A0A5K4FE30_SCHMA Loading...

Membrane associated guanylate kinase inverted related

AlphaFold DB , UniProt , Accession A0A5K4FE30, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,142 aa.

						>A0A5K4FE30_SCHMA|A0A5K4FE30
MSKHYTTNDIISEKAISMGETNQDNIQGNGKVCPITTYTIHSNICPDKLLNTSPVYSVTNVIHELNPSSSVPSSKTIVKTSICSSGTSNGKINLSTISNYNTNSATNVTIPSCTKQRGNIISTNVGNSKNIDQSAYIIPSQNNCIPFYTLQKNSFYKPAYRPQLSLSCQPSPNISYNRTFSNDINNDLVSQSRGNGLQNSINVTETLKYPSENIDSSSLSLKHRPKNSFQSLDERSSFKLKSHQFFHRFLKYSSKFGGITKSENNSPSLLSSSTSPIHRNPQPLKNTYASRYCAWNPMISSSSVKLIDTCLIKKPSGFGLTLSGVITFIPNGILDVNIMSNLSDRQKGFFQRLLQIRSVSDDVITYNNDLVQSLGKNNSIRPGDILLAAGGCRLAGCTPEYAVQLLAKVPVGSAVQVTLLRGLGIPGIYSVTEDHNYTKHFNKPRSFSSCSSMSSSSELSPKRINSDFESQNGSKCVRSYMEHFCSNCCNSLRTVKLVKKENEYGFTYFYTNYGCLVNQVTRNNINQLNKTKLQPGDLIVKIGHFDVVKLTKTQFSQLLSVYLKSESIQFTVIHVCSTCLKQVNHANIHLNSKKSTNHYLDLNKTTSTPTTPTIRETNKAEMISFLRTVLNANCHGKKSTNHNLQTNDKHSSSNTSELNNVNNLLMKRKPESWLPVQCITPGIGKSGPCETPDFVPISQFINTLKTNNHQINDSSHLNNIPQYDYQKFDVFKQNQIKEQQRQQSIVNDKHCDNSLLDQISSPYLSPIIQMKNSHNLMLNIPEISTSNTNYNNFTEDVKIRYSTKDGKLKFVKENIEQNLLCIIPIEDNGNSSESSQNLVVGDLLVAIENHSVLSCKPSEIEELLRLAAKNNNGYVTLTVRRIHPLDEAECMKISEVPAKDSNSSNIINVKLLKEKDEGFGFVIVSSLNKEKASEIGRIIPGSPADKCGQLKVGQRIMAINGYCLLGINHMDIVNLIRQSQQQLILTIEKTGFLSNKQHNIHINSLDTDENFIPPATSTMICSNATECVHPTNGSKTSEPSLNNTSTRSLYSITLQRGPNGFGFSVRSGFDSNTSPLIVYRIAENGPAFQEGQMKVGDEILEINGISTLTMTHQQAVTLIRSSGSTLRIILQRFNENQNEYSF
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30	Very low	29.8	Very low	237 Å²	237	145.5 Å²	145.5	100%	1.167	75%	0.748	S	S	*	*				0	136.3	0	-58.1	168.3	86.3	0	0	106.9
2	S	26.1	Very low	29.6	Very low	104 Å²	104	141.8 Å²	141.8	73%	0.727	75%	0.745	S	S	*	*			cis	-167.6	145	-15	-73.4	0	0	0	0	105
3	K	28.8	Very low	29.7	Very low	157 Å²	157	145.8 Å²	145.8	68%	0.683	76%	0.757	S	S	*	*			cis	-168.7	159.2	6.3	-128.9	178.3	168	-167.7	0	107.9
4	H	32.6	Very low	29.6	Very low	148 Å²	148	149.4 Å²	149.4	69%	0.685	76%	0.764	S	S	*	*			trans	64.9	144.9	150.5	-64.1	-23.3	0	0	0	119.5
5	Y	31.7	Very low	29.5	Very low	171 Å²	171	145.1 Å²	145.1	67%	0.671	76%	0.76	S	S	*	*			cis	-143.9	140.2	-12.8	-77.3	-65.9	0	0	0	104.8
6	T	30.3	Very low	29.5	Very low	111 Å²	111	146.8 Å²	146.8	68%	0.681	77%	0.767	S	S	*	*				57.3	134.7	59	70.2	0	0	0	0	113.7
7	T	28.2	Very low	29.4	Very low	112 Å²	112	144.1 Å²	144.1	69%	0.687	76%	0.764	S	S	*	*			cis	-172.3	162	3	11.9	0	0	0	0	109.7
8	N	30	Very low	29.4	Very low	133 Å²	133	146.7 Å²	146.7	71%	0.711	77%	0.774	S	S	*	*			trans	65.5	165.4	147.3	-73.9	38.2	0	0	0	119.1
9	D	31.4	Very low	29.5	Very low	119 Å²	119	143 Å²	143	64%	0.636	78%	0.775	S	S	*	*			cis	-135.5	144	0.4	-95.7	-42.1	0	0	0	109.8
10	I	26.5	Very low	29.5	Very low	142 Å²	142	144.9 Å²	144.9	73%	0.728	78%	0.778	S	S	*	*				52.9	115.8	94.3	-47.9	178.8	0	0	0	116.1
11	I	31.9	Very low	29.4	Very low	166 Å²	166	142.8 Å²	142.8	85%	0.851	77%	0.771	S	S	*	*				-174	143.3	121.6	-93.6	163.2	0	0	0	109.2
12	S	27.3	Very low	29.5	Very low	101 Å²	101	138 Å²	138	71%	0.706	75%	0.75	S	S	*	*			trans	-119	154	178.1	59.2	0	0	0	0	110.6
13	E	31.4	Very low	29.6	Very low	194 Å²	194	140.1 Å²	140.1	91%	0.907	75%	0.748	S	S	*	*			trans	-158.7	167.9	136	-121.5	171.2	-176.4	0	0	117.2
14	K	28.8	Very low	29.7	Very low	196 Å²	196	138.8 Å²	138.8	85%	0.852	75%	0.749	S	S	*	*			trans	-93.2	171.2	178.3	-82.2	174.5	179.3	172	0	109.5
15	A	27.2	Very low	29.4	Very low	85 Å²	85	138.6 Å²	138.6	70%	0.702	75%	0.752	S	S	*	*			cis	-173.6	-138	-20.9	0	0	0	0	0	106.9
16	I	30.3	Very low	29.5	Very low	172 Å²	172	138.5 Å²	138.5	88%	0.882	76%	0.762	S	S	*	*			trans	89.3	138.3	167.6	-53	177.1	0	0	0	115.3
17	S	27.5	Very low	29.3	Very low	101 Å²	101	142.4 Å²	142.4	71%	0.706	77%	0.772	S	S	*	*			trans	-117.9	164	-172.7	52.3	0	0	0	0	111.8
18	M	28.8	Very low	29.5	Very low	191 Å²	191	140.8 Å²	140.8	94%	0.941	78%	0.778	S	S	*	*			trans	157.5	158.4	131.9	-83.4	-156.5	-58.3	0	0	109.3
19	G	31.4	Very low	29.5	Very low	77 Å²	77	143.1 Å²	143.1	79%	0.794	79%	0.79	S	S	*	*			trans	138	74.4	171.6	0	0	0	0	0	116.1
20	E	29.3	Very low	29.4	Very low	181 Å²	181	140.7 Å²	140.7	85%	0.846	79%	0.793	S	S	*	*			trans	-58	165.8	150	-69	176.2	161.9	0	0	111.2
21	T	28	Very low	29.4	Very low	101 Å²	101	143.5 Å²	143.5	62%	0.62	80%	0.8	S	S	*	*			cis	-165.6	180	-9.4	27.4	0	0	0	0	107.7
22	N	31.2	Very low	29.3	Very low	136 Å²	136	141.9 Å²	141.9	73%	0.727	80%	0.798	S	S	*	*			trans	71.1	161.4	157.4	-57.2	-26	0	0	0	117.8
23	Q	28.6	Very low	29.1	Very low	149 Å²	149	142.5 Å²	142.5	70%	0.696	80%	0.801	S	S	*	*			cis	-162.8	173.4	-44.1	-149.9	-178.2	-66.8	0	0	107.9
24	D	31.6	Very low	28.9	Very low	129 Å²	129	139.3 Å²	139.3	69%	0.69	80%	0.796	S	S	*	*			trans	75.7	167.2	157.8	-62.6	-26.2	0	0	0	120.4
25	N	26.9	Very low	28.8	Very low	143 Å²	143	137.1 Å²	137.1	77%	0.765	79%	0.792	S	S	*	*			trans	-104.7	163.7	-156.3	-56.9	-92.6	0	0	0	111.8
26	I	31.8	Very low	28.8	Very low	169 Å²	169	139.6 Å²	139.6	87%	0.867	80%	0.799	S	S	*	*				-174.2	154.4	123.4	-97.2	153.9	0	0	0	110.7
27	Q	28	Very low	28.5	Very low	194 Å²	194	136.8 Å²	136.8	91%	0.907	79%	0.79	S	S	*	*			trans	-76.4	140.4	178.9	-61.6	163	-60.6	0	0	111.8
28	G	32.3	Very low	28.5	Very low	77 Å²	77	143.2 Å²	143.2	79%	0.794	80%	0.8	S	S	*	*			trans	-159.2	125.1	172.7	0	0	0	0	0	112.7
29	N	28.6	Very low	28.2	Very low	183 Å²	183	139.7 Å²	139.7	98%	0.979	79%	0.79	S	S	*	*			trans	-80.8	137.2	175.8	-78.6	-47.3	0	0	0	111.3
30	G	29	Very low	28	Very low	67 Å²	67	143.2 Å²	143.2	69%	0.691	79%	0.789	S	S	*	*			trans	149.3	118.2	146.4	0	0	0	0	0	119.1
31	K	28.2	Very low	27.9	Very low	202 Å²	202	142.9 Å²	142.9	88%	0.878	79%	0.787	S	S	*	*			trans	67.8	119.2	139.9	-68.2	-178.9	177.6	176.7	0	120.9
32	V	28.9	Very low	27.8	Very low	132 Å²	132	142 Å²	142	80%	0.8	79%	0.785	S	S	*	*			trans	74.6	109.6	130.7	179.8	0	0	0	0	118.1
33	C	23.3	Very low	27.6	Very low	114 Å²	114	143.5 Å²	143.5	77%	0.77	79%	0.793	S	S	*	*			trans	-74.7	157.5	158.9	-41.1	0	0	0	0	111.3
34	P	28.1	Very low	27.4	Very low	126 Å²	126	143.5 Å²	143.5	82%	0.818	80%	0.796	S	S	*	*			trans	-109.1	158.9	136.8	34.2	-30.6	0	0	0	111.7
35	I	24.8	Very low	27.2	Very low	150 Å²	150	143.4 Å²	143.4	77%	0.769	80%	0.804	S	S	*	*			trans	-94.1	137	-178.4	-63.9	161	0	0	0	109.5	T37	I35-T37 HydrophobicContact CG2-CG2 4.19Å
36	T	28.2	Very low	27.4	Very low	137 Å²	137	142 Å²	142	84%	0.84	80%	0.803	S	S	*	*			trans	-111	115.6	158.9	35.2	0	0	0	0	110.1
37	T	24.6	Very low	27.3	Very low	113 Å²	113	139.4 Å²	139.4	69%	0.693	79%	0.791	S	S	*	*			trans	-81	137.5	178.9	42	0	0	0	0	112.2	I35	I35-T37 HydrophobicContact CG2-CG2 4.19Å
38	Y	26.6	Very low	27.4	Very low	236 Å²	236	137.6 Å²	137.6	93%	0.925	78%	0.78	S	S	*	*			trans	-118.3	116.9	150.1	-85.9	-86.4	0	0	0	109.4
39	T	23.2	Very low	27	Very low	118 Å²	118	141.3 Å²	141.3	72%	0.724	78%	0.781	S	S	*	*			trans	-92.3	-169.5	168.6	18	0	0	0	0	109.8
40	I	26.2	Very low	26.9	Very low	151 Å²	151	139.9 Å²	139.9	77%	0.774	77%	0.773	S	S	*	*			trans	82.5	126.8	170.9	-49	173.3	0	0	0	112.5
41	H	28.1	Very low	26.9	Very low	173 Å²	173	142.7 Å²	142.7	80%	0.801	77%	0.771	S	S	*	*			cis	-136.2	155.4	-5.2	-130.6	-53.1	0	0	0	111.6
42	S	25.1	Very low	26.9	Very low	82 Å²	82	138.3 Å²	138.3	57%	0.573	76%	0.762	S	S	*	*			trans	-80.7	154.6	172.2	53.7	0	0	0	0	114
43	N	27.9	Very low	26.6	Very low	168 Å²	168	136.9 Å²	136.9	90%	0.898	76%	0.758	S	S	*	*			trans	-149.7	146.2	134.7	-107.4	-23	0	0	0	111.8
44	I	25	Very low	26.9	Very low	149 Å²	149	137.7 Å²	137.7	76%	0.764	76%	0.762	S	S	*	*			trans	-136.3	137.1	-170	-64.1	170.6	0	0	0	108.4
45	C	26.3	Very low	26.9	Very low	127 Å²	127	137.5 Å²	137.5	86%	0.858	76%	0.758	S	S	*	*			trans	-164.7	141.4	142.9	-113.8	0	0	0	0	112
46	P	31.8	Very low	26.9	Very low	113 Å²	113	140.8 Å²	140.8	73%	0.734	76%	0.762	S	S	*	*			trans	-96.9	165.6	174.9	38.7	-34.4	0	0	0	112.2
47	D	28.5	Very low	26.9	Very low	115 Å²	115	139.6 Å²	139.6	62%	0.615	76%	0.759	S	S	*	*				-172.1	168.7	125.3	-141.2	-10.2	0	0	0	116.2	K685	D47-K685 PolarHBondContact O-NZ 2.85Å
48	K	30.4	Very low	26.9	Very low	157 Å²	157	139.7 Å²	139.7	68%	0.683	76%	0.76	S	S	*	*			trans	76.7	122.5	153.6	-76.4	160.1	-170	172.1	0	121	K685	K48-K685 PolarHBondContact O-NZ 3.02Å
49	L	24.4	Very low	27	Very low	155 Å²	155	134.9 Å²	134.9	81%	0.812	76%	0.755	S	S	*	*			trans	-89.3	-167	177.7	-67.9	129.6	0	0	0	112.5
50	L	27	Very low	27	Very low	153 Å²	153	137 Å²	137	80%	0.801	76%	0.762	S	S	*	*			trans	81.8	136.9	172.3	-50.9	159.5	0	0	0	113.6
51	N	28	Very low	27.1	Very low	125 Å²	125	135.9 Å²	135.9	67%	0.668	76%	0.762	S	S	*	*			cis	-153.1	153.3	-0.4	-127.5	-7.6	0	0	0	113.8
52	T	28.4	Very low	27	Very low	110 Å²	110	134 Å²	134	68%	0.675	76%	0.756	S	S	*	*			trans	25.4	121.8	154.3	56.4	0	0	0	0	120.1
53	S	23	Very low	27.1	Very low	102 Å²	102	137.3 Å²	137.3	71%	0.713	76%	0.762	S	S	*	*			cis	64.4	116	46.8	-47.7	0	0	0	0	116.3
54	P	30	Very low	27.1	Very low	132 Å²	132	137 Å²	137	86%	0.857	76%	0.756	S	S	*	*			trans	-91.3	129.2	150.9	33.5	-27.9	0	0	0	110.3
55	V	28.1	Very low	27.3	Very low	121 Å²	121	136.7 Å²	136.7	73%	0.733	76%	0.755	S	S	*	*			trans	-93	138.7	-174.8	172.8	0	0	0	0	111.3	S57	V55-S57 PolarHBondContact O-N 3.09Å
56	Y	25.1	Very low	27.3	Very low	220 Å²	220	137.7 Å²	137.7	86%	0.863	75%	0.751	S	S	*	*			trans	-74.9	107.5	162.2	-91.1	-92.5	0	0	0	109.6
57	S	27	Very low	27.4	Very low	112 Å²	112	137 Å²	137	78%	0.783	75%	0.747	S	S	*	*			trans	-95.4	105.7	171	44.6	0	0	0	0	110.9	V55	V55-S57 PolarHBondContact O-N 3.09Å
58	V	24.9	Very low	27.5	Very low	115 Å²	115	137.1 Å²	137.1	70%	0.697	76%	0.757	S	S	*	*			trans	-135.6	91.6	170.1	-177	0	0	0	0	109.8
59	T	27.8	Very low	27.5	Very low	134 Å²	134	134.4 Å²	134.4	82%	0.822	76%	0.757	S	S	*	*			trans	-168.6	121.6	146.1	22.2	0	0	0	0	109.1
60	N	25.1	Very low	27.8	Very low	162 Å²	162	131.7 Å²	131.7	87%	0.866	75%	0.752	S	S	*	*			trans	-139.6	78.9	160.4	-131.7	15.4	0	0	0	107.4
61	V	28.2	Very low	28	Very low	128 Å²	128	130.8 Å²	130.8	78%	0.776	75%	0.752	S	S	*	*			trans	-135.2	133	165.6	-178.3	0	0	0	0	105.8
62	I	25.3	Very low	28	Very low	135 Å²	135	130.5 Å²	130.5	69%	0.692	76%	0.757	S	S	*	*			trans	-110.7	159.1	-172.7	-42.1	176.1	0	0	0	107.5
63	H	27.7	Very low	27.9	Very low	151 Å²	151	130.7 Å²	130.7	70%	0.699	76%	0.763	S	S	*	*			trans	72	148.9	-177.7	-61.3	-109.1	0	0	0	114
64	E	27.2	Very low	28.2	Very low	162 Å²	162	130.5 Å²	130.5	76%	0.757	76%	0.762	S	S	*	*			cis	-140.8	174.4	6.7	-152	129	-120.8	0	0	114.6
65	L	28.2	Very low	28.2	Very low	142 Å²	142	133.7 Å²	133.7	74%	0.743	76%	0.762	S	S	*	*			trans	-72.2	131.1	-168.1	-76.2	154.5	0	0	0	115.7
66	N	27.4	Very low	28.2	Very low	147 Å²	147	133.4 Å²	133.4	79%	0.786	76%	0.761	S	S	*	*				57.4	-179.7	121.6	-107.1	-8.7	0	0	0	119.8
67	P	33.9	Very low	28.2	Very low	98 Å²	98	129.8 Å²	129.8	64%	0.636	76%	0.755	S	S	*	*			cis	-129.8	-160.9	-21.5	36.8	-17.7	0	0	0	113
68	S	30	Very low	28.2	Very low	118 Å²	118	130.2 Å²	130.2	83%	0.825	75%	0.752	S	S	*	*			trans	79.7	144.9	166.3	83.2	0	0	0	0	116.4
69	S	30.8	Very low	28.3	Very low	100 Å²	100	133.5 Å²	133.5	70%	0.699	76%	0.757	S	S	*	*			cis	-141.6	126.5	1.6	55.1	0	0	0	0	109.9
70	S	30.7	Very low	28.2	Very low	99 Å²	99	132.7 Å²	132.7	69%	0.692	75%	0.752	S	S	*	*				62.6	116.3	106.4	84.7	0	0	0	0	115.5
71	V	30.7	Very low	28.5	Very low	133 Å²	133	130.4 Å²	130.4	81%	0.806	75%	0.749	S	S	*	*				109.2	144.6	87.7	140.9	0	0	0	0	111.2
72	P	29.6	Very low	28.5	Very low	119 Å²	119	131.7 Å²	131.7	77%	0.773	75%	0.75	S	S	*	*			cis	-132.6	-157.8	-20.8	38.6	-18.7	0	0	0	113.6
73	S	26	Very low	28.6	Very low	115 Å²	115	130.8 Å²	130.8	80%	0.804	75%	0.754	S	S	*	*			trans	-104.1	165.8	-178.2	54.5	0	0	0	0	115
74	S	29.3	Very low	28.8	Very low	98 Å²	98	128.3 Å²	128.3	69%	0.685	75%	0.754	S	S	*	*			trans	-157.5	121.4	153.7	55.6	0	0	0	0	110.9
75	K	29.3	Very low	29	Very low	199 Å²	199	126.1 Å²	126.1	87%	0.865	76%	0.757	S	S	*	*				70	135.5	107.9	-61.5	177	-178.5	179.6	0	114.4
76	T	28.6	Very low	29.2	Very low	114 Å²	114	122.3 Å²	122.3	70%	0.699	75%	0.752	S	S	*	*			cis	-149.5	134.5	17.2	-39.6	0	0	0	0	109.5
77	I	25.4	Very low	29.4	Very low	145 Å²	145	122.1 Å²	122.1	74%	0.744	76%	0.756	S	S	*	*				31	140	100.5	-7.2	172	0	0	0	114.9
78	V	25.8	Very low	29.3	Very low	120 Å²	120	121.5 Å²	121.5	73%	0.727	75%	0.754	S	S	*	*			cis	-143.1	-161.6	21.1	-136.5	0	0	0	0	110	T80	V78-T80 HydrophobicContact CG1-CG2 4.32Å
79	K	26.6	Very low	29.4	Very low	185 Å²	185	123.8 Å²	123.8	80%	0.804	76%	0.757	S	S	*	*			cis	-152	117.7	10.9	-122.6	-176.4	-179.6	175.2	0	107.9
80	T	27.1	Very low	29.4	Very low	116 Å²	116	122 Å²	122	71%	0.712	76%	0.755	S	S	*	*				79.2	111.2	93.7	60.9	0	0	0	0	119.9	V78	V78-T80 HydrophobicContact CG1-CG2 4.32Å
81	S	30.2	Very low	29.4	Very low	115 Å²	115	126.9 Å²	126.9	80%	0.804	76%	0.764	S	S	*	*				170	145.5	129.2	54.8	0	0	0	0	111.4
82	I	28.8	Very low	29.2	Very low	154 Å²	154	127.2 Å²	127.2	79%	0.79	76%	0.759	S	S	*	*			cis	-163	145.1	-23.1	-119.8	160.3	0	0	0	108.5
83	C	27.9	Very low	29.1	Very low	116 Å²	116	127.8 Å²	127.8	78%	0.784	76%	0.756	S	S	*	*			trans	59.8	150.4	167.7	-69.1	0	0	0	0	119.5
84	S	31	Very low	29.1	Very low	99 Å²	99	129.8 Å²	129.8	69%	0.692	76%	0.757	S	S	*	*			cis	-154.6	159	-10.3	-107.8	0	0	0	0	113.2
85	S	31.7	Very low	29	Very low	117 Å²	117	130 Å²	130	82%	0.818	76%	0.759	S	S	*	*			trans	-6.3	144	164.1	55.1	0	0	0	0	121.2
86	G	31.9	Very low	28.9	Very low	62 Å²	62	126.5 Å²	126.5	64%	0.639	75%	0.754	S	S	*	*			cis	151.3	179	-3.7	0	0	0	0	0	114.6
87	T	31.4	Very low	28.8	Very low	142 Å²	142	128 Å²	128	87%	0.871	76%	0.756	S	S	*	*			trans	60.6	142.8	162	51.5	0	0	0	0	119.8
88	S	32.5	Very low	28.8	Very low	86 Å²	86	125.3 Å²	125.3	60%	0.601	75%	0.75	S	S	*	*			cis	-173	144.7	-15.3	51.6	0	0	0	0	111.6
89	N	32	Very low	28.8	Very low	165 Å²	165	125.8 Å²	125.8	88%	0.882	75%	0.748	S	S	*	*			trans	61.5	148.6	155	-52.8	-27.2	0	0	0	118.6
90	G	30.9	Very low	28.8	Very low	64 Å²	64	126.1 Å²	126.1	66%	0.66	75%	0.746	S	S	*	*			cis	142.7	147.2	-11.3	0	0	0	0	0	113.5
91	K	30.4	Very low	28.8	Very low	201 Å²	201	126.4 Å²	126.4	87%	0.874	74%	0.743	S	S	*	*			trans	66.8	153.8	168.2	-62.3	-172.2	179	178.3	0	115.7
92	I	26.3	Very low	28.6	Very low	139 Å²	139	126.1 Å²	126.1	71%	0.713	74%	0.737	S	S	*	*			cis	173	158.2	-27.4	-108.2	167.9	0	0	0	104.2
93	N	28.4	Very low	28.6	Very low	132 Å²	132	126 Å²	126	71%	0.706	74%	0.738	S	S	*	*			trans	73.2	110.8	166.3	-76	-6	0	0	0	120.7
94	L	25.6	Very low	28.6	Very low	156 Å²	156	125.9 Å²	125.9	82%	0.817	74%	0.738	S	S	*	*				56.9	159	111.3	-89.7	95.8	0	0	0	122.7
95	S	28	Very low	28.5	Very low	104 Å²	104	124.6 Å²	124.6	73%	0.727	73%	0.734	S	S	*	*			trans	72.3	102.5	172.3	63.1	0	0	0	0	116.4
96	T	25.6	Very low	28.4	Very low	124 Å²	124	125.3 Å²	125.3	76%	0.761	73%	0.733	S	S	*	*				89.3	149.5	79.6	-11.1	0	0	0	0	113.2
97	I	26.6	Very low	28.2	Very low	145 Å²	145	128.9 Å²	128.9	74%	0.744	74%	0.738	S	S	*	*			trans	65.8	82.9	159.3	-62.3	155.6	0	0	0	115.7
98	S	26.3	Very low	28.1	Very low	89 Å²	89	127.3 Å²	127.3	62%	0.622	73%	0.727	S	S	*	*				76.2	149.5	125.3	83.5	0	0	0	0	122
99	N	26.2	Very low	27.9	Very low	130 Å²	130	128.6 Å²	128.6	70%	0.695	73%	0.732	S	S	*	*			trans	73.1	120.5	136.7	-71	-12.1	0	0	0	122.5
100	Y	26.2	Very low	27.7	Very low	192 Å²	192	127.8 Å²	127.8	75%	0.753	73%	0.726	S	S	*	*			trans	86.8	131.2	135.5	-78.4	-138.1	0	0	0	119.8
101	N	27.2	Very low	27.7	Very low	123 Å²	123	129.5 Å²	129.5	66%	0.658	73%	0.725	S	S	*	*			trans	53.1	108	139.8	-59.3	-4.2	0	0	0	118.9
102	T	25.6	Very low	27.6	Very low	108 Å²	108	124.8 Å²	124.8	66%	0.663	72%	0.718	S	S	*	*				65.5	142.1	69	69.5	0	0	0	0	115.3
103	N	28.2	Very low	27.7	Very low	153 Å²	153	123.3 Å²	123.3	82%	0.818	72%	0.719	S	S	*	*			trans	77.3	155.8	174.1	-53.2	-16.5	0	0	0	113.4
104	S	27.9	Very low	27.6	Very low	112 Å²	112	122.3 Å²	122.3	78%	0.783	72%	0.718	S	S	*	*			cis	-163.9	-176.3	-18.5	50.4	0	0	0	0	107.1
105	A	29.2	Very low	27.7	Very low	73 Å²	73	124.3 Å²	124.3	60%	0.603	72%	0.72	S	S	*	*			cis	-151.3	175.8	9.8	0	0	0	0	0	111.7
106	T	29.8	Very low	27.8	Very low	132 Å²	132	127.9 Å²	127.9	81%	0.81	73%	0.725	S	S	*	*			trans	67	162.4	-179.8	85.8	0	0	0	0	112.8
107	N	28.6	Very low	27.8	Very low	137 Å²	137	134 Å²	134	73%	0.733	73%	0.734	S	S	*	*			cis	-152.9	167.1	-12.5	-130.5	0.3	0	0	0	107.4
108	V	28.3	Very low	27.9	Very low	108 Å²	108	130.5 Å²	130.5	66%	0.655	73%	0.734	S	S	*	*	S	Bend	cis	-131	121.8	8.3	167.7	0	0	0	0	108.1
109	T	28.5	Very low	27.9	Very low	113 Å²	113	133.6 Å²	133.6	69%	0.693	74%	0.743	S	S	*	*			trans	46.4	147.1	158	63.6	0	0	0	0	121.2
110	I	28.5	Very low	27.9	Very low	148 Å²	148	133.8 Å²	133.8	76%	0.759	74%	0.743	S	S	*	*			cis	-175.6	153.5	-7	-109.6	165.3	0	0	0	105.7
111	P	29.5	Very low	28	Very low	100 Å²	100	132.3 Å²	132.3	65%	0.649	75%	0.746	S	S	*	*			cis	-135.9	169.5	-26	41.1	-24.3	0	0	0	115
112	S	28.7	Very low	27.9	Very low	103 Å²	103	130.9 Å²	130.9	72%	0.72	75%	0.746	S	S	*	*			trans	48.6	151.7	142	62.3	0	0	0	0	123.9
113	C	27.8	Very low	28	Very low	108 Å²	108	132.5 Å²	132.5	73%	0.73	76%	0.756	S	S	*	*			cis	-168.7	114.9	-15.6	-98.7	0	0	0	0	107.4
114	T	28	Very low	27.9	Very low	111 Å²	111	132.5 Å²	132.5	68%	0.681	76%	0.756	S	S	*	*				67.5	113.3	86.3	63.4	0	0	0	0	119.8
115	K	27.4	Very low	27.8	Very low	198 Å²	198	134.1 Å²	134.1	86%	0.861	76%	0.761	S	S	*	*			trans	66.4	153.2	149.9	-53.9	171.5	179.6	174.6	0	116.2
116	Q	29.7	Very low	27.9	Very low	179 Å²	179	134.2 Å²	134.2	84%	0.836	77%	0.769	S	S	*	*			cis	-141.4	147.9	23	-63.8	177.3	8.6	0	0	110
117	R	25.7	Very low	27.8	Very low	252 Å²	252	135.1 Å²	135.1	95%	0.951	77%	0.769	S	S	*	*				58.5	106.3	86.1	-133.8	-174	-163	-165.1	5.3	115.4
118	G	29.2	Very low	27.7	Very low	71 Å²	71	133.2 Å²	133.2	73%	0.732	77%	0.766	S	S	*	*			trans	143	104.9	-177.9	0	0	0	0	0	107.7
119	N	26.4	Very low	27.8	Very low	155 Å²	155	137.6 Å²	137.6	83%	0.829	78%	0.776	S	S	*	*				75.4	137.1	54	-151.3	32	0	0	0	112.9
120	I	26.6	Very low	27.7	Very low	134 Å²	134	139.5 Å²	139.5	69%	0.687	78%	0.782	S	S	*	*			trans	82.6	110.6	165.4	-62.6	170.2	0	0	0	118.7
121	I	27.8	Very low	27.8	Very low	160 Å²	160	140.5 Å²	140.5	82%	0.821	79%	0.788	S	S	*	*			trans	76	142.1	145.4	-67.4	172	0	0	0	120.9
122	S	24.2	Very low	27.6	Very low	93 Å²	93	142.3 Å²	142.3	65%	0.65	79%	0.792	S	S	*	*			trans	-79.2	157	177	54	0	0	0	0	115.1
123	T	28.9	Very low	27.6	Very low	142 Å²	142	146.9 Å²	146.9	87%	0.871	80%	0.802	S	S	*	*				-166.1	169.8	119.4	20	0	0	0	0	112.4
124	N	25.4	Very low	27.4	Very low	154 Å²	154	147.1 Å²	147.1	82%	0.824	80%	0.804	S	S	*	*			trans	-98.4	-179.2	-173.7	-73.9	-27.4	0	0	0	113.6
125	V	26.9	Very low	27.4	Very low	145 Å²	145	146.7 Å²	146.7	88%	0.879	81%	0.812	S	S	*	*			trans	90.3	127.3	156.6	-168.1	0	0	0	0	116.4
126	G	29.9	Very low	27.1	Very low	75 Å²	75	147.7 Å²	147.7	77%	0.773	81%	0.812	S	S	*	*			trans	174.4	77.3	177.4	0	0	0	0	0	115.4
127	N	28.9	Very low	26.9	Very low	151 Å²	151	147 Å²	147	81%	0.807	81%	0.813	S	S	*	*			trans	-40.8	164.5	164.3	-68	-17.6	0	0	0	115.5
128	S	25.9	Very low	26.8	Very low	97 Å²	97	141.6 Å²	141.6	68%	0.678	80%	0.801	S	S	*	*			cis	-179.6	163.1	-19	59.6	0	0	0	0	108.3
129	K	30.8	Very low	26.7	Very low	201 Å²	201	144 Å²	144	87%	0.874	80%	0.804	S	S	*	*			trans	172.1	132.2	142.6	-97.8	156.8	-174.8	178	0	112.5
130	N	26.4	Very low	26.7	Very low	153 Å²	153	141.3 Å²	141.3	82%	0.818	80%	0.797	S	S	*	*			trans	-85.9	161.9	160.8	-63.2	-11.1	0	0	0	109.8
131	I	29.7	Very low	26.9	Very low	169 Å²	169	142.8 Å²	142.8	87%	0.867	80%	0.801	S	S	*	*			trans	-166.5	138.4	134.6	-99.4	151.5	0	0	0	108
132	D	25.6	Very low	26.9	Very low	137 Å²	137	141.3 Å²	141.3	73%	0.733	80%	0.795	S	S	*	*			trans	-78	159.8	-179	-48.7	-93.5	0	0	0	112.8
133	Q	29.6	Very low	27.3	Very low	199 Å²	199	143.2 Å²	143.2	93%	0.93	80%	0.798	S	S	*	*				-179.2	161.2	109.6	-95.4	172.6	20	0	0	113.9
134	S	23.3	Very low	27.2	Very low	113 Å²	113	141.9 Å²	141.9	79%	0.79	79%	0.793	S	S	*	*			trans	-91.7	150.5	-165.9	54	0	0	0	0	116
135	A	26.3	Very low	27.3	Very low	103 Å²	103	141.3 Å²	141.3	85%	0.851	79%	0.789	S	S	*	*			trans	-160.6	141.4	142.7	0	0	0	0	0	112.4
136	Y	22	Very low	27.3	Very low	218 Å²	218	140.3 Å²	140.3	86%	0.855	79%	0.785	S	S	*	*			trans	-103.8	136.7	171.6	-86.7	-104.5	0	0	0	110.8
137	I	25.6	Very low	27	Very low	165 Å²	165	145 Å²	145	85%	0.846	79%	0.785	S	S	*	*			trans	-146.9	142.9	145.6	-60.8	-171.6	0	0	0	109
138	I	23.8	Very low	27	Very low	138 Å²	138	148.1 Å²	148.1	71%	0.708	79%	0.787	S	S	*	*			trans	-128.2	142.3	170.3	-42.7	174.7	0	0	0	108.3
139	P	27.1	Very low	27	Very low	123 Å²	123	148.5 Å²	148.5	80%	0.799	79%	0.785	S	S	*	*				-136.6	-173.9	127.9	30.9	-13.9	0	0	0	113.3
140	S	26.7	Very low	26.7	Very low	98 Å²	98	145.5 Å²	145.5	69%	0.685	78%	0.778	S	S	*	*			trans	-147.2	-177	-152.4	61.7	0	0	0	0	115.6
141	Q	29.5	Very low	26.7	Very low	165 Å²	165	147.3 Å²	147.3	77%	0.771	78%	0.781	S	S	*	*			trans	82.1	152.3	172.7	-54.3	179.4	-1.2	0	0	114.9
142	N	29.4	Very low	26.5	Very low	128 Å²	128	147.3 Å²	147.3	68%	0.684	78%	0.775	S	S	*	*			cis	-162.8	171.9	39.1	-134.8	-19.5	0	0	0	116.2
143	N	32.4	Very low	26.7	Very low	133 Å²	133	147.6 Å²	147.6	71%	0.711	78%	0.777	S	S	*	*			trans	70.5	144.2	157.7	-60.6	-8.3	0	0	0	120.6
144	C	26.8	Very low	26.5	Very low	115 Å²	115	142.3 Å²	142.3	78%	0.777	76%	0.761	S	S	*	*			cis	-160.8	162.3	-11.8	-112.4	0	0	0	0	112.5
145	I	26.7	Very low	26.6	Very low	141 Å²	141	145.6 Å²	145.6	72%	0.723	76%	0.762	S	S	*	*			trans	-140.9	147.9	176.9	-60.7	166.7	0	0	0	109.1	F147	I145-F147 HydrophobicContact CG2-CD2 4.3Å
146	P	25.7	Very low	26.7	Very low	125 Å²	125	150.9 Å²	150.9	81%	0.812	76%	0.761	S	S	*	*			trans	-99.4	139.4	159.1	35.1	-28.5	0	0	0	112.9
147	F	25.1	Very low	27	Very low	173 Å²	173	149.5 Å²	149.5	76%	0.759	76%	0.76	S	S	*	*			trans	-123.6	172.9	177.8	-119.9	-88.2	0	0	0	109.7	I145	I145-F147 HydrophobicContact CG2-CD2 4.3Å
148	Y	28.8	Very low	27.3	Very low	217 Å²	217	147.5 Å²	147.5	85%	0.851	76%	0.757	S	S	*	*			trans	169.9	103.1	138.2	-88.3	-56.3	0	0	0	108.7
149	T	25.2	Very low	27.3	Very low	104 Å²	104	144.8 Å²	144.8	64%	0.638	76%	0.756	S	S	*	*				75	154.8	89.5	56.1	0	0	0	0	116.6
150	L	24.7	Very low	27.5	Very low	138 Å²	138	150.3 Å²	150.3	72%	0.723	76%	0.762	S	S	*	*			cis	174.3	141.8	-34.2	-133.7	177	0	0	0	107.1
151	Q	27.6	Very low	27.5	Very low	192 Å²	192	155.1 Å²	155.1	90%	0.897	77%	0.765	S	S	*	*			trans	-160.5	169.1	146.6	-118.6	172.2	6.1	0	0	113.2
152	K	25.2	Very low	27.6	Very low	168 Å²	168	152.5 Å²	152.5	73%	0.73	76%	0.763	S	S	*	*			trans	-133.9	152.9	-168.2	-62.7	175.3	176.3	176.5	0	111.6
153	N	28.5	Very low	27.5	Very low	144 Å²	144	153.9 Å²	153.9	77%	0.77	77%	0.765	S	S	*	*				179	132.8	116.8	-86.1	-26.7	0	0	0	109.1
154	S	26.5	Very low	27.4	Very low	87 Å²	87	152.8 Å²	152.8	61%	0.608	76%	0.759	S	S	*	*				77.9	110.5	54.8	-55.7	0	0	0	0	113
155	F	24.4	Very low	27.4	Very low	183 Å²	183	152.4 Å²	152.4	80%	0.803	76%	0.757	S	S	*	*				167.7	162.4	116.7	-102	-79.3	0	0	0	115.5
156	Y	28.6	Very low	27.3	Very low	214 Å²	214	153 Å²	153	84%	0.839	76%	0.761	S	S	*	*			trans	79.1	139.6	164	-75.2	-72	0	0	0	123.8
157	K	28.8	Very low	27.4	Very low	188 Å²	188	151.4 Å²	151.4	82%	0.817	75%	0.753	S	S	*	*			trans	-141.4	169.1	178.3	-120.4	-179	-175.1	179.5	0	104.3
158	P	31	Very low	27.4	Very low	123 Å²	123	148.5 Å²	148.5	80%	0.799	75%	0.753	S	S	*	*				-154.9	-176.2	54	42.8	-20.1	0	0	0	118.6
159	A	25.5	Very low	27.3	Very low	81 Å²	81	146.1 Å²	146.1	67%	0.669	75%	0.75	S	S	*	*			trans	-46.7	166.9	176.2	0	0	0	0	0	120.3
160	Y	29.4	Very low	27.6	Very low	240 Å²	240	145.9 Å²	145.9	94%	0.941	75%	0.75	S	S	*	*				-134.6	160.5	123.6	-117	-90.9	0	0	0	111
161	R	27.4	Very low	27.7	Very low	198 Å²	198	144.3 Å²	144.3	75%	0.747	75%	0.75	S	S	*	*			trans	-136.2	176.2	-178.9	-144.7	-169.6	-176	-163.7	0.5	106.8
162	P	31.5	Very low	27.9	Very low	111 Å²	111	140.6 Å²	140.6	72%	0.721	74%	0.743	S	S	*	*				-158.4	162.3	71.8	41.9	-20.8	0	0	0	118.9
163	Q	27.9	Very low	28	Very low	156 Å²	156	139.1 Å²	139.1	73%	0.729	74%	0.743	S	S	*	*			trans	64.2	141.2	146.8	-62.2	-88	-4.7	0	0	120.1
164	L	29.2	Very low	28	Very low	111 Å²	111	140.2 Å²	140.2	58%	0.581	75%	0.747	S	S	*	*			cis	-91.3	-111.5	-4.2	-72.3	77.8	0	0	0	109.1
165	S	26.8	Very low	28	Very low	107 Å²	107	139.9 Å²	139.9	75%	0.748	74%	0.744	S	S	*	*			cis	-164.9	142.4	-20	9.6	0	0	0	0	107.5
166	L	26.5	Very low	28.1	Very low	153 Å²	153	141.2 Å²	141.2	80%	0.801	75%	0.746	S	S	*	*			cis	-139.8	-85.2	-27	-141.3	-178.9	0	0	0	111.1
167	S	26.2	Very low	27.9	Very low	91 Å²	91	136.6 Å²	136.6	64%	0.636	74%	0.736	S	S	*	*			trans	-165.5	157.9	-167	62.9	0	0	0	0	112
168	C	25.5	Very low	27.7	Very low	113 Å²	113	137.7 Å²	137.7	76%	0.764	74%	0.735	S	S	*	*			cis	-131.2	140.7	10.3	-72.1	0	0	0	0	109.3
169	Q	27.8	Very low	27.4	Very low	167 Å²	167	136.8 Å²	136.8	78%	0.78	73%	0.727	S	S	*	*				72.4	145.3	63	-65	-77.6	-60.5	0	0	114.7
170	P	29.8	Very low	27.3	Very low	98 Å²	98	142.3 Å²	142.3	64%	0.636	74%	0.736	S	S	*	*			cis	-146.5	172.4	-34.3	40.9	-22.6	0	0	0	117.3
171	S	28	Very low	27.1	Very low	105 Å²	105	135 Å²	135	73%	0.734	72%	0.72	S	S	*	*				11.1	167.9	127.8	-45.2	0	0	0	0	121.5
172	P	32.5	Very low	27.1	Very low	114 Å²	114	131.5 Å²	131.5	74%	0.74	72%	0.716	S	S	*	*			cis	-155.8	178.5	30.8	45.6	-23	0	0	0	122.5
173	N	26.8	Very low	26.8	Very low	138 Å²	138	131.5 Å²	131.5	74%	0.738	71%	0.71	S	S	*	*			trans	-26.1	159.5	158.5	-44.8	-54.3	0	0	0	120.1
174	I	29	Very low	26.7	Very low	167 Å²	167	130 Å²	130	86%	0.856	71%	0.706	S	S	*	*				-173.9	171	116.4	-92.9	155.1	0	0	0	110.8
175	S	24.6	Very low	26.6	Very low	79 Å²	79	131.3 Å²	131.3	55%	0.552	71%	0.713	S	S	*	*				-163.7	179.2	-112.6	48.9	0	0	0	0	113.6
176	Y	26.8	Very low	26.6	Very low	211 Å²	211	131.9 Å²	131.9	83%	0.827	71%	0.708	S	S	*	*			trans	69	164.5	175.6	-71.7	-102.1	0	0	0	117.2
177	N	24.5	Very low	26.5	Very low	118 Å²	118	130.3 Å²	130.3	63%	0.631	70%	0.701	S	S	*	*			cis	-173.3	173	-45.2	-151.9	-27.6	0	0	0	109.1
178	R	24.4	Very low	26.4	Very low	210 Å²	210	132.9 Å²	132.9	79%	0.792	71%	0.706	S	S	*	*			trans	68.3	112.8	162.2	-67.7	-177.2	-171.5	-167.5	3	116.6
179	T	24.6	Very low	26.3	Very low	105 Å²	105	133 Å²	133	64%	0.644	70%	0.704	S	S	*	*				82	149.7	62.5	62	0	0	0	0	114.6
180	F	24.7	Very low	26.3	Very low	197 Å²	197	129.2 Å²	129.2	86%	0.864	70%	0.696	S	S	*	*			trans	74.7	145.9	-176	-59.2	-75.4	0	0	0	114.7
181	S	24.4	Very low	26.1	Very low	85 Å²	85	133.2 Å²	133.2	59%	0.594	71%	0.706	S	S	*	*			cis	-174.5	162	-29.7	-140.8	0	0	0	0	107.9
182	N	27	Very low	26.1	Very low	125 Å²	125	132.7 Å²	132.7	67%	0.668	70%	0.702	S	S	*	*			trans	65	164.1	155.4	-68.1	45.2	0	0	0	114.2
183	D	25.9	Very low	25.9	Very low	112 Å²	112	138.1 Å²	138.1	60%	0.599	71%	0.707	S	S	*	*			cis	-153.5	147.9	-18.1	-112.2	-12.9	0	0	0	110.4
184	I	26.1	Very low	26.2	Very low	125 Å²	125	134.7 Å²	134.7	64%	0.641	71%	0.705	S	S	*	*			trans	56.8	143.6	132.4	-62.5	167.9	0	0	0	120.3
185	N	27.1	Very low	26.3	Very low	137 Å²	137	134.7 Å²	134.7	73%	0.733	71%	0.707	S	S	*	*			trans	68.5	157.8	162.3	-76	-6.9	0	0	0	117.9
186	N	25.8	Very low	26.5	Very low	120 Å²	120	134 Å²	134	64%	0.642	71%	0.712	S	S	*	*			cis	-168.8	171.5	-40.5	-124.4	32.1	0	0	0	107.3
187	D	25	Very low	26.7	Very low	119 Å²	119	131.8 Å²	131.8	64%	0.636	71%	0.714	S	S	*	*			trans	54.6	120.7	143.4	-67.2	-36.6	0	0	0	122.8
188	L	24.3	Very low	27	Very low	145 Å²	145	133.7 Å²	133.7	76%	0.759	72%	0.718	S	S	*	*				73.3	116.5	125	-61.1	173.2	0	0	0	121.5
189	V	24.5	Very low	27.3	Very low	117 Å²	117	129.1 Å²	129.1	71%	0.709	71%	0.71	S	S	*	*				90.4	142.9	119.6	165.2	0	0	0	0	120.5
190	S	26	Very low	27.4	Very low	87 Å²	87	127.8 Å²	127.8	61%	0.608	71%	0.705	S	S	*	*			trans	79.4	113.3	162	75.3	0	0	0	0	116.1
191	Q	27.3	Very low	27.8	Very low	182 Å²	182	125.6 Å²	125.6	85%	0.85	70%	0.701	S	S	*	*				83.9	147	86.2	-74.4	174.3	43.6	0	0	112.3
192	S	28.1	Very low	27.9	Very low	93 Å²	93	127.9 Å²	127.9	65%	0.65	71%	0.706	S	S	*	*			cis	-149.4	157	10.9	68.7	0	0	0	0	113.8
193	R	28	Very low	27.9	Very low	228 Å²	228	127 Å²	127	86%	0.86	71%	0.705	S	S	*	*			trans	38.9	138.4	135.7	-61.6	168.6	178.9	170.9	-1.3	120.8
194	G	31.7	Very low	27.9	Very low	66 Å²	66	126 Å²	126	68%	0.68	70%	0.703	S	S	*	*			cis	156.4	-172.9	-7.6	0	0	0	0	0	115.8
195	N	31	Very low	27.9	Very low	168 Å²	168	127.7 Å²	127.7	90%	0.898	71%	0.708	S	S	*	*			trans	70.4	133.2	159.7	-55.2	-6.5	0	0	0	118.5
196	G	30.2	Very low	27.8	Very low	64 Å²	64	126.3 Å²	126.3	66%	0.66	71%	0.705	S	S	*	*			cis	167.5	-169.8	-5.7	0	0	0	0	0	113.8
197	L	29.5	Very low	27.8	Very low	165 Å²	165	127.1 Å²	127.1	86%	0.864	71%	0.709	S	S	*	*			trans	71.5	130.3	175.5	-53.8	158.8	0	0	0	114.4
198	Q	30.8	Very low	27.9	Very low	157 Å²	157	130 Å²	130	73%	0.734	72%	0.716	S	S	*	*			cis	-156.6	165.4	-9.1	-94.9	-174.8	12.8	0	0	106.2
199	N	31.7	Very low	27.9	Very low	115 Å²	115	133.1 Å²	133.1	62%	0.615	72%	0.719	S	S	*	*			cis	-153.4	153.8	-6.4	-113	-24.1	0	0	0	106.3
200	S	27	Very low	28.1	Very low	77 Å²	77	132.8 Å²	132.8	54%	0.538	72%	0.719	S	S	.	*				48	132.1	75.3	90.8	0	0	0	0	114.6
201	I	32.3	Very low	27.9	Very low	151 Å²	151	132.7 Å²	132.7	77%	0.774	72%	0.718	S	S	*	*			cis	-131	134.5	39.8	-79.6	154.4	0	0	0	109.8
202	N	25.9	Very low	28	Very low	133 Å²	133	132.3 Å²	132.3	71%	0.711	72%	0.716	S	S	*	*				71.4	147.2	62.9	-80.9	6.7	0	0	0	112.5
203	V	27.3	Very low	27.9	Very low	106 Å²	106	134.5 Å²	134.5	64%	0.642	72%	0.721	S	S	*	*			cis	-160.2	139.9	7.5	99.2	0	0	0	0	111.6
204	T	26.9	Very low	27.8	Very low	91 Å²	91	130.7 Å²	130.7	56%	0.558	72%	0.716	S	S	*	*			trans	58.6	143	141.6	63.2	0	0	0	0	125.5
205	E	25.8	Very low	27.6	Very low	161 Å²	161	133.7 Å²	133.7	75%	0.752	72%	0.717	S	S	*	*				60.8	158.6	124.9	-62.5	168.9	-172.2	0	0	121.9
206	T	25.6	Very low	27.3	Very low	107 Å²	107	130.6 Å²	130.6	66%	0.656	71%	0.708	S	S	*	*			cis	-160.8	165.4	-18.7	30.5	0	0	0	0	111
207	L	24.9	Very low	27.3	Very low	138 Å²	138	132.5 Å²	132.5	72%	0.723	71%	0.711	S	S	*	*			trans	70.3	141.8	141.2	-79.1	162.4	0	0	0	122.4
208	K	27.2	Very low	27.1	Very low	180 Å²	180	129.3 Å²	129.3	78%	0.783	70%	0.703	S	S	*	*			trans	83.3	108.7	148.2	-71.7	162.5	-177.2	179.3	0	121.7
209	Y	23.4	Very low	26.9	Very low	210 Å²	210	129.6 Å²	129.6	82%	0.824	71%	0.708	S	S	*	*			trans	-21.7	154	130.4	-71.9	-82.5	0	0	0	115.9
210	P	28.9	Very low	26.7	Very low	109 Å²	109	128.6 Å²	128.6	71%	0.708	71%	0.711	S	S	*	*			cis	-129.2	173.2	45.7	37.9	-21.4	0	0	0	115.2
211	S	23.4	Very low	26.6	Very low	86 Å²	86	131.7 Å²	131.7	60%	0.601	72%	0.72	S	S	*	*			cis	81.8	62	12.3	86.1	0	0	0	0	119.2
212	E	29.4	Very low	26.5	Very low	174 Å²	174	132.6 Å²	132.6	81%	0.813	72%	0.718	S	S	*	*			trans	-147.5	127.6	153.3	-102.8	143.7	-146.1	0	0	107.2
213	N	25.3	Very low	26.8	Very low	138 Å²	138	134 Å²	134	74%	0.738	72%	0.72	S	S	*	*				81.2	145.6	56	-84.6	-19.6	0	0	0	113.9
214	I	26.5	Very low	26.5	Very low	148 Å²	148	140.3 Å²	140.3	76%	0.759	73%	0.733	S	S	*	*			trans	70.5	130.5	154.6	-70.1	161.3	0	0	0	115.2
215	D	27.1	Very low	26.8	Very low	130 Å²	130	140.9 Å²	140.9	70%	0.695	74%	0.738	S	S	*	*			cis	-148.5	168.5	-6.7	-135.2	-41.1	0	0	0	114.6
216	S	24.3	Very low	26.7	Very low	102 Å²	102	141.6 Å²	141.6	71%	0.713	74%	0.739	S	S	*	*			trans	-56.4	136.3	162.9	59.1	0	0	0	0	115.2
217	S	29.7	Very low	26.7	Very low	105 Å²	105	143.3 Å²	143.3	73%	0.734	74%	0.744	S	S	*	*			trans	-164.3	100.4	147.7	50	0	0	0	0	108
218	S	25.5	Very low	26.8	Very low	98 Å²	98	142 Å²	142	69%	0.685	75%	0.746	S	S	*	*				88	149.5	61.9	75.2	0	0	0	0	112.9
219	L	27.6	Very low	26.6	Very low	162 Å²	162	143 Å²	143	85%	0.848	75%	0.751	S	S	*	*			trans	69.2	143.6	170.9	-54.9	166.2	0	0	0	116.6
220	S	26.8	Very low	26.8	Very low	95 Å²	95	141.8 Å²	141.8	66%	0.664	75%	0.753	S	S	*	*			cis	-160.2	157.6	-20.1	52.7	0	0	0	0	112.4
221	L	25.8	Very low	26.5	Very low	141 Å²	141	141.1 Å²	141.1	74%	0.738	75%	0.751	S	S	*	*			trans	-26	144.7	160.4	-46.4	75.8	0	0	0	115.4
222	K	28.5	Very low	26.7	Very low	170 Å²	170	145.1 Å²	145.1	74%	0.739	76%	0.764	S	S	*	*				-178.1	161.7	99.1	-102.3	157	-173.1	172.7	0	114.5
223	H	32.2	Very low	26.5	Very low	162 Å²	162	143.9 Å²	143.9	75%	0.75	76%	0.763	S	S	*	*			trans	44.7	105.7	163.9	-54	-52.9	0	0	0	116.8
224	R	22.9	Very low	26.6	Very low	239 Å²	239	146.7 Å²	146.7	90%	0.902	77%	0.772	S	S	*	*			cis	60.8	147.4	38.6	-109.7	-146.8	175.1	-178.9	0.7	112.5
225	P	32.1	Very low	26.4	Very low	103 Å²	103	150.7 Å²	150.7	67%	0.669	78%	0.778	S	S	*	*				-132	-175.1	-119	39.3	-21.4	0	0	0	113.6
226	K	24.4	Very low	26.2	Very low	177 Å²	177	150.1 Å²	150.1	77%	0.77	78%	0.784	S	S	*	*			trans	158.8	149.9	135.6	-90.2	170.1	-179.8	-176.2	0	113.6
227	N	25	Very low	26.3	Very low	142 Å²	142	150.5 Å²	150.5	76%	0.759	79%	0.786	S	S	*	*			trans	31	117.9	136.7	-46.3	5	0	0	0	120.5
228	S	26.2	Very low	26.1	Very low	112 Å²	112	155.4 Å²	155.4	78%	0.783	80%	0.795	S	S	*	*				-177	129.2	106.8	36.5	0	0	0	0	109
229	F	23.3	Very low	26	Very low	201 Å²	201	159.7 Å²	159.7	88%	0.882	80%	0.801	S	S	*	*				65.3	75.7	73.1	-98	-78	0	0	0	114.8
230	Q	28.1	Very low	25.9	Very low	183 Å²	183	158.2 Å²	158.2	86%	0.855	79%	0.793	S	S	*	*			trans	-164.4	115.3	140.4	-101.1	154.7	8.2	0	0	106
231	S	23.5	Very low	25.8	Very low	95 Å²	95	161.4 Å²	161.4	66%	0.664	80%	0.795	S	S	*	*			cis	68.8	86.5	47.6	85.1	0	0	0	0	113.4
232	L	27.6	Very low	25.7	Very low	170 Å²	170	157.2 Å²	157.2	89%	0.89	78%	0.778	S	S	*	*			trans	-161.6	153.9	147.5	-107	156.9	0	0	0	109
233	D	24.4	Very low	25.6	Very low	148 Å²	148	154.5 Å²	154.5	79%	0.791	77%	0.768	S	S	*	*			trans	-69.6	149	-172.4	-60.1	-98	0	0	0	113.7
234	E	26.2	Very low	25.3	Very low	197 Å²	197	150 Å²	150	92%	0.921	75%	0.747	S	S	*	*				-155.9	144.1	124.6	-121.1	174.1	-154.6	0	0	112.8
235	R	23.3	Very low	25.4	Very low	232 Å²	232	145.6 Å²	145.6	88%	0.875	74%	0.735	S	S	*	*			trans	-82.5	152.9	172.9	-70.5	172.2	171.5	161	-4.3	109.9
236	S	23.6	Very low	25.2	Very low	119 Å²	119	147.4 Å²	147.4	83%	0.832	73%	0.732	S	S	*	*			trans	72.7	114	159.8	77.5	0	0	0	0	118.9
237	S	26	Very low	25.5	Very low	109 Å²	109	142.1 Å²	142.1	76%	0.762	71%	0.71	S	S	*	*			trans	-146.7	53.8	149.3	63	0	0	0	0	112.8	K239	S237-K239 PolarHBondContact O-N 3.37Å
238	F	24.9	Very low	25.6	Very low	209 Å²	209	144.6 Å²	144.6	92%	0.917	71%	0.709	S	S	*	*			trans	-59	88.5	147	-102.5	-95.8	0	0	0	108.4
239	K	24.8	Very low	25.7	Very low	188 Å²	188	143.8 Å²	143.8	82%	0.817	69%	0.691	S	S	*	*			trans	-135.7	90.7	170.8	-81.7	179.5	177.1	167.3	0	108.9	S237	S237-K239 PolarHBondContact O-N 3.37Å
240	L	24.7	Very low	26.1	Very low	130 Å²	130	138.7 Å²	138.7	68%	0.681	67%	0.673	S	S	*	*				45.6	92.7	83.9	-80	159.8	0	0	0	114.4
241	K	24.6	Very low	26.1	Very low	162 Å²	162	134.7 Å²	134.7	70%	0.704	65%	0.653	S	S	*	*			trans	-101.9	52.7	137.6	-81.1	-170.6	175.1	-177.1	0	111.3	H243 Q677	K241-H243 PolarHBondContact O-N 2.78Å; K241-H243 VanDerWaalsContact O-N 3.12Å; K241-Q677 PolarHBondContact O-N 2.94Å
242	S	24.5	Very low	26.4	Very low	54 Å²	54	138.7 Å²	138.7	38%	0.378	66%	0.655	S	S	.	*				53.6	37.5	129.9	58.3	0	0	0	0	122.4	V676	S242-V676 CarbonylContact C-O 3.46Å; S242-V676 WeakPolarHBondContact CB-O 3.36Å; S242-V676 CarbonylContact O-C 3.53Å; S242-V676 WeakPolarHBondContact O-CA 3.27Å; S242-V676 PolarHBondContact O-N 2.74Å; S242-V676 PolarHBondContact OG-O 2.72Å
243	H	25.2	Very low	26.3	Very low	112 Å²	112	135.6 Å²	135.6	52%	0.519	65%	0.647	S	S	.	*			trans	88.5	-97.5	152.2	-33.6	-77.7	0	0	0	120.8	K241 F245 P675 Q677	K241-H243 PolarHBondContact O-N 2.78Å; K241-H243 VanDerWaalsContact O-N 3.12Å; H243-F245 PolarHBondContact O-N 2.77Å; H243-P675 HydrophobicContact CB-CG 4.46Å; H243-Q677 WeakPolarHBondContact O-CA 3.3Å; H243-Q677 WeakPolarHBondContact O-CG 3.49Å
244	Q	25.6	Very low	26.4	Very low	67 Å²	67	133 Å²	133	31%	0.313	64%	0.64	S	S	.	*	S	Bend	trans	32	-87.8	-136.9	-81.4	-142.8	56.2	0	0	114.5	F246 H247 P675 V676 Q677	Q244-F246 VanDerWaalsContact C-N 3.27Å; Q244-F246 PolarHBondContact O-N 3.12Å; Q244-H247 WeakPolarHBondContact O-CB 3.45Å; Q244-H247 PolarHBondContact O-N 2.8Å; Q244-P675 VanDerWaalsContact CA-O 3.22Å; Q244-P675 WeakPolarHBondContact CA-O 3.25Å; Q244-P675 WeakPolarHBondContact CG-O 3.34Å; Q244-P675 PolarHBondContact N-O 3.34Å; Q244-V676 HydrophobicContact CG-CB 3.89Å; Q244-V676 HydrophobicContact CG-CG1 4.04Å; Q244-V676 HydrophobicContact CG-CG2 3.66Å; Q244-Q677 HydrophobicContact CB-CB 3.88Å; Q244-Q677 HydrophobicContact CB-CG 3.85Å; Q244-Q677 HydrophobicContact CG-CB 4.17Å
245	F	25.5	Very low	26.4	Very low	148 Å²	148	132 Å²	132	65%	0.649	63%	0.633	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.4	-8.6	-131.2	-98	-163.3	0	0	0	116	H243	H243-F245 PolarHBondContact O-N 2.77Å
246	F	28.2	Very low	26.7	Very low	140 Å²	140	128.3 Å²	128.3	61%	0.614	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.4	-17.3	168.9	-98.9	-98.7	0	0	0	114.3	Q244 R248 F249	Q244-F246 VanDerWaalsContact C-N 3.27Å; Q244-F246 PolarHBondContact O-N 3.12Å; F246-R248 PolarHBondContact O-N 2.96Å; F246-F249 PolarHBondContact O-N 2.95Å
247	H	30.2	Very low	26.8	Very low	66 Å²	66	126.2 Å²	126.2	31%	0.306	62%	0.621	S	S	.	*	H	α-helix	trans	-74.5	-13.8	-173.3	-145.7	-36.3	0	0	0	113.7	Q244 F249 P675	Q244-H247 WeakPolarHBondContact O-CB 3.45Å; Q244-H247 PolarHBondContact O-N 2.8Å; H247-F249 VanDerWaalsContact C-N 3.31Å; H247-F249 PolarHBondContact O-N 3.01Å; H247-P675 HydrophobicContact CB-CG 4.29Å
248	R	27.7	Very low	26.8	Very low	195 Å²	195	123.3 Å²	123.3	74%	0.736	61%	0.608	S	S	*	*	H	α-helix	trans	-73	-21.5	178.5	-152.8	169.7	-169.5	151.6	1.9	113.1	F246	F246-R248 PolarHBondContact O-N 2.96Å
249	F	28.7	Very low	26.9	Very low	94 Å²	94	119.7 Å²	119.7	41%	0.412	60%	0.597	S	S	.	*	H	α-helix	trans	-92.8	-23.6	-172.8	-148.1	-93.6	0	0	0	114.8	F246 H247 L306 L334 D335	F246-F249 PolarHBondContact O-N 2.95Å; H247-F249 VanDerWaalsContact C-N 3.31Å; H247-F249 PolarHBondContact O-N 3.01Å; F249-L306 HydrophobicContact CD1-CD1 3.46Å; F249-L306 VanDerWaalsContact CD1-CD1 3.46Å; F249-L306 HydrophobicContact CE1-CD1 3.75Å; F249-L334 HydrophobicContact CE2-CD2 4.39Å; F249-L334 HydrophobicContact CZ-CD2 4.3Å; F249-D335 HydrophobicContact CE2-CB 4.47Å
250	L	30.9	Very low	27	Very low	94 Å²	94	114.6 Å²	114.6	49%	0.492	58%	0.582	S	S	.	*	H	α-helix	trans	-110.4	-2.5	-173.4	-70.6	170.1	0	0	0	114.4	L306	L250-L306 HydrophobicContact CD2-CD1 4.23Å
251	K	29	Very low	27	Very low	99 Å²	99	112.6 Å²	112.6	43%	0.43	57%	0.567	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.1	4.2	-171.8	-145	177.2	-173.6	174.9	0	115.7	W673 L674	K251-W673 PolarHBondContact NZ-O 2.71Å; K251-L674 HydrophobicContact CD-CD2 4.4Å
252	Y	28.6	Very low	27.3	Very low	180 Å²	180	105.9 Å²	105.9	71%	0.706	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.2	-2	-176.9	-86.9	-69.1	0	0	0	115.6
253	S	26.4	Very low	27.5	Very low	104 Å²	104	108.2 Å²	108.2	73%	0.727	55%	0.546	S	S	*	.	S	Bend	trans	-93.9	-4.7	-174.3	52.6	0	0	0	0	115.5
254	S	26	Very low	27.6	Very low	93 Å²	93	108.3 Å²	108.3	65%	0.65	55%	0.55	S	S	*	*	S	Bend	trans	-154.7	69.5	-170.5	52.1	0	0	0	0	115.9
255	K	26.4	Very low	27.8	Very low	177 Å²	177	111.8 Å²	111.8	77%	0.77	57%	0.571	S	S	*	*			trans	-166.6	121.8	152.1	-113.2	178.6	-175	-175.1	0	113.5
256	F	28.7	Very low	27.8	Very low	154 Å²	154	109.9 Å²	109.9	68%	0.675	58%	0.576	S	S	*	*			trans	54.8	134.7	165.6	-57.2	-76.2	0	0	0	118.5	P670	F256-P670 HydrophobicContact CB-CB 4.1Å; F256-P670 HydrophobicContact CB-CG 3.92Å
257	G	26.4	Very low	28.1	Very low	75 Å²	75	108.2 Å²	108.2	77%	0.773	58%	0.58	S	S	*	*			cis	92.5	75.2	3.8	0	0	0	0	0	114.6
258	G	25.6	Very low	27.9	Very low	49 Å²	49	109.9 Å²	109.9	51%	0.505	60%	0.598	S	S	.	*			trans	123.4	141.2	157.9	0	0	0	0	0	119.2
259	I	27	Very low	27.8	Very low	133 Å²	133	107.1 Å²	107.1	68%	0.682	60%	0.597	S	S	*	*			trans	71.9	176.4	134.8	-61.7	158	0	0	0	118.9	R668 K669	I259-R668 CarbonylContact O-C 3.49Å; I259-R668 VanDerWaalsContact O-CA 3.23Å; I259-R668 WeakPolarHBondContact O-CA 3.22Å; I259-R668 PolarHBondContact O-N 2.91Å; I259-K669 PolarHBondContact O-N 2.77Å
260	T	26.2	Very low	27.6	Very low	81 Å²	81	109.7 Å²	109.7	50%	0.497	62%	0.615	S	S	.	*			trans	79.1	118.8	177.6	-54.3	0	0	0	0	119.5	K667 R668	T260-K667 CarbonylContact O-C 3.54Å; T260-K667 VanDerWaalsContact O-C 3.32Å; T260-K667 WeakPolarHBondContact O-CA 3.4Å; T260-R668 PolarHBondContact O-N 3.02Å
261	K	26.6	Very low	27.4	Very low	87 Å²	87	109.3 Å²	109.3	38%	0.378	62%	0.62	S	S	.	*			trans	-98.2	141.6	-164.5	-157.4	-153.6	178.1	-83.4	0	115.6	E263 L665 R668	K261-E263 IonicContact NZ-OE1 2.85Å; K261-E263 PolarHBondContact NZ-OE1 2.76Å; K261-E263 IonicContact NZ-OE2 3.87Å; K261-E263 PolarHBondContact NZ-OE2 2.78Å; K261-L665 WeakPolarHBondContact CE-O 3.39Å; K261-L665 PolarHBondContact NZ-O 2.79Å; K261-R668 PolarHBondContact O-NH1 3.11Å
262	S	29.2	Very low	27.2	Very low	21 Å²	21	109.2 Å²	109.2	15%	0.147	63%	0.632	C	S	.	*			trans	39.1	-170.5	150.2	64.1	0	0	0	0	121.7	M666 R668	S262-M666 VanDerWaalsContact CA-SD 3.59Å; S262-R668 VanDerWaalsContact O-CZ 3.27Å; S262-R668 PolarHBondContact O-NH1 2.86Å; S262-R668 PolarHBondContact O-NH2 3.39Å
263	E	28.6	Very low	27.1	Very low	103 Å²	103	105.2 Å²	105.2	48%	0.481	63%	0.63	S	S	.	*			cis	-152.3	171.8	1.1	-134.5	100.2	53.2	0	0	106	K261 L665	K261-E263 IonicContact NZ-OE1 2.85Å; K261-E263 PolarHBondContact NZ-OE1 2.76Å; K261-E263 IonicContact NZ-OE2 3.87Å; K261-E263 PolarHBondContact NZ-OE2 2.78Å; E263-L665 WeakPolarHBondContact OE2-CD2 3.02Å; E263-L665 VanDerWaalsContact OE2-CG 3.27Å; E263-L665 WeakPolarHBondContact OE2-CG 3.25Å
264	N	28.4	Very low	27	Very low	115 Å²	115	105.8 Å²	105.8	62%	0.615	63%	0.629	S	S	*	*			cis	-161.1	-169.3	-11	-151	1.9	0	0	0	111
265	N	29.5	Very low	27	Very low	139 Å²	139	106.4 Å²	106.4	74%	0.743	63%	0.634	S	S	*	*			trans	66.3	98.1	153.4	-67	1	0	0	0	122.3
266	S	25.8	Very low	27.1	Very low	109 Å²	109	103.8 Å²	103.8	76%	0.762	64%	0.635	S	S	*	*			trans	-88.1	-159.9	145.3	60.4	0	0	0	0	109.7
267	P	33.4	Very low	26.9	Very low	105 Å²	105	103.9 Å²	103.9	68%	0.682	64%	0.641	S	S	*	*			cis	-138.2	-155.3	-10.4	39.3	-18	0	0	0	113.4
268	S	26	Very low	26.9	Very low	100 Å²	100	106.6 Å²	106.6	70%	0.699	63%	0.633	S	S	*	*			trans	80.5	159.5	151.3	79.4	0	0	0	0	117.7
269	L	25.8	Very low	26.9	Very low	137 Å²	137	114 Å²	114	72%	0.717	65%	0.646	S	S	*	*			cis	-142.7	158.8	16.5	-102.8	-177.6	0	0	0	112.5
270	L	25.7	Very low	26.8	Very low	149 Å²	149	113.9 Å²	113.9	78%	0.78	65%	0.646	S	S	*	*			trans	61.7	150.5	151.8	-63	164.8	0	0	0	119
271	S	25.7	Very low	26.7	Very low	86 Å²	86	114.5 Å²	114.5	60%	0.601	65%	0.652	S	S	*	*			cis	-165	174.5	-19	52.6	0	0	0	0	111.5
272	S	25.7	Very low	26.5	Very low	97 Å²	97	116.5 Å²	116.5	68%	0.678	66%	0.662	S	S	*	*			trans	41.7	134.1	138.8	62.8	0	0	0	0	121.6
273	S	25.2	Very low	26.3	Very low	95 Å²	95	116.7 Å²	116.7	66%	0.664	66%	0.663	S	S	*	*			cis	-175.2	174.7	-3.3	49.6	0	0	0	0	111.1
274	T	25.9	Very low	26.1	Very low	116 Å²	116	115.7 Å²	115.7	71%	0.712	66%	0.661	S	S	*	*			trans	41.4	92.9	144.2	51.9	0	0	0	0	117.7
275	S	25.1	Very low	25.9	Very low	106 Å²	106	115.5 Å²	115.5	74%	0.741	65%	0.654	S	S	*	*				98.3	147.3	65.8	61	0	0	0	0	112.9
276	P	27.9	Very low	25.8	Very low	122 Å²	122	114.3 Å²	114.3	79%	0.792	65%	0.648	S	S	*	*			trans	-113.8	140.1	-153.5	38.1	-26.8	0	0	0	115
277	I	25.6	Very low	25.7	Very low	157 Å²	157	114 Å²	114	81%	0.805	64%	0.642	S	S	*	*			trans	-141.6	124.8	170.7	-61.7	-179.3	0	0	0	105.9
278	H	26.3	Very low	25.3	Very low	131 Å²	131	119.4 Å²	119.4	61%	0.606	65%	0.65	S	S	*	*			cis	-155	159.4	0.1	-127	165.9	0	0	0	109.4
279	R	25.1	Very low	25.1	Very low	205 Å²	205	118.9 Å²	118.9	77%	0.774	65%	0.652	S	S	*	*			trans	41.4	141.4	139.9	-65.6	171.9	-162.6	-164.5	2.6	121.2
280	N	25.6	Very low	25	Very low	130 Å²	130	115.6 Å²	115.6	70%	0.695	64%	0.64	S	S	*	*			cis	-165.9	132.5	-20.1	-159.2	39.1	0	0	0	107.1
281	P	23.6	Very low	24.8	Very low	94 Å²	94	119.4 Å²	119.4	61%	0.61	64%	0.644	S	S	*	*			trans	-69.6	144.2	169.4	29.7	-33.5	0	0	0	111.2
282	Q	22.9	Very low	24.7	Very low	129 Å²	129	124.5 Å²	124.5	60%	0.603	65%	0.652	S	S	*	*			trans	-135.3	148.2	159	-90	-67.9	-23.9	0	0	103.6
283	P	24.1	Very low	24.6	Very low	26 Å²	26	125 Å²	125	17%	0.169	65%	0.654	C	S	.	*				-150	-169.5	67.8	27.5	-1	0	0	0	118	N1134 E1135	P283-N1134 HydrophobicContact CB-CB 4.22Å; P283-N1134 VanDerWaalsContact CB-OD1 3.32Å; P283-N1134 WeakPolarHBondContact CB-OD1 3.31Å; P283-N1134 HydrophobicContact CG-CB 4.26Å; P283-N1134 VanDerWaalsContact CG-OD1 3.27Å; P283-N1134 WeakPolarHBondContact CG-OD1 3.44Å; P283-N1134 CarbonylContact O-C 3.57Å; P283-N1134 VanDerWaalsContact O-C 3.32Å; P283-E1135 PolarHBondContact O-N 2.92Å
284	L	25.2	Very low	24.7	Very low	81 Å²	81	124 Å²	124	42%	0.424	65%	0.652	S	S	.	*			trans	-113.9	118.5	-158	-80.2	153	0	0	0	117.1	N1134	L284-N1134 VanDerWaalsContact C-CB 3.44Å; L284-N1134 PolarHBondContact N-ND2 3.46Å; L284-N1134 WeakPolarHBondContact O-CB 3.38Å; L284-N1134 PolarHBondContact O-ND2 2.97Å
285	K	24.7	Very low	24.7	Very low	111 Å²	111	125.2 Å²	125.2	48%	0.483	64%	0.643	S	S	.	*			trans	46.4	134.6	144.4	-61.7	162.9	-173.6	158.9	0	121.2	N1134 N1136	K285-N1134 PolarHBondContact N-O 3.49Å; K285-N1136 HydrophobicContact CB-CB 4.11Å; K285-N1136 WeakPolarHBondContact CE-OD1 3.4Å; K285-N1136 HydrophobicContact CG-CB 3.33Å; K285-N1136 VanDerWaalsContact CG-CG 3.44Å; K285-N1136 WeakPolarHBondContact CG-OD1 3.48Å
286	N	27.1	Very low	24.7	Very low	115 Å²	115	125.7 Å²	125.7	62%	0.615	64%	0.637	S	S	*	*				-169.9	94.6	115.3	-96.5	-16.7	0	0	0	116.2	Q1137	N286-Q1137 PolarHBondContact O-NE2 3.1Å; N286-Q1137 PolarHBondContact O-OE1 3.3Å
287	T	24.2	Very low	24.7	Very low	102 Å²	102	122.6 Å²	122.6	63%	0.626	62%	0.617	S	S	*	*			trans	-47.2	140.3	176.5	45.5	0	0	0	0	118.1
288	Y	24.4	Very low	24.6	Very low	219 Å²	219	123.1 Å²	123.1	86%	0.859	62%	0.619	S	S	*	*			trans	-139.6	174.6	140.9	-95.2	-80.1	0	0	0	109.7
289	A	22.4	Very low	24.9	Very low	89 Å²	89	119.4 Å²	119.4	74%	0.736	60%	0.603	S	S	*	*			trans	-84.1	171.1	-164.8	0	0	0	0	0	114.3
290	S	22.5	Very low	25.1	Very low	67 Å²	67	112.8 Å²	112.8	47%	0.469	59%	0.587	S	S	.	*			cis	-167.3	144.9	25.5	69	0	0	0	0	116.8
291	R	22.6	Very low	25.6	Very low	230 Å²	230	111.9 Å²	111.9	87%	0.868	59%	0.591	S	S	*	*			trans	41.1	86.8	152.5	-55.1	-174.3	-158.4	179.4	7.8	118.7
292	Y	22.5	Very low	26.3	Very low	193 Å²	193	112 Å²	112	76%	0.757	59%	0.594	S	S	*	*			trans	-165.6	175.3	139.9	-98	-61	0	0	0	111
293	C	23.8	Very low	27.8	Very low	108 Å²	108	108.9 Å²	108.9	73%	0.73	59%	0.587	S	S	*	*			trans	66.4	157.6	-177.2	-65.1	0	0	0	0	115.7
294	A	27	Very low	29.6	Very low	74 Å²	74	109.2 Å²	109.2	61%	0.612	59%	0.589	S	S	*	*			cis	-127.5	158.6	8	0	0	0	0	0	113.5
295	W	25.5	Very low	31.6	Very low	140 Å²	140	112 Å²	112	53%	0.53	60%	0.597	S	S	.	*			trans	-83.7	154.1	176.1	-70.5	26.9	0	0	0	111.7	T327 F328	W295-T327 HydrophobicContact CH2-CG2 4.25Å; W295-T327 HydrophobicContact CZ3-CG2 4.43Å; W295-F328 HydrophobicContact CE3-CB 4.39Å; W295-F328 HydrophobicContact CH2-CB 4.44Å; W295-F328 HydrophobicContact CZ3-CB 3.78Å
296	N	25.1	Very low	34.1	Very low	116 Å²	116	109 Å²	109	62%	0.62	59%	0.586	S	S	*	*			trans	-146.6	92.1	161.1	-165.8	-8	0	0	0	111.1	M298	N296-M298 PolarHBondContact O-N 3.31Å
297	P	28.1	Very low	36.7	Very low	58 Å²	58	104.9 Å²	104.9	38%	0.377	56%	0.564	S	S	.	*			trans	-86.9	64.1	-167.4	35.9	-36.8	0	0	0	113.4	I299 P330	P297-I299 PolarHBondContact O-N 3.17Å; P297-P330 HydrophobicContact CB-CG 4.47Å; P297-P330 HydrophobicContact CG-CG 4.23Å
298	M	24.9	Very low	39.4	Very low	168 Å²	168	103.1 Å²	103.1	83%	0.828	55%	0.55	S	S	*	*			trans	-74.9	64.1	155.8	-71.9	-147.8	82.2	0	0	110.3	N296 S300	N296-M298 PolarHBondContact O-N 3.31Å; M298-S300 PolarHBondContact O-N 3.3Å; M298-S300 VanDerWaalsContact O-N 3.11Å
299	I	31.5	Very low	42.2	Very low	53 Å²	53	92.7 Å²	92.7	27%	0.272	51%	0.51	S	S	.	.			trans	-69.1	104.6	164.4	-63.7	-179.5	0	0	0	106.2	P297 S301 V304 I333 L423	P297-I299 PolarHBondContact O-N 3.17Å; I299-S301 PolarHBondContact O-N 3.1Å; I299-V304 HydrophobicContact CG2-CG2 3.41Å; I299-V304 VanDerWaalsContact CG2-CG2 3.41Å; I299-I333 HydrophobicContact CB-CD1 3.97Å; I299-I333 HydrophobicContact CD1-CD1 3.81Å; I299-I333 HydrophobicContact CG1-CD1 4.36Å; I299-I333 HydrophobicContact CG2-CD1 4.25Å; I299-L423 HydrophobicContact CD1-CD2 3.98Å
300	S	30	Very low	45.1	Very low	65 Å²	65	89.7 Å²	89.7	46%	0.455	48%	0.483	S	S	.	.			trans	-58.4	127.9	170.7	-176	0	0	0	0	108.7	M298 S302 S303	M298-S300 PolarHBondContact O-N 3.3Å; M298-S300 VanDerWaalsContact O-N 3.11Å; S300-S302 PolarHBondContact O-N 3.36Å; S300-S302 PolarHBondContact OG-OG 3.45Å; S300-S303 PolarHBondContact O-N 3.45Å; S300-S303 PolarHBondContact O-OG 2.9Å
301	S	35.4	Very low	48.2	Very low	111 Å²	111	86.6 Å²	86.6	78%	0.776	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-56.4	-27	179.3	51.9	0	0	0	0	112.5	I299 S303 V304	I299-S301 PolarHBondContact O-N 3.1Å; S301-S303 VanDerWaalsContact C-N 3.28Å; S301-S303 PolarHBondContact O-N 3.48Å; S301-V304 PolarHBondContact O-N 3.03Å
302	S	39.4	Very low	51.2	Low	96 Å²	96	77 Å²	77	67%	0.671	43%	0.427	S	S	*	.	G	3₁₀ helix	trans	-66.6	-16.8	174.4	61.6	0	0	0	0	115.9	S300	S300-S302 PolarHBondContact O-N 3.36Å; S300-S302 PolarHBondContact OG-OG 3.45Å
303	S	52.5	Low	54.3	Low	65 Å²	65	69.5 Å²	69.5	46%	0.455	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-92.7	-13.2	177.8	61.2	0	0	0	0	113.9	S300 S301	S300-S303 PolarHBondContact O-N 3.45Å; S300-S303 PolarHBondContact O-OG 2.9Å; S301-S303 VanDerWaalsContact C-N 3.28Å; S301-S303 PolarHBondContact O-N 3.48Å
304	V	62.4	Low	57.2	Low	33 Å²	33	67.2 Å²	67.2	20%	0.2	38%	0.376	C	S	.	.			trans	-93.7	134.9	178.4	-177.3	0	0	0	0	109.5	I299 S301 L420 R421 L423	I299-V304 HydrophobicContact CG2-CG2 3.41Å; I299-V304 VanDerWaalsContact CG2-CG2 3.41Å; S301-V304 PolarHBondContact O-N 3.03Å; V304-L420 HydrophobicContact CG1-CD1 3.39Å; V304-L420 HydrophobicContact CG1-CD2 4.41Å; V304-L420 HydrophobicContact CG1-CG 3.87Å; V304-R421 CarbonylContact C-O 3.52Å; V304-R421 WeakPolarHBondContact CA-O 3.49Å; V304-L423 HydrophobicContact CG2-CD2 4.1Å
305	K	68.7	Low	59.8	Low	138 Å²	138	69.5 Å²	69.5	60%	0.6	38%	0.384	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-131.8	127.7	176.4	-67	-169.8	176.4	-171.2	0	110.9	R421	K305-R421 PolarHBondContact N-O 2.94Å; K305-R421 PolarHBondContact O-N 3.23Å
306	L	76.8	Confident	62.3	Low	50 Å²	50	66.4 Å²	66.4	26%	0.262	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	142.2	159	-76.6	165.5	0	0	0	109.3	F249 L250 L387 T418 L419 L420	F249-L306 HydrophobicContact CD1-CD1 3.46Å; F249-L306 VanDerWaalsContact CD1-CD1 3.46Å; F249-L306 HydrophobicContact CE1-CD1 3.75Å; L250-L306 HydrophobicContact CD2-CD1 4.23Å; L306-L387 HydrophobicContact CD2-CD1 3.72Å; L306-T418 HydrophobicContact CD2-CG2 3.81Å; L306-L419 CarbonylContact C-O 3.52Å; L306-L419 WeakPolarHBondContact CA-O 3.19Å; L306-L420 HydrophobicContact CD2-CD1 3.71Å; L306-L420 HydrophobicContact CG-CD1 3.87Å
307	I	80.5	Confident	65.2	Low	28 Å²	28	61.9 Å²	61.9	14%	0.144	37%	0.365	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	115.6	179	-55.2	174.9	0	0	0	107.5	L419 R421	I307-L419 HydrophobicContact CB-CB 4.36Å; I307-L419 PolarHBondContact N-O 2.87Å; I307-L419 PolarHBondContact O-N 3.42Å; I307-R421 HydrophobicContact CD1-CB 3.9Å
308	D	81.5	Confident	67.9	Low	64 Å²	64	60.2 Å²	60.2	34%	0.342	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	129.6	169.8	-66.7	-59	0	0	0	109.3	V417 T418	D308-V417 WeakPolarHBondContact CA-O 3.37Å; D308-T418 VanDerWaalsContact OD1-CB 3.27Å; D308-T418 WeakPolarHBondContact OD1-CB 3.33Å; D308-T418 WeakPolarHBondContact OD1-CG2 3.44Å; D308-T418 PolarHBondContact OD1-OG1 3.07Å
309	T	82.9	Confident	70.7	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.006	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.9	163.4	-179.4	-173.9	0	0	0	0	109.7	Y366 N367 I380 V417	T309-Y366 PolarHBondContact OG1-O 2.92Å; T309-N367 PolarHBondContact OG1-OD1 2.97Å; T309-I380 HydrophobicContact CG2-CD1 3.98Å; T309-I380 HydrophobicContact CG2-CG1 3.91Å; T309-V417 HydrophobicContact CG2-CG2 3.74Å; T309-V417 PolarHBondContact N-O 2.72Å; T309-V417 WeakPolarHBondContact O-CG2 2.97Å; T309-V417 PolarHBondContact O-N 3.35Å
310	C	84.5	Confident	73.3	Confident	26 Å²	26	52.2 Å²	52.2	18%	0.176	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	125.5	178.7	-71.7	0	0	0	0	110.8	T365 Y366 V415	C310-T365 CarbonylContact O-C 3.59Å; C310-T365 VanDerWaalsContact O-CA 3.22Å; C310-T365 WeakPolarHBondContact O-CA 3.23Å; C310-Y366 PolarHBondContact N-O 2.84Å; C310-Y366 PolarHBondContact O-N 2.76Å; C310-V415 WeakPolarHBondContact CA-O 3.47Å
311	L	86.9	Confident	75.9	Confident	1 Å²	1	52.3 Å²	52.3	1%	0.005	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	137.8	172.6	-84.2	169.1	0	0	0	110.6	F318 L320 V363 T365 I380 A414 V415 V417	L311-F318 HydrophobicContact CB-CD1 3.76Å; L311-F318 HydrophobicContact CB-CE1 3.8Å; L311-F318 HydrophobicContact CD1-CD1 4.32Å; L311-F318 HydrophobicContact CG-CD1 4.46Å; L311-L320 HydrophobicContact CD1-CD1 3.55Å; L311-L320 HydrophobicContact CD2-CD1 4.14Å; L311-L320 HydrophobicContact CG-CD1 4.49Å; L311-V363 HydrophobicContact CD2-CG1 3.61Å; L311-T365 HydrophobicContact CD2-CG2 3.92Å; L311-I380 HydrophobicContact CD1-CD1 4.19Å; L311-I380 HydrophobicContact CD2-CD1 3.54Å; L311-I380 HydrophobicContact CG-CD1 3.76Å; L311-A414 CarbonylContact O-C 3.54Å; L311-A414 VanDerWaalsContact O-CA 3.22Å; L311-A414 WeakPolarHBondContact O-CA 3.24Å; L311-V415 HydrophobicContact CB-CG1 4.03Å; L311-V415 PolarHBondContact N-O 2.79Å; L311-V415 PolarHBondContact O-N 2.87Å; L311-V417 HydrophobicContact CD1-CG1 3.82Å; L311-V417 HydrophobicContact CD1-CG2 3.98Å; L311-V417 HydrophobicContact CG-CG2 4.13Å
312	I	85.1	Confident	78.4	Confident	30 Å²	30	48.6 Å²	48.6	15%	0.154	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.8	135	169.4	-46	-176.6	0	0	0	110.2	F318 I364 Y366 A414	I312-F318 WeakPolarHBondContact O-CD1 3.23Å; I312-I364 HydrophobicContact CB-CB 4.27Å; I312-I364 HydrophobicContact CD1-CB 4.02Å; I312-I364 HydrophobicContact CD1-CD1 4.5Å; I312-I364 HydrophobicContact CD1-CG2 3.47Å; I312-I364 VanDerWaalsContact CD1-CG2 3.47Å; I312-I364 HydrophobicContact CG1-CB 4.18Å; I312-I364 HydrophobicContact CG1-CG2 4Å; I312-I364 PolarHBondContact N-O 2.9Å; I312-I364 VanDerWaalsContact N-O 3.17Å; I312-Y366 HydrophobicContact CD1-CD2 4.02Å; I312-Y366 HydrophobicContact CD1-CE2 3.64Å; I312-Y366 HydrophobicContact CG1-CD2 4.36Å; I312-Y366 HydrophobicContact CG1-CE2 4.43Å; I312-A414 HydrophobicContact CG1-CB 4.45Å
313	K	88.3	Confident	80.3	Confident	35 Å²	35	45.2 Å²	45.2	15%	0.152	26%	0.263	C	S	.	.	P	Polyproline II helix	trans	-80.9	117	171.5	-168.5	-177.2	169.8	-174.4	0	110.5	G317 F318 A407 V409 V411 G412 S413	K313-G317 CarbonylContact C-O 3.59Å; K313-F318 HydrophobicContact CB-CD1 4.2Å; K313-F318 HydrophobicContact CB-CE1 3.66Å; K313-F318 HydrophobicContact CB-CE2 4.03Å; K313-F318 HydrophobicContact CB-CZ 3.58Å; K313-F318 HydrophobicContact CD-CE2 4.23Å; K313-F318 HydrophobicContact CD-CZ 4.47Å; K313-F318 HydrophobicContact CG-CD2 4.35Å; K313-F318 HydrophobicContact CG-CE1 4.45Å; K313-F318 HydrophobicContact CG-CE2 4.06Å; K313-F318 HydrophobicContact CG-CZ 4.14Å; K313-F318 VanDerWaalsContact N-CE1 3.32Å; K313-A407 PolarHBondContact NZ-O 3.24Å; K313-V409 HydrophobicContact CB-CG1 4.27Å; K313-V409 HydrophobicContact CD-CB 4.29Å; K313-V409 WeakPolarHBondContact CD-O 3.49Å; K313-V409 WeakPolarHBondContact CE-O 3.35Å; K313-V409 PolarHBondContact NZ-O 3.31Å; K313-V411 HydrophobicContact CD-CG2 4.29Å; K313-V411 HydrophobicContact CG-CG2 4.47Å; K313-G412 PolarHBondContact O-N 3.09Å; K313-S413 PolarHBondContact N-O 3.49Å
314	K	83.8	Confident	81.6	Confident	59 Å²	59	43.6 Å²	43.6	26%	0.257	26%	0.256	S	S	.	.	B	Isolated β-bridge	trans	-85.4	172.8	168.3	-81.1	-178.6	161.5	-178.5	0	111.8	S316 G317 D362	K314-S316 WeakPolarHBondContact CB-OG 3.48Å; K314-S316 PolarHBondContact O-N 3.03Å; K314-G317 PolarHBondContact N-O 3.5Å; K314-G317 WeakPolarHBondContact O-CA 3.41Å; K314-G317 PolarHBondContact O-N 2.8Å; K314-D362 WeakPolarHBondContact CD-O 3.29Å; K314-D362 WeakPolarHBondContact CD-OD2 3.39Å; K314-D362 VanDerWaalsContact CE-O 3.25Å; K314-D362 WeakPolarHBondContact CE-O 3.23Å; K314-D362 VanDerWaalsContact NZ-CB 3.33Å; K314-D362 PolarHBondContact NZ-O 2.91Å; K314-D362 IonicContact NZ-OD2 2.87Å; K314-D362 PolarHBondContact NZ-OD2 3.14Å
315	P	82.1	Confident	82	Confident	122 Å²	122	42.9 Å²	42.9	79%	0.792	25%	0.252	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-34.8	165.5	-25.2	34.9	0	0	0	112.5	G317 V411	P315-G317 PolarHBondContact O-N 2.86Å; P315-G317 VanDerWaalsContact O-N 3.17Å; P315-V411 HydrophobicContact CG-CG1 4Å
316	S	78.4	Confident	81.9	Confident	76 Å²	76	41 Å²	41	53%	0.531	25%	0.248	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.8	3.3	170.9	47.3	0	0	0	0	114.8	K314 D362	K314-S316 WeakPolarHBondContact CB-OG 3.48Å; K314-S316 PolarHBondContact O-N 3.03Å; S316-D362 PolarHBondContact OG-OD2 2.75Å
317	G	85	Confident	81.1	Confident	21 Å²	21	39.1 Å²	39.1	22%	0.216	24%	0.238	C	C	.	.	B	Isolated β-bridge	trans	83.5	-137.1	-172.7	0	0	0	0	0	112.1	K313 K314 P315	K313-G317 CarbonylContact C-O 3.59Å; K314-G317 PolarHBondContact N-O 3.5Å; K314-G317 WeakPolarHBondContact O-CA 3.41Å; K314-G317 PolarHBondContact O-N 2.8Å; P315-G317 PolarHBondContact O-N 2.86Å; P315-G317 VanDerWaalsContact O-N 3.17Å
318	F	85.8	Confident	80.1	Confident	23 Å²	23	39.5 Å²	39.5	10%	0.101	24%	0.239	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.2	0.1	-177.6	-79	-69.4	0	0	0	114.6	L311 I312 K313 L320 V363 L406 V409 V415	L311-F318 HydrophobicContact CB-CD1 3.76Å; L311-F318 HydrophobicContact CB-CE1 3.8Å; L311-F318 HydrophobicContact CD1-CD1 4.32Å; L311-F318 HydrophobicContact CG-CD1 4.46Å; I312-F318 WeakPolarHBondContact O-CD1 3.23Å; K313-F318 HydrophobicContact CB-CD1 4.2Å; K313-F318 HydrophobicContact CB-CE1 3.66Å; K313-F318 HydrophobicContact CB-CE2 4.03Å; K313-F318 HydrophobicContact CB-CZ 3.58Å; K313-F318 HydrophobicContact CD-CE2 4.23Å; K313-F318 HydrophobicContact CD-CZ 4.47Å; K313-F318 HydrophobicContact CG-CD2 4.35Å; K313-F318 HydrophobicContact CG-CE1 4.45Å; K313-F318 HydrophobicContact CG-CE2 4.06Å; K313-F318 HydrophobicContact CG-CZ 4.14Å; K313-F318 VanDerWaalsContact N-CE1 3.32Å; F318-L320 PolarHBondContact O-N 2.71Å; F318-V363 WeakPolarHBondContact O-CG2 3.33Å; F318-L406 HydrophobicContact CD2-CB 3.94Å; F318-L406 HydrophobicContact CD2-CD2 4.25Å; F318-L406 HydrophobicContact CD2-CG 4.49Å; F318-L406 HydrophobicContact CE2-CB 3.76Å; F318-L406 HydrophobicContact CE2-CD2 3.89Å; F318-L406 HydrophobicContact CE2-CG 4.37Å; F318-L406 WeakPolarHBondContact CE2-O 3.45Å; F318-L406 HydrophobicContact CZ-CD2 4.3Å; F318-V409 HydrophobicContact CE2-CB 4.26Å; F318-V409 HydrophobicContact CE2-CG2 4.36Å; F318-V409 HydrophobicContact CZ-CB 3.89Å; F318-V409 HydrophobicContact CZ-CG1 3.99Å; F318-V409 HydrophobicContact CZ-CG2 4.02Å; F318-V415 HydrophobicContact CE1-CG1 3.58Å; F318-V415 HydrophobicContact CE2-CG1 4.43Å; F318-V415 HydrophobicContact CZ-CB 4.45Å; F318-V415 HydrophobicContact CZ-CG1 3.46Å; F318-V415 VanDerWaalsContact CZ-CG1 3.46Å
319	G	83.6	Confident	79.2	Confident	19 Å²	19	36.9 Å²	36.9	20%	0.196	23%	0.225	C	C	.	.	S	Bend	trans	59.9	22.8	-177.9	0	0	0	0	0	115	S360 V363	G319-S360 WeakPolarHBondContact O-CB 3.42Å; G319-S360 PolarHBondContact O-N 3.21Å; G319-V363 VanDerWaalsContact O-CG2 3.24Å; G319-V363 WeakPolarHBondContact O-CG2 3.22Å
320	L	86.7	Confident	77.8	Confident	33 Å²	33	38 Å²	38	17%	0.173	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	136.8	178.4	-62.2	-176.9	0	0	0	110.8	L311 F318 I356 V359 V363 I380	L311-L320 HydrophobicContact CD1-CD1 3.55Å; L311-L320 HydrophobicContact CD2-CD1 4.14Å; L311-L320 HydrophobicContact CG-CD1 4.49Å; F318-L320 PolarHBondContact O-N 2.71Å; L320-I356 HydrophobicContact CD1-CD1 4.18Å; L320-I356 HydrophobicContact CD2-CG2 4.12Å; L320-V359 HydrophobicContact CD2-CB 4.17Å; L320-V359 HydrophobicContact CD2-CG1 3.94Å; L320-V359 HydrophobicContact CD2-CG2 3.8Å; L320-V363 HydrophobicContact CD2-CG2 4.24Å; L320-I380 HydrophobicContact CD2-CG2 4.05Å
321	T	84.1	Confident	76.4	Confident	67 Å²	67	37.5 Å²	37.5	41%	0.411	23%	0.228	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	137.1	166.3	60	0	0	0	0	110.4	I356 R357 S358	T321-I356 WeakPolarHBondContact O-CA 3.2Å; T321-R357 PolarHBondContact O-N 2.77Å; T321-R357 VanDerWaalsContact OG1-CB 3.24Å; T321-R357 WeakPolarHBondContact OG1-CB 3.24Å; T321-S358 WeakPolarHBondContact CG2-OG 3.42Å; T321-S358 PolarHBondContact N-O 2.72Å; T321-S358 PolarHBondContact OG1-N 2.78Å; T321-S358 PolarHBondContact OG1-OG 2.72Å
322	L	86.9	Confident	74.4	Confident	34 Å²	34	40.9 Å²	40.9	18%	0.178	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	135.7	-175.6	-61.4	179.1	0	0	0	111	I356 L386 A402 L406	L322-I356 HydrophobicContact CD2-CG1 3.85Å; L322-L386 HydrophobicContact CD1-CD2 3.95Å; L322-L386 HydrophobicContact CD2-CD2 4Å; L322-A402 HydrophobicContact CD1-CB 4.18Å; L322-L406 HydrophobicContact CD1-CD1 4.35Å
323	S	79.6	Confident	72.7	Confident	24 Å²	24	41 Å²	41	17%	0.168	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.2	132.6	175.4	-166.6	0	0	0	0	110.6	V325 Q355 R357	S323-V325 PolarHBondContact O-N 3.29Å; S323-Q355 PolarHBondContact N-O 3.3Å; S323-Q355 PolarHBondContact O-N 3.49Å; S323-R357 PolarHBondContact OG-NH2 3.09Å
324	G	79.9	Confident	70.8	Confident	31 Å²	31	41.8 Å²	41.8	32%	0.32	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	106.9	-179	0	0	0	0	0	111.3	L353	G324-L353 CarbonylContact C-O 3.41Å; G324-L353 WeakPolarHBondContact CA-O 3.49Å
325	V	71.6	Confident	68.9	Low	18 Å²	18	44.7 Å²	44.7	11%	0.109	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	129.2	180	-164.8	0	0	0	0	109.7	S323 L353 Q355 I425	S323-V325 PolarHBondContact O-N 3.29Å; V325-L353 PolarHBondContact N-O 2.92Å; V325-L353 PolarHBondContact O-N 3.38Å; V325-Q355 HydrophobicContact CG2-CB 3.81Å; V325-I425 HydrophobicContact CB-CG2 4.44Å; V325-I425 HydrophobicContact CG1-CG2 3.62Å
326	I	65.8	Low	66.5	Low	100 Å²	100	41.8 Å²	41.8	51%	0.513	27%	0.267	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	132.6	172	-62.2	173.8	0	0	0	107.8	F350	I326-F350 HydrophobicContact CG2-CB 4.42Å; I326-F350 HydrophobicContact CG2-CD1 4.14Å
327	T	60.2	Low	64.4	Low	10 Å²	10	45 Å²	45	6%	0.061	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.6	136.3	-176.2	-65	0	0	0	0	110.7	W295 I329 F350 Q351 I425	W295-T327 HydrophobicContact CH2-CG2 4.25Å; W295-T327 HydrophobicContact CZ3-CG2 4.43Å; T327-I329 PolarHBondContact O-N 3.05Å; T327-F350 WeakPolarHBondContact O-CA 3.38Å; T327-Q351 PolarHBondContact N-O 3.46Å; T327-Q351 PolarHBondContact O-N 2.72Å; T327-I425 HydrophobicContact CG2-CD1 4.06Å; T327-I425 HydrophobicContact CG2-CG1 4.21Å; T327-I425 WeakPolarHBondContact OG1-CG2 3.32Å
328	F	60.4	Low	62	Low	36 Å²	36	47.5 Å²	47.5	16%	0.158	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	120.8	168.5	-177.5	-97.7	0	0	0	109.2	W295 P330 F350	W295-F328 HydrophobicContact CE3-CB 4.39Å; W295-F328 HydrophobicContact CH2-CB 4.44Å; W295-F328 HydrophobicContact CZ3-CB 3.78Å; F328-P330 HydrophobicContact CD1-CG 4.04Å; F328-P330 HydrophobicContact CE1-CB 4.28Å; F328-P330 HydrophobicContact CE1-CG 3.95Å; F328-P330 WeakPolarHBondContact O-CD 3.49Å; F328-F350 HydrophobicContact CB-CD1 3.94Å; F328-F350 HydrophobicContact CB-CE1 3.69Å; F328-F350 HydrophobicContact CB-CZ 4.03Å; F328-F350 HydrophobicContact CD2-CD2 4.02Å; F328-F350 HydrophobicContact CD2-CE1 4.39Å; F328-F350 AromaticContact CD2-CE2 3.78Å; F328-F350 HydrophobicContact CD2-CE2 3.78Å; F328-F350 HydrophobicContact CD2-CG 4.43Å; F328-F350 AromaticContact CD2-CZ 3.98Å; F328-F350 HydrophobicContact CD2-CZ 3.98Å; F328-F350 HydrophobicContact CG-CZ 4.44Å
329	I	61.7	Low	59.4	Low	8 Å²	8	53.7 Å²	53.7	4%	0.041	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	107.5	172.9	-51.2	-177	0	0	0	107.1	T327 I333 L334 G348 F349 Q351 L353	T327-I329 PolarHBondContact O-N 3.05Å; I329-I333 HydrophobicContact CG2-CB 4.02Å; I329-I333 HydrophobicContact CG2-CG2 4.07Å; I329-L334 HydrophobicContact CD1-CD1 3.9Å; I329-L334 HydrophobicContact CG2-CB 4.47Å; I329-L334 HydrophobicContact CG2-CD1 3.81Å; I329-L334 HydrophobicContact CG2-CG 3.82Å; I329-G348 CarbonylContact O-C 3.49Å; I329-G348 WeakPolarHBondContact O-CA 3.43Å; I329-F349 HydrophobicContact CD1-CE2 4.4Å; I329-F349 PolarHBondContact N-O 2.6Å; I329-F349 PolarHBondContact O-N 3.25Å; I329-Q351 HydrophobicContact CD1-CB 3.68Å; I329-Q351 HydrophobicContact CD1-CG 4.34Å; I329-Q351 HydrophobicContact CG1-CB 4.29Å; I329-L353 HydrophobicContact CD1-CD1 4.17Å; I329-L353 HydrophobicContact CD1-CD2 4.24Å; I329-L353 HydrophobicContact CD1-CG 4.49Å
330	P	53.8	Low	57	Low	25 Å²	25	54.9 Å²	54.9	16%	0.162	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	141.1	168.3	-19.8	30.6	0	0	0	109.9	P297 F328 G332 I333	P297-P330 HydrophobicContact CB-CG 4.47Å; P297-P330 HydrophobicContact CG-CG 4.23Å; F328-P330 HydrophobicContact CD1-CG 4.04Å; F328-P330 HydrophobicContact CE1-CB 4.28Å; F328-P330 HydrophobicContact CE1-CG 3.95Å; F328-P330 WeakPolarHBondContact O-CD 3.49Å; P330-G332 PolarHBondContact O-N 2.86Å; P330-G332 VanDerWaalsContact O-N 3.08Å; P330-I333 HydrophobicContact CB-CG1 4.26Å; P330-I333 HydrophobicContact CG-CD1 4.02Å; P330-I333 HydrophobicContact CG-CG1 4.17Å; P330-I333 WeakPolarHBondContact O-CB 3.4Å; P330-I333 PolarHBondContact O-N 2.9Å
331	N	54.3	Low	54.4	Low	16 Å²	16	61.1 Å²	61.1	9%	0.086	36%	0.356	C	S	.	.	H	α-helix	trans	-56.3	-33.6	-175.9	-77.5	-1.7	0	0	0	112.1	I333 L334 D335 V336 K347 G348	N331-I333 VanDerWaalsContact C-N 3.29Å; N331-I333 PolarHBondContact O-N 2.8Å; N331-L334 PolarHBondContact O-N 3.36Å; N331-D335 WeakPolarHBondContact O-CA 3.45Å; N331-D335 PolarHBondContact O-N 2.92Å; N331-V336 WeakPolarHBondContact CB-O 3.22Å; N331-V336 PolarHBondContact O-N 3.02Å; N331-V336 VanDerWaalsContact O-N 3.1Å; N331-K347 HydrophobicContact CB-CB 4.45Å; N331-K347 WeakPolarHBondContact CB-O 3.35Å; N331-K347 PolarHBondContact N-O 3.15Å; N331-G348 VanDerWaalsContact OD1-CA 3.27Å; N331-G348 WeakPolarHBondContact OD1-CA 3.36Å
332	G	45.6	Very low	52.2	Low	71 Å²	71	64.3 Å²	64.3	73%	0.732	37%	0.37	S	S	*	.	H	α-helix	trans	-72.9	-4.5	175.3	0	0	0	0	0	116.5	P330	P330-G332 PolarHBondContact O-N 2.86Å; P330-G332 VanDerWaalsContact O-N 3.08Å
333	I	49.6	Very low	49.5	Very low	34 Å²	34	68.7 Å²	68.7	17%	0.174	40%	0.403	C	S	.	.	H	α-helix	trans	-86.3	-26	170.6	-67.1	-163.7	0	0	0	111.7	I299 I329 P330 N331 L423	I299-I333 HydrophobicContact CB-CD1 3.97Å; I299-I333 HydrophobicContact CD1-CD1 3.81Å; I299-I333 HydrophobicContact CG1-CD1 4.36Å; I299-I333 HydrophobicContact CG2-CD1 4.25Å; I329-I333 HydrophobicContact CG2-CB 4.02Å; I329-I333 HydrophobicContact CG2-CG2 4.07Å; P330-I333 HydrophobicContact CB-CG1 4.26Å; P330-I333 HydrophobicContact CG-CD1 4.02Å; P330-I333 HydrophobicContact CG-CG1 4.17Å; P330-I333 WeakPolarHBondContact O-CB 3.4Å; P330-I333 PolarHBondContact O-N 2.9Å; N331-I333 VanDerWaalsContact C-N 3.29Å; N331-I333 PolarHBondContact O-N 2.8Å; I333-L423 HydrophobicContact CD1-CD2 4.23Å; I333-L423 HydrophobicContact CG2-CD2 4.02Å
334	L	49	Very low	47.4	Very low	50 Å²	50	74 Å²	74	26%	0.262	43%	0.429	S	S	.	.	H	α-helix	trans	-116.8	9.3	176.2	-72.4	-180	0	0	0	113.6	F249 I329 N331 V336 F349	F249-L334 HydrophobicContact CE2-CD2 4.39Å; F249-L334 HydrophobicContact CZ-CD2 4.3Å; I329-L334 HydrophobicContact CD1-CD1 3.9Å; I329-L334 HydrophobicContact CG2-CB 4.47Å; I329-L334 HydrophobicContact CG2-CD1 3.81Å; I329-L334 HydrophobicContact CG2-CG 3.82Å; N331-L334 PolarHBondContact O-N 3.36Å; L334-V336 HydrophobicContact CB-CG2 3.68Å; L334-V336 WeakPolarHBondContact O-CG2 3.42Å; L334-V336 PolarHBondContact O-N 2.92Å; L334-F349 HydrophobicContact CD1-CZ 3.92Å
335	D	42.3	Very low	45.7	Very low	120 Å²	120	83.9 Å²	83.9	64%	0.642	46%	0.457	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	27.4	-176.6	-148.9	28.4	0	0	0	113.6	F249 N331 N337	F249-D335 HydrophobicContact CE2-CB 4.47Å; N331-D335 WeakPolarHBondContact O-CA 3.45Å; N331-D335 PolarHBondContact O-N 2.92Å; D335-N337 PolarHBondContact O-N 3.39Å; D335-N337 VanDerWaalsContact O-N 3.12Å
336	V	33.2	Very low	44.6	Very low	61 Å²	61	90 Å²	90	37%	0.37	49%	0.485	S	S	.	.			trans	-84.5	91.9	-177.5	-175	0	0	0	0	108.2	N331 L334 I338 F349	N331-V336 WeakPolarHBondContact CB-O 3.22Å; N331-V336 PolarHBondContact O-N 3.02Å; N331-V336 VanDerWaalsContact O-N 3.1Å; L334-V336 HydrophobicContact CB-CG2 3.68Å; L334-V336 WeakPolarHBondContact O-CG2 3.42Å; L334-V336 PolarHBondContact O-N 2.92Å; V336-I338 VanDerWaalsContact C-N 3.25Å; V336-I338 HydrophobicContact CG1-CD1 4.42Å; V336-I338 HydrophobicContact CG1-CG1 3.77Å; V336-I338 PolarHBondContact O-N 2.93Å; V336-F349 HydrophobicContact CB-CE1 4.45Å; V336-F349 HydrophobicContact CG2-CE1 4.35Å
337	N	33.1	Very low	44	Very low	145 Å²	145	90.3 Å²	90.3	78%	0.775	48%	0.482	S	S	*	.			trans	-75.9	74.6	-179.9	-159.4	7.9	0	0	0	111.6	D335 M339	D335-N337 PolarHBondContact O-N 3.39Å; D335-N337 VanDerWaalsContact O-N 3.12Å; N337-M339 PolarHBondContact O-N 3.21Å
338	I	34.1	Very low	44	Very low	73 Å²	73	90.8 Å²	90.8	37%	0.374	49%	0.489	S	S	.	.			trans	-65.3	116	174.2	-51.7	-179.6	0	0	0	108.8	V336 S340 F349	V336-I338 VanDerWaalsContact C-N 3.25Å; V336-I338 HydrophobicContact CG1-CD1 4.42Å; V336-I338 HydrophobicContact CG1-CG1 3.77Å; V336-I338 PolarHBondContact O-N 2.93Å; I338-S340 VanDerWaalsContact C-N 3.27Å; I338-S340 PolarHBondContact O-N 2.81Å; I338-F349 HydrophobicContact CD1-CD1 4.32Å
339	M	31.7	Very low	43.8	Very low	153 Å²	153	91.1 Å²	91.1	75%	0.754	49%	0.491	S	S	*	.			trans	-71.6	80.2	170.6	-74	178.7	62	0	0	110.7	N337	N337-M339 PolarHBondContact O-N 3.21Å
340	S	33.6	Very low	43.9	Very low	44 Å²	44	97.4 Å²	97.4	31%	0.308	52%	0.518	S	S	.	.			trans	-95.1	116	165	52.8	0	0	0	0	110.6	I338 L342	I338-S340 VanDerWaalsContact C-N 3.27Å; I338-S340 PolarHBondContact O-N 2.81Å; S340-L342 PolarHBondContact O-N 2.89Å
341	N	32.9	Very low	44.5	Very low	164 Å²	164	98.1 Å²	98.1	88%	0.877	52%	0.519	S	S	*	.			trans	-78.3	41.4	170.6	-74.3	-3.2	0	0	0	111.5
342	L	37.1	Very low	45.4	Very low	134 Å²	134	102.1 Å²	102.1	70%	0.702	53%	0.533	S	S	*	.			trans	-122.6	117.2	-179.4	-79.6	159.7	0	0	0	108.5	S340 D344	S340-L342 PolarHBondContact O-N 2.89Å; L342-D344 VanDerWaalsContact C-N 3.33Å; L342-D344 PolarHBondContact O-N 3.17Å; L342-D344 VanDerWaalsContact O-N 3.09Å
343	S	30.8	Very low	47.1	Very low	126 Å²	126	98.9 Å²	98.9	88%	0.881	50%	0.499	S	S	*	.			trans	-85.1	65.7	-171.8	54.7	0	0	0	0	112.1
344	D	35.4	Very low	48.8	Very low	134 Å²	134	97.2 Å²	97.2	72%	0.717	49%	0.49	S	S	*	.	S	Bend	trans	-145.8	164	168.5	-134.8	-35.3	0	0	0	115.3	L342 Q346	L342-D344 VanDerWaalsContact C-N 3.33Å; L342-D344 PolarHBondContact O-N 3.17Å; L342-D344 VanDerWaalsContact O-N 3.09Å; D344-Q346 VanDerWaalsContact C-N 3.3Å; D344-Q346 PolarHBondContact O-N 3.23Å
345	R	44.6	Very low	50.6	Low	239 Å²	239	95.8 Å²	95.8	90%	0.902	48%	0.482	S	S	*	.	S	Bend	trans	-78.7	12.6	-152.4	-68.4	-179.2	167.5	-174.7	-2.2	116.8
346	Q	47.3	Very low	52.7	Low	148 Å²	148	90 Å²	90	69%	0.692	45%	0.452	S	S	*	.			trans	-120.8	71.2	-175	-61.6	-163.3	26.9	0	0	113.9	D344 G348	D344-Q346 VanDerWaalsContact C-N 3.3Å; D344-Q346 PolarHBondContact O-N 3.23Å; Q346-G348 PolarHBondContact O-N 2.82Å
347	K	53.7	Low	55.1	Low	105 Å²	105	91.8 Å²	91.8	46%	0.457	45%	0.452	S	S	.	.			trans	-83.3	88.8	172.8	-70.3	-160.8	173	-162.1	0	112	N331	N331-K347 HydrophobicContact CB-CB 4.45Å; N331-K347 WeakPolarHBondContact CB-O 3.35Å; N331-K347 PolarHBondContact N-O 3.15Å
348	G	59	Low	57.4	Low	20 Å²	20	87.2 Å²	87.2	21%	0.206	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-167	175.1	173	0	0	0	0	0	112.1	I329 N331 Q346	I329-G348 CarbonylContact O-C 3.49Å; I329-G348 WeakPolarHBondContact O-CA 3.43Å; N331-G348 VanDerWaalsContact OD1-CA 3.27Å; N331-G348 WeakPolarHBondContact OD1-CA 3.36Å; Q346-G348 PolarHBondContact O-N 2.82Å
349	F	57	Low	59.9	Low	43 Å²	43	85.2 Å²	85.2	19%	0.189	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	148.2	178	63.6	-85.7	0	0	0	112.1	I329 L334 V336 I338 Q351	I329-F349 HydrophobicContact CD1-CE2 4.4Å; I329-F349 PolarHBondContact N-O 2.6Å; I329-F349 PolarHBondContact O-N 3.25Å; L334-F349 HydrophobicContact CD1-CZ 3.92Å; V336-F349 HydrophobicContact CB-CE1 4.45Å; V336-F349 HydrophobicContact CG2-CE1 4.35Å; I338-F349 HydrophobicContact CD1-CD1 4.32Å; F349-Q351 HydrophobicContact CD2-CB 4.27Å; F349-Q351 HydrophobicContact CE2-CB 4.05Å; F349-Q351 HydrophobicContact CE2-CG 4.38Å
350	F	63.6	Low	62.1	Low	140 Å²	140	80.2 Å²	80.2	61%	0.614	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.8	129.8	173	-72.5	-87.6	0	0	0	110.8	I326 T327 F328	I326-F350 HydrophobicContact CG2-CB 4.42Å; I326-F350 HydrophobicContact CG2-CD1 4.14Å; T327-F350 WeakPolarHBondContact O-CA 3.38Å; F328-F350 HydrophobicContact CB-CD1 3.94Å; F328-F350 HydrophobicContact CB-CE1 3.69Å; F328-F350 HydrophobicContact CB-CZ 4.03Å; F328-F350 HydrophobicContact CD2-CD2 4.02Å; F328-F350 HydrophobicContact CD2-CE1 4.39Å; F328-F350 AromaticContact CD2-CE2 3.78Å; F328-F350 HydrophobicContact CD2-CE2 3.78Å; F328-F350 HydrophobicContact CD2-CG 4.43Å; F328-F350 AromaticContact CD2-CZ 3.98Å; F328-F350 HydrophobicContact CD2-CZ 3.98Å; F328-F350 HydrophobicContact CG-CZ 4.44Å
351	Q	66.5	Low	64.1	Low	40 Å²	40	86 Å²	86	19%	0.187	43%	0.43	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	145.2	175.9	-164.2	70.8	15.2	0	0	109.9	T327 I329 F349 L353 A395	T327-Q351 PolarHBondContact N-O 3.46Å; T327-Q351 PolarHBondContact O-N 2.72Å; I329-Q351 HydrophobicContact CD1-CB 3.68Å; I329-Q351 HydrophobicContact CD1-CG 4.34Å; I329-Q351 HydrophobicContact CG1-CB 4.29Å; F349-Q351 HydrophobicContact CD2-CB 4.27Å; F349-Q351 HydrophobicContact CE2-CB 4.05Å; F349-Q351 HydrophobicContact CE2-CG 4.38Å; Q351-L353 HydrophobicContact CG-CD2 4.32Å; Q351-A395 PolarHBondContact NE2-O 3.1Å
352	R	72.9	Confident	65.9	Low	101 Å²	101	80.4 Å²	80.4	38%	0.381	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	124.7	162.5	-179.6	173.6	-78	145.5	-5.4	109.4	G396 C397	R352-G396 WeakPolarHBondContact O-CA 3.37Å; R352-G396 PolarHBondContact O-N 3.13Å; R352-C397 WeakPolarHBondContact CD-O 3.22Å; R352-C397 WeakPolarHBondContact CG-O 3.21Å
353	L	81.4	Confident	67.6	Low	2 Å²	2	75.4 Å²	75.4	1%	0.01	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	153.4	177.3	-65.9	179.3	0	0	0	109.3	G324 V325 I329 Q351 I385 L387 A395 L423 I425	G324-L353 CarbonylContact C-O 3.41Å; G324-L353 WeakPolarHBondContact CA-O 3.49Å; V325-L353 PolarHBondContact N-O 2.92Å; V325-L353 PolarHBondContact O-N 3.38Å; I329-L353 HydrophobicContact CD1-CD1 4.17Å; I329-L353 HydrophobicContact CD1-CD2 4.24Å; I329-L353 HydrophobicContact CD1-CG 4.49Å; Q351-L353 HydrophobicContact CG-CD2 4.32Å; L353-I385 HydrophobicContact CB-CG2 3.74Å; L353-I385 HydrophobicContact CD1-CG2 4.24Å; L353-I385 HydrophobicContact CD2-CG2 4.19Å; L353-I385 HydrophobicContact CG-CG2 4.27Å; L353-L387 HydrophobicContact CD2-CD2 4.19Å; L353-A395 HydrophobicContact CD2-CB 3.9Å; L353-L423 HydrophobicContact CD1-CD1 4.07Å; L353-I425 HydrophobicContact CD1-CD1 3.89Å
354	L	84.9	Confident	69.3	Low	0 Å²	0	72.6 Å²	72.6	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	103.3	-179.9	-58.4	-177.4	0	0	0	109.3	I385 L386 L394 P399 A402	L354-I385 CarbonylContact O-C 3.56Å; L354-I385 WeakPolarHBondContact O-CA 3.38Å; L354-L386 HydrophobicContact CB-CB 4.35Å; L354-L386 PolarHBondContact O-N 3.25Å; L354-L394 HydrophobicContact CD1-CB 3.97Å; L354-P399 HydrophobicContact CD2-CB 4.39Å; L354-P399 HydrophobicContact CD2-CG 3.96Å; L354-A402 HydrophobicContact CD1-CB 3.3Å
355	Q	86.9	Confident	70.6	Confident	19 Å²	19	67 Å²	67	9%	0.089	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	132.8	177.3	-174.8	165.8	61.3	0	0	110.3	S323 V325 R357 G383 D384 I385	S323-Q355 PolarHBondContact N-O 3.3Å; S323-Q355 PolarHBondContact O-N 3.49Å; V325-Q355 HydrophobicContact CG2-CB 3.81Å; Q355-R357 PolarHBondContact O-N 2.95Å; Q355-G383 PolarHBondContact NE2-O 2.69Å; Q355-D384 WeakPolarHBondContact CA-O 3.38Å; Q355-I385 HydrophobicContact CB-CD1 3.63Å; Q355-I385 HydrophobicContact CG-CD1 3.82Å
356	I	87.3	Confident	71.4	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	117.1	171.4	-62.1	177	0	0	0	107.7	L320 T321 L322 V359 I380 G383 D384 L419	L320-I356 HydrophobicContact CD1-CD1 4.18Å; L320-I356 HydrophobicContact CD2-CG2 4.12Å; T321-I356 WeakPolarHBondContact O-CA 3.2Å; L322-I356 HydrophobicContact CD2-CG1 3.85Å; I356-V359 HydrophobicContact CG2-CG2 3.69Å; I356-I380 HydrophobicContact CD1-CG2 3.41Å; I356-I380 VanDerWaalsContact CD1-CG2 3.41Å; I356-G383 PolarHBondContact O-N 3.29Å; I356-D384 HydrophobicContact CD1-CB 4.39Å; I356-D384 PolarHBondContact N-O 2.72Å; I356-L419 HydrophobicContact CD1-CD1 4.32Å; I356-L419 HydrophobicContact CD1-CD2 3.94Å
357	R	83.5	Confident	71.7	Confident	98 Å²	98	55.5 Å²	55.5	37%	0.37	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	-58.1	-179.5	-88.3	-79.8	-168.2	102.7	9.7	110.6	T321 S323 Q355 P382	T321-R357 PolarHBondContact O-N 2.77Å; T321-R357 VanDerWaalsContact OG1-CB 3.24Å; T321-R357 WeakPolarHBondContact OG1-CB 3.24Å; S323-R357 PolarHBondContact OG-NH2 3.09Å; Q355-R357 PolarHBondContact O-N 2.95Å; R357-P382 WeakPolarHBondContact O-CB 3.31Å
358	S	82.1	Confident	71.5	Confident	49 Å²	49	56.6 Å²	56.6	34%	0.343	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129	157	176.3	65.8	0	0	0	0	111.3	T321	T321-S358 WeakPolarHBondContact CG2-OG 3.42Å; T321-S358 PolarHBondContact N-O 2.72Å; T321-S358 PolarHBondContact OG1-N 2.78Å; T321-S358 PolarHBondContact OG1-OG 2.72Å
359	V	85	Confident	70.7	Confident	30 Å²	30	62 Å²	62	18%	0.182	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	121.4	175.7	-178	0	0	0	0	105.6	L320 I356 V363 I380 P382	L320-V359 HydrophobicContact CD2-CB 4.17Å; L320-V359 HydrophobicContact CD2-CG1 3.94Å; L320-V359 HydrophobicContact CD2-CG2 3.8Å; I356-V359 HydrophobicContact CG2-CG2 3.69Å; V359-V363 HydrophobicContact CG1-CB 4.08Å; V359-V363 HydrophobicContact CG1-CG1 4.44Å; V359-V363 HydrophobicContact CG1-CG2 3.83Å; V359-I380 HydrophobicContact CG2-CG2 4.13Å; V359-P382 HydrophobicContact CG2-CG 4.37Å
360	S	79.5	Confident	69.8	Low	49 Å²	49	67.9 Å²	67.9	34%	0.343	34%	0.343	S	S	.	.			trans	-68.7	147.5	176	174.2	0	0	0	0	110.8	G319 D362 V363	G319-S360 WeakPolarHBondContact O-CB 3.42Å; G319-S360 PolarHBondContact O-N 3.21Å; S360-D362 VanDerWaalsContact CB-OD1 3.24Å; S360-D362 WeakPolarHBondContact CB-OD1 3.47Å; S360-D362 PolarHBondContact O-N 3.39Å; S360-D362 VanDerWaalsContact O-N 3.13Å; S360-D362 PolarHBondContact OG-N 3.34Å; S360-D362 PolarHBondContact OG-OD1 2.84Å; S360-V363 WeakPolarHBondContact O-CB 3.33Å; S360-V363 VanDerWaalsContact O-CG2 3.29Å; S360-V363 WeakPolarHBondContact O-CG2 3.49Å; S360-V363 PolarHBondContact O-N 2.84Å; S360-V363 VanDerWaalsContact O-N 3.15Å
361	D	73.9	Confident	68.7	Low	166 Å²	166	65.9 Å²	65.9	89%	0.888	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.7	-18.3	172.2	-63.8	-45.6	0	0	0	112.3
362	D	71.4	Confident	67.5	Low	45 Å²	45	70.6 Å²	70.6	24%	0.241	37%	0.365	C	S	.	.	T	Hydrogen-bonded Turn	trans	-85.6	-0.8	179.3	100.6	-54.5	0	0	0	114.1	K314 S316 S360 I364	K314-D362 WeakPolarHBondContact CD-O 3.29Å; K314-D362 WeakPolarHBondContact CD-OD2 3.39Å; K314-D362 VanDerWaalsContact CE-O 3.25Å; K314-D362 WeakPolarHBondContact CE-O 3.23Å; K314-D362 VanDerWaalsContact NZ-CB 3.33Å; K314-D362 PolarHBondContact NZ-O 2.91Å; K314-D362 IonicContact NZ-OD2 2.87Å; K314-D362 PolarHBondContact NZ-OD2 3.14Å; S316-D362 PolarHBondContact OG-OD2 2.75Å; S360-D362 VanDerWaalsContact CB-OD1 3.24Å; S360-D362 WeakPolarHBondContact CB-OD1 3.47Å; S360-D362 PolarHBondContact O-N 3.39Å; S360-D362 VanDerWaalsContact O-N 3.13Å; S360-D362 PolarHBondContact OG-N 3.34Å; S360-D362 PolarHBondContact OG-OD1 2.84Å; D362-I364 PolarHBondContact O-N 3.35Å
363	V	72.6	Confident	65.9	Low	30 Å²	30	68 Å²	68	18%	0.182	36%	0.362	C	S	.	.			trans	-67.8	114.8	-179.9	176.7	0	0	0	0	112	L311 F318 G319 L320 V359 S360 T365	L311-V363 HydrophobicContact CD2-CG1 3.61Å; F318-V363 WeakPolarHBondContact O-CG2 3.33Å; G319-V363 VanDerWaalsContact O-CG2 3.24Å; G319-V363 WeakPolarHBondContact O-CG2 3.22Å; L320-V363 HydrophobicContact CD2-CG2 4.24Å; V359-V363 HydrophobicContact CG1-CB 4.08Å; V359-V363 HydrophobicContact CG1-CG1 4.44Å; V359-V363 HydrophobicContact CG1-CG2 3.83Å; S360-V363 WeakPolarHBondContact O-CB 3.33Å; S360-V363 VanDerWaalsContact O-CG2 3.29Å; S360-V363 WeakPolarHBondContact O-CG2 3.49Å; S360-V363 PolarHBondContact O-N 2.84Å; S360-V363 VanDerWaalsContact O-N 3.15Å; V363-T365 HydrophobicContact CG1-CG2 4.13Å
364	I	66.6	Low	63.9	Low	66 Å²	66	75.3 Å²	75.3	34%	0.338	40%	0.4	S	S	.	.			trans	-89.6	125.5	171.3	-52.9	172.2	0	0	0	109.4	I312 D362	I312-I364 HydrophobicContact CB-CB 4.27Å; I312-I364 HydrophobicContact CD1-CB 4.02Å; I312-I364 HydrophobicContact CD1-CD1 4.5Å; I312-I364 HydrophobicContact CD1-CG2 3.47Å; I312-I364 VanDerWaalsContact CD1-CG2 3.47Å; I312-I364 HydrophobicContact CG1-CB 4.18Å; I312-I364 HydrophobicContact CG1-CG2 4Å; I312-I364 PolarHBondContact N-O 2.9Å; I312-I364 VanDerWaalsContact N-O 3.17Å; D362-I364 PolarHBondContact O-N 3.35Å
365	T	63.6	Low	61.5	Low	18 Å²	18	78.4 Å²	78.4	11%	0.11	43%	0.432	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	146	170.8	44.4	0	0	0	0	111.8	C310 L311 V363 I380	C310-T365 CarbonylContact O-C 3.59Å; C310-T365 VanDerWaalsContact O-CA 3.22Å; C310-T365 WeakPolarHBondContact O-CA 3.23Å; L311-T365 HydrophobicContact CD2-CG2 3.92Å; V363-T365 HydrophobicContact CG1-CG2 4.13Å; T365-I380 HydrophobicContact CG2-CD1 3.55Å; T365-I380 HydrophobicContact CG2-CG1 3.94Å
366	Y	61.8	Low	59.2	Low	74 Å²	74	86.8 Å²	86.8	29%	0.29	47%	0.468	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	132.9	162.7	-77.3	-77.6	0	0	0	109.2	T309 C310 I312 Q372	T309-Y366 PolarHBondContact OG1-O 2.92Å; C310-Y366 PolarHBondContact N-O 2.84Å; C310-Y366 PolarHBondContact O-N 2.76Å; I312-Y366 HydrophobicContact CD1-CD2 4.02Å; I312-Y366 HydrophobicContact CD1-CE2 3.64Å; I312-Y366 HydrophobicContact CG1-CD2 4.36Å; I312-Y366 HydrophobicContact CG1-CE2 4.43Å; Y366-Q372 HydrophobicContact CE1-CG 3.59Å; Y366-Q372 WeakPolarHBondContact OH-CG 3.38Å; Y366-Q372 PolarHBondContact OH-NE2 2.85Å
367	N	53.3	Low	57	Low	71 Å²	71	92.6 Å²	92.6	38%	0.38	50%	0.499	S	S	.	.			trans	-85.3	161.2	150.9	-71.6	-10.6	0	0	0	108.1	T309 D369 S379	T309-N367 PolarHBondContact OG1-OD1 2.97Å; N367-D369 PolarHBondContact O-N 2.95Å; N367-D369 VanDerWaalsContact O-N 3.09Å; N367-S379 PolarHBondContact OD1-OG 3.27Å
368	N	48.8	Very low	55.4	Low	127 Å²	127	91.8 Å²	91.8	68%	0.679	50%	0.502	S	S	*	.	S	Bend	trans	-64.1	-16.1	-178.2	-67.5	-22.9	0	0	0	113.4	L370	N368-L370 PolarHBondContact O-N 2.88Å
369	D	42.4	Very low	54.7	Low	135 Å²	135	90.1 Å²	90.1	72%	0.722	49%	0.491	S	S	*	.	S	Bend	trans	-78.7	51.9	178.2	-49.7	-58.2	0	0	0	113.1	N367 V371	N367-D369 PolarHBondContact O-N 2.95Å; N367-D369 VanDerWaalsContact O-N 3.09Å; D369-V371 WeakPolarHBondContact O-CG2 3.2Å; D369-V371 PolarHBondContact O-N 3.15Å
370	L	37.7	Very low	54.5	Low	165 Å²	165	88.9 Å²	88.9	86%	0.864	48%	0.483	S	S	*	.	S	Bend	trans	50.4	-0.5	157.3	-97.1	162.3	0	0	0	121.5	N368	N368-L370 PolarHBondContact O-N 2.88Å
371	V	39.9	Very low	54.5	Low	99 Å²	99	93.3 Å²	93.3	60%	0.6	49%	0.492	S	S	*	.			trans	-104.6	126.8	-173.1	177	0	0	0	0	111.9	D369 S373	D369-V371 WeakPolarHBondContact O-CG2 3.2Å; D369-V371 PolarHBondContact O-N 3.15Å; V371-S373 VanDerWaalsContact C-N 3.32Å; V371-S373 PolarHBondContact O-N 2.87Å
372	Q	42.3	Very low	54.9	Low	138 Å²	138	89.5 Å²	89.5	65%	0.645	48%	0.477	S	S	*	.			trans	-71.1	81.9	166.4	-73.7	-177	-1.6	0	0	110.8	Y366 L374	Y366-Q372 HydrophobicContact CE1-CG 3.59Å; Y366-Q372 WeakPolarHBondContact OH-CG 3.38Å; Y366-Q372 PolarHBondContact OH-NE2 2.85Å; Q372-L374 VanDerWaalsContact C-N 3.32Å; Q372-L374 PolarHBondContact O-N 3.46Å
373	S	38.9	Very low	55.4	Low	47 Å²	47	88.9 Å²	88.9	33%	0.329	48%	0.481	S	S	.	.			trans	-78.8	78.6	176.8	65.5	0	0	0	0	111.8	V371 G375	V371-S373 VanDerWaalsContact C-N 3.32Å; V371-S373 PolarHBondContact O-N 2.87Å; S373-G375 PolarHBondContact O-N 3.22Å
374	L	40	Very low	56	Low	156 Å²	156	87.7 Å²	87.7	82%	0.817	47%	0.473	S	S	*	.			trans	-59.2	104.1	167.1	-88.1	145.3	0	0	0	110.5	Q372	Q372-L374 VanDerWaalsContact C-N 3.32Å; Q372-L374 PolarHBondContact O-N 3.46Å
375	G	33.4	Very low	57	Low	64 Å²	64	84.6 Å²	84.6	66%	0.66	46%	0.457	S	S	*	.	S	Bend	trans	89.7	5.2	151.7	0	0	0	0	0	120.2	S373	S373-G375 PolarHBondContact O-N 3.22Å
376	K	38.6	Very low	58.2	Low	196 Å²	196	83.8 Å²	83.8	85%	0.852	45%	0.453	S	S	*	.	S	Bend	trans	-136.5	-7.7	179.2	-73.4	-167.5	177	176.7	0	119
377	N	40.9	Very low	59.3	Low	122 Å²	122	81.5 Å²	81.5	65%	0.652	45%	0.445	S	S	*	.			trans	-121	69	178.5	-89.9	-29.6	0	0	0	111.7	S379	N377-S379 PolarHBondContact O-N 2.56Å
378	N	51.8	Low	60.9	Low	80 Å²	80	78.5 Å²	78.5	43%	0.428	43%	0.43	S	S	.	.			trans	-65.9	96	-177.9	-64.3	20.1	0	0	0	110.5	I380	N378-I380 PolarHBondContact O-N 3.35Å
379	S	67.4	Low	62.7	Low	15 Å²	15	72.8 Å²	72.8	11%	0.105	40%	0.401	C	S	.	.	S	Bend	trans	-62.9	-22.5	176.6	-157.3	0	0	0	0	111.4	N367 N377 R421	N367-S379 PolarHBondContact OD1-OG 3.27Å; N377-S379 PolarHBondContact O-N 2.56Å; S379-R421 PolarHBondContact O-NH2 2.88Å
380	I	79.8	Confident	64.6	Low	4 Å²	4	68.9 Å²	68.9	2%	0.021	39%	0.392	C	S	.	.	S	Bend	trans	-114.4	139.3	-179.7	-50.7	-173	0	0	0	109.5	T309 L311 L320 I356 V359 T365 N378 V417 L419	T309-I380 HydrophobicContact CG2-CD1 3.98Å; T309-I380 HydrophobicContact CG2-CG1 3.91Å; L311-I380 HydrophobicContact CD1-CD1 4.19Å; L311-I380 HydrophobicContact CD2-CD1 3.54Å; L311-I380 HydrophobicContact CG-CD1 3.76Å; L320-I380 HydrophobicContact CD2-CG2 4.05Å; I356-I380 HydrophobicContact CD1-CG2 3.41Å; I356-I380 VanDerWaalsContact CD1-CG2 3.41Å; V359-I380 HydrophobicContact CG2-CG2 4.13Å; T365-I380 HydrophobicContact CG2-CD1 3.55Å; T365-I380 HydrophobicContact CG2-CG1 3.94Å; N378-I380 PolarHBondContact O-N 3.35Å; I380-V417 HydrophobicContact CD1-CG2 4.42Å; I380-L419 HydrophobicContact CB-CD1 4.03Å; I380-L419 HydrophobicContact CD1-CD1 4.26Å; I380-L419 HydrophobicContact CG1-CD1 3.68Å; I380-L419 HydrophobicContact CG2-CD1 3.81Å
381	R	80.3	Confident	66.5	Low	141 Å²	141	64.6 Å²	64.6	53%	0.532	39%	0.388	S	S	.	.			trans	-141.7	151.6	-176.2	-63.8	178.2	-174.3	-159.7	-3.3	112.5	G383 D384	R381-G383 PolarHBondContact O-N 2.64Å; R381-D384 PolarHBondContact N-OD2 2.8Å; R381-D384 WeakPolarHBondContact O-CB 3.28Å; R381-D384 PolarHBondContact O-N 3.29Å; R381-D384 VanDerWaalsContact O-N 3.11Å
382	P	82.3	Confident	68.3	Low	87 Å²	87	62.4 Å²	62.4	57%	0.565	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-47.1	129.3	162.6	-31	39	0	0	0	112.1	R357 V359	R357-P382 WeakPolarHBondContact O-CB 3.31Å; V359-P382 HydrophobicContact CG2-CG 4.37Å
383	G	81.4	Confident	70.1	Confident	32 Å²	32	63.3 Å²	63.3	33%	0.33	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	95	-15.1	-177.8	0	0	0	0	0	115.7	Q355 I356 R381	Q355-G383 PolarHBondContact NE2-O 2.69Å; I356-G383 PolarHBondContact O-N 3.29Å; R381-G383 PolarHBondContact O-N 2.64Å
384	D	85.8	Confident	72.2	Confident	4 Å²	4	61.1 Å²	61.1	2%	0.021	36%	0.358	C	S	.	.			trans	-65.4	148.3	173	-69.6	-29.5	0	0	0	111.6	Q355 I356 R381 L419 R421	Q355-D384 WeakPolarHBondContact CA-O 3.38Å; I356-D384 HydrophobicContact CD1-CB 4.39Å; I356-D384 PolarHBondContact N-O 2.72Å; R381-D384 PolarHBondContact N-OD2 2.8Å; R381-D384 WeakPolarHBondContact O-CB 3.28Å; R381-D384 PolarHBondContact O-N 3.29Å; R381-D384 VanDerWaalsContact O-N 3.11Å; D384-L419 HydrophobicContact CB-CD1 4.31Å; D384-R421 VanDerWaalsContact OD1-CB 3.28Å; D384-R421 WeakPolarHBondContact OD1-CB 3.31Å; D384-R421 VanDerWaalsContact OD1-CG 3.26Å; D384-R421 WeakPolarHBondContact OD1-CG 3.17Å; D384-R421 IonicContact OD1-CZ 3.25Å; D384-R421 IonicContact OD1-NE 2.68Å; D384-R421 PolarHBondContact OD1-NE 3.34Å; D384-R421 IonicContact OD1-NH2 2.69Å; D384-R421 IonicContact OD2-CZ 2.72Å; D384-R421 IonicContact OD2-NE 3.2Å; D384-R421 PolarHBondContact OD2-NE 3.42Å; D384-R421 IonicContact OD2-NH2 2.64Å; D384-R421 PolarHBondContact OD2-NH2 3.21Å
385	I	86.8	Confident	73.6	Confident	1 Å²	1	54.3 Å²	54.3	1%	0.005	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	117.6	179.5	-52.8	-52.1	0	0	0	110.8	L353 L354 Q355 L387 L419 L420 I425	L353-I385 HydrophobicContact CB-CG2 3.74Å; L353-I385 HydrophobicContact CD1-CG2 4.24Å; L353-I385 HydrophobicContact CD2-CG2 4.19Å; L353-I385 HydrophobicContact CG-CG2 4.27Å; L354-I385 CarbonylContact O-C 3.56Å; L354-I385 WeakPolarHBondContact O-CA 3.38Å; Q355-I385 HydrophobicContact CB-CD1 3.63Å; Q355-I385 HydrophobicContact CG-CD1 3.82Å; I385-L387 HydrophobicContact CG2-CD2 4.06Å; I385-L387 PolarHBondContact O-N 2.93Å; I385-L419 CarbonylContact O-C 3.57Å; I385-L419 VanDerWaalsContact O-CA 3.28Å; I385-L419 WeakPolarHBondContact O-CA 3.38Å; I385-L420 HydrophobicContact CB-CB 4.26Å; I385-L420 PolarHBondContact N-O 2.78Å; I385-L420 PolarHBondContact O-N 3.31Å; I385-I425 HydrophobicContact CD1-CD1 3.66Å; I385-I425 HydrophobicContact CG1-CD1 3.9Å
386	L	88.2	Confident	75.5	Confident	2 Å²	2	53 Å²	53	1%	0.01	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	103.6	173.7	179.4	62.4	0	0	0	110.2	L322 L354 A388 L394 L406 V417 L419	L322-L386 HydrophobicContact CD1-CD2 3.95Å; L322-L386 HydrophobicContact CD2-CD2 4Å; L354-L386 HydrophobicContact CB-CB 4.35Å; L354-L386 PolarHBondContact O-N 3.25Å; L386-A388 WeakPolarHBondContact CD1-O 3.46Å; L386-L394 HydrophobicContact CD1-CD1 4.31Å; L386-L394 HydrophobicContact CD2-CD1 3.63Å; L386-L394 HydrophobicContact CG-CD1 3.69Å; L386-L406 HydrophobicContact CD2-CD1 4.47Å; L386-V417 HydrophobicContact CD1-CB 3.81Å; L386-V417 HydrophobicContact CD1-CG1 3.96Å; L386-L419 HydrophobicContact CB-CD2 4.06Å; L386-L419 HydrophobicContact CD1-CD2 3.64Å; L386-L419 HydrophobicContact CG-CD2 4.47Å
387	L	85.5	Confident	77.1	Confident	26 Å²	26	44.8 Å²	44.8	14%	0.136	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	-33.9	-179.6	-69.2	-173.2	0	0	0	113.3	L306 L353 I385 L394 A395 T418 L420	L306-L387 HydrophobicContact CD2-CD1 3.72Å; L353-L387 HydrophobicContact CD2-CD2 4.19Å; I385-L387 HydrophobicContact CG2-CD2 4.06Å; I385-L387 PolarHBondContact O-N 2.93Å; L387-L394 PolarHBondContact O-N 2.96Å; L387-A395 HydrophobicContact CD2-CB 4.15Å; L387-A395 PolarHBondContact O-N 3.32Å; L387-T418 PolarHBondContact N-O 2.78Å; L387-L420 HydrophobicContact CD1-CB 3.73Å; L387-L420 HydrophobicContact CD1-CD1 4.42Å; L387-L420 HydrophobicContact CD1-CD2 4.19Å; L387-L420 HydrophobicContact CD1-CG 4.35Å; L387-L420 HydrophobicContact CD2-CB 4.3Å; L387-L420 HydrophobicContact CD2-CD2 4.4Å; L387-L420 HydrophobicContact CG-CB 3.82Å
388	A	86.5	Confident	78.8	Confident	8 Å²	8	41.4 Å²	41.4	7%	0.066	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	153	-178.5	0	0	0	0	0	112.1	L386 C392 V417 T418	L386-A388 WeakPolarHBondContact CD1-O 3.46Å; A388-C392 CarbonylContact C-O 2.96Å; A388-C392 WeakPolarHBondContact CA-O 3.14Å; A388-C392 WeakPolarHBondContact CB-O 3.46Å; A388-V417 WeakPolarHBondContact O-CA 3.18Å; A388-T418 PolarHBondContact N-O 3.27Å; A388-T418 PolarHBondContact O-N 3.48Å
389	A	87.1	Confident	80.2	Confident	7 Å²	7	38.9 Å²	38.9	6%	0.058	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-144	134.3	171.4	0	0	0	0	0	110.5	G391 C392 L394 L406 Q416 V417	A389-G391 PolarHBondContact O-N 2.61Å; A389-C392 PolarHBondContact N-O 2.81Å; A389-C392 WeakPolarHBondContact O-CB 3.3Å; A389-C392 PolarHBondContact O-N 2.97Å; A389-L394 HydrophobicContact CB-CD1 3.67Å; A389-L406 HydrophobicContact CB-CD2 3.86Å; A389-Q416 CarbonylContact C-O 3.57Å; A389-Q416 WeakPolarHBondContact CA-O 3.38Å; A389-V417 HydrophobicContact CB-CG1 3.79Å
390	G	81.9	Confident	80.7	Confident	52 Å²	52	42.5 Å²	42.5	54%	0.536	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	60.9	26.2	179.6	0	0	0	0	0	114	C392 Q416	G390-C392 PolarHBondContact O-N 3.06Å; G390-Q416 PolarHBondContact N-O 2.66Å
391	G	77.6	Confident	80.7	Confident	75 Å²	75	47.8 Å²	47.8	77%	0.773	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.2	-11.9	-171.1	0	0	0	0	0	115.1	A389	A389-G391 PolarHBondContact O-N 2.61Å
392	C	77.3	Confident	80.9	Confident	54 Å²	54	41.1 Å²	41.1	37%	0.365	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	126	175.1	-66.1	0	0	0	0	111	A388 A389 G390 L394 L405	A388-C392 CarbonylContact C-O 2.96Å; A388-C392 WeakPolarHBondContact CA-O 3.14Å; A388-C392 WeakPolarHBondContact CB-O 3.46Å; A389-C392 PolarHBondContact N-O 2.81Å; A389-C392 WeakPolarHBondContact O-CB 3.3Å; A389-C392 PolarHBondContact O-N 2.97Å; G390-C392 PolarHBondContact O-N 3.06Å; C392-L394 PolarHBondContact O-N 2.82Å; C392-L405 HydrophobicContact CB-CD1 4.11Å
393	R	80.2	Confident	81	Confident	157 Å²	157	40.9 Å²	40.9	59%	0.592	26%	0.258	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.5	128	169.8	173.3	178.2	168.1	163.2	-0.6	109.9	A395	R393-A395 HydrophobicContact CG-CB 4.34Å; R393-A395 PolarHBondContact NE-O 3.47Å; R393-A395 VanDerWaalsContact NE-O 3.07Å
394	L	82.8	Confident	81.1	Confident	0 Å²	0	45.2 Å²	45.2	0%	0	27%	0.269	C	S	.	.			trans	-106.5	-14.9	178.2	-63.3	177.6	0	0	0	113.3	L354 L386 L387 A389 C392 G396 C397 A402 L405	L354-L394 HydrophobicContact CD1-CB 3.97Å; L386-L394 HydrophobicContact CD1-CD1 4.31Å; L386-L394 HydrophobicContact CD2-CD1 3.63Å; L386-L394 HydrophobicContact CG-CD1 3.69Å; L387-L394 PolarHBondContact O-N 2.96Å; A389-L394 HydrophobicContact CB-CD1 3.67Å; C392-L394 PolarHBondContact O-N 2.82Å; L394-G396 PolarHBondContact O-N 2.96Å; L394-C397 VanDerWaalsContact O-CB 3.28Å; L394-C397 WeakPolarHBondContact O-CB 3.45Å; L394-C397 PolarHBondContact O-N 3.17Å; L394-A402 HydrophobicContact CD1-CB 4.21Å; L394-A402 HydrophobicContact CD2-CB 3.93Å; L394-L405 HydrophobicContact CD2-CD1 3.59Å
395	A	70.3	Confident	80.9	Confident	13 Å²	13	47 Å²	47	11%	0.107	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	103.3	173.4	0	0	0	0	0	111.6	Q351 L353 L387 R393	Q351-A395 PolarHBondContact NE2-O 3.1Å; L353-A395 HydrophobicContact CD2-CB 3.9Å; L387-A395 HydrophobicContact CD2-CB 4.15Å; L387-A395 PolarHBondContact O-N 3.32Å; R393-A395 HydrophobicContact CG-CB 4.34Å; R393-A395 PolarHBondContact NE-O 3.47Å; R393-A395 VanDerWaalsContact NE-O 3.07Å
396	G	72.7	Confident	80.8	Confident	38 Å²	38	47.8 Å²	47.8	39%	0.392	28%	0.283	S	S	.	.	T	Hydrogen-bonded Turn	trans	122.1	-23.4	-172.1	0	0	0	0	0	113.6	R352 L394	R352-G396 WeakPolarHBondContact O-CA 3.37Å; R352-G396 PolarHBondContact O-N 3.13Å; L394-G396 PolarHBondContact O-N 2.96Å
397	C	73.7	Confident	80.6	Confident	23 Å²	23	50.3 Å²	50.3	16%	0.155	30%	0.304	C	S	.	.			trans	-71.2	162.4	-179.4	-62.2	0	0	0	0	112.3	R352 L394 Y401	R352-C397 WeakPolarHBondContact CD-O 3.22Å; R352-C397 WeakPolarHBondContact CG-O 3.21Å; L394-C397 VanDerWaalsContact O-CB 3.28Å; L394-C397 WeakPolarHBondContact O-CB 3.45Å; L394-C397 PolarHBondContact O-N 3.17Å; C397-Y401 HydrophobicContact CB-CD1 3.82Å; C397-Y401 VanDerWaalsContact SG-CD1 3.53Å
398	T	76.2	Confident	80.6	Confident	51 Å²	51	57.1 Å²	57.1	31%	0.313	33%	0.333	S	S	.	.			trans	-83.5	157.5	165.1	81.4	0	0	0	0	109.9	E400 Y401 A402	T398-E400 WeakPolarHBondContact CB-OE2 3.27Å; T398-E400 PolarHBondContact O-N 2.8Å; T398-E400 PolarHBondContact OG1-OE2 2.86Å; T398-Y401 PolarHBondContact O-N 3.19Å; T398-Y401 PolarHBondContact OG1-N 2.88Å; T398-A402 PolarHBondContact O-N 3.34Å
399	P	79.7	Confident	80.6	Confident	26 Å²	26	57.8 Å²	57.8	17%	0.169	34%	0.336	C	S	.	.	H	α-helix	trans	-56.9	-38.9	176.3	-24.8	35.3	0	0	0	112.6	L354 Y401 A402 V403	L354-P399 HydrophobicContact CD2-CB 4.39Å; L354-P399 HydrophobicContact CD2-CG 3.96Å; P399-Y401 PolarHBondContact O-N 3.38Å; P399-A402 PolarHBondContact O-N 3.22Å; P399-V403 WeakPolarHBondContact O-CG2 3.45Å; P399-V403 PolarHBondContact O-N 3.5Å
400	E	78.3	Confident	80.5	Confident	92 Å²	92	61.3 Å²	61.3	43%	0.43	36%	0.358	S	S	.	.	H	α-helix	trans	-63.3	-42.2	-179.7	-49.3	83	173.1	0	0	111.3	T398 A402 V403 Q404	T398-E400 WeakPolarHBondContact CB-OE2 3.27Å; T398-E400 PolarHBondContact O-N 2.8Å; T398-E400 PolarHBondContact OG1-OE2 2.86Å; E400-A402 PolarHBondContact O-N 3.2Å; E400-V403 PolarHBondContact O-N 2.83Å; E400-Q404 WeakPolarHBondContact O-CG 3.32Å; E400-Q404 PolarHBondContact O-N 3.45Å
401	Y	80.7	Confident	80.8	Confident	115 Å²	115	62.8 Å²	62.8	45%	0.451	36%	0.356	S	S	.	.	H	α-helix	trans	-65.9	-37.1	175.9	-176.6	-98.5	0	0	0	112.3	C397 T398 P399 Q404 L405	C397-Y401 HydrophobicContact CB-CD1 3.82Å; C397-Y401 VanDerWaalsContact SG-CD1 3.53Å; T398-Y401 PolarHBondContact O-N 3.19Å; T398-Y401 PolarHBondContact OG1-N 2.88Å; P399-Y401 PolarHBondContact O-N 3.38Å; Y401-Q404 PolarHBondContact O-N 3.48Å; Y401-L405 HydrophobicContact CD1-CD1 3.89Å; Y401-L405 HydrophobicContact CD1-CG 4.4Å; Y401-L405 HydrophobicContact CE1-CD1 3.43Å; Y401-L405 VanDerWaalsContact CE1-CD1 3.43Å; Y401-L405 HydrophobicContact CE1-CG 4.04Å; Y401-L405 PolarHBondContact O-N 2.85Å
402	A	83.8	Confident	81	Confident	0 Å²	0	62 Å²	62	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-68.6	-39.8	174.5	0	0	0	0	0	112.3	L322 L354 L394 T398 P399 E400 Q404 L405 L406	L322-A402 HydrophobicContact CD1-CB 4.18Å; L354-A402 HydrophobicContact CD1-CB 3.3Å; L394-A402 HydrophobicContact CD1-CB 4.21Å; L394-A402 HydrophobicContact CD2-CB 3.93Å; T398-A402 PolarHBondContact O-N 3.34Å; P399-A402 PolarHBondContact O-N 3.22Å; E400-A402 PolarHBondContact O-N 3.2Å; A402-Q404 VanDerWaalsContact C-N 3.35Å; A402-L405 PolarHBondContact O-N 2.81Å; A402-L406 WeakPolarHBondContact O-CB 3.14Å; A402-L406 WeakPolarHBondContact O-CG 3.32Å; A402-L406 PolarHBondContact O-N 2.84Å
403	V	84.4	Confident	81.3	Confident	83 Å²	83	61.6 Å²	61.6	50%	0.503	35%	0.346	S	S	.	.	H	α-helix	trans	-62	-41.9	171.8	170.4	0	0	0	0	110.6	P399 E400 L405 L406 A407	P399-V403 WeakPolarHBondContact O-CG2 3.45Å; P399-V403 PolarHBondContact O-N 3.5Å; E400-V403 PolarHBondContact O-N 2.83Å; V403-L405 PolarHBondContact O-N 3.14Å; V403-L406 PolarHBondContact O-N 2.84Å; V403-A407 WeakPolarHBondContact O-CB 3.35Å; V403-A407 PolarHBondContact O-N 2.9Å
404	Q	82.7	Confident	81.5	Confident	123 Å²	123	57 Å²	57	58%	0.575	34%	0.342	S	S	*	.	H	α-helix	trans	-63.9	-37.2	174.6	-74.5	176.1	1.3	0	0	113.4	E400 Y401 A402	E400-Q404 WeakPolarHBondContact O-CG 3.32Å; E400-Q404 PolarHBondContact O-N 3.45Å; Y401-Q404 PolarHBondContact O-N 3.48Å; A402-Q404 VanDerWaalsContact C-N 3.35Å
405	L	82.4	Confident	81.7	Confident	42 Å²	42	57.6 Å²	57.6	22%	0.22	35%	0.346	C	S	.	.	H	α-helix	trans	-66.7	-46.6	173.8	-80.7	174.5	0	0	0	111.7	C392 L394 Y401 A402 V403 K408	C392-L405 HydrophobicContact CB-CD1 4.11Å; L394-L405 HydrophobicContact CD2-CD1 3.59Å; Y401-L405 HydrophobicContact CD1-CD1 3.89Å; Y401-L405 HydrophobicContact CD1-CG 4.4Å; Y401-L405 HydrophobicContact CE1-CD1 3.43Å; Y401-L405 VanDerWaalsContact CE1-CD1 3.43Å; Y401-L405 HydrophobicContact CE1-CG 4.04Å; Y401-L405 PolarHBondContact O-N 2.85Å; A402-L405 PolarHBondContact O-N 2.81Å; V403-L405 PolarHBondContact O-N 3.14Å; L405-K408 PolarHBondContact O-N 2.89Å
406	L	85	Confident	82.5	Confident	16 Å²	16	61.9 Å²	61.9	8%	0.084	36%	0.364	C	S	.	.	H	α-helix	trans	-66.1	-38.7	178	-72.7	170.3	0	0	0	111.8	F318 L322 L386 A389 A402 V403 K408 V409 V415	F318-L406 HydrophobicContact CD2-CB 3.94Å; F318-L406 HydrophobicContact CD2-CD2 4.25Å; F318-L406 HydrophobicContact CD2-CG 4.49Å; F318-L406 HydrophobicContact CE2-CB 3.76Å; F318-L406 HydrophobicContact CE2-CD2 3.89Å; F318-L406 HydrophobicContact CE2-CG 4.37Å; F318-L406 WeakPolarHBondContact CE2-O 3.45Å; F318-L406 HydrophobicContact CZ-CD2 4.3Å; L322-L406 HydrophobicContact CD1-CD1 4.35Å; L386-L406 HydrophobicContact CD2-CD1 4.47Å; A389-L406 HydrophobicContact CB-CD2 3.86Å; A402-L406 WeakPolarHBondContact O-CB 3.14Å; A402-L406 WeakPolarHBondContact O-CG 3.32Å; A402-L406 PolarHBondContact O-N 2.84Å; V403-L406 PolarHBondContact O-N 2.84Å; L406-K408 PolarHBondContact O-N 2.82Å; L406-K408 VanDerWaalsContact O-N 3.1Å; L406-V409 WeakPolarHBondContact O-CB 3.35Å; L406-V409 WeakPolarHBondContact O-CG2 3.36Å; L406-V409 PolarHBondContact O-N 2.68Å; L406-V415 HydrophobicContact CD2-CG1 4.09Å
407	A	84.9	Confident	83.3	Confident	56 Å²	56	60.1 Å²	60.1	46%	0.463	35%	0.345	S	S	.	.	H	α-helix	trans	-57.1	-29.4	-179.9	0	0	0	0	0	113.3	K313 V403 V409	K313-A407 PolarHBondContact NZ-O 3.24Å; V403-A407 WeakPolarHBondContact O-CB 3.35Å; V403-A407 PolarHBondContact O-N 2.9Å; A407-V409 VanDerWaalsContact C-N 3.28Å; A407-V409 PolarHBondContact O-N 3.04Å
408	K	84.4	Confident	83.8	Confident	169 Å²	169	59.8 Å²	59.8	74%	0.735	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.7	-15.7	177.8	-68.5	176.7	-178.7	-174.6	0	114.6	L405 L406	L405-K408 PolarHBondContact O-N 2.89Å; L406-K408 PolarHBondContact O-N 2.82Å; L406-K408 VanDerWaalsContact O-N 3.1Å
409	V	86	Confident	84.3	Confident	21 Å²	21	57.4 Å²	57.4	13%	0.127	33%	0.328	C	S	.	.	S	Bend	trans	-65.4	134	172.9	-178.1	0	0	0	0	108.5	K313 F318 L406 A407 V415	K313-V409 HydrophobicContact CB-CG1 4.27Å; K313-V409 HydrophobicContact CD-CB 4.29Å; K313-V409 WeakPolarHBondContact CD-O 3.49Å; K313-V409 WeakPolarHBondContact CE-O 3.35Å; K313-V409 PolarHBondContact NZ-O 3.31Å; F318-V409 HydrophobicContact CE2-CB 4.26Å; F318-V409 HydrophobicContact CE2-CG2 4.36Å; F318-V409 HydrophobicContact CZ-CB 3.89Å; F318-V409 HydrophobicContact CZ-CG1 3.99Å; F318-V409 HydrophobicContact CZ-CG2 4.02Å; L406-V409 WeakPolarHBondContact O-CB 3.35Å; L406-V409 WeakPolarHBondContact O-CG2 3.36Å; L406-V409 PolarHBondContact O-N 2.68Å; A407-V409 VanDerWaalsContact C-N 3.28Å; A407-V409 PolarHBondContact O-N 3.04Å; V409-V415 HydrophobicContact CG1-CB 4.49Å; V409-V415 HydrophobicContact CG2-CB 3.98Å; V409-V415 HydrophobicContact CG2-CG1 4.33Å; V409-V415 HydrophobicContact CG2-CG2 4.18Å
410	P	86.5	Confident	84.4	Confident	81 Å²	81	56.7 Å²	56.7	53%	0.526	32%	0.322	S	S	.	.	P	Polyproline II helix	trans	-66.3	152.1	174.9	-19.1	30.6	0	0	0	111.9	S413	P410-S413 VanDerWaalsContact O-CB 3.3Å; P410-S413 WeakPolarHBondContact O-CB 3.29Å; P410-S413 PolarHBondContact O-N 2.81Å; P410-S413 VanDerWaalsContact O-N 3.09Å
411	V	86.5	Confident	84.6	Confident	83 Å²	83	55 Å²	55	50%	0.503	31%	0.312	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	139.8	170.7	176.2	0	0	0	0	109.1	K313 P315 S413	K313-V411 HydrophobicContact CD-CG2 4.29Å; K313-V411 HydrophobicContact CG-CG2 4.47Å; P315-V411 HydrophobicContact CG-CG1 4Å; V411-S413 PolarHBondContact O-N 2.84Å
412	G	82.3	Confident	83.9	Confident	59 Å²	59	51.1 Å²	51.1	61%	0.608	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.9	-13.3	-171	0	0	0	0	0	114.6	K313	K313-G412 PolarHBondContact O-N 3.09Å
413	S	84.8	Confident	82.8	Confident	45 Å²	45	52 Å²	52	32%	0.315	31%	0.312	S	S	.	.			trans	-84.7	148.4	177.8	-63.1	0	0	0	0	112.5	K313 P410 V411	K313-S413 PolarHBondContact N-O 3.49Å; P410-S413 VanDerWaalsContact O-CB 3.3Å; P410-S413 WeakPolarHBondContact O-CB 3.29Å; P410-S413 PolarHBondContact O-N 2.81Å; P410-S413 VanDerWaalsContact O-N 3.09Å; V411-S413 PolarHBondContact O-N 2.84Å
414	A	83.8	Confident	81.2	Confident	62 Å²	62	51.1 Å²	51.1	51%	0.512	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	148.4	174	0	0	0	0	0	111.9	L311 I312	L311-A414 CarbonylContact O-C 3.54Å; L311-A414 VanDerWaalsContact O-CA 3.22Å; L311-A414 WeakPolarHBondContact O-CA 3.24Å; I312-A414 HydrophobicContact CG1-CB 4.45Å
415	V	87.6	Confident	79.3	Confident	12 Å²	12	46.2 Å²	46.2	7%	0.073	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	127.8	172.2	66.3	0	0	0	0	109.9	C310 L311 F318 L406 V409 V417	C310-V415 WeakPolarHBondContact CA-O 3.47Å; L311-V415 HydrophobicContact CB-CG1 4.03Å; L311-V415 PolarHBondContact N-O 2.79Å; L311-V415 PolarHBondContact O-N 2.87Å; F318-V415 HydrophobicContact CE1-CG1 3.58Å; F318-V415 HydrophobicContact CE2-CG1 4.43Å; F318-V415 HydrophobicContact CZ-CB 4.45Å; F318-V415 HydrophobicContact CZ-CG1 3.46Å; F318-V415 VanDerWaalsContact CZ-CG1 3.46Å; L406-V415 HydrophobicContact CD2-CG1 4.09Å; V409-V415 HydrophobicContact CG1-CB 4.49Å; V409-V415 HydrophobicContact CG2-CB 3.98Å; V409-V415 HydrophobicContact CG2-CG1 4.33Å; V409-V415 HydrophobicContact CG2-CG2 4.18Å; V415-V417 HydrophobicContact CG1-CG1 4.44Å
416	Q	86.3	Confident	77	Confident	103 Å²	103	47.9 Å²	47.9	48%	0.481	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	132.8	173.3	-173	-178.1	1.8	0	0	109.8	A389 G390	A389-Q416 CarbonylContact C-O 3.57Å; A389-Q416 WeakPolarHBondContact CA-O 3.38Å; G390-Q416 PolarHBondContact N-O 2.66Å
417	V	88.5	Confident	74.4	Confident	1 Å²	1	49.3 Å²	49.3	1%	0.006	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	143.2	174.6	-65.1	0	0	0	0	111.3	D308 T309 L311 I380 L386 A388 A389 V415 L419	D308-V417 WeakPolarHBondContact CA-O 3.37Å; T309-V417 HydrophobicContact CG2-CG2 3.74Å; T309-V417 PolarHBondContact N-O 2.72Å; T309-V417 WeakPolarHBondContact O-CG2 2.97Å; T309-V417 PolarHBondContact O-N 3.35Å; L311-V417 HydrophobicContact CD1-CG1 3.82Å; L311-V417 HydrophobicContact CD1-CG2 3.98Å; L311-V417 HydrophobicContact CG-CG2 4.13Å; I380-V417 HydrophobicContact CD1-CG2 4.42Å; L386-V417 HydrophobicContact CD1-CB 3.81Å; L386-V417 HydrophobicContact CD1-CG1 3.96Å; A388-V417 WeakPolarHBondContact O-CA 3.18Å; A389-V417 HydrophobicContact CB-CG1 3.79Å; V415-V417 HydrophobicContact CG1-CG1 4.44Å; V417-L419 HydrophobicContact CG2-CD2 4.48Å
418	T	84.8	Confident	71.6	Confident	15 Å²	15	52 Å²	52	9%	0.092	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	119.6	173.5	-54.4	0	0	0	0	108.7	L306 D308 L387 A388	L306-T418 HydrophobicContact CD2-CG2 3.81Å; D308-T418 VanDerWaalsContact OD1-CB 3.27Å; D308-T418 WeakPolarHBondContact OD1-CB 3.33Å; D308-T418 WeakPolarHBondContact OD1-CG2 3.44Å; D308-T418 PolarHBondContact OD1-OG1 3.07Å; L387-T418 PolarHBondContact N-O 2.78Å; A388-T418 PolarHBondContact N-O 3.27Å; A388-T418 PolarHBondContact O-N 3.48Å
419	L	87.6	Confident	68.9	Low	1 Å²	1	49.3 Å²	49.3	1%	0.005	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	147.2	178.2	-53.9	-176	0	0	0	111.3	L306 I307 I356 I380 D384 I385 L386 V417	L306-L419 CarbonylContact C-O 3.52Å; L306-L419 WeakPolarHBondContact CA-O 3.19Å; I307-L419 HydrophobicContact CB-CB 4.36Å; I307-L419 PolarHBondContact N-O 2.87Å; I307-L419 PolarHBondContact O-N 3.42Å; I356-L419 HydrophobicContact CD1-CD1 4.32Å; I356-L419 HydrophobicContact CD1-CD2 3.94Å; I380-L419 HydrophobicContact CB-CD1 4.03Å; I380-L419 HydrophobicContact CD1-CD1 4.26Å; I380-L419 HydrophobicContact CG1-CD1 3.68Å; I380-L419 HydrophobicContact CG2-CD1 3.81Å; D384-L419 HydrophobicContact CB-CD1 4.31Å; I385-L419 CarbonylContact O-C 3.57Å; I385-L419 VanDerWaalsContact O-CA 3.28Å; I385-L419 WeakPolarHBondContact O-CA 3.38Å; L386-L419 HydrophobicContact CB-CD2 4.06Å; L386-L419 HydrophobicContact CD1-CD2 3.64Å; L386-L419 HydrophobicContact CG-CD2 4.47Å; V417-L419 HydrophobicContact CG2-CD2 4.48Å
420	L	81.8	Confident	65.9	Low	11 Å²	11	54 Å²	54	6%	0.058	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	103.2	170.9	-168.7	70.1	0	0	0	109.1	V304 L306 I385 L387 L423	V304-L420 HydrophobicContact CG1-CD1 3.39Å; V304-L420 HydrophobicContact CG1-CD2 4.41Å; V304-L420 HydrophobicContact CG1-CG 3.87Å; L306-L420 HydrophobicContact CD2-CD1 3.71Å; L306-L420 HydrophobicContact CG-CD1 3.87Å; I385-L420 HydrophobicContact CB-CB 4.26Å; I385-L420 PolarHBondContact N-O 2.78Å; I385-L420 PolarHBondContact O-N 3.31Å; L387-L420 HydrophobicContact CD1-CB 3.73Å; L387-L420 HydrophobicContact CD1-CD1 4.42Å; L387-L420 HydrophobicContact CD1-CD2 4.19Å; L387-L420 HydrophobicContact CD1-CG 4.35Å; L387-L420 HydrophobicContact CD2-CB 4.3Å; L387-L420 HydrophobicContact CD2-CD2 4.4Å; L387-L420 HydrophobicContact CG-CB 3.82Å; L420-L423 HydrophobicContact CD2-CD1 3.51Å; L420-L423 HydrophobicContact CD2-CD2 4.41Å; L420-L423 HydrophobicContact CD2-CG 3.76Å; L420-L423 HydrophobicContact CG-CD1 4.41Å; L420-L423 HydrophobicContact CG-CG 4.25Å
421	R	81.1	Confident	63.1	Low	56 Å²	56	54.4 Å²	54.4	21%	0.211	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	145.9	176.8	-179.4	167.5	-68.4	153.6	5.3	110	V304 K305 I307 S379 D384	V304-R421 CarbonylContact C-O 3.52Å; V304-R421 WeakPolarHBondContact CA-O 3.49Å; K305-R421 PolarHBondContact N-O 2.94Å; K305-R421 PolarHBondContact O-N 3.23Å; I307-R421 HydrophobicContact CD1-CB 3.9Å; S379-R421 PolarHBondContact O-NH2 2.88Å; D384-R421 VanDerWaalsContact OD1-CB 3.28Å; D384-R421 WeakPolarHBondContact OD1-CB 3.31Å; D384-R421 VanDerWaalsContact OD1-CG 3.26Å; D384-R421 WeakPolarHBondContact OD1-CG 3.17Å; D384-R421 IonicContact OD1-CZ 3.25Å; D384-R421 IonicContact OD1-NE 2.68Å; D384-R421 PolarHBondContact OD1-NE 3.34Å; D384-R421 IonicContact OD1-NH2 2.69Å; D384-R421 IonicContact OD2-CZ 2.72Å; D384-R421 IonicContact OD2-NE 3.2Å; D384-R421 PolarHBondContact OD2-NE 3.42Å; D384-R421 IonicContact OD2-NH2 2.64Å; D384-R421 PolarHBondContact OD2-NH2 3.21Å
422	G	67.1	Low	60.1	Low	35 Å²	35	55.2 Å²	55.2	36%	0.361	36%	0.361	S	S	.	.			trans	86.2	4.7	168.7	0	0	0	0	0	116.2	G424	G422-G424 PolarHBondContact O-N 2.81Å
423	L	61.2	Low	57.6	Low	17 Å²	17	59.3 Å²	59.3	9%	0.089	36%	0.364	C	S	.	.			trans	-63.8	119.8	155	-73.2	-173.5	0	0	0	108.3	I299 V304 I333 L353 L420 I425	I299-L423 HydrophobicContact CD1-CD2 3.98Å; V304-L423 HydrophobicContact CG2-CD2 4.1Å; I333-L423 HydrophobicContact CD1-CD2 4.23Å; I333-L423 HydrophobicContact CG2-CD2 4.02Å; L353-L423 HydrophobicContact CD1-CD1 4.07Å; L420-L423 HydrophobicContact CD2-CD1 3.51Å; L420-L423 HydrophobicContact CD2-CD2 4.41Å; L420-L423 HydrophobicContact CD2-CG 3.76Å; L420-L423 HydrophobicContact CG-CD1 4.41Å; L420-L423 HydrophobicContact CG-CG 4.25Å; L423-I425 HydrophobicContact CB-CD1 4.15Å; L423-I425 HydrophobicContact CB-CG1 3.75Å; L423-I425 HydrophobicContact CD1-CD1 4.13Å; L423-I425 PolarHBondContact O-N 3.02Å
424	G	49.2	Very low	54.8	Low	66 Å²	66	63.8 Å²	63.8	68%	0.68	38%	0.384	S	S	*	.			trans	-74.9	57.2	177	0	0	0	0	0	112.5	G422 P426	G422-G424 PolarHBondContact O-N 2.81Å; G424-P426 VanDerWaalsContact O-CD 3.26Å; G424-P426 WeakPolarHBondContact O-CD 3.47Å
425	I	43.8	Very low	52.3	Low	20 Å²	20	69.9 Å²	69.9	10%	0.103	40%	0.402	C	S	.	.			trans	-77.6	113.4	177.8	-46	-171.3	0	0	0	108.3	V325 T327 L353 I385 L423 G427	V325-I425 HydrophobicContact CB-CG2 4.44Å; V325-I425 HydrophobicContact CG1-CG2 3.62Å; T327-I425 HydrophobicContact CG2-CD1 4.06Å; T327-I425 HydrophobicContact CG2-CG1 4.21Å; T327-I425 WeakPolarHBondContact OG1-CG2 3.32Å; L353-I425 HydrophobicContact CD1-CD1 3.89Å; I385-I425 HydrophobicContact CD1-CD1 3.66Å; I385-I425 HydrophobicContact CG1-CD1 3.9Å; L423-I425 HydrophobicContact CB-CD1 4.15Å; L423-I425 HydrophobicContact CB-CG1 3.75Å; L423-I425 HydrophobicContact CD1-CD1 4.13Å; L423-I425 PolarHBondContact O-N 3.02Å; I425-G427 PolarHBondContact O-N 2.95Å
426	P	34.4	Very low	49.3	Very low	77 Å²	77	76.6 Å²	76.6	50%	0.5	44%	0.437	S	S	.	.			trans	-68.2	118.2	171.1	29.1	-32.1	0	0	0	108.2	G424 I428	G424-P426 VanDerWaalsContact O-CD 3.26Å; G424-P426 WeakPolarHBondContact O-CD 3.47Å; P426-I428 PolarHBondContact O-N 2.88Å
427	G	29	Very low	46.3	Very low	46 Å²	46	82.3 Å²	82.3	47%	0.474	46%	0.456	S	S	.	.			trans	-64.2	107.9	171.5	0	0	0	0	0	109.2	I425 Y429	I425-G427 PolarHBondContact O-N 2.95Å; G427-Y429 PolarHBondContact O-N 3.19Å
428	I	26.9	Very low	43.4	Very low	112 Å²	112	89.4 Å²	89.4	57%	0.574	50%	0.5	S	S	*	.	S	Bend	trans	-77.7	51.3	177.1	-44.7	-178.6	0	0	0	109.7	P426	P426-I428 PolarHBondContact O-N 2.88Å
429	Y	26.8	Very low	40.5	Very low	113 Å²	113	98.5 Å²	98.5	44%	0.443	54%	0.538	S	S	.	.			trans	-164.7	87.3	171.3	-82.8	-67.1	0	0	0	107.5	G427 V431	G427-Y429 PolarHBondContact O-N 3.19Å; Y429-V431 VanDerWaalsContact C-N 3.3Å; Y429-V431 PolarHBondContact O-N 3.48Å; Y429-V431 VanDerWaalsContact O-N 3.12Å
430	S	24.3	Very low	37.6	Very low	119 Å²	119	107.1 Å²	107.1	83%	0.832	58%	0.578	S	S	*	*			trans	-79.2	82.4	165.8	55.3	0	0	0	0	109.1
431	V	26.4	Very low	34.9	Very low	89 Å²	89	115.7 Å²	115.7	54%	0.539	62%	0.615	S	S	.	*			trans	-74.4	126.8	161.1	-175.2	0	0	0	0	106.9	Y429 E433	Y429-V431 VanDerWaalsContact C-N 3.3Å; Y429-V431 PolarHBondContact O-N 3.48Å; Y429-V431 VanDerWaalsContact O-N 3.12Å; V431-E433 HydrophobicContact CG1-CG 4.06Å; V431-E433 PolarHBondContact O-N 3.29Å
432	T	25	Very low	32.4	Very low	100 Å²	100	120 Å²	120	61%	0.613	64%	0.642	S	S	*	*			trans	-80.3	91.3	169.9	46.1	0	0	0	0	108.7
433	E	28.7	Very low	30.3	Very low	145 Å²	145	127.7 Å²	127.7	68%	0.678	67%	0.666	S	S	*	*			trans	-90.7	105.2	166.9	-76.4	172.1	-162.1	0	0	108.5	V431 H435	V431-E433 HydrophobicContact CG1-CG 4.06Å; V431-E433 PolarHBondContact O-N 3.29Å; E433-H435 PolarHBondContact O-N 3.34Å
434	D	26.9	Very low	28.6	Very low	139 Å²	139	131.8 Å²	131.8	74%	0.743	69%	0.693	S	S	*	*			trans	-72.9	120.2	177.7	-77.3	-53.7	0	0	0	111.1	N436	D434-N436 VanDerWaalsContact C-N 3.3Å; D434-N436 PolarHBondContact O-N 2.72Å
435	H	30.4	Very low	27.4	Very low	190 Å²	190	139.8 Å²	139.8	88%	0.88	70%	0.703	S	S	*	*			trans	-74.6	75.8	178.2	-79.2	-48.2	0	0	0	112.6	E433 Y437	E433-H435 PolarHBondContact O-N 3.34Å; H435-Y437 PolarHBondContact O-N 3.33Å
436	N	24.5	Very low	26.5	Very low	153 Å²	153	142.6 Å²	142.6	82%	0.818	72%	0.724	S	S	*	*			trans	-95.9	58.5	172	-103.7	-30.9	0	0	0	112.7	D434	D434-N436 VanDerWaalsContact C-N 3.3Å; D434-N436 PolarHBondContact O-N 2.72Å
437	Y	24.8	Very low	26.1	Very low	223 Å²	223	148.4 Å²	148.4	88%	0.875	74%	0.742	S	S	*	*			trans	-136.8	87.5	171.2	-98.8	-81.4	0	0	0	112.6	H435	H435-Y437 PolarHBondContact O-N 3.33Å
438	T	26.3	Very low	25.9	Very low	151 Å²	151	150.6 Å²	150.6	93%	0.926	75%	0.75	S	S	*	*			trans	-179.6	87.7	141	20.1	0	0	0	0	110.3
439	K	25.4	Very low	25.7	Very low	206 Å²	206	149.7 Å²	149.7	90%	0.896	75%	0.754	S	S	*	*			trans	-147.1	47.9	173.9	-142	175.3	-171.7	179.2	0	115.3
440	H	25.5	Very low	25.5	Very low	182 Å²	182	150 Å²	150	84%	0.843	77%	0.771	S	S	*	*			trans	-129.3	106.8	161.2	-84.9	-86.3	0	0	0	110
441	F	26.3	Very low	25.4	Very low	191 Å²	191	149.3 Å²	149.3	84%	0.838	77%	0.766	S	S	*	*	S	Bend		-166.6	131.6	123.6	-100.3	-67.2	0	0	0	109.8
442	N	27.7	Very low	25.3	Very low	145 Å²	145	150.3 Å²	150.3	78%	0.775	78%	0.777	S	S	*	*			trans	59	95.3	159.3	-56.7	-11.6	0	0	0	120.4
443	K	22.9	Very low	25.3	Very low	197 Å²	197	153.3 Å²	153.3	86%	0.857	79%	0.786	S	S	*	*			trans	-64.4	164.2	130.1	-108.2	178.1	-178.9	176.9	0	108.7
444	P	26.3	Very low	25.1	Very low	104 Å²	104	150.9 Å²	150.9	68%	0.675	79%	0.785	S	S	*	*			cis	-149.7	167.8	46.2	42.5	-23.5	0	0	0	118.7
445	R	23.7	Very low	24.9	Very low	234 Å²	234	149.5 Å²	149.5	88%	0.883	79%	0.787	S	S	*	*			trans	61.2	159.9	152.7	-74.6	170.8	-173.8	179.6	1.3	117.7
446	S	24.1	Very low	24.6	Very low	78 Å²	78	145.5 Å²	145.5	55%	0.545	78%	0.78	S	S	.	*			cis	-174.3	149.1	-35.1	48.5	0	0	0	0	108.4
447	F	26.3	Very low	24.7	Very low	199 Å²	199	143.4 Å²	143.4	87%	0.873	78%	0.778	S	S	*	*			trans	65	161.9	178.2	-53.1	-82.2	0	0	0	115.5
448	S	23.8	Very low	24.6	Very low	92 Å²	92	141 Å²	141	64%	0.643	77%	0.774	S	S	*	*			cis	-162.3	167	-39.7	57.8	0	0	0	0	110.5
449	S	23.3	Very low	24.6	Very low	94 Å²	94	141.8 Å²	141.8	66%	0.657	77%	0.772	S	S	*	*			trans	51.3	109	146.7	58.1	0	0	0	0	121.6
450	C	22.3	Very low	24.6	Very low	120 Å²	120	137.3 Å²	137.3	81%	0.811	77%	0.767	S	S	*	*				88.8	135.3	124.7	-62.7	0	0	0	0	123.3
451	S	23.5	Very low	24.5	Very low	104 Å²	104	134.5 Å²	134.5	73%	0.727	76%	0.764	S	S	*	*			trans	63.7	104.3	139.6	58.2	0	0	0	0	122.3
452	S	24.3	Very low	24.6	Very low	110 Å²	110	135.2 Å²	135.2	77%	0.769	77%	0.767	S	S	*	*				95.8	159.6	112.6	82.8	0	0	0	0	121.4
453	M	25.3	Very low	24.4	Very low	162 Å²	162	139.6 Å²	139.6	80%	0.798	77%	0.773	S	S	*	*			trans	65.6	80.5	163.7	-54.4	-143.6	71.6	0	0	120
454	S	22.9	Very low	24.5	Very low	94 Å²	94	137.1 Å²	137.1	66%	0.657	77%	0.767	S	S	*	*				62.8	122.9	121.6	60.5	0	0	0	0	122.5
455	S	23.6	Very low	24.5	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	77%	0.769	S	S	*	*			trans	100.8	141.7	139.9	84.9	0	0	0	0	119.6
456	S	23.9	Very low	24.6	Very low	105 Å²	105	131.1 Å²	131.1	73%	0.734	75%	0.754	S	S	*	*			trans	81.7	147.9	156.1	-50.1	0	0	0	0	119.4
457	S	25.6	Very low	24.8	Very low	110 Å²	110	134.1 Å²	134.1	77%	0.769	76%	0.764	S	S	*	*			trans	63.4	107.4	171.6	33	0	0	0	0	120.4
458	E	24.7	Very low	24.9	Very low	172 Å²	172	130 Å²	130	80%	0.804	75%	0.746	S	S	*	*				72	83.5	129.6	-55.1	-167.7	149.6	0	0	122.1
459	L	24.8	Very low	25.1	Very low	167 Å²	167	133.3 Å²	133.3	87%	0.874	75%	0.751	S	S	*	*				56.3	76.4	116.1	-68.9	163.4	0	0	0	120.2
460	S	25	Very low	25.4	Very low	113 Å²	113	133 Å²	133	79%	0.79	75%	0.749	S	S	*	*			trans	-159.2	86.5	144	53.1	0	0	0	0	116.6
461	P	24.9	Very low	25.7	Very low	122 Å²	122	135.7 Å²	135.7	79%	0.792	75%	0.749	S	S	*	*			trans	-91.2	102	169.1	33.3	-29.3	0	0	0	111.7
462	K	26.9	Very low	26	Very low	206 Å²	206	134.4 Å²	134.4	90%	0.896	73%	0.734	S	S	*	*			trans	-131	65.9	170.2	-77.4	-169.7	175.5	179.1	0	113.3
463	R	23.6	Very low	26.2	Very low	238 Å²	238	130.8 Å²	130.8	90%	0.898	72%	0.715	S	S	*	*			trans	-131.3	171.1	151.7	-70.2	-171.5	-179.5	-177.9	2.1	107.5
464	I	25	Very low	26.7	Very low	144 Å²	144	126.1 Å²	126.1	74%	0.738	70%	0.698	S	S	*	*			trans	73.4	87.3	-165.8	-47	164.5	0	0	0	111.7
465	N	27.2	Very low	27.3	Very low	132 Å²	132	131.2 Å²	131.2	71%	0.706	71%	0.708	S	S	*	*			trans	-175.7	41.1	147.6	-96.3	-5.9	0	0	0	110.5
466	S	26.8	Very low	27.8	Very low	81 Å²	81	128.2 Å²	128.2	57%	0.566	69%	0.686	S	S	*	*			trans	-83.8	171.7	151.9	52	0	0	0	0	109	F468	S466-F468 PolarHBondContact O-N 2.58Å
467	D	26.8	Very low	28.6	Very low	141 Å²	141	123.7 Å²	123.7	75%	0.754	66%	0.655	S	S	*	*	S	Bend	trans	75	13.5	164.6	-40.2	-45.1	0	0	0	117.7
468	F	28.4	Very low	29.4	Very low	113 Å²	113	125.8 Å²	125.8	50%	0.496	65%	0.646	S	S	.	*			trans	-128.6	5.3	177.4	-92.4	-77.7	0	0	0	118.6	S466 N490	S466-F468 PolarHBondContact O-N 2.58Å; F468-N490 HydrophobicContact CD1-CB 4.01Å; F468-N490 WeakPolarHBondContact CD1-OD1 3.48Å; F468-N490 WeakPolarHBondContact CD2-OD1 3.3Å; F468-N490 VanDerWaalsContact CE1-CA 3.5Å; F468-N490 HydrophobicContact CE1-CB 3.42Å; F468-N490 VanDerWaalsContact CE1-CB 3.42Å; F468-N490 WeakPolarHBondContact CE1-OD1 3.36Å; F468-N490 HydrophobicContact CE2-CB 4.25Å; F468-N490 VanDerWaalsContact CE2-ND2 3.26Å; F468-N490 WeakPolarHBondContact CE2-ND2 2.95Å; F468-N490 WeakPolarHBondContact CE2-OD1 3.38Å; F468-N490 WeakPolarHBondContact CG-OD1 3.29Å; F468-N490 HydrophobicContact CZ-CB 3.57Å; F468-N490 WeakPolarHBondContact CZ-ND2 3.39Å; F468-N490 WeakPolarHBondContact CZ-OD1 3.42Å
469	E	28.4	Very low	30.4	Very low	161 Å²	161	121.4 Å²	121.4	75%	0.752	63%	0.634	S	S	*	*	S	Bend	trans	-89.6	7.1	172.6	-71.4	-153.4	125.8	0	0	114.6	R478	E469-R478 IonicContact OE1-CZ 3.04Å; E469-R478 IonicContact OE1-NE 3.56Å; E469-R478 PolarHBondContact OE1-NE 2.88Å; E469-R478 IonicContact OE1-NH2 2.79Å; E469-R478 PolarHBondContact OE1-NH2 2.74Å; E469-R478 IonicContact OE2-NH2 3.29Å; E469-R478 PolarHBondContact OE2-NH2 3.49Å
470	S	28.7	Very low	31.6	Very low	88 Å²	88	114.3 Å²	114.3	62%	0.615	60%	0.596	S	S	*	*	S	Bend	trans	-93.1	137	166	98.2	0	0	0	0	110.9
471	Q	30	Very low	33	Very low	175 Å²	175	111.6 Å²	111.6	82%	0.818	57%	0.571	S	S	*	*	S	Bend	trans	66.6	53.9	174.8	-47.2	-175.2	28	0	0	118.7
472	N	30	Very low	34.7	Very low	77 Å²	77	113.4 Å²	113.4	41%	0.412	57%	0.569	S	S	.	*			trans	-177.6	131.7	131.5	-98.3	-45.7	0	0	0	116.2	L492	N472-L492 HydrophobicContact CB-CD2 3.68Å; N472-L492 HydrophobicContact CB-CG 4.05Å; N472-L492 PolarHBondContact ND2-O 2.83Å
473	G	28.1	Very low	36.4	Very low	35 Å²	35	106.1 Å²	106.1	36%	0.361	54%	0.538	S	S	.	.			trans	62.5	77.8	130.4	0	0	0	0	0	122.6	V477	G473-V477 WeakPolarHBondContact O-CG2 3.5Å
474	S	35	Very low	38.5	Very low	63 Å²	63	95.4 Å²	95.4	44%	0.441	50%	0.498	S	S	.	.			trans	71.1	140.5	143	76.3	0	0	0	0	121.1	C476 V477 K541	S474-C476 PolarHBondContact O-N 3.43Å; S474-V477 PolarHBondContact O-N 2.88Å; S474-V477 VanDerWaalsContact O-N 3.07Å; S474-K541 PolarHBondContact OG-NZ 2.62Å
475	K	35.6	Very low	40.8	Very low	201 Å²	201	91 Å²	91	87%	0.874	48%	0.479	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.3	-14	-178.7	-76.1	-176.6	174.4	178	0	116.8
476	C	34.4	Very low	42.8	Very low	48 Å²	48	86.4 Å²	86.4	32%	0.324	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.9	-9.2	178.4	-66.3	0	0	0	0	114	S474 R478 K549	S474-C476 PolarHBondContact O-N 3.43Å; C476-R478 VanDerWaalsContact C-N 3.33Å; C476-K549 PolarHBondContact SG-NZ 3Å
477	V	40.1	Very low	44.8	Very low	11 Å²	11	88.5 Å²	88.5	7%	0.067	46%	0.463	C	S	.	.	S	Bend	trans	-74.7	-22.9	174.3	175.1	0	0	0	0	111.9	G473 S474 S479 Y480 M481 L492 V540	G473-V477 WeakPolarHBondContact O-CG2 3.5Å; S474-V477 PolarHBondContact O-N 2.88Å; S474-V477 VanDerWaalsContact O-N 3.07Å; V477-S479 VanDerWaalsContact C-N 3.33Å; V477-S479 PolarHBondContact O-N 3.42Å; V477-Y480 WeakPolarHBondContact O-CA 3.08Å; V477-Y480 WeakPolarHBondContact O-CB 3.35Å; V477-Y480 PolarHBondContact O-N 3.32Å; V477-M481 HydrophobicContact CG1-CE 3.7Å; V477-M481 HydrophobicContact CG1-CG 3.98Å; V477-M481 HydrophobicContact CG1-SD 3.86Å; V477-M481 WeakPolarHBondContact O-CG 3.37Å; V477-M481 PolarHBondContact O-N 3.1Å; V477-L492 HydrophobicContact CG1-CD2 4.05Å; V477-V540 HydrophobicContact CG2-CG1 4.45Å
478	R	42.8	Very low	46.8	Very low	153 Å²	153	81.9 Å²	81.9	58%	0.577	43%	0.427	S	S	*	.	H	α-helix	trans	-58	-39.2	179.2	-81.6	-171	174.5	168.8	-1.5	113.6	E469 C476 Y480 M481	E469-R478 IonicContact OE1-CZ 3.04Å; E469-R478 IonicContact OE1-NE 3.56Å; E469-R478 PolarHBondContact OE1-NE 2.88Å; E469-R478 IonicContact OE1-NH2 2.79Å; E469-R478 PolarHBondContact OE1-NH2 2.74Å; E469-R478 IonicContact OE2-NH2 3.29Å; E469-R478 PolarHBondContact OE2-NH2 3.49Å; C476-R478 VanDerWaalsContact C-N 3.33Å; R478-Y480 PolarHBondContact O-N 3.36Å; R478-M481 PolarHBondContact O-N 2.82Å
479	S	46.7	Very low	48.7	Very low	81 Å²	81	77.4 Å²	77.4	57%	0.566	41%	0.41	S	S	*	.	H	α-helix	trans	-66.7	-0.1	174.2	-53.2	0	0	0	0	115	V477	V477-S479 VanDerWaalsContact C-N 3.33Å; V477-S479 PolarHBondContact O-N 3.42Å
480	Y	49.2	Very low	50.6	Low	17 Å²	17	72.3 Å²	72.3	7%	0.067	39%	0.388	C	S	.	.	H	α-helix	trans	-111.8	-35.7	175.4	-84.9	-90.8	0	0	0	112.8	V477 R478 E482 H483 F484 V548 Y599	V477-Y480 WeakPolarHBondContact O-CA 3.08Å; V477-Y480 WeakPolarHBondContact O-CB 3.35Å; V477-Y480 PolarHBondContact O-N 3.32Å; R478-Y480 PolarHBondContact O-N 3.36Å; Y480-E482 PolarHBondContact O-N 2.77Å; Y480-H483 PolarHBondContact O-N 3.23Å; Y480-F484 AromaticContact CD1-CE2 3.77Å; Y480-F484 HydrophobicContact CD1-CE2 3.77Å; Y480-F484 HydrophobicContact CD1-CZ 4.09Å; Y480-F484 HydrophobicContact CG-CE2 4.23Å; Y480-F484 WeakPolarHBondContact O-CD2 3.44Å; Y480-V548 HydrophobicContact CD2-CG2 4.44Å; Y480-V548 HydrophobicContact CE2-CB 4.29Å; Y480-V548 HydrophobicContact CE2-CG1 3.87Å; Y480-V548 HydrophobicContact CE2-CG2 3.44Å; Y480-V548 VanDerWaalsContact CE2-CG2 3.44Å; Y480-V548 VanDerWaalsContact OH-CG1 3.27Å; Y480-V548 WeakPolarHBondContact OH-CG1 3.19Å; Y480-V548 VanDerWaalsContact OH-CG2 3.31Å; Y480-V548 WeakPolarHBondContact OH-CG2 3.37Å; Y480-Y599 HydrophobicContact CE1-CE1 4.17Å; Y480-Y599 PolarHBondContact OH-OH 3.5Å
481	M	54.1	Low	52.4	Low	57 Å²	57	69.8 Å²	69.8	28%	0.281	37%	0.37	S	S	.	.	H	α-helix	trans	-59.8	-27.9	-178.4	-56.3	-77.5	81.1	0	0	112.5	V477 R478 H483 F484 C489 I573	V477-M481 HydrophobicContact CG1-CE 3.7Å; V477-M481 HydrophobicContact CG1-CG 3.98Å; V477-M481 HydrophobicContact CG1-SD 3.86Å; V477-M481 WeakPolarHBondContact O-CG 3.37Å; V477-M481 PolarHBondContact O-N 3.1Å; R478-M481 PolarHBondContact O-N 2.82Å; M481-H483 PolarHBondContact O-N 2.99Å; M481-F484 HydrophobicContact CE-CD2 3.83Å; M481-F484 PolarHBondContact O-N 3.47Å; M481-F484 VanDerWaalsContact O-O 3.12Å; M481-C489 HydrophobicContact CE-CB 3.95Å; M481-C489 VanDerWaalsContact CE-SG 3.59Å; M481-C489 HydrophobicContact SD-CB 3.79Å; M481-C489 VanDerWaalsContact SD-SG 3.65Å; M481-I573 HydrophobicContact CE-CD1 3.94Å
482	E	60	Low	54.3	Low	160 Å²	160	62.7 Å²	62.7	75%	0.748	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.2	-15.5	176.3	-65.5	176.4	-163	0	0	114	Y480	Y480-E482 PolarHBondContact O-N 2.77Å
483	H	62.8	Low	56	Low	52 Å²	52	61 Å²	61	24%	0.241	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115.8	10.4	178.1	-55.9	-47.8	0	0	0	113.2	Y480 M481 C579 Q582 V583	Y480-H483 PolarHBondContact O-N 3.23Å; M481-H483 PolarHBondContact O-N 2.99Å; H483-C579 WeakPolarHBondContact O-CB 3.44Å; H483-Q582 PolarHBondContact O-OE1 3.26Å; H483-V583 HydrophobicContact CB-CG2 3.58Å
484	F	68.2	Low	57.9	Low	13 Å²	13	61.1 Å²	61.1	6%	0.057	32%	0.319	C	S	.	.	S	Bend	trans	-120.6	131.4	179.3	-71.4	-44.2	0	0	0	109.7	Y480 M481 C488 C489 L538 I573 V575 C579 V583	Y480-F484 AromaticContact CD1-CE2 3.77Å; Y480-F484 HydrophobicContact CD1-CE2 3.77Å; Y480-F484 HydrophobicContact CD1-CZ 4.09Å; Y480-F484 HydrophobicContact CG-CE2 4.23Å; Y480-F484 WeakPolarHBondContact O-CD2 3.44Å; M481-F484 HydrophobicContact CE-CD2 3.83Å; M481-F484 PolarHBondContact O-N 3.47Å; M481-F484 VanDerWaalsContact O-O 3.12Å; F484-C488 HydrophobicContact CB-CB 3.9Å; F484-C488 HydrophobicContact CD1-CB 4.04Å; F484-C488 HydrophobicContact CG-CB 4.17Å; F484-C489 WeakPolarHBondContact CB-SG 3.39Å; F484-L538 HydrophobicContact CZ-CD2 3.96Å; F484-I573 HydrophobicContact CD1-CD1 4.48Å; F484-I573 HydrophobicContact CD2-CD1 3.49Å; F484-I573 VanDerWaalsContact CD2-CD1 3.49Å; F484-I573 HydrophobicContact CE2-CD1 3.57Å; F484-I573 HydrophobicContact CE2-CG2 4.15Å; F484-I573 HydrophobicContact CG-CD1 3.99Å; F484-I573 HydrophobicContact CZ-CD1 4.19Å; F484-I573 HydrophobicContact CZ-CG2 4.1Å; F484-V575 HydrophobicContact CD1-CG1 3.98Å; F484-V575 HydrophobicContact CD1-CG2 4.43Å; F484-V575 HydrophobicContact CE1-CB 4.22Å; F484-V575 HydrophobicContact CE1-CG1 3.5Å; F484-V575 VanDerWaalsContact CE1-CG1 3.5Å; F484-V575 HydrophobicContact CE1-CG2 3.59Å; F484-V575 HydrophobicContact CZ-CG2 3.92Å; F484-C579 HydrophobicContact CD1-CB 3.86Å; F484-V583 HydrophobicContact CD1-CG2 4.25Å; F484-V583 HydrophobicContact CE1-CG2 3.65Å; F484-V583 HydrophobicContact CZ-CG2 3.98Å
485	C	73.8	Confident	59.2	Low	51 Å²	51	58.3 Å²	58.3	35%	0.345	30%	0.299	S	S	.	.			trans	-68.2	160.1	167.8	71	0	0	0	0	109.6	N487 C488 C489 C579	C485-N487 VanDerWaalsContact C-N 3.33Å; C485-N487 PolarHBondContact O-N 2.93Å; C485-C488 WeakPolarHBondContact O-CA 2.89Å; C485-C488 WeakPolarHBondContact O-CB 3.37Å; C485-C488 PolarHBondContact O-N 2.93Å; C485-C489 PolarHBondContact O-N 2.96Å; C485-C489 VanDerWaalsContact O-N 3.1Å; C485-C489 PolarHBondContact O-SG 3.42Å; C485-C579 PolarHBondContact N-SG 3.39Å
486	S	69.7	Low	60.5	Low	36 Å²	36	52.7 Å²	52.7	25%	0.252	28%	0.275	S	S	.	.	H	α-helix	trans	-43.9	-56.9	177.7	50.9	0	0	0	0	111.5	C488 C489 N490	S486-C488 CarbonylContact O-C 3.57Å; S486-C488 PolarHBondContact O-N 3.3Å; S486-C489 CarbonylContact O-C 3.54Å; S486-C489 WeakPolarHBondContact O-CA 3.28Å; S486-C489 WeakPolarHBondContact O-CB 3.28Å; S486-C489 PolarHBondContact O-N 3.09Å; S486-N490 VanDerWaalsContact C-CG 3.42Å; S486-N490 VanDerWaalsContact O-CB 3.32Å; S486-N490 WeakPolarHBondContact O-CB 3.42Å; S486-N490 PolarHBondContact O-N 3.39Å; S486-N490 PolarHBondContact O-ND2 3.5Å; S486-N490 PolarHBondContact O-OD1 2.65Å
487	N	67.8	Low	61.6	Low	125 Å²	125	51.4 Å²	51.4	67%	0.668	27%	0.265	S	S	*	.	H	α-helix	trans	-53.2	-25.8	179.4	-67.4	-8.1	0	0	0	115.6	C485	C485-N487 VanDerWaalsContact C-N 3.33Å; C485-N487 PolarHBondContact O-N 2.93Å
488	C	69.1	Low	62.4	Low	2 Å²	2	52.8 Å²	52.8	1%	0.014	27%	0.273	C	S	.	.	H	α-helix	trans	-79.2	-51.6	170.4	-62.7	0	0	0	0	111.1	F484 C485 S486 N490 S491 I573 C576	F484-C488 HydrophobicContact CB-CB 3.9Å; F484-C488 HydrophobicContact CD1-CB 4.04Å; F484-C488 HydrophobicContact CG-CB 4.17Å; C485-C488 WeakPolarHBondContact O-CA 2.89Å; C485-C488 WeakPolarHBondContact O-CB 3.37Å; C485-C488 PolarHBondContact O-N 2.93Å; S486-C488 CarbonylContact O-C 3.57Å; S486-C488 PolarHBondContact O-N 3.3Å; C488-N490 PolarHBondContact O-N 2.96Å; C488-S491 WeakPolarHBondContact O-CA 3.44Å; C488-S491 WeakPolarHBondContact O-CB 3.33Å; C488-S491 PolarHBondContact O-N 2.97Å; C488-I573 HydrophobicContact CB-CD1 4.5Å; C488-I573 WeakPolarHBondContact O-CD1 3.36Å; C488-I573 WeakPolarHBondContact O-CG1 3.42Å; C488-C576 PolarHBondContact SG-N 2.71Å; C488-C576 VanDerWaalsContact SG-SG 3.64Å
489	C	67.6	Low	63	Low	19 Å²	19	48.8 Å²	48.8	13%	0.128	26%	0.26	C	S	.	.	H	α-helix	trans	-51.4	-43.9	175.7	-57.7	0	0	0	0	111.8	M481 F484 C485 S486 S491 L492	M481-C489 HydrophobicContact CE-CB 3.95Å; M481-C489 VanDerWaalsContact CE-SG 3.59Å; M481-C489 HydrophobicContact SD-CB 3.79Å; M481-C489 VanDerWaalsContact SD-SG 3.65Å; F484-C489 WeakPolarHBondContact CB-SG 3.39Å; C485-C489 PolarHBondContact O-N 2.96Å; C485-C489 VanDerWaalsContact O-N 3.1Å; C485-C489 PolarHBondContact O-SG 3.42Å; S486-C489 CarbonylContact O-C 3.54Å; S486-C489 WeakPolarHBondContact O-CA 3.28Å; S486-C489 WeakPolarHBondContact O-CB 3.28Å; S486-C489 PolarHBondContact O-N 3.09Å; C489-S491 PolarHBondContact O-N 3.1Å; C489-S491 VanDerWaalsContact O-N 3.11Å; C489-L492 VanDerWaalsContact O-CB 3.25Å; C489-L492 WeakPolarHBondContact O-CB 3.42Å; C489-L492 PolarHBondContact O-N 2.98Å; C489-L492 VanDerWaalsContact O-N 3.1Å
490	N	68.4	Low	63.2	Low	55 Å²	55	50.6 Å²	50.6	29%	0.294	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64	-13.6	179	-57.2	3.9	0	0	0	113.4	F468 S486 C488	F468-N490 HydrophobicContact CD1-CB 4.01Å; F468-N490 WeakPolarHBondContact CD1-OD1 3.48Å; F468-N490 WeakPolarHBondContact CD2-OD1 3.3Å; F468-N490 VanDerWaalsContact CE1-CA 3.5Å; F468-N490 HydrophobicContact CE1-CB 3.42Å; F468-N490 VanDerWaalsContact CE1-CB 3.42Å; F468-N490 WeakPolarHBondContact CE1-OD1 3.36Å; F468-N490 HydrophobicContact CE2-CB 4.25Å; F468-N490 VanDerWaalsContact CE2-ND2 3.26Å; F468-N490 WeakPolarHBondContact CE2-ND2 2.95Å; F468-N490 WeakPolarHBondContact CE2-OD1 3.38Å; F468-N490 WeakPolarHBondContact CG-OD1 3.29Å; F468-N490 HydrophobicContact CZ-CB 3.57Å; F468-N490 WeakPolarHBondContact CZ-ND2 3.39Å; F468-N490 WeakPolarHBondContact CZ-OD1 3.42Å; S486-N490 VanDerWaalsContact C-CG 3.42Å; S486-N490 VanDerWaalsContact O-CB 3.32Å; S486-N490 WeakPolarHBondContact O-CB 3.42Å; S486-N490 PolarHBondContact O-N 3.39Å; S486-N490 PolarHBondContact O-ND2 3.5Å; S486-N490 PolarHBondContact O-OD1 2.65Å; C488-N490 PolarHBondContact O-N 2.96Å
491	S	67.2	Low	63.2	Low	34 Å²	34	55.5 Å²	55.5	24%	0.238	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.3	9.9	178.6	-141.4	0	0	0	0	113.4	C488 C489 R493 H574	C488-S491 WeakPolarHBondContact O-CA 3.44Å; C488-S491 WeakPolarHBondContact O-CB 3.33Å; C488-S491 PolarHBondContact O-N 2.97Å; C489-S491 PolarHBondContact O-N 3.1Å; C489-S491 VanDerWaalsContact O-N 3.11Å; S491-R493 PolarHBondContact O-N 2.87Å; S491-H574 WeakPolarHBondContact OG-CB 3.35Å
492	L	69.7	Low	62.7	Low	26 Å²	26	55.2 Å²	55.2	14%	0.136	28%	0.28	C	S	.	.			trans	-65.3	113.5	172.3	-173.1	67.6	0	0	0	110.1	N472 V477 C489 T571 V572 I573	N472-L492 HydrophobicContact CB-CD2 3.68Å; N472-L492 HydrophobicContact CB-CG 4.05Å; N472-L492 PolarHBondContact ND2-O 2.83Å; V477-L492 HydrophobicContact CG1-CD2 4.05Å; C489-L492 VanDerWaalsContact O-CB 3.25Å; C489-L492 WeakPolarHBondContact O-CB 3.42Å; C489-L492 PolarHBondContact O-N 2.98Å; C489-L492 VanDerWaalsContact O-N 3.1Å; L492-T571 HydrophobicContact CD1-CG2 3.63Å; L492-T571 HydrophobicContact CG-CG2 4.28Å; L492-V572 CarbonylContact C-O 3.59Å; L492-V572 WeakPolarHBondContact CA-O 3.38Å; L492-I573 HydrophobicContact CD1-CB 4.12Å
493	R	66.5	Low	61.7	Low	43 Å²	43	56.6 Å²	56.6	16%	0.162	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	150.5	-176.2	59.4	-176.5	170.8	-151.4	-3.7	112.4	S491 V495 D537 V572	S491-R493 PolarHBondContact O-N 2.87Å; R493-V495 HydrophobicContact CG-CG2 4.4Å; R493-D537 IonicContact CZ-OD1 2.59Å; R493-D537 IonicContact CZ-OD2 3.34Å; R493-D537 IonicContact NE-OD2 2.72Å; R493-D537 IonicContact NH2-OD1 2.76Å; R493-D537 PolarHBondContact NH2-OD1 2.79Å; R493-D537 IonicContact NH2-OD2 3.67Å; R493-D537 PolarHBondContact NH2-OD2 2.73Å; R493-V572 HydrophobicContact CG-CB 4.22Å; R493-V572 PolarHBondContact N-O 3.21Å; R493-V572 PolarHBondContact O-N 3.25Å
494	T	67.7	Low	60.2	Low	37 Å²	37	63.1 Å²	63.1	23%	0.227	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	113.3	174.9	-62.8	0	0	0	0	110.2	N512 Q569 F570	T494-N512 PolarHBondContact O-ND2 3.24Å; T494-Q569 HydrophobicContact CG2-CB 4.45Å; T494-F570 CarbonylContact C-O 2.88Å; T494-F570 WeakPolarHBondContact CA-O 3.4Å
495	V	61.4	Low	58.5	Low	3 Å²	3	65.2 Å²	65.2	2%	0.018	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	109.1	179.6	-175.2	0	0	0	0	108.7	R493 L497 T511 N512 Y513 L533 F570 V572	R493-V495 HydrophobicContact CG-CG2 4.4Å; V495-L497 PolarHBondContact O-N 3.05Å; V495-T511 HydrophobicContact CG1-CG2 3.61Å; V495-N512 WeakPolarHBondContact CA-OD1 3.39Å; V495-Y513 HydrophobicContact CG2-CD2 4.42Å; V495-Y513 HydrophobicContact CG2-CE2 4.26Å; V495-L533 HydrophobicContact CG1-CD1 4.35Å; V495-L533 HydrophobicContact CG1-CG 4.49Å; V495-F570 PolarHBondContact N-O 3.45Å; V495-F570 PolarHBondContact O-N 2.96Å; V495-V572 HydrophobicContact CG2-CG2 4.12Å
496	K	63.5	Low	56.5	Low	84 Å²	84	67.5 Å²	67.5	37%	0.365	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	102.6	170.5	-174	-177.4	179.5	179.6	0	108.8	V498 T511 N512 S567 I568 Q569	K496-V498 HydrophobicContact CD-CG2 4.25Å; K496-V498 HydrophobicContact CG-CG2 4.1Å; K496-T511 CarbonylContact O-C 3.5Å; K496-T511 VanDerWaalsContact O-CA 3.27Å; K496-T511 WeakPolarHBondContact O-CA 3.38Å; K496-N512 HydrophobicContact CB-CB 4.24Å; K496-N512 PolarHBondContact N-OD1 3.05Å; K496-N512 PolarHBondContact O-N 2.79Å; K496-N512 VanDerWaalsContact O-N 3.08Å; K496-S567 VanDerWaalsContact CE-CB 3.44Å; K496-S567 WeakPolarHBondContact CE-OG 3.35Å; K496-I568 CarbonylContact C-O 3.32Å; K496-I568 WeakPolarHBondContact CA-O 3.49Å; K496-Q569 HydrophobicContact CB-CG 4.33Å; K496-Q569 HydrophobicContact CG-CG 4.23Å
497	L	58.1	Low	54.9	Low	21 Å²	21	67.2 Å²	67.2	11%	0.11	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	131	169.1	-106.4	160.2	0	0	0	109.5	V495 F509 Y510 T511 L516 S567 I568 F570	V495-L497 PolarHBondContact O-N 3.05Å; L497-F509 HydrophobicContact CD2-CB 3.61Å; L497-F509 HydrophobicContact CD2-CD1 3.86Å; L497-F509 HydrophobicContact CD2-CG 4.04Å; L497-Y510 CarbonylContact C-O 3.56Å; L497-Y510 WeakPolarHBondContact CA-O 3.38Å; L497-T511 HydrophobicContact CG-CG2 4.46Å; L497-L516 HydrophobicContact CD2-CD1 3.58Å; L497-L516 HydrophobicContact CG-CD1 4.24Å; L497-S567 CarbonylContact O-C 3.59Å; L497-S567 WeakPolarHBondContact O-CA 3.29Å; L497-S567 VanDerWaalsContact O-CB 3.31Å; L497-S567 WeakPolarHBondContact O-CB 3.08Å; L497-I568 HydrophobicContact CB-CB 4.34Å; L497-I568 PolarHBondContact N-O 3.36Å; L497-I568 PolarHBondContact O-N 3.26Å; L497-F570 HydrophobicContact CB-CD2 4.11Å; L497-F570 HydrophobicContact CB-CE2 3.92Å; L497-F570 HydrophobicContact CD1-CD2 3.66Å; L497-F570 HydrophobicContact CD1-CE2 3.32Å; L497-F570 HydrophobicContact CD1-CZ 4.16Å; L497-F570 HydrophobicContact CG-CD2 4.39Å; L497-F570 HydrophobicContact CG-CE2 4.21Å
498	V	55.2	Low	53.5	Low	39 Å²	39	64 Å²	64	24%	0.236	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	121.1	-179.4	-178.1	0	0	0	0	108.3	K496 Y510 E566	K496-V498 HydrophobicContact CD-CG2 4.25Å; K496-V498 HydrophobicContact CG-CG2 4.1Å; V498-Y510 PolarHBondContact N-O 3.43Å; V498-Y510 PolarHBondContact O-N 2.87Å; V498-E566 CarbonylContact C-O 3.51Å; V498-E566 WeakPolarHBondContact CA-O 3.48Å
499	K	56.7	Low	52.2	Low	70 Å²	70	65.7 Å²	65.7	30%	0.304	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	130.1	171.2	-162.9	-162.6	-174.2	-160.2	0	108.3	E501 T507 F509 E566	K499-E501 VanDerWaalsContact CE-OE1 3.31Å; K499-E501 WeakPolarHBondContact CE-OE1 3.16Å; K499-E501 IonicContact NZ-OE1 2.71Å; K499-E501 PolarHBondContact NZ-OE1 2.87Å; K499-T507 HydrophobicContact CD-CG2 4.21Å; K499-T507 WeakPolarHBondContact CE-OG1 3.48Å; K499-T507 HydrophobicContact CG-CG2 3.6Å; K499-F509 HydrophobicContact CB-CD1 4.49Å; K499-F509 HydrophobicContact CB-CE1 4.13Å; K499-F509 HydrophobicContact CG-CE1 4.02Å; K499-F509 HydrophobicContact CG-CZ 4.49Å; K499-E566 PolarHBondContact N-O 3.34Å
500	K	50	Low	51	Low	119 Å²	119	68.9 Å²	68.9	52%	0.517	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	133.8	163.5	-71.5	-168.8	-179.7	179.4	0	108.9	Y508 Y510	K500-Y508 PolarHBondContact N-O 2.85Å; K500-Y508 PolarHBondContact O-N 3.38Å; K500-Y510 HydrophobicContact CB-CD2 4.14Å; K500-Y510 HydrophobicContact CB-CE2 3.95Å; K500-Y510 HydrophobicContact CD-CD2 3.89Å; K500-Y510 HydrophobicContact CD-CE2 3.71Å; K500-Y510 HydrophobicContact CG-CD2 4Å; K500-Y510 HydrophobicContact CG-CE2 4.1Å
501	E	48.8	Very low	50	Low	120 Å²	120	67 Å²	67	56%	0.561	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.5	144.3	164.6	-74.4	160.6	-150.9	0	0	109	K499 F506	K499-E501 VanDerWaalsContact CE-OE1 3.31Å; K499-E501 WeakPolarHBondContact CE-OE1 3.16Å; K499-E501 IonicContact NZ-OE1 2.71Å; K499-E501 PolarHBondContact NZ-OE1 2.87Å; E501-F506 WeakPolarHBondContact CA-O 3.44Å
502	N	45.3	Very low	49.1	Very low	50 Å²	50	69.1 Å²	69.1	27%	0.267	33%	0.332	S	S	.	.			trans	-94.9	173.5	168.3	77	-3.6	0	0	0	111.1	Y504 G505 F506 Y508	N502-Y504 PolarHBondContact O-N 3.11Å; N502-Y504 WeakPolarHBondContact OD1-CA 3.28Å; N502-Y504 PolarHBondContact OD1-N 3.33Å; N502-Y504 VanDerWaalsContact OD1-N 3.1Å; N502-G505 PolarHBondContact O-N 2.84Å; N502-G505 PolarHBondContact OD1-N 3.02Å; N502-F506 PolarHBondContact N-O 2.81Å; N502-F506 VanDerWaalsContact N-O 3.09Å; N502-F506 PolarHBondContact OD1-N 2.83Å; N502-Y508 HydrophobicContact CB-CD2 4.39Å; N502-Y508 HydrophobicContact CB-CE2 3.87Å; N502-Y508 WeakPolarHBondContact ND2-CE2 3.5Å; N502-Y508 PolarHBondContact ND2-OH 3.19Å
503	E	37.5	Very low	47.5	Very low	189 Å²	189	72.6 Å²	72.6	88%	0.883	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-13	-178.9	-63.6	169.5	173.7	0	0	113.9
504	Y	32.2	Very low	46	Very low	189 Å²	189	72.1 Å²	72.1	74%	0.741	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	8.1	175.9	-50.7	-73.7	0	0	0	113.2	N502 F506	N502-Y504 PolarHBondContact O-N 3.11Å; N502-Y504 WeakPolarHBondContact OD1-CA 3.28Å; N502-Y504 PolarHBondContact OD1-N 3.33Å; N502-Y504 VanDerWaalsContact OD1-N 3.1Å; Y504-F506 PolarHBondContact O-N 2.84Å
505	G	32.1	Very low	44.1	Very low	57 Å²	57	72.5 Å²	72.5	59%	0.588	36%	0.357	S	S	*	.	S	Bend	trans	80.5	3.4	177.4	0	0	0	0	0	116	N502 T507	N502-G505 PolarHBondContact O-N 2.84Å; N502-G505 PolarHBondContact OD1-N 3.02Å; G505-T507 PolarHBondContact O-N 2.84Å
506	F	31.4	Very low	43	Very low	99 Å²	99	74.1 Å²	74.1	43%	0.434	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-75.3	127.7	176.5	-64.5	-81.5	0	0	0	110.8	E501 N502 Y504 Y508	E501-F506 WeakPolarHBondContact CA-O 3.44Å; N502-F506 PolarHBondContact N-O 2.81Å; N502-F506 VanDerWaalsContact N-O 3.09Å; N502-F506 PolarHBondContact OD1-N 2.83Å; Y504-F506 PolarHBondContact O-N 2.84Å; F506-Y508 HydrophobicContact CB-CD2 4.42Å; F506-Y508 HydrophobicContact CB-CE2 3.62Å; F506-Y508 VanDerWaalsContact O-CD2 3.31Å; F506-Y508 WeakPolarHBondContact O-CD2 3.39Å; F506-Y508 WeakPolarHBondContact O-CE2 3.26Å
507	T	36.5	Very low	41.4	Very low	30 Å²	30	72 Å²	72	18%	0.184	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.4	117.2	172.3	-70.7	0	0	0	0	110.9	K499 G505 F509 N633	K499-T507 HydrophobicContact CD-CG2 4.21Å; K499-T507 WeakPolarHBondContact CE-OG1 3.48Å; K499-T507 HydrophobicContact CG-CG2 3.6Å; G505-T507 PolarHBondContact O-N 2.84Å; T507-F509 HydrophobicContact CG2-CD2 4.33Å; T507-F509 HydrophobicContact CG2-CE1 4.28Å; T507-F509 HydrophobicContact CG2-CE2 3.75Å; T507-F509 HydrophobicContact CG2-CZ 3.73Å; T507-N633 PolarHBondContact O-ND2 2.8Å
508	Y	37.9	Very low	40	Very low	59 Å²	59	76.3 Å²	76.3	23%	0.231	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.4	146	170.3	-62.6	-93.8	0	0	0	110.6	K500 N502 F506 Y510 V517	K500-Y508 PolarHBondContact N-O 2.85Å; K500-Y508 PolarHBondContact O-N 3.38Å; N502-Y508 HydrophobicContact CB-CD2 4.39Å; N502-Y508 HydrophobicContact CB-CE2 3.87Å; N502-Y508 WeakPolarHBondContact ND2-CE2 3.5Å; N502-Y508 PolarHBondContact ND2-OH 3.19Å; F506-Y508 HydrophobicContact CB-CD2 4.42Å; F506-Y508 HydrophobicContact CB-CE2 3.62Å; F506-Y508 VanDerWaalsContact O-CD2 3.31Å; F506-Y508 WeakPolarHBondContact O-CD2 3.39Å; F506-Y508 WeakPolarHBondContact O-CE2 3.26Å; Y508-Y510 HydrophobicContact CG-CE2 4.43Å; Y508-V517 HydrophobicContact CD1-CG2 4Å
509	F	42.2	Very low	38.5	Very low	36 Å²	36	82.8 Å²	82.8	16%	0.158	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.3	110	173.9	-72.6	-67.8	0	0	0	109.7	L497 K499 T507 L516 V629	L497-F509 HydrophobicContact CD2-CB 3.61Å; L497-F509 HydrophobicContact CD2-CD1 3.86Å; L497-F509 HydrophobicContact CD2-CG 4.04Å; K499-F509 HydrophobicContact CB-CD1 4.49Å; K499-F509 HydrophobicContact CB-CE1 4.13Å; K499-F509 HydrophobicContact CG-CE1 4.02Å; K499-F509 HydrophobicContact CG-CZ 4.49Å; T507-F509 HydrophobicContact CG2-CD2 4.33Å; T507-F509 HydrophobicContact CG2-CE1 4.28Å; T507-F509 HydrophobicContact CG2-CE2 3.75Å; T507-F509 HydrophobicContact CG2-CZ 3.73Å; F509-L516 HydrophobicContact CB-CD1 4.22Å; F509-L516 WeakPolarHBondContact O-CB 3.38Å; F509-L516 PolarHBondContact O-N 3.4Å; F509-L516 VanDerWaalsContact O-N 3.16Å; F509-V629 HydrophobicContact CE2-CG1 4.11Å
510	Y	42.9	Very low	37	Very low	86 Å²	86	85.5 Å²	85.5	34%	0.337	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	139.5	174.2	-67.8	-93.1	0	0	0	109.4	L497 V498 K500 Y508 C515	L497-Y510 CarbonylContact C-O 3.56Å; L497-Y510 WeakPolarHBondContact CA-O 3.38Å; V498-Y510 PolarHBondContact N-O 3.43Å; V498-Y510 PolarHBondContact O-N 2.87Å; K500-Y510 HydrophobicContact CB-CD2 4.14Å; K500-Y510 HydrophobicContact CB-CE2 3.95Å; K500-Y510 HydrophobicContact CD-CD2 3.89Å; K500-Y510 HydrophobicContact CD-CE2 3.71Å; K500-Y510 HydrophobicContact CG-CD2 4Å; K500-Y510 HydrophobicContact CG-CE2 4.1Å; Y508-Y510 HydrophobicContact CG-CE2 4.43Å; Y510-C515 HydrophobicContact CD1-CB 4.17Å; Y510-C515 HydrophobicContact CE1-CB 4.14Å
511	T	47.1	Very low	35.8	Very low	15 Å²	15	86.6 Å²	86.6	9%	0.092	45%	0.449	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	163	164.2	67.6	0	0	0	0	110	V495 K496 L497 Y513 G514 L516	V495-T511 HydrophobicContact CG1-CG2 3.61Å; K496-T511 CarbonylContact O-C 3.5Å; K496-T511 VanDerWaalsContact O-CA 3.27Å; K496-T511 WeakPolarHBondContact O-CA 3.38Å; L497-T511 HydrophobicContact CG-CG2 4.46Å; T511-Y513 PolarHBondContact O-N 3.43Å; T511-Y513 WeakPolarHBondContact OG1-CA 3.47Å; T511-Y513 PolarHBondContact OG1-N 3.05Å; T511-G514 PolarHBondContact N-O 3.48Å; T511-G514 PolarHBondContact O-N 3.08Å; T511-G514 PolarHBondContact OG1-N 3.41Å; T511-G514 PolarHBondContact OG1-O 2.87Å; T511-L516 HydrophobicContact CG2-CD1 3.61Å; T511-L516 HydrophobicContact CG2-CG 3.85Å
512	N	48.4	Very low	34.6	Very low	80 Å²	80	91.6 Å²	91.6	43%	0.428	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-0.3	161.6	57.9	-40.4	0	0	0	114.5	T494 V495 K496	T494-N512 PolarHBondContact O-ND2 3.24Å; V495-N512 WeakPolarHBondContact CA-OD1 3.39Å; K496-N512 HydrophobicContact CB-CB 4.24Å; K496-N512 PolarHBondContact N-OD1 3.05Å; K496-N512 PolarHBondContact O-N 2.79Å; K496-N512 VanDerWaalsContact O-N 3.08Å
513	Y	36.1	Very low	33.8	Very low	98 Å²	98	96 Å²	96	38%	0.384	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122	1.4	-179.6	-60.6	-61.8	0	0	0	113.4	V495 T511 T531	V495-Y513 HydrophobicContact CG2-CD2 4.42Å; V495-Y513 HydrophobicContact CG2-CE2 4.26Å; T511-Y513 PolarHBondContact O-N 3.43Å; T511-Y513 WeakPolarHBondContact OG1-CA 3.47Å; T511-Y513 PolarHBondContact OG1-N 3.05Å; Y513-T531 VanDerWaalsContact CB-O 3.24Å; Y513-T531 WeakPolarHBondContact CB-O 3.24Å; Y513-T531 HydrophobicContact CD1-CG2 3.93Å; Y513-T531 HydrophobicContact CG-CG2 4.29Å
514	G	36.1	Very low	33.3	Very low	34 Å²	34	94.3 Å²	94.3	35%	0.351	48%	0.483	S	S	.	.	E	Extended strand (participates in β ladder)	trans	134	176	-179.9	0	0	0	0	0	113.9	T511	T511-G514 PolarHBondContact N-O 3.48Å; T511-G514 PolarHBondContact O-N 3.08Å; T511-G514 PolarHBondContact OG1-N 3.41Å; T511-G514 PolarHBondContact OG1-O 2.87Å
515	C	28	Very low	33	Very low	44 Å²	44	92.6 Å²	92.6	30%	0.297	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	137	175.2	-164.3	0	0	0	0	111.2	Y510 V517	Y510-C515 HydrophobicContact CD1-CB 4.17Å; Y510-C515 HydrophobicContact CE1-CB 4.14Å; C515-V517 VanDerWaalsContact C-N 3.3Å; C515-V517 PolarHBondContact SG-N 3.46Å
516	L	38.3	Very low	32.8	Very low	38 Å²	38	96.4 Å²	96.4	20%	0.199	49%	0.492	C	S	.	.	S	Bend	trans	-76.6	-19	172.4	-86.8	155.1	0	0	0	113.2	L497 F509 T511 N518 L533	L497-L516 HydrophobicContact CD2-CD1 3.58Å; L497-L516 HydrophobicContact CG-CD1 4.24Å; F509-L516 HydrophobicContact CB-CD1 4.22Å; F509-L516 WeakPolarHBondContact O-CB 3.38Å; F509-L516 PolarHBondContact O-N 3.4Å; F509-L516 VanDerWaalsContact O-N 3.16Å; T511-L516 HydrophobicContact CG2-CD1 3.61Å; T511-L516 HydrophobicContact CG2-CG 3.85Å; L516-N518 PolarHBondContact O-N 2.91Å; L516-L533 HydrophobicContact CD1-CD1 4.47Å; L516-L533 HydrophobicContact CD2-CB 4.48Å; L516-L533 HydrophobicContact CD2-CD1 4.29Å
517	V	29.7	Very low	32.7	Very low	40 Å²	40	101 Å²	101	24%	0.242	52%	0.515	C	S	.	.			trans	-82.7	111.8	-174.1	-173.6	0	0	0	0	109.8	Y508 C515 C634	Y508-V517 HydrophobicContact CD1-CG2 4Å; C515-V517 VanDerWaalsContact C-N 3.3Å; C515-V517 PolarHBondContact SG-N 3.46Å; V517-C634 WeakPolarHBondContact CG1-SG 3.47Å
518	N	26.8	Very low	32.3	Very low	110 Å²	110	106 Å²	106	59%	0.588	54%	0.54	S	S	*	.			trans	-79.4	116.1	172.4	-86.7	-4.2	0	0	0	110.4	L516 K532 C634	L516-N518 PolarHBondContact O-N 2.91Å; N518-K532 PolarHBondContact OD1-NZ 3.13Å; N518-C634 PolarHBondContact O-SG 3.19Å
519	Q	25.5	Very low	31.8	Very low	176 Å²	176	110.1 Å²	110.1	82%	0.822	57%	0.566	S	S	*	*			trans	-128	152.6	146.2	-122.2	179.5	-2	0	0	109.7
520	V	24.2	Very low	31.3	Very low	127 Å²	127	117.2 Å²	117.2	77%	0.77	60%	0.597	S	S	*	*			trans	-106.8	129.4	-156.3	174.9	0	0	0	0	111.9
521	T	25.7	Very low	31.1	Very low	142 Å²	142	115.2 Å²	115.2	87%	0.871	59%	0.594	S	S	*	*			trans	-143	159.1	143	18.4	0	0	0	0	109.7
522	R	23.7	Very low	31.1	Very low	225 Å²	225	118.8 Å²	118.8	85%	0.849	61%	0.608	S	S	*	*			trans	-82.4	175.3	-170.9	-62.4	173.8	173.6	135.2	-4.6	111.8
523	N	26.7	Very low	31.1	Very low	143 Å²	143	117.7 Å²	117.7	77%	0.765	60%	0.601	S	S	*	*			trans	78.2	68.7	165.9	-50.2	-4.3	0	0	0	116.8
524	N	29	Very low	31.6	Very low	152 Å²	152	117.1 Å²	117.1	81%	0.813	60%	0.602	S	S	*	*				-173.7	72.1	128.2	-94.3	-22.8	0	0	0	110.8	N526	N524-N526 PolarHBondContact O-N 2.87Å
525	I	25	Very low	31.9	Very low	153 Å²	153	119.9 Å²	119.9	79%	0.785	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.4	109.5	174	-60	169.6	0	0	0	107.4
526	N	28.2	Very low	32.8	Very low	138 Å²	138	118 Å²	118	74%	0.738	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	169.5	-15.1	146.6	-87	-18.1	0	0	0	114.7	N524	N524-N526 PolarHBondContact O-N 2.87Å
527	Q	29.3	Very low	33.8	Very low	196 Å²	196	116.4 Å²	116.4	92%	0.916	59%	0.594	S	S	*	*	S	Bend	trans	-107.2	0.7	-173.6	-67.3	-170.4	-4.6	0	0	116.5
528	L	27.9	Very low	35.4	Very low	133 Å²	133	115 Å²	115	70%	0.696	59%	0.585	S	S	*	*			trans	-103.1	9.5	-168.4	-92	155.8	0	0	0	116.1	K530 T531	L528-K530 PolarHBondContact O-N 3.32Å; L528-K530 VanDerWaalsContact O-N 3.12Å; L528-T531 PolarHBondContact O-OG1 3.45Å
529	N	27.1	Very low	37.2	Very low	146 Å²	146	112 Å²	112	78%	0.781	57%	0.568	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.2	29.4	-162.6	-70.3	-3.1	0	0	0	116.6
530	K	32.7	Very low	39.2	Very low	186 Å²	186	104 Å²	104	81%	0.809	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133.8	0.9	-179.8	-70.8	-172.4	176.9	178.8	0	116	L528	L528-K530 PolarHBondContact O-N 3.32Å; L528-K530 VanDerWaalsContact O-N 3.12Å
531	T	36.8	Very low	41.1	Very low	44 Å²	44	98.9 Å²	98.9	27%	0.27	50%	0.499	S	S	.	.			trans	-134.5	27.1	-148	37.7	0	0	0	0	116.7	Y513 L528	Y513-T531 VanDerWaalsContact CB-O 3.24Å; Y513-T531 WeakPolarHBondContact CB-O 3.24Å; Y513-T531 HydrophobicContact CD1-CG2 3.93Å; Y513-T531 HydrophobicContact CG-CG2 4.29Å; L528-T531 PolarHBondContact O-OG1 3.45Å
532	K	48.8	Very low	43	Very low	89 Å²	89	92.1 Å²	92.1	39%	0.387	46%	0.457	S	S	.	.	S	Bend	trans	-132.3	150.5	168.7	-75.1	-175.1	175.3	177.8	0	111.8	N518 Q534	N518-K532 PolarHBondContact OD1-NZ 3.13Å; K532-Q534 PolarHBondContact O-N 2.88Å; K532-Q534 PolarHBondContact O-NE2 3.04Å
533	L	46.5	Very low	45.4	Very low	57 Å²	57	82 Å²	82	30%	0.298	42%	0.423	S	S	.	.			trans	-55	130.8	163.9	-84	158.2	0	0	0	109.2	V495 L516 D537 V572	V495-L533 HydrophobicContact CG1-CD1 4.35Å; V495-L533 HydrophobicContact CG1-CG 4.49Å; L516-L533 HydrophobicContact CD1-CD1 4.47Å; L516-L533 HydrophobicContact CD2-CB 4.48Å; L516-L533 HydrophobicContact CD2-CD1 4.29Å; L533-D537 WeakPolarHBondContact CA-OD2 3.23Å; L533-D537 HydrophobicContact CD2-CB 4.35Å; L533-V572 HydrophobicContact CD2-CG1 4.21Å; L533-V572 HydrophobicContact CD2-CG2 4.1Å
534	Q	48.1	Very low	47.4	Very low	86 Å²	86	81.6 Å²	81.6	40%	0.402	42%	0.416	S	S	.	.			trans	-112	151.7	-176.6	-60.3	-54.9	-50.5	0	0	112.3	K532 G536 D537	K532-Q534 PolarHBondContact O-N 2.88Å; K532-Q534 PolarHBondContact O-NE2 3.04Å; Q534-G536 PolarHBondContact O-N 2.94Å; Q534-D537 PolarHBondContact N-OD2 3.01Å; Q534-D537 VanDerWaalsContact O-CB 3.25Å; Q534-D537 WeakPolarHBondContact O-CB 3.16Å; Q534-D537 PolarHBondContact O-N 3.19Å
535	P	40.9	Very low	48.9	Very low	92 Å²	92	77.3 Å²	77.3	60%	0.597	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	119.8	158.6	-20.6	33.4	0	0	0	109.9	N603	P535-N603 PolarHBondContact O-OD1 2.81Å
536	G	47.9	Very low	50.6	Low	4 Å²	4	70.9 Å²	70.9	4%	0.041	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	109.8	-8	-173.7	0	0	0	0	0	114.8	Q534 L538 V575 N603	Q534-G536 PolarHBondContact O-N 2.94Å; G536-L538 PolarHBondContact O-N 3.44Å; G536-V575 PolarHBondContact O-N 3.12Å; G536-N603 VanDerWaalsContact CA-ND2 3.32Å; G536-N603 WeakPolarHBondContact CA-ND2 3.48Å; G536-N603 WeakPolarHBondContact CA-OD1 3.5Å; G536-N603 PolarHBondContact N-OD1 3.31Å; G536-N603 VanDerWaalsContact N-OD1 3.08Å
537	D	60.1	Low	52.1	Low	5 Å²	5	65.7 Å²	65.7	3%	0.027	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	111.6	172.1	-85.4	-5.6	0	0	0	111.9	R493 L533 Q534 V572 H574 L602	R493-D537 IonicContact CZ-OD1 2.59Å; R493-D537 IonicContact CZ-OD2 3.34Å; R493-D537 IonicContact NE-OD2 2.72Å; R493-D537 IonicContact NH2-OD1 2.76Å; R493-D537 PolarHBondContact NH2-OD1 2.79Å; R493-D537 IonicContact NH2-OD2 3.67Å; R493-D537 PolarHBondContact NH2-OD2 2.73Å; L533-D537 WeakPolarHBondContact CA-OD2 3.23Å; L533-D537 HydrophobicContact CD2-CB 4.35Å; Q534-D537 PolarHBondContact N-OD2 3.01Å; Q534-D537 VanDerWaalsContact O-CB 3.25Å; Q534-D537 WeakPolarHBondContact O-CB 3.16Å; Q534-D537 PolarHBondContact O-N 3.19Å; D537-V572 HydrophobicContact CB-CG1 3.44Å; D537-V572 VanDerWaalsContact CB-CG1 3.44Å; D537-V572 VanDerWaalsContact CG-CG1 3.46Å; D537-H574 IonicContact OD1-CD2 3.61Å; D537-H574 PolarHBondContact OD1-CD2 2.96Å; D537-H574 IonicContact OD1-CG 3.56Å; D537-L602 WeakPolarHBondContact O-CD1 3.49Å
538	L	63.2	Low	53.3	Low	12 Å²	12	58.7 Å²	58.7	6%	0.063	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	123.1	173	-178.8	70.1	0	0	0	110.1	F484 G536 V540 V572 I573 V575 Y599	F484-L538 HydrophobicContact CZ-CD2 3.96Å; G536-L538 PolarHBondContact O-N 3.44Å; L538-V540 PolarHBondContact O-N 2.84Å; L538-V572 WeakPolarHBondContact O-CA 3.46Å; L538-I573 HydrophobicContact CB-CG2 3.94Å; L538-I573 HydrophobicContact CD2-CG2 4.25Å; L538-I573 HydrophobicContact CG-CG2 4.46Å; L538-I573 PolarHBondContact N-O 3.42Å; L538-I573 PolarHBondContact O-N 2.87Å; L538-V575 HydrophobicContact CB-CG2 3.69Å; L538-V575 HydrophobicContact CD2-CG2 4.18Å; L538-Y599 HydrophobicContact CD1-CD1 4.23Å
539	I	64.9	Low	54.3	Low	45 Å²	45	58.1 Å²	58.1	23%	0.231	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	113.9	173.9	-53.1	175.5	0	0	0	109.3	K541 I542 V547 F570	I539-K541 WeakPolarHBondContact CG2-O 3.27Å; I539-I542 HydrophobicContact CG2-CG1 4.08Å; I539-V547 HydrophobicContact CG2-CG2 3.9Å; I539-F570 HydrophobicContact CD1-CD1 4.05Å; I539-F570 HydrophobicContact CD1-CE1 4.26Å; I539-F570 HydrophobicContact CG2-CD1 3.83Å
540	V	66.3	Low	55.2	Low	9 Å²	9	52.8 Å²	52.8	6%	0.055	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	-35.8	178.8	-168.9	0	0	0	0	111.3	V477 L538 V547 T571 I573	V477-V540 HydrophobicContact CG2-CG1 4.45Å; L538-V540 PolarHBondContact O-N 2.84Å; V540-V547 PolarHBondContact O-N 2.82Å; V540-T571 PolarHBondContact N-O 3.25Å; V540-I573 HydrophobicContact CG2-CB 4.18Å; V540-I573 HydrophobicContact CG2-CG2 3.53Å
541	K	64.9	Low	56.3	Low	19 Å²	19	47.4 Å²	47.4	8%	0.083	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	148.9	-176.4	-47.6	175.3	71.7	86.5	0	112.5	S474 I539 F545 D546 F570 T571	S474-K541 PolarHBondContact OG-NZ 2.62Å; I539-K541 WeakPolarHBondContact CG2-O 3.27Å; K541-F545 CarbonylContact C-O 3.58Å; K541-F545 WeakPolarHBondContact CA-O 3.35Å; K541-F545 WeakPolarHBondContact CB-O 3.16Å; K541-D546 IonicContact NZ-OD1 3.84Å; K541-D546 PolarHBondContact NZ-OD1 3.47Å; K541-F570 WeakPolarHBondContact O-CA 3.5Å; K541-T571 HydrophobicContact CD-CG2 4.29Å; K541-T571 PolarHBondContact N-O 3.42Å; K541-T571 PolarHBondContact O-N 2.85Å
542	I	65.9	Low	56.8	Low	0 Å²	0	48.7 Å²	48.7	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	117.9	165.6	-56.8	-179.5	0	0	0	108	I539 H544 F545 V547 F555 L558 L559 Y562 I568 Q569 F570	I539-I542 HydrophobicContact CG2-CG1 4.08Å; I542-H544 PolarHBondContact O-N 3.27Å; I542-F545 PolarHBondContact N-O 2.93Å; I542-F545 WeakPolarHBondContact O-CB 3.28Å; I542-F545 PolarHBondContact O-N 3.06Å; I542-V547 HydrophobicContact CD1-CG2 4.17Å; I542-V547 HydrophobicContact CG1-CG2 3.77Å; I542-F555 HydrophobicContact CD1-CD2 4.19Å; I542-F555 HydrophobicContact CD1-CE2 3.5Å; I542-F555 HydrophobicContact CD1-CZ 4.02Å; I542-L558 HydrophobicContact CB-CD2 4.37Å; I542-L559 HydrophobicContact CD1-CD1 4.44Å; I542-Y562 HydrophobicContact CG2-CD2 3.39Å; I542-Y562 HydrophobicContact CG2-CE2 3.78Å; I542-Y562 HydrophobicContact CG2-CG 3.89Å; I542-I568 HydrophobicContact CG2-CG2 3.75Å; I542-Q569 CarbonylContact C-O 3.52Å; I542-Q569 WeakPolarHBondContact CA-O 3.5Å; I542-F570 HydrophobicContact CD1-CD1 4.29Å; I542-F570 HydrophobicContact CD1-CE1 3.77Å; I542-F570 HydrophobicContact CG1-CD1 3.79Å; I542-F570 HydrophobicContact CG1-CE1 3.76Å; I542-F570 HydrophobicContact CG2-CE1 4.29Å
543	G	72.6	Confident	57	Low	12 Å²	12	48.7 Å²	48.7	12%	0.124	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	53.8	-120.8	-167.3	0	0	0	0	0	110.7	Q569	G543-Q569 PolarHBondContact N-O 2.96Å
544	H	69.8	Low	57.2	Low	135 Å²	135	50.2 Å²	50.2	63%	0.625	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-6.5	176.7	-61	-66.5	0	0	0	114.1	I542	I542-H544 PolarHBondContact O-N 3.27Å
545	F	59.5	Low	57.5	Low	62 Å²	62	47.7 Å²	47.7	27%	0.272	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	130	-175.1	-60.4	-95.8	0	0	0	111.5	K541 I542 V547 L558 Y562	K541-F545 CarbonylContact C-O 3.58Å; K541-F545 WeakPolarHBondContact CA-O 3.35Å; K541-F545 WeakPolarHBondContact CB-O 3.16Å; I542-F545 PolarHBondContact N-O 2.93Å; I542-F545 WeakPolarHBondContact O-CB 3.28Å; I542-F545 PolarHBondContact O-N 3.06Å; F545-V547 PolarHBondContact O-N 3.47Å; F545-L558 HydrophobicContact CB-CD2 3.57Å; F545-L558 HydrophobicContact CD1-CD1 4.29Å; F545-L558 HydrophobicContact CD1-CD2 4.32Å; F545-L558 HydrophobicContact CD2-CD1 3.71Å; F545-L558 HydrophobicContact CD2-CD2 3.87Å; F545-L558 HydrophobicContact CD2-CG 4.38Å; F545-L558 HydrophobicContact CE1-CD1 4.28Å; F545-L558 HydrophobicContact CE2-CD1 3.71Å; F545-L558 HydrophobicContact CG-CD1 4.02Å; F545-L558 HydrophobicContact CG-CD2 3.67Å; F545-L558 HydrophobicContact CZ-CD1 4.01Å; F545-Y562 HydrophobicContact CD2-CE2 4.04Å; F545-Y562 HydrophobicContact CE2-CE2 4.27Å
546	D	60.9	Low	58	Low	18 Å²	18	46.9 Å²	46.9	10%	0.096	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.7	119.7	168.5	-50.2	-59.3	0	0	0	109.1	K541 V548 K549	K541-D546 IonicContact NZ-OD1 3.84Å; K541-D546 PolarHBondContact NZ-OD1 3.47Å; D546-V548 HydrophobicContact CB-CB 4.18Å; D546-V548 HydrophobicContact CB-CG2 4.25Å; D546-V548 PolarHBondContact O-N 3.23Å; D546-K549 HydrophobicContact CB-CD 4.11Å; D546-K549 HydrophobicContact CB-CG 4.26Å; D546-K549 PolarHBondContact O-N 3.41Å; D546-K549 WeakPolarHBondContact OD2-CE 3.38Å; D546-K549 IonicContact OD2-NZ 2.73Å; D546-K549 PolarHBondContact OD2-NZ 2.85Å
547	V	59.2	Low	58.4	Low	29 Å²	29	52 Å²	52	18%	0.176	27%	0.27	C	S	.	.	G	3₁₀ helix	trans	-56.9	-36.5	179.5	169	0	0	0	0	111.1	I539 V540 I542 F545 K549 L550 F555	I539-V547 HydrophobicContact CG2-CG2 3.9Å; V540-V547 PolarHBondContact O-N 2.82Å; I542-V547 HydrophobicContact CD1-CG2 4.17Å; I542-V547 HydrophobicContact CG1-CG2 3.77Å; F545-V547 PolarHBondContact O-N 3.47Å; V547-K549 PolarHBondContact O-N 3.1Å; V547-L550 WeakPolarHBondContact O-CB 3.24Å; V547-L550 PolarHBondContact O-N 3.11Å; V547-F555 HydrophobicContact CG1-CD2 3.79Å; V547-F555 HydrophobicContact CG1-CE2 3.8Å; V547-F555 HydrophobicContact CG2-CD2 4.26Å; V547-F555 HydrophobicContact CG2-CE2 3.97Å
548	V	55	Low	58.3	Low	49 Å²	49	52.9 Å²	52.9	30%	0.297	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-37	-39.2	168.1	-173.4	0	0	0	0	114.8	Y480 D546 L590	Y480-V548 HydrophobicContact CD2-CG2 4.44Å; Y480-V548 HydrophobicContact CE2-CB 4.29Å; Y480-V548 HydrophobicContact CE2-CG1 3.87Å; Y480-V548 HydrophobicContact CE2-CG2 3.44Å; Y480-V548 VanDerWaalsContact CE2-CG2 3.44Å; Y480-V548 VanDerWaalsContact OH-CG1 3.27Å; Y480-V548 WeakPolarHBondContact OH-CG1 3.19Å; Y480-V548 VanDerWaalsContact OH-CG2 3.31Å; Y480-V548 WeakPolarHBondContact OH-CG2 3.37Å; D546-V548 HydrophobicContact CB-CB 4.18Å; D546-V548 HydrophobicContact CB-CG2 4.25Å; D546-V548 PolarHBondContact O-N 3.23Å; V548-L590 HydrophobicContact CG1-CD1 3.9Å
549	K	49.2	Very low	58.1	Low	121 Å²	121	53.5 Å²	53.5	53%	0.526	28%	0.278	S	S	.	.	G	3₁₀ helix	trans	-97	6.5	-171	-64.5	173.2	-175.8	160.6	0	112.9	C476 D546 V547	C476-K549 PolarHBondContact SG-NZ 3Å; D546-K549 HydrophobicContact CB-CD 4.11Å; D546-K549 HydrophobicContact CB-CG 4.26Å; D546-K549 PolarHBondContact O-N 3.41Å; D546-K549 WeakPolarHBondContact OD2-CE 3.38Å; D546-K549 IonicContact OD2-NZ 2.73Å; D546-K549 PolarHBondContact OD2-NZ 2.85Å; V547-K549 PolarHBondContact O-N 3.1Å
550	L	45.3	Very low	57.6	Low	34 Å²	34	54 Å²	54	18%	0.178	29%	0.285	C	S	.	.			trans	-109	124.8	-174.6	-50.6	176.5	0	0	0	110.1	V547 Q554 F555 L558	V547-L550 WeakPolarHBondContact O-CB 3.24Å; V547-L550 PolarHBondContact O-N 3.11Å; L550-Q554 HydrophobicContact CB-CB 4.02Å; L550-Q554 HydrophobicContact CD2-CB 4.16Å; L550-F555 HydrophobicContact CB-CB 4.13Å; L550-F555 HydrophobicContact CD1-CB 4.4Å; L550-F555 HydrophobicContact CD1-CD2 4.27Å; L550-L558 HydrophobicContact CD1-CB 4.46Å; L550-L558 HydrophobicContact CD1-CD2 3.43Å; L550-L558 VanDerWaalsContact CD1-CD2 3.43Å; L550-L558 HydrophobicContact CD2-CD2 4.49Å
551	T	56.2	Low	57.2	Low	74 Å²	74	57.7 Å²	57.7	45%	0.454	31%	0.308	S	S	.	.			trans	-58.8	158.1	159.8	57.3	0	0	0	0	110.5	T553 Q554 F555	T551-T553 PolarHBondContact O-N 3.26Å; T551-Q554 CarbonylContact O-C 3.59Å; T551-Q554 PolarHBondContact O-N 2.97Å; T551-Q554 WeakPolarHBondContact OG1-CG 3.1Å; T551-Q554 PolarHBondContact OG1-N 3.06Å; T551-Q554 PolarHBondContact OG1-OE1 3.29Å; T551-F555 PolarHBondContact O-N 2.92Å
552	K	48.1	Very low	56.7	Low	71 Å²	71	58.6 Å²	58.6	31%	0.309	31%	0.311	S	S	.	.	H	α-helix	trans	-46.5	-39.3	172.6	177.7	-179.6	172	-171	0	112.9	S556 T617 N618	K552-S556 WeakPolarHBondContact O-CB 3.28Å; K552-S556 PolarHBondContact O-N 3.07Å; K552-T617 PolarHBondContact NZ-O 3.19Å; K552-N618 VanDerWaalsContact CE-OD1 3.29Å; K552-N618 WeakPolarHBondContact CE-OD1 3.22Å; K552-N618 PolarHBondContact NZ-OD1 3.34Å
553	T	52.2	Low	56.1	Low	89 Å²	89	61.1 Å²	61.1	55%	0.546	32%	0.324	S	S	.	.	H	α-helix	trans	-67.6	-48.5	176.4	-44.3	0	0	0	0	112.1	T551 F555 S556 Q557	T551-T553 PolarHBondContact O-N 3.26Å; T553-F555 VanDerWaalsContact C-N 3.35Å; T553-F555 PolarHBondContact O-N 3.37Å; T553-S556 PolarHBondContact O-N 3.1Å; T553-Q557 WeakPolarHBondContact O-CB 3.35Å; T553-Q557 VanDerWaalsContact O-CG 3.27Å; T553-Q557 WeakPolarHBondContact O-CG 3.48Å; T553-Q557 PolarHBondContact O-N 3.2Å
554	Q	50.8	Low	55.3	Low	88 Å²	88	69 Å²	69	41%	0.411	36%	0.355	S	S	.	.	H	α-helix	trans	-64.6	-37.8	176.5	-73	162	-49.1	0	0	112	L550 T551 L558	L550-Q554 HydrophobicContact CB-CB 4.02Å; L550-Q554 HydrophobicContact CD2-CB 4.16Å; T551-Q554 CarbonylContact O-C 3.59Å; T551-Q554 PolarHBondContact O-N 2.97Å; T551-Q554 WeakPolarHBondContact OG1-CG 3.1Å; T551-Q554 PolarHBondContact OG1-N 3.06Å; T551-Q554 PolarHBondContact OG1-OE1 3.29Å; Q554-L558 WeakPolarHBondContact O-CB 3.3Å; Q554-L558 PolarHBondContact O-N 2.86Å
555	F	54.3	Low	54.7	Low	33 Å²	33	64.7 Å²	64.7	15%	0.145	34%	0.34	C	S	.	.	H	α-helix	trans	-63.5	-46.3	174.3	179.5	-91.5	0	0	0	111.3	I542 V547 L550 T551 T553 L558 L559 L600	I542-F555 HydrophobicContact CD1-CD2 4.19Å; I542-F555 HydrophobicContact CD1-CE2 3.5Å; I542-F555 HydrophobicContact CD1-CZ 4.02Å; V547-F555 HydrophobicContact CG1-CD2 3.79Å; V547-F555 HydrophobicContact CG1-CE2 3.8Å; V547-F555 HydrophobicContact CG2-CD2 4.26Å; V547-F555 HydrophobicContact CG2-CE2 3.97Å; L550-F555 HydrophobicContact CB-CB 4.13Å; L550-F555 HydrophobicContact CD1-CB 4.4Å; L550-F555 HydrophobicContact CD1-CD2 4.27Å; T551-F555 PolarHBondContact O-N 2.92Å; T553-F555 VanDerWaalsContact C-N 3.35Å; T553-F555 PolarHBondContact O-N 3.37Å; F555-L558 PolarHBondContact O-N 2.68Å; F555-L559 HydrophobicContact CE1-CD2 4.02Å; F555-L559 WeakPolarHBondContact O-CB 3.47Å; F555-L559 PolarHBondContact O-N 3Å; F555-L600 HydrophobicContact CZ-CD1 4.4Å
556	S	52.4	Low	54.9	Low	76 Å²	76	69 Å²	69	53%	0.531	36%	0.361	S	S	.	.	H	α-helix	trans	-63.1	-44.6	176.7	-176.8	0	0	0	0	112.2	K552 T553 L559 S560	K552-S556 WeakPolarHBondContact O-CB 3.28Å; K552-S556 PolarHBondContact O-N 3.07Å; T553-S556 PolarHBondContact O-N 3.1Å; S556-L559 PolarHBondContact O-N 3.28Å; S556-S560 WeakPolarHBondContact O-CB 3.19Å; S556-S560 PolarHBondContact O-N 3.33Å
557	Q	56.4	Low	54.9	Low	112 Å²	112	70.4 Å²	70.4	52%	0.523	37%	0.372	S	S	.	.	H	α-helix	trans	-60.6	-49.7	174.2	-75	170.4	-19.1	0	0	111.5	T553 L559 S560 V561	T553-Q557 WeakPolarHBondContact O-CB 3.35Å; T553-Q557 VanDerWaalsContact O-CG 3.27Å; T553-Q557 WeakPolarHBondContact O-CG 3.48Å; T553-Q557 PolarHBondContact O-N 3.2Å; Q557-L559 PolarHBondContact O-N 3.08Å; Q557-S560 PolarHBondContact O-N 3.02Å; Q557-S560 VanDerWaalsContact O-N 3.11Å; Q557-S560 PolarHBondContact O-OG 2.76Å; Q557-V561 WeakPolarHBondContact O-CG2 3.37Å; Q557-V561 PolarHBondContact O-N 3.12Å
558	L	57.3	Low	55.2	Low	22 Å²	22	69.4 Å²	69.4	12%	0.115	37%	0.365	C	S	.	.	H	α-helix	trans	-62.7	-42.9	-179.7	-170.2	72.7	0	0	0	111.3	I542 F545 L550 Q554 F555 S560 V561 Y562	I542-L558 HydrophobicContact CB-CD2 4.37Å; F545-L558 HydrophobicContact CB-CD2 3.57Å; F545-L558 HydrophobicContact CD1-CD1 4.29Å; F545-L558 HydrophobicContact CD1-CD2 4.32Å; F545-L558 HydrophobicContact CD2-CD1 3.71Å; F545-L558 HydrophobicContact CD2-CD2 3.87Å; F545-L558 HydrophobicContact CD2-CG 4.38Å; F545-L558 HydrophobicContact CE1-CD1 4.28Å; F545-L558 HydrophobicContact CE2-CD1 3.71Å; F545-L558 HydrophobicContact CG-CD1 4.02Å; F545-L558 HydrophobicContact CG-CD2 3.67Å; F545-L558 HydrophobicContact CZ-CD1 4.01Å; L550-L558 HydrophobicContact CD1-CB 4.46Å; L550-L558 HydrophobicContact CD1-CD2 3.43Å; L550-L558 VanDerWaalsContact CD1-CD2 3.43Å; L550-L558 HydrophobicContact CD2-CD2 4.49Å; Q554-L558 WeakPolarHBondContact O-CB 3.3Å; Q554-L558 PolarHBondContact O-N 2.86Å; F555-L558 PolarHBondContact O-N 2.68Å; L558-S560 VanDerWaalsContact C-N 3.33Å; L558-S560 PolarHBondContact O-N 2.93Å; L558-V561 PolarHBondContact O-N 2.92Å; L558-Y562 HydrophobicContact CD1-CD2 4.14Å; L558-Y562 HydrophobicContact CD1-CE2 3.8Å; L558-Y562 HydrophobicContact CD2-CD2 4.5Å; L558-Y562 HydrophobicContact CD2-CE2 4.25Å; L558-Y562 HydrophobicContact CG-CD2 3.85Å; L558-Y562 HydrophobicContact CG-CE2 3.86Å; L558-Y562 WeakPolarHBondContact O-CD2 3.39Å; L558-Y562 PolarHBondContact O-N 2.99Å
559	L	59.2	Low	55.8	Low	26 Å²	26	71.3 Å²	71.3	14%	0.136	37%	0.371	C	S	.	.	H	α-helix	trans	-63.5	-37.7	173.8	-173.6	62.9	0	0	0	111.2	I542 F555 S556 Q557 V561 Y562 L563 F570	I542-L559 HydrophobicContact CD1-CD1 4.44Å; F555-L559 HydrophobicContact CE1-CD2 4.02Å; F555-L559 WeakPolarHBondContact O-CB 3.47Å; F555-L559 PolarHBondContact O-N 3Å; S556-L559 PolarHBondContact O-N 3.28Å; Q557-L559 PolarHBondContact O-N 3.08Å; L559-V561 VanDerWaalsContact C-N 3.29Å; L559-V561 PolarHBondContact O-N 2.86Å; L559-Y562 PolarHBondContact O-N 3.04Å; L559-L563 HydrophobicContact CD1-CD1 4.29Å; L559-L563 HydrophobicContact CD1-CG 4.15Å; L559-L563 HydrophobicContact CD2-CD1 4.5Å; L559-L563 HydrophobicContact CG-CD1 3.87Å; L559-L563 HydrophobicContact CG-CG 4.2Å; L559-L563 VanDerWaalsContact O-CB 3.26Å; L559-L563 WeakPolarHBondContact O-CB 3.22Å; L559-L563 WeakPolarHBondContact O-CG 3.48Å; L559-L563 PolarHBondContact O-N 3.4Å; L559-F570 HydrophobicContact CD1-CZ 4.37Å
560	S	54.5	Low	56.5	Low	55 Å²	55	66.4 Å²	66.4	39%	0.385	35%	0.35	S	S	.	.	H	α-helix	trans	-67.9	-25.5	174.6	82.4	0	0	0	0	113.8	S556 Q557 L558 K564	S556-S560 WeakPolarHBondContact O-CB 3.19Å; S556-S560 PolarHBondContact O-N 3.33Å; Q557-S560 PolarHBondContact O-N 3.02Å; Q557-S560 VanDerWaalsContact O-N 3.11Å; Q557-S560 PolarHBondContact O-OG 2.76Å; L558-S560 VanDerWaalsContact C-N 3.33Å; L558-S560 PolarHBondContact O-N 2.93Å; S560-K564 WeakPolarHBondContact O-CG 3.23Å
561	V	57.5	Low	57.7	Low	87 Å²	87	65.3 Å²	65.3	53%	0.527	34%	0.344	S	S	.	.	H	α-helix	trans	-78.8	-43.9	173.1	171.1	0	0	0	0	110.4	Q557 L558 L559 K564 S565	Q557-V561 WeakPolarHBondContact O-CG2 3.37Å; Q557-V561 PolarHBondContact O-N 3.12Å; L558-V561 PolarHBondContact O-N 2.92Å; L559-V561 VanDerWaalsContact C-N 3.29Å; L559-V561 PolarHBondContact O-N 2.86Å; V561-K564 WeakPolarHBondContact O-CB 3.41Å; V561-K564 PolarHBondContact O-N 3.34Å; V561-S565 PolarHBondContact O-N 2.88Å; V561-S565 PolarHBondContact O-OG 3.24Å
562	Y	54.2	Low	58.3	Low	37 Å²	37	61.8 Å²	61.8	15%	0.145	32%	0.323	C	S	.	.	H	α-helix	trans	-71.3	-32.6	176.8	-82.9	-65	0	0	0	113.4	I542 F545 L558 L559 K564 S565 I568	I542-Y562 HydrophobicContact CG2-CD2 3.39Å; I542-Y562 HydrophobicContact CG2-CE2 3.78Å; I542-Y562 HydrophobicContact CG2-CG 3.89Å; F545-Y562 HydrophobicContact CD2-CE2 4.04Å; F545-Y562 HydrophobicContact CE2-CE2 4.27Å; L558-Y562 HydrophobicContact CD1-CD2 4.14Å; L558-Y562 HydrophobicContact CD1-CE2 3.8Å; L558-Y562 HydrophobicContact CD2-CD2 4.5Å; L558-Y562 HydrophobicContact CD2-CE2 4.25Å; L558-Y562 HydrophobicContact CG-CD2 3.85Å; L558-Y562 HydrophobicContact CG-CE2 3.86Å; L558-Y562 WeakPolarHBondContact O-CD2 3.39Å; L558-Y562 PolarHBondContact O-N 2.99Å; L559-Y562 PolarHBondContact O-N 3.04Å; Y562-K564 PolarHBondContact O-N 2.86Å; Y562-S565 WeakPolarHBondContact O-CA 3.37Å; Y562-S565 WeakPolarHBondContact O-CB 3.49Å; Y562-S565 PolarHBondContact O-N 3.1Å; Y562-I568 HydrophobicContact CD1-CB 4.49Å; Y562-I568 HydrophobicContact CD1-CG1 4.43Å; Y562-I568 HydrophobicContact CD1-CG2 3.91Å; Y562-I568 HydrophobicContact CG-CG2 3.9Å; Y562-I568 VanDerWaalsContact O-CD1 3.25Å; Y562-I568 WeakPolarHBondContact O-CD1 3.46Å; Y562-I568 VanDerWaalsContact O-CG1 3.24Å; Y562-I568 WeakPolarHBondContact O-CG1 3.33Å
563	L	54.1	Low	59.4	Low	53 Å²	53	58.4 Å²	58.4	28%	0.277	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.9	-13.6	172.1	-73.7	172.1	0	0	0	113.5	L559 I568 F625	L559-L563 HydrophobicContact CD1-CD1 4.29Å; L559-L563 HydrophobicContact CD1-CG 4.15Å; L559-L563 HydrophobicContact CD2-CD1 4.5Å; L559-L563 HydrophobicContact CG-CD1 3.87Å; L559-L563 HydrophobicContact CG-CG 4.2Å; L559-L563 VanDerWaalsContact O-CB 3.26Å; L559-L563 WeakPolarHBondContact O-CB 3.22Å; L559-L563 WeakPolarHBondContact O-CG 3.48Å; L559-L563 PolarHBondContact O-N 3.4Å; L563-I568 HydrophobicContact CD2-CD1 4.27Å; L563-F625 HydrophobicContact CD1-CE1 4.31Å; L563-F625 HydrophobicContact CD1-CZ 4.16Å
564	K	56.2	Low	60.3	Low	179 Å²	179	57.6 Å²	57.6	78%	0.778	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-6.9	166.8	-67.4	173	-177.1	-177.2	0	113.2	S560 V561 Y562	S560-K564 WeakPolarHBondContact O-CG 3.23Å; V561-K564 WeakPolarHBondContact O-CB 3.41Å; V561-K564 PolarHBondContact O-N 3.34Å; Y562-K564 PolarHBondContact O-N 2.86Å
565	S	56.1	Low	61	Low	44 Å²	44	53.5 Å²	53.5	31%	0.308	28%	0.279	S	S	.	.	S	Bend	trans	-91.2	138.7	177.7	-53.9	0	0	0	0	110.2	V561 Y562 S567	V561-S565 PolarHBondContact O-N 2.88Å; V561-S565 PolarHBondContact O-OG 3.24Å; Y562-S565 WeakPolarHBondContact O-CA 3.37Å; Y562-S565 WeakPolarHBondContact O-CB 3.49Å; Y562-S565 PolarHBondContact O-N 3.1Å; S565-S567 PolarHBondContact O-N 2.85Å
566	E	63	Low	61.8	Low	152 Å²	152	54.1 Å²	54.1	71%	0.71	29%	0.287	S	S	*	.	S	Bend	trans	-63.2	-23.3	177.9	-60.1	-172.8	145.3	0	0	113.2	V498 K499	V498-E566 CarbonylContact C-O 3.51Å; V498-E566 WeakPolarHBondContact CA-O 3.48Å; K499-E566 PolarHBondContact N-O 3.34Å
567	S	62.7	Low	62.6	Low	47 Å²	47	54.6 Å²	54.6	33%	0.329	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	150.9	167.1	70.2	0	0	0	0	113.3	K496 L497 S565	K496-S567 VanDerWaalsContact CE-CB 3.44Å; K496-S567 WeakPolarHBondContact CE-OG 3.35Å; L497-S567 CarbonylContact O-C 3.59Å; L497-S567 WeakPolarHBondContact O-CA 3.29Å; L497-S567 VanDerWaalsContact O-CB 3.31Å; L497-S567 WeakPolarHBondContact O-CB 3.08Å; S565-S567 PolarHBondContact O-N 2.85Å
568	I	65.1	Low	63.2	Low	8 Å²	8	53.3 Å²	53.3	4%	0.041	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.2	130.7	-176.7	-44.3	171.4	0	0	0	107	K496 L497 I542 Y562 L563 F570	K496-I568 CarbonylContact C-O 3.32Å; K496-I568 WeakPolarHBondContact CA-O 3.49Å; L497-I568 HydrophobicContact CB-CB 4.34Å; L497-I568 PolarHBondContact N-O 3.36Å; L497-I568 PolarHBondContact O-N 3.26Å; I542-I568 HydrophobicContact CG2-CG2 3.75Å; Y562-I568 HydrophobicContact CD1-CB 4.49Å; Y562-I568 HydrophobicContact CD1-CG1 4.43Å; Y562-I568 HydrophobicContact CD1-CG2 3.91Å; Y562-I568 HydrophobicContact CG-CG2 3.9Å; Y562-I568 VanDerWaalsContact O-CD1 3.25Å; Y562-I568 WeakPolarHBondContact O-CD1 3.46Å; Y562-I568 VanDerWaalsContact O-CG1 3.24Å; Y562-I568 WeakPolarHBondContact O-CG1 3.33Å; L563-I568 HydrophobicContact CD2-CD1 4.27Å; I568-F570 HydrophobicContact CB-CD2 4.23Å; I568-F570 HydrophobicContact CB-CE2 3.62Å; I568-F570 HydrophobicContact CB-CZ 4.34Å; I568-F570 HydrophobicContact CD1-CE2 4.14Å; I568-F570 HydrophobicContact CD1-CZ 4.3Å; I568-F570 HydrophobicContact CG1-CE2 4.49Å; I568-F570 HydrophobicContact CG2-CD2 3.86Å; I568-F570 HydrophobicContact CG2-CE1 4.48Å; I568-F570 HydrophobicContact CG2-CE2 3.3Å; I568-F570 HydrophobicContact CG2-CZ 3.67Å
569	Q	66.2	Low	63.6	Low	90 Å²	90	52.4 Å²	52.4	42%	0.421	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	132.1	168.1	-71.8	177.2	-20.9	0	0	109.3	T494 K496 I542 G543	T494-Q569 HydrophobicContact CG2-CB 4.45Å; K496-Q569 HydrophobicContact CB-CG 4.33Å; K496-Q569 HydrophobicContact CG-CG 4.23Å; I542-Q569 CarbonylContact C-O 3.52Å; I542-Q569 WeakPolarHBondContact CA-O 3.5Å; G543-Q569 PolarHBondContact N-O 2.96Å
570	F	65.4	Low	64	Low	17 Å²	17	51.9 Å²	51.9	8%	0.075	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	129.1	171	-67.4	-96.8	0	0	0	108.4	T494 V495 L497 I539 K541 I542 L559 I568 V572	T494-F570 CarbonylContact C-O 2.88Å; T494-F570 WeakPolarHBondContact CA-O 3.4Å; V495-F570 PolarHBondContact N-O 3.45Å; V495-F570 PolarHBondContact O-N 2.96Å; L497-F570 HydrophobicContact CB-CD2 4.11Å; L497-F570 HydrophobicContact CB-CE2 3.92Å; L497-F570 HydrophobicContact CD1-CD2 3.66Å; L497-F570 HydrophobicContact CD1-CE2 3.32Å; L497-F570 HydrophobicContact CD1-CZ 4.16Å; L497-F570 HydrophobicContact CG-CD2 4.39Å; L497-F570 HydrophobicContact CG-CE2 4.21Å; I539-F570 HydrophobicContact CD1-CD1 4.05Å; I539-F570 HydrophobicContact CD1-CE1 4.26Å; I539-F570 HydrophobicContact CG2-CD1 3.83Å; K541-F570 WeakPolarHBondContact O-CA 3.5Å; I542-F570 HydrophobicContact CD1-CD1 4.29Å; I542-F570 HydrophobicContact CD1-CE1 3.77Å; I542-F570 HydrophobicContact CG1-CD1 3.79Å; I542-F570 HydrophobicContact CG1-CE1 3.76Å; I542-F570 HydrophobicContact CG2-CE1 4.29Å; L559-F570 HydrophobicContact CD1-CZ 4.37Å; I568-F570 HydrophobicContact CB-CD2 4.23Å; I568-F570 HydrophobicContact CB-CE2 3.62Å; I568-F570 HydrophobicContact CB-CZ 4.34Å; I568-F570 HydrophobicContact CD1-CE2 4.14Å; I568-F570 HydrophobicContact CD1-CZ 4.3Å; I568-F570 HydrophobicContact CG1-CE2 4.49Å; I568-F570 HydrophobicContact CG2-CD2 3.86Å; I568-F570 HydrophobicContact CG2-CE1 4.48Å; I568-F570 HydrophobicContact CG2-CE2 3.3Å; I568-F570 HydrophobicContact CG2-CZ 3.67Å; F570-V572 HydrophobicContact CB-CG2 3.94Å
571	T	70.2	Confident	64.5	Low	11 Å²	11	55.9 Å²	55.9	7%	0.067	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	125.7	165.3	-54.3	0	0	0	0	108	L492 V540 K541	L492-T571 HydrophobicContact CD1-CG2 3.63Å; L492-T571 HydrophobicContact CG-CG2 4.28Å; V540-T571 PolarHBondContact N-O 3.25Å; K541-T571 HydrophobicContact CD-CG2 4.29Å; K541-T571 PolarHBondContact N-O 3.42Å; K541-T571 PolarHBondContact O-N 2.85Å
572	V	67.8	Low	64.7	Low	0 Å²	0	56.2 Å²	56.2	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	141.7	-165	-179.7	0	0	0	0	108.8	L492 R493 V495 L533 D537 L538 F570	L492-V572 CarbonylContact C-O 3.59Å; L492-V572 WeakPolarHBondContact CA-O 3.38Å; R493-V572 HydrophobicContact CG-CB 4.22Å; R493-V572 PolarHBondContact N-O 3.21Å; R493-V572 PolarHBondContact O-N 3.25Å; V495-V572 HydrophobicContact CG2-CG2 4.12Å; L533-V572 HydrophobicContact CD2-CG1 4.21Å; L533-V572 HydrophobicContact CD2-CG2 4.1Å; D537-V572 HydrophobicContact CB-CG1 3.44Å; D537-V572 VanDerWaalsContact CB-CG1 3.44Å; D537-V572 VanDerWaalsContact CG-CG1 3.46Å; L538-V572 WeakPolarHBondContact O-CA 3.46Å; F570-V572 HydrophobicContact CB-CG2 3.94Å
573	I	71.4	Confident	64.9	Low	1 Å²	1	54.5 Å²	54.5	1%	0.005	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	127.7	173.4	-168.8	179.3	0	0	0	109.4	M481 F484 C488 L492 L538 V540 V575	M481-I573 HydrophobicContact CE-CD1 3.94Å; F484-I573 HydrophobicContact CD1-CD1 4.48Å; F484-I573 HydrophobicContact CD2-CD1 3.49Å; F484-I573 VanDerWaalsContact CD2-CD1 3.49Å; F484-I573 HydrophobicContact CE2-CD1 3.57Å; F484-I573 HydrophobicContact CE2-CG2 4.15Å; F484-I573 HydrophobicContact CG-CD1 3.99Å; F484-I573 HydrophobicContact CZ-CD1 4.19Å; F484-I573 HydrophobicContact CZ-CG2 4.1Å; C488-I573 HydrophobicContact CB-CD1 4.5Å; C488-I573 WeakPolarHBondContact O-CD1 3.36Å; C488-I573 WeakPolarHBondContact O-CG1 3.42Å; L492-I573 HydrophobicContact CD1-CB 4.12Å; L538-I573 HydrophobicContact CB-CG2 3.94Å; L538-I573 HydrophobicContact CD2-CG2 4.25Å; L538-I573 HydrophobicContact CG-CG2 4.46Å; L538-I573 PolarHBondContact N-O 3.42Å; L538-I573 PolarHBondContact O-N 2.87Å; V540-I573 HydrophobicContact CG2-CB 4.18Å; V540-I573 HydrophobicContact CG2-CG2 3.53Å; I573-V575 HydrophobicContact CG2-CG2 3.9Å; I573-V575 PolarHBondContact O-N 3.09Å
574	H	71.7	Confident	64.9	Low	71 Å²	71	54.7 Å²	54.7	33%	0.329	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.8	115.7	175.3	-175.1	-86.1	0	0	0	109.6	S491 D537	S491-H574 WeakPolarHBondContact OG-CB 3.35Å; D537-H574 IonicContact OD1-CD2 3.61Å; D537-H574 PolarHBondContact OD1-CD2 2.96Å; D537-H574 IonicContact OD1-CG 3.56Å
575	V	65.2	Low	64.8	Low	3 Å²	3	53.4 Å²	53.4	2%	0.018	28%	0.28	C	S	.	.			trans	-105.2	124.5	-171.3	-169.7	0	0	0	0	111.3	F484 G536 L538 I573 C579 L580	F484-V575 HydrophobicContact CD1-CG1 3.98Å; F484-V575 HydrophobicContact CD1-CG2 4.43Å; F484-V575 HydrophobicContact CE1-CB 4.22Å; F484-V575 HydrophobicContact CE1-CG1 3.5Å; F484-V575 VanDerWaalsContact CE1-CG1 3.5Å; F484-V575 HydrophobicContact CE1-CG2 3.59Å; F484-V575 HydrophobicContact CZ-CG2 3.92Å; G536-V575 PolarHBondContact O-N 3.12Å; L538-V575 HydrophobicContact CB-CG2 3.69Å; L538-V575 HydrophobicContact CD2-CG2 4.18Å; I573-V575 HydrophobicContact CG2-CG2 3.9Å; I573-V575 PolarHBondContact O-N 3.09Å; V575-C579 HydrophobicContact CG1-CB 4.05Å; V575-L580 HydrophobicContact CB-CB 4.46Å; V575-L580 HydrophobicContact CG1-CB 3.7Å; V575-L580 HydrophobicContact CG1-CD1 4.28Å; V575-L580 VanDerWaalsContact CG1-N 3.34Å
576	C	70.8	Confident	64.3	Low	46 Å²	46	53.2 Å²	53.2	31%	0.311	28%	0.281	S	S	.	.			trans	-70.5	153.7	171.8	82.2	0	0	0	0	111.3	C488 T578 C579 L580	C488-C576 PolarHBondContact SG-N 2.71Å; C488-C576 VanDerWaalsContact SG-SG 3.64Å; C576-T578 PolarHBondContact O-N 3.38Å; C576-T578 VanDerWaalsContact O-N 3.12Å; C576-C579 PolarHBondContact O-N 3.49Å; C576-C579 VanDerWaalsContact O-N 3.11Å; C576-C579 VanDerWaalsContact SG-SG 3.66Å; C576-L580 WeakPolarHBondContact O-CB 3.39Å; C576-L580 PolarHBondContact O-N 3.35Å
577	S	68.6	Low	63.1	Low	85 Å²	85	51.5 Å²	51.5	59%	0.594	28%	0.277	S	S	*	.	H	α-helix	trans	-56.2	-33.6	-175.8	56.3	0	0	0	0	113.9	K581	S577-K581 WeakPolarHBondContact O-CB 3.3Å; S577-K581 VanDerWaalsContact O-CG 3.32Å; S577-K581 WeakPolarHBondContact O-CG 3.24Å; S577-K581 PolarHBondContact O-N 3.26Å
578	T	70	Confident	61.9	Low	86 Å²	86	52 Å²	52	53%	0.528	28%	0.276	S	S	.	.	H	α-helix	trans	-65.8	-47.6	176.5	-47.5	0	0	0	0	112.2	C576 K581 Q582	C576-T578 PolarHBondContact O-N 3.38Å; C576-T578 VanDerWaalsContact O-N 3.12Å; T578-K581 WeakPolarHBondContact O-CB 3.4Å; T578-K581 PolarHBondContact O-N 3.18Å; T578-Q582 WeakPolarHBondContact O-CG 3.26Å; T578-Q582 PolarHBondContact O-N 3.2Å
579	C	66.7	Low	60.3	Low	3 Å²	3	58.9 Å²	58.9	2%	0.02	31%	0.307	C	S	.	.	H	α-helix	trans	-76.1	-30.3	179.8	-62.5	0	0	0	0	112	H483 F484 C485 V575 C576 K581 Q582 V583	H483-C579 WeakPolarHBondContact O-CB 3.44Å; F484-C579 HydrophobicContact CD1-CB 3.86Å; C485-C579 PolarHBondContact N-SG 3.39Å; V575-C579 HydrophobicContact CG1-CB 4.05Å; C576-C579 PolarHBondContact O-N 3.49Å; C576-C579 VanDerWaalsContact O-N 3.11Å; C576-C579 VanDerWaalsContact SG-SG 3.66Å; C579-K581 VanDerWaalsContact C-N 3.29Å; C579-K581 PolarHBondContact O-N 3.34Å; C579-Q582 PolarHBondContact O-N 2.85Å; C579-Q582 PolarHBondContact SG-OE1 2.87Å; C579-V583 WeakPolarHBondContact O-CB 3.25Å; C579-V583 WeakPolarHBondContact O-CG2 3.2Å; C579-V583 PolarHBondContact O-N 2.79Å
580	L	66.3	Low	58.4	Low	14 Å²	14	60.5 Å²	60.5	7%	0.073	32%	0.318	C	S	.	.	H	α-helix	trans	-63.8	-37.3	170	-166.8	54.1	0	0	0	110.8	V575 C576 N584 D601	V575-L580 HydrophobicContact CB-CB 4.46Å; V575-L580 HydrophobicContact CG1-CB 3.7Å; V575-L580 HydrophobicContact CG1-CD1 4.28Å; V575-L580 VanDerWaalsContact CG1-N 3.34Å; C576-L580 WeakPolarHBondContact O-CB 3.39Å; C576-L580 PolarHBondContact O-N 3.35Å; L580-N584 WeakPolarHBondContact O-CB 3.4Å; L580-N584 PolarHBondContact O-N 3.39Å; L580-N584 VanDerWaalsContact O-N 3.1Å; L580-N584 PolarHBondContact O-ND2 3.27Å; L580-D601 HydrophobicContact CD2-CB 4.4Å; L580-D601 WeakPolarHBondContact CD2-OD1 3.15Å
581	K	64.2	Low	56.5	Low	140 Å²	140	66.9 Å²	66.9	61%	0.609	35%	0.353	S	S	*	.	H	α-helix	trans	-63.6	-48.8	168.1	-76.6	174.6	179.9	-176.2	0	111.5	S577 T578 C579 V583 N584 H585	S577-K581 WeakPolarHBondContact O-CB 3.3Å; S577-K581 VanDerWaalsContact O-CG 3.32Å; S577-K581 WeakPolarHBondContact O-CG 3.24Å; S577-K581 PolarHBondContact O-N 3.26Å; T578-K581 WeakPolarHBondContact O-CB 3.4Å; T578-K581 PolarHBondContact O-N 3.18Å; C579-K581 VanDerWaalsContact C-N 3.29Å; C579-K581 PolarHBondContact O-N 3.34Å; K581-V583 PolarHBondContact O-N 2.63Å; K581-N584 PolarHBondContact O-N 2.77Å; K581-N584 VanDerWaalsContact O-N 3.16Å; K581-H585 WeakPolarHBondContact O-CB 3.38Å; K581-H585 PolarHBondContact O-CD2 2.82Å; K581-H585 VanDerWaalsContact O-CD2 3.27Å; K581-H585 PolarHBondContact O-N 2.89Å
582	Q	62.2	Low	54.5	Low	94 Å²	94	70.9 Å²	70.9	44%	0.439	38%	0.381	S	S	.	.	H	α-helix	trans	-55.6	-48.7	178.2	-73	170.8	-26.2	0	0	112.1	H483 T578 C579 N584 H585 A586	H483-Q582 PolarHBondContact O-OE1 3.26Å; T578-Q582 WeakPolarHBondContact O-CG 3.26Å; T578-Q582 PolarHBondContact O-N 3.2Å; C579-Q582 PolarHBondContact O-N 2.85Å; C579-Q582 PolarHBondContact SG-OE1 2.87Å; Q582-N584 VanDerWaalsContact C-N 3.35Å; Q582-N584 PolarHBondContact O-N 3Å; Q582-H585 PolarHBondContact O-N 3.04Å; Q582-A586 VanDerWaalsContact O-CB 3.25Å; Q582-A586 WeakPolarHBondContact O-CB 3.24Å; Q582-A586 PolarHBondContact O-N 2.89Å
583	V	59.3	Low	52.4	Low	0 Å²	0	79.9 Å²	79.9	0%	0	42%	0.421	C	S	.	.	H	α-helix	trans	-60.7	-39.5	176.8	169.4	0	0	0	0	112.5	H483 F484 C579 K581 Y599	H483-V583 HydrophobicContact CB-CG2 3.58Å; F484-V583 HydrophobicContact CD1-CG2 4.25Å; F484-V583 HydrophobicContact CE1-CG2 3.65Å; F484-V583 HydrophobicContact CZ-CG2 3.98Å; C579-V583 WeakPolarHBondContact O-CB 3.25Å; C579-V583 WeakPolarHBondContact O-CG2 3.2Å; C579-V583 PolarHBondContact O-N 2.79Å; K581-V583 PolarHBondContact O-N 2.63Å; V583-Y599 HydrophobicContact CG1-CD1 3.85Å; V583-Y599 HydrophobicContact CG1-CD2 4.32Å; V583-Y599 HydrophobicContact CG1-CE1 3.25Å; V583-Y599 HydrophobicContact CG1-CE2 3.8Å; V583-Y599 HydrophobicContact CG1-CG 4.36Å; V583-Y599 WeakPolarHBondContact CG1-OH 3.39Å
584	N	54.4	Low	50.3	Low	57 Å²	57	89.5 Å²	89.5	31%	0.305	46%	0.462	S	S	.	.	H	α-helix	trans	-72	-35	174.7	-79.1	-68	0	0	0	113	L580 K581 Q582	L580-N584 WeakPolarHBondContact O-CB 3.4Å; L580-N584 PolarHBondContact O-N 3.39Å; L580-N584 VanDerWaalsContact O-N 3.1Å; L580-N584 PolarHBondContact O-ND2 3.27Å; K581-N584 PolarHBondContact O-N 2.77Å; K581-N584 VanDerWaalsContact O-N 3.16Å; Q582-N584 VanDerWaalsContact C-N 3.35Å; Q582-N584 PolarHBondContact O-N 3Å
585	H	54.3	Low	48.2	Very low	153 Å²	153	91 Å²	91	71%	0.708	48%	0.481	S	S	*	.	H	α-helix	trans	-76.5	-28.8	177.8	-88.2	-86.3	0	0	0	113.1	K581 Q582 N587	K581-H585 WeakPolarHBondContact O-CB 3.38Å; K581-H585 PolarHBondContact O-CD2 2.82Å; K581-H585 VanDerWaalsContact O-CD2 3.27Å; K581-H585 PolarHBondContact O-N 2.89Å; Q582-H585 PolarHBondContact O-N 3.04Å; H585-N587 PolarHBondContact O-N 2.8Å; H585-N587 VanDerWaalsContact O-N 3.07Å
586	A	44.7	Very low	46.4	Very low	39 Å²	39	96.1 Å²	96.1	32%	0.322	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.8	-8.5	-177.3	0	0	0	0	0	114.1	Q582 I588	Q582-A586 VanDerWaalsContact O-CB 3.25Å; Q582-A586 WeakPolarHBondContact O-CB 3.24Å; Q582-A586 PolarHBondContact O-N 2.89Å; A586-I588 HydrophobicContact CB-CG1 4.08Å; A586-I588 PolarHBondContact O-N 2.83Å
587	N	38.1	Very low	44.3	Very low	117 Å²	117	101 Å²	101	63%	0.626	54%	0.535	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.4	57.4	175.1	-90.1	-30.7	0	0	0	112.2	H585 H589	H585-N587 PolarHBondContact O-N 2.8Å; H585-N587 VanDerWaalsContact O-N 3.07Å; N587-H589 PolarHBondContact O-N 3.18Å
588	I	36.6	Very low	42.6	Very low	58 Å²	58	103.1 Å²	103.1	30%	0.297	54%	0.535	S	S	.	.			trans	-70.7	69.9	-178.2	-49	-170.4	0	0	0	110.5	A586 L590	A586-I588 HydrophobicContact CB-CG1 4.08Å; A586-I588 PolarHBondContact O-N 2.83Å; I588-L590 HydrophobicContact CG2-CG 4.48Å; I588-L590 PolarHBondContact O-N 2.88Å
589	H	31.9	Very low	40.6	Very low	152 Å²	152	101.8 Å²	101.8	70%	0.704	52%	0.521	S	S	*	.			trans	-78.2	81.1	178.7	-99.3	-69.4	0	0	0	109.7	N587 N591	N587-H589 PolarHBondContact O-N 3.18Å; H589-N591 PolarHBondContact O-N 3.24Å
590	L	26.4	Very low	38.9	Very low	123 Å²	123	105.4 Å²	105.4	64%	0.644	54%	0.54	S	S	*	.			trans	-70.6	76	165.2	-75.6	172	0	0	0	110.4	V548 I588	V548-L590 HydrophobicContact CG1-CD1 3.9Å; I588-L590 HydrophobicContact CG2-CG 4.48Å; I588-L590 PolarHBondContact O-N 2.88Å
591	N	26.5	Very low	37.4	Very low	151 Å²	151	106.4 Å²	106.4	81%	0.807	55%	0.545	S	S	*	.	S	Bend	trans	69.2	155.4	-179.1	-77.3	-45	0	0	0	117.9	H589	H589-N591 PolarHBondContact O-N 3.24Å
592	S	26.5	Very low	35.8	Very low	96 Å²	96	103.6 Å²	103.6	67%	0.671	54%	0.536	S	S	*	.			trans	-87.5	163.7	-176.3	70.6	0	0	0	0	111.7
593	K	24.9	Very low	34.1	Very low	189 Å²	189	102.8 Å²	102.8	82%	0.822	54%	0.535	S	S	*	.			cis	-140.3	148.1	22	-62.6	177	177.5	-179.2	0	113
594	K	27	Very low	32.8	Very low	202 Å²	202	110.3 Å²	110.3	88%	0.878	57%	0.568	S	S	*	*	S	Bend	trans	73.8	144.4	168.2	-62.4	-172.1	174.2	-173.3	0	118.3
595	S	27.1	Very low	31.3	Very low	102 Å²	102	112.5 Å²	112.5	71%	0.713	58%	0.583	S	S	*	*			trans	57.5	91.3	162.1	54.7	0	0	0	0	120.8
596	T	27.6	Very low	30.1	Very low	111 Å²	111	111.7 Å²	111.7	68%	0.681	59%	0.59	S	S	*	*				57.9	126.7	124.2	56.7	0	0	0	0	122.6
597	N	27.1	Very low	29.3	Very low	149 Å²	149	114.6 Å²	114.6	80%	0.797	61%	0.607	S	S	*	*			trans	70.6	68.4	143.5	-57.8	-18.9	0	0	0	119.1
598	H	33.4	Very low	28.7	Very low	129 Å²	129	115.5 Å²	115.5	60%	0.597	62%	0.617	S	S	*	*			trans	-125.3	60.3	169.8	-72.3	-7.8	0	0	0	114.3
599	Y	28.3	Very low	28.2	Very low	59 Å²	59	118.3 Å²	118.3	23%	0.231	64%	0.64	C	S	.	*			trans	-117.2	135.6	151.5	-85.1	-77.6	0	0	0	109.6	Y480 L538 V583 D601	Y480-Y599 HydrophobicContact CE1-CE1 4.17Å; Y480-Y599 PolarHBondContact OH-OH 3.5Å; L538-Y599 HydrophobicContact CD1-CD1 4.23Å; V583-Y599 HydrophobicContact CG1-CD1 3.85Å; V583-Y599 HydrophobicContact CG1-CD2 4.32Å; V583-Y599 HydrophobicContact CG1-CE1 3.25Å; V583-Y599 HydrophobicContact CG1-CE2 3.8Å; V583-Y599 HydrophobicContact CG1-CG 4.36Å; V583-Y599 WeakPolarHBondContact CG1-OH 3.39Å; Y599-D601 PolarHBondContact O-N 3.12Å
600	L	31.2	Very low	28.2	Very low	79 Å²	79	118 Å²	118	41%	0.414	65%	0.649	S	S	.	*			trans	-84.3	67	178.2	-122.3	166.9	0	0	0	109.9	F555 L602	F555-L600 HydrophobicContact CZ-CD1 4.4Å; L600-L602 HydrophobicContact CD2-CD2 4.25Å; L600-L602 PolarHBondContact O-N 2.77Å; L600-L602 VanDerWaalsContact O-N 3.13Å
601	D	33	Very low	28.3	Very low	35 Å²	35	118.3 Å²	118.3	19%	0.187	66%	0.656	C	S	.	*			trans	-71.1	97.7	174.3	-178.6	-10	0	0	0	109.6	L580 Y599 N603 K604	L580-D601 HydrophobicContact CD2-CB 4.4Å; L580-D601 WeakPolarHBondContact CD2-OD1 3.15Å; Y599-D601 PolarHBondContact O-N 3.12Å; D601-N603 PolarHBondContact O-N 2.88Å; D601-N603 PolarHBondContact OD1-N 3.45Å; D601-K604 VanDerWaalsContact OD2-CD 3.28Å; D601-K604 WeakPolarHBondContact OD2-CD 3.47Å; D601-K604 WeakPolarHBondContact OD2-CE 3.49Å; D601-K604 IonicContact OD2-NZ 3.71Å; D601-K604 PolarHBondContact OD2-NZ 3.08Å
602	L	30.4	Very low	28.6	Very low	80 Å²	80	116.1 Å²	116.1	42%	0.419	65%	0.65	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70	-9.2	-179.8	-73	176	0	0	0	114	D537 L600	D537-L602 WeakPolarHBondContact O-CD1 3.49Å; L600-L602 HydrophobicContact CD2-CD2 4.25Å; L600-L602 PolarHBondContact O-N 2.77Å; L600-L602 VanDerWaalsContact O-N 3.13Å
603	N	28.4	Very low	28.5	Very low	77 Å²	77	117.6 Å²	117.6	41%	0.412	66%	0.655	S	S	.	*	T	Hydrogen-bonded Turn	trans	-107.8	7.3	-165.3	-72.5	-9.5	0	0	0	114.6	P535 G536 D601 T605	P535-N603 PolarHBondContact O-OD1 2.81Å; G536-N603 VanDerWaalsContact CA-ND2 3.32Å; G536-N603 WeakPolarHBondContact CA-ND2 3.48Å; G536-N603 WeakPolarHBondContact CA-OD1 3.5Å; G536-N603 PolarHBondContact N-OD1 3.31Å; G536-N603 VanDerWaalsContact N-OD1 3.08Å; D601-N603 PolarHBondContact O-N 2.88Å; D601-N603 PolarHBondContact OD1-N 3.45Å; N603-T605 PolarHBondContact O-N 3.11Å; N603-T605 VanDerWaalsContact O-N 3.16Å
604	K	30.2	Very low	28.5	Very low	158 Å²	158	116.4 Å²	116.4	69%	0.687	66%	0.656	S	S	*	*			trans	-87.1	78.7	176.4	-81.7	177.8	178.3	136.7	0	113.2	D601	D601-K604 VanDerWaalsContact OD2-CD 3.28Å; D601-K604 WeakPolarHBondContact OD2-CD 3.47Å; D601-K604 WeakPolarHBondContact OD2-CE 3.49Å; D601-K604 IonicContact OD2-NZ 3.71Å; D601-K604 PolarHBondContact OD2-NZ 3.08Å
605	T	24.7	Very low	28.4	Very low	103 Å²	103	118.3 Å²	118.3	63%	0.632	66%	0.657	S	S	*	*			trans	-120.8	85.4	171.8	50.9	0	0	0	0	112.1	N603	N603-T605 PolarHBondContact O-N 3.11Å; N603-T605 VanDerWaalsContact O-N 3.16Å
606	T	27.7	Very low	28.4	Very low	137 Å²	137	121.7 Å²	121.7	84%	0.84	66%	0.662	S	S	*	*			trans	-171.5	148.6	153.9	18.6	0	0	0	0	112.2
607	S	28	Very low	28.4	Very low	99 Å²	99	121 Å²	121	69%	0.692	66%	0.657	S	S	*	*			trans	4.9	145.3	153.2	55.2	0	0	0	0	121.5
608	T	26.7	Very low	28.8	Very low	136 Å²	136	116.8 Å²	116.8	83%	0.834	64%	0.635	S	S	*	*			cis	-163.2	166.9	-9.7	12.3	0	0	0	0	108.1
609	P	26.2	Very low	28.7	Very low	118 Å²	118	117.5 Å²	117.5	77%	0.766	64%	0.636	S	S	*	*			trans	-104.7	157.2	-160.8	38.8	-35.5	0	0	0	117
610	T	30.6	Very low	29	Very low	146 Å²	146	118.5 Å²	118.5	90%	0.896	66%	0.657	S	S	*	*			trans	-141	142.3	148.4	16.3	0	0	0	0	111.3
611	T	29.6	Very low	29.2	Very low	129 Å²	129	120.1 Å²	120.1	79%	0.791	66%	0.662	S	S	*	*			trans	-76	171.8	-166.6	29.4	0	0	0	0	116.1
612	P	31.2	Very low	29.2	Very low	105 Å²	105	122.3 Å²	122.3	68%	0.682	67%	0.672	S	S	*	*			cis	-140.7	-169.2	-19.5	35.6	-14.6	0	0	0	115.7
613	T	25.4	Very low	29.6	Very low	127 Å²	127	122.3 Å²	122.3	78%	0.779	67%	0.672	S	S	*	*			trans	68.3	83.5	156.2	51.6	0	0	0	0	120.2
614	I	24.7	Very low	30.2	Very low	163 Å²	163	121.8 Å²	121.8	84%	0.836	67%	0.674	S	S	*	*	S	Bend		-152	144.2	109	-98	156.1	0	0	0	107.1	E616	I614-E616 PolarHBondContact O-N 2.91Å; I614-E616 VanDerWaalsContact O-N 3.14Å
615	R	26	Very low	30.5	Very low	243 Å²	243	119.2 Å²	119.2	92%	0.917	66%	0.664	S	S	*	*			trans	-56.6	113.9	-160.2	-71.2	179.6	174.6	167.8	-2.5	114.1	T617	R615-T617 PolarHBondContact O-N 2.91Å
616	E	25.9	Very low	31.1	Very low	172 Å²	172	117.4 Å²	117.4	80%	0.804	65%	0.649	S	S	*	*			trans	-81.9	107.2	175.2	-63.4	-172.2	101.1	0	0	111.6	I614	I614-E616 PolarHBondContact O-N 2.91Å; I614-E616 VanDerWaalsContact O-N 3.14Å
617	T	27.2	Very low	31.5	Very low	96 Å²	96	118.1 Å²	118.1	59%	0.589	64%	0.637	S	S	*	*			trans	-129.2	151.6	171.7	54.1	0	0	0	0	113.2	K552 R615 K619	K552-T617 PolarHBondContact NZ-O 3.19Å; R615-T617 PolarHBondContact O-N 2.91Å; T617-K619 PolarHBondContact O-N 2.86Å; T617-K619 VanDerWaalsContact O-N 3.1Å
618	N	37	Very low	32	Very low	62 Å²	62	117 Å²	117	33%	0.332	63%	0.626	S	S	.	*	S	Bend	trans	57.5	1.5	-173.7	-15.2	99.3	0	0	0	119.3	K552 E621 M622	K552-N618 VanDerWaalsContact CE-OD1 3.29Å; K552-N618 WeakPolarHBondContact CE-OD1 3.22Å; K552-N618 PolarHBondContact NZ-OD1 3.34Å; N618-E621 WeakPolarHBondContact CA-OE2 3.27Å; N618-E621 HydrophobicContact CB-CB 4.38Å; N618-E621 WeakPolarHBondContact CB-OE2 3.46Å; N618-E621 VanDerWaalsContact CG-OE2 3.31Å; N618-E621 PolarHBondContact N-OE2 2.8Å; N618-E621 PolarHBondContact ND2-OE2 2.9Å; N618-M622 HydrophobicContact CB-CG 4.39Å; N618-M622 VanDerWaalsContact O-CB 3.27Å; N618-M622 WeakPolarHBondContact O-CB 3.18Å; N618-M622 WeakPolarHBondContact O-CE 3.31Å; N618-M622 VanDerWaalsContact O-CG 3.28Å; N618-M622 WeakPolarHBondContact O-CG 3.36Å; N618-M622 PolarHBondContact O-N 3.42Å
619	K	29.3	Very low	32.4	Very low	143 Å²	143	112.9 Å²	112.9	62%	0.622	60%	0.601	S	S	*	*	H	α-helix	trans	-69.3	-49.5	169.1	-166.1	-178.3	-179.8	-170.9	0	110.5	T617 I623	T617-K619 PolarHBondContact O-N 2.86Å; T617-K619 VanDerWaalsContact O-N 3.1Å; K619-I623 WeakPolarHBondContact O-CG1 3.35Å; K619-I623 PolarHBondContact O-N 3.04Å
620	A	34.6	Very low	32.7	Very low	80 Å²	80	112 Å²	112	66%	0.661	59%	0.589	S	S	*	*	H	α-helix	trans	-64.6	-42.2	170.3	0	0	0	0	0	111.9	I623 S624	A620-I623 PolarHBondContact O-N 2.83Å; A620-S624 VanDerWaalsContact O-CB 3.24Å; A620-S624 WeakPolarHBondContact O-CB 3.36Å; A620-S624 PolarHBondContact O-N 3.12Å
621	E	36.2	Very low	33	Very low	113 Å²	113	110.2 Å²	110.2	53%	0.528	57%	0.574	S	S	.	*	H	α-helix	trans	-71.9	-32.8	-176.9	-50.9	167.7	116.7	0	0	113.5	N618 S624 F625	N618-E621 WeakPolarHBondContact CA-OE2 3.27Å; N618-E621 HydrophobicContact CB-CB 4.38Å; N618-E621 WeakPolarHBondContact CB-OE2 3.46Å; N618-E621 VanDerWaalsContact CG-OE2 3.31Å; N618-E621 PolarHBondContact N-OE2 2.8Å; N618-E621 PolarHBondContact ND2-OE2 2.9Å; E621-S624 PolarHBondContact O-N 2.71Å; E621-F625 WeakPolarHBondContact O-CB 3.46Å; E621-F625 PolarHBondContact O-N 3.17Å
622	M	34.1	Very low	33.1	Very low	81 Å²	81	107 Å²	107	40%	0.399	56%	0.56	S	S	.	*	H	α-helix	trans	-69.9	-38.7	173	-75.5	-173	-61.3	0	0	111.5	N618 S624 L626	N618-M622 HydrophobicContact CB-CG 4.39Å; N618-M622 VanDerWaalsContact O-CB 3.27Å; N618-M622 WeakPolarHBondContact O-CB 3.18Å; N618-M622 WeakPolarHBondContact O-CE 3.31Å; N618-M622 VanDerWaalsContact O-CG 3.28Å; N618-M622 WeakPolarHBondContact O-CG 3.36Å; N618-M622 PolarHBondContact O-N 3.42Å; M622-S624 VanDerWaalsContact C-N 3.35Å; M622-L626 VanDerWaalsContact O-CB 3.3Å; M622-L626 WeakPolarHBondContact O-CB 3.26Å; M622-L626 VanDerWaalsContact O-CG 3.28Å; M622-L626 WeakPolarHBondContact O-CG 3.16Å; M622-L626 PolarHBondContact O-N 3.23Å
623	I	38.1	Very low	33	Very low	81 Å²	81	105.5 Å²	105.5	42%	0.415	55%	0.547	S	S	.	.	H	α-helix	trans	-67.3	-39	174.6	-67.2	172	0	0	0	110.3	K619 A620 R627	K619-I623 WeakPolarHBondContact O-CG1 3.35Å; K619-I623 PolarHBondContact O-N 3.04Å; A620-I623 PolarHBondContact O-N 2.83Å; I623-R627 VanDerWaalsContact O-CB 3.25Å; I623-R627 WeakPolarHBondContact O-CB 3.33Å; I623-R627 WeakPolarHBondContact O-CD 3.47Å; I623-R627 WeakPolarHBondContact O-CG 3.28Å; I623-R627 PolarHBondContact O-N 3.41Å
624	S	40.5	Very low	33	Very low	66 Å²	66	101.3 Å²	101.3	46%	0.462	52%	0.522	S	S	.	.	H	α-helix	trans	-62.7	-55.2	172.4	-172.1	0	0	0	0	110.8	A620 E621 M622 L626 R627 T628	A620-S624 VanDerWaalsContact O-CB 3.24Å; A620-S624 WeakPolarHBondContact O-CB 3.36Å; A620-S624 PolarHBondContact O-N 3.12Å; E621-S624 PolarHBondContact O-N 2.71Å; M622-S624 VanDerWaalsContact C-N 3.35Å; S624-L626 PolarHBondContact O-N 2.99Å; S624-R627 CarbonylContact O-C 3.32Å; S624-R627 WeakPolarHBondContact O-CA 3.23Å; S624-R627 WeakPolarHBondContact O-CB 3.4Å; S624-R627 PolarHBondContact O-N 3.49Å; S624-T628 WeakPolarHBondContact O-CB 3.27Å; S624-T628 PolarHBondContact O-N 2.82Å; S624-T628 PolarHBondContact O-OG1 2.93Å
625	F	37.1	Very low	33.3	Very low	104 Å²	104	102.8 Å²	102.8	46%	0.456	53%	0.525	S	S	.	.	H	α-helix	trans	-57.8	-44.5	-180	-179.3	-99.7	0	0	0	112.5	L563 E621 T628 V629	L563-F625 HydrophobicContact CD1-CE1 4.31Å; L563-F625 HydrophobicContact CD1-CZ 4.16Å; E621-F625 WeakPolarHBondContact O-CB 3.46Å; E621-F625 PolarHBondContact O-N 3.17Å; F625-T628 PolarHBondContact O-N 2.8Å; F625-V629 HydrophobicContact CD1-CG2 4.29Å; F625-V629 HydrophobicContact CD2-CG2 4.3Å; F625-V629 HydrophobicContact CE1-CG2 3.97Å; F625-V629 HydrophobicContact CE2-CG2 3.98Å; F625-V629 HydrophobicContact CG-CG2 4.45Å; F625-V629 HydrophobicContact CZ-CG2 3.81Å; F625-V629 WeakPolarHBondContact O-CB 3.34Å; F625-V629 VanDerWaalsContact O-CG2 3.3Å; F625-V629 WeakPolarHBondContact O-CG2 3.47Å; F625-V629 PolarHBondContact O-N 3.35Å
626	L	36.3	Very low	33.3	Very low	64 Å²	64	94.5 Å²	94.5	34%	0.335	52%	0.516	S	S	.	.	H	α-helix	trans	-66.9	-39.3	175.4	-70.7	169.4	0	0	0	111.7	M622 S624 L630	M622-L626 VanDerWaalsContact O-CB 3.3Å; M622-L626 WeakPolarHBondContact O-CB 3.26Å; M622-L626 VanDerWaalsContact O-CG 3.28Å; M622-L626 WeakPolarHBondContact O-CG 3.16Å; M622-L626 PolarHBondContact O-N 3.23Å; S624-L626 PolarHBondContact O-N 2.99Å; L626-L630 VanDerWaalsContact O-CB 3.25Å; L626-L630 WeakPolarHBondContact O-CB 3.5Å; L626-L630 VanDerWaalsContact O-CG 3.23Å; L626-L630 WeakPolarHBondContact O-CG 3.33Å; L626-L630 PolarHBondContact O-N 3.36Å
627	R	36.3	Very low	33.2	Very low	152 Å²	152	96.7 Å²	96.7	57%	0.574	52%	0.522	S	S	*	.	H	α-helix	trans	-66.2	-34.3	171.8	-75	172.8	176.9	-179	-1.9	112.4	I623 S624 N631	I623-R627 VanDerWaalsContact O-CB 3.25Å; I623-R627 WeakPolarHBondContact O-CB 3.33Å; I623-R627 WeakPolarHBondContact O-CD 3.47Å; I623-R627 WeakPolarHBondContact O-CG 3.28Å; I623-R627 PolarHBondContact O-N 3.41Å; S624-R627 CarbonylContact O-C 3.32Å; S624-R627 WeakPolarHBondContact O-CA 3.23Å; S624-R627 WeakPolarHBondContact O-CB 3.4Å; S624-R627 PolarHBondContact O-N 3.49Å; R627-N631 WeakPolarHBondContact O-CA 3.38Å; R627-N631 WeakPolarHBondContact O-CB 3.33Å; R627-N631 VanDerWaalsContact O-CG 3.28Å; R627-N631 PolarHBondContact O-N 3.36Å; R627-N631 PolarHBondContact O-ND2 3.14Å
628	T	39.9	Very low	33.2	Very low	75 Å²	75	102.2 Å²	102.2	46%	0.46	54%	0.538	S	S	.	.	H	α-helix	trans	-70.9	-50.8	176.8	-58.3	0	0	0	0	110.2	S624 F625 L630 N631 A632	S624-T628 WeakPolarHBondContact O-CB 3.27Å; S624-T628 PolarHBondContact O-N 2.82Å; S624-T628 PolarHBondContact O-OG1 2.93Å; F625-T628 PolarHBondContact O-N 2.8Å; T628-L630 PolarHBondContact O-N 3.12Å; T628-N631 PolarHBondContact O-N 2.79Å; T628-A632 HydrophobicContact CG2-CB 3.76Å; T628-A632 WeakPolarHBondContact O-CA 3.27Å; T628-A632 WeakPolarHBondContact O-CB 3.07Å; T628-A632 PolarHBondContact O-N 2.93Å
629	V	34.7	Very low	32.6	Very low	51 Å²	51	103.8 Å²	103.8	31%	0.309	55%	0.554	S	S	.	*	H	α-helix	trans	-63.3	-27.6	178.9	172.7	0	0	0	0	112.4	F509 F625	F509-V629 HydrophobicContact CE2-CG1 4.11Å; F625-V629 HydrophobicContact CD1-CG2 4.29Å; F625-V629 HydrophobicContact CD2-CG2 4.3Å; F625-V629 HydrophobicContact CE1-CG2 3.97Å; F625-V629 HydrophobicContact CE2-CG2 3.98Å; F625-V629 HydrophobicContact CG-CG2 4.45Å; F625-V629 HydrophobicContact CZ-CG2 3.81Å; F625-V629 WeakPolarHBondContact O-CB 3.34Å; F625-V629 VanDerWaalsContact O-CG2 3.3Å; F625-V629 WeakPolarHBondContact O-CG2 3.47Å; F625-V629 PolarHBondContact O-N 3.35Å
630	L	32.9	Very low	32.4	Very low	99 Å²	99	102.4 Å²	102.4	52%	0.518	56%	0.558	S	S	.	*	H	α-helix	trans	-96.5	-25.3	179.2	-63.1	172.6	0	0	0	115	L626 T628	L626-L630 VanDerWaalsContact O-CB 3.25Å; L626-L630 WeakPolarHBondContact O-CB 3.5Å; L626-L630 VanDerWaalsContact O-CG 3.23Å; L626-L630 WeakPolarHBondContact O-CG 3.33Å; L626-L630 PolarHBondContact O-N 3.36Å; T628-L630 PolarHBondContact O-N 3.12Å
631	N	35.9	Very low	32	Very low	108 Å²	108	105 Å²	105	58%	0.578	56%	0.561	S	S	*	*	H	α-helix	trans	-113.2	-21.3	-177.3	-54.9	-21.1	0	0	0	114.7	R627 T628 N633 C634	R627-N631 WeakPolarHBondContact O-CA 3.38Å; R627-N631 WeakPolarHBondContact O-CB 3.33Å; R627-N631 VanDerWaalsContact O-CG 3.28Å; R627-N631 PolarHBondContact O-N 3.36Å; R627-N631 PolarHBondContact O-ND2 3.14Å; T628-N631 PolarHBondContact O-N 2.79Å; N631-N633 VanDerWaalsContact C-N 3.3Å; N631-N633 PolarHBondContact O-N 3.06Å; N631-C634 PolarHBondContact O-N 2.84Å
632	A	31.8	Very low	31.6	Very low	62 Å²	62	107.1 Å²	107.1	51%	0.512	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.9	-1.2	-165	0	0	0	0	0	116.1	T628	T628-A632 HydrophobicContact CG2-CB 3.76Å; T628-A632 WeakPolarHBondContact O-CA 3.27Å; T628-A632 WeakPolarHBondContact O-CB 3.07Å; T628-A632 PolarHBondContact O-N 2.93Å
633	N	29.3	Very low	31.3	Very low	74 Å²	74	109.6 Å²	109.6	40%	0.396	59%	0.585	S	S	.	*	T	Hydrogen-bonded Turn	trans	-97.2	17.5	168.9	-74.9	-18.8	0	0	0	113	T507 N631	T507-N633 PolarHBondContact O-ND2 2.8Å; N631-N633 VanDerWaalsContact C-N 3.3Å; N631-N633 PolarHBondContact O-N 3.06Å
634	C	25.7	Very low	30.7	Very low	38 Å²	38	111.6 Å²	111.6	26%	0.257	60%	0.596	S	S	.	*	S	Bend	trans	-125.4	41.5	179.1	-85	0	0	0	0	115	V517 N518 N631	V517-C634 WeakPolarHBondContact CG1-SG 3.47Å; N518-C634 PolarHBondContact O-SG 3.19Å; N631-C634 PolarHBondContact O-N 2.84Å
635	H	29.6	Very low	29.9	Very low	194 Å²	194	115.8 Å²	115.8	90%	0.898	61%	0.608	S	S	*	*			trans	-140.1	128.5	151.7	-93.9	-70.5	0	0	0	111.1
636	G	26	Very low	29.3	Very low	70 Å²	70	115.8 Å²	115.8	72%	0.722	62%	0.617	S	S	*	*			trans	-82.7	179.2	-176.3	0	0	0	0	0	113.8	K638	G636-K638 PolarHBondContact O-N 3.21Å; G636-K638 VanDerWaalsContact O-N 3.13Å
637	K	24.2	Very low	28.8	Very low	218 Å²	218	119 Å²	119	95%	0.948	63%	0.634	S	S	*	*			trans	-43.9	115.4	173	-57.8	172.4	-177.7	177	0	111.2
638	K	27.6	Very low	28.3	Very low	211 Å²	211	118.5 Å²	118.5	92%	0.917	64%	0.643	S	S	*	*			trans	-99	122.8	142.6	-83.8	-163.7	172.2	-171.2	0	107.2	G636	G636-K638 PolarHBondContact O-N 3.21Å; G636-K638 VanDerWaalsContact O-N 3.13Å
639	S	25.1	Very low	27.6	Very low	95 Å²	95	122.9 Å²	122.9	66%	0.664	66%	0.656	S	S	*	*			trans	-82	173.2	175.7	57.7	0	0	0	0	111.1
640	T	25.3	Very low	27.3	Very low	114 Å²	114	128.3 Å²	128.3	70%	0.699	68%	0.677	S	S	*	*			trans	67.3	140	148.6	41.5	0	0	0	0	119.2
641	N	26.6	Very low	27.2	Very low	136 Å²	136	129.1 Å²	129.1	73%	0.727	69%	0.691	S	S	*	*			trans	74	105.2	164.9	-56.4	-7.6	0	0	0	114.8
642	H	27.3	Very low	27	Very low	157 Å²	157	128.7 Å²	128.7	73%	0.727	70%	0.697	S	S	*	*				85.7	128	64.8	-95	-78.2	0	0	0	111.7
643	N	26.2	Very low	26.9	Very low	132 Å²	132	130.6 Å²	130.6	71%	0.706	71%	0.707	S	S	*	*			trans	68.5	149.4	155.7	-55.3	2	0	0	0	114.9
644	L	26	Very low	26.7	Very low	124 Å²	124	133.9 Å²	133.9	65%	0.649	72%	0.724	S	S	*	*			cis	-140.1	158	-17.9	-138.6	80.9	0	0	0	105.5
645	Q	24.8	Very low	26.7	Very low	153 Å²	153	137.5 Å²	137.5	72%	0.715	75%	0.745	S	S	*	*				21.6	139.2	103.3	-50.8	178.5	-56.1	0	0	115.7
646	T	24.1	Very low	26.6	Very low	105 Å²	105	132.3 Å²	132.3	64%	0.644	73%	0.73	S	S	*	*			cis	-166.9	-179.2	-4.1	14.7	0	0	0	0	106.9
647	N	24.5	Very low	26.5	Very low	130 Å²	130	136.4 Å²	136.4	70%	0.695	73%	0.731	S	S	*	*			trans	18.1	137.6	137.6	-38.8	-5.5	0	0	0	117.6
648	D	25.9	Very low	26.5	Very low	142 Å²	142	132.8 Å²	132.8	76%	0.759	72%	0.721	S	S	*	*				-170.3	-179.3	53.2	-120	-47.8	0	0	0	113.5
649	K	26.7	Very low	26.4	Very low	167 Å²	167	128.9 Å²	128.9	73%	0.726	71%	0.71	S	S	*	*			trans	97.2	101.3	155.1	-53.7	-152.9	177.8	-178.9	0	121.2
650	H	27.1	Very low	26.5	Very low	165 Å²	165	131.1 Å²	131.1	76%	0.764	72%	0.715	S	S	*	*			trans	79.1	145.8	137	-57.3	-51.5	0	0	0	122
651	S	32.5	Very low	26.6	Very low	116 Å²	116	130.8 Å²	130.8	81%	0.811	71%	0.713	S	S	*	*			trans	44.1	108.3	150.2	55.8	0	0	0	0	118.4
652	S	30.8	Very low	26.7	Very low	100 Å²	100	131.2 Å²	131.2	70%	0.699	72%	0.715	S	S	*	*			cis	-154.2	109.1	1	54	0	0	0	0	107.7
653	S	28.7	Very low	26.9	Very low	102 Å²	102	129.1 Å²	129.1	71%	0.713	71%	0.709	S	S	*	*				63.2	130	92.7	75.7	0	0	0	0	113.9
654	N	26	Very low	27	Very low	143 Å²	143	130.1 Å²	130.1	77%	0.765	71%	0.713	S	S	*	*			cis	-161.6	-175.6	5.3	-135.1	7.7	0	0	0	111.5
655	T	26.1	Very low	27.1	Very low	114 Å²	114	126.6 Å²	126.6	70%	0.699	70%	0.695	S	S	*	*			trans	4.6	147.9	148.6	56.7	0	0	0	0	120
656	S	26.1	Very low	27.2	Very low	84 Å²	84	123.9 Å²	123.9	59%	0.587	68%	0.684	S	S	*	*			cis	-169.5	-173.5	-4.7	49.9	0	0	0	0	108.2
657	E	24.3	Very low	27.5	Very low	156 Å²	156	126 Å²	126	73%	0.729	68%	0.684	S	S	*	*			trans	45.2	110.4	144.7	-74.1	154.1	161.6	0	0	119.8
658	L	24.2	Very low	27.6	Very low	142 Å²	142	125.9 Å²	125.9	74%	0.743	67%	0.673	S	S	*	*				80.5	144.9	83.9	-99.3	162.2	0	0	0	115.1
659	N	25.9	Very low	27.6	Very low	129 Å²	129	125.8 Å²	125.8	69%	0.69	67%	0.666	S	S	*	*			trans	80.4	140	160.6	-62.7	-36.6	0	0	0	120.8
660	N	27.1	Very low	28.1	Very low	143 Å²	143	120.6 Å²	120.6	77%	0.765	65%	0.65	S	S	*	*			trans	80.1	145.3	149.3	-64.8	-17.5	0	0	0	121.6
661	V	28.6	Very low	28.2	Very low	107 Å²	107	118.1 Å²	118.1	65%	0.648	64%	0.638	S	S	*	*			cis	169.4	149.5	-36	136.6	0	0	0	0	107.5
662	N	28.7	Very low	28.1	Very low	145 Å²	145	116.4 Å²	116.4	78%	0.775	63%	0.627	S	S	*	*			trans	66.2	151.1	168.7	-71.5	-25.4	0	0	0	118.2
663	N	30.2	Very low	28	Very low	113 Å²	113	120.8 Å²	120.8	60%	0.604	63%	0.628	S	S	*	*			cis	-140.2	-98	-28.4	-167.6	-38.6	0	0	0	111
664	L	29.2	Very low	28	Very low	152 Å²	152	121.1 Å²	121.1	80%	0.796	62%	0.621	S	S	*	*			cis	-165.1	137.1	-14.5	-159.8	160.6	0	0	0	109.7
665	L	27.1	Very low	28.4	Very low	50 Å²	50	116.4 Å²	116.4	26%	0.262	60%	0.598	S	S	.	*			cis	-163.1	96.7	-33.5	-164.7	46.6	0	0	0	112.2	K261 E263	K261-L665 WeakPolarHBondContact CE-O 3.39Å; K261-L665 PolarHBondContact NZ-O 2.79Å; E263-L665 WeakPolarHBondContact OE2-CD2 3.02Å; E263-L665 VanDerWaalsContact OE2-CG 3.27Å; E263-L665 WeakPolarHBondContact OE2-CG 3.25Å
666	M	27.4	Very low	28.7	Very low	97 Å²	97	115.3 Å²	115.3	48%	0.478	59%	0.591	S	S	.	*			trans	69.7	155.2	162.8	-42.8	-170.6	-148.5	0	0	122.6	S262	S262-M666 VanDerWaalsContact CA-SD 3.59Å
667	K	30	Very low	28.8	Very low	148 Å²	148	114.2 Å²	114.2	64%	0.643	58%	0.577	S	S	*	*			trans	-167.4	145.6	153.8	-115	121.3	176.7	175.1	0	112.5	T260	T260-K667 CarbonylContact O-C 3.54Å; T260-K667 VanDerWaalsContact O-C 3.32Å; T260-K667 WeakPolarHBondContact O-CA 3.4Å
668	R	26.4	Very low	28.9	Very low	128 Å²	128	111.3 Å²	111.3	48%	0.483	57%	0.573	S	S	.	*			trans	-166.3	134.2	178.5	78.7	-51.4	-170.9	-159.7	12.6	118.5	I259 T260 K261 S262	I259-R668 CarbonylContact O-C 3.49Å; I259-R668 VanDerWaalsContact O-CA 3.23Å; I259-R668 WeakPolarHBondContact O-CA 3.22Å; I259-R668 PolarHBondContact O-N 2.91Å; T260-R668 PolarHBondContact O-N 3.02Å; K261-R668 PolarHBondContact O-NH1 3.11Å; S262-R668 VanDerWaalsContact O-CZ 3.27Å; S262-R668 PolarHBondContact O-NH1 2.86Å; S262-R668 PolarHBondContact O-NH2 3.39Å
669	K	27.3	Very low	29.3	Very low	141 Å²	141	112.3 Å²	112.3	61%	0.613	58%	0.577	S	S	*	*			trans	94.2	147.9	132.1	-99	-145.4	169.3	-163.4	0	125.5	I259 E671	I259-K669 PolarHBondContact O-N 2.77Å; K669-E671 IonicContact NZ-OE1 3.82Å; K669-E671 PolarHBondContact NZ-OE1 2.83Å
670	P	36.9	Very low	29.6	Very low	58 Å²	58	112.1 Å²	112.1	38%	0.377	58%	0.581	S	S	.	*			trans	-121.8	-166.1	173.1	46.8	-34.5	0	0	0	114.6	F256	F256-P670 HydrophobicContact CB-CB 4.1Å; F256-P670 HydrophobicContact CB-CG 3.92Å
671	E	29.6	Very low	30.1	Very low	112 Å²	112	111.5 Å²	111.5	52%	0.523	59%	0.585	S	S	.	*			trans	162.5	-178.8	149	-91.5	170.5	-132.8	0	0	114.1	K669	K669-E671 IonicContact NZ-OE1 3.82Å; K669-E671 PolarHBondContact NZ-OE1 2.83Å
672	S	29.9	Very low	30.1	Very low	81 Å²	81	109.9 Å²	109.9	57%	0.566	59%	0.589	S	S	*	*			cis	-168.2	-131.4	-48.9	75	0	0	0	0	115.8
673	W	29.2	Very low	30.2	Very low	191 Å²	191	111.6 Å²	111.6	72%	0.723	60%	0.597	S	S	*	*			trans	101.2	166.6	165	-56.6	82.8	0	0	0	124.2	K251	K251-W673 PolarHBondContact NZ-O 2.71Å
674	L	27	Very low	30.1	Very low	110 Å²	110	109.8 Å²	109.8	58%	0.576	61%	0.605	S	S	*	*				-143.9	0	-125.9	-70	138.1	0	0	0	124	K251	K251-L674 HydrophobicContact CD-CD2 4.4Å
675	P	34.5	Very low	30.1	Very low	44 Å²	44	109.7 Å²	109.7	29%	0.286	60%	0.598	S	S	.	*				0	0	0	44.1	-25.8	0	0	0	123.2	H243 Q244 H247	H243-P675 HydrophobicContact CB-CG 4.46Å; Q244-P675 VanDerWaalsContact CA-O 3.22Å; Q244-P675 WeakPolarHBondContact CA-O 3.25Å; Q244-P675 WeakPolarHBondContact CG-O 3.34Å; Q244-P675 PolarHBondContact N-O 3.34Å; H247-P675 HydrophobicContact CB-CG 4.29Å
676	V	32.9	Very low	30.3	Very low	91 Å²	91	111.5 Å²	111.5	55%	0.552	62%	0.615	S	S	*	*				0	0	0	-175.2	0	0	0	0	120.4	S242 Q244	S242-V676 CarbonylContact C-O 3.46Å; S242-V676 WeakPolarHBondContact CB-O 3.36Å; S242-V676 CarbonylContact O-C 3.53Å; S242-V676 WeakPolarHBondContact O-CA 3.27Å; S242-V676 PolarHBondContact O-N 2.74Å; S242-V676 PolarHBondContact OG-O 2.72Å; Q244-V676 HydrophobicContact CG-CB 3.89Å; Q244-V676 HydrophobicContact CG-CG1 4.04Å; Q244-V676 HydrophobicContact CG-CG2 3.66Å
677	Q	29.3	Very low	30.4	Very low	61 Å²	61	108.6 Å²	108.6	29%	0.285	61%	0.61	S	S	.	*				0	165.3	0	-160.1	-169.6	-46.6	0	0	116.2	K241 H243 Q244	K241-Q677 PolarHBondContact O-N 2.94Å; H243-Q677 WeakPolarHBondContact O-CA 3.3Å; H243-Q677 WeakPolarHBondContact O-CG 3.49Å; Q244-Q677 HydrophobicContact CB-CB 3.88Å; Q244-Q677 HydrophobicContact CB-CG 3.85Å; Q244-Q677 HydrophobicContact CG-CB 4.17Å
678	C	26.1	Very low	30.6	Very low	95 Å²	95	104.8 Å²	104.8	64%	0.642	60%	0.6	S	S	*	*			trans	-149.1	177.4	179.5	-85.9	0	0	0	0	120.3
679	I	31.4	Very low	30.5	Very low	162 Å²	162	101.5 Å²	101.5	83%	0.831	60%	0.596	S	S	*	*			trans	-149.9	158.3	-168.4	-67.8	-175.8	0	0	0	119.7
680	T	33.4	Very low	30.5	Very low	126 Å²	126	102.3 Å²	102.3	77%	0.773	60%	0.602	S	S	*	*			trans	-148	0	172.3	64	0	0	0	0	114
681	P	36.3	Very low	30	Very low	130 Å²	130	104.7 Å²	104.7	84%	0.844	62%	0.616	S	S	*	*				0	-131.6	0	45.9	-19.2	0	0	0	120
682	G	30.1	Very low	30.2	Very low	72 Å²	72	104.8 Å²	104.8	74%	0.742	63%	0.626	S	S	*	*			trans	-164.6	-170.5	-171.5	0	0	0	0	0	123
683	I	29.1	Very low	29.9	Very low	181 Å²	181	107.9 Å²	107.9	93%	0.928	64%	0.636	S	S	*	*			trans	-140.5	177.6	-163.4	-71.2	159.3	0	0	0	113.9
684	G	29.1	Very low	29.6	Very low	75 Å²	75	107.5 Å²	107.5	77%	0.773	64%	0.64	S	S	*	*			cis	-178.9	-162.8	6.7	0	0	0	0	0	110.9
685	K	29.3	Very low	29.5	Very low	150 Å²	150	108.4 Å²	108.4	65%	0.652	65%	0.65	S	S	*	*			cis	-176.3	171.8	-19.9	-155.3	-172.1	174.6	172.6	0	108.3	D47 K48	D47-K685 PolarHBondContact O-NZ 2.85Å; K48-K685 PolarHBondContact O-NZ 3.02Å
686	S	31.3	Very low	28.9	Very low	89 Å²	89	109.9 Å²	109.9	62%	0.622	66%	0.66	S	S	*	*			cis	-163.7	-173.4	-13.5	27.2	0	0	0	0	108.3	D916	S686-D916 WeakPolarHBondContact CA-OD1 3.48Å; S686-D916 VanDerWaalsContact CB-OD1 3.22Å; S686-D916 WeakPolarHBondContact CB-OD1 3.13Å
687	G	28.3	Very low	28.5	Very low	36 Å²	36	112.9 Å²	112.9	37%	0.371	67%	0.671	S	S	.	*			cis	-175.8	-167.9	7.2	0	0	0	0	0	116.5	K915 D916	G687-K915 WeakPolarHBondContact O-CD 3.44Å; G687-D916 WeakPolarHBondContact CA-OD1 3.38Å; G687-D916 WeakPolarHBondContact CA-OD2 3.32Å
688	P	34.7	Very low	28.3	Very low	67 Å²	67	115.1 Å²	115.1	44%	0.435	69%	0.693	S	S	.	*			trans	-70.9	-178.8	-157.2	31.3	-40.5	0	0	0	122.2	K915 D916	P688-K915 VanDerWaalsContact CA-CD 3.48Å; P688-K915 HydrophobicContact CB-CB 4.13Å; P688-K915 HydrophobicContact CB-CG 4.26Å; P688-K915 PolarHBondContact O-NZ 2.85Å; P688-D916 WeakPolarHBondContact CD-OD2 3.45Å
689	C	25.7	Very low	28.3	Very low	60 Å²	60	119.1 Å²	119.1	41%	0.405	70%	0.703	S	S	.	*			cis	-127.9	-157.3	-3.8	-49.6	0	0	0	0	112.5	K915	C689-K915 VanDerWaalsContact N-CE 3.32Å; C689-K915 VanDerWaalsContact N-NZ 3.15Å; C689-K915 WeakPolarHBondContact O-CE 3.27Å; C689-K915 PolarHBondContact O-NZ 2.92Å
690	E	26.7	Very low	27.9	Very low	158 Å²	158	119.4 Å²	119.4	74%	0.738	70%	0.698	S	S	*	*			cis	-169.8	176	-1.6	-131.1	155	-78.6	0	0	113.4
691	T	25.8	Very low	27.5	Very low	107 Å²	107	119.3 Å²	119.3	66%	0.656	69%	0.691	S	S	*	*			trans	-140.7	0	-168.9	53.3	0	0	0	0	123.7
692	P	34.4	Very low	27	Very low	114 Å²	114	121.2 Å²	121.2	74%	0.74	70%	0.695	S	S	*	*				0	-177.6	0	44.4	-20.9	0	0	0	123.2
693	D	23.6	Very low	26.7	Very low	147 Å²	147	123.1 Å²	123.1	79%	0.786	69%	0.692	S	S	*	*			trans	-158	147.9	170.1	-142.7	7.6	0	0	0	121.7
694	F	23.1	Very low	26.5	Very low	182 Å²	182	121.9 Å²	121.9	80%	0.798	69%	0.686	S	S	*	*			trans	48.5	155.1	165.5	-79.8	-66.8	0	0	0	132
695	V	23.8	Very low	26.2	Very low	129 Å²	129	127.6 Å²	127.6	78%	0.782	69%	0.69	S	S	*	*			trans	87.4	128.7	163.5	-164.2	0	0	0	0	121.4
696	P	22.7	Very low	26	Very low	76 Å²	76	126.7 Å²	126.7	49%	0.494	70%	0.697	S	S	.	*			trans	-107.8	159.9	-179.7	40.7	-34.3	0	0	0	117	S698 I815	P696-S698 PolarHBondContact O-N 2.74Å; P696-I815 HydrophobicContact CB-CD1 3.68Å; P696-I815 HydrophobicContact CB-CG1 4.43Å
697	I	23.9	Very low	25.7	Very low	153 Å²	153	130 Å²	130	79%	0.785	71%	0.708	S	S	*	*			trans	-100.8	81.8	-171.9	-48.6	174.7	0	0	0	112.3	F700	I697-F700 HydrophobicContact CG2-CB 4.03Å
698	S	24.9	Very low	25.6	Very low	109 Å²	109	136.5 Å²	136.5	76%	0.762	73%	0.734	S	S	*	*	S	Bend	trans	-115.4	4.3	171.7	56.9	0	0	0	0	114.4	P696	P696-S698 PolarHBondContact O-N 2.74Å
699	Q	26.8	Very low	25.2	Very low	179 Å²	179	141.8 Å²	141.8	84%	0.836	75%	0.753	S	S	*	*	S	Bend	trans	-116.1	6.1	-171.2	-67.3	-174.8	-51.2	0	0	115.2
700	F	22.5	Very low	25.2	Very low	167 Å²	167	146.5 Å²	146.5	73%	0.732	77%	0.769	S	S	*	*	S	Bend	trans	-112.7	0.3	-161.2	-126.9	-87.9	0	0	0	117.8	I697	I697-F700 HydrophobicContact CG2-CB 4.03Å
701	I	24.6	Very low	25.1	Very low	124 Å²	124	145.5 Å²	145.5	64%	0.636	77%	0.767	S	S	*	*	S	Bend	trans	-135.1	70.1	178.6	-46.2	-178.2	0	0	0	111.3
702	N	26.2	Very low	25.1	Very low	170 Å²	170	146.6 Å²	146.6	91%	0.909	77%	0.769	S	S	*	*	S	Bend	trans	-140.2	21.7	161.3	-118.1	-8.2	0	0	0	112.2
703	T	24.5	Very low	24.7	Very low	113 Å²	113	147.4 Å²	147.4	69%	0.693	77%	0.767	S	S	*	*	S	Bend	trans	-139.3	18.6	-159.7	-15.8	0	0	0	0	114.1
704	L	23.9	Very low	24.7	Very low	154 Å²	154	145.8 Å²	145.8	81%	0.806	77%	0.767	S	S	*	*	S	Bend	trans	-137.8	24.8	-177.7	-75	177.4	0	0	0	114.3
705	K	24.5	Very low	24.9	Very low	196 Å²	196	141.1 Å²	141.1	85%	0.852	76%	0.757	S	S	*	*	S	Bend	trans	-123.7	152.3	157.6	-73.2	-172.9	176.4	-178.2	0	107.6
706	T	24.9	Very low	25	Very low	130 Å²	130	142.9 Å²	142.9	80%	0.798	76%	0.757	S	S	*	*	S	Bend	trans	51.7	87.3	-173.1	60.5	0	0	0	0	115.6
707	N	24.6	Very low	25.1	Very low	158 Å²	158	145.3 Å²	145.3	85%	0.845	77%	0.765	S	S	*	*				-179	101.6	112.5	-89.2	-9	0	0	0	111.9
708	N	25.5	Very low	25.1	Very low	173 Å²	173	144 Å²	144	93%	0.925	76%	0.759	S	S	*	*			trans	-153.7	48	154.1	-127.9	-6.3	0	0	0	109.9
709	H	27.9	Very low	25.2	Very low	179 Å²	179	145.2 Å²	145.2	83%	0.829	76%	0.757	S	S	*	*			trans	-106.8	154.9	160.2	-105.8	-72.4	0	0	0	109.4
710	Q	25.4	Very low	25.2	Very low	158 Å²	158	143.8 Å²	143.8	74%	0.738	75%	0.754	S	S	*	*			trans	-65.2	141.6	-167.3	-70.8	156.9	-48.7	0	0	114.3
711	I	24	Very low	25.7	Very low	138 Å²	138	141.3 Å²	141.3	71%	0.708	76%	0.755	S	S	*	*			trans	75.5	129.5	132.3	-67.7	171.6	0	0	0	118.4
712	N	25.5	Very low	25.6	Very low	130 Å²	130	143.5 Å²	143.5	70%	0.695	76%	0.762	S	S	*	*			trans	71.7	108.2	161.7	-66.5	9.6	0	0	0	121
713	D	25.5	Very low	25.5	Very low	130 Å²	130	145.3 Å²	145.3	70%	0.695	76%	0.758	S	S	*	*				62.5	105.9	118	-53.3	-29	0	0	0	121.3
714	S	25	Very low	25.5	Very low	114 Å²	114	146.3 Å²	146.3	80%	0.797	76%	0.759	S	S	*	*				73.7	153.8	129.4	83.5	0	0	0	0	118.1
715	S	25.8	Very low	25.5	Very low	84 Å²	84	148.9 Å²	148.9	59%	0.587	76%	0.759	S	S	*	*			cis	-166.6	161.9	-26	49.7	0	0	0	0	108
716	H	27.4	Very low	25.5	Very low	165 Å²	165	147.2 Å²	147.2	76%	0.764	76%	0.755	S	S	*	*			trans	64.8	156.6	164.6	-62.2	-63.4	0	0	0	118.1
717	L	24.2	Very low	25.5	Very low	128 Å²	128	149.4 Å²	149.4	67%	0.67	75%	0.753	S	S	*	*			cis	-162	139.3	-41.5	-154.6	76.5	0	0	0	109.6
718	N	24.6	Very low	25.5	Very low	124 Å²	124	150.1 Å²	150.1	66%	0.663	75%	0.749	S	S	*	*			trans	61.4	158.7	147	-80	4.8	0	0	0	122.8
719	N	26.9	Very low	25.7	Very low	136 Å²	136	148.8 Å²	148.8	73%	0.727	74%	0.742	S	S	*	*			trans	71.5	147.8	154.9	-62.4	-12.5	0	0	0	118.8
720	I	25.1	Very low	25.6	Very low	148 Å²	148	145.6 Å²	145.6	76%	0.759	74%	0.735	S	S	*	*			cis	-165.2	157.5	-36.3	-121.1	165.5	0	0	0	105.6
721	P	33.3	Very low	25.5	Very low	116 Å²	116	147.4 Å²	147.4	75%	0.753	74%	0.741	S	S	*	*			trans	-100.3	-161.9	-148.2	40.8	-41.1	0	0	0	115.6
722	Q	23.4	Very low	25.6	Very low	170 Å²	170	148.9 Å²	148.9	79%	0.794	74%	0.742	S	S	*	*			trans	105.9	159.7	161.8	-151.5	163.6	11.6	0	0	115.6
723	Y	23.9	Very low	25.7	Very low	207 Å²	207	150.4 Å²	150.4	81%	0.812	75%	0.745	S	S	*	*			trans	73.9	141.3	-171.5	-59.1	-79.3	0	0	0	116.1
724	D	24.3	Very low	25.8	Very low	135 Å²	135	152.3 Å²	152.3	72%	0.722	76%	0.755	S	S	*	*			cis	-156.1	-177.3	-24.7	-149.1	-16.8	0	0	0	111.2
725	Y	23.8	Very low	25.8	Very low	207 Å²	207	154.7 Å²	154.7	81%	0.812	75%	0.754	S	S	*	*			trans	-72.9	171.1	-175.6	-98.9	-99.3	0	0	0	117.1
726	Q	23.9	Very low	25.9	Very low	161 Å²	161	157.3 Å²	157.3	75%	0.752	76%	0.76	S	S	*	*			trans	88.4	145.3	156	-72.6	169.4	46	0	0	120.6
727	K	25.1	Very low	25.8	Very low	176 Å²	176	158.6 Å²	158.6	77%	0.765	76%	0.763	S	S	*	*			trans	100.2	128.4	156.5	-56.2	-150.7	179	176.9	0	117.8
728	F	24.9	Very low	26	Very low	173 Å²	173	161.1 Å²	161.1	76%	0.759	77%	0.771	S	S	*	*			cis	-162.5	162.1	-16.7	-142.2	-118.2	0	0	0	107.6
729	D	30.6	Very low	26.1	Very low	145 Å²	145	163.6 Å²	163.6	78%	0.775	78%	0.779	S	S	*	*			trans	-58.6	160.6	156.5	-75	-78.1	0	0	0	110.5
730	V	24.2	Very low	26.1	Very low	113 Å²	113	165.7 Å²	165.7	69%	0.685	78%	0.784	S	S	*	*			trans	155.2	147	131	158.1	0	0	0	0	114.5
731	F	23.8	Very low	26.1	Very low	196 Å²	196	169.3 Å²	169.3	86%	0.86	79%	0.788	S	S	*	*			trans	82.4	120.6	162.6	-84.3	-52.3	0	0	0	123
732	K	26.6	Very low	25.9	Very low	168 Å²	168	171.4 Å²	171.4	73%	0.73	79%	0.788	S	S	*	*			trans	-58.9	160.8	164.8	-65.5	172	170.4	178	0	114.3
733	Q	26.8	Very low	26.1	Very low	162 Å²	162	172.1 Å²	172.1	76%	0.757	79%	0.792	S	S	*	*			trans	55.6	117.5	140.5	-73.2	171.8	-51.5	0	0	118.6
734	N	27.6	Very low	26.5	Very low	170 Å²	170	167.9 Å²	167.9	91%	0.909	79%	0.792	S	S	*	*				-157.8	174.1	111.7	-105	-34	0	0	0	113.3
735	Q	25.9	Very low	26.7	Very low	165 Å²	165	169 Å²	169	77%	0.771	80%	0.796	S	S	*	*			trans	-98.5	145.9	-168.7	-75.8	-176.9	-18.9	0	0	114.1
736	I	27.2	Very low	27.1	Very low	139 Å²	139	164.5 Å²	164.5	71%	0.713	79%	0.79	S	S	*	*			trans	57	141.5	133.3	-55.8	166.9	0	0	0	118.6
737	K	25.2	Very low	27.4	Very low	192 Å²	192	163.3 Å²	163.3	84%	0.835	79%	0.789	S	S	*	*			trans	79.4	142.6	-170.8	-47.9	179.7	-174.6	179.9	0	111.7
738	E	29.6	Very low	27.8	Very low	180 Å²	180	160 Å²	160	84%	0.841	78%	0.779	S	S	*	*			cis	-124.1	126.4	4.7	-61.9	169.1	139.7	0	0	108.1
739	Q	26	Very low	28.2	Very low	176 Å²	176	158.9 Å²	158.9	82%	0.822	77%	0.774	S	S	*	*				41	108.7	84.1	-76.3	-169	-15.1	0	0	116.4
740	Q	26.2	Very low	28.3	Very low	180 Å²	180	159.9 Å²	159.9	84%	0.841	77%	0.774	S	S	*	*			trans	58.9	90.2	146.8	-59.4	-178.5	-6.2	0	0	119.4
741	R	26.4	Very low	28.7	Very low	224 Å²	224	158.6 Å²	158.6	85%	0.845	77%	0.769	S	S	*	*			trans	-130	105.5	142.3	-83.7	-166.8	137.3	129.1	-4.9	109.5
742	Q	27.9	Very low	29.3	Very low	160 Å²	160	155.3 Å²	155.3	75%	0.748	76%	0.761	S	S	*	*				87.1	89.3	88.8	-80.6	172.5	-19.6	0	0	112.4
743	Q	29	Very low	29.6	Very low	186 Å²	186	153.5 Å²	153.5	87%	0.869	76%	0.759	S	S	*	*			trans	-108.9	142.3	152.5	-84.9	-172.3	-22.2	0	0	109.4
744	S	31	Very low	30	Very low	117 Å²	117	150.8 Å²	150.8	82%	0.818	76%	0.758	S	S	*	*			trans	39.6	98.2	160.9	56.9	0	0	0	0	118.6
745	I	28.4	Very low	30.2	Very low	159 Å²	159	149.8 Å²	149.8	82%	0.815	75%	0.752	S	S	*	*			trans	-78.9	160.4	148.2	-58.9	172.3	0	0	0	108.2
746	V	32.3	Very low	30.4	Very low	113 Å²	113	148.4 Å²	148.4	69%	0.685	75%	0.749	S	S	*	*			trans	116.3	92.9	160.2	-176.5	0	0	0	0	114.9
747	N	31.6	Very low	30.8	Very low	136 Å²	136	146.9 Å²	146.9	73%	0.727	74%	0.742	S	S	*	*			trans	64.9	146	139.2	-55	7	0	0	0	119.6
748	D	33.2	Very low	31.1	Very low	105 Å²	105	144.7 Å²	144.7	56%	0.561	74%	0.735	S	S	*	*			cis	-154.2	142.2	2.2	-132.7	-11.5	0	0	0	113.9
749	K	32.9	Very low	31	Very low	150 Å²	150	142.5 Å²	142.5	65%	0.652	73%	0.727	S	S	*	*			trans	60.4	128.7	143.2	-78.2	161.5	-165.1	130.2	0	125.7
750	H	33	Very low	31.2	Very low	166 Å²	166	139.4 Å²	139.4	77%	0.769	73%	0.726	S	S	*	*			trans	68.7	144.8	141.5	-66.2	-57.1	0	0	0	119.9
751	C	32.4	Very low	31.4	Very low	86 Å²	86	135.8 Å²	135.8	58%	0.581	72%	0.72	S	S	*	*			cis	-155.4	149	-0.8	-123.7	0	0	0	0	112.4
752	D	37	Very low	31.9	Very low	128 Å²	128	130 Å²	130	68%	0.684	71%	0.711	S	S	*	*			trans	60.4	147	136.3	-65.1	13.5	0	0	0	123
753	N	31.6	Very low	32.1	Very low	129 Å²	129	133 Å²	133	69%	0.69	72%	0.717	S	S	*	*			cis	-168.7	164.8	-23.9	-117.7	-34.5	0	0	0	112.1
754	S	35.8	Very low	32.1	Very low	105 Å²	105	131.4 Å²	131.4	73%	0.734	71%	0.714	S	S	*	*			trans	68.3	153.8	156.2	77.2	0	0	0	0	118.8
755	L	32.7	Very low	31.9	Very low	150 Å²	150	130.4 Å²	130.4	79%	0.785	71%	0.707	S	S	*	*			cis	-155.1	165.7	-11.7	-104.1	146.3	0	0	0	105.1
756	L	29.9	Very low	32.2	Very low	136 Å²	136	127.7 Å²	127.7	71%	0.712	70%	0.7	S	S	*	*			cis	175.3	172.6	-43.2	-161.6	68.1	0	0	0	104.9
757	D	34.4	Very low	31.8	Very low	106 Å²	106	129.4 Å²	129.4	57%	0.567	70%	0.704	S	S	*	*			trans	75	141.1	158.6	-57.1	-36.4	0	0	0	120.1
758	Q	31.3	Very low	31.6	Very low	146 Å²	146	129.9 Å²	129.9	68%	0.682	71%	0.705	S	S	*	*			cis	-162.3	149.7	-9.7	-116.3	166.4	43.2	0	0	114.2
759	I	29.2	Very low	31.2	Very low	134 Å²	134	133 Å²	133	69%	0.687	72%	0.716	S	S	*	*			trans	78.8	131.9	139.3	-74.8	163.5	0	0	0	124
760	S	30.1	Very low	30.7	Very low	112 Å²	112	133 Å²	133	78%	0.783	72%	0.72	S	S	*	*			trans	70.4	146.2	154.4	-77.2	0	0	0	0	122.4
761	S	29.8	Very low	30.3	Very low	103 Å²	103	133.1 Å²	133.1	72%	0.72	72%	0.718	S	S	*	*			cis	-166.3	154.3	-20.6	-163.7	0	0	0	0	111.4
762	P	37	Very low	29.9	Very low	103 Å²	103	135.6 Å²	135.6	67%	0.669	73%	0.726	S	S	*	*			trans	-125.3	166.1	-170.5	42.8	-30.7	0	0	0	117.7
763	Y	31	Very low	29.3	Very low	223 Å²	223	133.9 Å²	133.9	88%	0.875	72%	0.724	S	S	*	*			trans	-158.8	162.4	163.5	-77.7	-82	0	0	0	110.5
764	L	30.7	Very low	29	Very low	153 Å²	153	135.7 Å²	135.7	80%	0.801	73%	0.728	S	S	*	*				-157.4	-168.2	-50.1	-143.8	97.1	0	0	0	109.1
765	S	26	Very low	28.5	Very low	95 Å²	95	137.3 Å²	137.3	66%	0.664	73%	0.728	S	S	*	*			trans	-141.5	-163.7	-164.3	66.3	0	0	0	0	112.4
766	P	33.9	Very low	28.1	Very low	103 Å²	103	138.4 Å²	138.4	67%	0.669	73%	0.734	S	S	*	*			cis	-135.7	-155.3	-36.8	29.4	-5.3	0	0	0	113.6
767	I	25.1	Very low	27.8	Very low	149 Å²	149	140.9 Å²	140.9	76%	0.764	74%	0.744	S	S	*	*			trans	106.5	140.6	138.2	-90.3	169	0	0	0	123.1
768	I	27.3	Very low	27.3	Very low	146 Å²	146	143.3 Å²	143.3	75%	0.749	76%	0.756	S	S	*	*			trans	74.2	97.7	164.2	-79.4	158.7	0	0	0	123
769	Q	23.9	Very low	26.9	Very low	171 Å²	171	142.5 Å²	142.5	80%	0.799	76%	0.756	S	S	*	*				42.8	114.2	110.5	-128	177.7	23.7	0	0	122.4
770	M	23.4	Very low	26.7	Very low	148 Å²	148	143.2 Å²	143.2	73%	0.729	76%	0.76	S	S	*	*				161.3	132.6	109.2	-86.7	-172	66.3	0	0	116.7
771	K	23.1	Very low	26.6	Very low	169 Å²	169	142.4 Å²	142.4	74%	0.735	75%	0.753	S	S	*	*			trans	46.4	121	150.1	-67.9	-173.2	178.9	175.7	0	123.8
772	N	24.2	Very low	26.2	Very low	138 Å²	138	145.7 Å²	145.7	74%	0.738	76%	0.756	S	S	*	*			trans	84.8	124.1	131.7	-69	14.2	0	0	0	122.7
773	S	24	Very low	25.5	Very low	92 Å²	92	147.7 Å²	147.7	64%	0.643	76%	0.76	S	S	*	*			trans	50	121.3	140.4	63	0	0	0	0	119.4
774	H	27.3	Very low	25	Very low	167 Å²	167	142 Å²	142	77%	0.773	75%	0.753	S	S	*	*			cis	-156.6	165.8	43	-90.6	-82.4	0	0	0	114.1
775	N	24.2	Very low	24.8	Very low	140 Å²	140	141.1 Å²	141.1	75%	0.749	75%	0.754	S	S	*	*			trans	10.5	115.4	152.3	-57.4	-8.5	0	0	0	119.8
776	L	25.5	Very low	24.7	Very low	172 Å²	172	141.4 Å²	141.4	90%	0.901	76%	0.756	S	S	*	*				-172.6	143.8	109.6	-102.7	146.9	0	0	0	110.3
777	M	22.5	Very low	24.2	Very low	188 Å²	188	144.4 Å²	144.4	93%	0.926	77%	0.766	S	S	*	*			trans	-79.6	131.1	-175.2	-73.8	-172	70.7	0	0	112.6
778	L	23.8	Very low	24.3	Very low	158 Å²	158	142.5 Å²	142.5	83%	0.827	76%	0.762	S	S	*	*			trans	-123.6	112.6	170.2	-84.3	168.9	0	0	0	111.7
779	N	23.7	Very low	24.2	Very low	128 Å²	128	142.1 Å²	142.1	68%	0.684	76%	0.761	S	S	*	*			trans	12.5	127.5	135.9	-73.8	-22.6	0	0	0	120.6
780	I	24.8	Very low	24.3	Very low	149 Å²	149	143 Å²	143	76%	0.764	76%	0.759	S	S	*	*				73.8	150.1	123.8	-62.5	171.9	0	0	0	116.8
781	P	27	Very low	24.7	Very low	96 Å²	96	140.8 Å²	140.8	62%	0.623	75%	0.75	S	S	*	*			cis	-125.7	-177.2	-1.7	31.1	-9.9	0	0	0	116.3
782	E	21.6	Very low	25.4	Very low	171 Å²	171	139.3 Å²	139.3	80%	0.799	75%	0.75	S	S	*	*			trans	89.3	155.5	133	-101.7	161.4	-128.4	0	0	125.1
783	I	23	Very low	26.2	Very low	146 Å²	146	138.6 Å²	138.6	75%	0.749	74%	0.74	S	S	*	*			trans	75.6	91.3	164.2	-60.4	152.7	0	0	0	119.1
784	S	20.9	Very low	27.7	Very low	103 Å²	103	137.7 Å²	137.7	72%	0.72	73%	0.731	S	S	*	*			trans	7.6	128.1	146.5	59.2	0	0	0	0	123.5
785	T	26.2	Very low	29.3	Very low	134 Å²	134	132.7 Å²	132.7	82%	0.822	71%	0.708	S	S	*	*				-163.8	101.8	128.5	22.4	0	0	0	0	108.4
786	S	24.1	Very low	31.1	Very low	102 Å²	102	131 Å²	131	71%	0.713	70%	0.699	S	S	*	*				74.4	109	89.7	70	0	0	0	0	115.6
787	N	23	Very low	33	Very low	166 Å²	166	122.9 Å²	122.9	89%	0.888	66%	0.656	S	S	*	*			trans	-27.5	137.1	173.7	-52.1	-23.1	0	0	0	117.6
788	T	26.5	Very low	34.9	Very low	108 Å²	108	120.8 Å²	120.8	66%	0.663	64%	0.642	S	S	*	*			trans	-123.1	135.3	155	48.7	0	0	0	0	110.4	Y790	T788-Y790 PolarHBondContact O-N 2.71Å
789	N	26.4	Very low	36.9	Very low	138 Å²	138	114.3 Å²	114.3	74%	0.738	61%	0.608	S	S	*	*			trans	-87.2	104.8	-176.2	-100.7	-14.3	0	0	0	110.9	N791	N789-N791 VanDerWaalsContact C-N 3.33Å; N789-N791 PolarHBondContact O-N 3.31Å
790	Y	25.6	Very low	38.7	Very low	190 Å²	190	116.4 Å²	116.4	75%	0.745	61%	0.607	S	S	*	*			trans	-77.2	79.2	172.3	-72.3	-95.9	0	0	0	111.4	T788	T788-Y790 PolarHBondContact O-N 2.71Å
791	N	30.4	Very low	40.6	Very low	101 Å²	101	110.8 Å²	110.8	54%	0.54	58%	0.576	S	S	.	*			trans	-136.4	140.7	170.6	-85	-30.8	0	0	0	110	N789 F793	N789-N791 VanDerWaalsContact C-N 3.33Å; N789-N791 PolarHBondContact O-N 3.31Å; N791-F793 WeakPolarHBondContact O-CD2 3.49Å; N791-F793 PolarHBondContact O-N 3.05Å
792	N	37.8	Very low	42	Very low	138 Å²	138	107.7 Å²	107.7	74%	0.738	56%	0.556	S	S	*	*			trans	-67.9	110.7	-174.7	-60.5	-19.2	0	0	0	111.6	T794	N792-T794 PolarHBondContact O-N 3.3Å
793	F	41.2	Very low	43.5	Very low	124 Å²	124	104.7 Å²	104.7	54%	0.544	55%	0.55	S	S	.	*			trans	-74.6	117.4	173.3	-86.7	-100.5	0	0	0	111.2	N791 E795 R880 R881	N791-F793 WeakPolarHBondContact O-CD2 3.49Å; N791-F793 PolarHBondContact O-N 3.05Å; F793-E795 HydrophobicContact CB-CG 4.49Å; F793-E795 HydrophobicContact CD1-CG 4.2Å; F793-R880 WeakPolarHBondContact O-CA 3.3Å; F793-R881 PolarHBondContact O-N 2.68Å
794	T	55.8	Low	44.7	Very low	73 Å²	73	106.7 Å²	106.7	45%	0.448	55%	0.553	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-105	123.3	154.8	45	0	0	0	0	108.4	N792 V879 R880	N792-T794 PolarHBondContact O-N 3.3Å; T794-V879 CarbonylContact C-O 3.59Å; T794-V879 VanDerWaalsContact CA-O 3.23Å; T794-V879 WeakPolarHBondContact CA-O 3.26Å; T794-R880 HydrophobicContact CG2-CB 4.22Å; T794-R880 VanDerWaalsContact CG2-NH2 3.34Å
795	E	61.2	Low	46	Very low	61 Å²	61	106.6 Å²	106.6	29%	0.285	55%	0.545	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	134.2	-177.5	-63.4	-174.1	146.8	0	0	110	F793 V797 V879 R881	F793-E795 HydrophobicContact CB-CG 4.49Å; F793-E795 HydrophobicContact CD1-CG 4.2Å; E795-V797 HydrophobicContact CB-CG2 4.28Å; E795-V797 PolarHBondContact O-N 3Å; E795-V879 HydrophobicContact CB-CG2 4.33Å; E795-V879 PolarHBondContact N-O 2.77Å; E795-V879 PolarHBondContact O-N 2.82Å; E795-R881 IonicContact OE1-NH1 2.77Å; E795-R881 IonicContact OE2-CZ 2.76Å; E795-R881 VanDerWaalsContact OE2-CZ 3.29Å; E795-R881 IonicContact OE2-NH1 3.84Å; E795-R881 PolarHBondContact OE2-NH1 3.07Å; E795-R881 IonicContact OE2-NH2 3.48Å; E795-R881 PolarHBondContact OE2-NH2 3.04Å
796	D	63	Low	46.9	Very low	104 Å²	104	102.2 Å²	102.2	56%	0.556	53%	0.527	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.8	101.8	172.7	-73.5	-37.2	0	0	0	109.8	T876 L877 T878	D796-T876 HydrophobicContact CB-CG2 4.33Å; D796-L877 CarbonylContact C-O 3.6Å; D796-L877 WeakPolarHBondContact CA-O 3.37Å; D796-T878 VanDerWaalsContact OD1-CB 3.29Å; D796-T878 WeakPolarHBondContact OD1-CB 3.4Å; D796-T878 WeakPolarHBondContact OD1-CG2 3.38Å; D796-T878 PolarHBondContact OD1-OG1 2.82Å
797	V	64.2	Low	48.3	Very low	2 Å²	2	100.4 Å²	100.4	1%	0.012	51%	0.506	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	116.5	-175.4	-176.9	0	0	0	0	110.2	E795 I799 N837 L838 L877 V879	E795-V797 HydrophobicContact CB-CG2 4.28Å; E795-V797 PolarHBondContact O-N 3Å; V797-I799 HydrophobicContact CG1-CG2 4.22Å; V797-N837 HydrophobicContact CB-CB 4.39Å; V797-N837 HydrophobicContact CG1-CB 3.54Å; V797-N837 HydrophobicContact CG2-CB 3.95Å; V797-L838 HydrophobicContact CB-CD2 4.13Å; V797-L838 HydrophobicContact CG1-CD2 3.9Å; V797-L838 HydrophobicContact CG1-CG 3.97Å; V797-L838 HydrophobicContact CG2-CD2 4.19Å; V797-L877 PolarHBondContact N-O 2.7Å; V797-L877 PolarHBondContact O-N 3.26Å; V797-V879 HydrophobicContact CG2-CG2 3.79Å
798	K	63.8	Low	49.7	Very low	145 Å²	145	93.5 Å²	93.5	63%	0.63	47%	0.469	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.9	121.5	174.4	-67.7	-171.9	177.6	-170.8	0	110.8	V875 T876	K798-V875 WeakPolarHBondContact CA-O 3.47Å; K798-T876 WeakPolarHBondContact CE-OG1 3.29Å; K798-T876 HydrophobicContact CG-CG2 3.94Å
799	I	65.9	Low	50.8	Low	22 Å²	22	92.8 Å²	92.8	11%	0.113	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	167.6	175.6	60.7	158.9	0	0	0	110.9	V797 L808 L838 Y874 V875 L877	V797-I799 HydrophobicContact CG1-CG2 4.22Å; I799-L808 HydrophobicContact CD1-CD1 3.66Å; I799-L808 HydrophobicContact CD1-CD2 4.15Å; I799-L808 HydrophobicContact CD1-CG 4.04Å; I799-L838 HydrophobicContact CG2-CD1 3.91Å; I799-Y874 CarbonylContact O-C 3.59Å; I799-Y874 WeakPolarHBondContact O-CA 3.26Å; I799-V875 HydrophobicContact CG1-CB 4.15Å; I799-V875 WeakPolarHBondContact CG1-O 3.19Å; I799-V875 PolarHBondContact N-O 3.23Å; I799-V875 PolarHBondContact O-N 2.96Å; I799-L877 HydrophobicContact CD1-CD1 3.79Å; I799-L877 HydrophobicContact CD1-CG 4.23Å; I799-L877 HydrophobicContact CG1-CD1 4.14Å; I799-L877 HydrophobicContact CG1-CG 4.21Å; I799-L877 HydrophobicContact CG2-CD1 4.43Å
800	R	61.5	Low	51.9	Low	172 Å²	172	89 Å²	89	65%	0.649	43%	0.434	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-105.5	115.1	164.7	-168.7	-172.9	-76.6	167.7	-6.7	109.2	G873 Y874	R800-G873 CarbonylContact C-O 3.1Å; R800-G873 VanDerWaalsContact CA-O 3.31Å; R800-G873 WeakPolarHBondContact CA-O 3.1Å; R800-G873 VanDerWaalsContact CG-O 3.28Å; R800-G873 WeakPolarHBondContact CG-O 3.37Å; R800-Y874 HydrophobicContact CB-CD1 4.36Å; R800-Y874 HydrophobicContact CB-CE1 4.39Å; R800-Y874 PolarHBondContact NH2-OH 2.65Å
801	Y	62.8	Low	52.6	Low	31 Å²	31	82.5 Å²	82.5	12%	0.122	41%	0.414	C	S	.	.			trans	-92.1	119.2	-179.3	178.9	-92	0	0	0	110.5	T803 L864 A868 G873 V875	Y801-T803 HydrophobicContact CD1-CG2 4.37Å; Y801-T803 HydrophobicContact CE1-CG2 3.97Å; Y801-L864 HydrophobicContact CD2-CB 4.15Å; Y801-L864 HydrophobicContact CD2-CD1 4.48Å; Y801-L864 HydrophobicContact CD2-CD2 4.47Å; Y801-L864 HydrophobicContact CE1-CB 4.4Å; Y801-L864 HydrophobicContact CE2-CB 3.77Å; Y801-L864 HydrophobicContact CE2-CD1 3.89Å; Y801-L864 HydrophobicContact CE2-CG 4.3Å; Y801-A868 HydrophobicContact CD1-CB 3.55Å; Y801-A868 HydrophobicContact CE1-CB 4.41Å; Y801-A868 HydrophobicContact CG-CB 4.18Å; Y801-G873 PolarHBondContact N-O 3.24Å; Y801-V875 HydrophobicContact CG-CG2 4.41Å
802	S	57	Low	53	Low	30 Å²	30	82.3 Å²	82.3	21%	0.21	41%	0.408	C	S	.	.			trans	-97.2	121.9	174.8	178.7	0	0	0	0	111.3	K804 D805 G806	S802-K804 PolarHBondContact O-N 2.91Å; S802-K804 PolarHBondContact OG-N 3.23Å; S802-D805 WeakPolarHBondContact CB-OD2 3.44Å; S802-D805 PolarHBondContact OG-N 3.17Å; S802-D805 PolarHBondContact OG-OD2 3.04Å; S802-G806 PolarHBondContact O-N 3.02Å
803	T	53.1	Low	52.8	Low	109 Å²	109	80.2 Å²	80.2	67%	0.669	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.1	-7	171.9	51.9	0	0	0	0	113.8	Y801	Y801-T803 HydrophobicContact CD1-CG2 4.37Å; Y801-T803 HydrophobicContact CE1-CG2 3.97Å
804	K	48.3	Very low	52.3	Low	188 Å²	188	78.7 Å²	78.7	82%	0.817	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	-28.4	177.1	-69.6	-176.6	174	-177.8	0	113.6	S802	S802-K804 PolarHBondContact O-N 2.91Å; S802-K804 PolarHBondContact OG-N 3.23Å
805	D	48.8	Very low	51.3	Low	100 Å²	100	81 Å²	81	54%	0.535	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.9	-4.8	-164	-39.3	-57.7	0	0	0	114.1	S802 K807	S802-D805 WeakPolarHBondContact CB-OD2 3.44Å; S802-D805 PolarHBondContact OG-N 3.17Å; S802-D805 PolarHBondContact OG-OD2 3.04Å; D805-K807 HydrophobicContact CB-CD 4.3Å; D805-K807 HydrophobicContact CB-CG 3.79Å; D805-K807 PolarHBondContact O-N 2.68Å; D805-K807 WeakPolarHBondContact OD2-CE 3.28Å
806	G	44.3	Very low	49.8	Very low	43 Å²	43	83.8 Å²	83.8	44%	0.443	41%	0.413	S	S	.	.			trans	59.3	38.7	171.8	0	0	0	0	0	114.9	S802 L808	S802-G806 PolarHBondContact O-N 3.02Å; G806-L808 PolarHBondContact O-N 3.28Å
807	K	53.7	Low	48.8	Very low	63 Å²	63	81.6 Å²	81.6	27%	0.274	40%	0.399	S	S	.	.			trans	-68.2	12.2	-163.8	-54.2	-150.2	180	-155.9	0	117.4	D805 D827	D805-K807 HydrophobicContact CB-CD 4.3Å; D805-K807 HydrophobicContact CB-CG 3.79Å; D805-K807 PolarHBondContact O-N 2.68Å; D805-K807 WeakPolarHBondContact OD2-CE 3.28Å; K807-D827 IonicContact NZ-OD1 2.77Å; K807-D827 PolarHBondContact NZ-OD1 3.14Å; K807-D827 IonicContact NZ-OD2 3.11Å; K807-D827 PolarHBondContact NZ-OD2 2.91Å
808	L	52.3	Low	47.7	Very low	22 Å²	22	86.2 Å²	86.2	12%	0.115	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	114.6	167.9	-70.4	179	0	0	0	109.1	I799 G806 F810 I822 L838 L864 L877	I799-L808 HydrophobicContact CD1-CD1 3.66Å; I799-L808 HydrophobicContact CD1-CD2 4.15Å; I799-L808 HydrophobicContact CD1-CG 4.04Å; G806-L808 PolarHBondContact O-N 3.28Å; L808-F810 HydrophobicContact CB-CE1 4.3Å; L808-F810 HydrophobicContact CB-CE2 4.15Å; L808-F810 HydrophobicContact CB-CZ 3.84Å; L808-F810 HydrophobicContact CD1-CE1 4.23Å; L808-F810 HydrophobicContact CD1-CZ 3.68Å; L808-F810 HydrophobicContact CG-CZ 4.4Å; L808-I822 HydrophobicContact CD2-CG2 3.96Å; L808-L838 HydrophobicContact CD2-CD1 4.48Å; L808-L864 HydrophobicContact CD1-CD1 4.24Å; L808-L864 HydrophobicContact CD1-CD2 4.05Å; L808-L877 HydrophobicContact CD1-CD1 4.17Å
809	K	49.9	Very low	46.7	Very low	93 Å²	93	80.9 Å²	80.9	40%	0.404	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	115.8	165.1	-87.5	175.7	-179.4	-179	0	108.8	I823 I825	K809-I823 HydrophobicContact CB-CB 4.48Å; K809-I823 PolarHBondContact O-N 3.3Å; K809-I825 HydrophobicContact CB-CD1 4.31Å; K809-I825 HydrophobicContact CB-CG1 4.45Å; K809-I825 HydrophobicContact CD-CD1 4.07Å; K809-I825 HydrophobicContact CG-CD1 3.88Å; K809-I825 HydrophobicContact CG-CG1 4.47Å
810	F	48.7	Very low	46.1	Very low	59 Å²	59	80.9 Å²	80.9	26%	0.259	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.5	129.4	170.2	-59.5	-62.1	0	0	0	109.7	L808 L820 I822 L844 I860 L864	L808-F810 HydrophobicContact CB-CE1 4.3Å; L808-F810 HydrophobicContact CB-CE2 4.15Å; L808-F810 HydrophobicContact CB-CZ 3.84Å; L808-F810 HydrophobicContact CD1-CE1 4.23Å; L808-F810 HydrophobicContact CD1-CZ 3.68Å; L808-F810 HydrophobicContact CG-CZ 4.4Å; F810-L820 HydrophobicContact CB-CD1 3.91Å; F810-L820 HydrophobicContact CB-CD2 4.11Å; F810-L820 HydrophobicContact CB-CG 3.96Å; F810-L820 HydrophobicContact CD1-CD2 3.32Å; F810-L820 HydrophobicContact CD1-CG 3.88Å; F810-L820 HydrophobicContact CD2-CD2 4.36Å; F810-L820 HydrophobicContact CE1-CD2 3.78Å; F810-L820 HydrophobicContact CG-CD1 4.33Å; F810-L820 HydrophobicContact CG-CD2 3.66Å; F810-L820 HydrophobicContact CG-CG 4.06Å; F810-L820 HydrophobicContact CZ-CD2 4.46Å; F810-I822 HydrophobicContact CE1-CG1 4.31Å; F810-L844 HydrophobicContact CE1-CD2 3.9Å; F810-L844 HydrophobicContact CZ-CD2 4.33Å; F810-I860 HydrophobicContact CE2-CG2 4.37Å; F810-I860 HydrophobicContact CZ-CG2 4.37Å; F810-L864 HydrophobicContact CE2-CD1 3.57Å; F810-L864 HydrophobicContact CZ-CD1 3.61Å
811	V	40.2	Very low	45.4	Very low	53 Å²	53	73 Å²	73	32%	0.321	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108	128.9	169.4	173.3	0	0	0	0	108.7	E813 C821 I823	V811-E813 VanDerWaalsContact C-N 3.3Å; V811-E813 HydrophobicContact CG1-CG 3.95Å; V811-E813 PolarHBondContact O-N 3.07Å; V811-E813 VanDerWaalsContact O-N 3.1Å; V811-C821 PolarHBondContact N-O 3.18Å; V811-C821 VanDerWaalsContact N-O 3.1Å; V811-C821 PolarHBondContact O-N 2.89Å; V811-I823 HydrophobicContact CB-CD1 4.27Å; V811-I823 HydrophobicContact CB-CG1 4.48Å; V811-I823 HydrophobicContact CG2-CD1 3.42Å; V811-I823 VanDerWaalsContact CG2-CD1 3.42Å; V811-I823 HydrophobicContact CG2-CG1 3.92Å
812	K	39.4	Very low	45.1	Very low	96 Å²	96	71.5 Å²	71.5	42%	0.417	37%	0.367	S	S	.	.			trans	-81	81.3	171.6	-171.7	-176.6	179.4	179.8	0	108.6	N814 I815 N818	K812-N814 PolarHBondContact O-N 3.09Å; K812-I815 WeakPolarHBondContact CE-O 3.23Å; K812-I815 PolarHBondContact NZ-O 2.94Å; K812-I815 VanDerWaalsContact NZ-O 3.08Å; K812-N818 VanDerWaalsContact CE-OD1 3.22Å; K812-N818 WeakPolarHBondContact CE-OD1 3.43Å; K812-N818 PolarHBondContact NZ-OD1 2.8Å
813	E	34.6	Very low	44.7	Very low	95 Å²	95	73.1 Å²	73.1	44%	0.444	37%	0.373	S	S	.	.			trans	-65.3	130.5	168.4	-65	-168.9	137.8	0	0	109.1	V811 C821	V811-E813 VanDerWaalsContact C-N 3.3Å; V811-E813 HydrophobicContact CG1-CG 3.95Å; V811-E813 PolarHBondContact O-N 3.07Å; V811-E813 VanDerWaalsContact O-N 3.1Å; E813-C821 HydrophobicContact CG-CB 4.25Å; E813-C821 PolarHBondContact OE2-SG 2.83Å
814	N	30.2	Very low	44.2	Very low	92 Å²	92	70 Å²	70	49%	0.492	36%	0.355	S	S	.	.			trans	52.3	108.2	-167.5	-75.6	-43.2	0	0	0	116.1	K812 E816 Q817 N818	K812-N814 PolarHBondContact O-N 3.09Å; N814-E816 PolarHBondContact O-N 3.01Å; N814-E816 VanDerWaalsContact O-N 3.07Å; N814-Q817 HydrophobicContact CB-CB 3.7Å; N814-Q817 HydrophobicContact CB-CG 3.59Å; N814-Q817 VanDerWaalsContact ND2-CD 3.31Å; N814-Q817 PolarHBondContact ND2-OE1 3.44Å; N814-Q817 PolarHBondContact O-N 3.06Å; N814-N818 PolarHBondContact O-N 3.14Å
815	I	33.5	Very low	44.2	Very low	120 Å²	120	64.4 Å²	64.4	62%	0.615	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	-33.4	171	-64.6	163.1	0	0	0	111.6	P696 K812	P696-I815 HydrophobicContact CB-CD1 3.68Å; P696-I815 HydrophobicContact CB-CG1 4.43Å; K812-I815 WeakPolarHBondContact CE-O 3.23Å; K812-I815 PolarHBondContact NZ-O 2.94Å; K812-I815 VanDerWaalsContact NZ-O 3.08Å
816	E	31.1	Very low	43.9	Very low	121 Å²	121	68.1 Å²	68.1	57%	0.565	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-21.8	179.4	-56	-162.7	161.8	0	0	115.5	N814 N908 I984	N814-E816 PolarHBondContact O-N 3.01Å; N814-E816 VanDerWaalsContact O-N 3.07Å; E816-N908 PolarHBondContact OE2-ND2 3.2Å; E816-I984 WeakPolarHBondContact O-CD1 3.31Å
817	Q	40.6	Very low	43.5	Very low	58 Å²	58	70.3 Å²	70.3	27%	0.271	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.2	-22	-167.9	-63.4	-174.8	-23.8	0	0	113.8	N814 L819 N960 G961	N814-Q817 HydrophobicContact CB-CB 3.7Å; N814-Q817 HydrophobicContact CB-CG 3.59Å; N814-Q817 VanDerWaalsContact ND2-CD 3.31Å; N814-Q817 PolarHBondContact ND2-OE1 3.44Å; N814-Q817 PolarHBondContact O-N 3.06Å; Q817-L819 HydrophobicContact CB-CD1 4.36Å; Q817-L819 HydrophobicContact CB-CG 4.35Å; Q817-L819 PolarHBondContact O-N 3.39Å; Q817-L819 VanDerWaalsContact O-N 3.11Å; Q817-N960 VanDerWaalsContact O-O 3.07Å; Q817-G961 VanDerWaalsContact CG-CA 3.5Å
818	N	41.6	Very low	42.6	Very low	99 Å²	99	75.6 Å²	75.6	53%	0.529	38%	0.38	S	S	.	.			trans	63	16	173.9	-129.9	51.4	0	0	0	115	K812 N814	K812-N818 VanDerWaalsContact CE-OD1 3.22Å; K812-N818 WeakPolarHBondContact CE-OD1 3.43Å; K812-N818 PolarHBondContact NZ-OD1 2.8Å; N814-N818 PolarHBondContact O-N 3.14Å
819	L	43.7	Very low	41.7	Very low	33 Å²	33	76.6 Å²	76.6	17%	0.173	40%	0.396	C	S	.	.			trans	-72.7	152.4	172.1	-64.2	171.3	0	0	0	110.1	Q817 L843	Q817-L819 HydrophobicContact CB-CD1 4.36Å; Q817-L819 HydrophobicContact CB-CG 4.35Å; Q817-L819 PolarHBondContact O-N 3.39Å; Q817-L819 VanDerWaalsContact O-N 3.11Å; L819-L843 HydrophobicContact CB-CD1 4.11Å; L819-L843 HydrophobicContact CD2-CD1 4Å; L819-L843 HydrophobicContact CD2-CD2 4.36Å
820	L	53.6	Low	40.7	Very low	21 Å²	21	80.8 Å²	80.8	11%	0.11	42%	0.422	C	S	.	.			trans	-123.2	100.5	-175.3	-158.7	93.4	0	0	0	110.3	F810 L844 I860	F810-L820 HydrophobicContact CB-CD1 3.91Å; F810-L820 HydrophobicContact CB-CD2 4.11Å; F810-L820 HydrophobicContact CB-CG 3.96Å; F810-L820 HydrophobicContact CD1-CD2 3.32Å; F810-L820 HydrophobicContact CD1-CG 3.88Å; F810-L820 HydrophobicContact CD2-CD2 4.36Å; F810-L820 HydrophobicContact CE1-CD2 3.78Å; F810-L820 HydrophobicContact CG-CD1 4.33Å; F810-L820 HydrophobicContact CG-CD2 3.66Å; F810-L820 HydrophobicContact CG-CG 4.06Å; F810-L820 HydrophobicContact CZ-CD2 4.46Å; L820-L844 HydrophobicContact CD2-CB 4.42Å; L820-L844 HydrophobicContact CD2-CD2 3.89Å; L820-L844 PolarHBondContact O-N 3.16Å; L820-I860 HydrophobicContact CD1-CD1 4.43Å; L820-I860 HydrophobicContact CD2-CD1 3.67Å; L820-I860 HydrophobicContact CD2-CG2 4.19Å
821	C	47	Very low	40	Very low	6 Å²	6	81.6 Å²	81.6	4%	0.041	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	140.5	179.8	-62.3	0	0	0	0	110.1	V811 E813	V811-C821 PolarHBondContact N-O 3.18Å; V811-C821 VanDerWaalsContact N-O 3.1Å; V811-C821 PolarHBondContact O-N 2.89Å; E813-C821 HydrophobicContact CG-CB 4.25Å; E813-C821 PolarHBondContact OE2-SG 2.83Å
822	I	56	Low	39.6	Very low	0 Å²	0	84.5 Å²	84.5	0%	0	46%	0.458	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	128.4	-179.1	-55.9	169.7	0	0	0	109	L808 F810 L838 D842 L844 L877 V879	L808-I822 HydrophobicContact CD2-CG2 3.96Å; F810-I822 HydrophobicContact CE1-CG1 4.31Å; I822-L838 HydrophobicContact CD1-CD2 4.02Å; I822-L838 HydrophobicContact CG2-CD1 4.29Å; I822-D842 PolarHBondContact N-O 3.2Å; I822-L844 HydrophobicContact CD1-CB 4.09Å; I822-L844 HydrophobicContact CD1-CD1 4.12Å; I822-L844 HydrophobicContact CG1-CB 4.11Å; I822-L877 HydrophobicContact CD1-CD1 4.21Å; I822-V879 HydrophobicContact CD1-CG1 3.6Å
823	I	47.6	Very low	39.4	Very low	64 Å²	64	89.1 Å²	89.1	33%	0.328	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	111.6	159.9	-62.4	-167.4	0	0	0	108.2	K809 V811 I825	K809-I823 HydrophobicContact CB-CB 4.48Å; K809-I823 PolarHBondContact O-N 3.3Å; V811-I823 HydrophobicContact CB-CD1 4.27Å; V811-I823 HydrophobicContact CB-CG1 4.48Å; V811-I823 HydrophobicContact CG2-CD1 3.42Å; V811-I823 VanDerWaalsContact CG2-CD1 3.42Å; V811-I823 HydrophobicContact CG2-CG1 3.92Å; I823-I825 PolarHBondContact O-N 2.94Å
824	P	42.7	Very low	39.7	Very low	45 Å²	45	88.1 Å²	88.1	29%	0.292	48%	0.484	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-62.6	131	169.1	27.5	-33.7	0	0	0	109.2	L838 V840	P824-L838 HydrophobicContact CB-CB 4.39Å; P824-V840 HydrophobicContact CG-CG2 4.37Å
825	I	48.6	Very low	40.1	Very low	70 Å²	70	88 Å²	88	36%	0.359	49%	0.491	S	S	.	.			trans	-90	116.8	173.6	-50.6	-175.1	0	0	0	107.4	K809 I823 D827	K809-I825 HydrophobicContact CB-CD1 4.31Å; K809-I825 HydrophobicContact CB-CG1 4.45Å; K809-I825 HydrophobicContact CD-CD1 4.07Å; K809-I825 HydrophobicContact CG-CD1 3.88Å; K809-I825 HydrophobicContact CG-CG1 4.47Å; I823-I825 PolarHBondContact O-N 2.94Å; I825-D827 PolarHBondContact O-N 2.79Å; I825-D827 VanDerWaalsContact O-N 3.09Å
826	E	41.7	Very low	40.8	Very low	177 Å²	177	90.8 Å²	90.8	83%	0.827	50%	0.501	S	S	*	.			trans	-65.6	107.6	175.4	-65.4	-177.2	146.8	0	0	110.5	N828	E826-N828 PolarHBondContact O-N 3.47Å
827	D	37.4	Very low	42	Very low	90 Å²	90	88.8 Å²	88.8	48%	0.481	50%	0.495	S	S	.	.			trans	-71.5	115.9	166.1	-94.2	-34.4	0	0	0	109.2	K807 I825 G829	K807-D827 IonicContact NZ-OD1 2.77Å; K807-D827 PolarHBondContact NZ-OD1 3.14Å; K807-D827 IonicContact NZ-OD2 3.11Å; K807-D827 PolarHBondContact NZ-OD2 2.91Å; I825-D827 PolarHBondContact O-N 2.79Å; I825-D827 VanDerWaalsContact O-N 3.09Å; D827-G829 PolarHBondContact O-N 3.44Å
828	N	34.3	Very low	42.8	Very low	173 Å²	173	87.1 Å²	87.1	93%	0.925	49%	0.488	S	S	*	.	S	Bend	trans	-71.5	63.7	165.7	-75.1	-32.7	0	0	0	110.3	E826	E826-N828 PolarHBondContact O-N 3.47Å
829	G	34	Very low	43.7	Very low	44 Å²	44	85.8 Å²	85.8	45%	0.454	48%	0.483	S	S	.	.	S	Bend	trans	-163.4	121.4	-174.1	0	0	0	0	0	114.1	D827 S831	D827-G829 PolarHBondContact O-N 3.44Å; G829-S831 PolarHBondContact O-N 2.95Å; G829-S831 PolarHBondContact O-OG 2.82Å
830	N	28.6	Very low	44.1	Very low	181 Å²	181	88.6 Å²	88.6	97%	0.968	50%	0.501	S	S	*	.			trans	-47.6	95.6	-176	-65.4	-18.8	0	0	0	114.3
831	S	33.7	Very low	44.2	Very low	75 Å²	75	88.4 Å²	88.4	52%	0.524	50%	0.504	S	S	.	.			trans	-151.8	98.2	169.5	49.9	0	0	0	0	110.2	G829 E833	G829-S831 PolarHBondContact O-N 2.95Å; G829-S831 PolarHBondContact O-OG 2.82Å; S831-E833 PolarHBondContact O-N 2.74Å
832	S	30.7	Very low	45	Very low	115 Å²	115	88.1 Å²	88.1	80%	0.804	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.8	18.1	-156	54.7	0	0	0	0	116.4
833	E	35.9	Very low	45.7	Very low	192 Å²	192	88.3 Å²	88.3	90%	0.897	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-132.4	3.6	-166.8	-65.5	-167.7	136.7	0	0	116.4	S831	S831-E833 PolarHBondContact O-N 2.74Å
834	S	40.7	Very low	47.1	Very low	74 Å²	74	85.3 Å²	85.3	52%	0.517	49%	0.488	S	S	.	.	S	Bend	trans	-136.1	-2.3	-177.3	62.9	0	0	0	0	116.9
835	S	38.9	Very low	48.7	Very low	91 Å²	91	84.2 Å²	84.2	64%	0.636	48%	0.48	S	S	*	.	S	Bend	trans	-91.1	-9.8	-174.1	44.5	0	0	0	0	115.2	N837	S835-N837 PolarHBondContact O-N 3.2Å
836	Q	48.5	Very low	50.2	Low	177 Å²	177	81.1 Å²	81.1	83%	0.827	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.1	-7.2	-174.8	-68.8	-172.6	-19.7	0	0	115.2
837	N	55.6	Low	52.2	Low	80 Å²	80	72.8 Å²	72.8	43%	0.428	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101	-7.4	-167	-67.8	8.4	0	0	0	115	V797 S835 R881	V797-N837 HydrophobicContact CB-CB 4.39Å; V797-N837 HydrophobicContact CG1-CB 3.54Å; V797-N837 HydrophobicContact CG2-CB 3.95Å; S835-N837 PolarHBondContact O-N 3.2Å; N837-R881 PolarHBondContact O-NH2 3.39Å
838	L	58.1	Low	54.3	Low	23 Å²	23	70.6 Å²	70.6	12%	0.12	41%	0.413	C	S	.	.			trans	-119.4	119.6	177.6	-64.9	176.7	0	0	0	109.5	V797 I799 L808 I822 P824 V879	V797-L838 HydrophobicContact CB-CD2 4.13Å; V797-L838 HydrophobicContact CG1-CD2 3.9Å; V797-L838 HydrophobicContact CG1-CG 3.97Å; V797-L838 HydrophobicContact CG2-CD2 4.19Å; I799-L838 HydrophobicContact CG2-CD1 3.91Å; L808-L838 HydrophobicContact CD2-CD1 4.48Å; I822-L838 HydrophobicContact CD1-CD2 4.02Å; I822-L838 HydrophobicContact CG2-CD1 4.29Å; P824-L838 HydrophobicContact CB-CB 4.39Å; L838-V879 HydrophobicContact CD2-CG1 3.84Å; L838-V879 HydrophobicContact CD2-CG2 4.41Å
839	V	59.7	Low	56.2	Low	70 Å²	70	68.9 Å²	68.9	42%	0.424	40%	0.404	S	S	.	.			trans	-107	147.8	176.6	-170.8	0	0	0	0	108.9	G841 D842	V839-G841 PolarHBondContact O-N 3.18Å; V839-D842 PolarHBondContact N-OD2 3.41Å; V839-D842 VanDerWaalsContact O-CB 3.28Å; V839-D842 WeakPolarHBondContact O-CB 3.44Å; V839-D842 PolarHBondContact O-N 3.15Å
840	V	53.8	Low	58.3	Low	93 Å²	93	72.6 Å²	72.6	56%	0.564	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.5	127.5	170.1	178.3	0	0	0	0	108.5	P824	P824-V840 HydrophobicContact CG-CG2 4.37Å
841	G	54.1	Low	60.7	Low	16 Å²	16	66.7 Å²	66.7	17%	0.165	38%	0.382	C	S	.	.	T	Hydrogen-bonded Turn	trans	94.4	-3.2	-171.9	0	0	0	0	0	114.8	V839 L843	V839-G841 PolarHBondContact O-N 3.18Å; G841-L843 PolarHBondContact O-N 3.23Å
842	D	64.1	Low	62.8	Low	1 Å²	1	63.3 Å²	63.3	1%	0.005	36%	0.359	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	116.9	165.9	-76.1	-15.5	0	0	0	109.5	I822 V839 V879 R881	I822-D842 PolarHBondContact N-O 3.2Å; V839-D842 PolarHBondContact N-OD2 3.41Å; V839-D842 VanDerWaalsContact O-CB 3.28Å; V839-D842 WeakPolarHBondContact O-CB 3.44Å; V839-D842 PolarHBondContact O-N 3.15Å; D842-V879 HydrophobicContact CB-CB 4.29Å; D842-V879 HydrophobicContact CB-CG2 4.42Å; D842-R881 VanDerWaalsContact OD1-CA 3.25Å; D842-R881 WeakPolarHBondContact OD1-CA 3.3Å; D842-R881 WeakPolarHBondContact OD1-CB 3.36Å; D842-R881 VanDerWaalsContact OD1-CG 3.26Å; D842-R881 WeakPolarHBondContact OD1-CG 3.4Å; D842-R881 IonicContact OD1-CZ 2.65Å; D842-R881 IonicContact OD1-NE 3.46Å; D842-R881 PolarHBondContact OD1-NE 2.87Å; D842-R881 IonicContact OD1-NH2 3.6Å; D842-R881 IonicContact OD2-CZ 2.79Å; D842-R881 IonicContact OD2-NE 3.7Å; D842-R881 PolarHBondContact OD2-NE 2.94Å; D842-R881 IonicContact OD2-NH2 2.66Å; D842-R881 PolarHBondContact OD2-NH2 3.06Å
843	L	70.9	Confident	64.7	Low	4 Å²	4	60.5 Å²	60.5	2%	0.021	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.5	125.5	179.5	172.1	64.8	0	0	0	110.1	L819 G841 V845 L853 V879 R880 I882	L819-L843 HydrophobicContact CB-CD1 4.11Å; L819-L843 HydrophobicContact CD2-CD1 4Å; L819-L843 HydrophobicContact CD2-CD2 4.36Å; G841-L843 PolarHBondContact O-N 3.23Å; L843-V845 PolarHBondContact O-N 2.98Å; L843-L853 HydrophobicContact CD1-CD2 4.31Å; L843-L853 HydrophobicContact CD2-CD2 4.18Å; L843-L853 HydrophobicContact CG-CD2 4.28Å; L843-V879 CarbonylContact O-C 3.59Å; L843-V879 VanDerWaalsContact O-CA 3.28Å; L843-V879 WeakPolarHBondContact O-CA 3.37Å; L843-R880 HydrophobicContact CB-CB 4.48Å; L843-R880 PolarHBondContact N-O 2.95Å; L843-R880 PolarHBondContact O-N 3.47Å; L843-I882 HydrophobicContact CB-CD1 4.09Å; L843-I882 HydrophobicContact CB-CG1 4.4Å
844	L	77.9	Confident	65.9	Low	1 Å²	1	55 Å²	55	1%	0.005	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.9	115.4	174.2	-175.7	63.9	0	0	0	110.7	F810 L820 I822 I847 V852 I860 L877 V879	F810-L844 HydrophobicContact CE1-CD2 3.9Å; F810-L844 HydrophobicContact CZ-CD2 4.33Å; L820-L844 HydrophobicContact CD2-CB 4.42Å; L820-L844 HydrophobicContact CD2-CD2 3.89Å; L820-L844 PolarHBondContact O-N 3.16Å; I822-L844 HydrophobicContact CD1-CB 4.09Å; I822-L844 HydrophobicContact CD1-CD1 4.12Å; I822-L844 HydrophobicContact CG1-CB 4.11Å; L844-I847 HydrophobicContact CD2-CD1 4.36Å; L844-I847 HydrophobicContact CD2-CG1 4.33Å; L844-V852 HydrophobicContact CB-CG2 4.44Å; L844-V852 HydrophobicContact CD2-CG2 3.73Å; L844-V852 HydrophobicContact CG-CG2 3.61Å; L844-I860 HydrophobicContact CD2-CG2 4.22Å; L844-L877 HydrophobicContact CD1-CB 3.82Å; L844-L877 HydrophobicContact CD1-CD1 4.29Å; L844-L877 HydrophobicContact CD1-CD2 3.93Å; L844-L877 HydrophobicContact CD1-CG 4.23Å; L844-V879 HydrophobicContact CD1-CG1 4.34Å
845	V	76.3	Confident	67.2	Low	21 Å²	21	52.8 Å²	52.8	13%	0.127	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	-45.2	-179.1	-180	0	0	0	0	111.4	L843 S851 V852 L853 T878 R880	L843-V845 PolarHBondContact O-N 2.98Å; V845-S851 WeakPolarHBondContact O-CA 3.47Å; V845-S851 PolarHBondContact O-OG 3.1Å; V845-V852 PolarHBondContact O-N 2.85Å; V845-L853 HydrophobicContact CG1-CD1 4.26Å; V845-T878 WeakPolarHBondContact CA-O 3.39Å; V845-T878 HydrophobicContact CB-CG2 4.27Å; V845-T878 WeakPolarHBondContact CB-O 3.4Å; V845-T878 PolarHBondContact N-O 2.87Å; V845-R880 HydrophobicContact CG2-CB 3.78Å
846	A	78.4	Confident	68.8	Low	6 Å²	6	54.4 Å²	54.4	5%	0.05	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.6	162.1	-177.3	0	0	0	0	0	113.8	H850 L877 T878	A846-H850 CarbonylContact C-O 3.55Å; A846-H850 WeakPolarHBondContact CA-O 3.44Å; A846-H850 VanDerWaalsContact CB-O 3.31Å; A846-H850 WeakPolarHBondContact CB-O 3.35Å; A846-L877 CarbonylContact O-C 3.55Å; A846-L877 WeakPolarHBondContact O-CA 3.41Å; A846-T878 PolarHBondContact N-O 2.78Å; A846-T878 VanDerWaalsContact N-O 3.1Å; A846-T878 PolarHBondContact O-N 3.25Å
847	I	84.7	Confident	69.7	Low	2 Å²	2	50.2 Å²	50.2	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125	120.6	171.4	-62.5	175.6	0	0	0	107.7	L844 N849 H850 V852 I860 L863 L864 A867 V875 L877	L844-I847 HydrophobicContact CD2-CD1 4.36Å; L844-I847 HydrophobicContact CD2-CG1 4.33Å; I847-N849 PolarHBondContact O-N 2.75Å; I847-N849 VanDerWaalsContact O-N 3.14Å; I847-H850 PolarHBondContact N-O 3.01Å; I847-H850 WeakPolarHBondContact O-CA 3.35Å; I847-H850 WeakPolarHBondContact O-CB 3.46Å; I847-H850 PolarHBondContact O-N 3.23Å; I847-V852 HydrophobicContact CB-CG1 4.4Å; I847-V852 HydrophobicContact CD1-CG1 3.93Å; I847-V852 HydrophobicContact CG1-CG1 3.96Å; I847-I860 HydrophobicContact CD1-CG2 3.79Å; I847-L863 HydrophobicContact CD1-CB 4.08Å; I847-L864 HydrophobicContact CD1-CD2 3.6Å; I847-L864 HydrophobicContact CD1-CG 3.71Å; I847-L864 HydrophobicContact CG1-CD2 4.27Å; I847-A867 HydrophobicContact CG2-CB 3.97Å; I847-V875 HydrophobicContact CG2-CG1 3.69Å; I847-L877 HydrophobicContact CG1-CD2 3.92Å
848	E	81.9	Confident	70.4	Confident	44 Å²	44	50 Å²	50	21%	0.206	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	48.4	41.3	-178.5	-60.8	-63.1	165.9	0	0	113.3	H850 A867 N871 V875 T876	E848-H850 VanDerWaalsContact C-N 3.25Å; E848-H850 PolarHBondContact O-N 3.2Å; E848-A867 HydrophobicContact CG-CB 3.65Å; E848-N871 PolarHBondContact OE1-ND2 3.37Å; E848-N871 PolarHBondContact OE2-ND2 3.16Å; E848-V875 WeakPolarHBondContact OE1-CA 3.32Å; E848-T876 PolarHBondContact N-O 2.84Å; E848-T876 PolarHBondContact OE1-N 2.8Å; E848-T876 PolarHBondContact OE1-OG1 3.27Å; E848-T876 VanDerWaalsContact OE1-OG1 3.14Å; E848-T876 PolarHBondContact OE2-OG1 3.4Å
849	N	73.4	Confident	71.2	Confident	137 Å²	137	52.4 Å²	52.4	73%	0.733	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	70.2	-1.6	-173	-46.6	-84.2	0	0	0	116.6	I847 S851	I847-N849 PolarHBondContact O-N 2.75Å; I847-N849 VanDerWaalsContact O-N 3.14Å; N849-S851 PolarHBondContact O-N 3.42Å
850	H	77.7	Confident	71.9	Confident	121 Å²	121	49.2 Å²	49.2	56%	0.56	28%	0.281	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	111.7	168.1	-68.8	-95.7	0	0	0	110.1	A846 I847 E848 V852	A846-H850 CarbonylContact C-O 3.55Å; A846-H850 WeakPolarHBondContact CA-O 3.44Å; A846-H850 VanDerWaalsContact CB-O 3.31Å; A846-H850 WeakPolarHBondContact CB-O 3.35Å; I847-H850 PolarHBondContact N-O 3.01Å; I847-H850 WeakPolarHBondContact O-CA 3.35Å; I847-H850 WeakPolarHBondContact O-CB 3.46Å; I847-H850 PolarHBondContact O-N 3.23Å; E848-H850 VanDerWaalsContact C-N 3.25Å; E848-H850 PolarHBondContact O-N 3.2Å; H850-V852 PolarHBondContact O-N 3.46Å
851	S	80.1	Confident	73	Confident	58 Å²	58	50.5 Å²	50.5	41%	0.406	28%	0.281	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.7	134.2	175.6	-178.9	0	0	0	0	111.4	V845 N849	V845-S851 WeakPolarHBondContact O-CA 3.47Å; V845-S851 PolarHBondContact O-OG 3.1Å; N849-S851 PolarHBondContact O-N 3.42Å
852	V	78	Confident	74.3	Confident	4 Å²	4	53.1 Å²	53.1	2%	0.024	29%	0.289	C	S	.	.			trans	-115	1.7	-178.3	-63.1	0	0	0	0	114.4	L844 V845 I847 H850 S854 C855 I860 L863	L844-V852 HydrophobicContact CB-CG2 4.44Å; L844-V852 HydrophobicContact CD2-CG2 3.73Å; L844-V852 HydrophobicContact CG-CG2 3.61Å; V845-V852 PolarHBondContact O-N 2.85Å; I847-V852 HydrophobicContact CB-CG1 4.4Å; I847-V852 HydrophobicContact CD1-CG1 3.93Å; I847-V852 HydrophobicContact CG1-CG1 3.96Å; H850-V852 PolarHBondContact O-N 3.46Å; V852-S854 PolarHBondContact O-N 3.46Å; V852-C855 HydrophobicContact CB-CB 4.25Å; V852-C855 PolarHBondContact O-N 3.19Å; V852-I860 HydrophobicContact CB-CD1 3.9Å; V852-I860 HydrophobicContact CB-CG1 4Å; V852-I860 HydrophobicContact CG1-CG1 4.21Å; V852-I860 HydrophobicContact CG2-CD1 4.34Å; V852-L863 HydrophobicContact CG1-CD1 3.84Å
853	L	68.8	Low	75.2	Confident	55 Å²	55	55.2 Å²	55.2	29%	0.288	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-14.6	178.7	-64.3	175.5	0	0	0	114.7	L843 V845	L843-L853 HydrophobicContact CD1-CD2 4.31Å; L843-L853 HydrophobicContact CD2-CD2 4.18Å; L843-L853 HydrophobicContact CG-CD2 4.28Å; V845-L853 HydrophobicContact CG1-CD1 4.26Å
854	S	61.9	Low	75.7	Confident	76 Å²	76	55.1 Å²	55.1	53%	0.531	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.6	6.8	176.9	63.1	0	0	0	0	114.1	V852	V852-S854 PolarHBondContact O-N 3.46Å
855	C	68.6	Low	75.9	Confident	29 Å²	29	61.4 Å²	61.4	20%	0.196	32%	0.323	C	S	.	.			trans	-88.4	147.7	-176.3	-70.9	0	0	0	0	111.7	V852 E859 I860	V852-C855 HydrophobicContact CB-CB 4.25Å; V852-C855 PolarHBondContact O-N 3.19Å; C855-E859 WeakPolarHBondContact CA-OE2 3.4Å; C855-E859 HydrophobicContact CB-CB 4.14Å; C855-I860 HydrophobicContact CB-CD1 3.92Å; C855-I860 HydrophobicContact CB-CG1 3.47Å; C855-I860 VanDerWaalsContact CB-CG1 3.47Å
856	K	72.6	Confident	76.3	Confident	125 Å²	125	64 Å²	64	54%	0.543	34%	0.336	S	S	.	.			trans	-72.5	152.9	169	-55.9	-171.5	-162.2	89.2	0	110.2	S858 E859 I860	K856-S858 PolarHBondContact O-N 2.92Å; K856-S858 VanDerWaalsContact O-N 3.09Å; K856-E859 HydrophobicContact CB-CG 4.15Å; K856-E859 WeakPolarHBondContact CG-OE1 3.35Å; K856-E859 PolarHBondContact N-OE2 3.01Å; K856-E859 IonicContact NZ-OE1 2.78Å; K856-E859 PolarHBondContact NZ-OE1 3.04Å; K856-E859 WeakPolarHBondContact O-CA 3.41Å; K856-E859 WeakPolarHBondContact O-CB 3.31Å; K856-E859 PolarHBondContact O-N 3.29Å; K856-I860 WeakPolarHBondContact O-CG1 3.2Å; K856-I860 PolarHBondContact O-N 3.44Å
857	P	66.2	Low	76.5	Confident	89 Å²	89	64.2 Å²	64.2	58%	0.578	34%	0.337	S	S	*	.	H	α-helix	trans	-50.6	-38.1	177.5	-30.1	36.6	0	0	0	114.5	I860 E861	P857-I860 PolarHBondContact O-N 2.9Å; P857-E861 WeakPolarHBondContact O-CB 3.43Å; P857-E861 PolarHBondContact O-N 3.2Å
858	S	70.7	Confident	76.4	Confident	75 Å²	75	64.4 Å²	64.4	52%	0.524	34%	0.339	S	S	.	.	H	α-helix	trans	-68.6	-31.2	175.6	51.9	0	0	0	0	114.5	K856 E862	K856-S858 PolarHBondContact O-N 2.92Å; K856-S858 VanDerWaalsContact O-N 3.09Å; S858-E862 PolarHBondContact O-N 3.43Å; S858-E862 VanDerWaalsContact O-N 3.15Å
859	E	74.8	Confident	76.3	Confident	74 Å²	74	70.3 Å²	70.3	35%	0.346	36%	0.364	S	S	.	.	H	α-helix	trans	-73.3	-35.5	174.4	-64.3	159.6	-170.5	0	0	110.1	C855 K856 L863	C855-E859 WeakPolarHBondContact CA-OE2 3.4Å; C855-E859 HydrophobicContact CB-CB 4.14Å; K856-E859 HydrophobicContact CB-CG 4.15Å; K856-E859 WeakPolarHBondContact CG-OE1 3.35Å; K856-E859 PolarHBondContact N-OE2 3.01Å; K856-E859 IonicContact NZ-OE1 2.78Å; K856-E859 PolarHBondContact NZ-OE1 3.04Å; K856-E859 WeakPolarHBondContact O-CA 3.41Å; K856-E859 WeakPolarHBondContact O-CB 3.31Å; K856-E859 PolarHBondContact O-N 3.29Å; E859-L863 WeakPolarHBondContact O-CB 3.13Å; E859-L863 VanDerWaalsContact O-CG 3.23Å; E859-L863 WeakPolarHBondContact O-CG 3.35Å; E859-L863 PolarHBondContact O-N 3.26Å
860	I	75.7	Confident	76.5	Confident	2 Å²	2	69.4 Å²	69.4	1%	0.01	36%	0.359	C	S	.	.	H	α-helix	trans	-70	-42.3	175.3	-59.3	-178.1	0	0	0	110.7	F810 L820 L844 I847 V852 C855 K856 P857 L863 L864	F810-I860 HydrophobicContact CE2-CG2 4.37Å; F810-I860 HydrophobicContact CZ-CG2 4.37Å; L820-I860 HydrophobicContact CD1-CD1 4.43Å; L820-I860 HydrophobicContact CD2-CD1 3.67Å; L820-I860 HydrophobicContact CD2-CG2 4.19Å; L844-I860 HydrophobicContact CD2-CG2 4.22Å; I847-I860 HydrophobicContact CD1-CG2 3.79Å; V852-I860 HydrophobicContact CB-CD1 3.9Å; V852-I860 HydrophobicContact CB-CG1 4Å; V852-I860 HydrophobicContact CG1-CG1 4.21Å; V852-I860 HydrophobicContact CG2-CD1 4.34Å; C855-I860 HydrophobicContact CB-CD1 3.92Å; C855-I860 HydrophobicContact CB-CG1 3.47Å; C855-I860 VanDerWaalsContact CB-CG1 3.47Å; K856-I860 WeakPolarHBondContact O-CG1 3.2Å; K856-I860 PolarHBondContact O-N 3.44Å; P857-I860 PolarHBondContact O-N 2.9Å; I860-L863 PolarHBondContact O-N 2.64Å; I860-L864 HydrophobicContact CG2-CD1 4.42Å; I860-L864 VanDerWaalsContact O-CG 3.3Å; I860-L864 WeakPolarHBondContact O-CG 3.48Å; I860-L864 PolarHBondContact O-N 2.93Å
861	E	76.1	Confident	76.2	Confident	121 Å²	121	67 Å²	67	57%	0.565	35%	0.35	S	S	*	.	H	α-helix	trans	-60.4	-45.8	175	-172.5	176.1	-175.6	0	0	112.1	P857 L864 R865	P857-E861 WeakPolarHBondContact O-CB 3.43Å; P857-E861 PolarHBondContact O-N 3.2Å; E861-L864 PolarHBondContact O-N 2.97Å; E861-R865 WeakPolarHBondContact O-CB 3.48Å; E861-R865 PolarHBondContact O-N 3.45Å
862	E	81.2	Confident	76.1	Confident	71 Å²	71	71.3 Å²	71.3	33%	0.332	37%	0.369	S	S	.	.	H	α-helix	trans	-68	-35.7	175.6	-172.7	61.4	-167.1	0	0	112.1	S858 R865 L866	S858-E862 PolarHBondContact O-N 3.43Å; S858-E862 VanDerWaalsContact O-N 3.15Å; E862-R865 PolarHBondContact O-N 3.41Å; E862-R865 IonicContact OE1-CZ 2.68Å; E862-R865 IonicContact OE1-NE 2.7Å; E862-R865 IonicContact OE1-NH2 2.64Å; E862-R865 PolarHBondContact OE1-NH2 3.15Å; E862-R865 IonicContact OE2-CZ 3.54Å; E862-R865 IonicContact OE2-NE 3.59Å; E862-R865 PolarHBondContact OE2-NE 3.1Å; E862-R865 IonicContact OE2-NH2 2.71Å; E862-R865 PolarHBondContact OE2-NH2 2.88Å; E862-L866 HydrophobicContact CG-CD1 3.91Å; E862-L866 HydrophobicContact CG-CG 4.22Å; E862-L866 WeakPolarHBondContact O-CB 3.47Å; E862-L866 VanDerWaalsContact O-CG 3.23Å; E862-L866 WeakPolarHBondContact O-CG 3.25Å; E862-L866 PolarHBondContact O-N 3.24Å
863	L	83	Confident	75.8	Confident	44 Å²	44	72 Å²	72	23%	0.23	38%	0.377	C	S	.	.	H	α-helix	trans	-61.7	-43.3	172.4	-79.6	169	0	0	0	112.2	I847 V852 E859 I860 A867	I847-L863 HydrophobicContact CD1-CB 4.08Å; V852-L863 HydrophobicContact CG1-CD1 3.84Å; E859-L863 WeakPolarHBondContact O-CB 3.13Å; E859-L863 VanDerWaalsContact O-CG 3.23Å; E859-L863 WeakPolarHBondContact O-CG 3.35Å; E859-L863 PolarHBondContact O-N 3.26Å; I860-L863 PolarHBondContact O-N 2.64Å; L863-A867 WeakPolarHBondContact O-CB 3.4Å; L863-A867 PolarHBondContact O-N 2.77Å
864	L	81.9	Confident	75.8	Confident	3 Å²	3	74.6 Å²	74.6	2%	0.016	38%	0.384	C	S	.	.	H	α-helix	trans	-61.3	-45.4	173.3	-67.3	164.6	0	0	0	111.1	Y801 L808 F810 I847 I860 E861 L866 A867 A868 V875 L877	Y801-L864 HydrophobicContact CD2-CB 4.15Å; Y801-L864 HydrophobicContact CD2-CD1 4.48Å; Y801-L864 HydrophobicContact CD2-CD2 4.47Å; Y801-L864 HydrophobicContact CE1-CB 4.4Å; Y801-L864 HydrophobicContact CE2-CB 3.77Å; Y801-L864 HydrophobicContact CE2-CD1 3.89Å; Y801-L864 HydrophobicContact CE2-CG 4.3Å; L808-L864 HydrophobicContact CD1-CD1 4.24Å; L808-L864 HydrophobicContact CD1-CD2 4.05Å; F810-L864 HydrophobicContact CE2-CD1 3.57Å; F810-L864 HydrophobicContact CZ-CD1 3.61Å; I847-L864 HydrophobicContact CD1-CD2 3.6Å; I847-L864 HydrophobicContact CD1-CG 3.71Å; I847-L864 HydrophobicContact CG1-CD2 4.27Å; I860-L864 HydrophobicContact CG2-CD1 4.42Å; I860-L864 VanDerWaalsContact O-CG 3.3Å; I860-L864 WeakPolarHBondContact O-CG 3.48Å; I860-L864 PolarHBondContact O-N 2.93Å; E861-L864 PolarHBondContact O-N 2.97Å; L864-L866 PolarHBondContact O-N 3.1Å; L864-A867 PolarHBondContact O-N 3.43Å; L864-A868 WeakPolarHBondContact O-CB 3.45Å; L864-A868 PolarHBondContact O-N 3.21Å; L864-V875 HydrophobicContact CD2-CG1 4.12Å; L864-L877 HydrophobicContact CD2-CD2 3.97Å
865	R	82.2	Confident	76.5	Confident	133 Å²	133	71 Å²	71	50%	0.502	36%	0.359	S	S	.	.	H	α-helix	trans	-64.9	-40.1	-178.7	-163.9	177.7	70.9	123.1	1.6	112	E861 E862 K869	E861-R865 WeakPolarHBondContact O-CB 3.48Å; E861-R865 PolarHBondContact O-N 3.45Å; E862-R865 PolarHBondContact O-N 3.41Å; E862-R865 IonicContact OE1-CZ 2.68Å; E862-R865 IonicContact OE1-NE 2.7Å; E862-R865 IonicContact OE1-NH2 2.64Å; E862-R865 PolarHBondContact OE1-NH2 3.15Å; E862-R865 IonicContact OE2-CZ 3.54Å; E862-R865 IonicContact OE2-NE 3.59Å; E862-R865 PolarHBondContact OE2-NE 3.1Å; E862-R865 IonicContact OE2-NH2 2.71Å; E862-R865 PolarHBondContact OE2-NH2 2.88Å; R865-K869 VanDerWaalsContact O-CB 3.23Å; R865-K869 WeakPolarHBondContact O-CB 3.38Å; R865-K869 PolarHBondContact O-N 2.91Å
866	L	84.5	Confident	76.8	Confident	76 Å²	76	70.6 Å²	70.6	40%	0.398	36%	0.355	S	S	.	.	H	α-helix	trans	-70.8	-44.3	175.3	-70.5	171.7	0	0	0	112	E862 L864 K869 N870	E862-L866 HydrophobicContact CG-CD1 3.91Å; E862-L866 HydrophobicContact CG-CG 4.22Å; E862-L866 WeakPolarHBondContact O-CB 3.47Å; E862-L866 VanDerWaalsContact O-CG 3.23Å; E862-L866 WeakPolarHBondContact O-CG 3.25Å; E862-L866 PolarHBondContact O-N 3.24Å; L864-L866 PolarHBondContact O-N 3.1Å; L866-K869 PolarHBondContact O-N 3.11Å; L866-N870 WeakPolarHBondContact O-CB 3.37Å; L866-N870 PolarHBondContact O-N 3.5Å; L866-N870 PolarHBondContact O-ND2 3.06Å
867	A	82.4	Confident	77.2	Confident	10 Å²	10	64.6 Å²	64.6	8%	0.083	33%	0.329	C	S	.	.	H	α-helix	trans	-58.5	-51.8	175.1	0	0	0	0	0	111.2	I847 E848 L863 L864 K869 N870 N871 V875	I847-A867 HydrophobicContact CG2-CB 3.97Å; E848-A867 HydrophobicContact CG-CB 3.65Å; L863-A867 WeakPolarHBondContact O-CB 3.4Å; L863-A867 PolarHBondContact O-N 2.77Å; L864-A867 PolarHBondContact O-N 3.43Å; A867-K869 VanDerWaalsContact C-N 3.32Å; A867-K869 PolarHBondContact O-N 2.8Å; A867-N870 PolarHBondContact O-N 2.94Å; A867-N870 VanDerWaalsContact O-N 3.1Å; A867-N871 WeakPolarHBondContact O-CB 3.39Å; A867-N871 PolarHBondContact O-N 3.02Å; A867-V875 HydrophobicContact CB-CG1 4Å; A867-V875 HydrophobicContact CB-CG2 3.97Å
868	A	81.9	Confident	77.6	Confident	6 Å²	6	61.4 Å²	61.4	5%	0.05	31%	0.308	C	S	.	.	H	α-helix	trans	-61.1	-38.8	178.6	0	0	0	0	0	112.4	Y801 L864 N870 N872 G873 V875	Y801-A868 HydrophobicContact CD1-CB 3.55Å; Y801-A868 HydrophobicContact CE1-CB 4.41Å; Y801-A868 HydrophobicContact CG-CB 4.18Å; L864-A868 WeakPolarHBondContact O-CB 3.45Å; L864-A868 PolarHBondContact O-N 3.21Å; A868-N870 VanDerWaalsContact C-N 3.32Å; A868-N870 PolarHBondContact O-N 3.35Å; A868-N872 PolarHBondContact O-N 3.29Å; A868-G873 WeakPolarHBondContact O-CA 3.48Å; A868-G873 PolarHBondContact O-N 3.32Å; A868-V875 HydrophobicContact CB-CG2 3.85Å
869	K	80.9	Confident	77.8	Confident	168 Å²	168	57.9 Å²	57.9	73%	0.73	28%	0.283	S	S	*	.	H	α-helix	trans	-63.6	-36.8	175.1	-177	-179.9	177.8	-175.2	0	112.4	R865 L866 A867	R865-K869 VanDerWaalsContact O-CB 3.23Å; R865-K869 WeakPolarHBondContact O-CB 3.38Å; R865-K869 PolarHBondContact O-N 2.91Å; L866-K869 PolarHBondContact O-N 3.11Å; A867-K869 VanDerWaalsContact C-N 3.32Å; A867-K869 PolarHBondContact O-N 2.8Å
870	N	77.2	Confident	77.5	Confident	118 Å²	118	57.3 Å²	57.3	63%	0.631	28%	0.278	S	S	*	.	H	α-helix	trans	-80.8	-30.9	-179.1	-65.2	-16.6	0	0	0	112.8	L866 A867 A868	L866-N870 WeakPolarHBondContact O-CB 3.37Å; L866-N870 PolarHBondContact O-N 3.5Å; L866-N870 PolarHBondContact O-ND2 3.06Å; A867-N870 PolarHBondContact O-N 2.94Å; A867-N870 VanDerWaalsContact O-N 3.1Å; A868-N870 VanDerWaalsContact C-N 3.32Å; A868-N870 PolarHBondContact O-N 3.35Å
871	N	72.1	Confident	77	Confident	69 Å²	69	60 Å²	60	37%	0.369	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.2	35.6	-171.5	-72	-11	0	0	0	113.5	E848 A867 G873 Y874	E848-N871 PolarHBondContact OE1-ND2 3.37Å; E848-N871 PolarHBondContact OE2-ND2 3.16Å; A867-N871 WeakPolarHBondContact O-CB 3.39Å; A867-N871 PolarHBondContact O-N 3.02Å; N871-G873 VanDerWaalsContact C-N 3.31Å; N871-G873 PolarHBondContact O-N 3.11Å; N871-Y874 VanDerWaalsContact CB-O 3.29Å; N871-Y874 WeakPolarHBondContact CB-O 3.19Å; N871-Y874 WeakPolarHBondContact O-CB 3.2Å; N871-Y874 PolarHBondContact O-N 3Å
872	N	77.2	Confident	76	Confident	149 Å²	149	58.1 Å²	58.1	80%	0.797	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	41.9	176.9	-71.5	-12.7	0	0	0	114.7	A868 Y874	A868-N872 PolarHBondContact O-N 3.29Å; N872-Y874 VanDerWaalsContact C-N 3.29Å; N872-Y874 PolarHBondContact O-N 2.72Å
873	G	71.3	Confident	74.2	Confident	20 Å²	20	60.1 Å²	60.1	21%	0.206	29%	0.29	C	S	.	.	T	Hydrogen-bonded Turn	trans	79.4	3.1	-177.9	0	0	0	0	0	114.7	R800 Y801 A868 N871	R800-G873 CarbonylContact C-O 3.1Å; R800-G873 VanDerWaalsContact CA-O 3.31Å; R800-G873 WeakPolarHBondContact CA-O 3.1Å; R800-G873 VanDerWaalsContact CG-O 3.28Å; R800-G873 WeakPolarHBondContact CG-O 3.37Å; Y801-G873 PolarHBondContact N-O 3.24Å; A868-G873 WeakPolarHBondContact O-CA 3.48Å; A868-G873 PolarHBondContact O-N 3.32Å; N871-G873 VanDerWaalsContact C-N 3.31Å; N871-G873 PolarHBondContact O-N 3.11Å
874	Y	69.5	Low	72	Confident	109 Å²	109	61.6 Å²	61.6	43%	0.427	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.7	151.7	170.6	-69.8	-95.2	0	0	0	111.6	I799 R800 N871 N872	I799-Y874 CarbonylContact O-C 3.59Å; I799-Y874 WeakPolarHBondContact O-CA 3.26Å; R800-Y874 HydrophobicContact CB-CD1 4.36Å; R800-Y874 HydrophobicContact CB-CE1 4.39Å; R800-Y874 PolarHBondContact NH2-OH 2.65Å; N871-Y874 VanDerWaalsContact CB-O 3.29Å; N871-Y874 WeakPolarHBondContact CB-O 3.19Å; N871-Y874 WeakPolarHBondContact O-CB 3.2Å; N871-Y874 PolarHBondContact O-N 3Å; N872-Y874 VanDerWaalsContact C-N 3.29Å; N872-Y874 PolarHBondContact O-N 2.72Å
875	V	75.5	Confident	69.7	Low	0 Å²	0	68 Å²	68	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	131.5	172.9	-177	0	0	0	0	109.5	K798 I799 Y801 I847 E848 L864 A867 A868 L877	K798-V875 WeakPolarHBondContact CA-O 3.47Å; I799-V875 HydrophobicContact CG1-CB 4.15Å; I799-V875 WeakPolarHBondContact CG1-O 3.19Å; I799-V875 PolarHBondContact N-O 3.23Å; I799-V875 PolarHBondContact O-N 2.96Å; Y801-V875 HydrophobicContact CG-CG2 4.41Å; I847-V875 HydrophobicContact CG2-CG1 3.69Å; E848-V875 WeakPolarHBondContact OE1-CA 3.32Å; L864-V875 HydrophobicContact CD2-CG1 4.12Å; A867-V875 HydrophobicContact CB-CG1 4Å; A867-V875 HydrophobicContact CB-CG2 3.97Å; A868-V875 HydrophobicContact CB-CG2 3.85Å; V875-L877 HydrophobicContact CG1-CD2 3.78Å
876	T	75.3	Confident	67.4	Low	20 Å²	20	65.6 Å²	65.6	12%	0.123	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	116.7	169.9	-44.1	0	0	0	0	109.2	D796 K798 E848	D796-T876 HydrophobicContact CB-CG2 4.33Å; K798-T876 WeakPolarHBondContact CE-OG1 3.29Å; K798-T876 HydrophobicContact CG-CG2 3.94Å; E848-T876 PolarHBondContact N-O 2.84Å; E848-T876 PolarHBondContact OE1-N 2.8Å; E848-T876 PolarHBondContact OE1-OG1 3.27Å; E848-T876 VanDerWaalsContact OE1-OG1 3.14Å; E848-T876 PolarHBondContact OE2-OG1 3.4Å
877	L	81.3	Confident	64.9	Low	0 Å²	0	66.9 Å²	66.9	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	127.5	173.3	-54	-179.7	0	0	0	109	D796 V797 I799 L808 I822 L844 A846 I847 L864 V875 V879	D796-L877 CarbonylContact C-O 3.6Å; D796-L877 WeakPolarHBondContact CA-O 3.37Å; V797-L877 PolarHBondContact N-O 2.7Å; V797-L877 PolarHBondContact O-N 3.26Å; I799-L877 HydrophobicContact CD1-CD1 3.79Å; I799-L877 HydrophobicContact CD1-CG 4.23Å; I799-L877 HydrophobicContact CG1-CD1 4.14Å; I799-L877 HydrophobicContact CG1-CG 4.21Å; I799-L877 HydrophobicContact CG2-CD1 4.43Å; L808-L877 HydrophobicContact CD1-CD1 4.17Å; I822-L877 HydrophobicContact CD1-CD1 4.21Å; L844-L877 HydrophobicContact CD1-CB 3.82Å; L844-L877 HydrophobicContact CD1-CD1 4.29Å; L844-L877 HydrophobicContact CD1-CD2 3.93Å; L844-L877 HydrophobicContact CD1-CG 4.23Å; A846-L877 CarbonylContact O-C 3.55Å; A846-L877 WeakPolarHBondContact O-CA 3.41Å; I847-L877 HydrophobicContact CG1-CD2 3.92Å; L864-L877 HydrophobicContact CD2-CD2 3.97Å; V875-L877 HydrophobicContact CG1-CD2 3.78Å; L877-V879 HydrophobicContact CB-CG1 4.23Å
878	T	75.3	Confident	62.3	Low	21 Å²	21	69.7 Å²	69.7	13%	0.129	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	120.7	162.7	-49.9	0	0	0	0	107.5	D796 V845 A846	D796-T878 VanDerWaalsContact OD1-CB 3.29Å; D796-T878 WeakPolarHBondContact OD1-CB 3.4Å; D796-T878 WeakPolarHBondContact OD1-CG2 3.38Å; D796-T878 PolarHBondContact OD1-OG1 2.82Å; V845-T878 WeakPolarHBondContact CA-O 3.39Å; V845-T878 HydrophobicContact CB-CG2 4.27Å; V845-T878 WeakPolarHBondContact CB-O 3.4Å; V845-T878 PolarHBondContact N-O 2.87Å; A846-T878 PolarHBondContact N-O 2.78Å; A846-T878 VanDerWaalsContact N-O 3.1Å; A846-T878 PolarHBondContact O-N 3.25Å
879	V	74.2	Confident	59.9	Low	1 Å²	1	77 Å²	77	1%	0.006	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	159.2	176.6	-55.7	0	0	0	0	111.2	T794 E795 V797 I822 L838 D842 L843 L844 L877	T794-V879 CarbonylContact C-O 3.59Å; T794-V879 VanDerWaalsContact CA-O 3.23Å; T794-V879 WeakPolarHBondContact CA-O 3.26Å; E795-V879 HydrophobicContact CB-CG2 4.33Å; E795-V879 PolarHBondContact N-O 2.77Å; E795-V879 PolarHBondContact O-N 2.82Å; V797-V879 HydrophobicContact CG2-CG2 3.79Å; I822-V879 HydrophobicContact CD1-CG1 3.6Å; L838-V879 HydrophobicContact CD2-CG1 3.84Å; L838-V879 HydrophobicContact CD2-CG2 4.41Å; D842-V879 HydrophobicContact CB-CB 4.29Å; D842-V879 HydrophobicContact CB-CG2 4.42Å; L843-V879 CarbonylContact O-C 3.59Å; L843-V879 VanDerWaalsContact O-CA 3.28Å; L843-V879 WeakPolarHBondContact O-CA 3.37Å; L844-V879 HydrophobicContact CD1-CG1 4.34Å; L877-V879 HydrophobicContact CB-CG1 4.23Å
880	R	69.5	Low	57.3	Low	63 Å²	63	72 Å²	72	24%	0.238	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	120.9	170.6	177	170.4	-67	152.6	8.1	109.3	F793 T794 L843 V845 I882 Y962	F793-R880 WeakPolarHBondContact O-CA 3.3Å; T794-R880 HydrophobicContact CG2-CB 4.22Å; T794-R880 VanDerWaalsContact CG2-NH2 3.34Å; L843-R880 HydrophobicContact CB-CB 4.48Å; L843-R880 PolarHBondContact N-O 2.95Å; L843-R880 PolarHBondContact O-N 3.47Å; V845-R880 HydrophobicContact CG2-CB 3.78Å; R880-I882 PolarHBondContact O-N 3.02Å; R880-Y962 PolarHBondContact NH1-OH 3.06Å
881	R	64.2	Low	54.9	Low	57 Å²	57	70.4 Å²	70.4	22%	0.215	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	111.8	178.2	-169	149.2	-62.2	120.5	11.6	110.4	F793 E795 N837 D842	F793-R881 PolarHBondContact O-N 2.68Å; E795-R881 IonicContact OE1-NH1 2.77Å; E795-R881 IonicContact OE2-CZ 2.76Å; E795-R881 VanDerWaalsContact OE2-CZ 3.29Å; E795-R881 IonicContact OE2-NH1 3.84Å; E795-R881 PolarHBondContact OE2-NH1 3.07Å; E795-R881 IonicContact OE2-NH2 3.48Å; E795-R881 PolarHBondContact OE2-NH2 3.04Å; N837-R881 PolarHBondContact O-NH2 3.39Å; D842-R881 VanDerWaalsContact OD1-CA 3.25Å; D842-R881 WeakPolarHBondContact OD1-CA 3.3Å; D842-R881 WeakPolarHBondContact OD1-CB 3.36Å; D842-R881 VanDerWaalsContact OD1-CG 3.26Å; D842-R881 WeakPolarHBondContact OD1-CG 3.4Å; D842-R881 IonicContact OD1-CZ 2.65Å; D842-R881 IonicContact OD1-NE 3.46Å; D842-R881 PolarHBondContact OD1-NE 2.87Å; D842-R881 IonicContact OD1-NH2 3.6Å; D842-R881 IonicContact OD2-CZ 2.79Å; D842-R881 IonicContact OD2-NE 3.7Å; D842-R881 PolarHBondContact OD2-NE 2.94Å; D842-R881 IonicContact OD2-NH2 2.66Å; D842-R881 PolarHBondContact OD2-NH2 3.06Å
882	I	54.7	Low	52.8	Low	82 Å²	82	74.9 Å²	74.9	42%	0.421	39%	0.385	S	S	.	.			trans	-83.7	113.4	166.7	-56.3	178.8	0	0	0	105.5	L843 R880	L843-I882 HydrophobicContact CB-CD1 4.09Å; L843-I882 HydrophobicContact CB-CG1 4.4Å; R880-I882 PolarHBondContact O-N 3.02Å
883	H	44.9	Very low	50.5	Low	114 Å²	114	73.1 Å²	73.1	53%	0.528	37%	0.374	S	S	.	.			trans	-84.9	131.9	-170.4	-122.6	-69.3	0	0	0	110.7	L885 D886	H883-L885 PolarHBondContact O-N 3.01Å; H883-D886 PolarHBondContact O-N 2.75Å
884	P	36.6	Very low	48.3	Very low	75 Å²	75	76.6 Å²	76.6	49%	0.487	40%	0.395	S	S	.	.	G	3₁₀ helix	trans	-59.1	0.9	176.5	-30.5	38.1	0	0	0	116.7	D886 E887	P884-D886 VanDerWaalsContact C-N 3.25Å; P884-E887 HydrophobicContact CB-CG 4.17Å; P884-E887 VanDerWaalsContact O-CB 3.23Å; P884-E887 WeakPolarHBondContact O-CB 3.32Å; P884-E887 VanDerWaalsContact O-CG 3.28Å; P884-E887 WeakPolarHBondContact O-CG 3.28Å; P884-E887 PolarHBondContact O-N 2.96Å; P884-E887 VanDerWaalsContact O-N 3.15Å
885	L	33.3	Very low	46.2	Very low	138 Å²	138	78.6 Å²	78.6	72%	0.723	41%	0.409	S	S	*	.	G	3₁₀ helix	trans	-74.7	-16.6	170.4	-76.1	160.9	0	0	0	112.7	H883 E887	H883-L885 PolarHBondContact O-N 3.01Å; L885-E887 PolarHBondContact O-N 3.33Å
886	D	33.9	Very low	44	Very low	82 Å²	82	83.1 Å²	83.1	44%	0.439	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-71.5	-10.6	164.8	-86	-61.5	0	0	0	112.7	H883 P884 A888 E889 C890	H883-D886 PolarHBondContact O-N 2.75Å; P884-D886 VanDerWaalsContact C-N 3.25Å; D886-A888 PolarHBondContact O-N 2.96Å; D886-E889 PolarHBondContact O-N 3.49Å; D886-C890 HydrophobicContact CB-CB 4.17Å; D886-C890 WeakPolarHBondContact O-CA 3.28Å; D886-C890 VanDerWaalsContact O-CB 3.29Å; D886-C890 WeakPolarHBondContact O-CB 3.48Å; D886-C890 PolarHBondContact O-N 2.87Å; D886-C890 PolarHBondContact OD1-SG 2.8Å
887	E	31.9	Very low	41.5	Very low	103 Å²	103	87.1 Å²	87.1	48%	0.481	46%	0.462	S	S	.	.	G	3₁₀ helix	trans	-66.2	-21.4	-177.6	-65.5	-177.4	164.1	0	0	113.4	P884 L885 M891	P884-E887 HydrophobicContact CB-CG 4.17Å; P884-E887 VanDerWaalsContact O-CB 3.23Å; P884-E887 WeakPolarHBondContact O-CB 3.32Å; P884-E887 VanDerWaalsContact O-CG 3.28Å; P884-E887 WeakPolarHBondContact O-CG 3.28Å; P884-E887 PolarHBondContact O-N 2.96Å; P884-E887 VanDerWaalsContact O-N 3.15Å; L885-E887 PolarHBondContact O-N 3.33Å; E887-M891 HydrophobicContact CB-CE 4.15Å; E887-M891 HydrophobicContact CB-CG 4.17Å; E887-M891 HydrophobicContact CB-SD 3.72Å; E887-M891 HydrophobicContact CG-CE 3.66Å; E887-M891 HydrophobicContact CG-CG 4.35Å; E887-M891 HydrophobicContact CG-SD 3.93Å; E887-M891 VanDerWaalsContact O-CB 3.28Å; E887-M891 WeakPolarHBondContact O-CB 3.43Å
888	A	28.4	Very low	38.8	Very low	69 Å²	69	91.8 Å²	91.8	57%	0.57	50%	0.501	S	S	*	.	G	3₁₀ helix	trans	-83.3	-22.4	176.3	0	0	0	0	0	114.6	D886	D886-A888 PolarHBondContact O-N 2.96Å
889	E	30.2	Very low	36.5	Very low	160 Å²	160	99.6 Å²	99.6	75%	0.748	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117	-31.6	-175.7	-62.9	-158.3	121.2	0	0	113.3	D886	D886-E889 PolarHBondContact O-N 3.49Å
890	C	27.2	Very low	34.3	Very low	63 Å²	63	107 Å²	107	43%	0.426	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-90.9	-32.7	177	-69.9	0	0	0	0	114.3	D886 K892 I893	D886-C890 HydrophobicContact CB-CB 4.17Å; D886-C890 WeakPolarHBondContact O-CA 3.28Å; D886-C890 VanDerWaalsContact O-CB 3.29Å; D886-C890 WeakPolarHBondContact O-CB 3.48Å; D886-C890 PolarHBondContact O-N 2.87Å; D886-C890 PolarHBondContact OD1-SG 2.8Å; C890-K892 PolarHBondContact O-N 2.96Å; C890-K892 VanDerWaalsContact O-N 3.16Å; C890-I893 PolarHBondContact O-N 3.12Å
891	M	27.1	Very low	32.3	Very low	84 Å²	84	109.3 Å²	109.3	41%	0.414	60%	0.599	S	S	.	*	G	3₁₀ helix	trans	-67.2	-14.3	176	-71.5	-179.4	162.9	0	0	113.5	E887 I893 S894 E895	E887-M891 HydrophobicContact CB-CE 4.15Å; E887-M891 HydrophobicContact CB-CG 4.17Å; E887-M891 HydrophobicContact CB-SD 3.72Å; E887-M891 HydrophobicContact CG-CE 3.66Å; E887-M891 HydrophobicContact CG-CG 4.35Å; E887-M891 HydrophobicContact CG-SD 3.93Å; E887-M891 VanDerWaalsContact O-CB 3.28Å; E887-M891 WeakPolarHBondContact O-CB 3.43Å; M891-I893 PolarHBondContact O-N 3.4Å; M891-S894 PolarHBondContact O-N 2.81Å; M891-E895 PolarHBondContact O-N 2.88Å
892	K	27.1	Very low	30.7	Very low	163 Å²	163	112.9 Å²	112.9	71%	0.709	62%	0.622	S	S	*	*	G	3₁₀ helix	trans	-62.5	-1.8	171.3	-78.5	178.6	178.7	161.2	0	114.5	C890	C890-K892 PolarHBondContact O-N 2.96Å; C890-K892 VanDerWaalsContact O-N 3.16Å
893	I	29.1	Very low	29.9	Very low	112 Å²	112	114 Å²	114	57%	0.574	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-109.2	-13.3	173.7	-57.1	-179.6	0	0	0	111.8	C890 M891 I906 M957	C890-I893 PolarHBondContact O-N 3.12Å; M891-I893 PolarHBondContact O-N 3.4Å; I893-I906 HydrophobicContact CD1-CD1 4.14Å; I893-I906 HydrophobicContact CG2-CD1 4.08Å; I893-M957 HydrophobicContact CD1-CE 4.06Å
894	S	25.1	Very low	30.1	Very low	92 Å²	92	112.1 Å²	112.1	64%	0.643	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-123.9	-9.9	-174.8	59.6	0	0	0	0	116.4	M891	M891-S894 PolarHBondContact O-N 2.81Å
895	E	25.9	Very low	31.7	Very low	152 Å²	152	111 Å²	111	71%	0.71	63%	0.626	S	S	*	*			trans	-128.5	120.3	159.9	-78.9	-166.9	176.6	0	0	110.8	M891 P897	M891-E895 PolarHBondContact O-N 2.88Å; E895-P897 WeakPolarHBondContact O-CD 3.32Å
896	V	27.9	Very low	33.9	Very low	94 Å²	94	107.1 Å²	107.1	57%	0.57	61%	0.606	S	S	*	*			trans	-105.2	105.4	168.9	175.7	0	0	0	0	107.5	A898	V896-A898 PolarHBondContact O-N 2.81Å
897	P	24.1	Very low	36.4	Very low	105 Å²	105	105 Å²	105	68%	0.682	59%	0.594	S	S	*	*			trans	-57.7	133.4	164.8	-18.5	31.3	0	0	0	108.2	E895 K899	E895-P897 WeakPolarHBondContact O-CD 3.32Å; P897-K899 PolarHBondContact O-N 3.11Å
898	A	25.2	Very low	39	Very low	98 Å²	98	103.4 Å²	103.4	81%	0.81	59%	0.589	S	S	*	*	S	Bend	trans	-76.6	65.4	-170.5	0	0	0	0	0	113.7	V896	V896-A898 PolarHBondContact O-N 2.81Å
899	K	25.7	Very low	42	Very low	184 Å²	184	100.1 Å²	100.1	80%	0.8	56%	0.562	S	S	*	*	S	Bend	trans	-161	148.9	160	-94.7	128.5	-172.9	-179.6	0	110.3	P897	P897-K899 PolarHBondContact O-N 3.11Å
900	D	28.4	Very low	44.9	Very low	157 Å²	157	97.7 Å²	97.7	84%	0.84	55%	0.549	S	S	*	.	S	Bend	trans	66.1	138.4	179	-54.4	-19.5	0	0	0	116.4
901	S	26.8	Very low	48	Very low	112 Å²	112	94.7 Å²	94.7	78%	0.783	53%	0.529	S	S	*	.			trans	-119.3	115.6	-149.8	54.7	0	0	0	0	114.7
902	N	31.3	Very low	51.1	Low	132 Å²	132	95.3 Å²	95.3	71%	0.706	53%	0.533	S	S	*	.			trans	-158.9	11.4	166.4	-114.1	-23.2	0	0	0	117	S904	N902-S904 PolarHBondContact O-N 3.27Å
903	S	38.8	Very low	54	Low	104 Å²	104	88.7 Å²	88.7	73%	0.727	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	14.2	-170.2	52.5	0	0	0	0	116.6
904	S	49.1	Very low	56.7	Low	75 Å²	75	88.1 Å²	88.1	52%	0.524	50%	0.499	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-12.4	-169.6	51.1	0	0	0	0	115.7	N902 I906 K989	N902-S904 PolarHBondContact O-N 3.27Å; S904-I906 PolarHBondContact O-N 3.23Å; S904-K989 VanDerWaalsContact O-CD 3.28Å; S904-K989 WeakPolarHBondContact O-CD 3.46Å; S904-K989 PolarHBondContact O-NZ 3.4Å
905	N	70	Confident	59.1	Low	52 Å²	52	88.4 Å²	88.4	28%	0.278	49%	0.489	S	S	.	.	S	Bend	trans	-95.1	20.2	-159.2	-71.2	-26.8	0	0	0	117	E988 K989	N905-E988 CarbonylContact O-C 3.58Å; N905-E988 WeakPolarHBondContact O-CA 3.4Å; N905-K989 PolarHBondContact O-N 2.79Å
906	I	78.4	Confident	61.6	Low	56 Å²	56	86.2 Å²	86.2	29%	0.287	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.3	153.1	175.7	-58.9	178.6	0	0	0	111	I893 S904 M957 T986 I987 K989	I893-I906 HydrophobicContact CD1-CD1 4.14Å; I893-I906 HydrophobicContact CG2-CD1 4.08Å; S904-I906 PolarHBondContact O-N 3.23Å; I906-M957 HydrophobicContact CD1-CE 4.21Å; I906-M957 HydrophobicContact CD1-SD 3.87Å; I906-M957 HydrophobicContact CG1-SD 4.05Å; I906-T986 HydrophobicContact CG2-CG2 3.61Å; I906-I987 CarbonylContact C-O 3.54Å; I906-I987 WeakPolarHBondContact CA-O 3.47Å; I906-K989 PolarHBondContact O-NZ 2.99Å
907	I	86.8	Confident	64.3	Low	38 Å²	38	84.5 Å²	84.5	20%	0.195	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	145.1	168.7	49.4	178.1	0	0	0	111.4	V909 T986 I987 K989	I907-V909 HydrophobicContact CD1-CG2 3.78Å; I907-V909 HydrophobicContact CG1-CG2 4.08Å; I907-T986 WeakPolarHBondContact O-CA 3.39Å; I907-I987 HydrophobicContact CD1-CG2 4.27Å; I907-I987 HydrophobicContact CG1-CB 4.01Å; I907-I987 HydrophobicContact CG1-CG2 4.1Å; I907-I987 PolarHBondContact N-O 2.89Å; I907-I987 PolarHBondContact O-N 2.87Å; I907-K989 HydrophobicContact CD1-CG 4.4Å; I907-K989 HydrophobicContact CG1-CG 4.27Å; I907-K989 HydrophobicContact CG2-CD 4.09Å; I907-K989 HydrophobicContact CG2-CG 3.88Å
908	N	87.6	Confident	67.5	Low	70 Å²	70	81.7 Å²	81.7	37%	0.374	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	112.4	167.4	-74.6	-22.1	0	0	0	109	E816 I984 T986	E816-N908 PolarHBondContact OE2-ND2 3.2Å; N908-I984 HydrophobicContact CB-CG2 4.27Å; N908-T986 WeakPolarHBondContact OD1-CA 3.12Å; N908-T986 VanDerWaalsContact OD1-CB 3.28Å; N908-T986 WeakPolarHBondContact OD1-CB 3.4Å; N908-T986 WeakPolarHBondContact OD1-CG2 3.4Å; N908-T986 PolarHBondContact OD1-OG1 3.23Å
909	V	90.7	Very high	70.7	Confident	0 Å²	0	77.5 Å²	77.5	0%	0	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	111.5	-178.4	-177	0	0	0	0	109.9	I907 L911 Q949 L950 L985 I987	I907-V909 HydrophobicContact CD1-CG2 3.78Å; I907-V909 HydrophobicContact CG1-CG2 4.08Å; V909-L911 HydrophobicContact CG1-CD2 4.13Å; V909-Q949 HydrophobicContact CG1-CB 3.83Å; V909-Q949 HydrophobicContact CG2-CB 3.86Å; V909-L950 HydrophobicContact CB-CD2 3.97Å; V909-L950 HydrophobicContact CG1-CD2 3.76Å; V909-L950 HydrophobicContact CG1-CG 4.09Å; V909-L950 HydrophobicContact CG2-CD2 4.04Å; V909-L985 PolarHBondContact N-O 2.8Å; V909-L985 PolarHBondContact O-N 3.43Å; V909-I987 HydrophobicContact CG2-CD1 4.25Å
910	K	91.7	Very high	73.9	Confident	108 Å²	108	69.3 Å²	69.3	47%	0.47	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	119	174.4	174.4	171.4	162.9	162.7	0	110.3	Q982 L983	K910-Q982 HydrophobicContact CD-CG 4.36Å; K910-Q982 HydrophobicContact CG-CG 4.11Å; K910-L983 WeakPolarHBondContact CA-O 3.35Å
911	L	92.4	Very high	76.9	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.005	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.7	140.3	167.6	-54.8	-174	0	0	0	110.2	V909 F919 F921 A944 C947 L950 Q982 L983 L985	V909-L911 HydrophobicContact CG1-CD2 4.13Å; L911-F919 HydrophobicContact CB-CD1 3.74Å; L911-F919 HydrophobicContact CB-CE1 4.24Å; L911-F919 HydrophobicContact CD1-CB 3.94Å; L911-F919 HydrophobicContact CD1-CD1 4.21Å; L911-F919 HydrophobicContact CD1-CG 4.36Å; L911-F921 HydrophobicContact CD1-CD1 3.97Å; L911-F921 HydrophobicContact CD1-CE1 3.81Å; L911-A944 HydrophobicContact CD1-CB 4.23Å; L911-C947 HydrophobicContact CD2-CB 3.74Å; L911-C947 WeakPolarHBondContact CD2-SG 3.47Å; L911-L950 HydrophobicContact CD1-CD1 3.95Å; L911-L950 HydrophobicContact CD2-CD1 3.94Å; L911-L950 HydrophobicContact CG-CD1 4.39Å; L911-Q982 WeakPolarHBondContact O-CA 3.48Å; L911-L983 HydrophobicContact CB-CB 4.43Å; L911-L983 HydrophobicContact CD1-CD2 4.27Å; L911-L983 PolarHBondContact N-O 3.06Å; L911-L983 PolarHBondContact O-N 3.3Å; L911-L985 HydrophobicContact CD1-CD1 4.29Å
912	L	90.4	Very high	80	Confident	96 Å²	96	61 Å²	61	50%	0.503	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.6	134.2	171.2	-69.1	172.7	0	0	0	108.3	P943 Q981 Q982	L912-P943 VanDerWaalsContact O-CB 3.3Å; L912-P943 WeakPolarHBondContact O-CB 3.47Å; L912-P943 WeakPolarHBondContact O-CG 3.36Å; L912-Q981 WeakPolarHBondContact CA-O 3.32Å; L912-Q982 HydrophobicContact CD2-CB 3.83Å; L912-Q982 HydrophobicContact CD2-CG 3.91Å
913	K	88.9	Confident	82.8	Confident	24 Å²	24	55.5 Å²	55.5	10%	0.104	31%	0.307	C	S	.	.			trans	-130.3	151.9	-178.4	73.9	171.1	-159.5	68.8	0	112	E917 F919 P943 Q980 Q981	K913-E917 HydrophobicContact CB-CG 3.91Å; K913-E917 WeakPolarHBondContact CD-O 3.1Å; K913-E917 WeakPolarHBondContact CE-O 3.18Å; K913-E917 PolarHBondContact NZ-O 2.77Å; K913-F919 HydrophobicContact CB-CD1 3.91Å; K913-F919 HydrophobicContact CB-CE1 3.94Å; K913-F919 HydrophobicContact CD-CD1 3.79Å; K913-F919 HydrophobicContact CD-CD2 3.93Å; K913-F919 HydrophobicContact CD-CE1 3.66Å; K913-F919 HydrophobicContact CD-CE2 3.81Å; K913-F919 HydrophobicContact CD-CG 3.91Å; K913-F919 HydrophobicContact CD-CZ 3.66Å; K913-F919 HydrophobicContact CG-CD1 3.93Å; K913-F919 HydrophobicContact CG-CE1 3.56Å; K913-F919 HydrophobicContact CG-CZ 3.89Å; K913-P943 HydrophobicContact CB-CB 4.35Å; K913-P943 HydrophobicContact CB-CG 3.58Å; K913-Q980 WeakPolarHBondContact CE-O 3.39Å; K913-Q980 PolarHBondContact NZ-O 3.38Å; K913-Q981 PolarHBondContact N-O 2.84Å; K913-Q981 WeakPolarHBondContact O-CG 3.34Å
914	E	85.5	Confident	85	Confident	100 Å²	100	54.1 Å²	54.1	47%	0.467	29%	0.294	S	S	.	.			trans	-66.8	157.7	165.1	-61.4	-51.2	144.5	0	0	111.9	D916 E917	E914-D916 VanDerWaalsContact C-N 3.29Å; E914-D916 PolarHBondContact O-N 3.25Å; E914-E917 HydrophobicContact CB-CG 4.08Å; E914-E917 PolarHBondContact N-OE1 2.92Å; E914-E917 PolarHBondContact O-N 2.93Å
915	K	76.2	Confident	86.2	Confident	98 Å²	98	51.8 Å²	51.8	43%	0.426	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.3	-31.9	-179.8	-70.2	-170.9	-148.4	153.1	0	112.9	G687 P688 C689	G687-K915 WeakPolarHBondContact O-CD 3.44Å; P688-K915 VanDerWaalsContact CA-CD 3.48Å; P688-K915 HydrophobicContact CB-CB 4.13Å; P688-K915 HydrophobicContact CB-CG 4.26Å; P688-K915 PolarHBondContact O-NZ 2.85Å; C689-K915 VanDerWaalsContact N-CE 3.32Å; C689-K915 VanDerWaalsContact N-NZ 3.15Å; C689-K915 WeakPolarHBondContact O-CE 3.27Å; C689-K915 PolarHBondContact O-NZ 2.92Å
916	D	78.7	Confident	85.8	Confident	107 Å²	107	51.2 Å²	51.2	57%	0.572	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.5	-3.4	179.3	-70.5	-53.6	0	0	0	114.4	S686 G687 P688 E914	S686-D916 WeakPolarHBondContact CA-OD1 3.48Å; S686-D916 VanDerWaalsContact CB-OD1 3.22Å; S686-D916 WeakPolarHBondContact CB-OD1 3.13Å; G687-D916 WeakPolarHBondContact CA-OD1 3.38Å; G687-D916 WeakPolarHBondContact CA-OD2 3.32Å; P688-D916 WeakPolarHBondContact CD-OD2 3.45Å; E914-D916 VanDerWaalsContact C-N 3.29Å; E914-D916 PolarHBondContact O-N 3.25Å
917	E	84.8	Confident	84.7	Confident	57 Å²	57	54.6 Å²	54.6	27%	0.266	30%	0.296	S	S	.	.	S	Bend	trans	-109	167.9	173.7	83.7	-174	152.8	0	0	112.3	K913 E914 P943 K946	K913-E917 HydrophobicContact CB-CG 3.91Å; K913-E917 WeakPolarHBondContact CD-O 3.1Å; K913-E917 WeakPolarHBondContact CE-O 3.18Å; K913-E917 PolarHBondContact NZ-O 2.77Å; E914-E917 HydrophobicContact CB-CG 4.08Å; E914-E917 PolarHBondContact N-OE1 2.92Å; E914-E917 PolarHBondContact O-N 2.93Å; E917-P943 HydrophobicContact CG-CG 4.12Å; E917-P943 WeakPolarHBondContact OE1-CG 3.4Å; E917-P943 WeakPolarHBondContact OE2-CD 3.29Å; E917-K946 IonicContact OE1-NZ 3.48Å; E917-K946 IonicContact OE2-NZ 3.54Å; E917-K946 PolarHBondContact OE2-NZ 3.01Å; E917-K946 VanDerWaalsContact OE2-NZ 3.1Å
918	G	89.3	Confident	83.1	Confident	46 Å²	46	57 Å²	57	47%	0.474	31%	0.309	S	S	.	.			trans	-104.9	159.9	168.2	0	0	0	0	0	110.7	G920 P943	G918-G920 PolarHBondContact O-N 2.82Å; G918-P943 WeakPolarHBondContact O-CD 3.5Å
919	F	93.1	Very high	81.5	Confident	11 Å²	11	61.8 Å²	61.8	5%	0.048	33%	0.327	C	S	.	.			trans	-56.8	-22.8	177.8	-63.4	-69.5	0	0	0	113.9	L911 K913 F921 A944 I976 S979 L983	L911-F919 HydrophobicContact CB-CD1 3.74Å; L911-F919 HydrophobicContact CB-CE1 4.24Å; L911-F919 HydrophobicContact CD1-CB 3.94Å; L911-F919 HydrophobicContact CD1-CD1 4.21Å; L911-F919 HydrophobicContact CD1-CG 4.36Å; K913-F919 HydrophobicContact CB-CD1 3.91Å; K913-F919 HydrophobicContact CB-CE1 3.94Å; K913-F919 HydrophobicContact CD-CD1 3.79Å; K913-F919 HydrophobicContact CD-CD2 3.93Å; K913-F919 HydrophobicContact CD-CE1 3.66Å; K913-F919 HydrophobicContact CD-CE2 3.81Å; K913-F919 HydrophobicContact CD-CG 3.91Å; K913-F919 HydrophobicContact CD-CZ 3.66Å; K913-F919 HydrophobicContact CG-CD1 3.93Å; K913-F919 HydrophobicContact CG-CE1 3.56Å; K913-F919 HydrophobicContact CG-CZ 3.89Å; F919-F921 HydrophobicContact CB-CD1 3.92Å; F919-F921 HydrophobicContact CB-CE1 3.71Å; F919-A944 WeakPolarHBondContact O-CB 3.05Å; F919-A944 PolarHBondContact O-N 2.81Å; F919-I976 HydrophobicContact CD2-CG2 3.89Å; F919-I976 HydrophobicContact CE2-CG2 4.33Å; F919-S979 WeakPolarHBondContact CE2-O 3.24Å; F919-S979 WeakPolarHBondContact CZ-O 3.43Å; F919-L983 HydrophobicContact CB-CD2 4.46Å; F919-L983 HydrophobicContact CD1-CB 3.98Å; F919-L983 HydrophobicContact CD1-CD2 4.41Å; F919-L983 HydrophobicContact CD2-CB 4.22Å; F919-L983 HydrophobicContact CD2-CD2 3.88Å; F919-L983 HydrophobicContact CE1-CB 3.56Å; F919-L983 HydrophobicContact CE2-CB 3.83Å; F919-L983 HydrophobicContact CE2-CD2 4.21Å; F919-L983 HydrophobicContact CE2-CG 4.47Å; F919-L983 HydrophobicContact CG-CB 4.3Å; F919-L983 HydrophobicContact CG-CD2 3.99Å; F919-L983 HydrophobicContact CZ-CB 3.49Å; F919-L983 VanDerWaalsContact CZ-CB 3.49Å
920	G	92.4	Very high	79.6	Confident	11 Å²	11	70.6 Å²	70.6	11%	0.113	37%	0.368	C	S	.	.			trans	81.7	30.5	162.8	0	0	0	0	0	115.8	G918 I939 S942	G918-G920 PolarHBondContact O-N 2.82Å; G920-I939 VanDerWaalsContact O-CB 3.3Å; G920-I939 WeakPolarHBondContact O-CB 3.39Å; G920-I939 WeakPolarHBondContact O-CG1 3.32Å; G920-I939 PolarHBondContact O-N 3.22Å; G920-S942 WeakPolarHBondContact CA-OG 3.39Å; G920-S942 PolarHBondContact O-OG 2.87Å
921	F	92.9	Very high	78	Confident	27 Å²	27	69.1 Å²	69.1	12%	0.118	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	161.5	167.2	67.8	-75.2	0	0	0	110.4	L911 F919 I923 I935 R937 I938 A944 I956 I976 L983 L985	L911-F921 HydrophobicContact CD1-CD1 3.97Å; L911-F921 HydrophobicContact CD1-CE1 3.81Å; F919-F921 HydrophobicContact CB-CD1 3.92Å; F919-F921 HydrophobicContact CB-CE1 3.71Å; F921-I923 HydrophobicContact CD2-CG1 4.03Å; F921-I923 HydrophobicContact CE2-CD1 3.83Å; F921-I923 HydrophobicContact CE2-CG1 3.64Å; F921-I935 HydrophobicContact CB-CG2 4.47Å; F921-R937 CarbonylContact C-O 3.48Å; F921-R937 VanDerWaalsContact CA-O 3.27Å; F921-R937 WeakPolarHBondContact CA-O 3.49Å; F921-I938 HydrophobicContact CB-CG1 4.44Å; F921-A944 HydrophobicContact CB-CB 3.84Å; F921-A944 HydrophobicContact CD1-CB 4.05Å; F921-A944 HydrophobicContact CG-CB 4.35Å; F921-I956 HydrophobicContact CE2-CD1 4.06Å; F921-I976 HydrophobicContact CE2-CD1 4.49Å; F921-I976 HydrophobicContact CZ-CD1 4.15Å; F921-L983 HydrophobicContact CE1-CD2 3.62Å; F921-L983 HydrophobicContact CZ-CD2 3.69Å; F921-L985 HydrophobicContact CE1-CD1 4.12Å; F921-L985 HydrophobicContact CE2-CD1 3.98Å; F921-L985 HydrophobicContact CZ-CD1 3.72Å; F921-L985 HydrophobicContact CZ-CD2 4.07Å; F921-L985 HydrophobicContact CZ-CG 4.46Å
922	V	91.9	Very high	76.8	Confident	68 Å²	68	70.5 Å²	70.5	41%	0.412	37%	0.373	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	132.3	179.3	-175.7	0	0	0	0	108.3	G936 R937	V922-G936 PolarHBondContact O-N 3.06Å; V922-R937 HydrophobicContact CB-CB 4.01Å; V922-R937 HydrophobicContact CG2-CB 4Å; V922-R937 PolarHBondContact N-O 3.35Å; V922-R937 PolarHBondContact O-N 2.96Å
923	I	89.7	Confident	76.6	Confident	17 Å²	17	66.2 Å²	66.2	9%	0.087	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	136.7	176.4	-64.1	-176.8	0	0	0	110.5	F921 S925 E934 I956 I959 H969 I972 I976	F921-I923 HydrophobicContact CD2-CG1 4.03Å; F921-I923 HydrophobicContact CE2-CD1 3.83Å; F921-I923 HydrophobicContact CE2-CG1 3.64Å; I923-S925 WeakPolarHBondContact CG2-OG 3.39Å; I923-E934 CarbonylContact C-O 3.56Å; I923-E934 WeakPolarHBondContact CA-O 3.49Å; I923-I956 HydrophobicContact CD1-CD1 3.66Å; I923-I956 HydrophobicContact CG1-CD1 3.79Å; I923-I959 HydrophobicContact CD1-CD1 4.44Å; I923-H969 PolarHBondContact O-CE1 3.07Å; I923-I972 HydrophobicContact CD1-CG2 3.71Å; I923-I976 HydrophobicContact CD1-CD1 3.34Å; I923-I976 HydrophobicContact CG1-CD1 4.43Å
924	V	84.9	Confident	76.6	Confident	75 Å²	75	65.8 Å²	65.8	46%	0.455	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	102.9	163.5	173.1	0	0	0	0	107.4	E934	V924-E934 PolarHBondContact N-O 3.34Å; V924-E934 PolarHBondContact O-N 2.8Å
925	S	75.1	Confident	76.8	Confident	25 Å²	25	61 Å²	61	18%	0.175	33%	0.327	C	S	.	.			trans	-96.6	125.2	173.4	-56.7	0	0	0	0	109.5	I923 S933 H969	I923-S925 WeakPolarHBondContact CG2-OG 3.39Å; S925-S933 VanDerWaalsContact CB-OG 3.31Å; S925-S933 WeakPolarHBondContact CB-OG 3.1Å; S925-S933 PolarHBondContact OG-OG 2.98Å; S925-H969 WeakPolarHBondContact CB-ND1 3.28Å; S925-H969 PolarHBondContact OG-ND1 2.87Å
926	S	60.9	Low	77.4	Confident	41 Å²	41	58 Å²	58	29%	0.287	32%	0.323	S	S	.	.			trans	-77.1	149.7	170.1	-71.4	0	0	0	0	111.1	N928 K931	S926-N928 VanDerWaalsContact C-N 3.28Å; S926-K931 VanDerWaalsContact CB-CB 3.48Å; S926-K931 WeakPolarHBondContact OG-CD 3.41Å
927	L	54.1	Low	77.9	Confident	126 Å²	126	60 Å²	60	66%	0.66	32%	0.323	S	S	*	.	S	Bend	trans	-85	-2.9	168.5	-67.4	175.5	0	0	0	112.8
928	N	54.2	Low	78.3	Confident	90 Å²	90	58.7 Å²	58.7	48%	0.481	32%	0.317	S	S	.	.	S	Bend	trans	-83.2	125.4	175.2	-66	15.1	0	0	0	108.9	S926 E930 K931	S926-N928 VanDerWaalsContact C-N 3.28Å; N928-E930 PolarHBondContact O-N 2.89Å; N928-K931 PolarHBondContact O-N 3.25Å
929	K	52.9	Low	78.4	Confident	170 Å²	170	60.1 Å²	60.1	74%	0.739	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-24	-178.3	-67.1	-168.6	172.1	-164.2	0	114.4
930	E	51.9	Low	78.3	Confident	184 Å²	184	64.3 Å²	64.3	86%	0.86	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	-9.1	-177.2	-65.5	152.5	-152.5	0	0	114.2	N928	N928-E930 PolarHBondContact O-N 2.89Å
931	K	58.7	Low	78.1	Confident	78 Å²	78	66.1 Å²	66.1	34%	0.339	36%	0.36	S	S	.	.			trans	-111	117.7	-178.3	-79.6	-165.6	173.2	-167.7	0	111.3	S926 N928	S926-K931 VanDerWaalsContact CB-CB 3.48Å; S926-K931 WeakPolarHBondContact OG-CD 3.41Å; N928-K931 PolarHBondContact O-N 3.25Å
932	A	67	Low	78.2	Confident	30 Å²	30	65.2 Å²	65.2	25%	0.248	36%	0.358	C	S	.	.			trans	-59.9	166.9	171.3	0	0	0	0	0	112.1	R955	A932-R955 HydrophobicContact CB-CB 4.22Å; A932-R955 HydrophobicContact CB-CG 4.48Å
933	S	84.6	Confident	78.2	Confident	5 Å²	5	62.2 Å²	62.2	4%	0.035	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	132.2	173.5	-76.8	0	0	0	0	111	S925 I956 I972	S925-S933 VanDerWaalsContact CB-OG 3.31Å; S925-S933 WeakPolarHBondContact CB-OG 3.1Å; S925-S933 PolarHBondContact OG-OG 2.98Å; S933-I956 WeakPolarHBondContact O-CB 3.37Å; S933-I956 PolarHBondContact O-N 3.38Å; S933-I972 VanDerWaalsContact OG-CD1 3.23Å; S933-I972 WeakPolarHBondContact OG-CD1 3.22Å
934	E	89.1	Confident	78.4	Confident	15 Å²	15	61.5 Å²	61.5	7%	0.07	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.3	148.7	-171.5	-78.6	160.1	-171	0	0	111.9	I923 V924 G936 Q954 R955 N1072	I923-E934 CarbonylContact C-O 3.56Å; I923-E934 WeakPolarHBondContact CA-O 3.49Å; V924-E934 PolarHBondContact N-O 3.34Å; V924-E934 PolarHBondContact O-N 2.8Å; E934-G936 PolarHBondContact O-N 2.8Å; E934-G936 VanDerWaalsContact O-N 3.14Å; E934-Q954 WeakPolarHBondContact CA-O 3.3Å; E934-R955 HydrophobicContact CG-CG 3.74Å; E934-N1072 PolarHBondContact OE1-ND2 2.99Å; E934-N1072 PolarHBondContact OE2-ND2 2.85Å
935	I	89.9	Confident	78.9	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	102.1	170.6	-59.7	-179.9	0	0	0	108.2	F921 I938 L950 V952 G953 Q954 I956 I987	F921-I935 HydrophobicContact CB-CG2 4.47Å; I935-I938 HydrophobicContact CG2-CD1 4.38Å; I935-I938 HydrophobicContact CG2-CG1 3.92Å; I935-L950 HydrophobicContact CD1-CB 4.15Å; I935-L950 HydrophobicContact CD1-CD1 4.28Å; I935-L950 HydrophobicContact CD1-CD2 3.83Å; I935-L950 HydrophobicContact CD1-CG 4.31Å; I935-V952 CarbonylContact O-C 3.57Å; I935-V952 VanDerWaalsContact O-CA 3.26Å; I935-V952 WeakPolarHBondContact O-CA 3.34Å; I935-V952 WeakPolarHBondContact O-CG1 3.29Å; I935-G953 PolarHBondContact O-N 3.26Å; I935-Q954 HydrophobicContact CD1-CB 4.16Å; I935-Q954 HydrophobicContact CG1-CB 4.5Å; I935-Q954 PolarHBondContact N-O 3.48Å; I935-I956 HydrophobicContact CD1-CG1 4.49Å; I935-I956 HydrophobicContact CG1-CD1 3.87Å; I935-I956 HydrophobicContact CG1-CG1 3.9Å; I935-I987 HydrophobicContact CD1-CD1 4.01Å
936	G	88.6	Confident	79.6	Confident	34 Å²	34	66.8 Å²	66.8	35%	0.351	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	-21.4	-179.2	0	0	0	0	0	114.7	V922 E934	V922-G936 PolarHBondContact O-N 3.06Å; E934-G936 PolarHBondContact O-N 2.8Å; E934-G936 VanDerWaalsContact O-N 3.14Å
937	R	90.9	Very high	81	Confident	151 Å²	151	66.3 Å²	66.3	57%	0.57	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-160.8	148.1	175	179.6	172.6	176.7	-173.8	-0.3	111.2	F921 V922	F921-R937 CarbonylContact C-O 3.48Å; F921-R937 VanDerWaalsContact CA-O 3.27Å; F921-R937 WeakPolarHBondContact CA-O 3.49Å; V922-R937 HydrophobicContact CB-CB 4.01Å; V922-R937 HydrophobicContact CG2-CB 4Å; V922-R937 PolarHBondContact N-O 3.35Å; V922-R937 PolarHBondContact O-N 2.96Å
938	I	92.4	Very high	82.6	Confident	28 Å²	28	63.2 Å²	63.2	14%	0.144	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	144.7	164.1	-61.9	168.8	0	0	0	108.3	F921 I935 A944 D945 L950	F921-I938 HydrophobicContact CB-CG1 4.44Å; I935-I938 HydrophobicContact CG2-CD1 4.38Å; I935-I938 HydrophobicContact CG2-CG1 3.92Å; I938-A944 HydrophobicContact CG2-CB 4.02Å; I938-D945 HydrophobicContact CG2-CB 3.79Å; I938-L950 VanDerWaalsContact CD1-C 3.5Å; I938-L950 HydrophobicContact CD1-CB 3.67Å; I938-L950 WeakPolarHBondContact CD1-O 3.39Å
939	I	91.7	Very high	84.2	Confident	77 Å²	77	63.7 Å²	63.7	40%	0.395	35%	0.347	S	S	.	.			trans	-97.6	120.1	179.7	-59.5	-178.5	0	0	0	108.2	G920 S942 D945	G920-I939 VanDerWaalsContact O-CB 3.3Å; G920-I939 WeakPolarHBondContact O-CB 3.39Å; G920-I939 WeakPolarHBondContact O-CG1 3.32Å; G920-I939 PolarHBondContact O-N 3.22Å; I939-S942 WeakPolarHBondContact O-CB 3.28Å; I939-S942 PolarHBondContact O-N 3.18Å; I939-S942 PolarHBondContact O-OG 3.05Å; I939-D945 WeakPolarHBondContact O-CB 3.41Å
940	P	90.1	Very high	86	Confident	98 Å²	98	56.1 Å²	56.1	64%	0.636	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.9	139.9	179.8	-28.3	36.1	0	0	0	113.3	S942 D945	P940-S942 PolarHBondContact O-N 3.36Å; P940-D945 WeakPolarHBondContact CA-OD2 3.23Å
941	G	89.2	Confident	87.8	Confident	49 Å²	49	53.9 Å²	53.9	51%	0.505	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	74.8	3.3	180	0	0	0	0	0	115.5	D945 K946	G941-D945 PolarHBondContact N-OD2 2.84Å; G941-K946 WeakPolarHBondContact O-CE 3.37Å; G941-K946 PolarHBondContact O-NZ 3.02Å
942	S	93.5	Very high	89.2	Confident	9 Å²	9	53.1 Å²	53.1	6%	0.063	30%	0.304	C	S	.	.	S	Bend	trans	-91.6	170.1	179.7	76.2	0	0	0	0	113	G920 I939 P940 A944 D945 K946	G920-S942 WeakPolarHBondContact CA-OG 3.39Å; G920-S942 PolarHBondContact O-OG 2.87Å; I939-S942 WeakPolarHBondContact O-CB 3.28Å; I939-S942 PolarHBondContact O-N 3.18Å; I939-S942 PolarHBondContact O-OG 3.05Å; P940-S942 PolarHBondContact O-N 3.36Å; S942-A944 VanDerWaalsContact C-N 3.3Å; S942-A944 PolarHBondContact O-N 3.31Å; S942-D945 WeakPolarHBondContact O-CB 3.21Å; S942-D945 PolarHBondContact O-N 3.23Å; S942-K946 WeakPolarHBondContact O-CB 3.46Å; S942-K946 VanDerWaalsContact O-CG 3.24Å; S942-K946 WeakPolarHBondContact O-CG 3.42Å; S942-K946 PolarHBondContact O-N 2.9Å
943	P	93.4	Very high	90.1	Very high	5 Å²	5	52.6 Å²	52.6	3%	0.032	30%	0.302	C	S	.	.	H	α-helix	trans	-50.7	-42.4	175	-32.9	40.2	0	0	0	115.2	L912 K913 E917 G918 D945 C947	L912-P943 VanDerWaalsContact O-CB 3.3Å; L912-P943 WeakPolarHBondContact O-CB 3.47Å; L912-P943 WeakPolarHBondContact O-CG 3.36Å; K913-P943 HydrophobicContact CB-CB 4.35Å; K913-P943 HydrophobicContact CB-CG 3.58Å; E917-P943 HydrophobicContact CG-CG 4.12Å; E917-P943 WeakPolarHBondContact OE1-CG 3.4Å; E917-P943 WeakPolarHBondContact OE2-CD 3.29Å; G918-P943 WeakPolarHBondContact O-CD 3.5Å; P943-D945 VanDerWaalsContact C-N 3.26Å; P943-D945 PolarHBondContact O-N 3.3Å; P943-C947 WeakPolarHBondContact O-CB 3.32Å; P943-C947 PolarHBondContact O-N 3.11Å
944	A	94.3	Very high	90.3	Very high	1 Å²	1	53 Å²	53	1%	0.008	30%	0.303	C	S	.	.	H	α-helix	trans	-65.2	-29.1	177.4	0	0	0	0	0	113.3	L911 F919 F921 I938 S942 C947 L950	L911-A944 HydrophobicContact CD1-CB 4.23Å; F919-A944 WeakPolarHBondContact O-CB 3.05Å; F919-A944 PolarHBondContact O-N 2.81Å; F921-A944 HydrophobicContact CB-CB 3.84Å; F921-A944 HydrophobicContact CD1-CB 4.05Å; F921-A944 HydrophobicContact CG-CB 4.35Å; I938-A944 HydrophobicContact CG2-CB 4.02Å; S942-A944 VanDerWaalsContact C-N 3.3Å; S942-A944 PolarHBondContact O-N 3.31Å; A944-C947 PolarHBondContact O-SG 3.03Å; A944-L950 HydrophobicContact CB-CD1 3.75Å
945	D	93.9	Very high	90.3	Very high	76 Å²	76	56.3 Å²	56.3	41%	0.406	32%	0.315	S	S	.	.	H	α-helix	trans	-82	-51.1	176.5	-164.2	56.7	0	0	0	110.3	I938 I939 P940 G941 S942 P943 C947 G948	I938-D945 HydrophobicContact CG2-CB 3.79Å; I939-D945 WeakPolarHBondContact O-CB 3.41Å; P940-D945 WeakPolarHBondContact CA-OD2 3.23Å; G941-D945 PolarHBondContact N-OD2 2.84Å; S942-D945 WeakPolarHBondContact O-CB 3.21Å; S942-D945 PolarHBondContact O-N 3.23Å; P943-D945 VanDerWaalsContact C-N 3.26Å; P943-D945 PolarHBondContact O-N 3.3Å; D945-C947 PolarHBondContact O-N 3.44Å; D945-C947 VanDerWaalsContact O-N 3.12Å; D945-G948 PolarHBondContact O-N 3.34Å; D945-G948 VanDerWaalsContact O-N 3.11Å
946	K	90.7	Very high	90.3	Very high	136 Å²	136	56.3 Å²	56.3	59%	0.591	32%	0.315	S	S	*	.	H	α-helix	trans	-52	-32.7	175.7	-70.6	163.2	177.1	158.3	0	113.2	E917 G941 S942 G948	E917-K946 IonicContact OE1-NZ 3.48Å; E917-K946 IonicContact OE2-NZ 3.54Å; E917-K946 PolarHBondContact OE2-NZ 3.01Å; E917-K946 VanDerWaalsContact OE2-NZ 3.1Å; G941-K946 WeakPolarHBondContact O-CE 3.37Å; G941-K946 PolarHBondContact O-NZ 3.02Å; S942-K946 WeakPolarHBondContact O-CB 3.46Å; S942-K946 VanDerWaalsContact O-CG 3.24Å; S942-K946 WeakPolarHBondContact O-CG 3.42Å; S942-K946 PolarHBondContact O-N 2.9Å; K946-G948 PolarHBondContact O-N 3.13Å
947	C	90.4	Very high	90.2	Very high	31 Å²	31	57.6 Å²	57.6	21%	0.209	31%	0.313	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76	-16.7	-177.5	81.8	0	0	0	0	114.9	L911 P943 A944 D945 Q949	L911-C947 HydrophobicContact CD2-CB 3.74Å; L911-C947 WeakPolarHBondContact CD2-SG 3.47Å; P943-C947 WeakPolarHBondContact O-CB 3.32Å; P943-C947 PolarHBondContact O-N 3.11Å; A944-C947 PolarHBondContact O-SG 3.03Å; D945-C947 PolarHBondContact O-N 3.44Å; D945-C947 VanDerWaalsContact O-N 3.12Å; C947-Q949 PolarHBondContact O-N 3.37Å
948	G	88.1	Confident	90	Very high	61 Å²	61	50.8 Å²	50.8	63%	0.629	29%	0.289	S	S	*	.	S	Bend	trans	63.8	-12.4	178.3	0	0	0	0	0	117.7	D945 K946	D945-G948 PolarHBondContact O-N 3.34Å; D945-G948 VanDerWaalsContact O-N 3.11Å; K946-G948 PolarHBondContact O-N 3.13Å
949	Q	87.1	Confident	89.8	Confident	99 Å²	99	49.5 Å²	49.5	46%	0.463	28%	0.282	S	S	.	.			trans	-88.8	-21.6	-174.1	-71	167.7	74.1	0	0	113.5	V909 C947 Q954	V909-Q949 HydrophobicContact CG1-CB 3.83Å; V909-Q949 HydrophobicContact CG2-CB 3.86Å; C947-Q949 PolarHBondContact O-N 3.37Å; Q949-Q954 PolarHBondContact O-NE2 3.38Å
950	L	90.8	Very high	89.5	Confident	11 Å²	11	48.1 Å²	48.1	6%	0.058	28%	0.275	C	S	.	.			trans	-86	142.7	-179.6	-60.4	-172.3	0	0	0	112.1	V909 L911 I935 I938 A944 Q954 L985 I987	V909-L950 HydrophobicContact CB-CD2 3.97Å; V909-L950 HydrophobicContact CG1-CD2 3.76Å; V909-L950 HydrophobicContact CG1-CG 4.09Å; V909-L950 HydrophobicContact CG2-CD2 4.04Å; L911-L950 HydrophobicContact CD1-CD1 3.95Å; L911-L950 HydrophobicContact CD2-CD1 3.94Å; L911-L950 HydrophobicContact CG-CD1 4.39Å; I935-L950 HydrophobicContact CD1-CB 4.15Å; I935-L950 HydrophobicContact CD1-CD1 4.28Å; I935-L950 HydrophobicContact CD1-CD2 3.83Å; I935-L950 HydrophobicContact CD1-CG 4.31Å; I938-L950 VanDerWaalsContact CD1-C 3.5Å; I938-L950 HydrophobicContact CD1-CB 3.67Å; I938-L950 WeakPolarHBondContact CD1-O 3.39Å; A944-L950 HydrophobicContact CB-CD1 3.75Å; L950-Q954 VanDerWaalsContact CA-OE1 3.31Å; L950-L985 HydrophobicContact CD1-CD1 3.96Å; L950-L985 HydrophobicContact CD2-CD1 4.15Å; L950-I987 HydrophobicContact CD2-CD1 3.17Å
951	K	89.2	Confident	88.9	Confident	137 Å²	137	44 Å²	44	60%	0.596	25%	0.251	S	S	*	.			trans	-139.1	147	175.7	-62.6	-175.6	-179.1	179.7	0	110.7	Q954	K951-Q954 HydrophobicContact CB-CG 4.17Å; K951-Q954 WeakPolarHBondContact O-CB 2.99Å; K951-Q954 PolarHBondContact O-N 2.92Å
952	V	89.2	Confident	88.4	Confident	62 Å²	62	44 Å²	44	38%	0.376	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62	137.1	171.4	177.5	0	0	0	0	109.4	I935	I935-V952 CarbonylContact O-C 3.57Å; I935-V952 VanDerWaalsContact O-CA 3.26Å; I935-V952 WeakPolarHBondContact O-CA 3.34Å; I935-V952 WeakPolarHBondContact O-CG1 3.29Å
953	G	84.8	Confident	87.8	Confident	20 Å²	20	46.6 Å²	46.6	21%	0.206	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	87.1	-5	-174.6	0	0	0	0	0	115.5	I935	I935-G953 PolarHBondContact O-N 3.26Å
954	Q	89.1	Confident	87.2	Confident	13 Å²	13	46.7 Å²	46.7	6%	0.061	25%	0.254	C	S	.	.			trans	-68.2	136.2	171.9	-83.7	174	-21.8	0	0	111.5	E934 I935 Q949 L950 K951 I987	E934-Q954 WeakPolarHBondContact CA-O 3.3Å; I935-Q954 HydrophobicContact CD1-CB 4.16Å; I935-Q954 HydrophobicContact CG1-CB 4.5Å; I935-Q954 PolarHBondContact N-O 3.48Å; Q949-Q954 PolarHBondContact O-NE2 3.38Å; L950-Q954 VanDerWaalsContact CA-OE1 3.31Å; K951-Q954 HydrophobicContact CB-CG 4.17Å; K951-Q954 WeakPolarHBondContact O-CB 2.99Å; K951-Q954 PolarHBondContact O-N 2.92Å; Q954-I987 HydrophobicContact CB-CG2 3.83Å; Q954-I987 HydrophobicContact CG-CG2 3.95Å
955	R	88.8	Confident	86.3	Confident	84 Å²	84	52.7 Å²	52.7	32%	0.317	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	122.3	175.9	-64.7	-167.4	-67.1	-138.2	6.2	110.3	A932 E934 I987 E988	A932-R955 HydrophobicContact CB-CB 4.22Å; A932-R955 HydrophobicContact CB-CG 4.48Å; E934-R955 HydrophobicContact CG-CG 3.74Å; R955-I987 WeakPolarHBondContact O-CA 3.43Å; R955-E988 HydrophobicContact CB-CB 4.28Å; R955-E988 IonicContact CZ-OE1 3.58Å; R955-E988 IonicContact CZ-OE2 3.1Å; R955-E988 IonicContact NE-OE2 3.47Å; R955-E988 PolarHBondContact NE-OE2 2.76Å; R955-E988 IonicContact NH2-OE1 3.48Å; R955-E988 PolarHBondContact NH2-OE1 2.8Å; R955-E988 IonicContact NH2-OE2 3.62Å; R955-E988 PolarHBondContact NH2-OE2 2.84Å; R955-E988 PolarHBondContact O-N 3.46Å
956	I	89.9	Confident	85	Confident	0 Å²	0	52 Å²	52	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	114.7	174.8	-47.1	171.8	0	0	0	107.4	F921 I923 S933 I935 I959 L964 L985 I987	F921-I956 HydrophobicContact CE2-CD1 4.06Å; I923-I956 HydrophobicContact CD1-CD1 3.66Å; I923-I956 HydrophobicContact CG1-CD1 3.79Å; S933-I956 WeakPolarHBondContact O-CB 3.37Å; S933-I956 PolarHBondContact O-N 3.38Å; I935-I956 HydrophobicContact CD1-CG1 4.49Å; I935-I956 HydrophobicContact CG1-CD1 3.87Å; I935-I956 HydrophobicContact CG1-CG1 3.9Å; I956-I959 HydrophobicContact CG2-CG1 4.19Å; I956-L964 HydrophobicContact CB-CD1 3.92Å; I956-L964 HydrophobicContact CG2-CD1 3.58Å; I956-L985 HydrophobicContact CG2-CD2 4.19Å; I956-I987 HydrophobicContact CG1-CG1 4.36Å
957	M	86.2	Confident	84.3	Confident	61 Å²	61	47.1 Å²	47.1	30%	0.3	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.2	-37.7	179.2	-60.3	-177.4	74.3	0	0	111.7	I893 I906 C963 L964 T986 E988	I893-M957 HydrophobicContact CD1-CE 4.06Å; I906-M957 HydrophobicContact CD1-CE 4.21Å; I906-M957 HydrophobicContact CD1-SD 3.87Å; I906-M957 HydrophobicContact CG1-SD 4.05Å; M957-C963 WeakPolarHBondContact O-CA 3.31Å; M957-L964 PolarHBondContact O-N 2.8Å; M957-T986 HydrophobicContact CB-CG2 4.34Å; M957-T986 PolarHBondContact N-O 3.48Å; M957-E988 HydrophobicContact CG-CB 4.27Å; M957-E988 HydrophobicContact SD-CB 3.96Å; M957-E988 HydrophobicContact SD-CG 4.41Å
958	A	86.7	Confident	83.7	Confident	8 Å²	8	47.8 Å²	47.8	7%	0.066	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	156.3	177.6	0	0	0	0	0	113.2	Y962 T986	A958-Y962 CarbonylContact C-O 3.54Å; A958-Y962 WeakPolarHBondContact CA-O 3.47Å; A958-Y962 WeakPolarHBondContact CB-O 3.47Å; A958-T986 PolarHBondContact N-O 3.22Å; A958-T986 PolarHBondContact O-N 3.24Å
959	I	88.4	Confident	83.5	Confident	1 Å²	1	48.6 Å²	48.6	1%	0.005	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	119.1	172	-73.6	160.2	0	0	0	108.4	I923 I956 G961 Y962 L964 I972 L975 I976 L983 I984 L985	I923-I959 HydrophobicContact CD1-CD1 4.44Å; I956-I959 HydrophobicContact CG2-CG1 4.19Å; I959-G961 PolarHBondContact O-N 3.42Å; I959-Y962 PolarHBondContact N-O 3.07Å; I959-Y962 VanDerWaalsContact O-CB 3.24Å; I959-Y962 WeakPolarHBondContact O-CB 3.38Å; I959-Y962 PolarHBondContact O-N 2.71Å; I959-L964 HydrophobicContact CB-CD2 4.08Å; I959-L964 HydrophobicContact CD1-CD1 3.67Å; I959-L964 HydrophobicContact CD1-CD2 3.74Å; I959-L964 HydrophobicContact CD1-CG 4.33Å; I959-L964 HydrophobicContact CG1-CD1 4.03Å; I959-L964 HydrophobicContact CG1-CD2 3.99Å; I959-L964 HydrophobicContact CG1-CG 4.47Å; I959-I972 HydrophobicContact CD1-CG2 3.8Å; I959-L975 HydrophobicContact CG2-CB 3.97Å; I959-I976 HydrophobicContact CD1-CD1 3.82Å; I959-I976 HydrophobicContact CD1-CG1 3.76Å; I959-I976 HydrophobicContact CG2-CG1 4.39Å; I959-L983 HydrophobicContact CG2-CD1 3.62Å; I959-I984 WeakPolarHBondContact CA-O 3.2Å; I959-L985 HydrophobicContact CG1-CD2 3.71Å
960	N	86.4	Confident	83.3	Confident	48 Å²	48	48.4 Å²	48.4	26%	0.257	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.2	42.9	-172	-54	-20.8	0	0	0	111.8	Q817 Y962 S979 I984	Q817-N960 VanDerWaalsContact O-O 3.07Å; N960-Y962 PolarHBondContact O-N 3.06Å; N960-S979 PolarHBondContact ND2-OG 3.37Å; N960-I984 PolarHBondContact N-O 3.28Å; N960-I984 PolarHBondContact OD1-N 2.94Å
961	G	77.1	Confident	82.9	Confident	11 Å²	11	51.3 Å²	51.3	11%	0.113	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	-18.6	-174.3	0	0	0	0	0	116.3	Q817 I959 C963	Q817-G961 VanDerWaalsContact CG-CA 3.5Å; I959-G961 PolarHBondContact O-N 3.42Å; G961-C963 PolarHBondContact O-N 2.8Å; G961-C963 VanDerWaalsContact O-N 3.14Å
962	Y	78.7	Confident	82.8	Confident	49 Å²	49	44.8 Å²	44.8	19%	0.192	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	110.4	177.1	-162.1	-67.8	0	0	0	110.5	R880 A958 I959 N960 L964 I967 L975	R880-Y962 PolarHBondContact NH1-OH 3.06Å; A958-Y962 CarbonylContact C-O 3.54Å; A958-Y962 WeakPolarHBondContact CA-O 3.47Å; A958-Y962 WeakPolarHBondContact CB-O 3.47Å; I959-Y962 PolarHBondContact N-O 3.07Å; I959-Y962 VanDerWaalsContact O-CB 3.24Å; I959-Y962 WeakPolarHBondContact O-CB 3.38Å; I959-Y962 PolarHBondContact O-N 2.71Å; N960-Y962 PolarHBondContact O-N 3.06Å; Y962-L964 WeakPolarHBondContact O-CD2 3.29Å; Y962-I967 HydrophobicContact CD1-CD1 3.56Å; Y962-I967 HydrophobicContact CE1-CD1 3.39Å; Y962-I967 HydrophobicContact CE1-CG1 4.11Å; Y962-L975 HydrophobicContact CD1-CD1 3.85Å; Y962-L975 HydrophobicContact CD2-CD2 4.34Å; Y962-L975 HydrophobicContact CG-CD1 3.99Å; Y962-L975 HydrophobicContact CG-CD2 4.27Å
963	C	80.2	Confident	82.8	Confident	65 Å²	65	43.4 Å²	43.4	44%	0.439	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-62	131.5	180	-178	0	0	0	0	112.1	M957 G961 I967	M957-C963 WeakPolarHBondContact O-CA 3.31Å; G961-C963 PolarHBondContact O-N 2.8Å; G961-C963 VanDerWaalsContact O-N 3.14Å; C963-I967 WeakPolarHBondContact O-CD1 3.46Å
964	L	80.9	Confident	82.9	Confident	7 Å²	7	45 Å²	45	4%	0.037	25%	0.248	C	C	.	.			trans	-87.7	-0.6	-173.6	-53.3	-167.1	0	0	0	115	I956 M957 I959 Y962 G966 I967 I972 L975	I956-L964 HydrophobicContact CB-CD1 3.92Å; I956-L964 HydrophobicContact CG2-CD1 3.58Å; M957-L964 PolarHBondContact O-N 2.8Å; I959-L964 HydrophobicContact CB-CD2 4.08Å; I959-L964 HydrophobicContact CD1-CD1 3.67Å; I959-L964 HydrophobicContact CD1-CD2 3.74Å; I959-L964 HydrophobicContact CD1-CG 4.33Å; I959-L964 HydrophobicContact CG1-CD1 4.03Å; I959-L964 HydrophobicContact CG1-CD2 3.99Å; I959-L964 HydrophobicContact CG1-CG 4.47Å; Y962-L964 WeakPolarHBondContact O-CD2 3.29Å; L964-G966 PolarHBondContact O-N 3.03Å; L964-I967 HydrophobicContact CB-CD1 4.45Å; L964-I967 HydrophobicContact CD2-CD1 3.81Å; L964-I967 PolarHBondContact O-N 2.96Å; L964-I972 HydrophobicContact CB-CD1 4.45Å; L964-I972 HydrophobicContact CD1-CG2 4.31Å; L964-I972 HydrophobicContact CD2-CG1 4.4Å; L964-L975 HydrophobicContact CD2-CD1 4.38Å
965	L	74.8	Confident	82.8	Confident	126 Å²	126	45.6 Å²	45.6	66%	0.66	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	128.8	-178.3	-166.8	65.5	0	0	0	110.6	I967	L965-I967 PolarHBondContact O-N 3.12Å; L965-I967 VanDerWaalsContact O-N 3.12Å
966	G	67.4	Low	82.9	Confident	63 Å²	63	43 Å²	43	65%	0.649	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.3	-5.4	179.6	0	0	0	0	0	116.8	L964	L964-G966 PolarHBondContact O-N 3.03Å
967	I	75.9	Confident	82.7	Confident	32 Å²	32	50.4 Å²	50.4	16%	0.164	27%	0.271	C	S	.	.			trans	-71.2	141.8	175	-40.9	179.8	0	0	0	110.3	Y962 C963 L964 L965 D971 I972 L975	Y962-I967 HydrophobicContact CD1-CD1 3.56Å; Y962-I967 HydrophobicContact CE1-CD1 3.39Å; Y962-I967 HydrophobicContact CE1-CG1 4.11Å; C963-I967 WeakPolarHBondContact O-CD1 3.46Å; L964-I967 HydrophobicContact CB-CD1 4.45Å; L964-I967 HydrophobicContact CD2-CD1 3.81Å; L964-I967 PolarHBondContact O-N 2.96Å; L965-I967 PolarHBondContact O-N 3.12Å; L965-I967 VanDerWaalsContact O-N 3.12Å; I967-D971 HydrophobicContact CG2-CB 3.6Å; I967-I972 HydrophobicContact CB-CD1 4.1Å; I967-I972 HydrophobicContact CB-CG1 3.82Å; I967-I972 HydrophobicContact CD1-CG1 4.17Å; I967-I972 HydrophobicContact CG2-CG1 3.85Å; I967-L975 HydrophobicContact CD1-CD1 4.07Å
968	N	78.3	Confident	82.5	Confident	46 Å²	46	51.7 Å²	51.7	25%	0.246	28%	0.277	C	S	.	.			trans	-74.6	156.4	167.7	77.3	79.4	0	0	0	112.3	M970 D971 I972	N968-M970 VanDerWaalsContact C-N 3.25Å; N968-M970 PolarHBondContact O-N 2.92Å; N968-M970 VanDerWaalsContact O-N 3.12Å; N968-M970 VanDerWaalsContact OD1-CB 3.29Å; N968-M970 WeakPolarHBondContact OD1-CB 3.32Å; N968-M970 PolarHBondContact OD1-N 3.1Å; N968-D971 PolarHBondContact ND2-OD2 3.14Å; N968-D971 PolarHBondContact O-N 2.82Å; N968-D971 PolarHBondContact OD1-N 2.76Å; N968-I972 PolarHBondContact O-N 3.11Å
969	H	84.1	Confident	82.1	Confident	77 Å²	77	51.7 Å²	51.7	36%	0.356	28%	0.276	S	S	.	.	H	α-helix	trans	-55.5	-31.9	-176.6	-174.1	67	0	0	0	115.2	I923 S925 V973	I923-H969 PolarHBondContact O-CE1 3.07Å; S925-H969 WeakPolarHBondContact CB-ND1 3.28Å; S925-H969 PolarHBondContact OG-ND1 2.87Å; H969-V973 WeakPolarHBondContact O-CG2 3.1Å; H969-V973 PolarHBondContact O-N 2.93Å; H969-V973 VanDerWaalsContact O-N 3.09Å
970	M	83.1	Confident	81.6	Confident	95 Å²	95	58.9 Å²	58.9	47%	0.468	31%	0.31	S	S	.	.	H	α-helix	trans	-69.3	-42.6	-177.2	-168.9	64.1	66.1	0	0	111.4	N968 V973 N974	N968-M970 VanDerWaalsContact C-N 3.25Å; N968-M970 PolarHBondContact O-N 2.92Å; N968-M970 VanDerWaalsContact O-N 3.12Å; N968-M970 VanDerWaalsContact OD1-CB 3.29Å; N968-M970 WeakPolarHBondContact OD1-CB 3.32Å; N968-M970 PolarHBondContact OD1-N 3.1Å; M970-V973 CarbonylContact O-C 3.54Å; M970-V973 WeakPolarHBondContact O-CB 3.46Å; M970-V973 PolarHBondContact O-N 3.23Å; M970-N974 PolarHBondContact O-N 2.73Å; M970-N974 PolarHBondContact O-ND2 3.06Å
971	D	82.6	Confident	81.5	Confident	73 Å²	73	58.4 Å²	58.4	39%	0.39	31%	0.306	S	S	.	.	H	α-helix	trans	-73.8	-32	-178.3	-62.6	-35.5	0	0	0	111.8	I967 N968 V973 N974 L975	I967-D971 HydrophobicContact CG2-CB 3.6Å; N968-D971 PolarHBondContact ND2-OD2 3.14Å; N968-D971 PolarHBondContact O-N 2.82Å; N968-D971 PolarHBondContact OD1-N 2.76Å; D971-V973 VanDerWaalsContact C-N 3.34Å; D971-V973 PolarHBondContact O-N 2.71Å; D971-N974 WeakPolarHBondContact O-CB 3.26Å; D971-N974 PolarHBondContact O-N 3.1Å; D971-N974 VanDerWaalsContact O-N 3.13Å; D971-N974 PolarHBondContact OD1-ND2 3.01Å; D971-L975 WeakPolarHBondContact O-CG 3.47Å; D971-L975 PolarHBondContact O-N 3.4Å
972	I	87.3	Confident	82	Confident	0 Å²	0	61.1 Å²	61.1	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-58.5	-46	167.4	-64.1	175.6	0	0	0	110.7	I923 S933 I959 L964 I967 N968 N974 L975 I976	I923-I972 HydrophobicContact CD1-CG2 3.71Å; S933-I972 VanDerWaalsContact OG-CD1 3.23Å; S933-I972 WeakPolarHBondContact OG-CD1 3.22Å; I959-I972 HydrophobicContact CD1-CG2 3.8Å; L964-I972 HydrophobicContact CB-CD1 4.45Å; L964-I972 HydrophobicContact CD1-CG2 4.31Å; L964-I972 HydrophobicContact CD2-CG1 4.4Å; I967-I972 HydrophobicContact CB-CD1 4.1Å; I967-I972 HydrophobicContact CB-CG1 3.82Å; I967-I972 HydrophobicContact CD1-CG1 4.17Å; I967-I972 HydrophobicContact CG2-CG1 3.85Å; N968-I972 PolarHBondContact O-N 3.11Å; I972-N974 VanDerWaalsContact C-N 3.3Å; I972-N974 PolarHBondContact O-N 2.76Å; I972-L975 PolarHBondContact O-N 3.18Å; I972-I976 HydrophobicContact CG2-CD1 4.38Å; I972-I976 WeakPolarHBondContact O-CD1 3.39Å; I972-I976 WeakPolarHBondContact O-CG1 3.37Å; I972-I976 PolarHBondContact O-N 3.45Å
973	V	88.7	Confident	82.7	Confident	33 Å²	33	58.8 Å²	58.8	20%	0.2	31%	0.306	C	S	.	.	H	α-helix	trans	-65.6	-32.4	174.8	167.8	0	0	0	0	111.9	H969 M970 D971 I976 R977	H969-V973 WeakPolarHBondContact O-CG2 3.1Å; H969-V973 PolarHBondContact O-N 2.93Å; H969-V973 VanDerWaalsContact O-N 3.09Å; M970-V973 CarbonylContact O-C 3.54Å; M970-V973 WeakPolarHBondContact O-CB 3.46Å; M970-V973 PolarHBondContact O-N 3.23Å; D971-V973 VanDerWaalsContact C-N 3.34Å; D971-V973 PolarHBondContact O-N 2.71Å; V973-I976 PolarHBondContact O-N 3.33Å; V973-R977 HydrophobicContact CG1-CG 4.49Å; V973-R977 VanDerWaalsContact O-CG 3.27Å; V973-R977 WeakPolarHBondContact O-CG 3.39Å; V973-R977 PolarHBondContact O-N 3.11Å
974	N	86.7	Confident	83.1	Confident	52 Å²	52	57.1 Å²	57.1	28%	0.278	29%	0.293	S	S	.	.	H	α-helix	trans	-70	-42.1	176.6	-68.3	-29.7	0	0	0	112.5	M970 D971 I972 I976 R977 Q978	M970-N974 PolarHBondContact O-N 2.73Å; M970-N974 PolarHBondContact O-ND2 3.06Å; D971-N974 WeakPolarHBondContact O-CB 3.26Å; D971-N974 PolarHBondContact O-N 3.1Å; D971-N974 VanDerWaalsContact O-N 3.13Å; D971-N974 PolarHBondContact OD1-ND2 3.01Å; I972-N974 VanDerWaalsContact C-N 3.3Å; I972-N974 PolarHBondContact O-N 2.76Å; N974-I976 VanDerWaalsContact C-N 3.25Å; N974-I976 PolarHBondContact O-N 3.13Å; N974-R977 PolarHBondContact O-N 3.47Å; N974-R977 VanDerWaalsContact O-N 3.08Å; N974-Q978 VanDerWaalsContact O-CG 3.3Å; N974-Q978 WeakPolarHBondContact O-CG 3.32Å; N974-Q978 PolarHBondContact O-N 3.29Å
975	L	86.8	Confident	83.6	Confident	26 Å²	26	56.8 Å²	56.8	14%	0.136	29%	0.291	C	S	.	.	H	α-helix	trans	-56.4	-39.7	173.2	-70.5	166.9	0	0	0	111.8	I959 Y962 L964 I967 D971 I972 S979	I959-L975 HydrophobicContact CG2-CB 3.97Å; Y962-L975 HydrophobicContact CD1-CD1 3.85Å; Y962-L975 HydrophobicContact CD2-CD2 4.34Å; Y962-L975 HydrophobicContact CG-CD1 3.99Å; Y962-L975 HydrophobicContact CG-CD2 4.27Å; L964-L975 HydrophobicContact CD2-CD1 4.38Å; I967-L975 HydrophobicContact CD1-CD1 4.07Å; D971-L975 WeakPolarHBondContact O-CG 3.47Å; D971-L975 PolarHBondContact O-N 3.4Å; I972-L975 PolarHBondContact O-N 3.18Å; L975-S979 PolarHBondContact O-N 2.85Å; L975-S979 PolarHBondContact O-OG 3.47Å
976	I	90.7	Very high	84.3	Confident	29 Å²	29	51.7 Å²	51.7	15%	0.149	27%	0.265	C	S	.	.	H	α-helix	trans	-72.3	-33	177.3	-60.4	163.2	0	0	0	111.7	F919 F921 I923 I959 I972 V973 N974 S979 L983	F919-I976 HydrophobicContact CD2-CG2 3.89Å; F919-I976 HydrophobicContact CE2-CG2 4.33Å; F921-I976 HydrophobicContact CE2-CD1 4.49Å; F921-I976 HydrophobicContact CZ-CD1 4.15Å; I923-I976 HydrophobicContact CD1-CD1 3.34Å; I923-I976 HydrophobicContact CG1-CD1 4.43Å; I959-I976 HydrophobicContact CD1-CD1 3.82Å; I959-I976 HydrophobicContact CD1-CG1 3.76Å; I959-I976 HydrophobicContact CG2-CG1 4.39Å; I972-I976 HydrophobicContact CG2-CD1 4.38Å; I972-I976 WeakPolarHBondContact O-CD1 3.39Å; I972-I976 WeakPolarHBondContact O-CG1 3.37Å; I972-I976 PolarHBondContact O-N 3.45Å; V973-I976 PolarHBondContact O-N 3.33Å; N974-I976 VanDerWaalsContact C-N 3.25Å; N974-I976 PolarHBondContact O-N 3.13Å; I976-S979 WeakPolarHBondContact O-CB 3.49Å; I976-S979 PolarHBondContact O-N 2.7Å; I976-L983 HydrophobicContact CG1-CD1 4.25Å; I976-L983 HydrophobicContact CG2-CD2 4.15Å
977	R	86.3	Confident	85.4	Confident	157 Å²	157	48.7 Å²	48.7	59%	0.592	23%	0.234	S	C	*	.	H	α-helix	trans	-74.5	-32.3	175.6	-74.1	167.3	172.4	-177.6	-4.7	113.1	V973 N974 S979	V973-R977 HydrophobicContact CG1-CG 4.49Å; V973-R977 VanDerWaalsContact O-CG 3.27Å; V973-R977 WeakPolarHBondContact O-CG 3.39Å; V973-R977 PolarHBondContact O-N 3.11Å; N974-R977 PolarHBondContact O-N 3.47Å; N974-R977 VanDerWaalsContact O-N 3.08Å; R977-S979 PolarHBondContact O-N 3.48Å
978	Q	82	Confident	85.6	Confident	88 Å²	88	49.7 Å²	49.7	41%	0.411	24%	0.238	S	C	.	.	H	α-helix	trans	-66.8	-26.7	172.1	-72.2	164.4	-10.1	0	0	111.7	N974 Q980	N974-Q978 VanDerWaalsContact O-CG 3.3Å; N974-Q978 WeakPolarHBondContact O-CG 3.32Å; N974-Q978 PolarHBondContact O-N 3.29Å; Q978-Q980 PolarHBondContact O-N 2.91Å
979	S	78.4	Confident	85.1	Confident	7 Å²	7	51.7 Å²	51.7	5%	0.049	25%	0.245	C	C	.	.			trans	-73.8	83.5	175.3	-57.6	0	0	0	0	111.1	F919 N960 L975 I976 R977 Q981 Q982 L983	F919-S979 WeakPolarHBondContact CE2-O 3.24Å; F919-S979 WeakPolarHBondContact CZ-O 3.43Å; N960-S979 PolarHBondContact ND2-OG 3.37Å; L975-S979 PolarHBondContact O-N 2.85Å; L975-S979 PolarHBondContact O-OG 3.47Å; I976-S979 WeakPolarHBondContact O-CB 3.49Å; I976-S979 PolarHBondContact O-N 2.7Å; R977-S979 PolarHBondContact O-N 3.48Å; S979-Q981 PolarHBondContact O-N 2.78Å; S979-Q982 WeakPolarHBondContact CB-O 3.25Å; S979-L983 VanDerWaalsContact OG-CD1 3.24Å; S979-L983 WeakPolarHBondContact OG-CD1 3.22Å
980	Q	77.3	Confident	83.8	Confident	153 Å²	153	52.6 Å²	52.6	72%	0.715	26%	0.256	S	S	*	.	S	Bend	trans	-64.8	-40.5	-166.5	-61.5	-172.3	12.5	0	0	115.3	K913 Q978	K913-Q980 WeakPolarHBondContact CE-O 3.39Å; K913-Q980 PolarHBondContact NZ-O 3.38Å; Q978-Q980 PolarHBondContact O-N 2.91Å
981	Q	85.2	Confident	81.7	Confident	37 Å²	37	49.9 Å²	49.9	17%	0.173	25%	0.252	C	S	.	.	S	Bend	trans	-136.8	-30.9	-174.1	-157.7	178.2	-4	0	0	113.4	L912 K913 S979	L912-Q981 WeakPolarHBondContact CA-O 3.32Å; K913-Q981 PolarHBondContact N-O 2.84Å; K913-Q981 WeakPolarHBondContact O-CG 3.34Å; S979-Q981 PolarHBondContact O-N 2.78Å
982	Q	87.1	Confident	79.2	Confident	69 Å²	69	56.5 Å²	56.5	32%	0.322	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	140.9	173.4	-176.8	-177.6	-73.3	0	0	110	K910 L911 L912 S979	K910-Q982 HydrophobicContact CD-CG 4.36Å; K910-Q982 HydrophobicContact CG-CG 4.11Å; L911-Q982 WeakPolarHBondContact O-CA 3.48Å; L912-Q982 HydrophobicContact CD2-CB 3.83Å; L912-Q982 HydrophobicContact CD2-CG 3.91Å; S979-Q982 WeakPolarHBondContact CB-O 3.25Å
983	L	92.2	Very high	76.5	Confident	0 Å²	0	64 Å²	64	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	137	170.8	-179.7	76.1	0	0	0	108.8	K910 L911 F919 F921 I959 I976 S979 L985	K910-L983 WeakPolarHBondContact CA-O 3.35Å; L911-L983 HydrophobicContact CB-CB 4.43Å; L911-L983 HydrophobicContact CD1-CD2 4.27Å; L911-L983 PolarHBondContact N-O 3.06Å; L911-L983 PolarHBondContact O-N 3.3Å; F919-L983 HydrophobicContact CB-CD2 4.46Å; F919-L983 HydrophobicContact CD1-CB 3.98Å; F919-L983 HydrophobicContact CD1-CD2 4.41Å; F919-L983 HydrophobicContact CD2-CB 4.22Å; F919-L983 HydrophobicContact CD2-CD2 3.88Å; F919-L983 HydrophobicContact CE1-CB 3.56Å; F919-L983 HydrophobicContact CE2-CB 3.83Å; F919-L983 HydrophobicContact CE2-CD2 4.21Å; F919-L983 HydrophobicContact CE2-CG 4.47Å; F919-L983 HydrophobicContact CG-CB 4.3Å; F919-L983 HydrophobicContact CG-CD2 3.99Å; F919-L983 HydrophobicContact CZ-CB 3.49Å; F919-L983 VanDerWaalsContact CZ-CB 3.49Å; F921-L983 HydrophobicContact CE1-CD2 3.62Å; F921-L983 HydrophobicContact CZ-CD2 3.69Å; I959-L983 HydrophobicContact CG2-CD1 3.62Å; I976-L983 HydrophobicContact CG1-CD1 4.25Å; I976-L983 HydrophobicContact CG2-CD2 4.15Å; S979-L983 VanDerWaalsContact OG-CD1 3.24Å; S979-L983 WeakPolarHBondContact OG-CD1 3.22Å; L983-L985 HydrophobicContact CD2-CD1 4.48Å; L983-L985 HydrophobicContact CD2-CD2 3.77Å; L983-L985 HydrophobicContact CD2-CG 4.11Å; L983-L985 HydrophobicContact CG-CD2 4Å; L983-L985 HydrophobicContact CG-CG 4.34Å
984	I	89.8	Confident	73.5	Confident	29 Å²	29	67.3 Å²	67.3	15%	0.149	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	124.3	172.2	-58.7	173.6	0	0	0	108	E816 N908 I959 N960	E816-I984 WeakPolarHBondContact O-CD1 3.31Å; N908-I984 HydrophobicContact CB-CG2 4.27Å; I959-I984 WeakPolarHBondContact CA-O 3.2Å; N960-I984 PolarHBondContact N-O 3.28Å; N960-I984 PolarHBondContact OD1-N 2.94Å
985	L	92.1	Very high	70.5	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.1	114.2	174.8	-60.3	-179.3	0	0	0	109.6	V909 L911 F921 L950 I956 I959 L983 I987	V909-L985 PolarHBondContact N-O 2.8Å; V909-L985 PolarHBondContact O-N 3.43Å; L911-L985 HydrophobicContact CD1-CD1 4.29Å; F921-L985 HydrophobicContact CE1-CD1 4.12Å; F921-L985 HydrophobicContact CE2-CD1 3.98Å; F921-L985 HydrophobicContact CZ-CD1 3.72Å; F921-L985 HydrophobicContact CZ-CD2 4.07Å; F921-L985 HydrophobicContact CZ-CG 4.46Å; L950-L985 HydrophobicContact CD1-CD1 3.96Å; L950-L985 HydrophobicContact CD2-CD1 4.15Å; I956-L985 HydrophobicContact CG2-CD2 4.19Å; I959-L985 HydrophobicContact CG1-CD2 3.71Å; L983-L985 HydrophobicContact CD2-CD1 4.48Å; L983-L985 HydrophobicContact CD2-CD2 3.77Å; L983-L985 HydrophobicContact CD2-CG 4.11Å; L983-L985 HydrophobicContact CG-CD2 4Å; L983-L985 HydrophobicContact CG-CG 4.34Å; L985-I987 HydrophobicContact CB-CD1 3.69Å; L985-I987 HydrophobicContact CB-CG1 4.03Å; L985-I987 HydrophobicContact CD1-CD1 4.18Å
986	T	89.1	Confident	67.7	Low	20 Å²	20	80.5 Å²	80.5	12%	0.123	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	117.8	166.5	-55.3	0	0	0	0	107.8	I906 I907 N908 M957 A958	I906-T986 HydrophobicContact CG2-CG2 3.61Å; I907-T986 WeakPolarHBondContact O-CA 3.39Å; N908-T986 WeakPolarHBondContact OD1-CA 3.12Å; N908-T986 VanDerWaalsContact OD1-CB 3.28Å; N908-T986 WeakPolarHBondContact OD1-CB 3.4Å; N908-T986 WeakPolarHBondContact OD1-CG2 3.4Å; N908-T986 PolarHBondContact OD1-OG1 3.23Å; M957-T986 HydrophobicContact CB-CG2 4.34Å; M957-T986 PolarHBondContact N-O 3.48Å; A958-T986 PolarHBondContact N-O 3.22Å; A958-T986 PolarHBondContact O-N 3.24Å
987	I	89.8	Confident	64.6	Low	0 Å²	0	87.1 Å²	87.1	0%	0	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	137.4	-169.8	-76.2	164.8	0	0	0	109.8	I906 I907 V909 I935 L950 Q954 R955 I956 L985 K989	I906-I987 CarbonylContact C-O 3.54Å; I906-I987 WeakPolarHBondContact CA-O 3.47Å; I907-I987 HydrophobicContact CD1-CG2 4.27Å; I907-I987 HydrophobicContact CG1-CB 4.01Å; I907-I987 HydrophobicContact CG1-CG2 4.1Å; I907-I987 PolarHBondContact N-O 2.89Å; I907-I987 PolarHBondContact O-N 2.87Å; V909-I987 HydrophobicContact CG2-CD1 4.25Å; I935-I987 HydrophobicContact CD1-CD1 4.01Å; L950-I987 HydrophobicContact CD2-CD1 3.17Å; Q954-I987 HydrophobicContact CB-CG2 3.83Å; Q954-I987 HydrophobicContact CG-CG2 3.95Å; R955-I987 WeakPolarHBondContact O-CA 3.43Å; I956-I987 HydrophobicContact CG1-CG1 4.36Å; L985-I987 HydrophobicContact CB-CD1 3.69Å; L985-I987 HydrophobicContact CB-CG1 4.03Å; L985-I987 HydrophobicContact CD1-CD1 4.18Å; I987-K989 PolarHBondContact O-N 2.77Å
988	E	81.1	Confident	61.8	Low	53 Å²	53	88.9 Å²	88.9	25%	0.248	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.5	120.2	169.1	-163.1	-174.1	165.2	0	0	109.3	N905 R955 M957 T990	N905-E988 CarbonylContact O-C 3.58Å; N905-E988 WeakPolarHBondContact O-CA 3.4Å; R955-E988 HydrophobicContact CB-CB 4.28Å; R955-E988 IonicContact CZ-OE1 3.58Å; R955-E988 IonicContact CZ-OE2 3.1Å; R955-E988 IonicContact NE-OE2 3.47Å; R955-E988 PolarHBondContact NE-OE2 2.76Å; R955-E988 IonicContact NH2-OE1 3.48Å; R955-E988 PolarHBondContact NH2-OE1 2.8Å; R955-E988 IonicContact NH2-OE2 3.62Å; R955-E988 PolarHBondContact NH2-OE2 2.84Å; R955-E988 PolarHBondContact O-N 3.46Å; M957-E988 HydrophobicContact CG-CB 4.27Å; M957-E988 HydrophobicContact SD-CB 3.96Å; M957-E988 HydrophobicContact SD-CG 4.41Å; E988-T990 PolarHBondContact O-N 2.85Å
989	K	67.9	Low	59.2	Low	88 Å²	88	91.7 Å²	91.7	38%	0.383	47%	0.466	S	S	.	.			trans	-64.9	119.6	162.9	-72.7	170.5	177.5	113.5	0	107.3	S904 N905 I906 I907 I987 G991	S904-K989 VanDerWaalsContact O-CD 3.28Å; S904-K989 WeakPolarHBondContact O-CD 3.46Å; S904-K989 PolarHBondContact O-NZ 3.4Å; N905-K989 PolarHBondContact O-N 2.79Å; I906-K989 PolarHBondContact O-NZ 2.99Å; I907-K989 HydrophobicContact CD1-CG 4.4Å; I907-K989 HydrophobicContact CG1-CG 4.27Å; I907-K989 HydrophobicContact CG2-CD 4.09Å; I907-K989 HydrophobicContact CG2-CG 3.88Å; I987-K989 PolarHBondContact O-N 2.77Å; K989-G991 PolarHBondContact O-N 2.79Å
990	T	56.3	Low	56.7	Low	96 Å²	96	98.9 Å²	98.9	59%	0.589	50%	0.502	S	S	*	.			trans	-62.8	89.5	159.7	53.6	0	0	0	0	108.9	E988	E988-T990 PolarHBondContact O-N 2.85Å
991	G	39.2	Very low	54.3	Low	37 Å²	37	100.1 Å²	100.1	38%	0.381	51%	0.508	S	S	.	.			trans	-60.5	138	175	0	0	0	0	0	110.4	K989 L993	K989-G991 PolarHBondContact O-N 2.79Å; G991-L993 PolarHBondContact O-N 2.99Å
992	F	28.4	Very low	51.5	Low	213 Å²	213	104.6 Å²	104.6	93%	0.934	53%	0.531	S	S	*	.			trans	-72.1	73.6	172.3	-77.7	-96.5	0	0	0	109.7	S994	F992-S994 PolarHBondContact O-N 2.81Å
993	L	30.9	Very low	48.6	Very low	158 Å²	158	108.4 Å²	108.4	83%	0.827	55%	0.554	S	S	*	*			trans	-73	99.2	169.4	-76.1	176.4	0	0	0	108.9	G991	G991-L993 PolarHBondContact O-N 2.99Å
994	S	25.9	Very low	45.5	Very low	102 Å²	102	113.3 Å²	113.3	71%	0.713	59%	0.588	S	S	*	*			trans	-55	155.4	173	48.5	0	0	0	0	112.5	F992 K996	F992-S994 PolarHBondContact O-N 2.81Å; S994-K996 PolarHBondContact O-N 2.87Å
995	N	23.5	Very low	42.6	Very low	169 Å²	169	118.6 Å²	118.6	90%	0.904	62%	0.616	S	S	*	*			trans	-49.6	110.9	174.7	-67.6	-24.7	0	0	0	112
996	K	28	Very low	39.5	Very low	185 Å²	185	125.2 Å²	125.2	80%	0.804	65%	0.651	S	S	*	*			trans	-148.1	84.1	156.7	-114.7	169	-173	179.4	0	112.1	S994	S994-K996 PolarHBondContact O-N 2.87Å
997	Q	26.5	Very low	36.7	Very low	168 Å²	168	130.9 Å²	130.9	79%	0.785	69%	0.686	S	S	*	*			trans	40.9	107.1	142.8	-64.5	164.3	-28.2	0	0	118.3
998	H	27.1	Very low	33.9	Very low	195 Å²	195	138.2 Å²	138.2	90%	0.903	73%	0.726	S	S	*	*			trans	-116.2	38.9	142.4	-111.6	-45.9	0	0	0	111.4
999	N	27.4	Very low	31.3	Very low	146 Å²	146	143 Å²	143	78%	0.781	75%	0.748	S	S	*	*			trans	-80.2	119.4	162	-85	4.9	0	0	0	108.6	H1001	N999-H1001 PolarHBondContact O-N 3.19Å; N999-H1001 VanDerWaalsContact O-N 3.15Å
1000	I	26.1	Very low	29.7	Very low	158 Å²	158	145.7 Å²	145.7	81%	0.81	77%	0.766	S	S	*	*			trans	-69.2	106.8	164.3	-60.9	169.5	0	0	0	106.5
1001	H	27.7	Very low	28.4	Very low	180 Å²	180	149 Å²	149	83%	0.833	77%	0.773	S	S	*	*			trans	-137.5	137.2	166.5	-138.4	-89.3	0	0	0	110.6	N999	N999-H1001 PolarHBondContact O-N 3.19Å; N999-H1001 VanDerWaalsContact O-N 3.15Å
1002	I	26	Very low	28	Very low	130 Å²	130	154.1 Å²	154.1	67%	0.667	79%	0.79	S	S	*	*			trans	-98.3	126.9	-170.9	-67.1	170	0	0	0	109
1003	N	26	Very low	28	Very low	150 Å²	150	149.2 Å²	149.2	80%	0.802	78%	0.779	S	S	*	*			trans	62.8	147.8	162.6	-60.5	-7.5	0	0	0	120.4
1004	S	27.6	Very low	28.3	Very low	103 Å²	103	147.5 Å²	147.5	72%	0.72	78%	0.778	S	S	*	*			trans	99.8	96.8	145.4	-158.2	0	0	0	0	119.8
1005	L	28	Very low	28.3	Very low	140 Å²	140	146.7 Å²	146.7	73%	0.733	78%	0.778	S	S	*	*			trans	60.4	104.7	144.3	-80.7	70	0	0	0	120.3
1006	D	27.2	Very low	28.5	Very low	138 Å²	138	144.8 Å²	144.8	74%	0.738	77%	0.772	S	S	*	*				44.5	113.5	107.2	-42.9	-19.3	0	0	0	119.7
1007	T	31.1	Very low	28.4	Very low	140 Å²	140	140.5 Å²	140.5	86%	0.859	77%	0.765	S	S	*	*				-174.9	164.1	104.1	23.8	0	0	0	0	111.4
1008	D	30.2	Very low	28.3	Very low	154 Å²	154	138.4 Å²	138.4	82%	0.824	76%	0.764	S	S	*	*			trans	-91.9	155.3	-152	-66.3	-78.4	0	0	0	118.7
1009	E	27.4	Very low	28.2	Very low	154 Å²	154	136.9 Å²	136.9	72%	0.72	76%	0.759	S	S	*	*			trans	3.1	136.8	147.5	-66.8	-91.1	140.4	0	0	119.6
1010	N	32.8	Very low	28.2	Very low	143 Å²	143	136.7 Å²	136.7	77%	0.765	76%	0.757	S	S	*	*				-164.5	127	124.1	-104.6	-65.9	0	0	0	113.7
1011	F	29.3	Very low	28	Very low	165 Å²	165	134.4 Å²	134.4	72%	0.724	75%	0.754	S	S	*	*				40.2	129.7	124.5	-79.2	-112.4	0	0	0	118.9
1012	I	31.5	Very low	27.9	Very low	145 Å²	145	130.7 Å²	130.7	74%	0.744	75%	0.748	S	S	*	*			cis	-159.2	151.8	19	-80.2	134.1	0	0	0	110.8
1013	P	28.4	Very low	27.9	Very low	110 Å²	110	132.7 Å²	132.7	71%	0.714	76%	0.76	S	S	*	*			trans	-109.2	-176.3	164.9	41.3	-33.7	0	0	0	113.2
1014	P	36.3	Very low	28	Very low	122 Å²	122	130.1 Å²	130.1	79%	0.792	76%	0.76	S	S	*	*				-126.3	-175.5	-54.3	40.4	-26.5	0	0	0	111.5
1015	A	25.9	Very low	27.9	Very low	86 Å²	86	131.7 Å²	131.7	71%	0.711	77%	0.765	S	S	*	*			trans	167.3	153.2	133.3	0	0	0	0	0	116.7
1016	T	27.6	Very low	27.8	Very low	129 Å²	129	133.2 Å²	133.2	79%	0.791	77%	0.768	S	S	*	*			trans	67.6	121.9	150.8	29.2	0	0	0	0	123.8
1017	S	26.7	Very low	27.6	Very low	94 Å²	94	132.5 Å²	132.5	66%	0.657	77%	0.773	S	S	*	*				78.6	94	130	-61.2	0	0	0	0	123.3
1018	T	24.5	Very low	27.5	Very low	124 Å²	124	132.1 Å²	132.1	76%	0.761	77%	0.77	S	S	*	*				63.8	140.3	121.5	59.1	0	0	0	0	123.7
1019	M	24.9	Very low	27.3	Very low	163 Å²	163	132.9 Å²	132.9	80%	0.803	77%	0.768	S	S	*	*			trans	106	124.4	147	-71.5	-49.6	-178.2	0	0	121.5
1020	I	26.3	Very low	27.3	Very low	143 Å²	143	131.3 Å²	131.3	73%	0.733	77%	0.771	S	S	*	*			trans	77.2	102.9	139.3	-61.6	165.2	0	0	0	120.6
1021	C	22.3	Very low	26.9	Very low	110 Å²	110	129.9 Å²	129.9	74%	0.743	77%	0.768	S	S	*	*			trans	25.6	130.7	131.9	-60.6	0	0	0	0	124
1022	S	25.4	Very low	26.9	Very low	101 Å²	101	129.4 Å²	129.4	71%	0.706	77%	0.773	S	S	*	*				69.6	113.8	129.5	-56.1	0	0	0	0	121.2
1023	N	27.5	Very low	26.6	Very low	172 Å²	172	126.3 Å²	126.3	92%	0.92	78%	0.777	S	S	*	*				-168.5	172.2	97.2	-93.8	-24.3	0	0	0	111.6
1024	A	26.5	Very low	26.6	Very low	96 Å²	96	126.4 Å²	126.4	79%	0.793	78%	0.78	S	S	*	*			trans	-134.9	143.5	-179.5	0	0	0	0	0	111.3
1025	T	26.9	Very low	26	Very low	136 Å²	136	129.9 Å²	129.9	83%	0.834	78%	0.783	S	S	*	*			trans	-145.5	151.9	160.5	-26.3	0	0	0	0	111.1
1026	E	24.9	Very low	25.9	Very low	172 Å²	172	131.7 Å²	131.7	80%	0.804	79%	0.785	S	S	*	*			trans	-59.3	161.2	-170.2	-56.7	143.2	136.2	0	0	116.5
1027	C	24	Very low	26.2	Very low	123 Å²	123	131 Å²	131	83%	0.831	79%	0.785	S	S	*	*				-161.8	104.3	129.6	-113.3	0	0	0	0	114.4
1028	V	28.2	Very low	26.2	Very low	132 Å²	132	134.1 Å²	134.1	80%	0.8	79%	0.789	S	S	*	*			trans	53.7	121.7	132.3	-175.5	0	0	0	0	121.4
1029	H	25.5	Very low	26.5	Very low	171 Å²	171	134.6 Å²	134.6	79%	0.792	80%	0.795	S	S	*	*			trans	-81.6	157.9	159.4	-96.5	-78	0	0	0	112.6
1030	P	27.3	Very low	26.5	Very low	120 Å²	120	131.1 Å²	131.1	78%	0.779	79%	0.787	S	S	*	*				-134.3	-177.1	120.6	33.7	-20.7	0	0	0	114.3
1031	T	24.2	Very low	26.8	Very low	114 Å²	114	131.8 Å²	131.8	70%	0.699	79%	0.791	S	S	*	*			trans	-120.5	-178.6	-161.3	58.3	0	0	0	0	115.3
1032	N	29.3	Very low	27.1	Very low	155 Å²	155	132.7 Å²	132.7	83%	0.829	79%	0.788	S	S	*	*			trans	95.6	123.9	172.6	-45.3	-17	0	0	0	111.6
1033	G	25.7	Very low	27.1	Very low	79 Å²	79	135.3 Å²	135.3	81%	0.814	79%	0.794	S	S	*	*			cis	109.9	130.6	48	0	0	0	0	0	107.3
1034	S	28	Very low	27.2	Very low	112 Å²	112	133.6 Å²	133.6	78%	0.783	79%	0.79	S	S	*	*			cis	-162	160.6	8	61.2	0	0	0	0	111.7
1035	K	24.7	Very low	27.5	Very low	196 Å²	196	132.8 Å²	132.8	85%	0.852	78%	0.779	S	S	*	*			trans	18.3	135.8	157.5	-51.9	175.3	-177.2	174.4	0	118.6
1036	T	24.7	Very low	28	Very low	124 Å²	124	132 Å²	132	76%	0.761	77%	0.774	S	S	*	*				-174.8	160.5	66.7	-54.6	0	0	0	0	112.4
1037	S	32	Very low	29.5	Very low	114 Å²	114	130.1 Å²	130.1	80%	0.797	76%	0.759	S	S	*	*			trans	70.4	130.5	160.5	42	0	0	0	0	121
1038	E	28.2	Very low	31.5	Very low	159 Å²	159	127.3 Å²	127.3	74%	0.743	74%	0.741	S	S	*	*			trans	-87.7	173.4	171.2	-53.5	-176.5	150.9	0	0	112.2
1039	P	29.4	Very low	34.3	Very low	135 Å²	135	126.2 Å²	126.2	88%	0.877	73%	0.73	S	S	*	*				-127.7	150.1	99.6	37.2	-33.1	0	0	0	114.2
1040	S	25.5	Very low	37.4	Very low	90 Å²	90	120 Å²	120	63%	0.629	70%	0.7	S	S	*	*			trans	-97.6	143.7	-174.3	39.8	0	0	0	0	113.6
1041	L	33.8	Very low	40.4	Very low	156 Å²	156	116.5 Å²	116.5	82%	0.817	68%	0.679	S	S	*	*			trans	-148.7	90.4	175.9	-152.3	76.4	0	0	0	114.8
1042	N	27.9	Very low	43.8	Very low	129 Å²	129	111.2 Å²	111.2	69%	0.69	65%	0.646	S	S	*	*			trans	60.2	111.2	137.9	-54	-24.8	0	0	0	122.7
1043	N	26	Very low	46.9	Very low	157 Å²	157	107.5 Å²	107.5	84%	0.84	63%	0.629	S	S	*	*			trans	58.6	93	134.6	-65.8	-19.7	0	0	0	122
1044	T	29.5	Very low	50.2	Low	136 Å²	136	103.8 Å²	103.8	83%	0.834	59%	0.59	S	S	*	*			trans	-141.2	135.5	148.5	-46.4	0	0	0	0	110.7	T1046	T1044-T1046 PolarHBondContact O-N 3.37Å
1045	S	32.5	Very low	53.4	Low	78 Å²	78	103.8 Å²	103.8	55%	0.545	58%	0.578	S	S	.	*	P	Polyproline II helix	trans	-73.6	125.2	176.4	-69.4	0	0	0	0	111.4
1046	T	36.9	Very low	56.7	Low	119 Å²	119	100.5 Å²	100.5	73%	0.73	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-78.1	124.2	-175.2	44.6	0	0	0	0	112.4	T1044 N1134	T1044-T1046 PolarHBondContact O-N 3.37Å; T1046-N1134 PolarHBondContact O-ND2 2.92Å
1047	R	55.6	Low	59.9	Low	134 Å²	134	95.5 Å²	95.5	51%	0.506	53%	0.533	S	S	.	.	P	Polyproline II helix	trans	-96.4	126.6	159.2	-57.8	-171.6	-173	-175.3	-0.1	107.7	Q1131	R1047-Q1131 HydrophobicContact CB-CG 3.93Å
1048	S	67.7	Low	62.6	Low	63 Å²	63	96.6 Å²	96.6	44%	0.441	54%	0.538	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.5	126.9	177.9	44.9	0	0	0	0	111.7	Q1131 R1132	S1048-Q1131 WeakPolarHBondContact O-CA 3.17Å; S1048-R1132 PolarHBondContact O-N 3.32Å
1049	L	85.4	Confident	65.4	Low	110 Å²	110	96.7 Å²	96.7	58%	0.576	54%	0.543	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.7	139.9	167.6	-66.8	173.5	0	0	0	109.4	L1100 L1130 Q1131	L1049-L1100 HydrophobicContact CD2-CD1 3.32Å; L1049-L1130 WeakPolarHBondContact CA-O 3.47Å; L1049-Q1131 HydrophobicContact CD2-CB 4.07Å; L1049-Q1131 HydrophobicContact CD2-CG 4.34Å; L1049-Q1131 VanDerWaalsContact CD2-NE2 3.3Å
1050	Y	91.7	Very high	68.4	Low	40 Å²	40	91 Å²	91	16%	0.157	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.8	157.7	171.7	72.5	-77.2	0	0	0	110.9	I1052 Q1092 D1097 L1130 R1132	Y1050-I1052 HydrophobicContact CD2-CG2 3.81Å; Y1050-I1052 HydrophobicContact CE2-CG2 3.58Å; Y1050-Q1092 HydrophobicContact CE2-CB 4.04Å; Y1050-D1097 PolarHBondContact OH-OD2 3.44Å; Y1050-L1130 HydrophobicContact CD1-CB 4.13Å; Y1050-L1130 HydrophobicContact CE1-CB 3.57Å; Y1050-L1130 HydrophobicContact CE2-CB 4.3Å; Y1050-L1130 HydrophobicContact CE2-CD1 4.19Å; Y1050-L1130 PolarHBondContact N-O 2.76Å; Y1050-L1130 PolarHBondContact O-N 3.4Å; Y1050-R1132 PolarHBondContact OH-NH2 3.35Å; Y1050-R1132 VanDerWaalsContact OH-NH2 3.15Å
1051	S	90.8	Very high	71.7	Confident	47 Å²	47	87.3 Å²	87.3	33%	0.329	48%	0.482	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	139.2	178.8	-173.8	0	0	0	0	110.8	I1128	S1051-I1128 CarbonylContact C-O 3.54Å; S1051-I1128 WeakPolarHBondContact CA-O 3.32Å; S1051-I1128 WeakPolarHBondContact CB-O 3.33Å; S1051-I1128 PolarHBondContact OG-O 3.45Å
1052	I	93.8	Very high	74.6	Confident	3 Å²	3	80.3 Å²	80.3	2%	0.015	45%	0.448	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	156	175.2	71.1	177	0	0	0	110	Y1050 L1054 E1090 Q1092 M1093 R1127 I1128 L1130	Y1050-I1052 HydrophobicContact CD2-CG2 3.81Å; Y1050-I1052 HydrophobicContact CE2-CG2 3.58Å; I1052-L1054 HydrophobicContact CD1-CD1 3.97Å; I1052-L1054 HydrophobicContact CD1-CD2 4.08Å; I1052-L1054 HydrophobicContact CD1-CG 3.92Å; I1052-L1054 HydrophobicContact CG1-CG 4.3Å; I1052-E1090 VanDerWaalsContact CG2-OE1 3.26Å; I1052-E1090 WeakPolarHBondContact CG2-OE1 3.37Å; I1052-Q1092 HydrophobicContact CG2-CB 4.13Å; I1052-M1093 HydrophobicContact CD1-CB 4.08Å; I1052-M1093 HydrophobicContact CD1-CE 3.79Å; I1052-R1127 WeakPolarHBondContact O-CA 3.46Å; I1052-I1128 HydrophobicContact CD1-CD1 4.36Å; I1052-I1128 HydrophobicContact CG1-CB 4.09Å; I1052-I1128 HydrophobicContact CG1-CD1 4.45Å; I1052-I1128 HydrophobicContact CG1-CG1 4.36Å; I1052-I1128 PolarHBondContact N-O 3.48Å; I1052-I1128 PolarHBondContact O-N 2.9Å; I1052-L1130 HydrophobicContact CD1-CD1 3.88Å; I1052-L1130 HydrophobicContact CG1-CD1 3.8Å; I1052-L1130 HydrophobicContact CG2-CD1 4.41Å
1053	T	94.6	Very high	77.9	Confident	76 Å²	76	75.8 Å²	75.8	47%	0.466	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	110.9	173.5	-60	0	0	0	0	109	T1125 L1126	T1053-T1125 HydrophobicContact CG2-CG2 3.45Å; T1053-T1125 VanDerWaalsContact CG2-CG2 3.45Å; T1053-L1126 CarbonylContact C-O 3.57Å; T1053-L1126 WeakPolarHBondContact CA-O 3.3Å
1054	L	96.3	Very high	81.1	Confident	2 Å²	2	70.5 Å²	70.5	1%	0.01	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	133.2	-176.9	-62.2	177.6	0	0	0	110.9	I1052 F1061 F1063 A1087 E1090 L1126 I1128	I1052-L1054 HydrophobicContact CD1-CD1 3.97Å; I1052-L1054 HydrophobicContact CD1-CD2 4.08Å; I1052-L1054 HydrophobicContact CD1-CG 3.92Å; I1052-L1054 HydrophobicContact CG1-CG 4.3Å; L1054-F1061 HydrophobicContact CB-CB 4.49Å; L1054-F1061 HydrophobicContact CB-CD1 3.85Å; L1054-F1061 HydrophobicContact CD1-CB 4.22Å; L1054-F1061 WeakPolarHBondContact O-CE1 3.32Å; L1054-F1063 HydrophobicContact CD1-CD1 3.91Å; L1054-F1063 HydrophobicContact CD1-CE1 3.71Å; L1054-A1087 HydrophobicContact CD1-CB 3.93Å; L1054-A1087 HydrophobicContact CD2-CB 4.4Å; L1054-E1090 HydrophobicContact CD2-CB 3.52Å; L1054-E1090 HydrophobicContact CD2-CG 3.76Å; L1054-L1126 PolarHBondContact N-O 3.38Å; L1054-L1126 PolarHBondContact O-N 2.91Å; L1054-I1128 HydrophobicContact CD1-CD1 4.22Å
1055	Q	95.2	Very high	84.1	Confident	112 Å²	112	64.9 Å²	64.9	52%	0.523	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	145.8	167.2	-67.6	-58	-37.8	0	0	110.5	G1057 P1086 S1124 T1125	Q1055-G1057 PolarHBondContact O-N 2.91Å; Q1055-P1086 WeakPolarHBondContact O-CB 3.27Å; Q1055-P1086 WeakPolarHBondContact O-CG 3.44Å; Q1055-S1124 CarbonylContact C-O 3.6Å; Q1055-S1124 PolarHBondContact OE1-O 3.44Å; Q1055-T1125 PolarHBondContact NE2-OG1 2.87Å; Q1055-T1125 PolarHBondContact OE1-OG1 3.21Å
1056	R	94.3	Very high	86.7	Confident	127 Å²	127	63.7 Å²	63.7	48%	0.479	35%	0.347	S	S	.	.			trans	-80.4	112	-175.4	-171.1	167.8	175	160.5	-0.7	111.5	F1061 R1120 G1123 S1124	R1056-F1061 HydrophobicContact CB-CD1 4.14Å; R1056-F1061 HydrophobicContact CB-CE1 3.54Å; R1056-F1061 HydrophobicContact CB-CE2 4.49Å; R1056-F1061 HydrophobicContact CB-CZ 3.75Å; R1056-F1061 HydrophobicContact CG-CE1 4.2Å; R1056-F1061 HydrophobicContact CG-CE2 4.33Å; R1056-F1061 HydrophobicContact CG-CZ 4.05Å; R1056-R1120 PolarHBondContact NH1-O 2.83Å; R1056-G1123 WeakPolarHBondContact CD-O 3.45Å; R1056-G1123 PolarHBondContact NH1-O 2.83Å; R1056-S1124 WeakPolarHBondContact CB-O 3.4Å; R1056-S1124 PolarHBondContact N-O 3.29Å
1057	G	91.8	Very high	88.4	Confident	18 Å²	18	59.1 Å²	59.1	19%	0.186	32%	0.319	C	S	.	.	B	Isolated β-bridge	trans	-76.5	174.8	169.4	0	0	0	0	0	112.5	Q1055 N1059 G1060	Q1055-G1057 PolarHBondContact O-N 2.91Å; G1057-N1059 PolarHBondContact O-N 3.21Å; G1057-G1060 WeakPolarHBondContact CA-O 3.48Å; G1057-G1060 PolarHBondContact N-O 3.2Å; G1057-G1060 PolarHBondContact O-N 2.78Å
1058	P	87.9	Confident	88.8	Confident	138 Å²	138	52.9 Å²	52.9	90%	0.896	30%	0.296	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.4	-34.8	-178.9	23	-33.7	0	0	0	112.7	G1060	P1058-G1060 VanDerWaalsContact C-N 3.33Å; P1058-G1060 PolarHBondContact O-N 3.2Å
1059	N	86.4	Confident	88.7	Confident	160 Å²	160	55.1 Å²	55.1	86%	0.856	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.3	23.5	177.4	-62.2	-21.7	0	0	0	112.7	G1057	G1057-N1059 PolarHBondContact O-N 3.21Å
1060	G	92.3	Very high	87.7	Confident	17 Å²	17	51.6 Å²	51.6	18%	0.175	28%	0.28	C	S	.	.	B	Isolated β-bridge	trans	82.9	-156.1	-173.2	0	0	0	0	0	113.2	G1057 P1058 G1062	G1057-G1060 WeakPolarHBondContact CA-O 3.48Å; G1057-G1060 PolarHBondContact N-O 3.2Å; G1057-G1060 PolarHBondContact O-N 2.78Å; P1058-G1060 VanDerWaalsContact C-N 3.33Å; P1058-G1060 PolarHBondContact O-N 3.2Å; G1060-G1062 VanDerWaalsContact C-N 3.29Å; G1060-G1062 PolarHBondContact O-N 2.9Å
1061	F	96.2	Very high	85.9	Confident	11 Å²	11	51.4 Å²	51.4	5%	0.048	29%	0.285	C	S	.	.	S	Bend	trans	-80.4	0.3	-173.3	-59.6	-77.1	0	0	0	114.9	L1054 R1056 F1063 A1087 I1119 L1126	L1054-F1061 HydrophobicContact CB-CB 4.49Å; L1054-F1061 HydrophobicContact CB-CD1 3.85Å; L1054-F1061 HydrophobicContact CD1-CB 4.22Å; L1054-F1061 WeakPolarHBondContact O-CE1 3.32Å; R1056-F1061 HydrophobicContact CB-CD1 4.14Å; R1056-F1061 HydrophobicContact CB-CE1 3.54Å; R1056-F1061 HydrophobicContact CB-CE2 4.49Å; R1056-F1061 HydrophobicContact CB-CZ 3.75Å; R1056-F1061 HydrophobicContact CG-CE1 4.2Å; R1056-F1061 HydrophobicContact CG-CE2 4.33Å; R1056-F1061 HydrophobicContact CG-CZ 4.05Å; F1061-F1063 HydrophobicContact CB-CD1 4.02Å; F1061-F1063 HydrophobicContact CB-CE1 3.74Å; F1061-A1087 WeakPolarHBondContact O-CB 3.42Å; F1061-A1087 PolarHBondContact O-N 2.96Å; F1061-I1119 HydrophobicContact CD2-CG2 4.11Å; F1061-I1119 WeakPolarHBondContact CE2-O 3.23Å; F1061-L1126 HydrophobicContact CB-CD2 4Å; F1061-L1126 HydrophobicContact CD1-CB 3.73Å; F1061-L1126 HydrophobicContact CD1-CD2 4.04Å; F1061-L1126 HydrophobicContact CD2-CB 4.22Å; F1061-L1126 HydrophobicContact CD2-CD2 3.55Å; F1061-L1126 HydrophobicContact CE1-CB 3.42Å; F1061-L1126 VanDerWaalsContact CE1-CB 3.42Å; F1061-L1126 HydrophobicContact CE1-CD2 4.42Å; F1061-L1126 HydrophobicContact CE2-CB 3.97Å; F1061-L1126 HydrophobicContact CE2-CD2 4Å; F1061-L1126 HydrophobicContact CG-CB 4.11Å; F1061-L1126 HydrophobicContact CG-CD2 3.58Å; F1061-L1126 HydrophobicContact CZ-CB 3.56Å; F1061-L1126 HydrophobicContact CZ-CD2 4.41Å
1062	G	94.8	Very high	83.9	Confident	10 Å²	10	51.2 Å²	51.2	10%	0.103	28%	0.28	C	S	.	.	S	Bend	trans	77.7	21.4	170	0	0	0	0	0	116.2	G1060 A1082	G1060-G1062 VanDerWaalsContact C-N 3.29Å; G1060-G1062 PolarHBondContact O-N 2.9Å; G1062-A1082 PolarHBondContact O-N 3.07Å
1063	F	95.5	Very high	82.2	Confident	33 Å²	33	57.1 Å²	57.1	15%	0.145	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	160.4	170.6	70.6	-78.7	0	0	0	111.3	L1054 F1061 V1065 R1080 I1081 A1087 M1093 I1099 I1119 L1126 I1128	L1054-F1063 HydrophobicContact CD1-CD1 3.91Å; L1054-F1063 HydrophobicContact CD1-CE1 3.71Å; F1061-F1063 HydrophobicContact CB-CD1 4.02Å; F1061-F1063 HydrophobicContact CB-CE1 3.74Å; F1063-V1065 HydrophobicContact CD2-CG2 3.99Å; F1063-V1065 HydrophobicContact CE2-CG2 3.56Å; F1063-R1080 CarbonylContact C-O 3.53Å; F1063-R1080 VanDerWaalsContact CA-O 3.32Å; F1063-R1080 WeakPolarHBondContact CA-O 3.49Å; F1063-R1080 WeakPolarHBondContact CB-O 3.25Å; F1063-I1081 HydrophobicContact CB-CG1 4.36Å; F1063-A1087 HydrophobicContact CB-CB 3.92Å; F1063-A1087 HydrophobicContact CD1-CB 3.97Å; F1063-A1087 HydrophobicContact CG-CB 4.34Å; F1063-M1093 HydrophobicContact CB-SD 3.82Å; F1063-M1093 HydrophobicContact CD1-CE 4.13Å; F1063-M1093 HydrophobicContact CD1-SD 4.14Å; F1063-M1093 HydrophobicContact CD2-CE 3.89Å; F1063-M1093 HydrophobicContact CD2-SD 4.05Å; F1063-M1093 HydrophobicContact CE1-CE 4.19Å; F1063-M1093 HydrophobicContact CE2-CE 3.95Å; F1063-M1093 HydrophobicContact CG-CE 3.99Å; F1063-M1093 HydrophobicContact CG-SD 3.75Å; F1063-M1093 HydrophobicContact CZ-CE 4.11Å; F1063-I1099 HydrophobicContact CE2-CD1 3.93Å; F1063-I1119 HydrophobicContact CE2-CD1 4.16Å; F1063-I1119 HydrophobicContact CZ-CD1 4.05Å; F1063-L1126 HydrophobicContact CE1-CD2 3.76Å; F1063-L1126 HydrophobicContact CZ-CD2 3.9Å; F1063-I1128 HydrophobicContact CE1-CD1 3.94Å; F1063-I1128 HydrophobicContact CE2-CD1 4.4Å; F1063-I1128 HydrophobicContact CZ-CD1 3.58Å
1064	S	93.6	Very high	81	Confident	46 Å²	46	55.3 Å²	55.3	32%	0.322	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	137.3	171.8	69.8	0	0	0	0	110.6	Y1079 R1080	S1064-Y1079 PolarHBondContact O-N 3.2Å; S1064-R1080 PolarHBondContact N-O 3.08Å; S1064-R1080 PolarHBondContact O-N 2.75Å; S1064-R1080 WeakPolarHBondContact OG-CB 3.3Å; S1064-R1080 PolarHBondContact OG-N 2.89Å
1065	V	92.3	Very high	80.3	Confident	19 Å²	19	57.1 Å²	57.1	12%	0.115	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.8	157.8	176.7	-175.5	0	0	0	0	110.1	F1063 L1076 I1077 I1099 H1112 I1119	F1063-V1065 HydrophobicContact CD2-CG2 3.99Å; F1063-V1065 HydrophobicContact CE2-CG2 3.56Å; V1065-L1076 HydrophobicContact CG1-CD1 3.37Å; V1065-L1076 HydrophobicContact CG1-CD2 4.4Å; V1065-L1076 HydrophobicContact CG1-CG 3.58Å; V1065-I1077 CarbonylContact C-O 3.52Å; V1065-I1077 WeakPolarHBondContact CA-O 3.36Å; V1065-I1099 HydrophobicContact CG1-CD1 4.42Å; V1065-I1099 HydrophobicContact CG2-CD1 3.77Å; V1065-H1112 PolarHBondContact O-CE1 2.88Å; V1065-I1119 HydrophobicContact CG2-CD1 3.79Å
1066	R	87.6	Confident	80.1	Confident	53 Å²	53	52 Å²	52	20%	0.2	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	166.7	162.2	68.1	-178.6	170.7	92.7	1.7	110.2	I1077 Y1079	R1066-I1077 HydrophobicContact CG-CB 4.21Å; R1066-I1077 PolarHBondContact N-O 2.88Å; R1066-I1077 PolarHBondContact O-N 3.07Å; R1066-Y1079 HydrophobicContact CB-CG 4.24Å; R1066-Y1079 HydrophobicContact CG-CG 4.35Å
1067	S	73	Confident	79.9	Confident	23 Å²	23	46 Å²	46	16%	0.161	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	59.9	-168.1	179.1	-165.6	0	0	0	0	112	S1071 S1074 P1075 L1076 H1112	S1067-S1071 PolarHBondContact OG-OG 3.06Å; S1067-S1074 WeakPolarHBondContact OG-CB 3.28Å; S1067-S1074 PolarHBondContact OG-O 2.68Å; S1067-S1074 VanDerWaalsContact OG-O 3.11Å; S1067-P1075 VanDerWaalsContact CB-O 3.29Å; S1067-P1075 WeakPolarHBondContact CB-O 3.38Å; S1067-P1075 PolarHBondContact OG-O 3.05Å; S1067-L1076 VanDerWaalsContact O-CD1 3.3Å; S1067-L1076 WeakPolarHBondContact O-CD1 3.12Å; S1067-H1112 WeakPolarHBondContact O-CB 3.4Å; S1067-H1112 PolarHBondContact O-ND1 3.06Å
1068	G	64.6	Low	80	Confident	2 Å²	2	45.2 Å²	45.2	2%	0.021	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	131.9	168.9	-156	0	0	0	0	0	110.9	D1070 S1071 S1074	G1068-D1070 VanDerWaalsContact C-OD1 3.23Å; G1068-D1070 PolarHBondContact O-N 3.47Å; G1068-S1071 PolarHBondContact O-N 3.38Å; G1068-S1071 PolarHBondContact O-OG 2.9Å; G1068-S1074 CarbonylContact C-O 3.49Å; G1068-S1074 PolarHBondContact N-O 2.88Å
1069	F	64.4	Low	80.2	Confident	110 Å²	110	42.8 Å²	42.8	48%	0.482	24%	0.237	S	C	.	.	G	3₁₀ helix	trans	-59	-25.1	-172.9	-162.1	-96.5	0	0	0	114	S1071 T1109 M1110	F1069-S1071 PolarHBondContact O-N 3.16Å; F1069-T1109 HydrophobicContact CE2-CG2 4.48Å; F1069-M1110 PolarHBondContact N-O 2.74Å
1070	D	63.7	Low	80.5	Confident	36 Å²	36	42.1 Å²	42.1	19%	0.193	22%	0.223	C	C	.	.	G	3₁₀ helix	trans	-69.4	14.7	172.3	54.2	-31.4	0	0	0	115.1	G1068 T1111 H1112	G1068-D1070 VanDerWaalsContact C-OD1 3.23Å; G1068-D1070 PolarHBondContact O-N 3.47Å; D1070-T1111 HydrophobicContact CB-CG2 3.97Å; D1070-T1111 WeakPolarHBondContact OD1-CA 3.1Å; D1070-H1112 PolarHBondContact OD1-N 2.82Å; D1070-H1112 VanDerWaalsContact OD2-CB 3.3Å; D1070-H1112 WeakPolarHBondContact OD2-CB 3.3Å; D1070-H1112 PolarHBondContact OD2-N 3.36Å
1071	S	55.7	Low	80.6	Confident	36 Å²	36	43.1 Å²	43.1	25%	0.252	22%	0.224	S	C	.	.	G	3₁₀ helix	trans	-131.5	22.1	177.5	57.2	0	0	0	0	114.9	S1067 G1068 F1069	S1067-S1071 PolarHBondContact OG-OG 3.06Å; G1068-S1071 PolarHBondContact O-N 3.38Å; G1068-S1071 PolarHBondContact O-OG 2.9Å; F1069-S1071 PolarHBondContact O-N 3.16Å
1072	N	48.9	Very low	80.5	Confident	44 Å²	44	45 Å²	45	24%	0.235	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	61	94.5	-169.1	-64	-96.2	0	0	0	112.5	E934 S1074	E934-N1072 PolarHBondContact OE1-ND2 2.99Å; E934-N1072 PolarHBondContact OE2-ND2 2.85Å; N1072-S1074 PolarHBondContact O-N 3.08Å; N1072-S1074 PolarHBondContact O-OG 3.46Å
1073	T	56.8	Low	80.3	Confident	126 Å²	126	52 Å²	52	77%	0.773	27%	0.271	S	S	*	.	S	Bend	trans	46.8	20.8	170	53.1	0	0	0	0	116.5
1074	S	68.8	Low	80.1	Confident	38 Å²	38	56.1 Å²	56.1	27%	0.266	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	128.9	-176	-63.8	0	0	0	0	109.4	S1067 G1068 N1072	S1067-S1074 WeakPolarHBondContact OG-CB 3.28Å; S1067-S1074 PolarHBondContact OG-O 2.68Å; S1067-S1074 VanDerWaalsContact OG-O 3.11Å; G1068-S1074 CarbonylContact C-O 3.49Å; G1068-S1074 PolarHBondContact N-O 2.88Å; N1072-S1074 PolarHBondContact O-N 3.08Å; N1072-S1074 PolarHBondContact O-OG 3.46Å
1075	P	83.2	Confident	80	Confident	40 Å²	40	54.5 Å²	54.5	26%	0.26	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	157.1	-170.1	25.8	-33.8	0	0	0	112.8	S1067 I1077 E1098	S1067-P1075 VanDerWaalsContact CB-O 3.29Å; S1067-P1075 WeakPolarHBondContact CB-O 3.38Å; S1067-P1075 PolarHBondContact OG-O 3.05Å; P1075-I1077 HydrophobicContact CG-CD1 4.1Å; P1075-I1077 HydrophobicContact CG-CG1 4.32Å; P1075-I1077 WeakPolarHBondContact O-CG1 3.28Å; P1075-I1077 PolarHBondContact O-N 3.47Å; P1075-E1098 HydrophobicContact CB-CG 3.87Å; P1075-E1098 WeakPolarHBondContact CB-OE1 3.27Å
1076	L	89.7	Confident	80.2	Confident	5 Å²	5	54.4 Å²	54.4	3%	0.026	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	102.9	-177	-170.3	73.2	0	0	0	110.4	V1065 S1067 E1098 I1099 I1102 T1107 M1110 A1115	V1065-L1076 HydrophobicContact CG1-CD1 3.37Å; V1065-L1076 HydrophobicContact CG1-CD2 4.4Å; V1065-L1076 HydrophobicContact CG1-CG 3.58Å; S1067-L1076 VanDerWaalsContact O-CD1 3.3Å; S1067-L1076 WeakPolarHBondContact O-CD1 3.12Å; L1076-E1098 CarbonylContact O-C 3.58Å; L1076-I1099 HydrophobicContact CB-CB 4.48Å; L1076-I1099 HydrophobicContact CD2-CB 3.99Å; L1076-I1099 HydrophobicContact CD2-CG2 3.94Å; L1076-I1099 HydrophobicContact CG-CB 4.31Å; L1076-I1099 PolarHBondContact O-N 3.18Å; L1076-I1102 HydrophobicContact CD2-CD1 4.03Å; L1076-T1107 HydrophobicContact CD2-CG2 3.7Å; L1076-M1110 HydrophobicContact CD2-CE 4.28Å; L1076-A1115 HydrophobicContact CD1-CB 3.69Å; L1076-A1115 HydrophobicContact CD2-CB 3.63Å; L1076-A1115 HydrophobicContact CG-CB 4.32Å
1077	I	91.7	Very high	80.6	Confident	2 Å²	2	51.9 Å²	51.9	1%	0.01	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	140.3	-167.5	-67	162.9	0	0	0	112.8	V1065 R1066 P1075 Y1079 D1097 Y1140	V1065-I1077 CarbonylContact C-O 3.52Å; V1065-I1077 WeakPolarHBondContact CA-O 3.36Å; R1066-I1077 HydrophobicContact CG-CB 4.21Å; R1066-I1077 PolarHBondContact N-O 2.88Å; R1066-I1077 PolarHBondContact O-N 3.07Å; P1075-I1077 HydrophobicContact CG-CD1 4.1Å; P1075-I1077 HydrophobicContact CG-CG1 4.32Å; P1075-I1077 WeakPolarHBondContact O-CG1 3.28Å; P1075-I1077 PolarHBondContact O-N 3.47Å; I1077-Y1079 PolarHBondContact O-N 2.81Å; I1077-D1097 WeakPolarHBondContact CA-O 3.42Å; I1077-Y1140 HydrophobicContact CD1-CD2 4.4Å; I1077-Y1140 HydrophobicContact CD1-CE2 3.91Å
1078	V	93.6	Very high	81.7	Confident	0 Å²	0	56 Å²	56	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.5	110	166	-178.4	0	0	0	0	109.7	I1081 M1093 K1094 G1096 D1097 I1099 L1130	V1078-I1081 HydrophobicContact CG1-CD1 4.38Å; V1078-I1081 HydrophobicContact CG1-CG1 3.95Å; V1078-M1093 HydrophobicContact CG1-CG 4.17Å; V1078-M1093 HydrophobicContact CG1-SD 3.92Å; V1078-M1093 HydrophobicContact CG2-CE 3.79Å; V1078-M1093 HydrophobicContact CG2-CG 4.01Å; V1078-M1093 HydrophobicContact CG2-SD 3.9Å; V1078-K1094 WeakPolarHBondContact CB-O 3.43Å; V1078-K1094 WeakPolarHBondContact CG1-O 3.43Å; V1078-G1096 PolarHBondContact O-N 2.86Å; V1078-D1097 HydrophobicContact CG2-CB 4.3Å; V1078-D1097 PolarHBondContact N-O 2.93Å; V1078-I1099 HydrophobicContact CG2-CD1 3.95Å; V1078-I1099 HydrophobicContact CG2-CG1 4.03Å; V1078-L1130 HydrophobicContact CG2-CD2 3.91Å
1079	Y	91.3	Very high	83.1	Confident	87 Å²	87	62.7 Å²	62.7	34%	0.341	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	-37.9	-177.2	176.4	-130.8	0	0	0	113.7	S1064 R1066 I1077 V1095	S1064-Y1079 PolarHBondContact O-N 3.2Å; R1066-Y1079 HydrophobicContact CB-CG 4.24Å; R1066-Y1079 HydrophobicContact CG-CG 4.35Å; I1077-Y1079 PolarHBondContact O-N 2.81Å; Y1079-V1095 VanDerWaalsContact O-CG1 3.23Å; Y1079-V1095 WeakPolarHBondContact O-CG1 3.33Å
1080	R	93.2	Very high	84.4	Confident	147 Å²	147	59.9 Å²	59.9	56%	0.555	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-148.1	152.5	176.4	-57.6	-175.7	-179.3	-154.7	-3.2	109.7	F1063 S1064	F1063-R1080 CarbonylContact C-O 3.53Å; F1063-R1080 VanDerWaalsContact CA-O 3.32Å; F1063-R1080 WeakPolarHBondContact CA-O 3.49Å; F1063-R1080 WeakPolarHBondContact CB-O 3.25Å; S1064-R1080 PolarHBondContact N-O 3.08Å; S1064-R1080 PolarHBondContact O-N 2.75Å; S1064-R1080 WeakPolarHBondContact OG-CB 3.3Å; S1064-R1080 PolarHBondContact OG-N 2.89Å
1081	I	94	Very high	85.7	Confident	37 Å²	37	60 Å²	60	19%	0.19	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	133.5	166.6	-62.7	173.3	0	0	0	106	F1063 V1078 A1087 F1088 M1093 V1095	F1063-I1081 HydrophobicContact CB-CG1 4.36Å; V1078-I1081 HydrophobicContact CG1-CD1 4.38Å; V1078-I1081 HydrophobicContact CG1-CG1 3.95Å; I1081-A1087 HydrophobicContact CG2-CB 4.15Å; I1081-F1088 HydrophobicContact CG2-CB 3.76Å; I1081-F1088 HydrophobicContact CG2-CD2 4.3Å; I1081-M1093 HydrophobicContact CD1-CB 4.04Å; I1081-M1093 HydrophobicContact CD1-CG 3.89Å; I1081-M1093 VanDerWaalsContact CD1-O 3.31Å; I1081-M1093 WeakPolarHBondContact CD1-O 3.17Å; I1081-M1093 HydrophobicContact CD1-SD 4.28Å; I1081-M1093 HydrophobicContact CG1-SD 4.31Å; I1081-V1095 HydrophobicContact CG1-CG2 4.32Å
1082	A	94.1	Very high	87.4	Confident	50 Å²	50	63.2 Å²	63.2	41%	0.413	33%	0.33	S	S	.	.			trans	-83.1	126.6	179.7	0	0	0	0	0	109.7	G1062 N1084 G1085 F1088	G1062-A1082 PolarHBondContact O-N 3.07Å; A1082-N1084 PolarHBondContact O-N 2.98Å; A1082-G1085 PolarHBondContact O-N 2.76Å; A1082-F1088 VanDerWaalsContact O-CB 3.32Å; A1082-F1088 WeakPolarHBondContact O-CB 3.41Å
1083	E	90.9	Very high	89.5	Confident	157 Å²	157	61.1 Å²	61.1	73%	0.734	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.5	133	174.2	-66.5	173.6	-165.9	0	0	110.8	G1085	E1083-G1085 PolarHBondContact O-N 3.06Å
1084	N	91.2	Very high	91.2	Very high	121 Å²	121	59.7 Å²	59.7	65%	0.647	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	6.6	-176.1	-49.8	-61.9	0	0	0	116	A1082 Q1089	A1082-N1084 PolarHBondContact O-N 2.98Å; N1084-Q1089 PolarHBondContact O-NE2 2.72Å
1085	G	92.4	Very high	92.3	Very high	12 Å²	12	61.9 Å²	61.9	12%	0.124	31%	0.314	C	S	.	.	S	Bend	trans	-77.9	165.6	170.6	0	0	0	0	0	112.8	A1082 E1083 A1087 F1088 Q1089	A1082-G1085 PolarHBondContact O-N 2.76Å; E1083-G1085 PolarHBondContact O-N 3.06Å; G1085-A1087 PolarHBondContact O-N 3.12Å; G1085-F1088 WeakPolarHBondContact O-CA 3.4Å; G1085-F1088 VanDerWaalsContact O-CB 3.28Å; G1085-F1088 WeakPolarHBondContact O-CB 3.31Å; G1085-F1088 PolarHBondContact O-N 2.72Å; G1085-Q1089 PolarHBondContact O-N 3.08Å
1086	P	96.1	Very high	92.6	Very high	17 Å²	17	61 Å²	61	11%	0.11	31%	0.313	C	S	.	.	H	α-helix	trans	-55.8	-41.8	-175.6	-28.4	34.1	0	0	0	115.2	Q1055 F1088 Q1089 E1090	Q1055-P1086 WeakPolarHBondContact O-CB 3.27Å; Q1055-P1086 WeakPolarHBondContact O-CG 3.44Å; P1086-F1088 PolarHBondContact O-N 2.67Å; P1086-Q1089 PolarHBondContact O-N 2.8Å; P1086-E1090 WeakPolarHBondContact O-CB 3.48Å; P1086-E1090 PolarHBondContact O-N 3.34Å
1087	A	96.2	Very high	92.7	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-64.9	-23.9	174.4	0	0	0	0	0	114.3	L1054 F1061 F1063 I1081 G1085 G1091 M1093	L1054-A1087 HydrophobicContact CD1-CB 3.93Å; L1054-A1087 HydrophobicContact CD2-CB 4.4Å; F1061-A1087 WeakPolarHBondContact O-CB 3.42Å; F1061-A1087 PolarHBondContact O-N 2.96Å; F1063-A1087 HydrophobicContact CB-CB 3.92Å; F1063-A1087 HydrophobicContact CD1-CB 3.97Å; F1063-A1087 HydrophobicContact CG-CB 4.34Å; I1081-A1087 HydrophobicContact CG2-CB 4.15Å; G1085-A1087 PolarHBondContact O-N 3.12Å; A1087-G1091 PolarHBondContact O-N 2.87Å; A1087-M1093 HydrophobicContact CB-SD 3.83Å
1088	F	94.9	Very high	92.8	Very high	109 Å²	109	61.9 Å²	61.9	48%	0.478	32%	0.317	S	S	.	.	H	α-helix	trans	-78.9	-40	171.7	-174.6	-89.8	0	0	0	111.4	I1081 A1082 G1085 P1086 G1091	I1081-F1088 HydrophobicContact CG2-CB 3.76Å; I1081-F1088 HydrophobicContact CG2-CD2 4.3Å; A1082-F1088 VanDerWaalsContact O-CB 3.32Å; A1082-F1088 WeakPolarHBondContact O-CB 3.41Å; G1085-F1088 WeakPolarHBondContact O-CA 3.4Å; G1085-F1088 VanDerWaalsContact O-CB 3.28Å; G1085-F1088 WeakPolarHBondContact O-CB 3.31Å; G1085-F1088 PolarHBondContact O-N 2.72Å; P1086-F1088 PolarHBondContact O-N 2.67Å; F1088-G1091 PolarHBondContact O-N 2.74Å
1089	Q	93.9	Very high	92.8	Very high	142 Å²	142	61.9 Å²	61.9	66%	0.664	32%	0.317	S	S	*	.	H	α-helix	trans	-69.2	-35.2	178.7	-67.9	174.1	-26.7	0	0	112.8	N1084 G1085 P1086	N1084-Q1089 PolarHBondContact O-NE2 2.72Å; G1085-Q1089 PolarHBondContact O-N 3.08Å; P1086-Q1089 PolarHBondContact O-N 2.8Å
1090	E	93.1	Very high	92.8	Very high	52 Å²	52	59.7 Å²	59.7	24%	0.243	31%	0.31	C	S	.	.	H	α-helix	trans	-69.9	-35.9	173.1	-171.7	-79.2	161.3	0	0	111.7	I1052 L1054 P1086 Q1092 M1093	I1052-E1090 VanDerWaalsContact CG2-OE1 3.26Å; I1052-E1090 WeakPolarHBondContact CG2-OE1 3.37Å; L1054-E1090 HydrophobicContact CD2-CB 3.52Å; L1054-E1090 HydrophobicContact CD2-CG 3.76Å; P1086-E1090 WeakPolarHBondContact O-CB 3.48Å; P1086-E1090 PolarHBondContact O-N 3.34Å; E1090-Q1092 VanDerWaalsContact C-N 3.25Å; E1090-Q1092 PolarHBondContact O-N 3.21Å; E1090-Q1092 VanDerWaalsContact O-N 3.08Å; E1090-Q1092 WeakPolarHBondContact OE1-CB 3.26Å; E1090-Q1092 VanDerWaalsContact OE1-CG 3.3Å; E1090-Q1092 WeakPolarHBondContact OE1-CG 3.48Å; E1090-Q1092 PolarHBondContact OE1-NE2 3.15Å; E1090-Q1092 WeakPolarHBondContact OE2-CB 3.43Å; E1090-Q1092 PolarHBondContact OE2-N 3.41Å; E1090-M1093 PolarHBondContact OE2-N 2.76Å
1091	G	91.1	Very high	92.9	Very high	37 Å²	37	55.8 Å²	55.8	38%	0.381	30%	0.299	S	S	.	.			trans	76.2	-9.9	162	0	0	0	0	0	116.8	A1087 F1088 K1094	A1087-G1091 PolarHBondContact O-N 2.87Å; F1088-G1091 PolarHBondContact O-N 2.74Å; G1091-K1094 PolarHBondContact O-NZ 2.91Å
1092	Q	91.2	Very high	92.9	Very high	104 Å²	104	54.1 Å²	54.1	49%	0.486	29%	0.29	S	S	.	.			trans	-80.3	-40.1	175.1	-61.7	-171.6	82.8	0	0	111.6	Y1050 I1052 E1090 R1132	Y1050-Q1092 HydrophobicContact CE2-CB 4.04Å; I1052-Q1092 HydrophobicContact CG2-CB 4.13Å; E1090-Q1092 VanDerWaalsContact C-N 3.25Å; E1090-Q1092 PolarHBondContact O-N 3.21Å; E1090-Q1092 VanDerWaalsContact O-N 3.08Å; E1090-Q1092 WeakPolarHBondContact OE1-CB 3.26Å; E1090-Q1092 VanDerWaalsContact OE1-CG 3.3Å; E1090-Q1092 WeakPolarHBondContact OE1-CG 3.48Å; E1090-Q1092 PolarHBondContact OE1-NE2 3.15Å; E1090-Q1092 WeakPolarHBondContact OE2-CB 3.43Å; E1090-Q1092 PolarHBondContact OE2-N 3.41Å; Q1092-R1132 PolarHBondContact O-NH2 2.72Å
1093	M	92.5	Very high	92.9	Very high	1 Å²	1	55.2 Å²	55.2	1%	0.005	29%	0.289	C	S	.	.			trans	-58.4	142.5	176.4	-165.9	-174.4	-104.8	0	0	112.4	I1052 F1063 V1078 I1081 A1087 E1090 I1128 L1130	I1052-M1093 HydrophobicContact CD1-CB 4.08Å; I1052-M1093 HydrophobicContact CD1-CE 3.79Å; F1063-M1093 HydrophobicContact CB-SD 3.82Å; F1063-M1093 HydrophobicContact CD1-CE 4.13Å; F1063-M1093 HydrophobicContact CD1-SD 4.14Å; F1063-M1093 HydrophobicContact CD2-CE 3.89Å; F1063-M1093 HydrophobicContact CD2-SD 4.05Å; F1063-M1093 HydrophobicContact CE1-CE 4.19Å; F1063-M1093 HydrophobicContact CE2-CE 3.95Å; F1063-M1093 HydrophobicContact CG-CE 3.99Å; F1063-M1093 HydrophobicContact CG-SD 3.75Å; F1063-M1093 HydrophobicContact CZ-CE 4.11Å; V1078-M1093 HydrophobicContact CG1-CG 4.17Å; V1078-M1093 HydrophobicContact CG1-SD 3.92Å; V1078-M1093 HydrophobicContact CG2-CE 3.79Å; V1078-M1093 HydrophobicContact CG2-CG 4.01Å; V1078-M1093 HydrophobicContact CG2-SD 3.9Å; I1081-M1093 HydrophobicContact CD1-CB 4.04Å; I1081-M1093 HydrophobicContact CD1-CG 3.89Å; I1081-M1093 VanDerWaalsContact CD1-O 3.31Å; I1081-M1093 WeakPolarHBondContact CD1-O 3.17Å; I1081-M1093 HydrophobicContact CD1-SD 4.28Å; I1081-M1093 HydrophobicContact CG1-SD 4.31Å; A1087-M1093 HydrophobicContact CB-SD 3.83Å; E1090-M1093 PolarHBondContact OE2-N 2.76Å; M1093-I1128 HydrophobicContact CE-CD1 3.81Å; M1093-L1130 HydrophobicContact CE-CD1 4.44Å; M1093-L1130 HydrophobicContact CE-CD2 3.91Å; M1093-L1130 HydrophobicContact CG-CD2 4.3Å
1094	K	92.2	Very high	92.9	Very high	96 Å²	96	50.4 Å²	50.4	42%	0.417	28%	0.281	S	S	.	.			trans	-134.6	158.5	175.2	-63.1	-72.7	159.5	-78.8	0	110.5	V1078 G1091 D1097	V1078-K1094 WeakPolarHBondContact CB-O 3.43Å; V1078-K1094 WeakPolarHBondContact CG1-O 3.43Å; G1091-K1094 PolarHBondContact O-NZ 2.91Å; K1094-D1097 WeakPolarHBondContact CA-OD2 3.27Å; K1094-D1097 WeakPolarHBondContact CB-OD2 3.14Å; K1094-D1097 PolarHBondContact N-OD2 2.88Å; K1094-D1097 PolarHBondContact O-N 3.2Å; K1094-D1097 VanDerWaalsContact O-OD2 3.14Å
1095	V	92.1	Very high	92.9	Very high	83 Å²	83	48.9 Å²	48.9	50%	0.503	27%	0.272	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.9	131	170.6	173.5	0	0	0	0	108.7	Y1079 I1081	Y1079-V1095 VanDerWaalsContact O-CG1 3.23Å; Y1079-V1095 WeakPolarHBondContact O-CG1 3.33Å; I1081-V1095 HydrophobicContact CG1-CG2 4.32Å
1096	G	89.1	Confident	92.7	Very high	23 Å²	23	51.6 Å²	51.6	24%	0.237	29%	0.289	C	S	.	.	T	Hydrogen-bonded Turn	trans	101.5	-11.3	-175	0	0	0	0	0	115.1	V1078	V1078-G1096 PolarHBondContact O-N 2.86Å
1097	D	92.4	Very high	92.4	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.016	29%	0.286	C	S	.	.			trans	-68.5	139.5	174.2	-65.5	-37.4	0	0	0	111.5	Y1050 I1077 V1078 K1094 L1130 R1132	Y1050-D1097 PolarHBondContact OH-OD2 3.44Å; I1077-D1097 WeakPolarHBondContact CA-O 3.42Å; V1078-D1097 HydrophobicContact CG2-CB 4.3Å; V1078-D1097 PolarHBondContact N-O 2.93Å; K1094-D1097 WeakPolarHBondContact CA-OD2 3.27Å; K1094-D1097 WeakPolarHBondContact CB-OD2 3.14Å; K1094-D1097 PolarHBondContact N-OD2 2.88Å; K1094-D1097 PolarHBondContact O-N 3.2Å; K1094-D1097 VanDerWaalsContact O-OD2 3.14Å; D1097-L1130 HydrophobicContact CB-CD2 3.77Å; D1097-R1132 WeakPolarHBondContact OD1-CB 3.19Å; D1097-R1132 WeakPolarHBondContact OD1-CG 3.1Å; D1097-R1132 IonicContact OD1-CZ 3.45Å; D1097-R1132 IonicContact OD1-NE 2.74Å; D1097-R1132 PolarHBondContact OD1-NE 2.76Å; D1097-R1132 IonicContact OD1-NH2 2.71Å; D1097-R1132 PolarHBondContact OD1-NH2 3.49Å; D1097-R1132 IonicContact OD2-CZ 2.87Å; D1097-R1132 IonicContact OD2-NE 3.17Å; D1097-R1132 IonicContact OD2-NH2 3.34Å; D1097-R1132 PolarHBondContact OD2-NH2 3.15Å
1098	E	92.7	Very high	91.6	Very high	22 Å²	22	57.8 Å²	57.8	10%	0.103	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	138.8	172.1	171.7	171.5	-171.1	0	0	110.2	P1075 L1076 L1100 L1130 Q1131 F1133	P1075-E1098 HydrophobicContact CB-CG 3.87Å; P1075-E1098 WeakPolarHBondContact CB-OE1 3.27Å; L1076-E1098 CarbonylContact O-C 3.58Å; E1098-L1100 HydrophobicContact CG-CD2 3.89Å; E1098-L1100 HydrophobicContact CG-CG 4.23Å; E1098-L1100 WeakPolarHBondContact OE1-CD2 3.4Å; E1098-L1130 CarbonylContact O-C 3.52Å; E1098-L1130 WeakPolarHBondContact O-CA 3.3Å; E1098-L1130 WeakPolarHBondContact O-CB 2.99Å; E1098-Q1131 HydrophobicContact CB-CB 4.46Å; E1098-Q1131 PolarHBondContact N-O 3.49Å; E1098-Q1131 PolarHBondContact O-N 3.09Å; E1098-F1133 HydrophobicContact CB-CE2 3.93Å; E1098-F1133 WeakPolarHBondContact OE2-CE2 3.45Å; E1098-F1133 VanDerWaalsContact OE2-CZ 3.27Å; E1098-F1133 WeakPolarHBondContact OE2-CZ 3.27Å
1099	I	93.8	Very high	90.8	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	115.3	176.1	-63.6	167.3	0	0	0	107.8	F1063 V1065 L1076 V1078 I1102 T1107 I1128 L1130	F1063-I1099 HydrophobicContact CE2-CD1 3.93Å; V1065-I1099 HydrophobicContact CG1-CD1 4.42Å; V1065-I1099 HydrophobicContact CG2-CD1 3.77Å; L1076-I1099 HydrophobicContact CB-CB 4.48Å; L1076-I1099 HydrophobicContact CD2-CB 3.99Å; L1076-I1099 HydrophobicContact CD2-CG2 3.94Å; L1076-I1099 HydrophobicContact CG-CB 4.31Å; L1076-I1099 PolarHBondContact O-N 3.18Å; V1078-I1099 HydrophobicContact CG2-CD1 3.95Å; V1078-I1099 HydrophobicContact CG2-CG1 4.03Å; I1099-I1102 HydrophobicContact CG2-CD1 4.07Å; I1099-I1102 HydrophobicContact CG2-CG1 3.73Å; I1099-T1107 HydrophobicContact CG2-CG2 3.97Å; I1099-T1107 WeakPolarHBondContact O-CB 3.31Å; I1099-T1107 WeakPolarHBondContact O-CG2 3.39Å; I1099-T1107 PolarHBondContact O-OG1 2.83Å; I1099-I1128 HydrophobicContact CB-CG2 4.4Å; I1099-I1128 HydrophobicContact CG1-CG2 4.24Å; I1099-I1128 HydrophobicContact CG2-CG2 3.58Å; I1099-L1130 HydrophobicContact CG1-CD2 3.9Å; I1099-L1130 HydrophobicContact CG1-CG 4.33Å
1100	L	91.9	Very high	90.3	Very high	40 Å²	40	51.3 Å²	51.3	21%	0.209	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	-29	-175.6	-68	176.4	0	0	0	113.8	L1049 E1098 S1106 T1107 I1129 Q1131	L1049-L1100 HydrophobicContact CD2-CD1 3.32Å; E1098-L1100 HydrophobicContact CG-CD2 3.89Å; E1098-L1100 HydrophobicContact CG-CG 4.23Å; E1098-L1100 WeakPolarHBondContact OE1-CD2 3.4Å; L1100-S1106 WeakPolarHBondContact O-CA 3.33Å; L1100-T1107 VanDerWaalsContact CA-OG1 3.31Å; L1100-T1107 WeakPolarHBondContact CA-OG1 3.11Å; L1100-T1107 PolarHBondContact O-N 2.93Å; L1100-T1107 PolarHBondContact O-OG1 2.77Å; L1100-I1129 PolarHBondContact N-O 2.77Å; L1100-Q1131 HydrophobicContact CD1-CB 3.7Å; L1100-Q1131 HydrophobicContact CG-CB 4.28Å
1101	E	94.6	Very high	90	Very high	66 Å²	66	50.5 Å²	50.5	31%	0.308	30%	0.298	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	149	172.5	-62.7	-176.5	-172	0	0	112.2	G1104 I1105 I1128 I1129	E1101-G1104 WeakPolarHBondContact OE2-CA 3.29Å; E1101-I1105 CarbonylContact C-O 3.46Å; E1101-I1105 VanDerWaalsContact CA-O 3.29Å; E1101-I1105 WeakPolarHBondContact CA-O 3.39Å; E1101-I1128 WeakPolarHBondContact O-CA 3.27Å; E1101-I1128 WeakPolarHBondContact O-CG2 3.45Å; E1101-I1129 HydrophobicContact CB-CB 4Å; E1101-I1129 HydrophobicContact CB-CD1 4.44Å; E1101-I1129 HydrophobicContact CB-CG1 4.09Å; E1101-I1129 HydrophobicContact CG-CB 4.34Å; E1101-I1129 HydrophobicContact CG-CD1 4.32Å; E1101-I1129 HydrophobicContact CG-CG1 4.45Å; E1101-I1129 PolarHBondContact N-O 3.49Å; E1101-I1129 PolarHBondContact O-N 2.83Å; E1101-I1129 VanDerWaalsContact OE2-CD1 3.3Å; E1101-I1129 WeakPolarHBondContact OE2-CD1 3.43Å
1102	I	95.5	Very high	89.9	Confident	1 Å²	1	51.5 Å²	51.5	1%	0.005	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	111.4	174.4	-57.9	-175.4	0	0	0	107.5	L1076 I1099 G1104 I1105 T1107 M1110 A1115 L1118 I1119 L1126	L1076-I1102 HydrophobicContact CD2-CD1 4.03Å; I1099-I1102 HydrophobicContact CG2-CD1 4.07Å; I1099-I1102 HydrophobicContact CG2-CG1 3.73Å; I1102-G1104 PolarHBondContact O-N 2.84Å; I1102-I1105 PolarHBondContact N-O 3.03Å; I1102-I1105 WeakPolarHBondContact O-CB 3.41Å; I1102-I1105 PolarHBondContact O-N 2.82Å; I1102-T1107 HydrophobicContact CD1-CG2 4.14Å; I1102-T1107 HydrophobicContact CG1-CG2 3.85Å; I1102-M1110 HydrophobicContact CD1-CE 3.65Å; I1102-M1110 HydrophobicContact CG1-CE 4.19Å; I1102-A1115 HydrophobicContact CD1-CB 4.25Å; I1102-L1118 HydrophobicContact CB-CD1 4.38Å; I1102-L1118 HydrophobicContact CG2-CB 3.85Å; I1102-L1118 HydrophobicContact CG2-CD1 4.49Å; I1102-I1119 HydrophobicContact CD1-CD1 3.97Å; I1102-I1119 HydrophobicContact CD1-CG1 3.88Å; I1102-I1119 HydrophobicContact CG2-CG1 4.18Å; I1102-L1126 HydrophobicContact CG2-CD1 3.81Å
1103	N	94.1	Very high	89.8	Confident	73 Å²	73	51.7 Å²	51.7	39%	0.39	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	51.4	36	-173.6	-66.8	-11.6	0	0	0	114.3	I1105 S1122 R1127	N1103-I1105 VanDerWaalsContact C-N 3.33Å; N1103-S1122 WeakPolarHBondContact ND2-CB 3Å; N1103-S1122 PolarHBondContact ND2-OG 3.02Å; N1103-R1127 PolarHBondContact N-O 2.99Å; N1103-R1127 PolarHBondContact OD1-N 3.37Å; N1103-R1127 PolarHBondContact OD1-O 2.86Å
1104	G	90.1	Very high	89.7	Confident	56 Å²	56	56.5 Å²	56.5	58%	0.577	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	83.6	1.7	-176.9	0	0	0	0	0	115	E1101 I1102	E1101-G1104 WeakPolarHBondContact OE2-CA 3.29Å; I1102-G1104 PolarHBondContact O-N 2.84Å
1105	I	90.3	Very high	89.7	Confident	90 Å²	90	52 Å²	52	46%	0.462	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	119	174.2	-56.5	171.8	0	0	0	108.4	E1101 I1102 N1103 L1118	E1101-I1105 CarbonylContact C-O 3.46Å; E1101-I1105 VanDerWaalsContact CA-O 3.29Å; E1101-I1105 WeakPolarHBondContact CA-O 3.39Å; I1102-I1105 PolarHBondContact N-O 3.03Å; I1102-I1105 WeakPolarHBondContact O-CB 3.41Å; I1102-I1105 PolarHBondContact O-N 2.82Å; N1103-I1105 VanDerWaalsContact C-N 3.33Å; I1105-L1118 HydrophobicContact CB-CD1 3.99Å; I1105-L1118 HydrophobicContact CD1-CD1 3.92Å; I1105-L1118 HydrophobicContact CD1-CD2 3.96Å; I1105-L1118 HydrophobicContact CG2-CD1 3.9Å
1106	S	88.4	Confident	89.8	Confident	68 Å²	68	49 Å²	49	48%	0.476	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.1	145.2	179.7	-173.9	0	0	0	0	112.7	L1100	L1100-S1106 WeakPolarHBondContact O-CA 3.33Å
1107	T	89.6	Confident	89.9	Confident	9 Å²	9	51.2 Å²	51.2	6%	0.055	29%	0.287	C	S	.	.			trans	-98.4	-4.9	-176.3	66.4	0	0	0	0	114.3	L1076 I1099 L1100 I1102 T1109 M1110	L1076-T1107 HydrophobicContact CD2-CG2 3.7Å; I1099-T1107 HydrophobicContact CG2-CG2 3.97Å; I1099-T1107 WeakPolarHBondContact O-CB 3.31Å; I1099-T1107 WeakPolarHBondContact O-CG2 3.39Å; I1099-T1107 PolarHBondContact O-OG1 2.83Å; L1100-T1107 VanDerWaalsContact CA-OG1 3.31Å; L1100-T1107 WeakPolarHBondContact CA-OG1 3.11Å; L1100-T1107 PolarHBondContact O-N 2.93Å; L1100-T1107 PolarHBondContact O-OG1 2.77Å; I1102-T1107 HydrophobicContact CD1-CG2 4.14Å; I1102-T1107 HydrophobicContact CG1-CG2 3.85Å; T1107-T1109 PolarHBondContact O-N 3.3Å; T1107-M1110 HydrophobicContact CG2-CE 3.39Å; T1107-M1110 WeakPolarHBondContact O-CB 3.45Å; T1107-M1110 PolarHBondContact O-N 2.83Å
1108	L	79.2	Confident	90	Very high	139 Å²	139	53 Å²	53	73%	0.728	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.6	-35.1	-168.5	-176	64.1	0	0	0	114.4
1109	T	79.8	Confident	90.1	Very high	101 Å²	101	53 Å²	53	62%	0.62	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.1	11.9	178.3	53.9	0	0	0	0	112.9	F1069 T1107	F1069-T1109 HydrophobicContact CE2-CG2 4.48Å; T1107-T1109 PolarHBondContact O-N 3.3Å
1110	M	83.4	Confident	90.1	Very high	13 Å²	13	60.9 Å²	60.9	6%	0.064	33%	0.327	C	S	.	.			trans	-87.6	127.1	-171.5	-170.6	158.8	55.6	0	0	111.9	F1069 L1076 I1102 T1107 Q1114 A1115 L1118	F1069-M1110 PolarHBondContact N-O 2.74Å; L1076-M1110 HydrophobicContact CD2-CE 4.28Å; I1102-M1110 HydrophobicContact CD1-CE 3.65Å; I1102-M1110 HydrophobicContact CG1-CE 4.19Å; T1107-M1110 HydrophobicContact CG2-CE 3.39Å; T1107-M1110 WeakPolarHBondContact O-CB 3.45Å; T1107-M1110 PolarHBondContact O-N 2.83Å; M1110-Q1114 HydrophobicContact CG-CB 3.43Å; M1110-Q1114 VanDerWaalsContact CG-CB 3.43Å; M1110-Q1114 HydrophobicContact SD-CB 3.92Å; M1110-A1115 HydrophobicContact CE-CB 3.75Å; M1110-A1115 HydrophobicContact CG-CB 4.17Å; M1110-A1115 HydrophobicContact SD-CB 4.18Å; M1110-L1118 HydrophobicContact CE-CD1 3.99Å; M1110-L1118 HydrophobicContact SD-CD1 3.51Å; M1110-L1118 VanDerWaalsContact SD-CD1 3.51Å; M1110-L1118 HydrophobicContact SD-CG 4.18Å
1111	T	86.9	Confident	90	Very high	35 Å²	35	62.9 Å²	62.9	22%	0.215	34%	0.344	C	S	.	.			trans	-67.7	155.9	170.7	61.2	0	0	0	0	111.4	D1070 Q1113 Q1114 A1115	D1070-T1111 HydrophobicContact CB-CG2 3.97Å; D1070-T1111 WeakPolarHBondContact OD1-CA 3.1Å; T1111-Q1113 PolarHBondContact O-N 2.91Å; T1111-Q1114 PolarHBondContact O-N 2.62Å; T1111-Q1114 VanDerWaalsContact O-N 3.1Å; T1111-Q1114 WeakPolarHBondContact OG1-CB 3.46Å; T1111-Q1114 VanDerWaalsContact OG1-CD 3.32Å; T1111-Q1114 VanDerWaalsContact OG1-CG 3.31Å; T1111-Q1114 WeakPolarHBondContact OG1-CG 3.24Å; T1111-Q1114 PolarHBondContact OG1-N 2.97Å; T1111-Q1114 PolarHBondContact OG1-OE1 3.26Å; T1111-A1115 PolarHBondContact O-N 3.24Å
1112	H	87.8	Confident	89.7	Confident	58 Å²	58	60.3 Å²	60.3	27%	0.269	33%	0.333	S	S	.	.	H	α-helix	trans	-51.4	-43	174.3	-172.8	70.1	0	0	0	111.9	V1065 S1067 D1070 A1115 V1116	V1065-H1112 PolarHBondContact O-CE1 2.88Å; S1067-H1112 WeakPolarHBondContact O-CB 3.4Å; S1067-H1112 PolarHBondContact O-ND1 3.06Å; D1070-H1112 PolarHBondContact OD1-N 2.82Å; D1070-H1112 VanDerWaalsContact OD2-CB 3.3Å; D1070-H1112 WeakPolarHBondContact OD2-CB 3.3Å; D1070-H1112 PolarHBondContact OD2-N 3.36Å; H1112-A1115 PolarHBondContact O-N 2.86Å; H1112-V1116 WeakPolarHBondContact O-CB 3.5Å; H1112-V1116 VanDerWaalsContact O-CG2 3.3Å; H1112-V1116 WeakPolarHBondContact O-CG2 3.46Å; H1112-V1116 PolarHBondContact O-N 3.28Å
1113	Q	89.8	Confident	89.5	Confident	109 Å²	109	62.4 Å²	62.4	51%	0.509	36%	0.355	S	S	.	.	H	α-helix	trans	-67	-40.4	179.1	-178.9	55.8	39.9	0	0	112.7	T1111 T1117	T1111-Q1113 PolarHBondContact O-N 2.91Å; Q1113-T1117 PolarHBondContact NE2-OG1 3.06Å; Q1113-T1117 VanDerWaalsContact O-CB 3.32Å; Q1113-T1117 WeakPolarHBondContact O-CB 3.18Å; Q1113-T1117 PolarHBondContact O-N 3.15Å; Q1113-T1117 PolarHBondContact O-OG1 2.96Å
1114	Q	90	Very high	89.4	Confident	102 Å²	102	62.6 Å²	62.6	48%	0.477	36%	0.362	S	S	.	.	H	α-helix	trans	-64.6	-44.4	173.5	-76.1	162.9	-50.3	0	0	111.1	M1110 T1111 V1116 T1117 L1118	M1110-Q1114 HydrophobicContact CG-CB 3.43Å; M1110-Q1114 VanDerWaalsContact CG-CB 3.43Å; M1110-Q1114 HydrophobicContact SD-CB 3.92Å; T1111-Q1114 PolarHBondContact O-N 2.62Å; T1111-Q1114 VanDerWaalsContact O-N 3.1Å; T1111-Q1114 WeakPolarHBondContact OG1-CB 3.46Å; T1111-Q1114 VanDerWaalsContact OG1-CD 3.32Å; T1111-Q1114 VanDerWaalsContact OG1-CG 3.31Å; T1111-Q1114 WeakPolarHBondContact OG1-CG 3.24Å; T1111-Q1114 PolarHBondContact OG1-N 2.97Å; T1111-Q1114 PolarHBondContact OG1-OE1 3.26Å; Q1114-V1116 PolarHBondContact O-N 2.71Å; Q1114-T1117 WeakPolarHBondContact O-CA 3.49Å; Q1114-T1117 WeakPolarHBondContact O-CB 3.25Å; Q1114-T1117 PolarHBondContact O-N 2.82Å; Q1114-T1117 VanDerWaalsContact O-N 3.07Å; Q1114-L1118 PolarHBondContact O-N 2.98Å
1115	A	92.4	Very high	89.5	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-59.5	-48.6	178.1	0	0	0	0	0	112.3	L1076 I1102 M1110 T1111 H1112 T1117 L1118 I1119	L1076-A1115 HydrophobicContact CD1-CB 3.69Å; L1076-A1115 HydrophobicContact CD2-CB 3.63Å; L1076-A1115 HydrophobicContact CG-CB 4.32Å; I1102-A1115 HydrophobicContact CD1-CB 4.25Å; M1110-A1115 HydrophobicContact CE-CB 3.75Å; M1110-A1115 HydrophobicContact CG-CB 4.17Å; M1110-A1115 HydrophobicContact SD-CB 4.18Å; T1111-A1115 PolarHBondContact O-N 3.24Å; H1112-A1115 PolarHBondContact O-N 2.86Å; A1115-T1117 PolarHBondContact O-N 3.03Å; A1115-L1118 PolarHBondContact O-N 2.78Å; A1115-I1119 VanDerWaalsContact O-CG1 3.29Å; A1115-I1119 WeakPolarHBondContact O-CG1 3.25Å; A1115-I1119 PolarHBondContact O-N 3.04Å
1116	V	93.3	Very high	89.8	Confident	22 Å²	22	58.2 Å²	58.2	13%	0.133	33%	0.329	C	S	.	.	H	α-helix	trans	-63.3	-31.5	175	168.3	0	0	0	0	111.6	H1112 Q1114 R1120	H1112-V1116 WeakPolarHBondContact O-CB 3.5Å; H1112-V1116 VanDerWaalsContact O-CG2 3.3Å; H1112-V1116 WeakPolarHBondContact O-CG2 3.46Å; H1112-V1116 PolarHBondContact O-N 3.28Å; Q1114-V1116 PolarHBondContact O-N 2.71Å; V1116-R1120 WeakPolarHBondContact O-CB 3.37Å; V1116-R1120 WeakPolarHBondContact O-CD 3.49Å; V1116-R1120 WeakPolarHBondContact O-CG 3.31Å; V1116-R1120 PolarHBondContact O-N 3.36Å; V1116-R1120 VanDerWaalsContact O-N 3.11Å
1117	T	92.8	Very high	90.1	Very high	68 Å²	68	62 Å²	62	42%	0.417	33%	0.333	S	S	.	.	H	α-helix	trans	-69.6	-48.9	175.3	-57.6	0	0	0	0	111.1	Q1113 Q1114 A1115 I1119 R1120 S1121	Q1113-T1117 PolarHBondContact NE2-OG1 3.06Å; Q1113-T1117 VanDerWaalsContact O-CB 3.32Å; Q1113-T1117 WeakPolarHBondContact O-CB 3.18Å; Q1113-T1117 PolarHBondContact O-N 3.15Å; Q1113-T1117 PolarHBondContact O-OG1 2.96Å; Q1114-T1117 WeakPolarHBondContact O-CA 3.49Å; Q1114-T1117 WeakPolarHBondContact O-CB 3.25Å; Q1114-T1117 PolarHBondContact O-N 2.82Å; Q1114-T1117 VanDerWaalsContact O-N 3.07Å; A1115-T1117 PolarHBondContact O-N 3.03Å; T1117-I1119 PolarHBondContact O-N 3.24Å; T1117-R1120 PolarHBondContact O-N 2.59Å; T1117-R1120 VanDerWaalsContact O-N 3.13Å; T1117-S1121 PolarHBondContact O-N 2.91Å; T1117-S1121 PolarHBondContact O-OG 2.81Å; T1117-S1121 VanDerWaalsContact O-OG 3.12Å
1118	L	93	Very high	90.3	Very high	41 Å²	41	61.7 Å²	61.7	22%	0.215	33%	0.331	C	S	.	.	H	α-helix	trans	-57.1	-48.8	175.8	-70.3	-172.6	0	0	0	111.7	I1102 I1105 M1110 Q1114 A1115 R1120 S1121 S1122	I1102-L1118 HydrophobicContact CB-CD1 4.38Å; I1102-L1118 HydrophobicContact CG2-CB 3.85Å; I1102-L1118 HydrophobicContact CG2-CD1 4.49Å; I1105-L1118 HydrophobicContact CB-CD1 3.99Å; I1105-L1118 HydrophobicContact CD1-CD1 3.92Å; I1105-L1118 HydrophobicContact CD1-CD2 3.96Å; I1105-L1118 HydrophobicContact CG2-CD1 3.9Å; M1110-L1118 HydrophobicContact CE-CD1 3.99Å; M1110-L1118 HydrophobicContact SD-CD1 3.51Å; M1110-L1118 VanDerWaalsContact SD-CD1 3.51Å; M1110-L1118 HydrophobicContact SD-CG 4.18Å; Q1114-L1118 PolarHBondContact O-N 2.98Å; A1115-L1118 PolarHBondContact O-N 2.78Å; L1118-R1120 VanDerWaalsContact C-N 3.27Å; L1118-R1120 PolarHBondContact O-N 2.9Å; L1118-S1121 WeakPolarHBondContact CA-OG 3.24Å; L1118-S1121 CarbonylContact O-C 3.48Å; L1118-S1121 PolarHBondContact O-N 3.16Å; L1118-S1121 VanDerWaalsContact O-N 3.11Å; L1118-S1121 PolarHBondContact O-OG 3.18Å; L1118-S1122 PolarHBondContact O-N 3.21Å; L1118-S1122 PolarHBondContact O-OG 3.09Å
1119	I	95.7	Very high	91	Very high	23 Å²	23	57 Å²	57	12%	0.118	31%	0.306	C	S	.	.	H	α-helix	trans	-56.2	-40.8	176.7	-70.2	166.7	0	0	0	111.3	F1061 F1063 V1065 I1102 A1115 T1117 L1126	F1061-I1119 HydrophobicContact CD2-CG2 4.11Å; F1061-I1119 WeakPolarHBondContact CE2-O 3.23Å; F1063-I1119 HydrophobicContact CE2-CD1 4.16Å; F1063-I1119 HydrophobicContact CZ-CD1 4.05Å; V1065-I1119 HydrophobicContact CG2-CD1 3.79Å; I1102-I1119 HydrophobicContact CD1-CD1 3.97Å; I1102-I1119 HydrophobicContact CD1-CG1 3.88Å; I1102-I1119 HydrophobicContact CG2-CG1 4.18Å; A1115-I1119 VanDerWaalsContact O-CG1 3.29Å; A1115-I1119 WeakPolarHBondContact O-CG1 3.25Å; A1115-I1119 PolarHBondContact O-N 3.04Å; T1117-I1119 PolarHBondContact O-N 3.24Å; I1119-L1126 HydrophobicContact CG1-CD2 4.41Å; I1119-L1126 HydrophobicContact CG2-CD2 4.04Å
1120	R	93	Very high	91.8	Very high	165 Å²	165	52.2 Å²	52.2	62%	0.623	28%	0.276	S	S	*	.	H	α-helix	trans	-72.3	-33.5	178.9	-74.8	170.1	-179.7	168	3.7	112.8	R1056 V1116 T1117 L1118	R1056-R1120 PolarHBondContact NH1-O 2.83Å; V1116-R1120 WeakPolarHBondContact O-CB 3.37Å; V1116-R1120 WeakPolarHBondContact O-CD 3.49Å; V1116-R1120 WeakPolarHBondContact O-CG 3.31Å; V1116-R1120 PolarHBondContact O-N 3.36Å; V1116-R1120 VanDerWaalsContact O-N 3.11Å; T1117-R1120 PolarHBondContact O-N 2.59Å; T1117-R1120 VanDerWaalsContact O-N 3.13Å; L1118-R1120 VanDerWaalsContact C-N 3.27Å; L1118-R1120 PolarHBondContact O-N 2.9Å
1121	S	91.5	Very high	92.1	Very high	82 Å²	82	52.6 Å²	52.6	57%	0.573	28%	0.278	S	S	*	.	H	α-helix	trans	-82.4	-7.9	178.4	59.5	0	0	0	0	114.7	T1117 L1118 G1123	T1117-S1121 PolarHBondContact O-N 2.91Å; T1117-S1121 PolarHBondContact O-OG 2.81Å; T1117-S1121 VanDerWaalsContact O-OG 3.12Å; L1118-S1121 WeakPolarHBondContact CA-OG 3.24Å; L1118-S1121 CarbonylContact O-C 3.48Å; L1118-S1121 PolarHBondContact O-N 3.16Å; L1118-S1121 VanDerWaalsContact O-N 3.11Å; L1118-S1121 PolarHBondContact O-OG 3.18Å; S1121-G1123 PolarHBondContact O-N 3.36Å
1122	S	87.4	Confident	92	Very high	11 Å²	11	54.3 Å²	54.3	8%	0.077	28%	0.281	C	S	.	.	S	Bend	trans	-63.1	16.4	177.9	-59.2	0	0	0	0	116.1	N1103 L1118 S1124 T1125 L1126	N1103-S1122 WeakPolarHBondContact ND2-CB 3Å; N1103-S1122 PolarHBondContact ND2-OG 3.02Å; L1118-S1122 PolarHBondContact O-N 3.21Å; L1118-S1122 PolarHBondContact O-OG 3.09Å; S1122-S1124 PolarHBondContact O-N 3.39Å; S1122-T1125 CarbonylContact O-C 3.46Å; S1122-T1125 PolarHBondContact O-N 3.04Å; S1122-L1126 WeakPolarHBondContact OG-CD1 3.42Å
1123	G	90.5	Very high	91.2	Very high	45 Å²	45	54.7 Å²	54.7	46%	0.464	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.9	-122.3	177.5	0	0	0	0	0	112.3	R1056 S1121	R1056-G1123 WeakPolarHBondContact CD-O 3.45Å; R1056-G1123 PolarHBondContact NH1-O 2.83Å; S1121-G1123 PolarHBondContact O-N 3.36Å
1124	S	92.7	Very high	89.6	Confident	77 Å²	77	49.9 Å²	49.9	54%	0.538	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.2	-23.2	176.5	56.6	0	0	0	0	114.5	Q1055 R1056 S1122	Q1055-S1124 CarbonylContact C-O 3.6Å; Q1055-S1124 PolarHBondContact OE1-O 3.44Å; R1056-S1124 WeakPolarHBondContact CB-O 3.4Å; R1056-S1124 PolarHBondContact N-O 3.29Å; S1122-S1124 PolarHBondContact O-N 3.39Å
1125	T	92.4	Very high	87.4	Confident	55 Å²	55	51.3 Å²	51.3	34%	0.337	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.9	121.4	-169.6	-61.8	0	0	0	0	110.8	T1053 Q1055 S1122	T1053-T1125 HydrophobicContact CG2-CG2 3.45Å; T1053-T1125 VanDerWaalsContact CG2-CG2 3.45Å; Q1055-T1125 PolarHBondContact NE2-OG1 2.87Å; Q1055-T1125 PolarHBondContact OE1-OG1 3.21Å; S1122-T1125 CarbonylContact O-C 3.46Å; S1122-T1125 PolarHBondContact O-N 3.04Å
1126	L	96.6	Very high	84.9	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	111.9	-179.1	167.8	61	0	0	0	109.8	T1053 L1054 F1061 F1063 I1102 I1119 S1122 I1128	T1053-L1126 CarbonylContact C-O 3.57Å; T1053-L1126 WeakPolarHBondContact CA-O 3.3Å; L1054-L1126 PolarHBondContact N-O 3.38Å; L1054-L1126 PolarHBondContact O-N 2.91Å; F1061-L1126 HydrophobicContact CB-CD2 4Å; F1061-L1126 HydrophobicContact CD1-CB 3.73Å; F1061-L1126 HydrophobicContact CD1-CD2 4.04Å; F1061-L1126 HydrophobicContact CD2-CB 4.22Å; F1061-L1126 HydrophobicContact CD2-CD2 3.55Å; F1061-L1126 HydrophobicContact CE1-CB 3.42Å; F1061-L1126 VanDerWaalsContact CE1-CB 3.42Å; F1061-L1126 HydrophobicContact CE1-CD2 4.42Å; F1061-L1126 HydrophobicContact CE2-CB 3.97Å; F1061-L1126 HydrophobicContact CE2-CD2 4Å; F1061-L1126 HydrophobicContact CG-CB 4.11Å; F1061-L1126 HydrophobicContact CG-CD2 3.58Å; F1061-L1126 HydrophobicContact CZ-CB 3.56Å; F1061-L1126 HydrophobicContact CZ-CD2 4.41Å; F1063-L1126 HydrophobicContact CE1-CD2 3.76Å; F1063-L1126 HydrophobicContact CZ-CD2 3.9Å; I1102-L1126 HydrophobicContact CG2-CD1 3.81Å; I1119-L1126 HydrophobicContact CG1-CD2 4.41Å; I1119-L1126 HydrophobicContact CG2-CD2 4.04Å; S1122-L1126 WeakPolarHBondContact OG-CD1 3.42Å; L1126-I1128 HydrophobicContact CD1-CD1 4.39Å; L1126-I1128 HydrophobicContact CD1-CG1 3.93Å; L1126-I1128 HydrophobicContact CD2-CD1 3.88Å; L1126-I1128 HydrophobicContact CD2-CG1 4.26Å; L1126-I1128 HydrophobicContact CG-CD1 3.92Å; L1126-I1128 HydrophobicContact CG-CG1 3.73Å
1127	R	93.7	Very high	82.3	Confident	148 Å²	148	56.8 Å²	56.8	56%	0.558	29%	0.292	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92.6	133.1	171	-170.6	-179.6	-176.2	-172	3.6	109.2	I1052 N1103	I1052-R1127 WeakPolarHBondContact O-CA 3.46Å; N1103-R1127 PolarHBondContact N-O 2.99Å; N1103-R1127 PolarHBondContact OD1-N 3.37Å; N1103-R1127 PolarHBondContact OD1-O 2.86Å
1128	I	95.8	Very high	79.3	Confident	2 Å²	2	60.2 Å²	60.2	1%	0.01	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	144.1	-179.3	-44	-177.6	0	0	0	108.6	S1051 I1052 L1054 F1063 M1093 I1099 E1101 L1126 L1130	S1051-I1128 CarbonylContact C-O 3.54Å; S1051-I1128 WeakPolarHBondContact CA-O 3.32Å; S1051-I1128 WeakPolarHBondContact CB-O 3.33Å; S1051-I1128 PolarHBondContact OG-O 3.45Å; I1052-I1128 HydrophobicContact CD1-CD1 4.36Å; I1052-I1128 HydrophobicContact CG1-CB 4.09Å; I1052-I1128 HydrophobicContact CG1-CD1 4.45Å; I1052-I1128 HydrophobicContact CG1-CG1 4.36Å; I1052-I1128 PolarHBondContact N-O 3.48Å; I1052-I1128 PolarHBondContact O-N 2.9Å; L1054-I1128 HydrophobicContact CD1-CD1 4.22Å; F1063-I1128 HydrophobicContact CE1-CD1 3.94Å; F1063-I1128 HydrophobicContact CE2-CD1 4.4Å; F1063-I1128 HydrophobicContact CZ-CD1 3.58Å; M1093-I1128 HydrophobicContact CE-CD1 3.81Å; I1099-I1128 HydrophobicContact CB-CG2 4.4Å; I1099-I1128 HydrophobicContact CG1-CG2 4.24Å; I1099-I1128 HydrophobicContact CG2-CG2 3.58Å; E1101-I1128 WeakPolarHBondContact O-CA 3.27Å; E1101-I1128 WeakPolarHBondContact O-CG2 3.45Å; L1126-I1128 HydrophobicContact CD1-CD1 4.39Å; L1126-I1128 HydrophobicContact CD1-CG1 3.93Å; L1126-I1128 HydrophobicContact CD2-CD1 3.88Å; L1126-I1128 HydrophobicContact CD2-CG1 4.26Å; L1126-I1128 HydrophobicContact CG-CD1 3.92Å; L1126-I1128 HydrophobicContact CG-CG1 3.73Å; I1128-L1130 HydrophobicContact CB-CD1 3.8Å; I1128-L1130 HydrophobicContact CG2-CD1 3.59Å; I1128-L1130 HydrophobicContact CG2-CG 3.85Å
1129	I	94	Very high	76.7	Confident	40 Å²	40	63 Å²	63	21%	0.205	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	129.9	160.2	-55.6	-168.9	0	0	0	108	L1100 E1101	L1100-I1129 PolarHBondContact N-O 2.77Å; E1101-I1129 HydrophobicContact CB-CB 4Å; E1101-I1129 HydrophobicContact CB-CD1 4.44Å; E1101-I1129 HydrophobicContact CB-CG1 4.09Å; E1101-I1129 HydrophobicContact CG-CB 4.34Å; E1101-I1129 HydrophobicContact CG-CD1 4.32Å; E1101-I1129 HydrophobicContact CG-CG1 4.45Å; E1101-I1129 PolarHBondContact N-O 3.49Å; E1101-I1129 PolarHBondContact O-N 2.83Å; E1101-I1129 VanDerWaalsContact OE2-CD1 3.3Å; E1101-I1129 WeakPolarHBondContact OE2-CD1 3.43Å
1130	L	94.7	Very high	74.1	Confident	0 Å²	0	67.7 Å²	67.7	0%	0	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	160.2	-177.7	-66.5	106.2	0	0	0	112.2	L1049 Y1050 I1052 V1078 M1093 D1097 E1098 I1099 I1128	L1049-L1130 WeakPolarHBondContact CA-O 3.47Å; Y1050-L1130 HydrophobicContact CD1-CB 4.13Å; Y1050-L1130 HydrophobicContact CE1-CB 3.57Å; Y1050-L1130 HydrophobicContact CE2-CB 4.3Å; Y1050-L1130 HydrophobicContact CE2-CD1 4.19Å; Y1050-L1130 PolarHBondContact N-O 2.76Å; Y1050-L1130 PolarHBondContact O-N 3.4Å; I1052-L1130 HydrophobicContact CD1-CD1 3.88Å; I1052-L1130 HydrophobicContact CG1-CD1 3.8Å; I1052-L1130 HydrophobicContact CG2-CD1 4.41Å; V1078-L1130 HydrophobicContact CG2-CD2 3.91Å; M1093-L1130 HydrophobicContact CE-CD1 4.44Å; M1093-L1130 HydrophobicContact CE-CD2 3.91Å; M1093-L1130 HydrophobicContact CG-CD2 4.3Å; D1097-L1130 HydrophobicContact CB-CD2 3.77Å; E1098-L1130 CarbonylContact O-C 3.52Å; E1098-L1130 WeakPolarHBondContact O-CA 3.3Å; E1098-L1130 WeakPolarHBondContact O-CB 2.99Å; I1099-L1130 HydrophobicContact CG1-CD2 3.9Å; I1099-L1130 HydrophobicContact CG1-CG 4.33Å; I1128-L1130 HydrophobicContact CB-CD1 3.8Å; I1128-L1130 HydrophobicContact CG2-CD1 3.59Å; I1128-L1130 HydrophobicContact CG2-CG 3.85Å
1131	Q	89.4	Confident	71	Confident	21 Å²	21	64.5 Å²	64.5	10%	0.098	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	132.4	172.8	-175.3	162.4	91.3	0	0	110.4	R1047 S1048 L1049 E1098 L1100	R1047-Q1131 HydrophobicContact CB-CG 3.93Å; S1048-Q1131 WeakPolarHBondContact O-CA 3.17Å; L1049-Q1131 HydrophobicContact CD2-CB 4.07Å; L1049-Q1131 HydrophobicContact CD2-CG 4.34Å; L1049-Q1131 VanDerWaalsContact CD2-NE2 3.3Å; E1098-Q1131 HydrophobicContact CB-CB 4.46Å; E1098-Q1131 PolarHBondContact N-O 3.49Å; E1098-Q1131 PolarHBondContact O-N 3.09Å; L1100-Q1131 HydrophobicContact CD1-CB 3.7Å; L1100-Q1131 HydrophobicContact CG-CB 4.28Å
1132	R	86.4	Confident	67.9	Low	72 Å²	72	71.4 Å²	71.4	27%	0.272	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	129.2	-180	-176.2	155.7	-66.8	148.3	8.1	111.6	S1048 Y1050 Q1092 D1097 N1134	S1048-R1132 PolarHBondContact O-N 3.32Å; Y1050-R1132 PolarHBondContact OH-NH2 3.35Å; Y1050-R1132 VanDerWaalsContact OH-NH2 3.15Å; Q1092-R1132 PolarHBondContact O-NH2 2.72Å; D1097-R1132 WeakPolarHBondContact OD1-CB 3.19Å; D1097-R1132 WeakPolarHBondContact OD1-CG 3.1Å; D1097-R1132 IonicContact OD1-CZ 3.45Å; D1097-R1132 IonicContact OD1-NE 2.74Å; D1097-R1132 PolarHBondContact OD1-NE 2.76Å; D1097-R1132 IonicContact OD1-NH2 2.71Å; D1097-R1132 PolarHBondContact OD1-NH2 3.49Å; D1097-R1132 IonicContact OD2-CZ 2.87Å; D1097-R1132 IonicContact OD2-NE 3.17Å; D1097-R1132 IonicContact OD2-NH2 3.34Å; D1097-R1132 PolarHBondContact OD2-NH2 3.15Å; R1132-N1134 PolarHBondContact O-N 3.22Å; R1132-N1134 PolarHBondContact O-OD1 3.22Å; R1132-N1134 VanDerWaalsContact O-OD1 3.09Å
1133	F	71.4	Confident	66.9	Low	65 Å²	65	74.4 Å²	74.4	29%	0.285	37%	0.374	S	S	.	.			trans	-89.8	86.3	167.4	-71.1	-80.7	0	0	0	111.4	E1098 E1135	E1098-F1133 HydrophobicContact CB-CE2 3.93Å; E1098-F1133 WeakPolarHBondContact OE2-CE2 3.45Å; E1098-F1133 VanDerWaalsContact OE2-CZ 3.27Å; E1098-F1133 WeakPolarHBondContact OE2-CZ 3.27Å; F1133-E1135 PolarHBondContact O-N 3.22Å
1134	N	54.7	Low	65.7	Low	9 Å²	9	75.9 Å²	75.9	5%	0.048	37%	0.369	C	S	.	.				36.5	78.5	114.1	-73.6	42.7	0	0	0	115.9	P283 L284 K285 T1046 R1132 N1136	P283-N1134 HydrophobicContact CB-CB 4.22Å; P283-N1134 VanDerWaalsContact CB-OD1 3.32Å; P283-N1134 WeakPolarHBondContact CB-OD1 3.31Å; P283-N1134 HydrophobicContact CG-CB 4.26Å; P283-N1134 VanDerWaalsContact CG-OD1 3.27Å; P283-N1134 WeakPolarHBondContact CG-OD1 3.44Å; P283-N1134 CarbonylContact O-C 3.57Å; P283-N1134 VanDerWaalsContact O-C 3.32Å; L284-N1134 VanDerWaalsContact C-CB 3.44Å; L284-N1134 PolarHBondContact N-ND2 3.46Å; L284-N1134 WeakPolarHBondContact O-CB 3.38Å; L284-N1134 PolarHBondContact O-ND2 2.97Å; K285-N1134 PolarHBondContact N-O 3.49Å; T1046-N1134 PolarHBondContact O-ND2 2.92Å; R1132-N1134 PolarHBondContact O-N 3.22Å; R1132-N1134 PolarHBondContact O-OD1 3.22Å; R1132-N1134 VanDerWaalsContact O-OD1 3.09Å; N1134-N1136 VanDerWaalsContact C-N 3.29Å; N1134-N1136 PolarHBondContact O-N 3.02Å
1135	E	44.1	Very low	64.2	Low	132 Å²	132	75.9 Å²	75.9	62%	0.617	36%	0.36	S	S	*	.	S	Bend	trans	-54	49.3	-162.7	-57.1	-176.3	140.6	0	0	118.9	P283 F1133	P283-E1135 PolarHBondContact O-N 2.92Å; F1133-E1135 PolarHBondContact O-N 3.22Å
1136	N	39.1	Very low	62.5	Low	64 Å²	64	77.1 Å²	77.1	34%	0.342	36%	0.361	S	S	.	.			trans	-135.3	28.9	177	-72.1	-123.3	0	0	0	112.5	K285 N1134	K285-N1136 HydrophobicContact CB-CB 4.11Å; K285-N1136 WeakPolarHBondContact CE-OD1 3.4Å; K285-N1136 HydrophobicContact CG-CB 3.33Å; K285-N1136 VanDerWaalsContact CG-CG 3.44Å; K285-N1136 WeakPolarHBondContact CG-OD1 3.48Å; N1134-N1136 VanDerWaalsContact C-N 3.29Å; N1134-N1136 PolarHBondContact O-N 3.02Å
1137	Q	39	Very low	60.4	Low	72 Å²	72	81.9 Å²	81.9	34%	0.336	38%	0.384	S	S	.	.			trans	-136.5	74.2	171.1	-78.5	-176.4	-89	0	0	110.9	N286 E1139	N286-Q1137 PolarHBondContact O-NE2 3.1Å; N286-Q1137 PolarHBondContact O-OE1 3.3Å; Q1137-E1139 PolarHBondContact O-N 3.13Å
1138	N	31.4	Very low	58.2	Low	140 Å²	140	77.5 Å²	77.5	75%	0.749	37%	0.372	S	S	*	.			trans	-79.4	66.7	-179	-67.6	-28	0	0	0	112
1139	E	37.9	Very low	55.5	Low	99 Å²	99	82.9 Å²	82.9	46%	0.463	40%	0.398	S	S	.	.			trans	-120.2	7.4	176.7	-156.8	159	-142.5	0	0	112.4	Q1137	Q1137-E1139 PolarHBondContact O-N 3.13Å
1140	Y	39.6	Very low	52.5	Low	123 Å²	123	86.2 Å²	86.2	48%	0.482	41%	0.413	S	S	.	.	S	Bend	trans	-127.9	11.4	-173.5	-69.7	-40.7	0	0	0	115.9	I1077	I1077-Y1140 HydrophobicContact CD1-CD2 4.4Å; I1077-Y1140 HydrophobicContact CD1-CE2 3.91Å
1141	S	28.3	Very low	49	Very low	97 Å²	97	93.4 Å²	93.4	68%	0.678	45%	0.447	S	S	*	.			trans	-101.1	121.8	168.1	36.2	0	0	0	0	110.5
1142	F	26.8	Very low	45.3	Very low	227 Å²	227	100 Å²	100	100%	0.996	48%	0.479	S	S	*	.			trans	-133.6	0	-178.2	-109.1	-73	0	0	0	109.9

Retrieved 1,142 of 1,142 residues in 561.6 ms (Link to these results)

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