A0A087X514_POEFO Loading...

Nuclear factor of activated T cells 2

AlphaFold DB , UniProt , Accession A0A087X514, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 848 aa.

						>A0A087X514_POEFO|A0A087X514
HKLLSSESEQVFPLDEQYRIKSCNSPYSNLNPEVLSGYENQEARNYLDNTRPPGLALSPRIEITPSREHYSHGRDSLPNQHLNLSPRPTLTVPGHENLAYREPQCLSPASSNSSTSWHSESYSPWASPCVSPSSGPNPADLCPRMQNIHTGSPRTSPGTSPHTSLGEDGGLGARSPSPRPRSTSPQGKRTYEMYRNPGLMPGQRSRSPSPHSGQEDPNTGAHFTHTGLVESVNGFGNSQPGMVPTKIVKTSNQLYALIPENHGDGNYLVSCNQDIKTKPAAEPFYVIPPIWPKPLVPNLSICSLPLATAPPLEWPLPSRTDQYELHIEVQPKPHHRAHYETEGSRGAVKAPTGGHPVVQLHGYRGKDPVGLQIFIGTADERILKPHAFYQVHRITGKTVTTNSYERIINGTKVLEIPLEPKNNMKAIIDCAGILKLRNADIELRKGETDVGRKNTRVRLVFRVHIFQPGGQDVCLQVASHPIECSQRSAHELPMVEKQDMDSCSVLGGQQMILTGQNFSSDSKVIFLEKTHDGQQLWEMEATVDKDKSQPSMLFVEVPSYRDTSICQPVKVNFYVINGKRKRSQPQHFTFTPLTSPAIKTEPLDEYEAQNMGFGIPQILGLSPQSYYHNPRGILHPDNGLLSGMASCQRFSPNLPNQDARFQQQSPAIVYSRGGKSLSSSPGTWHSGGVMPDPHRSVLVHTGSPSQSVGPISSGQHPSIIQFSPTNHHLLRAGDTETLPPPQPDNQQILFCDDYPPQAGSHSPGHPQAQAAVTHQQPCPTVIQQQQQPFGQKEPQKVRVSPGTQPMEVTEDAQRRVTVKEENLDQAYLDDVNEIIRKDLTGVQARGQT
					

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	H	32.9	Very low	33.9	Very low	233 Å²	233	146.1 Å²	146.1	100%	1.079	76%	0.763	S	S	*	*				0	110.9	0	-72.4	-113.2	0	0	0	106.4
2	K	30.9	Very low	33.5	Very low	185 Å²	185	150.2 Å²	150.2	80%	0.804	77%	0.771	S	S	*	*				62.8	106.5	91.9	-75.3	-150	171.5	-173.6	0	111.4
3	L	39.9	Very low	34.5	Very low	141 Å²	141	146.9 Å²	146.9	74%	0.738	77%	0.765	S	S	*	*				78.3	138.7	84.1	-83.9	166.5	0	0	0	111.3
4	L	34.6	Very low	34.2	Very low	152 Å²	152	146.6 Å²	146.6	80%	0.796	76%	0.764	S	S	*	*			cis	-135.2	152.3	30.1	-84.5	100.5	0	0	0	111.9
5	S	39.8	Very low	34	Very low	94 Å²	94	146.5 Å²	146.5	66%	0.657	77%	0.765	S	S	*	*				87.8	146.9	70.4	-146.7	0	0	0	0	113.1
6	S	35.2	Very low	33.9	Very low	82 Å²	82	148.4 Å²	148.4	57%	0.573	77%	0.769	S	S	*	*			cis	-154.5	164.4	26.1	-58.8	0	0	0	0	117.9
7	E	34.4	Very low	33.7	Very low	179 Å²	179	150.2 Å²	150.2	84%	0.836	77%	0.773	S	S	*	*			trans	62.1	145.9	140.4	-73	158.9	121.2	0	0	122.4
8	S	35.4	Very low	33.5	Very low	88 Å²	88	154.4 Å²	154.4	62%	0.615	78%	0.779	S	S	*	*			cis	-159.7	162.1	-23.1	-154.2	0	0	0	0	112.9
9	E	32.3	Very low	33.2	Very low	154 Å²	154	158.5 Å²	158.5	72%	0.72	78%	0.784	S	S	*	*			trans	40.8	118.5	154	-76.8	153.2	130.5	0	0	122.9
10	Q	31.9	Very low	33	Very low	171 Å²	171	158.3 Å²	158.3	80%	0.799	78%	0.784	S	S	*	*				76.5	141.7	89.2	-74.4	-168.8	42.4	0	0	115.1
11	V	25.5	Very low	32.8	Very low	128 Å²	128	159.9 Å²	159.9	78%	0.776	79%	0.787	S	S	*	*			cis	-144.3	163.2	23.5	-170.6	0	0	0	0	111.6
12	F	29	Very low	32.6	Very low	195 Å²	195	154.9 Å²	154.9	86%	0.855	78%	0.778	S	S	*	*			trans	-101.2	-175.2	175.3	-90.4	-78.5	0	0	0	112.7
13	P	46.4	Very low	32.3	Very low	108 Å²	108	151 Å²	151	70%	0.701	77%	0.773	S	S	*	*			cis	-132.6	-177.8	13.9	44.7	-25	0	0	0	115.2
14	L	31.1	Very low	31.9	Very low	143 Å²	143	152.3 Å²	152.3	75%	0.749	78%	0.781	S	S	*	*				-177.7	131.9	70.4	-166.8	74.9	0	0	0	114
15	D	30.8	Very low	31.6	Very low	145 Å²	145	150.5 Å²	150.5	78%	0.775	78%	0.781	S	S	*	*			trans	53.5	161.6	151.4	-61.8	0.3	0	0	0	125.9
16	E	31.6	Very low	32.2	Very low	177 Å²	177	150.8 Å²	150.8	83%	0.827	78%	0.78	S	S	*	*			trans	-99.9	124.9	-147.2	-59.7	-178.9	114.4	0	0	117.2
17	Q	30.5	Very low	32	Very low	179 Å²	179	156.3 Å²	156.3	84%	0.836	79%	0.79	S	S	*	*				4.7	121.6	123.3	-178.6	178.2	9.8	0	0	118.9
18	Y	30.6	Very low	31.8	Very low	225 Å²	225	153.3 Å²	153.3	88%	0.882	79%	0.789	S	S	*	*			trans	-145.6	166.7	143.4	-109.1	-75.8	0	0	0	113.6
19	R	27.7	Very low	31.7	Very low	233 Å²	233	155.8 Å²	155.8	88%	0.879	80%	0.795	S	S	*	*			trans	-104.3	118.3	-154.5	-172.8	-167.4	-147.7	161.8	5.8	113.3
20	I	29.9	Very low	31.7	Very low	154 Å²	154	156.8 Å²	156.8	79%	0.79	81%	0.805	S	S	*	*			trans	-83.8	146.1	176.3	-69.3	176.3	0	0	0	111.8
21	K	27.9	Very low	31.8	Very low	191 Å²	191	155.3 Å²	155.3	83%	0.83	80%	0.802	S	S	*	*			trans	-101.2	166.2	173.5	-70.3	-179.9	179.4	175.4	0	111.1
22	S	28.8	Very low	33	Very low	129 Å²	129	153.9 Å²	153.9	90%	0.902	80%	0.796	S	S	*	*			trans	-41.5	134.9	179.2	-41.8	0	0	0	0	115.1
23	C	25	Very low	32.9	Very low	103 Å²	103	152.1 Å²	152.1	70%	0.696	79%	0.79	S	S	*	*			trans	-110.2	125.6	175.5	-57.4	0	0	0	0	111.7
24	N	31.2	Very low	32.2	Very low	169 Å²	169	152.1 Å²	152.1	90%	0.904	79%	0.788	S	S	*	*			trans	-90.8	146.1	145.9	-80.4	-4.1	0	0	0	107.5
25	S	29.3	Very low	32.2	Very low	113 Å²	113	152.4 Å²	152.4	79%	0.79	79%	0.789	S	S	*	*			trans	-154.7	160.2	179.5	-101.7	0	0	0	0	112
26	P	51.5	Low	32.1	Very low	100 Å²	100	151.2 Å²	151.2	65%	0.649	79%	0.792	S	S	*	*				-139.6	-135	-127.1	44.9	-26	0	0	0	114.6
27	Y	31.4	Very low	32	Very low	198 Å²	198	146 Å²	146	78%	0.776	79%	0.786	S	S	*	*			trans	92.1	141.9	179.6	-62.9	-77.4	0	0	0	115.7
28	S	29.1	Very low	32	Very low	117 Å²	117	147.7 Å²	147.7	82%	0.818	79%	0.787	S	S	*	*			cis	-126	168.9	16.2	-73.3	0	0	0	0	115.7
29	N	33.7	Very low	32	Very low	140 Å²	140	143.8 Å²	143.8	75%	0.749	78%	0.776	S	S	*	*			trans	-105.7	165.1	-178.4	-94.9	-57.4	0	0	0	112.9
30	L	33.9	Very low	32.3	Very low	175 Å²	175	138.7 Å²	138.7	92%	0.916	77%	0.767	S	S	*	*				-169.9	155.2	115.3	-98.1	164.5	0	0	0	112
31	N	32.9	Very low	32.3	Very low	139 Å²	139	139 Å²	139	74%	0.743	77%	0.765	S	S	*	*			trans	-108.3	167.5	-170.2	-143.2	15.6	0	0	0	110.7
32	P	50.5	Low	32.4	Very low	98 Å²	98	138.7 Å²	138.7	64%	0.636	77%	0.766	S	S	*	*				-142.9	-167.8	61.8	42.8	-21.6	0	0	0	113.9
33	E	28	Very low	32.6	Very low	158 Å²	158	136.9 Å²	136.9	74%	0.738	76%	0.759	S	S	*	*			cis	-155.6	173	13.1	-156.6	43	-68.5	0	0	115.7
34	V	30.1	Very low	33.1	Very low	108 Å²	108	142.4 Å²	142.4	66%	0.655	77%	0.765	S	S	*	*			trans	-33	124.7	174.9	162.1	0	0	0	0	122.9
35	L	31.3	Very low	33.2	Very low	149 Å²	149	140.4 Å²	140.4	78%	0.78	75%	0.754	S	S	*	*			trans	47.9	134.5	133.1	-75.3	130.5	0	0	0	127
36	S	30	Very low	33.1	Very low	120 Å²	120	146.5 Å²	146.5	84%	0.839	76%	0.762	S	S	*	*			trans	69.9	151.2	144.1	70.1	0	0	0	0	120
37	G	28.7	Very low	32.5	Very low	68 Å²	68	148.8 Å²	148.8	70%	0.701	77%	0.768	S	S	*	*			cis	170.8	160.9	-8.9	0	0	0	0	0	113.7
38	Y	31.2	Very low	32.5	Very low	215 Å²	215	145.4 Å²	145.4	84%	0.843	76%	0.763	S	S	*	*			trans	66	128.7	166.1	-91.5	-95.9	0	0	0	122.8
39	E	30.1	Very low	32.7	Very low	143 Å²	143	145.6 Å²	145.6	67%	0.668	76%	0.755	S	S	*	*			trans	43.8	125.5	139.4	-80.1	-165.1	78.9	0	0	126.9
40	N	32.9	Very low	32.5	Very low	126 Å²	126	145.2 Å²	145.2	67%	0.674	76%	0.758	S	S	*	*				71.3	146.7	126.4	-85	-42.5	0	0	0	125.8
41	Q	30	Very low	32.2	Very low	161 Å²	161	148.1 Å²	148.1	75%	0.752	76%	0.757	S	S	*	*			trans	74.1	109.4	150.1	-74.5	170.3	8.3	0	0	123.7
42	E	31.6	Very low	32.7	Very low	183 Å²	183	146.7 Å²	146.7	86%	0.855	76%	0.755	S	S	*	*				43.2	123.9	123.8	-60.1	-166.1	115.4	0	0	124.7
43	A	32.8	Very low	32.1	Very low	91 Å²	91	148 Å²	148	75%	0.752	76%	0.763	S	S	*	*				85.1	119.3	126.3	0	0	0	0	0	124.6
44	R	34.8	Very low	32.2	Very low	219 Å²	219	144.3 Å²	144.3	83%	0.826	77%	0.767	S	S	*	*			trans	79.9	124	133.5	-82.4	-170.8	164.7	-176.4	-2.3	123.8
45	N	34.4	Very low	32.3	Very low	127 Å²	127	147.9 Å²	147.9	68%	0.679	78%	0.782	S	S	*	*			trans	67.9	136.5	132	-59.9	0.8	0	0	0	121.9
46	Y	26.7	Very low	32.3	Very low	242 Å²	242	145.7 Å²	145.7	95%	0.949	79%	0.786	S	S	*	*				-153.8	-174.7	127.5	-115.6	-77.6	0	0	0	110.9
47	L	39.4	Very low	32.5	Very low	148 Å²	148	148.4 Å²	148.4	78%	0.775	79%	0.79	S	S	*	*			trans	-134.1	-172.3	-153.4	-148.6	78.3	0	0	0	114.2
48	D	31.3	Very low	32.5	Very low	127 Å²	127	150.5 Å²	150.5	68%	0.679	79%	0.794	S	S	*	*			trans	82	146.6	158.2	-97.3	27.5	0	0	0	119.9
49	N	32.7	Very low	32.8	Very low	121 Å²	121	146.4 Å²	146.4	65%	0.647	79%	0.793	S	S	*	*			cis	-161.1	175.4	-12.2	-145.7	-31.1	0	0	0	113.8
50	T	28.9	Very low	32.9	Very low	131 Å²	131	149.3 Å²	149.3	80%	0.804	80%	0.798	S	S	*	*			trans	74	171.8	153.7	45.4	0	0	0	0	123.6
51	R	28.3	Very low	33.1	Very low	237 Å²	237	150.8 Å²	150.8	89%	0.894	81%	0.805	S	S	*	*			trans	-154.3	-173.2	-150.9	-128.7	-175.1	175.8	-174.5	1.6	109.2
52	P	42.3	Very low	33.2	Very low	108 Å²	108	149.1 Å²	149.1	70%	0.701	80%	0.797	S	S	*	*			cis	-134.1	-133	-5.1	29.6	-0.8	0	0	0	114.3
53	P	39.6	Very low	33.5	Very low	126 Å²	126	148 Å²	148	82%	0.818	80%	0.795	S	S	*	*				-124.9	167	-95.8	40.3	-24.3	0	0	0	117.3
54	G	28.8	Very low	33.5	Very low	80 Å²	80	149.2 Å²	149.2	83%	0.825	79%	0.793	S	S	*	*			trans	-173	127.1	169.5	0	0	0	0	0	116.6
55	L	32.6	Very low	33.6	Very low	183 Å²	183	144.7 Å²	144.7	96%	0.958	79%	0.792	S	S	*	*			trans	-55.1	138.2	-172.6	-63.6	157.7	0	0	0	118.7
56	A	31	Very low	33.3	Very low	104 Å²	104	144.2 Å²	144.2	86%	0.86	80%	0.799	S	S	*	*			trans	-163.8	160.1	141.7	0	0	0	0	0	110.9
57	L	34.3	Very low	33.4	Very low	177 Å²	177	142.2 Å²	142.2	93%	0.927	79%	0.789	S	S	*	*			trans	-118.6	151.5	-175.4	-72.7	168.3	0	0	0	113.1
58	S	29.4	Very low	32.9	Very low	112 Å²	112	142.9 Å²	142.9	78%	0.783	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-71	144.1	-176.1	-46.1	0	0	0	0	114.2
59	P	36.9	Very low	32.9	Very low	128 Å²	128	142.9 Å²	142.9	83%	0.831	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-75.7	139	168.3	31.5	-33.2	0	0	0	111.8
60	R	32.3	Very low	32.8	Very low	204 Å²	204	146 Å²	146	77%	0.77	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-100.8	138.7	176.6	171.5	-177.3	-179.1	153.2	-8	108.5	E62	R60-E62 HydrophobicContact CG-CG 4.32Å; R60-E62 IonicContact CZ-OE1 3.12Å; R60-E62 IonicContact NE-OE1 2.77Å; R60-E62 PolarHBondContact NE-OE1 3.38Å; R60-E62 IonicContact NH2-OE1 2.65Å; R60-E62 PolarHBondContact NH2-OE1 2.89Å
61	I	37.7	Very low	32.7	Very low	158 Å²	158	145.5 Å²	145.5	81%	0.81	79%	0.79	S	S	*	*			trans	-122.9	124.8	170.9	-60.6	-178.9	0	0	0	108.8
62	E	32.7	Very low	32.9	Very low	125 Å²	125	143.2 Å²	143.2	58%	0.584	79%	0.789	S	S	*	*			trans	-118.5	152.7	171.8	-63.3	177.5	166.4	0	0	108.1	R60	R60-E62 HydrophobicContact CG-CG 4.32Å; R60-E62 IonicContact CZ-OE1 3.12Å; R60-E62 IonicContact NE-OE1 2.77Å; R60-E62 PolarHBondContact NE-OE1 3.38Å; R60-E62 IonicContact NH2-OE1 2.65Å; R60-E62 PolarHBondContact NH2-OE1 2.89Å
63	I	36.8	Very low	32.1	Very low	161 Å²	161	141.2 Å²	141.2	83%	0.826	79%	0.788	S	S	*	*			trans	-132.4	105.2	169.2	-57.7	-178.1	0	0	0	108.9
64	T	32.6	Very low	31.7	Very low	116 Å²	116	146 Å²	146	71%	0.712	79%	0.79	S	S	*	*			trans	-109.4	134	170.8	-61.2	0	0	0	0	108.6
65	P	37.9	Very low	31.7	Very low	124 Å²	124	147.7 Å²	147.7	81%	0.805	78%	0.78	S	S	*	*			trans	-93.2	123.4	-175.2	33.5	-32.7	0	0	0	113.5
66	S	28.1	Very low	31.6	Very low	116 Å²	116	144.4 Å²	144.4	81%	0.811	77%	0.772	S	S	*	*			trans	-155	118.5	166.8	58	0	0	0	0	115.7
67	R	28	Very low	31.6	Very low	201 Å²	201	147.4 Å²	147.4	76%	0.758	77%	0.773	S	S	*	*			trans	-30.4	146.2	158.4	-172.6	-158.6	-160.4	171.3	4.1	118.6
68	E	29.5	Very low	32.2	Very low	161 Å²	161	143.7 Å²	143.7	75%	0.752	76%	0.76	S	S	*	*			trans	163.9	131.3	132	-88.6	163.3	-149.3	0	0	110.5
69	H	31.1	Very low	32	Very low	128 Å²	128	144.4 Å²	144.4	59%	0.593	76%	0.755	S	S	*	*				58.4	142.6	82.2	-57.5	135.3	0	0	0	114.3
70	Y	30.6	Very low	31.5	Very low	187 Å²	187	146 Å²	146	73%	0.733	75%	0.751	S	S	*	*			cis	-155.5	161.7	19.7	-112.1	-65.1	0	0	0	112.7
71	S	26.2	Very low	31.3	Very low	120 Å²	120	143.3 Å²	143.3	84%	0.839	75%	0.747	S	S	*	*			trans	-156.4	162.2	143.2	-48.2	0	0	0	0	110.9
72	H	32.9	Very low	31	Very low	188 Å²	188	142.2 Å²	142.2	87%	0.87	74%	0.742	S	S	*	*			trans	-104.3	160.5	-163.9	-76.8	-82.5	0	0	0	117
73	G	25.6	Very low	30.7	Very low	66 Å²	66	142.2 Å²	142.2	68%	0.68	75%	0.746	S	S	*	*			trans	-178.9	78.2	156.9	0	0	0	0	0	118.6
74	R	30.7	Very low	30.4	Very low	226 Å²	226	142.2 Å²	142.2	85%	0.853	75%	0.747	S	S	*	*			trans	62.9	156.5	152.9	-61.4	-107.7	-166.2	172.3	2.8	117.9
75	D	29.2	Very low	30.3	Very low	116 Å²	116	142.2 Å²	142.2	62%	0.62	75%	0.751	S	S	*	*			cis	-153.7	170.2	-10.2	-124.6	-14.2	0	0	0	111
76	S	30.8	Very low	30.6	Very low	114 Å²	114	142.1 Å²	142.1	80%	0.797	75%	0.751	S	S	*	*			trans	82.9	136.1	163.6	-56.3	0	0	0	0	121.1
77	L	31.3	Very low	31	Very low	168 Å²	168	147.6 Å²	147.6	88%	0.88	75%	0.754	S	S	*	*			trans	-124	-160.8	175.9	-67.9	167	0	0	0	109.1
78	P	45.3	Very low	32	Very low	99 Å²	99	143.4 Å²	143.4	64%	0.643	75%	0.752	S	S	*	*				-129.3	173.9	-82.9	40.2	-25.1	0	0	0	113.9
79	N	26.1	Very low	32	Very low	127 Å²	127	142 Å²	142	68%	0.679	76%	0.755	S	S	*	*				157.8	141.1	127.7	-91.2	-63.3	0	0	0	114.4
80	Q	26	Very low	32.1	Very low	160 Å²	160	143.3 Å²	143.3	75%	0.748	77%	0.765	S	S	*	*			trans	53.6	148.7	140.2	-60.4	178.1	15.3	0	0	119.8
81	H	28.1	Very low	32.1	Very low	148 Å²	148	140.9 Å²	140.9	69%	0.685	77%	0.77	S	S	*	*			cis	-157.8	147.3	3	-142.5	-150.9	0	0	0	110.6
82	L	31.7	Very low	32.7	Very low	135 Å²	135	141.9 Å²	141.9	71%	0.707	77%	0.771	S	S	*	*			trans	65.6	161.2	160.2	-59.7	169.6	0	0	0	116.6
83	N	26.5	Very low	33	Very low	126 Å²	126	138.8 Å²	138.8	67%	0.674	77%	0.768	S	S	*	*			cis	-150	169.3	8.8	-145.5	-23.6	0	0	0	113.8
84	L	29.5	Very low	33.2	Very low	161 Å²	161	139.2 Å²	139.2	84%	0.843	77%	0.772	S	S	*	*			trans	72.4	93.2	161.7	-58.4	176.7	0	0	0	120.5
85	S	30.5	Very low	33	Very low	115 Å²	115	136.8 Å²	136.8	80%	0.804	77%	0.77	S	S	*	*			trans	-147	151.5	137	-157.6	0	0	0	0	107.4
86	P	45.5	Very low	32.9	Very low	122 Å²	122	138.3 Å²	138.3	79%	0.792	77%	0.773	S	S	*	*				-152.3	170.8	89.7	41.8	-23.9	0	0	0	116.7
87	R	35.5	Very low	32.8	Very low	232 Å²	232	139.1 Å²	139.1	88%	0.875	77%	0.769	S	S	*	*			trans	-63.2	165	154.5	-107.7	176.2	176.4	176.1	-1.5	110.4
88	P	48.6	Very low	32.7	Very low	112 Å²	112	138.4 Å²	138.4	73%	0.727	77%	0.765	S	S	*	*				-158.3	-169.1	56.6	37.3	-11.6	0	0	0	118.7
89	T	29.7	Very low	32	Very low	131 Å²	131	137.4 Å²	137.4	80%	0.804	77%	0.765	S	S	*	*			trans	100	146.6	147.7	-46.5	0	0	0	0	119.8
90	L	33.7	Very low	32	Very low	156 Å²	156	141.8 Å²	141.8	82%	0.817	77%	0.774	S	S	*	*			trans	-87.6	160.6	-179.6	-59.5	126.7	0	0	0	112.8
91	T	31.1	Very low	32.3	Very low	137 Å²	137	144.5 Å²	144.5	84%	0.84	78%	0.777	S	S	*	*				-167.1	153.9	129.1	8.2	0	0	0	0	113.3
92	V	37.7	Very low	32.1	Very low	141 Å²	141	145.3 Å²	145.3	86%	0.855	78%	0.781	S	S	*	*			trans	-141.6	122.6	163.1	171.3	0	0	0	0	105.5
93	P	40.7	Very low	32.9	Very low	123 Å²	123	142.7 Å²	142.7	80%	0.799	77%	0.773	S	S	*	*				-146.8	166.4	117.1	37.4	-21.9	0	0	0	113.9
94	G	29.1	Very low	33	Very low	75 Å²	75	144.5 Å²	144.5	77%	0.773	78%	0.777	S	S	*	*			trans	173.4	58	178.8	0	0	0	0	0	115.1
95	H	26.8	Very low	33	Very low	175 Å²	175	142.1 Å²	142.1	81%	0.81	77%	0.772	S	S	*	*			trans	-66.1	159.2	158.6	-120.3	-106.3	0	0	0	107.9
96	E	27.6	Very low	32.9	Very low	148 Å²	148	144.9 Å²	144.9	69%	0.692	78%	0.777	S	S	*	*			cis	-171.4	159.6	31	52.1	-156.6	118	0	0	112.7
97	N	27.8	Very low	32.3	Very low	130 Å²	130	144.1 Å²	144.1	70%	0.695	78%	0.775	S	S	*	*			trans	56.4	145.6	147.2	-71.5	-43.7	0	0	0	120.4
98	L	30.3	Very low	32.6	Very low	153 Å²	153	139.7 Å²	139.7	80%	0.801	78%	0.776	S	S	*	*			cis	-159.9	161.4	18.7	-130.8	161	0	0	0	111.4
99	A	28.6	Very low	31.6	Very low	79 Å²	79	138.3 Å²	138.3	65%	0.653	77%	0.774	S	S	*	*			trans	81.9	125	150.5	0	0	0	0	0	122.9
100	Y	28.1	Very low	31.6	Very low	219 Å²	219	137.2 Å²	137.2	86%	0.859	77%	0.772	S	S	*	*			trans	82.6	98.3	137.5	-97.9	-105.8	0	0	0	123.5
101	R	31.1	Very low	31.3	Very low	216 Å²	216	135.3 Å²	135.3	82%	0.815	77%	0.772	S	S	*	*				51.5	100.9	123	-80.1	-75.9	-176.7	-174.7	0.2	120.4
102	E	24.3	Very low	31.1	Very low	166 Å²	166	135.9 Å²	135.9	78%	0.776	77%	0.77	S	S	*	*				-55.4	169.3	128.3	-110.1	-155.5	132.9	0	0	112.8
103	P	48.1	Very low	30.5	Very low	80 Å²	80	134.6 Å²	134.6	52%	0.519	77%	0.767	S	S	.	*			cis	-142.4	-165.9	13.5	31	-5.3	0	0	0	116.6
104	Q	28.1	Very low	30.2	Very low	163 Å²	163	134 Å²	134	76%	0.762	77%	0.766	S	S	*	*			trans	93.9	111.8	139.3	-92.9	163.7	-23.5	0	0	121.8
105	C	30.3	Very low	30.3	Very low	111 Å²	111	137 Å²	137	75%	0.75	77%	0.769	S	S	*	*				40.4	135.7	125.8	-55.5	0	0	0	0	121.7
106	L	27.8	Very low	30.8	Very low	174 Å²	174	133.1 Å²	133.1	91%	0.911	76%	0.761	S	S	*	*				-178.8	152.5	108.4	-95	164	0	0	0	112.2
107	S	33.3	Very low	30.8	Very low	106 Å²	106	137.7 Å²	137.7	74%	0.741	77%	0.773	S	S	*	*			trans	-93.2	158.7	160.9	-49.2	0	0	0	0	109
108	P	41.3	Very low	30.9	Very low	138 Å²	138	138.8 Å²	138.8	90%	0.896	77%	0.773	S	S	*	*				-152.3	-166.2	95.8	40.6	-21.6	0	0	0	115.5
109	A	28.4	Very low	31	Very low	84 Å²	84	136.1 Å²	136.1	69%	0.694	77%	0.767	S	S	*	*			trans	-89	167.2	-162.2	0	0	0	0	0	117.5
110	S	30.1	Very low	31.1	Very low	108 Å²	108	139.9 Å²	139.9	76%	0.755	77%	0.772	S	S	*	*			trans	58.5	124.2	142.4	60.3	0	0	0	0	121.5
111	S	26.7	Very low	31.1	Very low	116 Å²	116	134.5 Å²	134.5	81%	0.811	77%	0.766	S	S	*	*				-178.2	146.2	114.1	-82.4	0	0	0	0	115.7
112	N	26.2	Very low	31.1	Very low	149 Å²	149	135.2 Å²	135.2	80%	0.797	77%	0.77	S	S	*	*			trans	14.5	137.3	148.3	-77.5	3.1	0	0	0	124.4
113	S	26.5	Very low	31.6	Very low	114 Å²	114	132.3 Å²	132.3	80%	0.797	77%	0.768	S	S	*	*				83.3	147.4	129.3	-66	0	0	0	0	122.7
114	S	33.9	Very low	31.9	Very low	111 Å²	111	133.8 Å²	133.8	78%	0.776	78%	0.778	S	S	*	*			trans	-68.5	151.3	-179.5	-31.6	0	0	0	0	114.7
115	T	30.1	Very low	32	Very low	138 Å²	138	137.3 Å²	137.3	85%	0.847	78%	0.784	S	S	*	*				-167.5	163.3	117.8	14	0	0	0	0	111.8
116	S	37.6	Very low	32	Very low	92 Å²	92	136 Å²	136	64%	0.643	78%	0.781	S	S	*	*			trans	-89.2	160.1	179.9	48.9	0	0	0	0	113.2
117	W	28.8	Very low	32.3	Very low	244 Å²	244	133.1 Å²	133.1	92%	0.924	78%	0.776	S	S	*	*			trans	-135.4	141.2	162.1	-82.8	92.9	0	0	0	112.1
118	H	29.1	Very low	33.3	Very low	153 Å²	153	133.3 Å²	133.3	71%	0.708	77%	0.774	S	S	*	*			trans	-95.1	-171.2	167.1	-59	-90.2	0	0	0	108.1
119	S	33.2	Very low	32.8	Very low	97 Å²	97	132.5 Å²	132.5	68%	0.678	77%	0.771	S	S	*	*			cis	-163.4	168.5	24.6	-75.9	0	0	0	0	108.5
120	E	31.1	Very low	32.9	Very low	159 Å²	159	135.1 Å²	135.1	74%	0.743	78%	0.778	S	S	*	*			cis	-170.9	168.7	-22.5	-103.7	163.1	79.8	0	0	107.2
121	S	27.5	Very low	33.2	Very low	106 Å²	106	135.1 Å²	135.1	74%	0.741	78%	0.778	S	S	*	*			trans	-161.3	113.7	157	-88.7	0	0	0	0	114.7
122	Y	30.3	Very low	34.2	Very low	231 Å²	231	135.9 Å²	135.9	91%	0.906	78%	0.78	S	S	*	*			trans	64.7	136.1	155.2	-72.5	-85.2	0	0	0	121.8
123	S	35.3	Very low	34.3	Very low	105 Å²	105	133.9 Å²	133.9	73%	0.734	78%	0.778	S	S	*	*			trans	-120.3	177.5	176	-156.3	0	0	0	0	108
124	P	54.1	Low	34.4	Very low	110 Å²	110	134.4 Å²	134.4	71%	0.714	78%	0.782	S	S	*	*				-153.8	-178.9	72.6	42.6	-22.3	0	0	0	117.5
125	W	31.3	Very low	34.2	Very low	237 Å²	237	132.7 Å²	132.7	90%	0.898	78%	0.781	S	S	*	*			trans	91.4	95.3	157.8	-89.8	83.9	0	0	0	122.1
126	A	30	Very low	34.9	Very low	83 Å²	83	132 Å²	132	69%	0.686	78%	0.779	S	S	*	*			trans	83	127.3	131.6	0	0	0	0	0	123.5
127	S	33.7	Very low	34.6	Very low	115 Å²	115	134.8 Å²	134.8	80%	0.804	79%	0.787	S	S	*	*			trans	-98.7	-153.8	168.5	-41.5	0	0	0	0	109.2
128	P	53.8	Low	35.5	Very low	109 Å²	109	128.5 Å²	128.5	71%	0.708	78%	0.778	S	S	*	*			cis	-142.5	158.9	-6.1	36.2	-14.7	0	0	0	119.3
129	C	31.7	Very low	35.6	Very low	121 Å²	121	125.4 Å²	125.4	82%	0.818	78%	0.778	S	S	*	*			trans	55.2	-178	145.1	-55.5	0	0	0	0	119.2
130	V	30.5	Very low	35.5	Very low	139 Å²	139	127.4 Å²	127.4	84%	0.842	78%	0.781	S	S	*	*			cis	-144.9	162	1.5	-152.6	0	0	0	0	109.8
131	S	36.1	Very low	35.7	Very low	108 Å²	108	127 Å²	127	76%	0.755	78%	0.784	S	S	*	*			trans	-83.1	164.4	162.8	-46.7	0	0	0	0	112.4
132	P	46.9	Very low	35.9	Very low	132 Å²	132	127.5 Å²	127.5	86%	0.857	79%	0.786	S	S	*	*				-152.1	-163.8	107	41.1	-22.9	0	0	0	115.5
133	S	28.9	Very low	36.8	Very low	108 Å²	108	121.8 Å²	121.8	76%	0.755	78%	0.777	S	S	*	*			trans	-105.4	170.5	-166.5	-50.7	0	0	0	0	116
134	S	28.7	Very low	36.5	Very low	125 Å²	125	126.5 Å²	126.5	87%	0.874	78%	0.779	S	S	*	*			trans	65.9	132.9	147.5	59.6	0	0	0	0	121.4
135	G	29.8	Very low	35.4	Very low	75 Å²	75	127.3 Å²	127.3	77%	0.773	77%	0.774	S	S	*	*			trans	169.4	148.4	166.8	0	0	0	0	0	113.6
136	P	44.4	Very low	35.4	Very low	124 Å²	124	124 Å²	124	81%	0.805	77%	0.769	S	S	*	*			trans	-118.6	174.1	-171.2	43.2	-33.9	0	0	0	116.7
137	N	30.8	Very low	35.3	Very low	150 Å²	150	126.3 Å²	126.3	80%	0.802	77%	0.77	S	S	*	*			trans	-0.7	164.2	143.8	-76.4	0.5	0	0	0	121.2
138	P	47.6	Very low	35.3	Very low	112 Å²	112	127 Å²	127	73%	0.727	76%	0.763	S	S	*	*			cis	-140.8	-170.2	-14.7	37.4	-16.7	0	0	0	115.3
139	A	31.6	Very low	34.1	Very low	87 Å²	87	129.8 Å²	129.8	72%	0.719	77%	0.766	S	S	*	*			trans	70.3	167	149.5	0	0	0	0	0	118
140	D	32.5	Very low	34.1	Very low	139 Å²	139	131.1 Å²	131.1	74%	0.743	77%	0.771	S	S	*	*			cis	-156.2	172.8	1.3	-144.1	-21.1	0	0	0	113.5
141	L	34.8	Very low	34.2	Very low	151 Å²	151	127.6 Å²	127.6	79%	0.791	76%	0.763	S	S	*	*			trans	66	132	153.3	-67.2	168.6	0	0	0	123.5
142	C	31.5	Very low	34	Very low	117 Å²	117	128.5 Å²	128.5	79%	0.791	77%	0.769	S	S	*	*			trans	-86.1	-168.6	159.2	-55.3	0	0	0	0	109.8
143	P	48.7	Very low	34.6	Very low	111 Å²	111	127.3 Å²	127.3	72%	0.721	76%	0.761	S	S	*	*			cis	-160.1	-165.2	27.7	48.1	-24.1	0	0	0	120.2
144	R	29	Very low	35	Very low	203 Å²	203	132.7 Å²	132.7	77%	0.766	77%	0.765	S	S	*	*			trans	77.1	104.5	148.9	-76.7	-178.5	86	103.3	-6.2	122.5
145	M	32.3	Very low	35.3	Very low	127 Å²	127	132.9 Å²	132.9	63%	0.626	76%	0.761	S	S	*	*				83.5	142.9	112.2	-75.2	-170.4	100.7	0	0	123.6
146	Q	31	Very low	36	Very low	167 Å²	167	134.9 Å²	134.9	78%	0.78	76%	0.763	S	S	*	*			trans	71.6	147	156.7	-68.8	165	23.3	0	0	118
147	N	26.3	Very low	36.5	Very low	133 Å²	133	135.2 Å²	135.2	71%	0.711	77%	0.766	S	S	*	*			cis	161.7	160	-36.8	-180	27.3	0	0	0	107.3
148	I	33.7	Very low	36.6	Very low	130 Å²	130	131.1 Å²	131.1	67%	0.667	76%	0.759	S	S	*	*			trans	80.3	84.8	168	-43.4	-171.1	0	0	0	118.4
149	H	29	Very low	36.2	Very low	166 Å²	166	133.2 Å²	133.2	77%	0.769	77%	0.77	S	S	*	*				51.4	121.6	120.9	-57.4	-177.8	0	0	0	123
150	T	31.8	Very low	36.3	Very low	150 Å²	150	134.1 Å²	134.1	92%	0.92	77%	0.771	S	S	*	*				-132.5	176	120.9	55	0	0	0	0	107.5
151	G	32.6	Very low	37.4	Very low	65 Å²	65	133.7 Å²	133.7	67%	0.67	78%	0.775	S	S	*	*			cis	-131	-144.6	0.7	0	0	0	0	0	112.5
152	S	32.7	Very low	37.4	Very low	127 Å²	127	134.7 Å²	134.7	89%	0.888	78%	0.776	S	S	*	*			trans	-172.8	173.3	-162.5	-98.9	0	0	0	0	116.4
153	P	58.2	Low	37.5	Very low	106 Å²	106	135.2 Å²	135.2	69%	0.688	78%	0.775	S	S	*	*			trans	-132.2	-173.8	-141.5	45.9	-33	0	0	0	116.7
154	R	37.6	Very low	36.7	Very low	221 Å²	221	134.3 Å²	134.3	83%	0.834	77%	0.772	S	S	*	*			trans	170.7	152.8	131.4	-95.9	165.3	-179.7	-94.4	-1.5	118.1
155	T	35.9	Very low	36.8	Very low	129 Å²	129	133 Å²	133	79%	0.791	78%	0.779	S	S	*	*			trans	73.7	151.2	145.4	44.5	0	0	0	0	124.8
156	S	43.5	Very low	36.9	Very low	117 Å²	117	130.3 Å²	130.3	82%	0.818	78%	0.784	S	S	*	*			trans	-99.3	-166.6	179.5	-30	0	0	0	0	111.8
157	P	55.4	Low	37	Very low	132 Å²	132	131.5 Å²	131.5	86%	0.857	79%	0.79	S	S	*	*			cis	-145.6	-168.3	21.8	44.8	-23.6	0	0	0	117.8
158	G	33.8	Very low	37.5	Very low	64 Å²	64	132.8 Å²	132.8	66%	0.66	80%	0.796	S	S	*	*			trans	138.7	98.4	145.3	0	0	0	0	0	123.6
159	T	38.1	Very low	37.3	Very low	156 Å²	156	129.7 Å²	129.7	96%	0.957	80%	0.797	S	S	*	*			trans	52.7	162.9	135.7	47.3	0	0	0	0	126.6
160	S	34.6	Very low	37.3	Very low	106 Å²	106	125.3 Å²	125.3	74%	0.741	80%	0.797	S	S	*	*			trans	-99.1	177.6	-174.8	-143.6	0	0	0	0	113.2
161	P	54.3	Low	37.2	Very low	129 Å²	129	127 Å²	127	84%	0.838	80%	0.799	S	S	*	*				-147.1	-143.3	57.8	42.7	-19.2	0	0	0	116.9
162	H	35.2	Very low	37	Very low	172 Å²	172	128 Å²	128	80%	0.796	81%	0.809	S	S	*	*			trans	-117.2	-173.2	-147.7	-132.5	-103.6	0	0	0	116
163	T	33.3	Very low	36.8	Very low	128 Å²	128	126.4 Å²	126.4	79%	0.785	80%	0.803	S	S	*	*			trans	88.1	161.4	162.9	73.5	0	0	0	0	119.5
164	S	32.4	Very low	35.5	Very low	92 Å²	92	133.1 Å²	133.1	64%	0.643	82%	0.815	S	S	*	*			cis	-177.1	145.6	-47	60.4	0	0	0	0	112
165	L	31.8	Very low	35.5	Very low	177 Å²	177	128 Å²	128	93%	0.927	81%	0.813	S	S	*	*			trans	59.8	173.5	166.7	-91.9	66.4	0	0	0	115.2
166	G	33.3	Very low	35.8	Very low	70 Å²	70	127.9 Å²	127.9	72%	0.722	81%	0.814	S	S	*	*			cis	-172.4	-171.9	0.3	0	0	0	0	0	113.7
167	E	33.4	Very low	35.5	Very low	192 Å²	192	126.9 Å²	126.9	90%	0.897	81%	0.807	S	S	*	*			trans	-59.4	164.5	-164.7	-141.1	158.4	101.2	0	0	120.9
168	D	36.2	Very low	34.7	Very low	159 Å²	159	126.5 Å²	126.5	85%	0.85	81%	0.805	S	S	*	*			trans	88.6	153.6	140.3	-150.9	17.9	0	0	0	122.3
169	G	29.7	Very low	34.9	Very low	66 Å²	66	134.3 Å²	134.3	68%	0.68	81%	0.814	S	S	*	*			trans	111.3	102.6	147.7	0	0	0	0	0	119.7
170	G	28.7	Very low	35.2	Very low	74 Å²	74	131.4 Å²	131.4	76%	0.763	80%	0.798	S	S	*	*				109.3	99.7	128.1	0	0	0	0	0	121.1
171	L	31.2	Very low	34.9	Very low	186 Å²	186	137 Å²	137	97%	0.974	80%	0.803	S	S	*	*			trans	12.1	130.7	130.9	-53.6	171.9	0	0	0	119.8
172	G	28.1	Very low	33.7	Very low	85 Å²	85	135 Å²	135	88%	0.876	79%	0.792	S	S	*	*			trans	172.6	131.1	157.6	0	0	0	0	0	115
173	A	29.2	Very low	33.3	Very low	93 Å²	93	133 Å²	133	77%	0.769	79%	0.792	S	S	*	*			trans	-125.3	144.2	178.4	0	0	0	0	0	112.1
174	R	30.3	Very low	33.1	Very low	248 Å²	248	132.1 Å²	132.1	94%	0.936	79%	0.791	S	S	*	*			trans	173.3	135.6	131.8	-96.5	160.7	-175.7	-164	1.1	112.9
175	S	37.2	Very low	33.6	Very low	112 Å²	112	132 Å²	132	78%	0.783	79%	0.789	S	S	*	*			trans	-74.3	169.1	154.4	-46.2	0	0	0	0	110.4
176	P	42.7	Very low	33.4	Very low	128 Å²	128	132.6 Å²	132.6	83%	0.831	79%	0.787	S	S	*	*				-131.4	150.7	117.1	36.4	-30.1	0	0	0	113.8
177	S	36.5	Very low	33.3	Very low	95 Å²	95	132.6 Å²	132.6	66%	0.664	79%	0.786	S	S	*	*			trans	-101	163.1	163.4	179.7	0	0	0	0	109
178	P	39.2	Very low	33.1	Very low	125 Å²	125	132.6 Å²	132.6	81%	0.812	78%	0.783	S	S	*	*				-133.3	135.3	123	35	-26.3	0	0	0	114.2
179	R	38.5	Very low	33	Very low	227 Å²	227	132.7 Å²	132.7	86%	0.857	77%	0.772	S	S	*	*			trans	-93	166.7	150.9	-62.9	179.3	169	-174.5	-3.7	108.3
180	P	42.8	Very low	33.1	Very low	95 Å²	95	134.2 Å²	134.2	62%	0.617	77%	0.768	S	S	*	*				-156	154.4	94.3	38.2	-20	0	0	0	118
181	R	29.3	Very low	33.2	Very low	224 Å²	224	138.1 Å²	138.1	85%	0.845	76%	0.761	S	S	*	*			trans	64.7	154.4	146.6	-75.4	176.6	-79.4	169.4	-3.9	119.9
182	S	29.5	Very low	33.2	Very low	87 Å²	87	135.1 Å²	135.1	61%	0.608	74%	0.742	S	S	*	*			cis	-177.5	139.6	-31.4	49.2	0	0	0	0	111.3
183	T	26.9	Very low	33.1	Very low	130 Å²	130	137.1 Å²	137.1	80%	0.798	73%	0.73	S	S	*	*			trans	40.2	140.5	142.3	60.2	0	0	0	0	120.7
184	S	28.1	Very low	33.1	Very low	110 Å²	110	141.7 Å²	141.7	77%	0.769	73%	0.728	S	S	*	*			cis	-172.8	-162.5	11.5	-140.9	0	0	0	0	106.9
185	P	43.2	Very low	33.3	Very low	90 Å²	90	141.7 Å²	141.7	58%	0.584	73%	0.729	S	S	*	*			cis	-133	179.9	-16.9	43.1	-27.5	0	0	0	114.5
186	Q	28.2	Very low	32.9	Very low	189 Å²	189	142.9 Å²	142.9	88%	0.883	73%	0.726	S	S	*	*			trans	58.5	147.2	158	-64.5	159.4	25.9	0	0	118.2
187	G	31	Very low	32.7	Very low	69 Å²	69	142.7 Å²	142.7	71%	0.711	73%	0.725	S	S	*	*			cis	118	86.1	-9	0	0	0	0	0	115.2
188	K	28.3	Very low	32.3	Very low	193 Å²	193	141.3 Å²	141.3	84%	0.839	73%	0.726	S	S	*	*			trans	-164.9	112.1	155.4	-79.3	-148.5	-177.9	178	0	114.6
189	R	35.7	Very low	32	Very low	160 Å²	160	143.2 Å²	143.2	60%	0.604	73%	0.728	S	S	*	*				44.6	123	109	-62.4	169.3	157.6	-141.9	1.5	121.2	T848	R189-T848 HydrophobicContact CB-CG2 3.79Å; R189-T848 HydrophobicContact CG-CG2 4Å; R189-T848 VanDerWaalsContact CZ-CB 3.5Å; R189-T848 VanDerWaalsContact NE-C 3.29Å; R189-T848 PolarHBondContact NE-OXT 2.65Å; R189-T848 PolarHBondContact NH1-OG1 3.11Å; R189-T848 VanDerWaalsContact NH1-OG1 3.07Å; R189-T848 PolarHBondContact NH2-O 2.94Å; R189-T848 PolarHBondContact NH2-OXT 2.77Å
190	T	31.3	Very low	31.8	Very low	98 Å²	98	140 Å²	140	60%	0.601	73%	0.725	S	S	*	*			trans	89.7	135.6	141.2	9	0	0	0	0	125.2	T848	T190-T848 HydrophobicContact CG2-CG2 3.46Å; T190-T848 VanDerWaalsContact CG2-CG2 3.46Å; T190-T848 WeakPolarHBondContact OG1-CG2 3.31Å
191	Y	29.3	Very low	31.4	Very low	156 Å²	156	141.7 Å²	141.7	61%	0.612	74%	0.736	S	S	*	*			trans	-47.9	161.6	143.8	-116.9	-125.8	0	0	0	112.4	R845	Y191-R845 VanDerWaalsContact CE1-CZ 3.41Å
192	E	31.3	Very low	31.4	Very low	123 Å²	123	134.4 Å²	134.4	58%	0.575	73%	0.73	S	S	*	*			cis	-165.8	168.4	10.1	-163.1	170.1	-170.5	0	0	110.1	R845	E192-R845 IonicContact OE2-NH1 3.92Å; E192-R845 PolarHBondContact OE2-NH1 2.8Å
193	M	26.3	Very low	31.5	Very low	127 Å²	127	138 Å²	138	63%	0.626	74%	0.737	S	S	*	*			trans	137.9	144	130.1	-70.2	-129.4	74	0	0	118.8
194	Y	29.2	Very low	31.6	Very low	189 Å²	189	142.4 Å²	142.4	74%	0.741	74%	0.739	S	S	*	*			trans	59.9	115.2	157.9	-69.6	-59.9	0	0	0	122
195	R	34	Very low	31.7	Very low	249 Å²	249	142.4 Å²	142.4	94%	0.94	74%	0.739	S	S	*	*				-156.9	152.7	101.9	-115.5	179.3	-173.6	-178	2.5	115.5
196	N	29.1	Very low	31	Very low	136 Å²	136	149 Å²	149	73%	0.727	75%	0.753	S	S	*	*			trans	-94.9	177.4	166.7	-99.9	-58.3	0	0	0	109.8
197	P	38.4	Very low	31.5	Very low	124 Å²	124	144.9 Å²	144.9	81%	0.805	75%	0.745	S	S	*	*			cis	-104.3	-152.6	0	45.1	-36.5	0	0	0	110.5
198	G	28.7	Very low	31.8	Very low	67 Å²	67	147.7 Å²	147.7	69%	0.691	75%	0.75	S	S	*	*			cis	170.7	169.2	2	0	0	0	0	0	109.5
199	L	32.9	Very low	32.1	Very low	164 Å²	164	143.8 Å²	143.8	86%	0.859	75%	0.747	S	S	*	*			cis	-136.9	126.8	-6.2	-99.8	165.8	0	0	0	108.5
200	M	34.1	Very low	32.4	Very low	160 Å²	160	141.1 Å²	141.1	79%	0.788	75%	0.751	S	S	*	*			trans	26.6	135.5	148.9	-59.8	-56.5	95.6	0	0	120.9
201	P	35.5	Very low	32.4	Very low	131 Å²	131	144.7 Å²	144.7	85%	0.851	76%	0.76	S	S	*	*				-147.4	176.8	71.6	41.5	-25.1	0	0	0	117.3
202	G	28.5	Very low	32.4	Very low	70 Å²	70	142.1 Å²	142.1	72%	0.722	77%	0.765	S	S	*	*			trans	111.8	47.7	133.1	0	0	0	0	0	121.6
203	Q	31	Very low	32.3	Very low	162 Å²	162	140 Å²	140	76%	0.757	78%	0.776	S	S	*	*			trans	36.7	125.2	150.9	-68.9	-147.4	7.3	0	0	123.6
204	R	29.8	Very low	32.3	Very low	223 Å²	223	141.5 Å²	141.5	84%	0.842	78%	0.781	S	S	*	*				63.5	133.9	128.9	-62.7	-175.9	-177.4	-106.5	-1.4	122
205	S	29.7	Very low	32.3	Very low	110 Å²	110	139.5 Å²	139.5	77%	0.769	78%	0.779	S	S	*	*			trans	-136	162.7	147.1	59.6	0	0	0	0	110.3
206	R	28.4	Very low	32.3	Very low	229 Å²	229	134.6 Å²	134.6	86%	0.864	77%	0.772	S	S	*	*			trans	100.6	106.1	174.7	-61.3	-178.3	177.4	-110.3	-0.1	118.7
207	S	38.7	Very low	32.8	Very low	102 Å²	102	133.5 Å²	133.5	71%	0.713	77%	0.772	S	S	*	*				26.7	142.9	118.2	62.5	0	0	0	0	119.9
208	P	37.2	Very low	32.2	Very low	128 Å²	128	133.9 Å²	133.9	83%	0.831	77%	0.767	S	S	*	*				-150.6	179.6	65.1	41.7	-22.1	0	0	0	118.8
209	S	34.2	Very low	32.2	Very low	111 Å²	111	136.9 Å²	136.9	78%	0.776	77%	0.772	S	S	*	*			trans	-76.5	178.3	173.4	-35.3	0	0	0	0	113.4
210	P	42.9	Very low	31.9	Very low	105 Å²	105	132.5 Å²	132.5	68%	0.682	77%	0.766	S	S	*	*				-153.4	-156.2	78.8	43.4	-22.8	0	0	0	115.6
211	H	30.2	Very low	31.5	Very low	172 Å²	172	129 Å²	129	80%	0.796	76%	0.763	S	S	*	*			trans	94.5	145.3	177.7	-54.9	97.6	0	0	0	116.8
212	S	31.2	Very low	31.2	Very low	103 Å²	103	130 Å²	130	72%	0.72	76%	0.756	S	S	*	*			cis	174.8	127.6	-46.3	45.4	0	0	0	0	110.5
213	G	27.8	Very low	31.3	Very low	77 Å²	77	134.9 Å²	134.9	79%	0.794	76%	0.757	S	S	*	*			trans	75.4	132.5	178.7	0	0	0	0	0	113.4
214	Q	27.4	Very low	31.2	Very low	159 Å²	159	133 Å²	133	74%	0.743	76%	0.757	S	S	*	*			cis	87.9	119.2	21.8	-164.1	171.9	-2.2	0	0	115.5
215	E	28.7	Very low	31.2	Very low	147 Å²	147	130.2 Å²	130.2	69%	0.687	75%	0.753	S	S	*	*			trans	59.3	112.4	165.8	-76.3	142.2	-146.5	0	0	117
216	D	33.8	Very low	31.1	Very low	147 Å²	147	132.2 Å²	132.2	79%	0.786	76%	0.761	S	S	*	*				85.3	154.9	73.2	-83.5	-50.6	0	0	0	113
217	P	39.7	Very low	31.2	Very low	112 Å²	112	124.4 Å²	124.4	73%	0.727	75%	0.752	S	S	*	*			cis	-130.9	165.9	9.1	42.4	-27.3	0	0	0	117.2
218	N	26.9	Very low	30.9	Very low	132 Å²	132	127.6 Å²	127.6	71%	0.706	76%	0.76	S	S	*	*			trans	22	141.2	135.5	-161.8	23.7	0	0	0	122.8
219	T	27.7	Very low	30.6	Very low	131 Å²	131	127.2 Å²	127.2	80%	0.804	76%	0.755	S	S	*	*			trans	62.6	154.4	164.6	31.3	0	0	0	0	117.6
220	G	27.3	Very low	30.4	Very low	71 Å²	71	129.9 Å²	129.9	73%	0.732	76%	0.755	S	S	*	*			cis	173.3	168.2	-2.3	0	0	0	0	0	111.1
221	A	25.5	Very low	29.8	Very low	86 Å²	86	130.2 Å²	130.2	71%	0.711	76%	0.76	S	S	*	*			trans	-161.1	137.8	-179.6	0	0	0	0	0	109.8
222	H	28.4	Very low	29.8	Very low	153 Å²	153	127.5 Å²	127.5	71%	0.708	76%	0.755	S	S	*	*			cis	-137.8	-174.2	-3.2	-57	-95.1	0	0	0	107.8
223	F	31.5	Very low	29.9	Very low	172 Å²	172	129.1 Å²	129.1	75%	0.754	76%	0.756	S	S	*	*			cis	-140.8	-178	11.3	-68.2	-86.2	0	0	0	108.1
224	T	27.6	Very low	30	Very low	123 Å²	123	128.5 Å²	128.5	76%	0.755	75%	0.749	S	S	*	*			cis	-151.4	143.2	24.8	46.4	0	0	0	0	114.3
225	H	30.6	Very low	30.2	Very low	165 Å²	165	130.3 Å²	130.3	76%	0.764	76%	0.755	S	S	*	*			trans	19.9	122.4	146.4	-66.7	-88.9	0	0	0	122.9
226	T	28.3	Very low	30.2	Very low	152 Å²	152	126.2 Å²	126.2	93%	0.933	75%	0.752	S	S	*	*				171.6	151.4	112.7	30	0	0	0	0	109.9
227	G	30.4	Very low	29.9	Very low	64 Å²	64	127.4 Å²	127.4	66%	0.66	76%	0.759	S	S	*	*			cis	160.4	132.1	-10	0	0	0	0	0	110.6
228	L	32.5	Very low	29.5	Very low	169 Å²	169	127.4 Å²	127.4	89%	0.885	76%	0.761	S	S	*	*			trans	63.7	154.6	-171.4	-101.4	62.1	0	0	0	113.4
229	V	30.1	Very low	29.7	Very low	120 Å²	120	129.2 Å²	129.2	73%	0.727	77%	0.765	S	S	*	*			cis	-148.2	171.6	0.2	-94.5	0	0	0	0	107.7
230	E	30.5	Very low	30.6	Very low	168 Å²	168	129 Å²	129	79%	0.785	77%	0.766	S	S	*	*			cis	-179.2	164.7	-32.8	-176.6	154.2	-131.5	0	0	109.1
231	S	29.7	Very low	30.7	Very low	112 Å²	112	128.5 Å²	128.5	78%	0.783	76%	0.762	S	S	*	*			trans	73.7	149.7	171.1	115.6	0	0	0	0	116.4
232	V	30.7	Very low	31	Very low	115 Å²	115	133.5 Å²	133.5	70%	0.697	77%	0.772	S	S	*	*			cis	-161.9	160.4	-14.9	69.7	0	0	0	0	110.3
233	N	33.6	Very low	31.2	Very low	137 Å²	137	132.4 Å²	132.4	73%	0.733	78%	0.776	S	S	*	*			trans	6.7	146.6	163.2	-57.7	-14.3	0	0	0	121.7
234	G	29.5	Very low	32.3	Very low	63 Å²	63	129.3 Å²	129.3	65%	0.649	77%	0.774	S	S	*	*			cis	146.1	177	1	0	0	0	0	0	112.9
235	F	32.2	Very low	32.4	Very low	197 Å²	197	128.6 Å²	128.6	86%	0.864	77%	0.769	S	S	*	*			trans	49.6	140.1	162.4	-52.2	-82.5	0	0	0	120.4
236	G	28.1	Very low	32.3	Very low	62 Å²	62	129.1 Å²	129.1	64%	0.639	77%	0.769	S	S	*	*			cis	160.6	173.9	-2.4	0	0	0	0	0	112.2
237	N	28.1	Very low	32.5	Very low	172 Å²	172	128.6 Å²	128.6	92%	0.92	76%	0.759	S	S	*	*			trans	66.7	155.2	172.2	-59.6	-5.7	0	0	0	116.3
238	S	30	Very low	32.4	Very low	112 Å²	112	131.6 Å²	131.6	78%	0.783	76%	0.764	S	S	*	*			cis	-143.1	167.7	4.1	51	0	0	0	0	113.3
239	Q	32.1	Very low	32.5	Very low	169 Å²	169	131.8 Å²	131.8	79%	0.79	76%	0.758	S	S	*	*			trans	-107.5	152.7	163.8	-85.3	-75.5	-21.2	0	0	107.8
240	P	45.5	Very low	32.6	Very low	127 Å²	127	131.5 Å²	131.5	83%	0.825	76%	0.756	S	S	*	*				-140.2	179.4	65.1	38.9	-20.9	0	0	0	115.2
241	G	29.3	Very low	32.5	Very low	61 Å²	61	128.3 Å²	128.3	63%	0.629	75%	0.753	S	S	*	*			trans	-142.8	-172.8	178.5	0	0	0	0	0	114.6
242	M	31.6	Very low	32.5	Very low	190 Å²	190	130 Å²	130	94%	0.936	75%	0.753	S	S	*	*			trans	-139.9	166.9	165.6	-70.3	-156.8	78.6	0	0	110.6
243	V	33.1	Very low	32.6	Very low	130 Å²	130	131.9 Å²	131.9	79%	0.788	75%	0.754	S	S	*	*			trans	-144.4	166.7	-159.9	-147.3	0	0	0	0	106.8
244	P	54.5	Low	32.3	Very low	108 Å²	108	133.5 Å²	133.5	70%	0.701	76%	0.762	S	S	*	*			cis	-118.4	-152.2	-5	16.4	12.2	0	0	0	111.7
245	T	30.2	Very low	32.3	Very low	107 Å²	107	140.8 Å²	140.8	66%	0.656	77%	0.771	S	S	*	*			cis	-170	148.3	30.9	-18	0	0	0	0	115.7
246	K	28.7	Very low	32	Very low	177 Å²	177	135.7 Å²	135.7	77%	0.77	77%	0.766	S	S	*	*			trans	65.6	108.2	157	-53	-154.2	176.4	-173.7	0	119
247	I	31.6	Very low	32.1	Very low	141 Å²	141	141 Å²	141	72%	0.723	78%	0.779	S	S	*	*				92.1	116.5	96.9	-77.9	168.8	0	0	0	112
248	V	29.3	Very low	32.2	Very low	126 Å²	126	140.7 Å²	140.7	76%	0.764	78%	0.776	S	S	*	*			cis	79.3	137.4	48.8	176.5	0	0	0	0	112
249	K	35.2	Very low	32.5	Very low	173 Å²	173	141.2 Å²	141.2	75%	0.752	78%	0.776	S	S	*	*			cis	-115.2	-162.6	-1.2	-139.3	174.3	170.6	-176	0	107.4
250	T	31.3	Very low	32.3	Very low	114 Å²	114	141.8 Å²	141.8	70%	0.699	78%	0.779	S	S	*	*			cis	-153	149.8	8.7	-19.7	0	0	0	0	106
251	S	27.4	Very low	31.4	Very low	102 Å²	102	142.9 Å²	142.9	71%	0.713	78%	0.778	S	S	*	*			cis	71	143.1	34	173.1	0	0	0	0	114.2
252	N	29.6	Very low	31.5	Very low	146 Å²	146	148.2 Å²	148.2	78%	0.781	79%	0.786	S	S	*	*			trans	-147.9	162.9	-173.6	-158.9	1.8	0	0	0	110.2
253	Q	34.6	Very low	31.3	Very low	156 Å²	156	142.7 Å²	142.7	73%	0.729	78%	0.778	S	S	*	*			trans	0.4	133.7	169.7	-67.7	-76.1	5.8	0	0	120.8
254	L	27	Very low	31.1	Very low	171 Å²	171	144.8 Å²	144.8	90%	0.895	79%	0.785	S	S	*	*				-173.5	162.6	121.9	-103.8	169.1	0	0	0	113
255	Y	28	Very low	29.9	Very low	215 Å²	215	143.3 Å²	143.3	84%	0.843	79%	0.789	S	S	*	*			trans	-123.5	155	179.3	-119.4	-90.3	0	0	0	110.1
256	A	27.7	Very low	29.9	Very low	91 Å²	91	145 Å²	145	75%	0.752	79%	0.794	S	S	*	*			trans	-144.9	152.2	170.7	0	0	0	0	0	111.3
257	L	28.7	Very low	30	Very low	173 Å²	173	147.5 Å²	147.5	91%	0.906	80%	0.8	S	S	*	*			trans	-105.5	156.7	174.9	-68.5	166.4	0	0	0	110
258	I	30.9	Very low	30	Very low	166 Å²	166	148.1 Å²	148.1	85%	0.851	80%	0.804	S	S	*	*			trans	-116.7	137.8	-179.4	-69.2	178.6	0	0	0	109.5
259	P	36.3	Very low	30	Very low	122 Å²	122	148.3 Å²	148.3	79%	0.792	81%	0.805	S	S	*	*			trans	-85.2	160.3	175.6	35.2	-35.7	0	0	0	113.2
260	E	26.9	Very low	29.7	Very low	181 Å²	181	144.9 Å²	144.9	85%	0.846	80%	0.803	S	S	*	*			trans	-104.3	148.4	-178.9	-173.6	178.6	157.7	0	0	111.4
261	N	27.2	Very low	29.4	Very low	150 Å²	150	144 Å²	144	80%	0.802	80%	0.801	S	S	*	*			trans	-155.1	157.3	166.9	-153.6	-14.7	0	0	0	111
262	H	30.7	Very low	29.6	Very low	173 Å²	173	145 Å²	145	80%	0.801	80%	0.798	S	S	*	*			trans	-86.5	160.6	-160.2	-58.9	-79.7	0	0	0	116
263	G	27.5	Very low	29.8	Very low	74 Å²	74	145.6 Å²	145.6	76%	0.763	80%	0.796	S	S	*	*			trans	177.9	111.7	167.7	0	0	0	0	0	112.3
264	D	30.8	Very low	29.6	Very low	175 Å²	175	144.6 Å²	144.6	94%	0.936	80%	0.796	S	S	*	*			trans	-70.3	155.5	-166.6	-52.6	-77.6	0	0	0	116.3
265	G	28.1	Very low	30	Very low	77 Å²	77	143.1 Å²	143.1	79%	0.794	79%	0.787	S	S	*	*			trans	178.3	110.3	168.7	0	0	0	0	0	115.5
266	N	29.6	Very low	30.2	Very low	143 Å²	143	142.1 Å²	142.1	77%	0.765	79%	0.787	S	S	*	*			trans	-67.3	151	172.7	-76.6	-29.9	0	0	0	112.6
267	Y	31	Very low	30.3	Very low	228 Å²	228	144.7 Å²	144.7	89%	0.894	79%	0.794	S	S	*	*				-177	163.5	101.8	-95.4	-67.5	0	0	0	112.5
268	L	31.7	Very low	30.7	Very low	155 Å²	155	145.7 Å²	145.7	81%	0.812	79%	0.791	S	S	*	*			trans	-139.7	155.9	-168.7	-162.3	82.8	0	0	0	108.9
269	V	29.6	Very low	31.3	Very low	130 Å²	130	143.4 Å²	143.4	79%	0.788	79%	0.787	S	S	*	*			trans	72	138.2	168.5	178.1	0	0	0	0	114.3
270	S	28.4	Very low	31	Very low	101 Å²	101	142.5 Å²	142.5	71%	0.706	79%	0.789	S	S	*	*			cis	-153.3	-175.2	0.8	-137.8	0	0	0	0	114.8
271	C	26.3	Very low	31.3	Very low	95 Å²	95	138.6 Å²	138.6	64%	0.642	79%	0.788	S	S	*	*			trans	-50.5	162.8	165.4	57.8	0	0	0	0	115.5
272	N	31.1	Very low	31.7	Very low	124 Å²	124	138.9 Å²	138.9	66%	0.663	79%	0.785	S	S	*	*				-168.1	167.2	56.5	-116.2	-39.1	0	0	0	115.2
273	Q	33.6	Very low	31.9	Very low	157 Å²	157	135.8 Å²	135.8	73%	0.734	78%	0.78	S	S	*	*			trans	11.9	138.1	153.1	-65.1	163.8	66.3	0	0	120.8
274	D	31	Very low	32	Very low	135 Å²	135	140.1 Å²	140.1	72%	0.722	78%	0.778	S	S	*	*				-164.6	137	91	-104.5	-19.8	0	0	0	118.7
275	I	34.5	Very low	32.2	Very low	140 Å²	140	142.4 Å²	142.4	72%	0.718	78%	0.775	S	S	*	*			trans	50	98.6	133.3	-56.7	170.3	0	0	0	122.4
276	K	32.4	Very low	32.5	Very low	195 Å²	195	144.9 Å²	144.9	85%	0.848	78%	0.775	S	S	*	*				58	106.6	123	-172.3	-161.8	175.3	-175.8	0	122.5
277	T	31.1	Very low	33	Very low	144 Å²	144	145.1 Å²	145.1	88%	0.883	77%	0.774	S	S	*	*				-150.4	163.4	127.8	-23.6	0	0	0	0	111.7
278	K	35.3	Very low	33.1	Very low	194 Å²	194	139.7 Å²	139.7	84%	0.843	77%	0.767	S	S	*	*			trans	-139.8	168	178.1	-102.1	-167.2	178.2	-173.9	0	109.1
279	P	44.6	Very low	33.7	Very low	119 Å²	119	137.5 Å²	137.5	77%	0.773	76%	0.762	S	S	*	*			cis	-133.7	165.9	-29.6	38.6	-23.7	0	0	0	113.3
280	A	29.3	Very low	34.1	Very low	102 Å²	102	138.3 Å²	138.3	84%	0.843	76%	0.761	S	S	*	*			trans	-158.5	146	163.5	0	0	0	0	0	113.9
281	A	33.3	Very low	34.4	Very low	99 Å²	99	144.9 Å²	144.9	82%	0.818	77%	0.77	S	S	*	*			trans	52.8	119	160	0	0	0	0	0	121
282	E	36.1	Very low	35.1	Very low	157 Å²	157	145.3 Å²	145.3	73%	0.734	77%	0.771	S	S	*	*			trans	-74.2	141.8	153.7	-64.2	174.8	108.9	0	0	111.2	F284	E282-F284 HydrophobicContact CB-CD2 4.29Å; E282-F284 HydrophobicContact CB-CE2 4.23Å; E282-F284 WeakPolarHBondContact OE2-CE2 3.37Å
283	P	35	Very low	35.3	Very low	108 Å²	108	148.9 Å²	148.9	70%	0.701	78%	0.781	S	S	*	*			trans	-99.1	108.8	157.1	32.8	-25.5	0	0	0	110.7	Y285	P283-Y285 PolarHBondContact O-N 3.18Å
284	F	30.1	Very low	35.5	Very low	164 Å²	164	147 Å²	147	72%	0.719	78%	0.782	S	S	*	*			trans	-68	125.9	174.4	-80.8	-114.5	0	0	0	111.3	E282 V286	E282-F284 HydrophobicContact CB-CD2 4.29Å; E282-F284 HydrophobicContact CB-CE2 4.23Å; E282-F284 WeakPolarHBondContact OE2-CE2 3.37Å; F284-V286 PolarHBondContact O-N 2.69Å
285	Y	34.4	Very low	36	Very low	223 Å²	223	148.7 Å²	148.7	88%	0.875	79%	0.791	S	S	*	*			trans	-85.7	100.2	166.6	-79.8	-80.4	0	0	0	110.8	P283 I287	P283-Y285 PolarHBondContact O-N 3.18Å; Y285-I287 PolarHBondContact O-N 3.38Å
286	V	33.8	Very low	36.1	Very low	130 Å²	130	148.6 Å²	148.6	79%	0.788	80%	0.796	S	S	*	*			trans	-76.3	115.7	175.4	179.1	0	0	0	0	109.9	F284	F284-V286 PolarHBondContact O-N 2.69Å
287	I	40.5	Very low	36.2	Very low	148 Å²	148	144.8 Å²	144.8	76%	0.759	79%	0.792	S	S	*	*			trans	-82.2	124.9	173.1	-57.5	176	0	0	0	109	Y285	Y285-I287 PolarHBondContact O-N 3.38Å
288	P	34	Very low	36.4	Very low	113 Å²	113	145.6 Å²	145.6	73%	0.734	79%	0.79	S	S	*	*			trans	-67.2	127.7	173.2	-18.9	32.3	0	0	0	111.3
289	P	43.3	Very low	36.4	Very low	110 Å²	110	143.4 Å²	143.4	71%	0.714	79%	0.787	S	S	*	*			trans	-83.2	175.7	175.3	34.8	-35.7	0	0	0	112.3
290	I	37.9	Very low	35.7	Very low	147 Å²	147	143.1 Å²	143.1	75%	0.754	79%	0.788	S	S	*	*			trans	79.3	113.6	174.5	-44.2	159.6	0	0	0	113.8
291	W	34.1	Very low	36.1	Very low	238 Å²	238	145 Å²	145	90%	0.902	78%	0.782	S	S	*	*				-169.3	168.7	111.1	-101.1	81.4	0	0	0	106.6
292	P	41.6	Very low	36.3	Very low	104 Å²	104	145 Å²	145	68%	0.675	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-83.3	157.9	-142	30.6	-36.5	0	0	0	117.5
293	K	35.5	Very low	36.4	Very low	199 Å²	199	143.4 Å²	143.4	87%	0.865	78%	0.782	S	S	*	*	P	Polyproline II helix	trans	-69.8	127.7	179.4	-60.6	174.4	-179.8	176.4	0	113
294	P	36.8	Very low	36.3	Very low	117 Å²	117	145.4 Å²	145.4	76%	0.76	79%	0.785	S	S	*	*	P	Polyproline II helix	trans	-83.9	144.3	153	33.5	-30.9	0	0	0	110.8	V296	P294-V296 PolarHBondContact O-N 3.05Å
295	L	43.1	Very low	36.6	Very low	172 Å²	172	143.3 Å²	143.3	90%	0.901	79%	0.788	S	S	*	*	S	Bend	trans	-91.9	78.1	-176.7	-77.3	167.1	0	0	0	112.9
296	V	36.4	Very low	36.8	Very low	137 Å²	137	140.2 Å²	140.2	83%	0.83	79%	0.786	S	S	*	*			trans	-163	112.2	154.7	-103.5	0	0	0	0	111.7	P294	P294-V296 PolarHBondContact O-N 3.05Å
297	P	34.7	Very low	37.3	Very low	116 Å²	116	137.1 Å²	137.1	75%	0.753	77%	0.774	S	S	*	*			trans	-98.9	112.1	164.5	33.1	-25.1	0	0	0	110.8
298	N	33.9	Very low	38.1	Very low	160 Å²	160	136 Å²	136	86%	0.856	78%	0.775	S	S	*	*			trans	154.1	65.6	150.3	-80.5	-9.4	0	0	0	112.3
299	L	35.2	Very low	39.9	Very low	149 Å²	149	133.1 Å²	133.1	78%	0.78	76%	0.76	S	S	*	*			trans	-150.5	83.7	156.6	-105.7	144.1	0	0	0	107.2	I301	L299-I301 VanDerWaalsContact C-N 3.32Å; L299-I301 PolarHBondContact O-N 3.01Å
300	S	31.2	Very low	42	Very low	112 Å²	112	129.3 Å²	129.3	78%	0.783	74%	0.736	S	S	*	*			trans	-78.4	82.5	178	-179.3	0	0	0	0	109.7	C302	S300-C302 PolarHBondContact O-N 3.47Å
301	I	38	Very low	44.5	Very low	142 Å²	142	124.4 Å²	124.4	73%	0.728	71%	0.713	S	S	*	*			trans	-76.5	109.1	168.5	-58.1	177.2	0	0	0	107.3	L299 S303	L299-I301 VanDerWaalsContact C-N 3.32Å; L299-I301 PolarHBondContact O-N 3.01Å; I301-S303 PolarHBondContact O-N 3.32Å
302	C	36.9	Very low	47.2	Very low	99 Å²	99	113.3 Å²	113.3	67%	0.669	67%	0.672	S	S	*	*			trans	-69.7	119.5	-178	-65.2	0	0	0	0	111.4	S300 L304	S300-C302 PolarHBondContact O-N 3.47Å; C302-L304 PolarHBondContact O-N 2.85Å
303	S	38.9	Very low	49.5	Very low	124 Å²	124	113 Å²	113	87%	0.867	66%	0.661	S	S	*	*			trans	-74	84.8	176.8	-58.1	0	0	0	0	112.1	I301	I301-S303 PolarHBondContact O-N 3.32Å
304	L	32.9	Very low	52.1	Low	149 Å²	149	110.3 Å²	110.3	78%	0.78	65%	0.646	S	S	*	*			trans	-123.3	158.9	166.1	-78.5	177.5	0	0	0	109.2	C302 L306	C302-L304 PolarHBondContact O-N 2.85Å; L304-L306 PolarHBondContact O-N 2.64Å
305	P	34.5	Very low	54.5	Low	121 Å²	121	110.8 Å²	110.8	79%	0.786	65%	0.649	S	S	*	*			trans	-59.6	137.4	-162.6	21.9	-33.8	0	0	0	112.2	A307	P305-A307 PolarHBondContact O-N 2.66Å
306	L	39.9	Very low	56.9	Low	157 Å²	157	104.3 Å²	104.3	82%	0.822	62%	0.615	S	S	*	*			trans	-65.4	90.9	-173.2	-171.5	76.3	0	0	0	110.9	L304 T308	L304-L306 PolarHBondContact O-N 2.64Å; L306-T308 PolarHBondContact O-N 3.31Å; L306-T308 VanDerWaalsContact O-N 3.09Å
307	A	43.3	Very low	59.6	Low	66 Å²	66	101 Å²	101	55%	0.545	60%	0.596	S	S	.	*			trans	-50.3	118.4	159.1	0	0	0	0	0	107.2	P305 A309	P305-A307 PolarHBondContact O-N 2.66Å; A307-A309 VanDerWaalsContact C-N 3.3Å; A307-A309 PolarHBondContact O-N 3.25Å
308	T	58.6	Low	62.5	Low	124 Å²	124	97.7 Å²	97.7	76%	0.761	58%	0.576	S	S	*	*			trans	-71.3	89.5	-171.3	32.5	0	0	0	0	109.5	L306 P310	L306-T308 PolarHBondContact O-N 3.31Å; L306-T308 VanDerWaalsContact O-N 3.09Å; T308-P310 VanDerWaalsContact O-N 3.08Å
309	A	72.1	Confident	65.4	Low	53 Å²	53	97.2 Å²	97.2	44%	0.438	56%	0.562	S	S	.	*			trans	-36.5	115	177.5	0	0	0	0	0	109.8	A307	A307-A309 VanDerWaalsContact C-N 3.3Å; A307-A309 PolarHBondContact O-N 3.25Å
310	P	85.6	Confident	68.2	Low	30 Å²	30	92.5 Å²	92.5	20%	0.195	54%	0.54	C	S	.	.			trans	-54.1	146.5	-159.1	-27.9	27	0	0	0	113.4	T308 W314 R462	T308-P310 VanDerWaalsContact O-N 3.08Å; P310-W314 HydrophobicContact CB-CD2 4.01Å; P310-W314 HydrophobicContact CB-CE3 3.57Å; P310-W314 HydrophobicContact CB-CG 4.48Å; P310-W314 HydrophobicContact CB-CZ3 3.99Å; P310-W314 HydrophobicContact CG-CE3 4.33Å; P310-W314 HydrophobicContact CG-CZ3 4.37Å; P310-R462 VanDerWaalsContact CD-NH2 3.3Å; P310-R462 PolarHBondContact O-NH1 3.24Å; P310-R462 PolarHBondContact O-NH2 3.07Å
311	P	90.4	Very high	70.9	Confident	43 Å²	43	94.9 Å²	94.9	28%	0.279	54%	0.544	S	S	.	.			trans	-48.9	154.8	-177.9	-28	33.6	0	0	0	114.5	E313 W314 R462	P311-E313 HydrophobicContact CB-CG 4.02Å; P311-E313 WeakPolarHBondContact CB-OE2 3.49Å; P311-E313 PolarHBondContact O-N 3.3Å; P311-W314 HydrophobicContact CB-CG 4.34Å; P311-W314 HydrophobicContact CG-CG 4.4Å; P311-W314 PolarHBondContact O-N 3.1Å; P311-R462 PolarHBondContact O-NH1 2.68Å
312	L	91.8	Very high	73.4	Confident	6 Å²	6	93.7 Å²	93.7	3%	0.031	54%	0.535	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.1	-16.8	-176.4	-65	-179.1	0	0	0	112.8	F374 P385 I408 T411 V413	L312-F374 HydrophobicContact CB-CE2 4.3Å; L312-F374 HydrophobicContact CB-CZ 4.17Å; L312-F374 HydrophobicContact CD2-CD1 4.17Å; L312-F374 HydrophobicContact CD2-CE1 3.91Å; L312-F374 HydrophobicContact CD2-CZ 4.27Å; L312-P385 HydrophobicContact CB-CG 3.54Å; L312-P385 HydrophobicContact CD1-CG 4.1Å; L312-I408 HydrophobicContact CD1-CB 4.13Å; L312-I408 HydrophobicContact CD1-CG2 4.43Å; L312-I408 HydrophobicContact CD2-CD1 4.42Å; L312-I408 HydrophobicContact CG-CG2 4.47Å; L312-T411 HydrophobicContact CD1-CG2 3.87Å; L312-V413 HydrophobicContact CD1-CG2 3.76Å; L312-V413 HydrophobicContact CD2-CG2 4.46Å
313	E	89.6	Confident	76.3	Confident	98 Å²	98	90.8 Å²	90.8	46%	0.458	51%	0.51	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.4	-2.3	174.4	62.7	-90.3	-146.8	0	0	113.8	P311 K384	P311-E313 HydrophobicContact CB-CG 4.02Å; P311-E313 WeakPolarHBondContact CB-OE2 3.49Å; P311-E313 PolarHBondContact O-N 3.3Å; E313-K384 HydrophobicContact CB-CB 4.45Å
314	W	89.4	Confident	79.1	Confident	141 Å²	141	88.4 Å²	88.4	53%	0.534	49%	0.485	S	S	.	.	S	Bend	trans	-73.8	133.9	175.9	-85.5	26.7	0	0	0	111.4	P310 P311 L316 Q476	P310-W314 HydrophobicContact CB-CD2 4.01Å; P310-W314 HydrophobicContact CB-CE3 3.57Å; P310-W314 HydrophobicContact CB-CG 4.48Å; P310-W314 HydrophobicContact CB-CZ3 3.99Å; P310-W314 HydrophobicContact CG-CE3 4.33Å; P310-W314 HydrophobicContact CG-CZ3 4.37Å; P311-W314 HydrophobicContact CB-CG 4.34Å; P311-W314 HydrophobicContact CG-CG 4.4Å; P311-W314 PolarHBondContact O-N 3.1Å; W314-L316 PolarHBondContact O-N 3.22Å; W314-Q476 PolarHBondContact O-NE2 2.97Å
315	P	87.8	Confident	82.2	Confident	127 Å²	127	81.4 Å²	81.4	83%	0.825	45%	0.448	S	S	*	.			trans	-67.6	124.4	168.2	29.6	-32.8	0	0	0	108.9
316	L	92.9	Very high	85.2	Confident	37 Å²	37	79.6 Å²	79.6	19%	0.194	43%	0.43	C	S	.	.			trans	-133.2	141.5	-178.9	-74	169.9	0	0	0	108.7	W314 C474 Q476	W314-L316 PolarHBondContact O-N 3.22Å; L316-C474 HydrophobicContact CD1-CB 3.97Å; L316-C474 HydrophobicContact CD2-CB 3.86Å; L316-Q476 HydrophobicContact CB-CB 3.6Å; L316-Q476 HydrophobicContact CD1-CB 4.42Å
317	P	94.3	Very high	88	Confident	67 Å²	67	72.6 Å²	72.6	44%	0.435	39%	0.393	S	S	.	.			trans	-75.7	152.6	-176	32.8	-36.2	0	0	0	111.4	R319 L475 Q476	P317-R319 VanDerWaalsContact C-N 3.32Å; P317-L475 HydrophobicContact CG-CD2 4.47Å; P317-L475 CarbonylContact O-C 3.59Å; P317-L475 VanDerWaalsContact O-CA 3.24Å; P317-L475 WeakPolarHBondContact O-CA 3.45Å; P317-Q476 CarbonylContact C-O 3.54Å; P317-Q476 PolarHBondContact O-N 2.92Å
318	S	95.1	Very high	90.6	Very high	47 Å²	47	73.5 Å²	73.5	33%	0.329	39%	0.386	S	S	.	.	S	Bend	trans	-75.2	-23.5	169.3	54.6	0	0	0	0	112.7	L325 Q476	S318-L325 PolarHBondContact O-N 3.41Å; S318-Q476 WeakPolarHBondContact CA-O 3.45Å; S318-Q476 PolarHBondContact N-O 3.02Å
319	R	95.5	Very high	92.5	Very high	150 Å²	150	69.6 Å²	69.6	57%	0.566	36%	0.361	S	S	*	.	B	Isolated β-bridge	trans	-141.3	148.7	-177.9	54.3	169	-74.8	-129	-6.2	113.5	P317 Y323 E324	P317-R319 VanDerWaalsContact C-N 3.32Å; R319-Y323 CarbonylContact C-O 3.51Å; R319-Y323 VanDerWaalsContact CA-O 3.27Å; R319-Y323 WeakPolarHBondContact CA-O 3.21Å; R319-E324 HydrophobicContact CB-CB 3.9Å; R319-E324 HydrophobicContact CB-CG 4.03Å
320	T	93.8	Very high	93.7	Very high	50 Å²	50	69.3 Å²	69.3	31%	0.307	35%	0.351	S	S	.	.			trans	-115.4	-170	160.8	57.5	0	0	0	0	108.8	Q322 Y323 V473 L475	T320-Q322 PolarHBondContact O-N 2.66Å; T320-Y323 PolarHBondContact N-O 2.96Å; T320-Y323 PolarHBondContact OG1-N 3.28Å; T320-V473 HydrophobicContact CG2-CG1 4.1Å; T320-L475 HydrophobicContact CG2-CD2 3.92Å
321	D	87.8	Confident	94.2	Very high	162 Å²	162	68.1 Å²	68.1	87%	0.866	34%	0.344	S	S	*	.	S	Bend	trans	-71.5	-18.6	176.9	-52.1	-55.7	0	0	0	113.4
322	Q	90.8	Very high	94.3	Very high	117 Å²	117	69.7 Å²	69.7	55%	0.547	35%	0.346	S	S	.	.	S	Bend	trans	-109.3	-27.1	-176.2	-64.9	-178.6	-0.9	0	0	113.9	T320 G362	T320-Q322 PolarHBondContact O-N 2.66Å; Q322-G362 VanDerWaalsContact O-CA 3.3Å; Q322-G362 WeakPolarHBondContact O-CA 3.38Å
323	Y	96.2	Very high	94.2	Very high	37 Å²	37	73 Å²	73	15%	0.145	37%	0.368	C	S	.	.			trans	-139.3	145.7	-168.6	-54.8	-57	0	0	0	111.6	R319 T320 I465 V473	R319-Y323 CarbonylContact C-O 3.51Å; R319-Y323 VanDerWaalsContact CA-O 3.27Å; R319-Y323 WeakPolarHBondContact CA-O 3.21Å; T320-Y323 PolarHBondContact N-O 2.96Å; T320-Y323 PolarHBondContact OG1-N 3.28Å; Y323-I465 HydrophobicContact CD1-CD1 4.47Å; Y323-I465 HydrophobicContact CD2-CD1 4.01Å; Y323-I465 HydrophobicContact CE2-CG2 4.34Å; Y323-I465 HydrophobicContact CG-CD1 3.96Å; Y323-V473 HydrophobicContact CD2-CB 4.49Å; Y323-V473 HydrophobicContact CD2-CG1 4.24Å
324	E	97.8	Very high	94.2	Very high	75 Å²	75	69.7 Å²	69.7	35%	0.35	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	124.4	176.4	172	172.3	-127.2	0	0	111	R319 H326 L360 H361	R319-E324 HydrophobicContact CB-CB 3.9Å; R319-E324 HydrophobicContact CB-CG 4.03Å; E324-H326 HydrophobicContact CG-CB 4.37Å; E324-L360 CarbonylContact O-C 3.59Å; E324-L360 WeakPolarHBondContact O-CA 3.3Å; E324-H361 HydrophobicContact CB-CB 4.32Å; E324-H361 PolarHBondContact N-O 2.97Å; E324-H361 PolarHBondContact O-N 3.38Å
325	L	98.5	Very high	94.4	Very high	1 Å²	1	64 Å²	64	1%	0.005	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	107.3	173.3	-174.8	69	0	0	0	108.9	S318 V358 L360 F461 V463 L475 V477	S318-L325 PolarHBondContact O-N 3.41Å; L325-V358 HydrophobicContact CD1-CG1 3.76Å; L325-V358 HydrophobicContact CG-CG1 4.29Å; L325-L360 HydrophobicContact CD1-CB 4.24Å; L325-F461 HydrophobicContact CD2-CB 4.31Å; L325-F461 WeakPolarHBondContact CD2-O 3.27Å; L325-V463 HydrophobicContact CD1-CG1 3.85Å; L325-V463 HydrophobicContact CD1-CG2 4.35Å; L325-V463 HydrophobicContact CD2-CG1 4.32Å; L325-V463 HydrophobicContact CD2-CG2 4.25Å; L325-L475 HydrophobicContact CB-CB 3.94Å; L325-L475 HydrophobicContact CB-CD1 4.07Å; L325-L475 HydrophobicContact CD2-CB 4.47Å; L325-V477 HydrophobicContact CB-CG1 4.46Å; L325-V477 HydrophobicContact CD2-CG1 3.85Å; L325-V477 HydrophobicContact CG-CG1 3.79Å
326	H	98	Very high	94.7	Very high	84 Å²	84	60.7 Å²	60.7	39%	0.389	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.9	143.5	-171.7	-175.6	-97.5	0	0	0	112.4	E324 E328 V358 Q359	E324-H326 HydrophobicContact CG-CB 4.37Å; H326-E328 PolarHBondContact ND1-N 2.79Å; H326-V358 WeakPolarHBondContact O-CA 3.48Å; H326-Q359 PolarHBondContact N-O 3.11Å; H326-Q359 PolarHBondContact O-N 3.46Å
327	I	98.4	Very high	94.8	Very high	9 Å²	9	59.4 Å²	59.4	5%	0.046	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	92.1	173	-53.7	177	0	0	0	108.2	V329 Q330 V357 V358 F461 V477 A478	I327-V329 VanDerWaalsContact C-N 3.33Å; I327-V329 WeakPolarHBondContact CG2-O 2.93Å; I327-V329 PolarHBondContact O-N 2.82Å; I327-Q330 HydrophobicContact CG2-CG 4.28Å; I327-V357 CarbonylContact C-O 3.56Å; I327-V358 HydrophobicContact CG1-CG2 4.37Å; I327-F461 HydrophobicContact CD1-CD2 3.75Å; I327-F461 HydrophobicContact CD1-CE2 3.94Å; I327-F461 HydrophobicContact CG1-CD2 4.08Å; I327-F461 HydrophobicContact CG1-CE2 4.36Å; I327-V477 HydrophobicContact CD1-CG1 4.01Å; I327-V477 HydrophobicContact CD1-CG2 3.95Å; I327-V477 HydrophobicContact CG1-CB 4.48Å; I327-V477 HydrophobicContact CG1-CG1 3.67Å; I327-V477 HydrophobicContact CG1-CG2 3.98Å; I327-A478 VanDerWaalsContact CD1-C 3.48Å; I327-A478 WeakPolarHBondContact CD1-O 3.43Å
328	E	97.6	Very high	94.8	Very high	86 Å²	86	56.4 Å²	56.4	40%	0.402	28%	0.277	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	-37.1	179.6	-173.5	-170.6	149.8	0	0	112.5	H326 V357 Q359 K425	H326-E328 PolarHBondContact ND1-N 2.79Å; E328-V357 HydrophobicContact CB-CB 4.49Å; E328-V357 HydrophobicContact CB-CG1 4.39Å; E328-V357 PolarHBondContact N-O 2.95Å; E328-Q359 PolarHBondContact OE2-OE1 3.49Å; E328-K425 IonicContact OE1-NZ 2.66Å; E328-K425 PolarHBondContact OE1-NZ 3.02Å; E328-K425 WeakPolarHBondContact OE2-CE 3.32Å; E328-K425 IonicContact OE2-NZ 2.64Å; E328-K425 PolarHBondContact OE2-NZ 3.43Å
329	V	98.2	Very high	94.8	Very high	41 Å²	41	58.3 Å²	58.3	25%	0.248	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	113.6	176.5	-176.8	0	0	0	0	109.6	I327 A350 P356 V357	I327-V329 VanDerWaalsContact C-N 3.33Å; I327-V329 WeakPolarHBondContact CG2-O 2.93Å; I327-V329 PolarHBondContact O-N 2.82Å; V329-A350 HydrophobicContact CG1-CB 3.42Å; V329-A350 VanDerWaalsContact CG1-CB 3.42Å; V329-P356 CarbonylContact O-C 3.55Å; V329-P356 WeakPolarHBondContact O-CA 3.26Å; V329-P356 WeakPolarHBondContact O-CB 3.39Å; V329-V357 HydrophobicContact CB-CB 3.81Å; V329-V357 HydrophobicContact CB-CG2 3.87Å; V329-V357 HydrophobicContact CG2-CB 3.89Å; V329-V357 HydrophobicContact CG2-CG2 3.87Å; V329-V357 PolarHBondContact N-O 3.05Å; V329-V357 VanDerWaalsContact N-O 3.15Å; V329-V357 PolarHBondContact O-N 2.99Å
330	Q	97.9	Very high	94.6	Very high	47 Å²	47	57.2 Å²	57.2	22%	0.22	28%	0.279	C	S	.	.	P	Polyproline II helix	trans	-71.5	153.5	177.7	-68.9	-76.2	-1.7	0	0	111.9	I327 P351	I327-Q330 HydrophobicContact CG2-CG 4.28Å; Q330-P351 WeakPolarHBondContact O-CD 3.49Å
331	P	97.2	Very high	94.5	Very high	6 Å²	6	60.6 Å²	60.6	4%	0.039	30%	0.3	C	S	.	.	P	Polyproline II helix	trans	-69.4	164.6	171.5	31.5	-35.2	0	0	0	112.1	V348 K349 P356 L459 I482	P331-V348 HydrophobicContact CB-CG1 3.5Å; P331-K349 CarbonylContact C-O 3.5Å; P331-K349 WeakPolarHBondContact CA-O 3.26Å; P331-P356 HydrophobicContact CB-CG 3.92Å; P331-L459 HydrophobicContact CB-CD1 4.41Å; P331-L459 HydrophobicContact CG-CD1 4.49Å; P331-I482 HydrophobicContact CB-CD1 3.79Å; P331-I482 HydrophobicContact CB-CG1 4.16Å; P331-I482 HydrophobicContact CG-CD1 3.74Å; P331-I482 HydrophobicContact CG-CG1 3.85Å
332	K	91.6	Very high	94.6	Very high	76 Å²	76	55.8 Å²	55.8	33%	0.33	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-60.2	146.5	166.5	-71.3	-164.4	-179.7	-159.2	0	109.8	H334 K349 A350	K332-H334 PolarHBondContact O-N 3.45Å; K332-K349 WeakPolarHBondContact CG-O 3.2Å; K332-K349 PolarHBondContact N-O 3.47Å; K332-A350 WeakPolarHBondContact CE-O 3.47Å; K332-A350 VanDerWaalsContact CG-C 3.44Å; K332-A350 WeakPolarHBondContact CG-O 3.37Å
333	P	89.9	Confident	94.5	Very high	75 Å²	75	52.2 Å²	52.2	49%	0.487	27%	0.267	S	S	.	.	S	Bend	trans	-66.7	-1.9	176.3	29.4	-36.7	0	0	0	113.7	E483	P333-E483 WeakPolarHBondContact O-CB 3.46Å; P333-E483 PolarHBondContact O-N 2.92Å
334	H	90.4	Very high	94.2	Very high	28 Å²	28	53.5 Å²	53.5	13%	0.13	28%	0.281	C	S	.	.	B	Isolated β-bridge	trans	-144.1	138.7	176.1	179.4	88.6	0	0	0	111.3	K332 E483 S485 H490	K332-H334 PolarHBondContact O-N 3.45Å; H334-E483 VanDerWaalsContact CA-O 3.29Å; H334-E483 WeakPolarHBondContact CA-O 3.48Å; H334-E483 HydrophobicContact CB-CB 4.45Å; H334-E483 PolarHBondContact ND1-O 2.94Å; H334-S485 PolarHBondContact CE1-O 3.39Å; H334-S485 VanDerWaalsContact CE1-O 3.23Å; H334-H490 AromaticContact CD2-CD2 3.19Å; H334-H490 PolarHBondContact CD2-CD2 2.58Å; H334-H490 AromaticContact CD2-NE2 3.2Å; H334-H490 PolarHBondContact CD2-NE2 2.92Å; H334-H490 AromaticContact CG-CD2 3.71Å; H334-H490 AromaticContact CG-NE2 3.59Å; H334-H490 AromaticContact NE2-CD2 3.8Å
335	H	93.2	Very high	94	Very high	22 Å²	22	55.8 Å²	55.8	10%	0.102	29%	0.287	C	S	.	.			trans	-153.1	106.6	168.4	168.4	95	0	0	0	107.8	A337 G346 I433 I482 E483 C484	H335-A337 PolarHBondContact O-N 2.88Å; H335-G346 PolarHBondContact CE1-O 2.92Å; H335-I433 HydrophobicContact CB-CD1 4.5Å; H335-I482 HydrophobicContact CB-CG2 3.82Å; H335-E483 PolarHBondContact N-O 2.98Å; H335-C484 WeakPolarHBondContact O-CA 3.36Å
336	R	93.2	Very high	93.8	Very high	58 Å²	58	56.9 Å²	56.9	22%	0.219	30%	0.299	C	S	.	.			trans	-53.7	114.8	175.5	170.4	177.2	172.2	-174.3	-1.1	110.3	E342 Q486	R336-E342 IonicContact CZ-OE2 3.59Å; R336-E342 IonicContact NE-OE2 3.02Å; R336-E342 VanDerWaalsContact NH2-CD 3.26Å; R336-E342 IonicContact NH2-OE1 2.69Å; R336-E342 PolarHBondContact NH2-OE1 2.96Å; R336-E342 IonicContact NH2-OE2 3.83Å; R336-E342 PolarHBondContact NH2-OE2 3.15Å; R336-Q486 VanDerWaalsContact CZ-OE1 3.32Å
337	A	94.8	Very high	93.8	Very high	9 Å²	9	53.5 Å²	53.5	7%	0.074	29%	0.285	C	S	.	.			trans	-70.2	164.6	170.3	0	0	0	0	0	111.5	H335 Y389 I433 K435 C484	H335-A337 PolarHBondContact O-N 2.88Å; A337-Y389 HydrophobicContact CB-CD1 4.04Å; A337-Y389 HydrophobicContact CB-CE1 3.68Å; A337-I433 WeakPolarHBondContact CA-O 3.32Å; A337-I433 HydrophobicContact CB-CB 4.18Å; A337-I433 HydrophobicContact CB-CG2 3.98Å; A337-I433 WeakPolarHBondContact CB-O 3.23Å; A337-K435 HydrophobicContact CB-CB 4.26Å; A337-C484 HydrophobicContact CB-CB 3.97Å; A337-C484 PolarHBondContact N-O 2.82Å; A337-C484 VanDerWaalsContact N-O 3.13Å
338	H	94.7	Very high	93.7	Very high	4 Å²	4	53.1 Å²	53.1	2%	0.019	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-125.3	153.2	178.1	62.2	-62.6	0	0	0	111.5	E342 G343 R345 H392 I433 L434 K435	H338-E342 HydrophobicContact CB-CB 4.21Å; H338-G343 PolarHBondContact CD2-O 2.89Å; H338-R345 HydrophobicContact CB-CG 3.67Å; H338-H392 AromaticContact CE1-CD2 3.25Å; H338-H392 PolarHBondContact CE1-CD2 3.48Å; H338-H392 AromaticContact CE1-CG 3.64Å; H338-H392 AromaticContact NE2-CD2 3.19Å; H338-H392 PolarHBondContact NE2-CD2 3.4Å; H338-H392 AromaticContact NE2-CG 3.64Å; H338-H392 AromaticContact NE2-NE2 3.6Å; H338-I433 PolarHBondContact CE1-O 3.05Å; H338-I433 PolarHBondContact N-O 2.9Å; H338-I433 PolarHBondContact ND1-O 2.78Å; H338-L434 CarbonylContact O-C 3.49Å; H338-L434 WeakPolarHBondContact O-CA 3.39Å; H338-L434 WeakPolarHBondContact O-CD1 3.35Å; H338-K435 PolarHBondContact O-N 3.01Å
339	Y	95.1	Very high	93.6	Very high	87 Å²	87	53.1 Å²	53.1	34%	0.341	28%	0.282	S	S	.	.			trans	-81.7	158.5	164	-60.2	-81.9	0	0	0	109.8	T341 E342 K435 R437	Y339-T341 PolarHBondContact O-N 3.06Å; Y339-E342 PolarHBondContact O-N 3.32Å; Y339-K435 HydrophobicContact CD1-CB 4.15Å; Y339-K435 HydrophobicContact CD1-CG 3.96Å; Y339-K435 VanDerWaalsContact CD1-O 3.32Å; Y339-K435 WeakPolarHBondContact CD1-O 3.37Å; Y339-K435 HydrophobicContact CE1-CB 4.01Å; Y339-K435 HydrophobicContact CE1-CG 3.34Å; Y339-R437 HydrophobicContact CD1-CG 4.25Å
340	E	91.8	Very high	93.5	Very high	127 Å²	127	51.2 Å²	51.2	59%	0.593	27%	0.27	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	-25.1	176.8	-63.8	-179.5	142.1	0	0	112.7	L434	E340-L434 HydrophobicContact CG-CD1 3.71Å; E340-L434 HydrophobicContact CG-CD2 3.8Å; E340-L434 HydrophobicContact CG-CG 4.17Å
341	T	92.1	Very high	92.9	Very high	122 Å²	122	52.9 Å²	52.9	75%	0.748	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-14.1	177.6	52.6	0	0	0	0	115.3	Y339	Y339-T341 PolarHBondContact O-N 3.06Å
342	E	88.9	Confident	92.4	Very high	61 Å²	61	58.5 Å²	58.5	29%	0.285	32%	0.319	S	S	.	.	S	Bend	trans	-87.2	-11.1	-176.1	-82.9	-164.6	-156.5	0	0	114.1	R336 H338 Y339 R345	R336-E342 IonicContact CZ-OE2 3.59Å; R336-E342 IonicContact NE-OE2 3.02Å; R336-E342 VanDerWaalsContact NH2-CD 3.26Å; R336-E342 IonicContact NH2-OE1 2.69Å; R336-E342 PolarHBondContact NH2-OE1 2.96Å; R336-E342 IonicContact NH2-OE2 3.83Å; R336-E342 PolarHBondContact NH2-OE2 3.15Å; H338-E342 HydrophobicContact CB-CB 4.21Å; Y339-E342 PolarHBondContact O-N 3.32Å; E342-R345 IonicContact OE2-CZ 2.78Å; E342-R345 IonicContact OE2-NE 3.79Å; E342-R345 PolarHBondContact OE2-NE 3.32Å; E342-R345 IonicContact OE2-NH2 3.85Å; E342-R345 PolarHBondContact OE2-NH2 2.84Å
343	G	89.3	Confident	92.1	Very high	42 Å²	42	56.9 Å²	56.9	43%	0.433	33%	0.325	S	S	.	.			trans	72.7	165.8	-163.1	0	0	0	0	0	112.6	H338	H338-G343 PolarHBondContact CD2-O 2.89Å
344	S	90.6	Very high	92.3	Very high	64 Å²	64	54.9 Å²	54.9	45%	0.448	32%	0.317	S	S	.	.			trans	-70.2	135.6	-172.5	-161.9	0	0	0	0	112.6	G346 H392 I394	S344-G346 VanDerWaalsContact C-N 3.27Å; S344-G346 PolarHBondContact OG-N 3.39Å; S344-H392 WeakPolarHBondContact CB-NE2 3.46Å; S344-H392 PolarHBondContact OG-CD2 3.25Å; S344-H392 PolarHBondContact OG-NE2 2.75Å; S344-I394 VanDerWaalsContact OG-CD1 3.23Å; S344-I394 WeakPolarHBondContact OG-CD1 3.33Å
345	R	92.4	Very high	92.6	Very high	122 Å²	122	55.2 Å²	55.2	46%	0.46	32%	0.319	S	S	.	.			trans	-86.9	6.2	171	-65.1	-77.5	171.7	-149	-8.9	113.1	H338 E342	H338-R345 HydrophobicContact CB-CG 3.67Å; E342-R345 IonicContact OE2-CZ 2.78Å; E342-R345 IonicContact OE2-NE 3.79Å; E342-R345 PolarHBondContact OE2-NE 3.32Å; E342-R345 IonicContact OE2-NH2 3.85Å; E342-R345 PolarHBondContact OE2-NH2 2.84Å
346	G	94.7	Very high	92.9	Very high	25 Å²	25	54.2 Å²	54.2	26%	0.258	31%	0.314	S	S	.	.			trans	78.6	-175.9	-174.8	0	0	0	0	0	113	H335 S344	H335-G346 PolarHBondContact CE1-O 2.92Å; S344-G346 VanDerWaalsContact C-N 3.27Å; S344-G346 PolarHBondContact OG-N 3.39Å
347	A	96.9	Very high	93.1	Very high	12 Å²	12	52.1 Å²	52.1	10%	0.099	31%	0.308	C	S	.	.			trans	-78.8	159.8	-178	0	0	0	0	0	113.4	I394 D429 A431	A347-I394 HydrophobicContact CB-CB 4.45Å; A347-I394 HydrophobicContact CB-CG1 3.94Å; A347-D429 WeakPolarHBondContact CB-O 3.34Å; A347-A431 CarbonylContact C-O 3.57Å; A347-A431 WeakPolarHBondContact CA-O 3.32Å; A347-A431 WeakPolarHBondContact CB-O 3.25Å
348	V	97.3	Very high	93.3	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.006	30%	0.304	C	S	.	.			trans	-60	142	170.9	-177.9	0	0	0	0	109.7	P331 H355 P356 A431 I433 L459 I482	P331-V348 HydrophobicContact CB-CG1 3.5Å; V348-H355 PolarHBondContact O-ND1 3.16Å; V348-P356 HydrophobicContact CB-CG 4.44Å; V348-P356 HydrophobicContact CG1-CG 4.07Å; V348-P356 WeakPolarHBondContact O-CD 3.24Å; V348-A431 PolarHBondContact N-O 3.02Å; V348-I433 HydrophobicContact CG2-CD1 3.98Å; V348-I433 HydrophobicContact CG2-CG1 3.84Å; V348-L459 HydrophobicContact CB-CD1 4.3Å; V348-L459 HydrophobicContact CG1-CD1 4.17Å; V348-L459 HydrophobicContact CG2-CD1 4.38Å; V348-L459 HydrophobicContact CG2-CD2 4.44Å; V348-I482 HydrophobicContact CG1-CD1 4.03Å
349	K	96.3	Very high	93.5	Very high	87 Å²	87	53 Å²	53	38%	0.378	31%	0.311	S	S	.	.			trans	-112	156.4	-179	-69.1	-69.5	-172.4	172.9	0	110.8	P331 K332 G354 H355	P331-K349 CarbonylContact C-O 3.5Å; P331-K349 WeakPolarHBondContact CA-O 3.26Å; K332-K349 WeakPolarHBondContact CG-O 3.2Å; K332-K349 PolarHBondContact N-O 3.47Å; K349-G354 CarbonylContact C-O 3.54Å; K349-G354 VanDerWaalsContact CA-O 3.31Å; K349-G354 WeakPolarHBondContact CA-O 3.06Å; K349-G354 WeakPolarHBondContact CD-O 3.27Å; K349-H355 VanDerWaalsContact CE-CE1 3.49Å; K349-H355 WeakPolarHBondContact CE-CE1 3.38Å; K349-H355 PolarHBondContact NZ-CE1 3.42Å; K349-H355 VanDerWaalsContact NZ-CE1 3.34Å; K349-H355 PolarHBondContact NZ-NE2 3.38Å
350	A	95.3	Very high	93.6	Very high	0 Å²	0	49 Å²	49	0%	0	30%	0.295	C	S	.	.			trans	-87.6	159.3	169.5	0	0	0	0	0	111.5	V329 K332 T352 G353 G354 H355	V329-A350 HydrophobicContact CG1-CB 3.42Å; V329-A350 VanDerWaalsContact CG1-CB 3.42Å; K332-A350 WeakPolarHBondContact CE-O 3.47Å; K332-A350 VanDerWaalsContact CG-C 3.44Å; K332-A350 WeakPolarHBondContact CG-O 3.37Å; A350-T352 PolarHBondContact O-N 2.74Å; A350-G353 PolarHBondContact O-N 2.92Å; A350-G354 PolarHBondContact N-O 2.68Å; A350-H355 WeakPolarHBondContact CB-O 3.41Å
351	P	85.6	Confident	93.9	Very high	82 Å²	82	46.2 Å²	46.2	53%	0.532	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-48.2	-42.8	175.4	-30.6	37.3	0	0	0	113.6	Q330 G353	Q330-P351 WeakPolarHBondContact O-CD 3.49Å; P351-G353 PolarHBondContact O-N 2.69Å
352	T	86.2	Confident	94	Very high	124 Å²	124	41.9 Å²	41.9	76%	0.761	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	-0.3	177.9	55	0	0	0	0	115.4	A350 G354	A350-T352 PolarHBondContact O-N 2.74Å; T352-G354 VanDerWaalsContact C-N 3.27Å; T352-G354 PolarHBondContact O-N 2.99Å
353	G	85.2	Confident	94.2	Very high	43 Å²	43	40.6 Å²	40.6	44%	0.443	25%	0.254	S	S	.	.	S	Bend	trans	87.1	-14.9	-178.8	0	0	0	0	0	114.8	A350 P351	A350-G353 PolarHBondContact O-N 2.92Å; P351-G353 PolarHBondContact O-N 2.69Å
354	G	94.5	Very high	94.3	Very high	32 Å²	32	48.7 Å²	48.7	33%	0.33	27%	0.271	S	S	.	.	S	Bend	trans	-72.9	-153.6	168.4	0	0	0	0	0	113.1	K349 A350 T352	K349-G354 CarbonylContact C-O 3.54Å; K349-G354 VanDerWaalsContact CA-O 3.31Å; K349-G354 WeakPolarHBondContact CA-O 3.06Å; K349-G354 WeakPolarHBondContact CD-O 3.27Å; A350-G354 PolarHBondContact N-O 2.68Å; T352-G354 VanDerWaalsContact C-N 3.27Å; T352-G354 PolarHBondContact O-N 2.99Å
355	H	97.8	Very high	94.3	Very high	36 Å²	36	47 Å²	47	17%	0.167	27%	0.265	C	S	.	.			trans	-112.8	161.9	176.4	-72.4	-80.4	0	0	0	110.9	V348 K349 A350 I427 I428 D429	V348-H355 PolarHBondContact O-ND1 3.16Å; K349-H355 VanDerWaalsContact CE-CE1 3.49Å; K349-H355 WeakPolarHBondContact CE-CE1 3.38Å; K349-H355 PolarHBondContact NZ-CE1 3.42Å; K349-H355 VanDerWaalsContact NZ-CE1 3.34Å; K349-H355 PolarHBondContact NZ-NE2 3.38Å; A350-H355 WeakPolarHBondContact CB-O 3.41Å; H355-I427 HydrophobicContact CB-CG2 3.7Å; H355-I428 PolarHBondContact ND1-O 3.38Å; H355-D429 HydrophobicContact CB-CB 4.48Å
356	P	98.2	Very high	94.2	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	28%	0.283	C	S	.	.			trans	-57.9	154.2	168.9	-18.3	31	0	0	0	110.7	V329 P331 V348 I428 L459	V329-P356 CarbonylContact O-C 3.55Å; V329-P356 WeakPolarHBondContact O-CA 3.26Å; V329-P356 WeakPolarHBondContact O-CB 3.39Å; P331-P356 HydrophobicContact CB-CG 3.92Å; V348-P356 HydrophobicContact CB-CG 4.44Å; V348-P356 HydrophobicContact CG1-CG 4.07Å; V348-P356 WeakPolarHBondContact O-CD 3.24Å; P356-I428 HydrophobicContact CB-CB 4.18Å; P356-I428 HydrophobicContact CB-CG1 4.29Å; P356-I428 WeakPolarHBondContact O-CG1 3.18Å; P356-I428 PolarHBondContact O-N 3.02Å; P356-L459 HydrophobicContact CG-CD1 4.23Å
357	V	98.4	Very high	94.1	Very high	14 Å²	14	54.6 Å²	54.6	9%	0.085	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	133.5	-177	-176.6	0	0	0	0	109.6	I327 E328 V329 K425 A426 I427	I327-V357 CarbonylContact C-O 3.56Å; E328-V357 HydrophobicContact CB-CB 4.49Å; E328-V357 HydrophobicContact CB-CG1 4.39Å; E328-V357 PolarHBondContact N-O 2.95Å; V329-V357 HydrophobicContact CB-CB 3.81Å; V329-V357 HydrophobicContact CB-CG2 3.87Å; V329-V357 HydrophobicContact CG2-CB 3.89Å; V329-V357 HydrophobicContact CG2-CG2 3.87Å; V329-V357 PolarHBondContact N-O 3.05Å; V329-V357 VanDerWaalsContact N-O 3.15Å; V329-V357 PolarHBondContact O-N 2.99Å; V357-K425 HydrophobicContact CG1-CD 4.28Å; V357-K425 HydrophobicContact CG1-CG 3.77Å; V357-A426 WeakPolarHBondContact CA-O 3.4Å; V357-I427 HydrophobicContact CG2-CG1 4.26Å
358	V	98.4	Very high	94	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.8	139	-176.7	-179.2	0	0	0	0	109.2	L325 H326 I327 L371 K425 A426 I428 F461	L325-V358 HydrophobicContact CD1-CG1 3.76Å; L325-V358 HydrophobicContact CG-CG1 4.29Å; H326-V358 WeakPolarHBondContact O-CA 3.48Å; I327-V358 HydrophobicContact CG1-CG2 4.37Å; V358-L371 HydrophobicContact CB-CD2 4.2Å; V358-L371 HydrophobicContact CG1-CD2 4.09Å; V358-K425 WeakPolarHBondContact O-CA 3.38Å; V358-A426 PolarHBondContact N-O 3.33Å; V358-A426 PolarHBondContact O-N 2.85Å; V358-I428 HydrophobicContact CG2-CD1 4.28Å; V358-I428 HydrophobicContact CG2-CG1 4.17Å; V358-F461 HydrophobicContact CG1-CB 4.44Å; V358-F461 HydrophobicContact CG1-CG 4.47Å; V358-F461 HydrophobicContact CG2-CD1 3.76Å; V358-F461 HydrophobicContact CG2-CD2 3.9Å; V358-F461 HydrophobicContact CG2-CE1 3.72Å; V358-F461 HydrophobicContact CG2-CE2 3.85Å; V358-F461 HydrophobicContact CG2-CG 3.84Å; V358-F461 HydrophobicContact CG2-CZ 3.75Å
359	Q	98.3	Very high	93.9	Very high	33 Å²	33	58 Å²	58	15%	0.154	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	139.6	-179	-172.2	167.5	8.8	0	0	111.4	H326 E328 N423 M424 K425	H326-Q359 PolarHBondContact N-O 3.11Å; H326-Q359 PolarHBondContact O-N 3.46Å; E328-Q359 PolarHBondContact OE2-OE1 3.49Å; Q359-N423 PolarHBondContact NE2-O 2.84Å; Q359-M424 WeakPolarHBondContact CA-O 3.18Å; Q359-K425 HydrophobicContact CB-CB 4.25Å; Q359-K425 HydrophobicContact CB-CG 4.32Å; Q359-K425 HydrophobicContact CG-CB 4.03Å
360	L	98.2	Very high	93.9	Very high	3 Å²	3	55.3 Å²	55.3	2%	0.016	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	108	172.7	172.7	60.4	0	0	0	110.3	E324 L325 V369 L418 M424 V463 I465 L475	E324-L360 CarbonylContact O-C 3.59Å; E324-L360 WeakPolarHBondContact O-CA 3.3Å; L325-L360 HydrophobicContact CD1-CB 4.24Å; L360-V369 HydrophobicContact CD2-CB 4.41Å; L360-V369 HydrophobicContact CD2-CG1 4.16Å; L360-V369 HydrophobicContact CD2-CG2 4.42Å; L360-L418 HydrophobicContact CB-CD1 3.84Å; L360-L418 HydrophobicContact CD2-CD1 4.49Å; L360-M424 HydrophobicContact CB-CB 4.16Å; L360-M424 HydrophobicContact CD2-CE 4.01Å; L360-M424 PolarHBondContact N-O 2.97Å; L360-M424 VanDerWaalsContact O-CB 3.27Å; L360-M424 WeakPolarHBondContact O-CB 3.46Å; L360-V463 HydrophobicContact CD1-CG2 4.3Å; L360-V463 HydrophobicContact CD2-CG2 4.24Å; L360-I465 HydrophobicContact CD1-CD1 3.98Å; L360-I465 HydrophobicContact CD2-CD1 3.82Å; L360-I465 HydrophobicContact CD2-CG1 4.22Å; L360-I465 HydrophobicContact CG-CD1 4.49Å; L360-L475 HydrophobicContact CD1-CD1 3.85Å
361	H	97.3	Very high	94	Very high	68 Å²	68	55.3 Å²	55.3	32%	0.315	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	163.3	176.2	-57.8	114.1	0	0	0	112.3	E324 Y363	E324-H361 HydrophobicContact CB-CB 4.32Å; E324-H361 PolarHBondContact N-O 2.97Å; E324-H361 PolarHBondContact O-N 3.38Å; H361-Y363 PolarHBondContact O-N 2.78Å
362	G	94.3	Very high	94.6	Very high	31 Å²	31	51.9 Å²	51.9	32%	0.32	29%	0.294	S	S	.	.	S	Bend	trans	77.5	-23.6	176.3	0	0	0	0	0	115.8	Q322	Q322-G362 VanDerWaalsContact O-CA 3.3Å; Q322-G362 WeakPolarHBondContact O-CA 3.38Å
363	Y	94.3	Very high	95.2	Very high	34 Å²	34	46 Å²	46	13%	0.133	26%	0.258	C	S	.	.			trans	-58.9	142.2	177.8	-168.3	-105.2	0	0	0	112.2	H361 G365 D367 V369 P420 M424 I465	H361-Y363 PolarHBondContact O-N 2.78Å; Y363-G365 VanDerWaalsContact CE1-CA 3.46Å; Y363-G365 WeakPolarHBondContact CE1-O 3.47Å; Y363-D367 WeakPolarHBondContact CE1-O 3.15Å; Y363-D367 PolarHBondContact OH-O 2.84Å; Y363-V369 HydrophobicContact CD2-CG2 4.23Å; Y363-V369 HydrophobicContact CE1-CG2 4.13Å; Y363-V369 HydrophobicContact CE2-CG2 3.77Å; Y363-P420 HydrophobicContact CE1-CG 4.17Å; Y363-M424 HydrophobicContact CD1-CE 3.46Å; Y363-M424 VanDerWaalsContact CD1-CE 3.46Å; Y363-M424 HydrophobicContact CD1-CG 4.02Å; Y363-M424 HydrophobicContact CD1-SD 3.65Å; Y363-M424 HydrophobicContact CE1-CE 3.86Å; Y363-M424 HydrophobicContact CE1-SD 4.12Å; Y363-M424 HydrophobicContact CG-CE 3.94Å; Y363-I465 HydrophobicContact CD2-CG2 4.05Å; Y363-I465 HydrophobicContact CE2-CG2 3.97Å
364	R	90.8	Very high	95.8	Very high	211 Å²	211	44 Å²	44	80%	0.796	24%	0.237	S	C	*	.			trans	-136.4	1.7	-177.6	-65.8	-64.5	-179.7	-93.5	1.7	113.7
365	G	89.6	Confident	95.9	Very high	30 Å²	30	42.6 Å²	42.6	31%	0.309	22%	0.221	S	C	.	.			trans	-71.2	167.2	174.3	0	0	0	0	0	112	Y363	Y363-G365 VanDerWaalsContact CE1-CA 3.46Å; Y363-G365 WeakPolarHBondContact CE1-O 3.47Å
366	K	90.3	Very high	95.8	Very high	195 Å²	195	40.9 Å²	40.9	85%	0.848	21%	0.214	S	C	*	.	S	Bend	trans	-96.2	-16.3	178.7	-64.8	-179	-179.4	177.6	0	112.7
367	D	92.8	Very high	95.6	Very high	110 Å²	110	41.7 Å²	41.7	59%	0.588	22%	0.219	S	C	*	.	S	Bend	trans	-87.9	152.2	-174.3	-51.2	-76.9	0	0	0	111.4	Y363 P420	Y363-D367 WeakPolarHBondContact CE1-O 3.15Å; Y363-D367 PolarHBondContact OH-O 2.84Å; D367-P420 WeakPolarHBondContact O-CG 3.32Å
368	P	94.6	Very high	95.2	Very high	77 Å²	77	41.9 Å²	41.9	50%	0.5	22%	0.222	S	C	.	.	P	Polyproline II helix	trans	-74	141.3	176.4	30.8	-34.5	0	0	0	111.6	P417 L418 E419	P368-P417 HydrophobicContact CB-CB 4.21Å; P368-L418 CarbonylContact C-O 3.59Å; P368-L418 VanDerWaalsContact CA-O 3.26Å; P368-L418 WeakPolarHBondContact CA-O 3.45Å; P368-E419 HydrophobicContact CB-CG 4.33Å
369	V	95.6	Very high	94.4	Very high	9 Å²	9	45.5 Å²	45.5	6%	0.055	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	132.2	176.4	173.7	0	0	0	0	110	L360 Y363 L371 L418 M424 V463 I465	L360-V369 HydrophobicContact CD2-CB 4.41Å; L360-V369 HydrophobicContact CD2-CG1 4.16Å; L360-V369 HydrophobicContact CD2-CG2 4.42Å; Y363-V369 HydrophobicContact CD2-CG2 4.23Å; Y363-V369 HydrophobicContact CE1-CG2 4.13Å; Y363-V369 HydrophobicContact CE2-CG2 3.77Å; V369-L371 PolarHBondContact O-N 2.97Å; V369-L418 PolarHBondContact N-O 2.78Å; V369-L418 PolarHBondContact O-N 3.33Å; V369-M424 HydrophobicContact CB-CE 3.72Å; V369-M424 HydrophobicContact CG2-CE 3.59Å; V369-V463 HydrophobicContact CG1-CB 3.87Å; V369-V463 HydrophobicContact CG1-CG1 4.09Å; V369-I465 HydrophobicContact CG1-CG1 4.36Å
370	G	95.9	Very high	93.3	Very high	29 Å²	29	50 Å²	50	30%	0.299	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	114.6	176.7	0	0	0	0	0	112.1
371	L	97.9	Very high	92.4	Very high	0 Å²	0	60.8 Å²	60.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	112.4	170.8	169	59.4	0	0	0	109.9	V358 V369 I373 E415 I416 L418 I428 F461 V463	V358-L371 HydrophobicContact CB-CD2 4.2Å; V358-L371 HydrophobicContact CG1-CD2 4.09Å; V369-L371 PolarHBondContact O-N 2.97Å; L371-I373 HydrophobicContact CG-CG1 4.33Å; L371-E415 WeakPolarHBondContact O-CA 3.47Å; L371-I416 HydrophobicContact CB-CG1 4Å; L371-I416 HydrophobicContact CD2-CD1 4.05Å; L371-I416 HydrophobicContact CD2-CG1 4.12Å; L371-I416 HydrophobicContact CG-CG1 4.1Å; L371-I416 PolarHBondContact N-O 3.06Å; L371-I416 PolarHBondContact O-N 3.11Å; L371-L418 HydrophobicContact CB-CD1 3.98Å; L371-L418 HydrophobicContact CB-CD2 4.37Å; L371-L418 HydrophobicContact CB-CG 3.79Å; L371-L418 HydrophobicContact CD2-CD1 4.28Å; L371-L418 HydrophobicContact CD2-CD2 3.85Å; L371-L418 HydrophobicContact CD2-CG 4.15Å; L371-I428 HydrophobicContact CD2-CD1 4.35Å; L371-F461 HydrophobicContact CD1-CB 3.98Å; L371-F461 HydrophobicContact CD1-CD1 4.27Å; L371-V463 HydrophobicContact CB-CG1 4.19Å; L371-V463 HydrophobicContact CD1-CG1 4.01Å
372	Q	97.9	Very high	91.5	Very high	11 Å²	11	62.6 Å²	62.6	5%	0.051	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	139.8	173.6	-71.5	171.5	-2.4	0	0	110.7	V413 L414 E415 F461 R462 H464	Q372-V413 HydrophobicContact CB-CG1 3.74Å; Q372-V413 HydrophobicContact CG-CG1 3.99Å; Q372-L414 CarbonylContact C-O 3.58Å; Q372-L414 WeakPolarHBondContact CA-O 3.19Å; Q372-E415 HydrophobicContact CG-CG 4.08Å; Q372-E415 WeakPolarHBondContact CG-OE2 2.91Å; Q372-E415 PolarHBondContact NE2-OE2 2.96Å; Q372-E415 VanDerWaalsContact NE2-OE2 3.1Å; Q372-F461 CarbonylContact O-C 3.56Å; Q372-F461 WeakPolarHBondContact O-CA 3.45Å; Q372-R462 HydrophobicContact CB-CB 4.37Å; Q372-R462 PolarHBondContact N-O 3.31Å; Q372-R462 PolarHBondContact O-N 3.48Å; Q372-H464 PolarHBondContact OE1-NE2 3.19Å
373	I	98.4	Very high	91.3	Very high	0 Å²	0	62.8 Å²	62.8	0%	0	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	123.4	-177.7	-43.9	178.8	0	0	0	108.7	L371 V413 L414 I416 I428 V460 F461	L371-I373 HydrophobicContact CG-CG1 4.33Å; I373-V413 WeakPolarHBondContact O-CA 3.43Å; I373-L414 HydrophobicContact CB-CB 4.33Å; I373-L414 PolarHBondContact N-O 2.83Å; I373-L414 PolarHBondContact O-N 2.95Å; I373-I416 HydrophobicContact CD1-CD1 3.88Å; I373-I416 HydrophobicContact CD1-CG1 4.17Å; I373-I428 HydrophobicContact CD1-CD1 4.08Å; I373-I428 HydrophobicContact CD1-CG2 3.99Å; I373-V460 WeakPolarHBondContact CA-O 3.4Å; I373-F461 HydrophobicContact CB-CD1 4.5Å; I373-F461 HydrophobicContact CD1-CD1 4.37Å; I373-F461 HydrophobicContact CD1-CE1 4.11Å; I373-F461 HydrophobicContact CG1-CD1 3.98Å; I373-F461 HydrophobicContact CG1-CE1 4.14Å; I373-F461 HydrophobicContact CG2-CD1 4.08Å; I373-F461 HydrophobicContact CG2-CE1 3.82Å
374	F	98.1	Very high	91.2	Very high	1 Å²	1	65.2 Å²	65.2	0%	0.004	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	170	174.4	65.8	-84	0	0	0	111.9	L312 P385 T411 V413 V460	L312-F374 HydrophobicContact CB-CE2 4.3Å; L312-F374 HydrophobicContact CB-CZ 4.17Å; L312-F374 HydrophobicContact CD2-CD1 4.17Å; L312-F374 HydrophobicContact CD2-CE1 3.91Å; L312-F374 HydrophobicContact CD2-CZ 4.27Å; F374-P385 HydrophobicContact CD2-CG 4.27Å; F374-P385 HydrophobicContact CE2-CG 4.03Å; F374-T411 HydrophobicContact CB-CG2 4.41Å; F374-V413 HydrophobicContact CB-CG2 4.2Å; F374-V460 HydrophobicContact CD1-CB 4.08Å; F374-V460 HydrophobicContact CD1-CG1 4.33Å; F374-V460 HydrophobicContact CD2-CB 4.16Å; F374-V460 HydrophobicContact CD2-CG2 4.46Å; F374-V460 HydrophobicContact CE1-CB 3.78Å; F374-V460 HydrophobicContact CE1-CG1 3.57Å; F374-V460 HydrophobicContact CE2-CB 3.88Å; F374-V460 HydrophobicContact CE2-CG1 4.09Å; F374-V460 HydrophobicContact CE2-CG2 4.09Å; F374-V460 HydrophobicContact CG-CB 4.27Å; F374-V460 HydrophobicContact CZ-CB 3.69Å; F374-V460 HydrophobicContact CZ-CG1 3.44Å; F374-V460 VanDerWaalsContact CZ-CG1 3.44Å; F374-V460 HydrophobicContact CZ-CG2 4.29Å; F374-V460 PolarHBondContact N-O 3.49Å; F374-V460 PolarHBondContact O-N 2.9Å
375	I	97.8	Very high	91.3	Very high	2 Å²	2	55.9 Å²	55.9	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	117.1	178.7	-54.3	-57.3	0	0	0	109.4	H386 V391 I433 V457 R458 L459	I375-H386 HydrophobicContact CG2-CB 4.05Å; I375-H386 PolarHBondContact O-N 2.87Å; I375-V391 HydrophobicContact CD1-CB 4.38Å; I375-V391 HydrophobicContact CG1-CB 4.13Å; I375-V391 VanDerWaalsContact CG1-N 3.32Å; I375-I433 HydrophobicContact CD1-CG1 4.16Å; I375-I433 HydrophobicContact CD1-CG2 4.48Å; I375-V457 HydrophobicContact CG2-CB 3.55Å; I375-V457 HydrophobicContact CG2-CG1 3.86Å; I375-V457 HydrophobicContact CG2-CG2 3.8Å; I375-R458 WeakPolarHBondContact CA-O 3.48Å; I375-L459 HydrophobicContact CD1-CD2 3.69Å
376	G	95.6	Very high	91.4	Very high	0 Å²	0	55.2 Å²	55.2	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	168.6	177.5	0	0	0	0	0	113.5	K384 V457 R458	G376-K384 CarbonylContact C-O 3.52Å; G376-K384 WeakPolarHBondContact CA-O 3.4Å; G376-V457 WeakPolarHBondContact O-CA 3.42Å; G376-V457 WeakPolarHBondContact O-CB 3.5Å; G376-R458 PolarHBondContact N-O 2.99Å; G376-R458 PolarHBondContact O-N 3.17Å
377	T	93.3	Very high	91.4	Very high	18 Å²	18	46.7 Å²	46.7	11%	0.11	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-55.9	154.4	163.8	37.5	0	0	0	0	112.8	D379 I382 L383 K384 R458	T377-D379 VanDerWaalsContact C-N 3.35Å; T377-I382 PolarHBondContact OG1-O 3.48Å; T377-L383 WeakPolarHBondContact OG1-CA 3.48Å; T377-K384 HydrophobicContact CG2-CG 3.73Å; T377-K384 PolarHBondContact N-O 2.8Å; T377-K384 PolarHBondContact OG1-N 2.84Å; T377-K384 PolarHBondContact OG1-O 2.81Å; T377-R458 WeakPolarHBondContact O-CD 3.32Å
378	A	89.9	Confident	91.4	Very high	18 Å²	18	41.8 Å²	41.8	15%	0.149	21%	0.213	C	C	.	.	S	Bend	trans	-75.2	-21.5	175	0	0	0	0	0	114.1	R456 R458 P481	A378-R456 HydrophobicContact CB-CB 3.68Å; A378-R456 WeakPolarHBondContact CB-O 3.46Å; A378-R458 PolarHBondContact O-NE 2.85Å; A378-R458 PolarHBondContact O-NH2 2.81Å; A378-P481 HydrophobicContact CB-CB 4.27Å
379	D	82.8	Confident	91.4	Very high	76 Å²	76	38.5 Å²	38.5	41%	0.406	19%	0.191	S	C	.	.			trans	-84.7	127.8	174.5	-175.6	6	0	0	0	110.5	T377 R381 I382 L383	T377-D379 VanDerWaalsContact C-N 3.35Å; D379-R381 WeakPolarHBondContact OD1-CB 3.34Å; D379-R381 PolarHBondContact OD1-N 2.94Å; D379-I382 CarbonylContact O-C 3.52Å; D379-L383 PolarHBondContact O-N 2.94Å
380	E	74.2	Confident	91.4	Very high	126 Å²	126	38.9 Å²	38.9	59%	0.589	19%	0.192	S	C	*	.	S	Bend	trans	-74.7	-30.3	176.2	-76.3	161.5	-149.5	0	0	112.3	I382 L383 R458	E380-I382 PolarHBondContact O-N 2.86Å; E380-L383 PolarHBondContact O-N 2.78Å; E380-R458 IonicContact OE1-CZ 3.33Å; E380-R458 IonicContact OE1-NH1 3.57Å; E380-R458 PolarHBondContact OE1-NH1 2.86Å; E380-R458 IonicContact OE1-NH2 3.61Å; E380-R458 PolarHBondContact OE1-NH2 3.34Å
381	R	79.4	Confident	91.5	Very high	231 Å²	231	37.5 Å²	37.5	87%	0.872	18%	0.177	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67	-26.5	-178.5	-62	179.7	176.3	-172.7	-1.1	112.4	D379	D379-R381 WeakPolarHBondContact OD1-CB 3.34Å; D379-R381 PolarHBondContact OD1-N 2.94Å
382	I	79.1	Confident	91.5	Very high	105 Å²	105	39.7 Å²	39.7	54%	0.538	19%	0.188	S	C	.	.	T	Hydrogen-bonded Turn	trans	-130.9	57.9	178.2	-44	-180	0	0	0	107.8	T377 D379 E380 K384	T377-I382 PolarHBondContact OG1-O 3.48Å; D379-I382 CarbonylContact O-C 3.52Å; E380-I382 PolarHBondContact O-N 2.86Å; I382-K384 HydrophobicContact CG2-CD 4.22Å; I382-K384 HydrophobicContact CG2-CG 4.47Å; I382-K384 PolarHBondContact O-N 3.42Å; I382-K384 VanDerWaalsContact O-N 3.07Å
383	L	88.9	Confident	91.5	Very high	35 Å²	35	43.4 Å²	43.4	18%	0.183	20%	0.201	C	C	.	.			trans	-70.4	100.2	177.6	-170.8	68.9	0	0	0	110.1	T377 D379 E380 V460 A478	T377-L383 WeakPolarHBondContact OG1-CA 3.48Å; D379-L383 PolarHBondContact O-N 2.94Å; E380-L383 PolarHBondContact O-N 2.78Å; L383-V460 HydrophobicContact CD1-CG2 3.83Å; L383-V460 HydrophobicContact CD2-CG1 4.13Å; L383-V460 HydrophobicContact CD2-CG2 4.35Å; L383-V460 HydrophobicContact CG-CG2 4.3Å; L383-A478 HydrophobicContact CD1-CB 4.03Å; L383-A478 HydrophobicContact CD2-CB 3.97Å
384	K	92.1	Very high	91.4	Very high	85 Å²	85	44.1 Å²	44.1	37%	0.37	21%	0.205	S	C	.	.			trans	-135.9	157	-179.6	62.8	176.6	177.3	168.3	0	110.7	E313 G376 T377 I382 H386 E447	E313-K384 HydrophobicContact CB-CB 4.45Å; G376-K384 CarbonylContact C-O 3.52Å; G376-K384 WeakPolarHBondContact CA-O 3.4Å; T377-K384 HydrophobicContact CG2-CG 3.73Å; T377-K384 PolarHBondContact N-O 2.8Å; T377-K384 PolarHBondContact OG1-N 2.84Å; T377-K384 PolarHBondContact OG1-O 2.81Å; I382-K384 HydrophobicContact CG2-CD 4.22Å; I382-K384 HydrophobicContact CG2-CG 4.47Å; I382-K384 PolarHBondContact O-N 3.42Å; I382-K384 VanDerWaalsContact O-N 3.07Å; K384-H386 PolarHBondContact O-N 3.23Å; K384-E447 IonicContact NZ-OE1 2.69Å
385	P	93.7	Very high	91.1	Very high	16 Å²	16	48.6 Å²	48.6	10%	0.104	23%	0.232	C	C	.	.	B	Isolated β-bridge	trans	-50.3	128.7	172.1	-30.7	37.2	0	0	0	113	L312 F374 A387 T411	L312-P385 HydrophobicContact CB-CG 3.54Å; L312-P385 HydrophobicContact CD1-CG 4.1Å; F374-P385 HydrophobicContact CD2-CG 4.27Å; F374-P385 HydrophobicContact CE2-CG 4.03Å; P385-A387 PolarHBondContact O-N 2.87Å; P385-T411 HydrophobicContact CB-CG2 3.81Å; P385-T411 WeakPolarHBondContact CB-OG1 3.12Å; P385-T411 HydrophobicContact CG-CG2 4.27Å
386	H	92.4	Very high	90.7	Very high	16 Å²	16	50.6 Å²	50.6	7%	0.074	25%	0.254	C	S	.	.			trans	-71.9	119.7	-175.5	-161.5	-67.2	0	0	0	110.9	I375 K384 F388 Y389	I375-H386 HydrophobicContact CG2-CB 4.05Å; I375-H386 PolarHBondContact O-N 2.87Å; K384-H386 PolarHBondContact O-N 3.23Å; H386-F388 VanDerWaalsContact C-N 3.29Å; H386-F388 PolarHBondContact ND1-N 2.61Å; H386-F388 VanDerWaalsContact ND1-N 3.18Å; H386-F388 PolarHBondContact O-N 2.72Å; H386-Y389 AromaticContact CE1-CD2 3.53Å; H386-Y389 AromaticContact ND1-CD2 3.51Å; H386-Y389 PolarHBondContact O-N 2.85Å
387	A	90.1	Very high	90.1	Very high	15 Å²	15	61.2 Å²	61.2	12%	0.124	30%	0.3	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-37.8	-175.5	0	0	0	0	0	113.6	P385 I441 K445 E447	P385-A387 PolarHBondContact O-N 2.87Å; A387-I441 WeakPolarHBondContact O-CD1 3.49Å; A387-K445 HydrophobicContact CB-CD 4.12Å; A387-E447 WeakPolarHBondContact CB-OE2 3.31Å
388	F	91.2	Very high	89.8	Confident	7 Å²	7	66.4 Å²	66.4	3%	0.031	33%	0.332	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	-4.6	-172.9	-64	-102.3	0	0	0	115.4	H386 L436 I441 G451	H386-F388 VanDerWaalsContact C-N 3.29Å; H386-F388 PolarHBondContact ND1-N 2.61Å; H386-F388 VanDerWaalsContact ND1-N 3.18Å; H386-F388 PolarHBondContact O-N 2.72Å; F388-L436 PolarHBondContact O-N 2.84Å; F388-I441 HydrophobicContact CD1-CB 4.37Å; F388-I441 HydrophobicContact CD1-CG1 3.76Å; F388-I441 HydrophobicContact CD1-CG2 4.44Å; F388-I441 HydrophobicContact CE1-CB 4.03Å; F388-I441 HydrophobicContact CE1-CG1 3.93Å; F388-I441 HydrophobicContact CE1-CG2 3.97Å; F388-I441 HydrophobicContact CE2-CG2 4.07Å; F388-I441 HydrophobicContact CG-CG1 4.24Å; F388-I441 HydrophobicContact CZ-CB 4.32Å; F388-I441 HydrophobicContact CZ-CG2 3.75Å; F388-G451 VanDerWaalsContact CE2-CA 3.41Å
389	Y	95.3	Very high	90	Very high	9 Å²	9	67 Å²	67	4%	0.035	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	142.4	-177.6	-68.5	-81	0	0	0	111.1	A337 H386 I433 L434 K435 V457 C484	A337-Y389 HydrophobicContact CB-CD1 4.04Å; A337-Y389 HydrophobicContact CB-CE1 3.68Å; H386-Y389 AromaticContact CE1-CD2 3.53Å; H386-Y389 AromaticContact ND1-CD2 3.51Å; H386-Y389 PolarHBondContact O-N 2.85Å; Y389-I433 HydrophobicContact CD1-CG2 3.89Å; Y389-I433 HydrophobicContact CG-CG2 4.42Å; Y389-L434 CarbonylContact C-O 3.56Å; Y389-L434 WeakPolarHBondContact CA-O 3.09Å; Y389-L434 WeakPolarHBondContact CD1-O 3.41Å; Y389-K435 HydrophobicContact CD1-CB 4.04Å; Y389-K435 HydrophobicContact CD1-CD 3.9Å; Y389-K435 HydrophobicContact CE1-CB 3.83Å; Y389-K435 HydrophobicContact CE1-CD 3.39Å; Y389-K435 HydrophobicContact CE1-CG 4.15Å; Y389-K435 HydrophobicContact CE2-CD 4.24Å; Y389-V457 HydrophobicContact CD2-CG1 3.33Å; Y389-V457 HydrophobicContact CE2-CG1 3.87Å; Y389-V457 HydrophobicContact CG-CG1 3.78Å; Y389-C484 HydrophobicContact CD1-CB 4.45Å; Y389-C484 HydrophobicContact CE1-CB 3.62Å; Y389-C484 HydrophobicContact CE2-CB 4.49Å
390	Q	96.6	Very high	90.4	Very high	16 Å²	16	69 Å²	69	8%	0.075	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	159.5	177.9	-79.1	-175.7	-12	0	0	111.3	G410 K412 L434 L436	Q390-G410 PolarHBondContact NE2-O 2.99Å; Q390-K412 HydrophobicContact CB-CB 4.27Å; Q390-K412 HydrophobicContact CB-CD 4.27Å; Q390-K412 HydrophobicContact CG-CB 4.45Å; Q390-K412 VanDerWaalsContact OE1-CD 3.28Å; Q390-L434 HydrophobicContact CB-CB 4.46Å; Q390-L434 PolarHBondContact N-O 2.87Å; Q390-L434 WeakPolarHBondContact O-CB 3.3Å; Q390-L434 PolarHBondContact O-N 2.84Å; Q390-L436 HydrophobicContact CG-CD1 3.86Å; Q390-L436 HydrophobicContact CG-CG 4.44Å
391	V	98.1	Very high	91.4	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	138.3	171.9	70.7	0	0	0	0	108.3	I375 K412 L414 A431	I375-V391 HydrophobicContact CD1-CB 4.38Å; I375-V391 HydrophobicContact CG1-CB 4.13Å; I375-V391 VanDerWaalsContact CG1-N 3.32Å; V391-K412 HydrophobicContact CG1-CB 3.94Å; V391-K412 WeakPolarHBondContact CG1-O 3.48Å; V391-L414 HydrophobicContact CG1-CB 4.09Å; V391-L414 HydrophobicContact CG2-CB 4.1Å; V391-A431 HydrophobicContact CG2-CB 4.05Å
392	H	97.5	Very high	92	Very high	46 Å²	46	57.3 Å²	57.3	21%	0.213	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	121.9	172.4	177.6	48.3	0	0	0	108.9	H338 S344 I394 G432 L434	H338-H392 AromaticContact CE1-CD2 3.25Å; H338-H392 PolarHBondContact CE1-CD2 3.48Å; H338-H392 AromaticContact CE1-CG 3.64Å; H338-H392 AromaticContact NE2-CD2 3.19Å; H338-H392 PolarHBondContact NE2-CD2 3.4Å; H338-H392 AromaticContact NE2-CG 3.64Å; H338-H392 AromaticContact NE2-NE2 3.6Å; S344-H392 WeakPolarHBondContact CB-NE2 3.46Å; S344-H392 PolarHBondContact OG-CD2 3.25Å; S344-H392 PolarHBondContact OG-NE2 2.75Å; H392-I394 WeakPolarHBondContact CD2-CD1 3.46Å; H392-I394 PolarHBondContact O-N 3.47Å; H392-G432 PolarHBondContact N-O 2.86Å; H392-G432 PolarHBondContact O-N 2.86Å; H392-L434 HydrophobicContact CB-CB 4.25Å
393	R	97.2	Very high	92.8	Very high	90 Å²	90	52.4 Å²	52.4	34%	0.34	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.8	115.9	171.3	-177.7	167.3	179.5	-103.8	6.9	110.8	T395 S403 E405 L414	R393-T395 HydrophobicContact CG-CG2 4.25Å; R393-S403 PolarHBondContact NE-O 3.01Å; R393-S403 PolarHBondContact NE-OG 3.1Å; R393-S403 PolarHBondContact NH2-O 2.8Å; R393-E405 HydrophobicContact CB-CB 4.4Å; R393-E405 WeakPolarHBondContact CB-OE2 3.26Å; R393-L414 HydrophobicContact CB-CD1 3.63Å; R393-L414 HydrophobicContact CG-CD1 3.66Å
394	I	96.5	Very high	93.1	Very high	14 Å²	14	57.7 Å²	57.7	7%	0.072	30%	0.302	C	S	.	.			trans	-93.1	133.4	175	-46.5	-62.6	0	0	0	108.9	S344 A347 H392 V399 C430	S344-I394 VanDerWaalsContact OG-CD1 3.23Å; S344-I394 WeakPolarHBondContact OG-CD1 3.33Å; A347-I394 HydrophobicContact CB-CB 4.45Å; A347-I394 HydrophobicContact CB-CG1 3.94Å; H392-I394 WeakPolarHBondContact CD2-CD1 3.46Å; H392-I394 PolarHBondContact O-N 3.47Å; I394-V399 HydrophobicContact CB-CG2 4.47Å; I394-V399 HydrophobicContact CG2-CG2 3.89Å; I394-C430 PolarHBondContact N-O 2.76Å
395	T	92.4	Very high	93.3	Very high	95 Å²	95	57.2 Å²	57.2	58%	0.583	30%	0.301	S	S	*	.			trans	-134.2	154.8	173.6	60.7	0	0	0	0	109.6	R393	R393-T395 HydrophobicContact CG-CG2 4.25Å
396	G	88	Confident	93.4	Very high	45 Å²	45	61.2 Å²	61.2	46%	0.464	31%	0.314	S	S	.	.	S	Bend	trans	152.3	174.5	177.9	0	0	0	0	0	112.5	T398 V399	G396-T398 PolarHBondContact O-N 2.79Å; G396-V399 PolarHBondContact O-N 2.82Å
397	K	84.7	Confident	93.4	Very high	222 Å²	222	66.1 Å²	66.1	97%	0.965	34%	0.339	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-16.6	-176.5	-62.6	-175.3	179.2	-177.1	0	114.7
398	T	86.1	Confident	93.5	Very high	127 Å²	127	67.2 Å²	67.2	78%	0.779	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.4	5.8	179.3	61.2	0	0	0	0	113.3	G396	G396-T398 PolarHBondContact O-N 2.79Å
399	V	94.3	Very high	93.4	Very high	31 Å²	31	73 Å²	73	19%	0.188	37%	0.374	C	S	.	.			trans	-102.4	120.3	174.3	-176.9	0	0	0	0	107.8	I394 G396 C430	I394-V399 HydrophobicContact CB-CG2 4.47Å; I394-V399 HydrophobicContact CG2-CG2 3.89Å; G396-V399 PolarHBondContact O-N 2.82Å; V399-C430 HydrophobicContact CG1-CB 3.75Å
400	T	91.6	Very high	93.1	Very high	117 Å²	117	74.8 Å²	74.8	72%	0.718	40%	0.395	S	S	*	.			trans	-95.1	-29.5	-179.9	62.4	0	0	0	0	112.2	N402 D429	T400-N402 PolarHBondContact O-N 2.97Å; T400-D429 WeakPolarHBondContact CB-OD2 3.22Å; T400-D429 PolarHBondContact N-OD2 2.88Å; T400-D429 PolarHBondContact OG1-OD2 3.2Å
401	T	93.8	Very high	92.9	Very high	25 Å²	25	74.9 Å²	74.9	15%	0.153	40%	0.397	C	S	.	.	S	Bend	trans	-81.3	113.3	-178.3	-49.5	0	0	0	0	111.6	I416 I427 D429	T401-I416 HydrophobicContact CG2-CB 3.88Å; T401-I416 HydrophobicContact CG2-CD1 3.96Å; T401-I416 HydrophobicContact CG2-CG2 3.73Å; T401-I427 PolarHBondContact OG1-O 3.09Å; T401-D429 WeakPolarHBondContact CB-OD1 3.46Å; T401-D429 PolarHBondContact N-OD1 3.02Å; T401-D429 VanDerWaalsContact N-OD1 3.16Å; T401-D429 PolarHBondContact OG1-OD1 2.91Å
402	N	93	Very high	92.9	Very high	88 Å²	88	76.5 Å²	76.5	47%	0.471	40%	0.404	S	S	.	.			trans	-65.8	134.9	166.5	-178.2	37	0	0	0	110.1	T400 Y404	T400-N402 PolarHBondContact O-N 2.97Å; N402-Y404 PolarHBondContact ND2-OH 2.89Å
403	S	95.7	Very high	92.9	Very high	2 Å²	2	74.3 Å²	74.3	1%	0.014	39%	0.394	C	S	.	.			trans	-147.1	152.9	-169.8	60.4	0	0	0	0	111.9	R393 E415	R393-S403 PolarHBondContact NE-O 3.01Å; R393-S403 PolarHBondContact NE-OG 3.1Å; R393-S403 PolarHBondContact NH2-O 2.8Å; S403-E415 WeakPolarHBondContact CA-O 3.14Å
404	Y	95.3	Very high	92.9	Very high	146 Å²	146	70 Å²	70	57%	0.573	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-126.5	135.6	-179.5	-59.4	-87.7	0	0	0	110.3	N402 L414 E415	N402-Y404 PolarHBondContact ND2-OH 2.89Å; Y404-L414 CarbonylContact O-C 3.6Å; Y404-L414 WeakPolarHBondContact O-CA 3.42Å; Y404-E415 PolarHBondContact N-O 3.44Å; Y404-E415 PolarHBondContact O-N 3.28Å
405	E	96.1	Very high	93	Very high	75 Å²	75	71.9 Å²	71.9	35%	0.35	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	127.3	176	-172.1	175.4	117.5	0	0	109.7	R393 K412 L414	R393-E405 HydrophobicContact CB-CB 4.4Å; R393-E405 WeakPolarHBondContact CB-OE2 3.26Å; E405-K412 VanDerWaalsContact OE1-CD 3.32Å; E405-K412 WeakPolarHBondContact OE1-CD 3.29Å; E405-K412 VanDerWaalsContact OE1-CE 3.26Å; E405-K412 WeakPolarHBondContact OE1-CE 3.25Å; E405-K412 IonicContact OE1-NZ 2.71Å; E405-K412 PolarHBondContact OE1-NZ 3.42Å; E405-K412 IonicContact OE2-NZ 3.42Å; E405-L414 HydrophobicContact CB-CD1 4.41Å
406	R	94.8	Very high	93.2	Very high	100 Å²	100	67.5 Å²	67.5	38%	0.377	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.5	154.7	174.7	59.9	-172	-85.7	-177.7	-1.5	109.8	V413 E415	R406-V413 HydrophobicContact CG-CB 4.04Å; R406-V413 PolarHBondContact N-O 2.87Å; R406-V413 PolarHBondContact O-N 2.69Å; R406-V413 VanDerWaalsContact O-O 3.13Å; R406-E415 VanDerWaalsContact CD-OE2 3.32Å; R406-E415 WeakPolarHBondContact CD-OE2 3.14Å; R406-E415 IonicContact CZ-OE2 2.62Å; R406-E415 IonicContact NE-OE2 2.78Å; R406-E415 IonicContact NH1-OE1 3.95Å; R406-E415 IonicContact NH1-OE2 2.65Å; R406-E415 PolarHBondContact NH1-OE2 2.76Å
407	I	94.3	Very high	93.6	Very high	118 Å²	118	67.8 Å²	67.8	61%	0.605	35%	0.353	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.1	126.3	175.4	-59.9	177.3	0	0	0	108.8	T411 K412	I407-T411 CarbonylContact C-O 3.58Å; I407-T411 WeakPolarHBondContact CA-O 3.45Å; I407-K412 HydrophobicContact CG1-CG 4.3Å
408	I	91.8	Very high	94.2	Very high	38 Å²	38	57.2 Å²	57.2	20%	0.195	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	121.6	174.3	-49.2	-178.1	0	0	0	107.2	L312 G410 T411 V413	L312-I408 HydrophobicContact CD1-CB 4.13Å; L312-I408 HydrophobicContact CD1-CG2 4.43Å; L312-I408 HydrophobicContact CD2-CD1 4.42Å; L312-I408 HydrophobicContact CG-CG2 4.47Å; I408-G410 PolarHBondContact O-N 2.78Å; I408-G410 VanDerWaalsContact O-N 3.12Å; I408-T411 PolarHBondContact N-O 2.81Å; I408-T411 WeakPolarHBondContact O-CA 3.24Å; I408-T411 VanDerWaalsContact O-CB 3.27Å; I408-T411 WeakPolarHBondContact O-CB 3.46Å; I408-T411 PolarHBondContact O-N 2.75Å; I408-V413 HydrophobicContact CB-CG2 4.37Å; I408-V413 HydrophobicContact CD1-CB 4.44Å; I408-V413 HydrophobicContact CD1-CG2 3.9Å; I408-V413 HydrophobicContact CG1-CG2 4.01Å
409	N	88.2	Confident	94.6	Very high	129 Å²	129	54 Å²	54	69%	0.69	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	43.4	178.5	-59	-2	0	0	0	113.5	T411	N409-T411 PolarHBondContact O-N 2.86Å
410	G	88.5	Confident	94.7	Very high	46 Å²	46	54.5 Å²	54.5	47%	0.474	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	74	-0.4	-177.6	0	0	0	0	0	115.9	Q390 I408	Q390-G410 PolarHBondContact NE2-O 2.99Å; I408-G410 PolarHBondContact O-N 2.78Å; I408-G410 VanDerWaalsContact O-N 3.12Å
411	T	93.8	Very high	94.8	Very high	18 Å²	18	56 Å²	56	11%	0.11	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.8	129.1	175.7	-58.1	0	0	0	0	110.1	L312 F374 P385 I407 I408 N409 V413	L312-T411 HydrophobicContact CD1-CG2 3.87Å; F374-T411 HydrophobicContact CB-CG2 4.41Å; P385-T411 HydrophobicContact CB-CG2 3.81Å; P385-T411 WeakPolarHBondContact CB-OG1 3.12Å; P385-T411 HydrophobicContact CG-CG2 4.27Å; I407-T411 CarbonylContact C-O 3.58Å; I407-T411 WeakPolarHBondContact CA-O 3.45Å; I408-T411 PolarHBondContact N-O 2.81Å; I408-T411 WeakPolarHBondContact O-CA 3.24Å; I408-T411 VanDerWaalsContact O-CB 3.27Å; I408-T411 WeakPolarHBondContact O-CB 3.46Å; I408-T411 PolarHBondContact O-N 2.75Å; N409-T411 PolarHBondContact O-N 2.86Å; T411-V413 HydrophobicContact CG2-CG2 4.49Å
412	K	96.6	Very high	94.8	Very high	35 Å²	35	58.5 Å²	58.5	15%	0.152	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	132	167.9	-70.3	-178.1	177.5	-142.2	0	110.1	Q390 V391 E405 I407	Q390-K412 HydrophobicContact CB-CB 4.27Å; Q390-K412 HydrophobicContact CB-CD 4.27Å; Q390-K412 HydrophobicContact CG-CB 4.45Å; Q390-K412 VanDerWaalsContact OE1-CD 3.28Å; V391-K412 HydrophobicContact CG1-CB 3.94Å; V391-K412 WeakPolarHBondContact CG1-O 3.48Å; E405-K412 VanDerWaalsContact OE1-CD 3.32Å; E405-K412 WeakPolarHBondContact OE1-CD 3.29Å; E405-K412 VanDerWaalsContact OE1-CE 3.26Å; E405-K412 WeakPolarHBondContact OE1-CE 3.25Å; E405-K412 IonicContact OE1-NZ 2.71Å; E405-K412 PolarHBondContact OE1-NZ 3.42Å; E405-K412 IonicContact OE2-NZ 3.42Å; I407-K412 HydrophobicContact CG1-CG 4.3Å
413	V	98	Very high	94.9	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	130.4	173.8	-175.4	0	0	0	0	107.5	L312 Q372 I373 F374 R406 I408 T411	L312-V413 HydrophobicContact CD1-CG2 3.76Å; L312-V413 HydrophobicContact CD2-CG2 4.46Å; Q372-V413 HydrophobicContact CB-CG1 3.74Å; Q372-V413 HydrophobicContact CG-CG1 3.99Å; I373-V413 WeakPolarHBondContact O-CA 3.43Å; F374-V413 HydrophobicContact CB-CG2 4.2Å; R406-V413 HydrophobicContact CG-CB 4.04Å; R406-V413 PolarHBondContact N-O 2.87Å; R406-V413 PolarHBondContact O-N 2.69Å; R406-V413 VanDerWaalsContact O-O 3.13Å; I408-V413 HydrophobicContact CB-CG2 4.37Å; I408-V413 HydrophobicContact CD1-CB 4.44Å; I408-V413 HydrophobicContact CD1-CG2 3.9Å; I408-V413 HydrophobicContact CG1-CG2 4.01Å; T411-V413 HydrophobicContact CG2-CG2 4.49Å
414	L	98	Very high	95	Very high	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	134.8	172.9	-166.9	74.6	0	0	0	108.6	Q372 I373 V391 R393 Y404 E405 C430 A431	Q372-L414 CarbonylContact C-O 3.58Å; Q372-L414 WeakPolarHBondContact CA-O 3.19Å; I373-L414 HydrophobicContact CB-CB 4.33Å; I373-L414 PolarHBondContact N-O 2.83Å; I373-L414 PolarHBondContact O-N 2.95Å; V391-L414 HydrophobicContact CG1-CB 4.09Å; V391-L414 HydrophobicContact CG2-CB 4.1Å; R393-L414 HydrophobicContact CB-CD1 3.63Å; R393-L414 HydrophobicContact CG-CD1 3.66Å; Y404-L414 CarbonylContact O-C 3.6Å; Y404-L414 WeakPolarHBondContact O-CA 3.42Å; E405-L414 HydrophobicContact CB-CD1 4.41Å; L414-C430 HydrophobicContact CD2-CB 4.38Å; L414-C430 WeakPolarHBondContact CD2-O 3.39Å; L414-A431 HydrophobicContact CD2-CB 3.93Å
415	E	97.5	Very high	95.1	Very high	52 Å²	52	56.8 Å²	56.8	24%	0.243	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	130.3	-179	-158.6	166.4	111	0	0	110.3	L371 Q372 S403 Y404 R406	L371-E415 WeakPolarHBondContact O-CA 3.47Å; Q372-E415 HydrophobicContact CG-CG 4.08Å; Q372-E415 WeakPolarHBondContact CG-OE2 2.91Å; Q372-E415 PolarHBondContact NE2-OE2 2.96Å; Q372-E415 VanDerWaalsContact NE2-OE2 3.1Å; S403-E415 WeakPolarHBondContact CA-O 3.14Å; Y404-E415 PolarHBondContact N-O 3.44Å; Y404-E415 PolarHBondContact O-N 3.28Å; R406-E415 VanDerWaalsContact CD-OE2 3.32Å; R406-E415 WeakPolarHBondContact CD-OE2 3.14Å; R406-E415 IonicContact CZ-OE2 2.62Å; R406-E415 IonicContact NE-OE2 2.78Å; R406-E415 IonicContact NH1-OE1 3.95Å; R406-E415 IonicContact NH1-OE2 2.65Å; R406-E415 PolarHBondContact NH1-OE2 2.76Å
416	I	97.4	Very high	95.2	Very high	3 Å²	3	53.6 Å²	53.6	2%	0.015	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	148.5	-180	65.7	172.7	0	0	0	111.1	L371 I373 T401 A426 I428	L371-I416 HydrophobicContact CB-CG1 4Å; L371-I416 HydrophobicContact CD2-CD1 4.05Å; L371-I416 HydrophobicContact CD2-CG1 4.12Å; L371-I416 HydrophobicContact CG-CG1 4.1Å; L371-I416 PolarHBondContact N-O 3.06Å; L371-I416 PolarHBondContact O-N 3.11Å; I373-I416 HydrophobicContact CD1-CD1 3.88Å; I373-I416 HydrophobicContact CD1-CG1 4.17Å; T401-I416 HydrophobicContact CG2-CB 3.88Å; T401-I416 HydrophobicContact CG2-CD1 3.96Å; T401-I416 HydrophobicContact CG2-CG2 3.73Å; I416-A426 HydrophobicContact CD1-CB 3.74Å; I416-I428 HydrophobicContact CD1-CD1 3.7Å
417	P	96.3	Very high	95.3	Very high	52 Å²	52	53 Å²	53	34%	0.338	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	127.3	177.8	31	-33.1	0	0	0	112	P368 E419	P368-P417 HydrophobicContact CB-CB 4.21Å; P417-E419 HydrophobicContact CB-CG 4.37Å
418	L	96.8	Very high	95.5	Very high	0 Å²	0	47.4 Å²	47.4	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	111.8	158.5	-65.3	177.6	0	0	0	108.5	L360 P368 V369 L371 M424 A426 V463	L360-L418 HydrophobicContact CB-CD1 3.84Å; L360-L418 HydrophobicContact CD2-CD1 4.49Å; P368-L418 CarbonylContact C-O 3.59Å; P368-L418 VanDerWaalsContact CA-O 3.26Å; P368-L418 WeakPolarHBondContact CA-O 3.45Å; V369-L418 PolarHBondContact N-O 2.78Å; V369-L418 PolarHBondContact O-N 3.33Å; L371-L418 HydrophobicContact CB-CD1 3.98Å; L371-L418 HydrophobicContact CB-CD2 4.37Å; L371-L418 HydrophobicContact CB-CG 3.79Å; L371-L418 HydrophobicContact CD2-CD1 4.28Å; L371-L418 HydrophobicContact CD2-CD2 3.85Å; L371-L418 HydrophobicContact CD2-CG 4.15Å; L418-M424 HydrophobicContact CB-CE 3.87Å; L418-A426 HydrophobicContact CD2-CB 3.55Å; L418-V463 HydrophobicContact CD1-CG1 3.83Å
419	E	95.4	Very high	95.7	Very high	60 Å²	60	46 Å²	46	28%	0.28	25%	0.247	S	C	.	.			trans	-97.3	135.3	-178.1	-63.2	-162.9	-107	0	0	112.3	P368 P417 K421 N422 M424	P368-E419 HydrophobicContact CB-CG 4.33Å; P417-E419 HydrophobicContact CB-CG 4.37Å; E419-K421 HydrophobicContact CB-CD 4.47Å; E419-K421 HydrophobicContact CB-CG 4.09Å; E419-K421 VanDerWaalsContact CD-CE 3.41Å; E419-K421 PolarHBondContact O-N 3.31Å; E419-K421 WeakPolarHBondContact OE1-CE 3.41Å; E419-K421 IonicContact OE1-NZ 2.69Å; E419-K421 PolarHBondContact OE1-NZ 3.06Å; E419-K421 WeakPolarHBondContact OE2-CD 3.43Å; E419-K421 WeakPolarHBondContact OE2-CE 3.4Å; E419-K421 IonicContact OE2-NZ 2.61Å; E419-K421 PolarHBondContact OE2-NZ 2.92Å; E419-N422 PolarHBondContact O-N 2.85Å; E419-M424 VanDerWaalsContact C-SD 3.56Å; E419-M424 PolarHBondContact O-N 3.33Å; E419-M424 VanDerWaalsContact O-N 3.1Å
420	P	95.2	Very high	96.2	Very high	41 Å²	41	39.8 Å²	39.8	27%	0.266	21%	0.214	S	C	.	.	G	3₁₀ helix	trans	-58.1	-33.6	176.2	-28	35.5	0	0	0	113.6	Y363 D367 N422 N423 M424	Y363-P420 HydrophobicContact CE1-CG 4.17Å; D367-P420 WeakPolarHBondContact O-CG 3.32Å; P420-N422 PolarHBondContact O-N 2.81Å; P420-N423 WeakPolarHBondContact O-CA 3.49Å; P420-N423 PolarHBondContact O-N 3.35Å; P420-M424 VanDerWaalsContact CA-SD 3.52Å; P420-M424 HydrophobicContact CB-SD 4.06Å; P420-M424 VanDerWaalsContact CD-SD 3.56Å; P420-M424 HydrophobicContact CG-SD 3.57Å; P420-M424 VanDerWaalsContact CG-SD 3.57Å
421	K	94.3	Very high	96.6	Very high	147 Å²	147	37.6 Å²	37.6	64%	0.639	19%	0.191	S	C	*	.	G	3₁₀ helix	trans	-60.8	-23.9	175.8	84.4	-166.1	-175.2	-153.1	0	113.4	E419	E419-K421 HydrophobicContact CB-CD 4.47Å; E419-K421 HydrophobicContact CB-CG 4.09Å; E419-K421 VanDerWaalsContact CD-CE 3.41Å; E419-K421 PolarHBondContact O-N 3.31Å; E419-K421 WeakPolarHBondContact OE1-CE 3.41Å; E419-K421 IonicContact OE1-NZ 2.69Å; E419-K421 PolarHBondContact OE1-NZ 3.06Å; E419-K421 WeakPolarHBondContact OE2-CD 3.43Å; E419-K421 WeakPolarHBondContact OE2-CE 3.4Å; E419-K421 IonicContact OE2-NZ 2.61Å; E419-K421 PolarHBondContact OE2-NZ 2.92Å
422	N	94.2	Very high	96.8	Very high	78 Å²	78	36.8 Å²	36.8	42%	0.417	19%	0.186	S	C	.	.	G	3₁₀ helix	trans	-98.6	19.5	176.5	-64.4	-9.1	0	0	0	111.4	E419 P420 M424 K425	E419-N422 PolarHBondContact O-N 2.85Å; P420-N422 PolarHBondContact O-N 2.81Å; N422-M424 PolarHBondContact O-N 2.69Å; N422-K425 VanDerWaalsContact O-CB 3.26Å; N422-K425 WeakPolarHBondContact O-CB 3.48Å; N422-K425 PolarHBondContact O-N 2.69Å
423	N	95.8	Very high	96.9	Very high	122 Å²	122	35.1 Å²	35.1	65%	0.652	18%	0.179	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.4	33.3	-172.2	-55.6	-61.2	0	0	0	113.7	Q359 P420 K425	Q359-N423 PolarHBondContact NE2-O 2.84Å; P420-N423 WeakPolarHBondContact O-CA 3.49Å; P420-N423 PolarHBondContact O-N 3.35Å; N423-K425 PolarHBondContact O-N 3.37Å
424	M	97.1	Very high	96.8	Very high	8 Å²	8	35.2 Å²	35.2	4%	0.039	18%	0.18	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	34	-177.2	-57.2	-61.1	-71.5	0	0	114	Q359 L360 Y363 V369 L418 E419 P420 N422	Q359-M424 WeakPolarHBondContact CA-O 3.18Å; L360-M424 HydrophobicContact CB-CB 4.16Å; L360-M424 HydrophobicContact CD2-CE 4.01Å; L360-M424 PolarHBondContact N-O 2.97Å; L360-M424 VanDerWaalsContact O-CB 3.27Å; L360-M424 WeakPolarHBondContact O-CB 3.46Å; Y363-M424 HydrophobicContact CD1-CE 3.46Å; Y363-M424 VanDerWaalsContact CD1-CE 3.46Å; Y363-M424 HydrophobicContact CD1-CG 4.02Å; Y363-M424 HydrophobicContact CD1-SD 3.65Å; Y363-M424 HydrophobicContact CE1-CE 3.86Å; Y363-M424 HydrophobicContact CE1-SD 4.12Å; Y363-M424 HydrophobicContact CG-CE 3.94Å; V369-M424 HydrophobicContact CB-CE 3.72Å; V369-M424 HydrophobicContact CG2-CE 3.59Å; L418-M424 HydrophobicContact CB-CE 3.87Å; E419-M424 VanDerWaalsContact C-SD 3.56Å; E419-M424 PolarHBondContact O-N 3.33Å; E419-M424 VanDerWaalsContact O-N 3.1Å; P420-M424 VanDerWaalsContact CA-SD 3.52Å; P420-M424 HydrophobicContact CB-SD 4.06Å; P420-M424 VanDerWaalsContact CD-SD 3.56Å; P420-M424 HydrophobicContact CG-SD 3.57Å; P420-M424 VanDerWaalsContact CG-SD 3.57Å; N422-M424 PolarHBondContact O-N 2.69Å
425	K	97.4	Very high	96.6	Very high	70 Å²	70	36.3 Å²	36.3	30%	0.304	18%	0.184	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	137.2	-176.3	-176	173.7	174.1	154.3	0	110.8	E328 V357 V358 Q359 N422 N423	E328-K425 IonicContact OE1-NZ 2.66Å; E328-K425 PolarHBondContact OE1-NZ 3.02Å; E328-K425 WeakPolarHBondContact OE2-CE 3.32Å; E328-K425 IonicContact OE2-NZ 2.64Å; E328-K425 PolarHBondContact OE2-NZ 3.43Å; V357-K425 HydrophobicContact CG1-CD 4.28Å; V357-K425 HydrophobicContact CG1-CG 3.77Å; V358-K425 WeakPolarHBondContact O-CA 3.38Å; Q359-K425 HydrophobicContact CB-CB 4.25Å; Q359-K425 HydrophobicContact CB-CG 4.32Å; Q359-K425 HydrophobicContact CG-CB 4.03Å; N422-K425 VanDerWaalsContact O-CB 3.26Å; N422-K425 WeakPolarHBondContact O-CB 3.48Å; N422-K425 PolarHBondContact O-N 2.69Å; N423-K425 PolarHBondContact O-N 3.37Å
426	A	97.3	Very high	96.4	Very high	9 Å²	9	34.2 Å²	34.2	7%	0.074	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	142.3	173.9	0	0	0	0	0	112.3	V357 V358 I416 L418 I428	V357-A426 WeakPolarHBondContact CA-O 3.4Å; V358-A426 PolarHBondContact N-O 3.33Å; V358-A426 PolarHBondContact O-N 2.85Å; I416-A426 HydrophobicContact CD1-CB 3.74Å; L418-A426 HydrophobicContact CD2-CB 3.55Å; A426-I428 HydrophobicContact CB-CD1 4.26Å
427	I	97.4	Very high	96	Very high	87 Å²	87	40.9 Å²	40.9	45%	0.446	20%	0.2	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.4	121.6	173.2	-59.1	177.1	0	0	0	107.2	H355 V357 T401 D429	H355-I427 HydrophobicContact CB-CG2 3.7Å; V357-I427 HydrophobicContact CG2-CG1 4.26Å; T401-I427 PolarHBondContact OG1-O 3.09Å; I427-D429 VanDerWaalsContact C-N 3.25Å; I427-D429 PolarHBondContact O-N 2.62Å
428	I	97.9	Very high	95.5	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	20%	0.197	C	C	.	.			trans	-86.4	66.1	-169.9	-45.9	-56.7	0	0	0	110.3	H355 P356 V358 L371 I373 I416 A426 A431 F461	H355-I428 PolarHBondContact ND1-O 3.38Å; P356-I428 HydrophobicContact CB-CB 4.18Å; P356-I428 HydrophobicContact CB-CG1 4.29Å; P356-I428 WeakPolarHBondContact O-CG1 3.18Å; P356-I428 PolarHBondContact O-N 3.02Å; V358-I428 HydrophobicContact CG2-CD1 4.28Å; V358-I428 HydrophobicContact CG2-CG1 4.17Å; L371-I428 HydrophobicContact CD2-CD1 4.35Å; I373-I428 HydrophobicContact CD1-CD1 4.08Å; I373-I428 HydrophobicContact CD1-CG2 3.99Å; I416-I428 HydrophobicContact CD1-CD1 3.7Å; A426-I428 HydrophobicContact CB-CD1 4.26Å; I428-A431 HydrophobicContact CG2-CB 3.86Å; I428-F461 HydrophobicContact CD1-CE1 4.01Å; I428-F461 HydrophobicContact CG1-CE1 3.85Å; I428-F461 HydrophobicContact CG1-CZ 4.15Å; I428-F461 HydrophobicContact CG2-CE1 4.25Å
429	D	97.4	Very high	94.9	Very high	8 Å²	8	43.9 Å²	43.9	4%	0.043	22%	0.222	C	C	.	.			trans	-90.5	-6.6	-179.9	70.9	-9.1	0	0	0	114.4	A347 H355 T400 T401 I427	A347-D429 WeakPolarHBondContact CB-O 3.34Å; H355-D429 HydrophobicContact CB-CB 4.48Å; T400-D429 WeakPolarHBondContact CB-OD2 3.22Å; T400-D429 PolarHBondContact N-OD2 2.88Å; T400-D429 PolarHBondContact OG1-OD2 3.2Å; T401-D429 WeakPolarHBondContact CB-OD1 3.46Å; T401-D429 PolarHBondContact N-OD1 3.02Å; T401-D429 VanDerWaalsContact N-OD1 3.16Å; T401-D429 PolarHBondContact OG1-OD1 2.91Å; I427-D429 VanDerWaalsContact C-N 3.25Å; I427-D429 PolarHBondContact O-N 2.62Å
430	C	97.5	Very high	94.3	Very high	0 Å²	0	42.6 Å²	42.6	0%	0	22%	0.217	C	C	.	.	S	Bend	trans	-104.5	3	-175.4	63.8	0	0	0	0	115.1	I394 V399 L414	I394-C430 PolarHBondContact N-O 2.76Å; V399-C430 HydrophobicContact CG1-CB 3.75Å; L414-C430 HydrophobicContact CD2-CB 4.38Å; L414-C430 WeakPolarHBondContact CD2-O 3.39Å
431	A	98.1	Very high	93.7	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	120.5	-174.6	0	0	0	0	0	112.9	A347 V348 V391 L414 I428	A347-A431 CarbonylContact C-O 3.57Å; A347-A431 WeakPolarHBondContact CA-O 3.32Å; A347-A431 WeakPolarHBondContact CB-O 3.25Å; V348-A431 PolarHBondContact N-O 3.02Å; V391-A431 HydrophobicContact CG2-CB 4.05Å; L414-A431 HydrophobicContact CD2-CB 3.93Å; I428-A431 HydrophobicContact CG2-CB 3.86Å
432	G	97.6	Very high	93	Very high	0 Å²	0	37 Å²	37	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	-178.5	169.8	0	0	0	0	0	112	H392	H392-G432 PolarHBondContact N-O 2.86Å; H392-G432 PolarHBondContact O-N 2.86Å
433	I	98	Very high	92.2	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	123.5	-173.5	-47.7	-178.9	0	0	0	111.6	H335 A337 H338 V348 I375 Y389 V457 I482	H335-I433 HydrophobicContact CB-CD1 4.5Å; A337-I433 WeakPolarHBondContact CA-O 3.32Å; A337-I433 HydrophobicContact CB-CB 4.18Å; A337-I433 HydrophobicContact CB-CG2 3.98Å; A337-I433 WeakPolarHBondContact CB-O 3.23Å; H338-I433 PolarHBondContact CE1-O 3.05Å; H338-I433 PolarHBondContact N-O 2.9Å; H338-I433 PolarHBondContact ND1-O 2.78Å; V348-I433 HydrophobicContact CG2-CD1 3.98Å; V348-I433 HydrophobicContact CG2-CG1 3.84Å; I375-I433 HydrophobicContact CD1-CG1 4.16Å; I375-I433 HydrophobicContact CD1-CG2 4.48Å; Y389-I433 HydrophobicContact CD1-CG2 3.89Å; Y389-I433 HydrophobicContact CG-CG2 4.42Å; I433-V457 HydrophobicContact CD1-CG2 3.92Å; I433-I482 HydrophobicContact CD1-CD1 4.16Å; I433-I482 HydrophobicContact CD1-CG2 4.17Å
434	L	96.4	Very high	91	Very high	3 Å²	3	41.3 Å²	41.3	2%	0.016	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99	130.4	176.1	-167.8	72.3	0	0	0	110.6	H338 E340 Y389 Q390 H392 L436	H338-L434 CarbonylContact O-C 3.49Å; H338-L434 WeakPolarHBondContact O-CA 3.39Å; H338-L434 WeakPolarHBondContact O-CD1 3.35Å; E340-L434 HydrophobicContact CG-CD1 3.71Å; E340-L434 HydrophobicContact CG-CD2 3.8Å; E340-L434 HydrophobicContact CG-CG 4.17Å; Y389-L434 CarbonylContact C-O 3.56Å; Y389-L434 WeakPolarHBondContact CA-O 3.09Å; Y389-L434 WeakPolarHBondContact CD1-O 3.41Å; Q390-L434 HydrophobicContact CB-CB 4.46Å; Q390-L434 PolarHBondContact N-O 2.87Å; Q390-L434 WeakPolarHBondContact O-CB 3.3Å; Q390-L434 PolarHBondContact O-N 2.84Å; H392-L434 HydrophobicContact CB-CB 4.25Å; L434-L436 HydrophobicContact CD2-CD2 4.17Å
435	K	94.4	Very high	89.6	Confident	23 Å²	23	46.3 Å²	46.3	10%	0.1	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	121.1	166.5	178.1	73.2	-177.3	78	0	108.6	A337 H338 Y339 Y389 N438	A337-K435 HydrophobicContact CB-CB 4.26Å; H338-K435 PolarHBondContact O-N 3.01Å; Y339-K435 HydrophobicContact CD1-CB 4.15Å; Y339-K435 HydrophobicContact CD1-CG 3.96Å; Y339-K435 VanDerWaalsContact CD1-O 3.32Å; Y339-K435 WeakPolarHBondContact CD1-O 3.37Å; Y339-K435 HydrophobicContact CE1-CB 4.01Å; Y339-K435 HydrophobicContact CE1-CG 3.34Å; Y389-K435 HydrophobicContact CD1-CB 4.04Å; Y389-K435 HydrophobicContact CD1-CD 3.9Å; Y389-K435 HydrophobicContact CE1-CB 3.83Å; Y389-K435 HydrophobicContact CE1-CD 3.39Å; Y389-K435 HydrophobicContact CE1-CG 4.15Å; Y389-K435 HydrophobicContact CE2-CD 4.24Å; K435-N438 PolarHBondContact NZ-OD1 2.83Å
436	L	92.1	Very high	88	Confident	8 Å²	8	45.6 Å²	45.6	4%	0.042	24%	0.235	C	C	.	.	P	Polyproline II helix	trans	-77.4	148	172.3	-63.2	171.2	0	0	0	109.9	F388 Q390 L434 I441	F388-L436 PolarHBondContact O-N 2.84Å; Q390-L436 HydrophobicContact CG-CD1 3.86Å; Q390-L436 HydrophobicContact CG-CG 4.44Å; L434-L436 HydrophobicContact CD2-CD2 4.17Å; L436-I441 HydrophobicContact CB-CD1 3.6Å; L436-I441 HydrophobicContact CB-CG1 4.3Å; L436-I441 HydrophobicContact CD1-CD1 3.53Å; L436-I441 HydrophobicContact CG-CD1 4.21Å
437	R	89.3	Confident	86.4	Confident	143 Å²	143	47.6 Å²	47.6	54%	0.54	24%	0.243	S	C	.	.	P	Polyproline II helix	trans	-74	147	175.9	-42.3	174.2	-64.9	178.3	4.3	108.9	Y339 A439 D440 I441	Y339-R437 HydrophobicContact CD1-CG 4.25Å; R437-A439 PolarHBondContact O-N 3.09Å; R437-D440 WeakPolarHBondContact CB-OD2 3.44Å; R437-D440 VanDerWaalsContact CG-OD2 3.29Å; R437-D440 WeakPolarHBondContact CG-OD2 3.41Å; R437-D440 IonicContact CZ-OD1 2.68Å; R437-D440 IonicContact CZ-OD2 2.87Å; R437-D440 PolarHBondContact N-OD2 3.32Å; R437-D440 IonicContact NE-OD1 3.93Å; R437-D440 PolarHBondContact NE-OD1 3.34Å; R437-D440 IonicContact NE-OD2 2.69Å; R437-D440 PolarHBondContact NE-OD2 2.89Å; R437-D440 IonicContact NH2-OD1 3.84Å; R437-D440 PolarHBondContact NH2-OD1 2.84Å; R437-D440 IonicContact NH2-OD2 3.4Å; R437-D440 WeakPolarHBondContact O-CB 3.43Å; R437-D440 PolarHBondContact O-N 2.96Å; R437-I441 PolarHBondContact O-N 3.28Å
438	N	85.1	Confident	84.3	Confident	51 Å²	51	47.8 Å²	47.8	27%	0.273	25%	0.249	S	C	.	.	H	α-helix	trans	-64.9	-38.1	-170.4	-63.9	-3.2	0	0	0	112.5	K435 D440 I441 E442	K435-N438 PolarHBondContact NZ-OD1 2.83Å; N438-D440 PolarHBondContact O-N 3.5Å; N438-I441 WeakPolarHBondContact O-CA 3.46Å; N438-I441 WeakPolarHBondContact O-CB 3.4Å; N438-I441 PolarHBondContact O-N 2.97Å; N438-E442 WeakPolarHBondContact O-CG 3.46Å; N438-E442 PolarHBondContact O-N 2.96Å
439	A	84.7	Confident	82.2	Confident	64 Å²	64	52.2 Å²	52.2	53%	0.529	27%	0.272	S	S	.	.	H	α-helix	trans	-58.9	-34.6	173	0	0	0	0	0	112.9	R437 I441 E442 L443	R437-A439 PolarHBondContact O-N 3.09Å; A439-I441 PolarHBondContact O-N 2.86Å; A439-E442 PolarHBondContact O-N 2.9Å; A439-L443 WeakPolarHBondContact O-CB 3.25Å; A439-L443 PolarHBondContact O-N 3.2Å; A439-L443 VanDerWaalsContact O-N 3.1Å
440	D	83.6	Confident	80.1	Confident	32 Å²	32	57.1 Å²	57.1	17%	0.171	30%	0.302	C	S	.	.	H	α-helix	trans	-71.6	-16.2	175.9	-48.1	-38.8	0	0	0	112.4	R437 N438 R444	R437-D440 WeakPolarHBondContact CB-OD2 3.44Å; R437-D440 VanDerWaalsContact CG-OD2 3.29Å; R437-D440 WeakPolarHBondContact CG-OD2 3.41Å; R437-D440 IonicContact CZ-OD1 2.68Å; R437-D440 IonicContact CZ-OD2 2.87Å; R437-D440 PolarHBondContact N-OD2 3.32Å; R437-D440 IonicContact NE-OD1 3.93Å; R437-D440 PolarHBondContact NE-OD1 3.34Å; R437-D440 IonicContact NE-OD2 2.69Å; R437-D440 PolarHBondContact NE-OD2 2.89Å; R437-D440 IonicContact NH2-OD1 3.84Å; R437-D440 PolarHBondContact NH2-OD1 2.84Å; R437-D440 IonicContact NH2-OD2 3.4Å; R437-D440 WeakPolarHBondContact O-CB 3.43Å; R437-D440 PolarHBondContact O-N 2.96Å; N438-D440 PolarHBondContact O-N 3.5Å; D440-R444 VanDerWaalsContact O-CZ 3.29Å; D440-R444 PolarHBondContact O-NE 2.79Å; D440-R444 PolarHBondContact O-NH2 3.03Å
441	I	81.9	Confident	78.1	Confident	3 Å²	3	57.5 Å²	57.5	2%	0.015	31%	0.306	C	S	.	.	H	α-helix	trans	-88.5	-47.9	173.4	-55.1	-48.3	0	0	0	110.1	A387 F388 L436 R437 N438 A439 L443 R444 K445	A387-I441 WeakPolarHBondContact O-CD1 3.49Å; F388-I441 HydrophobicContact CD1-CB 4.37Å; F388-I441 HydrophobicContact CD1-CG1 3.76Å; F388-I441 HydrophobicContact CD1-CG2 4.44Å; F388-I441 HydrophobicContact CE1-CB 4.03Å; F388-I441 HydrophobicContact CE1-CG1 3.93Å; F388-I441 HydrophobicContact CE1-CG2 3.97Å; F388-I441 HydrophobicContact CE2-CG2 4.07Å; F388-I441 HydrophobicContact CG-CG1 4.24Å; F388-I441 HydrophobicContact CZ-CB 4.32Å; F388-I441 HydrophobicContact CZ-CG2 3.75Å; L436-I441 HydrophobicContact CB-CD1 3.6Å; L436-I441 HydrophobicContact CB-CG1 4.3Å; L436-I441 HydrophobicContact CD1-CD1 3.53Å; L436-I441 HydrophobicContact CG-CD1 4.21Å; R437-I441 PolarHBondContact O-N 3.28Å; N438-I441 WeakPolarHBondContact O-CA 3.46Å; N438-I441 WeakPolarHBondContact O-CB 3.4Å; N438-I441 PolarHBondContact O-N 2.97Å; A439-I441 PolarHBondContact O-N 2.86Å; I441-L443 VanDerWaalsContact C-N 3.28Å; I441-L443 PolarHBondContact O-N 2.87Å; I441-R444 PolarHBondContact O-N 3.4Å; I441-K445 PolarHBondContact O-N 2.92Å
442	E	80.3	Confident	76.3	Confident	68 Å²	68	63 Å²	63	32%	0.318	33%	0.327	S	S	.	.	H	α-helix	trans	-57.1	-44	-178.7	-70.4	166.6	146.4	0	0	110.4	N438 A439 R444 G446 R452	N438-E442 WeakPolarHBondContact O-CG 3.46Å; N438-E442 PolarHBondContact O-N 2.96Å; A439-E442 PolarHBondContact O-N 2.9Å; E442-R444 VanDerWaalsContact C-N 3.32Å; E442-R444 PolarHBondContact O-N 3.19Å; E442-G446 PolarHBondContact O-N 2.83Å; E442-G446 VanDerWaalsContact O-N 3.14Å; E442-R452 IonicContact OE1-CZ 2.65Å; E442-R452 IonicContact OE1-NH1 3.06Å; E442-R452 PolarHBondContact OE1-NH1 2.71Å; E442-R452 IonicContact OE1-NH2 3.35Å; E442-R452 PolarHBondContact OE1-NH2 2.77Å; E442-R452 IonicContact OE2-NH2 3.55Å
443	L	76.6	Confident	74.9	Confident	157 Å²	157	71.3 Å²	71.3	82%	0.822	36%	0.363	S	S	*	.	H	α-helix	trans	-66	-24.6	175	-175.1	62.4	0	0	0	114.8	A439 I441	A439-L443 WeakPolarHBondContact O-CB 3.25Å; A439-L443 PolarHBondContact O-N 3.2Å; A439-L443 VanDerWaalsContact O-N 3.1Å; I441-L443 VanDerWaalsContact C-N 3.28Å; I441-L443 PolarHBondContact O-N 2.87Å
444	R	71.7	Confident	73.8	Confident	133 Å²	133	74.2 Å²	74.2	50%	0.502	38%	0.379	S	S	.	.	H	α-helix	trans	-103.4	-25.5	-174.1	-85.5	-172.8	-67.5	158.5	-5.7	115.3	D440 I441 E442	D440-R444 VanDerWaalsContact O-CZ 3.29Å; D440-R444 PolarHBondContact O-NE 2.79Å; D440-R444 PolarHBondContact O-NH2 3.03Å; I441-R444 PolarHBondContact O-N 3.4Å; E442-R444 VanDerWaalsContact C-N 3.32Å; E442-R444 PolarHBondContact O-N 3.19Å
445	K	66.7	Low	73.4	Confident	114 Å²	114	76.4 Å²	76.4	50%	0.496	39%	0.392	S	S	.	.	H	α-helix	trans	-128	-17.6	-173.5	-74.7	-160.7	170.8	-160.6	0	114.8	A387 I441 E447	A387-K445 HydrophobicContact CB-CD 4.12Å; I441-K445 PolarHBondContact O-N 2.92Å; K445-E447 HydrophobicContact CB-CB 3.93Å; K445-E447 WeakPolarHBondContact CD-OE2 3.17Å; K445-E447 PolarHBondContact O-N 3.42Å
446	G	64.7	Low	73.3	Confident	54 Å²	54	79.7 Å²	79.7	56%	0.557	40%	0.404	S	S	*	.			trans	61.9	4.1	-167.9	0	0	0	0	0	114.7	E442 T448	E442-G446 PolarHBondContact O-N 2.83Å; E442-G446 VanDerWaalsContact O-N 3.14Å; G446-T448 PolarHBondContact O-N 2.86Å
447	E	63.1	Low	73.5	Confident	51 Å²	51	79.3 Å²	79.3	24%	0.238	40%	0.402	C	S	.	.			trans	-78.2	85.3	-173.5	-171.2	174	-165.9	0	0	110	K384 A387 K445	K384-E447 IonicContact NZ-OE1 2.69Å; A387-E447 WeakPolarHBondContact CB-OE2 3.31Å; K445-E447 HydrophobicContact CB-CB 3.93Å; K445-E447 WeakPolarHBondContact CD-OE2 3.17Å; K445-E447 PolarHBondContact O-N 3.42Å
448	T	53.9	Low	73.8	Confident	92 Å²	92	73.5 Å²	73.5	56%	0.564	38%	0.38	S	S	*	.			trans	-77.9	150.7	-179.5	45.3	0	0	0	0	112.9	G446 V450	G446-T448 PolarHBondContact O-N 2.86Å; T448-V450 VanDerWaalsContact C-N 3.3Å; T448-V450 PolarHBondContact O-N 3.19Å
449	D	53.8	Low	74.5	Confident	93 Å²	93	71 Å²	71	50%	0.497	37%	0.367	S	S	.	.	S	Bend	trans	61.4	-41.6	171.8	-108.2	38.7	0	0	0	120.8	G451 R452	D449-G451 VanDerWaalsContact C-N 3.26Å; D449-G451 PolarHBondContact O-N 3.25Å; D449-R452 WeakPolarHBondContact O-CB 3.18Å; D449-R452 PolarHBondContact O-N 2.97Å; D449-R452 WeakPolarHBondContact OD1-CD 3.26Å; D449-R452 IonicContact OD1-CZ 2.64Å; D449-R452 IonicContact OD1-NE 2.67Å; D449-R452 IonicContact OD1-NH1 2.82Å; D449-R452 PolarHBondContact OD1-NH1 3.16Å
450	V	53	Low	75.1	Confident	110 Å²	110	68 Å²	68	67%	0.667	34%	0.342	S	S	*	.	G	3₁₀ helix	trans	-53.7	-40.3	-169.2	-179.9	0	0	0	0	113	T448	T448-V450 VanDerWaalsContact C-N 3.3Å; T448-V450 PolarHBondContact O-N 3.19Å
451	G	54.2	Low	75.8	Confident	8 Å²	8	66.5 Å²	66.5	8%	0.082	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-94.2	7.7	178.7	0	0	0	0	0	116.6	F388 D449 K453	F388-G451 VanDerWaalsContact CE2-CA 3.41Å; D449-G451 VanDerWaalsContact C-N 3.26Å; D449-G451 PolarHBondContact O-N 3.25Å; G451-K453 PolarHBondContact O-N 3.29Å
452	R	60.8	Low	76.5	Confident	116 Å²	116	66.4 Å²	66.4	44%	0.438	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-66.7	-21.3	169.4	-80	-169.6	168.1	78.2	15.4	112.6	E442 D449	E442-R452 IonicContact OE1-CZ 2.65Å; E442-R452 IonicContact OE1-NH1 3.06Å; E442-R452 PolarHBondContact OE1-NH1 2.71Å; E442-R452 IonicContact OE1-NH2 3.35Å; E442-R452 PolarHBondContact OE1-NH2 2.77Å; E442-R452 IonicContact OE2-NH2 3.55Å; D449-R452 WeakPolarHBondContact O-CB 3.18Å; D449-R452 PolarHBondContact O-N 2.97Å; D449-R452 WeakPolarHBondContact OD1-CD 3.26Å; D449-R452 IonicContact OD1-CZ 2.64Å; D449-R452 IonicContact OD1-NE 2.67Å; D449-R452 IonicContact OD1-NH1 2.82Å; D449-R452 PolarHBondContact OD1-NH1 3.16Å
453	K	68.4	Low	77.3	Confident	174 Å²	174	63.1 Å²	63.1	76%	0.757	32%	0.318	S	S	*	.	S	Bend	trans	-119.8	-18.6	-172.9	-64.7	171.4	-175.3	164	0	114.7	G451 T455	G451-K453 PolarHBondContact O-N 3.29Å; K453-T455 PolarHBondContact O-N 3.13Å
454	N	74.9	Confident	78.1	Confident	62 Å²	62	57 Å²	57	33%	0.332	29%	0.285	S	S	.	.			trans	-89.5	107.8	179	-169.1	5.9	0	0	0	111.8	R456	N454-R456 PolarHBondContact OD1-N 2.87Å; N454-R456 PolarHBondContact OD1-O 2.91Å
455	T	88.9	Confident	79.1	Confident	48 Å²	48	50.8 Å²	50.8	29%	0.294	26%	0.262	S	S	.	.			trans	-103	4.6	176.4	50.2	0	0	0	0	113.5	K453 E483 C484	K453-T455 PolarHBondContact O-N 3.13Å; T455-E483 VanDerWaalsContact CB-OE1 3.24Å; T455-E483 WeakPolarHBondContact CB-OE1 3.05Å; T455-E483 VanDerWaalsContact OG1-CD 3.26Å; T455-E483 PolarHBondContact OG1-OE1 3.33Å; T455-E483 PolarHBondContact OG1-OE2 3.11Å; T455-C484 WeakPolarHBondContact O-CB 3.49Å; T455-C484 PolarHBondContact O-N 3.03Å
456	R	91.5	Very high	80.2	Confident	93 Å²	93	52.5 Å²	52.5	35%	0.351	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	134.3	180	-61.2	-178.1	79.1	-172	8	111.4	A378 N454 I482 E483	A378-R456 HydrophobicContact CB-CB 3.68Å; A378-R456 WeakPolarHBondContact CB-O 3.46Å; N454-R456 PolarHBondContact OD1-N 2.87Å; N454-R456 PolarHBondContact OD1-O 2.91Å; R456-I482 CarbonylContact C-O 3.55Å; R456-I482 VanDerWaalsContact CA-O 3.31Å; R456-I482 WeakPolarHBondContact CA-O 3.45Å; R456-E483 HydrophobicContact CG-CB 4.5Å; R456-E483 WeakPolarHBondContact CG-OE2 3.44Å
457	V	95.5	Very high	81	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	174.3	-178.9	-50.8	0	0	0	0	111.3	I375 G376 Y389 I433 P481 I482 C484	I375-V457 HydrophobicContact CG2-CB 3.55Å; I375-V457 HydrophobicContact CG2-CG1 3.86Å; I375-V457 HydrophobicContact CG2-CG2 3.8Å; G376-V457 WeakPolarHBondContact O-CA 3.42Å; G376-V457 WeakPolarHBondContact O-CB 3.5Å; Y389-V457 HydrophobicContact CD2-CG1 3.33Å; Y389-V457 HydrophobicContact CE2-CG1 3.87Å; Y389-V457 HydrophobicContact CG-CG1 3.78Å; I433-V457 HydrophobicContact CD1-CG2 3.92Å; V457-P481 CarbonylContact O-C 3.55Å; V457-P481 WeakPolarHBondContact O-CA 3.42Å; V457-I482 HydrophobicContact CG2-CB 4.25Å; V457-I482 PolarHBondContact N-O 3.13Å; V457-I482 PolarHBondContact O-N 2.56Å; V457-C484 VanDerWaalsContact CG2-SG 3.57Å
458	R	97.1	Very high	81.7	Confident	20 Å²	20	57 Å²	57	8%	0.075	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	151.1	166.3	-68.2	175.5	-176.8	-120.6	14.9	110.9	I375 G376 T377 A378 E380 A478 S479	I375-R458 WeakPolarHBondContact CA-O 3.48Å; G376-R458 PolarHBondContact N-O 2.99Å; G376-R458 PolarHBondContact O-N 3.17Å; T377-R458 WeakPolarHBondContact O-CD 3.32Å; A378-R458 PolarHBondContact O-NE 2.85Å; A378-R458 PolarHBondContact O-NH2 2.81Å; E380-R458 IonicContact OE1-CZ 3.33Å; E380-R458 IonicContact OE1-NH1 3.57Å; E380-R458 PolarHBondContact OE1-NH1 2.86Å; E380-R458 IonicContact OE1-NH2 3.61Å; E380-R458 PolarHBondContact OE1-NH2 3.34Å; R458-A478 HydrophobicContact CB-CB 4.44Å; R458-S479 WeakPolarHBondContact CD-O 3.28Å; R458-S479 VanDerWaalsContact CG-O 3.26Å; R458-S479 WeakPolarHBondContact CG-O 3.41Å; R458-S479 PolarHBondContact NH1-O 3.49Å
459	L	98.1	Very high	82.8	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	123.4	158.1	-63.9	173.7	0	0	0	107	P331 V348 P356 I375 F461 A478 S479 I482	P331-L459 HydrophobicContact CB-CD1 4.41Å; P331-L459 HydrophobicContact CG-CD1 4.49Å; V348-L459 HydrophobicContact CB-CD1 4.3Å; V348-L459 HydrophobicContact CG1-CD1 4.17Å; V348-L459 HydrophobicContact CG2-CD1 4.38Å; V348-L459 HydrophobicContact CG2-CD2 4.44Å; P356-L459 HydrophobicContact CG-CD1 4.23Å; I375-L459 HydrophobicContact CD1-CD2 3.69Å; L459-F461 HydrophobicContact CB-CD2 4.44Å; L459-F461 HydrophobicContact CB-CE1 4.49Å; L459-F461 HydrophobicContact CB-CE2 3.63Å; L459-F461 HydrophobicContact CB-CZ 3.66Å; L459-F461 HydrophobicContact CD1-CE2 4.45Å; L459-F461 HydrophobicContact CD1-CZ 3.9Å; L459-F461 HydrophobicContact CG-CZ 4.39Å; L459-A478 WeakPolarHBondContact O-CA 3.29Å; L459-S479 PolarHBondContact N-OG 2.79Å; L459-S479 PolarHBondContact O-N 3.14Å; L459-I482 HydrophobicContact CD1-CD1 4.23Å; L459-I482 HydrophobicContact CG-CD1 3.91Å
460	V	98.1	Very high	83.9	Confident	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	125.1	174.9	-172.2	0	0	0	0	108.3	I373 F374 L383 Q476 A478	I373-V460 WeakPolarHBondContact CA-O 3.4Å; F374-V460 HydrophobicContact CD1-CB 4.08Å; F374-V460 HydrophobicContact CD1-CG1 4.33Å; F374-V460 HydrophobicContact CD2-CB 4.16Å; F374-V460 HydrophobicContact CD2-CG2 4.46Å; F374-V460 HydrophobicContact CE1-CB 3.78Å; F374-V460 HydrophobicContact CE1-CG1 3.57Å; F374-V460 HydrophobicContact CE2-CB 3.88Å; F374-V460 HydrophobicContact CE2-CG1 4.09Å; F374-V460 HydrophobicContact CE2-CG2 4.09Å; F374-V460 HydrophobicContact CG-CB 4.27Å; F374-V460 HydrophobicContact CZ-CB 3.69Å; F374-V460 HydrophobicContact CZ-CG1 3.44Å; F374-V460 VanDerWaalsContact CZ-CG1 3.44Å; F374-V460 HydrophobicContact CZ-CG2 4.29Å; F374-V460 PolarHBondContact N-O 3.49Å; F374-V460 PolarHBondContact O-N 2.9Å; L383-V460 HydrophobicContact CD1-CG2 3.83Å; L383-V460 HydrophobicContact CD2-CG1 4.13Å; L383-V460 HydrophobicContact CD2-CG2 4.35Å; L383-V460 HydrophobicContact CG-CG2 4.3Å; V460-Q476 HydrophobicContact CG1-CG 3.63Å; V460-A478 HydrophobicContact CG2-CB 4.33Å
461	F	98.3	Very high	85.2	Confident	0 Å²	0	55 Å²	55	0%	0	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	132.3	-175.3	-63.4	-73.8	0	0	0	109	L325 I327 V358 L371 Q372 I373 I428 L459 Q476 V477	L325-F461 HydrophobicContact CD2-CB 4.31Å; L325-F461 WeakPolarHBondContact CD2-O 3.27Å; I327-F461 HydrophobicContact CD1-CD2 3.75Å; I327-F461 HydrophobicContact CD1-CE2 3.94Å; I327-F461 HydrophobicContact CG1-CD2 4.08Å; I327-F461 HydrophobicContact CG1-CE2 4.36Å; V358-F461 HydrophobicContact CG1-CB 4.44Å; V358-F461 HydrophobicContact CG1-CG 4.47Å; V358-F461 HydrophobicContact CG2-CD1 3.76Å; V358-F461 HydrophobicContact CG2-CD2 3.9Å; V358-F461 HydrophobicContact CG2-CE1 3.72Å; V358-F461 HydrophobicContact CG2-CE2 3.85Å; V358-F461 HydrophobicContact CG2-CG 3.84Å; V358-F461 HydrophobicContact CG2-CZ 3.75Å; L371-F461 HydrophobicContact CD1-CB 3.98Å; L371-F461 HydrophobicContact CD1-CD1 4.27Å; Q372-F461 CarbonylContact O-C 3.56Å; Q372-F461 WeakPolarHBondContact O-CA 3.45Å; I373-F461 HydrophobicContact CB-CD1 4.5Å; I373-F461 HydrophobicContact CD1-CD1 4.37Å; I373-F461 HydrophobicContact CD1-CE1 4.11Å; I373-F461 HydrophobicContact CG1-CD1 3.98Å; I373-F461 HydrophobicContact CG1-CE1 4.14Å; I373-F461 HydrophobicContact CG2-CD1 4.08Å; I373-F461 HydrophobicContact CG2-CE1 3.82Å; I428-F461 HydrophobicContact CD1-CE1 4.01Å; I428-F461 HydrophobicContact CG1-CE1 3.85Å; I428-F461 HydrophobicContact CG1-CZ 4.15Å; I428-F461 HydrophobicContact CG2-CE1 4.25Å; L459-F461 HydrophobicContact CB-CD2 4.44Å; L459-F461 HydrophobicContact CB-CE1 4.49Å; L459-F461 HydrophobicContact CB-CE2 3.63Å; L459-F461 HydrophobicContact CB-CZ 3.66Å; L459-F461 HydrophobicContact CD1-CE2 4.45Å; L459-F461 HydrophobicContact CD1-CZ 3.9Å; L459-F461 HydrophobicContact CG-CZ 4.39Å; F461-Q476 CarbonylContact O-C 3.49Å; F461-Q476 VanDerWaalsContact O-CA 3.29Å; F461-Q476 WeakPolarHBondContact O-CA 3.1Å; F461-V477 HydrophobicContact CB-CG1 3.89Å; F461-V477 HydrophobicContact CD2-CG1 4.47Å; F461-V477 PolarHBondContact N-O 2.89Å; F461-V477 PolarHBondContact O-N 3.33Å
462	R	97.1	Very high	86.8	Confident	1 Å²	1	58.5 Å²	58.5	0%	0.004	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.3	137.4	-175.7	176.9	170.1	173.1	-178.1	-8.7	112.3	P310 P311 Q372 H464 L475 Q476	P310-R462 VanDerWaalsContact CD-NH2 3.3Å; P310-R462 PolarHBondContact O-NH1 3.24Å; P310-R462 PolarHBondContact O-NH2 3.07Å; P311-R462 PolarHBondContact O-NH1 2.68Å; Q372-R462 HydrophobicContact CB-CB 4.37Å; Q372-R462 PolarHBondContact N-O 3.31Å; Q372-R462 PolarHBondContact O-N 3.48Å; R462-H464 PolarHBondContact NE-CE1 3.2Å; R462-H464 PolarHBondContact NE-NE2 3.06Å; R462-H464 PolarHBondContact NH2-CE1 2.99Å; R462-H464 VanDerWaalsContact NH2-CE1 3.25Å; R462-L475 CarbonylContact C-O 3.51Å; R462-L475 VanDerWaalsContact CA-O 3.25Å; R462-L475 WeakPolarHBondContact CA-O 3.19Å; R462-L475 WeakPolarHBondContact CG-O 3.3Å; R462-Q476 HydrophobicContact CB-CB 4.48Å; R462-Q476 HydrophobicContact CB-CG 4.33Å
463	V	96.9	Very high	88.3	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.7	153.4	174.1	-63.3	0	0	0	0	110.9	L325 L360 V369 L371 L418 I465 C474 L475	L325-V463 HydrophobicContact CD1-CG1 3.85Å; L325-V463 HydrophobicContact CD1-CG2 4.35Å; L325-V463 HydrophobicContact CD2-CG1 4.32Å; L325-V463 HydrophobicContact CD2-CG2 4.25Å; L360-V463 HydrophobicContact CD1-CG2 4.3Å; L360-V463 HydrophobicContact CD2-CG2 4.24Å; V369-V463 HydrophobicContact CG1-CB 3.87Å; V369-V463 HydrophobicContact CG1-CG1 4.09Å; L371-V463 HydrophobicContact CB-CG1 4.19Å; L371-V463 HydrophobicContact CD1-CG1 4.01Å; L418-V463 HydrophobicContact CD1-CG1 3.83Å; V463-I465 HydrophobicContact CG2-CD1 4.13Å; V463-I465 HydrophobicContact CG2-CG1 4.12Å; V463-C474 WeakPolarHBondContact O-CA 3.46Å; V463-L475 HydrophobicContact CG2-CB 3.85Å; V463-L475 HydrophobicContact CG2-CD1 4.36Å; V463-L475 HydrophobicContact CG2-CG 4.33Å; V463-L475 PolarHBondContact N-O 3.28Å; V463-L475 PolarHBondContact O-N 2.81Å; V463-L475 VanDerWaalsContact O-N 3.11Å
464	H	94	Very high	89.5	Confident	27 Å²	27	46.7 Å²	46.7	13%	0.125	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	118.1	173.1	-54.6	-115.9	0	0	0	106.9	Q372 R462 C474	Q372-H464 PolarHBondContact OE1-NE2 3.19Å; R462-H464 PolarHBondContact NE-CE1 3.2Å; R462-H464 PolarHBondContact NE-NE2 3.06Å; R462-H464 PolarHBondContact NH2-CE1 2.99Å; R462-H464 VanDerWaalsContact NH2-CE1 3.25Å; H464-C474 PolarHBondContact ND1-SG 3.19Å; H464-C474 VanDerWaalsContact ND1-SG 3.4Å
465	I	93.2	Very high	90.6	Very high	4 Å²	4	43.7 Å²	43.7	2%	0.021	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	100.8	-172.3	-52.6	170.6	0	0	0	108.2	Y323 L360 Y363 V369 V463 Q467 V473 L475	Y323-I465 HydrophobicContact CD1-CD1 4.47Å; Y323-I465 HydrophobicContact CD2-CD1 4.01Å; Y323-I465 HydrophobicContact CE2-CG2 4.34Å; Y323-I465 HydrophobicContact CG-CD1 3.96Å; L360-I465 HydrophobicContact CD1-CD1 3.98Å; L360-I465 HydrophobicContact CD2-CD1 3.82Å; L360-I465 HydrophobicContact CD2-CG1 4.22Å; L360-I465 HydrophobicContact CG-CD1 4.49Å; Y363-I465 HydrophobicContact CD2-CG2 4.05Å; Y363-I465 HydrophobicContact CE2-CG2 3.97Å; V369-I465 HydrophobicContact CG1-CG1 4.36Å; V463-I465 HydrophobicContact CG2-CD1 4.13Å; V463-I465 HydrophobicContact CG2-CG1 4.12Å; I465-Q467 PolarHBondContact O-N 3.31Å; I465-V473 HydrophobicContact CB-CB 4.32Å; I465-V473 PolarHBondContact N-O 2.88Å; I465-V473 PolarHBondContact O-N 2.96Å; I465-L475 HydrophobicContact CD1-CD1 4.35Å
466	F	88.3	Confident	90.9	Very high	149 Å²	149	41.8 Å²	41.8	65%	0.654	24%	0.241	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	117.5	173.3	-56.8	-81.4	0	0	0	109.5	D472	F466-D472 WeakPolarHBondContact CD1-OD1 3.37Å; F466-D472 WeakPolarHBondContact CE1-OD2 3.36Å
467	Q	82.8	Confident	91.2	Very high	51 Å²	51	38.7 Å²	38.7	24%	0.238	23%	0.232	C	C	.	.			trans	-89	151.7	176.6	-61.4	-170.5	20.2	0	0	112	I465 G469 G470 Q471 V473	I465-Q467 PolarHBondContact O-N 3.31Å; Q467-G469 PolarHBondContact O-N 2.92Å; Q467-G470 PolarHBondContact O-N 2.92Å; Q467-Q471 HydrophobicContact CB-CB 4.42Å; Q467-Q471 VanDerWaalsContact CB-O 3.25Å; Q467-Q471 WeakPolarHBondContact CB-O 3.29Å; Q467-Q471 WeakPolarHBondContact CG-O 3.34Å; Q467-Q471 PolarHBondContact N-O 3.45Å; Q467-V473 VanDerWaalsContact NE2-CG2 3.29Å
468	P	77.7	Confident	91.3	Very high	148 Å²	148	39.7 Å²	39.7	96%	0.961	24%	0.241	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-20.2	174.9	-26.6	35.6	0	0	0	115.3	G470	P468-G470 VanDerWaalsContact C-N 3.31Å
469	G	76	Confident	91.3	Very high	65 Å²	65	38.7 Å²	38.7	67%	0.67	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-85	10.3	173.9	0	0	0	0	0	115.3	Q467 Q471	Q467-G469 PolarHBondContact O-N 2.92Å; G469-Q471 VanDerWaalsContact C-N 3.32Å; G469-Q471 PolarHBondContact O-N 2.67Å
470	G	76.7	Confident	91.2	Very high	62 Å²	62	44 Å²	44	64%	0.639	26%	0.262	S	S	*	.	S	Bend	trans	70	26.1	-178.2	0	0	0	0	0	114.2	Q467 P468	Q467-G470 PolarHBondContact O-N 2.92Å; P468-G470 VanDerWaalsContact C-N 3.31Å
471	Q	81.8	Confident	91.1	Very high	128 Å²	128	45.2 Å²	45.2	60%	0.598	27%	0.27	S	S	*	.			trans	-108.7	131.2	176.7	-67.3	-64.2	-46.3	0	0	109.9	Q467 G469	Q467-Q471 HydrophobicContact CB-CB 4.42Å; Q467-Q471 VanDerWaalsContact CB-O 3.25Å; Q467-Q471 WeakPolarHBondContact CB-O 3.29Å; Q467-Q471 WeakPolarHBondContact CG-O 3.34Å; Q467-Q471 PolarHBondContact N-O 3.45Å; G469-Q471 VanDerWaalsContact C-N 3.32Å; G469-Q471 PolarHBondContact O-N 2.67Å
472	D	86.4	Confident	90.9	Very high	80 Å²	80	45.2 Å²	45.2	43%	0.428	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	114.2	-174.3	-71.4	0.8	0	0	0	110.7	F466	F466-D472 WeakPolarHBondContact CD1-OD1 3.37Å; F466-D472 WeakPolarHBondContact CE1-OD2 3.36Å
473	V	92	Very high	90.6	Very high	24 Å²	24	46.4 Å²	46.4	15%	0.145	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.2	115.1	176.7	177.1	0	0	0	0	110.3	T320 Y323 I465 Q467 L475	T320-V473 HydrophobicContact CG2-CG1 4.1Å; Y323-V473 HydrophobicContact CD2-CB 4.49Å; Y323-V473 HydrophobicContact CD2-CG1 4.24Å; I465-V473 HydrophobicContact CB-CB 4.32Å; I465-V473 PolarHBondContact N-O 2.88Å; I465-V473 PolarHBondContact O-N 2.96Å; Q467-V473 VanDerWaalsContact NE2-CG2 3.29Å; V473-L475 HydrophobicContact CG1-CD2 3.99Å; V473-L475 HydrophobicContact CG1-CG 4.17Å
474	C	94.9	Very high	90.5	Very high	18 Å²	18	46.6 Å²	46.6	12%	0.122	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	124	169.6	-71.1	0	0	0	0	110.5	L316 V463 H464	L316-C474 HydrophobicContact CD1-CB 3.97Å; L316-C474 HydrophobicContact CD2-CB 3.86Å; V463-C474 WeakPolarHBondContact O-CA 3.46Å; H464-C474 PolarHBondContact ND1-SG 3.19Å; H464-C474 VanDerWaalsContact ND1-SG 3.4Å
475	L	96.6	Very high	90.1	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	145.5	169.9	-56.7	178.7	0	0	0	110.7	P317 T320 L325 L360 R462 V463 I465 V473	P317-L475 HydrophobicContact CG-CD2 4.47Å; P317-L475 CarbonylContact O-C 3.59Å; P317-L475 VanDerWaalsContact O-CA 3.24Å; P317-L475 WeakPolarHBondContact O-CA 3.45Å; T320-L475 HydrophobicContact CG2-CD2 3.92Å; L325-L475 HydrophobicContact CB-CB 3.94Å; L325-L475 HydrophobicContact CB-CD1 4.07Å; L325-L475 HydrophobicContact CD2-CB 4.47Å; L360-L475 HydrophobicContact CD1-CD1 3.85Å; R462-L475 CarbonylContact C-O 3.51Å; R462-L475 VanDerWaalsContact CA-O 3.25Å; R462-L475 WeakPolarHBondContact CA-O 3.19Å; R462-L475 WeakPolarHBondContact CG-O 3.3Å; V463-L475 HydrophobicContact CG2-CB 3.85Å; V463-L475 HydrophobicContact CG2-CD1 4.36Å; V463-L475 HydrophobicContact CG2-CG 4.33Å; V463-L475 PolarHBondContact N-O 3.28Å; V463-L475 PolarHBondContact O-N 2.81Å; V463-L475 VanDerWaalsContact O-N 3.11Å; I465-L475 HydrophobicContact CD1-CD1 4.35Å; V473-L475 HydrophobicContact CG1-CD2 3.99Å; V473-L475 HydrophobicContact CG1-CG 4.17Å
476	Q	97	Very high	89.2	Confident	7 Å²	7	50.8 Å²	50.8	3%	0.033	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	137.7	178.9	-171.9	167	-100.9	0	0	111.8	W314 L316 P317 S318 V460 F461 R462	W314-Q476 PolarHBondContact O-NE2 2.97Å; L316-Q476 HydrophobicContact CB-CB 3.6Å; L316-Q476 HydrophobicContact CD1-CB 4.42Å; P317-Q476 CarbonylContact C-O 3.54Å; P317-Q476 PolarHBondContact O-N 2.92Å; S318-Q476 WeakPolarHBondContact CA-O 3.45Å; S318-Q476 PolarHBondContact N-O 3.02Å; V460-Q476 HydrophobicContact CG1-CG 3.63Å; F461-Q476 CarbonylContact O-C 3.49Å; F461-Q476 VanDerWaalsContact O-CA 3.29Å; F461-Q476 WeakPolarHBondContact O-CA 3.1Å; R462-Q476 HydrophobicContact CB-CB 4.48Å; R462-Q476 HydrophobicContact CB-CG 4.33Å
477	V	97.4	Very high	87.6	Confident	28 Å²	28	53.6 Å²	53.6	17%	0.17	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	142.6	175.2	68.6	0	0	0	0	110.2	L325 I327 F461	L325-V477 HydrophobicContact CB-CG1 4.46Å; L325-V477 HydrophobicContact CD2-CG1 3.85Å; L325-V477 HydrophobicContact CG-CG1 3.79Å; I327-V477 HydrophobicContact CD1-CG1 4.01Å; I327-V477 HydrophobicContact CD1-CG2 3.95Å; I327-V477 HydrophobicContact CG1-CB 4.48Å; I327-V477 HydrophobicContact CG1-CG1 3.67Å; I327-V477 HydrophobicContact CG1-CG2 3.98Å; F461-V477 HydrophobicContact CB-CG1 3.89Å; F461-V477 HydrophobicContact CD2-CG1 4.47Å; F461-V477 PolarHBondContact N-O 2.89Å; F461-V477 PolarHBondContact O-N 3.33Å
478	A	97.5	Very high	86.4	Confident	21 Å²	21	53.8 Å²	53.8	17%	0.174	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.2	140.3	-179.7	0	0	0	0	0	111.2	I327 L383 R458 L459 V460	I327-A478 VanDerWaalsContact CD1-C 3.48Å; I327-A478 WeakPolarHBondContact CD1-O 3.43Å; L383-A478 HydrophobicContact CD1-CB 4.03Å; L383-A478 HydrophobicContact CD2-CB 3.97Å; R458-A478 HydrophobicContact CB-CB 4.44Å; L459-A478 WeakPolarHBondContact O-CA 3.29Å; V460-A478 HydrophobicContact CG2-CB 4.33Å
479	S	97.8	Very high	85.2	Confident	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.278	C	S	.	.	P	Polyproline II helix	trans	-66.4	168.1	175.7	75.1	0	0	0	0	112.3	R458 L459	R458-S479 WeakPolarHBondContact CD-O 3.28Å; R458-S479 VanDerWaalsContact CG-O 3.26Å; R458-S479 WeakPolarHBondContact CG-O 3.41Å; R458-S479 PolarHBondContact NH1-O 3.49Å; L459-S479 PolarHBondContact N-OG 2.79Å; L459-S479 PolarHBondContact O-N 3.14Å
480	H	95.8	Very high	84	Confident	112 Å²	112	50.2 Å²	50.2	52%	0.519	27%	0.27	S	S	.	.	S	Bend	trans	-54.6	152.6	159.6	-65.7	166	0	0	0	111.3	I482	H480-I482 PolarHBondContact O-N 3.47Å
481	P	94.3	Very high	83.4	Confident	25 Å²	25	52.6 Å²	52.6	16%	0.162	26%	0.264	C	S	.	.	P	Polyproline II helix	trans	-65.4	133.3	-179.8	-18.9	30	0	0	0	113.3	A378 V457	A378-P481 HydrophobicContact CB-CB 4.27Å; V457-P481 CarbonylContact O-C 3.55Å; V457-P481 WeakPolarHBondContact O-CA 3.42Å
482	I	94.7	Very high	83.6	Confident	0 Å²	0	49 Å²	49	0%	0	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	126.2	177.5	-51.1	174.2	0	0	0	108.8	P331 H335 V348 I433 R456 V457 L459 H480	P331-I482 HydrophobicContact CB-CD1 3.79Å; P331-I482 HydrophobicContact CB-CG1 4.16Å; P331-I482 HydrophobicContact CG-CD1 3.74Å; P331-I482 HydrophobicContact CG-CG1 3.85Å; H335-I482 HydrophobicContact CB-CG2 3.82Å; V348-I482 HydrophobicContact CG1-CD1 4.03Å; I433-I482 HydrophobicContact CD1-CD1 4.16Å; I433-I482 HydrophobicContact CD1-CG2 4.17Å; R456-I482 CarbonylContact C-O 3.55Å; R456-I482 VanDerWaalsContact CA-O 3.31Å; R456-I482 WeakPolarHBondContact CA-O 3.45Å; V457-I482 HydrophobicContact CG2-CB 4.25Å; V457-I482 PolarHBondContact N-O 3.13Å; V457-I482 PolarHBondContact O-N 2.56Å; L459-I482 HydrophobicContact CD1-CD1 4.23Å; L459-I482 HydrophobicContact CG-CD1 3.91Å; H480-I482 PolarHBondContact O-N 3.47Å
483	E	91.9	Very high	83.7	Confident	25 Å²	25	45.2 Å²	45.2	12%	0.117	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	124.9	172.2	176.1	42.9	-120.8	0	0	110.9	P333 H334 H335 T455 R456 S485 A489	P333-E483 WeakPolarHBondContact O-CB 3.46Å; P333-E483 PolarHBondContact O-N 2.92Å; H334-E483 VanDerWaalsContact CA-O 3.29Å; H334-E483 WeakPolarHBondContact CA-O 3.48Å; H334-E483 HydrophobicContact CB-CB 4.45Å; H334-E483 PolarHBondContact ND1-O 2.94Å; H335-E483 PolarHBondContact N-O 2.98Å; T455-E483 VanDerWaalsContact CB-OE1 3.24Å; T455-E483 WeakPolarHBondContact CB-OE1 3.05Å; T455-E483 VanDerWaalsContact OG1-CD 3.26Å; T455-E483 PolarHBondContact OG1-OE1 3.33Å; T455-E483 PolarHBondContact OG1-OE2 3.11Å; R456-E483 HydrophobicContact CG-CB 4.5Å; R456-E483 WeakPolarHBondContact CG-OE2 3.44Å; E483-S485 WeakPolarHBondContact OE1-CB 3.47Å; E483-S485 PolarHBondContact OE1-N 2.88Å; E483-S485 PolarHBondContact OE1-OG 2.83Å; E483-A489 HydrophobicContact CG-CB 3.69Å
484	C	92.9	Very high	83.7	Confident	4 Å²	4	47.6 Å²	47.6	3%	0.027	24%	0.239	C	C	.	.			trans	-108.9	-1.7	-168.2	-69.8	0	0	0	0	115.6	H335 A337 Y389 T455 V457	H335-C484 WeakPolarHBondContact O-CA 3.36Å; A337-C484 HydrophobicContact CB-CB 3.97Å; A337-C484 PolarHBondContact N-O 2.82Å; A337-C484 VanDerWaalsContact N-O 3.13Å; Y389-C484 HydrophobicContact CD1-CB 4.45Å; Y389-C484 HydrophobicContact CE1-CB 3.62Å; Y389-C484 HydrophobicContact CE2-CB 4.49Å; T455-C484 WeakPolarHBondContact O-CB 3.49Å; T455-C484 PolarHBondContact O-N 3.03Å; V457-C484 VanDerWaalsContact CG2-SG 3.57Å
485	S	86.6	Confident	83.6	Confident	23 Å²	23	47.5 Å²	47.5	16%	0.161	24%	0.238	C	C	.	.			trans	-64	158.7	-178.3	58.8	0	0	0	0	113.9	H334 E483	H334-S485 PolarHBondContact CE1-O 3.39Å; H334-S485 VanDerWaalsContact CE1-O 3.23Å; E483-S485 WeakPolarHBondContact OE1-CB 3.47Å; E483-S485 PolarHBondContact OE1-N 2.88Å; E483-S485 PolarHBondContact OE1-OG 2.83Å
486	Q	73.9	Confident	83.3	Confident	97 Å²	97	52.8 Å²	52.8	45%	0.453	26%	0.263	S	S	.	.	S	Bend	trans	-78.8	-35	-170.9	165.4	158.4	-28.7	0	0	114.6	R336	R336-Q486 VanDerWaalsContact CZ-OE1 3.32Å
487	R	55.7	Low	83.1	Confident	207 Å²	207	58.9 Å²	58.9	78%	0.781	29%	0.289	S	S	*	.	S	Bend	trans	-157.3	104.8	179.9	-67.9	-174.6	-167.9	-76	2.7	110.8
488	S	56.3	Low	83.1	Confident	55 Å²	55	59.2 Å²	59.2	39%	0.385	29%	0.289	S	S	.	.	S	Bend	trans	-175.6	-59.8	156.1	51.1	0	0	0	0	111.1	H490 E491 L492	S488-H490 VanDerWaalsContact C-N 3.33Å; S488-H490 PolarHBondContact O-N 2.96Å; S488-H490 VanDerWaalsContact O-N 3.11Å; S488-E491 CarbonylContact O-C 3.47Å; S488-E491 WeakPolarHBondContact O-CA 3.32Å; S488-E491 PolarHBondContact O-N 2.88Å; S488-L492 PolarHBondContact O-N 3.23Å; S488-L492 VanDerWaalsContact O-N 3.13Å
489	A	52.5	Low	83.1	Confident	31 Å²	31	62.3 Å²	62.3	26%	0.256	30%	0.302	S	S	.	.	G	3₁₀ helix	trans	-56.1	-35.2	-162	0	0	0	0	0	115.9	E483 E491 L492	E483-A489 HydrophobicContact CG-CB 3.69Å; A489-E491 PolarHBondContact O-N 2.82Å; A489-L492 PolarHBondContact O-N 2.92Å
490	H	51.5	Low	83	Confident	108 Å²	108	64 Å²	64	50%	0.5	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-73.6	-6.5	175.2	-83.8	-46.4	0	0	0	115	H334 S488 N517	H334-H490 AromaticContact CD2-CD2 3.19Å; H334-H490 PolarHBondContact CD2-CD2 2.58Å; H334-H490 AromaticContact CD2-NE2 3.2Å; H334-H490 PolarHBondContact CD2-NE2 2.92Å; H334-H490 AromaticContact CG-CD2 3.71Å; H334-H490 AromaticContact CG-NE2 3.59Å; H334-H490 AromaticContact NE2-CD2 3.8Å; S488-H490 VanDerWaalsContact C-N 3.33Å; S488-H490 PolarHBondContact O-N 2.96Å; S488-H490 VanDerWaalsContact O-N 3.11Å; H490-N517 PolarHBondContact O-ND2 3.02Å
491	E	64.7	Low	83	Confident	112 Å²	112	63.5 Å²	63.5	52%	0.523	31%	0.312	S	S	.	.	G	3₁₀ helix	trans	-122	0.5	174.7	-62	-179.2	-155.9	0	0	112.8	S488 A489 K581	S488-E491 CarbonylContact O-C 3.47Å; S488-E491 WeakPolarHBondContact O-CA 3.32Å; S488-E491 PolarHBondContact O-N 2.88Å; A489-E491 PolarHBondContact O-N 2.82Å; E491-K581 WeakPolarHBondContact O-CD 3.22Å; E491-K581 VanDerWaalsContact OE2-CE 3.29Å; E491-K581 WeakPolarHBondContact OE2-CE 3.42Å; E491-K581 IonicContact OE2-NZ 2.61Å; E491-K581 PolarHBondContact OE2-NZ 3.43Å
492	L	84.9	Confident	83.1	Confident	51 Å²	51	64.6 Å²	64.6	27%	0.267	32%	0.32	S	S	.	.	S	Bend	trans	-82.2	138	169.3	-63.5	-177	0	0	0	108.7	S488 A489 N517 K581	S488-L492 PolarHBondContact O-N 3.23Å; S488-L492 VanDerWaalsContact O-N 3.13Å; A489-L492 PolarHBondContact O-N 2.92Å; L492-N517 WeakPolarHBondContact O-CB 3.35Å; L492-N517 PolarHBondContact O-ND2 3.12Å; L492-K581 HydrophobicContact CD2-CB 3.75Å; L492-K581 HydrophobicContact CD2-CG 4.12Å
493	P	89.8	Confident	83.2	Confident	2 Å²	2	65 Å²	65	1%	0.013	32%	0.323	C	S	.	.			trans	-62	139.2	167.1	29.3	-33.6	0	0	0	108.9	Q516 F518 V575 K581 S583	P493-Q516 WeakPolarHBondContact CA-O 3.44Å; P493-F518 HydrophobicContact CB-CD1 3.8Å; P493-F518 HydrophobicContact CB-CE1 4.04Å; P493-V575 HydrophobicContact CB-CB 3.92Å; P493-V575 HydrophobicContact CB-CG1 3.67Å; P493-V575 HydrophobicContact CG-CB 4.01Å; P493-V575 HydrophobicContact CG-CG1 3.94Å; P493-V575 WeakPolarHBondContact CG-O 3.44Å; P493-K581 WeakPolarHBondContact CD-O 3.15Å; P493-K581 WeakPolarHBondContact CG-O 3.41Å; P493-S583 WeakPolarHBondContact O-CA 3.17Å; P493-S583 WeakPolarHBondContact O-CB 3.42Å
494	M	90.2	Very high	83.4	Confident	74 Å²	74	65.3 Å²	65.3	37%	0.365	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	123.3	-179.7	-175.9	173.8	71.6	0	0	108.6	E496 G515 Q516 F518	M494-E496 HydrophobicContact CE-CG 3.9Å; M494-E496 VanDerWaalsContact CE-OE1 3.24Å; M494-E496 WeakPolarHBondContact CE-OE1 3.17Å; M494-G515 CarbonylContact O-C 3.54Å; M494-G515 WeakPolarHBondContact O-CA 3.29Å; M494-Q516 HydrophobicContact CE-CB 4.21Å; M494-Q516 HydrophobicContact CE-CG 3.94Å; M494-Q516 PolarHBondContact N-O 3.19Å; M494-Q516 PolarHBondContact O-N 3.12Å; M494-F518 WeakPolarHBondContact O-CZ 3.44Å
495	V	94.2	Very high	83.6	Confident	15 Å²	15	65.1 Å²	65.1	9%	0.091	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	125.8	171.4	-174.9	0	0	0	0	107.7	L513 F518 V575 Q586	V495-L513 HydrophobicContact CG1-CD2 4.3Å; V495-F518 HydrophobicContact CG2-CE1 4.49Å; V495-F518 HydrophobicContact CG2-CZ 4.39Å; V495-V575 HydrophobicContact CG2-CG2 3.51Å; V495-Q586 HydrophobicContact CB-CG 3.94Å; V495-Q586 HydrophobicContact CG1-CG 3.99Å; V495-Q586 HydrophobicContact CG2-CG 4.17Å
496	E	89.9	Confident	84	Confident	112 Å²	112	68.5 Å²	68.5	52%	0.523	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	-33.6	175.8	-67.2	178.7	158.9	0	0	111.2	M494 T514 Q516	M494-E496 HydrophobicContact CE-CG 3.9Å; M494-E496 VanDerWaalsContact CE-OE1 3.24Å; M494-E496 WeakPolarHBondContact CE-OE1 3.17Å; E496-T514 PolarHBondContact N-O 2.84Å; E496-Q516 PolarHBondContact OE1-NE2 2.65Å
497	K	92.9	Very high	85.1	Confident	134 Å²	134	64.1 Å²	64.1	58%	0.583	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-150.7	143.2	178.7	178.6	-179.9	177.4	-168.9	0	111.1	T514	K497-T514 PolarHBondContact N-O 3.23Å; K497-T514 PolarHBondContact O-N 3.13Å
498	Q	96.8	Very high	87	Confident	35 Å²	35	56.3 Å²	56.3	16%	0.164	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	151.2	158.6	63.7	-154.7	68	0	0	108.7	M500 M511 L513 F573 H587	Q498-M500 WeakPolarHBondContact CG-O 3.31Å; Q498-M500 PolarHBondContact NE2-O 2.76Å; Q498-M500 VanDerWaalsContact NE2-O 3.17Å; Q498-M511 HydrophobicContact CB-SD 4.41Å; Q498-L513 HydrophobicContact CB-CD2 3.71Å; Q498-F573 HydrophobicContact CB-CZ 4.49Å; Q498-H587 PolarHBondContact NE2-O 2.83Å
499	D	97.4	Very high	88.9	Confident	86 Å²	86	57.1 Å²	57.1	46%	0.46	31%	0.305	S	S	.	.	S	Bend	trans	-87.5	-27.8	174.7	60.5	-11	0	0	0	113.3	M511 I512	D499-M511 WeakPolarHBondContact OD1-CA 3.49Å; D499-M511 WeakPolarHBondContact OD1-CG 3.38Å; D499-I512 PolarHBondContact N-O 2.86Å; D499-I512 PolarHBondContact OD1-N 3.24Å; D499-I512 VanDerWaalsContact OD2-CB 3.3Å; D499-I512 WeakPolarHBondContact OD2-CB 3.4Å; D499-I512 WeakPolarHBondContact OD2-CG1 3.25Å; D499-I512 PolarHBondContact OD2-N 3.34Å; D499-I512 VanDerWaalsContact OD2-N 3.11Å
500	M	96.4	Very high	91	Very high	36 Å²	36	60.7 Å²	60.7	18%	0.177	32%	0.316	C	S	.	.			trans	-122.3	136.8	178.5	-177.1	172.1	51.4	0	0	110.8	Q498 S502 C503 Q509 M511 V557 F588	Q498-M500 WeakPolarHBondContact CG-O 3.31Å; Q498-M500 PolarHBondContact NE2-O 2.76Å; Q498-M500 VanDerWaalsContact NE2-O 3.17Å; M500-S502 WeakPolarHBondContact CG-O 3.24Å; M500-C503 HydrophobicContact SD-CB 3.99Å; M500-Q509 HydrophobicContact CE-CB 3.73Å; M500-Q509 HydrophobicContact SD-CB 3.99Å; M500-M511 HydrophobicContact CB-CG 4.31Å; M500-M511 HydrophobicContact CE-CB 3.71Å; M500-M511 HydrophobicContact CE-CG 4.42Å; M500-V557 HydrophobicContact CE-CG2 3.64Å; M500-F588 HydrophobicContact CE-CE2 4.48Å; M500-F588 HydrophobicContact CG-CE2 4.18Å
501	D	96.3	Very high	93.2	Very high	101 Å²	101	55.6 Å²	55.6	54%	0.54	29%	0.292	S	S	.	.	S	Bend	trans	-113.6	-8.7	178.9	69.9	-6.3	0	0	0	113.8	F588 T589	D501-F588 VanDerWaalsContact C-CD2 3.47Å; D501-F588 CarbonylContact O-C 3.43Å; D501-F588 VanDerWaalsContact O-CA 3.29Å; D501-F588 WeakPolarHBondContact O-CA 3.44Å; D501-F588 WeakPolarHBondContact O-CD2 3.49Å; D501-T589 PolarHBondContact O-N 2.87Å
502	S	96.6	Very high	94.8	Very high	48 Å²	48	52.4 Å²	52.4	34%	0.336	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	147.1	-173.5	52	0	0	0	0	111.9	M500 T589	M500-S502 WeakPolarHBondContact CG-O 3.24Å; S502-T589 WeakPolarHBondContact CA-O 3.41Å; S502-T589 VanDerWaalsContact CB-O 3.3Å; S502-T589 WeakPolarHBondContact CB-O 3.05Å
503	C	96.3	Very high	95.4	Very high	10 Å²	10	50 Å²	50	7%	0.068	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.6	172.4	173.7	81.8	0	0	0	0	110.9	M500 Q509 F588 T589 F590 T591	M500-C503 HydrophobicContact SD-CB 3.99Å; C503-Q509 HydrophobicContact CB-CB 4.42Å; C503-Q509 HydrophobicContact CB-CG 4.34Å; C503-F588 HydrophobicContact CB-CE1 4.3Å; C503-F588 HydrophobicContact CB-CZ 3.83Å; C503-F588 VanDerWaalsContact SG-CZ 3.59Å; C503-T589 PolarHBondContact N-O 3.35Å; C503-T589 VanDerWaalsContact N-O 3.13Å; C503-F590 CarbonylContact O-C 3.52Å; C503-F590 WeakPolarHBondContact O-CA 3.47Å; C503-T591 PolarHBondContact O-N 2.98Å; C503-T591 PolarHBondContact O-OG1 3.31Å; C503-T591 VanDerWaalsContact O-OG1 3.12Å
504	S	96.2	Very high	95.8	Very high	30 Å²	30	52.1 Å²	52.1	21%	0.21	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66	154.1	177.3	76.5	0	0	0	0	112.1	L506 G507	S504-L506 PolarHBondContact O-N 2.73Å; S504-L506 PolarHBondContact OG-N 2.7Å; S504-G507 PolarHBondContact O-N 3.04Å
505	V	96.6	Very high	95.9	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-50.7	-21.1	173.1	-75.5	0	0	0	0	115.8	G507 Y560 T563 I565 F590 T591 L593	V505-G507 VanDerWaalsContact C-N 3.29Å; V505-G507 PolarHBondContact O-N 2.97Å; V505-Y560 HydrophobicContact CG1-CD1 3.9Å; V505-Y560 PolarHBondContact O-N 3.06Å; V505-T563 HydrophobicContact CG2-CG2 4.48Å; V505-I565 HydrophobicContact CG1-CD1 3.24Å; V505-I565 HydrophobicContact CG1-CG1 3.63Å; V505-F590 HydrophobicContact CG1-CB 4.26Å; V505-T591 PolarHBondContact N-O 3.1Å; V505-L593 HydrophobicContact CG2-CD1 4.39Å; V505-L593 HydrophobicContact CG2-CG 3.85Å
506	L	96.1	Very high	95.7	Very high	94 Å²	94	51.9 Å²	51.9	49%	0.492	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-22.8	177.1	-61.3	-178.8	0	0	0	113.3	S504 S559 T563 L593	S504-L506 PolarHBondContact O-N 2.73Å; S504-L506 PolarHBondContact OG-N 2.7Å; L506-S559 WeakPolarHBondContact O-CA 3.32Å; L506-S559 VanDerWaalsContact O-CB 3.31Å; L506-S559 WeakPolarHBondContact O-CB 3.47Å; L506-T563 HydrophobicContact CD2-CG2 4.09Å; L506-L593 HydrophobicContact CD1-CD2 3.87Å; L506-L593 HydrophobicContact CD2-CD1 4.37Å; L506-L593 HydrophobicContact CG-CD1 4.48Å; L506-L593 HydrophobicContact CG-CD2 4Å
507	G	95.4	Very high	95.7	Very high	5 Å²	5	49.1 Å²	49.1	5%	0.052	27%	0.266	C	S	.	.			trans	59	-151.2	-169.7	0	0	0	0	0	112.1	S504 V505 Q509 V557	S504-G507 PolarHBondContact O-N 3.04Å; V505-G507 VanDerWaalsContact C-N 3.29Å; V505-G507 PolarHBondContact O-N 2.97Å; G507-Q509 PolarHBondContact O-N 3.14Å; G507-Q509 PolarHBondContact O-NE2 2.61Å; G507-Q509 PolarHBondContact O-OE1 2.87Å; G507-V557 CarbonylContact C-O 3.47Å; G507-V557 WeakPolarHBondContact CA-O 3.18Å
508	G	95.4	Very high	95.7	Very high	43 Å²	43	43.1 Å²	43.1	44%	0.443	24%	0.24	S	C	.	.			trans	79.2	-0.8	-176.5	0	0	0	0	0	114.2	V557	G508-V557 PolarHBondContact N-O 2.95Å
509	Q	96.8	Very high	95.4	Very high	73 Å²	73	43.6 Å²	43.6	34%	0.341	25%	0.247	S	C	.	.			trans	-80.1	138.3	172.4	-72.5	72.4	76.9	0	0	109.8	M500 C503 G507 V557	M500-Q509 HydrophobicContact CE-CB 3.73Å; M500-Q509 HydrophobicContact SD-CB 3.99Å; C503-Q509 HydrophobicContact CB-CB 4.42Å; C503-Q509 HydrophobicContact CB-CG 4.34Å; G507-Q509 PolarHBondContact O-N 3.14Å; G507-Q509 PolarHBondContact O-NE2 2.61Å; G507-Q509 PolarHBondContact O-OE1 2.87Å; Q509-V557 PolarHBondContact O-N 3.34Å
510	Q	97.4	Very high	95	Very high	106 Å²	106	44.5 Å²	44.5	50%	0.495	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	134.6	173.3	-177.7	164.9	85.9	0	0	110.8	V555	Q510-V555 CarbonylContact C-O 3.52Å; Q510-V555 WeakPolarHBondContact CA-O 3.27Å
511	M	97.8	Very high	94.7	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.4	139.1	175.9	-179.3	179	59.9	0	0	108.8	Q498 D499 M500 L513 F526 V555 V557 F573 F588	Q498-M511 HydrophobicContact CB-SD 4.41Å; D499-M511 WeakPolarHBondContact OD1-CA 3.49Å; D499-M511 WeakPolarHBondContact OD1-CG 3.38Å; M500-M511 HydrophobicContact CB-CG 4.31Å; M500-M511 HydrophobicContact CE-CB 3.71Å; M500-M511 HydrophobicContact CE-CG 4.42Å; M511-L513 HydrophobicContact CE-CD1 4.29Å; M511-L513 HydrophobicContact CE-CD2 3.74Å; M511-L513 HydrophobicContact CE-CG 4.08Å; M511-L513 HydrophobicContact CG-CD2 4.14Å; M511-L513 HydrophobicContact SD-CD2 3.88Å; M511-F526 HydrophobicContact CE-CE2 4.2Å; M511-F526 HydrophobicContact CE-CZ 3.75Å; M511-V555 HydrophobicContact CE-CB 4.15Å; M511-V555 HydrophobicContact CE-CG1 4.11Å; M511-V555 PolarHBondContact N-O 2.86Å; M511-V555 PolarHBondContact O-N 2.65Å; M511-V557 HydrophobicContact CB-CG2 3.96Å; M511-V557 HydrophobicContact CE-CG2 4.35Å; M511-V557 HydrophobicContact SD-CG2 4.46Å; M511-F573 HydrophobicContact CE-CE1 4.37Å; M511-F573 HydrophobicContact CE-CE2 4.35Å; M511-F573 HydrophobicContact CE-CZ 4.12Å; M511-F573 HydrophobicContact SD-CE1 4.26Å; M511-F573 HydrophobicContact SD-CZ 4.17Å; M511-F588 HydrophobicContact SD-CD2 4.3Å; M511-F588 HydrophobicContact SD-CE2 4.16Å
512	I	97.9	Very high	94.6	Very high	45 Å²	45	41.6 Å²	41.6	23%	0.231	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	116.4	175.6	-55.1	175.8	0	0	0	109.4	D499 M552 L553 F554	D499-I512 PolarHBondContact N-O 2.86Å; D499-I512 PolarHBondContact OD1-N 3.24Å; D499-I512 VanDerWaalsContact OD2-CB 3.3Å; D499-I512 WeakPolarHBondContact OD2-CB 3.4Å; D499-I512 WeakPolarHBondContact OD2-CG1 3.25Å; D499-I512 PolarHBondContact OD2-N 3.34Å; D499-I512 VanDerWaalsContact OD2-N 3.11Å; I512-M552 HydrophobicContact CG2-CE 4.19Å; I512-M552 HydrophobicContact CG2-CG 3.53Å; I512-M552 HydrophobicContact CG2-SD 3.75Å; I512-L553 WeakPolarHBondContact CA-O 3.43Å; I512-F554 HydrophobicContact CD1-CD1 4.15Å; I512-F554 HydrophobicContact CD1-CE1 3.63Å; I512-F554 HydrophobicContact CD1-CZ 4.35Å; I512-F554 HydrophobicContact CG1-CD1 3.88Å; I512-F554 HydrophobicContact CG1-CE1 3.85Å
513	L	98.1	Very high	94.6	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	114.7	173.4	-57.8	-178.4	0	0	0	109.7	V495 Q498 M511 V524 M552 L553 V555 F573 V575	V495-L513 HydrophobicContact CG1-CD2 4.3Å; Q498-L513 HydrophobicContact CB-CD2 3.71Å; M511-L513 HydrophobicContact CE-CD1 4.29Å; M511-L513 HydrophobicContact CE-CD2 3.74Å; M511-L513 HydrophobicContact CE-CG 4.08Å; M511-L513 HydrophobicContact CG-CD2 4.14Å; M511-L513 HydrophobicContact SD-CD2 3.88Å; L513-V524 HydrophobicContact CD1-CG1 4.08Å; L513-V524 HydrophobicContact CD1-CG2 3.94Å; L513-M552 CarbonylContact O-C 3.6Å; L513-M552 VanDerWaalsContact O-CA 3.26Å; L513-M552 WeakPolarHBondContact O-CA 3.42Å; L513-L553 HydrophobicContact CB-CB 4.31Å; L513-L553 PolarHBondContact N-O 3.16Å; L513-L553 PolarHBondContact O-N 2.71Å; L513-V555 HydrophobicContact CD1-CG2 4Å; L513-V555 HydrophobicContact CG-CG2 4.11Å; L513-F573 HydrophobicContact CD1-CD2 4.43Å; L513-F573 HydrophobicContact CD1-CE2 3.72Å; L513-F573 HydrophobicContact CD1-CZ 4.5Å; L513-F573 HydrophobicContact CD2-CE2 3.66Å; L513-F573 HydrophobicContact CD2-CZ 3.61Å; L513-F573 HydrophobicContact CG-CE2 4.36Å; L513-V575 HydrophobicContact CD1-CG2 3.9Å
514	T	96.9	Very high	94.7	Very high	48 Å²	48	42.6 Å²	42.6	29%	0.294	24%	0.242	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	140.1	172	-51.1	0	0	0	0	109.8	E496 K497 S551	E496-T514 PolarHBondContact N-O 2.84Å; K497-T514 PolarHBondContact N-O 3.23Å; K497-T514 PolarHBondContact O-N 3.13Å; T514-S551 WeakPolarHBondContact CA-O 3.49Å
515	G	93.4	Very high	94.8	Very high	3 Å²	3	41.8 Å²	41.8	3%	0.031	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	174.1	-146.5	-176.4	0	0	0	0	0	114.9	M494 S551	M494-G515 CarbonylContact O-C 3.54Å; M494-G515 WeakPolarHBondContact O-CA 3.29Å; G515-S551 PolarHBondContact N-O 2.85Å; G515-S551 WeakPolarHBondContact O-CA 3.36Å; G515-S551 WeakPolarHBondContact O-CB 3.18Å
516	Q	89.5	Confident	94.8	Very high	81 Å²	81	41.8 Å²	41.8	38%	0.379	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	157.5	-176.8	-57	-173.6	33.3	0	0	112.4	P493 M494 E496 F518	P493-Q516 WeakPolarHBondContact CA-O 3.44Å; M494-Q516 HydrophobicContact CE-CB 4.21Å; M494-Q516 HydrophobicContact CE-CG 3.94Å; M494-Q516 PolarHBondContact N-O 3.19Å; M494-Q516 PolarHBondContact O-N 3.12Å; E496-Q516 PolarHBondContact OE1-NE2 2.65Å; Q516-F518 VanDerWaalsContact C-N 3.28Å; Q516-F518 PolarHBondContact O-N 2.84Å
517	N	89.4	Confident	94.8	Very high	54 Å²	54	38 Å²	38	29%	0.289	22%	0.215	S	C	.	.	S	Bend	trans	58	32.8	176.3	-45.4	-39.6	0	0	0	114.2	H490 L492 P550 N577	H490-N517 PolarHBondContact O-ND2 3.02Å; L492-N517 WeakPolarHBondContact O-CB 3.35Å; L492-N517 PolarHBondContact O-ND2 3.12Å; N517-P550 PolarHBondContact N-O 3.12Å; N517-N577 PolarHBondContact O-ND2 3.48Å
518	F	92.6	Very high	94.8	Very high	8 Å²	8	38.9 Å²	38.9	4%	0.035	22%	0.219	C	C	.	.			trans	-76.8	157.1	166.5	-52.4	-38.7	0	0	0	110.5	P493 M494 V495 Q516 S522 P550 L553 V575	P493-F518 HydrophobicContact CB-CD1 3.8Å; P493-F518 HydrophobicContact CB-CE1 4.04Å; M494-F518 WeakPolarHBondContact O-CZ 3.44Å; V495-F518 HydrophobicContact CG2-CE1 4.49Å; V495-F518 HydrophobicContact CG2-CZ 4.39Å; Q516-F518 VanDerWaalsContact C-N 3.28Å; Q516-F518 PolarHBondContact O-N 2.84Å; F518-S522 WeakPolarHBondContact CA-OG 3.44Å; F518-P550 PolarHBondContact N-O 2.88Å; F518-P550 WeakPolarHBondContact O-CA 3.31Å; F518-L553 HydrophobicContact CB-CD1 4.48Å; F518-L553 HydrophobicContact CB-CD2 3.89Å; F518-L553 HydrophobicContact CB-CG 4.09Å; F518-L553 HydrophobicContact CD1-CD1 4.06Å; F518-L553 HydrophobicContact CD1-CG 4.27Å; F518-L553 HydrophobicContact CD2-CD1 4.36Å; F518-L553 HydrophobicContact CD2-CD2 4.29Å; F518-L553 HydrophobicContact CD2-CG 3.7Å; F518-L553 HydrophobicContact CE1-CD1 4.39Å; F518-L553 HydrophobicContact CE2-CG 4.15Å; F518-L553 HydrophobicContact CG-CD1 4.06Å; F518-L553 HydrophobicContact CG-CD2 4.16Å; F518-L553 HydrophobicContact CG-CG 3.78Å; F518-V575 HydrophobicContact CD1-CG1 3.98Å; F518-V575 HydrophobicContact CE1-CB 4.34Å; F518-V575 HydrophobicContact CE1-CG1 4.1Å; F518-V575 HydrophobicContact CE1-CG2 4.02Å
519	S	90.3	Very high	94.7	Very high	45 Å²	45	42 Å²	42	32%	0.315	22%	0.22	S	C	.	.			trans	-146.6	166.8	-175.8	52.6	0	0	0	0	110.7	D521 S522 N577	S519-D521 VanDerWaalsContact CB-OD1 3.25Å; S519-D521 WeakPolarHBondContact CB-OD1 3.26Å; S519-D521 PolarHBondContact O-N 3.4Å; S519-D521 VanDerWaalsContact O-N 3.14Å; S519-D521 PolarHBondContact OG-OD1 3.47Å; S519-S522 PolarHBondContact N-OG 3.5Å; S519-S522 VanDerWaalsContact O-CB 3.22Å; S519-S522 WeakPolarHBondContact O-CB 3.49Å; S519-S522 PolarHBondContact O-N 2.97Å; S519-S522 PolarHBondContact O-OG 2.94Å; S519-S522 PolarHBondContact OG-OG 2.87Å; S519-N577 PolarHBondContact OG-ND2 2.92Å
520	S	89.4	Confident	94.3	Very high	104 Å²	104	40.2 Å²	40.2	73%	0.727	21%	0.214	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.2	-11.1	179.5	52	0	0	0	0	114.2	K545	S520-K545 PolarHBondContact O-NZ 2.88Å
521	D	89.5	Confident	93.7	Very high	74 Å²	74	44.4 Å²	44.4	40%	0.396	23%	0.233	S	C	.	.	T	Hydrogen-bonded Turn	trans	-100.5	1.5	169.3	77.4	-55	0	0	0	114.1	S519 K523 G578	S519-D521 VanDerWaalsContact CB-OD1 3.25Å; S519-D521 WeakPolarHBondContact CB-OD1 3.26Å; S519-D521 PolarHBondContact O-N 3.4Å; S519-D521 VanDerWaalsContact O-N 3.14Å; S519-D521 PolarHBondContact OG-OD1 3.47Å; D521-K523 PolarHBondContact O-N 2.8Å; D521-G578 WeakPolarHBondContact OD2-CA 3.41Å; D521-G578 PolarHBondContact OD2-N 2.81Å
522	S	95.2	Very high	93.2	Very high	2 Å²	2	48.9 Å²	48.9	1%	0.014	26%	0.257	C	S	.	.			trans	-57.7	128.1	172.9	-69.8	0	0	0	0	110.8	F518 S519 I576 N577	F518-S522 WeakPolarHBondContact CA-OG 3.44Å; S519-S522 PolarHBondContact N-OG 3.5Å; S519-S522 VanDerWaalsContact O-CB 3.22Å; S519-S522 WeakPolarHBondContact O-CB 3.49Å; S519-S522 PolarHBondContact O-N 2.97Å; S519-S522 PolarHBondContact O-OG 2.94Å; S519-S522 PolarHBondContact OG-OG 2.87Å; S522-I576 WeakPolarHBondContact CA-O 3.32Å; S522-N577 PolarHBondContact OG-OD1 2.78Å
523	K	96.7	Very high	92.5	Very high	80 Å²	80	48.4 Å²	48.4	35%	0.348	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	149.8	170.9	-62.8	167.7	164.2	-77.4	0	108.8	D521 I525 E540 V575 I576	D521-K523 PolarHBondContact O-N 2.8Å; K523-I525 HydrophobicContact CB-CD1 4.14Å; K523-E540 HydrophobicContact CB-CG 4.43Å; K523-E540 WeakPolarHBondContact CD-OE2 3.34Å; K523-E540 WeakPolarHBondContact CG-OE1 3.15Å; K523-E540 IonicContact NZ-OE1 3.72Å; K523-E540 PolarHBondContact NZ-OE1 3.18Å; K523-E540 IonicContact NZ-OE2 3.86Å; K523-E540 PolarHBondContact NZ-OE2 3.3Å; K523-V575 CarbonylContact O-C 3.53Å; K523-V575 WeakPolarHBondContact O-CA 3.29Å; K523-I576 HydrophobicContact CB-CG2 3.83Å; K523-I576 PolarHBondContact N-O 2.85Å; K523-I576 PolarHBondContact O-N 2.61Å
524	V	97.9	Very high	92.1	Very high	0 Å²	0	54.4 Å²	54.4	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	122.8	172.3	-174.9	0	0	0	0	108.2	L513 F526 A541 V543 L553 V555 F573 V575	L513-V524 HydrophobicContact CD1-CG1 4.08Å; L513-V524 HydrophobicContact CD1-CG2 3.94Å; V524-F526 HydrophobicContact CG1-CD2 4.46Å; V524-F526 HydrophobicContact CG1-CE2 4.07Å; V524-A541 HydrophobicContact CB-CB 4.21Å; V524-A541 WeakPolarHBondContact O-CB 3.37Å; V524-A541 PolarHBondContact O-N 2.79Å; V524-V543 HydrophobicContact CB-CG2 4.43Å; V524-V543 HydrophobicContact CG2-CG2 3.95Å; V524-L553 HydrophobicContact CG2-CD1 3.87Å; V524-V555 HydrophobicContact CB-CG1 4.06Å; V524-V555 HydrophobicContact CB-CG2 4.49Å; V524-V555 HydrophobicContact CG1-CG1 4.23Å; V524-V555 HydrophobicContact CG2-CG1 4.27Å; V524-V555 HydrophobicContact CG2-CG2 3.82Å; V524-F573 HydrophobicContact CG1-CD2 3.77Å; V524-F573 HydrophobicContact CG1-CE2 4.43Å; V524-F573 HydrophobicContact CG1-CG 4.43Å; V524-V575 HydrophobicContact CG2-CG2 4.19Å
525	I	97.6	Very high	91.7	Very high	13 Å²	13	56.7 Å²	56.7	7%	0.067	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	114.2	-171.3	-51.9	-60.8	0	0	0	108.9	K523 E538 M539 E540 F573 Y574 I576	K523-I525 HydrophobicContact CB-CD1 4.14Å; I525-E538 HydrophobicContact CG2-CG 3.34Å; I525-E538 WeakPolarHBondContact CG2-OE1 3.31Å; I525-M539 WeakPolarHBondContact CA-O 3.47Å; I525-E540 HydrophobicContact CD1-CB 3.8Å; I525-E540 HydrophobicContact CD1-CG 3.83Å; I525-F573 CarbonylContact O-C 3.53Å; I525-F573 WeakPolarHBondContact O-CA 3.38Å; I525-F573 WeakPolarHBondContact O-CB 3.47Å; I525-Y574 HydrophobicContact CB-CD2 4.28Å; I525-Y574 HydrophobicContact CB-CE1 4.07Å; I525-Y574 HydrophobicContact CB-CE2 3.77Å; I525-Y574 HydrophobicContact CG1-CD2 4.41Å; I525-Y574 HydrophobicContact CG1-CE2 3.7Å; I525-Y574 HydrophobicContact CG2-CE1 4.1Å; I525-Y574 HydrophobicContact CG2-CE2 4.42Å; I525-Y574 PolarHBondContact N-O 3.33Å; I525-Y574 PolarHBondContact O-N 2.78Å; I525-I576 HydrophobicContact CD1-CG2 4.49Å; I525-I576 HydrophobicContact CG1-CG2 3.85Å
526	F	97.9	Very high	91.7	Very high	0 Å²	0	60 Å²	60	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	143.3	170.2	-75.8	-108.3	0	0	0	109.4	M511 V524 W537 E538 M539 A541 V557 P558 V571 N572 F573 F588 F590	M511-F526 HydrophobicContact CE-CE2 4.2Å; M511-F526 HydrophobicContact CE-CZ 3.75Å; V524-F526 HydrophobicContact CG1-CD2 4.46Å; V524-F526 HydrophobicContact CG1-CE2 4.07Å; F526-W537 HydrophobicContact CB-CH2 3.88Å; F526-W537 HydrophobicContact CB-CZ3 3.83Å; F526-E538 CarbonylContact O-C 3.54Å; F526-E538 VanDerWaalsContact O-CA 3.31Å; F526-E538 WeakPolarHBondContact O-CA 3.35Å; F526-M539 PolarHBondContact N-O 3.48Å; F526-M539 PolarHBondContact O-N 2.93Å; F526-A541 HydrophobicContact CD2-CB 3.91Å; F526-A541 HydrophobicContact CE2-CB 3.8Å; F526-V557 HydrophobicContact CE1-CG1 3.96Å; F526-V557 HydrophobicContact CZ-CB 4.46Å; F526-V557 HydrophobicContact CZ-CG1 3.92Å; F526-V557 HydrophobicContact CZ-CG2 4.12Å; F526-P558 HydrophobicContact CB-CG 4.21Å; F526-P558 HydrophobicContact CD2-CG 3.9Å; F526-P558 HydrophobicContact CE2-CG 4.49Å; F526-P558 HydrophobicContact CG-CG 4.05Å; F526-V571 HydrophobicContact CD1-CG2 4.17Å; F526-N572 CarbonylContact C-O 3.59Å; F526-N572 WeakPolarHBondContact CA-O 3.46Å; F526-F573 HydrophobicContact CB-CB 4.49Å; F526-F573 HydrophobicContact CD1-CB 4.01Å; F526-F573 HydrophobicContact CD2-CB 3.98Å; F526-F573 HydrophobicContact CE1-CB 4.19Å; F526-F573 AromaticContact CE1-CD1 3.98Å; F526-F573 HydrophobicContact CE1-CD1 3.98Å; F526-F573 HydrophobicContact CE1-CG 4.34Å; F526-F573 HydrophobicContact CE2-CB 4.16Å; F526-F573 HydrophobicContact CE2-CG 4.39Å; F526-F573 HydrophobicContact CG-CB 3.9Å; F526-F573 HydrophobicContact CZ-CB 4.26Å; F526-F573 HydrophobicContact CZ-CD1 4.08Å; F526-F573 HydrophobicContact CZ-CG 4.21Å; F526-F588 HydrophobicContact CD1-CD1 4.45Å; F526-F588 HydrophobicContact CE1-CB 4.06Å; F526-F588 AromaticContact CE1-CD1 3.79Å; F526-F588 HydrophobicContact CE1-CD1 3.79Å; F526-F588 HydrophobicContact CE1-CD2 4.18Å; F526-F588 HydrophobicContact CE1-CE1 4.25Å; F526-F588 AromaticContact CE1-CG 3.75Å; F526-F588 HydrophobicContact CE1-CG 3.75Å; F526-F590 HydrophobicContact CD1-CE2 4.31Å; F526-F590 HydrophobicContact CD1-CZ 4.43Å
527	L	96.5	Very high	92	Very high	13 Å²	13	57.3 Å²	57.3	7%	0.068	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.8	153.9	-179.2	71.8	98.7	0	0	0	113.5	K529 W537 E538 V571 N572 Y574	L527-K529 HydrophobicContact CD1-CD 4.15Å; L527-K529 HydrophobicContact CD1-CG 3.78Å; L527-W537 CarbonylContact C-O 3.53Å; L527-W537 WeakPolarHBondContact CA-O 3.42Å; L527-W537 WeakPolarHBondContact CB-O 3.32Å; L527-E538 HydrophobicContact CB-CB 4.4Å; L527-E538 HydrophobicContact CB-CG 4.38Å; L527-V571 WeakPolarHBondContact O-CB 3.47Å; L527-N572 HydrophobicContact CG-CB 4.48Å; L527-N572 PolarHBondContact N-O 3.06Å; L527-N572 PolarHBondContact O-N 2.74Å; L527-Y574 HydrophobicContact CD2-CD1 3.54Å; L527-Y574 HydrophobicContact CD2-CE1 3.31Å
528	E	95.6	Very high	92.3	Very high	25 Å²	25	58.5 Å²	58.5	12%	0.117	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	147.6	172.8	-163.5	-166.9	153.4	0	0	109.8	L536 W537 Y560 R561 V571	E528-L536 HydrophobicContact CB-CB 4.22Å; E528-L536 HydrophobicContact CG-CB 4.39Å; E528-L536 HydrophobicContact CG-CD1 4.25Å; E528-L536 PolarHBondContact O-N 3.38Å; E528-L536 WeakPolarHBondContact OE1-CD1 3.26Å; E528-W537 HydrophobicContact CB-CB 3.92Å; E528-W537 HydrophobicContact CB-CE3 4.32Å; E528-W537 PolarHBondContact N-O 2.81Å; E528-W537 PolarHBondContact O-N 2.83Å; E528-Y560 WeakPolarHBondContact OE2-CE2 3.48Å; E528-Y560 PolarHBondContact OE2-OH 2.97Å; E528-R561 IonicContact OE1-CZ 2.79Å; E528-R561 IonicContact OE1-NH2 3.29Å; E528-R561 PolarHBondContact OE1-NH2 2.84Å; E528-R561 IonicContact OE2-CZ 3.24Å; E528-R561 IonicContact OE2-NE 2.71Å; E528-R561 PolarHBondContact OE2-NE 3.36Å; E528-R561 IonicContact OE2-NH2 2.73Å; E528-R561 PolarHBondContact OE2-NH2 3.36Å; E528-V571 HydrophobicContact CB-CG1 4.25Å; E528-V571 HydrophobicContact CG-CG1 4.38Å
529	K	92.4	Very high	92.6	Very high	108 Å²	108	61.6 Å²	61.6	47%	0.47	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	148.4	177.6	-68.8	-172.3	167	-137.7	0	111.8	L527 G533 Q534	L527-K529 HydrophobicContact CD1-CD 4.15Å; L527-K529 HydrophobicContact CD1-CG 3.78Å; K529-G533 PolarHBondContact NZ-O 2.62Å; K529-Q534 CarbonylContact C-O 3.53Å; K529-Q534 WeakPolarHBondContact CA-O 3.34Å; K529-Q534 WeakPolarHBondContact CB-O 3.46Å
530	T	89	Confident	92.9	Very high	36 Å²	36	64.1 Å²	64.1	22%	0.221	33%	0.328	C	S	.	.			trans	-64.8	167.6	165.7	55.8	0	0	0	0	111.2	D532 G533 Q534 L536	T530-D532 WeakPolarHBondContact CB-OD1 3.4Å; T530-D532 PolarHBondContact O-N 2.95Å; T530-D532 PolarHBondContact OG1-OD1 2.8Å; T530-G533 PolarHBondContact O-N 2.89Å; T530-G533 PolarHBondContact OG1-N 2.86Å; T530-Q534 HydrophobicContact CG2-CB 4.33Å; T530-Q534 PolarHBondContact N-O 3.47Å; T530-Q534 WeakPolarHBondContact OG1-CB 3.48Å; T530-Q534 PolarHBondContact OG1-N 2.88Å; T530-Q534 PolarHBondContact OG1-O 2.93Å; T530-L536 HydrophobicContact CG2-CD1 3.82Å; T530-L536 HydrophobicContact CG2-CD2 3.55Å; T530-L536 HydrophobicContact CG2-CG 3.61Å
531	H	84	Confident	93.3	Very high	194 Å²	194	59.2 Å²	59.2	90%	0.898	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	-27.6	172.5	60.5	-93	0	0	0	113.3	G533	H531-G533 VanDerWaalsContact C-N 3.31Å
532	D	87	Confident	93.7	Very high	94 Å²	94	59.7 Å²	59.7	50%	0.503	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	3.1	172	70.8	-48.2	0	0	0	113.5	T530 Q534	T530-D532 WeakPolarHBondContact CB-OD1 3.4Å; T530-D532 PolarHBondContact O-N 2.95Å; T530-D532 PolarHBondContact OG1-OD1 2.8Å; D532-Q534 WeakPolarHBondContact OD2-CG 3.34Å; D532-Q534 PolarHBondContact OD2-NE2 3.32Å
533	G	83.9	Confident	93.8	Very high	35 Å²	35	60.5 Å²	60.5	36%	0.361	30%	0.304	S	S	.	.			trans	89.7	2.3	167.8	0	0	0	0	0	116.4	K529 T530 H531	K529-G533 PolarHBondContact NZ-O 2.62Å; T530-G533 PolarHBondContact O-N 2.89Å; T530-G533 PolarHBondContact OG1-N 2.86Å; H531-G533 VanDerWaalsContact C-N 3.31Å
534	Q	88.3	Confident	93.8	Very high	126 Å²	126	58.8 Å²	58.8	59%	0.589	30%	0.299	S	S	*	.			trans	-63.3	149.7	170.2	-57.5	-174.9	41.2	0	0	110.4	K529 T530 D532 L536	K529-Q534 CarbonylContact C-O 3.53Å; K529-Q534 WeakPolarHBondContact CA-O 3.34Å; K529-Q534 WeakPolarHBondContact CB-O 3.46Å; T530-Q534 HydrophobicContact CG2-CB 4.33Å; T530-Q534 PolarHBondContact N-O 3.47Å; T530-Q534 WeakPolarHBondContact OG1-CB 3.48Å; T530-Q534 PolarHBondContact OG1-N 2.88Å; T530-Q534 PolarHBondContact OG1-O 2.93Å; D532-Q534 WeakPolarHBondContact OD2-CG 3.34Å; D532-Q534 PolarHBondContact OD2-NE2 3.32Å; Q534-L536 PolarHBondContact O-N 2.91Å
535	Q	90.1	Very high	93.6	Very high	96 Å²	96	64.4 Å²	64.4	45%	0.449	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	110.2	-177.9	-169	166.3	-78.2	0	0	110.3	E538	Q535-E538 HydrophobicContact CG-CB 4.26Å; Q535-E538 VanDerWaalsContact NE2-CB 3.32Å; Q535-E538 PolarHBondContact NE2-OE2 3.23Å
536	L	92.9	Very high	93.4	Very high	72 Å²	72	71.3 Å²	71.3	38%	0.377	36%	0.36	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	-31.1	179.4	-74.4	172.9	0	0	0	112.6	E528 T530 Q534	E528-L536 HydrophobicContact CB-CB 4.22Å; E528-L536 HydrophobicContact CG-CB 4.39Å; E528-L536 HydrophobicContact CG-CD1 4.25Å; E528-L536 PolarHBondContact O-N 3.38Å; E528-L536 WeakPolarHBondContact OE1-CD1 3.26Å; T530-L536 HydrophobicContact CG2-CD1 3.82Å; T530-L536 HydrophobicContact CG2-CD2 3.55Å; T530-L536 HydrophobicContact CG2-CG 3.61Å; Q534-L536 PolarHBondContact O-N 2.91Å
537	W	95.8	Very high	93.1	Very high	24 Å²	24	76.7 Å²	76.7	9%	0.091	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-157.6	141.2	-174.6	-177.4	57.6	0	0	0	108.9	F526 L527 E528 M539 P558 S559 Y560 R561 V571 F590	F526-W537 HydrophobicContact CB-CH2 3.88Å; F526-W537 HydrophobicContact CB-CZ3 3.83Å; L527-W537 CarbonylContact C-O 3.53Å; L527-W537 WeakPolarHBondContact CA-O 3.42Å; L527-W537 WeakPolarHBondContact CB-O 3.32Å; E528-W537 HydrophobicContact CB-CB 3.92Å; E528-W537 HydrophobicContact CB-CE3 4.32Å; E528-W537 PolarHBondContact N-O 2.81Å; E528-W537 PolarHBondContact O-N 2.83Å; W537-M539 HydrophobicContact CH2-CB 4.14Å; W537-M539 HydrophobicContact CZ2-CB 3.46Å; W537-M539 VanDerWaalsContact CZ2-CB 3.46Å; W537-M539 HydrophobicContact CZ2-CG 3.96Å; W537-P558 HydrophobicContact CH2-CG 4.37Å; W537-S559 WeakPolarHBondContact CZ2-O 3.37Å; W537-Y560 HydrophobicContact CD2-CD2 4.32Å; W537-Y560 HydrophobicContact CD2-CE2 4.46Å; W537-Y560 HydrophobicContact CE3-CD2 4.01Å; W537-Y560 HydrophobicContact CE3-CE2 4.16Å; W537-Y560 HydrophobicContact CH2-CD2 4.1Å; W537-Y560 HydrophobicContact CZ2-CD2 4.38Å; W537-Y560 AromaticContact CZ3-CD2 3.91Å; W537-Y560 HydrophobicContact CZ3-CD2 3.91Å; W537-Y560 HydrophobicContact CZ3-CE2 4.46Å; W537-R561 HydrophobicContact CB-CG 4.42Å; W537-R561 HydrophobicContact CD2-CG 4.48Å; W537-R561 HydrophobicContact CG-CB 4.22Å; W537-R561 HydrophobicContact CG-CG 4.07Å; W537-V571 HydrophobicContact CE3-CG1 4.23Å; W537-V571 HydrophobicContact CZ3-CB 4.43Å; W537-V571 HydrophobicContact CZ3-CG1 4.03Å; W537-F590 AromaticContact CH2-CE2 3.62Å; W537-F590 HydrophobicContact CH2-CE2 3.62Å; W537-F590 HydrophobicContact CH2-CZ 4.01Å; W537-F590 AromaticContact CZ3-CE2 3.77Å; W537-F590 HydrophobicContact CZ3-CE2 3.77Å
538	E	96.4	Very high	93	Very high	79 Å²	79	77 Å²	77	37%	0.369	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.9	132.7	167.1	-171.9	170.9	-141.5	0	0	107.2	I525 F526 L527 Q535 Y574	I525-E538 HydrophobicContact CG2-CG 3.34Å; I525-E538 WeakPolarHBondContact CG2-OE1 3.31Å; F526-E538 CarbonylContact O-C 3.54Å; F526-E538 VanDerWaalsContact O-CA 3.31Å; F526-E538 WeakPolarHBondContact O-CA 3.35Å; L527-E538 HydrophobicContact CB-CB 4.4Å; L527-E538 HydrophobicContact CB-CG 4.38Å; Q535-E538 HydrophobicContact CG-CB 4.26Å; Q535-E538 VanDerWaalsContact NE2-CB 3.32Å; Q535-E538 PolarHBondContact NE2-OE2 3.23Å; E538-Y574 PolarHBondContact OE1-OH 2.71Å
539	M	97.5	Very high	92.9	Very high	74 Å²	74	81 Å²	81	37%	0.365	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	131.9	-173.9	-170	66.2	124	0	0	110	I525 F526 W537 P558	I525-M539 WeakPolarHBondContact CA-O 3.47Å; F526-M539 PolarHBondContact N-O 3.48Å; F526-M539 PolarHBondContact O-N 2.93Å; W537-M539 HydrophobicContact CH2-CB 4.14Å; W537-M539 HydrophobicContact CZ2-CB 3.46Å; W537-M539 VanDerWaalsContact CZ2-CB 3.46Å; W537-M539 HydrophobicContact CZ2-CG 3.96Å; M539-P558 HydrophobicContact CB-CG 4.31Å; M539-P558 HydrophobicContact CG-CB 3.58Å; M539-P558 HydrophobicContact CG-CG 3.89Å
540	E	97.6	Very high	92.8	Very high	97 Å²	97	80 Å²	80	45%	0.453	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.2	128.3	173.5	-175	169.5	149.5	0	0	110	K523 I525	K523-E540 HydrophobicContact CB-CG 4.43Å; K523-E540 WeakPolarHBondContact CD-OE2 3.34Å; K523-E540 WeakPolarHBondContact CG-OE1 3.15Å; K523-E540 IonicContact NZ-OE1 3.72Å; K523-E540 PolarHBondContact NZ-OE1 3.18Å; K523-E540 IonicContact NZ-OE2 3.86Å; K523-E540 PolarHBondContact NZ-OE2 3.3Å; I525-E540 HydrophobicContact CD1-CB 3.8Å; I525-E540 HydrophobicContact CD1-CG 3.83Å
541	A	97.7	Very high	93	Very high	1 Å²	1	81.4 Å²	81.4	1%	0.008	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	144	175	0	0	0	0	0	110.9	V524 F526 V543 V555 E556 P558	V524-A541 HydrophobicContact CB-CB 4.21Å; V524-A541 WeakPolarHBondContact O-CB 3.37Å; V524-A541 PolarHBondContact O-N 2.79Å; F526-A541 HydrophobicContact CD2-CB 3.91Å; F526-A541 HydrophobicContact CE2-CB 3.8Å; A541-V543 PolarHBondContact O-N 3.43Å; A541-V555 HydrophobicContact CB-CG1 3.5Å; A541-E556 WeakPolarHBondContact CB-O 3.35Å; A541-P558 HydrophobicContact CB-CG 4.37Å
542	T	97.5	Very high	93.6	Very high	85 Å²	85	75.2 Å²	75.2	52%	0.521	39%	0.394	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.2	120.4	176.5	-37.2	0	0	0	0	109.4	V555 E556	T542-V555 CarbonylContact O-C 3.59Å; T542-V555 WeakPolarHBondContact O-CA 3.2Å; T542-E556 VanDerWaalsContact CB-OE2 3.28Å; T542-E556 WeakPolarHBondContact CB-OE2 3.22Å; T542-E556 PolarHBondContact N-O 3.3Å; T542-E556 PolarHBondContact O-N 3.37Å; T542-E556 PolarHBondContact OG1-OE2 3.07Å
543	V	97.6	Very high	94.1	Very high	19 Å²	19	70.9 Å²	70.9	12%	0.115	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	122.1	173.4	-177.4	0	0	0	0	109.1	V524 A541 K545 L553 F554	V524-V543 HydrophobicContact CB-CG2 4.43Å; V524-V543 HydrophobicContact CG2-CG2 3.95Å; A541-V543 PolarHBondContact O-N 3.43Å; V543-K545 WeakPolarHBondContact O-CG 3.1Å; V543-K545 PolarHBondContact O-N 3.03Å; V543-L553 HydrophobicContact CG1-CD2 4.18Å; V543-F554 WeakPolarHBondContact CA-O 3.32Å
544	D	96	Very high	94.8	Very high	43 Å²	43	70.9 Å²	70.9	23%	0.23	36%	0.361	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	94.1	172.1	-178.1	-31.2	0	0	0	108.8	D546 K547 S548 F554	D544-D546 VanDerWaalsContact C-N 3.3Å; D544-D546 PolarHBondContact O-N 3.21Å; D544-D546 PolarHBondContact OD1-N 3.13Å; D544-K547 WeakPolarHBondContact OD1-CG 3.47Å; D544-K547 PolarHBondContact OD1-N 2.83Å; D544-K547 IonicContact OD1-NZ 3.89Å; D544-K547 WeakPolarHBondContact OD2-CD 3.42Å; D544-K547 WeakPolarHBondContact OD2-CE 3.42Å; D544-K547 IonicContact OD2-NZ 2.66Å; D544-K547 PolarHBondContact OD2-NZ 3.4Å; D544-S548 VanDerWaalsContact O-CB 3.25Å; D544-S548 WeakPolarHBondContact O-CB 3.33Å; D544-S548 PolarHBondContact O-N 2.92Å; D544-S548 VanDerWaalsContact O-N 3.09Å; D544-S548 PolarHBondContact O-OG 3.02Å; D544-F554 HydrophobicContact CB-CB 3.93Å; D544-F554 PolarHBondContact N-O 3.21Å
545	K	94	Very high	95.3	Very high	118 Å²	118	64.9 Å²	64.9	51%	0.513	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	-25	-172	-60	-168	175.2	-154.3	0	113.6	S520 V543	S520-K545 PolarHBondContact O-NZ 2.88Å; V543-K545 WeakPolarHBondContact O-CG 3.1Å; V543-K545 PolarHBondContact O-N 3.03Å
546	D	93.2	Very high	95.6	Very high	159 Å²	159	64.5 Å²	64.5	85%	0.85	33%	0.331	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.8	-29.6	-175.9	-59.5	-36.1	0	0	0	111.4	D544	D544-D546 VanDerWaalsContact C-N 3.3Å; D544-D546 PolarHBondContact O-N 3.21Å; D544-D546 PolarHBondContact OD1-N 3.13Å
547	K	92.9	Very high	95.9	Very high	113 Å²	113	61.1 Å²	61.1	49%	0.491	31%	0.313	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	-27.2	169.4	-63.4	-177.4	-170.7	64.7	0	113.3	D544 F554	D544-K547 WeakPolarHBondContact OD1-CG 3.47Å; D544-K547 PolarHBondContact OD1-N 2.83Å; D544-K547 IonicContact OD1-NZ 3.89Å; D544-K547 WeakPolarHBondContact OD2-CD 3.42Å; D544-K547 WeakPolarHBondContact OD2-CE 3.42Å; D544-K547 IonicContact OD2-NZ 2.66Å; D544-K547 PolarHBondContact OD2-NZ 3.4Å; K547-F554 HydrophobicContact CB-CB 4.36Å; K547-F554 HydrophobicContact CB-CD2 3.54Å; K547-F554 HydrophobicContact CB-CE2 3.9Å; K547-F554 HydrophobicContact CB-CG 3.9Å; K547-F554 HydrophobicContact CD-CD1 4.47Å; K547-F554 WeakPolarHBondContact O-CE2 3.17Å
548	S	94.1	Very high	96	Very high	20 Å²	20	60.7 Å²	60.7	14%	0.14	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.9	149.5	-174.2	-69	0	0	0	0	114.2	D544 M552 F554	D544-S548 VanDerWaalsContact O-CB 3.25Å; D544-S548 WeakPolarHBondContact O-CB 3.33Å; D544-S548 PolarHBondContact O-N 2.92Å; D544-S548 VanDerWaalsContact O-N 3.09Å; D544-S548 PolarHBondContact O-OG 3.02Å; S548-M552 CarbonylContact C-O 3.55Å; S548-M552 WeakPolarHBondContact CA-O 3.1Å; S548-F554 PolarHBondContact OG-N 3.04Å
549	Q	93.8	Very high	96	Very high	108 Å²	108	59.6 Å²	59.6	51%	0.505	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	162	-174.9	-61.9	-59.5	-41.4	0	0	110.5	S551 M552	Q549-S551 PolarHBondContact O-N 2.93Å; Q549-M552 HydrophobicContact CB-CB 4.35Å; Q549-M552 PolarHBondContact N-O 2.79Å; Q549-M552 CarbonylContact O-C 3.54Å; Q549-M552 PolarHBondContact O-N 2.83Å; Q549-M552 VanDerWaalsContact O-O 3.06Å
550	P	90	Very high	96	Very high	87 Å²	87	56.6 Å²	56.6	57%	0.565	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.3	-11.7	179.8	-26.2	36.1	0	0	0	116.3	N517 F518	N517-P550 PolarHBondContact N-O 3.12Å; F518-P550 PolarHBondContact N-O 2.88Å; F518-P550 WeakPolarHBondContact O-CA 3.31Å
551	S	93.2	Very high	95.8	Very high	66 Å²	66	57.9 Å²	57.9	46%	0.462	30%	0.3	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.4	2.7	175.8	55.5	0	0	0	0	114.7	T514 G515 Q549	T514-S551 WeakPolarHBondContact CA-O 3.49Å; G515-S551 PolarHBondContact N-O 2.85Å; G515-S551 WeakPolarHBondContact O-CA 3.36Å; G515-S551 WeakPolarHBondContact O-CB 3.18Å; Q549-S551 PolarHBondContact O-N 2.93Å
552	M	96.8	Very high	95.5	Very high	64 Å²	64	60.8 Å²	60.8	32%	0.315	32%	0.315	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	119.6	-179.4	-173.1	172.1	-74.6	0	0	112.1	I512 L513 S548 Q549 F554	I512-M552 HydrophobicContact CG2-CE 4.19Å; I512-M552 HydrophobicContact CG2-CG 3.53Å; I512-M552 HydrophobicContact CG2-SD 3.75Å; L513-M552 CarbonylContact O-C 3.6Å; L513-M552 VanDerWaalsContact O-CA 3.26Å; L513-M552 WeakPolarHBondContact O-CA 3.42Å; S548-M552 CarbonylContact C-O 3.55Å; S548-M552 WeakPolarHBondContact CA-O 3.1Å; Q549-M552 HydrophobicContact CB-CB 4.35Å; Q549-M552 PolarHBondContact N-O 2.79Å; Q549-M552 CarbonylContact O-C 3.54Å; Q549-M552 PolarHBondContact O-N 2.83Å; Q549-M552 VanDerWaalsContact O-O 3.06Å; M552-F554 HydrophobicContact CG-CE2 3.98Å; M552-F554 HydrophobicContact CG-CZ 4.45Å; M552-F554 HydrophobicContact SD-CE2 3.89Å; M552-F554 HydrophobicContact SD-CZ 3.88Å
553	L	97.9	Very high	95.3	Very high	2 Å²	2	60.4 Å²	60.4	1%	0.01	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	138.5	170.9	-62.7	179.8	0	0	0	111	I512 L513 F518 V524 V543 V555 V575	I512-L553 WeakPolarHBondContact CA-O 3.43Å; L513-L553 HydrophobicContact CB-CB 4.31Å; L513-L553 PolarHBondContact N-O 3.16Å; L513-L553 PolarHBondContact O-N 2.71Å; F518-L553 HydrophobicContact CB-CD1 4.48Å; F518-L553 HydrophobicContact CB-CD2 3.89Å; F518-L553 HydrophobicContact CB-CG 4.09Å; F518-L553 HydrophobicContact CD1-CD1 4.06Å; F518-L553 HydrophobicContact CD1-CG 4.27Å; F518-L553 HydrophobicContact CD2-CD1 4.36Å; F518-L553 HydrophobicContact CD2-CD2 4.29Å; F518-L553 HydrophobicContact CD2-CG 3.7Å; F518-L553 HydrophobicContact CE1-CD1 4.39Å; F518-L553 HydrophobicContact CE2-CG 4.15Å; F518-L553 HydrophobicContact CG-CD1 4.06Å; F518-L553 HydrophobicContact CG-CD2 4.16Å; F518-L553 HydrophobicContact CG-CG 3.78Å; V524-L553 HydrophobicContact CG2-CD1 3.87Å; V543-L553 HydrophobicContact CG1-CD2 4.18Å; L553-V555 HydrophobicContact CB-CG2 3.95Å; L553-V575 HydrophobicContact CD1-CG1 3.79Å; L553-V575 HydrophobicContact CD1-CG2 4.28Å
554	F	97.6	Very high	95	Very high	36 Å²	36	63.8 Å²	63.8	16%	0.158	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	120.6	168.9	-70.4	-97.2	0	0	0	108.5	I512 V543 D544 K547 S548 M552	I512-F554 HydrophobicContact CD1-CD1 4.15Å; I512-F554 HydrophobicContact CD1-CE1 3.63Å; I512-F554 HydrophobicContact CD1-CZ 4.35Å; I512-F554 HydrophobicContact CG1-CD1 3.88Å; I512-F554 HydrophobicContact CG1-CE1 3.85Å; V543-F554 WeakPolarHBondContact CA-O 3.32Å; D544-F554 HydrophobicContact CB-CB 3.93Å; D544-F554 PolarHBondContact N-O 3.21Å; K547-F554 HydrophobicContact CB-CB 4.36Å; K547-F554 HydrophobicContact CB-CD2 3.54Å; K547-F554 HydrophobicContact CB-CE2 3.9Å; K547-F554 HydrophobicContact CB-CG 3.9Å; K547-F554 HydrophobicContact CD-CD1 4.47Å; K547-F554 WeakPolarHBondContact O-CE2 3.17Å; S548-F554 PolarHBondContact OG-N 3.04Å; M552-F554 HydrophobicContact CG-CE2 3.98Å; M552-F554 HydrophobicContact CG-CZ 4.45Å; M552-F554 HydrophobicContact SD-CE2 3.89Å; M552-F554 HydrophobicContact SD-CZ 3.88Å
555	V	98	Very high	94.9	Very high	0 Å²	0	62.7 Å²	62.7	0%	0	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	126.1	-165.2	-172.1	0	0	0	0	110	Q510 M511 L513 V524 A541 T542 L553	Q510-V555 CarbonylContact C-O 3.52Å; Q510-V555 WeakPolarHBondContact CA-O 3.27Å; M511-V555 HydrophobicContact CE-CB 4.15Å; M511-V555 HydrophobicContact CE-CG1 4.11Å; M511-V555 PolarHBondContact N-O 2.86Å; M511-V555 PolarHBondContact O-N 2.65Å; L513-V555 HydrophobicContact CD1-CG2 4Å; L513-V555 HydrophobicContact CG-CG2 4.11Å; V524-V555 HydrophobicContact CB-CG1 4.06Å; V524-V555 HydrophobicContact CB-CG2 4.49Å; V524-V555 HydrophobicContact CG1-CG1 4.23Å; V524-V555 HydrophobicContact CG2-CG1 4.27Å; V524-V555 HydrophobicContact CG2-CG2 3.82Å; A541-V555 HydrophobicContact CB-CG1 3.5Å; T542-V555 CarbonylContact O-C 3.59Å; T542-V555 WeakPolarHBondContact O-CA 3.2Å; L553-V555 HydrophobicContact CB-CG2 3.95Å
556	E	98.2	Very high	94.8	Very high	88 Å²	88	62.8 Å²	62.8	41%	0.411	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.4	117.6	167.7	-170.7	-174	-172.4	0	0	108.9	A541 T542	A541-E556 WeakPolarHBondContact CB-O 3.35Å; T542-E556 VanDerWaalsContact CB-OE2 3.28Å; T542-E556 WeakPolarHBondContact CB-OE2 3.22Å; T542-E556 PolarHBondContact N-O 3.3Å; T542-E556 PolarHBondContact O-N 3.37Å; T542-E556 PolarHBondContact OG1-OE2 3.07Å
557	V	98.2	Very high	94.8	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	34%	0.339	C	S	.	.	P	Polyproline II helix	trans	-67.7	126.9	-179.9	-179.4	0	0	0	0	109.4	M500 G507 G508 Q509 M511 F526 F588 F590	M500-V557 HydrophobicContact CE-CG2 3.64Å; G507-V557 CarbonylContact C-O 3.47Å; G507-V557 WeakPolarHBondContact CA-O 3.18Å; G508-V557 PolarHBondContact N-O 2.95Å; Q509-V557 PolarHBondContact O-N 3.34Å; M511-V557 HydrophobicContact CB-CG2 3.96Å; M511-V557 HydrophobicContact CE-CG2 4.35Å; M511-V557 HydrophobicContact SD-CG2 4.46Å; F526-V557 HydrophobicContact CE1-CG1 3.96Å; F526-V557 HydrophobicContact CZ-CB 4.46Å; F526-V557 HydrophobicContact CZ-CG1 3.92Å; F526-V557 HydrophobicContact CZ-CG2 4.12Å; V557-F588 HydrophobicContact CG1-CE1 3.84Å; V557-F588 HydrophobicContact CG1-CZ 3.81Å; V557-F588 HydrophobicContact CG2-CE2 4.27Å; V557-F588 HydrophobicContact CG2-CZ 4.03Å; V557-F590 HydrophobicContact CG1-CE1 3.83Å; V557-F590 HydrophobicContact CG1-CZ 3.79Å
558	P	97.8	Very high	95	Very high	16 Å²	16	60.9 Å²	60.9	10%	0.104	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-71.5	158.5	-176.9	29.9	-35.5	0	0	0	111.6	F526 W537 M539 A541 F590	F526-P558 HydrophobicContact CB-CG 4.21Å; F526-P558 HydrophobicContact CD2-CG 3.9Å; F526-P558 HydrophobicContact CE2-CG 4.49Å; F526-P558 HydrophobicContact CG-CG 4.05Å; W537-P558 HydrophobicContact CH2-CG 4.37Å; M539-P558 HydrophobicContact CB-CG 4.31Å; M539-P558 HydrophobicContact CG-CB 3.58Å; M539-P558 HydrophobicContact CG-CG 3.89Å; A541-P558 HydrophobicContact CB-CG 4.37Å; P558-F590 WeakPolarHBondContact O-CE1 3.41Å; P558-F590 VanDerWaalsContact O-CZ 3.26Å; P558-F590 WeakPolarHBondContact O-CZ 3.03Å
559	S	96.5	Very high	95.1	Very high	56 Å²	56	61.4 Å²	61.4	39%	0.392	34%	0.343	S	S	.	.	P	Polyproline II helix	trans	-61.6	138	167.9	54.6	0	0	0	0	111	L506 W537	L506-S559 WeakPolarHBondContact O-CA 3.32Å; L506-S559 VanDerWaalsContact O-CB 3.31Å; L506-S559 WeakPolarHBondContact O-CB 3.47Å; W537-S559 WeakPolarHBondContact CZ2-O 3.37Å
560	Y	96.9	Very high	95.2	Very high	11 Å²	11	64.3 Å²	64.3	4%	0.043	35%	0.354	C	S	.	.	P	Polyproline II helix	trans	-74.6	153.4	174.5	178.6	-113.6	0	0	0	110.7	V505 E528 W537 D562 I565 V569 V571 F590	V505-Y560 HydrophobicContact CG1-CD1 3.9Å; V505-Y560 PolarHBondContact O-N 3.06Å; E528-Y560 WeakPolarHBondContact OE2-CE2 3.48Å; E528-Y560 PolarHBondContact OE2-OH 2.97Å; W537-Y560 HydrophobicContact CD2-CD2 4.32Å; W537-Y560 HydrophobicContact CD2-CE2 4.46Å; W537-Y560 HydrophobicContact CE3-CD2 4.01Å; W537-Y560 HydrophobicContact CE3-CE2 4.16Å; W537-Y560 HydrophobicContact CH2-CD2 4.1Å; W537-Y560 HydrophobicContact CZ2-CD2 4.38Å; W537-Y560 AromaticContact CZ3-CD2 3.91Å; W537-Y560 HydrophobicContact CZ3-CD2 3.91Å; W537-Y560 HydrophobicContact CZ3-CE2 4.46Å; Y560-D562 HydrophobicContact CD1-CB 4.37Å; Y560-D562 VanDerWaalsContact CD1-O 3.22Å; Y560-D562 WeakPolarHBondContact CD1-O 3.46Å; Y560-D562 HydrophobicContact CE1-CB 3.93Å; Y560-D562 PolarHBondContact O-N 2.87Å; Y560-D562 VanDerWaalsContact O-N 3.12Å; Y560-I565 HydrophobicContact CD1-CD1 4.43Å; Y560-I565 HydrophobicContact CD1-CG2 4.34Å; Y560-I565 HydrophobicContact CE1-CD1 4.5Å; Y560-I565 HydrophobicContact CE1-CG2 3.77Å; Y560-V569 HydrophobicContact CE1-CB 4.43Å; Y560-V569 HydrophobicContact CE1-CG2 4.26Å; Y560-V569 HydrophobicContact CE2-CG1 4.12Å; Y560-V571 HydrophobicContact CD2-CG1 4.43Å; Y560-V571 HydrophobicContact CE2-CG1 4.23Å; Y560-F590 AromaticContact CD2-CD2 3.73Å; Y560-F590 HydrophobicContact CD2-CD2 3.73Å; Y560-F590 HydrophobicContact CD2-CE2 4.11Å; Y560-F590 HydrophobicContact CD2-CG 4.33Å; Y560-F590 HydrophobicContact CG-CB 4.24Å; Y560-F590 AromaticContact CG-CD2 3.89Å; Y560-F590 HydrophobicContact CG-CD2 3.89Å; Y560-F590 HydrophobicContact CG-CE2 4.41Å; Y560-F590 HydrophobicContact CG-CG 4.02Å
561	R	94.2	Very high	95.5	Very high	123 Å²	123	60.3 Å²	60.3	46%	0.464	33%	0.327	S	S	.	.	S	Bend	trans	-61.2	-21.7	-172.8	53.6	164.4	176.3	149.6	10.4	115.6	E528 W537	E528-R561 IonicContact OE1-CZ 2.79Å; E528-R561 IonicContact OE1-NH2 3.29Å; E528-R561 PolarHBondContact OE1-NH2 2.84Å; E528-R561 IonicContact OE2-CZ 3.24Å; E528-R561 IonicContact OE2-NE 2.71Å; E528-R561 PolarHBondContact OE2-NE 3.36Å; E528-R561 IonicContact OE2-NH2 2.73Å; E528-R561 PolarHBondContact OE2-NH2 3.36Å; W537-R561 HydrophobicContact CB-CG 4.42Å; W537-R561 HydrophobicContact CD2-CG 4.48Å; W537-R561 HydrophobicContact CG-CB 4.22Å; W537-R561 HydrophobicContact CG-CG 4.07Å
562	D	92.3	Very high	95.7	Very high	62 Å²	62	59.4 Å²	59.4	33%	0.332	32%	0.317	S	S	.	.			trans	-132.3	111.3	-179.3	176	10.9	0	0	0	109.4	Y560 S564 I565	Y560-D562 HydrophobicContact CD1-CB 4.37Å; Y560-D562 VanDerWaalsContact CD1-O 3.22Å; Y560-D562 WeakPolarHBondContact CD1-O 3.46Å; Y560-D562 HydrophobicContact CE1-CB 3.93Å; Y560-D562 PolarHBondContact O-N 2.87Å; Y560-D562 VanDerWaalsContact O-N 3.12Å; D562-S564 VanDerWaalsContact C-N 3.26Å; D562-S564 PolarHBondContact O-N 3.39Å; D562-S564 WeakPolarHBondContact OD1-CA 3.31Å; D562-S564 WeakPolarHBondContact OD1-CB 3.46Å; D562-S564 PolarHBondContact OD1-N 3.03Å; D562-S564 PolarHBondContact OD1-OG 3.38Å; D562-I565 HydrophobicContact CB-CG2 4.07Å; D562-I565 WeakPolarHBondContact OD2-CG2 3.2Å
563	T	91.8	Very high	95.7	Very high	78 Å²	78	56.3 Å²	56.3	48%	0.479	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-1.6	178.1	51.8	0	0	0	0	113.5	V505 L506	V505-T563 HydrophobicContact CG2-CG2 4.48Å; L506-T563 HydrophobicContact CD2-CG2 4.09Å
564	S	91.9	Very high	95.7	Very high	89 Å²	89	56.8 Å²	56.8	62%	0.622	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.7	8.6	-175.9	72.1	0	0	0	0	114.9	D562 C566	D562-S564 VanDerWaalsContact C-N 3.26Å; D562-S564 PolarHBondContact O-N 3.39Å; D562-S564 WeakPolarHBondContact OD1-CA 3.31Å; D562-S564 WeakPolarHBondContact OD1-CB 3.46Å; D562-S564 PolarHBondContact OD1-N 3.03Å; D562-S564 PolarHBondContact OD1-OG 3.38Å; S564-C566 PolarHBondContact O-N 3.34Å
565	I	93.8	Very high	95.7	Very high	20 Å²	20	55 Å²	55	10%	0.103	30%	0.296	C	S	.	.			trans	-56.3	139.6	178.4	71.1	-175.5	0	0	0	111.9	V505 Y560 D562 Q567 V569 P592	V505-I565 HydrophobicContact CG1-CD1 3.24Å; V505-I565 HydrophobicContact CG1-CG1 3.63Å; Y560-I565 HydrophobicContact CD1-CD1 4.43Å; Y560-I565 HydrophobicContact CD1-CG2 4.34Å; Y560-I565 HydrophobicContact CE1-CD1 4.5Å; Y560-I565 HydrophobicContact CE1-CG2 3.77Å; D562-I565 HydrophobicContact CB-CG2 4.07Å; D562-I565 WeakPolarHBondContact OD2-CG2 3.2Å; I565-Q567 WeakPolarHBondContact CD1-O 3.38Å; I565-V569 HydrophobicContact CD1-CB 4.34Å; I565-V569 HydrophobicContact CD1-CG2 3.94Å; I565-V569 HydrophobicContact CG2-CG2 4.16Å; I565-P592 HydrophobicContact CG1-CB 4.18Å; I565-P592 WeakPolarHBondContact O-CB 3.35Å
566	C	92	Very high	95.5	Very high	121 Å²	121	55.6 Å²	55.6	82%	0.818	30%	0.299	S	S	*	.	S	Bend	trans	-97.4	-5.7	174.8	-60.3	0	0	0	0	113.5	S564	S564-C566 PolarHBondContact O-N 3.34Å
567	Q	93.6	Very high	95.1	Very high	151 Å²	151	52.1 Å²	52.1	71%	0.706	28%	0.283	S	S	*	.	S	Bend	trans	-140.4	151	-178	-65.3	-173.4	1.6	0	0	110.3	I565 V569	I565-Q567 WeakPolarHBondContact CD1-O 3.38Å; Q567-V569 PolarHBondContact O-N 2.93Å
568	P	96.1	Very high	94.5	Very high	81 Å²	81	54 Å²	54	53%	0.526	30%	0.303	S	S	.	.	P	Polyproline II helix	trans	-64.8	127.6	179.8	-20.5	32.6	0	0	0	113.1	T589 F590 T591	P568-T589 HydrophobicContact CB-CG2 3.66Å; P568-F590 CarbonylContact C-O 3.53Å; P568-F590 WeakPolarHBondContact CA-O 3.38Å; P568-T591 HydrophobicContact CB-CG2 4.44Å
569	V	96.1	Very high	93.6	Very high	30 Å²	30	62.7 Å²	62.7	18%	0.182	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	125.8	178.4	174.2	0	0	0	0	110.1	Y560 I565 Q567 V571 T589 F590	Y560-V569 HydrophobicContact CE1-CB 4.43Å; Y560-V569 HydrophobicContact CE1-CG2 4.26Å; Y560-V569 HydrophobicContact CE2-CG1 4.12Å; I565-V569 HydrophobicContact CD1-CB 4.34Å; I565-V569 HydrophobicContact CD1-CG2 3.94Å; I565-V569 HydrophobicContact CG2-CG2 4.16Å; Q567-V569 PolarHBondContact O-N 2.93Å; V569-V571 HydrophobicContact CG1-CG1 4.13Å; V569-T589 CarbonylContact O-C 3.51Å; V569-T589 WeakPolarHBondContact O-CA 3.45Å; V569-F590 PolarHBondContact N-O 3.5Å; V569-F590 PolarHBondContact O-N 3.14Å
570	K	96.1	Very high	92.7	Very high	170 Å²	170	70.9 Å²	70.9	74%	0.739	36%	0.362	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.8	123.5	174.8	-66.3	-176.5	179.7	-178.9	0	110.3	T589	K570-T589 HydrophobicContact CG-CG2 4.22Å
571	V	96.9	Very high	92.3	Very high	2 Å²	2	74.2 Å²	74.2	1%	0.012	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.2	173.4	176	-60.2	0	0	0	0	109.7	F526 L527 E528 W537 Y560 V569 F588 F590	F526-V571 HydrophobicContact CD1-CG2 4.17Å; L527-V571 WeakPolarHBondContact O-CB 3.47Å; E528-V571 HydrophobicContact CB-CG1 4.25Å; E528-V571 HydrophobicContact CG-CG1 4.38Å; W537-V571 HydrophobicContact CE3-CG1 4.23Å; W537-V571 HydrophobicContact CZ3-CB 4.43Å; W537-V571 HydrophobicContact CZ3-CG1 4.03Å; Y560-V571 HydrophobicContact CD2-CG1 4.43Å; Y560-V571 HydrophobicContact CE2-CG1 4.23Å; V569-V571 HydrophobicContact CG1-CG1 4.13Å; V571-F588 HydrophobicContact CG2-CB 4.03Å; V571-F588 HydrophobicContact CG2-CD1 4.21Å; V571-F588 WeakPolarHBondContact CG2-O 3.39Å; V571-F588 PolarHBondContact N-O 3.29Å; V571-F588 PolarHBondContact O-N 2.68Å; V571-F588 VanDerWaalsContact O-O 3.06Å; V571-F590 HydrophobicContact CG1-CD2 4.05Å; V571-F590 HydrophobicContact CG1-CE2 4.4Å; V571-F590 HydrophobicContact CG2-CD2 3.85Å; V571-F590 HydrophobicContact CG2-CE2 3.81Å
572	N	97.1	Very high	92.1	Very high	47 Å²	47	73.7 Å²	73.7	25%	0.251	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	157.4	170.1	-58.5	-89.9	0	0	0	109.4	F526 L527 P585 Q586 H587	F526-N572 CarbonylContact C-O 3.59Å; F526-N572 WeakPolarHBondContact CA-O 3.46Å; L527-N572 HydrophobicContact CG-CB 4.48Å; L527-N572 PolarHBondContact N-O 3.06Å; L527-N572 PolarHBondContact O-N 2.74Å; N572-P585 HydrophobicContact CB-CB 4.32Å; N572-Q586 CarbonylContact C-O 3.54Å; N572-Q586 WeakPolarHBondContact CA-O 3.12Å; N572-Q586 WeakPolarHBondContact CB-O 3.34Å; N572-H587 PolarHBondContact OD1-CE1 3.02Å; N572-H587 PolarHBondContact OD1-ND1 2.98Å
573	F	97.8	Very high	92.1	Very high	0 Å²	0	71.4 Å²	71.4	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	156.9	164.8	71.3	-93.9	0	0	0	112	Q498 M511 L513 V524 I525 F526 P585 Q586 F588	Q498-F573 HydrophobicContact CB-CZ 4.49Å; M511-F573 HydrophobicContact CE-CE1 4.37Å; M511-F573 HydrophobicContact CE-CE2 4.35Å; M511-F573 HydrophobicContact CE-CZ 4.12Å; M511-F573 HydrophobicContact SD-CE1 4.26Å; M511-F573 HydrophobicContact SD-CZ 4.17Å; L513-F573 HydrophobicContact CD1-CD2 4.43Å; L513-F573 HydrophobicContact CD1-CE2 3.72Å; L513-F573 HydrophobicContact CD1-CZ 4.5Å; L513-F573 HydrophobicContact CD2-CE2 3.66Å; L513-F573 HydrophobicContact CD2-CZ 3.61Å; L513-F573 HydrophobicContact CG-CE2 4.36Å; V524-F573 HydrophobicContact CG1-CD2 3.77Å; V524-F573 HydrophobicContact CG1-CE2 4.43Å; V524-F573 HydrophobicContact CG1-CG 4.43Å; I525-F573 CarbonylContact O-C 3.53Å; I525-F573 WeakPolarHBondContact O-CA 3.38Å; I525-F573 WeakPolarHBondContact O-CB 3.47Å; F526-F573 HydrophobicContact CB-CB 4.49Å; F526-F573 HydrophobicContact CD1-CB 4.01Å; F526-F573 HydrophobicContact CD2-CB 3.98Å; F526-F573 HydrophobicContact CE1-CB 4.19Å; F526-F573 AromaticContact CE1-CD1 3.98Å; F526-F573 HydrophobicContact CE1-CD1 3.98Å; F526-F573 HydrophobicContact CE1-CG 4.34Å; F526-F573 HydrophobicContact CE2-CB 4.16Å; F526-F573 HydrophobicContact CE2-CG 4.39Å; F526-F573 HydrophobicContact CG-CB 3.9Å; F526-F573 HydrophobicContact CZ-CB 4.26Å; F526-F573 HydrophobicContact CZ-CD1 4.08Å; F526-F573 HydrophobicContact CZ-CG 4.21Å; F573-P585 CarbonylContact O-C 3.51Å; F573-P585 WeakPolarHBondContact O-CA 3.37Å; F573-Q586 HydrophobicContact CD1-CB 3.96Å; F573-Q586 HydrophobicContact CD2-CB 4.09Å; F573-Q586 HydrophobicContact CD2-CG 4.4Å; F573-Q586 HydrophobicContact CE1-CB 3.55Å; F573-Q586 HydrophobicContact CE1-CG 4.44Å; F573-Q586 HydrophobicContact CE2-CB 3.68Å; F573-Q586 HydrophobicContact CE2-CG 3.76Å; F573-Q586 HydrophobicContact CG-CB 4.22Å; F573-Q586 HydrophobicContact CZ-CB 3.39Å; F573-Q586 HydrophobicContact CZ-CG 3.79Å; F573-Q586 PolarHBondContact N-O 2.92Å; F573-Q586 PolarHBondContact O-N 3.29Å; F573-F588 HydrophobicContact CD1-CB 3.94Å; F573-F588 HydrophobicContact CE1-CB 4.18Å; F573-F588 HydrophobicContact CE1-CD2 4.43Å
574	Y	96.9	Very high	91.9	Very high	11 Å²	11	74 Å²	74	4%	0.043	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	151.2	170.8	63.4	-99.6	0	0	0	110.8	I525 L527 E538 I576 R582 S583	I525-Y574 HydrophobicContact CB-CD2 4.28Å; I525-Y574 HydrophobicContact CB-CE1 4.07Å; I525-Y574 HydrophobicContact CB-CE2 3.77Å; I525-Y574 HydrophobicContact CG1-CD2 4.41Å; I525-Y574 HydrophobicContact CG1-CE2 3.7Å; I525-Y574 HydrophobicContact CG2-CE1 4.1Å; I525-Y574 HydrophobicContact CG2-CE2 4.42Å; I525-Y574 PolarHBondContact N-O 3.33Å; I525-Y574 PolarHBondContact O-N 2.78Å; L527-Y574 HydrophobicContact CD2-CD1 3.54Å; L527-Y574 HydrophobicContact CD2-CE1 3.31Å; E538-Y574 PolarHBondContact OE1-OH 2.71Å; Y574-I576 HydrophobicContact CD2-CB 4.01Å; Y574-I576 HydrophobicContact CD2-CG2 4.45Å; Y574-I576 HydrophobicContact CE2-CB 3.8Å; Y574-I576 HydrophobicContact CE2-CD1 4.3Å; Y574-I576 HydrophobicContact CE2-CG2 3.96Å; Y574-R582 HydrophobicContact CD2-CB 4.02Å; Y574-R582 HydrophobicContact CD2-CG 3.8Å; Y574-R582 HydrophobicContact CE2-CB 4.44Å; Y574-R582 HydrophobicContact CE2-CG 3.71Å; Y574-R582 VanDerWaalsContact CZ-CZ 3.43Å; Y574-R582 PolarHBondContact OH-NH1 3.44Å; Y574-R582 PolarHBondContact OH-NH2 3.48Å; Y574-S583 WeakPolarHBondContact CA-OG 3.45Å
575	V	96.9	Very high	92	Very high	0 Å²	0	73.8 Å²	73.8	0%	0	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	140.4	167.1	-172.3	0	0	0	0	108.2	P493 V495 L513 F518 K523 V524 L553 R582 S583	P493-V575 HydrophobicContact CB-CB 3.92Å; P493-V575 HydrophobicContact CB-CG1 3.67Å; P493-V575 HydrophobicContact CG-CB 4.01Å; P493-V575 HydrophobicContact CG-CG1 3.94Å; P493-V575 WeakPolarHBondContact CG-O 3.44Å; V495-V575 HydrophobicContact CG2-CG2 3.51Å; L513-V575 HydrophobicContact CD1-CG2 3.9Å; F518-V575 HydrophobicContact CD1-CG1 3.98Å; F518-V575 HydrophobicContact CE1-CB 4.34Å; F518-V575 HydrophobicContact CE1-CG1 4.1Å; F518-V575 HydrophobicContact CE1-CG2 4.02Å; K523-V575 CarbonylContact O-C 3.53Å; K523-V575 WeakPolarHBondContact O-CA 3.29Å; V524-V575 HydrophobicContact CG2-CG2 4.19Å; L553-V575 HydrophobicContact CD1-CG1 3.79Å; L553-V575 HydrophobicContact CD1-CG2 4.28Å; V575-R582 CarbonylContact O-C 3.56Å; V575-R582 WeakPolarHBondContact O-CA 3.47Å; V575-S583 PolarHBondContact N-OG 2.87Å; V575-S583 PolarHBondContact O-N 2.76Å
576	I	94.4	Very high	92.1	Very high	11 Å²	11	74.9 Å²	74.9	6%	0.056	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	132.3	175.2	-170.9	178.1	0	0	0	111.9	S522 K523 I525 Y574 K581 R582	S522-I576 WeakPolarHBondContact CA-O 3.32Å; K523-I576 HydrophobicContact CB-CG2 3.83Å; K523-I576 PolarHBondContact N-O 2.85Å; K523-I576 PolarHBondContact O-N 2.61Å; I525-I576 HydrophobicContact CD1-CG2 4.49Å; I525-I576 HydrophobicContact CG1-CG2 3.85Å; Y574-I576 HydrophobicContact CD2-CB 4.01Å; Y574-I576 HydrophobicContact CD2-CG2 4.45Å; Y574-I576 HydrophobicContact CE2-CB 3.8Å; Y574-I576 HydrophobicContact CE2-CD1 4.3Å; Y574-I576 HydrophobicContact CE2-CG2 3.96Å; I576-K581 VanDerWaalsContact CA-O 3.31Å; I576-K581 WeakPolarHBondContact CA-O 3.14Å; I576-R582 HydrophobicContact CB-CG 4.1Å; I576-R582 HydrophobicContact CD1-CG 3.65Å; I576-R582 HydrophobicContact CG1-CG 3.74Å
577	N	91	Very high	92.4	Very high	15 Å²	15	75.9 Å²	75.9	8%	0.08	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	132.8	170.3	-55.2	-5.6	0	0	0	108.6	N517 S519 S522 K581	N517-N577 PolarHBondContact O-ND2 3.48Å; S519-N577 PolarHBondContact OG-ND2 2.92Å; S522-N577 PolarHBondContact OG-OD1 2.78Å; N577-K581 HydrophobicContact CB-CB 4.19Å; N577-K581 PolarHBondContact N-O 2.95Å; N577-K581 WeakPolarHBondContact O-CB 3.39Å; N577-K581 PolarHBondContact O-N 2.81Å
578	G	84.1	Confident	92.6	Very high	40 Å²	40	68.7 Å²	68.7	41%	0.412	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	50.5	-137.6	-169.5	0	0	0	0	0	113.2	D521	D521-G578 WeakPolarHBondContact OD2-CA 3.41Å; D521-G578 PolarHBondContact OD2-N 2.81Å
579	K	79	Confident	92.7	Very high	198 Å²	198	66.4 Å²	66.4	86%	0.861	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99	-9.4	-173.9	-63.3	-171.6	178.3	-174.9	0	115.7
580	R	78.4	Confident	92.7	Very high	229 Å²	229	65 Å²	65	86%	0.864	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-142.6	-15.3	-168.6	-66.3	-170.7	-179.8	-169.6	0.3	116.2	R582	R580-R582 PolarHBondContact O-N 2.92Å
581	K	88.2	Confident	92.8	Very high	81 Å²	81	59.1 Å²	59.1	35%	0.352	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	83.7	-175.5	-67.2	169.7	161.9	-172	0	110.1	E491 L492 P493 I576 N577	E491-K581 WeakPolarHBondContact O-CD 3.22Å; E491-K581 VanDerWaalsContact OE2-CE 3.29Å; E491-K581 WeakPolarHBondContact OE2-CE 3.42Å; E491-K581 IonicContact OE2-NZ 2.61Å; E491-K581 PolarHBondContact OE2-NZ 3.43Å; L492-K581 HydrophobicContact CD2-CB 3.75Å; L492-K581 HydrophobicContact CD2-CG 4.12Å; P493-K581 WeakPolarHBondContact CD-O 3.15Å; P493-K581 WeakPolarHBondContact CG-O 3.41Å; I576-K581 VanDerWaalsContact CA-O 3.31Å; I576-K581 WeakPolarHBondContact CA-O 3.14Å; N577-K581 HydrophobicContact CB-CB 4.19Å; N577-K581 PolarHBondContact N-O 2.95Å; N577-K581 WeakPolarHBondContact O-CB 3.39Å; N577-K581 PolarHBondContact O-N 2.81Å
582	R	90.6	Very high	92.7	Very high	112 Å²	112	60.6 Å²	60.6	42%	0.423	29%	0.294	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	147.8	-179.7	-62.1	-177.7	179.7	-161.5	-7	111.8	Y574 V575 I576 R580	Y574-R582 HydrophobicContact CD2-CB 4.02Å; Y574-R582 HydrophobicContact CD2-CG 3.8Å; Y574-R582 HydrophobicContact CE2-CB 4.44Å; Y574-R582 HydrophobicContact CE2-CG 3.71Å; Y574-R582 VanDerWaalsContact CZ-CZ 3.43Å; Y574-R582 PolarHBondContact OH-NH1 3.44Å; Y574-R582 PolarHBondContact OH-NH2 3.48Å; V575-R582 CarbonylContact O-C 3.56Å; V575-R582 WeakPolarHBondContact O-CA 3.47Å; I576-R582 HydrophobicContact CB-CG 4.1Å; I576-R582 HydrophobicContact CD1-CG 3.65Å; I576-R582 HydrophobicContact CG1-CG 3.74Å; R580-R582 PolarHBondContact O-N 2.92Å
583	S	91.9	Very high	92.3	Very high	14 Å²	14	62.4 Å²	62.4	10%	0.098	30%	0.303	C	S	.	.			trans	-72	177.7	167.9	71.7	0	0	0	0	111.7	P493 Y574 V575	P493-S583 WeakPolarHBondContact O-CA 3.17Å; P493-S583 WeakPolarHBondContact O-CB 3.42Å; Y574-S583 WeakPolarHBondContact CA-OG 3.45Å; V575-S583 PolarHBondContact N-OG 2.87Å; V575-S583 PolarHBondContact O-N 2.76Å
584	Q	88	Confident	91.2	Very high	133 Å²	133	68.9 Å²	68.9	62%	0.621	34%	0.343	S	S	*	.	P	Polyproline II helix	trans	-64.8	148.5	158.2	-64.3	-170.8	4.6	0	0	109.6
585	P	92.9	Very high	89.8	Confident	83 Å²	83	73 Å²	73	54%	0.539	37%	0.373	S	S	.	.	P	Polyproline II helix	trans	-70.5	129.9	174.4	-16.3	31.2	0	0	0	111.3	N572 F573	N572-P585 HydrophobicContact CB-CB 4.32Å; F573-P585 CarbonylContact O-C 3.51Å; F573-P585 WeakPolarHBondContact O-CA 3.37Å
586	Q	96.7	Very high	87.8	Confident	44 Å²	44	78.3 Å²	78.3	21%	0.206	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	156.8	169.5	-60.5	-60.2	112.9	0	0	109.9	V495 N572 F573	V495-Q586 HydrophobicContact CB-CG 3.94Å; V495-Q586 HydrophobicContact CG1-CG 3.99Å; V495-Q586 HydrophobicContact CG2-CG 4.17Å; N572-Q586 CarbonylContact C-O 3.54Å; N572-Q586 WeakPolarHBondContact CA-O 3.12Å; N572-Q586 WeakPolarHBondContact CB-O 3.34Å; F573-Q586 HydrophobicContact CD1-CB 3.96Å; F573-Q586 HydrophobicContact CD2-CB 4.09Å; F573-Q586 HydrophobicContact CD2-CG 4.4Å; F573-Q586 HydrophobicContact CE1-CB 3.55Å; F573-Q586 HydrophobicContact CE1-CG 4.44Å; F573-Q586 HydrophobicContact CE2-CB 3.68Å; F573-Q586 HydrophobicContact CE2-CG 3.76Å; F573-Q586 HydrophobicContact CG-CB 4.22Å; F573-Q586 HydrophobicContact CZ-CB 3.39Å; F573-Q586 HydrophobicContact CZ-CG 3.79Å; F573-Q586 PolarHBondContact N-O 2.92Å; F573-Q586 PolarHBondContact O-N 3.29Å
587	H	96.8	Very high	85.6	Confident	141 Å²	141	82.4 Å²	82.4	65%	0.653	44%	0.443	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	146.7	175.7	-58.7	-43	0	0	0	111.5	Q498 N572	Q498-H587 PolarHBondContact NE2-O 2.83Å; N572-H587 PolarHBondContact OD1-CE1 3.02Å; N572-H587 PolarHBondContact OD1-ND1 2.98Å
588	F	98.1	Very high	83.9	Confident	1 Å²	1	88.8 Å²	88.8	0%	0.004	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	153.3	174	-169.2	-89.4	0	0	0	110.4	M500 D501 C503 M511 F526 V557 V571 F573 F590	M500-F588 HydrophobicContact CE-CE2 4.48Å; M500-F588 HydrophobicContact CG-CE2 4.18Å; D501-F588 VanDerWaalsContact C-CD2 3.47Å; D501-F588 CarbonylContact O-C 3.43Å; D501-F588 VanDerWaalsContact O-CA 3.29Å; D501-F588 WeakPolarHBondContact O-CA 3.44Å; D501-F588 WeakPolarHBondContact O-CD2 3.49Å; C503-F588 HydrophobicContact CB-CE1 4.3Å; C503-F588 HydrophobicContact CB-CZ 3.83Å; C503-F588 VanDerWaalsContact SG-CZ 3.59Å; M511-F588 HydrophobicContact SD-CD2 4.3Å; M511-F588 HydrophobicContact SD-CE2 4.16Å; F526-F588 HydrophobicContact CD1-CD1 4.45Å; F526-F588 HydrophobicContact CE1-CB 4.06Å; F526-F588 AromaticContact CE1-CD1 3.79Å; F526-F588 HydrophobicContact CE1-CD1 3.79Å; F526-F588 HydrophobicContact CE1-CD2 4.18Å; F526-F588 HydrophobicContact CE1-CE1 4.25Å; F526-F588 AromaticContact CE1-CG 3.75Å; F526-F588 HydrophobicContact CE1-CG 3.75Å; V557-F588 HydrophobicContact CG1-CE1 3.84Å; V557-F588 HydrophobicContact CG1-CZ 3.81Å; V557-F588 HydrophobicContact CG2-CE2 4.27Å; V557-F588 HydrophobicContact CG2-CZ 4.03Å; V571-F588 HydrophobicContact CG2-CB 4.03Å; V571-F588 HydrophobicContact CG2-CD1 4.21Å; V571-F588 WeakPolarHBondContact CG2-O 3.39Å; V571-F588 PolarHBondContact N-O 3.29Å; V571-F588 PolarHBondContact O-N 2.68Å; V571-F588 VanDerWaalsContact O-O 3.06Å; F573-F588 HydrophobicContact CD1-CB 3.94Å; F573-F588 HydrophobicContact CE1-CB 4.18Å; F573-F588 HydrophobicContact CE1-CD2 4.43Å; F588-F590 HydrophobicContact CD1-CD2 4.48Å; F588-F590 HydrophobicContact CD1-CE2 4.33Å; F588-F590 HydrophobicContact CD1-CZ 4.46Å; F588-F590 HydrophobicContact CE1-CD1 4.28Å; F588-F590 HydrophobicContact CE1-CE1 4.1Å; F588-F590 HydrophobicContact CE1-CE2 4.47Å; F588-F590 HydrophobicContact CE1-CZ 4.2Å
589	T	97.9	Very high	82.2	Confident	33 Å²	33	94 Å²	94	20%	0.202	49%	0.487	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	120.9	-177.7	-48.7	0	0	0	0	112.2	D501 S502 C503 P568 V569 K570	D501-T589 PolarHBondContact O-N 2.87Å; S502-T589 WeakPolarHBondContact CA-O 3.41Å; S502-T589 VanDerWaalsContact CB-O 3.3Å; S502-T589 WeakPolarHBondContact CB-O 3.05Å; C503-T589 PolarHBondContact N-O 3.35Å; C503-T589 VanDerWaalsContact N-O 3.13Å; P568-T589 HydrophobicContact CB-CG2 3.66Å; V569-T589 CarbonylContact O-C 3.51Å; V569-T589 WeakPolarHBondContact O-CA 3.45Å; K570-T589 HydrophobicContact CG-CG2 4.22Å
590	F	97.9	Very high	80.9	Confident	0 Å²	0	90.3 Å²	90.3	0%	0	48%	0.481	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	128.9	168.5	-75.6	-73.2	0	0	0	110.5	C503 V505 F526 W537 V557 P558 Y560 P568 V569 V571 F588	C503-F590 CarbonylContact O-C 3.52Å; C503-F590 WeakPolarHBondContact O-CA 3.47Å; V505-F590 HydrophobicContact CG1-CB 4.26Å; F526-F590 HydrophobicContact CD1-CE2 4.31Å; F526-F590 HydrophobicContact CD1-CZ 4.43Å; W537-F590 AromaticContact CH2-CE2 3.62Å; W537-F590 HydrophobicContact CH2-CE2 3.62Å; W537-F590 HydrophobicContact CH2-CZ 4.01Å; W537-F590 AromaticContact CZ3-CE2 3.77Å; W537-F590 HydrophobicContact CZ3-CE2 3.77Å; V557-F590 HydrophobicContact CG1-CE1 3.83Å; V557-F590 HydrophobicContact CG1-CZ 3.79Å; P558-F590 WeakPolarHBondContact O-CE1 3.41Å; P558-F590 VanDerWaalsContact O-CZ 3.26Å; P558-F590 WeakPolarHBondContact O-CZ 3.03Å; Y560-F590 AromaticContact CD2-CD2 3.73Å; Y560-F590 HydrophobicContact CD2-CD2 3.73Å; Y560-F590 HydrophobicContact CD2-CE2 4.11Å; Y560-F590 HydrophobicContact CD2-CG 4.33Å; Y560-F590 HydrophobicContact CG-CB 4.24Å; Y560-F590 AromaticContact CG-CD2 3.89Å; Y560-F590 HydrophobicContact CG-CD2 3.89Å; Y560-F590 HydrophobicContact CG-CE2 4.41Å; Y560-F590 HydrophobicContact CG-CG 4.02Å; P568-F590 CarbonylContact C-O 3.53Å; P568-F590 WeakPolarHBondContact CA-O 3.38Å; V569-F590 PolarHBondContact N-O 3.5Å; V569-F590 PolarHBondContact O-N 3.14Å; V571-F590 HydrophobicContact CG1-CD2 4.05Å; V571-F590 HydrophobicContact CG1-CE2 4.4Å; V571-F590 HydrophobicContact CG2-CD2 3.85Å; V571-F590 HydrophobicContact CG2-CE2 3.81Å; F588-F590 HydrophobicContact CD1-CD2 4.48Å; F588-F590 HydrophobicContact CD1-CE2 4.33Å; F588-F590 HydrophobicContact CD1-CZ 4.46Å; F588-F590 HydrophobicContact CE1-CD1 4.28Å; F588-F590 HydrophobicContact CE1-CE1 4.1Å; F588-F590 HydrophobicContact CE1-CE2 4.47Å; F588-F590 HydrophobicContact CE1-CZ 4.2Å
591	T	96.8	Very high	79.6	Confident	47 Å²	47	85.6 Å²	85.6	29%	0.288	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	146.3	-179.9	54.9	0	0	0	0	111.8	C503 V505 P568	C503-T591 PolarHBondContact O-N 2.98Å; C503-T591 PolarHBondContact O-OG1 3.31Å; C503-T591 VanDerWaalsContact O-OG1 3.12Å; V505-T591 PolarHBondContact N-O 3.1Å; P568-T591 HydrophobicContact CB-CG2 4.44Å
592	P	95.1	Very high	78	Confident	33 Å²	33	86.6 Å²	86.6	21%	0.214	48%	0.484	C	S	.	.	P	Polyproline II helix	trans	-59.8	153.4	176.7	28.6	-37.9	0	0	0	111.1	I565 T594	I565-P592 HydrophobicContact CG1-CB 4.18Å; I565-P592 WeakPolarHBondContact O-CB 3.35Å; P592-T594 PolarHBondContact O-N 2.79Å
593	L	89.4	Confident	75.7	Confident	84 Å²	84	89.3 Å²	89.3	44%	0.44	51%	0.506	S	S	.	.	P	Polyproline II helix	trans	-63.9	118.5	171.4	-82.5	172.2	0	0	0	110	V505 L506 S595	V505-L593 HydrophobicContact CG2-CD1 4.39Å; V505-L593 HydrophobicContact CG2-CG 3.85Å; L506-L593 HydrophobicContact CD1-CD2 3.87Å; L506-L593 HydrophobicContact CD2-CD1 4.37Å; L506-L593 HydrophobicContact CG-CD1 4.48Å; L506-L593 HydrophobicContact CG-CD2 4Å; L593-S595 PolarHBondContact O-N 2.96Å
594	T	75.1	Confident	73.7	Confident	137 Å²	137	95.9 Å²	95.9	84%	0.84	54%	0.54	S	S	*	.			trans	-74.9	69.5	172.3	-40.9	0	0	0	0	110	P592 P596	P592-T594 PolarHBondContact O-N 2.79Å; T594-P596 WeakPolarHBondContact O-CD 3.42Å
595	S	65.9	Low	71.8	Confident	96 Å²	96	98.8 Å²	98.8	67%	0.671	55%	0.553	S	S	*	*			trans	-61.2	122.8	168.3	42.4	0	0	0	0	108.9	L593 A597	L593-S595 PolarHBondContact O-N 2.96Å; S595-A597 PolarHBondContact O-N 3.37Å; S595-A597 VanDerWaalsContact O-N 3.16Å
596	P	55.1	Low	69.3	Low	112 Å²	112	105.2 Å²	105.2	73%	0.727	57%	0.568	S	S	*	*			trans	-60.8	122	163.8	-16.2	30.5	0	0	0	106.6	T594 I598	T594-P596 WeakPolarHBondContact O-CD 3.42Å; P596-I598 VanDerWaalsContact C-N 3.32Å; P596-I598 PolarHBondContact O-N 2.51Å
597	A	48.1	Very low	66.7	Low	97 Å²	97	109.7 Å²	109.7	80%	0.802	59%	0.589	S	S	*	*			trans	-63.7	99.5	169.1	0	0	0	0	0	107.3	S595 K599	S595-A597 PolarHBondContact O-N 3.37Å; S595-A597 VanDerWaalsContact O-N 3.16Å; A597-K599 VanDerWaalsContact C-N 3.31Å; A597-K599 PolarHBondContact O-N 2.98Å
598	I	55.6	Low	63.8	Low	150 Å²	150	107.9 Å²	107.9	77%	0.769	60%	0.599	S	S	*	*			trans	-63.8	100.7	171.1	-62.1	178.9	0	0	0	105.4	P596 T600	P596-I598 VanDerWaalsContact C-N 3.32Å; P596-I598 PolarHBondContact O-N 2.51Å; I598-T600 PolarHBondContact O-N 3.24Å
599	K	48	Very low	60.9	Low	148 Å²	148	115.5 Å²	115.5	64%	0.643	64%	0.635	S	S	*	*			trans	-65	89.8	175.3	-177.9	175.7	178.5	-85.2	0	107.5	A597 E601	A597-K599 VanDerWaalsContact C-N 3.31Å; A597-K599 PolarHBondContact O-N 2.98Å; K599-E601 IonicContact NZ-OE1 3.13Å; K599-E601 PolarHBondContact NZ-OE1 3Å; K599-E601 IonicContact NZ-OE2 2.81Å; K599-E601 PolarHBondContact NZ-OE2 3.48Å; K599-E601 PolarHBondContact O-N 3.41Å; K599-E601 VanDerWaalsContact O-N 3.13Å
600	T	52	Low	57.9	Low	122 Å²	122	120.7 Å²	120.7	75%	0.748	66%	0.661	S	S	*	*			trans	-61.1	110.5	161.3	48	0	0	0	0	106.4	I598	I598-T600 PolarHBondContact O-N 3.24Å
601	E	51.1	Low	55	Low	130 Å²	130	129.3 Å²	129.3	61%	0.607	70%	0.703	S	S	*	*	P	Polyproline II helix	trans	-53.7	143.6	172.5	-64.2	-57	114.6	0	0	109.5	K599	K599-E601 IonicContact NZ-OE1 3.13Å; K599-E601 PolarHBondContact NZ-OE1 3Å; K599-E601 IonicContact NZ-OE2 2.81Å; K599-E601 PolarHBondContact NZ-OE2 3.48Å; K599-E601 PolarHBondContact O-N 3.41Å; K599-E601 VanDerWaalsContact O-N 3.13Å
602	P	54.5	Low	51.9	Low	102 Å²	102	130 Å²	130	66%	0.662	72%	0.72	S	S	*	*	P	Polyproline II helix	trans	-62.4	147.2	173.7	28.9	-34.5	0	0	0	110.1
603	L	43	Very low	48.9	Very low	168 Å²	168	139 Å²	139	88%	0.88	76%	0.756	S	S	*	*	P	Polyproline II helix	trans	-81.2	117.7	173.7	-165	87.5	0	0	0	108.5	E605	L603-E605 PolarHBondContact O-N 3.23Å
604	D	50.3	Low	46.1	Very low	152 Å²	152	138.7 Å²	138.7	81%	0.813	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-67.4	126.8	173.3	-77.5	-39.8	0	0	0	110.7
605	E	48	Very low	44	Very low	194 Å²	194	140 Å²	140	91%	0.907	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-79.1	133.3	165.2	-68.6	-174.9	115.6	0	0	109.7	L603	L603-E605 PolarHBondContact O-N 3.23Å
606	Y	39.4	Very low	43.1	Very low	219 Å²	219	140 Å²	140	86%	0.859	77%	0.771	S	S	*	*			trans	-134.5	144.1	166.2	-165.5	-97.3	0	0	0	111.1
607	E	42.5	Very low	42.2	Very low	137 Å²	137	143 Å²	143	64%	0.64	78%	0.775	S	S	*	*			trans	-78.3	147.3	-162.8	-59.8	-175.9	96.6	0	0	114.7	Q609	E607-Q609 PolarHBondContact OE1-NE2 2.74Å
608	A	35.9	Very low	41.5	Very low	104 Å²	104	145.3 Å²	145.3	86%	0.86	77%	0.772	S	S	*	*			trans	-147.7	79.7	157.7	0	0	0	0	0	110.2
609	Q	37.1	Very low	40.8	Very low	161 Å²	161	146.6 Å²	146.6	75%	0.752	78%	0.78	S	S	*	*			trans	-77.5	165.6	172.1	-62.5	-172.5	24.1	0	0	112	E607	E607-Q609 PolarHBondContact OE1-NE2 2.74Å
610	N	35.8	Very low	40	Very low	142 Å²	142	142.4 Å²	142.4	76%	0.759	78%	0.779	S	S	*	*			trans	76.9	85.2	153.6	-163.7	37.2	0	0	0	118.9
611	M	35.3	Very low	39.2	Very low	180 Å²	180	145.7 Å²	145.7	89%	0.887	79%	0.791	S	S	*	*				-168.4	154	102	-86.3	-143.7	-172.8	0	0	110.4
612	G	31.6	Very low	38.3	Very low	62 Å²	62	144.1 Å²	144.1	64%	0.639	79%	0.794	S	S	*	*			trans	-155.9	144.8	172.3	0	0	0	0	0	113.1
613	F	32.4	Very low	37.6	Very low	223 Å²	223	145.3 Å²	145.3	98%	0.978	80%	0.802	S	S	*	*			trans	-167.4	155.3	165.9	-92.9	-65.9	0	0	0	109.6
614	G	30.4	Very low	37	Very low	76 Å²	76	144.5 Å²	144.5	78%	0.784	79%	0.794	S	S	*	*			trans	93.4	69.4	147.6	0	0	0	0	0	120.3
615	I	32.2	Very low	36	Very low	166 Å²	166	142.8 Å²	142.8	85%	0.851	79%	0.794	S	S	*	*			trans	-34.4	154.4	144.2	-100.8	167.2	0	0	0	114.3
616	P	45.8	Very low	35.1	Very low	96 Å²	96	143.2 Å²	143.2	62%	0.623	79%	0.789	S	S	*	*			cis	-144.3	-179.1	-15.9	42.3	-23.9	0	0	0	117.1
617	Q	36.5	Very low	34.6	Very low	174 Å²	174	143.6 Å²	143.6	81%	0.813	79%	0.79	S	S	*	*			trans	46.4	124.4	146.3	-73.7	-179.3	57.8	0	0	122.2
618	I	34.3	Very low	33.9	Very low	145 Å²	145	145.1 Å²	145.1	74%	0.744	80%	0.797	S	S	*	*				169.6	126.1	114.3	-89.1	164.6	0	0	0	109.6
619	L	40.6	Very low	33.6	Very low	177 Å²	177	147.3 Å²	147.3	93%	0.927	79%	0.794	S	S	*	*			trans	56.7	141.8	172.9	-63	161.4	0	0	0	116.6
620	G	32.1	Very low	34.6	Very low	61 Å²	61	143.7 Å²	143.7	63%	0.629	79%	0.785	S	S	*	*			cis	167.3	158.8	-4.3	0	0	0	0	0	110.4
621	L	34.3	Very low	34.5	Very low	190 Å²	190	149.4 Å²	149.4	100%	0.995	80%	0.796	S	S	*	*			trans	74.1	140.2	-178.5	-49.3	177.4	0	0	0	116.4
622	S	32.6	Very low	34.4	Very low	97 Å²	97	144 Å²	144	68%	0.678	79%	0.786	S	S	*	*			trans	-134.6	136.1	179.2	171.6	0	0	0	0	109.6	Q624	S622-Q624 PolarHBondContact O-N 2.75Å
623	P	38.7	Very low	34.5	Very low	128 Å²	128	148.7 Å²	148.7	83%	0.831	80%	0.795	S	S	*	*			trans	-82.7	99.1	172.6	32.5	-30.7	0	0	0	110.1
624	Q	31.9	Very low	34.5	Very low	150 Å²	150	146.3 Å²	146.3	70%	0.701	79%	0.791	S	S	*	*			trans	-88.3	117.2	-175.4	-149.3	167.6	-1.2	0	0	111.5	S622 Y626	S622-Q624 PolarHBondContact O-N 2.75Å; Q624-Y626 PolarHBondContact O-N 2.96Å
625	S	28.3	Very low	34.5	Very low	117 Å²	117	150.5 Å²	150.5	82%	0.818	79%	0.79	S	S	*	*			trans	-65.4	127.7	175.1	-57.2	0	0	0	0	111.4
626	Y	28.8	Very low	35.3	Very low	203 Å²	203	147.2 Å²	147.2	80%	0.796	78%	0.779	S	S	*	*			trans	-106.1	126.6	176.6	-93.6	-88.6	0	0	0	112.7	Q624	Q624-Y626 PolarHBondContact O-N 2.96Å
627	Y	30.4	Very low	34.6	Very low	227 Å²	227	148.5 Å²	148.5	89%	0.89	78%	0.781	S	S	*	*			trans	-64.2	150.3	162.3	-83.3	-104.5	0	0	0	110.5
628	H	27.8	Very low	34.2	Very low	169 Å²	169	148 Å²	148	78%	0.782	78%	0.784	S	S	*	*			trans	-116.5	131.7	167.3	-168.9	51.4	0	0	0	110.9
629	N	28	Very low	34	Very low	150 Å²	150	143.9 Å²	143.9	80%	0.802	78%	0.778	S	S	*	*			trans	-143.5	124.4	170.8	-165.9	0.9	0	0	0	107.2
630	P	58.1	Low	33.9	Very low	85 Å²	85	143.4 Å²	143.4	55%	0.552	78%	0.775	S	S	*	*			trans	-104.5	151.3	-159.4	37.6	-35.4	0	0	0	115.3
631	R	35.3	Very low	33.8	Very low	262 Å²	262	147.5 Å²	147.5	99%	0.989	78%	0.782	S	S	*	*			trans	179	150.6	144.6	-103.6	163.7	-173.7	-150.9	1.4	112.1
632	G	32.1	Very low	33.7	Very low	67 Å²	67	143.7 Å²	143.7	69%	0.691	77%	0.771	S	S	*	*			trans	115.7	66.2	144.2	0	0	0	0	0	121
633	I	34.1	Very low	33.7	Very low	160 Å²	160	142.2 Å²	142.2	82%	0.821	77%	0.771	S	S	*	*				54.5	127.5	119.3	-64.7	175.4	0	0	0	120.7
634	L	32.6	Very low	33.7	Very low	172 Å²	172	145.5 Å²	145.5	90%	0.901	78%	0.778	S	S	*	*			trans	99.2	156.2	155.2	-82.2	167	0	0	0	122.5
635	H	29.4	Very low	33.7	Very low	165 Å²	165	142.4 Å²	142.4	76%	0.764	78%	0.778	S	S	*	*			trans	-83.6	178.3	-167.8	-130.2	-124.2	0	0	0	112
636	P	50.7	Low	33.7	Very low	96 Å²	96	142.6 Å²	142.6	62%	0.623	78%	0.779	S	S	*	*			cis	-148.2	-175.9	22.8	46.4	-26.2	0	0	0	120.4
637	D	30	Very low	33.8	Very low	124 Å²	124	137.9 Å²	137.9	66%	0.663	78%	0.775	S	S	*	*			trans	87.3	135.1	146.2	-67.1	-20.3	0	0	0	124
638	N	29.3	Very low	33.8	Very low	162 Å²	162	135.8 Å²	135.8	87%	0.866	77%	0.773	S	S	*	*			trans	57.3	137.3	163.9	-60.7	-28.7	0	0	0	119.4
639	G	29.3	Very low	33.9	Very low	60 Å²	60	137.4 Å²	137.4	62%	0.619	77%	0.773	S	S	*	*			cis	142	144.1	-2.5	0	0	0	0	0	112
640	L	37.6	Very low	33.9	Very low	167 Å²	167	139 Å²	139	87%	0.874	77%	0.772	S	S	*	*			trans	72.1	146.1	-177.4	-45.7	175.5	0	0	0	114.2
641	L	30.3	Very low	32.8	Very low	147 Å²	147	140 Å²	140	77%	0.77	78%	0.781	S	S	*	*			cis	-155.1	177.8	-8.7	-120.7	169.9	0	0	0	111.2
642	S	32.7	Very low	33.1	Very low	110 Å²	110	133.6 Å²	133.6	77%	0.769	77%	0.774	S	S	*	*			trans	-50.7	160.2	176.4	-50	0	0	0	0	115.2
643	G	31.7	Very low	32.9	Very low	65 Å²	65	137.4 Å²	137.4	67%	0.67	78%	0.778	S	S	*	*			cis	135.8	170.5	2.7	0	0	0	0	0	112.4
644	M	39.6	Very low	32.7	Very low	197 Å²	197	137.2 Å²	137.2	97%	0.97	78%	0.779	S	S	*	*			trans	69.9	154.3	179.7	-54.8	-171.7	-174.5	0	0	116.9
645	A	32.5	Very low	33.3	Very low	86 Å²	86	134.1 Å²	134.1	71%	0.711	77%	0.768	S	S	*	*			cis	-168.5	148.5	-30.5	0	0	0	0	0	110.8
646	S	28.4	Very low	33.2	Very low	121 Å²	121	133.1 Å²	133.1	85%	0.846	77%	0.769	S	S	*	*			trans	-153.4	165.3	135.1	67.5	0	0	0	0	108.8
647	C	30.7	Very low	32.1	Very low	104 Å²	104	136 Å²	136	70%	0.703	77%	0.774	S	S	*	*			trans	-142	177.1	-160.7	-60.4	0	0	0	0	112.7
648	Q	30	Very low	32	Very low	183 Å²	183	137.4 Å²	137.4	86%	0.855	78%	0.782	S	S	*	*			trans	81.3	154.6	162.1	-52.5	-166.7	59.7	0	0	117
649	R	29.1	Very low	32.1	Very low	203 Å²	203	133.8 Å²	133.8	77%	0.766	77%	0.774	S	S	*	*			cis	-171.2	136.2	-43.7	-129.6	-176.2	177.4	-159.2	1.7	108.6
650	F	28.5	Very low	31.9	Very low	182 Å²	182	140.6 Å²	140.6	80%	0.798	78%	0.781	S	S	*	*			trans	61	152.4	163.5	-70.3	-70.9	0	0	0	120.5
651	S	35.6	Very low	31.4	Very low	106 Å²	106	139.4 Å²	139.4	74%	0.741	77%	0.769	S	S	*	*			trans	-80.1	172.7	174.4	-27.4	0	0	0	0	112.6
652	P	40.3	Very low	31.2	Very low	128 Å²	128	140.1 Å²	140.1	83%	0.831	77%	0.769	S	S	*	*				-133.8	-174.7	122.7	38.2	-28.7	0	0	0	114
653	N	28.2	Very low	31	Very low	147 Å²	147	141.8 Å²	141.8	79%	0.786	76%	0.764	S	S	*	*			trans	-109.9	166.1	-171.8	-78.6	-70.3	0	0	0	113.6
654	L	29.9	Very low	31	Very low	157 Å²	157	146.6 Å²	146.6	82%	0.822	77%	0.769	S	S	*	*			trans	69	169.2	156.9	-101.3	69.4	0	0	0	116.8
655	P	45	Very low	30.8	Very low	106 Å²	106	142.8 Å²	142.8	69%	0.688	76%	0.762	S	S	*	*			cis	-137	156.5	-16.6	34.5	-15.9	0	0	0	117
656	N	27.1	Very low	31.5	Very low	144 Å²	144	144.7 Å²	144.7	77%	0.77	77%	0.767	S	S	*	*			trans	52.6	154.9	131.8	-150.3	15.9	0	0	0	124.7
657	Q	27.9	Very low	31.7	Very low	158 Å²	158	142.8 Å²	142.8	74%	0.738	76%	0.758	S	S	*	*			trans	77.2	105	163.3	-58.5	-155.5	12	0	0	121.7
658	D	28.8	Very low	32.1	Very low	153 Å²	153	145.5 Å²	145.5	82%	0.818	77%	0.765	S	S	*	*				45.6	147.2	108.7	-88	-59.1	0	0	0	124.4
659	A	30.3	Very low	32.3	Very low	86 Å²	86	142 Å²	142	71%	0.711	76%	0.755	S	S	*	*			trans	70.4	147.6	159.5	0	0	0	0	0	118.7
660	R	25.4	Very low	32.6	Very low	203 Å²	203	141.9 Å²	141.9	77%	0.766	76%	0.756	S	S	*	*			cis	-163.8	167.6	-20.1	-111.4	-157	-62.5	176	-0.1	109.4
661	F	27.4	Very low	33	Very low	142 Å²	142	137.7 Å²	137.7	62%	0.623	75%	0.75	S	S	*	*			trans	75.7	126.1	157.5	-70.7	-64.3	0	0	0	121.3
662	Q	25.8	Very low	32.9	Very low	162 Å²	162	144.2 Å²	144.2	76%	0.757	76%	0.758	S	S	*	*			trans	70.8	156.7	135.2	-76	171.6	-19.1	0	0	118.8
663	Q	29.5	Very low	32.5	Very low	144 Å²	144	142.1 Å²	142.1	67%	0.673	76%	0.759	S	S	*	*			cis	-149.9	170.4	10.2	-140	-179.1	-5.2	0	0	113.2
664	Q	30.5	Very low	32.6	Very low	166 Å²	166	138.7 Å²	138.7	78%	0.776	76%	0.758	S	S	*	*			trans	63.7	112.8	153.4	-76.1	165.5	20.5	0	0	120.8
665	S	35.5	Very low	32.7	Very low	118 Å²	118	141 Å²	141	83%	0.825	76%	0.762	S	S	*	*			trans	-126.5	147	146.2	52	0	0	0	0	109.6
666	P	46.9	Very low	32.1	Very low	126 Å²	126	141.1 Å²	141.1	82%	0.818	77%	0.765	S	S	*	*			trans	-108.2	152.1	167.8	36.5	-29	0	0	0	112
667	A	34.3	Very low	32.5	Very low	80 Å²	80	141.5 Å²	141.5	66%	0.661	77%	0.766	S	S	*	*			cis	-165.7	156.3	-15.9	0	0	0	0	0	110.4
668	I	38.8	Very low	32.6	Very low	162 Å²	162	138.1 Å²	138.1	83%	0.831	76%	0.76	S	S	*	*			trans	64.2	123.7	149.1	-71.3	162.7	0	0	0	116.7
669	V	34.5	Very low	32.7	Very low	108 Å²	108	136.1 Å²	136.1	66%	0.655	76%	0.758	S	S	*	*			cis	-170.8	173.1	-0.9	78.5	0	0	0	0	106.9
670	Y	35	Very low	32.9	Very low	202 Å²	202	137.6 Å²	137.6	79%	0.792	76%	0.763	S	S	*	*			cis	-159.6	176.4	16.2	-127.9	-31.4	0	0	0	112.8
671	S	35.6	Very low	33.9	Very low	94 Å²	94	134.2 Å²	134.2	66%	0.657	77%	0.768	S	S	*	*			trans	18.1	139.7	140.9	-64.7	0	0	0	0	123.2
672	R	35.3	Very low	34	Very low	243 Å²	243	130.6 Å²	130.6	92%	0.917	77%	0.771	S	S	*	*			cis	-170.1	117.1	-5.3	-177.9	-177.1	-165	-173.8	5.9	114.2
673	G	31.5	Very low	34.2	Very low	83 Å²	83	128.4 Å²	128.4	86%	0.856	77%	0.768	S	S	*	*			trans	84.9	144.4	150.4	0	0	0	0	0	119.1
674	G	29.7	Very low	34	Very low	75 Å²	75	131.6 Å²	131.6	77%	0.773	77%	0.774	S	S	*	*			cis	167.1	169.8	-12.9	0	0	0	0	0	116.4
675	K	32.7	Very low	33.9	Very low	207 Å²	207	130.6 Å²	130.6	90%	0.9	77%	0.77	S	S	*	*			trans	81	77.6	161.7	-51	-176.3	-174.3	-179.2	0	120.9
676	S	31.1	Very low	33.5	Very low	108 Å²	108	130.3 Å²	130.3	76%	0.755	77%	0.767	S	S	*	*				5.2	156.9	112.4	-56	0	0	0	0	120.5
677	L	36.1	Very low	32.5	Very low	151 Å²	151	128.4 Å²	128.4	79%	0.791	77%	0.77	S	S	*	*			cis	-167.8	157.5	-0.5	-113.6	168.8	0	0	0	113.5
678	S	30	Very low	32.1	Very low	88 Å²	88	128.2 Å²	128.2	62%	0.615	78%	0.777	S	S	*	*			trans	24.5	150.1	147	68	0	0	0	0	127.7
679	S	30.1	Very low	31.6	Very low	111 Å²	111	126.9 Å²	126.9	78%	0.776	78%	0.776	S	S	*	*			trans	74.9	129.3	132.2	59.7	0	0	0	0	123.9
680	S	34.8	Very low	31.3	Very low	116 Å²	116	130 Å²	130	81%	0.811	79%	0.786	S	S	*	*			trans	-81.3	162.5	166.1	-32.9	0	0	0	0	112.8
681	P	47.7	Very low	32.2	Very low	133 Å²	133	125.4 Å²	125.4	86%	0.864	78%	0.78	S	S	*	*				-156.8	178.6	86.8	41.7	-22.9	0	0	0	117.2
682	G	29.6	Very low	31.8	Very low	66 Å²	66	128.1 Å²	128.1	68%	0.68	79%	0.787	S	S	*	*			trans	116.6	94	139.7	0	0	0	0	0	122
683	T	28.9	Very low	32.2	Very low	116 Å²	116	120.6 Å²	120.6	71%	0.712	77%	0.77	S	S	*	*			trans	49.9	126.8	130.9	-30.9	0	0	0	0	123.3
684	W	26	Very low	32	Very low	210 Å²	210	125 Å²	125	80%	0.795	77%	0.768	S	S	*	*				151.9	136.2	120.4	-79.5	114	0	0	0	115.7
685	H	27.7	Very low	32	Very low	146 Å²	146	133.1 Å²	133.1	68%	0.676	78%	0.775	S	S	*	*			trans	58.6	113.4	149.3	-70.4	-48	0	0	0	125.6
686	S	27.2	Very low	31.8	Very low	111 Å²	111	129.3 Å²	129.3	78%	0.776	78%	0.775	S	S	*	*				65.7	107.9	116.5	-53.1	0	0	0	0	123.4
687	G	26.3	Very low	31.7	Very low	86 Å²	86	130.3 Å²	130.3	89%	0.887	78%	0.776	S	S	*	*				101.4	157.8	122.7	0	0	0	0	0	119.3
688	G	26.5	Very low	31.7	Very low	77 Å²	77	131.1 Å²	131.1	79%	0.794	78%	0.78	S	S	*	*			trans	114.1	129.4	172	0	0	0	0	0	114.6
689	V	28.5	Very low	31.6	Very low	134 Å²	134	132 Å²	132	81%	0.812	78%	0.782	S	S	*	*			trans	-138.3	119.4	177.6	174.2	0	0	0	0	109.4
690	M	27.7	Very low	31.5	Very low	174 Å²	174	134.5 Å²	134.5	86%	0.857	78%	0.781	S	S	*	*			trans	64.9	165.8	162.9	-70.6	-63.4	165.8	0	0	118.1
691	P	53.6	Low	31.1	Very low	105 Å²	105	135.3 Å²	135.3	68%	0.682	78%	0.781	S	S	*	*			cis	-134.1	-173.4	-24.3	30	-8.9	0	0	0	114.4
692	D	27.7	Very low	30.1	Very low	151 Å²	151	132.4 Å²	132.4	81%	0.807	78%	0.775	S	S	*	*			trans	80.2	166.3	143.6	-113.4	34.3	0	0	0	120
693	P	42.8	Very low	30	Very low	85 Å²	85	135 Å²	135	55%	0.552	78%	0.783	S	S	*	*				-141.7	-178.2	-105.8	43.2	-22.7	0	0	0	117.9
694	H	28.6	Very low	31.1	Very low	175 Å²	175	135.7 Å²	135.7	81%	0.81	79%	0.789	S	S	*	*			trans	51.6	101.5	154.9	-62.7	-54.4	0	0	0	121.1
695	R	28.5	Very low	31.3	Very low	245 Å²	245	130 Å²	130	93%	0.925	78%	0.782	S	S	*	*				-174.4	125.3	105.3	-113.9	-174.4	171	-141.7	-0.6	113.1
696	S	28.1	Very low	31.3	Very low	127 Å²	127	132 Å²	132	89%	0.888	79%	0.791	S	S	*	*			trans	-167.8	136.4	139.7	-89.2	0	0	0	0	113.7
697	V	29.8	Very low	31.5	Very low	129 Å²	129	131.1 Å²	131.1	78%	0.782	79%	0.785	S	S	*	*			trans	-50.9	118.7	-177.7	-179.5	0	0	0	0	115.6
698	L	35.4	Very low	31.5	Very low	168 Å²	168	133.9 Å²	133.9	88%	0.88	79%	0.785	S	S	*	*				175.4	121.8	130	-99.2	161.3	0	0	0	108.2
699	V	28.5	Very low	31.5	Very low	107 Å²	107	133.4 Å²	133.4	65%	0.648	78%	0.779	S	S	*	*			trans	-147.5	153.5	-152.2	-150	0	0	0	0	113.5
700	H	27.2	Very low	32.3	Very low	164 Å²	164	132.3 Å²	132.3	76%	0.759	78%	0.775	S	S	*	*			trans	80.8	139	164.2	-60.1	-63	0	0	0	118.7
701	T	27.6	Very low	32.4	Very low	133 Å²	133	131.6 Å²	131.6	82%	0.816	77%	0.773	S	S	*	*			cis	-174.1	155.7	-39.8	11.9	0	0	0	0	107.5
702	G	25.8	Very low	31.2	Very low	72 Å²	72	131.1 Å²	131.1	74%	0.742	77%	0.772	S	S	*	*			trans	178.8	92.2	171.8	0	0	0	0	0	119.7
703	S	28.4	Very low	31.3	Very low	119 Å²	119	129.8 Å²	129.8	83%	0.832	78%	0.775	S	S	*	*			trans	-118.7	-174.1	137.5	-53.2	0	0	0	0	105.7
704	P	50.6	Low	30.7	Very low	131 Å²	131	129 Å²	129	85%	0.851	78%	0.782	S	S	*	*			cis	-135.3	-105.7	0.4	38	-14.2	0	0	0	113.3
705	S	31.1	Very low	30.8	Very low	92 Å²	92	130.4 Å²	130.4	64%	0.643	79%	0.789	S	S	*	*			trans	-135.5	148.2	-161.5	58.4	0	0	0	0	114.5
706	Q	28.2	Very low	30.9	Very low	186 Å²	186	126.4 Å²	126.4	87%	0.869	78%	0.781	S	S	*	*			trans	65.4	149.5	170.4	-64.5	-166.9	56.2	0	0	116.3
707	S	30.4	Very low	31.6	Very low	93 Å²	93	125.9 Å²	125.9	65%	0.65	77%	0.774	S	S	*	*			cis	-165.3	-180	-15	51.4	0	0	0	0	110.5
708	V	27.1	Very low	31.6	Very low	145 Å²	145	123.3 Å²	123.3	88%	0.879	76%	0.762	S	S	*	*			trans	81.5	143.2	173.9	-166.3	0	0	0	0	116.6
709	G	25.4	Very low	31.6	Very low	66 Å²	66	122.6 Å²	122.6	68%	0.68	76%	0.757	S	S	*	*			trans	-101.6	-146.6	179.5	0	0	0	0	0	113.5
710	P	45.9	Very low	31.8	Very low	112 Å²	112	124.1 Å²	124.1	73%	0.727	76%	0.76	S	S	*	*			cis	-139.2	-170.2	11.5	44.6	-26.5	0	0	0	115.8
711	I	30.4	Very low	31.9	Very low	159 Å²	159	123.3 Å²	123.3	82%	0.815	76%	0.757	S	S	*	*			trans	68.8	148.9	163.5	-60.4	166.8	0	0	0	116.1
712	S	26.7	Very low	31.8	Very low	95 Å²	95	126.7 Å²	126.7	66%	0.664	76%	0.761	S	S	*	*			cis	-162.1	171.9	-43.9	76.3	0	0	0	0	109
713	S	31.5	Very low	31.9	Very low	123 Å²	123	127.5 Å²	127.5	86%	0.86	76%	0.755	S	S	*	*			trans	68.1	140.4	-179.9	78.7	0	0	0	0	116.7
714	G	29.8	Very low	32.8	Very low	68 Å²	68	127.5 Å²	127.5	70%	0.701	75%	0.752	S	S	*	*			cis	-174.2	153.4	-9	0	0	0	0	0	115.1
715	Q	30	Very low	31.9	Very low	205 Å²	205	127.3 Å²	127.3	96%	0.958	75%	0.749	S	S	*	*			trans	74.3	134.8	169.7	-59.4	-166.8	-16.8	0	0	120.2
716	H	31.3	Very low	32	Very low	161 Å²	161	128.6 Å²	128.6	75%	0.745	75%	0.748	S	S	*	*			trans	-111.4	164.1	173.2	-129.3	-108.4	0	0	0	107.4	S718	H716-S718 PolarHBondContact ND1-N 2.93Å; H716-S718 PolarHBondContact ND1-OG 3.24Å
717	P	41.8	Very low	32.3	Very low	116 Å²	116	127.1 Å²	127.1	75%	0.753	74%	0.741	S	S	*	*				-139.4	153.3	71.3	38.1	-20.3	0	0	0	113.4
718	S	31.3	Very low	32.6	Very low	75 Å²	75	129.2 Å²	129.2	52%	0.524	74%	0.74	S	S	.	*				52.4	114.6	70.1	-42.4	0	0	0	0	111.7	H716	H716-S718 PolarHBondContact ND1-N 2.93Å; H716-S718 PolarHBondContact ND1-OG 3.24Å
719	I	34.2	Very low	33.2	Very low	153 Å²	153	128.9 Å²	128.9	79%	0.785	73%	0.733	S	S	*	*				169.4	152.1	75.3	-107.6	145.8	0	0	0	107.3
720	I	33.1	Very low	33.6	Very low	139 Å²	139	133 Å²	133	71%	0.713	74%	0.739	S	S	*	*			cis	-161.9	172.7	-21.2	-154	163	0	0	0	111.2
721	Q	28.9	Very low	32.7	Very low	146 Å²	146	138.3 Å²	138.3	68%	0.682	74%	0.744	S	S	*	*			trans	-52.8	159.7	171.1	-179	-176.1	5.5	0	0	118.3
722	F	25.6	Very low	32.9	Very low	205 Å²	205	134.3 Å²	134.3	90%	0.899	74%	0.735	S	S	*	*			trans	-146.4	158.7	152	-98	-69.8	0	0	0	113.1
723	S	27.7	Very low	33.1	Very low	88 Å²	88	133 Å²	133	62%	0.615	74%	0.736	S	S	*	*			trans	-132.9	167.5	-167.8	-60.8	0	0	0	0	111.4
724	P	47.3	Very low	33.2	Very low	119 Å²	119	133.7 Å²	133.7	77%	0.773	73%	0.73	S	S	*	*			trans	-90.1	176.6	-173.9	37.4	-37.3	0	0	0	114
725	T	32.8	Very low	33.4	Very low	128 Å²	128	136.8 Å²	136.8	79%	0.785	74%	0.735	S	S	*	*			trans	137.8	138	147.3	-61.6	0	0	0	0	113.2
726	N	33.4	Very low	33.5	Very low	118 Å²	118	134.4 Å²	134.4	63%	0.631	73%	0.725	S	S	*	*			trans	-177.6	164.3	145.7	-112.1	-75.5	0	0	0	109.8	H728	N726-H728 PolarHBondContact OD1-CD2 3.32Å; N726-H728 VanDerWaalsContact OD1-CD2 3.28Å
727	H	34.2	Very low	33.4	Very low	156 Å²	156	132.5 Å²	132.5	72%	0.722	72%	0.724	S	S	*	*			cis	-139.9	174.5	16.4	-73	-75.5	0	0	0	108.8
728	H	37	Very low	33.1	Very low	137 Å²	137	134 Å²	134	63%	0.634	73%	0.725	S	S	*	*			cis	-174.3	169.6	-9.9	-105.9	-170.1	0	0	0	107.4	N726	N726-H728 PolarHBondContact OD1-CD2 3.32Å; N726-H728 VanDerWaalsContact OD1-CD2 3.28Å
729	L	38.2	Very low	33.5	Very low	138 Å²	138	135.9 Å²	135.9	72%	0.723	74%	0.735	S	S	*	*			cis	-170.9	125.9	-35.7	-147.1	-170.9	0	0	0	108.3
730	L	34.1	Very low	34.7	Very low	153 Å²	153	134.2 Å²	134.2	80%	0.801	74%	0.735	S	S	*	*			trans	-163.6	150.2	168.1	-97.5	168.8	0	0	0	107.2
731	R	28.7	Very low	35.3	Very low	223 Å²	223	134.1 Å²	134.1	84%	0.842	74%	0.743	S	S	*	*			cis	-148.7	161.4	-6.2	-169.3	177.5	172	145.3	2.9	108.8
732	A	33.7	Very low	35.3	Very low	75 Å²	75	135.9 Å²	135.9	62%	0.62	75%	0.752	S	S	*	*			trans	-57.2	153.9	163.8	0	0	0	0	0	112.9
733	G	31.1	Very low	36.9	Very low	67 Å²	67	130.5 Å²	130.5	69%	0.691	74%	0.737	S	S	*	*			cis	170.7	-173.9	8.5	0	0	0	0	0	111.9
734	D	32.5	Very low	36.9	Very low	137 Å²	137	132.8 Å²	132.8	73%	0.733	74%	0.743	S	S	*	*			cis	-168.2	-179.8	-10.8	-88.9	-37.5	0	0	0	110.2
735	T	34.2	Very low	36.2	Very low	133 Å²	133	133.7 Å²	133.7	82%	0.816	74%	0.741	S	S	*	*			trans	72.9	110.9	165.6	42.2	0	0	0	0	122.6
736	E	31.7	Very low	36	Very low	156 Å²	156	136.1 Å²	136.1	73%	0.729	74%	0.743	S	S	*	*			trans	72.3	169.2	146.8	-71.3	-80.3	60	0	0	119.4
737	T	29.8	Very low	35.7	Very low	121 Å²	121	139.3 Å²	139.3	74%	0.742	75%	0.754	S	S	*	*			cis	-143.3	-146.8	11.1	-20.7	0	0	0	0	114.4
738	L	35.8	Very low	35.5	Very low	147 Å²	147	140.3 Å²	140.3	77%	0.77	76%	0.763	S	S	*	*			trans	-140.2	-179	-168.7	-69.5	167.3	0	0	0	110.5
739	P	40.4	Very low	35.1	Very low	114 Å²	114	140.5 Å²	140.5	74%	0.74	77%	0.768	S	S	*	*				-131.5	-179.1	-51	39.1	-22.3	0	0	0	113.7
740	P	59.2	Low	34.6	Very low	118 Å²	118	143.7 Å²	143.7	77%	0.766	78%	0.777	S	S	*	*			trans	-107	176.5	-175.7	41	-35.6	0	0	0	116.2
741	P	45.9	Very low	34.2	Very low	138 Å²	138	141.4 Å²	141.4	90%	0.896	77%	0.772	S	S	*	*				-147.5	-170.6	123.7	39.3	-22.1	0	0	0	117.3
742	Q	28.2	Very low	34.1	Very low	183 Å²	183	138.8 Å²	138.8	86%	0.855	78%	0.775	S	S	*	*			trans	-111.4	-163.4	-168.4	-132.9	-167.1	-8.9	0	0	111.5
743	P	58.9	Low	33.7	Very low	92 Å²	92	142.2 Å²	142.2	60%	0.597	78%	0.783	S	S	*	*			cis	-140.9	-148.4	-14.5	40	-16.4	0	0	0	115.2
744	D	27.7	Very low	33.6	Very low	136 Å²	136	148.9 Å²	148.9	73%	0.727	79%	0.789	S	S	*	*			trans	83.1	152	157.8	-76.5	-32.7	0	0	0	121.5
745	N	32	Very low	35.1	Very low	137 Å²	137	147.7 Å²	147.7	73%	0.733	79%	0.788	S	S	*	*			cis	-171	-176.6	-32.1	-148	-41	0	0	0	111.5
746	Q	29.7	Very low	36	Very low	180 Å²	180	146.2 Å²	146.2	84%	0.841	78%	0.781	S	S	*	*			trans	97.1	155.2	158.1	-50.3	-163.9	6.3	0	0	120.6
747	Q	27.8	Very low	35.9	Very low	185 Å²	185	147.9 Å²	147.9	86%	0.864	79%	0.788	S	S	*	*			trans	-131.3	165.4	-172.9	-58.6	171.7	-35	0	0	110.1
748	I	29.9	Very low	35.9	Very low	176 Å²	176	146.5 Å²	146.5	90%	0.903	79%	0.79	S	S	*	*			trans	-158.4	157.7	150.6	-106.5	150.6	0	0	0	110.2
749	L	28.7	Very low	35.6	Very low	142 Å²	142	143.3 Å²	143.3	74%	0.743	79%	0.792	S	S	*	*			trans	-135.6	144.5	-171.3	-119.8	161.3	0	0	0	109.3
750	F	26	Very low	35.1	Very low	205 Å²	205	142.5 Å²	142.5	90%	0.899	79%	0.789	S	S	*	*			trans	-169.8	162.2	141.6	-115.7	-77.4	0	0	0	111.2
751	C	27.2	Very low	33.6	Very low	105 Å²	105	145.4 Å²	145.4	71%	0.709	79%	0.792	S	S	*	*			trans	-128.8	162.8	179.3	-55.8	0	0	0	0	110.3
752	D	25.2	Very low	32.7	Very low	168 Å²	168	144.4 Å²	144.4	90%	0.898	79%	0.788	S	S	*	*			trans	-158	171.6	155.4	-130.8	-41.9	0	0	0	112.2
753	D	25.3	Very low	33.5	Very low	146 Å²	146	141.9 Å²	141.9	78%	0.781	79%	0.788	S	S	*	*			trans	-116.1	-176.3	-144.2	-131.5	-53.2	0	0	0	119.5
754	Y	29.7	Very low	31.9	Very low	208 Å²	208	141.2 Å²	141.2	82%	0.816	80%	0.798	S	S	*	*			trans	-78.3	-172.9	-172.8	-90.2	-118.7	0	0	0	115.9
755	P	64	Low	32.1	Very low	111 Å²	111	143.1 Å²	143.1	72%	0.721	80%	0.802	S	S	*	*			cis	-119.2	-96.1	-45.3	29.8	-9.4	0	0	0	113.5
756	P	52.3	Low	32.5	Very low	102 Å²	102	142.3 Å²	142.3	66%	0.662	80%	0.804	S	S	*	*			cis	-129.3	170.5	-13.9	43.5	-26.9	0	0	0	117.7
757	Q	29.5	Very low	32.5	Very low	191 Å²	191	141.4 Å²	141.4	89%	0.893	80%	0.8	S	S	*	*			trans	67	151.2	163.6	-63	-165.4	4.8	0	0	120.1
758	A	30.9	Very low	32.4	Very low	93 Å²	93	137.4 Å²	137.4	77%	0.769	80%	0.799	S	S	*	*			cis	-175.3	163.4	-25.1	0	0	0	0	0	108.4
759	G	29	Very low	32.3	Very low	79 Å²	79	137.6 Å²	137.6	81%	0.814	80%	0.796	S	S	*	*			cis	-119	-101.9	-14.9	0	0	0	0	0	109.2
760	S	31	Very low	32.2	Very low	98 Å²	98	135.3 Å²	135.3	69%	0.685	80%	0.797	S	S	*	*			cis	-175.2	159	-24	90.4	0	0	0	0	106.5
761	H	27.8	Very low	32.1	Very low	179 Å²	179	130 Å²	130	83%	0.829	79%	0.791	S	S	*	*			cis	-149.7	-171	-9.3	-91.3	-45	0	0	0	108.6
762	S	26.7	Very low	32.1	Very low	116 Å²	116	131.2 Å²	131.2	81%	0.811	80%	0.795	S	S	*	*			trans	-139.3	-163.9	-174.9	-40.7	0	0	0	0	110.3
763	P	44.9	Very low	32.1	Very low	131 Å²	131	128.8 Å²	128.8	85%	0.851	79%	0.786	S	S	*	*			cis	-134.8	-169.6	-15	41.8	-24.2	0	0	0	113.8
764	G	25.7	Very low	32.2	Very low	78 Å²	78	130.8 Å²	130.8	80%	0.804	79%	0.79	S	S	*	*			trans	163.6	130.4	158.1	0	0	0	0	0	117.8
765	H	30.3	Very low	32	Very low	176 Å²	176	129.5 Å²	129.5	82%	0.815	79%	0.792	S	S	*	*			trans	-144.5	152	168.1	-136	-39.2	0	0	0	108
766	P	41.3	Very low	30.3	Very low	119 Å²	119	132.8 Å²	132.8	77%	0.773	80%	0.798	S	S	*	*				-146.8	-156	96.1	39.2	-21.2	0	0	0	113.4
767	Q	28.5	Very low	29.2	Very low	161 Å²	161	133.7 Å²	133.7	75%	0.752	80%	0.803	S	S	*	*			trans	-104	163.3	-168.2	-55.7	157.8	-89.6	0	0	114.4
768	A	26.4	Very low	29.1	Very low	102 Å²	102	129.6 Å²	129.6	84%	0.843	80%	0.795	S	S	*	*			trans	-150.2	153.3	139.5	0	0	0	0	0	110
769	Q	27.6	Very low	29.4	Very low	180 Å²	180	130.9 Å²	130.9	84%	0.841	80%	0.795	S	S	*	*			trans	-134.5	136.5	-175	-64.8	174	-54.3	0	0	112.8
770	A	26.1	Very low	29.3	Very low	93 Å²	93	132.7 Å²	132.7	77%	0.769	79%	0.791	S	S	*	*			trans	-169.7	132.7	148.5	0	0	0	0	0	106.2
771	A	25.6	Very low	29.2	Very low	93 Å²	93	133.6 Å²	133.6	77%	0.769	79%	0.792	S	S	*	*				56.3	129.5	61	0	0	0	0	0	111.2
772	V	27.4	Very low	29.4	Very low	132 Å²	132	131.6 Å²	131.6	80%	0.8	79%	0.786	S	S	*	*			cis	-144.5	149.5	42.4	159.4	0	0	0	0	112.5
773	T	25.3	Very low	29.4	Very low	117 Å²	117	132.5 Å²	132.5	72%	0.718	78%	0.777	S	S	*	*			trans	-72.4	150.9	168.7	47.7	0	0	0	0	113
774	H	26.8	Very low	28.6	Very low	187 Å²	187	133.1 Å²	133.1	87%	0.866	77%	0.769	S	S	*	*			trans	-153.1	152.9	137.6	-119.2	-78	0	0	0	113.7
775	Q	25.3	Very low	28.7	Very low	181 Å²	181	136.2 Å²	136.2	85%	0.846	76%	0.762	S	S	*	*			trans	-103.7	172.4	-178.8	-66.9	175.9	-16.7	0	0	112.2
776	Q	27.8	Very low	28.6	Very low	180 Å²	180	135 Å²	135	84%	0.841	76%	0.757	S	S	*	*			trans	-36.3	155	163	-96.7	179.3	-3.8	0	0	115.2
777	P	29.2	Very low	28	Very low	121 Å²	121	136.9 Å²	136.9	79%	0.786	76%	0.756	S	S	*	*				-147.2	173.5	64.4	40.1	-20.7	0	0	0	118.6
778	C	28.5	Very low	28.9	Very low	106 Å²	106	133.6 Å²	133.6	72%	0.716	75%	0.748	S	S	*	*			trans	-96.7	154.3	164.3	-55.7	0	0	0	0	110.7
779	P	35.7	Very low	29	Very low	119 Å²	119	138.5 Å²	138.5	77%	0.773	75%	0.751	S	S	*	*				-131.6	169.2	96.2	10.3	12.6	0	0	0	112.6
780	T	28.2	Very low	29	Very low	118 Å²	118	132.9 Å²	132.9	72%	0.724	74%	0.741	S	S	*	*			cis	95.5	147.4	26.2	-44.7	0	0	0	0	114.5
781	V	28	Very low	29.1	Very low	116 Å²	116	137 Å²	137	70%	0.703	74%	0.744	S	S	*	*			trans	83.7	127.8	176.1	-172.8	0	0	0	0	114.9
782	I	31.1	Very low	29.2	Very low	137 Å²	137	141.7 Å²	141.7	70%	0.703	75%	0.747	S	S	*	*			cis	95	117.9	14.3	-55.3	170.5	0	0	0	116.8
783	Q	27.9	Very low	28.9	Very low	135 Å²	135	143.8 Å²	143.8	63%	0.631	75%	0.749	S	S	*	*			trans	175.9	127.2	146	-115.7	51.7	84.6	0	0	108.2
784	Q	28.8	Very low	29.9	Very low	144 Å²	144	142.3 Å²	142.3	67%	0.673	74%	0.741	S	S	*	*				72.6	157.5	89.8	-70.1	-173	10.8	0	0	115.9
785	Q	26.9	Very low	30.1	Very low	143 Å²	143	141.6 Å²	141.6	67%	0.668	74%	0.738	S	S	*	*			cis	-157.6	-178.8	8.5	-132.2	-177.7	81.4	0	0	108.6
786	Q	28.3	Very low	30.1	Very low	150 Å²	150	141.6 Å²	141.6	70%	0.701	74%	0.735	S	S	*	*			cis	-148.1	-93.3	-1.5	-162.9	-160.4	97.9	0	0	114.6
787	Q	28.4	Very low	30	Very low	160 Å²	160	138.6 Å²	138.6	75%	0.748	73%	0.729	S	S	*	*			trans	-167.5	-168.5	-156.8	-89.3	-118	11.3	0	0	110.1
788	P	47.4	Very low	29.8	Very low	91 Å²	91	143.9 Å²	143.9	59%	0.591	73%	0.733	S	S	*	*			cis	-150.9	179.5	15.8	47.6	-27.1	0	0	0	121.6
789	F	28	Very low	29.7	Very low	205 Å²	205	144.6 Å²	144.6	90%	0.899	73%	0.734	S	S	*	*			trans	53.8	154.1	155.5	-69.5	-64.3	0	0	0	122.3
790	G	27.4	Very low	29.3	Very low	62 Å²	62	144.1 Å²	144.1	64%	0.639	73%	0.734	S	S	*	*			cis	170.4	167.9	-8.3	0	0	0	0	0	116.2
791	Q	28.2	Very low	29.8	Very low	179 Å²	179	144.7 Å²	144.7	84%	0.836	74%	0.739	S	S	*	*			trans	69.9	126.4	166.1	-48.9	-173.3	2.1	0	0	123.8
792	K	27.7	Very low	29.7	Very low	192 Å²	192	142.5 Å²	142.5	84%	0.835	74%	0.74	S	S	*	*				165.8	163.2	106	-86.6	-169.1	179.7	177.7	0	115
793	E	22.9	Very low	29.5	Very low	177 Å²	177	143 Å²	143	83%	0.827	75%	0.75	S	S	*	*			trans	-145.1	-171.8	-174.3	-134.8	-148	121.4	0	0	108.3
794	P	46.3	Very low	29.5	Very low	86 Å²	86	144.3 Å²	144.3	56%	0.558	76%	0.756	S	S	*	*			cis	-143.6	-165.6	-3.1	44.5	-24.3	0	0	0	117.3
795	Q	29.6	Very low	30.1	Very low	172 Å²	172	142.6 Å²	142.6	80%	0.804	76%	0.758	S	S	*	*			trans	80	155.3	157.3	-70.1	175.9	21.3	0	0	119.5
796	K	25.3	Very low	30.1	Very low	181 Å²	181	143.2 Å²	143.2	79%	0.787	76%	0.762	S	S	*	*			cis	-162.7	133.9	36.6	-166.4	177.6	179.6	-177.9	0	116.5
797	V	25.7	Very low	30.1	Very low	117 Å²	117	143.3 Å²	143.3	71%	0.709	76%	0.763	S	S	*	*			trans	48.2	117.1	145.3	-176.2	0	0	0	0	120.8
798	R	25.8	Very low	30	Very low	232 Å²	232	142.8 Å²	142.8	88%	0.875	77%	0.77	S	S	*	*				62	133.2	91.1	-134.7	-174.3	177.7	172.9	-0.3	115.5
799	V	25.4	Very low	29.2	Very low	120 Å²	120	144 Å²	144	73%	0.727	78%	0.776	S	S	*	*				-174.4	155.8	89.4	158.6	0	0	0	0	112.4
800	S	28.6	Very low	29.2	Very low	110 Å²	110	142.7 Å²	142.7	77%	0.769	77%	0.772	S	S	*	*			trans	-145.1	153.8	160.3	-41	0	0	0	0	107.7
801	P	39.1	Very low	29.3	Very low	129 Å²	129	147.8 Å²	147.8	84%	0.838	79%	0.785	S	S	*	*				-161.3	-176.6	82.3	43.5	-22.8	0	0	0	117.8
802	G	24.4	Very low	29.7	Very low	71 Å²	71	143.6 Å²	143.6	73%	0.732	78%	0.781	S	S	*	*			trans	87.7	152.4	158.1	0	0	0	0	0	116.9
803	T	28.3	Very low	29.9	Very low	146 Å²	146	143.7 Å²	143.7	90%	0.896	79%	0.785	S	S	*	*			cis	-155.4	163.6	7.1	-55.4	0	0	0	0	110.7
804	Q	28	Very low	30.7	Very low	164 Å²	164	147.6 Å²	147.6	77%	0.766	79%	0.792	S	S	*	*			trans	-124.8	150.5	177.9	-97.6	-89.6	-2.7	0	0	109.4
805	P	39.9	Very low	30	Very low	108 Å²	108	154.7 Å²	154.7	70%	0.701	81%	0.807	S	S	*	*				-158	161.9	90.3	41.3	-22.2	0	0	0	118.8
806	M	27.3	Very low	30.3	Very low	156 Å²	156	152.8 Å²	152.8	77%	0.768	81%	0.807	S	S	*	*			trans	46	158.8	140	-65.5	177.7	82.3	0	0	122.5
807	E	27.7	Very low	30.8	Very low	152 Å²	152	150.5 Å²	150.5	71%	0.71	81%	0.809	S	S	*	*			cis	-177.8	125.9	-27.3	173.9	175.3	-125.6	0	0	108
808	V	26.9	Very low	31.6	Very low	148 Å²	148	151.2 Å²	151.2	90%	0.897	81%	0.813	S	S	*	*			trans	-150.3	148	163.1	-177.1	0	0	0	0	109.1
809	T	30	Very low	32.1	Very low	116 Å²	116	148 Å²	148	71%	0.712	81%	0.805	S	S	*	*			trans	-107.1	164.6	-172.1	-40.4	0	0	0	0	113.3
810	E	28.5	Very low	33.1	Very low	178 Å²	178	150.5 Å²	150.5	83%	0.832	81%	0.809	S	S	*	*			trans	118.2	146.3	149.3	-63	-157.6	125.3	0	0	120.1
811	D	28.9	Very low	34	Very low	169 Å²	169	151.3 Å²	151.3	90%	0.904	80%	0.801	S	S	*	*			trans	64.5	142.6	171.4	-92.8	-28.1	0	0	0	123.3
812	A	38	Very low	34.4	Very low	92 Å²	92	152.6 Å²	152.6	76%	0.76	80%	0.801	S	S	*	*			trans	-123.3	116.6	-160.8	0	0	0	0	0	113.2
813	Q	32.3	Very low	36.1	Very low	193 Å²	193	153.7 Å²	153.7	90%	0.902	79%	0.789	S	S	*	*			trans	-133.6	141.8	159.4	-71.2	-162.4	-7.1	0	0	112.4	R815	Q813-R815 PolarHBondContact O-N 3.48Å; Q813-R815 VanDerWaalsContact O-N 3.11Å
814	R	38.9	Very low	37.9	Very low	259 Å²	259	153.2 Å²	153.2	98%	0.977	78%	0.781	S	S	*	*			trans	-73.3	95.7	-169	-170.8	-175	-166.4	-177.2	5.5	111.5
815	R	32.1	Very low	39.3	Very low	235 Å²	235	151 Å²	151	89%	0.887	77%	0.771	S	S	*	*			trans	-101.2	138.1	-177.5	-151	176	-163.1	-178.1	5.3	112.7	Q813	Q813-R815 PolarHBondContact O-N 3.48Å; Q813-R815 VanDerWaalsContact O-N 3.11Å
816	V	36	Very low	40.3	Very low	132 Å²	132	149.1 Å²	149.1	80%	0.8	76%	0.764	S	S	*	*			trans	-78.3	127.6	173.1	177.2	0	0	0	0	109.7
817	T	34.7	Very low	42.3	Very low	134 Å²	134	148.5 Å²	148.5	82%	0.822	75%	0.754	S	S	*	*			trans	-86.4	106.4	174	48.5	0	0	0	0	111
818	V	42	Very low	44.3	Very low	132 Å²	132	144.5 Å²	144.5	80%	0.8	74%	0.738	S	S	*	*			trans	-73	131.7	160.2	178	0	0	0	0	107.8	E820	V818-E820 PolarHBondContact O-N 2.64Å
819	K	37.5	Very low	46.3	Very low	163 Å²	163	141.2 Å²	141.2	71%	0.709	72%	0.715	S	S	*	*			trans	-88.5	101.2	178.8	-169.2	-166.1	179.5	-155.2	0	109.4	E821	K819-E821 HydrophobicContact CD-CG 4.38Å; K819-E821 WeakPolarHBondContact CE-OE1 3.38Å; K819-E821 IonicContact NZ-OE1 3.44Å; K819-E821 PolarHBondContact NZ-OE1 3.06Å; K819-E821 PolarHBondContact O-N 3.03Å
820	E	45.6	Very low	48.4	Very low	173 Å²	173	140.7 Å²	140.7	81%	0.808	71%	0.708	S	S	*	*			trans	-77.3	107.8	174.4	-173.1	168.3	-141.6	0	0	109.9	V818	V818-E820 PolarHBondContact O-N 2.64Å
821	E	49	Very low	50.6	Low	127 Å²	127	134.9 Å²	134.9	59%	0.593	68%	0.684	S	S	*	*			trans	-90.8	118.2	171.9	-66.9	-168	155	0	0	109.4	K819 L823	K819-E821 HydrophobicContact CD-CG 4.38Å; K819-E821 WeakPolarHBondContact CE-OE1 3.38Å; K819-E821 IonicContact NZ-OE1 3.44Å; K819-E821 PolarHBondContact NZ-OE1 3.06Å; K819-E821 PolarHBondContact O-N 3.03Å; E821-L823 PolarHBondContact O-N 3.4Å
822	N	47.1	Very low	52.7	Low	156 Å²	156	130.6 Å²	130.6	83%	0.834	66%	0.661	S	S	*	*			trans	-70.1	100.1	170.1	-86.9	-108	0	0	0	108.4
823	L	59	Low	54.3	Low	94 Å²	94	129.8 Å²	129.8	49%	0.492	64%	0.642	S	S	.	*			trans	-75.3	130.7	166.7	-69.6	108	0	0	0	109.1	E821 Y827 L828	E821-L823 PolarHBondContact O-N 3.4Å; L823-Y827 HydrophobicContact CD2-CD1 3.51Å; L823-Y827 HydrophobicContact CD2-CE1 3.75Å; L823-Y827 HydrophobicContact CD2-CG 4.36Å; L823-L828 HydrophobicContact CB-CD2 4.32Å; L823-L828 HydrophobicContact CB-CG 4.38Å
824	D	66	Low	56.4	Low	136 Å²	136	125.2 Å²	125.2	73%	0.727	62%	0.623	S	S	*	*			trans	-54.6	139.3	175	-89.2	-45.7	0	0	0	111.2	A826 Y827 L828	D824-A826 PolarHBondContact O-N 2.91Å; D824-A826 VanDerWaalsContact O-N 3.08Å; D824-Y827 WeakPolarHBondContact O-CB 3.25Å; D824-Y827 PolarHBondContact O-N 2.9Å; D824-L828 PolarHBondContact O-N 3.35Å
825	Q	57.8	Low	58	Low	118 Å²	118	116.7 Å²	116.7	55%	0.551	60%	0.596	S	S	*	*	H	α-helix	trans	-53.8	-35.1	-178.3	-174.3	62.2	48.8	0	0	112.4	Y827 L828 D829	Q825-Y827 VanDerWaalsContact C-N 3.28Å; Q825-Y827 PolarHBondContact O-N 2.67Å; Q825-L828 PolarHBondContact O-N 3.09Å; Q825-D829 PolarHBondContact NE2-OD1 3.43Å; Q825-D829 WeakPolarHBondContact O-CB 3.27Å; Q825-D829 VanDerWaalsContact O-CG 3.25Å; Q825-D829 PolarHBondContact O-N 2.96Å
826	A	61.9	Low	59.8	Low	68 Å²	68	111.9 Å²	111.9	56%	0.562	58%	0.578	S	S	*	*	H	α-helix	trans	-59.4	-35.5	175.8	0	0	0	0	0	113.2	D824 D829 D830	D824-A826 PolarHBondContact O-N 2.91Å; D824-A826 VanDerWaalsContact O-N 3.08Å; A826-D829 PolarHBondContact O-N 3.45Å; A826-D830 WeakPolarHBondContact O-CB 3.43Å; A826-D830 PolarHBondContact O-N 2.95Å
827	Y	67.8	Low	61.1	Low	143 Å²	143	111.4 Å²	111.4	56%	0.561	57%	0.565	S	S	*	*	H	α-helix	trans	-73.8	-36.6	177.3	-166.4	-89	0	0	0	111.5	L823 D824 Q825 V831	L823-Y827 HydrophobicContact CD2-CD1 3.51Å; L823-Y827 HydrophobicContact CD2-CE1 3.75Å; L823-Y827 HydrophobicContact CD2-CG 4.36Å; D824-Y827 WeakPolarHBondContact O-CB 3.25Å; D824-Y827 PolarHBondContact O-N 2.9Å; Q825-Y827 VanDerWaalsContact C-N 3.28Å; Q825-Y827 PolarHBondContact O-N 2.67Å; Y827-V831 HydrophobicContact CD1-CG2 4.18Å; Y827-V831 HydrophobicContact CE1-CG2 4Å; Y827-V831 WeakPolarHBondContact O-CB 3.43Å; Y827-V831 VanDerWaalsContact O-CG2 3.27Å; Y827-V831 WeakPolarHBondContact O-CG2 3.43Å; Y827-V831 PolarHBondContact O-N 3.06Å
828	L	70.9	Confident	62.5	Low	69 Å²	69	111.4 Å²	111.4	36%	0.361	56%	0.56	S	S	.	*	H	α-helix	trans	-67.3	-38	172.5	-62.8	177.2	0	0	0	111.4	L823 D824 Q825 N832	L823-L828 HydrophobicContact CB-CD2 4.32Å; L823-L828 HydrophobicContact CB-CG 4.38Å; D824-L828 PolarHBondContact O-N 3.35Å; Q825-L828 PolarHBondContact O-N 3.09Å; L828-N832 VanDerWaalsContact O-CB 3.27Å; L828-N832 WeakPolarHBondContact O-CB 3.39Å; L828-N832 VanDerWaalsContact O-CG 3.25Å; L828-N832 PolarHBondContact O-N 2.82Å; L828-N832 PolarHBondContact O-ND2 2.82Å
829	D	68.6	Low	63.5	Low	78 Å²	78	111.9 Å²	111.9	42%	0.417	56%	0.557	S	S	.	*	H	α-helix	trans	-69.1	-41.8	178.6	-71	-12.7	0	0	0	112	Q825 A826 N832 E833	Q825-D829 PolarHBondContact NE2-OD1 3.43Å; Q825-D829 WeakPolarHBondContact O-CB 3.27Å; Q825-D829 VanDerWaalsContact O-CG 3.25Å; Q825-D829 PolarHBondContact O-N 2.96Å; A826-D829 PolarHBondContact O-N 3.45Å; D829-N832 CarbonylContact O-C 3.56Å; D829-N832 PolarHBondContact O-N 2.85Å; D829-E833 WeakPolarHBondContact O-CB 3.35Å; D829-E833 PolarHBondContact O-N 2.71Å
830	D	74.4	Confident	64.4	Low	105 Å²	105	108.7 Å²	108.7	56%	0.561	55%	0.551	S	S	*	*	H	α-helix	trans	-60.2	-48.6	171.6	-94.1	1.6	0	0	0	111.5	A826 N832 E833 I834	A826-D830 WeakPolarHBondContact O-CB 3.43Å; A826-D830 PolarHBondContact O-N 2.95Å; D830-N832 VanDerWaalsContact C-N 3.3Å; D830-N832 PolarHBondContact O-N 2.91Å; D830-E833 WeakPolarHBondContact O-CA 3.46Å; D830-E833 WeakPolarHBondContact O-CB 3.27Å; D830-E833 PolarHBondContact O-N 2.96Å; D830-I834 WeakPolarHBondContact O-CG1 3.47Å; D830-I834 PolarHBondContact O-N 2.67Å
831	V	74.4	Confident	64.8	Low	56 Å²	56	103.8 Å²	103.8	34%	0.339	55%	0.547	S	S	.	.	H	α-helix	trans	-60.3	-41.5	176.1	167.5	0	0	0	0	110.8	Y827 E833 I834 I835	Y827-V831 HydrophobicContact CD1-CG2 4.18Å; Y827-V831 HydrophobicContact CE1-CG2 4Å; Y827-V831 WeakPolarHBondContact O-CB 3.43Å; Y827-V831 VanDerWaalsContact O-CG2 3.27Å; Y827-V831 WeakPolarHBondContact O-CG2 3.43Å; Y827-V831 PolarHBondContact O-N 3.06Å; V831-E833 VanDerWaalsContact C-N 3.32Å; V831-E833 PolarHBondContact O-N 2.91Å; V831-I834 PolarHBondContact O-N 3.07Å; V831-I835 HydrophobicContact CG1-CD1 3.71Å; V831-I835 HydrophobicContact CG1-CG1 4.48Å; V831-I835 WeakPolarHBondContact O-CB 3.5Å; V831-I835 VanDerWaalsContact O-CG1 3.25Å; V831-I835 WeakPolarHBondContact O-CG1 3.47Å; V831-I835 PolarHBondContact O-N 3.08Å
832	N	72.9	Confident	64.4	Low	79 Å²	79	103.1 Å²	103.1	42%	0.422	55%	0.552	S	S	.	*	H	α-helix	trans	-67.9	-27.2	173.8	-77.6	-45.4	0	0	0	113	L828 D829 D830 R836	L828-N832 VanDerWaalsContact O-CB 3.27Å; L828-N832 WeakPolarHBondContact O-CB 3.39Å; L828-N832 VanDerWaalsContact O-CG 3.25Å; L828-N832 PolarHBondContact O-N 2.82Å; L828-N832 PolarHBondContact O-ND2 2.82Å; D829-N832 CarbonylContact O-C 3.56Å; D829-N832 PolarHBondContact O-N 2.85Å; D830-N832 VanDerWaalsContact C-N 3.3Å; D830-N832 PolarHBondContact O-N 2.91Å; N832-R836 VanDerWaalsContact O-CB 3.31Å; N832-R836 WeakPolarHBondContact O-CB 3.5Å; N832-R836 VanDerWaalsContact O-CG 3.22Å; N832-R836 WeakPolarHBondContact O-CG 3.37Å; N832-R836 PolarHBondContact O-N 3.32Å; N832-R836 PolarHBondContact O-NE 2.81Å
833	E	70.7	Confident	64.2	Low	76 Å²	76	103.8 Å²	103.8	36%	0.355	55%	0.55	S	S	.	.	H	α-helix	trans	-74	-41	174.9	-140.7	-103.7	128.3	0	0	111.4	D829 D830 V831 R836 K837	D829-E833 WeakPolarHBondContact O-CB 3.35Å; D829-E833 PolarHBondContact O-N 2.71Å; D830-E833 WeakPolarHBondContact O-CA 3.46Å; D830-E833 WeakPolarHBondContact O-CB 3.27Å; D830-E833 PolarHBondContact O-N 2.96Å; V831-E833 VanDerWaalsContact C-N 3.32Å; V831-E833 PolarHBondContact O-N 2.91Å; E833-R836 VanDerWaalsContact CA-NH2 3.28Å; E833-R836 PolarHBondContact O-N 3Å; E833-K837 WeakPolarHBondContact O-CB 3.49Å; E833-K837 WeakPolarHBondContact O-CG 3.44Å; E833-K837 PolarHBondContact O-N 2.82Å; E833-K837 WeakPolarHBondContact OE1-CE 3.27Å; E833-K837 IonicContact OE1-NZ 2.95Å; E833-K837 PolarHBondContact OE1-NZ 3.17Å; E833-K837 IonicContact OE2-NZ 2.7Å; E833-K837 PolarHBondContact OE2-NZ 2.93Å
834	I	76.6	Confident	63.2	Low	96 Å²	96	103.9 Å²	103.9	49%	0.492	56%	0.564	S	S	.	*	H	α-helix	trans	-62.6	-49.9	171.8	-65.4	163.7	0	0	0	110.3	D830 V831 R836 K837 D838	D830-I834 WeakPolarHBondContact O-CG1 3.47Å; D830-I834 PolarHBondContact O-N 2.67Å; V831-I834 PolarHBondContact O-N 3.07Å; I834-R836 VanDerWaalsContact C-N 3.3Å; I834-R836 PolarHBondContact O-N 3.36Å; I834-K837 WeakPolarHBondContact O-CB 2.97Å; I834-K837 PolarHBondContact O-N 3.05Å; I834-K837 VanDerWaalsContact O-N 3.09Å; I834-D838 PolarHBondContact O-N 2.86Å
835	I	73.9	Confident	61.9	Low	80 Å²	80	104.6 Å²	104.6	41%	0.41	56%	0.557	S	S	.	*	H	α-helix	trans	-60.4	-38.6	177.5	-71.9	169.2	0	0	0	111.4	V831 L839	V831-I835 HydrophobicContact CG1-CD1 3.71Å; V831-I835 HydrophobicContact CG1-CG1 4.48Å; V831-I835 WeakPolarHBondContact O-CB 3.5Å; V831-I835 VanDerWaalsContact O-CG1 3.25Å; V831-I835 WeakPolarHBondContact O-CG1 3.47Å; V831-I835 PolarHBondContact O-N 3.08Å; I835-L839 HydrophobicContact CG2-CD1 3.65Å; I835-L839 HydrophobicContact CG2-CG 4.4Å; I835-L839 VanDerWaalsContact O-CB 3.27Å; I835-L839 WeakPolarHBondContact O-CB 3.26Å; I835-L839 WeakPolarHBondContact O-CG 3.32Å; I835-L839 PolarHBondContact O-N 3.34Å
836	R	68.3	Low	60.9	Low	135 Å²	135	102.6 Å²	102.6	51%	0.509	57%	0.567	S	S	.	*	H	α-helix	trans	-66.4	-40.2	173	-80.4	173.7	-69.6	151.2	-2.1	112.6	N832 E833 I834 T840	N832-R836 VanDerWaalsContact O-CB 3.31Å; N832-R836 WeakPolarHBondContact O-CB 3.5Å; N832-R836 VanDerWaalsContact O-CG 3.22Å; N832-R836 WeakPolarHBondContact O-CG 3.37Å; N832-R836 PolarHBondContact O-N 3.32Å; N832-R836 PolarHBondContact O-NE 2.81Å; E833-R836 VanDerWaalsContact CA-NH2 3.28Å; E833-R836 PolarHBondContact O-N 3Å; I834-R836 VanDerWaalsContact C-N 3.3Å; I834-R836 PolarHBondContact O-N 3.36Å; R836-T840 VanDerWaalsContact O-CB 3.32Å; R836-T840 WeakPolarHBondContact O-CB 3.09Å; R836-T840 VanDerWaalsContact O-CG2 3.26Å; R836-T840 WeakPolarHBondContact O-CG2 3.49Å; R836-T840 PolarHBondContact O-N 2.87Å; R836-T840 PolarHBondContact O-OG1 3.49Å
837	K	64.4	Low	59.6	Low	121 Å²	121	107.3 Å²	107.3	53%	0.526	58%	0.578	S	S	.	*	H	α-helix	trans	-61.5	-45.4	175.7	-83.7	162.9	167.9	155.4	0	111.8	E833 I834	E833-K837 WeakPolarHBondContact O-CB 3.49Å; E833-K837 WeakPolarHBondContact O-CG 3.44Å; E833-K837 PolarHBondContact O-N 2.82Å; E833-K837 WeakPolarHBondContact OE1-CE 3.27Å; E833-K837 IonicContact OE1-NZ 2.95Å; E833-K837 PolarHBondContact OE1-NZ 3.17Å; E833-K837 IonicContact OE2-NZ 2.7Å; E833-K837 PolarHBondContact OE2-NZ 2.93Å; I834-K837 WeakPolarHBondContact O-CB 2.97Å; I834-K837 PolarHBondContact O-N 3.05Å; I834-K837 VanDerWaalsContact O-N 3.09Å
838	D	63.1	Low	58.2	Low	134 Å²	134	104.7 Å²	104.7	72%	0.717	58%	0.577	S	S	*	*	H	α-helix	trans	-71.2	-39.6	179.4	-75.6	-9.6	0	0	0	112.6	I834	I834-D838 PolarHBondContact O-N 2.86Å
839	L	62.8	Low	57.5	Low	143 Å²	143	106.5 Å²	106.5	75%	0.749	59%	0.588	S	S	*	*	H	α-helix	trans	-74.5	-30.4	179.1	-76.8	171.3	0	0	0	114.4	I835	I835-L839 HydrophobicContact CG2-CD1 3.65Å; I835-L839 HydrophobicContact CG2-CG 4.4Å; I835-L839 VanDerWaalsContact O-CB 3.27Å; I835-L839 WeakPolarHBondContact O-CB 3.26Å; I835-L839 WeakPolarHBondContact O-CG 3.32Å; I835-L839 PolarHBondContact O-N 3.34Å
840	T	57.2	Low	56.9	Low	95 Å²	95	108 Å²	108	58%	0.583	60%	0.597	S	S	*	*	H	α-helix	trans	-81.6	-20.5	-177.1	53.2	0	0	0	0	113.6	R836 V842	R836-T840 VanDerWaalsContact O-CB 3.32Å; R836-T840 WeakPolarHBondContact O-CB 3.09Å; R836-T840 VanDerWaalsContact O-CG2 3.26Å; R836-T840 WeakPolarHBondContact O-CG2 3.49Å; R836-T840 PolarHBondContact O-N 2.87Å; R836-T840 PolarHBondContact O-OG1 3.49Å; T840-V842 WeakPolarHBondContact O-CG2 3.22Å; T840-V842 PolarHBondContact O-N 2.82Å
841	G	54	Low	56	Low	70 Å²	70	108.2 Å²	108.2	72%	0.722	60%	0.598	S	S	*	*			trans	61.2	9.5	167.6	0	0	0	0	0	116.3
842	V	41.4	Very low	54.9	Low	114 Å²	114	111.2 Å²	111.2	69%	0.691	61%	0.614	S	S	*	*			trans	-110.4	115.8	-175.1	168.1	0	0	0	0	109.5	T840 A844	T840-V842 WeakPolarHBondContact O-CG2 3.22Å; T840-V842 PolarHBondContact O-N 2.82Å; V842-A844 PolarHBondContact O-N 3.32Å
843	Q	42.2	Very low	53.8	Low	170 Å²	170	113.3 Å²	113.3	79%	0.794	63%	0.626	S	S	*	*			trans	-61.3	111.2	159	-73.1	-175	-9.5	0	0	108.2	R845	Q843-R845 PolarHBondContact O-N 3.4Å
844	A	38.1	Very low	52.6	Low	96 Å²	96	115.7 Å²	115.7	79%	0.793	64%	0.644	S	S	*	*			trans	-68.4	73.3	169.1	0	0	0	0	0	110	V842 G846	V842-A844 PolarHBondContact O-N 3.32Å; A844-G846 PolarHBondContact O-N 3.01Å
845	R	38.7	Very low	50.9	Low	151 Å²	151	117.1 Å²	117.1	57%	0.57	66%	0.655	S	S	*	*			trans	-56	106.9	160.4	-92.7	-175.1	171.6	172.4	-2.3	106.4	Y191 E192 Q843 Q847	Y191-R845 VanDerWaalsContact CE1-CZ 3.41Å; E192-R845 IonicContact OE2-NH1 3.92Å; E192-R845 PolarHBondContact OE2-NH1 2.8Å; Q843-R845 PolarHBondContact O-N 3.4Å; R845-Q847 PolarHBondContact O-N 2.81Å
846	G	37.3	Very low	49.1	Very low	75 Å²	75	120 Å²	120	77%	0.773	67%	0.673	S	S	*	*			trans	-57.7	101.7	175.3	0	0	0	0	0	109.9	A844 T848	A844-G846 PolarHBondContact O-N 3.01Å; G846-T848 PolarHBondContact O-N 3.41Å
847	Q	33.8	Very low	47.6	Very low	167 Å²	167	118.8 Å²	118.8	78%	0.78	69%	0.687	S	S	*	*			trans	-63.3	98.6	153.1	-85.3	-168.9	-7.5	0	0	107.2	R845	R845-Q847 PolarHBondContact O-N 2.81Å
848	T	37.7	Very low	46	Very low	89 Å²	89	118.5 Å²	118.5	55%	0.546	70%	0.702	S	S	.	*			trans	71	0	133.2	72.8	0	0	0	0	118.8	R189 T190 G846	R189-T848 HydrophobicContact CB-CG2 3.79Å; R189-T848 HydrophobicContact CG-CG2 4Å; R189-T848 VanDerWaalsContact CZ-CB 3.5Å; R189-T848 VanDerWaalsContact NE-C 3.29Å; R189-T848 PolarHBondContact NE-OXT 2.65Å; R189-T848 PolarHBondContact NH1-OG1 3.11Å; R189-T848 VanDerWaalsContact NH1-OG1 3.07Å; R189-T848 PolarHBondContact NH2-O 2.94Å; R189-T848 PolarHBondContact NH2-OXT 2.77Å; T190-T848 HydrophobicContact CG2-CG2 3.46Å; T190-T848 VanDerWaalsContact CG2-CG2 3.46Å; T190-T848 WeakPolarHBondContact OG1-CG2 3.31Å; G846-T848 PolarHBondContact O-N 3.41Å

Retrieved 848 of 848 residues in 110.5 ms (Link to these results)

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