A0A3Q0KVJ6_SCHMA Loading...

Homeobox protein six-related

AlphaFold DB (A0A5K4F027), UniProt , Accession A0A3Q0KVJ6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,193 aa.

						>A0A3Q0KVJ6_SCHMA|A0A3Q0KVJ6
MSHSPKSAIVHENIANGGTELEKKLLNLKSPFNDIDDVYLSSNFNELDRSSHVSVVMSERVQSIASGIYKEFETMIEAYGLPVVERLMPLIISLLENLDELYKDQSAYHAEVRQLREENEHIYDQLTAEKAARKQSELRLLNAEDAFDEERKVNEAKNESLSTSCRQTELRLQLAKDQVSRLEVKEQEWKKEENRLHEHLNELIRSNVELTEQIKFINNNNQDQSRNTLNNHIHKHSPRKLSMNSPKYNLTGSTNHDQSSTIDGSSIVHSNSLGVGYDATSGGFEFDELPNTLESESGGLNVDDDLPDTYPITINPEFEIIEFAGMRKEIDVLIKENMELVEMKNALNVVKDDLLARIDHLTSENISLHESVNMLTDSRIRLQSELTNIDQMLNDARTEINQLNEKLSFYQDKTNIESTNSAQVKRFTRSEMARILAERNHYKERLLELQDAVRFTETLRVSQKGHRELFMTKTPTIQQCKFDLNSPVSGPLQSLQKFFSSFTSGQRSENSNELIQNVGNDLSIHGTDNSLSWITLSATCTNSPIYGWATGKQSDRKSSCNNNNGGAMQSNNDSVDDNVYSNVPVPIQCRTIGGLHKKNLEICTALTVPIASLDCDSKPKYHLWLIGRGGSGDYTNSNDSSLSLNRGYLGQVHIFEPTKFTQPINSFDLDNGFLPTAAVYVKYTASTALSSPELTSNHEYIEFTWDINESYDSSSNSMNETICNKNNDGCVILASNDGRFLVFKLCYSMNSTSSSDLVRNNNDNEQIVSSHFNVVVMPQIIYRFNTNSQGLVANGMISRDNYVCIGLFNSISTTHIVCFQWPLTFMHNQHNHTINTSSSMINSTLNKIQTKHKLINLPFESLSTGPLIMASSFSSSTSSSSSSSSNQCSTMNENNISSINDYIWLGTAGGGHCYCLAVQSGDFITSLVLPNETPCLHAICIKPSTMGLADIVWLAVSGNPTICTSCEKISICTTDSNRNNIDNKDIDDDDVIVNQKKCQHNVNGGVSVGMARLLACCPKQKCILRQIDLTNSLSSMLDMENVTDPIDLTICRLLIIPLTSDHEIWFATRSGLIARLRLDYSKYKYSSNEVELSKPSSITISCHGYRRPVCNLLLIHQICQKANNNEDLNYLIVSVGHDYVDLRQIQEQFGQNDEHQTQLSAVRTSSIRIHINRSRQMGSGAHAIVWRLTNLSH
					

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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	38.1	Very low	33.1	Very low	237 Å²	237	144.6 Å²	144.6	100%	1.167	81%	0.808	S	S	*	*				0	142.5	0	-72.8	166.1	167.9	0	0	108.1
2	S	31.1	Very low	32.8	Very low	86 Å²	86	145 Å²	145	60%	0.601	80%	0.799	S	S	*	*			cis	179.4	133.1	-35	33.4	0	0	0	0	108.5
3	H	36.1	Very low	32.5	Very low	178 Å²	178	143.3 Å²	143.3	82%	0.824	79%	0.788	S	S	*	*			trans	69.4	150.6	178.8	-50.4	-67.5	0	0	0	116.1
4	S	30.8	Very low	32.5	Very low	83 Å²	83	144.1 Å²	144.1	58%	0.58	79%	0.788	S	S	*	*			cis	166.8	129.6	-45.5	49.9	0	0	0	0	107.1
5	P	35.5	Very low	32.7	Very low	130 Å²	130	139.9 Å²	139.9	84%	0.844	78%	0.781	S	S	*	*			trans	-78.7	141.9	-171.3	31.8	-35.8	0	0	0	113.2
6	K	32.9	Very low	32.7	Very low	196 Å²	196	140.8 Å²	140.8	85%	0.852	78%	0.783	S	S	*	*			trans	-154.3	119.4	167.4	-73.2	-170.3	179.4	179.1	0	112
7	S	34	Very low	32.6	Very low	115 Å²	115	136.9 Å²	136.9	80%	0.804	78%	0.783	S	S	*	*				174.7	101.5	116.4	53.5	0	0	0	0	110.8
8	A	30	Very low	32.6	Very low	97 Å²	97	131.9 Å²	131.9	80%	0.802	77%	0.767	S	S	*	*			trans	-98.9	124	164.8	0	0	0	0	0	109
9	I	33.3	Very low	33.2	Very low	157 Å²	157	128.3 Å²	128.3	81%	0.805	75%	0.747	S	S	*	*			trans	-137.1	90.7	167.4	-57.7	-179.1	0	0	0	104.3
10	V	30.9	Very low	33.3	Very low	115 Å²	115	128.3 Å²	128.3	70%	0.697	74%	0.739	S	S	*	*				55.8	91.4	94.4	-177.7	0	0	0	0	111.3
11	H	31.6	Very low	33.6	Very low	197 Å²	197	128.4 Å²	128.4	91%	0.912	74%	0.736	S	S	*	*			trans	-138.9	116.9	138.2	-119.9	-76.3	0	0	0	108.7
12	E	29.7	Very low	33.9	Very low	149 Å²	149	122.9 Å²	122.9	70%	0.696	71%	0.708	S	S	*	*			trans	-110.1	149.3	-171.9	-155.6	-163.7	137.7	0	0	109.4
13	N	29	Very low	34.5	Very low	123 Å²	123	124.9 Å²	124.9	66%	0.658	71%	0.706	S	S	*	*			trans	69	166.7	171.6	-59.4	-64.8	0	0	0	117.4
14	I	31.7	Very low	34.9	Very low	154 Å²	154	122.1 Å²	122.1	79%	0.79	69%	0.691	S	S	*	*			trans	75.8	115.2	-169.6	-49.8	171.6	0	0	0	112.4
15	A	35.9	Very low	35.3	Very low	82 Å²	82	124.1 Å²	124.1	68%	0.678	70%	0.695	S	S	*	*			cis	-137.9	121.3	2.6	0	0	0	0	0	113.3	G17	A15-G17 PolarHBondContact O-N 3.27Å
16	N	32.8	Very low	35.7	Very low	153 Å²	153	124.7 Å²	124.7	82%	0.818	69%	0.69	S	S	*	*			trans	-77.2	95.2	156.5	-82	-54.9	0	0	0	108.3
17	G	31.3	Very low	35.9	Very low	75 Å²	75	121.8 Å²	121.8	77%	0.773	68%	0.684	S	S	*	*			trans	-93.6	-28.5	-168.7	0	0	0	0	0	117.5	A15	A15-G17 PolarHBondContact O-N 3.27Å
18	G	32.9	Very low	35.9	Very low	48 Å²	48	123.3 Å²	123.3	50%	0.495	68%	0.682	S	S	.	*	S	Bend	trans	-91.3	-27.5	-171.4	0	0	0	0	0	115.8	E20	G18-E20 PolarHBondContact O-N 3.19Å
19	T	42.6	Very low	36	Very low	63 Å²	63	125.7 Å²	125.7	39%	0.387	67%	0.674	S	S	.	*	H	α-helix	trans	-88.5	4.4	-153.8	54.2	0	0	0	0	115.8	K23	T19-K23 VanDerWaalsContact O-CB 3.26Å; T19-K23 WeakPolarHBondContact O-CB 3.4Å; T19-K23 VanDerWaalsContact O-CD 3.24Å; T19-K23 WeakPolarHBondContact O-CD 3.34Å; T19-K23 WeakPolarHBondContact O-CG 3.4Å; T19-K23 PolarHBondContact O-N 3.43Å
20	E	35.6	Very low	36	Very low	127 Å²	127	121.7 Å²	121.7	59%	0.593	66%	0.66	S	S	*	*	H	α-helix	trans	-93.7	-33.2	175.4	-141.2	-160.7	138.7	0	0	113.5	G18 K24	G18-E20 PolarHBondContact O-N 3.19Å; E20-K24 WeakPolarHBondContact O-CB 3.49Å; E20-K24 VanDerWaalsContact O-CG 3.3Å; E20-K24 WeakPolarHBondContact O-CG 3.3Å; E20-K24 PolarHBondContact O-N 3.2Å; E20-K24 VanDerWaalsContact OE1-CE 3.31Å; E20-K24 WeakPolarHBondContact OE1-CE 3.49Å; E20-K24 IonicContact OE1-NZ 2.78Å; E20-K24 PolarHBondContact OE1-NZ 3.44Å
21	L	40.3	Very low	35.9	Very low	131 Å²	131	121.7 Å²	121.7	69%	0.686	66%	0.663	S	S	*	*	H	α-helix	trans	-74.6	-40.2	172	-80.9	170.9	0	0	0	111.4	K23 K24 L25	L21-K23 VanDerWaalsContact C-N 3.35Å; L21-K23 PolarHBondContact O-N 3.44Å; L21-K24 PolarHBondContact O-N 3.01Å; L21-K24 VanDerWaalsContact O-N 3.1Å; L21-L25 WeakPolarHBondContact O-CD1 3.27Å; L21-L25 PolarHBondContact O-N 3Å
22	E	44.6	Very low	36	Very low	121 Å²	121	120.5 Å²	120.5	57%	0.565	66%	0.655	S	S	*	*	H	α-helix	trans	-59	-45.7	171.5	-66.9	-179.7	135.2	0	0	111.1	K24 L25 L26	E22-K24 VanDerWaalsContact C-N 3.27Å; E22-K24 PolarHBondContact O-N 3.39Å; E22-L25 PolarHBondContact O-N 3.38Å; E22-L26 WeakPolarHBondContact O-CB 3.48Å; E22-L26 VanDerWaalsContact O-CG 3.28Å; E22-L26 WeakPolarHBondContact O-CG 3.35Å; E22-L26 PolarHBondContact O-N 3.03Å
23	K	43.6	Very low	36.2	Very low	129 Å²	129	117.4 Å²	117.4	56%	0.561	64%	0.643	S	S	*	*	H	α-helix	trans	-69.8	-17.9	175.2	-72.8	177	-172.4	176.4	0	114.3	T19 L21 N27	T19-K23 VanDerWaalsContact O-CB 3.26Å; T19-K23 WeakPolarHBondContact O-CB 3.4Å; T19-K23 VanDerWaalsContact O-CD 3.24Å; T19-K23 WeakPolarHBondContact O-CD 3.34Å; T19-K23 WeakPolarHBondContact O-CG 3.4Å; T19-K23 PolarHBondContact O-N 3.43Å; L21-K23 VanDerWaalsContact C-N 3.35Å; L21-K23 PolarHBondContact O-N 3.44Å; K23-N27 PolarHBondContact O-N 2.99Å; K23-N27 PolarHBondContact O-ND2 3.46Å
24	K	43.2	Very low	36.5	Very low	120 Å²	120	118.3 Å²	118.3	52%	0.522	65%	0.648	S	S	.	*	H	α-helix	trans	-86.9	-34.2	173	-81.5	167.7	169.9	166.7	0	112.5	E20 L21 E22 N27	E20-K24 WeakPolarHBondContact O-CB 3.49Å; E20-K24 VanDerWaalsContact O-CG 3.3Å; E20-K24 WeakPolarHBondContact O-CG 3.3Å; E20-K24 PolarHBondContact O-N 3.2Å; E20-K24 VanDerWaalsContact OE1-CE 3.31Å; E20-K24 WeakPolarHBondContact OE1-CE 3.49Å; E20-K24 IonicContact OE1-NZ 2.78Å; E20-K24 PolarHBondContact OE1-NZ 3.44Å; L21-K24 PolarHBondContact O-N 3.01Å; L21-K24 VanDerWaalsContact O-N 3.1Å; E22-K24 VanDerWaalsContact C-N 3.27Å; E22-K24 PolarHBondContact O-N 3.39Å; K24-N27 PolarHBondContact O-N 3.34Å
25	L	40.6	Very low	36.8	Very low	125 Å²	125	117.6 Å²	117.6	65%	0.654	65%	0.645	S	S	*	*	H	α-helix	trans	-65.1	-43.6	167.4	-92.4	76.6	0	0	0	111.2	L21 E22 N27 L28	L21-L25 WeakPolarHBondContact O-CD1 3.27Å; L21-L25 PolarHBondContact O-N 3Å; E22-L25 PolarHBondContact O-N 3.38Å; L25-N27 PolarHBondContact O-N 3.44Å; L25-L28 PolarHBondContact O-N 3.48Å
26	L	43	Very low	36.8	Very low	142 Å²	142	120 Å²	120	74%	0.743	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-11.1	177.8	-70.5	168.6	0	0	0	114.3	E22	E22-L26 WeakPolarHBondContact O-CB 3.48Å; E22-L26 VanDerWaalsContact O-CG 3.28Å; E22-L26 WeakPolarHBondContact O-CG 3.35Å; E22-L26 PolarHBondContact O-N 3.03Å
27	N	38.1	Very low	37.1	Very low	134 Å²	134	120.4 Å²	120.4	72%	0.717	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.5	2	174.7	-86.9	-65.8	0	0	0	114.2	K23 K24 L25 K29	K23-N27 PolarHBondContact O-N 2.99Å; K23-N27 PolarHBondContact O-ND2 3.46Å; K24-N27 PolarHBondContact O-N 3.34Å; L25-N27 PolarHBondContact O-N 3.44Å; N27-K29 PolarHBondContact O-N 3.49Å
28	L	32.8	Very low	37.5	Very low	147 Å²	147	122.5 Å²	122.5	77%	0.77	65%	0.646	S	S	*	*			trans	-81.7	54.8	167.9	-82.9	155.7	0	0	0	110.9	L25 S30	L25-L28 PolarHBondContact O-N 3.48Å; L28-S30 PolarHBondContact O-N 3.39Å
29	K	33.3	Very low	37.7	Very low	148 Å²	148	130.4 Å²	130.4	64%	0.643	66%	0.662	S	S	*	*			trans	-68.3	117.8	173.1	-167.3	-178.4	-177.9	-163.8	0	108.5	N27	N27-K29 PolarHBondContact O-N 3.49Å
30	S	32	Very low	37.6	Very low	73 Å²	73	135.4 Å²	135.4	51%	0.51	69%	0.685	S	S	.	*			trans	-65.5	138.9	177.9	44.6	0	0	0	0	111.2	L28 F32	L28-S30 PolarHBondContact O-N 3.39Å; S30-F32 VanDerWaalsContact C-N 3.31Å; S30-F32 PolarHBondContact O-N 2.98Å
31	P	30.6	Very low	37.6	Very low	115 Å²	115	134.3 Å²	134.3	75%	0.747	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	63.6	-168	35.2	-38.1	0	0	0	112.7
32	F	33.7	Very low	37.2	Very low	172 Å²	172	132.9 Å²	132.9	75%	0.754	69%	0.693	S	S	*	*	T	Hydrogen-bonded Turn	trans	-140.7	1.9	-178	-78.9	-71.6	0	0	0	116.2	S30	S30-F32 VanDerWaalsContact C-N 3.31Å; S30-F32 PolarHBondContact O-N 2.98Å
33	N	33	Very low	36.6	Very low	83 Å²	83	134 Å²	134	44%	0.444	70%	0.703	S	S	.	*			trans	-107.7	23.2	-167.7	-64.5	3.8	0	0	0	115.4
34	D	34.2	Very low	36	Very low	143 Å²	143	136.8 Å²	136.8	77%	0.765	72%	0.715	S	S	*	*	S	Bend	trans	-110	26.9	-173.8	-63.1	-20.3	0	0	0	113.4
35	I	38.4	Very low	35.6	Very low	139 Å²	139	138.2 Å²	138.2	71%	0.713	73%	0.729	S	S	*	*	S	Bend	trans	-127.7	-37.7	-172.5	-65.9	-178	0	0	0	115.1
36	D	36.4	Very low	35.2	Very low	133 Å²	133	140.5 Å²	140.5	71%	0.711	74%	0.736	S	S	*	*	S	Bend	trans	-93.5	-15.2	-161.7	-66.7	-42.6	0	0	0	116.7	V38	D36-V38 PolarHBondContact O-N 3.03Å
37	D	39.2	Very low	34.8	Very low	161 Å²	161	141 Å²	141	86%	0.861	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	7.7	-173.3	-84.2	-30.3	0	0	0	115.6
38	V	39.4	Very low	34.5	Very low	118 Å²	118	141.8 Å²	141.8	72%	0.715	74%	0.743	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	-13.8	-172	-178.5	0	0	0	0	113.8	D36	D36-V38 PolarHBondContact O-N 3.03Å
39	Y	37.4	Very low	34.6	Very low	214 Å²	214	145.6 Å²	145.6	84%	0.839	75%	0.747	S	S	*	*	S	Bend	trans	-114.1	1.2	-162.8	-113.7	-82	0	0	0	117.7
40	L	39.3	Very low	34.4	Very low	168 Å²	168	144.2 Å²	144.2	88%	0.88	76%	0.756	S	S	*	*	S	Bend	trans	-125.6	0.9	-174.7	-70.3	174	0	0	0	115.6	S42	L40-S42 PolarHBondContact O-N 3.41Å; L40-S42 VanDerWaalsContact O-N 3.16Å
41	S	35.6	Very low	34.4	Very low	104 Å²	104	145.8 Å²	145.8	73%	0.727	77%	0.767	S	S	*	*	S	Bend	trans	-85	29.9	-177.8	61.8	0	0	0	0	114.4
42	S	32.8	Very low	34.3	Very low	101 Å²	101	149.8 Å²	149.8	71%	0.706	78%	0.775	S	S	*	*	S	Bend	trans	-157.8	68.3	-172.6	-70.2	0	0	0	0	114.4	L40	L40-S42 PolarHBondContact O-N 3.41Å; L40-S42 VanDerWaalsContact O-N 3.16Å
43	N	31	Very low	34.3	Very low	145 Å²	145	147.3 Å²	147.3	78%	0.775	77%	0.774	S	S	*	*	S	Bend	trans	-168.3	158	146.4	-99.2	-29	0	0	0	111.3
44	F	32.9	Very low	34.4	Very low	187 Å²	187	147.6 Å²	147.6	82%	0.82	78%	0.783	S	S	*	*			trans	62.5	61.9	174.7	-57.5	-67.4	0	0	0	117.6
45	N	33.1	Very low	35.2	Very low	151 Å²	151	147.3 Å²	147.3	81%	0.807	79%	0.785	S	S	*	*			trans	-70.9	155.4	131.7	-86.7	-23.5	0	0	0	109.7
46	E	33.8	Very low	36	Very low	173 Å²	173	145.2 Å²	145.2	81%	0.808	78%	0.779	S	S	*	*			trans	70.5	145.1	158.6	-72.6	-176.3	123.1	0	0	121.1
47	L	33.8	Very low	37.2	Very low	153 Å²	153	142.1 Å²	142.1	80%	0.801	76%	0.761	S	S	*	*			trans	73.8	94.3	151.3	-70	160.8	0	0	0	121.1
48	D	32.6	Very low	39	Very low	149 Å²	149	136.2 Å²	136.2	80%	0.797	73%	0.733	S	S	*	*				119.6	157	108.8	-148.9	6.3	0	0	0	117.2
49	R	33.2	Very low	41	Very low	227 Å²	227	138.4 Å²	138.4	86%	0.857	74%	0.735	S	S	*	*			trans	-75.9	160.7	179	-66.6	177.2	167.1	-158.6	-4.1	111.2
50	S	29.7	Very low	43.2	Very low	120 Å²	120	135.6 Å²	135.6	84%	0.839	72%	0.723	S	S	*	*			trans	69.4	73.8	159.1	-175.3	0	0	0	0	117.4
51	S	32.2	Very low	45.6	Very low	105 Å²	105	127.6 Å²	127.6	73%	0.734	68%	0.681	S	S	*	*				-154.8	116.1	128.1	49.7	0	0	0	0	112.2	V53	S51-V53 VanDerWaalsContact C-N 3.29Å; S51-V53 PolarHBondContact O-N 3.09Å; S51-V53 VanDerWaalsContact O-N 3.15Å
52	H	29.5	Very low	48	Very low	199 Å²	199	128.5 Å²	128.5	92%	0.921	67%	0.674	S	S	*	*			trans	-88.2	65.8	176.1	-170.7	-66.4	0	0	0	110
53	V	33.4	Very low	50.7	Low	120 Å²	120	127.7 Å²	127.7	73%	0.727	67%	0.668	S	S	*	*			trans	-106.1	121.5	177	-179.5	0	0	0	0	108.8	S51 V55	S51-V53 VanDerWaalsContact C-N 3.29Å; S51-V53 PolarHBondContact O-N 3.09Å; S51-V53 VanDerWaalsContact O-N 3.15Å; V53-V55 PolarHBondContact O-N 3.44Å
54	S	34	Very low	53.5	Low	90 Å²	90	124.2 Å²	124.2	63%	0.629	65%	0.649	S	S	*	*			trans	-68.5	120.9	-177.5	38.8	0	0	0	0	112.1	V56	S54-V56 PolarHBondContact O-N 3Å; S54-V56 VanDerWaalsContact O-N 3.12Å
55	V	50.8	Low	56.1	Low	136 Å²	136	115.6 Å²	115.6	82%	0.824	61%	0.612	S	S	*	*			trans	-75.9	92.7	160.4	-178	0	0	0	0	107.2	V53	V53-V55 PolarHBondContact O-N 3.44Å
56	V	55.3	Low	58.8	Low	96 Å²	96	112.3 Å²	112.3	58%	0.582	60%	0.601	S	S	*	*			trans	-74	-28.5	-169.1	179.6	0	0	0	0	113	S54 K103	S54-V56 PolarHBondContact O-N 3Å; S54-V56 VanDerWaalsContact O-N 3.12Å; V56-K103 PolarHBondContact O-NZ 3.04Å
57	M	61.6	Low	61.6	Low	67 Å²	67	105.8 Å²	105.8	33%	0.33	58%	0.581	S	S	.	*	S	Bend	trans	-134.6	152.6	-173.1	-59.6	175.5	71.1	0	0	112.1	V61 D99	M57-V61 HydrophobicContact CE-CB 4.27Å; M57-V61 HydrophobicContact CE-CG1 3.55Å; M57-D99 WeakPolarHBondContact CA-OD1 3.38Å
58	S	78.5	Confident	64.2	Low	38 Å²	38	100.5 Å²	100.5	27%	0.266	55%	0.552	S	S	.	*			trans	-62	137.4	170.3	168.5	0	0	0	0	111.7	R60 V61 Q62 D99	S58-R60 PolarHBondContact O-N 3.41Å; S58-R60 VanDerWaalsContact O-N 3.17Å; S58-V61 CarbonylContact O-C 3.59Å; S58-V61 WeakPolarHBondContact O-CA 3.44Å; S58-V61 PolarHBondContact O-N 2.96Å; S58-Q62 PolarHBondContact O-N 3.24Å; S58-D99 WeakPolarHBondContact CB-OD1 3.48Å; S58-D99 PolarHBondContact N-OD1 3.24Å
59	E	80.7	Confident	66.9	Low	164 Å²	164	98.4 Å²	98.4	77%	0.766	53%	0.534	S	S	*	.	H	α-helix	trans	-55.5	-35.6	-179	-173.6	179	-150.4	0	0	112.6	Q62 S63	E59-Q62 PolarHBondContact O-N 3.46Å; E59-S63 WeakPolarHBondContact O-CB 3.44Å; E59-S63 PolarHBondContact O-N 3.4Å
60	R	84	Confident	69.6	Low	155 Å²	155	94 Å²	94	59%	0.585	52%	0.521	S	S	*	.	H	α-helix	trans	-65	-42.4	174	-69.2	-175	-178.4	175	3.1	111.9	S58 S63 I64 Y102	S58-R60 PolarHBondContact O-N 3.41Å; S58-R60 VanDerWaalsContact O-N 3.17Å; R60-S63 PolarHBondContact O-N 2.95Å; R60-I64 WeakPolarHBondContact O-CD1 3.39Å; R60-I64 VanDerWaalsContact O-CG1 3.25Å; R60-I64 WeakPolarHBondContact O-CG1 3.36Å; R60-I64 PolarHBondContact O-N 3.11Å; R60-Y102 HydrophobicContact CB-CE2 4.21Å; R60-Y102 WeakPolarHBondContact CD-OH 3.39Å
61	V	88.5	Confident	72.4	Confident	0 Å²	0	94.1 Å²	94.1	0%	0	51%	0.509	C	S	.	.	H	α-helix	trans	-71.5	-37	178.6	-170.9	0	0	0	0	110.4	M57 S58 S63 I64 A65 L95 L98 D99 Y102	M57-V61 HydrophobicContact CE-CB 4.27Å; M57-V61 HydrophobicContact CE-CG1 3.55Å; S58-V61 CarbonylContact O-C 3.59Å; S58-V61 WeakPolarHBondContact O-CA 3.44Å; S58-V61 PolarHBondContact O-N 2.96Å; V61-S63 VanDerWaalsContact C-N 3.35Å; V61-S63 PolarHBondContact O-N 3.22Å; V61-I64 PolarHBondContact O-N 2.8Å; V61-A65 WeakPolarHBondContact O-CB 3.48Å; V61-A65 PolarHBondContact O-N 3.24Å; V61-L95 HydrophobicContact CG1-CB 4.18Å; V61-L95 HydrophobicContact CG1-CD2 3.74Å; V61-L98 HydrophobicContact CG2-CB 4.34Å; V61-D99 HydrophobicContact CG1-CB 4.3Å; V61-D99 HydrophobicContact CG2-CB 4.24Å; V61-Y102 HydrophobicContact CG2-CD2 3.45Å; V61-Y102 VanDerWaalsContact CG2-CD2 3.45Å; V61-Y102 HydrophobicContact CG2-CE2 3.86Å
62	Q	87.3	Confident	75.1	Confident	122 Å²	122	89.8 Å²	89.8	57%	0.57	48%	0.476	S	S	*	.	H	α-helix	trans	-62.1	-40.6	172.6	-170.1	178.8	10.3	0	0	112	S58 E59 S66	S58-Q62 PolarHBondContact O-N 3.24Å; E59-Q62 PolarHBondContact O-N 3.46Å; Q62-S66 WeakPolarHBondContact O-CB 3.45Å; Q62-S66 PolarHBondContact O-N 3.41Å
63	S	88.4	Confident	77.9	Confident	84 Å²	84	86.3 Å²	86.3	59%	0.587	46%	0.461	S	S	*	.	H	α-helix	trans	-64.2	-47.4	174.2	-173.9	0	0	0	0	112.1	E59 R60 V61 S66 G67	E59-S63 WeakPolarHBondContact O-CB 3.44Å; E59-S63 PolarHBondContact O-N 3.4Å; R60-S63 PolarHBondContact O-N 2.95Å; V61-S63 VanDerWaalsContact C-N 3.35Å; V61-S63 PolarHBondContact O-N 3.22Å; S63-S66 PolarHBondContact O-N 3.48Å; S63-G67 PolarHBondContact O-N 3.04Å
64	I	89.4	Confident	80.5	Confident	72 Å²	72	83.4 Å²	83.4	37%	0.369	44%	0.443	S	S	.	.	H	α-helix	trans	-61.3	-45.8	176.1	-67.9	163.5	0	0	0	110.7	R60 V61 S66 G67 I68 L95	R60-I64 WeakPolarHBondContact O-CD1 3.39Å; R60-I64 VanDerWaalsContact O-CG1 3.25Å; R60-I64 WeakPolarHBondContact O-CG1 3.36Å; R60-I64 PolarHBondContact O-N 3.11Å; V61-I64 PolarHBondContact O-N 2.8Å; I64-S66 PolarHBondContact O-N 3.32Å; I64-G67 PolarHBondContact O-N 2.67Å; I64-I68 HydrophobicContact CG2-CD1 3.7Å; I64-I68 HydrophobicContact CG2-CG1 4.43Å; I64-I68 WeakPolarHBondContact O-CG1 3.47Å; I64-I68 PolarHBondContact O-N 3.06Å; I64-L95 HydrophobicContact CG2-CD2 3.98Å
65	A	89.1	Confident	82.9	Confident	7 Å²	7	82.1 Å²	82.1	6%	0.058	43%	0.428	C	S	.	.	H	α-helix	trans	-59.7	-45.9	176.7	0	0	0	0	0	111.6	V61 G67 I68 Y69 L95	V61-A65 WeakPolarHBondContact O-CB 3.48Å; V61-A65 PolarHBondContact O-N 3.24Å; A65-G67 VanDerWaalsContact C-N 3.33Å; A65-G67 PolarHBondContact O-N 3.36Å; A65-I68 PolarHBondContact O-N 3.33Å; A65-Y69 HydrophobicContact CB-CD2 4.28Å; A65-Y69 HydrophobicContact CB-CE2 4.06Å; A65-Y69 WeakPolarHBondContact O-CB 3.31Å; A65-Y69 WeakPolarHBondContact O-CD2 3.39Å; A65-Y69 PolarHBondContact O-N 3.01Å; A65-L95 HydrophobicContact CB-CD1 3.74Å; A65-L95 HydrophobicContact CB-CD2 4.09Å
66	S	89.2	Confident	84.6	Confident	81 Å²	81	78.7 Å²	78.7	57%	0.566	41%	0.405	S	S	*	.	H	α-helix	trans	-59.5	-41.7	176.1	-178.5	0	0	0	0	112.2	Q62 S63 I64 K70	Q62-S66 WeakPolarHBondContact O-CB 3.45Å; Q62-S66 PolarHBondContact O-N 3.41Å; S63-S66 PolarHBondContact O-N 3.48Å; I64-S66 PolarHBondContact O-N 3.32Å; S66-K70 WeakPolarHBondContact O-CB 3.39Å; S66-K70 PolarHBondContact O-N 2.98Å; S66-K70 VanDerWaalsContact O-N 3.15Å
67	G	91.6	Very high	86.1	Confident	37 Å²	37	82 Å²	82	38%	0.381	41%	0.413	S	S	.	.	H	α-helix	trans	-61	-48.1	173.1	0	0	0	0	0	112.7	S63 I64 A65 K70 E71	S63-G67 PolarHBondContact O-N 3.04Å; I64-G67 PolarHBondContact O-N 2.67Å; A65-G67 VanDerWaalsContact C-N 3.33Å; A65-G67 PolarHBondContact O-N 3.36Å; G67-K70 PolarHBondContact O-N 3.34Å; G67-E71 PolarHBondContact O-N 3Å; G67-E71 VanDerWaalsContact O-N 3.11Å
68	I	89.1	Confident	87.2	Confident	41 Å²	41	81.9 Å²	81.9	21%	0.21	42%	0.424	C	S	.	.	H	α-helix	trans	-67.9	-40.7	-178.8	-62.1	164.8	0	0	0	111.9	I64 A65 K70 E71 F72 I91 L95	I64-I68 HydrophobicContact CG2-CD1 3.7Å; I64-I68 HydrophobicContact CG2-CG1 4.43Å; I64-I68 WeakPolarHBondContact O-CG1 3.47Å; I64-I68 PolarHBondContact O-N 3.06Å; A65-I68 PolarHBondContact O-N 3.33Å; I68-K70 VanDerWaalsContact C-N 3.26Å; I68-K70 PolarHBondContact O-N 3.03Å; I68-E71 PolarHBondContact O-N 2.92Å; I68-F72 HydrophobicContact CG2-CD1 4.34Å; I68-F72 HydrophobicContact CG2-CD2 4.49Å; I68-F72 HydrophobicContact CG2-CE1 4.09Å; I68-F72 HydrophobicContact CG2-CE2 4.25Å; I68-F72 HydrophobicContact CG2-CZ 4.06Å; I68-F72 PolarHBondContact O-N 3.03Å; I68-I91 HydrophobicContact CD1-CG2 4.16Å; I68-I91 HydrophobicContact CG2-CD1 3.69Å; I68-I91 HydrophobicContact CG2-CG2 3.78Å; I68-L95 HydrophobicContact CD1-CD2 4.45Å
69	Y	88.6	Confident	87.6	Confident	105 Å²	105	88.7 Å²	88.7	41%	0.412	45%	0.445	S	S	.	.	H	α-helix	trans	-62.8	-33.6	175.9	-73.6	-53.8	0	0	0	112.3	A65 F72 E73 M88	A65-Y69 HydrophobicContact CB-CD2 4.28Å; A65-Y69 HydrophobicContact CB-CE2 4.06Å; A65-Y69 WeakPolarHBondContact O-CB 3.31Å; A65-Y69 WeakPolarHBondContact O-CD2 3.39Å; A65-Y69 PolarHBondContact O-N 3.01Å; Y69-F72 HydrophobicContact CD1-CD2 4.18Å; Y69-F72 WeakPolarHBondContact O-CB 3.47Å; Y69-F72 PolarHBondContact O-N 3.39Å; Y69-E73 PolarHBondContact O-N 3.05Å; Y69-M88 HydrophobicContact CE1-CE 4.44Å
70	K	90.4	Very high	87.7	Confident	135 Å²	135	82.1 Å²	82.1	59%	0.587	42%	0.421	S	S	*	.	H	α-helix	trans	-69.5	-38.5	174.1	-170.5	178.2	179.8	-177.7	0	112.8	S66 G67 I68 F72 E73 T74	S66-K70 WeakPolarHBondContact O-CB 3.39Å; S66-K70 PolarHBondContact O-N 2.98Å; S66-K70 VanDerWaalsContact O-N 3.15Å; G67-K70 PolarHBondContact O-N 3.34Å; I68-K70 VanDerWaalsContact C-N 3.26Å; I68-K70 PolarHBondContact O-N 3.03Å; K70-F72 VanDerWaalsContact C-N 3.33Å; K70-E73 WeakPolarHBondContact O-CB 3.49Å; K70-E73 PolarHBondContact O-N 3.29Å; K70-T74 PolarHBondContact O-N 3.08Å; K70-T74 VanDerWaalsContact O-N 3.16Å
71	E	88.9	Confident	87.6	Confident	123 Å²	123	79.4 Å²	79.4	58%	0.575	42%	0.418	S	S	*	.	H	α-helix	trans	-71.2	-27.9	172.4	-65.5	-59.7	138.6	0	0	112.4	G67 I68 T74 M75	G67-E71 PolarHBondContact O-N 3Å; G67-E71 VanDerWaalsContact O-N 3.11Å; I68-E71 PolarHBondContact O-N 2.92Å; E71-T74 PolarHBondContact O-OG1 3.46Å; E71-T74 VanDerWaalsContact O-OG1 3.06Å; E71-M75 VanDerWaalsContact O-CB 3.23Å; E71-M75 WeakPolarHBondContact O-CB 3.39Å; E71-M75 PolarHBondContact O-N 2.7Å
72	F	89.2	Confident	87.3	Confident	13 Å²	13	83.8 Å²	83.8	6%	0.057	45%	0.447	C	S	.	.	H	α-helix	trans	-67.8	-40	168	-76.6	-7	0	0	0	111.9	I68 Y69 K70 M75 I76 V84 L87 M88 I91	I68-F72 HydrophobicContact CG2-CD1 4.34Å; I68-F72 HydrophobicContact CG2-CD2 4.49Å; I68-F72 HydrophobicContact CG2-CE1 4.09Å; I68-F72 HydrophobicContact CG2-CE2 4.25Å; I68-F72 HydrophobicContact CG2-CZ 4.06Å; I68-F72 PolarHBondContact O-N 3.03Å; Y69-F72 HydrophobicContact CD1-CD2 4.18Å; Y69-F72 WeakPolarHBondContact O-CB 3.47Å; Y69-F72 PolarHBondContact O-N 3.39Å; K70-F72 VanDerWaalsContact C-N 3.33Å; F72-M75 PolarHBondContact O-N 3.47Å; F72-I76 WeakPolarHBondContact O-CB 3.27Å; F72-I76 WeakPolarHBondContact O-CD1 2.99Å; F72-I76 WeakPolarHBondContact O-CG1 3.44Å; F72-I76 PolarHBondContact O-N 2.76Å; F72-V84 HydrophobicContact CB-CG1 4.24Å; F72-V84 HydrophobicContact CD1-CG1 4Å; F72-V84 HydrophobicContact CD1-CG2 4.31Å; F72-V84 HydrophobicContact CD2-CG1 3.66Å; F72-V84 HydrophobicContact CE1-CG1 4.16Å; F72-V84 HydrophobicContact CE2-CG1 3.85Å; F72-V84 HydrophobicContact CG-CG1 3.72Å; F72-V84 HydrophobicContact CG-CG2 4.47Å; F72-V84 HydrophobicContact CZ-CG1 4.07Å; F72-L87 HydrophobicContact CE1-CD2 3.74Å; F72-L87 HydrophobicContact CE1-CG 4.02Å; F72-L87 HydrophobicContact CZ-CD2 4.23Å; F72-L87 HydrophobicContact CZ-CG 3.98Å; F72-M88 HydrophobicContact CE2-CB 4.04Å; F72-M88 HydrophobicContact CE2-CG 4.34Å; F72-I91 HydrophobicContact CE1-CD1 3.98Å; F72-I91 HydrophobicContact CE2-CG2 4.5Å; F72-I91 HydrophobicContact CZ-CB 4.17Å; F72-I91 HydrophobicContact CZ-CD1 3.63Å; F72-I91 HydrophobicContact CZ-CG1 4.04Å; F72-I91 HydrophobicContact CZ-CG2 4.38Å
73	E	87.4	Confident	87	Confident	126 Å²	126	81.5 Å²	81.5	59%	0.589	44%	0.44	S	S	*	.	H	α-helix	trans	-58.5	-50.9	176.1	-168.7	169.3	-139.9	0	0	110.9	Y69 K70 M75 I76 E77	Y69-E73 PolarHBondContact O-N 3.05Å; K70-E73 WeakPolarHBondContact O-CB 3.49Å; K70-E73 PolarHBondContact O-N 3.29Å; E73-M75 VanDerWaalsContact C-N 3.33Å; E73-M75 PolarHBondContact O-N 3.42Å; E73-I76 PolarHBondContact O-N 2.68Å; E73-E77 WeakPolarHBondContact O-CG 3.08Å; E73-E77 PolarHBondContact O-N 3.39Å
74	T	88.3	Confident	86.9	Confident	60 Å²	60	77.7 Å²	77.7	37%	0.368	41%	0.414	S	S	.	.	H	α-helix	trans	-64.8	-33.6	176.3	61.2	0	0	0	0	113.1	K70 E71 E77 A78	K70-T74 PolarHBondContact O-N 3.08Å; K70-T74 VanDerWaalsContact O-N 3.16Å; E71-T74 PolarHBondContact O-OG1 3.46Å; E71-T74 VanDerWaalsContact O-OG1 3.06Å; T74-E77 PolarHBondContact O-N 2.88Å; T74-A78 WeakPolarHBondContact O-CB 3.3Å; T74-A78 PolarHBondContact O-N 2.95Å
75	M	84.8	Confident	86.5	Confident	62 Å²	62	80 Å²	80	31%	0.305	42%	0.423	S	S	.	.	H	α-helix	trans	-70.4	-36	176	-170.3	176.7	-61.9	0	0	112.6	E71 F72 E73 A78 Y79 V83 V84	E71-M75 VanDerWaalsContact O-CB 3.23Å; E71-M75 WeakPolarHBondContact O-CB 3.39Å; E71-M75 PolarHBondContact O-N 2.7Å; F72-M75 PolarHBondContact O-N 3.47Å; E73-M75 VanDerWaalsContact C-N 3.33Å; E73-M75 PolarHBondContact O-N 3.42Å; M75-A78 PolarHBondContact O-N 3.36Å; M75-Y79 HydrophobicContact CG-CD2 4.17Å; M75-Y79 PolarHBondContact O-N 2.9Å; M75-V83 HydrophobicContact CG-CG1 4.25Å; M75-V83 HydrophobicContact SD-CG1 3.72Å; M75-V84 HydrophobicContact CB-CG2 4.42Å; M75-V84 HydrophobicContact CG-CG2 4.26Å; M75-V84 HydrophobicContact SD-CG2 4.04Å
76	I	86.3	Confident	86.3	Confident	65 Å²	65	90.2 Å²	90.2	33%	0.333	46%	0.46	S	S	.	.	H	α-helix	trans	-68.4	-40.2	174.3	-69.4	163.2	0	0	0	110.3	F72 E73 G80 L81 V84	F72-I76 WeakPolarHBondContact O-CB 3.27Å; F72-I76 WeakPolarHBondContact O-CD1 2.99Å; F72-I76 WeakPolarHBondContact O-CG1 3.44Å; F72-I76 PolarHBondContact O-N 2.76Å; E73-I76 PolarHBondContact O-N 2.68Å; I76-G80 WeakPolarHBondContact O-CA 3.46Å; I76-G80 PolarHBondContact O-N 3.08Å; I76-L81 HydrophobicContact CD1-CD1 3.94Å; I76-L81 HydrophobicContact CG1-CD1 4.23Å; I76-L81 HydrophobicContact CG2-CD1 4.45Å; I76-V84 HydrophobicContact CD1-CB 4.49Å; I76-V84 HydrophobicContact CD1-CG2 4.36Å; I76-V84 HydrophobicContact CG1-CB 4.34Å; I76-V84 HydrophobicContact CG1-CG2 3.86Å
77	E	86.2	Confident	86.1	Confident	164 Å²	164	89.6 Å²	89.6	77%	0.766	45%	0.45	S	S	*	.	H	α-helix	trans	-61.6	-42.4	172.2	-71.6	-172.9	149.7	0	0	112.5	E73 T74	E73-E77 WeakPolarHBondContact O-CG 3.08Å; E73-E77 PolarHBondContact O-N 3.39Å; T74-E77 PolarHBondContact O-N 2.88Å
78	A	86.3	Confident	85.9	Confident	66 Å²	66	91.8 Å²	91.8	55%	0.545	45%	0.451	S	S	.	.	H	α-helix	trans	-81.2	-34.7	-173.7	0	0	0	0	0	114.7	T74 M75	T74-A78 WeakPolarHBondContact O-CB 3.3Å; T74-A78 PolarHBondContact O-N 2.95Å; M75-A78 PolarHBondContact O-N 3.36Å
79	Y	85.9	Confident	85.9	Confident	180 Å²	180	93.5 Å²	93.5	71%	0.706	47%	0.465	S	S	*	.	H	α-helix	trans	-131.1	-6.4	-171.1	-57	-77.7	0	0	0	114.9	M75	M75-Y79 HydrophobicContact CG-CD2 4.17Å; M75-Y79 PolarHBondContact O-N 2.9Å
80	G	82.3	Confident	85.9	Confident	27 Å²	27	94.4 Å²	94.4	28%	0.278	48%	0.476	S	S	.	.			trans	83.5	160.6	-178.6	0	0	0	0	0	114.7	I76 V83	I76-G80 WeakPolarHBondContact O-CA 3.46Å; I76-G80 PolarHBondContact O-N 3.08Å; G80-V83 PolarHBondContact O-N 3.11Å
81	L	83	Confident	86	Confident	97 Å²	97	89.3 Å²	89.3	51%	0.508	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-50.6	-40.3	-173.3	-163.6	69.3	0	0	0	116.5	I76 V83 V84 E85	I76-L81 HydrophobicContact CD1-CD1 3.94Å; I76-L81 HydrophobicContact CG1-CD1 4.23Å; I76-L81 HydrophobicContact CG2-CD1 4.45Å; L81-V83 PolarHBondContact O-N 3.23Å; L81-V84 PolarHBondContact O-N 2.86Å; L81-E85 HydrophobicContact CG-CG 4.35Å; L81-E85 PolarHBondContact O-N 3.5Å
82	P	82.5	Confident	85.9	Confident	93 Å²	93	86 Å²	86	60%	0.604	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-61.5	-15.9	-172.6	-26.4	36.4	0	0	0	115.8
83	V	80.8	Confident	86	Confident	73 Å²	73	87.8 Å²	87.8	44%	0.442	46%	0.455	S	S	.	.	G	3₁₀ helix	trans	-71.3	-36	175.3	-175.6	0	0	0	0	111.3	M75 G80 L81	M75-V83 HydrophobicContact CG-CG1 4.25Å; M75-V83 HydrophobicContact SD-CG1 3.72Å; G80-V83 PolarHBondContact O-N 3.11Å; L81-V83 PolarHBondContact O-N 3.23Å
84	V	84.8	Confident	86.3	Confident	5 Å²	5	86.3 Å²	86.3	3%	0.03	45%	0.451	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	-26.3	-171.9	179.6	0	0	0	0	112.7	F72 M75 I76 L81 R86 L87 M88	F72-V84 HydrophobicContact CB-CG1 4.24Å; F72-V84 HydrophobicContact CD1-CG1 4Å; F72-V84 HydrophobicContact CD1-CG2 4.31Å; F72-V84 HydrophobicContact CD2-CG1 3.66Å; F72-V84 HydrophobicContact CE1-CG1 4.16Å; F72-V84 HydrophobicContact CE2-CG1 3.85Å; F72-V84 HydrophobicContact CG-CG1 3.72Å; F72-V84 HydrophobicContact CG-CG2 4.47Å; F72-V84 HydrophobicContact CZ-CG1 4.07Å; M75-V84 HydrophobicContact CB-CG2 4.42Å; M75-V84 HydrophobicContact CG-CG2 4.26Å; M75-V84 HydrophobicContact SD-CG2 4.04Å; I76-V84 HydrophobicContact CD1-CB 4.49Å; I76-V84 HydrophobicContact CD1-CG2 4.36Å; I76-V84 HydrophobicContact CG1-CB 4.34Å; I76-V84 HydrophobicContact CG1-CG2 3.86Å; L81-V84 PolarHBondContact O-N 2.86Å; V84-R86 PolarHBondContact O-N 3.02Å; V84-L87 PolarHBondContact O-N 3.25Å; V84-M88 HydrophobicContact CG1-CB 4.19Å; V84-M88 PolarHBondContact O-N 2.96Å
85	E	82.5	Confident	86.4	Confident	120 Å²	120	83.8 Å²	83.8	56%	0.561	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.3	-37.6	-177.7	-69.6	-179	167.4	0	0	114.4	L81 P89	L81-E85 HydrophobicContact CG-CG 4.35Å; L81-E85 PolarHBondContact O-N 3.5Å; E85-P89 WeakPolarHBondContact O-CD 3.29Å
86	R	83.5	Confident	86.7	Confident	222 Å²	222	86.5 Å²	86.5	84%	0.838	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.4	-18.1	179.4	-63.9	-175.2	-180	-168.3	-0.3	114	V84	V84-R86 PolarHBondContact O-N 3.02Å
87	L	86.6	Confident	86.9	Confident	67 Å²	67	87.2 Å²	87.2	35%	0.351	45%	0.451	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-36.3	-175.2	-176.3	56.8	0	0	0	111.6	F72 V84 L90 I91	F72-L87 HydrophobicContact CE1-CD2 3.74Å; F72-L87 HydrophobicContact CE1-CG 4.02Å; F72-L87 HydrophobicContact CZ-CD2 4.23Å; F72-L87 HydrophobicContact CZ-CG 3.98Å; V84-L87 PolarHBondContact O-N 3.25Å; L87-L90 WeakPolarHBondContact O-CB 3.36Å; L87-L90 PolarHBondContact O-N 3.04Å; L87-L90 VanDerWaalsContact O-N 3.14Å; L87-I91 HydrophobicContact CD1-CD1 4.35Å; L87-I91 HydrophobicContact CD1-CG1 4.14Å; L87-I91 HydrophobicContact CG-CD1 4.25Å; L87-I91 HydrophobicContact CG-CG1 4.23Å; L87-I91 PolarHBondContact O-N 2.84Å
88	M	86.4	Confident	87.2	Confident	83 Å²	83	81.9 Å²	81.9	41%	0.409	43%	0.428	S	S	.	.	H	α-helix	trans	-55.3	-44.8	-178.8	179.7	174.9	178.6	0	0	113.9	Y69 F72 V84 L90 I91 I92	Y69-M88 HydrophobicContact CE1-CE 4.44Å; F72-M88 HydrophobicContact CE2-CB 4.04Å; F72-M88 HydrophobicContact CE2-CG 4.34Å; V84-M88 HydrophobicContact CG1-CB 4.19Å; V84-M88 PolarHBondContact O-N 2.96Å; M88-L90 VanDerWaalsContact C-N 3.33Å; M88-L90 PolarHBondContact O-N 2.76Å; M88-I91 PolarHBondContact O-N 3.28Å; M88-I92 HydrophobicContact CE-CD1 3.95Å; M88-I92 HydrophobicContact CG-CD1 3.8Å; M88-I92 HydrophobicContact CG-CG1 4.43Å; M88-I92 WeakPolarHBondContact O-CG1 3.38Å; M88-I92 PolarHBondContact O-N 3.05Å
89	P	88.4	Confident	87.5	Confident	77 Å²	77	79.2 Å²	79.2	50%	0.5	41%	0.405	S	S	.	.	H	α-helix	trans	-65	-34.3	177.6	-22.3	34.8	0	0	0	113.6	E85 S93	E85-P89 WeakPolarHBondContact O-CD 3.29Å; P89-S93 PolarHBondContact O-N 3.41Å
90	L	90	Very high	87.6	Confident	124 Å²	124	76.6 Å²	76.6	65%	0.649	40%	0.399	S	S	*	.	H	α-helix	trans	-69.1	-37.6	176.8	-62.5	173.4	0	0	0	111.3	L87 M88 L94	L87-L90 WeakPolarHBondContact O-CB 3.36Å; L87-L90 PolarHBondContact O-N 3.04Å; L87-L90 VanDerWaalsContact O-N 3.14Å; M88-L90 VanDerWaalsContact C-N 3.33Å; M88-L90 PolarHBondContact O-N 2.76Å; L90-L94 WeakPolarHBondContact O-CB 3.39Å; L90-L94 PolarHBondContact O-N 3.11Å
91	I	91.2	Very high	88	Confident	28 Å²	28	80.7 Å²	80.7	14%	0.144	41%	0.414	C	S	.	.	H	α-helix	trans	-73.4	-37.3	176.3	-68.7	-148.8	0	0	0	111.8	I68 F72 L87 M88 L94 L95	I68-I91 HydrophobicContact CD1-CG2 4.16Å; I68-I91 HydrophobicContact CG2-CD1 3.69Å; I68-I91 HydrophobicContact CG2-CG2 3.78Å; F72-I91 HydrophobicContact CE1-CD1 3.98Å; F72-I91 HydrophobicContact CE2-CG2 4.5Å; F72-I91 HydrophobicContact CZ-CB 4.17Å; F72-I91 HydrophobicContact CZ-CD1 3.63Å; F72-I91 HydrophobicContact CZ-CG1 4.04Å; F72-I91 HydrophobicContact CZ-CG2 4.38Å; L87-I91 HydrophobicContact CD1-CD1 4.35Å; L87-I91 HydrophobicContact CD1-CG1 4.14Å; L87-I91 HydrophobicContact CG-CD1 4.25Å; L87-I91 HydrophobicContact CG-CG1 4.23Å; L87-I91 PolarHBondContact O-N 2.84Å; M88-I91 PolarHBondContact O-N 3.28Å; I91-L94 PolarHBondContact O-N 3.46Å; I91-L95 HydrophobicContact CG2-CD1 3.95Å; I91-L95 HydrophobicContact CG2-CG 4.39Å; I91-L95 WeakPolarHBondContact O-CB 3.26Å; I91-L95 VanDerWaalsContact O-CG 3.28Å; I91-L95 WeakPolarHBondContact O-CG 3.35Å; I91-L95 PolarHBondContact O-N 3.37Å
92	I	88.7	Confident	88.3	Confident	53 Å²	53	79 Å²	79	27%	0.272	40%	0.401	S	S	.	.	H	α-helix	trans	-60.2	-51.2	172.7	-70.8	165.5	0	0	0	109.9	M88 L94 L95 E96	M88-I92 HydrophobicContact CE-CD1 3.95Å; M88-I92 HydrophobicContact CG-CD1 3.8Å; M88-I92 HydrophobicContact CG-CG1 4.43Å; M88-I92 WeakPolarHBondContact O-CG1 3.38Å; M88-I92 PolarHBondContact O-N 3.05Å; I92-L94 VanDerWaalsContact C-N 3.28Å; I92-L94 PolarHBondContact O-N 3.1Å; I92-L95 PolarHBondContact O-N 3.38Å; I92-E96 HydrophobicContact CG2-CG 4.31Å; I92-E96 WeakPolarHBondContact O-CG 3.42Å; I92-E96 PolarHBondContact O-N 3.29Å
93	S	90.4	Very high	88.5	Confident	52 Å²	52	79.8 Å²	79.8	36%	0.364	40%	0.395	S	S	.	.	H	α-helix	trans	-60.7	-35.4	176.7	-178.9	0	0	0	0	112.9	P89 E96 N97	P89-S93 PolarHBondContact O-N 3.41Å; S93-E96 WeakPolarHBondContact CA-OE2 3.45Å; S93-N97 WeakPolarHBondContact O-CB 3.47Å; S93-N97 PolarHBondContact O-N 2.97Å; S93-N97 PolarHBondContact O-ND2 3.23Å
94	L	92.8	Very high	88.9	Confident	94 Å²	94	80 Å²	80	49%	0.492	39%	0.394	S	S	.	.	H	α-helix	trans	-65.9	-40.4	173.2	-178.7	62.3	0	0	0	112.4	L90 I91 I92 L98	L90-L94 WeakPolarHBondContact O-CB 3.39Å; L90-L94 PolarHBondContact O-N 3.11Å; I91-L94 PolarHBondContact O-N 3.46Å; I92-L94 VanDerWaalsContact C-N 3.28Å; I92-L94 PolarHBondContact O-N 3.1Å; L94-L98 HydrophobicContact CD1-CD1 4.42Å; L94-L98 HydrophobicContact CG-CD1 4.14Å; L94-L98 WeakPolarHBondContact O-CB 3.28Å; L94-L98 WeakPolarHBondContact O-CG 3.39Å; L94-L98 PolarHBondContact O-N 2.99Å
95	L	91.7	Very high	89	Confident	7 Å²	7	85.5 Å²	85.5	4%	0.037	42%	0.419	C	S	.	.	H	α-helix	trans	-69.8	-38.4	177	-70.5	167.4	0	0	0	111.9	V61 I64 A65 I68 I91 I92 L98 D99	V61-L95 HydrophobicContact CG1-CB 4.18Å; V61-L95 HydrophobicContact CG1-CD2 3.74Å; I64-L95 HydrophobicContact CG2-CD2 3.98Å; A65-L95 HydrophobicContact CB-CD1 3.74Å; A65-L95 HydrophobicContact CB-CD2 4.09Å; I68-L95 HydrophobicContact CD1-CD2 4.45Å; I91-L95 HydrophobicContact CG2-CD1 3.95Å; I91-L95 HydrophobicContact CG2-CG 4.39Å; I91-L95 WeakPolarHBondContact O-CB 3.26Å; I91-L95 VanDerWaalsContact O-CG 3.28Å; I91-L95 WeakPolarHBondContact O-CG 3.35Å; I91-L95 PolarHBondContact O-N 3.37Å; I92-L95 PolarHBondContact O-N 3.38Å; L95-L98 PolarHBondContact O-N 3.49Å; L95-D99 WeakPolarHBondContact O-CB 3.21Å; L95-D99 PolarHBondContact O-N 2.85Å
96	E	90.8	Very high	89.2	Confident	120 Å²	120	83.7 Å²	83.7	56%	0.561	42%	0.42	S	S	*	.	H	α-helix	trans	-60.9	-50.9	173	-70.9	168.9	155.4	0	0	110.8	I92 S93 L98 D99 E100	I92-E96 HydrophobicContact CG2-CG 4.31Å; I92-E96 WeakPolarHBondContact O-CG 3.42Å; I92-E96 PolarHBondContact O-N 3.29Å; S93-E96 WeakPolarHBondContact CA-OE2 3.45Å; E96-L98 VanDerWaalsContact C-N 3.32Å; E96-L98 PolarHBondContact O-N 3.5Å; E96-D99 PolarHBondContact O-N 2.85Å; E96-D99 VanDerWaalsContact O-N 3.16Å; E96-E100 PolarHBondContact O-N 2.89Å
97	N	91.2	Very high	89.4	Confident	79 Å²	79	75.9 Å²	75.9	42%	0.422	40%	0.403	S	S	.	.	H	α-helix	trans	-61.4	-37.2	176.3	-67	-26.1	0	0	0	112.5	S93 L101	S93-N97 WeakPolarHBondContact O-CB 3.47Å; S93-N97 PolarHBondContact O-N 2.97Å; S93-N97 PolarHBondContact O-ND2 3.23Å; N97-L101 WeakPolarHBondContact O-CB 3.31Å; N97-L101 VanDerWaalsContact O-CG 3.25Å; N97-L101 WeakPolarHBondContact O-CG 3.49Å; N97-L101 PolarHBondContact O-N 3.35Å
98	L	91.7	Very high	89.5	Confident	53 Å²	53	79.6 Å²	79.6	28%	0.277	41%	0.413	S	S	.	.	H	α-helix	trans	-68	-37.1	175.7	-78.7	169	0	0	0	112.1	V61 L94 L95 E96 L101 Y102	V61-L98 HydrophobicContact CG2-CB 4.34Å; L94-L98 HydrophobicContact CD1-CD1 4.42Å; L94-L98 HydrophobicContact CG-CD1 4.14Å; L94-L98 WeakPolarHBondContact O-CB 3.28Å; L94-L98 WeakPolarHBondContact O-CG 3.39Å; L94-L98 PolarHBondContact O-N 2.99Å; L95-L98 PolarHBondContact O-N 3.49Å; E96-L98 VanDerWaalsContact C-N 3.32Å; E96-L98 PolarHBondContact O-N 3.5Å; L98-L101 PolarHBondContact O-N 3.43Å; L98-Y102 WeakPolarHBondContact O-CD2 3.45Å; L98-Y102 PolarHBondContact O-N 3.24Å
99	D	91.5	Very high	89.6	Confident	10 Å²	10	81.1 Å²	81.1	5%	0.053	42%	0.419	C	S	.	.	H	α-helix	trans	-71.4	-38.2	178.2	-164.2	59.4	0	0	0	112.3	M57 S58 V61 L95 E96 Y102 K103	M57-D99 WeakPolarHBondContact CA-OD1 3.38Å; S58-D99 WeakPolarHBondContact CB-OD1 3.48Å; S58-D99 PolarHBondContact N-OD1 3.24Å; V61-D99 HydrophobicContact CG1-CB 4.3Å; V61-D99 HydrophobicContact CG2-CB 4.24Å; L95-D99 WeakPolarHBondContact O-CB 3.21Å; L95-D99 PolarHBondContact O-N 2.85Å; E96-D99 PolarHBondContact O-N 2.85Å; E96-D99 VanDerWaalsContact O-N 3.16Å; D99-Y102 PolarHBondContact O-N 3.15Å; D99-K103 WeakPolarHBondContact O-CD 3.41Å; D99-K103 WeakPolarHBondContact O-CG 3.15Å; D99-K103 PolarHBondContact O-N 3.43Å; D99-K103 VanDerWaalsContact OD2-CE 3.24Å; D99-K103 WeakPolarHBondContact OD2-CE 3.49Å; D99-K103 IonicContact OD2-NZ 2.61Å; D99-K103 PolarHBondContact OD2-NZ 2.78Å
100	E	89.4	Confident	89.7	Confident	124 Å²	124	80 Å²	80	58%	0.579	42%	0.416	S	S	*	.	H	α-helix	trans	-61.4	-47	170	-168.6	166.2	-133.6	0	0	111.1	E96 Y102 K103 D104	E96-E100 PolarHBondContact O-N 2.89Å; E100-Y102 VanDerWaalsContact C-N 3.32Å; E100-Y102 PolarHBondContact O-N 3.36Å; E100-K103 WeakPolarHBondContact O-CB 3.46Å; E100-K103 PolarHBondContact O-N 3.2Å; E100-K103 VanDerWaalsContact O-N 3.12Å; E100-D104 PolarHBondContact O-N 3.5Å
101	L	90.1	Very high	89.7	Confident	113 Å²	113	79.1 Å²	79.1	59%	0.592	41%	0.409	S	S	*	.	H	α-helix	trans	-60.3	-35.8	174.6	-75.3	169.1	0	0	0	113.6	N97 L98 Q105	N97-L101 WeakPolarHBondContact O-CB 3.31Å; N97-L101 VanDerWaalsContact O-CG 3.25Å; N97-L101 WeakPolarHBondContact O-CG 3.49Å; N97-L101 PolarHBondContact O-N 3.35Å; L98-L101 PolarHBondContact O-N 3.43Å; L101-Q105 WeakPolarHBondContact O-CB 3.47Å; L101-Q105 PolarHBondContact O-N 2.8Å
102	Y	89.7	Confident	89.6	Confident	61 Å²	61	81.1 Å²	81.1	24%	0.239	42%	0.422	C	S	.	.	H	α-helix	trans	-72.7	-33.9	174.5	-86.6	-61.8	0	0	0	112.9	R60 V61 L98 D99 E100 S106	R60-Y102 HydrophobicContact CB-CE2 4.21Å; R60-Y102 WeakPolarHBondContact CD-OH 3.39Å; V61-Y102 HydrophobicContact CG2-CD2 3.45Å; V61-Y102 VanDerWaalsContact CG2-CD2 3.45Å; V61-Y102 HydrophobicContact CG2-CE2 3.86Å; L98-Y102 WeakPolarHBondContact O-CD2 3.45Å; L98-Y102 PolarHBondContact O-N 3.24Å; D99-Y102 PolarHBondContact O-N 3.15Å; E100-Y102 VanDerWaalsContact C-N 3.32Å; E100-Y102 PolarHBondContact O-N 3.36Å; Y102-S106 WeakPolarHBondContact O-CB 3.26Å; Y102-S106 PolarHBondContact O-N 3.38Å; Y102-S106 VanDerWaalsContact O-N 3.09Å
103	K	87	Confident	89.4	Confident	111 Å²	111	84.7 Å²	84.7	48%	0.483	43%	0.432	S	S	.	.	H	α-helix	trans	-65	-47.1	172.8	-76.2	161.3	174.5	162.2	0	110.6	V56 D99 E100 S106 A107	V56-K103 PolarHBondContact O-NZ 3.04Å; D99-K103 WeakPolarHBondContact O-CD 3.41Å; D99-K103 WeakPolarHBondContact O-CG 3.15Å; D99-K103 PolarHBondContact O-N 3.43Å; D99-K103 VanDerWaalsContact OD2-CE 3.24Å; D99-K103 WeakPolarHBondContact OD2-CE 3.49Å; D99-K103 IonicContact OD2-NZ 2.61Å; D99-K103 PolarHBondContact OD2-NZ 2.78Å; E100-K103 WeakPolarHBondContact O-CB 3.46Å; E100-K103 PolarHBondContact O-N 3.2Å; E100-K103 VanDerWaalsContact O-N 3.12Å; K103-S106 WeakPolarHBondContact O-CB 3.42Å; K103-S106 PolarHBondContact O-N 3.28Å; K103-A107 PolarHBondContact O-N 3.42Å
104	D	87.9	Confident	89.4	Confident	78 Å²	78	87.4 Å²	87.4	42%	0.417	44%	0.439	S	S	.	.	H	α-helix	trans	-58.7	-48	173.2	-89.1	14.5	0	0	0	112	E100 S106 A107 Y108	E100-D104 PolarHBondContact O-N 3.5Å; D104-S106 VanDerWaalsContact C-N 3.26Å; D104-S106 PolarHBondContact O-N 2.93Å; D104-A107 PolarHBondContact O-N 2.78Å; D104-A107 VanDerWaalsContact O-N 3.13Å; D104-Y108 HydrophobicContact CB-CD2 4.39Å; D104-Y108 HydrophobicContact CB-CE2 4.15Å; D104-Y108 WeakPolarHBondContact O-CD2 3.34Å; D104-Y108 PolarHBondContact O-N 3.43Å
105	Q	88.6	Confident	89.1	Confident	119 Å²	119	86.5 Å²	86.5	56%	0.556	43%	0.434	S	S	*	.	H	α-helix	trans	-57.4	-40.4	177.8	-173.8	-179.3	15	0	0	112.1	L101 H109	L101-Q105 WeakPolarHBondContact O-CB 3.47Å; L101-Q105 PolarHBondContact O-N 2.8Å; Q105-H109 PolarHBondContact O-N 2.76Å; Q105-H109 VanDerWaalsContact O-N 3.12Å
106	S	85.2	Confident	89	Confident	83 Å²	83	93.8 Å²	93.8	58%	0.58	46%	0.461	S	S	*	.	H	α-helix	trans	-66.3	-43.5	176.4	-166.4	0	0	0	0	111.8	Y102 K103 D104 H109 A110	Y102-S106 WeakPolarHBondContact O-CB 3.26Å; Y102-S106 PolarHBondContact O-N 3.38Å; Y102-S106 VanDerWaalsContact O-N 3.09Å; K103-S106 WeakPolarHBondContact O-CB 3.42Å; K103-S106 PolarHBondContact O-N 3.28Å; D104-S106 VanDerWaalsContact C-N 3.26Å; D104-S106 PolarHBondContact O-N 2.93Å; S106-H109 PolarHBondContact O-N 3.49Å; S106-A110 PolarHBondContact O-N 3.26Å
107	A	87.8	Confident	89	Confident	58 Å²	58	93.5 Å²	93.5	48%	0.479	46%	0.46	S	S	.	.	H	α-helix	trans	-62	-47.9	176.4	0	0	0	0	0	112.5	K103 D104 H109 A110 E111	K103-A107 PolarHBondContact O-N 3.42Å; D104-A107 PolarHBondContact O-N 2.78Å; D104-A107 VanDerWaalsContact O-N 3.13Å; A107-H109 VanDerWaalsContact C-N 3.29Å; A107-H109 PolarHBondContact O-N 3.03Å; A107-A110 WeakPolarHBondContact O-CB 3.48Å; A107-A110 PolarHBondContact O-N 3.27Å; A107-A110 VanDerWaalsContact O-N 3.1Å; A107-E111 PolarHBondContact O-N 3.15Å
108	Y	90.3	Very high	88.8	Confident	145 Å²	145	94 Å²	94	57%	0.569	46%	0.46	S	S	*	.	H	α-helix	trans	-61	-36.7	175.8	-72.6	-61.8	0	0	0	112.3	D104 V112	D104-Y108 HydrophobicContact CB-CD2 4.39Å; D104-Y108 HydrophobicContact CB-CE2 4.15Å; D104-Y108 WeakPolarHBondContact O-CD2 3.34Å; D104-Y108 PolarHBondContact O-N 3.43Å; Y108-V112 WeakPolarHBondContact O-CB 3.4Å; Y108-V112 VanDerWaalsContact O-CG2 3.27Å; Y108-V112 WeakPolarHBondContact O-CG2 3.27Å; Y108-V112 PolarHBondContact O-N 3.23Å
109	H	88	Confident	88.4	Confident	115 Å²	115	96.6 Å²	96.6	53%	0.532	47%	0.474	S	S	.	.	H	α-helix	trans	-69.2	-34.3	175.4	-164.7	-38	0	0	0	112.1	Q105 S106 A107 R113	Q105-H109 PolarHBondContact O-N 2.76Å; Q105-H109 VanDerWaalsContact O-N 3.12Å; S106-H109 PolarHBondContact O-N 3.49Å; A107-H109 VanDerWaalsContact C-N 3.29Å; A107-H109 PolarHBondContact O-N 3.03Å; H109-R113 PolarHBondContact CE1-NH2 3.22Å; H109-R113 WeakPolarHBondContact O-CB 3.1Å; H109-R113 PolarHBondContact O-N 3.45Å; H109-R113 VanDerWaalsContact O-N 3.12Å
110	A	89.3	Confident	88.3	Confident	53 Å²	53	102.6 Å²	102.6	44%	0.438	50%	0.501	S	S	.	.	H	α-helix	trans	-65.6	-48	173.2	0	0	0	0	0	111.4	S106 A107 V112 R113 Q114	S106-A110 PolarHBondContact O-N 3.26Å; A107-A110 WeakPolarHBondContact O-CB 3.48Å; A107-A110 PolarHBondContact O-N 3.27Å; A107-A110 VanDerWaalsContact O-N 3.1Å; A110-V112 PolarHBondContact O-N 2.98Å; A110-R113 WeakPolarHBondContact O-CB 3.26Å; A110-R113 PolarHBondContact O-N 3.22Å; A110-R113 VanDerWaalsContact O-N 3.13Å; A110-Q114 PolarHBondContact O-N 2.76Å
111	E	89.9	Confident	88.3	Confident	106 Å²	106	102.8 Å²	102.8	50%	0.495	50%	0.502	S	S	.	.	H	α-helix	trans	-59.3	-46	177	-172.9	-177.2	-168.7	0	0	111.7	A107 R113 Q114 L115	A107-E111 PolarHBondContact O-N 3.15Å; E111-R113 VanDerWaalsContact C-N 3.26Å; E111-R113 PolarHBondContact O-N 3.1Å; E111-Q114 PolarHBondContact O-N 2.92Å; E111-L115 HydrophobicContact CG-CD1 3.9Å; E111-L115 HydrophobicContact CG-CG 4.38Å; E111-L115 WeakPolarHBondContact O-CB 3.25Å; E111-L115 VanDerWaalsContact O-CG 3.31Å; E111-L115 WeakPolarHBondContact O-CG 3.46Å; E111-L115 PolarHBondContact O-N 2.96Å
112	V	88.8	Confident	88.1	Confident	69 Å²	69	101 Å²	101	42%	0.418	49%	0.492	S	S	.	.	H	α-helix	trans	-65.4	-27.5	177.5	169.7	0	0	0	0	112.7	Y108 A110 R116	Y108-V112 WeakPolarHBondContact O-CB 3.4Å; Y108-V112 VanDerWaalsContact O-CG2 3.27Å; Y108-V112 WeakPolarHBondContact O-CG2 3.27Å; Y108-V112 PolarHBondContact O-N 3.23Å; A110-V112 PolarHBondContact O-N 2.98Å; V112-R116 WeakPolarHBondContact O-CG 3.18Å; V112-R116 PolarHBondContact O-N 2.9Å
113	R	86	Confident	88.1	Confident	128 Å²	128	105.1 Å²	105.1	48%	0.483	51%	0.509	S	S	.	.	H	α-helix	trans	-71.7	-52.8	172.5	-177.8	-178.3	-67.8	100.7	-3	110.5	H109 A110 E111 L115 R116 E117	H109-R113 PolarHBondContact CE1-NH2 3.22Å; H109-R113 WeakPolarHBondContact O-CB 3.1Å; H109-R113 PolarHBondContact O-N 3.45Å; H109-R113 VanDerWaalsContact O-N 3.12Å; A110-R113 WeakPolarHBondContact O-CB 3.26Å; A110-R113 PolarHBondContact O-N 3.22Å; A110-R113 VanDerWaalsContact O-N 3.13Å; E111-R113 VanDerWaalsContact C-N 3.26Å; E111-R113 PolarHBondContact O-N 3.1Å; R113-L115 VanDerWaalsContact C-N 3.32Å; R113-L115 PolarHBondContact O-N 3.5Å; R113-R116 WeakPolarHBondContact O-CB 3.4Å; R113-R116 PolarHBondContact O-N 3.04Å; R113-E117 WeakPolarHBondContact CG-OE1 3.3Å; R113-E117 PolarHBondContact O-N 2.87Å; R113-E117 VanDerWaalsContact O-N 3.16Å
114	Q	89	Confident	88.2	Confident	109 Å²	109	104.3 Å²	104.3	51%	0.509	51%	0.509	S	S	.	.	H	α-helix	trans	-55.2	-46	177.6	-178.3	-175.7	-26.2	0	0	111.7	A110 E111 R116 E117 E118	A110-Q114 PolarHBondContact O-N 2.76Å; E111-Q114 PolarHBondContact O-N 2.92Å; Q114-R116 PolarHBondContact O-N 2.97Å; Q114-E117 PolarHBondContact O-N 3.41Å; Q114-E118 HydrophobicContact CG-CG 4.4Å; Q114-E118 WeakPolarHBondContact CG-OE1 3.41Å; Q114-E118 PolarHBondContact NE2-OE1 3.39Å; Q114-E118 WeakPolarHBondContact O-CG 3.4Å; Q114-E118 PolarHBondContact O-N 3.39Å
115	L	86.8	Confident	88.1	Confident	75 Å²	75	105.8 Å²	105.8	39%	0.393	51%	0.514	S	S	.	.	H	α-helix	trans	-64.6	-20.9	178.6	-71.5	172.6	0	0	0	113.6	E111 R113 N119	E111-L115 HydrophobicContact CG-CD1 3.9Å; E111-L115 HydrophobicContact CG-CG 4.38Å; E111-L115 WeakPolarHBondContact O-CB 3.25Å; E111-L115 VanDerWaalsContact O-CG 3.31Å; E111-L115 WeakPolarHBondContact O-CG 3.46Å; E111-L115 PolarHBondContact O-N 2.96Å; R113-L115 VanDerWaalsContact C-N 3.32Å; R113-L115 PolarHBondContact O-N 3.5Å; L115-N119 PolarHBondContact O-N 2.96Å; L115-N119 PolarHBondContact O-ND2 2.88Å
116	R	91.2	Very high	87.9	Confident	161 Å²	161	104 Å²	104	61%	0.608	51%	0.508	S	S	*	.	H	α-helix	trans	-78.4	-47.3	171.4	-73.1	174.3	-172.5	-161.7	7.1	111.1	V112 R113 Q114 E118 N119 E120	V112-R116 WeakPolarHBondContact O-CG 3.18Å; V112-R116 PolarHBondContact O-N 2.9Å; R113-R116 WeakPolarHBondContact O-CB 3.4Å; R113-R116 PolarHBondContact O-N 3.04Å; Q114-R116 PolarHBondContact O-N 2.97Å; R116-E118 VanDerWaalsContact C-N 3.31Å; R116-E118 PolarHBondContact O-N 2.98Å; R116-N119 PolarHBondContact O-N 3.44Å; R116-N119 VanDerWaalsContact O-N 3.1Å; R116-E120 PolarHBondContact O-N 2.86Å
117	E	89.1	Confident	88	Confident	114 Å²	114	102.9 Å²	102.9	53%	0.533	50%	0.497	S	S	.	.	H	α-helix	trans	-58.9	-41.8	177.4	-66.9	164	-170.5	0	0	111.2	R113 Q114 E120 H121	R113-E117 WeakPolarHBondContact CG-OE1 3.3Å; R113-E117 PolarHBondContact O-N 2.87Å; R113-E117 VanDerWaalsContact O-N 3.16Å; Q114-E117 PolarHBondContact O-N 3.41Å; E117-E120 PolarHBondContact O-N 3.43Å; E117-H121 WeakPolarHBondContact O-CB 3.42Å; E117-H121 PolarHBondContact O-N 2.93Å
118	E	86.9	Confident	88.1	Confident	89 Å²	89	103 Å²	103	42%	0.416	50%	0.498	S	S	.	.	H	α-helix	trans	-62.9	-40.3	173.3	-74	-178.7	-165.7	0	0	113	Q114 R116 I122	Q114-E118 HydrophobicContact CG-CG 4.4Å; Q114-E118 WeakPolarHBondContact CG-OE1 3.41Å; Q114-E118 PolarHBondContact NE2-OE1 3.39Å; Q114-E118 WeakPolarHBondContact O-CG 3.4Å; Q114-E118 PolarHBondContact O-N 3.39Å; R116-E118 VanDerWaalsContact C-N 3.31Å; R116-E118 PolarHBondContact O-N 2.98Å; E118-I122 WeakPolarHBondContact O-CB 3.48Å; E118-I122 WeakPolarHBondContact O-CD1 3.48Å; E118-I122 WeakPolarHBondContact O-CG1 3.31Å; E118-I122 PolarHBondContact O-N 3.18Å
119	N	83.5	Confident	87.8	Confident	107 Å²	107	100 Å²	100	57%	0.572	49%	0.489	S	S	*	.	H	α-helix	trans	-70.4	-36.8	178.1	-88.7	-74.2	0	0	0	112.4	L115 R116 I122 Y123	L115-N119 PolarHBondContact O-N 2.96Å; L115-N119 PolarHBondContact O-ND2 2.88Å; R116-N119 PolarHBondContact O-N 3.44Å; R116-N119 VanDerWaalsContact O-N 3.1Å; N119-I122 PolarHBondContact O-N 3.33Å; N119-Y123 WeakPolarHBondContact O-CB 3.45Å; N119-Y123 PolarHBondContact O-N 2.85Å
120	E	89	Confident	87.8	Confident	136 Å²	136	100.3 Å²	100.3	64%	0.636	49%	0.489	S	S	*	.	H	α-helix	trans	-64.8	-46.6	175.1	-170.8	163.5	-169.6	0	0	110.7	R116 E117 I122 Y123 D124	R116-E120 PolarHBondContact O-N 2.86Å; E117-E120 PolarHBondContact O-N 3.43Å; E120-I122 VanDerWaalsContact C-N 3.35Å; E120-I122 PolarHBondContact O-N 2.82Å; E120-Y123 WeakPolarHBondContact O-CB 3.48Å; E120-Y123 PolarHBondContact O-N 3.14Å; E120-Y123 VanDerWaalsContact O-N 3.1Å; E120-D124 PolarHBondContact O-N 3.32Å
121	H	90	Very high	87.7	Confident	129 Å²	129	100.8 Å²	100.8	60%	0.597	49%	0.493	S	S	*	.	H	α-helix	trans	-60.5	-40.2	174.8	-171.9	74.8	0	0	0	113.1	E117 Y123 Q125	E117-H121 WeakPolarHBondContact O-CB 3.42Å; E117-H121 PolarHBondContact O-N 2.93Å; H121-Y123 VanDerWaalsContact C-N 3.34Å; H121-Q125 WeakPolarHBondContact O-CB 3.33Å; H121-Q125 PolarHBondContact O-N 3.2Å; H121-Q125 VanDerWaalsContact O-N 3.07Å
122	I	86.4	Confident	87.4	Confident	75 Å²	75	98 Å²	98	39%	0.385	49%	0.488	S	S	.	.	H	α-helix	trans	-66.1	-36.1	175	-72.5	167.5	0	0	0	111.6	E118 N119 E120 L126	E118-I122 WeakPolarHBondContact O-CB 3.48Å; E118-I122 WeakPolarHBondContact O-CD1 3.48Å; E118-I122 WeakPolarHBondContact O-CG1 3.31Å; E118-I122 PolarHBondContact O-N 3.18Å; N119-I122 PolarHBondContact O-N 3.33Å; E120-I122 VanDerWaalsContact C-N 3.35Å; E120-I122 PolarHBondContact O-N 2.82Å; I122-L126 WeakPolarHBondContact O-CB 3.2Å; I122-L126 PolarHBondContact O-N 2.93Å
123	Y	88.5	Confident	87.3	Confident	148 Å²	148	101.2 Å²	101.2	58%	0.58	49%	0.493	S	S	*	.	H	α-helix	trans	-66.7	-47.6	176.5	179.8	-91.6	0	0	0	111.4	N119 E120 H121 Q125 L126 T127	N119-Y123 WeakPolarHBondContact O-CB 3.45Å; N119-Y123 PolarHBondContact O-N 2.85Å; E120-Y123 WeakPolarHBondContact O-CB 3.48Å; E120-Y123 PolarHBondContact O-N 3.14Å; E120-Y123 VanDerWaalsContact O-N 3.1Å; H121-Y123 VanDerWaalsContact C-N 3.34Å; Y123-Q125 PolarHBondContact O-N 3.32Å; Y123-L126 WeakPolarHBondContact O-CA 3.23Å; Y123-L126 WeakPolarHBondContact O-CB 3.39Å; Y123-L126 PolarHBondContact O-N 3.33Å; Y123-L126 VanDerWaalsContact O-N 3.09Å; Y123-T127 HydrophobicContact CD1-CG2 4.15Å; Y123-T127 HydrophobicContact CE1-CG2 3.7Å; Y123-T127 WeakPolarHBondContact O-CG2 3.48Å; Y123-T127 PolarHBondContact O-N 2.85Å
124	D	90.7	Very high	87.5	Confident	94 Å²	94	102.1 Å²	102.1	50%	0.503	50%	0.5	S	S	.	.	H	α-helix	trans	-61	-45.7	178.2	-83	-1.8	0	0	0	111.6	E120 L126 T127 A128	E120-D124 PolarHBondContact O-N 3.32Å; D124-L126 VanDerWaalsContact C-N 3.27Å; D124-L126 PolarHBondContact O-N 2.93Å; D124-T127 PolarHBondContact O-N 3.37Å; D124-T127 PolarHBondContact O-OG1 3.41Å; D124-A128 PolarHBondContact O-N 2.94Å
125	Q	84.9	Confident	87.4	Confident	108 Å²	108	102.2 Å²	102.2	51%	0.505	50%	0.501	S	S	.	.	H	α-helix	trans	-58.1	-38.5	173.8	-173.3	177.5	84.6	0	0	112.1	H121 Y123 A128 E129	H121-Q125 WeakPolarHBondContact O-CB 3.33Å; H121-Q125 PolarHBondContact O-N 3.2Å; H121-Q125 VanDerWaalsContact O-N 3.07Å; Y123-Q125 PolarHBondContact O-N 3.32Å; Q125-A128 PolarHBondContact O-N 2.59Å; Q125-E129 WeakPolarHBondContact O-CB 3.32Å; Q125-E129 PolarHBondContact O-N 3.07Å
126	L	84.1	Confident	86.8	Confident	82 Å²	82	101.8 Å²	101.8	43%	0.429	50%	0.504	S	S	.	.	H	α-helix	trans	-66.9	-33.4	174.8	178.8	64.6	0	0	0	112.7	I122 Y123 D124 K130	I122-L126 WeakPolarHBondContact O-CB 3.2Å; I122-L126 PolarHBondContact O-N 2.93Å; Y123-L126 WeakPolarHBondContact O-CA 3.23Å; Y123-L126 WeakPolarHBondContact O-CB 3.39Å; Y123-L126 PolarHBondContact O-N 3.33Å; Y123-L126 VanDerWaalsContact O-N 3.09Å; D124-L126 VanDerWaalsContact C-N 3.27Å; D124-L126 PolarHBondContact O-N 2.93Å; L126-K130 HydrophobicContact CD1-CD 4.49Å; L126-K130 HydrophobicContact CG-CD 4.32Å; L126-K130 WeakPolarHBondContact O-CB 3.48Å; L126-K130 WeakPolarHBondContact O-CD 3.3Å; L126-K130 VanDerWaalsContact O-CG 3.23Å; L126-K130 WeakPolarHBondContact O-CG 3.33Å; L126-K130 PolarHBondContact O-N 2.9Å; L126-K130 VanDerWaalsContact O-N 3.14Å
127	T	87.2	Confident	86.2	Confident	59 Å²	59	100 Å²	100	36%	0.362	50%	0.502	S	S	.	.	H	α-helix	trans	-72.5	-41.6	175.4	69.4	0	0	0	0	112.1	Y123 D124 K130 A131	Y123-T127 HydrophobicContact CD1-CG2 4.15Å; Y123-T127 HydrophobicContact CE1-CG2 3.7Å; Y123-T127 WeakPolarHBondContact O-CG2 3.48Å; Y123-T127 PolarHBondContact O-N 2.85Å; D124-T127 PolarHBondContact O-N 3.37Å; D124-T127 PolarHBondContact O-OG1 3.41Å; T127-K130 PolarHBondContact O-N 3.22Å; T127-A131 PolarHBondContact O-N 2.6Å; T127-A131 VanDerWaalsContact O-N 3.08Å
128	A	90.6	Very high	86.1	Confident	61 Å²	61	99.5 Å²	99.5	50%	0.504	50%	0.503	S	S	.	.	H	α-helix	trans	-60.6	-46.5	174.8	0	0	0	0	0	111.8	D124 Q125 K130 A131 A132	D124-A128 PolarHBondContact O-N 2.94Å; Q125-A128 PolarHBondContact O-N 2.59Å; A128-K130 VanDerWaalsContact C-N 3.34Å; A128-K130 PolarHBondContact O-N 3.43Å; A128-A131 WeakPolarHBondContact O-CB 3.28Å; A128-A131 PolarHBondContact O-N 3.06Å; A128-A132 PolarHBondContact O-N 3.41Å
129	E	83.6	Confident	86.1	Confident	81 Å²	81	102 Å²	102	38%	0.379	51%	0.508	S	S	.	.	H	α-helix	trans	-63.4	-37.9	177.6	-178	62.4	-170.3	0	0	112.2	Q125 A131 A132 R133	Q125-E129 WeakPolarHBondContact O-CB 3.32Å; Q125-E129 PolarHBondContact O-N 3.07Å; E129-A131 VanDerWaalsContact C-N 3.29Å; E129-A131 PolarHBondContact O-N 3.45Å; E129-A132 PolarHBondContact O-N 3.02Å; E129-R133 WeakPolarHBondContact O-CG 3.32Å; E129-R133 PolarHBondContact O-N 3.2Å; E129-R133 IonicContact OE1-CZ 3.95Å; E129-R133 IonicContact OE1-NE 3.25Å; E129-R133 PolarHBondContact OE1-NE 2.79Å; E129-R133 IonicContact OE1-NH2 2.84Å; E129-R133 PolarHBondContact OE1-NH2 2.77Å
130	K	87.9	Confident	86	Confident	123 Å²	123	101.9 Å²	101.9	54%	0.535	51%	0.507	S	S	.	.	H	α-helix	trans	-64.3	-30.4	172.7	-78.1	170	179.7	173.3	0	112.9	L126 T127 A128	L126-K130 HydrophobicContact CD1-CD 4.49Å; L126-K130 HydrophobicContact CG-CD 4.32Å; L126-K130 WeakPolarHBondContact O-CB 3.48Å; L126-K130 WeakPolarHBondContact O-CD 3.3Å; L126-K130 VanDerWaalsContact O-CG 3.23Å; L126-K130 WeakPolarHBondContact O-CG 3.33Å; L126-K130 PolarHBondContact O-N 2.9Å; L126-K130 VanDerWaalsContact O-N 3.14Å; T127-K130 PolarHBondContact O-N 3.22Å; A128-K130 VanDerWaalsContact C-N 3.34Å; A128-K130 PolarHBondContact O-N 3.43Å
131	A	87.2	Confident	85.7	Confident	62 Å²	62	99.6 Å²	99.6	51%	0.512	50%	0.499	S	S	.	.	H	α-helix	trans	-76.6	-43.7	174.7	0	0	0	0	0	111.7	T127 A128 E129 R133 K134 Q135	T127-A131 PolarHBondContact O-N 2.6Å; T127-A131 VanDerWaalsContact O-N 3.08Å; A128-A131 WeakPolarHBondContact O-CB 3.28Å; A128-A131 PolarHBondContact O-N 3.06Å; E129-A131 VanDerWaalsContact C-N 3.29Å; E129-A131 PolarHBondContact O-N 3.45Å; A131-R133 PolarHBondContact O-N 3.34Å; A131-K134 PolarHBondContact O-N 3.13Å; A131-Q135 PolarHBondContact O-N 3.25Å; A131-Q135 VanDerWaalsContact O-N 3.15Å
132	A	84.5	Confident	85.5	Confident	47 Å²	47	98.1 Å²	98.1	39%	0.388	50%	0.495	S	S	.	.	H	α-helix	trans	-58.2	-44.6	177.5	0	0	0	0	0	112.1	A128 E129 K134 Q135 S136	A128-A132 PolarHBondContact O-N 3.41Å; E129-A132 PolarHBondContact O-N 3.02Å; A132-K134 PolarHBondContact O-N 3.36Å; A132-Q135 WeakPolarHBondContact O-CB 3.48Å; A132-Q135 PolarHBondContact O-N 2.81Å; A132-Q135 VanDerWaalsContact O-N 3.1Å; A132-S136 PolarHBondContact O-N 3.36Å
133	R	86.1	Confident	85.2	Confident	138 Å²	138	96.5 Å²	96.5	52%	0.521	49%	0.494	S	S	.	.	H	α-helix	trans	-61.5	-41.9	178.2	-71	174.8	-170.3	178.8	2.3	113.2	E129 A131 Q135 S136 E137	E129-R133 WeakPolarHBondContact O-CG 3.32Å; E129-R133 PolarHBondContact O-N 3.2Å; E129-R133 IonicContact OE1-CZ 3.95Å; E129-R133 IonicContact OE1-NE 3.25Å; E129-R133 PolarHBondContact OE1-NE 2.79Å; E129-R133 IonicContact OE1-NH2 2.84Å; E129-R133 PolarHBondContact OE1-NH2 2.77Å; A131-R133 PolarHBondContact O-N 3.34Å; R133-Q135 VanDerWaalsContact C-N 3.28Å; R133-Q135 PolarHBondContact O-N 3.21Å; R133-S136 WeakPolarHBondContact CA-OG 3.41Å; R133-S136 PolarHBondContact O-N 3.37Å; R133-S136 PolarHBondContact O-OG 3.28Å; R133-E137 WeakPolarHBondContact O-CB 3.38Å; R133-E137 VanDerWaalsContact O-CG 3.29Å; R133-E137 WeakPolarHBondContact O-CG 3.37Å; R133-E137 PolarHBondContact O-N 3.23Å
134	K	90.2	Very high	84.8	Confident	147 Å²	147	94.5 Å²	94.5	64%	0.639	49%	0.49	S	S	*	.	H	α-helix	trans	-63.2	-34.3	174.1	-72.4	-178.8	175	-172.7	0	112.6	A131 A132 L138	A131-K134 PolarHBondContact O-N 3.13Å; A132-K134 PolarHBondContact O-N 3.36Å; K134-L138 PolarHBondContact O-N 3.42Å; K134-L138 VanDerWaalsContact O-N 3.13Å
135	Q	86	Confident	84.6	Confident	111 Å²	111	94.9 Å²	94.9	52%	0.519	49%	0.492	S	S	.	.	H	α-helix	trans	-70.8	-35	175.3	-163.1	-175.9	30.9	0	0	112	A131 A132 R133 R139	A131-Q135 PolarHBondContact O-N 3.25Å; A131-Q135 VanDerWaalsContact O-N 3.15Å; A132-Q135 WeakPolarHBondContact O-CB 3.48Å; A132-Q135 PolarHBondContact O-N 2.81Å; A132-Q135 VanDerWaalsContact O-N 3.1Å; R133-Q135 VanDerWaalsContact C-N 3.28Å; R133-Q135 PolarHBondContact O-N 3.21Å; Q135-R139 WeakPolarHBondContact O-CG 3.42Å; Q135-R139 PolarHBondContact O-N 3.32Å
136	S	74.5	Confident	84.7	Confident	66 Å²	66	92.7 Å²	92.7	46%	0.462	49%	0.492	S	S	.	.	H	α-helix	trans	-74	-36.9	173.9	56.3	0	0	0	0	112.9	A132 R133 R139 L140	A132-S136 PolarHBondContact O-N 3.36Å; R133-S136 WeakPolarHBondContact CA-OG 3.41Å; R133-S136 PolarHBondContact O-N 3.37Å; R133-S136 PolarHBondContact O-OG 3.28Å; S136-R139 PolarHBondContact O-N 3.41Å; S136-L140 PolarHBondContact O-N 3.49Å
137	E	79.1	Confident	84.5	Confident	123 Å²	123	95.3 Å²	95.3	58%	0.575	50%	0.5	S	S	*	.	H	α-helix	trans	-58.9	-45.8	172.7	-73.9	164.7	178	0	0	111.8	R133 R139 L140 L141	R133-E137 WeakPolarHBondContact O-CB 3.38Å; R133-E137 VanDerWaalsContact O-CG 3.29Å; R133-E137 WeakPolarHBondContact O-CG 3.37Å; R133-E137 PolarHBondContact O-N 3.23Å; E137-R139 PolarHBondContact O-N 3.11Å; E137-L140 WeakPolarHBondContact O-CB 3.39Å; E137-L140 PolarHBondContact O-N 2.97Å; E137-L141 PolarHBondContact O-N 3.27Å; E137-L141 VanDerWaalsContact O-N 3.08Å
138	L	87.5	Confident	84.4	Confident	104 Å²	104	96.2 Å²	96.2	55%	0.545	50%	0.503	S	S	.	.	H	α-helix	trans	-66.3	-35.5	176.8	-176.6	61.5	0	0	0	112.8	K134 N142	K134-L138 PolarHBondContact O-N 3.42Å; K134-L138 VanDerWaalsContact O-N 3.13Å; L138-N142 VanDerWaalsContact O-CG 3.24Å; L138-N142 PolarHBondContact O-N 2.85Å; L138-N142 PolarHBondContact O-OD1 3.27Å
139	R	86.1	Confident	84.2	Confident	141 Å²	141	98.5 Å²	98.5	53%	0.532	50%	0.503	S	S	.	.	H	α-helix	trans	-68.5	-34.1	173.7	-78.3	172.4	168.5	150	-6.7	112.5	Q135 S136 E137 A143	Q135-R139 WeakPolarHBondContact O-CG 3.42Å; Q135-R139 PolarHBondContact O-N 3.32Å; S136-R139 PolarHBondContact O-N 3.41Å; E137-R139 PolarHBondContact O-N 3.11Å; R139-A143 PolarHBondContact O-N 3.36Å
140	L	82	Confident	84.1	Confident	104 Å²	104	100.1 Å²	100.1	55%	0.545	51%	0.51	S	S	.	.	H	α-helix	trans	-64.5	-52	175	-169.8	81.7	0	0	0	110.3	S136 E137 N142 A143 E144	S136-L140 PolarHBondContact O-N 3.49Å; E137-L140 WeakPolarHBondContact O-CB 3.39Å; E137-L140 PolarHBondContact O-N 2.97Å; L140-N142 PolarHBondContact O-N 3.06Å; L140-A143 WeakPolarHBondContact O-CA 3.4Å; L140-A143 WeakPolarHBondContact O-CB 3.38Å; L140-A143 PolarHBondContact O-N 2.82Å; L140-E144 HydrophobicContact CG-CG 4.47Å; L140-E144 WeakPolarHBondContact O-CG 3.11Å; L140-E144 PolarHBondContact O-N 2.87Å
141	L	83.8	Confident	84.1	Confident	88 Å²	88	100.5 Å²	100.5	46%	0.461	51%	0.508	S	S	.	.	H	α-helix	trans	-56.3	-47.3	-179.6	-177.4	65.4	0	0	0	112.2	E137 A143 E144 D145	E137-L141 PolarHBondContact O-N 3.27Å; E137-L141 VanDerWaalsContact O-N 3.08Å; L141-A143 PolarHBondContact O-N 3.41Å; L141-E144 PolarHBondContact O-N 2.83Å; L141-E144 VanDerWaalsContact O-N 3.16Å; L141-D145 PolarHBondContact O-N 3.02Å
142	N	85	Confident	84.3	Confident	98 Å²	98	102.3 Å²	102.3	52%	0.524	51%	0.505	S	S	.	.	H	α-helix	trans	-62.3	-26.6	177.3	-68.5	-1.6	0	0	0	113.2	L138 L140 A146	L138-N142 VanDerWaalsContact O-CG 3.24Å; L138-N142 PolarHBondContact O-N 2.85Å; L138-N142 PolarHBondContact O-OD1 3.27Å; L140-N142 PolarHBondContact O-N 3.06Å; N142-A146 PolarHBondContact O-N 2.95Å
143	A	80.6	Confident	84.5	Confident	42 Å²	42	104.7 Å²	104.7	35%	0.347	51%	0.514	S	S	.	.	H	α-helix	trans	-82.1	-37.2	175	0	0	0	0	0	111.8	R139 L140 L141 A146 F147	R139-A143 PolarHBondContact O-N 3.36Å; L140-A143 WeakPolarHBondContact O-CA 3.4Å; L140-A143 WeakPolarHBondContact O-CB 3.38Å; L140-A143 PolarHBondContact O-N 2.82Å; L141-A143 PolarHBondContact O-N 3.41Å; A143-A146 PolarHBondContact O-N 3.24Å; A143-F147 WeakPolarHBondContact O-CD2 3.26Å; A143-F147 PolarHBondContact O-N 3.34Å
144	E	78.5	Confident	84.4	Confident	106 Å²	106	101.7 Å²	101.7	50%	0.495	51%	0.509	S	S	.	.	H	α-helix	trans	-60.8	-47.5	174	-70.4	174.9	157.9	0	0	111.1	L140 L141 A146 F147 D148	L140-E144 HydrophobicContact CG-CG 4.47Å; L140-E144 WeakPolarHBondContact O-CG 3.11Å; L140-E144 PolarHBondContact O-N 2.87Å; L141-E144 PolarHBondContact O-N 2.83Å; L141-E144 VanDerWaalsContact O-N 3.16Å; E144-A146 VanDerWaalsContact C-N 3.31Å; E144-A146 PolarHBondContact O-N 3.35Å; E144-F147 PolarHBondContact O-N 3.47Å; E144-D148 PolarHBondContact O-N 3.31Å
145	D	86.8	Confident	84.2	Confident	102 Å²	102	99 Å²	99	55%	0.545	50%	0.498	S	S	.	.	H	α-helix	trans	-56.6	-42.8	174.2	-78.4	-23.8	0	0	0	112.1	L141 D148 E149	L141-D145 PolarHBondContact O-N 3.02Å; D145-D148 PolarHBondContact O-N 2.97Å; D145-E149 PolarHBondContact O-N 2.89Å; D145-E149 VanDerWaalsContact O-N 3.16Å
146	A	87.1	Confident	84.4	Confident	61 Å²	61	96.6 Å²	96.6	50%	0.504	50%	0.497	S	S	.	.	H	α-helix	trans	-68.2	-39.9	179.6	0	0	0	0	0	112.7	N142 A143 E144 E149 E150	N142-A146 PolarHBondContact O-N 2.95Å; A143-A146 PolarHBondContact O-N 3.24Å; E144-A146 VanDerWaalsContact C-N 3.31Å; E144-A146 PolarHBondContact O-N 3.35Å; A146-E149 PolarHBondContact O-N 3.43Å; A146-E150 PolarHBondContact O-N 2.81Å
147	F	80.5	Confident	85.2	Confident	137 Å²	137	99.6 Å²	99.6	60%	0.601	50%	0.502	S	S	*	.	H	α-helix	trans	-66.3	-37.1	175.1	-78.5	-57.5	0	0	0	112.3	A143 E144 E150 R151	A143-F147 WeakPolarHBondContact O-CD2 3.26Å; A143-F147 PolarHBondContact O-N 3.34Å; E144-F147 PolarHBondContact O-N 3.47Å; F147-E150 PolarHBondContact O-N 2.94Å; F147-R151 WeakPolarHBondContact O-CB 3.39Å; F147-R151 PolarHBondContact O-N 2.94Å
148	D	84.6	Confident	85.4	Confident	79 Å²	79	99.2 Å²	99.2	42%	0.422	50%	0.504	S	S	.	.	H	α-helix	trans	-73.1	-26.6	178.6	-113	6.7	0	0	0	112.6	E144 D145 R151 K152	E144-D148 PolarHBondContact O-N 3.31Å; D145-D148 PolarHBondContact O-N 2.97Å; D148-R151 IonicContact OD1-NH1 2.74Å; D148-K152 WeakPolarHBondContact O-CD 3.49Å; D148-K152 WeakPolarHBondContact O-CE 3.31Å; D148-K152 VanDerWaalsContact O-CG 3.26Å; D148-K152 WeakPolarHBondContact O-CG 3.34Å; D148-K152 PolarHBondContact O-N 3.18Å
149	E	87.3	Confident	85.4	Confident	109 Å²	109	101 Å²	101	51%	0.509	51%	0.51	S	S	.	.	H	α-helix	trans	-72.8	-46.1	167.3	-72.7	-57.3	141.4	0	0	112.7	D145 A146 R151 K152 V153	D145-E149 PolarHBondContact O-N 2.89Å; D145-E149 VanDerWaalsContact O-N 3.16Å; A146-E149 PolarHBondContact O-N 3.43Å; E149-R151 PolarHBondContact O-N 3.49Å; E149-K152 PolarHBondContact O-N 3.14Å; E149-K152 VanDerWaalsContact O-N 3.15Å; E149-K152 IonicContact OE1-NZ 3.13Å; E149-K152 PolarHBondContact OE1-NZ 3.17Å; E149-V153 PolarHBondContact O-N 3.01Å
150	E	81.7	Confident	85.5	Confident	114 Å²	114	98 Å²	98	53%	0.533	51%	0.51	S	S	.	.	H	α-helix	trans	-59	-36.8	175.3	-157.9	-149.2	135.5	0	0	111.2	A146 F147 V153 N154	A146-E150 PolarHBondContact O-N 2.81Å; F147-E150 PolarHBondContact O-N 2.94Å; E150-V153 PolarHBondContact O-N 3.04Å; E150-N154 WeakPolarHBondContact O-CB 3.46Å; E150-N154 PolarHBondContact O-N 3.15Å; E150-N154 PolarHBondContact O-ND2 2.95Å; E150-N154 PolarHBondContact OE1-ND2 3.07Å
151	R	87.9	Confident	85.8	Confident	132 Å²	132	98.2 Å²	98.2	50%	0.498	51%	0.511	S	S	.	.	H	α-helix	trans	-61.9	-47.1	174.9	179.6	178.5	165.2	-140	-17.8	112.6	F147 D148 E149 V153 N154 E155	F147-R151 WeakPolarHBondContact O-CB 3.39Å; F147-R151 PolarHBondContact O-N 2.94Å; D148-R151 IonicContact OD1-NH1 2.74Å; E149-R151 PolarHBondContact O-N 3.49Å; R151-V153 VanDerWaalsContact C-N 3.31Å; R151-V153 PolarHBondContact O-N 2.79Å; R151-N154 PolarHBondContact O-N 2.7Å; R151-E155 HydrophobicContact CG-CG 4.38Å; R151-E155 IonicContact CZ-OE1 3.5Å; R151-E155 VanDerWaalsContact CZ-OE1 3.25Å; R151-E155 IonicContact NE-OE1 2.81Å; R151-E155 PolarHBondContact NE-OE1 2.84Å; R151-E155 IonicContact NH2-OE1 2.94Å; R151-E155 PolarHBondContact NH2-OE1 3.33Å; R151-E155 IonicContact NH2-OE2 3.27Å; R151-E155 WeakPolarHBondContact O-CG 3.46Å; R151-E155 PolarHBondContact O-N 2.75Å
152	K	90.5	Very high	85.9	Confident	99 Å²	99	96.3 Å²	96.3	43%	0.43	51%	0.506	S	S	.	.	H	α-helix	trans	-58.7	-42.8	177.4	-70.5	157.7	-166.4	147.6	0	111.7	D148 E149 E155 A156	D148-K152 WeakPolarHBondContact O-CD 3.49Å; D148-K152 WeakPolarHBondContact O-CE 3.31Å; D148-K152 VanDerWaalsContact O-CG 3.26Å; D148-K152 WeakPolarHBondContact O-CG 3.34Å; D148-K152 PolarHBondContact O-N 3.18Å; E149-K152 PolarHBondContact O-N 3.14Å; E149-K152 VanDerWaalsContact O-N 3.15Å; E149-K152 IonicContact OE1-NZ 3.13Å; E149-K152 PolarHBondContact OE1-NZ 3.17Å; K152-E155 PolarHBondContact O-N 2.82Å; K152-A156 PolarHBondContact O-N 3.26Å
153	V	89.8	Confident	86.2	Confident	98 Å²	98	95.8 Å²	95.8	59%	0.594	51%	0.506	S	S	*	.	H	α-helix	trans	-63.5	-42.6	176.9	176	0	0	0	0	111.3	E149 E150 R151 K157	E149-V153 PolarHBondContact O-N 3.01Å; E150-V153 PolarHBondContact O-N 3.04Å; R151-V153 VanDerWaalsContact C-N 3.31Å; R151-V153 PolarHBondContact O-N 2.79Å; V153-K157 WeakPolarHBondContact O-CB 3.32Å; V153-K157 PolarHBondContact O-N 3.45Å
154	N	83.4	Confident	86.6	Confident	75 Å²	75	96.8 Å²	96.8	40%	0.401	51%	0.51	S	S	.	.	H	α-helix	trans	-68.6	-36.9	176.6	-79.5	-59.8	0	0	0	113	E150 R151 K157 N158	E150-N154 WeakPolarHBondContact O-CB 3.46Å; E150-N154 PolarHBondContact O-N 3.15Å; E150-N154 PolarHBondContact O-ND2 2.95Å; E150-N154 PolarHBondContact OE1-ND2 3.07Å; R151-N154 PolarHBondContact O-N 2.7Å; N154-K157 PolarHBondContact O-N 3.29Å; N154-N158 WeakPolarHBondContact O-CB 3.49Å; N154-N158 PolarHBondContact O-N 3.25Å
155	E	86.5	Confident	86.9	Confident	89 Å²	89	94.2 Å²	94.2	42%	0.416	50%	0.504	S	S	.	.	H	α-helix	trans	-62.3	-49.5	174.8	-75.5	175.5	177.1	0	0	110.7	R151 K152 K157 N158 E159	R151-E155 HydrophobicContact CG-CG 4.38Å; R151-E155 IonicContact CZ-OE1 3.5Å; R151-E155 VanDerWaalsContact CZ-OE1 3.25Å; R151-E155 IonicContact NE-OE1 2.81Å; R151-E155 PolarHBondContact NE-OE1 2.84Å; R151-E155 IonicContact NH2-OE1 2.94Å; R151-E155 PolarHBondContact NH2-OE1 3.33Å; R151-E155 IonicContact NH2-OE2 3.27Å; R151-E155 WeakPolarHBondContact O-CG 3.46Å; R151-E155 PolarHBondContact O-N 2.75Å; K152-E155 PolarHBondContact O-N 2.82Å; E155-K157 VanDerWaalsContact C-N 3.34Å; E155-K157 PolarHBondContact O-N 2.79Å; E155-N158 WeakPolarHBondContact O-CB 3.44Å; E155-N158 PolarHBondContact O-N 3.15Å; E155-N158 VanDerWaalsContact O-N 3.12Å; E155-E159 PolarHBondContact O-N 3.46Å; E155-E159 VanDerWaalsContact O-N 3.08Å
156	A	90.2	Very high	87.1	Confident	61 Å²	61	96.8 Å²	96.8	50%	0.504	51%	0.506	S	S	.	.	H	α-helix	trans	-61.7	-37.4	175.8	0	0	0	0	0	113.4	K152 N158 E159 S160	K152-A156 PolarHBondContact O-N 3.26Å; A156-N158 VanDerWaalsContact C-N 3.33Å; A156-E159 PolarHBondContact O-N 3.13Å; A156-S160 PolarHBondContact O-N 3.3Å; A156-S160 VanDerWaalsContact O-N 3.17Å
157	K	90.9	Very high	87.2	Confident	130 Å²	130	98.8 Å²	98.8	57%	0.565	50%	0.504	S	S	*	.	H	α-helix	trans	-65.8	-35.5	175	-172.1	174.6	-176.8	175.4	0	112.2	V153 N154 E155 L161	V153-K157 WeakPolarHBondContact O-CB 3.32Å; V153-K157 PolarHBondContact O-N 3.45Å; N154-K157 PolarHBondContact O-N 3.29Å; E155-K157 VanDerWaalsContact C-N 3.34Å; E155-K157 PolarHBondContact O-N 2.79Å; K157-L161 HydrophobicContact CG-CD1 4.48Å; K157-L161 WeakPolarHBondContact O-CG 3.36Å; K157-L161 PolarHBondContact O-N 2.87Å
158	N	82.3	Confident	87.4	Confident	114 Å²	114	95.7 Å²	95.7	61%	0.61	50%	0.497	S	S	*	.	H	α-helix	trans	-70	-38.8	176.7	-170	36.3	0	0	0	112	N154 E155 A156 L161 S162	N154-N158 WeakPolarHBondContact O-CB 3.49Å; N154-N158 PolarHBondContact O-N 3.25Å; E155-N158 WeakPolarHBondContact O-CB 3.44Å; E155-N158 PolarHBondContact O-N 3.15Å; E155-N158 VanDerWaalsContact O-N 3.12Å; A156-N158 VanDerWaalsContact C-N 3.33Å; N158-L161 PolarHBondContact O-N 3.13Å; N158-S162 WeakPolarHBondContact O-CB 3.43Å; N158-S162 PolarHBondContact O-N 3.34Å
159	E	87.9	Confident	87.5	Confident	142 Å²	142	96.9 Å²	96.9	66%	0.664	50%	0.5	S	S	*	.	H	α-helix	trans	-61	-45.9	172.8	-68.6	-174.2	166.5	0	0	112	E155 A156 L161 S162 T163	E155-E159 PolarHBondContact O-N 3.46Å; E155-E159 VanDerWaalsContact O-N 3.08Å; A156-E159 PolarHBondContact O-N 3.13Å; E159-L161 PolarHBondContact O-N 2.89Å; E159-S162 WeakPolarHBondContact O-CB 3.44Å; E159-S162 PolarHBondContact O-N 2.88Å; E159-S162 VanDerWaalsContact O-N 3.14Å; E159-T163 PolarHBondContact O-N 2.77Å
160	S	87.9	Confident	87.7	Confident	78 Å²	78	97.5 Å²	97.5	55%	0.545	51%	0.506	S	S	.	.	H	α-helix	trans	-60.7	-41.9	175.9	-176.5	0	0	0	0	112.8	A156 S162 T163 S164	A156-S160 PolarHBondContact O-N 3.3Å; A156-S160 VanDerWaalsContact O-N 3.17Å; S160-S162 VanDerWaalsContact C-N 3.35Å; S160-T163 PolarHBondContact O-OG1 2.79Å; S160-S164 PolarHBondContact O-N 3.15Å
161	L	88	Confident	88.1	Confident	108 Å²	108	99.1 Å²	99.1	57%	0.565	51%	0.507	S	S	*	.	H	α-helix	trans	-67.6	-34	173.9	-72.9	169.8	0	0	0	112.4	K157 N158 E159 C165	K157-L161 HydrophobicContact CG-CD1 4.48Å; K157-L161 WeakPolarHBondContact O-CG 3.36Å; K157-L161 PolarHBondContact O-N 2.87Å; N158-L161 PolarHBondContact O-N 3.13Å; E159-L161 PolarHBondContact O-N 2.89Å; L161-C165 VanDerWaalsContact O-CB 3.31Å; L161-C165 WeakPolarHBondContact O-CB 3.49Å; L161-C165 PolarHBondContact O-N 2.95Å
162	S	87.7	Confident	88.1	Confident	49 Å²	49	98.8 Å²	98.8	34%	0.343	52%	0.515	S	S	.	.	H	α-helix	trans	-67	-42.3	177.5	-170.9	0	0	0	0	112.5	N158 E159 S160 C165 R166	N158-S162 WeakPolarHBondContact O-CB 3.43Å; N158-S162 PolarHBondContact O-N 3.34Å; E159-S162 WeakPolarHBondContact O-CB 3.44Å; E159-S162 PolarHBondContact O-N 2.88Å; E159-S162 VanDerWaalsContact O-N 3.14Å; S160-S162 VanDerWaalsContact C-N 3.35Å; S162-C165 PolarHBondContact O-N 2.69Å; S162-R166 WeakPolarHBondContact O-CG 3.08Å; S162-R166 PolarHBondContact O-N 3.41Å; S162-R166 VanDerWaalsContact O-N 3.12Å
163	T	89.7	Confident	88.2	Confident	87 Å²	87	98.1 Å²	98.1	53%	0.534	51%	0.513	S	S	.	.	H	α-helix	trans	-67.6	-39.9	176.3	58.1	0	0	0	0	111.9	E159 S160 R166 Q167	E159-T163 PolarHBondContact O-N 2.77Å; S160-T163 PolarHBondContact O-OG1 2.79Å; T163-R166 PolarHBondContact O-N 2.9Å; T163-Q167 PolarHBondContact O-N 2.67Å
164	S	89	Confident	88.3	Confident	62 Å²	62	99.2 Å²	99.2	43%	0.434	52%	0.515	S	S	.	.	H	α-helix	trans	-61	-45.6	173.7	-174.7	0	0	0	0	112.2	S160 R166 Q167 T168	S160-S164 PolarHBondContact O-N 3.15Å; S164-R166 PolarHBondContact O-N 2.86Å; S164-Q167 WeakPolarHBondContact O-CB 3.37Å; S164-Q167 PolarHBondContact O-N 2.84Å; S164-Q167 VanDerWaalsContact O-N 3.11Å; S164-T168 PolarHBondContact O-N 2.82Å
165	C	85.8	Confident	88.5	Confident	53 Å²	53	98 Å²	98	36%	0.358	52%	0.515	S	S	.	.	H	α-helix	trans	-59.5	-47.9	178.4	-156.9	0	0	0	0	111.5	L161 S162 Q167 T168 E169	L161-C165 VanDerWaalsContact O-CB 3.31Å; L161-C165 WeakPolarHBondContact O-CB 3.49Å; L161-C165 PolarHBondContact O-N 2.95Å; S162-C165 PolarHBondContact O-N 2.69Å; C165-Q167 VanDerWaalsContact C-N 3.3Å; C165-Q167 PolarHBondContact O-N 3.32Å; C165-T168 PolarHBondContact O-N 3.12Å; C165-T168 PolarHBondContact O-OG1 2.88Å; C165-E169 VanDerWaalsContact O-CG 3.32Å; C165-E169 WeakPolarHBondContact O-CG 3.4Å; C165-E169 PolarHBondContact O-N 3.5Å; C165-E169 PolarHBondContact SG-OE1 3.34Å; C165-E169 VanDerWaalsContact SG-OE1 3.35Å
166	R	91.1	Very high	88.8	Confident	156 Å²	156	99.8 Å²	99.8	59%	0.589	52%	0.522	S	S	*	.	H	α-helix	trans	-57.7	-38.4	173.5	-71.3	173	178.2	171.2	1.6	113.1	S162 T163 S164 E169 L170	S162-R166 WeakPolarHBondContact O-CG 3.08Å; S162-R166 PolarHBondContact O-N 3.41Å; S162-R166 VanDerWaalsContact O-N 3.12Å; T163-R166 PolarHBondContact O-N 2.9Å; S164-R166 PolarHBondContact O-N 2.86Å; R166-E169 WeakPolarHBondContact CA-OE2 3.45Å; R166-E169 PolarHBondContact O-N 2.85Å; R166-L170 WeakPolarHBondContact O-CG 3.46Å; R166-L170 PolarHBondContact O-N 3.12Å; R166-L170 VanDerWaalsContact O-N 3.1Å
167	Q	88.8	Confident	88.9	Confident	102 Å²	102	100.5 Å²	100.5	48%	0.477	52%	0.517	S	S	.	.	H	α-helix	trans	-66.6	-37.2	176.1	-164.4	-173.1	55.4	0	0	111.8	T163 S164 C165 R171	T163-Q167 PolarHBondContact O-N 2.67Å; S164-Q167 WeakPolarHBondContact O-CB 3.37Å; S164-Q167 PolarHBondContact O-N 2.84Å; S164-Q167 VanDerWaalsContact O-N 3.11Å; C165-Q167 VanDerWaalsContact C-N 3.3Å; C165-Q167 PolarHBondContact O-N 3.32Å; Q167-R171 WeakPolarHBondContact O-CG 3.49Å; Q167-R171 PolarHBondContact O-N 3.32Å
168	T	85.2	Confident	88.9	Confident	72 Å²	72	100.4 Å²	100.4	44%	0.442	52%	0.519	S	S	.	.	H	α-helix	trans	-72.3	-35.9	175.1	56.8	0	0	0	0	113.1	S164 C165 R171 L172	S164-T168 PolarHBondContact O-N 2.82Å; C165-T168 PolarHBondContact O-N 3.12Å; C165-T168 PolarHBondContact O-OG1 2.88Å; T168-R171 PolarHBondContact O-N 3.24Å; T168-L172 WeakPolarHBondContact O-CB 3.36Å; T168-L172 PolarHBondContact O-N 3.37Å
169	E	86.7	Confident	89.3	Confident	105 Å²	105	98.7 Å²	98.7	49%	0.491	51%	0.512	S	S	.	.	H	α-helix	trans	-62.7	-44.3	175.7	-72	159.4	-175.4	0	0	111.2	C165 R166 L172 Q173	C165-E169 VanDerWaalsContact O-CG 3.32Å; C165-E169 WeakPolarHBondContact O-CG 3.4Å; C165-E169 PolarHBondContact O-N 3.5Å; C165-E169 PolarHBondContact SG-OE1 3.34Å; C165-E169 VanDerWaalsContact SG-OE1 3.35Å; R166-E169 WeakPolarHBondContact CA-OE2 3.45Å; R166-E169 PolarHBondContact O-N 2.85Å; E169-L172 PolarHBondContact O-N 2.73Å; E169-Q173 PolarHBondContact O-N 3.32Å
170	L	91	Very high	89.4	Confident	121 Å²	121	94.6 Å²	94.6	63%	0.634	50%	0.499	S	S	*	.	H	α-helix	trans	-62.7	-41.4	174.3	-72.4	169.7	0	0	0	112.5	R166 Q173 L174	R166-L170 WeakPolarHBondContact O-CG 3.46Å; R166-L170 PolarHBondContact O-N 3.12Å; R166-L170 VanDerWaalsContact O-N 3.1Å; L170-Q173 PolarHBondContact O-N 3.42Å; L170-L174 WeakPolarHBondContact O-CG 3.47Å; L170-L174 PolarHBondContact O-N 2.9Å; L170-L174 VanDerWaalsContact O-N 3.08Å
171	R	90.3	Very high	89.5	Confident	148 Å²	148	100.2 Å²	100.2	56%	0.558	51%	0.508	S	S	*	.	H	α-helix	trans	-63	-41.1	174.5	-75.3	174.7	174.5	138.3	-0.7	112	Q167 T168 L174 A175	Q167-R171 WeakPolarHBondContact O-CG 3.49Å; Q167-R171 PolarHBondContact O-N 3.32Å; T168-R171 PolarHBondContact O-N 3.24Å; R171-L174 PolarHBondContact O-N 3.5Å; R171-A175 WeakPolarHBondContact O-CB 3.43Å; R171-A175 PolarHBondContact O-N 3.1Å
172	L	88.5	Confident	89.5	Confident	125 Å²	125	100 Å²	100	65%	0.654	51%	0.507	S	S	*	.	H	α-helix	trans	-64.6	-42.2	177.3	179	61.1	0	0	0	111.8	T168 E169 A175 K176	T168-L172 WeakPolarHBondContact O-CB 3.36Å; T168-L172 PolarHBondContact O-N 3.37Å; E169-L172 PolarHBondContact O-N 2.73Å; L172-A175 PolarHBondContact O-N 3.34Å; L172-K176 WeakPolarHBondContact O-CB 3.39Å; L172-K176 PolarHBondContact O-N 2.84Å
173	Q	91.1	Very high	89.6	Confident	85 Å²	85	102.1 Å²	102.1	40%	0.397	51%	0.512	S	S	.	.	H	α-helix	trans	-64.5	-43.3	177.3	-177.9	54.3	40.1	0	0	111.8	E169 L170 A175 K176 D177	E169-Q173 PolarHBondContact O-N 3.32Å; L170-Q173 PolarHBondContact O-N 3.42Å; Q173-A175 PolarHBondContact O-N 3.13Å; Q173-K176 WeakPolarHBondContact O-CB 3.46Å; Q173-K176 PolarHBondContact O-N 3.21Å; Q173-D177 PolarHBondContact NE2-OD1 2.96Å; Q173-D177 PolarHBondContact NE2-OD2 3.28Å; Q173-D177 PolarHBondContact O-N 3.34Å
174	L	92.3	Very high	89.7	Confident	122 Å²	122	101.7 Å²	101.7	64%	0.639	51%	0.509	S	S	*	.	H	α-helix	trans	-61.6	-40.7	174.7	-70.4	170.3	0	0	0	112.5	L170 R171 D177 Q178	L170-L174 WeakPolarHBondContact O-CG 3.47Å; L170-L174 PolarHBondContact O-N 2.9Å; L170-L174 VanDerWaalsContact O-N 3.08Å; R171-L174 PolarHBondContact O-N 3.5Å; L174-D177 PolarHBondContact O-N 2.87Å; L174-Q178 PolarHBondContact O-N 2.82Å
175	A	87.5	Confident	89.8	Confident	49 Å²	49	104.1 Å²	104.1	41%	0.405	51%	0.512	S	S	.	.	H	α-helix	trans	-65.6	-39.8	175.4	0	0	0	0	0	112.2	R171 L172 Q173 Q178 V179	R171-A175 WeakPolarHBondContact O-CB 3.43Å; R171-A175 PolarHBondContact O-N 3.1Å; L172-A175 PolarHBondContact O-N 3.34Å; Q173-A175 PolarHBondContact O-N 3.13Å; A175-Q178 WeakPolarHBondContact O-CB 3.44Å; A175-Q178 PolarHBondContact O-N 3.18Å; A175-V179 WeakPolarHBondContact O-CG2 3.44Å; A175-V179 PolarHBondContact O-N 3.01Å
176	K	92.5	Very high	89.9	Confident	126 Å²	126	106.1 Å²	106.1	55%	0.548	52%	0.516	S	S	.	.	H	α-helix	trans	-62.2	-45.6	175	-178.2	-178.9	175.4	-174.9	0	111.8	L172 Q173 Q178 V179 S180	L172-K176 WeakPolarHBondContact O-CB 3.39Å; L172-K176 PolarHBondContact O-N 2.84Å; Q173-K176 WeakPolarHBondContact O-CB 3.46Å; Q173-K176 PolarHBondContact O-N 3.21Å; K176-Q178 VanDerWaalsContact C-N 3.25Å; K176-Q178 PolarHBondContact O-N 3.44Å; K176-V179 PolarHBondContact O-N 3.42Å; K176-V179 VanDerWaalsContact O-N 3.15Å; K176-S180 PolarHBondContact O-N 3.17Å
177	D	92.6	Very high	89.9	Confident	77 Å²	77	104.1 Å²	104.1	41%	0.412	51%	0.513	S	S	.	.	H	α-helix	trans	-65.3	-29.8	177.1	-66.6	-25.3	0	0	0	112.1	Q173 L174 R181	Q173-D177 PolarHBondContact NE2-OD1 2.96Å; Q173-D177 PolarHBondContact NE2-OD2 3.28Å; Q173-D177 PolarHBondContact O-N 3.34Å; L174-D177 PolarHBondContact O-N 2.87Å; D177-R181 WeakPolarHBondContact O-CD 3.33Å; D177-R181 VanDerWaalsContact O-CG 3.25Å; D177-R181 WeakPolarHBondContact O-CG 3.45Å; D177-R181 PolarHBondContact O-N 2.95Å
178	Q	90.9	Very high	89.9	Confident	128 Å²	128	104.3 Å²	104.3	60%	0.598	51%	0.514	S	S	*	.	H	α-helix	trans	-69.5	-43.5	170.3	179.6	176.6	-14.6	0	0	112.2	L174 A175 K176 R181 L182	L174-Q178 PolarHBondContact O-N 2.82Å; A175-Q178 WeakPolarHBondContact O-CB 3.44Å; A175-Q178 PolarHBondContact O-N 3.18Å; K176-Q178 VanDerWaalsContact C-N 3.25Å; K176-Q178 PolarHBondContact O-N 3.44Å; Q178-R181 PolarHBondContact O-N 2.95Å; Q178-L182 WeakPolarHBondContact O-CG 3.37Å; Q178-L182 PolarHBondContact O-N 3.15Å
179	V	90.1	Very high	90.1	Very high	77 Å²	77	109.7 Å²	109.7	47%	0.467	53%	0.526	S	S	.	.	H	α-helix	trans	-60.9	-50.3	177.8	169.6	0	0	0	0	110.9	A175 K176 R181 L182 E183	A175-V179 WeakPolarHBondContact O-CG2 3.44Å; A175-V179 PolarHBondContact O-N 3.01Å; K176-V179 PolarHBondContact O-N 3.42Å; K176-V179 VanDerWaalsContact O-N 3.15Å; V179-R181 PolarHBondContact O-N 3.26Å; V179-L182 WeakPolarHBondContact O-CA 3.39Å; V179-L182 WeakPolarHBondContact O-CB 3.26Å; V179-L182 PolarHBondContact O-N 3.08Å; V179-E183 HydrophobicContact CG1-CG 4.16Å; V179-E183 WeakPolarHBondContact O-CG 3.44Å; V179-E183 PolarHBondContact O-N 3.24Å
180	S	91.2	Very high	90.4	Very high	56 Å²	56	109.4 Å²	109.4	39%	0.392	52%	0.524	S	S	.	.	H	α-helix	trans	-67.3	-22.1	-179.3	-64	0	0	0	0	114.3	K176 L182 E183 V184	K176-S180 PolarHBondContact O-N 3.17Å; S180-L182 VanDerWaalsContact C-N 3.33Å; S180-E183 VanDerWaalsContact CA-OE2 3.23Å; S180-E183 WeakPolarHBondContact CA-OE2 3.25Å; S180-E183 PolarHBondContact OG-OE2 3.15Å; S180-V184 WeakPolarHBondContact O-CG2 3.37Å; S180-V184 PolarHBondContact O-N 3.43Å
181	R	89.1	Confident	90.5	Very high	196 Å²	196	110.1 Å²	110.1	74%	0.74	52%	0.522	S	S	*	.	H	α-helix	trans	-72.2	-23.4	167.6	-76.8	172.5	170.4	-165.2	-2.1	113.9	D177 Q178 V179	D177-R181 WeakPolarHBondContact O-CD 3.33Å; D177-R181 VanDerWaalsContact O-CG 3.25Å; D177-R181 WeakPolarHBondContact O-CG 3.45Å; D177-R181 PolarHBondContact O-N 2.95Å; Q178-R181 PolarHBondContact O-N 2.95Å; V179-R181 PolarHBondContact O-N 3.26Å
182	L	87.8	Confident	90.6	Very high	103 Å²	103	106.8 Å²	106.8	54%	0.539	51%	0.512	S	S	.	.	H	α-helix	trans	-85.1	-41.1	173.6	-66.1	170.6	0	0	0	111.2	Q178 V179 S180 V184 K185 E186	Q178-L182 WeakPolarHBondContact O-CG 3.37Å; Q178-L182 PolarHBondContact O-N 3.15Å; V179-L182 WeakPolarHBondContact O-CA 3.39Å; V179-L182 WeakPolarHBondContact O-CB 3.26Å; V179-L182 PolarHBondContact O-N 3.08Å; S180-L182 VanDerWaalsContact C-N 3.33Å; L182-V184 VanDerWaalsContact C-N 3.3Å; L182-V184 PolarHBondContact O-N 3.45Å; L182-K185 PolarHBondContact O-N 3.03Å; L182-K185 VanDerWaalsContact O-N 3.07Å; L182-E186 PolarHBondContact O-N 3.47Å
183	E	90.2	Very high	90.4	Very high	94 Å²	94	107 Å²	107	44%	0.439	51%	0.51	S	S	.	.	H	α-helix	trans	-55.5	-42.4	175.6	-67	174.1	139	0	0	112.1	V179 S180 E186 Q187	V179-E183 HydrophobicContact CG1-CG 4.16Å; V179-E183 WeakPolarHBondContact O-CG 3.44Å; V179-E183 PolarHBondContact O-N 3.24Å; S180-E183 VanDerWaalsContact CA-OE2 3.23Å; S180-E183 WeakPolarHBondContact CA-OE2 3.25Å; S180-E183 PolarHBondContact OG-OE2 3.15Å; E183-E186 PolarHBondContact O-N 3.05Å; E183-Q187 WeakPolarHBondContact O-CG 3.4Å; E183-Q187 PolarHBondContact O-N 2.91Å
184	V	91.9	Very high	90.5	Very high	79 Å²	79	107.7 Å²	107.7	48%	0.479	52%	0.516	S	S	.	.	H	α-helix	trans	-62.9	-42.9	175.8	171.3	0	0	0	0	111.7	S180 L182 Q187 E188	S180-V184 WeakPolarHBondContact O-CG2 3.37Å; S180-V184 PolarHBondContact O-N 3.43Å; L182-V184 VanDerWaalsContact C-N 3.3Å; L182-V184 PolarHBondContact O-N 3.45Å; V184-Q187 WeakPolarHBondContact O-CB 3.34Å; V184-Q187 PolarHBondContact O-N 3.43Å; V184-E188 WeakPolarHBondContact O-CG 3.43Å; V184-E188 PolarHBondContact O-N 2.95Å
185	K	91.9	Very high	90.5	Very high	112 Å²	112	108.3 Å²	108.3	49%	0.487	51%	0.51	S	S	.	.	H	α-helix	trans	-67	-36.1	177.5	-72	-176.3	176.2	-171.8	0	112.5	L182 Q187 E188 W189	L182-K185 PolarHBondContact O-N 3.03Å; L182-K185 VanDerWaalsContact O-N 3.07Å; K185-Q187 VanDerWaalsContact C-N 3.32Å; K185-Q187 PolarHBondContact O-N 3.35Å; K185-E188 PolarHBondContact O-N 2.88Å; K185-W189 PolarHBondContact O-N 2.95Å
186	E	87.7	Confident	90.6	Very high	95 Å²	95	109.8 Å²	109.8	44%	0.444	51%	0.511	S	S	.	.	H	α-helix	trans	-63.2	-39.6	173.4	-164.3	-168.1	155.3	0	0	111.2	L182 E183 W189 K190	L182-E186 PolarHBondContact O-N 3.47Å; E183-E186 PolarHBondContact O-N 3.05Å; E186-W189 PolarHBondContact O-N 2.97Å; E186-K190 WeakPolarHBondContact O-CB 3.37Å; E186-K190 WeakPolarHBondContact O-CG 3.35Å; E186-K190 PolarHBondContact O-N 3.41Å; E186-K190 WeakPolarHBondContact OE1-CE 3.27Å; E186-K190 IonicContact OE1-NZ 3.51Å; E186-K190 PolarHBondContact OE1-NZ 2.87Å
187	Q	89.8	Confident	90.6	Very high	114 Å²	114	108.9 Å²	108.9	53%	0.533	51%	0.508	S	S	.	.	H	α-helix	trans	-68	-31.7	173.2	-69.3	-178	27.3	0	0	113.3	E183 V184 K185 K191	E183-Q187 WeakPolarHBondContact O-CG 3.4Å; E183-Q187 PolarHBondContact O-N 2.91Å; V184-Q187 WeakPolarHBondContact O-CB 3.34Å; V184-Q187 PolarHBondContact O-N 3.43Å; K185-Q187 VanDerWaalsContact C-N 3.32Å; K185-Q187 PolarHBondContact O-N 3.35Å; Q187-K191 WeakPolarHBondContact O-CD 3.42Å; Q187-K191 VanDerWaalsContact O-CG 3.26Å; Q187-K191 WeakPolarHBondContact O-CG 3.21Å; Q187-K191 PolarHBondContact O-N 3.46Å
188	E	90.6	Very high	90.6	Very high	107 Å²	107	111.6 Å²	111.6	50%	0.5	52%	0.518	S	S	.	.	H	α-helix	trans	-68.7	-46.3	172.2	-71.6	175	158.9	0	0	111.4	V184 K185 K190 K191 E192	V184-E188 WeakPolarHBondContact O-CG 3.43Å; V184-E188 PolarHBondContact O-N 2.95Å; K185-E188 PolarHBondContact O-N 2.88Å; E188-K190 PolarHBondContact O-N 3.16Å; E188-K191 WeakPolarHBondContact O-CB 3.33Å; E188-K191 PolarHBondContact O-N 2.92Å; E188-K191 VanDerWaalsContact O-N 3.11Å; E188-E192 PolarHBondContact O-N 2.96Å; E188-E192 VanDerWaalsContact O-N 3.1Å
189	W	88.9	Confident	90.6	Very high	185 Å²	185	110.9 Å²	110.9	70%	0.701	52%	0.515	S	S	*	.	H	α-helix	trans	-62.5	-40.8	177	-66.6	-17.4	0	0	0	112.5	K185 E186 K191 E192 E193	K185-W189 PolarHBondContact O-N 2.95Å; E186-W189 PolarHBondContact O-N 2.97Å; W189-K191 VanDerWaalsContact C-N 3.28Å; W189-K191 PolarHBondContact O-N 2.96Å; W189-E192 PolarHBondContact O-N 3.25Å; W189-E193 WeakPolarHBondContact O-CB 3.29Å; W189-E193 PolarHBondContact O-N 3.22Å
190	K	92.5	Very high	90.6	Very high	99 Å²	99	111.6 Å²	111.6	43%	0.43	52%	0.515	S	S	.	.	H	α-helix	trans	-63.7	-28.8	173.5	-73.8	173.2	-175.9	172	0	113.3	E186 E188 N194	E186-K190 WeakPolarHBondContact O-CB 3.37Å; E186-K190 WeakPolarHBondContact O-CG 3.35Å; E186-K190 PolarHBondContact O-N 3.41Å; E186-K190 WeakPolarHBondContact OE1-CE 3.27Å; E186-K190 IonicContact OE1-NZ 3.51Å; E186-K190 PolarHBondContact OE1-NZ 2.87Å; E188-K190 PolarHBondContact O-N 3.16Å; K190-N194 PolarHBondContact O-N 2.88Å; K190-N194 PolarHBondContact O-ND2 2.95Å
191	K	93.7	Very high	90.6	Very high	136 Å²	136	111.6 Å²	111.6	59%	0.591	51%	0.511	S	S	*	.	H	α-helix	trans	-72.1	-42.8	174	-72.2	162.5	-169.9	166.4	0	111.2	Q187 E188 W189 N194 R195	Q187-K191 WeakPolarHBondContact O-CD 3.42Å; Q187-K191 VanDerWaalsContact O-CG 3.26Å; Q187-K191 WeakPolarHBondContact O-CG 3.21Å; Q187-K191 PolarHBondContact O-N 3.46Å; E188-K191 WeakPolarHBondContact O-CB 3.33Å; E188-K191 PolarHBondContact O-N 2.92Å; E188-K191 VanDerWaalsContact O-N 3.11Å; W189-K191 VanDerWaalsContact C-N 3.28Å; W189-K191 PolarHBondContact O-N 2.96Å; K191-N194 PolarHBondContact O-N 3.01Å; K191-R195 PolarHBondContact O-N 3.09Å
192	E	91.4	Very high	90.7	Very high	78 Å²	78	107.5 Å²	107.5	36%	0.364	50%	0.5	S	S	.	.	H	α-helix	trans	-70.9	-35.3	177.6	-173.1	60.4	-168.1	0	0	112.4	E188 W189 N194 R195 L196	E188-E192 PolarHBondContact O-N 2.96Å; E188-E192 VanDerWaalsContact O-N 3.1Å; W189-E192 PolarHBondContact O-N 3.25Å; E192-N194 PolarHBondContact O-N 3.02Å; E192-R195 PolarHBondContact O-N 3.15Å; E192-R195 IonicContact OE1-CZ 3.91Å; E192-R195 IonicContact OE1-NE 3.63Å; E192-R195 PolarHBondContact OE1-NE 2.69Å; E192-R195 IonicContact OE1-NH2 3.39Å; E192-R195 PolarHBondContact OE1-NH2 2.84Å; E192-R195 IonicContact OE2-CZ 3.65Å; E192-R195 IonicContact OE2-NE 2.67Å; E192-R195 PolarHBondContact OE2-NE 2.87Å; E192-R195 IonicContact OE2-NH2 2.76Å; E192-L196 HydrophobicContact CG-CD1 4.15Å; E192-L196 HydrophobicContact CG-CG 4.42Å; E192-L196 WeakPolarHBondContact O-CB 3.32Å; E192-L196 VanDerWaalsContact O-CG 3.29Å; E192-L196 WeakPolarHBondContact O-CG 3.44Å; E192-L196 PolarHBondContact O-N 3.01Å
193	E	85.9	Confident	90.9	Very high	130 Å²	130	105.8 Å²	105.8	61%	0.607	49%	0.491	S	S	*	.	H	α-helix	trans	-56.4	-49.5	170.5	-178.7	178.6	-159.7	0	0	111.2	W189 R195 L196 H197	W189-E193 WeakPolarHBondContact O-CB 3.29Å; W189-E193 PolarHBondContact O-N 3.22Å; E193-R195 PolarHBondContact O-N 3.26Å; E193-L196 PolarHBondContact O-N 3.27Å; E193-H197 WeakPolarHBondContact O-CB 3.33Å; E193-H197 PolarHBondContact O-N 3.31Å
194	N	91.4	Very high	91	Very high	98 Å²	98	105.5 Å²	105.5	52%	0.524	49%	0.492	S	S	.	.	H	α-helix	trans	-61.5	-42.8	175	-76.9	-55.7	0	0	0	112.1	K190 K191 E192 L196 H197 E198	K190-N194 PolarHBondContact O-N 2.88Å; K190-N194 PolarHBondContact O-ND2 2.95Å; K191-N194 PolarHBondContact O-N 3.01Å; E192-N194 PolarHBondContact O-N 3.02Å; N194-L196 VanDerWaalsContact C-N 3.34Å; N194-L196 PolarHBondContact O-N 3.08Å; N194-H197 WeakPolarHBondContact O-CB 3.45Å; N194-H197 PolarHBondContact O-N 3.28Å; N194-H197 VanDerWaalsContact O-N 3.15Å; N194-E198 WeakPolarHBondContact O-CG 3.43Å; N194-E198 PolarHBondContact O-N 3.07Å
195	R	92.8	Very high	90.9	Very high	136 Å²	136	108.9 Å²	108.9	51%	0.513	50%	0.496	S	S	.	.	H	α-helix	trans	-63.4	-38.2	178.2	-161.1	-173	73.5	80.1	3.6	112.6	K191 E192 E193 H199	K191-R195 PolarHBondContact O-N 3.09Å; E192-R195 PolarHBondContact O-N 3.15Å; E192-R195 IonicContact OE1-CZ 3.91Å; E192-R195 IonicContact OE1-NE 3.63Å; E192-R195 PolarHBondContact OE1-NE 2.69Å; E192-R195 IonicContact OE1-NH2 3.39Å; E192-R195 PolarHBondContact OE1-NH2 2.84Å; E192-R195 IonicContact OE2-CZ 3.65Å; E192-R195 IonicContact OE2-NE 2.67Å; E192-R195 PolarHBondContact OE2-NE 2.87Å; E192-R195 IonicContact OE2-NH2 2.76Å; E193-R195 PolarHBondContact O-N 3.26Å; R195-H199 PolarHBondContact O-N 2.94Å; R195-H199 VanDerWaalsContact O-N 3.08Å
196	L	89.9	Confident	90.8	Very high	80 Å²	80	106 Å²	106	42%	0.419	49%	0.491	S	S	.	.	H	α-helix	trans	-70.3	-35.6	173.7	-70.7	170	0	0	0	111.6	E192 E193 N194 H199 L200	E192-L196 HydrophobicContact CG-CD1 4.15Å; E192-L196 HydrophobicContact CG-CG 4.42Å; E192-L196 WeakPolarHBondContact O-CB 3.32Å; E192-L196 VanDerWaalsContact O-CG 3.29Å; E192-L196 WeakPolarHBondContact O-CG 3.44Å; E192-L196 PolarHBondContact O-N 3.01Å; E193-L196 PolarHBondContact O-N 3.27Å; N194-L196 VanDerWaalsContact C-N 3.34Å; N194-L196 PolarHBondContact O-N 3.08Å; L196-H199 PolarHBondContact O-N 3.48Å; L196-L200 WeakPolarHBondContact O-CB 3.49Å; L196-L200 PolarHBondContact O-N 3.32Å
197	H	92.7	Very high	90.7	Very high	106 Å²	106	104.7 Å²	104.7	49%	0.491	49%	0.486	S	S	.	.	H	α-helix	trans	-67.1	-40.7	174.6	-168.4	81	0	0	0	112.1	E193 N194 L200 N201	E193-H197 WeakPolarHBondContact O-CB 3.33Å; E193-H197 PolarHBondContact O-N 3.31Å; N194-H197 WeakPolarHBondContact O-CB 3.45Å; N194-H197 PolarHBondContact O-N 3.28Å; N194-H197 VanDerWaalsContact O-N 3.15Å; H197-L200 PolarHBondContact O-N 3.45Å; H197-N201 PolarHBondContact CD2-ND2 3.3Å; H197-N201 PolarHBondContact NE2-ND2 2.89Å; H197-N201 PolarHBondContact O-N 3.48Å; H197-N201 PolarHBondContact O-ND2 2.87Å
198	E	91.6	Very high	90.7	Very high	134 Å²	134	102.7 Å²	102.7	63%	0.626	48%	0.482	S	S	*	.	H	α-helix	trans	-59.9	-46.8	170.7	-73.4	178	169	0	0	111.5	N194 L200 N201 E202	N194-E198 WeakPolarHBondContact O-CG 3.43Å; N194-E198 PolarHBondContact O-N 3.07Å; E198-L200 PolarHBondContact O-N 2.82Å; E198-N201 PolarHBondContact O-N 2.95Å; E198-E202 PolarHBondContact O-N 2.84Å
199	H	92.2	Very high	90.6	Very high	114 Å²	114	103 Å²	103	53%	0.528	48%	0.483	S	S	.	.	H	α-helix	trans	-63.4	-39	177.7	-175	53.3	0	0	0	113	R195 L196 E202 L203	R195-H199 PolarHBondContact O-N 2.94Å; R195-H199 VanDerWaalsContact O-N 3.08Å; L196-H199 PolarHBondContact O-N 3.48Å; H199-E202 PolarHBondContact O-N 2.82Å; H199-L203 WeakPolarHBondContact O-CB 3.37Å; H199-L203 PolarHBondContact O-N 3.09Å
200	L	90	Very high	90.4	Very high	91 Å²	91	98 Å²	98	48%	0.476	47%	0.47	S	S	.	.	H	α-helix	trans	-60.3	-46	173.3	-176.9	74.6	0	0	0	111.2	L196 H197 E198 E202 L203 I204	L196-L200 WeakPolarHBondContact O-CB 3.49Å; L196-L200 PolarHBondContact O-N 3.32Å; H197-L200 PolarHBondContact O-N 3.45Å; E198-L200 PolarHBondContact O-N 2.82Å; L200-E202 VanDerWaalsContact C-N 3.34Å; L200-E202 PolarHBondContact O-N 2.89Å; L200-L203 PolarHBondContact O-N 3.05Å; L200-I204 HydrophobicContact CG-CD1 4.06Å; L200-I204 VanDerWaalsContact O-CG1 3.27Å; L200-I204 WeakPolarHBondContact O-CG1 3.38Å; L200-I204 PolarHBondContact O-N 2.99Å
201	N	90.9	Very high	90.1	Very high	57 Å²	57	96.5 Å²	96.5	31%	0.305	47%	0.469	S	S	.	.	H	α-helix	trans	-64.3	-37.7	178.5	-75.3	-50	0	0	0	112.2	H197 E198 I204 R205	H197-N201 PolarHBondContact CD2-ND2 3.3Å; H197-N201 PolarHBondContact NE2-ND2 2.89Å; H197-N201 PolarHBondContact O-N 3.48Å; H197-N201 PolarHBondContact O-ND2 2.87Å; E198-N201 PolarHBondContact O-N 2.95Å; N201-I204 PolarHBondContact O-N 3.32Å; N201-R205 WeakPolarHBondContact O-CG 3.39Å; N201-R205 PolarHBondContact O-N 2.59Å
202	E	91.7	Very high	89.6	Confident	109 Å²	109	95 Å²	95	51%	0.509	46%	0.464	S	S	.	.	H	α-helix	trans	-66.6	-42.1	174.6	-160.9	72	164.8	0	0	112.1	E198 H199 L200 I204 R205 S206	E198-E202 PolarHBondContact O-N 2.84Å; H199-E202 PolarHBondContact O-N 2.82Å; L200-E202 VanDerWaalsContact C-N 3.34Å; L200-E202 PolarHBondContact O-N 2.89Å; E202-I204 VanDerWaalsContact C-N 3.3Å; E202-I204 PolarHBondContact O-N 3.45Å; E202-R205 WeakPolarHBondContact O-CB 3.34Å; E202-R205 PolarHBondContact O-N 3.14Å; E202-R205 WeakPolarHBondContact OE2-CD 3.44Å; E202-R205 IonicContact OE2-CZ 3.86Å; E202-R205 IonicContact OE2-NE 3.18Å; E202-R205 IonicContact OE2-NH1 2.66Å; E202-R205 PolarHBondContact OE2-NH1 3.28Å; E202-S206 PolarHBondContact O-N 3.45Å
203	L	90.4	Very high	89.2	Confident	67 Å²	67	96.4 Å²	96.4	35%	0.351	47%	0.471	S	S	.	.	H	α-helix	trans	-63.6	-36.1	174.7	-170.9	66.6	0	0	0	111.7	H199 L200 N207	H199-L203 WeakPolarHBondContact O-CB 3.37Å; H199-L203 PolarHBondContact O-N 3.09Å; L200-L203 PolarHBondContact O-N 3.05Å; L203-N207 WeakPolarHBondContact O-CB 3.4Å; L203-N207 PolarHBondContact O-N 3.38Å; L203-N207 PolarHBondContact O-ND2 3.38Å
204	I	92.5	Very high	89	Confident	88 Å²	88	95 Å²	95	45%	0.451	47%	0.466	S	S	.	.	H	α-helix	trans	-64.4	-44.9	173.8	-71.9	164.7	0	0	0	111	L200 N201 E202 N207 V208	L200-I204 HydrophobicContact CG-CD1 4.06Å; L200-I204 VanDerWaalsContact O-CG1 3.27Å; L200-I204 WeakPolarHBondContact O-CG1 3.38Å; L200-I204 PolarHBondContact O-N 2.99Å; N201-I204 PolarHBondContact O-N 3.32Å; E202-I204 VanDerWaalsContact C-N 3.3Å; E202-I204 PolarHBondContact O-N 3.45Å; I204-N207 PolarHBondContact O-N 2.88Å; I204-V208 WeakPolarHBondContact O-CG2 3.03Å; I204-V208 PolarHBondContact O-N 2.82Å
205	R	90.9	Very high	88.5	Confident	150 Å²	150	96 Å²	96	57%	0.566	47%	0.466	S	S	*	.	H	α-helix	trans	-56.2	-53	175.5	-69.8	165.5	-175.2	152.5	2	111.1	N201 E202 N207 V208 E209	N201-R205 WeakPolarHBondContact O-CG 3.39Å; N201-R205 PolarHBondContact O-N 2.59Å; E202-R205 WeakPolarHBondContact O-CB 3.34Å; E202-R205 PolarHBondContact O-N 3.14Å; E202-R205 WeakPolarHBondContact OE2-CD 3.44Å; E202-R205 IonicContact OE2-CZ 3.86Å; E202-R205 IonicContact OE2-NE 3.18Å; E202-R205 IonicContact OE2-NH1 2.66Å; E202-R205 PolarHBondContact OE2-NH1 3.28Å; R205-N207 VanDerWaalsContact C-N 3.33Å; R205-N207 PolarHBondContact O-N 3.3Å; R205-V208 WeakPolarHBondContact O-CB 3.34Å; R205-V208 PolarHBondContact O-N 2.96Å; R205-E209 PolarHBondContact O-N 2.87Å
206	S	88.8	Confident	87.7	Confident	53 Å²	53	96.6 Å²	96.6	37%	0.371	47%	0.473	S	S	.	.	H	α-helix	trans	-60.4	-39.2	179.8	-175.1	0	0	0	0	112.9	E202 V208 E209 L210	E202-S206 PolarHBondContact O-N 3.45Å; S206-V208 VanDerWaalsContact C-N 3.35Å; S206-V208 PolarHBondContact O-N 2.75Å; S206-E209 PolarHBondContact O-N 2.98Å; S206-L210 WeakPolarHBondContact O-CG 3.39Å; S206-L210 PolarHBondContact O-N 3.1Å
207	N	85.8	Confident	86.9	Confident	66 Å²	66	97.5 Å²	97.5	35%	0.353	48%	0.477	S	S	.	.	H	α-helix	trans	-69.1	-29.8	175.4	-82.5	-82.6	0	0	0	113.3	L203 I204 R205 T211	L203-N207 WeakPolarHBondContact O-CB 3.4Å; L203-N207 PolarHBondContact O-N 3.38Å; L203-N207 PolarHBondContact O-ND2 3.38Å; I204-N207 PolarHBondContact O-N 2.88Å; R205-N207 VanDerWaalsContact C-N 3.33Å; R205-N207 PolarHBondContact O-N 3.3Å; N207-T211 VanDerWaalsContact O-CB 3.31Å; N207-T211 WeakPolarHBondContact O-CB 3.3Å; N207-T211 PolarHBondContact O-N 2.97Å; N207-T211 PolarHBondContact O-OG1 2.74Å
208	V	90.7	Very high	85.6	Confident	73 Å²	73	96.8 Å²	96.8	44%	0.442	48%	0.477	S	S	.	.	H	α-helix	trans	-68	-47.7	171.8	169.6	0	0	0	0	110.4	I204 R205 S206 L210 T211 E212	I204-V208 WeakPolarHBondContact O-CG2 3.03Å; I204-V208 PolarHBondContact O-N 2.82Å; R205-V208 WeakPolarHBondContact O-CB 3.34Å; R205-V208 PolarHBondContact O-N 2.96Å; S206-V208 VanDerWaalsContact C-N 3.35Å; S206-V208 PolarHBondContact O-N 2.75Å; V208-L210 PolarHBondContact O-N 2.98Å; V208-T211 WeakPolarHBondContact O-CA 3.39Å; V208-T211 WeakPolarHBondContact O-CB 3.21Å; V208-T211 PolarHBondContact O-N 3.25Å; V208-T211 VanDerWaalsContact O-N 3.09Å; V208-E212 PolarHBondContact O-N 2.96Å
209	E	87.3	Confident	84.2	Confident	112 Å²	112	95.9 Å²	95.9	52%	0.523	48%	0.476	S	S	.	.	H	α-helix	trans	-57.5	-47.5	176.6	-68.2	169.7	-173.3	0	0	112.1	R205 S206 T211 E212 Q213	R205-E209 PolarHBondContact O-N 2.87Å; S206-E209 PolarHBondContact O-N 2.98Å; E209-T211 VanDerWaalsContact C-N 3.31Å; E209-T211 PolarHBondContact O-N 3.45Å; E209-E212 PolarHBondContact O-N 3.37Å; E209-E212 VanDerWaalsContact O-N 3.11Å; E209-Q213 WeakPolarHBondContact O-CG 3.47Å; E209-Q213 PolarHBondContact O-N 3.42Å
210	L	85.6	Confident	82.5	Confident	80 Å²	80	96.8 Å²	96.8	42%	0.419	49%	0.485	S	S	.	.	H	α-helix	trans	-61.6	-38.5	175	-71.1	170.8	0	0	0	112	S206 V208 E212 Q213 I214	S206-L210 WeakPolarHBondContact O-CG 3.39Å; S206-L210 PolarHBondContact O-N 3.1Å; V208-L210 PolarHBondContact O-N 2.98Å; L210-E212 VanDerWaalsContact C-N 3.28Å; L210-E212 PolarHBondContact O-N 3.5Å; L210-Q213 PolarHBondContact O-N 3.38Å; L210-I214 WeakPolarHBondContact O-CD1 3.46Å; L210-I214 VanDerWaalsContact O-CG1 3.27Å; L210-I214 WeakPolarHBondContact O-CG1 3.42Å; L210-I214 PolarHBondContact O-N 3.03Å
211	T	85.5	Confident	80.8	Confident	69 Å²	69	97.8 Å²	97.8	42%	0.423	49%	0.491	S	S	.	.	H	α-helix	trans	-64	-33.3	175	-62.4	0	0	0	0	111.8	N207 V208 E209 K215	N207-T211 VanDerWaalsContact O-CB 3.31Å; N207-T211 WeakPolarHBondContact O-CB 3.3Å; N207-T211 PolarHBondContact O-N 2.97Å; N207-T211 PolarHBondContact O-OG1 2.74Å; V208-T211 WeakPolarHBondContact O-CA 3.39Å; V208-T211 WeakPolarHBondContact O-CB 3.21Å; V208-T211 PolarHBondContact O-N 3.25Å; V208-T211 VanDerWaalsContact O-N 3.09Å; E209-T211 VanDerWaalsContact C-N 3.31Å; E209-T211 PolarHBondContact O-N 3.45Å; T211-K215 VanDerWaalsContact O-CG 3.3Å; T211-K215 WeakPolarHBondContact O-CG 3.37Å; T211-K215 PolarHBondContact O-N 3.46Å
212	E	82.8	Confident	78.9	Confident	103 Å²	103	102 Å²	102	48%	0.481	51%	0.509	S	S	.	.	H	α-helix	trans	-76.3	-39.2	176.5	-69.3	-176	171	0	0	112.6	V208 E209 L210 I214 K215 F216	V208-E212 PolarHBondContact O-N 2.96Å; E209-E212 PolarHBondContact O-N 3.37Å; E209-E212 VanDerWaalsContact O-N 3.11Å; L210-E212 VanDerWaalsContact C-N 3.28Å; L210-E212 PolarHBondContact O-N 3.5Å; E212-I214 VanDerWaalsContact C-N 3.35Å; E212-I214 PolarHBondContact O-N 3.1Å; E212-K215 WeakPolarHBondContact O-CB 3.39Å; E212-K215 PolarHBondContact O-N 2.89Å; E212-F216 PolarHBondContact O-N 3.28Å
213	Q	84.4	Confident	76.8	Confident	109 Å²	109	104.9 Å²	104.9	51%	0.509	53%	0.528	S	S	.	.	H	α-helix	trans	-59.2	-44.3	171.4	-67.9	173.4	28.4	0	0	111.7	E209 L210 K215 F216 I217	E209-Q213 WeakPolarHBondContact O-CG 3.47Å; E209-Q213 PolarHBondContact O-N 3.42Å; L210-Q213 PolarHBondContact O-N 3.38Å; Q213-K215 VanDerWaalsContact C-N 3.35Å; Q213-K215 PolarHBondContact O-N 3.33Å; Q213-F216 PolarHBondContact O-N 2.91Å; Q213-I217 WeakPolarHBondContact O-CG1 3.2Å; Q213-I217 PolarHBondContact O-N 3.15Å
214	I	81.4	Confident	74.8	Confident	99 Å²	99	109.6 Å²	109.6	51%	0.508	55%	0.548	S	S	.	.	H	α-helix	trans	-63.4	-38.5	177.1	-68.8	165.1	0	0	0	111.6	L210 E212 I217 N218	L210-I214 WeakPolarHBondContact O-CD1 3.46Å; L210-I214 VanDerWaalsContact O-CG1 3.27Å; L210-I214 WeakPolarHBondContact O-CG1 3.42Å; L210-I214 PolarHBondContact O-N 3.03Å; E212-I214 VanDerWaalsContact C-N 3.35Å; E212-I214 PolarHBondContact O-N 3.1Å; I214-I217 PolarHBondContact O-N 3.3Å; I214-N218 WeakPolarHBondContact O-CB 3.32Å; I214-N218 PolarHBondContact O-N 3.23Å
215	K	80.3	Confident	72.4	Confident	119 Å²	119	111.3 Å²	111.3	52%	0.517	57%	0.568	S	S	.	*	H	α-helix	trans	-62.1	-43.2	173.3	-72.1	166.6	-172.7	165.1	0	111.9	T211 E212 Q213 N218 N219	T211-K215 VanDerWaalsContact O-CG 3.3Å; T211-K215 WeakPolarHBondContact O-CG 3.37Å; T211-K215 PolarHBondContact O-N 3.46Å; E212-K215 WeakPolarHBondContact O-CB 3.39Å; E212-K215 PolarHBondContact O-N 2.89Å; Q213-K215 VanDerWaalsContact C-N 3.35Å; Q213-K215 PolarHBondContact O-N 3.33Å; K215-N218 PolarHBondContact O-N 2.93Å; K215-N219 PolarHBondContact O-N 3.32Å
216	F	76	Confident	69.6	Low	149 Å²	149	115.5 Å²	115.5	65%	0.654	58%	0.584	S	S	*	*	H	α-helix	trans	-61.8	-44.4	177	-100.1	-79.8	0	0	0	112.3	E212 Q213 N219 N220	E212-F216 PolarHBondContact O-N 3.28Å; Q213-F216 PolarHBondContact O-N 2.91Å; F216-N219 PolarHBondContact O-N 2.93Å; F216-N220 PolarHBondContact O-N 2.76Å
217	I	74.6	Confident	67.1	Low	100 Å²	100	119.9 Å²	119.9	51%	0.513	60%	0.603	S	S	.	*	H	α-helix	trans	-63.3	-43.2	177.2	-66.6	165.2	0	0	0	110.9	Q213 I214 N220 N221	Q213-I217 WeakPolarHBondContact O-CG1 3.2Å; Q213-I217 PolarHBondContact O-N 3.15Å; I214-I217 PolarHBondContact O-N 3.3Å; I217-N220 PolarHBondContact O-N 3.19Å; I217-N221 PolarHBondContact O-ND2 2.94Å
218	N	65	Low	64.8	Low	91 Å²	91	122.5 Å²	122.5	49%	0.487	62%	0.621	S	S	.	*	H	α-helix	trans	-68.5	-33.8	179.7	-78	-11.3	0	0	0	113.3	I214 K215 N220 N221	I214-N218 WeakPolarHBondContact O-CB 3.32Å; I214-N218 PolarHBondContact O-N 3.23Å; K215-N218 PolarHBondContact O-N 2.93Å; N218-N220 VanDerWaalsContact C-N 3.35Å; N218-N221 PolarHBondContact O-N 3.28Å
219	N	60.8	Low	62.2	Low	115 Å²	115	126.1 Å²	126.1	62%	0.615	64%	0.637	S	S	*	*	H	α-helix	trans	-67	-34.3	176	-81.3	2.6	0	0	0	112.7	K215 F216 N221	K215-N219 PolarHBondContact O-N 3.32Å; F216-N219 PolarHBondContact O-N 2.93Å; N219-N221 VanDerWaalsContact C-N 3.32Å; N219-N221 PolarHBondContact O-N 3.39Å
220	N	56.8	Low	59.6	Low	132 Å²	132	126.8 Å²	126.8	71%	0.706	64%	0.644	S	S	*	*	H	α-helix	trans	-78.4	-12	-178.9	-73.6	-12	0	0	0	114.3	F216 I217 N218	F216-N220 PolarHBondContact O-N 2.76Å; I217-N220 PolarHBondContact O-N 3.19Å; N218-N220 VanDerWaalsContact C-N 3.35Å
221	N	54.5	Low	57.1	Low	113 Å²	113	129.2 Å²	129.2	60%	0.604	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.2	1.6	-175.5	-75.3	-36.3	0	0	0	114.5	I217 N218 N219 D223	I217-N221 PolarHBondContact O-ND2 2.94Å; N218-N221 PolarHBondContact O-N 3.28Å; N219-N221 VanDerWaalsContact C-N 3.32Å; N219-N221 PolarHBondContact O-N 3.39Å; N221-D223 PolarHBondContact O-N 2.98Å
222	Q	51.9	Low	54.8	Low	146 Å²	146	133.9 Å²	133.9	68%	0.682	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.6	-3.5	-172	-82.1	-177.2	12.8	0	0	116.4	Q224	Q222-Q224 PolarHBondContact O-N 2.87Å
223	D	46.9	Very low	52.5	Low	169 Å²	169	136.1 Å²	136.1	90%	0.904	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-2.2	176.9	-90.2	-30.6	0	0	0	114.2	N221	N221-D223 PolarHBondContact O-N 2.98Å
224	Q	49.2	Very low	50.1	Low	165 Å²	165	139.1 Å²	139.1	77%	0.771	70%	0.702	S	S	*	*	S	Bend	trans	-130.3	143.3	173.8	-59.9	-170.6	23.2	0	0	111.8	Q222	Q222-Q224 PolarHBondContact O-N 2.87Å
225	S	40.8	Very low	47.8	Very low	125 Å²	125	144 Å²	144	87%	0.874	72%	0.719	S	S	*	*			trans	64.9	81.1	-177.1	66.8	0	0	0	0	117.2
226	R	32.1	Very low	45.6	Very low	238 Å²	238	147 Å²	147	90%	0.898	74%	0.735	S	S	*	*			trans	-76.7	128.2	154.8	-77.1	175.8	163.6	155.3	-5.3	110.4
227	N	35.8	Very low	43.5	Very low	145 Å²	145	144.9 Å²	144.9	78%	0.775	74%	0.738	S	S	*	*				166.8	152.7	123	-84.6	-22.3	0	0	0	113.2
228	T	38.4	Very low	41.7	Very low	121 Å²	121	143.7 Å²	143.7	74%	0.742	74%	0.737	S	S	*	*			trans	56.5	100.8	168.4	46.7	0	0	0	0	117.1
229	L	36.8	Very low	40.2	Very low	148 Å²	148	150.3 Å²	150.3	78%	0.775	76%	0.756	S	S	*	*				62.5	131.1	82.8	-82	93.3	0	0	0	114.3
230	N	32	Very low	38.7	Very low	126 Å²	126	153.1 Å²	153.1	67%	0.674	76%	0.762	S	S	*	*			cis	-165.9	163.3	-10.8	-129.4	4.4	0	0	0	112.3
231	N	34	Very low	37.7	Very low	132 Å²	132	154.8 Å²	154.8	71%	0.706	77%	0.77	S	S	*	*			trans	78.3	136.1	156	-62.2	-15.4	0	0	0	122.9
232	H	37.1	Very low	36.5	Very low	167 Å²	167	154.1 Å²	154.1	77%	0.773	78%	0.775	S	S	*	*			trans	80.3	53.6	144.2	-80.3	49.7	0	0	0	121.8
233	I	33.1	Very low	35.8	Very low	150 Å²	150	156.2 Å²	156.2	77%	0.769	79%	0.786	S	S	*	*				16.9	108.4	109.7	-55.3	163.6	0	0	0	116.8
234	H	34.7	Very low	35	Very low	171 Å²	171	154.8 Å²	154.8	79%	0.792	78%	0.779	S	S	*	*				-165.1	154.8	117.6	-117	18.8	0	0	0	114
235	K	33	Very low	34.3	Very low	202 Å²	202	152.2 Å²	152.2	88%	0.878	78%	0.779	S	S	*	*			trans	-63.3	154.4	-159.7	-63.6	172	171.6	-179.1	0	117.1
236	H	34	Very low	34.1	Very low	182 Å²	182	150.8 Å²	150.8	84%	0.843	77%	0.767	S	S	*	*			trans	-110	147.2	171.2	-84.7	-86.3	0	0	0	113.7
237	S	32.3	Very low	34.1	Very low	104 Å²	104	148.8 Å²	148.8	73%	0.727	77%	0.765	S	S	*	*			trans	65.2	165.8	145.3	-104.2	0	0	0	0	121.6
238	P	37.5	Very low	34	Very low	75 Å²	75	152.1 Å²	152.1	49%	0.487	77%	0.768	S	S	.	*			cis	-132.3	138.6	-10.7	28.6	-7.3	0	0	0	117.6
239	R	32.5	Very low	33.5	Very low	231 Å²	231	153.3 Å²	153.3	87%	0.872	77%	0.77	S	S	*	*				39.6	118.9	128	-159.2	174.2	-64.6	-161.7	0.2	123.2
240	K	30	Very low	33.3	Very low	174 Å²	174	154.9 Å²	154.9	76%	0.757	78%	0.778	S	S	*	*			trans	2.2	140	146.1	-55.6	177.3	-178.8	176.2	0	120.1	E342	K240-E342 IonicContact NZ-OE1 3.29Å
241	L	34.8	Very low	33.1	Very low	167 Å²	167	155.6 Å²	155.6	87%	0.874	79%	0.787	S	S	*	*			trans	-131.5	154.7	139.1	-84.4	-179.6	0	0	0	110.7
242	S	29.4	Very low	33	Very low	99 Å²	99	153.1 Å²	153.1	69%	0.692	79%	0.793	S	S	*	*			trans	-148.4	151.9	-177.8	177.6	0	0	0	0	109.6
243	M	37	Very low	32.7	Very low	189 Å²	189	150.4 Å²	150.4	93%	0.931	79%	0.793	S	S	*	*			trans	-141.6	151.5	170.7	-86.8	-60.1	-156.5	0	0	111.5
244	N	31.3	Very low	32.8	Very low	139 Å²	139	150.1 Å²	150.1	74%	0.743	80%	0.798	S	S	*	*			trans	-116	153	-158	-79.3	-25.3	0	0	0	115.1
245	S	34	Very low	32.6	Very low	112 Å²	112	148.9 Å²	148.9	78%	0.783	80%	0.797	S	S	*	*			trans	71	167.5	143	78	0	0	0	0	119
246	P	36.6	Very low	32.7	Very low	95 Å²	95	148 Å²	148	62%	0.617	80%	0.796	S	S	*	*			cis	-120.4	167.3	-8.4	30.4	-11.8	0	0	0	114.8	Y248	P246-Y248 HydrophobicContact CG-CE2 4.48Å
247	K	31.2	Very low	32.8	Very low	196 Å²	196	144.6 Å²	144.6	85%	0.852	78%	0.784	S	S	*	*			trans	-89.4	143.2	163.2	-67.1	179.7	-179.3	177.2	0	109.3
248	Y	34.2	Very low	33	Very low	215 Å²	215	147.3 Å²	147.3	84%	0.843	79%	0.785	S	S	*	*			trans	-104.8	125.3	166.5	-73.6	-88	0	0	0	109.6	P246	P246-Y248 HydrophobicContact CG-CE2 4.48Å
249	N	27.3	Very low	32.6	Very low	146 Å²	146	149 Å²	149	78%	0.781	80%	0.799	S	S	*	*			trans	-92	145.3	164.4	-68.5	-13.1	0	0	0	108.7
250	L	33.2	Very low	32.7	Very low	180 Å²	180	142.7 Å²	142.7	94%	0.942	79%	0.79	S	S	*	*			trans	-144.4	112.2	160	-148.4	77.5	0	0	0	109.8
251	T	28.3	Very low	32.9	Very low	141 Å²	141	139.8 Å²	139.8	87%	0.865	79%	0.787	S	S	*	*			trans	-93.6	154.4	168.6	45	0	0	0	0	109.5
252	G	31.6	Very low	32.8	Very low	80 Å²	80	138.6 Å²	138.6	83%	0.825	78%	0.78	S	S	*	*			trans	-168	94.3	-179.6	0	0	0	0	0	112.2
253	S	31.5	Very low	32.9	Very low	110 Å²	110	141.5 Å²	141.5	77%	0.769	79%	0.788	S	S	*	*			trans	-101.4	149.6	172.9	-58.3	0	0	0	0	110.9
254	T	33.6	Very low	32.7	Very low	145 Å²	145	135.5 Å²	135.5	89%	0.89	78%	0.775	S	S	*	*			trans	-139.3	124.9	159.7	48.8	0	0	0	0	109.4
255	N	30.7	Very low	32.6	Very low	145 Å²	145	135.1 Å²	135.1	78%	0.775	78%	0.783	S	S	*	*			trans	-100.1	153.6	179.7	-60.9	-31.1	0	0	0	111.2
256	H	36.6	Very low	32.6	Very low	182 Å²	182	134.7 Å²	134.7	84%	0.843	78%	0.78	S	S	*	*			trans	-176.5	150.6	150.4	-94.1	-36.2	0	0	0	109
257	D	36.2	Very low	32.2	Very low	111 Å²	111	136.9 Å²	136.9	59%	0.594	79%	0.785	S	S	*	*			cis	-167.9	160.2	-37.9	-131.3	-46.1	0	0	0	110
258	Q	36	Very low	32.4	Very low	162 Å²	162	134.2 Å²	134.2	76%	0.757	79%	0.785	S	S	*	*			trans	57.2	113.2	160.6	-65.5	160.2	52.1	0	0	118.9
259	S	29.5	Very low	32.2	Very low	111 Å²	111	131.8 Å²	131.8	78%	0.776	78%	0.781	S	S	*	*				74.6	157.9	108.1	-128.7	0	0	0	0	116.4
260	S	33.5	Very low	32.5	Very low	98 Å²	98	130.5 Å²	130.5	69%	0.685	78%	0.783	S	S	*	*			cis	-166.9	158.8	1.9	9.7	0	0	0	0	107.9
261	T	33.6	Very low	32.4	Very low	113 Å²	113	128.8 Å²	128.8	69%	0.693	78%	0.775	S	S	*	*			cis	-175.5	149.8	-8.8	26.5	0	0	0	0	110.2
262	I	33.4	Very low	32.6	Very low	141 Å²	141	126.8 Å²	126.8	72%	0.723	77%	0.767	S	S	*	*			trans	77.7	138.5	144.6	-69.4	165.7	0	0	0	120.8
263	D	31.7	Very low	32.7	Very low	160 Å²	160	130.7 Å²	130.7	86%	0.856	77%	0.768	S	S	*	*			trans	55.4	147.3	163.8	-62.3	-17.3	0	0	0	122.1
264	G	32	Very low	32.7	Very low	64 Å²	64	128.5 Å²	128.5	66%	0.66	76%	0.763	S	S	*	*			cis	163.1	148.7	-12	0	0	0	0	0	116.6
265	S	30.3	Very low	32.9	Very low	131 Å²	131	129.1 Å²	129.1	92%	0.916	77%	0.766	S	S	*	*			trans	80.2	149.1	155.6	-57.6	0	0	0	0	123.1
266	S	33.3	Very low	32.9	Very low	102 Å²	102	125.4 Å²	125.4	71%	0.713	76%	0.762	S	S	*	*			trans	74.2	103.9	169.2	-148.5	0	0	0	0	117.6
267	I	29	Very low	33	Very low	142 Å²	142	128.2 Å²	128.2	73%	0.728	77%	0.767	S	S	*	*				70.1	114.6	55	-54.1	164.1	0	0	0	113.5
268	V	35.5	Very low	32.8	Very low	139 Å²	139	130.9 Å²	130.9	84%	0.842	78%	0.781	S	S	*	*				-163.7	141.2	118.3	145.4	0	0	0	0	109.2
269	H	29.1	Very low	32.8	Very low	164 Å²	164	126.8 Å²	126.8	76%	0.759	78%	0.775	S	S	*	*			trans	-94.2	155.2	176.6	-67.8	-113.8	0	0	0	112.3
270	S	35	Very low	33.2	Very low	119 Å²	119	128.5 Å²	128.5	83%	0.832	78%	0.781	S	S	*	*			trans	-152.6	136.1	134.6	49.3	0	0	0	0	112.1
271	N	30.1	Very low	33.1	Very low	144 Å²	144	129.8 Å²	129.8	77%	0.77	79%	0.79	S	S	*	*			trans	-79.7	-178.5	-178.8	-49.8	-31.3	0	0	0	110.5
272	S	32.8	Very low	33.3	Very low	100 Å²	100	128.3 Å²	128.3	70%	0.699	80%	0.798	S	S	*	*				177.9	145.1	77.6	-159.5	0	0	0	0	113.8
273	L	34.5	Very low	33.2	Very low	161 Å²	161	125 Å²	125	84%	0.843	80%	0.799	S	S	*	*			trans	53.7	133.9	164.2	-92	69.3	0	0	0	119.3
274	G	31.2	Very low	33.4	Very low	65 Å²	65	128.2 Å²	128.2	67%	0.67	81%	0.805	S	S	*	*			cis	114.2	97.4	-12.6	0	0	0	0	0	116.1
275	V	37.4	Very low	33.2	Very low	157 Å²	157	133.2 Å²	133.2	95%	0.952	81%	0.811	S	S	*	*			trans	-145.3	143.5	155.7	-178	0	0	0	0	107.2
276	G	31.4	Very low	33.5	Very low	67 Å²	67	136.8 Å²	136.8	69%	0.691	81%	0.811	S	S	*	*			trans	-158.2	177.5	175.9	0	0	0	0	0	112.7
277	Y	38.2	Very low	33.7	Very low	241 Å²	241	137.2 Å²	137.2	95%	0.945	81%	0.805	S	S	*	*			trans	-144.6	141	166.3	47.9	-93.4	0	0	0	108.5
278	D	31.1	Very low	34	Very low	167 Å²	167	137.8 Å²	137.8	89%	0.893	81%	0.805	S	S	*	*			trans	-139.7	151.8	-170.3	-175.9	17.9	0	0	0	109.2
279	A	36.8	Very low	34.1	Very low	77 Å²	77	139.2 Å²	139.2	64%	0.636	81%	0.807	S	S	*	*			trans	-152.3	113.4	-174.8	0	0	0	0	0	114.2
280	T	37.5	Very low	34.5	Very low	146 Å²	146	135.7 Å²	135.7	90%	0.896	80%	0.798	S	S	*	*			trans	70	86.3	158.3	57.5	0	0	0	0	118.6
281	S	32.3	Very low	34.5	Very low	126 Å²	126	137.1 Å²	137.1	88%	0.881	80%	0.796	S	S	*	*			trans	-80.4	154.6	147.3	57.7	0	0	0	0	111.7
282	G	37.6	Very low	34.4	Very low	82 Å²	82	135.2 Å²	135.2	85%	0.845	79%	0.79	S	S	*	*			trans	-178.1	100.7	169.2	0	0	0	0	0	112.2
283	G	31	Very low	34.5	Very low	72 Å²	72	138 Å²	138	74%	0.742	80%	0.797	S	S	*	*			trans	-98.4	159.4	179.4	0	0	0	0	0	113.1
284	F	34.7	Very low	34.6	Very low	226 Å²	226	138.7 Å²	138.7	99%	0.991	80%	0.796	S	S	*	*			trans	-141.6	159.3	161.8	-87.9	-73.1	0	0	0	110.2
285	E	29	Very low	34.6	Very low	169 Å²	169	140 Å²	140	79%	0.79	80%	0.795	S	S	*	*			trans	-126	137.9	-158.1	175.5	-172.8	140.3	0	0	109.2
286	F	36.1	Very low	34.3	Very low	207 Å²	207	141.3 Å²	141.3	91%	0.908	79%	0.79	S	S	*	*			trans	-153.2	142.5	160.8	-166	-96	0	0	0	109.6
287	D	37.8	Very low	34.3	Very low	111 Å²	111	143 Å²	143	59%	0.594	79%	0.792	S	S	*	*			trans	-129.4	170.2	-152.8	-141.9	-14.3	0	0	0	113.8
288	E	35.8	Very low	33.8	Very low	154 Å²	154	135.4 Å²	135.4	72%	0.72	79%	0.786	S	S	*	*			trans	35.9	130.7	161.8	-60	-161.5	122.2	0	0	122
289	L	38	Very low	33.7	Very low	169 Å²	169	131 Å²	131	89%	0.885	78%	0.78	S	S	*	*				-168.3	132.8	105.3	-99.7	169.2	0	0	0	111.6
290	P	37.2	Very low	33.4	Very low	90 Å²	90	135.5 Å²	135.5	58%	0.584	79%	0.793	S	S	*	*			trans	-108.1	170.1	-175.9	40.6	-35.2	0	0	0	114.8
291	N	34	Very low	33.2	Very low	148 Å²	148	135.5 Å²	135.5	79%	0.791	79%	0.787	S	S	*	*			trans	172.8	116.1	143.9	-84.4	-26.4	0	0	0	107.3
292	T	29	Very low	33.4	Very low	105 Å²	105	135.4 Å²	135.4	64%	0.644	78%	0.781	S	S	*	*				78.3	117.2	56	65	0	0	0	0	116.1
293	L	34.3	Very low	33.5	Very low	159 Å²	159	137.8 Å²	137.8	83%	0.832	78%	0.775	S	S	*	*			trans	69.6	153.4	162	-54.7	164.5	0	0	0	114.8
294	E	35.8	Very low	33.9	Very low	175 Å²	175	141.7 Å²	141.7	82%	0.818	78%	0.778	S	S	*	*			cis	-121.3	154	11.1	-69.9	175	160.1	0	0	110.3
295	S	31.4	Very low	34.2	Very low	93 Å²	93	138.8 Å²	138.8	65%	0.65	77%	0.773	S	S	*	*				50	138.6	86	-32.1	0	0	0	0	114.1
296	E	31.2	Very low	35	Very low	184 Å²	184	137.3 Å²	137.3	86%	0.86	77%	0.77	S	S	*	*			cis	-154.8	-160.7	10.9	-145.9	168.2	-128	0	0	112.5
297	S	30.7	Very low	35.3	Very low	103 Å²	103	133.4 Å²	133.4	72%	0.72	77%	0.765	S	S	*	*			trans	-70.1	136	-169.7	55.1	0	0	0	0	116.8
298	G	28.8	Very low	35.3	Very low	80 Å²	80	134.5 Å²	134.5	83%	0.825	77%	0.771	S	S	*	*				72.4	111.1	113.8	0	0	0	0	0	121.1
299	G	28.5	Very low	35.5	Very low	75 Å²	75	133.1 Å²	133.1	77%	0.773	77%	0.773	S	S	*	*			trans	108.7	147.1	133.2	0	0	0	0	0	118.7
300	L	31.8	Very low	35.8	Very low	171 Å²	171	135 Å²	135	90%	0.895	77%	0.77	S	S	*	*			trans	72.7	121	162.7	-59.4	172.8	0	0	0	119.5
301	N	31.4	Very low	36.3	Very low	147 Å²	147	136.2 Å²	136.2	79%	0.786	78%	0.778	S	S	*	*			trans	-40.1	153.7	161.6	-33.7	-31.3	0	0	0	115.2
302	V	38.5	Very low	36.6	Very low	123 Å²	123	137.1 Å²	137.1	75%	0.745	78%	0.781	S	S	*	*				175.2	119.2	112.6	152.8	0	0	0	0	110.9
303	D	38.7	Very low	37	Very low	133 Å²	133	138 Å²	138	71%	0.711	79%	0.786	S	S	*	*			trans	34.1	132	139.5	-39.8	-29.2	0	0	0	124.3
304	D	39.2	Very low	37.6	Very low	154 Å²	154	137.1 Å²	137.1	82%	0.824	78%	0.781	S	S	*	*			trans	78.1	152.5	133.2	-73.4	-21.6	0	0	0	126.6
305	D	41.3	Very low	37.8	Very low	165 Å²	165	135.3 Å²	135.3	88%	0.882	78%	0.777	S	S	*	*			trans	82.4	138.2	159.3	-78.2	-27.7	0	0	0	124.3
306	L	46.1	Very low	38.4	Very low	138 Å²	138	135.6 Å²	135.6	72%	0.723	78%	0.777	S	S	*	*			trans	-116.3	161.4	-179.2	-170.5	81.6	0	0	0	109.8
307	P	42.6	Very low	39.1	Very low	124 Å²	124	135.2 Å²	135.2	81%	0.805	78%	0.775	S	S	*	*				-149.1	158.8	126.1	34.9	-18.1	0	0	0	117.5
308	D	36.7	Very low	40	Very low	134 Å²	134	140.2 Å²	140.2	72%	0.717	78%	0.784	S	S	*	*			trans	-85.6	-178.4	172	-70.9	-63.7	0	0	0	114.6
309	T	39.7	Very low	40.7	Very low	125 Å²	125	141.6 Å²	141.6	77%	0.767	77%	0.769	S	S	*	*			trans	113.8	130.7	159.9	-51.4	0	0	0	0	115.3
310	Y	44	Very low	41.8	Very low	210 Å²	210	142.7 Å²	142.7	82%	0.824	76%	0.756	S	S	*	*			cis	-164.7	169.6	-22	-105.7	-177.6	0	0	0	110.3
311	P	48.4	Very low	42.7	Very low	114 Å²	114	141.8 Å²	141.8	74%	0.74	75%	0.751	S	S	*	*			trans	-103.1	-179.6	-168.1	40.8	-37.2	0	0	0	116.4
312	I	40.3	Very low	43.6	Very low	167 Å²	167	141.6 Å²	141.6	86%	0.856	75%	0.745	S	S	*	*			trans	-131.2	151.1	171.2	-65.9	-178	0	0	0	111.1
313	T	37.6	Very low	44.3	Very low	123 Å²	123	139.8 Å²	139.8	76%	0.755	73%	0.727	S	S	*	*			trans	-105.6	-174.6	-163.7	-44.6	0	0	0	0	113.5
314	I	46	Very low	45.3	Very low	142 Å²	142	135.7 Å²	135.7	73%	0.728	71%	0.712	S	S	*	*			trans	103.1	122.1	166.1	-58.7	163.3	0	0	0	112.3
315	N	41.1	Very low	46.8	Very low	136 Å²	136	130.1 Å²	130.1	73%	0.727	69%	0.691	S	S	*	*			cis	-138.8	138.2	10.9	-97.6	-40.6	0	0	0	111.7
316	P	43.1	Very low	48.4	Very low	100 Å²	100	125.9 Å²	125.9	65%	0.649	67%	0.667	S	S	*	*			trans	-117	97	-178.2	37.6	-24.7	0	0	0	114.4
317	E	47	Very low	49.8	Very low	176 Å²	176	126.5 Å²	126.5	82%	0.822	66%	0.659	S	S	*	*	S	Bend	trans	-156.4	-34.9	163.3	-131.6	164.2	-146.3	0	0	115.5
318	F	48.2	Very low	51.6	Low	208 Å²	208	127.6 Å²	127.6	91%	0.912	65%	0.651	S	S	*	*	S	Bend	trans	-90.3	-32.1	179.3	-146.5	-98.6	0	0	0	113.9	I320	F318-I320 PolarHBondContact O-N 3.24Å
319	E	44.5	Very low	53.7	Low	108 Å²	108	127.2 Å²	127.2	51%	0.505	65%	0.645	S	S	.	*	T	Hydrogen-bonded Turn	trans	-64.5	-21.8	176.6	-89.4	-173.6	144.4	0	0	113.6	I321 E322 F323	E319-I321 PolarHBondContact O-N 2.83Å; E319-E322 PolarHBondContact O-N 2.83Å; E319-F323 HydrophobicContact CB-CD2 4Å; E319-F323 HydrophobicContact CG-CD2 4.16Å; E319-F323 WeakPolarHBondContact O-CB 3.38Å; E319-F323 PolarHBondContact O-N 2.69Å; E319-F323 WeakPolarHBondContact OE1-CE2 3.21Å
320	I	51.5	Low	55.9	Low	99 Å²	99	125.3 Å²	125.3	51%	0.508	63%	0.63	S	S	.	*	H	α-helix	trans	-58.8	-31.5	-162.6	-61	177.9	0	0	0	113.3	F318 A324	F318-I320 PolarHBondContact O-N 3.24Å; I320-A324 WeakPolarHBondContact O-CB 3.34Å; I320-A324 PolarHBondContact O-N 3.28Å
321	I	50.4	Low	57.8	Low	151 Å²	151	119.7 Å²	119.7	77%	0.774	61%	0.614	S	S	*	*	H	α-helix	trans	-75.7	-43.3	176.5	-60.9	177	0	0	0	111.1	E319 A324 G325	E319-I321 PolarHBondContact O-N 2.83Å; I321-A324 PolarHBondContact O-N 3.48Å; I321-G325 PolarHBondContact O-N 3.28Å
322	E	51.5	Low	59.6	Low	143 Å²	143	118.6 Å²	118.6	67%	0.668	61%	0.605	S	S	*	*	H	α-helix	trans	-74	-40.8	-177.9	-152.1	159.4	-126.6	0	0	110.8	E319 A324 G325 M326	E319-E322 PolarHBondContact O-N 2.83Å; E322-A324 VanDerWaalsContact C-N 3.3Å; E322-A324 PolarHBondContact O-N 2.65Å; E322-G325 CarbonylContact O-C 3.46Å; E322-G325 PolarHBondContact O-N 2.76Å; E322-G325 VanDerWaalsContact O-N 3.15Å; E322-M326 HydrophobicContact CB-CE 4.38Å; E322-M326 HydrophobicContact CG-CE 4.21Å; E322-M326 WeakPolarHBondContact O-CB 3.23Å; E322-M326 WeakPolarHBondContact O-CG 3.33Å; E322-M326 PolarHBondContact O-N 2.92Å
323	F	52.5	Low	61.9	Low	86 Å²	86	115.1 Å²	115.1	38%	0.377	59%	0.587	S	S	.	*	H	α-helix	trans	-65	-26.9	168.1	-111	-87.4	0	0	0	113.3	E319 M326 R327	E319-F323 HydrophobicContact CB-CD2 4Å; E319-F323 HydrophobicContact CG-CD2 4.16Å; E319-F323 WeakPolarHBondContact O-CB 3.38Å; E319-F323 PolarHBondContact O-N 2.69Å; E319-F323 WeakPolarHBondContact OE1-CE2 3.21Å; F323-M326 HydrophobicContact CD2-CE 3.84Å; F323-M326 HydrophobicContact CE2-CE 4.26Å; F323-M326 HydrophobicContact CG-CE 4.22Å; F323-R327 WeakPolarHBondContact O-CA 3.41Å; F323-R327 WeakPolarHBondContact O-CB 3.42Å; F323-R327 PolarHBondContact O-N 2.83Å
324	A	60.2	Low	64.4	Low	46 Å²	46	114.2 Å²	114.2	38%	0.38	58%	0.577	S	S	.	*	H	α-helix	trans	-78.5	-25.6	171.4	0	0	0	0	0	112.9	I320 I321 E322 K328	I320-A324 WeakPolarHBondContact O-CB 3.34Å; I320-A324 PolarHBondContact O-N 3.28Å; I321-A324 PolarHBondContact O-N 3.48Å; E322-A324 VanDerWaalsContact C-N 3.3Å; E322-A324 PolarHBondContact O-N 2.65Å; A324-K328 WeakPolarHBondContact O-CD 3.21Å; A324-K328 VanDerWaalsContact O-CG 3.3Å; A324-K328 WeakPolarHBondContact O-CG 3.38Å
325	G	70.1	Confident	66.5	Low	37 Å²	37	113.1 Å²	113.1	38%	0.381	57%	0.567	S	S	.	*	H	α-helix	trans	-69.9	-61.7	166	0	0	0	0	0	110.7	I321 E322 R327 K328 E329	I321-G325 PolarHBondContact O-N 3.28Å; E322-G325 CarbonylContact O-C 3.46Å; E322-G325 PolarHBondContact O-N 2.76Å; E322-G325 VanDerWaalsContact O-N 3.15Å; G325-R327 VanDerWaalsContact C-N 3.3Å; G325-R327 PolarHBondContact O-N 3.34Å; G325-K328 WeakPolarHBondContact O-CB 3.29Å; G325-K328 PolarHBondContact O-N 2.9Å; G325-E329 PolarHBondContact O-N 2.98Å
326	M	73.9	Confident	68.8	Low	77 Å²	77	111.6 Å²	111.6	38%	0.379	56%	0.555	S	S	.	*	H	α-helix	trans	-54.9	-39.8	178.4	-70.2	-173.3	-73	0	0	112.5	E322 F323 K328 E329 I330	E322-M326 HydrophobicContact CB-CE 4.38Å; E322-M326 HydrophobicContact CG-CE 4.21Å; E322-M326 WeakPolarHBondContact O-CB 3.23Å; E322-M326 WeakPolarHBondContact O-CG 3.33Å; E322-M326 PolarHBondContact O-N 2.92Å; F323-M326 HydrophobicContact CD2-CE 3.84Å; F323-M326 HydrophobicContact CE2-CE 4.26Å; F323-M326 HydrophobicContact CG-CE 4.22Å; M326-K328 PolarHBondContact O-N 2.76Å; M326-E329 PolarHBondContact O-N 2.81Å; M326-I330 VanDerWaalsContact O-CB 3.28Å; M326-I330 WeakPolarHBondContact O-CB 3.46Å; M326-I330 WeakPolarHBondContact O-CD1 3.16Å; M326-I330 WeakPolarHBondContact O-CG1 3.4Å; M326-I330 PolarHBondContact O-N 2.61Å
327	R	76.2	Confident	71	Confident	150 Å²	150	111.6 Å²	111.6	57%	0.566	55%	0.55	S	S	*	.	H	α-helix	trans	-65.8	-38.4	177.1	-172.8	175.2	-62.9	-85.1	0	112.2	F323 G325 I330 D331	F323-R327 WeakPolarHBondContact O-CA 3.41Å; F323-R327 WeakPolarHBondContact O-CB 3.42Å; F323-R327 PolarHBondContact O-N 2.83Å; G325-R327 VanDerWaalsContact C-N 3.3Å; G325-R327 PolarHBondContact O-N 3.34Å; R327-I330 PolarHBondContact O-N 2.79Å; R327-D331 WeakPolarHBondContact O-CB 3.33Å; R327-D331 PolarHBondContact O-N 2.84Å; R327-D331 VanDerWaalsContact O-OD2 3.14Å
328	K	81	Confident	73.2	Confident	147 Å²	147	108.9 Å²	108.9	64%	0.639	54%	0.538	S	S	*	.	H	α-helix	trans	-66.3	-38.8	172.8	-71.8	170.8	-176.7	174.1	0	112	A324 G325 M326 D331 V332	A324-K328 WeakPolarHBondContact O-CD 3.21Å; A324-K328 VanDerWaalsContact O-CG 3.3Å; A324-K328 WeakPolarHBondContact O-CG 3.38Å; G325-K328 WeakPolarHBondContact O-CB 3.29Å; G325-K328 PolarHBondContact O-N 2.9Å; M326-K328 PolarHBondContact O-N 2.76Å; K328-D331 PolarHBondContact O-N 3.37Å; K328-V332 WeakPolarHBondContact O-CB 3.19Å; K328-V332 VanDerWaalsContact O-CG2 3.31Å; K328-V332 WeakPolarHBondContact O-CG2 3.48Å; K328-V332 PolarHBondContact O-N 3.04Å
329	E	79.8	Confident	75.1	Confident	127 Å²	127	103.6 Å²	103.6	59%	0.593	52%	0.517	S	S	*	.	H	α-helix	trans	-67.1	-40.6	176.4	-169.1	166.5	-161.1	0	0	111.3	G325 M326 V332 L333	G325-E329 PolarHBondContact O-N 2.98Å; M326-E329 PolarHBondContact O-N 2.81Å; E329-V332 PolarHBondContact O-N 2.82Å; E329-L333 HydrophobicContact CG-CD1 4.34Å; E329-L333 WeakPolarHBondContact O-CB 3.24Å; E329-L333 VanDerWaalsContact O-CG 3.26Å; E329-L333 WeakPolarHBondContact O-CG 3.42Å; E329-L333 PolarHBondContact O-N 3.01Å
330	I	85.8	Confident	77.4	Confident	85 Å²	85	102.8 Å²	102.8	44%	0.436	52%	0.515	S	S	.	.	H	α-helix	trans	-62.5	-44.4	170.5	-71.5	162.4	0	0	0	111	M326 R327 V332 L333 I334	M326-I330 VanDerWaalsContact O-CB 3.28Å; M326-I330 WeakPolarHBondContact O-CB 3.46Å; M326-I330 WeakPolarHBondContact O-CD1 3.16Å; M326-I330 WeakPolarHBondContact O-CG1 3.4Å; M326-I330 PolarHBondContact O-N 2.61Å; R327-I330 PolarHBondContact O-N 2.79Å; I330-V332 VanDerWaalsContact C-N 3.3Å; I330-V332 PolarHBondContact O-N 2.88Å; I330-L333 PolarHBondContact O-N 2.86Å; I330-I334 HydrophobicContact CG2-CD1 3.64Å; I330-I334 HydrophobicContact CG2-CG1 4.28Å; I330-I334 WeakPolarHBondContact O-CB 3.17Å; I330-I334 WeakPolarHBondContact O-CG1 3.31Å; I330-I334 PolarHBondContact O-N 3.44Å
331	D	84.4	Confident	79.3	Confident	92 Å²	92	101.2 Å²	101.2	49%	0.492	51%	0.51	S	S	.	.	H	α-helix	trans	-63.6	-35.9	176.8	-68.4	-30.6	0	0	0	111.4	R327 K328 K335	R327-D331 WeakPolarHBondContact O-CB 3.33Å; R327-D331 PolarHBondContact O-N 2.84Å; R327-D331 VanDerWaalsContact O-OD2 3.14Å; K328-D331 PolarHBondContact O-N 3.37Å; D331-K335 WeakPolarHBondContact O-CB 2.99Å; D331-K335 PolarHBondContact O-N 3.23Å; D331-K335 VanDerWaalsContact O-N 3.1Å
332	V	87.5	Confident	81.1	Confident	91 Å²	91	99 Å²	99	55%	0.552	50%	0.497	S	S	*	.	H	α-helix	trans	-67.4	-48	172.1	167.1	0	0	0	0	111.2	K328 E329 I330 I334 K335 E336	K328-V332 WeakPolarHBondContact O-CB 3.19Å; K328-V332 VanDerWaalsContact O-CG2 3.31Å; K328-V332 WeakPolarHBondContact O-CG2 3.48Å; K328-V332 PolarHBondContact O-N 3.04Å; E329-V332 PolarHBondContact O-N 2.82Å; I330-V332 VanDerWaalsContact C-N 3.3Å; I330-V332 PolarHBondContact O-N 2.88Å; V332-I334 VanDerWaalsContact C-N 3.32Å; V332-I334 PolarHBondContact O-N 3.39Å; V332-K335 WeakPolarHBondContact O-CB 3.41Å; V332-K335 PolarHBondContact O-N 3.01Å; V332-K335 VanDerWaalsContact O-N 3.14Å; V332-E336 PolarHBondContact O-N 2.98Å
333	L	88.6	Confident	83	Confident	94 Å²	94	97.7 Å²	97.7	49%	0.492	49%	0.492	S	S	.	.	H	α-helix	trans	-64.4	-34.6	177.9	-72.7	168.1	0	0	0	112.3	E329 I330 N337	E329-L333 HydrophobicContact CG-CD1 4.34Å; E329-L333 WeakPolarHBondContact O-CB 3.24Å; E329-L333 VanDerWaalsContact O-CG 3.26Å; E329-L333 WeakPolarHBondContact O-CG 3.42Å; E329-L333 PolarHBondContact O-N 3.01Å; I330-L333 PolarHBondContact O-N 2.86Å; L333-N337 WeakPolarHBondContact O-CB 3.43Å; L333-N337 PolarHBondContact O-N 3.05Å
334	I	89.2	Confident	84.9	Confident	103 Å²	103	100 Å²	100	53%	0.528	50%	0.502	S	S	.	.	H	α-helix	trans	-65.1	-43.2	172.5	-73.6	166.9	0	0	0	110.2	I330 V332 M338	I330-I334 HydrophobicContact CG2-CD1 3.64Å; I330-I334 HydrophobicContact CG2-CG1 4.28Å; I330-I334 WeakPolarHBondContact O-CB 3.17Å; I330-I334 WeakPolarHBondContact O-CG1 3.31Å; I330-I334 PolarHBondContact O-N 3.44Å; V332-I334 VanDerWaalsContact C-N 3.32Å; V332-I334 PolarHBondContact O-N 3.39Å; I334-M338 VanDerWaalsContact O-CB 3.27Å; I334-M338 WeakPolarHBondContact O-CB 3.45Å; I334-M338 PolarHBondContact O-N 3.17Å
335	K	89	Confident	86.4	Confident	119 Å²	119	102 Å²	102	52%	0.517	51%	0.506	S	S	.	.	H	α-helix	trans	-64.5	-46.2	176	180	-177.6	170.9	-63.3	0	111.8	D331 V332 M338 E339	D331-K335 WeakPolarHBondContact O-CB 2.99Å; D331-K335 PolarHBondContact O-N 3.23Å; D331-K335 VanDerWaalsContact O-N 3.1Å; V332-K335 WeakPolarHBondContact O-CB 3.41Å; V332-K335 PolarHBondContact O-N 3.01Å; V332-K335 VanDerWaalsContact O-N 3.14Å; K335-M338 PolarHBondContact O-N 3.18Å; K335-E339 VanDerWaalsContact CE-OE1 3.26Å; K335-E339 WeakPolarHBondContact CE-OE1 3.45Å; K335-E339 VanDerWaalsContact NZ-CD 3.29Å; K335-E339 IonicContact NZ-OE1 3.26Å; K335-E339 PolarHBondContact NZ-OE1 3.27Å; K335-E339 IonicContact NZ-OE2 2.67Å; K335-E339 PolarHBondContact NZ-OE2 2.76Å; K335-E339 WeakPolarHBondContact O-CG 3.44Å; K335-E339 PolarHBondContact O-N 2.78Å
336	E	90.2	Very high	87.5	Confident	104 Å²	104	103 Å²	103	49%	0.486	51%	0.51	S	S	.	.	H	α-helix	trans	-63	-44.6	177.2	-176.4	175.6	-176	0	0	111.4	V332 M338 E339 L340	V332-E336 PolarHBondContact O-N 2.98Å; E336-M338 VanDerWaalsContact C-N 3.33Å; E336-M338 PolarHBondContact O-N 2.66Å; E336-E339 CarbonylContact O-C 3.6Å; E336-E339 PolarHBondContact O-N 2.86Å; E336-L340 HydrophobicContact CG-CD1 4.24Å; E336-L340 WeakPolarHBondContact O-CB 3.41Å; E336-L340 VanDerWaalsContact O-CG 3.32Å; E336-L340 WeakPolarHBondContact O-CG 3.31Å; E336-L340 PolarHBondContact O-N 2.86Å
337	N	90.4	Very high	88.3	Confident	100 Å²	100	104.6 Å²	104.6	54%	0.535	52%	0.52	S	S	.	.	H	α-helix	trans	-66.6	-34.3	177.2	-162.7	-5.9	0	0	0	111.8	L333 L340 V341	L333-N337 WeakPolarHBondContact O-CB 3.43Å; L333-N337 PolarHBondContact O-N 3.05Å; N337-L340 PolarHBondContact O-N 2.91Å; N337-V341 WeakPolarHBondContact O-CB 3.13Å; N337-V341 VanDerWaalsContact O-CG2 3.31Å; N337-V341 WeakPolarHBondContact O-CG2 3.2Å; N337-V341 PolarHBondContact O-N 2.97Å
338	M	91.8	Very high	89.1	Confident	119 Å²	119	100.3 Å²	100.3	59%	0.586	51%	0.508	S	S	*	.	H	α-helix	trans	-64.9	-42.1	170.7	-176.1	174.5	175.5	0	0	112	I334 K335 E336 V341 E342	I334-M338 VanDerWaalsContact O-CB 3.27Å; I334-M338 WeakPolarHBondContact O-CB 3.45Å; I334-M338 PolarHBondContact O-N 3.17Å; K335-M338 PolarHBondContact O-N 3.18Å; E336-M338 VanDerWaalsContact C-N 3.33Å; E336-M338 PolarHBondContact O-N 2.66Å; M338-V341 PolarHBondContact O-N 2.78Å; M338-E342 PolarHBondContact O-N 3.16Å
339	E	89.2	Confident	89.6	Confident	97 Å²	97	97.3 Å²	97.3	45%	0.453	50%	0.503	S	S	.	.	H	α-helix	trans	-65.8	-37.6	174.7	-76.1	167.8	-170.1	0	0	111.8	K335 E336 E342 M343	K335-E339 VanDerWaalsContact CE-OE1 3.26Å; K335-E339 WeakPolarHBondContact CE-OE1 3.45Å; K335-E339 VanDerWaalsContact NZ-CD 3.29Å; K335-E339 IonicContact NZ-OE1 3.26Å; K335-E339 PolarHBondContact NZ-OE1 3.27Å; K335-E339 IonicContact NZ-OE2 2.67Å; K335-E339 PolarHBondContact NZ-OE2 2.76Å; K335-E339 WeakPolarHBondContact O-CG 3.44Å; K335-E339 PolarHBondContact O-N 2.78Å; E336-E339 CarbonylContact O-C 3.6Å; E336-E339 PolarHBondContact O-N 2.86Å; E339-E342 PolarHBondContact O-N 2.81Å; E339-M343 WeakPolarHBondContact O-CB 3.48Å; E339-M343 PolarHBondContact O-N 2.86Å
340	L	92.1	Very high	90.2	Very high	91 Å²	91	95.2 Å²	95.2	48%	0.476	50%	0.498	S	S	.	.	H	α-helix	trans	-66.6	-35.1	171.9	-71.8	170.2	0	0	0	112.5	E336 N337 K344	E336-L340 HydrophobicContact CG-CD1 4.24Å; E336-L340 WeakPolarHBondContact O-CB 3.41Å; E336-L340 VanDerWaalsContact O-CG 3.32Å; E336-L340 WeakPolarHBondContact O-CG 3.31Å; E336-L340 PolarHBondContact O-N 2.86Å; N337-L340 PolarHBondContact O-N 2.91Å; L340-K344 WeakPolarHBondContact O-CB 3.4Å; L340-K344 PolarHBondContact O-N 2.99Å
341	V	92.1	Very high	90.6	Very high	67 Å²	67	95.5 Å²	95.5	41%	0.406	50%	0.496	S	S	.	.	H	α-helix	trans	-69.4	-43.4	173.3	166.8	0	0	0	0	111.3	N337 M338 M343 K344 N345	N337-V341 WeakPolarHBondContact O-CB 3.13Å; N337-V341 VanDerWaalsContact O-CG2 3.31Å; N337-V341 WeakPolarHBondContact O-CG2 3.2Å; N337-V341 PolarHBondContact O-N 2.97Å; M338-V341 PolarHBondContact O-N 2.78Å; V341-M343 VanDerWaalsContact C-N 3.34Å; V341-M343 PolarHBondContact O-N 3.47Å; V341-K344 PolarHBondContact O-N 3.19Å; V341-N345 WeakPolarHBondContact O-CB 3.48Å; V341-N345 PolarHBondContact O-N 2.85Å; V341-N345 PolarHBondContact O-ND2 2.66Å
342	E	88.6	Confident	91.1	Very high	104 Å²	104	95 Å²	95	49%	0.486	49%	0.494	S	S	.	.	H	α-helix	trans	-61.8	-41.7	173.1	-71	-162.5	160.6	0	0	111.1	K240 M338 E339 N345 A346	K240-E342 IonicContact NZ-OE1 3.29Å; M338-E342 PolarHBondContact O-N 3.16Å; E339-E342 PolarHBondContact O-N 2.81Å; E342-N345 PolarHBondContact O-N 2.9Å; E342-A346 PolarHBondContact O-N 2.84Å
343	M	90.6	Very high	91.4	Very high	116 Å²	116	95.9 Å²	95.9	57%	0.571	50%	0.495	S	S	*	.	H	α-helix	trans	-65.4	-42.8	175.8	-168.2	-175.1	-59.2	0	0	112.9	E339 V341 N345 A346 L347	E339-M343 WeakPolarHBondContact O-CB 3.48Å; E339-M343 PolarHBondContact O-N 2.86Å; V341-M343 VanDerWaalsContact C-N 3.34Å; V341-M343 PolarHBondContact O-N 3.47Å; M343-N345 VanDerWaalsContact C-N 3.29Å; M343-N345 PolarHBondContact O-N 3.23Å; M343-A346 PolarHBondContact O-N 2.87Å; M343-L347 HydrophobicContact CG-CD1 4.25Å; M343-L347 WeakPolarHBondContact O-CB 3.5Å; M343-L347 WeakPolarHBondContact O-CG 3.33Å; M343-L347 PolarHBondContact O-N 3.12Å
344	K	93.1	Very high	91.5	Very high	133 Å²	133	96.3 Å²	96.3	58%	0.578	50%	0.497	S	S	*	.	H	α-helix	trans	-60.6	-38.1	174.1	178.2	-175	176.1	-176.7	0	111.7	L340 V341 N348	L340-K344 WeakPolarHBondContact O-CB 3.4Å; L340-K344 PolarHBondContact O-N 2.99Å; V341-K344 PolarHBondContact O-N 3.19Å; K344-N348 PolarHBondContact O-N 3.47Å; K344-N348 PolarHBondContact O-ND2 2.88Å; K344-N348 VanDerWaalsContact O-ND2 3.15Å
345	N	91.2	Very high	91.7	Very high	89 Å²	89	95.4 Å²	95.4	48%	0.476	49%	0.493	S	S	.	.	H	α-helix	trans	-70.6	-42.2	177.6	-69.1	-17.8	0	0	0	111.1	V341 E342 M343 N348 V349	V341-N345 WeakPolarHBondContact O-CB 3.48Å; V341-N345 PolarHBondContact O-N 2.85Å; V341-N345 PolarHBondContact O-ND2 2.66Å; E342-N345 PolarHBondContact O-N 2.9Å; M343-N345 VanDerWaalsContact C-N 3.29Å; M343-N345 PolarHBondContact O-N 3.23Å; N345-N348 PolarHBondContact O-N 3.05Å; N345-V349 PolarHBondContact O-N 3.3Å; N345-V349 VanDerWaalsContact O-N 3.11Å
346	A	91.9	Very high	91.8	Very high	57 Å²	57	92.5 Å²	92.5	47%	0.471	49%	0.491	S	S	.	.	H	α-helix	trans	-61.2	-43.5	172.8	0	0	0	0	0	112.4	E342 M343 N348 V349 V350	E342-A346 PolarHBondContact O-N 2.84Å; M343-A346 PolarHBondContact O-N 2.87Å; A346-N348 VanDerWaalsContact C-N 3.31Å; A346-N348 PolarHBondContact O-N 3.35Å; A346-V349 PolarHBondContact O-N 2.82Å; A346-V350 WeakPolarHBondContact O-CG2 3.43Å; A346-V350 PolarHBondContact O-N 3.25Å
347	L	92.2	Very high	91.9	Very high	111 Å²	111	95.5 Å²	95.5	58%	0.581	50%	0.498	S	S	*	.	H	α-helix	trans	-61.3	-36.7	174.4	-80.3	164.4	0	0	0	112.6	M343 K351	M343-L347 HydrophobicContact CG-CD1 4.25Å; M343-L347 WeakPolarHBondContact O-CB 3.5Å; M343-L347 WeakPolarHBondContact O-CG 3.33Å; M343-L347 PolarHBondContact O-N 3.12Å; L347-K351 WeakPolarHBondContact O-CB 3.21Å; L347-K351 PolarHBondContact O-N 3.05Å
348	N	93.1	Very high	92.1	Very high	60 Å²	60	95.4 Å²	95.4	32%	0.321	50%	0.497	S	S	.	.	H	α-helix	trans	-65	-45.5	174.2	-90.5	-56.4	0	0	0	112.3	K344 N345 A346 V350 K351 D352	K344-N348 PolarHBondContact O-N 3.47Å; K344-N348 PolarHBondContact O-ND2 2.88Å; K344-N348 VanDerWaalsContact O-ND2 3.15Å; N345-N348 PolarHBondContact O-N 3.05Å; A346-N348 VanDerWaalsContact C-N 3.31Å; A346-N348 PolarHBondContact O-N 3.35Å; N348-V350 VanDerWaalsContact C-N 3.34Å; N348-V350 PolarHBondContact O-N 3.14Å; N348-K351 PolarHBondContact O-N 3.46Å; N348-K351 PolarHBondContact OD1-NZ 3.08Å; N348-D352 WeakPolarHBondContact O-CB 3.45Å; N348-D352 PolarHBondContact O-N 2.94Å; N348-D352 VanDerWaalsContact O-OD2 3.1Å
349	V	91.3	Very high	92.1	Very high	85 Å²	85	95 Å²	95	52%	0.515	50%	0.497	S	S	.	.	H	α-helix	trans	-57.6	-47.6	175.6	177.9	0	0	0	0	110.8	N345 A346 K351 D352 D353	N345-V349 PolarHBondContact O-N 3.3Å; N345-V349 VanDerWaalsContact O-N 3.11Å; A346-V349 PolarHBondContact O-N 2.82Å; V349-K351 VanDerWaalsContact C-N 3.34Å; V349-K351 PolarHBondContact O-N 3.21Å; V349-D352 PolarHBondContact O-N 2.71Å; V349-D353 WeakPolarHBondContact O-CB 3.5Å; V349-D353 PolarHBondContact O-N 3.02Å
350	V	92.9	Very high	92.1	Very high	82 Å²	82	96.3 Å²	96.3	50%	0.497	50%	0.503	S	S	.	.	H	α-helix	trans	-62.5	-39.7	177.6	173.7	0	0	0	0	111.9	A346 N348 L354	A346-V350 WeakPolarHBondContact O-CG2 3.43Å; A346-V350 PolarHBondContact O-N 3.25Å; N348-V350 VanDerWaalsContact C-N 3.34Å; N348-V350 PolarHBondContact O-N 3.14Å; V350-L354 HydrophobicContact CG1-CD1 3.94Å; V350-L354 HydrophobicContact CG1-CG 4.43Å; V350-L354 VanDerWaalsContact O-CB 3.32Å; V350-L354 WeakPolarHBondContact O-CB 3.45Å; V350-L354 WeakPolarHBondContact O-CG 3.44Å; V350-L354 PolarHBondContact O-N 3.1Å
351	K	94.2	Very high	92	Very high	91 Å²	91	95.5 Å²	95.5	40%	0.396	50%	0.499	S	S	.	.	H	α-helix	trans	-65.7	-41	176	178.4	-132.9	70.5	-153.6	0	111.7	L347 N348 V349 L354 L355	L347-K351 WeakPolarHBondContact O-CB 3.21Å; L347-K351 PolarHBondContact O-N 3.05Å; N348-K351 PolarHBondContact O-N 3.46Å; N348-K351 PolarHBondContact OD1-NZ 3.08Å; V349-K351 VanDerWaalsContact C-N 3.34Å; V349-K351 PolarHBondContact O-N 3.21Å; K351-L354 PolarHBondContact O-N 2.89Å; K351-L355 HydrophobicContact CG-CD1 4.47Å; K351-L355 VanDerWaalsContact O-CG 3.3Å; K351-L355 WeakPolarHBondContact O-CG 3.41Å; K351-L355 PolarHBondContact O-N 2.88Å
352	D	93.6	Very high	92	Very high	83 Å²	83	95.8 Å²	95.8	44%	0.444	50%	0.501	S	S	.	.	H	α-helix	trans	-70	-40.4	178	-65.8	-33.8	0	0	0	111.5	N348 V349 L355 A356	N348-D352 WeakPolarHBondContact O-CB 3.45Å; N348-D352 PolarHBondContact O-N 2.94Å; N348-D352 VanDerWaalsContact O-OD2 3.1Å; V349-D352 PolarHBondContact O-N 2.71Å; D352-L355 PolarHBondContact O-N 2.88Å; D352-A356 PolarHBondContact O-N 3.12Å
353	D	93.2	Very high	92.1	Very high	109 Å²	109	94.6 Å²	94.6	58%	0.583	50%	0.504	S	S	*	.	H	α-helix	trans	-63.8	-39.3	172.4	-80.8	-22	0	0	0	112	V349 A356 R357	V349-D353 WeakPolarHBondContact O-CB 3.5Å; V349-D353 PolarHBondContact O-N 3.02Å; D353-A356 PolarHBondContact O-N 3.45Å; D353-R357 WeakPolarHBondContact O-CB 3.37Å; D353-R357 PolarHBondContact O-N 2.71Å
354	L	92.6	Very high	92.1	Very high	102 Å²	102	93.6 Å²	93.6	53%	0.534	50%	0.497	S	S	.	.	H	α-helix	trans	-67.9	-38.3	175.7	-76.6	170.8	0	0	0	112.3	V350 K351 R357 I358	V350-L354 HydrophobicContact CG1-CD1 3.94Å; V350-L354 HydrophobicContact CG1-CG 4.43Å; V350-L354 VanDerWaalsContact O-CB 3.32Å; V350-L354 WeakPolarHBondContact O-CB 3.45Å; V350-L354 WeakPolarHBondContact O-CG 3.44Å; V350-L354 PolarHBondContact O-N 3.1Å; K351-L354 PolarHBondContact O-N 2.89Å; L354-R357 WeakPolarHBondContact O-CB 3.42Å; L354-R357 PolarHBondContact O-N 3.05Å; L354-I358 VanDerWaalsContact O-CG1 3.3Å; L354-I358 WeakPolarHBondContact O-CG1 3.47Å; L354-I358 PolarHBondContact O-N 3.01Å
355	L	91.9	Very high	91.8	Very high	85 Å²	85	91.2 Å²	91.2	45%	0.445	49%	0.491	S	S	.	.	H	α-helix	trans	-62.8	-48.9	172.8	-74.5	166.7	0	0	0	110.9	K351 D352 R357 I358 D359	K351-L355 HydrophobicContact CG-CD1 4.47Å; K351-L355 VanDerWaalsContact O-CG 3.3Å; K351-L355 WeakPolarHBondContact O-CG 3.41Å; K351-L355 PolarHBondContact O-N 2.88Å; D352-L355 PolarHBondContact O-N 2.88Å; L355-R357 PolarHBondContact O-N 3.23Å; L355-I358 WeakPolarHBondContact O-CB 3.4Å; L355-I358 PolarHBondContact O-N 3.39Å; L355-D359 PolarHBondContact O-N 2.94Å
356	A	92	Very high	91.8	Very high	58 Å²	58	92.1 Å²	92.1	48%	0.479	50%	0.495	S	S	.	.	H	α-helix	trans	-60	-33.2	175.5	0	0	0	0	0	112.8	D352 D353 H360	D352-A356 PolarHBondContact O-N 3.12Å; D353-A356 PolarHBondContact O-N 3.45Å; A356-H360 WeakPolarHBondContact O-CB 3.49Å; A356-H360 PolarHBondContact O-N 3.07Å; A356-H360 VanDerWaalsContact O-N 3.14Å
357	R	92.2	Very high	91.6	Very high	167 Å²	167	92.6 Å²	92.6	63%	0.63	50%	0.495	S	S	*	.	H	α-helix	trans	-66.9	-41.6	173	-163.9	76.4	-177.3	-143.7	4.6	112	D353 L354 L355 L361	D353-R357 WeakPolarHBondContact O-CB 3.37Å; D353-R357 PolarHBondContact O-N 2.71Å; L354-R357 WeakPolarHBondContact O-CB 3.42Å; L354-R357 PolarHBondContact O-N 3.05Å; L355-R357 PolarHBondContact O-N 3.23Å; R357-L361 HydrophobicContact CG-CD1 4.21Å; R357-L361 WeakPolarHBondContact O-CB 3.36Å; R357-L361 VanDerWaalsContact O-CG 3.27Å; R357-L361 WeakPolarHBondContact O-CG 3.3Å; R357-L361 PolarHBondContact O-N 2.92Å
358	I	93.9	Very high	91.4	Very high	97 Å²	97	91.8 Å²	91.8	50%	0.497	49%	0.49	S	S	.	.	H	α-helix	trans	-66.2	-47.8	177.1	-71.4	163.7	0	0	0	110.4	L354 L355 H360 L361 T362	L354-I358 VanDerWaalsContact O-CG1 3.3Å; L354-I358 WeakPolarHBondContact O-CG1 3.47Å; L354-I358 PolarHBondContact O-N 3.01Å; L355-I358 WeakPolarHBondContact O-CB 3.4Å; L355-I358 PolarHBondContact O-N 3.39Å; I358-H360 VanDerWaalsContact C-N 3.3Å; I358-H360 PolarHBondContact O-N 2.95Å; I358-L361 PolarHBondContact O-N 3.31Å; I358-T362 WeakPolarHBondContact O-CB 3.32Å; I358-T362 PolarHBondContact O-N 3.11Å; I358-T362 PolarHBondContact O-OG1 3.45Å; I358-T362 VanDerWaalsContact O-OG1 3.08Å
359	D	92.1	Very high	91.2	Very high	112 Å²	112	94.6 Å²	94.6	60%	0.599	50%	0.501	S	S	*	.	H	α-helix	trans	-58.3	-42.8	178.6	-69.6	-23.8	0	0	0	111.7	L355 T362 S363	L355-D359 PolarHBondContact O-N 2.94Å; D359-T362 PolarHBondContact O-N 2.89Å; D359-S363 WeakPolarHBondContact O-CB 3.34Å; D359-S363 PolarHBondContact O-N 3.47Å
360	H	89.8	Confident	91.1	Very high	123 Å²	123	96.7 Å²	96.7	57%	0.569	51%	0.505	S	S	*	.	H	α-helix	trans	-63.2	-47.6	175.9	-174.7	51.3	0	0	0	112.3	A356 I358 T362 S363 E364	A356-H360 WeakPolarHBondContact O-CB 3.49Å; A356-H360 PolarHBondContact O-N 3.07Å; A356-H360 VanDerWaalsContact O-N 3.14Å; I358-H360 VanDerWaalsContact C-N 3.3Å; I358-H360 PolarHBondContact O-N 2.95Å; H360-T362 VanDerWaalsContact C-N 3.35Å; H360-T362 PolarHBondContact O-N 2.85Å; H360-S363 PolarHBondContact O-N 2.94Å; H360-E364 WeakPolarHBondContact O-CB 3.27Å; H360-E364 PolarHBondContact O-N 3.35Å
361	L	90.6	Very high	90.9	Very high	75 Å²	75	95.5 Å²	95.5	39%	0.393	50%	0.501	S	S	.	.	H	α-helix	trans	-66.5	-33.7	178.3	-72.2	169.2	0	0	0	112.6	R357 I358 E364 N365	R357-L361 HydrophobicContact CG-CD1 4.21Å; R357-L361 WeakPolarHBondContact O-CB 3.36Å; R357-L361 VanDerWaalsContact O-CG 3.27Å; R357-L361 WeakPolarHBondContact O-CG 3.3Å; R357-L361 PolarHBondContact O-N 2.92Å; I358-L361 PolarHBondContact O-N 3.31Å; L361-E364 PolarHBondContact O-N 2.88Å; L361-N365 WeakPolarHBondContact O-CB 3.46Å; L361-N365 PolarHBondContact O-N 2.87Å; L361-N365 PolarHBondContact O-ND2 3.08Å
362	T	91.8	Very high	90.6	Very high	73 Å²	73	94.9 Å²	94.9	45%	0.448	50%	0.504	S	S	.	.	H	α-helix	trans	-66.9	-45.1	173.1	-65.3	0	0	0	0	110.7	I358 D359 H360 E364 N365 I366	I358-T362 WeakPolarHBondContact O-CB 3.32Å; I358-T362 PolarHBondContact O-N 3.11Å; I358-T362 PolarHBondContact O-OG1 3.45Å; I358-T362 VanDerWaalsContact O-OG1 3.08Å; D359-T362 PolarHBondContact O-N 2.89Å; H360-T362 VanDerWaalsContact C-N 3.35Å; H360-T362 PolarHBondContact O-N 2.85Å; T362-E364 VanDerWaalsContact C-N 3.32Å; T362-E364 PolarHBondContact O-N 3.25Å; T362-N365 PolarHBondContact O-N 2.89Å; T362-I366 HydrophobicContact CG2-CD1 4.02Å; T362-I366 WeakPolarHBondContact O-CG1 3.43Å; T362-I366 PolarHBondContact O-N 3.16Å
363	S	90.4	Very high	90.3	Very high	78 Å²	78	95.7 Å²	95.7	55%	0.545	51%	0.509	S	S	.	.	H	α-helix	trans	-63	-37.1	175.1	-173.4	0	0	0	0	112.7	D359 H360 S367	D359-S363 WeakPolarHBondContact O-CB 3.34Å; D359-S363 PolarHBondContact O-N 3.47Å; H360-S363 PolarHBondContact O-N 2.94Å; S363-S367 PolarHBondContact O-N 3.25Å
364	E	90.2	Very high	90.1	Very high	95 Å²	95	96.2 Å²	96.2	44%	0.444	51%	0.509	S	S	.	.	H	α-helix	trans	-66.9	-46.6	175.3	-172.1	177.7	-168.6	0	0	111.1	H360 L361 T362 I366 S367 L368	H360-E364 WeakPolarHBondContact O-CB 3.27Å; H360-E364 PolarHBondContact O-N 3.35Å; L361-E364 PolarHBondContact O-N 2.88Å; T362-E364 VanDerWaalsContact C-N 3.32Å; T362-E364 PolarHBondContact O-N 3.25Å; E364-I366 VanDerWaalsContact C-N 3.34Å; E364-I366 PolarHBondContact O-N 3.11Å; E364-S367 PolarHBondContact O-N 2.85Å; E364-L368 HydrophobicContact CG-CD1 4Å; E364-L368 HydrophobicContact CG-CG 4.41Å; E364-L368 WeakPolarHBondContact O-CB 3.5Å; E364-L368 WeakPolarHBondContact O-CG 3.49Å; E364-L368 PolarHBondContact O-N 3.25Å
365	N	87.2	Confident	89.8	Confident	84 Å²	84	97.2 Å²	97.2	45%	0.449	52%	0.515	S	S	.	.	H	α-helix	trans	-58	-43.3	176	-88	-82.9	0	0	0	112.5	L361 T362 S367 L368 H369	L361-N365 WeakPolarHBondContact O-CB 3.46Å; L361-N365 PolarHBondContact O-N 2.87Å; L361-N365 PolarHBondContact O-ND2 3.08Å; T362-N365 PolarHBondContact O-N 2.89Å; N365-S367 PolarHBondContact O-N 2.89Å; N365-L368 PolarHBondContact O-N 2.84Å; N365-H369 WeakPolarHBondContact O-CB 3.46Å; N365-H369 PolarHBondContact O-CD2 2.73Å; N365-H369 PolarHBondContact O-N 2.89Å
366	I	90.9	Very high	89.6	Confident	108 Å²	108	96.3 Å²	96.3	55%	0.554	51%	0.513	S	S	*	.	H	α-helix	trans	-60.8	-46.8	178	-68.7	164.5	0	0	0	110.8	T362 E364 L368 H369 E370	T362-I366 HydrophobicContact CG2-CD1 4.02Å; T362-I366 WeakPolarHBondContact O-CG1 3.43Å; T362-I366 PolarHBondContact O-N 3.16Å; E364-I366 VanDerWaalsContact C-N 3.34Å; E364-I366 PolarHBondContact O-N 3.11Å; I366-L368 PolarHBondContact O-N 2.97Å; I366-H369 PolarHBondContact O-N 3Å; I366-E370 PolarHBondContact O-N 2.94Å
367	S	88.6	Confident	89.4	Confident	66 Å²	66	97.4 Å²	97.4	46%	0.462	51%	0.51	S	S	.	.	H	α-helix	trans	-65.3	-36.6	178.2	-174	0	0	0	0	112.9	S363 E364 N365 S371	S363-S367 PolarHBondContact O-N 3.25Å; E364-S367 PolarHBondContact O-N 2.85Å; N365-S367 PolarHBondContact O-N 2.89Å; S367-S371 WeakPolarHBondContact O-CB 3.04Å; S367-S371 PolarHBondContact O-N 3.01Å; S367-S371 PolarHBondContact O-OG 2.87Å
368	L	87.9	Confident	89.1	Confident	94 Å²	94	91.7 Å²	91.7	49%	0.492	50%	0.496	S	S	.	.	H	α-helix	trans	-67.5	-41.2	173.4	-71.7	172.5	0	0	0	111.9	E364 N365 I366 S371 V372	E364-L368 HydrophobicContact CG-CD1 4Å; E364-L368 HydrophobicContact CG-CG 4.41Å; E364-L368 WeakPolarHBondContact O-CB 3.5Å; E364-L368 WeakPolarHBondContact O-CG 3.49Å; E364-L368 PolarHBondContact O-N 3.25Å; N365-L368 PolarHBondContact O-N 2.84Å; I366-L368 PolarHBondContact O-N 2.97Å; L368-S371 WeakPolarHBondContact O-CB 3.32Å; L368-S371 PolarHBondContact O-N 3.47Å; L368-V372 WeakPolarHBondContact O-CB 3.33Å; L368-V372 VanDerWaalsContact O-CG2 3.31Å; L368-V372 WeakPolarHBondContact O-CG2 3.38Å; L368-V372 PolarHBondContact O-N 2.94Å
369	H	88.8	Confident	89	Confident	119 Å²	119	95.3 Å²	95.3	55%	0.551	50%	0.504	S	S	*	.	H	α-helix	trans	-64.1	-43.1	175.1	-84.1	-65.8	0	0	0	112.3	N365 I366 S371 V372 N373	N365-H369 WeakPolarHBondContact O-CB 3.46Å; N365-H369 PolarHBondContact O-CD2 2.73Å; N365-H369 PolarHBondContact O-N 2.89Å; I366-H369 PolarHBondContact O-N 3Å; H369-S371 VanDerWaalsContact C-N 3.34Å; H369-S371 PolarHBondContact O-N 3.41Å; H369-V372 PolarHBondContact O-N 2.91Å; H369-N373 VanDerWaalsContact O-CG 3.28Å; H369-N373 PolarHBondContact O-N 3.18Å; H369-N373 PolarHBondContact O-ND2 3.35Å
370	E	89.4	Confident	88.8	Confident	129 Å²	129	95 Å²	95	60%	0.603	50%	0.5	S	S	*	.	H	α-helix	trans	-60.5	-44	173.6	-174	174.6	-156.7	0	0	111.3	I366 V372 N373 M374	I366-E370 PolarHBondContact O-N 2.94Å; E370-V372 PolarHBondContact O-N 2.73Å; E370-N373 PolarHBondContact O-N 2.74Å; E370-M374 WeakPolarHBondContact O-CG 3.32Å; E370-M374 PolarHBondContact O-N 3.48Å
371	S	87.4	Confident	88.8	Confident	57 Å²	57	94.8 Å²	94.8	40%	0.399	50%	0.495	S	S	.	.	H	α-helix	trans	-61.4	-40.9	175.5	-61	0	0	0	0	112.7	S367 L368 H369 M374 L375	S367-S371 WeakPolarHBondContact O-CB 3.04Å; S367-S371 PolarHBondContact O-N 3.01Å; S367-S371 PolarHBondContact O-OG 2.87Å; L368-S371 WeakPolarHBondContact O-CB 3.32Å; L368-S371 PolarHBondContact O-N 3.47Å; H369-S371 VanDerWaalsContact C-N 3.34Å; H369-S371 PolarHBondContact O-N 3.41Å; S371-M374 PolarHBondContact O-N 2.85Å; S371-L375 WeakPolarHBondContact O-CB 3.29Å; S371-L375 VanDerWaalsContact O-CG 3.29Å; S371-L375 WeakPolarHBondContact O-CG 3.41Å; S371-L375 PolarHBondContact O-N 2.99Å
372	V	88.4	Confident	88.6	Confident	78 Å²	78	96 Å²	96	47%	0.473	50%	0.501	S	S	.	.	H	α-helix	trans	-65.6	-40.4	176.1	165.7	0	0	0	0	111.5	L368 H369 E370 L375 T376	L368-V372 WeakPolarHBondContact O-CB 3.33Å; L368-V372 VanDerWaalsContact O-CG2 3.31Å; L368-V372 WeakPolarHBondContact O-CG2 3.38Å; L368-V372 PolarHBondContact O-N 2.94Å; H369-V372 PolarHBondContact O-N 2.91Å; E370-V372 PolarHBondContact O-N 2.73Å; V372-L375 PolarHBondContact O-N 3.47Å; V372-T376 WeakPolarHBondContact O-CB 3.23Å; V372-T376 PolarHBondContact O-N 2.94Å; V372-T376 PolarHBondContact O-OG1 3.06Å
373	N	88	Confident	88.3	Confident	101 Å²	101	97.8 Å²	97.8	54%	0.54	50%	0.504	S	S	.	.	H	α-helix	trans	-62.8	-49	175.4	-68.5	-16.8	0	0	0	110.8	H369 E370 L375 T376 D377	H369-N373 VanDerWaalsContact O-CG 3.28Å; H369-N373 PolarHBondContact O-N 3.18Å; H369-N373 PolarHBondContact O-ND2 3.35Å; E370-N373 PolarHBondContact O-N 2.74Å; N373-L375 VanDerWaalsContact C-N 3.31Å; N373-L375 PolarHBondContact O-N 3.49Å; N373-T376 WeakPolarHBondContact O-CB 3.41Å; N373-T376 PolarHBondContact O-N 3.49Å; N373-D377 PolarHBondContact O-N 3.19Å
374	M	88.3	Confident	88.2	Confident	119 Å²	119	97.3 Å²	97.3	59%	0.586	50%	0.501	S	S	*	.	H	α-helix	trans	-60.5	-37.4	177.9	-71.8	-64.5	-71.4	0	0	113.3	E370 S371 S378	E370-M374 WeakPolarHBondContact O-CG 3.32Å; E370-M374 PolarHBondContact O-N 3.48Å; S371-M374 PolarHBondContact O-N 2.85Å; M374-S378 WeakPolarHBondContact O-CB 3.32Å; M374-S378 PolarHBondContact O-N 2.83Å; M374-S378 VanDerWaalsContact O-N 3.1Å
375	L	85.2	Confident	88.2	Confident	124 Å²	124	97.8 Å²	97.8	65%	0.649	50%	0.503	S	S	*	.	H	α-helix	trans	-69.8	-34.5	173.2	-73.5	171	0	0	0	112.4	S371 V372 N373 S378 R379	S371-L375 WeakPolarHBondContact O-CB 3.29Å; S371-L375 VanDerWaalsContact O-CG 3.29Å; S371-L375 WeakPolarHBondContact O-CG 3.41Å; S371-L375 PolarHBondContact O-N 2.99Å; V372-L375 PolarHBondContact O-N 3.47Å; N373-L375 VanDerWaalsContact C-N 3.31Å; N373-L375 PolarHBondContact O-N 3.49Å; L375-S378 PolarHBondContact O-N 2.84Å; L375-R379 WeakPolarHBondContact O-CB 3.29Å; L375-R379 PolarHBondContact O-N 2.87Å
376	T	87.8	Confident	88	Confident	66 Å²	66	98.5 Å²	98.5	41%	0.405	51%	0.507	S	S	.	.	H	α-helix	trans	-69.2	-44.4	178	-58.2	0	0	0	0	111.1	V372 N373 S378 R379 I380	V372-T376 WeakPolarHBondContact O-CB 3.23Å; V372-T376 PolarHBondContact O-N 2.94Å; V372-T376 PolarHBondContact O-OG1 3.06Å; N373-T376 WeakPolarHBondContact O-CB 3.41Å; N373-T376 PolarHBondContact O-N 3.49Å; T376-S378 VanDerWaalsContact C-N 3.34Å; T376-S378 PolarHBondContact O-N 2.82Å; T376-R379 WeakPolarHBondContact O-CB 3.04Å; T376-R379 PolarHBondContact O-N 3.32Å; T376-I380 HydrophobicContact CG2-CD1 4.24Å; T376-I380 WeakPolarHBondContact O-CG1 3.07Å; T376-I380 PolarHBondContact O-N 3.17Å
377	D	87.7	Confident	87.9	Confident	80 Å²	80	97.8 Å²	97.8	43%	0.428	51%	0.507	S	S	.	.	H	α-helix	trans	-59.3	-43.1	172	-88.7	14.5	0	0	0	112.5	N373 R379 I380 R381	N373-D377 PolarHBondContact O-N 3.19Å; D377-R379 VanDerWaalsContact C-N 3.35Å; D377-I380 PolarHBondContact O-N 3Å; D377-R381 PolarHBondContact O-N 2.83Å; D377-R381 VanDerWaalsContact O-N 3.09Å
378	S	87.8	Confident	87.8	Confident	47 Å²	47	99.2 Å²	99.2	33%	0.329	51%	0.51	S	S	.	.	H	α-helix	trans	-65.5	-38.3	176.4	-161	0	0	0	0	111.9	M374 L375 T376 R381 L382	M374-S378 WeakPolarHBondContact O-CB 3.32Å; M374-S378 PolarHBondContact O-N 2.83Å; M374-S378 VanDerWaalsContact O-N 3.1Å; L375-S378 PolarHBondContact O-N 2.84Å; T376-S378 VanDerWaalsContact C-N 3.34Å; T376-S378 PolarHBondContact O-N 2.82Å; S378-R381 PolarHBondContact O-N 2.82Å; S378-L382 WeakPolarHBondContact O-CB 3.28Å; S378-L382 WeakPolarHBondContact O-CG 3.38Å; S378-L382 PolarHBondContact O-N 3.25Å
379	R	90.2	Very high	87.9	Confident	174 Å²	174	99.4 Å²	99.4	66%	0.657	51%	0.51	S	S	*	.	H	α-helix	trans	-62.4	-44.5	173.1	176.7	-176.3	174.1	179.9	1.4	111.7	L375 T376 D377 L382 Q383	L375-R379 WeakPolarHBondContact O-CB 3.29Å; L375-R379 PolarHBondContact O-N 2.87Å; T376-R379 WeakPolarHBondContact O-CB 3.04Å; T376-R379 PolarHBondContact O-N 3.32Å; D377-R379 VanDerWaalsContact C-N 3.35Å; R379-L382 PolarHBondContact O-N 2.83Å; R379-Q383 WeakPolarHBondContact O-CB 3.44Å; R379-Q383 PolarHBondContact O-N 3.37Å
380	I	88.6	Confident	87.7	Confident	104 Å²	104	97.5 Å²	97.5	53%	0.533	50%	0.504	S	S	.	.	H	α-helix	trans	-62.3	-44.9	179.3	-69.1	164.6	0	0	0	110.6	T376 D377 Q383 S384	T376-I380 HydrophobicContact CG2-CD1 4.24Å; T376-I380 WeakPolarHBondContact O-CG1 3.07Å; T376-I380 PolarHBondContact O-N 3.17Å; D377-I380 PolarHBondContact O-N 3Å; I380-Q383 PolarHBondContact O-N 3.38Å; I380-S384 PolarHBondContact O-N 2.84Å; I380-S384 VanDerWaalsContact O-N 3.09Å
381	R	89.1	Confident	87.7	Confident	120 Å²	120	97.2 Å²	97.2	45%	0.453	50%	0.503	S	S	.	.	H	α-helix	trans	-58.9	-55.4	174.7	-74.2	-174.9	-70.6	-88.9	0.2	111.8	D377 S378 Q383 S384 E385	D377-R381 PolarHBondContact O-N 2.83Å; D377-R381 VanDerWaalsContact O-N 3.09Å; S378-R381 PolarHBondContact O-N 2.82Å; R381-Q383 VanDerWaalsContact C-N 3.26Å; R381-Q383 PolarHBondContact O-N 3.09Å; R381-S384 PolarHBondContact O-N 2.81Å; R381-S384 PolarHBondContact O-OG 2.82Å; R381-E385 PolarHBondContact O-N 3.33Å
382	L	86.8	Confident	87.7	Confident	99 Å²	99	100.4 Å²	100.4	52%	0.518	51%	0.513	S	S	.	.	H	α-helix	trans	-58.6	-36.6	179	-72.4	169.5	0	0	0	112.6	S378 R379 S384 E385 L386	S378-L382 WeakPolarHBondContact O-CB 3.28Å; S378-L382 WeakPolarHBondContact O-CG 3.38Å; S378-L382 PolarHBondContact O-N 3.25Å; R379-L382 PolarHBondContact O-N 2.83Å; L382-S384 VanDerWaalsContact C-N 3.34Å; L382-E385 PolarHBondContact O-N 2.88Å; L382-L386 WeakPolarHBondContact O-CB 3.29Å; L382-L386 PolarHBondContact O-N 3.4Å
383	Q	86.5	Confident	87.5	Confident	111 Å²	111	100.7 Å²	100.7	52%	0.519	51%	0.511	S	S	.	.	H	α-helix	trans	-67.3	-34.8	177.5	-172.7	168.7	-22.2	0	0	111.9	R379 I380 R381 T387	R379-Q383 WeakPolarHBondContact O-CB 3.44Å; R379-Q383 PolarHBondContact O-N 3.37Å; I380-Q383 PolarHBondContact O-N 3.38Å; R381-Q383 VanDerWaalsContact C-N 3.26Å; R381-Q383 PolarHBondContact O-N 3.09Å; Q383-T387 PolarHBondContact O-N 2.74Å; Q383-T387 VanDerWaalsContact O-N 3.16Å; Q383-T387 PolarHBondContact O-OG1 2.96Å
384	S	87.1	Confident	87.5	Confident	69 Å²	69	99.7 Å²	99.7	48%	0.483	51%	0.506	S	S	.	.	H	α-helix	trans	-70.5	-39	173.7	73	0	0	0	0	113	I380 R381 L382 T387 N388	I380-S384 PolarHBondContact O-N 2.84Å; I380-S384 VanDerWaalsContact O-N 3.09Å; R381-S384 PolarHBondContact O-N 2.81Å; R381-S384 PolarHBondContact O-OG 2.82Å; L382-S384 VanDerWaalsContact C-N 3.34Å; S384-T387 WeakPolarHBondContact CA-OG1 2.98Å; S384-T387 PolarHBondContact O-N 3.26Å; S384-T387 PolarHBondContact O-OG1 3.45Å; S384-N388 PolarHBondContact O-N 2.91Å
385	E	90.9	Very high	87.6	Confident	104 Å²	104	98.4 Å²	98.4	49%	0.486	50%	0.501	S	S	.	.	H	α-helix	trans	-62.5	-42.8	173.2	-69.1	169.9	-170.7	0	0	111.1	R381 L382 T387 N388 I389	R381-E385 PolarHBondContact O-N 3.33Å; L382-E385 PolarHBondContact O-N 2.88Å; E385-T387 PolarHBondContact O-N 3.19Å; E385-N388 WeakPolarHBondContact O-CB 3.37Å; E385-N388 PolarHBondContact O-N 2.61Å; E385-I389 WeakPolarHBondContact O-CG1 3.42Å; E385-I389 PolarHBondContact O-N 2.93Å
386	L	83.1	Confident	87.6	Confident	100 Å²	100	94.5 Å²	94.5	52%	0.524	49%	0.487	S	S	.	.	H	α-helix	trans	-60.9	-45.2	177.8	-140.4	166.9	0	0	0	111.5	L382 N388 I389 D390	L382-L386 WeakPolarHBondContact O-CB 3.29Å; L382-L386 PolarHBondContact O-N 3.4Å; L386-N388 VanDerWaalsContact C-N 3.28Å; L386-N388 PolarHBondContact O-N 3.36Å; L386-I389 PolarHBondContact O-N 2.99Å; L386-D390 VanDerWaalsContact CD2-OD2 3.32Å; L386-D390 WeakPolarHBondContact CD2-OD2 3.43Å; L386-D390 PolarHBondContact O-N 3.41Å
387	T	87.9	Confident	87.6	Confident	92 Å²	92	98.3 Å²	98.3	56%	0.564	49%	0.494	S	S	*	.	H	α-helix	trans	-62.9	-32.5	176	46.6	0	0	0	0	113.7	Q383 S384 E385 Q391	Q383-T387 PolarHBondContact O-N 2.74Å; Q383-T387 VanDerWaalsContact O-N 3.16Å; Q383-T387 PolarHBondContact O-OG1 2.96Å; S384-T387 WeakPolarHBondContact CA-OG1 2.98Å; S384-T387 PolarHBondContact O-N 3.26Å; S384-T387 PolarHBondContact O-OG1 3.45Å; E385-T387 PolarHBondContact O-N 3.19Å; T387-Q391 PolarHBondContact O-N 3.17Å; T387-Q391 VanDerWaalsContact O-N 3.16Å
388	N	87.8	Confident	87.5	Confident	97 Å²	97	98 Å²	98	52%	0.519	50%	0.496	S	S	.	.	H	α-helix	trans	-71.5	-44.8	176.8	-166.2	3.6	0	0	0	111.1	S384 E385 L386 Q391 M392	S384-N388 PolarHBondContact O-N 2.91Å; E385-N388 WeakPolarHBondContact O-CB 3.37Å; E385-N388 PolarHBondContact O-N 2.61Å; L386-N388 VanDerWaalsContact C-N 3.28Å; L386-N388 PolarHBondContact O-N 3.36Å; N388-Q391 PolarHBondContact O-N 3.03Å; N388-M392 WeakPolarHBondContact O-CG 3.4Å; N388-M392 PolarHBondContact O-N 3.03Å
389	I	88.8	Confident	87.4	Confident	98 Å²	98	101 Å²	101	50%	0.503	50%	0.504	S	S	.	.	H	α-helix	trans	-64.6	-41.3	177.2	-66.9	167.1	0	0	0	111.6	E385 L386 Q391 M392 L393	E385-I389 WeakPolarHBondContact O-CG1 3.42Å; E385-I389 PolarHBondContact O-N 2.93Å; L386-I389 PolarHBondContact O-N 2.99Å; I389-Q391 VanDerWaalsContact C-N 3.31Å; I389-Q391 PolarHBondContact O-N 3.14Å; I389-M392 PolarHBondContact O-N 3.34Å; I389-L393 HydrophobicContact CG2-CD1 4.12Å; I389-L393 HydrophobicContact CG2-CG 4.48Å; I389-L393 WeakPolarHBondContact O-CB 3.38Å; I389-L393 WeakPolarHBondContact O-CG 3.47Å; I389-L393 PolarHBondContact O-N 3.03Å
390	D	85.8	Confident	87.1	Confident	78 Å²	78	97.3 Å²	97.3	42%	0.417	50%	0.497	S	S	.	.	H	α-helix	trans	-64.9	-34.1	175.3	-85.2	-27.1	0	0	0	112.1	L386 N394	L386-D390 VanDerWaalsContact CD2-OD2 3.32Å; L386-D390 WeakPolarHBondContact CD2-OD2 3.43Å; L386-D390 PolarHBondContact O-N 3.41Å; D390-N394 VanDerWaalsContact O-CG 3.29Å; D390-N394 PolarHBondContact O-N 2.85Å; D390-N394 VanDerWaalsContact O-N 3.08Å; D390-N394 PolarHBondContact O-ND2 3.02Å
391	Q	87.7	Confident	86.8	Confident	123 Å²	123	97.3 Å²	97.3	58%	0.575	50%	0.498	S	S	*	.	H	α-helix	trans	-66.6	-50.2	173	-173.2	166	-8.8	0	0	111.2	T387 N388 I389 L393 N394 D395	T387-Q391 PolarHBondContact O-N 3.17Å; T387-Q391 VanDerWaalsContact O-N 3.16Å; N388-Q391 PolarHBondContact O-N 3.03Å; I389-Q391 VanDerWaalsContact C-N 3.31Å; I389-Q391 PolarHBondContact O-N 3.14Å; Q391-L393 VanDerWaalsContact C-N 3.28Å; Q391-L393 PolarHBondContact O-N 3.47Å; Q391-N394 PolarHBondContact O-N 3.24Å; Q391-D395 PolarHBondContact O-N 3.29Å
392	M	87.4	Confident	86.7	Confident	124 Å²	124	96.2 Å²	96.2	61%	0.611	50%	0.498	S	S	*	.	H	α-helix	trans	-57.4	-38.4	175.5	-69.3	179.4	66.9	0	0	112.9	N388 I389 A396	N388-M392 WeakPolarHBondContact O-CG 3.4Å; N388-M392 PolarHBondContact O-N 3.03Å; I389-M392 PolarHBondContact O-N 3.34Å; M392-A396 WeakPolarHBondContact O-CB 3.42Å; M392-A396 PolarHBondContact O-N 3.44Å
393	L	86	Confident	86.5	Confident	84 Å²	84	95.7 Å²	95.7	44%	0.44	50%	0.495	S	S	.	.	H	α-helix	trans	-67.2	-35.3	175.8	-80.8	172.9	0	0	0	112.7	I389 Q391 R397	I389-L393 HydrophobicContact CG2-CD1 4.12Å; I389-L393 HydrophobicContact CG2-CG 4.48Å; I389-L393 WeakPolarHBondContact O-CB 3.38Å; I389-L393 WeakPolarHBondContact O-CG 3.47Å; I389-L393 PolarHBondContact O-N 3.03Å; Q391-L393 VanDerWaalsContact C-N 3.28Å; Q391-L393 PolarHBondContact O-N 3.47Å; L393-R397 WeakPolarHBondContact O-CB 3.48Å; L393-R397 WeakPolarHBondContact O-CD 3.28Å; L393-R397 WeakPolarHBondContact O-CG 3.31Å; L393-R397 PolarHBondContact O-N 3.44Å
394	N	87.3	Confident	86.2	Confident	80 Å²	80	94.6 Å²	94.6	43%	0.428	49%	0.493	S	S	.	.	H	α-helix	trans	-72.6	-41.7	175.9	-72.2	-34.6	0	0	0	111.5	D390 Q391 A396 R397 T398	D390-N394 VanDerWaalsContact O-CG 3.29Å; D390-N394 PolarHBondContact O-N 2.85Å; D390-N394 VanDerWaalsContact O-N 3.08Å; D390-N394 PolarHBondContact O-ND2 3.02Å; Q391-N394 PolarHBondContact O-N 3.24Å; N394-A396 PolarHBondContact O-N 2.9Å; N394-R397 WeakPolarHBondContact O-CB 3.47Å; N394-R397 PolarHBondContact O-N 3.07Å; N394-R397 PolarHBondContact OD1-NH1 3.47Å; N394-T398 WeakPolarHBondContact O-CG2 3.44Å; N394-T398 PolarHBondContact O-N 2.94Å
395	D	89.6	Confident	85.9	Confident	92 Å²	92	98.1 Å²	98.1	49%	0.492	50%	0.502	S	S	.	.	H	α-helix	trans	-58.5	-49.7	174.4	-66.7	-23.7	0	0	0	110.7	Q391 R397 T398 E399	Q391-D395 PolarHBondContact O-N 3.29Å; D395-R397 VanDerWaalsContact C-N 3.32Å; D395-R397 PolarHBondContact O-N 3.18Å; D395-T398 PolarHBondContact O-N 2.89Å; D395-T398 PolarHBondContact O-OG1 3.08Å; D395-E399 PolarHBondContact O-N 2.75Å; D395-E399 VanDerWaalsContact O-N 3.08Å
396	A	85.8	Confident	85.5	Confident	43 Å²	43	98.5 Å²	98.5	36%	0.355	50%	0.502	S	S	.	.	H	α-helix	trans	-60.8	-35.3	176.3	0	0	0	0	0	113.5	M392 N394 E399 I400	M392-A396 WeakPolarHBondContact O-CB 3.42Å; M392-A396 PolarHBondContact O-N 3.44Å; N394-A396 PolarHBondContact O-N 2.9Å; A396-E399 PolarHBondContact O-N 2.82Å; A396-I400 WeakPolarHBondContact O-CG1 3.29Å; A396-I400 PolarHBondContact O-N 3.38Å
397	R	87.6	Confident	85.2	Confident	145 Å²	145	98.4 Å²	98.4	55%	0.547	50%	0.501	S	S	.	.	H	α-helix	trans	-64.1	-38.7	172.2	-77.6	163.6	173.5	165.5	-2.4	112	L393 N394 D395 I400 N401	L393-R397 WeakPolarHBondContact O-CB 3.48Å; L393-R397 WeakPolarHBondContact O-CD 3.28Å; L393-R397 WeakPolarHBondContact O-CG 3.31Å; L393-R397 PolarHBondContact O-N 3.44Å; N394-R397 WeakPolarHBondContact O-CB 3.47Å; N394-R397 PolarHBondContact O-N 3.07Å; N394-R397 PolarHBondContact OD1-NH1 3.47Å; D395-R397 VanDerWaalsContact C-N 3.32Å; D395-R397 PolarHBondContact O-N 3.18Å; R397-I400 PolarHBondContact O-N 3.28Å; R397-N401 VanDerWaalsContact O-CG 3.32Å; R397-N401 PolarHBondContact O-N 2.91Å
398	T	86.9	Confident	84.5	Confident	75 Å²	75	96.7 Å²	96.7	46%	0.46	49%	0.493	S	S	.	.	H	α-helix	trans	-67.2	-37.1	175.7	68.8	0	0	0	0	112.2	N394 D395 N401 Q402	N394-T398 WeakPolarHBondContact O-CG2 3.44Å; N394-T398 PolarHBondContact O-N 2.94Å; D395-T398 PolarHBondContact O-N 2.89Å; D395-T398 PolarHBondContact O-OG1 3.08Å; T398-N401 PolarHBondContact O-N 3.5Å; T398-Q402 WeakPolarHBondContact O-CG 3.22Å; T398-Q402 PolarHBondContact O-N 2.81Å
399	E	85.7	Confident	83.9	Confident	108 Å²	108	98.4 Å²	98.4	51%	0.505	50%	0.496	S	S	.	.	H	α-helix	trans	-64	-45.9	174.8	-168.8	-177.5	178.4	0	0	111.4	D395 A396 N401 Q402 L403	D395-E399 PolarHBondContact O-N 2.75Å; D395-E399 VanDerWaalsContact O-N 3.08Å; A396-E399 PolarHBondContact O-N 2.82Å; E399-N401 VanDerWaalsContact C-N 3.35Å; E399-N401 PolarHBondContact O-N 3.41Å; E399-Q402 PolarHBondContact O-N 2.89Å; E399-L403 HydrophobicContact CG-CD1 4.23Å; E399-L403 WeakPolarHBondContact O-CG 3.45Å; E399-L403 PolarHBondContact O-N 3.46Å
400	I	83.2	Confident	82.9	Confident	98 Å²	98	101.6 Å²	101.6	50%	0.503	50%	0.503	S	S	.	.	H	α-helix	trans	-59.6	-43.8	176.3	-69.9	167.7	0	0	0	111.4	A396 R397 L403 N404	A396-I400 WeakPolarHBondContact O-CG1 3.29Å; A396-I400 PolarHBondContact O-N 3.38Å; R397-I400 PolarHBondContact O-N 3.28Å; I400-L403 PolarHBondContact O-N 3.46Å; I400-N404 PolarHBondContact O-N 2.85Å; I400-N404 PolarHBondContact O-ND2 3.22Å
401	N	82.8	Confident	81.4	Confident	103 Å²	103	103.4 Å²	103.4	55%	0.551	51%	0.509	S	S	*	.	H	α-helix	trans	-63.5	-43.1	177.6	-73.1	-13.5	0	0	0	112	R397 T398 E399 L403 N404 E405	R397-N401 VanDerWaalsContact O-CG 3.32Å; R397-N401 PolarHBondContact O-N 2.91Å; T398-N401 PolarHBondContact O-N 3.5Å; E399-N401 VanDerWaalsContact C-N 3.35Å; E399-N401 PolarHBondContact O-N 3.41Å; N401-L403 VanDerWaalsContact C-N 3.27Å; N401-L403 PolarHBondContact O-N 2.86Å; N401-N404 PolarHBondContact O-N 3.41Å; N401-E405 PolarHBondContact O-N 2.66Å
402	Q	85.5	Confident	79.9	Confident	98 Å²	98	102.8 Å²	102.8	46%	0.458	51%	0.509	S	S	.	.	H	α-helix	trans	-64.3	-29.5	174.7	-71.9	177.1	39.7	0	0	113.2	T398 E399 K406	T398-Q402 WeakPolarHBondContact O-CG 3.22Å; T398-Q402 PolarHBondContact O-N 2.81Å; E399-Q402 PolarHBondContact O-N 2.89Å; Q402-K406 WeakPolarHBondContact O-CD 3.09Å; Q402-K406 WeakPolarHBondContact O-CE 3.43Å; Q402-K406 WeakPolarHBondContact O-CG 3.24Å; Q402-K406 PolarHBondContact O-N 2.89Å
403	L	82.5	Confident	78.3	Confident	87 Å²	87	103.3 Å²	103.3	46%	0.455	51%	0.508	S	S	.	.	H	α-helix	trans	-75.9	-38.4	174.9	-71.4	170.4	0	0	0	111.7	E399 I400 N401 K406 L407	E399-L403 HydrophobicContact CG-CD1 4.23Å; E399-L403 WeakPolarHBondContact O-CG 3.45Å; E399-L403 PolarHBondContact O-N 3.46Å; I400-L403 PolarHBondContact O-N 3.46Å; N401-L403 VanDerWaalsContact C-N 3.27Å; N401-L403 PolarHBondContact O-N 2.86Å; L403-K406 PolarHBondContact O-N 2.8Å; L403-L407 WeakPolarHBondContact O-CB 3.16Å; L403-L407 PolarHBondContact O-N 3.02Å
404	N	80.7	Confident	76.6	Confident	89 Å²	89	103.7 Å²	103.7	48%	0.476	51%	0.514	S	S	.	.	H	α-helix	trans	-64.4	-43.1	174.5	-71.7	-25.7	0	0	0	112.1	I400 N401 K406 L407 S408	I400-N404 PolarHBondContact O-N 2.85Å; I400-N404 PolarHBondContact O-ND2 3.22Å; N401-N404 PolarHBondContact O-N 3.41Å; N404-K406 VanDerWaalsContact C-N 3.32Å; N404-K406 PolarHBondContact O-N 3.35Å; N404-L407 WeakPolarHBondContact O-CB 3.33Å; N404-L407 PolarHBondContact O-N 3.5Å; N404-L407 VanDerWaalsContact O-N 3.08Å; N404-S408 PolarHBondContact O-N 2.82Å
405	E	81.4	Confident	74.4	Confident	143 Å²	143	105.6 Å²	105.6	67%	0.668	52%	0.524	S	S	*	.	H	α-helix	trans	-64.4	-35.3	176.6	-174.4	176.7	-152.1	0	0	112.3	N401 S408 F409	N401-E405 PolarHBondContact O-N 2.66Å; E405-S408 PolarHBondContact O-OG 2.96Å; E405-S408 VanDerWaalsContact O-OG 3.1Å; E405-F409 PolarHBondContact O-N 2.97Å
406	K	83	Confident	72.4	Confident	111 Å²	111	107.9 Å²	107.9	48%	0.483	54%	0.535	S	S	.	.	H	α-helix	trans	-66.9	-38.9	170.1	-71.6	162.7	-165.3	160.6	0	111.4	Q402 L403 N404 F409 Y410	Q402-K406 WeakPolarHBondContact O-CD 3.09Å; Q402-K406 WeakPolarHBondContact O-CE 3.43Å; Q402-K406 WeakPolarHBondContact O-CG 3.24Å; Q402-K406 PolarHBondContact O-N 2.89Å; L403-K406 PolarHBondContact O-N 2.8Å; N404-K406 VanDerWaalsContact C-N 3.32Å; N404-K406 PolarHBondContact O-N 3.35Å; K406-F409 PolarHBondContact O-N 2.78Å; K406-Y410 WeakPolarHBondContact O-CD2 3.4Å; K406-Y410 PolarHBondContact O-N 2.88Å
407	L	76.1	Confident	70.4	Confident	99 Å²	99	114.6 Å²	114.6	52%	0.518	56%	0.559	S	S	.	*	H	α-helix	trans	-66.1	-43.9	-178	-165.2	73.5	0	0	0	112.3	L403 N404 F409 Y410 Q411	L403-L407 WeakPolarHBondContact O-CB 3.16Å; L403-L407 PolarHBondContact O-N 3.02Å; N404-L407 WeakPolarHBondContact O-CB 3.33Å; N404-L407 PolarHBondContact O-N 3.5Å; N404-L407 VanDerWaalsContact O-N 3.08Å; L407-F409 VanDerWaalsContact C-N 3.32Å; L407-F409 PolarHBondContact O-N 2.83Å; L407-Y410 PolarHBondContact O-N 2.75Å; L407-Y410 VanDerWaalsContact O-N 3.16Å; L407-Q411 PolarHBondContact O-N 3.11Å
408	S	73.6	Confident	68	Low	55 Å²	55	112.2 Å²	112.2	39%	0.385	57%	0.565	S	S	.	*	H	α-helix	trans	-62	-40.9	175.9	56.6	0	0	0	0	111.7	N404 E405 Y410 Q411 D412	N404-S408 PolarHBondContact O-N 2.82Å; E405-S408 PolarHBondContact O-OG 2.96Å; E405-S408 VanDerWaalsContact O-OG 3.1Å; S408-Y410 PolarHBondContact O-N 2.89Å; S408-Q411 PolarHBondContact O-N 2.74Å; S408-D412 PolarHBondContact O-N 2.92Å
409	F	75.1	Confident	65.5	Low	134 Å²	134	114 Å²	114	59%	0.588	58%	0.576	S	S	*	*	H	α-helix	trans	-63.4	-22	176.7	-162	-96.7	0	0	0	114.1	E405 K406 L407	E405-F409 PolarHBondContact O-N 2.97Å; K406-F409 PolarHBondContact O-N 2.78Å; L407-F409 VanDerWaalsContact C-N 3.32Å; L407-F409 PolarHBondContact O-N 2.83Å
410	Y	67.1	Low	63	Low	165 Å²	165	116 Å²	116	65%	0.647	59%	0.59	S	S	*	*	H	α-helix	trans	-83	-40.5	168.6	-77.7	-69.4	0	0	0	112.5	K406 L407 S408 K413 T414	K406-Y410 WeakPolarHBondContact O-CD2 3.4Å; K406-Y410 PolarHBondContact O-N 2.88Å; L407-Y410 PolarHBondContact O-N 2.75Å; L407-Y410 VanDerWaalsContact O-N 3.16Å; S408-Y410 PolarHBondContact O-N 2.89Å; Y410-K413 PolarHBondContact O-N 2.78Å; Y410-T414 PolarHBondContact O-N 3.01Å; Y410-T414 PolarHBondContact O-OG1 2.9Å
411	Q	55.1	Low	60.8	Low	116 Å²	116	117.1 Å²	117.1	54%	0.542	61%	0.606	S	S	.	*	H	α-helix	trans	-63.1	-42.4	179.4	-72.1	-174	-60.7	0	0	112.7	L407 S408 K413 T414 N415	L407-Q411 PolarHBondContact O-N 3.11Å; S408-Q411 PolarHBondContact O-N 2.74Å; Q411-K413 PolarHBondContact O-N 2.91Å; Q411-T414 WeakPolarHBondContact CA-OG1 3.31Å; Q411-T414 PolarHBondContact O-N 3.49Å; Q411-T414 VanDerWaalsContact O-N 3.13Å; Q411-T414 PolarHBondContact O-OG1 3.16Å; Q411-N415 PolarHBondContact O-N 2.87Å
412	D	55.4	Low	58.4	Low	109 Å²	109	116.9 Å²	116.9	58%	0.583	62%	0.619	S	S	*	*	H	α-helix	trans	-62.8	-31.1	177.8	-72.7	-24.1	0	0	0	112.6	S408	S408-D412 PolarHBondContact O-N 2.92Å
413	K	54.4	Low	56.3	Low	136 Å²	136	120.5 Å²	120.5	59%	0.591	64%	0.636	S	S	*	*	H	α-helix	trans	-74.4	-32.9	174.7	-74	-173.3	175.5	-170.4	0	113.3	Y410 Q411	Y410-K413 PolarHBondContact O-N 2.78Å; Q411-K413 PolarHBondContact O-N 2.91Å
414	T	49.2	Very low	54.1	Low	92 Å²	92	123.3 Å²	123.3	56%	0.564	66%	0.656	S	S	*	*	H	α-helix	trans	-75.8	-21.3	179.8	47	0	0	0	0	114.3	Y410 Q411 I416	Y410-T414 PolarHBondContact O-N 3.01Å; Y410-T414 PolarHBondContact O-OG1 2.9Å; Q411-T414 WeakPolarHBondContact CA-OG1 3.31Å; Q411-T414 PolarHBondContact O-N 3.49Å; Q411-T414 VanDerWaalsContact O-N 3.13Å; Q411-T414 PolarHBondContact O-OG1 3.16Å; T414-I416 VanDerWaalsContact C-N 3.33Å; T414-I416 PolarHBondContact O-N 3.27Å
415	N	41.9	Very low	52.6	Low	120 Å²	120	128.1 Å²	128.1	64%	0.642	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.9	-3.6	-174.6	-86.1	-22.8	0	0	0	115.4	Q411	Q411-N415 PolarHBondContact O-N 2.87Å
416	I	48	Very low	51.3	Low	140 Å²	140	132.1 Å²	132.1	72%	0.718	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.1	-24.6	-172.1	-65.1	174.3	0	0	0	113	T414	T414-I416 VanDerWaalsContact C-N 3.33Å; T414-I416 PolarHBondContact O-N 3.27Å
417	E	43.3	Very low	49.7	Very low	184 Å²	184	133.2 Å²	133.2	86%	0.86	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.9	-8.2	-171.1	-64.3	-173.7	146.9	0	0	114.9
418	S	38.1	Very low	49.9	Very low	95 Å²	95	131.8 Å²	131.8	66%	0.664	68%	0.682	S	S	*	*			trans	-110.2	62.7	-174.4	70.3	0	0	0	0	114.5
419	T	32.8	Very low	50.1	Low	112 Å²	112	140.1 Å²	140.1	69%	0.687	71%	0.705	S	S	*	*			trans	-99.2	150.1	160.1	56.2	0	0	0	0	110.1
420	N	34.7	Very low	50.3	Low	151 Å²	151	138.1 Å²	138.1	81%	0.807	71%	0.708	S	S	*	*			trans	70.9	81.5	-177	-47.8	-51.2	0	0	0	116.9
421	S	36.4	Very low	50.7	Low	121 Å²	121	134.2 Å²	134.2	85%	0.846	70%	0.695	S	S	*	*			trans	-162.4	52.8	154.9	-89	0	0	0	0	113.6	Q423	S421-Q423 PolarHBondContact O-N 2.81Å; S421-Q423 VanDerWaalsContact O-N 3.15Å
422	A	31.6	Very low	51.9	Low	98 Å²	98	133.7 Å²	133.7	81%	0.81	69%	0.694	S	S	*	*			trans	-81	87.7	174.2	0	0	0	0	0	111.4
423	Q	42.9	Very low	53.2	Low	174 Å²	174	131.1 Å²	131.1	81%	0.813	69%	0.688	S	S	*	*			trans	-133.7	142	167.6	-70.4	-167.5	2.2	0	0	111.5	S421 K425	S421-Q423 PolarHBondContact O-N 2.81Å; S421-Q423 VanDerWaalsContact O-N 3.15Å; Q423-K425 PolarHBondContact O-N 3.16Å
424	V	36	Very low	54.7	Low	146 Å²	146	131.5 Å²	131.5	89%	0.885	69%	0.686	S	S	*	*			trans	-70.2	95.9	-179.4	-178.8	0	0	0	0	109.5	R426	V424-R426 PolarHBondContact O-N 3.18Å
425	K	48.5	Very low	56.3	Low	189 Å²	189	131.1 Å²	131.1	82%	0.822	68%	0.68	S	S	*	*			trans	-66.2	97.4	-176	-71.8	-172.5	176.2	-176.5	0	111.7	Q423	Q423-K425 PolarHBondContact O-N 3.16Å
426	R	54.1	Low	58.4	Low	228 Å²	228	129.6 Å²	129.6	86%	0.86	67%	0.671	S	S	*	*	P	Polyproline II helix	trans	-58.6	143.1	155.1	-67.7	177.6	172.4	179.7	-2.5	108.4	V424 T428	V424-R426 PolarHBondContact O-N 3.18Å; R426-T428 PolarHBondContact O-N 3.01Å; R426-T428 VanDerWaalsContact O-N 3.16Å
427	F	49.6	Very low	60.2	Low	133 Å²	133	126 Å²	126	58%	0.583	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-48.3	120.9	173	-104.2	-75.1	0	0	0	111.2	E431 M432 I435	F427-E431 HydrophobicContact CD1-CB 3.69Å; F427-E431 HydrophobicContact CE1-CB 3.94Å; F427-M432 HydrophobicContact CB-CE 4.37Å; F427-I435 HydrophobicContact CE1-CD1 3.42Å; F427-I435 VanDerWaalsContact CE1-CD1 3.42Å; F427-I435 HydrophobicContact CZ-CD1 3.62Å
428	T	80.8	Confident	62.3	Low	70 Å²	70	121.6 Å²	121.6	43%	0.429	64%	0.641	S	S	.	*	P	Polyproline II helix	trans	-68.8	155.4	172.4	64.8	0	0	0	0	110.2	R426 S430 E431 M432	R426-T428 PolarHBondContact O-N 3.01Å; R426-T428 VanDerWaalsContact O-N 3.16Å; T428-S430 PolarHBondContact O-N 2.81Å; T428-E431 VanDerWaalsContact CB-OE2 3.28Å; T428-E431 WeakPolarHBondContact CB-OE2 3.44Å; T428-E431 WeakPolarHBondContact CG2-OE2 3.38Å; T428-E431 PolarHBondContact N-OE2 2.96Å; T428-E431 PolarHBondContact O-N 2.86Å; T428-E431 WeakPolarHBondContact OG1-CB 3.33Å; T428-E431 VanDerWaalsContact OG1-CD 3.23Å; T428-E431 WeakPolarHBondContact OG1-CG 3.47Å; T428-E431 PolarHBondContact OG1-N 3.43Å; T428-E431 VanDerWaalsContact OG1-N 3.12Å; T428-E431 PolarHBondContact OG1-OE2 2.85Å; T428-M432 PolarHBondContact O-N 3.45Å
429	R	78.3	Confident	64.6	Low	230 Å²	230	124.8 Å²	124.8	87%	0.868	64%	0.639	S	S	*	*	H	α-helix	trans	-58.3	-32.9	175	-167.4	178.5	-178.2	-162.5	0.3	111.6	A433	R429-A433 VanDerWaalsContact O-CB 3.28Å; R429-A433 WeakPolarHBondContact O-CB 3.49Å; R429-A433 PolarHBondContact O-N 3.3Å
430	S	77.7	Confident	67.2	Low	91 Å²	91	123.2 Å²	123.2	64%	0.636	63%	0.626	S	S	*	*	H	α-helix	trans	-70.7	-44.7	178.4	-52.5	0	0	0	0	112.7	T428 A433 R434	T428-S430 PolarHBondContact O-N 2.81Å; S430-A433 PolarHBondContact O-N 3.02Å; S430-R434 WeakPolarHBondContact O-CB 3.33Å; S430-R434 PolarHBondContact O-N 3.01Å
431	E	77.4	Confident	69.7	Low	83 Å²	83	120.8 Å²	120.8	39%	0.388	61%	0.61	S	S	.	*	H	α-helix	trans	-64.8	-42.6	173.9	-70.8	159.8	134	0	0	111.4	F427 T428 A433 R434 I435	F427-E431 HydrophobicContact CD1-CB 3.69Å; F427-E431 HydrophobicContact CE1-CB 3.94Å; T428-E431 VanDerWaalsContact CB-OE2 3.28Å; T428-E431 WeakPolarHBondContact CB-OE2 3.44Å; T428-E431 WeakPolarHBondContact CG2-OE2 3.38Å; T428-E431 PolarHBondContact N-OE2 2.96Å; T428-E431 PolarHBondContact O-N 2.86Å; T428-E431 WeakPolarHBondContact OG1-CB 3.33Å; T428-E431 VanDerWaalsContact OG1-CD 3.23Å; T428-E431 WeakPolarHBondContact OG1-CG 3.47Å; T428-E431 PolarHBondContact OG1-N 3.43Å; T428-E431 VanDerWaalsContact OG1-N 3.12Å; T428-E431 PolarHBondContact OG1-OE2 2.85Å; E431-A433 VanDerWaalsContact C-N 3.34Å; E431-A433 PolarHBondContact O-N 3.05Å; E431-R434 WeakPolarHBondContact O-CB 3.35Å; E431-R434 PolarHBondContact O-N 3.16Å; E431-I435 WeakPolarHBondContact O-CG1 3.42Å; E431-I435 PolarHBondContact O-N 2.91Å
432	M	78.9	Confident	72.1	Confident	105 Å²	105	122 Å²	122	52%	0.517	60%	0.597	S	S	.	*	H	α-helix	trans	-63.3	-40	176.1	-171	178.2	-67.7	0	0	111.7	F427 T428 L436	F427-M432 HydrophobicContact CB-CE 4.37Å; T428-M432 PolarHBondContact O-N 3.45Å; M432-L436 HydrophobicContact CG-CD1 4.19Å; M432-L436 WeakPolarHBondContact O-CB 3.22Å; M432-L436 VanDerWaalsContact O-CG 3.26Å; M432-L436 WeakPolarHBondContact O-CG 3.28Å; M432-L436 PolarHBondContact O-N 3.45Å
433	A	83	Confident	74.8	Confident	55 Å²	55	122.1 Å²	122.1	46%	0.455	58%	0.579	S	S	.	*	H	α-helix	trans	-64.5	-41	173.5	0	0	0	0	0	112.2	R429 S430 E431 L436 A437	R429-A433 VanDerWaalsContact O-CB 3.28Å; R429-A433 WeakPolarHBondContact O-CB 3.49Å; R429-A433 PolarHBondContact O-N 3.3Å; S430-A433 PolarHBondContact O-N 3.02Å; E431-A433 VanDerWaalsContact C-N 3.34Å; E431-A433 PolarHBondContact O-N 3.05Å; A433-L436 PolarHBondContact O-N 3.37Å; A433-A437 WeakPolarHBondContact O-CB 3.44Å; A433-A437 PolarHBondContact O-N 2.93Å
434	R	86	Confident	76.9	Confident	144 Å²	144	119.7 Å²	119.7	54%	0.543	57%	0.568	S	S	.	*	H	α-helix	trans	-60.4	-48.4	175.4	-169.8	-177.4	-67.8	-171.7	-1.3	111.2	S430 E431 L436 A437 E438	S430-R434 WeakPolarHBondContact O-CB 3.33Å; S430-R434 PolarHBondContact O-N 3.01Å; E431-R434 WeakPolarHBondContact O-CB 3.35Å; E431-R434 PolarHBondContact O-N 3.16Å; R434-L436 VanDerWaalsContact C-N 3.35Å; R434-L436 PolarHBondContact O-N 3.2Å; R434-A437 PolarHBondContact O-N 2.78Å; R434-E438 WeakPolarHBondContact O-CB 3.34Å; R434-E438 PolarHBondContact O-N 2.95Å
435	I	82.9	Confident	79.3	Confident	85 Å²	85	119.2 Å²	119.2	44%	0.436	55%	0.55	S	S	.	*	H	α-helix	trans	-63.9	-37.7	176.9	-70.2	178.1	0	0	0	111.8	F427 E431 R439	F427-I435 HydrophobicContact CE1-CD1 3.42Å; F427-I435 VanDerWaalsContact CE1-CD1 3.42Å; F427-I435 HydrophobicContact CZ-CD1 3.62Å; E431-I435 WeakPolarHBondContact O-CG1 3.42Å; E431-I435 PolarHBondContact O-N 2.91Å; I435-R439 WeakPolarHBondContact O-CB 3.35Å; I435-R439 PolarHBondContact O-N 3.4Å
436	L	86.4	Confident	81.1	Confident	88 Å²	88	114.7 Å²	114.7	46%	0.461	53%	0.534	S	S	.	.	H	α-helix	trans	-69.1	-39.4	176.2	-75	169.9	0	0	0	112.5	M432 A433 R434 N440	M432-L436 HydrophobicContact CG-CD1 4.19Å; M432-L436 WeakPolarHBondContact O-CB 3.22Å; M432-L436 VanDerWaalsContact O-CG 3.26Å; M432-L436 WeakPolarHBondContact O-CG 3.28Å; M432-L436 PolarHBondContact O-N 3.45Å; A433-L436 PolarHBondContact O-N 3.37Å; R434-L436 VanDerWaalsContact C-N 3.35Å; R434-L436 PolarHBondContact O-N 3.2Å; L436-N440 WeakPolarHBondContact O-CB 3.29Å; L436-N440 PolarHBondContact O-N 2.87Å; L436-N440 PolarHBondContact O-ND2 3.42Å
437	A	85	Confident	82.5	Confident	63 Å²	63	108.3 Å²	108.3	52%	0.521	52%	0.517	S	S	.	.	H	α-helix	trans	-64.4	-47.9	174.6	0	0	0	0	0	111.3	A433 R434 N440 H441	A433-A437 WeakPolarHBondContact O-CB 3.44Å; A433-A437 PolarHBondContact O-N 2.93Å; R434-A437 PolarHBondContact O-N 2.78Å; A437-N440 PolarHBondContact O-N 3Å; A437-N440 VanDerWaalsContact O-N 3.16Å; A437-H441 PolarHBondContact O-N 2.72Å
438	E	87.6	Confident	84.3	Confident	93 Å²	93	107 Å²	107	44%	0.435	51%	0.512	S	S	.	.	H	α-helix	trans	-63.1	-44.5	177	178.5	166.9	-161.8	0	0	112	R434 N440 H441 Y442	R434-E438 WeakPolarHBondContact O-CB 3.34Å; R434-E438 PolarHBondContact O-N 2.95Å; E438-N440 VanDerWaalsContact C-N 3.25Å; E438-N440 PolarHBondContact O-N 2.79Å; E438-H441 PolarHBondContact O-N 2.98Å; E438-Y442 HydrophobicContact CG-CD2 3.87Å; E438-Y442 HydrophobicContact CG-CE2 3.34Å; E438-Y442 WeakPolarHBondContact O-CD2 3.38Å; E438-Y442 PolarHBondContact O-N 3.41Å; E438-Y442 WeakPolarHBondContact OE1-CE2 3.34Å; E438-Y442 PolarHBondContact OE1-OH 3.28Å; E438-Y442 VanDerWaalsContact OE1-OH 3.09Å
439	R	87.1	Confident	84.7	Confident	161 Å²	161	108.7 Å²	108.7	61%	0.608	52%	0.518	S	S	*	.	H	α-helix	trans	-60.2	-34.4	173.1	-176.7	177.2	-178.6	-171.1	1.2	112.3	I435 K443	I435-R439 WeakPolarHBondContact O-CB 3.35Å; I435-R439 PolarHBondContact O-N 3.4Å; R439-K443 WeakPolarHBondContact O-CG 3.24Å; R439-K443 PolarHBondContact O-N 3.12Å
440	N	86.5	Confident	85	Confident	80 Å²	80	101.9 Å²	101.9	43%	0.428	50%	0.496	S	S	.	.	H	α-helix	trans	-76.2	-36.5	176.5	-74.5	-16	0	0	0	112.1	L436 A437 E438 Y442 K443 E444	L436-N440 WeakPolarHBondContact O-CB 3.29Å; L436-N440 PolarHBondContact O-N 2.87Å; L436-N440 PolarHBondContact O-ND2 3.42Å; A437-N440 PolarHBondContact O-N 3Å; A437-N440 VanDerWaalsContact O-N 3.16Å; E438-N440 VanDerWaalsContact C-N 3.25Å; E438-N440 PolarHBondContact O-N 2.79Å; N440-Y442 PolarHBondContact O-N 2.93Å; N440-K443 WeakPolarHBondContact O-CB 3.43Å; N440-K443 PolarHBondContact O-N 3.37Å; N440-K443 VanDerWaalsContact O-N 3.12Å; N440-K443 PolarHBondContact OD1-NZ 3.11Å; N440-E444 PolarHBondContact O-N 3.43Å
441	H	86.6	Confident	85.3	Confident	99 Å²	99	101.5 Å²	101.5	46%	0.458	49%	0.487	S	S	.	.	H	α-helix	trans	-61.1	-43.1	172.4	-177.2	58.7	0	0	0	111.9	A437 E438 K443 E444 R445	A437-H441 PolarHBondContact O-N 2.72Å; E438-H441 PolarHBondContact O-N 2.98Å; H441-K443 VanDerWaalsContact C-N 3.32Å; H441-K443 PolarHBondContact O-N 3.5Å; H441-E444 PolarHBondContact O-N 2.96Å; H441-R445 WeakPolarHBondContact O-CB 3.25Å; H441-R445 PolarHBondContact O-N 3.28Å
442	Y	87.7	Confident	85.6	Confident	146 Å²	146	99.9 Å²	99.9	57%	0.573	49%	0.488	S	S	*	.	H	α-helix	trans	-65.3	-30.7	173.2	-68.3	-55.8	0	0	0	113.3	E438 N440 L446	E438-Y442 HydrophobicContact CG-CD2 3.87Å; E438-Y442 HydrophobicContact CG-CE2 3.34Å; E438-Y442 WeakPolarHBondContact O-CD2 3.38Å; E438-Y442 PolarHBondContact O-N 3.41Å; E438-Y442 WeakPolarHBondContact OE1-CE2 3.34Å; E438-Y442 PolarHBondContact OE1-OH 3.28Å; E438-Y442 VanDerWaalsContact OE1-OH 3.09Å; N440-Y442 PolarHBondContact O-N 2.93Å; Y442-L446 WeakPolarHBondContact O-CB 3.41Å; Y442-L446 PolarHBondContact O-N 3.48Å
443	K	88.1	Confident	85.7	Confident	102 Å²	102	99.6 Å²	99.6	44%	0.443	49%	0.492	S	S	.	.	H	α-helix	trans	-69	-43.9	171.6	-72.4	171.5	-169.9	164	0	112.1	R439 N440 H441 L446 L447	R439-K443 WeakPolarHBondContact O-CG 3.24Å; R439-K443 PolarHBondContact O-N 3.12Å; N440-K443 WeakPolarHBondContact O-CB 3.43Å; N440-K443 PolarHBondContact O-N 3.37Å; N440-K443 VanDerWaalsContact O-N 3.12Å; N440-K443 PolarHBondContact OD1-NZ 3.11Å; H441-K443 VanDerWaalsContact C-N 3.32Å; H441-K443 PolarHBondContact O-N 3.5Å; K443-L446 WeakPolarHBondContact O-CB 3.24Å; K443-L446 PolarHBondContact O-N 3.42Å; K443-L447 WeakPolarHBondContact O-CG 3.13Å; K443-L447 PolarHBondContact O-N 3.39Å
444	E	86.7	Confident	85.5	Confident	123 Å²	123	103.4 Å²	103.4	58%	0.575	50%	0.495	S	S	*	.	H	α-helix	trans	-60.6	-49.3	178.8	-174.4	168.3	-133.6	0	0	109.8	N440 H441 L446 L447 E448	N440-E444 PolarHBondContact O-N 3.43Å; H441-E444 PolarHBondContact O-N 2.96Å; E444-L446 VanDerWaalsContact C-N 3.31Å; E444-L446 PolarHBondContact O-N 3.49Å; E444-L447 WeakPolarHBondContact O-CA 3.41Å; E444-L447 WeakPolarHBondContact O-CB 3.3Å; E444-L447 PolarHBondContact O-N 3.24Å; E444-E448 WeakPolarHBondContact O-CG 3.31Å; E444-E448 PolarHBondContact O-N 2.78Å
445	R	86.9	Confident	85.3	Confident	136 Å²	136	103 Å²	103	51%	0.513	50%	0.497	S	S	.	.	H	α-helix	trans	-65	-30.2	175.5	-160.8	158.9	-170.2	76.3	-12.5	113.7	H441 E448 L449	H441-R445 WeakPolarHBondContact O-CB 3.25Å; H441-R445 PolarHBondContact O-N 3.28Å; R445-E448 IonicContact NH1-OE2 2.84Å; R445-E448 PolarHBondContact NH1-OE2 3.12Å; R445-L449 WeakPolarHBondContact O-CB 3.38Å; R445-L449 WeakPolarHBondContact O-CD1 3.29Å; R445-L449 VanDerWaalsContact O-CG 3.23Å; R445-L449 WeakPolarHBondContact O-CG 3.48Å; R445-L449 PolarHBondContact O-N 2.98Å
446	L	85.8	Confident	84.9	Confident	94 Å²	94	102.1 Å²	102.1	49%	0.492	50%	0.496	S	S	.	.	H	α-helix	trans	-68.3	-38	170.4	178	63.1	0	0	0	112	Y442 K443 E444 L449 Q450	Y442-L446 WeakPolarHBondContact O-CB 3.41Å; Y442-L446 PolarHBondContact O-N 3.48Å; K443-L446 WeakPolarHBondContact O-CB 3.24Å; K443-L446 PolarHBondContact O-N 3.42Å; E444-L446 VanDerWaalsContact C-N 3.31Å; E444-L446 PolarHBondContact O-N 3.49Å; L446-L449 PolarHBondContact O-N 3.37Å; L446-Q450 HydrophobicContact CD1-CG 4.41Å; L446-Q450 WeakPolarHBondContact O-CB 3.42Å; L446-Q450 VanDerWaalsContact O-CG 3.26Å; L446-Q450 WeakPolarHBondContact O-CG 3.44Å; L446-Q450 PolarHBondContact O-N 3.42Å
447	L	84.7	Confident	84.1	Confident	94 Å²	94	102.1 Å²	102.1	49%	0.492	49%	0.493	S	S	.	.	H	α-helix	trans	-67.9	-45	174.4	-70.6	166.6	0	0	0	111.1	K443 E444 L449 Q450 D451	K443-L447 WeakPolarHBondContact O-CG 3.13Å; K443-L447 PolarHBondContact O-N 3.39Å; E444-L447 WeakPolarHBondContact O-CA 3.41Å; E444-L447 WeakPolarHBondContact O-CB 3.3Å; E444-L447 PolarHBondContact O-N 3.24Å; L447-L449 VanDerWaalsContact C-N 3.3Å; L447-L449 PolarHBondContact O-N 2.84Å; L447-Q450 PolarHBondContact O-N 3.05Å; L447-D451 PolarHBondContact O-N 3.38Å
448	E	86.6	Confident	83.6	Confident	105 Å²	105	103 Å²	103	49%	0.491	49%	0.493	S	S	.	.	H	α-helix	trans	-52.6	-48	171.8	-68.6	-179	143.1	0	0	111.4	E444 R445 D451 A452	E444-E448 WeakPolarHBondContact O-CG 3.31Å; E444-E448 PolarHBondContact O-N 2.78Å; R445-E448 IonicContact NH1-OE2 2.84Å; R445-E448 PolarHBondContact NH1-OE2 3.12Å; E448-D451 PolarHBondContact O-N 2.84Å; E448-A452 WeakPolarHBondContact O-CB 3.44Å; E448-A452 PolarHBondContact O-N 2.97Å
449	L	89.2	Confident	82.9	Confident	106 Å²	106	102.1 Å²	102.1	56%	0.555	49%	0.49	S	S	*	.	H	α-helix	trans	-67.6	-39	178.7	-74.1	167.9	0	0	0	112.5	R445 L446 L447 A452 V453	R445-L449 WeakPolarHBondContact O-CB 3.38Å; R445-L449 WeakPolarHBondContact O-CD1 3.29Å; R445-L449 VanDerWaalsContact O-CG 3.23Å; R445-L449 WeakPolarHBondContact O-CG 3.48Å; R445-L449 PolarHBondContact O-N 2.98Å; L446-L449 PolarHBondContact O-N 3.37Å; L447-L449 VanDerWaalsContact C-N 3.3Å; L447-L449 PolarHBondContact O-N 2.84Å; L449-A452 PolarHBondContact O-N 2.86Å; L449-V453 WeakPolarHBondContact O-CB 3.43Å; L449-V453 VanDerWaalsContact O-CG2 3.29Å; L449-V453 WeakPolarHBondContact O-CG2 3.38Å; L449-V453 PolarHBondContact O-N 2.87Å
450	Q	85	Confident	82.1	Confident	86 Å²	86	100.1 Å²	100.1	40%	0.402	48%	0.483	S	S	.	.	H	α-helix	trans	-64.8	-38.7	174.9	-77.4	177.9	6.7	0	0	111.9	L446 L447 V453 R454	L446-Q450 HydrophobicContact CD1-CG 4.41Å; L446-Q450 WeakPolarHBondContact O-CB 3.42Å; L446-Q450 VanDerWaalsContact O-CG 3.26Å; L446-Q450 WeakPolarHBondContact O-CG 3.44Å; L446-Q450 PolarHBondContact O-N 3.42Å; L447-Q450 PolarHBondContact O-N 3.05Å; Q450-V453 PolarHBondContact O-N 3.06Å; Q450-R454 WeakPolarHBondContact O-CB 3.33Å; Q450-R454 WeakPolarHBondContact O-CG 3.45Å; Q450-R454 PolarHBondContact O-N 3.33Å
451	D	83.2	Confident	80.8	Confident	83 Å²	83	100.3 Å²	100.3	44%	0.444	49%	0.486	S	S	.	.	H	α-helix	trans	-72.9	-36.8	175.4	-78.8	-29.5	0	0	0	112.7	L447 E448 V453 R454 F455	L447-D451 PolarHBondContact O-N 3.38Å; E448-D451 PolarHBondContact O-N 2.84Å; D451-V453 VanDerWaalsContact C-N 3.34Å; D451-V453 PolarHBondContact O-N 2.77Å; D451-R454 PolarHBondContact O-N 3.33Å; D451-R454 IonicContact OD1-CZ 2.73Å; D451-R454 IonicContact OD1-NE 2.67Å; D451-R454 PolarHBondContact OD1-NE 3.43Å; D451-R454 IonicContact OD1-NH2 3.55Å; D451-R454 PolarHBondContact OD1-NH2 3.48Å; D451-R454 IonicContact OD2-NH2 3.12Å; D451-F455 VanDerWaalsContact O-CB 3.24Å; D451-F455 WeakPolarHBondContact O-CB 3.43Å; D451-F455 PolarHBondContact O-N 3.35Å
452	A	84.7	Confident	79.7	Confident	50 Å²	50	99.5 Å²	99.5	41%	0.413	49%	0.492	S	S	.	.	H	α-helix	trans	-61.7	-40.6	170.6	0	0	0	0	0	112.1	E448 L449 T456	E448-A452 WeakPolarHBondContact O-CB 3.44Å; E448-A452 PolarHBondContact O-N 2.97Å; L449-A452 PolarHBondContact O-N 2.86Å; A452-T456 WeakPolarHBondContact O-CB 3.42Å; A452-T456 PolarHBondContact O-N 2.66Å; A452-T456 PolarHBondContact O-OG1 2.87Å
453	V	79.1	Confident	78.2	Confident	98 Å²	98	100 Å²	100	59%	0.594	50%	0.5	S	S	*	.	H	α-helix	trans	-66.9	-46.6	173.9	169.3	0	0	0	0	111.1	L449 Q450 D451 F455 T456 E457	L449-V453 WeakPolarHBondContact O-CB 3.43Å; L449-V453 VanDerWaalsContact O-CG2 3.29Å; L449-V453 WeakPolarHBondContact O-CG2 3.38Å; L449-V453 PolarHBondContact O-N 2.87Å; Q450-V453 PolarHBondContact O-N 3.06Å; D451-V453 VanDerWaalsContact C-N 3.34Å; D451-V453 PolarHBondContact O-N 2.77Å; V453-F455 VanDerWaalsContact C-N 3.33Å; V453-F455 PolarHBondContact O-N 2.71Å; V453-T456 PolarHBondContact O-N 3.41Å; V453-E457 WeakPolarHBondContact O-CB 3.41Å; V453-E457 PolarHBondContact O-N 3.47Å
454	R	80.3	Confident	76.3	Confident	136 Å²	136	103.1 Å²	103.1	51%	0.513	51%	0.513	S	S	.	.	H	α-helix	trans	-59.2	-41.4	175.6	-78.9	-168.4	-78.7	-126.1	3.3	112.5	Q450 D451 E457 T458	Q450-R454 WeakPolarHBondContact O-CB 3.33Å; Q450-R454 WeakPolarHBondContact O-CG 3.45Å; Q450-R454 PolarHBondContact O-N 3.33Å; D451-R454 PolarHBondContact O-N 3.33Å; D451-R454 IonicContact OD1-CZ 2.73Å; D451-R454 IonicContact OD1-NE 2.67Å; D451-R454 PolarHBondContact OD1-NE 3.43Å; D451-R454 IonicContact OD1-NH2 3.55Å; D451-R454 PolarHBondContact OD1-NH2 3.48Å; D451-R454 IonicContact OD2-NH2 3.12Å; R454-E457 PolarHBondContact O-N 3.16Å; R454-T458 WeakPolarHBondContact O-CB 3.4Å; R454-T458 PolarHBondContact O-N 2.88Å; R454-T458 PolarHBondContact O-OG1 3.18Å
455	F	80.9	Confident	73.8	Confident	135 Å²	135	100.5 Å²	100.5	59%	0.592	52%	0.519	S	S	*	.	H	α-helix	trans	-66.9	-42.3	175.8	-175.5	-107.7	0	0	0	111.8	D451 V453 E457 T458 L459	D451-F455 VanDerWaalsContact O-CB 3.24Å; D451-F455 WeakPolarHBondContact O-CB 3.43Å; D451-F455 PolarHBondContact O-N 3.35Å; V453-F455 VanDerWaalsContact C-N 3.33Å; V453-F455 PolarHBondContact O-N 2.71Å; F455-E457 VanDerWaalsContact C-N 3.33Å; F455-E457 PolarHBondContact O-N 2.9Å; F455-T458 PolarHBondContact O-N 2.89Å; F455-L459 HydrophobicContact CD1-CD1 3.94Å; F455-L459 HydrophobicContact CE1-CD1 3.53Å; F455-L459 HydrophobicContact CE1-CG 4.25Å; F455-L459 HydrophobicContact CZ-CD1 4.03Å; F455-L459 HydrophobicContact CZ-CG 4.35Å; F455-L459 PolarHBondContact O-N 2.67Å
456	T	75.7	Confident	71.5	Confident	67 Å²	67	101 Å²	101	41%	0.411	53%	0.527	S	S	.	.	H	α-helix	trans	-63.7	-38.5	175.4	-56.8	0	0	0	0	111.7	A452 V453 L459 R460	A452-T456 WeakPolarHBondContact O-CB 3.42Å; A452-T456 PolarHBondContact O-N 2.66Å; A452-T456 PolarHBondContact O-OG1 2.87Å; V453-T456 PolarHBondContact O-N 3.41Å; T456-L459 PolarHBondContact O-N 2.82Å; T456-R460 WeakPolarHBondContact O-CB 3.49Å; T456-R460 PolarHBondContact O-N 3.45Å
457	E	68.1	Low	69.1	Low	88 Å²	88	108.1 Å²	108.1	41%	0.411	55%	0.547	S	S	.	.	H	α-helix	trans	-71.4	-37.6	175.9	-160.7	58.5	-144.5	0	0	111.6	V453 R454 F455 L459 R460 V461	V453-E457 WeakPolarHBondContact O-CB 3.41Å; V453-E457 PolarHBondContact O-N 3.47Å; R454-E457 PolarHBondContact O-N 3.16Å; F455-E457 VanDerWaalsContact C-N 3.33Å; F455-E457 PolarHBondContact O-N 2.9Å; E457-L459 VanDerWaalsContact C-N 3.33Å; E457-L459 PolarHBondContact O-N 2.75Å; E457-R460 WeakPolarHBondContact O-CB 3.4Å; E457-R460 PolarHBondContact O-N 3.31Å; E457-R460 IonicContact OE2-CZ 3.96Å; E457-R460 IonicContact OE2-NH1 2.9Å; E457-R460 PolarHBondContact OE2-NH1 2.85Å; E457-V461 WeakPolarHBondContact O-CB 3.34Å; E457-V461 WeakPolarHBondContact O-CG2 3.31Å; E457-V461 PolarHBondContact O-N 2.93Å
458	T	75.5	Confident	67.1	Low	82 Å²	82	112.4 Å²	112.4	50%	0.503	56%	0.564	S	S	.	*	H	α-helix	trans	-62.9	-40.5	172.9	-57.4	0	0	0	0	111.1	R454 F455 S462	R454-T458 WeakPolarHBondContact O-CB 3.4Å; R454-T458 PolarHBondContact O-N 2.88Å; R454-T458 PolarHBondContact O-OG1 3.18Å; F455-T458 PolarHBondContact O-N 2.89Å; T458-S462 WeakPolarHBondContact O-CB 3.5Å; T458-S462 PolarHBondContact O-N 3.34Å
459	L	72.7	Confident	64.8	Low	73 Å²	73	114.4 Å²	114.4	38%	0.382	58%	0.578	S	S	.	*	H	α-helix	trans	-63.2	-46.8	171.6	-80.9	172.6	0	0	0	111.6	F455 T456 E457 V461 S462 Q463	F455-L459 HydrophobicContact CD1-CD1 3.94Å; F455-L459 HydrophobicContact CE1-CD1 3.53Å; F455-L459 HydrophobicContact CE1-CG 4.25Å; F455-L459 HydrophobicContact CZ-CD1 4.03Å; F455-L459 HydrophobicContact CZ-CG 4.35Å; F455-L459 PolarHBondContact O-N 2.67Å; T456-L459 PolarHBondContact O-N 2.82Å; E457-L459 VanDerWaalsContact C-N 3.33Å; E457-L459 PolarHBondContact O-N 2.75Å; L459-V461 VanDerWaalsContact C-N 3.33Å; L459-V461 PolarHBondContact O-N 2.84Å; L459-S462 WeakPolarHBondContact CA-OG 3.24Å; L459-S462 PolarHBondContact O-N 2.81Å; L459-S462 VanDerWaalsContact O-N 3.1Å; L459-S462 PolarHBondContact O-OG 2.92Å; L459-Q463 WeakPolarHBondContact O-CG 3.37Å; L459-Q463 PolarHBondContact O-N 2.98Å
460	R	69.9	Low	62.2	Low	120 Å²	120	117.4 Å²	117.4	45%	0.453	59%	0.587	S	S	.	*	H	α-helix	trans	-58.7	-41.1	177.5	-179	175	-71.1	130.1	0.5	112.3	T456 E457 K464	T456-R460 WeakPolarHBondContact O-CB 3.49Å; T456-R460 PolarHBondContact O-N 3.45Å; E457-R460 WeakPolarHBondContact O-CB 3.4Å; E457-R460 PolarHBondContact O-N 3.31Å; E457-R460 IonicContact OE2-CZ 3.96Å; E457-R460 IonicContact OE2-NH1 2.9Å; E457-R460 PolarHBondContact OE2-NH1 2.85Å; R460-K464 WeakPolarHBondContact O-CB 3.29Å; R460-K464 PolarHBondContact O-N 2.83Å
461	V	59.5	Low	59.6	Low	83 Å²	83	121.5 Å²	121.5	50%	0.503	61%	0.608	S	S	.	*	H	α-helix	trans	-67.7	-42.4	172.7	171.3	0	0	0	0	111.3	E457 L459 Q463 K464	E457-V461 WeakPolarHBondContact O-CB 3.34Å; E457-V461 WeakPolarHBondContact O-CG2 3.31Å; E457-V461 PolarHBondContact O-N 2.93Å; L459-V461 VanDerWaalsContact C-N 3.33Å; L459-V461 PolarHBondContact O-N 2.84Å; V461-Q463 VanDerWaalsContact C-N 3.26Å; V461-Q463 PolarHBondContact O-N 2.86Å; V461-K464 CarbonylContact O-C 3.56Å; V461-K464 PolarHBondContact O-N 2.81Å; V461-K464 VanDerWaalsContact O-N 3.15Å
462	S	62.9	Low	57.2	Low	83 Å²	83	123.7 Å²	123.7	58%	0.58	63%	0.625	S	S	*	*	H	α-helix	trans	-64.2	-29.9	177.6	78.3	0	0	0	0	113.5	T458 L459	T458-S462 WeakPolarHBondContact O-CB 3.5Å; T458-S462 PolarHBondContact O-N 3.34Å; L459-S462 WeakPolarHBondContact CA-OG 3.24Å; L459-S462 PolarHBondContact O-N 2.81Å; L459-S462 VanDerWaalsContact O-N 3.1Å; L459-S462 PolarHBondContact O-OG 2.92Å
463	Q	56.2	Low	54.6	Low	157 Å²	157	130.7 Å²	130.7	73%	0.734	65%	0.646	S	S	*	*	H	α-helix	trans	-81.5	-28.8	174.5	-69.9	173.8	-5	0	0	112.2	L459 V461 G465	L459-Q463 WeakPolarHBondContact O-CG 3.37Å; L459-Q463 PolarHBondContact O-N 2.98Å; V461-Q463 VanDerWaalsContact C-N 3.26Å; V461-Q463 PolarHBondContact O-N 2.86Å; Q463-G465 PolarHBondContact O-N 3.2Å
464	K	47.8	Very low	52.1	Low	167 Å²	167	131.9 Å²	131.9	73%	0.726	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97	69.9	177.9	-71.6	-169.7	173	-171.9	0	113.6	R460 V461 H466	R460-K464 WeakPolarHBondContact O-CB 3.29Å; R460-K464 PolarHBondContact O-N 2.83Å; V461-K464 CarbonylContact O-C 3.56Å; V461-K464 PolarHBondContact O-N 2.81Å; V461-K464 VanDerWaalsContact O-N 3.15Å; K464-H466 PolarHBondContact O-N 2.88Å; K464-H466 VanDerWaalsContact O-N 3.15Å
465	G	34.9	Very low	49.8	Very low	67 Å²	67	131.1 Å²	131.1	69%	0.691	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	78.2	0.5	138.6	0	0	0	0	0	120.4	Q463	Q463-G465 PolarHBondContact O-N 3.2Å
466	H	38	Very low	47.3	Very low	146 Å²	146	130.1 Å²	130.1	68%	0.676	67%	0.671	S	S	*	*			trans	-114.4	84.8	173.7	-90.5	3.1	0	0	0	113.1	K464 E468	K464-H466 PolarHBondContact O-N 2.88Å; K464-H466 VanDerWaalsContact O-N 3.15Å; H466-E468 VanDerWaalsContact C-N 3.31Å; H466-E468 PolarHBondContact O-N 3.26Å
467	R	36.8	Very low	45.3	Very low	245 Å²	245	134 Å²	134	93%	0.925	69%	0.688	S	S	*	*			trans	-78.5	-7.1	-176.1	-144.4	173.3	-169.6	165	3	114.6
468	E	41	Very low	43.6	Very low	183 Å²	183	137.4 Å²	137.4	86%	0.855	70%	0.704	S	S	*	*	S	Bend	trans	-107.2	-12.1	-168	-55.6	-147.7	147.7	0	0	115.5	H466 F470	H466-E468 VanDerWaalsContact C-N 3.31Å; H466-E468 PolarHBondContact O-N 3.26Å; E468-F470 PolarHBondContact O-N 3.49Å
469	L	38.5	Very low	41.3	Very low	147 Å²	147	141.3 Å²	141.3	77%	0.77	72%	0.716	S	S	*	*	S	Bend	trans	-77.5	3.9	-179.5	-70.2	176.5	0	0	0	114.5
470	F	34.5	Very low	39.2	Very low	170 Å²	170	143.5 Å²	143.5	75%	0.746	74%	0.736	S	S	*	*	S	Bend	trans	-106.7	52.8	174.7	-86.3	-78.9	0	0	0	112.8	E468	E468-F470 PolarHBondContact O-N 3.49Å
471	M	31.5	Very low	37.2	Very low	171 Å²	171	145.5 Å²	145.5	84%	0.842	75%	0.748	S	S	*	*			trans	-161.1	76.8	160.9	-93.3	-49.8	105.5	0	0	113.8
472	T	31.8	Very low	35.8	Very low	130 Å²	130	149.9 Å²	149.9	80%	0.798	76%	0.761	S	S	*	*			trans	-159.3	119.5	151.2	25.1	0	0	0	0	114.8
473	K	31.3	Very low	34.3	Very low	196 Å²	196	152.2 Å²	152.2	85%	0.852	77%	0.767	S	S	*	*			trans	57.8	106	144.9	-60.4	-179.6	-178.6	176.6	0	120.1
474	T	25.9	Very low	33	Very low	124 Å²	124	152 Å²	152	76%	0.761	77%	0.77	S	S	*	*			trans	-66.6	159.9	149.9	51.3	0	0	0	0	111.3
475	P	33	Very low	32.2	Very low	120 Å²	120	152 Å²	152	78%	0.779	78%	0.778	S	S	*	*				-129.2	140.2	85.8	34.3	-22.7	0	0	0	112.4
476	T	27.9	Very low	31.9	Very low	113 Å²	113	154 Å²	154	69%	0.693	78%	0.781	S	S	*	*				74.2	103.3	59.6	-53.6	0	0	0	0	113.8
477	I	33.9	Very low	31.5	Very low	148 Å²	148	153 Å²	153	76%	0.759	79%	0.788	S	S	*	*			trans	-167.4	124	133.8	-99.9	155.8	0	0	0	109.8
478	Q	31.9	Very low	31.2	Very low	161 Å²	161	147.5 Å²	147.5	75%	0.752	78%	0.781	S	S	*	*			trans	30.8	154.8	147.8	-63.9	162	-17.2	0	0	123.1
479	Q	27.6	Very low	30.8	Very low	164 Å²	164	144.3 Å²	144.3	77%	0.766	78%	0.779	S	S	*	*			cis	172	121.3	-34.9	-114.1	178	-14.1	0	0	108.6
480	C	27.8	Very low	30.5	Very low	119 Å²	119	140.4 Å²	140.4	80%	0.804	77%	0.774	S	S	*	*			trans	178.7	120	154.1	-99.7	0	0	0	0	105.8
481	K	27.7	Very low	30.2	Very low	161 Å²	161	137.3 Å²	137.3	70%	0.7	77%	0.771	S	S	*	*				55.2	125.6	55.4	-60.1	-169.6	172.5	-172.1	0	111
482	F	31.5	Very low	30.3	Very low	176 Å²	176	136.6 Å²	136.6	77%	0.772	77%	0.77	S	S	*	*			cis	-141.2	171.3	24.5	-66.9	-106.3	0	0	0	109.3
483	D	31.7	Very low	30.5	Very low	131 Å²	131	137.8 Å²	137.8	70%	0.701	77%	0.767	S	S	*	*			cis	-157.1	162.1	-23.3	-108.5	7.8	0	0	0	107.9
484	L	29.1	Very low	30.6	Very low	154 Å²	154	131.8 Å²	131.8	81%	0.806	75%	0.749	S	S	*	*			trans	-88	147.4	176.2	-70.8	75.3	0	0	0	111.3
485	N	30.2	Very low	31.1	Very low	166 Å²	166	130.6 Å²	130.6	89%	0.888	74%	0.738	S	S	*	*			trans	172.5	88.8	132.5	-88.5	-30.3	0	0	0	113.7
486	S	27.6	Very low	31.3	Very low	109 Å²	109	131.8 Å²	131.8	76%	0.762	73%	0.733	S	S	*	*			trans	-171.3	124.6	146.9	-171.2	0	0	0	0	110.6
487	P	30.5	Very low	31.8	Very low	126 Å²	126	134 Å²	134	82%	0.818	73%	0.733	S	S	*	*			trans	-101.2	122.6	-179.2	35.1	-29.4	0	0	0	113.3
488	V	30.9	Very low	32	Very low	129 Å²	129	132.6 Å²	132.6	78%	0.782	72%	0.721	S	S	*	*			trans	-134.1	149.5	166	-176.4	0	0	0	0	108.7
489	S	33.2	Very low	32.3	Very low	116 Å²	116	131.4 Å²	131.4	81%	0.811	71%	0.714	S	S	*	*			trans	-122	133.4	-154.4	169	0	0	0	0	115.4
490	G	30.3	Very low	32.9	Very low	65 Å²	65	127 Å²	127	67%	0.67	70%	0.702	S	S	*	*			trans	95.4	161.7	158	0	0	0	0	0	116.2
491	P	29.8	Very low	33.3	Very low	104 Å²	104	125.1 Å²	125.1	68%	0.675	69%	0.689	S	S	*	*			cis	-124.7	73	7.9	39.7	-24	0	0	0	114.3	Q493 S494	P491-Q493 VanDerWaalsContact C-N 3.31Å; P491-Q493 PolarHBondContact O-N 3.09Å; P491-S494 PolarHBondContact O-OG 3.4Å; P491-S494 VanDerWaalsContact O-OG 3.09Å
492	L	33.4	Very low	33.8	Very low	156 Å²	156	125 Å²	125	82%	0.817	69%	0.689	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	0.4	174.7	-89.5	168.1	0	0	0	115.4
493	Q	34.8	Very low	33.9	Very low	156 Å²	156	122.1 Å²	122.1	73%	0.729	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.7	-10.9	178.5	-70	-175.7	-7	0	0	114.5	P491 K497	P491-Q493 VanDerWaalsContact C-N 3.31Å; P491-Q493 PolarHBondContact O-N 3.09Å; Q493-K497 PolarHBondContact O-N 3.04Å
494	S	35	Very low	33.8	Very low	69 Å²	69	121 Å²	121	48%	0.483	69%	0.688	S	S	.	*	H	α-helix	trans	-72.8	-50	179.1	50	0	0	0	0	111.6	P491 Q496 K497 F498	P491-S494 PolarHBondContact O-OG 3.4Å; P491-S494 VanDerWaalsContact O-OG 3.09Å; S494-Q496 VanDerWaalsContact C-N 3.3Å; S494-Q496 PolarHBondContact O-N 3.14Å; S494-K497 PolarHBondContact O-N 3.03Å; S494-F498 PolarHBondContact O-N 3.1Å
495	L	36.1	Very low	33.8	Very low	100 Å²	100	117.4 Å²	117.4	52%	0.524	69%	0.689	S	S	.	*	H	α-helix	trans	-58.9	-37.7	177.8	-91.6	156.6	0	0	0	112.9	K497 F498 F499	L495-K497 VanDerWaalsContact C-N 3.31Å; L495-K497 PolarHBondContact O-N 2.91Å; L495-F498 PolarHBondContact O-N 3.22Å; L495-F499 HydrophobicContact CD2-CD2 4.48Å; L495-F499 HydrophobicContact CD2-CE2 3.78Å; L495-F499 HydrophobicContact CD2-CZ 4.41Å; L495-F499 VanDerWaalsContact O-CD2 3.3Å; L495-F499 WeakPolarHBondContact O-CD2 3.43Å; L495-F499 PolarHBondContact O-N 2.84Å; L495-F499 VanDerWaalsContact O-N 3.11Å
496	Q	37.3	Very low	33.8	Very low	144 Å²	144	118.5 Å²	118.5	67%	0.673	69%	0.689	S	S	*	*	H	α-helix	trans	-66.7	-32.8	176.7	-164	173.5	6.4	0	0	112.1	S494 S500	S494-Q496 VanDerWaalsContact C-N 3.3Å; S494-Q496 PolarHBondContact O-N 3.14Å; Q496-S500 PolarHBondContact O-N 2.82Å; Q496-S500 PolarHBondContact O-OG 2.81Å
497	K	38	Very low	33.8	Very low	160 Å²	160	125.5 Å²	125.5	70%	0.696	70%	0.699	S	S	*	*	H	α-helix	trans	-74.3	-39.6	170.4	-75.1	-174.9	175.7	-178.4	0	112.5	Q493 S494 L495 F499 S500 S501	Q493-K497 PolarHBondContact O-N 3.04Å; S494-K497 PolarHBondContact O-N 3.03Å; L495-K497 VanDerWaalsContact C-N 3.31Å; L495-K497 PolarHBondContact O-N 2.91Å; K497-F499 PolarHBondContact O-N 2.9Å; K497-S500 WeakPolarHBondContact O-CA 3.4Å; K497-S500 WeakPolarHBondContact O-CB 3.26Å; K497-S500 PolarHBondContact O-N 2.87Å; K497-S501 PolarHBondContact O-N 2.9Å; K497-S501 VanDerWaalsContact O-N 3.12Å; K497-S501 PolarHBondContact O-OG 2.88Å
498	F	37.8	Very low	33.6	Very low	118 Å²	118	124.3 Å²	124.3	52%	0.518	69%	0.693	S	S	.	*	H	α-helix	trans	-57.6	-44.6	179.5	-176.4	-97.7	0	0	0	112.5	S494 L495 S500 S501 F502	S494-F498 PolarHBondContact O-N 3.1Å; L495-F498 PolarHBondContact O-N 3.22Å; F498-S500 VanDerWaalsContact C-N 3.34Å; F498-S501 PolarHBondContact O-N 3.06Å; F498-S501 PolarHBondContact O-OG 3.03Å; F498-F502 HydrophobicContact CE1-CE2 4.14Å; F498-F502 HydrophobicContact CZ-CE2 4.12Å; F498-F502 WeakPolarHBondContact O-CD2 3.37Å
499	F	38	Very low	33.6	Very low	137 Å²	137	126 Å²	126	60%	0.601	69%	0.693	S	S	*	*	H	α-helix	trans	-74	-22.4	173.6	-68.6	-60.8	0	0	0	113.8	L495 K497	L495-F499 HydrophobicContact CD2-CD2 4.48Å; L495-F499 HydrophobicContact CD2-CE2 3.78Å; L495-F499 HydrophobicContact CD2-CZ 4.41Å; L495-F499 VanDerWaalsContact O-CD2 3.3Å; L495-F499 WeakPolarHBondContact O-CD2 3.43Å; L495-F499 PolarHBondContact O-N 2.84Å; L495-F499 VanDerWaalsContact O-N 3.11Å; K497-F499 PolarHBondContact O-N 2.9Å
500	S	41	Very low	33.5	Very low	72 Å²	72	127.2 Å²	127.2	50%	0.503	69%	0.69	S	S	.	*	H	α-helix	trans	-70.7	-30.6	174.9	-59.7	0	0	0	0	112.4	Q496 K497 F498 F502 T503	Q496-S500 PolarHBondContact O-N 2.82Å; Q496-S500 PolarHBondContact O-OG 2.81Å; K497-S500 WeakPolarHBondContact O-CA 3.4Å; K497-S500 WeakPolarHBondContact O-CB 3.26Å; K497-S500 PolarHBondContact O-N 2.87Å; F498-S500 VanDerWaalsContact C-N 3.34Å; S500-F502 VanDerWaalsContact C-N 3.31Å; S500-F502 PolarHBondContact O-N 3.04Å; S500-T503 PolarHBondContact O-N 2.8Å; S500-T503 PolarHBondContact O-OG1 2.83Å
501	S	36.3	Very low	33.6	Very low	78 Å²	78	129.5 Å²	129.5	55%	0.545	70%	0.696	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.3	-15.6	179.6	28.8	0	0	0	0	115.5	K497 F498 T503	K497-S501 PolarHBondContact O-N 2.9Å; K497-S501 VanDerWaalsContact O-N 3.12Å; K497-S501 PolarHBondContact O-OG 2.88Å; F498-S501 PolarHBondContact O-N 3.06Å; F498-S501 PolarHBondContact O-OG 3.03Å; S501-T503 VanDerWaalsContact C-N 3.31Å
502	F	37.6	Very low	33.3	Very low	159 Å²	159	132.1 Å²	132.1	70%	0.697	70%	0.704	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.7	6.6	176.4	-75.5	-78.9	0	0	0	113.8	F498 S500	F498-F502 HydrophobicContact CE1-CE2 4.14Å; F498-F502 HydrophobicContact CZ-CE2 4.12Å; F498-F502 WeakPolarHBondContact O-CD2 3.37Å; S500-F502 VanDerWaalsContact C-N 3.31Å; S500-F502 PolarHBondContact O-N 3.04Å
503	T	32.9	Very low	33.2	Very low	116 Å²	116	134 Å²	134	71%	0.712	71%	0.709	S	S	*	*	S	Bend	trans	-127.8	39.8	-171	56.9	0	0	0	0	114.4	S500 S501	S500-T503 PolarHBondContact O-N 2.8Å; S500-T503 PolarHBondContact O-OG1 2.83Å; S501-T503 VanDerWaalsContact C-N 3.31Å
504	S	30.2	Very low	32.8	Very low	106 Å²	106	134 Å²	134	74%	0.741	71%	0.713	S	S	*	*			trans	-138.8	89.8	175.9	59.2	0	0	0	0	112.7
505	G	29.3	Very low	32.6	Very low	80 Å²	80	138.6 Å²	138.6	83%	0.825	73%	0.73	S	S	*	*			trans	-150.8	49.3	-174	0	0	0	0	0	114.2
506	Q	29.4	Very low	32.3	Very low	189 Å²	189	141.5 Å²	141.5	88%	0.883	74%	0.741	S	S	*	*			trans	5.1	120.8	173.2	-60.6	-174.7	-0.4	0	0	120.1
507	R	28.3	Very low	31.7	Very low	256 Å²	256	141.4 Å²	141.4	97%	0.966	75%	0.745	S	S	*	*				-155	158.6	108.8	-113.4	177.1	-180	-172.8	-1	111
508	S	26.9	Very low	31.5	Very low	100 Å²	100	140.8 Å²	140.8	70%	0.699	75%	0.754	S	S	*	*			trans	-135.8	148.3	-171.9	53.6	0	0	0	0	110.6
509	E	31.1	Very low	31	Very low	166 Å²	166	138 Å²	138	78%	0.776	76%	0.759	S	S	*	*				-174.7	143	124.1	-99.9	166.2	-143.4	0	0	111.1
510	N	30.4	Very low	30.6	Very low	141 Å²	141	139.3 Å²	139.3	75%	0.754	77%	0.772	S	S	*	*			trans	32.9	140.3	139.5	-50	-24.7	0	0	0	120.5
511	S	31.5	Very low	29.9	Very low	113 Å²	113	143.3 Å²	143.3	79%	0.79	79%	0.788	S	S	*	*			cis	-161.9	167.5	6.4	33.2	0	0	0	0	111.8
512	N	25	Very low	29.6	Very low	158 Å²	158	147 Å²	147	85%	0.845	80%	0.801	S	S	*	*			trans	-84.4	153.3	-178.4	-25.5	-96.9	0	0	0	113.4
513	E	29.4	Very low	29.1	Very low	197 Å²	197	145.4 Å²	145.4	92%	0.921	81%	0.809	S	S	*	*			trans	-154.8	173.6	131	-124.2	169.9	-150.9	0	0	113.3
514	L	27.4	Very low	29	Very low	156 Å²	156	146.8 Å²	146.8	82%	0.817	81%	0.811	S	S	*	*			trans	-136.8	140.4	-166.5	-81	153.9	0	0	0	111.3
515	I	30.4	Very low	28.8	Very low	164 Å²	164	151.3 Å²	151.3	84%	0.841	82%	0.82	S	S	*	*			trans	178.5	114.9	152.6	-92.6	144.6	0	0	0	105.4
516	Q	29.7	Very low	28.9	Very low	161 Å²	161	151 Å²	151	75%	0.752	82%	0.817	S	S	*	*				70.1	105.9	62	-74.9	-157.1	-6.2	0	0	117.5
517	N	26.1	Very low	28.7	Very low	142 Å²	142	148.5 Å²	148.5	76%	0.759	81%	0.814	S	S	*	*			trans	61.3	109.7	139.1	-57.9	-16.6	0	0	0	120.9
518	V	31.9	Very low	28.8	Very low	148 Å²	148	143.1 Å²	143.1	90%	0.897	81%	0.805	S	S	*	*				176.2	138.1	127	150.1	0	0	0	0	106
519	G	27.5	Very low	29.1	Very low	59 Å²	59	144.6 Å²	144.6	61%	0.608	81%	0.805	S	S	*	*			cis	126.1	77.8	3.9	0	0	0	0	0	112.1
520	N	29.5	Very low	29.1	Very low	164 Å²	164	141 Å²	141	88%	0.877	80%	0.798	S	S	*	*			trans	-170.5	150.4	162.2	-103	-21.3	0	0	0	112.2
521	D	28	Very low	29.6	Very low	156 Å²	156	136.7 Å²	136.7	83%	0.834	78%	0.775	S	S	*	*			trans	-83.6	132.7	-175.9	-59.5	-77.5	0	0	0	114.1
522	L	30.1	Very low	29.9	Very low	157 Å²	157	133.7 Å²	133.7	82%	0.822	75%	0.754	S	S	*	*			trans	-146.4	104.4	156.7	-105	115.7	0	0	0	110	I524	L522-I524 PolarHBondContact O-N 2.91Å
523	S	26	Very low	30.8	Very low	125 Å²	125	127.4 Å²	127.4	87%	0.874	72%	0.718	S	S	*	*			trans	-78.3	110.5	178.4	57.3	0	0	0	0	111.3
524	I	31.3	Very low	31.2	Very low	145 Å²	145	121.9 Å²	121.9	74%	0.744	69%	0.694	S	S	*	*			trans	-120.8	124.6	175.5	-60.7	177.7	0	0	0	108.9	L522	L522-I524 PolarHBondContact O-N 2.91Å
525	H	26.5	Very low	31.9	Very low	200 Å²	200	118.4 Å²	118.4	93%	0.926	68%	0.679	S	S	*	*			trans	-75.5	129.1	170.3	-81.6	-83.6	0	0	0	110.4
526	G	30.1	Very low	32.3	Very low	74 Å²	74	114 Å²	114	76%	0.763	66%	0.657	S	S	*	*			trans	-148.6	155.1	175.1	0	0	0	0	0	111.1
527	T	24.9	Very low	32.6	Very low	136 Å²	136	107.8 Å²	107.8	83%	0.834	63%	0.631	S	S	*	*			trans	-104.4	140.6	-175.2	53.5	0	0	0	0	112
528	D	31	Very low	33.4	Very low	144 Å²	144	104.8 Å²	104.8	77%	0.77	63%	0.627	S	S	*	*			trans	-143.3	132.8	160.8	-94	-50	0	0	0	112.1
529	N	33.2	Very low	33.5	Very low	130 Å²	130	102.5 Å²	102.5	70%	0.695	61%	0.613	S	S	*	*			trans	-113.7	112.9	170	-90.1	-1.1	0	0	0	107.8
530	S	31.8	Very low	34.1	Very low	91 Å²	91	105.8 Å²	105.8	64%	0.636	63%	0.625	S	S	*	*			trans	-74.9	129.9	174.4	58.8	0	0	0	0	111.7	G551	S530-G551 WeakPolarHBondContact O-CA 3.31Å; S530-G551 PolarHBondContact O-N 2.95Å
531	L	41.3	Very low	34.3	Very low	51 Å²	51	99.8 Å²	99.8	27%	0.267	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-114.6	140.7	170.7	-66.3	162.3	0	0	0	108.4	W548 T550 I1169	L531-W548 HydrophobicContact CB-CH2 3.91Å; L531-W548 HydrophobicContact CB-CZ2 3.5Å; L531-W548 VanDerWaalsContact CB-CZ2 3.5Å; L531-W548 HydrophobicContact CD1-CZ2 4.08Å; L531-W548 HydrophobicContact CG-CZ2 4.26Å; L531-T550 HydrophobicContact CD2-CG2 3.88Å; L531-I1169 VanDerWaalsContact O-CD1 3.25Å; L531-I1169 WeakPolarHBondContact O-CD1 3.44Å
532	S	36.6	Very low	34.9	Very low	49 Å²	49	100.7 Å²	100.7	34%	0.343	60%	0.6	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-158.4	150.8	-179.1	57.2	0	0	0	0	112.8	A549	S532-A549 PolarHBondContact N-O 2.88Å; S532-A549 PolarHBondContact O-N 3.27Å
533	W	44.1	Very low	35.4	Very low	26 Å²	26	94.7 Å²	94.7	10%	0.098	57%	0.57	C	S	.	*	E	Extended strand (participates in β ladder)	trans	-72.1	141.6	164.1	-70	88.5	0	0	0	110.8	G547 W548 C1102 Q1144 I1171	W533-G547 CarbonylContact C-O 3.41Å; W533-G547 WeakPolarHBondContact CA-O 3.47Å; W533-G547 VanDerWaalsContact CE3-CA 3.49Å; W533-W548 AromaticContact CD1-CE3 3.36Å; W533-W548 AromaticContact CD1-CZ3 3.44Å; W533-W548 VanDerWaalsContact CD1-CZ3 3.44Å; W533-W548 HydrophobicContact CD2-CE3 4.11Å; W533-W548 AromaticContact CE2-CE3 3.87Å; W533-W548 AromaticContact CG-CE3 3.83Å; W533-W548 HydrophobicContact CG-CE3 3.83Å; W533-W548 HydrophobicContact CG-CZ3 4.27Å; W533-W548 AromaticContact NE1-CE3 3.39Å; W533-W548 AromaticContact NE1-CZ3 3.61Å; W533-C1102 HydrophobicContact CH2-CB 4.1Å; W533-C1102 HydrophobicContact CZ3-CB 3.83Å; W533-Q1144 VanDerWaalsContact CD1-OE1 3.27Å; W533-Q1144 HydrophobicContact CG-CB 4.23Å; W533-I1171 HydrophobicContact CZ2-CD1 3.86Å; W533-I1171 HydrophobicContact CZ2-CG1 4.03Å
534	I	38.2	Very low	36.1	Very low	82 Å²	82	91.1 Å²	91.1	42%	0.421	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	146.9	170.6	47.2	170.5	0	0	0	110	L536 Y546 G547 A549	I534-L536 HydrophobicContact CD1-CD2 3.8Å; I534-L536 HydrophobicContact CG1-CD2 3.87Å; I534-L536 PolarHBondContact O-N 3.34Å; I534-Y546 CarbonylContact O-C 3.46Å; I534-Y546 WeakPolarHBondContact O-CA 3.42Å; I534-G547 PolarHBondContact N-O 3.24Å; I534-G547 PolarHBondContact O-N 3.47Å; I534-A549 HydrophobicContact CD1-CB 3.61Å; I534-A549 HydrophobicContact CG1-CB 3.79Å
535	T	41.3	Very low	36.4	Very low	82 Å²	82	84.8 Å²	84.8	50%	0.503	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	123.6	172.7	-40.5	0	0	0	0	109.4	P544 I545 Y546	T535-P544 HydrophobicContact CG2-CB 4.12Å; T535-I545 CarbonylContact C-O 3.56Å; T535-Y546 HydrophobicContact CG2-CD1 4.38Å; T535-Y546 HydrophobicContact CG2-CE1 4.21Å; T535-Y546 VanDerWaalsContact OG1-CE1 3.22Å; T535-Y546 WeakPolarHBondContact OG1-CE1 3.31Å
536	L	38.4	Very low	37	Very low	73 Å²	73	79.2 Å²	79.2	38%	0.382	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	-26	-177.7	-63.2	-175.1	0	0	0	113.3	I534 I545 V583 V585	I534-L536 HydrophobicContact CD1-CD2 3.8Å; I534-L536 HydrophobicContact CG1-CD2 3.87Å; I534-L536 PolarHBondContact O-N 3.34Å; L536-I545 PolarHBondContact N-O 3.49Å; L536-V583 HydrophobicContact CD1-CB 3.83Å; L536-V583 HydrophobicContact CD1-CG1 4.23Å; L536-V583 HydrophobicContact CD1-CG2 4.24Å; L536-V585 HydrophobicContact CB-CG2 3.88Å; L536-V585 HydrophobicContact CD1-CG2 3.44Å; L536-V585 VanDerWaalsContact CD1-CG2 3.44Å; L536-V585 HydrophobicContact CG-CG2 4.32Å
537	S	36.7	Very low	37.2	Very low	29 Å²	29	75.7 Å²	75.7	20%	0.203	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.4	139.8	167.6	-174.6	0	0	0	0	111.2	T539 I545	S537-T539 PolarHBondContact OG-N 2.94Å; S537-T539 PolarHBondContact OG-O 2.9Å; S537-T539 PolarHBondContact OG-OG1 2.91Å; S537-I545 PolarHBondContact N-O 3.49Å; S537-I545 PolarHBondContact O-N 2.93Å
538	A	44.1	Very low	37.9	Very low	80 Å²	80	70.7 Å²	70.7	66%	0.661	41%	0.413	S	S	*	.	S	Bend	trans	-106.5	2.8	165.2	0	0	0	0	0	112.3
539	T	32.7	Very low	38.2	Very low	100 Å²	100	64.9 Å²	64.9	61%	0.613	39%	0.385	S	S	*	.	S	Bend	trans	-116.3	145.6	-176.4	49.2	0	0	0	0	111.2	S537	S537-T539 PolarHBondContact OG-N 2.94Å; S537-T539 PolarHBondContact OG-O 2.9Å; S537-T539 PolarHBondContact OG-OG1 2.91Å
540	C	39.6	Very low	38.4	Very low	128 Å²	128	62.4 Å²	62.4	87%	0.865	37%	0.374	S	S	*	.	S	Bend	trans	82.9	-1	179.6	-52.5	0	0	0	0	118.1
541	T	34	Very low	38.4	Very low	38 Å²	38	59.7 Å²	59.7	23%	0.233	36%	0.361	C	S	.	.	S	Bend	trans	-140.4	147.3	170	43.8	0	0	0	0	111.2	S543	T541-S543 PolarHBondContact O-N 3.38Å; T541-S543 PolarHBondContact OG1-O 3.42Å
542	N	40.4	Very low	37.9	Very low	175 Å²	175	63.5 Å²	63.5	94%	0.936	38%	0.376	S	S	*	.	S	Bend	trans	-70.8	15.2	176.7	-67.2	28.3	0	0	0	113.8
543	S	41.4	Very low	37.5	Very low	30 Å²	30	68.3 Å²	68.3	21%	0.21	39%	0.393	C	S	.	.	S	Bend	trans	-148.1	137.5	174	46.3	0	0	0	0	108.2	T541	T541-S543 PolarHBondContact O-N 3.38Å; T541-S543 PolarHBondContact OG1-O 3.42Å
544	P	41.1	Very low	36.7	Very low	51 Å²	51	72.3 Å²	72.3	33%	0.331	43%	0.425	S	S	.	.			trans	-68.8	135.9	179	26.6	-32.7	0	0	0	110.8	T535 Y546	T535-P544 HydrophobicContact CG2-CB 4.12Å; P544-Y546 HydrophobicContact CB-CE2 4.24Å; P544-Y546 HydrophobicContact CG-CE2 3.86Å; P544-Y546 WeakPolarHBondContact O-CD2 3.49Å; P544-Y546 WeakPolarHBondContact O-CE2 3.2Å
545	I	37.7	Very low	36.4	Very low	11 Å²	11	73.3 Å²	73.3	6%	0.056	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	126.7	179.9	-53.5	-179.2	0	0	0	108.9	T535 L536 S537 V585	T535-I545 CarbonylContact C-O 3.56Å; L536-I545 PolarHBondContact N-O 3.49Å; S537-I545 PolarHBondContact N-O 3.49Å; S537-I545 PolarHBondContact O-N 2.93Å; I545-V585 HydrophobicContact CD1-CG1 3.91Å; I545-V585 HydrophobicContact CG2-CG1 4.05Å; I545-V585 HydrophobicContact CG2-CG2 4.12Å
546	Y	38.2	Very low	35.6	Very low	84 Å²	84	81 Å²	81	33%	0.329	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	155	173.3	-58.9	-89.8	0	0	0	111.1	I534 T535 P544 C1102	I534-Y546 CarbonylContact O-C 3.46Å; I534-Y546 WeakPolarHBondContact O-CA 3.42Å; T535-Y546 HydrophobicContact CG2-CD1 4.38Å; T535-Y546 HydrophobicContact CG2-CE1 4.21Å; T535-Y546 VanDerWaalsContact OG1-CE1 3.22Å; T535-Y546 WeakPolarHBondContact OG1-CE1 3.31Å; P544-Y546 HydrophobicContact CB-CE2 4.24Å; P544-Y546 HydrophobicContact CG-CE2 3.86Å; P544-Y546 WeakPolarHBondContact O-CD2 3.49Å; P544-Y546 WeakPolarHBondContact O-CE2 3.2Å; Y546-C1102 PolarHBondContact O-SG 2.92Å
547	G	34	Very low	35.4	Very low	0 Å²	0	86 Å²	86	0%	0	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.7	149.1	173.2	0	0	0	0	0	114	W533 I534	W533-G547 CarbonylContact C-O 3.41Å; W533-G547 WeakPolarHBondContact CA-O 3.47Å; W533-G547 VanDerWaalsContact CE3-CA 3.49Å; I534-G547 PolarHBondContact N-O 3.24Å; I534-G547 PolarHBondContact O-N 3.47Å
548	W	39.5	Very low	34.9	Very low	30 Å²	30	90 Å²	90	11%	0.114	50%	0.497	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	112.2	-179.4	-172.7	-115.4	0	0	0	113	L531 W533 V583 I1169	L531-W548 HydrophobicContact CB-CH2 3.91Å; L531-W548 HydrophobicContact CB-CZ2 3.5Å; L531-W548 VanDerWaalsContact CB-CZ2 3.5Å; L531-W548 HydrophobicContact CD1-CZ2 4.08Å; L531-W548 HydrophobicContact CG-CZ2 4.26Å; W533-W548 AromaticContact CD1-CE3 3.36Å; W533-W548 AromaticContact CD1-CZ3 3.44Å; W533-W548 VanDerWaalsContact CD1-CZ3 3.44Å; W533-W548 HydrophobicContact CD2-CE3 4.11Å; W533-W548 AromaticContact CE2-CE3 3.87Å; W533-W548 AromaticContact CG-CE3 3.83Å; W533-W548 HydrophobicContact CG-CE3 3.83Å; W533-W548 HydrophobicContact CG-CZ3 4.27Å; W533-W548 AromaticContact NE1-CE3 3.39Å; W533-W548 AromaticContact NE1-CZ3 3.61Å; W548-V583 WeakPolarHBondContact O-CG2 3.45Å; W548-I1169 HydrophobicContact CH2-CB 3.97Å; W548-I1169 HydrophobicContact CH2-CD1 3.87Å; W548-I1169 HydrophobicContact CH2-CG2 3.9Å; W548-I1169 HydrophobicContact CZ3-CB 4.37Å; W548-I1169 HydrophobicContact CZ3-CD1 4.2Å; W548-I1169 HydrophobicContact CZ3-CG2 3.79Å
549	A	37.8	Very low	34.3	Very low	23 Å²	23	92.1 Å²	92.1	19%	0.19	51%	0.507	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	143	-177	0	0	0	0	0	113.6	S532 I534	S532-A549 PolarHBondContact N-O 2.88Å; S532-A549 PolarHBondContact O-N 3.27Å; I534-A549 HydrophobicContact CD1-CB 3.61Å; I534-A549 HydrophobicContact CG1-CB 3.79Å
550	T	37.4	Very low	34.1	Very low	77 Å²	77	92.2 Å²	92.2	47%	0.472	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81	122.4	166.2	51.1	0	0	0	0	110.2	L531	L531-T550 HydrophobicContact CD2-CG2 3.88Å
551	G	31.8	Very low	33.6	Very low	34 Å²	34	92.8 Å²	92.8	35%	0.351	51%	0.505	S	S	.	.	P	Polyproline II helix	trans	-59.1	149.7	172.6	0	0	0	0	0	112.6	S530 Q553	S530-G551 WeakPolarHBondContact O-CA 3.31Å; S530-G551 PolarHBondContact O-N 2.95Å; G551-Q553 PolarHBondContact O-N 3.4Å
552	K	31	Very low	33.5	Very low	132 Å²	132	96.9 Å²	96.9	57%	0.574	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-66.4	128.7	178.2	-94.6	-177	164.7	177	0	111.4	N578 Y580	K552-N578 PolarHBondContact NZ-OD1 2.86Å; K552-Y580 WeakPolarHBondContact CE-OH 3.38Å; K552-Y580 PolarHBondContact NZ-OH 3.06Å
553	Q	28.3	Very low	33.1	Very low	150 Å²	150	94.3 Å²	94.3	70%	0.701	51%	0.512	S	S	*	.	P	Polyproline II helix	trans	-61.9	139.1	156.8	-76.8	-173.9	-54.1	0	0	109.6	G551	G551-Q553 PolarHBondContact O-N 3.4Å
554	S	27.5	Very low	32.8	Very low	110 Å²	110	100.5 Å²	100.5	77%	0.769	54%	0.543	S	S	*	.			trans	-120	63.3	174.5	49.1	0	0	0	0	110.4	R556	S554-R556 VanDerWaalsContact C-N 3.29Å; S554-R556 PolarHBondContact O-N 2.66Å
555	D	32.4	Very low	32.3	Very low	103 Å²	103	102 Å²	102	55%	0.551	57%	0.568	S	S	*	*			trans	-69.6	75.8	-173	-121.1	52.4	0	0	0	112.2	K557	D555-K557 PolarHBondContact O-N 3.05Å; D555-K557 VanDerWaalsContact O-N 3.07Å; D555-K557 IonicContact OD2-NZ 2.61Å; D555-K557 PolarHBondContact OD2-NZ 3.32Å
556	R	24.7	Very low	31.8	Very low	242 Å²	242	105.5 Å²	105.5	91%	0.913	61%	0.606	S	S	*	*			trans	-71.6	93.9	170	-75.9	-174.6	173.9	-178.2	-0.2	110.4	S554	S554-R556 VanDerWaalsContact C-N 3.29Å; S554-R556 PolarHBondContact O-N 2.66Å
557	K	33.3	Very low	31.5	Very low	178 Å²	178	106.5 Å²	106.5	77%	0.774	63%	0.632	S	S	*	*			trans	-97.3	109.2	169.7	-80.2	175.8	175.6	127.7	0	111.9	D555	D555-K557 PolarHBondContact O-N 3.05Å; D555-K557 VanDerWaalsContact O-N 3.07Å; D555-K557 IonicContact OD2-NZ 2.61Å; D555-K557 PolarHBondContact OD2-NZ 3.32Å
558	S	27	Very low	31.1	Very low	114 Å²	114	115 Å²	115	80%	0.797	67%	0.674	S	S	*	*			trans	-88	123.3	167.6	53.6	0	0	0	0	111.2
559	S	30.4	Very low	30.8	Very low	125 Å²	125	122.4 Å²	122.4	87%	0.874	71%	0.709	S	S	*	*			trans	-159.1	148.4	148.8	-101.4	0	0	0	0	114
560	C	27.8	Very low	30.5	Very low	102 Å²	102	126 Å²	126	69%	0.689	73%	0.733	S	S	*	*			trans	-69.9	138.7	-165.4	51.9	0	0	0	0	117.3
561	N	29.1	Very low	30	Very low	140 Å²	140	129.3 Å²	129.3	75%	0.749	75%	0.748	S	S	*	*				67.7	132.8	123.9	-69.4	9.7	0	0	0	123.9
562	N	32.2	Very low	29.9	Very low	123 Å²	123	134.4 Å²	134.4	66%	0.658	77%	0.767	S	S	*	*			trans	96.2	96.6	134.6	-69.1	2.8	0	0	0	122
563	N	33.5	Very low	29.9	Very low	122 Å²	122	135.5 Å²	135.5	65%	0.652	78%	0.779	S	S	*	*				98.1	119.5	113.7	-66.1	-4.8	0	0	0	122.1
564	N	33.8	Very low	29.8	Very low	160 Å²	160	133.6 Å²	133.6	86%	0.856	78%	0.783	S	S	*	*			trans	77.1	128.4	139.1	-59	-8.1	0	0	0	120.7
565	G	30.5	Very low	29.9	Very low	83 Å²	83	133.9 Å²	133.9	86%	0.856	78%	0.78	S	S	*	*			trans	138.2	61.3	160.6	0	0	0	0	0	115.3
566	G	28.5	Very low	29.7	Very low	84 Å²	84	136 Å²	136	87%	0.866	79%	0.791	S	S	*	*			trans	-80.8	157.5	-171.1	0	0	0	0	0	116.4
567	A	30.6	Very low	29.9	Very low	104 Å²	104	131.7 Å²	131.7	86%	0.86	79%	0.786	S	S	*	*			trans	-149.1	149.2	157.3	0	0	0	0	0	110.2
568	M	27.1	Very low	29.7	Very low	180 Å²	180	127 Å²	127	89%	0.887	77%	0.769	S	S	*	*			trans	-71.3	138.9	-174.1	-66.7	-82.4	173.2	0	0	113.6
569	Q	31.4	Very low	29.9	Very low	184 Å²	184	127.2 Å²	127.2	86%	0.86	77%	0.766	S	S	*	*				178.6	145.3	118.9	-95.5	161.8	16.8	0	0	114.4
570	S	31.6	Very low	29.8	Very low	99 Å²	99	129.4 Å²	129.4	69%	0.692	76%	0.756	S	S	*	*			trans	40.4	101.5	158.5	58.2	0	0	0	0	121.5
571	N	27.4	Very low	30.2	Very low	147 Å²	147	128.2 Å²	128.2	79%	0.786	75%	0.749	S	S	*	*				23.1	127.6	103.7	-62.2	39.4	0	0	0	116.5
572	N	30.2	Very low	31.1	Very low	140 Å²	140	123.9 Å²	123.9	75%	0.749	73%	0.726	S	S	*	*			cis	-147.1	144.6	24.5	-78	-33.7	0	0	0	113.1
573	D	30.2	Very low	31.9	Very low	155 Å²	155	118.8 Å²	118.8	83%	0.829	70%	0.699	S	S	*	*			trans	20.3	119.9	147.6	-54.2	-14.7	0	0	0	121.5
574	S	26	Very low	32.8	Very low	110 Å²	110	113.9 Å²	113.9	77%	0.769	67%	0.674	S	S	*	*			trans	-75.9	143.3	168.9	53.2	0	0	0	0	114
575	V	31.1	Very low	33.8	Very low	117 Å²	117	108.5 Å²	108.5	71%	0.709	65%	0.647	S	S	*	*			trans	-128.9	108.7	164.7	-178.7	0	0	0	0	109.9	D577	V575-D577 PolarHBondContact O-N 3.37Å
576	D	26.4	Very low	35.5	Very low	148 Å²	148	104.7 Å²	104.7	79%	0.791	61%	0.607	S	S	*	*			trans	-80.2	83.2	173.1	-83.1	-50	0	0	0	111	N578	D576-N578 VanDerWaalsContact C-N 3.3Å; D576-N578 PolarHBondContact O-N 2.89Å; D576-N578 PolarHBondContact O-ND2 3.01Å; D576-N578 VanDerWaalsContact O-ND2 3.11Å
577	D	29.6	Very low	37.4	Very low	150 Å²	150	104.9 Å²	104.9	80%	0.802	59%	0.587	S	S	*	*			trans	-78.5	79.6	176.9	-100.4	-36.4	0	0	0	113.1	V575	V575-D577 PolarHBondContact O-N 3.37Å
578	N	30.1	Very low	39.2	Very low	80 Å²	80	101.3 Å²	101.3	43%	0.428	55%	0.553	S	S	.	*			trans	-0.2	121.6	165.8	-67	-99.4	0	0	0	120	K552 D576 Y580	K552-N578 PolarHBondContact NZ-OD1 2.86Å; D576-N578 VanDerWaalsContact C-N 3.3Å; D576-N578 PolarHBondContact O-N 2.89Å; D576-N578 PolarHBondContact O-ND2 3.01Å; D576-N578 VanDerWaalsContact O-ND2 3.11Å; N578-Y580 HydrophobicContact CB-CD2 3.55Å; N578-Y580 HydrophobicContact CB-CE2 3.41Å; N578-Y580 VanDerWaalsContact CB-CE2 3.41Å; N578-Y580 PolarHBondContact O-N 2.89Å
579	V	30	Very low	41.2	Very low	119 Å²	119	94.3 Å²	94.3	72%	0.721	52%	0.521	S	S	*	.			trans	-55.5	93.2	166.9	-174.8	0	0	0	0	113.3
580	Y	28.5	Very low	42.9	Very low	170 Å²	170	90.2 Å²	90.2	67%	0.667	50%	0.498	S	S	*	.			trans	-141.3	67.5	176.9	-64.8	-56.7	0	0	0	114	K552 N578	K552-Y580 WeakPolarHBondContact CE-OH 3.38Å; K552-Y580 PolarHBondContact NZ-OH 3.06Å; N578-Y580 HydrophobicContact CB-CD2 3.55Å; N578-Y580 HydrophobicContact CB-CE2 3.41Å; N578-Y580 VanDerWaalsContact CB-CE2 3.41Å; N578-Y580 PolarHBondContact O-N 2.89Å
581	S	35.7	Very low	44.8	Very low	77 Å²	77	88.2 Å²	88.2	54%	0.538	48%	0.481	S	S	.	.			trans	-152.8	15.9	178	62.7	0	0	0	0	116.4	V583	S581-V583 VanDerWaalsContact C-N 3.27Å; S581-V583 PolarHBondContact O-N 2.75Å
582	N	49.2	Very low	46.9	Very low	49 Å²	49	81.2 Å²	81.2	26%	0.262	44%	0.444	S	S	.	.			trans	-73.8	2.2	-159.8	-78.7	-24.5	0	0	0	117.7	R1075 R1077	N582-R1075 PolarHBondContact O-NH2 3.5Å; N582-R1077 PolarHBondContact OD1-NH1 3.06Å
583	V	48.8	Very low	48.1	Very low	17 Å²	17	75.5 Å²	75.5	10%	0.103	42%	0.418	C	S	.	.	S	Bend	trans	-115.3	129.9	179.4	-172.8	0	0	0	0	110.9	L536 W548 S581 V585 T1099	L536-V583 HydrophobicContact CD1-CB 3.83Å; L536-V583 HydrophobicContact CD1-CG1 4.23Å; L536-V583 HydrophobicContact CD1-CG2 4.24Å; W548-V583 WeakPolarHBondContact O-CG2 3.45Å; S581-V583 VanDerWaalsContact C-N 3.27Å; S581-V583 PolarHBondContact O-N 2.75Å; V583-V585 PolarHBondContact O-N 3.01Å; V583-T1099 HydrophobicContact CB-CG2 4.4Å; V583-T1099 HydrophobicContact CG1-CG2 4.18Å; V583-T1099 HydrophobicContact CG2-CG2 4.27Å
584	P	53.1	Low	49.4	Very low	18 Å²	18	70.6 Å²	70.6	12%	0.117	41%	0.405	C	S	.	.			trans	-74.9	94.1	172.4	31.9	-32.1	0	0	0	110.2	W1065 W1186	P584-W1065 HydrophobicContact CB-CH2 3.53Å; P584-W1065 HydrophobicContact CB-CZ2 3.65Å; P584-W1065 HydrophobicContact CG-CH2 3.87Å; P584-W1065 HydrophobicContact CG-CZ2 4.04Å; P584-W1186 PolarHBondContact O-NE1 2.94Å
585	V	54.9	Low	51.2	Low	48 Å²	48	65.6 Å²	65.6	29%	0.291	37%	0.369	S	S	.	.			trans	-70	127.2	168.3	165.4	0	0	0	0	109.4	L536 I545 V583 W1186	L536-V585 HydrophobicContact CB-CG2 3.88Å; L536-V585 HydrophobicContact CD1-CG2 3.44Å; L536-V585 VanDerWaalsContact CD1-CG2 3.44Å; L536-V585 HydrophobicContact CG-CG2 4.32Å; I545-V585 HydrophobicContact CD1-CG1 3.91Å; I545-V585 HydrophobicContact CG2-CG1 4.05Å; I545-V585 HydrophobicContact CG2-CG2 4.12Å; V583-V585 PolarHBondContact O-N 3.01Å; V585-W1186 VanDerWaalsContact C-CD1 3.43Å
586	P	64.4	Low	52.2	Low	3 Å²	3	65.8 Å²	65.8	2%	0.019	36%	0.362	C	S	.	.			trans	-73	137.9	168.7	29.2	-29.8	0	0	0	110	Q588 H1103 I1184 V1185 W1186	P586-Q588 VanDerWaalsContact C-N 3.29Å; P586-H1103 WeakPolarHBondContact CG-CD2 3.49Å; P586-H1103 WeakPolarHBondContact CG-NE2 3.44Å; P586-I1184 HydrophobicContact CB-CG2 3.5Å; P586-I1184 VanDerWaalsContact CB-CG2 3.5Å; P586-I1184 HydrophobicContact CG-CG2 3.9Å; P586-V1185 CarbonylContact C-O 3.59Å; P586-V1185 WeakPolarHBondContact CA-O 3.5Å; P586-V1185 VanDerWaalsContact CB-O 3.31Å; P586-V1185 WeakPolarHBondContact CB-O 3.04Å; P586-W1186 HydrophobicContact CB-CD2 4.24Å; P586-W1186 HydrophobicContact CB-CG 4.25Å; P586-W1186 HydrophobicContact CB-CZ2 4.44Å
587	I	69	Low	53.6	Low	88 Å²	88	68.4 Å²	68.4	45%	0.451	37%	0.366	S	S	.	.	S	Bend	trans	-76.1	-24.3	174.7	-66.5	-163.6	0	0	0	110.8	V1185 R1187	I587-V1185 PolarHBondContact N-O 3.07Å; I587-R1187 HydrophobicContact CD1-CB 3.49Å; I587-R1187 VanDerWaalsContact CD1-CB 3.49Å; I587-R1187 HydrophobicContact CG1-CB 4.26Å
588	Q	68.2	Low	55	Low	28 Å²	28	63.8 Å²	63.8	13%	0.131	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	109.6	-172.8	176.7	173.1	-25.4	0	0	111	P586 R590 T658 I1184 V1185	P586-Q588 VanDerWaalsContact C-N 3.29Å; Q588-R590 HydrophobicContact CG-CG 3.94Å; Q588-T658 PolarHBondContact NE2-O 2.9Å; Q588-T658 PolarHBondContact OE1-O 3.28Å; Q588-I1184 CarbonylContact O-C 3.6Å; Q588-V1185 HydrophobicContact CB-CB 4.23Å; Q588-V1185 HydrophobicContact CB-CG2 4.42Å; Q588-V1185 PolarHBondContact N-O 3.39Å; Q588-V1185 PolarHBondContact O-N 3.43Å
589	C	68.6	Low	56.7	Low	34 Å²	34	65.7 Å²	65.7	23%	0.23	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	130	159.2	-178.9	0	0	0	0	108.5	Y1139 A1183	C589-Y1139 WeakPolarHBondContact SG-CE2 3.48Å; C589-A1183 WeakPolarHBondContact CA-O 3.47Å
590	R	67.8	Low	58.8	Low	98 Å²	98	60.4 Å²	60.4	37%	0.37	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	136.7	174.4	-67.8	-169.9	-173	162.6	8.7	111.4	Q588 F660 A1183	Q588-R590 HydrophobicContact CG-CG 3.94Å; R590-F660 HydrophobicContact CB-CB 4.21Å; R590-A1183 PolarHBondContact N-O 2.86Å; R590-A1183 PolarHBondContact O-N 3.06Å
591	T	70.7	Confident	61.2	Low	56 Å²	56	56.7 Å²	56.7	34%	0.344	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	138.2	155.5	-43.6	0	0	0	0	108.8	G593 H1182	T591-G593 PolarHBondContact O-N 2.77Å; T591-H1182 VanDerWaalsContact CA-CD2 3.44Å; T591-H1182 WeakPolarHBondContact CA-CD2 3.34Å; T591-H1182 PolarHBondContact OG1-CD2 3.15Å; T591-H1182 VanDerWaalsContact OG1-CD2 3.23Å; T591-H1182 PolarHBondContact OG1-NE2 2.98Å
592	I	72.1	Confident	63.3	Low	0 Å²	0	53 Å²	53	0%	0	28%	0.28	C	S	.	.			trans	-84.4	101.9	-173.4	-57.8	179.9	0	0	0	108.4	L595 L625 F655 F660 V1135 A1181 A1183	I592-L595 HydrophobicContact CB-CD1 3.97Å; I592-L595 HydrophobicContact CB-CG 4.37Å; I592-L595 HydrophobicContact CG2-CD1 3.59Å; I592-L595 HydrophobicContact CG2-CG 3.92Å; I592-L595 WeakPolarHBondContact O-CB 3.49Å; I592-L595 PolarHBondContact O-N 3.39Å; I592-L595 VanDerWaalsContact O-N 3.13Å; I592-L625 HydrophobicContact CD1-CD1 3.65Å; I592-L625 HydrophobicContact CG2-CD1 4.14Å; I592-F655 HydrophobicContact CG2-CD1 4.37Å; I592-F655 HydrophobicContact CG2-CD2 4.34Å; I592-F655 HydrophobicContact CG2-CE1 3.59Å; I592-F655 HydrophobicContact CG2-CE2 3.57Å; I592-F655 HydrophobicContact CG2-CZ 3.15Å; I592-F660 HydrophobicContact CG1-CB 4.45Å; I592-V1135 HydrophobicContact CD1-CG1 3.65Å; I592-A1181 HydrophobicContact CB-CB 4.42Å; I592-A1181 HydrophobicContact CD1-CB 4.19Å; I592-A1181 PolarHBondContact N-O 3.36Å; I592-A1183 HydrophobicContact CD1-CB 3.9Å; I592-A1183 HydrophobicContact CG1-CB 3.98Å
593	G	55.7	Low	64.8	Low	20 Å²	20	52.1 Å²	52.1	21%	0.206	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.8	142.3	-173.2	0	0	0	0	0	112.5	T591 L595 F660 T661	T591-G593 PolarHBondContact O-N 2.77Å; G593-L595 VanDerWaalsContact C-N 3.3Å; G593-L595 PolarHBondContact O-N 2.95Å; G593-F660 PolarHBondContact N-O 3.41Å; G593-T661 WeakPolarHBondContact CA-O 3.39Å
594	G	57.8	Low	66.6	Low	53 Å²	53	52.4 Å²	52.4	55%	0.546	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	89.5	-33.8	-168.4	0	0	0	0	0	114
595	L	62.8	Low	68.2	Low	5 Å²	5	51.8 Å²	51.8	3%	0.026	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-78.3	-25.8	-177.7	-58.1	-171.1	0	0	0	113.9	I592 G593 K597 K598 N599 L600 L625 H653 A1181	I592-L595 HydrophobicContact CB-CD1 3.97Å; I592-L595 HydrophobicContact CB-CG 4.37Å; I592-L595 HydrophobicContact CG2-CD1 3.59Å; I592-L595 HydrophobicContact CG2-CG 3.92Å; I592-L595 WeakPolarHBondContact O-CB 3.49Å; I592-L595 PolarHBondContact O-N 3.39Å; I592-L595 VanDerWaalsContact O-N 3.13Å; G593-L595 VanDerWaalsContact C-N 3.3Å; G593-L595 PolarHBondContact O-N 2.95Å; L595-K597 PolarHBondContact O-N 3.26Å; L595-K598 PolarHBondContact O-N 3.5Å; L595-N599 PolarHBondContact O-N 3.43Å; L595-L600 HydrophobicContact CD1-CB 4.49Å; L595-L600 HydrophobicContact CD1-CD2 3.77Å; L595-L600 HydrophobicContact CD2-CB 4.18Å; L595-L600 HydrophobicContact CD2-CD2 3.83Å; L595-L600 HydrophobicContact CG-CD2 4.44Å; L595-L625 HydrophobicContact CD1-CD1 4.34Å; L595-H653 HydrophobicContact CD2-CB 4.4Å; L595-A1181 HydrophobicContact CB-CB 4.43Å; L595-A1181 HydrophobicContact CD1-CB 3.74Å
596	H	53.6	Low	69.7	Low	120 Å²	120	50.3 Å²	50.3	56%	0.556	27%	0.266	S	S	*	.	G	3₁₀ helix	trans	-59.1	-18.8	-178.7	-163.1	-49.1	0	0	0	114
597	K	54.8	Low	70.7	Confident	203 Å²	203	52 Å²	52	88%	0.883	28%	0.276	S	S	*	.	G	3₁₀ helix	trans	-99.2	-15.8	173.1	-68.8	-166.8	176.5	-170.9	0	114.5	L595	L595-K597 PolarHBondContact O-N 3.26Å
598	K	58.6	Low	71.4	Confident	53 Å²	53	47.9 Å²	47.9	23%	0.23	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.4	-10.5	-173.3	-83.2	-168.5	156.6	-152.5	0	114.9	L595 L600 G630 D668	L595-K598 PolarHBondContact O-N 3.5Å; K598-L600 VanDerWaalsContact C-N 3.29Å; K598-L600 PolarHBondContact O-N 3.14Å; K598-G630 PolarHBondContact O-N 3.49Å; K598-G630 VanDerWaalsContact O-N 3.15Å; K598-D668 IonicContact NZ-OD1 3.56Å; K598-D668 PolarHBondContact NZ-OD1 3.46Å; K598-D668 IonicContact NZ-OD2 2.78Å
599	N	65.5	Low	71.8	Confident	120 Å²	120	48.6 Å²	48.6	64%	0.642	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	46	-175	-70.5	-23.8	0	0	0	112.9	L595 E601	L595-N599 PolarHBondContact O-N 3.43Å; N599-E601 PolarHBondContact O-N 3.06Å; N599-E601 VanDerWaalsContact O-N 3.12Å
600	L	74.3	Confident	72	Confident	8 Å²	8	48.2 Å²	48.2	4%	0.042	26%	0.257	C	S	.	.			trans	-67.3	107.7	-178.1	-174.2	78.3	0	0	0	111.7	L595 K598 I602 Q651 H1137	L595-L600 HydrophobicContact CD1-CB 4.49Å; L595-L600 HydrophobicContact CD1-CD2 3.77Å; L595-L600 HydrophobicContact CD2-CB 4.18Å; L595-L600 HydrophobicContact CD2-CD2 3.83Å; L595-L600 HydrophobicContact CG-CD2 4.44Å; K598-L600 VanDerWaalsContact C-N 3.29Å; K598-L600 PolarHBondContact O-N 3.14Å; L600-I602 VanDerWaalsContact C-N 3.34Å; L600-I602 HydrophobicContact CD2-CG1 3.79Å; L600-I602 HydrophobicContact CG-CG1 4.31Å; L600-I602 PolarHBondContact O-N 3.33Å; L600-Q651 HydrophobicContact CD1-CB 3.76Å; L600-Q651 HydrophobicContact CD1-CG 4.34Å; L600-H1137 PolarHBondContact O-CE1 3.06Å
601	E	78.9	Confident	71.7	Confident	93 Å²	93	44.9 Å²	44.9	44%	0.435	25%	0.251	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	90	159.5	-176.6	-176.1	-135.5	0	0	108.7	N599 C603 G627 R628	N599-E601 PolarHBondContact O-N 3.06Å; N599-E601 VanDerWaalsContact O-N 3.12Å; E601-C603 PolarHBondContact O-N 3.26Å; E601-G627 CarbonylContact O-C 3.56Å; E601-G627 WeakPolarHBondContact O-CA 3.39Å; E601-R628 HydrophobicContact CB-CB 4.45Å; E601-R628 WeakPolarHBondContact CB-O 3.5Å; E601-R628 PolarHBondContact N-O 2.79Å; E601-R628 PolarHBondContact O-N 3.43Å
602	I	79.8	Confident	71	Confident	0 Å²	0	43.8 Å²	43.8	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.7	124.4	168	-64.9	170.6	0	0	0	108.5	L600 L625 V1109 V1135 H1137 A1181	L600-I602 VanDerWaalsContact C-N 3.34Å; L600-I602 HydrophobicContact CD2-CG1 3.79Å; L600-I602 HydrophobicContact CG-CG1 4.31Å; L600-I602 PolarHBondContact O-N 3.33Å; I602-L625 HydrophobicContact CD1-CD1 4.16Å; I602-V1109 WeakPolarHBondContact O-CG1 3.25Å; I602-V1135 HydrophobicContact CD1-CG1 3.54Å; I602-H1137 PolarHBondContact N-CE1 2.9Å; I602-H1137 PolarHBondContact N-NE2 3.14Å; I602-H1137 VanDerWaalsContact N-NE2 3.14Å; I602-A1181 HydrophobicContact CD1-CB 3.71Å
603	C	82.2	Confident	70	Confident	30 Å²	30	47.1 Å²	47.1	20%	0.203	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96	-39.9	172.8	-54.8	0	0	0	0	110.7	E601 I626	E601-C603 PolarHBondContact O-N 3.26Å; C603-I626 PolarHBondContact N-O 2.87Å
604	T	85.1	Confident	69.6	Low	22 Å²	22	51.2 Å²	51.2	14%	0.135	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149	154.6	-179.8	-175.6	0	0	0	0	111.6	I626 A678	T604-I626 HydrophobicContact CG2-CB 3.86Å; T604-I626 HydrophobicContact CG2-CD1 4.1Å; T604-I626 HydrophobicContact CG2-CG2 4.18Å; T604-I626 PolarHBondContact N-O 3.01Å; T604-I626 PolarHBondContact O-N 2.99Å; T604-I626 VanDerWaalsContact O-O 3.11Å; T604-A678 HydrophobicContact CG2-CB 3.7Å
605	A	86.9	Confident	68.7	Low	5 Å²	5	54.9 Å²	54.9	4%	0.041	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	132.2	176.3	0	0	0	0	0	109.4	W624 L625 N1111 L1113	A605-W624 VanDerWaalsContact CA-O 3.29Å; A605-W624 WeakPolarHBondContact CA-O 3.29Å; A605-L625 HydrophobicContact CB-CD2 3.51Å; A605-N1111 HydrophobicContact CB-CB 3.96Å; A605-L1113 HydrophobicContact CB-CD1 3.97Å
606	L	87	Confident	67.7	Low	17 Å²	17	61.1 Å²	61.1	9%	0.089	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	150.6	-174.8	62.6	87.2	0	0	0	112.5	V608 W624 I626 A678 V731	L606-V608 HydrophobicContact CD1-CG2 3.33Å; L606-W624 HydrophobicContact CD1-CB 3.83Å; L606-W624 HydrophobicContact CD1-CG 4.14Å; L606-W624 HydrophobicContact CG-CB 4.07Å; L606-W624 PolarHBondContact N-O 3.41Å; L606-W624 PolarHBondContact O-N 3.48Å; L606-I626 HydrophobicContact CD2-CD1 3.71Å; L606-I626 HydrophobicContact CG-CD1 4.09Å; L606-A678 HydrophobicContact CD2-CB 3.49Å; L606-A678 VanDerWaalsContact CD2-CB 3.49Å; L606-V731 HydrophobicContact CD1-CG1 4.37Å; L606-V731 HydrophobicContact CD1-CG2 4.36Å; L606-V731 HydrophobicContact CD2-CG1 4.18Å
607	T	84.9	Confident	67.5	Low	39 Å²	39	57.1 Å²	57.1	24%	0.239	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	112.4	-176.7	54	0	0	0	0	110.1	H622 L623 L1113 I1115	T607-H622 WeakPolarHBondContact CA-O 3.35Å; T607-L623 HydrophobicContact CG2-CD1 4.29Å; T607-L1113 HydrophobicContact CG2-CB 4.11Å; T607-L1113 HydrophobicContact CG2-CD1 4.22Å; T607-I1115 HydrophobicContact CG2-CD1 3.88Å; T607-I1115 HydrophobicContact CG2-CG1 3.61Å
608	V	83.5	Confident	67.4	Low	1 Å²	1	51.8 Å²	51.8	1%	0.006	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	121	178.5	-170.9	0	0	0	0	109.6	L606 Y621 H622 W624 Y680 V731 L745	L606-V608 HydrophobicContact CD1-CG2 3.33Å; V608-Y621 CarbonylContact O-C 3.57Å; V608-Y621 WeakPolarHBondContact O-CA 3.48Å; V608-H622 PolarHBondContact N-O 3.27Å; V608-H622 PolarHBondContact O-N 3.19Å; V608-W624 VanDerWaalsContact CG2-CD1 3.44Å; V608-W624 HydrophobicContact CG2-CD2 4.21Å; V608-W624 HydrophobicContact CG2-CG 3.9Å; V608-Y680 HydrophobicContact CB-CD2 4.48Å; V608-Y680 HydrophobicContact CG1-CD2 3.67Å; V608-Y680 HydrophobicContact CG1-CE2 3.72Å; V608-Y680 HydrophobicContact CG1-CG 4.45Å; V608-Y680 HydrophobicContact CG2-CD2 4.4Å; V608-V731 HydrophobicContact CG1-CG2 4.46Å; V608-V731 HydrophobicContact CG2-CG2 3.71Å; V608-L745 HydrophobicContact CB-CD1 4.41Å; V608-L745 HydrophobicContact CG1-CD1 3.45Å; V608-L745 VanDerWaalsContact CG1-CD1 3.45Å
609	P	77.9	Confident	67.3	Low	43 Å²	43	51.5 Å²	51.5	28%	0.279	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	144.3	171.6	30.2	-34.4	0	0	0	110.6	Y621 Y680	P609-Y621 HydrophobicContact CB-CD1 4.03Å; P609-Y621 HydrophobicContact CB-CE1 3.77Å; P609-Y680 HydrophobicContact CG-CD1 4.39Å; P609-Y680 HydrophobicContact CG-CE1 3.57Å; P609-Y680 HydrophobicContact CG-CE2 4.46Å; P609-Y680 WeakPolarHBondContact CG-OH 3.45Å
610	I	71.8	Confident	67.5	Low	26 Å²	26	51.1 Å²	51.1	13%	0.133	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	127.9	179.9	-58	161	0	0	0	107.7	S612 K620 H622 Y747	I610-S612 PolarHBondContact O-N 3.45Å; I610-S612 VanDerWaalsContact O-N 3.11Å; I610-K620 HydrophobicContact CB-CB 4.12Å; I610-K620 WeakPolarHBondContact CB-O 3.5Å; I610-K620 HydrophobicContact CD1-CB 3.64Å; I610-K620 HydrophobicContact CG1-CB 4.42Å; I610-K620 PolarHBondContact N-O 3.25Å; I610-H622 HydrophobicContact CD1-CB 4.46Å; I610-H622 WeakPolarHBondContact CD1-CE1 3.26Å; I610-H622 WeakPolarHBondContact CD1-ND1 3.39Å; I610-H622 WeakPolarHBondContact CD1-NE2 3.4Å; I610-H622 WeakPolarHBondContact CG1-ND1 3.43Å; I610-Y747 HydrophobicContact CG2-CE1 4.11Å
611	A	61.9	Low	67.6	Low	28 Å²	28	53.5 Å²	53.5	23%	0.231	30%	0.297	C	S	.	.			trans	-66.2	108.6	167.3	0	0	0	0	0	108.5
612	S	55.8	Low	67.7	Low	34 Å²	34	49.6 Å²	49.6	24%	0.238	28%	0.279	C	S	.	.			trans	-77.2	137.1	174.8	-139.9	0	0	0	0	109.3	I610 S617	I610-S612 PolarHBondContact O-N 3.45Å; I610-S612 VanDerWaalsContact O-N 3.11Å; S612-S617 WeakPolarHBondContact CB-OG 3.03Å; S612-S617 PolarHBondContact OG-OG 3.49Å
613	L	51.8	Low	68	Low	69 Å²	69	49.6 Å²	49.6	36%	0.361	28%	0.279	S	S	.	.	S	Bend	trans	-78.3	-28.9	-177.7	-73.4	90.5	0	0	0	112.5	I722 M749	L613-I722 HydrophobicContact CD2-CD1 4.11Å; L613-I722 HydrophobicContact CD2-CG2 4.19Å; L613-M749 HydrophobicContact CD1-CE 4.07Å; L613-M749 HydrophobicContact CD2-CE 3.5Å; L613-M749 VanDerWaalsContact CD2-CE 3.5Å; L613-M749 HydrophobicContact CG-CE 4.39Å
614	D	47.3	Very low	68.3	Low	106 Å²	106	48.2 Å²	48.2	57%	0.567	27%	0.269	S	S	*	.	S	Bend	trans	-88.9	120.9	176.8	-28.7	-70.6	0	0	0	109.8	D616 S617	D614-D616 PolarHBondContact O-N 2.98Å; D614-D616 VanDerWaalsContact O-N 3.15Å; D614-S617 WeakPolarHBondContact O-CB 3.49Å; D614-S617 PolarHBondContact O-N 3.29Å; D614-S617 PolarHBondContact O-OG 3.49Å
615	C	39.1	Very low	68.5	Low	131 Å²	131	47.2 Å²	47.2	89%	0.885	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-31.2	-175.7	-63.5	0	0	0	0	114.4
616	D	41.5	Very low	68.5	Low	136 Å²	136	47 Å²	47	73%	0.727	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-0.5	-179	-59.2	-54	0	0	0	113.6	D614	D614-D616 PolarHBondContact O-N 2.98Å; D614-D616 VanDerWaalsContact O-N 3.15Å
617	S	48.8	Very low	68.5	Low	35 Å²	35	46.1 Å²	46.1	25%	0.245	26%	0.257	C	S	.	.	S	Bend	trans	-90.2	141.6	-172.4	68.8	0	0	0	0	113.6	S612 D614	S612-S617 WeakPolarHBondContact CB-OG 3.03Å; S612-S617 PolarHBondContact OG-OG 3.49Å; D614-S617 WeakPolarHBondContact O-CB 3.49Å; D614-S617 PolarHBondContact O-N 3.29Å; D614-S617 PolarHBondContact O-OG 3.49Å
618	K	53.6	Low	68.5	Low	92 Å²	92	47.1 Å²	47.1	40%	0.4	26%	0.256	S	S	.	.	P	Polyproline II helix	trans	-55.3	139	-176.5	-61.1	176.6	-179.6	-176.3	0	111.4	K620 I1118	K618-K620 PolarHBondContact O-N 3.15Å; K618-K620 VanDerWaalsContact O-N 3.09Å; K618-I1118 WeakPolarHBondContact CD-O 3.43Å
619	P	56.4	Low	68.2	Low	47 Å²	47	47 Å²	47	31%	0.305	26%	0.255	S	S	.	.	P	Polyproline II helix	trans	-59.8	117.5	175.2	25.9	-34.1	0	0	0	109.8	Y621 I1118	P619-Y621 HydrophobicContact CB-CE2 4.21Å; P619-I1118 HydrophobicContact CG-CB 4.34Å; P619-I1118 HydrophobicContact CG-CD1 3.82Å; P619-I1118 HydrophobicContact CG-CG1 3.94Å
620	K	68.6	Low	67.7	Low	112 Å²	112	46.6 Å²	46.6	49%	0.487	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	151	177.2	-57.9	169.8	-172.2	156.8	0	108.6	I610 K618	I610-K620 HydrophobicContact CB-CB 4.12Å; I610-K620 WeakPolarHBondContact CB-O 3.5Å; I610-K620 HydrophobicContact CD1-CB 3.64Å; I610-K620 HydrophobicContact CG1-CB 4.42Å; I610-K620 PolarHBondContact N-O 3.25Å; K618-K620 PolarHBondContact O-N 3.15Å; K618-K620 VanDerWaalsContact O-N 3.09Å
621	Y	76.2	Confident	67.1	Low	57 Å²	57	48.3 Å²	48.3	22%	0.224	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	145.4	175.3	-67.9	-98.9	0	0	0	109.2	V608 P609 P619 P657 I1115 H1116	V608-Y621 CarbonylContact O-C 3.57Å; V608-Y621 WeakPolarHBondContact O-CA 3.48Å; P609-Y621 HydrophobicContact CB-CD1 4.03Å; P609-Y621 HydrophobicContact CB-CE1 3.77Å; P619-Y621 HydrophobicContact CB-CE2 4.21Å; Y621-P657 WeakPolarHBondContact O-CD 3.49Å; Y621-P657 WeakPolarHBondContact O-CG 3.43Å; Y621-I1115 HydrophobicContact CD2-CG2 3.9Å; Y621-I1115 HydrophobicContact CG-CG2 4.01Å; Y621-H1116 HydrophobicContact CE2-CB 4.41Å; Y621-H1116 WeakPolarHBondContact CE2-O 3.47Å
622	H	82.5	Confident	66.7	Low	12 Å²	12	48.5 Å²	48.5	6%	0.056	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	141.8	164.1	-71.8	132.3	0	0	0	109.9	T607 V608 I610 I654 F655 I664	T607-H622 WeakPolarHBondContact CA-O 3.35Å; V608-H622 PolarHBondContact N-O 3.27Å; V608-H622 PolarHBondContact O-N 3.19Å; I610-H622 HydrophobicContact CD1-CB 4.46Å; I610-H622 WeakPolarHBondContact CD1-CE1 3.26Å; I610-H622 WeakPolarHBondContact CD1-ND1 3.39Å; I610-H622 WeakPolarHBondContact CD1-NE2 3.4Å; I610-H622 WeakPolarHBondContact CG1-ND1 3.43Å; H622-I654 HydrophobicContact CB-CG2 3.75Å; H622-F655 WeakPolarHBondContact CA-O 3.35Å; H622-I664 WeakPolarHBondContact CD2-CD1 3.34Å; H622-I664 WeakPolarHBondContact NE2-CD1 3.26Å
623	L	84.5	Confident	65.9	Low	0 Å²	0	54.2 Å²	54.2	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	114.8	164.7	-176.3	64.9	0	0	0	109	T607 L625 F655 F660 L1113 V1133 V1135	T607-L623 HydrophobicContact CG2-CD1 4.29Å; L623-L625 HydrophobicContact CD1-CD2 4.35Å; L623-L625 HydrophobicContact CD2-CD2 3.83Å; L623-L625 HydrophobicContact CD2-CG 4.42Å; L623-L625 HydrophobicContact CG-CD2 3.84Å; L623-L625 HydrophobicContact CG-CG 4.36Å; L623-F655 HydrophobicContact CB-CB 4.48Å; L623-F655 PolarHBondContact N-O 2.78Å; L623-F655 PolarHBondContact O-N 2.88Å; L623-F660 HydrophobicContact CD2-CE1 3.62Å; L623-F660 HydrophobicContact CD2-CZ 3.99Å; L623-L1113 HydrophobicContact CD1-CD1 3.38Å; L623-V1133 HydrophobicContact CD2-CG1 4.32Å; L623-V1135 HydrophobicContact CD2-CG2 3.85Å
624	W	89.6	Confident	65.3	Low	1 Å²	1	60.8 Å²	60.8	0%	0.004	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	121.5	171.9	-74.5	46.2	0	0	0	108.8	A605 L606 V608 I626 V652 I654 F667 V731 F743 L745 P778	A605-W624 VanDerWaalsContact CA-O 3.29Å; A605-W624 WeakPolarHBondContact CA-O 3.29Å; L606-W624 HydrophobicContact CD1-CB 3.83Å; L606-W624 HydrophobicContact CD1-CG 4.14Å; L606-W624 HydrophobicContact CG-CB 4.07Å; L606-W624 PolarHBondContact N-O 3.41Å; L606-W624 PolarHBondContact O-N 3.48Å; V608-W624 VanDerWaalsContact CG2-CD1 3.44Å; V608-W624 HydrophobicContact CG2-CD2 4.21Å; V608-W624 HydrophobicContact CG2-CG 3.9Å; W624-I626 HydrophobicContact CB-CD1 4.2Å; W624-V652 HydrophobicContact CD2-CG1 4.43Å; W624-V652 HydrophobicContact CE3-CG1 3.68Å; W624-V652 HydrophobicContact CZ3-CG1 4.11Å; W624-I654 HydrophobicContact CD2-CD1 4.05Å; W624-I654 HydrophobicContact CD2-CG1 4Å; W624-I654 HydrophobicContact CG-CG1 4.14Å; W624-I654 HydrophobicContact CH2-CD1 4.17Å; W624-I654 HydrophobicContact CZ2-CD1 3.59Å; W624-I654 HydrophobicContact CZ2-CG1 4.45Å; W624-F667 HydrophobicContact CZ3-CZ 4.29Å; W624-V731 HydrophobicContact CD2-CG2 4.44Å; W624-V731 HydrophobicContact CE3-CB 4.49Å; W624-V731 HydrophobicContact CE3-CG1 4.08Å; W624-V731 HydrophobicContact CE3-CG2 4.38Å; W624-V731 HydrophobicContact CH2-CB 4.25Å; W624-V731 HydrophobicContact CH2-CG2 4.13Å; W624-V731 HydrophobicContact CZ2-CG2 4.19Å; W624-V731 HydrophobicContact CZ3-CB 4.1Å; W624-V731 HydrophobicContact CZ3-CG1 4.02Å; W624-V731 HydrophobicContact CZ3-CG2 4.23Å; W624-F743 HydrophobicContact CH2-CB 4.08Å; W624-F743 HydrophobicContact CH2-CG 4.46Å; W624-F743 HydrophobicContact CZ3-CB 4.44Å; W624-F743 HydrophobicContact CZ3-CG 4.49Å; W624-L745 HydrophobicContact CZ2-CD2 3.85Å; W624-L745 HydrophobicContact CZ2-CG 4.27Å; W624-P778 HydrophobicContact CH2-CB 3.77Å; W624-P778 HydrophobicContact CZ2-CB 4.22Å
625	L	88.2	Confident	64.4	Low	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	119.9	171.5	-56	-177.2	0	0	0	108.2	I592 L595 I602 A605 L623 V652 H653 F655 V1135	I592-L625 HydrophobicContact CD1-CD1 3.65Å; I592-L625 HydrophobicContact CG2-CD1 4.14Å; L595-L625 HydrophobicContact CD1-CD1 4.34Å; I602-L625 HydrophobicContact CD1-CD1 4.16Å; A605-L625 HydrophobicContact CB-CD2 3.51Å; L623-L625 HydrophobicContact CD1-CD2 4.35Å; L623-L625 HydrophobicContact CD2-CD2 3.83Å; L623-L625 HydrophobicContact CD2-CG 4.42Å; L623-L625 HydrophobicContact CG-CD2 3.84Å; L623-L625 HydrophobicContact CG-CG 4.36Å; L625-V652 WeakPolarHBondContact O-CA 3.29Å; L625-H653 PolarHBondContact N-O 2.94Å; L625-H653 PolarHBondContact O-N 2.9Å; L625-F655 HydrophobicContact CD1-CD2 3.81Å; L625-F655 HydrophobicContact CD1-CE2 3.74Å; L625-F655 HydrophobicContact CG-CD2 4.15Å; L625-F655 HydrophobicContact CG-CE2 4.38Å; L625-V1135 HydrophobicContact CD1-CG1 4.29Å; L625-V1135 HydrophobicContact CD2-CB 4.39Å; L625-V1135 HydrophobicContact CD2-CG1 4Å; L625-V1135 HydrophobicContact CD2-CG2 4.26Å
626	I	88.3	Confident	64	Low	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	126.3	-174.7	-62.6	132.8	0	0	0	107.6	C603 T604 L606 W624 V652 P675 A678 L733	C603-I626 PolarHBondContact N-O 2.87Å; T604-I626 HydrophobicContact CG2-CB 3.86Å; T604-I626 HydrophobicContact CG2-CD1 4.1Å; T604-I626 HydrophobicContact CG2-CG2 4.18Å; T604-I626 PolarHBondContact N-O 3.01Å; T604-I626 PolarHBondContact O-N 2.99Å; T604-I626 VanDerWaalsContact O-O 3.11Å; L606-I626 HydrophobicContact CD2-CD1 3.71Å; L606-I626 HydrophobicContact CG-CD1 4.09Å; W624-I626 HydrophobicContact CB-CD1 4.2Å; I626-V652 HydrophobicContact CG1-CG1 4.03Å; I626-V652 HydrophobicContact CG1-CG2 4Å; I626-V652 HydrophobicContact CG2-CG2 4.36Å; I626-P675 HydrophobicContact CG2-CB 3.58Å; I626-P675 HydrophobicContact CG2-CG 3.74Å; I626-A678 HydrophobicContact CD1-CB 3.83Å; I626-L733 HydrophobicContact CD1-CD2 3.7Å; I626-L733 HydrophobicContact CG1-CD2 4.06Å; I626-L733 HydrophobicContact CG2-CD2 4.41Å
627	G	87	Confident	63.4	Low	0 Å²	0	61.4 Å²	61.4	0%	0	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	-167.4	-172.3	0	0	0	0	0	114.3	E601 G650 Q651 P675	E601-G627 CarbonylContact O-C 3.56Å; E601-G627 WeakPolarHBondContact O-CA 3.39Å; G627-G650 CarbonylContact O-C 3.51Å; G627-G650 WeakPolarHBondContact O-CA 3.22Å; G627-Q651 PolarHBondContact N-O 3.44Å; G627-Q651 PolarHBondContact O-N 3.17Å; G627-P675 VanDerWaalsContact O-CG 3.29Å; G627-P675 WeakPolarHBondContact O-CG 3.35Å
628	R	85.3	Confident	62.8	Low	59 Å²	59	67 Å²	67	22%	0.223	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	119.7	-179.5	-62.5	164.9	-171.7	-174.7	-1.8	108.5	E601 Y648 L649 L674 P675	E601-R628 HydrophobicContact CB-CB 4.45Å; E601-R628 WeakPolarHBondContact CB-O 3.5Å; E601-R628 PolarHBondContact N-O 2.79Å; E601-R628 PolarHBondContact O-N 3.43Å; R628-Y648 HydrophobicContact CB-CD1 4.35Å; R628-L649 CarbonylContact C-O 3.51Å; R628-L649 WeakPolarHBondContact CA-O 3.31Å; R628-L674 HydrophobicContact CG-CD2 4.03Å; R628-P675 HydrophobicContact CG-CG 4.45Å; R628-P675 PolarHBondContact NE-O 3.1Å; R628-P675 PolarHBondContact NH2-O 3.43Å
629	G	76.1	Confident	61.8	Low	0 Å²	0	70 Å²	70	0%	0	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	173.5	179.6	0	0	0	0	0	111.8	Y648 L649	G629-Y648 WeakPolarHBondContact O-CA 3.32Å; G629-L649 PolarHBondContact N-O 3Å; G629-L649 PolarHBondContact O-N 3.33Å
630	G	67.1	Low	60.5	Low	33 Å²	33	73.6 Å²	73.6	34%	0.34	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	147.6	165.4	0	0	0	0	0	110.6	K598 G632 Q651	K598-G630 PolarHBondContact O-N 3.49Å; K598-G630 VanDerWaalsContact O-N 3.15Å; G630-G632 PolarHBondContact O-N 2.91Å; G630-Q651 PolarHBondContact O-NE2 2.9Å
631	S	60.2	Low	58.7	Low	63 Å²	63	72.6 Å²	72.6	44%	0.441	42%	0.416	S	S	.	.	P	Polyproline II helix	trans	-55.9	122.5	162.9	53.1	0	0	0	0	109
632	G	53.7	Low	56.6	Low	32 Å²	32	77.4 Å²	77.4	33%	0.33	44%	0.444	S	S	.	.	P	Polyproline II helix	trans	-66.4	136.3	175.6	0	0	0	0	0	110.5	G630 Y634	G630-G632 PolarHBondContact O-N 2.91Å; G632-Y634 PolarHBondContact O-N 2.73Å
633	D	39.4	Very low	54.2	Low	154 Å²	154	81.6 Å²	81.6	82%	0.824	48%	0.475	S	S	*	.			trans	-69.5	68.6	-178.5	-65.8	-59.9	0	0	0	112.6	T635	D633-T635 VanDerWaalsContact C-N 3.27Å; D633-T635 PolarHBondContact O-N 3.07Å; D633-T635 VanDerWaalsContact O-N 3.09Å
634	Y	38.7	Very low	51.6	Low	207 Å²	207	90.3 Å²	90.3	81%	0.812	52%	0.52	S	S	*	.			trans	-79.8	79.1	164.5	-78	-72.9	0	0	0	109.3	G632 N636	G632-Y634 PolarHBondContact O-N 2.73Å; Y634-N636 PolarHBondContact O-N 3.36Å
635	T	27.6	Very low	49.1	Very low	124 Å²	124	96.8 Å²	96.8	76%	0.761	56%	0.555	S	S	*	*			trans	-70.5	73.9	173.5	56.5	0	0	0	0	111	D633 S637	D633-T635 VanDerWaalsContact C-N 3.27Å; D633-T635 PolarHBondContact O-N 3.07Å; D633-T635 VanDerWaalsContact O-N 3.09Å; T635-S637 PolarHBondContact O-N 2.88Å
636	N	30.8	Very low	47.2	Very low	155 Å²	155	109.1 Å²	109.1	83%	0.829	60%	0.602	S	S	*	*			trans	-67.7	98.5	161	-103.9	0	0	0	0	107.9	Y634 N638	Y634-N636 PolarHBondContact O-N 3.36Å; N636-N638 PolarHBondContact O-N 3.03Å
637	S	30	Very low	45.8	Very low	107 Å²	107	111 Å²	111	75%	0.748	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.8	90.2	177.4	55.9	0	0	0	0	110.7	T635	T635-S637 PolarHBondContact O-N 2.88Å
638	N	35.9	Very low	45	Very low	152 Å²	152	117.8 Å²	117.8	81%	0.813	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-163.8	-34	158.7	-94.8	-30	0	0	0	114.1	N636 S640	N636-N638 PolarHBondContact O-N 3.03Å; N638-S640 PolarHBondContact O-N 2.91Å
639	D	32.5	Very low	44.8	Very low	154 Å²	154	116.4 Å²	116.4	82%	0.824	64%	0.644	S	S	*	*			trans	-84.7	82.2	-175.4	-75.3	-49.1	0	0	0	113.2	S641	D639-S641 VanDerWaalsContact C-N 3.28Å; D639-S641 PolarHBondContact O-N 3.49Å; D639-S641 VanDerWaalsContact O-N 3.15Å
640	S	29.3	Very low	45.3	Very low	124 Å²	124	116.4 Å²	116.4	87%	0.867	64%	0.644	S	S	*	*			trans	-84.9	46.9	178.9	57.5	0	0	0	0	114.1	N638	N638-S640 PolarHBondContact O-N 2.91Å
641	S	30.3	Very low	46.3	Very low	91 Å²	91	114.8 Å²	114.8	64%	0.636	63%	0.628	S	S	*	*			trans	-154.4	155.1	170.1	70	0	0	0	0	114.7	D639	D639-S641 VanDerWaalsContact C-N 3.28Å; D639-S641 PolarHBondContact O-N 3.49Å; D639-S641 VanDerWaalsContact O-N 3.15Å
642	L	32.3	Very low	47.6	Very low	157 Å²	157	111.8 Å²	111.8	82%	0.822	61%	0.607	S	S	*	*	S	Bend	trans	77.2	102.6	170.2	-51.7	179.8	0	0	0	118.9
643	S	30.8	Very low	49.2	Very low	100 Å²	100	110.5 Å²	110.5	70%	0.699	59%	0.592	S	S	*	*			trans	64.2	107.7	156.5	62.2	0	0	0	0	120.1	N645	S643-N645 PolarHBondContact O-N 3.04Å
644	L	31.4	Very low	51.4	Low	183 Å²	183	103.2 Å²	103.2	96%	0.958	55%	0.553	S	S	*	*			trans	-69.7	103.9	155.1	-80.3	74.4	0	0	0	109.5
645	N	37	Very low	53.5	Low	138 Å²	138	93.3 Å²	93.3	74%	0.738	52%	0.515	S	S	*	.			trans	-122.8	111	164.8	-95.5	-39.3	0	0	0	109.3	S643 G647	S643-N645 PolarHBondContact O-N 3.04Å; N645-G647 PolarHBondContact O-N 2.93Å
646	R	48.4	Very low	55.8	Low	259 Å²	259	90.6 Å²	90.6	98%	0.977	49%	0.493	S	S	*	.			trans	-73.1	63.2	169.2	-76	-177.5	169.4	177.6	-2.8	110.2
647	G	58.7	Low	57.6	Low	38 Å²	38	83.6 Å²	83.6	39%	0.392	46%	0.456	S	S	.	.			trans	-78.5	141.3	178.5	0	0	0	0	0	111.7	N645	N645-G647 PolarHBondContact O-N 2.93Å
648	Y	69	Low	59.3	Low	143 Å²	143	80.6 Å²	80.6	56%	0.561	43%	0.433	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69	145.6	157.6	-70	-84.6	0	0	0	109.3	R628 G629 L674	R628-Y648 HydrophobicContact CB-CD1 4.35Å; G629-Y648 WeakPolarHBondContact O-CA 3.32Å; Y648-L674 WeakPolarHBondContact O-CD2 3.44Å
649	L	82.5	Confident	60.9	Low	30 Å²	30	78.3 Å²	78.3	16%	0.157	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	146.1	167.2	-72.1	176.7	0	0	0	109.7	R628 G629 N671	R628-L649 CarbonylContact C-O 3.51Å; R628-L649 WeakPolarHBondContact CA-O 3.31Å; G629-L649 PolarHBondContact N-O 3Å; G629-L649 PolarHBondContact O-N 3.33Å; L649-N671 WeakPolarHBondContact CD2-OD1 3.2Å
650	G	85.5	Confident	62.8	Low	0 Å²	0	71 Å²	71	0%	0	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.9	137.1	166.5	0	0	0	0	0	110.1	G627 L669 F673	G627-G650 CarbonylContact O-C 3.51Å; G627-G650 WeakPolarHBondContact O-CA 3.22Å; G650-L669 PolarHBondContact O-N 2.79Å; G650-F673 WeakPolarHBondContact CA-O 3.46Å; G650-F673 PolarHBondContact N-O 3.21Å
651	Q	87.3	Confident	64.6	Low	0 Å²	0	69.3 Å²	69.3	0%	0	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.8	144.4	179.4	-51.3	-174.7	-46.3	0	0	110.1	L600 G627 G630 D668	L600-Q651 HydrophobicContact CD1-CB 3.76Å; L600-Q651 HydrophobicContact CD1-CG 4.34Å; G627-Q651 PolarHBondContact N-O 3.44Å; G627-Q651 PolarHBondContact O-N 3.17Å; G630-Q651 PolarHBondContact O-NE2 2.9Å; Q651-D668 VanDerWaalsContact CD-OD1 3.27Å; Q651-D668 WeakPolarHBondContact CG-OD1 3.08Å; Q651-D668 PolarHBondContact NE2-OD1 2.83Å
652	V	88.8	Confident	66.6	Low	0 Å²	0	72.2 Å²	72.2	0%	0	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	129.1	178.7	-177.8	0	0	0	0	109.3	W624 L625 I626 I654 S666 F667 L669 L733	W624-V652 HydrophobicContact CD2-CG1 4.43Å; W624-V652 HydrophobicContact CE3-CG1 3.68Å; W624-V652 HydrophobicContact CZ3-CG1 4.11Å; L625-V652 WeakPolarHBondContact O-CA 3.29Å; I626-V652 HydrophobicContact CG1-CG1 4.03Å; I626-V652 HydrophobicContact CG1-CG2 4Å; I626-V652 HydrophobicContact CG2-CG2 4.36Å; V652-I654 HydrophobicContact CG1-CG1 4.47Å; V652-S666 WeakPolarHBondContact O-CA 3.31Å; V652-F667 HydrophobicContact CB-CD1 4.17Å; V652-F667 HydrophobicContact CB-CD2 4.29Å; V652-F667 HydrophobicContact CB-CE1 3.63Å; V652-F667 HydrophobicContact CB-CE2 3.79Å; V652-F667 HydrophobicContact CB-CG 4.48Å; V652-F667 HydrophobicContact CB-CZ 3.44Å; V652-F667 VanDerWaalsContact CB-CZ 3.44Å; V652-F667 HydrophobicContact CG1-CD1 4.49Å; V652-F667 HydrophobicContact CG1-CE1 3.58Å; V652-F667 HydrophobicContact CG1-CE2 4.36Å; V652-F667 HydrophobicContact CG1-CZ 3.53Å; V652-F667 HydrophobicContact CG2-CE2 3.86Å; V652-F667 HydrophobicContact CG2-CZ 3.85Å; V652-F667 PolarHBondContact N-O 2.9Å; V652-F667 PolarHBondContact O-N 3.23Å; V652-L669 HydrophobicContact CG2-CD1 3.99Å; V652-L669 HydrophobicContact CG2-CD2 3.83Å; V652-L669 HydrophobicContact CG2-CG 4.01Å; V652-L733 HydrophobicContact CG2-CD1 3.88Å
653	H	86.2	Confident	68.7	Low	5 Å²	5	66.5 Å²	66.5	2%	0.023	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	122.5	-179.4	-60.3	-93.5	0	0	0	109.9	L595 L625 F655 P663 S666	L595-H653 HydrophobicContact CD2-CB 4.4Å; L625-H653 PolarHBondContact N-O 2.94Å; L625-H653 PolarHBondContact O-N 2.9Å; H653-F655 HydrophobicContact CB-CD2 4.31Å; H653-F655 HydrophobicContact CB-CE2 3.56Å; H653-F655 HydrophobicContact CB-CZ 4.3Å; H653-P663 HydrophobicContact CB-CB 4.43Å; H653-S666 WeakPolarHBondContact ND1-CB 3.24Å; H653-S666 PolarHBondContact ND1-OG 3.12Å
654	I	87	Confident	71	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	32%	0.323	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	124.7	-176	-56.1	-178.5	0	0	0	108.7	H622 W624 V652 P663 I664 N665 F667 P778	H622-I654 HydrophobicContact CB-CG2 3.75Å; W624-I654 HydrophobicContact CD2-CD1 4.05Å; W624-I654 HydrophobicContact CD2-CG1 4Å; W624-I654 HydrophobicContact CG-CG1 4.14Å; W624-I654 HydrophobicContact CH2-CD1 4.17Å; W624-I654 HydrophobicContact CZ2-CD1 3.59Å; W624-I654 HydrophobicContact CZ2-CG1 4.45Å; V652-I654 HydrophobicContact CG1-CG1 4.47Å; I654-P663 CarbonylContact O-C 3.42Å; I654-P663 VanDerWaalsContact O-CA 3.29Å; I654-P663 WeakPolarHBondContact O-CA 3.3Å; I654-P663 WeakPolarHBondContact O-CB 3.37Å; I654-I664 PolarHBondContact O-N 2.61Å; I654-N665 HydrophobicContact CB-CB 4.46Å; I654-N665 HydrophobicContact CD1-CB 4.38Å; I654-N665 PolarHBondContact N-O 3.36Å; I654-F667 HydrophobicContact CD1-CE1 4.28Å; I654-P778 HydrophobicContact CD1-CB 4.44Å; I654-P778 HydrophobicContact CD1-CG 4.07Å
655	F	81.2	Confident	73.3	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	155.4	-178.4	-69.8	-89	0	0	0	112.5	I592 H622 L623 L625 H653 F660 P663	I592-F655 HydrophobicContact CG2-CD1 4.37Å; I592-F655 HydrophobicContact CG2-CD2 4.34Å; I592-F655 HydrophobicContact CG2-CE1 3.59Å; I592-F655 HydrophobicContact CG2-CE2 3.57Å; I592-F655 HydrophobicContact CG2-CZ 3.15Å; H622-F655 WeakPolarHBondContact CA-O 3.35Å; L623-F655 HydrophobicContact CB-CB 4.48Å; L623-F655 PolarHBondContact N-O 2.78Å; L623-F655 PolarHBondContact O-N 2.88Å; L625-F655 HydrophobicContact CD1-CD2 3.81Å; L625-F655 HydrophobicContact CD1-CE2 3.74Å; L625-F655 HydrophobicContact CG-CD2 4.15Å; L625-F655 HydrophobicContact CG-CE2 4.38Å; H653-F655 HydrophobicContact CB-CD2 4.31Å; H653-F655 HydrophobicContact CB-CE2 3.56Å; H653-F655 HydrophobicContact CB-CZ 4.3Å; F655-F660 HydrophobicContact CB-CD1 4.02Å; F655-F660 HydrophobicContact CB-CE1 4.04Å; F655-F660 HydrophobicContact CD1-CD1 4.11Å; F655-F660 HydrophobicContact CG-CD1 4.07Å; F655-F660 HydrophobicContact CG-CE1 4.5Å; F655-P663 HydrophobicContact CD1-CB 4.24Å; F655-P663 HydrophobicContact CD2-CB 4.49Å; F655-P663 VanDerWaalsContact CE1-CA 3.5Å; F655-P663 HydrophobicContact CE1-CB 3.79Å; F655-P663 HydrophobicContact CE1-CG 4.34Å; F655-P663 VanDerWaalsContact CE1-N 3.27Å; F655-P663 HydrophobicContact CE2-CB 4.06Å; F655-P663 HydrophobicContact CZ-CB 3.66Å; F655-P663 HydrophobicContact CZ-CG 4.16Å
656	E	76.2	Confident	75.6	Confident	67 Å²	67	54 Å²	54	31%	0.313	27%	0.266	S	S	.	.	B	Isolated β-bridge	trans	-77.3	131.7	160.1	-163.1	177.2	139.3	0	0	108.1	T658 K659 I664	E656-T658 PolarHBondContact O-N 2.93Å; E656-T658 PolarHBondContact OE1-OG1 2.9Å; E656-K659 HydrophobicContact CB-CB 4.07Å; E656-K659 HydrophobicContact CB-CD 4.49Å; E656-K659 HydrophobicContact CB-CG 4.33Å; E656-K659 VanDerWaalsContact CD-CE 3.48Å; E656-K659 VanDerWaalsContact CD-NZ 3.27Å; E656-K659 CarbonylContact O-C 3.55Å; E656-K659 PolarHBondContact O-N 2.88Å; E656-K659 WeakPolarHBondContact OE1-CE 3.38Å; E656-K659 IonicContact OE1-NZ 3.83Å; E656-K659 PolarHBondContact OE1-NZ 2.97Å; E656-K659 VanDerWaalsContact OE1-NZ 3.12Å; E656-K659 WeakPolarHBondContact OE2-CD 3.47Å; E656-K659 VanDerWaalsContact OE2-CE 3.24Å; E656-K659 WeakPolarHBondContact OE2-CE 3.36Å; E656-K659 IonicContact OE2-NZ 2.95Å; E656-K659 PolarHBondContact OE2-NZ 3.05Å; E656-I664 HydrophobicContact CB-CD1 4.11Å
657	P	68.3	Low	77.3	Confident	8 Å²	8	43.6 Å²	43.6	5%	0.052	23%	0.229	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.6	-15.1	-178.5	-30.5	36.6	0	0	0	116.3	Y621 F660 I1115	Y621-P657 WeakPolarHBondContact O-CD 3.49Å; Y621-P657 WeakPolarHBondContact O-CG 3.43Å; P657-F660 VanDerWaalsContact O-CE2 3.26Å; P657-F660 WeakPolarHBondContact O-CE2 3.26Å; P657-F660 VanDerWaalsContact O-CZ 3.31Å; P657-F660 WeakPolarHBondContact O-CZ 2.73Å; P657-I1115 HydrophobicContact CB-CD1 3.59Å; P657-I1115 HydrophobicContact CG-CD1 3.67Å
658	T	66.8	Low	78.7	Confident	44 Å²	44	44.8 Å²	44.8	27%	0.27	23%	0.226	S	C	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-8.9	177.2	53.6	0	0	0	0	112.9	Q588 E656 L1131	Q588-T658 PolarHBondContact NE2-O 2.9Å; Q588-T658 PolarHBondContact OE1-O 3.28Å; E656-T658 PolarHBondContact O-N 2.93Å; E656-T658 PolarHBondContact OE1-OG1 2.9Å; T658-L1131 HydrophobicContact CG2-CD1 4.17Å
659	K	69.7	Low	79.5	Confident	104 Å²	104	38.6 Å²	38.6	45%	0.452	20%	0.202	S	C	.	.	B	Isolated β-bridge	trans	-134.4	86.5	-173.9	-52.3	177.4	-166.4	148.6	0	111.9	E656 T661	E656-K659 HydrophobicContact CB-CB 4.07Å; E656-K659 HydrophobicContact CB-CD 4.49Å; E656-K659 HydrophobicContact CB-CG 4.33Å; E656-K659 VanDerWaalsContact CD-CE 3.48Å; E656-K659 VanDerWaalsContact CD-NZ 3.27Å; E656-K659 CarbonylContact O-C 3.55Å; E656-K659 PolarHBondContact O-N 2.88Å; E656-K659 WeakPolarHBondContact OE1-CE 3.38Å; E656-K659 IonicContact OE1-NZ 3.83Å; E656-K659 PolarHBondContact OE1-NZ 2.97Å; E656-K659 VanDerWaalsContact OE1-NZ 3.12Å; E656-K659 WeakPolarHBondContact OE2-CD 3.47Å; E656-K659 VanDerWaalsContact OE2-CE 3.24Å; E656-K659 WeakPolarHBondContact OE2-CE 3.36Å; E656-K659 IonicContact OE2-NZ 2.95Å; E656-K659 PolarHBondContact OE2-NZ 3.05Å; K659-T661 VanDerWaalsContact C-N 3.29Å; K659-T661 PolarHBondContact O-N 2.87Å
660	F	71.4	Confident	79.6	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.208	C	C	.	.			trans	-88.3	19.9	173.4	-58.1	-63.1	0	0	0	114.3	R590 I592 G593 L623 F655 P657 V1133 A1183 V1185	R590-F660 HydrophobicContact CB-CB 4.21Å; I592-F660 HydrophobicContact CG1-CB 4.45Å; G593-F660 PolarHBondContact N-O 3.41Å; L623-F660 HydrophobicContact CD2-CE1 3.62Å; L623-F660 HydrophobicContact CD2-CZ 3.99Å; F655-F660 HydrophobicContact CB-CD1 4.02Å; F655-F660 HydrophobicContact CB-CE1 4.04Å; F655-F660 HydrophobicContact CD1-CD1 4.11Å; F655-F660 HydrophobicContact CG-CD1 4.07Å; F655-F660 HydrophobicContact CG-CE1 4.5Å; P657-F660 VanDerWaalsContact O-CE2 3.26Å; P657-F660 WeakPolarHBondContact O-CE2 3.26Å; P657-F660 VanDerWaalsContact O-CZ 3.31Å; P657-F660 WeakPolarHBondContact O-CZ 2.73Å; F660-V1133 HydrophobicContact CZ-CG1 4.13Å; F660-A1183 HydrophobicContact CD1-CB 4.08Å; F660-A1183 HydrophobicContact CD2-CB 3.54Å; F660-A1183 HydrophobicContact CE1-CB 4.14Å; F660-A1183 HydrophobicContact CE2-CB 3.59Å; F660-A1183 HydrophobicContact CG-CB 3.8Å; F660-A1183 HydrophobicContact CZ-CB 3.9Å; F660-V1185 HydrophobicContact CE2-CG2 3.66Å
661	T	68	Low	79.3	Confident	88 Å²	88	46.1 Å²	46.1	54%	0.54	24%	0.243	S	C	.	.	S	Bend	trans	-78.7	-40.5	-177.5	37.5	0	0	0	0	113	G593 K659	G593-T661 WeakPolarHBondContact CA-O 3.39Å; K659-T661 VanDerWaalsContact C-N 3.29Å; K659-T661 PolarHBondContact O-N 2.87Å
662	Q	72.6	Confident	79.1	Confident	153 Å²	153	47.9 Å²	47.9	72%	0.715	26%	0.261	S	S	*	.	S	Bend	trans	-147.7	148.5	171.1	-68.6	-175.2	-3.6	0	0	108
663	P	76	Confident	79.1	Confident	36 Å²	36	47.9 Å²	47.9	23%	0.234	26%	0.261	C	S	.	.			trans	-69.2	142.9	171.3	27.9	-32.5	0	0	0	110.7	H653 I654 F655 N665 S666	H653-P663 HydrophobicContact CB-CB 4.43Å; I654-P663 CarbonylContact O-C 3.42Å; I654-P663 VanDerWaalsContact O-CA 3.29Å; I654-P663 WeakPolarHBondContact O-CA 3.3Å; I654-P663 WeakPolarHBondContact O-CB 3.37Å; F655-P663 HydrophobicContact CD1-CB 4.24Å; F655-P663 HydrophobicContact CD2-CB 4.49Å; F655-P663 VanDerWaalsContact CE1-CA 3.5Å; F655-P663 HydrophobicContact CE1-CB 3.79Å; F655-P663 HydrophobicContact CE1-CG 4.34Å; F655-P663 VanDerWaalsContact CE1-N 3.27Å; F655-P663 HydrophobicContact CE2-CB 4.06Å; F655-P663 HydrophobicContact CZ-CB 3.66Å; F655-P663 HydrophobicContact CZ-CG 4.16Å; P663-N665 VanDerWaalsContact C-N 3.29Å; P663-S666 WeakPolarHBondContact CB-OG 3.46Å; P663-S666 WeakPolarHBondContact CG-OG 3.42Å
664	I	78.1	Confident	79.2	Confident	78 Å²	78	49.4 Å²	49.4	40%	0.4	27%	0.269	S	S	.	.	S	Bend	trans	-63.3	-39.5	171.4	-62.3	163.9	0	0	0	110.2	H622 I654 E656 V776	H622-I664 WeakPolarHBondContact CD2-CD1 3.34Å; H622-I664 WeakPolarHBondContact NE2-CD1 3.26Å; I654-I664 PolarHBondContact O-N 2.61Å; E656-I664 HydrophobicContact CB-CD1 4.11Å; I664-V776 HydrophobicContact CG2-CB 4.4Å; I664-V776 HydrophobicContact CG2-CG2 4.42Å
665	N	81.2	Confident	79.3	Confident	32 Å²	32	49.4 Å²	49.4	17%	0.171	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	148.6	175	-162.8	-28.4	0	0	0	109.1	I654 P663 V776 P778	I654-N665 HydrophobicContact CB-CB 4.46Å; I654-N665 HydrophobicContact CD1-CB 4.38Å; I654-N665 PolarHBondContact N-O 3.36Å; P663-N665 VanDerWaalsContact C-N 3.29Å; N665-V776 PolarHBondContact ND2-O 3.19Å; N665-P778 VanDerWaalsContact ND2-CD 3.27Å; N665-P778 WeakPolarHBondContact ND2-CD 3.43Å
666	S	83.7	Confident	79.6	Confident	48 Å²	48	51 Å²	51	34%	0.336	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	130.1	176.3	-68.5	0	0	0	0	110.4	V652 H653 P663	V652-S666 WeakPolarHBondContact O-CA 3.31Å; H653-S666 WeakPolarHBondContact ND1-CB 3.24Å; H653-S666 PolarHBondContact ND1-OG 3.12Å; P663-S666 WeakPolarHBondContact CB-OG 3.46Å; P663-S666 WeakPolarHBondContact CG-OG 3.42Å
667	F	85.8	Confident	80.2	Confident	42 Å²	42	48.2 Å²	48.2	18%	0.184	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.4	144.6	-178.4	58.9	-80.5	0	0	0	110.1	W624 V652 I654 L669 F743 P778	W624-F667 HydrophobicContact CZ3-CZ 4.29Å; V652-F667 HydrophobicContact CB-CD1 4.17Å; V652-F667 HydrophobicContact CB-CD2 4.29Å; V652-F667 HydrophobicContact CB-CE1 3.63Å; V652-F667 HydrophobicContact CB-CE2 3.79Å; V652-F667 HydrophobicContact CB-CG 4.48Å; V652-F667 HydrophobicContact CB-CZ 3.44Å; V652-F667 VanDerWaalsContact CB-CZ 3.44Å; V652-F667 HydrophobicContact CG1-CD1 4.49Å; V652-F667 HydrophobicContact CG1-CE1 3.58Å; V652-F667 HydrophobicContact CG1-CE2 4.36Å; V652-F667 HydrophobicContact CG1-CZ 3.53Å; V652-F667 HydrophobicContact CG2-CE2 3.86Å; V652-F667 HydrophobicContact CG2-CZ 3.85Å; V652-F667 PolarHBondContact N-O 2.9Å; V652-F667 PolarHBondContact O-N 3.23Å; I654-F667 HydrophobicContact CD1-CE1 4.28Å; F667-L669 HydrophobicContact CD2-CD2 4.13Å; F667-L669 HydrophobicContact CE2-CD2 3.71Å; F667-F743 HydrophobicContact CD2-CE1 4.43Å; F667-F743 HydrophobicContact CE2-CD1 4.35Å; F667-F743 AromaticContact CE2-CE1 3.46Å; F667-F743 HydrophobicContact CE2-CE1 3.46Å; F667-F743 VanDerWaalsContact CE2-CE1 3.46Å; F667-F743 AromaticContact CE2-CZ 3.62Å; F667-F743 HydrophobicContact CE2-CZ 3.62Å; F667-F743 HydrophobicContact CZ-CD1 4.26Å; F667-F743 AromaticContact CZ-CE1 3.81Å; F667-F743 HydrophobicContact CZ-CE1 3.81Å; F667-F743 HydrophobicContact CZ-CZ 4.18Å; F667-P778 HydrophobicContact CD1-CG 3.82Å; F667-P778 HydrophobicContact CE1-CB 4.13Å; F667-P778 HydrophobicContact CE1-CG 3.35Å; F667-P778 HydrophobicContact CZ-CB 4.25Å; F667-P778 HydrophobicContact CZ-CG 3.9Å
668	D	86.8	Confident	81.3	Confident	63 Å²	63	48.4 Å²	48.4	34%	0.337	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	147.9	170.8	-57.8	-35.6	0	0	0	108.2	K598 Q651	K598-D668 IonicContact NZ-OD1 3.56Å; K598-D668 PolarHBondContact NZ-OD1 3.46Å; K598-D668 IonicContact NZ-OD2 2.78Å; Q651-D668 VanDerWaalsContact CD-OD1 3.27Å; Q651-D668 WeakPolarHBondContact CG-OD1 3.08Å; Q651-D668 PolarHBondContact NE2-OD1 2.83Å
669	L	87.4	Confident	82.5	Confident	12 Å²	12	46.7 Å²	46.7	6%	0.063	26%	0.259	C	S	.	.			trans	-88.2	165.7	178.4	-62.4	176.1	0	0	0	110.7	G650 V652 F667 N671 F673 P675 L733 L741 F743	G650-L669 PolarHBondContact O-N 2.79Å; V652-L669 HydrophobicContact CG2-CD1 3.99Å; V652-L669 HydrophobicContact CG2-CD2 3.83Å; V652-L669 HydrophobicContact CG2-CG 4.01Å; F667-L669 HydrophobicContact CD2-CD2 4.13Å; F667-L669 HydrophobicContact CE2-CD2 3.71Å; L669-N671 PolarHBondContact O-N 2.98Å; L669-F673 HydrophobicContact CB-CB 4.34Å; L669-F673 HydrophobicContact CB-CD1 4.21Å; L669-F673 HydrophobicContact CD1-CD1 3.67Å; L669-F673 HydrophobicContact CD1-CE1 4Å; L669-P675 HydrophobicContact CD1-CG 4.3Å; L669-L733 HydrophobicContact CD1-CD1 3.9Å; L669-L733 HydrophobicContact CD2-CD1 3.94Å; L669-L741 HydrophobicContact CD2-CD1 4.17Å; L669-F743 HydrophobicContact CD2-CE2 4.38Å; L669-F743 HydrophobicContact CD2-CZ 3.88Å
670	D	83.2	Confident	83.4	Confident	52 Å²	52	43.8 Å²	43.8	28%	0.278	25%	0.245	S	C	.	.	S	Bend	trans	-43.1	139.2	176.3	-66	-27.3	0	0	0	112.2	G672 F673 R783	D670-G672 PolarHBondContact O-N 3.01Å; D670-F673 HydrophobicContact CB-CB 4.07Å; D670-F673 WeakPolarHBondContact O-CB 3.48Å; D670-F673 PolarHBondContact O-N 3.34Å; D670-R783 IonicContact OD1-NH2 2.74Å; D670-R783 IonicContact OD2-CZ 2.8Å; D670-R783 IonicContact OD2-NE 3.79Å; D670-R783 PolarHBondContact OD2-NE 2.88Å; D670-R783 IonicContact OD2-NH2 3.09Å; D670-R783 PolarHBondContact OD2-NH2 2.88Å
671	N	80.5	Confident	84.1	Confident	136 Å²	136	43.8 Å²	43.8	73%	0.727	25%	0.245	S	C	*	.	T	Hydrogen-bonded Turn	trans	-51.2	129.4	178.8	-76.5	-14.5	0	0	0	111.7	L649 L669 F673	L649-N671 WeakPolarHBondContact CD2-OD1 3.2Å; L669-N671 PolarHBondContact O-N 2.98Å; N671-F673 VanDerWaalsContact C-N 3.26Å; N671-F673 PolarHBondContact O-N 3.31Å
672	G	82.2	Confident	84.5	Confident	37 Å²	37	44.2 Å²	44.2	38%	0.381	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	76.1	-5.1	-175.4	0	0	0	0	0	116	D670 L674 R739	D670-G672 PolarHBondContact O-N 3.01Å; G672-L674 PolarHBondContact O-N 2.7Å; G672-R739 VanDerWaalsContact C-NH2 3.3Å; G672-R739 PolarHBondContact O-NH2 2.82Å
673	F	88.7	Confident	84.5	Confident	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.218	C	C	.	.			trans	-75.5	91.2	172.9	-167.3	-77.8	0	0	0	109.3	G650 L669 D670 N671 P675 L733 R739 L741	G650-F673 WeakPolarHBondContact CA-O 3.46Å; G650-F673 PolarHBondContact N-O 3.21Å; L669-F673 HydrophobicContact CB-CB 4.34Å; L669-F673 HydrophobicContact CB-CD1 4.21Å; L669-F673 HydrophobicContact CD1-CD1 3.67Å; L669-F673 HydrophobicContact CD1-CE1 4Å; D670-F673 HydrophobicContact CB-CB 4.07Å; D670-F673 WeakPolarHBondContact O-CB 3.48Å; D670-F673 PolarHBondContact O-N 3.34Å; N671-F673 VanDerWaalsContact C-N 3.26Å; N671-F673 PolarHBondContact O-N 3.31Å; F673-P675 WeakPolarHBondContact O-CD 3.29Å; F673-L733 HydrophobicContact CE1-CB 4.2Å; F673-L733 HydrophobicContact CZ-CB 4.28Å; F673-R739 HydrophobicContact CD2-CB 4.03Å; F673-R739 HydrophobicContact CE2-CB 3.77Å; F673-L741 HydrophobicContact CD1-CD1 4.17Å; F673-L741 HydrophobicContact CD2-CD1 3.93Å; F673-L741 HydrophobicContact CD2-CG 4.11Å; F673-L741 HydrophobicContact CE1-CD1 4.05Å; F673-L741 HydrophobicContact CE1-CG 4.47Å; F673-L741 HydrophobicContact CE2-CD1 3.8Å; F673-L741 HydrophobicContact CE2-CD2 4.44Å; F673-L741 HydrophobicContact CE2-CG 3.58Å; F673-L741 HydrophobicContact CG-CD1 4.13Å; F673-L741 HydrophobicContact CZ-CB 4.39Å; F673-L741 HydrophobicContact CZ-CD1 3.86Å; F673-L741 HydrophobicContact CZ-CG 3.79Å
674	L	88	Confident	83.8	Confident	37 Å²	37	39.8 Å²	39.8	19%	0.194	22%	0.216	C	C	.	.			trans	-93.1	107.2	176.8	-63.8	170.1	0	0	0	109.1	R628 Y648 G672 S735 N736	R628-L674 HydrophobicContact CG-CD2 4.03Å; Y648-L674 WeakPolarHBondContact O-CD2 3.44Å; G672-L674 PolarHBondContact O-N 2.7Å; L674-S735 CarbonylContact O-C 3.59Å; L674-S735 VanDerWaalsContact O-CA 3.31Å; L674-S735 WeakPolarHBondContact O-CA 3.4Å; L674-N736 WeakPolarHBondContact CB-OD1 3.34Å; L674-N736 PolarHBondContact O-N 3.27Å; L674-N736 PolarHBondContact O-OD1 3.26Å
675	P	89.6	Confident	82.6	Confident	0 Å²	0	40.6 Å²	40.6	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-63.6	149.2	-173.7	25.1	-34.2	0	0	0	112.1	I626 G627 R628 L669 F673 A734	I626-P675 HydrophobicContact CG2-CB 3.58Å; I626-P675 HydrophobicContact CG2-CG 3.74Å; G627-P675 VanDerWaalsContact O-CG 3.29Å; G627-P675 WeakPolarHBondContact O-CG 3.35Å; R628-P675 HydrophobicContact CG-CG 4.45Å; R628-P675 PolarHBondContact NE-O 3.1Å; R628-P675 PolarHBondContact NH2-O 3.43Å; L669-P675 HydrophobicContact CD1-CG 4.3Å; F673-P675 WeakPolarHBondContact O-CD 3.29Å; P675-A734 CarbonylContact C-O 3.57Å; P675-A734 VanDerWaalsContact CA-O 3.29Å; P675-A734 WeakPolarHBondContact CA-O 3.37Å
676	T	88.1	Confident	81.1	Confident	35 Å²	35	42.4 Å²	42.4	22%	0.215	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	-52.4	174.1	51.4	0	0	0	0	111.4	A734 S735 N736 V792 A793	T676-A734 PolarHBondContact N-O 2.93Å; T676-A734 PolarHBondContact OG1-O 3.02Å; T676-S735 PolarHBondContact OG1-O 2.93Å; T676-N736 HydrophobicContact CG2-CB 3.81Å; T676-V792 HydrophobicContact CG2-CG1 4.48Å; T676-A793 WeakPolarHBondContact CB-O 3.45Å; T676-A793 PolarHBondContact OG1-O 3.48Å
677	A	88.6	Confident	79	Confident	7 Å²	7	46 Å²	46	6%	0.058	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	160.9	-177.6	0	0	0	0	0	110.8	A734 M796	A677-A734 PolarHBondContact O-N 3.17Å; A677-M796 HydrophobicContact CB-CB 4.43Å; A677-M796 HydrophobicContact CB-CG 3.78Å; A677-M796 HydrophobicContact CB-SD 3.9Å
678	A	91.4	Very high	76.6	Confident	12 Å²	12	47.3 Å²	47.3	10%	0.099	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-156.3	151.9	176.3	0	0	0	0	0	111	T604 L606 I626 I732 L733	T604-A678 HydrophobicContact CG2-CB 3.7Å; L606-A678 HydrophobicContact CD2-CB 3.49Å; L606-A678 VanDerWaalsContact CD2-CB 3.49Å; I626-A678 HydrophobicContact CD1-CB 3.83Å; A678-I732 CarbonylContact C-O 3.46Å; A678-I732 VanDerWaalsContact CA-O 3.22Å; A678-I732 WeakPolarHBondContact CA-O 3.23Å; A678-L733 HydrophobicContact CB-CD2 3.49Å; A678-L733 VanDerWaalsContact CB-CD2 3.49Å
679	V	90.8	Very high	74.2	Confident	9 Å²	9	50.4 Å²	50.4	6%	0.055	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	141.7	-179.5	63.3	0	0	0	0	110.9	V681 V731 I732 M796 V803	V679-V681 HydrophobicContact CG1-CG2 4.2Å; V679-V731 WeakPolarHBondContact O-CA 3.39Å; V679-I732 HydrophobicContact CG1-CB 4.03Å; V679-I732 HydrophobicContact CG1-CG1 4.49Å; V679-I732 PolarHBondContact N-O 3.39Å; V679-I732 PolarHBondContact O-N 2.84Å; V679-M796 HydrophobicContact CB-CB 3.84Å; V679-M796 HydrophobicContact CG1-CB 3.94Å; V679-M796 HydrophobicContact CG1-CE 3.74Å; V679-M796 HydrophobicContact CG1-SD 4.4Å; V679-V803 HydrophobicContact CG1-CG1 4.32Å
680	Y	88.5	Confident	71.7	Confident	42 Å²	42	55.1 Å²	55.1	17%	0.165	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	128.4	164.4	171	-103.8	0	0	0	109.5	V608 P609 K682 C730 V731 S798	V608-Y680 HydrophobicContact CB-CD2 4.48Å; V608-Y680 HydrophobicContact CG1-CD2 3.67Å; V608-Y680 HydrophobicContact CG1-CE2 3.72Å; V608-Y680 HydrophobicContact CG1-CG 4.45Å; V608-Y680 HydrophobicContact CG2-CD2 4.4Å; P609-Y680 HydrophobicContact CG-CD1 4.39Å; P609-Y680 HydrophobicContact CG-CE1 3.57Å; P609-Y680 HydrophobicContact CG-CE2 4.46Å; P609-Y680 WeakPolarHBondContact CG-OH 3.45Å; Y680-K682 HydrophobicContact CE1-CB 4.01Å; Y680-C730 WeakPolarHBondContact CA-O 3.38Å; Y680-C730 WeakPolarHBondContact CD2-O 3.48Å; Y680-V731 HydrophobicContact CD2-CG2 4.12Å; Y680-S798 WeakPolarHBondContact O-CB 3.22Å; Y680-S798 PolarHBondContact O-OG 2.85Å
681	V	86.7	Confident	69.6	Low	0 Å²	0	57.6 Å²	57.6	0%	0	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	118.8	178	-167.1	0	0	0	0	108.1	V679 G729 C730 I732 V803 W821	V679-V681 HydrophobicContact CG1-CG2 4.2Å; V681-G729 CarbonylContact O-C 3.59Å; V681-G729 WeakPolarHBondContact O-CA 3.44Å; V681-C730 PolarHBondContact N-O 3.18Å; V681-C730 PolarHBondContact O-N 3.36Å; V681-I732 HydrophobicContact CG2-CD1 3.84Å; V681-I732 HydrophobicContact CG2-CG1 4.08Å; V681-V803 HydrophobicContact CB-CG2 4.37Å; V681-V803 HydrophobicContact CG1-CG2 3.8Å; V681-V803 HydrophobicContact CG2-CG2 3.6Å; V681-W821 HydrophobicContact CG1-CB 3.85Å; V681-W821 HydrophobicContact CG1-CG 4.01Å
682	K	77.6	Confident	67.7	Low	98 Å²	98	56.3 Å²	56.3	43%	0.426	36%	0.358	S	S	.	.			trans	-77.5	139.1	177.6	-174.7	-178	174.7	-168.8	0	108.8	Y680 T684 N801	Y680-K682 HydrophobicContact CE1-CB 4.01Å; K682-T684 HydrophobicContact CD-CG2 4.14Å; K682-T684 HydrophobicContact CG-CG2 4.33Å; K682-N801 PolarHBondContact O-OD1 2.87Å
683	Y	71.4	Confident	65.5	Low	67 Å²	67	63.2 Å²	63.2	26%	0.263	38%	0.38	S	S	.	.			trans	-82.5	123.3	165.6	-177.4	-89.9	0	0	0	109.5	A685 P822	Y683-A685 HydrophobicContact CE1-CB 4.34Å; Y683-P822 HydrophobicContact CD2-CG 3.82Å; Y683-P822 HydrophobicContact CE2-CG 3.52Å
684	T	62.7	Low	63.4	Low	29 Å²	29	68.9 Å²	68.9	18%	0.178	41%	0.41	C	S	.	.			trans	-118.6	135.7	165.2	60.3	0	0	0	0	109.8	K682 S686 D800 N801	K682-T684 HydrophobicContact CD-CG2 4.14Å; K682-T684 HydrophobicContact CG-CG2 4.33Å; T684-S686 PolarHBondContact O-N 2.5Å; T684-S686 PolarHBondContact OG1-OG 2.96Å; T684-D800 HydrophobicContact CG2-CB 4.35Å; T684-N801 PolarHBondContact N-OD1 2.9Å; T684-N801 PolarHBondContact O-ND2 2.9Å; T684-N801 PolarHBondContact O-OD1 2.88Å; T684-N801 PolarHBondContact OG1-ND2 3.08Å; T684-N801 VanDerWaalsContact OG1-ND2 3.13Å; T684-N801 PolarHBondContact OG1-OD1 3.02Å
685	A	51.2	Low	61.4	Low	95 Å²	95	70.9 Å²	70.9	79%	0.785	42%	0.424	S	S	*	.			trans	-75.6	65.9	176.9	0	0	0	0	0	111.1	Y683	Y683-A685 HydrophobicContact CE1-CB 4.34Å
686	S	49.6	Very low	59.3	Low	69 Å²	69	76.3 Å²	76.3	48%	0.483	46%	0.461	S	S	.	.			trans	-91.7	135.8	-178.6	-53.5	0	0	0	0	110.4	T684 A688	T684-S686 PolarHBondContact O-N 2.5Å; T684-S686 PolarHBondContact OG1-OG 2.96Å; S686-A688 PolarHBondContact O-N 2.89Å
687	T	40.8	Very low	57.7	Low	125 Å²	125	81.3 Å²	81.3	77%	0.767	49%	0.487	S	S	*	.			trans	-56.1	128.9	178.5	-38.7	0	0	0	0	110.6	L689	T687-L689 PolarHBondContact O-N 2.9Å
688	A	35.8	Very low	56.4	Low	68 Å²	68	85.3 Å²	85.3	56%	0.562	50%	0.504	S	S	*	.			trans	-67.3	104.4	179.3	0	0	0	0	0	110.5	S686 T824	S686-A688 PolarHBondContact O-N 2.89Å; A688-T824 HydrophobicContact CB-CG2 4.31Å
689	L	34.5	Very low	55.7	Low	128 Å²	128	89.9 Å²	89.9	67%	0.67	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-73.2	154.8	164.1	-92.2	70.9	0	0	0	109.8	T687 S691	T687-L689 PolarHBondContact O-N 2.9Å; L689-S691 PolarHBondContact O-N 2.83Å
690	S	36.5	Very low	55.2	Low	112 Å²	112	93.2 Å²	93.2	78%	0.783	54%	0.536	S	S	*	.	P	Polyproline II helix	trans	-57.8	134.4	176.2	49	0	0	0	0	111.5
691	S	38.9	Very low	54.9	Low	103 Å²	103	91.2 Å²	91.2	72%	0.72	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-51.8	137.9	166.8	51.2	0	0	0	0	110.8	L689	L689-S691 PolarHBondContact O-N 2.83Å
692	P	41.1	Very low	54.9	Low	110 Å²	110	93.6 Å²	93.6	71%	0.714	54%	0.539	S	S	*	.	P	Polyproline II helix	trans	-60.8	139.8	178.3	25.9	-34.3	0	0	0	110.9	L694	P692-L694 PolarHBondContact O-N 2.88Å
693	E	35.7	Very low	55.3	Low	182 Å²	182	89 Å²	89	85%	0.85	52%	0.519	S	S	*	.	P	Polyproline II helix	trans	-64.7	130.1	178.8	-65.8	-170.9	134.3	0	0	110.8	T695	E693-T695 PolarHBondContact O-N 3.11Å
694	L	44.2	Very low	56	Low	119 Å²	119	86.5 Å²	86.5	62%	0.623	51%	0.511	S	S	*	.			trans	-76.4	87.3	-178.1	-66.6	169.3	0	0	0	110.6	P692 Y700	P692-L694 PolarHBondContact O-N 2.88Å; L694-Y700 HydrophobicContact CD2-CD1 4.23Å; L694-Y700 HydrophobicContact CD2-CE1 3.41Å; L694-Y700 VanDerWaalsContact CD2-CE1 3.41Å
695	T	45	Very low	57.1	Low	78 Å²	78	85.1 Å²	85.1	48%	0.479	50%	0.502	S	S	.	.			trans	-70.2	144.2	172.8	59.2	0	0	0	0	111.3	E693 N697 H698 Y700	E693-T695 PolarHBondContact O-N 3.11Å; T695-N697 PolarHBondContact O-N 2.75Å; T695-H698 PolarHBondContact OG1-CD2 2.98Å; T695-Y700 PolarHBondContact O-OH 3.33Å
696	S	47.1	Very low	58.6	Low	114 Å²	114	82.7 Å²	82.7	80%	0.797	48%	0.476	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-2.5	-165.5	52.7	0	0	0	0	117.2
697	N	53.8	Low	59.7	Low	140 Å²	140	81 Å²	81	75%	0.749	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-116.2	9.5	-160.4	-63.8	12	0	0	0	114.2	T695	T695-N697 PolarHBondContact O-N 2.75Å
698	H	61.9	Low	60.9	Low	91 Å²	91	78 Å²	78	42%	0.421	44%	0.441	S	S	.	.	S	Bend	trans	-104.2	151.4	175.8	-67.8	-56	0	0	0	111.9	T695 Y700	T695-H698 PolarHBondContact OG1-CD2 2.98Å; H698-Y700 HydrophobicContact CB-CE1 4.46Å; H698-Y700 HydrophobicContact CB-CE2 4.21Å; H698-Y700 WeakPolarHBondContact O-CD2 3.32Å; H698-Y700 VanDerWaalsContact O-CE2 3.22Å; H698-Y700 WeakPolarHBondContact O-CE2 3.35Å
699	E	75.1	Confident	61.6	Low	109 Å²	109	81.3 Å²	81.3	51%	0.509	45%	0.445	S	S	.	.			trans	-70.5	145	165.2	-62.9	-167.2	129.5	0	0	109.6	L854 N856	E699-L854 HydrophobicContact CB-CB 4Å; E699-L854 HydrophobicContact CB-CD2 4.18Å; E699-L854 WeakPolarHBondContact O-CB 3.39Å; E699-L854 PolarHBondContact O-N 3.01Å; E699-N856 PolarHBondContact OE2-ND2 2.83Å
700	Y	80.4	Confident	62.2	Low	78 Å²	78	79.7 Å²	79.7	31%	0.306	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	134.1	-177.1	-69.3	-71.1	0	0	0	110.5	L694 T695 H698 H852 K853	L694-Y700 HydrophobicContact CD2-CD1 4.23Å; L694-Y700 HydrophobicContact CD2-CE1 3.41Å; L694-Y700 VanDerWaalsContact CD2-CE1 3.41Å; T695-Y700 PolarHBondContact O-OH 3.33Å; H698-Y700 HydrophobicContact CB-CE1 4.46Å; H698-Y700 HydrophobicContact CB-CE2 4.21Å; H698-Y700 WeakPolarHBondContact O-CD2 3.32Å; H698-Y700 VanDerWaalsContact O-CE2 3.22Å; H698-Y700 WeakPolarHBondContact O-CE2 3.35Å; Y700-H852 WeakPolarHBondContact CA-O 3.43Å; Y700-K853 HydrophobicContact CE1-CB 4.49Å
701	I	83.9	Confident	62.6	Low	1 Å²	1	79 Å²	79	1%	0.005	43%	0.425	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	144.4	166.5	-162.4	164.5	0	0	0	109.9	F703 T786 L791 L807 V817 K851 H852 L854	I701-F703 HydrophobicContact CD1-CE1 3.98Å; I701-F703 HydrophobicContact CG1-CD1 4.49Å; I701-F703 HydrophobicContact CG1-CE1 4.21Å; I701-F703 HydrophobicContact CG2-CE1 4.03Å; I701-F703 HydrophobicContact CG2-CZ 4.15Å; I701-T786 HydrophobicContact CD1-CG2 3.72Å; I701-L791 HydrophobicContact CD1-CD1 3.57Å; I701-L791 HydrophobicContact CG1-CD1 4.5Å; I701-L807 HydrophobicContact CD1-CD1 3.4Å; I701-V817 HydrophobicContact CG2-CG1 3.98Å; I701-V817 HydrophobicContact CG2-CG2 3.79Å; I701-K851 WeakPolarHBondContact O-CA 2.96Å; I701-H852 HydrophobicContact CG2-CB 4.05Å; I701-H852 PolarHBondContact N-O 2.74Å; I701-H852 PolarHBondContact O-N 2.67Å; I701-L854 HydrophobicContact CB-CD1 4.39Å
702	E	84.8	Confident	62.4	Low	50 Å²	50	80.2 Å²	80.2	23%	0.234	42%	0.423	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	126.5	174.3	-165.1	176.2	-113.7	0	0	109.8	N787 Q849 T850 K851	E702-N787 HydrophobicContact CB-CB 4.27Å; E702-N787 WeakPolarHBondContact CG-ND2 3.43Å; E702-N787 WeakPolarHBondContact O-CB 3.15Å; E702-N787 PolarHBondContact O-N 2.91Å; E702-N787 PolarHBondContact OE2-ND2 2.84Å; E702-Q849 HydrophobicContact CG-CB 4.41Å; E702-T850 CarbonylContact C-O 3.57Å; E702-T850 VanDerWaalsContact CA-O 3.26Å; E702-T850 WeakPolarHBondContact CA-O 3.03Å; E702-K851 HydrophobicContact CB-CG 4.44Å; E702-K851 HydrophobicContact CG-CG 4.18Å; E702-K851 WeakPolarHBondContact OE1-CE 3.31Å; E702-K851 IonicContact OE1-NZ 2.67Å; E702-K851 PolarHBondContact OE1-NZ 3.18Å
703	F	87	Confident	62	Low	0 Å²	0	79.1 Å²	79.1	0%	0	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	129.6	170.9	-60.4	-33.5	0	0	0	109.1	I701 W705 F784 N785 T786 V817 F819 Q849 T850 H852	I701-F703 HydrophobicContact CD1-CE1 3.98Å; I701-F703 HydrophobicContact CG1-CD1 4.49Å; I701-F703 HydrophobicContact CG1-CE1 4.21Å; I701-F703 HydrophobicContact CG2-CE1 4.03Å; I701-F703 HydrophobicContact CG2-CZ 4.15Å; F703-W705 HydrophobicContact CD2-CZ2 4.01Å; F703-F784 HydrophobicContact CB-CD2 4.19Å; F703-F784 HydrophobicContact CD1-CD2 4.3Å; F703-F784 HydrophobicContact CD1-CE2 4.43Å; F703-F784 HydrophobicContact CD2-CD2 4.26Å; F703-F784 HydrophobicContact CD2-CE2 4.17Å; F703-F784 HydrophobicContact CE1-CE2 4.49Å; F703-F784 HydrophobicContact CE2-CE2 4.24Å; F703-F784 HydrophobicContact CG-CD2 4.02Å; F703-F784 HydrophobicContact CG-CE2 4.28Å; F703-F784 HydrophobicContact CZ-CE2 4.4Å; F703-N785 WeakPolarHBondContact CA-O 3.26Å; F703-T786 HydrophobicContact CD1-CG2 4.28Å; F703-T786 HydrophobicContact CE1-CG2 3.95Å; F703-V817 HydrophobicContact CE2-CG1 4.19Å; F703-V817 HydrophobicContact CZ-CB 4.47Å; F703-V817 HydrophobicContact CZ-CG1 3.9Å; F703-F819 HydrophobicContact CE2-CD1 4.14Å; F703-F819 HydrophobicContact CE2-CE1 4.02Å; F703-Q849 WeakPolarHBondContact O-CA 3.48Å; F703-T850 PolarHBondContact N-O 2.97Å; F703-T850 PolarHBondContact O-N 2.81Å; F703-H852 AromaticContact CD2-CD2 3.35Å; F703-H852 WeakPolarHBondContact CD2-CD2 3.45Å; F703-H852 AromaticContact CD2-NE2 3.59Å; F703-H852 AromaticContact CE2-CD2 3.57Å
704	T	86.2	Confident	61.6	Low	15 Å²	15	75.3 Å²	75.3	9%	0.092	41%	0.412	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	123.7	166.1	-55	0	0	0	0	108.6	F784 N785 N787 K847 Q849	T704-F784 WeakPolarHBondContact O-CA 3.41Å; T704-F784 VanDerWaalsContact O-CB 3.31Å; T704-F784 WeakPolarHBondContact O-CB 3.41Å; T704-N785 PolarHBondContact N-O 3.25Å; T704-N785 PolarHBondContact O-N 2.84Å; T704-N785 VanDerWaalsContact O-N 3.11Å; T704-N785 PolarHBondContact O-OD1 2.93Å; T704-N787 VanDerWaalsContact OG1-CG 3.32Å; T704-N787 PolarHBondContact OG1-ND2 2.89Å; T704-N787 PolarHBondContact OG1-OD1 2.91Å; T704-K847 HydrophobicContact CG2-CB 4.47Å; T704-Q849 HydrophobicContact CG2-CG 4.24Å; T704-Q849 PolarHBondContact OG1-NE2 2.71Å
705	W	86.4	Confident	61	Low	0 Å²	0	75.2 Å²	75.2	0%	0	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.2	123.9	-178.5	-59	78	0	0	0	110	F703 V742 F784 F819 W821 L823 K847 I848 T850	F703-W705 HydrophobicContact CD2-CZ2 4.01Å; W705-V742 HydrophobicContact CZ3-CG2 4.47Å; W705-F784 HydrophobicContact CB-CB 4.45Å; W705-F784 HydrophobicContact CD2-CB 3.76Å; W705-F784 HydrophobicContact CD2-CD1 4.37Å; W705-F784 HydrophobicContact CD2-CG 4.13Å; W705-F784 HydrophobicContact CE3-CB 3.76Å; W705-F784 AromaticContact CE3-CD1 3.7Å; W705-F784 HydrophobicContact CE3-CD1 3.7Å; W705-F784 AromaticContact CE3-CG 3.91Å; W705-F784 HydrophobicContact CE3-CG 3.91Å; W705-F784 HydrophobicContact CG-CB 4.08Å; W705-F784 AromaticContact CH2-CD1 3.64Å; W705-F784 HydrophobicContact CH2-CD1 3.64Å; W705-F784 HydrophobicContact CH2-CD2 4.36Å; W705-F784 AromaticContact CH2-CE1 3.68Å; W705-F784 HydrophobicContact CH2-CE1 3.68Å; W705-F784 HydrophobicContact CH2-CE2 4.39Å; W705-F784 AromaticContact CH2-CG 4Å; W705-F784 HydrophobicContact CH2-CG 4Å; W705-F784 HydrophobicContact CH2-CZ 4.06Å; W705-F784 HydrophobicContact CZ2-CD1 4.34Å; W705-F784 HydrophobicContact CZ2-CD2 4.34Å; W705-F784 HydrophobicContact CZ2-CG 4.23Å; W705-F784 HydrophobicContact CZ3-CB 4.23Å; W705-F784 AromaticContact CZ3-CD1 3.29Å; W705-F784 HydrophobicContact CZ3-CD1 3.29Å; W705-F784 AromaticContact CZ3-CE1 3.67Å; W705-F784 HydrophobicContact CZ3-CE1 3.67Å; W705-F784 AromaticContact CZ3-CG 3.84Å; W705-F784 HydrophobicContact CZ3-CG 3.84Å; W705-F784 HydrophobicContact CZ3-CZ 4.49Å; W705-F819 HydrophobicContact CH2-CE2 4.35Å; W705-W821 HydrophobicContact CH2-CZ3 4.14Å; W705-W821 AromaticContact CZ3-CZ3 3.97Å; W705-W821 HydrophobicContact CZ3-CZ3 3.97Å; W705-L823 HydrophobicContact CH2-CD1 3.48Å; W705-L823 VanDerWaalsContact CH2-CD1 3.48Å; W705-L823 HydrophobicContact CZ2-CD1 3.53Å; W705-L823 HydrophobicContact CZ3-CD1 4Å; W705-K847 CarbonylContact O-C 3.57Å; W705-K847 VanDerWaalsContact O-CA 3.31Å; W705-K847 WeakPolarHBondContact O-CA 3.38Å; W705-I848 HydrophobicContact CB-CB 4.43Å; W705-I848 PolarHBondContact N-O 3.21Å; W705-I848 PolarHBondContact O-N 3.27Å; W705-T850 PolarHBondContact NE1-OG1 3.12Å
706	D	82.6	Confident	60	Low	45 Å²	45	79.5 Å²	79.5	24%	0.241	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	119.9	172.7	-69.5	7.5	0	0	0	108.7	R783 K847	D706-R783 HydrophobicContact CB-CB 4.42Å; D706-R783 PolarHBondContact N-O 3.43Å; D706-R783 PolarHBondContact O-N 2.85Å; D706-K847 WeakPolarHBondContact OD1-CG 3.19Å; D706-K847 IonicContact OD1-NZ 3.48Å; D706-K847 PolarHBondContact OD1-NZ 2.75Å; D706-K847 IonicContact OD2-NZ 2.68Å; D706-K847 PolarHBondContact OD2-NZ 2.93Å
707	I	72.6	Confident	59.1	Low	34 Å²	34	79 Å²	79	17%	0.174	44%	0.437	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	134.2	176.4	-54.9	179.3	0	0	0	109.4	Y782 M826 N846 I848	I707-Y782 HydrophobicContact CB-CD1 4.46Å; I707-Y782 HydrophobicContact CG1-CD1 4.13Å; I707-Y782 HydrophobicContact CG1-CE1 4.11Å; I707-Y782 HydrophobicContact CG2-CD1 4.41Å; I707-Y782 HydrophobicContact CG2-CE1 4.13Å; I707-M826 HydrophobicContact CD1-CE 3.85Å; I707-M826 HydrophobicContact CG1-CE 4.18Å; I707-N846 HydrophobicContact CB-CB 4.48Å; I707-N846 PolarHBondContact N-O 3.31Å; I707-I848 HydrophobicContact CD1-CD1 3.94Å
708	N	66.4	Low	57.9	Low	60 Å²	60	81.3 Å²	81.3	32%	0.321	45%	0.446	S	S	.	.			trans	-86.6	111	178.2	-162.6	16.1	0	0	0	110.8	S710 Y711 I780 I781	N708-S710 PolarHBondContact ND2-OG 2.84Å; N708-S710 PolarHBondContact O-N 3.13Å; N708-Y711 PolarHBondContact O-N 3.37Å; N708-I780 PolarHBondContact ND2-O 2.84Å; N708-I781 WeakPolarHBondContact CB-O 3.38Å; N708-I781 PolarHBondContact N-O 3.2Å
709	E	49.5	Very low	56.4	Low	139 Å²	139	83.5 Å²	83.5	65%	0.65	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-61.8	-15.2	-174.2	-69.2	-178.8	134.6	0	0	114.4	Y711 D712 N846	E709-Y711 PolarHBondContact O-N 3.49Å; E709-D712 PolarHBondContact O-N 3.5Å; E709-N846 VanDerWaalsContact CG-ND2 3.3Å; E709-N846 WeakPolarHBondContact CG-ND2 3.32Å; E709-N846 PolarHBondContact OE1-ND2 3.16Å
710	S	47.2	Very low	54.2	Low	94 Å²	94	86.1 Å²	86.1	66%	0.657	47%	0.473	S	S	*	.	G	3₁₀ helix	trans	-64.6	-0.1	174.2	65.1	0	0	0	0	114.6	N708	N708-S710 PolarHBondContact ND2-OG 2.84Å; N708-S710 PolarHBondContact O-N 3.13Å
711	Y	44.6	Very low	52.2	Low	97 Å²	97	86.1 Å²	86.1	38%	0.38	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-91.4	11.2	176.2	-131.3	-85.1	0	0	0	113.8	N708 E709 K744 I781	N708-Y711 PolarHBondContact O-N 3.37Å; E709-Y711 PolarHBondContact O-N 3.49Å; Y711-K744 WeakPolarHBondContact OH-CD 3.32Å; Y711-I781 HydrophobicContact CD2-CG2 3.9Å; Y711-I781 HydrophobicContact CE2-CG1 4.37Å; Y711-I781 HydrophobicContact CE2-CG2 3.96Å; Y711-I781 HydrophobicContact CG-CG2 4.42Å
712	D	34.7	Very low	50.2	Low	129 Å²	129	88.9 Å²	88.9	69%	0.69	50%	0.496	S	S	*	.			trans	-77.1	132.6	-175.4	-159.5	4.6	0	0	0	113.9	E709 S714	E709-D712 PolarHBondContact O-N 3.5Å; D712-S714 PolarHBondContact O-N 2.8Å
713	S	32.6	Very low	47.9	Very low	86 Å²	86	88.6 Å²	88.6	60%	0.601	50%	0.498	S	S	*	.			trans	-86.6	79.4	-163.7	59.5	0	0	0	0	113.1
714	S	28.3	Very low	45.7	Very low	103 Å²	103	91.2 Å²	91.2	72%	0.72	51%	0.512	S	S	*	.			trans	-116.2	39.5	179	56.9	0	0	0	0	114	D712 N716	D712-S714 PolarHBondContact O-N 2.8Å; S714-N716 PolarHBondContact O-N 2.79Å
715	S	30	Very low	43.7	Very low	116 Å²	116	99.7 Å²	99.7	81%	0.811	55%	0.548	S	S	*	.			trans	-71.8	66.6	-179.5	63.4	0	0	0	0	113.8
716	N	26	Very low	41.6	Very low	169 Å²	169	105.9 Å²	105.9	90%	0.904	58%	0.581	S	S	*	*			trans	-119	44.9	172.5	-101.6	-14.7	0	0	0	110.7	S714	S714-N716 PolarHBondContact O-N 2.79Å
717	S	28.1	Very low	40	Very low	102 Å²	102	109.6 Å²	109.6	71%	0.713	60%	0.601	S	S	*	*	S	Bend	trans	-148.6	154.2	168.7	64.3	0	0	0	0	111.3	N719	S717-N719 PolarHBondContact O-N 2.88Å
718	M	28.2	Very low	39.6	Very low	190 Å²	190	109.1 Å²	109.1	94%	0.936	60%	0.599	S	S	*	*	S	Bend	trans	-79.2	69.7	-165.6	-68.8	-84.3	-158.5	0	0	113.6
719	N	29.1	Very low	40	Very low	137 Å²	137	106.6 Å²	106.6	73%	0.733	59%	0.587	S	S	*	*			trans	-148.5	107.7	166.2	-84	-50	0	0	0	110.4	S717 T721	S717-N719 PolarHBondContact O-N 2.88Å; N719-T721 PolarHBondContact O-N 2.97Å; N719-T721 VanDerWaalsContact O-N 3.1Å
720	E	29.4	Very low	41.7	Very low	163 Å²	163	100.1 Å²	100.1	76%	0.762	56%	0.557	S	S	*	*			trans	-77.9	96.3	-172.1	-65.8	-169.4	134.3	0	0	113.1	I722	E720-I722 PolarHBondContact O-N 2.84Å
721	T	38.9	Very low	43.8	Very low	79 Å²	79	95.8 Å²	95.8	49%	0.485	53%	0.526	S	S	.	.	B	Isolated β-bridge	trans	-86.3	103.9	168.1	-51.4	0	0	0	0	109.4	N719 C723	N719-T721 PolarHBondContact O-N 2.97Å; N719-T721 VanDerWaalsContact O-N 3.1Å; T721-C723 VanDerWaalsContact C-N 3.31Å; T721-C723 PolarHBondContact O-N 2.81Å
722	I	40.6	Very low	46	Very low	59 Å²	59	91.1 Å²	91.1	30%	0.303	51%	0.508	S	S	.	.			trans	-80.9	78.8	-175.5	-51.7	-176.9	0	0	0	110.3	L613 E720 N724 Y747 M749	L613-I722 HydrophobicContact CD2-CD1 4.11Å; L613-I722 HydrophobicContact CD2-CG2 4.19Å; E720-I722 PolarHBondContact O-N 2.84Å; I722-N724 PolarHBondContact O-N 3.12Å; I722-Y747 PolarHBondContact N-O 3.44Å; I722-Y747 VanDerWaalsContact N-O 3.14Å; I722-M749 HydrophobicContact CD1-CE 4.17Å; I722-M749 HydrophobicContact CD1-CG 3.69Å; I722-M749 HydrophobicContact CG1-CG 4.13Å
723	C	38.4	Very low	48.8	Very low	43 Å²	43	85 Å²	85	29%	0.291	48%	0.475	S	S	.	.			trans	-75.7	100.8	166.2	-73.3	0	0	0	0	109.9	T721 K725	T721-C723 VanDerWaalsContact C-N 3.31Å; T721-C723 PolarHBondContact O-N 2.81Å; C723-K725 PolarHBondContact O-N 3.33Å
724	N	38.9	Very low	51.7	Low	56 Å²	56	80.9 Å²	80.9	30%	0.299	45%	0.447	S	S	.	.			trans	-64.2	99.4	176.7	-101.3	-23.7	0	0	0	110.5	I722 N726	I722-N724 PolarHBondContact O-N 3.12Å; N724-N726 PolarHBondContact O-N 3.39Å; N724-N726 VanDerWaalsContact O-N 3.09Å
725	K	44.3	Very low	54.6	Low	192 Å²	192	76 Å²	76	84%	0.835	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.1	-17.2	-170.2	-66.5	-170.4	177.2	-177	0	114.6	C723	C723-K725 PolarHBondContact O-N 3.33Å
726	N	42.5	Very low	57.4	Low	131 Å²	131	73.7 Å²	73.7	70%	0.701	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.5	-2.5	-160	-64.8	3	0	0	0	116.5	N724	N724-N726 PolarHBondContact O-N 3.39Å; N724-N726 VanDerWaalsContact O-N 3.09Å
727	N	49	Very low	60.2	Low	123 Å²	123	69.4 Å²	69.4	66%	0.658	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-147.7	-3	-174.7	-96.5	-36.7	0	0	0	117	G729	N727-G729 PolarHBondContact O-N 3.39Å
728	D	64.4	Low	63	Low	24 Å²	24	64.6 Å²	64.6	13%	0.128	34%	0.335	C	S	.	.			trans	-82.9	117.5	-173.8	-65.4	-33.2	0	0	0	112.7	K744	D728-K744 WeakPolarHBondContact OD2-CE 3.29Å; D728-K744 IonicContact OD2-NZ 2.61Å; D728-K744 PolarHBondContact OD2-NZ 3.48Å
729	G	75	Confident	65.9	Low	6 Å²	6	58.7 Å²	58.7	6%	0.062	30%	0.302	C	S	.	.			trans	-73.5	174.7	166.9	0	0	0	0	0	113.8	V681 N727	V681-G729 CarbonylContact O-C 3.59Å; V681-G729 WeakPolarHBondContact O-CA 3.44Å; N727-G729 PolarHBondContact O-N 3.39Å
730	C	86.3	Confident	68.9	Low	4 Å²	4	52.3 Å²	52.3	3%	0.027	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	163.1	-179.3	71.1	0	0	0	0	112.8	Y680 V681 V742 F743 W821	Y680-C730 WeakPolarHBondContact CA-O 3.38Å; Y680-C730 WeakPolarHBondContact CD2-O 3.48Å; V681-C730 PolarHBondContact N-O 3.18Å; V681-C730 PolarHBondContact O-N 3.36Å; C730-V742 HydrophobicContact CB-CG1 3.95Å; C730-F743 CarbonylContact C-O 3.53Å; C730-F743 VanDerWaalsContact CA-O 3.3Å; C730-F743 WeakPolarHBondContact CA-O 3.43Å; C730-F743 WeakPolarHBondContact CB-O 3.46Å; C730-W821 VanDerWaalsContact SG-CE2 3.58Å; C730-W821 PolarHBondContact SG-NE1 3.39Å
731	V	89.5	Confident	71.9	Confident	2 Å²	2	44.6 Å²	44.6	1%	0.012	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	123.9	169.2	179.2	0	0	0	0	108.3	L606 V608 W624 V679 Y680 L733 F743	L606-V731 HydrophobicContact CD1-CG1 4.37Å; L606-V731 HydrophobicContact CD1-CG2 4.36Å; L606-V731 HydrophobicContact CD2-CG1 4.18Å; V608-V731 HydrophobicContact CG1-CG2 4.46Å; V608-V731 HydrophobicContact CG2-CG2 3.71Å; W624-V731 HydrophobicContact CD2-CG2 4.44Å; W624-V731 HydrophobicContact CE3-CB 4.49Å; W624-V731 HydrophobicContact CE3-CG1 4.08Å; W624-V731 HydrophobicContact CE3-CG2 4.38Å; W624-V731 HydrophobicContact CH2-CB 4.25Å; W624-V731 HydrophobicContact CH2-CG2 4.13Å; W624-V731 HydrophobicContact CZ2-CG2 4.19Å; W624-V731 HydrophobicContact CZ3-CB 4.1Å; W624-V731 HydrophobicContact CZ3-CG1 4.02Å; W624-V731 HydrophobicContact CZ3-CG2 4.23Å; V679-V731 WeakPolarHBondContact O-CA 3.39Å; Y680-V731 HydrophobicContact CD2-CG2 4.12Å; V731-L733 HydrophobicContact CG1-CD2 3.81Å; V731-F743 HydrophobicContact CB-CB 4.47Å; V731-F743 PolarHBondContact N-O 3.01Å; V731-F743 PolarHBondContact O-N 2.92Å
732	I	92.1	Very high	74.3	Confident	0 Å²	0	40.9 Å²	40.9	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	124	173.1	-47.6	179.8	0	0	0	108.1	A678 V679 V681 F740 L741 V742 F784 M796 V803	A678-I732 CarbonylContact C-O 3.46Å; A678-I732 VanDerWaalsContact CA-O 3.22Å; A678-I732 WeakPolarHBondContact CA-O 3.23Å; V679-I732 HydrophobicContact CG1-CB 4.03Å; V679-I732 HydrophobicContact CG1-CG1 4.49Å; V679-I732 PolarHBondContact N-O 3.39Å; V679-I732 PolarHBondContact O-N 2.84Å; V681-I732 HydrophobicContact CG2-CD1 3.84Å; V681-I732 HydrophobicContact CG2-CG1 4.08Å; I732-F740 HydrophobicContact CG2-CB 4.43Å; I732-F740 HydrophobicContact CG2-CD1 4.25Å; I732-L741 WeakPolarHBondContact CA-O 3.4Å; I732-V742 HydrophobicContact CG1-CG1 4.4Å; I732-V742 HydrophobicContact CG1-CG2 4.25Å; I732-V742 HydrophobicContact CG2-CG2 4.32Å; I732-F784 HydrophobicContact CG2-CE1 4.05Å; I732-F784 HydrophobicContact CG2-CZ 4.29Å; I732-M796 HydrophobicContact CB-CE 4.06Å; I732-M796 HydrophobicContact CG2-CE 3.76Å; I732-V803 HydrophobicContact CD1-CG1 4.28Å; I732-V803 HydrophobicContact CD1-CG2 4.21Å
733	L	93.3	Very high	76.6	Confident	0 Å²	0	38.3 Å²	38.3	0%	0	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	145.2	169.2	-50.2	-173.4	0	0	0	109.5	I626 V652 L669 F673 A678 V731 F740 L741 F743	I626-L733 HydrophobicContact CD1-CD2 3.7Å; I626-L733 HydrophobicContact CG1-CD2 4.06Å; I626-L733 HydrophobicContact CG2-CD2 4.41Å; V652-L733 HydrophobicContact CG2-CD1 3.88Å; L669-L733 HydrophobicContact CD1-CD1 3.9Å; L669-L733 HydrophobicContact CD2-CD1 3.94Å; F673-L733 HydrophobicContact CE1-CB 4.2Å; F673-L733 HydrophobicContact CZ-CB 4.28Å; A678-L733 HydrophobicContact CB-CD2 3.49Å; A678-L733 VanDerWaalsContact CB-CD2 3.49Å; V731-L733 HydrophobicContact CG1-CD2 3.81Å; L733-F740 CarbonylContact O-C 3.58Å; L733-F740 WeakPolarHBondContact O-CA 3.36Å; L733-L741 PolarHBondContact N-O 3.09Å; L733-L741 PolarHBondContact O-N 2.61Å; L733-F743 HydrophobicContact CD1-CD2 4.18Å; L733-F743 HydrophobicContact CD1-CE2 3.57Å; L733-F743 HydrophobicContact CD1-CZ 4.35Å; L733-F743 HydrophobicContact CG-CD2 4.11Å; L733-F743 HydrophobicContact CG-CE2 3.91Å
734	A	92.4	Very high	78.6	Confident	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.9	145.6	171	0	0	0	0	0	111.3	P675 T676 A677 F740 A793 M796	P675-A734 CarbonylContact C-O 3.57Å; P675-A734 VanDerWaalsContact CA-O 3.29Å; P675-A734 WeakPolarHBondContact CA-O 3.37Å; T676-A734 PolarHBondContact N-O 2.93Å; T676-A734 PolarHBondContact OG1-O 3.02Å; A677-A734 PolarHBondContact O-N 3.17Å; A734-F740 HydrophobicContact CB-CD1 3.55Å; A734-F740 HydrophobicContact CB-CE1 3.38Å; A734-F740 HydrophobicContact CB-CG 4.46Å; A734-F740 HydrophobicContact CB-CZ 4.16Å; A734-A793 HydrophobicContact CB-CB 3.6Å; A734-M796 HydrophobicContact CB-SD 3.69Å
735	S	91.2	Very high	80.2	Confident	1 Å²	1	35 Å²	35	1%	0.007	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.4	170.9	174.9	66.5	0	0	0	0	113.1	L674 T676 D737 G738 R739 V792	L674-S735 CarbonylContact O-C 3.59Å; L674-S735 VanDerWaalsContact O-CA 3.31Å; L674-S735 WeakPolarHBondContact O-CA 3.4Å; T676-S735 PolarHBondContact OG1-O 2.93Å; S735-D737 VanDerWaalsContact CB-OD1 3.32Å; S735-D737 WeakPolarHBondContact CB-OD1 3.29Å; S735-D737 PolarHBondContact O-N 2.91Å; S735-D737 PolarHBondContact OG-N 3.04Å; S735-D737 PolarHBondContact OG-OD1 3.36Å; S735-G738 PolarHBondContact OG-N 3.16Å; S735-R739 PolarHBondContact N-O 3.44Å; S735-R739 WeakPolarHBondContact OG-CB 3.47Å; S735-R739 PolarHBondContact OG-N 3.48Å; S735-R739 PolarHBondContact OG-O 3Å; S735-R739 VanDerWaalsContact OG-O 3.08Å; S735-V792 WeakPolarHBondContact O-CG1 3.31Å
736	N	87.1	Confident	81.2	Confident	67 Å²	67	26 Å²	26	36%	0.358	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.5	-2.9	168.4	74.4	-39.6	0	0	0	114.9	L674 T676 V792	L674-N736 WeakPolarHBondContact CB-OD1 3.34Å; L674-N736 PolarHBondContact O-N 3.27Å; L674-N736 PolarHBondContact O-OD1 3.26Å; T676-N736 HydrophobicContact CG2-CB 3.81Å; N736-V792 VanDerWaalsContact O-CG2 3.32Å; N736-V792 WeakPolarHBondContact O-CG2 3.17Å
737	D	85.6	Confident	82.2	Confident	78 Å²	78	20 Å²	20	42%	0.417	10%	0.102	S	C	.	.	T	Hydrogen-bonded Turn	trans	-121	17.8	-175.6	71.4	-2.4	0	0	0	113.9	S735 R739	S735-D737 VanDerWaalsContact CB-OD1 3.32Å; S735-D737 WeakPolarHBondContact CB-OD1 3.29Å; S735-D737 PolarHBondContact O-N 2.91Å; S735-D737 PolarHBondContact OG-N 3.04Å; S735-D737 PolarHBondContact OG-OD1 3.36Å; D737-R739 VanDerWaalsContact C-N 3.33Å; D737-R739 VanDerWaalsContact CG-NE 3.29Å; D737-R739 PolarHBondContact O-N 3.46Å; D737-R739 WeakPolarHBondContact OD1-CG 3.37Å; D737-R739 IonicContact OD1-CZ 2.74Å; D737-R739 IonicContact OD1-NE 2.89Å; D737-R739 PolarHBondContact OD1-NE 3.45Å; D737-R739 IonicContact OD1-NH2 2.66Å; D737-R739 IonicContact OD2-CZ 3.47Å; D737-R739 VanDerWaalsContact OD2-CZ 3.22Å; D737-R739 IonicContact OD2-NE 3.97Å; D737-R739 PolarHBondContact OD2-NE 3.45Å; D737-R739 IonicContact OD2-NH2 3.72Å; D737-R739 PolarHBondContact OD2-NH2 3.45Å
738	G	86.5	Confident	82.2	Confident	2 Å²	2	15.5 Å²	15.5	2%	0.021	8%	0.081	C	C	.	.	S	Bend	trans	79.5	11.5	174.8	0	0	0	0	0	114.7	S735 N785 T786 L791	S735-G738 PolarHBondContact OG-N 3.16Å; G738-N785 VanDerWaalsContact O-CA 3.31Å; G738-N785 WeakPolarHBondContact O-CA 3.29Å; G738-T786 PolarHBondContact O-N 3.21Å; G738-T786 PolarHBondContact O-OG1 2.89Å; G738-L791 WeakPolarHBondContact CA-O 3.45Å
739	R	90.2	Very high	81.5	Confident	66 Å²	66	16 Å²	16	25%	0.249	8%	0.083	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	151.2	172.3	-63.8	-176.2	-74.8	161.9	-12.9	111.3	G672 F673 S735 D737 N785	G672-R739 VanDerWaalsContact C-NH2 3.3Å; G672-R739 PolarHBondContact O-NH2 2.82Å; F673-R739 HydrophobicContact CD2-CB 4.03Å; F673-R739 HydrophobicContact CE2-CB 3.77Å; S735-R739 PolarHBondContact N-O 3.44Å; S735-R739 WeakPolarHBondContact OG-CB 3.47Å; S735-R739 PolarHBondContact OG-N 3.48Å; S735-R739 PolarHBondContact OG-O 3Å; S735-R739 VanDerWaalsContact OG-O 3.08Å; D737-R739 VanDerWaalsContact C-N 3.33Å; D737-R739 VanDerWaalsContact CG-NE 3.29Å; D737-R739 PolarHBondContact O-N 3.46Å; D737-R739 WeakPolarHBondContact OD1-CG 3.37Å; D737-R739 IonicContact OD1-CZ 2.74Å; D737-R739 IonicContact OD1-NE 2.89Å; D737-R739 PolarHBondContact OD1-NE 3.45Å; D737-R739 IonicContact OD1-NH2 2.66Å; D737-R739 IonicContact OD2-CZ 3.47Å; D737-R739 VanDerWaalsContact OD2-CZ 3.22Å; D737-R739 IonicContact OD2-NE 3.97Å; D737-R739 PolarHBondContact OD2-NE 3.45Å; D737-R739 IonicContact OD2-NH2 3.72Å; D737-R739 PolarHBondContact OD2-NH2 3.45Å; R739-N785 HydrophobicContact CG-CB 4.44Å
740	F	92	Very high	79.9	Confident	2 Å²	2	20 Å²	20	1%	0.009	10%	0.103	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	142.9	178.9	-61.8	-100.5	0	0	0	110.5	I732 L733 A734 R783 F784 T786 A793 M796 I805 L807	I732-F740 HydrophobicContact CG2-CB 4.43Å; I732-F740 HydrophobicContact CG2-CD1 4.25Å; L733-F740 CarbonylContact O-C 3.58Å; L733-F740 WeakPolarHBondContact O-CA 3.36Å; A734-F740 HydrophobicContact CB-CD1 3.55Å; A734-F740 HydrophobicContact CB-CE1 3.38Å; A734-F740 HydrophobicContact CB-CG 4.46Å; A734-F740 HydrophobicContact CB-CZ 4.16Å; F740-R783 WeakPolarHBondContact O-CA 3.18Å; F740-F784 HydrophobicContact CB-CD1 3.63Å; F740-F784 HydrophobicContact CB-CD2 3.92Å; F740-F784 HydrophobicContact CB-CE1 3.39Å; F740-F784 HydrophobicContact CB-CE2 3.69Å; F740-F784 HydrophobicContact CB-CG 3.9Å; F740-F784 HydrophobicContact CB-CZ 3.42Å; F740-F784 VanDerWaalsContact CB-CZ 3.42Å; F740-F784 HydrophobicContact CD1-CE1 4.46Å; F740-F784 HydrophobicContact CD1-CE2 4.01Å; F740-F784 AromaticContact CD1-CZ 3.74Å; F740-F784 HydrophobicContact CD1-CZ 3.74Å; F740-F784 AromaticContact CD2-CD2 3.81Å; F740-F784 HydrophobicContact CD2-CD2 3.81Å; F740-F784 AromaticContact CD2-CE2 3.5Å; F740-F784 HydrophobicContact CD2-CE2 3.5Å; F740-F784 HydrophobicContact CD2-CZ 4.03Å; F740-F784 HydrophobicContact CE2-CE2 4.12Å; F740-F784 HydrophobicContact CG-CD1 4.47Å; F740-F784 AromaticContact CG-CD2 4Å; F740-F784 HydrophobicContact CG-CD2 4Å; F740-F784 HydrophobicContact CG-CE1 4Å; F740-F784 AromaticContact CG-CE2 3.46Å; F740-F784 HydrophobicContact CG-CE2 3.46Å; F740-F784 VanDerWaalsContact CG-CE2 3.46Å; F740-F784 HydrophobicContact CG-CG 4.48Å; F740-F784 AromaticContact CG-CZ 3.46Å; F740-F784 HydrophobicContact CG-CZ 3.46Å; F740-F784 VanDerWaalsContact CG-CZ 3.46Å; F740-F784 PolarHBondContact N-O 3.26Å; F740-F784 PolarHBondContact O-N 3.09Å; F740-T786 HydrophobicContact CE2-CG2 4.14Å; F740-A793 HydrophobicContact CE1-CB 4Å; F740-A793 HydrophobicContact CZ-CB 4.03Å; F740-M796 HydrophobicContact CD1-CE 4.08Å; F740-M796 HydrophobicContact CE1-CE 4.02Å; F740-M796 HydrophobicContact CE1-SD 4.44Å; F740-I805 HydrophobicContact CD1-CD1 4.48Å; F740-I805 HydrophobicContact CE1-CD1 3.88Å; F740-I805 HydrophobicContact CE1-CG2 4.29Å; F740-I805 HydrophobicContact CZ-CD1 4.39Å; F740-I805 HydrophobicContact CZ-CG2 4.39Å; F740-L807 HydrophobicContact CZ-CD2 4.16Å
741	L	91.5	Very high	77.4	Confident	2 Å²	2	24.2 Å²	24.2	1%	0.01	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	128.6	177.5	-62.4	174.7	0	0	0	109.3	L669 F673 I732 L733 F743 R783	L669-L741 HydrophobicContact CD2-CD1 4.17Å; F673-L741 HydrophobicContact CD1-CD1 4.17Å; F673-L741 HydrophobicContact CD2-CD1 3.93Å; F673-L741 HydrophobicContact CD2-CG 4.11Å; F673-L741 HydrophobicContact CE1-CD1 4.05Å; F673-L741 HydrophobicContact CE1-CG 4.47Å; F673-L741 HydrophobicContact CE2-CD1 3.8Å; F673-L741 HydrophobicContact CE2-CD2 4.44Å; F673-L741 HydrophobicContact CE2-CG 3.58Å; F673-L741 HydrophobicContact CG-CD1 4.13Å; F673-L741 HydrophobicContact CZ-CB 4.39Å; F673-L741 HydrophobicContact CZ-CD1 3.86Å; F673-L741 HydrophobicContact CZ-CG 3.79Å; I732-L741 WeakPolarHBondContact CA-O 3.4Å; L733-L741 PolarHBondContact N-O 3.09Å; L733-L741 PolarHBondContact O-N 2.61Å; L741-F743 HydrophobicContact CB-CD2 4.26Å; L741-F743 HydrophobicContact CB-CE2 3.58Å; L741-F743 HydrophobicContact CB-CZ 4.31Å; L741-F743 HydrophobicContact CD1-CE2 4.19Å; L741-F743 HydrophobicContact CD1-CZ 4.27Å; L741-R783 HydrophobicContact CD2-CB 4.2Å; L741-R783 HydrophobicContact CD2-CG 3.72Å
742	V	90.1	Very high	74.7	Confident	0 Å²	0	30.1 Å²	30.1	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	112.6	179.1	-173.4	0	0	0	0	109.8	W705 C730 I732 I780 I781 Y782 F784 W821	W705-V742 HydrophobicContact CZ3-CG2 4.47Å; C730-V742 HydrophobicContact CB-CG1 3.95Å; I732-V742 HydrophobicContact CG1-CG1 4.4Å; I732-V742 HydrophobicContact CG1-CG2 4.25Å; I732-V742 HydrophobicContact CG2-CG2 4.32Å; V742-I780 WeakPolarHBondContact O-CA 3.48Å; V742-I781 HydrophobicContact CG1-CD1 4.47Å; V742-I781 PolarHBondContact O-N 3.36Å; V742-Y782 HydrophobicContact CB-CD2 4.43Å; V742-Y782 HydrophobicContact CG1-CD2 4.4Å; V742-Y782 PolarHBondContact N-O 3.22Å; V742-F784 HydrophobicContact CG2-CD1 4.05Å; V742-F784 HydrophobicContact CG2-CE1 3.86Å; V742-W821 HydrophobicContact CG1-CH2 3.88Å; V742-W821 HydrophobicContact CG1-CZ2 3.97Å
743	F	87.9	Confident	71.9	Confident	5 Å²	5	35.4 Å²	35.4	2%	0.022	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	135.8	179.3	-67.9	-95.5	0	0	0	111.8	W624 F667 L669 C730 V731 L733 L741 P778 Q779 I780	W624-F743 HydrophobicContact CH2-CB 4.08Å; W624-F743 HydrophobicContact CH2-CG 4.46Å; W624-F743 HydrophobicContact CZ3-CB 4.44Å; W624-F743 HydrophobicContact CZ3-CG 4.49Å; F667-F743 HydrophobicContact CD2-CE1 4.43Å; F667-F743 HydrophobicContact CE2-CD1 4.35Å; F667-F743 AromaticContact CE2-CE1 3.46Å; F667-F743 HydrophobicContact CE2-CE1 3.46Å; F667-F743 VanDerWaalsContact CE2-CE1 3.46Å; F667-F743 AromaticContact CE2-CZ 3.62Å; F667-F743 HydrophobicContact CE2-CZ 3.62Å; F667-F743 HydrophobicContact CZ-CD1 4.26Å; F667-F743 AromaticContact CZ-CE1 3.81Å; F667-F743 HydrophobicContact CZ-CE1 3.81Å; F667-F743 HydrophobicContact CZ-CZ 4.18Å; L669-F743 HydrophobicContact CD2-CE2 4.38Å; L669-F743 HydrophobicContact CD2-CZ 3.88Å; C730-F743 CarbonylContact C-O 3.53Å; C730-F743 VanDerWaalsContact CA-O 3.3Å; C730-F743 WeakPolarHBondContact CA-O 3.43Å; C730-F743 WeakPolarHBondContact CB-O 3.46Å; V731-F743 HydrophobicContact CB-CB 4.47Å; V731-F743 PolarHBondContact N-O 3.01Å; V731-F743 PolarHBondContact O-N 2.92Å; L733-F743 HydrophobicContact CD1-CD2 4.18Å; L733-F743 HydrophobicContact CD1-CE2 3.57Å; L733-F743 HydrophobicContact CD1-CZ 4.35Å; L733-F743 HydrophobicContact CG-CD2 4.11Å; L733-F743 HydrophobicContact CG-CE2 3.91Å; L741-F743 HydrophobicContact CB-CD2 4.26Å; L741-F743 HydrophobicContact CB-CE2 3.58Å; L741-F743 HydrophobicContact CB-CZ 4.31Å; L741-F743 HydrophobicContact CD1-CE2 4.19Å; L741-F743 HydrophobicContact CD1-CZ 4.27Å; F743-P778 HydrophobicContact CD1-CB 4.08Å; F743-Q779 CarbonylContact C-O 3.59Å; F743-Q779 VanDerWaalsContact CA-O 3.29Å; F743-Q779 WeakPolarHBondContact CA-O 3.2Å; F743-I780 HydrophobicContact CD1-CG1 3.82Å; F743-I780 HydrophobicContact CE1-CD1 4Å; F743-I780 HydrophobicContact CE1-CG1 3.32Å; F743-I780 HydrophobicContact CE2-CG1 4.35Å; F743-I780 HydrophobicContact CZ-CD1 3.97Å; F743-I780 HydrophobicContact CZ-CG1 3.62Å
744	K	81.7	Confident	68.9	Low	22 Å²	22	41 Å²	41	10%	0.096	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	150.5	158.3	-143.7	-171.1	167.7	-159.9	0	110.2	Y711 D728 P778 Q779 I781	Y711-K744 WeakPolarHBondContact OH-CD 3.32Å; D728-K744 WeakPolarHBondContact OD2-CE 3.29Å; D728-K744 IonicContact OD2-NZ 2.61Å; D728-K744 PolarHBondContact OD2-NZ 3.48Å; K744-P778 CarbonylContact O-C 3.58Å; K744-P778 VanDerWaalsContact O-CA 3.28Å; K744-P778 WeakPolarHBondContact O-CA 3.47Å; K744-Q779 PolarHBondContact N-O 3.15Å; K744-Q779 PolarHBondContact O-N 2.96Å; K744-I781 HydrophobicContact CB-CD1 3.7Å; K744-I781 HydrophobicContact CB-CG1 3.84Å; K744-I781 HydrophobicContact CG-CD1 4.09Å
745	L	72.1	Confident	65.9	Low	9 Å²	9	46.2 Å²	46.2	5%	0.047	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	123.8	154.4	-76.7	169.1	0	0	0	108.6	V608 W624 Y747 V776	V608-L745 HydrophobicContact CB-CD1 4.41Å; V608-L745 HydrophobicContact CG1-CD1 3.45Å; V608-L745 VanDerWaalsContact CG1-CD1 3.45Å; W624-L745 HydrophobicContact CZ2-CD2 3.85Å; W624-L745 HydrophobicContact CZ2-CG 4.27Å; L745-Y747 HydrophobicContact CB-CE2 4.48Å; L745-V776 HydrophobicContact CD2-CG1 3.47Å; L745-V776 VanDerWaalsContact CD2-CG1 3.47Å
746	C	65.3	Low	62.9	Low	2 Å²	2	53.6 Å²	53.6	1%	0.014	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	147.4	169.4	-66.7	0	0	0	0	109.5	M777 Q779	C746-M777 PolarHBondContact N-O 3.46Å; C746-M777 PolarHBondContact O-N 3.13Å; C746-Q779 HydrophobicContact CB-CG 4.34Å; C746-Q779 PolarHBondContact SG-OE1 2.93Å
747	Y	62.7	Low	60.3	Low	4 Å²	4	58.7 Å²	58.7	2%	0.016	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	120.3	-174.4	-52.5	-77.2	0	0	0	109.9	I610 I722 L745 V774 V776	I610-Y747 HydrophobicContact CG2-CE1 4.11Å; I722-Y747 PolarHBondContact N-O 3.44Å; I722-Y747 VanDerWaalsContact N-O 3.14Å; L745-Y747 HydrophobicContact CB-CE2 4.48Å; Y747-V774 HydrophobicContact CD1-CG1 3.75Å; Y747-V774 HydrophobicContact CG-CG1 4.27Å; Y747-V776 HydrophobicContact CD1-CG2 4.23Å; Y747-V776 HydrophobicContact CE1-CG1 4.47Å; Y747-V776 HydrophobicContact CE1-CG2 4.28Å
748	S	48.5	Very low	57.7	Low	30 Å²	30	61.6 Å²	61.6	21%	0.21	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	132.9	170.8	-176.4	0	0	0	0	109.8	N750 V775	S748-N750 PolarHBondContact OG-OD1 3.02Å; S748-V775 PolarHBondContact N-O 2.87Å; S748-V775 PolarHBondContact O-N 3.49Å
749	M	50.3	Low	55	Low	35 Å²	35	72.1 Å²	72.1	17%	0.172	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	103.4	171.9	-69.4	-59.2	-168	0	0	109.3	L613 I722 S751 F772 V774	L613-M749 HydrophobicContact CD1-CE 4.07Å; L613-M749 HydrophobicContact CD2-CE 3.5Å; L613-M749 VanDerWaalsContact CD2-CE 3.5Å; L613-M749 HydrophobicContact CG-CE 4.39Å; I722-M749 HydrophobicContact CD1-CE 4.17Å; I722-M749 HydrophobicContact CD1-CG 3.69Å; I722-M749 HydrophobicContact CG1-CG 4.13Å; M749-S751 PolarHBondContact O-N 2.96Å; M749-F772 HydrophobicContact SD-CB 3.9Å; M749-F772 HydrophobicContact SD-CD1 4.4Å; M749-F772 HydrophobicContact SD-CG 4.33Å; M749-V774 HydrophobicContact CE-CG2 3.94Å; M749-V774 HydrophobicContact SD-CG2 3.92Å
750	N	41.5	Very low	52.3	Low	90 Å²	90	76.6 Å²	76.6	48%	0.481	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	104.2	174.8	-72	16.6	0	0	0	109.4	S748	S748-N750 PolarHBondContact OG-OD1 3.02Å
751	S	33.8	Very low	49.4	Very low	92 Å²	92	83.5 Å²	83.5	64%	0.643	47%	0.472	S	S	*	.			trans	-78.8	117.2	172.7	46.9	0	0	0	0	110.8	M749 S753	M749-S751 PolarHBondContact O-N 2.96Å; S751-S753 PolarHBondContact O-N 3.04Å; S751-S753 VanDerWaalsContact O-N 3.11Å
752	T	33.7	Very low	46.7	Very low	125 Å²	125	90.9 Å²	90.9	77%	0.767	51%	0.511	S	S	*	.			trans	-81.2	84.8	172.4	49	0	0	0	0	109.9	S754	T752-S754 PolarHBondContact O-N 3.21Å
753	S	32.1	Very low	44	Very low	111 Å²	111	98.2 Å²	98.2	78%	0.776	55%	0.551	S	S	*	*			trans	-79.3	94	-179.2	58.3	0	0	0	0	112.2	S751	S751-S753 PolarHBondContact O-N 3.04Å; S751-S753 VanDerWaalsContact O-N 3.11Å
754	S	30.2	Very low	41.3	Very low	117 Å²	117	106 Å²	106	82%	0.818	59%	0.593	S	S	*	*			trans	-77.1	121.7	154.9	54.4	0	0	0	0	109	T752 D756	T752-S754 PolarHBondContact O-N 3.21Å; S754-D756 PolarHBondContact O-N 3.35Å
755	S	29.6	Very low	38.8	Very low	110 Å²	110	114.1 Å²	114.1	77%	0.769	63%	0.631	S	S	*	*			trans	-78.4	118.3	-178.8	54.2	0	0	0	0	112
756	D	29.2	Very low	36.7	Very low	156 Å²	156	121.8 Å²	121.8	83%	0.834	67%	0.667	S	S	*	*			trans	-162.3	129.4	135	-101.9	-29.3	0	0	0	110.9	S754	S754-D756 PolarHBondContact O-N 3.35Å
757	L	30.9	Very low	35.1	Very low	175 Å²	175	129.5 Å²	129.5	92%	0.916	71%	0.706	S	S	*	*			trans	-138.5	95.3	-178.4	-89.4	172.7	0	0	0	110.7
758	V	33	Very low	33.4	Very low	138 Å²	138	135.1 Å²	135.1	84%	0.836	74%	0.74	S	S	*	*			trans	-99.6	114.8	162.4	179.4	0	0	0	0	108.3
759	R	29.2	Very low	32.5	Very low	224 Å²	224	138.5 Å²	138.5	85%	0.845	76%	0.764	S	S	*	*			trans	-63.4	137	175.3	-65.7	172.1	173.8	160	-4	110.6
760	N	32.8	Very low	31.4	Very low	160 Å²	160	140.1 Å²	140.1	86%	0.856	78%	0.779	S	S	*	*			trans	-147.7	140.5	137.8	-95.6	-42.1	0	0	0	109.5
761	N	31.9	Very low	31	Very low	146 Å²	146	144.4 Å²	144.4	78%	0.781	80%	0.796	S	S	*	*			trans	-79.9	140.3	176.1	-51.1	-28.5	0	0	0	109
762	N	35.2	Very low	31	Very low	157 Å²	157	146.1 Å²	146.1	84%	0.84	79%	0.792	S	S	*	*			trans	-173.5	144	138	-90.6	-23.6	0	0	0	108.4
763	D	31.7	Very low	31.2	Very low	155 Å²	155	145.4 Å²	145.4	83%	0.829	78%	0.783	S	S	*	*			trans	-75.5	125.9	-170.6	-45.7	-85.5	0	0	0	112
764	N	32.5	Very low	32	Very low	168 Å²	168	143.2 Å²	143.2	90%	0.898	77%	0.765	S	S	*	*			trans	-173	143.7	149.7	-96.8	-54.5	0	0	0	110.2	Q766	N764-Q766 PolarHBondContact O-N 2.94Å
765	E	29.2	Very low	33.1	Very low	193 Å²	193	140.1 Å²	140.1	90%	0.902	74%	0.741	S	S	*	*			trans	-80.9	117.8	-173.2	-61	176.6	131.3	0	0	112.3
766	Q	28.1	Very low	34.5	Very low	170 Å²	170	135.3 Å²	135.3	79%	0.794	71%	0.707	S	S	*	*			trans	-135	111	162.2	-73.5	-166.1	-5	0	0	110.8	N764 V768	N764-Q766 PolarHBondContact O-N 2.94Å; Q766-V768 PolarHBondContact O-N 3.29Å
767	I	30.3	Very low	36.4	Very low	163 Å²	163	132.3 Å²	132.3	84%	0.836	69%	0.689	S	S	*	*			trans	-81.8	100.9	177.4	-58.4	175	0	0	0	108.7
768	V	27.3	Very low	38.4	Very low	122 Å²	122	125 Å²	125	74%	0.739	65%	0.652	S	S	*	*			trans	-80.5	117	174.4	180	0	0	0	0	109.6	Q766 S770	Q766-V768 PolarHBondContact O-N 3.29Å; V768-S770 PolarHBondContact O-N 3.25Å
769	S	29.1	Very low	40.5	Very low	101 Å²	101	122.3 Å²	122.3	71%	0.706	63%	0.631	S	S	*	*			trans	-76.3	78.6	-176.9	-50.5	0	0	0	0	113.2	H771	S769-H771 PolarHBondContact O-N 2.89Å; S769-H771 PolarHBondContact O-ND1 3.41Å
770	S	28.3	Very low	43.1	Very low	70 Å²	70	113.6 Å²	113.6	49%	0.49	60%	0.6	S	S	.	*			trans	-60.7	121.9	172.1	54.6	0	0	0	0	111.6	V768 F772	V768-S770 PolarHBondContact O-N 3.25Å; S770-F772 WeakPolarHBondContact O-CD2 3.41Å; S770-F772 PolarHBondContact O-N 3.12Å; S770-F772 VanDerWaalsContact O-N 3.15Å; S770-F772 WeakPolarHBondContact OG-CE2 3.21Å; S770-F772 VanDerWaalsContact OG-CZ 3.31Å; S770-F772 WeakPolarHBondContact OG-CZ 3.4Å
771	H	32.1	Very low	45.2	Very low	180 Å²	180	106.8 Å²	106.8	83%	0.833	56%	0.564	S	S	*	*			trans	-75.6	99.7	177.4	-80.5	53.3	0	0	0	111.1	S769	S769-H771 PolarHBondContact O-N 2.89Å; S769-H771 PolarHBondContact O-ND1 3.41Å
772	F	34.2	Very low	47.6	Very low	127 Å²	127	101.6 Å²	101.6	56%	0.557	53%	0.533	S	S	*	.			trans	-77.5	123.5	175.7	-65.8	-79.4	0	0	0	112.1	M749 S770 V774	M749-F772 HydrophobicContact SD-CB 3.9Å; M749-F772 HydrophobicContact SD-CD1 4.4Å; M749-F772 HydrophobicContact SD-CG 4.33Å; S770-F772 WeakPolarHBondContact O-CD2 3.41Å; S770-F772 PolarHBondContact O-N 3.12Å; S770-F772 VanDerWaalsContact O-N 3.15Å; S770-F772 WeakPolarHBondContact OG-CE2 3.21Å; S770-F772 VanDerWaalsContact OG-CZ 3.31Å; S770-F772 WeakPolarHBondContact OG-CZ 3.4Å; F772-V774 PolarHBondContact O-N 3.22Å
773	N	37.9	Very low	50.2	Low	111 Å²	111	98.7 Å²	98.7	59%	0.594	51%	0.511	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.8	96.8	168.1	-82.1	-40.9	0	0	0	109.9	V775	N773-V775 PolarHBondContact O-N 2.99Å
774	V	49.4	Very low	52.9	Low	65 Å²	65	91.5 Å²	91.5	39%	0.394	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.4	102.9	176.2	-175.3	0	0	0	0	109.8	Y747 M749 F772	Y747-V774 HydrophobicContact CD1-CG1 3.75Å; Y747-V774 HydrophobicContact CG-CG1 4.27Å; M749-V774 HydrophobicContact CE-CG2 3.94Å; M749-V774 HydrophobicContact SD-CG2 3.92Å; F772-V774 PolarHBondContact O-N 3.22Å
775	V	52.9	Low	55.6	Low	51 Å²	51	86.3 Å²	86.3	31%	0.309	44%	0.444	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	117.5	176.2	-177.4	0	0	0	0	109.4	S748 N773 M777	S748-V775 PolarHBondContact N-O 2.87Å; S748-V775 PolarHBondContact O-N 3.49Å; N773-V775 PolarHBondContact O-N 2.99Å; V775-M777 HydrophobicContact CG1-CG 3.9Å; V775-M777 HydrophobicContact CG1-SD 4.48Å
776	V	60.4	Low	58.2	Low	10 Å²	10	77.7 Å²	77.7	6%	0.061	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.2	105.5	-177.2	-177.2	0	0	0	0	109.3	I664 N665 L745 Y747	I664-V776 HydrophobicContact CG2-CB 4.4Å; I664-V776 HydrophobicContact CG2-CG2 4.42Å; N665-V776 PolarHBondContact ND2-O 3.19Å; L745-V776 HydrophobicContact CD2-CG1 3.47Å; L745-V776 VanDerWaalsContact CD2-CG1 3.47Å; Y747-V776 HydrophobicContact CD1-CG2 4.23Å; Y747-V776 HydrophobicContact CE1-CG1 4.47Å; Y747-V776 HydrophobicContact CE1-CG2 4.28Å
777	M	67.4	Low	60.5	Low	93 Å²	93	72.1 Å²	72.1	46%	0.458	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	110.4	-179.8	-59.9	-134.3	102.5	0	0	110.4	C746 V775 Q779	C746-M777 PolarHBondContact N-O 3.46Å; C746-M777 PolarHBondContact O-N 3.13Å; V775-M777 HydrophobicContact CG1-CG 3.9Å; V775-M777 HydrophobicContact CG1-SD 4.48Å; M777-Q779 PolarHBondContact O-N 3.04Å
778	P	74.6	Confident	62.3	Low	22 Å²	22	66.9 Å²	66.9	14%	0.143	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	122.1	173.8	30	-30.3	0	0	0	109.5	W624 I654 N665 F667 F743 K744	W624-P778 HydrophobicContact CH2-CB 3.77Å; W624-P778 HydrophobicContact CZ2-CB 4.22Å; I654-P778 HydrophobicContact CD1-CB 4.44Å; I654-P778 HydrophobicContact CD1-CG 4.07Å; N665-P778 VanDerWaalsContact ND2-CD 3.27Å; N665-P778 WeakPolarHBondContact ND2-CD 3.43Å; F667-P778 HydrophobicContact CD1-CG 3.82Å; F667-P778 HydrophobicContact CE1-CB 4.13Å; F667-P778 HydrophobicContact CE1-CG 3.35Å; F667-P778 HydrophobicContact CZ-CB 4.25Å; F667-P778 HydrophobicContact CZ-CG 3.9Å; F743-P778 HydrophobicContact CD1-CB 4.08Å; K744-P778 CarbonylContact O-C 3.58Å; K744-P778 VanDerWaalsContact O-CA 3.28Å; K744-P778 WeakPolarHBondContact O-CA 3.47Å
779	Q	76.8	Confident	64.1	Low	81 Å²	81	70.5 Å²	70.5	38%	0.379	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.5	-177.3	-70.6	-176.8	-22.7	0	0	110.9	F743 K744 C746 M777 I781	F743-Q779 CarbonylContact C-O 3.59Å; F743-Q779 VanDerWaalsContact CA-O 3.29Å; F743-Q779 WeakPolarHBondContact CA-O 3.2Å; K744-Q779 PolarHBondContact N-O 3.15Å; K744-Q779 PolarHBondContact O-N 2.96Å; C746-Q779 HydrophobicContact CB-CG 4.34Å; C746-Q779 PolarHBondContact SG-OE1 2.93Å; M777-Q779 PolarHBondContact O-N 3.04Å; Q779-I781 PolarHBondContact O-N 3.35Å
780	I	82.9	Confident	66.1	Low	41 Å²	41	67.8 Å²	67.8	21%	0.21	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72	114.6	172.7	-60.2	172.5	0	0	0	108.2	N708 V742 F743 R783	N708-I780 PolarHBondContact ND2-O 2.84Å; V742-I780 WeakPolarHBondContact O-CA 3.48Å; F743-I780 HydrophobicContact CD1-CG1 3.82Å; F743-I780 HydrophobicContact CE1-CD1 4Å; F743-I780 HydrophobicContact CE1-CG1 3.32Å; F743-I780 HydrophobicContact CE2-CG1 4.35Å; F743-I780 HydrophobicContact CZ-CD1 3.97Å; F743-I780 HydrophobicContact CZ-CG1 3.62Å; I780-R783 HydrophobicContact CG2-CG 3.79Å
781	I	77.7	Confident	68.6	Low	17 Å²	17	65.3 Å²	65.3	9%	0.087	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	-46.6	175.4	-31.9	172	0	0	0	110	N708 Y711 V742 K744 Q779	N708-I781 WeakPolarHBondContact CB-O 3.38Å; N708-I781 PolarHBondContact N-O 3.2Å; Y711-I781 HydrophobicContact CD2-CG2 3.9Å; Y711-I781 HydrophobicContact CE2-CG1 4.37Å; Y711-I781 HydrophobicContact CE2-CG2 3.96Å; Y711-I781 HydrophobicContact CG-CG2 4.42Å; V742-I781 HydrophobicContact CG1-CD1 4.47Å; V742-I781 PolarHBondContact O-N 3.36Å; K744-I781 HydrophobicContact CB-CD1 3.7Å; K744-I781 HydrophobicContact CB-CG1 3.84Å; K744-I781 HydrophobicContact CG-CD1 4.09Å; Q779-I781 PolarHBondContact O-N 3.35Å
782	Y	82.5	Confident	71.1	Confident	36 Å²	36	57.4 Å²	57.4	14%	0.141	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	149.1	-173.1	-51.9	-70.2	0	0	0	110.5	I707 V742 W821 M826	I707-Y782 HydrophobicContact CB-CD1 4.46Å; I707-Y782 HydrophobicContact CG1-CD1 4.13Å; I707-Y782 HydrophobicContact CG1-CE1 4.11Å; I707-Y782 HydrophobicContact CG2-CD1 4.41Å; I707-Y782 HydrophobicContact CG2-CE1 4.13Å; V742-Y782 HydrophobicContact CB-CD2 4.43Å; V742-Y782 HydrophobicContact CG1-CD2 4.4Å; V742-Y782 PolarHBondContact N-O 3.22Å; Y782-W821 AromaticContact CD2-CH2 3.83Å; Y782-W821 HydrophobicContact CD2-CH2 3.83Å; Y782-W821 HydrophobicContact CD2-CZ2 4.47Å; Y782-W821 HydrophobicContact CE2-CH2 4.02Å; Y782-W821 HydrophobicContact CE2-CZ2 4.4Å; Y782-M826 HydrophobicContact CD1-CE 4.25Å; Y782-M826 HydrophobicContact CD1-SD 3.97Å; Y782-M826 HydrophobicContact CD2-SD 4.41Å; Y782-M826 HydrophobicContact CE1-CE 3.56Å; Y782-M826 HydrophobicContact CE1-SD 3.51Å; Y782-M826 VanDerWaalsContact CE1-SD 3.51Å; Y782-M826 HydrophobicContact CE2-SD 3.99Å; Y782-M826 HydrophobicContact CG-SD 4.41Å; Y782-M826 VanDerWaalsContact CZ-SD 3.52Å
783	R	88.6	Confident	73.6	Confident	96 Å²	96	51.3 Å²	51.3	36%	0.362	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	138.2	168.6	-51.8	170.7	75.4	-146.1	12.8	106.1	D670 D706 F740 L741 I780	D670-R783 IonicContact OD1-NH2 2.74Å; D670-R783 IonicContact OD2-CZ 2.8Å; D670-R783 IonicContact OD2-NE 3.79Å; D670-R783 PolarHBondContact OD2-NE 2.88Å; D670-R783 IonicContact OD2-NH2 3.09Å; D670-R783 PolarHBondContact OD2-NH2 2.88Å; D706-R783 HydrophobicContact CB-CB 4.42Å; D706-R783 PolarHBondContact N-O 3.43Å; D706-R783 PolarHBondContact O-N 2.85Å; F740-R783 WeakPolarHBondContact O-CA 3.18Å; L741-R783 HydrophobicContact CD2-CB 4.2Å; L741-R783 HydrophobicContact CD2-CG 3.72Å; I780-R783 HydrophobicContact CG2-CG 3.79Å
784	F	89.2	Confident	75.6	Confident	5 Å²	5	48 Å²	48	2%	0.022	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	159.3	173.3	71.1	-87.8	0	0	0	111.9	F703 T704 W705 I732 F740 V742	F703-F784 HydrophobicContact CB-CD2 4.19Å; F703-F784 HydrophobicContact CD1-CD2 4.3Å; F703-F784 HydrophobicContact CD1-CE2 4.43Å; F703-F784 HydrophobicContact CD2-CD2 4.26Å; F703-F784 HydrophobicContact CD2-CE2 4.17Å; F703-F784 HydrophobicContact CE1-CE2 4.49Å; F703-F784 HydrophobicContact CE2-CE2 4.24Å; F703-F784 HydrophobicContact CG-CD2 4.02Å; F703-F784 HydrophobicContact CG-CE2 4.28Å; F703-F784 HydrophobicContact CZ-CE2 4.4Å; T704-F784 WeakPolarHBondContact O-CA 3.41Å; T704-F784 VanDerWaalsContact O-CB 3.31Å; T704-F784 WeakPolarHBondContact O-CB 3.41Å; W705-F784 HydrophobicContact CB-CB 4.45Å; W705-F784 HydrophobicContact CD2-CB 3.76Å; W705-F784 HydrophobicContact CD2-CD1 4.37Å; W705-F784 HydrophobicContact CD2-CG 4.13Å; W705-F784 HydrophobicContact CE3-CB 3.76Å; W705-F784 AromaticContact CE3-CD1 3.7Å; W705-F784 HydrophobicContact CE3-CD1 3.7Å; W705-F784 AromaticContact CE3-CG 3.91Å; W705-F784 HydrophobicContact CE3-CG 3.91Å; W705-F784 HydrophobicContact CG-CB 4.08Å; W705-F784 AromaticContact CH2-CD1 3.64Å; W705-F784 HydrophobicContact CH2-CD1 3.64Å; W705-F784 HydrophobicContact CH2-CD2 4.36Å; W705-F784 AromaticContact CH2-CE1 3.68Å; W705-F784 HydrophobicContact CH2-CE1 3.68Å; W705-F784 HydrophobicContact CH2-CE2 4.39Å; W705-F784 AromaticContact CH2-CG 4Å; W705-F784 HydrophobicContact CH2-CG 4Å; W705-F784 HydrophobicContact CH2-CZ 4.06Å; W705-F784 HydrophobicContact CZ2-CD1 4.34Å; W705-F784 HydrophobicContact CZ2-CD2 4.34Å; W705-F784 HydrophobicContact CZ2-CG 4.23Å; W705-F784 HydrophobicContact CZ3-CB 4.23Å; W705-F784 AromaticContact CZ3-CD1 3.29Å; W705-F784 HydrophobicContact CZ3-CD1 3.29Å; W705-F784 AromaticContact CZ3-CE1 3.67Å; W705-F784 HydrophobicContact CZ3-CE1 3.67Å; W705-F784 AromaticContact CZ3-CG 3.84Å; W705-F784 HydrophobicContact CZ3-CG 3.84Å; W705-F784 HydrophobicContact CZ3-CZ 4.49Å; I732-F784 HydrophobicContact CG2-CE1 4.05Å; I732-F784 HydrophobicContact CG2-CZ 4.29Å; F740-F784 HydrophobicContact CB-CD1 3.63Å; F740-F784 HydrophobicContact CB-CD2 3.92Å; F740-F784 HydrophobicContact CB-CE1 3.39Å; F740-F784 HydrophobicContact CB-CE2 3.69Å; F740-F784 HydrophobicContact CB-CG 3.9Å; F740-F784 HydrophobicContact CB-CZ 3.42Å; F740-F784 VanDerWaalsContact CB-CZ 3.42Å; F740-F784 HydrophobicContact CD1-CE1 4.46Å; F740-F784 HydrophobicContact CD1-CE2 4.01Å; F740-F784 AromaticContact CD1-CZ 3.74Å; F740-F784 HydrophobicContact CD1-CZ 3.74Å; F740-F784 AromaticContact CD2-CD2 3.81Å; F740-F784 HydrophobicContact CD2-CD2 3.81Å; F740-F784 AromaticContact CD2-CE2 3.5Å; F740-F784 HydrophobicContact CD2-CE2 3.5Å; F740-F784 HydrophobicContact CD2-CZ 4.03Å; F740-F784 HydrophobicContact CE2-CE2 4.12Å; F740-F784 HydrophobicContact CG-CD1 4.47Å; F740-F784 AromaticContact CG-CD2 4Å; F740-F784 HydrophobicContact CG-CD2 4Å; F740-F784 HydrophobicContact CG-CE1 4Å; F740-F784 AromaticContact CG-CE2 3.46Å; F740-F784 HydrophobicContact CG-CE2 3.46Å; F740-F784 VanDerWaalsContact CG-CE2 3.46Å; F740-F784 HydrophobicContact CG-CG 4.48Å; F740-F784 AromaticContact CG-CZ 3.46Å; F740-F784 HydrophobicContact CG-CZ 3.46Å; F740-F784 VanDerWaalsContact CG-CZ 3.46Å; F740-F784 PolarHBondContact N-O 3.26Å; F740-F784 PolarHBondContact O-N 3.09Å; V742-F784 HydrophobicContact CG2-CD1 4.05Å; V742-F784 HydrophobicContact CG2-CE1 3.86Å
785	N	87.9	Confident	77.2	Confident	59 Å²	59	45.5 Å²	45.5	32%	0.316	24%	0.243	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	154.5	177.8	70.9	-53.7	0	0	0	112.1	F703 T704 G738 R739	F703-N785 WeakPolarHBondContact CA-O 3.26Å; T704-N785 PolarHBondContact N-O 3.25Å; T704-N785 PolarHBondContact O-N 2.84Å; T704-N785 VanDerWaalsContact O-N 3.11Å; T704-N785 PolarHBondContact O-OD1 2.93Å; G738-N785 VanDerWaalsContact O-CA 3.31Å; G738-N785 WeakPolarHBondContact O-CA 3.29Å; R739-N785 HydrophobicContact CG-CB 4.44Å
786	T	84.6	Confident	79	Confident	12 Å²	12	44.1 Å²	44.1	7%	0.074	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	122.4	166.7	48.8	0	0	0	0	109.9	I701 F703 G738 F740 S788 L791 L807	I701-T786 HydrophobicContact CD1-CG2 3.72Å; F703-T786 HydrophobicContact CD1-CG2 4.28Å; F703-T786 HydrophobicContact CE1-CG2 3.95Å; G738-T786 PolarHBondContact O-N 3.21Å; G738-T786 PolarHBondContact O-OG1 2.89Å; F740-T786 HydrophobicContact CE2-CG2 4.14Å; T786-S788 PolarHBondContact O-N 2.86Å; T786-L791 HydrophobicContact CG2-CB 4.42Å; T786-L791 PolarHBondContact OG1-O 3.23Å; T786-L807 HydrophobicContact CG2-CD1 4.33Å
787	N	76.7	Confident	80.3	Confident	52 Å²	52	44.9 Å²	44.9	28%	0.278	24%	0.237	S	C	.	.	S	Bend	trans	-67.8	-25.3	174.7	-69.8	-3.9	0	0	0	112	E702 T704 Q789 Q849	E702-N787 HydrophobicContact CB-CB 4.27Å; E702-N787 WeakPolarHBondContact CG-ND2 3.43Å; E702-N787 WeakPolarHBondContact O-CB 3.15Å; E702-N787 PolarHBondContact O-N 2.91Å; E702-N787 PolarHBondContact OE2-ND2 2.84Å; T704-N787 VanDerWaalsContact OG1-CG 3.32Å; T704-N787 PolarHBondContact OG1-ND2 2.89Å; T704-N787 PolarHBondContact OG1-OD1 2.91Å; N787-Q789 PolarHBondContact O-N 2.81Å; N787-Q849 PolarHBondContact ND2-NE2 2.85Å
788	S	69.1	Low	81.2	Confident	53 Å²	53	41.9 Å²	41.9	37%	0.371	23%	0.225	S	C	.	.	S	Bend	trans	-75.4	105.8	172.5	-54.6	0	0	0	0	111.1	T786 G790 L791	T786-S788 PolarHBondContact O-N 2.86Å; S788-G790 PolarHBondContact O-N 3.03Å; S788-L791 PolarHBondContact O-N 2.79Å
789	Q	63.9	Low	81.5	Confident	199 Å²	199	41.2 Å²	41.2	93%	0.93	22%	0.22	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.4	132.5	175.6	-68.1	-176.2	-9	0	0	111.3	N787	N787-Q789 PolarHBondContact O-N 2.81Å
790	G	70.9	Confident	81.4	Confident	44 Å²	44	39.3 Å²	39.3	45%	0.454	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	94.3	-2.5	177.8	0	0	0	0	0	115.7	S788 N809	S788-G790 PolarHBondContact O-N 3.03Å; G790-N809 WeakPolarHBondContact O-CA 3.42Å
791	L	81	Confident	81.2	Confident	17 Å²	17	37.7 Å²	37.7	9%	0.089	20%	0.204	C	C	.	.			trans	-86.6	127.6	167.2	-71.8	-178.4	0	0	0	111.3	I701 G738 T786 S788 L807 F808 N809	I701-L791 HydrophobicContact CD1-CD1 3.57Å; I701-L791 HydrophobicContact CG1-CD1 4.5Å; G738-L791 WeakPolarHBondContact CA-O 3.45Å; T786-L791 HydrophobicContact CG2-CB 4.42Å; T786-L791 PolarHBondContact OG1-O 3.23Å; S788-L791 PolarHBondContact O-N 2.79Å; L791-L807 HydrophobicContact CB-CD1 4.49Å; L791-L807 HydrophobicContact CD1-CD1 4.3Å; L791-L807 HydrophobicContact CD2-CB 4.39Å; L791-F808 WeakPolarHBondContact CA-O 3.37Å; L791-N809 HydrophobicContact CD2-CB 3.83Å
792	V	84.7	Confident	81.6	Confident	14 Å²	14	38.5 Å²	38.5	9%	0.085	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	142.3	-173.6	179.2	0	0	0	0	109.8	T676 S735 N736 L807 F808	T676-V792 HydrophobicContact CG2-CG1 4.48Å; S735-V792 WeakPolarHBondContact O-CG1 3.31Å; N736-V792 VanDerWaalsContact O-CG2 3.32Å; N736-V792 WeakPolarHBondContact O-CG2 3.17Å; V792-L807 CarbonylContact O-C 3.6Å; V792-L807 VanDerWaalsContact O-CA 3.29Å; V792-L807 WeakPolarHBondContact O-CA 3.16Å; V792-F808 HydrophobicContact CB-CD1 4.17Å; V792-F808 HydrophobicContact CB-CE1 3.62Å; V792-F808 HydrophobicContact CB-CE2 3.99Å; V792-F808 HydrophobicContact CB-CZ 3.53Å; V792-F808 HydrophobicContact CG1-CD1 4.48Å; V792-F808 HydrophobicContact CG1-CE1 3.53Å; V792-F808 HydrophobicContact CG1-CE2 4.35Å; V792-F808 HydrophobicContact CG1-CZ 3.46Å; V792-F808 VanDerWaalsContact CG1-CZ 3.46Å; V792-F808 HydrophobicContact CG2-CZ 4.41Å; V792-F808 PolarHBondContact N-O 3.36Å; V792-F808 WeakPolarHBondContact O-CD1 3.1Å; V792-F808 WeakPolarHBondContact O-CE1 3.46Å; V792-F808 PolarHBondContact O-N 2.86Å
793	A	86.4	Confident	81.8	Confident	0 Å²	0	36.8 Å²	36.8	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80	128.3	179.2	0	0	0	0	0	112.3	T676 A734 F740 M796 I805 G806 L807	T676-A793 WeakPolarHBondContact CB-O 3.45Å; T676-A793 PolarHBondContact OG1-O 3.48Å; A734-A793 HydrophobicContact CB-CB 3.6Å; F740-A793 HydrophobicContact CE1-CB 4Å; F740-A793 HydrophobicContact CZ-CB 4.03Å; A793-M796 HydrophobicContact CB-CG 4.44Å; A793-I805 HydrophobicContact CB-CG2 3.85Å; A793-G806 VanDerWaalsContact CA-O 3.31Å; A793-G806 WeakPolarHBondContact CA-O 3.37Å; A793-L807 HydrophobicContact CB-CD2 4.15Å
794	N	79.5	Confident	81.9	Confident	41 Å²	41	32.2 Å²	32.2	22%	0.219	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	-25.9	171.2	56.8	25.7	0	0	0	113.5	G806 F808 L867	N794-G806 PolarHBondContact N-O 3.18Å; N794-G806 PolarHBondContact OD1-O 3.09Å; N794-F808 HydrophobicContact CB-CD1 3.56Å; N794-F808 HydrophobicContact CB-CE1 3.78Å; N794-L867 PolarHBondContact ND2-N 3.21Å; N794-L867 WeakPolarHBondContact OD1-CB 3.22Å; N794-L867 PolarHBondContact OD1-N 3.37Å
795	G	83.7	Confident	82	Confident	12 Å²	12	32 Å²	32	12%	0.124	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	142.9	179.5	0	0	0	0	0	110.7	G806 M869	G795-G806 PolarHBondContact O-N 2.87Å; G795-M869 VanDerWaalsContact C-CE 3.41Å; G795-M869 WeakPolarHBondContact O-CE 3.44Å
796	M	90.1	Very high	82	Confident	22 Å²	22	29.2 Å²	29.2	11%	0.108	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	137.4	177.4	-61.1	176.2	82.6	0	0	108.7	A677 V679 I732 A734 F740 A793 C804 I805	A677-M796 HydrophobicContact CB-CB 4.43Å; A677-M796 HydrophobicContact CB-CG 3.78Å; A677-M796 HydrophobicContact CB-SD 3.9Å; V679-M796 HydrophobicContact CB-CB 3.84Å; V679-M796 HydrophobicContact CG1-CB 3.94Å; V679-M796 HydrophobicContact CG1-CE 3.74Å; V679-M796 HydrophobicContact CG1-SD 4.4Å; I732-M796 HydrophobicContact CB-CE 4.06Å; I732-M796 HydrophobicContact CG2-CE 3.76Å; A734-M796 HydrophobicContact CB-SD 3.69Å; F740-M796 HydrophobicContact CD1-CE 4.08Å; F740-M796 HydrophobicContact CE1-CE 4.02Å; F740-M796 HydrophobicContact CE1-SD 4.44Å; A793-M796 HydrophobicContact CB-CG 4.44Å; M796-C804 WeakPolarHBondContact CA-O 3.41Å; M796-I805 HydrophobicContact CE-CD1 3.84Å; M796-I805 HydrophobicContact CE-CG1 3.99Å; M796-I805 HydrophobicContact CG-CG1 4.4Å; M796-I805 HydrophobicContact CG-CG2 4.24Å
797	I	89.2	Confident	82.2	Confident	26 Å²	26	28.6 Å²	28.6	13%	0.133	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.7	149.8	177	-163.6	165.8	0	0	0	110.3	C804 M869 S871 I903	I797-C804 HydrophobicContact CG2-CB 3.93Å; I797-C804 PolarHBondContact N-O 2.92Å; I797-C804 PolarHBondContact O-N 2.64Å; I797-M869 HydrophobicContact CB-CB 4.41Å; I797-M869 HydrophobicContact CB-CE 4.3Å; I797-M869 HydrophobicContact CD1-CB 4.25Å; I797-M869 HydrophobicContact CG2-CB 4Å; I797-M869 HydrophobicContact CG2-CE 3.85Å; I797-M869 HydrophobicContact CG2-SD 3.73Å; I797-S871 VanDerWaalsContact CD1-N 3.28Å; I797-I903 HydrophobicContact CG2-CD1 3.56Å; I797-I903 HydrophobicContact CG2-CG1 4.17Å; I797-I903 HydrophobicContact CG2-CG2 4.21Å
798	S	85.9	Confident	82.4	Confident	30 Å²	30	29.4 Å²	29.4	21%	0.21	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	147.6	177.3	52.7	0	0	0	0	111	Y680 Y802	Y680-S798 WeakPolarHBondContact O-CB 3.22Å; Y680-S798 PolarHBondContact O-OG 2.85Å; S798-Y802 CarbonylContact C-O 3.56Å; S798-Y802 VanDerWaalsContact CA-O 3.24Å; S798-Y802 WeakPolarHBondContact CA-O 3.34Å
799	R	81	Confident	82.7	Confident	9 Å²	9	28.4 Å²	28.4	3%	0.034	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	98.5	166.1	177.5	45.6	168.3	-168.9	-25.1	107.6	N801 Y802 S872 F873 S874 N900 D901 V918	R799-N801 PolarHBondContact O-N 2.89Å; R799-Y802 PolarHBondContact N-O 2.72Å; R799-Y802 PolarHBondContact O-N 3.05Å; R799-S872 VanDerWaalsContact CZ-O 3.29Å; R799-S872 PolarHBondContact NH1-O 3.29Å; R799-S872 PolarHBondContact NH2-O 3.18Å; R799-S872 PolarHBondContact NH2-OG 3.42Å; R799-F873 PolarHBondContact NH2-O 3.25Å; R799-S874 PolarHBondContact NH1-OG 3.48Å; R799-N900 PolarHBondContact NE-O 2.94Å; R799-N900 PolarHBondContact NH2-O 2.69Å; R799-D901 HydrophobicContact CG-CB 4.1Å; R799-D901 IonicContact CZ-OD1 2.72Å; R799-D901 IonicContact NE-OD1 2.64Å; R799-D901 PolarHBondContact NE-OD1 2.89Å; R799-V918 HydrophobicContact CB-CG2 4.35Å
800	D	75	Confident	83.2	Confident	41 Å²	41	24.3 Å²	24.3	22%	0.219	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	51.4	-108.9	-172.5	-67	-86.1	0	0	0	110.7	T684	T684-D800 HydrophobicContact CG2-CB 4.35Å
801	N	78.6	Confident	83.2	Confident	6 Å²	6	28.2 Å²	28.2	3%	0.032	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-15.8	176.6	-92.4	-8.2	0	0	0	114.9	K682 T684 R799 Q820 W821	K682-N801 PolarHBondContact O-OD1 2.87Å; T684-N801 PolarHBondContact N-OD1 2.9Å; T684-N801 PolarHBondContact O-ND2 2.9Å; T684-N801 PolarHBondContact O-OD1 2.88Å; T684-N801 PolarHBondContact OG1-ND2 3.08Å; T684-N801 VanDerWaalsContact OG1-ND2 3.13Å; T684-N801 PolarHBondContact OG1-OD1 3.02Å; R799-N801 PolarHBondContact O-N 2.89Å; N801-Q820 HydrophobicContact CB-CG 4.46Å; N801-W821 WeakPolarHBondContact CB-O 3.4Å; N801-W821 PolarHBondContact ND2-O 3.04Å; N801-W821 WeakPolarHBondContact O-CA 3.25Å; N801-W821 VanDerWaalsContact O-CB 3.25Å; N801-W821 WeakPolarHBondContact O-CB 3.44Å; N801-W821 PolarHBondContact O-N 2.82Å; N801-W821 PolarHBondContact OD1-O 3.26Å
802	Y	84.5	Confident	82.5	Confident	35 Å²	35	30.3 Å²	30.3	14%	0.137	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	140.2	-175.7	-70.3	-93.9	0	0	0	112.2	S798 R799 F819 Q820 V918 Q919	S798-Y802 CarbonylContact C-O 3.56Å; S798-Y802 VanDerWaalsContact CA-O 3.24Å; S798-Y802 WeakPolarHBondContact CA-O 3.34Å; R799-Y802 PolarHBondContact N-O 2.72Å; R799-Y802 PolarHBondContact O-N 3.05Å; Y802-F819 WeakPolarHBondContact CA-O 3.38Å; Y802-Q820 HydrophobicContact CD1-CB 3.98Å; Y802-Q820 HydrophobicContact CD1-CG 4.41Å; Y802-Q820 HydrophobicContact CE1-CB 3.64Å; Y802-Q820 HydrophobicContact CE1-CG 4Å; Y802-Q820 HydrophobicContact CE2-CG 4.36Å; Y802-Q820 PolarHBondContact OH-OE1 3.45Å; Y802-Q820 VanDerWaalsContact OH-OE1 3.14Å; Y802-V918 HydrophobicContact CD1-CG1 4.44Å; Y802-V918 HydrophobicContact CG-CG1 4.16Å; Y802-Q919 HydrophobicContact CD2-CG 4.36Å; Y802-Q919 HydrophobicContact CE1-CG 4.45Å; Y802-Q919 HydrophobicContact CE2-CG 3.78Å
803	V	88.6	Confident	82	Confident	0 Å²	0	31.3 Å²	31.3	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	127.3	175	-170.6	0	0	0	0	108.8	V679 V681 I732 I805 C818 F819 W821	V679-V803 HydrophobicContact CG1-CG1 4.32Å; V681-V803 HydrophobicContact CB-CG2 4.37Å; V681-V803 HydrophobicContact CG1-CG2 3.8Å; V681-V803 HydrophobicContact CG2-CG2 3.6Å; I732-V803 HydrophobicContact CD1-CG1 4.28Å; I732-V803 HydrophobicContact CD1-CG2 4.21Å; V803-I805 HydrophobicContact CG1-CD1 4.41Å; V803-I805 HydrophobicContact CG1-CG1 4.02Å; V803-C818 WeakPolarHBondContact O-CA 3.45Å; V803-F819 HydrophobicContact CB-CD1 4.42Å; V803-F819 HydrophobicContact CB-CD2 4.37Å; V803-F819 HydrophobicContact CB-CE1 4.01Å; V803-F819 HydrophobicContact CB-CE2 3.94Å; V803-F819 HydrophobicContact CB-CZ 3.75Å; V803-F819 HydrophobicContact CG1-CE1 4.1Å; V803-F819 HydrophobicContact CG1-CZ 3.91Å; V803-F819 HydrophobicContact CG2-CE2 3.95Å; V803-F819 HydrophobicContact CG2-CZ 4.13Å; V803-F819 PolarHBondContact N-O 3.45Å; V803-F819 PolarHBondContact O-N 2.78Å; V803-W821 HydrophobicContact CG2-CB 4.26Å
804	C	90	Very high	81.6	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	124.4	173.4	-179.8	0	0	0	0	109.2	M796 I797 V817 M869 I903	M796-C804 WeakPolarHBondContact CA-O 3.41Å; I797-C804 HydrophobicContact CG2-CB 3.93Å; I797-C804 PolarHBondContact N-O 2.92Å; I797-C804 PolarHBondContact O-N 2.64Å; C804-V817 WeakPolarHBondContact CA-O 3.37Å; C804-M869 VanDerWaalsContact SG-SD 3.68Å; C804-I903 HydrophobicContact CB-CD1 3.45Å; C804-I903 VanDerWaalsContact CB-CD1 3.45Å
805	I	91	Very high	81.8	Confident	0 Å²	0	30.5 Å²	30.5	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	123.9	-179.4	-54.1	-178.9	0	0	0	108.8	F740 A793 M796 V803 L807 I816 V817 F819	F740-I805 HydrophobicContact CD1-CD1 4.48Å; F740-I805 HydrophobicContact CE1-CD1 3.88Å; F740-I805 HydrophobicContact CE1-CG2 4.29Å; F740-I805 HydrophobicContact CZ-CD1 4.39Å; F740-I805 HydrophobicContact CZ-CG2 4.39Å; A793-I805 HydrophobicContact CB-CG2 3.85Å; M796-I805 HydrophobicContact CE-CD1 3.84Å; M796-I805 HydrophobicContact CE-CG1 3.99Å; M796-I805 HydrophobicContact CG-CG1 4.4Å; M796-I805 HydrophobicContact CG-CG2 4.24Å; V803-I805 HydrophobicContact CG1-CD1 4.41Å; V803-I805 HydrophobicContact CG1-CG1 4.02Å; I805-L807 HydrophobicContact CG2-CD2 3.62Å; I805-L807 HydrophobicContact CG2-CG 4.03Å; I805-I816 WeakPolarHBondContact O-CA 3.36Å; I805-V817 PolarHBondContact N-O 2.77Å; I805-V817 PolarHBondContact O-N 3.46Å; I805-F819 HydrophobicContact CD1-CE1 3.76Å; I805-F819 HydrophobicContact CD1-CZ 4.33Å; I805-F819 HydrophobicContact CG1-CE1 4.32Å
806	G	88.7	Confident	82	Confident	0 Å²	0	29.9 Å²	29.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	115.8	165.6	0	0	0	0	0	110.1	A793 N794 G795	A793-G806 VanDerWaalsContact CA-O 3.31Å; A793-G806 WeakPolarHBondContact CA-O 3.37Å; N794-G806 PolarHBondContact N-O 3.18Å; N794-G806 PolarHBondContact OD1-O 3.09Å; G795-G806 PolarHBondContact O-N 2.87Å
807	L	87.4	Confident	82	Confident	0 Å²	0	28.9 Å²	28.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	131.2	177.5	-62.2	178.2	0	0	0	109.9	I701 F740 T786 L791 V792 A793 I805 T814 H815 V817	I701-L807 HydrophobicContact CD1-CD1 3.4Å; F740-L807 HydrophobicContact CZ-CD2 4.16Å; T786-L807 HydrophobicContact CG2-CD1 4.33Å; L791-L807 HydrophobicContact CB-CD1 4.49Å; L791-L807 HydrophobicContact CD1-CD1 4.3Å; L791-L807 HydrophobicContact CD2-CB 4.39Å; V792-L807 CarbonylContact O-C 3.6Å; V792-L807 VanDerWaalsContact O-CA 3.29Å; V792-L807 WeakPolarHBondContact O-CA 3.16Å; A793-L807 HydrophobicContact CB-CD2 4.15Å; I805-L807 HydrophobicContact CG2-CD2 3.62Å; I805-L807 HydrophobicContact CG2-CG 4.03Å; L807-T814 WeakPolarHBondContact O-CA 3.41Å; L807-H815 PolarHBondContact N-O 3.4Å; L807-H815 PolarHBondContact O-N 3.06Å; L807-V817 HydrophobicContact CD1-CG2 3.61Å; L807-V817 HydrophobicContact CG-CG2 4.37Å
808	F	80.4	Confident	82	Confident	68 Å²	68	28.5 Å²	28.5	30%	0.298	16%	0.163	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	147.1	170.3	65.1	-84.1	0	0	0	111.1	L791 V792 N794 T813	L791-F808 WeakPolarHBondContact CA-O 3.37Å; V792-F808 HydrophobicContact CB-CD1 4.17Å; V792-F808 HydrophobicContact CB-CE1 3.62Å; V792-F808 HydrophobicContact CB-CE2 3.99Å; V792-F808 HydrophobicContact CB-CZ 3.53Å; V792-F808 HydrophobicContact CG1-CD1 4.48Å; V792-F808 HydrophobicContact CG1-CE1 3.53Å; V792-F808 HydrophobicContact CG1-CE2 4.35Å; V792-F808 HydrophobicContact CG1-CZ 3.46Å; V792-F808 VanDerWaalsContact CG1-CZ 3.46Å; V792-F808 HydrophobicContact CG2-CZ 4.41Å; V792-F808 PolarHBondContact N-O 3.36Å; V792-F808 WeakPolarHBondContact O-CD1 3.1Å; V792-F808 WeakPolarHBondContact O-CE1 3.46Å; V792-F808 PolarHBondContact O-N 2.86Å; N794-F808 HydrophobicContact CB-CD1 3.56Å; N794-F808 HydrophobicContact CB-CE1 3.78Å; F808-T813 WeakPolarHBondContact CA-O 3.45Å
809	N	76.8	Confident	82	Confident	33 Å²	33	27.5 Å²	27.5	18%	0.176	16%	0.155	C	C	.	.			trans	-95.3	177.8	167.5	72.6	8.8	0	0	0	111.9	G790 L791 I811 S812 T813	G790-N809 WeakPolarHBondContact O-CA 3.42Å; L791-N809 HydrophobicContact CD2-CB 3.83Å; N809-I811 PolarHBondContact O-N 3.35Å; N809-I811 VanDerWaalsContact O-N 3.17Å; N809-I811 VanDerWaalsContact OD1-CA 3.31Å; N809-I811 WeakPolarHBondContact OD1-CA 3.49Å; N809-I811 WeakPolarHBondContact OD1-CB 3.43Å; N809-I811 PolarHBondContact OD1-N 3.5Å; N809-S812 PolarHBondContact O-N 3.43Å; N809-S812 PolarHBondContact OD1-N 3.16Å; N809-T813 PolarHBondContact N-O 2.88Å; N809-T813 PolarHBondContact ND2-OG1 3.5Å; N809-T813 PolarHBondContact OD1-N 3.22Å; N809-T813 PolarHBondContact OD1-OG1 3.09Å
810	S	73.2	Confident	82.1	Confident	112 Å²	112	29.7 Å²	29.7	78%	0.783	17%	0.165	S	C	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-14.4	176	52.2	0	0	0	0	115	S812	S810-S812 VanDerWaalsContact C-N 3.33Å
811	I	71.7	Confident	82.2	Confident	127 Å²	127	28.5 Å²	28.5	65%	0.651	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	0.6	176.2	-51.9	172	0	0	0	110.3	N809 T813	N809-I811 PolarHBondContact O-N 3.35Å; N809-I811 VanDerWaalsContact O-N 3.17Å; N809-I811 VanDerWaalsContact OD1-CA 3.31Å; N809-I811 WeakPolarHBondContact OD1-CA 3.49Å; N809-I811 WeakPolarHBondContact OD1-CB 3.43Å; N809-I811 PolarHBondContact OD1-N 3.5Å; I811-T813 HydrophobicContact CG2-CG2 4.46Å; I811-T813 PolarHBondContact O-N 2.98Å
812	S	65.6	Low	81.5	Confident	61 Å²	61	30 Å²	30	43%	0.427	17%	0.168	S	C	.	.			trans	65.1	16.8	-175.7	-49.1	0	0	0	0	115.3	N809 S810	N809-S812 PolarHBondContact O-N 3.43Å; N809-S812 PolarHBondContact OD1-N 3.16Å; S810-S812 VanDerWaalsContact C-N 3.33Å
813	T	74.2	Confident	80.5	Confident	35 Å²	35	29 Å²	29	22%	0.215	17%	0.165	C	C	.	.			trans	-73.4	139	168	66.5	0	0	0	0	109.3	F808 N809 I811 H815	F808-T813 WeakPolarHBondContact CA-O 3.45Å; N809-T813 PolarHBondContact N-O 2.88Å; N809-T813 PolarHBondContact ND2-OG1 3.5Å; N809-T813 PolarHBondContact OD1-N 3.22Å; N809-T813 PolarHBondContact OD1-OG1 3.09Å; I811-T813 HydrophobicContact CG2-CG2 4.46Å; I811-T813 PolarHBondContact O-N 2.98Å; T813-H815 PolarHBondContact OG1-NE2 3.31Å
814	T	78.8	Confident	78.7	Confident	4 Å²	4	33.4 Å²	33.4	3%	0.025	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	123.3	-174.2	-69.7	0	0	0	0	110.9	L807 L857 G865 L867 T907	L807-T814 WeakPolarHBondContact O-CA 3.41Å; T814-L857 HydrophobicContact CG2-CD1 4.14Å; T814-G865 PolarHBondContact OG1-O 3.26Å; T814-L867 HydrophobicContact CG2-CB 3.88Å; T814-L867 HydrophobicContact CG2-CD1 3.92Å; T814-L867 HydrophobicContact CG2-CD2 4.26Å; T814-L867 HydrophobicContact CG2-CG 4.23Å; T814-T907 HydrophobicContact CG2-CG2 4.13Å
815	H	83.7	Confident	76.9	Confident	19 Å²	19	36.1 Å²	36.1	9%	0.088	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	154.4	177.8	-51.3	-96.5	0	0	0	109.4	L807 T813 L854 N856	L807-H815 PolarHBondContact N-O 3.4Å; L807-H815 PolarHBondContact O-N 3.06Å; T813-H815 PolarHBondContact OG1-NE2 3.31Å; H815-L854 HydrophobicContact CB-CD1 3.63Å; H815-L854 HydrophobicContact CB-CD2 4.35Å; H815-L854 HydrophobicContact CB-CG 3.98Å; H815-N856 PolarHBondContact ND1-OD1 3.29Å
816	I	88.3	Confident	75.1	Confident	0 Å²	0	37.1 Å²	37.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139.7	-179.2	-66.6	154	0	0	0	109.4	I805 I855 L857 L867 L905 L916 F923	I805-I816 WeakPolarHBondContact O-CA 3.36Å; I816-I855 HydrophobicContact CB-CB 4.1Å; I816-I855 WeakPolarHBondContact CB-O 3.32Å; I816-I855 HydrophobicContact CG2-CB 4.46Å; I816-I855 HydrophobicContact CG2-CD1 4.42Å; I816-I855 PolarHBondContact N-O 3.11Å; I816-I855 WeakPolarHBondContact O-CB 3.36Å; I816-I855 PolarHBondContact O-N 2.69Å; I816-L857 HydrophobicContact CD1-CD2 3.73Å; I816-L867 HydrophobicContact CD1-CD2 4.28Å; I816-L867 HydrophobicContact CG1-CD2 3.75Å; I816-L905 HydrophobicContact CD1-CD1 3.9Å; I816-L905 HydrophobicContact CD1-CD2 3.61Å; I816-L905 HydrophobicContact CD1-CG 4.43Å; I816-L916 HydrophobicContact CG2-CD2 3.89Å; I816-F923 HydrophobicContact CD1-CZ 4.28Å
817	V	89.5	Confident	72.9	Confident	0 Å²	0	43.4 Å²	43.4	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	121.8	171.4	-171.6	0	0	0	0	108.6	I701 F703 C804 I805 L807 F819 H852 L854	I701-V817 HydrophobicContact CG2-CG1 3.98Å; I701-V817 HydrophobicContact CG2-CG2 3.79Å; F703-V817 HydrophobicContact CE2-CG1 4.19Å; F703-V817 HydrophobicContact CZ-CB 4.47Å; F703-V817 HydrophobicContact CZ-CG1 3.9Å; C804-V817 WeakPolarHBondContact CA-O 3.37Å; I805-V817 PolarHBondContact N-O 2.77Å; I805-V817 PolarHBondContact O-N 3.46Å; L807-V817 HydrophobicContact CD1-CG2 3.61Å; L807-V817 HydrophobicContact CG-CG2 4.37Å; V817-F819 HydrophobicContact CG1-CD1 4.44Å; V817-H852 HydrophobicContact CG1-CB 3.66Å; V817-L854 HydrophobicContact CG2-CD1 3.73Å
818	C	88.6	Confident	70.4	Confident	19 Å²	19	48.3 Å²	48.3	13%	0.128	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	132.8	173.2	-69.7	0	0	0	0	109.9	V803 I855 V918	V803-C818 WeakPolarHBondContact O-CA 3.45Å; C818-I855 HydrophobicContact CB-CD1 4.3Å; C818-V918 HydrophobicContact CB-CG1 4.39Å
819	F	86.9	Confident	68.6	Low	8 Å²	8	51 Å²	51	4%	0.035	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	156.4	172.7	64	-90	0	0	0	112.1	F703 W705 Y802 V803 I805 V817 W821 L823	F703-F819 HydrophobicContact CE2-CD1 4.14Å; F703-F819 HydrophobicContact CE2-CE1 4.02Å; W705-F819 HydrophobicContact CH2-CE2 4.35Å; Y802-F819 WeakPolarHBondContact CA-O 3.38Å; V803-F819 HydrophobicContact CB-CD1 4.42Å; V803-F819 HydrophobicContact CB-CD2 4.37Å; V803-F819 HydrophobicContact CB-CE1 4.01Å; V803-F819 HydrophobicContact CB-CE2 3.94Å; V803-F819 HydrophobicContact CB-CZ 3.75Å; V803-F819 HydrophobicContact CG1-CE1 4.1Å; V803-F819 HydrophobicContact CG1-CZ 3.91Å; V803-F819 HydrophobicContact CG2-CE2 3.95Å; V803-F819 HydrophobicContact CG2-CZ 4.13Å; V803-F819 PolarHBondContact N-O 3.45Å; V803-F819 PolarHBondContact O-N 2.78Å; I805-F819 HydrophobicContact CD1-CE1 3.76Å; I805-F819 HydrophobicContact CD1-CZ 4.33Å; I805-F819 HydrophobicContact CG1-CE1 4.32Å; V817-F819 HydrophobicContact CG1-CD1 4.44Å; F819-W821 HydrophobicContact CE2-CE3 4.3Å; F819-L823 HydrophobicContact CD2-CD2 4.18Å
820	Q	83.1	Confident	66.7	Low	55 Å²	55	56.7 Å²	56.7	26%	0.257	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	135.8	178.1	-169.3	174.9	-13.8	0	0	111	N801 Y802	N801-Q820 HydrophobicContact CB-CG 4.46Å; Y802-Q820 HydrophobicContact CD1-CB 3.98Å; Y802-Q820 HydrophobicContact CD1-CG 4.41Å; Y802-Q820 HydrophobicContact CE1-CB 3.64Å; Y802-Q820 HydrophobicContact CE1-CG 4Å; Y802-Q820 HydrophobicContact CE2-CG 4.36Å; Y802-Q820 PolarHBondContact OH-OE1 3.45Å; Y802-Q820 VanDerWaalsContact OH-OE1 3.14Å
821	W	76.4	Confident	64.6	Low	17 Å²	17	57.1 Å²	57.1	6%	0.064	30%	0.296	C	S	.	.	S	Bend	trans	-107.7	144	169.7	-169	-100.7	0	0	0	110.1	V681 W705 C730 V742 Y782 N801 V803 F819 L823	V681-W821 HydrophobicContact CG1-CB 3.85Å; V681-W821 HydrophobicContact CG1-CG 4.01Å; W705-W821 HydrophobicContact CH2-CZ3 4.14Å; W705-W821 AromaticContact CZ3-CZ3 3.97Å; W705-W821 HydrophobicContact CZ3-CZ3 3.97Å; C730-W821 VanDerWaalsContact SG-CE2 3.58Å; C730-W821 PolarHBondContact SG-NE1 3.39Å; V742-W821 HydrophobicContact CG1-CH2 3.88Å; V742-W821 HydrophobicContact CG1-CZ2 3.97Å; Y782-W821 AromaticContact CD2-CH2 3.83Å; Y782-W821 HydrophobicContact CD2-CH2 3.83Å; Y782-W821 HydrophobicContact CD2-CZ2 4.47Å; Y782-W821 HydrophobicContact CE2-CH2 4.02Å; Y782-W821 HydrophobicContact CE2-CZ2 4.4Å; N801-W821 WeakPolarHBondContact CB-O 3.4Å; N801-W821 PolarHBondContact ND2-O 3.04Å; N801-W821 WeakPolarHBondContact O-CA 3.25Å; N801-W821 VanDerWaalsContact O-CB 3.25Å; N801-W821 WeakPolarHBondContact O-CB 3.44Å; N801-W821 PolarHBondContact O-N 2.82Å; N801-W821 PolarHBondContact OD1-O 3.26Å; V803-W821 HydrophobicContact CG2-CB 4.26Å; F819-W821 HydrophobicContact CE2-CE3 4.3Å; W821-L823 HydrophobicContact CE3-CD1 3.95Å; W821-L823 HydrophobicContact CZ3-CD1 3.75Å
822	P	63.3	Low	62.6	Low	36 Å²	36	60.7 Å²	60.7	23%	0.234	31%	0.31	C	S	.	.	S	Bend	cis	-67.4	148.7	-15.3	-2.1	18.2	0	0	0	110.3	Y683 T824	Y683-P822 HydrophobicContact CD2-CG 3.82Å; Y683-P822 HydrophobicContact CE2-CG 3.52Å; P822-T824 PolarHBondContact O-N 3.09Å
823	L	65.1	Low	60.7	Low	14 Å²	14	63.6 Å²	63.6	7%	0.073	33%	0.325	C	S	.	.			trans	-69.2	128	172.3	-56.5	126.7	0	0	0	108.6	W705 F819 W821 F825 M826	W705-L823 HydrophobicContact CH2-CD1 3.48Å; W705-L823 VanDerWaalsContact CH2-CD1 3.48Å; W705-L823 HydrophobicContact CZ2-CD1 3.53Å; W705-L823 HydrophobicContact CZ3-CD1 4Å; F819-L823 HydrophobicContact CD2-CD2 4.18Å; W821-L823 HydrophobicContact CE3-CD1 3.95Å; W821-L823 HydrophobicContact CZ3-CD1 3.75Å; L823-F825 HydrophobicContact CB-CD1 3.98Å; L823-F825 HydrophobicContact CB-CE1 3.37Å; L823-F825 HydrophobicContact CB-CE2 4.3Å; L823-F825 HydrophobicContact CB-CZ 3.54Å; L823-F825 HydrophobicContact CD1-CE1 4.49Å; L823-F825 HydrophobicContact CD1-CZ 3.99Å; L823-F825 HydrophobicContact CD2-CE1 3.97Å; L823-F825 HydrophobicContact CD2-CZ 4.22Å; L823-F825 HydrophobicContact CG-CE1 4.12Å; L823-F825 HydrophobicContact CG-CZ 4.11Å; L823-F825 PolarHBondContact O-N 2.9Å; L823-F825 VanDerWaalsContact O-N 3.09Å; L823-M826 HydrophobicContact CB-CG 4.02Å; L823-M826 HydrophobicContact CD1-CG 4.5Å; L823-M826 VanDerWaalsContact O-CB 3.26Å; L823-M826 WeakPolarHBondContact O-CB 3.38Å; L823-M826 WeakPolarHBondContact O-CG 3.32Å; L823-M826 PolarHBondContact O-N 2.98Å
824	T	48.9	Very low	58.6	Low	94 Å²	94	69.1 Å²	69.1	58%	0.577	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-29.3	-166.8	34.9	0	0	0	0	114.7	A688 P822 M826 H827	A688-T824 HydrophobicContact CB-CG2 4.31Å; P822-T824 PolarHBondContact O-N 3.09Å; T824-M826 VanDerWaalsContact C-N 3.26Å; T824-M826 PolarHBondContact O-N 3.31Å; T824-H827 PolarHBondContact O-N 3.08Å
825	F	52.9	Low	56	Low	57 Å²	57	76.6 Å²	76.6	25%	0.25	39%	0.392	C	S	.	.	H	α-helix	trans	-66.2	-25.3	174.6	60.3	-97.8	0	0	0	113.5	L823 H827 N828 I848 T850	L823-F825 HydrophobicContact CB-CD1 3.98Å; L823-F825 HydrophobicContact CB-CE1 3.37Å; L823-F825 HydrophobicContact CB-CE2 4.3Å; L823-F825 HydrophobicContact CB-CZ 3.54Å; L823-F825 HydrophobicContact CD1-CE1 4.49Å; L823-F825 HydrophobicContact CD1-CZ 3.99Å; L823-F825 HydrophobicContact CD2-CE1 3.97Å; L823-F825 HydrophobicContact CD2-CZ 4.22Å; L823-F825 HydrophobicContact CG-CE1 4.12Å; L823-F825 HydrophobicContact CG-CZ 4.11Å; L823-F825 PolarHBondContact O-N 2.9Å; L823-F825 VanDerWaalsContact O-N 3.09Å; F825-H827 PolarHBondContact O-N 2.94Å; F825-N828 PolarHBondContact O-N 2.86Å; F825-I848 HydrophobicContact CD2-CD1 3.75Å; F825-I848 HydrophobicContact CD2-CG2 3.96Å; F825-I848 HydrophobicContact CE2-CB 4.42Å; F825-I848 HydrophobicContact CE2-CD1 4.02Å; F825-I848 HydrophobicContact CE2-CG2 3.76Å; F825-I848 HydrophobicContact CZ-CG2 4.24Å; F825-T850 HydrophobicContact CD1-CG2 4.36Å; F825-T850 HydrophobicContact CE1-CG2 3.28Å; F825-T850 HydrophobicContact CE2-CG2 4.34Å; F825-T850 HydrophobicContact CZ-CG2 3.28Å
826	M	52.6	Low	53.5	Low	21 Å²	21	82.2 Å²	82.2	10%	0.103	43%	0.428	C	S	.	.	H	α-helix	trans	-69.5	-23	179.3	-55.3	-92.5	56.8	0	0	112.4	I707 Y782 L823 T824 I848	I707-M826 HydrophobicContact CD1-CE 3.85Å; I707-M826 HydrophobicContact CG1-CE 4.18Å; Y782-M826 HydrophobicContact CD1-CE 4.25Å; Y782-M826 HydrophobicContact CD1-SD 3.97Å; Y782-M826 HydrophobicContact CD2-SD 4.41Å; Y782-M826 HydrophobicContact CE1-CE 3.56Å; Y782-M826 HydrophobicContact CE1-SD 3.51Å; Y782-M826 VanDerWaalsContact CE1-SD 3.51Å; Y782-M826 HydrophobicContact CE2-SD 3.99Å; Y782-M826 HydrophobicContact CG-SD 4.41Å; Y782-M826 VanDerWaalsContact CZ-SD 3.52Å; L823-M826 HydrophobicContact CB-CG 4.02Å; L823-M826 HydrophobicContact CD1-CG 4.5Å; L823-M826 VanDerWaalsContact O-CB 3.26Å; L823-M826 WeakPolarHBondContact O-CB 3.38Å; L823-M826 WeakPolarHBondContact O-CG 3.32Å; L823-M826 PolarHBondContact O-N 2.98Å; T824-M826 VanDerWaalsContact C-N 3.26Å; T824-M826 PolarHBondContact O-N 3.31Å; M826-I848 HydrophobicContact CE-CD1 3.98Å
827	H	42.8	Very low	50.6	Low	131 Å²	131	87.6 Å²	87.6	61%	0.606	47%	0.465	S	S	*	.	H	α-helix	trans	-89.2	-25.6	177.8	-130.7	74.3	0	0	0	112.7	T824 F825	T824-H827 PolarHBondContact O-N 3.08Å; F825-H827 PolarHBondContact O-N 2.94Å
828	N	36.7	Very low	47.8	Very low	103 Å²	103	93.3 Å²	93.3	55%	0.551	51%	0.505	S	S	*	.	H	α-helix	trans	-85.1	-9.7	-169.9	-75.4	-6.6	0	0	0	114.9	F825 H830 N831	F825-N828 PolarHBondContact O-N 2.86Å; N828-H830 PolarHBondContact O-N 3.2Å; N828-N831 PolarHBondContact O-N 2.98Å; N828-N831 VanDerWaalsContact O-N 3.16Å
829	Q	40.8	Very low	45.3	Very low	124 Å²	124	96.7 Å²	96.7	58%	0.579	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-21.5	177.1	-76.2	-168.7	-28	0	0	113.8
830	H	37.6	Very low	42.8	Very low	154 Å²	154	105.3 Å²	105.3	71%	0.713	57%	0.571	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.6	-5.1	176.5	-87.1	-54.2	0	0	0	115.3	N828	N828-H830 PolarHBondContact O-N 3.2Å
831	N	28.7	Very low	40.7	Very low	121 Å²	121	108.7 Å²	108.7	65%	0.647	59%	0.59	S	S	*	*	S	Bend	trans	-130.2	108.3	-179.9	-79.4	-53.1	0	0	0	112.1	N828 T833	N828-N831 PolarHBondContact O-N 2.98Å; N828-N831 VanDerWaalsContact O-N 3.16Å; N831-T833 PolarHBondContact O-N 2.86Å
832	H	29.3	Very low	38.7	Very low	201 Å²	201	113.9 Å²	113.9	93%	0.931	62%	0.619	S	S	*	*			trans	-71.5	70.7	173.1	-86.1	-61.4	0	0	0	112.5
833	T	26.4	Very low	37.5	Very low	122 Å²	122	117.8 Å²	117.8	75%	0.748	65%	0.647	S	S	*	*			trans	-175.2	131.8	155.3	8.1	0	0	0	0	111.2	N831	N831-T833 PolarHBondContact O-N 2.86Å
834	I	30.3	Very low	36.6	Very low	152 Å²	152	122.9 Å²	122.9	78%	0.779	68%	0.679	S	S	*	*			trans	161.9	141.5	139.3	-86.8	157.4	0	0	0	109.6
835	N	25	Very low	36.7	Very low	161 Å²	161	123.9 Å²	123.9	86%	0.861	68%	0.68	S	S	*	*			trans	-90.1	122.4	-179.9	-52.1	-59.2	0	0	0	111.2
836	T	29.7	Very low	37.3	Very low	137 Å²	137	124.9 Å²	124.9	84%	0.84	69%	0.688	S	S	*	*			trans	-145.4	144.1	151.6	36.3	0	0	0	0	109.5
837	S	28.2	Very low	38.2	Very low	113 Å²	113	128.9 Å²	128.9	79%	0.79	71%	0.705	S	S	*	*			trans	-74.1	159.7	-176.7	44.9	0	0	0	0	113.3
838	S	30.3	Very low	39.9	Very low	120 Å²	120	124 Å²	124	84%	0.839	68%	0.683	S	S	*	*	S	Bend	trans	84.3	44.8	163.5	-49.4	0	0	0	0	118.8
839	S	36.5	Very low	41.9	Very low	90 Å²	90	124.5 Å²	124.5	63%	0.629	68%	0.682	S	S	*	*			trans	-147.1	141	148.5	60.4	0	0	0	0	111.6	I841	S839-I841 PolarHBondContact O-N 3.39Å
840	M	33.7	Very low	43.8	Very low	188 Å²	188	119.3 Å²	119.3	93%	0.926	66%	0.659	S	S	*	*			trans	-90.6	97.5	173.2	-76.7	-171.2	172.5	0	0	109.8	N842	M840-N842 PolarHBondContact O-N 3.09Å
841	I	39.8	Very low	46	Very low	127 Å²	127	117.9 Å²	117.9	65%	0.651	65%	0.651	S	S	*	*			trans	-90.3	96.2	173.5	-57.5	174.3	0	0	0	108.4	S839 S843	S839-I841 PolarHBondContact O-N 3.39Å; I841-S843 PolarHBondContact O-N 3.3Å
842	N	33.4	Very low	48.6	Very low	126 Å²	126	113.2 Å²	113.2	67%	0.674	63%	0.625	S	S	*	*			trans	-77.3	110.6	169.3	-82.3	-18.5	0	0	0	109.1	M840 T844	M840-N842 PolarHBondContact O-N 3.09Å; N842-T844 PolarHBondContact O-N 2.97Å
843	S	38.7	Very low	51.3	Low	118 Å²	118	106.1 Å²	106.1	83%	0.825	59%	0.592	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	42.3	-169.8	64.7	0	0	0	0	114.7	I841	I841-S843 PolarHBondContact O-N 3.3Å
844	T	45.6	Very low	54	Low	121 Å²	121	101.4 Å²	101.4	74%	0.742	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-143.7	0.3	-176.7	50.8	0	0	0	0	114.7	N842	N842-T844 PolarHBondContact O-N 2.97Å
845	L	51.8	Low	56.7	Low	114 Å²	114	94.7 Å²	94.7	60%	0.597	53%	0.527	S	S	*	.	S	Bend	trans	-137.6	144	170.9	-78.9	92.4	0	0	0	110.8	K847	L845-K847 HydrophobicContact CB-CB 4.46Å; L845-K847 HydrophobicContact CB-CG 4.48Å; L845-K847 HydrophobicContact CD2-CD 4.25Å; L845-K847 PolarHBondContact O-N 2.86Å
846	N	65.2	Low	59.4	Low	79 Å²	79	89 Å²	89	42%	0.422	50%	0.496	S	S	.	.	S	Bend	trans	-76	35	176.8	-59	-38.1	0	0	0	113.5	I707 E709	I707-N846 HydrophobicContact CB-CB 4.48Å; I707-N846 PolarHBondContact N-O 3.31Å; E709-N846 VanDerWaalsContact CG-ND2 3.3Å; E709-N846 WeakPolarHBondContact CG-ND2 3.32Å; E709-N846 PolarHBondContact OE1-ND2 3.16Å
847	K	71.9	Confident	61.8	Low	105 Å²	105	82.6 Å²	82.6	46%	0.457	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118	123	-174.2	-64.4	-168.7	168.9	-84.4	0	110.4	T704 W705 D706 L845	T704-K847 HydrophobicContact CG2-CB 4.47Å; W705-K847 CarbonylContact O-C 3.57Å; W705-K847 VanDerWaalsContact O-CA 3.31Å; W705-K847 WeakPolarHBondContact O-CA 3.38Å; D706-K847 WeakPolarHBondContact OD1-CG 3.19Å; D706-K847 IonicContact OD1-NZ 3.48Å; D706-K847 PolarHBondContact OD1-NZ 2.75Å; D706-K847 IonicContact OD2-NZ 2.68Å; D706-K847 PolarHBondContact OD2-NZ 2.93Å; L845-K847 HydrophobicContact CB-CB 4.46Å; L845-K847 HydrophobicContact CB-CG 4.48Å; L845-K847 HydrophobicContact CD2-CD 4.25Å; L845-K847 PolarHBondContact O-N 2.86Å
848	I	78.2	Confident	64.1	Low	29 Å²	29	80.3 Å²	80.3	15%	0.149	44%	0.44	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	138.7	174.4	-60.7	179.7	0	0	0	108.6	W705 I707 F825 M826 T850	W705-I848 HydrophobicContact CB-CB 4.43Å; W705-I848 PolarHBondContact N-O 3.21Å; W705-I848 PolarHBondContact O-N 3.27Å; I707-I848 HydrophobicContact CD1-CD1 3.94Å; F825-I848 HydrophobicContact CD2-CD1 3.75Å; F825-I848 HydrophobicContact CD2-CG2 3.96Å; F825-I848 HydrophobicContact CE2-CB 4.42Å; F825-I848 HydrophobicContact CE2-CD1 4.02Å; F825-I848 HydrophobicContact CE2-CG2 3.76Å; F825-I848 HydrophobicContact CZ-CG2 4.24Å; M826-I848 HydrophobicContact CE-CD1 3.98Å; I848-T850 HydrophobicContact CG2-CG2 4.45Å
849	Q	78.9	Confident	65.8	Low	112 Å²	112	77.9 Å²	77.9	52%	0.523	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134	174.2	-66	-173.3	-47.7	0	0	110.7	E702 F703 T704 N787	E702-Q849 HydrophobicContact CG-CB 4.41Å; F703-Q849 WeakPolarHBondContact O-CA 3.48Å; T704-Q849 HydrophobicContact CG2-CG 4.24Å; T704-Q849 PolarHBondContact OG1-NE2 2.71Å; N787-Q849 PolarHBondContact ND2-NE2 2.85Å
850	T	81.2	Confident	66.6	Low	15 Å²	15	78 Å²	78	9%	0.092	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.9	147.7	176.6	63.9	0	0	0	0	111.1	E702 F703 W705 F825 I848 H852	E702-T850 CarbonylContact C-O 3.57Å; E702-T850 VanDerWaalsContact CA-O 3.26Å; E702-T850 WeakPolarHBondContact CA-O 3.03Å; F703-T850 PolarHBondContact N-O 2.97Å; F703-T850 PolarHBondContact O-N 2.81Å; W705-T850 PolarHBondContact NE1-OG1 3.12Å; F825-T850 HydrophobicContact CD1-CG2 4.36Å; F825-T850 HydrophobicContact CE1-CG2 3.28Å; F825-T850 HydrophobicContact CE2-CG2 4.34Å; F825-T850 HydrophobicContact CZ-CG2 3.28Å; I848-T850 HydrophobicContact CG2-CG2 4.45Å; T850-H852 WeakPolarHBondContact CB-NE2 3.49Å; T850-H852 PolarHBondContact OG1-CD2 2.94Å; T850-H852 PolarHBondContact OG1-NE2 3.46Å
851	K	82.4	Confident	67.4	Low	125 Å²	125	74.3 Å²	74.3	54%	0.543	40%	0.398	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	132.5	175.8	-65.6	-174.7	178	-175.1	0	110.2	I701 E702	I701-K851 WeakPolarHBondContact O-CA 2.96Å; E702-K851 HydrophobicContact CB-CG 4.44Å; E702-K851 HydrophobicContact CG-CG 4.18Å; E702-K851 WeakPolarHBondContact OE1-CE 3.31Å; E702-K851 IonicContact OE1-NZ 2.67Å; E702-K851 PolarHBondContact OE1-NZ 3.18Å
852	H	85	Confident	68.1	Low	23 Å²	23	72.9 Å²	72.9	11%	0.106	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	140.6	-177.5	-60.7	-80.8	0	0	0	110.5	Y700 I701 F703 V817 T850 L854	Y700-H852 WeakPolarHBondContact CA-O 3.43Å; I701-H852 HydrophobicContact CG2-CB 4.05Å; I701-H852 PolarHBondContact N-O 2.74Å; I701-H852 PolarHBondContact O-N 2.67Å; F703-H852 AromaticContact CD2-CD2 3.35Å; F703-H852 WeakPolarHBondContact CD2-CD2 3.45Å; F703-H852 AromaticContact CD2-NE2 3.59Å; F703-H852 AromaticContact CE2-CD2 3.57Å; V817-H852 HydrophobicContact CG1-CB 3.66Å; T850-H852 WeakPolarHBondContact CB-NE2 3.49Å; T850-H852 PolarHBondContact OG1-CD2 2.94Å; T850-H852 PolarHBondContact OG1-NE2 3.46Å; H852-L854 PolarHBondContact O-N 2.64Å
853	K	84.4	Confident	69.2	Low	52 Å²	52	67.1 Å²	67.1	23%	0.226	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.1	118.4	174.5	-176.2	-169.6	-174.5	-164.9	0	108.3	Y700 I855 S920 G921 D922	Y700-K853 HydrophobicContact CE1-CB 4.49Å; K853-I855 HydrophobicContact CD-CD1 4.45Å; K853-I855 HydrophobicContact CD-CG1 4.01Å; K853-I855 HydrophobicContact CG-CG1 4.02Å; K853-S920 PolarHBondContact NZ-O 3.04Å; K853-G921 PolarHBondContact NZ-O 3.09Å; K853-D922 IonicContact NZ-OD1 3.21Å; K853-D922 PolarHBondContact NZ-OD1 2.96Å
854	L	84.6	Confident	70.4	Confident	23 Å²	23	66 Å²	66	12%	0.12	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	124.8	168.7	-166	66	0	0	0	107.2	E699 I701 H815 V817 H852	E699-L854 HydrophobicContact CB-CB 4Å; E699-L854 HydrophobicContact CB-CD2 4.18Å; E699-L854 WeakPolarHBondContact O-CB 3.39Å; E699-L854 PolarHBondContact O-N 3.01Å; I701-L854 HydrophobicContact CB-CD1 4.39Å; H815-L854 HydrophobicContact CB-CD1 3.63Å; H815-L854 HydrophobicContact CB-CD2 4.35Å; H815-L854 HydrophobicContact CB-CG 3.98Å; V817-L854 HydrophobicContact CG2-CD1 3.73Å; H852-L854 PolarHBondContact O-N 2.64Å
855	I	85.9	Confident	71.4	Confident	11 Å²	11	60.8 Å²	60.8	6%	0.056	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.8	105.7	-173.8	-58	161	0	0	0	107.1	I816 C818 K853 L916 F923	I816-I855 HydrophobicContact CB-CB 4.1Å; I816-I855 WeakPolarHBondContact CB-O 3.32Å; I816-I855 HydrophobicContact CG2-CB 4.46Å; I816-I855 HydrophobicContact CG2-CD1 4.42Å; I816-I855 PolarHBondContact N-O 3.11Å; I816-I855 WeakPolarHBondContact O-CB 3.36Å; I816-I855 PolarHBondContact O-N 2.69Å; C818-I855 HydrophobicContact CB-CD1 4.3Å; K853-I855 HydrophobicContact CD-CD1 4.45Å; K853-I855 HydrophobicContact CD-CG1 4.01Å; K853-I855 HydrophobicContact CG-CG1 4.02Å; I855-L916 HydrophobicContact CG2-CD1 4.41Å; I855-F923 HydrophobicContact CG2-CE2 3.73Å; I855-F923 HydrophobicContact CG2-CZ 3.78Å
856	N	82.5	Confident	72.5	Confident	40 Å²	40	59.1 Å²	59.1	21%	0.214	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	154.3	178.8	-59.9	3.6	0	0	0	110.3	E699 H815 E860 F923	E699-N856 PolarHBondContact OE2-ND2 2.83Å; H815-N856 PolarHBondContact ND1-OD1 3.29Å; N856-E860 WeakPolarHBondContact CB-OE1 3.33Å; N856-E860 PolarHBondContact ND2-OE1 3.06Å; N856-F923 WeakPolarHBondContact O-CE2 3.39Å
857	L	80.1	Confident	73.4	Confident	3 Å²	3	55.8 Å²	55.8	2%	0.016	30%	0.297	C	S	.	.			trans	-72.4	137.2	177	-67.4	172.5	0	0	0	110.3	T814 I816 F859 E860 L905 T907 Y914 F923	T814-L857 HydrophobicContact CG2-CD1 4.14Å; I816-L857 HydrophobicContact CD1-CD2 3.73Å; L857-F859 PolarHBondContact O-N 2.86Å; L857-E860 WeakPolarHBondContact O-CG 3.49Å; L857-E860 PolarHBondContact O-N 3.2Å; L857-L905 HydrophobicContact CD2-CD1 3.61Å; L857-T907 HydrophobicContact CD1-CG2 3.63Å; L857-Y914 HydrophobicContact CD2-CD2 4.25Å; L857-Y914 HydrophobicContact CD2-CE2 4.2Å; L857-F923 HydrophobicContact CD2-CZ 4.33Å
858	P	75	Confident	74	Confident	65 Å²	65	52.2 Å²	52.2	42%	0.422	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-20.9	-174.3	-29.4	35.9	0	0	0	116.4	Y914 F923	P858-Y914 HydrophobicContact CB-CE1 4.07Å; P858-Y914 HydrophobicContact CG-CD1 4.07Å; P858-Y914 HydrophobicContact CG-CE1 3.73Å; P858-F923 HydrophobicContact CG-CD2 3.68Å; P858-F923 HydrophobicContact CG-CE2 3.87Å; P858-F923 HydrophobicContact CG-CG 4.18Å; P858-F923 HydrophobicContact CG-CZ 4.5Å
859	F	65.9	Low	74.5	Confident	70 Å²	70	52.3 Å²	52.3	31%	0.307	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	-129.3	61.7	-179.8	-55.7	-56.9	0	0	0	110.9	L857 S861 L862 H912 Y914	L857-F859 PolarHBondContact O-N 2.86Å; F859-S861 PolarHBondContact O-N 2.84Å; F859-S861 VanDerWaalsContact O-N 3.1Å; F859-L862 PolarHBondContact O-N 2.87Å; F859-H912 AromaticContact CD2-CD2 3.68Å; F859-H912 AromaticContact CD2-NE2 3.63Å; F859-Y914 HydrophobicContact CD2-CE1 4.24Å; F859-Y914 WeakPolarHBondContact CD2-OH 3.3Å
860	E	55.1	Low	74.9	Confident	91 Å²	91	47.5 Å²	47.5	43%	0.425	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-47.2	-40.4	-175.8	-63.2	-176	156.8	0	0	113.8	N856 L857 L862 S863	N856-E860 WeakPolarHBondContact CB-OE1 3.33Å; N856-E860 PolarHBondContact ND2-OE1 3.06Å; L857-E860 WeakPolarHBondContact O-CG 3.49Å; L857-E860 PolarHBondContact O-N 3.2Å; E860-L862 VanDerWaalsContact C-N 3.26Å; E860-L862 PolarHBondContact O-N 3.37Å; E860-L862 VanDerWaalsContact O-N 3.13Å; E860-S863 WeakPolarHBondContact CA-OG 3.29Å; E860-S863 PolarHBondContact O-N 3.36Å; E860-S863 PolarHBondContact O-OG 3.37Å
861	S	50.4	Low	74.8	Confident	112 Å²	112	48.8 Å²	48.8	78%	0.783	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-66.6	-13.2	-169.1	53.7	0	0	0	0	116.3	F859	F859-S861 PolarHBondContact O-N 2.84Å; F859-S861 VanDerWaalsContact O-N 3.1Å
862	L	54	Low	74.1	Confident	97 Å²	97	43.5 Å²	43.5	51%	0.508	25%	0.251	S	S	.	.	G	3₁₀ helix	trans	-109.4	-7	171.5	-66.7	94.4	0	0	0	113	F859 E860 T864 G910	F859-L862 PolarHBondContact O-N 2.87Å; E860-L862 VanDerWaalsContact C-N 3.26Å; E860-L862 PolarHBondContact O-N 3.37Å; E860-L862 VanDerWaalsContact O-N 3.13Å; L862-T864 VanDerWaalsContact C-N 3.3Å; L862-T864 PolarHBondContact O-N 2.83Å; L862-G910 WeakPolarHBondContact O-CA 3.44Å
863	S	56.8	Low	73	Confident	4 Å²	4	46.8 Å²	46.8	3%	0.028	27%	0.265	C	S	.	.			trans	-87.9	38.9	-162	68.2	0	0	0	0	115.5	E860 G865 T907	E860-S863 WeakPolarHBondContact CA-OG 3.29Å; E860-S863 PolarHBondContact O-N 3.36Å; E860-S863 PolarHBondContact O-OG 3.37Å; S863-G865 PolarHBondContact O-N 3.16Å; S863-T907 WeakPolarHBondContact CA-OG1 3.42Å; S863-T907 WeakPolarHBondContact CB-OG1 3.47Å
864	T	62.9	Low	71.3	Confident	95 Å²	95	46.9 Å²	46.9	58%	0.583	27%	0.272	S	S	*	.			trans	-84.4	65.1	-172.7	47	0	0	0	0	114.2	L862	L862-T864 VanDerWaalsContact C-N 3.3Å; L862-T864 PolarHBondContact O-N 2.83Å
865	G	67.8	Low	68.9	Low	12 Å²	12	50.4 Å²	50.4	12%	0.124	30%	0.298	C	S	.	.	S	Bend	trans	-165.5	170.3	177.6	0	0	0	0	0	114.5	T814 S863 T907	T814-G865 PolarHBondContact OG1-O 3.26Å; S863-G865 PolarHBondContact O-N 3.16Å; G865-T907 WeakPolarHBondContact O-CG2 3.48Å
866	P	74.1	Confident	66.3	Low	78 Å²	78	54.1 Å²	54.1	51%	0.506	33%	0.326	S	S	.	.			trans	-59.6	145.4	178.1	25.6	-35.8	0	0	0	112.2	I868 A908	P866-I868 PolarHBondContact O-N 3.39Å; P866-A908 HydrophobicContact CG-CB 4.35Å; P866-A908 PolarHBondContact O-N 3.39Å
867	L	83.9	Confident	63.6	Low	9 Å²	9	58.4 Å²	58.4	5%	0.047	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	113.2	178.4	-165.8	66.2	0	0	0	111.1	N794 T814 I816 M869 L905 T907	N794-L867 PolarHBondContact ND2-N 3.21Å; N794-L867 WeakPolarHBondContact OD1-CB 3.22Å; N794-L867 PolarHBondContact OD1-N 3.37Å; T814-L867 HydrophobicContact CG2-CB 3.88Å; T814-L867 HydrophobicContact CG2-CD1 3.92Å; T814-L867 HydrophobicContact CG2-CD2 4.26Å; T814-L867 HydrophobicContact CG2-CG 4.23Å; I816-L867 HydrophobicContact CD1-CD2 4.28Å; I816-L867 HydrophobicContact CG1-CD2 3.75Å; L867-M869 HydrophobicContact CD2-CE 4.1Å; L867-M869 HydrophobicContact CD2-CG 3.88Å; L867-M869 HydrophobicContact CD2-SD 3.59Å; L867-M869 VanDerWaalsContact CD2-SD 3.59Å; L867-M869 HydrophobicContact CG-CG 3.82Å; L867-M869 HydrophobicContact CG-SD 4.22Å; L867-L905 HydrophobicContact CD1-CB 4.27Å; L867-L905 HydrophobicContact CD1-CD1 4.13Å; L867-T907 HydrophobicContact CD1-CG2 4.06Å
868	I	85.2	Confident	61	Low	30 Å²	30	63.6 Å²	63.6	15%	0.154	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89	130.8	171.7	-58.7	158.8	0	0	0	107	P866 L905 G906 L936 I939	P866-I868 PolarHBondContact O-N 3.39Å; I868-L905 CarbonylContact O-C 3.56Å; I868-L905 WeakPolarHBondContact O-CA 3.47Å; I868-G906 PolarHBondContact N-O 3.46Å; I868-G906 PolarHBondContact O-N 2.93Å; I868-L936 HydrophobicContact CD1-CB 4.18Å; I868-L936 HydrophobicContact CD1-CD2 4.29Å; I868-L936 HydrophobicContact CD1-CG 3.88Å; I868-L936 VanDerWaalsContact CD1-O 3.24Å; I868-L936 WeakPolarHBondContact CD1-O 3.37Å; I868-I939 HydrophobicContact CB-CD1 4.45Å; I868-I939 HydrophobicContact CG2-CB 4.35Å; I868-I939 HydrophobicContact CG2-CD1 3.98Å; I868-I939 HydrophobicContact CG2-CG1 3.78Å
869	M	87.9	Confident	58.7	Low	31 Å²	31	65 Å²	65	15%	0.153	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	146.9	-179.2	-61.1	-168.7	-79.5	0	0	112.1	G795 I797 C804 L867 I903 W904 L905	G795-M869 VanDerWaalsContact C-CE 3.41Å; G795-M869 WeakPolarHBondContact O-CE 3.44Å; I797-M869 HydrophobicContact CB-CB 4.41Å; I797-M869 HydrophobicContact CB-CE 4.3Å; I797-M869 HydrophobicContact CD1-CB 4.25Å; I797-M869 HydrophobicContact CG2-CB 4Å; I797-M869 HydrophobicContact CG2-CE 3.85Å; I797-M869 HydrophobicContact CG2-SD 3.73Å; C804-M869 VanDerWaalsContact SG-SD 3.68Å; L867-M869 HydrophobicContact CD2-CE 4.1Å; L867-M869 HydrophobicContact CD2-CG 3.88Å; L867-M869 HydrophobicContact CD2-SD 3.59Å; L867-M869 VanDerWaalsContact CD2-SD 3.59Å; L867-M869 HydrophobicContact CG-CG 3.82Å; L867-M869 HydrophobicContact CG-SD 4.22Å; M869-I903 HydrophobicContact CB-CG2 4.14Å; M869-I903 HydrophobicContact CG-CG2 4.41Å; M869-I903 HydrophobicContact SD-CG2 4.37Å; M869-W904 CarbonylContact C-O 3.36Å; M869-W904 VanDerWaalsContact CA-O 3.31Å; M869-W904 WeakPolarHBondContact CA-O 3.26Å; M869-L905 HydrophobicContact CG-CB 3.87Å
870	A	86.9	Confident	56.8	Low	12 Å²	12	68 Å²	68	10%	0.099	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	137.4	169.1	0	0	0	0	0	110.2	W904 I939 I941	A870-W904 PolarHBondContact N-O 3.09Å; A870-W904 PolarHBondContact O-N 2.79Å; A870-I939 HydrophobicContact CB-CB 3.91Å; A870-I939 HydrophobicContact CB-CG2 3.71Å; A870-I941 HydrophobicContact CB-CD1 3.9Å; A870-I941 HydrophobicContact CB-CG1 4.31Å; A870-I941 WeakPolarHBondContact O-CD1 3.41Å
871	S	79.9	Confident	55.5	Low	42 Å²	42	68 Å²	68	29%	0.294	44%	0.441	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	148.2	175.3	47.1	0	0	0	0	110.9	I797 I941	I797-S871 VanDerWaalsContact CD1-N 3.28Å; S871-I941 VanDerWaalsContact C-CD1 3.47Å; S871-I941 WeakPolarHBondContact O-CD1 3.45Å
872	S	68.5	Low	54.3	Low	13 Å²	13	68 Å²	68	9%	0.091	44%	0.441	C	S	.	.	P	Polyproline II helix	trans	-63.4	146.6	169.8	48.3	0	0	0	0	110.7	R799 N900 Y902	R799-S872 VanDerWaalsContact CZ-O 3.29Å; R799-S872 PolarHBondContact NH1-O 3.29Å; R799-S872 PolarHBondContact NH2-O 3.18Å; R799-S872 PolarHBondContact NH2-OG 3.42Å; S872-N900 PolarHBondContact OG-O 3.13Å; S872-Y902 PolarHBondContact N-O 3.33Å; S872-Y902 PolarHBondContact OG-O 2.91Å
873	F	60.6	Low	53.1	Low	93 Å²	93	69.5 Å²	69.5	41%	0.408	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-62.3	150	168.4	-70.3	-91.5	0	0	0	110.3	R799 I941 P943	R799-F873 PolarHBondContact NH2-O 3.25Å; F873-I941 WeakPolarHBondContact CE2-O 3.24Å; F873-P943 HydrophobicContact CB-CB 4.23Å; F873-P943 HydrophobicContact CD2-CB 4.01Å; F873-P943 HydrophobicContact CD2-CG 3.79Å; F873-P943 HydrophobicContact CE2-CG 4.22Å; F873-P943 HydrophobicContact CG-CB 4.38Å; F873-P943 HydrophobicContact CG-CG 4.3Å
874	S	48.2	Very low	51.7	Low	53 Å²	53	75 Å²	75	37%	0.371	50%	0.498	S	S	.	.			trans	-96	115.8	167	21.6	0	0	0	0	109.3	R799 S876	R799-S874 PolarHBondContact NH1-OG 3.48Å; S874-S876 PolarHBondContact O-N 3.48Å
875	S	35.3	Very low	50.1	Low	97 Å²	97	75.3 Å²	75.3	68%	0.678	50%	0.504	S	S	*	.			trans	-77.5	58.9	175.9	59.9	0	0	0	0	111.1	T877	S875-T877 VanDerWaalsContact C-N 3.26Å; S875-T877 PolarHBondContact O-N 2.87Å
876	S	30.2	Very low	48.2	Very low	90 Å²	90	82.5 Å²	82.5	63%	0.629	54%	0.54	S	S	*	.			trans	-90.1	33.6	-175.6	63.2	0	0	0	0	113.6	S874 S878	S874-S876 PolarHBondContact O-N 3.48Å; S876-S878 PolarHBondContact O-N 3.21Å; S876-S878 VanDerWaalsContact O-N 3.07Å
877	T	26.6	Very low	45.9	Very low	130 Å²	130	87.6 Å²	87.6	80%	0.798	56%	0.557	S	S	*	*			trans	-77.8	73.8	161.4	47.1	0	0	0	0	109.1	S875 S879	S875-T877 VanDerWaalsContact C-N 3.26Å; S875-T877 PolarHBondContact O-N 2.87Å; T877-S879 VanDerWaalsContact C-N 3.27Å; T877-S879 PolarHBondContact O-N 2.9Å
878	S	26.5	Very low	43.1	Very low	111 Å²	111	93 Å²	93	78%	0.776	59%	0.594	S	S	*	*			trans	-70.9	83.6	172.7	56.6	0	0	0	0	109.9	S876 S880	S876-S878 PolarHBondContact O-N 3.21Å; S876-S878 VanDerWaalsContact O-N 3.07Å; S878-S880 PolarHBondContact O-N 3.28Å; S878-S880 VanDerWaalsContact O-N 3.12Å
879	S	26.2	Very low	40.2	Very low	96 Å²	96	96.2 Å²	96.2	67%	0.671	62%	0.619	S	S	*	*			trans	-60.3	112.1	175	53.3	0	0	0	0	110.1	T877 S881	T877-S879 VanDerWaalsContact C-N 3.27Å; T877-S879 PolarHBondContact O-N 2.9Å; S879-S881 PolarHBondContact O-N 2.98Å; S879-S881 PolarHBondContact O-OG 3.31Å
880	S	25	Very low	37.3	Very low	131 Å²	131	101.2 Å²	101.2	92%	0.916	65%	0.651	S	S	*	*			trans	-74.6	46.4	177.5	43.3	0	0	0	0	112.6	S878 S882	S878-S880 PolarHBondContact O-N 3.28Å; S878-S880 VanDerWaalsContact O-N 3.12Å; S880-S882 PolarHBondContact O-N 2.91Å
881	S	27.7	Very low	34.4	Very low	93 Å²	93	109.2 Å²	109.2	65%	0.65	69%	0.689	S	S	*	*			trans	-83.5	108.7	178.5	54.1	0	0	0	0	111	S879 S883	S879-S881 PolarHBondContact O-N 2.98Å; S879-S881 PolarHBondContact O-OG 3.31Å; S881-S883 PolarHBondContact O-N 3.49Å
882	S	27	Very low	31.7	Very low	110 Å²	110	114.4 Å²	114.4	77%	0.769	71%	0.713	S	S	*	*			trans	-33.1	125.6	175.8	52.3	0	0	0	0	115.6	S880 S884	S880-S882 PolarHBondContact O-N 2.91Å; S882-S884 PolarHBondContact O-N 3.18Å
883	S	27	Very low	29.8	Very low	130 Å²	130	122.8 Å²	122.8	91%	0.909	75%	0.751	S	S	*	*			trans	-65.7	123	171	40.5	0	0	0	0	111.7	S881	S881-S883 PolarHBondContact O-N 3.49Å
884	S	28.6	Very low	28.1	Very low	118 Å²	118	125.3 Å²	125.3	83%	0.825	77%	0.769	S	S	*	*			trans	-132	147	161.4	58.9	0	0	0	0	109.3	S882	S882-S884 PolarHBondContact O-N 3.18Å
885	S	27.8	Very low	27.1	Very low	102 Å²	102	129.4 Å²	129.4	71%	0.713	79%	0.787	S	S	*	*			trans	-84.3	141.6	-162.3	51.7	0	0	0	0	114
886	N	30	Very low	26.8	Very low	163 Å²	163	131.3 Å²	131.3	87%	0.872	79%	0.788	S	S	*	*				-171	166.2	114.5	-92.6	-29.1	0	0	0	113.5
887	Q	25.3	Very low	26.7	Very low	186 Å²	186	133 Å²	133	87%	0.869	80%	0.8	S	S	*	*			trans	-105.6	139.2	-169	-61.7	170.8	-33	0	0	113.3
888	C	24.5	Very low	27.1	Very low	122 Å²	122	132 Å²	132	82%	0.824	80%	0.797	S	S	*	*			trans	-168.3	94.2	148.7	-97.6	0	0	0	0	108.1
889	S	25.1	Very low	27.7	Very low	97 Å²	97	130.1 Å²	130.1	68%	0.678	78%	0.778	S	S	*	*				71.3	88.7	70.3	77.8	0	0	0	0	115.5
890	T	26.1	Very low	28.9	Very low	136 Å²	136	129.3 Å²	129.3	83%	0.834	77%	0.767	S	S	*	*				165.7	159.5	115.5	38.6	0	0	0	0	112.3
891	M	25.8	Very low	31	Very low	180 Å²	180	125 Å²	125	89%	0.887	73%	0.733	S	S	*	*			trans	74.4	152.7	-178	-56	-55.4	-169.1	0	0	116.8
892	N	24.4	Very low	33.5	Very low	152 Å²	152	123.5 Å²	123.5	81%	0.813	71%	0.714	S	S	*	*			trans	-105.2	113.3	-159.4	-63.4	-31.9	0	0	0	113.1
893	E	27.9	Very low	36.3	Very low	189 Å²	189	118.3 Å²	118.3	88%	0.883	68%	0.677	S	S	*	*			trans	-133.5	36.7	166.7	-68.8	-159.9	145.7	0	0	113.1	N895	E893-N895 PolarHBondContact O-N 3.35Å; E893-N895 VanDerWaalsContact O-N 3.12Å
894	N	24.6	Very low	39.3	Very low	146 Å²	146	112.8 Å²	112.8	78%	0.781	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	101.9	175.8	-68.1	-18	0	0	0	111
895	N	26.6	Very low	42.1	Very low	139 Å²	139	107.1 Å²	107.1	74%	0.743	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	160.6	-0.5	141.4	-82.2	-10.3	0	0	0	115.2	E893	E893-N895 PolarHBondContact O-N 3.35Å; E893-N895 VanDerWaalsContact O-N 3.12Å
896	I	29.8	Very low	44.9	Very low	137 Å²	137	102.3 Å²	102.3	70%	0.703	56%	0.563	S	S	*	*			trans	-95.1	11.6	-171.9	-64.5	174.4	0	0	0	113.5	S898 I899	I896-S898 PolarHBondContact O-N 3.16Å; I896-I899 HydrophobicContact CB-CD1 4.5Å; I896-I899 HydrophobicContact CG1-CD1 4.44Å; I896-I899 HydrophobicContact CG2-CD1 4.21Å
897	S	29.1	Very low	47.3	Very low	126 Å²	126	94.6 Å²	94.6	88%	0.881	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	10.4	-176.3	62.4	0	0	0	0	116
898	S	33.7	Very low	49.7	Very low	107 Å²	107	87.1 Å²	87.1	75%	0.748	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	11.3	-179.1	56	0	0	0	0	113.6	I896	I896-S898 PolarHBondContact O-N 3.16Å
899	I	39.6	Very low	51.9	Low	73 Å²	73	82.7 Å²	82.7	37%	0.374	47%	0.467	S	S	.	.			trans	-108.3	102.9	-164	-80.7	169.1	0	0	0	110.2	I896 Y902	I896-I899 HydrophobicContact CB-CD1 4.5Å; I896-I899 HydrophobicContact CG1-CD1 4.44Å; I896-I899 HydrophobicContact CG2-CD1 4.21Å; I899-Y902 HydrophobicContact CG2-CE2 3.54Å; I899-Y902 VanDerWaalsContact CG2-OH 3.24Å; I899-Y902 WeakPolarHBondContact CG2-OH 3.31Å
900	N	52.2	Low	54.1	Low	79 Å²	79	78.2 Å²	78.2	42%	0.422	44%	0.436	S	S	.	.			trans	-161.6	3.6	175.3	-103.3	-34.3	0	0	0	116.9	R799 S872 Y902	R799-N900 PolarHBondContact NE-O 2.94Å; R799-N900 PolarHBondContact NH2-O 2.69Å; S872-N900 PolarHBondContact OG-O 3.13Å; N900-Y902 PolarHBondContact O-N 3.31Å
901	D	69	Low	56.5	Low	40 Å²	40	72.4 Å²	72.4	21%	0.214	40%	0.403	C	S	.	.			trans	-100.9	68.5	-176.3	-79	-8.6	0	0	0	112.9	R799 V918 Q919	R799-D901 HydrophobicContact CG-CB 4.1Å; R799-D901 IonicContact CZ-OD1 2.72Å; R799-D901 IonicContact NE-OD1 2.64Å; R799-D901 PolarHBondContact NE-OD1 2.89Å; D901-V918 WeakPolarHBondContact O-CG2 3.21Å; D901-V918 PolarHBondContact O-N 3.14Å; D901-Q919 HydrophobicContact CB-CG 4.31Å; D901-Q919 PolarHBondContact OD2-NE2 2.88Å
902	Y	78.6	Confident	59.1	Low	62 Å²	62	65.3 Å²	65.3	24%	0.243	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	143	-173.2	-57	-27.8	0	0	0	112.9	S872 I899 N900 L916 A917 I924	S872-Y902 PolarHBondContact N-O 3.33Å; S872-Y902 PolarHBondContact OG-O 2.91Å; I899-Y902 HydrophobicContact CG2-CE2 3.54Å; I899-Y902 VanDerWaalsContact CG2-OH 3.24Å; I899-Y902 WeakPolarHBondContact CG2-OH 3.31Å; N900-Y902 PolarHBondContact O-N 3.31Å; Y902-L916 WeakPolarHBondContact CA-O 3.37Å; Y902-A917 HydrophobicContact CD1-CB 4.42Å; Y902-A917 HydrophobicContact CE1-CB 4.26Å; Y902-I924 HydrophobicContact CD1-CD1 3.29Å; Y902-I924 HydrophobicContact CD2-CD1 3.95Å; Y902-I924 HydrophobicContact CE1-CD1 3.32Å; Y902-I924 HydrophobicContact CE1-CG1 4.32Å; Y902-I924 HydrophobicContact CE2-CD1 3.93Å; Y902-I924 HydrophobicContact CG-CD1 3.64Å
903	I	87.1	Confident	62.1	Low	0 Å²	0	58.1 Å²	58.1	0%	0	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	131.9	171.6	-69.4	163.9	0	0	0	108.6	I797 C804 M869 L905 C915 L916 V918	I797-I903 HydrophobicContact CG2-CD1 3.56Å; I797-I903 HydrophobicContact CG2-CG1 4.17Å; I797-I903 HydrophobicContact CG2-CG2 4.21Å; C804-I903 HydrophobicContact CB-CD1 3.45Å; C804-I903 VanDerWaalsContact CB-CD1 3.45Å; M869-I903 HydrophobicContact CB-CG2 4.14Å; M869-I903 HydrophobicContact CG-CG2 4.41Å; M869-I903 HydrophobicContact SD-CG2 4.37Å; I903-L905 HydrophobicContact CG2-CB 4.39Å; I903-L905 HydrophobicContact CG2-CD2 4.44Å; I903-C915 WeakPolarHBondContact O-CA 3.34Å; I903-L916 PolarHBondContact N-O 3.46Å; I903-L916 VanDerWaalsContact N-O 3.09Å; I903-L916 PolarHBondContact O-N 2.82Å; I903-V918 HydrophobicContact CB-CG2 4.22Å; I903-V918 HydrophobicContact CD1-CB 4.46Å; I903-V918 HydrophobicContact CD1-CG1 4.09Å; I903-V918 HydrophobicContact CD1-CG2 3.44Å; I903-V918 VanDerWaalsContact CD1-CG2 3.44Å; I903-V918 HydrophobicContact CG1-CG2 3.59Å
904	W	88.5	Confident	64.9	Low	14 Å²	14	49.4 Å²	49.4	5%	0.053	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	133.2	164.2	-75.2	82.6	0	0	0	109.9	M869 A870 Y914 C915 T925 L927 I939 I941 V952 P1018	M869-W904 CarbonylContact C-O 3.36Å; M869-W904 VanDerWaalsContact CA-O 3.31Å; M869-W904 WeakPolarHBondContact CA-O 3.26Å; A870-W904 PolarHBondContact N-O 3.09Å; A870-W904 PolarHBondContact O-N 2.79Å; W904-Y914 CarbonylContact C-O 3.54Å; W904-Y914 WeakPolarHBondContact CA-O 3.2Å; W904-C915 HydrophobicContact CD2-CB 4Å; W904-C915 HydrophobicContact CE3-CB 4.1Å; W904-C915 HydrophobicContact CH2-CB 3.7Å; W904-C915 HydrophobicContact CZ2-CB 3.52Å; W904-C915 HydrophobicContact CZ3-CB 3.97Å; W904-T925 HydrophobicContact CH2-CG2 3.7Å; W904-T925 HydrophobicContact CZ2-CG2 4.22Å; W904-L927 HydrophobicContact CE3-CD1 4.34Å; W904-L927 HydrophobicContact CH2-CD1 3.81Å; W904-L927 HydrophobicContact CH2-CG 4.03Å; W904-L927 HydrophobicContact CZ3-CD1 3.48Å; W904-L927 VanDerWaalsContact CZ3-CD1 3.48Å; W904-L927 HydrophobicContact CZ3-CG 3.79Å; W904-I939 HydrophobicContact CB-CD1 4.5Å; W904-I939 HydrophobicContact CB-CG2 4.01Å; W904-I941 HydrophobicContact CB-CD1 4.13Å; W904-I941 HydrophobicContact CG-CD1 4.15Å; W904-I941 HydrophobicContact CG-CG1 4.4Å; W904-V952 HydrophobicContact CD2-CG1 4.25Å; W904-V952 HydrophobicContact CD2-CG2 3.88Å; W904-V952 HydrophobicContact CE3-CG1 4.42Å; W904-V952 HydrophobicContact CE3-CG2 4.46Å; W904-V952 HydrophobicContact CG-CG1 4.35Å; W904-V952 HydrophobicContact CG-CG2 4.2Å; W904-V952 HydrophobicContact CZ2-CG2 4.03Å; W904-P1018 HydrophobicContact CH2-CB 4.17Å; W904-P1018 HydrophobicContact CH2-CG 4.12Å; W904-P1018 HydrophobicContact CZ2-CB 3.66Å; W904-P1018 HydrophobicContact CZ2-CG 3.48Å; W904-P1018 VanDerWaalsContact CZ2-CG 3.48Å
905	L	89.3	Confident	67.9	Low	0 Å²	0	42.7 Å²	42.7	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.3	159	-175.3	62.5	86.2	0	0	0	112.4	I816 L857 L867 I868 M869 I903 C913 Y914 L916 F923	I816-L905 HydrophobicContact CD1-CD1 3.9Å; I816-L905 HydrophobicContact CD1-CD2 3.61Å; I816-L905 HydrophobicContact CD1-CG 4.43Å; L857-L905 HydrophobicContact CD2-CD1 3.61Å; L867-L905 HydrophobicContact CD1-CB 4.27Å; L867-L905 HydrophobicContact CD1-CD1 4.13Å; I868-L905 CarbonylContact O-C 3.56Å; I868-L905 WeakPolarHBondContact O-CA 3.47Å; M869-L905 HydrophobicContact CG-CB 3.87Å; I903-L905 HydrophobicContact CG2-CB 4.39Å; I903-L905 HydrophobicContact CG2-CD2 4.44Å; L905-C913 CarbonylContact O-C 3.3Å; L905-C913 WeakPolarHBondContact O-CA 3.4Å; L905-C913 PolarHBondContact O-SG 2.96Å; L905-Y914 HydrophobicContact CD1-CD2 3.9Å; L905-Y914 HydrophobicContact CD1-CG 4.31Å; L905-Y914 PolarHBondContact N-O 3.07Å; L905-Y914 PolarHBondContact O-N 3.15Å; L905-L916 HydrophobicContact CD2-CB 3.79Å; L905-L916 HydrophobicContact CD2-CD2 3.8Å; L905-L916 HydrophobicContact CD2-CG 4.41Å; L905-F923 HydrophobicContact CD1-CE1 4.24Å; L905-F923 HydrophobicContact CD2-CE1 4.45Å
906	G	85.3	Confident	70.7	Confident	0 Å²	0	36 Å²	36	0%	0	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-176	162.9	173.1	0	0	0	0	0	111.2	I868	I868-G906 PolarHBondContact N-O 3.46Å; I868-G906 PolarHBondContact O-N 2.93Å
907	T	80.3	Confident	73.4	Confident	1 Å²	1	30.2 Å²	30.2	1%	0.006	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.5	147.4	178.6	49.6	0	0	0	0	111.2	T814 L857 S863 G865 L867 G909 G910	T814-T907 HydrophobicContact CG2-CG2 4.13Å; L857-T907 HydrophobicContact CD1-CG2 3.63Å; S863-T907 WeakPolarHBondContact CA-OG1 3.42Å; S863-T907 WeakPolarHBondContact CB-OG1 3.47Å; G865-T907 WeakPolarHBondContact O-CG2 3.48Å; L867-T907 HydrophobicContact CD1-CG2 4.06Å; T907-G909 PolarHBondContact O-N 2.95Å; T907-G910 PolarHBondContact O-N 2.92Å; T907-G910 VanDerWaalsContact O-N 3.14Å
908	A	75.4	Confident	75.9	Confident	30 Å²	30	24.4 Å²	24.4	25%	0.248	15%	0.149	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	126.1	169.6	0	0	0	0	0	109.8	P866 G910 L936	P866-A908 HydrophobicContact CG-CB 4.35Å; P866-A908 PolarHBondContact O-N 3.39Å; A908-G910 VanDerWaalsContact C-N 3.3Å; A908-G910 PolarHBondContact O-N 3.22Å; A908-L936 WeakPolarHBondContact CA-O 3.37Å
909	G	71.9	Confident	78.1	Confident	28 Å²	28	24.5 Å²	24.5	29%	0.289	14%	0.137	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.5	-14.7	-176.6	0	0	0	0	0	115.4	T907 G911 P934	T907-G909 PolarHBondContact O-N 2.95Å; G909-G911 VanDerWaalsContact C-N 3.26Å; G909-G911 PolarHBondContact O-N 2.91Å; G909-G911 VanDerWaalsContact O-N 3.12Å; G909-P934 CarbonylContact C-O 3.09Å; G909-P934 WeakPolarHBondContact CA-O 3.48Å
910	G	70.2	Confident	80	Confident	3 Å²	3	23.8 Å²	23.8	3%	0.031	14%	0.139	C	C	.	.	S	Bend	trans	-74.1	1.4	-169.9	0	0	0	0	0	117.2	L862 T907 A908 H912	L862-G910 WeakPolarHBondContact O-CA 3.44Å; T907-G910 PolarHBondContact O-N 2.92Å; T907-G910 VanDerWaalsContact O-N 3.14Å; A908-G910 VanDerWaalsContact C-N 3.3Å; A908-G910 PolarHBondContact O-N 3.22Å; G910-H912 PolarHBondContact O-CD2 2.89Å; G910-H912 PolarHBondContact O-N 3.05Å
911	G	77	Confident	81.3	Confident	14 Å²	14	20.3 Å²	20.3	14%	0.144	12%	0.121	C	C	.	.	S	Bend	trans	64.2	-3.6	176.1	0	0	0	0	0	116.7	G909 L929 P934	G909-G911 VanDerWaalsContact C-N 3.26Å; G909-G911 PolarHBondContact O-N 2.91Å; G909-G911 VanDerWaalsContact O-N 3.12Å; G911-L929 WeakPolarHBondContact O-CB 3.33Å; G911-L929 WeakPolarHBondContact O-CG 3.29Å; G911-L929 PolarHBondContact O-N 3.28Å; G911-P934 PolarHBondContact N-O 2.84Å
912	H	81.3	Confident	82	Confident	32 Å²	32	22.2 Å²	22.2	15%	0.148	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	148.2	-172.7	-65.4	-75.5	0	0	0	112.5	F859 G910 Y914 L927	F859-H912 AromaticContact CD2-CD2 3.68Å; F859-H912 AromaticContact CD2-NE2 3.63Å; G910-H912 PolarHBondContact O-CD2 2.89Å; G910-H912 PolarHBondContact O-N 3.05Å; H912-Y914 HydrophobicContact CB-CD2 4.48Å; H912-Y914 HydrophobicContact CB-CE1 4.23Å; H912-Y914 HydrophobicContact CB-CE2 3.72Å; H912-L927 WeakPolarHBondContact CA-O 3.24Å
913	C	86	Confident	82.2	Confident	0 Å²	0	22.1 Å²	22.1	0%	0	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123	135.5	166.8	-169.1	0	0	0	0	108.9	L905 S926 L927 L954	L905-C913 CarbonylContact O-C 3.3Å; L905-C913 WeakPolarHBondContact O-CA 3.4Å; L905-C913 PolarHBondContact O-SG 2.96Å; C913-S926 CarbonylContact O-C 3.54Å; C913-S926 WeakPolarHBondContact O-CA 3.17Å; C913-L927 PolarHBondContact N-O 2.84Å; C913-L927 PolarHBondContact O-N 3.18Å; C913-L954 HydrophobicContact CB-CD1 4.43Å; C913-L954 HydrophobicContact CB-CD2 4.43Å
914	Y	87.2	Confident	82	Confident	6 Å²	6	25.8 Å²	25.8	2%	0.024	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	150.7	-172.5	-49.6	-96.8	0	0	0	111.1	L857 P858 F859 W904 L905 H912 F923	L857-Y914 HydrophobicContact CD2-CD2 4.25Å; L857-Y914 HydrophobicContact CD2-CE2 4.2Å; P858-Y914 HydrophobicContact CB-CE1 4.07Å; P858-Y914 HydrophobicContact CG-CD1 4.07Å; P858-Y914 HydrophobicContact CG-CE1 3.73Å; F859-Y914 HydrophobicContact CD2-CE1 4.24Å; F859-Y914 WeakPolarHBondContact CD2-OH 3.3Å; W904-Y914 CarbonylContact C-O 3.54Å; W904-Y914 WeakPolarHBondContact CA-O 3.2Å; L905-Y914 HydrophobicContact CD1-CD2 3.9Å; L905-Y914 HydrophobicContact CD1-CG 4.31Å; L905-Y914 PolarHBondContact N-O 3.07Å; L905-Y914 PolarHBondContact O-N 3.15Å; H912-Y914 HydrophobicContact CB-CD2 4.48Å; H912-Y914 HydrophobicContact CB-CE1 4.23Å; H912-Y914 HydrophobicContact CB-CE2 3.72Å; Y914-F923 HydrophobicContact CD1-CD1 4.46Å; Y914-F923 HydrophobicContact CG-CD1 4.37Å; Y914-F923 HydrophobicContact CG-CE1 4.45Å
915	C	87.2	Confident	81.7	Confident	5 Å²	5	25.9 Å²	25.9	3%	0.034	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	116.2	171.5	-169.8	0	0	0	0	109.1	I903 W904 F923 I924 T925	I903-C915 WeakPolarHBondContact O-CA 3.34Å; W904-C915 HydrophobicContact CD2-CB 4Å; W904-C915 HydrophobicContact CE3-CB 4.1Å; W904-C915 HydrophobicContact CH2-CB 3.7Å; W904-C915 HydrophobicContact CZ2-CB 3.52Å; W904-C915 HydrophobicContact CZ3-CB 3.97Å; C915-F923 CarbonylContact O-C 3.6Å; C915-F923 WeakPolarHBondContact O-CA 3.14Å; C915-I924 PolarHBondContact O-N 2.73Å; C915-T925 HydrophobicContact CB-CG2 3.81Å; C915-T925 PolarHBondContact N-O 2.66Å
916	L	86.5	Confident	81.4	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	17%	0.165	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	129.5	-176.6	-178.5	69.5	0	0	0	110.8	I816 I855 Y902 I903 L905 V918 F923	I816-L916 HydrophobicContact CG2-CD2 3.89Å; I855-L916 HydrophobicContact CG2-CD1 4.41Å; Y902-L916 WeakPolarHBondContact CA-O 3.37Å; I903-L916 PolarHBondContact N-O 3.46Å; I903-L916 VanDerWaalsContact N-O 3.09Å; I903-L916 PolarHBondContact O-N 2.82Å; L905-L916 HydrophobicContact CD2-CB 3.79Å; L905-L916 HydrophobicContact CD2-CD2 3.8Å; L905-L916 HydrophobicContact CD2-CG 4.41Å; L916-V918 PolarHBondContact O-N 3.23Å; L916-F923 HydrophobicContact CB-CD1 4.33Å; L916-F923 HydrophobicContact CB-CE1 4.33Å; L916-F923 HydrophobicContact CD1-CD1 3.94Å; L916-F923 HydrophobicContact CD1-CE1 3.81Å; L916-F923 HydrophobicContact CD1-CG 4.43Å; L916-F923 HydrophobicContact CD1-CZ 4.18Å
917	A	85.1	Confident	81.2	Confident	15 Å²	15	28 Å²	28	12%	0.124	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	109.5	166.1	0	0	0	0	0	109.2	Y902 Q919 G921 D922 I924	Y902-A917 HydrophobicContact CD1-CB 4.42Å; Y902-A917 HydrophobicContact CE1-CB 4.26Å; A917-Q919 VanDerWaalsContact C-N 3.28Å; A917-Q919 PolarHBondContact O-N 3.15Å; A917-G921 VanDerWaalsContact O-CA 3.29Å; A917-G921 WeakPolarHBondContact O-CA 3.42Å; A917-G921 PolarHBondContact O-N 3.26Å; A917-D922 WeakPolarHBondContact CB-O 3.26Å; A917-D922 PolarHBondContact N-O 2.93Å; A917-I924 HydrophobicContact CB-CD1 3.89Å; A917-I924 HydrophobicContact CB-CG1 4Å
918	V	82.6	Confident	81.2	Confident	3 Å²	3	31 Å²	31	2%	0.018	19%	0.186	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.2	-29.5	-171.5	-161.3	0	0	0	0	112.1	R799 Y802 C818 D901 I903 L916	R799-V918 HydrophobicContact CB-CG2 4.35Å; Y802-V918 HydrophobicContact CD1-CG1 4.44Å; Y802-V918 HydrophobicContact CG-CG1 4.16Å; C818-V918 HydrophobicContact CB-CG1 4.39Å; D901-V918 WeakPolarHBondContact O-CG2 3.21Å; D901-V918 PolarHBondContact O-N 3.14Å; I903-V918 HydrophobicContact CB-CG2 4.22Å; I903-V918 HydrophobicContact CD1-CB 4.46Å; I903-V918 HydrophobicContact CD1-CG1 4.09Å; I903-V918 HydrophobicContact CD1-CG2 3.44Å; I903-V918 VanDerWaalsContact CD1-CG2 3.44Å; I903-V918 HydrophobicContact CG1-CG2 3.59Å; L916-V918 PolarHBondContact O-N 3.23Å
919	Q	78.9	Confident	81.4	Confident	110 Å²	110	29.9 Å²	29.9	51%	0.514	18%	0.176	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.1	-36.8	-178.3	-57.3	-170.8	2.8	0	0	113.6	Y802 D901 A917	Y802-Q919 HydrophobicContact CD2-CG 4.36Å; Y802-Q919 HydrophobicContact CE1-CG 4.45Å; Y802-Q919 HydrophobicContact CE2-CG 3.78Å; D901-Q919 HydrophobicContact CB-CG 4.31Å; D901-Q919 PolarHBondContact OD2-NE2 2.88Å; A917-Q919 VanDerWaalsContact C-N 3.28Å; A917-Q919 PolarHBondContact O-N 3.15Å
920	S	80.1	Confident	81.5	Confident	58 Å²	58	30 Å²	30	41%	0.406	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	-103.4	-20.2	-179.4	73.8	0	0	0	0	113.7	K853 D922	K853-S920 PolarHBondContact NZ-O 3.04Å; S920-D922 WeakPolarHBondContact CB-OD2 3.01Å; S920-D922 PolarHBondContact OG-OD2 3.26Å
921	G	79.9	Confident	81.5	Confident	5 Å²	5	37 Å²	37	5%	0.052	21%	0.208	C	C	.	.	T	Hydrogen-bonded Turn	trans	73.2	34.7	-177	0	0	0	0	0	113.2	K853 A917	K853-G921 PolarHBondContact NZ-O 3.09Å; A917-G921 VanDerWaalsContact O-CA 3.29Å; A917-G921 WeakPolarHBondContact O-CA 3.42Å; A917-G921 PolarHBondContact O-N 3.26Å
922	D	82.8	Confident	81	Confident	80 Å²	80	38.7 Å²	38.7	43%	0.428	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	147.7	-177.6	-47.6	-51.9	0	0	0	111.9	K853 A917 S920	K853-D922 IonicContact NZ-OD1 3.21Å; K853-D922 PolarHBondContact NZ-OD1 2.96Å; A917-D922 WeakPolarHBondContact CB-O 3.26Å; A917-D922 PolarHBondContact N-O 2.93Å; S920-D922 WeakPolarHBondContact CB-OD2 3.01Å; S920-D922 PolarHBondContact OG-OD2 3.26Å
923	F	84.2	Confident	80.5	Confident	60 Å²	60	37.2 Å²	37.2	26%	0.263	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	115.9	-178	-62.4	-74.5	0	0	0	111.5	I816 I855 N856 L857 P858 L905 Y914 C915 L916	I816-F923 HydrophobicContact CD1-CZ 4.28Å; I855-F923 HydrophobicContact CG2-CE2 3.73Å; I855-F923 HydrophobicContact CG2-CZ 3.78Å; N856-F923 WeakPolarHBondContact O-CE2 3.39Å; L857-F923 HydrophobicContact CD2-CZ 4.33Å; P858-F923 HydrophobicContact CG-CD2 3.68Å; P858-F923 HydrophobicContact CG-CE2 3.87Å; P858-F923 HydrophobicContact CG-CG 4.18Å; P858-F923 HydrophobicContact CG-CZ 4.5Å; L905-F923 HydrophobicContact CD1-CE1 4.24Å; L905-F923 HydrophobicContact CD2-CE1 4.45Å; Y914-F923 HydrophobicContact CD1-CD1 4.46Å; Y914-F923 HydrophobicContact CG-CD1 4.37Å; Y914-F923 HydrophobicContact CG-CE1 4.45Å; C915-F923 CarbonylContact O-C 3.6Å; C915-F923 WeakPolarHBondContact O-CA 3.14Å; L916-F923 HydrophobicContact CB-CD1 4.33Å; L916-F923 HydrophobicContact CB-CE1 4.33Å; L916-F923 HydrophobicContact CD1-CD1 3.94Å; L916-F923 HydrophobicContact CD1-CE1 3.81Å; L916-F923 HydrophobicContact CD1-CG 4.43Å; L916-F923 HydrophobicContact CD1-CZ 4.18Å
924	I	82.2	Confident	79.7	Confident	77 Å²	77	39.4 Å²	39.4	40%	0.395	22%	0.22	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	-39.3	-176.3	-55.1	144.5	0	0	0	110.7	Y902 C915 A917	Y902-I924 HydrophobicContact CD1-CD1 3.29Å; Y902-I924 HydrophobicContact CD2-CD1 3.95Å; Y902-I924 HydrophobicContact CE1-CD1 3.32Å; Y902-I924 HydrophobicContact CE1-CG1 4.32Å; Y902-I924 HydrophobicContact CE2-CD1 3.93Å; Y902-I924 HydrophobicContact CG-CD1 3.64Å; C915-I924 PolarHBondContact O-N 2.73Å; A917-I924 HydrophobicContact CB-CD1 3.89Å; A917-I924 HydrophobicContact CB-CG1 4Å
925	T	81.5	Confident	79.4	Confident	16 Å²	16	41.2 Å²	41.2	10%	0.098	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-160.4	156.3	175.3	-168.9	0	0	0	0	110.8	W904 C915 K1021	W904-T925 HydrophobicContact CH2-CG2 3.7Å; W904-T925 HydrophobicContact CZ2-CG2 4.22Å; C915-T925 HydrophobicContact CB-CG2 3.81Å; C915-T925 PolarHBondContact N-O 2.66Å; T925-K1021 WeakPolarHBondContact OG1-CD 3.43Å; T925-K1021 WeakPolarHBondContact OG1-CE 3.3Å; T925-K1021 PolarHBondContact OG1-NZ 3.43Å
926	S	83.3	Confident	79.4	Confident	36 Å²	36	41 Å²	41	25%	0.252	23%	0.231	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	165.3	162	54.6	0	0	0	0	110.9	C913	C913-S926 CarbonylContact O-C 3.54Å; C913-S926 WeakPolarHBondContact O-CA 3.17Å
927	L	81	Confident	79.4	Confident	9 Å²	9	43.4 Å²	43.4	5%	0.047	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	130.5	164.5	-65.6	171.5	0	0	0	106.4	W904 H912 C913 C1016 K1021	W904-L927 HydrophobicContact CE3-CD1 4.34Å; W904-L927 HydrophobicContact CH2-CD1 3.81Å; W904-L927 HydrophobicContact CH2-CG 4.03Å; W904-L927 HydrophobicContact CZ3-CD1 3.48Å; W904-L927 VanDerWaalsContact CZ3-CD1 3.48Å; W904-L927 HydrophobicContact CZ3-CG 3.79Å; H912-L927 WeakPolarHBondContact CA-O 3.24Å; C913-L927 PolarHBondContact N-O 2.84Å; C913-L927 PolarHBondContact O-N 3.18Å; L927-C1016 HydrophobicContact CD1-CB 3.6Å; L927-K1021 HydrophobicContact CD2-CB 4.5Å
928	V	81.2	Confident	79.6	Confident	65 Å²	65	43 Å²	43	39%	0.394	24%	0.239	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-86	130.8	172.7	-169	0	0	0	0	107.9
929	L	79.9	Confident	80	Confident	6 Å²	6	43.5 Å²	43.5	3%	0.031	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-79.3	147.8	172.9	-54.8	179	0	0	0	109.2	G911 L936 L954 V956 L1014	G911-L929 WeakPolarHBondContact O-CB 3.33Å; G911-L929 WeakPolarHBondContact O-CG 3.29Å; G911-L929 PolarHBondContact O-N 3.28Å; L929-L936 HydrophobicContact CD1-CB 4.08Å; L929-L954 HydrophobicContact CD2-CD1 3.74Å; L929-V956 HydrophobicContact CD1-CG1 4.48Å; L929-V956 HydrophobicContact CD2-CG1 4.39Å; L929-L1014 HydrophobicContact CD2-CD1 4.42Å
930	P	73.2	Confident	80.4	Confident	29 Å²	29	39 Å²	39	19%	0.188	22%	0.222	C	C	.	.	P	Polyproline II helix	trans	-55.9	140.8	172.1	-23.7	33.3	0	0	0	111.7	E932 T933 L1014 I1023	P930-E932 PolarHBondContact O-N 3.1Å; P930-E932 VanDerWaalsContact O-N 3.13Å; P930-T933 WeakPolarHBondContact CD-OG1 3.45Å; P930-T933 CarbonylContact O-C 3.58Å; P930-T933 VanDerWaalsContact O-C 3.3Å; P930-T933 WeakPolarHBondContact O-CA 3.16Å; P930-T933 PolarHBondContact O-N 3.15Å; P930-T933 PolarHBondContact O-OG1 2.97Å; P930-L1014 HydrophobicContact CG-CD1 4.13Å; P930-I1023 HydrophobicContact CG-CD1 3.65Å
931	N	70.3	Confident	80.6	Confident	152 Å²	152	36.5 Å²	36.5	81%	0.813	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-26.7	178.7	-66.1	-3.9	0	0	0	113	T933	N931-T933 PolarHBondContact O-N 3.37Å
932	E	66.9	Low	80.5	Confident	49 Å²	49	37.1 Å²	37.1	23%	0.229	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-17.1	172.1	-63.9	-174.7	-163.3	0	0	113.9	P930 G958 N959 R1012	P930-E932 PolarHBondContact O-N 3.1Å; P930-E932 VanDerWaalsContact O-N 3.13Å; E932-G958 CarbonylContact O-C 3.57Å; E932-G958 WeakPolarHBondContact O-CA 3.45Å; E932-N959 PolarHBondContact O-N 3.04Å; E932-R1012 IonicContact OE2-CZ 3.97Å; E932-R1012 IonicContact OE2-NH1 3.22Å; E932-R1012 PolarHBondContact OE2-NH1 2.94Å; E932-R1012 IonicContact OE2-NH2 2.68Å
933	T	69.6	Low	79.7	Confident	0 Å²	0	34.7 Å²	34.7	0%	0	19%	0.194	C	C	.	.			trans	-138.2	59.7	-172.7	62.7	0	0	0	0	112.2	P930 N931 C935 V956 S957 R1012	P930-T933 WeakPolarHBondContact CD-OG1 3.45Å; P930-T933 CarbonylContact O-C 3.58Å; P930-T933 VanDerWaalsContact O-C 3.3Å; P930-T933 WeakPolarHBondContact O-CA 3.16Å; P930-T933 PolarHBondContact O-N 3.15Å; P930-T933 PolarHBondContact O-OG1 2.97Å; N931-T933 PolarHBondContact O-N 3.37Å; T933-C935 PolarHBondContact O-N 3.38Å; T933-V956 HydrophobicContact CG2-CG2 3.95Å; T933-S957 CarbonylContact C-O 3.59Å; T933-S957 VanDerWaalsContact CA-O 3.32Å; T933-S957 WeakPolarHBondContact CA-O 3.49Å; T933-R1012 VanDerWaalsContact CG2-CD 3.43Å
934	P	70.7	Confident	78.6	Confident	47 Å²	47	34 Å²	34	31%	0.305	20%	0.197	S	C	.	.			trans	-72.4	-17.8	-173.9	31.4	-35.6	0	0	0	113	G909 G911 L936	G909-P934 CarbonylContact C-O 3.09Å; G909-P934 WeakPolarHBondContact CA-O 3.48Å; G911-P934 PolarHBondContact N-O 2.84Å; P934-L936 PolarHBondContact O-N 3.05Å
935	C	79.8	Confident	77.4	Confident	43 Å²	43	33.6 Å²	33.6	29%	0.291	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	97.1	-173.1	-59.7	0	0	0	0	111.8	T933 H937 V956 S957	T933-C935 PolarHBondContact O-N 3.38Å; C935-H937 PolarHBondContact O-CE1 3.29Å; C935-H937 PolarHBondContact O-ND1 2.94Å; C935-V956 WeakPolarHBondContact O-CA 3.4Å; C935-S957 PolarHBondContact N-O 2.68Å; C935-S957 PolarHBondContact O-N 3.03Å; C935-S957 VanDerWaalsContact O-N 3.09Å
936	L	87.3	Confident	75.8	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	137.9	166.4	-171.6	63.9	0	0	0	111.1	I868 A908 L929 P934 I939 L954 V956	I868-L936 HydrophobicContact CD1-CB 4.18Å; I868-L936 HydrophobicContact CD1-CD2 4.29Å; I868-L936 HydrophobicContact CD1-CG 3.88Å; I868-L936 VanDerWaalsContact CD1-O 3.24Å; I868-L936 WeakPolarHBondContact CD1-O 3.37Å; A908-L936 WeakPolarHBondContact CA-O 3.37Å; L929-L936 HydrophobicContact CD1-CB 4.08Å; P934-L936 PolarHBondContact O-N 3.05Å; L936-I939 HydrophobicContact CD1-CG1 4.32Å; L936-I939 HydrophobicContact CD2-CD1 4.04Å; L936-I939 HydrophobicContact CD2-CG1 3.96Å; L936-I939 HydrophobicContact CG-CG1 4.47Å; L936-L954 HydrophobicContact CD1-CB 3.92Å; L936-L954 HydrophobicContact CD1-CD2 3.94Å; L936-L954 HydrophobicContact CD1-CG 4.42Å; L936-V956 HydrophobicContact CD1-CG1 4.08Å
937	H	87.1	Confident	74.1	Confident	51 Å²	51	41.6 Å²	41.6	24%	0.236	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	-34.4	-178	-74.2	55.9	0	0	0	113.7	C935 A955 S957 I1050	C935-H937 PolarHBondContact O-CE1 3.29Å; C935-H937 PolarHBondContact O-ND1 2.94Å; H937-A955 HydrophobicContact CB-CB 4.34Å; H937-A955 PolarHBondContact N-O 3.02Å; H937-S957 PolarHBondContact CE1-OG 2.74Å; H937-I1050 WeakPolarHBondContact CB-O 3.46Å
938	A	89.6	Confident	72.7	Confident	7 Å²	7	46 Å²	46	6%	0.058	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	152.1	173.3	0	0	0	0	0	111.1	L954 A955 L1053	A938-L954 WeakPolarHBondContact O-CA 3.35Å; A938-A955 HydrophobicContact CB-CB 3.96Å; A938-A955 PolarHBondContact N-O 3.08Å; A938-A955 PolarHBondContact O-N 3.06Å; A938-L1053 HydrophobicContact CB-CB 4.42Å; A938-L1053 HydrophobicContact CB-CD1 4.29Å; A938-L1053 HydrophobicContact CB-CG 4.06Å
939	I	90.7	Very high	71.6	Confident	14 Å²	14	44 Å²	44	7%	0.072	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	139.1	171	-54.2	166.6	0	0	0	107.6	I868 A870 W904 L936 V952 W953 L954	I868-I939 HydrophobicContact CB-CD1 4.45Å; I868-I939 HydrophobicContact CG2-CB 4.35Å; I868-I939 HydrophobicContact CG2-CD1 3.98Å; I868-I939 HydrophobicContact CG2-CG1 3.78Å; A870-I939 HydrophobicContact CB-CB 3.91Å; A870-I939 HydrophobicContact CB-CG2 3.71Å; W904-I939 HydrophobicContact CB-CD1 4.5Å; W904-I939 HydrophobicContact CB-CG2 4.01Å; L936-I939 HydrophobicContact CD1-CG1 4.32Å; L936-I939 HydrophobicContact CD2-CD1 4.04Å; L936-I939 HydrophobicContact CD2-CG1 3.96Å; L936-I939 HydrophobicContact CG-CG1 4.47Å; I939-V952 HydrophobicContact CG2-CG1 3.86Å; I939-W953 CarbonylContact C-O 3.43Å; I939-W953 WeakPolarHBondContact CA-O 3.34Å; I939-L954 HydrophobicContact CB-CD2 4.36Å; I939-L954 HydrophobicContact CG1-CD2 3.9Å; I939-L954 HydrophobicContact CG2-CD2 4.05Å
940	C	88.2	Confident	71.1	Confident	14 Å²	14	46.2 Å²	46.2	10%	0.095	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	136.1	165.7	-168	0	0	0	0	109.8	W953 L1053 I1055	C940-W953 PolarHBondContact N-O 2.99Å; C940-W953 PolarHBondContact O-N 3.18Å; C940-L1053 HydrophobicContact CB-CB 3.61Å; C940-L1053 HydrophobicContact CB-CD1 4.27Å; C940-I1055 HydrophobicContact CB-CD1 4.4Å
941	I	83.7	Confident	71.4	Confident	6 Å²	6	45.7 Å²	45.7	3%	0.031	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	117.8	-176.3	-60.7	152.9	0	0	0	108	A870 S871 F873 W904 D950 V952	A870-I941 HydrophobicContact CB-CD1 3.9Å; A870-I941 HydrophobicContact CB-CG1 4.31Å; A870-I941 WeakPolarHBondContact O-CD1 3.41Å; S871-I941 VanDerWaalsContact C-CD1 3.47Å; S871-I941 WeakPolarHBondContact O-CD1 3.45Å; F873-I941 WeakPolarHBondContact CE2-O 3.24Å; W904-I941 HydrophobicContact CB-CD1 4.13Å; W904-I941 HydrophobicContact CG-CD1 4.15Å; W904-I941 HydrophobicContact CG-CG1 4.4Å; I941-D950 HydrophobicContact CG2-CB 4.18Å; I941-V952 HydrophobicContact CG1-CG2 4.49Å
942	K	77.4	Confident	72.1	Confident	19 Å²	19	38.5 Å²	38.5	8%	0.083	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79	119.9	170.3	-176.5	177.2	176.3	-176.3	0	108.6	D950 I951 I1055 D1061	K942-D950 WeakPolarHBondContact O-CA 3.19Å; K942-I951 HydrophobicContact CB-CB 4.24Å; K942-I951 PolarHBondContact N-O 3.41Å; K942-I951 PolarHBondContact O-N 3.42Å; K942-I1055 HydrophobicContact CB-CD1 3.89Å; K942-I1055 HydrophobicContact CB-CG2 4.47Å; K942-I1055 HydrophobicContact CG-CG2 4.24Å; K942-D1061 WeakPolarHBondContact CE-OD1 3.44Å; K942-D1061 PolarHBondContact NZ-O 3.1Å; K942-D1061 IonicContact NZ-OD1 2.61Å; K942-D1061 PolarHBondContact NZ-OD1 3.4Å
943	P	65.2	Low	73.2	Confident	29 Å²	29	36.2 Å²	36.2	19%	0.188	22%	0.222	C	C	.	.			trans	-68.6	145.1	176.1	29.8	-33.5	0	0	0	110.6	F873 T945 P1057	F873-P943 HydrophobicContact CB-CB 4.23Å; F873-P943 HydrophobicContact CD2-CB 4.01Å; F873-P943 HydrophobicContact CD2-CG 3.79Å; F873-P943 HydrophobicContact CE2-CG 4.22Å; F873-P943 HydrophobicContact CG-CB 4.38Å; F873-P943 HydrophobicContact CG-CG 4.3Å; P943-T945 PolarHBondContact O-N 3.46Å; P943-P1057 HydrophobicContact CG-CB 4.34Å
944	S	63	Low	74.2	Confident	46 Å²	46	36.2 Å²	36.2	32%	0.322	22%	0.222	S	C	.	.			trans	-67.2	115.1	175.4	-170.7	0	0	0	0	112.6	G947 L948 D950	S944-G947 PolarHBondContact OG-N 3.16Å; S944-L948 VanDerWaalsContact CB-O 3.28Å; S944-L948 WeakPolarHBondContact CB-O 3.28Å; S944-L948 PolarHBondContact OG-N 3.3Å; S944-L948 PolarHBondContact OG-O 3.23Å; S944-D950 PolarHBondContact N-OD1 3.06Å
945	T	55.4	Low	75.2	Confident	68 Å²	68	34 Å²	34	42%	0.417	21%	0.208	S	C	.	.	S	Bend	trans	-89	-20.1	177.1	45.7	0	0	0	0	113.5	P943 D1061	P943-T945 PolarHBondContact O-N 3.46Å; T945-D1061 PolarHBondContact OG1-OD1 3.03Å
946	M	48.5	Very low	75.6	Confident	147 Å²	147	32.1 Å²	32.1	72%	0.724	20%	0.195	S	C	*	.	S	Bend	trans	-138.4	25.3	-167.3	-69	-91.6	77.5	0	0	113.4	L948	M946-L948 PolarHBondContact O-N 3.45Å
947	G	47.1	Very low	75.5	Confident	72 Å²	72	32.6 Å²	32.6	74%	0.742	20%	0.198	S	C	*	.	S	Bend	trans	74.7	2.7	-179.2	0	0	0	0	0	115.2	S944	S944-G947 PolarHBondContact OG-N 3.16Å
948	L	51.2	Low	74.7	Confident	102 Å²	102	30.8 Å²	30.8	53%	0.534	19%	0.193	S	C	.	.	S	Bend	trans	-62.9	173.3	169	-64.8	172.5	0	0	0	111.4	S944 M946	S944-L948 VanDerWaalsContact CB-O 3.28Å; S944-L948 WeakPolarHBondContact CB-O 3.28Å; S944-L948 PolarHBondContact OG-N 3.3Å; S944-L948 PolarHBondContact OG-O 3.23Å; M946-L948 PolarHBondContact O-N 3.45Å
949	A	58.1	Low	73.3	Confident	22 Å²	22	34.4 Å²	34.4	18%	0.182	21%	0.212	C	C	.	.	P	Polyproline II helix	trans	-69.3	145.9	165.3	0	0	0	0	0	110.5	I951 K1019	A949-I951 PolarHBondContact O-N 3.4Å; A949-K1019 HydrophobicContact CB-CB 4.25Å; A949-K1019 HydrophobicContact CB-CD 3.87Å; A949-K1019 HydrophobicContact CB-CG 3.93Å
950	D	70.2	Confident	71.1	Confident	54 Å²	54	36.3 Å²	36.3	29%	0.289	23%	0.225	S	C	.	.	P	Polyproline II helix	trans	-57.3	137.1	167	-57.2	-58	0	0	0	109.7	I941 K942 S944 P1018	I941-D950 HydrophobicContact CG2-CB 4.18Å; K942-D950 WeakPolarHBondContact O-CA 3.19Å; S944-D950 PolarHBondContact N-OD1 3.06Å; D950-P1018 WeakPolarHBondContact O-CD 3.47Å
951	I	78.8	Confident	68.6	Low	18 Å²	18	39.7 Å²	39.7	9%	0.092	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	115.4	-177.7	-57.7	178.2	0	0	0	108.3	K942 A949 A1015 L1024 Y1080	K942-I951 HydrophobicContact CB-CB 4.24Å; K942-I951 PolarHBondContact N-O 3.41Å; K942-I951 PolarHBondContact O-N 3.42Å; A949-I951 PolarHBondContact O-N 3.4Å; I951-A1015 HydrophobicContact CG2-CB 3.84Å; I951-L1024 HydrophobicContact CD1-CD1 4.24Å; I951-L1024 HydrophobicContact CG1-CD1 4.2Å; I951-L1024 HydrophobicContact CG2-CD1 4.35Å; I951-Y1080 HydrophobicContact CD1-CE1 4.18Å
952	V	86.3	Confident	66.2	Low	0 Å²	0	46.1 Å²	46.1	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	114.1	177	-174.1	0	0	0	0	108.1	W904 I939 I941 L954 C1016 P1018	W904-V952 HydrophobicContact CD2-CG1 4.25Å; W904-V952 HydrophobicContact CD2-CG2 3.88Å; W904-V952 HydrophobicContact CE3-CG1 4.42Å; W904-V952 HydrophobicContact CE3-CG2 4.46Å; W904-V952 HydrophobicContact CG-CG1 4.35Å; W904-V952 HydrophobicContact CG-CG2 4.2Å; W904-V952 HydrophobicContact CZ2-CG2 4.03Å; I939-V952 HydrophobicContact CG2-CG1 3.86Å; I941-V952 HydrophobicContact CG1-CG2 4.49Å; V952-L954 HydrophobicContact CG1-CD2 3.74Å; V952-L954 HydrophobicContact CG1-CG 4.27Å; V952-C1016 PolarHBondContact N-O 3.14Å; V952-C1016 PolarHBondContact O-N 2.97Å; V952-P1018 HydrophobicContact CG2-CG 3.68Å
953	W	89.6	Confident	63.8	Low	1 Å²	1	50.7 Å²	50.7	0%	0.004	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	128.5	173.7	-74.6	88.8	0	0	0	110.4	I939 C940 L1013 L1014 A1015 I1027 L1053 I1055 I1064 L1078	I939-W953 CarbonylContact C-O 3.43Å; I939-W953 WeakPolarHBondContact CA-O 3.34Å; C940-W953 PolarHBondContact N-O 2.99Å; C940-W953 PolarHBondContact O-N 3.18Å; W953-L1013 HydrophobicContact CE3-CB 4.16Å; W953-L1013 HydrophobicContact CZ3-CB 4.09Å; W953-L1014 CarbonylContact C-O 3.58Å; W953-L1014 WeakPolarHBondContact CA-O 3.38Å; W953-A1015 HydrophobicContact CD2-CB 3.92Å; W953-A1015 HydrophobicContact CE3-CB 3.93Å; W953-A1015 HydrophobicContact CH2-CB 3.71Å; W953-A1015 HydrophobicContact CZ2-CB 3.65Å; W953-A1015 HydrophobicContact CZ3-CB 3.84Å; W953-I1027 HydrophobicContact CH2-CD1 3.96Å; W953-I1027 HydrophobicContact CZ3-CD1 3.95Å; W953-L1053 HydrophobicContact CB-CD1 4.32Å; W953-I1055 HydrophobicContact CB-CD1 4.42Å; W953-I1055 VanDerWaalsContact CD1-CD1 3.49Å; W953-I1055 HydrophobicContact CG-CD1 4.08Å; W953-I1064 HydrophobicContact CD2-CD1 3.44Å; W953-I1064 VanDerWaalsContact CD2-CD1 3.44Å; W953-I1064 HydrophobicContact CE3-CD1 3.68Å; W953-I1064 HydrophobicContact CG-CD1 3.94Å; W953-I1064 HydrophobicContact CH2-CD1 3.97Å; W953-I1064 HydrophobicContact CZ2-CD1 3.78Å; W953-I1064 HydrophobicContact CZ3-CD1 3.94Å; W953-L1078 HydrophobicContact CH2-CD1 3.43Å; W953-L1078 VanDerWaalsContact CH2-CD1 3.43Å; W953-L1078 HydrophobicContact CH2-CD2 4.28Å; W953-L1078 HydrophobicContact CZ2-CD1 3.4Å; W953-L1078 VanDerWaalsContact CZ2-CD1 3.4Å; W953-L1078 HydrophobicContact CZ3-CD1 4.39Å
954	L	90.9	Very high	62	Low	0 Å²	0	54.1 Å²	54.1	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	120.6	-177.1	-53.5	173.5	0	0	0	108.6	C913 L929 L936 A938 I939 V952 V956 L1013 L1014	C913-L954 HydrophobicContact CB-CD1 4.43Å; C913-L954 HydrophobicContact CB-CD2 4.43Å; L929-L954 HydrophobicContact CD2-CD1 3.74Å; L936-L954 HydrophobicContact CD1-CB 3.92Å; L936-L954 HydrophobicContact CD1-CD2 3.94Å; L936-L954 HydrophobicContact CD1-CG 4.42Å; A938-L954 WeakPolarHBondContact O-CA 3.35Å; I939-L954 HydrophobicContact CB-CD2 4.36Å; I939-L954 HydrophobicContact CG1-CD2 3.9Å; I939-L954 HydrophobicContact CG2-CD2 4.05Å; V952-L954 HydrophobicContact CG1-CD2 3.74Å; V952-L954 HydrophobicContact CG1-CG 4.27Å; L954-V956 HydrophobicContact CB-CG1 4.16Å; L954-L1013 WeakPolarHBondContact O-CA 3.39Å; L954-L1014 HydrophobicContact CB-CB 4.29Å; L954-L1014 PolarHBondContact N-O 3.03Å; L954-L1014 PolarHBondContact O-N 3.32Å
955	A	91	Very high	60.3	Low	0 Å²	0	56.9 Å²	56.9	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.1	124.1	165.8	0	0	0	0	0	108.8	H937 A938 L1013 I1050 L1053	H937-A955 HydrophobicContact CB-CB 4.34Å; H937-A955 PolarHBondContact N-O 3.02Å; A938-A955 HydrophobicContact CB-CB 3.96Å; A938-A955 PolarHBondContact N-O 3.08Å; A938-A955 PolarHBondContact O-N 3.06Å; A955-L1013 HydrophobicContact CB-CD2 4.08Å; A955-I1050 HydrophobicContact CB-CB 3.89Å; A955-I1050 HydrophobicContact CB-CG2 3.8Å; A955-I1050 WeakPolarHBondContact CB-O 3.43Å; A955-L1053 HydrophobicContact CB-CD1 3.93Å; A955-L1053 HydrophobicContact CB-CG 4.18Å
956	V	88.8	Confident	59.1	Low	4 Å²	4	59.5 Å²	59.5	2%	0.024	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	158.6	-175.2	-58.8	0	0	0	0	111.4	L929 T933 C935 L936 L954 R1012 L1014	L929-V956 HydrophobicContact CD1-CG1 4.48Å; L929-V956 HydrophobicContact CD2-CG1 4.39Å; T933-V956 HydrophobicContact CG2-CG2 3.95Å; C935-V956 WeakPolarHBondContact O-CA 3.4Å; L936-V956 HydrophobicContact CD1-CG1 4.08Å; L954-V956 HydrophobicContact CB-CG1 4.16Å; V956-R1012 HydrophobicContact CG2-CB 3.83Å; V956-R1012 PolarHBondContact N-O 3.47Å; V956-R1012 PolarHBondContact O-N 3.1Å; V956-L1014 HydrophobicContact CG1-CD1 4.17Å; V956-L1014 HydrophobicContact CG2-CD1 3.98Å; V956-L1014 HydrophobicContact CG2-CD2 4.43Å; V956-L1014 HydrophobicContact CG2-CG 3.84Å
957	S	84.3	Confident	58.1	Low	10 Å²	10	60.9 Å²	60.9	7%	0.07	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	160.5	171.3	71.6	0	0	0	0	111.9	T933 C935 H937 G1009 M1010	T933-S957 CarbonylContact C-O 3.59Å; T933-S957 VanDerWaalsContact CA-O 3.32Å; T933-S957 WeakPolarHBondContact CA-O 3.49Å; C935-S957 PolarHBondContact N-O 2.68Å; C935-S957 PolarHBondContact O-N 3.03Å; C935-S957 VanDerWaalsContact O-N 3.09Å; H937-S957 PolarHBondContact CE1-OG 2.74Å; S957-G1009 WeakPolarHBondContact CA-O 3.4Å; S957-M1010 WeakPolarHBondContact CB-O 3.47Å
958	G	71.2	Confident	57.2	Low	13 Å²	13	67 Å²	67	13%	0.134	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	168.8	-174.4	173.5	0	0	0	0	0	113.7	E932 V1008 G1009	E932-G958 CarbonylContact O-C 3.57Å; E932-G958 WeakPolarHBondContact O-CA 3.45Å; G958-V1008 WeakPolarHBondContact O-CG1 3.49Å; G958-G1009 PolarHBondContact N-O 3.34Å; G958-G1009 VanDerWaalsContact N-O 3.13Å; G958-G1009 CarbonylContact O-C 3.53Å; G958-G1009 PolarHBondContact O-N 3.4Å
959	N	59.3	Low	56.2	Low	84 Å²	84	67 Å²	67	45%	0.449	38%	0.381	S	S	.	.			trans	-98.9	120.7	-171.7	-160.2	22.7	0	0	0	111.3	E932 T961 V1008	E932-N959 PolarHBondContact O-N 3.04Å; N959-T961 PolarHBondContact ND2-OG1 3.23Å; N959-T961 PolarHBondContact O-N 2.94Å; N959-V1008 HydrophobicContact CB-CG1 4.39Å
960	P	45.1	Very low	54.8	Low	54 Å²	54	70 Å²	70	35%	0.351	40%	0.401	S	S	.	.			trans	-79.2	68.1	179.8	33.5	-35.4	0	0	0	111
961	T	36.7	Very low	52.8	Low	85 Å²	85	73.4 Å²	73.4	52%	0.521	42%	0.418	S	S	.	.			trans	-128.8	127.3	178	52.2	0	0	0	0	110.3	N959	N959-T961 PolarHBondContact ND2-OG1 3.23Å; N959-T961 PolarHBondContact O-N 2.94Å
962	I	33.2	Very low	50.3	Low	141 Å²	141	76.6 Å²	76.6	72%	0.723	44%	0.441	S	S	*	.			trans	73.6	79.1	-175.7	-45.6	174	0	0	0	113.1	T964	I962-T964 HydrophobicContact CG2-CG2 3.76Å; I962-T964 PolarHBondContact O-N 2.99Å
963	C	26.1	Very low	47.6	Very low	114 Å²	114	81.1 Å²	81.1	77%	0.77	47%	0.469	S	S	*	.			trans	-83	98.6	159.5	-172.8	0	0	0	0	109
964	T	26.5	Very low	44.6	Very low	101 Å²	101	87.6 Å²	87.6	62%	0.62	51%	0.509	S	S	*	.			trans	-118.2	112.4	168.7	47.1	0	0	0	0	108.8	I962 C966	I962-T964 HydrophobicContact CG2-CG2 3.76Å; I962-T964 PolarHBondContact O-N 2.99Å; T964-C966 PolarHBondContact O-N 3.12Å
965	S	28.8	Very low	41.7	Very low	104 Å²	104	94.3 Å²	94.3	73%	0.727	54%	0.544	S	S	*	.			trans	22.3	95.5	164.3	53.6	0	0	0	0	116.5	E967	S965-E967 PolarHBondContact O-N 3.29Å
966	C	29.1	Very low	38.7	Very low	123 Å²	123	99.6 Å²	99.6	83%	0.831	58%	0.581	S	S	*	*			trans	-63.6	101	164.4	-72.5	0	0	0	0	110.2	T964	T964-C966 PolarHBondContact O-N 3.12Å
967	E	27.5	Very low	35.8	Very low	176 Å²	176	106.4 Å²	106.4	82%	0.822	62%	0.617	S	S	*	*			trans	-62.4	166.8	161.9	-63.1	-167.7	128	0	0	111	S965 I969	S965-E967 PolarHBondContact O-N 3.29Å; E967-I969 PolarHBondContact O-N 2.82Å
968	K	28.9	Very low	33.3	Very low	202 Å²	202	116.3 Å²	116.3	88%	0.878	65%	0.653	S	S	*	*			trans	-58.3	133.5	-176.5	-67.2	164.9	-177.4	163.4	0	110.5	S970	K968-S970 PolarHBondContact O-N 2.63Å
969	I	30.1	Very low	31.3	Very low	100 Å²	100	122.5 Å²	122.5	51%	0.513	68%	0.684	S	S	.	*			trans	-48.1	108.9	175.3	-61.7	168.2	0	0	0	109.1	E967	E967-I969 PolarHBondContact O-N 2.82Å
970	S	29.3	Very low	29.9	Very low	86 Å²	86	125.7 Å²	125.7	60%	0.601	70%	0.701	S	S	*	*			trans	-76.9	131.3	-170.6	51.7	0	0	0	0	111.3	K968 C972	K968-S970 PolarHBondContact O-N 2.63Å; S970-C972 PolarHBondContact O-N 3.16Å
971	I	27.1	Very low	29.5	Very low	126 Å²	126	131.2 Å²	131.2	65%	0.646	73%	0.725	S	S	*	*			trans	-90.5	98.6	-177.1	-59.9	173.6	0	0	0	108.8	T973	I971-T973 HydrophobicContact CG2-CG2 3.89Å; I971-T973 PolarHBondContact O-N 3.21Å
972	C	27.6	Very low	29.6	Very low	85 Å²	85	134.2 Å²	134.2	57%	0.574	74%	0.738	S	S	*	*			trans	-83.2	81.6	166.6	-64.2	0	0	0	0	110.5	S970	S970-C972 PolarHBondContact O-N 3.16Å
973	T	28.4	Very low	29.5	Very low	95 Å²	95	134.7 Å²	134.7	58%	0.583	74%	0.742	S	S	*	*			trans	-81.5	116.7	161	37.2	0	0	0	0	109.3	I971 D975	I971-T973 HydrophobicContact CG2-CG2 3.89Å; I971-T973 PolarHBondContact O-N 3.21Å; T973-D975 PolarHBondContact O-N 3.2Å
974	T	27.8	Very low	30.1	Very low	137 Å²	137	138.8 Å²	138.8	84%	0.84	75%	0.747	S	S	*	*			trans	-80.1	58	177.6	51.8	0	0	0	0	111.9	S976	T974-S976 PolarHBondContact O-N 2.93Å
975	D	29.9	Very low	30.5	Very low	141 Å²	141	140.7 Å²	140.7	75%	0.754	75%	0.754	S	S	*	*			trans	-88.6	91.1	173.1	-82.5	-54.3	0	0	0	110.3	T973 N977	T973-D975 PolarHBondContact O-N 3.2Å; D975-N977 PolarHBondContact O-N 3.16Å
976	S	27.2	Very low	30.9	Very low	111 Å²	111	143.1 Å²	143.1	78%	0.776	76%	0.756	S	S	*	*			trans	-75.7	80.7	179.7	58.5	0	0	0	0	112	T974	T974-S976 PolarHBondContact O-N 2.93Å
977	N	28.2	Very low	31.1	Very low	146 Å²	146	144.3 Å²	144.3	78%	0.781	76%	0.755	S	S	*	*			trans	-165.9	141.3	161.6	-109.3	-59.3	0	0	0	115.2	D975	D975-N977 PolarHBondContact O-N 3.16Å
978	R	30.8	Very low	31.6	Very low	218 Å²	218	143.4 Å²	143.4	82%	0.823	76%	0.756	S	S	*	*			trans	76.8	93.1	163.8	-60.5	175.6	178.3	177.3	-0.2	120
979	N	29.8	Very low	31.8	Very low	144 Å²	144	141.6 Å²	141.6	77%	0.77	76%	0.755	S	S	*	*				41.6	125.8	114.7	-51.2	3.8	0	0	0	120.8
980	N	30.1	Very low	32	Very low	151 Å²	151	144.1 Å²	144.1	81%	0.807	77%	0.77	S	S	*	*			trans	51	120.6	145.6	-59.2	11.1	0	0	0	119.9
981	I	37.3	Very low	32.2	Very low	169 Å²	169	145.8 Å²	145.8	87%	0.867	78%	0.776	S	S	*	*				-165.5	152.3	115.2	-99.3	153.5	0	0	0	109.6
982	D	37.7	Very low	32.3	Very low	148 Å²	148	147.9 Å²	147.9	79%	0.791	79%	0.787	S	S	*	*			trans	-79.2	167.8	-165.6	-56.2	-89.8	0	0	0	116.4
983	N	31.6	Very low	32.5	Very low	152 Å²	152	149.2 Å²	149.2	81%	0.813	79%	0.792	S	S	*	*			trans	-49.3	147.8	176.2	-53.7	-45	0	0	0	114.3
984	K	38.4	Very low	32.5	Very low	199 Å²	199	152.1 Å²	152.1	87%	0.865	80%	0.804	S	S	*	*			trans	-157.4	147.4	140	-119.6	168.1	-171.8	176.7	0	113.7
985	D	34.8	Very low	32.5	Very low	142 Å²	142	154.9 Å²	154.9	76%	0.759	81%	0.808	S	S	*	*			trans	-82.9	140.9	-172.5	-31.6	-97.5	0	0	0	111.3
986	I	37.1	Very low	32.3	Very low	154 Å²	154	157.5 Å²	157.5	79%	0.79	81%	0.812	S	S	*	*			trans	-142.6	111.9	159.6	-59.5	-176.2	0	0	0	107.5
987	D	33.4	Very low	32.2	Very low	149 Å²	149	161.9 Å²	161.9	80%	0.797	82%	0.818	S	S	*	*			trans	-79.8	143.8	162.5	-52.4	-73	0	0	0	109.5
988	D	38.3	Very low	32.1	Very low	157 Å²	157	160.8 Å²	160.8	84%	0.84	82%	0.82	S	S	*	*			trans	-149.6	95.5	164.2	-100.6	-40.4	0	0	0	109.4	D990	D988-D990 PolarHBondContact O-N 3.47Å
989	D	33.1	Very low	31.8	Very low	163 Å²	163	160 Å²	160	87%	0.872	83%	0.825	S	S	*	*			trans	-75.3	109.4	171	-91.1	-50.6	0	0	0	110.5
990	D	34.6	Very low	31.7	Very low	153 Å²	153	161.3 Å²	161.3	82%	0.818	83%	0.827	S	S	*	*			trans	-160.6	173.4	153.6	-135.9	-31.9	0	0	0	114	D988	D988-D990 PolarHBondContact O-N 3.47Å
991	V	33.9	Very low	31.5	Very low	122 Å²	122	161.8 Å²	161.8	74%	0.739	83%	0.829	S	S	*	*			trans	76.7	50.7	175.9	-157.8	0	0	0	0	116	V993	V991-V993 PolarHBondContact O-N 3.14Å
992	I	28.3	Very low	31.1	Very low	170 Å²	170	159 Å²	159	87%	0.872	82%	0.819	S	S	*	*			trans	-91.5	75.7	161.5	-52.4	-179.1	0	0	0	110.7
993	V	31.1	Very low	30.6	Very low	113 Å²	113	160.3 Å²	160.3	69%	0.685	83%	0.827	S	S	*	*			trans	-142.6	144.4	170.9	-165.1	0	0	0	0	111	V991	V991-V993 PolarHBondContact O-N 3.14Å
994	N	28.7	Very low	30.3	Very low	155 Å²	155	155.2 Å²	155.2	83%	0.829	81%	0.81	S	S	*	*			trans	86.7	12.3	171.9	-58.4	-42.9	0	0	0	120.6	K996	N994-K996 VanDerWaalsContact C-N 3.32Å; N994-K996 PolarHBondContact O-N 2.92Å
995	Q	27.8	Very low	29.9	Very low	196 Å²	196	150 Å²	150	92%	0.916	81%	0.813	S	S	*	*			trans	-77.3	76.2	159.5	-74.7	-169	-3.8	0	0	111.8
996	K	26.3	Very low	29.9	Very low	195 Å²	195	148.8 Å²	148.8	85%	0.848	81%	0.811	S	S	*	*			trans	-161.4	62.8	174	-124.8	163.6	-169.8	169.8	0	117.7	N994	N994-K996 VanDerWaalsContact C-N 3.32Å; N994-K996 PolarHBondContact O-N 2.92Å
997	K	25.2	Very low	30.4	Very low	204 Å²	204	143.7 Å²	143.7	89%	0.887	79%	0.788	S	S	*	*	S	Bend	trans	-167	170.8	151.9	-110.5	159.5	-174.5	178.2	0	111
998	C	25.4	Very low	31.5	Very low	123 Å²	123	138.9 Å²	138.9	83%	0.831	76%	0.764	S	S	*	*			trans	72	25.9	177.3	-56.8	0	0	0	0	118	H1000	C998-H1000 PolarHBondContact O-N 3.04Å
999	Q	25.6	Very low	32.4	Very low	200 Å²	200	131.5 Å²	131.5	94%	0.935	73%	0.725	S	S	*	*			trans	-83.4	98.5	144	-79.9	-176.6	-19.7	0	0	108.3
1000	H	28	Very low	34.2	Very low	172 Å²	172	124.7 Å²	124.7	80%	0.796	69%	0.688	S	S	*	*			trans	-111	122.9	168.5	-111.7	-69.4	0	0	0	109.1	C998 V1002	C998-H1000 PolarHBondContact O-N 3.04Å; H1000-V1002 PolarHBondContact O-N 3.31Å
1001	N	24.2	Very low	36.5	Very low	162 Å²	162	117.4 Å²	117.4	87%	0.866	65%	0.649	S	S	*	*			trans	-60.2	117.6	176.3	-79.5	-14.7	0	0	0	110.9
1002	V	30.5	Very low	39	Very low	109 Å²	109	112.3 Å²	112.3	66%	0.661	62%	0.617	S	S	*	*			trans	-135.2	85.9	164.1	-173.2	0	0	0	0	108.7	H1000 G1004	H1000-V1002 PolarHBondContact O-N 3.31Å; V1002-G1004 VanDerWaalsContact C-N 3.27Å; V1002-G1004 PolarHBondContact O-N 2.61Å
1003	N	26	Very low	41.9	Very low	177 Å²	177	104.2 Å²	104.2	95%	0.947	58%	0.575	S	S	*	*			trans	-74.7	87	162.1	-79.9	-3.2	0	0	0	108
1004	G	26.7	Very low	44.6	Very low	45 Å²	45	98.8 Å²	98.8	46%	0.464	54%	0.543	S	S	.	.	S	Bend	trans	-171.1	137.4	178.5	0	0	0	0	0	109.2	V1002 V1006	V1002-G1004 VanDerWaalsContact C-N 3.27Å; V1002-G1004 PolarHBondContact O-N 2.61Å; G1004-V1006 PolarHBondContact O-N 3.01Å
1005	G	28.1	Very low	47.4	Very low	90 Å²	90	91.4 Å²	91.4	93%	0.928	50%	0.503	S	S	*	.			trans	-53.2	106.2	-164.8	0	0	0	0	0	114.4	S1007	G1005-S1007 PolarHBondContact O-N 3.43Å
1006	V	36.8	Very low	50	Low	116 Å²	116	82.3 Å²	82.3	70%	0.703	46%	0.461	S	S	*	.	P	Polyproline II helix	trans	-77.2	116.6	172.9	-179	0	0	0	0	108.2	G1004 V1008	G1004-V1006 PolarHBondContact O-N 3.01Å; V1006-V1008 PolarHBondContact O-N 3.39Å
1007	S	47.4	Very low	52.4	Low	46 Å²	46	73.3 Å²	73.3	32%	0.322	42%	0.422	S	S	.	.	P	Polyproline II helix	trans	-65.8	130.8	172.7	45.9	0	0	0	0	110.7	G1005 N1031	G1005-S1007 PolarHBondContact O-N 3.43Å; S1007-N1031 PolarHBondContact OG-OD1 2.94Å
1008	V	54.8	Low	54.7	Low	49 Å²	49	64.8 Å²	64.8	30%	0.297	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-54.8	154.4	177	-176.6	0	0	0	0	110.9	G958 N959 V1006 M1010 T1030	G958-V1008 WeakPolarHBondContact O-CG1 3.49Å; N959-V1008 HydrophobicContact CB-CG1 4.39Å; V1006-V1008 PolarHBondContact O-N 3.39Å; V1008-M1010 HydrophobicContact CB-CG 4.25Å; V1008-M1010 HydrophobicContact CB-SD 3.7Å; V1008-M1010 HydrophobicContact CG1-SD 3.52Å; V1008-M1010 VanDerWaalsContact CG1-SD 3.52Å; V1008-M1010 WeakPolarHBondContact O-CG 3.29Å; V1008-M1010 PolarHBondContact O-N 2.88Å; V1008-T1030 WeakPolarHBondContact O-CG2 3.35Å
1009	G	57.9	Low	56.8	Low	1 Å²	1	66.8 Å²	66.8	1%	0.01	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.3	62.6	-175.4	0	0	0	0	0	114.5	S957 G958	S957-G1009 WeakPolarHBondContact CA-O 3.4Å; G958-G1009 PolarHBondContact N-O 3.34Å; G958-G1009 VanDerWaalsContact N-O 3.13Å; G958-G1009 CarbonylContact O-C 3.53Å; G958-G1009 PolarHBondContact O-N 3.4Å
1010	M	72.1	Confident	59	Low	20 Å²	20	62 Å²	62	10%	0.099	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	-23.1	-169	-53.5	-50.4	-76.2	0	0	114.6	S957 V1008 T1030 P1045 I1046 L1048 T1049	S957-M1010 WeakPolarHBondContact CB-O 3.47Å; V1008-M1010 HydrophobicContact CB-CG 4.25Å; V1008-M1010 HydrophobicContact CB-SD 3.7Å; V1008-M1010 HydrophobicContact CG1-SD 3.52Å; V1008-M1010 VanDerWaalsContact CG1-SD 3.52Å; V1008-M1010 WeakPolarHBondContact O-CG 3.29Å; V1008-M1010 PolarHBondContact O-N 2.88Å; M1010-T1030 PolarHBondContact N-OG1 3.01Å; M1010-T1030 VanDerWaalsContact N-OG1 3.15Å; M1010-P1045 HydrophobicContact CE-CB 4.3Å; M1010-P1045 HydrophobicContact CE-CG 4.43Å; M1010-P1045 HydrophobicContact CG-CB 4.04Å; M1010-P1045 WeakPolarHBondContact CG-O 3.32Å; M1010-P1045 HydrophobicContact SD-CB 4.49Å; M1010-I1046 HydrophobicContact CE-CB 4.31Å; M1010-I1046 HydrophobicContact CE-CG1 3.68Å; M1010-L1048 HydrophobicContact CB-CB 4.5Å; M1010-T1049 HydrophobicContact CB-CG2 4.48Å; M1010-T1049 HydrophobicContact CE-CG2 4.42Å; M1010-T1049 WeakPolarHBondContact O-CA 3.39Å; M1010-T1049 WeakPolarHBondContact O-CG2 3.41Å
1011	A	81.9	Confident	61.2	Low	0 Å²	0	57.7 Å²	57.7	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	70.3	-168.9	0	0	0	0	0	110.9	L1029 T1030 L1033 L1048 I1050	A1011-L1029 HydrophobicContact CB-CB 4.32Å; A1011-L1029 WeakPolarHBondContact O-CB 3.38Å; A1011-L1029 PolarHBondContact O-N 3.04Å; A1011-T1030 WeakPolarHBondContact CB-OG1 3.17Å; A1011-T1030 PolarHBondContact N-OG1 3.03Å; A1011-L1033 HydrophobicContact CB-CD1 3.98Å; A1011-L1048 WeakPolarHBondContact CB-O 3.37Å; A1011-I1050 HydrophobicContact CB-CD1 4.27Å; A1011-I1050 HydrophobicContact CB-CG1 4.22Å
1012	R	86.8	Confident	63.4	Low	15 Å²	15	51.7 Å²	51.7	6%	0.057	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	145.1	-178.1	-71.4	170.9	170.7	-164.9	-6.2	111.6	E932 T933 V956 I1027 D1028	E932-R1012 IonicContact OE2-CZ 3.97Å; E932-R1012 IonicContact OE2-NH1 3.22Å; E932-R1012 PolarHBondContact OE2-NH1 2.94Å; E932-R1012 IonicContact OE2-NH2 2.68Å; T933-R1012 VanDerWaalsContact CG2-CD 3.43Å; V956-R1012 HydrophobicContact CG2-CB 3.83Å; V956-R1012 PolarHBondContact N-O 3.47Å; V956-R1012 PolarHBondContact O-N 3.1Å; R1012-I1027 CarbonylContact C-O 3.59Å; R1012-I1027 VanDerWaalsContact CA-O 3.31Å; R1012-I1027 WeakPolarHBondContact CA-O 3.23Å; R1012-D1028 HydrophobicContact CG-CB 4.19Å; R1012-D1028 WeakPolarHBondContact CG-OD2 3.36Å; R1012-D1028 IonicContact CZ-OD2 3.22Å; R1012-D1028 IonicContact NE-OD2 3.95Å; R1012-D1028 PolarHBondContact NE-OD2 2.98Å; R1012-D1028 IonicContact NH2-OD2 3.64Å; R1012-D1028 PolarHBondContact NH2-OD2 3.08Å
1013	L	89.5	Confident	65.6	Low	0 Å²	0	49.4 Å²	49.4	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	124.7	173.3	-62.9	179.9	0	0	0	109.8	W953 L954 A955 Q1026 I1027 L1029 I1050 L1053 L1076	W953-L1013 HydrophobicContact CE3-CB 4.16Å; W953-L1013 HydrophobicContact CZ3-CB 4.09Å; L954-L1013 WeakPolarHBondContact O-CA 3.39Å; A955-L1013 HydrophobicContact CB-CD2 4.08Å; L1013-Q1026 WeakPolarHBondContact O-CA 3.46Å; L1013-I1027 HydrophobicContact CB-CB 4.41Å; L1013-I1027 PolarHBondContact N-O 3.48Å; L1013-I1027 PolarHBondContact O-N 3.2Å; L1013-L1029 HydrophobicContact CD1-CD1 4.05Å; L1013-L1029 HydrophobicContact CG-CD1 4.45Å; L1013-I1050 HydrophobicContact CD2-CD1 3.65Å; L1013-I1050 HydrophobicContact CD2-CG2 4.48Å; L1013-I1050 HydrophobicContact CG-CD1 3.94Å; L1013-L1053 HydrophobicContact CD2-CD1 4.33Å; L1013-L1053 HydrophobicContact CD2-CD2 3.83Å; L1013-L1076 HydrophobicContact CD1-CD2 3.62Å
1014	L	88	Confident	68	Low	0 Å²	0	42.9 Å²	42.9	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	131.2	169.9	-50.4	177.9	0	0	0	109	L929 P930 W953 L954 V956 I1023 R1025 Q1026	L929-L1014 HydrophobicContact CD2-CD1 4.42Å; P930-L1014 HydrophobicContact CG-CD1 4.13Å; W953-L1014 CarbonylContact C-O 3.58Å; W953-L1014 WeakPolarHBondContact CA-O 3.38Å; L954-L1014 HydrophobicContact CB-CB 4.29Å; L954-L1014 PolarHBondContact N-O 3.03Å; L954-L1014 PolarHBondContact O-N 3.32Å; V956-L1014 HydrophobicContact CG1-CD1 4.17Å; V956-L1014 HydrophobicContact CG2-CD1 3.98Å; V956-L1014 HydrophobicContact CG2-CD2 4.43Å; V956-L1014 HydrophobicContact CG2-CG 3.84Å; L1014-I1023 HydrophobicContact CD1-CD1 4.29Å; L1014-I1023 HydrophobicContact CD2-CG2 4.49Å; L1014-R1025 WeakPolarHBondContact CA-O 3.44Å; L1014-Q1026 HydrophobicContact CD2-CB 3.75Å; L1014-Q1026 HydrophobicContact CD2-CG 3.56Å
1015	A	86.4	Confident	70.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	123.7	164	0	0	0	0	0	108.3	I951 W953 I1023 L1024 R1025	I951-A1015 HydrophobicContact CG2-CB 3.84Å; W953-A1015 HydrophobicContact CD2-CB 3.92Å; W953-A1015 HydrophobicContact CE3-CB 3.93Å; W953-A1015 HydrophobicContact CH2-CB 3.71Å; W953-A1015 HydrophobicContact CZ2-CB 3.65Å; W953-A1015 HydrophobicContact CZ3-CB 3.84Å; A1015-I1023 CarbonylContact O-C 3.52Å; A1015-L1024 HydrophobicContact CB-CB 4.4Å; A1015-L1024 PolarHBondContact O-N 3.05Å; A1015-R1025 HydrophobicContact CB-CB 3.87Å; A1015-R1025 PolarHBondContact N-O 3.02Å; A1015-R1025 PolarHBondContact O-N 3.03Å
1016	C	82.7	Confident	73.1	Confident	4 Å²	4	39.2 Å²	39.2	3%	0.027	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	145.5	-176.4	-63.8	0	0	0	0	111.5	L927 V952 C1022	L927-C1016 HydrophobicContact CD1-CB 3.6Å; V952-C1016 PolarHBondContact N-O 3.14Å; V952-C1016 PolarHBondContact O-N 2.97Å; C1016-C1022 WeakPolarHBondContact CA-O 3.4Å
1017	C	77.6	Confident	75.4	Confident	6 Å²	6	33.8 Å²	33.8	4%	0.041	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	110.9	175.3	-177.7	0	0	0	0	110.4	K1019 Q1020 K1021 C1022 L1024	C1017-K1019 VanDerWaalsContact C-N 3.35Å; C1017-K1019 PolarHBondContact O-N 2.92Å; C1017-Q1020 HydrophobicContact CB-CB 4.04Å; C1017-Q1020 PolarHBondContact O-N 3.07Å; C1017-Q1020 PolarHBondContact SG-OE1 3.5Å; C1017-K1021 WeakPolarHBondContact O-CA 3.27Å; C1017-K1021 PolarHBondContact O-N 3.42Å; C1017-C1022 PolarHBondContact N-O 3.08Å; C1017-C1022 PolarHBondContact O-N 2.95Å; C1017-L1024 HydrophobicContact CB-CD1 3.88Å; C1017-L1024 HydrophobicContact CB-CD2 3.84Å; C1017-L1024 HydrophobicContact CB-CG 3.77Å
1018	P	71.9	Confident	77.2	Confident	26 Å²	26	32.1 Å²	32.1	17%	0.169	16%	0.157	C	C	.	.	G	3₁₀ helix	trans	-54.9	-45.6	176	-31	39.6	0	0	0	113.8	W904 D950 V952 Q1020 K1021	W904-P1018 HydrophobicContact CH2-CB 4.17Å; W904-P1018 HydrophobicContact CH2-CG 4.12Å; W904-P1018 HydrophobicContact CZ2-CB 3.66Å; W904-P1018 HydrophobicContact CZ2-CG 3.48Å; W904-P1018 VanDerWaalsContact CZ2-CG 3.48Å; D950-P1018 WeakPolarHBondContact O-CD 3.47Å; V952-P1018 HydrophobicContact CG2-CG 3.68Å; P1018-Q1020 VanDerWaalsContact C-N 3.28Å; P1018-Q1020 PolarHBondContact O-N 2.99Å; P1018-K1021 PolarHBondContact O-N 3.27Å
1019	K	70.9	Confident	78.7	Confident	165 Å²	165	29.8 Å²	29.8	72%	0.717	14%	0.143	S	C	*	.	G	3₁₀ helix	trans	-67.6	-27.4	-175.6	-61.9	-171.3	-175.4	176.9	0	112.7	A949 C1017	A949-K1019 HydrophobicContact CB-CB 4.25Å; A949-K1019 HydrophobicContact CB-CD 3.87Å; A949-K1019 HydrophobicContact CB-CG 3.93Å; C1017-K1019 VanDerWaalsContact C-N 3.35Å; C1017-K1019 PolarHBondContact O-N 2.92Å
1020	Q	70.5	Confident	79.9	Confident	100 Å²	100	29.8 Å²	29.8	47%	0.467	14%	0.143	S	C	.	.	G	3₁₀ helix	trans	-104.3	-4.6	-179.8	-64.6	170.7	-45.4	0	0	113	C1017 P1018 C1022	C1017-Q1020 HydrophobicContact CB-CB 4.04Å; C1017-Q1020 PolarHBondContact O-N 3.07Å; C1017-Q1020 PolarHBondContact SG-OE1 3.5Å; P1018-Q1020 VanDerWaalsContact C-N 3.28Å; P1018-Q1020 PolarHBondContact O-N 2.99Å; Q1020-C1022 VanDerWaalsContact CB-SG 3.51Å; Q1020-C1022 PolarHBondContact O-N 3.38Å; Q1020-C1022 VanDerWaalsContact O-N 3.1Å
1021	K	74.1	Confident	80.1	Confident	80 Å²	80	32.3 Å²	32.3	35%	0.348	16%	0.157	S	C	.	.	T	Hydrogen-bonded Turn	trans	48.3	29.8	-174.4	-53.5	-165.6	-174	-153.5	0	114.7	T925 L927 C1017 P1018	T925-K1021 WeakPolarHBondContact OG1-CD 3.43Å; T925-K1021 WeakPolarHBondContact OG1-CE 3.3Å; T925-K1021 PolarHBondContact OG1-NZ 3.43Å; L927-K1021 HydrophobicContact CD2-CB 4.5Å; C1017-K1021 WeakPolarHBondContact O-CA 3.27Å; C1017-K1021 PolarHBondContact O-N 3.42Å; P1018-K1021 PolarHBondContact O-N 3.27Å
1022	C	71.5	Confident	79.9	Confident	36 Å²	36	32.5 Å²	32.5	24%	0.243	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	158.5	-173.5	70	0	0	0	0	112.8	C1016 C1017 Q1020	C1016-C1022 WeakPolarHBondContact CA-O 3.4Å; C1017-C1022 PolarHBondContact N-O 3.08Å; C1017-C1022 PolarHBondContact O-N 2.95Å; Q1020-C1022 VanDerWaalsContact CB-SG 3.51Å; Q1020-C1022 PolarHBondContact O-N 3.38Å; Q1020-C1022 VanDerWaalsContact O-N 3.1Å
1023	I	76	Confident	79.5	Confident	61 Å²	61	31.8 Å²	31.8	31%	0.313	16%	0.156	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	123.6	166.2	-58.3	171.9	0	0	0	107.3	P930 L1014 A1015 R1025	P930-I1023 HydrophobicContact CG-CD1 3.65Å; L1014-I1023 HydrophobicContact CD1-CD1 4.29Å; L1014-I1023 HydrophobicContact CD2-CG2 4.49Å; A1015-I1023 CarbonylContact O-C 3.52Å; I1023-R1025 WeakPolarHBondContact CG2-O 3.37Å
1024	L	76.2	Confident	78.8	Confident	40 Å²	40	33.4 Å²	33.4	21%	0.209	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	-30.8	175	-65.2	177.7	0	0	0	112.6	I951 A1015 C1017 Y1083 Y1085	I951-L1024 HydrophobicContact CD1-CD1 4.24Å; I951-L1024 HydrophobicContact CG1-CD1 4.2Å; I951-L1024 HydrophobicContact CG2-CD1 4.35Å; A1015-L1024 HydrophobicContact CB-CB 4.4Å; A1015-L1024 PolarHBondContact O-N 3.05Å; C1017-L1024 HydrophobicContact CB-CD1 3.88Å; C1017-L1024 HydrophobicContact CB-CD2 3.84Å; C1017-L1024 HydrophobicContact CB-CG 3.77Å; L1024-Y1083 HydrophobicContact CD1-CE1 4.42Å; L1024-Y1085 HydrophobicContact CD2-CD1 4.37Å; L1024-Y1085 HydrophobicContact CD2-CE1 4.04Å
1025	R	80.1	Confident	77.9	Confident	33 Å²	33	36.4 Å²	36.4	13%	0.125	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	136.8	-172.5	-160.8	174	-178.6	155	6.6	109.4	L1014 A1015 I1023 I1027 D1079 E1091	L1014-R1025 WeakPolarHBondContact CA-O 3.44Å; A1015-R1025 HydrophobicContact CB-CB 3.87Å; A1015-R1025 PolarHBondContact N-O 3.02Å; A1015-R1025 PolarHBondContact O-N 3.03Å; I1023-R1025 WeakPolarHBondContact CG2-O 3.37Å; R1025-I1027 HydrophobicContact CG-CD1 4.32Å; R1025-I1027 HydrophobicContact CG-CG1 3.96Å; R1025-D1079 PolarHBondContact NH1-O 3.41Å; R1025-D1079 PolarHBondContact NH2-O 3.33Å; R1025-E1091 IonicContact CZ-OE1 3.69Å; R1025-E1091 IonicContact CZ-OE2 2.93Å; R1025-E1091 IonicContact NE-OE2 3.67Å; R1025-E1091 PolarHBondContact NE-OE2 3.47Å; R1025-E1091 VanDerWaalsContact NH2-CD 3.26Å; R1025-E1091 IonicContact NH2-OE1 2.7Å; R1025-E1091 PolarHBondContact NH2-OE1 3.04Å; R1025-E1091 IonicContact NH2-OE2 2.89Å; R1025-E1091 PolarHBondContact NH2-OE2 3.34Å
1026	Q	83	Confident	77	Confident	26 Å²	26	36.9 Å²	36.9	12%	0.121	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	119.5	170.7	172.2	165.7	-12.7	0	0	107.9	L1013 L1014 V1090 E1091	L1013-Q1026 WeakPolarHBondContact O-CA 3.46Å; L1014-Q1026 HydrophobicContact CD2-CB 3.75Å; L1014-Q1026 HydrophobicContact CD2-CG 3.56Å; Q1026-V1090 HydrophobicContact CG-CG1 4.35Å; Q1026-V1090 HydrophobicContact CG-CG2 4.18Å; Q1026-E1091 WeakPolarHBondContact O-CB 3.45Å; Q1026-E1091 PolarHBondContact O-N 3.13Å
1027	I	84.9	Confident	76.2	Confident	1 Å²	1	37 Å²	37	1%	0.005	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.4	129.1	-177.4	-44.1	179.1	0	0	0	108.6	W953 R1012 L1013 R1025 L1029 L1076 L1078 E1091	W953-I1027 HydrophobicContact CH2-CD1 3.96Å; W953-I1027 HydrophobicContact CZ3-CD1 3.95Å; R1012-I1027 CarbonylContact C-O 3.59Å; R1012-I1027 VanDerWaalsContact CA-O 3.31Å; R1012-I1027 WeakPolarHBondContact CA-O 3.23Å; L1013-I1027 HydrophobicContact CB-CB 4.41Å; L1013-I1027 PolarHBondContact N-O 3.48Å; L1013-I1027 PolarHBondContact O-N 3.2Å; R1025-I1027 HydrophobicContact CG-CD1 4.32Å; R1025-I1027 HydrophobicContact CG-CG1 3.96Å; I1027-L1029 HydrophobicContact CG2-CD2 3.65Å; I1027-L1076 HydrophobicContact CD1-CD2 4.06Å; I1027-L1078 HydrophobicContact CD1-CD2 3.42Å; I1027-L1078 VanDerWaalsContact CD1-CD2 3.42Å; I1027-E1091 WeakPolarHBondContact CA-O 3.16Å; I1027-E1091 HydrophobicContact CG1-CB 4.48Å; I1027-E1091 WeakPolarHBondContact CG2-O 3.33Å
1028	D	85.5	Confident	75.4	Confident	11 Å²	11	38.2 Å²	38.2	6%	0.059	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	119.1	171.7	-160.7	-48.9	0	0	0	109.8	R1012 T1030 V1090 E1091 S1093	R1012-D1028 HydrophobicContact CG-CB 4.19Å; R1012-D1028 WeakPolarHBondContact CG-OD2 3.36Å; R1012-D1028 IonicContact CZ-OD2 3.22Å; R1012-D1028 IonicContact NE-OD2 3.95Å; R1012-D1028 PolarHBondContact NE-OD2 2.98Å; R1012-D1028 IonicContact NH2-OD2 3.64Å; R1012-D1028 PolarHBondContact NH2-OD2 3.08Å; D1028-T1030 WeakPolarHBondContact OD1-CB 3.46Å; D1028-T1030 PolarHBondContact OD1-N 3.31Å; D1028-V1090 HydrophobicContact CB-CG1 3.59Å; D1028-E1091 PolarHBondContact N-O 3.3Å; D1028-S1093 PolarHBondContact O-N 3.35Å; D1028-S1093 PolarHBondContact O-OG 2.72Å
1029	L	85.7	Confident	75	Confident	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.205	C	C	.	.			trans	-99.1	-9.4	178	-51.8	-169.1	0	0	0	112.5	A1011 L1013 I1027 N1031 S1032 L1033 I1050 F1066 L1076 S1093 I1098	A1011-L1029 HydrophobicContact CB-CB 4.32Å; A1011-L1029 WeakPolarHBondContact O-CB 3.38Å; A1011-L1029 PolarHBondContact O-N 3.04Å; L1013-L1029 HydrophobicContact CD1-CD1 4.05Å; L1013-L1029 HydrophobicContact CG-CD1 4.45Å; I1027-L1029 HydrophobicContact CG2-CD2 3.65Å; L1029-N1031 PolarHBondContact O-N 3.41Å; L1029-S1032 PolarHBondContact O-N 3.21Å; L1029-S1032 VanDerWaalsContact O-N 3.13Å; L1029-L1033 HydrophobicContact CB-CD1 4.01Å; L1029-L1033 HydrophobicContact CB-CG 4.29Å; L1029-L1033 WeakPolarHBondContact O-CG 3.45Å; L1029-L1033 PolarHBondContact O-N 3.35Å; L1029-I1050 HydrophobicContact CD1-CD1 3.85Å; L1029-F1066 HydrophobicContact CD1-CE1 4.01Å; L1029-F1066 HydrophobicContact CD1-CE2 4.12Å; L1029-F1066 HydrophobicContact CD1-CZ 3.68Å; L1029-L1076 HydrophobicContact CD1-CD2 4.35Å; L1029-L1076 HydrophobicContact CD2-CD1 4.12Å; L1029-L1076 HydrophobicContact CD2-CD2 4.1Å; L1029-S1093 VanDerWaalsContact CD2-OG 3.27Å; L1029-S1093 WeakPolarHBondContact CD2-OG 3.45Å; L1029-I1098 HydrophobicContact CB-CD1 4.36Å; L1029-I1098 HydrophobicContact CD2-CD1 4.18Å
1030	T	81.8	Confident	74.2	Confident	1 Å²	1	39.9 Å²	39.9	1%	0.006	21%	0.206	C	C	.	.	H	α-helix	trans	-60.8	-50.9	-171.8	-66.3	0	0	0	0	111.3	V1008 M1010 A1011 D1028 S1032 L1033 S1034 L1048	V1008-T1030 WeakPolarHBondContact O-CG2 3.35Å; M1010-T1030 PolarHBondContact N-OG1 3.01Å; M1010-T1030 VanDerWaalsContact N-OG1 3.15Å; A1011-T1030 WeakPolarHBondContact CB-OG1 3.17Å; A1011-T1030 PolarHBondContact N-OG1 3.03Å; D1028-T1030 WeakPolarHBondContact OD1-CB 3.46Å; D1028-T1030 PolarHBondContact OD1-N 3.31Å; T1030-S1032 PolarHBondContact O-N 3.49Å; T1030-L1033 PolarHBondContact O-N 3.09Å; T1030-S1034 WeakPolarHBondContact O-CB 3.34Å; T1030-S1034 PolarHBondContact O-N 3.34Å; T1030-S1034 PolarHBondContact O-OG 3.15Å; T1030-L1048 HydrophobicContact CG2-CD1 4.24Å
1031	N	76.6	Confident	73.3	Confident	73 Å²	73	39.4 Å²	39.4	39%	0.39	21%	0.207	S	C	.	.	H	α-helix	trans	-59.2	-37.1	177.9	-71.2	-18.3	0	0	0	112.1	S1007 L1029 S1035 L1092	S1007-N1031 PolarHBondContact OG-OD1 2.94Å; L1029-N1031 PolarHBondContact O-N 3.41Å; N1031-S1035 VanDerWaalsContact O-CB 3.3Å; N1031-S1035 WeakPolarHBondContact O-CB 3.31Å; N1031-S1035 PolarHBondContact O-N 2.93Å; N1031-S1035 VanDerWaalsContact O-N 3.14Å; N1031-S1035 PolarHBondContact O-OG 2.78Å; N1031-L1092 HydrophobicContact CB-CD2 4.27Å; N1031-L1092 VanDerWaalsContact ND2-CD2 3.3Å; N1031-L1092 WeakPolarHBondContact ND2-CD2 3.5Å
1032	S	77.5	Confident	72.3	Confident	4 Å²	4	36.3 Å²	36.3	3%	0.028	19%	0.194	C	C	.	.	H	α-helix	trans	-68.6	-49.6	177.7	-71.6	0	0	0	0	111.8	L1029 T1030 S1035 M1036 S1093	L1029-S1032 PolarHBondContact O-N 3.21Å; L1029-S1032 VanDerWaalsContact O-N 3.13Å; T1030-S1032 PolarHBondContact O-N 3.49Å; S1032-S1035 PolarHBondContact O-N 3.34Å; S1032-S1035 PolarHBondContact O-OG 3.01Å; S1032-M1036 WeakPolarHBondContact O-CG 3.33Å; S1032-M1036 PolarHBondContact O-N 3.18Å; S1032-S1093 WeakPolarHBondContact CB-OG 3.45Å; S1032-S1093 PolarHBondContact OG-O 2.93Å; S1032-S1093 PolarHBondContact OG-OG 2.97Å
1033	L	78.3	Confident	71.3	Confident	1 Å²	1	40.5 Å²	40.5	1%	0.005	22%	0.219	C	C	.	.	H	α-helix	trans	-62.3	-48.7	179.4	-67.6	169.7	0	0	0	111.2	A1011 L1029 T1030 S1035 M1036 L1037 L1048 F1066 T1068 I1098 I1100	A1011-L1033 HydrophobicContact CB-CD1 3.98Å; L1029-L1033 HydrophobicContact CB-CD1 4.01Å; L1029-L1033 HydrophobicContact CB-CG 4.29Å; L1029-L1033 WeakPolarHBondContact O-CG 3.45Å; L1029-L1033 PolarHBondContact O-N 3.35Å; T1030-L1033 PolarHBondContact O-N 3.09Å; L1033-S1035 PolarHBondContact O-N 3.1Å; L1033-M1036 PolarHBondContact O-N 3.47Å; L1033-L1037 HydrophobicContact CB-CD1 4.35Å; L1033-L1037 WeakPolarHBondContact O-CD1 3.22Å; L1033-L1037 VanDerWaalsContact O-CG 3.26Å; L1033-L1037 WeakPolarHBondContact O-CG 3.28Å; L1033-L1037 PolarHBondContact O-N 2.78Å; L1033-L1048 HydrophobicContact CB-CD2 4.29Å; L1033-F1066 HydrophobicContact CD1-CE2 4.34Å; L1033-F1066 HydrophobicContact CD2-CE2 4.38Å; L1033-F1066 HydrophobicContact CD2-CZ 4.33Å; L1033-T1068 HydrophobicContact CD1-CG2 4.39Å; L1033-I1098 HydrophobicContact CD2-CD1 4.32Å; L1033-I1098 HydrophobicContact CG-CD1 4.44Å; L1033-I1100 HydrophobicContact CD2-CD1 4.34Å
1034	S	75.3	Confident	70.3	Confident	34 Å²	34	41.9 Å²	41.9	24%	0.238	23%	0.227	C	C	.	.	H	α-helix	trans	-58.6	-27.6	175.2	-59.9	0	0	0	0	113.4	T1030 L1048	T1030-S1034 WeakPolarHBondContact O-CB 3.34Å; T1030-S1034 PolarHBondContact O-N 3.34Å; T1030-S1034 PolarHBondContact O-OG 3.15Å; S1034-L1048 VanDerWaalsContact OG-CD1 3.28Å; S1034-L1048 WeakPolarHBondContact OG-CD1 3.28Å
1035	S	69.3	Low	69.2	Low	63 Å²	63	43.2 Å²	43.2	44%	0.441	24%	0.238	S	C	.	.	H	α-helix	trans	-81.9	-16.3	176.4	75.5	0	0	0	0	114.7	N1031 S1032 L1033 P1095	N1031-S1035 VanDerWaalsContact O-CB 3.3Å; N1031-S1035 WeakPolarHBondContact O-CB 3.31Å; N1031-S1035 PolarHBondContact O-N 2.93Å; N1031-S1035 VanDerWaalsContact O-N 3.14Å; N1031-S1035 PolarHBondContact O-OG 2.78Å; S1032-S1035 PolarHBondContact O-N 3.34Å; S1032-S1035 PolarHBondContact O-OG 3.01Å; L1033-S1035 PolarHBondContact O-N 3.1Å; S1035-P1095 WeakPolarHBondContact OG-CG 3.3Å
1036	M	66.7	Low	68.3	Low	10 Å²	10	45.6 Å²	45.6	5%	0.049	25%	0.252	C	S	.	.	H	α-helix	trans	-99.6	-17.1	-178.2	-67.3	173.4	78.3	0	0	112.9	S1032 L1033 P1095 I1098 I1100 I1171	S1032-M1036 WeakPolarHBondContact O-CG 3.33Å; S1032-M1036 PolarHBondContact O-N 3.18Å; L1033-M1036 PolarHBondContact O-N 3.47Å; M1036-P1095 HydrophobicContact CG-CB 3.98Å; M1036-P1095 HydrophobicContact SD-CB 3.96Å; M1036-I1098 HydrophobicContact SD-CB 4.17Å; M1036-I1098 HydrophobicContact SD-CG2 4.43Å; M1036-I1100 HydrophobicContact CB-CD1 4.01Å; M1036-I1100 HydrophobicContact CE-CD1 3.76Å; M1036-I1100 HydrophobicContact CE-CG1 3.84Å; M1036-I1100 HydrophobicContact SD-CD1 4.05Å; M1036-I1171 WeakPolarHBondContact O-CB 3.49Å; M1036-I1171 WeakPolarHBondContact O-CD1 3.25Å; M1036-I1171 WeakPolarHBondContact O-CG1 3.33Å; M1036-I1171 PolarHBondContact O-N 3.07Å
1037	L	66.7	Low	67.8	Low	5 Å²	5	46.1 Å²	46.1	3%	0.026	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-105.9	153.7	-170.6	-63.8	166.6	0	0	0	111.7	L1033 L1048 L1072 I1100 H1170	L1033-L1037 HydrophobicContact CB-CD1 4.35Å; L1033-L1037 WeakPolarHBondContact O-CD1 3.22Å; L1033-L1037 VanDerWaalsContact O-CG 3.26Å; L1033-L1037 WeakPolarHBondContact O-CG 3.28Å; L1033-L1037 PolarHBondContact O-N 2.78Å; L1037-L1048 HydrophobicContact CD1-CD2 3.65Å; L1037-L1072 HydrophobicContact CD1-CD1 3.4Å; L1037-L1072 VanDerWaalsContact CD1-CD1 3.4Å; L1037-L1072 HydrophobicContact CD2-CD1 3.51Å; L1037-L1072 HydrophobicContact CD2-CD2 3.97Å; L1037-L1072 HydrophobicContact CD2-CG 4.39Å; L1037-L1072 HydrophobicContact CG-CD1 4.07Å; L1037-I1100 HydrophobicContact CD2-CD1 4.39Å; L1037-H1170 PolarHBondContact O-ND1 2.91Å
1038	D	61.3	Low	67.6	Low	33 Å²	33	46.2 Å²	46.2	18%	0.176	26%	0.256	C	S	.	.			trans	-79.7	131.9	153.4	-155.6	-39.5	0	0	0	109.7	E1040 H1170 I1171 N1172	D1038-E1040 WeakPolarHBondContact OD1-CB 3.24Å; D1038-E1040 WeakPolarHBondContact OD1-CG 3.1Å; D1038-E1040 PolarHBondContact OD1-N 3.32Å; D1038-H1170 HydrophobicContact CB-CB 4.23Å; D1038-I1171 WeakPolarHBondContact CB-O 3.36Å; D1038-I1171 PolarHBondContact N-O 3.45Å; D1038-N1172 HydrophobicContact CB-CB 4.27Å; D1038-N1172 PolarHBondContact OD2-ND2 3.11Å
1039	M	63.1	Low	67.5	Low	69 Å²	69	45.8 Å²	45.8	34%	0.34	25%	0.254	S	S	.	.			trans	-100.4	-1.9	-178.5	-64.5	-67.2	-69.4	0	0	112.7	N1041 V1042 L1048	M1039-N1041 PolarHBondContact O-N 3.17Å; M1039-V1042 HydrophobicContact CE-CB 3.76Å; M1039-V1042 HydrophobicContact CE-CG1 3.53Å; M1039-V1042 PolarHBondContact O-N 2.83Å; M1039-V1042 HydrophobicContact SD-CB 3.95Å; M1039-V1042 HydrophobicContact SD-CG1 4.12Å; M1039-V1042 HydrophobicContact SD-CG2 4.1Å; M1039-L1048 HydrophobicContact CE-CD1 4.39Å
1040	E	54.9	Low	67.7	Low	157 Å²	157	45.9 Å²	45.9	73%	0.734	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.6	-25.6	178.8	-80.9	-172.9	164.6	0	0	114.4	D1038	D1038-E1040 WeakPolarHBondContact OD1-CB 3.24Å; D1038-E1040 WeakPolarHBondContact OD1-CG 3.1Å; D1038-E1040 PolarHBondContact OD1-N 3.32Å
1041	N	49.9	Very low	68	Low	90 Å²	90	47.3 Å²	47.3	48%	0.481	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.4	11.6	-179.6	-71.7	-107	0	0	0	113.1	M1039	M1039-N1041 PolarHBondContact O-N 3.17Å
1042	V	53.2	Low	68.6	Low	15 Å²	15	48 Å²	48	9%	0.091	26%	0.261	C	S	.	.			trans	-111.3	86	179.5	-177.9	0	0	0	0	108.2	M1039 D1047	M1039-V1042 HydrophobicContact CE-CB 3.76Å; M1039-V1042 HydrophobicContact CE-CG1 3.53Å; M1039-V1042 PolarHBondContact O-N 2.83Å; M1039-V1042 HydrophobicContact SD-CB 3.95Å; M1039-V1042 HydrophobicContact SD-CG1 4.12Å; M1039-V1042 HydrophobicContact SD-CG2 4.1Å; V1042-D1047 HydrophobicContact CG1-CB 3.8Å
1043	T	51.3	Low	69.2	Low	123 Å²	123	48.8 Å²	48.8	76%	0.755	27%	0.265	S	S	*	.			trans	-72.5	-34	-174.4	49.5	0	0	0	0	112.8
1044	D	56.2	Low	69.6	Low	90 Å²	90	49.8 Å²	49.8	48%	0.481	27%	0.27	S	S	.	.			trans	-112.4	130.2	-178.1	-70.6	-55.6	0	0	0	111.2	I1046 D1047	D1044-I1046 HydrophobicContact CB-CB 4.29Å; D1044-I1046 PolarHBondContact O-N 3.01Å; D1044-D1047 WeakPolarHBondContact O-CB 3.26Å; D1044-D1047 PolarHBondContact O-N 3.42Å
1045	P	52.1	Low	69.9	Low	69 Å²	69	48.5 Å²	48.5	45%	0.448	26%	0.261	S	S	.	.	G	3₁₀ helix	trans	-63.2	-15.6	175.1	27.6	-35.2	0	0	0	112.6	M1010 D1047 L1048	M1010-P1045 HydrophobicContact CE-CB 4.3Å; M1010-P1045 HydrophobicContact CE-CG 4.43Å; M1010-P1045 HydrophobicContact CG-CB 4.04Å; M1010-P1045 WeakPolarHBondContact CG-O 3.32Å; M1010-P1045 HydrophobicContact SD-CB 4.49Å; P1045-D1047 PolarHBondContact O-N 2.97Å; P1045-L1048 PolarHBondContact O-N 3.38Å
1046	I	61.3	Low	70.1	Confident	83 Å²	83	45.8 Å²	45.8	43%	0.426	24%	0.241	S	C	.	.	G	3₁₀ helix	trans	-60.7	-24.1	173	-68	170.3	0	0	0	111.8	M1010 D1044 L1048 T1049	M1010-I1046 HydrophobicContact CE-CB 4.31Å; M1010-I1046 HydrophobicContact CE-CG1 3.68Å; D1044-I1046 HydrophobicContact CB-CB 4.29Å; D1044-I1046 PolarHBondContact O-N 3.01Å; I1046-L1048 VanDerWaalsContact C-N 3.27Å; I1046-L1048 PolarHBondContact O-N 2.98Å; I1046-T1049 VanDerWaalsContact O-CB 3.29Å; I1046-T1049 WeakPolarHBondContact O-CB 3.28Å; I1046-T1049 WeakPolarHBondContact O-CG2 3.39Å; I1046-T1049 PolarHBondContact O-N 3.46Å; I1046-T1049 VanDerWaalsContact O-N 3.08Å; I1046-T1049 PolarHBondContact O-OG1 3.1Å
1047	D	73	Confident	69.9	Low	36 Å²	36	47.5 Å²	47.5	19%	0.193	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-65.6	-28	179.2	-73.5	-22.4	0	0	0	112.8	V1042 D1044 P1045 T1049 R1069 S1070	V1042-D1047 HydrophobicContact CG1-CB 3.8Å; D1044-D1047 WeakPolarHBondContact O-CB 3.26Å; D1044-D1047 PolarHBondContact O-N 3.42Å; P1045-D1047 PolarHBondContact O-N 2.97Å; D1047-T1049 PolarHBondContact O-N 3.07Å; D1047-R1069 CarbonylContact O-C 3.57Å; D1047-R1069 VanDerWaalsContact O-C 3.32Å; D1047-R1069 PolarHBondContact O-N 2.93Å; D1047-S1070 WeakPolarHBondContact O-CB 3.13Å; D1047-S1070 PolarHBondContact O-N 3.44Å
1048	L	79.2	Confident	69.4	Low	3 Å²	3	50.6 Å²	50.6	2%	0.016	27%	0.269	C	S	.	.	G	3₁₀ helix	trans	-74.7	-7.2	176	-61.8	-180	0	0	0	113.2	M1010 A1011 T1030 L1033 S1034 L1037 M1039 P1045 I1046 I1050	M1010-L1048 HydrophobicContact CB-CB 4.5Å; A1011-L1048 WeakPolarHBondContact CB-O 3.37Å; T1030-L1048 HydrophobicContact CG2-CD1 4.24Å; L1033-L1048 HydrophobicContact CB-CD2 4.29Å; S1034-L1048 VanDerWaalsContact OG-CD1 3.28Å; S1034-L1048 WeakPolarHBondContact OG-CD1 3.28Å; L1037-L1048 HydrophobicContact CD1-CD2 3.65Å; M1039-L1048 HydrophobicContact CE-CD1 4.39Å; P1045-L1048 PolarHBondContact O-N 3.38Å; I1046-L1048 VanDerWaalsContact C-N 3.27Å; I1046-L1048 PolarHBondContact O-N 2.98Å; L1048-I1050 PolarHBondContact O-N 3.45Å
1049	T	85.2	Confident	69.1	Low	2 Å²	2	50.5 Å²	50.5	1%	0.012	27%	0.27	C	S	.	.	S	Bend	trans	-61.4	135.6	-178.8	58.7	0	0	0	0	111.8	M1010 I1046 D1047 C1051 T1068 R1069	M1010-T1049 HydrophobicContact CB-CG2 4.48Å; M1010-T1049 HydrophobicContact CE-CG2 4.42Å; M1010-T1049 WeakPolarHBondContact O-CA 3.39Å; M1010-T1049 WeakPolarHBondContact O-CG2 3.41Å; I1046-T1049 VanDerWaalsContact O-CB 3.29Å; I1046-T1049 WeakPolarHBondContact O-CB 3.28Å; I1046-T1049 WeakPolarHBondContact O-CG2 3.39Å; I1046-T1049 PolarHBondContact O-N 3.46Å; I1046-T1049 VanDerWaalsContact O-N 3.08Å; I1046-T1049 PolarHBondContact O-OG1 3.1Å; D1047-T1049 PolarHBondContact O-N 3.07Å; T1049-C1051 PolarHBondContact O-N 3.28Å; T1049-T1068 CarbonylContact O-C 3.55Å; T1049-T1068 WeakPolarHBondContact O-CA 3.36Å; T1049-R1069 PolarHBondContact O-N 3.46Å; T1049-R1069 WeakPolarHBondContact OG1-CB 3.36Å
1050	I	89.7	Confident	68.7	Low	3 Å²	3	51.8 Å²	51.8	2%	0.015	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	107.2	-177.6	-60.3	168.8	0	0	0	108.7	H937 A955 A1011 L1013 L1029 L1048 L1053 F1066 A1067	H937-I1050 WeakPolarHBondContact CB-O 3.46Å; A955-I1050 HydrophobicContact CB-CB 3.89Å; A955-I1050 HydrophobicContact CB-CG2 3.8Å; A955-I1050 WeakPolarHBondContact CB-O 3.43Å; A1011-I1050 HydrophobicContact CB-CD1 4.27Å; A1011-I1050 HydrophobicContact CB-CG1 4.22Å; L1013-I1050 HydrophobicContact CD2-CD1 3.65Å; L1013-I1050 HydrophobicContact CD2-CG2 4.48Å; L1013-I1050 HydrophobicContact CG-CD1 3.94Å; L1029-I1050 HydrophobicContact CD1-CD1 3.85Å; L1048-I1050 PolarHBondContact O-N 3.45Å; I1050-L1053 HydrophobicContact CG2-CD2 3.86Å; I1050-L1053 HydrophobicContact CG2-CG 4.36Å; I1050-F1066 HydrophobicContact CD1-CD2 4.19Å; I1050-F1066 HydrophobicContact CD1-CE2 4.44Å; I1050-F1066 HydrophobicContact CG1-CD2 3.98Å; I1050-F1066 HydrophobicContact CG1-CE2 4.37Å; I1050-F1066 HydrophobicContact CG2-CB 3.85Å; I1050-F1066 HydrophobicContact CG2-CD2 4.18Å; I1050-F1066 HydrophobicContact CG2-CG 4.41Å; I1050-A1067 CarbonylContact C-O 3.59Å
1051	C	87.4	Confident	68.8	Low	30 Å²	30	47.1 Å²	47.1	20%	0.203	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	-13.5	-172.3	66	0	0	0	0	114.1	T1049 A1067	T1049-C1051 PolarHBondContact O-N 3.28Å; C1051-A1067 PolarHBondContact N-O 3.39Å; C1051-A1067 PolarHBondContact SG-O 3.27Å
1052	R	89	Confident	69.4	Low	88 Å²	88	46.1 Å²	46.1	33%	0.332	26%	0.258	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	146.3	173.3	-62.2	-64.4	177.8	110.2	11.9	111.1	F1066 A1067 C1110 N1111 L1112	R1052-F1066 VanDerWaalsContact O-CA 3.29Å; R1052-F1066 WeakPolarHBondContact O-CA 3.43Å; R1052-A1067 HydrophobicContact CB-CB 4.25Å; R1052-A1067 PolarHBondContact N-O 2.97Å; R1052-A1067 PolarHBondContact O-N 3.48Å; R1052-C1110 WeakPolarHBondContact CG-O 3.49Å; R1052-C1110 PolarHBondContact NE-O 3.49Å; R1052-N1111 VanDerWaalsContact CZ-OD1 3.26Å; R1052-N1111 PolarHBondContact NH1-OD1 2.95Å; R1052-N1111 PolarHBondContact NH2-OD1 3.37Å; R1052-L1112 HydrophobicContact CB-CD1 4.06Å; R1052-L1112 HydrophobicContact CB-CG 4.26Å
1053	L	90.4	Very high	70.5	Confident	21 Å²	21	46.5 Å²	46.5	11%	0.11	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	143.9	173.3	-70.7	177.9	0	0	0	109.7	A938 C940 W953 A955 L1013 I1050 I1064 W1065 F1066	A938-L1053 HydrophobicContact CB-CB 4.42Å; A938-L1053 HydrophobicContact CB-CD1 4.29Å; A938-L1053 HydrophobicContact CB-CG 4.06Å; C940-L1053 HydrophobicContact CB-CB 3.61Å; C940-L1053 HydrophobicContact CB-CD1 4.27Å; W953-L1053 HydrophobicContact CB-CD1 4.32Å; A955-L1053 HydrophobicContact CB-CD1 3.93Å; A955-L1053 HydrophobicContact CB-CG 4.18Å; L1013-L1053 HydrophobicContact CD2-CD1 4.33Å; L1013-L1053 HydrophobicContact CD2-CD2 3.83Å; I1050-L1053 HydrophobicContact CG2-CD2 3.86Å; I1050-L1053 HydrophobicContact CG2-CG 4.36Å; L1053-I1064 HydrophobicContact CD2-CG2 4.04Å; L1053-W1065 CarbonylContact C-O 3.57Å; L1053-F1066 HydrophobicContact CD2-CB 3.85Å
1054	L	86.5	Confident	72.2	Confident	21 Å²	21	40.8 Å²	40.8	11%	0.11	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	132.1	172.7	177.5	62.8	0	0	0	109.7	W1065 L1112 L1114 I1132	L1054-W1065 HydrophobicContact CB-CB 4.19Å; L1054-W1065 PolarHBondContact N-O 3.11Å; L1054-W1065 PolarHBondContact O-N 3.17Å; L1054-L1112 HydrophobicContact CB-CB 4.38Å; L1054-L1112 HydrophobicContact CB-CD1 4.44Å; L1054-L1112 HydrophobicContact CD2-CB 4.38Å; L1054-L1114 HydrophobicContact CD1-CB 3.99Å; L1054-L1114 HydrophobicContact CD2-CB 4.19Å; L1054-I1132 HydrophobicContact CD2-CD1 4Å; L1054-I1132 HydrophobicContact CD2-CG1 4.01Å; L1054-I1132 HydrophobicContact CD2-CG2 4.26Å
1055	I	80.9	Confident	73.7	Confident	8 Å²	8	36.6 Å²	36.6	4%	0.041	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	131.3	175.1	-61.7	177.6	0	0	0	107.8	C940 K942 W953 I1064	C940-I1055 HydrophobicContact CB-CD1 4.4Å; K942-I1055 HydrophobicContact CB-CD1 3.89Å; K942-I1055 HydrophobicContact CB-CG2 4.47Å; K942-I1055 HydrophobicContact CG-CG2 4.24Å; W953-I1055 HydrophobicContact CB-CD1 4.42Å; W953-I1055 VanDerWaalsContact CD1-CD1 3.49Å; W953-I1055 HydrophobicContact CG-CD1 4.08Å; I1055-I1064 HydrophobicContact CD1-CD1 4.38Å; I1055-I1064 HydrophobicContact CD1-CG1 4.43Å; I1055-I1064 HydrophobicContact CG1-CG1 4.21Å; I1055-I1064 HydrophobicContact CG1-CG2 4.47Å
1056	I	73.2	Confident	75.6	Confident	6 Å²	6	33.4 Å²	33.4	3%	0.031	18%	0.18	C	C	.	.			trans	-89.9	124.8	177.8	-53.2	150.8	0	0	0	107.4	L1058 T1059 I1132 L1188	I1056-L1058 PolarHBondContact O-N 3.29Å; I1056-T1059 HydrophobicContact CB-CG2 4.27Å; I1056-T1059 HydrophobicContact CD1-CG2 3.82Å; I1056-T1059 HydrophobicContact CG2-CG2 4.14Å; I1056-T1059 PolarHBondContact O-OG1 3Å; I1056-I1132 HydrophobicContact CD1-CD1 4.01Å; I1056-I1132 HydrophobicContact CG1-CD1 4.06Å; I1056-L1188 HydrophobicContact CD1-CD1 3.44Å; I1056-L1188 VanDerWaalsContact CD1-CD1 3.44Å; I1056-L1188 HydrophobicContact CD1-CD2 3.97Å; I1056-L1188 HydrophobicContact CD1-CG 4.36Å; I1056-L1188 HydrophobicContact CG1-CD1 3.82Å; I1056-L1188 HydrophobicContact CG2-CD1 4.1Å
1057	P	63.6	Low	76.8	Confident	45 Å²	45	29.4 Å²	29.4	29%	0.292	16%	0.16	S	C	.	.	S	Bend	trans	-74.1	-4.3	-174.4	28.9	-35.4	0	0	0	114.9	P943	P943-P1057 HydrophobicContact CG-CB 4.34Å
1058	L	56.4	Low	77.5	Confident	71 Å²	71	27.8 Å²	27.8	37%	0.372	15%	0.151	S	C	.	.	S	Bend	trans	-127.9	-9.2	-170.5	-84.6	142.1	0	0	0	115.5	I1056 L1128 Y1130	I1056-L1058 PolarHBondContact O-N 3.29Å; L1058-L1128 HydrophobicContact CD1-CD1 3.95Å; L1058-L1128 HydrophobicContact CD2-CD1 4Å; L1058-Y1130 HydrophobicContact CB-CE2 4.28Å; L1058-Y1130 HydrophobicContact CD1-CE2 3.51Å; L1058-Y1130 WeakPolarHBondContact CD1-OH 3.24Å
1059	T	54.8	Low	77.6	Confident	30 Å²	30	33.9 Å²	33.9	18%	0.184	17%	0.174	C	C	.	.	S	Bend	trans	-72.2	129.3	161.6	48.6	0	0	0	0	108.2	I1056 D1061 L1188	I1056-T1059 HydrophobicContact CB-CG2 4.27Å; I1056-T1059 HydrophobicContact CD1-CG2 3.82Å; I1056-T1059 HydrophobicContact CG2-CG2 4.14Å; I1056-T1059 PolarHBondContact O-OG1 3Å; T1059-D1061 PolarHBondContact O-N 2.75Å; T1059-L1188 HydrophobicContact CG2-CD2 4.49Å
1060	S	53.9	Low	77	Confident	96 Å²	96	34 Å²	34	67%	0.671	18%	0.175	S	C	*	.			trans	-41.8	112.4	177	47.6	0	0	0	0	110.8	H1062	S1060-H1062 VanDerWaalsContact C-CD2 3.48Å; S1060-H1062 WeakPolarHBondContact O-CA 3.36Å; S1060-H1062 WeakPolarHBondContact O-CB 3.37Å; S1060-H1062 PolarHBondContact O-CD2 3.03Å; S1060-H1062 PolarHBondContact O-N 3.08Å
1061	D	56.9	Low	76.4	Confident	60 Å²	60	33.9 Å²	33.9	32%	0.321	17%	0.174	S	C	.	.	S	Bend	trans	8.9	0.8	-175.1	-85	-51.6	0	0	0	123.9	K942 T945 T1059 Y1080	K942-D1061 WeakPolarHBondContact CE-OD1 3.44Å; K942-D1061 PolarHBondContact NZ-O 3.1Å; K942-D1061 IonicContact NZ-OD1 2.61Å; K942-D1061 PolarHBondContact NZ-OD1 3.4Å; T945-D1061 PolarHBondContact OG1-OD1 3.03Å; T1059-D1061 PolarHBondContact O-N 2.75Å; D1061-Y1080 WeakPolarHBondContact O-CE2 3.43Å
1062	H	63.9	Low	76	Confident	69 Å²	69	32.6 Å²	32.6	32%	0.319	17%	0.165	S	C	.	.			trans	-128.4	0.8	-143.6	-63	-72.3	0	0	0	114.5	S1060 R1077 L1078 Y1080	S1060-H1062 VanDerWaalsContact C-CD2 3.48Å; S1060-H1062 WeakPolarHBondContact O-CA 3.36Å; S1060-H1062 WeakPolarHBondContact O-CB 3.37Å; S1060-H1062 PolarHBondContact O-CD2 3.03Å; S1060-H1062 PolarHBondContact O-N 3.08Å; H1062-R1077 CarbonylContact O-C 3.57Å; H1062-R1077 WeakPolarHBondContact O-CA 3.21Å; H1062-L1078 VanDerWaalsContact CB-O 3.31Å; H1062-L1078 WeakPolarHBondContact CB-O 3.49Å; H1062-L1078 PolarHBondContact ND1-O 3.15Å; H1062-L1078 PolarHBondContact O-N 3.41Å; H1062-Y1080 AromaticContact ND1-CD2 3.56Å
1063	E	76.9	Confident	75.7	Confident	22 Å²	22	28.4 Å²	28.4	10%	0.103	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	125.5	-174.7	-56.6	-158.3	142.1	0	0	112.6	R1075 R1077	E1063-R1075 HydrophobicContact CB-CG 4.38Å; E1063-R1075 VanDerWaalsContact CD-NH1 3.26Å; E1063-R1075 IonicContact OE1-CZ 2.77Å; E1063-R1075 VanDerWaalsContact OE1-CZ 3.26Å; E1063-R1075 IonicContact OE1-NE 2.69Å; E1063-R1075 PolarHBondContact OE1-NE 3.27Å; E1063-R1075 IonicContact OE1-NH1 2.77Å; E1063-R1075 PolarHBondContact OE1-NH1 3.38Å; E1063-R1075 VanDerWaalsContact OE2-CD 3.28Å; E1063-R1075 WeakPolarHBondContact OE2-CD 3.47Å; E1063-R1075 IonicContact OE2-CZ 3.65Å; E1063-R1075 IonicContact OE2-NE 3.53Å; E1063-R1075 IonicContact OE2-NH1 2.75Å; E1063-R1075 PolarHBondContact OE2-NH1 3.2Å; E1063-R1077 HydrophobicContact CG-CG 4.27Å; E1063-R1077 IonicContact OE1-CZ 2.59Å; E1063-R1077 VanDerWaalsContact OE1-CZ 3.27Å; E1063-R1077 IonicContact OE1-NE 3.41Å; E1063-R1077 PolarHBondContact OE1-NE 3.19Å; E1063-R1077 IonicContact OE1-NH2 3.62Å; E1063-R1077 PolarHBondContact OE1-NH2 3.45Å
1064	I	86.3	Confident	75.3	Confident	4 Å²	4	27.6 Å²	27.6	2%	0.021	15%	0.146	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	128.3	170.5	-58.8	-171.2	0	0	0	108.7	W953 L1053 I1055 R1075 L1076 L1078	W953-I1064 HydrophobicContact CD2-CD1 3.44Å; W953-I1064 VanDerWaalsContact CD2-CD1 3.44Å; W953-I1064 HydrophobicContact CE3-CD1 3.68Å; W953-I1064 HydrophobicContact CG-CD1 3.94Å; W953-I1064 HydrophobicContact CH2-CD1 3.97Å; W953-I1064 HydrophobicContact CZ2-CD1 3.78Å; W953-I1064 HydrophobicContact CZ3-CD1 3.94Å; L1053-I1064 HydrophobicContact CD2-CG2 4.04Å; I1055-I1064 HydrophobicContact CD1-CD1 4.38Å; I1055-I1064 HydrophobicContact CD1-CG1 4.43Å; I1055-I1064 HydrophobicContact CG1-CG1 4.21Å; I1055-I1064 HydrophobicContact CG1-CG2 4.47Å; I1064-R1075 CarbonylContact O-C 3.4Å; I1064-R1075 WeakPolarHBondContact O-CA 3.43Å; I1064-L1076 PolarHBondContact N-O 3.28Å; I1064-L1076 PolarHBondContact O-N 3.16Å; I1064-L1078 HydrophobicContact CD1-CD1 3.56Å; I1064-L1078 HydrophobicContact CG1-CD1 3.8Å
1065	W	88.1	Confident	75.1	Confident	2 Å²	2	27.4 Å²	27.4	1%	0.008	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	139.1	169.1	-76.6	66.4	0	0	0	109.9	P584 L1053 L1054 I1073 I1132 W1186	P584-W1065 HydrophobicContact CB-CH2 3.53Å; P584-W1065 HydrophobicContact CB-CZ2 3.65Å; P584-W1065 HydrophobicContact CG-CH2 3.87Å; P584-W1065 HydrophobicContact CG-CZ2 4.04Å; L1053-W1065 CarbonylContact C-O 3.57Å; L1054-W1065 HydrophobicContact CB-CB 4.19Å; L1054-W1065 PolarHBondContact N-O 3.11Å; L1054-W1065 PolarHBondContact O-N 3.17Å; W1065-I1073 HydrophobicContact CE3-CG2 4.22Å; W1065-I1073 HydrophobicContact CZ3-CG2 4.29Å; W1065-I1132 HydrophobicContact CD2-CD1 3.57Å; W1065-I1132 HydrophobicContact CE3-CD1 3.97Å; W1065-I1132 HydrophobicContact CE3-CG2 4.33Å; W1065-I1132 HydrophobicContact CG-CD1 3.9Å; W1065-I1132 HydrophobicContact CH2-CD1 4.22Å; W1065-I1132 HydrophobicContact CZ2-CD1 3.89Å; W1065-I1132 HydrophobicContact CZ3-CD1 4.27Å; W1065-I1132 HydrophobicContact CZ3-CG2 4.3Å; W1065-W1186 HydrophobicContact CH2-CB 4.14Å; W1065-W1186 AromaticContact CH2-CD1 3.82Å; W1065-W1186 AromaticContact CH2-CD2 3.8Å; W1065-W1186 HydrophobicContact CH2-CD2 3.8Å; W1065-W1186 HydrophobicContact CH2-CE3 4.4Å; W1065-W1186 AromaticContact CH2-CG 3.65Å; W1065-W1186 HydrophobicContact CH2-CG 3.65Å; W1065-W1186 AromaticContact CZ3-CD2 3.8Å; W1065-W1186 HydrophobicContact CZ3-CD2 3.8Å; W1065-W1186 AromaticContact CZ3-CE2 3.96Å; W1065-W1186 HydrophobicContact CZ3-CE3 4.05Å; W1065-W1186 HydrophobicContact CZ3-CG 4.18Å; W1065-W1186 HydrophobicContact CZ3-CZ2 4.38Å; W1065-W1186 HydrophobicContact CZ3-CZ3 4.46Å
1066	F	90.4	Very high	75.3	Confident	1 Å²	1	27.1 Å²	27.1	0%	0.004	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.2	155.2	-179.7	69.6	-86.1	0	0	0	111.9	L1029 L1033 I1050 R1052 L1053 T1068 A1074 L1076 I1098	L1029-F1066 HydrophobicContact CD1-CE1 4.01Å; L1029-F1066 HydrophobicContact CD1-CE2 4.12Å; L1029-F1066 HydrophobicContact CD1-CZ 3.68Å; L1033-F1066 HydrophobicContact CD1-CE2 4.34Å; L1033-F1066 HydrophobicContact CD2-CE2 4.38Å; L1033-F1066 HydrophobicContact CD2-CZ 4.33Å; I1050-F1066 HydrophobicContact CD1-CD2 4.19Å; I1050-F1066 HydrophobicContact CD1-CE2 4.44Å; I1050-F1066 HydrophobicContact CG1-CD2 3.98Å; I1050-F1066 HydrophobicContact CG1-CE2 4.37Å; I1050-F1066 HydrophobicContact CG2-CB 3.85Å; I1050-F1066 HydrophobicContact CG2-CD2 4.18Å; I1050-F1066 HydrophobicContact CG2-CG 4.41Å; R1052-F1066 VanDerWaalsContact O-CA 3.29Å; R1052-F1066 WeakPolarHBondContact O-CA 3.43Å; L1053-F1066 HydrophobicContact CD2-CB 3.85Å; F1066-T1068 HydrophobicContact CD2-CG2 4.26Å; F1066-T1068 HydrophobicContact CE2-CG2 4.13Å; F1066-A1074 HydrophobicContact CD1-CB 4.23Å; F1066-A1074 WeakPolarHBondContact CD1-O 3.36Å; F1066-A1074 HydrophobicContact CD2-CB 4.46Å; F1066-A1074 HydrophobicContact CE1-CB 3.64Å; F1066-A1074 HydrophobicContact CE2-CB 3.91Å; F1066-A1074 HydrophobicContact CZ-CB 3.48Å; F1066-A1074 VanDerWaalsContact CZ-CB 3.48Å; F1066-A1074 PolarHBondContact N-O 2.88Å; F1066-A1074 PolarHBondContact O-N 3.01Å; F1066-L1076 HydrophobicContact CD1-CB 4.33Å; F1066-L1076 HydrophobicContact CE1-CB 3.98Å; F1066-I1098 HydrophobicContact CE1-CG2 4.44Å; F1066-I1098 HydrophobicContact CZ-CG2 4.16Å
1067	A	88.5	Confident	75.5	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	145.7	169.7	0	0	0	0	0	110.3	I1050 C1051 R1052 L1072 L1112	I1050-A1067 CarbonylContact C-O 3.59Å; C1051-A1067 PolarHBondContact N-O 3.39Å; C1051-A1067 PolarHBondContact SG-O 3.27Å; R1052-A1067 HydrophobicContact CB-CB 4.25Å; R1052-A1067 PolarHBondContact N-O 2.97Å; R1052-A1067 PolarHBondContact O-N 3.48Å; A1067-L1072 VanDerWaalsContact CA-O 3.29Å; A1067-L1072 WeakPolarHBondContact CA-O 3.33Å; A1067-L1112 HydrophobicContact CB-CD1 4.02Å; A1067-L1112 HydrophobicContact CB-CG 4.26Å
1068	T	86.8	Confident	76.1	Confident	1 Å²	1	28.7 Å²	28.7	1%	0.006	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	161.6	179.7	62.9	0	0	0	0	112	L1033 T1049 F1066 S1070 G1071 L1072	L1033-T1068 HydrophobicContact CD1-CG2 4.39Å; T1049-T1068 CarbonylContact O-C 3.55Å; T1049-T1068 WeakPolarHBondContact O-CA 3.36Å; F1066-T1068 HydrophobicContact CD2-CG2 4.26Å; F1066-T1068 HydrophobicContact CE2-CG2 4.13Å; T1068-S1070 PolarHBondContact O-N 3.16Å; T1068-S1070 PolarHBondContact OG1-OG 3.19Å; T1068-G1071 WeakPolarHBondContact O-CA 3.31Å; T1068-G1071 PolarHBondContact O-N 3.41Å; T1068-L1072 PolarHBondContact N-O 3.2Å; T1068-L1072 WeakPolarHBondContact OG1-CB 3.49Å; T1068-L1072 PolarHBondContact OG1-N 2.94Å; T1068-L1072 PolarHBondContact OG1-O 3.42Å
1069	R	81.2	Confident	76.5	Confident	131 Å²	131	28 Å²	28	49%	0.494	14%	0.139	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-14.6	173.3	-168.7	173.2	174.3	111.1	2.9	113.6	D1047 T1049 G1071 P1108	D1047-R1069 CarbonylContact O-C 3.57Å; D1047-R1069 VanDerWaalsContact O-C 3.32Å; D1047-R1069 PolarHBondContact O-N 2.93Å; T1049-R1069 PolarHBondContact O-N 3.46Å; T1049-R1069 WeakPolarHBondContact OG1-CB 3.36Å; R1069-G1071 PolarHBondContact O-N 2.99Å; R1069-P1108 HydrophobicContact CG-CB 4.38Å; R1069-P1108 HydrophobicContact CG-CG 3.89Å; R1069-P1108 WeakPolarHBondContact O-CB 3.49Å; R1069-P1108 WeakPolarHBondContact O-CG 3.45Å
1070	S	73.6	Confident	77	Confident	5 Å²	5	28.4 Å²	28.4	4%	0.035	14%	0.137	C	C	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-2.2	168.1	80.9	0	0	0	0	113	D1047 T1068 L1072 Y1105 R1173	D1047-S1070 WeakPolarHBondContact O-CB 3.13Å; D1047-S1070 PolarHBondContact O-N 3.44Å; T1068-S1070 PolarHBondContact O-N 3.16Å; T1068-S1070 PolarHBondContact OG1-OG 3.19Å; S1070-L1072 VanDerWaalsContact OG-CD1 3.23Å; S1070-L1072 WeakPolarHBondContact OG-CD1 3.33Å; S1070-L1072 VanDerWaalsContact OG-CG 3.23Å; S1070-L1072 WeakPolarHBondContact OG-CG 3.49Å; S1070-Y1105 VanDerWaalsContact O-O 3.09Å; S1070-R1173 VanDerWaalsContact CB-NH2 3.32Å; S1070-R1173 PolarHBondContact O-NH1 3.3Å; S1070-R1173 PolarHBondContact O-NH2 3.42Å; S1070-R1173 PolarHBondContact OG-NH2 3Å
1071	G	75.1	Confident	77.2	Confident	0 Å²	0	28.7 Å²	28.7	0%	0	14%	0.14	C	C	.	.			trans	79.5	6.4	-178.5	0	0	0	0	0	115.7	T1068 R1069 G1104 Y1105	T1068-G1071 WeakPolarHBondContact O-CA 3.31Å; T1068-G1071 PolarHBondContact O-N 3.41Å; R1069-G1071 PolarHBondContact O-N 2.99Å; G1071-G1104 WeakPolarHBondContact O-CA 3.1Å; G1071-Y1105 WeakPolarHBondContact CA-O 3.19Å; G1071-Y1105 PolarHBondContact O-N 3.09Å
1072	L	79.2	Confident	77	Confident	4 Å²	4	33.3 Å²	33.3	2%	0.021	16%	0.157	C	C	.	.			trans	-70.8	142.2	172.7	-57.7	162.5	0	0	0	111	L1037 A1067 T1068 S1070 I1100 L1142	L1037-L1072 HydrophobicContact CD1-CD1 3.4Å; L1037-L1072 VanDerWaalsContact CD1-CD1 3.4Å; L1037-L1072 HydrophobicContact CD2-CD1 3.51Å; L1037-L1072 HydrophobicContact CD2-CD2 3.97Å; L1037-L1072 HydrophobicContact CD2-CG 4.39Å; L1037-L1072 HydrophobicContact CG-CD1 4.07Å; A1067-L1072 VanDerWaalsContact CA-O 3.29Å; A1067-L1072 WeakPolarHBondContact CA-O 3.33Å; T1068-L1072 PolarHBondContact N-O 3.2Å; T1068-L1072 WeakPolarHBondContact OG1-CB 3.49Å; T1068-L1072 PolarHBondContact OG1-N 2.94Å; T1068-L1072 PolarHBondContact OG1-O 3.42Å; S1070-L1072 VanDerWaalsContact OG-CD1 3.23Å; S1070-L1072 WeakPolarHBondContact OG-CD1 3.33Å; S1070-L1072 VanDerWaalsContact OG-CG 3.23Å; S1070-L1072 WeakPolarHBondContact OG-CG 3.49Å; L1072-I1100 HydrophobicContact CD2-CG2 4.4Å; L1072-L1142 HydrophobicContact CD2-CD1 3.55Å; L1072-L1142 HydrophobicContact CD2-CD2 3.94Å; L1072-L1142 HydrophobicContact CD2-CG 4.42Å
1073	I	82.8	Confident	76.6	Confident	0 Å²	0	33.4 Å²	33.4	0%	0	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.9	130.8	173.5	-57.4	168.5	0	0	0	107.8	W1065 S1101 Y1105 L1112 S1134 I1184 W1186	W1065-I1073 HydrophobicContact CE3-CG2 4.22Å; W1065-I1073 HydrophobicContact CZ3-CG2 4.29Å; I1073-S1101 VanDerWaalsContact O-CB 3.29Å; I1073-S1101 WeakPolarHBondContact O-CB 3.44Å; I1073-S1101 PolarHBondContact O-N 3.29Å; I1073-Y1105 HydrophobicContact CD1-CD2 4.28Å; I1073-Y1105 HydrophobicContact CD1-CE2 3.84Å; I1073-L1112 HydrophobicContact CG2-CD2 4.34Å; I1073-S1134 VanDerWaalsContact CD1-OG 3.25Å; I1073-S1134 WeakPolarHBondContact CD1-OG 3.47Å; I1073-I1184 HydrophobicContact CD1-CD1 4.13Å; I1073-W1186 HydrophobicContact CD1-CH2 3.7Å; I1073-W1186 HydrophobicContact CD1-CZ3 4.48Å; I1073-W1186 HydrophobicContact CG2-CH2 4.12Å; I1073-W1186 HydrophobicContact CG2-CZ2 4.44Å
1074	A	82.1	Confident	75.1	Confident	4 Å²	4	40.8 Å²	40.8	3%	0.033	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.9	161	-175.7	0	0	0	0	0	112.8	F1066 I1098 T1099 I1100	F1066-A1074 HydrophobicContact CD1-CB 4.23Å; F1066-A1074 WeakPolarHBondContact CD1-O 3.36Å; F1066-A1074 HydrophobicContact CD2-CB 4.46Å; F1066-A1074 HydrophobicContact CE1-CB 3.64Å; F1066-A1074 HydrophobicContact CE2-CB 3.91Å; F1066-A1074 HydrophobicContact CZ-CB 3.48Å; F1066-A1074 VanDerWaalsContact CZ-CB 3.48Å; F1066-A1074 PolarHBondContact N-O 2.88Å; F1066-A1074 PolarHBondContact O-N 3.01Å; A1074-I1098 HydrophobicContact CB-CG2 4.13Å; A1074-T1099 CarbonylContact C-O 3.58Å; A1074-T1099 VanDerWaalsContact CA-O 3.32Å; A1074-T1099 WeakPolarHBondContact CA-O 3.27Å; A1074-I1100 HydrophobicContact CB-CG1 4.17Å
1075	R	83.9	Confident	73.3	Confident	16 Å²	16	48.3 Å²	48.3	6%	0.06	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	123.2	175.4	-180	172	71.1	173.4	-9.1	109.5	N582 E1063 I1064 I1098 T1099	N582-R1075 PolarHBondContact O-NH2 3.5Å; E1063-R1075 HydrophobicContact CB-CG 4.38Å; E1063-R1075 VanDerWaalsContact CD-NH1 3.26Å; E1063-R1075 IonicContact OE1-CZ 2.77Å; E1063-R1075 VanDerWaalsContact OE1-CZ 3.26Å; E1063-R1075 IonicContact OE1-NE 2.69Å; E1063-R1075 PolarHBondContact OE1-NE 3.27Å; E1063-R1075 IonicContact OE1-NH1 2.77Å; E1063-R1075 PolarHBondContact OE1-NH1 3.38Å; E1063-R1075 VanDerWaalsContact OE2-CD 3.28Å; E1063-R1075 WeakPolarHBondContact OE2-CD 3.47Å; E1063-R1075 IonicContact OE2-CZ 3.65Å; E1063-R1075 IonicContact OE2-NE 3.53Å; E1063-R1075 IonicContact OE2-NH1 2.75Å; E1063-R1075 PolarHBondContact OE2-NH1 3.2Å; I1064-R1075 CarbonylContact O-C 3.4Å; I1064-R1075 WeakPolarHBondContact O-CA 3.43Å; R1075-I1098 CarbonylContact O-C 3.54Å; R1075-I1098 WeakPolarHBondContact O-CA 3.46Å; R1075-T1099 PolarHBondContact N-O 2.98Å; R1075-T1099 PolarHBondContact O-N 3.13Å
1076	L	84.8	Confident	71.1	Confident	2 Å²	2	52.3 Å²	52.3	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	129.5	168.8	177.6	63.7	0	0	0	109.1	L1013 I1027 L1029 I1064 F1066 L1078 I1098	L1013-L1076 HydrophobicContact CD1-CD2 3.62Å; I1027-L1076 HydrophobicContact CD1-CD2 4.06Å; L1029-L1076 HydrophobicContact CD1-CD2 4.35Å; L1029-L1076 HydrophobicContact CD2-CD1 4.12Å; L1029-L1076 HydrophobicContact CD2-CD2 4.1Å; I1064-L1076 PolarHBondContact N-O 3.28Å; I1064-L1076 PolarHBondContact O-N 3.16Å; F1066-L1076 HydrophobicContact CD1-CB 4.33Å; F1066-L1076 HydrophobicContact CE1-CB 3.98Å; L1076-L1078 HydrophobicContact CD2-CD2 3.69Å; L1076-L1078 HydrophobicContact CD2-CG 4.42Å; L1076-L1078 HydrophobicContact CG-CD2 3.87Å; L1076-L1078 HydrophobicContact CG-CG 4.33Å; L1076-I1098 HydrophobicContact CD1-CG1 4.12Å
1077	R	76.8	Confident	69.2	Low	81 Å²	81	56.2 Å²	56.2	31%	0.306	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	124.6	172.1	-76.5	176.3	160.4	-168.6	-12.2	110.8	N582 H1062 E1063 S1097	N582-R1077 PolarHBondContact OD1-NH1 3.06Å; H1062-R1077 CarbonylContact O-C 3.57Å; H1062-R1077 WeakPolarHBondContact O-CA 3.21Å; E1063-R1077 HydrophobicContact CG-CG 4.27Å; E1063-R1077 IonicContact OE1-CZ 2.59Å; E1063-R1077 VanDerWaalsContact OE1-CZ 3.27Å; E1063-R1077 IonicContact OE1-NE 3.41Å; E1063-R1077 PolarHBondContact OE1-NE 3.19Å; E1063-R1077 IonicContact OE1-NH2 3.62Å; E1063-R1077 PolarHBondContact OE1-NH2 3.45Å; R1077-S1097 PolarHBondContact N-O 2.89Å
1078	L	75.2	Confident	67.5	Low	4 Å²	4	63.6 Å²	63.6	2%	0.021	31%	0.311	C	S	.	.			trans	-110.5	110.3	-174.8	-64	179.8	0	0	0	110.3	W953 I1027 H1062 I1064 L1076 Y1080	W953-L1078 HydrophobicContact CH2-CD1 3.43Å; W953-L1078 VanDerWaalsContact CH2-CD1 3.43Å; W953-L1078 HydrophobicContact CH2-CD2 4.28Å; W953-L1078 HydrophobicContact CZ2-CD1 3.4Å; W953-L1078 VanDerWaalsContact CZ2-CD1 3.4Å; W953-L1078 HydrophobicContact CZ3-CD1 4.39Å; I1027-L1078 HydrophobicContact CD1-CD2 3.42Å; I1027-L1078 VanDerWaalsContact CD1-CD2 3.42Å; H1062-L1078 VanDerWaalsContact CB-O 3.31Å; H1062-L1078 WeakPolarHBondContact CB-O 3.49Å; H1062-L1078 PolarHBondContact ND1-O 3.15Å; H1062-L1078 PolarHBondContact O-N 3.41Å; I1064-L1078 HydrophobicContact CD1-CD1 3.56Å; I1064-L1078 HydrophobicContact CG1-CD1 3.8Å; L1076-L1078 HydrophobicContact CD2-CD2 3.69Å; L1076-L1078 HydrophobicContact CD2-CG 4.42Å; L1076-L1078 HydrophobicContact CG-CD2 3.87Å; L1076-L1078 HydrophobicContact CG-CG 4.33Å; L1078-Y1080 HydrophobicContact CB-CD2 3.9Å; L1078-Y1080 HydrophobicContact CB-CE2 3.62Å; L1078-Y1080 HydrophobicContact CD1-CE2 3.85Å; L1078-Y1080 HydrophobicContact CG-CE2 4.43Å; L1078-Y1080 WeakPolarHBondContact O-CD2 3.2Å; L1078-Y1080 PolarHBondContact O-N 3.46Å
1079	D	66.5	Low	66.2	Low	56 Å²	56	70.7 Å²	70.7	30%	0.299	34%	0.344	S	S	.	.			trans	-67.4	119.7	162.1	-176.8	2	0	0	0	109	R1025 S1081 K1082	R1025-D1079 PolarHBondContact NH1-O 3.41Å; R1025-D1079 PolarHBondContact NH2-O 3.33Å; D1079-S1081 VanDerWaalsContact OD1-CB 3.29Å; D1079-S1081 WeakPolarHBondContact OD1-CB 3.42Å; D1079-S1081 PolarHBondContact OD1-N 2.95Å; D1079-S1081 PolarHBondContact OD1-OG 3.32Å; D1079-S1081 PolarHBondContact OD2-OG 3.1Å; D1079-K1082 WeakPolarHBondContact OD2-CD 3.2Å; D1079-K1082 VanDerWaalsContact OD2-CE 3.26Å; D1079-K1082 WeakPolarHBondContact OD2-CE 3.31Å; D1079-K1082 IonicContact OD2-NZ 2.6Å; D1079-K1082 PolarHBondContact OD2-NZ 2.78Å
1080	Y	65.3	Low	65.5	Low	38 Å²	38	67.1 Å²	67.1	15%	0.149	34%	0.337	C	S	.	.			trans	-99.5	-8.9	173.8	-82	-107.6	0	0	0	112.3	I951 D1061 H1062 L1078 K1082 Y1083	I951-Y1080 HydrophobicContact CD1-CE1 4.18Å; D1061-Y1080 WeakPolarHBondContact O-CE2 3.43Å; H1062-Y1080 AromaticContact ND1-CD2 3.56Å; L1078-Y1080 HydrophobicContact CB-CD2 3.9Å; L1078-Y1080 HydrophobicContact CB-CE2 3.62Å; L1078-Y1080 HydrophobicContact CD1-CE2 3.85Å; L1078-Y1080 HydrophobicContact CG-CE2 4.43Å; L1078-Y1080 WeakPolarHBondContact O-CD2 3.2Å; L1078-Y1080 PolarHBondContact O-N 3.46Å; Y1080-K1082 PolarHBondContact O-N 3.31Å; Y1080-K1082 VanDerWaalsContact O-N 3.12Å; Y1080-Y1083 AromaticContact CD1-CD2 3.78Å; Y1080-Y1083 HydrophobicContact CD1-CD2 3.78Å; Y1080-Y1083 AromaticContact CD1-CE2 3.19Å; Y1080-Y1083 HydrophobicContact CD1-CE2 3.19Å; Y1080-Y1083 AromaticContact CD1-CZ 3.82Å; Y1080-Y1083 AromaticContact CE1-CE2 3.64Å; Y1080-Y1083 HydrophobicContact CE1-CE2 3.64Å; Y1080-Y1083 AromaticContact CE1-CZ 3.86Å; Y1080-Y1083 HydrophobicContact CG-CD2 4.24Å; Y1080-Y1083 AromaticContact CG-CE2 3.87Å; Y1080-Y1083 HydrophobicContact CG-CE2 3.87Å; Y1080-Y1083 WeakPolarHBondContact O-CD2 3.43Å; Y1080-Y1083 PolarHBondContact O-N 3.3Å
1081	S	57.1	Low	65.5	Low	103 Å²	103	70.6 Å²	70.6	72%	0.72	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-17.9	178.7	71.9	0	0	0	0	113.2	D1079	D1079-S1081 VanDerWaalsContact OD1-CB 3.29Å; D1079-S1081 WeakPolarHBondContact OD1-CB 3.42Å; D1079-S1081 PolarHBondContact OD1-N 2.95Å; D1079-S1081 PolarHBondContact OD1-OG 3.32Å; D1079-S1081 PolarHBondContact OD2-OG 3.1Å
1082	K	52.3	Low	65	Low	157 Å²	157	75.7 Å²	75.7	68%	0.683	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.6	8.3	179.8	-66.7	179.3	178.8	121.7	0	114.7	D1079 Y1080 K1084	D1079-K1082 WeakPolarHBondContact OD2-CD 3.2Å; D1079-K1082 VanDerWaalsContact OD2-CE 3.26Å; D1079-K1082 WeakPolarHBondContact OD2-CE 3.31Å; D1079-K1082 IonicContact OD2-NZ 2.6Å; D1079-K1082 PolarHBondContact OD2-NZ 2.78Å; Y1080-K1082 PolarHBondContact O-N 3.31Å; Y1080-K1082 VanDerWaalsContact O-N 3.12Å; K1082-K1084 PolarHBondContact O-N 2.88Å
1083	Y	54.8	Low	64.5	Low	71 Å²	71	76 Å²	76	28%	0.278	38%	0.382	S	S	.	.			trans	-62.7	98.5	178.2	-99.1	-106.5	0	0	0	112	L1024 Y1080	L1024-Y1083 HydrophobicContact CD1-CE1 4.42Å; Y1080-Y1083 AromaticContact CD1-CD2 3.78Å; Y1080-Y1083 HydrophobicContact CD1-CD2 3.78Å; Y1080-Y1083 AromaticContact CD1-CE2 3.19Å; Y1080-Y1083 HydrophobicContact CD1-CE2 3.19Å; Y1080-Y1083 AromaticContact CD1-CZ 3.82Å; Y1080-Y1083 AromaticContact CE1-CE2 3.64Å; Y1080-Y1083 HydrophobicContact CE1-CE2 3.64Å; Y1080-Y1083 AromaticContact CE1-CZ 3.86Å; Y1080-Y1083 HydrophobicContact CG-CD2 4.24Å; Y1080-Y1083 AromaticContact CG-CE2 3.87Å; Y1080-Y1083 HydrophobicContact CG-CE2 3.87Å; Y1080-Y1083 WeakPolarHBondContact O-CD2 3.43Å; Y1080-Y1083 PolarHBondContact O-N 3.3Å
1084	K	47.3	Very low	63.6	Low	177 Å²	177	83 Å²	83	77%	0.77	41%	0.412	S	S	*	.			trans	-112.5	133.2	155.8	-71.3	-171.6	175.9	-175.4	0	108	K1082 S1086	K1082-K1084 PolarHBondContact O-N 2.88Å; K1084-S1086 PolarHBondContact O-N 2.83Å
1085	Y	48.4	Very low	62.9	Low	161 Å²	161	85 Å²	85	63%	0.631	43%	0.425	S	S	*	.	S	Bend	trans	-73.3	61	-179.7	-74.3	-87.5	0	0	0	112.2	L1024	L1024-Y1085 HydrophobicContact CD2-CD1 4.37Å; L1024-Y1085 HydrophobicContact CD2-CE1 4.04Å
1086	S	40.6	Very low	62	Low	87 Å²	87	87.4 Å²	87.4	61%	0.608	44%	0.444	S	S	*	.			trans	-167.2	101	-179.9	58.3	0	0	0	0	112.8	K1084	K1084-S1086 PolarHBondContact O-N 2.83Å
1087	S	50.5	Low	61.4	Low	82 Å²	82	88.7 Å²	88.7	57%	0.573	45%	0.453	S	S	*	.			trans	168.7	139	140.1	43.2	0	0	0	0	110.7	E1089	S1087-E1089 PolarHBondContact O-N 3.37Å
1088	N	53.3	Low	61.2	Low	155 Å²	155	84.9 Å²	84.9	83%	0.829	44%	0.439	S	S	*	.			trans	-84.7	30.9	166.4	-64.9	-8.2	0	0	0	110.5
1089	E	59.9	Low	61.3	Low	151 Å²	151	85.2 Å²	85.2	71%	0.706	44%	0.441	S	S	*	.			trans	-92.4	138.5	-173.7	-72.9	-179.2	-165.5	0	0	110.9	S1087 E1091	S1087-E1089 PolarHBondContact O-N 3.37Å; E1089-E1091 PolarHBondContact O-N 2.98Å
1090	V	67	Low	61.7	Low	55 Å²	55	82.7 Å²	82.7	33%	0.333	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	109.6	178.2	-176.8	0	0	0	0	109	Q1026 D1028 L1092	Q1026-V1090 HydrophobicContact CG-CG1 4.35Å; Q1026-V1090 HydrophobicContact CG-CG2 4.18Å; D1028-V1090 HydrophobicContact CB-CG1 3.59Å; V1090-L1092 PolarHBondContact O-N 3.12Å
1091	E	72	Confident	62	Low	78 Å²	78	81 Å²	81	36%	0.364	42%	0.421	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	104.3	173.4	-174.2	-179.7	-174.8	0	0	109.6	R1025 Q1026 I1027 D1028 E1089 S1093	R1025-E1091 IonicContact CZ-OE1 3.69Å; R1025-E1091 IonicContact CZ-OE2 2.93Å; R1025-E1091 IonicContact NE-OE2 3.67Å; R1025-E1091 PolarHBondContact NE-OE2 3.47Å; R1025-E1091 VanDerWaalsContact NH2-CD 3.26Å; R1025-E1091 IonicContact NH2-OE1 2.7Å; R1025-E1091 PolarHBondContact NH2-OE1 3.04Å; R1025-E1091 IonicContact NH2-OE2 2.89Å; R1025-E1091 PolarHBondContact NH2-OE2 3.34Å; Q1026-E1091 WeakPolarHBondContact O-CB 3.45Å; Q1026-E1091 PolarHBondContact O-N 3.13Å; I1027-E1091 WeakPolarHBondContact CA-O 3.16Å; I1027-E1091 HydrophobicContact CG1-CB 4.48Å; I1027-E1091 WeakPolarHBondContact CG2-O 3.33Å; D1028-E1091 PolarHBondContact N-O 3.3Å; E1089-E1091 PolarHBondContact O-N 2.98Å; E1091-S1093 PolarHBondContact O-N 3.3Å; E1091-S1093 VanDerWaalsContact O-N 3.15Å
1092	L	65.3	Low	62.4	Low	107 Å²	107	76.2 Å²	76.2	56%	0.56	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-68.6	106.6	164.2	-75.6	146.4	0	0	0	108.3	N1031 V1090	N1031-L1092 HydrophobicContact CB-CD2 4.27Å; N1031-L1092 VanDerWaalsContact ND2-CD2 3.3Å; N1031-L1092 WeakPolarHBondContact ND2-CD2 3.5Å; V1090-L1092 PolarHBondContact O-N 3.12Å
1093	S	67.7	Low	63.3	Low	12 Å²	12	69.3 Å²	69.3	8%	0.084	36%	0.358	C	S	.	.			trans	-57.1	153.8	171.7	61.3	0	0	0	0	110.3	D1028 L1029 S1032 E1091	D1028-S1093 PolarHBondContact O-N 3.35Å; D1028-S1093 PolarHBondContact O-OG 2.72Å; L1029-S1093 VanDerWaalsContact CD2-OG 3.27Å; L1029-S1093 WeakPolarHBondContact CD2-OG 3.45Å; S1032-S1093 WeakPolarHBondContact CB-OG 3.45Å; S1032-S1093 PolarHBondContact OG-O 2.93Å; S1032-S1093 PolarHBondContact OG-OG 2.97Å; E1091-S1093 PolarHBondContact O-N 3.3Å; E1091-S1093 VanDerWaalsContact O-N 3.15Å
1094	K	65.6	Low	64.1	Low	147 Å²	147	66 Å²	66	64%	0.639	35%	0.345	S	S	*	.			trans	-89.2	146.4	166.3	-66.8	-172.3	177.5	-173.8	0	109.1	S1096 S1097	K1094-S1096 PolarHBondContact O-N 2.94Å; K1094-S1096 VanDerWaalsContact O-N 3.09Å; K1094-S1097 PolarHBondContact N-OG 3.13Å; K1094-S1097 PolarHBondContact O-N 3.12Å; K1094-S1097 PolarHBondContact O-OG 3Å
1095	P	67.5	Low	65.5	Low	45 Å²	45	57.6 Å²	57.6	29%	0.292	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-52.4	-32.6	169.7	-29.8	37.4	0	0	0	112.7	S1035 M1036 S1097 I1098	S1035-P1095 WeakPolarHBondContact OG-CG 3.3Å; M1036-P1095 HydrophobicContact CG-CB 3.98Å; M1036-P1095 HydrophobicContact SD-CB 3.96Å; P1095-S1097 VanDerWaalsContact C-N 3.25Å; P1095-S1097 PolarHBondContact O-N 3.1Å; P1095-I1098 PolarHBondContact O-N 2.99Å; P1095-I1098 VanDerWaalsContact O-N 3.15Å; P1095-I1098 VanDerWaalsContact O-O 3.1Å
1096	S	64.6	Low	66.5	Low	66 Å²	66	57.9 Å²	57.9	46%	0.462	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-69	-10.5	175.3	65.2	0	0	0	0	115.8	K1094	K1094-S1096 PolarHBondContact O-N 2.94Å; K1094-S1096 VanDerWaalsContact O-N 3.09Å
1097	S	70.9	Confident	67.7	Low	30 Å²	30	60.4 Å²	60.4	21%	0.21	31%	0.305	C	S	.	.	G	3₁₀ helix	trans	-94.7	-6.6	171.7	49.2	0	0	0	0	113.5	R1077 K1094 P1095	R1077-S1097 PolarHBondContact N-O 2.89Å; K1094-S1097 PolarHBondContact N-OG 3.13Å; K1094-S1097 PolarHBondContact O-N 3.12Å; K1094-S1097 PolarHBondContact O-OG 3Å; P1095-S1097 VanDerWaalsContact C-N 3.25Å; P1095-S1097 PolarHBondContact O-N 3.1Å
1098	I	74.2	Confident	68.1	Low	1 Å²	1	58.9 Å²	58.9	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	135.5	174.9	-53.2	-177.2	0	0	0	108.5	L1029 L1033 M1036 F1066 A1074 R1075 L1076 P1095 I1100	L1029-I1098 HydrophobicContact CB-CD1 4.36Å; L1029-I1098 HydrophobicContact CD2-CD1 4.18Å; L1033-I1098 HydrophobicContact CD2-CD1 4.32Å; L1033-I1098 HydrophobicContact CG-CD1 4.44Å; M1036-I1098 HydrophobicContact SD-CB 4.17Å; M1036-I1098 HydrophobicContact SD-CG2 4.43Å; F1066-I1098 HydrophobicContact CE1-CG2 4.44Å; F1066-I1098 HydrophobicContact CZ-CG2 4.16Å; A1074-I1098 HydrophobicContact CB-CG2 4.13Å; R1075-I1098 CarbonylContact O-C 3.54Å; R1075-I1098 WeakPolarHBondContact O-CA 3.46Å; L1076-I1098 HydrophobicContact CD1-CG1 4.12Å; P1095-I1098 PolarHBondContact O-N 2.99Å; P1095-I1098 VanDerWaalsContact O-N 3.15Å; P1095-I1098 VanDerWaalsContact O-O 3.1Å; I1098-I1100 HydrophobicContact CG2-CG1 4.04Å
1099	T	75.5	Confident	68.6	Low	11 Å²	11	53.6 Å²	53.6	7%	0.067	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	108.4	169.9	-44.7	0	0	0	0	108.6	V583 A1074 R1075	V583-T1099 HydrophobicContact CB-CG2 4.4Å; V583-T1099 HydrophobicContact CG1-CG2 4.18Å; V583-T1099 HydrophobicContact CG2-CG2 4.27Å; A1074-T1099 CarbonylContact C-O 3.58Å; A1074-T1099 VanDerWaalsContact CA-O 3.32Å; A1074-T1099 WeakPolarHBondContact CA-O 3.27Å; R1075-T1099 PolarHBondContact N-O 2.98Å; R1075-T1099 PolarHBondContact O-N 3.13Å
1100	I	74.9	Confident	69.1	Low	2 Å²	2	46.5 Å²	46.5	1%	0.01	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	138.7	177	-52.4	-179.7	0	0	0	108.6	L1033 M1036 L1037 L1072 A1074 I1098 I1171	L1033-I1100 HydrophobicContact CD2-CD1 4.34Å; M1036-I1100 HydrophobicContact CB-CD1 4.01Å; M1036-I1100 HydrophobicContact CE-CD1 3.76Å; M1036-I1100 HydrophobicContact CE-CG1 3.84Å; M1036-I1100 HydrophobicContact SD-CD1 4.05Å; L1037-I1100 HydrophobicContact CD2-CD1 4.39Å; L1072-I1100 HydrophobicContact CD2-CG2 4.4Å; A1074-I1100 HydrophobicContact CB-CG1 4.17Å; I1098-I1100 HydrophobicContact CG2-CG1 4.04Å; I1100-I1171 HydrophobicContact CD1-CD1 4.18Å
1101	S	72.7	Confident	69.7	Low	2 Å²	2	44 Å²	44	1%	0.014	22%	0.218	C	C	.	.			trans	-64.6	142.2	170.2	170.6	0	0	0	0	110.6	I1073 H1103 L1142	I1073-S1101 VanDerWaalsContact O-CB 3.29Å; I1073-S1101 WeakPolarHBondContact O-CB 3.44Å; I1073-S1101 PolarHBondContact O-N 3.29Å; S1101-H1103 VanDerWaalsContact CB-O 3.3Å; S1101-H1103 WeakPolarHBondContact CB-O 3.4Å; S1101-H1103 PolarHBondContact O-N 2.94Å; S1101-H1103 PolarHBondContact OG-N 3.44Å; S1101-H1103 PolarHBondContact OG-O 2.89Å; S1101-L1142 VanDerWaalsContact O-CD1 3.32Å; S1101-L1142 WeakPolarHBondContact O-CD1 3.38Å
1102	C	66.1	Low	70.4	Confident	4 Å²	4	41.1 Å²	41.1	3%	0.027	21%	0.205	C	C	.	.	S	Bend	trans	-66.7	-11.1	166.9	40.8	0	0	0	0	113.3	W533 Y546 L1142	W533-C1102 HydrophobicContact CH2-CB 4.1Å; W533-C1102 HydrophobicContact CZ3-CB 3.83Å; Y546-C1102 PolarHBondContact O-SG 2.92Å; C1102-L1142 WeakPolarHBondContact O-CB 3.36Å; C1102-L1142 PolarHBondContact O-N 3.4Å
1103	H	70.4	Confident	71.3	Confident	11 Å²	11	37.1 Å²	37.1	5%	0.051	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	132.9	178.2	-50.4	-84.7	0	0	0	110.6	P586 S1101 Y1139 I1184	P586-H1103 WeakPolarHBondContact CG-CD2 3.49Å; P586-H1103 WeakPolarHBondContact CG-NE2 3.44Å; S1101-H1103 VanDerWaalsContact CB-O 3.3Å; S1101-H1103 WeakPolarHBondContact CB-O 3.4Å; S1101-H1103 PolarHBondContact O-N 2.94Å; S1101-H1103 PolarHBondContact OG-N 3.44Å; S1101-H1103 PolarHBondContact OG-O 2.89Å; H1103-Y1139 HydrophobicContact CB-CE2 3.92Å; H1103-Y1139 AromaticContact ND1-CE2 3.47Å; H1103-Y1139 WeakPolarHBondContact ND1-CE2 3.45Å; H1103-Y1139 AromaticContact ND1-CZ 3.59Å; H1103-Y1139 PolarHBondContact ND1-OH 2.88Å; H1103-I1184 HydrophobicContact CB-CD1 3.71Å; H1103-I1184 HydrophobicContact CB-CG1 4.43Å; H1103-I1184 HydrophobicContact CB-CG2 4.45Å
1104	G	72.6	Confident	72	Confident	1 Å²	1	38.5 Å²	38.5	1%	0.01	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.6	-166.2	174	0	0	0	0	0	112.4	G1071 V1140	G1071-G1104 WeakPolarHBondContact O-CA 3.1Å; G1104-V1140 PolarHBondContact N-O 2.98Å; G1104-V1140 PolarHBondContact O-N 3.16Å
1105	Y	74.9	Confident	72.5	Confident	1 Å²	1	31.9 Å²	31.9	0%	0.004	16%	0.162	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	155.4	179.5	-61.9	-68.8	0	0	0	110.5	S1070 G1071 I1073 C1110 S1134 V1135 G1136 H1137 D1138 H1182 I1184	S1070-Y1105 VanDerWaalsContact O-O 3.09Å; G1071-Y1105 WeakPolarHBondContact CA-O 3.19Å; G1071-Y1105 PolarHBondContact O-N 3.09Å; I1073-Y1105 HydrophobicContact CD1-CD2 4.28Å; I1073-Y1105 HydrophobicContact CD1-CE2 3.84Å; Y1105-C1110 HydrophobicContact CD2-CB 3.9Å; Y1105-C1110 HydrophobicContact CE2-CB 4.07Å; Y1105-S1134 VanDerWaalsContact OH-C 3.29Å; Y1105-S1134 PolarHBondContact OH-O 3.26Å; Y1105-S1134 VanDerWaalsContact OH-O 3.09Å; Y1105-S1134 PolarHBondContact OH-OG 2.89Å; Y1105-V1135 WeakPolarHBondContact OH-CA 3.48Å; Y1105-V1135 PolarHBondContact OH-N 2.93Å; Y1105-G1136 VanDerWaalsContact CD1-C 3.48Å; Y1105-G1136 VanDerWaalsContact CE1-C 3.42Å; Y1105-G1136 WeakPolarHBondContact CE1-O 3.45Å; Y1105-G1136 VanDerWaalsContact CZ-N 3.28Å; Y1105-G1136 PolarHBondContact OH-N 2.85Å; Y1105-H1137 WeakPolarHBondContact CB-O 3.35Å; Y1105-D1138 CarbonylContact C-O 3.43Å; Y1105-H1182 HydrophobicContact CE1-CB 4.08Å; Y1105-H1182 WeakPolarHBondContact CE1-O 3.46Å; Y1105-H1182 PolarHBondContact OH-O 2.94Å; Y1105-I1184 HydrophobicContact CE1-CD1 4.39Å; Y1105-I1184 HydrophobicContact CE2-CD1 4.25Å
1106	R	69.3	Low	72.5	Confident	167 Å²	167	32.7 Å²	32.7	63%	0.63	16%	0.161	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-91.5	-31.5	172.1	-172.2	-172.8	179.4	-165.9	0.6	111.7	D1138 V1140	R1106-D1138 HydrophobicContact CB-CB 3.77Å; R1106-D1138 WeakPolarHBondContact CB-O 3.38Å; R1106-D1138 PolarHBondContact N-O 3.4Å; R1106-V1140 HydrophobicContact CB-CG2 3.84Å
1107	R	66.6	Low	72	Confident	141 Å²	141	32.4 Å²	32.4	53%	0.532	15%	0.153	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	120.3	178.1	-71.6	-175	174.1	138.4	-17.1	110.3	V1109 H1137 D1138	R1107-V1109 VanDerWaalsContact C-N 3.28Å; R1107-V1109 PolarHBondContact O-N 3.16Å; R1107-H1137 HydrophobicContact CB-CB 4.2Å; R1107-D1138 VanDerWaalsContact CD-OD2 3.24Å; R1107-D1138 WeakPolarHBondContact CD-OD2 3.28Å; R1107-D1138 IonicContact CZ-OD2 3.5Å; R1107-D1138 IonicContact NE-OD2 2.69Å; R1107-D1138 IonicContact NH1-OD2 3.48Å; R1107-D1138 PolarHBondContact NH1-OD2 3.05Å
1108	P	58.9	Low	70.8	Confident	50 Å²	50	33.7 Å²	33.7	33%	0.325	16%	0.157	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	52.5	-163.3	38.5	-44.2	0	0	0	114.4	R1069 C1110	R1069-P1108 HydrophobicContact CG-CB 4.38Å; R1069-P1108 HydrophobicContact CG-CG 3.89Å; R1069-P1108 WeakPolarHBondContact O-CB 3.49Å; R1069-P1108 WeakPolarHBondContact O-CG 3.45Å; P1108-C1110 PolarHBondContact O-N 3.01Å
1109	V	64.5	Low	69	Low	44 Å²	44	35.5 Å²	35.5	27%	0.267	17%	0.169	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	44.8	166.1	-154	0	0	0	0	110.1	I602 R1107	I602-V1109 WeakPolarHBondContact O-CG1 3.25Å; R1107-V1109 VanDerWaalsContact C-N 3.28Å; R1107-V1109 PolarHBondContact O-N 3.16Å
1110	C	69.1	Low	67.1	Low	1 Å²	1	40.4 Å²	40.4	1%	0.007	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-81.9	122.1	-177.5	56.2	0	0	0	0	111.3	R1052 Y1105 P1108 V1135	R1052-C1110 WeakPolarHBondContact CG-O 3.49Å; R1052-C1110 PolarHBondContact NE-O 3.49Å; Y1105-C1110 HydrophobicContact CD2-CB 3.9Å; Y1105-C1110 HydrophobicContact CE2-CB 4.07Å; P1108-C1110 PolarHBondContact O-N 3.01Å; C1110-V1135 CarbonylContact C-O 3.56Å; C1110-V1135 VanDerWaalsContact CA-O 3.24Å; C1110-V1135 WeakPolarHBondContact CA-O 3.36Å
1111	N	81	Confident	65	Low	4 Å²	4	46.5 Å²	46.5	2%	0.021	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	131.6	163.7	-65.5	-80.9	0	0	0	108.3	A605 R1052 L1113 S1134 V1135	A605-N1111 HydrophobicContact CB-CB 3.96Å; R1052-N1111 VanDerWaalsContact CZ-OD1 3.26Å; R1052-N1111 PolarHBondContact NH1-OD1 2.95Å; R1052-N1111 PolarHBondContact NH2-OD1 3.37Å; N1111-L1113 HydrophobicContact CB-CD1 4.43Å; N1111-L1113 HydrophobicContact CB-CG 4.31Å; N1111-S1134 VanDerWaalsContact O-CA 3.26Å; N1111-S1134 WeakPolarHBondContact O-CA 3.41Å; N1111-V1135 PolarHBondContact N-O 3.39Å; N1111-V1135 PolarHBondContact O-N 3.05Å; N1111-V1135 VanDerWaalsContact O-N 3.1Å
1112	L	85.9	Confident	63.1	Low	16 Å²	16	50.7 Å²	50.7	8%	0.084	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101	121.7	168	-67.3	-179.9	0	0	0	108.1	R1052 L1054 A1067 I1073	R1052-L1112 HydrophobicContact CB-CD1 4.06Å; R1052-L1112 HydrophobicContact CB-CG 4.26Å; L1054-L1112 HydrophobicContact CB-CB 4.38Å; L1054-L1112 HydrophobicContact CB-CD1 4.44Å; L1054-L1112 HydrophobicContact CD2-CB 4.38Å; A1067-L1112 HydrophobicContact CB-CD1 4.02Å; A1067-L1112 HydrophobicContact CB-CG 4.26Å; I1073-L1112 HydrophobicContact CG2-CD2 4.34Å
1113	L	84.2	Confident	61.6	Low	24 Å²	24	57.2 Å²	57.2	13%	0.126	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	131.5	-172.9	-60.3	170.1	0	0	0	110.3	A605 T607 L623 N1111 I1132 V1133	A605-L1113 HydrophobicContact CB-CD1 3.97Å; T607-L1113 HydrophobicContact CG2-CB 4.11Å; T607-L1113 HydrophobicContact CG2-CD1 4.22Å; L623-L1113 HydrophobicContact CD1-CD1 3.38Å; N1111-L1113 HydrophobicContact CB-CD1 4.43Å; N1111-L1113 HydrophobicContact CB-CG 4.31Å; L1113-I1132 WeakPolarHBondContact O-CA 3.47Å; L1113-V1133 PolarHBondContact N-O 3.26Å; L1113-V1133 PolarHBondContact O-N 3.03Å
1114	L	82.8	Confident	60.1	Low	41 Å²	41	64.6 Å²	64.6	22%	0.215	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	122.4	174	-174.6	70.4	0	0	0	109.4	L1054 Y1130 I1132	L1054-L1114 HydrophobicContact CD1-CB 3.99Å; L1054-L1114 HydrophobicContact CD2-CB 4.19Å; L1114-Y1130 HydrophobicContact CD1-CD1 4Å; L1114-Y1130 HydrophobicContact CD1-CG 4.17Å; L1114-Y1130 HydrophobicContact CD2-CD1 4.34Å; L1114-Y1130 HydrophobicContact CG-CD1 4.11Å; L1114-I1132 HydrophobicContact CD1-CG1 3.97Å
1115	I	76	Confident	58.5	Low	7 Å²	7	70.3 Å²	70.3	4%	0.036	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.7	124.1	178.9	-60	174.7	0	0	0	108.4	T607 Y621 P657 Y1130 L1131 V1133	T607-I1115 HydrophobicContact CG2-CD1 3.88Å; T607-I1115 HydrophobicContact CG2-CG1 3.61Å; Y621-I1115 HydrophobicContact CD2-CG2 3.9Å; Y621-I1115 HydrophobicContact CG-CG2 4.01Å; P657-I1115 HydrophobicContact CB-CD1 3.59Å; P657-I1115 HydrophobicContact CG-CD1 3.67Å; I1115-Y1130 WeakPolarHBondContact O-CA 3.38Å; I1115-L1131 HydrophobicContact CB-CB 4.28Å; I1115-L1131 PolarHBondContact N-O 2.74Å; I1115-L1131 PolarHBondContact O-N 3Å; I1115-V1133 HydrophobicContact CD1-CG2 3.72Å
1116	H	67.8	Low	57.1	Low	62 Å²	62	76.8 Å²	76.8	29%	0.287	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.9	128.5	179.6	-164.2	-44.3	0	0	0	110	Y621 Y1130	Y621-H1116 HydrophobicContact CE2-CB 4.41Å; Y621-H1116 WeakPolarHBondContact CE2-O 3.47Å; H1116-Y1130 HydrophobicContact CB-CD1 4.38Å; H1116-Y1130 HydrophobicContact CB-CE1 3.92Å; H1116-Y1130 AromaticContact CD2-CE1 3.54Å; H1116-Y1130 AromaticContact CD2-CZ 3.91Å; H1116-Y1130 PolarHBondContact CD2-OH 3Å; H1116-Y1130 PolarHBondContact CE1-OH 3.29Å; H1116-Y1130 VanDerWaalsContact CE1-OH 3.27Å; H1116-Y1130 AromaticContact CG-CE1 3.55Å; H1116-Y1130 AromaticContact ND1-CE1 3.99Å; H1116-Y1130 AromaticContact NE2-CE1 3.95Å; H1116-Y1130 AromaticContact NE2-CZ 3.82Å; H1116-Y1130 PolarHBondContact NE2-OH 2.98Å
1117	Q	53.3	Low	56.1	Low	61 Å²	61	71 Å²	71	29%	0.285	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	95.6	177	-168.4	172	29.7	0	0	110.4	C1119 N1129	Q1117-C1119 PolarHBondContact O-N 3.37Å; Q1117-N1129 CarbonylContact C-O 3.54Å; Q1117-N1129 WeakPolarHBondContact CA-O 3.49Å; Q1117-N1129 HydrophobicContact CB-CB 4.36Å; Q1117-N1129 WeakPolarHBondContact CB-O 3.34Å; Q1117-N1129 PolarHBondContact N-O 3.05Å; Q1117-N1129 PolarHBondContact O-N 2.94Å
1118	I	46.1	Very low	55.5	Low	56 Å²	56	66.2 Å²	66.2	29%	0.287	35%	0.354	S	S	.	.			trans	-64	129	173.6	-56.6	178.6	0	0	0	108.5	K618 P619	K618-I1118 WeakPolarHBondContact CD-O 3.43Å; P619-I1118 HydrophobicContact CG-CB 4.34Å; P619-I1118 HydrophobicContact CG-CD1 3.82Å; P619-I1118 HydrophobicContact CG-CG1 3.94Å
1119	C	37.4	Very low	55.6	Low	39 Å²	39	64.6 Å²	64.6	26%	0.264	34%	0.343	S	S	.	.			trans	-123.7	94.9	177.9	-149.9	0	0	0	0	110.7	Q1117 K1121 D1127	Q1117-C1119 PolarHBondContact O-N 3.37Å; C1119-K1121 PolarHBondContact O-N 2.96Å; C1119-D1127 VanDerWaalsContact CB-O 3.29Å; C1119-D1127 WeakPolarHBondContact CB-O 3.36Å
1120	Q	34.2	Very low	55.9	Low	115 Å²	115	63 Å²	63	54%	0.537	33%	0.332	S	S	.	.	B	Isolated β-bridge	trans	-57.9	118.8	163.5	-73.2	173.4	-12.1	0	0	109.6
1121	K	32.1	Very low	56.2	Low	129 Å²	129	63.1 Å²	63.1	56%	0.561	33%	0.333	S	S	*	.	P	Polyproline II helix	trans	-91.6	142.6	143.8	-79.5	172.4	173.6	162.4	0	107.2	C1119 D1127	C1119-K1121 PolarHBondContact O-N 2.96Å; K1121-D1127 WeakPolarHBondContact CD-OD2 3.46Å; K1121-D1127 WeakPolarHBondContact CE-OD2 3.21Å; K1121-D1127 IonicContact NZ-OD1 3.73Å; K1121-D1127 IonicContact NZ-OD2 3.01Å; K1121-D1127 PolarHBondContact NZ-OD2 3.01Å
1122	A	31.3	Very low	56	Low	91 Å²	91	63 Å²	63	75%	0.752	33%	0.332	S	S	*	.	S	Bend	trans	-62.7	140.3	159.9	0	0	0	0	0	108.7
1123	N	35.2	Very low	55.8	Low	141 Å²	141	62.2 Å²	62.2	75%	0.754	33%	0.328	S	S	*	.	S	Bend	trans	78.4	83.9	-172.9	-49.2	-25	0	0	0	115.6	N1125	N1123-N1125 VanDerWaalsContact C-N 3.33Å; N1123-N1125 PolarHBondContact O-N 3.12Å
1124	N	39	Very low	55.8	Low	166 Å²	166	61 Å²	61	89%	0.888	32%	0.322	S	S	*	.	S	Bend	trans	64	-11.6	142.5	-59.9	10.8	0	0	0	121.6
1125	N	39.3	Very low	55.7	Low	120 Å²	120	59.1 Å²	59.1	64%	0.642	31%	0.311	S	S	*	.			trans	-116.9	120.4	170.2	-79.2	7.5	0	0	0	111	N1123 D1127	N1123-N1125 VanDerWaalsContact C-N 3.33Å; N1123-N1125 PolarHBondContact O-N 3.12Å; N1125-D1127 PolarHBondContact O-N 2.97Å
1126	E	45.9	Very low	55.8	Low	137 Å²	137	58.8 Å²	58.8	64%	0.64	31%	0.31	S	S	*	.	B	Isolated β-bridge	trans	-85.5	99.6	174.5	-65.2	-161	149.4	0	0	111.4	L1128	E1126-L1128 PolarHBondContact O-N 3.35Å
1127	D	48.6	Very low	56.1	Low	45 Å²	45	56.5 Å²	56.5	24%	0.241	30%	0.299	C	S	.	.			trans	-71.7	90.3	174.4	-72.2	-9.1	0	0	0	110.5	C1119 K1121 N1125 N1129	C1119-D1127 VanDerWaalsContact CB-O 3.29Å; C1119-D1127 WeakPolarHBondContact CB-O 3.36Å; K1121-D1127 WeakPolarHBondContact CD-OD2 3.46Å; K1121-D1127 WeakPolarHBondContact CE-OD2 3.21Å; K1121-D1127 IonicContact NZ-OD1 3.73Å; K1121-D1127 IonicContact NZ-OD2 3.01Å; K1121-D1127 PolarHBondContact NZ-OD2 3.01Å; N1125-D1127 PolarHBondContact O-N 2.97Å; D1127-N1129 PolarHBondContact O-N 3.33Å; D1127-N1129 VanDerWaalsContact O-N 3.17Å; D1127-N1129 PolarHBondContact O-ND2 3.29Å
1128	L	52.5	Low	57	Low	41 Å²	41	54.2 Å²	54.2	22%	0.215	29%	0.289	C	S	.	.			trans	-60.1	117.2	169.9	-65.5	171.9	0	0	0	109.8	L1058 E1126 Y1130	L1058-L1128 HydrophobicContact CD1-CD1 3.95Å; L1058-L1128 HydrophobicContact CD2-CD1 4Å; E1126-L1128 PolarHBondContact O-N 3.35Å; L1128-Y1130 HydrophobicContact CB-CE2 4Å
1129	N	62.1	Low	58.3	Low	17 Å²	17	52.5 Å²	52.5	9%	0.091	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	138.9	174.2	-77.5	-94.8	0	0	0	109.4	Q1117 D1127 L1188 T1189	Q1117-N1129 CarbonylContact C-O 3.54Å; Q1117-N1129 WeakPolarHBondContact CA-O 3.49Å; Q1117-N1129 HydrophobicContact CB-CB 4.36Å; Q1117-N1129 WeakPolarHBondContact CB-O 3.34Å; Q1117-N1129 PolarHBondContact N-O 3.05Å; Q1117-N1129 PolarHBondContact O-N 2.94Å; D1127-N1129 PolarHBondContact O-N 3.33Å; D1127-N1129 VanDerWaalsContact O-N 3.17Å; D1127-N1129 PolarHBondContact O-ND2 3.29Å; N1129-L1188 WeakPolarHBondContact CA-O 3.44Å; N1129-T1189 WeakPolarHBondContact OD1-CG2 3.21Å
1130	Y	70.1	Confident	59.8	Low	9 Å²	9	51.3 Å²	51.3	4%	0.035	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	141.6	171.1	-65	-86	0	0	0	110.3	L1058 L1114 I1115 H1116 L1128 R1187 L1188	L1058-Y1130 HydrophobicContact CB-CE2 4.28Å; L1058-Y1130 HydrophobicContact CD1-CE2 3.51Å; L1058-Y1130 WeakPolarHBondContact CD1-OH 3.24Å; L1114-Y1130 HydrophobicContact CD1-CD1 4Å; L1114-Y1130 HydrophobicContact CD1-CG 4.17Å; L1114-Y1130 HydrophobicContact CD2-CD1 4.34Å; L1114-Y1130 HydrophobicContact CG-CD1 4.11Å; I1115-Y1130 WeakPolarHBondContact O-CA 3.38Å; H1116-Y1130 HydrophobicContact CB-CD1 4.38Å; H1116-Y1130 HydrophobicContact CB-CE1 3.92Å; H1116-Y1130 AromaticContact CD2-CE1 3.54Å; H1116-Y1130 AromaticContact CD2-CZ 3.91Å; H1116-Y1130 PolarHBondContact CD2-OH 3Å; H1116-Y1130 PolarHBondContact CE1-OH 3.29Å; H1116-Y1130 VanDerWaalsContact CE1-OH 3.27Å; H1116-Y1130 AromaticContact CG-CE1 3.55Å; H1116-Y1130 AromaticContact ND1-CE1 3.99Å; H1116-Y1130 AromaticContact NE2-CE1 3.95Å; H1116-Y1130 AromaticContact NE2-CZ 3.82Å; H1116-Y1130 PolarHBondContact NE2-OH 2.98Å; L1128-Y1130 HydrophobicContact CB-CE2 4Å; Y1130-R1187 CarbonylContact O-C 3.56Å; Y1130-R1187 WeakPolarHBondContact O-CA 3.5Å; Y1130-L1188 PolarHBondContact N-O 3.25Å; Y1130-L1188 PolarHBondContact O-N 3Å
1131	L	74.9	Confident	61.4	Low	5 Å²	5	46.1 Å²	46.1	3%	0.026	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	120.8	165.1	-56.3	176.8	0	0	0	107.7	T658 I1115 V1133 V1185 W1186 R1187	T658-L1131 HydrophobicContact CG2-CD1 4.17Å; I1115-L1131 HydrophobicContact CB-CB 4.28Å; I1115-L1131 PolarHBondContact N-O 2.74Å; I1115-L1131 PolarHBondContact O-N 3Å; L1131-V1133 HydrophobicContact CB-CG2 4.49Å; L1131-V1185 HydrophobicContact CB-CG1 4.15Å; L1131-V1185 HydrophobicContact CD2-CG1 4.08Å; L1131-V1185 HydrophobicContact CG-CG1 4.48Å; L1131-W1186 CarbonylContact C-O 3.32Å; L1131-W1186 VanDerWaalsContact CA-O 3.29Å; L1131-W1186 WeakPolarHBondContact CA-O 3.47Å; L1131-R1187 HydrophobicContact CD2-CB 3.83Å; L1131-R1187 HydrophobicContact CD2-CG 3.92Å
1132	I	78.1	Confident	63	Low	0 Å²	0	40.1 Å²	40.1	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	126	157.9	-68.1	179	0	0	0	106.2	L1054 I1056 W1065 L1113 L1114 V1185 W1186 L1188	L1054-I1132 HydrophobicContact CD2-CD1 4Å; L1054-I1132 HydrophobicContact CD2-CG1 4.01Å; L1054-I1132 HydrophobicContact CD2-CG2 4.26Å; I1056-I1132 HydrophobicContact CD1-CD1 4.01Å; I1056-I1132 HydrophobicContact CG1-CD1 4.06Å; W1065-I1132 HydrophobicContact CD2-CD1 3.57Å; W1065-I1132 HydrophobicContact CE3-CD1 3.97Å; W1065-I1132 HydrophobicContact CE3-CG2 4.33Å; W1065-I1132 HydrophobicContact CG-CD1 3.9Å; W1065-I1132 HydrophobicContact CH2-CD1 4.22Å; W1065-I1132 HydrophobicContact CZ2-CD1 3.89Å; W1065-I1132 HydrophobicContact CZ3-CD1 4.27Å; W1065-I1132 HydrophobicContact CZ3-CG2 4.3Å; L1113-I1132 WeakPolarHBondContact O-CA 3.47Å; L1114-I1132 HydrophobicContact CD1-CG1 3.97Å; I1132-V1185 WeakPolarHBondContact O-CA 3.18Å; I1132-W1186 HydrophobicContact CB-CB 4.44Å; I1132-W1186 HydrophobicContact CB-CE3 4.25Å; I1132-W1186 HydrophobicContact CG2-CE3 3.86Å; I1132-W1186 HydrophobicContact CG2-CZ3 4.32Å; I1132-W1186 PolarHBondContact N-O 3.16Å; I1132-W1186 PolarHBondContact O-N 3.49Å; I1132-L1188 HydrophobicContact CD1-CD1 3.76Å; I1132-L1188 HydrophobicContact CG1-CD1 3.85Å
1133	V	80.1	Confident	64.2	Low	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	122.7	171.3	-174.8	0	0	0	0	107.7	L623 F660 L1113 I1115 L1131 V1135 I1184 V1185	L623-V1133 HydrophobicContact CD2-CG1 4.32Å; F660-V1133 HydrophobicContact CZ-CG1 4.13Å; L1113-V1133 PolarHBondContact N-O 3.26Å; L1113-V1133 PolarHBondContact O-N 3.03Å; I1115-V1133 HydrophobicContact CD1-CG2 3.72Å; L1131-V1133 HydrophobicContact CB-CG2 4.49Å; V1133-V1135 HydrophobicContact CG1-CG2 3.87Å; V1133-I1184 CarbonylContact C-O 3.55Å; V1133-I1184 WeakPolarHBondContact CA-O 3.43Å; V1133-V1185 HydrophobicContact CG1-CG2 4.41Å; V1133-V1185 HydrophobicContact CG2-CG1 4.25Å; V1133-V1185 HydrophobicContact CG2-CG2 4.22Å
1134	S	85	Confident	64.8	Low	0 Å²	0	35 Å²	35	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	140.8	158.9	74.6	0	0	0	0	110	I1073 Y1105 N1111 A1183 I1184	I1073-S1134 VanDerWaalsContact CD1-OG 3.25Å; I1073-S1134 WeakPolarHBondContact CD1-OG 3.47Å; Y1105-S1134 VanDerWaalsContact OH-C 3.29Å; Y1105-S1134 PolarHBondContact OH-O 3.26Å; Y1105-S1134 VanDerWaalsContact OH-O 3.09Å; Y1105-S1134 PolarHBondContact OH-OG 2.89Å; N1111-S1134 VanDerWaalsContact O-CA 3.26Å; N1111-S1134 WeakPolarHBondContact O-CA 3.41Å; S1134-A1183 CarbonylContact O-C 3.5Å; S1134-A1183 VanDerWaalsContact O-CA 3.32Å; S1134-A1183 WeakPolarHBondContact O-CA 3.23Å; S1134-I1184 PolarHBondContact N-O 3Å; S1134-I1184 PolarHBondContact O-N 3.06Å; S1134-I1184 WeakPolarHBondContact OG-CB 3.42Å
1135	V	80.8	Confident	65	Low	0 Å²	0	32 Å²	32	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	129.2	168.7	-178.6	0	0	0	0	109.5	I592 I602 L623 L625 Y1105 C1110 N1111 V1133 A1183	I592-V1135 HydrophobicContact CD1-CG1 3.65Å; I602-V1135 HydrophobicContact CD1-CG1 3.54Å; L623-V1135 HydrophobicContact CD2-CG2 3.85Å; L625-V1135 HydrophobicContact CD1-CG1 4.29Å; L625-V1135 HydrophobicContact CD2-CB 4.39Å; L625-V1135 HydrophobicContact CD2-CG1 4Å; L625-V1135 HydrophobicContact CD2-CG2 4.26Å; Y1105-V1135 WeakPolarHBondContact OH-CA 3.48Å; Y1105-V1135 PolarHBondContact OH-N 2.93Å; C1110-V1135 CarbonylContact C-O 3.56Å; C1110-V1135 VanDerWaalsContact CA-O 3.24Å; C1110-V1135 WeakPolarHBondContact CA-O 3.36Å; N1111-V1135 PolarHBondContact N-O 3.39Å; N1111-V1135 PolarHBondContact O-N 3.05Å; N1111-V1135 VanDerWaalsContact O-N 3.1Å; V1133-V1135 HydrophobicContact CG1-CG2 3.87Å; V1135-A1183 HydrophobicContact CG2-CB 4.03Å
1136	G	78.1	Confident	65.1	Low	0 Å²	0	32.1 Å²	32.1	0%	0	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-163.5	-172.1	-178.5	0	0	0	0	0	112.1	Y1105 A1181 H1182	Y1105-G1136 VanDerWaalsContact CD1-C 3.48Å; Y1105-G1136 VanDerWaalsContact CE1-C 3.42Å; Y1105-G1136 WeakPolarHBondContact CE1-O 3.45Å; Y1105-G1136 VanDerWaalsContact CZ-N 3.28Å; Y1105-G1136 PolarHBondContact OH-N 2.85Å; G1136-A1181 WeakPolarHBondContact O-CA 3.19Å; G1136-H1182 PolarHBondContact N-O 2.84Å; G1136-H1182 PolarHBondContact O-N 2.61Å
1137	H	74.8	Confident	64.8	Low	15 Å²	15	31.1 Å²	31.1	7%	0.069	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	151.8	-172.8	-65.2	-49.9	0	0	0	113.6	L600 I602 Y1105 R1107 G1180	L600-H1137 PolarHBondContact O-CE1 3.06Å; I602-H1137 PolarHBondContact N-CE1 2.9Å; I602-H1137 PolarHBondContact N-NE2 3.14Å; I602-H1137 VanDerWaalsContact N-NE2 3.14Å; Y1105-H1137 WeakPolarHBondContact CB-O 3.35Å; R1107-H1137 HydrophobicContact CB-CB 4.2Å; H1137-G1180 WeakPolarHBondContact CA-O 3.47Å
1138	D	71.8	Confident	64.1	Low	13 Å²	13	38.1 Å²	38.1	7%	0.07	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	55.7	70.7	171.1	-58.5	-14.5	0	0	0	110.6	Y1105 R1106 R1107 S1179 G1180	Y1105-D1138 CarbonylContact C-O 3.43Å; R1106-D1138 HydrophobicContact CB-CB 3.77Å; R1106-D1138 WeakPolarHBondContact CB-O 3.38Å; R1106-D1138 PolarHBondContact N-O 3.4Å; R1107-D1138 VanDerWaalsContact CD-OD2 3.24Å; R1107-D1138 WeakPolarHBondContact CD-OD2 3.28Å; R1107-D1138 IonicContact CZ-OD2 3.5Å; R1107-D1138 IonicContact NE-OD2 2.69Å; R1107-D1138 IonicContact NH1-OD2 3.48Å; R1107-D1138 PolarHBondContact NH1-OD2 3.05Å; D1138-S1179 VanDerWaalsContact OD1-CA 3.31Å; D1138-S1179 WeakPolarHBondContact OD1-CA 3.2Å; D1138-S1179 PolarHBondContact OD1-OG 2.86Å; D1138-G1180 PolarHBondContact N-O 3.05Å; D1138-G1180 PolarHBondContact OD1-N 3.37Å
1139	Y	73.1	Confident	63.1	Low	20 Å²	20	44.7 Å²	44.7	8%	0.078	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-52.5	145.6	-178.7	163.7	-82.8	0	0	0	112.7	C589 H1103 D1141 Q1176 M1177	C589-Y1139 WeakPolarHBondContact SG-CE2 3.48Å; H1103-Y1139 HydrophobicContact CB-CE2 3.92Å; H1103-Y1139 AromaticContact ND1-CE2 3.47Å; H1103-Y1139 WeakPolarHBondContact ND1-CE2 3.45Å; H1103-Y1139 AromaticContact ND1-CZ 3.59Å; H1103-Y1139 PolarHBondContact ND1-OH 2.88Å; Y1139-D1141 HydrophobicContact CE1-CB 4.16Å; Y1139-Q1176 WeakPolarHBondContact CD1-O 3.38Å; Y1139-M1177 HydrophobicContact CD1-CB 4.13Å
1140	V	69.3	Low	61.7	Low	13 Å²	13	46.8 Å²	46.8	8%	0.079	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	134.2	176.6	-179.5	0	0	0	0	110	G1104 R1106 L1142 R1173	G1104-V1140 PolarHBondContact N-O 2.98Å; G1104-V1140 PolarHBondContact O-N 3.16Å; R1106-V1140 HydrophobicContact CB-CG2 3.84Å; V1140-L1142 HydrophobicContact CG1-CD2 4.01Å; V1140-L1142 HydrophobicContact CG1-CG 4.44Å; V1140-R1173 HydrophobicContact CG1-CB 3.91Å; V1140-R1173 HydrophobicContact CG1-CG 4.16Å
1141	D	68	Low	59.8	Low	6 Å²	6	54.7 Å²	54.7	3%	0.032	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	126.8	168.2	-172.3	-4.5	0	0	0	109.4	Y1139 R1143 S1174	Y1139-D1141 HydrophobicContact CE1-CB 4.16Å; D1141-R1143 IonicContact OD1-NE 2.66Å; D1141-R1143 IonicContact OD2-CZ 3.14Å; D1141-R1143 IonicContact OD2-NE 2.79Å; D1141-R1143 PolarHBondContact OD2-NE 3.45Å; D1141-R1143 IonicContact OD2-NH2 3.26Å; D1141-R1143 PolarHBondContact OD2-NH2 2.89Å; D1141-S1174 PolarHBondContact N-O 2.91Å; D1141-S1174 WeakPolarHBondContact O-CA 3.37Å; D1141-S1174 VanDerWaalsContact O-CB 3.28Å; D1141-S1174 WeakPolarHBondContact O-CB 3.33Å; D1141-S1174 PolarHBondContact O-N 3.15Å
1142	L	64.8	Low	57.9	Low	4 Å²	4	62.2 Å²	62.2	2%	0.021	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	95.2	-170.1	-65.7	166.1	0	0	0	108.7	L1072 S1101 C1102 V1140 I1171 R1173	L1072-L1142 HydrophobicContact CD2-CD1 3.55Å; L1072-L1142 HydrophobicContact CD2-CD2 3.94Å; L1072-L1142 HydrophobicContact CD2-CG 4.42Å; S1101-L1142 VanDerWaalsContact O-CD1 3.32Å; S1101-L1142 WeakPolarHBondContact O-CD1 3.38Å; C1102-L1142 WeakPolarHBondContact O-CB 3.36Å; C1102-L1142 PolarHBondContact O-N 3.4Å; V1140-L1142 HydrophobicContact CG1-CD2 4.01Å; V1140-L1142 HydrophobicContact CG1-CG 4.44Å; L1142-I1171 HydrophobicContact CB-CG2 3.71Å; L1142-I1171 HydrophobicContact CD2-CG2 4.16Å; L1142-I1171 HydrophobicContact CG-CG2 4.48Å; L1142-R1173 HydrophobicContact CD2-CG 3.97Å
1143	R	57.1	Low	55.8	Low	70 Å²	70	68.7 Å²	68.7	26%	0.264	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	151.7	-171.1	-64.8	-170.5	177.9	172.6	3.5	112.1	D1141 N1172	D1141-R1143 IonicContact OD1-NE 2.66Å; D1141-R1143 IonicContact OD2-CZ 3.14Å; D1141-R1143 IonicContact OD2-NE 2.79Å; D1141-R1143 PolarHBondContact OD2-NE 3.45Å; D1141-R1143 IonicContact OD2-NH2 3.26Å; D1141-R1143 PolarHBondContact OD2-NH2 2.89Å; R1143-N1172 PolarHBondContact N-O 3.17Å; R1143-N1172 VanDerWaalsContact N-O 3.16Å; R1143-N1172 PolarHBondContact O-N 3.21Å
1144	Q	48	Very low	53.5	Low	55 Å²	55	76.4 Å²	76.4	26%	0.257	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.4	129.9	168.5	179.1	170.5	1.8	0	0	110.5	W533 I1169	W533-Q1144 VanDerWaalsContact CD1-OE1 3.27Å; W533-Q1144 HydrophobicContact CG-CB 4.23Å; Q1144-I1169 HydrophobicContact CG-CG2 3.77Å
1145	I	43.6	Very low	51.2	Low	103 Å²	103	84.5 Å²	84.5	53%	0.528	42%	0.418	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	131.7	150	-60	178.6	0	0	0	106	N1172	I1145-N1172 HydrophobicContact CD1-CB 4.1Å; I1145-N1172 HydrophobicContact CG1-CB 4.32Å
1146	Q	41.5	Very low	48.9	Very low	121 Å²	121	92.7 Å²	92.7	57%	0.565	46%	0.456	S	S	*	.			trans	-104.6	112	171.1	-172	166.3	1.5	0	0	107.8	Q1148	Q1146-Q1148 PolarHBondContact O-N 2.94Å; Q1146-Q1148 VanDerWaalsContact O-N 3.16Å
1147	E	38.8	Very low	46.6	Very low	117 Å²	117	98.4 Å²	98.4	55%	0.547	49%	0.492	S	S	.	.			trans	-57.5	118.4	179.7	-64.6	-177.9	132.5	0	0	110.3	F1149	E1147-F1149 HydrophobicContact CB-CD2 4.25Å; E1147-F1149 HydrophobicContact CB-CE2 4.19Å; E1147-F1149 PolarHBondContact O-N 3.24Å
1148	Q	33.9	Very low	44.4	Very low	191 Å²	191	106.3 Å²	106.3	89%	0.893	53%	0.529	S	S	*	.			trans	-81.7	97.7	165.5	-67.6	-173	11.2	0	0	107.7	Q1146 G1150	Q1146-Q1148 PolarHBondContact O-N 2.94Å; Q1146-Q1148 VanDerWaalsContact O-N 3.16Å; Q1148-G1150 PolarHBondContact O-N 3.48Å
1149	F	32.1	Very low	42.5	Very low	180 Å²	180	114.2 Å²	114.2	79%	0.789	57%	0.57	S	S	*	*			trans	-65.5	86.5	164.9	-88.1	-90.8	0	0	0	109.2	E1147	E1147-F1149 HydrophobicContact CB-CD2 4.25Å; E1147-F1149 HydrophobicContact CB-CE2 4.19Å; E1147-F1149 PolarHBondContact O-N 3.24Å
1150	G	32	Very low	40.2	Very low	61 Å²	61	118.9 Å²	118.9	63%	0.629	61%	0.605	S	S	*	*			trans	-63.8	131.7	169.2	0	0	0	0	0	109.9	Q1148 N1152	Q1148-G1150 PolarHBondContact O-N 3.48Å; G1150-N1152 PolarHBondContact O-N 2.79Å
1151	Q	29.8	Very low	38.3	Very low	175 Å²	175	122.8 Å²	122.8	82%	0.818	64%	0.639	S	S	*	*			trans	-67.7	123.9	172.7	-64.5	171.6	-96.4	0	0	108.9
1152	N	34.9	Very low	36.5	Very low	162 Å²	162	128.6 Å²	128.6	87%	0.866	67%	0.674	S	S	*	*			trans	-133.5	129	160.2	-84	-42.8	0	0	0	106.1	G1150	G1150-N1152 PolarHBondContact O-N 2.79Å
1153	D	34.9	Very low	34.6	Very low	137 Å²	137	140.3 Å²	140.3	73%	0.733	72%	0.718	S	S	*	*			trans	-88.9	161	-160.5	-72.3	-60.7	0	0	0	114.9
1154	E	32.1	Very low	33.3	Very low	161 Å²	161	142.2 Å²	142.2	75%	0.752	74%	0.738	S	S	*	*			trans	31.8	112.5	156.8	-60.3	-166.9	162.6	0	0	120.1
1155	H	35.2	Very low	32.3	Very low	170 Å²	170	144.7 Å²	144.7	79%	0.787	76%	0.761	S	S	*	*				-172.3	166	98.9	-92.7	-28.8	0	0	0	113.9
1156	Q	32.7	Very low	31.7	Very low	173 Å²	173	144 Å²	144	81%	0.808	77%	0.766	S	S	*	*			trans	67	78.5	165.1	-68.2	180	13.7	0	0	120.1
1157	T	31.1	Very low	31.3	Very low	120 Å²	120	144.4 Å²	144.4	74%	0.736	77%	0.77	S	S	*	*				48.7	125.3	120.7	47.2	0	0	0	0	123.1
1158	Q	28.5	Very low	31.2	Very low	181 Å²	181	147.4 Å²	147.4	85%	0.846	78%	0.777	S	S	*	*			trans	67.7	93.1	140.9	-63.2	-176.9	6.6	0	0	119.7
1159	L	30.5	Very low	31.7	Very low	179 Å²	179	139.5 Å²	139.5	94%	0.937	74%	0.74	S	S	*	*				-161.7	153.8	115.5	-105.6	160	0	0	0	110.7
1160	S	25.5	Very low	32.5	Very low	118 Å²	118	133 Å²	133	83%	0.825	71%	0.712	S	S	*	*			trans	-97.4	114.8	-167.1	55.9	0	0	0	0	113.4
1161	A	30.1	Very low	33.5	Very low	94 Å²	94	130.4 Å²	130.4	78%	0.777	68%	0.684	S	S	*	*			trans	-142.9	154.9	168.1	0	0	0	0	0	111.9	R1163	A1161-R1163 PolarHBondContact O-N 3.37Å
1162	V	29.9	Very low	34.6	Very low	129 Å²	129	123.7 Å²	123.7	78%	0.782	65%	0.653	S	S	*	*			trans	-57.5	122.3	-171.5	-177.5	0	0	0	0	112.6	T1164	V1162-T1164 HydrophobicContact CG1-CG2 4.11Å; V1162-T1164 PolarHBondContact O-N 3.49Å
1163	R	25.2	Very low	35.5	Very low	250 Å²	250	118.2 Å²	118.2	94%	0.943	62%	0.62	S	S	*	*			trans	-80.9	90.4	169.6	-75.1	-177.7	172.3	174.8	-3.7	111	A1161	A1161-R1163 PolarHBondContact O-N 3.37Å
1164	T	28.7	Very low	36.3	Very low	110 Å²	110	113.4 Å²	113.4	68%	0.675	60%	0.598	S	S	*	*			trans	-90.7	107.2	161.9	46.4	0	0	0	0	110	V1162 S1166	V1162-T1164 HydrophobicContact CG1-CG2 4.11Å; V1162-T1164 PolarHBondContact O-N 3.49Å; T1164-S1166 PolarHBondContact O-N 2.91Å
1165	S	27.2	Very low	37.1	Very low	106 Å²	106	115.9 Å²	115.9	74%	0.741	60%	0.6	S	S	*	*			trans	-78.2	58.6	178	51.9	0	0	0	0	112.7	I1167	S1165-I1167 PolarHBondContact O-N 2.85Å
1166	S	31.7	Very low	37.9	Very low	90 Å²	90	111.1 Å²	111.1	63%	0.629	58%	0.578	S	S	*	*			trans	-76.5	116.4	172.3	-57.6	0	0	0	0	110	T1164 R1168	T1164-S1166 PolarHBondContact O-N 2.91Å; S1166-R1168 PolarHBondContact O-N 3.12Å
1167	I	32	Very low	38.8	Very low	128 Å²	128	109.4 Å²	109.4	66%	0.656	57%	0.572	S	S	*	*			trans	-64.6	100.4	168.3	-55.9	175.4	0	0	0	107.3	S1165 I1169	S1165-I1167 PolarHBondContact O-N 2.85Å; I1167-I1169 HydrophobicContact CG2-CD1 4.41Å; I1167-I1169 HydrophobicContact CG2-CG1 4.01Å; I1167-I1169 PolarHBondContact O-N 3.34Å
1168	R	38	Very low	40	Very low	181 Å²	181	105.6 Å²	105.6	68%	0.683	56%	0.557	S	S	*	*			trans	-70.1	129.8	170	-70.1	-169.2	179.3	-171.3	0.1	108.5	S1166 H1170	S1166-R1168 PolarHBondContact O-N 3.12Å; R1168-H1170 WeakPolarHBondContact CD-NE2 3.35Å
1169	I	43.6	Very low	41.6	Very low	24 Å²	24	100.6 Å²	100.6	12%	0.123	54%	0.541	C	S	.	.			trans	-120.5	94.6	175.8	-63	173.7	0	0	0	106.2	L531 W548 Q1144 I1167	L531-I1169 VanDerWaalsContact O-CD1 3.25Å; L531-I1169 WeakPolarHBondContact O-CD1 3.44Å; W548-I1169 HydrophobicContact CH2-CB 3.97Å; W548-I1169 HydrophobicContact CH2-CD1 3.87Å; W548-I1169 HydrophobicContact CH2-CG2 3.9Å; W548-I1169 HydrophobicContact CZ3-CB 4.37Å; W548-I1169 HydrophobicContact CZ3-CD1 4.2Å; W548-I1169 HydrophobicContact CZ3-CG2 3.79Å; Q1144-I1169 HydrophobicContact CG-CG2 3.77Å; I1167-I1169 HydrophobicContact CG2-CD1 4.41Å; I1167-I1169 HydrophobicContact CG2-CG1 4.01Å; I1167-I1169 PolarHBondContact O-N 3.34Å
1170	H	49.5	Very low	43.4	Very low	43 Å²	43	92.8 Å²	92.8	20%	0.199	50%	0.504	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.4	124.1	178.8	-72.9	-74.2	0	0	0	110	L1037 D1038 R1168 N1172	L1037-H1170 PolarHBondContact O-ND1 2.91Å; D1038-H1170 HydrophobicContact CB-CB 4.23Å; R1168-H1170 WeakPolarHBondContact CD-NE2 3.35Å; H1170-N1172 PolarHBondContact O-N 2.99Å
1171	I	52.2	Low	45.7	Very low	7 Å²	7	87.4 Å²	87.4	4%	0.036	47%	0.467	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	110.3	168.8	-63.4	169.1	0	0	0	107.3	W533 M1036 D1038 I1100 L1142	W533-I1171 HydrophobicContact CZ2-CD1 3.86Å; W533-I1171 HydrophobicContact CZ2-CG1 4.03Å; M1036-I1171 WeakPolarHBondContact O-CB 3.49Å; M1036-I1171 WeakPolarHBondContact O-CD1 3.25Å; M1036-I1171 WeakPolarHBondContact O-CG1 3.33Å; M1036-I1171 PolarHBondContact O-N 3.07Å; D1038-I1171 WeakPolarHBondContact CB-O 3.36Å; D1038-I1171 PolarHBondContact N-O 3.45Å; I1100-I1171 HydrophobicContact CD1-CD1 4.18Å; L1142-I1171 HydrophobicContact CB-CG2 3.71Å; L1142-I1171 HydrophobicContact CD2-CG2 4.16Å; L1142-I1171 HydrophobicContact CG-CG2 4.48Å
1172	N	53.3	Low	48	Very low	34 Å²	34	83.1 Å²	83.1	18%	0.182	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.2	145.4	-178	-152.8	-41	0	0	0	110.7	D1038 R1143 I1145 H1170 S1174	D1038-N1172 HydrophobicContact CB-CB 4.27Å; D1038-N1172 PolarHBondContact OD2-ND2 3.11Å; R1143-N1172 PolarHBondContact N-O 3.17Å; R1143-N1172 VanDerWaalsContact N-O 3.16Å; R1143-N1172 PolarHBondContact O-N 3.21Å; I1145-N1172 HydrophobicContact CD1-CB 4.1Å; I1145-N1172 HydrophobicContact CG1-CB 4.32Å; H1170-N1172 PolarHBondContact O-N 2.99Å; N1172-S1174 PolarHBondContact O-N 3.33Å; N1172-S1174 VanDerWaalsContact O-N 3.08Å
1173	R	54.7	Low	50.3	Low	47 Å²	47	77 Å²	77	18%	0.177	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	88	-169.2	-70.3	-174.2	177.3	-127.2	-6.8	110.6	S1070 V1140 L1142 R1175	S1070-R1173 VanDerWaalsContact CB-NH2 3.32Å; S1070-R1173 PolarHBondContact O-NH1 3.3Å; S1070-R1173 PolarHBondContact O-NH2 3.42Å; S1070-R1173 PolarHBondContact OG-NH2 3Å; V1140-R1173 HydrophobicContact CG1-CB 3.91Å; V1140-R1173 HydrophobicContact CG1-CG 4.16Å; L1142-R1173 HydrophobicContact CD2-CG 3.97Å; R1173-R1175 PolarHBondContact O-N 3.22Å
1174	S	50.3	Low	52.9	Low	36 Å²	36	65.1 Å²	65.1	25%	0.252	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.6	117.8	178.4	-166	0	0	0	0	110.6	D1141 N1172 Q1176	D1141-S1174 PolarHBondContact N-O 2.91Å; D1141-S1174 WeakPolarHBondContact O-CA 3.37Å; D1141-S1174 VanDerWaalsContact O-CB 3.28Å; D1141-S1174 WeakPolarHBondContact O-CB 3.33Å; D1141-S1174 PolarHBondContact O-N 3.15Å; N1172-S1174 PolarHBondContact O-N 3.33Å; N1172-S1174 VanDerWaalsContact O-N 3.08Å; S1174-Q1176 PolarHBondContact O-N 3.28Å
1175	R	50	Low	55.2	Low	213 Å²	213	60.1 Å²	60.1	80%	0.804	32%	0.318	S	S	*	.			trans	-73.2	94.2	175.4	-62.4	-176.2	-173.2	-179.7	4.4	109.4	R1173	R1173-R1175 PolarHBondContact O-N 3.22Å
1176	Q	51.2	Low	57.7	Low	71 Å²	71	55.2 Å²	55.2	33%	0.332	28%	0.284	S	S	.	.			trans	-128.3	137.3	164.5	-70	-155.6	-28.7	0	0	110.2	Y1139 S1174	Y1139-Q1176 WeakPolarHBondContact CD1-O 3.38Å; S1174-Q1176 PolarHBondContact O-N 3.28Å
1177	M	52.8	Low	59.8	Low	137 Å²	137	56.2 Å²	56.2	68%	0.675	27%	0.274	S	S	*	.	S	Bend	trans	71.1	160	-173.5	-51.5	-54.6	171.3	0	0	115.9	Y1139	Y1139-M1177 HydrophobicContact CD1-CB 4.13Å
1178	G	54.5	Low	61.6	Low	40 Å²	40	51.3 Å²	51.3	41%	0.412	25%	0.249	S	C	.	.			trans	-95.8	-178.2	-163.4	0	0	0	0	0	116	H1182	G1178-H1182 PolarHBondContact O-CE1 2.87Å
1179	S	62.8	Low	62.6	Low	75 Å²	75	46.9 Å²	46.9	52%	0.524	24%	0.242	S	C	.	.	S	Bend	trans	-59.4	142	177.9	-168.3	0	0	0	0	112.3	D1138	D1138-S1179 VanDerWaalsContact OD1-CA 3.31Å; D1138-S1179 WeakPolarHBondContact OD1-CA 3.2Å; D1138-S1179 PolarHBondContact OD1-OG 2.86Å
1180	G	67.8	Low	63	Low	16 Å²	16	48.4 Å²	48.4	17%	0.165	25%	0.25	C	S	.	.	S	Bend	trans	118.5	-171.8	169.3	0	0	0	0	0	115.9	H1137 D1138 H1182	H1137-G1180 WeakPolarHBondContact CA-O 3.47Å; D1138-G1180 PolarHBondContact N-O 3.05Å; D1138-G1180 PolarHBondContact OD1-N 3.37Å; G1180-H1182 PolarHBondContact O-ND1 3.45Å
1181	A	75	Confident	62.5	Low	5 Å²	5	53.2 Å²	53.2	4%	0.041	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	130.7	-167	0	0	0	0	0	114	I592 L595 I602 G1136	I592-A1181 HydrophobicContact CB-CB 4.42Å; I592-A1181 HydrophobicContact CD1-CB 4.19Å; I592-A1181 PolarHBondContact N-O 3.36Å; L595-A1181 HydrophobicContact CB-CB 4.43Å; L595-A1181 HydrophobicContact CD1-CB 3.74Å; I602-A1181 HydrophobicContact CD1-CB 3.71Å; G1136-A1181 WeakPolarHBondContact O-CA 3.19Å
1182	H	77	Confident	61.5	Low	4 Å²	4	56.9 Å²	56.9	2%	0.019	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	136.3	-177.3	-71.1	78.7	0	0	0	111.6	T591 Y1105 G1136 G1178 G1180	T591-H1182 VanDerWaalsContact CA-CD2 3.44Å; T591-H1182 WeakPolarHBondContact CA-CD2 3.34Å; T591-H1182 PolarHBondContact OG1-CD2 3.15Å; T591-H1182 VanDerWaalsContact OG1-CD2 3.23Å; T591-H1182 PolarHBondContact OG1-NE2 2.98Å; Y1105-H1182 HydrophobicContact CE1-CB 4.08Å; Y1105-H1182 WeakPolarHBondContact CE1-O 3.46Å; Y1105-H1182 PolarHBondContact OH-O 2.94Å; G1136-H1182 PolarHBondContact N-O 2.84Å; G1136-H1182 PolarHBondContact O-N 2.61Å; G1178-H1182 PolarHBondContact O-CE1 2.87Å; G1180-H1182 PolarHBondContact O-ND1 3.45Å
1183	A	79.4	Confident	60.2	Low	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	134.7	175.3	0	0	0	0	0	111	C589 R590 I592 F660 S1134 V1135	C589-A1183 WeakPolarHBondContact CA-O 3.47Å; R590-A1183 PolarHBondContact N-O 2.86Å; R590-A1183 PolarHBondContact O-N 3.06Å; I592-A1183 HydrophobicContact CD1-CB 3.9Å; I592-A1183 HydrophobicContact CG1-CB 3.98Å; F660-A1183 HydrophobicContact CD1-CB 4.08Å; F660-A1183 HydrophobicContact CD2-CB 3.54Å; F660-A1183 HydrophobicContact CE1-CB 4.14Å; F660-A1183 HydrophobicContact CE2-CB 3.59Å; F660-A1183 HydrophobicContact CG-CB 3.8Å; F660-A1183 HydrophobicContact CZ-CB 3.9Å; S1134-A1183 CarbonylContact O-C 3.5Å; S1134-A1183 VanDerWaalsContact O-CA 3.32Å; S1134-A1183 WeakPolarHBondContact O-CA 3.23Å; V1135-A1183 HydrophobicContact CG2-CB 4.03Å
1184	I	78.8	Confident	60.5	Low	0 Å²	0	68.3 Å²	68.3	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	129.4	175.4	-48.5	159.9	0	0	0	107.7	P586 Q588 I1073 H1103 Y1105 V1133 S1134 W1186	P586-I1184 HydrophobicContact CB-CG2 3.5Å; P586-I1184 VanDerWaalsContact CB-CG2 3.5Å; P586-I1184 HydrophobicContact CG-CG2 3.9Å; Q588-I1184 CarbonylContact O-C 3.6Å; I1073-I1184 HydrophobicContact CD1-CD1 4.13Å; H1103-I1184 HydrophobicContact CB-CD1 3.71Å; H1103-I1184 HydrophobicContact CB-CG1 4.43Å; H1103-I1184 HydrophobicContact CB-CG2 4.45Å; Y1105-I1184 HydrophobicContact CE1-CD1 4.39Å; Y1105-I1184 HydrophobicContact CE2-CD1 4.25Å; V1133-I1184 CarbonylContact C-O 3.55Å; V1133-I1184 WeakPolarHBondContact CA-O 3.43Å; S1134-I1184 PolarHBondContact N-O 3Å; S1134-I1184 PolarHBondContact O-N 3.06Å; S1134-I1184 WeakPolarHBondContact OG-CB 3.42Å; I1184-W1186 HydrophobicContact CB-CH2 3.67Å; I1184-W1186 HydrophobicContact CB-CZ2 4.36Å; I1184-W1186 HydrophobicContact CB-CZ3 3.89Å; I1184-W1186 HydrophobicContact CD1-CH2 4.32Å; I1184-W1186 HydrophobicContact CG2-CD2 4.49Å; I1184-W1186 HydrophobicContact CG2-CE3 4.34Å; I1184-W1186 HydrophobicContact CG2-CH2 3.36Å; I1184-W1186 HydrophobicContact CG2-CZ2 3.55Å; I1184-W1186 HydrophobicContact CG2-CZ3 3.8Å; I1184-W1186 WeakPolarHBondContact O-CZ3 3.33Å
1185	V	78.1	Confident	61.1	Low	6 Å²	6	70 Å²	70	4%	0.036	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	123.8	-175	-170.1	0	0	0	0	111.2	P586 I587 Q588 F660 L1131 I1132 V1133	P586-V1185 CarbonylContact C-O 3.59Å; P586-V1185 WeakPolarHBondContact CA-O 3.5Å; P586-V1185 VanDerWaalsContact CB-O 3.31Å; P586-V1185 WeakPolarHBondContact CB-O 3.04Å; I587-V1185 PolarHBondContact N-O 3.07Å; Q588-V1185 HydrophobicContact CB-CB 4.23Å; Q588-V1185 HydrophobicContact CB-CG2 4.42Å; Q588-V1185 PolarHBondContact N-O 3.39Å; Q588-V1185 PolarHBondContact O-N 3.43Å; F660-V1185 HydrophobicContact CE2-CG2 3.66Å; L1131-V1185 HydrophobicContact CB-CG1 4.15Å; L1131-V1185 HydrophobicContact CD2-CG1 4.08Å; L1131-V1185 HydrophobicContact CG-CG1 4.48Å; I1132-V1185 WeakPolarHBondContact O-CA 3.18Å; V1133-V1185 HydrophobicContact CG1-CG2 4.41Å; V1133-V1185 HydrophobicContact CG2-CG1 4.25Å; V1133-V1185 HydrophobicContact CG2-CG2 4.22Å
1186	W	79.8	Confident	61.7	Low	3 Å²	3	62.1 Å²	62.1	1%	0.011	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	134.9	167.7	-60.1	-96.4	0	0	0	109.3	P584 V585 P586 W1065 I1073 L1131 I1132 I1184	P584-W1186 PolarHBondContact O-NE1 2.94Å; V585-W1186 VanDerWaalsContact C-CD1 3.43Å; P586-W1186 HydrophobicContact CB-CD2 4.24Å; P586-W1186 HydrophobicContact CB-CG 4.25Å; P586-W1186 HydrophobicContact CB-CZ2 4.44Å; W1065-W1186 HydrophobicContact CH2-CB 4.14Å; W1065-W1186 AromaticContact CH2-CD1 3.82Å; W1065-W1186 AromaticContact CH2-CD2 3.8Å; W1065-W1186 HydrophobicContact CH2-CD2 3.8Å; W1065-W1186 HydrophobicContact CH2-CE3 4.4Å; W1065-W1186 AromaticContact CH2-CG 3.65Å; W1065-W1186 HydrophobicContact CH2-CG 3.65Å; W1065-W1186 AromaticContact CZ3-CD2 3.8Å; W1065-W1186 HydrophobicContact CZ3-CD2 3.8Å; W1065-W1186 AromaticContact CZ3-CE2 3.96Å; W1065-W1186 HydrophobicContact CZ3-CE3 4.05Å; W1065-W1186 HydrophobicContact CZ3-CG 4.18Å; W1065-W1186 HydrophobicContact CZ3-CZ2 4.38Å; W1065-W1186 HydrophobicContact CZ3-CZ3 4.46Å; I1073-W1186 HydrophobicContact CD1-CH2 3.7Å; I1073-W1186 HydrophobicContact CD1-CZ3 4.48Å; I1073-W1186 HydrophobicContact CG2-CH2 4.12Å; I1073-W1186 HydrophobicContact CG2-CZ2 4.44Å; L1131-W1186 CarbonylContact C-O 3.32Å; L1131-W1186 VanDerWaalsContact CA-O 3.29Å; L1131-W1186 WeakPolarHBondContact CA-O 3.47Å; I1132-W1186 HydrophobicContact CB-CB 4.44Å; I1132-W1186 HydrophobicContact CB-CE3 4.25Å; I1132-W1186 HydrophobicContact CG2-CE3 3.86Å; I1132-W1186 HydrophobicContact CG2-CZ3 4.32Å; I1132-W1186 PolarHBondContact N-O 3.16Å; I1132-W1186 PolarHBondContact O-N 3.49Å; I1184-W1186 HydrophobicContact CB-CH2 3.67Å; I1184-W1186 HydrophobicContact CB-CZ2 4.36Å; I1184-W1186 HydrophobicContact CB-CZ3 3.89Å; I1184-W1186 HydrophobicContact CD1-CH2 4.32Å; I1184-W1186 HydrophobicContact CG2-CD2 4.49Å; I1184-W1186 HydrophobicContact CG2-CE3 4.34Å; I1184-W1186 HydrophobicContact CG2-CH2 3.36Å; I1184-W1186 HydrophobicContact CG2-CZ2 3.55Å; I1184-W1186 HydrophobicContact CG2-CZ3 3.8Å; I1184-W1186 WeakPolarHBondContact O-CZ3 3.33Å
1187	R	74.4	Confident	62.3	Low	111 Å²	111	61.5 Å²	61.5	42%	0.419	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	122.1	165.5	-172.3	-176.1	-63.2	143.1	3.7	109.2	I587 Y1130 L1131 T1189	I587-R1187 HydrophobicContact CD1-CB 3.49Å; I587-R1187 VanDerWaalsContact CD1-CB 3.49Å; I587-R1187 HydrophobicContact CG1-CB 4.26Å; Y1130-R1187 CarbonylContact O-C 3.56Å; Y1130-R1187 WeakPolarHBondContact O-CA 3.5Å; L1131-R1187 HydrophobicContact CD2-CB 3.83Å; L1131-R1187 HydrophobicContact CD2-CG 3.92Å; R1187-T1189 HydrophobicContact CG-CG2 4.42Å
1188	L	69.7	Low	62.9	Low	25 Å²	25	56.8 Å²	56.8	13%	0.131	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	101.7	165.2	-62.9	153.7	0	0	0	106.7	I1056 T1059 N1129 Y1130 I1132	I1056-L1188 HydrophobicContact CD1-CD1 3.44Å; I1056-L1188 VanDerWaalsContact CD1-CD1 3.44Å; I1056-L1188 HydrophobicContact CD1-CD2 3.97Å; I1056-L1188 HydrophobicContact CD1-CG 4.36Å; I1056-L1188 HydrophobicContact CG1-CD1 3.82Å; I1056-L1188 HydrophobicContact CG2-CD1 4.1Å; T1059-L1188 HydrophobicContact CG2-CD2 4.49Å; N1129-L1188 WeakPolarHBondContact CA-O 3.44Å; Y1130-L1188 PolarHBondContact N-O 3.25Å; Y1130-L1188 PolarHBondContact O-N 3Å; I1132-L1188 HydrophobicContact CD1-CD1 3.76Å; I1132-L1188 HydrophobicContact CG1-CD1 3.85Å
1189	T	60.1	Low	63.4	Low	87 Å²	87	57.9 Å²	57.9	53%	0.534	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	132.5	159.8	48.5	0	0	0	0	107.7	N1129 R1187 L1191	N1129-T1189 WeakPolarHBondContact OD1-CG2 3.21Å; R1187-T1189 HydrophobicContact CG-CG2 4.42Å; T1189-L1191 PolarHBondContact O-N 2.95Å; T1189-L1191 VanDerWaalsContact O-N 3.16Å
1190	N	51.5	Low	63.5	Low	57 Å²	57	56.7 Å²	56.7	31%	0.305	30%	0.298	S	S	.	.			trans	-59.9	120.3	171.2	-99.6	4.7	0	0	0	110.2	S1192	N1190-S1192 PolarHBondContact O-N 3.31Å
1191	L	38.6	Very low	63.2	Low	144 Å²	144	59.8 Å²	59.8	75%	0.754	31%	0.308	S	S	*	.			trans	-79.9	55.9	162.9	-79.1	163.7	0	0	0	109.1	T1189 H1193	T1189-L1191 PolarHBondContact O-N 2.95Å; T1189-L1191 VanDerWaalsContact O-N 3.16Å; L1191-H1193 PolarHBondContact O-N 2.94Å; L1191-H1193 VanDerWaalsContact O-N 3.16Å
1192	S	33	Very low	62.2	Low	84 Å²	84	64.4 Å²	64.4	59%	0.587	33%	0.33	S	S	*	.			trans	-82.2	84.6	173	51.9	0	0	0	0	109.4	N1190	N1190-S1192 PolarHBondContact O-N 3.31Å
1193	H	25.9	Very low	60.8	Low	252 Å²	252	69.9 Å²	69.9	100%	1.167	36%	0.359	S	S	*	.			trans	-90.5	0	152.6	-91.2	-62.7	0	0	0	109.3	L1191	L1191-H1193 PolarHBondContact O-N 2.94Å; L1191-H1193 VanDerWaalsContact O-N 3.16Å

Retrieved 1,193 of 1,193 residues in 287.9 ms (Link to these results)

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