A0A5K4F1N4_SCHMA Loading...

F-box domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F1N4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 1,109 aa.

						>A0A5K4F1N4_SCHMA|A0A5K4F1N4
MSQQSGYYKSKSQVGNSFDLKPKRTYQKTHHKKSIVNKLLGKAQLKEQTINEIEKHNNGNQLTGSIDPVQKSGENQGKDIKMSKTFANKSFSVADVSYSGSSVSFNSQSSQNIHYTYNRSFNEVKVNHSGKNGLQSNHMKNNVLSFAESKLDVEKLSVDDQNYKLKEGGGVQLDQSFTTEICPIEESDNYYSSDFSDESSSLSSISPSKTQKLLSKDRTNNDEETTKTCESISTTRSSGFTMSFKVTDNFNDGENMNVLDFEQPNRLLSHHVSSNVKCRANDLLKLVGLSLNEFTSVFELKPIDEYGFYTLHSNKCKDRNHCHVQTNDDAFHREVQTEPIDISYDVWTQTTSDENGEFCRRVGSNNNSLINDSYNLSYSNDFNHVSSKIILRELAKEFCLGVNTYNTTVNDKTEDVTDTFPINEFNRPENSTSMMNPNNRLPDNVLENLQIMLNLINEENLVNLSYLSKESITDRNDFQSKEDDFVEIFFQLKDDCFSVESKFDRDYNGIQNKELQNTSAKNNVTSVNENEIGKLQSFSYLWENYECVACDCAPQNQTLILTIHRPVRLNQEQEEIKSLFNYSRSAGEFICIWTEIGVKPLPDRLLYCPGLSETGLKGANLNCAIFSPDNDANLVIAGLHDGGLSIWDQHNYFNEIPIKSTNLSISTDVQHQLVTTGFNEFLNLPVLLPTYKTSLVEYKDSTNTCKLQSVDNCVTQQHNHFSPIISVKIADGDHHRYREVVKESTRDTDKFQLLALDEIGNISLWLVLMNQKYEVQNSIESLAGSQIDYCLSPGTGRLRIIRLLFIEYKSTQINIPASLGENSLKCQIEENNWNLSNRLNNKVITTCLAITKLGNFLIGCSNGQIIHHGRTPNQTVYPKLFSRILCCSAVQTLETHPNAELHIFIAGYTDGKICLYKTNYFQPILEWDVTSSVPITNLSKIKLTKNKNDTVVPVSKSTSKISVNCSFVSIRKLVWSATRSSVFFSLDSNNQVILWNIIDIFNLNNNSLHLNNTKSSLKNDYMINVNPSDKNILSCQINDICISKMPCSRHINRISSSSIASISTHSSPLIILFYPHKISTYWVNSRWTNESVNENTLLMKTFDSFSSIS
					

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	31.2	Very low	29.5	Very low	233 Å²	233	166.6 Å²	166.6	100%	1.148	86%	0.855	S	S	*	*				0	133.8	0	-78.3	176.6	74	0	0	108.6
2	S	30.5	Very low	29.6	Very low	118 Å²	118	163.1 Å²	163.1	83%	0.825	86%	0.856	S	S	*	*			trans	49	103.7	169.4	57.3	0	0	0	0	119.5
3	Q	27	Very low	29.6	Very low	191 Å²	191	163.6 Å²	163.6	89%	0.893	85%	0.851	S	S	*	*			trans	-44.8	142.8	156	-66.6	166	-24.8	0	0	113.2
4	Q	33.1	Very low	29.7	Very low	196 Å²	196	162.4 Å²	162.4	92%	0.916	85%	0.854	S	S	*	*			trans	-159.4	107.7	132.7	-111.3	172.5	4.9	0	0	110.4
5	S	27.6	Very low	29.5	Very low	118 Å²	118	155.5 Å²	155.5	83%	0.825	84%	0.837	S	S	*	*			trans	-67.1	130.2	167.8	50.9	0	0	0	0	110.9
6	G	30.7	Very low	29.6	Very low	73 Å²	73	156.4 Å²	156.4	75%	0.753	84%	0.842	S	S	*	*			trans	-136.2	103.1	171.4	0	0	0	0	0	110.8
7	Y	26.6	Very low	29.4	Very low	202 Å²	202	152.8 Å²	152.8	79%	0.792	83%	0.831	S	S	*	*			trans	-57.7	135.3	170.9	-85.6	-100.3	0	0	0	112
8	Y	31.4	Very low	29.4	Very low	236 Å²	236	155.4 Å²	155.4	93%	0.925	83%	0.833	S	S	*	*			trans	-134	114.5	148.6	-100.6	-84.9	0	0	0	110.9
9	K	27.4	Very low	29.3	Very low	176 Å²	176	155.2 Å²	155.2	77%	0.765	83%	0.832	S	S	*	*			trans	-99.5	132.2	171.5	-116.2	179.5	179.6	172.9	0	107.7
10	S	31.4	Very low	29.3	Very low	113 Å²	113	154.9 Å²	154.9	79%	0.79	83%	0.83	S	S	*	*			trans	-156.2	88.9	154.2	51	0	0	0	0	107.5
11	K	27.2	Very low	29.1	Very low	177 Å²	177	156.3 Å²	156.3	77%	0.77	83%	0.828	S	S	*	*				44	103.7	88.4	-83.8	-166.1	176.6	-173.2	0	114.7
12	S	31.3	Very low	29.2	Very low	124 Å²	124	151.4 Å²	151.4	87%	0.867	81%	0.814	S	S	*	*				-146	113.1	125.6	61.9	0	0	0	0	109.8
13	Q	28.7	Very low	29.1	Very low	170 Å²	170	155 Å²	155	79%	0.794	82%	0.815	S	S	*	*			trans	-78.5	136.1	172.7	-79.7	167.3	-71.9	0	0	110.6
14	V	31.5	Very low	29.1	Very low	147 Å²	147	157 Å²	157	89%	0.891	81%	0.814	S	S	*	*				-154.4	119.6	127.4	-173.7	0	0	0	0	103.4
15	G	27.4	Very low	28.9	Very low	58 Å²	58	154 Å²	154	60%	0.598	81%	0.81	S	S	*	*			cis	112.7	75.4	28.5	0	0	0	0	0	108.3
16	N	30.4	Very low	28.8	Very low	171 Å²	171	159 Å²	159	91%	0.914	81%	0.811	S	S	*	*			trans	-161.1	121.2	146.3	-96.8	-18.8	0	0	0	111.6
17	S	26.2	Very low	28.7	Very low	94 Å²	94	164.1 Å²	164.1	66%	0.657	82%	0.816	S	S	*	*			trans	-96	127.7	-173.6	47.6	0	0	0	0	110.6
18	F	29.9	Very low	28.6	Very low	200 Å²	200	164.6 Å²	164.6	88%	0.877	82%	0.822	S	S	*	*			trans	-146.3	86.4	146.3	-84.6	-70.9	0	0	0	109.5
19	D	26.3	Very low	28.5	Very low	151 Å²	151	159.3 Å²	159.3	81%	0.807	81%	0.814	S	S	*	*			trans	-89.4	107.6	163.6	-132.6	-11.2	0	0	0	106.4
20	L	29.6	Very low	28.4	Very low	150 Å²	150	159.6 Å²	159.6	79%	0.785	82%	0.818	S	S	*	*			trans	-138.4	90.8	168.9	-83.8	174.1	0	0	0	111.1
21	K	25.8	Very low	28.4	Very low	185 Å²	185	163.6 Å²	163.6	80%	0.804	82%	0.824	S	S	*	*			trans	-55.4	128.3	156.6	-67.6	175.7	177.3	175.9	0	109.5	K23	K21-K23 PolarHBondContact O-N 3.47Å; K21-K23 VanDerWaalsContact O-N 3.15Å
22	P	32.2	Very low	28.3	Very low	130 Å²	130	164 Å²	164	84%	0.844	83%	0.826	S	S	*	*			trans	-80.7	100.5	167	9.8	5.8	0	0	0	108.7	R24	P22-R24 PolarHBondContact O-N 3.43Å
23	K	28.4	Very low	28.1	Very low	194 Å²	194	166.3 Å²	166.3	84%	0.843	82%	0.82	S	S	*	*			trans	-66.5	119.6	160.5	-92.8	-178.9	174.7	177.9	0	108.3	K21 T25	K21-K23 PolarHBondContact O-N 3.47Å; K21-K23 VanDerWaalsContact O-N 3.15Å; K23-T25 PolarHBondContact O-N 2.85Å
24	R	26.9	Very low	28.3	Very low	233 Å²	233	163.9 Å²	163.9	88%	0.879	82%	0.822	S	S	*	*			trans	-57.8	121.2	164.7	-77.1	177.6	171.8	169.1	-2.6	109.5	P22	P22-R24 PolarHBondContact O-N 3.43Å
25	T	29.9	Very low	28.1	Very low	133 Å²	133	162.3 Å²	162.3	82%	0.816	81%	0.807	S	S	*	*			trans	-134.7	111.3	160	10.3	0	0	0	0	108.5	K23	K23-T25 PolarHBondContact O-N 2.85Å
26	Y	24.7	Very low	28.3	Very low	221 Å²	221	166.4 Å²	166.4	87%	0.867	82%	0.821	S	S	*	*			trans	-66	121.9	168.7	-85.7	-98.8	0	0	0	109.4
27	Q	29.2	Very low	28.3	Very low	181 Å²	181	164.5 Å²	164.5	85%	0.846	81%	0.81	S	S	*	*			trans	-139.1	114.3	155.7	-89.3	-172.8	-14.9	0	0	110.1
28	K	25.2	Very low	28.6	Very low	213 Å²	213	169.1 Å²	169.1	93%	0.926	82%	0.818	S	S	*	*			trans	-66.8	120.8	162.1	-84.4	174.5	170.3	175.4	0	108.3
29	T	28.5	Very low	28.6	Very low	124 Å²	124	167.6 Å²	167.6	76%	0.761	82%	0.819	S	S	*	*			trans	-147.2	111	160.2	32.3	0	0	0	0	110.6
30	H	24.8	Very low	28.8	Very low	183 Å²	183	167 Å²	167	85%	0.847	82%	0.815	S	S	*	*			trans	-55.8	139.7	154.7	-76.9	-91.5	0	0	0	109.3
31	H	31.8	Very low	28.8	Very low	197 Å²	197	163.5 Å²	163.5	91%	0.912	82%	0.815	S	S	*	*			trans	-167.5	140.5	137	-98.9	-62.4	0	0	0	113
32	K	25.4	Very low	28.9	Very low	186 Å²	186	162.9 Å²	162.9	81%	0.809	81%	0.812	S	S	*	*			trans	-80.1	149.7	-175.7	-95.7	169.1	170.3	167.1	0	113.6
33	K	27.7	Very low	28.8	Very low	172 Å²	172	161.2 Å²	161.2	75%	0.748	81%	0.81	S	S	*	*			trans	60	127.5	139.8	-73.8	-176.9	172.5	-176.4	0	120.6
34	S	31.5	Very low	28.8	Very low	119 Å²	119	159.8 Å²	159.8	83%	0.832	81%	0.806	S	S	*	*				-146.8	130.4	120.6	73.6	0	0	0	0	112
35	I	28.6	Very low	28.7	Very low	113 Å²	113	154.9 Å²	154.9	58%	0.579	80%	0.796	S	S	*	*			trans	-96.8	146	177.4	-70.5	161	0	0	0	108.5
36	V	31.9	Very low	28.6	Very low	145 Å²	145	157.8 Å²	157.8	88%	0.879	80%	0.798	S	S	*	*			trans	-122.8	117	154.5	178.7	0	0	0	0	109.3
37	N	30.3	Very low	28.6	Very low	130 Å²	130	155.9 Å²	155.9	70%	0.695	80%	0.797	S	S	*	*			trans	-73	156.7	179.4	-66.1	-51.3	0	0	0	112.3
38	K	32.3	Very low	28.7	Very low	191 Å²	191	156.5 Å²	156.5	83%	0.83	80%	0.8	S	S	*	*				175	148.1	82.5	-103.2	176.5	177.7	174.7	0	106.2
39	L	30.2	Very low	28.6	Very low	169 Å²	169	152.2 Å²	152.2	89%	0.885	79%	0.791	S	S	*	*			cis	-161.3	167.2	46.4	-116.2	135.4	0	0	0	111.4
40	L	28.8	Very low	28.6	Very low	138 Å²	138	152.9 Å²	152.9	72%	0.723	79%	0.789	S	S	*	*			trans	-123.2	155.6	-142.2	-178.1	84	0	0	0	112.9	K42	L40-K42 HydrophobicContact CD2-CD 3.99Å; L40-K42 HydrophobicContact CD2-CG 4.07Å; L40-K42 HydrophobicContact CG-CG 4.14Å
41	G	30.1	Very low	28.8	Very low	76 Å²	76	150.4 Å²	150.4	78%	0.784	78%	0.782	S	S	*	*			trans	177.9	72.8	154.3	0	0	0	0	0	113.1
42	K	27.7	Very low	28.5	Very low	172 Å²	172	149.3 Å²	149.3	75%	0.748	78%	0.777	S	S	*	*				71.6	107.1	90.8	-92.1	-176.3	169.1	-179.9	0	117.2	L40	L40-K42 HydrophobicContact CD2-CD 3.99Å; L40-K42 HydrophobicContact CD2-CG 4.07Å; L40-K42 HydrophobicContact CG-CG 4.14Å
43	A	30.5	Very low	28.7	Very low	96 Å²	96	148.6 Å²	148.6	79%	0.793	78%	0.78	S	S	*	*				176.8	101	124.7	0	0	0	0	0	107.7
44	Q	28.4	Very low	28.6	Very low	164 Å²	164	148.2 Å²	148.2	77%	0.766	78%	0.781	S	S	*	*				47.5	133.8	73.5	-76.9	-161.2	-23.3	0	0	113.4
45	L	25.6	Very low	28.5	Very low	129 Å²	129	150.6 Å²	150.6	68%	0.675	78%	0.777	S	S	*	*			cis	177.6	144.2	11	-123.5	165.2	0	0	0	107.3
46	K	28.4	Very low	28.6	Very low	194 Å²	194	152.5 Å²	152.5	84%	0.843	78%	0.783	S	S	*	*				148.2	126.3	127.4	-91.4	178	176.2	-179.1	0	115.6
47	E	24.4	Very low	28.6	Very low	182 Å²	182	152.6 Å²	152.6	85%	0.85	78%	0.778	S	S	*	*			trans	-58.7	149.1	158.5	-63.5	159.4	131.6	0	0	112.4
48	Q	30.3	Very low	28.4	Very low	194 Å²	194	154.1 Å²	154.1	91%	0.907	79%	0.786	S	S	*	*			trans	-160.3	134.1	132.5	-113.2	172.7	-1	0	0	111.7
49	T	24.4	Very low	28.3	Very low	123 Å²	123	148 Å²	148	76%	0.755	78%	0.778	S	S	*	*			trans	-71.1	174.7	175.8	24	0	0	0	0	113.4
50	I	26.6	Very low	28.2	Very low	138 Å²	138	146.5 Å²	146.5	71%	0.708	77%	0.771	S	S	*	*			trans	113.9	113.9	142.3	-55.7	-164.9	0	0	0	117.8
51	N	29.2	Very low	28.2	Very low	131 Å²	131	147.5 Å²	147.5	70%	0.701	77%	0.772	S	S	*	*			trans	84	114.7	142	-63.9	-2.2	0	0	0	124.1
52	E	25.5	Very low	28.1	Very low	173 Å²	173	150 Å²	150	81%	0.808	77%	0.766	S	S	*	*				24.5	128.2	114.8	-64.5	177.9	169.3	0	0	118.1
53	I	30.6	Very low	28	Very low	171 Å²	171	147.9 Å²	147.9	88%	0.877	77%	0.768	S	S	*	*				-162.4	113.8	124.1	-90.2	146.9	0	0	0	107.7
54	E	25.1	Very low	28.1	Very low	164 Å²	164	147 Å²	147	77%	0.766	77%	0.769	S	S	*	*			trans	-55.6	154.3	158.2	-65.4	173.7	139.1	0	0	111
55	K	30.9	Very low	28	Very low	170 Å²	170	144.4 Å²	144.4	74%	0.739	77%	0.768	S	S	*	*				157.4	125.1	118.6	-84.4	-179	-179.7	177	0	112.8
56	H	29.7	Very low	28.4	Very low	153 Å²	153	146.1 Å²	146.1	71%	0.708	78%	0.776	S	S	*	*			trans	56.1	113.9	134.4	-70	-70.4	0	0	0	119.2
57	N	32.2	Very low	28.3	Very low	147 Å²	147	143.9 Å²	143.9	79%	0.786	77%	0.774	S	S	*	*				177.5	141.9	81.2	-99.4	-29.6	0	0	0	113.9
58	N	25.9	Very low	29	Very low	161 Å²	161	140.5 Å²	140.5	86%	0.861	77%	0.768	S	S	*	*			trans	-53.4	160.5	170.4	-64.7	-33.4	0	0	0	114.7
59	G	29.2	Very low	29	Very low	63 Å²	63	136.5 Å²	136.5	65%	0.649	76%	0.756	S	S	*	*			trans	143.1	97.4	132.6	0	0	0	0	0	116.7
60	N	29.1	Very low	29.3	Very low	137 Å²	137	137.6 Å²	137.6	73%	0.733	75%	0.753	S	S	*	*				64.4	119.5	129.3	-65.8	-7.7	0	0	0	119.8
61	Q	28	Very low	29.6	Very low	160 Å²	160	138.7 Å²	138.7	75%	0.748	75%	0.752	S	S	*	*				73.6	140.4	109.4	-70.8	-172.9	15.9	0	0	113.8
62	L	27.6	Very low	29.5	Very low	127 Å²	127	137.9 Å²	137.9	67%	0.665	76%	0.757	S	S	*	*			cis	-173.8	146	17	-111.2	160.5	0	0	0	104.9
63	T	27	Very low	29.8	Very low	129 Å²	129	133 Å²	133	79%	0.791	75%	0.753	S	S	*	*			trans	39.5	137	142	58.8	0	0	0	0	122.3
64	G	31.2	Very low	29.7	Very low	78 Å²	78	133.2 Å²	133.2	80%	0.804	75%	0.75	S	S	*	*			trans	158.7	98	146.8	0	0	0	0	0	114.9
65	S	27.5	Very low	29.8	Very low	108 Å²	108	130.7 Å²	130.7	76%	0.755	74%	0.742	S	S	*	*			trans	-52.1	156.2	168.7	55.6	0	0	0	0	114.8
66	I	32.7	Very low	29.7	Very low	165 Å²	165	131.2 Å²	131.2	85%	0.846	75%	0.747	S	S	*	*				175.1	115.5	124.7	-83	149.5	0	0	0	108.8
67	D	27.8	Very low	29.7	Very low	148 Å²	148	126.9 Å²	126.9	79%	0.791	74%	0.744	S	S	*	*			trans	-71.2	-169.3	166.1	-75.3	-42.4	0	0	0	111.9
68	P	39	Very low	29.6	Very low	111 Å²	111	129.3 Å²	129.3	72%	0.721	75%	0.747	S	S	*	*				-124.8	-160.7	-70	37.6	-20	0	0	0	109.1
69	V	29.9	Very low	29.7	Very low	110 Å²	110	128.7 Å²	128.7	67%	0.667	74%	0.744	S	S	*	*			trans	147.8	117	142.8	163.6	0	0	0	0	114.1
70	Q	30.9	Very low	29.8	Very low	146 Å²	146	132.8 Å²	132.8	68%	0.682	75%	0.75	S	S	*	*			trans	62.2	147.7	142.5	-69.1	174.5	15.7	0	0	119.1
71	K	31.8	Very low	29.7	Very low	161 Å²	161	135.5 Å²	135.5	70%	0.7	76%	0.755	S	S	*	*			cis	-174.2	131.2	20.7	-123.4	162.9	-173.7	159.1	0	106.5
72	S	28.1	Very low	29.6	Very low	114 Å²	114	136.5 Å²	136.5	80%	0.797	76%	0.762	S	S	*	*				75.1	135	108.5	72.5	0	0	0	0	119.3
73	G	31.5	Very low	29.4	Very low	70 Å²	70	135.2 Å²	135.2	72%	0.722	76%	0.764	S	S	*	*			trans	117.7	98	149.3	0	0	0	0	0	113.7
74	E	28.3	Very low	29.6	Very low	176 Å²	176	138.5 Å²	138.5	82%	0.822	77%	0.767	S	S	*	*				98.3	124.7	72.5	-95.7	-167.6	176.6	0	0	113.5
75	N	28.1	Very low	29.2	Very low	110 Å²	110	140.8 Å²	140.8	59%	0.588	77%	0.765	S	S	*	*			trans	85.7	121.4	132.2	-76	-30.3	0	0	0	122.8
76	Q	28.8	Very low	29.2	Very low	181 Å²	181	145.6 Å²	145.6	85%	0.846	77%	0.773	S	S	*	*			trans	73.3	136.3	138.1	-60.5	175.2	34.4	0	0	116.5
77	G	28.6	Very low	28.8	Very low	63 Å²	63	141.3 Å²	141.3	65%	0.649	76%	0.762	S	S	*	*			cis	153.5	168.9	15.3	0	0	0	0	0	107.5
78	K	31.4	Very low	28.7	Very low	197 Å²	197	140.9 Å²	140.9	86%	0.857	76%	0.76	S	S	*	*			trans	82.7	113.1	166.1	-57.6	173.3	-179.5	175.5	0	115.8
79	D	27.6	Very low	28	Very low	148 Å²	148	144.4 Å²	144.4	79%	0.791	76%	0.764	S	S	*	*				100	142.7	55.1	-95.8	-32.6	0	0	0	112.7
80	I	31.9	Very low	27.9	Very low	150 Å²	150	143.6 Å²	143.6	77%	0.769	76%	0.763	S	S	*	*			trans	95.5	87.7	157.3	-56.1	136.5	0	0	0	118.2
81	K	25.1	Very low	27.6	Very low	194 Å²	194	146 Å²	146	84%	0.843	77%	0.771	S	S	*	*				34.8	117.2	104.6	-138.5	178.1	-166.9	175.1	0	117.2
82	M	27.4	Very low	27.3	Very low	180 Å²	180	142.9 Å²	142.9	89%	0.887	77%	0.77	S	S	*	*				-172.6	124.6	123.2	-104	-160.6	-65.2	0	0	113.8
83	S	23.5	Very low	27.3	Very low	101 Å²	101	144.5 Å²	144.5	71%	0.706	78%	0.775	S	S	*	*			trans	-51.1	148.7	163.1	45.4	0	0	0	0	115.5
84	K	30.1	Very low	27.1	Very low	198 Å²	198	144.7 Å²	144.7	86%	0.861	77%	0.77	S	S	*	*			trans	-164.9	116.2	135.2	-108.7	164.1	-172.9	176.8	0	113.5
85	T	23.1	Very low	26.9	Very low	126 Å²	126	143.3 Å²	143.3	77%	0.773	77%	0.768	S	S	*	*			trans	-48.1	141.6	160.1	-16.8	0	0	0	0	112.8
86	F	27.8	Very low	26.8	Very low	209 Å²	209	144.4 Å²	144.4	92%	0.917	78%	0.778	S	S	*	*			trans	-158.1	124	140.4	-99.7	-72.3	0	0	0	111
87	A	24.2	Very low	26.5	Very low	75 Å²	75	140.7 Å²	140.7	62%	0.62	77%	0.772	S	S	*	*			trans	-88.3	151.3	173	0	0	0	0	0	111.3
88	N	25	Very low	26.5	Very low	138 Å²	138	148.4 Å²	148.4	74%	0.738	78%	0.783	S	S	*	*				159.5	136.4	115.9	-91.4	-31.8	0	0	0	114.6
89	K	25.6	Very low	26.3	Very low	186 Å²	186	143.9 Å²	143.9	81%	0.809	78%	0.777	S	S	*	*			trans	66.2	140.1	142.3	-71.1	174.3	176.7	178.9	0	117.1
90	S	26.3	Very low	26.2	Very low	92 Å²	92	140.2 Å²	140.2	64%	0.643	77%	0.774	S	S	*	*			cis	176.9	145.1	12.7	41.8	0	0	0	0	104.5
91	F	26.5	Very low	26	Very low	196 Å²	196	138.7 Å²	138.7	86%	0.86	78%	0.777	S	S	*	*				-178.4	147.9	71.6	-115.2	-83.7	0	0	0	109
92	S	25.3	Very low	25.9	Very low	96 Å²	96	135.3 Å²	135.3	67%	0.671	78%	0.778	S	S	*	*			trans	-70.9	155.4	178.7	50.5	0	0	0	0	116
93	V	27.4	Very low	25.8	Very low	149 Å²	149	131.8 Å²	131.8	90%	0.903	77%	0.766	S	S	*	*				-147.9	125.2	121.5	179.9	0	0	0	0	110.4
94	A	26.3	Very low	25.7	Very low	74 Å²	74	132.3 Å²	132.3	61%	0.612	77%	0.769	S	S	*	*			trans	-47.2	172.9	172.8	0	0	0	0	0	117.7
95	D	24.4	Very low	25.5	Very low	147 Å²	147	132 Å²	132	79%	0.786	77%	0.768	S	S	*	*			cis	-173.9	147.3	-17.4	-89.1	-32.9	0	0	0	102.7
96	V	26.3	Very low	25.5	Very low	133 Å²	133	133.7 Å²	133.7	81%	0.806	77%	0.773	S	S	*	*				-162.5	126.8	82.3	169	0	0	0	0	107.9
97	S	23	Very low	25.3	Very low	103 Å²	103	128.6 Å²	128.6	72%	0.72	76%	0.763	S	S	*	*			trans	-123.7	148.8	168.7	51.4	0	0	0	0	108.1
98	Y	27.5	Very low	25.3	Very low	224 Å²	224	133.9 Å²	133.9	88%	0.878	78%	0.775	S	S	*	*			trans	-113.2	110.9	159.3	-94.2	-82.4	0	0	0	108.8
99	S	27	Very low	25.2	Very low	102 Å²	102	132.3 Å²	132.3	71%	0.713	78%	0.775	S	S	*	*			trans	-48.1	148.7	164.4	50.4	0	0	0	0	113.2
100	G	27.1	Very low	25.2	Very low	72 Å²	72	128.6 Å²	128.6	74%	0.742	77%	0.772	S	S	*	*			cis	88.6	102.9	24.5	0	0	0	0	0	111.7
101	S	26.6	Very low	25.1	Very low	117 Å²	117	132.8 Å²	132.8	82%	0.818	78%	0.782	S	S	*	*			trans	-161.9	91	150.8	34.9	0	0	0	0	111.9
102	S	23.2	Very low	25	Very low	124 Å²	124	130.7 Å²	130.7	87%	0.867	78%	0.78	S	S	*	*			trans	-73	128.6	154.2	49.8	0	0	0	0	109.1
103	V	24.9	Very low	24.9	Very low	106 Å²	106	132.2 Å²	132.2	64%	0.642	78%	0.779	S	S	*	*			trans	-120.9	110.3	167.9	-177.2	0	0	0	0	108.8	F105	V103-F105 HydrophobicContact CG1-CD2 3.61Å; V103-F105 HydrophobicContact CG1-CE2 3.31Å; V103-F105 HydrophobicContact CG1-CZ 4.14Å
104	S	22.7	Very low	24.6	Very low	111 Å²	111	133.8 Å²	133.8	78%	0.776	78%	0.776	S	S	*	*			trans	-78.4	135.3	165.3	50.6	0	0	0	0	110
105	F	25.1	Very low	24.5	Very low	192 Å²	192	139.6 Å²	139.6	84%	0.842	78%	0.783	S	S	*	*			trans	-127.1	126.5	162	-86.4	-72.6	0	0	0	111.4	V103	V103-F105 HydrophobicContact CG1-CD2 3.61Å; V103-F105 HydrophobicContact CG1-CE2 3.31Å; V103-F105 HydrophobicContact CG1-CZ 4.14Å
106	N	22.9	Very low	24.4	Very low	161 Å²	161	138.6 Å²	138.6	86%	0.861	78%	0.783	S	S	*	*			trans	-73.6	150.1	172.3	-96.9	-16.6	0	0	0	111.6
107	S	24.7	Very low	24.3	Very low	103 Å²	103	143.3 Å²	143.3	72%	0.72	79%	0.788	S	S	*	*			trans	-51.4	141.1	170.8	54	0	0	0	0	115.4
108	Q	24.2	Very low	24.2	Very low	186 Å²	186	145 Å²	145	87%	0.869	79%	0.789	S	S	*	*				-173	126.5	122.4	-105.3	167.2	-18.4	0	0	111.9
109	S	23.2	Very low	24.1	Very low	104 Å²	104	143.9 Å²	143.9	73%	0.727	78%	0.783	S	S	*	*			trans	-2.7	131.3	154.3	55.8	0	0	0	0	118.9
110	S	23.9	Very low	24	Very low	108 Å²	108	143.8 Å²	143.8	76%	0.755	78%	0.782	S	S	*	*				169.2	126.5	108.1	39.9	0	0	0	0	112.7
111	Q	24.8	Very low	23.9	Very low	180 Å²	180	146.2 Å²	146.2	84%	0.841	77%	0.773	S	S	*	*			trans	37	124.5	138.8	-68.8	170.9	-23.7	0	0	120.6
112	N	23.5	Very low	23.9	Very low	153 Å²	153	148.8 Å²	148.8	82%	0.818	78%	0.777	S	S	*	*			trans	15.9	116.7	142.9	-70.2	-15.1	0	0	0	116.4
113	I	23.5	Very low	23.9	Very low	127 Å²	127	148.2 Å²	148.2	65%	0.651	76%	0.761	S	S	*	*			trans	-159.9	127.8	132.7	-76.9	120.6	0	0	0	108.9	Y115	I113-Y115 HydrophobicContact CB-CD2 4.42Å; I113-Y115 HydrophobicContact CB-CE2 4.04Å; I113-Y115 HydrophobicContact CG2-CD2 3.52Å; I113-Y115 HydrophobicContact CG2-CE1 4.28Å; I113-Y115 HydrophobicContact CG2-CE2 3.09Å; I113-Y115 HydrophobicContact CG2-CG 4.28Å; I113-Y115 VanDerWaalsContact CG2-CZ 3.49Å
114	H	22.4	Very low	23.9	Very low	183 Å²	183	150.1 Å²	150.1	85%	0.847	77%	0.772	S	S	*	*			trans	-51.3	125.6	159.6	-99.9	-90.2	0	0	0	111.8
115	Y	23.5	Very low	23.9	Very low	195 Å²	195	151.2 Å²	151.2	77%	0.765	76%	0.763	S	S	*	*			trans	-139.3	107.1	155	-76.3	-65	0	0	0	111.9	I113	I113-Y115 HydrophobicContact CB-CD2 4.42Å; I113-Y115 HydrophobicContact CB-CE2 4.04Å; I113-Y115 HydrophobicContact CG2-CD2 3.52Å; I113-Y115 HydrophobicContact CG2-CE1 4.28Å; I113-Y115 HydrophobicContact CG2-CE2 3.09Å; I113-Y115 HydrophobicContact CG2-CG 4.28Å; I113-Y115 VanDerWaalsContact CG2-CZ 3.49Å
116	T	21.6	Very low	24.1	Very low	127 Å²	127	149 Å²	149	78%	0.779	77%	0.765	S	S	*	*			trans	-48.8	130.3	149.1	42.9	0	0	0	0	110.4
117	Y	24.4	Very low	24.3	Very low	232 Å²	232	147.2 Å²	147.2	91%	0.91	76%	0.755	S	S	*	*			trans	-131.1	131.4	157.9	-127.7	-92	0	0	0	110.7
118	N	22.4	Very low	24.4	Very low	138 Å²	138	150.7 Å²	150.7	74%	0.738	76%	0.76	S	S	*	*			trans	-117.7	147.9	-162.2	-150.3	-9.8	0	0	0	107.9
119	R	24.5	Very low	24.5	Very low	200 Å²	200	147.7 Å²	147.7	76%	0.755	76%	0.759	S	S	*	*			trans	69.8	146.3	161.5	-89	176.5	180	-173.9	-4.1	117.9	F121	R119-F121 HydrophobicContact CG-CD2 4.34Å; R119-F121 HydrophobicContact CG-CE2 3.99Å
120	S	25.2	Very low	24.7	Very low	100 Å²	100	146.1 Å²	146.1	70%	0.699	76%	0.76	S	S	*	*			cis	-164.1	135.2	29	33.6	0	0	0	0	114.5
121	F	24.3	Very low	24.8	Very low	124 Å²	124	150 Å²	150	54%	0.544	76%	0.763	S	S	.	*			trans	50.3	125.3	130.2	-66.3	-78.6	0	0	0	122.5	R119 E123	R119-F121 HydrophobicContact CG-CD2 4.34Å; R119-F121 HydrophobicContact CG-CE2 3.99Å; F121-E123 HydrophobicContact CD1-CG 4.05Å; F121-E123 HydrophobicContact CE1-CG 4.19Å
122	N	27	Very low	24.8	Very low	171 Å²	171	149 Å²	149	91%	0.914	76%	0.764	S	S	*	*				-148.8	125.5	97.2	-98	-22	0	0	0	112.7
123	E	22.9	Very low	25	Very low	111 Å²	111	145.4 Å²	145.4	52%	0.519	76%	0.763	S	S	.	*			trans	-68.5	144.6	176.4	-71.5	171.4	127.3	0	0	112.1	F121 K125	F121-E123 HydrophobicContact CD1-CG 4.05Å; F121-E123 HydrophobicContact CE1-CG 4.19Å; E123-K125 WeakPolarHBondContact OE1-CE 3.28Å; E123-K125 IonicContact OE1-NZ 2.71Å; E123-K125 PolarHBondContact OE1-NZ 2.83Å
124	V	24.8	Very low	24.9	Very low	146 Å²	146	147.5 Å²	147.5	89%	0.885	78%	0.775	S	S	*	*			trans	-130	101.3	135.5	-179.6	0	0	0	0	108
125	K	23.6	Very low	25	Very low	135 Å²	135	147.5 Å²	147.5	59%	0.587	78%	0.775	S	S	*	*			trans	-74.2	135.4	167.7	-85.2	169.3	169.1	136.3	0	110.1	E123	E123-K125 WeakPolarHBondContact OE1-CE 3.28Å; E123-K125 IonicContact OE1-NZ 2.71Å; E123-K125 PolarHBondContact OE1-NZ 2.83Å
126	V	28.9	Very low	25.1	Very low	144 Å²	144	142.4 Å²	142.4	87%	0.873	77%	0.768	S	S	*	*			trans	-139.6	127.1	137.3	-176.2	0	0	0	0	108.9
127	N	26.8	Very low	25.3	Very low	125 Å²	125	143.5 Å²	143.5	67%	0.668	77%	0.769	S	S	*	*			trans	-83.5	155.7	-167.8	-73.4	-34.2	0	0	0	115
128	H	26.4	Very low	25.3	Very low	175 Å²	175	141.1 Å²	141.1	81%	0.81	77%	0.766	S	S	*	*			trans	-26	143.9	160.7	-55.3	-78.9	0	0	0	118.6
129	S	26.5	Very low	25.6	Very low	123 Å²	123	143 Å²	143	86%	0.86	77%	0.772	S	S	*	*				167.2	144.4	108.6	53.4	0	0	0	0	113
130	G	27	Very low	25.7	Very low	72 Å²	72	141.7 Å²	141.7	74%	0.742	77%	0.772	S	S	*	*			trans	100.8	95.8	138	0	0	0	0	0	119.8
131	K	26.1	Very low	25.7	Very low	190 Å²	190	142.9 Å²	142.9	83%	0.826	77%	0.771	S	S	*	*			trans	53.9	121.6	130.9	-74.2	177.5	175.5	173.9	0	120.9
132	N	25	Very low	25.9	Very low	158 Å²	158	145.1 Å²	145.1	85%	0.845	79%	0.788	S	S	*	*			trans	59.9	118.5	132.5	-58.9	-2.6	0	0	0	119.2
133	G	27.2	Very low	25.8	Very low	78 Å²	78	142.3 Å²	142.3	80%	0.804	78%	0.777	S	S	*	*			trans	160.9	104	155.9	0	0	0	0	0	114.2
134	L	22.9	Very low	26	Very low	171 Å²	171	145.3 Å²	145.3	90%	0.895	80%	0.796	S	S	*	*			trans	-48.3	133.8	165.2	-70.4	136.9	0	0	0	112.4
135	Q	25.1	Very low	25.9	Very low	183 Å²	183	142.3 Å²	142.3	86%	0.855	78%	0.781	S	S	*	*				160.6	143.9	118.9	-90.1	-177.9	-7.7	0	0	112.3
136	S	23.9	Very low	26	Very low	88 Å²	88	146 Å²	146	62%	0.615	80%	0.797	S	S	*	*			trans	-23.7	140	172.5	64.1	0	0	0	0	117.5
137	N	26	Very low	25.9	Very low	150 Å²	150	143.4 Å²	143.4	80%	0.802	79%	0.791	S	S	*	*				-177.8	144.4	109.3	-87	-33.8	0	0	0	112.4
138	H	25.9	Very low	25.8	Very low	182 Å²	182	146.1 Å²	146.1	84%	0.843	80%	0.8	S	S	*	*			trans	-42.1	142.4	169.3	-72.7	-88	0	0	0	114.9
139	M	28.4	Very low	26	Very low	177 Å²	177	143.9 Å²	143.9	87%	0.872	80%	0.804	S	S	*	*				-175.9	116.8	123.1	-94.1	-139.5	162.4	0	0	113.4
140	K	25.2	Very low	26	Very low	173 Å²	173	146.6 Å²	146.6	75%	0.752	80%	0.8	S	S	*	*			trans	33.1	129.6	132.9	-78.6	-178.8	176.8	176.9	0	122.8
141	N	26	Very low	26	Very low	125 Å²	125	150.2 Å²	150.2	67%	0.668	80%	0.802	S	S	*	*			trans	81.9	120.4	132.6	-62.9	-1.1	0	0	0	119.4
142	N	28.7	Very low	26.1	Very low	170 Å²	170	148.3 Å²	148.3	91%	0.909	80%	0.8	S	S	*	*				-155.3	133.9	108.3	-93.8	-20.8	0	0	0	112.5
143	V	24.5	Very low	26.2	Very low	112 Å²	112	146 Å²	146	68%	0.679	79%	0.792	S	S	*	*			trans	-93.9	146.1	-177.8	168	0	0	0	0	108.7
144	L	27	Very low	26.3	Very low	175 Å²	175	152 Å²	152	92%	0.916	80%	0.799	S	S	*	*			trans	-133.2	128.8	145	-97.9	166.1	0	0	0	109.6
145	S	23.1	Very low	26.4	Very low	83 Å²	83	152.6 Å²	152.6	58%	0.58	79%	0.794	S	S	*	*			trans	-120.3	136.6	-164.8	49.5	0	0	0	0	110.9
146	F	26.5	Very low	26.6	Very low	211 Å²	211	152.3 Å²	152.3	93%	0.925	80%	0.798	S	S	*	*			trans	-166.7	139.1	156.4	-90	-79.9	0	0	0	108
147	A	27	Very low	26.6	Very low	90 Å²	90	152.9 Å²	152.9	74%	0.744	80%	0.802	S	S	*	*			cis	-162.6	141.4	-20.9	0	0	0	0	0	105.5
148	E	24.3	Very low	26.8	Very low	183 Å²	183	152 Å²	152	86%	0.855	80%	0.801	S	S	*	*			trans	-71.9	153.5	-178	-65.4	169.4	147	0	0	113.1
149	S	29.9	Very low	26.9	Very low	127 Å²	127	150.5 Å²	150.5	89%	0.888	80%	0.8	S	S	*	*			trans	-122.5	133.4	143.7	63.9	0	0	0	0	109.6
150	K	25.6	Very low	26.9	Very low	180 Å²	180	149.4 Å²	149.4	78%	0.783	80%	0.797	S	S	*	*			trans	-80.4	165.3	-158.7	-74.2	167.5	165.9	174.2	0	115.4
151	L	27.9	Very low	27.2	Very low	149 Å²	149	149.3 Å²	149.3	78%	0.78	80%	0.8	S	S	*	*			trans	129.5	126	138.2	-67.7	156.2	0	0	0	110.2
152	D	28.7	Very low	27.3	Very low	149 Å²	149	150.6 Å²	150.6	80%	0.797	81%	0.807	S	S	*	*			cis	-154.6	153.9	-2.5	-103.7	-29.9	0	0	0	109.3
153	V	26.8	Very low	27.4	Very low	111 Å²	111	152.4 Å²	152.4	67%	0.673	80%	0.802	S	S	*	*			trans	-97.3	137.6	-175.5	169	0	0	0	0	110.1	K155	V153-K155 HydrophobicContact CG1-CG 3.83Å
154	E	28.1	Very low	27.5	Very low	202 Å²	202	156.4 Å²	156.4	94%	0.944	81%	0.81	S	S	*	*			trans	-130.6	121.7	140.7	-92.2	-168.6	163.4	0	0	111.4
155	K	25.4	Very low	27.6	Very low	184 Å²	184	155 Å²	155	80%	0.8	80%	0.803	S	S	*	*			trans	-81.3	147.2	178.4	-72.1	169.5	172.4	178.3	0	110	V153	V153-K155 HydrophobicContact CG1-CG 3.83Å
156	L	29.3	Very low	28	Very low	178 Å²	178	160.2 Å²	160.2	93%	0.932	82%	0.815	S	S	*	*			trans	-149.9	109.4	141.4	-101.7	158.3	0	0	0	109.6
157	S	25.3	Very low	27.9	Very low	99 Å²	99	159.8 Å²	159.8	69%	0.692	82%	0.816	S	S	*	*			trans	-85.8	140.5	168.9	48.9	0	0	0	0	110.4
158	V	28.9	Very low	28	Very low	131 Å²	131	159.3 Å²	159.3	79%	0.794	82%	0.82	S	S	*	*			trans	-157.2	111.6	143.8	179.4	0	0	0	0	110.8
159	D	28.8	Very low	28.2	Very low	151 Å²	151	154.6 Å²	154.6	81%	0.807	82%	0.82	S	S	*	*			trans	48.6	123	137.3	-54.9	-22.8	0	0	0	125.3
160	D	27.4	Very low	28	Very low	154 Å²	154	152.3 Å²	152.3	82%	0.824	82%	0.817	S	S	*	*			trans	-59.7	137.2	155.6	-75.2	-44.2	0	0	0	113
161	Q	32.2	Very low	28.2	Very low	172 Å²	172	150.3 Å²	150.3	80%	0.804	82%	0.82	S	S	*	*			trans	-142.1	123.6	140.6	-75	-153.6	0.9	0	0	112.7
162	N	27.3	Very low	28	Very low	152 Å²	152	151.6 Å²	151.6	81%	0.813	82%	0.822	S	S	*	*			trans	-58.7	140.3	172	-75.6	-59.8	0	0	0	113.9
163	Y	30.6	Very low	28	Very low	208 Å²	208	151.5 Å²	151.5	82%	0.816	82%	0.82	S	S	*	*			trans	-138.7	105.7	145.5	-76	-76.3	0	0	0	111.8
164	K	27.7	Very low	28	Very low	196 Å²	196	152.8 Å²	152.8	85%	0.852	82%	0.824	S	S	*	*			trans	-67	144.7	153.8	-106.9	174.3	173.5	173.9	0	108.6
165	L	29.6	Very low	27.9	Very low	146 Å²	146	152 Å²	152	76%	0.764	82%	0.82	S	S	*	*			trans	-178.6	113.6	132.3	-95.3	154.6	0	0	0	113.4
166	K	30.1	Very low	27.9	Very low	192 Å²	192	147.7 Å²	147.7	84%	0.835	81%	0.813	S	S	*	*			trans	60.5	121.1	133.4	-73	178.7	-171.1	-179.2	0	122.7
167	E	26.2	Very low	27.8	Very low	201 Å²	201	147.6 Å²	147.6	94%	0.939	81%	0.805	S	S	*	*			trans	-52.9	150.6	155.3	-64.2	172.8	142.5	0	0	113.9
168	G	27.7	Very low	27.7	Very low	81 Å²	81	149.7 Å²	149.7	84%	0.835	81%	0.814	S	S	*	*			trans	156.6	119.9	153.9	0	0	0	0	0	114.3
169	G	29.5	Very low	27.7	Very low	83 Å²	83	149 Å²	149	86%	0.856	81%	0.81	S	S	*	*			trans	117	99.4	153.4	0	0	0	0	0	115.2
170	G	25.9	Very low	27.5	Very low	79 Å²	79	150.6 Å²	150.6	81%	0.814	81%	0.813	S	S	*	*			trans	-74.1	155.9	173.6	0	0	0	0	0	113.8
171	V	29.3	Very low	27.5	Very low	139 Å²	139	150.9 Å²	150.9	84%	0.842	81%	0.813	S	S	*	*			trans	-141.1	124.3	153.5	179.7	0	0	0	0	107.6
172	Q	24.1	Very low	27.1	Very low	176 Å²	176	147.3 Å²	147.3	82%	0.822	81%	0.805	S	S	*	*			trans	-92.9	129.9	172.2	176.3	178	7.7	0	0	107.3
173	L	27.6	Very low	27.1	Very low	147 Å²	147	145.9 Å²	145.9	77%	0.77	80%	0.804	S	S	*	*			trans	-167.3	109	154.5	-106.1	136.4	0	0	0	112.1
174	D	27.9	Very low	27.1	Very low	138 Å²	138	143.4 Å²	143.4	74%	0.738	80%	0.804	S	S	*	*			trans	66.3	121.3	134.5	-64.7	-7.5	0	0	0	124.4
175	Q	25	Very low	27.1	Very low	186 Å²	186	142.6 Å²	142.6	87%	0.869	80%	0.803	S	S	*	*			trans	-40.3	132.4	157.2	-62	163.8	-4.6	0	0	113.4
176	S	24.9	Very low	27.1	Very low	93 Å²	93	144.5 Å²	144.5	65%	0.65	81%	0.808	S	S	*	*				161.6	156.5	121.8	46.9	0	0	0	0	111.9
177	F	27.2	Very low	27.2	Very low	176 Å²	176	139.7 Å²	139.7	77%	0.772	80%	0.798	S	S	*	*			trans	94.3	86.1	167.2	-54.2	-71.3	0	0	0	118.3	T179	F177-T179 PolarHBondContact O-N 3.02Å
178	T	24.1	Very low	27.5	Very low	143 Å²	143	138 Å²	138	88%	0.877	80%	0.796	S	S	*	*			trans	-39.9	118.7	138.3	46.6	0	0	0	0	111.3
179	T	28.2	Very low	27.8	Very low	117 Å²	117	140.2 Å²	140.2	72%	0.718	79%	0.789	S	S	*	*			trans	-140.9	118.9	157.6	-28.4	0	0	0	0	107.8	F177 I181	F177-T179 PolarHBondContact O-N 3.02Å; T179-I181 PolarHBondContact O-N 2.94Å
180	E	24.7	Very low	28	Very low	184 Å²	184	146.7 Å²	146.7	86%	0.86	79%	0.789	S	S	*	*			trans	-55.3	115.2	170.4	-66.3	170	163.6	0	0	108.8	C182	E180-C182 PolarHBondContact O-N 2.92Å
181	I	27	Very low	28.5	Very low	160 Å²	160	153.4 Å²	153.4	82%	0.821	79%	0.791	S	S	*	*			trans	-93.3	94.9	170.2	-58.9	177	0	0	0	106.2	T179	T179-I181 PolarHBondContact O-N 2.94Å
182	C	23.9	Very low	28.6	Very low	96 Å²	96	152.7 Å²	152.7	65%	0.649	79%	0.792	S	S	*	*			trans	-57.7	130.9	160.2	-67.1	0	0	0	0	108.1	E180 I184	E180-C182 PolarHBondContact O-N 2.92Å; C182-I184 PolarHBondContact O-N 3.45Å; C182-I184 VanDerWaalsContact O-N 3.07Å
183	P	28.8	Very low	29.3	Very low	122 Å²	122	148.4 Å²	148.4	79%	0.792	78%	0.781	S	S	*	*			trans	-66.4	113.5	164.8	26.9	-27.1	0	0	0	107.1	E185	P183-E185 PolarHBondContact O-N 3.23Å
184	I	29.4	Very low	29.5	Very low	157 Å²	157	148.4 Å²	148.4	81%	0.805	78%	0.782	S	S	*	*			trans	-57.1	124	175.1	-68.4	164.8	0	0	0	108	C182 E186	C182-I184 PolarHBondContact O-N 3.45Å; C182-I184 VanDerWaalsContact O-N 3.07Å; I184-E186 PolarHBondContact O-N 3.09Å
185	E	28	Very low	29.9	Very low	178 Å²	178	152 Å²	152	83%	0.832	79%	0.792	S	S	*	*			trans	-60	118.1	171.5	-64	177.4	160.8	0	0	109.3	P183 S187	P183-E185 PolarHBondContact O-N 3.23Å; E185-S187 PolarHBondContact O-N 3.4Å; E185-S187 VanDerWaalsContact O-N 3.09Å
186	E	30.4	Very low	30.4	Very low	187 Å²	187	147.9 Å²	147.9	87%	0.874	78%	0.783	S	S	*	*			trans	-70.9	100	162	-76.1	-177.1	162.5	0	0	107.5	I184 D188	I184-E186 PolarHBondContact O-N 3.09Å; E186-D188 PolarHBondContact O-N 3.32Å
187	S	31.2	Very low	30.8	Very low	90 Å²	90	150.4 Å²	150.4	63%	0.629	79%	0.79	S	S	*	*			trans	-70.6	105.3	173.6	58.1	0	0	0	0	110.3	E185 N189	E185-S187 PolarHBondContact O-N 3.4Å; E185-S187 VanDerWaalsContact O-N 3.09Å; S187-N189 VanDerWaalsContact C-N 3.3Å; S187-N189 PolarHBondContact O-N 3.07Å
188	D	32.4	Very low	31.1	Very low	166 Å²	166	150.7 Å²	150.7	89%	0.888	79%	0.793	S	S	*	*			trans	-74.8	84.5	163.7	-76.1	-26	0	0	0	109.4	E186	E186-D188 PolarHBondContact O-N 3.32Å
189	N	33.5	Very low	31.4	Very low	128 Å²	128	149.6 Å²	149.6	68%	0.684	79%	0.792	S	S	*	*			trans	-98.5	144.2	164	-83.4	-40.8	0	0	0	109.8	S187	S187-N189 VanDerWaalsContact C-N 3.3Å; S187-N189 PolarHBondContact O-N 3.07Å
190	Y	35.5	Very low	31.4	Very low	218 Å²	218	149.1 Å²	149.1	86%	0.855	79%	0.793	S	S	*	*			trans	102.8	93.7	170.7	-71.1	-88.5	0	0	0	117.3
191	Y	35.2	Very low	31.6	Very low	221 Å²	221	145.2 Å²	145.2	87%	0.867	79%	0.786	S	S	*	*				-165.3	103.1	104.2	-119.4	-94.2	0	0	0	109.4
192	S	32.2	Very low	31.8	Very low	123 Å²	123	146.3 Å²	146.3	86%	0.86	79%	0.793	S	S	*	*			trans	-82.4	122.4	161	-68.3	0	0	0	0	108.5
193	S	38.3	Very low	31.9	Very low	86 Å²	86	146.2 Å²	146.2	60%	0.601	79%	0.793	S	S	*	*			trans	-158.3	99.5	154.8	59	0	0	0	0	109.7
194	D	33	Very low	32	Very low	147 Å²	147	145.4 Å²	145.4	79%	0.786	79%	0.79	S	S	*	*			trans	40.7	91.4	131.9	-53.8	-17.8	0	0	0	118.1
195	F	35.9	Very low	32.1	Very low	215 Å²	215	145.9 Å²	145.9	94%	0.943	79%	0.792	S	S	*	*			trans	-149.4	95	138.4	-86.8	-74.3	0	0	0	108.7
196	S	35.1	Very low	32.1	Very low	98 Å²	98	142.5 Å²	142.5	69%	0.685	79%	0.788	S	S	*	*			trans	-74.9	127.2	155.9	52.4	0	0	0	0	108.2
197	D	33.8	Very low	32.2	Very low	147 Å²	147	139.8 Å²	139.8	79%	0.786	79%	0.787	S	S	*	*				170.9	139.5	113.9	-80.7	-21.8	0	0	0	111.9
198	E	32.7	Very low	32.2	Very low	182 Å²	182	140.8 Å²	140.8	85%	0.85	79%	0.794	S	S	*	*			trans	96	118.2	154.4	-51.8	-139	142.6	0	0	121.5
199	S	30.8	Very low	32	Very low	120 Å²	120	142.4 Å²	142.4	84%	0.839	79%	0.793	S	S	*	*			trans	91.8	73.6	152	71.8	0	0	0	0	118.7
200	S	28	Very low	31.9	Very low	107 Å²	107	141.3 Å²	141.3	75%	0.748	79%	0.792	S	S	*	*			trans	-69.7	156.1	153.1	51.4	0	0	0	0	113.4
201	S	29.3	Very low	31.8	Very low	101 Å²	101	137.9 Å²	137.9	71%	0.706	78%	0.783	S	S	*	*			trans	74.9	112.6	147.6	65.2	0	0	0	0	119.2
202	L	30.3	Very low	31.6	Very low	184 Å²	184	135.2 Å²	135.2	96%	0.963	78%	0.776	S	S	*	*				-158.5	95.9	121.4	-99	159.8	0	0	0	108.6
203	S	27	Very low	31.6	Very low	94 Å²	94	135.8 Å²	135.8	66%	0.657	77%	0.769	S	S	*	*			trans	-86.5	142.9	170.3	51.4	0	0	0	0	110.9
204	S	29.4	Very low	31.5	Very low	105 Å²	105	138.7 Å²	138.7	73%	0.734	78%	0.777	S	S	*	*			trans	42.8	103.9	140.6	64.1	0	0	0	0	118.9
205	I	32.6	Very low	31.6	Very low	166 Å²	166	136 Å²	136	85%	0.851	77%	0.769	S	S	*	*			trans	-141.9	117.5	149.3	-59.4	-177.8	0	0	0	109.7
206	S	27.1	Very low	31.7	Very low	107 Å²	107	134.5 Å²	134.5	75%	0.748	76%	0.762	S	S	*	*			trans	-76.5	144.9	165	45.4	0	0	0	0	110.5
207	P	32.5	Very low	31.8	Very low	131 Å²	131	134.5 Å²	134.5	85%	0.851	76%	0.755	S	S	*	*			trans	-96.3	126.5	-177.6	34.1	-27.7	0	0	0	111.5
208	S	30.7	Very low	31.9	Very low	111 Å²	111	137.7 Å²	137.7	78%	0.776	76%	0.756	S	S	*	*			trans	-145	117.7	152.1	61.4	0	0	0	0	112.1
209	K	29.5	Very low	32	Very low	200 Å²	200	134.3 Å²	134.3	87%	0.87	75%	0.748	S	S	*	*			trans	73	111.9	134.4	-99.2	178	-174	176.3	0	120.6
210	T	30.1	Very low	32.4	Very low	105 Å²	105	135 Å²	135	64%	0.644	74%	0.742	S	S	*	*				118.4	109.2	115.9	-32.7	0	0	0	0	118.4
211	Q	33.5	Very low	32.8	Very low	146 Å²	146	136.3 Å²	136.3	68%	0.682	74%	0.741	S	S	*	*			trans	68.9	133.6	134	-70.2	178.2	19.6	0	0	124.4
212	K	31.8	Very low	33.3	Very low	165 Å²	165	137.9 Å²	137.9	72%	0.717	74%	0.741	S	S	*	*			trans	79.3	134.5	133.4	-83.6	173.7	-176.8	165	0	116.4
213	L	33.1	Very low	33.6	Very low	135 Å²	135	137.3 Å²	137.3	71%	0.707	73%	0.733	S	S	*	*			cis	-164.3	148.8	28.6	-91.1	125.2	0	0	0	110.5
214	L	34.8	Very low	33.9	Very low	147 Å²	147	140.3 Å²	140.3	77%	0.77	74%	0.737	S	S	*	*			trans	62.1	147.6	136	-64.6	168.2	0	0	0	121
215	S	36.4	Very low	34.3	Very low	90 Å²	90	140.3 Å²	140.3	63%	0.629	73%	0.733	S	S	*	*			cis	165.2	151	-20.9	51.1	0	0	0	0	107.7
216	K	38.1	Very low	34.1	Very low	183 Å²	183	138.2 Å²	138.2	80%	0.796	73%	0.728	S	S	*	*			trans	122.8	136	160.5	-79.1	-176.7	154.3	167.1	0	113.1
217	D	37.3	Very low	34.4	Very low	99 Å²	99	142 Å²	142	53%	0.529	73%	0.731	S	S	.	*			cis	-163.6	140.9	6.8	-107.4	-31.8	0	0	0	109.3
218	R	35.8	Very low	34.3	Very low	214 Å²	214	141.6 Å²	141.6	81%	0.808	73%	0.726	S	S	*	*			trans	67.1	146.2	135.3	-67.9	174.3	175.3	166.8	-3.3	121.9
219	T	34.5	Very low	33.9	Very low	110 Å²	110	141.8 Å²	141.8	68%	0.675	73%	0.726	S	S	*	*			cis	167.9	149.9	-30.4	29.6	0	0	0	0	106.5
220	N	37.9	Very low	33.7	Very low	136 Å²	136	140.8 Å²	140.8	73%	0.727	73%	0.725	S	S	*	*			trans	143.4	104.2	147.5	-71.7	0	0	0	0	110.4
221	N	37.2	Very low	33.6	Very low	133 Å²	133	140.6 Å²	140.6	71%	0.711	73%	0.728	S	S	*	*				83.9	130.1	84.2	-83.1	36.9	0	0	0	110.6
222	D	38.8	Very low	33.2	Very low	134 Å²	134	141.2 Å²	141.2	72%	0.717	73%	0.734	S	S	*	*			cis	-159.1	163.7	24.5	-73	-45.9	0	0	0	112.6
223	E	37.6	Very low	33.1	Very low	172 Å²	172	139 Å²	139	80%	0.804	74%	0.739	S	S	*	*			trans	-23.3	163	158.2	-68.5	165.3	171.9	0	0	118.8
224	E	34.3	Very low	32.7	Very low	157 Å²	157	139 Å²	139	73%	0.734	75%	0.745	S	S	*	*			cis	-172.3	156.9	17.1	-128.7	-176.3	166.2	0	0	110.6
225	T	35.7	Very low	32.6	Very low	106 Å²	106	138.9 Å²	138.9	65%	0.65	75%	0.751	S	S	*	*			trans	76.8	109.3	146.5	57.9	0	0	0	0	125.3
226	T	29.8	Very low	32	Very low	121 Å²	121	146.4 Å²	146.4	74%	0.742	77%	0.765	S	S	*	*				82.8	125.4	125.9	61.2	0	0	0	0	123.9
227	K	33.9	Very low	31.7	Very low	187 Å²	187	143.2 Å²	143.2	81%	0.813	77%	0.766	S	S	*	*			trans	93.1	116.8	140.6	-78	174	-176.8	-178.8	0	120.6
228	T	28.6	Very low	31.4	Very low	123 Å²	123	143.9 Å²	143.9	76%	0.755	78%	0.779	S	S	*	*			trans	65.2	116.8	140.2	40.2	0	0	0	0	121.4
229	C	23.3	Very low	31.1	Very low	114 Å²	114	136.6 Å²	136.6	77%	0.77	77%	0.77	S	S	*	*			trans	65.5	134.4	135.3	-66.7	0	0	0	0	121.9
230	E	26.1	Very low	30.8	Very low	179 Å²	179	142.1 Å²	142.1	84%	0.836	79%	0.785	S	S	*	*			trans	87.2	129.6	150.1	-73.4	174.1	-167.1	0	0	120.8
231	S	27.4	Very low	30.2	Very low	102 Å²	102	141.6 Å²	141.6	71%	0.713	79%	0.787	S	S	*	*			trans	86.3	111.2	147.5	64.9	0	0	0	0	120.4
232	I	24.8	Very low	29.8	Very low	158 Å²	158	143.5 Å²	143.5	81%	0.81	79%	0.794	S	S	*	*				45.1	113.8	129.3	-52.7	165	0	0	0	116.6
233	S	29.2	Very low	29.2	Very low	118 Å²	118	141.5 Å²	141.5	83%	0.825	79%	0.79	S	S	*	*			trans	-160.7	131.2	140.1	-67.5	0	0	0	0	112
234	T	25.3	Very low	28.8	Very low	137 Å²	137	143 Å²	143	84%	0.84	80%	0.795	S	S	*	*			trans	-68.7	149.1	169.2	35.4	0	0	0	0	112.8
235	T	31.6	Very low	28.4	Very low	144 Å²	144	144.7 Å²	144.7	88%	0.883	80%	0.799	S	S	*	*			trans	-136.6	121.1	162.4	44.8	0	0	0	0	112.3
236	R	25.4	Very low	28.1	Very low	248 Å²	248	146.8 Å²	146.8	94%	0.936	81%	0.812	S	S	*	*			trans	-74	149.4	168.2	-74.2	161.2	92.8	178.2	7.7	111.6
237	S	30.4	Very low	28	Very low	115 Å²	115	145.8 Å²	145.8	80%	0.804	81%	0.806	S	S	*	*			trans	178.9	150.6	130.1	72.8	0	0	0	0	106.6
238	S	32.4	Very low	27.9	Very low	114 Å²	114	144.8 Å²	144.8	80%	0.797	81%	0.809	S	S	*	*			cis	-171	136.4	9.3	44.5	0	0	0	0	103.9
239	G	27.9	Very low	28	Very low	61 Å²	61	145.1 Å²	145.1	63%	0.629	81%	0.806	S	S	*	*				116.7	124	65.7	0	0	0	0	0	109.1
240	F	29.5	Very low	28.5	Very low	225 Å²	225	150.1 Å²	150.1	99%	0.987	82%	0.815	S	S	*	*			trans	-172.4	122.7	149.1	-91.9	-66.1	0	0	0	109.2
241	T	25.4	Very low	28.7	Very low	126 Å²	126	148.1 Å²	148.1	77%	0.773	81%	0.81	S	S	*	*			trans	-119.6	137.7	-179.6	-42.5	0	0	0	0	108.6
242	M	28.5	Very low	28.9	Very low	173 Å²	173	150.8 Å²	150.8	85%	0.852	82%	0.817	S	S	*	*			trans	-144.9	136.5	152.2	-81.3	-58.2	-76.3	0	0	109.9	F244	M242-F244 HydrophobicContact CE-CE2 4.49Å
243	S	26	Very low	29.2	Very low	91 Å²	91	146.8 Å²	146.8	64%	0.636	82%	0.815	S	S	*	*			trans	-127.3	141	-168.9	43.3	0	0	0	0	111.3
244	F	29.6	Very low	29.3	Very low	205 Å²	205	149.9 Å²	149.9	90%	0.899	82%	0.816	S	S	*	*			trans	-144.1	126	157.8	-87.7	-80.4	0	0	0	111.4	M242	M242-F244 HydrophobicContact CE-CE2 4.49Å
245	K	25.5	Very low	29.5	Very low	192 Å²	192	150.2 Å²	150.2	84%	0.835	81%	0.813	S	S	*	*			trans	-97.3	143.3	170.6	-84.3	177.5	170.7	179	0	109.2
246	V	29.9	Very low	29.5	Very low	150 Å²	150	151.2 Å²	151.2	91%	0.909	81%	0.809	S	S	*	*			trans	-141.4	126.6	143.4	-179.5	0	0	0	0	108.6
247	T	26.9	Very low	29.7	Very low	100 Å²	100	147.4 Å²	147.4	61%	0.613	81%	0.808	S	S	*	*			trans	-87.8	152.9	178.8	40.4	0	0	0	0	111.7
248	D	32.7	Very low	29.8	Very low	165 Å²	165	148.3 Å²	148.3	88%	0.882	81%	0.808	S	S	*	*				-163.4	136.1	128.3	-93.7	-19.6	0	0	0	112.3
249	N	30	Very low	29.8	Very low	131 Å²	131	149.7 Å²	149.7	70%	0.701	81%	0.806	S	S	*	*			trans	-88.7	146.4	-170	-64.4	-38.9	0	0	0	112.6
250	F	33.2	Very low	29.9	Very low	218 Å²	218	153 Å²	153	96%	0.956	81%	0.809	S	S	*	*			trans	-149.3	122.4	139.3	-88.4	-74	0	0	0	111.2
251	N	31.3	Very low	30.1	Very low	137 Å²	137	150.4 Å²	150.4	73%	0.733	80%	0.797	S	S	*	*			trans	-47.2	163.2	165.8	-64.6	-5.8	0	0	0	112.9
252	D	31.7	Very low	30.7	Very low	158 Å²	158	151.5 Å²	151.5	85%	0.845	79%	0.794	S	S	*	*			cis	-163.1	155.7	15.5	-102	-33.7	0	0	0	105.7
253	G	31.1	Very low	31	Very low	75 Å²	75	151.2 Å²	151.2	77%	0.773	79%	0.79	S	S	*	*			trans	138.4	99.6	159.6	0	0	0	0	0	115.5
254	E	30.2	Very low	31.5	Very low	183 Å²	183	150.8 Å²	150.8	86%	0.855	79%	0.785	S	S	*	*			trans	-41.8	126.1	173.4	-57.9	172.9	152.1	0	0	114.4
255	N	30.7	Very low	31.7	Very low	143 Å²	143	145.4 Å²	145.4	77%	0.765	77%	0.766	S	S	*	*				174.3	125.1	126	-92	-45.2	0	0	0	113.4
256	M	31.7	Very low	32	Very low	166 Å²	166	145.8 Å²	145.8	82%	0.818	76%	0.762	S	S	*	*			trans	65.2	110.8	151	-59.5	-62.3	178.8	0	0	119.6	V258	M256-V258 PolarHBondContact O-N 3.03Å; M256-V258 VanDerWaalsContact O-N 3.13Å
257	N	29	Very low	32.4	Very low	168 Å²	168	145.2 Å²	145.2	90%	0.898	75%	0.754	S	S	*	*			trans	-53	107.3	168.7	-66.6	-26.9	0	0	0	112.1
258	V	31.7	Very low	33	Very low	134 Å²	134	146.2 Å²	146.2	81%	0.812	75%	0.754	S	S	*	*			trans	-103	108	157.9	-179.8	0	0	0	0	106.3	M256 D260	M256-V258 PolarHBondContact O-N 3.03Å; M256-V258 VanDerWaalsContact O-N 3.13Å; V258-D260 PolarHBondContact O-N 3.15Å
259	L	32.4	Very low	33.5	Very low	143 Å²	143	141.6 Å²	141.6	75%	0.749	74%	0.735	S	S	*	*			trans	-61.4	116.6	171	-91.9	129.9	0	0	0	108.6	F261	L259-F261 HydrophobicContact CB-CE2 4.32Å; L259-F261 WeakPolarHBondContact O-CD2 3.41Å
260	D	31.3	Very low	34.2	Very low	131 Å²	131	142.2 Å²	142.2	70%	0.701	73%	0.733	S	S	*	*			trans	-80.9	113.3	178.8	-161	-0.7	0	0	0	109.6	V258 E262	V258-D260 PolarHBondContact O-N 3.15Å; D260-E262 VanDerWaalsContact C-N 3.34Å; D260-E262 PolarHBondContact O-N 2.62Å
261	F	33.2	Very low	34.8	Very low	169 Å²	169	138.1 Å²	138.1	74%	0.741	72%	0.717	S	S	*	*			trans	-85.1	2.8	-171.3	-79.7	-89.3	0	0	0	114	L259 P264	L259-F261 HydrophobicContact CB-CE2 4.32Å; L259-F261 WeakPolarHBondContact O-CD2 3.41Å; F261-P264 WeakPolarHBondContact O-CD 3.46Å
262	E	37.3	Very low	35.6	Very low	149 Å²	149	135.7 Å²	135.7	70%	0.696	71%	0.707	S	S	*	*			trans	-84.3	-10	-169.3	-70	-158.2	163.1	0	0	116.5	D260	D260-E262 VanDerWaalsContact C-N 3.34Å; D260-E262 PolarHBondContact O-N 2.62Å
263	Q	36.5	Very low	36.4	Very low	167 Å²	167	130.9 Å²	130.9	78%	0.78	69%	0.685	S	S	*	*	S	Bend	trans	-81.1	-25.2	-175	-71	-171.3	-5.6	0	0	118.1	N265	Q263-N265 PolarHBondContact O-N 3.43Å
264	P	34.7	Very low	37.5	Very low	82 Å²	82	129.6 Å²	129.6	53%	0.532	67%	0.665	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.5	-27.6	-177.2	-13.1	27.7	0	0	0	113.8	F261 R266	F261-P264 WeakPolarHBondContact O-CD 3.46Å; P264-R266 PolarHBondContact O-N 3.1Å
265	N	35.2	Very low	38.5	Very low	92 Å²	92	125.9 Å²	125.9	49%	0.492	65%	0.651	S	S	.	*	H	α-helix	trans	-75.2	-19.8	-168.1	-71.9	-19.9	0	0	0	114.2	Q263 E305	Q263-N265 PolarHBondContact O-N 3.43Å; N265-E305 PolarHBondContact ND2-OE1 3.1Å
266	R	32	Very low	39.8	Very low	201 Å²	201	122.3 Å²	122.3	76%	0.758	63%	0.634	S	S	*	*	H	α-helix	trans	-83.9	-25.6	178.6	-76.9	-175.8	-179.6	153	4.5	114.4	P264 S269	P264-R266 PolarHBondContact O-N 3.1Å; R266-S269 PolarHBondContact O-OG 3.07Å; R266-S269 VanDerWaalsContact O-OG 3.13Å
267	L	37.4	Very low	41.1	Very low	138 Å²	138	121.1 Å²	121.1	72%	0.723	62%	0.624	S	S	*	*	H	α-helix	trans	-85.3	-29.9	179.3	-69.5	172.8	0	0	0	112.2
268	L	40.2	Very low	42.5	Very low	121 Å²	121	116.5 Å²	116.5	63%	0.634	60%	0.604	S	S	*	*	H	α-helix	trans	-70.6	-31.2	177.1	-149.3	73.7	0	0	0	112.2	H270 H271 V272	L268-H270 PolarHBondContact O-N 3.38Å; L268-H271 PolarHBondContact O-N 3.07Å; L268-V272 WeakPolarHBondContact O-CG2 3.32Å; L268-V272 PolarHBondContact O-N 3.06Å
269	S	43	Very low	43.4	Very low	68 Å²	68	118.5 Å²	118.5	48%	0.476	60%	0.597	S	S	.	*	H	α-helix	trans	-67	-32.7	-179.6	75.5	0	0	0	0	113.4	R266 S273	R266-S269 PolarHBondContact O-OG 3.07Å; R266-S269 VanDerWaalsContact O-OG 3.13Å; S269-S273 WeakPolarHBondContact O-CB 3.45Å; S269-S273 PolarHBondContact O-N 3.19Å
270	H	44.4	Very low	44.6	Very low	144 Å²	144	113.3 Å²	113.3	67%	0.667	58%	0.575	S	S	*	*	H	α-helix	trans	-69.9	-40.4	176.9	-99.3	-75.9	0	0	0	112.5	L268 S273 S274	L268-H270 PolarHBondContact O-N 3.38Å; H270-S273 PolarHBondContact O-N 3.4Å; H270-S274 PolarHBondContact O-N 3.31Å; H270-S274 PolarHBondContact O-OG 3.25Å
271	H	46.5	Very low	45.9	Very low	132 Å²	132	111.2 Å²	111.2	61%	0.611	56%	0.564	S	S	*	*	H	α-helix	trans	-65.9	-43.1	176	-98	-67.4	0	0	0	111.7	L268 S274 N275	L268-H271 PolarHBondContact O-N 3.07Å; H271-S274 PolarHBondContact O-N 2.73Å; H271-S274 PolarHBondContact O-OG 3.32Å; H271-N275 PolarHBondContact O-N 3.27Å
272	V	46.4	Very low	46.9	Very low	85 Å²	85	107.3 Å²	107.3	52%	0.515	55%	0.551	S	S	.	*	H	α-helix	trans	-63	-43.8	175.2	177.4	0	0	0	0	110.9	L268 S274 N275 V276	L268-V272 WeakPolarHBondContact O-CG2 3.32Å; L268-V272 PolarHBondContact O-N 3.06Å; V272-S274 PolarHBondContact O-N 3.19Å; V272-N275 PolarHBondContact O-N 3.17Å; V272-V276 HydrophobicContact CG1-CG2 4.36Å; V272-V276 VanDerWaalsContact O-CG2 3.28Å; V272-V276 WeakPolarHBondContact O-CG2 3.35Å; V272-V276 PolarHBondContact O-N 3.34Å
273	S	50.2	Low	47.7	Very low	57 Å²	57	103.4 Å²	103.4	40%	0.399	53%	0.534	S	S	.	.	H	α-helix	trans	-61.3	-40.9	176.2	-174	0	0	0	0	112.6	S269 H270 V276 K277	S269-S273 WeakPolarHBondContact O-CB 3.45Å; S269-S273 PolarHBondContact O-N 3.19Å; H270-S273 PolarHBondContact O-N 3.4Å; S273-V276 PolarHBondContact O-N 3.44Å; S273-K277 WeakPolarHBondContact O-CG 3.29Å; S273-K277 PolarHBondContact O-N 3.17Å
274	S	52.6	Low	48.3	Very low	49 Å²	49	97.9 Å²	97.9	34%	0.343	51%	0.51	S	S	.	.	H	α-helix	trans	-65.5	-40.1	176.5	71.4	0	0	0	0	112.6	H270 H271 V272 K277 C278	H270-S274 PolarHBondContact O-N 3.31Å; H270-S274 PolarHBondContact O-OG 3.25Å; H271-S274 PolarHBondContact O-N 2.73Å; H271-S274 PolarHBondContact O-OG 3.32Å; V272-S274 PolarHBondContact O-N 3.19Å; S274-K277 PolarHBondContact O-N 3.41Å; S274-C278 PolarHBondContact O-N 3.29Å; S274-C278 PolarHBondContact O-SG 3.46Å; S274-C278 VanDerWaalsContact O-SG 3.32Å
275	N	51.9	Low	49.2	Very low	105 Å²	105	101.5 Å²	101.5	56%	0.561	52%	0.517	S	S	*	.	H	α-helix	trans	-69.3	-37.9	177.2	-72.3	-13.3	0	0	0	112.1	H271 V272 C278 R279	H271-N275 PolarHBondContact O-N 3.27Å; V272-N275 PolarHBondContact O-N 3.17Å; N275-C278 PolarHBondContact O-N 3.34Å; N275-R279 WeakPolarHBondContact O-CB 3.35Å; N275-R279 PolarHBondContact O-N 2.9Å
276	V	58.2	Low	49.9	Very low	68 Å²	68	101 Å²	101	41%	0.412	51%	0.514	S	S	.	.	H	α-helix	trans	-64.4	-40.6	173.1	173	0	0	0	0	110.6	V272 S273 R279 A280	V272-V276 HydrophobicContact CG1-CG2 4.36Å; V272-V276 VanDerWaalsContact O-CG2 3.28Å; V272-V276 WeakPolarHBondContact O-CG2 3.35Å; V272-V276 PolarHBondContact O-N 3.34Å; S273-V276 PolarHBondContact O-N 3.44Å; V276-R279 PolarHBondContact O-N 2.92Å; V276-A280 VanDerWaalsContact O-CB 3.23Å; V276-A280 WeakPolarHBondContact O-CB 3.43Å; V276-A280 PolarHBondContact O-N 3.27Å
277	K	59.2	Low	50.9	Low	140 Å²	140	92.7 Å²	92.7	61%	0.609	49%	0.486	S	S	*	.	H	α-helix	trans	-65.6	-43.7	174.4	-77.5	-178.1	-179.7	-177.1	0	112.9	S273 S274 A280 N281	S273-K277 WeakPolarHBondContact O-CG 3.29Å; S273-K277 PolarHBondContact O-N 3.17Å; S274-K277 PolarHBondContact O-N 3.41Å; K277-A280 PolarHBondContact O-N 3.13Å; K277-N281 WeakPolarHBondContact O-CB 3.14Å; K277-N281 PolarHBondContact O-N 3.31Å
278	C	59.1	Low	51.1	Low	71 Å²	71	89.9 Å²	89.9	48%	0.48	49%	0.49	S	S	.	.	H	α-helix	trans	-61.7	-45.3	174.6	-69.6	0	0	0	0	110.9	S274 N275 A280 N281 D282	S274-C278 PolarHBondContact O-N 3.29Å; S274-C278 PolarHBondContact O-SG 3.46Å; S274-C278 VanDerWaalsContact O-SG 3.32Å; N275-C278 PolarHBondContact O-N 3.34Å; C278-A280 PolarHBondContact O-N 3.29Å; C278-N281 PolarHBondContact O-N 2.99Å; C278-D282 VanDerWaalsContact O-CG 3.3Å; C278-D282 PolarHBondContact O-N 2.92Å
279	R	49.1	Very low	51.3	Low	177 Å²	177	85.4 Å²	85.4	67%	0.668	47%	0.466	S	S	*	.	H	α-helix	trans	-65.2	-38.5	176.9	-171.4	170	-178.4	161.7	-0.3	112.6	N275 V276 D282 L283	N275-R279 WeakPolarHBondContact O-CB 3.35Å; N275-R279 PolarHBondContact O-N 2.9Å; V276-R279 PolarHBondContact O-N 2.92Å; R279-D282 PolarHBondContact O-N 3.29Å; R279-L283 HydrophobicContact CG-CD1 4.21Å; R279-L283 VanDerWaalsContact O-CB 3.31Å; R279-L283 WeakPolarHBondContact O-CB 3.02Å; R279-L283 WeakPolarHBondContact O-CG 3.07Å; R279-L283 PolarHBondContact O-N 2.87Å
280	A	59	Low	51.3	Low	34 Å²	34	85.2 Å²	85.2	28%	0.281	47%	0.465	S	S	.	.	H	α-helix	trans	-64.2	-41.5	173.7	0	0	0	0	0	111.2	V276 K277 C278 L283 L284	V276-A280 VanDerWaalsContact O-CB 3.23Å; V276-A280 WeakPolarHBondContact O-CB 3.43Å; V276-A280 PolarHBondContact O-N 3.27Å; K277-A280 PolarHBondContact O-N 3.13Å; C278-A280 PolarHBondContact O-N 3.29Å; A280-L283 CarbonylContact O-C 3.57Å; A280-L283 PolarHBondContact O-N 2.8Å; A280-L284 WeakPolarHBondContact O-CB 3.13Å; A280-L284 PolarHBondContact O-N 3.16Å
281	N	56.9	Low	51.1	Low	86 Å²	86	83.9 Å²	83.9	46%	0.46	46%	0.462	S	S	.	.	H	α-helix	trans	-66.3	-37.7	174.7	-78.8	-18.9	0	0	0	112.8	K277 C278 L284 K285	K277-N281 WeakPolarHBondContact O-CB 3.14Å; K277-N281 PolarHBondContact O-N 3.31Å; C278-N281 PolarHBondContact O-N 2.99Å; N281-L284 WeakPolarHBondContact O-CB 3.26Å; N281-L284 PolarHBondContact O-N 2.79Å; N281-K285 WeakPolarHBondContact O-CG 3.29Å; N281-K285 PolarHBondContact O-N 3.49Å; N281-K285 VanDerWaalsContact O-N 3.14Å
282	D	55.4	Low	51.1	Low	88 Å²	88	84.5 Å²	84.5	47%	0.471	47%	0.47	S	S	.	.	H	α-helix	trans	-69.8	-37	174.9	-68.7	-23.1	0	0	0	111.2	C278 R279 L284 K285 L286	C278-D282 VanDerWaalsContact O-CG 3.3Å; C278-D282 PolarHBondContact O-N 2.92Å; R279-D282 PolarHBondContact O-N 3.29Å; D282-L284 VanDerWaalsContact C-N 3.34Å; D282-K285 PolarHBondContact O-N 3.19Å; D282-L286 WeakPolarHBondContact O-CD1 3.21Å; D282-L286 WeakPolarHBondContact O-CG 3.23Å; D282-L286 PolarHBondContact O-N 3.29Å; D282-L286 VanDerWaalsContact O-N 3.14Å
283	L	52.9	Low	51	Low	67 Å²	67	85.4 Å²	85.4	35%	0.351	47%	0.469	S	S	.	.	H	α-helix	trans	-66.6	-33.9	170.9	-72.8	169.7	0	0	0	112.3	R279 A280 K285 L286 V287 F298	R279-L283 HydrophobicContact CG-CD1 4.21Å; R279-L283 VanDerWaalsContact O-CB 3.31Å; R279-L283 WeakPolarHBondContact O-CB 3.02Å; R279-L283 WeakPolarHBondContact O-CG 3.07Å; R279-L283 PolarHBondContact O-N 2.87Å; A280-L283 CarbonylContact O-C 3.57Å; A280-L283 PolarHBondContact O-N 2.8Å; L283-K285 VanDerWaalsContact C-N 3.27Å; L283-K285 PolarHBondContact O-N 3.46Å; L283-L286 HydrophobicContact CD2-CD1 4.13Å; L283-L286 CarbonylContact O-C 3.36Å; L283-L286 WeakPolarHBondContact O-CA 3.28Å; L283-L286 WeakPolarHBondContact O-CB 3.45Å; L283-L286 PolarHBondContact O-N 2.96Å; L283-V287 PolarHBondContact O-N 3.39Å; L283-F298 HydrophobicContact CD1-CZ 4.2Å
284	L	49.4	Very low	50.7	Low	50 Å²	50	86.4 Å²	86.4	26%	0.262	47%	0.466	S	S	.	.	H	α-helix	trans	-66.7	-30	174.8	-138.1	112.2	0	0	0	112.2	A280 N281 D282 L286 L291	A280-L284 WeakPolarHBondContact O-CB 3.13Å; A280-L284 PolarHBondContact O-N 3.16Å; N281-L284 WeakPolarHBondContact O-CB 3.26Å; N281-L284 PolarHBondContact O-N 2.79Å; D282-L284 VanDerWaalsContact C-N 3.34Å; L284-L286 VanDerWaalsContact C-N 3.34Å; L284-L291 HydrophobicContact CD1-CD2 4.42Å; L284-L291 HydrophobicContact CD1-CG 3.85Å; L284-L291 HydrophobicContact CD2-CD1 3.7Å; L284-L291 HydrophobicContact CD2-CG 3.89Å
285	K	53.9	Low	50.3	Low	158 Å²	158	90 Å²	90	69%	0.687	49%	0.486	S	S	*	.	H	α-helix	trans	-76.4	-24.4	170.6	-67.2	170.6	-174.3	168.3	0	112.1	N281 D282 L283	N281-K285 WeakPolarHBondContact O-CG 3.29Å; N281-K285 PolarHBondContact O-N 3.49Å; N281-K285 VanDerWaalsContact O-N 3.14Å; D282-K285 PolarHBondContact O-N 3.19Å; L283-K285 VanDerWaalsContact C-N 3.27Å; L283-K285 PolarHBondContact O-N 3.46Å
286	L	50.7	Low	50.1	Low	81 Å²	81	89.8 Å²	89.8	42%	0.424	49%	0.493	S	S	.	.	H	α-helix	trans	-84.5	-17.3	178.6	-77.4	158.7	0	0	0	114	D282 L283 L284 Y737	D282-L286 WeakPolarHBondContact O-CD1 3.21Å; D282-L286 WeakPolarHBondContact O-CG 3.23Å; D282-L286 PolarHBondContact O-N 3.29Å; D282-L286 VanDerWaalsContact O-N 3.14Å; L283-L286 HydrophobicContact CD2-CD1 4.13Å; L283-L286 CarbonylContact O-C 3.36Å; L283-L286 WeakPolarHBondContact O-CA 3.28Å; L283-L286 WeakPolarHBondContact O-CB 3.45Å; L283-L286 PolarHBondContact O-N 2.96Å; L284-L286 VanDerWaalsContact C-N 3.34Å; L286-Y737 WeakPolarHBondContact CA-OH 2.94Å; L286-Y737 HydrophobicContact CD2-CD1 4.46Å; L286-Y737 HydrophobicContact CD2-CE1 3.64Å; L286-Y737 PolarHBondContact O-OH 3.22Å
287	V	52.7	Low	49.5	Very low	28 Å²	28	91 Å²	91	17%	0.17	50%	0.5	C	S	.	.	S	Bend	trans	-135.6	104.4	-177.9	-175.1	0	0	0	0	105.8	L283 L289 L803	L283-V287 PolarHBondContact O-N 3.39Å; V287-L289 HydrophobicContact CG1-CB 4.17Å; V287-L289 HydrophobicContact CG1-CD1 3.5Å; V287-L289 HydrophobicContact CG1-CG 3.72Å; V287-L289 PolarHBondContact O-N 3.34Å; V287-L803 HydrophobicContact CG2-CD2 4.36Å
288	G	42.4	Very low	48.8	Very low	78 Å²	78	89.7 Å²	89.7	80%	0.804	50%	0.495	S	S	*	.			trans	-66.3	57.8	-178.6	0	0	0	0	0	114.2
289	L	44.6	Very low	48.1	Very low	27 Å²	27	94.6 Å²	94.6	14%	0.141	51%	0.51	C	S	.	.			trans	-124.1	140.7	-179.8	-65	176.7	0	0	0	109.3	V287 T871	V287-L289 HydrophobicContact CG1-CB 4.17Å; V287-L289 HydrophobicContact CG1-CD1 3.5Å; V287-L289 HydrophobicContact CG1-CG 3.72Å; V287-L289 PolarHBondContact O-N 3.34Å; L289-T871 HydrophobicContact CD2-CG2 3.73Å
290	S	41.7	Very low	47.9	Very low	65 Å²	65	93 Å²	93	46%	0.455	51%	0.514	S	S	.	.			trans	-70.2	148.9	-174.8	50.3	0	0	0	0	113.6	N292	S290-N292 PolarHBondContact O-N 3.17Å
291	L	40.1	Very low	47.5	Very low	115 Å²	115	100.6 Å²	100.6	60%	0.602	54%	0.541	S	S	*	.	G	3₁₀ helix	trans	-53.2	-13.7	-175.7	-94	122	0	0	0	117.5	L284 E293	L284-L291 HydrophobicContact CD1-CD2 4.42Å; L284-L291 HydrophobicContact CD1-CG 3.85Å; L284-L291 HydrophobicContact CD2-CD1 3.7Å; L284-L291 HydrophobicContact CD2-CG 3.89Å; L291-E293 PolarHBondContact O-N 3.17Å
292	N	46.6	Very low	46.9	Very low	145 Å²	145	102.3 Å²	102.3	78%	0.775	56%	0.557	S	S	*	*	G	3₁₀ helix	trans	-81.9	-6	-169.1	-72.9	-1.2	0	0	0	115.2	S290	S290-N292 PolarHBondContact O-N 3.17Å
293	E	45.3	Very low	46.7	Very low	104 Å²	104	103.7 Å²	103.7	49%	0.486	56%	0.563	S	S	.	*	G	3₁₀ helix	trans	-106.6	-0.1	-172.9	-67.1	176.9	172.4	0	0	114.5	L291	L291-E293 PolarHBondContact O-N 3.17Å
294	F	43.1	Very low	46.9	Very low	79 Å²	79	105.6 Å²	105.6	35%	0.346	57%	0.574	S	S	.	*			trans	-109.3	2.6	-168.2	-84.2	-78.6	0	0	0	117.3	S296 V297 F298	F294-S296 PolarHBondContact O-N 2.98Å; F294-S296 VanDerWaalsContact O-N 3.09Å; F294-V297 HydrophobicContact CD1-CB 4.5Å; F294-F298 HydrophobicContact CD1-CE2 4.22Å
295	T	44.5	Very low	46.7	Very low	123 Å²	123	110.2 Å²	110.2	76%	0.755	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.9	-12.3	-169	-24.5	0	0	0	0	114.5
296	S	47.9	Very low	46.3	Very low	102 Å²	102	111.3 Å²	111.3	71%	0.713	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116	2	-177.7	67.6	0	0	0	0	115.9	F294	F294-S296 PolarHBondContact O-N 2.98Å; F294-S296 VanDerWaalsContact O-N 3.09Å
297	V	45.1	Very low	46.4	Very low	93 Å²	93	108.4 Å²	108.4	56%	0.564	59%	0.585	S	S	*	*	S	Bend	trans	-90.3	-15.9	-173	178.3	0	0	0	0	113.2	F294	F294-V297 HydrophobicContact CD1-CB 4.5Å
298	F	44.4	Very low	46.4	Very low	113 Å²	113	112.9 Å²	112.9	50%	0.496	60%	0.602	S	S	.	*	S	Bend	trans	-119.7	18	-173.8	-67.4	-70.8	0	0	0	115.5	L283 F294 L300	L283-F298 HydrophobicContact CD1-CZ 4.2Å; F294-F298 HydrophobicContact CD1-CE2 4.22Å; F298-L300 PolarHBondContact O-N 2.98Å; F298-L300 VanDerWaalsContact O-N 3.11Å
299	E	45.1	Very low	46.6	Very low	173 Å²	173	117 Å²	117	81%	0.808	59%	0.594	S	S	*	*			trans	-85.5	74.7	174.1	-69.8	-168.2	161.6	0	0	111.8
300	L	45	Very low	47.1	Very low	143 Å²	143	119 Å²	119	75%	0.749	61%	0.608	S	S	*	*	P	Polyproline II helix	trans	-81.2	129.9	164.3	-72	171.6	0	0	0	109.8	F298	F298-L300 PolarHBondContact O-N 2.98Å; F298-L300 VanDerWaalsContact O-N 3.11Å
301	K	49.1	Very low	47.3	Very low	194 Å²	194	121.6 Å²	121.6	84%	0.843	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-58.8	141.6	168.8	-98.6	179.2	176	175.4	0	110	I303	K301-I303 PolarHBondContact O-N 2.7Å
302	P	45.4	Very low	48.1	Very low	123 Å²	123	120.8 Å²	120.8	80%	0.799	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-56.2	135.3	170.3	-18.3	29.3	0	0	0	110.5
303	I	50.1	Low	48.1	Very low	116 Å²	116	116.4 Å²	116.4	60%	0.595	59%	0.59	S	S	*	*	P	Polyproline II helix	trans	-56.6	135	170.2	-78.2	167.8	0	0	0	108.9	K301 F308	K301-I303 PolarHBondContact O-N 2.7Å; I303-F308 HydrophobicContact CG2-CB 4.23Å
304	D	58.7	Low	47.9	Very low	108 Å²	108	118 Å²	118	58%	0.578	60%	0.602	S	S	*	*	P	Polyproline II helix	trans	-67.9	154.3	176	63.9	4.6	0	0	0	111.6	Y306 G307 F308	D304-Y306 PolarHBondContact O-N 2.77Å; D304-Y306 VanDerWaalsContact O-N 3.12Å; D304-G307 PolarHBondContact O-N 3.34Å; D304-G307 VanDerWaalsContact O-N 3.09Å; D304-G307 WeakPolarHBondContact OD1-CA 3.42Å; D304-G307 PolarHBondContact OD1-N 3.24Å; D304-F308 PolarHBondContact O-N 2.94Å
305	E	44.5	Very low	47.7	Very low	146 Å²	146	122.2 Å²	122.2	68%	0.682	62%	0.62	S	S	*	*	H	α-helix	trans	-58	-29.6	-176.9	-74	178.8	162.5	0	0	112.6	N265 Y309	N265-E305 PolarHBondContact ND2-OE1 3.1Å; E305-Y309 WeakPolarHBondContact O-CB 3.46Å; E305-Y309 PolarHBondContact O-N 3.09Å
306	Y	44.6	Very low	47.3	Very low	181 Å²	181	121.3 Å²	121.3	71%	0.71	62%	0.617	S	S	*	*	H	α-helix	trans	-72.6	-39.8	178	-147.3	-92.9	0	0	0	112.2	D304 Y309 T310	D304-Y306 PolarHBondContact O-N 2.77Å; D304-Y306 VanDerWaalsContact O-N 3.12Å; Y306-Y309 PolarHBondContact O-N 3.49Å; Y306-T310 WeakPolarHBondContact O-CB 3.3Å; Y306-T310 PolarHBondContact O-N 3.05Å; Y306-T310 PolarHBondContact O-OG1 3.09Å
307	G	52.8	Low	46.7	Very low	20 Å²	20	125.7 Å²	125.7	21%	0.206	62%	0.624	C	S	.	*	H	α-helix	trans	-65	-39.4	173.1	0	0	0	0	0	112.3	D304 T310 L311	D304-G307 PolarHBondContact O-N 3.34Å; D304-G307 VanDerWaalsContact O-N 3.09Å; D304-G307 WeakPolarHBondContact OD1-CA 3.42Å; D304-G307 PolarHBondContact OD1-N 3.24Å; G307-T310 PolarHBondContact O-N 3.45Å; G307-L311 WeakPolarHBondContact O-CB 3.38Å; G307-L311 WeakPolarHBondContact O-CG 3.42Å; G307-L311 PolarHBondContact O-N 3.42Å; G307-L311 VanDerWaalsContact O-N 3.08Å
308	F	53.7	Low	46.3	Very low	123 Å²	123	128.5 Å²	128.5	54%	0.539	64%	0.636	S	S	.	*	H	α-helix	trans	-64.3	-44.7	174.6	-163.9	-91.2	0	0	0	111.9	I303 D304 L311 H312	I303-F308 HydrophobicContact CG2-CB 4.23Å; D304-F308 PolarHBondContact O-N 2.94Å; F308-L311 PolarHBondContact O-N 2.84Å; F308-H312 AromaticContact CD1-ND1 3.79Å; F308-H312 AromaticContact CD2-CE1 3.78Å; F308-H312 AromaticContact CE1-CE1 3.81Å; F308-H312 AromaticContact CE1-ND1 3.72Å; F308-H312 AromaticContact CE2-CE1 3.4Å; F308-H312 VanDerWaalsContact CE2-CE1 3.4Å; F308-H312 WeakPolarHBondContact CE2-CE1 3.02Å; F308-H312 AromaticContact CG-ND1 3.96Å; F308-H312 AromaticContact CZ-CE1 3.41Å; F308-H312 VanDerWaalsContact CZ-CE1 3.41Å; F308-H312 WeakPolarHBondContact CZ-CE1 3.47Å; F308-H312 AromaticContact CZ-ND1 3.83Å; F308-H312 AromaticContact CZ-NE2 3.81Å; F308-H312 PolarHBondContact O-N 3.23Å; F308-H312 PolarHBondContact O-ND1 3.24Å
309	Y	45.7	Very low	45.8	Very low	163 Å²	163	133.4 Å²	133.4	64%	0.639	65%	0.651	S	S	*	*	H	α-helix	trans	-63.9	-39.6	176.8	-174.1	-96	0	0	0	112.4	E305 Y306 H312 S313	E305-Y309 WeakPolarHBondContact O-CB 3.46Å; E305-Y309 PolarHBondContact O-N 3.09Å; Y306-Y309 PolarHBondContact O-N 3.49Å; Y309-H312 PolarHBondContact O-N 3.39Å; Y309-S313 WeakPolarHBondContact O-CB 3.41Å; Y309-S313 PolarHBondContact O-N 3.46Å; Y309-S313 PolarHBondContact O-OG 3.33Å
310	T	55.4	Low	45.4	Very low	71 Å²	71	132.3 Å²	132.3	44%	0.436	65%	0.65	S	S	.	*	H	α-helix	trans	-69.4	-35.7	-179.4	-51.1	0	0	0	0	112	Y306 G307 S313	Y306-T310 WeakPolarHBondContact O-CB 3.3Å; Y306-T310 PolarHBondContact O-N 3.05Å; Y306-T310 PolarHBondContact O-OG1 3.09Å; G307-T310 PolarHBondContact O-N 3.45Å; T310-S313 PolarHBondContact O-OG 2.83Å
311	L	46.7	Very low	45.3	Very low	118 Å²	118	133.9 Å²	133.9	62%	0.618	65%	0.654	S	S	*	*	H	α-helix	trans	-75	-24.9	177.8	-73	167.7	0	0	0	113.7	G307 F308	G307-L311 WeakPolarHBondContact O-CB 3.38Å; G307-L311 WeakPolarHBondContact O-CG 3.42Å; G307-L311 PolarHBondContact O-N 3.42Å; G307-L311 VanDerWaalsContact O-N 3.08Å; F308-L311 PolarHBondContact O-N 2.84Å
312	H	55.6	Low	44.8	Very low	99 Å²	99	130.2 Å²	130.2	46%	0.458	65%	0.651	S	S	.	*	H	α-helix	trans	-104.2	-19.6	-177.4	-66.2	82.7	0	0	0	114.4	F308 Y309 N314 K315	F308-H312 AromaticContact CD1-ND1 3.79Å; F308-H312 AromaticContact CD2-CE1 3.78Å; F308-H312 AromaticContact CE1-CE1 3.81Å; F308-H312 AromaticContact CE1-ND1 3.72Å; F308-H312 AromaticContact CE2-CE1 3.4Å; F308-H312 VanDerWaalsContact CE2-CE1 3.4Å; F308-H312 WeakPolarHBondContact CE2-CE1 3.02Å; F308-H312 AromaticContact CG-ND1 3.96Å; F308-H312 AromaticContact CZ-CE1 3.41Å; F308-H312 VanDerWaalsContact CZ-CE1 3.41Å; F308-H312 WeakPolarHBondContact CZ-CE1 3.47Å; F308-H312 AromaticContact CZ-ND1 3.83Å; F308-H312 AromaticContact CZ-NE2 3.81Å; F308-H312 PolarHBondContact O-N 3.23Å; F308-H312 PolarHBondContact O-ND1 3.24Å; Y309-H312 PolarHBondContact O-N 3.39Å; H312-N314 VanDerWaalsContact C-N 3.3Å; H312-N314 PolarHBondContact O-N 3.49Å; H312-K315 PolarHBondContact O-N 3.46Å
313	S	47.4	Very low	44.5	Very low	53 Å²	53	132 Å²	132	37%	0.371	65%	0.648	S	S	.	*	H	α-helix	trans	-70.2	-23.4	-179.4	51.2	0	0	0	0	113.9	Y309 T310	Y309-S313 WeakPolarHBondContact O-CB 3.41Å; Y309-S313 PolarHBondContact O-N 3.46Å; Y309-S313 PolarHBondContact O-OG 3.33Å; T310-S313 PolarHBondContact O-OG 2.83Å
314	N	41.3	Very low	44.5	Very low	136 Å²	136	132.4 Å²	132.4	73%	0.727	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.2	-1.2	178	-69.6	-29.3	0	0	0	114.3	H312	H312-N314 VanDerWaalsContact C-N 3.3Å; H312-N314 PolarHBondContact O-N 3.49Å
315	K	38.7	Very low	44	Very low	168 Å²	168	135 Å²	135	73%	0.73	66%	0.664	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.3	0.5	178.5	-74.8	-171.9	176	-178.8	0	115	H312	H312-K315 PolarHBondContact O-N 3.46Å
316	C	36.5	Very low	44.3	Very low	104 Å²	104	132.6 Å²	132.6	70%	0.703	66%	0.66	S	S	*	*			trans	-111.9	62.6	178.2	-77.5	0	0	0	0	111.8
317	K	35.1	Very low	44.5	Very low	195 Å²	195	130.8 Å²	130.8	85%	0.848	66%	0.663	S	S	*	*			trans	-85.8	-3.4	172.8	-93.2	-175.3	177.5	177.9	0	115.1
318	D	37.4	Very low	44.6	Very low	152 Å²	152	135.9 Å²	135.9	81%	0.813	69%	0.685	S	S	*	*			trans	-116.4	47	-177.9	-63.5	-21.3	0	0	0	113.9	N320	D318-N320 PolarHBondContact O-N 3.19Å
319	R	32.4	Very low	44.7	Very low	215 Å²	215	136.7 Å²	136.7	81%	0.811	70%	0.695	S	S	*	*			trans	-89	83.7	163.9	-132.1	178.6	-175.3	165.3	0.7	108.7	H321	R319-H321 PolarHBondContact O-CD2 3.11Å; R319-H321 PolarHBondContact O-N 3.44Å; R319-H321 VanDerWaalsContact O-N 3.12Å
320	N	37.7	Very low	44.9	Very low	150 Å²	150	132.6 Å²	132.6	80%	0.802	70%	0.695	S	S	*	*			trans	-63	110.8	166.4	-78.7	-20	0	0	0	108.6	D318 C322	D318-N320 PolarHBondContact O-N 3.19Å; N320-C322 PolarHBondContact O-N 3.48Å; N320-C322 VanDerWaalsContact O-N 3.11Å
321	H	41.7	Very low	44.8	Very low	177 Å²	177	137.8 Å²	137.8	82%	0.819	71%	0.712	S	S	*	*			trans	-70.7	99.2	166.8	-77.3	-120.6	0	0	0	107.8	R319 H323	R319-H321 PolarHBondContact O-CD2 3.11Å; R319-H321 PolarHBondContact O-N 3.44Å; R319-H321 VanDerWaalsContact O-N 3.12Å; H321-H323 PolarHBondContact O-N 3.05Å
322	C	39.4	Very low	44.9	Very low	116 Å²	116	140.8 Å²	140.8	78%	0.784	72%	0.723	S	S	*	*			trans	-76.8	106.5	168.5	36.7	0	0	0	0	109.2	N320 V324	N320-C322 PolarHBondContact O-N 3.48Å; N320-C322 VanDerWaalsContact O-N 3.11Å; C322-V324 PolarHBondContact O-N 3.29Å
323	H	39.8	Very low	44.8	Very low	161 Å²	161	147.3 Å²	147.3	75%	0.745	74%	0.743	S	S	*	*			trans	-79.1	108.8	167.3	-154.3	-35.4	0	0	0	107.9	H321	H321-H323 PolarHBondContact O-N 3.05Å
324	V	48.5	Very low	44.9	Very low	124 Å²	124	153.2 Å²	153.2	75%	0.752	77%	0.765	S	S	*	*			trans	-79	119.3	160.7	174.9	0	0	0	0	105.7	C322	C322-V324 PolarHBondContact O-N 3.29Å
325	Q	49.8	Very low	45.5	Very low	162 Å²	162	153.2 Å²	153.2	76%	0.757	77%	0.769	S	S	*	*			trans	-122	125.6	166.3	-153.6	172.3	-13	0	0	107.4
326	T	50	Low	46	Very low	97 Å²	97	154 Å²	154	60%	0.595	78%	0.776	S	S	*	*			trans	-62	140.9	-177.6	38.5	0	0	0	0	110.7	D328	T326-D328 WeakPolarHBondContact CB-OD2 3.24Å; T326-D328 PolarHBondContact O-N 3.09Å; T326-D328 PolarHBondContact OG1-OD2 3.44Å
327	N	47.8	Very low	46.8	Very low	143 Å²	143	155.7 Å²	155.7	77%	0.765	78%	0.783	S	S	*	*			trans	-68.8	70.8	-179.8	-175	30.9	0	0	0	111.4
328	D	55.8	Low	48.3	Very low	127 Å²	127	154.8 Å²	154.8	68%	0.679	78%	0.782	S	S	*	*			trans	-96.1	-1	-174.5	-70.3	-40.6	0	0	0	114.4	T326	T326-D328 WeakPolarHBondContact CB-OD2 3.24Å; T326-D328 PolarHBondContact O-N 3.09Å; T326-D328 PolarHBondContact OG1-OD2 3.44Å
329	D	55.9	Low	49.4	Very low	139 Å²	139	153.2 Å²	153.2	74%	0.743	78%	0.78	S	S	*	*			trans	-126.2	60.1	176.7	-75.6	-37.6	0	0	0	112.3	F331	D329-F331 PolarHBondContact O-N 3.29Å; D329-F331 VanDerWaalsContact O-N 3.14Å
330	A	50.7	Low	50.6	Low	78 Å²	78	150.1 Å²	150.1	65%	0.645	78%	0.778	S	S	*	*			trans	-73.6	91.7	164.7	0	0	0	0	0	110.5
331	F	51.8	Low	51.4	Low	180 Å²	180	150.6 Å²	150.6	79%	0.789	78%	0.78	S	S	*	*			trans	-113.1	110.7	162	-78.4	-79.4	0	0	0	110.4	D329 R333	D329-F331 PolarHBondContact O-N 3.29Å; D329-F331 VanDerWaalsContact O-N 3.14Å; F331-R333 PolarHBondContact O-N 2.97Å
332	H	48.9	Very low	51.7	Low	181 Å²	181	147.1 Å²	147.1	84%	0.838	77%	0.767	S	S	*	*			trans	-55.4	123.9	169.3	-89.4	-81.1	0	0	0	110.9
333	R	53.8	Low	52.2	Low	235 Å²	235	146 Å²	146	89%	0.887	76%	0.76	S	S	*	*			trans	-130.5	103	156.2	-70.9	-171.4	178.6	-169.1	0.7	108.2	F331	F331-R333 PolarHBondContact O-N 2.97Å
334	E	49.5	Very low	52.4	Low	178 Å²	178	147.5 Å²	147.5	83%	0.832	76%	0.761	S	S	*	*			trans	-75.7	116.6	166.1	-67.3	175.5	167.4	0	0	108.7
335	V	53.9	Low	52.4	Low	135 Å²	135	148.3 Å²	148.3	82%	0.818	76%	0.761	S	S	*	*			trans	-152.5	104.3	157	-170.2	0	0	0	0	111
336	Q	50.1	Low	52.2	Low	186 Å²	186	143.9 Å²	143.9	87%	0.869	75%	0.745	S	S	*	*			trans	38.1	111.5	145.6	-156	164.1	-16.7	0	0	120.4
337	T	53	Low	52	Low	139 Å²	139	149.4 Å²	149.4	85%	0.853	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-74.1	136.8	169.4	35.4	0	0	0	0	113
338	E	67.3	Low	52	Low	176 Å²	176	148 Å²	148	82%	0.822	75%	0.751	S	S	*	*	P	Polyproline II helix	trans	-67.3	153.7	167.6	-71.5	-162.6	167.8	0	0	112
339	P	58.7	Low	51.7	Low	118 Å²	118	147.8 Å²	147.8	77%	0.766	75%	0.746	S	S	*	*	P	Polyproline II helix	trans	-62.7	143.7	-179.7	25.5	-32.9	0	0	0	111.9	D341	P339-D341 PolarHBondContact O-N 3.23Å
340	I	59.1	Low	51.2	Low	151 Å²	151	148.4 Å²	148.4	77%	0.774	76%	0.755	S	S	*	*			trans	-78	110.6	177.6	-58.2	165.2	0	0	0	108.3	I342	I340-I342 HydrophobicContact CG2-CG1 4.05Å; I340-I342 PolarHBondContact O-N 2.78Å; I340-I342 VanDerWaalsContact O-N 3.13Å
341	D	54.7	Low	50.7	Low	160 Å²	160	148.9 Å²	148.9	86%	0.856	75%	0.75	S	S	*	*			trans	-69.5	101.4	166.8	-84.5	-22.1	0	0	0	109.2	P339	P339-D341 PolarHBondContact O-N 3.23Å
342	I	47.5	Very low	50	Low	103 Å²	103	145.6 Å²	145.6	53%	0.528	75%	0.75	S	S	.	*			trans	-85.1	109.6	172.4	-53.9	170.3	0	0	0	107.3	I340 Y344	I340-I342 HydrophobicContact CG2-CG1 4.05Å; I340-I342 PolarHBondContact O-N 2.78Å; I340-I342 VanDerWaalsContact O-N 3.13Å; I342-Y344 HydrophobicContact CB-CD2 4.43Å; I342-Y344 HydrophobicContact CB-CE2 3.83Å; I342-Y344 HydrophobicContact CG2-CD1 4.48Å; I342-Y344 HydrophobicContact CG2-CD2 4.38Å; I342-Y344 HydrophobicContact CG2-CE1 4.11Å; I342-Y344 HydrophobicContact CG2-CE2 3.98Å; I342-Y344 WeakPolarHBondContact O-CD2 3.46Å; I342-Y344 WeakPolarHBondContact O-CE2 3.43Å; I342-Y344 PolarHBondContact O-N 3.37Å
343	S	49	Very low	49.6	Very low	93 Å²	93	143.3 Å²	143.3	65%	0.65	74%	0.743	S	S	*	*			trans	-72.9	108.2	172.8	44.5	0	0	0	0	110.3	D345	S343-D345 VanDerWaalsContact C-N 3.35Å; S343-D345 PolarHBondContact O-N 2.75Å
344	Y	44.5	Very low	49.3	Very low	192 Å²	192	141.6 Å²	141.6	75%	0.753	75%	0.746	S	S	*	*	S	Bend	trans	-82.9	7.3	-174	-76.1	-80.6	0	0	0	116.1	I342	I342-Y344 HydrophobicContact CB-CD2 4.43Å; I342-Y344 HydrophobicContact CB-CE2 3.83Å; I342-Y344 HydrophobicContact CG2-CD1 4.48Å; I342-Y344 HydrophobicContact CG2-CD2 4.38Å; I342-Y344 HydrophobicContact CG2-CE1 4.11Å; I342-Y344 HydrophobicContact CG2-CE2 3.98Å; I342-Y344 WeakPolarHBondContact O-CD2 3.46Å; I342-Y344 WeakPolarHBondContact O-CE2 3.43Å; I342-Y344 PolarHBondContact O-N 3.37Å
345	D	48.6	Very low	49	Very low	142 Å²	142	138.9 Å²	138.9	76%	0.759	74%	0.737	S	S	*	*			trans	-127.6	43.3	-174.7	-74.3	-29.1	0	0	0	113.5	S343 C359	S343-D345 VanDerWaalsContact C-N 3.35Å; S343-D345 PolarHBondContact O-N 2.75Å; D345-C359 PolarHBondContact O-SG 2.94Å
346	V	46.1	Very low	48	Very low	68 Å²	68	135.5 Å²	135.5	41%	0.412	73%	0.729	S	S	.	*			trans	-93.8	110	174.2	-173.2	0	0	0	0	109.9	T348 E357	V346-T348 HydrophobicContact CG1-CG2 4.19Å; V346-E357 HydrophobicContact CG1-CG 4.2Å
347	W	45.8	Very low	47.5	Very low	214 Å²	214	133.2 Å²	133.2	81%	0.811	72%	0.719	S	S	*	*			trans	-83.9	117.3	172.2	-139.6	77.4	0	0	0	108.9	Q349	W347-Q349 HydrophobicContact CZ3-CB 4.32Å
348	T	47.9	Very low	46.8	Very low	113 Å²	113	135.1 Å²	135.1	69%	0.693	72%	0.716	S	S	*	*			trans	-105.9	127.4	176.6	48.8	0	0	0	0	109.7	V346	V346-T348 HydrophobicContact CG1-CG2 4.19Å
349	Q	48.3	Very low	45.4	Very low	123 Å²	123	131.4 Å²	131.4	58%	0.575	71%	0.708	S	S	*	*			trans	-112	132.9	171.9	-179.4	174.5	-12.6	0	0	109	W347 T351	W347-Q349 HydrophobicContact CZ3-CB 4.32Å; Q349-T351 PolarHBondContact NE2-OG1 3.49Å; Q349-T351 PolarHBondContact O-N 3.41Å
350	T	46.4	Very low	44	Very low	152 Å²	152	137.4 Å²	137.4	93%	0.933	72%	0.715	S	S	*	*	S	Bend	trans	-69	-8.9	-177	36.2	0	0	0	0	114.9
351	T	39	Very low	42.8	Very low	88 Å²	88	141.6 Å²	141.6	54%	0.54	72%	0.721	S	S	.	*	S	Bend	trans	-119.7	108.8	177.1	55.6	0	0	0	0	108.6	Q349 D353	Q349-T351 PolarHBondContact NE2-OG1 3.49Å; Q349-T351 PolarHBondContact O-N 3.41Å; T351-D353 PolarHBondContact O-N 3.4Å
352	S	38.2	Very low	41.6	Very low	111 Å²	111	141.1 Å²	141.1	78%	0.776	72%	0.724	S	S	*	*			trans	-76.8	104.9	-179	56.1	0	0	0	0	111
353	D	40	Very low	40.8	Very low	132 Å²	132	139.5 Å²	139.5	71%	0.706	73%	0.733	S	S	*	*			trans	-75.2	146.7	142.2	-66.9	-18.1	0	0	0	106.4	T351 N355 G356	T351-D353 PolarHBondContact O-N 3.4Å; D353-N355 PolarHBondContact O-N 3.27Å; D353-G356 PolarHBondContact O-N 2.97Å; D353-G356 VanDerWaalsContact O-N 3.11Å
354	E	47.7	Very low	40.2	Very low	200 Å²	200	139.5 Å²	139.5	94%	0.935	73%	0.733	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.7	3.1	-169.7	-64.6	-177.3	157	0	0	116.1
355	N	43.8	Very low	39.6	Very low	121 Å²	121	138.3 Å²	138.3	65%	0.647	74%	0.739	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118	32.3	178	-62.1	-37.2	0	0	0	113	D353 E357 F358	D353-N355 PolarHBondContact O-N 3.27Å; N355-E357 PolarHBondContact O-N 3.06Å; N355-E357 VanDerWaalsContact O-N 3.17Å; N355-F358 HydrophobicContact CB-CD2 4.38Å; N355-F358 HydrophobicContact CB-CE2 4.3Å
356	G	32.8	Very low	39.1	Very low	64 Å²	64	136.8 Å²	136.8	66%	0.66	73%	0.731	S	S	*	*			trans	-66.2	108.2	170.9	0	0	0	0	0	111.2	D353	D353-G356 PolarHBondContact O-N 2.97Å; D353-G356 VanDerWaalsContact O-N 3.11Å
357	E	39.6	Very low	38.8	Very low	137 Å²	137	138.4 Å²	138.4	64%	0.64	74%	0.738	S	S	*	*			trans	100.3	85.9	180	-59.1	-177.8	-175.5	0	0	115.7	V346 N355	V346-E357 HydrophobicContact CG1-CG 4.2Å; N355-E357 PolarHBondContact O-N 3.06Å; N355-E357 VanDerWaalsContact O-N 3.17Å
358	F	38.5	Very low	38.8	Very low	180 Å²	180	131 Å²	131	79%	0.789	72%	0.719	S	S	*	*			trans	-116.5	100.6	162.6	-98.1	-84.1	0	0	0	111.4	N355	N355-F358 HydrophobicContact CB-CD2 4.38Å; N355-F358 HydrophobicContact CB-CE2 4.3Å
359	C	36.8	Very low	38.5	Very low	98 Å²	98	132.5 Å²	132.5	66%	0.662	72%	0.722	S	S	*	*			trans	-95.7	100.4	158.4	-80.7	0	0	0	0	110.2	D345 R361	D345-C359 PolarHBondContact O-SG 2.94Å; C359-R361 PolarHBondContact O-N 3.37Å
360	R	30.2	Very low	38.3	Very low	243 Å²	243	130.4 Å²	130.4	92%	0.917	71%	0.714	S	S	*	*			trans	33.1	84	146.3	-146.1	-179.9	-155.7	173.1	5.9	117.6
361	R	32.4	Very low	37.9	Very low	240 Å²	240	127.1 Å²	127.1	91%	0.906	69%	0.69	S	S	*	*			trans	-133.6	104.7	149.3	-152.8	-175.3	-99.8	-162.8	-1.9	109.6	C359	C359-R361 PolarHBondContact O-N 3.37Å
362	V	30.7	Very low	38.1	Very low	149 Å²	149	128.1 Å²	128.1	90%	0.903	69%	0.692	S	S	*	*			trans	-81.3	118.5	169.6	176.7	0	0	0	0	107
363	G	31	Very low	38.2	Very low	70 Å²	70	125.7 Å²	125.7	72%	0.722	68%	0.675	S	S	*	*			trans	133.8	89.1	165.2	0	0	0	0	0	116
364	S	35.3	Very low	38.1	Very low	93 Å²	93	124 Å²	124	65%	0.65	66%	0.66	S	S	*	*				155.6	106.8	121.1	-163.8	0	0	0	0	107.9	N366	S364-N366 PolarHBondContact O-N 3.2Å; S364-N366 PolarHBondContact OG-OD1 3.2Å
365	N	31.7	Very low	37.6	Very low	166 Å²	166	120.6 Å²	120.6	89%	0.888	65%	0.648	S	S	*	*			trans	-66.9	74.9	171.1	-72	-9	0	0	0	109.5
366	N	38.3	Very low	37.2	Very low	110 Å²	110	119.4 Å²	119.4	59%	0.588	64%	0.641	S	S	*	*			trans	-102.6	97.6	166	-72.4	0.9	0	0	0	106.7	S364 S368	S364-N366 PolarHBondContact O-N 3.2Å; S364-N366 PolarHBondContact OG-OD1 3.2Å; N366-S368 PolarHBondContact O-N 2.98Å
367	N	41	Very low	37.4	Very low	103 Å²	103	119 Å²	119	55%	0.551	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63	28.1	166.4	-74.4	-5	0	0	0	111.9	I370 N371	N367-I370 HydrophobicContact CB-CB 4.25Å; N367-N371 VanDerWaalsContact O-CB 3.29Å; N367-N371 WeakPolarHBondContact O-CB 3.43Å; N367-N371 PolarHBondContact O-N 3.01Å
368	S	44.7	Very low	37.3	Very low	59 Å²	59	118.8 Å²	118.8	41%	0.413	62%	0.622	S	S	.	*	H	α-helix	trans	-76.2	-35	179.9	61.2	0	0	0	0	112	N366 I370 N371 D372	N366-S368 PolarHBondContact O-N 2.98Å; S368-I370 VanDerWaalsContact C-N 3.31Å; S368-N371 PolarHBondContact O-N 2.85Å; S368-D372 VanDerWaalsContact O-CG 3.24Å; S368-D372 PolarHBondContact O-N 2.78Å
369	L	41.7	Very low	37.1	Very low	144 Å²	144	111 Å²	111	75%	0.754	59%	0.59	S	S	*	*	H	α-helix	trans	-70	-30.7	171.7	-86.9	137.1	0	0	0	112.5	S373	L369-S373 PolarHBondContact O-N 3.23Å; L369-S373 PolarHBondContact O-OG 3.39Å; L369-S373 VanDerWaalsContact O-OG 3.13Å
370	I	43.5	Very low	37.1	Very low	79 Å²	79	111.2 Å²	111.2	41%	0.405	58%	0.584	S	S	.	*	H	α-helix	trans	-69.2	-51.1	169.2	-66.5	176.4	0	0	0	107.7	N367 S368 D372 S373 Y374	N367-I370 HydrophobicContact CB-CB 4.25Å; S368-I370 VanDerWaalsContact C-N 3.31Å; I370-D372 VanDerWaalsContact C-N 3.28Å; I370-D372 PolarHBondContact O-N 2.96Å; I370-D372 VanDerWaalsContact O-N 3.16Å; I370-S373 CarbonylContact O-C 3.52Å; I370-S373 PolarHBondContact O-N 3.1Å; I370-S373 PolarHBondContact O-OG 3.28Å; I370-Y374 HydrophobicContact CB-CD2 4.22Å; I370-Y374 HydrophobicContact CB-CE2 4.39Å; I370-Y374 HydrophobicContact CG2-CD2 3.28Å; I370-Y374 HydrophobicContact CG2-CE2 3.37Å; I370-Y374 HydrophobicContact CG2-CG 4.24Å; I370-Y374 WeakPolarHBondContact O-CB 3.42Å; I370-Y374 WeakPolarHBondContact O-CD2 3.38Å; I370-Y374 PolarHBondContact O-N 3.2Å
371	N	38.9	Very low	37.6	Very low	82 Å²	82	103.5 Å²	103.5	44%	0.439	56%	0.562	S	S	.	*	H	α-helix	trans	-60.5	-31	178	-77.5	-10.1	0	0	0	114.3	N367 S368 S373 N375	N367-N371 VanDerWaalsContact O-CB 3.29Å; N367-N371 WeakPolarHBondContact O-CB 3.43Å; N367-N371 PolarHBondContact O-N 3.01Å; S368-N371 PolarHBondContact O-N 2.85Å; N371-S373 VanDerWaalsContact C-N 3.33Å; N371-N375 WeakPolarHBondContact O-CB 3.21Å; N371-N375 PolarHBondContact O-N 3.42Å; N371-N375 PolarHBondContact O-ND2 2.92Å
372	D	43.3	Very low	37.7	Very low	110 Å²	110	99.2 Å²	99.2	59%	0.588	55%	0.55	S	S	*	.	H	α-helix	trans	-72.6	-27.2	175.6	-68.6	-21.4	0	0	0	112.5	S368 I370 L376	S368-D372 VanDerWaalsContact O-CG 3.24Å; S368-D372 PolarHBondContact O-N 2.78Å; I370-D372 VanDerWaalsContact C-N 3.28Å; I370-D372 PolarHBondContact O-N 2.96Å; I370-D372 VanDerWaalsContact O-N 3.16Å; D372-L376 WeakPolarHBondContact O-CD1 3.38Å
373	S	39.5	Very low	38	Very low	59 Å²	59	96 Å²	96	41%	0.413	53%	0.527	S	S	.	.	H	α-helix	trans	-85.1	-33.8	171.9	55	0	0	0	0	112.7	L369 I370 N371 S379	L369-S373 PolarHBondContact O-N 3.23Å; L369-S373 PolarHBondContact O-OG 3.39Å; L369-S373 VanDerWaalsContact O-OG 3.13Å; I370-S373 CarbonylContact O-C 3.52Å; I370-S373 PolarHBondContact O-N 3.1Å; I370-S373 PolarHBondContact O-OG 3.28Å; N371-S373 VanDerWaalsContact C-N 3.33Å; S373-S379 WeakPolarHBondContact O-CB 3.38Å
374	Y	37.8	Very low	38.3	Very low	98 Å²	98	99 Å²	99	38%	0.384	52%	0.523	S	S	.	.	H	α-helix	trans	-83.3	-21.5	-179.4	-78.3	-92.5	0	0	0	114.2	I370	I370-Y374 HydrophobicContact CB-CD2 4.22Å; I370-Y374 HydrophobicContact CB-CE2 4.39Å; I370-Y374 HydrophobicContact CG2-CD2 3.28Å; I370-Y374 HydrophobicContact CG2-CE2 3.37Å; I370-Y374 HydrophobicContact CG2-CG 4.24Å; I370-Y374 WeakPolarHBondContact O-CB 3.42Å; I370-Y374 WeakPolarHBondContact O-CD2 3.38Å; I370-Y374 PolarHBondContact O-N 3.2Å
375	N	37.8	Very low	38.5	Very low	127 Å²	127	96.6 Å²	96.6	68%	0.679	50%	0.503	S	S	*	.	S	Bend	trans	-92.2	-9.2	177.3	-70.2	-40.1	0	0	0	114.3	N371	N371-N375 WeakPolarHBondContact O-CB 3.21Å; N371-N375 PolarHBondContact O-N 3.42Å; N371-N375 PolarHBondContact O-ND2 2.92Å
376	L	34.8	Very low	38.6	Very low	96 Å²	96	91.5 Å²	91.5	50%	0.503	48%	0.481	S	S	.	.	S	Bend	trans	-78.5	132.9	162.5	-97	95	0	0	0	107.6	D372 Y378 S379	D372-L376 WeakPolarHBondContact O-CD1 3.38Å; L376-Y378 HydrophobicContact CB-CD2 3.87Å; L376-Y378 HydrophobicContact CB-CG 4.49Å; L376-Y378 HydrophobicContact CD2-CD2 3.55Å; L376-Y378 HydrophobicContact CD2-CE2 3.79Å; L376-Y378 HydrophobicContact CD2-CG 4.45Å; L376-Y378 HydrophobicContact CG-CD2 4.2Å; L376-Y378 PolarHBondContact O-N 2.91Å; L376-S379 PolarHBondContact O-N 2.76Å; L376-S379 VanDerWaalsContact O-N 3.09Å
377	S	37.2	Very low	38.5	Very low	55 Å²	55	89.5 Å²	89.5	39%	0.385	48%	0.475	S	S	.	.	H	α-helix	trans	-49.4	-13.9	175.2	49.1	0	0	0	0	114.4	S379 N439	S377-S379 PolarHBondContact O-N 3.43Å; S377-N439 PolarHBondContact OG-ND2 2.87Å
378	Y	37.6	Very low	38.3	Very low	134 Å²	134	90 Å²	90	53%	0.525	47%	0.473	S	S	.	.	H	α-helix	trans	-64.6	-21.5	174.5	-68.2	-95.6	0	0	0	116.3	L376 N439	L376-Y378 HydrophobicContact CB-CD2 3.87Å; L376-Y378 HydrophobicContact CB-CG 4.49Å; L376-Y378 HydrophobicContact CD2-CD2 3.55Å; L376-Y378 HydrophobicContact CD2-CE2 3.79Å; L376-Y378 HydrophobicContact CD2-CG 4.45Å; L376-Y378 HydrophobicContact CG-CD2 4.2Å; L376-Y378 PolarHBondContact O-N 2.91Å; Y378-N439 HydrophobicContact CE1-CB 4.43Å; Y378-N439 WeakPolarHBondContact CE2-ND2 3.35Å; Y378-N439 VanDerWaalsContact CZ-CG 3.4Å; Y378-N439 VanDerWaalsContact CZ-ND2 3.26Å; Y378-N439 VanDerWaalsContact CZ-OD1 3.3Å; Y378-N439 PolarHBondContact OH-OD1 3.17Å
379	S	35.9	Very low	37.9	Very low	17 Å²	17	92.9 Å²	92.9	12%	0.119	48%	0.482	C	S	.	.	H	α-helix	trans	-110.9	-15.8	-175.6	-172.6	0	0	0	0	115	S373 L376 S377 D381 F382 N383	S373-S379 WeakPolarHBondContact O-CB 3.38Å; L376-S379 PolarHBondContact O-N 2.76Å; L376-S379 VanDerWaalsContact O-N 3.09Å; S377-S379 PolarHBondContact O-N 3.43Å; S379-D381 PolarHBondContact O-N 2.86Å; S379-F382 WeakPolarHBondContact O-CA 3.33Å; S379-F382 WeakPolarHBondContact O-CB 3.2Å; S379-F382 PolarHBondContact O-N 2.82Å; S379-N383 PolarHBondContact O-N 3.22Å
380	N	36.5	Very low	37.8	Very low	101 Å²	101	91.4 Å²	91.4	54%	0.54	47%	0.474	S	S	.	.	H	α-helix	trans	-67.4	-25.4	168.4	-77.7	-26.9	0	0	0	112.2	F382	N380-F382 VanDerWaalsContact C-N 3.31Å
381	D	39.8	Very low	37.4	Very low	82 Å²	82	91.6 Å²	91.6	44%	0.439	48%	0.476	S	S	.	.	H	α-helix	trans	-69.3	-28.1	168.5	-68.8	-20.1	0	0	0	112.1	S379 V385	S379-D381 PolarHBondContact O-N 2.86Å; D381-V385 WeakPolarHBondContact O-CG2 3.38Å
382	F	35.2	Very low	37.2	Very low	149 Å²	149	97 Å²	97	65%	0.654	49%	0.49	S	S	*	.	H	α-helix	trans	-76.4	-31.1	177.2	-105.9	-92	0	0	0	113.3	S379 N380 H384 V385 S386	S379-F382 WeakPolarHBondContact O-CA 3.33Å; S379-F382 WeakPolarHBondContact O-CB 3.2Å; S379-F382 PolarHBondContact O-N 2.82Å; N380-F382 VanDerWaalsContact C-N 3.31Å; F382-H384 VanDerWaalsContact C-N 3.35Å; F382-V385 WeakPolarHBondContact O-CB 3.22Å; F382-V385 PolarHBondContact O-N 2.71Å; F382-S386 PolarHBondContact O-N 3.27Å; F382-S386 PolarHBondContact O-OG 2.96Å
383	N	36.4	Very low	36.8	Very low	81 Å²	81	96.5 Å²	96.5	43%	0.433	48%	0.484	S	S	.	.	H	α-helix	trans	-75.5	-21.9	176.2	-80.3	-25.6	0	0	0	113.4	S379 V385 S386	S379-N383 PolarHBondContact O-N 3.22Å; N383-V385 VanDerWaalsContact C-N 3.26Å; N383-S386 PolarHBondContact O-N 2.87Å
384	H	38	Very low	36.8	Very low	135 Å²	135	98 Å²	98	63%	0.625	49%	0.487	S	S	*	.	H	α-helix	trans	-70.7	-25.3	169.7	-119.8	-74.8	0	0	0	112.3	F382 S387	F382-H384 VanDerWaalsContact C-N 3.35Å; H384-S387 PolarHBondContact O-OG 3.28Å
385	V	37.9	Very low	36.6	Very low	41 Å²	41	96 Å²	96	25%	0.248	49%	0.491	C	S	.	.	H	α-helix	trans	-79.6	-16.7	176.4	177.4	0	0	0	0	112.1	D381 F382 N383 S387 K388	D381-V385 WeakPolarHBondContact O-CG2 3.38Å; F382-V385 WeakPolarHBondContact O-CB 3.22Å; F382-V385 PolarHBondContact O-N 2.71Å; N383-V385 VanDerWaalsContact C-N 3.26Å; V385-S387 VanDerWaalsContact C-N 3.28Å; V385-S387 PolarHBondContact O-N 3.22Å; V385-K388 HydrophobicContact CG1-CD 4.46Å; V385-K388 WeakPolarHBondContact O-CB 3.12Å; V385-K388 WeakPolarHBondContact O-CG 3.41Å; V385-K388 PolarHBondContact O-N 2.88Å
386	S	35.9	Very low	36.5	Very low	59 Å²	59	96 Å²	96	41%	0.413	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-1.2	176.7	-60.4	0	0	0	0	115.2	F382 N383 K388 I389	F382-S386 PolarHBondContact O-N 3.27Å; F382-S386 PolarHBondContact O-OG 2.96Å; N383-S386 PolarHBondContact O-N 2.87Å; S386-K388 PolarHBondContact O-N 3.37Å; S386-I389 PolarHBondContact O-N 3.15Å
387	S	35.9	Very low	36.4	Very low	68 Å²	68	99 Å²	99	48%	0.476	50%	0.496	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-10.3	160.3	52.3	0	0	0	0	112.4	H384 V385 I389 I390 L391	H384-S387 PolarHBondContact O-OG 3.28Å; V385-S387 VanDerWaalsContact C-N 3.28Å; V385-S387 PolarHBondContact O-N 3.22Å; S387-I389 VanDerWaalsContact C-N 3.26Å; S387-I389 PolarHBondContact O-N 3.21Å; S387-I390 WeakPolarHBondContact O-CB 3.3Å; S387-I390 PolarHBondContact O-N 3.46Å; S387-L391 PolarHBondContact O-N 3.46Å
388	K	35.6	Very low	36.3	Very low	113 Å²	113	105 Å²	105	49%	0.491	52%	0.515	S	S	.	.	H	α-helix	trans	-61.5	-16	164	-82.4	-178.7	171.9	179.9	0	116	V385 S386 I390 R392	V385-K388 HydrophobicContact CG1-CD 4.46Å; V385-K388 WeakPolarHBondContact O-CB 3.12Å; V385-K388 WeakPolarHBondContact O-CG 3.41Å; V385-K388 PolarHBondContact O-N 2.88Å; S386-K388 PolarHBondContact O-N 3.37Å; K388-I390 VanDerWaalsContact C-N 3.35Å; K388-R392 PolarHBondContact O-N 2.99Å
389	I	36.8	Very low	36	Very low	120 Å²	120	103.3 Å²	103.3	62%	0.615	52%	0.522	S	S	*	.	H	α-helix	trans	-75.3	-28.8	168.4	-65.9	174.3	0	0	0	110.7	S386 S387 R392 E393	S386-I389 PolarHBondContact O-N 3.15Å; S387-I389 VanDerWaalsContact C-N 3.26Å; S387-I389 PolarHBondContact O-N 3.21Å; I389-R392 WeakPolarHBondContact O-CB 3.46Å; I389-R392 PolarHBondContact O-N 3.31Å; I389-E393 PolarHBondContact O-N 3.34Å
390	I	38.5	Very low	35.6	Very low	114 Å²	114	109.6 Å²	109.6	59%	0.585	55%	0.554	S	S	*	*	H	α-helix	trans	-78	-35.5	-178.7	-60.2	170.9	0	0	0	111.3	S387 K388 R392 E393 L394	S387-I390 WeakPolarHBondContact O-CB 3.3Å; S387-I390 PolarHBondContact O-N 3.46Å; K388-I390 VanDerWaalsContact C-N 3.35Å; I390-R392 VanDerWaalsContact C-N 3.28Å; I390-R392 PolarHBondContact O-N 3.13Å; I390-E393 PolarHBondContact O-N 2.95Å; I390-L394 PolarHBondContact O-N 3.49Å; I390-L394 VanDerWaalsContact O-N 3.09Å
391	L	36.8	Very low	35.1	Very low	83 Å²	83	108.4 Å²	108.4	44%	0.435	57%	0.565	S	S	.	*	H	α-helix	trans	-69.3	-25.1	168.1	-79.2	165.4	0	0	0	112.7	S387 E393 L394 A395	S387-L391 PolarHBondContact O-N 3.46Å; L391-E393 VanDerWaalsContact C-N 3.3Å; L391-L394 HydrophobicContact CD2-CD1 4.14Å; L391-L394 PolarHBondContact O-N 3.27Å; L391-A395 VanDerWaalsContact O-CB 3.24Å; L391-A395 WeakPolarHBondContact O-CB 3.44Å; L391-A395 PolarHBondContact O-N 2.94Å
392	R	33	Very low	34.5	Very low	194 Å²	194	110.3 Å²	110.3	73%	0.732	58%	0.58	S	S	*	*	H	α-helix	trans	-70.5	-24.8	172.9	-132.3	178.8	-175	-179.7	1.9	112.8	K388 I389 I390	K388-R392 PolarHBondContact O-N 2.99Å; I389-R392 WeakPolarHBondContact O-CB 3.46Å; I389-R392 PolarHBondContact O-N 3.31Å; I390-R392 VanDerWaalsContact C-N 3.28Å; I390-R392 PolarHBondContact O-N 3.13Å
393	E	36.7	Very low	34.1	Very low	100 Å²	100	109.8 Å²	109.8	47%	0.467	58%	0.584	S	S	.	*	H	α-helix	trans	-83.7	-37	171	-74.4	-61.6	137.9	0	0	112.2	I389 I390 L391 A395 K396 E397	I389-E393 PolarHBondContact O-N 3.34Å; I390-E393 PolarHBondContact O-N 2.95Å; L391-E393 VanDerWaalsContact C-N 3.3Å; E393-A395 VanDerWaalsContact C-N 3.29Å; E393-A395 PolarHBondContact O-N 3.13Å; E393-K396 WeakPolarHBondContact O-CB 3.19Å; E393-K396 PolarHBondContact O-N 2.9Å; E393-K396 IonicContact OE1-NZ 2.74Å; E393-K396 PolarHBondContact OE1-NZ 2.85Å; E393-E397 PolarHBondContact O-N 2.84Å
394	L	38.3	Very low	33.5	Very low	91 Å²	91	110.9 Å²	110.9	48%	0.476	59%	0.593	S	S	.	*	H	α-helix	trans	-65	-33	170.5	-76.4	163.1	0	0	0	112.5	I390 L391 K396 E397 F398	I390-L394 PolarHBondContact O-N 3.49Å; I390-L394 VanDerWaalsContact O-N 3.09Å; L391-L394 HydrophobicContact CD2-CD1 4.14Å; L391-L394 PolarHBondContact O-N 3.27Å; L394-K396 VanDerWaalsContact C-N 3.28Å; L394-K396 PolarHBondContact O-N 2.92Å; L394-E397 PolarHBondContact O-N 2.83Å; L394-F398 PolarHBondContact O-N 2.77Å
395	A	35	Very low	32.9	Very low	57 Å²	57	115 Å²	115	47%	0.471	61%	0.605	S	S	.	*	H	α-helix	trans	-71.9	-15	171.7	0	0	0	0	0	114.1	L391 E393 C399	L391-A395 VanDerWaalsContact O-CB 3.24Å; L391-A395 WeakPolarHBondContact O-CB 3.44Å; L391-A395 PolarHBondContact O-N 2.94Å; E393-A395 VanDerWaalsContact C-N 3.29Å; E393-A395 PolarHBondContact O-N 3.13Å; A395-C399 WeakPolarHBondContact O-CB 3.16Å; A395-C399 PolarHBondContact O-SG 3.34Å
396	K	34.2	Very low	32.2	Very low	125 Å²	125	120.3 Å²	120.3	54%	0.543	63%	0.632	S	S	.	*	H	α-helix	trans	-83.8	-37.7	168.7	-78.3	176.2	-176.8	167.9	0	112	E393 L394 C399	E393-K396 WeakPolarHBondContact O-CB 3.19Å; E393-K396 PolarHBondContact O-N 2.9Å; E393-K396 IonicContact OE1-NZ 2.74Å; E393-K396 PolarHBondContact OE1-NZ 2.85Å; L394-K396 VanDerWaalsContact C-N 3.28Å; L394-K396 PolarHBondContact O-N 2.92Å; K396-C399 PolarHBondContact O-N 2.79Å
397	E	33.2	Very low	31.8	Very low	160 Å²	160	123.6 Å²	123.6	75%	0.748	65%	0.65	S	S	*	*	H	α-helix	trans	-67.1	-35	178.4	-79.5	-80.1	135.2	0	0	113	E393 L394	E393-E397 PolarHBondContact O-N 2.84Å; L394-E397 PolarHBondContact O-N 2.83Å
398	F	34.1	Very low	31.2	Very low	180 Å²	180	126.3 Å²	126.3	79%	0.789	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	-8.8	176	-87.5	-87.6	0	0	0	114.7	L394	L394-F398 PolarHBondContact O-N 2.77Å
399	C	31.8	Very low	30.8	Very low	99 Å²	99	126.8 Å²	126.8	67%	0.669	68%	0.675	S	S	*	*	T	Hydrogen-bonded Turn	trans	-107.7	9.3	-173.2	-70.5	0	0	0	0	115.6	A395 K396	A395-C399 WeakPolarHBondContact O-CB 3.16Å; A395-C399 PolarHBondContact O-SG 3.34Å; K396-C399 PolarHBondContact O-N 2.79Å
400	L	28	Very low	30.3	Very low	150 Å²	150	127.5 Å²	127.5	79%	0.785	68%	0.681	S	S	*	*			trans	-126.2	72.7	170.3	-72.4	171.5	0	0	0	110.5	V402	L400-V402 PolarHBondContact O-N 2.99Å
401	G	25.4	Very low	29.8	Very low	75 Å²	75	128.7 Å²	128.7	77%	0.773	69%	0.688	S	S	*	*			trans	-64.2	122.7	167.4	0	0	0	0	0	111.4
402	V	28.4	Very low	29.5	Very low	123 Å²	123	133.9 Å²	133.9	75%	0.745	71%	0.707	S	S	*	*			trans	-149.5	96.2	162.7	-164.1	0	0	0	0	106.3	L400	L400-V402 PolarHBondContact O-N 2.99Å
403	N	25.3	Very low	29.2	Very low	137 Å²	137	130.6 Å²	130.6	73%	0.733	71%	0.709	S	S	*	*				42.7	115	102.3	-74.9	-25.2	0	0	0	113.6
404	T	24.4	Very low	28.9	Very low	104 Å²	104	135.4 Å²	135.4	64%	0.638	73%	0.731	S	S	*	*			trans	37.9	118.7	137.9	56.8	0	0	0	0	117.8
405	Y	26.3	Very low	28.3	Very low	223 Å²	223	137.9 Å²	137.9	88%	0.875	75%	0.745	S	S	*	*				161.1	120.8	119.1	-83.7	-67.8	0	0	0	110.6
406	N	22.5	Very low	28.1	Very low	151 Å²	151	142 Å²	142	81%	0.807	76%	0.764	S	S	*	*			trans	-46.3	137.1	160	-72.9	-36.9	0	0	0	111.1
407	T	27.1	Very low	27.7	Very low	128 Å²	128	141 Å²	141	79%	0.785	77%	0.769	S	S	*	*				171.9	120.7	116.8	36.1	0	0	0	0	111.4
408	T	23.8	Very low	27.5	Very low	125 Å²	125	140.6 Å²	140.6	77%	0.767	77%	0.772	S	S	*	*			trans	11.9	134.2	138.1	56.9	0	0	0	0	119.5
409	V	27.9	Very low	27.1	Very low	123 Å²	123	138.1 Å²	138.1	75%	0.745	77%	0.771	S	S	*	*				150.4	112.9	123.2	169.5	0	0	0	0	112.4
410	N	26.2	Very low	26.7	Very low	135 Å²	135	142.1 Å²	142.1	72%	0.722	78%	0.778	S	S	*	*			trans	43.2	129.3	140.3	-60.9	-2.9	0	0	0	124.3
411	D	26.9	Very low	26.7	Very low	139 Å²	139	140.4 Å²	140.4	74%	0.743	78%	0.775	S	S	*	*				42.6	113.8	128.4	-58.4	-22.2	0	0	0	120
412	K	31.4	Very low	26.6	Very low	192 Å²	192	144.4 Å²	144.4	84%	0.835	78%	0.778	S	S	*	*				169.4	114.9	107.2	-89.1	168.3	-172.3	-178.7	0	112
413	T	26.4	Very low	26.5	Very low	125 Å²	125	145.8 Å²	145.8	77%	0.767	78%	0.781	S	S	*	*			trans	17.7	124.6	139.9	53.7	0	0	0	0	119.9
414	E	29.6	Very low	26.5	Very low	201 Å²	201	147.9 Å²	147.9	94%	0.939	79%	0.786	S	S	*	*				-157.5	127	128.7	-108.9	171.6	-157.5	0	0	110.8
415	D	27.2	Very low	26.6	Very low	143 Å²	143	153.3 Å²	153.3	77%	0.765	80%	0.801	S	S	*	*			trans	-78.4	136	-172.2	-68.9	-53.1	0	0	0	113.4
416	V	29.8	Very low	26.6	Very low	144 Å²	144	150.7 Å²	150.7	87%	0.873	80%	0.802	S	S	*	*			trans	-136.9	103.9	147.3	-179.3	0	0	0	0	108.2
417	T	25.4	Very low	26.7	Very low	104 Å²	104	153.8 Å²	153.8	64%	0.638	80%	0.803	S	S	*	*			trans	-86.3	122.9	175.3	49.5	0	0	0	0	110.6
418	D	28.8	Very low	26.6	Very low	152 Å²	152	153.7 Å²	153.7	81%	0.813	80%	0.804	S	S	*	*			trans	-139	93.8	151.7	-91.3	-31	0	0	0	108.9
419	T	25.5	Very low	26.8	Very low	127 Å²	127	155.2 Å²	155.2	78%	0.779	80%	0.803	S	S	*	*			trans	-85.5	119.1	177.2	-28.7	0	0	0	0	108.8
420	F	25.1	Very low	26.7	Very low	184 Å²	184	157.4 Å²	157.4	81%	0.807	81%	0.81	S	S	*	*			trans	-108.4	130.1	161.5	-85	-80.3	0	0	0	110.2
421	P	27	Very low	26.8	Very low	113 Å²	113	156.1 Å²	156.1	73%	0.734	81%	0.812	S	S	*	*			trans	-82.9	126.9	-162.7	31.6	-32.3	0	0	0	112.5	N423	P421-N423 PolarHBondContact O-N 2.83Å
422	I	24.4	Very low	26.6	Very low	160 Å²	160	156.8 Å²	156.8	82%	0.821	82%	0.821	S	S	*	*	S	Bend	trans	-74.8	96.6	159.5	-59.6	165.6	0	0	0	106.1
423	N	24.5	Very low	26.4	Very low	151 Å²	151	152.3 Å²	152.3	81%	0.807	81%	0.814	S	S	*	*			trans	172.8	77	159	-90.5	-22.3	0	0	0	111.5	P421	P421-N423 PolarHBondContact O-N 2.83Å
424	E	26.2	Very low	26.2	Very low	182 Å²	182	155.5 Å²	155.5	85%	0.85	82%	0.823	S	S	*	*			trans	-163.2	51.1	167.3	-126.7	173.2	-152.5	0	0	115.6
425	F	27	Very low	26.1	Very low	218 Å²	218	154 Å²	154	96%	0.956	82%	0.818	S	S	*	*			trans	-142.7	69.4	165.1	-87.2	-78.5	0	0	0	112.1
426	N	25.1	Very low	26.2	Very low	167 Å²	167	153.4 Å²	153.4	89%	0.893	81%	0.814	S	S	*	*			trans	-130.7	91.4	164.8	-93.4	-30	0	0	0	108.8
427	R	25.5	Very low	26	Very low	217 Å²	217	150.6 Å²	150.6	82%	0.819	80%	0.799	S	S	*	*			trans	-169	125.2	153.1	-111.4	-179.4	-165.1	-157.9	5.9	111.2
428	P	26	Very low	26.2	Very low	126 Å²	126	150.7 Å²	150.7	82%	0.818	80%	0.796	S	S	*	*			trans	-92.7	120.6	173	33.5	-25.1	0	0	0	109.6
429	E	27.4	Very low	26.4	Very low	157 Å²	157	146.7 Å²	146.7	73%	0.734	77%	0.774	S	S	*	*			trans	-120.5	111.1	168	-75.1	-170.7	-175.2	0	0	110.9	S431	E429-S431 PolarHBondContact O-N 3.03Å
430	N	24.4	Very low	26.8	Very low	168 Å²	168	149.7 Å²	149.7	90%	0.898	77%	0.771	S	S	*	*			trans	-13.7	109.8	160.8	-62	-31.9	0	0	0	116.5
431	S	28.4	Very low	27.4	Very low	109 Å²	109	144.8 Å²	144.8	76%	0.762	75%	0.753	S	S	*	*			trans	-151.7	104.2	148.7	48.3	0	0	0	0	111	E429 S433	E429-S431 PolarHBondContact O-N 3.03Å; S431-S433 PolarHBondContact O-N 2.97Å
432	T	22.9	Very low	27.7	Very low	152 Å²	152	143.4 Å²	143.4	93%	0.933	74%	0.744	S	S	*	*			trans	-65.5	108.1	164.6	38.1	0	0	0	0	109.5
433	S	27	Very low	28.3	Very low	98 Å²	98	140.1 Å²	140.1	69%	0.685	73%	0.728	S	S	*	*			trans	-142	129.8	161	85	0	0	0	0	110.5	S431	S431-S433 PolarHBondContact O-N 2.97Å
434	M	23.2	Very low	28.8	Very low	193 Å²	193	138.5 Å²	138.5	95%	0.951	72%	0.719	S	S	*	*	P	Polyproline II helix	trans	-68.3	125.9	-176.5	-61	-177.4	71.8	0	0	110.5
435	M	27.1	Very low	29.3	Very low	169 Å²	169	132.2 Å²	132.2	83%	0.833	69%	0.694	S	S	*	*	P	Polyproline II helix	trans	-102.8	142.9	173.5	-89.1	-166.6	170.2	0	0	112.7
436	N	28.8	Very low	30	Very low	131 Å²	131	125 Å²	125	70%	0.701	67%	0.665	S	S	*	*	P	Polyproline II helix	trans	-93.8	137.9	-162.9	-166.3	3.5	0	0	0	111.3	N438	N436-N438 PolarHBondContact O-N 3.12Å
437	P	27.1	Very low	30.6	Very low	85 Å²	85	123.2 Å²	123.2	55%	0.552	65%	0.651	S	S	*	*	S	Bend	trans	-91.3	37.9	-162.9	36.4	-35.9	0	0	0	116.6	S778	P437-S778 VanDerWaalsContact O-CB 3.28Å; P437-S778 WeakPolarHBondContact O-CB 3.41Å; P437-S778 PolarHBondContact O-OG 3.34Å
438	N	29.6	Very low	31.3	Very low	106 Å²	106	117.4 Å²	117.4	57%	0.567	64%	0.636	S	S	*	*			trans	-118.6	20.4	-166.7	-75.7	-11.3	0	0	0	118.1	N436	N436-N438 PolarHBondContact O-N 3.12Å
439	N	32.3	Very low	32.1	Very low	67 Å²	67	114.5 Å²	114.5	36%	0.358	61%	0.613	S	S	.	*			trans	-115.2	113.9	-177.1	-62.1	3.4	0	0	0	112.2	S377 Y378	S377-N439 PolarHBondContact OG-ND2 2.87Å; Y378-N439 HydrophobicContact CE1-CB 4.43Å; Y378-N439 WeakPolarHBondContact CE2-ND2 3.35Å; Y378-N439 VanDerWaalsContact CZ-CG 3.4Å; Y378-N439 VanDerWaalsContact CZ-ND2 3.26Å; Y378-N439 VanDerWaalsContact CZ-OD1 3.3Å; Y378-N439 PolarHBondContact OH-OD1 3.17Å
440	R	34.5	Very low	32.8	Very low	190 Å²	190	109.9 Å²	109.9	72%	0.717	59%	0.592	S	S	*	*			trans	-119.7	144.3	174.4	-99.1	-171.1	179.9	168.6	6.4	111.4	V775	R440-V775 PolarHBondContact NH1-O 2.94Å
441	L	36.4	Very low	33.8	Very low	82 Å²	82	105.8 Å²	105.8	43%	0.429	57%	0.569	S	S	.	*			trans	-61	149.3	169.8	-81.9	115.4	0	0	0	112	D443 V445	L441-D443 PolarHBondContact O-N 2.76Å; L441-V445 HydrophobicContact CD2-CG1 4.19Å
442	P	34.6	Very low	34.3	Very low	84 Å²	84	103.7 Å²	103.7	55%	0.545	55%	0.548	S	S	.	.			trans	-62.7	132.3	171.5	-13.7	26.4	0	0	0	111.1	N444 V445	P442-N444 PolarHBondContact O-N 2.74Å; P442-N444 VanDerWaalsContact O-N 3.09Å; P442-V445 HydrophobicContact CB-CG2 4.34Å; P442-V445 HydrophobicContact CG-CG2 4.35Å; P442-V445 WeakPolarHBondContact O-CB 3.34Å; P442-V445 PolarHBondContact O-N 2.84Å
443	D	35.7	Very low	35.5	Very low	91 Å²	91	99.8 Å²	99.8	49%	0.487	52%	0.521	S	S	.	.	H	α-helix	trans	-54.4	-34.1	-174.4	-71.3	-53.4	0	0	0	113.6	L441 V445 L446 E447	L441-D443 PolarHBondContact O-N 2.76Å; D443-V445 PolarHBondContact O-N 3.37Å; D443-L446 PolarHBondContact O-N 2.95Å; D443-E447 WeakPolarHBondContact O-CB 3.5Å; D443-E447 PolarHBondContact O-N 2.88Å
444	N	36.1	Very low	36.4	Very low	116 Å²	116	98.7 Å²	98.7	62%	0.62	51%	0.508	S	S	*	.	H	α-helix	trans	-61.4	-30.9	177.6	-55.1	10.2	0	0	0	112.6	P442 N448	P442-N444 PolarHBondContact O-N 2.74Å; P442-N444 VanDerWaalsContact O-N 3.09Å; N444-N448 WeakPolarHBondContact O-CB 3.44Å; N444-N448 VanDerWaalsContact O-CG 3.27Å; N444-N448 PolarHBondContact O-N 3Å; N444-N448 PolarHBondContact O-ND2 3.29Å
445	V	36.9	Very low	37.5	Very low	51 Å²	51	93.5 Å²	93.5	31%	0.309	48%	0.483	S	S	.	.	H	α-helix	trans	-79.2	-39.1	-179.5	-179.2	0	0	0	0	110.5	L441 P442 D443 N448 L449	L441-V445 HydrophobicContact CD2-CG1 4.19Å; P442-V445 HydrophobicContact CB-CG2 4.34Å; P442-V445 HydrophobicContact CG-CG2 4.35Å; P442-V445 WeakPolarHBondContact O-CB 3.34Å; P442-V445 PolarHBondContact O-N 2.84Å; D443-V445 PolarHBondContact O-N 3.37Å; V445-N448 PolarHBondContact O-N 2.76Å; V445-L449 HydrophobicContact CG1-CD1 4.25Å; V445-L449 WeakPolarHBondContact O-CG 3.39Å; V445-L449 PolarHBondContact O-N 3.3Å
446	L	40.3	Very low	38.5	Very low	66 Å²	66	88.9 Å²	88.9	35%	0.346	46%	0.461	S	S	.	.	H	α-helix	trans	-65.6	-40.4	176.3	-173.1	67.9	0	0	0	111.3	D443 L449 Q450	D443-L446 PolarHBondContact O-N 2.95Å; L446-L449 PolarHBondContact O-N 3.14Å; L446-Q450 WeakPolarHBondContact O-CB 3.33Å; L446-Q450 PolarHBondContact O-N 2.86Å
447	E	38.7	Very low	39.3	Very low	130 Å²	130	85.8 Å²	85.8	61%	0.607	44%	0.444	S	S	*	.	H	α-helix	trans	-64.1	-41.7	175.8	-157.7	169.8	-152	0	0	111.4	D443 Q450 I451	D443-E447 WeakPolarHBondContact O-CB 3.5Å; D443-E447 PolarHBondContact O-N 2.88Å; E447-Q450 PolarHBondContact O-N 2.8Å; E447-I451 HydrophobicContact CG-CD1 4.44Å; E447-I451 VanDerWaalsContact O-CG1 3.23Å; E447-I451 WeakPolarHBondContact O-CG1 3.45Å; E447-I451 PolarHBondContact O-N 2.89Å
448	N	39.7	Very low	40.2	Very low	95 Å²	95	87.5 Å²	87.5	51%	0.508	45%	0.445	S	S	.	.	H	α-helix	trans	-66.8	-36.6	175.1	-77.8	-42.7	0	0	0	113.7	N444 V445 I451 M452	N444-N448 WeakPolarHBondContact O-CB 3.44Å; N444-N448 VanDerWaalsContact O-CG 3.27Å; N444-N448 PolarHBondContact O-N 3Å; N444-N448 PolarHBondContact O-ND2 3.29Å; V445-N448 PolarHBondContact O-N 2.76Å; N448-I451 PolarHBondContact O-N 3.33Å; N448-M452 PolarHBondContact O-N 3.03Å
449	L	42.4	Very low	40.7	Very low	64 Å²	64	88 Å²	88	34%	0.335	44%	0.444	S	S	.	.	H	α-helix	trans	-67.7	-40.7	174.4	-74.5	169.7	0	0	0	111.5	V445 L446 M452 L453	V445-L449 HydrophobicContact CG1-CD1 4.25Å; V445-L449 WeakPolarHBondContact O-CG 3.39Å; V445-L449 PolarHBondContact O-N 3.3Å; L446-L449 PolarHBondContact O-N 3.14Å; L449-M452 HydrophobicContact CD2-CE 3.94Å; L449-M452 PolarHBondContact O-N 2.85Å; L449-L453 WeakPolarHBondContact O-CG 3.42Å; L449-L453 PolarHBondContact O-N 3.45Å
450	Q	42.2	Very low	41	Very low	60 Å²	60	89.1 Å²	89.1	28%	0.28	45%	0.45	S	S	.	.	H	α-helix	trans	-62.6	-43.2	173.9	-172.2	68.6	51.7	0	0	111.2	L446 E447 L453 N454 N654	L446-Q450 WeakPolarHBondContact O-CB 3.33Å; L446-Q450 PolarHBondContact O-N 2.86Å; E447-Q450 PolarHBondContact O-N 2.8Å; Q450-L453 PolarHBondContact O-N 3.35Å; Q450-N454 PolarHBondContact NE2-OD1 3.49Å; Q450-N454 VanDerWaalsContact O-CB 3.29Å; Q450-N454 WeakPolarHBondContact O-CB 3.18Å; Q450-N454 PolarHBondContact O-N 3.14Å; Q450-N454 PolarHBondContact O-OD1 3.4Å; Q450-N654 PolarHBondContact OE1-ND2 2.86Å
451	I	45.8	Very low	41	Very low	83 Å²	83	83.7 Å²	83.7	43%	0.426	44%	0.435	S	S	.	.	H	α-helix	trans	-61.9	-44.5	175.3	-68.9	163.6	0	0	0	110.7	E447 N448 N454 L455	E447-I451 HydrophobicContact CG-CD1 4.44Å; E447-I451 VanDerWaalsContact O-CG1 3.23Å; E447-I451 WeakPolarHBondContact O-CG1 3.45Å; E447-I451 PolarHBondContact O-N 2.89Å; N448-I451 PolarHBondContact O-N 3.33Å; I451-N454 PolarHBondContact O-N 2.67Å; I451-L455 HydrophobicContact CG2-CD1 3.77Å; I451-L455 HydrophobicContact CG2-CG 4.28Å; I451-L455 WeakPolarHBondContact O-CB 3.33Å; I451-L455 VanDerWaalsContact O-CG 3.24Å; I451-L455 WeakPolarHBondContact O-CG 3.43Å; I451-L455 PolarHBondContact O-N 3Å
452	M	40.2	Very low	40.9	Very low	64 Å²	64	83.3 Å²	83.3	32%	0.315	44%	0.436	S	S	.	.	H	α-helix	trans	-62.7	-43.7	176.4	-89.5	-158.8	-59.7	0	0	113	N448 L449 N454 L455 I456	N448-M452 PolarHBondContact O-N 3.03Å; L449-M452 HydrophobicContact CD2-CE 3.94Å; L449-M452 PolarHBondContact O-N 2.85Å; M452-N454 VanDerWaalsContact C-N 3.35Å; M452-L455 PolarHBondContact O-N 3.23Å; M452-I456 VanDerWaalsContact O-CG1 3.31Å; M452-I456 WeakPolarHBondContact O-CG1 3.29Å; M452-I456 PolarHBondContact O-N 2.89Å
453	L	46.5	Very low	40.6	Very low	71 Å²	71	83.1 Å²	83.1	37%	0.372	43%	0.43	S	S	.	.	H	α-helix	trans	-65.5	-39.8	177.2	-75.9	166.8	0	0	0	111.7	L449 Q450 I456 N457	L449-L453 WeakPolarHBondContact O-CG 3.42Å; L449-L453 PolarHBondContact O-N 3.45Å; Q450-L453 PolarHBondContact O-N 3.35Å; L453-I456 PolarHBondContact O-N 3.38Å; L453-N457 WeakPolarHBondContact O-CB 3.33Å; L453-N457 VanDerWaalsContact O-CG 3.28Å; L453-N457 PolarHBondContact O-N 2.81Å; L453-N457 PolarHBondContact O-ND2 2.8Å
454	N	46.4	Very low	40.4	Very low	75 Å²	75	83.8 Å²	83.8	40%	0.401	43%	0.433	S	S	.	.	H	α-helix	trans	-63.5	-43.3	174.3	-70.1	-2.4	0	0	0	110.9	Q450 I451 M452 N457 E458	Q450-N454 PolarHBondContact NE2-OD1 3.49Å; Q450-N454 VanDerWaalsContact O-CB 3.29Å; Q450-N454 WeakPolarHBondContact O-CB 3.18Å; Q450-N454 PolarHBondContact O-N 3.14Å; Q450-N454 PolarHBondContact O-OD1 3.4Å; I451-N454 PolarHBondContact O-N 2.67Å; M452-N454 VanDerWaalsContact C-N 3.35Å; N454-N457 PolarHBondContact O-N 3.08Å; N454-E458 WeakPolarHBondContact O-CB 3.44Å; N454-E458 WeakPolarHBondContact O-CG 3.45Å; N454-E458 PolarHBondContact O-N 3.32Å
455	L	46.9	Very low	40	Very low	84 Å²	84	80.9 Å²	80.9	44%	0.44	42%	0.422	S	S	.	.	H	α-helix	trans	-64.2	-40.6	176.4	-74.8	168.6	0	0	0	112.6	I451 M452 N457 E458 E459	I451-L455 HydrophobicContact CG2-CD1 3.77Å; I451-L455 HydrophobicContact CG2-CG 4.28Å; I451-L455 WeakPolarHBondContact O-CB 3.33Å; I451-L455 VanDerWaalsContact O-CG 3.24Å; I451-L455 WeakPolarHBondContact O-CG 3.43Å; I451-L455 PolarHBondContact O-N 3Å; M452-L455 PolarHBondContact O-N 3.23Å; L455-N457 VanDerWaalsContact C-N 3.33Å; L455-E458 PolarHBondContact O-N 3.47Å; L455-E459 VanDerWaalsContact O-CB 3.32Å; L455-E459 WeakPolarHBondContact O-CB 3.32Å; L455-E459 WeakPolarHBondContact O-CG 3.5Å; L455-E459 PolarHBondContact O-N 2.78Å
456	I	48.2	Very low	39.5	Very low	72 Å²	72	84.7 Å²	84.7	37%	0.369	43%	0.432	S	S	.	.	H	α-helix	trans	-64.4	-40.3	175	-69.2	164.9	0	0	0	110.8	M452 L453 N460	M452-I456 VanDerWaalsContact O-CG1 3.31Å; M452-I456 WeakPolarHBondContact O-CG1 3.29Å; M452-I456 PolarHBondContact O-N 2.89Å; L453-I456 PolarHBondContact O-N 3.38Å; I456-N460 WeakPolarHBondContact O-CB 3.45Å; I456-N460 VanDerWaalsContact O-CG 3.3Å; I456-N460 PolarHBondContact O-N 3.49Å; I456-N460 PolarHBondContact O-ND2 2.91Å
457	N	45.6	Very low	38.8	Very low	65 Å²	65	87.6 Å²	87.6	35%	0.348	45%	0.447	S	S	.	.	H	α-helix	trans	-67.7	-40.1	176.2	-72.7	-29	0	0	0	111.7	L453 N454 L455 L461	L453-N457 WeakPolarHBondContact O-CB 3.33Å; L453-N457 VanDerWaalsContact O-CG 3.28Å; L453-N457 PolarHBondContact O-N 2.81Å; L453-N457 PolarHBondContact O-ND2 2.8Å; N454-N457 PolarHBondContact O-N 3.08Å; L455-N457 VanDerWaalsContact C-N 3.33Å; N457-L461 WeakPolarHBondContact O-CD1 3.4Å; N457-L461 WeakPolarHBondContact O-CG 3.21Å; N457-L461 PolarHBondContact O-N 3.31Å
458	E	44.6	Very low	38.3	Very low	122 Å²	122	86 Å²	86	57%	0.57	45%	0.45	S	S	*	.	H	α-helix	trans	-67.4	-41.4	173.7	-76.3	-168.3	175.6	0	0	112.5	N454 L455 N460 L461 V462	N454-E458 WeakPolarHBondContact O-CB 3.44Å; N454-E458 WeakPolarHBondContact O-CG 3.45Å; N454-E458 PolarHBondContact O-N 3.32Å; L455-E458 PolarHBondContact O-N 3.47Å; E458-N460 VanDerWaalsContact C-N 3.33Å; E458-N460 PolarHBondContact O-N 3.04Å; E458-L461 CarbonylContact O-C 3.59Å; E458-L461 WeakPolarHBondContact O-CB 3.32Å; E458-L461 PolarHBondContact O-N 3.25Å; E458-L461 VanDerWaalsContact O-N 3.17Å; E458-V462 WeakPolarHBondContact O-CG2 3.39Å; E458-V462 PolarHBondContact O-N 2.95Å
459	E	41.6	Very low	37.7	Very low	117 Å²	117	90.2 Å²	90.2	55%	0.547	46%	0.464	S	S	.	.	H	α-helix	trans	-67.1	-33.6	176	-80	-174.8	171.7	0	0	111.9	L455 V462 N463	L455-E459 VanDerWaalsContact O-CB 3.32Å; L455-E459 WeakPolarHBondContact O-CB 3.32Å; L455-E459 WeakPolarHBondContact O-CG 3.5Å; L455-E459 PolarHBondContact O-N 2.78Å; E459-V462 PolarHBondContact O-N 3.19Å; E459-N463 WeakPolarHBondContact O-CB 3.11Å; E459-N463 VanDerWaalsContact O-CG 3.29Å; E459-N463 PolarHBondContact O-N 3.2Å; E459-N463 PolarHBondContact O-ND2 3.31Å
460	N	38.5	Very low	37	Very low	89 Å²	89	94.3 Å²	94.3	48%	0.476	48%	0.481	S	S	.	.	H	α-helix	trans	-67.4	-39.1	170.3	-77.4	-31.7	0	0	0	111.6	I456 E458 L464	I456-N460 WeakPolarHBondContact O-CB 3.45Å; I456-N460 VanDerWaalsContact O-CG 3.3Å; I456-N460 PolarHBondContact O-N 3.49Å; I456-N460 PolarHBondContact O-ND2 2.91Å; E458-N460 VanDerWaalsContact C-N 3.33Å; E458-N460 PolarHBondContact O-N 3.04Å; N460-L464 WeakPolarHBondContact O-CB 3.43Å; N460-L464 WeakPolarHBondContact O-CD1 3.43Å; N460-L464 PolarHBondContact O-N 2.86Å
461	L	34.9	Very low	36.4	Very low	76 Å²	76	96.5 Å²	96.5	40%	0.398	50%	0.503	S	S	.	.	H	α-helix	trans	-65.5	-36.6	174.3	-78.6	158	0	0	0	112.4	N457 E458 S465	N457-L461 WeakPolarHBondContact O-CD1 3.4Å; N457-L461 WeakPolarHBondContact O-CG 3.21Å; N457-L461 PolarHBondContact O-N 3.31Å; E458-L461 CarbonylContact O-C 3.59Å; E458-L461 WeakPolarHBondContact O-CB 3.32Å; E458-L461 PolarHBondContact O-N 3.25Å; E458-L461 VanDerWaalsContact O-N 3.17Å; L461-S465 PolarHBondContact O-OG 3.49Å
462	V	33.5	Very low	35.5	Very low	74 Å²	74	100 Å²	100	45%	0.448	52%	0.521	S	S	.	.	H	α-helix	trans	-79.2	-51.9	178.2	176.8	0	0	0	0	110.2	E458 E459 L464 S465 Y466	E458-V462 WeakPolarHBondContact O-CG2 3.39Å; E458-V462 PolarHBondContact O-N 2.95Å; E459-V462 PolarHBondContact O-N 3.19Å; V462-L464 PolarHBondContact O-N 2.86Å; V462-S465 PolarHBondContact O-N 2.72Å; V462-S465 VanDerWaalsContact O-N 3.14Å; V462-S465 PolarHBondContact O-OG 3.13Å; V462-Y466 HydrophobicContact CG1-CD2 4.01Å; V462-Y466 HydrophobicContact CG1-CE2 3.87Å; V462-Y466 VanDerWaalsContact O-CD2 3.23Å; V462-Y466 WeakPolarHBondContact O-CD2 3.39Å; V462-Y466 PolarHBondContact O-N 3.31Å
463	N	29.2	Very low	34.9	Very low	81 Å²	81	103 Å²	103	43%	0.433	54%	0.543	S	S	.	.	H	α-helix	trans	-67.5	-29.5	-173.2	-69.5	-31.2	0	0	0	114.2	E459 Y466 L467	E459-N463 WeakPolarHBondContact O-CB 3.11Å; E459-N463 VanDerWaalsContact O-CG 3.29Å; E459-N463 PolarHBondContact O-N 3.2Å; E459-N463 PolarHBondContact O-ND2 3.31Å; N463-Y466 PolarHBondContact O-N 3.4Å; N463-L467 WeakPolarHBondContact O-CB 3.46Å; N463-L467 WeakPolarHBondContact O-CD1 3.44Å; N463-L467 WeakPolarHBondContact O-CG 3.42Å; N463-L467 PolarHBondContact O-N 3.22Å; N463-L467 VanDerWaalsContact O-N 3.13Å
464	L	29.7	Very low	34	Very low	105 Å²	105	106.9 Å²	106.9	55%	0.55	56%	0.564	S	S	.	*	H	α-helix	trans	-73.1	-28.2	175	-79.8	158	0	0	0	113.2	N460 V462	N460-L464 WeakPolarHBondContact O-CB 3.43Å; N460-L464 WeakPolarHBondContact O-CD1 3.43Å; N460-L464 PolarHBondContact O-N 2.86Å; V462-L464 PolarHBondContact O-N 2.86Å
465	S	28.2	Very low	33	Very low	54 Å²	54	114.6 Å²	114.6	38%	0.378	59%	0.588	S	S	.	*	H	α-helix	trans	-77.1	-19.9	175.6	65.3	0	0	0	0	113.4	L461 V462	L461-S465 PolarHBondContact O-OG 3.49Å; V462-S465 PolarHBondContact O-N 2.72Å; V462-S465 VanDerWaalsContact O-N 3.14Å; V462-S465 PolarHBondContact O-OG 3.13Å
466	Y	25.8	Very low	32.1	Very low	132 Å²	132	117.3 Å²	117.3	52%	0.518	60%	0.603	S	S	.	*	H	α-helix	trans	-96	-27.4	177.3	-76.7	-99.9	0	0	0	113.9	V462 N463 S468 K469	V462-Y466 HydrophobicContact CG1-CD2 4.01Å; V462-Y466 HydrophobicContact CG1-CE2 3.87Å; V462-Y466 VanDerWaalsContact O-CD2 3.23Å; V462-Y466 WeakPolarHBondContact O-CD2 3.39Å; V462-Y466 PolarHBondContact O-N 3.31Å; N463-Y466 PolarHBondContact O-N 3.4Å; Y466-S468 VanDerWaalsContact C-N 3.25Å; Y466-S468 PolarHBondContact O-N 2.93Å; Y466-K469 PolarHBondContact O-N 3.33Å
467	L	26.1	Very low	31	Very low	126 Å²	126	120.8 Å²	120.8	66%	0.66	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.6	-9.9	-176.8	-88.3	159.4	0	0	0	115.5	N463	N463-L467 WeakPolarHBondContact O-CB 3.46Å; N463-L467 WeakPolarHBondContact O-CD1 3.44Å; N463-L467 WeakPolarHBondContact O-CG 3.42Å; N463-L467 PolarHBondContact O-N 3.22Å; N463-L467 VanDerWaalsContact O-N 3.13Å
468	S	27.7	Very low	30.1	Very low	96 Å²	96	127.1 Å²	127.1	67%	0.671	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	-2.9	177.5	60.5	0	0	0	0	114.8	Y466	Y466-S468 VanDerWaalsContact C-N 3.25Å; Y466-S468 PolarHBondContact O-N 2.93Å
469	K	27.2	Very low	29.1	Very low	185 Å²	185	131 Å²	131	80%	0.804	67%	0.665	S	S	*	*	T	Hydrogen-bonded Turn	trans	-124.7	-9.8	-177.6	-81	-179.2	176.7	174.8	0	116.3	Y466	Y466-K469 PolarHBondContact O-N 3.33Å
470	E	28.9	Very low	28.4	Very low	149 Å²	149	130.4 Å²	130.4	70%	0.696	67%	0.674	S	S	*	*	S	Bend	trans	-99.9	7.5	-171.7	-73.9	-172.6	158.3	0	0	115.9
471	S	29.1	Very low	27.8	Very low	106 Å²	106	134.6 Å²	134.6	74%	0.741	69%	0.688	S	S	*	*	S	Bend	trans	-97.7	14.6	178.1	60.5	0	0	0	0	115.8
472	I	27.8	Very low	27.4	Very low	156 Å²	156	140 Å²	140	80%	0.8	71%	0.711	S	S	*	*			trans	-122.6	69.8	175.5	-48.4	176.7	0	0	0	109.7
473	T	25.9	Very low	27	Very low	127 Å²	127	140.9 Å²	140.9	78%	0.779	71%	0.713	S	S	*	*			trans	-104.4	76.3	162.7	55	0	0	0	0	109
474	D	29.3	Very low	26.9	Very low	154 Å²	154	145 Å²	145	82%	0.824	74%	0.735	S	S	*	*			trans	-139.4	104.9	152.1	-98.4	-29.1	0	0	0	108.2	N476	D474-N476 PolarHBondContact O-N 3.45Å
475	R	25	Very low	26.6	Very low	236 Å²	236	147.3 Å²	147.3	89%	0.891	74%	0.741	S	S	*	*			trans	-59.7	113	165.7	-78.8	174.5	170	166.6	-2.7	106.5
476	N	26.8	Very low	26.5	Very low	142 Å²	142	150.6 Å²	150.6	76%	0.759	76%	0.758	S	S	*	*	S	Bend	trans	174.1	127.8	132.3	-77.5	-24.4	0	0	0	109.8	D474	D474-N476 PolarHBondContact O-N 3.45Å
477	D	24.9	Very low	26.4	Very low	144 Å²	144	150.7 Å²	150.7	77%	0.77	76%	0.764	S	S	*	*			trans	54.6	76	154.2	-58.6	-21.5	0	0	0	119.6
478	F	27.6	Very low	26.3	Very low	198 Å²	198	148.6 Å²	148.6	87%	0.868	75%	0.752	S	S	*	*			trans	-152.9	119.3	146.9	-93	-73.2	0	0	0	112.7	S480	F478-S480 VanDerWaalsContact C-N 3.33Å; F478-S480 PolarHBondContact O-N 2.85Å; F478-S480 VanDerWaalsContact O-N 3.1Å
479	Q	23.8	Very low	26.1	Very low	205 Å²	205	151.3 Å²	151.3	96%	0.958	75%	0.752	S	S	*	*			trans	-68.8	87.4	156.7	-82.2	172.5	-37.5	0	0	108.2
480	S	26.7	Very low	26.1	Very low	104 Å²	104	146.2 Å²	146.2	73%	0.727	73%	0.73	S	S	*	*			trans	-93	125.5	174.8	55.7	0	0	0	0	110.8	F478	F478-S480 VanDerWaalsContact C-N 3.33Å; F478-S480 PolarHBondContact O-N 2.85Å; F478-S480 VanDerWaalsContact O-N 3.1Å
481	K	25.9	Very low	25.8	Very low	177 Å²	177	147 Å²	147	77%	0.77	73%	0.734	S	S	*	*			trans	-63.4	140	176.2	-67.5	173.5	175.3	177.3	0	110.5	D483	K481-D483 VanDerWaalsContact C-N 3.33Å; K481-D483 PolarHBondContact O-N 3.31Å
482	E	25.9	Very low	25.6	Very low	190 Å²	190	148.5 Å²	148.5	89%	0.888	73%	0.733	S	S	*	*	S	Bend	trans	-65.6	82.4	169.4	-65.9	172.4	147.3	0	0	110.3
483	D	25.6	Very low	25.3	Very low	91 Å²	91	149.3 Å²	149.3	49%	0.487	73%	0.73	S	S	.	*			trans	-151.9	31.2	179.6	-79.8	-44.4	0	0	0	113.5	K481 F485	K481-D483 VanDerWaalsContact C-N 3.33Å; K481-D483 PolarHBondContact O-N 3.31Å; D483-F485 WeakPolarHBondContact O-CD2 3.41Å; D483-F485 PolarHBondContact O-N 2.97Å
484	D	26.9	Very low	25.3	Very low	167 Å²	167	150 Å²	150	89%	0.893	73%	0.729	S	S	*	*			trans	-89.5	93.9	178.3	-76.5	-14.9	0	0	0	112.1
485	F	24.4	Very low	25.1	Very low	154 Å²	154	149.7 Å²	149.7	68%	0.675	73%	0.728	S	S	*	*			trans	-75.1	131.1	169.4	-66.9	-96.1	0	0	0	110.7	D483	D483-F485 WeakPolarHBondContact O-CD2 3.41Å; D483-F485 PolarHBondContact O-N 2.97Å
486	V	24.8	Very low	25	Very low	123 Å²	123	143.8 Å²	143.8	75%	0.745	72%	0.722	S	S	*	*			trans	-99.8	89.8	167	-177.2	0	0	0	0	108.6	I488	V486-I488 HydrophobicContact CG1-CG1 4.2Å
487	E	23.9	Very low	24.8	Very low	135 Å²	135	146.7 Å²	146.7	63%	0.631	73%	0.728	S	S	*	*			trans	-84.8	117.8	166.2	-82	-172.3	141.6	0	0	109.8	F489	E487-F489 HydrophobicContact CB-CD2 4.28Å; E487-F489 HydrophobicContact CB-CE2 3.74Å; E487-F489 HydrophobicContact CB-CZ 4.33Å; E487-F489 WeakPolarHBondContact OE2-CE2 3.44Å; E487-F489 VanDerWaalsContact OE2-CZ 3.26Å; E487-F489 WeakPolarHBondContact OE2-CZ 3.41Å
488	I	25.4	Very low	24.6	Very low	82 Å²	82	145.1 Å²	145.1	42%	0.421	73%	0.728	S	S	.	*			trans	-98.2	115.6	166.7	-55.7	176.9	0	0	0	107.8	V486 F490 K1077	V486-I488 HydrophobicContact CG1-CG1 4.2Å; I488-F490 HydrophobicContact CG2-CD2 4.49Å; I488-F490 HydrophobicContact CG2-CE2 3.93Å; I488-F490 HydrophobicContact CG2-CZ 4.25Å; I488-K1077 WeakPolarHBondContact O-CE 3.34Å
489	F	23.4	Very low	24.4	Very low	152 Å²	152	141.7 Å²	141.7	67%	0.667	72%	0.723	S	S	*	*			trans	-89.1	126.4	176.1	-71.3	-90.8	0	0	0	110.4	E487	E487-F489 HydrophobicContact CB-CD2 4.28Å; E487-F489 HydrophobicContact CB-CE2 3.74Å; E487-F489 HydrophobicContact CB-CZ 4.33Å; E487-F489 WeakPolarHBondContact OE2-CE2 3.44Å; E487-F489 VanDerWaalsContact OE2-CZ 3.26Å; E487-F489 WeakPolarHBondContact OE2-CZ 3.41Å
490	F	25.4	Very low	24.3	Very low	78 Å²	78	141 Å²	141	34%	0.342	72%	0.72	S	S	.	*			trans	-105.4	111.1	159	-67.2	-84.2	0	0	0	107.1	I488 L492 L535 H1076 K1077	I488-F490 HydrophobicContact CG2-CD2 4.49Å; I488-F490 HydrophobicContact CG2-CE2 3.93Å; I488-F490 HydrophobicContact CG2-CZ 4.25Å; F490-L492 PolarHBondContact O-N 2.83Å; F490-L535 HydrophobicContact CE1-CD2 3.75Å; F490-L535 HydrophobicContact CZ-CD2 4.26Å; F490-H1076 WeakPolarHBondContact CD2-O 3.23Å; F490-K1077 HydrophobicContact CD2-CB 4.24Å; F490-K1077 HydrophobicContact CD2-CG 4.3Å
491	Q	23.1	Very low	24.2	Very low	166 Å²	166	140.8 Å²	140.8	78%	0.776	72%	0.718	S	S	*	*			trans	-80.7	110.4	-176.1	-173.4	170.6	4.9	0	0	110.2
492	L	25.2	Very low	24.1	Very low	137 Å²	137	141 Å²	141	72%	0.717	72%	0.719	S	S	*	*			trans	-80.3	118.3	162.4	-85.5	155.7	0	0	0	108.7	F490	F490-L492 PolarHBondContact O-N 2.83Å
493	K	22.7	Very low	24	Very low	173 Å²	173	140.3 Å²	140.3	75%	0.752	71%	0.713	S	S	*	*			trans	-84.3	112.8	157.3	-96.8	-177.8	173.8	177.4	0	106.6
494	D	25.9	Very low	24.1	Very low	141 Å²	141	142.7 Å²	142.7	75%	0.754	73%	0.726	S	S	*	*				170.1	114.9	124	-78.4	-15.1	0	0	0	110.7
495	D	24	Very low	23.9	Very low	149 Å²	149	145.1 Å²	145.1	80%	0.797	72%	0.723	S	S	*	*			trans	44.8	119.4	149.1	-62.4	-17.5	0	0	0	122.4
496	C	22.8	Very low	23.9	Very low	112 Å²	112	144.1 Å²	144.1	76%	0.757	72%	0.724	S	S	*	*			trans	79	93.2	154.5	-56.2	0	0	0	0	118.3
497	F	23.3	Very low	24.1	Very low	203 Å²	203	149.3 Å²	149.3	89%	0.89	73%	0.732	S	S	*	*				-174.7	111.5	116.9	-97.4	-71.1	0	0	0	110.5
498	S	20.6	Very low	24.1	Very low	111 Å²	111	150.2 Å²	150.2	78%	0.776	74%	0.741	S	S	*	*			trans	-76.1	123.7	167.6	51.2	0	0	0	0	110.6
499	V	23.5	Very low	24.1	Very low	125 Å²	125	149.4 Å²	149.4	76%	0.758	75%	0.754	S	S	*	*			trans	-135.3	94.7	157.2	-177.9	0	0	0	0	109.1
500	E	21.5	Very low	24.3	Very low	192 Å²	192	150.2 Å²	150.2	90%	0.897	76%	0.763	S	S	*	*			trans	-65.7	138.3	149	-66	177.5	149.6	0	0	109.4
501	S	25	Very low	24.5	Very low	98 Å²	98	155.1 Å²	155.1	69%	0.685	79%	0.787	S	S	*	*			trans	-168	110.9	141.2	49	0	0	0	0	109.4
502	K	22.8	Very low	24.5	Very low	181 Å²	181	155 Å²	155	79%	0.787	79%	0.791	S	S	*	*				59.4	118.6	103.4	-70.8	178.3	176.4	174.4	0	111.8
503	F	24.4	Very low	24.6	Very low	176 Å²	176	158 Å²	158	77%	0.772	80%	0.799	S	S	*	*				-171.7	156.8	70.5	-79	-90	0	0	0	107
504	D	26.9	Very low	24.7	Very low	142 Å²	142	158.8 Å²	158.8	76%	0.759	81%	0.805	S	S	*	*			cis	-157	154.4	7.4	-125.9	-23.5	0	0	0	109.6
505	R	23.7	Very low	24.7	Very low	218 Å²	218	160.4 Å²	160.4	82%	0.823	81%	0.813	S	S	*	*			trans	-73.6	145.6	175.3	-64	175.7	178.5	-178.4	-1.3	110.6
506	D	24.4	Very low	24.7	Very low	132 Å²	132	161.4 Å²	161.4	71%	0.706	81%	0.813	S	S	*	*				160	114.5	117.8	-80.3	-20.5	0	0	0	109.5
507	Y	28.5	Very low	24.7	Very low	233 Å²	233	163.1 Å²	163.1	91%	0.914	81%	0.814	S	S	*	*				-169.1	124.7	118.7	-113.1	-85.2	0	0	0	110.4
508	N	24.7	Very low	24.8	Very low	153 Å²	153	160.3 Å²	160.3	82%	0.818	81%	0.814	S	S	*	*			trans	-62.9	151.8	-170.6	-71.2	-58	0	0	0	115.2
509	G	25.4	Very low	24.9	Very low	66 Å²	66	160.9 Å²	160.9	68%	0.68	82%	0.818	S	S	*	*			trans	113.9	99.1	136.9	0	0	0	0	0	115.1
510	I	27.6	Very low	25.1	Very low	168 Å²	168	159 Å²	159	86%	0.862	82%	0.816	S	S	*	*				173	104.4	110.2	-81.3	153.1	0	0	0	108.4
511	Q	28.4	Very low	25.2	Very low	182 Å²	182	159.5 Å²	159.5	85%	0.85	82%	0.815	S	S	*	*			trans	24.9	118	143.1	-63.2	-177.4	-7.8	0	0	120.4
512	N	23.6	Very low	25.2	Very low	162 Å²	162	161.2 Å²	161.2	87%	0.866	82%	0.816	S	S	*	*			trans	-35.2	130.3	148.5	-63.8	-29	0	0	0	113.9
513	K	27.8	Very low	25.3	Very low	201 Å²	201	160.3 Å²	160.3	87%	0.874	82%	0.82	S	S	*	*			trans	-153.1	124.9	138.3	-113.6	174.6	-175.9	178.4	0	109.9	L515	K513-L515 PolarHBondContact O-N 3.18Å
514	E	24.7	Very low	25.4	Very low	190 Å²	190	158.1 Å²	158.1	89%	0.888	82%	0.821	S	S	*	*			trans	-45.3	127.5	172.7	-64.5	162.4	135.2	0	0	111.6
515	L	25.8	Very low	25.3	Very low	175 Å²	175	157.7 Å²	157.7	92%	0.916	82%	0.824	S	S	*	*			trans	-138.9	109.2	157.6	-107.5	147.3	0	0	0	108.3	K513	K513-L515 PolarHBondContact O-N 3.18Å
516	Q	23.8	Very low	25.5	Very low	170 Å²	170	152.4 Å²	152.4	79%	0.794	82%	0.82	S	S	*	*			trans	-58.8	147.3	175.2	-66.9	174.3	-15.6	0	0	111.3
517	N	22.7	Very low	25.7	Very low	147 Å²	147	149.7 Å²	149.7	79%	0.786	81%	0.808	S	S	*	*			trans	54	95.6	152.6	-66.8	-15.5	0	0	0	117.3
518	T	24.8	Very low	25.7	Very low	145 Å²	145	143.6 Å²	143.6	89%	0.89	79%	0.792	S	S	*	*			trans	-158.1	125.2	131.9	18.8	0	0	0	0	109.6	A520	T518-A520 PolarHBondContact O-N 2.87Å
519	S	23.5	Very low	26	Very low	122 Å²	122	144.4 Å²	144.4	85%	0.853	79%	0.79	S	S	*	*			trans	-64.6	117.8	175.8	50.2	0	0	0	0	111.3
520	A	26.7	Very low	26.3	Very low	86 Å²	86	147.2 Å²	147.2	71%	0.711	79%	0.79	S	S	*	*			trans	-122.8	89.4	161.3	0	0	0	0	0	108.3	T518 N522	T518-A520 PolarHBondContact O-N 2.87Å; A520-N522 PolarHBondContact O-N 3.18Å
521	K	24.4	Very low	26.5	Very low	202 Å²	202	144.2 Å²	144.2	88%	0.878	77%	0.772	S	S	*	*			trans	-59.5	113.8	158.7	-78.5	173.6	170	179.1	0	106.9
522	N	25.7	Very low	26.6	Very low	134 Å²	134	139.1 Å²	139.1	72%	0.717	75%	0.75	S	S	*	*			trans	-143.5	100.6	165.8	-82.7	-26	0	0	0	109.3	A520	A520-N522 PolarHBondContact O-N 3.18Å
523	N	24.5	Very low	26.8	Very low	162 Å²	162	133.1 Å²	133.1	87%	0.866	73%	0.727	S	S	*	*			trans	52.9	64.4	146.7	-55.7	-6.1	0	0	0	119
524	V	25.6	Very low	26.9	Very low	131 Å²	131	129.7 Å²	129.7	79%	0.794	71%	0.712	S	S	*	*			trans	-104.1	113.8	142.3	178.3	0	0	0	0	105	S526	V524-S526 VanDerWaalsContact C-N 3.26Å; V524-S526 PolarHBondContact O-N 2.73Å
525	T	25.3	Very low	27.1	Very low	132 Å²	132	123.8 Å²	123.8	81%	0.81	69%	0.686	S	S	*	*			trans	-62.5	95.9	166.9	38.8	0	0	0	0	107.1	V527	T525-V527 PolarHBondContact O-N 2.98Å
526	S	27	Very low	27.2	Very low	108 Å²	108	120.8 Å²	120.8	76%	0.755	67%	0.667	S	S	*	*			trans	-60.4	103.7	167.4	53.1	0	0	0	0	107.1	V524 N528	V524-S526 VanDerWaalsContact C-N 3.26Å; V524-S526 PolarHBondContact O-N 2.73Å; S526-N528 PolarHBondContact O-N 3.47Å
527	V	30.2	Very low	27.5	Very low	74 Å²	74	115.7 Å²	115.7	45%	0.448	65%	0.65	S	S	.	*			trans	-53	125.8	169.8	-179.8	0	0	0	0	107.1	T525 E529 E531 I532	T525-V527 PolarHBondContact O-N 2.98Å; V527-E529 PolarHBondContact O-N 3.39Å; V527-E531 HydrophobicContact CG1-CB 3.89Å; V527-I532 HydrophobicContact CB-CD1 4.39Å; V527-I532 HydrophobicContact CB-CG1 4.27Å; V527-I532 HydrophobicContact CG1-CD1 4.38Å; V527-I532 HydrophobicContact CG1-CG1 3.73Å
528	N	28.2	Very low	28.3	Very low	106 Å²	106	111.2 Å²	111.2	57%	0.567	62%	0.624	S	S	*	*			trans	-57.3	132.4	-177.3	-142.8	-12.3	0	0	0	108.2	S526 N530 E531 I532	S526-N528 PolarHBondContact O-N 3.47Å; N528-N530 PolarHBondContact O-N 3.06Å; N528-E531 HydrophobicContact CB-CG 4.24Å; N528-E531 WeakPolarHBondContact O-CA 3.44Å; N528-E531 WeakPolarHBondContact O-CB 3.26Å; N528-E531 PolarHBondContact O-N 2.93Å; N528-I532 PolarHBondContact O-N 3.1Å
529	E	30.8	Very low	29	Very low	169 Å²	169	106 Å²	106	79%	0.79	59%	0.593	S	S	*	*	H	α-helix	trans	-55.5	-25.2	-178.4	-69.1	-178.6	159.9	0	0	112.3	V527 I532 G533	V527-E529 PolarHBondContact O-N 3.39Å; E529-I532 PolarHBondContact O-N 2.94Å; E529-G533 PolarHBondContact O-N 2.85Å; E529-G533 VanDerWaalsContact O-N 3.12Å
530	N	31.8	Very low	29.8	Very low	125 Å²	125	107.6 Å²	107.6	67%	0.668	58%	0.582	S	S	*	*	H	α-helix	trans	-70.1	-26.8	172.8	-72.3	-19.5	0	0	0	114.5	N528 K534	N528-N530 PolarHBondContact O-N 3.06Å; N530-K534 WeakPolarHBondContact O-CG 3.47Å; N530-K534 PolarHBondContact O-N 2.65Å
531	E	32.3	Very low	30.9	Very low	105 Å²	105	105 Å²	105	49%	0.491	56%	0.555	S	S	.	*	H	α-helix	trans	-80.7	-32.2	173.4	-70.1	-173.9	163	0	0	111.5	V527 N528 K534 L535	V527-E531 HydrophobicContact CG1-CB 3.89Å; N528-E531 HydrophobicContact CB-CG 4.24Å; N528-E531 WeakPolarHBondContact O-CA 3.44Å; N528-E531 WeakPolarHBondContact O-CB 3.26Å; N528-E531 PolarHBondContact O-N 2.93Å; E531-K534 WeakPolarHBondContact O-CB 3.35Å; E531-K534 PolarHBondContact O-N 2.96Å; E531-L535 WeakPolarHBondContact O-CG 3.43Å; E531-L535 PolarHBondContact O-N 3.45Å
532	I	28.9	Very low	32.6	Very low	76 Å²	76	97.5 Å²	97.5	39%	0.39	52%	0.522	S	S	.	.	H	α-helix	trans	-66.2	-39.8	173.4	-57.6	176.3	0	0	0	110.6	V527 N528 E529 K534 L535 Q536	V527-I532 HydrophobicContact CB-CD1 4.39Å; V527-I532 HydrophobicContact CB-CG1 4.27Å; V527-I532 HydrophobicContact CG1-CD1 4.38Å; V527-I532 HydrophobicContact CG1-CG1 3.73Å; N528-I532 PolarHBondContact O-N 3.1Å; E529-I532 PolarHBondContact O-N 2.94Å; I532-K534 VanDerWaalsContact C-N 3.33Å; I532-K534 PolarHBondContact O-N 2.89Å; I532-L535 PolarHBondContact O-N 3.46Å; I532-Q536 WeakPolarHBondContact O-CB 3.38Å; I532-Q536 PolarHBondContact O-N 3.26Å
533	G	28.8	Very low	34	Very low	36 Å²	36	95 Å²	95	37%	0.371	51%	0.505	S	S	.	.	H	α-helix	trans	-65.8	-32.5	172.8	0	0	0	0	0	113.7	E529 S537	E529-G533 PolarHBondContact O-N 2.85Å; E529-G533 VanDerWaalsContact O-N 3.12Å; G533-S537 PolarHBondContact O-N 2.98Å; G533-S537 PolarHBondContact O-OG 2.88Å
534	K	29.3	Very low	35.6	Very low	129 Å²	129	90.3 Å²	90.3	56%	0.561	48%	0.481	S	S	*	.	H	α-helix	trans	-67.7	-46.2	170.5	-76.5	175.6	179	-179.2	0	111	N530 E531 I532 Q536 S537 F538	N530-K534 WeakPolarHBondContact O-CG 3.47Å; N530-K534 PolarHBondContact O-N 2.65Å; E531-K534 WeakPolarHBondContact O-CB 3.35Å; E531-K534 PolarHBondContact O-N 2.96Å; I532-K534 VanDerWaalsContact C-N 3.33Å; I532-K534 PolarHBondContact O-N 2.89Å; K534-Q536 PolarHBondContact O-N 2.87Å; K534-S537 PolarHBondContact O-N 3.33Å; K534-S537 PolarHBondContact O-OG 2.8Å; K534-F538 HydrophobicContact CB-CE2 4.34Å; K534-F538 WeakPolarHBondContact O-CD2 3.26Å; K534-F538 WeakPolarHBondContact O-CE2 3.37Å; K534-F538 PolarHBondContact O-N 3.35Å
535	L	28.8	Very low	37.5	Very low	66 Å²	66	85.8 Å²	85.8	35%	0.346	45%	0.449	S	S	.	.	H	α-helix	trans	-63.4	-38.1	177.5	-73.1	157.7	0	0	0	112.5	F490 E531 I532 S537 F538 S539	F490-L535 HydrophobicContact CE1-CD2 3.75Å; F490-L535 HydrophobicContact CZ-CD2 4.26Å; E531-L535 WeakPolarHBondContact O-CG 3.43Å; E531-L535 PolarHBondContact O-N 3.45Å; I532-L535 PolarHBondContact O-N 3.46Å; L535-S537 VanDerWaalsContact C-N 3.34Å; L535-S537 PolarHBondContact O-N 2.69Å; L535-F538 PolarHBondContact O-N 2.9Å; L535-S539 PolarHBondContact O-N 3.45Å
536	Q	27.4	Very low	39.6	Very low	111 Å²	111	82.5 Å²	82.5	52%	0.519	43%	0.425	S	S	.	.	H	α-helix	trans	-63.1	-36.5	175.8	-85.2	-176.8	-16.6	0	0	113.2	I532 K534 F538 Y540	I532-Q536 WeakPolarHBondContact O-CB 3.38Å; I532-Q536 PolarHBondContact O-N 3.26Å; K534-Q536 PolarHBondContact O-N 2.87Å; Q536-F538 VanDerWaalsContact C-N 3.27Å; Q536-F538 PolarHBondContact O-N 3.09Å; Q536-Y540 VanDerWaalsContact O-CD2 3.3Å; Q536-Y540 WeakPolarHBondContact O-CD2 3.29Å
537	S	31.1	Very low	41.8	Very low	64 Å²	64	78.9 Å²	78.9	45%	0.448	40%	0.399	S	S	.	.	H	α-helix	trans	-72.4	-20.4	177	34.9	0	0	0	0	113	G533 K534 L535	G533-S537 PolarHBondContact O-N 2.98Å; G533-S537 PolarHBondContact O-OG 2.88Å; K534-S537 PolarHBondContact O-N 3.33Å; K534-S537 PolarHBondContact O-OG 2.8Å; L535-S537 VanDerWaalsContact C-N 3.34Å; L535-S537 PolarHBondContact O-N 2.69Å
538	F	39.8	Very low	43.8	Very low	53 Å²	53	78.5 Å²	78.5	23%	0.232	40%	0.397	C	S	.	.	H	α-helix	trans	-84.5	-27.5	175.5	-68.3	-63.9	0	0	0	113.8	K534 L535 Q536 Y540 L541 P600	K534-F538 HydrophobicContact CB-CE2 4.34Å; K534-F538 WeakPolarHBondContact O-CD2 3.26Å; K534-F538 WeakPolarHBondContact O-CE2 3.37Å; K534-F538 PolarHBondContact O-N 3.35Å; L535-F538 PolarHBondContact O-N 2.9Å; Q536-F538 VanDerWaalsContact C-N 3.27Å; Q536-F538 PolarHBondContact O-N 3.09Å; F538-Y540 PolarHBondContact O-N 3.19Å; F538-L541 HydrophobicContact CD1-CD1 4.08Å; F538-L541 WeakPolarHBondContact O-CB 3.49Å; F538-L541 PolarHBondContact O-N 2.86Å; F538-L541 VanDerWaalsContact O-N 3.15Å; F538-P600 HydrophobicContact CD2-CB 4.34Å; F538-P600 HydrophobicContact CE2-CB 4.47Å
539	S	40	Very low	46.1	Very low	34 Å²	34	74.6 Å²	74.6	24%	0.238	38%	0.379	C	S	.	.	H	α-helix	trans	-57.4	-40.5	171.5	-62.6	0	0	0	0	111.5	L535 L541 W542 E543	L535-S539 PolarHBondContact O-N 3.45Å; S539-L541 PolarHBondContact O-N 3.29Å; S539-L541 VanDerWaalsContact O-N 3.12Å; S539-W542 PolarHBondContact O-N 3.11Å; S539-W542 VanDerWaalsContact O-N 3.16Å; S539-E543 WeakPolarHBondContact O-CG 3.23Å; S539-E543 PolarHBondContact O-N 2.96Å; S539-E543 VanDerWaalsContact O-N 3.09Å
540	Y	40	Very low	48.5	Very low	157 Å²	157	66.9 Å²	66.9	62%	0.616	34%	0.344	S	S	*	.	H	α-helix	trans	-57.6	-26.1	177	-81.8	-74.4	0	0	0	114.5	Q536 F538 W542 E543	Q536-Y540 VanDerWaalsContact O-CD2 3.3Å; Q536-Y540 WeakPolarHBondContact O-CD2 3.29Å; F538-Y540 PolarHBondContact O-N 3.19Å; Y540-W542 VanDerWaalsContact C-N 3.35Å; Y540-E543 WeakPolarHBondContact CD1-OE2 3.22Å; Y540-E543 WeakPolarHBondContact CE1-OE2 3.23Å
541	L	49.2	Very low	50.8	Low	30 Å²	30	63 Å²	63	16%	0.157	32%	0.323	C	S	.	.	H	α-helix	trans	-68.6	-34.7	179.9	-103.9	120.9	0	0	0	112.8	F538 S539 L579 L682	F538-L541 HydrophobicContact CD1-CD1 4.08Å; F538-L541 WeakPolarHBondContact O-CB 3.49Å; F538-L541 PolarHBondContact O-N 2.86Å; F538-L541 VanDerWaalsContact O-N 3.15Å; S539-L541 PolarHBondContact O-N 3.29Å; S539-L541 VanDerWaalsContact O-N 3.12Å; L541-L579 HydrophobicContact CB-CD2 4.48Å; L541-L579 HydrophobicContact CD2-CD2 3.47Å; L541-L579 VanDerWaalsContact CD2-CD2 3.47Å; L541-L579 HydrophobicContact CG-CD2 3.58Å; L541-L682 HydrophobicContact CD1-CD1 3.87Å; L541-L682 HydrophobicContact CD2-CD1 3.68Å; L541-L682 HydrophobicContact CG-CD1 4.32Å
542	W	60.1	Low	52.9	Low	45 Å²	45	58.7 Å²	58.7	17%	0.17	31%	0.305	C	S	.	.	H	α-helix	trans	-108.3	-6.2	-174.6	-61	99.6	0	0	0	113.2	S539 Y540 N544 Y545 H564 C591 P602 L605	S539-W542 PolarHBondContact O-N 3.11Å; S539-W542 VanDerWaalsContact O-N 3.16Å; Y540-W542 VanDerWaalsContact C-N 3.35Å; W542-N544 PolarHBondContact O-N 2.86Å; W542-Y545 PolarHBondContact O-N 3.04Å; W542-Y545 VanDerWaalsContact O-O 3.07Å; W542-H564 AromaticContact CE3-ND1 3.88Å; W542-H564 HydrophobicContact CZ3-CB 4.09Å; W542-H564 AromaticContact CZ3-CG 3.82Å; W542-H564 AromaticContact CZ3-ND1 4Å; W542-C591 WeakPolarHBondContact CH2-SG 3.43Å; W542-P602 HydrophobicContact CZ2-CG 4.38Å; W542-L605 HydrophobicContact CH2-CD1 4.37Å
543	E	54.4	Low	55.1	Low	81 Å²	81	55.1 Å²	55.1	38%	0.379	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.6	-27.5	178.5	-91.8	169.6	-155.5	0	0	114.4	S539 Y540	S539-E543 WeakPolarHBondContact O-CG 3.23Å; S539-E543 PolarHBondContact O-N 2.96Å; S539-E543 VanDerWaalsContact O-N 3.09Å; Y540-E543 WeakPolarHBondContact CD1-OE2 3.22Å; Y540-E543 WeakPolarHBondContact CE1-OE2 3.23Å
544	N	59.5	Low	57.1	Low	64 Å²	64	56.4 Å²	56.4	34%	0.342	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-99.2	5.4	-179.9	-62.6	-47.9	0	0	0	114.3	W542 P566 V567	W542-N544 PolarHBondContact O-N 2.86Å; N544-P566 CarbonylContact O-C 3.57Å; N544-P566 WeakPolarHBondContact O-CA 3.32Å; N544-V567 PolarHBondContact O-N 3.41Å
545	Y	65.8	Low	58.7	Low	36 Å²	36	55.3 Å²	55.3	14%	0.141	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	141.2	-179.8	-72.2	-94.2	0	0	0	110.7	W542 H564 R565 P566 F589	W542-Y545 PolarHBondContact O-N 3.04Å; W542-Y545 VanDerWaalsContact O-O 3.07Å; Y545-H564 HydrophobicContact CD1-CB 4.35Å; Y545-R565 CarbonylContact C-O 3.59Å; Y545-R565 VanDerWaalsContact CA-O 3.25Å; Y545-R565 WeakPolarHBondContact CA-O 3.39Å; Y545-R565 VanDerWaalsContact CD1-C 3.46Å; Y545-P566 HydrophobicContact CD1-CB 4.39Å; Y545-P566 HydrophobicContact CE1-CB 4.06Å; Y545-F589 HydrophobicContact CD1-CD2 4.36Å; Y545-F589 AromaticContact CE1-CD2 3.68Å; Y545-F589 HydrophobicContact CE1-CD2 3.68Å; Y545-F589 AromaticContact CE1-CE2 3.87Å; Y545-F589 HydrophobicContact CE1-CE2 3.87Å; Y545-F589 AromaticContact CZ-CE2 3.84Å; Y545-F589 WeakPolarHBondContact OH-CE2 3.4Å
546	E	67.6	Low	60.3	Low	63 Å²	63	55 Å²	55	29%	0.294	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	140.2	170.9	64.6	-173.7	155.5	0	0	110.5	H564 R565 V567	E546-H564 WeakPolarHBondContact O-CA 3.38Å; E546-R565 HydrophobicContact CG-CG 3.58Å; E546-R565 PolarHBondContact N-O 2.85Å; E546-R565 PolarHBondContact O-N 3.11Å; E546-R565 IonicContact OE1-CZ 3.68Å; E546-R565 IonicContact OE1-NE 3.53Å; E546-R565 PolarHBondContact OE1-NE 2.9Å; E546-R565 IonicContact OE1-NH2 2.94Å; E546-R565 PolarHBondContact OE1-NH2 2.8Å; E546-V567 HydrophobicContact CB-CG2 3.86Å; E546-V567 HydrophobicContact CG-CG2 4.1Å
547	C	73.2	Confident	62.1	Low	32 Å²	32	51.7 Å²	51.7	22%	0.216	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	122.4	173.3	-175.5	0	0	0	0	109.4	I563	C547-I563 CarbonylContact C-O 3.57Å; C547-I563 WeakPolarHBondContact CA-O 3.01Å
548	V	72.8	Confident	63.8	Low	67 Å²	67	51 Å²	51	41%	0.406	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-38.5	-172.9	-172.8	0	0	0	0	111.7	I563 R565	V548-I563 PolarHBondContact N-O 2.92Å; V548-R565 HydrophobicContact CG2-CB 3.85Å; V548-R565 VanDerWaalsContact CG2-CD 3.44Å; V548-R565 HydrophobicContact CG2-CG 3.38Å
549	A	76.8	Confident	65.4	Low	23 Å²	23	49.5 Å²	49.5	19%	0.19	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.5	155.5	-175.5	0	0	0	0	0	110.5	T562 I563	A549-T562 CarbonylContact O-C 3.46Å; A549-T562 WeakPolarHBondContact O-CA 3.45Å; A549-I563 HydrophobicContact CB-CB 4.44Å; A549-I563 HydrophobicContact CB-CD1 4.05Å; A549-I563 HydrophobicContact CB-CG1 4.3Å; A549-I563 PolarHBondContact O-N 3.45Å
550	C	80.8	Confident	67.3	Low	8 Å²	8	47.9 Å²	47.9	5%	0.054	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	156.8	169.1	89.7	0	0	0	0	110.8	L561 T562 C1041 F1073	C550-L561 CarbonylContact C-O 3.52Å; C550-L561 WeakPolarHBondContact CA-O 3.36Å; C550-L561 VanDerWaalsContact CB-O 3.29Å; C550-L561 WeakPolarHBondContact CB-O 3.45Å; C550-T562 HydrophobicContact CB-CG2 4.04Å; C550-C1041 HydrophobicContact CB-CB 3.97Å; C550-C1041 PolarHBondContact N-SG 3.3Å; C550-C1041 VanDerWaalsContact N-SG 3.38Å; C550-C1041 WeakPolarHBondContact SG-CB 3.4Å; C550-F1073 HydrophobicContact CB-CD2 4.16Å; C550-F1073 HydrophobicContact CB-CE2 4.29Å
551	D	79.4	Confident	69.5	Low	43 Å²	43	40.5 Å²	40.5	23%	0.23	22%	0.216	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	155.7	170.6	-160.7	21.6	0	0	0	110.7	I560 L561 I625	D551-I560 WeakPolarHBondContact O-CA 3.48Å; D551-L561 HydrophobicContact CB-CD1 3.99Å; D551-L561 HydrophobicContact CB-CD2 4.11Å; D551-L561 HydrophobicContact CB-CG 3.89Å; D551-L561 PolarHBondContact N-O 3.24Å; D551-L561 PolarHBondContact O-N 2.87Å; D551-I625 WeakPolarHBondContact OD2-CG2 3.33Å
552	C	76.6	Confident	71.1	Confident	15 Å²	15	39.1 Å²	39.1	10%	0.101	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	150.1	174.3	60.4	0	0	0	0	110.9	I560 S1043 K1044	C552-I560 HydrophobicContact CB-CG1 4.37Å; C552-S1043 VanDerWaalsContact CB-OG 3.24Å; C552-S1043 WeakPolarHBondContact CB-OG 3.4Å; C552-S1043 PolarHBondContact SG-OG 3.11Å; C552-K1044 PolarHBondContact SG-O 2.67Å
553	A	75.9	Confident	72.2	Confident	1 Å²	1	37.1 Å²	37.1	1%	0.008	20%	0.201	C	C	.	.			trans	-66	135.9	173.8	0	0	0	0	0	110.4	Q555 N556 Q557 L559 F626 A632	A553-Q555 VanDerWaalsContact C-N 3.34Å; A553-Q555 PolarHBondContact O-N 3.44Å; A553-N556 WeakPolarHBondContact CB-O 3.33Å; A553-Q557 WeakPolarHBondContact O-CG 3.19Å; A553-L559 HydrophobicContact CB-CB 3.89Å; A553-L559 HydrophobicContact CB-CD1 4.47Å; A553-L559 PolarHBondContact N-O 3.05Å; A553-F626 VanDerWaalsContact CA-CD2 3.46Å; A553-F626 HydrophobicContact CB-CB 4.12Å; A553-F626 HydrophobicContact CB-CD2 3.69Å; A553-F626 HydrophobicContact CB-CE2 4.15Å; A553-F626 HydrophobicContact CB-CG 3.9Å; A553-F626 VanDerWaalsContact N-CD2 3.3Å; A553-A632 HydrophobicContact CB-CB 3.83Å
554	P	69.8	Low	73.3	Confident	63 Å²	63	34 Å²	34	41%	0.409	19%	0.187	S	C	.	.	S	Bend	trans	-65.4	-35.3	-170.4	22.8	-32.7	0	0	0	113.3
555	Q	63.9	Low	74	Confident	106 Å²	106	35.4 Å²	35.4	50%	0.495	19%	0.187	S	C	.	.	S	Bend	trans	-98.8	-40.4	-177.8	-67.8	-178.1	-11.4	0	0	112.7	A553 P628 N630	A553-Q555 VanDerWaalsContact C-N 3.34Å; A553-Q555 PolarHBondContact O-N 3.44Å; Q555-P628 PolarHBondContact NE2-O 2.78Å; Q555-P628 PolarHBondContact OE1-O 2.79Å; Q555-N630 VanDerWaalsContact OE1-CG 3.26Å; Q555-N630 PolarHBondContact OE1-OD1 3.1Å
556	N	62.9	Low	74	Confident	60 Å²	60	36 Å²	36	32%	0.321	20%	0.196	S	C	.	.			trans	-111.6	76.9	179.5	-170.5	8.2	0	0	0	111.4	A553 T558 L559 N630	A553-N556 WeakPolarHBondContact CB-O 3.33Å; N556-T558 PolarHBondContact O-N 2.86Å; N556-T558 PolarHBondContact OD1-OG1 2.81Å; N556-L559 HydrophobicContact CB-CD1 4.16Å; N556-L559 HydrophobicContact CB-CG 4.4Å; N556-L559 WeakPolarHBondContact O-CB 3.45Å; N556-L559 PolarHBondContact O-N 3.26Å; N556-N630 WeakPolarHBondContact CB-O 3.18Å
557	Q	63.8	Low	73.9	Confident	40 Å²	40	36 Å²	36	19%	0.187	20%	0.2	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-3	-169.5	-65.4	158.3	-3	0	0	114.6	A553 L559 M1045 P1046	A553-Q557 WeakPolarHBondContact O-CG 3.19Å; Q557-L559 PolarHBondContact O-N 2.94Å; Q557-M1045 HydrophobicContact CB-CG 3.99Å; Q557-M1045 WeakPolarHBondContact O-CE 3.44Å; Q557-P1046 VanDerWaalsContact NE2-CD 3.31Å; Q557-P1046 PolarHBondContact OE1-O 3.04Å; Q557-P1046 VanDerWaalsContact OE1-O 3.12Å
558	T	66.7	Low	73	Confident	51 Å²	51	44 Å²	44	31%	0.313	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-18.3	166.7	65.4	0	0	0	0	112	N556 E595	N556-T558 PolarHBondContact O-N 2.86Å; N556-T558 PolarHBondContact OD1-OG1 2.81Å; T558-E595 PolarHBondContact O-N 3.42Å; T558-E595 VanDerWaalsContact O-N 3.09Å
559	L	74.5	Confident	71.6	Confident	21 Å²	21	44.4 Å²	44.4	11%	0.11	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	123.1	173.3	-60.8	178.4	0	0	0	110.8	A553 N556 Q557 W593 T594 F626 A632	A553-L559 HydrophobicContact CB-CB 3.89Å; A553-L559 HydrophobicContact CB-CD1 4.47Å; A553-L559 PolarHBondContact N-O 3.05Å; N556-L559 HydrophobicContact CB-CD1 4.16Å; N556-L559 HydrophobicContact CB-CG 4.4Å; N556-L559 WeakPolarHBondContact O-CB 3.45Å; N556-L559 PolarHBondContact O-N 3.26Å; Q557-L559 PolarHBondContact O-N 2.94Å; L559-W593 CarbonylContact C-O 3.59Å; L559-W593 VanDerWaalsContact CA-O 3.31Å; L559-W593 WeakPolarHBondContact CA-O 3.36Å; L559-T594 HydrophobicContact CD2-CG2 3.17Å; L559-F626 HydrophobicContact CB-CZ 4.49Å; L559-A632 HydrophobicContact CD1-CB 3.91Å
560	I	79.3	Confident	69.6	Low	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.5	179.5	-62.7	160.9	0	0	0	109.4	D551 C552 I592 W593 I596 M1045 I1071 F1073	D551-I560 WeakPolarHBondContact O-CA 3.48Å; C552-I560 HydrophobicContact CB-CG1 4.37Å; I560-I592 CarbonylContact O-C 3.43Å; I560-I592 WeakPolarHBondContact O-CA 3.36Å; I560-W593 PolarHBondContact N-O 3.01Å; I560-W593 PolarHBondContact O-N 2.92Å; I560-I596 HydrophobicContact CD1-CD1 3.15Å; I560-I596 HydrophobicContact CD1-CG1 3.99Å; I560-M1045 HydrophobicContact CD1-CE 4.49Å; I560-I1071 HydrophobicContact CD1-CD1 3.67Å; I560-F1073 HydrophobicContact CB-CZ 4.35Å; I560-F1073 HydrophobicContact CD1-CZ 4.2Å; I560-F1073 HydrophobicContact CG2-CE1 4.35Å; I560-F1073 HydrophobicContact CG2-CE2 3.85Å; I560-F1073 HydrophobicContact CG2-CZ 3.43Å; I560-F1073 VanDerWaalsContact CG2-CZ 3.43Å
561	L	86	Confident	67.6	Low	1 Å²	1	59.7 Å²	59.7	1%	0.005	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	145.1	169.6	70.3	87.3	0	0	0	110.5	C550 D551 I563 I590 C591 A624 F626	C550-L561 CarbonylContact C-O 3.52Å; C550-L561 WeakPolarHBondContact CA-O 3.36Å; C550-L561 VanDerWaalsContact CB-O 3.29Å; C550-L561 WeakPolarHBondContact CB-O 3.45Å; D551-L561 HydrophobicContact CB-CD1 3.99Å; D551-L561 HydrophobicContact CB-CD2 4.11Å; D551-L561 HydrophobicContact CB-CG 3.89Å; D551-L561 PolarHBondContact N-O 3.24Å; D551-L561 PolarHBondContact O-N 2.87Å; L561-I563 HydrophobicContact CD1-CG1 4.26Å; L561-I590 HydrophobicContact CB-CG2 3.98Å; L561-I590 HydrophobicContact CD1-CG2 4.36Å; L561-C591 CarbonylContact C-O 3.59Å; L561-C591 VanDerWaalsContact CA-O 3.24Å; L561-C591 WeakPolarHBondContact CA-O 3.44Å; L561-A624 HydrophobicContact CD1-CB 4.14Å; L561-A624 HydrophobicContact CD2-CB 4.49Å; L561-F626 HydrophobicContact CB-CE1 4.43Å; L561-F626 HydrophobicContact CB-CE2 3.71Å; L561-F626 HydrophobicContact CB-CZ 3.59Å; L561-F626 HydrophobicContact CD2-CD1 4.36Å; L561-F626 HydrophobicContact CD2-CD2 3.62Å; L561-F626 HydrophobicContact CD2-CE1 4.26Å; L561-F626 HydrophobicContact CD2-CE2 3.54Å; L561-F626 HydrophobicContact CD2-CG 4.08Å; L561-F626 HydrophobicContact CD2-CZ 3.89Å; L561-F626 HydrophobicContact CG-CD2 4.27Å; L561-F626 HydrophobicContact CG-CE2 3.76Å; L561-F626 HydrophobicContact CG-CZ 4.12Å
562	T	82.9	Confident	65.4	Low	1 Å²	1	66.6 Å²	66.6	1%	0.006	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	132.4	171.3	56.4	0	0	0	0	109.7	A549 C550 H564 I590 C591 W593 F1073	A549-T562 CarbonylContact O-C 3.46Å; A549-T562 WeakPolarHBondContact O-CA 3.45Å; C550-T562 HydrophobicContact CB-CG2 4.04Å; T562-H564 WeakPolarHBondContact CB-NE2 3.49Å; T562-H564 PolarHBondContact O-CD2 3.28Å; T562-H564 PolarHBondContact OG1-CD2 3.43Å; T562-H564 PolarHBondContact OG1-NE2 3.33Å; T562-I590 WeakPolarHBondContact O-CA 3.47Å; T562-C591 PolarHBondContact N-O 2.81Å; T562-C591 PolarHBondContact O-N 3.02Å; T562-C591 WeakPolarHBondContact OG1-CB 3.41Å; T562-W593 PolarHBondContact OG1-NE1 2.95Å; T562-F1073 HydrophobicContact CG2-CD1 3.65Å; T562-F1073 HydrophobicContact CG2-CE1 3.61Å; T562-F1073 HydrophobicContact CG2-CG 4.17Å; T562-F1073 HydrophobicContact CG2-CZ 4.1Å
563	I	83	Confident	63.3	Low	3 Å²	3	72.5 Å²	72.5	2%	0.015	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	127.1	176.7	-51.2	-176.3	0	0	0	108.8	C547 V548 A549 L561 F589 I590 L621 A624	C547-I563 CarbonylContact C-O 3.57Å; C547-I563 WeakPolarHBondContact CA-O 3.01Å; V548-I563 PolarHBondContact N-O 2.92Å; A549-I563 HydrophobicContact CB-CB 4.44Å; A549-I563 HydrophobicContact CB-CD1 4.05Å; A549-I563 HydrophobicContact CB-CG1 4.3Å; A549-I563 PolarHBondContact O-N 3.45Å; L561-I563 HydrophobicContact CD1-CG1 4.26Å; I563-F589 CarbonylContact C-O 3.56Å; I563-F589 WeakPolarHBondContact CA-O 3.48Å; I563-I590 HydrophobicContact CG1-CG1 4.43Å; I563-L621 HydrophobicContact CG2-CB 4.28Å; I563-L621 HydrophobicContact CG2-CD1 4.06Å; I563-A624 HydrophobicContact CD1-CB 3.68Å; I563-A624 HydrophobicContact CG1-CB 4.33Å
564	H	79	Confident	61.1	Low	16 Å²	16	80.9 Å²	80.9	7%	0.074	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	130.3	-178.5	-68.3	-96.3	0	0	0	110.5	W542 Y545 E546 T562 E588 F589 C591	W542-H564 AromaticContact CE3-ND1 3.88Å; W542-H564 HydrophobicContact CZ3-CB 4.09Å; W542-H564 AromaticContact CZ3-CG 3.82Å; W542-H564 AromaticContact CZ3-ND1 4Å; Y545-H564 HydrophobicContact CD1-CB 4.35Å; E546-H564 WeakPolarHBondContact O-CA 3.38Å; T562-H564 WeakPolarHBondContact CB-NE2 3.49Å; T562-H564 PolarHBondContact O-CD2 3.28Å; T562-H564 PolarHBondContact OG1-CD2 3.43Å; T562-H564 PolarHBondContact OG1-NE2 3.33Å; H564-E588 WeakPolarHBondContact O-CA 3.38Å; H564-F589 HydrophobicContact CB-CB 4.45Å; H564-F589 PolarHBondContact N-O 2.91Å; H564-F589 PolarHBondContact O-N 3.11Å; H564-C591 VanDerWaalsContact CD2-SG 3.51Å
565	R	72.9	Confident	59.4	Low	93 Å²	93	86.8 Å²	86.8	35%	0.351	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	149.9	177.8	77.9	176.2	-160.5	179.7	2	111.1	Y545 E546 V548 V567 E588	Y545-R565 CarbonylContact C-O 3.59Å; Y545-R565 VanDerWaalsContact CA-O 3.25Å; Y545-R565 WeakPolarHBondContact CA-O 3.39Å; Y545-R565 VanDerWaalsContact CD1-C 3.46Å; E546-R565 HydrophobicContact CG-CG 3.58Å; E546-R565 PolarHBondContact N-O 2.85Å; E546-R565 PolarHBondContact O-N 3.11Å; E546-R565 IonicContact OE1-CZ 3.68Å; E546-R565 IonicContact OE1-NE 3.53Å; E546-R565 PolarHBondContact OE1-NE 2.9Å; E546-R565 IonicContact OE1-NH2 2.94Å; E546-R565 PolarHBondContact OE1-NH2 2.8Å; V548-R565 HydrophobicContact CG2-CB 3.85Å; V548-R565 VanDerWaalsContact CG2-CD 3.44Å; V548-R565 HydrophobicContact CG2-CG 3.38Å; R565-V567 PolarHBondContact O-N 3.17Å; R565-E588 HydrophobicContact CB-CG 3.81Å; R565-E588 WeakPolarHBondContact CB-OE1 3.4Å
566	P	66.4	Low	58	Low	50 Å²	50	86.3 Å²	86.3	33%	0.325	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	132.6	178.7	26.6	-33.1	0	0	0	111	N544 Y545 G587	N544-P566 CarbonylContact O-C 3.57Å; N544-P566 WeakPolarHBondContact O-CA 3.32Å; Y545-P566 HydrophobicContact CD1-CB 4.39Å; Y545-P566 HydrophobicContact CE1-CB 4.06Å; P566-G587 WeakPolarHBondContact CD-O 3.5Å
567	V	65.7	Low	56.8	Low	62 Å²	62	91.7 Å²	91.7	38%	0.376	44%	0.435	S	S	.	.			trans	-70.7	128.6	173.4	-178.1	0	0	0	0	108.3	N544 E546 R565 L569	N544-V567 PolarHBondContact O-N 3.41Å; E546-V567 HydrophobicContact CB-CG2 3.86Å; E546-V567 HydrophobicContact CG-CG2 4.1Å; R565-V567 PolarHBondContact O-N 3.17Å; V567-L569 PolarHBondContact O-N 3.44Å
568	R	54.9	Low	55.6	Low	201 Å²	201	90.6 Å²	90.6	76%	0.758	43%	0.432	S	S	*	.			trans	-67	99.8	177.6	-71.4	-176.5	179	152.1	-0.5	109.7	K617	R568-K617 PolarHBondContact NH2-O 2.54Å
569	L	41.9	Very low	54.4	Low	75 Å²	75	91 Å²	91	39%	0.393	43%	0.431	S	S	.	.			trans	-71.6	137.4	168	-75.8	160.4	0	0	0	109.7	V567 I576	V567-L569 PolarHBondContact O-N 3.44Å; L569-I576 HydrophobicContact CB-CD1 4.49Å; L569-I576 HydrophobicContact CD1-CD1 3.41Å; L569-I576 VanDerWaalsContact CD1-CD1 3.41Å
570	N	34.5	Very low	52.9	Low	145 Å²	145	91.4 Å²	91.4	78%	0.775	43%	0.432	S	S	*	.			trans	-55	146	-178.9	-73.3	-32.1	0	0	0	111.1	E572 Q573	N570-E572 PolarHBondContact O-N 3.42Å; N570-Q573 PolarHBondContact O-N 2.94Å
571	Q	39.1	Very low	50.9	Low	206 Å²	206	97 Å²	97	96%	0.963	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.4	8.5	-167.4	-73.4	175.6	-25	0	0	117.7
572	E	34.7	Very low	48.6	Very low	189 Å²	189	98.6 Å²	98.6	88%	0.883	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.9	-6.7	-174.8	-64.2	-172.2	164.4	0	0	114.5	N570	N570-E572 PolarHBondContact O-N 3.42Å
573	Q	31.8	Very low	46.3	Very low	139 Å²	139	104.5 Å²	104.5	65%	0.65	51%	0.51	S	S	*	.	S	Bend	trans	-101.3	105	172	-77.6	179.9	-18.7	0	0	110.8	N570	N570-Q573 PolarHBondContact O-N 2.94Å
574	E	29.8	Very low	44.3	Very low	176 Å²	176	109.8 Å²	109.8	82%	0.822	53%	0.529	S	S	*	.			trans	25	134.6	141.9	-66.7	179.8	153.2	0	0	118.4	I576	E574-I576 VanDerWaalsContact C-N 3.33Å; E574-I576 PolarHBondContact O-N 3.09Å
575	E	33.3	Very low	42.7	Very low	188 Å²	188	114.3 Å²	114.3	88%	0.879	56%	0.563	S	S	*	*			trans	-20.5	88.1	156.1	-64.5	178	158.1	0	0	113.2	K577	E575-K577 PolarHBondContact O-N 2.93Å
576	I	35.1	Very low	41.8	Very low	96 Å²	96	111.9 Å²	111.9	49%	0.492	56%	0.563	S	S	.	*			trans	-69.5	96	167.9	-56.8	173.9	0	0	0	103.6	L569 E574 S578	L569-I576 HydrophobicContact CB-CD1 4.49Å; L569-I576 HydrophobicContact CD1-CD1 3.41Å; L569-I576 VanDerWaalsContact CD1-CD1 3.41Å; E574-I576 VanDerWaalsContact C-N 3.33Å; E574-I576 PolarHBondContact O-N 3.09Å; I576-S578 VanDerWaalsContact C-N 3.25Å; I576-S578 PolarHBondContact O-N 3.13Å
577	K	36.9	Very low	41.7	Very low	172 Å²	172	109.7 Å²	109.7	75%	0.748	55%	0.55	S	S	*	.			trans	-49	104.7	158.3	-78.3	-179.7	178.7	175.1	0	104.3	E575 L579	E575-K577 PolarHBondContact O-N 2.93Å; K577-L579 PolarHBondContact O-N 3.36Å
578	S	39.2	Very low	42.2	Very low	18 Å²	18	107 Å²	107	13%	0.126	53%	0.533	C	S	.	.			trans	-49.9	133.2	175.3	65.5	0	0	0	0	106.3	I576 F580 N581 Y582	I576-S578 VanDerWaalsContact C-N 3.25Å; I576-S578 PolarHBondContact O-N 3.13Å; S578-F580 PolarHBondContact O-N 3.48Å; S578-N581 PolarHBondContact O-N 3.2Å; S578-Y582 VanDerWaalsContact OG-CA 3.3Å; S578-Y582 WeakPolarHBondContact OG-CA 3.33Å; S578-Y582 WeakPolarHBondContact OG-CB 2.86Å; S578-Y582 PolarHBondContact OG-N 3.24Å; S578-Y582 PolarHBondContact OG-O 3Å
579	L	41.5	Very low	43.4	Very low	58 Å²	58	97.5 Å²	97.5	30%	0.304	50%	0.497	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	-19.5	-173.6	-141.7	85.8	0	0	0	112.3	L541 K577 T676	L541-L579 HydrophobicContact CB-CD2 4.48Å; L541-L579 HydrophobicContact CD2-CD2 3.47Å; L541-L579 VanDerWaalsContact CD2-CD2 3.47Å; L541-L579 HydrophobicContact CG-CD2 3.58Å; K577-L579 PolarHBondContact O-N 3.36Å; L579-T676 WeakPolarHBondContact O-CG2 3.49Å
580	F	42.8	Very low	45.4	Very low	30 Å²	30	94 Å²	94	13%	0.132	48%	0.478	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.1	14.3	-179.5	-65	-69.9	0	0	0	115.3	S578 Y582 F589 L605 V674 T676	S578-F580 PolarHBondContact O-N 3.48Å; F580-Y582 HydrophobicContact CB-CD2 3.46Å; F580-Y582 VanDerWaalsContact CB-CD2 3.46Å; F580-Y582 HydrophobicContact CB-CE2 3.65Å; F580-Y582 HydrophobicContact CG-CD2 4.47Å; F580-Y582 HydrophobicContact CG-CE2 4.37Å; F580-Y582 PolarHBondContact O-N 3.29Å; F580-F589 HydrophobicContact CD2-CE1 4.17Å; F580-F589 HydrophobicContact CD2-CE2 4.03Å; F580-F589 AromaticContact CD2-CZ 3.41Å; F580-F589 HydrophobicContact CD2-CZ 3.41Å; F580-F589 VanDerWaalsContact CD2-CZ 3.41Å; F580-F589 AromaticContact CE2-CE1 3.99Å; F580-F589 HydrophobicContact CE2-CE1 3.99Å; F580-F589 AromaticContact CE2-CE2 3.9Å; F580-F589 HydrophobicContact CE2-CE2 3.9Å; F580-F589 AromaticContact CE2-CZ 3.48Å; F580-F589 HydrophobicContact CE2-CZ 3.48Å; F580-F589 VanDerWaalsContact CE2-CZ 3.48Å; F580-F589 HydrophobicContact CG-CZ 4.25Å; F580-F589 HydrophobicContact CZ-CE1 4.45Å; F580-F589 HydrophobicContact CZ-CZ 4.35Å; F580-L605 HydrophobicContact CE1-CD2 4.25Å; F580-L605 HydrophobicContact CZ-CD2 3.99Å; F580-V674 VanDerWaalsContact C-CG1 3.43Å; F580-V674 HydrophobicContact CB-CB 4.5Å; F580-V674 HydrophobicContact CB-CG1 3.66Å; F580-V674 HydrophobicContact CB-CG2 4.34Å; F580-V674 HydrophobicContact CD1-CB 4.26Å; F580-V674 HydrophobicContact CD1-CG1 3.72Å; F580-V674 HydrophobicContact CG-CG1 4.19Å; F580-V674 WeakPolarHBondContact O-CG1 3.44Å; F580-T676 HydrophobicContact CD1-CG2 4.16Å; F580-T676 HydrophobicContact CE1-CG2 4.4Å
581	N	37	Very low	47.8	Very low	117 Å²	117	87 Å²	87	63%	0.626	44%	0.441	S	S	*	.			trans	52.2	21.9	-176.7	-93.7	-15.6	0	0	0	114.3	S578 S583	S578-N581 PolarHBondContact O-N 3.2Å; N581-S583 PolarHBondContact O-N 3.19Å
582	Y	38.3	Very low	49.9	Very low	35 Å²	35	77.3 Å²	77.3	14%	0.137	40%	0.396	C	S	.	.			trans	-69.4	122.2	168.8	-75.1	-69.3	0	0	0	109.1	S578 F580 R584 Y607 V674	S578-Y582 VanDerWaalsContact OG-CA 3.3Å; S578-Y582 WeakPolarHBondContact OG-CA 3.33Å; S578-Y582 WeakPolarHBondContact OG-CB 2.86Å; S578-Y582 PolarHBondContact OG-N 3.24Å; S578-Y582 PolarHBondContact OG-O 3Å; F580-Y582 HydrophobicContact CB-CD2 3.46Å; F580-Y582 VanDerWaalsContact CB-CD2 3.46Å; F580-Y582 HydrophobicContact CB-CE2 3.65Å; F580-Y582 HydrophobicContact CG-CD2 4.47Å; F580-Y582 HydrophobicContact CG-CE2 4.37Å; F580-Y582 PolarHBondContact O-N 3.29Å; Y582-R584 PolarHBondContact O-N 3.49Å; Y582-R584 VanDerWaalsContact O-N 3.13Å; Y582-Y607 HydrophobicContact CD1-CE1 4.37Å; Y582-Y607 HydrophobicContact CD2-CE1 4.49Å; Y582-Y607 HydrophobicContact CE1-CD1 4.42Å; Y582-Y607 HydrophobicContact CE1-CE1 4.05Å; Y582-Y607 HydrophobicContact CE2-CD1 4.36Å; Y582-Y607 HydrophobicContact CE2-CE1 4.19Å; Y582-Y607 AromaticContact CZ-CE1 3.97Å; Y582-V674 HydrophobicContact CE2-CG2 4.03Å
583	S	34.9	Very low	52	Low	125 Å²	125	69.8 Å²	69.8	87%	0.874	36%	0.359	S	S	*	.	S	Bend	trans	-66.9	-0.1	167	51.5	0	0	0	0	113.4	N581	N581-S583 PolarHBondContact O-N 3.19Å
584	R	41.2	Very low	53.8	Low	114 Å²	114	64.3 Å²	64.3	43%	0.43	34%	0.336	S	S	.	.			trans	-116.5	104.7	178	-70.6	-170.6	-177	-158.7	3.3	110.7	Y582 A586	Y582-R584 PolarHBondContact O-N 3.49Å; Y582-R584 VanDerWaalsContact O-N 3.13Å; R584-A586 PolarHBondContact O-N 2.98Å
585	S	44.3	Very low	55.3	Low	112 Å²	112	59.8 Å²	59.8	78%	0.783	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.1	32	-174	39.9	0	0	0	0	115.5
586	A	54.7	Low	56.2	Low	41 Å²	41	53.1 Å²	53.1	34%	0.339	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-148.1	17.2	-165.1	0	0	0	0	0	117.5	R584 G610	R584-A586 PolarHBondContact O-N 2.98Å; A586-G610 WeakPolarHBondContact O-CA 3.45Å
587	G	64.2	Low	56.7	Low	5 Å²	5	50.7 Å²	50.7	5%	0.052	28%	0.283	C	S	.	.			trans	-96	166.4	179.6	0	0	0	0	0	114.7	P566 Y607 C608	P566-G587 WeakPolarHBondContact CD-O 3.5Å; G587-Y607 WeakPolarHBondContact CA-OH 3.46Å; G587-C608 VanDerWaalsContact CA-O 3.28Å; G587-C608 WeakPolarHBondContact CA-O 3.38Å
588	E	76.7	Confident	57.1	Low	4 Å²	4	49.2 Å²	49.2	2%	0.019	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	152	177.4	-68.4	173.8	140.5	0	0	110.5	H564 R565 Y607 C608 A619 N620 L621	H564-E588 WeakPolarHBondContact O-CA 3.38Å; R565-E588 HydrophobicContact CB-CG 3.81Å; R565-E588 WeakPolarHBondContact CB-OE1 3.4Å; E588-Y607 WeakPolarHBondContact O-CD2 3.12Å; E588-C608 PolarHBondContact N-O 2.86Å; E588-C608 VanDerWaalsContact N-O 3.11Å; E588-C608 PolarHBondContact O-N 2.76Å; E588-A619 WeakPolarHBondContact OE1-CA 3.41Å; E588-A619 WeakPolarHBondContact OE1-CB 3.33Å; E588-N620 WeakPolarHBondContact OE2-CA 3.33Å; E588-N620 WeakPolarHBondContact OE2-CB 3.24Å; E588-N620 PolarHBondContact OE2-N 3.11Å; E588-L621 HydrophobicContact CB-CD1 3.92Å; E588-L621 HydrophobicContact CB-CG 4.48Å; E588-L621 VanDerWaalsContact OE2-CB 3.29Å; E588-L621 WeakPolarHBondContact OE2-CB 3.42Å; E588-L621 WeakPolarHBondContact OE2-CG 3.41Å; E588-L621 PolarHBondContact OE2-N 2.92Å
589	F	79.5	Confident	57.8	Low	3 Å²	3	52.3 Å²	52.3	1%	0.013	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	142.4	-179.8	-69.9	-82.5	0	0	0	111.3	Y545 I563 H564 F580 L605 L606 Y607 V686	Y545-F589 HydrophobicContact CD1-CD2 4.36Å; Y545-F589 AromaticContact CE1-CD2 3.68Å; Y545-F589 HydrophobicContact CE1-CD2 3.68Å; Y545-F589 AromaticContact CE1-CE2 3.87Å; Y545-F589 HydrophobicContact CE1-CE2 3.87Å; Y545-F589 AromaticContact CZ-CE2 3.84Å; Y545-F589 WeakPolarHBondContact OH-CE2 3.4Å; I563-F589 CarbonylContact C-O 3.56Å; I563-F589 WeakPolarHBondContact CA-O 3.48Å; H564-F589 HydrophobicContact CB-CB 4.45Å; H564-F589 PolarHBondContact N-O 2.91Å; H564-F589 PolarHBondContact O-N 3.11Å; F580-F589 HydrophobicContact CD2-CE1 4.17Å; F580-F589 HydrophobicContact CD2-CE2 4.03Å; F580-F589 AromaticContact CD2-CZ 3.41Å; F580-F589 HydrophobicContact CD2-CZ 3.41Å; F580-F589 VanDerWaalsContact CD2-CZ 3.41Å; F580-F589 AromaticContact CE2-CE1 3.99Å; F580-F589 HydrophobicContact CE2-CE1 3.99Å; F580-F589 AromaticContact CE2-CE2 3.9Å; F580-F589 HydrophobicContact CE2-CE2 3.9Å; F580-F589 AromaticContact CE2-CZ 3.48Å; F580-F589 HydrophobicContact CE2-CZ 3.48Å; F580-F589 VanDerWaalsContact CE2-CZ 3.48Å; F580-F589 HydrophobicContact CG-CZ 4.25Å; F580-F589 HydrophobicContact CZ-CE1 4.45Å; F580-F589 HydrophobicContact CZ-CZ 4.35Å; F589-L605 HydrophobicContact CB-CD1 4.1Å; F589-L605 HydrophobicContact CD1-CD1 3.86Å; F589-L605 HydrophobicContact CD1-CD2 3.87Å; F589-L605 HydrophobicContact CD1-CG 3.82Å; F589-L605 HydrophobicContact CE1-CD2 4.01Å; F589-L605 HydrophobicContact CE1-CG 4.39Å; F589-L605 HydrophobicContact CG-CD1 4.3Å; F589-L606 CarbonylContact C-O 3.53Å; F589-L606 WeakPolarHBondContact CA-O 3.43Å; F589-Y607 AromaticContact CD1-CD2 3.72Å; F589-Y607 HydrophobicContact CD1-CD2 3.72Å; F589-Y607 HydrophobicContact CD1-CG 4.38Å; F589-Y607 HydrophobicContact CD2-CD2 4.31Å; F589-Y607 AromaticContact CE1-CD2 3.36Å; F589-Y607 HydrophobicContact CE1-CD2 3.36Å; F589-Y607 HydrophobicContact CE1-CE2 4.11Å; F589-Y607 AromaticContact CE1-CG 3.98Å; F589-Y607 HydrophobicContact CE1-CG 3.98Å; F589-Y607 AromaticContact CE2-CD2 3.97Å; F589-Y607 HydrophobicContact CE2-CD2 3.97Å; F589-Y607 HydrophobicContact CE2-CE2 4.01Å; F589-Y607 HydrophobicContact CG-CD2 4.19Å; F589-Y607 AromaticContact CZ-CD2 3.48Å; F589-Y607 HydrophobicContact CZ-CD2 3.48Å; F589-Y607 VanDerWaalsContact CZ-CD2 3.48Å; F589-Y607 AromaticContact CZ-CE2 3.73Å; F589-Y607 HydrophobicContact CZ-CE2 3.73Å; F589-Y607 HydrophobicContact CZ-CG 4.41Å; F589-V686 HydrophobicContact CE1-CG1 4.5Å
590	I	84.6	Confident	58.4	Low	0 Å²	0	53 Å²	53	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	116.8	165	-52.3	172.2	0	0	0	106.6	L561 T562 I563 L606 L621 A624 V635 W647	L561-I590 HydrophobicContact CB-CG2 3.98Å; L561-I590 HydrophobicContact CD1-CG2 4.36Å; T562-I590 WeakPolarHBondContact O-CA 3.47Å; I563-I590 HydrophobicContact CG1-CG1 4.43Å; I590-L606 HydrophobicContact CB-CB 4.03Å; I590-L606 HydrophobicContact CB-CD1 4.11Å; I590-L606 HydrophobicContact CB-CG 4.28Å; I590-L606 HydrophobicContact CD1-CD1 4.41Å; I590-L606 HydrophobicContact CG2-CD1 4.18Å; I590-L606 PolarHBondContact N-O 2.71Å; I590-L606 PolarHBondContact O-N 3.19Å; I590-L621 HydrophobicContact CD1-CD1 3.98Å; I590-L621 HydrophobicContact CG1-CD1 3.83Å; I590-A624 HydrophobicContact CD1-CB 4.2Å; I590-V635 HydrophobicContact CD1-CG1 3.97Å; I590-W647 HydrophobicContact CD1-CE3 4.32Å; I590-W647 HydrophobicContact CD1-CH2 3.75Å; I590-W647 HydrophobicContact CD1-CZ2 4.16Å; I590-W647 HydrophobicContact CD1-CZ3 3.85Å
591	C	83.4	Confident	59.3	Low	0 Å²	0	53.9 Å²	53.9	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	133.2	177.3	-51.7	0	0	0	0	109	W542 L561 T562 H564 W593 P602 L605	W542-C591 WeakPolarHBondContact CH2-SG 3.43Å; L561-C591 CarbonylContact C-O 3.59Å; L561-C591 VanDerWaalsContact CA-O 3.24Å; L561-C591 WeakPolarHBondContact CA-O 3.44Å; T562-C591 PolarHBondContact N-O 2.81Å; T562-C591 PolarHBondContact O-N 3.02Å; T562-C591 WeakPolarHBondContact OG1-CB 3.41Å; H564-C591 VanDerWaalsContact CD2-SG 3.51Å; C591-W593 HydrophobicContact CB-CZ2 3.94Å; C591-P602 HydrophobicContact CB-CB 3.89Å; C591-P602 HydrophobicContact CB-CG 4.28Å; C591-L605 HydrophobicContact CB-CD1 4.44Å; C591-L605 VanDerWaalsContact SG-CD1 3.51Å
592	I	83.6	Confident	61	Low	2 Å²	2	48.5 Å²	48.5	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.2	130.4	176.2	-56	176.6	0	0	0	108.6	I560 D603 R604 L606 F626 V635	I560-I592 CarbonylContact O-C 3.43Å; I560-I592 WeakPolarHBondContact O-CA 3.36Å; I592-D603 PolarHBondContact O-N 3.08Å; I592-R604 HydrophobicContact CB-CB 4.04Å; I592-R604 HydrophobicContact CD1-CB 4.17Å; I592-R604 HydrophobicContact CG1-CB 4.42Å; I592-R604 PolarHBondContact N-O 2.84Å; I592-R604 PolarHBondContact O-N 3.26Å; I592-L606 HydrophobicContact CD1-CD1 4.12Å; I592-L606 HydrophobicContact CD1-CD2 4.37Å; I592-L606 HydrophobicContact CD1-CG 4.28Å; I592-F626 HydrophobicContact CD1-CE1 4.24Å; I592-F626 HydrophobicContact CG1-CE1 4.45Å; I592-F626 HydrophobicContact CG2-CE1 4.43Å; I592-F626 HydrophobicContact CG2-CZ 4.24Å; I592-V635 HydrophobicContact CD1-CG2 4.2Å
593	W	79.4	Confident	62.6	Low	30 Å²	30	48.9 Å²	48.9	11%	0.114	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	131.7	-176.7	-50.3	89.9	0	0	0	109.3	L559 I560 T562 C591 P602	L559-W593 CarbonylContact C-O 3.59Å; L559-W593 VanDerWaalsContact CA-O 3.31Å; L559-W593 WeakPolarHBondContact CA-O 3.36Å; I560-W593 PolarHBondContact N-O 3.01Å; I560-W593 PolarHBondContact O-N 2.92Å; T562-W593 PolarHBondContact OG1-NE1 2.95Å; C591-W593 HydrophobicContact CB-CZ2 3.94Å; W593-P602 HydrophobicContact CD2-CB 4.11Å; W593-P602 HydrophobicContact CE3-CB 4.05Å; W593-P602 HydrophobicContact CH2-CB 3.9Å; W593-P602 HydrophobicContact CH2-CG 4.24Å; W593-P602 HydrophobicContact CZ2-CB 3.95Å; W593-P602 HydrophobicContact CZ2-CG 4.45Å; W593-P602 HydrophobicContact CZ3-CB 3.95Å
594	T	69.9	Low	64.6	Low	24 Å²	24	45.8 Å²	45.8	15%	0.147	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	118.5	172.3	69.3	0	0	0	0	107.5	L559 K599 D603	L559-T594 HydrophobicContact CD2-CG2 3.17Å; T594-K599 PolarHBondContact OG1-NZ 3.46Å; T594-D603 WeakPolarHBondContact CA-OD2 3.43Å; T594-D603 VanDerWaalsContact CB-OD2 3.25Å; T594-D603 WeakPolarHBondContact CB-OD2 3.35Å; T594-D603 HydrophobicContact CG2-CB 4.09Å; T594-D603 WeakPolarHBondContact CG2-OD2 3.22Å; T594-D603 PolarHBondContact N-OD2 2.89Å; T594-D603 PolarHBondContact OG1-OD1 3.21Å; T594-D603 PolarHBondContact OG1-OD2 2.88Å
595	E	60.9	Low	66.5	Low	82 Å²	82	40.7 Å²	40.7	38%	0.383	24%	0.239	S	C	.	.	S	Bend	trans	61.2	111.9	177.2	-145.7	174.5	-161.4	0	0	114.6	T558 G597	T558-E595 PolarHBondContact O-N 3.42Å; T558-E595 VanDerWaalsContact O-N 3.09Å; E595-G597 PolarHBondContact O-N 2.86Å; E595-G597 VanDerWaalsContact O-N 3.12Å
596	I	51.7	Low	68.3	Low	47 Å²	47	35.3 Å²	35.3	24%	0.241	20%	0.202	C	C	.	.	S	Bend	trans	-84.4	98.5	-174.8	-64.5	160.8	0	0	0	109.8	I560 I1071 F1073 I1078 T1080	I560-I596 HydrophobicContact CD1-CD1 3.15Å; I560-I596 HydrophobicContact CD1-CG1 3.99Å; I596-I1071 HydrophobicContact CD1-CB 4.21Å; I596-I1071 HydrophobicContact CD1-CD1 3.19Å; I596-I1071 HydrophobicContact CD1-CG1 3.64Å; I596-I1071 HydrophobicContact CD1-CG2 3.61Å; I596-F1073 HydrophobicContact CD1-CZ 4.42Å; I596-I1078 HydrophobicContact CG2-CB 4.43Å; I596-I1078 HydrophobicContact CG2-CG2 3.48Å; I596-I1078 VanDerWaalsContact CG2-CG2 3.48Å; I596-T1080 HydrophobicContact CB-CG2 4.3Å; I596-T1080 HydrophobicContact CG2-CG2 3.62Å
597	G	45.4	Very low	69.4	Low	46 Å²	46	33.7 Å²	33.7	47%	0.474	19%	0.187	S	C	.	.	S	Bend	trans	172.2	126.4	172.1	0	0	0	0	0	110.8	E595 K599	E595-G597 PolarHBondContact O-N 2.86Å; E595-G597 VanDerWaalsContact O-N 3.12Å; G597-K599 VanDerWaalsContact C-N 3.26Å; G597-K599 PolarHBondContact O-N 3.15Å
598	V	45.8	Very low	70	Confident	140 Å²	140	33.5 Å²	33.5	85%	0.848	19%	0.185	S	C	*	.	S	Bend	trans	68.5	-5.3	165.8	-155	0	0	0	0	117.7
599	K	55	Low	69.5	Low	83 Å²	83	35.1 Å²	35.1	36%	0.361	20%	0.196	S	C	.	.			trans	-86.3	125.8	175.1	-71.2	-177.4	-178	173	0	112.9	T594 G597 D603	T594-K599 PolarHBondContact OG1-NZ 3.46Å; G597-K599 VanDerWaalsContact C-N 3.26Å; G597-K599 PolarHBondContact O-N 3.15Å; K599-D603 IonicContact NZ-OD1 2.76Å; K599-D603 PolarHBondContact NZ-OD1 3.19Å; K599-D603 IonicContact NZ-OD2 3.73Å
600	P	54.1	Low	68.5	Low	73 Å²	73	35.4 Å²	35.4	47%	0.474	20%	0.199	S	C	.	.	S	Bend	trans	-81.2	-13.5	178.4	31.5	-34.9	0	0	0	114.1	F538	F538-P600 HydrophobicContact CD2-CB 4.34Å; F538-P600 HydrophobicContact CE2-CB 4.47Å
601	L	61.7	Low	66.9	Low	49 Å²	49	37.5 Å²	37.5	26%	0.257	21%	0.21	S	C	.	.	S	Bend	trans	-130.3	149.4	-175.3	-67.5	172.1	0	0	0	111	L682	L601-L682 HydrophobicContact CD1-CD2 3.8Å; L601-L682 HydrophobicContact CD2-CD2 3.58Å; L601-L682 HydrophobicContact CG-CD2 4.37Å
602	P	72.2	Confident	65	Low	4 Å²	4	39.9 Å²	39.9	3%	0.026	23%	0.227	C	C	.	.			trans	-66.3	145.5	171.6	27.9	-32.2	0	0	0	110.2	W542 C591 W593 R604 L684	W542-P602 HydrophobicContact CZ2-CG 4.38Å; C591-P602 HydrophobicContact CB-CB 3.89Å; C591-P602 HydrophobicContact CB-CG 4.28Å; W593-P602 HydrophobicContact CD2-CB 4.11Å; W593-P602 HydrophobicContact CE3-CB 4.05Å; W593-P602 HydrophobicContact CH2-CB 3.9Å; W593-P602 HydrophobicContact CH2-CG 4.24Å; W593-P602 HydrophobicContact CZ2-CB 3.95Å; W593-P602 HydrophobicContact CZ2-CG 4.45Å; W593-P602 HydrophobicContact CZ3-CB 3.95Å; P602-R604 VanDerWaalsContact C-N 3.27Å; P602-R604 PolarHBondContact O-N 2.9Å; P602-L684 HydrophobicContact CG-CD2 3.88Å; P602-L684 WeakPolarHBondContact O-CD1 3.04Å; P602-L684 WeakPolarHBondContact O-CD2 3.32Å
603	D	72.1	Confident	62.7	Low	42 Å²	42	45.4 Å²	45.4	23%	0.225	25%	0.253	C	S	.	.	S	Bend	trans	-68.8	-31.6	178.9	-61	-75.4	0	0	0	111.4	I592 T594 K599	I592-D603 PolarHBondContact O-N 3.08Å; T594-D603 WeakPolarHBondContact CA-OD2 3.43Å; T594-D603 VanDerWaalsContact CB-OD2 3.25Å; T594-D603 WeakPolarHBondContact CB-OD2 3.35Å; T594-D603 HydrophobicContact CG2-CB 4.09Å; T594-D603 WeakPolarHBondContact CG2-OD2 3.22Å; T594-D603 PolarHBondContact N-OD2 2.89Å; T594-D603 PolarHBondContact OG1-OD1 3.21Å; T594-D603 PolarHBondContact OG1-OD2 2.88Å; K599-D603 IonicContact NZ-OD1 2.76Å; K599-D603 PolarHBondContact NZ-OD1 3.19Å; K599-D603 IonicContact NZ-OD2 3.73Å
604	R	77.1	Confident	60.5	Low	61 Å²	61	48.9 Å²	48.9	23%	0.23	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	145.8	175.6	-45.8	179.1	-179.1	-166.9	-6	111.6	I592 P602 Y652	I592-R604 HydrophobicContact CB-CB 4.04Å; I592-R604 HydrophobicContact CD1-CB 4.17Å; I592-R604 HydrophobicContact CG1-CB 4.42Å; I592-R604 PolarHBondContact N-O 2.84Å; I592-R604 PolarHBondContact O-N 3.26Å; P602-R604 VanDerWaalsContact C-N 3.27Å; P602-R604 PolarHBondContact O-N 2.9Å; R604-Y652 VanDerWaalsContact CA-OH 3.26Å; R604-Y652 WeakPolarHBondContact CA-OH 3.18Å; R604-Y652 HydrophobicContact CB-CD1 4.41Å; R604-Y652 HydrophobicContact CB-CE1 3.79Å; R604-Y652 HydrophobicContact CB-CE2 3.97Å; R604-Y652 HydrophobicContact CG-CD1 3.95Å; R604-Y652 HydrophobicContact CG-CE1 3.65Å; R604-Y652 HydrophobicContact CG-CG 4.46Å
605	L	79.1	Confident	58.7	Low	6 Å²	6	50.9 Å²	50.9	3%	0.031	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	123	177.9	-167.2	67.3	0	0	0	110.3	W542 F580 F589 C591 Y652 L684 V686 L687	W542-L605 HydrophobicContact CH2-CD1 4.37Å; F580-L605 HydrophobicContact CE1-CD2 4.25Å; F580-L605 HydrophobicContact CZ-CD2 3.99Å; F589-L605 HydrophobicContact CB-CD1 4.1Å; F589-L605 HydrophobicContact CD1-CD1 3.86Å; F589-L605 HydrophobicContact CD1-CD2 3.87Å; F589-L605 HydrophobicContact CD1-CG 3.82Å; F589-L605 HydrophobicContact CE1-CD2 4.01Å; F589-L605 HydrophobicContact CE1-CG 4.39Å; F589-L605 HydrophobicContact CG-CD1 4.3Å; C591-L605 HydrophobicContact CB-CD1 4.44Å; C591-L605 VanDerWaalsContact SG-CD1 3.51Å; L605-Y652 PolarHBondContact N-OH 3.24Å; L605-L684 HydrophobicContact CB-CD2 3.79Å; L605-V686 HydrophobicContact CD2-CG2 4Å; L605-V686 WeakPolarHBondContact O-CA 3.31Å; L605-L687 PolarHBondContact O-N 2.7Å
606	L	82.5	Confident	57.5	Low	0 Å²	0	52.5 Å²	52.5	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	145.5	172.8	-36	176.6	0	0	0	109.1	F589 I590 I592 V635 W647 L687	F589-L606 CarbonylContact C-O 3.53Å; F589-L606 WeakPolarHBondContact CA-O 3.43Å; I590-L606 HydrophobicContact CB-CB 4.03Å; I590-L606 HydrophobicContact CB-CD1 4.11Å; I590-L606 HydrophobicContact CB-CG 4.28Å; I590-L606 HydrophobicContact CD1-CD1 4.41Å; I590-L606 HydrophobicContact CG2-CD1 4.18Å; I590-L606 PolarHBondContact N-O 2.71Å; I590-L606 PolarHBondContact O-N 3.19Å; I592-L606 HydrophobicContact CD1-CD1 4.12Å; I592-L606 HydrophobicContact CD1-CD2 4.37Å; I592-L606 HydrophobicContact CD1-CG 4.28Å; L606-V635 HydrophobicContact CD1-CB 3.74Å; L606-V635 HydrophobicContact CD1-CG1 3.8Å; L606-V635 HydrophobicContact CD1-CG2 3.91Å; L606-W647 HydrophobicContact CB-CG 4.26Å; L606-W647 HydrophobicContact CD1-CB 4.03Å; L606-W647 HydrophobicContact CD1-CD2 4.17Å; L606-W647 HydrophobicContact CD1-CG 3.91Å; L606-W647 HydrophobicContact CD2-CB 4.44Å; L606-W647 HydrophobicContact CD2-CG 4.47Å; L606-W647 HydrophobicContact CG-CG 4.47Å; L606-L687 WeakPolarHBondContact CA-O 3.39Å; L606-L687 HydrophobicContact CD2-CB 3.72Å; L606-L687 HydrophobicContact CD2-CD2 3.86Å; L606-L687 HydrophobicContact CD2-CG 4.32Å
607	Y	79.1	Confident	56.9	Low	7 Å²	7	58.7 Å²	58.7	3%	0.027	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	135.3	179.5	179.5	-115.3	0	0	0	111.2	Y582 G587 E588 F589 P609 W647 V686 L687 L688 P689	Y582-Y607 HydrophobicContact CD1-CE1 4.37Å; Y582-Y607 HydrophobicContact CD2-CE1 4.49Å; Y582-Y607 HydrophobicContact CE1-CD1 4.42Å; Y582-Y607 HydrophobicContact CE1-CE1 4.05Å; Y582-Y607 HydrophobicContact CE2-CD1 4.36Å; Y582-Y607 HydrophobicContact CE2-CE1 4.19Å; Y582-Y607 AromaticContact CZ-CE1 3.97Å; G587-Y607 WeakPolarHBondContact CA-OH 3.46Å; E588-Y607 WeakPolarHBondContact O-CD2 3.12Å; F589-Y607 AromaticContact CD1-CD2 3.72Å; F589-Y607 HydrophobicContact CD1-CD2 3.72Å; F589-Y607 HydrophobicContact CD1-CG 4.38Å; F589-Y607 HydrophobicContact CD2-CD2 4.31Å; F589-Y607 AromaticContact CE1-CD2 3.36Å; F589-Y607 HydrophobicContact CE1-CD2 3.36Å; F589-Y607 HydrophobicContact CE1-CE2 4.11Å; F589-Y607 AromaticContact CE1-CG 3.98Å; F589-Y607 HydrophobicContact CE1-CG 3.98Å; F589-Y607 AromaticContact CE2-CD2 3.97Å; F589-Y607 HydrophobicContact CE2-CD2 3.97Å; F589-Y607 HydrophobicContact CE2-CE2 4.01Å; F589-Y607 HydrophobicContact CG-CD2 4.19Å; F589-Y607 AromaticContact CZ-CD2 3.48Å; F589-Y607 HydrophobicContact CZ-CD2 3.48Å; F589-Y607 VanDerWaalsContact CZ-CD2 3.48Å; F589-Y607 AromaticContact CZ-CE2 3.73Å; F589-Y607 HydrophobicContact CZ-CE2 3.73Å; F589-Y607 HydrophobicContact CZ-CG 4.41Å; Y607-P609 HydrophobicContact CE1-CB 4.02Å; Y607-W647 PolarHBondContact O-NE1 3.34Å; Y607-V686 VanDerWaalsContact CB-CG1 3.46Å; Y607-V686 HydrophobicContact CG-CG1 4.47Å; Y607-L687 PolarHBondContact N-O 2.92Å; Y607-L688 HydrophobicContact CD1-CD2 3.72Å; Y607-P689 WeakPolarHBondContact O-CD 3.21Å
608	C	76.4	Confident	56.8	Low	0 Å²	0	58.8 Å²	58.8	0%	0	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	110.6	170.5	-167.7	0	0	0	0	109.7	G587 E588 G610 L621 W647	G587-C608 VanDerWaalsContact CA-O 3.28Å; G587-C608 WeakPolarHBondContact CA-O 3.38Å; E588-C608 PolarHBondContact N-O 2.86Å; E588-C608 VanDerWaalsContact N-O 3.11Å; E588-C608 PolarHBondContact O-N 2.76Å; C608-G610 PolarHBondContact O-N 3.1Å; C608-L621 HydrophobicContact CB-CD1 3.76Å; C608-L621 HydrophobicContact CB-CD2 3.97Å; C608-L621 HydrophobicContact CB-CG 3.93Å; C608-W647 HydrophobicContact CB-CH2 4.36Å; C608-W647 HydrophobicContact CB-CZ2 3.91Å
609	P	65.6	Low	57.1	Low	39 Å²	39	53.5 Å²	53.5	25%	0.253	31%	0.311	S	S	.	.			trans	-68.2	130.5	-178.5	26.4	-33.1	0	0	0	111.8	Y607 N620	Y607-P609 HydrophobicContact CE1-CB 4.02Å; P609-N620 PolarHBondContact O-ND2 2.75Å
610	G	57.8	Low	57.9	Low	8 Å²	8	49.9 Å²	49.9	8%	0.082	30%	0.296	C	S	.	.			trans	-42.4	132.7	173.9	0	0	0	0	0	114.1	A586 C608 S612 N620	A586-G610 WeakPolarHBondContact O-CA 3.45Å; C608-G610 PolarHBondContact O-N 3.1Å; G610-S612 PolarHBondContact O-N 2.81Å; G610-N620 WeakPolarHBondContact CA-ND2 3.45Å; G610-N620 PolarHBondContact N-ND2 2.89Å
611	L	52.7	Low	59.1	Low	44 Å²	44	46.5 Å²	46.5	23%	0.23	27%	0.274	C	S	.	.			trans	-70.9	104.7	164.6	-73.2	162.3	0	0	0	107.9	N620 H640 D641	L611-N620 PolarHBondContact N-ND2 3.49Å; L611-N620 PolarHBondContact N-OD1 2.85Å; L611-H640 WeakPolarHBondContact CD1-NE2 3.28Å; L611-D641 HydrophobicContact CD1-CB 3.76Å; L611-D641 WeakPolarHBondContact CD1-OD2 3.34Å
612	S	43	Very low	60	Low	51 Å²	51	47.2 Å²	47.2	36%	0.357	28%	0.278	S	S	.	.			trans	-121.9	99.1	-176.5	72.9	0	0	0	0	112.6	G610	G610-S612 PolarHBondContact O-N 2.81Å
613	E	34.7	Very low	60.7	Low	117 Å²	117	48 Å²	48	55%	0.547	28%	0.283	S	S	.	.	S	Bend	trans	-174.7	-11.1	138.6	-103.3	176.9	-149	0	0	112.3	G615 C705	E613-G615 VanDerWaalsContact C-N 3.27Å; E613-G615 PolarHBondContact O-N 3Å; E613-C705 VanDerWaalsContact CD-SG 3.52Å; E613-C705 PolarHBondContact OE1-SG 3.49Å; E613-C705 WeakPolarHBondContact OE2-CB 3.4Å; E613-C705 PolarHBondContact OE2-SG 3.48Å; E613-C705 VanDerWaalsContact OE2-SG 3.32Å
614	T	33.1	Very low	61.5	Low	103 Å²	103	46.4 Å²	46.4	63%	0.632	28%	0.276	S	S	*	.	S	Bend	trans	-77.7	2.2	178.3	58.1	0	0	0	0	115.6	L616	T614-L616 PolarHBondContact O-N 2.78Å
615	G	32	Very low	62.1	Low	66 Å²	66	44.3 Å²	44.3	68%	0.68	27%	0.269	S	S	*	.	S	Bend	trans	73.5	-2.2	179.8	0	0	0	0	0	115.4	E613 K617	E613-G615 VanDerWaalsContact C-N 3.27Å; E613-G615 PolarHBondContact O-N 3Å; G615-K617 PolarHBondContact O-N 3.46Å
616	L	36.3	Very low	62.5	Low	116 Å²	116	44.1 Å²	44.1	61%	0.607	27%	0.268	S	S	*	.			trans	-76	70.8	166.7	-72.6	169.2	0	0	0	109.6	T614 G618	T614-L616 PolarHBondContact O-N 2.78Å; L616-G618 PolarHBondContact O-N 2.92Å
617	K	38.4	Very low	62.6	Low	177 Å²	177	44.1 Å²	44.1	77%	0.77	27%	0.268	S	S	*	.			trans	-67	96.6	170.6	-73.5	-176.8	175.6	-177.3	0	109.3	R568 G615	R568-K617 PolarHBondContact NH2-O 2.54Å; G615-K617 PolarHBondContact O-N 3.46Å
618	G	44	Very low	62.5	Low	49 Å²	49	45 Å²	45	51%	0.505	27%	0.274	S	S	.	.	S	Bend	trans	137	124.1	161.5	0	0	0	0	0	114.3	L616	L616-G618 PolarHBondContact O-N 2.92Å
619	A	51.9	Low	62.3	Low	29 Å²	29	45.7 Å²	45.7	24%	0.24	28%	0.278	C	S	.	.			trans	70.6	111.5	176.9	0	0	0	0	0	116.9	E588 H640	E588-A619 WeakPolarHBondContact OE1-CA 3.41Å; E588-A619 WeakPolarHBondContact OE1-CB 3.33Å; A619-H640 PolarHBondContact O-CD2 2.96Å
620	N	72.1	Confident	62.2	Low	6 Å²	6	48.6 Å²	48.6	3%	0.032	29%	0.292	C	S	.	.	S	Bend	trans	-96.1	-37	174.1	-84.1	-14.4	0	0	0	112.8	E588 P609 G610 L611 L639 H640	E588-N620 WeakPolarHBondContact OE2-CA 3.33Å; E588-N620 WeakPolarHBondContact OE2-CB 3.24Å; E588-N620 PolarHBondContact OE2-N 3.11Å; P609-N620 PolarHBondContact O-ND2 2.75Å; G610-N620 WeakPolarHBondContact CA-ND2 3.45Å; G610-N620 PolarHBondContact N-ND2 2.89Å; L611-N620 PolarHBondContact N-ND2 3.49Å; L611-N620 PolarHBondContact N-OD1 2.85Å; N620-L639 CarbonylContact O-C 3.28Å; N620-L639 WeakPolarHBondContact O-CA 3.43Å; N620-L639 WeakPolarHBondContact O-CD2 3.46Å; N620-H640 PolarHBondContact O-N 2.75Å
621	L	80.1	Confident	62.5	Low	3 Å²	3	53.3 Å²	53.3	2%	0.016	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	120.1	-172.1	-59.3	170.7	0	0	0	108.4	I563 E588 I590 C608 A637 L639 W647	I563-L621 HydrophobicContact CG2-CB 4.28Å; I563-L621 HydrophobicContact CG2-CD1 4.06Å; E588-L621 HydrophobicContact CB-CD1 3.92Å; E588-L621 HydrophobicContact CB-CG 4.48Å; E588-L621 VanDerWaalsContact OE2-CB 3.29Å; E588-L621 WeakPolarHBondContact OE2-CB 3.42Å; E588-L621 WeakPolarHBondContact OE2-CG 3.41Å; E588-L621 PolarHBondContact OE2-N 2.92Å; I590-L621 HydrophobicContact CD1-CD1 3.98Å; I590-L621 HydrophobicContact CG1-CD1 3.83Å; C608-L621 HydrophobicContact CB-CD1 3.76Å; C608-L621 HydrophobicContact CB-CD2 3.97Å; C608-L621 HydrophobicContact CB-CG 3.93Å; L621-A637 HydrophobicContact CD2-CB 3.49Å; L621-A637 VanDerWaalsContact CD2-CB 3.49Å; L621-L639 HydrophobicContact CD2-CD2 3.71Å; L621-W647 HydrophobicContact CD2-CH2 3.84Å
622	N	80.6	Confident	63.5	Low	63 Å²	63	51.2 Å²	51.2	34%	0.337	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	-34.9	173.6	-74.4	-15.3	0	0	0	111.8	G638 I724	N622-G638 PolarHBondContact N-O 3.37Å; N622-I724 WeakPolarHBondContact CB-O 3.42Å; N622-I724 PolarHBondContact ND2-O 2.83Å
623	C	86.2	Confident	65	Low	22 Å²	22	49.8 Å²	49.8	15%	0.149	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.8	153.2	-179.5	55.1	0	0	0	0	110.3	A637 G638	C623-A637 CarbonylContact O-C 3.55Å; C623-A637 WeakPolarHBondContact O-CA 3.44Å; C623-A637 VanDerWaalsContact O-CB 3.31Å; C623-A637 WeakPolarHBondContact O-CB 3.32Å; C623-G638 PolarHBondContact O-N 3.34Å
624	A	89.1	Confident	67.3	Low	8 Å²	8	44.3 Å²	44.3	7%	0.066	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	147.2	173.2	0	0	0	0	0	110.4	L561 I563 I590 I636 A637	L561-A624 HydrophobicContact CD1-CB 4.14Å; L561-A624 HydrophobicContact CD2-CB 4.49Å; I563-A624 HydrophobicContact CD1-CB 3.68Å; I563-A624 HydrophobicContact CG1-CB 4.33Å; I590-A624 HydrophobicContact CD1-CB 4.2Å; A624-I636 CarbonylContact C-O 3.58Å; A624-I636 VanDerWaalsContact CA-O 3.24Å; A624-I636 WeakPolarHBondContact CA-O 3.3Å; A624-A637 HydrophobicContact CB-CB 3.86Å
625	I	88.8	Confident	69.9	Low	16 Å²	16	39.4 Å²	39.4	8%	0.082	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.7	156.9	177.9	66.4	166.6	0	0	0	110.3	D551 I636 V727 I729 L753	D551-I625 WeakPolarHBondContact OD2-CG2 3.33Å; I625-I636 HydrophobicContact CG1-CB 4.27Å; I625-I636 PolarHBondContact N-O 2.76Å; I625-I636 PolarHBondContact O-N 2.69Å; I625-V727 HydrophobicContact CD1-CG1 3.71Å; I625-V727 HydrophobicContact CG1-CG1 3.96Å; I625-I729 HydrophobicContact CD1-CD1 4.07Å; I625-I729 HydrophobicContact CD1-CG1 3.79Å; I625-L753 HydrophobicContact CD1-CD1 3.84Å
626	F	88	Confident	72.6	Confident	2 Å²	2	36.2 Å²	36.2	1%	0.009	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	156.3	167.6	-71.3	-73	0	0	0	111.5	A553 L559 L561 I592 A632 V635 I729	A553-F626 VanDerWaalsContact CA-CD2 3.46Å; A553-F626 HydrophobicContact CB-CB 4.12Å; A553-F626 HydrophobicContact CB-CD2 3.69Å; A553-F626 HydrophobicContact CB-CE2 4.15Å; A553-F626 HydrophobicContact CB-CG 3.9Å; A553-F626 VanDerWaalsContact N-CD2 3.3Å; L559-F626 HydrophobicContact CB-CZ 4.49Å; L561-F626 HydrophobicContact CB-CE1 4.43Å; L561-F626 HydrophobicContact CB-CE2 3.71Å; L561-F626 HydrophobicContact CB-CZ 3.59Å; L561-F626 HydrophobicContact CD2-CD1 4.36Å; L561-F626 HydrophobicContact CD2-CD2 3.62Å; L561-F626 HydrophobicContact CD2-CE1 4.26Å; L561-F626 HydrophobicContact CD2-CE2 3.54Å; L561-F626 HydrophobicContact CD2-CG 4.08Å; L561-F626 HydrophobicContact CD2-CZ 3.89Å; L561-F626 HydrophobicContact CG-CD2 4.27Å; L561-F626 HydrophobicContact CG-CE2 3.76Å; L561-F626 HydrophobicContact CG-CZ 4.12Å; I592-F626 HydrophobicContact CD1-CE1 4.24Å; I592-F626 HydrophobicContact CG1-CE1 4.45Å; I592-F626 HydrophobicContact CG2-CE1 4.43Å; I592-F626 HydrophobicContact CG2-CZ 4.24Å; F626-A632 HydrophobicContact CB-CB 4.11Å; F626-A632 HydrophobicContact CD1-CB 3.69Å; F626-A632 HydrophobicContact CE1-CB 4.33Å; F626-A632 HydrophobicContact CG-CB 4.06Å; F626-V635 HydrophobicContact CD1-CG2 3.63Å; F626-V635 HydrophobicContact CE1-CG2 3.68Å; F626-I729 VanDerWaalsContact O-CD1 3.22Å; F626-I729 WeakPolarHBondContact O-CD1 3.36Å
627	S	84.3	Confident	75.1	Confident	0 Å²	0	30.7 Å²	30.7	0%	0	18%	0.175	C	C	.	.			trans	-65	157.6	164.5	42.6	0	0	0	0	112.2	D629 L634	S627-D629 WeakPolarHBondContact CB-OD1 3.39Å; S627-D629 PolarHBondContact O-N 3.46Å; S627-D629 PolarHBondContact OG-OD1 2.74Å; S627-L634 PolarHBondContact N-O 3.4Å; S627-L634 WeakPolarHBondContact OG-CA 2.96Å; S627-L634 WeakPolarHBondContact OG-CB 3.35Å; S627-L634 PolarHBondContact OG-N 3.49Å; S627-L634 PolarHBondContact OG-O 3.2Å; S627-L634 VanDerWaalsContact OG-O 3.08Å
628	P	77.7	Confident	77.5	Confident	26 Å²	26	22.3 Å²	22.3	17%	0.169	14%	0.139	C	C	.	.	S	Bend	trans	-79.1	2.3	-177.5	31.3	-33.2	0	0	0	114.2	Q555 I729 F751	Q555-P628 PolarHBondContact NE2-O 2.78Å; Q555-P628 PolarHBondContact OE1-O 2.79Å; P628-I729 HydrophobicContact CB-CD1 4Å; P628-I729 HydrophobicContact CB-CG2 4.26Å; P628-I729 HydrophobicContact CG-CD1 4.16Å; P628-I729 HydrophobicContact CG-CG2 4.2Å; P628-F751 HydrophobicContact CG-CB 3.55Å; P628-F751 HydrophobicContact CG-CD1 3.99Å; P628-F751 HydrophobicContact CG-CD2 4.02Å; P628-F751 HydrophobicContact CG-CG 3.59Å
629	D	71.8	Confident	79.4	Confident	14 Å²	14	20 Å²	20	8%	0.075	12%	0.115	C	C	.	.	S	Bend	trans	-74.1	155.8	178.1	62	-35.1	0	0	0	111.9	S627 D631 A632 N633	S627-D629 WeakPolarHBondContact CB-OD1 3.39Å; S627-D629 PolarHBondContact O-N 3.46Å; S627-D629 PolarHBondContact OG-OD1 2.74Å; D629-D631 PolarHBondContact O-N 3.06Å; D629-A632 PolarHBondContact O-N 2.75Å; D629-A632 VanDerWaalsContact O-N 3.08Å; D629-A632 VanDerWaalsContact OD1-CA 3.32Å; D629-A632 WeakPolarHBondContact OD1-CA 3.36Å; D629-A632 PolarHBondContact OD1-N 2.82Å; D629-N633 PolarHBondContact OD1-N 3.11Å; D629-N633 VanDerWaalsContact OD2-CB 3.24Å; D629-N633 WeakPolarHBondContact OD2-CB 3.49Å; D629-N633 PolarHBondContact OD2-N 2.69Å; D629-N633 PolarHBondContact OD2-ND2 3.25Å
630	N	63.3	Low	80.7	Confident	101 Å²	101	20.2 Å²	20.2	54%	0.54	11%	0.111	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-36.5	-173.2	-79	-40.3	0	0	0	112.1	Q555 N556	Q555-N630 VanDerWaalsContact OE1-CG 3.26Å; Q555-N630 PolarHBondContact OE1-OD1 3.1Å; N556-N630 WeakPolarHBondContact CB-O 3.18Å
631	D	64.3	Low	80.7	Confident	106 Å²	106	22 Å²	22	57%	0.567	12%	0.12	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-2.5	-175.4	-47.1	-37	0	0	0	112.5	D629 N633	D629-D631 PolarHBondContact O-N 3.06Å; D631-N633 VanDerWaalsContact C-N 3.28Å; D631-N633 WeakPolarHBondContact CB-ND2 3.46Å; D631-N633 PolarHBondContact O-N 3.13Å
632	A	74	Confident	80.5	Confident	1 Å²	1	21.9 Å²	21.9	1%	0.008	12%	0.12	C	C	.	.			trans	50.1	47.1	-177.3	0	0	0	0	0	112.6	A553 L559 F626 D629 L634 Q649	A553-A632 HydrophobicContact CB-CB 3.83Å; L559-A632 HydrophobicContact CD1-CB 3.91Å; F626-A632 HydrophobicContact CB-CB 4.11Å; F626-A632 HydrophobicContact CD1-CB 3.69Å; F626-A632 HydrophobicContact CE1-CB 4.33Å; F626-A632 HydrophobicContact CG-CB 4.06Å; D629-A632 PolarHBondContact O-N 2.75Å; D629-A632 VanDerWaalsContact O-N 3.08Å; D629-A632 VanDerWaalsContact OD1-CA 3.32Å; D629-A632 WeakPolarHBondContact OD1-CA 3.36Å; D629-A632 PolarHBondContact OD1-N 2.82Å; A632-L634 PolarHBondContact O-N 2.8Å; A632-Q649 PolarHBondContact O-NE2 3.01Å; A632-Q649 VanDerWaalsContact O-NE2 3.12Å
633	N	75	Confident	80.4	Confident	21 Å²	21	18.9 Å²	18.9	11%	0.112	10%	0.104	C	C	.	.			trans	-68.7	-20.3	-168.8	-67.8	-58.3	0	0	0	113.5	D629 D631 Q649 H650	D629-N633 PolarHBondContact OD1-N 3.11Å; D629-N633 VanDerWaalsContact OD2-CB 3.24Å; D629-N633 WeakPolarHBondContact OD2-CB 3.49Å; D629-N633 PolarHBondContact OD2-N 2.69Å; D629-N633 PolarHBondContact OD2-ND2 3.25Å; D631-N633 VanDerWaalsContact C-N 3.28Å; D631-N633 WeakPolarHBondContact CB-ND2 3.46Å; D631-N633 PolarHBondContact O-N 3.13Å; N633-Q649 WeakPolarHBondContact O-CA 3.37Å; N633-Q649 WeakPolarHBondContact O-CB 3.5Å; N633-Q649 WeakPolarHBondContact O-CG 3.21Å; N633-Q649 PolarHBondContact O-N 3.12Å; N633-H650 VanDerWaalsContact CB-CE1 3.44Å; N633-H650 WeakPolarHBondContact CB-CE1 3.21Å; N633-H650 WeakPolarHBondContact CB-NE2 3.22Å; N633-H650 PolarHBondContact ND2-CE1 3.1Å; N633-H650 PolarHBondContact OD1-ND1 3.35Å
634	L	82.9	Confident	80.2	Confident	1 Å²	1	18 Å²	18	1%	0.005	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	140.5	176.6	-52.2	176.7	0	0	0	110.7	S627 A632 I646 W647 D648 F751 V767 M769 L798	S627-L634 PolarHBondContact N-O 3.4Å; S627-L634 WeakPolarHBondContact OG-CA 2.96Å; S627-L634 WeakPolarHBondContact OG-CB 3.35Å; S627-L634 PolarHBondContact OG-N 3.49Å; S627-L634 PolarHBondContact OG-O 3.2Å; S627-L634 VanDerWaalsContact OG-O 3.08Å; A632-L634 PolarHBondContact O-N 2.8Å; L634-I646 HydrophobicContact CD2-CG2 4.5Å; L634-W647 WeakPolarHBondContact CA-O 3.2Å; L634-D648 HydrophobicContact CD2-CB 4.08Å; L634-F751 HydrophobicContact CD1-CE1 4.06Å; L634-F751 HydrophobicContact CD1-CZ 4.08Å; L634-V767 HydrophobicContact CD1-CG1 4.1Å; L634-M769 HydrophobicContact CD1-CG 4.08Å; L634-M769 HydrophobicContact CD1-SD 3.65Å; L634-M769 HydrophobicContact CG-SD 4.04Å; L634-L798 HydrophobicContact CD1-CD1 3.59Å; L634-L798 HydrophobicContact CD2-CD1 4.13Å
635	V	87.9	Confident	79.9	Confident	0 Å²	0	17.6 Å²	17.6	0%	0	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	135.3	162.9	167.1	0	0	0	0	108.1	I590 I592 L606 F626 I646 W647	I590-V635 HydrophobicContact CD1-CG1 3.97Å; I592-V635 HydrophobicContact CD1-CG2 4.2Å; L606-V635 HydrophobicContact CD1-CB 3.74Å; L606-V635 HydrophobicContact CD1-CG1 3.8Å; L606-V635 HydrophobicContact CD1-CG2 3.91Å; F626-V635 HydrophobicContact CD1-CG2 3.63Å; F626-V635 HydrophobicContact CE1-CG2 3.68Å; V635-I646 CarbonylContact O-C 3.56Å; V635-I646 VanDerWaalsContact O-CA 3.3Å; V635-I646 WeakPolarHBondContact O-CA 3.25Å; V635-W647 HydrophobicContact CB-CB 4.44Å; V635-W647 HydrophobicContact CB-CE3 4.31Å; V635-W647 HydrophobicContact CG1-CE3 3.92Å; V635-W647 HydrophobicContact CG1-CZ3 4.34Å; V635-W647 PolarHBondContact N-O 3.25Å; V635-W647 VanDerWaalsContact N-O 3.07Å; V635-W647 PolarHBondContact O-N 3.42Å
636	I	88.7	Confident	79.7	Confident	0 Å²	0	17 Å²	17	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	127.5	-174.8	-49.8	174.9	0	0	0	108	A624 I625 S645 I646 V727 F751 L753	A624-I636 CarbonylContact C-O 3.58Å; A624-I636 VanDerWaalsContact CA-O 3.24Å; A624-I636 WeakPolarHBondContact CA-O 3.3Å; I625-I636 HydrophobicContact CG1-CB 4.27Å; I625-I636 PolarHBondContact N-O 2.76Å; I625-I636 PolarHBondContact O-N 2.69Å; I636-S645 CarbonylContact C-O 3.58Å; I636-S645 WeakPolarHBondContact CA-O 3.21Å; I636-I646 HydrophobicContact CB-CG1 4.33Å; I636-I646 HydrophobicContact CG1-CG1 4.13Å; I636-I646 HydrophobicContact CG2-CG1 3.93Å; I636-V727 HydrophobicContact CG2-CG1 4.35Å; I636-F751 HydrophobicContact CD1-CE2 3.62Å; I636-F751 HydrophobicContact CD1-CZ 3.75Å; I636-L753 HydrophobicContact CD1-CD1 3.82Å; I636-L753 HydrophobicContact CD1-CD2 4.32Å; I636-L753 HydrophobicContact CG2-CD1 4.1Å; I636-L753 HydrophobicContact CG2-CD2 3.66Å
637	A	88.6	Confident	79.5	Confident	0 Å²	0	16.9 Å²	16.9	0%	0	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	144.2	179.2	0	0	0	0	0	113	L621 C623 A624 L644 S645 W647	L621-A637 HydrophobicContact CD2-CB 3.49Å; L621-A637 VanDerWaalsContact CD2-CB 3.49Å; C623-A637 CarbonylContact O-C 3.55Å; C623-A637 WeakPolarHBondContact O-CA 3.44Å; C623-A637 VanDerWaalsContact O-CB 3.31Å; C623-A637 WeakPolarHBondContact O-CB 3.32Å; A624-A637 HydrophobicContact CB-CB 3.86Å; A637-L644 WeakPolarHBondContact O-CA 3.43Å; A637-S645 PolarHBondContact N-O 3.11Å; A637-S645 PolarHBondContact O-N 3.21Å; A637-W647 HydrophobicContact CB-CH2 3.89Å; A637-W647 HydrophobicContact CB-CZ3 3.55Å
638	G	87.3	Confident	79.2	Confident	0 Å²	0	17.4 Å²	17.4	0%	0	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	132.2	170.4	0	0	0	0	0	110.9	N622 C623	N622-G638 PolarHBondContact N-O 3.37Å; C623-G638 PolarHBondContact O-N 3.34Å
639	L	84.7	Confident	79	Confident	0 Å²	0	16.6 Å²	16.6	0%	0	9%	0.088	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	157.6	-175.6	-58.9	173	0	0	0	113.2	N620 L621 D641 G642 G643 S645 K692 I724	N620-L639 CarbonylContact O-C 3.28Å; N620-L639 WeakPolarHBondContact O-CA 3.43Å; N620-L639 WeakPolarHBondContact O-CD2 3.46Å; L621-L639 HydrophobicContact CD2-CD2 3.71Å; L639-D641 WeakPolarHBondContact CB-OD1 3.41Å; L639-D641 PolarHBondContact O-N 3.37Å; L639-G642 PolarHBondContact O-N 3.2Å; L639-G643 VanDerWaalsContact CB-O 3.23Å; L639-G643 WeakPolarHBondContact CB-O 3.46Å; L639-G643 WeakPolarHBondContact CG-O 3.47Å; L639-G643 PolarHBondContact N-O 3.44Å; L639-S645 WeakPolarHBondContact CD1-OG 3.46Å; L639-K692 HydrophobicContact CD1-CD 4.22Å; L639-K692 HydrophobicContact CD1-CG 3.94Å; L639-I724 PolarHBondContact O-N 3.46Å; L639-I724 VanDerWaalsContact O-N 3.07Å
640	H	79.8	Confident	78.7	Confident	34 Å²	34	19.4 Å²	19.4	16%	0.157	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-27	175.5	94.3	58.9	0	0	0	112.7	L611 A619 N620 G642 P723	L611-H640 WeakPolarHBondContact CD1-NE2 3.28Å; A619-H640 PolarHBondContact O-CD2 2.96Å; N620-H640 PolarHBondContact O-N 2.75Å; H640-G642 PolarHBondContact O-N 3.31Å; H640-P723 VanDerWaalsContact O-CA 3.31Å; H640-P723 WeakPolarHBondContact O-CA 3.33Å; H640-P723 WeakPolarHBondContact O-CB 3.46Å; H640-P723 WeakPolarHBondContact O-CD 3.44Å; H640-P723 VanDerWaalsContact O-CG 3.22Å; H640-P723 WeakPolarHBondContact O-CG 3.09Å
641	D	72.4	Confident	78.3	Confident	43 Å²	43	16.2 Å²	16.2	23%	0.23	8%	0.083	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.8	2.7	-177.2	64.4	-5.5	0	0	0	112.5	L611 L639 G643 S694	L611-D641 HydrophobicContact CD1-CB 3.76Å; L611-D641 WeakPolarHBondContact CD1-OD2 3.34Å; L639-D641 WeakPolarHBondContact CB-OD1 3.41Å; L639-D641 PolarHBondContact O-N 3.37Å; D641-G643 VanDerWaalsContact C-N 3.34Å; D641-G643 PolarHBondContact OD1-N 3.46Å; D641-S694 WeakPolarHBondContact OD2-CB 3.37Å
642	G	75.9	Confident	77.8	Confident	1 Å²	1	11.7 Å²	11.7	1%	0.01	6%	0.058	C	C	.	.	S	Bend	trans	83.4	9.4	-177.3	0	0	0	0	0	114.4	L639 H640 H720 S722	L639-G642 PolarHBondContact O-N 3.2Å; H640-G642 PolarHBondContact O-N 3.31Å; G642-H720 CarbonylContact C-O 3.56Å; G642-H720 WeakPolarHBondContact CA-O 3.29Å; G642-H720 WeakPolarHBondContact O-CB 3.21Å; G642-H720 PolarHBondContact O-N 3.44Å; G642-S722 WeakPolarHBondContact CA-O 3.43Å
643	G	77.5	Confident	76.5	Confident	0 Å²	0	15.9 Å²	15.9	0%	0	8%	0.076	C	C	.	.			trans	-90.9	169.2	172.2	0	0	0	0	0	114.6	L639 D641 T693 I724	L639-G643 VanDerWaalsContact CB-O 3.23Å; L639-G643 WeakPolarHBondContact CB-O 3.46Å; L639-G643 WeakPolarHBondContact CG-O 3.47Å; L639-G643 PolarHBondContact N-O 3.44Å; D641-G643 VanDerWaalsContact C-N 3.34Å; D641-G643 PolarHBondContact OD1-N 3.46Å; G643-T693 WeakPolarHBondContact CA-OG1 3.27Å; G643-I724 WeakPolarHBondContact O-CD1 3.24Å
644	L	82.8	Confident	74.8	Confident	4 Å²	4	18.3 Å²	18.3	2%	0.021	9%	0.089	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	140.5	172	-69.5	168.8	0	0	0	110.1	A637 K692 T693 I724 V727 L753 A755 W765	A637-L644 WeakPolarHBondContact O-CA 3.43Å; L644-K692 CarbonylContact O-C 3.52Å; L644-K692 VanDerWaalsContact O-CA 3.32Å; L644-K692 WeakPolarHBondContact O-CA 3.28Å; L644-T693 HydrophobicContact CB-CG2 4.2Å; L644-T693 PolarHBondContact N-OG1 3.03Å; L644-T693 PolarHBondContact O-N 2.86Å; L644-I724 HydrophobicContact CD2-CD1 3.58Å; L644-I724 HydrophobicContact CG-CD1 3.8Å; L644-V727 HydrophobicContact CD2-CG2 4.05Å; L644-L753 HydrophobicContact CD1-CD2 4.06Å; L644-A755 HydrophobicContact CD2-CB 4.22Å; L644-W765 HydrophobicContact CD1-CD2 4.31Å; L644-W765 HydrophobicContact CD1-CG 4.38Å; L644-W765 HydrophobicContact CD1-CZ2 4.21Å
645	S	82.3	Confident	72.5	Confident	0 Å²	0	22 Å²	22	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116	137.6	170.3	-75.4	0	0	0	0	110.4	I636 A637 L639 W647 Y691	I636-S645 CarbonylContact C-O 3.58Å; I636-S645 WeakPolarHBondContact CA-O 3.21Å; A637-S645 PolarHBondContact N-O 3.11Å; A637-S645 PolarHBondContact O-N 3.21Å; L639-S645 WeakPolarHBondContact CD1-OG 3.46Å; S645-W647 VanDerWaalsContact CB-CH2 3.46Å; S645-Y691 CarbonylContact C-O 3.56Å; S645-Y691 WeakPolarHBondContact CA-O 3.41Å
646	I	84.6	Confident	69.8	Low	2 Å²	2	26.3 Å²	26.3	1%	0.01	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	136.1	178.2	-63.8	162.2	0	0	0	110	L634 V635 I636 P689 T690 Y691 L798 I800	L634-I646 HydrophobicContact CD2-CG2 4.5Å; V635-I646 CarbonylContact O-C 3.56Å; V635-I646 VanDerWaalsContact O-CA 3.3Å; V635-I646 WeakPolarHBondContact O-CA 3.25Å; I636-I646 HydrophobicContact CB-CG1 4.33Å; I636-I646 HydrophobicContact CG1-CG1 4.13Å; I636-I646 HydrophobicContact CG2-CG1 3.93Å; I646-P689 CarbonylContact O-C 3.59Å; I646-T690 WeakPolarHBondContact O-CA 3.48Å; I646-T690 WeakPolarHBondContact O-CB 3.29Å; I646-T690 PolarHBondContact O-N 2.86Å; I646-Y691 HydrophobicContact CD1-CD1 4.25Å; I646-Y691 PolarHBondContact N-O 3.43Å; I646-Y691 PolarHBondContact O-N 2.89Å; I646-Y691 VanDerWaalsContact O-N 3.11Å; I646-L798 HydrophobicContact CB-CD2 4.41Å; I646-L798 HydrophobicContact CD1-CD2 4.37Å; I646-L798 HydrophobicContact CG2-CD2 3.94Å; I646-I800 HydrophobicContact CD1-CD1 3.21Å; I646-I800 HydrophobicContact CD1-CG1 4.01Å
647	W	83.7	Confident	66.9	Low	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	126.1	175.1	-64.7	-101.8	0	0	0	109.9	I590 L606 Y607 C608 L621 L634 V635 A637 S645 L687 L688 P689	I590-W647 HydrophobicContact CD1-CE3 4.32Å; I590-W647 HydrophobicContact CD1-CH2 3.75Å; I590-W647 HydrophobicContact CD1-CZ2 4.16Å; I590-W647 HydrophobicContact CD1-CZ3 3.85Å; L606-W647 HydrophobicContact CB-CG 4.26Å; L606-W647 HydrophobicContact CD1-CB 4.03Å; L606-W647 HydrophobicContact CD1-CD2 4.17Å; L606-W647 HydrophobicContact CD1-CG 3.91Å; L606-W647 HydrophobicContact CD2-CB 4.44Å; L606-W647 HydrophobicContact CD2-CG 4.47Å; L606-W647 HydrophobicContact CG-CG 4.47Å; Y607-W647 PolarHBondContact O-NE1 3.34Å; C608-W647 HydrophobicContact CB-CH2 4.36Å; C608-W647 HydrophobicContact CB-CZ2 3.91Å; L621-W647 HydrophobicContact CD2-CH2 3.84Å; L634-W647 WeakPolarHBondContact CA-O 3.2Å; V635-W647 HydrophobicContact CB-CB 4.44Å; V635-W647 HydrophobicContact CB-CE3 4.31Å; V635-W647 HydrophobicContact CG1-CE3 3.92Å; V635-W647 HydrophobicContact CG1-CZ3 4.34Å; V635-W647 PolarHBondContact N-O 3.25Å; V635-W647 VanDerWaalsContact N-O 3.07Å; V635-W647 PolarHBondContact O-N 3.42Å; A637-W647 HydrophobicContact CB-CH2 3.89Å; A637-W647 HydrophobicContact CB-CZ3 3.55Å; S645-W647 VanDerWaalsContact CB-CH2 3.46Å; W647-L687 HydrophobicContact CB-CD2 4.06Å; W647-L687 PolarHBondContact NE1-O 2.96Å; W647-L688 VanDerWaalsContact CD1-O 3.26Å; W647-P689 HydrophobicContact CD2-CB 4.49Å; W647-P689 HydrophobicContact CZ2-CB 4.21Å; W647-P689 HydrophobicContact CZ2-CG 3.74Å
648	D	77.3	Confident	64	Low	12 Å²	12	35.1 Å²	35.1	6%	0.064	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	112.3	172.8	-178	-2.6	0	0	0	110.7	L634 H650 L687 T690	L634-D648 HydrophobicContact CD2-CB 4.08Å; D648-H650 VanDerWaalsContact OD1-CB 3.26Å; D648-H650 WeakPolarHBondContact OD1-CB 3.2Å; D648-H650 IonicContact OD1-CD2 3.75Å; D648-H650 PolarHBondContact OD1-CD2 3.35Å; D648-H650 IonicContact OD1-CG 3.17Å; D648-H650 PolarHBondContact OD1-N 2.73Å; D648-L687 WeakPolarHBondContact O-CD2 3.33Å; D648-T690 HydrophobicContact CB-CG2 4.1Å; D648-T690 PolarHBondContact N-OG1 2.79Å
649	Q	74.3	Confident	61	Low	8 Å²	8	44.7 Å²	44.7	4%	0.037	22%	0.219	C	C	.	.			trans	-90.2	-2	-178.6	-52.4	-177.8	41.7	0	0	114.2	A632 N633 N651 Y652	A632-Q649 PolarHBondContact O-NE2 3.01Å; A632-Q649 VanDerWaalsContact O-NE2 3.12Å; N633-Q649 WeakPolarHBondContact O-CA 3.37Å; N633-Q649 WeakPolarHBondContact O-CB 3.5Å; N633-Q649 WeakPolarHBondContact O-CG 3.21Å; N633-Q649 PolarHBondContact O-N 3.12Å; Q649-N651 PolarHBondContact O-N 3.49Å; Q649-N651 VanDerWaalsContact O-N 3.17Å; Q649-Y652 PolarHBondContact O-N 3.04Å
650	H	65.6	Low	58.2	Low	73 Å²	73	49.8 Å²	49.8	34%	0.338	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.5	-26.7	-176	-77.4	-69.2	0	0	0	113.8	N633 D648	N633-H650 VanDerWaalsContact CB-CE1 3.44Å; N633-H650 WeakPolarHBondContact CB-CE1 3.21Å; N633-H650 WeakPolarHBondContact CB-NE2 3.22Å; N633-H650 PolarHBondContact ND2-CE1 3.1Å; N633-H650 PolarHBondContact OD1-ND1 3.35Å; D648-H650 VanDerWaalsContact OD1-CB 3.26Å; D648-H650 WeakPolarHBondContact OD1-CB 3.2Å; D648-H650 IonicContact OD1-CD2 3.75Å; D648-H650 PolarHBondContact OD1-CD2 3.35Å; D648-H650 IonicContact OD1-CG 3.17Å; D648-H650 PolarHBondContact OD1-N 2.73Å
651	N	54.4	Low	55.5	Low	34 Å²	34	54.1 Å²	54.1	18%	0.182	28%	0.284	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.6	20.3	-178	-72	-10.5	0	0	0	112.9	Q649 F653 N654 R797	Q649-N651 PolarHBondContact O-N 3.49Å; Q649-N651 VanDerWaalsContact O-N 3.17Å; N651-F653 PolarHBondContact O-N 3.08Å; N651-N654 HydrophobicContact CB-CB 4.26Å; N651-N654 PolarHBondContact O-N 3.03Å; N651-R797 PolarHBondContact OD1-NH1 2.86Å
652	Y	54.6	Low	53.1	Low	11 Å²	11	58.7 Å²	58.7	4%	0.043	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-32.6	-171.5	-172.3	-103.7	0	0	0	114.4	R604 L605 Q649 P685 L687	R604-Y652 VanDerWaalsContact CA-OH 3.26Å; R604-Y652 WeakPolarHBondContact CA-OH 3.18Å; R604-Y652 HydrophobicContact CB-CD1 4.41Å; R604-Y652 HydrophobicContact CB-CE1 3.79Å; R604-Y652 HydrophobicContact CB-CE2 3.97Å; R604-Y652 HydrophobicContact CG-CD1 3.95Å; R604-Y652 HydrophobicContact CG-CE1 3.65Å; R604-Y652 HydrophobicContact CG-CG 4.46Å; L605-Y652 PolarHBondContact N-OH 3.24Å; Q649-Y652 PolarHBondContact O-N 3.04Å; Y652-P685 HydrophobicContact CD1-CG 4.29Å; Y652-P685 HydrophobicContact CE1-CG 3.62Å; Y652-P685 PolarHBondContact OH-O 2.77Å; Y652-L687 HydrophobicContact CD2-CB 3.99Å; Y652-L687 HydrophobicContact CD2-CD2 4.26Å; Y652-L687 HydrophobicContact CE2-CB 3.89Å
653	F	46.2	Very low	50.6	Low	90 Å²	90	66.5 Å²	66.5	40%	0.395	35%	0.349	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96	-11.6	177.1	-69.6	-75.3	0	0	0	115.4	N651	N651-F653 PolarHBondContact O-N 3.08Å
654	N	39.2	Very low	48	Very low	71 Å²	71	70.9 Å²	70.9	38%	0.38	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.2	-7.1	-172.8	-74.7	-24.1	0	0	0	114	Q450 N651	Q450-N654 PolarHBondContact OE1-ND2 2.86Å; N651-N654 HydrophobicContact CB-CB 4.26Å; N651-N654 PolarHBondContact O-N 3.03Å
655	E	34.7	Very low	45.2	Very low	79 Å²	79	79.2 Å²	79.2	37%	0.369	42%	0.422	S	S	.	.			trans	-116.8	45.2	-178	-71.7	173.2	154.8	0	0	112.5	P657 H671	E655-P657 VanDerWaalsContact O-CD 3.28Å; E655-P657 WeakPolarHBondContact O-CD 3.24Å; E655-H671 IonicContact OE1-NE2 2.74Å; E655-H671 IonicContact OE2-CD2 3.46Å; E655-H671 IonicContact OE2-CE1 2.76Å; E655-H671 PolarHBondContact OE2-CE1 3.02Å; E655-H671 IonicContact OE2-CG 3.71Å; E655-H671 IonicContact OE2-ND1 2.73Å; E655-H671 PolarHBondContact OE2-ND1 3.38Å; E655-H671 IonicContact OE2-NE2 3.37Å; E655-H671 PolarHBondContact OE2-NE2 2.78Å
656	I	31.3	Very low	42.4	Very low	90 Å²	90	83.5 Å²	83.5	46%	0.462	45%	0.452	S	S	.	.			trans	-81.7	111.8	168.2	-58.5	171	0	0	0	107.7	I658 L673	I656-I658 PolarHBondContact O-N 3.21Å; I656-L673 HydrophobicContact CG2-CD1 4.16Å
657	P	27.6	Very low	39.5	Very low	61 Å²	61	88.4 Å²	88.4	40%	0.396	48%	0.483	S	S	.	.			trans	-70.3	104.8	164.3	-0.7	18.5	0	0	0	106.8	E655 K659 L673	E655-P657 VanDerWaalsContact O-CD 3.28Å; E655-P657 WeakPolarHBondContact O-CD 3.24Å; P657-K659 PolarHBondContact O-N 3Å; P657-K659 VanDerWaalsContact O-N 3.09Å; P657-L673 HydrophobicContact CG-CB 4.44Å
658	I	28.1	Very low	36.6	Very low	124 Å²	124	93.5 Å²	93.5	64%	0.636	51%	0.51	S	S	*	.			trans	-56.4	114.6	166.7	-60.9	169	0	0	0	106.7	I656 S660	I656-I658 PolarHBondContact O-N 3.21Å; I658-S660 PolarHBondContact O-N 3.32Å
659	K	23.5	Very low	34.2	Very low	202 Å²	202	98 Å²	98	88%	0.878	54%	0.537	S	S	*	.			trans	9.5	99.6	161.9	-71	176.4	175.4	176.1	0	115	P657	P657-K659 PolarHBondContact O-N 3Å; P657-K659 VanDerWaalsContact O-N 3.09Å
660	S	26.4	Very low	32	Very low	106 Å²	106	104.5 Å²	104.5	74%	0.741	57%	0.568	S	S	*	*			trans	-135.9	98.7	155.3	64.6	0	0	0	0	110.2	I658	I658-S660 PolarHBondContact O-N 3.32Å
661	T	22.5	Very low	30.4	Very low	125 Å²	125	104 Å²	104	77%	0.767	57%	0.566	S	S	*	*			trans	-48.5	132.8	157.3	45.8	0	0	0	0	110.8
662	N	22.7	Very low	29.3	Very low	140 Å²	140	107.5 Å²	107.5	75%	0.749	58%	0.581	S	S	*	*			trans	86.1	133.1	163.1	-51.7	-39.5	0	0	0	118.2
663	L	23.8	Very low	28.2	Very low	165 Å²	165	110.6 Å²	110.6	86%	0.864	60%	0.598	S	S	*	*			trans	71.6	141.6	166.8	-86.2	69.5	0	0	0	116.1
664	S	23.3	Very low	27.5	Very low	92 Å²	92	107.2 Å²	107.2	64%	0.643	58%	0.584	S	S	*	*			cis	-171.1	146.1	-14	41.7	0	0	0	0	105.8	S666	S664-S666 PolarHBondContact O-N 2.71Å; S664-S666 VanDerWaalsContact O-N 3.14Å
665	I	22.9	Very low	27	Very low	179 Å²	179	108.5 Å²	108.5	92%	0.918	60%	0.595	S	S	*	*			trans	-51.1	109.8	-179.9	-61.8	149.2	0	0	0	111.5
666	S	23	Very low	26.8	Very low	89 Å²	89	105.2 Å²	105.2	62%	0.622	58%	0.58	S	S	*	*			trans	-162.6	113.1	147.9	60	0	0	0	0	109.3	S664	S664-S666 PolarHBondContact O-N 2.71Å; S664-S666 VanDerWaalsContact O-N 3.14Å
667	T	23.3	Very low	26.7	Very low	106 Å²	106	104.3 Å²	104.3	65%	0.65	59%	0.593	S	S	*	*	S	Bend	trans	43.3	122.4	145.3	54.2	0	0	0	0	118.8
668	D	24.2	Very low	26.7	Very low	106 Å²	106	108 Å²	108	57%	0.567	60%	0.603	S	S	*	*	S	Bend	trans	83.7	116.8	159.1	-51.7	-30.7	0	0	0	116.8
669	V	26.1	Very low	26.6	Very low	107 Å²	107	109.2 Å²	109.2	65%	0.648	61%	0.611	S	S	*	*			trans	65.3	92.3	165.4	-164.1	0	0	0	0	115.7
670	Q	29.4	Very low	26.9	Very low	145 Å²	145	108.2 Å²	108.2	68%	0.678	61%	0.609	S	S	*	*			trans	-138.9	109.7	167.4	-71.5	-166.3	-15.8	0	0	113.2	Q672	Q670-Q672 PolarHBondContact O-N 2.95Å
671	H	32	Very low	27.2	Very low	63 Å²	63	109.7 Å²	109.7	29%	0.292	60%	0.603	S	S	.	*			trans	-61	109.4	153.5	-72.8	-98.9	0	0	0	107.6	E655	E655-H671 IonicContact OE1-NE2 2.74Å; E655-H671 IonicContact OE2-CD2 3.46Å; E655-H671 IonicContact OE2-CE1 2.76Å; E655-H671 PolarHBondContact OE2-CE1 3.02Å; E655-H671 IonicContact OE2-CG 3.71Å; E655-H671 IonicContact OE2-ND1 2.73Å; E655-H671 PolarHBondContact OE2-ND1 3.38Å; E655-H671 IonicContact OE2-NE2 3.37Å; E655-H671 PolarHBondContact OE2-NE2 2.78Å
672	Q	31.1	Very low	28	Very low	106 Å²	106	104.9 Å²	104.9	50%	0.495	57%	0.572	S	S	.	*			trans	-90.6	113.3	175.1	-85	-178	-19.5	0	0	109.4	Q670 V674	Q670-Q672 PolarHBondContact O-N 2.95Å; Q672-V674 PolarHBondContact O-N 2.79Å
673	L	30.9	Very low	29.1	Very low	76 Å²	76	105.2 Å²	105.2	40%	0.398	57%	0.574	S	S	.	*			trans	-67.8	121.1	162.4	-157.8	89.6	0	0	0	107.7	I656 P657	I656-L673 HydrophobicContact CG2-CD1 4.16Å; P657-L673 HydrophobicContact CG-CB 4.44Å
674	V	31.7	Very low	30.6	Very low	20 Å²	20	99.7 Å²	99.7	12%	0.121	55%	0.545	C	S	.	.			trans	-92.9	105.3	175.3	175.7	0	0	0	0	109.2	F580 Y582 Q672 T676	F580-V674 VanDerWaalsContact C-CG1 3.43Å; F580-V674 HydrophobicContact CB-CB 4.5Å; F580-V674 HydrophobicContact CB-CG1 3.66Å; F580-V674 HydrophobicContact CB-CG2 4.34Å; F580-V674 HydrophobicContact CD1-CB 4.26Å; F580-V674 HydrophobicContact CD1-CG1 3.72Å; F580-V674 HydrophobicContact CG-CG1 4.19Å; F580-V674 WeakPolarHBondContact O-CG1 3.44Å; Y582-V674 HydrophobicContact CE2-CG2 4.03Å; Q672-V674 PolarHBondContact O-N 2.79Å; V674-T676 HydrophobicContact CG1-CG2 4.37Å; V674-T676 PolarHBondContact O-N 2.79Å
675	T	29.2	Very low	32.2	Very low	97 Å²	97	96.5 Å²	96.5	60%	0.595	52%	0.522	S	S	*	.			trans	-79	102.3	160.9	28.7	0	0	0	0	108.5
676	T	30.2	Very low	34.2	Very low	11 Å²	11	88.5 Å²	88.5	7%	0.067	48%	0.482	C	S	.	.			trans	-60.8	137.6	165.2	61.3	0	0	0	0	108.1	L579 F580 V674 F678 L682	L579-T676 WeakPolarHBondContact O-CG2 3.49Å; F580-T676 HydrophobicContact CD1-CG2 4.16Å; F580-T676 HydrophobicContact CE1-CG2 4.4Å; V674-T676 HydrophobicContact CG1-CG2 4.37Å; V674-T676 PolarHBondContact O-N 2.79Å; T676-F678 PolarHBondContact O-N 3.09Å; T676-L682 HydrophobicContact CG2-CD1 4.44Å
677	G	28.3	Very low	36.5	Very low	71 Å²	71	84.6 Å²	84.6	73%	0.732	45%	0.454	S	S	*	.	S	Bend	trans	-63.3	11.6	176.8	0	0	0	0	0	115.5	N679	G677-N679 PolarHBondContact O-N 2.78Å
678	F	27.1	Very low	38.6	Very low	139 Å²	139	82 Å²	82	61%	0.61	44%	0.436	S	S	*	.	S	Bend	trans	-88.2	95.7	165.6	-72.7	-82.4	0	0	0	108.7	T676 E680	T676-F678 PolarHBondContact O-N 3.09Å; F678-E680 PolarHBondContact O-N 3.44Å
679	N	26.4	Very low	40.8	Very low	149 Å²	149	78.5 Å²	78.5	80%	0.797	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.6	125.2	168.5	-71.8	-31.9	0	0	0	109.2	G677	G677-N679 PolarHBondContact O-N 2.78Å
680	E	30.9	Very low	42.7	Very low	180 Å²	180	74.9 Å²	74.9	84%	0.841	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.5	-13.7	168.5	-57.9	-177.5	163.9	0	0	120.9	F678	F678-E680 PolarHBondContact O-N 3.44Å
681	F	32.5	Very low	44.5	Very low	138 Å²	138	69.8 Å²	69.8	61%	0.605	37%	0.372	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.1	-9.9	-162.9	-72.6	-80.3	0	0	0	120.1
682	L	38	Very low	46.3	Very low	23 Å²	23	68.8 Å²	68.8	12%	0.12	37%	0.367	C	S	.	.			trans	-141	91.6	-177.6	-73.3	164.5	0	0	0	112.7	L541 L601 T676	L541-L682 HydrophobicContact CD1-CD1 3.87Å; L541-L682 HydrophobicContact CD2-CD1 3.68Å; L541-L682 HydrophobicContact CG-CD1 4.32Å; L601-L682 HydrophobicContact CD1-CD2 3.8Å; L601-L682 HydrophobicContact CD2-CD2 3.58Å; L601-L682 HydrophobicContact CG-CD2 4.37Å; T676-L682 HydrophobicContact CG2-CD1 4.44Å
683	N	46.8	Very low	48	Very low	148 Å²	148	64.4 Å²	64.4	79%	0.791	35%	0.347	S	S	*	.			trans	-105.7	50.3	168.2	-77.8	-20.5	0	0	0	110.6	P685	N683-P685 WeakPolarHBondContact O-CD 2.99Å
684	L	55	Low	49.4	Very low	48 Å²	48	61.1 Å²	61.1	25%	0.251	33%	0.33	S	S	.	.			trans	-88.9	116.8	176.2	-156.9	75.7	0	0	0	109.4	P602 L605	P602-L684 HydrophobicContact CG-CD2 3.88Å; P602-L684 WeakPolarHBondContact O-CD1 3.04Å; P602-L684 WeakPolarHBondContact O-CD2 3.32Å; L605-L684 HydrophobicContact CB-CD2 3.79Å
685	P	57.8	Low	50.1	Low	25 Å²	25	64 Å²	64	16%	0.162	35%	0.345	C	S	.	.			trans	-64.2	143.4	179.1	23.9	-29.7	0	0	0	110.6	Y652 N683	Y652-P685 HydrophobicContact CD1-CG 4.29Å; Y652-P685 HydrophobicContact CE1-CG 3.62Å; Y652-P685 PolarHBondContact OH-O 2.77Å; N683-P685 WeakPolarHBondContact O-CD 2.99Å
686	V	64.2	Low	50.6	Low	12 Å²	12	63.3 Å²	63.3	7%	0.073	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	123.2	178.8	-173.8	0	0	0	0	109.1	F589 L605 Y607	F589-V686 HydrophobicContact CE1-CG1 4.5Å; L605-V686 HydrophobicContact CD2-CG2 4Å; L605-V686 WeakPolarHBondContact O-CA 3.31Å; Y607-V686 VanDerWaalsContact CB-CG1 3.46Å; Y607-V686 HydrophobicContact CG-CG1 4.47Å
687	L	70.5	Confident	50.6	Low	7 Å²	7	67.8 Å²	67.8	4%	0.037	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	127.5	179.1	-169.3	68.4	0	0	0	111.1	L605 L606 Y607 W647 D648 Y652	L605-L687 PolarHBondContact O-N 2.7Å; L606-L687 WeakPolarHBondContact CA-O 3.39Å; L606-L687 HydrophobicContact CD2-CB 3.72Å; L606-L687 HydrophobicContact CD2-CD2 3.86Å; L606-L687 HydrophobicContact CD2-CG 4.32Å; Y607-L687 PolarHBondContact N-O 2.92Å; W647-L687 HydrophobicContact CB-CD2 4.06Å; W647-L687 PolarHBondContact NE1-O 2.96Å; D648-L687 WeakPolarHBondContact O-CD2 3.33Å; Y652-L687 HydrophobicContact CD2-CB 3.99Å; Y652-L687 HydrophobicContact CD2-CD2 4.26Å; Y652-L687 HydrophobicContact CE2-CB 3.89Å
688	L	68.4	Low	50.6	Low	51 Å²	51	71.5 Å²	71.5	27%	0.267	35%	0.353	S	S	.	.	P	Polyproline II helix	trans	-87.2	160.6	173.1	-68.2	174.6	0	0	0	111.1	Y607 W647 T690	Y607-L688 HydrophobicContact CD1-CD2 3.72Å; W647-L688 VanDerWaalsContact CD1-O 3.26Å; L688-T690 PolarHBondContact O-N 2.78Å
689	P	69.6	Low	50.5	Low	32 Å²	32	70.9 Å²	70.9	21%	0.208	35%	0.35	C	S	.	.	P	Polyproline II helix	trans	-62.2	126.8	179.7	-15.6	28.9	0	0	0	110.5	Y607 I646 W647 Y691	Y607-P689 WeakPolarHBondContact O-CD 3.21Å; I646-P689 CarbonylContact O-C 3.59Å; W647-P689 HydrophobicContact CD2-CB 4.49Å; W647-P689 HydrophobicContact CZ2-CB 4.21Å; W647-P689 HydrophobicContact CZ2-CG 3.74Å; P689-Y691 VanDerWaalsContact C-N 3.34Å
690	T	67.4	Low	50.5	Low	31 Å²	31	68.5 Å²	68.5	19%	0.19	34%	0.338	C	S	.	.	S	Bend	trans	-71.4	-31.9	176	-48.9	0	0	0	0	111.7	I646 D648 L688	I646-T690 WeakPolarHBondContact O-CA 3.48Å; I646-T690 WeakPolarHBondContact O-CB 3.29Å; I646-T690 PolarHBondContact O-N 2.86Å; D648-T690 HydrophobicContact CB-CG2 4.1Å; D648-T690 PolarHBondContact N-OG1 2.79Å; L688-T690 PolarHBondContact O-N 2.78Å
691	Y	67	Low	50.6	Low	38 Å²	38	66.2 Å²	66.2	15%	0.149	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.2	139.4	178.1	-179.1	-98.5	0	0	0	110.2	S645 I646 P689 T693 I800	S645-Y691 CarbonylContact C-O 3.56Å; S645-Y691 WeakPolarHBondContact CA-O 3.41Å; I646-Y691 HydrophobicContact CD1-CD1 4.25Å; I646-Y691 PolarHBondContact N-O 3.43Å; I646-Y691 PolarHBondContact O-N 2.89Å; I646-Y691 VanDerWaalsContact O-N 3.11Å; P689-Y691 VanDerWaalsContact C-N 3.34Å; Y691-T693 HydrophobicContact CD1-CG2 4.28Å; Y691-T693 HydrophobicContact CE1-CG2 3.33Å; Y691-I800 HydrophobicContact CD1-CD1 3.32Å; Y691-I800 HydrophobicContact CD2-CD1 4.41Å; Y691-I800 HydrophobicContact CE1-CD1 3.43Å; Y691-I800 VanDerWaalsContact CE1-CD1 3.43Å; Y691-I800 HydrophobicContact CG-CD1 3.84Å
692	K	69.4	Low	50.6	Low	43 Å²	43	63.8 Å²	63.8	19%	0.187	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	129.6	175.1	-162.4	177.7	-176.4	-147.9	0	109	L639 L644 S694	L639-K692 HydrophobicContact CD1-CD 4.22Å; L639-K692 HydrophobicContact CD1-CG 3.94Å; L644-K692 CarbonylContact O-C 3.52Å; L644-K692 VanDerWaalsContact O-CA 3.32Å; L644-K692 WeakPolarHBondContact O-CA 3.28Å; K692-S694 WeakPolarHBondContact CD-OG 3.39Å; K692-S694 WeakPolarHBondContact CE-OG 3.22Å; K692-S694 VanDerWaalsContact CG-OG 3.27Å; K692-S694 WeakPolarHBondContact CG-OG 3.35Å; K692-S694 PolarHBondContact NZ-OG 3.07Å
693	T	67.4	Low	50.3	Low	13 Å²	13	70 Å²	70	8%	0.08	37%	0.371	C	S	.	.			trans	-84.2	-14.9	178.2	67.4	0	0	0	0	113.2	G643 L644 Y691 N719	G643-T693 WeakPolarHBondContact CA-OG1 3.27Å; L644-T693 HydrophobicContact CB-CG2 4.2Å; L644-T693 PolarHBondContact N-OG1 3.03Å; L644-T693 PolarHBondContact O-N 2.86Å; Y691-T693 HydrophobicContact CD1-CG2 4.28Å; Y691-T693 HydrophobicContact CE1-CG2 3.33Å; T693-N719 WeakPolarHBondContact CB-OD1 3.26Å; T693-N719 PolarHBondContact O-ND2 3.4Å; T693-N719 PolarHBondContact O-OD1 2.86Å; T693-N719 PolarHBondContact OG1-OD1 3.4Å
694	S	58.7	Low	49.3	Very low	8 Å²	8	66.3 Å²	66.3	6%	0.056	35%	0.354	C	S	.	.	S	Bend	trans	-62.5	155.3	177.8	72.1	0	0	0	0	112.8	D641 K692 V696	D641-S694 WeakPolarHBondContact OD2-CB 3.37Å; K692-S694 WeakPolarHBondContact CD-OG 3.39Å; K692-S694 WeakPolarHBondContact CE-OG 3.22Å; K692-S694 VanDerWaalsContact CG-OG 3.27Å; K692-S694 WeakPolarHBondContact CG-OG 3.35Å; K692-S694 PolarHBondContact NZ-OG 3.07Å; S694-V696 PolarHBondContact O-N 2.98Å
695	L	48.1	Very low	48	Very low	80 Å²	80	66.3 Å²	66.3	42%	0.419	36%	0.358	S	S	.	.			trans	-53.7	128.7	172.5	-92.7	96.7	0	0	0	111.5	Q716	L695-Q716 HydrophobicContact CD1-CG 4.28Å
696	V	40.1	Very low	46.4	Very low	83 Å²	83	72.9 Å²	72.9	50%	0.503	38%	0.384	S	S	.	.			trans	-80.9	113.1	166.6	178.2	0	0	0	0	107.3	S694 Y698	S694-V696 PolarHBondContact O-N 2.98Å; V696-Y698 PolarHBondContact O-N 3.12Å
697	E	28.3	Very low	44.6	Very low	104 Å²	104	80 Å²	80	49%	0.486	42%	0.42	S	S	.	.			trans	-72.6	119	168.6	-74.3	177.1	171.2	0	0	109.5
698	Y	28.4	Very low	42.6	Very low	150 Å²	150	86.4 Å²	86.4	59%	0.588	45%	0.45	S	S	*	.			trans	-86.6	126.7	168	-123.2	-91.7	0	0	0	109.5	V696	V696-Y698 PolarHBondContact O-N 3.12Å
699	K	26.7	Very low	40.7	Very low	125 Å²	125	88.1 Å²	88.1	54%	0.543	47%	0.467	S	S	.	.			trans	-87.8	108.7	164.7	-79.3	-170	174	-170.3	0	108.8
700	D	26.2	Very low	38.8	Very low	100 Å²	100	91.9 Å²	91.9	54%	0.535	49%	0.489	S	S	.	.			trans	-64.3	151.7	163.7	-91.1	-19.2	0	0	0	110	T702 N703	D700-T702 PolarHBondContact O-N 3.43Å; D700-N703 PolarHBondContact O-N 3.26Å
701	S	32.5	Very low	36.9	Very low	131 Å²	131	96.7 Å²	96.7	92%	0.916	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	2	-178.3	57.6	0	0	0	0	115.3
702	T	32.2	Very low	34.9	Very low	87 Å²	87	101.6 Å²	101.6	53%	0.534	54%	0.542	S	S	.	.	T	Hydrogen-bonded Turn	trans	-103.6	16.2	-176.7	52	0	0	0	0	114.3	D700 T704	D700-T702 PolarHBondContact O-N 3.43Å; T702-T704 WeakPolarHBondContact CB-OG1 3.44Å; T702-T704 PolarHBondContact O-N 2.79Å; T702-T704 PolarHBondContact O-OG1 3.42Å; T702-T704 PolarHBondContact OG1-OG1 3.31Å
703	N	30.9	Very low	32.9	Very low	153 Å²	153	101.3 Å²	101.3	82%	0.818	55%	0.545	S	S	*	.	S	Bend	trans	50.8	23.6	179.9	-90.3	-11.7	0	0	0	114.2	D700	D700-N703 PolarHBondContact O-N 3.26Å
704	T	26.9	Very low	31.1	Very low	71 Å²	71	105 Å²	105	44%	0.436	57%	0.568	S	S	.	*			trans	-121.2	102.5	-176.9	30.1	0	0	0	0	107.5	T702 K706	T702-T704 WeakPolarHBondContact CB-OG1 3.44Å; T702-T704 PolarHBondContact O-N 2.79Å; T702-T704 PolarHBondContact O-OG1 3.42Å; T702-T704 PolarHBondContact OG1-OG1 3.31Å; T704-K706 PolarHBondContact O-N 3.23Å; T704-K706 VanDerWaalsContact O-N 3.15Å
705	C	26.6	Very low	29.9	Very low	48 Å²	48	107.5 Å²	107.5	32%	0.324	58%	0.582	S	S	.	*			trans	-67.1	111.4	173	-69.4	0	0	0	0	108.4	E613	E613-C705 VanDerWaalsContact CD-SG 3.52Å; E613-C705 PolarHBondContact OE1-SG 3.49Å; E613-C705 WeakPolarHBondContact OE2-CB 3.4Å; E613-C705 PolarHBondContact OE2-SG 3.48Å; E613-C705 VanDerWaalsContact OE2-SG 3.32Å
706	K	24.3	Very low	29.4	Very low	163 Å²	163	105.6 Å²	105.6	71%	0.709	57%	0.571	S	S	*	*			trans	-106.1	114.7	169.1	-72.9	-178.6	179.4	174.8	0	107	T704 Q708	T704-K706 PolarHBondContact O-N 3.23Å; T704-K706 VanDerWaalsContact O-N 3.15Å; K706-Q708 PolarHBondContact O-N 3.13Å; K706-Q708 VanDerWaalsContact O-N 3.1Å
707	L	27	Very low	29.5	Very low	161 Å²	161	109.1 Å²	109.1	84%	0.843	58%	0.582	S	S	*	*			trans	-52.7	115.6	160.1	-91.4	141.4	0	0	0	107.4	S709	L707-S709 PolarHBondContact O-N 3.37Å
708	Q	29.1	Very low	30.7	Very low	143 Å²	143	107.4 Å²	107.4	67%	0.668	57%	0.574	S	S	*	*			trans	-62.8	125.7	171.4	-157.5	173.3	18.6	0	0	107.3	K706 V710	K706-Q708 PolarHBondContact O-N 3.13Å; K706-Q708 VanDerWaalsContact O-N 3.1Å; Q708-V710 PolarHBondContact O-N 3.1Å
709	S	27.6	Very low	32	Very low	87 Å²	87	101.1 Å²	101.1	61%	0.608	55%	0.551	S	S	*	*			trans	-51.6	137.1	-179.4	55.9	0	0	0	0	111	L707 D711	L707-S709 PolarHBondContact O-N 3.37Å; S709-D711 PolarHBondContact O-N 3.15Å
710	V	30.8	Very low	33.7	Very low	110 Å²	110	95.4 Å²	95.4	67%	0.667	53%	0.526	S	S	*	.	T	Hydrogen-bonded Turn	trans	-39.2	-8.7	-174.9	178.9	0	0	0	0	117.7	Q708 Q716	Q708-V710 PolarHBondContact O-N 3.1Å; V710-Q716 PolarHBondContact O-OE1 2.79Å
711	D	26.7	Very low	35.6	Very low	133 Å²	133	99 Å²	99	71%	0.711	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-100.4	-6.9	-157.6	-63.9	-29.9	0	0	0	116.8	S709	S709-D711 PolarHBondContact O-N 3.15Å
712	N	25.4	Very low	37.7	Very low	141 Å²	141	93 Å²	93	75%	0.754	50%	0.495	S	S	*	.	S	Bend	trans	-135.4	10.5	-168.4	-80.7	-22.7	0	0	0	118.1
713	C	27.5	Very low	40.1	Very low	37 Å²	37	90.4 Å²	90.4	25%	0.25	48%	0.48	C	S	.	.			trans	-96.6	102.1	177.8	-72.6	0	0	0	0	111.6	T715 Q716	C713-T715 PolarHBondContact O-N 2.98Å; C713-Q716 HydrophobicContact CB-CG 3.87Å; C713-Q716 WeakPolarHBondContact O-CB 3.31Å; C713-Q716 PolarHBondContact O-N 2.81Å
714	V	28.9	Very low	42.8	Very low	91 Å²	91	83.1 Å²	83.1	55%	0.552	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-56.1	-23.3	175.4	-179.9	0	0	0	0	112.2	Q716 I787	V714-Q716 VanDerWaalsContact C-N 3.27Å; V714-Q716 PolarHBondContact O-N 2.96Å; V714-I787 HydrophobicContact CB-CG2 4.15Å; V714-I787 HydrophobicContact CG2-CG2 4.18Å
715	T	34.6	Very low	45.7	Very low	59 Å²	59	81.9 Å²	81.9	36%	0.362	43%	0.431	S	S	.	.	G	3₁₀ helix	trans	-69.4	-14.5	176	53.4	0	0	0	0	114.7	C713	C713-T715 PolarHBondContact O-N 2.98Å
716	Q	36.5	Very low	48.7	Very low	40 Å²	40	80.3 Å²	80.3	19%	0.187	42%	0.42	C	S	.	.	G	3₁₀ helix	trans	-75.6	-23.4	-176.3	-74.7	-178.9	-1.2	0	0	114.7	L695 V710 C713 V714 H718	L695-Q716 HydrophobicContact CD1-CG 4.28Å; V710-Q716 PolarHBondContact O-OE1 2.79Å; C713-Q716 HydrophobicContact CB-CG 3.87Å; C713-Q716 WeakPolarHBondContact O-CB 3.31Å; C713-Q716 PolarHBondContact O-N 2.81Å; V714-Q716 VanDerWaalsContact C-N 3.27Å; V714-Q716 PolarHBondContact O-N 2.96Å; Q716-H718 PolarHBondContact O-N 2.92Å; Q716-H718 VanDerWaalsContact O-N 3.12Å
717	Q	41.8	Very low	51.9	Low	157 Å²	157	72.7 Å²	72.7	73%	0.734	39%	0.388	S	S	*	.	G	3₁₀ helix	trans	-68.8	-13.3	-175	-71.2	-170.2	-14.9	0	0	113.9	R802	Q717-R802 PolarHBondContact O-NH1 3.33Å
718	H	53.8	Low	54.9	Low	68 Å²	68	68.7 Å²	68.7	32%	0.315	36%	0.363	S	S	.	.	G	3₁₀ helix	trans	-108.4	-10	-171.4	-54.8	-56.7	0	0	0	115.1	Q716 W765 R802	Q716-H718 PolarHBondContact O-N 2.92Å; Q716-H718 VanDerWaalsContact O-N 3.12Å; H718-W765 HydrophobicContact CB-CH2 3.58Å; H718-W765 HydrophobicContact CB-CZ2 4.37Å; H718-W765 HydrophobicContact CB-CZ3 4.28Å; H718-W765 WeakPolarHBondContact O-CZ2 3.43Å; H718-R802 PolarHBondContact O-NH2 2.67Å
719	N	56.3	Low	57.7	Low	19 Å²	19	63.9 Å²	63.9	10%	0.102	34%	0.342	C	S	.	.	S	Bend	trans	-78.6	143	177.7	-75.8	-20.7	0	0	0	111.4	T693	T693-N719 WeakPolarHBondContact CB-OD1 3.26Å; T693-N719 PolarHBondContact O-ND2 3.4Å; T693-N719 PolarHBondContact O-OD1 2.86Å; T693-N719 PolarHBondContact OG1-OD1 3.4Å
720	H	61.1	Low	60.1	Low	5 Å²	5	60.2 Å²	60.2	2%	0.023	32%	0.317	C	S	.	.			trans	-67.2	136.7	155.2	-61	-95.3	0	0	0	106	G642 S722 D757 N761 S763 F805	G642-H720 CarbonylContact C-O 3.56Å; G642-H720 WeakPolarHBondContact CA-O 3.29Å; G642-H720 WeakPolarHBondContact O-CB 3.21Å; G642-H720 PolarHBondContact O-N 3.44Å; H720-S722 WeakPolarHBondContact CB-O 3.28Å; H720-S722 PolarHBondContact O-N 2.97Å; H720-D757 HydrophobicContact CB-CB 3.94Å; H720-D757 IonicContact CE1-OD2 3.88Å; H720-D757 IonicContact CG-OD2 3.41Å; H720-D757 WeakPolarHBondContact ND1-CB 3.45Å; H720-D757 IonicContact ND1-OD2 2.76Å; H720-D757 PolarHBondContact ND1-OD2 2.73Å; H720-N761 PolarHBondContact CE1-O 2.99Å; H720-S763 VanDerWaalsContact NE2-CB 3.29Å; H720-S763 WeakPolarHBondContact NE2-CB 3.1Å; H720-S763 PolarHBondContact NE2-OG 2.97Å; H720-F805 AromaticContact CE1-CE2 3.84Å
721	F	67.3	Low	61.6	Low	175 Å²	175	59.4 Å²	59.4	77%	0.768	31%	0.309	S	S	*	.	S	Bend	trans	-84.9	7.2	170.7	-68.5	-77.8	0	0	0	111.5
722	S	76.8	Confident	62.7	Low	4 Å²	4	54.2 Å²	54.2	3%	0.028	29%	0.287	C	S	.	.	S	Bend	trans	-132.2	141.8	-173.7	52.9	0	0	0	0	109.5	G642 H720 I724 D757	G642-S722 WeakPolarHBondContact CA-O 3.43Å; H720-S722 WeakPolarHBondContact CB-O 3.28Å; H720-S722 PolarHBondContact O-N 2.97Å; S722-I724 PolarHBondContact O-N 3.22Å; S722-D757 VanDerWaalsContact OG-CB 3.24Å; S722-D757 WeakPolarHBondContact OG-CB 3.41Å; S722-D757 PolarHBondContact OG-OD2 2.89Å; S722-D757 VanDerWaalsContact OG-OD2 3.1Å
723	P	83.2	Confident	63.4	Low	33 Å²	33	51 Å²	51	21%	0.214	27%	0.27	C	S	.	.			trans	-41.2	130	-180	-28.2	22.1	0	0	0	114.5	H640 I725 D757 E758	H640-P723 VanDerWaalsContact O-CA 3.31Å; H640-P723 WeakPolarHBondContact O-CA 3.33Å; H640-P723 WeakPolarHBondContact O-CB 3.46Å; H640-P723 WeakPolarHBondContact O-CD 3.44Å; H640-P723 VanDerWaalsContact O-CG 3.22Å; H640-P723 WeakPolarHBondContact O-CG 3.09Å; P723-I725 PolarHBondContact O-N 2.77Å; P723-D757 CarbonylContact O-C 3.53Å; P723-D757 VanDerWaalsContact O-CA 3.28Å; P723-D757 WeakPolarHBondContact O-CA 3.31Å; P723-E758 HydrophobicContact CB-CG 4.27Å; P723-E758 VanDerWaalsContact CD-CD 3.4Å; P723-E758 WeakPolarHBondContact CD-OE1 3.14Å; P723-E758 HydrophobicContact CG-CG 4.2Å; P723-E758 WeakPolarHBondContact CG-OE2 3.46Å; P723-E758 PolarHBondContact O-N 2.91Å
724	I	86.8	Confident	63.9	Low	0 Å²	0	55 Å²	55	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	119.3	170.3	-59.9	-174.4	0	0	0	107.7	N622 L639 G643 L644 S722 V727 A755 L756	N622-I724 WeakPolarHBondContact CB-O 3.42Å; N622-I724 PolarHBondContact ND2-O 2.83Å; L639-I724 PolarHBondContact O-N 3.46Å; L639-I724 VanDerWaalsContact O-N 3.07Å; G643-I724 WeakPolarHBondContact O-CD1 3.24Å; L644-I724 HydrophobicContact CD2-CD1 3.58Å; L644-I724 HydrophobicContact CG-CD1 3.8Å; S722-I724 PolarHBondContact O-N 3.22Å; I724-V727 HydrophobicContact CG2-CG2 3.72Å; I724-A755 HydrophobicContact CD1-CB 4.08Å; I724-A755 HydrophobicContact CG2-CB 4.1Å; I724-L756 CarbonylContact C-O 3.59Å; I724-L756 WeakPolarHBondContact CA-O 3.34Å
725	I	87.9	Confident	64.1	Low	45 Å²	45	58.4 Å²	58.4	23%	0.231	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	-22.4	-177.8	56.6	152.5	0	0	0	113	P723 L756 E758 T845	P723-I725 PolarHBondContact O-N 2.77Å; I725-L756 HydrophobicContact CD1-CD2 3.55Å; I725-L756 HydrophobicContact CD1-CG 3.95Å; I725-L756 HydrophobicContact CG1-CB 4.36Å; I725-L756 HydrophobicContact CG1-CD2 4.01Å; I725-L756 HydrophobicContact CG1-CG 3.93Å; I725-L756 WeakPolarHBondContact CG1-O 3.34Å; I725-L756 PolarHBondContact N-O 2.91Å; I725-E758 HydrophobicContact CG2-CB 3.96Å; I725-T845 WeakPolarHBondContact CD1-O 3.15Å; I725-T845 WeakPolarHBondContact CD1-OG1 3.31Å
726	S	90.2	Very high	64	Low	15 Å²	15	65 Å²	65	11%	0.105	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.4	136.3	-179	-164	0	0	0	0	111.3	A755 L756	S726-A755 WeakPolarHBondContact O-CA 3.42Å; S726-L756 PolarHBondContact N-O 2.84Å; S726-L756 PolarHBondContact O-N 2.95Å
727	V	91.1	Very high	63.9	Low	3 Å²	3	67.2 Å²	67.2	2%	0.018	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	131.8	170.9	-179.2	0	0	0	0	108	I625 I636 L644 I724 L753 L754 A755	I625-V727 HydrophobicContact CD1-CG1 3.71Å; I625-V727 HydrophobicContact CG1-CG1 3.96Å; I636-V727 HydrophobicContact CG2-CG1 4.35Å; L644-V727 HydrophobicContact CD2-CG2 4.05Å; I724-V727 HydrophobicContact CG2-CG2 3.72Å; V727-L753 HydrophobicContact CG1-CD1 3.34Å; V727-L753 HydrophobicContact CG1-CD2 4.34Å; V727-L753 HydrophobicContact CG1-CG 3.95Å; V727-L754 CarbonylContact C-O 3.42Å; V727-L754 VanDerWaalsContact CA-O 3.28Å; V727-L754 WeakPolarHBondContact CA-O 3.44Å; V727-A755 HydrophobicContact CG2-CB 4.43Å
728	K	89.8	Confident	63.5	Low	77 Å²	77	69.4 Å²	69.4	34%	0.335	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	147	-178.5	-69.6	-68.9	-174.4	176.5	0	110.7	L754 L848 I850	K728-L754 PolarHBondContact N-O 3.02Å; K728-L754 PolarHBondContact O-N 2.94Å; K728-L848 HydrophobicContact CB-CD2 4.39Å; K728-L848 WeakPolarHBondContact CE-O 3.2Å; K728-L848 HydrophobicContact CG-CD2 4.13Å; K728-I850 HydrophobicContact CB-CD1 3.57Å; K728-I850 HydrophobicContact CB-CG1 4.43Å; K728-I850 HydrophobicContact CG-CD1 4.37Å
729	I	86.9	Confident	62.5	Low	43 Å²	43	74.8 Å²	74.8	22%	0.221	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	130.6	169.5	-68.6	154	0	0	0	108.7	I625 F626 P628 D731	I625-I729 HydrophobicContact CD1-CD1 4.07Å; I625-I729 HydrophobicContact CD1-CG1 3.79Å; F626-I729 VanDerWaalsContact O-CD1 3.22Å; F626-I729 WeakPolarHBondContact O-CD1 3.36Å; P628-I729 HydrophobicContact CB-CD1 4Å; P628-I729 HydrophobicContact CB-CG2 4.26Å; P628-I729 HydrophobicContact CG-CD1 4.16Å; P628-I729 HydrophobicContact CG-CG2 4.2Å; I729-D731 PolarHBondContact O-N 3.32Å; I729-D731 VanDerWaalsContact O-N 3.1Å
730	A	77.8	Confident	61.6	Low	10 Å²	10	80 Å²	80	8%	0.083	38%	0.378	C	S	.	.			trans	-80.3	90.3	175.3	0	0	0	0	0	109.7	G732 Q752 L754 L764	A730-G732 VanDerWaalsContact C-N 3.3Å; A730-G732 PolarHBondContact O-N 3.33Å; A730-Q752 HydrophobicContact CB-CB 4.04Å; A730-Q752 PolarHBondContact N-O 2.82Å; A730-L754 HydrophobicContact CB-CD1 3.7Å; A730-L754 HydrophobicContact CB-CG 4.28Å; A730-L764 HydrophobicContact CB-CD1 4.38Å
731	D	62	Low	60.3	Low	93 Å²	93	84.6 Å²	84.6	50%	0.497	41%	0.406	S	S	.	.			trans	-75.2	80.3	175.1	-174	26.8	0	0	0	109.8	I729 K852	I729-D731 PolarHBondContact O-N 3.32Å; I729-D731 VanDerWaalsContact O-N 3.1Å; D731-K852 IonicContact OD2-NZ 3.76Å; D731-K852 PolarHBondContact OD2-NZ 3.01Å
732	G	49.9	Very low	58.6	Low	24 Å²	24	85.6 Å²	85.6	25%	0.247	41%	0.411	C	S	.	.			trans	-167.5	77.7	-173.4	0	0	0	0	0	113.1	A730	A730-G732 VanDerWaalsContact C-N 3.3Å; A730-G732 PolarHBondContact O-N 3.33Å
733	D	41.5	Very low	56.3	Low	73 Å²	73	94 Å²	94	39%	0.39	45%	0.449	S	S	.	.			trans	162.1	10.2	140.4	-95.9	-21.4	0	0	0	114	H735 R736 Y737	D733-H735 PolarHBondContact O-N 3.49Å; D733-R736 PolarHBondContact O-N 2.48Å; D733-Y737 HydrophobicContact CB-CD2 4.14Å; D733-Y737 HydrophobicContact CB-CE2 3.97Å; D733-Y737 VanDerWaalsContact O-CD2 3.32Å; D733-Y737 WeakPolarHBondContact O-CD2 3.4Å; D733-Y737 PolarHBondContact O-N 3.12Å
734	H	38.5	Very low	53.8	Low	122 Å²	122	97.1 Å²	97.1	57%	0.565	47%	0.472	S	S	*	.	H	α-helix	trans	-56.3	-22	177.1	-71.1	-1	0	0	0	114
735	H	32.3	Very low	51.1	Low	161 Å²	161	103.3 Å²	103.3	75%	0.745	51%	0.51	S	S	*	.	H	α-helix	trans	-84.7	-26.9	175	-71.2	-58.6	0	0	0	115	D733	D733-H735 PolarHBondContact O-N 3.49Å
736	R	31.9	Very low	49	Very low	197 Å²	197	109.8 Å²	109.8	74%	0.743	53%	0.532	S	S	*	.	H	α-helix	trans	-78.4	-25	175.5	-81.2	-172.4	178.7	178.4	1.8	113	D733	D733-R736 PolarHBondContact O-N 2.48Å
737	Y	34.7	Very low	46.9	Very low	88 Å²	88	115.3 Å²	115.3	35%	0.345	56%	0.56	S	S	.	*	H	α-helix	trans	-75.1	-26.1	176	-79.4	-75.3	0	0	0	114	L286 D733 E739	L286-Y737 WeakPolarHBondContact CA-OH 2.94Å; L286-Y737 HydrophobicContact CD2-CD1 4.46Å; L286-Y737 HydrophobicContact CD2-CE1 3.64Å; L286-Y737 PolarHBondContact O-OH 3.22Å; D733-Y737 HydrophobicContact CB-CD2 4.14Å; D733-Y737 HydrophobicContact CB-CE2 3.97Å; D733-Y737 VanDerWaalsContact O-CD2 3.32Å; D733-Y737 WeakPolarHBondContact O-CD2 3.4Å; D733-Y737 PolarHBondContact O-N 3.12Å; Y737-E739 VanDerWaalsContact C-N 3.29Å; Y737-E739 PolarHBondContact O-N 2.85Å
738	R	32.8	Very low	45.3	Very low	202 Å²	202	118.8 Å²	118.8	76%	0.762	58%	0.581	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	-18.2	-173.5	-114.6	-176.4	-175.5	-171.9	3.6	115.1
739	E	33.5	Very low	44.1	Very low	182 Å²	182	116.7 Å²	116.7	85%	0.85	57%	0.574	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.7	-14.3	-173.8	-100.8	-177	161.4	0	0	115.1	Y737	Y737-E739 VanDerWaalsContact C-N 3.29Å; Y737-E739 PolarHBondContact O-N 2.85Å
740	V	38	Very low	43.5	Very low	128 Å²	128	120.1 Å²	120.1	78%	0.776	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.2	-21	-173.4	-176.9	0	0	0	0	113.5
741	V	33.6	Very low	43.6	Very low	101 Å²	101	120 Å²	120	61%	0.612	59%	0.585	S	S	*	*			trans	-113.8	94.9	-179	-172.4	0	0	0	0	109.9
742	K	31	Very low	44.7	Very low	196 Å²	196	117.4 Å²	117.4	85%	0.852	57%	0.57	S	S	*	*			trans	-71.9	122.4	156.9	-72.6	-179.9	177.5	178.8	0	106.7
743	E	28.4	Very low	46.5	Very low	180 Å²	180	116.3 Å²	116.3	84%	0.841	56%	0.558	S	S	*	*	S	Bend	trans	77.9	96.2	167.7	-57.7	168.9	171.4	0	0	117.3
744	S	30.4	Very low	48.8	Very low	99 Å²	99	112.8 Å²	112.8	69%	0.692	54%	0.539	S	S	*	.				163.1	109.1	123.9	65	0	0	0	0	113.3
745	T	30.1	Very low	51.3	Low	130 Å²	130	107 Å²	107	80%	0.798	51%	0.513	S	S	*	.	S	Bend	trans	44.9	107.5	143.5	58.1	0	0	0	0	121.5
746	R	43.8	Very low	54.1	Low	181 Å²	181	99.3 Å²	99.3	68%	0.683	48%	0.477	S	S	*	.			trans	64.7	71.7	155.6	-55.7	-172.9	-171.1	-172	4.7	118.1	T748	R746-T748 PolarHBondContact O-N 3.03Å; R746-T748 VanDerWaalsContact O-N 3.15Å
747	D	47.6	Very low	56.8	Low	131 Å²	131	90 Å²	90	70%	0.701	44%	0.442	S	S	*	.	G	3₁₀ helix	trans	-69.1	4.5	165.7	-83.2	-32.1	0	0	0	114.8	D749	D747-D749 PolarHBondContact O-N 3.38Å
748	T	56.2	Low	59.2	Low	77 Å²	77	89.3 Å²	89.3	47%	0.472	44%	0.442	S	S	.	.	G	3₁₀ helix	trans	-69	-10.4	178.9	46.4	0	0	0	0	113.8	R746 K750 M769	R746-T748 PolarHBondContact O-N 3.03Å; R746-T748 VanDerWaalsContact O-N 3.15Å; T748-K750 VanDerWaalsContact C-N 3.34Å; T748-K750 PolarHBondContact O-N 3.25Å; T748-M769 WeakPolarHBondContact O-CE 3.34Å
749	D	64.4	Low	61.6	Low	33 Å²	33	81.8 Å²	81.8	18%	0.176	42%	0.416	C	S	.	.	G	3₁₀ helix	trans	-91.5	3.7	-166.4	-68.7	4.5	0	0	0	112.9	D747 M769 Q771	D747-D749 PolarHBondContact O-N 3.38Å; D749-M769 HydrophobicContact CB-CB 4.33Å; D749-M769 WeakPolarHBondContact CB-O 3.46Å; D749-M769 PolarHBondContact O-N 2.68Å; D749-Q771 WeakPolarHBondContact OD2-CG 3.3Å; D749-Q771 PolarHBondContact OD2-NE2 2.78Å
750	K	74.8	Confident	64	Low	114 Å²	114	73.2 Å²	73.2	50%	0.496	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	131.9	-176.8	-52	-178.8	-176.3	159.9	0	111.8	T748 V767 L768	T748-K750 VanDerWaalsContact C-N 3.34Å; T748-K750 PolarHBondContact O-N 3.25Å; K750-V767 WeakPolarHBondContact CA-O 3.2Å; K750-L768 HydrophobicContact CB-CD2 4.06Å; K750-L768 HydrophobicContact CD-CD2 3.5Å; K750-L768 HydrophobicContact CG-CD2 3.49Å; K750-L768 VanDerWaalsContact CG-CD2 3.49Å
751	F	80.9	Confident	66.3	Low	9 Å²	9	68 Å²	68	4%	0.039	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.9	165.6	173.6	63.6	-87.5	0	0	0	111.8	P628 L634 I636 V767 M769	P628-F751 HydrophobicContact CG-CB 3.55Å; P628-F751 HydrophobicContact CG-CD1 3.99Å; P628-F751 HydrophobicContact CG-CD2 4.02Å; P628-F751 HydrophobicContact CG-CG 3.59Å; L634-F751 HydrophobicContact CD1-CE1 4.06Å; L634-F751 HydrophobicContact CD1-CZ 4.08Å; I636-F751 HydrophobicContact CD1-CE2 3.62Å; I636-F751 HydrophobicContact CD1-CZ 3.75Å; F751-V767 HydrophobicContact CD1-CB 4.23Å; F751-V767 HydrophobicContact CD2-CB 4.24Å; F751-V767 HydrophobicContact CD2-CG2 4.34Å; F751-V767 HydrophobicContact CE1-CB 3.77Å; F751-V767 HydrophobicContact CE1-CG1 3.72Å; F751-V767 HydrophobicContact CE2-CB 3.79Å; F751-V767 HydrophobicContact CE2-CG1 4.33Å; F751-V767 HydrophobicContact CE2-CG2 3.68Å; F751-V767 HydrophobicContact CG-CB 4.45Å; F751-V767 HydrophobicContact CZ-CB 3.53Å; F751-V767 HydrophobicContact CZ-CG1 3.58Å; F751-V767 HydrophobicContact CZ-CG2 3.78Å; F751-V767 PolarHBondContact N-O 3Å; F751-V767 VanDerWaalsContact N-O 3.1Å; F751-V767 PolarHBondContact O-N 2.92Å; F751-M769 HydrophobicContact CD1-CE 4.26Å; F751-M769 HydrophobicContact CE1-CE 4.04Å
752	Q	85	Confident	68.9	Low	38 Å²	38	63.3 Å²	63.3	18%	0.178	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	135.6	-179.2	-71.5	171.7	-3.1	0	0	111.5	A730 L764 W765 L766 L803	A730-Q752 HydrophobicContact CB-CB 4.04Å; A730-Q752 PolarHBondContact N-O 2.82Å; Q752-L764 HydrophobicContact CB-CD1 4.09Å; Q752-W765 CarbonylContact C-O 3.6Å; Q752-W765 VanDerWaalsContact CA-O 3.25Å; Q752-W765 WeakPolarHBondContact CA-O 3.44Å; Q752-L766 HydrophobicContact CG-CD1 4.03Å; Q752-L803 HydrophobicContact CG-CD1 4.24Å
753	L	87.9	Confident	71.5	Confident	0 Å²	0	54 Å²	54	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	132.8	-175.9	-177.6	78	0	0	0	109.4	I625 I636 L644 V727 L764 W765 V767	I625-L753 HydrophobicContact CD1-CD1 3.84Å; I636-L753 HydrophobicContact CD1-CD1 3.82Å; I636-L753 HydrophobicContact CD1-CD2 4.32Å; I636-L753 HydrophobicContact CG2-CD1 4.1Å; I636-L753 HydrophobicContact CG2-CD2 3.66Å; L644-L753 HydrophobicContact CD1-CD2 4.06Å; V727-L753 HydrophobicContact CG1-CD1 3.34Å; V727-L753 HydrophobicContact CG1-CD2 4.34Å; V727-L753 HydrophobicContact CG1-CG 3.95Å; L753-L764 CarbonylContact O-C 3.57Å; L753-L764 WeakPolarHBondContact O-CA 3.49Å; L753-W765 HydrophobicContact CB-CB 4.25Å; L753-W765 PolarHBondContact N-O 3.37Å; L753-W765 PolarHBondContact O-N 2.69Å; L753-V767 HydrophobicContact CB-CG2 4.37Å
754	L	89.7	Confident	74.3	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.5	134.1	173.4	-75.6	157	0	0	0	109.6	V727 K728 A730 I762 S763 L764 I850 F856	V727-L754 CarbonylContact C-O 3.42Å; V727-L754 VanDerWaalsContact CA-O 3.28Å; V727-L754 WeakPolarHBondContact CA-O 3.44Å; K728-L754 PolarHBondContact N-O 3.02Å; K728-L754 PolarHBondContact O-N 2.94Å; A730-L754 HydrophobicContact CB-CD1 3.7Å; A730-L754 HydrophobicContact CB-CG 4.28Å; L754-I762 HydrophobicContact CD2-CG2 3.54Å; L754-S763 CarbonylContact C-O 3.54Å; L754-S763 WeakPolarHBondContact CA-O 3.32Å; L754-L764 HydrophobicContact CD1-CD1 4.47Å; L754-L764 HydrophobicContact CD2-CB 3.96Å; L754-L764 HydrophobicContact CD2-CD1 3.59Å; L754-L764 HydrophobicContact CD2-CG 4.37Å; L754-L764 HydrophobicContact CG-CD1 3.71Å; L754-I850 HydrophobicContact CD1-CD1 3.39Å; L754-I850 HydrophobicContact CD1-CG1 4.13Å; L754-F856 HydrophobicContact CD1-CD1 4.18Å; L754-F856 HydrophobicContact CD1-CE1 3.43Å; L754-F856 VanDerWaalsContact CD1-CE1 3.43Å; L754-F856 HydrophobicContact CD1-CZ 4.12Å; L754-F856 HydrophobicContact CD2-CE1 3.95Å; L754-F856 HydrophobicContact CD2-CZ 3.83Å; L754-F856 HydrophobicContact CG-CE1 4.36Å
755	A	90.5	Very high	76.9	Confident	0 Å²	0	41.5 Å²	41.5	0%	0	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	128.7	170.3	0	0	0	0	0	110	L644 I724 S726 V727 I762 S763	L644-A755 HydrophobicContact CD2-CB 4.22Å; I724-A755 HydrophobicContact CD1-CB 4.08Å; I724-A755 HydrophobicContact CG2-CB 4.1Å; S726-A755 WeakPolarHBondContact O-CA 3.42Å; V727-A755 HydrophobicContact CG2-CB 4.43Å; A755-I762 WeakPolarHBondContact O-CA 3.46Å; A755-S763 PolarHBondContact N-O 3.02Å; A755-S763 PolarHBondContact O-N 3.07Å; A755-S763 PolarHBondContact O-OG 3.08Å
756	L	91.1	Very high	79.4	Confident	0 Å²	0	37 Å²	37	0%	0	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	130.8	175.4	175	70.5	0	0	0	109	I724 I725 S726 I762 L848 I858	I724-L756 CarbonylContact C-O 3.59Å; I724-L756 WeakPolarHBondContact CA-O 3.34Å; I725-L756 HydrophobicContact CD1-CD2 3.55Å; I725-L756 HydrophobicContact CD1-CG 3.95Å; I725-L756 HydrophobicContact CG1-CB 4.36Å; I725-L756 HydrophobicContact CG1-CD2 4.01Å; I725-L756 HydrophobicContact CG1-CG 3.93Å; I725-L756 WeakPolarHBondContact CG1-O 3.34Å; I725-L756 PolarHBondContact N-O 2.91Å; S726-L756 PolarHBondContact N-O 2.84Å; S726-L756 PolarHBondContact O-N 2.95Å; L756-I762 HydrophobicContact CD1-CD1 4.44Å; L756-I762 HydrophobicContact CD1-CG1 3.65Å; L756-L848 HydrophobicContact CB-CB 4.4Å; L756-L848 HydrophobicContact CB-CD2 4.11Å; L756-L848 HydrophobicContact CD2-CB 3.75Å; L756-L848 HydrophobicContact CD2-CD1 4.3Å; L756-L848 HydrophobicContact CD2-CG 4.47Å; L756-I858 HydrophobicContact CD1-CD1 4.42Å; L756-I858 HydrophobicContact CD1-CG2 4.48Å; L756-I858 HydrophobicContact CD2-CG2 4.02Å
757	D	87.8	Confident	81.1	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.144	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	167.1	170.4	69.8	28.2	0	0	0	113.2	H720 S722 P723 I759 G760 N761 T845	H720-D757 HydrophobicContact CB-CB 3.94Å; H720-D757 IonicContact CE1-OD2 3.88Å; H720-D757 IonicContact CG-OD2 3.41Å; H720-D757 WeakPolarHBondContact ND1-CB 3.45Å; H720-D757 IonicContact ND1-OD2 2.76Å; H720-D757 PolarHBondContact ND1-OD2 2.73Å; S722-D757 VanDerWaalsContact OG-CB 3.24Å; S722-D757 WeakPolarHBondContact OG-CB 3.41Å; S722-D757 PolarHBondContact OG-OD2 2.89Å; S722-D757 VanDerWaalsContact OG-OD2 3.1Å; P723-D757 CarbonylContact O-C 3.53Å; P723-D757 VanDerWaalsContact O-CA 3.28Å; P723-D757 WeakPolarHBondContact O-CA 3.31Å; D757-I759 PolarHBondContact O-N 3.47Å; D757-I759 WeakPolarHBondContact OD1-CA 2.86Å; D757-I759 WeakPolarHBondContact OD1-CB 3.25Å; D757-I759 PolarHBondContact OD1-N 3.37Å; D757-G760 PolarHBondContact O-N 2.9Å; D757-G760 VanDerWaalsContact O-N 3.13Å; D757-G760 PolarHBondContact OD1-N 3.42Å; D757-N761 PolarHBondContact N-O 2.97Å; D757-N761 PolarHBondContact OD1-N 2.85Å; D757-N761 WeakPolarHBondContact OD2-CB 3.28Å; D757-N761 PolarHBondContact OD2-ND2 2.81Å; D757-T845 PolarHBondContact O-OG1 2.92Å
758	E	85.6	Confident	82.4	Confident	74 Å²	74	23.4 Å²	23.4	35%	0.346	12%	0.118	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-19.1	177.8	56	163.1	-155.1	0	0	114.7	P723 I725 T845	P723-E758 HydrophobicContact CB-CG 4.27Å; P723-E758 VanDerWaalsContact CD-CD 3.4Å; P723-E758 WeakPolarHBondContact CD-OE1 3.14Å; P723-E758 HydrophobicContact CG-CG 4.2Å; P723-E758 WeakPolarHBondContact CG-OE2 3.46Å; P723-E758 PolarHBondContact O-N 2.91Å; I725-E758 HydrophobicContact CG2-CB 3.96Å; E758-T845 WeakPolarHBondContact CA-OG1 3.23Å; E758-T845 PolarHBondContact O-N 3.38Å; E758-T845 VanDerWaalsContact O-N 3.1Å; E758-T845 PolarHBondContact O-OG1 3.36Å; E758-T845 VanDerWaalsContact O-OG1 3.11Å
759	I	83.6	Confident	83	Confident	44 Å²	44	20.8 Å²	20.8	23%	0.226	10%	0.1	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-20.4	178.8	-69.8	172.4	0	0	0	110.6	D757 K842	D757-I759 PolarHBondContact O-N 3.47Å; D757-I759 WeakPolarHBondContact OD1-CA 2.86Å; D757-I759 WeakPolarHBondContact OD1-CB 3.25Å; D757-I759 PolarHBondContact OD1-N 3.37Å; I759-K842 VanDerWaalsContact CG2-NZ 3.35Å
760	G	83	Confident	82.8	Confident	3 Å²	3	21.2 Å²	21.2	3%	0.031	10%	0.103	C	C	.	.	S	Bend	trans	105	5.7	179.9	0	0	0	0	0	115.1	D757 Y808	D757-G760 PolarHBondContact O-N 2.9Å; D757-G760 VanDerWaalsContact O-N 3.13Å; D757-G760 PolarHBondContact OD1-N 3.42Å; G760-Y808 WeakPolarHBondContact O-CB 3.24Å
761	N	86	Confident	81.7	Confident	17 Å²	17	21.1 Å²	21.1	9%	0.091	10%	0.104	C	C	.	.			trans	-75.9	137.6	175.3	-42.4	-55.2	0	0	0	110.4	H720 D757 F805 I806 E807 Y808	H720-N761 PolarHBondContact CE1-O 2.99Å; D757-N761 PolarHBondContact N-O 2.97Å; D757-N761 PolarHBondContact OD1-N 2.85Å; D757-N761 WeakPolarHBondContact OD2-CB 3.28Å; D757-N761 PolarHBondContact OD2-ND2 2.81Å; N761-F805 HydrophobicContact CB-CE2 3.6Å; N761-F805 HydrophobicContact CB-CZ 3.67Å; N761-I806 CarbonylContact C-O 3.56Å; N761-I806 WeakPolarHBondContact CA-O 3.46Å; N761-I806 WeakPolarHBondContact CB-O 3.41Å; N761-E807 WeakPolarHBondContact OD1-CA 3.12Å; N761-E807 WeakPolarHBondContact OD1-CG 3.02Å; N761-Y808 PolarHBondContact OD1-N 2.91Å
762	I	88.4	Confident	80.1	Confident	3 Å²	3	27.1 Å²	27.1	2%	0.015	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	129.8	178.7	-64.7	170.9	0	0	0	108.5	L754 A755 L756 F805 I806 L848 F856 I858	L754-I762 HydrophobicContact CD2-CG2 3.54Å; A755-I762 WeakPolarHBondContact O-CA 3.46Å; L756-I762 HydrophobicContact CD1-CD1 4.44Å; L756-I762 HydrophobicContact CD1-CG1 3.65Å; I762-F805 CarbonylContact O-C 3.54Å; I762-F805 WeakPolarHBondContact O-CA 3.24Å; I762-I806 HydrophobicContact CB-CB 4.33Å; I762-I806 PolarHBondContact N-O 2.96Å; I762-I806 PolarHBondContact O-N 2.88Å; I762-L848 HydrophobicContact CD1-CD1 4.5Å; I762-F856 HydrophobicContact CD1-CB 4.04Å; I762-F856 HydrophobicContact CD1-CD2 3.72Å; I762-F856 HydrophobicContact CD1-CE2 4.43Å; I762-F856 HydrophobicContact CD1-CG 3.97Å; I762-F856 HydrophobicContact CG2-CE2 4.46Å; I762-I858 HydrophobicContact CD1-CD1 3.69Å; I762-I858 HydrophobicContact CD1-CG1 4.29Å; I762-I858 HydrophobicContact CG1-CD1 4.43Å
763	S	86.8	Confident	77.8	Confident	0 Å²	0	34.5 Å²	34.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	132.3	166.3	62.1	0	0	0	0	111	H720 L754 A755 W765 L804	H720-S763 VanDerWaalsContact NE2-CB 3.29Å; H720-S763 WeakPolarHBondContact NE2-CB 3.1Å; H720-S763 PolarHBondContact NE2-OG 2.97Å; L754-S763 CarbonylContact C-O 3.54Å; L754-S763 WeakPolarHBondContact CA-O 3.32Å; A755-S763 PolarHBondContact N-O 3.02Å; A755-S763 PolarHBondContact O-N 3.07Å; A755-S763 PolarHBondContact O-OG 3.08Å; S763-W765 PolarHBondContact OG-NE1 2.84Å; S763-L804 WeakPolarHBondContact CA-O 3.19Å
764	L	85.9	Confident	75.1	Confident	10 Å²	10	42 Å²	42	5%	0.052	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	131.1	171.1	-178.4	70.3	0	0	0	108.4	A730 Q752 L753 L754 R802 L803 L804	A730-L764 HydrophobicContact CB-CD1 4.38Å; Q752-L764 HydrophobicContact CB-CD1 4.09Å; L753-L764 CarbonylContact O-C 3.57Å; L753-L764 WeakPolarHBondContact O-CA 3.49Å; L754-L764 HydrophobicContact CD1-CD1 4.47Å; L754-L764 HydrophobicContact CD2-CB 3.96Å; L754-L764 HydrophobicContact CD2-CD1 3.59Å; L754-L764 HydrophobicContact CD2-CG 4.37Å; L754-L764 HydrophobicContact CG-CD1 3.71Å; L764-R802 CarbonylContact O-C 3.58Å; L764-L803 HydrophobicContact CB-CB 4.43Å; L764-L803 HydrophobicContact CD2-CB 3.97Å; L764-L803 HydrophobicContact CD2-CD1 3.97Å; L764-L803 HydrophobicContact CG-CB 4.12Å; L764-L803 HydrophobicContact CG-CD1 4.19Å; L764-L803 PolarHBondContact O-N 2.91Å; L764-L804 HydrophobicContact CB-CB 3.87Å; L764-L804 HydrophobicContact CD2-CB 4.3Å; L764-L804 PolarHBondContact N-O 2.82Å; L764-L804 PolarHBondContact O-N 3.39Å
765	W	85.1	Confident	72.5	Confident	7 Å²	7	44.5 Å²	44.5	3%	0.027	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124	145.1	179.7	-56.7	83.7	0	0	0	110.1	L644 H718 Q752 L753 S763 I800 I801 R802	L644-W765 HydrophobicContact CD1-CD2 4.31Å; L644-W765 HydrophobicContact CD1-CG 4.38Å; L644-W765 HydrophobicContact CD1-CZ2 4.21Å; H718-W765 HydrophobicContact CB-CH2 3.58Å; H718-W765 HydrophobicContact CB-CZ2 4.37Å; H718-W765 HydrophobicContact CB-CZ3 4.28Å; H718-W765 WeakPolarHBondContact O-CZ2 3.43Å; Q752-W765 CarbonylContact C-O 3.6Å; Q752-W765 VanDerWaalsContact CA-O 3.25Å; Q752-W765 WeakPolarHBondContact CA-O 3.44Å; L753-W765 HydrophobicContact CB-CB 4.25Å; L753-W765 PolarHBondContact N-O 3.37Å; L753-W765 PolarHBondContact O-N 2.69Å; S763-W765 PolarHBondContact OG-NE1 2.84Å; W765-I800 HydrophobicContact CB-CG2 4.18Å; W765-I800 HydrophobicContact CD2-CG2 4.29Å; W765-I800 HydrophobicContact CE3-CG2 3.63Å; W765-I800 HydrophobicContact CZ3-CG2 4.26Å; W765-I801 CarbonylContact C-O 3.52Å; W765-I801 VanDerWaalsContact CA-O 3.3Å; W765-I801 WeakPolarHBondContact CA-O 3.16Å; W765-R802 HydrophobicContact CD2-CB 4.11Å; W765-R802 HydrophobicContact CD2-CG 4.04Å; W765-R802 HydrophobicContact CE3-CB 3.6Å; W765-R802 HydrophobicContact CE3-CG 4.05Å; W765-R802 HydrophobicContact CH2-CB 4.2Å; W765-R802 HydrophobicContact CH2-CG 4.32Å; W765-R802 HydrophobicContact CZ2-CG 4.19Å; W765-R802 HydrophobicContact CZ3-CB 3.68Å; W765-R802 HydrophobicContact CZ3-CG 4.21Å
766	L	82.2	Confident	69.8	Low	35 Å²	35	52.7 Å²	52.7	18%	0.183	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.1	122.2	168.2	-176.4	66.3	0	0	0	108	Q752 L768 I800 I801 L803	Q752-L766 HydrophobicContact CG-CD1 4.03Å; L766-L768 HydrophobicContact CD1-CD2 4.42Å; L766-L768 HydrophobicContact CD2-CD1 4.39Å; L766-L768 HydrophobicContact CD2-CD2 3.84Å; L766-L768 HydrophobicContact CD2-CG 4.17Å; L766-L768 HydrophobicContact CG-CD2 3.91Å; L766-L768 HydrophobicContact CG-CG 4.12Å; L766-I800 CarbonylContact O-C 3.48Å; L766-I800 WeakPolarHBondContact O-CA 3.31Å; L766-I801 HydrophobicContact CB-CB 4.44Å; L766-I801 PolarHBondContact N-O 2.95Å; L766-I801 PolarHBondContact O-N 3.23Å; L766-L803 HydrophobicContact CB-CD1 3.85Å; L766-L803 HydrophobicContact CB-CD2 4Å; L766-L803 HydrophobicContact CB-CG 3.82Å; L766-L803 HydrophobicContact CD2-CD2 4.37Å
767	V	80.3	Confident	67	Low	0 Å²	0	56.7 Å²	56.7	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	124.8	172.2	-174.5	0	0	0	0	107.7	L634 K750 F751 L753 L798 I800	L634-V767 HydrophobicContact CD1-CG1 4.1Å; K750-V767 WeakPolarHBondContact CA-O 3.2Å; F751-V767 HydrophobicContact CD1-CB 4.23Å; F751-V767 HydrophobicContact CD2-CB 4.24Å; F751-V767 HydrophobicContact CD2-CG2 4.34Å; F751-V767 HydrophobicContact CE1-CB 3.77Å; F751-V767 HydrophobicContact CE1-CG1 3.72Å; F751-V767 HydrophobicContact CE2-CB 3.79Å; F751-V767 HydrophobicContact CE2-CG1 4.33Å; F751-V767 HydrophobicContact CE2-CG2 3.68Å; F751-V767 HydrophobicContact CG-CB 4.45Å; F751-V767 HydrophobicContact CZ-CB 3.53Å; F751-V767 HydrophobicContact CZ-CG1 3.58Å; F751-V767 HydrophobicContact CZ-CG2 3.78Å; F751-V767 PolarHBondContact N-O 3Å; F751-V767 VanDerWaalsContact N-O 3.1Å; F751-V767 PolarHBondContact O-N 2.92Å; L753-V767 HydrophobicContact CB-CG2 4.37Å; V767-L798 HydrophobicContact CG1-CD1 3.85Å; V767-I800 HydrophobicContact CG1-CG1 4.46Å; V767-I800 HydrophobicContact CG2-CG1 4.42Å
768	L	74.3	Confident	64.5	Low	27 Å²	27	58.8 Å²	58.8	14%	0.141	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.2	122.4	178.6	-59.2	172.4	0	0	0	108.2	K750 L766 R799 I801	K750-L768 HydrophobicContact CB-CD2 4.06Å; K750-L768 HydrophobicContact CD-CD2 3.5Å; K750-L768 HydrophobicContact CG-CD2 3.49Å; K750-L768 VanDerWaalsContact CG-CD2 3.49Å; L766-L768 HydrophobicContact CD1-CD2 4.42Å; L766-L768 HydrophobicContact CD2-CD1 4.39Å; L766-L768 HydrophobicContact CD2-CD2 3.84Å; L766-L768 HydrophobicContact CD2-CG 4.17Å; L766-L768 HydrophobicContact CG-CD2 3.91Å; L766-L768 HydrophobicContact CG-CG 4.12Å; L768-R799 HydrophobicContact CB-CB 4.19Å; L768-R799 PolarHBondContact N-O 3.49Å; L768-R799 PolarHBondContact O-N 3.3Å; L768-I801 HydrophobicContact CD1-CD1 3.85Å
769	M	69.7	Low	62.3	Low	22 Å²	22	61 Å²	61	11%	0.108	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	117.2	170.2	-60.4	-173	-83.6	0	0	107.4	L634 T748 D749 F751 R797	L634-M769 HydrophobicContact CD1-CG 4.08Å; L634-M769 HydrophobicContact CD1-SD 3.65Å; L634-M769 HydrophobicContact CG-SD 4.04Å; T748-M769 WeakPolarHBondContact O-CE 3.34Å; D749-M769 HydrophobicContact CB-CB 4.33Å; D749-M769 WeakPolarHBondContact CB-O 3.46Å; D749-M769 PolarHBondContact O-N 2.68Å; F751-M769 HydrophobicContact CD1-CE 4.26Å; F751-M769 HydrophobicContact CE1-CE 4.04Å; M769-R797 CarbonylContact C-O 3.59Å; M769-R797 WeakPolarHBondContact CA-O 3.29Å
770	N	61	Low	59.9	Low	43 Å²	43	64.3 Å²	64.3	23%	0.23	31%	0.31	C	S	.	.	P	Polyproline II helix	trans	-88.3	126.2	172	-64.8	-31.3	0	0	0	108.2	K772 G796 R797 R799	N770-K772 PolarHBondContact O-N 3.06Å; N770-G796 PolarHBondContact ND2-O 3.12Å; N770-R797 PolarHBondContact N-O 2.82Å; N770-R799 PolarHBondContact ND2-NE 2.94Å
771	Q	51.8	Low	57.5	Low	111 Å²	111	67 Å²	67	52%	0.519	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-59.6	133	159.7	-69.6	173.5	21.3	0	0	107.9	D749 Y773	D749-Q771 WeakPolarHBondContact OD2-CG 3.3Å; D749-Q771 PolarHBondContact OD2-NE2 2.78Å; Q771-Y773 PolarHBondContact O-N 3.22Å
772	K	45.5	Very low	55.2	Low	136 Å²	136	72 Å²	72	59%	0.591	35%	0.354	S	S	*	.			trans	-32.9	126.5	-170.6	-60.5	177.4	-170	178.6	0	113	N770	N770-K772 PolarHBondContact O-N 3.06Å
773	Y	36.7	Very low	52.7	Low	192 Å²	192	74.1 Å²	74.1	75%	0.753	37%	0.373	S	S	*	.			trans	-73.4	131.4	147.9	-89.3	-94.6	0	0	0	106.8	Q771 V775	Q771-Y773 PolarHBondContact O-N 3.22Å; Y773-V775 PolarHBondContact O-N 3.01Å
774	E	32.3	Very low	50	Low	158 Å²	158	77.4 Å²	77.4	74%	0.738	41%	0.407	S	S	*	.			trans	-60.3	88.5	163.5	-75.8	176.4	172.2	0	0	108.1	Q776	E774-Q776 PolarHBondContact O-N 3.06Å; E774-Q776 VanDerWaalsContact O-N 3.14Å
775	V	35.3	Very low	47.7	Very low	53 Å²	53	79.8 Å²	79.8	32%	0.321	42%	0.424	S	S	.	.			trans	-76.9	103.1	177.9	178	0	0	0	0	107.7	R440 Y773 N777 E780	R440-V775 PolarHBondContact NH1-O 2.94Å; Y773-V775 PolarHBondContact O-N 3.01Å; V775-N777 VanDerWaalsContact C-N 3.31Å; V775-N777 PolarHBondContact O-N 3.12Å; V775-E780 HydrophobicContact CG1-CB 3.99Å
776	Q	32.5	Very low	45.7	Very low	171 Å²	171	84.2 Å²	84.2	80%	0.799	45%	0.445	S	S	*	.			trans	-80.7	5.8	-169.4	-136.5	166.4	14	0	0	114.9	E774	E774-Q776 PolarHBondContact O-N 3.06Å; E774-Q776 VanDerWaalsContact O-N 3.14Å
777	N	33.2	Very low	43.8	Very low	85 Å²	85	86.6 Å²	86.6	46%	0.455	46%	0.457	S	S	.	.			trans	-145.9	129.9	-179.7	-76	-45.8	0	0	0	113	V775 I779 E780	V775-N777 VanDerWaalsContact C-N 3.31Å; V775-N777 PolarHBondContact O-N 3.12Å; N777-I779 PolarHBondContact O-N 2.82Å; N777-E780 PolarHBondContact O-N 3.09Å
778	S	36.3	Very low	41.7	Very low	44 Å²	44	91.8 Å²	91.8	31%	0.308	49%	0.485	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.9	-1.8	177.5	48.6	0	0	0	0	115.2	P437 S781	P437-S778 VanDerWaalsContact O-CB 3.28Å; P437-S778 WeakPolarHBondContact O-CB 3.41Å; P437-S778 PolarHBondContact O-OG 3.34Å; S778-S781 PolarHBondContact O-OG 3.41Å; S778-S781 VanDerWaalsContact O-OG 3.07Å
779	I	37.5	Very low	40	Very low	119 Å²	119	98 Å²	98	61%	0.61	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-16.6	179	-57.9	171.6	0	0	0	111.1	N777 L782	N777-I779 PolarHBondContact O-N 2.82Å; I779-L782 WeakPolarHBondContact O-CB 3.44Å; I779-L782 PolarHBondContact O-N 3.26Å
780	E	33.2	Very low	38.8	Very low	114 Å²	114	99.7 Å²	99.7	53%	0.533	52%	0.52	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-5.2	177.6	-67.8	179.5	-176.4	0	0	113.5	V775 N777 L782 A783	V775-E780 HydrophobicContact CG1-CB 3.99Å; N777-E780 PolarHBondContact O-N 3.09Å; E780-L782 PolarHBondContact O-N 3.37Å; E780-A783 PolarHBondContact O-N 3.46Å
781	S	33.6	Very low	37.8	Very low	61 Å²	61	100.6 Å²	100.6	43%	0.427	53%	0.525	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-22.8	164.2	58.6	0	0	0	0	111.8	S778 A783	S778-S781 PolarHBondContact O-OG 3.41Å; S778-S781 VanDerWaalsContact O-OG 3.07Å; S781-A783 PolarHBondContact O-N 2.82Å; S781-A783 VanDerWaalsContact O-N 3.14Å
782	L	36.9	Very low	37.4	Very low	121 Å²	121	95.5 Å²	95.5	63%	0.634	50%	0.502	S	S	*	.	S	Bend	trans	-81.5	65.9	160.8	-70	141	0	0	0	108.5	I779 E780 G784	I779-L782 WeakPolarHBondContact O-CB 3.44Å; I779-L782 PolarHBondContact O-N 3.26Å; E780-L782 PolarHBondContact O-N 3.37Å; L782-G784 PolarHBondContact O-N 3.31Å
783	A	37.3	Very low	37	Very low	48 Å²	48	92.1 Å²	92.1	40%	0.397	49%	0.494	S	S	.	.			trans	-61.1	111.6	169.3	0	0	0	0	0	108.1	E780 S781 S785	E780-A783 PolarHBondContact O-N 3.46Å; S781-A783 PolarHBondContact O-N 2.82Å; S781-A783 VanDerWaalsContact O-N 3.14Å; A783-S785 PolarHBondContact O-N 3.14Å
784	G	30.4	Very low	37.2	Very low	69 Å²	69	85 Å²	85	71%	0.711	48%	0.479	S	S	*	.	S	Bend	trans	-56.8	130.5	177.6	0	0	0	0	0	111.2	L782	L782-G784 PolarHBondContact O-N 3.31Å
785	S	36.2	Very low	37.9	Very low	60 Å²	60	79.5 Å²	79.5	42%	0.42	46%	0.456	S	S	.	.			trans	53.3	111.5	167.5	-171.9	0	0	0	0	116.7	A783 I787	A783-S785 PolarHBondContact O-N 3.14Å; S785-I787 PolarHBondContact O-N 3.27Å; S785-I787 WeakPolarHBondContact OG-CB 3.45Å; S785-I787 WeakPolarHBondContact OG-CD1 3.34Å; S785-I787 WeakPolarHBondContact OG-CG1 3.48Å; S785-I787 PolarHBondContact OG-N 2.83Å
786	Q	43.3	Very low	38.6	Very low	100 Å²	100	78.7 Å²	78.7	47%	0.467	46%	0.458	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55	-7.9	167.3	-145.4	171.8	10.5	0	0	113.8
787	I	41.8	Very low	39.9	Very low	85 Å²	85	72.8 Å²	72.8	44%	0.436	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-22.5	-163.4	-46.6	171.2	0	0	0	112	V714 S785	V714-I787 HydrophobicContact CB-CG2 4.15Å; V714-I787 HydrophobicContact CG2-CG2 4.18Å; S785-I787 PolarHBondContact O-N 3.27Å; S785-I787 WeakPolarHBondContact OG-CB 3.45Å; S785-I787 WeakPolarHBondContact OG-CD1 3.34Å; S785-I787 WeakPolarHBondContact OG-CG1 3.48Å; S785-I787 PolarHBondContact OG-N 2.83Å
788	D	37.8	Very low	41.6	Very low	109 Å²	109	69 Å²	69	58%	0.583	41%	0.409	S	S	*	.	S	Bend	trans	-109.6	-18.7	-164.8	-67	-25.8	0	0	0	116.3
789	Y	37.5	Very low	43	Very low	158 Å²	158	72 Å²	72	62%	0.62	41%	0.413	S	S	*	.	S	Bend	trans	-144.9	8.3	-172.6	-69.6	-74.6	0	0	0	117.9	L791	Y789-L791 HydrophobicContact CG-CD1 4.49Å; Y789-L791 PolarHBondContact O-N 3.48Å
790	C	45.6	Very low	44.7	Very low	56 Å²	56	66.8 Å²	66.8	38%	0.378	39%	0.386	S	S	.	.			trans	50.7	28.2	-175.7	-56.8	0	0	0	0	113.8
791	L	38.9	Very low	46.7	Very low	62 Å²	62	65.2 Å²	65.2	33%	0.325	38%	0.381	S	S	.	.	P	Polyproline II helix	trans	-86	129.7	176.8	-65.3	168.9	0	0	0	108.5	Y789 R799	Y789-L791 HydrophobicContact CG-CD1 4.49Å; Y789-L791 PolarHBondContact O-N 3.48Å; L791-R799 HydrophobicContact CD2-CG 4.1Å
792	S	43.8	Very low	48.8	Very low	5 Å²	5	64.5 Å²	64.5	4%	0.035	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-56.9	134.8	168.2	158.3	0	0	0	0	109.6	G794 T795	S792-G794 PolarHBondContact O-N 3.17Å; S792-T795 PolarHBondContact OG-OG1 3.48Å
793	P	37	Very low	50.8	Low	65 Å²	65	60.5 Å²	60.5	42%	0.422	35%	0.348	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	122.8	168.3	-10.9	23.6	0	0	0	108.7
794	G	40.4	Very low	52.7	Low	43 Å²	43	59.1 Å²	59.1	44%	0.443	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.8	-25.7	165.6	0	0	0	0	0	117.9	S792	S792-G794 PolarHBondContact O-N 3.17Å
795	T	47.9	Very low	55.2	Low	41 Å²	41	59.8 Å²	59.8	25%	0.252	32%	0.317	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.5	-25.7	-173.4	63.9	0	0	0	0	116.2	S792 R797	S792-T795 PolarHBondContact OG-OG1 3.48Å; T795-R797 WeakPolarHBondContact O-CG 3.3Å; T795-R797 PolarHBondContact O-N 3.09Å
796	G	50.1	Low	57.3	Low	36 Å²	36	58 Å²	58	37%	0.371	30%	0.303	S	S	.	.			trans	58.6	2.1	-179.3	0	0	0	0	0	116	N770	N770-G796 PolarHBondContact ND2-O 3.12Å
797	R	60.1	Low	58.8	Low	47 Å²	47	59.4 Å²	59.4	18%	0.177	31%	0.309	C	S	.	.			trans	-83.3	-39	-175.1	-69.9	-172.4	-170	164.8	10.6	112.4	N651 M769 N770 T795	N651-R797 PolarHBondContact OD1-NH1 2.86Å; M769-R797 CarbonylContact C-O 3.59Å; M769-R797 WeakPolarHBondContact CA-O 3.29Å; N770-R797 PolarHBondContact N-O 2.82Å; T795-R797 WeakPolarHBondContact O-CG 3.3Å; T795-R797 PolarHBondContact O-N 3.09Å
798	L	67.7	Low	60.2	Low	6 Å²	6	56.7 Å²	56.7	3%	0.031	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	131	-175.9	-166.2	87	0	0	0	111.1	L634 I646 V767 I800	L634-L798 HydrophobicContact CD1-CD1 3.59Å; L634-L798 HydrophobicContact CD2-CD1 4.13Å; I646-L798 HydrophobicContact CB-CD2 4.41Å; I646-L798 HydrophobicContact CD1-CD2 4.37Å; I646-L798 HydrophobicContact CG2-CD2 3.94Å; V767-L798 HydrophobicContact CG1-CD1 3.85Å; L798-I800 HydrophobicContact CD2-CD1 3.74Å; L798-I800 HydrophobicContact CD2-CG1 4.16Å; L798-I800 HydrophobicContact CG-CD1 4.41Å; L798-I800 HydrophobicContact CG-CG1 4.31Å
799	R	66.1	Low	61.1	Low	107 Å²	107	59.5 Å²	59.5	40%	0.404	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	136.3	165.6	-64.3	-179.1	-178.6	-179.2	-1.6	109.7	L768 N770 L791	L768-R799 HydrophobicContact CB-CB 4.19Å; L768-R799 PolarHBondContact N-O 3.49Å; L768-R799 PolarHBondContact O-N 3.3Å; N770-R799 PolarHBondContact ND2-NE 2.94Å; L791-R799 HydrophobicContact CD2-CG 4.1Å
800	I	74.1	Confident	61.8	Low	9 Å²	9	54.2 Å²	54.2	5%	0.046	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	133.2	179.5	-55.5	148	0	0	0	108.3	I646 Y691 W765 L766 V767 L798	I646-I800 HydrophobicContact CD1-CD1 3.21Å; I646-I800 HydrophobicContact CD1-CG1 4.01Å; Y691-I800 HydrophobicContact CD1-CD1 3.32Å; Y691-I800 HydrophobicContact CD2-CD1 4.41Å; Y691-I800 HydrophobicContact CE1-CD1 3.43Å; Y691-I800 VanDerWaalsContact CE1-CD1 3.43Å; Y691-I800 HydrophobicContact CG-CD1 3.84Å; W765-I800 HydrophobicContact CB-CG2 4.18Å; W765-I800 HydrophobicContact CD2-CG2 4.29Å; W765-I800 HydrophobicContact CE3-CG2 3.63Å; W765-I800 HydrophobicContact CZ3-CG2 4.26Å; L766-I800 CarbonylContact O-C 3.48Å; L766-I800 WeakPolarHBondContact O-CA 3.31Å; V767-I800 HydrophobicContact CG1-CG1 4.46Å; V767-I800 HydrophobicContact CG2-CG1 4.42Å; L798-I800 HydrophobicContact CD2-CD1 3.74Å; L798-I800 HydrophobicContact CD2-CG1 4.16Å; L798-I800 HydrophobicContact CG-CD1 4.41Å; L798-I800 HydrophobicContact CG-CG1 4.31Å
801	I	74.6	Confident	61.6	Low	81 Å²	81	55.9 Å²	55.9	42%	0.415	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	126.1	-176.6	-56.9	173.2	0	0	0	108.3	W765 L766 L768 L803	W765-I801 CarbonylContact C-O 3.52Å; W765-I801 VanDerWaalsContact CA-O 3.3Å; W765-I801 WeakPolarHBondContact CA-O 3.16Å; L766-I801 HydrophobicContact CB-CB 4.44Å; L766-I801 PolarHBondContact N-O 2.95Å; L766-I801 PolarHBondContact O-N 3.23Å; L768-I801 HydrophobicContact CD1-CD1 3.85Å; I801-L803 PolarHBondContact O-N 2.77Å
802	R	78.1	Confident	61.6	Low	47 Å²	47	61.3 Å²	61.3	18%	0.177	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	118.5	171.7	-159.5	-176.5	-160.2	177.8	18.4	108.9	Q717 H718 L764 W765	Q717-R802 PolarHBondContact O-NH1 3.33Å; H718-R802 PolarHBondContact O-NH2 2.67Å; L764-R802 CarbonylContact O-C 3.58Å; W765-R802 HydrophobicContact CD2-CB 4.11Å; W765-R802 HydrophobicContact CD2-CG 4.04Å; W765-R802 HydrophobicContact CE3-CB 3.6Å; W765-R802 HydrophobicContact CE3-CG 4.05Å; W765-R802 HydrophobicContact CH2-CB 4.2Å; W765-R802 HydrophobicContact CH2-CG 4.32Å; W765-R802 HydrophobicContact CZ2-CG 4.19Å; W765-R802 HydrophobicContact CZ3-CB 3.68Å; W765-R802 HydrophobicContact CZ3-CG 4.21Å
803	L	78.3	Confident	61.3	Low	36 Å²	36	64.2 Å²	64.2	19%	0.188	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	-40.2	179.3	-66.6	-178.2	0	0	0	112.5	V287 Q752 L764 L766 I801	V287-L803 HydrophobicContact CG2-CD2 4.36Å; Q752-L803 HydrophobicContact CG-CD1 4.24Å; L764-L803 HydrophobicContact CB-CB 4.43Å; L764-L803 HydrophobicContact CD2-CB 3.97Å; L764-L803 HydrophobicContact CD2-CD1 3.97Å; L764-L803 HydrophobicContact CG-CB 4.12Å; L764-L803 HydrophobicContact CG-CD1 4.19Å; L764-L803 PolarHBondContact O-N 2.91Å; L766-L803 HydrophobicContact CB-CD1 3.85Å; L766-L803 HydrophobicContact CB-CD2 4Å; L766-L803 HydrophobicContact CB-CG 3.82Å; L766-L803 HydrophobicContact CD2-CD2 4.37Å; I801-L803 PolarHBondContact O-N 2.77Å
804	L	77.9	Confident	61.1	Low	19 Å²	19	68.3 Å²	68.3	10%	0.099	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	145.8	-173.8	-175.9	66.6	0	0	0	110.1	S763 L764 I806 R870 P872	S763-L804 WeakPolarHBondContact CA-O 3.19Å; L764-L804 HydrophobicContact CB-CB 3.87Å; L764-L804 HydrophobicContact CD2-CB 4.3Å; L764-L804 PolarHBondContact N-O 2.82Å; L764-L804 PolarHBondContact O-N 3.39Å; L804-I806 HydrophobicContact CD2-CD1 3.73Å; L804-I806 HydrophobicContact CD2-CG1 3.69Å; L804-I806 HydrophobicContact CG-CD1 4.46Å; L804-I806 HydrophobicContact CG-CG1 3.87Å; L804-R870 VanDerWaalsContact CD2-O 3.23Å; L804-R870 WeakPolarHBondContact CD2-O 3.39Å; L804-P872 HydrophobicContact CD1-CG 4Å
805	F	82.7	Confident	60.8	Low	83 Å²	83	71 Å²	71	36%	0.364	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	118.4	166.7	-177.7	-115.7	0	0	0	108.8	H720 N761 I762 E807	H720-F805 AromaticContact CE1-CE2 3.84Å; N761-F805 HydrophobicContact CB-CE2 3.6Å; N761-F805 HydrophobicContact CB-CZ 3.67Å; I762-F805 CarbonylContact O-C 3.54Å; I762-F805 WeakPolarHBondContact O-CA 3.24Å; F805-E807 HydrophobicContact CE1-CB 4.21Å
806	I	78.9	Confident	60	Low	24 Å²	24	73 Å²	73	12%	0.123	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	110.2	177.2	-54.4	177.7	0	0	0	106.7	N761 I762 L804 F856	N761-I806 CarbonylContact C-O 3.56Å; N761-I806 WeakPolarHBondContact CA-O 3.46Å; N761-I806 WeakPolarHBondContact CB-O 3.41Å; I762-I806 HydrophobicContact CB-CB 4.33Å; I762-I806 PolarHBondContact N-O 2.96Å; I762-I806 PolarHBondContact O-N 2.88Å; L804-I806 HydrophobicContact CD2-CD1 3.73Å; L804-I806 HydrophobicContact CD2-CG1 3.69Å; L804-I806 HydrophobicContact CG-CD1 4.46Å; L804-I806 HydrophobicContact CG-CG1 3.87Å; I806-F856 HydrophobicContact CD1-CD2 4.35Å; I806-F856 HydrophobicContact CD1-CE2 3.83Å
807	E	76.3	Confident	59	Low	128 Å²	128	76.3 Å²	76.3	60%	0.598	39%	0.393	S	S	*	.			trans	-81.7	127.1	174.2	-167.4	-177.4	-178.1	0	0	109.9	N761 F805 K809	N761-E807 WeakPolarHBondContact OD1-CA 3.12Å; N761-E807 WeakPolarHBondContact OD1-CG 3.02Å; F805-E807 HydrophobicContact CE1-CB 4.21Å; E807-K809 PolarHBondContact O-N 3.4Å
808	Y	69.5	Low	57.9	Low	29 Å²	29	79.1 Å²	79.1	11%	0.114	42%	0.42	C	S	.	.			trans	-79.5	103.1	174.3	-178.6	-107.3	0	0	0	109.8	G760 N761 S810 I866	G760-Y808 WeakPolarHBondContact O-CB 3.24Å; N761-Y808 PolarHBondContact OD1-N 2.91Å; Y808-S810 PolarHBondContact O-N 3.26Å; Y808-I866 HydrophobicContact CD2-CD1 4.42Å; Y808-I866 HydrophobicContact CE1-CD1 4.47Å; Y808-I866 HydrophobicContact CE2-CD1 3.49Å; Y808-I866 VanDerWaalsContact CE2-CD1 3.49Å; Y808-I866 HydrophobicContact CE2-CG2 4.49Å; Y808-I866 VanDerWaalsContact OH-CD1 3.29Å; Y808-I866 WeakPolarHBondContact OH-CD1 3Å
809	K	57.7	Low	56.4	Low	167 Å²	167	82.8 Å²	82.8	73%	0.726	44%	0.439	S	S	*	.			trans	-77.2	102	167.1	-67.5	-176.1	-178.4	177.9	0	107.9	E807 T811	E807-K809 PolarHBondContact O-N 3.4Å; K809-T811 PolarHBondContact O-N 3.09Å
810	S	52.3	Low	54.7	Low	47 Å²	47	79.8 Å²	79.8	33%	0.329	44%	0.441	S	S	.	.			trans	-49.5	105.6	171.7	-175.3	0	0	0	0	109.3	Y808 Q812	Y808-S810 PolarHBondContact O-N 3.26Å; S810-Q812 PolarHBondContact O-N 2.9Å
811	T	41	Very low	52.7	Low	92 Å²	92	87.4 Å²	87.4	56%	0.564	48%	0.477	S	S	*	.			trans	-67.5	122	166.9	50.9	0	0	0	0	106.1	K809 I813	K809-T811 PolarHBondContact O-N 3.09Å; T811-I813 PolarHBondContact O-N 3.12Å
812	Q	39.1	Very low	50.7	Low	175 Å²	175	89.7 Å²	89.7	82%	0.818	49%	0.49	S	S	*	.			trans	-55.1	105.8	167.6	-75.5	179.4	-7.3	0	0	107.6	S810 N814	S810-Q812 PolarHBondContact O-N 2.9Å; Q812-N814 PolarHBondContact O-N 2.79Å
813	I	38	Very low	48.6	Very low	67 Å²	67	90.9 Å²	90.9	34%	0.344	51%	0.505	S	S	.	.			trans	-78.3	111.5	175.2	-65.8	154.9	0	0	0	105.8	T811 I815 V843	T811-I813 PolarHBondContact O-N 3.12Å; I813-I815 VanDerWaalsContact C-N 3.34Å; I813-I815 PolarHBondContact O-N 2.82Å; I813-V843 HydrophobicContact CD1-CG2 4.24Å
814	N	32.1	Very low	46.6	Very low	150 Å²	150	94.6 Å²	94.6	80%	0.802	53%	0.525	S	S	*	.			trans	-61.3	99.1	166.9	-77.1	-24.7	0	0	0	107.9	Q812 P816	Q812-N814 PolarHBondContact O-N 2.79Å; N814-P816 WeakPolarHBondContact O-CD 3.32Å
815	I	33.3	Very low	44.3	Very low	99 Å²	99	101.2 Å²	101.2	51%	0.508	55%	0.553	S	S	.	*			trans	-58.1	125.1	168.6	-58.1	170.5	0	0	0	105.9	I813 A817 L819	I813-I815 VanDerWaalsContact C-N 3.34Å; I813-I815 PolarHBondContact O-N 2.82Å; I815-A817 PolarHBondContact O-N 2.85Å; I815-L819 HydrophobicContact CG2-CB 4.08Å
816	P	31.3	Very low	41.8	Very low	84 Å²	84	102.2 Å²	102.2	55%	0.545	57%	0.569	S	S	.	*			trans	-55.4	128.7	174.1	-19.2	29	0	0	0	108.4	N814 S818 L819	N814-P816 WeakPolarHBondContact O-CD 3.32Å; P816-S818 PolarHBondContact O-N 3.44Å; P816-L819 PolarHBondContact O-N 3.14Å
817	A	30.6	Very low	39.6	Very low	106 Å²	106	110.1 Å²	110.1	88%	0.876	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.8	-6.3	-178	0	0	0	0	0	114.4	I815	I815-A817 PolarHBondContact O-N 2.85Å
818	S	36.7	Very low	37.6	Very low	106 Å²	106	109 Å²	109	74%	0.741	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.2	-16.3	172.4	59.3	0	0	0	0	114.9	P816 G820	P816-S818 PolarHBondContact O-N 3.44Å; S818-G820 PolarHBondContact O-N 2.82Å
819	L	35.5	Very low	35.6	Very low	83 Å²	83	116.3 Å²	116.3	44%	0.435	64%	0.638	S	S	.	*	S	Bend	trans	-92.2	81.9	166.2	-85.7	94.8	0	0	0	109	I815 P816	I815-L819 HydrophobicContact CG2-CB 4.08Å; P816-L819 PolarHBondContact O-N 3.14Å
820	G	29.9	Very low	34.4	Very low	44 Å²	44	117.3 Å²	117.3	45%	0.454	65%	0.645	S	S	.	*			trans	-57.5	142.8	176.7	0	0	0	0	0	111.9	S818 N822 S823	S818-G820 PolarHBondContact O-N 2.82Å; G820-N822 PolarHBondContact O-N 2.82Å; G820-S823 PolarHBondContact O-N 2.92Å; G820-S823 PolarHBondContact O-OG 2.7Å
821	E	33.2	Very low	33.3	Very low	169 Å²	169	121.4 Å²	121.4	79%	0.79	66%	0.663	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.8	-11.9	-178.2	-67.7	176.4	145.6	0	0	115.8
822	N	32.7	Very low	32.7	Very low	128 Å²	128	125.6 Å²	125.6	68%	0.684	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.3	-19.5	179	-67	-21.6	0	0	0	114.4	G820	G820-N822 PolarHBondContact O-N 2.82Å
823	S	33.6	Very low	32.3	Very low	73 Å²	73	126.9 Å²	126.9	51%	0.51	68%	0.679	S	S	.	*	S	Bend	trans	-82.2	-18.5	176.6	57.1	0	0	0	0	113.7	G820	G820-S823 PolarHBondContact O-N 2.92Å; G820-S823 PolarHBondContact O-OG 2.7Å
824	L	36.3	Very low	31.7	Very low	114 Å²	114	130.5 Å²	130.5	60%	0.597	70%	0.7	S	S	*	*	S	Bend	trans	-88	-10.7	177.8	-72	164.3	0	0	0	113.2	I828	L824-I828 WeakPolarHBondContact O-CD1 3.04Å
825	K	30.2	Very low	31.8	Very low	157 Å²	157	128 Å²	128	68%	0.683	69%	0.686	S	S	*	*	S	Bend	trans	-81.3	-20.2	174.2	-89	179.2	174.1	172.9	0	113.6	Q827	K825-Q827 PolarHBondContact O-N 2.84Å
826	C	29.5	Very low	31.7	Very low	105 Å²	105	126.7 Å²	126.7	71%	0.709	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.3	60	-173.7	-64.2	0	0	0	0	112.5
827	Q	32.6	Very low	31.7	Very low	189 Å²	189	129.6 Å²	129.6	88%	0.883	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-166.1	12.5	162.2	-110.4	169.1	23	0	0	113.3	K825	K825-Q827 PolarHBondContact O-N 2.84Å
828	I	34.5	Very low	31.7	Very low	105 Å²	105	136 Å²	136	54%	0.538	70%	0.698	S	S	.	*			trans	-103.3	-4.2	-167.5	-62.5	173.8	0	0	0	112.6	L824	L824-I828 WeakPolarHBondContact O-CD1 3.04Å
829	E	27	Very low	31.5	Very low	183 Å²	183	134.7 Å²	134.7	86%	0.855	68%	0.682	S	S	*	*	S	Bend	trans	-106	83.7	-179.6	-67.3	-177.2	173.7	0	0	110.6
830	E	33.2	Very low	31.4	Very low	187 Å²	187	138.2 Å²	138.2	87%	0.874	70%	0.701	S	S	*	*	S	Bend	trans	-166.6	-17.8	154.6	-111.3	165.6	-150.8	0	0	114.7
831	N	29.3	Very low	32.3	Very low	133 Å²	133	142.9 Å²	142.9	71%	0.711	72%	0.716	S	S	*	*	S	Bend	trans	-127.1	120.6	172	-67.9	-45.8	0	0	0	109.3	W833	N831-W833 PolarHBondContact O-N 3.37Å
832	N	28	Very low	33.6	Very low	181 Å²	181	139.6 Å²	139.6	97%	0.968	70%	0.699	S	S	*	*			trans	-60.2	37.8	-176.1	-101.4	-16.2	0	0	0	116
833	W	30.1	Very low	35.4	Very low	201 Å²	201	134.4 Å²	134.4	76%	0.761	67%	0.672	S	S	*	*			trans	-97.5	94.4	173.7	-64.8	77.9	0	0	0	108.9	N831 L835	N831-W833 PolarHBondContact O-N 3.37Å; W833-L835 HydrophobicContact CB-CD1 4.05Å; W833-L835 HydrophobicContact CE3-CD1 4.23Å; W833-L835 PolarHBondContact O-N 3.11Å
834	N	25.7	Very low	37.8	Very low	144 Å²	144	134.3 Å²	134.3	77%	0.77	67%	0.665	S	S	*	*			trans	-68.5	68.4	167.7	-98.7	-26.6	0	0	0	110.4	S836	N834-S836 VanDerWaalsContact C-N 3.35Å
835	L	33.7	Very low	40.2	Very low	97 Å²	97	129 Å²	129	51%	0.508	64%	0.638	S	S	.	*			trans	-85	-8.6	174.2	-97.7	148.2	0	0	0	112.7	W833 N837 L839	W833-L835 HydrophobicContact CB-CD1 4.05Å; W833-L835 HydrophobicContact CE3-CD1 4.23Å; W833-L835 PolarHBondContact O-N 3.11Å; L835-N837 VanDerWaalsContact C-N 3.26Å; L835-N837 PolarHBondContact O-N 2.87Å; L835-L839 HydrophobicContact CB-CD1 4.41Å; L835-L839 HydrophobicContact CD2-CD1 3.8Å
836	S	32	Very low	43	Very low	71 Å²	71	123.6 Å²	123.6	50%	0.497	62%	0.618	S	S	.	*	T	Hydrogen-bonded Turn	trans	-66.7	-18.8	-178.3	51.4	0	0	0	0	114.6	N834	N834-S836 VanDerWaalsContact C-N 3.35Å
837	N	30.7	Very low	45.9	Very low	145 Å²	145	119.3 Å²	119.3	78%	0.775	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.9	4.5	-173.7	-75.2	-8.5	0	0	0	115.5	L835	L835-N837 VanDerWaalsContact C-N 3.26Å; L835-N837 PolarHBondContact O-N 2.87Å
838	R	31.9	Very low	48.8	Very low	240 Å²	240	110.6 Å²	110.6	91%	0.906	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.3	-11.4	172.1	-82.6	-168.5	179.4	-166.5	1.3	115.2	N840	R838-N840 PolarHBondContact O-N 2.77Å
839	L	32.9	Very low	51.5	Low	79 Å²	79	105.8 Å²	105.8	41%	0.414	52%	0.524	S	S	.	.			trans	-94.4	78	177	-80.3	150.2	0	0	0	110.5	L835 N841 K842 I844	L835-L839 HydrophobicContact CB-CD1 4.41Å; L835-L839 HydrophobicContact CD2-CD1 3.8Å; L839-N841 PolarHBondContact O-N 2.68Å; L839-K842 HydrophobicContact CD2-CB 4.37Å; L839-I844 HydrophobicContact CD2-CD1 4.4Å
840	N	33.2	Very low	54.5	Low	157 Å²	157	98.4 Å²	98.4	84%	0.84	49%	0.49	S	S	*	.	S	Bend	trans	-60.1	97.3	161.3	-86	-15	0	0	0	108.6	R838 K842	R838-N840 PolarHBondContact O-N 2.77Å; N840-K842 PolarHBondContact O-N 2.87Å
841	N	49	Very low	57	Low	142 Å²	142	90.1 Å²	90.1	76%	0.759	45%	0.452	S	S	*	.	S	Bend	trans	38.6	35.6	167.6	-72.5	-6.1	0	0	0	116.9	L839	L839-N841 PolarHBondContact O-N 2.68Å
842	K	59.4	Low	59.4	Low	100 Å²	100	88.8 Å²	88.8	44%	0.435	44%	0.44	S	S	.	.			trans	-97.3	111.3	-175.6	-152.2	175.1	-176.6	-173.9	0	109.3	I759 L839 N840 I844	I759-K842 VanDerWaalsContact CG2-NZ 3.35Å; L839-K842 HydrophobicContact CD2-CB 4.37Å; N840-K842 PolarHBondContact O-N 2.87Å; K842-I844 PolarHBondContact O-N 2.84Å
843	V	70.1	Confident	61.7	Low	19 Å²	19	85.6 Å²	85.6	12%	0.115	42%	0.423	C	S	.	.	P	Polyproline II helix	trans	-67.1	128.1	174.1	-179.7	0	0	0	0	108.3	I813 C860 N862	I813-V843 HydrophobicContact CD1-CG2 4.24Å; V843-C860 HydrophobicContact CG1-CB 3.46Å; V843-C860 VanDerWaalsContact CG1-CB 3.46Å; V843-N862 WeakPolarHBondContact CG2-ND2 3.42Å
844	I	83.8	Confident	64.1	Low	71 Å²	71	76.2 Å²	76.2	36%	0.364	39%	0.388	S	S	.	.	P	Polyproline II helix	trans	-94	134.5	178.2	-61.6	172.4	0	0	0	108.1	L839 K842 C860 S861	L839-I844 HydrophobicContact CD2-CD1 4.4Å; K842-I844 PolarHBondContact O-N 2.84Å; I844-C860 WeakPolarHBondContact O-CA 3.35Å; I844-S861 PolarHBondContact N-OG 3.02Å; I844-S861 PolarHBondContact O-N 3.08Å; I844-S861 PolarHBondContact O-OG 2.95Å
845	T	88.5	Confident	67	Low	4 Å²	4	70.1 Å²	70.1	3%	0.025	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.6	146.6	173.6	55.1	0	0	0	0	110.4	I725 D757 E758 I858 G859	I725-T845 WeakPolarHBondContact CD1-O 3.15Å; I725-T845 WeakPolarHBondContact CD1-OG1 3.31Å; D757-T845 PolarHBondContact O-OG1 2.92Å; E758-T845 WeakPolarHBondContact CA-OG1 3.23Å; E758-T845 PolarHBondContact O-N 3.38Å; E758-T845 VanDerWaalsContact O-N 3.1Å; E758-T845 PolarHBondContact O-OG1 3.36Å; E758-T845 VanDerWaalsContact O-OG1 3.11Å; T845-I858 HydrophobicContact CG2-CG2 3.49Å; T845-I858 VanDerWaalsContact CG2-CG2 3.49Å; T845-G859 WeakPolarHBondContact CA-O 3.42Å
846	T	88.2	Confident	69.7	Low	43 Å²	43	65.6 Å²	65.6	26%	0.264	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	-32.3	-170.9	52.8	0	0	0	0	113.2	G859 V890	T846-G859 PolarHBondContact N-O 3.43Å; T846-G859 PolarHBondContact OG1-O 3.46Å; T846-V890 WeakPolarHBondContact CB-O 3.46Å; T846-V890 PolarHBondContact OG1-O 3.02Å
847	C	90.9	Very high	72.5	Confident	15 Å²	15	62.2 Å²	62.2	10%	0.101	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	159.6	179.6	56.2	0	0	0	0	112	G859	C847-G859 PolarHBondContact O-N 3.39Å
848	L	92.9	Very high	75.5	Confident	5 Å²	5	55.4 Å²	55.4	3%	0.026	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	133.9	178	-178.1	68.4	0	0	0	110.3	K728 L756 I762 F856 L857 I858	K728-L848 HydrophobicContact CB-CD2 4.39Å; K728-L848 WeakPolarHBondContact CE-O 3.2Å; K728-L848 HydrophobicContact CG-CD2 4.13Å; L756-L848 HydrophobicContact CB-CB 4.4Å; L756-L848 HydrophobicContact CB-CD2 4.11Å; L756-L848 HydrophobicContact CD2-CB 3.75Å; L756-L848 HydrophobicContact CD2-CD1 4.3Å; L756-L848 HydrophobicContact CD2-CG 4.47Å; I762-L848 HydrophobicContact CD1-CD1 4.5Å; L848-F856 HydrophobicContact CD1-CB 4.27Å; L848-L857 WeakPolarHBondContact CA-O 3.4Å; L848-I858 HydrophobicContact CD1-CG1 4.07Å
849	A	91.4	Very high	78.3	Confident	5 Å²	5	44 Å²	44	4%	0.041	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.7	151.8	163.8	0	0	0	0	0	110.8	L857 L893 T895	A849-L857 HydrophobicContact CB-CB 4.34Å; A849-L857 PolarHBondContact N-O 3.42Å; A849-L857 PolarHBondContact O-N 3.02Å; A849-L893 HydrophobicContact CB-CB 3.72Å; A849-T895 HydrophobicContact CB-CG2 4.12Å
850	I	89.4	Confident	81	Confident	28 Å²	28	40.2 Å²	40.2	14%	0.144	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	127.3	178.6	-54.3	165.8	0	0	0	107.5	K728 L754 F856 T895	K728-I850 HydrophobicContact CB-CD1 3.57Å; K728-I850 HydrophobicContact CB-CG1 4.43Å; K728-I850 HydrophobicContact CG-CD1 4.37Å; L754-I850 HydrophobicContact CD1-CD1 3.39Å; L754-I850 HydrophobicContact CD1-CG1 4.13Å; I850-F856 HydrophobicContact CG1-CD1 4.35Å; I850-T895 WeakPolarHBondContact O-CG2 3.4Å; I850-T895 PolarHBondContact O-OG1 3.02Å
851	T	86.4	Confident	83.6	Confident	12 Å²	12	35 Å²	35	7%	0.074	19%	0.185	C	C	.	.			trans	-73.2	154.6	172.5	65.2	0	0	0	0	109.9	L853 G854 N855 L857 T895 T918	T851-L853 PolarHBondContact O-N 3.26Å; T851-G854 WeakPolarHBondContact O-CA 3.17Å; T851-G854 PolarHBondContact O-N 2.95Å; T851-N855 HydrophobicContact CG2-CB 4.35Å; T851-N855 PolarHBondContact N-O 3.22Å; T851-N855 WeakPolarHBondContact OG1-CA 3.06Å; T851-N855 VanDerWaalsContact OG1-CB 3.32Å; T851-N855 WeakPolarHBondContact OG1-CB 3.4Å; T851-N855 PolarHBondContact OG1-N 2.86Å; T851-N855 PolarHBondContact OG1-O 3.31Å; T851-N855 VanDerWaalsContact OG1-O 3.12Å; T851-L857 HydrophobicContact CG2-CD1 3.83Å; T851-L857 HydrophobicContact CG2-CG 4.02Å; T851-T895 HydrophobicContact CG2-CG2 4.25Å; T851-T918 HydrophobicContact CG2-CG2 4.37Å
852	K	80.2	Confident	85.2	Confident	105 Å²	105	30.2 Å²	30.2	46%	0.457	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-13.5	175.2	-74	-72.4	-180	179.1	0	114.2	D731 G854 A899	D731-K852 IonicContact OD2-NZ 3.76Å; D731-K852 PolarHBondContact OD2-NZ 3.01Å; K852-G854 VanDerWaalsContact C-N 3.32Å; K852-A899 HydrophobicContact CB-CB 3.6Å; K852-A899 HydrophobicContact CG-CB 4.06Å
853	L	75.3	Confident	86.4	Confident	115 Å²	115	25.6 Å²	25.6	60%	0.602	14%	0.14	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-2.7	171.7	-62.3	177.7	0	0	0	113.2	T851	T851-L853 PolarHBondContact O-N 3.26Å
854	G	81.1	Confident	87.3	Confident	4 Å²	4	26.1 Å²	26.1	4%	0.041	14%	0.141	C	C	.	.	S	Bend	trans	87.4	2	-179.1	0	0	0	0	0	115.3	T851 K852	T851-G854 WeakPolarHBondContact O-CA 3.17Å; T851-G854 PolarHBondContact O-N 2.95Å; K852-G854 VanDerWaalsContact C-N 3.32Å
855	N	86.3	Confident	87.6	Confident	15 Å²	15	22.8 Å²	22.8	8%	0.08	12%	0.124	C	C	.	.			trans	-75.4	148.9	174.7	-55.7	-24.6	0	0	0	111.2	T851 H868 Q874	T851-N855 HydrophobicContact CG2-CB 4.35Å; T851-N855 PolarHBondContact N-O 3.22Å; T851-N855 WeakPolarHBondContact OG1-CA 3.06Å; T851-N855 VanDerWaalsContact OG1-CB 3.32Å; T851-N855 WeakPolarHBondContact OG1-CB 3.4Å; T851-N855 PolarHBondContact OG1-N 2.86Å; T851-N855 PolarHBondContact OG1-O 3.31Å; T851-N855 VanDerWaalsContact OG1-O 3.12Å; N855-H868 CarbonylContact C-O 3.59Å; N855-H868 WeakPolarHBondContact CA-O 3.43Å; N855-H868 WeakPolarHBondContact CB-O 3.22Å; N855-Q874 PolarHBondContact OD1-NE2 2.95Å
856	F	89.8	Confident	87.6	Confident	2 Å²	2	23 Å²	23	1%	0.009	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	132.2	-179.1	-48.5	-46.2	0	0	0	111.1	L754 I762 I806 L848 I850 H867 H868 G869 R870	L754-F856 HydrophobicContact CD1-CD1 4.18Å; L754-F856 HydrophobicContact CD1-CE1 3.43Å; L754-F856 VanDerWaalsContact CD1-CE1 3.43Å; L754-F856 HydrophobicContact CD1-CZ 4.12Å; L754-F856 HydrophobicContact CD2-CE1 3.95Å; L754-F856 HydrophobicContact CD2-CZ 3.83Å; L754-F856 HydrophobicContact CG-CE1 4.36Å; I762-F856 HydrophobicContact CD1-CB 4.04Å; I762-F856 HydrophobicContact CD1-CD2 3.72Å; I762-F856 HydrophobicContact CD1-CE2 4.43Å; I762-F856 HydrophobicContact CD1-CG 3.97Å; I762-F856 HydrophobicContact CG2-CE2 4.46Å; I806-F856 HydrophobicContact CD1-CD2 4.35Å; I806-F856 HydrophobicContact CD1-CE2 3.83Å; L848-F856 HydrophobicContact CD1-CB 4.27Å; I850-F856 HydrophobicContact CG1-CD1 4.35Å; F856-H867 WeakPolarHBondContact O-CA 3.49Å; F856-H868 HydrophobicContact CB-CB 4.33Å; F856-H868 HydrophobicContact CD2-CB 4.35Å; F856-H868 PolarHBondContact N-O 3.43Å; F856-H868 PolarHBondContact O-N 2.77Å; F856-G869 WeakPolarHBondContact CD2-O 3.42Å; F856-G869 WeakPolarHBondContact CE2-O 3.25Å; F856-R870 HydrophobicContact CZ-CB 4.38Å; F856-R870 HydrophobicContact CZ-CG 4.11Å
857	L	92	Very high	87.7	Confident	1 Å²	1	21.3 Å²	21.3	1%	0.005	11%	0.114	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	117.7	170.2	-63.3	172.8	0	0	0	108.1	L848 A849 T851 I865 I866 H867 F881 L893 T895 F904	L848-L857 WeakPolarHBondContact CA-O 3.4Å; A849-L857 HydrophobicContact CB-CB 4.34Å; A849-L857 PolarHBondContact N-O 3.42Å; A849-L857 PolarHBondContact O-N 3.02Å; T851-L857 HydrophobicContact CG2-CD1 3.83Å; T851-L857 HydrophobicContact CG2-CG 4.02Å; L857-I865 HydrophobicContact CB-CG2 4.32Å; L857-I865 HydrophobicContact CD2-CG2 4.48Å; L857-I866 CarbonylContact C-O 3.58Å; L857-I866 WeakPolarHBondContact CA-O 3.41Å; L857-H867 HydrophobicContact CD2-CB 4.19Å; L857-F881 HydrophobicContact CD2-CD2 4.45Å; L857-F881 HydrophobicContact CD2-CE2 3.75Å; L857-L893 HydrophobicContact CB-CD1 4.34Å; L857-T895 HydrophobicContact CD1-CG2 3.87Å; L857-F904 HydrophobicContact CD1-CB 4.15Å; L857-F904 HydrophobicContact CD1-CD1 3.79Å; L857-F904 HydrophobicContact CD1-CD2 3.99Å; L857-F904 HydrophobicContact CD1-CE1 4.1Å; L857-F904 HydrophobicContact CD1-CE2 4.29Å; L857-F904 HydrophobicContact CD1-CG 3.71Å; L857-F904 HydrophobicContact CD1-CZ 4.33Å; L857-F904 HydrophobicContact CD2-CE1 4.4Å; L857-F904 HydrophobicContact CD2-CZ 4.41Å
858	I	92.1	Very high	87.5	Confident	1 Å²	1	23.5 Å²	23.5	1%	0.005	12%	0.122	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	118.3	-175.7	-52.5	173.2	0	0	0	108.4	L756 I762 T845 L848 I865 I866	L756-I858 HydrophobicContact CD1-CD1 4.42Å; L756-I858 HydrophobicContact CD1-CG2 4.48Å; L756-I858 HydrophobicContact CD2-CG2 4.02Å; I762-I858 HydrophobicContact CD1-CD1 3.69Å; I762-I858 HydrophobicContact CD1-CG1 4.29Å; I762-I858 HydrophobicContact CG1-CD1 4.43Å; T845-I858 HydrophobicContact CG2-CG2 3.49Å; T845-I858 VanDerWaalsContact CG2-CG2 3.49Å; L848-I858 HydrophobicContact CD1-CG1 4.07Å; I858-I865 CarbonylContact O-C 3.52Å; I858-I865 VanDerWaalsContact O-CA 3.26Å; I858-I865 WeakPolarHBondContact O-CA 3.34Å; I858-I866 HydrophobicContact CB-CB 4.27Å; I858-I866 PolarHBondContact N-O 3.23Å; I858-I866 PolarHBondContact O-N 3.18Å
859	G	91.3	Very high	86.9	Confident	0 Å²	0	23.5 Å²	23.5	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.7	143.9	172.9	0	0	0	0	0	110.9	T845 T846 C847 L893	T845-G859 WeakPolarHBondContact CA-O 3.42Å; T846-G859 PolarHBondContact N-O 3.43Å; T846-G859 PolarHBondContact OG1-O 3.46Å; C847-G859 PolarHBondContact O-N 3.39Å; G859-L893 VanDerWaalsContact N-CD1 3.33Å
860	C	90.1	Very high	86.2	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	156.1	-178.6	-66.8	0	0	0	0	112.8	V843 I844 N862 G863 Q864 I866 V890	V843-C860 HydrophobicContact CG1-CB 3.46Å; V843-C860 VanDerWaalsContact CG1-CB 3.46Å; I844-C860 WeakPolarHBondContact O-CA 3.35Å; C860-N862 WeakPolarHBondContact CB-OD1 3.23Å; C860-N862 PolarHBondContact O-N 2.74Å; C860-G863 PolarHBondContact O-N 3.44Å; C860-G863 VanDerWaalsContact O-N 3.11Å; C860-Q864 WeakPolarHBondContact CB-O 3.38Å; C860-Q864 PolarHBondContact N-O 3.17Å; C860-I866 VanDerWaalsContact SG-CD1 3.51Å; C860-V890 PolarHBondContact O-N 3.29Å; C860-V890 VanDerWaalsContact O-N 3.09Å
861	S	88.2	Confident	85.5	Confident	47 Å²	47	26.1 Å²	26.1	33%	0.329	14%	0.135	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.6	-19.7	178.6	62.7	0	0	0	0	114	I844 G863 A889	I844-S861 PolarHBondContact N-OG 3.02Å; I844-S861 PolarHBondContact O-N 3.08Å; I844-S861 PolarHBondContact O-OG 2.95Å; S861-G863 VanDerWaalsContact C-N 3.31Å; S861-A889 WeakPolarHBondContact O-CA 3.18Å; S861-A889 WeakPolarHBondContact O-CB 3.32Å
862	N	82.3	Confident	84.7	Confident	43 Å²	43	29 Å²	29	23%	0.23	15%	0.154	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	3.6	176	68.8	-6.9	0	0	0	113.7	V843 C860 Q864 C887	V843-N862 WeakPolarHBondContact CG2-ND2 3.42Å; C860-N862 WeakPolarHBondContact CB-OD1 3.23Å; C860-N862 PolarHBondContact O-N 2.74Å; N862-Q864 PolarHBondContact ND2-OE1 3.38Å; N862-Q864 WeakPolarHBondContact OD1-CB 3.44Å; N862-Q864 PolarHBondContact OD1-N 3.23Å; N862-Q864 VanDerWaalsContact OD1-N 3.08Å; N862-C887 CarbonylContact C-O 3.6Å; N862-C887 WeakPolarHBondContact O-CA 3.4Å
863	G	84.3	Confident	84.2	Confident	2 Å²	2	30 Å²	30	2%	0.021	17%	0.165	C	C	.	.	S	Bend	trans	84.2	4.4	179.8	0	0	0	0	0	116.1	C860 S861 S888	C860-G863 PolarHBondContact O-N 3.44Å; C860-G863 VanDerWaalsContact O-N 3.11Å; S861-G863 VanDerWaalsContact C-N 3.31Å; G863-S888 WeakPolarHBondContact CA-O 3.26Å; G863-S888 PolarHBondContact N-O 3.34Å
864	Q	88.1	Confident	84.1	Confident	31 Å²	31	28.3 Å²	28.3	15%	0.145	15%	0.154	C	C	.	.			trans	-88.7	155.4	173.6	-60.5	177.7	-19.5	0	0	111.4	C860 N862 L880	C860-Q864 WeakPolarHBondContact CB-O 3.38Å; C860-Q864 PolarHBondContact N-O 3.17Å; N862-Q864 PolarHBondContact ND2-OE1 3.38Å; N862-Q864 WeakPolarHBondContact OD1-CB 3.44Å; N862-Q864 PolarHBondContact OD1-N 3.23Å; N862-Q864 VanDerWaalsContact OD1-N 3.08Å; Q864-L880 HydrophobicContact CB-CD1 3.84Å; Q864-L880 HydrophobicContact CB-CD2 4.47Å; Q864-L880 HydrophobicContact CB-CG 4.28Å; Q864-L880 HydrophobicContact CG-CD1 4.39Å; Q864-L880 HydrophobicContact CG-CD2 4.2Å
865	I	91.1	Very high	83.8	Confident	0 Å²	0	34 Å²	34	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	119.2	173.5	-55	162.7	0	0	0	107.5	L857 I858 L880 F881 V890 L893 F904 A906 Y916	L857-I865 HydrophobicContact CB-CG2 4.32Å; L857-I865 HydrophobicContact CD2-CG2 4.48Å; I858-I865 CarbonylContact O-C 3.52Å; I858-I865 VanDerWaalsContact O-CA 3.26Å; I858-I865 WeakPolarHBondContact O-CA 3.34Å; I865-L880 CarbonylContact O-C 3.54Å; I865-L880 WeakPolarHBondContact O-CA 3.42Å; I865-F881 HydrophobicContact CB-CB 4.11Å; I865-F881 HydrophobicContact CB-CD2 4.24Å; I865-F881 HydrophobicContact CD1-CB 4.48Å; I865-F881 HydrophobicContact CG2-CD2 4.14Å; I865-F881 PolarHBondContact N-O 3.37Å; I865-F881 PolarHBondContact O-N 2.97Å; I865-V890 HydrophobicContact CD1-CG2 4.49Å; I865-V890 HydrophobicContact CG1-CG1 4.32Å; I865-V890 HydrophobicContact CG1-CG2 3.81Å; I865-L893 HydrophobicContact CD1-CD2 3.78Å; I865-L893 HydrophobicContact CG1-CD2 4.2Å; I865-L893 HydrophobicContact CG2-CD1 4.05Å; I865-L893 HydrophobicContact CG2-CD2 4.27Å; I865-F904 HydrophobicContact CD1-CE2 3.98Å; I865-F904 HydrophobicContact CG2-CE2 4.45Å; I865-A906 HydrophobicContact CD1-CB 3.71Å; I865-Y916 HydrophobicContact CD1-CD2 4.22Å; I865-Y916 HydrophobicContact CD1-CE2 3.78Å
866	I	89.2	Confident	83.5	Confident	9 Å²	9	34.2 Å²	34.2	5%	0.046	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.5	135.1	-177.5	-49.2	175.2	0	0	0	108.9	Y808 L857 I858 C860 H868 L880	Y808-I866 HydrophobicContact CD2-CD1 4.42Å; Y808-I866 HydrophobicContact CE1-CD1 4.47Å; Y808-I866 HydrophobicContact CE2-CD1 3.49Å; Y808-I866 VanDerWaalsContact CE2-CD1 3.49Å; Y808-I866 HydrophobicContact CE2-CG2 4.49Å; Y808-I866 VanDerWaalsContact OH-CD1 3.29Å; Y808-I866 WeakPolarHBondContact OH-CD1 3Å; L857-I866 CarbonylContact C-O 3.58Å; L857-I866 WeakPolarHBondContact CA-O 3.41Å; I858-I866 HydrophobicContact CB-CB 4.27Å; I858-I866 PolarHBondContact N-O 3.23Å; I858-I866 PolarHBondContact O-N 3.18Å; C860-I866 VanDerWaalsContact SG-CD1 3.51Å; I866-H868 WeakPolarHBondContact CG2-CD2 3.19Å; I866-H868 VanDerWaalsContact CG2-NE2 3.26Å; I866-H868 WeakPolarHBondContact CG2-NE2 3.36Å; I866-L880 HydrophobicContact CG1-CD1 4.01Å
867	H	90	Very high	83.1	Confident	7 Å²	7	42.9 Å²	42.9	3%	0.032	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	112.2	-179.7	-165	-172.6	0	0	0	110	F856 L857 V876 P878 K879 F881	F856-H867 WeakPolarHBondContact O-CA 3.49Å; L857-H867 HydrophobicContact CD2-CB 4.19Å; H867-V876 WeakPolarHBondContact CE1-CG1 3.38Å; H867-V876 WeakPolarHBondContact ND1-CG1 2.97Å; H867-V876 WeakPolarHBondContact NE2-CG1 3.24Å; H867-P878 WeakPolarHBondContact CB-O 3.47Å; H867-P878 PolarHBondContact ND1-O 2.79Å; H867-K879 PolarHBondContact N-O 3.33Å; H867-F881 HydrophobicContact CB-CD2 4.43Å; H867-F881 HydrophobicContact CB-CE2 3.74Å; H867-F881 AromaticContact CG-CE2 3.86Å; H867-F881 AromaticContact ND1-CE2 3.73Å; H867-F881 AromaticContact ND1-CZ 3.76Å
868	H	85.2	Confident	82.9	Confident	61 Å²	61	43 Å²	43	28%	0.282	22%	0.224	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	144.9	179.8	-82	-73.2	0	0	0	111.7	N855 F856 I866	N855-H868 CarbonylContact C-O 3.59Å; N855-H868 WeakPolarHBondContact CA-O 3.43Å; N855-H868 WeakPolarHBondContact CB-O 3.22Å; F856-H868 HydrophobicContact CB-CB 4.33Å; F856-H868 HydrophobicContact CD2-CB 4.35Å; F856-H868 PolarHBondContact N-O 3.43Å; F856-H868 PolarHBondContact O-N 2.77Å; I866-H868 WeakPolarHBondContact CG2-CD2 3.19Å; I866-H868 VanDerWaalsContact CG2-NE2 3.26Å; I866-H868 WeakPolarHBondContact CG2-NE2 3.36Å
869	G	81	Confident	82.5	Confident	5 Å²	5	49.8 Å²	49.8	5%	0.052	25%	0.254	C	S	.	.			trans	-72.3	167	168.2	0	0	0	0	0	111.6	F856	F856-G869 WeakPolarHBondContact CD2-O 3.42Å; F856-G869 WeakPolarHBondContact CE2-O 3.25Å
870	R	77.8	Confident	82.4	Confident	49 Å²	49	52.7 Å²	52.7	19%	0.185	27%	0.269	C	S	.	.	S	Bend	trans	-72.3	-33.3	179.3	-174	176.6	166.6	91.6	12	112.4	L804 F856	L804-R870 VanDerWaalsContact CD2-O 3.23Å; L804-R870 WeakPolarHBondContact CD2-O 3.39Å; F856-R870 HydrophobicContact CZ-CB 4.38Å; F856-R870 HydrophobicContact CZ-CG 4.11Å
871	T	74.6	Confident	82.3	Confident	40 Å²	40	52.7 Å²	52.7	25%	0.245	27%	0.269	C	S	.	.	S	Bend	trans	-104.6	147.6	174.4	69.7	0	0	0	0	110.2	L289 N873 Q874	L289-T871 HydrophobicContact CD2-CG2 3.73Å; T871-N873 PolarHBondContact O-N 3.26Å; T871-N873 VanDerWaalsContact O-N 3.1Å; T871-Q874 WeakPolarHBondContact O-CB 3.33Å; T871-Q874 PolarHBondContact O-N 3.04Å; T871-Q874 WeakPolarHBondContact OG1-CB 3.38Å; T871-Q874 PolarHBondContact OG1-N 3.13Å
872	P	68.7	Low	82.1	Confident	73 Å²	73	52.1 Å²	52.1	47%	0.474	27%	0.265	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	-31.7	178	-25.1	33.7	0	0	0	113.7	L804	L804-P872 HydrophobicContact CD1-CG 4Å
873	N	69.3	Low	82.1	Confident	126 Å²	126	50.9 Å²	50.9	67%	0.674	26%	0.257	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.8	-8.1	-179	-62.6	-18.9	0	0	0	113.6	T871 T875	T871-N873 PolarHBondContact O-N 3.26Å; T871-N873 VanDerWaalsContact O-N 3.1Å; N873-T875 PolarHBondContact O-N 2.75Å
874	Q	73.3	Confident	81.3	Confident	79 Å²	79	56.4 Å²	56.4	37%	0.369	29%	0.285	S	S	.	.			trans	-82	105	179.2	-178.4	-177.7	8.4	0	0	109.2	N855 T871 V876	N855-Q874 PolarHBondContact OD1-NE2 2.95Å; T871-Q874 WeakPolarHBondContact O-CB 3.33Å; T871-Q874 PolarHBondContact O-N 3.04Å; T871-Q874 WeakPolarHBondContact OG1-CB 3.38Å; T871-Q874 PolarHBondContact OG1-N 3.13Å; Q874-V876 HydrophobicContact CG-CG2 4.18Å
875	T	74.1	Confident	80	Confident	122 Å²	122	61.2 Å²	61.2	75%	0.748	31%	0.311	S	S	*	.			trans	-74.4	130.5	171.8	52.9	0	0	0	0	109.6	N873	N873-T875 PolarHBondContact O-N 2.75Å
876	V	81.1	Confident	78.8	Confident	21 Å²	21	62.9 Å²	62.9	13%	0.127	32%	0.322	C	S	.	.			trans	-122.6	138.1	176.2	-170	0	0	0	0	108.7	H867 Q874 K879	H867-V876 WeakPolarHBondContact CE1-CG1 3.38Å; H867-V876 WeakPolarHBondContact ND1-CG1 2.97Å; H867-V876 WeakPolarHBondContact NE2-CG1 3.24Å; Q874-V876 HydrophobicContact CG-CG2 4.18Å; V876-K879 VanDerWaalsContact O-CG 3.28Å; V876-K879 WeakPolarHBondContact O-CG 3.4Å
877	Y	81.5	Confident	77.8	Confident	183 Å²	183	66.7 Å²	66.7	72%	0.718	35%	0.348	S	S	*	.	S	Bend	trans	-125.8	137.1	179.6	-174.5	-90.2	0	0	0	110.6
878	P	86.6	Confident	77.5	Confident	4 Å²	4	67.4 Å²	67.4	3%	0.026	36%	0.355	C	S	.	.	S	Bend	cis	-70.1	149.4	-7.1	31.8	-36	0	0	0	111.4	H867 L880 F881 T918 F921	H867-P878 WeakPolarHBondContact CB-O 3.47Å; H867-P878 PolarHBondContact ND1-O 2.79Å; P878-L880 VanDerWaalsContact C-N 3.34Å; P878-F881 HydrophobicContact CG-CD1 3.99Å; P878-F881 HydrophobicContact CG-CE1 3.35Å; P878-F881 HydrophobicContact CG-CE2 4.38Å; P878-F881 HydrophobicContact CG-CZ 3.59Å; P878-T918 VanDerWaalsContact CD-O 3.29Å; P878-T918 WeakPolarHBondContact CD-O 3.47Å; P878-F921 HydrophobicContact CB-CB 3.82Å; P878-F921 HydrophobicContact CG-CB 4.09Å
879	K	85.6	Confident	77.6	Confident	144 Å²	144	65.5 Å²	65.5	63%	0.626	35%	0.349	S	S	*	.	S	Bend	trans	-75.9	-22.9	178.1	-68.1	-177.6	178.9	179.4	0	113.2	H867 V876	H867-K879 PolarHBondContact N-O 3.33Å; V876-K879 VanDerWaalsContact O-CG 3.28Å; V876-K879 WeakPolarHBondContact O-CG 3.4Å
880	L	87.5	Confident	78.1	Confident	61 Å²	61	65.2 Å²	65.2	32%	0.319	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141	138	-174.9	-164.1	82.1	0	0	0	109	Q864 I865 I866 P878	Q864-L880 HydrophobicContact CB-CD1 3.84Å; Q864-L880 HydrophobicContact CB-CD2 4.47Å; Q864-L880 HydrophobicContact CB-CG 4.28Å; Q864-L880 HydrophobicContact CG-CD1 4.39Å; Q864-L880 HydrophobicContact CG-CD2 4.2Å; I865-L880 CarbonylContact O-C 3.54Å; I865-L880 WeakPolarHBondContact O-CA 3.42Å; I866-L880 HydrophobicContact CG1-CD1 4.01Å; P878-L880 VanDerWaalsContact C-N 3.34Å
881	F	89.1	Confident	78.7	Confident	0 Å²	0	67.2 Å²	67.2	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	139.5	164.9	-49.2	-96.4	0	0	0	109.3	L857 I865 H867 P878 F904 Y916 K917 Y920 F921	L857-F881 HydrophobicContact CD2-CD2 4.45Å; L857-F881 HydrophobicContact CD2-CE2 3.75Å; I865-F881 HydrophobicContact CB-CB 4.11Å; I865-F881 HydrophobicContact CB-CD2 4.24Å; I865-F881 HydrophobicContact CD1-CB 4.48Å; I865-F881 HydrophobicContact CG2-CD2 4.14Å; I865-F881 PolarHBondContact N-O 3.37Å; I865-F881 PolarHBondContact O-N 2.97Å; H867-F881 HydrophobicContact CB-CD2 4.43Å; H867-F881 HydrophobicContact CB-CE2 3.74Å; H867-F881 AromaticContact CG-CE2 3.86Å; H867-F881 AromaticContact ND1-CE2 3.73Å; H867-F881 AromaticContact ND1-CZ 3.76Å; P878-F881 HydrophobicContact CG-CD1 3.99Å; P878-F881 HydrophobicContact CG-CE1 3.35Å; P878-F881 HydrophobicContact CG-CE2 4.38Å; P878-F881 HydrophobicContact CG-CZ 3.59Å; F881-F904 HydrophobicContact CD1-CE1 4.33Å; F881-F904 AromaticContact CD1-CZ 3.96Å; F881-F904 HydrophobicContact CD1-CZ 3.96Å; F881-F904 HydrophobicContact CD2-CE1 4.4Å; F881-F904 AromaticContact CD2-CZ 3.75Å; F881-F904 HydrophobicContact CD2-CZ 3.75Å; F881-F904 AromaticContact CE1-CE1 3.94Å; F881-F904 HydrophobicContact CE1-CE1 3.94Å; F881-F904 HydrophobicContact CE1-CZ 4.02Å; F881-F904 AromaticContact CE2-CE1 3.98Å; F881-F904 HydrophobicContact CE2-CE1 3.98Å; F881-F904 AromaticContact CE2-CZ 3.78Å; F881-F904 HydrophobicContact CE2-CZ 3.78Å; F881-F904 AromaticContact CG-CZ 3.85Å; F881-F904 HydrophobicContact CG-CZ 3.85Å; F881-F904 AromaticContact CZ-CE1 3.76Å; F881-F904 HydrophobicContact CZ-CE1 3.76Å; F881-F904 AromaticContact CZ-CZ 3.94Å; F881-F904 HydrophobicContact CZ-CZ 3.94Å; F881-Y916 HydrophobicContact CB-CD1 3.93Å; F881-Y916 HydrophobicContact CB-CE1 3.72Å; F881-Y916 AromaticContact CD1-CD1 3.79Å; F881-Y916 HydrophobicContact CD1-CD1 3.79Å; F881-Y916 HydrophobicContact CD1-CE1 4.37Å; F881-Y916 HydrophobicContact CD1-CG 4.43Å; F881-Y916 HydrophobicContact CG-CD1 4.2Å; F881-Y916 HydrophobicContact CG-CE1 4.48Å; F881-K917 WeakPolarHBondContact CE1-O 3.43Å; F881-Y920 WeakPolarHBondContact CD1-O 3.21Å; F881-Y920 VanDerWaalsContact CE1-O 3.22Å; F881-Y920 WeakPolarHBondContact CE1-O 3.41Å; F881-F921 VanDerWaalsContact CA-O 3.3Å; F881-F921 WeakPolarHBondContact CA-O 3.37Å
882	S	83.7	Confident	79.5	Confident	35 Å²	35	66.1 Å²	66.1	25%	0.245	35%	0.351	C	S	.	.			trans	-151.4	161.3	-179.7	66.2	0	0	0	0	112.2	F921	S882-F921 PolarHBondContact N-O 2.91Å
883	R	83	Confident	80.7	Confident	16 Å²	16	63 Å²	63	6%	0.06	33%	0.33	C	S	.	.			trans	-94.6	133.5	169.8	-66	169.2	62.5	-146.7	-9.8	107.8	L885 Y908 D910 P923 E926	R883-L885 PolarHBondContact O-N 3.46Å; R883-Y908 VanDerWaalsContact CD-CZ 3.49Å; R883-D910 IonicContact CZ-OD2 2.86Å; R883-D910 IonicContact NH1-OD1 3.02Å; R883-D910 PolarHBondContact NH1-OD1 3.05Å; R883-D910 IonicContact NH1-OD2 2.82Å; R883-D910 PolarHBondContact NH1-OD2 2.84Å; R883-D910 IonicContact NH2-OD2 3.29Å; R883-D910 PolarHBondContact NH2-OD2 2.91Å; R883-P923 HydrophobicContact CG-CG 4.35Å; R883-E926 IonicContact CZ-OE1 2.7Å; R883-E926 IonicContact CZ-OE2 3.12Å; R883-E926 IonicContact NE-OE1 2.76Å; R883-E926 IonicContact NE-OE2 3.09Å; R883-E926 PolarHBondContact NE-OE2 3.24Å; R883-E926 VanDerWaalsContact NE-OE2 3.17Å; R883-E926 IonicContact NH2-OE1 3.67Å; R883-E926 PolarHBondContact NH2-OE1 3.04Å; R883-E926 IonicContact NH2-OE2 3.47Å
884	I	66.1	Low	81.7	Confident	118 Å²	118	59.2 Å²	59.2	61%	0.605	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-30.4	-173.6	-57.4	172.3	0	0	0	112.2
885	L	62.6	Low	82.6	Confident	132 Å²	132	56.8 Å²	56.8	69%	0.691	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.6	7.4	-163.9	-66.4	167.7	0	0	0	114.1	R883 K940	R883-L885 PolarHBondContact O-N 3.46Å; L885-K940 HydrophobicContact CD1-CD 4.29Å; L885-K940 VanDerWaalsContact CD1-NZ 3.28Å
886	C	64.6	Low	83.3	Confident	36 Å²	36	51.2 Å²	51.2	24%	0.243	27%	0.265	C	S	.	.			trans	-153.6	138.8	-171.1	-159.2	0	0	0	0	113.1	S888 D910	C886-S888 PolarHBondContact SG-OG 3.33Å; C886-D910 PolarHBondContact SG-OD2 3.49Å
887	C	69.1	Low	83.4	Confident	88 Å²	88	52.8 Å²	52.8	60%	0.595	28%	0.276	S	S	*	.			trans	-114.2	25.3	-177.9	-55.8	0	0	0	0	112.8	N862	N862-C887 CarbonylContact C-O 3.6Å; N862-C887 WeakPolarHBondContact O-CA 3.4Å
888	S	83.7	Confident	83.3	Confident	23 Å²	23	45.6 Å²	45.6	16%	0.161	25%	0.249	C	C	.	.	P	Polyproline II helix	trans	-64.7	138.2	178.4	-55.5	0	0	0	0	110.7	G863 C886 Y908 D910	G863-S888 WeakPolarHBondContact CA-O 3.26Å; G863-S888 PolarHBondContact N-O 3.34Å; C886-S888 PolarHBondContact SG-OG 3.33Å; S888-Y908 WeakPolarHBondContact O-CD1 3.47Å; S888-D910 WeakPolarHBondContact CB-OD2 3.21Å; S888-D910 VanDerWaalsContact OG-CB 3.32Å; S888-D910 WeakPolarHBondContact OG-CB 3.44Å; S888-D910 PolarHBondContact OG-OD2 2.85Å
889	A	87.2	Confident	82.9	Confident	20 Å²	20	47.5 Å²	47.5	17%	0.165	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-58.5	140.1	-178.6	0	0	0	0	0	112.1	S861 Q891 Y908 T909	S861-A889 WeakPolarHBondContact O-CA 3.18Å; S861-A889 WeakPolarHBondContact O-CB 3.32Å; A889-Q891 PolarHBondContact O-N 3.21Å; A889-Y908 WeakPolarHBondContact O-CA 3.44Å; A889-T909 HydrophobicContact CB-CG2 3.77Å; A889-T909 PolarHBondContact N-OG1 2.82Å; A889-T909 PolarHBondContact O-N 3.45Å
890	V	91	Very high	82.7	Confident	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	117.7	171.3	-173.1	0	0	0	0	107.6	T846 C860 I865 L893 A906 Y908	T846-V890 WeakPolarHBondContact CB-O 3.46Å; T846-V890 PolarHBondContact OG1-O 3.02Å; C860-V890 PolarHBondContact O-N 3.29Å; C860-V890 VanDerWaalsContact O-N 3.09Å; I865-V890 HydrophobicContact CD1-CG2 4.49Å; I865-V890 HydrophobicContact CG1-CG1 4.32Å; I865-V890 HydrophobicContact CG1-CG2 3.81Å; V890-L893 HydrophobicContact CG1-CD1 4.4Å; V890-L893 HydrophobicContact CG1-CD2 4Å; V890-L893 HydrophobicContact CG1-CG 3.91Å; V890-A906 HydrophobicContact CG1-CB 4.42Å; V890-Y908 HydrophobicContact CG2-CD1 4.24Å; V890-Y908 HydrophobicContact CG2-CE1 3.71Å
891	Q	89.5	Confident	82.4	Confident	90 Å²	90	44.4 Å²	44.4	42%	0.421	25%	0.252	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	-35.1	-177.8	-167.1	70.3	23.6	0	0	112.2	A889 G907 T909 I970	A889-Q891 PolarHBondContact O-N 3.21Å; Q891-G907 PolarHBondContact N-O 3.25Å; Q891-T909 HydrophobicContact CB-CG2 4.42Å; Q891-I970 WeakPolarHBondContact CB-O 3.29Å; Q891-I970 WeakPolarHBondContact CG-O 3.25Å
892	T	91.6	Very high	82.2	Confident	17 Å²	17	48.2 Å²	48.2	10%	0.104	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148	143.8	-173.8	-178.1	0	0	0	0	110.8	A906 G907 I970 L973	T892-A906 WeakPolarHBondContact O-CA 3.48Å; T892-G907 PolarHBondContact N-O 3.28Å; T892-G907 PolarHBondContact O-N 3.26Å; T892-I970 HydrophobicContact CG2-CG2 3.88Å; T892-L973 HydrophobicContact CG2-CB 4.09Å; T892-L973 HydrophobicContact CG2-CD1 3.88Å; T892-L973 HydrophobicContact CG2-CG 3.67Å; T892-L973 PolarHBondContact OG1-N 2.76Å
893	L	94.3	Very high	82.5	Confident	7 Å²	7	47 Å²	47	4%	0.037	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.6	134.9	177.4	-74.2	169.9	0	0	0	108.8	A849 L857 G859 I865 V890 F904 I905 A906	A849-L893 HydrophobicContact CB-CB 3.72Å; L857-L893 HydrophobicContact CB-CD1 4.34Å; G859-L893 VanDerWaalsContact N-CD1 3.33Å; I865-L893 HydrophobicContact CD1-CD2 3.78Å; I865-L893 HydrophobicContact CG1-CD2 4.2Å; I865-L893 HydrophobicContact CG2-CD1 4.05Å; I865-L893 HydrophobicContact CG2-CD2 4.27Å; V890-L893 HydrophobicContact CG1-CD1 4.4Å; V890-L893 HydrophobicContact CG1-CD2 4Å; V890-L893 HydrophobicContact CG1-CG 3.91Å; L893-F904 HydrophobicContact CD2-CD2 4.24Å; L893-F904 HydrophobicContact CD2-CE2 4.28Å; L893-I905 WeakPolarHBondContact CA-O 3.22Å; L893-A906 HydrophobicContact CD2-CB 3.58Å
894	E	91.3	Very high	83	Confident	48 Å²	48	46.2 Å²	46.2	22%	0.224	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	124.3	177.7	-173.7	74.6	173	0	0	110.7	F904 I905 L973 W975	E894-F904 WeakPolarHBondContact O-CA 3.33Å; E894-I905 HydrophobicContact CB-CD1 4.3Å; E894-I905 HydrophobicContact CB-CG1 3.92Å; E894-I905 PolarHBondContact N-O 2.76Å; E894-I905 WeakPolarHBondContact O-CG1 3.34Å; E894-I905 PolarHBondContact O-N 2.99Å; E894-L973 HydrophobicContact CB-CB 4.4Å; E894-W975 HydrophobicContact CG-CG 4.36Å; E894-W975 PolarHBondContact O-NE1 2.95Å
895	T	91.7	Very high	84.3	Confident	28 Å²	28	40.6 Å²	40.6	17%	0.172	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	143	177.9	51.5	0	0	0	0	110.7	A849 I850 T851 L857 F904 W975	A849-T895 HydrophobicContact CB-CG2 4.12Å; I850-T895 WeakPolarHBondContact O-CG2 3.4Å; I850-T895 PolarHBondContact O-OG1 3.02Å; T851-T895 HydrophobicContact CG2-CG2 4.25Å; L857-T895 HydrophobicContact CD1-CG2 3.87Å; T895-F904 HydrophobicContact CG2-CB 4.08Å; T895-W975 PolarHBondContact O-NE1 3.04Å
896	H	88.8	Confident	85.8	Confident	5 Å²	5	34.3 Å²	34.3	2%	0.023	20%	0.195	C	C	.	.			trans	-67.1	139.2	-178.1	-175.3	-80.4	0	0	0	111.3	N898 L901 I903 W975 S980	H896-N898 VanDerWaalsContact C-N 3.31Å; H896-N898 PolarHBondContact CE1-N 2.91Å; H896-N898 PolarHBondContact ND1-N 3.36Å; H896-N898 PolarHBondContact ND1-O 3.36Å; H896-N898 PolarHBondContact O-N 3.25Å; H896-L901 WeakPolarHBondContact CE1-CD1 3.41Å; H896-L901 WeakPolarHBondContact ND1-CD1 3.46Å; H896-I903 HydrophobicContact CB-CD1 4.23Å; H896-I903 HydrophobicContact CB-CG1 3.52Å; H896-I903 WeakPolarHBondContact CB-O 3.41Å; H896-I903 PolarHBondContact N-O 2.82Å; H896-I903 VanDerWaalsContact N-O 3.13Å; H896-W975 HydrophobicContact CB-CZ2 4.11Å; H896-W975 AromaticContact CD2-CD2 3.84Å; H896-W975 AromaticContact CD2-CE2 3.84Å; H896-W975 AromaticContact CD2-CE3 3.71Å; H896-W975 AromaticContact CD2-CH2 3.66Å; H896-W975 AromaticContact CD2-CZ2 3.76Å; H896-W975 AromaticContact CD2-CZ3 3.64Å; H896-S980 PolarHBondContact NE2-O 3.34Å
897	P	82.2	Confident	87.2	Confident	54 Å²	54	32.6 Å²	32.6	35%	0.351	18%	0.184	S	C	.	.	S	Bend	trans	-60.9	-35.8	-175.9	20.9	-33.9	0	0	0	113.8	W975	P897-W975 HydrophobicContact CG-CB 4.29Å
898	N	79.9	Confident	88.2	Confident	32 Å²	32	28.4 Å²	28.4	17%	0.171	16%	0.156	C	C	.	.	S	Bend	trans	-82.9	118.9	172.5	-175.2	-2.4	0	0	0	110.7	H896 E900 L901	H896-N898 VanDerWaalsContact C-N 3.31Å; H896-N898 PolarHBondContact CE1-N 2.91Å; H896-N898 PolarHBondContact ND1-N 3.36Å; H896-N898 PolarHBondContact ND1-O 3.36Å; H896-N898 PolarHBondContact O-N 3.25Å; N898-E900 VanDerWaalsContact C-N 3.33Å; N898-E900 PolarHBondContact O-N 3.48Å; N898-E900 WeakPolarHBondContact OD1-CB 3.41Å; N898-E900 PolarHBondContact OD1-N 3.42Å; N898-L901 HydrophobicContact CB-CD1 4.17Å
899	A	79.2	Confident	88.5	Confident	44 Å²	44	29.8 Å²	29.8	36%	0.364	16%	0.163	S	C	.	.	G	3₁₀ helix	trans	-66.2	-30.3	-179.3	0	0	0	0	0	113.7	K852 L901 H902	K852-A899 HydrophobicContact CB-CB 3.6Å; K852-A899 HydrophobicContact CG-CB 4.06Å; A899-L901 PolarHBondContact O-N 2.89Å; A899-H902 PolarHBondContact O-CE1 2.96Å; A899-H902 PolarHBondContact O-N 2.94Å; A899-H902 PolarHBondContact O-ND1 2.62Å
900	E	79.8	Confident	88.4	Confident	131 Å²	131	30.9 Å²	30.9	61%	0.612	17%	0.166	S	C	*	.	G	3₁₀ helix	trans	-65.6	-27.6	-175.1	-63.1	176.9	166.8	0	0	112.7	N898 H902 M1099	N898-E900 VanDerWaalsContact C-N 3.33Å; N898-E900 PolarHBondContact O-N 3.48Å; N898-E900 WeakPolarHBondContact OD1-CB 3.41Å; N898-E900 PolarHBondContact OD1-N 3.42Å; E900-H902 VanDerWaalsContact C-N 3.3Å; E900-H902 PolarHBondContact O-CD2 3.23Å; E900-H902 PolarHBondContact O-N 3.29Å; E900-M1099 HydrophobicContact CB-CE 3.88Å; E900-M1099 VanDerWaalsContact O-CE 3.26Å; E900-M1099 WeakPolarHBondContact O-CE 3.08Å
901	L	81.4	Confident	88	Confident	9 Å²	9	30.9 Å²	30.9	5%	0.047	17%	0.166	C	C	.	.	G	3₁₀ helix	trans	-73.8	-23.5	-177.5	-72.7	166.8	0	0	0	112.7	H896 N898 A899 I903 L1098 M1099 F1102	H896-L901 WeakPolarHBondContact CE1-CD1 3.41Å; H896-L901 WeakPolarHBondContact ND1-CD1 3.46Å; N898-L901 HydrophobicContact CB-CD1 4.17Å; A899-L901 PolarHBondContact O-N 2.89Å; L901-I903 HydrophobicContact CB-CD1 4.04Å; L901-I903 HydrophobicContact CB-CG1 3.95Å; L901-I903 HydrophobicContact CD1-CD1 4.26Å; L901-I903 WeakPolarHBondContact O-CG2 3.49Å; L901-I903 PolarHBondContact O-N 3.44Å; L901-L1098 HydrophobicContact CD1-CD2 3.35Å; L901-L1098 HydrophobicContact CD2-CB 4.49Å; L901-L1098 HydrophobicContact CD2-CD2 3.85Å; L901-L1098 HydrophobicContact CG-CD2 4.24Å; L901-M1099 HydrophobicContact CD2-CE 4.02Å; L901-M1099 HydrophobicContact CD2-CG 3.73Å; L901-M1099 HydrophobicContact CD2-SD 3.63Å; L901-M1099 HydrophobicContact CG-CE 4.49Å; L901-F1102 HydrophobicContact CD2-CD2 4.37Å
902	H	85.8	Confident	87.9	Confident	80 Å²	80	28.5 Å²	28.5	37%	0.37	15%	0.154	S	C	.	.			trans	52	41	-179.2	-64.7	-63.2	0	0	0	113	A899 E900 K917 T918	A899-H902 PolarHBondContact O-CE1 2.96Å; A899-H902 PolarHBondContact O-N 2.94Å; A899-H902 PolarHBondContact O-ND1 2.62Å; E900-H902 VanDerWaalsContact C-N 3.3Å; E900-H902 PolarHBondContact O-CD2 3.23Å; E900-H902 PolarHBondContact O-N 3.29Å; H902-K917 CarbonylContact O-C 3.51Å; H902-K917 WeakPolarHBondContact O-CA 3.47Å; H902-K917 WeakPolarHBondContact O-CG 3.33Å; H902-T918 WeakPolarHBondContact CB-OG1 3.29Å; H902-T918 PolarHBondContact O-N 2.98Å; H902-T918 PolarHBondContact O-OG1 3.19Å
903	I	89.8	Confident	87.9	Confident	8 Å²	8	27.7 Å²	27.7	4%	0.041	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	155.1	179.5	65.2	-174.5	0	0	0	112.3	H896 L901 L915 Y916 K917 I924 W975 L1098 F1102	H896-I903 HydrophobicContact CB-CD1 4.23Å; H896-I903 HydrophobicContact CB-CG1 3.52Å; H896-I903 WeakPolarHBondContact CB-O 3.41Å; H896-I903 PolarHBondContact N-O 2.82Å; H896-I903 VanDerWaalsContact N-O 3.13Å; L901-I903 HydrophobicContact CB-CD1 4.04Å; L901-I903 HydrophobicContact CB-CG1 3.95Å; L901-I903 HydrophobicContact CD1-CD1 4.26Å; L901-I903 WeakPolarHBondContact O-CG2 3.49Å; L901-I903 PolarHBondContact O-N 3.44Å; I903-L915 HydrophobicContact CB-CD1 4.2Å; I903-L915 HydrophobicContact CD1-CD1 4.31Å; I903-Y916 CarbonylContact C-O 3.59Å; I903-Y916 WeakPolarHBondContact CA-O 3.16Å; I903-Y916 WeakPolarHBondContact CB-O 3.43Å; I903-K917 HydrophobicContact CG2-CG 4.47Å; I903-I924 HydrophobicContact CG2-CD1 4.42Å; I903-W975 HydrophobicContact CD1-CH2 4.48Å; I903-L1098 HydrophobicContact CD1-CD2 4.23Å; I903-F1102 HydrophobicContact CD1-CE2 3.72Å; I903-F1102 HydrophobicContact CD1-CZ 4.06Å
904	F	93.3	Very high	87.7	Confident	0 Å²	0	27.3 Å²	27.3	0%	0	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	158.2	171.7	66.8	-87.3	0	0	0	110.4	L857 I865 F881 L893 E894 T895 Y916 T918	L857-F904 HydrophobicContact CD1-CB 4.15Å; L857-F904 HydrophobicContact CD1-CD1 3.79Å; L857-F904 HydrophobicContact CD1-CD2 3.99Å; L857-F904 HydrophobicContact CD1-CE1 4.1Å; L857-F904 HydrophobicContact CD1-CE2 4.29Å; L857-F904 HydrophobicContact CD1-CG 3.71Å; L857-F904 HydrophobicContact CD1-CZ 4.33Å; L857-F904 HydrophobicContact CD2-CE1 4.4Å; L857-F904 HydrophobicContact CD2-CZ 4.41Å; I865-F904 HydrophobicContact CD1-CE2 3.98Å; I865-F904 HydrophobicContact CG2-CE2 4.45Å; F881-F904 HydrophobicContact CD1-CE1 4.33Å; F881-F904 AromaticContact CD1-CZ 3.96Å; F881-F904 HydrophobicContact CD1-CZ 3.96Å; F881-F904 HydrophobicContact CD2-CE1 4.4Å; F881-F904 AromaticContact CD2-CZ 3.75Å; F881-F904 HydrophobicContact CD2-CZ 3.75Å; F881-F904 AromaticContact CE1-CE1 3.94Å; F881-F904 HydrophobicContact CE1-CE1 3.94Å; F881-F904 HydrophobicContact CE1-CZ 4.02Å; F881-F904 AromaticContact CE2-CE1 3.98Å; F881-F904 HydrophobicContact CE2-CE1 3.98Å; F881-F904 AromaticContact CE2-CZ 3.78Å; F881-F904 HydrophobicContact CE2-CZ 3.78Å; F881-F904 AromaticContact CG-CZ 3.85Å; F881-F904 HydrophobicContact CG-CZ 3.85Å; F881-F904 AromaticContact CZ-CE1 3.76Å; F881-F904 HydrophobicContact CZ-CE1 3.76Å; F881-F904 AromaticContact CZ-CZ 3.94Å; F881-F904 HydrophobicContact CZ-CZ 3.94Å; L893-F904 HydrophobicContact CD2-CD2 4.24Å; L893-F904 HydrophobicContact CD2-CE2 4.28Å; E894-F904 WeakPolarHBondContact O-CA 3.33Å; T895-F904 HydrophobicContact CG2-CB 4.08Å; F904-Y916 HydrophobicContact CD2-CD2 4.29Å; F904-Y916 HydrophobicContact CE1-CG 4.25Å; F904-Y916 AromaticContact CE2-CD2 3.59Å; F904-Y916 HydrophobicContact CE2-CD2 3.59Å; F904-Y916 AromaticContact CE2-CG 3.72Å; F904-Y916 HydrophobicContact CE2-CG 3.72Å; F904-Y916 HydrophobicContact CZ-CD1 4.31Å; F904-Y916 AromaticContact CZ-CD2 3.97Å; F904-Y916 HydrophobicContact CZ-CD2 3.97Å; F904-Y916 AromaticContact CZ-CG 3.58Å; F904-Y916 HydrophobicContact CZ-CG 3.58Å; F904-Y916 PolarHBondContact N-O 3.27Å; F904-Y916 PolarHBondContact O-N 3.09Å; F904-T918 HydrophobicContact CD1-CG2 3.82Å; F904-T918 HydrophobicContact CE1-CG2 4.23Å
905	I	94.3	Very high	87.7	Confident	0 Å²	0	25 Å²	25	0%	0	14%	0.137	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	146.5	177.3	53	178	0	0	0	110.8	L893 E894 C914 L915 L973 W975 F983	L893-I905 WeakPolarHBondContact CA-O 3.22Å; E894-I905 HydrophobicContact CB-CD1 4.3Å; E894-I905 HydrophobicContact CB-CG1 3.92Å; E894-I905 PolarHBondContact N-O 2.76Å; E894-I905 WeakPolarHBondContact O-CG1 3.34Å; E894-I905 PolarHBondContact O-N 2.99Å; I905-C914 CarbonylContact C-O 3.4Å; I905-C914 VanDerWaalsContact CA-O 3.29Å; I905-C914 WeakPolarHBondContact CA-O 3.34Å; I905-L915 HydrophobicContact CG2-CB 4.41Å; I905-L915 HydrophobicContact CG2-CD1 3.51Å; I905-L973 HydrophobicContact CB-CD1 4.17Å; I905-L973 HydrophobicContact CD1-CB 3.93Å; I905-L973 HydrophobicContact CD1-CD1 4.05Å; I905-L973 HydrophobicContact CD1-CD2 4.44Å; I905-L973 HydrophobicContact CD1-CG 4.37Å; I905-L973 HydrophobicContact CG1-CB 4.42Å; I905-L973 HydrophobicContact CG1-CD1 4.01Å; I905-W975 HydrophobicContact CB-CZ2 4.35Å; I905-W975 HydrophobicContact CD1-CD2 4.34Å; I905-W975 HydrophobicContact CD1-CZ2 3.93Å; I905-W975 HydrophobicContact CG1-CZ2 3.96Å; I905-W975 HydrophobicContact CG2-CH2 4.05Å; I905-W975 HydrophobicContact CG2-CZ2 3.61Å; I905-F983 HydrophobicContact CD1-CB 4.07Å; I905-F983 HydrophobicContact CD1-CD2 3.95Å; I905-F983 HydrophobicContact CD1-CG 3.99Å
906	A	94.2	Very high	87.7	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	131.8	177.9	0	0	0	0	0	110.1	I865 V890 T892 L893 Y908 I913 C914 Y916	I865-A906 HydrophobicContact CD1-CB 3.71Å; V890-A906 HydrophobicContact CG1-CB 4.42Å; T892-A906 WeakPolarHBondContact O-CA 3.48Å; L893-A906 HydrophobicContact CD2-CB 3.58Å; A906-Y908 HydrophobicContact CB-CE2 3.8Å; A906-I913 CarbonylContact O-C 3.58Å; A906-I913 WeakPolarHBondContact O-CA 3.35Å; A906-C914 PolarHBondContact N-O 2.94Å; A906-C914 PolarHBondContact O-N 2.79Å; A906-Y916 HydrophobicContact CB-CD2 4.29Å; A906-Y916 HydrophobicContact CB-CE2 4.06Å
907	G	92.2	Very high	87.6	Confident	0 Å²	0	26.4 Å²	26.4	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.3	134.2	174.5	0	0	0	0	0	110.3	Q891 T892 L973	Q891-G907 PolarHBondContact N-O 3.25Å; T892-G907 PolarHBondContact N-O 3.28Å; T892-G907 PolarHBondContact O-N 3.26Å; G907-L973 VanDerWaalsContact N-CD1 3.31Å
908	Y	91.5	Very high	87.8	Confident	1 Å²	1	24.9 Å²	24.9	0%	0.004	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	159.4	-173.3	-68.1	-95.1	0	0	0	112.2	R883 S888 A889 V890 A906 D910 G911 K912 C914 Y916 I970	R883-Y908 VanDerWaalsContact CD-CZ 3.49Å; S888-Y908 WeakPolarHBondContact O-CD1 3.47Å; A889-Y908 WeakPolarHBondContact O-CA 3.44Å; V890-Y908 HydrophobicContact CG2-CD1 4.24Å; V890-Y908 HydrophobicContact CG2-CE1 3.71Å; A906-Y908 HydrophobicContact CB-CE2 3.8Å; Y908-D910 WeakPolarHBondContact CB-OD1 3.35Å; Y908-D910 PolarHBondContact O-N 2.86Å; Y908-G911 PolarHBondContact O-N 3.28Å; Y908-K912 WeakPolarHBondContact CD2-O 2.88Å; Y908-K912 PolarHBondContact N-O 2.82Å; Y908-C914 HydrophobicContact CE2-CB 3.77Å; Y908-C914 VanDerWaalsContact CE2-SG 3.53Å; Y908-Y916 PolarHBondContact OH-OH 3.49Å; Y908-I970 PolarHBondContact O-N 3.09Å; Y908-I970 VanDerWaalsContact O-N 3.08Å
909	T	89	Confident	88	Confident	51 Å²	51	27.8 Å²	27.8	31%	0.313	15%	0.145	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69	-13.9	177.8	54.5	0	0	0	0	114.4	A889 Q891 G911 S969	A889-T909 HydrophobicContact CB-CG2 3.77Å; A889-T909 PolarHBondContact N-OG1 2.82Å; A889-T909 PolarHBondContact O-N 3.45Å; Q891-T909 HydrophobicContact CB-CG2 4.42Å; T909-G911 VanDerWaalsContact C-N 3.31Å; T909-S969 WeakPolarHBondContact O-CA 3.23Å; T909-S969 WeakPolarHBondContact O-CB 3.41Å
910	D	84.7	Confident	88.3	Confident	43 Å²	43	30.3 Å²	30.3	23%	0.23	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-90.2	11	174.6	62.3	-3.7	0	0	0	113.6	R883 C886 S888 Y908 K912 V968	R883-D910 IonicContact CZ-OD2 2.86Å; R883-D910 IonicContact NH1-OD1 3.02Å; R883-D910 PolarHBondContact NH1-OD1 3.05Å; R883-D910 IonicContact NH1-OD2 2.82Å; R883-D910 PolarHBondContact NH1-OD2 2.84Å; R883-D910 IonicContact NH2-OD2 3.29Å; R883-D910 PolarHBondContact NH2-OD2 2.91Å; C886-D910 PolarHBondContact SG-OD2 3.49Å; S888-D910 WeakPolarHBondContact CB-OD2 3.21Å; S888-D910 VanDerWaalsContact OG-CB 3.32Å; S888-D910 WeakPolarHBondContact OG-CB 3.44Å; S888-D910 PolarHBondContact OG-OD2 2.85Å; Y908-D910 WeakPolarHBondContact CB-OD1 3.35Å; Y908-D910 PolarHBondContact O-N 2.86Å; D910-K912 VanDerWaalsContact C-N 3.28Å; D910-K912 PolarHBondContact O-N 3.17Å; D910-K912 WeakPolarHBondContact OD1-CB 3.27Å; D910-K912 PolarHBondContact OD1-N 3.27Å; D910-V968 CarbonylContact C-O 3.59Å; D910-V968 VanDerWaalsContact C-O 3.28Å
911	G	84.4	Confident	88.5	Confident	0 Å²	0	28.3 Å²	28.3	0%	0	14%	0.136	C	C	.	.	S	Bend	trans	82.2	10.3	175.6	0	0	0	0	0	113.5	Y908 T909 V929 V968	Y908-G911 PolarHBondContact O-N 3.28Å; T909-G911 VanDerWaalsContact C-N 3.31Å; G911-V929 WeakPolarHBondContact O-CB 2.91Å; G911-V929 WeakPolarHBondContact O-CG2 3.03Å; G911-V929 PolarHBondContact O-N 3.43Å; G911-V968 WeakPolarHBondContact CA-O 3.47Å; G911-V968 PolarHBondContact N-O 2.89Å
912	K	87.2	Confident	88.6	Confident	40 Å²	40	29.9 Å²	29.9	17%	0.174	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	148.4	179.4	-65.8	176.4	167	-163.7	0	112	Y908 D910 E926 W927 D928	Y908-K912 WeakPolarHBondContact CD2-O 2.88Å; Y908-K912 PolarHBondContact N-O 2.82Å; D910-K912 VanDerWaalsContact C-N 3.28Å; D910-K912 PolarHBondContact O-N 3.17Å; D910-K912 WeakPolarHBondContact OD1-CB 3.27Å; D910-K912 PolarHBondContact OD1-N 3.27Å; K912-E926 HydrophobicContact CD-CG 4.38Å; K912-E926 WeakPolarHBondContact CD-OE1 3.46Å; K912-E926 WeakPolarHBondContact CE-OE1 3.4Å; K912-E926 IonicContact NZ-OE1 2.64Å; K912-E926 PolarHBondContact NZ-OE1 3.2Å; K912-W927 CarbonylContact C-O 3.57Å; K912-W927 WeakPolarHBondContact CA-O 3.32Å; K912-W927 WeakPolarHBondContact CB-O 3.39Å; K912-D928 HydrophobicContact CG-CB 4.16Å
913	I	90.5	Very high	88.6	Confident	0 Å²	0	26.3 Å²	26.3	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.8	127.9	176.3	-55.1	170.6	0	0	0	106.7	A906 E926 W927 V929 I970 L973 F983 W995	A906-I913 CarbonylContact O-C 3.58Å; A906-I913 WeakPolarHBondContact O-CA 3.35Å; I913-E926 CarbonylContact O-C 3.51Å; I913-E926 WeakPolarHBondContact O-CA 3.17Å; I913-W927 HydrophobicContact CB-CB 4.33Å; I913-W927 HydrophobicContact CB-CE3 3.98Å; I913-W927 HydrophobicContact CG2-CE3 3.74Å; I913-W927 HydrophobicContact CG2-CZ3 4.09Å; I913-W927 PolarHBondContact N-O 2.96Å; I913-W927 PolarHBondContact O-N 2.83Å; I913-V929 HydrophobicContact CD1-CG2 4.24Å; I913-I970 HydrophobicContact CD1-CD1 4.08Å; I913-I970 HydrophobicContact CG1-CD1 3.83Å; I913-I970 HydrophobicContact CG1-CG1 3.91Å; I913-L973 HydrophobicContact CD1-CD2 4.02Å; I913-L973 HydrophobicContact CG1-CD2 4.3Å; I913-L973 HydrophobicContact CG2-CD1 4.09Å; I913-L973 HydrophobicContact CG2-CD2 4.21Å; I913-F983 HydrophobicContact CD1-CE2 4.23Å; I913-F983 HydrophobicContact CG2-CE2 4.09Å; I913-F983 HydrophobicContact CG2-CZ 4.34Å; I913-W995 HydrophobicContact CD1-CZ2 3.91Å
914	C	90.7	Very high	88.3	Confident	0 Å²	0	27.6 Å²	27.6	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138	176.8	-66	0	0	0	0	111	I905 A906 Y908 Y916 P923 L925	I905-C914 CarbonylContact C-O 3.4Å; I905-C914 VanDerWaalsContact CA-O 3.29Å; I905-C914 WeakPolarHBondContact CA-O 3.34Å; A906-C914 PolarHBondContact N-O 2.94Å; A906-C914 PolarHBondContact O-N 2.79Å; Y908-C914 HydrophobicContact CE2-CB 3.77Å; Y908-C914 VanDerWaalsContact CE2-SG 3.53Å; C914-Y916 HydrophobicContact CB-CD2 4.07Å; C914-Y916 HydrophobicContact CB-CE2 3.46Å; C914-Y916 VanDerWaalsContact CB-CE2 3.46Å; C914-P923 HydrophobicContact CB-CB 3.8Å; C914-L925 WeakPolarHBondContact CA-O 3.26Å
915	L	91.2	Very high	87.7	Confident	0 Å²	0	27.7 Å²	27.7	0%	0	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	127.7	168.9	-178.6	71.9	0	0	0	109.6	I903 I905 P923 I924 L925 W927 W975 F1102	I903-L915 HydrophobicContact CB-CD1 4.2Å; I903-L915 HydrophobicContact CD1-CD1 4.31Å; I905-L915 HydrophobicContact CG2-CB 4.41Å; I905-L915 HydrophobicContact CG2-CD1 3.51Å; L915-P923 CarbonylContact O-C 3.47Å; L915-P923 WeakPolarHBondContact O-CA 3.46Å; L915-I924 HydrophobicContact CD2-CD1 4.32Å; L915-I924 HydrophobicContact CG-CD1 4.36Å; L915-I924 PolarHBondContact O-N 2.72Å; L915-L925 HydrophobicContact CB-CB 4.2Å; L915-L925 HydrophobicContact CD2-CD1 4.24Å; L915-L925 PolarHBondContact N-O 2.84Å; L915-W927 HydrophobicContact CB-CH2 3.58Å; L915-W927 HydrophobicContact CB-CZ3 3.62Å; L915-W927 HydrophobicContact CD2-CH2 4.13Å; L915-W927 HydrophobicContact CG-CH2 4.34Å; L915-W975 HydrophobicContact CD1-CH2 4.43Å; L915-F1102 HydrophobicContact CD2-CE1 3.43Å; L915-F1102 VanDerWaalsContact CD2-CE1 3.43Å; L915-F1102 HydrophobicContact CD2-CZ 3.51Å
916	Y	90.7	Very high	87.2	Confident	0 Å²	0	28.6 Å²	28.6	0%	0	14%	0.138	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	148.9	178.8	-73.3	-85.3	0	0	0	111.2	I865 F881 I903 F904 A906 Y908 C914 Q922 P923	I865-Y916 HydrophobicContact CD1-CD2 4.22Å; I865-Y916 HydrophobicContact CD1-CE2 3.78Å; F881-Y916 HydrophobicContact CB-CD1 3.93Å; F881-Y916 HydrophobicContact CB-CE1 3.72Å; F881-Y916 AromaticContact CD1-CD1 3.79Å; F881-Y916 HydrophobicContact CD1-CD1 3.79Å; F881-Y916 HydrophobicContact CD1-CE1 4.37Å; F881-Y916 HydrophobicContact CD1-CG 4.43Å; F881-Y916 HydrophobicContact CG-CD1 4.2Å; F881-Y916 HydrophobicContact CG-CE1 4.48Å; I903-Y916 CarbonylContact C-O 3.59Å; I903-Y916 WeakPolarHBondContact CA-O 3.16Å; I903-Y916 WeakPolarHBondContact CB-O 3.43Å; F904-Y916 HydrophobicContact CD2-CD2 4.29Å; F904-Y916 HydrophobicContact CE1-CG 4.25Å; F904-Y916 AromaticContact CE2-CD2 3.59Å; F904-Y916 HydrophobicContact CE2-CD2 3.59Å; F904-Y916 AromaticContact CE2-CG 3.72Å; F904-Y916 HydrophobicContact CE2-CG 3.72Å; F904-Y916 HydrophobicContact CZ-CD1 4.31Å; F904-Y916 AromaticContact CZ-CD2 3.97Å; F904-Y916 HydrophobicContact CZ-CD2 3.97Å; F904-Y916 AromaticContact CZ-CG 3.58Å; F904-Y916 HydrophobicContact CZ-CG 3.58Å; F904-Y916 PolarHBondContact N-O 3.27Å; F904-Y916 PolarHBondContact O-N 3.09Å; A906-Y916 HydrophobicContact CB-CD2 4.29Å; A906-Y916 HydrophobicContact CB-CE2 4.06Å; Y908-Y916 PolarHBondContact OH-OH 3.49Å; C914-Y916 HydrophobicContact CB-CD2 4.07Å; C914-Y916 HydrophobicContact CB-CE2 3.46Å; C914-Y916 VanDerWaalsContact CB-CE2 3.46Å; Y916-Q922 VanDerWaalsContact CE1-C 3.5Å; Y916-P923 HydrophobicContact CD1-CB 4.21Å; Y916-P923 HydrophobicContact CE1-CB 3.77Å; Y916-P923 HydrophobicContact CE1-CG 4.16Å; Y916-P923 VanDerWaalsContact CE1-N 3.25Å; Y916-P923 HydrophobicContact CE2-CB 4.21Å
917	K	87.8	Confident	86.7	Confident	61 Å²	61	28.7 Å²	28.7	27%	0.265	14%	0.139	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	136.7	162.8	-154.2	173.3	167.3	170.8	0	107.7	F881 H902 I903 N919 Y920 I924	F881-K917 WeakPolarHBondContact CE1-O 3.43Å; H902-K917 CarbonylContact O-C 3.51Å; H902-K917 WeakPolarHBondContact O-CA 3.47Å; H902-K917 WeakPolarHBondContact O-CG 3.33Å; I903-K917 HydrophobicContact CG2-CG 4.47Å; K917-N919 WeakPolarHBondContact CD-OD1 3.2Å; K917-N919 WeakPolarHBondContact CE-OD1 3.17Å; K917-N919 WeakPolarHBondContact CG-OD1 3.42Å; K917-N919 PolarHBondContact O-N 2.9Å; K917-Y920 PolarHBondContact O-N 3.39Å; K917-Y920 VanDerWaalsContact O-O 3.1Å; K917-I924 HydrophobicContact CB-CD1 3.82Å; K917-I924 HydrophobicContact CB-CG1 4.31Å
918	T	86.6	Confident	86.2	Confident	23 Å²	23	30 Å²	30	14%	0.141	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-12.5	-177	59.9	0	0	0	0	113.7	T851 P878 H902 F904	T851-T918 HydrophobicContact CG2-CG2 4.37Å; P878-T918 VanDerWaalsContact CD-O 3.29Å; P878-T918 WeakPolarHBondContact CD-O 3.47Å; H902-T918 WeakPolarHBondContact CB-OG1 3.29Å; H902-T918 PolarHBondContact O-N 2.98Å; H902-T918 PolarHBondContact O-OG1 3.19Å; F904-T918 HydrophobicContact CD1-CG2 3.82Å; F904-T918 HydrophobicContact CE1-CG2 4.23Å
919	N	84.5	Confident	85.3	Confident	92 Å²	92	31.2 Å²	31.2	49%	0.492	15%	0.153	S	C	.	.	T	Hydrogen-bonded Turn	trans	-109.6	8	176.7	70.4	-15	0	0	0	113.6	K917	K917-N919 WeakPolarHBondContact CD-OD1 3.2Å; K917-N919 WeakPolarHBondContact CE-OD1 3.17Å; K917-N919 WeakPolarHBondContact CG-OD1 3.42Å; K917-N919 PolarHBondContact O-N 2.9Å
920	Y	84.1	Confident	84.2	Confident	98 Å²	98	33 Å²	33	38%	0.384	16%	0.164	S	C	.	.			trans	-132	120.3	-178	-169.6	-114.9	0	0	0	111	F881 K917 Q922	F881-Y920 WeakPolarHBondContact CD1-O 3.21Å; F881-Y920 VanDerWaalsContact CE1-O 3.22Å; F881-Y920 WeakPolarHBondContact CE1-O 3.41Å; K917-Y920 PolarHBondContact O-N 3.39Å; K917-Y920 VanDerWaalsContact O-O 3.1Å; Y920-Q922 VanDerWaalsContact C-N 3.29Å; Y920-Q922 HydrophobicContact CD1-CB 4.29Å; Y920-Q922 WeakPolarHBondContact CD1-O 3.43Å; Y920-Q922 HydrophobicContact CE1-CB 3.72Å; Y920-Q922 PolarHBondContact O-N 2.86Å
921	F	84.4	Confident	82.7	Confident	88 Å²	88	32.9 Å²	32.9	39%	0.386	17%	0.167	S	C	.	.	S	Bend	trans	-72.1	-16.6	-167.4	72	-81.9	0	0	0	115	P878 F881 S882	P878-F921 HydrophobicContact CB-CB 3.82Å; P878-F921 HydrophobicContact CG-CB 4.09Å; F881-F921 VanDerWaalsContact CA-O 3.3Å; F881-F921 WeakPolarHBondContact CA-O 3.37Å; S882-F921 PolarHBondContact N-O 2.91Å
922	Q	84.1	Confident	80.9	Confident	42 Å²	42	37.3 Å²	37.3	20%	0.196	20%	0.197	C	C	.	.	S	Bend	trans	-105.2	156.4	178.3	-65.3	-177.2	-2.8	0	0	111.1	Y916 Y920 I924	Y916-Q922 VanDerWaalsContact CE1-C 3.5Å; Y920-Q922 VanDerWaalsContact C-N 3.29Å; Y920-Q922 HydrophobicContact CD1-CB 4.29Å; Y920-Q922 WeakPolarHBondContact CD1-O 3.43Å; Y920-Q922 HydrophobicContact CE1-CB 3.72Å; Y920-Q922 PolarHBondContact O-N 2.86Å; Q922-I924 PolarHBondContact O-N 3.47Å
923	P	85.5	Confident	78.7	Confident	6 Å²	6	39.6 Å²	39.6	4%	0.039	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	135	176.7	26.5	-30.6	0	0	0	111.1	R883 C914 L915 Y916 N937	R883-P923 HydrophobicContact CG-CG 4.35Å; C914-P923 HydrophobicContact CB-CB 3.8Å; L915-P923 CarbonylContact O-C 3.47Å; L915-P923 WeakPolarHBondContact O-CA 3.46Å; Y916-P923 HydrophobicContact CD1-CB 4.21Å; Y916-P923 HydrophobicContact CE1-CB 3.77Å; Y916-P923 HydrophobicContact CE1-CG 4.16Å; Y916-P923 VanDerWaalsContact CE1-N 3.25Å; Y916-P923 HydrophobicContact CE2-CB 4.21Å; P923-N937 PolarHBondContact O-ND2 2.64Å
924	I	82.5	Confident	76.4	Confident	35 Å²	35	40.7 Å²	40.7	18%	0.179	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	-45.7	172.4	-48.9	175.5	0	0	0	109.1	I903 L915 K917 Q922 F1102	I903-I924 HydrophobicContact CG2-CD1 4.42Å; L915-I924 HydrophobicContact CD2-CD1 4.32Å; L915-I924 HydrophobicContact CG-CD1 4.36Å; L915-I924 PolarHBondContact O-N 2.72Å; K917-I924 HydrophobicContact CB-CD1 3.82Å; K917-I924 HydrophobicContact CB-CG1 4.31Å; Q922-I924 PolarHBondContact O-N 3.47Å; I924-F1102 HydrophobicContact CD1-CD1 4.44Å; I924-F1102 HydrophobicContact CD1-CE1 4.45Å
925	L	82.5	Confident	74.4	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.01	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.3	145	179.5	-65.6	177	0	0	0	110.4	C914 L915 W927 T936 F1001	C914-L925 WeakPolarHBondContact CA-O 3.26Å; L915-L925 HydrophobicContact CB-CB 4.2Å; L915-L925 HydrophobicContact CD2-CD1 4.24Å; L915-L925 PolarHBondContact N-O 2.84Å; L925-W927 HydrophobicContact CB-CH2 4.06Å; L925-W927 HydrophobicContact CB-CZ2 3.89Å; L925-W927 HydrophobicContact CB-CZ3 4.44Å; L925-W927 HydrophobicContact CD1-CH2 3.96Å; L925-W927 HydrophobicContact CD1-CZ2 3.36Å; L925-W927 HydrophobicContact CG-CZ2 4.31Å; L925-T936 HydrophobicContact CD2-CG2 4.02Å; L925-F1001 HydrophobicContact CD1-CE1 3.63Å; L925-F1001 HydrophobicContact CD1-CE2 4.31Å; L925-F1001 HydrophobicContact CD1-CZ 3.45Å; L925-F1001 VanDerWaalsContact CD1-CZ 3.45Å; L925-F1001 HydrophobicContact CD2-CE1 4.13Å; L925-F1001 HydrophobicContact CG-CE1 4.31Å; L925-F1001 HydrophobicContact CG-CZ 4.33Å
926	E	83.6	Confident	72.1	Confident	18 Å²	18	44.6 Å²	44.6	8%	0.084	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125.7	169.4	-176	168.7	141.1	0	0	107.7	R883 K912 I913 I935	R883-E926 IonicContact CZ-OE1 2.7Å; R883-E926 IonicContact CZ-OE2 3.12Å; R883-E926 IonicContact NE-OE1 2.76Å; R883-E926 IonicContact NE-OE2 3.09Å; R883-E926 PolarHBondContact NE-OE2 3.24Å; R883-E926 VanDerWaalsContact NE-OE2 3.17Å; R883-E926 IonicContact NH2-OE1 3.67Å; R883-E926 PolarHBondContact NH2-OE1 3.04Å; R883-E926 IonicContact NH2-OE2 3.47Å; K912-E926 HydrophobicContact CD-CG 4.38Å; K912-E926 WeakPolarHBondContact CD-OE1 3.46Å; K912-E926 WeakPolarHBondContact CE-OE1 3.4Å; K912-E926 IonicContact NZ-OE1 2.64Å; K912-E926 PolarHBondContact NZ-OE1 3.2Å; I913-E926 CarbonylContact O-C 3.51Å; I913-E926 WeakPolarHBondContact O-CA 3.17Å; E926-I935 PolarHBondContact N-O 3.34Å; E926-I935 CarbonylContact O-C 3.49Å; E926-I935 WeakPolarHBondContact O-CA 3.24Å; E926-I935 PolarHBondContact O-N 3.14Å
927	W	82.7	Confident	69.7	Low	3 Å²	3	47.1 Å²	47.1	1%	0.011	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	148.5	171.2	-56.3	-83.4	0	0	0	108.6	K912 I913 L915 L925 F983 W995	K912-W927 CarbonylContact C-O 3.57Å; K912-W927 WeakPolarHBondContact CA-O 3.32Å; K912-W927 WeakPolarHBondContact CB-O 3.39Å; I913-W927 HydrophobicContact CB-CB 4.33Å; I913-W927 HydrophobicContact CB-CE3 3.98Å; I913-W927 HydrophobicContact CG2-CE3 3.74Å; I913-W927 HydrophobicContact CG2-CZ3 4.09Å; I913-W927 PolarHBondContact N-O 2.96Å; I913-W927 PolarHBondContact O-N 2.83Å; L915-W927 HydrophobicContact CB-CH2 3.58Å; L915-W927 HydrophobicContact CB-CZ3 3.62Å; L915-W927 HydrophobicContact CD2-CH2 4.13Å; L915-W927 HydrophobicContact CG-CH2 4.34Å; L925-W927 HydrophobicContact CB-CH2 4.06Å; L925-W927 HydrophobicContact CB-CZ2 3.89Å; L925-W927 HydrophobicContact CB-CZ3 4.44Å; L925-W927 HydrophobicContact CD1-CH2 3.96Å; L925-W927 HydrophobicContact CD1-CZ2 3.36Å; L925-W927 HydrophobicContact CG-CZ2 4.31Å; W927-F983 HydrophobicContact CE3-CZ 4.21Å; W927-F983 HydrophobicContact CH2-CE1 4.13Å; W927-F983 HydrophobicContact CH2-CZ 4.18Å; W927-F983 HydrophobicContact CZ3-CE1 4.33Å; W927-F983 AromaticContact CZ3-CZ 3.97Å; W927-F983 HydrophobicContact CZ3-CZ 3.97Å; W927-W995 HydrophobicContact CB-CH2 4.11Å; W927-W995 HydrophobicContact CB-CZ3 3.97Å; W927-W995 AromaticContact CD1-CZ3 3.89Å; W927-W995 HydrophobicContact CG-CE3 4.37Å; W927-W995 HydrophobicContact CG-CZ3 4.03Å
928	D	81.1	Confident	67	Low	26 Å²	26	48.5 Å²	48.5	14%	0.139	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	121.3	174.4	-176.6	-26.3	0	0	0	106.9	K912 T930 S931 I935	K912-D928 HydrophobicContact CG-CB 4.16Å; D928-T930 PolarHBondContact O-N 3.2Å; D928-T930 WeakPolarHBondContact OD1-CB 3.37Å; D928-T930 PolarHBondContact OD1-N 2.71Å; D928-T930 PolarHBondContact OD1-OG1 3.11Å; D928-S931 CarbonylContact O-C 3.54Å; D928-S931 PolarHBondContact O-N 3.47Å; D928-S931 PolarHBondContact O-OG 3.37Å; D928-I935 HydrophobicContact CB-CD1 4.15Å
929	V	73.1	Confident	64.4	Low	27 Å²	27	51.5 Å²	51.5	16%	0.164	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-28.3	-178.2	168.8	0	0	0	0	111.9	G911 I913 S931 V968 I970 I993 W995	G911-V929 WeakPolarHBondContact O-CB 2.91Å; G911-V929 WeakPolarHBondContact O-CG2 3.03Å; G911-V929 PolarHBondContact O-N 3.43Å; I913-V929 HydrophobicContact CD1-CG2 4.24Å; V929-S931 VanDerWaalsContact C-N 3.31Å; V929-V968 HydrophobicContact CG1-CG1 4.24Å; V929-I970 HydrophobicContact CB-CD1 4.47Å; V929-I970 HydrophobicContact CG2-CD1 3.39Å; V929-I993 HydrophobicContact CB-CD1 4.5Å; V929-I993 HydrophobicContact CG1-CD1 3.5Å; V929-I993 HydrophobicContact CG2-CD1 4.29Å; V929-W995 HydrophobicContact CG2-CZ2 4.11Å
930	T	65.4	Low	62	Low	89 Å²	89	54.1 Å²	54.1	55%	0.546	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.7	-15.1	178.9	69	0	0	0	0	113	D928 V968	D928-T930 PolarHBondContact O-N 3.2Å; D928-T930 WeakPolarHBondContact OD1-CB 3.37Å; D928-T930 PolarHBondContact OD1-N 2.71Å; D928-T930 PolarHBondContact OD1-OG1 3.11Å; T930-V968 HydrophobicContact CG2-CB 4.5Å; T930-V968 HydrophobicContact CG2-CG2 4.25Å
931	S	54.6	Low	59.4	Low	41 Å²	41	56.2 Å²	56.2	29%	0.287	31%	0.312	S	S	.	.	S	Bend	trans	-115.7	126.4	-177.8	89.2	0	0	0	0	111.2	D928 V929 V933	D928-S931 CarbonylContact O-C 3.54Å; D928-S931 PolarHBondContact O-N 3.47Å; D928-S931 PolarHBondContact O-OG 3.37Å; V929-S931 VanDerWaalsContact C-N 3.31Å; S931-V933 PolarHBondContact O-N 3.11Å; S931-V933 PolarHBondContact OG-O 3.31Å; S931-V933 VanDerWaalsContact OG-O 3.13Å
932	S	45.4	Very low	56.6	Low	92 Å²	92	60.3 Å²	60.3	64%	0.643	33%	0.329	S	S	*	.	S	Bend	trans	-72	11.3	-179.7	56.4	0	0	0	0	114.7
933	V	41.1	Very low	53.9	Low	89 Å²	89	66.3 Å²	66.3	54%	0.539	36%	0.362	S	S	.	.	S	Bend	trans	-131.2	126.3	-175.7	-175.1	0	0	0	0	110	S931 I935	S931-V933 PolarHBondContact O-N 3.11Å; S931-V933 PolarHBondContact OG-O 3.31Å; S931-V933 VanDerWaalsContact OG-O 3.13Å; V933-I935 PolarHBondContact O-N 3.12Å
934	P	43.4	Very low	51.3	Low	23 Å²	23	70.8 Å²	70.8	15%	0.149	39%	0.389	C	S	.	.			trans	-59.3	128.9	172	27.1	-36.6	0	0	0	110.6	T936 I1000	P934-T936 PolarHBondContact O-N 3.43Å; P934-T936 VanDerWaalsContact O-N 3.09Å; P934-I1000 HydrophobicContact CB-CG2 4.04Å; P934-I1000 HydrophobicContact CG-CG2 3.74Å
935	I	49	Very low	48.7	Very low	54 Å²	54	78.7 Å²	78.7	28%	0.277	42%	0.422	S	S	.	.	B	Isolated β-bridge	trans	-82.3	89.4	172.8	-53.1	174.1	0	0	0	107	E926 D928 V933 N937	E926-I935 PolarHBondContact N-O 3.34Å; E926-I935 CarbonylContact O-C 3.49Å; E926-I935 WeakPolarHBondContact O-CA 3.24Å; E926-I935 PolarHBondContact O-N 3.14Å; D928-I935 HydrophobicContact CB-CD1 4.15Å; V933-I935 PolarHBondContact O-N 3.12Å; I935-N937 PolarHBondContact O-N 3.36Å
936	T	42.1	Very low	46.5	Very low	28 Å²	28	85.3 Å²	85.3	17%	0.172	46%	0.458	C	S	.	.			trans	-67.4	128.9	170.3	58	0	0	0	0	109.1	L925 P934 L938 S939 N1004	L925-T936 HydrophobicContact CD2-CG2 4.02Å; P934-T936 PolarHBondContact O-N 3.43Å; P934-T936 VanDerWaalsContact O-N 3.09Å; T936-L938 PolarHBondContact O-N 3.45Å; T936-S939 PolarHBondContact O-N 3.02Å; T936-S939 PolarHBondContact O-OG 3.22Å; T936-N1004 WeakPolarHBondContact CG2-ND2 3.28Å
937	N	39.7	Very low	44.1	Very low	52 Å²	52	93.5 Å²	93.5	28%	0.278	49%	0.493	S	S	.	.	G	3₁₀ helix	trans	-57.8	-15	173.8	-86.5	-33.8	0	0	0	113.6	P923 I935 S939	P923-N937 PolarHBondContact O-ND2 2.64Å; I935-N937 PolarHBondContact O-N 3.36Å; N937-S939 VanDerWaalsContact C-N 3.31Å; N937-S939 PolarHBondContact O-N 3.45Å
938	L	31.7	Very low	41.8	Very low	91 Å²	91	99.9 Å²	99.9	48%	0.476	53%	0.527	S	S	.	.	G	3₁₀ helix	trans	-68.5	-21	177.4	-73	160.1	0	0	0	114.4	T936 K940 F1105 I1108	T936-L938 PolarHBondContact O-N 3.45Å; L938-K940 VanDerWaalsContact C-N 3.26Å; L938-K940 PolarHBondContact O-N 3.02Å; L938-F1105 HydrophobicContact CD1-CD1 4.08Å; L938-F1105 HydrophobicContact CD1-CE1 3.97Å; L938-I1108 HydrophobicContact CD2-CG2 4.4Å
939	S	32.7	Very low	39.7	Very low	86 Å²	86	105.8 Å²	105.8	60%	0.601	56%	0.559	S	S	*	*	G	3₁₀ helix	trans	-78.2	-7.7	-179.3	63.5	0	0	0	0	114.1	T936 N937	T936-S939 PolarHBondContact O-N 3.02Å; T936-S939 PolarHBondContact O-OG 3.22Å; N937-S939 VanDerWaalsContact C-N 3.31Å; N937-S939 PolarHBondContact O-N 3.45Å
940	K	32.8	Very low	37.7	Very low	146 Å²	146	110.4 Å²	110.4	64%	0.635	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-95.4	-0.5	177	-80.6	178.7	177.8	171	0	114.7	L885 L938	L885-K940 HydrophobicContact CD1-CD 4.29Å; L885-K940 VanDerWaalsContact CD1-NZ 3.28Å; L938-K940 VanDerWaalsContact C-N 3.26Å; L938-K940 PolarHBondContact O-N 3.02Å
941	I	29.2	Very low	36	Very low	142 Å²	142	113.2 Å²	113.2	73%	0.728	60%	0.604	S	S	*	*			trans	-130.9	67.9	178.4	-47.1	177.1	0	0	0	109.9
942	K	27.1	Very low	34.7	Very low	174 Å²	174	116.9 Å²	116.9	76%	0.757	62%	0.624	S	S	*	*			trans	-127.3	77.7	158.9	-137.6	177	-171.6	175.3	0	108.8	T944	K942-T944 HydrophobicContact CD-CG2 4.46Å; K942-T944 HydrophobicContact CG-CG2 4.19Å; K942-T944 PolarHBondContact O-N 2.76Å
943	L	26.4	Very low	33.8	Very low	168 Å²	168	116.8 Å²	116.8	88%	0.88	62%	0.622	S	S	*	*			trans	-67.3	83.5	159.8	-84	158.5	0	0	0	107.4	K945	L943-K945 PolarHBondContact O-N 2.89Å
944	T	32.1	Very low	33.2	Very low	100 Å²	100	119.8 Å²	119.8	61%	0.613	64%	0.64	S	S	*	*			trans	-69.7	101.6	167.7	50.1	0	0	0	0	107.8	K942 N946	K942-T944 HydrophobicContact CD-CG2 4.46Å; K942-T944 HydrophobicContact CG-CG2 4.19Å; K942-T944 PolarHBondContact O-N 2.76Å; T944-N946 PolarHBondContact O-N 3.01Å
945	K	28.1	Very low	32.4	Very low	202 Å²	202	123 Å²	123	88%	0.878	66%	0.663	S	S	*	*			trans	-63	81.2	165.1	-80.5	179.6	175.1	171.9	0	109.1	L943 K947	L943-K945 PolarHBondContact O-N 2.89Å; K945-K947 PolarHBondContact O-N 3.25Å
946	N	35	Very low	31.3	Very low	141 Å²	141	129.2 Å²	129.2	75%	0.754	69%	0.688	S	S	*	*			trans	-82.8	107.8	158.5	-79.8	-2.2	0	0	0	107.3	T944 N948	T944-N946 PolarHBondContact O-N 3.01Å; N946-N948 PolarHBondContact O-N 3.39Å
947	K	34.3	Very low	30.5	Very low	189 Å²	189	133 Å²	133	82%	0.822	72%	0.716	S	S	*	*			trans	-63.1	126.9	163.1	-73.4	175.5	174.7	176.3	0	106.6	K945	K945-K947 PolarHBondContact O-N 3.25Å
948	N	34.1	Very low	29.8	Very low	138 Å²	138	136 Å²	136	74%	0.738	74%	0.736	S	S	*	*	S	Bend	trans	96.8	130.1	175.9	-47.2	-16.6	0	0	0	113.7	N946	N946-N948 PolarHBondContact O-N 3.39Å
949	D	36.8	Very low	29.5	Very low	150 Å²	150	135 Å²	135	80%	0.802	74%	0.737	S	S	*	*	S	Bend	trans	91	93.2	168.2	-53	-20.7	0	0	0	117.4
950	T	32	Very low	29.1	Very low	124 Å²	124	141.1 Å²	141.1	76%	0.761	75%	0.752	S	S	*	*			trans	43.3	102.1	143.4	48.4	0	0	0	0	117.3	V952	T950-V952 PolarHBondContact O-N 3.17Å
951	V	28.4	Very low	28.6	Very low	147 Å²	147	139.7 Å²	139.7	89%	0.891	75%	0.751	S	S	*	*			trans	-58.4	96.6	168.5	-178.4	0	0	0	0	109.9
952	V	27.2	Very low	28.3	Very low	118 Å²	118	138.4 Å²	138.4	72%	0.715	75%	0.754	S	S	*	*			trans	-89.2	116	157.9	179.8	0	0	0	0	106.1	T950 V954	T950-V952 PolarHBondContact O-N 3.17Å; V952-V954 PolarHBondContact O-N 3.45Å
953	P	27	Very low	28.3	Very low	91 Å²	91	134.3 Å²	134.3	59%	0.591	74%	0.744	S	S	*	*			trans	-62.3	127.4	169.2	27.1	-29.5	0	0	0	106.5	S955	P953-S955 PolarHBondContact O-N 3.42Å
954	V	28.5	Very low	28.1	Very low	151 Å²	151	134.1 Å²	134.1	92%	0.915	74%	0.744	S	S	*	*			trans	-67.2	82.4	163.4	179.7	0	0	0	0	105.8	V952 K956	V952-V954 PolarHBondContact O-N 3.45Å; V954-K956 PolarHBondContact O-N 2.71Å
955	S	27.1	Very low	28.2	Very low	92 Å²	92	132.9 Å²	132.9	64%	0.643	74%	0.738	S	S	*	*			trans	-61	122	172.7	42.9	0	0	0	0	107.2	P953 S957	P953-S955 PolarHBondContact O-N 3.42Å; S955-S957 PolarHBondContact O-N 3.46Å
956	K	25	Very low	28.8	Very low	183 Å²	183	126.9 Å²	126.9	80%	0.796	72%	0.721	S	S	*	*			trans	19.1	86	143.8	-69	177.2	176.8	177.3	0	113.6	V954 T958	V954-K956 PolarHBondContact O-N 2.71Å; K956-T958 HydrophobicContact CB-CG2 4.18Å; K956-T958 HydrophobicContact CG-CG2 4.41Å; K956-T958 PolarHBondContact O-N 3.1Å
957	S	25.7	Very low	30.1	Very low	108 Å²	108	128.9 Å²	128.9	76%	0.755	72%	0.724	S	S	*	*			trans	-75.6	67.4	144.2	64.6	0	0	0	0	107.3	S955 S959	S955-S957 PolarHBondContact O-N 3.46Å; S957-S959 PolarHBondContact O-N 3.15Å
958	T	24.7	Very low	32.1	Very low	115 Å²	115	120.3 Å²	120.3	71%	0.706	69%	0.687	S	S	*	*			trans	-70.9	61.6	151.4	48.1	0	0	0	0	106.8	K956 K960	K956-T958 HydrophobicContact CB-CG2 4.18Å; K956-T958 HydrophobicContact CG-CG2 4.41Å; K956-T958 PolarHBondContact O-N 3.1Å; T958-K960 PolarHBondContact O-N 3.32Å
959	S	24.6	Very low	34.4	Very low	71 Å²	71	115.1 Å²	115.1	50%	0.497	66%	0.662	S	S	.	*			trans	-67	118	153.6	38.8	0	0	0	0	104.1	S957 I961	S957-S959 PolarHBondContact O-N 3.15Å; S959-I961 PolarHBondContact O-N 3.39Å; S959-I961 WeakPolarHBondContact OG-CD1 3.38Å; S959-I961 WeakPolarHBondContact OG-CG1 3.37Å
960	K	24.2	Very low	36.8	Very low	213 Å²	213	108 Å²	108	93%	0.926	62%	0.624	S	S	*	*			trans	-58.3	73.2	156.7	-75.5	176.5	173.4	178.5	0	106.9	T958 S962	T958-K960 PolarHBondContact O-N 3.32Å; K960-S962 VanDerWaalsContact C-N 3.31Å; K960-S962 PolarHBondContact O-N 2.98Å
961	I	23.5	Very low	39.2	Very low	117 Å²	117	107 Å²	107	60%	0.6	61%	0.606	S	S	*	*			trans	-81.4	98.4	161.6	-48.7	178.9	0	0	0	101.7	S959 V963	S959-I961 PolarHBondContact O-N 3.39Å; S959-I961 WeakPolarHBondContact OG-CD1 3.38Å; S959-I961 WeakPolarHBondContact OG-CG1 3.37Å; I961-V963 HydrophobicContact CB-CG2 3.85Å; I961-V963 HydrophobicContact CG2-CB 4.33Å; I961-V963 HydrophobicContact CG2-CG2 3.38Å; I961-V963 PolarHBondContact O-N 2.95Å
962	S	22.9	Very low	42	Very low	115 Å²	115	102.4 Å²	102.4	80%	0.804	57%	0.574	S	S	*	*			trans	-59.2	78	151	53.1	0	0	0	0	105.8	K960 N964	K960-S962 VanDerWaalsContact C-N 3.31Å; K960-S962 PolarHBondContact O-N 2.98Å; S962-N964 PolarHBondContact O-N 3.38Å
963	V	26.3	Very low	44.9	Very low	88 Å²	88	96.9 Å²	96.9	53%	0.533	54%	0.541	S	S	.	.			trans	-68.7	114.3	163.5	-164.9	0	0	0	0	101.5	I961 C965	I961-V963 HydrophobicContact CB-CG2 3.85Å; I961-V963 HydrophobicContact CG2-CB 4.33Å; I961-V963 HydrophobicContact CG2-CG2 3.38Å; I961-V963 PolarHBondContact O-N 2.95Å; V963-C965 VanDerWaalsContact CB-SG 3.53Å; V963-C965 HydrophobicContact CG1-CB 4.4Å; V963-C965 WeakPolarHBondContact CG1-SG 3.44Å; V963-C965 PolarHBondContact O-N 2.91Å
964	N	23.6	Very low	47.7	Very low	164 Å²	164	93 Å²	93	88%	0.877	52%	0.515	S	S	*	.			trans	-60.3	74.6	151.9	-95.4	-6.8	0	0	0	105.5	S962 S966	S962-N964 PolarHBondContact O-N 3.38Å; N964-S966 VanDerWaalsContact C-N 3.34Å; N964-S966 PolarHBondContact O-N 2.95Å; N964-S966 VanDerWaalsContact O-N 3.09Å
965	C	32.3	Very low	50.4	Low	73 Å²	73	85.9 Å²	85.9	49%	0.493	47%	0.472	S	S	.	.			trans	-69.4	103.8	165.2	-76.7	0	0	0	0	103.1	V963 F967	V963-C965 VanDerWaalsContact CB-SG 3.53Å; V963-C965 HydrophobicContact CG1-CB 4.4Å; V963-C965 WeakPolarHBondContact CG1-SG 3.44Å; V963-C965 PolarHBondContact O-N 2.91Å; C965-F967 WeakPolarHBondContact O-CD2 3.48Å; C965-F967 PolarHBondContact O-N 2.54Å
966	S	42.7	Very low	52.9	Low	76 Å²	76	81.8 Å²	81.8	53%	0.531	44%	0.443	S	S	.	.			trans	-51.4	111.6	157.6	34.4	0	0	0	0	106.3	N964 V968	N964-S966 VanDerWaalsContact C-N 3.34Å; N964-S966 PolarHBondContact O-N 2.95Å; N964-S966 VanDerWaalsContact O-N 3.09Å; S966-V968 PolarHBondContact O-N 2.95Å
967	F	60.7	Low	55	Low	184 Å²	184	75 Å²	75	81%	0.807	42%	0.421	S	S	*	.			trans	-70.2	86.2	177.5	-71.7	-83.3	0	0	0	107.7	C965	C965-F967 WeakPolarHBondContact O-CD2 3.48Å; C965-F967 PolarHBondContact O-N 2.54Å
968	V	76.3	Confident	57	Low	8 Å²	8	72.3 Å²	72.3	5%	0.048	40%	0.4	C	S	.	.			trans	-82.7	126.8	176.1	-175.5	0	0	0	0	108	D910 G911 V929 T930 S966 D987 S988 N989	D910-V968 CarbonylContact C-O 3.59Å; D910-V968 VanDerWaalsContact C-O 3.28Å; G911-V968 WeakPolarHBondContact CA-O 3.47Å; G911-V968 PolarHBondContact N-O 2.89Å; V929-V968 HydrophobicContact CG1-CG1 4.24Å; T930-V968 HydrophobicContact CG2-CB 4.5Å; T930-V968 HydrophobicContact CG2-CG2 4.25Å; S966-V968 PolarHBondContact O-N 2.95Å; V968-D987 HydrophobicContact CG1-CB 3.52Å; V968-S988 WeakPolarHBondContact CA-OG 3.5Å; V968-N989 VanDerWaalsContact CG2-ND2 3.27Å; V968-N989 WeakPolarHBondContact CG2-ND2 3.42Å
969	S	83.7	Confident	59.1	Low	30 Å²	30	70.6 Å²	70.6	21%	0.21	38%	0.381	C	S	.	.			trans	-110.2	145.6	173.4	67.9	0	0	0	0	111.1	T909 R971 D987 S988	T909-S969 WeakPolarHBondContact O-CA 3.23Å; T909-S969 WeakPolarHBondContact O-CB 3.41Å; S969-R971 PolarHBondContact O-N 2.91Å; S969-D987 CarbonylContact O-C 3.55Å; S969-D987 VanDerWaalsContact O-CA 3.29Å; S969-D987 WeakPolarHBondContact O-CA 3.45Å; S969-S988 PolarHBondContact N-OG 3.17Å; S969-S988 PolarHBondContact O-N 3.39Å; S969-S988 VanDerWaalsContact OG-CB 3.31Å; S969-S988 WeakPolarHBondContact OG-CB 3.15Å
970	I	87	Confident	61.6	Low	0 Å²	0	68.6 Å²	68.6	0%	0	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.3	116.8	174.2	-54.3	-58.2	0	0	0	108.8	Q891 T892 Y908 I913 V929 L973	Q891-I970 WeakPolarHBondContact CB-O 3.29Å; Q891-I970 WeakPolarHBondContact CG-O 3.25Å; T892-I970 HydrophobicContact CG2-CG2 3.88Å; Y908-I970 PolarHBondContact O-N 3.09Å; Y908-I970 VanDerWaalsContact O-N 3.08Å; I913-I970 HydrophobicContact CD1-CD1 4.08Å; I913-I970 HydrophobicContact CG1-CD1 3.83Å; I913-I970 HydrophobicContact CG1-CG1 3.91Å; V929-I970 HydrophobicContact CB-CD1 4.47Å; V929-I970 HydrophobicContact CG2-CD1 3.39Å; I970-L973 HydrophobicContact CG2-CD2 4.09Å; I970-L973 HydrophobicContact CG2-CG 4.01Å
971	R	82.8	Confident	64.2	Low	104 Å²	104	58.4 Å²	58.4	39%	0.392	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	-42.2	179.2	-71.8	-173.3	171.1	-177.3	-1.8	112.7	S969 L986 N990 D1039	S969-R971 PolarHBondContact O-N 2.91Å; R971-L986 HydrophobicContact CB-CB 4.42Å; R971-L986 HydrophobicContact CB-CD2 4.05Å; R971-L986 HydrophobicContact CB-CG 4.18Å; R971-L986 PolarHBondContact N-O 3.37Å; R971-N990 PolarHBondContact NH1-OD1 3.44Å; R971-D1039 IonicContact NH1-OD1 3.96Å; R971-D1039 PolarHBondContact NH1-OD1 3.29Å; R971-D1039 VanDerWaalsContact NH1-OD1 3.09Å; R971-D1039 IonicContact NH2-OD1 3.72Å
972	K	86.4	Confident	66.9	Low	50 Å²	50	53.1 Å²	53.1	22%	0.217	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.8	143.3	-176	-162.5	167.7	-172.4	175.6	0	112	V974 S985 L986 I1042	K972-V974 HydrophobicContact CD-CG2 4.5Å; K972-V974 HydrophobicContact CG-CG2 4.25Å; K972-S985 WeakPolarHBondContact O-CA 3.37Å; K972-L986 HydrophobicContact CB-CB 4.14Å; K972-L986 PolarHBondContact N-O 2.99Å; K972-L986 PolarHBondContact O-N 3.02Å; K972-I1042 HydrophobicContact CD-CB 4.39Å; K972-I1042 VanDerWaalsContact CD-O 3.32Å; K972-I1042 WeakPolarHBondContact CD-O 3.39Å; K972-I1042 WeakPolarHBondContact CE-O 3.45Å; K972-I1042 PolarHBondContact NZ-O 3.17Å
973	L	88.7	Confident	69.9	Low	2 Å²	2	47.6 Å²	47.6	1%	0.01	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.5	140.5	171	-69.6	172.9	0	0	0	109.8	T892 E894 I905 G907 I913 I970 F983 F984	T892-L973 HydrophobicContact CG2-CB 4.09Å; T892-L973 HydrophobicContact CG2-CD1 3.88Å; T892-L973 HydrophobicContact CG2-CG 3.67Å; T892-L973 PolarHBondContact OG1-N 2.76Å; E894-L973 HydrophobicContact CB-CB 4.4Å; I905-L973 HydrophobicContact CB-CD1 4.17Å; I905-L973 HydrophobicContact CD1-CB 3.93Å; I905-L973 HydrophobicContact CD1-CD1 4.05Å; I905-L973 HydrophobicContact CD1-CD2 4.44Å; I905-L973 HydrophobicContact CD1-CG 4.37Å; I905-L973 HydrophobicContact CG1-CB 4.42Å; I905-L973 HydrophobicContact CG1-CD1 4.01Å; G907-L973 VanDerWaalsContact N-CD1 3.31Å; I913-L973 HydrophobicContact CD1-CD2 4.02Å; I913-L973 HydrophobicContact CG1-CD2 4.3Å; I913-L973 HydrophobicContact CG2-CD1 4.09Å; I913-L973 HydrophobicContact CG2-CD2 4.21Å; I970-L973 HydrophobicContact CG2-CD2 4.09Å; I970-L973 HydrophobicContact CG2-CG 4.01Å; L973-F983 HydrophobicContact CD2-CD2 4.29Å; L973-F983 HydrophobicContact CD2-CE2 4.37Å; L973-F984 WeakPolarHBondContact CA-O 3.35Å
974	V	85.9	Confident	72.6	Confident	10 Å²	10	44.1 Å²	44.1	6%	0.061	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.1	127	178.3	-179.8	0	0	0	0	110	K972 F983 F984 I1042 K1044	K972-V974 HydrophobicContact CD-CG2 4.5Å; K972-V974 HydrophobicContact CG-CG2 4.25Å; V974-F983 CarbonylContact O-C 3.58Å; V974-F983 WeakPolarHBondContact O-CA 3.33Å; V974-F984 PolarHBondContact N-O 3.15Å; V974-F984 PolarHBondContact O-N 3.41Å; V974-I1042 HydrophobicContact CB-CG2 4.43Å; V974-I1042 HydrophobicContact CG2-CB 4.41Å; V974-I1042 HydrophobicContact CG2-CG2 3.99Å; V974-K1044 HydrophobicContact CG1-CB 3.82Å; V974-K1044 HydrophobicContact CG1-CD 4.32Å; V974-K1044 HydrophobicContact CG1-CG 4.25Å
975	W	85.2	Confident	75.5	Confident	1 Å²	1	36.3 Å²	36.3	0%	0.004	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.5	139.1	169.6	-69.7	103.8	0	0	0	111.3	E894 T895 H896 P897 I903 I905 L915 F983 I997 K1044	E894-W975 HydrophobicContact CG-CG 4.36Å; E894-W975 PolarHBondContact O-NE1 2.95Å; T895-W975 PolarHBondContact O-NE1 3.04Å; H896-W975 HydrophobicContact CB-CZ2 4.11Å; H896-W975 AromaticContact CD2-CD2 3.84Å; H896-W975 AromaticContact CD2-CE2 3.84Å; H896-W975 AromaticContact CD2-CE3 3.71Å; H896-W975 AromaticContact CD2-CH2 3.66Å; H896-W975 AromaticContact CD2-CZ2 3.76Å; H896-W975 AromaticContact CD2-CZ3 3.64Å; P897-W975 HydrophobicContact CG-CB 4.29Å; I903-W975 HydrophobicContact CD1-CH2 4.48Å; I905-W975 HydrophobicContact CB-CZ2 4.35Å; I905-W975 HydrophobicContact CD1-CD2 4.34Å; I905-W975 HydrophobicContact CD1-CZ2 3.93Å; I905-W975 HydrophobicContact CG1-CZ2 3.96Å; I905-W975 HydrophobicContact CG2-CH2 4.05Å; I905-W975 HydrophobicContact CG2-CZ2 3.61Å; L915-W975 HydrophobicContact CD1-CH2 4.43Å; W975-F983 HydrophobicContact CD2-CB 4.11Å; W975-F983 HydrophobicContact CE3-CB 3.74Å; W975-F983 HydrophobicContact CE3-CD1 4.42Å; W975-F983 HydrophobicContact CH2-CD1 4.25Å; W975-F983 HydrophobicContact CZ3-CB 4.1Å; W975-F983 AromaticContact CZ3-CD1 3.9Å; W975-F983 HydrophobicContact CZ3-CD1 3.9Å; W975-F983 HydrophobicContact CZ3-CG 4.41Å; W975-I997 HydrophobicContact CH2-CD1 3.58Å; W975-I997 HydrophobicContact CZ3-CD1 3.61Å; W975-K1044 WeakPolarHBondContact O-CD 3.38Å; W975-K1044 VanDerWaalsContact O-CE 3.24Å; W975-K1044 WeakPolarHBondContact O-CE 3.3Å; W975-K1044 PolarHBondContact O-NZ 3.38Å
976	S	78.4	Confident	77.9	Confident	5 Å²	5	32.9 Å²	32.9	4%	0.035	17%	0.17	C	C	.	.			trans	-56.4	143.7	170.2	177.6	0	0	0	0	110.9	T978 R979 V982 K1044	S976-T978 PolarHBondContact OG-N 2.71Å; S976-T978 PolarHBondContact OG-OG1 3.06Å; S976-T978 VanDerWaalsContact OG-OG1 3.11Å; S976-R979 WeakPolarHBondContact CB-O 3.49Å; S976-R979 PolarHBondContact OG-N 2.83Å; S976-V982 VanDerWaalsContact CB-O 3.22Å; S976-V982 WeakPolarHBondContact CB-O 3.48Å; S976-V982 PolarHBondContact N-O 3.03Å; S976-K1044 PolarHBondContact O-NZ 2.85Å
977	A	69.4	Low	79.7	Confident	40 Å²	40	29.4 Å²	29.4	33%	0.331	15%	0.145	S	C	.	.	S	Bend	trans	-82.4	-22.8	175.2	0	0	0	0	0	112.7	K1044 P1046	A977-K1044 HydrophobicContact CB-CD 4.32Å; A977-K1044 HydrophobicContact CB-CG 4.06Å; A977-P1046 HydrophobicContact CB-CB 3.67Å; A977-P1046 VanDerWaalsContact CB-CD 3.44Å; A977-P1046 HydrophobicContact CB-CG 3.68Å
978	T	67.3	Low	80.6	Confident	53 Å²	53	21.9 Å²	21.9	33%	0.325	12%	0.115	S	C	.	.	S	Bend	trans	-101.7	-28.9	-170.2	55.3	0	0	0	0	112.6	S976	S976-T978 PolarHBondContact OG-N 2.71Å; S976-T978 PolarHBondContact OG-OG1 3.06Å; S976-T978 VanDerWaalsContact OG-OG1 3.11Å
979	R	70	Confident	80.4	Confident	79 Å²	79	24.6 Å²	24.6	30%	0.298	13%	0.13	S	C	.	.			trans	-131.4	123.8	-178	-62.8	-172.4	69.1	-168.9	1.1	110.5	S976 S981 V982 E1094	S976-R979 WeakPolarHBondContact CB-O 3.49Å; S976-R979 PolarHBondContact OG-N 2.83Å; R979-S981 VanDerWaalsContact C-N 3.27Å; R979-S981 PolarHBondContact O-N 3.07Å; R979-V982 HydrophobicContact CB-CB 4.06Å; R979-V982 HydrophobicContact CB-CG2 3.76Å; R979-V982 PolarHBondContact O-N 3.32Å; R979-E1094 IonicContact CZ-OE1 3.98Å; R979-E1094 VanDerWaalsContact CZ-OE1 3.29Å; R979-E1094 IonicContact NE-OE1 3.09Å; R979-E1094 PolarHBondContact NE-OE1 3.09Å; R979-E1094 IonicContact NH2-OE1 3.63Å; R979-E1094 PolarHBondContact NH2-OE1 3.35Å
980	S	77.3	Confident	79.7	Confident	28 Å²	28	23.7 Å²	23.7	20%	0.196	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-21.5	-175.1	-62.6	0	0	0	0	112.6	H896 V982 E1094 N1095	H896-S980 PolarHBondContact NE2-O 3.34Å; S980-V982 VanDerWaalsContact C-N 3.32Å; S980-E1094 PolarHBondContact N-OE2 3.21Å; S980-N1095 VanDerWaalsContact CB-OD1 3.3Å; S980-N1095 WeakPolarHBondContact CB-OD1 3.48Å; S980-N1095 PolarHBondContact OG-OD1 2.84Å
981	S	77.9	Confident	78.8	Confident	0 Å²	0	25.9 Å²	25.9	0%	0	13%	0.133	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83	-6.4	176.9	67.4	0	0	0	0	114.6	R979 N996 I997 I998	R979-S981 VanDerWaalsContact C-N 3.27Å; R979-S981 PolarHBondContact O-N 3.07Å; S981-N996 WeakPolarHBondContact CB-OD1 3.41Å; S981-N996 PolarHBondContact OG-OD1 2.8Å; S981-I997 WeakPolarHBondContact O-CB 3.46Å; S981-I997 WeakPolarHBondContact O-CG1 3.26Å; S981-I997 PolarHBondContact O-N 3.3Å; S981-I998 VanDerWaalsContact CB-CD1 3.43Å
982	V	80.5	Confident	78.4	Confident	5 Å²	5	21.2 Å²	21.2	3%	0.03	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	134.3	-169.3	-179.8	0	0	0	0	111	S976 R979 S980 F984 L994 W995 N996	S976-V982 VanDerWaalsContact CB-O 3.22Å; S976-V982 WeakPolarHBondContact CB-O 3.48Å; S976-V982 PolarHBondContact N-O 3.03Å; R979-V982 HydrophobicContact CB-CB 4.06Å; R979-V982 HydrophobicContact CB-CG2 3.76Å; R979-V982 PolarHBondContact O-N 3.32Å; S980-V982 VanDerWaalsContact C-N 3.32Å; V982-F984 HydrophobicContact CG1-CZ 4.43Å; V982-L994 HydrophobicContact CG1-CD1 4.15Å; V982-L994 HydrophobicContact CG1-CD2 4.13Å; V982-L994 HydrophobicContact CG1-CG 3.87Å; V982-W995 CarbonylContact C-O 3.57Å; V982-W995 VanDerWaalsContact CA-O 3.23Å; V982-W995 WeakPolarHBondContact CA-O 3.38Å; V982-N996 HydrophobicContact CG2-CB 4.18Å
983	F	86.2	Confident	77.9	Confident	0 Å²	0	19.8 Å²	19.8	0%	0	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	160.6	169.5	67.5	-89.4	0	0	0	111.2	I905 I913 W927 L973 V974 W975 W995 I997	I905-F983 HydrophobicContact CD1-CB 4.07Å; I905-F983 HydrophobicContact CD1-CD2 3.95Å; I905-F983 HydrophobicContact CD1-CG 3.99Å; I913-F983 HydrophobicContact CD1-CE2 4.23Å; I913-F983 HydrophobicContact CG2-CE2 4.09Å; I913-F983 HydrophobicContact CG2-CZ 4.34Å; W927-F983 HydrophobicContact CE3-CZ 4.21Å; W927-F983 HydrophobicContact CH2-CE1 4.13Å; W927-F983 HydrophobicContact CH2-CZ 4.18Å; W927-F983 HydrophobicContact CZ3-CE1 4.33Å; W927-F983 AromaticContact CZ3-CZ 3.97Å; W927-F983 HydrophobicContact CZ3-CZ 3.97Å; L973-F983 HydrophobicContact CD2-CD2 4.29Å; L973-F983 HydrophobicContact CD2-CE2 4.37Å; V974-F983 CarbonylContact O-C 3.58Å; V974-F983 WeakPolarHBondContact O-CA 3.33Å; W975-F983 HydrophobicContact CD2-CB 4.11Å; W975-F983 HydrophobicContact CE3-CB 3.74Å; W975-F983 HydrophobicContact CE3-CD1 4.42Å; W975-F983 HydrophobicContact CH2-CD1 4.25Å; W975-F983 HydrophobicContact CZ3-CB 4.1Å; W975-F983 AromaticContact CZ3-CD1 3.9Å; W975-F983 HydrophobicContact CZ3-CD1 3.9Å; W975-F983 HydrophobicContact CZ3-CG 4.41Å; F983-W995 HydrophobicContact CD1-CB 3.78Å; F983-W995 HydrophobicContact CD2-CB 3.85Å; F983-W995 AromaticContact CD2-CD1 3.67Å; F983-W995 AromaticContact CD2-CG 3.93Å; F983-W995 HydrophobicContact CD2-CG 3.93Å; F983-W995 HydrophobicContact CE1-CB 3.42Å; F983-W995 VanDerWaalsContact CE1-CB 3.42Å; F983-W995 HydrophobicContact CE1-CG 4.11Å; F983-W995 HydrophobicContact CE2-CB 3.49Å; F983-W995 VanDerWaalsContact CE2-CB 3.49Å; F983-W995 AromaticContact CE2-CD1 3.27Å; F983-W995 HydrophobicContact CE2-CD2 4.05Å; F983-W995 AromaticContact CE2-CG 3.3Å; F983-W995 HydrophobicContact CE2-CG 3.3Å; F983-W995 AromaticContact CE2-NE1 3.96Å; F983-W995 HydrophobicContact CG-CB 3.99Å; F983-W995 HydrophobicContact CZ-CB 3.26Å; F983-W995 AromaticContact CZ-CD1 3.9Å; F983-W995 AromaticContact CZ-CD2 3.98Å; F983-W995 HydrophobicContact CZ-CD2 3.98Å; F983-W995 AromaticContact CZ-CG 3.41Å; F983-W995 HydrophobicContact CZ-CG 3.41Å; F983-W995 VanDerWaalsContact CZ-CG 3.41Å; F983-W995 PolarHBondContact N-O 3.26Å; F983-W995 PolarHBondContact O-N 3.48Å; F983-I997 HydrophobicContact CD1-CD1 4.09Å; F983-I997 HydrophobicContact CD1-CG1 4.09Å; F983-I997 HydrophobicContact CE1-CD1 4.07Å; F983-I997 HydrophobicContact CE1-CG1 3.8Å
984	F	83.3	Confident	77.6	Confident	14 Å²	14	23.4 Å²	23.4	6%	0.061	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	143.2	179.2	-58.4	-86.5	0	0	0	109.8	L973 V974 V982 V992 I993 L994 P1068 I1070	L973-F984 WeakPolarHBondContact CA-O 3.35Å; V974-F984 PolarHBondContact N-O 3.15Å; V974-F984 PolarHBondContact O-N 3.41Å; V982-F984 HydrophobicContact CG1-CZ 4.43Å; F984-V992 HydrophobicContact CD1-CG1 4.4Å; F984-I993 CarbonylContact C-O 3.44Å; F984-I993 WeakPolarHBondContact CA-O 3.36Å; F984-L994 HydrophobicContact CD1-CB 4.21Å; F984-L994 HydrophobicContact CD1-CG 4.45Å; F984-L994 HydrophobicContact CE1-CB 4.14Å; F984-L994 HydrophobicContact CE1-CD1 3.77Å; F984-L994 HydrophobicContact CE1-CG 4.05Å; F984-L994 HydrophobicContact CZ-CD1 4.24Å; F984-P1068 HydrophobicContact CZ-CB 4.46Å; F984-P1068 HydrophobicContact CZ-CG 4.4Å; F984-I1070 HydrophobicContact CD1-CD1 3.96Å; F984-I1070 HydrophobicContact CE1-CD1 3.69Å; F984-I1070 HydrophobicContact CE1-CG1 4.45Å; F984-I1070 HydrophobicContact CZ-CD1 4.38Å
985	S	84.3	Confident	77.5	Confident	0 Å²	0	24.6 Å²	24.6	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	135.6	169.9	64.9	0	0	0	0	110.9	K972 V992 I993 W995	K972-S985 WeakPolarHBondContact O-CA 3.37Å; S985-V992 WeakPolarHBondContact O-CA 3.47Å; S985-I993 PolarHBondContact N-O 3.42Å; S985-I993 PolarHBondContact O-N 3.28Å; S985-W995 PolarHBondContact OG-NE1 3.38Å
986	L	82.4	Confident	77.2	Confident	2 Å²	2	25 Å²	25	1%	0.01	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	129.4	164.4	-175.8	66.3	0	0	0	109	R971 K972 Q991 V992 I1040 I1042	R971-L986 HydrophobicContact CB-CB 4.42Å; R971-L986 HydrophobicContact CB-CD2 4.05Å; R971-L986 HydrophobicContact CB-CG 4.18Å; R971-L986 PolarHBondContact N-O 3.37Å; K972-L986 HydrophobicContact CB-CB 4.14Å; K972-L986 PolarHBondContact N-O 2.99Å; K972-L986 PolarHBondContact O-N 3.02Å; L986-Q991 WeakPolarHBondContact CA-O 3.49Å; L986-V992 HydrophobicContact CD1-CG2 3.99Å; L986-I1040 HydrophobicContact CD1-CB 4.15Å; L986-I1040 HydrophobicContact CD1-CD1 3.93Å; L986-I1040 HydrophobicContact CD2-CB 4.2Å; L986-I1040 WeakPolarHBondContact CD2-O 3.43Å; L986-I1042 HydrophobicContact CB-CD1 3.59Å; L986-I1042 HydrophobicContact CB-CG1 4.06Å; L986-I1042 HydrophobicContact CD1-CD1 4.35Å; L986-I1042 HydrophobicContact CD1-CG1 4.45Å; L986-I1042 HydrophobicContact CD2-CG1 4.41Å; L986-I1042 HydrophobicContact CG-CD1 4.44Å
987	D	79.2	Confident	77.2	Confident	2 Å²	2	24.9 Å²	24.9	1%	0.011	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	174.4	175.1	80.9	6.1	0	0	0	113	V968 S969 N989 N990 Q991	V968-D987 HydrophobicContact CG1-CB 3.52Å; S969-D987 CarbonylContact O-C 3.55Å; S969-D987 VanDerWaalsContact O-CA 3.29Å; S969-D987 WeakPolarHBondContact O-CA 3.45Å; D987-N989 VanDerWaalsContact C-N 3.27Å; D987-N989 VanDerWaalsContact OD1-CA 3.26Å; D987-N989 WeakPolarHBondContact OD1-CA 3.28Å; D987-N989 WeakPolarHBondContact OD1-CB 3.31Å; D987-N989 PolarHBondContact OD1-N 2.84Å; D987-N990 WeakPolarHBondContact O-CA 3.04Å; D987-N990 PolarHBondContact O-N 3.33Å; D987-N990 PolarHBondContact OD1-N 3.22Å; D987-Q991 PolarHBondContact N-O 3.38Å; D987-Q991 WeakPolarHBondContact OD1-CB 3.48Å; D987-Q991 PolarHBondContact OD1-N 2.9Å
988	S	80.6	Confident	77.4	Confident	26 Å²	26	23.8 Å²	23.8	18%	0.182	12%	0.123	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-18.7	177.4	61.3	0	0	0	0	114.3	V968 S969 N990	V968-S988 WeakPolarHBondContact CA-OG 3.5Å; S969-S988 PolarHBondContact N-OG 3.17Å; S969-S988 PolarHBondContact O-N 3.39Å; S969-S988 VanDerWaalsContact OG-CB 3.31Å; S969-S988 WeakPolarHBondContact OG-CB 3.15Å; S988-N990 PolarHBondContact O-N 2.96Å
989	N	73.1	Confident	77.4	Confident	65 Å²	65	24.7 Å²	24.7	35%	0.348	13%	0.125	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.2	11	167.1	-64.9	-15.3	0	0	0	111.2	V968 D987 Q991	V968-N989 VanDerWaalsContact CG2-ND2 3.27Å; V968-N989 WeakPolarHBondContact CG2-ND2 3.42Å; D987-N989 VanDerWaalsContact C-N 3.27Å; D987-N989 VanDerWaalsContact OD1-CA 3.26Å; D987-N989 WeakPolarHBondContact OD1-CA 3.28Å; D987-N989 WeakPolarHBondContact OD1-CB 3.31Å; D987-N989 PolarHBondContact OD1-N 2.84Å; N989-Q991 HydrophobicContact CB-CG 4.18Å; N989-Q991 PolarHBondContact O-N 3.25Å
990	N	67.6	Low	77.2	Confident	12 Å²	12	22 Å²	22	6%	0.064	12%	0.117	C	C	.	.			trans	67.8	29.3	164.2	-99.1	-16	0	0	0	108.7	R971 D987 S988 I1037 D1039	R971-N990 PolarHBondContact NH1-OD1 3.44Å; D987-N990 WeakPolarHBondContact O-CA 3.04Å; D987-N990 PolarHBondContact O-N 3.33Å; D987-N990 PolarHBondContact OD1-N 3.22Å; S988-N990 PolarHBondContact O-N 2.96Å; N990-I1037 WeakPolarHBondContact CB-O 3.46Å; N990-I1037 VanDerWaalsContact CG-O 3.23Å; N990-I1037 CarbonylContact O-C 3.58Å; N990-I1037 VanDerWaalsContact O-CA 3.28Å; N990-I1037 WeakPolarHBondContact O-CA 3.45Å; N990-I1037 VanDerWaalsContact O-CB 3.25Å; N990-I1037 WeakPolarHBondContact O-CB 3.24Å; N990-I1037 PolarHBondContact O-N 3.09Å; N990-D1039 PolarHBondContact ND2-N 3.18Å; N990-D1039 PolarHBondContact ND2-OD1 3.05Å; N990-D1039 WeakPolarHBondContact OD1-CA 3.36Å; N990-D1039 PolarHBondContact OD1-N 3.41Å
991	Q	68.4	Low	76.4	Confident	45 Å²	45	21 Å²	21	21%	0.21	11%	0.109	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	136	176.9	-52.6	-167.8	3.6	0	0	111.1	L986 D987 N989 C1035	L986-Q991 WeakPolarHBondContact CA-O 3.49Å; D987-Q991 PolarHBondContact N-O 3.38Å; D987-Q991 WeakPolarHBondContact OD1-CB 3.48Å; D987-Q991 PolarHBondContact OD1-N 2.9Å; N989-Q991 HydrophobicContact CB-CG 4.18Å; N989-Q991 PolarHBondContact O-N 3.25Å; Q991-C1035 WeakPolarHBondContact CA-O 3.46Å; Q991-C1035 WeakPolarHBondContact CB-O 3.46Å
992	V	74.8	Confident	75.3	Confident	6 Å²	6	24.9 Å²	24.9	4%	0.036	13%	0.13	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	123.9	170.7	-174.1	0	0	0	0	108.8	F984 S985 L986 I1037 I1040 I1042 I1070 L1072	F984-V992 HydrophobicContact CD1-CG1 4.4Å; S985-V992 WeakPolarHBondContact O-CA 3.47Å; L986-V992 HydrophobicContact CD1-CG2 3.99Å; V992-I1037 HydrophobicContact CG2-CD1 4.34Å; V992-I1040 HydrophobicContact CG2-CD1 4.28Å; V992-I1042 HydrophobicContact CB-CD1 4.35Å; V992-I1042 HydrophobicContact CG1-CD1 3.74Å; V992-I1042 HydrophobicContact CG2-CD1 3.82Å; V992-I1042 HydrophobicContact CG2-CG1 4.31Å; V992-I1070 HydrophobicContact CG1-CD1 4.26Å; V992-L1072 HydrophobicContact CG2-CD2 3.85Å
993	I	75.5	Confident	73.7	Confident	20 Å²	20	28.9 Å²	28.9	10%	0.103	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	131.8	-179.3	-54.1	170.7	0	0	0	108.8	V929 F984 S985 W995	V929-I993 HydrophobicContact CB-CD1 4.5Å; V929-I993 HydrophobicContact CG1-CD1 3.5Å; V929-I993 HydrophobicContact CG2-CD1 4.29Å; F984-I993 CarbonylContact C-O 3.44Å; F984-I993 WeakPolarHBondContact CA-O 3.36Å; S985-I993 PolarHBondContact N-O 3.42Å; S985-I993 PolarHBondContact O-N 3.28Å; I993-W995 HydrophobicContact CG2-CD2 4.46Å; I993-W995 HydrophobicContact CG2-CZ2 3.95Å
994	L	82.6	Confident	71.6	Confident	79 Å²	79	30.5 Å²	30.5	41%	0.414	16%	0.159	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92	132.3	173.4	-178.5	155.6	0	0	0	110.1	V982 F984 V1083	V982-L994 HydrophobicContact CG1-CD1 4.15Å; V982-L994 HydrophobicContact CG1-CD2 4.13Å; V982-L994 HydrophobicContact CG1-CG 3.87Å; F984-L994 HydrophobicContact CD1-CB 4.21Å; F984-L994 HydrophobicContact CD1-CG 4.45Å; F984-L994 HydrophobicContact CE1-CB 4.14Å; F984-L994 HydrophobicContact CE1-CD1 3.77Å; F984-L994 HydrophobicContact CE1-CG 4.05Å; F984-L994 HydrophobicContact CZ-CD1 4.24Å; L994-V1083 HydrophobicContact CD1-CG1 4.37Å
995	W	82.6	Confident	69.3	Low	34 Å²	34	34.6 Å²	34.6	13%	0.129	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.6	124.4	177.1	-59.3	86.9	0	0	0	109.8	I913 W927 V929 V982 F983 S985 I993 I1000	I913-W995 HydrophobicContact CD1-CZ2 3.91Å; W927-W995 HydrophobicContact CB-CH2 4.11Å; W927-W995 HydrophobicContact CB-CZ3 3.97Å; W927-W995 AromaticContact CD1-CZ3 3.89Å; W927-W995 HydrophobicContact CG-CE3 4.37Å; W927-W995 HydrophobicContact CG-CZ3 4.03Å; V929-W995 HydrophobicContact CG2-CZ2 4.11Å; V982-W995 CarbonylContact C-O 3.57Å; V982-W995 VanDerWaalsContact CA-O 3.23Å; V982-W995 WeakPolarHBondContact CA-O 3.38Å; F983-W995 HydrophobicContact CD1-CB 3.78Å; F983-W995 HydrophobicContact CD2-CB 3.85Å; F983-W995 AromaticContact CD2-CD1 3.67Å; F983-W995 AromaticContact CD2-CG 3.93Å; F983-W995 HydrophobicContact CD2-CG 3.93Å; F983-W995 HydrophobicContact CE1-CB 3.42Å; F983-W995 VanDerWaalsContact CE1-CB 3.42Å; F983-W995 HydrophobicContact CE1-CG 4.11Å; F983-W995 HydrophobicContact CE2-CB 3.49Å; F983-W995 VanDerWaalsContact CE2-CB 3.49Å; F983-W995 AromaticContact CE2-CD1 3.27Å; F983-W995 HydrophobicContact CE2-CD2 4.05Å; F983-W995 AromaticContact CE2-CG 3.3Å; F983-W995 HydrophobicContact CE2-CG 3.3Å; F983-W995 AromaticContact CE2-NE1 3.96Å; F983-W995 HydrophobicContact CG-CB 3.99Å; F983-W995 HydrophobicContact CZ-CB 3.26Å; F983-W995 AromaticContact CZ-CD1 3.9Å; F983-W995 AromaticContact CZ-CD2 3.98Å; F983-W995 HydrophobicContact CZ-CD2 3.98Å; F983-W995 AromaticContact CZ-CG 3.41Å; F983-W995 HydrophobicContact CZ-CG 3.41Å; F983-W995 VanDerWaalsContact CZ-CG 3.41Å; F983-W995 PolarHBondContact N-O 3.26Å; F983-W995 PolarHBondContact O-N 3.48Å; S985-W995 PolarHBondContact OG-NE1 3.38Å; I993-W995 HydrophobicContact CG2-CD2 4.46Å; I993-W995 HydrophobicContact CG2-CZ2 3.95Å; W995-I1000 HydrophobicContact CE3-CD1 3.94Å
996	N	80.8	Confident	66.9	Low	11 Å²	11	40.6 Å²	40.6	6%	0.059	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	109.3	170.4	-175	-0.9	0	0	0	109.9	S981 V982 I998 D999 I1000	S981-N996 WeakPolarHBondContact CB-OD1 3.41Å; S981-N996 PolarHBondContact OG-OD1 2.8Å; V982-N996 HydrophobicContact CG2-CB 4.18Å; N996-I998 VanDerWaalsContact C-N 3.26Å; N996-I998 PolarHBondContact O-N 3.44Å; N996-I998 PolarHBondContact OD1-N 3.26Å; N996-D999 HydrophobicContact CB-CB 4.21Å; N996-D999 WeakPolarHBondContact CB-OD2 3.26Å; N996-D999 PolarHBondContact ND2-OD1 3.12Å; N996-D999 PolarHBondContact ND2-OD2 2.87Å; N996-D999 PolarHBondContact O-N 3.45Å; N996-I1000 WeakPolarHBondContact O-CD1 3.48Å; N996-I1000 WeakPolarHBondContact O-CG1 3.25Å; N996-I1000 PolarHBondContact O-N 3.37Å; N996-I1000 VanDerWaalsContact O-N 3.15Å
997	I	78.3	Confident	64.6	Low	1 Å²	1	44.6 Å²	44.6	1%	0.005	24%	0.242	C	C	.	.	H	α-helix	trans	-58.6	-39.1	-176.3	-66.9	175.1	0	0	0	111.4	W975 S981 F983 I1000 F1001 L1098 F1102	W975-I997 HydrophobicContact CH2-CD1 3.58Å; W975-I997 HydrophobicContact CZ3-CD1 3.61Å; S981-I997 WeakPolarHBondContact O-CB 3.46Å; S981-I997 WeakPolarHBondContact O-CG1 3.26Å; S981-I997 PolarHBondContact O-N 3.3Å; F983-I997 HydrophobicContact CD1-CD1 4.09Å; F983-I997 HydrophobicContact CD1-CG1 4.09Å; F983-I997 HydrophobicContact CE1-CD1 4.07Å; F983-I997 HydrophobicContact CE1-CG1 3.8Å; I997-I1000 PolarHBondContact O-N 3.25Å; I997-F1001 HydrophobicContact CG2-CD2 3.53Å; I997-F1001 HydrophobicContact CG2-CE2 3.18Å; I997-F1001 HydrophobicContact CG2-CZ 4.23Å; I997-F1001 WeakPolarHBondContact O-CD2 3.39Å; I997-F1001 PolarHBondContact O-N 2.88Å; I997-F1001 VanDerWaalsContact O-N 3.11Å; I997-L1098 HydrophobicContact CB-CD1 4.4Å; I997-L1098 HydrophobicContact CG2-CD1 4.25Å; I997-F1102 HydrophobicContact CG2-CZ 4.21Å
998	I	72.4	Confident	62.3	Low	18 Å²	18	51 Å²	51	9%	0.092	28%	0.275	C	S	.	.	H	α-helix	trans	-64.6	-46.7	-178.4	-67.3	167.5	0	0	0	110.8	S981 N996 I1000 F1001 N1002 L1097 L1098	S981-I998 VanDerWaalsContact CB-CD1 3.43Å; N996-I998 VanDerWaalsContact C-N 3.26Å; N996-I998 PolarHBondContact O-N 3.44Å; N996-I998 PolarHBondContact OD1-N 3.26Å; I998-I1000 VanDerWaalsContact C-N 3.29Å; I998-I1000 PolarHBondContact O-N 3.19Å; I998-F1001 PolarHBondContact O-N 3.44Å; I998-N1002 PolarHBondContact O-N 3.4Å; I998-N1002 PolarHBondContact O-ND2 2.8Å; I998-L1097 HydrophobicContact CB-CD2 4.23Å; I998-L1097 HydrophobicContact CD1-CD2 3.79Å; I998-L1097 HydrophobicContact CG1-CD2 3.7Å; I998-L1097 HydrophobicContact CG2-CD2 3.52Å; I998-L1098 HydrophobicContact CD1-CD1 4.44Å; I998-L1098 HydrophobicContact CG1-CD1 4.11Å
999	D	67.7	Low	59.8	Low	72 Å²	72	57.8 Å²	57.8	39%	0.385	30%	0.304	S	S	.	.	H	α-helix	trans	-65.6	-38.3	-178.1	-61.8	-14.5	0	0	0	111	N996 F1001 N1002 L1003	N996-D999 HydrophobicContact CB-CB 4.21Å; N996-D999 WeakPolarHBondContact CB-OD2 3.26Å; N996-D999 PolarHBondContact ND2-OD1 3.12Å; N996-D999 PolarHBondContact ND2-OD2 2.87Å; N996-D999 PolarHBondContact O-N 3.45Å; D999-F1001 VanDerWaalsContact C-N 3.32Å; D999-F1001 PolarHBondContact O-N 3.16Å; D999-N1002 PolarHBondContact O-N 3.24Å; D999-L1003 WeakPolarHBondContact O-CD1 3.48Å; D999-L1003 WeakPolarHBondContact O-CG 3.43Å; D999-L1003 PolarHBondContact O-N 3.15Å; D999-L1003 VanDerWaalsContact O-N 3.09Å
1000	I	65.1	Low	57.6	Low	23 Å²	23	62 Å²	62	12%	0.118	33%	0.325	C	S	.	.	H	α-helix	trans	-62.6	-40.5	177.5	-66	164.8	0	0	0	110.9	P934 W995 N996 I997 I998 N1004	P934-I1000 HydrophobicContact CB-CG2 4.04Å; P934-I1000 HydrophobicContact CG-CG2 3.74Å; W995-I1000 HydrophobicContact CE3-CD1 3.94Å; N996-I1000 WeakPolarHBondContact O-CD1 3.48Å; N996-I1000 WeakPolarHBondContact O-CG1 3.25Å; N996-I1000 PolarHBondContact O-N 3.37Å; N996-I1000 VanDerWaalsContact O-N 3.15Å; I997-I1000 PolarHBondContact O-N 3.25Å; I998-I1000 VanDerWaalsContact C-N 3.29Å; I998-I1000 PolarHBondContact O-N 3.19Å; I1000-N1004 PolarHBondContact O-N 3.03Å
1001	F	61.1	Low	55.5	Low	5 Å²	5	68.5 Å²	68.5	2%	0.022	36%	0.36	C	S	.	.	H	α-helix	trans	-70.7	-38.7	177.1	-75.1	-57	0	0	0	113.1	L925 I997 I998 D999 L1003 N1004 N1005 T1101 F1102 F1105	L925-F1001 HydrophobicContact CD1-CE1 3.63Å; L925-F1001 HydrophobicContact CD1-CE2 4.31Å; L925-F1001 HydrophobicContact CD1-CZ 3.45Å; L925-F1001 VanDerWaalsContact CD1-CZ 3.45Å; L925-F1001 HydrophobicContact CD2-CE1 4.13Å; L925-F1001 HydrophobicContact CG-CE1 4.31Å; L925-F1001 HydrophobicContact CG-CZ 4.33Å; I997-F1001 HydrophobicContact CG2-CD2 3.53Å; I997-F1001 HydrophobicContact CG2-CE2 3.18Å; I997-F1001 HydrophobicContact CG2-CZ 4.23Å; I997-F1001 WeakPolarHBondContact O-CD2 3.39Å; I997-F1001 PolarHBondContact O-N 2.88Å; I997-F1001 VanDerWaalsContact O-N 3.11Å; I998-F1001 PolarHBondContact O-N 3.44Å; D999-F1001 VanDerWaalsContact C-N 3.32Å; D999-F1001 PolarHBondContact O-N 3.16Å; F1001-L1003 VanDerWaalsContact C-N 3.27Å; F1001-L1003 PolarHBondContact O-N 3.19Å; F1001-N1004 PolarHBondContact O-N 2.87Å; F1001-N1005 PolarHBondContact O-N 3.32Å; F1001-T1101 HydrophobicContact CB-CG2 3.76Å; F1001-T1101 HydrophobicContact CD1-CG2 4.05Å; F1001-T1101 HydrophobicContact CD2-CG2 3.29Å; F1001-T1101 HydrophobicContact CE1-CG2 4.42Å; F1001-T1101 HydrophobicContact CE2-CG2 3.69Å; F1001-T1101 HydrophobicContact CG-CG2 3.46Å; F1001-T1101 VanDerWaalsContact CG-CG2 3.46Å; F1001-T1101 HydrophobicContact CZ-CG2 4.23Å; F1001-F1102 HydrophobicContact CE2-CE1 4.01Å; F1001-F1102 HydrophobicContact CE2-CZ 4.26Å; F1001-F1102 HydrophobicContact CZ-CD1 4.38Å; F1001-F1102 AromaticContact CZ-CE1 3.86Å; F1001-F1102 HydrophobicContact CZ-CE1 3.86Å; F1001-F1105 HydrophobicContact CD1-CD2 4.45Å; F1001-F1105 AromaticContact CD1-CE2 3.33Å; F1001-F1105 HydrophobicContact CD1-CE2 3.33Å; F1001-F1105 AromaticContact CD1-CZ 3.53Å; F1001-F1105 HydrophobicContact CD1-CZ 3.53Å; F1001-F1105 AromaticContact CE1-CD2 3.81Å; F1001-F1105 HydrophobicContact CE1-CD2 3.81Å; F1001-F1105 HydrophobicContact CE1-CE1 4.28Å; F1001-F1105 AromaticContact CE1-CE2 3Å; F1001-F1105 HydrophobicContact CE1-CE2 3Å; F1001-F1105 AromaticContact CE1-CZ 3.29Å; F1001-F1105 HydrophobicContact CE1-CZ 3.29Å; F1001-F1105 HydrophobicContact CG-CE2 4.28Å; F1001-F1105 HydrophobicContact CZ-CD2 4.12Å; F1001-F1105 AromaticContact CZ-CE2 3.71Å; F1001-F1105 HydrophobicContact CZ-CE2 3.71Å; F1001-F1105 HydrophobicContact CZ-CZ 4.35Å
1002	N	53.8	Low	53.5	Low	83 Å²	83	73.5 Å²	73.5	44%	0.444	39%	0.388	S	S	.	.	H	α-helix	trans	-64.1	-33.9	177.4	-73	-22.4	0	0	0	112.2	I998 D999 N1005 N1006	I998-N1002 PolarHBondContact O-N 3.4Å; I998-N1002 PolarHBondContact O-ND2 2.8Å; D999-N1002 PolarHBondContact O-N 3.24Å; N1002-N1005 PolarHBondContact O-N 2.95Å; N1002-N1006 PolarHBondContact O-N 2.78Å
1003	L	47.8	Very low	51.3	Low	88 Å²	88	79 Å²	79	46%	0.461	42%	0.422	S	S	.	.	H	α-helix	trans	-63.4	-39.3	174.1	-77.8	158.7	0	0	0	112.6	D999 F1001 S1007	D999-L1003 WeakPolarHBondContact O-CD1 3.48Å; D999-L1003 WeakPolarHBondContact O-CG 3.43Å; D999-L1003 PolarHBondContact O-N 3.15Å; D999-L1003 VanDerWaalsContact O-N 3.09Å; F1001-L1003 VanDerWaalsContact C-N 3.27Å; F1001-L1003 PolarHBondContact O-N 3.19Å; L1003-S1007 PolarHBondContact O-N 3.13Å
1004	N	41.7	Very low	48.9	Very low	34 Å²	34	87.7 Å²	87.7	18%	0.182	46%	0.459	C	S	.	.	H	α-helix	trans	-68.9	-38.1	179.9	-80.7	-6.5	0	0	0	112.2	T936 I1000 F1001 S1007	T936-N1004 WeakPolarHBondContact CG2-ND2 3.28Å; I1000-N1004 PolarHBondContact O-N 3.03Å; F1001-N1004 PolarHBondContact O-N 2.87Å; N1004-S1007 PolarHBondContact O-N 2.78Å; N1004-S1007 PolarHBondContact O-OG 3.21Å
1005	N	36.4	Very low	46.3	Very low	101 Å²	101	89.2 Å²	89.2	54%	0.54	48%	0.476	S	S	.	.	H	α-helix	trans	-69.6	-33.7	-179.9	-74	-16.6	0	0	0	112.8	F1001 N1002	F1001-N1005 PolarHBondContact O-N 3.32Å; N1002-N1005 PolarHBondContact O-N 2.95Å
1006	N	32.8	Very low	43.5	Very low	126 Å²	126	92.5 Å²	92.5	67%	0.674	51%	0.505	S	S	*	.	H	α-helix	trans	-77	-22.5	176.9	-70.4	-20.8	0	0	0	113.3	N1002 L1008	N1002-N1006 PolarHBondContact O-N 2.78Å; N1006-L1008 VanDerWaalsContact C-N 3.33Å
1007	S	34.2	Very low	41	Very low	85 Å²	85	100.5 Å²	100.5	59%	0.594	55%	0.546	S	S	*	.	H	α-helix	trans	-79.1	-12.1	177.6	72.8	0	0	0	0	114.5	L1003 N1004	L1003-S1007 PolarHBondContact O-N 3.13Å; N1004-S1007 PolarHBondContact O-N 2.78Å; N1004-S1007 PolarHBondContact O-OG 3.21Å
1008	L	31.5	Very low	38.4	Very low	136 Å²	136	109.2 Å²	109.2	71%	0.712	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.3	-1.2	-177.1	-83.1	158	0	0	0	114.9	N1006	N1006-L1008 VanDerWaalsContact C-N 3.33Å
1009	H	28.6	Very low	36.2	Very low	170 Å²	170	115 Å²	115	79%	0.787	62%	0.616	S	S	*	*			trans	-113	0.8	-176.7	-104	-72.9	0	0	0	116.9	N1011	H1009-N1011 PolarHBondContact O-N 3.4Å; H1009-N1011 VanDerWaalsContact O-N 3.15Å
1010	L	25.5	Very low	34.2	Very low	152 Å²	152	118.2 Å²	118.2	80%	0.796	63%	0.632	S	S	*	*			trans	-86.5	78.9	168.8	-93.9	95.5	0	0	0	110.6
1011	N	24.2	Very low	32.3	Very low	150 Å²	150	128.3 Å²	128.3	80%	0.802	67%	0.671	S	S	*	*	S	Bend	trans	174.7	80.5	149.5	-86.6	-25.1	0	0	0	108.4	H1009	H1009-N1011 PolarHBondContact O-N 3.4Å; H1009-N1011 VanDerWaalsContact O-N 3.15Å
1012	N	27	Very low	30.4	Very low	150 Å²	150	135.8 Å²	135.8	80%	0.802	71%	0.708	S	S	*	*	S	Bend	trans	-179	103.4	141.1	-89.3	-22.2	0	0	0	110.8
1013	T	28.1	Very low	29	Very low	120 Å²	120	139 Å²	139	74%	0.736	72%	0.723	S	S	*	*			trans	48.9	107.9	136.7	58.1	0	0	0	0	120
1014	K	24.1	Very low	27.7	Very low	203 Å²	203	141.8 Å²	141.8	88%	0.883	74%	0.739	S	S	*	*			trans	41.1	106.9	132.8	-67.9	178.1	176.3	177	0	117.5
1015	S	27.7	Very low	26.9	Very low	112 Å²	112	145.8 Å²	145.8	78%	0.783	76%	0.764	S	S	*	*				171.2	122.1	113.4	44.9	0	0	0	0	112.2
1016	S	24.4	Very low	26.3	Very low	103 Å²	103	146.3 Å²	146.3	72%	0.72	77%	0.767	S	S	*	*			trans	30	113.5	144	58.3	0	0	0	0	119.8
1017	L	29	Very low	26.2	Very low	179 Å²	179	146.4 Å²	146.4	94%	0.937	77%	0.774	S	S	*	*				-165	129.9	114.5	-98.6	150.7	0	0	0	110.3
1018	K	23.2	Very low	25.9	Very low	184 Å²	184	146.3 Å²	146.3	80%	0.8	77%	0.774	S	S	*	*			trans	-74	145.5	179.5	-74.1	169.7	166.7	179.1	0	110.8
1019	N	27.4	Very low	25.6	Very low	140 Å²	140	145.5 Å²	145.5	75%	0.749	77%	0.77	S	S	*	*			trans	155.6	92.3	138.1	-77.3	-1.4	0	0	0	106.8
1020	D	23.8	Very low	25.6	Very low	138 Å²	138	142.7 Å²	142.7	74%	0.738	76%	0.756	S	S	*	*				84	87	95	-75.6	-10	0	0	0	110.8
1021	Y	26.1	Very low	25.7	Very low	236 Å²	236	142 Å²	142	93%	0.925	75%	0.753	S	S	*	*			trans	178.6	96.5	130.2	-83.9	-64.4	0	0	0	106.9
1022	M	21.2	Very low	25.9	Very low	162 Å²	162	139.7 Å²	139.7	80%	0.798	74%	0.739	S	S	*	*			trans	-75.7	119.3	174.1	-80.6	178.6	61.7	0	0	109.9
1023	I	24	Very low	25.9	Very low	149 Å²	149	138.5 Å²	138.5	76%	0.764	73%	0.732	S	S	*	*			trans	-118.8	107.5	148.4	-61	178.8	0	0	0	106.1	V1025	I1023-V1025 HydrophobicContact CG2-CG2 4.08Å; I1023-V1025 PolarHBondContact O-N 2.72Å; I1023-V1025 VanDerWaalsContact O-N 3.1Å
1024	N	21.8	Very low	25.9	Very low	147 Å²	147	136.2 Å²	136.2	79%	0.786	72%	0.721	S	S	*	*			trans	-59	106.1	165.5	-91.7	-20.3	0	0	0	108
1025	V	24.7	Very low	26.2	Very low	119 Å²	119	128.6 Å²	128.6	72%	0.721	69%	0.693	S	S	*	*			trans	-101.5	109.3	162.9	-176	0	0	0	0	106.9	I1023	I1023-V1025 HydrophobicContact CG2-CG2 4.08Å; I1023-V1025 PolarHBondContact O-N 2.72Å; I1023-V1025 VanDerWaalsContact O-N 3.1Å
1026	N	23.5	Very low	26.2	Very low	111 Å²	111	130.9 Å²	130.9	59%	0.594	69%	0.691	S	S	*	*			trans	-57.7	128.8	175.9	-125.1	-8.3	0	0	0	109	S1028 D1029	N1026-S1028 PolarHBondContact O-N 3.14Å; N1026-D1029 PolarHBondContact O-N 2.76Å
1027	P	29.9	Very low	26.5	Very low	128 Å²	128	126.1 Å²	126.1	83%	0.831	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.2	10.3	-180	26.8	-32.1	0	0	0	114.3
1028	S	28.1	Very low	26.5	Very low	84 Å²	84	123.1 Å²	123.1	59%	0.587	64%	0.642	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	-14.4	178.1	54	0	0	0	0	114.6	N1026 K1030	N1026-S1028 PolarHBondContact O-N 3.14Å; S1028-K1030 VanDerWaalsContact C-N 3.3Å; S1028-K1030 PolarHBondContact O-N 2.83Å; S1028-K1030 VanDerWaalsContact O-N 3.13Å
1029	D	25.7	Very low	26.9	Very low	118 Å²	118	118.3 Å²	118.3	63%	0.631	63%	0.626	S	S	*	*			trans	-91.6	59.2	-179.5	-69.8	-12.9	0	0	0	111.3	N1026 N1031	N1026-D1029 PolarHBondContact O-N 2.76Å; D1029-N1031 PolarHBondContact O-N 3.39Å
1030	K	29.3	Very low	27.3	Very low	112 Å²	112	112.4 Å²	112.4	49%	0.487	59%	0.594	S	S	.	*			trans	-82.8	93.6	157.4	-73.5	-172	-179.2	-178	0	106.3	S1028 I1032	S1028-K1030 VanDerWaalsContact C-N 3.3Å; S1028-K1030 PolarHBondContact O-N 2.83Å; S1028-K1030 VanDerWaalsContact O-N 3.13Å; K1030-I1032 PolarHBondContact O-N 3.03Å
1031	N	27.4	Very low	28	Very low	137 Å²	137	107 Å²	107	73%	0.733	57%	0.567	S	S	*	*			trans	-65.4	73.2	169.7	-75	-19.1	0	0	0	109.8	D1029 L1033	D1029-N1031 PolarHBondContact O-N 3.39Å; N1031-L1033 VanDerWaalsContact C-N 3.26Å; N1031-L1033 PolarHBondContact O-N 2.74Å; N1031-L1033 VanDerWaalsContact O-N 3.11Å
1032	I	27.4	Very low	28.7	Very low	102 Å²	102	96 Å²	96	52%	0.523	52%	0.524	S	S	.	.			trans	-71.4	94.1	157.3	-60.2	172.3	0	0	0	103.9	K1030 S1034	K1030-I1032 PolarHBondContact O-N 3.03Å; I1032-S1034 PolarHBondContact O-N 2.92Å
1033	L	27.9	Very low	29.5	Very low	125 Å²	125	88.8 Å²	88.8	65%	0.654	49%	0.489	S	S	*	.			trans	-71	83.4	166.5	-76	161.6	0	0	0	106.8	N1031	N1031-L1033 VanDerWaalsContact C-N 3.26Å; N1031-L1033 PolarHBondContact O-N 2.74Å; N1031-L1033 VanDerWaalsContact O-N 3.11Å
1034	S	28	Very low	30.3	Very low	71 Å²	71	84.4 Å²	84.4	50%	0.497	47%	0.465	S	S	.	.			trans	-89.6	129.1	165.8	55.3	0	0	0	0	108.4	I1032	I1032-S1034 PolarHBondContact O-N 2.92Å
1035	C	29.9	Very low	30.8	Very low	43 Å²	43	78.8 Å²	78.8	29%	0.291	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	134.6	170.2	40.4	0	0	0	0	106.9	Q991 I1037	Q991-C1035 WeakPolarHBondContact CA-O 3.46Å; Q991-C1035 WeakPolarHBondContact CB-O 3.46Å; C1035-I1037 HydrophobicContact CB-CD1 3.52Å; C1035-I1037 HydrophobicContact CB-CG1 4.11Å; C1035-I1037 WeakPolarHBondContact SG-CD1 2.96Å
1036	Q	27	Very low	31.3	Very low	160 Å²	160	75.3 Å²	75.3	75%	0.748	41%	0.414	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.1	115.1	-178.4	-170.4	-179.8	-3.5	0	0	108.9
1037	I	31.6	Very low	31.7	Very low	4 Å²	4	72.7 Å²	72.7	2%	0.021	40%	0.404	C	S	.	.			trans	-143.9	103.4	-162.5	-58.4	136.8	0	0	0	115	N990 V992 C1035 D1039 I1040 L1072 Y1074	N990-I1037 WeakPolarHBondContact CB-O 3.46Å; N990-I1037 VanDerWaalsContact CG-O 3.23Å; N990-I1037 CarbonylContact O-C 3.58Å; N990-I1037 VanDerWaalsContact O-CA 3.28Å; N990-I1037 WeakPolarHBondContact O-CA 3.45Å; N990-I1037 VanDerWaalsContact O-CB 3.25Å; N990-I1037 WeakPolarHBondContact O-CB 3.24Å; N990-I1037 PolarHBondContact O-N 3.09Å; V992-I1037 HydrophobicContact CG2-CD1 4.34Å; C1035-I1037 HydrophobicContact CB-CD1 3.52Å; C1035-I1037 HydrophobicContact CB-CG1 4.11Å; C1035-I1037 WeakPolarHBondContact SG-CD1 2.96Å; I1037-D1039 PolarHBondContact O-N 3.45Å; I1037-I1040 HydrophobicContact CB-CD1 3.37Å; I1037-I1040 HydrophobicContact CB-CG1 4.2Å; I1037-I1040 HydrophobicContact CD1-CD1 4.01Å; I1037-I1040 HydrophobicContact CG1-CD1 4.27Å; I1037-I1040 HydrophobicContact CG2-CD1 3.2Å; I1037-I1040 HydrophobicContact CG2-CG1 3.54Å; I1037-I1040 WeakPolarHBondContact O-CD1 3.45Å; I1037-L1072 HydrophobicContact CB-CD1 4.25Å; I1037-L1072 HydrophobicContact CD1-CD1 3.29Å; I1037-L1072 HydrophobicContact CG1-CD1 3.76Å; I1037-L1072 HydrophobicContact CG2-CB 4.47Å; I1037-L1072 HydrophobicContact CG2-CD1 3.78Å; I1037-Y1074 HydrophobicContact CG2-CD1 4.23Å; I1037-Y1074 HydrophobicContact CG2-CE1 3.23Å; I1037-Y1074 HydrophobicContact CG2-CE2 4.12Å; I1037-Y1074 WeakPolarHBondContact CG2-OH 3.41Å
1038	N	29	Very low	31.8	Very low	115 Å²	115	71 Å²	71	62%	0.615	40%	0.395	S	S	*	.	S	Bend	trans	-53.8	120.8	-179.8	-62.7	-13.4	0	0	0	114.6	Y1074	N1038-Y1074 WeakPolarHBondContact O-CD1 3.02Å; N1038-Y1074 WeakPolarHBondContact O-CE1 3.3Å
1039	D	31.8	Very low	32	Very low	83 Å²	83	78 Å²	78	44%	0.444	41%	0.409	S	S	.	.	S	Bend	trans	45.1	102.9	173.6	-61.9	-38.4	0	0	0	116.9	R971 N990 I1037	R971-D1039 IonicContact NH1-OD1 3.96Å; R971-D1039 PolarHBondContact NH1-OD1 3.29Å; R971-D1039 VanDerWaalsContact NH1-OD1 3.09Å; R971-D1039 IonicContact NH2-OD1 3.72Å; N990-D1039 PolarHBondContact ND2-N 3.18Å; N990-D1039 PolarHBondContact ND2-OD1 3.05Å; N990-D1039 WeakPolarHBondContact OD1-CA 3.36Å; N990-D1039 PolarHBondContact OD1-N 3.41Å; I1037-D1039 PolarHBondContact O-N 3.45Å
1040	I	36	Very low	32.2	Very low	16 Å²	16	80.9 Å²	80.9	8%	0.082	42%	0.418	C	S	.	.			trans	-134.3	152.8	-173.4	-50.9	160.3	0	0	0	112.8	L986 V992 I1037 I1042 L1072	L986-I1040 HydrophobicContact CD1-CB 4.15Å; L986-I1040 HydrophobicContact CD1-CD1 3.93Å; L986-I1040 HydrophobicContact CD2-CB 4.2Å; L986-I1040 WeakPolarHBondContact CD2-O 3.43Å; V992-I1040 HydrophobicContact CG2-CD1 4.28Å; I1037-I1040 HydrophobicContact CB-CD1 3.37Å; I1037-I1040 HydrophobicContact CB-CG1 4.2Å; I1037-I1040 HydrophobicContact CD1-CD1 4.01Å; I1037-I1040 HydrophobicContact CG1-CD1 4.27Å; I1037-I1040 HydrophobicContact CG2-CD1 3.2Å; I1037-I1040 HydrophobicContact CG2-CG1 3.54Å; I1037-I1040 WeakPolarHBondContact O-CD1 3.45Å; I1040-I1042 HydrophobicContact CG2-CG1 4.48Å; I1040-L1072 HydrophobicContact CD1-CB 4.11Å; I1040-L1072 HydrophobicContact CD1-CD1 4.06Å; I1040-L1072 HydrophobicContact CD1-CD2 3.79Å; I1040-L1072 HydrophobicContact CD1-CG 4.22Å; I1040-L1072 HydrophobicContact CG1-CB 4.02Å; I1040-L1072 HydrophobicContact CG1-CD2 4.46Å; I1040-L1072 HydrophobicContact CG2-CB 3.77Å; I1040-L1072 HydrophobicContact CG2-CD2 3.71Å; I1040-L1072 HydrophobicContact CG2-CG 4.34Å
1041	C	38.2	Very low	32.2	Very low	25 Å²	25	81.8 Å²	81.8	17%	0.169	43%	0.427	C	S	.	.			trans	-119	119.3	162.4	-140.2	0	0	0	0	108.6	C550	C550-C1041 HydrophobicContact CB-CB 3.97Å; C550-C1041 PolarHBondContact N-SG 3.3Å; C550-C1041 VanDerWaalsContact N-SG 3.38Å; C550-C1041 WeakPolarHBondContact SG-CB 3.4Å
1042	I	40.8	Very low	32.1	Very low	4 Å²	4	81.1 Å²	81.1	2%	0.021	42%	0.423	C	S	.	.			trans	-83.2	131.5	179.4	-60.3	-178.3	0	0	0	109.6	K972 V974 L986 V992 I1040	K972-I1042 HydrophobicContact CD-CB 4.39Å; K972-I1042 VanDerWaalsContact CD-O 3.32Å; K972-I1042 WeakPolarHBondContact CD-O 3.39Å; K972-I1042 WeakPolarHBondContact CE-O 3.45Å; K972-I1042 PolarHBondContact NZ-O 3.17Å; V974-I1042 HydrophobicContact CB-CG2 4.43Å; V974-I1042 HydrophobicContact CG2-CB 4.41Å; V974-I1042 HydrophobicContact CG2-CG2 3.99Å; L986-I1042 HydrophobicContact CB-CD1 3.59Å; L986-I1042 HydrophobicContact CB-CG1 4.06Å; L986-I1042 HydrophobicContact CD1-CD1 4.35Å; L986-I1042 HydrophobicContact CD1-CG1 4.45Å; L986-I1042 HydrophobicContact CD2-CG1 4.41Å; L986-I1042 HydrophobicContact CG-CD1 4.44Å; V992-I1042 HydrophobicContact CB-CD1 4.35Å; V992-I1042 HydrophobicContact CG1-CD1 3.74Å; V992-I1042 HydrophobicContact CG2-CD1 3.82Å; V992-I1042 HydrophobicContact CG2-CG1 4.31Å; I1040-I1042 HydrophobicContact CG2-CG1 4.48Å
1043	S	37.9	Very low	32	Very low	11 Å²	11	88.4 Å²	88.4	8%	0.077	44%	0.444	C	S	.	.			trans	-122	156.1	171.8	-165.2	0	0	0	0	112.4	C552	C552-S1043 VanDerWaalsContact CB-OG 3.24Å; C552-S1043 WeakPolarHBondContact CB-OG 3.4Å; C552-S1043 PolarHBondContact SG-OG 3.11Å
1044	K	40.3	Very low	32	Very low	57 Å²	57	90.1 Å²	90.1	25%	0.248	45%	0.452	C	S	.	.			trans	-94.4	115.6	-176.6	-174	175.7	-177.4	162	0	110.3	C552 V974 W975 S976 A977	C552-K1044 PolarHBondContact SG-O 2.67Å; V974-K1044 HydrophobicContact CG1-CB 3.82Å; V974-K1044 HydrophobicContact CG1-CD 4.32Å; V974-K1044 HydrophobicContact CG1-CG 4.25Å; W975-K1044 WeakPolarHBondContact O-CD 3.38Å; W975-K1044 VanDerWaalsContact O-CE 3.24Å; W975-K1044 WeakPolarHBondContact O-CE 3.3Å; W975-K1044 PolarHBondContact O-NZ 3.38Å; S976-K1044 PolarHBondContact O-NZ 2.85Å; A977-K1044 HydrophobicContact CB-CD 4.32Å; A977-K1044 HydrophobicContact CB-CG 4.06Å
1045	M	32.9	Very low	31.9	Very low	30 Å²	30	91.4 Å²	91.4	15%	0.148	46%	0.461	C	S	.	.	B	Isolated β-bridge	trans	-118.2	110.6	168.6	-90.6	-177.2	140.5	0	0	110.8	Q557 I560 L1069 I1071	Q557-M1045 HydrophobicContact CB-CG 3.99Å; Q557-M1045 WeakPolarHBondContact O-CE 3.44Å; I560-M1045 HydrophobicContact CD1-CE 4.49Å; M1045-L1069 HydrophobicContact SD-CD2 3.4Å; M1045-L1069 WeakPolarHBondContact SD-CD2 3.39Å; M1045-I1071 HydrophobicContact CE-CD1 4.27Å; M1045-I1071 HydrophobicContact CG-CD1 4.34Å; M1045-I1071 HydrophobicContact SD-CD1 3.36Å; M1045-I1071 WeakPolarHBondContact SD-CD1 3.35Å; M1045-I1071 HydrophobicContact SD-CG1 4.48Å
1046	P	34.8	Very low	31.8	Very low	45 Å²	45	94.3 Å²	94.3	29%	0.292	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-74.8	126.1	150.1	13.2	-24.5	0	0	0	111.8	Q557 A977 S1048	Q557-P1046 VanDerWaalsContact NE2-CD 3.31Å; Q557-P1046 PolarHBondContact OE1-O 3.04Å; Q557-P1046 VanDerWaalsContact OE1-O 3.12Å; A977-P1046 HydrophobicContact CB-CB 3.67Å; A977-P1046 VanDerWaalsContact CB-CD 3.44Å; A977-P1046 HydrophobicContact CB-CG 3.68Å; P1046-S1048 PolarHBondContact O-N 3.3Å
1047	C	32.2	Very low	31.8	Very low	57 Å²	57	91.8 Å²	91.8	39%	0.385	48%	0.482	S	S	.	.	P	Polyproline II helix	trans	-62.6	120.1	166.1	-64.9	0	0	0	0	109.9
1048	S	32.6	Very low	31.6	Very low	91 Å²	91	96.4 Å²	96.4	64%	0.636	52%	0.515	S	S	*	.	P	Polyproline II helix	trans	-60.2	142.2	174.6	166.6	0	0	0	0	112.2	P1046 H1050	P1046-S1048 PolarHBondContact O-N 3.3Å; S1048-H1050 VanDerWaalsContact C-N 3.34Å; S1048-H1050 PolarHBondContact O-N 2.78Å; S1048-H1050 PolarHBondContact OG-CD2 2.96Å; S1048-H1050 VanDerWaalsContact OG-CD2 3.31Å; S1048-H1050 PolarHBondContact OG-N 3.36Å
1049	R	30.5	Very low	31.4	Very low	233 Å²	233	99 Å²	99	88%	0.879	53%	0.526	S	S	*	.			trans	-86.3	16.8	179.7	-80.7	-176.4	175.6	169.4	-0.3	114.4	I1051	R1049-I1051 VanDerWaalsContact C-N 3.26Å; R1049-I1051 PolarHBondContact O-N 3.43Å
1050	H	31.2	Very low	31.1	Very low	177 Å²	177	99.1 Å²	99.1	82%	0.819	54%	0.539	S	S	*	.			trans	-84.3	55.9	-176.5	-73.3	-59.8	0	0	0	114	S1048	S1048-H1050 VanDerWaalsContact C-N 3.34Å; S1048-H1050 PolarHBondContact O-N 2.78Å; S1048-H1050 PolarHBondContact OG-CD2 2.96Å; S1048-H1050 VanDerWaalsContact OG-CD2 3.31Å; S1048-H1050 PolarHBondContact OG-N 3.36Å
1051	I	28.3	Very low	30.6	Very low	132 Å²	132	104.3 Å²	104.3	68%	0.677	58%	0.577	S	S	*	*			trans	-141.5	96	163.3	-54.7	176.5	0	0	0	106.9	R1049	R1049-I1051 VanDerWaalsContact C-N 3.26Å; R1049-I1051 PolarHBondContact O-N 3.43Å
1052	N	26.6	Very low	30	Very low	123 Å²	123	109.8 Å²	109.8	66%	0.658	60%	0.603	S	S	*	*			trans	168.4	84.7	151.7	-85.5	-25.4	0	0	0	111.1
1053	R	24.4	Very low	29.4	Very low	255 Å²	255	113.7 Å²	113.7	96%	0.962	63%	0.631	S	S	*	*			trans	-127.1	77.8	145.6	-89.1	-171.5	176.2	167.5	0	107.5
1054	I	29.2	Very low	29	Very low	161 Å²	161	118.5 Å²	118.5	83%	0.826	66%	0.66	S	S	*	*			trans	-99.8	108.6	154.8	-62.8	178.5	0	0	0	105.9
1055	S	26	Very low	28.7	Very low	98 Å²	98	122.6 Å²	122.6	69%	0.685	68%	0.679	S	S	*	*			trans	-65	149.7	169	49.4	0	0	0	0	111.1
1056	S	26.2	Very low	29	Very low	103 Å²	103	123.7 Å²	123.7	72%	0.72	69%	0.69	S	S	*	*	S	Bend	trans	66.3	109.9	158.3	59.4	0	0	0	0	119
1057	S	27.7	Very low	29.1	Very low	107 Å²	107	122.4 Å²	122.4	75%	0.748	68%	0.682	S	S	*	*			trans	77	111.7	145.5	70.9	0	0	0	0	118.2
1058	S	26.4	Very low	29.4	Very low	102 Å²	102	120.9 Å²	120.9	71%	0.713	67%	0.672	S	S	*	*			trans	90.8	103.6	145.3	-38.1	0	0	0	0	117.2
1059	I	25.7	Very low	29.7	Very low	168 Å²	168	117.8 Å²	117.8	86%	0.862	65%	0.648	S	S	*	*	S	Bend	trans	90.4	116.7	144.2	-54.4	159.3	0	0	0	116.8
1060	A	25.5	Very low	30.2	Very low	87 Å²	87	107.6 Å²	107.6	72%	0.719	61%	0.611	S	S	*	*			trans	75.6	112.7	166.7	0	0	0	0	0	119.2	I1062	A1060-I1062 PolarHBondContact O-N 3.12Å
1061	S	24.9	Very low	30.9	Very low	125 Å²	125	99.3 Å²	99.3	87%	0.874	57%	0.572	S	S	*	*			trans	-76.2	106.6	167.1	53.2	0	0	0	0	110.5	S1063	S1061-S1063 PolarHBondContact O-N 2.99Å
1062	I	26.4	Very low	31.5	Very low	139 Å²	139	93 Å²	93	71%	0.713	54%	0.54	S	S	*	.			trans	-81.4	111.3	168.1	-61.5	172.3	0	0	0	107.9	A1060 T1064	A1060-I1062 PolarHBondContact O-N 3.12Å; I1062-T1064 HydrophobicContact CG2-CG2 4.06Å; I1062-T1064 PolarHBondContact O-N 3.36Å
1063	S	28	Very low	32.2	Very low	86 Å²	86	87.7 Å²	87.7	60%	0.601	51%	0.511	S	S	*	.			trans	-77.6	98.7	168.5	56.8	0	0	0	0	109.4	S1061 H1065	S1061-S1063 PolarHBondContact O-N 2.99Å; S1063-H1065 PolarHBondContact O-CD2 3.03Å; S1063-H1065 PolarHBondContact O-N 3.34Å; S1063-H1065 PolarHBondContact OG-NE2 3.31Å
1064	T	29.6	Very low	32.9	Very low	112 Å²	112	77.8 Å²	77.8	69%	0.687	47%	0.474	S	S	*	.			trans	-75.9	108.1	175.2	51.7	0	0	0	0	109.9	I1062	I1062-T1064 HydrophobicContact CG2-CG2 4.06Å; I1062-T1064 PolarHBondContact O-N 3.36Å
1065	H	33.3	Very low	33.2	Very low	143 Å²	143	72.2 Å²	72.2	66%	0.662	45%	0.448	S	S	*	.			trans	-74.9	127.4	177.9	-67.1	-86.4	0	0	0	110.9	S1063 S1067	S1063-H1065 PolarHBondContact O-CD2 3.03Å; S1063-H1065 PolarHBondContact O-N 3.34Å; S1063-H1065 PolarHBondContact OG-NE2 3.31Å; H1065-S1067 PolarHBondContact O-N 2.87Å
1066	S	40.5	Very low	33.7	Very low	54 Å²	54	71 Å²	71	38%	0.378	43%	0.431	S	S	.	.			trans	-87.6	101.7	175.4	55.3	0	0	0	0	110.5
1067	S	37	Very low	34.1	Very low	17 Å²	17	68.8 Å²	68.8	12%	0.119	41%	0.409	C	S	.	.	P	Polyproline II helix	trans	-75.8	136.8	171.3	-48.5	0	0	0	0	109.8	H1065 L1069	H1065-S1067 PolarHBondContact O-N 2.87Å; S1067-L1069 PolarHBondContact O-N 3.28Å
1068	P	37.5	Very low	34.5	Very low	26 Å²	26	66.5 Å²	66.5	17%	0.169	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-65.9	127.5	172.8	26.2	-29.4	0	0	0	109.5	F984 V1083	F984-P1068 HydrophobicContact CZ-CB 4.46Å; F984-P1068 HydrophobicContact CZ-CG 4.4Å; P1068-V1083 HydrophobicContact CG-CB 4.07Å; P1068-V1083 HydrophobicContact CG-CG2 4.19Å
1069	L	38.5	Very low	35.1	Very low	26 Å²	26	62.1 Å²	62.1	14%	0.136	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.6	125.5	173.9	-168.4	97.6	0	0	0	108.4	M1045 S1067 I1071 T1080 W1082	M1045-L1069 HydrophobicContact SD-CD2 3.4Å; M1045-L1069 WeakPolarHBondContact SD-CD2 3.39Å; S1067-L1069 PolarHBondContact O-N 3.28Å; L1069-I1071 HydrophobicContact CD2-CD1 3.67Å; L1069-I1071 HydrophobicContact CD2-CG1 3.54Å; L1069-I1071 HydrophobicContact CG-CG1 4.34Å; L1069-T1080 HydrophobicContact CD2-CG2 4.46Å; L1069-W1082 HydrophobicContact CD1-CD2 4.07Å; L1069-W1082 HydrophobicContact CD1-CE3 4.46Å; L1069-W1082 HydrophobicContact CD1-CH2 4.3Å; L1069-W1082 HydrophobicContact CD1-CZ2 3.88Å
1070	I	42.3	Very low	35.6	Very low	19 Å²	19	56.6 Å²	56.6	10%	0.097	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	125.6	170.5	-55.9	176	0	0	0	107.3	F984 V992 L1072 Y1081 V1083	F984-I1070 HydrophobicContact CD1-CD1 3.96Å; F984-I1070 HydrophobicContact CE1-CD1 3.69Å; F984-I1070 HydrophobicContact CE1-CG1 4.45Å; F984-I1070 HydrophobicContact CZ-CD1 4.38Å; V992-I1070 HydrophobicContact CG1-CD1 4.26Å; I1070-L1072 HydrophobicContact CG2-CD2 3.56Å; I1070-L1072 HydrophobicContact CG2-CG 4.46Å; I1070-Y1081 PolarHBondContact N-O 3.24Å; I1070-Y1081 PolarHBondContact O-N 3.46Å; I1070-V1083 HydrophobicContact CD1-CG2 3.71Å; I1070-V1083 HydrophobicContact CG1-CG2 4.09Å
1071	I	44.6	Very low	36.2	Very low	2 Å²	2	56.6 Å²	56.6	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	126.6	175.7	-60	150	0	0	0	107.8	I560 I596 M1045 L1069 F1073 I1078 S1079 T1080	I560-I1071 HydrophobicContact CD1-CD1 3.67Å; I596-I1071 HydrophobicContact CD1-CB 4.21Å; I596-I1071 HydrophobicContact CD1-CD1 3.19Å; I596-I1071 HydrophobicContact CD1-CG1 3.64Å; I596-I1071 HydrophobicContact CD1-CG2 3.61Å; M1045-I1071 HydrophobicContact CE-CD1 4.27Å; M1045-I1071 HydrophobicContact CG-CD1 4.34Å; M1045-I1071 HydrophobicContact SD-CD1 3.36Å; M1045-I1071 WeakPolarHBondContact SD-CD1 3.35Å; M1045-I1071 HydrophobicContact SD-CG1 4.48Å; L1069-I1071 HydrophobicContact CD2-CD1 3.67Å; L1069-I1071 HydrophobicContact CD2-CG1 3.54Å; L1069-I1071 HydrophobicContact CG-CG1 4.34Å; I1071-F1073 HydrophobicContact CB-CE2 4.36Å; I1071-F1073 HydrophobicContact CG2-CD2 4.07Å; I1071-F1073 HydrophobicContact CG2-CE1 4.43Å; I1071-F1073 HydrophobicContact CG2-CE2 3.55Å; I1071-F1073 HydrophobicContact CG2-CZ 3.73Å; I1071-I1078 HydrophobicContact CG2-CG2 3.84Å; I1071-S1079 WeakPolarHBondContact CA-O 3.09Å; I1071-T1080 HydrophobicContact CG1-CG2 4.23Å
1072	L	42.2	Very low	36.8	Very low	1 Å²	1	58.2 Å²	58.2	1%	0.005	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	120.5	174.1	-37.2	173.2	0	0	0	108.4	V992 I1037 I1040 I1070 Y1074 S1079 Y1081	V992-L1072 HydrophobicContact CG2-CD2 3.85Å; I1037-L1072 HydrophobicContact CB-CD1 4.25Å; I1037-L1072 HydrophobicContact CD1-CD1 3.29Å; I1037-L1072 HydrophobicContact CG1-CD1 3.76Å; I1037-L1072 HydrophobicContact CG2-CB 4.47Å; I1037-L1072 HydrophobicContact CG2-CD1 3.78Å; I1040-L1072 HydrophobicContact CD1-CB 4.11Å; I1040-L1072 HydrophobicContact CD1-CD1 4.06Å; I1040-L1072 HydrophobicContact CD1-CD2 3.79Å; I1040-L1072 HydrophobicContact CD1-CG 4.22Å; I1040-L1072 HydrophobicContact CG1-CB 4.02Å; I1040-L1072 HydrophobicContact CG1-CD2 4.46Å; I1040-L1072 HydrophobicContact CG2-CB 3.77Å; I1040-L1072 HydrophobicContact CG2-CD2 3.71Å; I1040-L1072 HydrophobicContact CG2-CG 4.34Å; I1070-L1072 HydrophobicContact CG2-CD2 3.56Å; I1070-L1072 HydrophobicContact CG2-CG 4.46Å; L1072-Y1074 HydrophobicContact CB-CE2 4.41Å; L1072-S1079 WeakPolarHBondContact CB-OG 3.49Å; L1072-S1079 PolarHBondContact N-O 3.42Å; L1072-S1079 PolarHBondContact O-N 3.3Å; L1072-S1079 PolarHBondContact O-OG 3.37Å; L1072-Y1081 HydrophobicContact CD1-CD2 3.44Å; L1072-Y1081 VanDerWaalsContact CD1-CD2 3.44Å; L1072-Y1081 HydrophobicContact CD1-CE2 3.1Å; L1072-Y1081 HydrophobicContact CG-CD2 3.78Å; L1072-Y1081 HydrophobicContact CG-CE2 3.84Å
1073	F	40.6	Very low	37.4	Very low	10 Å²	10	53 Å²	53	4%	0.044	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	110.7	174.2	-70.5	-83.3	0	0	0	109.2	C550 I560 T562 I596 I1071 I1078	C550-F1073 HydrophobicContact CB-CD2 4.16Å; C550-F1073 HydrophobicContact CB-CE2 4.29Å; I560-F1073 HydrophobicContact CB-CZ 4.35Å; I560-F1073 HydrophobicContact CD1-CZ 4.2Å; I560-F1073 HydrophobicContact CG2-CE1 4.35Å; I560-F1073 HydrophobicContact CG2-CE2 3.85Å; I560-F1073 HydrophobicContact CG2-CZ 3.43Å; I560-F1073 VanDerWaalsContact CG2-CZ 3.43Å; T562-F1073 HydrophobicContact CG2-CD1 3.65Å; T562-F1073 HydrophobicContact CG2-CE1 3.61Å; T562-F1073 HydrophobicContact CG2-CG 4.17Å; T562-F1073 HydrophobicContact CG2-CZ 4.1Å; I596-F1073 HydrophobicContact CD1-CZ 4.42Å; I1071-F1073 HydrophobicContact CB-CE2 4.36Å; I1071-F1073 HydrophobicContact CG2-CD2 4.07Å; I1071-F1073 HydrophobicContact CG2-CE1 4.43Å; I1071-F1073 HydrophobicContact CG2-CE2 3.55Å; I1071-F1073 HydrophobicContact CG2-CZ 3.73Å; F1073-I1078 HydrophobicContact CD1-CD1 4.27Å; F1073-I1078 HydrophobicContact CD1-CG1 3.98Å; F1073-I1078 HydrophobicContact CD1-CG2 4.46Å; F1073-I1078 HydrophobicContact CE1-CD1 3.96Å; F1073-I1078 HydrophobicContact CE1-CG1 4.11Å; F1073-I1078 HydrophobicContact CE1-CG2 4.25Å
1074	Y	39.5	Very low	37.6	Very low	47 Å²	47	54 Å²	54	18%	0.184	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	160.4	164.8	-55.7	-99.7	0	0	0	109.6	I1037 N1038 L1072 H1076 K1077 S1079	I1037-Y1074 HydrophobicContact CG2-CD1 4.23Å; I1037-Y1074 HydrophobicContact CG2-CE1 3.23Å; I1037-Y1074 HydrophobicContact CG2-CE2 4.12Å; I1037-Y1074 WeakPolarHBondContact CG2-OH 3.41Å; N1038-Y1074 WeakPolarHBondContact O-CD1 3.02Å; N1038-Y1074 WeakPolarHBondContact O-CE1 3.3Å; L1072-Y1074 HydrophobicContact CB-CE2 4.41Å; Y1074-H1076 PolarHBondContact O-N 3.49Å; Y1074-K1077 WeakPolarHBondContact CA-O 3.28Å; Y1074-K1077 VanDerWaalsContact CB-O 3.25Å; Y1074-K1077 WeakPolarHBondContact CB-O 3.46Å; Y1074-K1077 HydrophobicContact CD2-CB 3.65Å; Y1074-K1077 HydrophobicContact CD2-CD 3.95Å; Y1074-K1077 HydrophobicContact CD2-CG 3.79Å; Y1074-K1077 WeakPolarHBondContact CD2-O 3.38Å; Y1074-K1077 HydrophobicContact CE2-CB 4.39Å; Y1074-K1077 HydrophobicContact CE2-CD 3.83Å; Y1074-K1077 HydrophobicContact CE2-CG 4.1Å; Y1074-K1077 HydrophobicContact CG-CB 3.99Å; Y1074-K1077 PolarHBondContact N-O 3.38Å; Y1074-K1077 PolarHBondContact O-N 2.92Å; Y1074-S1079 WeakPolarHBondContact CE2-OG 3.43Å
1075	P	34.6	Very low	37.8	Very low	44 Å²	44	52.8 Å²	52.8	29%	0.286	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-26.6	172.1	-24.6	33	0	0	0	114.4
1076	H	37.7	Very low	37.6	Very low	72 Å²	72	56.1 Å²	56.1	33%	0.333	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.1	8.5	-175.9	-52.6	-53.8	0	0	0	114.4	F490 Y1074	F490-H1076 WeakPolarHBondContact CD2-O 3.23Å; Y1074-H1076 PolarHBondContact O-N 3.49Å
1077	K	34.3	Very low	37.3	Very low	58 Å²	58	63.2 Å²	63.2	25%	0.252	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	138.2	-172.2	179.9	-179.3	-176.8	-173.9	0	109.7	I488 F490 Y1074	I488-K1077 WeakPolarHBondContact O-CE 3.34Å; F490-K1077 HydrophobicContact CD2-CB 4.24Å; F490-K1077 HydrophobicContact CD2-CG 4.3Å; Y1074-K1077 WeakPolarHBondContact CA-O 3.28Å; Y1074-K1077 VanDerWaalsContact CB-O 3.25Å; Y1074-K1077 WeakPolarHBondContact CB-O 3.46Å; Y1074-K1077 HydrophobicContact CD2-CB 3.65Å; Y1074-K1077 HydrophobicContact CD2-CD 3.95Å; Y1074-K1077 HydrophobicContact CD2-CG 3.79Å; Y1074-K1077 WeakPolarHBondContact CD2-O 3.38Å; Y1074-K1077 HydrophobicContact CE2-CB 4.39Å; Y1074-K1077 HydrophobicContact CE2-CD 3.83Å; Y1074-K1077 HydrophobicContact CE2-CG 4.1Å; Y1074-K1077 HydrophobicContact CG-CB 3.99Å; Y1074-K1077 PolarHBondContact N-O 3.38Å; Y1074-K1077 PolarHBondContact O-N 2.92Å
1078	I	36.7	Very low	36.9	Very low	58 Å²	58	68.4 Å²	68.4	30%	0.297	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	129.1	162.3	-56.4	172.7	0	0	0	105.7	I596 I1071 F1073	I596-I1078 HydrophobicContact CG2-CB 4.43Å; I596-I1078 HydrophobicContact CG2-CG2 3.48Å; I596-I1078 VanDerWaalsContact CG2-CG2 3.48Å; I1071-I1078 HydrophobicContact CG2-CG2 3.84Å; F1073-I1078 HydrophobicContact CD1-CD1 4.27Å; F1073-I1078 HydrophobicContact CD1-CG1 3.98Å; F1073-I1078 HydrophobicContact CD1-CG2 4.46Å; F1073-I1078 HydrophobicContact CE1-CD1 3.96Å; F1073-I1078 HydrophobicContact CE1-CG1 4.11Å; F1073-I1078 HydrophobicContact CE1-CG2 4.25Å
1079	S	37.2	Very low	36.5	Very low	10 Å²	10	74.4 Å²	74.4	7%	0.07	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	134.4	177.7	59.1	0	0	0	0	110.1	I1071 L1072 Y1074 Y1081	I1071-S1079 WeakPolarHBondContact CA-O 3.09Å; L1072-S1079 WeakPolarHBondContact CB-OG 3.49Å; L1072-S1079 PolarHBondContact N-O 3.42Å; L1072-S1079 PolarHBondContact O-N 3.3Å; L1072-S1079 PolarHBondContact O-OG 3.37Å; Y1074-S1079 WeakPolarHBondContact CE2-OG 3.43Å; S1079-Y1081 VanDerWaalsContact OG-CE2 3.3Å; S1079-Y1081 WeakPolarHBondContact OG-CE2 3.37Å
1080	T	37.7	Very low	36.3	Very low	53 Å²	53	81.5 Å²	81.5	33%	0.325	39%	0.389	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	122.2	178.5	47.4	0	0	0	0	107.9	I596 L1069 I1071	I596-T1080 HydrophobicContact CB-CG2 4.3Å; I596-T1080 HydrophobicContact CG2-CG2 3.62Å; L1069-T1080 HydrophobicContact CD2-CG2 4.46Å; I1071-T1080 HydrophobicContact CG1-CG2 4.23Å
1081	Y	36.9	Very low	36.2	Very low	87 Å²	87	86.8 Å²	86.8	34%	0.341	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	120.5	174.9	-69.4	-94.5	0	0	0	108.8	I1070 L1072 S1079	I1070-Y1081 PolarHBondContact N-O 3.24Å; I1070-Y1081 PolarHBondContact O-N 3.46Å; L1072-Y1081 HydrophobicContact CD1-CD2 3.44Å; L1072-Y1081 VanDerWaalsContact CD1-CD2 3.44Å; L1072-Y1081 HydrophobicContact CD1-CE2 3.1Å; L1072-Y1081 HydrophobicContact CG-CD2 3.78Å; L1072-Y1081 HydrophobicContact CG-CE2 3.84Å; S1079-Y1081 VanDerWaalsContact OG-CE2 3.3Å; S1079-Y1081 WeakPolarHBondContact OG-CE2 3.37Å
1082	W	37.1	Very low	36.4	Very low	158 Å²	158	90.4 Å²	90.4	60%	0.598	45%	0.45	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	120.8	165.8	-67.8	88.3	0	0	0	108.1	L1069 N1084	L1069-W1082 HydrophobicContact CD1-CD2 4.07Å; L1069-W1082 HydrophobicContact CD1-CE3 4.46Å; L1069-W1082 HydrophobicContact CD1-CH2 4.3Å; L1069-W1082 HydrophobicContact CD1-CZ2 3.88Å; W1082-N1084 PolarHBondContact O-N 2.97Å
1083	V	39.6	Very low	37.1	Very low	31 Å²	31	95.3 Å²	95.3	19%	0.188	48%	0.477	C	S	.	.			trans	-74.5	110.1	169.1	-177.3	0	0	0	0	107.4	L994 P1068 I1070 S1085	L994-V1083 HydrophobicContact CD1-CG1 4.37Å; P1068-V1083 HydrophobicContact CG-CB 4.07Å; P1068-V1083 HydrophobicContact CG-CG2 4.19Å; I1070-V1083 HydrophobicContact CD1-CG2 3.71Å; I1070-V1083 HydrophobicContact CG1-CG2 4.09Å; V1083-S1085 PolarHBondContact O-N 3.23Å
1084	N	33	Very low	38	Very low	105 Å²	105	97.3 Å²	97.3	56%	0.561	49%	0.486	S	S	*	.			trans	-43.6	118.8	-175.5	-83.4	-12	0	0	0	113.1	W1082 R1086	W1082-N1084 PolarHBondContact O-N 2.97Å; N1084-R1086 VanDerWaalsContact C-N 3.29Å; N1084-R1086 PolarHBondContact O-N 2.99Å
1085	S	33.6	Very low	39.1	Very low	87 Å²	87	97.3 Å²	97.3	61%	0.608	49%	0.489	S	S	*	.			trans	-77.2	72.5	174.7	50.8	0	0	0	0	111.3	V1083	V1083-S1085 PolarHBondContact O-N 3.23Å
1086	R	29.5	Very low	40.5	Very low	214 Å²	214	98.2 Å²	98.2	81%	0.808	49%	0.494	S	S	*	.			trans	-121	67.1	163	-77.8	-167	-178.7	175.1	5.8	110.9	N1084	N1084-R1086 VanDerWaalsContact C-N 3.29Å; N1084-R1086 PolarHBondContact O-N 2.99Å
1087	W	33.5	Very low	41.6	Very low	202 Å²	202	97.6 Å²	97.6	77%	0.765	49%	0.493	S	S	*	.			trans	-139.6	88	168.4	-63.1	93.3	0	0	0	108.7
1088	T	29.1	Very low	42.9	Very low	126 Å²	126	94.9 Å²	94.9	77%	0.773	48%	0.481	S	S	*	.			trans	-88.5	138.9	-179.4	41.7	0	0	0	0	111.4
1089	N	29.1	Very low	44.4	Very low	153 Å²	153	94.9 Å²	94.9	82%	0.818	48%	0.481	S	S	*	.			trans	59.3	71.9	155.5	-71.7	-10.4	0	0	0	120.1
1090	E	34.4	Very low	45.7	Very low	174 Å²	174	101.3 Å²	101.3	81%	0.813	51%	0.507	S	S	*	.			trans	-148.6	98.2	139.3	-74	-161.8	164.3	0	0	110.3	V1092	E1090-V1092 HydrophobicContact CB-CG2 4.38Å; E1090-V1092 PolarHBondContact O-N 3.38Å
1091	S	39	Very low	46.8	Very low	131 Å²	131	100 Å²	100	92%	0.916	50%	0.499	S	S	*	.			trans	-77.7	48.9	172.5	63.1	0	0	0	0	111.7
1092	V	49.2	Very low	48.1	Very low	78 Å²	78	96.8 Å²	96.8	47%	0.473	49%	0.487	S	S	.	.			trans	-78.8	132.7	168.5	-179.9	0	0	0	0	106.8	E1090 E1094 L1097	E1090-V1092 HydrophobicContact CB-CG2 4.38Å; E1090-V1092 PolarHBondContact O-N 3.38Å; V1092-E1094 PolarHBondContact O-N 3.09Å; V1092-L1097 HydrophobicContact CG1-CD1 4.03Å
1093	N	57.7	Low	49.2	Very low	104 Å²	104	93.5 Å²	93.5	56%	0.556	48%	0.481	S	S	*	.			trans	-60.4	94.6	-178.1	-165.2	0.7	0	0	0	109.6	N1095 T1096 L1097	N1093-N1095 PolarHBondContact O-N 3.48Å; N1093-N1095 VanDerWaalsContact O-N 3.09Å; N1093-T1096 WeakPolarHBondContact CB-OG1 3.47Å; N1093-T1096 PolarHBondContact ND2-OG1 3.33Å; N1093-T1096 VanDerWaalsContact ND2-OG1 3.17Å; N1093-T1096 WeakPolarHBondContact O-CA 2.85Å; N1093-T1096 VanDerWaalsContact O-CB 3.29Å; N1093-T1096 WeakPolarHBondContact O-CB 3.32Å; N1093-T1096 PolarHBondContact O-N 2.74Å; N1093-L1097 PolarHBondContact O-N 2.78Å; N1093-L1097 VanDerWaalsContact O-N 3.13Å
1094	E	58.9	Low	49.9	Very low	52 Å²	52	94.4 Å²	94.4	24%	0.243	49%	0.489	C	S	.	.	H	α-helix	trans	-53.7	-36.4	-170.1	-70.5	-169.9	151.9	0	0	111.5	R979 S980 V1092 T1096 L1097 L1098	R979-E1094 IonicContact CZ-OE1 3.98Å; R979-E1094 VanDerWaalsContact CZ-OE1 3.29Å; R979-E1094 IonicContact NE-OE1 3.09Å; R979-E1094 PolarHBondContact NE-OE1 3.09Å; R979-E1094 IonicContact NH2-OE1 3.63Å; R979-E1094 PolarHBondContact NH2-OE1 3.35Å; S980-E1094 PolarHBondContact N-OE2 3.21Å; V1092-E1094 PolarHBondContact O-N 3.09Å; E1094-T1096 VanDerWaalsContact C-N 3.35Å; E1094-T1096 PolarHBondContact O-N 2.82Å; E1094-L1097 PolarHBondContact O-N 2.7Å; E1094-L1097 VanDerWaalsContact O-N 3.17Å; E1094-L1098 WeakPolarHBondContact O-CB 3.34Å; E1094-L1098 PolarHBondContact O-N 3.38Å
1095	N	63.3	Low	50.7	Low	47 Å²	47	91.6 Å²	91.6	25%	0.251	47%	0.471	S	S	.	.	H	α-helix	trans	-61.2	-41.4	175.7	-71.5	-23.7	0	0	0	112.5	S980 N1093 L1097 L1098 M1099	S980-N1095 VanDerWaalsContact CB-OD1 3.3Å; S980-N1095 WeakPolarHBondContact CB-OD1 3.48Å; S980-N1095 PolarHBondContact OG-OD1 2.84Å; N1093-N1095 PolarHBondContact O-N 3.48Å; N1093-N1095 VanDerWaalsContact O-N 3.09Å; N1095-L1097 VanDerWaalsContact C-N 3.31Å; N1095-L1098 PolarHBondContact O-N 3.28Å; N1095-M1099 WeakPolarHBondContact O-CB 3.41Å; N1095-M1099 WeakPolarHBondContact O-CG 3.35Å; N1095-M1099 PolarHBondContact O-N 3.33Å
1096	T	64.2	Low	51.3	Low	62 Å²	62	90.4 Å²	90.4	38%	0.38	46%	0.463	S	S	.	.	H	α-helix	trans	-66.6	-37.4	175.9	-48.1	0	0	0	0	110.9	N1093 E1094 K1100	N1093-T1096 WeakPolarHBondContact CB-OG1 3.47Å; N1093-T1096 PolarHBondContact ND2-OG1 3.33Å; N1093-T1096 VanDerWaalsContact ND2-OG1 3.17Å; N1093-T1096 WeakPolarHBondContact O-CA 2.85Å; N1093-T1096 VanDerWaalsContact O-CB 3.29Å; N1093-T1096 WeakPolarHBondContact O-CB 3.32Å; N1093-T1096 PolarHBondContact O-N 2.74Å; E1094-T1096 VanDerWaalsContact C-N 3.35Å; E1094-T1096 PolarHBondContact O-N 2.82Å; T1096-K1100 WeakPolarHBondContact O-CB 2.93Å; T1096-K1100 VanDerWaalsContact O-CG 3.28Å; T1096-K1100 WeakPolarHBondContact O-CG 3.15Å; T1096-K1100 PolarHBondContact O-N 3.13Å
1097	L	60.1	Low	51.9	Low	59 Å²	59	84.5 Å²	84.5	31%	0.309	46%	0.455	S	S	.	.	H	α-helix	trans	-67.9	-46.2	177	-158.1	133	0	0	0	110.5	I998 V1092 N1093 E1094 N1095 M1099 K1100 T1101	I998-L1097 HydrophobicContact CB-CD2 4.23Å; I998-L1097 HydrophobicContact CD1-CD2 3.79Å; I998-L1097 HydrophobicContact CG1-CD2 3.7Å; I998-L1097 HydrophobicContact CG2-CD2 3.52Å; V1092-L1097 HydrophobicContact CG1-CD1 4.03Å; N1093-L1097 PolarHBondContact O-N 2.78Å; N1093-L1097 VanDerWaalsContact O-N 3.13Å; E1094-L1097 PolarHBondContact O-N 2.7Å; E1094-L1097 VanDerWaalsContact O-N 3.17Å; N1095-L1097 VanDerWaalsContact C-N 3.31Å; L1097-M1099 PolarHBondContact O-N 2.78Å; L1097-K1100 PolarHBondContact O-N 3.23Å; L1097-T1101 PolarHBondContact O-N 3.14Å; L1097-T1101 PolarHBondContact O-OG1 3.28Å
1098	L	61.7	Low	52	Low	2 Å²	2	80.3 Å²	80.3	1%	0.01	45%	0.446	C	S	.	.	H	α-helix	trans	-58.5	-46.5	176	-145.4	96.8	0	0	0	111.9	L901 I903 I997 I998 E1094 N1095 T1101 F1102	L901-L1098 HydrophobicContact CD1-CD2 3.35Å; L901-L1098 HydrophobicContact CD2-CB 4.49Å; L901-L1098 HydrophobicContact CD2-CD2 3.85Å; L901-L1098 HydrophobicContact CG-CD2 4.24Å; I903-L1098 HydrophobicContact CD1-CD2 4.23Å; I997-L1098 HydrophobicContact CB-CD1 4.4Å; I997-L1098 HydrophobicContact CG2-CD1 4.25Å; I998-L1098 HydrophobicContact CD1-CD1 4.44Å; I998-L1098 HydrophobicContact CG1-CD1 4.11Å; E1094-L1098 WeakPolarHBondContact O-CB 3.34Å; E1094-L1098 PolarHBondContact O-N 3.38Å; N1095-L1098 PolarHBondContact O-N 3.28Å; L1098-T1101 PolarHBondContact O-N 3.42Å; L1098-F1102 HydrophobicContact CD2-CD2 4.13Å; L1098-F1102 HydrophobicContact CD2-CE2 3.49Å; L1098-F1102 VanDerWaalsContact CD2-CE2 3.49Å; L1098-F1102 HydrophobicContact CG-CD2 4.07Å; L1098-F1102 HydrophobicContact CG-CE2 3.59Å; L1098-F1102 WeakPolarHBondContact O-CD2 3.07Å; L1098-F1102 PolarHBondContact O-N 3.13Å
1099	M	67.8	Low	52	Low	58 Å²	58	81 Å²	81	29%	0.286	46%	0.456	S	S	.	.	H	α-helix	trans	-57.9	-51.5	174.6	-83.8	-68.4	-158.1	0	0	111.6	E900 L901 N1095 L1097 T1101 F1102 D1103	E900-M1099 HydrophobicContact CB-CE 3.88Å; E900-M1099 VanDerWaalsContact O-CE 3.26Å; E900-M1099 WeakPolarHBondContact O-CE 3.08Å; L901-M1099 HydrophobicContact CD2-CE 4.02Å; L901-M1099 HydrophobicContact CD2-CG 3.73Å; L901-M1099 HydrophobicContact CD2-SD 3.63Å; L901-M1099 HydrophobicContact CG-CE 4.49Å; N1095-M1099 WeakPolarHBondContact O-CB 3.41Å; N1095-M1099 WeakPolarHBondContact O-CG 3.35Å; N1095-M1099 PolarHBondContact O-N 3.33Å; L1097-M1099 PolarHBondContact O-N 2.78Å; M1099-T1101 VanDerWaalsContact C-N 3.26Å; M1099-T1101 PolarHBondContact O-N 2.81Å; M1099-F1102 PolarHBondContact O-N 2.83Å; M1099-F1102 VanDerWaalsContact O-N 3.16Å; M1099-D1103 WeakPolarHBondContact O-CB 3.4Å; M1099-D1103 VanDerWaalsContact O-CG 3.26Å; M1099-D1103 PolarHBondContact O-N 3.48Å
1100	K	63.6	Low	53.1	Low	145 Å²	145	77.4 Å²	77.4	63%	0.63	44%	0.438	S	S	*	.	H	α-helix	trans	-56.9	-41	176.8	-76.9	176.1	178.5	-178.2	0	112	T1096 L1097 S1104	T1096-K1100 WeakPolarHBondContact O-CB 2.93Å; T1096-K1100 VanDerWaalsContact O-CG 3.28Å; T1096-K1100 WeakPolarHBondContact O-CG 3.15Å; T1096-K1100 PolarHBondContact O-N 3.13Å; L1097-K1100 PolarHBondContact O-N 3.23Å; K1100-S1104 PolarHBondContact O-N 3.49Å; K1100-S1104 VanDerWaalsContact O-N 3.1Å
1101	T	60.8	Low	54.1	Low	24 Å²	24	72.3 Å²	72.3	15%	0.147	42%	0.418	C	S	.	.	H	α-helix	trans	-64.7	-47.7	178.1	-46.6	0	0	0	0	110.4	F1001 L1097 L1098 M1099 S1104 F1105	F1001-T1101 HydrophobicContact CB-CG2 3.76Å; F1001-T1101 HydrophobicContact CD1-CG2 4.05Å; F1001-T1101 HydrophobicContact CD2-CG2 3.29Å; F1001-T1101 HydrophobicContact CE1-CG2 4.42Å; F1001-T1101 HydrophobicContact CE2-CG2 3.69Å; F1001-T1101 HydrophobicContact CG-CG2 3.46Å; F1001-T1101 VanDerWaalsContact CG-CG2 3.46Å; F1001-T1101 HydrophobicContact CZ-CG2 4.23Å; L1097-T1101 PolarHBondContact O-N 3.14Å; L1097-T1101 PolarHBondContact O-OG1 3.28Å; L1098-T1101 PolarHBondContact O-N 3.42Å; M1099-T1101 VanDerWaalsContact C-N 3.26Å; M1099-T1101 PolarHBondContact O-N 2.81Å; T1101-S1104 PolarHBondContact O-N 2.87Å; T1101-S1104 PolarHBondContact O-OG 2.77Å; T1101-F1105 HydrophobicContact CG2-CE2 4.2Å; T1101-F1105 VanDerWaalsContact O-CD2 3.23Å; T1101-F1105 WeakPolarHBondContact O-CD2 3.11Å; T1101-F1105 PolarHBondContact O-N 3.16Å
1102	F	64.6	Low	54.9	Low	21 Å²	21	69.1 Å²	69.1	9%	0.092	39%	0.391	C	S	.	.	H	α-helix	trans	-67.5	-35.4	177.8	-72.6	-54.8	0	0	0	114.2	L901 I903 L915 I924 I997 F1001 L1098 M1099 S1104 F1105 S1106	L901-F1102 HydrophobicContact CD2-CD2 4.37Å; I903-F1102 HydrophobicContact CD1-CE2 3.72Å; I903-F1102 HydrophobicContact CD1-CZ 4.06Å; L915-F1102 HydrophobicContact CD2-CE1 3.43Å; L915-F1102 VanDerWaalsContact CD2-CE1 3.43Å; L915-F1102 HydrophobicContact CD2-CZ 3.51Å; I924-F1102 HydrophobicContact CD1-CD1 4.44Å; I924-F1102 HydrophobicContact CD1-CE1 4.45Å; I997-F1102 HydrophobicContact CG2-CZ 4.21Å; F1001-F1102 HydrophobicContact CE2-CE1 4.01Å; F1001-F1102 HydrophobicContact CE2-CZ 4.26Å; F1001-F1102 HydrophobicContact CZ-CD1 4.38Å; F1001-F1102 AromaticContact CZ-CE1 3.86Å; F1001-F1102 HydrophobicContact CZ-CE1 3.86Å; L1098-F1102 HydrophobicContact CD2-CD2 4.13Å; L1098-F1102 HydrophobicContact CD2-CE2 3.49Å; L1098-F1102 VanDerWaalsContact CD2-CE2 3.49Å; L1098-F1102 HydrophobicContact CG-CD2 4.07Å; L1098-F1102 HydrophobicContact CG-CE2 3.59Å; L1098-F1102 WeakPolarHBondContact O-CD2 3.07Å; L1098-F1102 PolarHBondContact O-N 3.13Å; M1099-F1102 PolarHBondContact O-N 2.83Å; M1099-F1102 VanDerWaalsContact O-N 3.16Å; F1102-S1104 VanDerWaalsContact C-N 3.29Å; F1102-S1104 PolarHBondContact O-N 3.29Å; F1102-F1105 PolarHBondContact O-N 2.99Å; F1102-S1106 PolarHBondContact O-N 2.85Å
1103	D	60.5	Low	55.3	Low	89 Å²	89	68.5 Å²	68.5	48%	0.476	39%	0.386	S	S	.	.	H	α-helix	trans	-61.8	-40.5	175.1	-73.5	-19.8	0	0	0	110.5	M1099 F1105 S1106 S1107	M1099-D1103 WeakPolarHBondContact O-CB 3.4Å; M1099-D1103 VanDerWaalsContact O-CG 3.26Å; M1099-D1103 PolarHBondContact O-N 3.48Å; D1103-F1105 VanDerWaalsContact C-N 3.29Å; D1103-F1105 PolarHBondContact O-N 2.92Å; D1103-S1106 PolarHBondContact O-OG 3.39Å; D1103-S1106 VanDerWaalsContact O-N 3.07Å; D1103-S1106 PolarHBondContact O-N 2.71Å; D1103-S1106 WeakPolarHBondContact CA-OG 3.29Å; D1103-S1107 PolarHBondContact O-N 3.31Å
1104	S	54.5	Low	55.1	Low	49 Å²	49	66.3 Å²	66.3	34%	0.343	38%	0.375	S	S	.	.	H	α-helix	trans	-59.5	-38.3	175.8	76.8	0	0	0	0	112.6	K1100 T1101 F1102 S1107 I1108	K1100-S1104 PolarHBondContact O-N 3.49Å; K1100-S1104 VanDerWaalsContact O-N 3.1Å; T1101-S1104 PolarHBondContact O-N 2.87Å; T1101-S1104 PolarHBondContact O-OG 2.77Å; F1102-S1104 VanDerWaalsContact C-N 3.29Å; F1102-S1104 PolarHBondContact O-N 3.29Å; S1104-S1107 PolarHBondContact O-N 2.79Å; S1104-S1107 PolarHBondContact O-OG 3.4Å; S1104-I1108 WeakPolarHBondContact O-CD1 3.35Å; S1104-I1108 WeakPolarHBondContact O-CG1 3.07Å
1105	F	49.7	Very low	54.9	Low	46 Å²	46	67.3 Å²	67.3	20%	0.202	38%	0.384	C	S	.	.	H	α-helix	trans	-69.1	-36.4	173.8	-78	-81.1	0	0	0	112.9	L938 F1001 T1101 F1102 D1103 S1107 I1108	L938-F1105 HydrophobicContact CD1-CD1 4.08Å; L938-F1105 HydrophobicContact CD1-CE1 3.97Å; F1001-F1105 HydrophobicContact CD1-CD2 4.45Å; F1001-F1105 AromaticContact CD1-CE2 3.33Å; F1001-F1105 HydrophobicContact CD1-CE2 3.33Å; F1001-F1105 AromaticContact CD1-CZ 3.53Å; F1001-F1105 HydrophobicContact CD1-CZ 3.53Å; F1001-F1105 AromaticContact CE1-CD2 3.81Å; F1001-F1105 HydrophobicContact CE1-CD2 3.81Å; F1001-F1105 HydrophobicContact CE1-CE1 4.28Å; F1001-F1105 AromaticContact CE1-CE2 3Å; F1001-F1105 HydrophobicContact CE1-CE2 3Å; F1001-F1105 AromaticContact CE1-CZ 3.29Å; F1001-F1105 HydrophobicContact CE1-CZ 3.29Å; F1001-F1105 HydrophobicContact CG-CE2 4.28Å; F1001-F1105 HydrophobicContact CZ-CD2 4.12Å; F1001-F1105 AromaticContact CZ-CE2 3.71Å; F1001-F1105 HydrophobicContact CZ-CE2 3.71Å; F1001-F1105 HydrophobicContact CZ-CZ 4.35Å; T1101-F1105 HydrophobicContact CG2-CE2 4.2Å; T1101-F1105 VanDerWaalsContact O-CD2 3.23Å; T1101-F1105 WeakPolarHBondContact O-CD2 3.11Å; T1101-F1105 PolarHBondContact O-N 3.16Å; F1102-F1105 PolarHBondContact O-N 2.99Å; D1103-F1105 VanDerWaalsContact C-N 3.29Å; D1103-F1105 PolarHBondContact O-N 2.92Å; F1105-S1107 PolarHBondContact O-N 2.77Å; F1105-I1108 PolarHBondContact O-N 3.35Å
1106	S	46.5	Very low	54.3	Low	62 Å²	62	68.7 Å²	68.7	43%	0.434	39%	0.394	S	S	.	.	H	α-helix	trans	-69.7	-22	178.3	73.1	0	0	0	0	113.6	F1102 D1103 S1109	F1102-S1106 PolarHBondContact O-N 2.85Å; D1103-S1106 PolarHBondContact O-OG 3.39Å; D1103-S1106 VanDerWaalsContact O-N 3.07Å; D1103-S1106 PolarHBondContact O-N 2.71Å; D1103-S1106 WeakPolarHBondContact CA-OG 3.29Å; S1106-S1109 PolarHBondContact O-OG 3.25Å
1107	S	42.3	Very low	53.5	Low	91 Å²	91	69.2 Å²	69.2	64%	0.636	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-8.2	173.5	69.2	0	0	0	0	114.5	D1103 S1104 F1105	D1103-S1107 PolarHBondContact O-N 3.31Å; S1104-S1107 PolarHBondContact O-N 2.79Å; S1104-S1107 PolarHBondContact O-OG 3.4Å; F1105-S1107 PolarHBondContact O-N 2.77Å
1108	I	34.8	Very low	53	Low	113 Å²	113	70.1 Å²	70.1	58%	0.579	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	-5.7	-175	-67.4	168.7	0	0	0	112.5	L938 S1104 F1105	L938-I1108 HydrophobicContact CD2-CG2 4.4Å; S1104-I1108 WeakPolarHBondContact O-CD1 3.35Å; S1104-I1108 WeakPolarHBondContact O-CG1 3.07Å; F1105-I1108 PolarHBondContact O-N 3.35Å
1109	S	28.7	Very low	52.2	Low	141 Å²	141	76.3 Å²	76.3	99%	0.986	44%	0.437	S	S	*	.			trans	-88.3	0	164.1	63.1	0	0	0	0	111	S1106	S1106-S1109 PolarHBondContact O-OG 3.25Å

Retrieved 1,109 of 1,109 residues in 548 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).