0	0	0	0	117
59	L	28.9	Very low	39.5	Very low	173 Å²	173	131.3 Å²	131.3	91%	0.906	67%	0.67	S	S	*	*	S	Bend	trans	-98.3	-5.4	-175.2	-79	169.5	0	0	0	115.8
60	Y	30.8	Very low	41.6	Very low	220 Å²	220	131.5 Å²	131.5	86%	0.863	65%	0.654	S	S	*	*			trans	-103.6	40.9	172.4	-79	-82.3	0	0	0	112.7	L62	Y60-L62 PolarHBondContact O-N 3.16Å
61	R	30.2	Very low	43.1	Very low	218 Å²	218	129.8 Å²	129.8	82%	0.823	63%	0.634	S	S	*	*			trans	-73.9	94.3	171.5	-177.4	172.1	-74.5	174.4	-1.7	109.8
62	L	37.1	Very low	44.8	Very low	85 Å²	85	122 Å²	122	45%	0.445	59%	0.593	S	S	.	*			trans	-45.4	147.1	166.5	-74	163	0	0	0	111.2	Y60 N64 N199	Y60-L62 PolarHBondContact O-N 3.16Å; L62-N64 PolarHBondContact O-N 2.95Å; L62-N199 HydrophobicContact CD1-CB 3.7Å
63	P	39.9	Very low	46.1	Very low	92 Å²	92	115.9 Å²	115.9	60%	0.597	56%	0.562	S	S	*	*	S	Bend	trans	-57.9	133.8	175.8	26.5	-34.4	0	0	0	109.5	Q65	P63-Q65 PolarHBondContact O-N 3.42Å; P63-Q65 VanDerWaalsContact O-N 3.09Å
64	N	48.6	Very low	46.6	Very low	115 Å²	115	110.2 Å²	110.2	62%	0.615	54%	0.538	S	S	*	.			trans	-40.8	117.6	-171.2	-63.7	-36	0	0	0	111.7	L62 S66 T67	L62-N64 PolarHBondContact O-N 2.95Å; N64-S66 PolarHBondContact O-N 3.1Å; N64-T67 PolarHBondContact O-N 2.86Å; N64-T67 PolarHBondContact O-OG1 3.11Å
65	Q	53.1	Low	47.5	Very low	100 Å²	100	104.1 Å²	104.1	47%	0.467	51%	0.511	S	S	.	.	H	α-helix	trans	-53.8	-33.8	-173.3	-75.8	173.6	-37.1	0	0	112.8	P63 T67 V68 C69 N199	P63-Q65 PolarHBondContact O-N 3.42Å; P63-Q65 VanDerWaalsContact O-N 3.09Å; Q65-T67 VanDerWaalsContact C-N 3.31Å; Q65-T67 PolarHBondContact O-N 3.29Å; Q65-V68 WeakPolarHBondContact O-CB 3.32Å; Q65-V68 PolarHBondContact O-N 3.43Å; Q65-C69 PolarHBondContact O-N 3.47Å; Q65-C69 PolarHBondContact O-SG 3.39Å; Q65-C69 VanDerWaalsContact O-SG 3.39Å; Q65-N199 PolarHBondContact NE2-O 3.28Å
66	S	58.7	Low	47.9	Very low	63 Å²	63	105.3 Å²	105.3	44%	0.441	51%	0.507	S	S	.	.	H	α-helix	trans	-50.8	-44.2	171.2	166.9	0	0	0	0	113.5	N64 V68 C69 N70	N64-S66 PolarHBondContact O-N 3.1Å; S66-V68 PolarHBondContact O-N 3.36Å; S66-C69 PolarHBondContact O-N 3.11Å; S66-N70 VanDerWaalsContact O-CG 3.24Å; S66-N70 PolarHBondContact O-N 2.92Å; S66-N70 PolarHBondContact O-ND2 3.35Å; S66-N70 PolarHBondContact O-OD1 3.26Å
67	T	68.1	Low	48.4	Very low	87 Å²	87	100.2 Å²	100.2	53%	0.534	49%	0.487	S	S	.	.	H	α-helix	trans	-69.6	-30.1	178	20.5	0	0	0	0	113.6	N64 Q65	N64-T67 PolarHBondContact O-N 2.86Å; N64-T67 PolarHBondContact O-OG1 3.11Å; Q65-T67 VanDerWaalsContact C-N 3.31Å; Q65-T67 PolarHBondContact O-N 3.29Å
68	V	77.7	Confident	48.5	Very low	22 Å²	22	94.1 Å²	94.1	13%	0.133	47%	0.471	C	S	.	.	H	α-helix	trans	-70.8	-46.6	174.2	176.9	0	0	0	0	110.1	Q65 S66 N70 Q71 P190 P197 T200	Q65-V68 WeakPolarHBondContact O-CB 3.32Å; Q65-V68 PolarHBondContact O-N 3.43Å; S66-V68 PolarHBondContact O-N 3.36Å; V68-N70 PolarHBondContact O-N 2.79Å; V68-Q71 PolarHBondContact O-N 3.14Å; V68-P190 HydrophobicContact CG1-CB 3.67Å; V68-P190 HydrophobicContact CG1-CG 3.92Å; V68-P197 HydrophobicContact CG1-CG 3.79Å; V68-T200 HydrophobicContact CG1-CG2 3.88Å
69	C	86.3	Confident	48.6	Very low	13 Å²	13	94 Å²	94	9%	0.088	46%	0.462	C	S	.	.	H	α-helix	trans	-70.3	-11.1	-179.1	-60.6	0	0	0	0	114.6	Q65 S66 Q71 F72 I73 C202	Q65-C69 PolarHBondContact O-N 3.47Å; Q65-C69 PolarHBondContact O-SG 3.39Å; Q65-C69 VanDerWaalsContact O-SG 3.39Å; S66-C69 PolarHBondContact O-N 3.11Å; C69-Q71 PolarHBondContact O-N 2.86Å; C69-F72 WeakPolarHBondContact O-CA 3.23Å; C69-F72 WeakPolarHBondContact O-CB 3.34Å; C69-F72 PolarHBondContact O-N 2.77Å; C69-I73 WeakPolarHBondContact O-CG1 3.34Å; C69-I73 PolarHBondContact O-N 3.07Å; C69-C202 WeakPolarHBondContact CA-SG 3.38Å; C69-C202 HydrophobicContact CB-CB 3.77Å; C69-C202 WeakPolarHBondContact CB-SG 2.81Å; C69-C202 WeakPolarHBondContact SG-CA 3.12Å; C69-C202 WeakPolarHBondContact SG-CB 3.44Å; C69-C202 CovalentContact SG-SG 2.04Å; C69-C202 PolarHBondContact SG-SG 3.29Å
70	N	69.9	Low	48.5	Very low	74 Å²	74	91.6 Å²	91.6	40%	0.396	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.6	-27.5	173.8	-74.6	-24.2	0	0	0	113.2	S66 V68 I73	S66-N70 VanDerWaalsContact O-CG 3.24Å; S66-N70 PolarHBondContact O-N 2.92Å; S66-N70 PolarHBondContact O-ND2 3.35Å; S66-N70 PolarHBondContact O-OD1 3.26Å; V68-N70 PolarHBondContact O-N 2.79Å; N70-I73 WeakPolarHBondContact O-CB 3.28Å; N70-I73 PolarHBondContact O-N 3.23Å
71	Q	60.4	Low	48.4	Very low	77 Å²	77	87.4 Å²	87.4	36%	0.36	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-72.8	-31.1	172	-74.9	174.1	-30.6	0	0	112.3	V68 C69 I73 N74	V68-Q71 PolarHBondContact O-N 3.14Å; C69-Q71 PolarHBondContact O-N 2.86Å; Q71-I73 PolarHBondContact O-N 3.48Å; Q71-I73 VanDerWaalsContact O-N 3.12Å; Q71-N74 PolarHBondContact O-N 2.91Å
72	F	60.2	Low	48.2	Very low	1 Å²	1	87.3 Å²	87.3	0%	0.004	45%	0.447	C	S	.	.	G	3₁₀ helix	trans	-65.2	-8.7	170.6	-156.1	-111.1	0	0	0	113.5	C69 T188 C202 K204 L236 F273 F284	C69-F72 WeakPolarHBondContact O-CA 3.23Å; C69-F72 WeakPolarHBondContact O-CB 3.34Å; C69-F72 PolarHBondContact O-N 2.77Å; F72-T188 WeakPolarHBondContact CA-O 3.45Å; F72-T188 WeakPolarHBondContact CD2-O 3.35Å; F72-C202 HydrophobicContact CB-CB 4.04Å; F72-C202 HydrophobicContact CD1-CB 3.61Å; F72-C202 HydrophobicContact CD2-CB 4.25Å; F72-C202 HydrophobicContact CE1-CB 4.06Å; F72-C202 WeakPolarHBondContact CE1-O 3.41Å; F72-C202 HydrophobicContact CG-CB 3.73Å; F72-K204 HydrophobicContact CD1-CB 3.92Å; F72-K204 HydrophobicContact CE1-CB 3.67Å; F72-L236 HydrophobicContact CZ-CD1 4.27Å; F72-F273 HydrophobicContact CD2-CB 4.18Å; F72-F273 HydrophobicContact CE1-CB 4.3Å; F72-F273 HydrophobicContact CE2-CB 3.31Å; F72-F273 HydrophobicContact CE2-CG 4.03Å; F72-F273 HydrophobicContact CZ-CB 3.39Å; F72-F284 AromaticContact CE2-CE1 3.98Å; F72-F284 HydrophobicContact CE2-CE1 3.98Å; F72-F284 AromaticContact CE2-CZ 3.65Å; F72-F284 HydrophobicContact CE2-CZ 3.65Å; F72-F284 HydrophobicContact CZ-CZ 4.24Å
73	I	54.5	Low	47.6	Very low	32 Å²	32	91 Å²	91	16%	0.164	46%	0.462	C	S	.	.	G	3₁₀ helix	trans	-105.9	-17.9	-174.2	-72.8	168.7	0	0	0	112.8	C69 N70 Q71 S75 D143 I145 K204	C69-I73 WeakPolarHBondContact O-CG1 3.34Å; C69-I73 PolarHBondContact O-N 3.07Å; N70-I73 WeakPolarHBondContact O-CB 3.28Å; N70-I73 PolarHBondContact O-N 3.23Å; Q71-I73 PolarHBondContact O-N 3.48Å; Q71-I73 VanDerWaalsContact O-N 3.12Å; I73-S75 PolarHBondContact O-N 3.34Å; I73-D143 HydrophobicContact CD1-CB 3.78Å; I73-D143 VanDerWaalsContact CD1-OD2 3.31Å; I73-D143 WeakPolarHBondContact CD1-OD2 3.29Å; I73-D143 HydrophobicContact CG1-CB 4.37Å; I73-I145 HydrophobicContact CG2-CD1 4.38Å; I73-K204 HydrophobicContact CG1-CD 4.32Å
74	N	41.6	Very low	47	Very low	72 Å²	72	94 Å²	94	39%	0.385	47%	0.473	S	S	.	.			trans	-70.7	83.5	-174	-79.1	-23.6	0	0	0	113.3	Q71 Y76	Q71-N74 PolarHBondContact O-N 2.91Å; N74-Y76 HydrophobicContact CB-CD2 4.17Å; N74-Y76 HydrophobicContact CB-CE2 3.79Å; N74-Y76 PolarHBondContact O-N 3.48Å
75	S	43.1	Very low	45.8	Very low	35 Å²	35	92.5 Å²	92.5	25%	0.245	49%	0.486	C	S	.	.			trans	-72.1	85.1	170.6	58.8	0	0	0	0	111.3	I73 Y77 T186	I73-S75 PolarHBondContact O-N 3.34Å; S75-Y77 PolarHBondContact O-N 3.41Å; S75-T186 CarbonylContact C-O 3.52Å; S75-T186 VanDerWaalsContact CA-O 3.27Å; S75-T186 WeakPolarHBondContact CA-O 3.38Å
76	Y	36.6	Very low	44.6	Very low	158 Å²	158	95.6 Å²	95.6	62%	0.62	49%	0.493	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.5	127.5	173.2	-75	-78.7	0	0	0	110.5	N74 T186	N74-Y76 HydrophobicContact CB-CD2 4.17Å; N74-Y76 HydrophobicContact CB-CE2 3.79Å; N74-Y76 PolarHBondContact O-N 3.48Å; Y76-T186 PolarHBondContact N-O 2.94Å; Y76-T186 PolarHBondContact O-N 2.89Å
77	Y	34.8	Very low	43	Very low	122 Å²	122	96.9 Å²	96.9	48%	0.478	50%	0.502	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	111.9	177.2	-152.1	-92.1	0	0	0	108.4	S75 D79 T183 F185	S75-Y77 PolarHBondContact O-N 3.41Å; Y77-D79 HydrophobicContact CD1-CB 4.47Å; Y77-D79 WeakPolarHBondContact CD1-OD2 3.5Å; Y77-D79 WeakPolarHBondContact CE1-OD2 3.39Å; Y77-D79 PolarHBondContact O-N 3.07Å; Y77-T183 HydrophobicContact CE1-CG2 4.47Å; Y77-T183 VanDerWaalsContact OH-CG2 3.25Å; Y77-T183 WeakPolarHBondContact OH-CG2 3.39Å; Y77-F185 HydrophobicContact CD2-CD1 4.14Å; Y77-F185 AromaticContact CD2-CE1 3.66Å; Y77-F185 HydrophobicContact CD2-CE1 3.66Å; Y77-F185 HydrophobicContact CD2-CZ 4.33Å; Y77-F185 AromaticContact CE2-CE1 3.73Å; Y77-F185 HydrophobicContact CE2-CE1 3.73Å; Y77-F185 AromaticContact CE2-CZ 3.97Å; Y77-F185 HydrophobicContact CE2-CZ 3.97Å
78	L	31.4	Very low	41.1	Very low	109 Å²	109	97.1 Å²	97.1	57%	0.571	50%	0.503	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.8	85	171.1	-79.1	170.6	0	0	0	109.2	L184 T186	L78-L184 PolarHBondContact N-O 2.81Å; L78-T186 WeakPolarHBondContact CD1-OG1 3.35Å
79	D	29.1	Very low	38.8	Very low	106 Å²	106	101.4 Å²	101.4	57%	0.567	53%	0.531	S	S	*	.			trans	-75.3	143.1	151.7	-83	-42.1	0	0	0	108.6	Y77 L81	Y77-D79 HydrophobicContact CD1-CB 4.47Å; Y77-D79 WeakPolarHBondContact CD1-OD2 3.5Å; Y77-D79 WeakPolarHBondContact CE1-OD2 3.39Å; Y77-D79 PolarHBondContact O-N 3.07Å; D79-L81 VanDerWaalsContact C-N 3.28Å; D79-L81 PolarHBondContact O-N 3.2Å
80	D	26.2	Very low	35.9	Very low	122 Å²	122	108.7 Å²	108.7	65%	0.652	57%	0.568	S	S	*	*			trans	-70.4	78.5	178.3	-75.9	-57.8	0	0	0	111.8	Q181	D80-Q181 PolarHBondContact OD2-NE2 2.57Å
81	L	28.7	Very low	33.8	Very low	132 Å²	132	110.5 Å²	110.5	69%	0.691	59%	0.587	S	S	*	*			trans	-121.7	70.4	173	-73.3	177.4	0	0	0	112	D79 E83	D79-L81 VanDerWaalsContact C-N 3.28Å; D79-L81 PolarHBondContact O-N 3.2Å; L81-E83 VanDerWaalsContact C-N 3.35Å; L81-E83 HydrophobicContact CD2-CB 4.36Å; L81-E83 HydrophobicContact CD2-CG 4.43Å
82	K	25.8	Very low	32.3	Very low	217 Å²	217	116.1 Å²	116.1	94%	0.943	61%	0.61	S	S	*	*			trans	-102.6	46.3	143.6	-82.8	-169.8	173.6	-178.9	0	110.5
83	E	26	Very low	30.7	Very low	161 Å²	161	121.3 Å²	121.3	75%	0.752	65%	0.647	S	S	*	*			trans	-79.1	163.2	158.5	-73.6	-161.3	147.9	0	0	110.7	L81	L81-E83 VanDerWaalsContact C-N 3.35Å; L81-E83 HydrophobicContact CD2-CB 4.36Å; L81-E83 HydrophobicContact CD2-CG 4.43Å
84	D	26.2	Very low	29.4	Very low	155 Å²	155	125.1 Å²	125.1	83%	0.829	68%	0.676	S	S	*	*			trans	-61.8	153.4	-156.9	-67.6	-65.8	0	0	0	116.8	R86	D84-R86 VanDerWaalsContact C-N 3.3Å; D84-R86 PolarHBondContact O-N 3.37Å
85	G	24.5	Very low	28.6	Very low	85 Å²	85	129.9 Å²	129.9	88%	0.876	70%	0.701	S	S	*	*			trans	-67.7	78.3	174.8	0	0	0	0	0	113.5
86	R	26.4	Very low	27.8	Very low	164 Å²	164	133.9 Å²	133.9	62%	0.619	73%	0.729	S	S	*	*			trans	-131.1	86.1	169.4	-96.8	-169	150.5	-179.9	-2.5	112.2	D84 F1122 T1123	D84-R86 VanDerWaalsContact C-N 3.3Å; D84-R86 PolarHBondContact O-N 3.37Å; R86-F1122 VanDerWaalsContact CZ-O 3.27Å; R86-F1122 PolarHBondContact NE-O 3.37Å; R86-F1122 PolarHBondContact NH2-O 3.23Å; R86-T1123 WeakPolarHBondContact CA-OG1 3.45Å; R86-T1123 HydrophobicContact CB-CG2 3.67Å; R86-T1123 HydrophobicContact CG-CG2 3.84Å; R86-T1123 WeakPolarHBondContact CG-OG1 3.31Å
87	S	25.7	Very low	27.5	Very low	91 Å²	91	130.8 Å²	130.8	64%	0.636	73%	0.73	S	S	*	*			trans	-69.8	136	177.4	49.6	0	0	0	0	113.9	T1123	S87-T1123 PolarHBondContact N-OG1 3.12Å; S87-T1123 WeakPolarHBondContact O-CB 3.43Å; S87-T1123 PolarHBondContact O-OG1 3.41Å
88	V	28.3	Very low	27.2	Very low	91 Å²	91	128.9 Å²	128.9	55%	0.552	75%	0.748	S	S	*	*			trans	-163.2	145.5	142.3	125	0	0	0	0	110	L1124	V88-L1124 HydrophobicContact CG1-CD2 4.21Å; V88-L1124 HydrophobicContact CG2-CD1 4.09Å; V88-L1124 HydrophobicContact CG2-CD2 4.39Å; V88-L1124 HydrophobicContact CG2-CG 3.93Å
89	P	29.3	Very low	27.3	Very low	112 Å²	112	130.7 Å²	130.7	73%	0.727	76%	0.757	S	S	*	*			trans	-91	154.3	-158.8	34.6	-36.7	0	0	0	115.7	S91	P89-S91 PolarHBondContact O-N 3.3Å
90	L	24.5	Very low	27.3	Very low	166 Å²	166	130.6 Å²	130.6	87%	0.869	76%	0.764	S	S	*	*			trans	-62.9	122.2	164.6	-87.3	158.4	0	0	0	111.5
91	S	27.1	Very low	27.6	Very low	113 Å²	113	129.9 Å²	129.9	79%	0.79	77%	0.769	S	S	*	*			trans	-132.5	91.5	159.5	50.2	0	0	0	0	110.4	P89 S93	P89-S91 PolarHBondContact O-N 3.3Å; S91-S93 PolarHBondContact O-N 2.84Å
92	K	28.6	Very low	27.7	Very low	194 Å²	194	129.8 Å²	129.8	84%	0.843	78%	0.779	S	S	*	*			trans	-83.4	101.8	165.8	-82.1	-173.9	175.9	178	0	109.2
93	S	25.6	Very low	28	Very low	111 Å²	111	124.5 Å²	124.5	78%	0.776	77%	0.769	S	S	*	*				164.4	124.8	113.8	49.7	0	0	0	0	113.5	S91	S91-S93 PolarHBondContact O-N 2.84Å
94	S	27.3	Very low	28.1	Very low	112 Å²	112	122.6 Å²	122.6	78%	0.783	77%	0.769	S	S	*	*				-165.3	129.9	124.1	43	0	0	0	0	108.6
95	L	24.5	Very low	28.4	Very low	172 Å²	172	120.2 Å²	120.2	90%	0.901	76%	0.764	S	S	*	*			trans	-79.7	134.5	164.5	-81.9	70.8	0	0	0	107.5
96	S	27	Very low	28.7	Very low	118 Å²	118	120.8 Å²	120.8	83%	0.825	76%	0.755	S	S	*	*			trans	-144.9	75.8	158.4	48.1	0	0	0	0	109.9	G98	S96-G98 PolarHBondContact O-N 3.19Å
97	S	31.2	Very low	28.9	Very low	93 Å²	93	118.4 Å²	118.4	65%	0.65	76%	0.763	S	S	*	*			trans	-68.7	115.5	166	51	0	0	0	0	109.2	I99	S97-I99 PolarHBondContact O-N 2.91Å
98	G	28.8	Very low	29.2	Very low	82 Å²	82	119.4 Å²	119.4	85%	0.845	77%	0.77	S	S	*	*			trans	-64	126.1	163.7	0	0	0	0	0	109.2	S96	S96-G98 PolarHBondContact O-N 3.19Å
99	I	32.7	Very low	29.4	Very low	148 Å²	148	122.6 Å²	122.6	76%	0.759	78%	0.783	S	S	*	*			trans	-114.2	130.9	178.3	-64.9	174.9	0	0	0	108.3	S97	S97-I99 PolarHBondContact O-N 2.91Å
100	S	29	Very low	29.6	Very low	103 Å²	103	122.1 Å²	122.1	72%	0.72	78%	0.78	S	S	*	*			trans	-78.4	132.2	170.4	37	0	0	0	0	111.5
101	S	31.8	Very low	29.8	Very low	108 Å²	108	120.2 Å²	120.2	76%	0.755	78%	0.775	S	S	*	*			trans	51.2	91.8	155.9	56.8	0	0	0	0	119.1
102	S	31.9	Very low	29.9	Very low	129 Å²	129	119.8 Å²	119.8	90%	0.902	77%	0.772	S	S	*	*				-169.6	155.6	105.9	35.1	0	0	0	0	111.3
103	S	30.6	Very low	30	Very low	106 Å²	106	114.8 Å²	114.8	74%	0.741	76%	0.762	S	S	*	*			trans	-122.7	155.2	-170.1	52	0	0	0	0	110.6
104	T	30.2	Very low	30.1	Very low	121 Å²	121	113 Å²	113	74%	0.742	75%	0.749	S	S	*	*				-171.6	164.2	63.9	39.3	0	0	0	0	113.9
105	S	30.7	Very low	30.2	Very low	105 Å²	105	110 Å²	110	73%	0.734	73%	0.728	S	S	*	*			trans	88.1	133.9	148.7	73.1	0	0	0	0	122.6
106	S	32.4	Very low	30.6	Very low	98 Å²	98	105.3 Å²	105.3	69%	0.685	71%	0.71	S	S	*	*			trans	52.6	105.9	158	39.8	0	0	0	0	119.2
107	S	29.6	Very low	30.8	Very low	113 Å²	113	103.1 Å²	103.1	79%	0.79	69%	0.694	S	S	*	*				69	132.4	76.8	74.2	0	0	0	0	114.1
108	S	31.9	Very low	30.8	Very low	112 Å²	112	103.7 Å²	103.7	78%	0.783	70%	0.699	S	S	*	*			cis	-159.3	156	21.5	49.5	0	0	0	0	113.8
109	I	32.1	Very low	31	Very low	158 Å²	158	105.2 Å²	105.2	81%	0.81	70%	0.696	S	S	*	*			trans	-95.8	167.1	156	-27.1	178.3	0	0	0	108.2
110	P	34.3	Very low	30.9	Very low	103 Å²	103	103.1 Å²	103.1	67%	0.669	69%	0.694	S	S	*	*				-153.3	153.2	95.8	39.6	-22	0	0	0	117.7
111	T	28.1	Very low	30.9	Very low	126 Å²	126	103.5 Å²	103.5	77%	0.773	70%	0.697	S	S	*	*			trans	61	154.2	145.5	50.4	0	0	0	0	120.6
112	S	30.1	Very low	30.7	Very low	104 Å²	104	105 Å²	105	73%	0.727	70%	0.702	S	S	*	*			cis	-178.3	163.3	-8.6	45.3	0	0	0	0	109.3
113	S	29.4	Very low	30.5	Very low	89 Å²	89	103.6 Å²	103.6	62%	0.622	69%	0.692	S	S	*	*			cis	-173.5	153.5	-26.4	53.3	0	0	0	0	112.8
114	S	29.3	Very low	30.5	Very low	74 Å²	74	103.9 Å²	103.9	52%	0.517	69%	0.694	S	S	.	*			trans	67.3	111.8	148.9	64	0	0	0	0	124.6	Q1051	S114-Q1051 PolarHBondContact OG-NE2 3.46Å
115	S	29.8	Very low	30.4	Very low	49 Å²	49	103.1 Å²	103.1	34%	0.343	69%	0.694	S	S	.	*				92.6	93.3	121.9	68.1	0	0	0	0	125.7	Q1051 Q1052	S115-Q1051 WeakPolarHBondContact OG-CG 3.4Å; S115-Q1052 WeakPolarHBondContact OG-CG 3.19Å; S115-Q1052 PolarHBondContact OG-NE2 3.34Å; S115-Q1052 VanDerWaalsContact OG-NE2 3.07Å
116	S	31	Very low	30.3	Very low	73 Å²	73	105.4 Å²	105.4	51%	0.51	70%	0.697	S	S	.	*				78.1	146.1	122	65	0	0	0	0	125.2	Q1052	S116-Q1052 WeakPolarHBondContact OG-CA 3.1Å
117	S	31.3	Very low	30.2	Very low	71 Å²	71	106.3 Å²	106.3	50%	0.497	70%	0.703	S	S	.	*			trans	109.4	79.9	150.3	-29.1	0	0	0	0	121.2	Q1053	S117-Q1053 PolarHBondContact OG-N 2.91Å
118	S	32.7	Very low	30.1	Very low	106 Å²	106	104.3 Å²	104.3	74%	0.741	70%	0.7	S	S	*	*			trans	37.7	125.5	133	59.7	0	0	0	0	125.3
119	S	32.4	Very low	29.9	Very low	114 Å²	114	103.9 Å²	103.9	80%	0.797	70%	0.697	S	S	*	*			trans	61.7	141.4	141.9	52.8	0	0	0	0	121.1
120	S	31	Very low	29.9	Very low	103 Å²	103	101.9 Å²	101.9	72%	0.72	69%	0.693	S	S	*	*			cis	-167.8	154.3	-0.5	47.1	0	0	0	0	113.1
121	S	28.9	Very low	29.7	Very low	111 Å²	111	103 Å²	103	78%	0.776	69%	0.693	S	S	*	*			trans	63.2	140.6	167.2	71.9	0	0	0	0	116.6
122	T	27	Very low	29.7	Very low	141 Å²	141	102.6 Å²	102.6	87%	0.865	69%	0.686	S	S	*	*			cis	-143	-171.3	36.1	43.7	0	0	0	0	114.5
123	S	28.4	Very low	29.5	Very low	99 Å²	99	108.2 Å²	108.2	69%	0.692	69%	0.691	S	S	*	*			trans	-80.9	159	-160.8	50.2	0	0	0	0	119.3
124	S	29.2	Very low	29.3	Very low	111 Å²	111	111.5 Å²	111.5	78%	0.776	70%	0.701	S	S	*	*			trans	73.1	143.1	151	72.8	0	0	0	0	118.1
125	S	29.7	Very low	29.1	Very low	106 Å²	106	115.7 Å²	115.7	74%	0.741	71%	0.706	S	S	*	*			cis	-171.2	-177.5	-12.9	58.6	0	0	0	0	109.4
126	L	28.9	Very low	28.9	Very low	152 Å²	152	121.4 Å²	121.4	80%	0.796	73%	0.732	S	S	*	*			cis	-162.4	168.8	0.5	-137.7	174.2	0	0	0	109.5
127	S	28.5	Very low	28.6	Very low	118 Å²	118	123.4 Å²	123.4	83%	0.825	74%	0.737	S	S	*	*			trans	91.5	149.9	148.1	82.2	0	0	0	0	120.6
128	G	28.1	Very low	28.4	Very low	70 Å²	70	126.2 Å²	126.2	72%	0.722	75%	0.754	S	S	*	*			trans	114.8	41.9	-168.3	0	0	0	0	0	112.9
129	S	28.9	Very low	28	Very low	103 Å²	103	125.1 Å²	125.1	72%	0.72	74%	0.743	S	S	*	*				60.8	99.2	85.7	-162.4	0	0	0	0	112.4
130	T	30.7	Very low	27.7	Very low	116 Å²	116	124 Å²	124	71%	0.712	73%	0.728	S	S	*	*				173.8	167.9	95.1	38.5	0	0	0	0	107.6
131	N	30.4	Very low	27.4	Very low	126 Å²	126	126.5 Å²	126.5	67%	0.674	72%	0.722	S	S	*	*			cis	-167.9	158	-18	-94.5	-5.3	0	0	0	106.4
132	L	27.6	Very low	27.6	Very low	119 Å²	119	123.6 Å²	123.6	62%	0.623	70%	0.7	S	S	*	*			cis	-159.9	148.7	-14.3	-113.7	169.2	0	0	0	109.7
133	R	26.4	Very low	28.1	Very low	222 Å²	222	120 Å²	120	84%	0.838	68%	0.675	S	S	*	*			trans	15.3	129.6	156.8	-67.4	170.3	-172.2	147	1	120
134	D	25.1	Very low	28.3	Very low	158 Å²	158	117.7 Å²	117.7	85%	0.845	66%	0.657	S	S	*	*				-131.4	130.7	107.8	-151.4	-12.1	0	0	0	110.5
135	R	26	Very low	28.8	Very low	161 Å²	161	114.9 Å²	114.9	61%	0.608	63%	0.633	S	S	*	*			trans	-178.2	105	174.9	-117.1	179.9	-176.5	177.4	2.1	110.4
136	N	24.4	Very low	28.8	Very low	169 Å²	169	115.8 Å²	115.8	90%	0.904	63%	0.625	S	S	*	*			trans	-145.1	61.1	164.6	-111	-11.4	0	0	0	109.7
137	N	25.6	Very low	29	Very low	115 Å²	115	112.1 Å²	112.1	62%	0.615	60%	0.603	S	S	*	*	S	Bend	trans	-156.8	133.4	168.9	-142.9	5.1	0	0	0	109	T139	N137-T139 HydrophobicContact CB-CG2 4.08Å; N137-T139 PolarHBondContact O-N 3.33Å
138	P	26.5	Very low	28.7	Very low	130 Å²	130	112.9 Å²	112.9	84%	0.844	60%	0.598	S	S	*	*			trans	-81.6	68.9	177.8	33.9	-34.5	0	0	0	110.3
139	T	24.2	Very low	28.8	Very low	83 Å²	83	114.2 Å²	114.2	51%	0.509	59%	0.593	S	S	.	*			trans	-102.7	126	-179	51.3	0	0	0	0	111.4	N137	N137-T139 HydrophobicContact CB-CG2 4.08Å; N137-T139 PolarHBondContact O-N 3.33Å
140	N	26	Very low	28.8	Very low	90 Å²	90	116.8 Å²	116.8	48%	0.481	60%	0.597	S	S	.	*			trans	-45.8	141.9	176.1	-58.5	20.2	0	0	0	111.2	D201 I203	N140-D201 PolarHBondContact ND2-OD2 2.75Å; N140-I203 HydrophobicContact CB-CD1 3.71Å
141	W	24.7	Very low	28.5	Very low	156 Å²	156	114.5 Å²	114.5	59%	0.591	60%	0.597	S	S	*	*			trans	-66.8	141.3	-179.6	-70.3	32	0	0	0	110
142	V	32.2	Very low	28.6	Very low	51 Å²	51	116.2 Å²	116.2	31%	0.309	60%	0.604	S	S	.	*			trans	-130.7	98	-177.1	-177.1	0	0	0	0	107.2	T144 I203 V205	V142-T144 PolarHBondContact O-N 3.27Å; V142-I203 HydrophobicContact CG1-CG2 4.4Å; V142-I203 HydrophobicContact CG2-CG2 4.25Å; V142-V205 HydrophobicContact CG1-CB 3.95Å; V142-V205 HydrophobicContact CG1-CG2 3.38Å
143	D	39	Very low	28.4	Very low	66 Å²	66	113.2 Å²	113.2	35%	0.353	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.2	73.1	-179.9	-68	-55	0	0	0	110.8	I73 I145	I73-D143 HydrophobicContact CD1-CB 3.78Å; I73-D143 VanDerWaalsContact CD1-OD2 3.31Å; I73-D143 WeakPolarHBondContact CD1-OD2 3.29Å; I73-D143 HydrophobicContact CG1-CB 4.37Å; D143-I145 PolarHBondContact O-N 3.14Å
144	T	32.2	Very low	28.4	Very low	50 Å²	50	105.2 Å²	105.2	31%	0.307	59%	0.589	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-64.1	107.8	167.1	-61.3	0	0	0	0	108.9	V142 E146 V205 W268	V142-T144 PolarHBondContact O-N 3.27Å; T144-E146 PolarHBondContact O-N 2.79Å; T144-V205 HydrophobicContact CG2-CG1 4.22Å; T144-W268 HydrophobicContact CG2-CH2 4.24Å; T144-W268 HydrophobicContact CG2-CZ3 3.87Å
145	I	40.3	Very low	28.4	Very low	52 Å²	52	105.1 Å²	105.1	27%	0.267	59%	0.588	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.7	113.5	169.5	-62.3	-176.7	0	0	0	108.2	I73 D143 F147	I73-I145 HydrophobicContact CG2-CD1 4.38Å; D143-I145 PolarHBondContact O-N 3.14Å; I145-F147 HydrophobicContact CB-CE2 4.3Å; I145-F147 HydrophobicContact CG2-CD1 4.36Å; I145-F147 HydrophobicContact CG2-CD2 3.9Å; I145-F147 HydrophobicContact CG2-CE1 4.08Å; I145-F147 HydrophobicContact CG2-CE2 3.6Å; I145-F147 HydrophobicContact CG2-CG 4.28Å; I145-F147 HydrophobicContact CG2-CZ 3.7Å
146	E	29.6	Very low	28.5	Very low	125 Å²	125	105.8 Å²	105.8	58%	0.584	60%	0.6	S	S	*	*			trans	-88	107.2	170.6	-178.3	147.5	-132.8	0	0	109.5	T144 D148 K207	T144-E146 PolarHBondContact O-N 2.79Å; E146-D148 PolarHBondContact O-N 2.6Å; E146-K207 IonicContact OE1-NZ 3.3Å; E146-K207 PolarHBondContact OE1-NZ 3Å
147	F	32.9	Very low	28.8	Very low	74 Å²	74	106.7 Å²	106.7	33%	0.325	60%	0.599	S	S	.	*			trans	-86.2	91.9	172.5	-73	-74.7	0	0	0	109.9	I145 F185 P209	I145-F147 HydrophobicContact CB-CE2 4.3Å; I145-F147 HydrophobicContact CG2-CD1 4.36Å; I145-F147 HydrophobicContact CG2-CD2 3.9Å; I145-F147 HydrophobicContact CG2-CE1 4.08Å; I145-F147 HydrophobicContact CG2-CE2 3.6Å; I145-F147 HydrophobicContact CG2-CG 4.28Å; I145-F147 HydrophobicContact CG2-CZ 3.7Å; F147-F185 HydrophobicContact CE2-CE1 4.49Å; F147-F185 HydrophobicContact CZ-CE1 4.18Å; F147-P209 HydrophobicContact CB-CG 4.5Å
148	D	23	Very low	28.9	Very low	135 Å²	135	107.5 Å²	107.5	72%	0.722	60%	0.602	S	S	*	*			trans	-57.2	125.8	165.6	-95.4	-32.2	0	0	0	109.8	E146 I150	E146-D148 PolarHBondContact O-N 2.6Å; D148-I150 PolarHBondContact O-N 3.33Å
149	P	29.1	Very low	29.1	Very low	97 Å²	97	105.6 Å²	105.6	63%	0.63	59%	0.59	S	S	*	*			trans	-66.4	119.2	169.7	28	-31.9	0	0	0	108	G151	P149-G151 PolarHBondContact O-N 3.48Å
150	I	28.7	Very low	29.7	Very low	157 Å²	157	112 Å²	112	81%	0.805	61%	0.611	S	S	*	*			trans	-49.9	107.2	-176.7	-63	175.4	0	0	0	109.7	D148 I152	D148-I150 PolarHBondContact O-N 3.33Å; I150-I152 PolarHBondContact O-N 3.21Å; I150-I152 VanDerWaalsContact O-N 3.07Å
151	G	25.2	Very low	29.9	Very low	68 Å²	68	115.2 Å²	115.2	70%	0.701	62%	0.623	S	S	*	*			trans	-64.9	111.6	-179.8	0	0	0	0	0	109.5	P149 G153	P149-G151 PolarHBondContact O-N 3.48Å; G151-G153 PolarHBondContact O-N 2.86Å
152	I	31.4	Very low	30.5	Very low	162 Å²	162	114.9 Å²	114.9	83%	0.831	63%	0.628	S	S	*	*			trans	-76.1	57.1	172.7	-47.9	-176.9	0	0	0	109	I150 G154	I150-I152 PolarHBondContact O-N 3.21Å; I150-I152 VanDerWaalsContact O-N 3.07Å; I152-G154 PolarHBondContact O-N 3.1Å; I152-G154 VanDerWaalsContact O-N 3.14Å
153	G	24.5	Very low	30.9	Very low	57 Å²	57	121.7 Å²	121.7	59%	0.588	65%	0.653	S	S	*	*			trans	-81	37	171.7	0	0	0	0	0	112	G151	G151-G153 PolarHBondContact O-N 2.86Å
154	G	26.2	Very low	31	Very low	54 Å²	54	122.1 Å²	122.1	56%	0.557	66%	0.662	S	S	*	*			trans	-120.9	102.4	-179.5	0	0	0	0	0	110.3	I152 M156	I152-G154 PolarHBondContact O-N 3.1Å; I152-G154 VanDerWaalsContact O-N 3.14Å; G154-M156 VanDerWaalsContact C-N 3.25Å; G154-M156 PolarHBondContact O-N 3Å
155	L	25.8	Very low	31.3	Very low	156 Å²	156	125.9 Å²	125.9	82%	0.817	68%	0.675	S	S	*	*			trans	-71.6	79.6	174.5	-87.3	166	0	0	0	110.6	Q157	L155-Q157 PolarHBondContact O-N 3.48Å; L155-Q157 VanDerWaalsContact O-N 3.11Å
156	M	27.6	Very low	31.4	Very low	174 Å²	174	128.1 Å²	128.1	86%	0.857	69%	0.687	S	S	*	*			trans	-72	101.8	163.9	-167	165.3	-175.8	0	0	108	G154 L158	G154-M156 VanDerWaalsContact C-N 3.25Å; G154-M156 PolarHBondContact O-N 3Å; M156-L158 PolarHBondContact O-N 3.46Å
157	Q	29.6	Very low	32.2	Very low	188 Å²	188	129 Å²	129	88%	0.879	69%	0.689	S	S	*	*			trans	-75.1	87.9	-169.5	-166.1	165	14.7	0	0	110.9	L155	L155-Q157 PolarHBondContact O-N 3.48Å; L155-Q157 VanDerWaalsContact O-N 3.11Å
158	L	28.7	Very low	33.2	Very low	132 Å²	132	128.7 Å²	128.7	69%	0.691	69%	0.691	S	S	*	*			trans	-56.7	143.1	175.5	-74	169.1	0	0	0	111.3	M156	M156-L158 PolarHBondContact O-N 3.46Å
159	P	29.3	Very low	34.8	Very low	90 Å²	90	129 Å²	129	58%	0.584	68%	0.683	S	S	*	*			trans	-63.6	157.7	174.5	28.7	-35.3	0	0	0	111	Q161	P159-Q161 VanDerWaalsContact C-N 3.28Å; P159-Q161 HydrophobicContact CG-CG 4.48Å; P159-Q161 PolarHBondContact O-N 2.85Å
160	K	36.9	Very low	36.1	Very low	219 Å²	219	127.9 Å²	127.9	95%	0.952	67%	0.672	S	S	*	*			trans	-70.3	84	172.1	-68.6	-178.7	-179.4	176.9	0	110.2
161	Q	31.6	Very low	37.5	Very low	156 Å²	156	124.3 Å²	124.3	73%	0.729	65%	0.652	S	S	*	*			trans	-104	164	164.3	-70.8	-172.1	-53.6	0	0	110.6	P159	P159-Q161 VanDerWaalsContact C-N 3.28Å; P159-Q161 HydrophobicContact CG-CG 4.48Å; P159-Q161 PolarHBondContact O-N 2.85Å
162	E	36.8	Very low	39.1	Very low	149 Å²	149	128.6 Å²	128.6	70%	0.696	65%	0.647	S	S	*	*			trans	-72.8	157.1	-161.2	-63.5	-176.8	105.2	0	0	114.5	S164 H165	E162-S164 PolarHBondContact O-N 3.03Å; E162-S164 VanDerWaalsContact O-N 3.11Å; E162-H165 PolarHBondContact O-N 3.15Å
163	K	39.6	Very low	40.1	Very low	195 Å²	195	124 Å²	124	85%	0.848	62%	0.624	S	S	*	*	H	α-helix	trans	-62.1	-21.9	-174.3	-65.8	175.6	-178.8	170.3	0	113.4	F167	K163-F167 PolarHBondContact O-N 2.97Å
164	S	42.1	Very low	41.2	Very low	75 Å²	75	126.9 Å²	126.9	52%	0.524	62%	0.62	S	S	.	*	H	α-helix	trans	-58.6	-57.8	174.3	45.3	0	0	0	0	111.9	E162 L166 F167 D168	E162-S164 PolarHBondContact O-N 3.03Å; E162-S164 VanDerWaalsContact O-N 3.11Å; S164-L166 VanDerWaalsContact C-N 3.27Å; S164-L166 PolarHBondContact O-N 3.45Å; S164-F167 WeakPolarHBondContact O-CB 3.5Å; S164-F167 PolarHBondContact O-N 3.1Å; S164-D168 PolarHBondContact O-N 2.83Å
165	H	38.1	Very low	42.3	Very low	128 Å²	128	127.9 Å²	127.9	59%	0.593	62%	0.616	S	S	*	*	H	α-helix	trans	-63.7	-31.3	-178.3	-76.9	-80.9	0	0	0	113.1	E162 F167 D168 Y169	E162-H165 PolarHBondContact O-N 3.15Å; H165-F167 VanDerWaalsContact C-N 3.28Å; H165-F167 PolarHBondContact O-N 3.07Å; H165-D168 PolarHBondContact O-N 3.48Å; H165-Y169 VanDerWaalsContact O-CB 3.28Å; H165-Y169 WeakPolarHBondContact O-CB 3.45Å; H165-Y169 PolarHBondContact O-N 2.98Å
166	L	43.2	Very low	43.6	Very low	100 Å²	100	124.4 Å²	124.4	52%	0.524	60%	0.601	S	S	.	*	H	α-helix	trans	-67.9	-28.2	176.6	-162.7	69.5	0	0	0	112.2	S164 N170	S164-L166 VanDerWaalsContact C-N 3.27Å; S164-L166 PolarHBondContact O-N 3.45Å; L166-N170 WeakPolarHBondContact O-CB 3.25Å; L166-N170 PolarHBondContact O-N 2.82Å; L166-N170 PolarHBondContact O-ND2 3.49Å
167	F	46.6	Very low	44.7	Very low	143 Å²	143	121.3 Å²	121.3	63%	0.627	59%	0.587	S	S	*	*	H	α-helix	trans	-73.5	-48.7	174.3	-172.4	-99.6	0	0	0	111.5	K163 S164 H165 Y169 N170 Q171	K163-F167 PolarHBondContact O-N 2.97Å; S164-F167 WeakPolarHBondContact O-CB 3.5Å; S164-F167 PolarHBondContact O-N 3.1Å; H165-F167 VanDerWaalsContact C-N 3.28Å; H165-F167 PolarHBondContact O-N 3.07Å; F167-Y169 PolarHBondContact O-N 2.69Å; F167-N170 PolarHBondContact O-N 3.1Å; F167-Q171 HydrophobicContact CD1-CG 4.08Å; F167-Q171 HydrophobicContact CE1-CG 3.8Å; F167-Q171 HydrophobicContact CZ-CG 4.12Å; F167-Q171 WeakPolarHBondContact O-CG 3.41Å; F167-Q171 PolarHBondContact O-N 2.81Å
168	D	53.7	Low	45.5	Very low	68 Å²	68	122.1 Å²	122.1	36%	0.364	58%	0.582	S	S	.	*	H	α-helix	trans	-61.7	-43.5	176.7	-176.1	39.1	0	0	0	111.6	S164 H165 N170 Q171 R172	S164-D168 PolarHBondContact O-N 2.83Å; H165-D168 PolarHBondContact O-N 3.48Å; D168-N170 VanDerWaalsContact C-N 3.33Å; D168-N170 PolarHBondContact O-N 3.4Å; D168-Q171 PolarHBondContact O-N 3.39Å; D168-Q171 VanDerWaalsContact O-N 3.14Å; D168-R172 VanDerWaalsContact CG-NE 3.34Å; D168-R172 WeakPolarHBondContact O-CB 3.3Å; D168-R172 WeakPolarHBondContact O-CG 3.2Å; D168-R172 PolarHBondContact O-N 2.95Å; D168-R172 IonicContact OD1-NE 3.7Å; D168-R172 PolarHBondContact OD1-NE 3.27Å; D168-R172 IonicContact OD2-CZ 3.01Å; D168-R172 VanDerWaalsContact OD2-CZ 3.25Å; D168-R172 IonicContact OD2-NE 3.85Å; D168-R172 PolarHBondContact OD2-NE 3.32Å; D168-R172 IonicContact OD2-NH2 2.83Å; D168-R172 PolarHBondContact OD2-NH2 2.58Å
169	Y	56.2	Low	46.1	Very low	140 Å²	140	121.7 Å²	121.7	55%	0.549	58%	0.58	S	S	.	*	H	α-helix	trans	-59.4	-41.9	176.1	-174.7	-105.9	0	0	0	112.6	H165 F167 L173	H165-Y169 VanDerWaalsContact O-CB 3.28Å; H165-Y169 WeakPolarHBondContact O-CB 3.45Å; H165-Y169 PolarHBondContact O-N 2.98Å; F167-Y169 PolarHBondContact O-N 2.69Å; Y169-L173 HydrophobicContact CD1-CD1 3.95Å; Y169-L173 HydrophobicContact CE1-CD1 3.39Å; Y169-L173 HydrophobicContact CE1-CG 4.4Å; Y169-L173 WeakPolarHBondContact O-CB 3.31Å; Y169-L173 PolarHBondContact O-N 3.2Å
170	N	56.8	Low	46.9	Very low	75 Å²	75	125.8 Å²	125.8	40%	0.401	58%	0.584	S	S	.	*	H	α-helix	trans	-71.2	-31.7	175.7	-85.1	-77	0	0	0	113.3	L166 F167 D168 K174	L166-N170 WeakPolarHBondContact O-CB 3.25Å; L166-N170 PolarHBondContact O-N 2.82Å; L166-N170 PolarHBondContact O-ND2 3.49Å; F167-N170 PolarHBondContact O-N 3.1Å; D168-N170 VanDerWaalsContact C-N 3.33Å; D168-N170 PolarHBondContact O-N 3.4Å; N170-K174 WeakPolarHBondContact O-CB 3.42Å; N170-K174 VanDerWaalsContact O-CG 3.29Å; N170-K174 WeakPolarHBondContact O-CG 3.28Å; N170-K174 PolarHBondContact O-N 3.23Å; N170-K174 VanDerWaalsContact O-N 3.1Å
171	Q	58.6	Low	47.6	Very low	82 Å²	82	118.8 Å²	118.8	38%	0.383	56%	0.555	S	S	.	*	H	α-helix	trans	-67.5	-52.4	171.8	-73.4	-78	66.7	0	0	110.3	F167 D168 L173 K174 T175	F167-Q171 HydrophobicContact CD1-CG 4.08Å; F167-Q171 HydrophobicContact CE1-CG 3.8Å; F167-Q171 HydrophobicContact CZ-CG 4.12Å; F167-Q171 WeakPolarHBondContact O-CG 3.41Å; F167-Q171 PolarHBondContact O-N 2.81Å; D168-Q171 PolarHBondContact O-N 3.39Å; D168-Q171 VanDerWaalsContact O-N 3.14Å; Q171-L173 VanDerWaalsContact C-N 3.32Å; Q171-L173 PolarHBondContact O-N 2.86Å; Q171-K174 CarbonylContact O-C 3.51Å; Q171-K174 WeakPolarHBondContact O-CA 3.24Å; Q171-K174 WeakPolarHBondContact O-CB 3.41Å; Q171-K174 PolarHBondContact O-N 3.46Å; Q171-T175 PolarHBondContact O-N 3.28Å; Q171-T175 PolarHBondContact O-OG1 3.16Å
172	R	57	Low	49.1	Very low	158 Å²	158	114.6 Å²	114.6	60%	0.596	54%	0.541	S	S	*	.	H	α-helix	trans	-54.7	-44.6	175.6	-70.5	-178.8	-171.6	-138.2	5.1	112.3	D168 K174 T175 V176	D168-R172 VanDerWaalsContact CG-NE 3.34Å; D168-R172 WeakPolarHBondContact O-CB 3.3Å; D168-R172 WeakPolarHBondContact O-CG 3.2Å; D168-R172 PolarHBondContact O-N 2.95Å; D168-R172 IonicContact OD1-NE 3.7Å; D168-R172 PolarHBondContact OD1-NE 3.27Å; D168-R172 IonicContact OD2-CZ 3.01Å; D168-R172 VanDerWaalsContact OD2-CZ 3.25Å; D168-R172 IonicContact OD2-NE 3.85Å; D168-R172 PolarHBondContact OD2-NE 3.32Å; D168-R172 IonicContact OD2-NH2 2.83Å; D168-R172 PolarHBondContact OD2-NH2 2.58Å; R172-K174 PolarHBondContact O-N 3.42Å; R172-T175 PolarHBondContact O-N 2.84Å; R172-V176 WeakPolarHBondContact O-CB 3.3Å; R172-V176 WeakPolarHBondContact O-CG2 3.33Å; R172-V176 PolarHBondContact O-N 2.93Å
173	L	52.4	Low	50.7	Low	65 Å²	65	109.8 Å²	109.8	34%	0.34	52%	0.522	S	S	.	.	H	α-helix	trans	-60.2	-43.3	173.8	-98.3	168.7	0	0	0	112.2	Y169 Q171 T175 V176 L177	Y169-L173 HydrophobicContact CD1-CD1 3.95Å; Y169-L173 HydrophobicContact CE1-CD1 3.39Å; Y169-L173 HydrophobicContact CE1-CG 4.4Å; Y169-L173 WeakPolarHBondContact O-CB 3.31Å; Y169-L173 PolarHBondContact O-N 3.2Å; Q171-L173 VanDerWaalsContact C-N 3.32Å; Q171-L173 PolarHBondContact O-N 2.86Å; L173-T175 VanDerWaalsContact C-N 3.34Å; L173-T175 PolarHBondContact O-N 3.36Å; L173-V176 PolarHBondContact O-N 3.26Å; L173-L177 HydrophobicContact CD2-CD1 4.42Å; L173-L177 VanDerWaalsContact O-CB 3.25Å; L173-L177 WeakPolarHBondContact O-CB 3.48Å; L173-L177 WeakPolarHBondContact O-CG 3.33Å; L173-L177 PolarHBondContact O-N 3.18Å
174	K	49.4	Very low	52.8	Low	118 Å²	118	102.2 Å²	102.2	51%	0.513	49%	0.49	S	S	.	.	H	α-helix	trans	-63.7	-37.3	174.7	-75.6	170.8	-178.3	176.2	0	112.3	N170 Q171 R172 R178	N170-K174 WeakPolarHBondContact O-CB 3.42Å; N170-K174 VanDerWaalsContact O-CG 3.29Å; N170-K174 WeakPolarHBondContact O-CG 3.28Å; N170-K174 PolarHBondContact O-N 3.23Å; N170-K174 VanDerWaalsContact O-N 3.1Å; Q171-K174 CarbonylContact O-C 3.51Å; Q171-K174 WeakPolarHBondContact O-CA 3.24Å; Q171-K174 WeakPolarHBondContact O-CB 3.41Å; Q171-K174 PolarHBondContact O-N 3.46Å; R172-K174 PolarHBondContact O-N 3.42Å; K174-R178 WeakPolarHBondContact O-CB 3.25Å; K174-R178 VanDerWaalsContact O-CG 3.31Å; K174-R178 WeakPolarHBondContact O-CG 3.47Å; K174-R178 PolarHBondContact O-N 3Å
175	T	48.7	Very low	55.1	Low	75 Å²	75	99.2 Å²	99.2	46%	0.46	47%	0.468	S	S	.	.	H	α-helix	trans	-68.8	-46.4	176.5	-45	0	0	0	0	111.1	Q171 R172 L173 L177 R178 N179	Q171-T175 PolarHBondContact O-N 3.28Å; Q171-T175 PolarHBondContact O-OG1 3.16Å; R172-T175 PolarHBondContact O-N 2.84Å; L173-T175 VanDerWaalsContact C-N 3.34Å; L173-T175 PolarHBondContact O-N 3.36Å; T175-L177 VanDerWaalsContact C-N 3.34Å; T175-L177 PolarHBondContact O-N 2.8Å; T175-R178 PolarHBondContact O-N 2.94Å; T175-N179 WeakPolarHBondContact O-CB 3.49Å; T175-N179 VanDerWaalsContact O-CG 3.23Å; T175-N179 PolarHBondContact O-N 3.22Å; T175-N179 PolarHBondContact O-OD1 2.97Å
176	V	52.8	Low	57.5	Low	83 Å²	83	93.7 Å²	93.7	50%	0.503	44%	0.444	S	S	.	.	H	α-helix	trans	-61.1	-41.1	175.4	170.6	0	0	0	0	111.4	R172 L173 N179 R180	R172-V176 WeakPolarHBondContact O-CB 3.3Å; R172-V176 WeakPolarHBondContact O-CG2 3.33Å; R172-V176 PolarHBondContact O-N 2.93Å; L173-V176 PolarHBondContact O-N 3.26Å; V176-N179 PolarHBondContact O-N 2.82Å; V176-R180 PolarHBondContact O-N 3.04Å
177	L	50.4	Low	59.7	Low	109 Å²	109	89.2 Å²	89.2	57%	0.571	42%	0.42	S	S	*	.	H	α-helix	trans	-73.3	-25.2	177.7	-70.4	169.7	0	0	0	113.7	L173 T175	L173-L177 HydrophobicContact CD2-CD1 4.42Å; L173-L177 VanDerWaalsContact O-CB 3.25Å; L173-L177 WeakPolarHBondContact O-CB 3.48Å; L173-L177 WeakPolarHBondContact O-CG 3.33Å; L173-L177 PolarHBondContact O-N 3.18Å; T175-L177 VanDerWaalsContact C-N 3.34Å; T175-L177 PolarHBondContact O-N 2.8Å
178	R	46.5	Very low	61.9	Low	205 Å²	205	83.7 Å²	83.7	77%	0.774	40%	0.398	S	S	*	.	H	α-helix	trans	-75.6	-30.7	167.9	-75.3	-175.6	-150.2	-164.5	9	112.8	K174 T175	K174-R178 WeakPolarHBondContact O-CB 3.25Å; K174-R178 VanDerWaalsContact O-CG 3.31Å; K174-R178 WeakPolarHBondContact O-CG 3.47Å; K174-R178 PolarHBondContact O-N 3Å; T175-R178 PolarHBondContact O-N 2.94Å
179	N	40.9	Very low	63.8	Low	122 Å²	122	80.4 Å²	80.4	65%	0.652	38%	0.38	S	S	*	.	H	α-helix	trans	-92.4	-10.3	-174.3	-68.7	7.3	0	0	0	113.7	T175 V176 Q181	T175-N179 WeakPolarHBondContact O-CB 3.49Å; T175-N179 VanDerWaalsContact O-CG 3.23Å; T175-N179 PolarHBondContact O-N 3.22Å; T175-N179 PolarHBondContact O-OD1 2.97Å; V176-N179 PolarHBondContact O-N 2.82Å; N179-Q181 PolarHBondContact O-N 3.07Å
180	R	46.4	Very low	65.6	Low	177 Å²	177	73.8 Å²	73.8	67%	0.668	35%	0.354	S	S	*	.	S	Bend	trans	-60.2	135.6	169.4	-86.1	-173	173.4	-155.1	-6.6	110.3	V176	V176-R180 PolarHBondContact O-N 3.04Å
181	Q	51.9	Low	67.2	Low	71 Å²	71	73.8 Å²	73.8	33%	0.332	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-57.5	149.5	167.5	-70.1	-144.8	28.6	0	0	110.6	D80 N179 T183 E376	D80-Q181 PolarHBondContact OD2-NE2 2.57Å; N179-Q181 PolarHBondContact O-N 3.07Å; Q181-T183 PolarHBondContact O-N 2.88Å; Q181-E376 PolarHBondContact NE2-OE1 2.99Å
182	P	62.3	Low	68.7	Low	68 Å²	68	72 Å²	72	44%	0.442	34%	0.344	S	S	.	.	P	Polyproline II helix	trans	-60.9	125.8	167.5	28	-33.6	0	0	0	108.6	L184 Y289	P182-L184 PolarHBondContact O-N 2.89Å; P182-L184 VanDerWaalsContact O-N 3.1Å; P182-Y289 HydrophobicContact CB-CD2 3.83Å; P182-Y289 HydrophobicContact CB-CG 4.2Å; P182-Y289 HydrophobicContact CG-CD2 4.26Å
183	T	71.2	Confident	70.4	Confident	49 Å²	49	68.9 Å²	68.9	30%	0.301	34%	0.344	S	S	.	.			trans	-63.3	113.1	-177.2	52.4	0	0	0	0	110	Y77 Q181 F185	Y77-T183 HydrophobicContact CE1-CG2 4.47Å; Y77-T183 VanDerWaalsContact OH-CG2 3.25Å; Y77-T183 WeakPolarHBondContact OH-CG2 3.39Å; Q181-T183 PolarHBondContact O-N 2.88Å; T183-F185 WeakPolarHBondContact O-CD2 3.34Å; T183-F185 WeakPolarHBondContact O-CE2 3.4Å
184	L	83.4	Confident	72.3	Confident	35 Å²	35	71.3 Å²	71.3	18%	0.183	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	120.2	-175.8	-76	164.2	0	0	0	110.8	L78 P182 V287 Y289	L78-L184 PolarHBondContact N-O 2.81Å; P182-L184 PolarHBondContact O-N 2.89Å; P182-L184 VanDerWaalsContact O-N 3.1Å; L184-V287 HydrophobicContact CD2-CB 4.13Å; L184-V287 HydrophobicContact CD2-CG2 3.92Å; L184-Y289 HydrophobicContact CD2-CD1 3.7Å; L184-Y289 HydrophobicContact CD2-CG 4.25Å
185	F	90.1	Very high	74.5	Confident	12 Å²	12	69.8 Å²	69.8	5%	0.053	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	115.4	176.6	-59.2	-88.8	0	0	0	109.5	Y77 F147 T183 V287 Y288 F290	Y77-F185 HydrophobicContact CD2-CD1 4.14Å; Y77-F185 AromaticContact CD2-CE1 3.66Å; Y77-F185 HydrophobicContact CD2-CE1 3.66Å; Y77-F185 HydrophobicContact CD2-CZ 4.33Å; Y77-F185 AromaticContact CE2-CE1 3.73Å; Y77-F185 HydrophobicContact CE2-CE1 3.73Å; Y77-F185 AromaticContact CE2-CZ 3.97Å; Y77-F185 HydrophobicContact CE2-CZ 3.97Å; F147-F185 HydrophobicContact CE2-CE1 4.49Å; F147-F185 HydrophobicContact CZ-CE1 4.18Å; T183-F185 WeakPolarHBondContact O-CD2 3.34Å; T183-F185 WeakPolarHBondContact O-CE2 3.4Å; F185-V287 CarbonylContact O-C 3.59Å; F185-V287 VanDerWaalsContact O-CA 3.3Å; F185-V287 WeakPolarHBondContact O-CA 3.46Å; F185-Y288 HydrophobicContact CB-CD1 3.9Å; F185-Y288 HydrophobicContact CB-CD2 4.08Å; F185-Y288 HydrophobicContact CB-CE1 3.47Å; F185-Y288 VanDerWaalsContact CB-CE1 3.47Å; F185-Y288 HydrophobicContact CB-CE2 3.66Å; F185-Y288 HydrophobicContact CB-CG 4.19Å; F185-Y288 HydrophobicContact CD2-CD2 4Å; F185-Y288 AromaticContact CD2-CE2 3.59Å; F185-Y288 HydrophobicContact CD2-CE2 3.59Å; F185-Y288 HydrophobicContact CE2-CE2 4.42Å; F185-Y288 HydrophobicContact CG-CD2 4.38Å; F185-Y288 HydrophobicContact CG-CE1 4.39Å; F185-Y288 AromaticContact CG-CE2 3.75Å; F185-Y288 HydrophobicContact CG-CE2 3.75Å; F185-Y288 AromaticContact CG-CZ 3.76Å; F185-Y288 PolarHBondContact N-O 2.88Å; F185-Y288 WeakPolarHBondContact O-CD1 3.41Å; F185-Y288 PolarHBondContact O-N 3.49Å; F185-F290 HydrophobicContact CD2-CE2 4.26Å; F185-F290 HydrophobicContact CD2-CZ 4.48Å; F185-F290 HydrophobicContact CE2-CD2 4.08Å; F185-F290 AromaticContact CE2-CE2 3.47Å; F185-F290 HydrophobicContact CE2-CE2 3.47Å; F185-F290 VanDerWaalsContact CE2-CE2 3.47Å; F185-F290 HydrophobicContact CE2-CZ 4.08Å; F185-F290 HydrophobicContact CZ-CE2 4Å
186	T	89	Confident	76.7	Confident	13 Å²	13	66.3 Å²	66.3	8%	0.08	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	137.5	-178.8	-50.1	0	0	0	0	110.8	S75 Y76 L78 Q285 A286 V287	S75-T186 CarbonylContact C-O 3.52Å; S75-T186 VanDerWaalsContact CA-O 3.27Å; S75-T186 WeakPolarHBondContact CA-O 3.38Å; Y76-T186 PolarHBondContact N-O 2.94Å; Y76-T186 PolarHBondContact O-N 2.89Å; L78-T186 WeakPolarHBondContact CD1-OG1 3.35Å; T186-Q285 HydrophobicContact CG2-CG 3.86Å; T186-A286 CarbonylContact C-O 3.57Å; T186-A286 WeakPolarHBondContact CA-O 3.42Å; T186-V287 HydrophobicContact CG2-CG1 4.07Å; T186-V287 WeakPolarHBondContact OG1-CG1 3.4Å
187	F	90.4	Very high	78.6	Confident	6 Å²	6	63.7 Å²	63.7	3%	0.026	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	167.8	168.8	73	-74.3	0	0	0	110.5	L217 L271 F284 A286 Y288	F187-L217 HydrophobicContact CE1-CD1 3.62Å; F187-L217 HydrophobicContact CZ-CD1 3.85Å; F187-L271 HydrophobicContact CE1-CD1 4.17Å; F187-L271 HydrophobicContact CE2-CD1 3.61Å; F187-L271 HydrophobicContact CZ-CD1 3.3Å; F187-F284 HydrophobicContact CD2-CE2 4.28Å; F187-F284 AromaticContact CE2-CE2 3.6Å; F187-F284 HydrophobicContact CE2-CE2 3.6Å; F187-F284 AromaticContact CE2-CZ 3.89Å; F187-F284 HydrophobicContact CE2-CZ 3.89Å; F187-F284 HydrophobicContact CZ-CE2 4.04Å; F187-A286 HydrophobicContact CD1-CB 4.3Å; F187-A286 HydrophobicContact CE1-CB 3.64Å; F187-A286 HydrophobicContact CZ-CB 3.76Å; F187-A286 PolarHBondContact N-O 3.01Å; F187-A286 PolarHBondContact O-N 3.19Å; F187-A286 VanDerWaalsContact O-O 3.05Å; F187-Y288 AromaticContact CD1-CD1 3.85Å; F187-Y288 HydrophobicContact CD1-CD1 3.85Å; F187-Y288 HydrophobicContact CD1-CE1 4.15Å; F187-Y288 AromaticContact CE1-CD1 3.94Å; F187-Y288 HydrophobicContact CE1-CD1 3.94Å
188	T	92.4	Very high	80.8	Confident	26 Å²	26	60.1 Å²	60.1	16%	0.16	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.9	168.7	-174.8	64.4	0	0	0	0	112.1	F72 Y192 F284 Q285	F72-T188 WeakPolarHBondContact CA-O 3.45Å; F72-T188 WeakPolarHBondContact CD2-O 3.35Å; T188-Y192 HydrophobicContact CG2-CD1 3.77Å; T188-Y192 HydrophobicContact CG2-CE1 4.48Å; T188-Y192 HydrophobicContact CG2-CG 4.01Å; T188-F284 CarbonylContact C-O 3.53Å; T188-F284 WeakPolarHBondContact CA-O 3.5Å; T188-F284 WeakPolarHBondContact CB-O 3.41Å; T188-Q285 HydrophobicContact CG2-CB 3.93Å; T188-Q285 HydrophobicContact CG2-CG 4.03Å
189	S	93.2	Very high	83.1	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	28%	0.282	C	S	.	.	S	Bend	trans	-57.2	159.4	155.1	47.2	0	0	0	0	111.2	A282 G283 F284	S189-A282 PolarHBondContact OG-O 2.86Å; S189-G283 WeakPolarHBondContact OG-CA 3.43Å; S189-F284 PolarHBondContact N-O 3.15Å; S189-F284 PolarHBondContact OG-N 3.43Å; S189-F284 PolarHBondContact OG-O 3.36Å
190	P	92.9	Very high	85.6	Confident	0 Å²	0	48 Å²	48	0%	0	25%	0.253	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.1	147.5	167.6	-23.2	35.5	0	0	0	111.4	V68 Y192 T200 F273	V68-P190 HydrophobicContact CG1-CB 3.67Å; V68-P190 HydrophobicContact CG1-CG 3.92Å; P190-Y192 PolarHBondContact O-N 3.27Å; P190-T200 HydrophobicContact CG-CG2 4.22Å; P190-F273 HydrophobicContact CG-CD1 4.38Å; P190-F273 HydrophobicContact CG-CE1 4.21Å
191	L	91.1	Very high	87.9	Confident	76 Å²	76	41.3 Å²	41.3	40%	0.398	23%	0.23	S	C	.	.	T	Hydrogen-bonded Turn	trans	58.2	-6.1	-178.2	-59.8	-179.6	0	0	0	118.2	D194 N195 P197	L191-D194 CarbonylContact C-O 3.46Å; L191-D194 HydrophobicContact CB-CB 4.36Å; L191-D194 WeakPolarHBondContact O-CA 3.42Å; L191-D194 WeakPolarHBondContact O-CB 3.22Å; L191-D194 PolarHBondContact O-N 3.19Å; L191-N195 WeakPolarHBondContact CB-O 3.2Å; L191-N195 WeakPolarHBondContact CD1-O 3.49Å; L191-P197 HydrophobicContact CD1-CG 3.74Å; L191-P197 HydrophobicContact CG-CG 4.29Å
192	Y	91.4	Very high	90	Very high	43 Å²	43	38 Å²	38	17%	0.169	21%	0.214	C	C	.	.	T	Hydrogen-bonded Turn	trans	-45.4	131.4	179.6	-174.8	-81.3	0	0	0	113.2	T188 P190 P222 A282 F284 Q285	T188-Y192 HydrophobicContact CG2-CD1 3.77Å; T188-Y192 HydrophobicContact CG2-CE1 4.48Å; T188-Y192 HydrophobicContact CG2-CG 4.01Å; P190-Y192 PolarHBondContact O-N 3.27Å; Y192-P222 WeakPolarHBondContact OH-CD 3.44Å; Y192-A282 VanDerWaalsContact CD2-O 3.25Å; Y192-A282 WeakPolarHBondContact CD2-O 3.45Å; Y192-F284 WeakPolarHBondContact CD2-O 3.48Å; Y192-Q285 HydrophobicContact CD1-CB 4.28Å; Y192-Q285 HydrophobicContact CE1-CB 3.73Å; Y192-Q285 HydrophobicContact CE2-CB 4.06Å
193	P	92	Very high	91.5	Very high	93 Å²	93	35.4 Å²	35.4	60%	0.604	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	cis	-87.3	1.3	10.1	36.8	-38	0	0	0	115.2	A282	P193-A282 WeakPolarHBondContact O-CB 3.14Å
194	D	92.8	Very high	92.5	Very high	117 Å²	117	33.4 Å²	33.4	63%	0.626	18%	0.184	S	C	*	.	S	Bend	trans	-71.9	167.4	170.8	-58.9	-42	0	0	0	110.2	L191	L191-D194 CarbonylContact C-O 3.46Å; L191-D194 HydrophobicContact CB-CB 4.36Å; L191-D194 WeakPolarHBondContact O-CA 3.42Å; L191-D194 WeakPolarHBondContact O-CB 3.22Å; L191-D194 PolarHBondContact O-N 3.19Å
195	N	94.1	Very high	93.1	Very high	85 Å²	85	31.8 Å²	31.8	46%	0.455	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-64.8	139.4	-176.8	-72	0.3	0	0	0	112.6	L191 E280 K281 A282	L191-N195 WeakPolarHBondContact CB-O 3.2Å; L191-N195 WeakPolarHBondContact CD1-O 3.49Å; N195-E280 HydrophobicContact CB-CB 4.02Å; N195-E280 PolarHBondContact ND2-O 2.81Å; N195-K281 CarbonylContact C-O 3.51Å; N195-K281 WeakPolarHBondContact CA-O 3.14Å; N195-K281 WeakPolarHBondContact OD1-CA 3.22Å; N195-A282 PolarHBondContact OD1-N 2.87Å
196	Y	94.5	Very high	93.3	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.008	17%	0.174	C	C	.	.	P	Polyproline II helix	trans	-63.8	151.9	172.3	48.8	-106.5	0	0	0	111.6	F225 E226 D234 F273 E280 K281	Y196-F225 WeakPolarHBondContact OH-CA 3.45Å; Y196-E226 PolarHBondContact OH-N 2.86Å; Y196-D234 VanDerWaalsContact CE2-OD2 3.23Å; Y196-D234 WeakPolarHBondContact CE2-OD2 3.47Å; Y196-D234 PolarHBondContact OH-OD2 3.49Å; Y196-F273 AromaticContact CD1-CE2 3.93Å; Y196-F273 HydrophobicContact CD1-CE2 3.93Å; Y196-F273 AromaticContact CD1-CZ 3.78Å; Y196-F273 HydrophobicContact CD1-CZ 3.78Å; Y196-F273 AromaticContact CD2-CZ 3.85Å; Y196-F273 HydrophobicContact CD2-CZ 3.85Å; Y196-F273 HydrophobicContact CE1-CE2 4.3Å; Y196-F273 HydrophobicContact CE1-CZ 4.42Å; Y196-F273 HydrophobicContact CE2-CZ 4.46Å; Y196-F273 HydrophobicContact CG-CE1 4.49Å; Y196-F273 HydrophobicContact CG-CE2 4.13Å; Y196-F273 AromaticContact CG-CZ 3.49Å; Y196-F273 HydrophobicContact CG-CZ 3.49Å; Y196-F273 VanDerWaalsContact CG-CZ 3.49Å; Y196-E280 HydrophobicContact CD2-CB 4.21Å; Y196-E280 HydrophobicContact CD2-CG 4.49Å; Y196-E280 HydrophobicContact CE2-CB 4.12Å; Y196-E280 VanDerWaalsContact O-CB 3.3Å; Y196-E280 WeakPolarHBondContact O-CB 3.36Å; Y196-E280 WeakPolarHBondContact O-CG 3.36Å; Y196-K281 WeakPolarHBondContact CD1-O 3.21Å; Y196-K281 HydrophobicContact CE1-CB 4.25Å; Y196-K281 WeakPolarHBondContact CE1-O 3.17Å; Y196-K281 PolarHBondContact N-O 3.19Å; Y196-K281 PolarHBondContact OH-N 2.86Å
197	P	94.6	Very high	93.6	Very high	29 Å²	29	32.9 Å²	32.9	19%	0.188	18%	0.179	C	C	.	.	P	Polyproline II helix	trans	-71.2	150.6	174	-19.3	33.9	0	0	0	112.6	V68 L191 T200 S275	V68-P197 HydrophobicContact CG1-CG 3.79Å; L191-P197 HydrophobicContact CD1-CG 3.74Å; L191-P197 HydrophobicContact CG-CG 4.29Å; P197-T200 PolarHBondContact O-OG1 3.45Å; P197-S275 PolarHBondContact O-OG 2.68Å
198	P	94.7	Very high	93.7	Very high	34 Å²	34	32.6 Å²	32.6	22%	0.221	18%	0.178	C	C	.	.	S	Bend	trans	-71.2	160.6	172.7	32.6	-35.3	0	0	0	111.2	T200 D276 E280	P198-T200 VanDerWaalsContact C-N 3.3Å; P198-T200 PolarHBondContact O-N 3.49Å; P198-D276 CarbonylContact C-O 3.56Å; P198-D276 VanDerWaalsContact CA-O 3.26Å; P198-D276 WeakPolarHBondContact CA-O 3.47Å; P198-D276 VanDerWaalsContact CB-O 3.29Å; P198-D276 WeakPolarHBondContact CB-O 3.32Å; P198-E280 HydrophobicContact CB-CG 4.15Å; P198-E280 VanDerWaalsContact CD-OE1 3.3Å; P198-E280 WeakPolarHBondContact CD-OE1 3.45Å; P198-E280 HydrophobicContact CG-CG 4.41Å; P198-E280 VanDerWaalsContact CG-OE1 3.3Å; P198-E280 WeakPolarHBondContact CG-OE1 3.42Å
199	N	95.4	Very high	93.6	Very high	69 Å²	69	34 Å²	34	37%	0.369	19%	0.188	S	C	.	.	S	Bend	trans	56.8	37.9	-179.5	-60	-87.2	0	0	0	113.4	L62 Q65 S275 D276 F277	L62-N199 HydrophobicContact CD1-CB 3.7Å; Q65-N199 PolarHBondContact NE2-O 3.28Å; N199-S275 WeakPolarHBondContact CA-O 3.36Å; N199-S275 PolarHBondContact N-O 2.71Å; N199-D276 PolarHBondContact N-O 3.49Å; N199-F277 WeakPolarHBondContact ND2-CA 3.18Å
200	T	94.7	Very high	93.3	Very high	4 Å²	4	38.3 Å²	38.3	3%	0.025	21%	0.208	C	C	.	.			trans	-100.9	133.7	-178.2	-60	0	0	0	0	110.7	V68 P190 P197 P198 C202 F273 H274 S275	V68-T200 HydrophobicContact CG1-CG2 3.88Å; P190-T200 HydrophobicContact CG-CG2 4.22Å; P197-T200 PolarHBondContact O-OG1 3.45Å; P198-T200 VanDerWaalsContact C-N 3.3Å; P198-T200 PolarHBondContact O-N 3.49Å; T200-C202 WeakPolarHBondContact CG2-SG 3.03Å; T200-F273 HydrophobicContact CG2-CD1 4.09Å; T200-F273 HydrophobicContact CG2-CE1 3.78Å; T200-H274 CarbonylContact O-C 3.59Å; T200-H274 VanDerWaalsContact O-CA 3.3Å; T200-H274 WeakPolarHBondContact O-CA 3.44Å; T200-H274 PolarHBondContact O-ND1 3.21Å; T200-S275 VanDerWaalsContact CB-OG 3.32Å; T200-S275 WeakPolarHBondContact CB-OG 3.23Å; T200-S275 PolarHBondContact N-O 2.83Å; T200-S275 PolarHBondContact N-OG 2.62Å; T200-S275 VanDerWaalsContact N-OG 3.08Å; T200-S275 PolarHBondContact O-N 2.9Å
201	D	94.8	Very high	92.9	Very high	35 Å²	35	46.6 Å²	46.6	19%	0.187	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.4	99.3	172.9	-174.2	-2.3	0	0	0	108.7	N140 R272 F273	N140-D201 PolarHBondContact ND2-OD2 2.75Å; D201-R272 WeakPolarHBondContact OD1-CG 3.22Å; D201-R272 IonicContact OD1-CZ 2.65Å; D201-R272 IonicContact OD1-NE 2.91Å; D201-R272 PolarHBondContact OD1-NE 3.03Å; D201-R272 IonicContact OD1-NH2 3.17Å; D201-R272 IonicContact OD2-CZ 2.79Å; D201-R272 IonicContact OD2-NE 2.62Å; D201-R272 PolarHBondContact OD2-NE 3.04Å; D201-R272 IonicContact OD2-NH2 3.85Å; D201-R272 PolarHBondContact OD2-NH2 3.19Å; D201-F273 WeakPolarHBondContact CA-O 3.36Å
202	C	95.3	Very high	92.8	Very high	1 Å²	1	46.2 Å²	46.2	1%	0.007	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126	-176.4	-61.6	0	0	0	0	111	C69 F72 T200 R272 F273	C69-C202 WeakPolarHBondContact CA-SG 3.38Å; C69-C202 HydrophobicContact CB-CB 3.77Å; C69-C202 WeakPolarHBondContact CB-SG 2.81Å; C69-C202 WeakPolarHBondContact SG-CA 3.12Å; C69-C202 WeakPolarHBondContact SG-CB 3.44Å; C69-C202 CovalentContact SG-SG 2.04Å; C69-C202 PolarHBondContact SG-SG 3.29Å; F72-C202 HydrophobicContact CB-CB 4.04Å; F72-C202 HydrophobicContact CD1-CB 3.61Å; F72-C202 HydrophobicContact CD2-CB 4.25Å; F72-C202 HydrophobicContact CE1-CB 4.06Å; F72-C202 WeakPolarHBondContact CE1-O 3.41Å; F72-C202 HydrophobicContact CG-CB 3.73Å; T200-C202 WeakPolarHBondContact CG2-SG 3.03Å; C202-R272 CarbonylContact O-C 3.47Å; C202-R272 WeakPolarHBondContact O-CA 3.34Å; C202-F273 HydrophobicContact CB-CB 4.48Å; C202-F273 HydrophobicContact CB-CD1 4.29Å; C202-F273 PolarHBondContact N-O 2.93Å; C202-F273 PolarHBondContact O-N 3.24Å
203	I	94.3	Very high	92.7	Very high	15 Å²	15	45.5 Å²	45.5	8%	0.077	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129.6	-178.5	-57.1	-177.1	0	0	0	110.2	N140 V142 R270 L271 R272	N140-I203 HydrophobicContact CB-CD1 3.71Å; V142-I203 HydrophobicContact CG1-CG2 4.4Å; V142-I203 HydrophobicContact CG2-CG2 4.25Å; I203-R270 HydrophobicContact CG2-CG 4.4Å; I203-L271 WeakPolarHBondContact CA-O 3.5Å; I203-R272 HydrophobicContact CG1-CB 4.23Å; I203-R272 HydrophobicContact CG1-CG 4.02Å
204	K	92.1	Very high	92.8	Very high	6 Å²	6	42.6 Å²	42.6	3%	0.026	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	134.1	173	-169.2	66.4	174.2	175.4	0	109.8	F72 I73 I206 L271	F72-K204 HydrophobicContact CD1-CB 3.92Å; F72-K204 HydrophobicContact CE1-CB 3.67Å; I73-K204 HydrophobicContact CG1-CD 4.32Å; K204-I206 HydrophobicContact CG-CG1 4.41Å; K204-L271 HydrophobicContact CB-CB 4.3Å; K204-L271 PolarHBondContact N-O 2.93Å; K204-L271 PolarHBondContact O-N 3.06Å
205	V	94.8	Very high	92.8	Very high	1 Å²	1	37 Å²	37	1%	0.006	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114	128.3	166.3	166.6	0	0	0	0	108.2	V142 T144 E242 W268 R270	V142-V205 HydrophobicContact CG1-CB 3.95Å; V142-V205 HydrophobicContact CG1-CG2 3.38Å; T144-V205 HydrophobicContact CG2-CG1 4.22Å; V205-E242 HydrophobicContact CG1-CG 4.25Å; V205-E242 WeakPolarHBondContact CG2-O 3.4Å; V205-W268 HydrophobicContact CG1-CE3 3.73Å; V205-W268 HydrophobicContact CG1-CZ3 3.73Å; V205-R270 HydrophobicContact CG2-CB 4.03Å; V205-R270 HydrophobicContact CG2-CG 3.87Å
206	I	94.5	Very high	92.8	Very high	3 Å²	3	33.4 Å²	33.4	2%	0.015	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	130.2	176.2	-58.6	168.6	0	0	0	107.4	K204 I215 W268 L269 L271 Y288 F290	K204-I206 HydrophobicContact CG-CG1 4.41Å; I206-I215 HydrophobicContact CB-CD1 4.03Å; I206-I215 HydrophobicContact CG2-CD1 3.7Å; I206-I215 HydrophobicContact CG2-CG1 4.09Å; I206-I215 HydrophobicContact CG2-CG2 4.06Å; I206-I215 WeakPolarHBondContact O-CD1 3.39Å; I206-W268 WeakPolarHBondContact O-CA 3.47Å; I206-L269 PolarHBondContact N-O 3.35Å; I206-L269 PolarHBondContact O-N 3.12Å; I206-L271 HydrophobicContact CD1-CD1 3.82Å; I206-Y288 HydrophobicContact CD1-CD1 3.67Å; I206-Y288 HydrophobicContact CD1-CD2 4.29Å; I206-Y288 HydrophobicContact CD1-CE1 3.88Å; I206-Y288 HydrophobicContact CD1-CE2 4.48Å; I206-Y288 HydrophobicContact CD1-CG 3.88Å; I206-Y288 HydrophobicContact CG1-CE1 4.24Å; I206-Y288 HydrophobicContact CG2-CD2 3.76Å; I206-Y288 HydrophobicContact CG2-CE2 3.49Å; I206-Y288 VanDerWaalsContact CG2-CE2 3.49Å; I206-Y288 HydrophobicContact CG2-CG 4.43Å; I206-F290 HydrophobicContact CG2-CE1 4.01Å
207	K	94.8	Very high	92.7	Very high	45 Å²	45	33.3 Å²	33.3	20%	0.196	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	126.6	175.8	-168.8	178.7	-169.1	171.2	0	109.3	E146 Q267 W268	E146-K207 IonicContact OE1-NZ 3.3Å; E146-K207 PolarHBondContact OE1-NZ 3Å; K207-Q267 CarbonylContact C-O 3.56Å; K207-Q267 WeakPolarHBondContact CA-O 3.07Å; K207-W268 HydrophobicContact CB-CE3 3.81Å; K207-W268 HydrophobicContact CB-CH2 4.31Å; K207-W268 HydrophobicContact CB-CZ3 3.56Å; K207-W268 HydrophobicContact CD-CE3 4.45Å; K207-W268 HydrophobicContact CD-CH2 3.53Å; K207-W268 HydrophobicContact CD-CZ2 4.16Å; K207-W268 HydrophobicContact CD-CZ3 3.69Å; K207-W268 HydrophobicContact CG-CD2 4.37Å; K207-W268 HydrophobicContact CG-CE3 3.83Å; K207-W268 HydrophobicContact CG-CH2 3.83Å; K207-W268 HydrophobicContact CG-CZ2 4.32Å; K207-W268 HydrophobicContact CG-CZ3 3.54Å
208	A	92.4	Very high	92.4	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.008	17%	0.166	C	C	.	.			trans	-77.3	139.4	169.4	0	0	0	0	0	110.2	Q210 Q213 I215 Q267 F290	A208-Q210 PolarHBondContact O-N 2.86Å; A208-Q210 VanDerWaalsContact O-N 3.15Å; A208-Q213 HydrophobicContact CB-CB 3.83Å; A208-I215 HydrophobicContact CB-CG1 4.18Å; A208-Q267 HydrophobicContact CB-CB 3.98Å; A208-Q267 PolarHBondContact N-O 3.48Å; A208-F290 HydrophobicContact CB-CD1 3.63Å; A208-F290 HydrophobicContact CB-CE1 4.01Å; A208-F290 HydrophobicContact CB-CG 4.21Å
209	P	90.3	Very high	92.1	Very high	56 Å²	56	33.3 Å²	33.3	36%	0.364	16%	0.164	S	C	.	.	S	Bend	trans	-63.8	-17.7	-178.1	-25.6	34.5	0	0	0	115.4	F147 F290	F147-P209 HydrophobicContact CB-CG 4.5Å; P209-F290 VanDerWaalsContact CD-CD2 3.47Å; P209-F290 VanDerWaalsContact CD-CE2 3.4Å; P209-F290 HydrophobicContact CG-CD2 4.15Å; P209-F290 HydrophobicContact CG-CE2 3.93Å
210	Q	87.4	Confident	91.7	Very high	89 Å²	89	35 Å²	35	42%	0.416	17%	0.165	S	C	.	.	S	Bend	trans	-128	140.4	-179.9	-48.2	-173.3	-44.4	0	0	111.3	A208 D212 Q213	A208-Q210 PolarHBondContact O-N 2.86Å; A208-Q210 VanDerWaalsContact O-N 3.15Å; Q210-D212 WeakPolarHBondContact CB-OD1 3.32Å; Q210-D212 PolarHBondContact O-N 2.88Å; Q210-Q213 HydrophobicContact CB-CG 3.98Å; Q210-Q213 WeakPolarHBondContact O-CB 3.31Å; Q210-Q213 PolarHBondContact O-N 3.13Å; Q210-Q213 VanDerWaalsContact O-N 3.07Å
211	K	85.4	Confident	91.1	Very high	175 Å²	175	37.7 Å²	37.7	76%	0.761	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-22.9	-179.3	-74.6	179.2	176.9	-176	0	114	Q213	K211-Q213 VanDerWaalsContact C-N 3.3Å
212	D	87.7	Confident	90.4	Very high	67 Å²	67	39 Å²	39	36%	0.358	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-91.7	18	177	69.9	-47.6	0	0	0	113	Q210 K292 L293	Q210-D212 WeakPolarHBondContact CB-OD1 3.32Å; Q210-D212 PolarHBondContact O-N 2.88Å; D212-K292 CarbonylContact O-C 3.23Å; D212-K292 WeakPolarHBondContact O-CA 3.41Å; D212-K292 IonicContact OD1-NZ 2.81Å; D212-K292 IonicContact OD2-NZ 3.64Å; D212-K292 PolarHBondContact OD2-NZ 2.94Å; D212-L293 PolarHBondContact O-N 2.84Å
213	Q	89.9	Confident	90.1	Very high	28 Å²	28	39.4 Å²	39.4	13%	0.131	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	141.4	175.8	-66.7	173.1	-0.2	0	0	112.2	A208 Q210 K211 G266 Q267 F290 S291 K292	A208-Q213 HydrophobicContact CB-CB 3.83Å; Q210-Q213 HydrophobicContact CB-CG 3.98Å; Q210-Q213 WeakPolarHBondContact O-CB 3.31Å; Q210-Q213 PolarHBondContact O-N 3.13Å; Q210-Q213 VanDerWaalsContact O-N 3.07Å; K211-Q213 VanDerWaalsContact C-N 3.3Å; Q213-G266 CarbonylContact O-C 3.56Å; Q213-G266 VanDerWaalsContact O-C 3.23Å; Q213-Q267 VanDerWaalsContact O-CA 3.24Å; Q213-Q267 WeakPolarHBondContact O-CA 3.41Å; Q213-Q267 PolarHBondContact O-N 3.45Å; Q213-Q267 VanDerWaalsContact O-N 3.1Å; Q213-F290 HydrophobicContact CB-CB 4.49Å; Q213-S291 CarbonylContact C-O 3.59Å; Q213-S291 VanDerWaalsContact CA-O 3.25Å; Q213-S291 WeakPolarHBondContact CA-O 3.25Å; Q213-K292 HydrophobicContact CG-CG 4.43Å
214	Q	93.3	Very high	90	Very high	32 Å²	32	42.6 Å²	42.6	15%	0.15	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	157.3	162.1	50.3	176.1	-1.5	0	0	109.7	S264 S291 L293	Q214-S264 WeakPolarHBondContact CB-O 3.4Å; Q214-S291 WeakPolarHBondContact CG-O 3.2Å; Q214-S291 PolarHBondContact N-O 3.04Å; Q214-S291 PolarHBondContact O-N 2.95Å; Q214-L293 HydrophobicContact CB-CD2 3.78Å; Q214-L293 HydrophobicContact CG-CD2 4.09Å
215	I	94.3	Very high	90	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	130.6	172.7	-61.2	154	0	0	0	107.1	I206 A208 K263 S264 L269 Y288 F290	I206-I215 HydrophobicContact CB-CD1 4.03Å; I206-I215 HydrophobicContact CG2-CD1 3.7Å; I206-I215 HydrophobicContact CG2-CG1 4.09Å; I206-I215 HydrophobicContact CG2-CG2 4.06Å; I206-I215 WeakPolarHBondContact O-CD1 3.39Å; A208-I215 HydrophobicContact CB-CG1 4.18Å; I215-K263 WeakPolarHBondContact O-CA 3.25Å; I215-S264 PolarHBondContact N-OG 3.43Å; I215-S264 PolarHBondContact O-N 3.03Å; I215-S264 PolarHBondContact O-OG 2.99Å; I215-L269 HydrophobicContact CB-CB 4.33Å; I215-L269 HydrophobicContact CD1-CB 3.68Å; I215-L269 HydrophobicContact CG2-CB 4.31Å; I215-L269 HydrophobicContact CG2-CD2 4.06Å; I215-Y288 HydrophobicContact CG2-CD2 4.37Å; I215-F290 HydrophobicContact CG1-CD1 3.94Å; I215-F290 HydrophobicContact CG1-CE1 4.03Å
216	I	93.3	Very high	90	Very high	10 Å²	10	43 Å²	43	5%	0.051	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	132.5	172	-48.6	-167.6	0	0	0	108.2	I262 K263 Y288 Y289	I216-I262 CarbonylContact C-O 3.52Å; I216-I262 WeakPolarHBondContact CA-O 3.3Å; I216-K263 HydrophobicContact CB-CG 4.48Å; I216-K263 HydrophobicContact CD1-CG 4.33Å; I216-K263 HydrophobicContact CG1-CG 4.09Å; I216-K263 HydrophobicContact CG2-CG 4.06Å; I216-Y288 CarbonylContact O-C 3.56Å; I216-Y288 WeakPolarHBondContact O-CA 3.35Å; I216-Y288 WeakPolarHBondContact O-CB 3.45Å; I216-Y289 HydrophobicContact CB-CD1 4.34Å; I216-Y289 HydrophobicContact CB-CD2 4.41Å; I216-Y289 HydrophobicContact CB-CE1 3.88Å; I216-Y289 HydrophobicContact CB-CE2 3.97Å; I216-Y289 HydrophobicContact CD1-CE2 3.86Å; I216-Y289 HydrophobicContact CG1-CE2 4.18Å; I216-Y289 HydrophobicContact CG2-CE1 3.89Å; I216-Y289 HydrophobicContact CG2-CE2 4.45Å; I216-Y289 PolarHBondContact N-O 3.08Å; I216-Y289 PolarHBondContact O-N 2.96Å
217	L	92.2	Very high	89.6	Confident	0 Å²	0	46 Å²	46	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	119.2	-173.8	173.3	67.8	0	0	0	109.9	F187 F219 S261 I262 L269 L271 A286	F187-L217 HydrophobicContact CE1-CD1 3.62Å; F187-L217 HydrophobicContact CZ-CD1 3.85Å; L217-F219 HydrophobicContact CD2-CZ 4.28Å; L217-S261 WeakPolarHBondContact O-CA 3.23Å; L217-I262 HydrophobicContact CB-CB 4.23Å; L217-I262 HydrophobicContact CD2-CB 4.48Å; L217-I262 HydrophobicContact CD2-CD1 4.43Å; L217-I262 PolarHBondContact N-O 3.36Å; L217-I262 PolarHBondContact O-N 3.28Å; L217-L269 HydrophobicContact CB-CD2 4.23Å; L217-L269 HydrophobicContact CD2-CD2 4.01Å; L217-L271 HydrophobicContact CD2-CD2 3.89Å; L217-A286 HydrophobicContact CD1-CB 3.81Å
218	D	89.8	Confident	89.4	Confident	24 Å²	24	44.6 Å²	44.6	13%	0.128	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	130	176.3	-61.5	-29.1	0	0	0	110.3	R220 S261 A286 V287	D218-R220 IonicContact OD2-NH2 3.12Å; D218-R220 PolarHBondContact OD2-NH2 3.38Å; D218-S261 WeakPolarHBondContact OD1-CB 3.43Å; D218-S261 PolarHBondContact OD1-OG 3.41Å; D218-A286 CarbonylContact O-C 3.58Å; D218-A286 WeakPolarHBondContact O-CA 3.04Å; D218-V287 HydrophobicContact CB-CG2 3.91Å; D218-V287 PolarHBondContact N-O 2.93Å; D218-V287 PolarHBondContact O-N 2.8Å
219	F	88.4	Confident	89	Confident	39 Å²	39	48.3 Å²	48.3	17%	0.171	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	145.5	168.4	-62.7	-73.7	0	0	0	111.3	L217 F223 L236 I262 F284 A286	L217-F219 HydrophobicContact CD2-CZ 4.28Å; F219-F223 AromaticContact CD1-CD2 3.69Å; F219-F223 HydrophobicContact CD1-CD2 3.69Å; F219-F223 AromaticContact CD1-CE2 3.71Å; F219-F223 HydrophobicContact CD1-CE2 3.71Å; F219-F223 HydrophobicContact CE1-CD2 4.1Å; F219-F223 AromaticContact CE1-CE2 3.6Å; F219-F223 HydrophobicContact CE1-CE2 3.6Å; F219-F223 HydrophobicContact CG-CD2 4.05Å; F219-F223 HydrophobicContact CG-CE2 4.29Å; F219-F223 HydrophobicContact CZ-CE2 4.09Å; F219-L236 HydrophobicContact CE1-CD2 3.49Å; F219-L236 VanDerWaalsContact CE1-CD2 3.49Å; F219-L236 HydrophobicContact CZ-CD2 3.62Å; F219-I262 HydrophobicContact CE2-CD1 3.94Å; F219-I262 HydrophobicContact CZ-CD1 4.35Å; F219-F284 AromaticContact CD1-CD2 3.96Å; F219-F284 HydrophobicContact CD1-CD2 3.96Å; F219-F284 AromaticContact CE1-CD2 3.9Å; F219-F284 HydrophobicContact CE1-CD2 3.9Å; F219-F284 HydrophobicContact CE1-CE2 4.2Å; F219-A286 HydrophobicContact CD1-CB 3.79Å; F219-A286 HydrophobicContact CE1-CB 4.05Å
220	R	85.6	Confident	88.8	Confident	104 Å²	104	52.3 Å²	52.3	39%	0.392	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	145	179.9	-57.2	-64.4	172.6	110.6	-3.4	109.4	D218 Q285 V287	D218-R220 IonicContact OD2-NH2 3.12Å; D218-R220 PolarHBondContact OD2-NH2 3.38Å; R220-Q285 HydrophobicContact CB-CG 4.26Å; R220-Q285 PolarHBondContact N-O 3.48Å; R220-Q285 CarbonylContact O-C 3.54Å; R220-Q285 WeakPolarHBondContact O-CB 3.33Å; R220-V287 HydrophobicContact CG-CG1 3.95Å; R220-V287 HydrophobicContact CG-CG2 3.92Å
221	G	81.9	Confident	89	Confident	61 Å²	61	48 Å²	48	63%	0.629	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	69.6	-166.1	-175.8	0	0	0	0	0	113.6
222	P	81.5	Confident	89.3	Confident	61 Å²	61	45 Å²	45	40%	0.396	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.3	141.7	173.4	25.8	-35	0	0	0	112.6	Y192 Q224	Y192-P222 WeakPolarHBondContact OH-CD 3.44Å; P222-Q224 HydrophobicContact CB-CG 4.17Å
223	F	89.1	Confident	89.6	Confident	10 Å²	10	43.7 Å²	43.7	4%	0.044	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	89.6	172.3	-171.8	-84.4	0	0	0	108.5	F219 F225 L236 F252 C253 R257 G283 F284	F219-F223 AromaticContact CD1-CD2 3.69Å; F219-F223 HydrophobicContact CD1-CD2 3.69Å; F219-F223 AromaticContact CD1-CE2 3.71Å; F219-F223 HydrophobicContact CD1-CE2 3.71Å; F219-F223 HydrophobicContact CE1-CD2 4.1Å; F219-F223 AromaticContact CE1-CE2 3.6Å; F219-F223 HydrophobicContact CE1-CE2 3.6Å; F219-F223 HydrophobicContact CG-CD2 4.05Å; F219-F223 HydrophobicContact CG-CE2 4.29Å; F219-F223 HydrophobicContact CZ-CE2 4.09Å; F223-F225 AromaticContact CD1-CD2 3.95Å; F223-F225 HydrophobicContact CD1-CD2 3.95Å; F223-F225 HydrophobicContact CD1-CE2 4.1Å; F223-F225 HydrophobicContact CD2-CE2 4.24Å; F223-F225 AromaticContact CE1-CD2 3.54Å; F223-F225 HydrophobicContact CE1-CD2 3.54Å; F223-F225 AromaticContact CE1-CE2 3.55Å; F223-F225 HydrophobicContact CE1-CE2 3.55Å; F223-F225 HydrophobicContact CE2-CD2 4.49Å; F223-F225 AromaticContact CE2-CE2 3.7Å; F223-F225 HydrophobicContact CE2-CE2 3.7Å; F223-F225 HydrophobicContact CE2-CZ 4.44Å; F223-F225 HydrophobicContact CG-CE2 4.41Å; F223-F225 AromaticContact CZ-CD2 3.84Å; F223-F225 HydrophobicContact CZ-CD2 3.84Å; F223-F225 AromaticContact CZ-CE2 3.31Å; F223-F225 HydrophobicContact CZ-CE2 3.31Å; F223-F225 HydrophobicContact CZ-CZ 4.04Å; F223-L236 HydrophobicContact CE2-CD2 4.28Å; F223-L236 HydrophobicContact CZ-CB 4.39Å; F223-F252 HydrophobicContact CE1-CB 3.99Å; F223-F252 HydrophobicContact CZ-CB 3.64Å; F223-C253 WeakPolarHBondContact CE1-O 3.37Å; F223-R257 HydrophobicContact CD1-CG 4.2Å; F223-R257 VanDerWaalsContact O-CZ 3.23Å; F223-R257 PolarHBondContact O-NE 3.39Å; F223-R257 PolarHBondContact O-NH2 3.01Å; F223-G283 CarbonylContact C-O 3.58Å; F223-G283 WeakPolarHBondContact CA-O 3.5Å; F223-F284 HydrophobicContact CD2-CB 3.45Å; F223-F284 VanDerWaalsContact CD2-CB 3.45Å; F223-F284 HydrophobicContact CD2-CG 4.19Å; F223-F284 HydrophobicContact CE2-CB 3.78Å; F223-F284 HydrophobicContact CE2-CD1 4.44Å; F223-F284 HydrophobicContact CE2-CG 4.03Å; F223-F284 HydrophobicContact CG-CB 4.32Å
224	Q	90.8	Very high	89.9	Confident	82 Å²	82	42.3 Å²	42.3	38%	0.383	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	109.4	-169.2	-69.3	178.1	-12.3	0	0	111	P222 K281 G283	P222-Q224 HydrophobicContact CB-CG 4.17Å; Q224-K281 HydrophobicContact CB-CB 4.07Å; Q224-K281 HydrophobicContact CB-CD 4.34Å; Q224-K281 WeakPolarHBondContact O-CB 3.49Å; Q224-G283 PolarHBondContact N-O 2.92Å; Q224-G283 WeakPolarHBondContact O-CA 3.3Å; Q224-G283 PolarHBondContact O-N 2.71Å
225	F	92.9	Very high	89.9	Confident	0 Å²	0	41.4 Å²	41.4	0%	0	24%	0.24	C	C	.	.			trans	-118	169.2	172	-73.1	-111.6	0	0	0	109.3	Y196 F223 D234 Y235 L236 C253 S254 F273 K281 F284	Y196-F225 WeakPolarHBondContact OH-CA 3.45Å; F223-F225 AromaticContact CD1-CD2 3.95Å; F223-F225 HydrophobicContact CD1-CD2 3.95Å; F223-F225 HydrophobicContact CD1-CE2 4.1Å; F223-F225 HydrophobicContact CD2-CE2 4.24Å; F223-F225 AromaticContact CE1-CD2 3.54Å; F223-F225 HydrophobicContact CE1-CD2 3.54Å; F223-F225 AromaticContact CE1-CE2 3.55Å; F223-F225 HydrophobicContact CE1-CE2 3.55Å; F223-F225 HydrophobicContact CE2-CD2 4.49Å; F223-F225 AromaticContact CE2-CE2 3.7Å; F223-F225 HydrophobicContact CE2-CE2 3.7Å; F223-F225 HydrophobicContact CE2-CZ 4.44Å; F223-F225 HydrophobicContact CG-CE2 4.41Å; F223-F225 AromaticContact CZ-CD2 3.84Å; F223-F225 HydrophobicContact CZ-CD2 3.84Å; F223-F225 AromaticContact CZ-CE2 3.31Å; F223-F225 HydrophobicContact CZ-CE2 3.31Å; F223-F225 HydrophobicContact CZ-CZ 4.04Å; F225-D234 HydrophobicContact CB-CB 4.2Å; F225-D234 HydrophobicContact CD1-CB 3.86Å; F225-Y235 VanDerWaalsContact CE1-C 3.4Å; F225-L236 HydrophobicContact CE1-CB 4.39Å; F225-L236 HydrophobicContact CZ-CB 3.93Å; F225-C253 HydrophobicContact CB-CB 4.05Å; F225-S254 PolarHBondContact N-OG 2.95Å; F225-S254 PolarHBondContact O-OG 3.11Å; F225-F273 HydrophobicContact CD1-CE2 4.36Å; F225-F273 AromaticContact CE1-CD2 3.61Å; F225-F273 HydrophobicContact CE1-CD2 3.61Å; F225-F273 AromaticContact CE1-CE2 3.54Å; F225-F273 HydrophobicContact CE1-CE2 3.54Å; F225-F273 AromaticContact CZ-CD2 3.9Å; F225-F273 HydrophobicContact CZ-CD2 3.9Å; F225-F273 HydrophobicContact CZ-CE2 4.03Å; F225-K281 VanDerWaalsContact O-CD 3.27Å; F225-K281 WeakPolarHBondContact O-CD 3.41Å; F225-K281 VanDerWaalsContact O-CE 3.29Å; F225-K281 WeakPolarHBondContact O-CE 3.45Å; F225-K281 PolarHBondContact O-NZ 2.87Å; F225-F284 HydrophobicContact CE2-CB 4.32Å; F225-F284 AromaticContact CE2-CD1 3.81Å; F225-F284 HydrophobicContact CE2-CD1 3.81Å; F225-F284 HydrophobicContact CE2-CG 4.43Å; F225-F284 AromaticContact CZ-CD1 3.58Å; F225-F284 HydrophobicContact CZ-CD1 3.58Å; F225-F284 HydrophobicContact CZ-CE1 4.02Å
226	E	93.9	Very high	89.9	Confident	16 Å²	16	41.4 Å²	41.4	8%	0.075	24%	0.24	C	C	.	.			trans	-50.4	138.5	160.9	-170.7	178.6	-158.9	0	0	110.4	Y196 N233 D234 I279	Y196-E226 PolarHBondContact OH-N 2.86Å; E226-N233 VanDerWaalsContact CD-ND2 3.35Å; E226-N233 WeakPolarHBondContact OE2-CB 3.49Å; E226-N233 PolarHBondContact OE2-ND2 3.1Å; E226-D234 HydrophobicContact CB-CB 4.04Å; E226-D234 WeakPolarHBondContact CB-OD2 3.34Å; E226-I279 HydrophobicContact CB-CB 4.34Å; E226-I279 HydrophobicContact CG-CB 3.91Å; E226-I279 HydrophobicContact CG-CD1 4.44Å; E226-I279 HydrophobicContact CG-CG1 4.48Å; E226-I279 HydrophobicContact CG-CG2 4.29Å; E226-I279 VanDerWaalsContact OE1-CD1 3.25Å; E226-I279 WeakPolarHBondContact OE1-CD1 3.42Å; E226-I279 WeakPolarHBondContact OE1-CG1 3.48Å
227	P	87.5	Confident	89.9	Confident	66 Å²	66	41.6 Å²	41.6	43%	0.429	24%	0.24	S	C	.	.			trans	-84.5	122.7	174.3	30.1	-16.2	0	0	0	108.8	D255	P227-D255 WeakPolarHBondContact CA-OD2 3.3Å; P227-D255 VanDerWaalsContact CB-OD1 3.27Å; P227-D255 WeakPolarHBondContact CB-OD1 3.36Å; P227-D255 WeakPolarHBondContact CB-OD2 3.14Å
228	S	89.5	Confident	90	Very high	15 Å²	15	41.6 Å²	41.6	11%	0.105	24%	0.24	C	C	.	.			trans	-150.7	140.8	-177	59.2	0	0	0	0	111.4	D230 C231 I232 N233 D255	S228-D230 PolarHBondContact O-N 3.28Å; S228-C231 PolarHBondContact O-N 2.76Å; S228-C231 WeakPolarHBondContact OG-CA 3.44Å; S228-I232 PolarHBondContact OG-N 2.87Å; S228-N233 PolarHBondContact OG-N 3.28Å; S228-D255 PolarHBondContact N-OD2 3.42Å
229	A	84.8	Confident	90.3	Very high	80 Å²	80	42.4 Å²	42.4	66%	0.661	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-56	133.1	177.2	0	0	0	0	0	110.4	C231 I232	A229-C231 PolarHBondContact O-N 3.06Å; A229-I232 WeakPolarHBondContact O-CG1 3.39Å; A229-I232 WeakPolarHBondContact O-CG2 3.38Å; A229-I232 PolarHBondContact O-N 2.86Å
230	D	84.8	Confident	90.6	Very high	139 Å²	139	41.9 Å²	41.9	74%	0.743	24%	0.24	S	C	*	.	G	3₁₀ helix	trans	53.7	15.4	-174.4	-63.1	-38.7	0	0	0	116	S228 I232	S228-D230 PolarHBondContact O-N 3.28Å; D230-I232 HydrophobicContact CB-CG2 4.47Å
231	C	91.7	Very high	91.1	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	23%	0.227	C	C	.	.	G	3₁₀ helix	trans	52.8	56.7	-174.5	-53.5	0	0	0	0	112.5	S228 A229 Y235 R251 C253 N256	S228-C231 PolarHBondContact O-N 2.76Å; S228-C231 WeakPolarHBondContact OG-CA 3.44Å; A229-C231 PolarHBondContact O-N 3.06Å; C231-Y235 WeakPolarHBondContact O-CD1 3.4Å; C231-R251 HydrophobicContact CB-CB 4.27Å; C231-C253 WeakPolarHBondContact CA-SG 3.43Å; C231-C253 HydrophobicContact CB-CB 3.59Å; C231-C253 WeakPolarHBondContact CB-SG 3.49Å; C231-C253 WeakPolarHBondContact SG-CB 3.21Å; C231-C253 PolarHBondContact SG-N 3.05Å; C231-C253 CovalentContact SG-SG 2.04Å; C231-C253 PolarHBondContact SG-SG 3.49Å; C231-N256 PolarHBondContact SG-ND2 3.4Å
232	I	91.7	Very high	91.7	Very high	110 Å²	110	36.5 Å²	36.5	56%	0.564	21%	0.207	S	C	*	.			trans	-80	-33.3	-177.2	52	166.6	0	0	0	114.4	S228 A229 D230	S228-I232 PolarHBondContact OG-N 2.87Å; A229-I232 WeakPolarHBondContact O-CG1 3.39Å; A229-I232 WeakPolarHBondContact O-CG2 3.38Å; A229-I232 PolarHBondContact O-N 2.86Å; D230-I232 HydrophobicContact CB-CG2 4.47Å
233	N	94	Very high	92.4	Very high	40 Å²	40	39 Å²	39	21%	0.214	21%	0.209	C	C	.	.	S	Bend	trans	-87.2	-100.4	-177.5	-64	9.3	0	0	0	109.5	E226 S228 Y235 D276	E226-N233 VanDerWaalsContact CD-ND2 3.35Å; E226-N233 WeakPolarHBondContact OE2-CB 3.49Å; E226-N233 PolarHBondContact OE2-ND2 3.1Å; S228-N233 PolarHBondContact OG-N 3.28Å; N233-Y235 WeakPolarHBondContact O-CD1 3.47Å; N233-D276 HydrophobicContact CB-CB 4.5Å; N233-D276 WeakPolarHBondContact CB-OD2 3.31Å; N233-D276 VanDerWaalsContact CG-OD2 3.26Å; N233-D276 PolarHBondContact ND2-OD2 2.72Å
234	D	96	Very high	92.5	Very high	0 Å²	0	40.4 Å²	40.4	0%	0	23%	0.226	C	C	.	.	S	Bend	trans	-80.7	127.4	176.4	-61.1	-20.9	0	0	0	112.1	Y196 F225 E226 C253 H274 S275 D276	Y196-D234 VanDerWaalsContact CE2-OD2 3.23Å; Y196-D234 WeakPolarHBondContact CE2-OD2 3.47Å; Y196-D234 PolarHBondContact OH-OD2 3.49Å; F225-D234 HydrophobicContact CB-CB 4.2Å; F225-D234 HydrophobicContact CD1-CB 3.86Å; E226-D234 HydrophobicContact CB-CB 4.04Å; E226-D234 WeakPolarHBondContact CB-OD2 3.34Å; D234-C253 WeakPolarHBondContact O-CB 3.49Å; D234-H274 WeakPolarHBondContact CA-O 3.36Å; D234-S275 WeakPolarHBondContact OD1-CA 3.35Å; D234-S275 VanDerWaalsContact OD1-CB 3.28Å; D234-S275 WeakPolarHBondContact OD1-CB 3.49Å; D234-D276 PolarHBondContact OD1-N 2.78Å
235	Y	94.3	Very high	92.6	Very high	13 Å²	13	44.4 Å²	44.4	5%	0.051	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	156.2	178.7	58.7	-98.1	0	0	0	115.3	F225 C231 N233 E237 R251 R272 F273 H274	F225-Y235 VanDerWaalsContact CE1-C 3.4Å; C231-Y235 WeakPolarHBondContact O-CD1 3.4Å; N233-Y235 WeakPolarHBondContact O-CD1 3.47Å; Y235-E237 HydrophobicContact CD2-CB 3.93Å; Y235-E237 HydrophobicContact CE2-CB 3.98Å; Y235-R251 HydrophobicContact CD2-CG 4.31Å; Y235-R272 PolarHBondContact OH-NH1 3.28Å; Y235-F273 WeakPolarHBondContact O-CA 3.34Å; Y235-H274 HydrophobicContact CD1-CB 4.32Å; Y235-H274 HydrophobicContact CD2-CB 4.06Å; Y235-H274 HydrophobicContact CE1-CB 3.98Å; Y235-H274 AromaticContact CE1-CD2 3.41Å; Y235-H274 VanDerWaalsContact CE1-CD2 3.41Å; Y235-H274 WeakPolarHBondContact CE1-CD2 3.47Å; Y235-H274 HydrophobicContact CE2-CB 3.68Å; Y235-H274 HydrophobicContact CG-CB 4.36Å; Y235-H274 AromaticContact CZ-CD2 3.58Å; Y235-H274 AromaticContact CZ-CG 3.85Å; Y235-H274 PolarHBondContact N-O 2.92Å; Y235-H274 PolarHBondContact O-N 2.04Å; Y235-H274 PolarHBondContact OH-CD2 3.05Å
236	L	94.3	Very high	92.8	Very high	0 Å²	0	45 Å²	45	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	112.1	158.2	-179.1	65.3	0	0	0	109.7	F72 F219 F223 F225 V238 R251 F252 L271 F273 F284	F72-L236 HydrophobicContact CZ-CD1 4.27Å; F219-L236 HydrophobicContact CE1-CD2 3.49Å; F219-L236 VanDerWaalsContact CE1-CD2 3.49Å; F219-L236 HydrophobicContact CZ-CD2 3.62Å; F223-L236 HydrophobicContact CE2-CD2 4.28Å; F223-L236 HydrophobicContact CZ-CB 4.39Å; F225-L236 HydrophobicContact CE1-CB 4.39Å; F225-L236 HydrophobicContact CZ-CB 3.93Å; L236-V238 HydrophobicContact CD2-CG2 4.34Å; L236-V238 HydrophobicContact CG-CG2 4.09Å; L236-R251 WeakPolarHBondContact O-CA 3.44Å; L236-F252 PolarHBondContact N-O 2.93Å; L236-F252 WeakPolarHBondContact O-CD2 3.1Å; L236-F252 PolarHBondContact O-N 3.3Å; L236-L271 HydrophobicContact CD1-CB 4.36Å; L236-F273 HydrophobicContact CD1-CB 4.3Å; L236-F284 HydrophobicContact CD1-CE1 4.11Å; L236-F284 HydrophobicContact CD1-CZ 3.86Å; L236-F284 HydrophobicContact CD2-CD2 4.43Å; L236-F284 HydrophobicContact CD2-CE1 4.06Å; L236-F284 HydrophobicContact CD2-CE2 3.94Å; L236-F284 HydrophobicContact CD2-CZ 3.73Å; L236-F284 HydrophobicContact CG-CE1 4.49Å; L236-F284 HydrophobicContact CG-CZ 4.37Å
237	E	94.1	Very high	92.9	Very high	13 Å²	13	48.5 Å²	48.5	6%	0.061	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	129.4	172.1	-170.3	179.7	88.2	0	0	109.9	Y235 R239 L248 R251 L271 R272	Y235-E237 HydrophobicContact CD2-CB 3.93Å; Y235-E237 HydrophobicContact CE2-CB 3.98Å; E237-R239 IonicContact OE1-CZ 2.87Å; E237-R239 VanDerWaalsContact OE1-CZ 3.25Å; E237-R239 IonicContact OE1-NE 2.57Å; E237-R239 PolarHBondContact OE1-NE 2.99Å; E237-R239 IonicContact OE1-NH2 3.7Å; E237-R239 PolarHBondContact OE1-NH2 2.81Å; E237-R239 IonicContact OE2-NH2 3.96Å; E237-R239 PolarHBondContact OE2-NH2 2.91Å; E237-R239 VanDerWaalsContact OE2-NH2 3.11Å; E237-L248 HydrophobicContact CG-CD1 3.49Å; E237-L248 VanDerWaalsContact CG-CD1 3.49Å; E237-R251 HydrophobicContact CB-CG 4.02Å; E237-R251 HydrophobicContact CG-CG 3.91Å; E237-R251 IonicContact OE2-CZ 3.54Å; E237-R251 VanDerWaalsContact OE2-CZ 3.3Å; E237-R251 IonicContact OE2-NE 3.97Å; E237-R251 PolarHBondContact OE2-NE 2.85Å; E237-R251 IonicContact OE2-NH2 3.11Å; E237-R251 PolarHBondContact OE2-NH2 3.11Å; E237-L271 CarbonylContact O-C 3.44Å; E237-L271 WeakPolarHBondContact O-CA 3.49Å; E237-R272 HydrophobicContact CB-CB 4.33Å; E237-R272 PolarHBondContact N-O 3.01Å; E237-R272 PolarHBondContact O-N 3.44Å
238	V	94.4	Very high	93.3	Very high	0 Å²	0	49.7 Å²	49.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	127.9	-178.4	-175.3	0	0	0	0	110.3	L236 I249 G250 F252 I262 L269 L271	L236-V238 HydrophobicContact CD2-CG2 4.34Å; L236-V238 HydrophobicContact CG-CG2 4.09Å; V238-I249 HydrophobicContact CB-CB 4.46Å; V238-I249 HydrophobicContact CG1-CB 4.34Å; V238-I249 HydrophobicContact CG1-CD1 4.15Å; V238-I249 WeakPolarHBondContact O-CB 3.24Å; V238-I249 PolarHBondContact O-N 2.9Å; V238-G250 PolarHBondContact N-O 2.92Å; V238-G250 PolarHBondContact O-N 3.12Å; V238-F252 HydrophobicContact CB-CE2 4.06Å; V238-F252 HydrophobicContact CG2-CD2 3.89Å; V238-F252 HydrophobicContact CG2-CE2 3.77Å; V238-I262 HydrophobicContact CG1-CD1 4.4Å; V238-I262 HydrophobicContact CG1-CG2 4.08Å; V238-I262 HydrophobicContact CG2-CD1 4.23Å; V238-L269 HydrophobicContact CG1-CD1 3.9Å; V238-L269 HydrophobicContact CG1-CD2 4.42Å; V238-L269 HydrophobicContact CG1-CG 4.29Å; V238-L271 HydrophobicContact CB-CD2 4.19Å; V238-L271 HydrophobicContact CG1-CD2 3.75Å; V238-L271 HydrophobicContact CG2-CD2 3.76Å
239	R	95.7	Very high	93.4	Very high	42 Å²	42	52.2 Å²	52.2	16%	0.158	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	141	-176.9	-65.3	179.1	179.5	-85.5	-3.9	112.4	E237 G241 G244 S246 P247 L248 L269 R270	E237-R239 IonicContact OE1-CZ 2.87Å; E237-R239 VanDerWaalsContact OE1-CZ 3.25Å; E237-R239 IonicContact OE1-NE 2.57Å; E237-R239 PolarHBondContact OE1-NE 2.99Å; E237-R239 IonicContact OE1-NH2 3.7Å; E237-R239 PolarHBondContact OE1-NH2 2.81Å; E237-R239 IonicContact OE2-NH2 3.96Å; E237-R239 PolarHBondContact OE2-NH2 2.91Å; E237-R239 VanDerWaalsContact OE2-NH2 3.11Å; R239-G241 PolarHBondContact O-N 2.73Å; R239-G244 WeakPolarHBondContact CD-O 3.27Å; R239-G244 VanDerWaalsContact CZ-O 3.23Å; R239-G244 PolarHBondContact NE-O 3.33Å; R239-G244 VanDerWaalsContact NE-O 3.15Å; R239-G244 PolarHBondContact NH1-O 3.11Å; R239-S246 WeakPolarHBondContact CD-O 3.39Å; R239-S246 PolarHBondContact NH1-O 3.08Å; R239-P247 CarbonylContact C-O 3.59Å; R239-P247 WeakPolarHBondContact CA-O 3.26Å; R239-P247 WeakPolarHBondContact CB-O 3.44Å; R239-L248 HydrophobicContact CG-CD1 4.22Å; R239-L269 WeakPolarHBondContact O-CD1 3.41Å; R239-R270 HydrophobicContact CB-CB 4.29Å; R239-R270 PolarHBondContact N-O 3Å; R239-R270 PolarHBondContact O-N 3.28Å
240	D	95.2	Very high	93.7	Very high	27 Å²	27	49.1 Å²	49.1	14%	0.144	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	89.4	-179	-168.8	21.3	0	0	0	110.7	S246 P247 I249 S264 T265	D240-S246 WeakPolarHBondContact O-CB 3.06Å; D240-P247 HydrophobicContact CB-CB 4.46Å; D240-P247 PolarHBondContact N-O 3.17Å; D240-P247 WeakPolarHBondContact O-CD 3.49Å; D240-I249 HydrophobicContact CB-CD1 3.98Å; D240-I249 HydrophobicContact CB-CG1 3.97Å; D240-S264 WeakPolarHBondContact OD1-CA 3.4Å; D240-S264 WeakPolarHBondContact OD1-CB 3.43Å; D240-T265 PolarHBondContact OD1-N 2.93Å; D240-T265 PolarHBondContact OD1-OG1 3.28Å; D240-T265 VanDerWaalsContact OD2-CB 3.28Å; D240-T265 WeakPolarHBondContact OD2-CB 3.39Å; D240-T265 WeakPolarHBondContact OD2-CG2 3.14Å; D240-T265 PolarHBondContact OD2-N 3.25Å; D240-T265 PolarHBondContact OD2-OG1 3.4Å
241	G	95.2	Very high	94	Very high	11 Å²	11	46.9 Å²	46.9	11%	0.113	24%	0.242	C	C	.	.	S	Bend	trans	139.8	-174.7	-174.6	0	0	0	0	0	113.7	R239 S246 W268 L269 R270	R239-G241 PolarHBondContact O-N 2.73Å; G241-S246 WeakPolarHBondContact CA-OG 3.38Å; G241-W268 PolarHBondContact N-O 2.9Å; G241-L269 CarbonylContact O-C 3.53Å; G241-R270 VanDerWaalsContact O-CB 3.3Å; G241-R270 WeakPolarHBondContact O-CB 3.49Å; G241-R270 PolarHBondContact O-N 2.88Å; G241-R270 VanDerWaalsContact O-N 3.12Å
242	E	95.3	Very high	94	Very high	42 Å²	42	48.2 Å²	48.2	20%	0.196	25%	0.247	C	C	.	.	S	Bend	trans	-83.7	-29.3	-175.2	-173.1	175	-160.9	0	0	113.1	V205 W268 R270	V205-E242 HydrophobicContact CG1-CG 4.25Å; V205-E242 WeakPolarHBondContact CG2-O 3.4Å; E242-W268 HydrophobicContact CB-CD2 4.03Å; E242-W268 HydrophobicContact CB-CE3 4.24Å; E242-W268 HydrophobicContact CB-CG 4.19Å; E242-W268 HydrophobicContact CG-CD2 4.38Å; E242-W268 HydrophobicContact CG-CE3 4.21Å; E242-W268 HydrophobicContact CG-CH2 4.23Å; E242-W268 HydrophobicContact CG-CZ2 4.44Å; E242-W268 HydrophobicContact CG-CZ3 4.12Å; E242-W268 VanDerWaalsContact OE1-CH2 3.3Å; E242-W268 WeakPolarHBondContact OE1-CH2 3.16Å; E242-R270 WeakPolarHBondContact O-CD 3.48Å; E242-R270 PolarHBondContact O-NH1 3.43Å
243	Y	94.4	Very high	93.9	Very high	112 Å²	112	43 Å²	43	44%	0.439	22%	0.221	S	C	.	.	S	Bend	trans	-107.7	159.6	-160.2	-50.4	-53.1	0	0	0	114.3	F245 S246 R270	Y243-F245 HydrophobicContact CD1-CZ 4.48Å; Y243-F245 HydrophobicContact CD2-CE1 4.24Å; Y243-F245 AromaticContact CD2-CE2 3.55Å; Y243-F245 HydrophobicContact CD2-CE2 3.55Å; Y243-F245 AromaticContact CD2-CZ 3.36Å; Y243-F245 HydrophobicContact CD2-CZ 3.36Å; Y243-F245 HydrophobicContact CE2-CZ 4.23Å; Y243-F245 AromaticContact CG-CE1 3.93Å; Y243-F245 HydrophobicContact CG-CE1 3.93Å; Y243-F245 HydrophobicContact CG-CE2 4Å; Y243-F245 AromaticContact CG-CZ 3.52Å; Y243-F245 HydrophobicContact CG-CZ 3.52Å; Y243-F245 PolarHBondContact O-N 2.85Å; Y243-S246 PolarHBondContact N-OG 2.83Å; Y243-S246 VanDerWaalsContact O-CB 3.22Å; Y243-S246 WeakPolarHBondContact O-CB 3.48Å; Y243-S246 PolarHBondContact O-N 3.37Å; Y243-S246 PolarHBondContact O-OG 2.85Å; Y243-R270 VanDerWaalsContact O-CD 3.23Å; Y243-R270 WeakPolarHBondContact O-CD 3.39Å
244	G	91.7	Very high	93.6	Very high	40 Å²	40	41.7 Å²	41.7	41%	0.412	22%	0.215	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.1	-20.1	176.2	0	0	0	0	0	114.2	R239	R239-G244 WeakPolarHBondContact CD-O 3.27Å; R239-G244 VanDerWaalsContact CZ-O 3.23Å; R239-G244 PolarHBondContact NE-O 3.33Å; R239-G244 VanDerWaalsContact NE-O 3.15Å; R239-G244 PolarHBondContact NH1-O 3.11Å
245	F	94.1	Very high	92.5	Very high	167 Å²	167	45.4 Å²	45.4	73%	0.732	24%	0.235	S	C	*	.	T	Hydrogen-bonded Turn	trans	-97.3	3	174.2	57	-100.5	0	0	0	113.6	Y243	Y243-F245 HydrophobicContact CD1-CZ 4.48Å; Y243-F245 HydrophobicContact CD2-CE1 4.24Å; Y243-F245 AromaticContact CD2-CE2 3.55Å; Y243-F245 HydrophobicContact CD2-CE2 3.55Å; Y243-F245 AromaticContact CD2-CZ 3.36Å; Y243-F245 HydrophobicContact CD2-CZ 3.36Å; Y243-F245 HydrophobicContact CE2-CZ 4.23Å; Y243-F245 AromaticContact CG-CE1 3.93Å; Y243-F245 HydrophobicContact CG-CE1 3.93Å; Y243-F245 HydrophobicContact CG-CE2 4Å; Y243-F245 AromaticContact CG-CZ 3.52Å; Y243-F245 HydrophobicContact CG-CZ 3.52Å; Y243-F245 PolarHBondContact O-N 2.85Å
246	S	96.5	Very high	91.2	Very high	12 Å²	12	48.5 Å²	48.5	8%	0.084	25%	0.252	C	S	.	.	S	Bend	trans	-62	151	173.4	-72.8	0	0	0	0	111.3	R239 D240 G241 Y243 L248	R239-S246 WeakPolarHBondContact CD-O 3.39Å; R239-S246 PolarHBondContact NH1-O 3.08Å; D240-S246 WeakPolarHBondContact O-CB 3.06Å; G241-S246 WeakPolarHBondContact CA-OG 3.38Å; Y243-S246 PolarHBondContact N-OG 2.83Å; Y243-S246 VanDerWaalsContact O-CB 3.22Å; Y243-S246 WeakPolarHBondContact O-CB 3.48Å; Y243-S246 PolarHBondContact O-N 3.37Å; Y243-S246 PolarHBondContact O-OG 2.85Å; S246-L248 PolarHBondContact O-N 2.86Å
247	P	96.6	Very high	89.5	Confident	89 Å²	89	52.8 Å²	52.8	58%	0.578	27%	0.268	S	S	*	.	P	Polyproline II helix	trans	-46.5	130.5	-179.4	-30.9	35	0	0	0	113.2	R239 D240 I249	R239-P247 CarbonylContact C-O 3.59Å; R239-P247 WeakPolarHBondContact CA-O 3.26Å; R239-P247 WeakPolarHBondContact CB-O 3.44Å; D240-P247 HydrophobicContact CB-CB 4.46Å; D240-P247 PolarHBondContact N-O 3.17Å; D240-P247 WeakPolarHBondContact O-CD 3.49Å; P247-I249 PolarHBondContact O-N 3.34Å
248	L	94.3	Very high	87.6	Confident	91 Å²	91	59.2 Å²	59.2	48%	0.476	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	122.8	177.8	-177.9	65.8	0	0	0	109.4	E237 R239 S246 G250	E237-L248 HydrophobicContact CG-CD1 3.49Å; E237-L248 VanDerWaalsContact CG-CD1 3.49Å; R239-L248 HydrophobicContact CG-CD1 4.22Å; S246-L248 PolarHBondContact O-N 2.86Å; L248-G250 WeakPolarHBondContact CD1-O 3.04Å
249	I	92.3	Very high	85.8	Confident	68 Å²	68	64.1 Å²	64.1	35%	0.349	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.3	-42.6	167.9	-55.1	-172.4	0	0	0	109.2	V238 D240 P247 I262 L269	V238-I249 HydrophobicContact CB-CB 4.46Å; V238-I249 HydrophobicContact CG1-CB 4.34Å; V238-I249 HydrophobicContact CG1-CD1 4.15Å; V238-I249 WeakPolarHBondContact O-CB 3.24Å; V238-I249 PolarHBondContact O-N 2.9Å; D240-I249 HydrophobicContact CB-CD1 3.98Å; D240-I249 HydrophobicContact CB-CG1 3.97Å; P247-I249 PolarHBondContact O-N 3.34Å; I249-I262 HydrophobicContact CD1-CG2 3.71Å; I249-I262 HydrophobicContact CG2-CG2 4.06Å; I249-L269 HydrophobicContact CD1-CD1 3.84Å
250	G	90.8	Very high	84.4	Confident	15 Å²	15	67.8 Å²	67.8	16%	0.155	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	174.3	172.5	174.1	0	0	0	0	0	113.7	V238 L248	V238-G250 PolarHBondContact N-O 2.92Å; V238-G250 PolarHBondContact O-N 3.12Å; L248-G250 WeakPolarHBondContact CD1-O 3.04Å
251	R	91.7	Very high	84	Confident	93 Å²	93	69 Å²	69	35%	0.351	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	137.1	161.1	-72.8	-174.5	-177.1	172.9	0.2	108.8	C231 Y235 L236 E237	C231-R251 HydrophobicContact CB-CB 4.27Å; Y235-R251 HydrophobicContact CD2-CG 4.31Å; L236-R251 WeakPolarHBondContact O-CA 3.44Å; E237-R251 HydrophobicContact CB-CG 4.02Å; E237-R251 HydrophobicContact CG-CG 3.91Å; E237-R251 IonicContact OE2-CZ 3.54Å; E237-R251 VanDerWaalsContact OE2-CZ 3.3Å; E237-R251 IonicContact OE2-NE 3.97Å; E237-R251 PolarHBondContact OE2-NE 2.85Å; E237-R251 IonicContact OE2-NH2 3.11Å; E237-R251 PolarHBondContact OE2-NH2 3.11Å
252	F	90.9	Very high	83.8	Confident	27 Å²	27	69.3 Å²	69.3	12%	0.118	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128	122.8	-172.8	-54.7	-82.4	0	0	0	109.9	F223 L236 V238 I262	F223-F252 HydrophobicContact CE1-CB 3.99Å; F223-F252 HydrophobicContact CZ-CB 3.64Å; L236-F252 PolarHBondContact N-O 2.93Å; L236-F252 WeakPolarHBondContact O-CD2 3.1Å; L236-F252 PolarHBondContact O-N 3.3Å; V238-F252 HydrophobicContact CB-CE2 4.06Å; V238-F252 HydrophobicContact CG2-CD2 3.89Å; V238-F252 HydrophobicContact CG2-CE2 3.77Å; F252-I262 HydrophobicContact CD2-CD1 4.45Å; F252-I262 HydrophobicContact CE2-CD1 3.68Å; F252-I262 HydrophobicContact CZ-CD1 3.73Å
253	C	90.9	Very high	83.6	Confident	0 Å²	0	73 Å²	73	0%	0	37%	0.368	C	S	.	.			trans	-130.4	-166.9	172.4	59.7	0	0	0	0	108.2	F223 F225 C231 D234 D255	F223-C253 WeakPolarHBondContact CE1-O 3.37Å; F225-C253 HydrophobicContact CB-CB 4.05Å; C231-C253 WeakPolarHBondContact CA-SG 3.43Å; C231-C253 HydrophobicContact CB-CB 3.59Å; C231-C253 WeakPolarHBondContact CB-SG 3.49Å; C231-C253 WeakPolarHBondContact SG-CB 3.21Å; C231-C253 PolarHBondContact SG-N 3.05Å; C231-C253 CovalentContact SG-SG 2.04Å; C231-C253 PolarHBondContact SG-SG 3.49Å; D234-C253 WeakPolarHBondContact O-CB 3.49Å; C253-D255 PolarHBondContact O-N 3.42Å
254	S	86.2	Confident	83.6	Confident	14 Å²	14	67.7 Å²	67.7	10%	0.098	35%	0.347	C	S	.	.	S	Bend	trans	-60.4	-29.4	-175.2	-78.1	0	0	0	0	114.5	F225 R257	F225-S254 PolarHBondContact N-OG 2.95Å; F225-S254 PolarHBondContact O-OG 3.11Å; S254-R257 WeakPolarHBondContact O-CG 3.37Å
255	D	73.7	Confident	83.7	Confident	78 Å²	78	71.2 Å²	71.2	42%	0.417	36%	0.361	S	S	.	.	S	Bend	trans	-93	-38.1	-167.2	-43.5	-48.4	0	0	0	111.7	P227 S228 C253 R257	P227-D255 WeakPolarHBondContact CA-OD2 3.3Å; P227-D255 VanDerWaalsContact CB-OD1 3.27Å; P227-D255 WeakPolarHBondContact CB-OD1 3.36Å; P227-D255 WeakPolarHBondContact CB-OD2 3.14Å; S228-D255 PolarHBondContact N-OD2 3.42Å; C253-D255 PolarHBondContact O-N 3.42Å; D255-R257 PolarHBondContact O-N 3.25Å
256	N	67.3	Low	83.6	Confident	77 Å²	77	64.1 Å²	64.1	41%	0.412	34%	0.335	S	S	.	.			trans	-83.4	37.2	-177.8	-74.3	-21.2	0	0	0	114.1	C231 Q258	C231-N256 PolarHBondContact SG-ND2 3.4Å; N256-Q258 PolarHBondContact O-N 2.92Å
257	R	58.4	Low	83.5	Confident	90 Å²	90	65.5 Å²	65.5	34%	0.34	34%	0.34	S	S	.	.			trans	-76.1	74.4	-176.8	-74.9	-170.5	-168.5	157.3	7.9	114.2	F223 S254 D255 L259	F223-R257 HydrophobicContact CD1-CG 4.2Å; F223-R257 VanDerWaalsContact O-CZ 3.23Å; F223-R257 PolarHBondContact O-NE 3.39Å; F223-R257 PolarHBondContact O-NH2 3.01Å; S254-R257 WeakPolarHBondContact O-CG 3.37Å; D255-R257 PolarHBondContact O-N 3.25Å; R257-L259 HydrophobicContact CB-CD2 4.47Å; R257-L259 HydrophobicContact CB-CG 4.39Å; R257-L259 PolarHBondContact O-N 3.13Å; R257-L259 VanDerWaalsContact O-N 3.09Å
258	Q	53.2	Low	83.4	Confident	148 Å²	148	63.4 Å²	63.4	69%	0.692	32%	0.321	S	S	*	.			trans	-74.3	94.2	154.4	-69.6	-170.4	0.8	0	0	109.1	N256 H260	N256-Q258 PolarHBondContact O-N 2.92Å; Q258-H260 PolarHBondContact O-N 2.62Å
259	L	56.9	Low	83.5	Confident	103 Å²	103	59.1 Å²	59.1	54%	0.539	30%	0.298	S	S	.	.			trans	-71.8	54.1	-179.2	-66.4	173.1	0	0	0	112.4	R257 T418	R257-L259 HydrophobicContact CB-CD2 4.47Å; R257-L259 HydrophobicContact CB-CG 4.39Å; R257-L259 PolarHBondContact O-N 3.13Å; R257-L259 VanDerWaalsContact O-N 3.09Å; L259-T418 HydrophobicContact CD1-CG2 4.02Å
260	H	67.1	Low	83.6	Confident	119 Å²	119	57.3 Å²	57.3	55%	0.551	29%	0.287	S	S	*	.			trans	-116.9	140.5	-175.4	-70.1	23.9	0	0	0	110.1	Q258 I262	Q258-H260 PolarHBondContact O-N 2.62Å; H260-I262 PolarHBondContact O-N 3.44Å
261	S	86.1	Confident	83.9	Confident	54 Å²	54	56.6 Å²	56.6	38%	0.378	28%	0.28	S	S	.	.			trans	-57.7	111.3	176.7	-54.4	0	0	0	0	111.2	L217 D218	L217-S261 WeakPolarHBondContact O-CA 3.23Å; D218-S261 WeakPolarHBondContact OD1-CB 3.43Å; D218-S261 PolarHBondContact OD1-OG 3.41Å
262	I	90.6	Very high	84	Confident	17 Å²	17	54.8 Å²	54.8	9%	0.087	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	142.1	175.5	-66.3	172.5	0	0	0	108.6	I216 L217 F219 V238 I249 F252 H260	I216-I262 CarbonylContact C-O 3.52Å; I216-I262 WeakPolarHBondContact CA-O 3.3Å; L217-I262 HydrophobicContact CB-CB 4.23Å; L217-I262 HydrophobicContact CD2-CB 4.48Å; L217-I262 HydrophobicContact CD2-CD1 4.43Å; L217-I262 PolarHBondContact N-O 3.36Å; L217-I262 PolarHBondContact O-N 3.28Å; F219-I262 HydrophobicContact CE2-CD1 3.94Å; F219-I262 HydrophobicContact CZ-CD1 4.35Å; V238-I262 HydrophobicContact CG1-CD1 4.4Å; V238-I262 HydrophobicContact CG1-CG2 4.08Å; V238-I262 HydrophobicContact CG2-CD1 4.23Å; I249-I262 HydrophobicContact CD1-CG2 3.71Å; I249-I262 HydrophobicContact CG2-CG2 4.06Å; F252-I262 HydrophobicContact CD2-CD1 4.45Å; F252-I262 HydrophobicContact CE2-CD1 3.68Å; F252-I262 HydrophobicContact CZ-CD1 3.73Å; H260-I262 PolarHBondContact O-N 3.44Å
263	K	92.2	Very high	84.3	Confident	118 Å²	118	53.5 Å²	53.5	51%	0.513	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	130.1	-178.4	-63.5	166.4	-172.2	144.2	0	109	I215 I216	I215-K263 WeakPolarHBondContact O-CA 3.25Å; I216-K263 HydrophobicContact CB-CG 4.48Å; I216-K263 HydrophobicContact CD1-CG 4.33Å; I216-K263 HydrophobicContact CG1-CG 4.09Å; I216-K263 HydrophobicContact CG2-CG 4.06Å
264	S	94.2	Very high	84.5	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.014	28%	0.277	C	S	.	.			trans	-75.7	157.1	167	59.4	0	0	0	0	110.9	Q214 I215 D240 G266 W268	Q214-S264 WeakPolarHBondContact CB-O 3.4Å; I215-S264 PolarHBondContact N-OG 3.43Å; I215-S264 PolarHBondContact O-N 3.03Å; I215-S264 PolarHBondContact O-OG 2.99Å; D240-S264 WeakPolarHBondContact OD1-CA 3.4Å; D240-S264 WeakPolarHBondContact OD1-CB 3.43Å; S264-G266 VanDerWaalsContact C-N 3.28Å; S264-G266 WeakPolarHBondContact CB-O 3.37Å; S264-G266 PolarHBondContact OG-O 3.19Å; S264-W268 WeakPolarHBondContact CB-O 3.45Å
265	T	92.7	Very high	85	Confident	113 Å²	113	55 Å²	55	69%	0.693	27%	0.273	S	S	*	.	S	Bend	trans	-80.8	-8.2	171.3	56.9	0	0	0	0	113.2	D240 L293	D240-T265 PolarHBondContact OD1-N 2.93Å; D240-T265 PolarHBondContact OD1-OG1 3.28Å; D240-T265 VanDerWaalsContact OD2-CB 3.28Å; D240-T265 WeakPolarHBondContact OD2-CB 3.39Å; D240-T265 WeakPolarHBondContact OD2-CG2 3.14Å; D240-T265 PolarHBondContact OD2-N 3.25Å; D240-T265 PolarHBondContact OD2-OG1 3.4Å; T265-L293 WeakPolarHBondContact O-CD2 3.37Å
266	G	92.2	Very high	86	Confident	19 Å²	19	52.5 Å²	52.5	20%	0.196	26%	0.26	C	S	.	.	S	Bend	trans	-162.9	-161.5	176.1	0	0	0	0	0	113.9	Q213 S264 W268	Q213-G266 CarbonylContact O-C 3.56Å; Q213-G266 VanDerWaalsContact O-C 3.23Å; S264-G266 VanDerWaalsContact C-N 3.28Å; S264-G266 WeakPolarHBondContact CB-O 3.37Å; S264-G266 PolarHBondContact OG-O 3.19Å; G266-W268 PolarHBondContact O-N 3.49Å
267	Q	94.5	Very high	87.4	Confident	40 Å²	40	56.2 Å²	56.2	19%	0.187	27%	0.272	C	S	.	.	S	Bend	trans	-66.2	6.4	-168.7	68.7	170.1	12.2	0	0	117	K207 A208 Q213	K207-Q267 CarbonylContact C-O 3.56Å; K207-Q267 WeakPolarHBondContact CA-O 3.07Å; A208-Q267 HydrophobicContact CB-CB 3.98Å; A208-Q267 PolarHBondContact N-O 3.48Å; Q213-Q267 VanDerWaalsContact O-CA 3.24Å; Q213-Q267 WeakPolarHBondContact O-CA 3.41Å; Q213-Q267 PolarHBondContact O-N 3.45Å; Q213-Q267 VanDerWaalsContact O-N 3.1Å
268	W	95.9	Very high	88.9	Confident	46 Å²	46	53.3 Å²	53.3	17%	0.174	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	134.9	-171.9	-67.5	121.9	0	0	0	111.5	T144 V205 I206 K207 G241 E242 S264 G266	T144-W268 HydrophobicContact CG2-CH2 4.24Å; T144-W268 HydrophobicContact CG2-CZ3 3.87Å; V205-W268 HydrophobicContact CG1-CE3 3.73Å; V205-W268 HydrophobicContact CG1-CZ3 3.73Å; I206-W268 WeakPolarHBondContact O-CA 3.47Å; K207-W268 HydrophobicContact CB-CE3 3.81Å; K207-W268 HydrophobicContact CB-CH2 4.31Å; K207-W268 HydrophobicContact CB-CZ3 3.56Å; K207-W268 HydrophobicContact CD-CE3 4.45Å; K207-W268 HydrophobicContact CD-CH2 3.53Å; K207-W268 HydrophobicContact CD-CZ2 4.16Å; K207-W268 HydrophobicContact CD-CZ3 3.69Å; K207-W268 HydrophobicContact CG-CD2 4.37Å; K207-W268 HydrophobicContact CG-CE3 3.83Å; K207-W268 HydrophobicContact CG-CH2 3.83Å; K207-W268 HydrophobicContact CG-CZ2 4.32Å; K207-W268 HydrophobicContact CG-CZ3 3.54Å; G241-W268 PolarHBondContact N-O 2.9Å; E242-W268 HydrophobicContact CB-CD2 4.03Å; E242-W268 HydrophobicContact CB-CE3 4.24Å; E242-W268 HydrophobicContact CB-CG 4.19Å; E242-W268 HydrophobicContact CG-CD2 4.38Å; E242-W268 HydrophobicContact CG-CE3 4.21Å; E242-W268 HydrophobicContact CG-CH2 4.23Å; E242-W268 HydrophobicContact CG-CZ2 4.44Å; E242-W268 HydrophobicContact CG-CZ3 4.12Å; E242-W268 VanDerWaalsContact OE1-CH2 3.3Å; E242-W268 WeakPolarHBondContact OE1-CH2 3.16Å; S264-W268 WeakPolarHBondContact CB-O 3.45Å; G266-W268 PolarHBondContact O-N 3.49Å
269	L	95.7	Very high	90.7	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	130.1	171.2	-170	76.9	0	0	0	109	I206 I215 L217 V238 R239 G241 I249 L271	I206-L269 PolarHBondContact N-O 3.35Å; I206-L269 PolarHBondContact O-N 3.12Å; I215-L269 HydrophobicContact CB-CB 4.33Å; I215-L269 HydrophobicContact CD1-CB 3.68Å; I215-L269 HydrophobicContact CG2-CB 4.31Å; I215-L269 HydrophobicContact CG2-CD2 4.06Å; L217-L269 HydrophobicContact CB-CD2 4.23Å; L217-L269 HydrophobicContact CD2-CD2 4.01Å; V238-L269 HydrophobicContact CG1-CD1 3.9Å; V238-L269 HydrophobicContact CG1-CD2 4.42Å; V238-L269 HydrophobicContact CG1-CG 4.29Å; R239-L269 WeakPolarHBondContact O-CD1 3.41Å; G241-L269 CarbonylContact O-C 3.53Å; I249-L269 HydrophobicContact CD1-CD1 3.84Å; L269-L271 HydrophobicContact CD2-CD2 4.12Å; L269-L271 HydrophobicContact CG-CD2 4.36Å
270	R	95.3	Very high	92.5	Very high	31 Å²	31	49.5 Å²	49.5	12%	0.117	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	134.3	177.8	-179	-175.4	-169.5	93.7	-1.2	110.2	I203 V205 R239 G241 E242 Y243	I203-R270 HydrophobicContact CG2-CG 4.4Å; V205-R270 HydrophobicContact CG2-CB 4.03Å; V205-R270 HydrophobicContact CG2-CG 3.87Å; R239-R270 HydrophobicContact CB-CB 4.29Å; R239-R270 PolarHBondContact N-O 3Å; R239-R270 PolarHBondContact O-N 3.28Å; G241-R270 VanDerWaalsContact O-CB 3.3Å; G241-R270 WeakPolarHBondContact O-CB 3.49Å; G241-R270 PolarHBondContact O-N 2.88Å; G241-R270 VanDerWaalsContact O-N 3.12Å; E242-R270 WeakPolarHBondContact O-CD 3.48Å; E242-R270 PolarHBondContact O-NH1 3.43Å; Y243-R270 VanDerWaalsContact O-CD 3.23Å; Y243-R270 WeakPolarHBondContact O-CD 3.39Å
271	L	95.4	Very high	93.8	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	136.9	179.5	-52.4	173.9	0	0	0	108.6	F187 I203 K204 I206 L217 L236 E237 V238 L269	F187-L271 HydrophobicContact CE1-CD1 4.17Å; F187-L271 HydrophobicContact CE2-CD1 3.61Å; F187-L271 HydrophobicContact CZ-CD1 3.3Å; I203-L271 WeakPolarHBondContact CA-O 3.5Å; K204-L271 HydrophobicContact CB-CB 4.3Å; K204-L271 PolarHBondContact N-O 2.93Å; K204-L271 PolarHBondContact O-N 3.06Å; I206-L271 HydrophobicContact CD1-CD1 3.82Å; L217-L271 HydrophobicContact CD2-CD2 3.89Å; L236-L271 HydrophobicContact CD1-CB 4.36Å; E237-L271 CarbonylContact O-C 3.44Å; E237-L271 WeakPolarHBondContact O-CA 3.49Å; V238-L271 HydrophobicContact CB-CD2 4.19Å; V238-L271 HydrophobicContact CG1-CD2 3.75Å; V238-L271 HydrophobicContact CG2-CD2 3.76Å; L269-L271 HydrophobicContact CD2-CD2 4.12Å; L269-L271 HydrophobicContact CG-CD2 4.36Å
272	R	95.5	Very high	94.1	Very high	54 Å²	54	44.2 Å²	44.2	20%	0.204	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	110.8	170.6	174.9	173.6	-178.7	-116.8	-2	109	D201 C202 I203 Y235 E237	D201-R272 WeakPolarHBondContact OD1-CG 3.22Å; D201-R272 IonicContact OD1-CZ 2.65Å; D201-R272 IonicContact OD1-NE 2.91Å; D201-R272 PolarHBondContact OD1-NE 3.03Å; D201-R272 IonicContact OD1-NH2 3.17Å; D201-R272 IonicContact OD2-CZ 2.79Å; D201-R272 IonicContact OD2-NE 2.62Å; D201-R272 PolarHBondContact OD2-NE 3.04Å; D201-R272 IonicContact OD2-NH2 3.85Å; D201-R272 PolarHBondContact OD2-NH2 3.19Å; C202-R272 CarbonylContact O-C 3.47Å; C202-R272 WeakPolarHBondContact O-CA 3.34Å; I203-R272 HydrophobicContact CG1-CB 4.23Å; I203-R272 HydrophobicContact CG1-CG 4.02Å; Y235-R272 PolarHBondContact OH-NH1 3.28Å; E237-R272 HydrophobicContact CB-CB 4.33Å; E237-R272 PolarHBondContact N-O 3.01Å; E237-R272 PolarHBondContact O-N 3.44Å
273	F	95.8	Very high	94.3	Very high	0 Å²	0	43.4 Å²	43.4	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	129	167.9	165.6	-97.4	0	0	0	108.7	F72 P190 Y196 T200 D201 C202 F225 Y235 L236 F284	F72-F273 HydrophobicContact CD2-CB 4.18Å; F72-F273 HydrophobicContact CE1-CB 4.3Å; F72-F273 HydrophobicContact CE2-CB 3.31Å; F72-F273 HydrophobicContact CE2-CG 4.03Å; F72-F273 HydrophobicContact CZ-CB 3.39Å; P190-F273 HydrophobicContact CG-CD1 4.38Å; P190-F273 HydrophobicContact CG-CE1 4.21Å; Y196-F273 AromaticContact CD1-CE2 3.93Å; Y196-F273 HydrophobicContact CD1-CE2 3.93Å; Y196-F273 AromaticContact CD1-CZ 3.78Å; Y196-F273 HydrophobicContact CD1-CZ 3.78Å; Y196-F273 AromaticContact CD2-CZ 3.85Å; Y196-F273 HydrophobicContact CD2-CZ 3.85Å; Y196-F273 HydrophobicContact CE1-CE2 4.3Å; Y196-F273 HydrophobicContact CE1-CZ 4.42Å; Y196-F273 HydrophobicContact CE2-CZ 4.46Å; Y196-F273 HydrophobicContact CG-CE1 4.49Å; Y196-F273 HydrophobicContact CG-CE2 4.13Å; Y196-F273 AromaticContact CG-CZ 3.49Å; Y196-F273 HydrophobicContact CG-CZ 3.49Å; Y196-F273 VanDerWaalsContact CG-CZ 3.49Å; T200-F273 HydrophobicContact CG2-CD1 4.09Å; T200-F273 HydrophobicContact CG2-CE1 3.78Å; D201-F273 WeakPolarHBondContact CA-O 3.36Å; C202-F273 HydrophobicContact CB-CB 4.48Å; C202-F273 HydrophobicContact CB-CD1 4.29Å; C202-F273 PolarHBondContact N-O 2.93Å; C202-F273 PolarHBondContact O-N 3.24Å; F225-F273 HydrophobicContact CD1-CE2 4.36Å; F225-F273 AromaticContact CE1-CD2 3.61Å; F225-F273 HydrophobicContact CE1-CD2 3.61Å; F225-F273 AromaticContact CE1-CE2 3.54Å; F225-F273 HydrophobicContact CE1-CE2 3.54Å; F225-F273 AromaticContact CZ-CD2 3.9Å; F225-F273 HydrophobicContact CZ-CD2 3.9Å; F225-F273 HydrophobicContact CZ-CE2 4.03Å; Y235-F273 WeakPolarHBondContact O-CA 3.34Å; L236-F273 HydrophobicContact CD1-CB 4.3Å; F273-F284 HydrophobicContact CD2-CE1 4.12Å
274	H	96.1	Very high	94.3	Very high	46 Å²	46	37.8 Å²	37.8	21%	0.213	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	138.2	176	-171.6	51	0	0	0	109.7	T200 D234 Y235	T200-H274 CarbonylContact O-C 3.59Å; T200-H274 VanDerWaalsContact O-CA 3.3Å; T200-H274 WeakPolarHBondContact O-CA 3.44Å; T200-H274 PolarHBondContact O-ND1 3.21Å; D234-H274 WeakPolarHBondContact CA-O 3.36Å; Y235-H274 HydrophobicContact CD1-CB 4.32Å; Y235-H274 HydrophobicContact CD2-CB 4.06Å; Y235-H274 HydrophobicContact CE1-CB 3.98Å; Y235-H274 AromaticContact CE1-CD2 3.41Å; Y235-H274 VanDerWaalsContact CE1-CD2 3.41Å; Y235-H274 WeakPolarHBondContact CE1-CD2 3.47Å; Y235-H274 HydrophobicContact CE2-CB 3.68Å; Y235-H274 HydrophobicContact CG-CB 4.36Å; Y235-H274 AromaticContact CZ-CD2 3.58Å; Y235-H274 AromaticContact CZ-CG 3.85Å; Y235-H274 PolarHBondContact N-O 2.92Å; Y235-H274 PolarHBondContact O-N 2.04Å; Y235-H274 PolarHBondContact OH-CD2 3.05Å
275	S	96	Very high	94.1	Very high	1 Å²	1	40.6 Å²	40.6	1%	0.007	20%	0.202	C	C	.	.			trans	-128.1	145.9	162.6	58.5	0	0	0	0	111.8	P197 N199 T200 D234	P197-S275 PolarHBondContact O-OG 2.68Å; N199-S275 WeakPolarHBondContact CA-O 3.36Å; N199-S275 PolarHBondContact N-O 2.71Å; T200-S275 VanDerWaalsContact CB-OG 3.32Å; T200-S275 WeakPolarHBondContact CB-OG 3.23Å; T200-S275 PolarHBondContact N-O 2.83Å; T200-S275 PolarHBondContact N-OG 2.62Å; T200-S275 VanDerWaalsContact N-OG 3.08Å; T200-S275 PolarHBondContact O-N 2.9Å; D234-S275 WeakPolarHBondContact OD1-CA 3.35Å; D234-S275 VanDerWaalsContact OD1-CB 3.28Å; D234-S275 WeakPolarHBondContact OD1-CB 3.49Å
276	D	95.6	Very high	94	Very high	25 Å²	25	35.2 Å²	35.2	13%	0.134	17%	0.169	C	C	.	.			trans	-88.3	-163.5	175.9	96.9	5.5	0	0	0	111.9	P198 N199 N233 D234 S278	P198-D276 CarbonylContact C-O 3.56Å; P198-D276 VanDerWaalsContact CA-O 3.26Å; P198-D276 WeakPolarHBondContact CA-O 3.47Å; P198-D276 VanDerWaalsContact CB-O 3.29Å; P198-D276 WeakPolarHBondContact CB-O 3.32Å; N199-D276 PolarHBondContact N-O 3.49Å; N233-D276 HydrophobicContact CB-CB 4.5Å; N233-D276 WeakPolarHBondContact CB-OD2 3.31Å; N233-D276 VanDerWaalsContact CG-OD2 3.26Å; N233-D276 PolarHBondContact ND2-OD2 2.72Å; D234-D276 PolarHBondContact OD1-N 2.78Å; D276-S278 VanDerWaalsContact C-N 3.26Å; D276-S278 PolarHBondContact O-N 2.75Å; D276-S278 PolarHBondContact OD1-N 2.84Å; D276-S278 PolarHBondContact OD1-OG 2.9Å
277	F	95.4	Very high	94	Very high	155 Å²	155	34.6 Å²	34.6	68%	0.68	16%	0.161	S	C	*	.	S	Bend	trans	-80.1	3.3	-177.6	69	-85.8	0	0	0	115	N199	N199-F277 WeakPolarHBondContact ND2-CA 3.18Å
278	S	89.9	Confident	93.9	Very high	29 Å²	29	33 Å²	33	20%	0.203	15%	0.153	C	C	.	.	S	Bend	trans	-144.2	169.1	-165.9	63.2	0	0	0	0	115.3	D276 E280	D276-S278 VanDerWaalsContact C-N 3.26Å; D276-S278 PolarHBondContact O-N 2.75Å; D276-S278 PolarHBondContact OD1-N 2.84Å; D276-S278 PolarHBondContact OD1-OG 2.9Å; S278-E280 PolarHBondContact O-N 3.19Å
279	I	92.8	Very high	93.7	Very high	95 Å²	95	33.1 Å²	33.1	49%	0.487	15%	0.154	S	C	.	.			trans	38.3	60.2	174	-39.2	-163.1	0	0	0	115.7	E226	E226-I279 HydrophobicContact CB-CB 4.34Å; E226-I279 HydrophobicContact CG-CB 3.91Å; E226-I279 HydrophobicContact CG-CD1 4.44Å; E226-I279 HydrophobicContact CG-CG1 4.48Å; E226-I279 HydrophobicContact CG-CG2 4.29Å; E226-I279 VanDerWaalsContact OE1-CD1 3.25Å; E226-I279 WeakPolarHBondContact OE1-CD1 3.42Å; E226-I279 WeakPolarHBondContact OE1-CG1 3.48Å
280	E	94.2	Very high	93.6	Very high	75 Å²	75	34.6 Å²	34.6	35%	0.35	16%	0.161	S	C	.	.			trans	-66.2	144.1	177.9	-49.1	95.2	143.1	0	0	112.7	N195 Y196 P198 S278	N195-E280 HydrophobicContact CB-CB 4.02Å; N195-E280 PolarHBondContact ND2-O 2.81Å; Y196-E280 HydrophobicContact CD2-CB 4.21Å; Y196-E280 HydrophobicContact CD2-CG 4.49Å; Y196-E280 HydrophobicContact CE2-CB 4.12Å; Y196-E280 VanDerWaalsContact O-CB 3.3Å; Y196-E280 WeakPolarHBondContact O-CB 3.36Å; Y196-E280 WeakPolarHBondContact O-CG 3.36Å; P198-E280 HydrophobicContact CB-CG 4.15Å; P198-E280 VanDerWaalsContact CD-OE1 3.3Å; P198-E280 WeakPolarHBondContact CD-OE1 3.45Å; P198-E280 HydrophobicContact CG-CG 4.41Å; P198-E280 VanDerWaalsContact CG-OE1 3.3Å; P198-E280 WeakPolarHBondContact CG-OE1 3.42Å; S278-E280 PolarHBondContact O-N 3.19Å
281	K	94.5	Very high	93.3	Very high	54 Å²	54	35.2 Å²	35.2	24%	0.235	17%	0.169	C	C	.	.			trans	-139.2	177.2	176.8	-61.8	-165	-161.7	164.4	0	111.7	N195 Y196 Q224 F225 G283	N195-K281 CarbonylContact C-O 3.51Å; N195-K281 WeakPolarHBondContact CA-O 3.14Å; N195-K281 WeakPolarHBondContact OD1-CA 3.22Å; Y196-K281 WeakPolarHBondContact CD1-O 3.21Å; Y196-K281 HydrophobicContact CE1-CB 4.25Å; Y196-K281 WeakPolarHBondContact CE1-O 3.17Å; Y196-K281 PolarHBondContact N-O 3.19Å; Y196-K281 PolarHBondContact OH-N 2.86Å; Q224-K281 HydrophobicContact CB-CB 4.07Å; Q224-K281 HydrophobicContact CB-CD 4.34Å; Q224-K281 WeakPolarHBondContact O-CB 3.49Å; F225-K281 VanDerWaalsContact O-CD 3.27Å; F225-K281 WeakPolarHBondContact O-CD 3.41Å; F225-K281 VanDerWaalsContact O-CE 3.29Å; F225-K281 WeakPolarHBondContact O-CE 3.45Å; F225-K281 PolarHBondContact O-NZ 2.87Å; K281-G283 PolarHBondContact O-N 3.08Å
282	A	92.8	Very high	92.8	Very high	8 Å²	8	40.9 Å²	40.9	7%	0.066	19%	0.194	C	C	.	.			trans	-58.2	-20	-176.2	0	0	0	0	0	114.7	S189 Y192 P193 N195 F284	S189-A282 PolarHBondContact OG-O 2.86Å; Y192-A282 VanDerWaalsContact CD2-O 3.25Å; Y192-A282 WeakPolarHBondContact CD2-O 3.45Å; P193-A282 WeakPolarHBondContact O-CB 3.14Å; N195-A282 PolarHBondContact OD1-N 2.87Å; A282-F284 PolarHBondContact O-N 3.01Å
283	G	93.3	Very high	92	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	74.7	-122.5	-177.5	0	0	0	0	0	111.8	S189 F223 Q224 K281	S189-G283 WeakPolarHBondContact OG-CA 3.43Å; F223-G283 CarbonylContact C-O 3.58Å; F223-G283 WeakPolarHBondContact CA-O 3.5Å; Q224-G283 PolarHBondContact N-O 2.92Å; Q224-G283 WeakPolarHBondContact O-CA 3.3Å; Q224-G283 PolarHBondContact O-N 2.71Å; K281-G283 PolarHBondContact O-N 3.08Å
284	F	91.8	Very high	90.5	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	157.5	-174.9	71.2	-80.1	0	0	0	114	F72 F187 T188 S189 Y192 F219 F223 F225 L236 F273 A282 A286	F72-F284 AromaticContact CE2-CE1 3.98Å; F72-F284 HydrophobicContact CE2-CE1 3.98Å; F72-F284 AromaticContact CE2-CZ 3.65Å; F72-F284 HydrophobicContact CE2-CZ 3.65Å; F72-F284 HydrophobicContact CZ-CZ 4.24Å; F187-F284 HydrophobicContact CD2-CE2 4.28Å; F187-F284 AromaticContact CE2-CE2 3.6Å; F187-F284 HydrophobicContact CE2-CE2 3.6Å; F187-F284 AromaticContact CE2-CZ 3.89Å; F187-F284 HydrophobicContact CE2-CZ 3.89Å; F187-F284 HydrophobicContact CZ-CE2 4.04Å; T188-F284 CarbonylContact C-O 3.53Å; T188-F284 WeakPolarHBondContact CA-O 3.5Å; T188-F284 WeakPolarHBondContact CB-O 3.41Å; S189-F284 PolarHBondContact N-O 3.15Å; S189-F284 PolarHBondContact OG-N 3.43Å; S189-F284 PolarHBondContact OG-O 3.36Å; Y192-F284 WeakPolarHBondContact CD2-O 3.48Å; F219-F284 AromaticContact CD1-CD2 3.96Å; F219-F284 HydrophobicContact CD1-CD2 3.96Å; F219-F284 AromaticContact CE1-CD2 3.9Å; F219-F284 HydrophobicContact CE1-CD2 3.9Å; F219-F284 HydrophobicContact CE1-CE2 4.2Å; F223-F284 HydrophobicContact CD2-CB 3.45Å; F223-F284 VanDerWaalsContact CD2-CB 3.45Å; F223-F284 HydrophobicContact CD2-CG 4.19Å; F223-F284 HydrophobicContact CE2-CB 3.78Å; F223-F284 HydrophobicContact CE2-CD1 4.44Å; F223-F284 HydrophobicContact CE2-CG 4.03Å; F223-F284 HydrophobicContact CG-CB 4.32Å; F225-F284 HydrophobicContact CE2-CB 4.32Å; F225-F284 AromaticContact CE2-CD1 3.81Å; F225-F284 HydrophobicContact CE2-CD1 3.81Å; F225-F284 HydrophobicContact CE2-CG 4.43Å; F225-F284 AromaticContact CZ-CD1 3.58Å; F225-F284 HydrophobicContact CZ-CD1 3.58Å; F225-F284 HydrophobicContact CZ-CE1 4.02Å; L236-F284 HydrophobicContact CD1-CE1 4.11Å; L236-F284 HydrophobicContact CD1-CZ 3.86Å; L236-F284 HydrophobicContact CD2-CD2 4.43Å; L236-F284 HydrophobicContact CD2-CE1 4.06Å; L236-F284 HydrophobicContact CD2-CE2 3.94Å; L236-F284 HydrophobicContact CD2-CZ 3.73Å; L236-F284 HydrophobicContact CG-CE1 4.49Å; L236-F284 HydrophobicContact CG-CZ 4.37Å; F273-F284 HydrophobicContact CD2-CE1 4.12Å; A282-F284 PolarHBondContact O-N 3.01Å; F284-A286 HydrophobicContact CD2-CB 4.01Å; F284-A286 HydrophobicContact CE2-CB 4.06Å
285	Q	91.5	Very high	88.5	Confident	62 Å²	62	53.4 Å²	53.4	29%	0.29	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	146.1	157.7	172.5	179.6	86	0	0	109.4	T186 T188 Y192 R220	T186-Q285 HydrophobicContact CG2-CG 3.86Å; T188-Q285 HydrophobicContact CG2-CB 3.93Å; T188-Q285 HydrophobicContact CG2-CG 4.03Å; Y192-Q285 HydrophobicContact CD1-CB 4.28Å; Y192-Q285 HydrophobicContact CE1-CB 3.73Å; Y192-Q285 HydrophobicContact CE2-CB 4.06Å; R220-Q285 HydrophobicContact CB-CG 4.26Å; R220-Q285 PolarHBondContact N-O 3.48Å; R220-Q285 CarbonylContact O-C 3.54Å; R220-Q285 WeakPolarHBondContact O-CB 3.33Å
286	A	90.5	Very high	86.6	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.8	155	174.3	0	0	0	0	0	111.2	T186 F187 L217 D218 F219 F284	T186-A286 CarbonylContact C-O 3.57Å; T186-A286 WeakPolarHBondContact CA-O 3.42Å; F187-A286 HydrophobicContact CD1-CB 4.3Å; F187-A286 HydrophobicContact CE1-CB 3.64Å; F187-A286 HydrophobicContact CZ-CB 3.76Å; F187-A286 PolarHBondContact N-O 3.01Å; F187-A286 PolarHBondContact O-N 3.19Å; F187-A286 VanDerWaalsContact O-O 3.05Å; L217-A286 HydrophobicContact CD1-CB 3.81Å; D218-A286 CarbonylContact O-C 3.58Å; D218-A286 WeakPolarHBondContact O-CA 3.04Å; F219-A286 HydrophobicContact CD1-CB 3.79Å; F219-A286 HydrophobicContact CE1-CB 4.05Å; F284-A286 HydrophobicContact CD2-CB 4.01Å; F284-A286 HydrophobicContact CE2-CB 4.06Å
287	V	91.7	Very high	84.3	Confident	6 Å²	6	64 Å²	64	4%	0.036	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	142.1	171.9	-59	0	0	0	0	109.4	L184 F185 T186 D218 R220	L184-V287 HydrophobicContact CD2-CB 4.13Å; L184-V287 HydrophobicContact CD2-CG2 3.92Å; F185-V287 CarbonylContact O-C 3.59Å; F185-V287 VanDerWaalsContact O-CA 3.3Å; F185-V287 WeakPolarHBondContact O-CA 3.46Å; T186-V287 HydrophobicContact CG2-CG1 4.07Å; T186-V287 WeakPolarHBondContact OG1-CG1 3.4Å; D218-V287 HydrophobicContact CB-CG2 3.91Å; D218-V287 PolarHBondContact N-O 2.93Å; D218-V287 PolarHBondContact O-N 2.8Å; R220-V287 HydrophobicContact CG-CG1 3.95Å; R220-V287 HydrophobicContact CG-CG2 3.92Å
288	Y	92.8	Very high	81.7	Confident	6 Å²	6	62.9 Å²	62.9	2%	0.024	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	155.6	170.5	70.1	-90.9	0	0	0	111.9	F185 F187 I206 I215 I216 F290	F185-Y288 HydrophobicContact CB-CD1 3.9Å; F185-Y288 HydrophobicContact CB-CD2 4.08Å; F185-Y288 HydrophobicContact CB-CE1 3.47Å; F185-Y288 VanDerWaalsContact CB-CE1 3.47Å; F185-Y288 HydrophobicContact CB-CE2 3.66Å; F185-Y288 HydrophobicContact CB-CG 4.19Å; F185-Y288 HydrophobicContact CD2-CD2 4Å; F185-Y288 AromaticContact CD2-CE2 3.59Å; F185-Y288 HydrophobicContact CD2-CE2 3.59Å; F185-Y288 HydrophobicContact CE2-CE2 4.42Å; F185-Y288 HydrophobicContact CG-CD2 4.38Å; F185-Y288 HydrophobicContact CG-CE1 4.39Å; F185-Y288 AromaticContact CG-CE2 3.75Å; F185-Y288 HydrophobicContact CG-CE2 3.75Å; F185-Y288 AromaticContact CG-CZ 3.76Å; F185-Y288 PolarHBondContact N-O 2.88Å; F185-Y288 WeakPolarHBondContact O-CD1 3.41Å; F185-Y288 PolarHBondContact O-N 3.49Å; F187-Y288 AromaticContact CD1-CD1 3.85Å; F187-Y288 HydrophobicContact CD1-CD1 3.85Å; F187-Y288 HydrophobicContact CD1-CE1 4.15Å; F187-Y288 AromaticContact CE1-CD1 3.94Å; F187-Y288 HydrophobicContact CE1-CD1 3.94Å; I206-Y288 HydrophobicContact CD1-CD1 3.67Å; I206-Y288 HydrophobicContact CD1-CD2 4.29Å; I206-Y288 HydrophobicContact CD1-CE1 3.88Å; I206-Y288 HydrophobicContact CD1-CE2 4.48Å; I206-Y288 HydrophobicContact CD1-CG 3.88Å; I206-Y288 HydrophobicContact CG1-CE1 4.24Å; I206-Y288 HydrophobicContact CG2-CD2 3.76Å; I206-Y288 HydrophobicContact CG2-CE2 3.49Å; I206-Y288 VanDerWaalsContact CG2-CE2 3.49Å; I206-Y288 HydrophobicContact CG2-CG 4.43Å; I215-Y288 HydrophobicContact CG2-CD2 4.37Å; I216-Y288 CarbonylContact O-C 3.56Å; I216-Y288 WeakPolarHBondContact O-CA 3.35Å; I216-Y288 WeakPolarHBondContact O-CB 3.45Å; Y288-F290 HydrophobicContact CD2-CE1 4.08Å; Y288-F290 HydrophobicContact CD2-CZ 4.31Å; Y288-F290 AromaticContact CE2-CE1 3.94Å; Y288-F290 HydrophobicContact CE2-CE1 3.94Å; Y288-F290 AromaticContact CE2-CZ 3.78Å; Y288-F290 HydrophobicContact CE2-CZ 3.78Å
289	Y	92.2	Very high	79.1	Confident	49 Å²	49	67 Å²	67	19%	0.192	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	159.2	174.3	60.2	-81.7	0	0	0	110.7	P182 L184 I216	P182-Y289 HydrophobicContact CB-CD2 3.83Å; P182-Y289 HydrophobicContact CB-CG 4.2Å; P182-Y289 HydrophobicContact CG-CD2 4.26Å; L184-Y289 HydrophobicContact CD2-CD1 3.7Å; L184-Y289 HydrophobicContact CD2-CG 4.25Å; I216-Y289 HydrophobicContact CB-CD1 4.34Å; I216-Y289 HydrophobicContact CB-CD2 4.41Å; I216-Y289 HydrophobicContact CB-CE1 3.88Å; I216-Y289 HydrophobicContact CB-CE2 3.97Å; I216-Y289 HydrophobicContact CD1-CE2 3.86Å; I216-Y289 HydrophobicContact CG1-CE2 4.18Å; I216-Y289 HydrophobicContact CG2-CE1 3.89Å; I216-Y289 HydrophobicContact CG2-CE2 4.45Å; I216-Y289 PolarHBondContact N-O 3.08Å; I216-Y289 PolarHBondContact O-N 2.96Å
290	F	92.9	Very high	76.6	Confident	31 Å²	31	67.3 Å²	67.3	14%	0.136	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.2	139.6	178.6	-47.7	-55.9	0	0	0	110.6	F185 I206 A208 P209 Q213 I215 Y288	F185-F290 HydrophobicContact CD2-CE2 4.26Å; F185-F290 HydrophobicContact CD2-CZ 4.48Å; F185-F290 HydrophobicContact CE2-CD2 4.08Å; F185-F290 AromaticContact CE2-CE2 3.47Å; F185-F290 HydrophobicContact CE2-CE2 3.47Å; F185-F290 VanDerWaalsContact CE2-CE2 3.47Å; F185-F290 HydrophobicContact CE2-CZ 4.08Å; F185-F290 HydrophobicContact CZ-CE2 4Å; I206-F290 HydrophobicContact CG2-CE1 4.01Å; A208-F290 HydrophobicContact CB-CD1 3.63Å; A208-F290 HydrophobicContact CB-CE1 4.01Å; A208-F290 HydrophobicContact CB-CG 4.21Å; P209-F290 VanDerWaalsContact CD-CD2 3.47Å; P209-F290 VanDerWaalsContact CD-CE2 3.4Å; P209-F290 HydrophobicContact CG-CD2 4.15Å; P209-F290 HydrophobicContact CG-CE2 3.93Å; Q213-F290 HydrophobicContact CB-CB 4.49Å; I215-F290 HydrophobicContact CG1-CD1 3.94Å; I215-F290 HydrophobicContact CG1-CE1 4.03Å; Y288-F290 HydrophobicContact CD2-CE1 4.08Å; Y288-F290 HydrophobicContact CD2-CZ 4.31Å; Y288-F290 AromaticContact CE2-CE1 3.94Å; Y288-F290 HydrophobicContact CE2-CE1 3.94Å; Y288-F290 AromaticContact CE2-CZ 3.78Å; Y288-F290 HydrophobicContact CE2-CZ 3.78Å
291	S	88.2	Confident	74	Confident	43 Å²	43	68.4 Å²	68.4	30%	0.301	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	141.7	178.6	-170.9	0	0	0	0	108.9	Q213 Q214 L293	Q213-S291 CarbonylContact C-O 3.59Å; Q213-S291 VanDerWaalsContact CA-O 3.25Å; Q213-S291 WeakPolarHBondContact CA-O 3.25Å; Q214-S291 WeakPolarHBondContact CG-O 3.2Å; Q214-S291 PolarHBondContact N-O 3.04Å; Q214-S291 PolarHBondContact O-N 2.95Å; S291-L293 PolarHBondContact O-N 2.59Å
292	K	85	Confident	71.7	Confident	119 Å²	119	73.1 Å²	73.1	52%	0.517	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.7	139.2	176	-80.7	-179.3	177.7	-78.5	0	110.7	D212 Q213 R294	D212-K292 CarbonylContact O-C 3.23Å; D212-K292 WeakPolarHBondContact O-CA 3.41Å; D212-K292 IonicContact OD1-NZ 2.81Å; D212-K292 IonicContact OD2-NZ 3.64Å; D212-K292 PolarHBondContact OD2-NZ 2.94Å; Q213-K292 HydrophobicContact CG-CG 4.43Å; K292-R294 PolarHBondContact O-N 3.33Å
293	L	78.1	Confident	69.8	Low	67 Å²	67	75.9 Å²	75.9	35%	0.351	38%	0.38	S	S	.	.	P	Polyproline II helix	trans	-59.4	132.2	161.7	-67	172.2	0	0	0	107.7	D212 Q214 T265 S291	D212-L293 PolarHBondContact O-N 2.84Å; Q214-L293 HydrophobicContact CB-CD2 3.78Å; Q214-L293 HydrophobicContact CG-CD2 4.09Å; T265-L293 WeakPolarHBondContact O-CD2 3.37Å; S291-L293 PolarHBondContact O-N 2.59Å
294	R	65.8	Low	68	Low	184 Å²	184	77 Å²	77	69%	0.694	39%	0.387	S	S	*	.	P	Polyproline II helix	trans	-82.2	125.7	175.3	-55.4	-176	-164.8	179.3	4.5	107.7	K292 I296	K292-R294 PolarHBondContact O-N 3.33Å; R294-I296 PolarHBondContact O-N 3.47Å
295	N	54.1	Low	66.6	Low	113 Å²	113	80.8 Å²	80.8	60%	0.604	41%	0.407	S	S	*	.	P	Polyproline II helix	trans	-60.9	131.5	164.9	-91.5	-18.1	0	0	0	108.4	D297 E298	N295-D297 PolarHBondContact O-N 2.83Å; N295-E298 HydrophobicContact CB-CB 3.93Å; N295-E298 PolarHBondContact O-N 2.95Å
296	I	56	Low	65.5	Low	101 Å²	101	78.4 Å²	78.4	52%	0.518	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-26.8	177.1	-66.7	172.8	0	0	0	110.2	R294 P398 I399	R294-I296 PolarHBondContact O-N 3.47Å; I296-P398 HydrophobicContact CD1-CG 4.31Å; I296-P398 HydrophobicContact CG2-CG 3.7Å; I296-I399 HydrophobicContact CD1-CD1 4.26Å; I296-I399 HydrophobicContact CD1-CG1 4.39Å
297	D	46.5	Very low	64.6	Low	147 Å²	147	82.1 Å²	82.1	79%	0.786	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-10.3	177.6	-44.8	-63.7	0	0	0	113.8	N295 P299	N295-D297 PolarHBondContact O-N 2.83Å; D297-P299 WeakPolarHBondContact O-CD 3.4Å
298	E	41.5	Very low	63.9	Low	132 Å²	132	83.4 Å²	83.4	62%	0.617	43%	0.427	S	S	*	.	S	Bend	trans	-85.2	113.4	172.4	-172.4	172.8	-167.4	0	0	108.4	N295 L300	N295-E298 HydrophobicContact CB-CB 3.93Å; N295-E298 PolarHBondContact O-N 2.95Å; E298-L300 PolarHBondContact O-N 2.87Å
299	P	34.2	Very low	63.1	Low	114 Å²	114	86.3 Å²	86.3	74%	0.74	45%	0.446	S	S	*	.			trans	-62.3	115.3	-178.9	25.6	-33.1	0	0	0	108.4	D297	D297-P299 WeakPolarHBondContact O-CD 3.4Å
300	L	41.8	Very low	62.5	Low	102 Å²	102	85.6 Å²	85.6	53%	0.534	45%	0.445	S	S	.	.			trans	-42.3	130.2	177	-71.3	172.3	0	0	0	108.8	E298 Q302	E298-L300 PolarHBondContact O-N 2.87Å; L300-Q302 WeakPolarHBondContact O-CG 3.15Å; L300-Q302 PolarHBondContact O-N 2.74Å
301	P	38.3	Very low	61.7	Low	98 Å²	98	88.2 Å²	88.2	64%	0.636	46%	0.459	S	S	*	.			trans	-62.9	95.5	175.3	25.5	-33	0	0	0	107	K303	P301-K303 PolarHBondContact O-N 2.67Å
302	Q	46.5	Very low	61.3	Low	154 Å²	154	86.5 Å²	86.5	72%	0.72	45%	0.447	S	S	*	.			trans	-60.8	107.1	-174.9	-67.6	-175.2	2.2	0	0	106.4	L300 R344	L300-Q302 WeakPolarHBondContact O-CG 3.15Å; L300-Q302 PolarHBondContact O-N 2.74Å; Q302-R344 PolarHBondContact O-NH1 2.92Å
303	K	52.7	Low	60.4	Low	65 Å²	65	84.1 Å²	84.1	28%	0.283	44%	0.439	S	S	.	.			trans	-57.5	132.5	160.9	-77.1	-169.4	177.3	-172.4	0	105.9	P301 I305 L345 E347	P301-K303 PolarHBondContact O-N 2.67Å; K303-I305 VanDerWaalsContact C-N 3.31Å; K303-I305 HydrophobicContact CB-CG1 4.32Å; K303-I305 WeakPolarHBondContact O-CG1 3.05Å; K303-I305 PolarHBondContact O-N 2.79Å; K303-L345 HydrophobicContact CD-CB 4.33Å; K303-E347 WeakPolarHBondContact CD-OE2 3.04Å; K303-E347 IonicContact NZ-OE2 3.19Å
304	P	56.3	Low	60.1	Low	23 Å²	23	85.6 Å²	85.6	15%	0.149	45%	0.448	C	S	.	.			trans	-56	98.3	164.5	21.4	-32	0	0	0	109.4	Y330 R344 I346 E347	P304-Y330 VanDerWaalsContact CA-OH 3.24Å; P304-Y330 WeakPolarHBondContact CA-OH 3.32Å; P304-Y330 HydrophobicContact CB-CE1 3.76Å; P304-Y330 WeakPolarHBondContact CB-OH 3.48Å; P304-R344 HydrophobicContact CG-CB 4.07Å; P304-I346 HydrophobicContact CB-CG1 3.92Å; P304-I346 HydrophobicContact CG-CB 4.34Å; P304-I346 HydrophobicContact CG-CD1 4.29Å; P304-I346 HydrophobicContact CG-CG1 3.31Å; P304-E347 PolarHBondContact O-N 2.8Å
305	I	62.9	Low	60.7	Low	80 Å²	80	83.4 Å²	83.4	41%	0.41	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	123.1	178.1	-68.7	159	0	0	0	107.9	K303 T307 E347 I349	K303-I305 VanDerWaalsContact C-N 3.31Å; K303-I305 HydrophobicContact CB-CG1 4.32Å; K303-I305 WeakPolarHBondContact O-CG1 3.05Å; K303-I305 PolarHBondContact O-N 2.79Å; I305-T307 WeakPolarHBondContact CG2-OG1 3.47Å; I305-E347 CarbonylContact C-O 3.55Å; I305-E347 VanDerWaalsContact CA-O 3.26Å; I305-E347 WeakPolarHBondContact CA-O 3.5Å; I305-E347 HydrophobicContact CG1-CB 4Å; I305-E347 HydrophobicContact CG1-CG 4.31Å; I305-I349 HydrophobicContact CG2-CD1 3.82Å; I305-I349 HydrophobicContact CG2-CG1 4.28Å
306	V	68.3	Low	61.8	Low	13 Å²	13	80.4 Å²	80.4	8%	0.079	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	88.7	177.6	-170.2	0	0	0	0	108	Y330 I346 E347 V348 I349	V306-Y330 HydrophobicContact CB-CG 4.45Å; V306-Y330 HydrophobicContact CG1-CD2 4.33Å; V306-Y330 HydrophobicContact CG1-CG 4.22Å; V306-Y330 HydrophobicContact CG2-CD1 3.42Å; V306-Y330 VanDerWaalsContact CG2-CD1 3.42Å; V306-Y330 HydrophobicContact CG2-CD2 3.82Å; V306-Y330 HydrophobicContact CG2-CE1 3.68Å; V306-Y330 HydrophobicContact CG2-CE2 4.07Å; V306-Y330 HydrophobicContact CG2-CG 3.49Å; V306-Y330 VanDerWaalsContact CG2-CG 3.49Å; V306-I346 HydrophobicContact CG2-CG2 4.23Å; V306-E347 PolarHBondContact N-O 2.96Å; V306-V348 HydrophobicContact CB-CB 4.5Å; V306-V348 HydrophobicContact CB-CG1 4.33Å; V306-V348 HydrophobicContact CB-CG2 4.27Å; V306-V348 CarbonylContact O-C 3.6Å; V306-V348 WeakPolarHBondContact O-CA 3.38Å; V306-I349 PolarHBondContact O-N 3.14Å
307	T	71	Confident	63	Low	77 Å²	77	79.4 Å²	79.4	47%	0.472	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	132.1	176.4	-52.1	0	0	0	0	110.7	I305 I349	I305-T307 WeakPolarHBondContact CG2-OG1 3.47Å; T307-I349 CarbonylContact C-O 3.45Å; T307-I349 WeakPolarHBondContact CA-O 3.17Å; T307-I349 HydrophobicContact CG2-CB 4.35Å; T307-I349 HydrophobicContact CG2-CG2 4.39Å
308	T	76.1	Confident	64.6	Low	34 Å²	34	72.7 Å²	72.7	21%	0.209	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	153.9	171.2	-168.2	0	0	0	0	110.6	L326 I349 I350 D351	T308-L326 HydrophobicContact CG2-CD1 4Å; T308-L326 HydrophobicContact CG2-CD2 3.84Å; T308-I349 PolarHBondContact N-O 2.8Å; T308-I350 HydrophobicContact CG2-CB 4.27Å; T308-I350 HydrophobicContact CG2-CG1 4.04Å; T308-I350 HydrophobicContact CG2-CG2 3.98Å; T308-I350 WeakPolarHBondContact O-CA 3.39Å; T308-D351 PolarHBondContact O-N 2.87Å
309	T	76.1	Confident	66.6	Low	67 Å²	67	68.9 Å²	68.9	41%	0.411	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	128.1	177.6	-54.6	0	0	0	0	108.7	D351 R353	T309-D351 CarbonylContact C-O 3.6Å; T309-D351 WeakPolarHBondContact CA-O 3.46Å; T309-D351 HydrophobicContact CG2-CB 4.25Å; T309-D351 WeakPolarHBondContact CG2-O 3Å; T309-R353 HydrophobicContact CG2-CG 4.06Å
310	I	80.3	Confident	68.7	Low	33 Å²	33	65.2 Å²	65.2	17%	0.169	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	120.4	-177.2	-63.5	178.7	0	0	0	108.6	I312 M316 F318 I350 D351 F352 R353	I310-I312 HydrophobicContact CG2-CG1 4.11Å; I310-M316 HydrophobicContact CG2-CE 3.95Å; I310-M316 HydrophobicContact CG2-SD 3.65Å; I310-F318 HydrophobicContact CD1-CD2 4.25Å; I310-F318 HydrophobicContact CD1-CE2 4.15Å; I310-I350 HydrophobicContact CD1-CG2 3.81Å; I310-I350 HydrophobicContact CG1-CG2 4.26Å; I310-D351 PolarHBondContact N-O 2.99Å; I310-F352 HydrophobicContact CB-CD1 3.78Å; I310-F352 HydrophobicContact CB-CE1 3.88Å; I310-F352 HydrophobicContact CD1-CE1 3.87Å; I310-F352 HydrophobicContact CG1-CE1 4.37Å; I310-F352 HydrophobicContact CG2-CD1 4.03Å; I310-F352 HydrophobicContact CG2-CE1 4.06Å; I310-F352 WeakPolarHBondContact O-CA 3.39Å; I310-R353 PolarHBondContact O-N 2.82Å
311	I	76.9	Confident	70.6	Confident	86 Å²	86	65.9 Å²	65.9	44%	0.441	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	134.1	177	-61.8	167.8	0	0	0	108.6	R353 N355	I311-R353 CarbonylContact C-O 3.56Å; I311-R353 WeakPolarHBondContact CA-O 3.39Å; I311-N355 HydrophobicContact CG2-CB 4.14Å
312	I	78.2	Confident	72.8	Confident	7 Å²	7	63.6 Å²	63.6	4%	0.036	33%	0.326	C	S	.	.			trans	-128.9	123	-175.5	-56.8	176.9	0	0	0	109.3	I310 N314 M316 F352 R353 L361 I477 A479	I310-I312 HydrophobicContact CG2-CG1 4.11Å; I312-N314 WeakPolarHBondContact CG2-O 3.05Å; I312-M316 HydrophobicContact CD1-CB 4.3Å; I312-M316 HydrophobicContact CD1-CE 4.1Å; I312-M316 HydrophobicContact CG1-CB 4.45Å; I312-M316 HydrophobicContact CG2-CB 4.49Å; I312-F352 HydrophobicContact CD1-CB 4.38Å; I312-F352 HydrophobicContact CD1-CD1 3.7Å; I312-F352 HydrophobicContact CD1-CE1 4.38Å; I312-F352 HydrophobicContact CD1-CG 4.34Å; I312-R353 PolarHBondContact N-O 2.82Å; I312-L361 HydrophobicContact CB-CD2 4.08Å; I312-L361 HydrophobicContact CD1-CD2 4.35Å; I312-L361 HydrophobicContact CG2-CD2 4.29Å; I312-I477 HydrophobicContact CD1-CB 3.84Å; I312-I477 HydrophobicContact CD1-CD1 4.03Å; I312-I477 HydrophobicContact CD1-CG2 3.46Å; I312-I477 VanDerWaalsContact CD1-CG2 3.46Å; I312-A479 HydrophobicContact CG2-CB 4.34Å
313	D	67.8	Low	74.3	Confident	69 Å²	69	56.3 Å²	56.3	37%	0.369	29%	0.292	S	S	.	.	S	Bend	trans	-105.6	-17.3	178.2	-64.7	-57.7	0	0	0	113.9	L359	D313-L359 WeakPolarHBondContact O-CD1 3.43Å
314	N	71.7	Confident	75.4	Confident	99 Å²	99	56.5 Å²	56.5	53%	0.529	30%	0.295	S	S	.	.	S	Bend	trans	-145.7	-119.3	176.6	-69.7	-84.1	0	0	0	109.1	I312 A479	I312-N314 WeakPolarHBondContact CG2-O 3.05Å; N314-A479 WeakPolarHBondContact O-CB 3.49Å; N314-A479 PolarHBondContact O-N 2.83Å
315	E	77.2	Confident	76.6	Confident	137 Å²	137	61.6 Å²	61.6	64%	0.64	32%	0.315	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-101.8	145.3	175.4	-56.7	-157.5	125.6	0	0	112.2	I477 T478	E315-I477 CarbonylContact C-O 3.49Å; E315-I477 WeakPolarHBondContact CA-O 3.46Å; E315-T478 HydrophobicContact CG-CG2 4Å; E315-T478 WeakPolarHBondContact OE1-CB 3.36Å; E315-T478 VanDerWaalsContact OE1-CG2 3.24Å; E315-T478 WeakPolarHBondContact OE1-CG2 3.37Å; E315-T478 PolarHBondContact OE1-OG1 2.84Å
316	M	78.5	Confident	77.4	Confident	50 Å²	50	59.3 Å²	59.3	25%	0.246	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	141.4	171.4	-165.2	-167.6	65.2	0	0	110.3	I310 I312 F318 F352 I477	I310-M316 HydrophobicContact CG2-CE 3.95Å; I310-M316 HydrophobicContact CG2-SD 3.65Å; I312-M316 HydrophobicContact CD1-CB 4.3Å; I312-M316 HydrophobicContact CD1-CE 4.1Å; I312-M316 HydrophobicContact CG1-CB 4.45Å; I312-M316 HydrophobicContact CG2-CB 4.49Å; M316-F318 HydrophobicContact CE-CB 3.9Å; M316-F318 HydrophobicContact CE-CD2 4.44Å; M316-F352 HydrophobicContact CE-CD1 4.36Å; M316-F352 HydrophobicContact CE-CE1 3.63Å; M316-F352 HydrophobicContact CE-CZ 4.41Å; M316-I477 HydrophobicContact CE-CD1 4.21Å; M316-I477 PolarHBondContact N-O 2.85Å; M316-I477 PolarHBondContact O-N 3.04Å
317	I	80.2	Confident	77.6	Confident	81 Å²	81	59.7 Å²	59.7	42%	0.415	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.9	116.7	169.2	-50.7	-175.3	0	0	0	108.1	E319 K474 I475 I476	I317-E319 HydrophobicContact CG2-CG 3.71Å; I317-K474 HydrophobicContact CG2-CD 4.33Å; I317-K474 HydrophobicContact CG2-CG 4.13Å; I317-I475 WeakPolarHBondContact CA-O 3.42Å; I317-I476 HydrophobicContact CG1-CG1 4.22Å; I317-I476 HydrophobicContact CG2-CG1 4.15Å
318	F	80.6	Confident	77.8	Confident	6 Å²	6	59.1 Å²	59.1	3%	0.026	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100	120.4	174.6	-174.3	-94.7	0	0	0	109.2	I310 M316 D322 L323 L326 I350 I473 I475	I310-F318 HydrophobicContact CD1-CD2 4.25Å; I310-F318 HydrophobicContact CD1-CE2 4.15Å; M316-F318 HydrophobicContact CE-CB 3.9Å; M316-F318 HydrophobicContact CE-CD2 4.44Å; F318-D322 HydrophobicContact CD2-CB 3.73Å; F318-D322 HydrophobicContact CE2-CB 3.61Å; F318-D322 HydrophobicContact CG-CB 4.39Å; F318-D322 HydrophobicContact CZ-CB 4.19Å; F318-L323 HydrophobicContact CE1-CB 4.33Å; F318-L323 HydrophobicContact CZ-CB 4.35Å; F318-L326 HydrophobicContact CE2-CD1 3.84Å; F318-L326 HydrophobicContact CZ-CD1 3.77Å; F318-I350 HydrophobicContact CE1-CD1 3.68Å; F318-I350 HydrophobicContact CE2-CD1 4.26Å; F318-I350 HydrophobicContact CZ-CD1 3.53Å; F318-I473 HydrophobicContact CD1-CD1 4.06Å; F318-I473 HydrophobicContact CE1-CD1 3.74Å; F318-I475 HydrophobicContact CB-CB 4.33Å; F318-I475 HydrophobicContact CD1-CD1 4.12Å; F318-I475 HydrophobicContact CD1-CG1 4.37Å; F318-I475 PolarHBondContact N-O 2.66Å; F318-I475 PolarHBondContact O-N 2.82Å
319	E	82.7	Confident	77.8	Confident	52 Å²	52	61.1 Å²	61.1	24%	0.243	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	169.7	-174	-55.5	-174.7	132.8	0	0	111.3	I317 K321 D322 L323 I473 K474	I317-E319 HydrophobicContact CG2-CG 3.71Å; E319-K321 HydrophobicContact CB-CD 4.23Å; E319-K321 HydrophobicContact CB-CG 4.23Å; E319-K321 PolarHBondContact O-N 2.97Å; E319-K321 WeakPolarHBondContact OE2-CE 3.4Å; E319-K321 IonicContact OE2-NZ 2.84Å; E319-K321 PolarHBondContact OE2-NZ 3.46Å; E319-D322 PolarHBondContact N-OD2 2.85Å; E319-D322 WeakPolarHBondContact O-CB 3.27Å; E319-D322 PolarHBondContact O-N 3.05Å; E319-L323 PolarHBondContact O-N 2.84Å; E319-I473 CarbonylContact C-O 3.58Å; E319-I473 WeakPolarHBondContact CA-O 3.32Å; E319-K474 HydrophobicContact CG-CD 4.39Å; E319-K474 HydrophobicContact CG-CG 4.35Å; E319-K474 WeakPolarHBondContact OE1-CD 3.4Å; E319-K474 WeakPolarHBondContact OE1-CE 3.47Å; E319-K474 IonicContact OE1-NZ 3.19Å; E319-K474 PolarHBondContact OE1-NZ 3.2Å
320	T	78.2	Confident	77.5	Confident	36 Å²	36	60.1 Å²	60.1	22%	0.221	30%	0.296	C	S	.	.	H	α-helix	trans	-45.7	-35.4	176.5	-41.7	0	0	0	0	113.8	D322 L323 I324 P471 E472 I473	T320-D322 VanDerWaalsContact C-N 3.28Å; T320-D322 PolarHBondContact O-N 3.27Å; T320-L323 PolarHBondContact O-N 2.95Å; T320-I324 HydrophobicContact CG2-CD1 3.99Å; T320-I324 HydrophobicContact CG2-CG1 4.49Å; T320-I324 WeakPolarHBondContact O-CB 3.45Å; T320-I324 WeakPolarHBondContact O-CD1 3.49Å; T320-I324 VanDerWaalsContact O-CG1 3.23Å; T320-I324 WeakPolarHBondContact O-CG1 3.23Å; T320-I324 PolarHBondContact O-N 3.29Å; T320-P471 WeakPolarHBondContact CG2-O 3.25Å; T320-E472 WeakPolarHBondContact OG1-CA 3.27Å; T320-I473 PolarHBondContact N-O 3.5Å; T320-I473 PolarHBondContact OG1-N 3.32Å; T320-I473 PolarHBondContact OG1-O 2.9Å
321	K	81.4	Confident	76.8	Confident	116 Å²	116	60.4 Å²	60.4	50%	0.504	30%	0.299	S	S	.	.	H	α-helix	trans	-60.6	-34.2	177.7	75.5	-161.6	178.6	-163.6	0	113.1	E319 K325	E319-K321 HydrophobicContact CB-CD 4.23Å; E319-K321 HydrophobicContact CB-CG 4.23Å; E319-K321 PolarHBondContact O-N 2.97Å; E319-K321 WeakPolarHBondContact OE2-CE 3.4Å; E319-K321 IonicContact OE2-NZ 2.84Å; E319-K321 PolarHBondContact OE2-NZ 3.46Å; K321-K325 PolarHBondContact O-N 2.95Å
322	D	84.7	Confident	76.4	Confident	50 Å²	50	61.3 Å²	61.3	27%	0.267	30%	0.302	S	S	.	.	H	α-helix	trans	-82.9	-35	-175.5	-50.3	-59.5	0	0	0	109.8	F318 E319 T320 K325 L326	F318-D322 HydrophobicContact CD2-CB 3.73Å; F318-D322 HydrophobicContact CE2-CB 3.61Å; F318-D322 HydrophobicContact CG-CB 4.39Å; F318-D322 HydrophobicContact CZ-CB 4.19Å; E319-D322 PolarHBondContact N-OD2 2.85Å; E319-D322 WeakPolarHBondContact O-CB 3.27Å; E319-D322 PolarHBondContact O-N 3.05Å; T320-D322 VanDerWaalsContact C-N 3.28Å; T320-D322 PolarHBondContact O-N 3.27Å; D322-K325 PolarHBondContact O-N 2.69Å; D322-L326 PolarHBondContact O-N 3.35Å
323	L	77.7	Confident	75.9	Confident	2 Å²	2	64.4 Å²	64.4	1%	0.01	32%	0.321	C	S	.	.	H	α-helix	trans	-62.9	-43.9	166.4	-173.2	70.2	0	0	0	111.9	F318 E319 T320 K325 L326 W327 V348 I444 I446 L470 P471 I473	F318-L323 HydrophobicContact CE1-CB 4.33Å; F318-L323 HydrophobicContact CZ-CB 4.35Å; E319-L323 PolarHBondContact O-N 2.84Å; T320-L323 PolarHBondContact O-N 2.95Å; L323-K325 VanDerWaalsContact C-N 3.28Å; L323-K325 PolarHBondContact O-N 3.45Å; L323-L326 PolarHBondContact O-N 2.87Å; L323-W327 WeakPolarHBondContact O-CB 3.46Å; L323-W327 PolarHBondContact O-N 2.83Å; L323-V348 HydrophobicContact CD1-CG1 4.25Å; L323-V348 HydrophobicContact CD1-CG2 4.27Å; L323-I444 HydrophobicContact CD1-CD1 4.19Å; L323-I446 HydrophobicContact CD2-CD1 4.22Å; L323-L470 HydrophobicContact CD2-CD2 4.27Å; L323-P471 HydrophobicContact CD2-CG 4.01Å; L323-I473 HydrophobicContact CB-CD1 4.19Å; L323-I473 HydrophobicContact CD2-CD1 3.88Å; L323-I473 HydrophobicContact CD2-CG1 4.36Å; L323-I473 HydrophobicContact CG-CD1 4.47Å
324	I	76.9	Confident	75.6	Confident	69 Å²	69	63 Å²	63	35%	0.354	31%	0.314	S	S	.	.	H	α-helix	trans	-60	-38.8	173.6	-71.7	161.2	0	0	0	110.8	T320 W327 N328 L470	T320-I324 HydrophobicContact CG2-CD1 3.99Å; T320-I324 HydrophobicContact CG2-CG1 4.49Å; T320-I324 WeakPolarHBondContact O-CB 3.45Å; T320-I324 WeakPolarHBondContact O-CD1 3.49Å; T320-I324 VanDerWaalsContact O-CG1 3.23Å; T320-I324 WeakPolarHBondContact O-CG1 3.23Å; T320-I324 PolarHBondContact O-N 3.29Å; I324-W327 WeakPolarHBondContact O-CB 3.41Å; I324-W327 PolarHBondContact O-N 3.35Å; I324-N328 PolarHBondContact O-N 3.3Å; I324-N328 PolarHBondContact O-ND2 3.39Å; I324-N328 PolarHBondContact O-OD1 2.92Å; I324-L470 HydrophobicContact CB-CD1 4.36Å; I324-L470 HydrophobicContact CG1-CD1 3.65Å
325	K	82.3	Confident	75.1	Confident	130 Å²	130	63.5 Å²	63.5	57%	0.565	32%	0.315	S	S	*	.	H	α-helix	trans	-64.8	-52.8	176.2	-167.1	-156.8	168	-158.3	0	111.6	K321 D322 L323 W327 N328 D329	K321-K325 PolarHBondContact O-N 2.95Å; D322-K325 PolarHBondContact O-N 2.69Å; L323-K325 VanDerWaalsContact C-N 3.28Å; L323-K325 PolarHBondContact O-N 3.45Å; K325-W327 PolarHBondContact O-N 3.09Å; K325-N328 PolarHBondContact O-N 2.83Å; K325-D329 WeakPolarHBondContact CE-OD2 3.18Å; K325-D329 IonicContact NZ-OD2 2.69Å; K325-D329 VanDerWaalsContact O-CG 3.29Å; K325-D329 PolarHBondContact O-N 3.21Å
326	L	78.9	Confident	74.3	Confident	31 Å²	31	63.9 Å²	63.9	16%	0.162	31%	0.314	C	S	.	.	H	α-helix	trans	-55.4	-39	176.7	-78	161.5	0	0	0	112.2	T308 F318 D322 L323 Y330	T308-L326 HydrophobicContact CG2-CD1 4Å; T308-L326 HydrophobicContact CG2-CD2 3.84Å; F318-L326 HydrophobicContact CE2-CD1 3.84Å; F318-L326 HydrophobicContact CZ-CD1 3.77Å; D322-L326 PolarHBondContact O-N 3.35Å; L323-L326 PolarHBondContact O-N 2.87Å; L326-Y330 WeakPolarHBondContact O-CB 3.47Å; L326-Y330 PolarHBondContact O-N 3.4Å; L326-Y330 VanDerWaalsContact O-N 3.13Å
327	W	72.9	Confident	73.3	Confident	22 Å²	22	66.1 Å²	66.1	8%	0.083	33%	0.331	C	S	.	.	H	α-helix	trans	-61.5	-50.5	173.2	178.8	-78.8	0	0	0	112.3	L323 I324 K325 Y330 T331 I346 I467 L470	L323-W327 WeakPolarHBondContact O-CB 3.46Å; L323-W327 PolarHBondContact O-N 2.83Å; I324-W327 WeakPolarHBondContact O-CB 3.41Å; I324-W327 PolarHBondContact O-N 3.35Å; K325-W327 PolarHBondContact O-N 3.09Å; W327-Y330 WeakPolarHBondContact O-CB 3.45Å; W327-Y330 PolarHBondContact O-N 3.06Å; W327-T331 HydrophobicContact CZ2-CG2 4.39Å; W327-T331 VanDerWaalsContact NE1-CG2 3.31Å; W327-T331 PolarHBondContact O-N 2.88Å; W327-T331 PolarHBondContact O-OG1 3.15Å; W327-I346 HydrophobicContact CE3-CG2 4.39Å; W327-I346 HydrophobicContact CH2-CD1 3.16Å; W327-I346 HydrophobicContact CH2-CG1 4.39Å; W327-I346 HydrophobicContact CZ2-CD1 3.99Å; W327-I346 HydrophobicContact CZ3-CB 4.15Å; W327-I346 HydrophobicContact CZ3-CD1 3.54Å; W327-I346 HydrophobicContact CZ3-CG1 4.38Å; W327-I346 HydrophobicContact CZ3-CG2 3.85Å; W327-I467 HydrophobicContact CH2-CD1 4.27Å; W327-I467 HydrophobicContact CZ2-CD1 3.34Å; W327-L470 HydrophobicContact CB-CD1 4.03Å; W327-L470 HydrophobicContact CD2-CD1 4.28Å; W327-L470 HydrophobicContact CD2-CD2 4.33Å; W327-L470 HydrophobicContact CE3-CD1 4.49Å; W327-L470 HydrophobicContact CE3-CD2 3.77Å; W327-L470 HydrophobicContact CG-CD1 4.04Å; W327-L470 HydrophobicContact CZ3-CD2 4.09Å
328	N	75.2	Confident	71.9	Confident	64 Å²	64	71.1 Å²	71.1	34%	0.342	35%	0.35	S	S	.	.	H	α-helix	trans	-61.9	-47.7	-178.2	-69	-16.9	0	0	0	111.2	I324 K325 Y330 T331 E332	I324-N328 PolarHBondContact O-N 3.3Å; I324-N328 PolarHBondContact O-ND2 3.39Å; I324-N328 PolarHBondContact O-OD1 2.92Å; K325-N328 PolarHBondContact O-N 2.83Å; N328-Y330 PolarHBondContact O-N 2.91Å; N328-T331 WeakPolarHBondContact CA-OG1 3.33Å; N328-T331 PolarHBondContact O-N 2.89Å; N328-T331 VanDerWaalsContact O-N 3.11Å; N328-T331 PolarHBondContact O-OG1 2.85Å; N328-E332 PolarHBondContact O-N 3.48Å
329	D	75.6	Confident	70.4	Confident	77 Å²	77	73.3 Å²	73.3	41%	0.412	37%	0.366	S	S	.	.	H	α-helix	trans	-55.9	-37.2	176.5	-64.6	-18.1	0	0	0	111.3	K325 T333	K325-D329 WeakPolarHBondContact CE-OD2 3.18Å; K325-D329 IonicContact NZ-OD2 2.69Å; K325-D329 VanDerWaalsContact O-CG 3.29Å; K325-D329 PolarHBondContact O-N 3.21Å; D329-T333 PolarHBondContact O-N 2.85Å; D329-T333 PolarHBondContact O-OG1 2.89Å; D329-T333 VanDerWaalsContact O-OG1 3.05Å
330	Y	70.6	Confident	68.6	Low	46 Å²	46	78.3 Å²	78.3	18%	0.18	39%	0.389	C	S	.	.	H	α-helix	trans	-73.6	-43	174.5	-175.3	-112.4	0	0	0	113.6	P304 V306 L326 W327 N328 E332 T333 L334	P304-Y330 VanDerWaalsContact CA-OH 3.24Å; P304-Y330 WeakPolarHBondContact CA-OH 3.32Å; P304-Y330 HydrophobicContact CB-CE1 3.76Å; P304-Y330 WeakPolarHBondContact CB-OH 3.48Å; V306-Y330 HydrophobicContact CB-CG 4.45Å; V306-Y330 HydrophobicContact CG1-CD2 4.33Å; V306-Y330 HydrophobicContact CG1-CG 4.22Å; V306-Y330 HydrophobicContact CG2-CD1 3.42Å; V306-Y330 VanDerWaalsContact CG2-CD1 3.42Å; V306-Y330 HydrophobicContact CG2-CD2 3.82Å; V306-Y330 HydrophobicContact CG2-CE1 3.68Å; V306-Y330 HydrophobicContact CG2-CE2 4.07Å; V306-Y330 HydrophobicContact CG2-CG 3.49Å; V306-Y330 VanDerWaalsContact CG2-CG 3.49Å; L326-Y330 WeakPolarHBondContact O-CB 3.47Å; L326-Y330 PolarHBondContact O-N 3.4Å; L326-Y330 VanDerWaalsContact O-N 3.13Å; W327-Y330 WeakPolarHBondContact O-CB 3.45Å; W327-Y330 PolarHBondContact O-N 3.06Å; N328-Y330 PolarHBondContact O-N 2.91Å; Y330-E332 VanDerWaalsContact C-N 3.32Å; Y330-E332 PolarHBondContact O-N 3.08Å; Y330-T333 WeakPolarHBondContact CA-OG1 3.26Å; Y330-T333 PolarHBondContact O-N 2.82Å; Y330-T333 VanDerWaalsContact O-N 3.11Å; Y330-T333 PolarHBondContact O-OG1 3.17Å; Y330-L334 HydrophobicContact CD1-CD1 3.95Å; Y330-L334 HydrophobicContact CD1-CG 4.29Å; Y330-L334 HydrophobicContact CE1-CD1 3.46Å; Y330-L334 VanDerWaalsContact CE1-CD1 3.46Å; Y330-L334 HydrophobicContact CE1-CD2 4.29Å; Y330-L334 HydrophobicContact CE1-CG 3.87Å; Y330-L334 HydrophobicContact CE2-CD2 4.49Å; Y330-L334 HydrophobicContact CE2-CG 4.44Å; Y330-L334 PolarHBondContact O-N 2.88Å
331	T	64.9	Low	67	Low	39 Å²	39	81.7 Å²	81.7	24%	0.239	41%	0.411	C	S	.	.	H	α-helix	trans	-64.9	-35.5	176.7	52.9	0	0	0	0	112.6	W327 N328 T333 L334 I335	W327-T331 HydrophobicContact CZ2-CG2 4.39Å; W327-T331 VanDerWaalsContact NE1-CG2 3.31Å; W327-T331 PolarHBondContact O-N 2.88Å; W327-T331 PolarHBondContact O-OG1 3.15Å; N328-T331 WeakPolarHBondContact CA-OG1 3.33Å; N328-T331 PolarHBondContact O-N 2.89Å; N328-T331 VanDerWaalsContact O-N 3.11Å; N328-T331 PolarHBondContact O-OG1 2.85Å; T331-T333 VanDerWaalsContact C-N 3.28Å; T331-T333 PolarHBondContact O-N 2.89Å; T331-L334 PolarHBondContact O-N 3.3Å; T331-I335 WeakPolarHBondContact O-CB 3.02Å; T331-I335 WeakPolarHBondContact O-CD1 3.18Å; T331-I335 VanDerWaalsContact O-CG1 3.23Å; T331-I335 WeakPolarHBondContact O-CG1 3.5Å; T331-I335 PolarHBondContact O-N 2.98Å
332	E	68.9	Low	65	Low	105 Å²	105	80.4 Å²	80.4	49%	0.491	41%	0.413	S	S	.	.	H	α-helix	trans	-60.5	-37.9	171.8	-85.4	-158.7	-153	0	0	112.2	N328 Y330 K336	N328-E332 PolarHBondContact O-N 3.48Å; Y330-E332 VanDerWaalsContact C-N 3.32Å; Y330-E332 PolarHBondContact O-N 3.08Å; E332-K336 WeakPolarHBondContact O-CB 3.36Å; E332-K336 VanDerWaalsContact O-CD 3.22Å; E332-K336 WeakPolarHBondContact O-CD 3.4Å; E332-K336 WeakPolarHBondContact O-CG 3.25Å; E332-K336 PolarHBondContact O-N 3.4Å; E332-K336 WeakPolarHBondContact OE2-CE 3.45Å; E332-K336 IonicContact OE2-NZ 4Å; E332-K336 PolarHBondContact OE2-NZ 3.35Å
333	T	66.4	Low	63.1	Low	72 Å²	72	85.4 Å²	85.4	44%	0.442	44%	0.44	S	S	.	.	H	α-helix	trans	-77.8	-31.6	179.3	41.2	0	0	0	0	113	D329 Y330 T331 T337	D329-T333 PolarHBondContact O-N 2.85Å; D329-T333 PolarHBondContact O-OG1 2.89Å; D329-T333 VanDerWaalsContact O-OG1 3.05Å; Y330-T333 WeakPolarHBondContact CA-OG1 3.26Å; Y330-T333 PolarHBondContact O-N 2.82Å; Y330-T333 VanDerWaalsContact O-N 3.11Å; Y330-T333 PolarHBondContact O-OG1 3.17Å; T331-T333 VanDerWaalsContact C-N 3.28Å; T331-T333 PolarHBondContact O-N 2.89Å; T333-T337 WeakPolarHBondContact O-CG2 3.28Å; T333-T337 PolarHBondContact O-N 3.35Å; T333-T337 PolarHBondContact O-OG1 2.88Å
334	L	61.9	Low	61.9	Low	40 Å²	40	90.6 Å²	90.6	21%	0.209	46%	0.459	C	S	.	.	H	α-helix	trans	-63	-47.5	167	-71.9	179.7	0	0	0	112.1	Y330 T331 K336 T337 K338 S339	Y330-L334 HydrophobicContact CD1-CD1 3.95Å; Y330-L334 HydrophobicContact CD1-CG 4.29Å; Y330-L334 HydrophobicContact CE1-CD1 3.46Å; Y330-L334 VanDerWaalsContact CE1-CD1 3.46Å; Y330-L334 HydrophobicContact CE1-CD2 4.29Å; Y330-L334 HydrophobicContact CE1-CG 3.87Å; Y330-L334 HydrophobicContact CE2-CD2 4.49Å; Y330-L334 HydrophobicContact CE2-CG 4.44Å; Y330-L334 PolarHBondContact O-N 2.88Å; T331-L334 PolarHBondContact O-N 3.3Å; L334-K336 VanDerWaalsContact C-N 3.34Å; L334-K336 PolarHBondContact O-N 3.14Å; L334-T337 WeakPolarHBondContact CA-OG1 3.29Å; L334-T337 PolarHBondContact O-N 3.11Å; L334-T337 VanDerWaalsContact O-N 3.08Å; L334-T337 PolarHBondContact O-OG1 3.05Å; L334-K338 PolarHBondContact O-N 2.62Å; L334-S339 VanDerWaalsContact CD2-OG 3.3Å; L334-S339 WeakPolarHBondContact CD2-OG 3.03Å; L334-S339 PolarHBondContact O-N 3.1Å; L334-S339 PolarHBondContact O-OG 3.09Å
335	I	60.9	Low	60.9	Low	109 Å²	109	89.2 Å²	89.2	56%	0.559	45%	0.452	S	S	*	.	H	α-helix	trans	-61.1	-43.9	178.7	-69.2	164.8	0	0	0	110.6	T331 T337 K338	T331-I335 WeakPolarHBondContact O-CB 3.02Å; T331-I335 WeakPolarHBondContact O-CD1 3.18Å; T331-I335 VanDerWaalsContact O-CG1 3.23Å; T331-I335 WeakPolarHBondContact O-CG1 3.5Å; T331-I335 PolarHBondContact O-N 2.98Å; I335-T337 PolarHBondContact O-N 2.96Å; I335-K338 PolarHBondContact O-N 3.22Å
336	K	59.9	Low	60.1	Low	145 Å²	145	83.8 Å²	83.8	63%	0.63	43%	0.429	S	S	*	.	H	α-helix	trans	-65	-20.1	176.2	-71.2	162.3	-163.6	169.1	0	113.9	E332 L334	E332-K336 WeakPolarHBondContact O-CB 3.36Å; E332-K336 VanDerWaalsContact O-CD 3.22Å; E332-K336 WeakPolarHBondContact O-CD 3.4Å; E332-K336 WeakPolarHBondContact O-CG 3.25Å; E332-K336 PolarHBondContact O-N 3.4Å; E332-K336 WeakPolarHBondContact OE2-CE 3.45Å; E332-K336 IonicContact OE2-NZ 4Å; E332-K336 PolarHBondContact OE2-NZ 3.35Å; L334-K336 VanDerWaalsContact C-N 3.34Å; L334-K336 PolarHBondContact O-N 3.14Å
337	T	59.3	Low	59.7	Low	97 Å²	97	83.3 Å²	83.3	60%	0.595	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.1	4.1	179.6	52.6	0	0	0	0	114.4	T333 L334 I335 S339	T333-T337 WeakPolarHBondContact O-CG2 3.28Å; T333-T337 PolarHBondContact O-N 3.35Å; T333-T337 PolarHBondContact O-OG1 2.88Å; L334-T337 WeakPolarHBondContact CA-OG1 3.29Å; L334-T337 PolarHBondContact O-N 3.11Å; L334-T337 VanDerWaalsContact O-N 3.08Å; L334-T337 PolarHBondContact O-OG1 3.05Å; I335-T337 PolarHBondContact O-N 2.96Å; T337-S339 PolarHBondContact O-N 2.98Å; T337-S339 VanDerWaalsContact O-N 3.16Å; T337-S339 PolarHBondContact OG1-OG 3.28Å; T337-S339 VanDerWaalsContact OG1-OG 3.1Å
338	K	49	Very low	59.8	Low	186 Å²	186	82.5 Å²	82.5	81%	0.809	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.4	27.3	-177	-66.6	-170.2	173.7	-171	0	114.5	L334 I335	L334-K338 PolarHBondContact O-N 2.62Å; I335-K338 PolarHBondContact O-N 3.22Å
339	S	49.2	Very low	59.9	Low	51 Å²	51	80.7 Å²	80.7	36%	0.357	41%	0.414	S	S	.	.			trans	-86.3	123.1	179.1	47	0	0	0	0	111.1	L334 T337	L334-S339 VanDerWaalsContact CD2-OG 3.3Å; L334-S339 WeakPolarHBondContact CD2-OG 3.03Å; L334-S339 PolarHBondContact O-N 3.1Å; L334-S339 PolarHBondContact O-OG 3.09Å; T337-S339 PolarHBondContact O-N 2.98Å; T337-S339 VanDerWaalsContact O-N 3.16Å; T337-S339 PolarHBondContact OG1-OG 3.28Å; T337-S339 VanDerWaalsContact OG1-OG 3.1Å
340	H	45.7	Very low	60.2	Low	157 Å²	157	77 Å²	77	73%	0.727	39%	0.394	S	S	*	.			trans	-70.7	127.3	-178.9	-81.8	-59.7	0	0	0	112	V342	H340-V342 HydrophobicContact CB-CG2 3.98Å; H340-V342 PolarHBondContact O-N 3.42Å
341	P	44.1	Very low	60.5	Low	108 Å²	108	75.3 Å²	75.3	70%	0.701	39%	0.388	S	S	*	.			trans	-80.3	67.8	174.6	34.8	-35.7	0	0	0	110.9	D343	P341-D343 PolarHBondContact O-N 3.21Å
342	V	40.3	Very low	61.2	Low	88 Å²	88	73.4 Å²	73.4	53%	0.533	38%	0.377	S	S	.	.			trans	-73.8	104.7	176	-176.3	0	0	0	0	109.6	H340 R344	H340-V342 HydrophobicContact CB-CG2 3.98Å; H340-V342 PolarHBondContact O-N 3.42Å; V342-R344 WeakPolarHBondContact O-CG 3.23Å; V342-R344 PolarHBondContact O-N 2.04Å
343	D	44.1	Very low	61.4	Low	156 Å²	156	72 Å²	72	83%	0.834	37%	0.367	S	S	*	.	S	Bend	trans	26	64.1	163.6	-60.8	-23.9	0	0	0	115.9	P341	P341-D343 PolarHBondContact O-N 3.21Å
344	R	52.8	Low	61.6	Low	111 Å²	111	70.5 Å²	70.5	42%	0.419	36%	0.357	S	S	.	.			trans	-125.3	133.1	-179	-82	164.2	-160.2	-154.2	6.6	112.4	Q302 P304 V342 I346	Q302-R344 PolarHBondContact O-NH1 2.92Å; P304-R344 HydrophobicContact CG-CB 4.07Å; V342-R344 WeakPolarHBondContact O-CG 3.23Å; V342-R344 PolarHBondContact O-N 2.04Å; R344-I346 PolarHBondContact O-N 3.31Å
345	L	56.1	Low	62	Low	40 Å²	40	74.1 Å²	74.1	21%	0.209	38%	0.377	C	S	.	.			trans	-49	124.1	160.4	-76.1	160.4	0	0	0	110.4	K303 N379	K303-L345 HydrophobicContact CD-CB 4.33Å; L345-N379 HydrophobicContact CD2-CB 4.01Å
346	I	65.2	Low	62.3	Low	16 Å²	16	72.9 Å²	72.9	8%	0.082	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	139.2	177	-74.9	156.4	0	0	0	109	P304 V306 W327 R344 V348 I446 P448	P304-I346 HydrophobicContact CB-CG1 3.92Å; P304-I346 HydrophobicContact CG-CB 4.34Å; P304-I346 HydrophobicContact CG-CD1 4.29Å; P304-I346 HydrophobicContact CG-CG1 3.31Å; V306-I346 HydrophobicContact CG2-CG2 4.23Å; W327-I346 HydrophobicContact CE3-CG2 4.39Å; W327-I346 HydrophobicContact CH2-CD1 3.16Å; W327-I346 HydrophobicContact CH2-CG1 4.39Å; W327-I346 HydrophobicContact CZ2-CD1 3.99Å; W327-I346 HydrophobicContact CZ3-CB 4.15Å; W327-I346 HydrophobicContact CZ3-CD1 3.54Å; W327-I346 HydrophobicContact CZ3-CG1 4.38Å; W327-I346 HydrophobicContact CZ3-CG2 3.85Å; R344-I346 PolarHBondContact O-N 3.31Å; I346-V348 HydrophobicContact CG2-CG2 4.28Å; I346-I446 PolarHBondContact N-O 3.18Å; I346-I446 PolarHBondContact O-N 3.2Å; I346-P448 HydrophobicContact CD1-CG 4.27Å
347	E	70.1	Confident	62.4	Low	21 Å²	21	70.4 Å²	70.4	10%	0.098	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	95.5	-170.1	-175.2	164.3	155.8	0	0	109.3	K303 P304 I305 V306 I349 R443 I444 L445	K303-E347 WeakPolarHBondContact CD-OE2 3.04Å; K303-E347 IonicContact NZ-OE2 3.19Å; P304-E347 PolarHBondContact O-N 2.8Å; I305-E347 CarbonylContact C-O 3.55Å; I305-E347 VanDerWaalsContact CA-O 3.26Å; I305-E347 WeakPolarHBondContact CA-O 3.5Å; I305-E347 HydrophobicContact CG1-CB 4Å; I305-E347 HydrophobicContact CG1-CG 4.31Å; V306-E347 PolarHBondContact N-O 2.96Å; E347-I349 HydrophobicContact CG-CG1 4.35Å; E347-R443 HydrophobicContact CG-CG 4.42Å; E347-R443 IonicContact OE1-CZ 2.62Å; E347-R443 IonicContact OE1-NE 3.27Å; E347-R443 PolarHBondContact OE1-NE 2.86Å; E347-R443 IonicContact OE1-NH2 2.71Å; E347-R443 PolarHBondContact OE1-NH2 2.97Å; E347-R443 IonicContact OE2-CZ 2.74Å; E347-R443 IonicContact OE2-NH2 2.67Å; E347-R443 PolarHBondContact OE2-NH2 3.09Å; E347-R443 VanDerWaalsContact OE2-NH2 3.08Å; E347-I444 WeakPolarHBondContact CA-O 3.39Å; E347-L445 HydrophobicContact CB-CD2 3.79Å; E347-L445 HydrophobicContact CG-CD2 3.71Å; E347-L445 WeakPolarHBondContact OE2-CD2 2.88Å
348	V	76.1	Confident	62.6	Low	5 Å²	5	69 Å²	69	3%	0.03	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	127.6	178.4	-170.5	0	0	0	0	108.6	V306 L323 I346 I350 R443 I444 I446	V306-V348 HydrophobicContact CB-CB 4.5Å; V306-V348 HydrophobicContact CB-CG1 4.33Å; V306-V348 HydrophobicContact CB-CG2 4.27Å; V306-V348 CarbonylContact O-C 3.6Å; V306-V348 WeakPolarHBondContact O-CA 3.38Å; L323-V348 HydrophobicContact CD1-CG1 4.25Å; L323-V348 HydrophobicContact CD1-CG2 4.27Å; I346-V348 HydrophobicContact CG2-CG2 4.28Å; V348-I350 HydrophobicContact CG1-CD1 4.42Å; V348-I350 HydrophobicContact CG1-CG1 4.05Å; V348-R443 CarbonylContact O-C 3.58Å; V348-R443 WeakPolarHBondContact O-CA 3.27Å; V348-I444 HydrophobicContact CB-CB 4.26Å; V348-I444 PolarHBondContact N-O 3.03Å; V348-I444 PolarHBondContact O-N 3.37Å; V348-I446 HydrophobicContact CG2-CD1 4.46Å
349	I	77.8	Confident	63.3	Low	26 Å²	26	61 Å²	61	13%	0.133	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	120	179.1	-57.8	-179.9	0	0	0	107.7	I305 V306 T307 T308 E347 I441 R443	I305-I349 HydrophobicContact CG2-CD1 3.82Å; I305-I349 HydrophobicContact CG2-CG1 4.28Å; V306-I349 PolarHBondContact O-N 3.14Å; T307-I349 CarbonylContact C-O 3.45Å; T307-I349 WeakPolarHBondContact CA-O 3.17Å; T307-I349 HydrophobicContact CG2-CB 4.35Å; T307-I349 HydrophobicContact CG2-CG2 4.39Å; T308-I349 PolarHBondContact N-O 2.8Å; E347-I349 HydrophobicContact CG-CG1 4.35Å; I349-I441 HydrophobicContact CG2-CG2 3.61Å; I349-R443 HydrophobicContact CG1-CG 4.43Å
350	I	81.7	Confident	63.9	Low	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	109	-176.9	-48	174.3	0	0	0	108.4	T308 I310 F318 V348 F352 I441 V442 I444	T308-I350 HydrophobicContact CG2-CB 4.27Å; T308-I350 HydrophobicContact CG2-CG1 4.04Å; T308-I350 HydrophobicContact CG2-CG2 3.98Å; T308-I350 WeakPolarHBondContact O-CA 3.39Å; I310-I350 HydrophobicContact CD1-CG2 3.81Å; I310-I350 HydrophobicContact CG1-CG2 4.26Å; F318-I350 HydrophobicContact CE1-CD1 3.68Å; F318-I350 HydrophobicContact CE2-CD1 4.26Å; F318-I350 HydrophobicContact CZ-CD1 3.53Å; V348-I350 HydrophobicContact CG1-CD1 4.42Å; V348-I350 HydrophobicContact CG1-CG1 4.05Å; I350-F352 HydrophobicContact CB-CE2 4.09Å; I350-F352 HydrophobicContact CB-CZ 4.15Å; I350-F352 HydrophobicContact CG2-CD1 4.18Å; I350-F352 HydrophobicContact CG2-CD2 4.21Å; I350-F352 HydrophobicContact CG2-CE1 3.57Å; I350-F352 HydrophobicContact CG2-CE2 3.62Å; I350-F352 HydrophobicContact CG2-CG 4.48Å; I350-F352 HydrophobicContact CG2-CZ 3.27Å; I350-I441 CarbonylContact O-C 3.6Å; I350-I441 WeakPolarHBondContact O-CA 3.3Å; I350-V442 HydrophobicContact CB-CB 4.48Å; I350-V442 PolarHBondContact N-O 3.21Å; I350-V442 PolarHBondContact O-N 3.03Å; I350-I444 HydrophobicContact CD1-CD1 4.16Å
351	D	77.1	Confident	64.8	Low	9 Å²	9	52.1 Å²	52.1	5%	0.048	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	106	178.1	177.9	-7.7	0	0	0	109.6	T308 T309 I310 R353 I441	T308-D351 PolarHBondContact O-N 2.87Å; T309-D351 CarbonylContact C-O 3.6Å; T309-D351 WeakPolarHBondContact CA-O 3.46Å; T309-D351 HydrophobicContact CG2-CB 4.25Å; T309-D351 WeakPolarHBondContact CG2-O 3Å; I310-D351 PolarHBondContact N-O 2.99Å; D351-R353 VanDerWaalsContact CG-NE 3.29Å; D351-R353 WeakPolarHBondContact OD1-CG 3.44Å; D351-R353 IonicContact OD1-NE 3.61Å; D351-R353 PolarHBondContact OD1-NE 3Å; D351-R353 VanDerWaalsContact OD1-NE 3.12Å; D351-R353 IonicContact OD2-CZ 2.87Å; D351-R353 IonicContact OD2-NE 3.53Å; D351-R353 PolarHBondContact OD2-NE 2.77Å; D351-R353 IonicContact OD2-NH2 2.75Å; D351-R353 PolarHBondContact OD2-NH2 3.39Å; D351-I441 HydrophobicContact CB-CG1 4.27Å
352	F	78.6	Confident	65.6	Low	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90	127.8	177.3	-63.6	-68.6	0	0	0	111	I310 I312 M316 I350 L361 I363 S440 V442 I477	I310-F352 HydrophobicContact CB-CD1 3.78Å; I310-F352 HydrophobicContact CB-CE1 3.88Å; I310-F352 HydrophobicContact CD1-CE1 3.87Å; I310-F352 HydrophobicContact CG1-CE1 4.37Å; I310-F352 HydrophobicContact CG2-CD1 4.03Å; I310-F352 HydrophobicContact CG2-CE1 4.06Å; I310-F352 WeakPolarHBondContact O-CA 3.39Å; I312-F352 HydrophobicContact CD1-CB 4.38Å; I312-F352 HydrophobicContact CD1-CD1 3.7Å; I312-F352 HydrophobicContact CD1-CE1 4.38Å; I312-F352 HydrophobicContact CD1-CG 4.34Å; M316-F352 HydrophobicContact CE-CD1 4.36Å; M316-F352 HydrophobicContact CE-CE1 3.63Å; M316-F352 HydrophobicContact CE-CZ 4.41Å; I350-F352 HydrophobicContact CB-CE2 4.09Å; I350-F352 HydrophobicContact CB-CZ 4.15Å; I350-F352 HydrophobicContact CG2-CD1 4.18Å; I350-F352 HydrophobicContact CG2-CD2 4.21Å; I350-F352 HydrophobicContact CG2-CE1 3.57Å; I350-F352 HydrophobicContact CG2-CE2 3.62Å; I350-F352 HydrophobicContact CG2-CG 4.48Å; I350-F352 HydrophobicContact CG2-CZ 3.27Å; F352-L361 HydrophobicContact CB-CD1 3.84Å; F352-L361 WeakPolarHBondContact O-CD1 3.39Å; F352-I363 HydrophobicContact CD2-CD1 3.99Å; F352-S440 WeakPolarHBondContact CB-O 3.43Å; F352-S440 PolarHBondContact N-O 3.02Å; F352-S440 PolarHBondContact O-N 3.31Å; F352-S440 VanDerWaalsContact O-N 3.11Å; F352-V442 HydrophobicContact CD2-CG2 3.91Å; F352-V442 HydrophobicContact CE2-CB 4.03Å; F352-V442 HydrophobicContact CE2-CG2 3.62Å; F352-I477 HydrophobicContact CD1-CD1 3.6Å; F352-I477 HydrophobicContact CD2-CD1 3.66Å; F352-I477 HydrophobicContact CE1-CD1 3.41Å; F352-I477 VanDerWaalsContact CE1-CD1 3.41Å; F352-I477 HydrophobicContact CE2-CD1 3.47Å; F352-I477 VanDerWaalsContact CE2-CD1 3.47Å; F352-I477 HydrophobicContact CG-CD1 3.71Å; F352-I477 HydrophobicContact CZ-CD1 3.33Å
353	R	73.1	Confident	67.1	Low	75 Å²	75	44.3 Å²	44.3	28%	0.283	23%	0.227	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	154.8	-175.9	-54.4	-172	-177.8	175.2	3.6	111.8	T309 I310 I311 I312 D351 R439	T309-R353 HydrophobicContact CG2-CG 4.06Å; I310-R353 PolarHBondContact O-N 2.82Å; I311-R353 CarbonylContact C-O 3.56Å; I311-R353 WeakPolarHBondContact CA-O 3.39Å; I312-R353 PolarHBondContact N-O 2.82Å; D351-R353 VanDerWaalsContact CG-NE 3.29Å; D351-R353 WeakPolarHBondContact OD1-CG 3.44Å; D351-R353 IonicContact OD1-NE 3.61Å; D351-R353 PolarHBondContact OD1-NE 3Å; D351-R353 VanDerWaalsContact OD1-NE 3.12Å; D351-R353 IonicContact OD2-CZ 2.87Å; D351-R353 IonicContact OD2-NE 3.53Å; D351-R353 PolarHBondContact OD2-NE 2.77Å; D351-R353 IonicContact OD2-NH2 2.75Å; D351-R353 PolarHBondContact OD2-NH2 3.39Å; R353-R439 HydrophobicContact CG-CG 4.2Å
354	T	71.4	Confident	68.1	Low	40 Å²	40	38.1 Å²	38.1	25%	0.245	19%	0.193	C	C	.	.			trans	-101.9	150.8	161.2	59.4	0	0	0	0	109.4	Q356 L359 L361	T354-Q356 PolarHBondContact OG1-O 3.41Å; T354-L359 HydrophobicContact CG2-CB 3.65Å; T354-L361 HydrophobicContact CG2-CD2 3.58Å; T354-L361 HydrophobicContact CG2-CG 3.83Å
355	N	69.6	Low	68.6	Low	116 Å²	116	33.8 Å²	33.8	62%	0.62	18%	0.178	S	C	*	.	S	Bend	trans	-89.9	-5.7	167.4	-85.2	-2.1	0	0	0	112.9	I311	I311-N355 HydrophobicContact CG2-CB 4.14Å
356	Q	66.5	Low	69	Low	83 Å²	83	36.2 Å²	36.2	39%	0.388	19%	0.187	S	C	.	.			trans	-110.2	126.1	-177.8	-58	178.4	32.6	0	0	110	T354 D358 L359	T354-Q356 PolarHBondContact OG1-O 3.41Å; Q356-D358 PolarHBondContact O-N 3.02Å; Q356-D358 VanDerWaalsContact O-N 3.17Å; Q356-L359 HydrophobicContact CB-CB 4.25Å; Q356-L359 HydrophobicContact CB-CD1 3.84Å; Q356-L359 HydrophobicContact CB-CG 3.82Å; Q356-L359 HydrophobicContact CG-CD1 4.02Å; Q356-L359 HydrophobicContact CG-CG 4.47Å; Q356-L359 PolarHBondContact O-N 3.39Å; Q356-L359 VanDerWaalsContact O-N 3.14Å
357	S	63.6	Low	68.8	Low	93 Å²	93	38.6 Å²	38.6	65%	0.65	20%	0.197	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.7	-35.4	170.3	40.4	0	0	0	0	113	L359 K482	S357-L359 VanDerWaalsContact C-N 3.3Å; S357-L359 PolarHBondContact O-N 3.42Å; S357-K482 VanDerWaalsContact O-CE 3.31Å; S357-K482 WeakPolarHBondContact O-CE 3.2Å; S357-K482 PolarHBondContact O-NZ 2.78Å
358	D	63.1	Low	68.5	Low	68 Å²	68	38 Å²	38	36%	0.364	20%	0.195	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.2	-5.8	-172.9	-57.2	23.5	0	0	0	113.1	Q356 K481 K482	Q356-D358 PolarHBondContact O-N 3.02Å; Q356-D358 VanDerWaalsContact O-N 3.17Å; D358-K481 HydrophobicContact CB-CG 4.27Å; D358-K481 VanDerWaalsContact CB-NZ 3.31Å; D358-K481 CarbonylContact O-C 3.16Å; D358-K481 WeakPolarHBondContact O-CA 3.48Å; D358-K481 IonicContact OD2-NZ 3.38Å; D358-K481 PolarHBondContact OD2-NZ 3.48Å; D358-K482 WeakPolarHBondContact O-CG 3.39Å; D358-K482 PolarHBondContact O-N 2.81Å
359	L	63.5	Low	67.9	Low	18 Å²	18	42.5 Å²	42.5	9%	0.094	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	155.6	-175.9	-68.2	179.9	0	0	0	112.9	D313 T354 Q356 S357 A479 L480 K481 K482	D313-L359 WeakPolarHBondContact O-CD1 3.43Å; T354-L359 HydrophobicContact CG2-CB 3.65Å; Q356-L359 HydrophobicContact CB-CB 4.25Å; Q356-L359 HydrophobicContact CB-CD1 3.84Å; Q356-L359 HydrophobicContact CB-CG 3.82Å; Q356-L359 HydrophobicContact CG-CD1 4.02Å; Q356-L359 HydrophobicContact CG-CG 4.47Å; Q356-L359 PolarHBondContact O-N 3.39Å; Q356-L359 VanDerWaalsContact O-N 3.14Å; S357-L359 VanDerWaalsContact C-N 3.3Å; S357-L359 PolarHBondContact O-N 3.42Å; L359-A479 HydrophobicContact CB-CB 4.38Å; L359-A479 HydrophobicContact CD1-CB 4.06Å; L359-A479 HydrophobicContact CD2-CB 4.37Å; L359-L480 CarbonylContact C-O 3.55Å; L359-L480 VanDerWaalsContact CA-O 3.27Å; L359-L480 WeakPolarHBondContact CA-O 3.44Å; L359-L480 WeakPolarHBondContact CD2-O 3.27Å; L359-K481 HydrophobicContact CD2-CB 4.28Å; L359-K482 WeakPolarHBondContact O-CE 3.31Å
360	M	61	Low	67.1	Low	15 Å²	15	42.4 Å²	42.4	7%	0.074	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	124.8	-174.5	-78.5	-87.5	-77.4	0	0	109.4	K436 L437 A479 L480 K482 P491	M360-K436 HydrophobicContact CE-CG 4.1Å; M360-L437 HydrophobicContact CE-CD2 4.46Å; M360-L437 HydrophobicContact CE-CG 4.1Å; M360-L437 HydrophobicContact SD-CB 4.16Å; M360-L437 HydrophobicContact SD-CD2 3.39Å; M360-L437 WeakPolarHBondContact SD-CD2 3.38Å; M360-L437 HydrophobicContact SD-CG 3.55Å; M360-L437 VanDerWaalsContact SD-CG 3.55Å; M360-L437 PolarHBondContact SD-N 2.78Å; M360-A479 CarbonylContact O-C 3.54Å; M360-A479 VanDerWaalsContact O-CA 3.27Å; M360-A479 WeakPolarHBondContact O-CA 3.42Å; M360-L480 HydrophobicContact CB-CB 4.29Å; M360-L480 PolarHBondContact N-O 2.69Å; M360-L480 PolarHBondContact O-N 3.31Å; M360-K482 HydrophobicContact CG-CD 4.23Å; M360-K482 HydrophobicContact CG-CG 3.45Å; M360-K482 VanDerWaalsContact CG-CG 3.45Å; M360-K482 HydrophobicContact SD-CG 4.32Å; M360-P491 HydrophobicContact CE-CB 4.41Å
361	L	65.2	Low	65.9	Low	7 Å²	7	46.3 Å²	46.3	4%	0.037	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	128.9	176.8	-62.8	178.1	0	0	0	111.8	I312 F352 T354 I477 A479	I312-L361 HydrophobicContact CB-CD2 4.08Å; I312-L361 HydrophobicContact CD1-CD2 4.35Å; I312-L361 HydrophobicContact CG2-CD2 4.29Å; F352-L361 HydrophobicContact CB-CD1 3.84Å; F352-L361 WeakPolarHBondContact O-CD1 3.39Å; T354-L361 HydrophobicContact CG2-CD2 3.58Å; T354-L361 HydrophobicContact CG2-CG 3.83Å; L361-I477 HydrophobicContact CD2-CG2 4.14Å; L361-A479 HydrophobicContact CD2-CB 4.38Å
362	M	61.8	Low	64.6	Low	10 Å²	10	50.1 Å²	50.1	5%	0.049	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	126.2	167.8	179.4	-174.4	-69.4	0	0	108.5	H364 I434 I477 T478 L480	M362-H364 PolarHBondContact SD-NE2 2.99Å; M362-H364 VanDerWaalsContact SD-NE2 3.43Å; M362-I434 HydrophobicContact CE-CD1 4.05Å; M362-I434 HydrophobicContact CE-CG1 3.94Å; M362-I434 HydrophobicContact CE-CG2 4.01Å; M362-I434 HydrophobicContact SD-CG1 4.42Å; M362-I477 CarbonylContact O-C 3.58Å; M362-I477 VanDerWaalsContact O-CA 3.27Å; M362-I477 WeakPolarHBondContact O-CA 3.37Å; M362-T478 PolarHBondContact N-O 3.03Å; M362-T478 PolarHBondContact O-N 2.9Å; M362-L480 HydrophobicContact CE-CD1 3.57Å; M362-L480 HydrophobicContact CE-CG 4.42Å
363	I	70	Confident	63.4	Low	21 Å²	21	57.2 Å²	57.2	11%	0.108	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	124.3	-178.7	-61.6	-173.6	0	0	0	110.9	F352 I384 S440 V442 I475 I477	F352-I363 HydrophobicContact CD2-CD1 3.99Å; I363-I384 HydrophobicContact CG2-CD1 4.06Å; I363-S440 VanDerWaalsContact CD1-CB 3.47Å; I363-V442 HydrophobicContact CD1-CG2 4.2Å; I363-I475 HydrophobicContact CG2-CG2 3.58Å; I363-I477 HydrophobicContact CD1-CD1 4.28Å; I363-I477 HydrophobicContact CG1-CD1 4.27Å; I363-I477 HydrophobicContact CG1-CG1 4.08Å; I363-I477 HydrophobicContact CG1-CG2 3.98Å; I363-I477 HydrophobicContact CG2-CG1 4.41Å
364	H	64.9	Low	62.7	Low	26 Å²	26	54.5 Å²	54.5	12%	0.12	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	111.7	176	-68.5	-39.6	0	0	0	111.4	M362 K366 I475 I476	M362-H364 PolarHBondContact SD-NE2 2.99Å; M362-H364 VanDerWaalsContact SD-NE2 3.43Å; H364-K366 PolarHBondContact O-N 2.65Å; H364-I475 WeakPolarHBondContact O-CA 3.08Å; H364-I476 HydrophobicContact CB-CB 4.26Å; H364-I476 PolarHBondContact N-O 2.84Å; H364-I476 PolarHBondContact O-N 2.9Å
365	L	65.2	Low	61.7	Low	21 Å²	21	57.1 Å²	57.1	11%	0.11	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	97.3	166.9	-73.5	163.9	0	0	0	109.4	V368 I384 L430 I475	L365-V368 HydrophobicContact CD2-CG2 3.93Å; L365-I384 HydrophobicContact CD1-CD1 3.83Å; L365-I384 HydrophobicContact CG-CD1 4.23Å; L365-L430 HydrophobicContact CD1-CD1 4.45Å; L365-L430 HydrophobicContact CD1-CD2 4.21Å; L365-I475 HydrophobicContact CD2-CD1 4.39Å; L365-I475 HydrophobicContact CD2-CG1 4.11Å
366	K	63.2	Low	61.2	Low	91 Å²	91	56.2 Å²	56.2	40%	0.396	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	-37.8	-179.6	-172.7	175.8	-167.1	146.3	0	112.6	H364 K474 I476 Y504	H364-K366 PolarHBondContact O-N 2.65Å; K366-K474 HydrophobicContact CB-CB 4.41Å; K366-K474 HydrophobicContact CB-CG 4.25Å; K366-K474 HydrophobicContact CD-CD 4.33Å; K366-K474 PolarHBondContact N-O 2.91Å; K366-I476 HydrophobicContact CB-CD1 4.46Å; K366-I476 HydrophobicContact CD-CD1 4.18Å; K366-Y504 VanDerWaalsContact CD-OH 3.28Å; K366-Y504 WeakPolarHBondContact CD-OH 3.01Å; K366-Y504 WeakPolarHBondContact CE-OH 3.27Å; K366-Y504 PolarHBondContact NZ-OH 2.04Å
367	F	62.1	Low	61	Low	65 Å²	65	53.2 Å²	53.2	29%	0.285	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.3	133.2	-175.3	-169.5	-108.8	0	0	0	110	K369 Y429 E472 I473 K474	F367-K369 HydrophobicContact CD1-CB 4.47Å; F367-K369 HydrophobicContact CE1-CB 3.66Å; F367-K369 HydrophobicContact CE1-CD 4.42Å; F367-K369 HydrophobicContact CZ-CB 3.76Å; F367-K369 HydrophobicContact CZ-CD 3.99Å; F367-Y429 HydrophobicContact CD2-CE1 4.13Å; F367-E472 HydrophobicContact CD1-CB 4.31Å; F367-E472 HydrophobicContact CE1-CB 3.89Å; F367-E472 WeakPolarHBondContact CE1-OE2 3.45Å; F367-I473 CarbonylContact O-C 3.39Å; F367-I473 WeakPolarHBondContact O-CA 3.49Å; F367-K474 HydrophobicContact CB-CB 4.31Å; F367-K474 PolarHBondContact N-O 2.91Å; F367-K474 PolarHBondContact O-N 3.12Å
368	V	64	Low	60.8	Low	10 Å²	10	52.8 Å²	52.8	6%	0.061	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	118.1	170.5	178.1	0	0	0	0	107.3	L365 F370 I382 E472 I473	L365-V368 HydrophobicContact CD2-CG2 3.93Å; V368-F370 HydrophobicContact CG1-CD2 4.05Å; V368-F370 HydrophobicContact CG1-CE2 3.59Å; V368-F370 HydrophobicContact CG1-CZ 4.15Å; V368-I382 HydrophobicContact CB-CD1 4.46Å; V368-I382 HydrophobicContact CG1-CD1 3.75Å; V368-I382 HydrophobicContact CG2-CD1 3.78Å; V368-E472 CarbonylContact C-O 3.53Å; V368-E472 WeakPolarHBondContact CA-O 3.41Å; V368-I473 HydrophobicContact CG1-CG2 4.39Å; V368-I473 HydrophobicContact CG2-CG2 4.45Å
369	K	62.2	Low	60.6	Low	99 Å²	99	52.8 Å²	52.8	43%	0.43	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	102.2	174.6	167.7	166.4	156.3	-104.9	0	109.6	F367 E472	F367-K369 HydrophobicContact CD1-CB 4.47Å; F367-K369 HydrophobicContact CE1-CB 3.66Å; F367-K369 HydrophobicContact CE1-CD 4.42Å; F367-K369 HydrophobicContact CZ-CB 3.76Å; F367-K369 HydrophobicContact CZ-CD 3.99Å; K369-E472 HydrophobicContact CB-CB 4.2Å; K369-E472 WeakPolarHBondContact CD-OE2 3.45Å; K369-E472 PolarHBondContact N-O 2.86Å; K369-E472 IonicContact NZ-OE1 3.36Å; K369-E472 PolarHBondContact NZ-OE1 2.91Å; K369-E472 IonicContact NZ-OE2 3.73Å; K369-E472 PolarHBondContact NZ-OE2 3.36Å; K369-E472 PolarHBondContact O-N 3.26Å
370	F	61.7	Low	60.5	Low	24 Å²	24	52.6 Å²	52.6	11%	0.105	26%	0.258	C	S	.	.			trans	-69.1	142.7	165.3	-61.7	-82.8	0	0	0	109.3	V368 F372 N380 I382 P471	V368-F370 HydrophobicContact CG1-CD2 4.05Å; V368-F370 HydrophobicContact CG1-CE2 3.59Å; V368-F370 HydrophobicContact CG1-CZ 4.15Å; F370-F372 WeakPolarHBondContact CB-O 3.47Å; F370-F372 PolarHBondContact O-N 3.07Å; F370-N380 HydrophobicContact CB-CB 4.4Å; F370-N380 HydrophobicContact CD1-CB 3.5Å; F370-N380 HydrophobicContact CD2-CB 4.36Å; F370-N380 HydrophobicContact CE1-CB 3.75Å; F370-N380 HydrophobicContact CG-CB 3.84Å; F370-N380 HydrophobicContact CZ-CB 4.28Å; F370-I382 HydrophobicContact CZ-CD1 4.46Å; F370-I382 HydrophobicContact CZ-CG1 4.2Å; F370-P471 HydrophobicContact CD1-CB 3.69Å; F370-P471 HydrophobicContact CD1-CG 4.3Å; F370-P471 HydrophobicContact CE1-CB 4.04Å; F370-P471 HydrophobicContact CE1-CG 4.28Å; F370-P471 HydrophobicContact CG-CB 4.35Å
371	Q	55.8	Low	60.8	Low	82 Å²	82	52.3 Å²	52.3	38%	0.383	26%	0.256	S	S	.	.	S	Bend	trans	-72.2	-15.2	177.1	-66.4	-169.5	4.9	0	0	113.2	T468 K469	Q371-T468 PolarHBondContact NE2-O 2.69Å; Q371-K469 VanDerWaalsContact OE1-CG 3.24Å
372	F	51.3	Low	60.9	Low	88 Å²	88	52 Å²	52	39%	0.386	26%	0.255	S	S	.	.	S	Bend	trans	-131.1	129.1	174.8	-58.4	-76.7	0	0	0	109	F370 D374 N380 K469	F370-F372 WeakPolarHBondContact CB-O 3.47Å; F370-F372 PolarHBondContact O-N 3.07Å; F372-D374 PolarHBondContact O-N 2.99Å; F372-N380 PolarHBondContact O-ND2 3.03Å; F372-K469 HydrophobicContact CE2-CD 3.96Å; F372-K469 HydrophobicContact CZ-CD 4.18Å
373	I	52.4	Low	61.1	Low	150 Å²	150	52 Å²	52	77%	0.769	26%	0.255	S	S	*	.			trans	-74.2	119.5	172	-59.6	174.1	0	0	0	107.4	P375	I373-P375 WeakPolarHBondContact O-CD 3.37Å
374	D	59.2	Low	60.9	Low	18 Å²	18	51.7 Å²	51.7	10%	0.096	25%	0.253	C	S	.	.			trans	-106.6	95.3	172.4	172.3	9	0	0	0	107.7	F372 E376 C377 K378 N379 N380	F372-D374 PolarHBondContact O-N 2.99Å; D374-E376 PolarHBondContact O-N 2.81Å; D374-E376 VanDerWaalsContact O-N 3.15Å; D374-E376 PolarHBondContact OD1-N 2.88Å; D374-C377 PolarHBondContact O-N 2.87Å; D374-C377 VanDerWaalsContact O-N 3.11Å; D374-C377 PolarHBondContact OD1-N 3.4Å; D374-C377 VanDerWaalsContact OD1-N 3.14Å; D374-C377 VanDerWaalsContact OD2-C 3.32Å; D374-C377 WeakPolarHBondContact OD2-CA 3.08Å; D374-K378 PolarHBondContact OD2-N 3.37Å; D374-N379 WeakPolarHBondContact OD2-CA 3.46Å; D374-N379 WeakPolarHBondContact OD2-CB 3.38Å; D374-N379 PolarHBondContact OD2-N 2.75Å; D374-N380 HydrophobicContact CB-CB 3.97Å; D374-N380 PolarHBondContact OD2-N 2.87Å
375	P	50.4	Low	60.6	Low	94 Å²	94	51.9 Å²	51.9	61%	0.61	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.9	-21.2	-172	26.5	-34.5	0	0	0	113	I373 N426	I373-P375 WeakPolarHBondContact O-CD 3.37Å; P375-N426 PolarHBondContact O-ND2 3.04Å
376	E	58	Low	59.7	Low	98 Å²	98	52.2 Å²	52.2	46%	0.458	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	-6.5	-179.6	-56.3	179.5	116	0	0	113	Q181 D374 K378	Q181-E376 PolarHBondContact NE2-OE1 2.99Å; D374-E376 PolarHBondContact O-N 2.81Å; D374-E376 VanDerWaalsContact O-N 3.15Å; D374-E376 PolarHBondContact OD1-N 2.88Å; E376-K378 HydrophobicContact CB-CD 4.03Å; E376-K378 HydrophobicContact CB-CG 3.96Å; E376-K378 PolarHBondContact O-N 2.8Å; E376-K378 IonicContact OE1-NZ 2.75Å; E376-K378 PolarHBondContact OE1-NZ 2.72Å; E376-K378 WeakPolarHBondContact OE2-CD 3.45Å; E376-K378 VanDerWaalsContact OE2-CE 3.25Å; E376-K378 WeakPolarHBondContact OE2-CE 3.34Å; E376-K378 IonicContact OE2-NZ 3.27Å; E376-K378 PolarHBondContact OE2-NZ 3.4Å
377	C	62.7	Low	58.9	Low	20 Å²	20	51.8 Å²	51.8	14%	0.135	25%	0.254	C	S	.	.			trans	55.9	27.1	-179.9	-43.3	0	0	0	0	115	D374 L381 C425	D374-C377 PolarHBondContact O-N 2.87Å; D374-C377 VanDerWaalsContact O-N 3.11Å; D374-C377 PolarHBondContact OD1-N 3.4Å; D374-C377 VanDerWaalsContact OD1-N 3.14Å; D374-C377 VanDerWaalsContact OD2-C 3.32Å; D374-C377 WeakPolarHBondContact OD2-CA 3.08Å; C377-L381 HydrophobicContact CB-CD1 4.3Å; C377-C425 HydrophobicContact CB-CB 3.58Å; C377-C425 WeakPolarHBondContact CB-SG 3.34Å; C377-C425 WeakPolarHBondContact SG-CB 3.43Å; C377-C425 CovalentContact SG-SG 2.03Å; C377-C425 PolarHBondContact SG-SG 2.96Å
378	K	58.3	Low	57.4	Low	84 Å²	84	56.6 Å²	56.6	37%	0.365	28%	0.275	S	S	.	.	S	Bend	trans	-76.4	-30.6	-178.4	-70.1	174.7	-176.5	161.6	0	112.9	D374 E376	D374-K378 PolarHBondContact OD2-N 3.37Å; E376-K378 HydrophobicContact CB-CD 4.03Å; E376-K378 HydrophobicContact CB-CG 3.96Å; E376-K378 PolarHBondContact O-N 2.8Å; E376-K378 IonicContact OE1-NZ 2.75Å; E376-K378 PolarHBondContact OE1-NZ 2.72Å; E376-K378 WeakPolarHBondContact OE2-CD 3.45Å; E376-K378 VanDerWaalsContact OE2-CE 3.25Å; E376-K378 WeakPolarHBondContact OE2-CE 3.34Å; E376-K378 IonicContact OE2-NZ 3.27Å; E376-K378 PolarHBondContact OE2-NZ 3.4Å
379	N	59.4	Low	55.7	Low	67 Å²	67	61.9 Å²	61.9	36%	0.358	30%	0.298	S	S	.	.	S	Bend	trans	-122.7	-35.2	-163.7	-67.8	-27.5	0	0	0	113.1	L345 D374 L445 I446 S447	L345-N379 HydrophobicContact CD2-CB 4.01Å; D374-N379 WeakPolarHBondContact OD2-CA 3.46Å; D374-N379 WeakPolarHBondContact OD2-CB 3.38Å; D374-N379 PolarHBondContact OD2-N 2.75Å; N379-L445 CarbonylContact O-C 3.56Å; N379-I446 CarbonylContact O-C 3.49Å; N379-I446 PolarHBondContact O-N 3.44Å; N379-S447 PolarHBondContact O-N 2.87Å
380	N	61.7	Low	54	Low	15 Å²	15	61 Å²	61	8%	0.08	30%	0.298	C	S	.	.	S	Bend	trans	-120.1	102.5	178.5	-77.2	-17.5	0	0	0	109.4	F370 F372 D374 C425	F370-N380 HydrophobicContact CB-CB 4.4Å; F370-N380 HydrophobicContact CD1-CB 3.5Å; F370-N380 HydrophobicContact CD2-CB 4.36Å; F370-N380 HydrophobicContact CE1-CB 3.75Å; F370-N380 HydrophobicContact CG-CB 3.84Å; F370-N380 HydrophobicContact CZ-CB 4.28Å; F372-N380 PolarHBondContact O-ND2 3.03Å; D374-N380 HydrophobicContact CB-CB 3.97Å; D374-N380 PolarHBondContact OD2-N 2.87Å; N380-C425 WeakPolarHBondContact O-CB 3.45Å
381	L	67.4	Low	52.3	Low	8 Å²	8	63.9 Å²	63.9	4%	0.042	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.1	134.4	-173.3	175.8	63	0	0	0	111.5	C377 E383 K423 C425 I444 L445	C377-L381 HydrophobicContact CB-CD1 4.3Å; L381-E383 HydrophobicContact CD1-CG 4.16Å; L381-E383 HydrophobicContact CD2-CG 3.81Å; L381-E383 HydrophobicContact CG-CG 3.88Å; L381-K423 HydrophobicContact CD1-CB 3.67Å; L381-K423 HydrophobicContact CD1-CD 4.11Å; L381-K423 HydrophobicContact CD1-CG 3.82Å; L381-C425 HydrophobicContact CD1-CB 4.41Å; L381-I444 CarbonylContact O-C 3.53Å; L381-I444 WeakPolarHBondContact O-CA 3.39Å; L381-L445 HydrophobicContact CB-CB 4.28Å; L381-L445 HydrophobicContact CB-CD1 4.43Å; L381-L445 HydrophobicContact CD2-CD1 4.3Å; L381-L445 PolarHBondContact N-O 2.86Å; L381-L445 PolarHBondContact O-N 3.28Å
382	I	68.2	Low	50.8	Low	0 Å²	0	67.5 Å²	67.5	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	137.7	160.7	-64.8	166.8	0	0	0	108	V368 F370 K423 A424 V442 R443 I444 I473	V368-I382 HydrophobicContact CB-CD1 4.46Å; V368-I382 HydrophobicContact CG1-CD1 3.75Å; V368-I382 HydrophobicContact CG2-CD1 3.78Å; F370-I382 HydrophobicContact CZ-CD1 4.46Å; F370-I382 HydrophobicContact CZ-CG1 4.2Å; I382-K423 WeakPolarHBondContact O-CA 3.3Å; I382-A424 HydrophobicContact CB-CB 4.14Å; I382-A424 PolarHBondContact O-N 3.43Å; I382-V442 HydrophobicContact CG2-CG1 3.95Å; I382-R443 CarbonylContact C-O 3.52Å; I382-R443 VanDerWaalsContact CA-O 3.27Å; I382-R443 WeakPolarHBondContact CA-O 3.33Å; I382-I444 HydrophobicContact CG1-CB 4.49Å; I382-I444 HydrophobicContact CG1-CG1 4.23Å; I382-I444 HydrophobicContact CG1-CG2 3.99Å; I382-I473 HydrophobicContact CD1-CG2 4.25Å
383	E	65.9	Low	49.8	Very low	12 Å²	12	73.2 Å²	73.2	6%	0.056	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	134.7	170	-68.3	176.8	135.9	0	0	108.6	L381 Y385 V421 K423 R443	L381-E383 HydrophobicContact CD1-CG 4.16Å; L381-E383 HydrophobicContact CD2-CG 3.81Å; L381-E383 HydrophobicContact CG-CG 3.88Å; E383-Y385 HydrophobicContact CB-CE2 3.77Å; E383-Y385 PolarHBondContact OE2-OH 3.15Å; E383-V421 HydrophobicContact CB-CG1 3.91Å; E383-V421 HydrophobicContact CG-CG1 3.59Å; E383-V421 WeakPolarHBondContact OE1-CG1 3.38Å; E383-K423 HydrophobicContact CG-CG 4.39Å; E383-K423 IonicContact OE1-NZ 3.49Å; E383-K423 PolarHBondContact OE1-NZ 2.73Å; E383-R443 HydrophobicContact CB-CB 4.33Å; E383-R443 PolarHBondContact N-O 3.01Å; E383-R443 PolarHBondContact O-N 2.87Å; E383-R443 IonicContact OE2-CZ 3.08Å; E383-R443 IonicContact OE2-NE 3.52Å; E383-R443 IonicContact OE2-NH1 2.68Å; E383-R443 PolarHBondContact OE2-NH1 2.85Å
384	I	65	Low	48.5	Very low	13 Å²	13	74 Å²	74	7%	0.067	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	138.5	170.5	-54.1	-168.9	0	0	0	108	I363 L365 I441 V442	I363-I384 HydrophobicContact CG2-CD1 4.06Å; L365-I384 HydrophobicContact CD1-CD1 3.83Å; L365-I384 HydrophobicContact CG-CD1 4.23Å; I384-I441 CarbonylContact C-O 3.58Å; I384-I441 WeakPolarHBondContact CA-O 3.33Å; I384-V442 HydrophobicContact CD1-CG2 4.34Å; I384-V442 HydrophobicContact CG1-CG2 4.13Å; I384-V442 HydrophobicContact CG2-CG2 4.46Å
385	Y	57.8	Low	47.1	Very low	31 Å²	31	79.1 Å²	79.1	12%	0.122	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	137.9	178.2	-64.5	-89.9	0	0	0	111.7	E383 F389 V421 I441 R443	E383-Y385 HydrophobicContact CB-CE2 3.77Å; E383-Y385 PolarHBondContact OE2-OH 3.15Å; Y385-F389 HydrophobicContact CD1-CD2 4.17Å; Y385-F389 AromaticContact CD1-CE2 3.98Å; Y385-F389 HydrophobicContact CD1-CE2 3.98Å; Y385-F389 HydrophobicContact CE1-CD2 4.38Å; Y385-F389 AromaticContact CE1-CE2 3.82Å; Y385-F389 HydrophobicContact CE1-CE2 3.82Å; Y385-F389 HydrophobicContact CG-CD2 4.41Å; Y385-V421 HydrophobicContact CD1-CG2 4.3Å; Y385-V421 HydrophobicContact CE1-CG2 3.92Å; Y385-I441 PolarHBondContact N-O 3.37Å; Y385-I441 PolarHBondContact O-N 3.32Å; Y385-R443 HydrophobicContact CE2-CB 4.01Å
386	D	46.8	Very low	45.9	Very low	28 Å²	28	82 Å²	82	15%	0.15	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.6	95.3	-179.7	-56.4	-24.2	0	0	0	107.7	R420 H435	D386-R420 WeakPolarHBondContact OD2-CB 3.3Å; D386-R420 PolarHBondContact OD2-N 3.01Å; D386-H435 WeakPolarHBondContact CB-CE1 3.5Å; D386-H435 IonicContact OD1-CD2 3.58Å; D386-H435 IonicContact OD1-CE1 2.66Å; D386-H435 PolarHBondContact OD1-CE1 3.3Å; D386-H435 IonicContact OD1-CG 2.64Å; D386-H435 IonicContact OD1-ND1 2.69Å; D386-H435 PolarHBondContact OD1-ND1 3.49Å; D386-H435 IonicContact OD1-NE2 3.71Å; D386-H435 IonicContact OD2-CE1 3.32Å; D386-H435 IonicContact OD2-ND1 3.93Å
387	E	45.9	Very low	44.2	Very low	82 Å²	82	84.4 Å²	84.4	38%	0.383	42%	0.423	S	S	.	.	S	Bend	trans	59.3	172.8	-171.3	-57.7	-121.8	112.5	0	0	116.3	G438 R439	E387-G438 WeakPolarHBondContact OE1-CA 3.2Å; E387-R439 PolarHBondContact N-O 2.93Å; E387-R439 PolarHBondContact OE1-N 2.76Å
388	F	32.3	Very low	42.6	Very low	165 Å²	165	87 Å²	87	72%	0.724	44%	0.44	S	S	*	.			trans	45.1	72.1	172.7	-79.6	-85.3	0	0	0	119.4
389	F	27	Very low	40.9	Very low	121 Å²	121	89.5 Å²	89.5	53%	0.531	46%	0.456	S	S	.	.	S	Bend	trans	-128.2	146.7	131.5	-91.4	-90.1	0	0	0	110.2	Y385 I441	Y385-F389 HydrophobicContact CD1-CD2 4.17Å; Y385-F389 AromaticContact CD1-CE2 3.98Å; Y385-F389 HydrophobicContact CD1-CE2 3.98Å; Y385-F389 HydrophobicContact CE1-CD2 4.38Å; Y385-F389 AromaticContact CE1-CE2 3.82Å; Y385-F389 HydrophobicContact CE1-CE2 3.82Å; Y385-F389 HydrophobicContact CG-CD2 4.41Å; F389-I441 HydrophobicContact CB-CD1 3.73Å; F389-I441 WeakPolarHBondContact O-CD1 3.29Å
390	L	27.9	Very low	39.4	Very low	82 Å²	82	91.3 Å²	91.3	43%	0.429	47%	0.471	S	S	.	.			trans	62.1	63.8	173.7	-53.4	176	0	0	0	116.6	R393	L390-R393 HydrophobicContact CD2-CB 4.33Å
391	S	24.2	Very low	37.5	Very low	84 Å²	84	96.3 Å²	96.3	59%	0.587	51%	0.507	S	S	*	.	S	Bend	trans	-89.3	132.9	139.3	53.5	0	0	0	0	109
392	N	26.1	Very low	35.4	Very low	158 Å²	158	102.2 Å²	102.2	85%	0.845	54%	0.543	S	S	*	.			trans	50.6	96.4	179.3	-63.4	-0.2	0	0	0	116.4
393	R	29.5	Very low	33.4	Very low	208 Å²	208	110.3 Å²	110.3	79%	0.785	59%	0.586	S	S	*	*			trans	-134.9	29.2	163.1	-120.9	-175.8	-170.1	-169.9	3.7	115.9	L390 T395	L390-R393 HydrophobicContact CD2-CB 4.33Å; R393-T395 VanDerWaalsContact C-N 3.26Å; R393-T395 PolarHBondContact O-N 2.03Å
394	D	25.7	Very low	31.3	Very low	166 Å²	166	117.8 Å²	117.8	89%	0.888	63%	0.625	S	S	*	*			trans	-86.4	62.1	159.6	-71	-48.8	0	0	0	110.5
395	T	27.9	Very low	29.4	Very low	126 Å²	126	126.3 Å²	126.3	77%	0.773	66%	0.662	S	S	*	*			trans	-169.1	158.3	163.5	2.8	0	0	0	0	111.7	R393	R393-T395 VanDerWaalsContact C-N 3.26Å; R393-T395 PolarHBondContact O-N 2.03Å
396	I	25.6	Very low	27.8	Very low	153 Å²	153	136.8 Å²	136.8	79%	0.785	70%	0.701	S	S	*	*			trans	-129.6	147.7	-170.3	-74.5	170.8	0	0	0	109.5
397	L	22.6	Very low	26.8	Very low	150 Å²	150	140.4 Å²	140.4	79%	0.785	73%	0.729	S	S	*	*			trans	74.1	161.8	177.8	-68.3	159.9	0	0	0	117.1
398	P	29.3	Very low	25.7	Very low	74 Å²	74	146.6 Å²	146.6	48%	0.481	75%	0.754	S	S	.	*			trans	-126.2	-169.4	-156.8	36	-16	0	0	0	116	I296	I296-P398 HydrophobicContact CD1-CG 4.31Å; I296-P398 HydrophobicContact CG2-CG 3.7Å
399	I	22.6	Very low	25.5	Very low	137 Å²	137	143.8 Å²	143.8	70%	0.703	75%	0.751	S	S	*	*			trans	83.4	142	168.9	-43.5	149.8	0	0	0	113.3	I296	I296-I399 HydrophobicContact CD1-CD1 4.26Å; I296-I399 HydrophobicContact CD1-CG1 4.39Å
400	P	27.4	Very low	25.3	Very low	104 Å²	104	147.6 Å²	147.6	68%	0.675	77%	0.77	S	S	*	*			cis	-137.8	167.8	-48.9	41.5	-23.3	0	0	0	115.7	V402	P400-V402 PolarHBondContact O-N 3.45Å
401	S	22.6	Very low	25.2	Very low	121 Å²	121	149.8 Å²	149.8	85%	0.846	78%	0.781	S	S	*	*			trans	42.1	51.3	138.3	-50	0	0	0	0	123.4
402	V	23.4	Very low	25.1	Very low	132 Å²	132	151.5 Å²	151.5	80%	0.8	79%	0.79	S	S	*	*			trans	-144.9	118.4	148.3	-177.6	0	0	0	0	111	P400	P400-V402 PolarHBondContact O-N 3.45Å
403	L	24.9	Very low	25.2	Very low	169 Å²	169	152.1 Å²	152.1	89%	0.885	79%	0.791	S	S	*	*			trans	176.5	98.1	138.8	-101	167.4	0	0	0	110.8
404	L	23.4	Very low	24.9	Very low	169 Å²	169	149.7 Å²	149.7	89%	0.885	79%	0.794	S	S	*	*			trans	-135	91.3	174.5	-141.7	179.3	0	0	0	108.9
405	K	23.5	Very low	25.1	Very low	192 Å²	192	148 Å²	148	84%	0.835	78%	0.781	S	S	*	*			trans	-175.8	129.5	166.2	-109.1	155.9	-172.9	175.6	0	112.9
406	R	25.7	Very low	25.2	Very low	251 Å²	251	148.4 Å²	148.4	95%	0.947	77%	0.774	S	S	*	*			trans	68.9	145.8	176.9	-56.9	175	173.9	170.5	-3.9	113.3
407	S	25.8	Very low	25.4	Very low	105 Å²	105	148.7 Å²	148.7	73%	0.734	77%	0.77	S	S	*	*			cis	-98.5	164.8	8.5	51.1	0	0	0	0	114.9
408	K	23.1	Very low	25.9	Very low	212 Å²	212	144.5 Å²	144.5	92%	0.922	75%	0.751	S	S	*	*			trans	-92.3	115.9	157.4	-76.9	-174	174	-171.5	0	107.6
409	V	27	Very low	26.2	Very low	106 Å²	106	143.9 Å²	143.9	64%	0.642	75%	0.747	S	S	*	*			trans	-142.2	120.8	158.5	-177.3	0	0	0	0	106.2	I411	V409-I411 HydrophobicContact CG1-CG1 4.02Å; V409-I411 PolarHBondContact O-N 2.74Å
410	Q	23.8	Very low	27	Very low	201 Å²	201	143.6 Å²	143.6	94%	0.939	74%	0.737	S	S	*	*			trans	-81.9	98.5	172.2	-76.8	165.1	-81.7	0	0	108.3
411	I	24.9	Very low	28	Very low	127 Å²	127	141.2 Å²	141.2	65%	0.651	72%	0.72	S	S	*	*			trans	-92.8	134.9	161.5	-57.5	177.7	0	0	0	105.8	V409 I413	V409-I411 HydrophobicContact CG1-CG1 4.02Å; V409-I411 PolarHBondContact O-N 2.74Å; I411-I413 PolarHBondContact O-N 2.79Å
412	P	23.1	Very low	29.3	Very low	120 Å²	120	137.8 Å²	137.8	78%	0.779	69%	0.692	S	S	*	*			trans	-63.6	111	176.7	25.6	-33.5	0	0	0	110	N414	P412-N414 VanDerWaalsContact C-N 3.35Å; P412-N414 PolarHBondContact O-N 2.84Å
413	I	27	Very low	30.9	Very low	171 Å²	171	137 Å²	137	88%	0.877	68%	0.677	S	S	*	*			trans	-80.9	84.8	179	-54.3	179.1	0	0	0	108	I411	I411-I413 PolarHBondContact O-N 2.79Å
414	N	24	Very low	32.4	Very low	157 Å²	157	129 Å²	129	84%	0.84	64%	0.636	S	S	*	*			trans	-144.5	38.6	179.9	-137.2	15	0	0	0	114.3	P412	P412-N414 VanDerWaalsContact C-N 3.35Å; P412-N414 PolarHBondContact O-N 2.84Å
415	E	28.9	Very low	34.1	Very low	131 Å²	131	121.9 Å²	121.9	61%	0.612	60%	0.6	S	S	*	*			trans	-135.6	130.5	162.5	-92.9	-165.2	145.6	0	0	111.1	F417	E415-F417 HydrophobicContact CB-CD2 4.19Å; E415-F417 HydrophobicContact CB-CE2 3.82Å; E415-F417 PolarHBondContact O-N 2.5Å; E415-F417 WeakPolarHBondContact OE2-CE2 3.38Å
416	Q	30.3	Very low	35.2	Very low	135 Å²	135	117.2 Å²	117.2	63%	0.631	59%	0.585	S	S	*	*			trans	-88.1	87.3	-178.2	-69	-174.5	-6.8	0	0	111.8	T418	Q416-T418 VanDerWaalsContact C-N 3.31Å; Q416-T418 PolarHBondContact O-N 3.23Å
417	F	29.6	Very low	36.4	Very low	159 Å²	159	110.5 Å²	110.5	70%	0.697	56%	0.564	S	S	*	*			trans	-71.6	81.8	173.2	-79	-90	0	0	0	112.3	E415	E415-F417 HydrophobicContact CB-CD2 4.19Å; E415-F417 HydrophobicContact CB-CE2 3.82Å; E415-F417 PolarHBondContact O-N 2.5Å; E415-F417 WeakPolarHBondContact OE2-CE2 3.38Å
418	T	34.3	Very low	37.2	Very low	62 Å²	62	109.5 Å²	109.5	38%	0.38	56%	0.555	S	S	.	*			trans	-91.7	119.7	168.3	60.6	0	0	0	0	110	L259 Q416 R420	L259-T418 HydrophobicContact CD1-CG2 4.02Å; Q416-T418 VanDerWaalsContact C-N 3.31Å; Q416-T418 PolarHBondContact O-N 3.23Å; T418-R420 PolarHBondContact O-N 2.71Å
419	P	34.8	Very low	38.1	Very low	61 Å²	61	106.6 Å²	106.6	40%	0.396	54%	0.539	S	S	.	.			trans	-66.8	117.7	-179.2	26	-33.7	0	0	0	110.8	V421	P419-V421 VanDerWaalsContact C-N 3.35Å; P419-V421 PolarHBondContact O-N 3.23Å
420	R	40.5	Very low	39	Very low	131 Å²	131	103.4 Å²	103.4	49%	0.494	52%	0.518	S	S	.	.			trans	-82.1	78.3	-176.1	-69.1	-171.5	172.2	-166.8	2.1	112.2	D386 T418 L422	D386-R420 WeakPolarHBondContact OD2-CB 3.3Å; D386-R420 PolarHBondContact OD2-N 3.01Å; T418-R420 PolarHBondContact O-N 2.71Å; R420-L422 VanDerWaalsContact C-N 3.32Å; R420-L422 PolarHBondContact O-N 3.31Å
421	V	46.8	Very low	39.6	Very low	53 Å²	53	100.7 Å²	100.7	32%	0.321	51%	0.505	S	S	.	.			trans	-62.9	86.4	174.7	-175.3	0	0	0	0	111.4	E383 Y385 P419 K423	E383-V421 HydrophobicContact CB-CG1 3.91Å; E383-V421 HydrophobicContact CG-CG1 3.59Å; E383-V421 WeakPolarHBondContact OE1-CG1 3.38Å; Y385-V421 HydrophobicContact CD1-CG2 4.3Å; Y385-V421 HydrophobicContact CE1-CG2 3.92Å; P419-V421 VanDerWaalsContact C-N 3.35Å; P419-V421 PolarHBondContact O-N 3.23Å; V421-K423 HydrophobicContact CG1-CG 4Å; V421-K423 PolarHBondContact O-N 3.31Å; V421-K423 VanDerWaalsContact O-N 3.14Å
422	L	51.5	Low	40.2	Very low	50 Å²	50	97.1 Å²	97.1	26%	0.262	49%	0.491	S	S	.	.			trans	-74.7	96.2	176.2	-70.8	176.5	0	0	0	110.8	R420 A424 L430 F433	R420-L422 VanDerWaalsContact C-N 3.32Å; R420-L422 PolarHBondContact O-N 3.31Å; L422-A424 PolarHBondContact O-N 2.98Å; L422-L430 HydrophobicContact CB-CD2 4.39Å; L422-L430 HydrophobicContact CD1-CD2 4.28Å; L422-L430 HydrophobicContact CD2-CD2 4.27Å; L422-F433 HydrophobicContact CD1-CD1 3.84Å; L422-F433 HydrophobicContact CD1-CG 4.47Å
423	K	55.2	Low	41.1	Very low	114 Å²	114	93.8 Å²	93.8	50%	0.496	46%	0.464	S	S	.	.			trans	-81.7	98.2	179.7	-62.6	-167.2	-177.3	-94.8	0	112.2	L381 I382 E383 V421 C425	L381-K423 HydrophobicContact CD1-CB 3.67Å; L381-K423 HydrophobicContact CD1-CD 4.11Å; L381-K423 HydrophobicContact CD1-CG 3.82Å; I382-K423 WeakPolarHBondContact O-CA 3.3Å; E383-K423 HydrophobicContact CG-CG 4.39Å; E383-K423 IonicContact OE1-NZ 3.49Å; E383-K423 PolarHBondContact OE1-NZ 2.73Å; V421-K423 HydrophobicContact CG1-CG 4Å; V421-K423 PolarHBondContact O-N 3.31Å; V421-K423 VanDerWaalsContact O-N 3.14Å; K423-C425 VanDerWaalsContact C-N 3.29Å; K423-C425 PolarHBondContact O-N 2.9Å
424	A	57.7	Low	41.7	Very low	2 Å²	2	86.2 Å²	86.2	2%	0.017	43%	0.425	C	S	.	.	G	3₁₀ helix	trans	-83.2	17.1	-174.3	0	0	0	0	0	115.9	I382 L422 L430	I382-A424 HydrophobicContact CB-CB 4.14Å; I382-A424 PolarHBondContact O-N 3.43Å; L422-A424 PolarHBondContact O-N 2.98Å; A424-L430 HydrophobicContact CB-CD1 4.05Å
425	C	59.8	Low	42.6	Very low	20 Å²	20	80.5 Å²	80.5	14%	0.135	39%	0.393	C	S	.	.	G	3₁₀ helix	trans	-66.6	-37.6	-176.9	44.1	0	0	0	0	114.1	C377 N380 L381 K423	C377-C425 HydrophobicContact CB-CB 3.58Å; C377-C425 WeakPolarHBondContact CB-SG 3.34Å; C377-C425 WeakPolarHBondContact SG-CB 3.43Å; C377-C425 CovalentContact SG-SG 2.03Å; C377-C425 PolarHBondContact SG-SG 2.96Å; N380-C425 WeakPolarHBondContact O-CB 3.45Å; L381-C425 HydrophobicContact CD1-CB 4.41Å; K423-C425 VanDerWaalsContact C-N 3.29Å; K423-C425 PolarHBondContact O-N 2.9Å
426	N	46.1	Very low	43.1	Very low	94 Å²	94	78 Å²	78	50%	0.503	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-113	18	-168.6	-72.7	-19.7	0	0	0	114.1	P375	P375-N426 PolarHBondContact O-ND2 3.04Å
427	Q	50	Low	43.8	Very low	110 Å²	110	74.4 Å²	74.4	51%	0.514	37%	0.365	S	S	.	.			trans	-138	120.7	178.8	-69.2	-171.6	-16	0	0	112	Y429 L430	Q427-Y429 VanDerWaalsContact C-N 3.26Å; Q427-Y429 PolarHBondContact O-N 3.19Å; Q427-L430 HydrophobicContact CB-CD1 4.34Å
428	P	42.3	Very low	44.9	Very low	83 Å²	83	68.3 Å²	68.3	54%	0.539	35%	0.347	S	S	.	.	S	Bend	trans	-73.5	-17.8	178.3	29.3	-34.4	0	0	0	113.5
429	Y	42	Very low	45.9	Very low	151 Å²	151	70.3 Å²	70.3	59%	0.592	35%	0.347	S	S	*	.			trans	-141.8	124.7	175.8	-54	-76.5	0	0	0	109	F367 Q427	F367-Y429 HydrophobicContact CD2-CE1 4.13Å; Q427-Y429 VanDerWaalsContact C-N 3.26Å; Q427-Y429 PolarHBondContact O-N 3.19Å
430	L	45.7	Very low	47.2	Very low	39 Å²	39	67.6 Å²	67.6	20%	0.204	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-89.3	153.5	159.7	-82.1	82.2	0	0	0	109	L365 L422 A424 Q427	L365-L430 HydrophobicContact CD1-CD1 4.45Å; L365-L430 HydrophobicContact CD1-CD2 4.21Å; L422-L430 HydrophobicContact CB-CD2 4.39Å; L422-L430 HydrophobicContact CD1-CD2 4.28Å; L422-L430 HydrophobicContact CD2-CD2 4.27Å; A424-L430 HydrophobicContact CB-CD1 4.05Å; Q427-L430 HydrophobicContact CB-CD1 4.34Å
431	E	37	Very low	48.4	Very low	144 Å²	144	61.7 Å²	61.7	67%	0.673	31%	0.308	S	S	*	.	P	Polyproline II helix	trans	-68.1	155	163.2	-70.9	-169.9	159.1	0	0	110.7	F433 N580	E431-F433 PolarHBondContact O-N 3.14Å; E431-N580 PolarHBondContact OE2-ND2 3.48Å; E431-N580 VanDerWaalsContact OE2-ND2 3.16Å
432	P	36.8	Very low	49.6	Very low	53 Å²	53	59.2 Å²	59.2	34%	0.344	29%	0.293	S	S	.	.	P	Polyproline II helix	trans	-57.6	125.1	170.3	25.5	-33.9	0	0	0	109.6	F505 N580	P432-F505 HydrophobicContact CG-CE2 4.2Å; P432-N580 PolarHBondContact O-ND2 3.19Å; P432-N580 VanDerWaalsContact O-ND2 3.1Å
433	F	43.1	Very low	50.5	Low	50 Å²	50	59.4 Å²	59.4	22%	0.219	29%	0.29	C	S	.	.			trans	-109.8	136.8	170.9	174.8	-125.1	0	0	0	108.8	L422 E431 H435	L422-F433 HydrophobicContact CD1-CD1 3.84Å; L422-F433 HydrophobicContact CD1-CG 4.47Å; E431-F433 PolarHBondContact O-N 3.14Å; F433-H435 HydrophobicContact CD1-CB 4.47Å; F433-H435 HydrophobicContact CE1-CB 3.86Å; F433-H435 HydrophobicContact CZ-CB 4.27Å
434	I	39.4	Very low	51.4	Low	12 Å²	12	54 Å²	54	6%	0.062	27%	0.267	C	S	.	.			trans	-107.1	119	175.2	-62.4	180	0	0	0	107.5	M362 I578	M362-I434 HydrophobicContact CE-CD1 4.05Å; M362-I434 HydrophobicContact CE-CG1 3.94Å; M362-I434 HydrophobicContact CE-CG2 4.01Å; M362-I434 HydrophobicContact SD-CG1 4.42Å; I434-I578 HydrophobicContact CB-CG2 4.08Å; I434-I578 HydrophobicContact CD1-CG1 4.23Å; I434-I578 HydrophobicContact CG2-CG1 4.22Å; I434-I578 HydrophobicContact CG2-CG2 4Å
435	H	42.5	Very low	51.8	Low	36 Å²	36	54.4 Å²	54.4	17%	0.167	27%	0.269	C	S	.	.			trans	-101.7	155.6	177.5	-175.9	63.1	0	0	0	111.1	D386 F433	D386-H435 WeakPolarHBondContact CB-CE1 3.5Å; D386-H435 IonicContact OD1-CD2 3.58Å; D386-H435 IonicContact OD1-CE1 2.66Å; D386-H435 PolarHBondContact OD1-CE1 3.3Å; D386-H435 IonicContact OD1-CG 2.64Å; D386-H435 IonicContact OD1-ND1 2.69Å; D386-H435 PolarHBondContact OD1-ND1 3.49Å; D386-H435 IonicContact OD1-NE2 3.71Å; D386-H435 IonicContact OD2-CE1 3.32Å; D386-H435 IonicContact OD2-ND1 3.93Å; F433-H435 HydrophobicContact CD1-CB 4.47Å; F433-H435 HydrophobicContact CE1-CB 3.86Å; F433-H435 HydrophobicContact CZ-CB 4.27Å
436	K	39.7	Very low	52	Low	80 Å²	80	53.8 Å²	53.8	35%	0.348	26%	0.264	S	S	.	.			trans	-121.8	117	-171.8	-158.1	-172.6	-178.3	-170.1	0	109.9	M360 D488 W489	M360-K436 HydrophobicContact CE-CG 4.1Å; K436-D488 IonicContact NZ-OD1 2.9Å; K436-W489 WeakPolarHBondContact CE-O 3.37Å; K436-W489 PolarHBondContact NZ-O 2.96Å
437	L	45.7	Very low	52.6	Low	59 Å²	59	51.1 Å²	51.1	31%	0.309	25%	0.253	S	S	.	.	S	Bend	trans	62.6	98	164.5	-64.4	156.2	0	0	0	117.5	M360 K482	M360-L437 HydrophobicContact CE-CD2 4.46Å; M360-L437 HydrophobicContact CE-CG 4.1Å; M360-L437 HydrophobicContact SD-CB 4.16Å; M360-L437 HydrophobicContact SD-CD2 3.39Å; M360-L437 WeakPolarHBondContact SD-CD2 3.38Å; M360-L437 HydrophobicContact SD-CG 3.55Å; M360-L437 VanDerWaalsContact SD-CG 3.55Å; M360-L437 PolarHBondContact SD-N 2.78Å; L437-K482 HydrophobicContact CD2-CD 4.35Å
438	G	52.9	Low	52.6	Low	30 Å²	30	47.9 Å²	47.9	31%	0.309	24%	0.241	S	C	.	.	S	Bend	trans	160	-173	159.4	0	0	0	0	0	117.3	E387	E387-G438 WeakPolarHBondContact OE1-CA 3.2Å
439	R	54.9	Low	52.7	Low	104 Å²	104	48 Å²	48	39%	0.392	23%	0.234	S	C	.	.			trans	-71.3	139.5	159.1	-61.8	-172.6	-171.1	164.3	5.6	109.4	R353 E387	R353-R439 HydrophobicContact CG-CG 4.2Å; E387-R439 PolarHBondContact N-O 2.93Å; E387-R439 PolarHBondContact OE1-N 2.76Å
440	S	61.6	Low	52.5	Low	4 Å²	4	47 Å²	47	3%	0.028	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	117.8	179.2	-55.9	0	0	0	0	110.6	F352 I363	F352-S440 WeakPolarHBondContact CB-O 3.43Å; F352-S440 PolarHBondContact N-O 3.02Å; F352-S440 PolarHBondContact O-N 3.31Å; F352-S440 VanDerWaalsContact O-N 3.11Å; I363-S440 VanDerWaalsContact CD1-CB 3.47Å
441	I	64.8	Low	51.5	Low	8 Å²	8	54.4 Å²	54.4	4%	0.041	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	120.2	-178.1	-61.9	171.7	0	0	0	109.3	I349 I350 D351 I384 Y385 F389	I349-I441 HydrophobicContact CG2-CG2 3.61Å; I350-I441 CarbonylContact O-C 3.6Å; I350-I441 WeakPolarHBondContact O-CA 3.3Å; D351-I441 HydrophobicContact CB-CG1 4.27Å; I384-I441 CarbonylContact C-O 3.58Å; I384-I441 WeakPolarHBondContact CA-O 3.33Å; Y385-I441 PolarHBondContact N-O 3.37Å; Y385-I441 PolarHBondContact O-N 3.32Å; F389-I441 HydrophobicContact CB-CD1 3.73Å; F389-I441 WeakPolarHBondContact O-CD1 3.29Å
442	V	72.3	Confident	51	Low	0 Å²	0	52.7 Å²	52.7	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	114.7	174.5	-179.1	0	0	0	0	109	I350 F352 I363 I382 I384 I444 I475	I350-V442 HydrophobicContact CB-CB 4.48Å; I350-V442 PolarHBondContact N-O 3.21Å; I350-V442 PolarHBondContact O-N 3.03Å; F352-V442 HydrophobicContact CD2-CG2 3.91Å; F352-V442 HydrophobicContact CE2-CB 4.03Å; F352-V442 HydrophobicContact CE2-CG2 3.62Å; I363-V442 HydrophobicContact CD1-CG2 4.2Å; I382-V442 HydrophobicContact CG2-CG1 3.95Å; I384-V442 HydrophobicContact CD1-CG2 4.34Å; I384-V442 HydrophobicContact CG1-CG2 4.13Å; I384-V442 HydrophobicContact CG2-CG2 4.46Å; V442-I444 HydrophobicContact CG1-CG1 4.24Å; V442-I475 HydrophobicContact CG1-CD1 4.26Å
443	R	70.8	Confident	50.4	Low	55 Å²	55	56.8 Å²	56.8	21%	0.208	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	132.9	178	-179.6	-177.1	-172.8	-131.8	3.8	109.3	E347 V348 I349 I382 E383 Y385	E347-R443 HydrophobicContact CG-CG 4.42Å; E347-R443 IonicContact OE1-CZ 2.62Å; E347-R443 IonicContact OE1-NE 3.27Å; E347-R443 PolarHBondContact OE1-NE 2.86Å; E347-R443 IonicContact OE1-NH2 2.71Å; E347-R443 PolarHBondContact OE1-NH2 2.97Å; E347-R443 IonicContact OE2-CZ 2.74Å; E347-R443 IonicContact OE2-NH2 2.67Å; E347-R443 PolarHBondContact OE2-NH2 3.09Å; E347-R443 VanDerWaalsContact OE2-NH2 3.08Å; V348-R443 CarbonylContact O-C 3.58Å; V348-R443 WeakPolarHBondContact O-CA 3.27Å; I349-R443 HydrophobicContact CG1-CG 4.43Å; I382-R443 CarbonylContact C-O 3.52Å; I382-R443 VanDerWaalsContact CA-O 3.27Å; I382-R443 WeakPolarHBondContact CA-O 3.33Å; E383-R443 HydrophobicContact CB-CB 4.33Å; E383-R443 PolarHBondContact N-O 3.01Å; E383-R443 PolarHBondContact O-N 2.87Å; E383-R443 IonicContact OE2-CZ 3.08Å; E383-R443 IonicContact OE2-NE 3.52Å; E383-R443 IonicContact OE2-NH1 2.68Å; E383-R443 PolarHBondContact OE2-NH1 2.85Å; Y385-R443 HydrophobicContact CE2-CB 4.01Å
444	I	74.3	Confident	49.6	Very low	0 Å²	0	62.4 Å²	62.4	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	113.6	-179	-42.3	-176.5	0	0	0	108.8	L323 E347 V348 I350 L381 I382 V442 I446 I473	L323-I444 HydrophobicContact CD1-CD1 4.19Å; E347-I444 WeakPolarHBondContact CA-O 3.39Å; V348-I444 HydrophobicContact CB-CB 4.26Å; V348-I444 PolarHBondContact N-O 3.03Å; V348-I444 PolarHBondContact O-N 3.37Å; I350-I444 HydrophobicContact CD1-CD1 4.16Å; L381-I444 CarbonylContact O-C 3.53Å; L381-I444 WeakPolarHBondContact O-CA 3.39Å; I382-I444 HydrophobicContact CG1-CB 4.49Å; I382-I444 HydrophobicContact CG1-CG1 4.23Å; I382-I444 HydrophobicContact CG1-CG2 3.99Å; V442-I444 HydrophobicContact CG1-CG1 4.24Å; I444-I446 HydrophobicContact CG2-CD1 4.05Å; I444-I446 HydrophobicContact CG2-CG1 3.82Å; I444-I473 HydrophobicContact CD1-CD1 4.19Å
445	L	65.1	Low	48.9	Very low	10 Å²	10	67.8 Å²	67.8	5%	0.052	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	131.9	168.5	-70.5	173.6	0	0	0	109.9	E347 N379 L381	E347-L445 HydrophobicContact CB-CD2 3.79Å; E347-L445 HydrophobicContact CG-CD2 3.71Å; E347-L445 WeakPolarHBondContact OE2-CD2 2.88Å; N379-L445 CarbonylContact O-C 3.56Å; L381-L445 HydrophobicContact CB-CB 4.28Å; L381-L445 HydrophobicContact CB-CD1 4.43Å; L381-L445 HydrophobicContact CD2-CD1 4.3Å; L381-L445 PolarHBondContact N-O 2.86Å; L381-L445 PolarHBondContact O-N 3.28Å
446	I	66	Low	48.3	Very low	7 Å²	7	73 Å²	73	4%	0.036	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	128.2	-178.6	-48.8	179.3	0	0	0	109	L323 I346 V348 N379 I444 P448 L470 P471	L323-I446 HydrophobicContact CD2-CD1 4.22Å; I346-I446 PolarHBondContact N-O 3.18Å; I346-I446 PolarHBondContact O-N 3.2Å; V348-I446 HydrophobicContact CG2-CD1 4.46Å; N379-I446 CarbonylContact O-C 3.49Å; N379-I446 PolarHBondContact O-N 3.44Å; I444-I446 HydrophobicContact CG2-CD1 4.05Å; I444-I446 HydrophobicContact CG2-CG1 3.82Å; I446-P448 WeakPolarHBondContact O-CD 3.49Å; I446-L470 HydrophobicContact CD1-CD2 3.65Å; I446-L470 HydrophobicContact CG2-CD2 4.36Å; I446-P471 HydrophobicContact CD1-CG 4.22Å
447	S	57.7	Low	47.6	Very low	39 Å²	39	78 Å²	78	27%	0.273	41%	0.405	S	S	.	.			trans	-100.4	112.8	170.8	-170.2	0	0	0	0	111.7	N379 E449	N379-S447 PolarHBondContact O-N 2.87Å; S447-E449 PolarHBondContact O-N 3.06Å; S447-E449 VanDerWaalsContact O-N 3.08Å
448	P	50.5	Low	46.7	Very low	42 Å²	42	86.5 Å²	86.5	27%	0.273	44%	0.435	S	S	.	.			trans	-78.2	86.8	171.2	32.8	-34	0	0	0	110.5	I346 I446 I450	I346-P448 HydrophobicContact CD1-CG 4.27Å; I446-P448 WeakPolarHBondContact O-CD 3.49Å; P448-I450 PolarHBondContact O-N 3.03Å
449	E	43.9	Very low	45.4	Very low	84 Å²	84	87.7 Å²	87.7	39%	0.393	45%	0.447	S	S	.	.			trans	-66.9	95.1	167.9	-89.1	-154.3	150.6	0	0	111	S447 R451	S447-E449 PolarHBondContact O-N 3.06Å; S447-E449 VanDerWaalsContact O-N 3.08Å; E449-R451 HydrophobicContact CB-CG 4.42Å; E449-R451 PolarHBondContact O-N 3.11Å; E449-R451 VanDerWaalsContact O-N 3.17Å; E449-R451 IonicContact OE1-CZ 3Å; E449-R451 VanDerWaalsContact OE1-CZ 3.27Å; E449-R451 IonicContact OE1-NE 2.9Å; E449-R451 PolarHBondContact OE1-NE 2.99Å; E449-R451 IonicContact OE1-NH2 2.73Å; E449-R451 PolarHBondContact OE1-NH2 2.95Å; E449-R451 IonicContact OE2-CZ 3.25Å; E449-R451 IonicContact OE2-NE 3.25Å; E449-R451 PolarHBondContact OE2-NE 2.83Å; E449-R451 IonicContact OE2-NH2 2.6Å; E449-R451 PolarHBondContact OE2-NH2 3Å
450	I	38.1	Very low	44.1	Very low	132 Å²	132	91.9 Å²	91.9	68%	0.677	47%	0.471	S	S	*	.			trans	-82.9	73.7	160	-52.4	-179	0	0	0	107.8	P448 T452	P448-I450 PolarHBondContact O-N 3.03Å; I450-T452 PolarHBondContact O-N 3.47Å
451	R	24.9	Very low	42.6	Very low	194 Å²	194	99.8 Å²	99.8	73%	0.732	51%	0.509	S	S	*	.			trans	-73.8	92.7	168	-73.6	-166.2	-168.8	-159.1	1.4	110	E449	E449-R451 HydrophobicContact CB-CG 4.42Å; E449-R451 PolarHBondContact O-N 3.11Å; E449-R451 VanDerWaalsContact O-N 3.17Å; E449-R451 IonicContact OE1-CZ 3Å; E449-R451 VanDerWaalsContact OE1-CZ 3.27Å; E449-R451 IonicContact OE1-NE 2.9Å; E449-R451 PolarHBondContact OE1-NE 2.99Å; E449-R451 IonicContact OE1-NH2 2.73Å; E449-R451 PolarHBondContact OE1-NH2 2.95Å; E449-R451 IonicContact OE2-CZ 3.25Å; E449-R451 IonicContact OE2-NE 3.25Å; E449-R451 PolarHBondContact OE2-NE 2.83Å; E449-R451 IonicContact OE2-NH2 2.6Å; E449-R451 PolarHBondContact OE2-NH2 3Å
452	T	25.4	Very low	40.7	Very low	108 Å²	108	106.5 Å²	106.5	66%	0.663	55%	0.545	S	S	*	.			trans	-123.8	98.2	156.8	47.3	0	0	0	0	108.7	I450 E454	I450-T452 PolarHBondContact O-N 3.47Å; T452-E454 VanDerWaalsContact C-N 3.26Å; T452-E454 PolarHBondContact O-N 2.92Å
453	T	25.5	Very low	38.9	Very low	138 Å²	138	112.5 Å²	112.5	85%	0.847	58%	0.576	S	S	*	*			trans	-73.5	80.9	166.5	44.3	0	0	0	0	109.4
454	E	25.8	Very low	37	Very low	168 Å²	168	113.3 Å²	113.3	79%	0.785	59%	0.59	S	S	*	*	S	Bend	trans	-167.1	144.5	161.4	-110.4	149.2	-139.8	0	0	109.8	T452 I456	T452-E454 VanDerWaalsContact C-N 3.26Å; T452-E454 PolarHBondContact O-N 2.92Å; E454-I456 PolarHBondContact O-N 3.28Å
455	S	24.6	Very low	35.1	Very low	126 Å²	126	121.4 Å²	121.4	88%	0.881	63%	0.625	S	S	*	*			trans	-76.6	116.3	175.9	47.7	0	0	0	0	110.2
456	I	29.6	Very low	33.6	Very low	146 Å²	146	125.4 Å²	125.4	75%	0.749	65%	0.652	S	S	*	*			trans	-116.3	128.1	169.4	-59.4	179.9	0	0	0	108	E454	E454-I456 PolarHBondContact O-N 3.28Å
457	E	25.8	Very low	32.8	Very low	183 Å²	183	128.5 Å²	128.5	86%	0.855	67%	0.668	S	S	*	*			trans	-67.6	164	-179.8	-64.2	-178.9	104.4	0	0	112.6	G459	E457-G459 VanDerWaalsContact C-N 3.31Å; E457-G459 PolarHBondContact O-N 3.19Å
458	Y	27.3	Very low	32.2	Very low	238 Å²	238	132 Å²	132	93%	0.933	69%	0.688	S	S	*	*	S	Bend	trans	-73.1	78.2	-177.9	-89	-101.4	0	0	0	112.4
459	G	24.3	Very low	32.4	Very low	56 Å²	56	135.1 Å²	135.1	58%	0.577	70%	0.697	S	S	*	*			trans	-133.3	115.6	174.7	0	0	0	0	0	113.3	E457 M461	E457-G459 VanDerWaalsContact C-N 3.31Å; E457-G459 PolarHBondContact O-N 3.19Å; G459-M461 PolarHBondContact O-N 2.61Å
460	H	27.2	Very low	33.5	Very low	191 Å²	191	131.7 Å²	131.7	88%	0.884	68%	0.681	S	S	*	*			trans	38.3	68.9	163.6	-72.8	-79.2	0	0	0	118.3	N462	H460-N462 PolarHBondContact O-N 2.85Å
461	M	30.1	Very low	34.9	Very low	170 Å²	170	125.6 Å²	125.6	84%	0.837	65%	0.65	S	S	*	*			trans	-69	94.8	164	-82.9	-155.5	173.9	0	0	112.3	G459 I463	G459-M461 PolarHBondContact O-N 2.61Å; M461-I463 HydrophobicContact CB-CG1 4.29Å; M461-I463 PolarHBondContact O-N 3.4Å; M461-I463 VanDerWaalsContact O-N 3.13Å
462	N	26	Very low	37	Very low	149 Å²	149	119.5 Å²	119.5	80%	0.797	63%	0.631	S	S	*	*			trans	-71.8	93.5	159.5	-91.8	-39.3	0	0	0	109.7	H460 S464	H460-N462 PolarHBondContact O-N 2.85Å; N462-S464 VanDerWaalsContact C-N 3.28Å; N462-S464 PolarHBondContact O-N 2.98Å
463	I	35.1	Very low	39.4	Very low	127 Å²	127	114.5 Å²	114.5	65%	0.651	60%	0.6	S	S	*	*			trans	-75.2	78.9	178.1	-51.4	179.1	0	0	0	109.9	M461	M461-I463 HydrophobicContact CB-CG1 4.29Å; M461-I463 PolarHBondContact O-N 3.4Å; M461-I463 VanDerWaalsContact O-N 3.13Å
464	S	29.1	Very low	41.7	Very low	72 Å²	72	110.8 Å²	110.8	50%	0.503	57%	0.572	S	S	.	*			trans	-117.4	6.9	-179.3	63.9	0	0	0	0	114.4	N462	N462-S464 VanDerWaalsContact C-N 3.28Å; N462-S464 PolarHBondContact O-N 2.98Å
465	K	34.4	Very low	44.2	Very low	169 Å²	169	102.8 Å²	102.8	74%	0.735	53%	0.534	S	S	*	.	S	Bend	trans	-98.7	114.2	171.4	-72.5	-180	179.1	173.2	0	109.7
466	P	35.2	Very low	46.5	Very low	95 Å²	95	97.7 Å²	97.7	62%	0.617	50%	0.497	S	S	*	.			trans	-66	148.1	170.9	29.6	-34.4	0	0	0	109.8	T468	P466-T468 PolarHBondContact O-N 2.84Å; P466-T468 VanDerWaalsContact O-N 3.09Å
467	I	49	Very low	48.7	Very low	71 Å²	71	90.7 Å²	90.7	36%	0.364	46%	0.461	S	S	.	.			trans	-72.5	108	-176.8	-74.5	161.7	0	0	0	109.7	W327 K469	W327-I467 HydrophobicContact CH2-CD1 4.27Å; W327-I467 HydrophobicContact CZ2-CD1 3.34Å; I467-K469 HydrophobicContact CG2-CB 4.49Å; I467-K469 PolarHBondContact O-N 2.87Å; I467-K469 VanDerWaalsContact O-N 3.1Å
468	T	44.3	Very low	50.9	Low	114 Å²	114	82.8 Å²	82.8	70%	0.699	43%	0.425	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.6	7.7	-176.3	51.3	0	0	0	0	114.1	Q371 P466	Q371-T468 PolarHBondContact NE2-O 2.69Å; P466-T468 PolarHBondContact O-N 2.84Å; P466-T468 VanDerWaalsContact O-N 3.09Å
469	K	55.4	Low	53.1	Low	106 Å²	106	72 Å²	72	46%	0.461	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-126.7	29.4	-166.2	-55.7	-151.4	175.6	-177.1	0	115.8	Q371 F372 I467	Q371-K469 VanDerWaalsContact OE1-CG 3.24Å; F372-K469 HydrophobicContact CE2-CD 3.96Å; F372-K469 HydrophobicContact CZ-CD 4.18Å; I467-K469 HydrophobicContact CG2-CB 4.49Å; I467-K469 PolarHBondContact O-N 2.87Å; I467-K469 VanDerWaalsContact O-N 3.1Å
470	L	66.4	Low	55.1	Low	12 Å²	12	70.1 Å²	70.1	6%	0.063	36%	0.362	C	S	.	.			trans	-73.9	150.8	165.7	-77	166.3	0	0	0	111	L323 I324 W327 I446	L323-L470 HydrophobicContact CD2-CD2 4.27Å; I324-L470 HydrophobicContact CB-CD1 4.36Å; I324-L470 HydrophobicContact CG1-CD1 3.65Å; W327-L470 HydrophobicContact CB-CD1 4.03Å; W327-L470 HydrophobicContact CD2-CD1 4.28Å; W327-L470 HydrophobicContact CD2-CD2 4.33Å; W327-L470 HydrophobicContact CE3-CD1 4.49Å; W327-L470 HydrophobicContact CE3-CD2 3.77Å; W327-L470 HydrophobicContact CG-CD1 4.04Å; W327-L470 HydrophobicContact CZ3-CD2 4.09Å; I446-L470 HydrophobicContact CD1-CD2 3.65Å; I446-L470 HydrophobicContact CG2-CD2 4.36Å
471	P	66.6	Low	56.7	Low	4 Å²	4	66 Å²	66	3%	0.026	34%	0.342	C	S	.	.			trans	-69.1	141.1	-179.8	29	-34.8	0	0	0	111.5	T320 L323 F370 I446 I473	T320-P471 WeakPolarHBondContact CG2-O 3.25Å; L323-P471 HydrophobicContact CD2-CG 4.01Å; F370-P471 HydrophobicContact CD1-CB 3.69Å; F370-P471 HydrophobicContact CD1-CG 4.3Å; F370-P471 HydrophobicContact CE1-CB 4.04Å; F370-P471 HydrophobicContact CE1-CG 4.28Å; F370-P471 HydrophobicContact CG-CB 4.35Å; I446-P471 HydrophobicContact CD1-CG 4.22Å; P471-I473 HydrophobicContact CB-CG2 4.27Å; P471-I473 HydrophobicContact CG-CG2 4.37Å; P471-I473 PolarHBondContact O-N 2.86Å
472	E	70.6	Confident	57.9	Low	67 Å²	67	60.7 Å²	60.7	31%	0.313	31%	0.314	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	113.9	172.4	-69	165.1	-164.8	0	0	109	T320 F367 V368 K369	T320-E472 WeakPolarHBondContact OG1-CA 3.27Å; F367-E472 HydrophobicContact CD1-CB 4.31Å; F367-E472 HydrophobicContact CE1-CB 3.89Å; F367-E472 WeakPolarHBondContact CE1-OE2 3.45Å; V368-E472 CarbonylContact C-O 3.53Å; V368-E472 WeakPolarHBondContact CA-O 3.41Å; K369-E472 HydrophobicContact CB-CB 4.2Å; K369-E472 WeakPolarHBondContact CD-OE2 3.45Å; K369-E472 PolarHBondContact N-O 2.86Å; K369-E472 IonicContact NZ-OE1 3.36Å; K369-E472 PolarHBondContact NZ-OE1 2.91Å; K369-E472 IonicContact NZ-OE2 3.73Å; K369-E472 PolarHBondContact NZ-OE2 3.36Å; K369-E472 PolarHBondContact O-N 3.26Å
473	I	75.2	Confident	59.1	Low	3 Å²	3	54.4 Å²	54.4	2%	0.015	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	146	-177.7	61	167	0	0	0	112.2	F318 E319 T320 L323 F367 V368 I382 I444 P471	F318-I473 HydrophobicContact CD1-CD1 4.06Å; F318-I473 HydrophobicContact CE1-CD1 3.74Å; E319-I473 CarbonylContact C-O 3.58Å; E319-I473 WeakPolarHBondContact CA-O 3.32Å; T320-I473 PolarHBondContact N-O 3.5Å; T320-I473 PolarHBondContact OG1-N 3.32Å; T320-I473 PolarHBondContact OG1-O 2.9Å; L323-I473 HydrophobicContact CB-CD1 4.19Å; L323-I473 HydrophobicContact CD2-CD1 3.88Å; L323-I473 HydrophobicContact CD2-CG1 4.36Å; L323-I473 HydrophobicContact CG-CD1 4.47Å; F367-I473 CarbonylContact O-C 3.39Å; F367-I473 WeakPolarHBondContact O-CA 3.49Å; V368-I473 HydrophobicContact CG1-CG2 4.39Å; V368-I473 HydrophobicContact CG2-CG2 4.45Å; I382-I473 HydrophobicContact CD1-CG2 4.25Å; I444-I473 HydrophobicContact CD1-CD1 4.19Å; P471-I473 HydrophobicContact CB-CG2 4.27Å; P471-I473 HydrophobicContact CG-CG2 4.37Å; P471-I473 PolarHBondContact O-N 2.86Å
474	K	74.8	Confident	59.3	Low	59 Å²	59	55.8 Å²	55.8	26%	0.257	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	109.2	167	-177	156.5	179.4	146.9	0	110.5	I317 E319 K366 F367	I317-K474 HydrophobicContact CG2-CD 4.33Å; I317-K474 HydrophobicContact CG2-CG 4.13Å; E319-K474 HydrophobicContact CG-CD 4.39Å; E319-K474 HydrophobicContact CG-CG 4.35Å; E319-K474 WeakPolarHBondContact OE1-CD 3.4Å; E319-K474 WeakPolarHBondContact OE1-CE 3.47Å; E319-K474 IonicContact OE1-NZ 3.19Å; E319-K474 PolarHBondContact OE1-NZ 3.2Å; K366-K474 HydrophobicContact CB-CB 4.41Å; K366-K474 HydrophobicContact CB-CG 4.25Å; K366-K474 HydrophobicContact CD-CD 4.33Å; K366-K474 PolarHBondContact N-O 2.91Å; F367-K474 HydrophobicContact CB-CB 4.31Å; F367-K474 PolarHBondContact N-O 2.91Å; F367-K474 PolarHBondContact O-N 3.12Å
475	I	76.6	Confident	59.8	Low	1 Å²	1	54.3 Å²	54.3	1%	0.005	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	128.3	174.9	-41	-176.4	0	0	0	107.4	I317 F318 I363 H364 L365 V442 I477	I317-I475 WeakPolarHBondContact CA-O 3.42Å; F318-I475 HydrophobicContact CB-CB 4.33Å; F318-I475 HydrophobicContact CD1-CD1 4.12Å; F318-I475 HydrophobicContact CD1-CG1 4.37Å; F318-I475 PolarHBondContact N-O 2.66Å; F318-I475 PolarHBondContact O-N 2.82Å; I363-I475 HydrophobicContact CG2-CG2 3.58Å; H364-I475 WeakPolarHBondContact O-CA 3.08Å; L365-I475 HydrophobicContact CD2-CD1 4.39Å; L365-I475 HydrophobicContact CD2-CG1 4.11Å; V442-I475 HydrophobicContact CG1-CD1 4.26Å; I475-I477 HydrophobicContact CG2-CD1 4.16Å; I475-I477 HydrophobicContact CG2-CG1 3.89Å
476	I	73.4	Confident	59.9	Low	18 Å²	18	55.2 Å²	55.2	9%	0.092	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	134.5	170.7	-61.2	167.8	0	0	0	106.6	I317 H364 K366 Y504	I317-I476 HydrophobicContact CG1-CG1 4.22Å; I317-I476 HydrophobicContact CG2-CG1 4.15Å; H364-I476 HydrophobicContact CB-CB 4.26Å; H364-I476 PolarHBondContact N-O 2.84Å; H364-I476 PolarHBondContact O-N 2.9Å; K366-I476 HydrophobicContact CB-CD1 4.46Å; K366-I476 HydrophobicContact CD-CD1 4.18Å; I476-Y504 HydrophobicContact CD1-CE2 4.37Å; I476-Y504 VanDerWaalsContact CD1-OH 3.23Å; I476-Y504 WeakPolarHBondContact CD1-OH 3.4Å
477	I	76.6	Confident	59.9	Low	0 Å²	0	58.4 Å²	58.4	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	124.1	-177.1	-50.3	-178.9	0	0	0	108.7	I312 E315 M316 F352 L361 M362 I363 I475	I312-I477 HydrophobicContact CD1-CB 3.84Å; I312-I477 HydrophobicContact CD1-CD1 4.03Å; I312-I477 HydrophobicContact CD1-CG2 3.46Å; I312-I477 VanDerWaalsContact CD1-CG2 3.46Å; E315-I477 CarbonylContact C-O 3.49Å; E315-I477 WeakPolarHBondContact CA-O 3.46Å; M316-I477 HydrophobicContact CE-CD1 4.21Å; M316-I477 PolarHBondContact N-O 2.85Å; M316-I477 PolarHBondContact O-N 3.04Å; F352-I477 HydrophobicContact CD1-CD1 3.6Å; F352-I477 HydrophobicContact CD2-CD1 3.66Å; F352-I477 HydrophobicContact CE1-CD1 3.41Å; F352-I477 VanDerWaalsContact CE1-CD1 3.41Å; F352-I477 HydrophobicContact CE2-CD1 3.47Å; F352-I477 VanDerWaalsContact CE2-CD1 3.47Å; F352-I477 HydrophobicContact CG-CD1 3.71Å; F352-I477 HydrophobicContact CZ-CD1 3.33Å; L361-I477 HydrophobicContact CD2-CG2 4.14Å; M362-I477 CarbonylContact O-C 3.58Å; M362-I477 VanDerWaalsContact O-CA 3.27Å; M362-I477 WeakPolarHBondContact O-CA 3.37Å; I363-I477 HydrophobicContact CD1-CD1 4.28Å; I363-I477 HydrophobicContact CG1-CD1 4.27Å; I363-I477 HydrophobicContact CG1-CG1 4.08Å; I363-I477 HydrophobicContact CG1-CG2 3.98Å; I363-I477 HydrophobicContact CG2-CG1 4.41Å; I475-I477 HydrophobicContact CG2-CD1 4.16Å; I475-I477 HydrophobicContact CG2-CG1 3.89Å
478	T	71.7	Confident	59.6	Low	17 Å²	17	59.7 Å²	59.7	10%	0.104	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	123.6	-173	-63.9	0	0	0	0	109.6	E315 M362 L480	E315-T478 HydrophobicContact CG-CG2 4Å; E315-T478 WeakPolarHBondContact OE1-CB 3.36Å; E315-T478 VanDerWaalsContact OE1-CG2 3.24Å; E315-T478 WeakPolarHBondContact OE1-CG2 3.37Å; E315-T478 PolarHBondContact OE1-OG1 2.84Å; M362-T478 PolarHBondContact N-O 3.03Å; M362-T478 PolarHBondContact O-N 2.9Å; T478-L480 HydrophobicContact CG2-CD2 3.88Å; T478-L480 HydrophobicContact CG2-CG 4.41Å
479	A	74.1	Confident	59.8	Low	12 Å²	12	59.3 Å²	59.3	10%	0.099	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	106.3	172	0	0	0	0	0	110.6	I312 N314 L359 M360 L361	I312-A479 HydrophobicContact CG2-CB 4.34Å; N314-A479 WeakPolarHBondContact O-CB 3.49Å; N314-A479 PolarHBondContact O-N 2.83Å; L359-A479 HydrophobicContact CB-CB 4.38Å; L359-A479 HydrophobicContact CD1-CB 4.06Å; L359-A479 HydrophobicContact CD2-CB 4.37Å; M360-A479 CarbonylContact O-C 3.54Å; M360-A479 VanDerWaalsContact O-CA 3.27Å; M360-A479 WeakPolarHBondContact O-CA 3.42Å; L361-A479 HydrophobicContact CD2-CB 4.38Å
480	L	64.4	Low	59.5	Low	15 Å²	15	56.1 Å²	56.1	8%	0.079	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	150.5	172.5	-64.1	-174	0	0	0	111	L359 M360 M362 T478 P491 V493	L359-L480 CarbonylContact C-O 3.55Å; L359-L480 VanDerWaalsContact CA-O 3.27Å; L359-L480 WeakPolarHBondContact CA-O 3.44Å; L359-L480 WeakPolarHBondContact CD2-O 3.27Å; M360-L480 HydrophobicContact CB-CB 4.29Å; M360-L480 PolarHBondContact N-O 2.69Å; M360-L480 PolarHBondContact O-N 3.31Å; M362-L480 HydrophobicContact CE-CD1 3.57Å; M362-L480 HydrophobicContact CE-CG 4.42Å; T478-L480 HydrophobicContact CG2-CD2 3.88Å; T478-L480 HydrophobicContact CG2-CG 4.41Å; L480-P491 HydrophobicContact CD1-CB 4.35Å; L480-V493 HydrophobicContact CD1-CG2 4.18Å; L480-V493 HydrophobicContact CD2-CG2 4.18Å
481	K	62.5	Low	58.6	Low	105 Å²	105	56 Å²	56	46%	0.457	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	130.9	171.7	-161.7	-177.7	174	72.8	0	110.3	D358 L359 C492	D358-K481 HydrophobicContact CB-CG 4.27Å; D358-K481 VanDerWaalsContact CB-NZ 3.31Å; D358-K481 CarbonylContact O-C 3.16Å; D358-K481 WeakPolarHBondContact O-CA 3.48Å; D358-K481 IonicContact OD2-NZ 3.38Å; D358-K481 PolarHBondContact OD2-NZ 3.48Å; L359-K481 HydrophobicContact CD2-CB 4.28Å; K481-C492 VanDerWaalsContact O-O 3.09Å
482	K	55.1	Low	57.5	Low	58 Å²	58	56.1 Å²	56.1	25%	0.252	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.6	137.5	168.5	-61.8	174.2	-174.1	174	0	109.5	S357 D358 L359 M360 L437 W489	S357-K482 VanDerWaalsContact O-CE 3.31Å; S357-K482 WeakPolarHBondContact O-CE 3.2Å; S357-K482 PolarHBondContact O-NZ 2.78Å; D358-K482 WeakPolarHBondContact O-CG 3.39Å; D358-K482 PolarHBondContact O-N 2.81Å; L359-K482 WeakPolarHBondContact O-CE 3.31Å; M360-K482 HydrophobicContact CG-CD 4.23Å; M360-K482 HydrophobicContact CG-CG 3.45Å; M360-K482 VanDerWaalsContact CG-CG 3.45Å; M360-K482 HydrophobicContact SD-CG 4.32Å; L437-K482 HydrophobicContact CD2-CD 4.35Å; K482-W489 HydrophobicContact CB-CE3 4.09Å; K482-W489 HydrophobicContact CB-CZ3 3.79Å; K482-W489 HydrophobicContact CD-CE3 4.24Å; K482-W489 HydrophobicContact CD-CH2 4.49Å; K482-W489 HydrophobicContact CD-CZ3 3.9Å; K482-W489 HydrophobicContact CG-CE3 4.44Å; K482-W489 HydrophobicContact CG-CZ3 4.32Å
483	A	50.7	Low	56.5	Low	18 Å²	18	53.6 Å²	53.6	15%	0.149	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	152.7	162	0	0	0	0	0	108.4	C492 I570	A483-C492 HydrophobicContact CB-CB 3.95Å; A483-I570 HydrophobicContact CB-CG2 4.15Å
484	F	40	Very low	54.9	Low	156 Å²	156	59.7 Å²	59.7	68%	0.684	29%	0.288	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-83.3	126	168.4	-112.4	-92.2	0	0	0	108.3	W489	F484-W489 AromaticContact CD2-CH2 3.87Å; F484-W489 HydrophobicContact CD2-CH2 3.87Å; F484-W489 HydrophobicContact CD2-CZ2 4.41Å; F484-W489 AromaticContact CD2-CZ3 3.95Å; F484-W489 HydrophobicContact CD2-CZ3 3.95Å; F484-W489 AromaticContact CE2-CH2 3.41Å; F484-W489 HydrophobicContact CE2-CH2 3.41Å; F484-W489 VanDerWaalsContact CE2-CH2 3.41Å; F484-W489 AromaticContact CE2-CZ2 3.63Å; F484-W489 HydrophobicContact CE2-CZ2 3.63Å; F484-W489 AromaticContact CE2-CZ3 3.97Å; F484-W489 HydrophobicContact CE2-CZ3 3.97Å; F484-W489 HydrophobicContact CZ-CH2 4.24Å; F484-W489 AromaticContact CZ-CZ2 3.99Å; F484-W489 HydrophobicContact CZ-CZ2 3.99Å
485	C	40	Very low	53.1	Low	41 Å²	41	59.9 Å²	59.9	28%	0.277	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	150.4	155.1	-65.3	0	0	0	0	106.9	N487 D488 V490	C485-N487 PolarHBondContact O-N 3.16Å; C485-D488 PolarHBondContact N-O 3.17Å; C485-D488 PolarHBondContact O-N 3.45Å; C485-D488 VanDerWaalsContact O-N 3.12Å; C485-D488 VanDerWaalsContact O-O 3.09Å; C485-V490 HydrophobicContact CB-CG2 3.96Å
486	E	35.8	Very low	51.5	Low	187 Å²	187	64.4 Å²	64.4	87%	0.874	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-12.9	-147.4	-155.4	152.3	-143.5	0	0	115.8
487	N	35.3	Very low	50	Low	163 Å²	163	66 Å²	66	87%	0.872	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	-129.6	-0	169	-73.6	-64	0	0	0	115.2	C485	C485-N487 PolarHBondContact O-N 3.16Å
488	D	41.5	Very low	48.6	Very low	97 Å²	97	69.8 Å²	69.8	52%	0.519	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.5	156.8	-177.7	-147.9	-34.2	0	0	0	114.1	K436 C485 V490	K436-D488 IonicContact NZ-OD1 2.9Å; C485-D488 PolarHBondContact N-O 3.17Å; C485-D488 PolarHBondContact O-N 3.45Å; C485-D488 VanDerWaalsContact O-N 3.12Å; C485-D488 VanDerWaalsContact O-O 3.09Å; D488-V490 PolarHBondContact O-N 3.14Å
489	W	50.4	Low	47.3	Very low	107 Å²	107	72.8 Å²	72.8	41%	0.405	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	105	178.5	-70.1	97.8	0	0	0	112	K436 K482 F484	K436-W489 WeakPolarHBondContact CE-O 3.37Å; K436-W489 PolarHBondContact NZ-O 2.96Å; K482-W489 HydrophobicContact CB-CE3 4.09Å; K482-W489 HydrophobicContact CB-CZ3 3.79Å; K482-W489 HydrophobicContact CD-CE3 4.24Å; K482-W489 HydrophobicContact CD-CH2 4.49Å; K482-W489 HydrophobicContact CD-CZ3 3.9Å; K482-W489 HydrophobicContact CG-CE3 4.44Å; K482-W489 HydrophobicContact CG-CZ3 4.32Å; F484-W489 AromaticContact CD2-CH2 3.87Å; F484-W489 HydrophobicContact CD2-CH2 3.87Å; F484-W489 HydrophobicContact CD2-CZ2 4.41Å; F484-W489 AromaticContact CD2-CZ3 3.95Å; F484-W489 HydrophobicContact CD2-CZ3 3.95Å; F484-W489 AromaticContact CE2-CH2 3.41Å; F484-W489 HydrophobicContact CE2-CH2 3.41Å; F484-W489 VanDerWaalsContact CE2-CH2 3.41Å; F484-W489 AromaticContact CE2-CZ2 3.63Å; F484-W489 HydrophobicContact CE2-CZ2 3.63Å; F484-W489 AromaticContact CE2-CZ3 3.97Å; F484-W489 HydrophobicContact CE2-CZ3 3.97Å; F484-W489 HydrophobicContact CZ-CH2 4.24Å; F484-W489 AromaticContact CZ-CZ2 3.99Å; F484-W489 HydrophobicContact CZ-CZ2 3.99Å
490	V	47.9	Very low	45.8	Very low	39 Å²	39	75 Å²	75	24%	0.236	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	134.7	174.8	-173	0	0	0	0	110.4	C485 D488 C492 C572	C485-V490 HydrophobicContact CB-CG2 3.96Å; D488-V490 PolarHBondContact O-N 3.14Å; V490-C492 PolarHBondContact O-N 3.2Å; V490-C492 PolarHBondContact O-SG 3.44Å; V490-C572 HydrophobicContact CG1-CB 3.87Å
491	P	47.1	Very low	45.1	Very low	10 Å²	10	77.4 Å²	77.4	7%	0.065	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	120.9	171.9	29.3	-32.3	0	0	0	109.9	M360 L480 L573 I578	M360-P491 HydrophobicContact CE-CB 4.41Å; L480-P491 HydrophobicContact CD1-CB 4.35Å; P491-L573 PolarHBondContact O-N 2.79Å; P491-L573 VanDerWaalsContact O-N 3.14Å; P491-I578 HydrophobicContact CG-CD1 3.63Å
492	C	43.7	Very low	44.3	Very low	6 Å²	6	77.8 Å²	77.8	4%	0.041	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	143.4	-176.6	-44.8	0	0	0	0	112.1	K481 A483 V490 I570 Y571 C572	K481-C492 VanDerWaalsContact O-O 3.09Å; A483-C492 HydrophobicContact CB-CB 3.95Å; V490-C492 PolarHBondContact O-N 3.2Å; V490-C492 PolarHBondContact O-SG 3.44Å; C492-I570 HydrophobicContact CB-CG2 3.26Å; C492-Y571 CarbonylContact C-O 3.54Å; C492-Y571 WeakPolarHBondContact CA-O 3.38Å; C492-C572 HydrophobicContact CB-CB 3.94Å; C492-C572 WeakPolarHBondContact CB-SG 3.2Å; C492-C572 WeakPolarHBondContact SG-CA 3.27Å; C492-C572 WeakPolarHBondContact SG-CB 3.44Å; C492-C572 CovalentContact SG-SG 2.04Å; C492-C572 PolarHBondContact SG-SG 3.28Å
493	V	50.3	Low	44	Very low	13 Å²	13	81 Å²	81	8%	0.079	41%	0.409	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	140.6	-164.6	-171.6	0	0	0	0	109.4	L480 D497 Y571 L573	L480-V493 HydrophobicContact CD1-CG2 4.18Å; L480-V493 HydrophobicContact CD2-CG2 4.18Å; V493-D497 HydrophobicContact CG1-CB 3.69Å; V493-Y571 PolarHBondContact N-O 3.25Å; V493-Y571 PolarHBondContact O-N 3.01Å; V493-L573 HydrophobicContact CG2-CD1 3.99Å; V493-L573 HydrophobicContact CG2-CG 4.13Å
494	R	40.7	Very low	43.6	Very low	132 Å²	132	84.4 Å²	84.4	50%	0.498	42%	0.418	S	S	.	.			trans	-69.4	150.9	174.2	-64.1	178.9	-64.2	-157.7	-4.9	109.9	T496 D497 Y498	R494-T496 PolarHBondContact O-N 3.23Å; R494-T496 VanDerWaalsContact O-N 3.13Å; R494-D497 IonicContact CZ-OD2 2.75Å; R494-D497 IonicContact NE-OD1 3.69Å; R494-D497 IonicContact NE-OD2 2.77Å; R494-D497 PolarHBondContact NE-OD2 2.93Å; R494-D497 IonicContact NH2-OD1 2.72Å; R494-D497 IonicContact NH2-OD2 3.56Å; R494-D497 PolarHBondContact NH2-OD2 3.29Å; R494-D497 PolarHBondContact O-N 2.88Å; R494-Y498 PolarHBondContact O-N 2.85Å
495	P	37.6	Very low	43.7	Very low	62 Å²	62	81.6 Å²	81.6	40%	0.403	41%	0.406	S	S	.	.	H	α-helix	trans	-52	-37.9	179.5	-29	34.7	0	0	0	114.7	V499 I569 Y571	P495-V499 WeakPolarHBondContact O-CG2 3.23Å; P495-V499 PolarHBondContact O-N 2.83Å; P495-I569 WeakPolarHBondContact CD-O 3.43Å; P495-I569 VanDerWaalsContact CG-O 3.31Å; P495-I569 WeakPolarHBondContact CG-O 3.36Å; P495-Y571 HydrophobicContact CB-CD2 4.35Å; P495-Y571 HydrophobicContact CB-CE2 3.91Å; P495-Y571 HydrophobicContact CG-CD2 4.11Å; P495-Y571 HydrophobicContact CG-CE2 3.84Å
496	T	42	Very low	43.6	Very low	97 Å²	97	84 Å²	84	60%	0.595	42%	0.416	S	S	*	.	H	α-helix	trans	-61.3	-44.2	175.6	43.4	0	0	0	0	112.7	R494 V499 A500	R494-T496 PolarHBondContact O-N 3.23Å; R494-T496 VanDerWaalsContact O-N 3.13Å; T496-V499 PolarHBondContact O-N 2.91Å; T496-A500 PolarHBondContact O-N 2.65Å
497	D	43.9	Very low	43.6	Very low	50 Å²	50	81.2 Å²	81.2	27%	0.267	41%	0.406	S	S	.	.	H	α-helix	trans	-81.9	-30.8	-168.8	-46.7	-7.5	0	0	0	109.4	V493 R494 A500 Y501	V493-D497 HydrophobicContact CG1-CB 3.69Å; R494-D497 IonicContact CZ-OD2 2.75Å; R494-D497 IonicContact NE-OD1 3.69Å; R494-D497 IonicContact NE-OD2 2.77Å; R494-D497 PolarHBondContact NE-OD2 2.93Å; R494-D497 IonicContact NH2-OD1 2.72Å; R494-D497 IonicContact NH2-OD2 3.56Å; R494-D497 PolarHBondContact NH2-OD2 3.29Å; R494-D497 PolarHBondContact O-N 2.88Å; D497-A500 PolarHBondContact O-N 2.77Å; D497-Y501 WeakPolarHBondContact O-CB 3.28Å; D497-Y501 PolarHBondContact O-N 2.64Å
498	Y	47	Very low	43.7	Very low	80 Å²	80	76.4 Å²	76.4	31%	0.314	38%	0.383	S	S	.	.	H	α-helix	trans	-66.6	-35.9	171.8	178.4	-118.5	0	0	0	112.8	R494 K502 Y571	R494-Y498 PolarHBondContact O-N 2.85Å; Y498-K502 VanDerWaalsContact O-CB 3.28Å; Y498-K502 WeakPolarHBondContact O-CB 3.01Å; Y498-K502 PolarHBondContact O-N 3.06Å; Y498-Y571 HydrophobicContact CD1-CD2 4.39Å; Y498-Y571 HydrophobicContact CD1-CG 4.41Å
499	V	44.6	Very low	43.3	Very low	81 Å²	81	75.8 Å²	75.8	49%	0.491	38%	0.383	S	S	.	.	H	α-helix	trans	-65.5	-47.3	174.3	171.8	0	0	0	0	110.5	P495 T496 Y501 K502 E503	P495-V499 WeakPolarHBondContact O-CG2 3.23Å; P495-V499 PolarHBondContact O-N 2.83Å; T496-V499 PolarHBondContact O-N 2.91Å; V499-Y501 VanDerWaalsContact C-N 3.35Å; V499-Y501 PolarHBondContact O-N 3.04Å; V499-K502 PolarHBondContact O-N 3.21Å; V499-E503 PolarHBondContact O-N 3.16Å
500	A	42.3	Very low	42.5	Very low	58 Å²	58	80.6 Å²	80.6	48%	0.479	40%	0.401	S	S	.	.	H	α-helix	trans	-59	-44.4	175.9	0	0	0	0	0	112.2	T496 D497 K502 E503 Y504	T496-A500 PolarHBondContact O-N 2.65Å; D497-A500 PolarHBondContact O-N 2.77Å; A500-K502 PolarHBondContact O-N 3.22Å; A500-E503 PolarHBondContact O-N 2.8Å; A500-Y504 WeakPolarHBondContact O-CB 3.39Å; A500-Y504 PolarHBondContact O-N 3.1Å
501	Y	49	Very low	41.8	Very low	66 Å²	66	82.4 Å²	82.4	26%	0.259	42%	0.415	S	S	.	.	H	α-helix	trans	-58.5	-46	174.2	-177.9	-97.5	0	0	0	112.1	D497 V499 Y504 F505	D497-Y501 WeakPolarHBondContact O-CB 3.28Å; D497-Y501 PolarHBondContact O-N 2.64Å; V499-Y501 VanDerWaalsContact C-N 3.35Å; V499-Y501 PolarHBondContact O-N 3.04Å; Y501-Y504 PolarHBondContact O-N 3.3Å; Y501-F505 HydrophobicContact CE1-CD2 4.5Å; Y501-F505 WeakPolarHBondContact O-CB 3.24Å; Y501-F505 PolarHBondContact O-N 3.47Å
502	K	46.6	Very low	41.1	Very low	113 Å²	113	90.1 Å²	90.1	49%	0.491	45%	0.448	S	S	.	.	H	α-helix	trans	-68.4	-36.6	-179.4	-173	170.2	-178	173.7	0	112.9	Y498 V499 A500 N506	Y498-K502 VanDerWaalsContact O-CB 3.28Å; Y498-K502 WeakPolarHBondContact O-CB 3.01Å; Y498-K502 PolarHBondContact O-N 3.06Å; V499-K502 PolarHBondContact O-N 3.21Å; A500-K502 PolarHBondContact O-N 3.22Å; K502-N506 WeakPolarHBondContact O-CB 3.5Å; K502-N506 PolarHBondContact O-N 2.86Å; K502-N506 VanDerWaalsContact O-N 3.13Å; K502-N506 PolarHBondContact O-ND2 3.14Å
503	E	47.4	Very low	40.7	Very low	125 Å²	125	94.4 Å²	94.4	58%	0.584	48%	0.478	S	S	*	.	H	α-helix	trans	-65.4	-46.2	172.1	-72.3	-171.1	157.8	0	0	111.3	V499 A500 F505 N506 L507	V499-E503 PolarHBondContact O-N 3.16Å; A500-E503 PolarHBondContact O-N 2.8Å; E503-F505 PolarHBondContact O-N 3Å; E503-N506 PolarHBondContact O-N 3.43Å; E503-L507 WeakPolarHBondContact O-CG 3.33Å; E503-L507 PolarHBondContact O-N 3.12Å
504	Y	42.8	Very low	39.7	Very low	89 Å²	89	104 Å²	104	35%	0.349	51%	0.513	S	S	.	.	H	α-helix	trans	-60.9	-41.6	178.5	-174	-92.7	0	0	0	112.9	K366 I476 A500 Y501 T508	K366-Y504 VanDerWaalsContact CD-OH 3.28Å; K366-Y504 WeakPolarHBondContact CD-OH 3.01Å; K366-Y504 WeakPolarHBondContact CE-OH 3.27Å; K366-Y504 PolarHBondContact NZ-OH 2.04Å; I476-Y504 HydrophobicContact CD1-CE2 4.37Å; I476-Y504 VanDerWaalsContact CD1-OH 3.23Å; I476-Y504 WeakPolarHBondContact CD1-OH 3.4Å; A500-Y504 WeakPolarHBondContact O-CB 3.39Å; A500-Y504 PolarHBondContact O-N 3.1Å; Y501-Y504 PolarHBondContact O-N 3.3Å; Y504-T508 PolarHBondContact O-N 2.95Å; Y504-T508 PolarHBondContact O-OG1 3.39Å
505	F	41.6	Very low	39.1	Very low	97 Å²	97	105.5 Å²	105.5	43%	0.425	53%	0.53	S	S	.	.	H	α-helix	trans	-66	-46.1	176.5	-151.5	-80.9	0	0	0	111.5	P432 Y501 E503 L507 T508 V509	P432-F505 HydrophobicContact CG-CE2 4.2Å; Y501-F505 HydrophobicContact CE1-CD2 4.5Å; Y501-F505 WeakPolarHBondContact O-CB 3.24Å; Y501-F505 PolarHBondContact O-N 3.47Å; E503-F505 PolarHBondContact O-N 3Å; F505-L507 PolarHBondContact O-N 2.93Å; F505-T508 PolarHBondContact O-N 3.38Å; F505-V509 HydrophobicContact CD1-CG2 3.94Å; F505-V509 HydrophobicContact CE1-CG2 3.95Å; F505-V509 PolarHBondContact O-N 2.75Å
506	N	38.9	Very low	38.7	Very low	92 Å²	92	112.6 Å²	112.6	49%	0.492	56%	0.555	S	S	.	*	H	α-helix	trans	-62.2	-38.2	178.3	-81	-49.5	0	0	0	113.3	K502 E503 T508 V509 R510	K502-N506 WeakPolarHBondContact O-CB 3.5Å; K502-N506 PolarHBondContact O-N 2.86Å; K502-N506 VanDerWaalsContact O-N 3.13Å; K502-N506 PolarHBondContact O-ND2 3.14Å; E503-N506 PolarHBondContact O-N 3.43Å; N506-T508 PolarHBondContact O-N 3.4Å; N506-V509 PolarHBondContact O-N 2.77Å; N506-R510 PolarHBondContact O-N 3.04Å; N506-R510 VanDerWaalsContact O-N 3.09Å
507	L	35.8	Very low	38.2	Very low	128 Å²	128	117 Å²	117	67%	0.67	57%	0.569	S	S	*	*	H	α-helix	trans	-63.2	-30.9	172.9	-73.2	168.2	0	0	0	112.5	E503 F505	E503-L507 WeakPolarHBondContact O-CG 3.33Å; E503-L507 PolarHBondContact O-N 3.12Å; F505-L507 PolarHBondContact O-N 2.93Å
508	T	36.9	Very low	37.4	Very low	62 Å²	62	121.5 Å²	121.5	38%	0.38	59%	0.591	S	S	.	*	H	α-helix	trans	-84.3	-23.5	-178	-52.1	0	0	0	0	112.9	Y504 F505 N506 S511	Y504-T508 PolarHBondContact O-N 2.95Å; Y504-T508 PolarHBondContact O-OG1 3.39Å; F505-T508 PolarHBondContact O-N 3.38Å; N506-T508 PolarHBondContact O-N 3.4Å; T508-S511 PolarHBondContact O-OG 3.31Å
509	V	33.3	Very low	36.4	Very low	84 Å²	84	124.6 Å²	124.6	51%	0.509	61%	0.613	S	S	.	*	H	α-helix	trans	-82.3	-41.9	172.3	177.2	0	0	0	0	111.5	F505 N506 S511 K512	F505-V509 HydrophobicContact CD1-CG2 3.94Å; F505-V509 HydrophobicContact CE1-CG2 3.95Å; F505-V509 PolarHBondContact O-N 2.75Å; N506-V509 PolarHBondContact O-N 2.77Å; V509-S511 PolarHBondContact O-N 3.4Å; V509-K512 PolarHBondContact O-N 3.45Å
510	R	32.3	Very low	35.5	Very low	208 Å²	208	125.5 Å²	125.5	79%	0.785	62%	0.623	S	S	*	*	H	α-helix	trans	-64.5	-19.7	-179	-98.9	-178	170	165.4	-1.3	114.9	N506	N506-R510 PolarHBondContact O-N 3.04Å; N506-R510 VanDerWaalsContact O-N 3.09Å
511	S	33.6	Very low	34.9	Very low	78 Å²	78	129.5 Å²	129.5	55%	0.545	64%	0.636	S	S	.	*	T	Hydrogen-bonded Turn	trans	-81.2	-11	173.8	55.3	0	0	0	0	114.1	T508 V509	T508-S511 PolarHBondContact O-OG 3.31Å; V509-S511 PolarHBondContact O-N 3.4Å
512	K	33.9	Very low	34.2	Very low	172 Å²	172	133.8 Å²	133.8	75%	0.748	66%	0.658	S	S	*	*	S	Bend	trans	-98.9	-2.4	178.9	-72.5	-173	175.6	-178.5	0	114.8	V509	V509-K512 PolarHBondContact O-N 3.45Å
513	S	33.2	Very low	33.4	Very low	95 Å²	95	134.2 Å²	134.2	66%	0.664	67%	0.666	S	S	*	*	S	Bend	trans	-106.2	10	178.6	69.1	0	0	0	0	115
514	R	29.6	Very low	32.6	Very low	216 Å²	216	134.5 Å²	134.5	82%	0.815	67%	0.672	S	S	*	*	S	Bend	trans	-135.2	78.1	172.8	-77.4	-176.2	170.4	174.1	-3.9	110.4
515	D	29.7	Very low	31.9	Very low	162 Å²	162	136.7 Å²	136.7	87%	0.866	69%	0.689	S	S	*	*			trans	-168.1	61.5	159.7	-98.2	-26.3	0	0	0	111.6
516	K	28.3	Very low	31.3	Very low	211 Å²	211	137.5 Å²	137.5	92%	0.917	70%	0.698	S	S	*	*			trans	-147.3	59.4	166.4	-82	-158.5	175	-178.8	0	112
517	Q	30.9	Very low	30.9	Very low	191 Å²	191	139.6 Å²	139.6	89%	0.893	71%	0.709	S	S	*	*			trans	-147.7	72.1	171	-149.5	164.8	5.9	0	0	113.9
518	I	27.2	Very low	30.7	Very low	144 Å²	144	138.7 Å²	138.7	74%	0.738	71%	0.705	S	S	*	*			trans	36.1	117.3	137	-59.6	179.4	0	0	0	119.2
519	N	27.1	Very low	30.3	Very low	144 Å²	144	142.8 Å²	142.8	77%	0.77	72%	0.718	S	S	*	*			trans	76.5	144.2	150.5	-66.5	0.2	0	0	0	122.6
520	S	26.2	Very low	30.1	Very low	100 Å²	100	145.9 Å²	145.9	70%	0.699	73%	0.727	S	S	*	*			trans	59.9	133	153.9	45.4	0	0	0	0	118.6
521	D	29.2	Very low	29.8	Very low	142 Å²	142	141.8 Å²	141.8	76%	0.759	72%	0.72	S	S	*	*			cis	-159.2	169.3	-0.1	-104.4	-37.2	0	0	0	111.9
522	H	33.1	Very low	29.7	Very low	156 Å²	156	144.7 Å²	144.7	72%	0.722	73%	0.73	S	S	*	*			trans	63.9	115	155.4	-75	-1.9	0	0	0	122.5
523	N	30.4	Very low	29.2	Very low	122 Å²	122	145.6 Å²	145.6	65%	0.652	73%	0.734	S	S	*	*				64.7	119.5	124.1	-56.9	-15.1	0	0	0	122.5
524	N	30.4	Very low	29	Very low	132 Å²	132	151.1 Å²	151.1	71%	0.706	75%	0.746	S	S	*	*			trans	66.1	116.7	131.5	-61.6	-4.6	0	0	0	118.8
525	N	28.1	Very low	28.7	Very low	134 Å²	134	145.4 Å²	145.4	72%	0.717	74%	0.739	S	S	*	*				65	136.8	87.4	-68	47.6	0	0	0	113.4
526	D	30.2	Very low	28.6	Very low	115 Å²	115	147.3 Å²	147.3	62%	0.615	74%	0.74	S	S	*	*			cis	-168.2	144.1	5.2	-119.2	-36.4	0	0	0	111.6
527	N	29.4	Very low	28.3	Very low	135 Å²	135	144.2 Å²	144.2	72%	0.722	73%	0.733	S	S	*	*			trans	58.8	174.7	152.5	-56.1	-55.2	0	0	0	118.4
528	D	31.4	Very low	27.9	Very low	109 Å²	109	142.7 Å²	142.7	58%	0.583	73%	0.726	S	S	*	*			cis	-156.2	162.4	7.2	-148	-5.6	0	0	0	115.6
529	K	29.4	Very low	27.7	Very low	149 Å²	149	141.7 Å²	141.7	65%	0.648	73%	0.726	S	S	*	*			trans	31.1	117.7	154.2	-75.7	156.7	-164.4	79.4	0	121.7
530	Q	28	Very low	27.7	Very low	148 Å²	148	140.2 Å²	140.2	69%	0.692	72%	0.722	S	S	*	*				58.8	128.3	91.3	-68.2	-173.5	-4.2	0	0	117.1
531	N	26.7	Very low	27.7	Very low	122 Å²	122	141.5 Å²	141.5	65%	0.652	73%	0.726	S	S	*	*				-178.8	176.6	69.6	-118.9	-45.4	0	0	0	115.2
532	N	30.6	Very low	27.9	Very low	140 Å²	140	139.8 Å²	139.8	75%	0.749	72%	0.723	S	S	*	*			trans	73.1	110.1	171.7	-58.7	-17	0	0	0	116.5
533	K	24.9	Very low	27.4	Very low	190 Å²	190	139.7 Å²	139.7	83%	0.826	73%	0.727	S	S	*	*				62	103.2	63.8	-73	-170.1	173	-179.6	0	115.4
534	F	28	Very low	27.4	Very low	211 Å²	211	140.8 Å²	140.8	93%	0.925	74%	0.738	S	S	*	*				-160	173	107	-116.7	-78.6	0	0	0	111.3
535	S	22.9	Very low	26.9	Very low	96 Å²	96	142 Å²	142	67%	0.671	74%	0.742	S	S	*	*			trans	-128.4	134.7	-160.8	55.9	0	0	0	0	115.1
536	K	27.5	Very low	26.9	Very low	202 Å²	202	142.5 Å²	142.5	88%	0.878	75%	0.75	S	S	*	*			trans	-179.9	122.3	143.6	-99.2	167.3	-178.8	-172.1	0	106.5
537	L	22.5	Very low	26.7	Very low	147 Å²	147	142.2 Å²	142.2	77%	0.77	75%	0.752	S	S	*	*				80.8	117.2	55.1	-156.7	88.9	0	0	0	113.4
538	Q	23.3	Very low	26.5	Very low	159 Å²	159	143 Å²	143	74%	0.743	76%	0.755	S	S	*	*			trans	75.9	132.6	160.7	-84.1	166.3	-26.3	0	0	121.9
539	T	23.4	Very low	26.1	Very low	122 Å²	122	142.7 Å²	142.7	75%	0.748	75%	0.749	S	S	*	*			trans	64.1	139.1	148.1	55.3	0	0	0	0	119.8
540	T	26.2	Very low	26.1	Very low	113 Å²	113	140.8 Å²	140.8	69%	0.693	75%	0.754	S	S	*	*			cis	-164.6	122.4	-0.7	10.1	0	0	0	0	112.9
541	T	25.5	Very low	26.1	Very low	127 Å²	127	140.3 Å²	140.3	78%	0.779	76%	0.756	S	S	*	*			trans	57.9	171.9	135.2	62.1	0	0	0	0	120
542	P	33.9	Very low	25.9	Very low	107 Å²	107	143.6 Å²	143.6	70%	0.695	77%	0.767	S	S	*	*				-140.1	-164.7	-99.8	36.6	-11.4	0	0	0	116.6
543	L	23.1	Very low	25.5	Very low	154 Å²	154	144.4 Å²	144.4	81%	0.806	77%	0.769	S	S	*	*			trans	78.3	144.7	171.4	-55.5	168.5	0	0	0	114.4
544	T	29.5	Very low	25.5	Very low	145 Å²	145	141 Å²	141	89%	0.89	76%	0.758	S	S	*	*			cis	-125.1	-177	39.6	51.3	0	0	0	0	116
545	M	21.4	Very low	25.4	Very low	157 Å²	157	137 Å²	137	77%	0.773	75%	0.751	S	S	*	*			trans	-142.6	146.1	-172.9	-175.8	-169.9	-171.9	0	0	111.2	T547	M545-T547 HydrophobicContact CE-CG2 4.29Å
546	T	27.7	Very low	25.5	Very low	144 Å²	144	138.9 Å²	138.9	88%	0.883	75%	0.754	S	S	*	*			trans	-152.3	156.7	159.2	15.4	0	0	0	0	112.3
547	T	24.6	Very low	25.4	Very low	110 Å²	110	134 Å²	134	68%	0.675	74%	0.743	S	S	*	*			trans	-109.9	-174.3	-173.2	46.6	0	0	0	0	111.1	M545	M545-T547 HydrophobicContact CE-CG2 4.29Å
548	I	26	Very low	25.5	Very low	151 Å²	151	134.4 Å²	134.4	77%	0.774	74%	0.744	S	S	*	*			cis	-145.3	146.1	24.8	-64.7	173.7	0	0	0	107.6
549	K	24	Very low	25.4	Very low	103 Å²	103	132.7 Å²	132.7	45%	0.448	74%	0.744	S	S	.	*			cis	91.7	75.8	20.6	-165	-97.4	108.1	-154.3	0	116.5	M553 I554	K549-M553 WeakPolarHBondContact CE-O 3.49Å; K549-M553 PolarHBondContact NZ-O 3.05Å; K549-I554 HydrophobicContact CD-CD1 4.44Å
550	S	27.9	Very low	25.5	Very low	108 Å²	108	134.7 Å²	134.7	76%	0.755	75%	0.749	S	S	*	*			trans	-124	142.1	158.2	54.8	0	0	0	0	110.5
551	N	28.3	Very low	25.3	Very low	139 Å²	139	137.6 Å²	137.6	74%	0.743	75%	0.752	S	S	*	*	S	Bend	cis	-138.7	-179.4	-6	-111.8	3.2	0	0	0	112.5
552	E	23.3	Very low	25.3	Very low	190 Å²	190	139 Å²	139	89%	0.888	75%	0.75	S	S	*	*	S	Bend	trans	65.4	53.7	-179.8	-58.7	-163.7	168.4	0	0	116.8
553	M	22.6	Very low	24.8	Very low	158 Å²	158	141.2 Å²	141.2	78%	0.778	75%	0.75	S	S	*	*			trans	-162.9	156.5	144.5	-123	-173.4	-178.2	0	0	110.9	K549	K549-M553 WeakPolarHBondContact CE-O 3.49Å; K549-M553 PolarHBondContact NZ-O 3.05Å
554	I	24.2	Very low	24.9	Very low	118 Å²	118	138.5 Å²	138.5	61%	0.605	74%	0.744	S	S	*	*			trans	83.6	111.4	173.3	-53.6	167.2	0	0	0	116.9	K549	K549-I554 HydrophobicContact CD-CD1 4.44Å
555	T	26	Very low	24.8	Very low	126 Å²	126	138.1 Å²	138.1	77%	0.773	74%	0.742	S	S	*	*	S	Bend		-136.2	144	110.9	47.8	0	0	0	0	107.2
556	N	24.6	Very low	25.1	Very low	137 Å²	137	138.4 Å²	138.4	73%	0.733	75%	0.746	S	S	*	*			cis	-141.2	143.4	-13.3	-89.8	-26.5	0	0	0	110.2
557	P	25.3	Very low	25.1	Very low	99 Å²	99	136.3 Å²	136.3	64%	0.643	74%	0.735	S	S	*	*			trans	-93.9	129.9	164.4	34.3	-28.1	0	0	0	111
558	I	24.5	Very low	25.4	Very low	156 Å²	156	140.4 Å²	140.4	80%	0.8	74%	0.743	S	S	*	*			trans	-104.3	127.3	166.3	-63.6	178.9	0	0	0	108.4
559	V	22.9	Very low	26	Very low	122 Å²	122	137.8 Å²	137.8	74%	0.739	73%	0.73	S	S	*	*			trans	-104.6	115.2	176.9	177.5	0	0	0	0	109.2
560	L	25.2	Very low	26.7	Very low	164 Å²	164	137.5 Å²	137.5	86%	0.859	73%	0.732	S	S	*	*			trans	-112.3	107.7	161.7	-81.1	169.9	0	0	0	109.5
561	K	21.3	Very low	27.5	Very low	175 Å²	175	137.6 Å²	137.6	76%	0.761	72%	0.717	S	S	*	*			trans	-78	126.4	152.7	-71	179	177.9	178.3	0	106.9
562	H	25	Very low	28.1	Very low	156 Å²	156	133.8 Å²	133.8	72%	0.722	70%	0.7	S	S	*	*				178.8	156.3	114.1	-105.5	-88.5	0	0	0	111.6
563	H	24	Very low	29.3	Very low	153 Å²	153	125.5 Å²	125.5	71%	0.708	66%	0.662	S	S	*	*			trans	45.9	103.5	161.4	-67.5	-65.1	0	0	0	121.2
564	S	24.4	Very low	30.2	Very low	97 Å²	97	120.4 Å²	120.4	68%	0.678	64%	0.642	S	S	*	*	S	Bend	trans	63.9	143.3	135.3	44.8	0	0	0	0	121.2
565	T	28	Very low	30.9	Very low	138 Å²	138	119 Å²	119	85%	0.847	64%	0.64	S	S	*	*			trans	55.2	55.6	163.8	53.2	0	0	0	0	116.9
566	L	27.7	Very low	31.6	Very low	163 Å²	163	116.8 Å²	116.8	85%	0.853	62%	0.624	S	S	*	*			trans	-68	131.9	152.1	-81.6	167	0	0	0	109.5
567	P	28.7	Very low	32.5	Very low	99 Å²	99	115.5 Å²	115.5	64%	0.643	62%	0.617	S	S	*	*			trans	-69.3	161.9	178.4	29.2	-34.8	0	0	0	111.7	I569	P567-I569 VanDerWaalsContact C-N 3.26Å; P567-I569 HydrophobicContact CG-CG1 4.46Å; P567-I569 PolarHBondContact O-N 3.17Å
568	K	30.1	Very low	33.4	Very low	197 Å²	197	113 Å²	113	86%	0.857	60%	0.597	S	S	*	*			trans	-73.3	76.6	177.4	-67	175.1	-177.4	168.9	0	110.7	I570	K568-I570 PolarHBondContact O-N 3.4Å
569	I	37.7	Very low	34.1	Very low	95 Å²	95	106.9 Å²	106.9	49%	0.487	57%	0.568	S	S	.	*			trans	-63	120.8	171.8	-60.3	175.2	0	0	0	108.4	P495 P567	P495-I569 WeakPolarHBondContact CD-O 3.43Å; P495-I569 VanDerWaalsContact CG-O 3.31Å; P495-I569 WeakPolarHBondContact CG-O 3.36Å; P567-I569 VanDerWaalsContact C-N 3.26Å; P567-I569 HydrophobicContact CG-CG1 4.46Å; P567-I569 PolarHBondContact O-N 3.17Å
570	I	39.7	Very low	34.9	Very low	98 Å²	98	104.1 Å²	104.1	50%	0.503	55%	0.549	S	S	.	.			trans	-100.4	123.8	179	-72.5	170.7	0	0	0	107.4	A483 C492 K568 C572	A483-I570 HydrophobicContact CB-CG2 4.15Å; C492-I570 HydrophobicContact CB-CG2 3.26Å; K568-I570 PolarHBondContact O-N 3.4Å; I570-C572 PolarHBondContact O-N 3.22Å
571	Y	44.8	Very low	35.6	Very low	109 Å²	109	103.3 Å²	103.3	43%	0.427	55%	0.546	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	99.3	-179.8	-71.6	-79.1	0	0	0	110.3	C492 V493 P495 Y498	C492-Y571 CarbonylContact C-O 3.54Å; C492-Y571 WeakPolarHBondContact CA-O 3.38Å; V493-Y571 PolarHBondContact N-O 3.25Å; V493-Y571 PolarHBondContact O-N 3.01Å; P495-Y571 HydrophobicContact CB-CD2 4.35Å; P495-Y571 HydrophobicContact CB-CE2 3.91Å; P495-Y571 HydrophobicContact CG-CD2 4.11Å; P495-Y571 HydrophobicContact CG-CE2 3.84Å; Y498-Y571 HydrophobicContact CD1-CD2 4.39Å; Y498-Y571 HydrophobicContact CD1-CG 4.41Å
572	C	41	Very low	36.2	Very low	59 Å²	59	104 Å²	104	40%	0.399	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	136.2	174.1	-66.6	0	0	0	0	111.6	V490 C492 I570	V490-C572 HydrophobicContact CG1-CB 3.87Å; C492-C572 HydrophobicContact CB-CB 3.94Å; C492-C572 WeakPolarHBondContact CB-SG 3.2Å; C492-C572 WeakPolarHBondContact SG-CA 3.27Å; C492-C572 WeakPolarHBondContact SG-CB 3.44Å; C492-C572 CovalentContact SG-SG 2.04Å; C492-C572 PolarHBondContact SG-SG 3.28Å; I570-C572 PolarHBondContact O-N 3.22Å
573	L	49	Very low	36.7	Very low	16 Å²	16	104.5 Å²	104.5	8%	0.084	55%	0.55	C	S	.	.	P	Polyproline II helix	trans	-80.6	124.8	-179.6	-68	168.6	0	0	0	109.9	P491 V493 I578	P491-L573 PolarHBondContact O-N 2.79Å; P491-L573 VanDerWaalsContact O-N 3.14Å; V493-L573 HydrophobicContact CG2-CD1 3.99Å; V493-L573 HydrophobicContact CG2-CG 4.13Å; L573-I578 HydrophobicContact CB-CD1 4.41Å
574	S	40.7	Very low	37.2	Very low	52 Å²	52	104.4 Å²	104.4	36%	0.364	55%	0.554	S	S	.	*	P	Polyproline II helix	trans	-56.5	138.6	172.1	168.8	0	0	0	0	110.7	N576 L577	S574-N576 PolarHBondContact O-N 2.99Å; S574-N576 VanDerWaalsContact O-N 3.09Å; S574-N576 PolarHBondContact OG-N 2.81Å; S574-L577 WeakPolarHBondContact O-CB 3.02Å; S574-L577 PolarHBondContact O-N 3.43Å
575	P	39.6	Very low	37.6	Very low	87 Å²	87	102 Å²	102	57%	0.565	54%	0.538	S	S	*	.	H	α-helix	trans	-51.2	-33.1	174.3	-28.3	35.8	0	0	0	113.6	L577 I578 C579	P575-L577 VanDerWaalsContact C-N 3.27Å; P575-L577 PolarHBondContact O-N 2.93Å; P575-I578 WeakPolarHBondContact O-CA 3.07Å; P575-I578 WeakPolarHBondContact O-CB 3.34Å; P575-I578 PolarHBondContact O-N 3.34Å; P575-C579 WeakPolarHBondContact O-CB 3.5Å; P575-C579 PolarHBondContact O-N 3.09Å; P575-C579 PolarHBondContact O-SG 3Å
576	N	39.2	Very low	37.9	Very low	81 Å²	81	101.3 Å²	101.3	43%	0.433	54%	0.535	S	S	.	.	H	α-helix	trans	-62.7	-31.7	179.5	-65.6	-29	0	0	0	112.7	S574 I578 E591	S574-N576 PolarHBondContact O-N 2.99Å; S574-N576 VanDerWaalsContact O-N 3.09Å; S574-N576 PolarHBondContact OG-N 2.81Å; N576-I578 VanDerWaalsContact C-N 3.32Å; N576-E591 PolarHBondContact ND2-OE1 3.4Å
577	L	44.4	Very low	38.3	Very low	110 Å²	110	100.3 Å²	100.3	58%	0.576	53%	0.531	S	S	*	.	H	α-helix	trans	-76.2	-16.5	172.9	-78.8	163.2	0	0	0	113.6	S574 P575	S574-L577 WeakPolarHBondContact O-CB 3.02Å; S574-L577 PolarHBondContact O-N 3.43Å; P575-L577 VanDerWaalsContact C-N 3.27Å; P575-L577 PolarHBondContact O-N 2.93Å
578	I	44.6	Very low	38.4	Very low	45 Å²	45	99.4 Å²	99.4	23%	0.231	54%	0.539	C	S	.	.	H	α-helix	trans	-90.4	-25.5	176.3	-58.8	174.4	0	0	0	110.3	I434 P491 L573 P575 N576	I434-I578 HydrophobicContact CB-CG2 4.08Å; I434-I578 HydrophobicContact CD1-CG1 4.23Å; I434-I578 HydrophobicContact CG2-CG1 4.22Å; I434-I578 HydrophobicContact CG2-CG2 4Å; P491-I578 HydrophobicContact CG-CD1 3.63Å; L573-I578 HydrophobicContact CB-CD1 4.41Å; P575-I578 WeakPolarHBondContact O-CA 3.07Å; P575-I578 WeakPolarHBondContact O-CB 3.34Å; P575-I578 PolarHBondContact O-N 3.34Å; N576-I578 VanDerWaalsContact C-N 3.32Å
579	C	37.3	Very low	38.3	Very low	29 Å²	29	97.7 Å²	97.7	20%	0.196	53%	0.534	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.3	-8.8	-173.4	-81.3	0	0	0	0	116.8	P575 N581 R582 C585	P575-C579 WeakPolarHBondContact O-CB 3.5Å; P575-C579 PolarHBondContact O-N 3.09Å; P575-C579 PolarHBondContact O-SG 3Å; C579-N581 VanDerWaalsContact C-N 3.25Å; C579-N581 PolarHBondContact O-N 3.35Å; C579-R582 PolarHBondContact O-N 2.92Å; C579-C585 HydrophobicContact CB-CB 4.19Å; C579-C585 WeakPolarHBondContact CB-SG 3.35Å; C579-C585 WeakPolarHBondContact SG-CB 3.43Å; C579-C585 CovalentContact SG-SG 2.04Å; C579-C585 PolarHBondContact SG-SG 2.96Å
580	N	41.4	Very low	38.1	Very low	64 Å²	64	99.5 Å²	99.5	34%	0.342	55%	0.545	S	S	.	.	T	Hydrogen-bonded Turn	trans	41.7	48.8	-170.7	-70.5	20.3	0	0	0	113.2	E431 P432 R582	E431-N580 PolarHBondContact OE2-ND2 3.48Å; E431-N580 VanDerWaalsContact OE2-ND2 3.16Å; P432-N580 PolarHBondContact O-ND2 3.19Å; P432-N580 VanDerWaalsContact O-ND2 3.1Å; N580-R582 PolarHBondContact O-N 3.44Å
581	N	38.8	Very low	37.7	Very low	147 Å²	147	102.6 Å²	102.6	79%	0.786	56%	0.557	S	S	*	*	T	Hydrogen-bonded Turn	trans	50.1	31.7	178.2	-66.1	3.6	0	0	0	115.7	C579	C579-N581 VanDerWaalsContact C-N 3.25Å; C579-N581 PolarHBondContact O-N 3.35Å
582	R	34.3	Very low	37.2	Very low	188 Å²	188	105.7 Å²	105.7	71%	0.709	58%	0.576	S	S	*	*			trans	-77.2	127.2	170.1	-69	-169.3	176.5	-155	-0.3	110.4	C579 N580 N584	C579-R582 PolarHBondContact O-N 2.92Å; N580-R582 PolarHBondContact O-N 3.44Å; R582-N584 PolarHBondContact O-N 3.02Å
583	I	35.4	Very low	36.6	Very low	167 Å²	167	110.5 Å²	110.5	86%	0.856	59%	0.594	S	S	*	*	S	Bend	trans	-58.1	-21.7	-176.6	-64.9	167.2	0	0	0	113.2
584	N	34.8	Very low	35.5	Very low	151 Å²	151	114.5 Å²	114.5	81%	0.807	62%	0.623	S	S	*	*			trans	-105.4	70.7	176.3	-63.8	36.6	0	0	0	110.7	R582	R582-N584 PolarHBondContact O-N 3.02Å
585	C	32.4	Very low	35	Very low	48 Å²	48	118 Å²	118	32%	0.324	64%	0.644	S	S	.	*	S	Bend	trans	-105.5	142.6	153.8	-80.7	0	0	0	0	108.6	C579 N587	C579-C585 HydrophobicContact CB-CB 4.19Å; C579-C585 WeakPolarHBondContact CB-SG 3.35Å; C579-C585 WeakPolarHBondContact SG-CB 3.43Å; C579-C585 CovalentContact SG-SG 2.04Å; C579-C585 PolarHBondContact SG-SG 2.96Å; C585-N587 PolarHBondContact O-N 3.43Å
586	P	35	Very low	34.6	Very low	123 Å²	123	123.9 Å²	123.9	80%	0.799	66%	0.655	S	S	*	*	S	Bend	trans	-65.7	125.8	-172.9	26.4	-33.4	0	0	0	110.5
587	N	35.7	Very low	34	Very low	141 Å²	141	125.4 Å²	125.4	75%	0.754	67%	0.669	S	S	*	*			trans	49	94	172.6	-60.2	11.1	0	0	0	115.9	C585 E589	C585-N587 PolarHBondContact O-N 3.43Å; N587-E589 PolarHBondContact O-N 3.46Å
588	G	30.6	Very low	33.2	Very low	80 Å²	80	127 Å²	127	83%	0.825	69%	0.686	S	S	*	*			trans	-83.1	43.6	161.3	0	0	0	0	0	112.5
589	E	28.9	Very low	32.6	Very low	161 Å²	161	128.1 Å²	128.1	75%	0.752	71%	0.709	S	S	*	*			trans	-126	136.2	174.1	-66.5	175.2	-170.1	0	0	105.1	N587	N587-E589 PolarHBondContact O-N 3.46Å
590	D	33.1	Very low	32.1	Very low	133 Å²	133	130.3 Å²	130.3	71%	0.711	74%	0.737	S	S	*	*			trans	87.3	47.1	-167.6	-54.5	-24.8	0	0	0	118.6	E592	D590-E592 PolarHBondContact O-N 3.35Å; D590-E592 VanDerWaalsContact O-N 3.13Å
591	E	30.9	Very low	31.5	Very low	163 Å²	163	135.8 Å²	135.8	76%	0.762	77%	0.765	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	3	169	-74.2	-148.1	141.7	0	0	115.2	N576	N576-E591 PolarHBondContact ND2-OE1 3.4Å
592	E	33.2	Very low	31	Very low	175 Å²	175	137.8 Å²	137.8	82%	0.818	77%	0.77	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.5	-17	-179.5	-62.1	-154.9	122	0	0	115.4	D590 C594	D590-E592 PolarHBondContact O-N 3.35Å; D590-E592 VanDerWaalsContact O-N 3.13Å; E592-C594 PolarHBondContact O-N 2.04Å
593	M	28.5	Very low	30.7	Very low	159 Å²	159	132.9 Å²	132.9	78%	0.783	77%	0.769	S	S	*	*			trans	-79.6	43.7	-176.4	-72.9	-154.8	174.8	0	0	115
594	C	27.6	Very low	30.3	Very low	101 Å²	101	134.5 Å²	134.5	68%	0.682	77%	0.771	S	S	*	*	S	Bend	trans	-120.6	112.4	166.3	-83.6	0	0	0	0	109.5	E592 R596	E592-C594 PolarHBondContact O-N 2.04Å; C594-R596 PolarHBondContact O-N 3.41Å
595	P	29.6	Very low	29.9	Very low	126 Å²	126	134.5 Å²	134.5	82%	0.818	77%	0.771	S	S	*	*			trans	-65.9	104.3	-173.6	25.3	-33.9	0	0	0	111.5
596	R	30.6	Very low	29.6	Very low	209 Å²	209	139.8 Å²	139.8	79%	0.789	79%	0.794	S	S	*	*			trans	-64.9	138.4	165.7	-59.4	-179.4	-171.8	168.5	6.7	107.8	C594	C594-R596 PolarHBondContact O-N 3.41Å
597	P	27.7	Very low	29.2	Very low	113 Å²	113	139.4 Å²	139.4	73%	0.734	79%	0.792	S	S	*	*			trans	-61.2	134.7	178.4	25.5	-33.7	0	0	0	110.1	G599	P597-G599 PolarHBondContact O-N 2.79Å
598	P	26.5	Very low	28.6	Very low	143 Å²	143	138.3 Å²	138.3	93%	0.929	79%	0.79	S	S	*	*	S	Bend	trans	-71.4	95.9	-178.9	28.1	-33.9	0	0	0	110.5
599	G	31.7	Very low	28.3	Very low	69 Å²	69	142.1 Å²	142.1	71%	0.711	79%	0.786	S	S	*	*			trans	-177.7	100.6	179.1	0	0	0	0	0	108.6	P597	P597-G599 PolarHBondContact O-N 2.79Å
600	G	26.5	Very low	28.2	Very low	76 Å²	76	142.1 Å²	142.1	78%	0.784	78%	0.783	S	S	*	*			trans	-71	144.4	-163.7	0	0	0	0	0	115.1
601	L	29.5	Very low	27.9	Very low	178 Å²	178	143.6 Å²	143.6	93%	0.932	79%	0.786	S	S	*	*			trans	-126.2	133	138.5	-85.4	170.4	0	0	0	106.3
602	E	29.4	Very low	27.8	Very low	189 Å²	189	142 Å²	142	88%	0.883	78%	0.782	S	S	*	*			trans	-79.5	167.9	-166.2	-66.4	169.9	129.9	0	0	112.8
603	A	26.2	Very low	27.6	Very low	85 Å²	85	138.5 Å²	138.5	70%	0.702	78%	0.777	S	S	*	*			trans	-69	147.4	-176.8	0	0	0	0	0	112.5
604	F	28.7	Very low	27.7	Very low	202 Å²	202	138 Å²	138	89%	0.886	78%	0.776	S	S	*	*			trans	-142.1	113.3	151.9	-94.3	-72.4	0	0	0	110.4
605	D	26.6	Very low	27.8	Very low	151 Å²	151	139.9 Å²	139.9	81%	0.807	78%	0.779	S	S	*	*			trans	-64.7	150.3	165.6	-77.7	-62.9	0	0	0	111.3
606	I	24.9	Very low	27.8	Very low	158 Å²	158	140.4 Å²	140.4	81%	0.81	78%	0.775	S	S	*	*			trans	-121.8	88.5	172.6	-54.3	179.2	0	0	0	109.8
607	P	26.6	Very low	27.7	Very low	116 Å²	116	137.1 Å²	137.1	75%	0.753	77%	0.772	S	S	*	*			trans	-77.7	135.5	162.8	31.7	-31.7	0	0	0	110.4
608	V	23.7	Very low	27.8	Very low	117 Å²	117	137.5 Å²	137.5	71%	0.709	77%	0.768	S	S	*	*			trans	-84.2	122.3	-175.1	177.6	0	0	0	0	111.5
609	H	24.5	Very low	27.8	Very low	161 Å²	161	137.1 Å²	137.1	75%	0.745	76%	0.757	S	S	*	*				176	145	123.6	-100.7	-58.9	0	0	0	117.4
610	K	27.5	Very low	27.6	Very low	160 Å²	160	142.5 Å²	142.5	70%	0.696	76%	0.764	S	S	*	*			trans	75.4	112.1	149	-69.6	168.9	-179.1	179.8	0	121.1
611	H	25.6	Very low	27.5	Very low	165 Å²	165	145 Å²	145	76%	0.764	76%	0.764	S	S	*	*				37.7	126.5	114.6	-78.8	-81.1	0	0	0	118.3
612	D	28.7	Very low	27.5	Very low	129 Å²	129	143 Å²	143	69%	0.69	76%	0.759	S	S	*	*			cis	-173.1	160.1	34.8	-93.1	-40.6	0	0	0	112.4
613	S	30.1	Very low	27.4	Very low	102 Å²	102	141.7 Å²	141.7	71%	0.713	75%	0.753	S	S	*	*			trans	63.4	132.2	163.7	41.6	0	0	0	0	120.1
614	I	29.3	Very low	27.5	Very low	149 Å²	149	145 Å²	145	76%	0.764	75%	0.754	S	S	*	*			cis	79.3	129.1	44.5	-67.1	167.1	0	0	0	112.2
615	D	29.3	Very low	27.4	Very low	140 Å²	140	141.2 Å²	141.2	75%	0.749	75%	0.748	S	S	*	*			cis	-156.7	-178.5	-15.7	-94.3	-18.3	0	0	0	105.4
616	D	30.9	Very low	27.4	Very low	137 Å²	137	139.4 Å²	139.4	73%	0.733	75%	0.747	S	S	*	*			cis	-120.9	-174.1	23.3	-97.5	-51.1	0	0	0	110.6
617	L	28.1	Very low	27.5	Very low	139 Å²	139	138.5 Å²	138.5	73%	0.728	75%	0.749	S	S	*	*			cis	66.1	137.9	40.8	-61.5	162.4	0	0	0	114.2
618	N	29	Very low	27.7	Very low	121 Å²	121	139.7 Å²	139.7	65%	0.647	76%	0.755	S	S	*	*			cis	-157.6	162.5	18.6	-141.4	-15.7	0	0	0	114.4
619	I	26.3	Very low	27.8	Very low	136 Å²	136	145 Å²	145	70%	0.697	76%	0.762	S	S	*	*			trans	-1.4	131.9	153.4	-65.2	162.7	0	0	0	116.7
620	Q	28.7	Very low	28	Very low	182 Å²	182	145.1 Å²	145.1	85%	0.85	76%	0.76	S	S	*	*				-167.7	168.3	74.8	-151.2	153.3	37.5	0	0	115.5
621	T	23.9	Very low	28	Very low	127 Å²	127	143.5 Å²	143.5	78%	0.779	76%	0.758	S	S	*	*			trans	-101.2	136.1	-177.1	50.3	0	0	0	0	114.9
622	T	29.7	Very low	28.1	Very low	137 Å²	137	142.6 Å²	142.6	84%	0.84	76%	0.758	S	S	*	*			trans	-153.3	111.5	150.8	32.8	0	0	0	0	112.5
623	E	27.2	Very low	28.2	Very low	162 Å²	162	141.2 Å²	141.2	76%	0.757	76%	0.759	S	S	*	*				48.9	150.2	129.5	-87.5	-174.2	-139.8	0	0	126.3
624	Q	28.5	Very low	28.2	Very low	153 Å²	153	142 Å²	142	72%	0.715	76%	0.755	S	S	*	*			trans	79.8	96.1	151.1	-74.1	172.7	50.8	0	0	121.3
625	T	26.6	Very low	28.2	Very low	123 Å²	123	137.7 Å²	137.7	76%	0.755	74%	0.738	S	S	*	*				29.9	125.3	119.6	57	0	0	0	0	118.1
626	S	27.3	Very low	28.2	Very low	114 Å²	114	133.8 Å²	133.8	80%	0.797	72%	0.722	S	S	*	*				-173.6	172.8	59.8	47.6	0	0	0	0	112.7
627	T	25.9	Very low	28.2	Very low	138 Å²	138	133.5 Å²	133.5	85%	0.847	73%	0.725	S	S	*	*			trans	-66.9	129.6	-172.8	49.7	0	0	0	0	115.5
628	T	30.3	Very low	28.5	Very low	142 Å²	142	131.9 Å²	131.9	87%	0.871	73%	0.725	S	S	*	*			trans	-129.5	136.5	148.9	26.1	0	0	0	0	111.8
629	R	26.3	Very low	28.5	Very low	228 Å²	228	134.3 Å²	134.3	86%	0.86	73%	0.732	S	S	*	*			trans	-68.3	164	160.8	-65.5	173.5	176.3	167.7	-2.3	108.5
630	K	28.1	Very low	28.9	Very low	163 Å²	163	134.6 Å²	134.6	71%	0.709	74%	0.735	S	S	*	*			cis	-177	155.2	-4	-120.1	-177	149.1	-154.4	0	105.2
631	I	28.4	Very low	29.1	Very low	127 Å²	127	129.2 Å²	129.2	65%	0.651	71%	0.713	S	S	*	*			trans	67.4	138.5	148.5	-67.5	173.5	0	0	0	113.4
632	D	28.2	Very low	29.4	Very low	145 Å²	145	128.8 Å²	128.8	78%	0.775	71%	0.705	S	S	*	*			cis	-147.7	-179.6	22.9	-124.5	-26.1	0	0	0	108.7
633	S	30.1	Very low	29.6	Very low	101 Å²	101	127.6 Å²	127.6	71%	0.706	69%	0.691	S	S	*	*			cis	-155.5	172.5	1.5	57.3	0	0	0	0	113.4
634	L	30.6	Very low	29.9	Very low	118 Å²	118	127.4 Å²	127.4	62%	0.618	69%	0.687	S	S	*	*			trans	-62.6	-176.4	149.8	-81.8	77.7	0	0	0	112.1
635	S	29.6	Very low	29.9	Very low	59 Å²	59	130 Å²	130	41%	0.413	69%	0.691	S	S	.	*			cis	-159.1	158.8	-28.4	53.5	0	0	0	0	110.2	Q1248 N1249 D1250	S635-Q1248 CarbonylContact C-O 3.08Å; S635-Q1248 WeakPolarHBondContact CA-O 3.37Å; S635-N1249 CarbonylContact C-O 3.6Å; S635-N1249 VanDerWaalsContact CB-O 3.31Å; S635-N1249 WeakPolarHBondContact CB-O 3.2Å; S635-D1250 WeakPolarHBondContact CB-O 3.09Å; S635-D1250 PolarHBondContact OG-O 2.99Å
636	S	29.3	Very low	30.2	Very low	58 Å²	58	131.1 Å²	131.1	41%	0.406	69%	0.687	S	S	.	*			trans	-67.1	176.3	-174.4	82.7	0	0	0	0	115.6	Q1248 N1249	S636-Q1248 PolarHBondContact N-O 3.06Å; S636-N1249 VanDerWaalsContact CA-O 3.28Å; S636-N1249 WeakPolarHBondContact CA-O 3.2Å; S636-N1249 WeakPolarHBondContact CB-O 3.13Å; S636-N1249 PolarHBondContact N-O 2.92Å; S636-N1249 PolarHBondContact OG-O 2.77Å
637	T	29.8	Very low	30.3	Very low	131 Å²	131	133.2 Å²	133.2	80%	0.804	68%	0.684	S	S	*	*			cis	-116.2	-162.4	49.3	46.4	0	0	0	0	116.2
638	S	35.8	Very low	30.8	Very low	104 Å²	104	132.5 Å²	132.5	73%	0.727	68%	0.68	S	S	*	*			trans	-77.8	171.2	-176.6	54.8	0	0	0	0	114.5
639	E	28.8	Very low	31.3	Very low	172 Å²	172	131 Å²	131	80%	0.804	67%	0.672	S	S	*	*			trans	76	90.5	-177.7	-60.8	-173.2	175.2	0	0	113.7
640	D	33.3	Very low	31.8	Very low	142 Å²	142	127.8 Å²	127.8	76%	0.759	67%	0.67	S	S	*	*				68.9	127.2	115.2	-71.7	30.2	0	0	0	120.1
641	D	33.6	Very low	32.1	Very low	70 Å²	70	126.8 Å²	126.8	37%	0.374	67%	0.671	S	S	.	*				140.7	19.7	109	-44.7	28.5	0	0	0	123.8	E643 S1243 S1244 C1245	D641-E643 PolarHBondContact O-N 2.96Å; D641-S1243 VanDerWaalsContact CG-C 3.48Å; D641-S1243 PolarHBondContact O-N 2.93Å; D641-S1243 WeakPolarHBondContact OD2-CA 3.35Å; D641-S1244 VanDerWaalsContact OD1-CA 3.28Å; D641-S1244 WeakPolarHBondContact OD1-CA 3.47Å; D641-S1244 WeakPolarHBondContact OD2-CA 3.48Å; D641-S1244 PolarHBondContact OD2-N 3.39Å; D641-C1245 PolarHBondContact OD1-N 3.13Å
642	D	30	Very low	32.4	Very low	117 Å²	117	125.5 Å²	125.5	63%	0.626	68%	0.68	S	S	*	*			trans	-76.4	112.6	-172.7	-174	19.4	0	0	0	116.5	F644 S1244	D642-F644 PolarHBondContact OD1-N 3.09Å; D642-S1244 VanDerWaalsContact C-N 3.27Å; D642-S1244 PolarHBondContact N-O 3.13Å; D642-S1244 WeakPolarHBondContact O-CB 3.45Å; D642-S1244 PolarHBondContact O-N 3.11Å; D642-S1244 PolarHBondContact O-OG 2.89Å
643	E	33.5	Very low	32.4	Very low	113 Å²	113	122.2 Å²	122.2	53%	0.528	68%	0.68	S	S	.	*			trans	-148.5	97.1	139.3	-102.8	-146.4	118.1	0	0	114.2	D641 S1242	D641-E643 PolarHBondContact O-N 2.96Å; E643-S1242 PolarHBondContact N-O 3.18Å
644	F	33.8	Very low	32.6	Very low	157 Å²	157	125.5 Å²	125.5	69%	0.689	69%	0.688	S	S	*	*			trans	75.7	107.6	149.9	-72.2	-73.8	0	0	0	122.9	D642	D642-F644 PolarHBondContact OD1-N 3.09Å
645	R	28.9	Very low	32.6	Very low	209 Å²	209	127.5 Å²	127.5	79%	0.789	70%	0.699	S	S	*	*			trans	80.1	109.9	151.6	-59.8	-179.6	167.5	-152.4	-2.5	118.7
646	H	32.8	Very low	32.5	Very low	146 Å²	146	127.7 Å²	127.7	68%	0.676	71%	0.711	S	S	*	*				178.7	138.1	92.5	-92.9	-68.9	0	0	0	113.5
647	H	29.6	Very low	32.4	Very low	158 Å²	158	135.5 Å²	135.5	73%	0.731	74%	0.738	S	S	*	*			trans	49.3	136.4	146.2	-68.4	-59.7	0	0	0	122.5
648	T	35.5	Very low	32.6	Very low	123 Å²	123	134.8 Å²	134.8	76%	0.755	74%	0.737	S	S	*	*			cis	-166.3	171.3	-15.4	1.2	0	0	0	0	108.3
649	P	42.2	Very low	32.4	Very low	110 Å²	110	134.6 Å²	134.6	71%	0.714	74%	0.741	S	S	*	*			trans	-108.7	177.3	-155.9	42.8	-40.4	0	0	0	117.5
650	I	35.6	Very low	32.8	Very low	160 Å²	160	133.4 Å²	133.4	82%	0.821	74%	0.739	S	S	*	*			trans	-165.7	156.8	158	-97.4	145.4	0	0	0	107.1
651	I	35.2	Very low	32.6	Very low	143 Å²	143	133.1 Å²	133.1	73%	0.733	75%	0.747	S	S	*	*			cis	170.8	130.1	-39.6	-97.9	167.6	0	0	0	105.5
652	A	33.2	Very low	32.7	Very low	100 Å²	100	133 Å²	133	83%	0.826	76%	0.762	S	S	*	*			trans	53.9	129	162.2	0	0	0	0	0	121.5
653	G	29.7	Very low	32.9	Very low	75 Å²	75	135.7 Å²	135.7	77%	0.773	78%	0.775	S	S	*	*			trans	-103.9	-163.5	167.5	0	0	0	0	0	113.3
654	L	33	Very low	33	Very low	170 Å²	170	138.2 Å²	138.2	89%	0.89	79%	0.791	S	S	*	*			trans	-160.1	176	167.7	-113.8	171.2	0	0	0	113.8
655	L	32.1	Very low	33	Very low	160 Å²	160	135.6 Å²	135.6	84%	0.838	79%	0.792	S	S	*	*			trans	-74.7	140	-165.5	-67.6	154.5	0	0	0	115.7
656	G	26	Very low	33.3	Very low	64 Å²	64	130.7 Å²	130.7	66%	0.66	80%	0.796	S	S	*	*				33.2	144.6	117.7	0	0	0	0	0	123.1
657	F	28.3	Very low	33.3	Very low	222 Å²	222	127.1 Å²	127.1	97%	0.974	80%	0.799	S	S	*	*			trans	64.2	109.3	172.4	-72.2	-91.5	0	0	0	116.8
658	C	33.7	Very low	33.6	Very low	116 Å²	116	123.3 Å²	123.3	78%	0.784	78%	0.782	S	S	*	*			trans	-138.4	136.1	148.9	-161.1	0	0	0	0	109.8
659	A	31.6	Very low	33.6	Very low	100 Å²	100	120.8 Å²	120.8	83%	0.826	77%	0.767	S	S	*	*			trans	-128.9	139.9	170.1	0	0	0	0	0	107.4
660	I	36.7	Very low	33	Very low	147 Å²	147	122.5 Å²	122.5	75%	0.754	77%	0.769	S	S	*	*			trans	-131.8	132	-172.9	-62.2	178.1	0	0	0	110.2
661	C	30.9	Very low	32.8	Very low	136 Å²	136	120.6 Å²	120.6	92%	0.919	77%	0.765	S	S	*	*			trans	-139	134.6	158.5	-71.8	0	0	0	0	106.3
662	G	33.7	Very low	32.5	Very low	68 Å²	68	120.9 Å²	120.9	70%	0.701	77%	0.768	S	S	*	*			trans	-171.5	-18.8	-171.9	0	0	0	0	0	122
663	L	34.9	Very low	32.3	Very low	172 Å²	172	126.8 Å²	126.8	90%	0.901	77%	0.769	S	S	*	*			trans	66.5	165.7	170.8	-68.5	170.1	0	0	0	120.1
664	I	35	Very low	32.3	Very low	166 Å²	166	127.3 Å²	127.3	85%	0.851	76%	0.76	S	S	*	*			trans	77.2	121.6	171	-50.4	-176	0	0	0	114.7
665	S	34.2	Very low	32	Very low	103 Å²	103	128.3 Å²	128.3	72%	0.72	76%	0.758	S	S	*	*			cis	-142.5	146.8	7.4	55.3	0	0	0	0	114.6
666	A	36	Very low	31.9	Very low	106 Å²	106	129.9 Å²	129.9	88%	0.876	76%	0.758	S	S	*	*			trans	26.7	139.4	149.6	0	0	0	0	0	121.6
667	G	32.8	Very low	31.9	Very low	71 Å²	71	134.1 Å²	134.1	73%	0.732	76%	0.76	S	S	*	*			cis	-178.6	173.7	-0.3	0	0	0	0	0	111.2
668	M	35.1	Very low	31.8	Very low	78 Å²	78	131.4 Å²	131.4	38%	0.384	75%	0.748	S	S	.	*			cis	-139.9	-137.6	3	-135.5	162.9	147.6	0	0	113.5	E1434 L1435 D1436	M668-E1434 WeakPolarHBondContact CB-OE2 3.38Å; M668-E1434 HydrophobicContact CE-CG 3.57Å; M668-E1434 HydrophobicContact CG-CG 4.3Å; M668-E1434 WeakPolarHBondContact CG-OE2 3.21Å; M668-E1434 HydrophobicContact SD-CB 4.38Å; M668-E1434 HydrophobicContact SD-CG 3.76Å; M668-L1435 HydrophobicContact SD-CD2 4.3Å; M668-D1436 HydrophobicContact CE-CB 3.65Å; M668-D1436 WeakPolarHBondContact CE-OD2 3.34Å
669	T	34.9	Very low	31.4	Very low	69 Å²	69	134.1 Å²	134.1	42%	0.423	75%	0.749	S	S	.	*			trans	-140.7	152.9	-152.5	73.4	0	0	0	0	119.5	E1434	T669-E1434 PolarHBondContact N-OE2 3.27Å; T669-E1434 PolarHBondContact OG1-OE1 2.72Å; T669-E1434 VanDerWaalsContact OG1-OE1 3.11Å; T669-E1434 PolarHBondContact OG1-OE2 3.3Å
670	L	31.3	Very low	31.7	Very low	146 Å²	146	134.2 Å²	134.2	76%	0.764	74%	0.741	S	S	*	*			cis	-168.1	146.2	-17.7	-102.3	172	0	0	0	112.2
671	V	31.5	Very low	31.2	Very low	121 Å²	121	134 Å²	134	73%	0.733	74%	0.741	S	S	*	*			trans	81.6	142.8	140.4	160.4	0	0	0	0	123.6
672	N	28.6	Very low	30.9	Very low	148 Å²	148	137.2 Å²	137.2	79%	0.791	74%	0.74	S	S	*	*			trans	-141	151.9	140.1	-156.1	-40.1	0	0	0	111.1
673	R	29.1	Very low	30.6	Very low	224 Å²	224	136.8 Å²	136.8	85%	0.845	74%	0.736	S	S	*	*			trans	74.3	142.1	-178.7	-65	179.6	173.8	178.5	-0.7	116.9
674	S	28.4	Very low	30.3	Very low	86 Å²	86	133.8 Å²	133.8	60%	0.601	73%	0.729	S	S	*	*			cis	-174	173.3	-5.2	54.2	0	0	0	0	115.3
675	K	28.4	Very low	30	Very low	191 Å²	191	132.2 Å²	132.2	83%	0.83	73%	0.727	S	S	*	*			trans	83.5	125.4	159.3	-57.3	157	-176.1	171.2	0	117.2
676	K	28.9	Very low	29.6	Very low	193 Å²	193	132.1 Å²	132.1	84%	0.839	73%	0.725	S	S	*	*				-164.1	151.9	64.6	-81.6	172.4	178.6	166.6	0	114.2
677	Q	25.6	Very low	29.3	Very low	153 Å²	153	133.1 Å²	133.1	72%	0.715	72%	0.716	S	S	*	*			trans	21.6	140.6	137.5	-63.3	-175.6	17.4	0	0	120.2
678	K	27.5	Very low	29.1	Very low	166 Å²	166	133.5 Å²	133.5	72%	0.722	71%	0.707	S	S	*	*			cis	-164.4	165.9	19.9	-113.9	154.7	179.6	158.7	0	112.3
679	H	25.2	Very low	28.8	Very low	173 Å²	173	136.8 Å²	136.8	80%	0.801	73%	0.725	S	S	*	*			trans	-29.1	171.4	166.3	-56.6	-77	0	0	0	120.5
680	P	36.4	Very low	28.4	Very low	102 Å²	102	141.9 Å²	141.9	66%	0.662	75%	0.749	S	S	*	*			cis	-141.5	-168	-38.3	40.5	-22.1	0	0	0	114.7
681	N	26.8	Very low	28.1	Very low	141 Å²	141	143.3 Å²	143.3	75%	0.754	75%	0.749	S	S	*	*			trans	87.7	130.4	153.4	-76.8	-3.3	0	0	0	123
682	F	25.2	Very low	28	Very low	205 Å²	205	146.4 Å²	146.4	90%	0.899	76%	0.755	S	S	*	*			trans	68.3	133.7	150.2	-91.3	-88.8	0	0	0	123.6
683	G	25.9	Very low	28	Very low	59 Å²	59	144.7 Å²	144.7	61%	0.608	76%	0.755	S	S	*	*			trans	68.2	83.3	138.6	0	0	0	0	0	118.6
684	S	29.8	Very low	28.2	Very low	108 Å²	108	137 Å²	137	76%	0.755	75%	0.745	S	S	*	*				75	141	71.3	78.9	0	0	0	0	116
685	V	28.5	Very low	28.2	Very low	134 Å²	134	139.4 Å²	139.4	81%	0.812	76%	0.757	S	S	*	*			trans	70.3	127.3	157.5	165.9	0	0	0	0	113.9
686	C	26	Very low	28.1	Very low	100 Å²	100	134.9 Å²	134.9	68%	0.676	75%	0.749	S	S	*	*			cis	-165.4	-168.1	3.1	-120.8	0	0	0	0	108.8
687	N	29.4	Very low	28.1	Very low	127 Å²	127	132.7 Å²	132.7	68%	0.679	75%	0.746	S	S	*	*			cis	-160.9	144.3	12.8	-139.3	-8.2	0	0	0	112.5
688	S	28	Very low	28.2	Very low	80 Å²	80	132.1 Å²	132.1	56%	0.559	75%	0.746	S	S	*	*			trans	57.3	174	134.7	-66.4	0	0	0	0	119
689	I	30.3	Very low	28.3	Very low	146 Å²	146	130.1 Å²	130.1	75%	0.749	75%	0.748	S	S	*	*			cis	-136.6	124.8	15.2	-60.8	161.9	0	0	0	111.5
690	L	26.3	Very low	28.2	Very low	176 Å²	176	126 Å²	126	92%	0.921	74%	0.744	S	S	*	*				-152.3	103.3	122.9	-116.1	169.8	0	0	0	109.8
691	F	23.7	Very low	27.6	Very low	176 Å²	176	128.6 Å²	128.6	77%	0.772	75%	0.751	S	S	*	*			trans	-133	127.6	-172.8	-139.9	-77.5	0	0	0	105.7
692	E	29.5	Very low	27.4	Very low	186 Å²	186	131 Å²	131	87%	0.869	76%	0.758	S	S	*	*			trans	175.2	148.6	160.6	-102.7	-178.7	-172.8	0	0	108.4
693	S	29.6	Very low	27.4	Very low	112 Å²	112	125.7 Å²	125.7	78%	0.783	75%	0.746	S	S	*	*			cis	-160	165.7	-27.2	49.9	0	0	0	0	109.4
694	G	31.8	Very low	27.4	Very low	62 Å²	62	128.9 Å²	128.9	64%	0.639	76%	0.759	S	S	*	*			trans	90.4	102.4	-177.6	0	0	0	0	0	112.7
695	T	28.4	Very low	27.2	Very low	137 Å²	137	127.6 Å²	127.6	84%	0.84	76%	0.763	S	S	*	*			cis	58.7	127.7	21.7	52.6	0	0	0	0	113.9
696	S	27.4	Very low	27	Very low	96 Å²	96	126.5 Å²	126.5	67%	0.671	76%	0.761	S	S	*	*			cis	-168.5	-175.7	8.3	51.4	0	0	0	0	113.1
697	L	29.1	Very low	26.8	Very low	147 Å²	147	129.1 Å²	129.1	77%	0.77	77%	0.768	S	S	*	*			trans	73	135.3	160.7	-94.6	70.4	0	0	0	117.4
698	I	28	Very low	26.6	Very low	141 Å²	141	128.2 Å²	128.2	72%	0.723	77%	0.772	S	S	*	*			cis	-131.5	114.9	-8.9	-74	178.2	0	0	0	106.2
699	T	27.9	Very low	26.5	Very low	125 Å²	125	131 Å²	131	77%	0.767	78%	0.78	S	S	*	*				67.8	128.4	85.9	-36.6	0	0	0	0	115.2
700	A	23.3	Very low	26.1	Very low	86 Å²	86	133.1 Å²	133.1	71%	0.711	78%	0.784	S	S	*	*			trans	-88	160.5	175.2	0	0	0	0	0	112.7
701	L	25.1	Very low	26.1	Very low	156 Å²	156	133.8 Å²	133.8	82%	0.817	78%	0.78	S	S	*	*			trans	-172.5	129.6	142.5	-107.4	161.9	0	0	0	112.1
702	E	23	Very low	26.3	Very low	193 Å²	193	131.1 Å²	131.1	90%	0.902	78%	0.778	S	S	*	*			trans	-86.8	123.2	155.3	-73.5	-171.3	128.4	0	0	109.6
703	S	25	Very low	26.1	Very low	93 Å²	93	129.2 Å²	129.2	65%	0.65	77%	0.773	S	S	*	*			trans	-159.3	115.7	156.6	61.4	0	0	0	0	112.7
704	S	24.9	Very low	25.9	Very low	126 Å²	126	131 Å²	131	88%	0.881	77%	0.769	S	S	*	*			trans	25.5	110.2	143.3	58.5	0	0	0	0	119.1
705	G	26	Very low	25.8	Very low	81 Å²	81	133.7 Å²	133.7	84%	0.835	77%	0.767	S	S	*	*			trans	-170.4	94.7	167	0	0	0	0	0	113.2
706	S	23.3	Very low	25.7	Very low	111 Å²	111	133.1 Å²	133.1	78%	0.776	76%	0.759	S	S	*	*			trans	-98.3	133.6	166.9	-176.9	0	0	0	0	108.9
707	L	23	Very low	25.9	Very low	155 Å²	155	133.1 Å²	133.1	81%	0.812	75%	0.752	S	S	*	*			trans	64.2	150.8	-172.5	-83.6	68.6	0	0	0	113.9
708	S	25.5	Very low	25.9	Very low	108 Å²	108	135.7 Å²	135.7	76%	0.755	76%	0.757	S	S	*	*			cis	-154	167.5	-3.7	39.8	0	0	0	0	112.1
709	N	24.9	Very low	25.7	Very low	139 Å²	139	137.2 Å²	137.2	74%	0.743	76%	0.759	S	S	*	*			trans	-64.7	167.4	-172.7	-57.8	-29.9	0	0	0	116.3
710	F	23.3	Very low	25.5	Very low	190 Å²	190	136.6 Å²	136.6	83%	0.833	76%	0.758	S	S	*	*			trans	74.8	148.7	168.1	-58	-75.4	0	0	0	115.5
711	K	25	Very low	25.6	Very low	190 Å²	190	140.2 Å²	140.2	83%	0.826	76%	0.76	S	S	*	*			cis	-126.8	147.8	19.4	-61.1	164.5	-175.7	170.6	0	110.2
712	T	27.3	Very low	25.7	Very low	120 Å²	120	138.4 Å²	138.4	74%	0.736	75%	0.751	S	S	*	*				-162.3	144.6	79.9	21.9	0	0	0	0	113.5
713	L	26.1	Very low	25.8	Very low	145 Å²	145	135.7 Å²	135.7	76%	0.759	74%	0.742	S	S	*	*			trans	59.1	137.9	154	-57.4	169.7	0	0	0	120.1
714	Q	24.7	Very low	25.7	Very low	151 Å²	151	137.6 Å²	137.6	71%	0.706	75%	0.745	S	S	*	*			cis	-166.8	169.2	-35	-132.5	-173.1	-21.8	0	0	109.9
715	I	29.8	Very low	25.7	Very low	117 Å²	117	140.7 Å²	140.7	60%	0.6	74%	0.743	S	S	*	*			trans	70.9	96.6	147	-72.2	165.1	0	0	0	117.1
716	N	28	Very low	25.8	Very low	126 Å²	126	142.5 Å²	142.5	67%	0.674	74%	0.737	S	S	*	*				65.6	152.8	118	-62.1	26.6	0	0	0	120
717	D	29.7	Very low	26.1	Very low	95 Å²	95	143 Å²	143	51%	0.508	73%	0.732	S	S	.	*			cis	-156	149.6	-9.8	-114	-29.4	0	0	0	110
718	F	29.3	Very low	26.3	Very low	202 Å²	202	141.3 Å²	141.3	89%	0.886	72%	0.723	S	S	*	*				-167.3	134.5	93.8	-110.9	-78.1	0	0	0	111.5
719	K	24.8	Very low	26.5	Very low	173 Å²	173	142.6 Å²	142.6	75%	0.752	72%	0.721	S	S	*	*			trans	-99.6	166.2	-179.3	-94.5	-178.3	175.7	178.4	0	112.4
720	C	22.5	Very low	26.7	Very low	111 Å²	111	141.8 Å²	141.8	75%	0.75	72%	0.717	S	S	*	*			trans	-6.4	157.3	145.7	-36.9	0	0	0	0	118.1
721	E	26	Very low	27	Very low	162 Å²	162	139.8 Å²	139.8	76%	0.757	71%	0.71	S	S	*	*				-162.9	159.6	103.8	-121.8	-179.3	-145.9	0	0	116.5
722	N	28.2	Very low	27.1	Very low	119 Å²	119	139.1 Å²	139.1	64%	0.636	71%	0.707	S	S	*	*			trans	66.3	162.3	155.7	-58.9	-33.2	0	0	0	120.9
723	L	24.6	Very low	27.2	Very low	135 Å²	135	138.8 Å²	138.8	71%	0.707	71%	0.705	S	S	*	*				-179	132.6	-57.9	-110	171.1	0	0	0	107.8
724	N	22.8	Very low	27.1	Very low	133 Å²	133	139.9 Å²	139.9	71%	0.711	71%	0.706	S	S	*	*			trans	49.3	125.7	160.7	-59.8	-14.1	0	0	0	120.5
725	F	25.4	Very low	27	Very low	192 Å²	192	137.4 Å²	137.4	84%	0.842	71%	0.705	S	S	*	*				-176.3	132.4	106	-117.7	-106.5	0	0	0	110.5
726	V	26.9	Very low	26.8	Very low	118 Å²	118	138.4 Å²	138.4	72%	0.715	71%	0.711	S	S	*	*			trans	57.2	134.6	146.8	170.4	0	0	0	0	117.9
727	D	29.3	Very low	26.7	Very low	122 Å²	122	140.6 Å²	140.6	65%	0.652	72%	0.717	S	S	*	*			cis	-155.1	167	27.2	-145.6	-11.1	0	0	0	113.7
728	N	28.8	Very low	26.6	Very low	120 Å²	120	142.5 Å²	142.5	64%	0.642	73%	0.732	S	S	*	*			trans	45.6	141.1	155.2	-64.1	-46	0	0	0	122
729	L	29.2	Very low	26.9	Very low	134 Å²	134	137.5 Å²	137.5	70%	0.702	72%	0.72	S	S	*	*			cis	-161.6	132.2	-8.4	-120.1	165.1	0	0	0	110.8
730	N	28.6	Very low	27	Very low	122 Å²	122	137.6 Å²	137.6	65%	0.652	72%	0.721	S	S	*	*			trans	15.2	151.1	147.5	-65.5	-22.2	0	0	0	122.8
731	Q	28.8	Very low	27.2	Very low	149 Å²	149	139.2 Å²	139.2	70%	0.696	72%	0.722	S	S	*	*			cis	-165.1	140.1	-3.2	-111.2	167.7	27.4	0	0	110
732	K	28.8	Very low	27.4	Very low	176 Å²	176	137.8 Å²	137.8	77%	0.765	72%	0.724	S	S	*	*				63.6	115.4	100.8	-87.2	-168.4	176.8	-177.6	0	117.1
733	T	28	Very low	27.5	Very low	113 Å²	113	136.6 Å²	136.6	69%	0.693	73%	0.725	S	S	*	*				63.1	138.6	92.9	63.2	0	0	0	0	115.5
734	Q	24.2	Very low	27.8	Very low	168 Å²	168	135.2 Å²	135.2	79%	0.785	73%	0.726	S	S	*	*			cis	-174.8	171.3	-6.2	-175.8	178.4	-4.4	0	0	108
735	C	23.2	Very low	28.2	Very low	99 Å²	99	134.6 Å²	134.6	67%	0.669	73%	0.727	S	S	*	*			trans	85.5	130.4	163.8	-58.7	0	0	0	0	120.7
736	N	24.8	Very low	28.4	Very low	137 Å²	137	131.4 Å²	131.4	73%	0.733	72%	0.724	S	S	*	*			trans	76.4	142.6	142.8	-66.4	19.8	0	0	0	124.2
737	E	26.7	Very low	28.6	Very low	172 Å²	172	131.2 Å²	131.2	80%	0.804	72%	0.723	S	S	*	*			trans	75.1	165	153.8	-74.7	157.6	-125.9	0	0	121.2
738	V	28.5	Very low	28.8	Very low	135 Å²	135	133.5 Å²	133.5	82%	0.818	73%	0.733	S	S	*	*			trans	-164.2	163.5	-158.2	-122.4	0	0	0	0	108.5
739	P	34.6	Very low	28.9	Very low	97 Å²	97	130.9 Å²	130.9	63%	0.63	73%	0.734	S	S	*	*			cis	-125	-165.7	-30	19.5	5.9	0	0	0	112.9
740	F	27.8	Very low	29	Very low	176 Å²	176	130.6 Å²	130.6	77%	0.772	74%	0.738	S	S	*	*			trans	80.7	114.2	163.2	-66.1	-68.4	0	0	0	119.1
741	N	26.2	Very low	29.1	Very low	144 Å²	144	134 Å²	134	77%	0.77	75%	0.748	S	S	*	*				67.6	130.8	98.6	-82.9	-3.3	0	0	0	114.6
742	V	29.6	Very low	29.2	Very low	133 Å²	133	132.6 Å²	132.6	81%	0.806	75%	0.749	S	S	*	*			cis	-160.1	165	45.1	175.6	0	0	0	0	109.3
743	S	29.7	Very low	29	Very low	93 Å²	93	129.2 Å²	129.2	65%	0.65	75%	0.747	S	S	*	*			cis	-173.8	173.3	-46.6	86.2	0	0	0	0	109.9
744	S	32.5	Very low	29	Very low	107 Å²	107	132.7 Å²	132.7	75%	0.748	75%	0.753	S	S	*	*			trans	72	155.5	168	81.1	0	0	0	0	118.1
745	V	30.1	Very low	29.1	Very low	119 Å²	119	130 Å²	130	72%	0.721	75%	0.748	S	S	*	*			cis	-143.7	147.6	12.1	-157.2	0	0	0	0	112.1
746	T	31	Very low	29.3	Very low	126 Å²	126	131 Å²	131	77%	0.773	75%	0.751	S	S	*	*			trans	66.8	146.1	157.3	25.4	0	0	0	0	119.7
747	T	31	Very low	29.3	Very low	113 Å²	113	131.3 Å²	131.3	69%	0.693	75%	0.752	S	S	*	*			cis	-146.4	128.6	13.2	-42	0	0	0	0	113.7
748	I	31.7	Very low	29.3	Very low	170 Å²	170	128.3 Å²	128.3	87%	0.872	75%	0.746	S	S	*	*			trans	50.1	132.8	151	-59.9	171.7	0	0	0	120.9
749	G	31.5	Very low	29.3	Very low	65 Å²	65	127.7 Å²	127.7	67%	0.67	74%	0.742	S	S	*	*			trans	176.3	-14.7	171.4	0	0	0	0	0	119.4
750	T	32.8	Very low	29	Very low	128 Å²	128	128.3 Å²	128.3	79%	0.785	75%	0.745	S	S	*	*			trans	57.7	92.5	165.5	50.3	0	0	0	0	121.5
751	F	29.9	Very low	29	Very low	195 Å²	195	125.4 Å²	125.4	86%	0.855	74%	0.742	S	S	*	*				57.4	93.4	129.5	-75.1	-78.1	0	0	0	123.9
752	V	30.4	Very low	29.1	Very low	119 Å²	119	124 Å²	124	72%	0.721	74%	0.738	S	S	*	*				20.5	130.4	96.4	-178.6	0	0	0	0	117
753	S	25	Very low	28.9	Very low	104 Å²	104	124.5 Å²	124.5	73%	0.727	74%	0.737	S	S	*	*			cis	95.5	131.6	23.1	-63.6	0	0	0	0	119
754	K	27.4	Very low	28.9	Very low	187 Å²	187	125.6 Å²	125.6	81%	0.813	74%	0.739	S	S	*	*			trans	78.2	106.1	141.6	-84.8	-175.9	177.5	-179.7	0	124.5
755	T	27	Very low	28.6	Very low	110 Å²	110	126.9 Å²	126.9	68%	0.675	74%	0.743	S	S	*	*				61.6	138.5	115.8	58.1	0	0	0	0	125.2
756	T	26.4	Very low	28.6	Very low	121 Å²	121	124.2 Å²	124.2	74%	0.742	74%	0.739	S	S	*	*			trans	73.2	159	139.7	48.4	0	0	0	0	120.6
757	L	26.2	Very low	28.7	Very low	144 Å²	144	124.4 Å²	124.4	75%	0.754	74%	0.74	S	S	*	*			cis	-150	173.1	1.8	-118.5	148.7	0	0	0	111.9
758	T	26.5	Very low	28.6	Very low	109 Å²	109	125.5 Å²	125.5	67%	0.669	74%	0.741	S	S	*	*			trans	-35.5	166.5	166.3	51.6	0	0	0	0	118.5
759	T	27.7	Very low	28.4	Very low	121 Å²	121	125.9 Å²	125.9	74%	0.742	74%	0.736	S	S	*	*			cis	-167.4	176.3	1.7	23	0	0	0	0	107.3
760	T	28.4	Very low	28.2	Very low	110 Å²	110	129.7 Å²	129.7	68%	0.675	74%	0.735	S	S	*	*			cis	-164	165.6	44.5	44.8	0	0	0	0	111.8
761	T	27.9	Very low	28.1	Very low	116 Å²	116	130.3 Å²	130.3	71%	0.712	73%	0.728	S	S	*	*			trans	26.2	135.6	145.5	60.6	0	0	0	0	120.8
762	T	27.9	Very low	28.1	Very low	114 Å²	114	127.2 Å²	127.2	70%	0.699	72%	0.721	S	S	*	*			cis	-170.9	164.4	16.1	3.9	0	0	0	0	111.9
763	N	26.6	Very low	28.4	Very low	144 Å²	144	127.7 Å²	127.7	77%	0.77	72%	0.719	S	S	*	*			trans	76	139.3	144.1	-82.8	-6.6	0	0	0	123.6
764	V	28.5	Very low	28.4	Very low	116 Å²	116	131.1 Å²	131.1	70%	0.703	72%	0.721	S	S	*	*			trans	82.2	93.4	136.6	172.7	0	0	0	0	120.3
765	T	26.9	Very low	28.8	Very low	134 Å²	134	127.8 Å²	127.8	82%	0.822	72%	0.718	S	S	*	*			trans	49.1	126.8	133.7	66.9	0	0	0	0	123.3
766	G	30.9	Very low	28.9	Very low	62 Å²	62	127.5 Å²	127.5	64%	0.639	72%	0.721	S	S	*	*			trans	-179.2	107.2	147.8	0	0	0	0	0	109.4
767	T	31.4	Very low	29.1	Very low	131 Å²	131	130 Å²	130	80%	0.804	72%	0.724	S	S	*	*				58.9	129.3	79.8	62	0	0	0	0	114
768	L	30.6	Very low	29.4	Very low	136 Å²	136	128.8 Å²	128.8	71%	0.712	72%	0.723	S	S	*	*			cis	-154	146.8	-5	-95.9	160.9	0	0	0	105.9
769	K	27	Very low	29.4	Very low	177 Å²	177	128.6 Å²	128.6	77%	0.77	73%	0.726	S	S	*	*				42.2	138.3	95	-62.1	-170.6	-170.3	173	0	114.6
770	K	27.2	Very low	29.3	Very low	146 Å²	146	129 Å²	129	64%	0.635	73%	0.732	S	S	*	*			cis	-168.4	176.7	10.1	-134.2	179.9	147.5	-154.2	0	112.1
771	E	29.2	Very low	29.2	Very low	141 Å²	141	133 Å²	133	66%	0.659	74%	0.74	S	S	*	*			trans	68	128.1	148.5	-78	152.3	166.3	0	0	119
772	D	31.6	Very low	29.1	Very low	129 Å²	129	132.8 Å²	132.8	69%	0.69	74%	0.742	S	S	*	*			cis	-157.7	-148.6	-14.8	-137.2	51.7	0	0	0	107.5
773	N	36	Very low	29	Very low	130 Å²	130	133.7 Å²	133.7	70%	0.695	75%	0.748	S	S	*	*			cis	-146.4	-120.3	6	-167	-116.8	0	0	0	112.8
774	K	25.6	Very low	29	Very low	175 Å²	175	137 Å²	137	76%	0.761	75%	0.751	S	S	*	*			trans	-164.3	-177.5	-158.9	-98.6	-175.5	179.9	178.8	0	111.1
775	P	34.5	Very low	28.9	Very low	117 Å²	117	138.3 Å²	138.3	76%	0.76	75%	0.748	S	S	*	*			cis	-112.9	-174.1	-8.1	43.2	-31.6	0	0	0	110.9
776	S	29.9	Very low	28.7	Very low	104 Å²	104	136 Å²	136	73%	0.727	74%	0.737	S	S	*	*			cis	-150.3	171.6	5.7	51.1	0	0	0	0	108
777	E	30.3	Very low	28.5	Very low	174 Å²	174	139.2 Å²	139.2	81%	0.813	75%	0.748	S	S	*	*			cis	-145.9	178.5	-1.1	-137.6	168.3	-148.2	0	0	112.4
778	T	31.6	Very low	28.2	Very low	119 Å²	119	138.3 Å²	138.3	73%	0.73	74%	0.743	S	S	*	*			trans	-58.4	157.6	176.3	42.5	0	0	0	0	115.3
779	S	28.4	Very low	27.9	Very low	105 Å²	105	138.3 Å²	138.3	73%	0.734	74%	0.743	S	S	*	*			cis	-170.3	154.7	-8.5	49.4	0	0	0	0	111
780	C	24.4	Very low	27.9	Very low	128 Å²	128	136.9 Å²	136.9	87%	0.865	74%	0.743	S	S	*	*			trans	-90.2	142.9	167.8	-69.4	0	0	0	0	112.4
781	K	27.2	Very low	27.8	Very low	195 Å²	195	135.7 Å²	135.7	85%	0.848	75%	0.752	S	S	*	*			trans	-152.2	144.7	148.9	-123.6	174.5	-176	177.9	0	110.9
782	C	25.3	Very low	27.8	Very low	112 Å²	112	134.3 Å²	134.3	76%	0.757	76%	0.758	S	S	*	*			trans	-94.4	151.3	-167.7	-50.3	0	0	0	0	112.2
783	T	26	Very low	27.9	Very low	133 Å²	133	135.6 Å²	135.6	82%	0.816	77%	0.765	S	S	*	*				162.4	145.4	115.8	38.1	0	0	0	0	113.6
784	Y	26.9	Very low	27.6	Very low	214 Å²	214	136.6 Å²	136.6	84%	0.839	77%	0.77	S	S	*	*			trans	-1.1	122.7	159.7	-74	-97.6	0	0	0	119.6
785	F	25.3	Very low	27.8	Very low	142 Å²	142	135.1 Å²	135.1	62%	0.623	78%	0.776	S	S	*	*				-179.6	168.1	96.1	-125.2	-88.5	0	0	0	113
786	S	22.6	Very low	27.6	Very low	87 Å²	87	134.2 Å²	134.2	61%	0.608	77%	0.773	S	S	*	*			trans	79.6	127.9	155.2	-150.8	0	0	0	0	120.1	T788	S786-T788 PolarHBondContact OG-OG1 2.99Å
787	C	26.1	Very low	27.6	Very low	129 Å²	129	135.2 Å²	135.2	87%	0.872	77%	0.774	S	S	*	*			trans	-91.1	110	144.2	-69	0	0	0	0	108
788	T	26.6	Very low	27.5	Very low	112 Å²	112	134 Å²	134	69%	0.687	77%	0.772	S	S	*	*			trans	174.7	97.2	150.9	21.5	0	0	0	0	109.9	S786	S786-T788 PolarHBondContact OG-OG1 2.99Å
789	N	24.8	Very low	27.6	Very low	135 Å²	135	133.5 Å²	133.5	72%	0.722	77%	0.771	S	S	*	*				176.8	158	116	-97.6	-69.9	0	0	0	111.1
790	L	26.7	Very low	27.6	Very low	147 Å²	147	134.6 Å²	134.6	77%	0.77	77%	0.773	S	S	*	*			trans	-66.4	150.4	166.1	-59.5	83.8	0	0	0	110.1
791	C	24.1	Very low	27.5	Very low	122 Å²	122	135.8 Å²	135.8	82%	0.824	77%	0.77	S	S	*	*				-178.5	152.2	103.8	-89.9	0	0	0	0	110.9
792	S	29.1	Very low	27.4	Very low	111 Å²	111	132.6 Å²	132.6	78%	0.776	76%	0.762	S	S	*	*			trans	-92.5	131.5	171.9	-64	0	0	0	0	111.1
793	N	34.9	Very low	27.4	Very low	156 Å²	156	136.1 Å²	136.1	83%	0.834	77%	0.765	S	S	*	*			trans	64.8	167.8	157.7	-59.6	-21.6	0	0	0	119.1
794	N	29.3	Very low	27.4	Very low	151 Å²	151	138.6 Å²	138.6	81%	0.807	77%	0.767	S	S	*	*			trans	-124.7	169.9	-157.3	-66.4	-51.3	0	0	0	113.8
795	T	30.1	Very low	27.3	Very low	144 Å²	144	133.7 Å²	133.7	88%	0.883	76%	0.76	S	S	*	*			trans	96.4	-168.1	163	76	0	0	0	0	117.2
796	S	29	Very low	27.3	Very low	99 Å²	99	132.5 Å²	132.5	69%	0.692	76%	0.764	S	S	*	*			trans	-159.1	179.3	-145.2	61	0	0	0	0	111.6
797	T	31.6	Very low	27.5	Very low	124 Å²	124	135.7 Å²	135.7	76%	0.761	77%	0.774	S	S	*	*			cis	-162	158	35.6	-34.2	0	0	0	0	114.5
798	I	28.2	Very low	27.7	Very low	149 Å²	149	134.7 Å²	134.7	76%	0.764	76%	0.764	S	S	*	*			trans	-42	145	159.7	-72.2	166.1	0	0	0	112.3
799	P	32.9	Very low	28	Very low	108 Å²	108	135.9 Å²	135.9	70%	0.701	76%	0.764	S	S	*	*			cis	-138.1	154.7	34.3	26.2	-1.8	0	0	0	120.9
800	T	27.6	Very low	28.2	Very low	129 Å²	129	135.6 Å²	135.6	79%	0.791	76%	0.763	S	S	*	*			trans	16.6	134.5	144.7	65.8	0	0	0	0	124.9
801	L	24.1	Very low	28.5	Very low	152 Å²	152	135.6 Å²	135.6	80%	0.796	76%	0.764	S	S	*	*			trans	98.5	128.9	132.3	-141.7	78	0	0	0	121.6
802	N	24.4	Very low	28.7	Very low	128 Å²	128	136.3 Å²	136.3	68%	0.684	76%	0.759	S	S	*	*			trans	73.6	126.3	155.3	-84.5	-28	0	0	0	122.4
803	K	24.4	Very low	28.8	Very low	187 Å²	187	137.1 Å²	137.1	81%	0.813	76%	0.755	S	S	*	*			trans	24.7	112.8	141.9	-61.6	-179.5	176.9	-179.3	0	119
804	Q	25.9	Very low	28.7	Very low	184 Å²	184	137 Å²	137	86%	0.86	75%	0.754	S	S	*	*				179.9	136.9	96.5	-108.6	179.2	-35.5	0	0	114.7
805	T	25.8	Very low	28.8	Very low	112 Å²	112	136.3 Å²	136.3	69%	0.687	75%	0.751	S	S	*	*			trans	30.9	140.9	147.3	23.3	0	0	0	0	124.3
806	T	25.8	Very low	28.9	Very low	116 Å²	116	137 Å²	137	71%	0.712	75%	0.749	S	S	*	*			trans	75.9	126	144.4	42.5	0	0	0	0	121.5
807	L	25.9	Very low	28.9	Very low	155 Å²	155	135.5 Å²	135.5	81%	0.812	75%	0.75	S	S	*	*			trans	70.9	133.6	158	-52.8	159.4	0	0	0	115.1
808	T	30.2	Very low	28.8	Very low	108 Å²	108	136.4 Å²	136.4	66%	0.663	75%	0.754	S	S	*	*			cis	-165.1	146.2	1	8.4	0	0	0	0	110.1
809	I	33.1	Very low	28.9	Very low	136 Å²	136	135.8 Å²	135.8	70%	0.697	75%	0.753	S	S	*	*			trans	64.8	90.3	150.9	-58.8	163.9	0	0	0	113.2
810	D	30	Very low	28.7	Very low	130 Å²	130	138.3 Å²	138.3	70%	0.695	76%	0.76	S	S	*	*				66.6	124.2	68.2	-42.9	-10.5	0	0	0	110.8
811	D	31.6	Very low	28.7	Very low	146 Å²	146	138.7 Å²	138.7	78%	0.781	76%	0.762	S	S	*	*			cis	-154.2	155.7	-8.8	-99.9	-36.6	0	0	0	109.6
812	N	28.6	Very low	29	Very low	138 Å²	138	140.3 Å²	140.3	74%	0.738	77%	0.766	S	S	*	*			trans	-158.8	129.5	168.5	-128.8	83.5	0	0	0	108.9
813	D	31.8	Very low	29.2	Very low	128 Å²	128	142.2 Å²	142.2	68%	0.684	78%	0.776	S	S	*	*			trans	18.7	132.8	142.1	-38.7	-29	0	0	0	117.9
814	D	31.9	Very low	29.3	Very low	153 Å²	153	141.6 Å²	141.6	82%	0.818	78%	0.776	S	S	*	*			cis	-154.7	168.7	38.9	-96.3	-48.4	0	0	0	114.2
815	D	32.8	Very low	29.4	Very low	136 Å²	136	140 Å²	140	73%	0.727	77%	0.769	S	S	*	*			trans	-46.3	143.8	169.5	-63	-45.2	0	0	0	116.1
816	N	32.4	Very low	29.4	Very low	158 Å²	158	140.9 Å²	140.9	85%	0.845	77%	0.765	S	S	*	*				174.8	142.6	95.1	-97.2	-76.7	0	0	0	112.7
817	G	27	Very low	29.3	Very low	69 Å²	69	141.2 Å²	141.2	71%	0.711	77%	0.767	S	S	*	*			trans	155.4	63.1	166.3	0	0	0	0	0	118.1
818	V	30.5	Very low	29.3	Very low	142 Å²	142	138 Å²	138	86%	0.861	76%	0.758	S	S	*	*				165.9	130.6	125.3	155.7	0	0	0	0	109.6
819	D	30.8	Very low	29.2	Very low	137 Å²	137	139.5 Å²	139.5	73%	0.733	76%	0.761	S	S	*	*			trans	-83.9	166.5	-178.7	-51.5	-83.9	0	0	0	114.1
820	D	27.8	Very low	29	Very low	161 Å²	161	140.3 Å²	140.3	86%	0.861	77%	0.765	S	S	*	*			trans	63.7	63.5	151.1	-62.4	-11.4	0	0	0	120
821	V	28.1	Very low	28.9	Very low	137 Å²	137	140.7 Å²	140.7	83%	0.83	77%	0.767	S	S	*	*			trans	-125.6	148.6	134.1	-140.3	0	0	0	0	104.2
822	E	31.2	Very low	28.7	Very low	185 Å²	185	139.1 Å²	139.1	86%	0.864	76%	0.759	S	S	*	*			cis	-156.9	161.5	36.7	-58.8	173.9	116.9	0	0	109.7
823	D	28.7	Very low	28.8	Very low	169 Å²	169	138.3 Å²	138.3	90%	0.904	76%	0.759	S	S	*	*			trans	-133.1	68.5	-173.2	-137.3	-6.4	0	0	0	112
824	Q	26.4	Very low	28.6	Very low	174 Å²	174	138.1 Å²	138.1	81%	0.813	76%	0.757	S	S	*	*			trans	-156.1	129.1	175.3	-105.4	-175.6	-5.3	0	0	114.9
825	E	26.5	Very low	28.2	Very low	151 Å²	151	140.5 Å²	140.5	71%	0.706	76%	0.76	S	S	*	*			trans	65.8	162.1	147.4	-57.7	-150.3	116.5	0	0	118.3
826	Q	25.6	Very low	28	Very low	130 Å²	130	143.1 Å²	143.1	61%	0.607	76%	0.761	S	S	*	*			cis	-162.5	152.3	-12.6	-119.9	179.7	41.8	0	0	109.7
827	T	24.7	Very low	27.7	Very low	123 Å²	123	142.2 Å²	142.2	76%	0.755	76%	0.756	S	S	*	*			trans	60.3	166.4	150.6	57.5	0	0	0	0	120.8
828	S	25.9	Very low	27.7	Very low	88 Å²	88	146.3 Å²	146.3	62%	0.615	76%	0.761	S	S	*	*			cis	-171.9	153.2	-31	55.5	0	0	0	0	111.5
829	D	28.3	Very low	27.3	Very low	138 Å²	138	148.4 Å²	148.4	74%	0.738	76%	0.758	S	S	*	*			trans	64	132.9	151.1	-60.3	-7.3	0	0	0	120.4
830	I	27.9	Very low	27	Very low	153 Å²	153	146 Å²	146	79%	0.785	75%	0.752	S	S	*	*			cis	85.3	123.5	48.7	-70	170.2	0	0	0	111.4
831	D	28.4	Very low	26.9	Very low	138 Å²	138	144 Å²	144	74%	0.738	75%	0.746	S	S	*	*			cis	-159.8	-166.3	7.3	-153.5	0.8	0	0	0	109
832	N	27.9	Very low	27	Very low	113 Å²	113	143.1 Å²	143.1	60%	0.604	74%	0.741	S	S	*	*			cis	-162.9	-159.4	3.5	-167	-99.4	0	0	0	110.2
833	V	29.5	Very low	26.9	Very low	121 Å²	121	140.9 Å²	140.9	73%	0.733	74%	0.74	S	S	*	*			trans	93.8	71.4	155.7	-155.3	0	0	0	0	121
834	I	27.6	Very low	26.9	Very low	125 Å²	125	136.1 Å²	136.1	64%	0.641	73%	0.731	S	S	*	*				40.9	118.8	119.9	-54.9	167.8	0	0	0	120.3	Y836	I834-Y836 HydrophobicContact CG2-CD2 4.06Å; I834-Y836 HydrophobicContact CG2-CE2 4.02Å
835	K	25.3	Very low	26.9	Very low	202 Å²	202	135.5 Å²	135.5	88%	0.878	73%	0.732	S	S	*	*				-159.2	99.3	121.7	-134.2	174.2	-175.1	175.9	0	117
836	Y	28.7	Very low	26.8	Very low	191 Å²	191	132.4 Å²	132.4	75%	0.749	73%	0.732	S	S	*	*			trans	31.2	124.3	148.3	-76.1	-81.8	0	0	0	124.6	I834	I834-Y836 HydrophobicContact CG2-CD2 4.06Å; I834-Y836 HydrophobicContact CG2-CE2 4.02Å
837	D	24.6	Very low	26.8	Very low	139 Å²	139	134.7 Å²	134.7	74%	0.743	74%	0.743	S	S	*	*			trans	32.8	120.4	133	-76.5	-48.5	0	0	0	121.5
838	L	26.7	Very low	27	Very low	156 Å²	156	135.4 Å²	135.4	82%	0.817	74%	0.741	S	S	*	*				-168.8	157.8	106.5	-104.6	164	0	0	0	115.4
839	K	23.6	Very low	27.1	Very low	185 Å²	185	141.1 Å²	141.1	80%	0.804	76%	0.755	S	S	*	*			trans	-35.7	157.6	162.5	-71.8	169.6	-176.6	172.7	0	115.7
840	S	24	Very low	27	Very low	87 Å²	87	140 Å²	140	61%	0.608	75%	0.749	S	S	*	*			cis	-179	179.2	-6.1	53.1	0	0	0	0	110.5
841	T	26.3	Very low	27.1	Very low	120 Å²	120	142.8 Å²	142.8	74%	0.736	75%	0.75	S	S	*	*			trans	63.8	140.9	151.6	45.4	0	0	0	0	117.3
842	T	29	Very low	27.1	Very low	118 Å²	118	141 Å²	141	72%	0.724	76%	0.755	S	S	*	*			cis	-162.3	166.4	9.4	4.4	0	0	0	0	106.6
843	T	30.3	Very low	27	Very low	138 Å²	138	141.7 Å²	141.7	85%	0.847	76%	0.763	S	S	*	*			cis	-164	152.8	21.1	-11.4	0	0	0	0	109.6
844	G	27.9	Very low	26.9	Very low	68 Å²	68	145.5 Å²	145.5	70%	0.701	77%	0.77	S	S	*	*			trans	117.4	108.9	142.7	0	0	0	0	0	120.5
845	L	26.3	Very low	27.3	Very low	161 Å²	161	144.7 Å²	144.7	84%	0.843	77%	0.772	S	S	*	*			trans	66.6	86.5	145.7	-56.1	176.9	0	0	0	121
846	A	24.4	Very low	27.2	Very low	86 Å²	86	143.7 Å²	143.7	71%	0.711	78%	0.776	S	S	*	*				52.8	138.3	109.9	0	0	0	0	0	123.1
847	E	26.6	Very low	27	Very low	178 Å²	178	137.6 Å²	137.6	83%	0.832	77%	0.771	S	S	*	*			trans	73.8	142.4	156.5	-65.6	175.8	169.8	0	0	117.8
848	I	27.8	Very low	27.1	Very low	138 Å²	138	141.7 Å²	141.7	71%	0.708	78%	0.778	S	S	*	*			cis	-152.9	143.3	3.8	-123.1	159.5	0	0	0	112.5
849	F	27.5	Very low	27.1	Very low	208 Å²	208	141.5 Å²	141.5	91%	0.912	78%	0.776	S	S	*	*			trans	37.2	150.2	160.4	-86	-90.2	0	0	0	126.2
850	D	27.4	Very low	27.2	Very low	114 Å²	114	141 Å²	141	61%	0.61	78%	0.776	S	S	*	*			trans	-106.2	157.7	-177.3	-172.7	28	0	0	0	113.9
851	R	30.1	Very low	27.4	Very low	212 Å²	212	145.3 Å²	145.3	80%	0.8	78%	0.784	S	S	*	*			trans	53.3	142.2	156.4	-92.9	170.6	-177.1	104.4	-3.3	123.4
852	A	28.4	Very low	27.4	Very low	102 Å²	102	146.1 Å²	146.1	84%	0.843	78%	0.783	S	S	*	*			trans	-75.4	157.4	177.1	0	0	0	0	0	114
853	T	25.9	Very low	27.3	Very low	127 Å²	127	147.2 Å²	147.2	78%	0.779	78%	0.784	S	S	*	*			trans	-121.5	127.8	-177	48	0	0	0	0	113.5
854	K	26.1	Very low	27.2	Very low	201 Å²	201	146.2 Å²	146.2	87%	0.874	78%	0.783	S	S	*	*			trans	155	160.3	146	-91.6	162.1	-175.1	172.5	0	111.8
855	P	35.6	Very low	27.1	Very low	108 Å²	108	148.6 Å²	148.6	70%	0.701	79%	0.789	S	S	*	*			cis	-132.7	148.8	-18.1	35.1	-19.2	0	0	0	114.2
856	L	24.2	Very low	27.5	Very low	181 Å²	181	146.7 Å²	146.7	95%	0.948	79%	0.786	S	S	*	*			trans	179	168.1	131.7	-97.1	161.6	0	0	0	109.6
857	G	23.9	Very low	27.8	Very low	63 Å²	63	146.9 Å²	146.9	65%	0.649	79%	0.787	S	S	*	*			trans	-109.2	155.5	-163.1	0	0	0	0	0	116.5
858	Y	26.3	Very low	27.8	Very low	225 Å²	225	149 Å²	149	88%	0.882	79%	0.788	S	S	*	*			trans	-141.6	138.4	166.7	-84	-84.6	0	0	0	105
859	I	28.1	Very low	27.9	Very low	151 Å²	151	147.3 Å²	147.3	77%	0.774	78%	0.78	S	S	*	*			cis	62.1	105.5	28.6	-57.1	-174.2	0	0	0	112.6
860	H	26	Very low	28.1	Very low	174 Å²	174	144.8 Å²	144.8	81%	0.806	77%	0.772	S	S	*	*			trans	-52.3	138.9	177.2	-77	-110.3	0	0	0	113.2
861	K	28	Very low	28.3	Very low	179 Å²	179	144.1 Å²	144.1	78%	0.778	78%	0.776	S	S	*	*				-171.3	131.1	112.9	-94.7	170	178.1	-165.4	0	108.1
862	L	26.3	Very low	28.2	Very low	137 Å²	137	141.2 Å²	141.2	72%	0.717	78%	0.775	S	S	*	*				56	115.9	78.7	-79.8	168.6	0	0	0	112.2
863	D	25.8	Very low	28.3	Very low	140 Å²	140	142 Å²	142	75%	0.749	77%	0.765	S	S	*	*				-179.9	156.9	91.2	-91	-39.6	0	0	0	112.5
864	S	28.2	Very low	28.5	Very low	118 Å²	118	145.4 Å²	145.4	83%	0.825	77%	0.765	S	S	*	*	S	Bend	trans	-138.2	110.6	165.1	-83.1	0	0	0	0	110.3
865	S	26.4	Very low	28.7	Very low	118 Å²	118	144.3 Å²	144.3	83%	0.825	76%	0.762	S	S	*	*	S	Bend	trans	75.1	149	168.9	-81.5	0	0	0	0	119
866	P	35.8	Very low	28.4	Very low	120 Å²	120	143.3 Å²	143.3	78%	0.779	76%	0.758	S	S	*	*				-143.5	167.2	-125	41.5	-23.3	0	0	0	117.9
867	A	29.4	Very low	28.7	Very low	90 Å²	90	141.6 Å²	141.6	74%	0.744	75%	0.75	S	S	*	*			trans	-159.9	115.5	150.4	0	0	0	0	0	115.6
868	W	27.4	Very low	29	Very low	222 Å²	222	145 Å²	145	84%	0.841	76%	0.758	S	S	*	*			trans	61.5	114.6	136.2	-75.8	56.7	0	0	0	123.3
869	N	29	Very low	29.1	Very low	103 Å²	103	141 Å²	141	55%	0.551	75%	0.751	S	S	*	*			trans	74.4	143.6	133.2	-66	7.3	0	0	0	121.2
870	Q	31.5	Very low	29.2	Very low	156 Å²	156	140.8 Å²	140.8	73%	0.729	75%	0.746	S	S	*	*			cis	-167.7	168	-7.1	-116.4	166.3	-2.3	0	0	111.4
871	S	31.2	Very low	29.5	Very low	99 Å²	99	139.6 Å²	139.6	69%	0.692	74%	0.741	S	S	*	*			trans	63.7	124.8	164.3	45	0	0	0	0	119.4
872	I	29.7	Very low	29.5	Very low	152 Å²	152	137.3 Å²	137.3	78%	0.779	74%	0.736	S	S	*	*			cis	80.2	124	32	-51.1	160.6	0	0	0	110.4
873	N	29.7	Very low	29.4	Very low	119 Å²	119	141 Å²	141	64%	0.636	74%	0.741	S	S	*	*			cis	-168.7	-177.8	46.1	-145.9	-14.9	0	0	0	116.9
874	Y	29.5	Very low	29.4	Very low	198 Å²	198	142.1 Å²	142.1	78%	0.776	74%	0.741	S	S	*	*			trans	82.5	84.5	151.7	-69.6	-58.2	0	0	0	125.2
875	H	31.3	Very low	29.4	Very low	177 Å²	177	141.7 Å²	141.7	82%	0.819	73%	0.733	S	S	*	*				33.6	121.9	116.3	-97.5	23	0	0	0	126.3
876	S	28.7	Very low	29.7	Very low	87 Å²	87	142.8 Å²	142.8	61%	0.608	73%	0.725	S	S	*	*				99.2	133.7	111.6	85	0	0	0	0	124.6
877	N	30.2	Very low	29.3	Very low	146 Å²	146	145.3 Å²	145.3	78%	0.781	72%	0.724	S	S	*	*			trans	63.4	123.3	140.6	-56.7	-9.2	0	0	0	123.3
878	T	31.6	Very low	29.3	Very low	135 Å²	135	151 Å²	151	83%	0.828	73%	0.732	S	S	*	*				164.2	142.4	99.9	-58.6	0	0	0	0	114.1
879	I	27.7	Very low	29.2	Very low	141 Å²	141	150.2 Å²	150.2	72%	0.723	74%	0.735	S	S	*	*			trans	-70.1	146.8	-176.4	-46.7	162.3	0	0	0	113.1
880	H	29.6	Very low	29.4	Very low	146 Å²	146	151.1 Å²	151.1	68%	0.676	75%	0.746	S	S	*	*				173.5	124.3	123.3	-103.4	-106.3	0	0	0	117.9
881	Q	32.2	Very low	29.2	Very low	149 Å²	149	150.3 Å²	150.3	70%	0.696	75%	0.752	S	S	*	*			trans	62.8	125	135	-77.3	179.9	-12.9	0	0	126.4
882	L	27.9	Very low	28.9	Very low	130 Å²	130	156 Å²	156	68%	0.681	76%	0.76	S	S	*	*				85.4	111.5	125	-71.2	169.5	0	0	0	124.1
883	R	25	Very low	28.7	Very low	216 Å²	216	154.3 Å²	154.3	82%	0.815	75%	0.753	S	S	*	*				71.6	129	129.2	-88.6	-171.7	178.6	158.1	1.8	122.9
884	E	25	Very low	28.7	Very low	162 Å²	162	154.4 Å²	154.4	76%	0.757	76%	0.762	S	S	*	*			trans	78.3	162.1	136.8	-73.5	-56.5	146	0	0	121.5
885	V	29.8	Very low	28.5	Very low	109 Å²	109	152.9 Å²	152.9	66%	0.661	76%	0.76	S	S	*	*			trans	72.3	93.7	167.3	-162.1	0	0	0	0	117.2
886	Q	30.8	Very low	28.4	Very low	141 Å²	141	151.4 Å²	151.4	66%	0.659	76%	0.758	S	S	*	*			trans	81.8	117.6	143.2	-68.8	-177.7	63.8	0	0	122.3
887	K	27.9	Very low	28.2	Very low	174 Å²	174	154.5 Å²	154.5	76%	0.757	77%	0.767	S	S	*	*			trans	77	125.9	134.9	-65.8	166.8	-180	160.7	0	119
888	K	29.3	Very low	28	Very low	208 Å²	208	157 Å²	157	90%	0.904	77%	0.767	S	S	*	*			trans	72.9	88.8	167.1	-59.3	-175.9	177.4	-177.9	0	117.1
889	K	25.6	Very low	27.7	Very low	207 Å²	207	159.7 Å²	159.7	90%	0.9	77%	0.77	S	S	*	*			trans	-132.3	168.4	150.8	-103.5	-168.9	175.1	176.8	0	109.5
890	P	33.1	Very low	27.5	Very low	122 Å²	122	162.9 Å²	162.9	79%	0.792	77%	0.774	S	S	*	*			trans	-99.3	161.8	-131.1	37.6	-39	0	0	0	115.7
891	T	28.3	Very low	27.5	Very low	139 Å²	139	161.4 Å²	161.4	85%	0.853	78%	0.778	S	S	*	*			trans	-108.7	113.6	169	48.3	0	0	0	0	110.9
892	Y	23.8	Very low	27.2	Very low	217 Å²	217	160.3 Å²	160.3	85%	0.851	78%	0.782	S	S	*	*			trans	-78	166.3	150.5	-118.3	-100.2	0	0	0	109.1
893	N	24.9	Very low	27.2	Very low	118 Å²	118	160.4 Å²	160.4	63%	0.631	78%	0.783	S	S	*	*			trans	65.1	99.3	175.2	-59.5	-5.2	0	0	0	116.8
894	S	30	Very low	27.4	Very low	120 Å²	120	159.1 Å²	159.1	84%	0.839	78%	0.778	S	S	*	*			trans	-150.8	149.5	135.7	-78.5	0	0	0	0	109.3
895	F	26.2	Very low	27.5	Very low	167 Å²	167	155.4 Å²	155.4	73%	0.732	77%	0.77	S	S	*	*			trans	-74	164.8	-166.7	-92.9	-110.3	0	0	0	114.9
896	N	28.8	Very low	27.4	Very low	145 Å²	145	154.3 Å²	154.3	78%	0.775	76%	0.76	S	S	*	*			trans	59.8	88.3	156	-63.3	1.5	0	0	0	117.1
897	L	25.6	Very low	27.3	Very low	153 Å²	153	149.9 Å²	149.9	80%	0.801	75%	0.752	S	S	*	*			trans	-72.2	128	163.5	-82.9	87.7	0	0	0	111.6
898	Y	26.1	Very low	27.3	Very low	199 Å²	199	148.5 Å²	148.5	78%	0.78	75%	0.749	S	S	*	*			trans	43	128.6	141.1	-65.3	-96.3	0	0	0	120.9
899	E	23.8	Very low	27.1	Very low	190 Å²	190	145.7 Å²	145.7	89%	0.888	74%	0.743	S	S	*	*				-130	105.9	127.8	-165.5	169	-128.6	0	0	110.7
900	Y	23.9	Very low	27.6	Very low	208 Å²	208	140.3 Å²	140.3	82%	0.816	73%	0.729	S	S	*	*			trans	-178.5	141.2	169.1	-103.5	-75.4	0	0	0	107.5
901	P	29.5	Very low	27.3	Very low	116 Å²	116	140.5 Å²	140.5	75%	0.753	72%	0.723	S	S	*	*			cis	-126.2	178.3	-43.9	34.6	-19.2	0	0	0	112.2
902	T	25.9	Very low	27.1	Very low	126 Å²	126	140.7 Å²	140.7	77%	0.773	73%	0.725	S	S	*	*			trans	-74.6	123.1	174.8	43	0	0	0	0	113
903	N	28.5	Very low	27.1	Very low	132 Å²	132	136.8 Å²	136.8	71%	0.706	72%	0.717	S	S	*	*				-177.7	165.4	104.8	-107.4	-64	0	0	0	115.7
904	R	29.7	Very low	27.1	Very low	189 Å²	189	137 Å²	137	71%	0.713	72%	0.723	S	S	*	*			trans	76.9	66	-177.5	-58.6	-179.1	179	-174.9	-1.6	114.8	P1375	R904-P1375 HydrophobicContact CG-CB 4.26Å; R904-P1375 HydrophobicContact CG-CG 3.91Å
905	S	26.8	Very low	26.9	Very low	83 Å²	83	138.3 Å²	138.3	58%	0.58	72%	0.719	S	S	*	*			trans	-143.3	135.4	165.3	-169.9	0	0	0	0	110.6	H1373 F1374	S905-H1373 PolarHBondContact OG-CD2 2.87Å; S905-H1373 VanDerWaalsContact OG-CD2 3.22Å; S905-H1373 PolarHBondContact OG-NE2 3.31Å; S905-F1374 WeakPolarHBondContact O-CD2 3.04Å; S905-F1374 WeakPolarHBondContact O-CE2 3.28Å; S905-F1374 WeakPolarHBondContact O-CG 3.12Å
906	L	27.8	Very low	26.8	Very low	86 Å²	86	136.2 Å²	136.2	45%	0.45	72%	0.722	S	S	.	*			trans	-114.6	146.6	-151.1	168.4	156.3	0	0	0	117	H1373 F1374	L906-H1373 HydrophobicContact CB-CB 3.41Å; L906-H1373 VanDerWaalsContact CB-CB 3.41Å; L906-H1373 WeakPolarHBondContact CB-ND1 3.46Å; L906-H1373 VanDerWaalsContact N-CB 3.33Å; L906-H1373 PolarHBondContact N-ND1 2.62Å; L906-F1374 VanDerWaalsContact CA-CD1 3.47Å; L906-F1374 HydrophobicContact CB-CB 3.63Å; L906-F1374 HydrophobicContact CB-CD1 3.31Å; L906-F1374 HydrophobicContact CB-CD2 4.46Å; L906-F1374 HydrophobicContact CB-CE1 4.09Å; L906-F1374 HydrophobicContact CB-CG 3.51Å; L906-F1374 HydrophobicContact CD1-CD1 3.75Å; L906-F1374 HydrophobicContact CG-CD1 3.47Å; L906-F1374 VanDerWaalsContact CG-CD1 3.47Å; L906-F1374 HydrophobicContact CG-CE1 4Å; L906-F1374 HydrophobicContact CG-CG 4.21Å
907	G	28.6	Very low	26.8	Very low	49 Å²	49	135.7 Å²	135.7	51%	0.505	72%	0.724	S	S	.	*			trans	108.5	132.1	137.7	0	0	0	0	0	114.5
908	Q	27.7	Very low	27.1	Very low	145 Å²	145	133.3 Å²	133.3	68%	0.678	73%	0.726	S	S	*	*			cis	52.1	106.9	7.2	-68.5	-164.5	-9.7	0	0	115.5
909	L	25.3	Very low	27.2	Very low	149 Å²	149	132.9 Å²	132.9	78%	0.78	73%	0.728	S	S	*	*			cis	-162.5	-176.2	6.8	-91.6	177.9	0	0	0	106.2
910	P	34.5	Very low	27.3	Very low	94 Å²	94	131.5 Å²	131.5	61%	0.61	73%	0.726	S	S	*	*			cis	-134.5	-156.9	-31.6	27.9	-3.9	0	0	0	111.8
911	N	27.7	Very low	27.5	Very low	125 Å²	125	125.9 Å²	125.9	67%	0.668	72%	0.717	S	S	*	*			trans	103.7	96.3	144.4	-65.8	-19	0	0	0	120.6	L913	N911-L913 HydrophobicContact CB-CB 4.48Å
912	T	24.1	Very low	27.6	Very low	144 Å²	144	129.6 Å²	129.6	88%	0.883	72%	0.721	S	S	*	*				-75.3	108.7	122.8	-58.2	0	0	0	0	109
913	L	23.8	Very low	27.8	Very low	134 Å²	134	127.1 Å²	127.1	70%	0.702	72%	0.721	S	S	*	*			trans	-160.2	107.4	161.4	-128.7	101.3	0	0	0	106.9	N911	N911-L913 HydrophobicContact CB-CB 4.48Å
914	V	24.8	Very low	27.9	Very low	123 Å²	123	126.5 Å²	126.5	75%	0.745	73%	0.727	S	S	*	*				106.8	138.3	75.2	151.1	0	0	0	0	111.4
915	I	25.6	Very low	27.8	Very low	148 Å²	148	127 Å²	127	76%	0.759	74%	0.737	S	S	*	*			trans	-51.3	130.4	176.7	-62.7	154	0	0	0	111.6	V917	I915-V917 PolarHBondContact O-N 3.13Å
916	P	23.8	Very low	27.7	Very low	123 Å²	123	128.4 Å²	128.4	80%	0.799	75%	0.747	S	S	*	*			trans	-90.2	102.5	-178	33.8	-33.3	0	0	0	113
917	V	29.6	Very low	28	Very low	134 Å²	134	129.6 Å²	129.6	81%	0.812	76%	0.76	S	S	*	*			trans	-140.8	102.6	161.6	-173.8	0	0	0	0	111.5	I915	I915-V917 PolarHBondContact O-N 3.13Å
918	A	31.1	Very low	28	Very low	102 Å²	102	133 Å²	133	84%	0.843	77%	0.771	S	S	*	*			trans	177.9	124.8	138.8	0	0	0	0	0	109.8
919	K	28.2	Very low	28.2	Very low	191 Å²	191	132.2 Å²	132.2	83%	0.83	78%	0.776	S	S	*	*			trans	-141.9	131.3	172.3	-151.5	-173.8	-173.9	178.6	0	107.9
920	L	26.9	Very low	28.4	Very low	160 Å²	160	133.5 Å²	133.5	84%	0.838	78%	0.775	S	S	*	*			trans	66.4	157.1	175.6	-53.4	163.6	0	0	0	113.4
921	S	27	Very low	28.1	Very low	91 Å²	91	136.4 Å²	136.4	64%	0.636	78%	0.781	S	S	*	*			cis	-171.3	170.4	-20.2	53.7	0	0	0	0	105.5
922	K	32.3	Very low	28.3	Very low	193 Å²	193	138.5 Å²	138.5	84%	0.839	79%	0.787	S	S	*	*			cis	-140.1	162.8	22.2	-59.2	169.4	-175.3	171.4	0	106.8
923	G	30.5	Very low	28.5	Very low	74 Å²	74	136.8 Å²	136.8	76%	0.763	78%	0.776	S	S	*	*				79	129.8	60.5	0	0	0	0	0	110
924	S	31.2	Very low	28.7	Very low	120 Å²	120	136.6 Å²	136.6	84%	0.839	78%	0.781	S	S	*	*			cis	-163	167.5	17.4	55.7	0	0	0	0	113
925	H	26.3	Very low	28.8	Very low	199 Å²	199	136.5 Å²	136.5	92%	0.921	78%	0.782	S	S	*	*			trans	-128.5	147.2	164.1	-91.1	-56.1	0	0	0	110.9
926	S	24.5	Very low	29	Very low	113 Å²	113	138.9 Å²	138.9	79%	0.79	79%	0.787	S	S	*	*			trans	-158.6	133.2	162.9	-173.7	0	0	0	0	105.3
927	P	35.6	Very low	29.6	Very low	110 Å²	110	138.2 Å²	138.2	71%	0.714	78%	0.783	S	S	*	*				-155.1	169.2	92.6	42	-23.1	0	0	0	117.5
928	T	27.7	Very low	29.6	Very low	120 Å²	120	143 Å²	143	74%	0.736	79%	0.788	S	S	*	*			trans	28.6	127.6	149.1	54.1	0	0	0	0	124.4
929	V	32.4	Very low	29.8	Very low	130 Å²	130	148.9 Å²	148.9	79%	0.788	79%	0.79	S	S	*	*			trans	65.9	103.4	130.5	-173.6	0	0	0	0	121
930	K	28.9	Very low	29.8	Very low	175 Å²	175	146.9 Å²	146.9	76%	0.761	78%	0.781	S	S	*	*			trans	29	126.2	137.5	-70.9	-173.4	175.6	-176.1	0	123.1
931	Q	29.2	Very low	29.9	Very low	156 Å²	156	143 Å²	143	73%	0.729	77%	0.768	S	S	*	*			trans	82.9	142.1	130.5	-74.2	179	-62.3	0	0	121.6
932	Q	31	Very low	30.1	Very low	169 Å²	169	146.9 Å²	146.9	79%	0.79	78%	0.776	S	S	*	*			trans	68.9	143.9	154.5	-77.6	176.9	-18.5	0	0	118.7
933	T	29.2	Very low	30	Very low	107 Å²	107	141.2 Å²	141.2	66%	0.656	76%	0.757	S	S	*	*			cis	-162	149.1	-31.8	-1	0	0	0	0	109.9
934	T	26.5	Very low	30.7	Very low	131 Å²	131	141.1 Å²	141.1	80%	0.804	75%	0.745	S	S	*	*			trans	64.6	-170.8	164.1	65.4	0	0	0	0	115
935	P	28.6	Very low	30.8	Very low	120 Å²	120	146.2 Å²	146.2	78%	0.779	75%	0.746	S	S	*	*				-113.7	173.6	-109.8	22.3	0.2	0	0	0	117
936	K	28.8	Very low	30.8	Very low	198 Å²	198	141.6 Å²	141.6	86%	0.861	74%	0.736	S	S	*	*			trans	-49.9	168	173.7	-56.3	179.8	177.8	-177.5	0	114.4
937	P	36.2	Very low	30.9	Very low	110 Å²	110	141.4 Å²	141.4	71%	0.714	73%	0.726	S	S	*	*			cis	-134.3	146.4	-6.8	33.6	-15.6	0	0	0	115.8
938	Y	30.3	Very low	30.9	Very low	234 Å²	234	139.7 Å²	139.7	92%	0.918	72%	0.715	S	S	*	*			trans	-171.4	124.4	151.7	-113.4	-75	0	0	0	112.4
939	Y	34.2	Very low	30.9	Very low	226 Å²	226	140.3 Å²	140.3	89%	0.886	71%	0.707	S	S	*	*			trans	-177	142.6	143.2	-119.6	-80.4	0	0	0	108.9
940	K	28.2	Very low	30.6	Very low	149 Å²	149	138.9 Å²	138.9	65%	0.648	70%	0.704	S	S	*	*			trans	-144	143.4	174.6	-172.1	167.6	-173.2	164.9	0	109.8	K1389	K940-K1389 VanDerWaalsContact CE-O 3.28Å; K940-K1389 WeakPolarHBondContact CE-O 3.08Å; K940-K1389 PolarHBondContact NZ-O 2.84Å
941	S	28.7	Very low	30.6	Very low	79 Å²	79	138 Å²	138	55%	0.552	71%	0.706	S	S	*	*			trans	59.5	151	179.7	59.2	0	0	0	0	114.2
942	E	32	Very low	30.5	Very low	172 Å²	172	138.1 Å²	138.1	80%	0.804	70%	0.704	S	S	*	*	S	Bend	cis	-143	144.3	23.3	-80.3	-178.5	170.6	0	0	110
943	V	29.7	Very low	30.2	Very low	74 Å²	74	136.1 Å²	136.1	45%	0.448	70%	0.695	S	S	.	*	S	Bend	cis	-143.2	130.9	-7.8	-175.3	0	0	0	0	108
944	S	44.7	Very low	30	Very low	72 Å²	72	139 Å²	139	50%	0.503	70%	0.701	S	S	.	*			cis	-159.7	56.3	-17.8	50.4	0	0	0	0	107.7
945	R	34.5	Very low	30.3	Very low	226 Å²	226	138 Å²	138	85%	0.853	70%	0.7	S	S	*	*			trans	-120.3	142	-158.9	-71.7	172.5	166	119.4	-3.5	112.8
946	S	26.6	Very low	30.3	Very low	102 Å²	102	138.1 Å²	138.1	71%	0.713	69%	0.688	S	S	*	*	S	Bend	trans	52.9	87.7	-177.2	57.3	0	0	0	0	116.6
947	D	26.9	Very low	30.2	Very low	109 Å²	109	138.5 Å²	138.5	58%	0.583	69%	0.69	S	S	*	*				42.3	157.9	121.3	-49	-49.5	0	0	0	122.1
948	P	34.1	Very low	29.8	Very low	75 Å²	75	139.1 Å²	139.1	49%	0.487	68%	0.683	S	S	.	*			cis	-136	-169.8	-18	21.5	4.9	0	0	0	114.4
949	F	28.5	Very low	29.8	Very low	132 Å²	132	133.7 Å²	133.7	58%	0.579	67%	0.666	S	S	*	*			trans	88.1	129.1	152.8	-75.9	-65.8	0	0	0	124.1	D1387	F949-D1387 PolarHBondContact N-O 2.92Å
950	S	26.5	Very low	29.4	Very low	101 Å²	101	128.1 Å²	128.1	71%	0.706	66%	0.656	S	S	*	*			trans	68.2	111	138.3	-67.2	0	0	0	0	121.7
951	L	28.6	Very low	29.2	Very low	155 Å²	155	127.8 Å²	127.8	81%	0.812	66%	0.661	S	S	*	*				-157.4	130.7	97.2	-104.8	168.4	0	0	0	113.5
952	K	26.1	Very low	29.2	Very low	159 Å²	159	131.9 Å²	131.9	69%	0.691	68%	0.677	S	S	*	*			trans	23.1	123.2	144.3	-80.2	178.8	165.3	-95	0	121.6
953	E	26.1	Very low	29.1	Very low	127 Å²	127	126.5 Å²	126.5	59%	0.593	67%	0.668	S	S	*	*				66.9	145.5	118.9	-67.9	-175.6	86.4	0	0	123.3
954	Q	25.2	Very low	29	Very low	167 Å²	167	134.8 Å²	134.8	78%	0.78	69%	0.691	S	S	*	*			trans	63.2	82.9	145.4	-68.5	171.4	47.6	0	0	119.4
955	S	31.5	Very low	28.5	Very low	112 Å²	112	136.1 Å²	136.1	78%	0.783	70%	0.7	S	S	*	*				-148	104.1	119.5	59.9	0	0	0	0	109.3
956	K	28.1	Very low	28.1	Very low	121 Å²	121	132.4 Å²	132.4	53%	0.526	69%	0.692	S	S	.	*				57.4	85	102.2	-83.8	-155	159.1	-162.3	0	114.3	H958 E959	K956-H958 HydrophobicContact CB-CB 4.03Å; K956-H958 HydrophobicContact CD-CB 4.27Å; K956-H958 HydrophobicContact CG-CB 4.07Å; K956-E959 IonicContact NZ-OE1 2.76Å; K956-E959 PolarHBondContact NZ-OE1 2.89Å; K956-E959 IonicContact NZ-OE2 2.67Å; K956-E959 PolarHBondContact NZ-OE2 3.13Å
957	F	27.3	Very low	28.3	Very low	207 Å²	207	137.4 Å²	137.4	91%	0.908	70%	0.696	S	S	*	*				-128	114.1	127.9	-80.8	-91.6	0	0	0	107.5
958	H	28.2	Very low	28.5	Very low	122 Å²	122	138 Å²	138	57%	0.565	70%	0.698	S	S	*	*			cis	61.7	161.3	-5.1	-64.1	-106.3	0	0	0	116.5	K956	K956-H958 HydrophobicContact CB-CB 4.03Å; K956-H958 HydrophobicContact CD-CB 4.27Å; K956-H958 HydrophobicContact CG-CB 4.07Å
959	E	31.2	Very low	28.4	Very low	120 Å²	120	142.2 Å²	142.2	56%	0.561	71%	0.712	S	S	*	*			cis	-123.5	139.7	-18.5	-150.4	125.3	-127.8	0	0	107.2	K956	K956-E959 IonicContact NZ-OE1 2.76Å; K956-E959 PolarHBondContact NZ-OE1 2.89Å; K956-E959 IonicContact NZ-OE2 2.67Å; K956-E959 PolarHBondContact NZ-OE2 3.13Å
960	T	25.8	Very low	28.6	Very low	110 Å²	110	142.8 Å²	142.8	68%	0.675	72%	0.716	S	S	*	*			trans	16.1	118.2	157.1	53.2	0	0	0	0	119.7
961	N	23.8	Very low	28.7	Very low	142 Å²	142	144.3 Å²	144.3	76%	0.759	72%	0.715	S	S	*	*				37.4	111.7	109.9	-52.5	-11.3	0	0	0	117.6
962	D	27.8	Very low	28.7	Very low	164 Å²	164	144.8 Å²	144.8	88%	0.877	71%	0.711	S	S	*	*				-173.7	144.6	102.4	-95.1	-19.7	0	0	0	110.1
963	G	30.8	Very low	28.8	Very low	60 Å²	60	145.6 Å²	145.6	62%	0.619	72%	0.715	S	S	*	*			cis	162.8	170.7	-7.3	0	0	0	0	0	112.3
964	R	27.7	Very low	28.8	Very low	248 Å²	248	145.6 Å²	145.6	94%	0.936	72%	0.719	S	S	*	*			trans	67.4	153.5	169.8	-56.2	176.6	-177.9	-179.2	0.2	115.4
965	S	33.5	Very low	29	Very low	100 Å²	100	143.9 Å²	143.9	70%	0.699	72%	0.715	S	S	*	*			cis	-149.5	133.8	-1.4	34.3	0	0	0	0	108.2
966	H	27	Very low	28.7	Very low	148 Å²	148	146.3 Å²	146.3	69%	0.685	72%	0.718	S	S	*	*				81.9	160.9	76.7	-147.3	-77.3	0	0	0	113.7	D968	H966-D968 IonicContact CE1-OD1 3.63Å; H966-D968 IonicContact ND1-OD1 3.19Å
967	W	30.9	Very low	28.7	Very low	207 Å²	207	151.7 Å²	151.7	78%	0.784	74%	0.736	S	S	*	*			trans	81.5	92.5	-172.1	-44.3	109.9	0	0	0	111.9
968	D	29.5	Very low	28.8	Very low	120 Å²	120	153 Å²	153	64%	0.642	73%	0.734	S	S	*	*				103.9	144.8	71.1	-81.7	18.6	0	0	0	107.9	H966	H966-D968 IonicContact CE1-OD1 3.63Å; H966-D968 IonicContact ND1-OD1 3.19Å
969	E	31.8	Very low	28.6	Very low	164 Å²	164	151.9 Å²	151.9	77%	0.766	74%	0.74	S	S	*	*			cis	-141.3	165.2	31.7	-72.7	-175.3	126.6	0	0	115.1
970	H	32.8	Very low	28.3	Very low	144 Å²	144	155.7 Å²	155.7	67%	0.667	76%	0.755	S	S	*	*			trans	44.2	121	151.1	-66.6	-61.1	0	0	0	122
971	L	29.1	Very low	28.4	Very low	133 Å²	133	155.4 Å²	155.4	70%	0.696	76%	0.758	S	S	*	*				69	134.1	68.7	-73.8	159.5	0	0	0	114.2
972	K	29.6	Very low	28.6	Very low	166 Å²	166	155.2 Å²	155.2	72%	0.722	76%	0.762	S	S	*	*			cis	-167.9	135.4	2.6	-159.6	176.4	-159.8	175.2	0	113
973	F	26.5	Very low	29	Very low	176 Å²	176	158.5 Å²	158.5	77%	0.772	76%	0.761	S	S	*	*			trans	51.7	142.5	150.6	-80.2	-116.3	0	0	0	124.8
974	D	27.8	Very low	29.1	Very low	126 Å²	126	161.1 Å²	161.1	67%	0.674	77%	0.768	S	S	*	*			trans	72.7	119.5	142.7	-71	0.6	0	0	0	126.3
975	N	27.6	Very low	29.3	Very low	132 Å²	132	155.6 Å²	155.6	71%	0.706	76%	0.755	S	S	*	*			trans	70.9	123.2	133.2	-73.5	-52.7	0	0	0	124.4
976	L	26.1	Very low	29.1	Very low	162 Å²	162	159.2 Å²	159.2	85%	0.848	76%	0.759	S	S	*	*			trans	76.8	142.8	143.2	-69.2	167.5	0	0	0	122.6
977	R	28.6	Very low	29.6	Very low	235 Å²	235	157.9 Å²	157.9	89%	0.887	76%	0.761	S	S	*	*			trans	74.4	109.2	156.7	-98.5	-177.6	176.5	-174.7	-1.1	121.5
978	R	28.1	Very low	29.7	Very low	234 Å²	234	154 Å²	154	88%	0.883	76%	0.755	S	S	*	*			trans	27.4	139	138.3	-66.4	-170.2	174.8	-171.2	-1.2	122.4
979	S	25.6	Very low	29.8	Very low	98 Å²	98	155.3 Å²	155.3	69%	0.685	76%	0.763	S	S	*	*			trans	86.6	105.2	133.6	48.9	0	0	0	0	123
980	F	24.9	Very low	29.8	Very low	201 Å²	201	152.5 Å²	152.5	88%	0.882	76%	0.761	S	S	*	*				71.5	113.9	128.3	-75.9	-68.8	0	0	0	123.5
981	S	26.6	Very low	29.6	Very low	104 Å²	104	149.8 Å²	149.8	73%	0.727	76%	0.764	S	S	*	*				79.1	131.8	125.5	-161.6	0	0	0	0	121.1
982	V	28.6	Very low	29.7	Very low	138 Å²	138	152.5 Å²	152.5	84%	0.836	77%	0.77	S	S	*	*				-167.2	150.7	121.5	141.1	0	0	0	0	109.5
983	R	36	Very low	29.6	Very low	232 Å²	232	148.8 Å²	148.8	88%	0.875	76%	0.761	S	S	*	*			trans	-115.5	154.6	176.2	-65	-170.6	-170.3	-176.3	3.8	113
984	P	33.6	Very low	29.8	Very low	116 Å²	116	145.9 Å²	145.9	75%	0.753	76%	0.76	S	S	*	*			trans	-107.9	177.7	157	39.3	-31.2	0	0	0	113.3
985	I	31	Very low	29.6	Very low	131 Å²	131	150.2 Å²	150.2	67%	0.672	77%	0.769	S	S	*	*				-161.5	120.3	-51.6	-167.5	164.9	0	0	0	112.1
986	K	29.8	Very low	30.2	Very low	177 Å²	177	151.6 Å²	151.6	77%	0.77	77%	0.774	S	S	*	*			trans	67.3	157.8	161.4	-68.1	165.8	-166.7	171.9	0	117.1
987	T	37.6	Very low	30.1	Very low	120 Å²	120	148.2 Å²	148.2	74%	0.736	76%	0.764	S	S	*	*			cis	-132.1	145.7	23.9	51.1	0	0	0	0	116.4
988	N	33	Very low	29.9	Very low	124 Å²	124	142 Å²	142	66%	0.663	76%	0.756	S	S	*	*				28.3	133.9	129.2	-51.7	10.8	0	0	0	119.2
989	N	31.1	Very low	29.8	Very low	149 Å²	149	137.5 Å²	137.5	80%	0.797	75%	0.754	S	S	*	*			cis	-147.6	175.6	-5.6	-65.8	-44.6	0	0	0	106.3
990	S	31	Very low	30	Very low	105 Å²	105	137.6 Å²	137.6	73%	0.734	76%	0.755	S	S	*	*			cis	-162.1	142.8	14.1	47.5	0	0	0	0	111.9
991	A	28.6	Very low	30.2	Very low	87 Å²	87	135 Å²	135	72%	0.719	75%	0.75	S	S	*	*			trans	64.3	159.9	146.6	0	0	0	0	0	122.4
992	F	31.8	Very low	30.4	Very low	190 Å²	190	138.1 Å²	138.1	83%	0.833	75%	0.75	S	S	*	*			trans	64.2	92	166.2	-67.8	-72.6	0	0	0	121.6
993	T	27.9	Very low	30.6	Very low	87 Å²	87	138.9 Å²	138.9	53%	0.534	74%	0.744	S	S	.	*				42.7	111.2	122.1	55.6	0	0	0	0	120.3
994	P	30.3	Very low	30.3	Very low	115 Å²	115	136.1 Å²	136.1	75%	0.747	74%	0.739	S	S	*	*	S	Bend		-69.2	169.1	119.4	36.3	-34.8	0	0	0	111
995	Y	24.2	Very low	30.3	Very low	217 Å²	217	137.6 Å²	137.6	85%	0.851	74%	0.739	S	S	*	*	S	Bend	trans	69.6	155.1	179.5	-84	-94.8	0	0	0	118
996	I	40.7	Very low	30.1	Very low	162 Å²	162	139.1 Å²	139.1	83%	0.831	75%	0.747	S	S	*	*			trans	-58.8	128.3	178.1	-60	164.1	0	0	0	110.3
997	S	23.6	Very low	30.6	Very low	90 Å²	90	135.7 Å²	135.7	63%	0.629	74%	0.743	S	S	*	*			trans	-147.6	98.8	170	175.6	0	0	0	0	109.1
998	C	24.8	Very low	30.2	Very low	106 Å²	106	136.1 Å²	136.1	72%	0.716	74%	0.741	S	S	*	*				71.3	117.9	78.5	-67.9	0	0	0	0	114.2
999	T	25.2	Very low	30.1	Very low	138 Å²	138	137.3 Å²	137.3	85%	0.847	74%	0.743	S	S	*	*	S	Bend	trans	-83.3	119.8	146.4	30.8	0	0	0	0	109.8
1000	S	30.8	Very low	29.9	Very low	100 Å²	100	137 Å²	137	70%	0.699	74%	0.74	S	S	*	*			trans	78.4	109.2	146	-60.2	0	0	0	0	121.4
1001	L	28.2	Very low	29.7	Very low	148 Å²	148	138.5 Å²	138.5	78%	0.775	74%	0.739	S	S	*	*				97.3	105.9	128.6	-65.8	165.7	0	0	0	121.6
1002	K	30.1	Very low	29.6	Very low	168 Å²	168	142 Å²	142	73%	0.73	74%	0.741	S	S	*	*			trans	93.5	100.2	132.2	-72.6	-179	175.5	178.1	0	121.4
1003	Q	32.3	Very low	29.4	Very low	154 Å²	154	140 Å²	140	72%	0.72	74%	0.738	S	S	*	*				82	110.1	116.3	-72.9	177.3	-28.4	0	0	121.4
1004	K	31.4	Very low	29.2	Very low	174 Å²	174	142.5 Å²	142.5	76%	0.757	75%	0.748	S	S	*	*				83.8	119.1	122.2	-81	-172.7	163.2	-169.6	0	121.6
1005	I	32.7	Very low	29	Very low	148 Å²	148	142.9 Å²	142.9	76%	0.759	74%	0.743	S	S	*	*			trans	97.3	145.4	130.4	-67.9	169.2	0	0	0	118.6
1006	L	28	Very low	29.4	Very low	162 Å²	162	140.7 Å²	140.7	85%	0.848	75%	0.746	S	S	*	*			trans	-74	173.7	-169.4	-97.1	65	0	0	0	115
1007	P	38.6	Very low	29	Very low	106 Å²	106	139 Å²	139	69%	0.688	74%	0.739	S	S	*	*			trans	-113.3	-179.1	-162.8	41.9	-31.7	0	0	0	114.6
1008	N	30.6	Very low	29.3	Very low	128 Å²	128	143.6 Å²	143.6	68%	0.684	75%	0.748	S	S	*	*				-178	152.1	122.9	-102.2	21.5	0	0	0	114.6
1009	E	30.5	Very low	29.8	Very low	149 Å²	149	146.1 Å²	146.1	70%	0.696	75%	0.754	S	S	*	*			trans	43.3	116.1	141	-63.5	174.8	127.5	0	0	123.4
1010	L	26.7	Very low	30.1	Very low	143 Å²	143	146.8 Å²	146.8	75%	0.749	75%	0.752	S	S	*	*				65.2	128.5	122.8	-68	166.5	0	0	0	123.2
1011	L	27	Very low	30.1	Very low	136 Å²	136	149.8 Å²	149.8	71%	0.712	76%	0.76	S	S	*	*			trans	75.7	107	143.6	-64.9	165.1	0	0	0	121.2
1012	E	26.7	Very low	30.1	Very low	161 Å²	161	151.4 Å²	151.4	75%	0.752	76%	0.761	S	S	*	*				93.9	126.8	126.4	-76.3	-176.4	-173.6	0	0	123.9
1013	L	26.4	Very low	30.1	Very low	148 Å²	148	149.4 Å²	149.4	78%	0.775	76%	0.762	S	S	*	*			trans	73.8	57.6	138.5	-61.2	170.8	0	0	0	121.7
1014	N	24.9	Very low	29.9	Very low	140 Å²	140	151.5 Å²	151.5	75%	0.749	77%	0.765	S	S	*	*				52.2	149.5	101.2	-153.4	14.4	0	0	0	122.9
1015	L	26.5	Very low	29.7	Very low	123 Å²	123	152 Å²	152	64%	0.644	76%	0.764	S	S	*	*			trans	81.7	113.5	162.1	-56.5	-179.5	0	0	0	121.9
1016	N	32.4	Very low	29.4	Very low	170 Å²	170	153.2 Å²	153.2	91%	0.909	77%	0.766	S	S	*	*				-163	148.4	113.8	-110.2	-52.2	0	0	0	112.8
1017	D	31.2	Very low	29.6	Very low	126 Å²	126	150.6 Å²	150.6	67%	0.674	76%	0.759	S	S	*	*			trans	-113.1	156.1	-165.3	-67.1	-62.5	0	0	0	115.5
1018	K	30	Very low	29	Very low	188 Å²	188	155.9 Å²	155.9	82%	0.817	77%	0.765	S	S	*	*				154.3	127.7	116.4	-84.8	162.1	-174	169.2	0	114.5
1019	N	35.9	Very low	28.8	Very low	158 Å²	158	160.2 Å²	160.2	85%	0.845	77%	0.773	S	S	*	*				-170.3	152.7	113.5	-102.2	-37.8	0	0	0	113.8
1020	N	31.9	Very low	28.5	Very low	152 Å²	152	157.4 Å²	157.4	81%	0.813	77%	0.77	S	S	*	*			trans	-77.2	146.6	-162.6	-67.9	-68.2	0	0	0	116.4
1021	L	30.2	Very low	28.3	Very low	164 Å²	164	158.1 Å²	158.1	86%	0.859	77%	0.774	S	S	*	*				-152.8	100.6	130	-122	158.7	0	0	0	112.4
1022	K	29.1	Very low	28.2	Very low	182 Å²	182	158.5 Å²	158.5	79%	0.791	77%	0.772	S	S	*	*			trans	21.1	116.4	158	-65.3	176.5	179.2	177.7	0	117.4
1023	T	30	Very low	28.2	Very low	125 Å²	125	158.1 Å²	158.1	77%	0.767	77%	0.77	S	S	*	*			cis	-162.1	-161.6	4.9	-9.3	0	0	0	0	108
1024	Y	27.6	Very low	28.1	Very low	198 Å²	198	158.4 Å²	158.4	78%	0.776	77%	0.768	S	S	*	*			cis	-144.5	-153.3	18.4	-162.4	-112.8	0	0	0	111.6
1025	Y	27.8	Very low	28.3	Very low	186 Å²	186	158.3 Å²	158.3	73%	0.729	77%	0.766	S	S	*	*			trans	-75.5	131.2	-169.4	-85	-115.7	0	0	0	115.6
1026	Q	25.4	Very low	28.4	Very low	172 Å²	172	159.1 Å²	159.1	80%	0.804	77%	0.771	S	S	*	*			trans	-102	174.1	134.9	-63.2	-174	-21.8	0	0	108.3
1027	P	31.6	Very low	28.3	Very low	107 Å²	107	155.4 Å²	155.4	70%	0.695	76%	0.758	S	S	*	*				-158.1	150.5	92.8	40.4	-20.7	0	0	0	119
1028	R	25.9	Very low	28.1	Very low	217 Å²	217	156.3 Å²	156.3	82%	0.819	76%	0.763	S	S	*	*			trans	56.6	133.4	130.1	-68.9	-171.9	166.3	-175.2	-5.1	125.2
1029	Y	27.9	Very low	27.9	Very low	219 Å²	219	154.4 Å²	154.4	86%	0.859	76%	0.761	S	S	*	*			trans	74.7	-178	132.5	-84.7	-106	0	0	0	120.6
1030	S	22.8	Very low	27.4	Very low	91 Å²	91	153.4 Å²	153.4	64%	0.636	76%	0.755	S	S	*	*			trans	-133.7	164.1	-140.4	56.3	0	0	0	0	114.4
1031	L	22.9	Very low	27	Very low	157 Å²	157	153 Å²	153	82%	0.822	75%	0.752	S	S	*	*			trans	83.4	141.2	161.9	-125.5	76.7	0	0	0	117.6
1032	E	25	Very low	26.7	Very low	144 Å²	144	155 Å²	155	67%	0.673	75%	0.753	S	S	*	*			trans	60.2	120.7	161.6	-61.3	-155.9	98.2	0	0	121.6
1033	Q	27.3	Very low	26.4	Very low	154 Å²	154	151.3 Å²	151.3	72%	0.72	75%	0.751	S	S	*	*			trans	68.2	154	139.7	-63.6	175.6	39.1	0	0	119.2
1034	Q	25	Very low	26.2	Very low	154 Å²	154	152.9 Å²	152.9	72%	0.72	75%	0.753	S	S	*	*			cis	-165.1	163.6	-36.2	-156.1	174.9	-19.3	0	0	107.4
1035	L	27.9	Very low	25.9	Very low	138 Å²	138	150.4 Å²	150.4	72%	0.723	75%	0.752	S	S	*	*			trans	66.5	132.2	-177.5	-64.7	78.1	0	0	0	114.5
1036	N	28.4	Very low	25.7	Very low	140 Å²	140	147.9 Å²	147.9	75%	0.749	75%	0.752	S	S	*	*	S	Bend	cis	-147.8	145.5	-9.7	-84.7	-25.3	0	0	0	106.4
1037	S	30.6	Very low	25.7	Very low	91 Å²	91	145 Å²	145	64%	0.636	75%	0.746	S	S	*	*			cis	-158	132.5	1.7	47.9	0	0	0	0	111
1038	D	27.1	Very low	25.5	Very low	145 Å²	145	147.4 Å²	147.4	78%	0.775	75%	0.748	S	S	*	*			trans	51.4	126.5	145.3	-41.1	-34.4	0	0	0	120.7
1039	I	25.4	Very low	25.6	Very low	149 Å²	149	143.7 Å²	143.7	76%	0.764	74%	0.739	S	S	*	*			cis	87.9	136.9	11.8	-50	-178.8	0	0	0	117
1040	N	26.2	Very low	25.6	Very low	136 Å²	136	141.7 Å²	141.7	73%	0.727	74%	0.738	S	S	*	*			trans	74.4	143.8	177.2	-65.4	-28.7	0	0	0	117.9
1041	I	23.7	Very low	25.9	Very low	145 Å²	145	142.1 Å²	142.1	74%	0.744	73%	0.73	S	S	*	*			cis	91.7	114.2	17.3	-57.1	177.1	0	0	0	115.8
1042	F	22.4	Very low	26.3	Very low	204 Å²	204	139.2 Å²	139.2	90%	0.895	71%	0.712	S	S	*	*			trans	43.1	97.6	161.6	-92.8	-82.3	0	0	0	121
1043	S	24.2	Very low	26.5	Very low	106 Å²	106	137.3 Å²	137.3	74%	0.741	70%	0.703	S	S	*	*			trans	-161.3	123	139.4	47.8	0	0	0	0	108.3
1044	I	25.4	Very low	26.7	Very low	158 Å²	158	137.3 Å²	137.3	81%	0.81	70%	0.703	S	S	*	*				71.5	129.3	82.7	-64.2	171.1	0	0	0	114.1
1045	L	21.3	Very low	27.1	Very low	145 Å²	145	136.9 Å²	136.9	76%	0.759	70%	0.701	S	S	*	*			trans	-27.3	128.3	163.2	-69.2	147.2	0	0	0	116.2
1046	N	23.9	Very low	27	Very low	134 Å²	134	137.6 Å²	137.6	72%	0.717	70%	0.701	S	S	*	*				171.1	168.2	96.1	-94.3	-35.2	0	0	0	112.9
1047	T	25.4	Very low	27.1	Very low	110 Å²	110	136 Å²	136	68%	0.675	70%	0.7	S	S	*	*			trans	28.8	133	148.8	56.1	0	0	0	0	119.8
1048	E	26.5	Very low	27.1	Very low	158 Å²	158	139.3 Å²	139.3	74%	0.738	71%	0.706	S	S	*	*			cis	-167.9	170	23.4	-128	161.6	-134.9	0	0	113.6
1049	H	27.5	Very low	27.3	Very low	139 Å²	139	139.8 Å²	139.8	64%	0.644	70%	0.703	S	S	*	*			trans	36.9	104.8	156.6	-76	-61.8	0	0	0	122.1
1050	Q	29.8	Very low	27.3	Very low	178 Å²	178	141.9 Å²	141.9	83%	0.832	70%	0.702	S	S	*	*				179.9	116.1	103.7	-93.6	177	14.1	0	0	109.2
1051	Q	28.1	Very low	27.5	Very low	100 Å²	100	140.8 Å²	140.8	47%	0.467	69%	0.69	S	S	.	*				70.2	110.7	87.9	-74.2	-153	-12.1	0	0	116.7	S114 S115	S114-Q1051 PolarHBondContact OG-NE2 3.46Å; S115-Q1051 WeakPolarHBondContact OG-CG 3.4Å
1052	Q	30.6	Very low	27.9	Very low	96 Å²	96	141.6 Å²	141.6	45%	0.449	68%	0.684	S	S	.	*			trans	82.4	115	136.5	-62.5	-179	30.2	0	0	123.6	S115 S116	S115-Q1052 WeakPolarHBondContact OG-CG 3.19Å; S115-Q1052 PolarHBondContact OG-NE2 3.34Å; S115-Q1052 VanDerWaalsContact OG-NE2 3.07Å; S116-Q1052 WeakPolarHBondContact OG-CA 3.1Å
1053	Q	29.9	Very low	28.5	Very low	104 Å²	104	136.3 Å²	136.3	49%	0.486	66%	0.662	S	S	.	*				71.6	153.8	123.9	-62.1	-177.7	45.7	0	0	118.4	S117	S117-Q1053 PolarHBondContact OG-N 2.91Å
1054	Q	31.4	Very low	28.8	Very low	154 Å²	154	135.5 Å²	135.5	72%	0.72	65%	0.647	S	S	*	*			cis	-156.9	168.8	-7.8	-120.2	178.1	17.8	0	0	111.6
1055	H	32.9	Very low	29.2	Very low	145 Å²	145	136.2 Å²	136.2	67%	0.671	64%	0.644	S	S	*	*			trans	2.3	120	165.7	-79.1	-90.1	0	0	0	123.5
1056	Q	26.7	Very low	29.8	Very low	153 Å²	153	139 Å²	139	72%	0.715	64%	0.644	S	S	*	*				43	118.3	113.5	-63.6	177.9	-28	0	0	122.8
1057	S	29.9	Very low	30.3	Very low	106 Å²	106	139.6 Å²	139.6	74%	0.741	64%	0.641	S	S	*	*			trans	73.9	156	131.6	83.6	0	0	0	0	119.4
1058	Q	30.1	Very low	30.8	Very low	161 Å²	161	141.9 Å²	141.9	75%	0.752	64%	0.643	S	S	*	*			cis	-139.5	167.4	8.3	-70.3	-176.2	-1.7	0	0	112.7
1059	Q	32.5	Very low	31	Very low	155 Å²	155	142.6 Å²	142.6	72%	0.724	64%	0.644	S	S	*	*			trans	18.6	151.9	145.1	-53.1	-178.9	3.9	0	0	121.3
1060	W	25.8	Very low	31.1	Very low	193 Å²	193	145 Å²	145	73%	0.731	65%	0.653	S	S	*	*			cis	-174.1	167.4	40.9	-150.3	12.9	0	0	0	114.9
1061	K	29.7	Very low	31.2	Very low	112 Å²	112	139.9 Å²	139.9	49%	0.487	65%	0.647	S	S	.	*			trans	72.4	90.7	149.2	-82.8	167.5	175.1	165	0	125.3	L1096	K1061-L1096 WeakPolarHBondContact O-CD2 3.35Å
1062	R	32.8	Very low	31.4	Very low	162 Å²	162	143.8 Å²	143.8	61%	0.611	67%	0.67	S	S	*	*				68.1	140.5	113.5	-76.7	172.9	174	-142.9	10.6	126.7	H1097	R1062-H1097 PolarHBondContact O-CE1 2.85Å; R1062-H1097 PolarHBondContact O-ND1 3.25Å
1063	E	33.7	Very low	31.3	Very low	94 Å²	94	143.7 Å²	143.7	44%	0.439	69%	0.685	S	S	.	*			trans	75.2	139.6	141.1	-72.7	169.1	-133.3	0	0	122.5	P1095 L1096 H1097	E1063-P1095 PolarHBondContact N-O 3.46Å; E1063-L1096 CarbonylContact O-C 3.49Å; E1063-H1097 WeakPolarHBondContact O-CA 3.4Å; E1063-H1097 PolarHBondContact O-N 3.33Å; E1063-H1097 VanDerWaalsContact O-N 3.14Å; E1063-H1097 PolarHBondContact O-ND1 3.36Å; E1063-H1097 VanDerWaalsContact O-ND1 3.13Å
1064	Q	31.4	Very low	31.9	Very low	89 Å²	89	144.2 Å²	144.2	42%	0.416	70%	0.697	S	S	.	*			cis	-179.9	178.6	-14.3	-118.1	-78.6	-12.5	0	0	112.1	I1094	Q1064-I1094 HydrophobicContact CG-CG2 4.37Å
1065	K	32.9	Very low	32.1	Very low	172 Å²	172	146.1 Å²	146.1	75%	0.748	70%	0.703	S	S	*	*			trans	79.7	127.8	166	-67.8	162.5	-173.8	171.4	0	117.5
1066	R	34.9	Very low	32	Very low	204 Å²	204	149.2 Å²	149.2	77%	0.77	71%	0.709	S	S	*	*			cis	103.3	150.2	45.7	-86.7	-178.6	170.7	176.4	-1	110.7
1067	K	34.6	Very low	32.3	Very low	146 Å²	146	144.9 Å²	144.9	64%	0.635	70%	0.699	S	S	*	*			cis	-166	135.8	14.8	-122.5	177.8	176.3	-172.3	0	109.7
1068	H	34.2	Very low	32.5	Very low	159 Å²	159	146.7 Å²	146.7	74%	0.736	69%	0.694	S	S	*	*				92.9	166	93.4	-91.3	20.5	0	0	0	120.2
1069	F	31.2	Very low	32.6	Very low	173 Å²	173	145.5 Å²	145.5	76%	0.759	69%	0.688	S	S	*	*			trans	95	135.8	168.9	-74.2	-106.2	0	0	0	117.3
1070	K	30.9	Very low	32.7	Very low	190 Å²	190	142.9 Å²	142.9	83%	0.826	68%	0.676	S	S	*	*			cis	-169.4	155.4	-17.5	-135.7	-165.8	-165.1	178.6	0	109.8
1071	G	30.1	Very low	33.1	Very low	69 Å²	69	139.1 Å²	139.1	71%	0.711	67%	0.67	S	S	*	*			trans	166.7	88.2	163.2	0	0	0	0	0	122.3
1072	I	33.8	Very low	33.3	Very low	183 Å²	183	140.4 Å²	140.4	94%	0.938	68%	0.682	S	S	*	*			trans	63.7	117.6	140.1	-55.4	172.9	0	0	0	121.8
1073	A	28.8	Very low	33.2	Very low	93 Å²	93	140.4 Å²	140.4	77%	0.769	69%	0.687	S	S	*	*			trans	-169.1	-177.8	160.3	0	0	0	0	0	108.5
1074	P	42.5	Very low	32.9	Very low	115 Å²	115	141.8 Å²	141.8	75%	0.747	70%	0.695	S	S	*	*			cis	-127.5	-155.1	-16	43.3	-26	0	0	0	111.9
1075	K	33.7	Very low	32.7	Very low	194 Å²	194	146.1 Å²	146.1	84%	0.843	71%	0.713	S	S	*	*			trans	137.5	151.3	156.9	-77.7	164.3	-172.5	177.2	0	111.7
1076	R	31.2	Very low	32.4	Very low	211 Å²	211	145 Å²	145	80%	0.796	71%	0.71	S	S	*	*			cis	-160.1	178.8	-5.4	-118	-148	141.6	161.7	-6.6	105.5
1077	A	33.3	Very low	31.9	Very low	61 Å²	61	143.4 Å²	143.4	50%	0.504	71%	0.712	S	S	.	*			cis	173.5	-167	-38.4	0	0	0	0	0	106.8
1078	K	33.9	Very low	31.6	Very low	145 Å²	145	144.2 Å²	144.2	63%	0.63	72%	0.718	S	S	*	*			trans	73.7	131.1	-175.8	-59.4	-174.6	157.8	-121	0	114.6	E1080	K1078-E1080 WeakPolarHBondContact CA-OE1 3.03Å; K1078-E1080 PolarHBondContact N-OE1 3.14Å
1079	H	33.3	Very low	31.1	Very low	135 Å²	135	140.9 Å²	140.9	63%	0.625	71%	0.712	S	S	*	*			cis	-140.9	136.2	-3.5	-100.4	-33.4	0	0	0	107.5
1080	E	34.7	Very low	31	Very low	101 Å²	101	140.5 Å²	140.5	47%	0.472	71%	0.713	S	S	.	*			cis	65.8	110.6	33.2	-42.5	149.3	-173	0	0	110.6	K1078	K1078-E1080 WeakPolarHBondContact CA-OE1 3.03Å; K1078-E1080 PolarHBondContact N-OE1 3.14Å
1081	N	34.5	Very low	30.7	Very low	114 Å²	114	137.5 Å²	137.5	61%	0.61	71%	0.705	S	S	*	*			cis	-149.5	-168.1	9	-129.7	44.4	0	0	0	109	F1083	N1081-F1083 PolarHBondContact ND2-O 2.82Å; N1081-F1083 VanDerWaalsContact ND2-O 3.12Å
1082	N	33.9	Very low	30.3	Very low	139 Å²	139	144.2 Å²	144.2	74%	0.743	71%	0.709	S	S	*	*	S	Bend	cis	-139	168.3	25.2	-109.7	-18.9	0	0	0	111.5
1083	F	28.9	Very low	30	Very low	161 Å²	161	142.7 Å²	142.7	71%	0.706	70%	0.702	S	S	*	*			cis	-119.7	-107.7	-1.2	-178	-117.3	0	0	0	111.4	N1081	N1081-F1083 PolarHBondContact ND2-O 2.82Å; N1081-F1083 VanDerWaalsContact ND2-O 3.12Å
1084	M	28.2	Very low	30	Very low	123 Å²	123	144.4 Å²	144.4	61%	0.606	70%	0.697	S	S	*	*			trans	-156.2	143.8	-172.6	-66.9	-62.9	-73.8	0	0	107.8
1085	F	27.7	Very low	29.5	Very low	181 Å²	181	142.8 Å²	142.8	79%	0.794	69%	0.687	S	S	*	*			cis	-148.3	-162	-9.2	-161.5	-115.3	0	0	0	110.1
1086	Q	26.4	Very low	29.1	Very low	148 Å²	148	138.8 Å²	138.8	69%	0.692	67%	0.674	S	S	*	*			trans	-142	161.6	-167	-164.8	176.2	14.4	0	0	112.8
1087	E	24.7	Very low	29	Very low	171 Å²	171	135.2 Å²	135.2	80%	0.799	67%	0.666	S	S	*	*			trans	-65.9	158.4	165.7	-58.7	-176.6	101.5	0	0	113.7
1088	Q	27.3	Very low	28.9	Very low	163 Å²	163	140.9 Å²	140.9	76%	0.762	68%	0.682	S	S	*	*			trans	176	122.8	130.5	-93.9	159.6	50.5	0	0	107.6
1089	S	25	Very low	28.6	Very low	88 Å²	88	144.5 Å²	144.5	62%	0.615	69%	0.692	S	S	*	*			cis	104.9	150	34.8	81	0	0	0	0	112.7
1090	Q	27.7	Very low	28.3	Very low	166 Å²	166	146.4 Å²	146.4	78%	0.776	71%	0.705	S	S	*	*			trans	77.6	143.1	171.5	-47.3	-155.1	19.5	0	0	117.9
1091	L	24.5	Very low	28.1	Very low	127 Å²	127	144.2 Å²	144.2	67%	0.665	71%	0.71	S	S	*	*			cis	-159.8	145.6	-11.9	-140.9	72.8	0	0	0	113.1
1092	R	23	Very low	27.9	Very low	210 Å²	210	146.3 Å²	146.3	79%	0.792	72%	0.719	S	S	*	*			trans	46.3	139.3	143.3	-77	174.3	-160.8	-148.4	4.5	125.6
1093	N	26.6	Very low	28.1	Very low	150 Å²	150	144.9 Å²	144.9	80%	0.802	72%	0.718	S	S	*	*			trans	81.9	150.5	143.9	-60.3	-0.9	0	0	0	122.7
1094	I	29	Very low	28.2	Very low	129 Å²	129	145.3 Å²	145.3	66%	0.662	72%	0.722	S	S	*	*			trans	-149.2	145.2	-171.2	-63.9	-178.6	0	0	0	113.1	Q1064	Q1064-I1094 HydrophobicContact CG-CG2 4.37Å
1095	P	31.3	Very low	28.2	Very low	82 Å²	82	147 Å²	147	53%	0.532	73%	0.726	S	S	.	*			trans	-105.3	-158.7	179.6	41.8	-37.5	0	0	0	116.7	E1063	E1063-P1095 PolarHBondContact N-O 3.46Å
1096	L	26.2	Very low	28.5	Very low	109 Å²	109	144.3 Å²	144.3	57%	0.571	72%	0.72	S	S	*	*			trans	-136.4	178.6	-164.6	-127.9	155.9	0	0	0	115.5	K1061 E1063	K1061-L1096 WeakPolarHBondContact O-CD2 3.35Å; E1063-L1096 CarbonylContact O-C 3.49Å
1097	H	28.5	Very low	28.4	Very low	137 Å²	137	145 Å²	145	63%	0.634	73%	0.727	S	S	*	*			trans	-56.8	174.8	-173.9	-81.8	-21.9	0	0	0	117.9	R1062 E1063	R1062-H1097 PolarHBondContact O-CE1 2.85Å; R1062-H1097 PolarHBondContact O-ND1 3.25Å; E1063-H1097 WeakPolarHBondContact O-CA 3.4Å; E1063-H1097 PolarHBondContact O-N 3.33Å; E1063-H1097 VanDerWaalsContact O-N 3.14Å; E1063-H1097 PolarHBondContact O-ND1 3.36Å; E1063-H1097 VanDerWaalsContact O-ND1 3.13Å
1098	Q	31.2	Very low	28.5	Very low	180 Å²	180	142.2 Å²	142.2	84%	0.841	73%	0.726	S	S	*	*			cis	-162.9	-149.8	46	-147.2	173.4	11.7	0	0	117.4
1099	R	27.3	Very low	28.6	Very low	221 Å²	221	141.9 Å²	141.9	83%	0.834	73%	0.725	S	S	*	*			trans	-110.4	162.4	-142.9	-81.8	178.3	168.5	176.1	-4.4	120
1100	I	29.1	Very low	28.7	Very low	174 Å²	174	146.8 Å²	146.8	89%	0.892	73%	0.732	S	S	*	*				-164.8	158.7	128.8	-104.1	164.1	0	0	0	107.6
1101	G	29.3	Very low	28.7	Very low	56 Å²	56	144.2 Å²	144.2	58%	0.577	73%	0.727	S	S	*	*			cis	-162.1	173.4	-4.9	0	0	0	0	0	109
1102	I	29.6	Very low	28.7	Very low	158 Å²	158	146.8 Å²	146.8	81%	0.81	74%	0.736	S	S	*	*			cis	97.4	126.6	16.6	-65.8	169	0	0	0	113.7
1103	P	38.1	Very low	28.8	Very low	109 Å²	109	145.8 Å²	145.8	71%	0.708	74%	0.74	S	S	*	*			cis	-148.3	-163.4	-18.2	42.2	-20.4	0	0	0	117.5
1104	Q	31.3	Very low	28.9	Very low	170 Å²	170	143.6 Å²	143.6	79%	0.794	73%	0.734	S	S	*	*			trans	98.5	142.3	165.8	-60.9	-157.8	1.4	0	0	117.7
1105	K	29.3	Very low	28.9	Very low	157 Å²	157	146.3 Å²	146.3	68%	0.683	74%	0.743	S	S	*	*			cis	-163.1	166.2	-19.1	-116.1	-175.3	159.3	-118.4	0	107.5
1106	D	32.8	Very low	28.7	Very low	126 Å²	126	147.9 Å²	147.9	67%	0.674	76%	0.757	S	S	*	*			cis	-142.6	-159.5	12.4	-139.5	-21.1	0	0	0	112.6
1107	L	25.3	Very low	28.6	Very low	162 Å²	162	149 Å²	149	85%	0.848	77%	0.768	S	S	*	*			trans	-142.5	119	-163.4	-176.6	67.4	0	0	0	116.3
1108	S	26.7	Very low	28.7	Very low	112 Å²	112	146.6 Å²	146.6	78%	0.783	77%	0.765	S	S	*	*			trans	-166	157.1	159.3	63.9	0	0	0	0	109.9
1109	Q	29.6	Very low	28.3	Very low	157 Å²	157	149.8 Å²	149.8	73%	0.734	77%	0.769	S	S	*	*			cis	-156.7	134.8	4.5	-144.3	175.3	18.6	0	0	104.7
1110	Y	26.3	Very low	28.2	Very low	191 Å²	191	145.2 Å²	145.2	75%	0.749	76%	0.757	S	S	*	*				-151	140.5	54.7	-101.7	-114.8	0	0	0	108.8
1111	T	27.9	Very low	27.9	Very low	111 Å²	111	144.3 Å²	144.3	68%	0.681	75%	0.753	S	S	*	*				69.2	143	76.8	-10.2	0	0	0	0	116.5
1112	Q	24.3	Very low	27.7	Very low	181 Å²	181	147.6 Å²	147.6	85%	0.846	75%	0.752	S	S	*	*			trans	-76.3	145.4	-175.4	-57.9	142.2	-66.5	0	0	112.7
1113	E	25.7	Very low	27.3	Very low	190 Å²	190	141.7 Å²	141.7	89%	0.888	72%	0.723	S	S	*	*				-161.2	159.6	128.1	-108.8	-179.9	-175.4	0	0	109.4
1114	P	29.2	Very low	26.7	Very low	103 Å²	103	141.8 Å²	141.8	67%	0.669	72%	0.717	S	S	*	*			trans	-87.7	151.8	-175.6	35.3	-33.5	0	0	0	112.3
1115	H	27.3	Very low	26.5	Very low	186 Å²	186	140.7 Å²	140.7	86%	0.861	72%	0.717	S	S	*	*			trans	-177.3	158	140.4	-93.7	-57.8	0	0	0	111.9
1116	S	27.7	Very low	26.3	Very low	116 Å²	116	142.9 Å²	142.9	81%	0.811	73%	0.726	S	S	*	*			trans	55.1	75	165.8	50.7	0	0	0	0	119.8
1117	T	24.3	Very low	25.9	Very low	133 Å²	133	144.6 Å²	144.6	82%	0.816	74%	0.735	S	S	*	*			trans	-62.4	-175.7	132.1	46.3	0	0	0	0	112.5
1118	P	29.9	Very low	26	Very low	86 Å²	86	141 Å²	141	56%	0.558	72%	0.723	S	S	*	*			cis	-108.2	-171.3	-33.8	41	-28.4	0	0	0	109.7	E1120	P1118-E1120 HydrophobicContact CG-CB 4.45Å
1119	R	23.1	Very low	26.1	Very low	246 Å²	246	143.9 Å²	143.9	93%	0.928	72%	0.724	S	S	*	*			cis	86.4	23.9	0.4	-141.5	-141.5	165.4	-172.4	-5.7	121.5
1120	E	26.2	Very low	26	Very low	125 Å²	125	146.6 Å²	146.6	58%	0.584	73%	0.734	S	S	*	*			trans	-129.2	145	171.9	-88.8	142.7	-160.1	0	0	110.9	P1118 F1122	P1118-E1120 HydrophobicContact CG-CB 4.45Å; E1120-F1122 HydrophobicContact CB-CD2 3.93Å; E1120-F1122 HydrophobicContact CG-CD2 3.78Å; E1120-F1122 HydrophobicContact CG-CE2 3.99Å; E1120-F1122 WeakPolarHBondContact OE2-CD2 3.28Å; E1120-F1122 WeakPolarHBondContact OE2-CE2 3.43Å
1121	L	22.5	Very low	26	Very low	155 Å²	155	142.3 Å²	142.3	81%	0.812	73%	0.727	S	S	*	*			cis	64.1	61.3	15.1	-143.8	-175.2	0	0	0	114.6
1122	F	24.5	Very low	26	Very low	126 Å²	126	144.5 Å²	144.5	55%	0.553	74%	0.735	S	S	*	*			trans	-131	114.7	160.9	-106.2	-66.7	0	0	0	112.7	R86 E1120	R86-F1122 VanDerWaalsContact CZ-O 3.27Å; R86-F1122 PolarHBondContact NE-O 3.37Å; R86-F1122 PolarHBondContact NH2-O 3.23Å; E1120-F1122 HydrophobicContact CB-CD2 3.93Å; E1120-F1122 HydrophobicContact CG-CD2 3.78Å; E1120-F1122 HydrophobicContact CG-CE2 3.99Å; E1120-F1122 WeakPolarHBondContact OE2-CD2 3.28Å; E1120-F1122 WeakPolarHBondContact OE2-CE2 3.43Å
1123	T	22.4	Very low	26.2	Very low	34 Å²	34	139.5 Å²	139.5	21%	0.209	73%	0.733	C	S	.	*			trans	-103.7	122.8	131.9	-27.9	0	0	0	0	107.3	R86 S87	R86-T1123 WeakPolarHBondContact CA-OG1 3.45Å; R86-T1123 HydrophobicContact CB-CG2 3.67Å; R86-T1123 HydrophobicContact CG-CG2 3.84Å; R86-T1123 WeakPolarHBondContact CG-OG1 3.31Å; S87-T1123 PolarHBondContact N-OG1 3.12Å; S87-T1123 WeakPolarHBondContact O-CB 3.43Å; S87-T1123 PolarHBondContact O-OG1 3.41Å
1124	L	25.3	Very low	26.3	Very low	111 Å²	111	139.5 Å²	139.5	58%	0.581	73%	0.732	S	S	*	*				-165.6	138.7	128	-116.3	165.7	0	0	0	109.4	V88	V88-L1124 HydrophobicContact CG1-CD2 4.21Å; V88-L1124 HydrophobicContact CG2-CD1 4.09Å; V88-L1124 HydrophobicContact CG2-CD2 4.39Å; V88-L1124 HydrophobicContact CG2-CG 3.93Å
1125	N	25.3	Very low	26.2	Very low	146 Å²	146	141.6 Å²	141.6	78%	0.781	74%	0.737	S	S	*	*			trans	-68.9	132.2	164	-76.2	-22.3	0	0	0	109
1126	K	26	Very low	26.1	Very low	203 Å²	203	139.2 Å²	139.2	88%	0.883	73%	0.73	S	S	*	*			trans	-148.8	128.3	130.5	-117.7	175.4	-177.4	-177	0	110.2
1127	L	25	Very low	26	Very low	163 Å²	163	140.4 Å²	140.4	85%	0.853	73%	0.728	S	S	*	*			trans	-65.2	141.7	164	-120	69.8	0	0	0	108.9
1128	S	26.2	Very low	26	Very low	87 Å²	87	140.4 Å²	140.4	61%	0.608	72%	0.72	S	S	*	*			trans	-10.5	140.8	150	54.2	0	0	0	0	117.4
1129	Q	28.9	Very low	25.8	Very low	171 Å²	171	144.1 Å²	144.1	80%	0.799	73%	0.73	S	S	*	*				-167.6	129	89.7	-97.1	172	-4	0	0	111.9
1130	F	27.2	Very low	25.8	Very low	215 Å²	215	138.5 Å²	138.5	94%	0.943	72%	0.718	S	S	*	*			trans	-96.3	155.6	143.9	-102.1	-86.2	0	0	0	107.2
1131	T	26.1	Very low	25.7	Very low	100 Å²	100	139.8 Å²	139.8	61%	0.613	72%	0.724	S	S	*	*			trans	-117.3	154.5	-168.3	55.4	0	0	0	0	113.6
1132	N	28.5	Very low	26	Very low	157 Å²	157	139.6 Å²	139.6	84%	0.84	72%	0.724	S	S	*	*			trans	100.9	129.1	159.4	-51.2	-27.1	0	0	0	117.6
1133	G	28.4	Very low	26	Very low	77 Å²	77	144.3 Å²	144.3	79%	0.794	74%	0.74	S	S	*	*			trans	82.3	121.8	-178.6	0	0	0	0	0	112.8
1134	E	28	Very low	26.5	Very low	189 Å²	189	147.4 Å²	147.4	88%	0.883	76%	0.761	S	S	*	*			cis	-137	143.8	-6.6	-74.8	171	127.6	0	0	105.7
1135	L	26.9	Very low	26.7	Very low	148 Å²	148	149.2 Å²	149.2	78%	0.775	77%	0.765	S	S	*	*				85.1	95.2	52	-162.9	85.6	0	0	0	113.8
1136	L	25.4	Very low	26.9	Very low	136 Å²	136	149.1 Å²	149.1	71%	0.712	76%	0.76	S	S	*	*			trans	64.6	163.8	167.8	-59.7	166.4	0	0	0	115.4
1137	D	25.4	Very low	26.9	Very low	141 Å²	141	148.6 Å²	148.6	75%	0.754	75%	0.754	S	S	*	*			cis	-110.2	173.8	-2.4	-62.4	-69.9	0	0	0	110
1138	M	24.1	Very low	27	Very low	132 Å²	132	150.9 Å²	150.9	65%	0.65	76%	0.757	S	S	*	*			cis	74.5	132.6	26.4	-66	-106.3	-58.3	0	0	116.4
1139	E	26.7	Very low	27	Very low	165 Å²	165	153.5 Å²	153.5	77%	0.771	76%	0.764	S	S	*	*			trans	54.9	139.3	165.1	-73.8	142.5	-153.6	0	0	118.5
1140	N	23.6	Very low	26.9	Very low	128 Å²	128	150.5 Å²	150.5	68%	0.684	76%	0.761	S	S	*	*				79.2	134.7	53	-137	50.4	0	0	0	113.6
1141	E	24.3	Very low	26.9	Very low	152 Å²	152	148.8 Å²	148.8	71%	0.71	75%	0.753	S	S	*	*			trans	54.1	97.9	168.4	-66.7	169.6	-133.4	0	0	119.1
1142	N	27.7	Very low	27	Very low	151 Å²	151	153.5 Å²	153.5	81%	0.807	77%	0.765	S	S	*	*				171.8	121.8	100.5	-91.7	-71.3	0	0	0	113.3
1143	Y	25.6	Very low	27	Very low	224 Å²	224	154.4 Å²	154.4	88%	0.878	76%	0.764	S	S	*	*			trans	-80.9	165.6	149.1	-93.1	-92.8	0	0	0	108.1
1144	P	32	Very low	27	Very low	100 Å²	100	156.7 Å²	156.7	65%	0.649	76%	0.757	S	S	*	*			cis	-137.8	172.1	27.3	37.2	-16.7	0	0	0	116.9
1145	H	29.3	Very low	27	Very low	148 Å²	148	156.3 Å²	156.3	69%	0.685	75%	0.753	S	S	*	*				176	142.6	113.5	-98.4	-79.2	0	0	0	113.8
1146	H	29.4	Very low	27.1	Very low	144 Å²	144	156.7 Å²	156.7	67%	0.667	75%	0.75	S	S	*	*			trans	60.8	82.3	156.4	-62.3	-55.7	0	0	0	122.6
1147	Y	25.8	Very low	27.3	Very low	193 Å²	193	156 Å²	156	76%	0.757	75%	0.746	S	S	*	*				44.7	124	114.3	-79.6	-91.6	0	0	0	120.3	L1149	Y1147-L1149 HydrophobicContact CD1-CD1 4.1Å; Y1147-L1149 HydrophobicContact CD1-CG 4.46Å; Y1147-L1149 HydrophobicContact CE1-CD1 3.76Å
1148	K	26.8	Very low	27.5	Very low	211 Å²	211	157 Å²	157	92%	0.917	75%	0.75	S	S	*	*				-149.4	137.4	101.9	-141.5	168.4	-173.1	173.6	0	114.1
1149	L	26.7	Very low	28	Very low	142 Å²	142	155.5 Å²	155.5	74%	0.743	75%	0.75	S	S	*	*			trans	-87.1	163.3	179.4	-84	154.5	0	0	0	112.8	Y1147	Y1147-L1149 HydrophobicContact CD1-CD1 4.1Å; Y1147-L1149 HydrophobicContact CD1-CG 4.46Å; Y1147-L1149 HydrophobicContact CE1-CD1 3.76Å
1150	S	26.2	Very low	27.9	Very low	107 Å²	107	152.1 Å²	152.1	75%	0.748	75%	0.745	S	S	*	*			trans	-84.3	131.1	161.1	59	0	0	0	0	112.1
1151	K	28.8	Very low	28.3	Very low	180 Å²	180	153.9 Å²	153.9	78%	0.783	75%	0.754	S	S	*	*			trans	-165.7	164.2	148.5	-112	170.4	-175.6	179.5	0	110.6
1152	K	27.8	Very low	28.7	Very low	198 Å²	198	152.6 Å²	152.6	86%	0.861	76%	0.757	S	S	*	*			trans	-92.1	156.1	177.7	-57.5	170.6	-179.9	172.8	0	110.4
1153	E	28.8	Very low	28.5	Very low	176 Å²	176	152.7 Å²	152.7	82%	0.822	76%	0.757	S	S	*	*				-168.3	142.7	129.9	-94.3	-165	162.2	0	0	106.6
1154	I	28	Very low	28.4	Very low	126 Å²	126	150.2 Å²	150.2	65%	0.646	76%	0.756	S	S	*	*			cis	103.7	133.9	37.8	-76.9	-179.5	0	0	0	112
1155	K	27.2	Very low	28.2	Very low	180 Å²	180	150.5 Å²	150.5	78%	0.783	76%	0.756	S	S	*	*			trans	69.4	157.5	174.2	-72.2	159.3	-174	173.2	0	118
1156	H	30.2	Very low	27.9	Very low	157 Å²	157	151 Å²	151	73%	0.727	76%	0.76	S	S	*	*			cis	176.2	167.5	-45.4	-99	1.9	0	0	0	109.1
1157	I	29.5	Very low	27.6	Very low	120 Å²	120	151.2 Å²	151.2	62%	0.615	76%	0.763	S	S	*	*			cis	-177.8	151.8	-37.5	-165.4	170	0	0	0	106.8
1158	L	28.6	Very low	27.7	Very low	163 Å²	163	150.2 Å²	150.2	85%	0.853	76%	0.763	S	S	*	*			trans	-168	163.1	151.7	-116.2	94	0	0	0	109.3
1159	P	34.7	Very low	28	Very low	100 Å²	100	145.9 Å²	145.9	65%	0.649	76%	0.756	S	S	*	*			trans	-140.7	-163.1	-143.5	37.2	-12.5	0	0	0	115.2
1160	S	24.8	Very low	27.9	Very low	94 Å²	94	143.4 Å²	143.4	66%	0.657	75%	0.747	S	S	*	*			trans	49.6	121.8	145.8	64.5	0	0	0	0	120.7
1161	L	33.1	Very low	28.1	Very low	165 Å²	165	144.5 Å²	144.5	86%	0.864	75%	0.75	S	S	*	*				-159.8	179.5	112	-130.3	73.4	0	0	0	113.4
1162	T	30.9	Very low	28.2	Very low	126 Å²	126	141.3 Å²	141.3	77%	0.773	75%	0.745	S	S	*	*			trans	-86.1	166.6	-164.8	43.5	0	0	0	0	116.2
1163	N	25.2	Very low	28.3	Very low	153 Å²	153	137.8 Å²	137.8	82%	0.818	74%	0.741	S	S	*	*			trans	-68.9	168.2	170.2	-72	-34.9	0	0	0	114.2
1164	M	23.1	Very low	28.4	Very low	172 Å²	172	135.8 Å²	135.8	85%	0.847	74%	0.74	S	S	*	*			trans	74.8	143.7	167.5	-56.4	-178.1	87.6	0	0	114.7
1165	T	26.3	Very low	28.2	Very low	106 Å²	106	134.8 Å²	134.8	65%	0.65	74%	0.744	S	S	*	*			cis	-155.7	147.9	10.8	-13.5	0	0	0	0	113.7
1166	M	23.6	Very low	28.4	Very low	157 Å²	157	132.7 Å²	132.7	77%	0.773	75%	0.746	S	S	*	*			trans	56	137.8	140	-90.8	178.3	172.5	0	0	125.4
1167	M	24.1	Very low	28.2	Very low	150 Å²	150	131.2 Å²	131.2	74%	0.739	75%	0.748	S	S	*	*			trans	82.4	113.3	139.1	-73.4	-176.3	-175.9	0	0	122.9
1168	K	26.7	Very low	28.2	Very low	171 Å²	171	130.3 Å²	130.3	74%	0.743	75%	0.75	S	S	*	*				44.8	134.2	116.9	-74.2	177.8	168.4	-175.6	0	119.5	T1170	K1168-T1170 HydrophobicContact CB-CG2 4.11Å; K1168-T1170 HydrophobicContact CD-CG2 3.71Å; K1168-T1170 HydrophobicContact CG-CG2 3.99Å
1169	P	33.2	Very low	28.3	Very low	120 Å²	120	128.2 Å²	128.2	78%	0.779	74%	0.744	S	S	*	*				-110.9	154.3	71.9	-6.1	26.4	0	0	0	112.7
1170	T	25.2	Very low	28.1	Very low	91 Å²	91	128.9 Å²	128.9	56%	0.558	75%	0.746	S	S	*	*			cis	77.5	147.2	29.8	67.5	0	0	0	0	116.7	K1168	K1168-T1170 HydrophobicContact CB-CG2 4.11Å; K1168-T1170 HydrophobicContact CD-CG2 3.71Å; K1168-T1170 HydrophobicContact CG-CG2 3.99Å
1171	T	30.7	Very low	28.1	Very low	130 Å²	130	129 Å²	129	80%	0.798	75%	0.747	S	S	*	*			trans	80.3	138.4	-169.3	81.3	0	0	0	0	113.9
1172	T	30.4	Very low	27.9	Very low	113 Å²	113	126.6 Å²	126.6	69%	0.693	74%	0.739	S	S	*	*			cis	-155	154.4	-6.7	-0.4	0	0	0	0	111.6
1173	T	29.4	Very low	27.9	Very low	124 Å²	124	125.5 Å²	125.5	76%	0.761	73%	0.733	S	S	*	*			trans	14.5	146.5	148	56.4	0	0	0	0	120.8
1174	V	30.8	Very low	28.3	Very low	134 Å²	134	125.8 Å²	125.8	81%	0.812	73%	0.734	S	S	*	*			cis	-147.1	149.4	49.7	170.3	0	0	0	0	112.9
1175	S	23.4	Very low	28.6	Very low	105 Å²	105	124 Å²	124	73%	0.734	73%	0.728	S	S	*	*			trans	-96.3	143.1	175.2	53	0	0	0	0	113.8
1176	V	32.1	Very low	28.8	Very low	136 Å²	136	124.5 Å²	124.5	82%	0.824	73%	0.725	S	S	*	*			trans	-141.9	100.8	149.5	-176.2	0	0	0	0	110.6
1177	T	25.5	Very low	29.1	Very low	126 Å²	126	125.9 Å²	125.9	77%	0.773	73%	0.732	S	S	*	*			trans	-77.9	147.2	143.1	51.5	0	0	0	0	107.2
1178	P	30.6	Very low	29.2	Very low	101 Å²	101	121.2 Å²	121.2	66%	0.656	72%	0.715	S	S	*	*				-160.5	176.5	82.3	44.3	-24.4	0	0	0	117.7
1179	V	30.5	Very low	29.2	Very low	119 Å²	119	117.9 Å²	117.9	72%	0.721	71%	0.705	S	S	*	*			trans	60.8	129.1	133.6	160	0	0	0	0	121.2
1180	T	30.8	Very low	29.1	Very low	114 Å²	114	117.4 Å²	117.4	70%	0.699	70%	0.699	S	S	*	*			trans	61.6	124.3	162.1	54.8	0	0	0	0	116.5
1181	S	23.8	Very low	29.3	Very low	97 Å²	97	120.7 Å²	120.7	68%	0.678	70%	0.702	S	S	*	*				55.1	130.5	58.9	84.2	0	0	0	0	111.9
1182	T	29.8	Very low	29	Very low	113 Å²	113	122.5 Å²	122.5	69%	0.693	70%	0.695	S	S	*	*			cis	-160.7	170.2	43.9	35.7	0	0	0	0	110.8
1183	T	30.5	Very low	28.8	Very low	103 Å²	103	123.8 Å²	123.8	63%	0.632	69%	0.693	S	S	*	*			trans	46	122.1	149.2	52.1	0	0	0	0	119
1184	N	32.9	Very low	28.6	Very low	159 Å²	159	125.2 Å²	125.2	85%	0.85	69%	0.691	S	S	*	*	S	Bend	cis	-126.4	87.6	43.8	-75.2	-24.1	0	0	0	113.7
1185	N	30.6	Very low	28.4	Very low	135 Å²	135	124.8 Å²	124.8	72%	0.722	69%	0.689	S	S	*	*	S	Bend		-89.2	160.5	124.4	-164.9	1.4	0	0	0	107.1
1186	I	30.4	Very low	28.5	Very low	116 Å²	116	128.9 Å²	128.9	60%	0.595	69%	0.693	S	S	*	*			trans	56.7	94.6	172.7	-3.4	177.5	0	0	0	116.1	S1188	I1186-S1188 WeakPolarHBondContact O-CB 3.45Å; I1186-S1188 PolarHBondContact O-OG 2.87Å
1187	M	29.7	Very low	28.2	Very low	186 Å²	186	129.2 Å²	129.2	92%	0.916	69%	0.689	S	S	*	*				-100	99.4	128.1	-118	-175.7	166.7	0	0	107.2
1188	S	25.7	Very low	28.3	Very low	53 Å²	53	133.5 Å²	133.5	37%	0.371	69%	0.693	S	S	.	*			cis	64.5	154.5	31.7	97.3	0	0	0	0	111.4	I1186	I1186-S1188 WeakPolarHBondContact O-CB 3.45Å; I1186-S1188 PolarHBondContact O-OG 2.87Å
1189	N	28.2	Very low	28.1	Very low	101 Å²	101	136.9 Å²	136.9	54%	0.54	70%	0.7	S	S	.	*			cis	-163.9	131.8	32.4	-138.7	-2.8	0	0	0	109
1190	V	31.1	Very low	28.6	Very low	109 Å²	109	135.9 Å²	135.9	66%	0.661	70%	0.696	S	S	*	*				64.5	-178.8	115.4	93.7	0	0	0	0	116.3
1191	R	27.6	Very low	28.7	Very low	161 Å²	161	138.4 Å²	138.4	61%	0.608	70%	0.699	S	S	*	*			cis	-149.4	153.1	10.1	-121.6	158.9	-170.7	145	5.9	112.4
1192	Y	26	Very low	29.1	Very low	168 Å²	168	139.8 Å²	139.8	66%	0.659	70%	0.703	S	S	*	*			trans	66	154.2	135.2	-71.4	-28.6	0	0	0	124.1
1193	H	26.2	Very low	29.1	Very low	139 Å²	139	140.3 Å²	140.3	64%	0.644	71%	0.706	S	S	*	*			trans	76.5	122.8	146.9	-68.9	-43.3	0	0	0	119.1
1194	H	25.1	Very low	29.2	Very low	154 Å²	154	142 Å²	142	71%	0.713	72%	0.716	S	S	*	*	S	Bend	trans	32.9	109	139.6	-51.2	-67.7	0	0	0	117.9
1195	T	25.3	Very low	29.2	Very low	126 Å²	126	139.9 Å²	139.9	77%	0.773	71%	0.711	S	S	*	*	S	Bend	trans	50.2	98.3	139	56.6	0	0	0	0	117.2
1196	K	27.1	Very low	29.5	Very low	190 Å²	190	138.9 Å²	138.9	83%	0.826	71%	0.712	S	S	*	*			trans	82	125.9	158.9	-54.9	178.7	177.2	179.3	0	117.9
1197	L	25.8	Very low	29.5	Very low	143 Å²	143	138.8 Å²	138.8	75%	0.749	72%	0.721	S	S	*	*			trans	79.2	142	135.3	-70	165.7	0	0	0	121.4
1198	Y	26.7	Very low	29.3	Very low	216 Å²	216	136.9 Å²	136.9	85%	0.847	72%	0.72	S	S	*	*			trans	94.4	128.3	159.8	-74.8	-70.7	0	0	0	122
1199	H	27.2	Very low	29.6	Very low	172 Å²	172	138.1 Å²	138.1	80%	0.796	73%	0.734	S	S	*	*			trans	-77.7	175	175.2	-111.9	-23.9	0	0	0	111
1200	P	40.8	Very low	29.7	Very low	98 Å²	98	140.7 Å²	140.7	64%	0.636	75%	0.747	S	S	*	*			cis	-153.7	163.7	44.7	42.1	-20.5	0	0	0	121
1201	H	31.7	Very low	30	Very low	168 Å²	168	140.8 Å²	140.8	78%	0.778	75%	0.749	S	S	*	*			trans	59.3	136.6	149	-62.5	-33.9	0	0	0	120.9
1202	V	32.2	Very low	30	Very low	126 Å²	126	138.9 Å²	138.9	76%	0.764	76%	0.761	S	S	*	*			cis	-168	168.7	-12.3	104.3	0	0	0	0	109.4
1203	V	31.3	Very low	30.1	Very low	123 Å²	123	136.4 Å²	136.4	75%	0.745	77%	0.768	S	S	*	*				-154.5	140.9	-77.4	73.3	0	0	0	0	108.7
1204	V	31	Very low	30.2	Very low	140 Å²	140	135.3 Å²	135.3	85%	0.848	78%	0.776	S	S	*	*			trans	-167.2	140.3	162.8	121.8	0	0	0	0	111.5
1205	P	34.5	Very low	30.5	Very low	114 Å²	114	133.5 Å²	133.5	74%	0.74	78%	0.781	S	S	*	*			trans	-126.7	176.1	170.8	40.5	-28.2	0	0	0	114.8
1206	P	37	Very low	30.9	Very low	114 Å²	114	133.4 Å²	133.4	74%	0.74	78%	0.782	S	S	*	*			trans	-130.8	170.1	-162.3	42.3	-27	0	0	0	118.6
1207	S	28.4	Very low	30.8	Very low	113 Å²	113	129.8 Å²	129.8	79%	0.79	78%	0.781	S	S	*	*			trans	63	141.9	142.8	58.6	0	0	0	0	123.9
1208	T	27.1	Very low	30.9	Very low	147 Å²	147	129.7 Å²	129.7	90%	0.902	78%	0.781	S	S	*	*			trans	-143.1	158.6	166.1	49.9	0	0	0	0	111.9
1209	A	31.2	Very low	31	Very low	79 Å²	79	129.2 Å²	129.2	65%	0.653	78%	0.778	S	S	*	*			trans	-155.3	119	173.7	0	0	0	0	0	108.9
1210	L	30.7	Very low	31.2	Very low	155 Å²	155	128.5 Å²	128.5	81%	0.812	78%	0.779	S	S	*	*				78.1	154.1	90.8	-74	166.6	0	0	0	114.4
1211	P	37.8	Very low	30.7	Very low	110 Å²	110	130 Å²	130	71%	0.714	78%	0.78	S	S	*	*			cis	-137.3	164.4	-18.1	37.8	-21	0	0	0	115.6
1212	S	26.1	Very low	30.5	Very low	121 Å²	121	128.9 Å²	128.9	85%	0.846	78%	0.778	S	S	*	*				-165.5	132	121.9	53.3	0	0	0	0	110.8
1213	S	29.5	Very low	31	Very low	116 Å²	116	127.7 Å²	127.7	81%	0.811	77%	0.773	S	S	*	*			trans	-168.5	130.5	175.3	58.9	0	0	0	0	111
1214	S	27.8	Very low	30.8	Very low	116 Å²	116	127.8 Å²	127.8	81%	0.811	77%	0.769	S	S	*	*			trans	-73.5	153.7	160.9	47.2	0	0	0	0	110.9
1215	S	31.1	Very low	30.8	Very low	116 Å²	116	127.8 Å²	127.8	81%	0.811	76%	0.76	S	S	*	*			trans	-60.2	154.8	-174	-36.3	0	0	0	0	113.3
1216	P	33.3	Very low	30.4	Very low	124 Å²	124	130.6 Å²	130.6	81%	0.805	76%	0.76	S	S	*	*				-145.7	178.8	77.8	38.1	-19.9	0	0	0	116
1217	S	25.6	Very low	30	Very low	115 Å²	115	134.2 Å²	134.2	80%	0.804	77%	0.768	S	S	*	*			trans	-83	146.9	-172.6	43.7	0	0	0	0	115.5
1218	N	28.4	Very low	30	Very low	140 Å²	140	138.9 Å²	138.9	75%	0.749	77%	0.768	S	S	*	*			trans	-117	177.8	162.5	-87.1	-50.3	0	0	0	108
1219	W	28.6	Very low	30	Very low	207 Å²	207	137.5 Å²	137.5	78%	0.784	76%	0.755	S	S	*	*			cis	-164.2	154.5	40	-78.6	74.2	0	0	0	111.3
1220	I	31.4	Very low	29.8	Very low	157 Å²	157	140.3 Å²	140.3	81%	0.805	76%	0.759	S	S	*	*				176.7	146.1	100.1	-106.8	123.8	0	0	0	113.5
1221	I	29.4	Very low	29.6	Very low	129 Å²	129	140.5 Å²	140.5	66%	0.662	76%	0.756	S	S	*	*			trans	-74.9	173.4	-176.4	53	-179.2	0	0	0	113.2
1222	I	29	Very low	29	Very low	145 Å²	145	142.6 Å²	142.6	74%	0.744	75%	0.753	S	S	*	*				-166.9	-168.3	50.9	8	170.1	0	0	0	109.4
1223	P	41.2	Very low	29.1	Very low	100 Å²	100	143.1 Å²	143.1	65%	0.649	74%	0.743	S	S	*	*			cis	-138.1	166.2	-9.6	24.1	0.9	0	0	0	119.2
1224	N	27.2	Very low	28.9	Very low	125 Å²	125	144.2 Å²	144.2	67%	0.668	74%	0.739	S	S	*	*			trans	75.2	118.8	146	-67.6	-8.2	0	0	0	121.2
1225	Q	31.7	Very low	28.9	Very low	140 Å²	140	143.9 Å²	143.9	65%	0.654	74%	0.736	S	S	*	*				89.4	140.7	57.8	-79.2	-171.9	73.8	0	0	112.4
1226	K	26.3	Very low	28.8	Very low	173 Å²	173	145.7 Å²	145.7	75%	0.752	73%	0.731	S	S	*	*			cis	-169.3	148.9	0.8	-129.1	176.7	-166.2	153.3	0	110.6
1227	Q	29.3	Very low	28.8	Very low	191 Å²	191	148.3 Å²	148.3	89%	0.893	73%	0.732	S	S	*	*			trans	158.2	165.1	142.9	-93.5	-178.4	-4.4	0	0	110.9
1228	R	28.2	Very low	29.1	Very low	211 Å²	211	146.7 Å²	146.7	80%	0.796	73%	0.734	S	S	*	*				-163.4	153.4	-63.8	-148.6	-178.1	-173	-166.8	7.1	108.7
1229	D	27	Very low	29.2	Very low	118 Å²	118	142.7 Å²	142.7	63%	0.631	73%	0.726	S	S	*	*			trans	64.3	165.4	160.9	-65.9	-45.4	0	0	0	117.2
1230	N	25.5	Very low	29.3	Very low	137 Å²	137	139.9 Å²	139.9	73%	0.733	73%	0.726	S	S	*	*			cis	-169.1	172.1	-49.6	-125.5	-52.1	0	0	0	108.1
1231	Q	26.9	Very low	29.2	Very low	159 Å²	159	141.1 Å²	141.1	74%	0.743	73%	0.728	S	S	*	*			trans	75.3	112.2	162.4	-65.9	-167.9	15.7	0	0	122.8
1232	K	26	Very low	29.1	Very low	154 Å²	154	138.5 Å²	138.5	67%	0.67	72%	0.722	S	S	*	*				79.6	118.7	112.4	-70.1	178.8	160.5	-120.9	0	124.5
1233	Q	27.8	Very low	29.1	Very low	133 Å²	133	134.7 Å²	134.7	62%	0.621	71%	0.708	S	S	*	*				76.4	113.7	118.7	-63.5	-178.2	-80.9	0	0	122.8
1234	N	25	Very low	28.5	Very low	139 Å²	139	132.1 Å²	132.1	74%	0.743	69%	0.692	S	S	*	*				52.9	132.6	121	-53.2	15.4	0	0	0	121.4
1235	C	28.2	Very low	28.3	Very low	109 Å²	109	131.1 Å²	131.1	74%	0.736	69%	0.694	S	S	*	*				-164.5	123.5	108.9	-109	0	0	0	0	115.8
1236	H	29.4	Very low	28.1	Very low	154 Å²	154	131.9 Å²	131.9	71%	0.713	70%	0.701	S	S	*	*			trans	79	126.6	138	-71.5	-15.4	0	0	0	125.6
1237	H	32.9	Very low	28.3	Very low	179 Å²	179	128.3 Å²	128.3	83%	0.829	70%	0.697	S	S	*	*			trans	81.3	122.4	146.8	-59.5	-43.4	0	0	0	120.5
1238	G	31.7	Very low	28.5	Very low	81 Å²	81	126 Å²	126	84%	0.835	69%	0.686	S	S	*	*			trans	-174	-65	176.9	0	0	0	0	0	113.6
1239	G	31.5	Very low	28.7	Very low	56 Å²	56	119 Å²	119	58%	0.577	67%	0.665	S	S	*	*			trans	83.8	149.3	-180	0	0	0	0	0	115
1240	D	30	Very low	29	Very low	148 Å²	148	117 Å²	117	79%	0.791	65%	0.654	S	S	*	*			cis	-159.1	163.8	-10.2	-65.3	-61.1	0	0	0	106.4
1241	E	28.8	Very low	29.3	Very low	182 Å²	182	116.3 Å²	116.3	85%	0.85	65%	0.65	S	S	*	*			cis	80.9	131.3	24.4	-59.1	179.2	-117.7	0	0	113.8
1242	S	28.5	Very low	29.5	Very low	75 Å²	75	116.3 Å²	116.3	52%	0.524	65%	0.65	S	S	.	*			cis	-175.5	167.3	5.7	50	0	0	0	0	111	E643	E643-S1242 PolarHBondContact N-O 3.18Å
1243	S	29	Very low	29.8	Very low	64 Å²	64	113.6 Å²	113.6	45%	0.448	65%	0.651	S	S	.	*			cis	-175.1	64.7	-18.6	60.8	0	0	0	0	118.8	D641	D641-S1243 VanDerWaalsContact CG-C 3.48Å; D641-S1243 PolarHBondContact O-N 2.93Å; D641-S1243 WeakPolarHBondContact OD2-CA 3.35Å
1244	S	26.7	Very low	30	Very low	47 Å²	47	115.2 Å²	115.2	33%	0.329	66%	0.659	S	S	.	*			trans	-162.7	123.9	158.9	76	0	0	0	0	123.7	D641 D642	D641-S1244 VanDerWaalsContact OD1-CA 3.28Å; D641-S1244 WeakPolarHBondContact OD1-CA 3.47Å; D641-S1244 WeakPolarHBondContact OD2-CA 3.48Å; D641-S1244 PolarHBondContact OD2-N 3.39Å; D642-S1244 VanDerWaalsContact C-N 3.27Å; D642-S1244 PolarHBondContact N-O 3.13Å; D642-S1244 WeakPolarHBondContact O-CB 3.45Å; D642-S1244 PolarHBondContact O-N 3.11Å; D642-S1244 PolarHBondContact O-OG 2.89Å
1245	C	23.8	Very low	30.3	Very low	103 Å²	103	114 Å²	114	70%	0.696	66%	0.657	S	S	*	*				70.8	150.9	124.6	-61.9	0	0	0	0	127.9	D641	D641-C1245 PolarHBondContact OD1-N 3.13Å
1246	I	27.9	Very low	30.4	Very low	157 Å²	157	115.9 Å²	115.9	81%	0.805	67%	0.665	S	S	*	*			trans	103.7	95.5	149.8	-47.6	-165.9	0	0	0	123
1247	S	29.5	Very low	30.4	Very low	97 Å²	97	113.4 Å²	113.4	68%	0.678	67%	0.665	S	S	*	*			trans	45.8	133.6	138.3	77.7	0	0	0	0	128.8
1248	Q	34.2	Very low	30.4	Very low	142 Å²	142	111.9 Å²	111.9	66%	0.664	66%	0.663	S	S	*	*			trans	85.7	129.3	140.7	-83.1	-162.7	-98.6	0	0	124.7	S635 S636	S635-Q1248 CarbonylContact C-O 3.08Å; S635-Q1248 WeakPolarHBondContact CA-O 3.37Å; S636-Q1248 PolarHBondContact N-O 3.06Å
1249	N	32.5	Very low	30.3	Very low	66 Å²	66	111.2 Å²	111.2	35%	0.353	66%	0.656	S	S	.	*			trans	94.6	155.6	146.6	-86.6	59.2	0	0	0	126.5	S635 S636	S635-N1249 CarbonylContact C-O 3.6Å; S635-N1249 VanDerWaalsContact CB-O 3.31Å; S635-N1249 WeakPolarHBondContact CB-O 3.2Å; S636-N1249 VanDerWaalsContact CA-O 3.28Å; S636-N1249 WeakPolarHBondContact CA-O 3.2Å; S636-N1249 WeakPolarHBondContact CB-O 3.13Å; S636-N1249 PolarHBondContact N-O 2.92Å; S636-N1249 PolarHBondContact OG-O 2.77Å
1250	D	33.2	Very low	30.2	Very low	75 Å²	75	116.2 Å²	116.2	40%	0.401	67%	0.669	S	S	.	*			trans	23.2	114.1	150.7	-34	-36	0	0	0	124.6	S635	S635-D1250 WeakPolarHBondContact CB-O 3.09Å; S635-D1250 PolarHBondContact OG-O 2.99Å
1251	N	32.6	Very low	30.1	Very low	122 Å²	122	116.2 Å²	116.2	65%	0.652	67%	0.669	S	S	*	*				64.1	152.2	119.7	-64.9	24.9	0	0	0	122.7
1252	E	31.3	Very low	30.3	Very low	159 Å²	159	115.4 Å²	115.4	74%	0.743	67%	0.67	S	S	*	*			cis	-165.8	166.1	-4.9	-116.2	164.6	158.8	0	0	112.8
1253	S	31.6	Very low	30.2	Very low	98 Å²	98	122.5 Å²	122.5	69%	0.685	69%	0.685	S	S	*	*			trans	16	150.6	146.7	73.9	0	0	0	0	122.7
1254	E	30.8	Very low	30.2	Very low	167 Å²	167	127 Å²	127	78%	0.78	70%	0.699	S	S	*	*			cis	-173.9	169.2	5.9	-125.8	-179.3	179.2	0	0	115
1255	T	31.7	Very low	30.3	Very low	114 Å²	114	132.3 Å²	132.3	70%	0.699	72%	0.719	S	S	*	*			trans	62.9	137.5	151.2	58.9	0	0	0	0	124.1
1256	T	29.8	Very low	30.4	Very low	147 Å²	147	134 Å²	134	90%	0.902	72%	0.721	S	S	*	*				-172.2	163.1	120.3	17.2	0	0	0	0	111.1
1257	S	31.4	Very low	30.5	Very low	103 Å²	103	131.1 Å²	131.1	72%	0.72	72%	0.715	S	S	*	*			trans	-145.2	-171.4	-178.6	69.6	0	0	0	0	110.5
1258	D	31.5	Very low	30.5	Very low	147 Å²	147	135 Å²	135	79%	0.786	72%	0.72	S	S	*	*			cis	-156.9	-176	17.4	-142.4	-74.4	0	0	0	112.4
1259	G	29.5	Very low	30.4	Very low	67 Å²	67	137 Å²	137	69%	0.691	73%	0.726	S	S	*	*			trans	167.6	137.1	169.8	0	0	0	0	0	115.5
1260	N	30.4	Very low	30.2	Very low	160 Å²	160	140.5 Å²	140.5	86%	0.856	74%	0.738	S	S	*	*			trans	-136.3	169.8	-168.7	-140.1	-19	0	0	0	114.2
1261	D	27.5	Very low	29.9	Very low	148 Å²	148	145.5 Å²	145.5	79%	0.791	75%	0.753	S	S	*	*			trans	83.6	165.7	159.3	-140.4	-8	0	0	0	121.9
1262	L	32.6	Very low	29.7	Very low	165 Å²	165	148.6 Å²	148.6	86%	0.864	76%	0.761	S	S	*	*			trans	88.6	150.8	174.6	-66.6	173	0	0	0	120.9
1263	R	27.6	Very low	29.7	Very low	224 Å²	224	147.6 Å²	147.6	85%	0.845	76%	0.759	S	S	*	*			trans	-114.1	143	-160.8	-73.3	177.4	169.9	179.4	-2	115
1264	Q	28.6	Very low	29.5	Very low	158 Å²	158	150 Å²	150	74%	0.738	76%	0.763	S	S	*	*			trans	54.9	116.4	141.2	-66.7	-175.8	-5.9	0	0	122.4
1265	Q	28.4	Very low	29.6	Very low	160 Å²	160	146.4 Å²	146.4	75%	0.748	75%	0.754	S	S	*	*				68.9	155.5	129.7	-66	-169.1	14.7	0	0	119.3
1266	N	26.4	Very low	29.4	Very low	137 Å²	137	151.9 Å²	151.9	73%	0.733	76%	0.762	S	S	*	*			cis	-165	153.4	-4.1	-123.4	-28.3	0	0	0	110.4
1267	S	30.3	Very low	29.1	Very low	98 Å²	98	148 Å²	148	69%	0.685	75%	0.751	S	S	*	*			trans	-158.9	118.4	152.5	75.1	0	0	0	0	118.4
1268	K	29.3	Very low	28.8	Very low	178 Å²	178	150.6 Å²	150.6	77%	0.774	76%	0.755	S	S	*	*			trans	58.7	145.7	144.9	-58.8	160.6	-171.3	162.8	0	118.9
1269	F	30.4	Very low	28.6	Very low	183 Å²	183	149.9 Å²	149.9	80%	0.803	75%	0.751	S	S	*	*			cis	-121.7	137.3	13.8	-78.4	-113.3	0	0	0	111.4
1270	K	28.6	Very low	28.7	Very low	140 Å²	140	154.1 Å²	154.1	61%	0.609	75%	0.753	S	S	*	*				72.5	129.8	69.2	-106.1	179.5	166.2	-163.3	0	113.9
1271	Y	28	Very low	28.4	Very low	181 Å²	181	151.9 Å²	151.9	71%	0.71	75%	0.75	S	S	*	*			cis	-149.6	143.4	19.9	-79.1	-94.5	0	0	0	114.3
1272	K	27	Very low	28.7	Very low	186 Å²	186	153.4 Å²	153.4	81%	0.809	76%	0.755	S	S	*	*				171.3	138.2	110	-102.7	-175	175.2	178.3	0	113.2
1273	I	33.1	Very low	28.3	Very low	138 Å²	138	152.2 Å²	152.2	71%	0.708	75%	0.749	S	S	*	*			trans	58.2	97	156.6	-54.1	168.9	0	0	0	115.4
1274	L	27.4	Very low	28.7	Very low	148 Å²	148	146.6 Å²	146.6	78%	0.775	74%	0.742	S	S	*	*				71.8	145.2	69.3	-66.7	166.4	0	0	0	114.8
1275	P	31.2	Very low	28.5	Very low	92 Å²	92	147.1 Å²	147.1	60%	0.597	75%	0.747	S	S	*	*			cis	-142.3	-175.2	-28.4	41.4	-23.5	0	0	0	114.7
1276	R	27.5	Very low	28.4	Very low	230 Å²	230	148 Å²	148	87%	0.868	75%	0.748	S	S	*	*			trans	29.9	142.9	141.6	-62.2	160.9	-172.8	160.7	-1.9	120.4
1277	G	24.4	Very low	28.3	Very low	64 Å²	64	146.9 Å²	146.9	66%	0.66	75%	0.746	S	S	*	*			cis	102.8	143	9.8	0	0	0	0	0	113.4
1278	I	24.6	Very low	28.4	Very low	159 Å²	159	148.7 Å²	148.7	82%	0.815	75%	0.746	S	S	*	*			trans	74.7	106.1	-177.1	-49.8	166.7	0	0	0	113.7
1279	D	27.9	Very low	28.5	Very low	131 Å²	131	150.8 Å²	150.8	70%	0.701	75%	0.749	S	S	*	*				-158.8	162.8	107.9	-119.4	-26.5	0	0	0	114.8
1280	Q	31.4	Very low	28.7	Very low	156 Å²	156	149.9 Å²	149.9	73%	0.729	75%	0.745	S	S	*	*			trans	-26.9	140.2	178.8	-61.2	145.4	61.5	0	0	117
1281	S	24.7	Very low	28.4	Very low	114 Å²	114	148.3 Å²	148.3	80%	0.797	75%	0.752	S	S	*	*			cis	66.1	81.7	41.8	-173.3	0	0	0	0	114.8
1282	M	32.7	Very low	28.2	Very low	179 Å²	179	143.9 Å²	143.9	88%	0.882	75%	0.753	S	S	*	*			trans	-159.9	145	149.1	-121.4	178.3	146.3	0	0	113.7
1283	D	25.3	Very low	28.6	Very low	140 Å²	140	144.3 Å²	144.3	75%	0.749	76%	0.755	S	S	*	*			trans	-25.3	169.3	164.4	-77.6	-58.4	0	0	0	121.6
1284	P	35.2	Very low	28.1	Very low	107 Å²	107	148.3 Å²	148.3	70%	0.695	76%	0.761	S	S	*	*			cis	-137	167.8	-13.5	30.7	-10.6	0	0	0	116.2	K1286	P1284-K1286 PolarHBondContact O-N 2.58Å
1285	M	25	Very low	27.9	Very low	169 Å²	169	147.7 Å²	147.7	83%	0.833	76%	0.756	S	S	*	*			trans	-47.8	120.7	146.8	171.4	-151	-62.6	0	0	112.2
1286	K	25.5	Very low	27.6	Very low	179 Å²	179	150.2 Å²	150.2	78%	0.778	76%	0.757	S	S	*	*			trans	-179.5	125.9	136.7	-104.6	163.5	-176.1	172.6	0	116.7	P1284	P1284-K1286 PolarHBondContact O-N 2.58Å
1287	T	25.5	Very low	27.6	Very low	113 Å²	113	148.4 Å²	148.4	69%	0.693	75%	0.752	S	S	*	*			trans	71.4	158.6	140.6	-43	0	0	0	0	118.2
1288	I	31.5	Very low	27.8	Very low	135 Å²	135	154.5 Å²	154.5	69%	0.692	76%	0.756	S	S	*	*			trans	73.1	102.8	176.2	-48	-177.8	0	0	0	111.8
1289	R	31.8	Very low	28	Very low	222 Å²	222	150.9 Å²	150.9	84%	0.838	74%	0.736	S	S	*	*			cis	-135.8	143.2	13.2	-91	142.9	-174.8	166.7	2.5	108.7
1290	K	33.8	Very low	28.1	Very low	165 Å²	165	146.7 Å²	146.7	72%	0.717	72%	0.717	S	S	*	*				61.1	114.2	60.6	-59.6	-169.9	175.6	-165.1	0	110.9
1291	S	24.2	Very low	28.1	Very low	106 Å²	106	144.1 Å²	144.1	74%	0.741	71%	0.708	S	S	*	*				55.9	134.9	58.8	87.7	0	0	0	0	114.4
1292	A	23.8	Very low	28.3	Very low	89 Å²	89	144.2 Å²	144.2	74%	0.736	71%	0.709	S	S	*	*			trans	64.4	152.8	171.8	0	0	0	0	0	119.6
1293	K	33.7	Very low	28.1	Very low	194 Å²	194	140.3 Å²	140.3	84%	0.843	71%	0.705	S	S	*	*			trans	77.6	109.3	170.7	-50.7	176	-175.1	-173.6	0	114.6
1294	R	23.5	Very low	28.3	Very low	223 Å²	223	140.3 Å²	140.3	84%	0.842	71%	0.705	S	S	*	*			cis	47.9	93.8	20.4	-140.6	-176.3	-168.6	-165.2	4.9	113.8
1295	M	23.3	Very low	27.9	Very low	134 Å²	134	141.9 Å²	141.9	66%	0.66	71%	0.706	S	S	*	*			trans	71.6	121.7	143.4	-144.8	-163.2	-57.4	0	0	118.3
1296	K	24.2	Very low	28.1	Very low	146 Å²	146	139.6 Å²	139.6	64%	0.635	70%	0.697	S	S	*	*				173.9	163.2	97	-92	-168.7	177.1	-174.4	0	112.5
1297	Y	28.3	Very low	28.1	Very low	191 Å²	191	137.8 Å²	137.8	75%	0.749	69%	0.692	S	S	*	*	S	Bend	trans	72.3	114.4	171.3	-47.9	-64.6	0	0	0	115.2
1298	Y	28.3	Very low	28.1	Very low	193 Å²	193	139.2 Å²	139.2	76%	0.757	70%	0.695	S	S	*	*	S	Bend	cis	-109.6	141.8	11	-99	-115.6	0	0	0	114.4
1299	E	29.1	Very low	27.9	Very low	82 Å²	82	137.3 Å²	137.3	38%	0.383	69%	0.694	S	S	.	*			trans	38.2	141.3	141.5	-56.7	-173.8	132.4	0	0	121.4	Y1411 N1413	E1299-Y1411 HydrophobicContact CB-CD1 4.09Å; E1299-Y1411 HydrophobicContact CB-CE1 3.78Å; E1299-Y1411 WeakPolarHBondContact O-CE1 3.34Å; E1299-N1413 WeakPolarHBondContact CG-ND2 3.28Å; E1299-N1413 PolarHBondContact OE1-ND2 2.68Å
1300	S	30.1	Very low	27.7	Very low	44 Å²	44	134.4 Å²	134.4	31%	0.308	69%	0.693	S	S	.	*			cis	-176.9	154.2	-6.9	49.4	0	0	0	0	112.3	N1413	S1300-N1413 WeakPolarHBondContact CB-OD1 3.41Å
1301	D	30.6	Very low	27.4	Very low	102 Å²	102	130.5 Å²	130.5	55%	0.545	69%	0.687	S	S	.	*			trans	61.1	140.1	159.6	-70.5	12	0	0	0	121	N1413 E1414	D1301-N1413 WeakPolarHBondContact OD2-CA 3.37Å; D1301-N1413 PolarHBondContact OD2-N 3.03Å; D1301-E1414 PolarHBondContact OD1-N 2.99Å
1302	S	29	Very low	27.4	Very low	115 Å²	115	135.3 Å²	135.3	80%	0.804	69%	0.689	S	S	*	*			cis	-153.7	171	-13.2	67.2	0	0	0	0	111
1303	A	28.9	Very low	27.6	Very low	98 Å²	98	137.8 Å²	137.8	81%	0.81	69%	0.685	S	S	*	*			trans	-106.2	-169.1	-176.7	0	0	0	0	0	113.8
1304	N	29.7	Very low	27.2	Very low	140 Å²	140	135.2 Å²	135.2	75%	0.749	68%	0.68	S	S	*	*			trans	-65.8	158.5	178.2	-80.4	-25.2	0	0	0	114.5
1305	I	27.1	Very low	27.7	Very low	139 Å²	139	131.1 Å²	131.1	71%	0.713	67%	0.674	S	S	*	*				18.9	124.6	115.6	-33.7	168.3	0	0	0	113.4
1306	D	27.7	Very low	28.3	Very low	122 Å²	122	130.6 Å²	130.6	65%	0.652	67%	0.674	S	S	*	*			cis	-163.4	-177.2	34	-147.1	-6	0	0	0	115.4
1307	Q	26.8	Very low	28.5	Very low	140 Å²	140	129.2 Å²	129.2	65%	0.654	67%	0.673	S	S	*	*			trans	77.3	132.2	139.3	-90.6	162.1	57.8	0	0	124.1
1308	D	25.7	Very low	28.5	Very low	144 Å²	144	126.6 Å²	126.6	77%	0.77	67%	0.672	S	S	*	*				46	148	122.5	-72.4	9.5	0	0	0	122.4
1309	S	26.1	Very low	28.7	Very low	95 Å²	95	124 Å²	124	66%	0.664	68%	0.676	S	S	*	*			cis	-161.6	177	-9	54.5	0	0	0	0	109.2
1310	I	28.3	Very low	28.8	Very low	160 Å²	160	123.5 Å²	123.5	82%	0.821	69%	0.686	S	S	*	*			trans	149.2	131.4	158.1	-83.9	160.6	0	0	0	108
1311	S	27.3	Very low	28.6	Very low	84 Å²	84	133.5 Å²	133.5	59%	0.587	72%	0.717	S	S	*	*			cis	-157.8	152.5	-15.3	-110.2	0	0	0	0	110.3
1312	R	25.2	Very low	28.3	Very low	206 Å²	206	137.5 Å²	137.5	78%	0.777	73%	0.73	S	S	*	*			trans	53.6	127.2	137.9	-67.7	-170.5	-172.1	-174.4	2.3	121
1313	E	26.2	Very low	28.1	Very low	142 Å²	142	139.1 Å²	139.1	66%	0.664	73%	0.729	S	S	*	*				95	119.6	122.5	-79.6	177.7	123.3	0	0	120.6
1314	L	26.1	Very low	28	Very low	139 Å²	139	140 Å²	140	73%	0.728	73%	0.729	S	S	*	*				88.5	154.8	128.2	-75.6	170.6	0	0	0	120
1315	L	33.6	Very low	28.1	Very low	137 Å²	137	139.2 Å²	139.2	72%	0.717	74%	0.735	S	S	*	*			trans	63.5	80.5	155.4	-69.1	158.4	0	0	0	117
1316	N	37.2	Very low	28.6	Very low	124 Å²	124	137.6 Å²	137.6	66%	0.663	73%	0.734	S	S	*	*				91.4	96.6	122.7	-74.9	-22.3	0	0	0	119.7
1317	N	28.1	Very low	28.6	Very low	117 Å²	117	137.4 Å²	137.4	63%	0.626	74%	0.737	S	S	*	*				58.6	111.9	100.1	-80.3	-55.7	0	0	0	118.5
1318	N	27.4	Very low	28.8	Very low	136 Å²	136	135.7 Å²	135.7	73%	0.727	74%	0.736	S	S	*	*			trans	73.7	170.1	138.5	-53.6	-36.3	0	0	0	114.7
1319	V	31.9	Very low	29.2	Very low	138 Å²	138	136.8 Å²	136.8	84%	0.836	74%	0.736	S	S	*	*			cis	-146.3	164.9	19.4	-129.4	0	0	0	0	108.4
1320	A	32	Very low	29.6	Very low	72 Å²	72	137 Å²	137	60%	0.595	74%	0.738	S	S	*	*			cis	-158.6	173.4	3.4	0	0	0	0	0	110.3
1321	R	25.8	Very low	29.6	Very low	253 Å²	253	135.4 Å²	135.4	96%	0.955	73%	0.731	S	S	*	*	S	Bend		-154.2	81.5	118.7	-116.8	176.5	-169.5	-168.6	3.7	115
1322	K	24.7	Very low	29.4	Very low	186 Å²	186	138.7 Å²	138.7	81%	0.809	74%	0.74	S	S	*	*	S	Bend	trans	-156.4	151.4	138.2	-111.5	169.2	-174.7	177.2	0	110.1
1323	N	24.6	Very low	29.5	Very low	150 Å²	150	135 Å²	135	80%	0.802	74%	0.74	S	S	*	*	S	Bend	trans	63.6	65.9	163.4	-55.6	3.7	0	0	0	118.3
1324	S	27.6	Very low	29.5	Very low	115 Å²	115	132.7 Å²	132.7	80%	0.804	74%	0.74	S	S	*	*				-168.1	98.1	126.4	24.5	0	0	0	0	110.8
1325	S	31.8	Very low	29.4	Very low	125 Å²	125	132 Å²	132	87%	0.874	74%	0.741	S	S	*	*			trans	-77.7	137.5	159.4	-53.8	0	0	0	0	108.6
1326	P	36.3	Very low	29	Very low	105 Å²	105	130.6 Å²	130.6	68%	0.682	74%	0.739	S	S	*	*			trans	-121.9	135.2	136	35.7	-29.9	0	0	0	110.8
1327	T	26.9	Very low	28.4	Very low	117 Å²	117	131.2 Å²	131.2	72%	0.718	74%	0.742	S	S	*	*			trans	38.1	130	135.8	63.1	0	0	0	0	119.3
1328	T	31.3	Very low	28.6	Very low	105 Å²	105	132.8 Å²	132.8	64%	0.644	75%	0.749	S	S	*	*			cis	-173.2	153.5	15.8	1.8	0	0	0	0	111.4
1329	H	35.5	Very low	28.7	Very low	166 Å²	166	132.2 Å²	132.2	77%	0.769	75%	0.746	S	S	*	*			trans	59.7	138.3	165.8	-54.5	-63.3	0	0	0	117
1330	S	34.3	Very low	28.7	Very low	100 Å²	100	131.5 Å²	131.5	70%	0.699	74%	0.738	S	S	*	*			cis	-141.1	132.9	-3.5	48.5	0	0	0	0	108.1
1331	L	27.7	Very low	28.6	Very low	127 Å²	127	134.1 Å²	134.1	67%	0.665	74%	0.742	S	S	*	*				47.7	104.5	83.4	-71	156.3	0	0	0	110.4
1332	I	23	Very low	28.9	Very low	153 Å²	153	129.5 Å²	129.5	79%	0.785	73%	0.734	S	S	*	*				48.3	102.9	69	-51	174.8	0	0	0	111.5
1333	T	26.4	Very low	28.9	Very low	128 Å²	128	126.3 Å²	126.3	79%	0.785	73%	0.734	S	S	*	*			trans	-166.8	161.4	145.9	3	0	0	0	0	110.8
1334	S	27.8	Very low	28.8	Very low	94 Å²	94	128.3 Å²	128.3	66%	0.657	74%	0.735	S	S	*	*			trans	46.5	102.6	161.1	53.2	0	0	0	0	118.4
1335	T	23.2	Very low	29.3	Very low	123 Å²	123	127.5 Å²	127.5	76%	0.755	73%	0.727	S	S	*	*				73.5	159.3	60.9	72.6	0	0	0	0	115.7
1336	T	26.2	Very low	29.1	Very low	108 Å²	108	128 Å²	128	66%	0.663	72%	0.719	S	S	*	*			trans	67	113.9	162.4	47.2	0	0	0	0	118.8
1337	N	24.2	Very low	28.7	Very low	137 Å²	137	130.6 Å²	130.6	73%	0.733	72%	0.72	S	S	*	*			trans	62.9	125.5	134.1	-49.4	-15.5	0	0	0	119
1338	I	32.7	Very low	28.7	Very low	150 Å²	150	132.1 Å²	132.1	77%	0.769	72%	0.719	S	S	*	*				-167.8	117.2	91.4	-92.6	164.5	0	0	0	110.2
1339	N	29.2	Very low	28.4	Very low	125 Å²	125	133.3 Å²	133.3	67%	0.668	72%	0.721	S	S	*	*			trans	45.3	128.2	137.1	-56.4	-6.5	0	0	0	122.9
1340	N	31.6	Very low	27.9	Very low	123 Å²	123	132.5 Å²	132.5	66%	0.658	72%	0.722	S	S	*	*				84.3	103.6	122.4	-67.4	1.7	0	0	0	122.7
1341	N	30.4	Very low	27.5	Very low	127 Å²	127	134.9 Å²	134.9	68%	0.679	72%	0.721	S	S	*	*				86.1	154.4	106.2	-64.4	-12.2	0	0	0	122.6
1342	I	30.9	Very low	27.3	Very low	156 Å²	156	135.2 Å²	135.2	80%	0.8	72%	0.723	S	S	*	*			trans	74.1	128	152.6	-72.3	150.2	0	0	0	116.5
1343	C	26.2	Very low	27.4	Very low	119 Å²	119	135.4 Å²	135.4	80%	0.804	72%	0.718	S	S	*	*			cis	-161.2	167.5	-19	-125	0	0	0	0	113.4
1344	K	22.5	Very low	27.4	Very low	191 Å²	191	136.9 Å²	136.9	83%	0.83	72%	0.717	S	S	*	*			trans	-67.4	179.9	158.8	-90.9	-175	177.2	179.8	0	111.6
1345	P	38.1	Very low	27.3	Very low	98 Å²	98	137.3 Å²	137.3	64%	0.636	72%	0.719	S	S	*	*			cis	-147.4	-160.3	-40.7	40.3	-19.8	0	0	0	114.2
1346	I	26.1	Very low	27.4	Very low	136 Å²	136	136.4 Å²	136.4	70%	0.697	72%	0.718	S	S	*	*			trans	97.8	145.5	134.9	-92.6	177.6	0	0	0	123.4
1347	F	28.5	Very low	27.5	Very low	160 Å²	160	136 Å²	136	70%	0.702	72%	0.72	S	S	*	*			trans	65.9	103.4	163.7	-73.2	-43.5	0	0	0	124.5
1348	E	26.6	Very low	27.6	Very low	149 Å²	149	136.3 Å²	136.3	70%	0.696	72%	0.721	S	S	*	*				54.4	120.4	113.8	-76.1	-178.6	-149	0	0	124.5
1349	N	25.5	Very low	27.3	Very low	130 Å²	130	135.3 Å²	135.3	70%	0.695	72%	0.717	S	S	*	*				73	136.1	124.7	-68.6	-29.1	0	0	0	123.7
1350	L	24.6	Very low	27.2	Very low	148 Å²	148	138.3 Å²	138.3	78%	0.775	72%	0.724	S	S	*	*			trans	90.4	130.4	149	-70.4	155.5	0	0	0	121.9
1351	H	26.3	Very low	27.1	Very low	150 Å²	150	137.9 Å²	137.9	69%	0.694	72%	0.718	S	S	*	*			trans	63.4	98.3	155.4	-72.2	-67.8	0	0	0	123.5
1352	L	24.3	Very low	26.8	Very low	134 Å²	134	137.1 Å²	137.1	70%	0.702	72%	0.721	S	S	*	*				80.2	140.4	115.3	-73.8	178.7	0	0	0	123.8
1353	F	25	Very low	26.6	Very low	157 Å²	157	134.8 Å²	134.8	69%	0.689	71%	0.71	S	S	*	*			trans	67.8	110.3	153.9	-79	-66.1	0	0	0	122.3
1354	E	25.6	Very low	26.7	Very low	160 Å²	160	133.9 Å²	133.9	75%	0.748	70%	0.704	S	S	*	*			trans	57.3	104.1	134.2	-79.5	173.2	-178.6	0	0	121.3
1355	S	26.2	Very low	27	Very low	102 Å²	102	133 Å²	133	71%	0.713	70%	0.7	S	S	*	*				43.8	120.2	129.5	63.7	0	0	0	0	118.5
1356	S	25.6	Very low	26.7	Very low	104 Å²	104	135.4 Å²	135.4	73%	0.727	71%	0.707	S	S	*	*				177.1	161.4	53.7	39.5	0	0	0	0	111.9
1357	S	26.8	Very low	26.8	Very low	101 Å²	101	133.1 Å²	133.1	71%	0.706	70%	0.703	S	S	*	*			trans	43	139.4	143.2	60.8	0	0	0	0	121.8
1358	D	26	Very low	26.9	Very low	142 Å²	142	130.2 Å²	130.2	76%	0.759	70%	0.703	S	S	*	*			cis	179.9	178.8	-14.1	-132.3	-48.4	0	0	0	110
1359	I	26.1	Very low	26.9	Very low	130 Å²	130	130.6 Å²	130.6	67%	0.667	71%	0.709	S	S	*	*			trans	55.2	119.3	151.9	-61.2	154.2	0	0	0	119.9
1360	F	28	Very low	27	Very low	187 Å²	187	130.4 Å²	130.4	82%	0.82	72%	0.719	S	S	*	*			trans	-150.7	133.3	133.6	-105.3	-94.4	0	0	0	107.7
1361	Q	29	Very low	27.1	Very low	115 Å²	115	131.4 Å²	131.4	54%	0.537	72%	0.717	S	S	.	*	S	Bend	cis	-157.3	145	-16.6	-131.5	-176.9	17	0	0	105.9
1362	C	24.1	Very low	27.1	Very low	110 Å²	110	132.2 Å²	132.2	74%	0.743	72%	0.715	S	S	*	*				-179.3	151	76	-101.6	0	0	0	0	109.2
1363	N	28.3	Very low	27.2	Very low	108 Å²	108	130.3 Å²	130.3	58%	0.578	70%	0.702	S	S	*	*			cis	-163	161.4	-20.3	-143.6	-37.4	0	0	0	109.2
1364	C	27.5	Very low	27.4	Very low	99 Å²	99	126.2 Å²	126.2	67%	0.669	68%	0.684	S	S	*	*			trans	66.6	143	171.7	-66.3	0	0	0	0	118.5
1365	K	28.9	Very low	27.7	Very low	172 Å²	172	121.6 Å²	121.6	75%	0.748	67%	0.668	S	S	*	*			cis	-169	140.1	-18.1	-120.7	179.9	179.6	178.4	0	109.8
1366	L	31.6	Very low	27.7	Very low	150 Å²	150	120.5 Å²	120.5	79%	0.785	66%	0.66	S	S	*	*			trans	63	163.8	150.8	-60.3	165.5	0	0	0	118.9
1367	S	29	Very low	27.8	Very low	88 Å²	88	119.8 Å²	119.8	62%	0.615	66%	0.655	S	S	*	*			cis	-171.3	136.9	-48	53.1	0	0	0	0	111.2
1368	S	30	Very low	27.8	Very low	99 Å²	99	125.4 Å²	125.4	69%	0.692	66%	0.663	S	S	*	*			trans	46.9	120.5	147.6	63.3	0	0	0	0	122.9
1369	N	26.2	Very low	27.8	Very low	156 Å²	156	123 Å²	123	83%	0.834	66%	0.657	S	S	*	*			trans	51.1	120.6	132.9	-59.1	-11.6	0	0	0	122.3
1370	S	28.1	Very low	28	Very low	127 Å²	127	121.6 Å²	121.6	89%	0.888	65%	0.654	S	S	*	*				-176.4	-175.3	114.5	46.7	0	0	0	0	112.4
1371	K	25.8	Very low	28	Very low	169 Å²	169	117.3 Å²	117.3	74%	0.735	64%	0.639	S	S	*	*			trans	-104.3	172.4	-167.8	-61.2	174.9	179.5	178.2	0	113.5
1372	Y	26.6	Very low	28	Very low	167 Å²	167	119.4 Å²	119.4	66%	0.655	65%	0.654	S	S	*	*			trans	98.9	-174.1	156.2	-57.8	-68.2	0	0	0	120.7
1373	H	26.7	Very low	28.2	Very low	94 Å²	94	116.8 Å²	116.8	44%	0.435	65%	0.645	S	S	.	*				-155.8	171.1	-129.9	-50.6	-36.4	0	0	0	115.3	S905 L906	S905-H1373 PolarHBondContact OG-CD2 2.87Å; S905-H1373 VanDerWaalsContact OG-CD2 3.22Å; S905-H1373 PolarHBondContact OG-NE2 3.31Å; L906-H1373 HydrophobicContact CB-CB 3.41Å; L906-H1373 VanDerWaalsContact CB-CB 3.41Å; L906-H1373 WeakPolarHBondContact CB-ND1 3.46Å; L906-H1373 VanDerWaalsContact N-CB 3.33Å; L906-H1373 PolarHBondContact N-ND1 2.62Å
1374	F	29.9	Very low	28.3	Very low	71 Å²	71	117.7 Å²	117.7	31%	0.311	66%	0.655	S	S	.	*			cis	-162.6	-165.2	-21.4	-151.7	25.3	0	0	0	107.1	S905 L906	S905-F1374 WeakPolarHBondContact O-CD2 3.04Å; S905-F1374 WeakPolarHBondContact O-CE2 3.28Å; S905-F1374 WeakPolarHBondContact O-CG 3.12Å; L906-F1374 VanDerWaalsContact CA-CD1 3.47Å; L906-F1374 HydrophobicContact CB-CB 3.63Å; L906-F1374 HydrophobicContact CB-CD1 3.31Å; L906-F1374 HydrophobicContact CB-CD2 4.46Å; L906-F1374 HydrophobicContact CB-CE1 4.09Å; L906-F1374 HydrophobicContact CB-CG 3.51Å; L906-F1374 HydrophobicContact CD1-CD1 3.75Å; L906-F1374 HydrophobicContact CG-CD1 3.47Å; L906-F1374 VanDerWaalsContact CG-CD1 3.47Å; L906-F1374 HydrophobicContact CG-CE1 4Å; L906-F1374 HydrophobicContact CG-CG 4.21Å
1375	P	30.2	Very low	28.3	Very low	62 Å²	62	120.1 Å²	120.1	40%	0.403	66%	0.66	S	S	.	*			cis	-137.8	-168.5	8.2	49.9	-30.4	0	0	0	118.7	R904	R904-P1375 HydrophobicContact CG-CB 4.26Å; R904-P1375 HydrophobicContact CG-CG 3.91Å
1376	S	27.8	Very low	28.3	Very low	80 Å²	80	114.5 Å²	114.5	56%	0.559	64%	0.643	S	S	*	*			trans	-108.4	-168.5	166.5	59.4	0	0	0	0	110.9
1377	S	27.6	Very low	28.2	Very low	89 Å²	89	112 Å²	112	62%	0.622	63%	0.63	S	S	*	*			cis	-158.9	-170	11.3	56.1	0	0	0	0	111.6
1378	Y	26.3	Very low	28.3	Very low	219 Å²	219	112 Å²	112	86%	0.859	63%	0.627	S	S	*	*			trans	68.3	155.7	-179.6	-70	-95.6	0	0	0	116.3
1379	S	26.7	Very low	28.4	Very low	91 Å²	91	114.6 Å²	114.6	64%	0.636	63%	0.625	S	S	*	*			cis	-177.3	172	-31.3	57.5	0	0	0	0	112.2
1380	V	29.3	Very low	28.8	Very low	101 Å²	101	111.4 Å²	111.4	61%	0.612	61%	0.612	S	S	*	*			trans	87.6	124.7	152.3	169	0	0	0	0	121.1
1381	I	28	Very low	29	Very low	96 Å²	96	113.2 Å²	113.2	49%	0.492	60%	0.599	S	S	.	*			trans	58.6	138.7	157.7	-61.3	160.9	0	0	0	117.3	D39	D39-I1381 HydrophobicContact CB-CD1 3.87Å; D39-I1381 HydrophobicContact CB-CG1 4.09Å; D39-I1381 VanDerWaalsContact OD2-CD1 3.32Å; D39-I1381 WeakPolarHBondContact OD2-CD1 3.31Å
1382	D	28.8	Very low	29.4	Very low	160 Å²	160	109.7 Å²	109.7	86%	0.856	59%	0.588	S	S	*	*			cis	-157.7	-176.2	27.5	-148.7	-21.6	0	0	0	113.7
1383	G	29	Very low	29.7	Very low	55 Å²	55	105.3 Å²	105.3	57%	0.567	59%	0.594	S	S	*	*				110.3	43.2	126.5	0	0	0	0	0	125.5
1384	T	29.9	Very low	30	Very low	126 Å²	126	109.1 Å²	109.1	77%	0.773	62%	0.617	S	S	*	*			trans	33.4	140.1	140.2	55.3	0	0	0	0	126.8
1385	L	28.6	Very low	30.2	Very low	150 Å²	150	110.1 Å²	110.1	79%	0.785	64%	0.639	S	S	*	*			trans	70.3	154.3	143.6	-89.6	70.3	0	0	0	121.6
1386	S	27.4	Very low	30.2	Very low	54 Å²	54	111.3 Å²	111.3	38%	0.378	66%	0.662	S	S	.	*			cis	-177.9	131.4	-33.1	52.6	0	0	0	0	114.3
1387	D	29.4	Very low	30.3	Very low	97 Å²	97	111.4 Å²	111.4	52%	0.519	68%	0.676	S	S	.	*			trans	46.8	170.8	135.2	-60.3	22.1	0	0	0	125	F949	F949-D1387 PolarHBondContact N-O 2.92Å
1388	V	33	Very low	30.4	Very low	90 Å²	90	112.8 Å²	112.8	55%	0.545	69%	0.685	S	S	.	*			trans	132.3	94	133.4	179.2	0	0	0	0	118.5
1389	K	31.7	Very low	30.6	Very low	152 Å²	152	109.9 Å²	109.9	66%	0.661	68%	0.683	S	S	*	*			trans	67	152	130.7	-62.5	-173.4	-172	174.7	0	122.7	K940	K940-K1389 VanDerWaalsContact CE-O 3.28Å; K940-K1389 WeakPolarHBondContact CE-O 3.08Å; K940-K1389 PolarHBondContact NZ-O 2.84Å
1390	T	33.9	Very low	30.6	Very low	90 Å²	90	111.3 Å²	111.3	55%	0.552	69%	0.688	S	S	*	*			cis	-168.2	176.2	-10.3	26.1	0	0	0	0	111.2
1391	R	33.2	Very low	30.5	Very low	164 Å²	164	117.1 Å²	117.1	62%	0.619	70%	0.699	S	S	*	*			trans	97.2	143.3	155.3	-51.5	-161	82.8	157.5	-0.8	117
1392	D	33.1	Very low	30.5	Very low	96 Å²	96	120.3 Å²	120.3	51%	0.513	71%	0.709	S	S	.	*			cis	-153.1	163.3	-18.2	-106.2	8	0	0	0	109.2
1393	G	32.6	Very low	30.4	Very low	75 Å²	75	119.9 Å²	119.9	77%	0.773	71%	0.707	S	S	*	*			trans	155.8	117.1	169.7	0	0	0	0	0	117.4
1394	N	34.1	Very low	30.3	Very low	173 Å²	173	121.5 Å²	121.5	93%	0.925	72%	0.715	S	S	*	*			trans	-73	165.4	177.6	-82.9	-11.6	0	0	0	114.3
1395	A	33.1	Very low	30.1	Very low	93 Å²	93	120.3 Å²	120.3	77%	0.769	71%	0.712	S	S	*	*			cis	-170.1	159.7	-17.6	0	0	0	0	0	111.1
1396	G	30.5	Very low	29.8	Very low	86 Å²	86	124.2 Å²	124.2	89%	0.887	72%	0.716	S	S	*	*			trans	73.8	146.2	168.1	0	0	0	0	0	116.4
1397	G	30.7	Very low	29.7	Very low	83 Å²	83	127.1 Å²	127.1	86%	0.856	73%	0.727	S	S	*	*			cis	-149.6	174.5	-6.8	0	0	0	0	0	110.2
1398	S	29	Very low	29.5	Very low	117 Å²	117	128.6 Å²	128.6	82%	0.818	74%	0.735	S	S	*	*			trans	-115.3	144.5	-156.3	-174.3	0	0	0	0	116.7
1399	I	30.8	Very low	29	Very low	159 Å²	159	132.6 Å²	132.6	82%	0.815	75%	0.75	S	S	*	*			trans	-137.3	103.1	158.5	-64.1	-173.2	0	0	0	111.6
1400	V	27.3	Very low	28.7	Very low	120 Å²	120	130.3 Å²	130.3	73%	0.727	75%	0.754	S	S	*	*			trans	52.2	121.7	138.7	-171.5	0	0	0	0	121
1401	R	25.8	Very low	28.3	Very low	224 Å²	224	133 Å²	133	85%	0.845	75%	0.754	S	S	*	*				-175	131.9	117.8	-103.2	177.5	-179.3	169.4	3.6	117.3
1402	K	29.3	Very low	28.2	Very low	162 Å²	162	133.7 Å²	133.7	70%	0.704	76%	0.762	S	S	*	*			trans	75.9	123.7	143.1	-70.4	-174.7	174	-172	0	122.9
1403	N	25.5	Very low	28	Very low	151 Å²	151	131.2 Å²	131.2	81%	0.807	75%	0.749	S	S	*	*				60.3	139.6	127.9	-60.5	32.2	0	0	0	120.8
1404	A	26.6	Very low	27.8	Very low	90 Å²	90	132.5 Å²	132.5	74%	0.744	74%	0.735	S	S	*	*			cis	-170.7	169.9	-10.3	0	0	0	0	0	111.5
1405	S	25.8	Very low	27.8	Very low	101 Å²	101	132.9 Å²	132.9	71%	0.706	72%	0.724	S	S	*	*			trans	105.9	98.7	140.7	-159.3	0	0	0	0	121.6
1406	W	23.3	Very low	27.8	Very low	232 Å²	232	134.8 Å²	134.8	88%	0.879	72%	0.721	S	S	*	*			trans	83.1	130.2	140.2	-74.2	51.9	0	0	0	122.5
1407	N	25.3	Very low	27.6	Very low	114 Å²	114	135.2 Å²	135.2	61%	0.61	71%	0.709	S	S	*	*			trans	75.9	123.1	154.6	-78.6	58	0	0	0	124.3
1408	D	24.8	Very low	27.7	Very low	128 Å²	128	140.2 Å²	140.2	68%	0.684	70%	0.704	S	S	*	*			trans	70.8	104.2	142.1	-52.8	-33.5	0	0	0	123.1
1409	M	22.9	Very low	28.1	Very low	175 Å²	175	141.2 Å²	141.2	86%	0.862	70%	0.695	S	S	*	*			trans	57	120.5	136.8	-60.1	179.2	64.8	0	0	121.3
1410	S	24.6	Very low	28.2	Very low	104 Å²	104	139 Å²	139	73%	0.727	69%	0.685	S	S	*	*				163	119.3	114.5	-170.5	0	0	0	0	115.5
1411	Y	26.6	Very low	28.7	Very low	145 Å²	145	139.3 Å²	139.3	57%	0.569	68%	0.683	S	S	*	*			trans	40.8	126.3	145.3	-74.8	-95.1	0	0	0	124.8	E1299	E1299-Y1411 HydrophobicContact CB-CD1 4.09Å; E1299-Y1411 HydrophobicContact CB-CE1 3.78Å; E1299-Y1411 WeakPolarHBondContact O-CE1 3.34Å
1412	K	30.5	Very low	29.2	Very low	179 Å²	179	134.6 Å²	134.6	78%	0.778	67%	0.674	S	S	*	*				159.2	155	123.2	-88.4	175.9	178.7	-167.8	0	112.3
1413	N	28.3	Very low	29.5	Very low	44 Å²	44	133.7 Å²	133.7	24%	0.235	68%	0.677	C	S	.	*			cis	152.6	136.3	-29.4	-167.6	22.5	0	0	0	111.2	E1299 S1300 D1301	E1299-N1413 WeakPolarHBondContact CG-ND2 3.28Å; E1299-N1413 PolarHBondContact OE1-ND2 2.68Å; S1300-N1413 WeakPolarHBondContact CB-OD1 3.41Å; D1301-N1413 WeakPolarHBondContact OD2-CA 3.37Å; D1301-N1413 PolarHBondContact OD2-N 3.03Å
1414	E	29.4	Very low	30.1	Very low	102 Å²	102	131.3 Å²	131.3	48%	0.477	67%	0.668	S	S	.	*			trans	78.4	148.8	164.7	-41.6	-166.6	118	0	0	118.1	D1301	D1301-E1414 PolarHBondContact OD1-N 2.99Å
1415	Y	33.4	Very low	30.5	Very low	181 Å²	181	134.4 Å²	134.4	71%	0.71	67%	0.667	S	S	*	*			cis	-139.2	147.2	21.4	-78.3	-94.3	0	0	0	111.3
1416	L	34.1	Very low	31	Very low	134 Å²	134	136.7 Å²	136.7	70%	0.702	67%	0.666	S	S	*	*				53.8	138.8	77.8	-73.8	81.8	0	0	0	115.1
1417	C	26.1	Very low	31.4	Very low	94 Å²	94	131.6 Å²	131.6	64%	0.635	66%	0.656	S	S	*	*			cis	-161.5	176.4	-4.8	-105.2	0	0	0	0	108
1418	Y	33.4	Very low	31.7	Very low	189 Å²	189	132.6 Å²	132.6	74%	0.741	66%	0.662	S	S	*	*			cis	-174.9	156.2	46.5	-109.8	-58.4	0	0	0	112.1
1419	H	35.5	Very low	32.2	Very low	138 Å²	138	134.4 Å²	134.4	64%	0.639	67%	0.666	S	S	*	*			trans	54	146.6	144.8	-64.3	-42.6	0	0	0	121.8
1420	D	34.7	Very low	32.8	Very low	112 Å²	112	135 Å²	135	60%	0.599	67%	0.667	S	S	*	*			cis	-168.2	170.9	-10.2	-108.5	-0.6	0	0	0	111.1
1421	D	36.3	Very low	33.4	Very low	127 Å²	127	137.2 Å²	137.2	68%	0.679	67%	0.67	S	S	*	*			trans	59.8	143.3	154	-54	-7.3	0	0	0	120
1422	D	35.9	Very low	34	Very low	125 Å²	125	137.5 Å²	137.5	67%	0.668	68%	0.682	S	S	*	*			cis	-158.6	157.3	-5.7	-100.8	-18.7	0	0	0	110.4
1423	D	36.4	Very low	34.4	Very low	142 Å²	142	134.9 Å²	134.9	76%	0.759	68%	0.676	S	S	*	*			trans	43.7	148.1	143.5	-64	-4.8	0	0	0	122.8
1424	V	38.4	Very low	35.1	Very low	102 Å²	102	137 Å²	137	62%	0.618	69%	0.685	S	S	*	*			cis	-156.1	136.1	1.6	107.5	0	0	0	0	108
1425	E	35.3	Very low	35.3	Very low	155 Å²	155	140.1 Å²	140.1	72%	0.724	70%	0.704	S	S	*	*				48.3	143.3	104.4	-56.2	-178.8	172.5	0	0	116.6
1426	E	35.3	Very low	35.4	Very low	148 Å²	148	136.8 Å²	136.8	69%	0.692	70%	0.698	S	S	*	*			cis	-161.3	155.2	-14.7	-112	176.1	-173.9	0	0	108.2
1427	D	32.1	Very low	35.4	Very low	126 Å²	126	136.9 Å²	136.9	67%	0.674	70%	0.695	S	S	*	*				23.1	151.1	125.3	-48.5	-2.9	0	0	0	119.6
1428	D	32.7	Very low	35.6	Very low	135 Å²	135	139.2 Å²	139.2	72%	0.722	70%	0.696	S	S	*	*			cis	-166.6	170.2	-0.7	-117.6	-20.5	0	0	0	112.1
1429	E	34.1	Very low	35.6	Very low	166 Å²	166	135.9 Å²	135.9	78%	0.776	70%	0.696	S	S	*	*			trans	40	130.4	152.2	-64	-172.5	156.4	0	0	125.8
1430	E	35.5	Very low	35.4	Very low	187 Å²	187	135.7 Å²	135.7	87%	0.874	70%	0.7	S	S	*	*			trans	69.7	155.1	149.6	-63	-169.7	161.6	0	0	122.4
1431	D	37.8	Very low	35.6	Very low	151 Å²	151	134.1 Å²	134.1	81%	0.807	71%	0.71	S	S	*	*			trans	-101.6	146.3	-162.5	-55.6	-74.6	0	0	0	115
1432	D	39.3	Very low	35.4	Very low	150 Å²	150	134.2 Å²	134.2	80%	0.802	71%	0.71	S	S	*	*				157.5	109.9	125.8	-85	-9.8	0	0	0	114.5
1433	D	39	Very low	35.1	Very low	125 Å²	125	133.3 Å²	133.3	67%	0.668	71%	0.71	S	S	*	*			trans	52	112.1	140.5	-64.1	-11.3	0	0	0	125.8
1434	E	41.7	Very low	34.8	Very low	89 Å²	89	133.7 Å²	133.7	42%	0.416	71%	0.707	S	S	.	*				77.6	122.3	113.8	-154.5	171.7	-133.9	0	0	121.9	M668 T669	M668-E1434 WeakPolarHBondContact CB-OE2 3.38Å; M668-E1434 HydrophobicContact CE-CG 3.57Å; M668-E1434 HydrophobicContact CG-CG 4.3Å; M668-E1434 WeakPolarHBondContact CG-OE2 3.21Å; M668-E1434 HydrophobicContact SD-CB 4.38Å; M668-E1434 HydrophobicContact SD-CG 3.76Å; T669-E1434 PolarHBondContact N-OE2 3.27Å; T669-E1434 PolarHBondContact OG1-OE1 2.72Å; T669-E1434 VanDerWaalsContact OG1-OE1 3.11Å; T669-E1434 PolarHBondContact OG1-OE2 3.3Å
1435	L	35.1	Very low	34.6	Very low	166 Å²	166	135.9 Å²	135.9	87%	0.869	71%	0.711	S	S	*	*			trans	-156.3	159.5	149.1	-110.5	-177.1	0	0	0	111.4	M668	M668-L1435 HydrophobicContact SD-CD2 4.3Å
1436	D	34.8	Very low	34.3	Very low	112 Å²	112	132.7 Å²	132.7	60%	0.599	71%	0.705	S	S	*	*			trans	-114.8	165.7	-145.2	-134.7	-19.4	0	0	0	118.5	M668	M668-D1436 HydrophobicContact CE-CB 3.65Å; M668-D1436 WeakPolarHBondContact CE-OD2 3.34Å
1437	E	34.1	Very low	34	Very low	135 Å²	135	129.6 Å²	129.6	63%	0.631	70%	0.7	S	S	*	*			trans	57.9	122.7	149.4	-66.8	-128.1	108	0	0	124.3
1438	Q	30.8	Very low	34.2	Very low	143 Å²	143	133.6 Å²	133.6	67%	0.668	72%	0.715	S	S	*	*			trans	63	130.4	133.1	-61.7	-172.3	30.7	0	0	122.5
1439	T	32.4	Very low	34.1	Very low	120 Å²	120	131.7 Å²	131.7	74%	0.736	71%	0.707	S	S	*	*				-168.7	137.1	100.3	18.9	0	0	0	0	115.8
1440	N	32.1	Very low	33.7	Very low	133 Å²	133	130.3 Å²	130.3	71%	0.711	71%	0.705	S	S	*	*			trans	56.9	115.3	145.3	-63.1	-32.5	0	0	0	122.1
1441	G	37.8	Very low	33.4	Very low	79 Å²	79	127.8 Å²	127.8	81%	0.814	70%	0.698	S	S	*	*			trans	-152.3	40.6	164.2	0	0	0	0	0	112.5
1442	N	32.6	Very low	32.9	Very low	129 Å²	129	125.2 Å²	125.2	69%	0.69	69%	0.692	S	S	*	*			trans	-76.4	170.6	-176.3	-53.2	-17.7	0	0	0	111.2
1443	T	30	Very low	32.5	Very low	107 Å²	107	123 Å²	123	66%	0.656	69%	0.688	S	S	*	*			cis	-156.2	171.7	14.5	-24.8	0	0	0	0	110
1444	E	30	Very low	31.9	Very low	149 Å²	149	122.7 Å²	122.7	70%	0.696	69%	0.69	S	S	*	*			trans	72.5	151.4	151.9	-75.6	163.7	-109.9	0	0	118.1
1445	Q	33.6	Very low	31.1	Very low	149 Å²	149	124.8 Å²	124.8	70%	0.696	70%	0.7	S	S	*	*			cis	-145	148.6	11.6	-137.8	163	51.5	0	0	112.7
1446	S	29.6	Very low	30.6	Very low	87 Å²	87	125.7 Å²	125.7	61%	0.608	69%	0.692	S	S	*	*			trans	31.6	104.7	142.3	62	0	0	0	0	118.6
1447	S	30	Very low	30.2	Very low	83 Å²	83	125.6 Å²	125.6	58%	0.58	70%	0.695	S	S	*	*				69.1	122.1	82.1	70.7	0	0	0	0	115.8	V1449	S1447-V1449 PolarHBondContact O-N 2.97Å; S1447-V1449 WeakPolarHBondContact OG-CB 3.4Å
1448	E	36.4	Very low	29.9	Very low	211 Å²	211	127.4 Å²	127.4	99%	0.986	70%	0.704	S	S	*	*	S	Bend	trans	-76	104	141.9	-70.3	-172.7	141.2	0	0	106
1449	V	30.1	Very low	29.9	Very low	94 Å²	94	128.2 Å²	128.2	57%	0.57	71%	0.713	S	S	*	*			trans	-108.9	130.6	-171	104.3	0	0	0	0	109.8	S1447	S1447-V1449 PolarHBondContact O-N 2.97Å; S1447-V1449 WeakPolarHBondContact OG-CB 3.4Å
1450	D	25.7	Very low	29.9	Very low	137 Å²	137	127.1 Å²	127.1	73%	0.733	71%	0.708	S	S	*	*			trans	63.6	164.1	156.7	-52.7	-23.8	0	0	0	116.6
1451	D	28.4	Very low	29.7	Very low	135 Å²	135	128.8 Å²	128.8	72%	0.722	72%	0.716	S	S	*	*			cis	-146.8	142.6	12.9	-162.8	3.7	0	0	0	114.3
1452	S	28	Very low	29.1	Very low	96 Å²	96	127.9 Å²	127.9	67%	0.671	71%	0.707	S	S	*	*			trans	64.6	172.2	156	86.1	0	0	0	0	117.6
1453	S	31	Very low	29	Very low	103 Å²	103	130.5 Å²	130.5	72%	0.72	71%	0.713	S	S	*	*			cis	-137.4	140.2	-1	-30.4	0	0	0	0	113
1454	V	26.1	Very low	28.9	Very low	119 Å²	119	131.8 Å²	131.8	72%	0.721	71%	0.714	S	S	*	*			trans	-11.4	130	135.6	167	0	0	0	0	115.6
1455	E	24.2	Very low	28.7	Very low	134 Å²	134	131.1 Å²	131.1	63%	0.626	72%	0.715	S	S	*	*			trans	43.6	142.2	143.8	-61	-172.4	128.6	0	0	119.7
1456	R	26	Very low	28.4	Very low	185 Å²	185	130.3 Å²	130.3	70%	0.698	72%	0.715	S	S	*	*			cis	180	160.5	26.8	-130.1	179.1	-153.4	107.6	9.7	107.3
1457	V	25.6	Very low	28.3	Very low	110 Å²	110	133.2 Å²	133.2	67%	0.667	72%	0.719	S	S	*	*			trans	64.8	140.5	151.5	173	0	0	0	0	117.5
1458	E	28.2	Very low	28.3	Very low	172 Å²	172	135.2 Å²	135.2	80%	0.804	72%	0.723	S	S	*	*			trans	62.5	131.4	174.1	-71.6	151.5	-139.9	0	0	115.7
1459	D	30	Very low	28.1	Very low	161 Å²	161	131.6 Å²	131.6	86%	0.861	71%	0.711	S	S	*	*			cis	-104.8	139.6	0.6	-93.3	-49	0	0	0	113.1
1460	P	33.1	Very low	28.2	Very low	97 Å²	97	135.7 Å²	135.7	63%	0.63	72%	0.724	S	S	*	*			trans	-96.6	159.1	179.1	38	-34.3	0	0	0	113.2
1461	N	28.4	Very low	28.4	Very low	167 Å²	167	137 Å²	137	89%	0.893	73%	0.729	S	S	*	*			trans	-156	102	137.7	-109.7	-42	0	0	0	112.6
1462	G	24.9	Very low	29.1	Very low	60 Å²	60	135.8 Å²	135.8	62%	0.619	73%	0.729	S	S	*	*			trans	-133.2	86	169.9	0	0	0	0	0	110.6
1463	F	29.4	Very low	29.1	Very low	184 Å²	184	137.8 Å²	137.8	81%	0.807	73%	0.733	S	S	*	*			trans	-146	120.6	163.1	-82.2	-80.4	0	0	0	105.6
1464	I	27.6	Very low	29	Very low	135 Å²	135	137.3 Å²	137.3	69%	0.692	74%	0.735	S	S	*	*				56	74.6	60.9	-46.8	173.6	0	0	0	111.3
1465	N	26.8	Very low	29.4	Very low	134 Å²	134	137.6 Å²	137.6	72%	0.717	74%	0.737	S	S	*	*				-179	144.3	113	-96.3	-48.4	0	0	0	114.7
1466	L	26.3	Very low	29.6	Very low	132 Å²	132	138.6 Å²	138.6	69%	0.691	75%	0.746	S	S	*	*			trans	48.8	120.8	139	-64	164.9	0	0	0	121.8
1467	Q	27.8	Very low	29.7	Very low	149 Å²	149	135 Å²	135	70%	0.696	75%	0.749	S	S	*	*			trans	85	117.6	134.2	-68.3	180	-97.8	0	0	121.9
1468	D	29.4	Very low	29.8	Very low	125 Å²	125	135.4 Å²	135.4	67%	0.668	75%	0.754	S	S	*	*			trans	68	133.7	133.7	-52.4	-35.8	0	0	0	122.3
1469	N	32.9	Very low	29.7	Very low	134 Å²	134	134.6 Å²	134.6	72%	0.717	76%	0.755	S	S	*	*			trans	89.4	100.7	156.6	-56.7	-59.4	0	0	0	121.7
1470	Q	33.1	Very low	29.6	Very low	181 Å²	181	131.9 Å²	131.9	85%	0.846	75%	0.748	S	S	*	*				75.9	142.9	125.7	-62.7	-179.9	3.1	0	0	121.8
1471	L	29.3	Very low	29.3	Very low	163 Å²	163	132 Å²	132	85%	0.853	75%	0.751	S	S	*	*			trans	-57.3	167.3	165.6	-80.2	67.6	0	0	0	112.1
1472	P	42.8	Very low	29.3	Very low	111 Å²	111	129.7 Å²	129.7	72%	0.721	74%	0.744	S	S	*	*			cis	-123	-166.7	12	46.1	-32	0	0	0	112.3
1473	D	27.7	Very low	29.3	Very low	138 Å²	138	131.5 Å²	131.5	74%	0.738	75%	0.747	S	S	*	*			cis	-151.7	170.4	8.4	-147.5	-36.4	0	0	0	111.1	T1475	D1473-T1475 PolarHBondContact O-OG1 3.34Å
1474	A	30.3	Very low	29.4	Very low	92 Å²	92	131.9 Å²	131.9	76%	0.76	75%	0.751	S	S	*	*			trans	54.2	-139.6	-175	0	0	0	0	0	112.8
1475	T	34.5	Very low	29.6	Very low	125 Å²	125	134.3 Å²	134.3	77%	0.767	76%	0.76	S	S	*	*			trans	66.4	146.6	174.7	36.3	0	0	0	0	121.1	D1473	D1473-T1475 PolarHBondContact O-OG1 3.34Å
1476	L	28.4	Very low	29.7	Very low	156 Å²	156	133.9 Å²	133.9	82%	0.817	77%	0.767	S	S	*	*	S	Bend	trans	-48	143.3	165.7	-61.3	140.9	0	0	0	114.5
1477	S	26.3	Very low	29.8	Very low	109 Å²	109	136.4 Å²	136.4	76%	0.762	78%	0.775	S	S	*	*			trans	64.8	146.7	168.2	-55.6	0	0	0	0	115.5
1478	P	28.8	Very low	29.8	Very low	118 Å²	118	134.9 Å²	134.9	77%	0.766	78%	0.78	S	S	*	*				-151.3	135.8	86.2	36.4	-16.4	0	0	0	117.3
1479	D	26.1	Very low	29.8	Very low	156 Å²	156	137 Å²	137	83%	0.834	79%	0.786	S	S	*	*				52.4	-165.9	128.2	-60.5	-1.7	0	0	0	121.9
1480	S	28.3	Very low	29.8	Very low	103 Å²	103	139.1 Å²	139.1	72%	0.72	80%	0.796	S	S	*	*			trans	-155.8	173.9	-145.3	69.4	0	0	0	0	114.2
1481	S	27.2	Very low	29.5	Very low	99 Å²	99	138.3 Å²	138.3	69%	0.692	80%	0.798	S	S	*	*			trans	88.1	153.7	150.9	79.4	0	0	0	0	121.7
1482	T	26.6	Very low	29.4	Very low	120 Å²	120	138.6 Å²	138.6	74%	0.736	80%	0.796	S	S	*	*			trans	63.9	104.4	154.4	44.6	0	0	0	0	122.7
1483	S	26.8	Very low	28.8	Very low	98 Å²	98	138.5 Å²	138.5	69%	0.685	80%	0.799	S	S	*	*				48.8	140.3	117.8	61.3	0	0	0	0	124.5
1484	E	30.9	Very low	29	Very low	192 Å²	192	137 Å²	137	90%	0.897	80%	0.799	S	S	*	*			trans	85.9	159.2	150.1	-77.6	174.2	-161.5	0	0	121.4
1485	E	32	Very low	29	Very low	186 Å²	186	139.6 Å²	139.6	87%	0.869	80%	0.795	S	S	*	*			trans	-81	143.1	-138.2	-51.2	-179	119.3	0	0	117.6
1486	S	29.2	Very low	28.8	Very low	125 Å²	125	139.9 Å²	139.9	87%	0.874	80%	0.797	S	S	*	*				-171	166.7	129	34.8	0	0	0	0	111.9
1487	Q	28.3	Very low	28.7	Very low	185 Å²	185	138 Å²	138	86%	0.864	79%	0.792	S	S	*	*			trans	-105.5	170.4	-171.9	-70.7	-172.4	-17.8	0	0	114
1488	C	26.7	Very low	29.3	Very low	117 Å²	117	138.6 Å²	138.6	79%	0.791	79%	0.793	S	S	*	*			trans	81	133.6	174	-65.9	0	0	0	0	115.9
1489	Q	30.6	Very low	29.3	Very low	170 Å²	170	141.3 Å²	141.3	79%	0.794	80%	0.798	S	S	*	*			cis	-140.6	132.6	7.5	-119.9	167.5	13.5	0	0	112.5
1490	L	31.5	Very low	29.5	Very low	177 Å²	177	145.2 Å²	145.2	93%	0.927	80%	0.801	S	S	*	*			trans	23.6	111.2	157.8	-64.2	168	0	0	0	118.9
1491	N	27.3	Very low	29.8	Very low	165 Å²	165	149.8 Å²	149.8	88%	0.882	80%	0.802	S	S	*	*			trans	-144.5	155.1	165.2	-152.6	-9.7	0	0	0	112.5
1492	M	28	Very low	29.9	Very low	168 Å²	168	150 Å²	150	83%	0.828	80%	0.804	S	S	*	*			trans	-158.1	136.9	-168.3	-158.3	-172.8	-157.9	0	0	113.3
1493	S	29.8	Very low	30.1	Very low	110 Å²	110	150.9 Å²	150.9	77%	0.769	80%	0.799	S	S	*	*			trans	66.7	164.9	166.5	87.1	0	0	0	0	116
1494	S	30.8	Very low	30.3	Very low	107 Å²	107	155.4 Å²	155.4	75%	0.748	81%	0.81	S	S	*	*			cis	-168.9	179.7	-27.3	55.3	0	0	0	0	107.1
1495	H	30.9	Very low	30.2	Very low	146 Å²	146	152.4 Å²	152.4	68%	0.676	81%	0.805	S	S	*	*			cis	-153.8	164.9	6.3	-157.9	0.2	0	0	0	108.8
1496	T	30.5	Very low	29.9	Very low	130 Å²	130	148.2 Å²	148.2	80%	0.798	80%	0.801	S	S	*	*				177.2	169.4	97	34.2	0	0	0	0	110.6
1497	T	27	Very low	29.9	Very low	117 Å²	117	149.3 Å²	149.3	72%	0.718	80%	0.803	S	S	*	*			trans	-108.9	159.3	-173.3	37.1	0	0	0	0	112.2
1498	P	38	Very low	29.8	Very low	121 Å²	121	146.2 Å²	146.2	79%	0.786	80%	0.796	S	S	*	*				-141.7	-163.8	52.5	44.9	-24.2	0	0	0	113.7
1499	M	28	Very low	29.7	Very low	176 Å²	176	148 Å²	148	87%	0.867	80%	0.796	S	S	*	*			cis	-143.5	-107.8	5.8	-158.4	-176.7	-165.5	0	0	114.6
1500	R	31.6	Very low	29.6	Very low	237 Å²	237	147.4 Å²	147.4	89%	0.894	80%	0.797	S	S	*	*			trans	-157	163.2	-169.9	-76	-175.5	169.4	167	-3.9	108.9
1501	R	33.2	Very low	29.4	Very low	199 Å²	199	144.3 Å²	144.3	75%	0.751	79%	0.785	S	S	*	*			cis	-145.4	157.5	15.6	-171.2	-152.4	167.5	109.9	-6.8	109.6	H1503	R1501-H1503 PolarHBondContact NE-NE2 3.23Å; R1501-H1503 PolarHBondContact NH2-CE1 2.66Å; R1501-H1503 PolarHBondContact NH2-NE2 3.46Å
1502	S	30.9	Very low	29.8	Very low	103 Å²	103	141.8 Å²	141.8	72%	0.72	78%	0.781	S	S	*	*			trans	-112.2	173	171.8	55.9	0	0	0	0	113.3
1503	H	31.2	Very low	29.9	Very low	140 Å²	140	144 Å²	144	65%	0.648	79%	0.786	S	S	*	*			trans	-148.2	107.9	164.1	-104.1	-73.8	0	0	0	111.9	R1501	R1501-H1503 PolarHBondContact NE-NE2 3.23Å; R1501-H1503 PolarHBondContact NH2-CE1 2.66Å; R1501-H1503 PolarHBondContact NH2-NE2 3.46Å
1504	E	29.3	Very low	30.2	Very low	193 Å²	193	142.2 Å²	142.2	90%	0.902	78%	0.784	S	S	*	*			trans	-118.3	157.3	150.5	-71.1	-174.2	126.2	0	0	107.5
1505	T	30.3	Very low	29.9	Very low	129 Å²	129	149.1 Å²	149.1	79%	0.791	79%	0.794	S	S	*	*			trans	-130.9	107.8	179.5	50.4	0	0	0	0	111.7
1506	A	25.6	Very low	29.7	Very low	97 Å²	97	148.6 Å²	148.6	80%	0.802	80%	0.801	S	S	*	*			trans	-106.2	133.1	163.7	0	0	0	0	0	109.3
1507	V	29.4	Very low	29.6	Very low	149 Å²	149	148.1 Å²	148.1	90%	0.903	80%	0.798	S	S	*	*			trans	-85.9	130.3	-177.4	176.8	0	0	0	0	110.4
1508	V	25.2	Very low	29.6	Very low	120 Å²	120	151 Å²	151	73%	0.727	80%	0.803	S	S	*	*			trans	-114.1	138.5	176.2	175.4	0	0	0	0	110
1509	I	23.8	Very low	29.1	Very low	155 Å²	155	151 Å²	151	80%	0.795	81%	0.807	S	S	*	*			trans	-70.5	132.6	177.7	-59.1	167.7	0	0	0	109.9
1510	I	28.7	Very low	29.3	Very low	157 Å²	157	148.7 Å²	148.7	81%	0.805	80%	0.803	S	S	*	*			trans	-129.8	124.9	169.5	-57.4	-179.3	0	0	0	109.6
1511	T	28	Very low	29.3	Very low	111 Å²	111	146.8 Å²	146.8	68%	0.681	80%	0.801	S	S	*	*			trans	-108.6	137.5	172.1	44.8	0	0	0	0	112.2
1512	S	35	Very low	29.4	Very low	112 Å²	112	143.6 Å²	143.6	78%	0.783	80%	0.804	S	S	*	*			trans	3.8	129.9	160.2	59.9	0	0	0	0	120.3
1513	K	31.8	Very low	29.8	Very low	215 Å²	215	148.6 Å²	148.6	94%	0.935	83%	0.83	S	S	*	*			trans	-142.8	141.7	148	-63.5	-173.3	-178.5	174	0	110.1
1514	G	34	Very low	29.8	Very low	72 Å²	72	149.1 Å²	149.1	74%	0.742	84%	0.839	S	S	*	*			cis	152.3	-177.5	-8.5	0	0	0	0	0	113
1515	R	24.9	Very low	29.8	Very low	252 Å²	252	146.7 Å²	146.7	95%	0.951	84%	0.836	S	S	*	*			trans	-125.7	153.5	150.8	-89.8	-172	171.3	176.5	-1.9	109.3
1516	T	27.7	Very low	29.8	Very low	135 Å²	135	147.7 Å²	147.7	83%	0.828	84%	0.838	S	S	*	*			trans	-85.8	163.1	-166.5	46	0	0	0	0	111.6
1517	V	27.2	Very low	30	Very low	120 Å²	120	150.7 Å²	150.7	73%	0.727	84%	0.841	S	S	*	*				-151.1	137.3	76.8	160.8	0	0	0	0	113
1518	Q	28.5	Very low	30.1	Very low	177 Å²	177	150.8 Å²	150.8	83%	0.827	84%	0.837	S	S	*	*			trans	27.8	129	156.3	-65.3	168.6	-43.4	0	0	122.6
1519	S	26.2	Very low	30.4	Very low	123 Å²	123	152.9 Å²	152.9	86%	0.86	84%	0.844	S	S	*	*			trans	-137.6	152.1	136	-179.5	0	0	0	0	108.4
1520	T	33.2	Very low	30.9	Very low	127 Å²	127	152.7 Å²	152.7	78%	0.779	85%	0.847	S	S	*	*			trans	-118.2	151	-173.3	42.1	0	0	0	0	113.1
1521	K	30.1	Very low	31	Very low	196 Å²	196	152.4 Å²	152.4	85%	0.852	85%	0.851	S	S	*	*			trans	-61	149.3	-178.6	-56.7	176.8	176.8	-176.6	0	113.1
1522	T	36.3	Very low	31.3	Very low	133 Å²	133	155.8 Å²	155.8	82%	0.816	87%	0.865	S	S	*	*				173	151.8	102.9	38.2	0	0	0	0	109.3
1523	T	40.4	Very low	30.9	Very low	208 Å²	208	159.8 Å²	159.8	100%	1.276	87%	0.872	S	S	*	*			cis	-113.8	0	-1.7	49.9	0	0	0	0	110.8

Retrieved 1,523 of 1,523 residues in 307.7 ms (Link to these results)

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