CPEB4_HUMAN Loading...

Cytoplasmic polyadenylation element-binding protein 4

Sequence-specific RNA-binding protein that binds to the cytoplasmic polyadenylation element (CPE), an uridine-rich sequence element (consensus sequence 5'-UUUUUAU-3') within the mRNA 3'-UTR¹. RNA binding results in a clear conformational change analogous to the Venus fly trap mechanism². Regulates activation of unfolded protein response (UPR) in the process of adaptation to ER stress in liver, by maintaining translation of CPE-regulated mRNAs in conditions in which global protein synthesis is inhibited (By similarity). Required for cell cycle progression, specifically for cytokinesis and chromosomal segregation³. Plays a role as an oncogene promoting tumor growth and progression by positively regulating translation of t-plasminogen activator/PLAT⁴. Stimulates proliferation of melanocytes⁵. In contrast to CPEB1 and CPEB3, does not play role in synaptic plasticity, learning and memory (By similarity).

AlphaFold DB , UniProt , Accession Q17RY0, Species HUMAN (Homo sapiens, Human), Gene CPEB4, Length 729 aa.

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	M	31.2	Very low	36.7	Very low	216 Å²	216	139 Å²	139	100%	1.064	79%	0.788	S	S	*	*				0	143.7	0	-78.3	51.9	173.2	0	0	107.7
2	G	40.5	Very low	36.6	Very low	57 Å²	57	136.1 Å²	136.1	59%	0.588	78%	0.783	S	S	*	*			trans	-178.3	139.7	-179.2	0	0	0	0	0	108.4	Y4	G2-Y4 PolarHBondContact O-N 3.36Å
3	D	34.9	Very low	36.1	Very low	166 Å²	166	136.8 Å²	136.8	89%	0.888	78%	0.783	S	S	*	*			trans	-70.3	117.5	-156.2	-62.1	-97.9	0	0	0	115.1
4	Y	41.2	Very low	36.1	Very low	209 Å²	209	136.2 Å²	136.2	82%	0.82	78%	0.783	S	S	*	*			trans	-125.1	83.9	160.4	-82.3	-81.1	0	0	0	109	G2 F6	G2-Y4 PolarHBondContact O-N 3.36Å; Y4-F6 PolarHBondContact O-N 2.96Å
5	G	38.2	Very low	35.9	Very low	78 Å²	78	132 Å²	132	80%	0.804	78%	0.781	S	S	*	*			trans	-59.8	121.7	-178.9	0	0	0	0	0	112.2	G7	G5-G7 PolarHBondContact O-N 3Å
6	F	39.4	Very low	36.1	Very low	165 Å²	165	134.2 Å²	134.2	72%	0.724	79%	0.788	S	S	*	*			trans	-77	90	-178.4	-124.8	-104.2	0	0	0	110.7	Y4 V8	Y4-F6 PolarHBondContact O-N 2.96Å; F6-V8 PolarHBondContact O-N 2.64Å
7	G	35.5	Very low	36.1	Very low	76 Å²	76	138.9 Å²	138.9	78%	0.784	80%	0.796	S	S	*	*			trans	-62.9	99	172.8	0	0	0	0	0	111.5	G5 L9	G5-G7 PolarHBondContact O-N 3Å; G7-L9 PolarHBondContact O-N 2.78Å
8	V	38.8	Very low	36.3	Very low	94 Å²	94	136.9 Å²	136.9	57%	0.57	79%	0.793	S	S	*	*			trans	-77.2	110.8	169.7	178.2	0	0	0	0	108	F6 V10	F6-V8 PolarHBondContact O-N 2.64Å; V8-V10 VanDerWaalsContact C-N 3.31Å; V8-V10 HydrophobicContact CG1-CG2 4.11Å; V8-V10 PolarHBondContact O-N 3.23Å
9	L	34.6	Very low	36.4	Very low	170 Å²	170	135 Å²	135	89%	0.89	79%	0.794	S	S	*	*			trans	-73.1	84.7	175.3	-165.4	101.6	0	0	0	109.9	G7 Q11	G7-L9 PolarHBondContact O-N 2.78Å; L9-Q11 PolarHBondContact O-N 3.36Å
10	V	37.1	Very low	36.3	Very low	107 Å²	107	138.1 Å²	138.1	65%	0.648	80%	0.798	S	S	*	*			trans	-70.2	121	169.5	178.4	0	0	0	0	108.2	V8 S12	V8-V10 VanDerWaalsContact C-N 3.31Å; V8-V10 HydrophobicContact CG1-CG2 4.11Å; V8-V10 PolarHBondContact O-N 3.23Å; V10-S12 PolarHBondContact O-N 3.07Å
11	Q	32.8	Very low	36.5	Very low	191 Å²	191	137.1 Å²	137.1	89%	0.893	80%	0.797	S	S	*	*			trans	-71.9	101.8	178.6	-165.8	171	21.1	0	0	109.6	L9	L9-Q11 PolarHBondContact O-N 3.36Å
12	S	35	Very low	37	Very low	104 Å²	104	133 Å²	133	73%	0.727	78%	0.783	S	S	*	*			trans	-113.8	108.1	177.9	-64.5	0	0	0	0	110.4	V10	V10-S12 PolarHBondContact O-N 3.07Å
13	N	29.9	Very low	36.9	Very low	146 Å²	146	141.9 Å²	141.9	78%	0.781	80%	0.799	S	S	*	*			trans	-80.7	161.1	170.6	-170.5	12.3	0	0	0	110.7
14	T	36.9	Very low	37.1	Very low	128 Å²	128	143.4 Å²	143.4	79%	0.785	80%	0.798	S	S	*	*	S	Bend	trans	66.3	133.2	-178	74.4	0	0	0	0	114.7
15	G	32.6	Very low	37.4	Very low	73 Å²	73	142.3 Å²	142.3	75%	0.753	80%	0.8	S	S	*	*			trans	-100	145.2	-176.2	0	0	0	0	0	112.7
16	N	38.2	Very low	37.9	Very low	167 Å²	167	144 Å²	144	89%	0.893	80%	0.797	S	S	*	*			trans	-147.2	147.2	143.9	-118.9	-29.6	0	0	0	110.4
17	K	36.2	Very low	38	Very low	214 Å²	214	144.9 Å²	144.9	93%	0.93	80%	0.803	S	S	*	*			trans	-98.6	113.8	-169	-57.2	174.9	-173	176.3	0	110
18	S	39.6	Very low	38.5	Very low	104 Å²	104	149.3 Å²	149.3	73%	0.727	81%	0.808	S	S	*	*			trans	-128.5	115.8	168.6	48.4	0	0	0	0	110.1
19	A	39.3	Very low	38.6	Very low	100 Å²	100	153.1 Å²	153.1	83%	0.826	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-98	130.2	179.9	0	0	0	0	0	110.5
20	F	33.3	Very low	39	Very low	196 Å²	196	150.4 Å²	150.4	86%	0.86	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-94.9	125.3	167.9	-78.3	-85.4	0	0	0	109.8
21	P	40.3	Very low	39.7	Very low	119 Å²	119	151.1 Å²	151.1	77%	0.773	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-82.8	126.2	180	31.3	-32.8	0	0	0	111.7
22	V	41.8	Very low	40.1	Very low	129 Å²	129	149.2 Å²	149.2	78%	0.782	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-75.5	129	165.7	-179.6	0	0	0	0	108.8
23	R	39.9	Very low	40.5	Very low	243 Å²	243	152.3 Å²	152.3	92%	0.917	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-72.7	129.5	176.9	-74.6	179.9	170.5	170.1	-3.7	111
24	F	38.8	Very low	41.1	Very low	199 Å²	199	152.6 Å²	152.6	87%	0.873	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-91.6	150.3	160.3	-78.5	-92.2	0	0	0	110.6
25	H	46.4	Very low	41.3	Very low	185 Å²	185	153.5 Å²	153.5	86%	0.856	80%	0.804	S	S	*	*	P	Polyproline II helix	trans	-82.2	144.5	176.4	-121	-104.5	0	0	0	111
26	P	48.6	Very low	41.5	Very low	115 Å²	115	157.3 Å²	157.3	75%	0.747	81%	0.807	S	S	*	*	P	Polyproline II helix	trans	-79.6	156.8	-177.1	31.9	-35.7	0	0	0	114
27	H	41.6	Very low	41.6	Very low	183 Å²	183	153 Å²	153	85%	0.847	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-69.3	158.6	176.7	-89.1	-98.3	0	0	0	114.3
28	L	46.6	Very low	41.7	Very low	169 Å²	169	149 Å²	149	89%	0.885	79%	0.788	S	S	*	*			trans	-108.3	154.4	150.1	-77.7	168.8	0	0	0	110
29	Q	42.2	Very low	42.1	Very low	173 Å²	173	149 Å²	149	81%	0.808	79%	0.786	S	S	*	*	P	Polyproline II helix	trans	-100.3	153.2	-163.4	-57.3	167	-77.2	0	0	114.1
30	P	41.2	Very low	42.1	Very low	114 Å²	114	149.6 Å²	149.6	74%	0.74	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-95.1	149	146	36	-29.2	0	0	0	111.4
31	P	52.9	Low	42.9	Very low	121 Å²	121	145.8 Å²	145.8	79%	0.786	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-88.4	158.2	-178.2	34	-34.9	0	0	0	115.4
32	H	41.8	Very low	42.8	Very low	151 Å²	151	144.9 Å²	144.9	70%	0.699	78%	0.781	S	S	*	*			trans	-44.3	161.9	174.5	-49.3	-84.7	0	0	0	115.7
33	H	42.5	Very low	42.7	Very low	170 Å²	170	142.1 Å²	142.1	79%	0.787	77%	0.772	S	S	*	*			cis	-138.7	-166.1	30.2	-68.5	-100.6	0	0	0	111.5
34	H	41.8	Very low	42.7	Very low	151 Å²	151	139.9 Å²	139.9	70%	0.699	77%	0.769	S	S	*	*			cis	-154.8	-179.3	13.3	-159.4	-96.3	0	0	0	113.7
35	Q	40.8	Very low	42.9	Very low	147 Å²	147	137.4 Å²	137.4	69%	0.687	76%	0.763	S	S	*	*			trans	-74.4	163.3	174.2	-54.2	153.1	-6.1	0	0	111.5
36	N	38.7	Very low	42.6	Very low	154 Å²	154	135 Å²	135	82%	0.824	76%	0.757	S	S	*	*			cis	-162.2	-177	11.2	-137.2	-2.3	0	0	0	108.9
37	A	39.2	Very low	42.3	Very low	75 Å²	75	135.2 Å²	135.2	62%	0.62	75%	0.752	S	S	*	*			cis	-152.6	-133.9	1	0	0	0	0	0	112.1
38	T	38.3	Very low	42.1	Very low	130 Å²	130	132.8 Å²	132.8	80%	0.798	75%	0.745	S	S	*	*			trans	-162.5	-176.9	-156.6	43.9	0	0	0	0	111.8
39	P	48.4	Very low	41.7	Very low	106 Å²	106	131.3 Å²	131.3	69%	0.688	74%	0.743	S	S	*	*				-144.8	171.9	-50.7	42.5	-25.6	0	0	0	117.7
40	S	38.6	Very low	41.4	Very low	112 Å²	112	127.6 Å²	127.6	78%	0.783	74%	0.742	S	S	*	*			trans	67.2	174.5	142.7	-68.7	0	0	0	0	122.6
41	P	50.5	Low	41.2	Very low	115 Å²	115	126.4 Å²	126.4	75%	0.747	74%	0.742	S	S	*	*				-143.8	-177.2	-51.6	43.2	-26.5	0	0	0	117.4
42	A	38.1	Very low	40.2	Very low	100 Å²	100	128.5 Å²	128.5	83%	0.826	75%	0.747	S	S	*	*			trans	75	154.1	150.9	0	0	0	0	0	121.6
43	A	40.2	Very low	39.7	Very low	71 Å²	71	124 Å²	124	59%	0.587	74%	0.741	S	S	*	*			cis	-170.7	174.7	-16.6	0	0	0	0	0	114.3
44	F	39.9	Very low	39.2	Very low	196 Å²	196	121.5 Å²	121.5	86%	0.86	74%	0.743	S	S	*	*			trans	76.8	152.9	161.2	-55.7	-58.1	0	0	0	119.9
45	I	43.1	Very low	38.7	Very low	147 Å²	147	120.1 Å²	120.1	75%	0.754	75%	0.75	S	S	*	*			cis	-157.4	150.7	1	-126	162.4	0	0	0	113.8
46	N	39.5	Very low	38.6	Very low	136 Å²	136	117.9 Å²	117.9	73%	0.727	76%	0.757	S	S	*	*			trans	31.1	151.9	151.2	-133.3	22.4	0	0	0	123.3
47	N	41.8	Very low	38.2	Very low	118 Å²	118	114 Å²	114	63%	0.631	75%	0.752	S	S	*	*			cis	-168.1	172.6	29	-163.4	11.1	0	0	0	114.5
48	N	38.7	Very low	37.9	Very low	133 Å²	133	116.4 Å²	116.4	71%	0.711	77%	0.765	S	S	*	*			trans	-30.8	166.7	173.6	-62.5	-21.2	0	0	0	120.6
49	T	37.5	Very low	37.8	Very low	137 Å²	137	114.1 Å²	114.1	84%	0.84	76%	0.76	S	S	*	*			cis	-156.6	168.9	23.6	-24.5	0	0	0	0	112.9
50	A	36.3	Very low	37	Very low	95 Å²	95	120.1 Å²	120.1	79%	0.785	77%	0.768	S	S	*	*			trans	-88.8	-178.6	174.8	0	0	0	0	0	112.7
51	A	36.2	Very low	36.7	Very low	90 Å²	90	120.9 Å²	120.9	74%	0.744	76%	0.763	S	S	*	*			cis	-157.9	-170.2	7.5	0	0	0	0	0	108.6
52	N	33.3	Very low	36.1	Very low	165 Å²	165	124.3 Å²	124.3	88%	0.882	77%	0.767	S	S	*	*			cis	-162.3	169.6	-0.7	-158.1	-2.3	0	0	0	110.9
53	G	29.7	Very low	36.1	Very low	57 Å²	57	125.5 Å²	125.5	59%	0.588	77%	0.766	S	S	*	*			trans	97.4	95.3	137.4	0	0	0	0	0	121.6
54	S	32	Very low	35.8	Very low	117 Å²	117	126.2 Å²	126.2	82%	0.818	77%	0.772	S	S	*	*				174.6	129.2	129.1	-82.5	0	0	0	0	115.1
55	S	31.9	Very low	36	Very low	122 Å²	122	123.1 Å²	123.1	85%	0.853	77%	0.771	S	S	*	*			trans	69.3	163.8	153.6	80.2	0	0	0	0	121.3
56	A	38.7	Very low	35.6	Very low	100 Å²	100	120.7 Å²	120.7	83%	0.826	77%	0.773	S	S	*	*			trans	70.5	109.2	162.7	0	0	0	0	0	121.4
57	G	30.4	Very low	35.2	Very low	71 Å²	71	121 Å²	121	73%	0.732	78%	0.78	S	S	*	*				76.5	115.8	112.6	0	0	0	0	0	122.3
58	S	33.5	Very low	35	Very low	126 Å²	126	123.3 Å²	123.3	88%	0.881	79%	0.787	S	S	*	*			trans	84.7	147.3	139.8	-55.2	0	0	0	0	122
59	A	35.2	Very low	34.6	Very low	83 Å²	83	122.6 Å²	122.6	69%	0.686	78%	0.783	S	S	*	*			trans	73.2	102.9	148.8	0	0	0	0	0	122.2
60	W	32.8	Very low	34.9	Very low	231 Å²	231	122.8 Å²	122.8	88%	0.875	78%	0.778	S	S	*	*				69.1	133.9	120.6	-73.9	117.8	0	0	0	123.7
61	L	31.1	Very low	34.6	Very low	129 Å²	129	124.7 Å²	124.7	68%	0.675	77%	0.77	S	S	*	*			trans	89.6	102.4	152.2	-61.3	159.9	0	0	0	121.8
62	F	38.8	Very low	34.6	Very low	187 Å²	187	127 Å²	127	82%	0.82	77%	0.77	S	S	*	*			trans	58.4	160.6	143	-57	-60.2	0	0	0	119.4
63	P	38.4	Very low	34.7	Very low	125 Å²	125	126.8 Å²	126.8	81%	0.812	76%	0.764	S	S	*	*				-130.9	168.9	68.1	33.4	-15.9	0	0	0	115
64	A	32	Very low	35.2	Very low	85 Å²	85	130.1 Å²	130.1	70%	0.702	77%	0.767	S	S	*	*			trans	-97.8	152.2	165.1	0	0	0	0	0	110.6	A66	A64-A66 PolarHBondContact O-N 3.19Å
65	P	45.3	Very low	35.5	Very low	132 Å²	132	132.6 Å²	132.6	86%	0.857	77%	0.77	S	S	*	*			trans	-73.5	114	174	29.7	-32.7	0	0	0	110.4
66	A	34.6	Very low	35.7	Very low	95 Å²	95	129.9 Å²	129.9	79%	0.785	76%	0.761	S	S	*	*			trans	-77.8	143.6	175.8	0	0	0	0	0	111.7	A64	A64-A66 PolarHBondContact O-N 3.19Å
67	T	30.8	Very low	35.6	Very low	144 Å²	144	130.7 Å²	130.7	88%	0.883	76%	0.761	S	S	*	*			trans	-71.2	124.5	168	48.6	0	0	0	0	110.2
68	H	37.9	Very low	36	Very low	165 Å²	165	134.7 Å²	134.7	76%	0.764	76%	0.76	S	S	*	*			trans	-108.7	117.9	168.7	-135.6	-74.3	0	0	0	110.5	I70	H68-I70 WeakPolarHBondContact ND1-CG1 3.33Å
69	N	29.9	Very low	35.9	Very low	119 Å²	119	136.3 Å²	136.3	64%	0.636	75%	0.752	S	S	*	*			trans	-93.6	131.7	165.5	-179.7	33.7	0	0	0	107.7	Q71	N69-Q71 PolarHBondContact ND2-OE1 3.38Å
70	I	43.1	Very low	36	Very low	141 Å²	141	136.6 Å²	136.6	72%	0.723	75%	0.754	S	S	*	*			trans	-138.3	130	167.6	-60.6	-175.6	0	0	0	106.4	H68	H68-I70 WeakPolarHBondContact ND1-CG1 3.33Å
71	Q	30.5	Very low	35.9	Very low	134 Å²	134	134.8 Å²	134.8	63%	0.626	75%	0.752	S	S	*	*			trans	-105.6	173.2	176.8	-76.3	168.5	-127.6	0	0	110.1	N69	N69-Q71 PolarHBondContact ND2-OE1 3.38Å
72	D	36.9	Very low	35.7	Very low	140 Å²	140	133.2 Å²	133.2	75%	0.749	75%	0.752	S	S	*	*			trans	72.9	142.2	169.7	-54.5	-62	0	0	0	114.5
73	E	36.2	Very low	35.2	Very low	159 Å²	159	131.6 Å²	131.6	74%	0.743	75%	0.747	S	S	*	*			cis	-154.2	-179.6	7.8	-142.4	-169.5	123	0	0	112.6
74	I	40.1	Very low	34.8	Very low	128 Å²	128	132.9 Å²	132.9	66%	0.656	74%	0.742	S	S	*	*			trans	85	99	150.9	-71.7	160.7	0	0	0	120.6
75	L	37	Very low	34.7	Very low	169 Å²	169	136.2 Å²	136.2	89%	0.885	74%	0.743	S	S	*	*			trans	74.5	136.8	135.4	-88.4	62.9	0	0	0	124.6
76	G	37.2	Very low	33.9	Very low	65 Å²	65	136 Å²	136	67%	0.67	73%	0.731	S	S	*	*			trans	105.6	92.7	160.9	0	0	0	0	0	114.7
77	S	36.6	Very low	33.6	Very low	116 Å²	116	138.4 Å²	138.4	81%	0.811	73%	0.725	S	S	*	*			cis	67.1	130.1	40.8	-46.6	0	0	0	0	113
78	E	37.5	Very low	33.8	Very low	155 Å²	155	139.7 Å²	139.7	72%	0.724	72%	0.722	S	S	*	*			cis	-131	-120	1.8	-96.2	-115.8	125.2	0	0	114.7
79	K	32.5	Very low	33.5	Very low	161 Å²	161	139 Å²	139	70%	0.7	72%	0.723	S	S	*	*				-163.5	171.9	-120.6	-172.2	172.8	171.5	-171.8	0	117.5
80	A	37.2	Very low	34.2	Very low	88 Å²	88	137.9 Å²	137.9	73%	0.727	72%	0.723	S	S	*	*			trans	68.7	143.7	173.8	0	0	0	0	0	115.1
81	K	30	Very low	33.8	Very low	194 Å²	194	138.3 Å²	138.3	84%	0.843	73%	0.726	S	S	*	*			cis	86	133.6	11.8	-161.7	175	179.3	177.9	0	116.8
82	S	27.5	Very low	34.1	Very low	96 Å²	96	138.2 Å²	138.2	67%	0.671	73%	0.725	S	S	*	*			trans	79.5	151	179.4	-52.6	0	0	0	0	114
83	Q	28.5	Very low	34.1	Very low	152 Å²	152	138.4 Å²	138.4	71%	0.71	72%	0.719	S	S	*	*			cis	-164.2	163.9	-15	-118.3	175.9	-11.8	0	0	110.1
84	Q	30.6	Very low	34.1	Very low	152 Å²	152	138.2 Å²	138.2	71%	0.71	72%	0.718	S	S	*	*			trans	72.5	147.8	144	-81.5	171.5	-5	0	0	123.3
85	Q	29.3	Very low	33.8	Very low	156 Å²	156	139.7 Å²	139.7	73%	0.729	72%	0.723	S	S	*	*			trans	67.5	152	150.6	-70.8	-169.4	-65.1	0	0	121.5
86	E	27.6	Very low	33.8	Very low	128 Å²	128	138.2 Å²	138.2	60%	0.598	72%	0.715	S	S	*	*			cis	-173.2	142	-22.9	-177.5	161.5	125.4	0	0	112.2
87	Q	29.7	Very low	33.6	Very low	144 Å²	144	140.1 Å²	140.1	67%	0.673	72%	0.718	S	S	*	*			trans	61.6	168.8	165.3	-74.2	174.9	58.7	0	0	116.3
88	Q	33	Very low	33.7	Very low	172 Å²	172	140.2 Å²	140.2	80%	0.804	72%	0.716	S	S	*	*			cis	-146.1	164.7	13.1	-147.4	154.9	59.3	0	0	113
89	D	33.5	Very low	33.6	Very low	149 Å²	149	138.6 Å²	138.6	80%	0.797	72%	0.722	S	S	*	*			trans	-93.1	-164.4	-177.4	-132.3	-21.9	0	0	0	110.1
90	P	42.8	Very low	34	Very low	97 Å²	97	137.2 Å²	137.2	63%	0.63	73%	0.729	S	S	*	*			cis	-144.9	-176.3	-8	37.7	-15	0	0	0	119.2
91	L	35.8	Very low	33.9	Very low	149 Å²	149	136 Å²	136	78%	0.78	73%	0.725	S	S	*	*			trans	74.8	154.9	150.6	-104.3	73.4	0	0	0	118.3
92	E	36.6	Very low	34.3	Very low	132 Å²	132	135.3 Å²	135.3	62%	0.617	73%	0.725	S	S	*	*			cis	-155.6	154.8	28.5	-168.9	169.6	84.3	0	0	116.3
93	K	37.8	Very low	34.8	Very low	144 Å²	144	138.1 Å²	138.1	63%	0.626	73%	0.728	S	S	*	*			trans	67.1	116.6	160	-84.1	157.3	-166.1	153	0	119.8
94	Q	35.1	Very low	35.3	Very low	155 Å²	155	135.7 Å²	135.7	72%	0.724	73%	0.733	S	S	*	*				75.4	135	80.5	-74.5	-179.3	-5.8	0	0	113.8
95	Q	34.6	Very low	35.5	Very low	159 Å²	159	131.6 Å²	131.6	74%	0.743	73%	0.732	S	S	*	*			cis	-162.6	-169.5	-6.1	-120.8	177.9	-10.8	0	0	108.1
96	L	35.8	Very low	36	Very low	138 Å²	138	132 Å²	132	72%	0.723	74%	0.737	S	S	*	*			cis	-138.5	-108	11.6	-145	173.2	0	0	0	113.5
97	S	33.6	Very low	36.6	Very low	105 Å²	105	133.7 Å²	133.7	73%	0.734	75%	0.75	S	S	*	*			trans	-163	167.6	-167.4	-68.6	0	0	0	0	116.1
98	P	39.7	Very low	37.2	Very low	118 Å²	118	132 Å²	132	77%	0.766	75%	0.751	S	S	*	*			trans	-119.5	-177.4	-177.1	43.8	-33.1	0	0	0	115
99	S	34.9	Very low	37.4	Very low	121 Å²	121	131.8 Å²	131.8	85%	0.846	75%	0.75	S	S	*	*			trans	-178.1	161.3	142.4	-82.7	0	0	0	0	115.3
100	P	39.6	Very low	37.6	Very low	133 Å²	133	129.9 Å²	129.9	86%	0.864	74%	0.744	S	S	*	*			trans	-126	176.8	-175.8	43.5	-30.4	0	0	0	117.1
101	G	36	Very low	37.4	Very low	62 Å²	62	132.1 Å²	132.1	64%	0.639	75%	0.746	S	S	*	*			trans	-168.1	134.4	166.2	0	0	0	0	0	111.1
102	Q	38.4	Very low	37.5	Very low	179 Å²	179	133 Å²	133	84%	0.836	74%	0.744	S	S	*	*				72.6	135.7	89.5	-79.7	-173.6	-60.5	0	0	114.9
103	E	37.4	Very low	37.5	Very low	156 Å²	156	130.7 Å²	130.7	73%	0.729	75%	0.747	S	S	*	*			cis	-165.7	159.1	-7.3	-156	169.7	106.8	0	0	111.6
104	A	39.6	Very low	37.5	Very low	100 Å²	100	132.6 Å²	132.6	83%	0.826	76%	0.755	S	S	*	*			trans	56.7	151.9	164.7	0	0	0	0	0	120.9
105	G	35.6	Very low	37.6	Very low	67 Å²	67	129.1 Å²	129.1	69%	0.691	75%	0.748	S	S	*	*			cis	170.4	169.7	-10.2	0	0	0	0	0	114.6
106	I	38.3	Very low	37.8	Very low	163 Å²	163	128.9 Å²	128.9	84%	0.836	75%	0.747	S	S	*	*			trans	76.5	92	158.6	-46	177.2	0	0	0	120.3
107	L	39.9	Very low	37.8	Very low	165 Å²	165	129.7 Å²	129.7	86%	0.864	75%	0.747	S	S	*	*				53	160.6	116.9	-67.7	175.2	0	0	0	123.8
108	P	42	Very low	37.8	Very low	107 Å²	107	130.4 Å²	130.4	70%	0.695	74%	0.743	S	S	*	*			trans	-131.4	-141.1	-142.8	46.4	-28.7	0	0	0	115.8
109	E	37.9	Very low	37.6	Very low	168 Å²	168	133.8 Å²	133.8	79%	0.785	75%	0.748	S	S	*	*			trans	88.3	148.6	177	-60.7	-166.2	58.1	0	0	116.3
110	T	38.4	Very low	37.7	Very low	109 Å²	109	131.5 Å²	131.5	67%	0.669	74%	0.744	S	S	*	*			cis	-156.8	157	-6.8	8.5	0	0	0	0	114.1
111	E	37.8	Very low	37.5	Very low	145 Å²	145	132 Å²	132	68%	0.678	74%	0.739	S	S	*	*			trans	55.1	144.1	141.5	-73.5	-144.2	102.4	0	0	128.3
112	K	38	Very low	37.3	Very low	168 Å²	168	136.1 Å²	136.1	73%	0.73	75%	0.747	S	S	*	*			trans	69.3	142.4	143.2	-77.2	175.4	171.9	76.9	0	120.4
113	A	37.1	Very low	37.1	Very low	83 Å²	83	133.2 Å²	133.2	69%	0.686	75%	0.746	S	S	*	*			cis	176.1	162.5	-3.9	0	0	0	0	0	109.6
114	K	36.8	Very low	37.1	Very low	184 Å²	184	130.8 Å²	130.8	80%	0.8	75%	0.746	S	S	*	*			trans	66.3	154.4	163.3	-86.5	-162.5	164.5	-132	0	118	E116	K114-E116 IonicContact NZ-OE2 3.36Å; K114-E116 PolarHBondContact NZ-OE2 2.91Å
115	S	37.3	Very low	37	Very low	82 Å²	82	133.5 Å²	133.5	57%	0.573	74%	0.742	S	S	*	*			cis	-167.4	154.7	-2.9	34.6	0	0	0	0	111.4
116	E	39.3	Very low	37	Very low	153 Å²	153	137.2 Å²	137.2	72%	0.715	75%	0.746	S	S	*	*			trans	52.5	146.9	142.6	-65.8	149.6	75.7	0	0	119.4	K114	K114-E116 IonicContact NZ-OE2 3.36Å; K114-E116 PolarHBondContact NZ-OE2 2.91Å
117	E	36.1	Very low	37	Very low	156 Å²	156	133.1 Å²	133.1	73%	0.729	74%	0.744	S	S	*	*			cis	-167.3	175.2	-16.1	-165.1	-178.6	75.7	0	0	107.7
118	N	34.5	Very low	36.8	Very low	120 Å²	120	133.7 Å²	133.7	64%	0.642	75%	0.747	S	S	*	*			trans	72.8	96.3	162.6	-62.5	-58.3	0	0	0	121.5
119	Q	35.1	Very low	36.5	Very low	188 Å²	188	131.7 Å²	131.7	88%	0.879	75%	0.746	S	S	*	*				40.3	121	107.5	-164.7	168.3	62.7	0	0	119.9
120	G	36.3	Very low	36.7	Very low	73 Å²	73	131.4 Å²	131.4	75%	0.753	74%	0.742	S	S	*	*			trans	-174	143.7	166.7	0	0	0	0	0	112.2
121	D	35.8	Very low	36.8	Very low	144 Å²	144	133.3 Å²	133.3	77%	0.77	74%	0.744	S	S	*	*			trans	-95	164.7	-164.1	-63.4	-73.5	0	0	0	116.9
122	N	31.4	Very low	36.9	Very low	148 Å²	148	135.1 Å²	135.1	79%	0.791	75%	0.75	S	S	*	*			trans	63.4	117.2	153.5	-63.8	-44.8	0	0	0	120.4
123	S	35.2	Very low	37	Very low	119 Å²	119	134 Å²	134	83%	0.832	75%	0.75	S	S	*	*				-178.1	133.4	111.1	-78.6	0	0	0	0	115.5
124	S	37.1	Very low	36.8	Very low	104 Å²	104	139.9 Å²	139.9	73%	0.727	76%	0.755	S	S	*	*			trans	25	136.6	144.3	-57.5	0	0	0	0	125.7
125	E	38	Very low	37.4	Very low	158 Å²	158	139 Å²	139	74%	0.738	76%	0.757	S	S	*	*				97.8	126	127.5	-88.7	-176.6	92.1	0	0	124.6
126	N	35	Very low	37.2	Very low	145 Å²	145	141.2 Å²	141.2	78%	0.775	76%	0.758	S	S	*	*			trans	68.3	143.7	148.4	-56.7	-35.4	0	0	0	120.8
127	G	37.6	Very low	37	Very low	76 Å²	76	139 Å²	139	78%	0.784	76%	0.76	S	S	*	*			trans	-176.8	-75.4	179.7	0	0	0	0	0	116.2
128	N	35.6	Very low	37.1	Very low	177 Å²	177	137.2 Å²	137.2	95%	0.947	76%	0.761	S	S	*	*			trans	71.3	139.2	175.9	-163.4	17.5	0	0	0	118.8
129	G	37.3	Very low	37	Very low	65 Å²	65	137.2 Å²	137.2	67%	0.67	77%	0.766	S	S	*	*			trans	95.3	135.3	169.5	0	0	0	0	0	116
130	K	41.8	Very low	37.2	Very low	162 Å²	162	136.2 Å²	136.2	70%	0.704	77%	0.765	S	S	*	*			cis	-165.1	137.4	-2	-161.5	175.6	-178.9	-89.9	0	110.6
131	E	40.2	Very low	37.2	Very low	149 Å²	149	138.7 Å²	138.7	70%	0.696	77%	0.766	S	S	*	*			trans	63.6	141.2	159.7	-81.3	147.5	-164.5	0	0	119.2
132	K	39.3	Very low	37	Very low	184 Å²	184	135.2 Å²	135.2	80%	0.8	77%	0.765	S	S	*	*			cis	-162.2	157.1	-1.7	-154.4	-175.6	179	-179.7	0	111.5
133	I	39.7	Very low	37.1	Very low	145 Å²	145	137.8 Å²	137.8	74%	0.744	77%	0.769	S	S	*	*			trans	75.6	108.7	165.1	-42.7	-178.2	0	0	0	118.4
134	R	33.6	Very low	36.8	Very low	206 Å²	206	138.7 Å²	138.7	78%	0.777	77%	0.765	S	S	*	*			trans	-139.5	145.5	149.9	178.3	179.8	-178.4	157.3	-0.2	106.9	E136	R134-E136 IonicContact CZ-OE2 2.68Å; R134-E136 IonicContact NE-OE2 2.71Å; R134-E136 PolarHBondContact NE-OE2 2.95Å; R134-E136 IonicContact NH2-OE1 3.83Å; R134-E136 IonicContact NH2-OE2 2.64Å; R134-E136 PolarHBondContact NH2-OE2 3.4Å
135	I	48.7	Very low	36.8	Very low	164 Å²	164	143 Å²	143	84%	0.841	77%	0.766	S	S	*	*			trans	-133.8	132.9	170.7	-63.5	177.3	0	0	0	107.2
136	E	33.8	Very low	36.6	Very low	129 Å²	129	143.6 Å²	143.6	60%	0.603	77%	0.769	S	S	*	*			trans	-162.8	137.7	179.6	-164	169.6	-172.8	0	0	111.1	R134	R134-E136 IonicContact CZ-OE2 2.68Å; R134-E136 IonicContact NE-OE2 2.71Å; R134-E136 PolarHBondContact NE-OE2 2.95Å; R134-E136 IonicContact NH2-OE1 3.83Å; R134-E136 IonicContact NH2-OE2 2.64Å; R134-E136 PolarHBondContact NH2-OE2 3.4Å
137	S	34.4	Very low	36.2	Very low	108 Å²	108	144.5 Å²	144.5	76%	0.755	77%	0.769	S	S	*	*			trans	65.1	166	172.8	-92.7	0	0	0	0	116.7
138	P	39.4	Very low	36.2	Very low	117 Å²	117	145.7 Å²	145.7	76%	0.76	77%	0.771	S	S	*	*			cis	-123.1	169.6	15.1	42.1	-29	0	0	0	117.3
139	V	32.1	Very low	36	Very low	121 Å²	121	143.4 Å²	143.4	73%	0.733	76%	0.764	S	S	*	*			trans	-70.3	143.3	165.3	173.4	0	0	0	0	110.8
140	L	39.9	Very low	35.9	Very low	167 Å²	167	143.8 Å²	143.8	87%	0.874	77%	0.767	S	S	*	*			trans	-136.1	155	159.1	-78.9	-179.7	0	0	0	111.2
141	T	35.2	Very low	35.6	Very low	124 Å²	124	144.6 Å²	144.6	76%	0.761	78%	0.778	S	S	*	*			trans	-110.9	138.9	-166.5	50.2	0	0	0	0	113.4
142	G	31.6	Very low	35.2	Very low	72 Å²	72	140.9 Å²	140.9	74%	0.742	78%	0.78	S	S	*	*			trans	56.9	118.9	139.8	0	0	0	0	0	120.1
143	F	34.7	Very low	35	Very low	201 Å²	201	138 Å²	138	88%	0.882	78%	0.778	S	S	*	*			trans	-141	144.3	152	-103.5	-82	0	0	0	110.3	Y145	F143-Y145 HydrophobicContact CD1-CD2 4.27Å; F143-Y145 HydrophobicContact CD1-CE2 4.25Å; F143-Y145 HydrophobicContact CE1-CE2 4.28Å
144	D	28.8	Very low	34.7	Very low	139 Å²	139	136.3 Å²	136.3	74%	0.743	78%	0.779	S	S	*	*			trans	-126.3	133.3	176.9	-179.3	-37.7	0	0	0	107
145	Y	36.3	Very low	34.7	Very low	194 Å²	194	132.5 Å²	132.5	76%	0.761	78%	0.779	S	S	*	*			trans	-154.6	91.9	166.9	-99.3	-67.5	0	0	0	113.3	F143	F143-Y145 HydrophobicContact CD1-CD2 4.27Å; F143-Y145 HydrophobicContact CD1-CE2 4.25Å; F143-Y145 HydrophobicContact CE1-CE2 4.28Å
146	Q	33.6	Very low	34	Very low	170 Å²	170	133.2 Å²	133.2	79%	0.794	78%	0.779	S	S	*	*				60.2	137.5	118.2	-157.1	161	60	0	0	121.8
147	E	27.7	Very low	34.2	Very low	165 Å²	165	132.3 Å²	132.3	77%	0.771	78%	0.784	S	S	*	*			trans	-87.2	156.4	-177.2	-178.2	-177	114.2	0	0	114.3
148	A	36.3	Very low	34.4	Very low	101 Å²	101	134.9 Å²	134.9	84%	0.835	79%	0.788	S	S	*	*			trans	-141.2	124.9	165.1	0	0	0	0	0	112.4
149	T	31.1	Very low	34.1	Very low	129 Å²	129	134.7 Å²	134.7	79%	0.791	79%	0.785	S	S	*	*			trans	-93.1	154.3	-175.5	40.1	0	0	0	0	114.1
150	G	34.9	Very low	34.4	Very low	72 Å²	72	134.1 Å²	134.1	74%	0.742	79%	0.787	S	S	*	*			trans	-163.2	120.3	173.7	0	0	0	0	0	114.6
151	L	35.8	Very low	34.2	Very low	179 Å²	179	131.9 Å²	131.9	94%	0.937	79%	0.785	S	S	*	*			trans	-40.9	144	178	-66.7	59	0	0	0	113.9
152	G	33.4	Very low	34.2	Very low	71 Å²	71	130 Å²	130	73%	0.732	78%	0.782	S	S	*	*				118.9	159.5	57	0	0	0	0	0	108.7
153	T	35.2	Very low	34.4	Very low	125 Å²	125	131.7 Å²	131.7	77%	0.767	78%	0.783	S	S	*	*			cis	-157.3	159.6	5.2	51.4	0	0	0	0	111.2
154	S	33.3	Very low	34.4	Very low	108 Å²	108	127.1 Å²	127.1	76%	0.755	78%	0.776	S	S	*	*			trans	64	178.1	161	-65.7	0	0	0	0	117.2
155	T	32	Very low	34.7	Very low	126 Å²	126	127.8 Å²	127.8	77%	0.773	78%	0.778	S	S	*	*			cis	-157.9	169.2	-41.3	33	0	0	0	0	106.8
156	Q	35.2	Very low	34.6	Very low	179 Å²	179	124.9 Å²	124.9	84%	0.836	78%	0.781	S	S	*	*			cis	-153.7	161.3	6	-137.1	178.6	8.5	0	0	109
157	P	36.8	Very low	34.5	Very low	111 Å²	111	120.1 Å²	120.1	72%	0.721	78%	0.778	S	S	*	*			trans	-120	154.2	-172.2	40	-28.6	0	0	0	117.1
158	L	38.7	Very low	34.6	Very low	161 Å²	161	121.6 Å²	121.6	84%	0.843	78%	0.782	S	S	*	*			trans	-146.3	123.4	159.2	-67.1	173.9	0	0	0	106.6
159	T	32.9	Very low	34.3	Very low	114 Å²	114	122 Å²	122	70%	0.699	78%	0.778	S	S	*	*				56.7	124.5	63.4	71.4	0	0	0	0	112.7
160	S	39	Very low	34.1	Very low	109 Å²	109	123.8 Å²	123.8	76%	0.762	78%	0.783	S	S	*	*			cis	-155.9	167	39	-61.7	0	0	0	0	115.7
161	S	35.3	Very low	33.9	Very low	119 Å²	119	131.9 Å²	131.9	83%	0.832	79%	0.791	S	S	*	*			trans	-11.4	163.7	149.2	-44.7	0	0	0	0	120.4
162	A	35	Very low	33.8	Very low	84 Å²	84	128.8 Å²	128.8	69%	0.694	79%	0.785	S	S	*	*			cis	176.4	174	-21.2	0	0	0	0	0	108.5
163	S	36.3	Very low	33.9	Very low	109 Å²	109	130 Å²	130	76%	0.762	79%	0.787	S	S	*	*			trans	79.3	109.7	154.9	-53	0	0	0	0	121.6
164	S	35.8	Very low	33.9	Very low	105 Å²	105	128.4 Å²	128.4	73%	0.734	79%	0.787	S	S	*	*				80.9	109.8	121.1	-58.5	0	0	0	0	123.8
165	L	33.8	Very low	33.9	Very low	152 Å²	152	130.8 Å²	130.8	80%	0.796	79%	0.79	S	S	*	*				91.3	130.5	125.1	-67.6	172	0	0	0	123.3
166	T	33.6	Very low	34.1	Very low	134 Å²	134	129.7 Å²	129.7	82%	0.822	79%	0.794	S	S	*	*			trans	76.2	123.4	145.1	48.3	0	0	0	0	122.5
167	G	31.9	Very low	34.2	Very low	70 Å²	70	127.2 Å²	127.2	72%	0.722	79%	0.793	S	S	*	*			trans	78.5	165.7	162.5	0	0	0	0	0	116.2
168	F	29.9	Very low	34.5	Very low	196 Å²	196	127.9 Å²	127.9	86%	0.86	80%	0.8	S	S	*	*			cis	-177	140.3	-26	52.8	-23.9	0	0	0	110.1
169	S	30.4	Very low	34.4	Very low	109 Å²	109	126.2 Å²	126.2	76%	0.762	80%	0.802	S	S	*	*			trans	66.9	128.3	157	-56.6	0	0	0	0	122
170	N	26.5	Very low	34.4	Very low	166 Å²	166	126.1 Å²	126.1	89%	0.888	81%	0.806	S	S	*	*			trans	59.1	126.7	147.4	-86.7	0.9	0	0	0	122.4
171	W	32.1	Very low	34.4	Very low	242 Å²	242	127.5 Å²	127.5	92%	0.917	81%	0.81	S	S	*	*			trans	-145.5	151.2	136.7	75.7	-50.9	0	0	0	110.8
172	S	32.4	Very low	34.4	Very low	115 Å²	115	129 Å²	129	80%	0.804	81%	0.808	S	S	*	*			trans	-154.1	125	173.6	-79.1	0	0	0	0	111.6
173	A	35	Very low	34.5	Very low	95 Å²	95	132.5 Å²	132.5	79%	0.785	81%	0.813	S	S	*	*			trans	48.3	115.7	154.3	0	0	0	0	0	121.8
174	A	35.1	Very low	34.2	Very low	93 Å²	93	133.3 Å²	133.3	77%	0.769	81%	0.809	S	S	*	*			trans	-146.5	105.2	139.5	0	0	0	0	0	107.2
175	I	34.4	Very low	34.1	Very low	158 Å²	158	135.4 Å²	135.4	81%	0.81	81%	0.807	S	S	*	*				71.8	108.9	84.3	-64.2	165	0	0	0	113.8
176	A	36.1	Very low	34.1	Very low	103 Å²	103	136 Å²	136	85%	0.851	81%	0.811	S	S	*	*			trans	-172.5	113.6	140.1	0	0	0	0	0	111.3
177	P	36.4	Very low	34.1	Very low	127 Å²	127	133.6 Å²	133.6	83%	0.825	80%	0.804	S	S	*	*			trans	-109.5	157.3	168.8	37.6	-29.8	0	0	0	113
178	S	43.6	Very low	34.2	Very low	124 Å²	124	135.5 Å²	135.5	87%	0.867	81%	0.807	S	S	*	*			trans	-141	159.6	170.1	59.6	0	0	0	0	111.9
179	S	37.7	Very low	34.4	Very low	127 Å²	127	135 Å²	135	89%	0.888	80%	0.804	S	S	*	*			trans	-98.1	162.7	-149.8	-52	0	0	0	0	117.3
180	S	33.1	Very low	34.7	Very low	111 Å²	111	137.4 Å²	137.4	78%	0.776	80%	0.802	S	S	*	*			trans	-71.5	166.7	179.1	-22.6	0	0	0	0	115
181	T	37.6	Very low	35.2	Very low	139 Å²	139	136.4 Å²	136.4	85%	0.853	79%	0.791	S	S	*	*				-166.9	158.2	124.1	-75.1	0	0	0	0	111.4
182	I	35.4	Very low	35.2	Very low	151 Å²	151	133.1 Å²	133.1	77%	0.774	79%	0.786	S	S	*	*			trans	-75	167	-177.6	-54	156.7	0	0	0	108
183	I	36.7	Very low	35.2	Very low	157 Å²	157	131.7 Å²	131.7	81%	0.805	79%	0.79	S	S	*	*				-164.7	141.1	56.5	-33.2	-175.8	0	0	0	112.6
184	N	29.9	Very low	35.2	Very low	126 Å²	126	131.1 Å²	131.1	67%	0.674	79%	0.793	S	S	*	*			trans	13.6	159.3	151.6	-151.1	29.8	0	0	0	125.6
185	E	34.6	Very low	35.5	Very low	149 Å²	149	133.7 Å²	133.7	70%	0.696	80%	0.799	S	S	*	*			trans	63.3	102.2	151.9	63	-167.4	37.7	0	0	122.9
186	D	33.2	Very low	36	Very low	165 Å²	165	132.2 Å²	132.2	88%	0.882	80%	0.799	S	S	*	*				67.7	156.4	129.9	-81.8	-68.2	0	0	0	124.5
187	A	35	Very low	35.8	Very low	83 Å²	83	132.1 Å²	132.1	69%	0.686	80%	0.799	S	S	*	*			trans	65.4	106.1	162.5	0	0	0	0	0	120.6
188	S	33.2	Very low	35.6	Very low	110 Å²	110	130.3 Å²	130.3	77%	0.769	80%	0.795	S	S	*	*				75.7	106.9	124.3	-59.2	0	0	0	0	122
189	F	34.1	Very low	35.1	Very low	184 Å²	184	130.2 Å²	130.2	81%	0.807	79%	0.794	S	S	*	*				67.2	108.4	123.3	-99.6	-125.1	0	0	0	122
190	F	37	Very low	35.2	Very low	161 Å²	161	127.4 Å²	127.4	71%	0.706	78%	0.778	S	S	*	*			trans	77.9	145.3	138.5	-79	-114.2	0	0	0	122.5
191	H	36.6	Very low	35.4	Very low	145 Å²	145	128.8 Å²	128.8	67%	0.671	78%	0.777	S	S	*	*			trans	56.1	96	162.9	-77.2	-74.7	0	0	0	122.7
192	Q	33.3	Very low	35.3	Very low	172 Å²	172	129.2 Å²	129.2	80%	0.804	77%	0.774	S	S	*	*				58.5	102	101.6	-168.9	-176.7	27.3	0	0	120
193	G	32.1	Very low	35.5	Very low	86 Å²	86	125.1 Å²	125.1	89%	0.887	77%	0.769	S	S	*	*			trans	102.2	127.1	137.8	0	0	0	0	0	117.8
194	G	34.1	Very low	35.3	Very low	83 Å²	83	122.2 Å²	122.2	86%	0.856	77%	0.768	S	S	*	*			trans	170.5	111.2	172.9	0	0	0	0	0	112.2
195	V	40.8	Very low	36	Very low	146 Å²	146	124.2 Å²	124.2	89%	0.885	78%	0.778	S	S	*	*			trans	-88.6	161.1	-176.4	-81.9	0	0	0	0	113.3
196	P	45.4	Very low	36	Very low	127 Å²	127	124.8 Å²	124.8	83%	0.825	79%	0.785	S	S	*	*			trans	-105.9	162.5	-160.3	40.4	-36.2	0	0	0	115.9
197	A	32	Very low	36.2	Very low	101 Å²	101	125.5 Å²	125.5	84%	0.835	78%	0.781	S	S	*	*			trans	-177.4	160.2	159.9	0	0	0	0	0	110
198	A	33.4	Very low	36.4	Very low	90 Å²	90	128.6 Å²	128.6	74%	0.744	78%	0.781	S	S	*	*			cis	-172.4	156.6	-26.5	0	0	0	0	0	110.4
199	S	32.6	Very low	36.3	Very low	122 Å²	122	129.4 Å²	129.4	85%	0.853	78%	0.777	S	S	*	*			trans	69.2	165.9	156.7	-127.4	0	0	0	0	117.4
200	A	38.3	Very low	36.4	Very low	67 Å²	67	129.1 Å²	129.1	55%	0.554	78%	0.776	S	S	*	*			cis	-155.7	167.1	7.2	0	0	0	0	0	114
201	N	38.2	Very low	36.7	Very low	140 Å²	140	125.5 Å²	125.5	75%	0.749	77%	0.768	S	S	*	*			trans	70.7	149.7	145.6	-63.4	-12.8	0	0	0	120.2
202	N	35.3	Very low	36.8	Very low	149 Å²	149	125.5 Å²	125.5	80%	0.797	77%	0.768	S	S	*	*			cis	-165.4	165.3	-19.2	-111.6	-23.7	0	0	0	112.4
203	G	38.9	Very low	37.2	Very low	64 Å²	64	124.9 Å²	124.9	66%	0.66	77%	0.765	S	S	*	*			trans	102.2	117.4	168.4	0	0	0	0	0	113.3
204	A	34.2	Very low	37.4	Very low	96 Å²	96	127.1 Å²	127.1	79%	0.793	76%	0.761	S	S	*	*			cis	66.8	132.2	43.5	0	0	0	0	0	112.4
205	L	43.7	Very low	37.4	Very low	168 Å²	168	128.3 Å²	128.3	88%	0.88	76%	0.756	S	S	*	*			cis	-136.9	164	39.9	-70.6	161.1	0	0	0	115.2
206	L	34.2	Very low	37.6	Very low	162 Å²	162	126.9 Å²	126.9	85%	0.848	75%	0.75	S	S	*	*			trans	-87.6	146	169.3	-71.1	150.4	0	0	0	111.4
207	F	38.2	Very low	37.3	Very low	179 Å²	179	124.4 Å²	124.4	79%	0.785	75%	0.747	S	S	*	*			trans	-151	123.2	146.1	-101.2	-77.1	0	0	0	113.3
208	Q	39.1	Very low	38	Very low	148 Å²	148	129.8 Å²	129.8	69%	0.692	75%	0.752	S	S	*	*			trans	18.3	126.7	146	-54.1	175.3	23.1	0	0	119
209	N	30	Very low	38.4	Very low	128 Å²	128	128.7 Å²	128.7	68%	0.684	75%	0.75	S	S	*	*			cis	70.8	103.9	43.4	-164.6	5.6	0	0	0	114.4
210	F	37.2	Very low	39.1	Very low	178 Å²	178	126.9 Å²	126.9	78%	0.781	75%	0.751	S	S	*	*			trans	178.6	162.5	131.1	-84.8	-49.8	0	0	0	110.6
211	P	42.5	Very low	39.1	Very low	84 Å²	84	128.4 Å²	128.4	55%	0.545	76%	0.757	S	S	.	*			trans	-132.3	-156.3	-150.9	32.8	-8.6	0	0	0	115
212	H	38.4	Very low	39.2	Very low	145 Å²	145	130.7 Å²	130.7	67%	0.671	76%	0.761	S	S	*	*			trans	118.8	157.2	148.4	-53.7	-58.2	0	0	0	119.2
213	H	42.5	Very low	39.3	Very low	160 Å²	160	128.5 Å²	128.5	74%	0.741	76%	0.757	S	S	*	*			trans	72.7	125.4	164.7	-36.1	-64.4	0	0	0	117
214	V	36.3	Very low	39.5	Very low	133 Å²	133	131.5 Å²	131.5	81%	0.806	77%	0.765	S	S	*	*			cis	63	138.4	47.2	-38.2	0	0	0	0	113.7
215	S	33.9	Very low	39.8	Very low	107 Å²	107	135.9 Å²	135.9	75%	0.748	77%	0.769	S	S	*	*			cis	-160.2	-145.6	11.3	-133.1	0	0	0	0	110.1
216	P	46.1	Very low	39.7	Very low	116 Å²	116	136.2 Å²	136.2	75%	0.753	77%	0.77	S	S	*	*				-129.1	159.6	-76.8	37.7	-20.8	0	0	0	117.2
217	G	38.2	Very low	40	Very low	75 Å²	75	131.6 Å²	131.6	77%	0.773	76%	0.761	S	S	*	*				60.3	122.5	123.4	0	0	0	0	0	124.2
218	F	47	Very low	40.1	Very low	214 Å²	214	128.9 Å²	128.9	94%	0.939	76%	0.762	S	S	*	*			trans	-159.8	150.2	145.6	-133.7	-94.2	0	0	0	109.5
219	G	41.2	Very low	40	Very low	67 Å²	67	129.8 Å²	129.8	69%	0.691	77%	0.77	S	S	*	*			cis	159.4	88.5	-12.7	0	0	0	0	0	113.6
220	G	48.5	Very low	40.6	Very low	85 Å²	85	127.5 Å²	127.5	88%	0.876	77%	0.765	S	S	*	*			trans	-173.1	121.3	175.7	0	0	0	0	0	113.8
221	S	37	Very low	40.8	Very low	99 Å²	99	126.9 Å²	126.9	69%	0.692	76%	0.764	S	S	*	*			trans	-103.6	165.9	-175.1	-144.1	0	0	0	0	110.7
222	F	40	Very low	40.7	Very low	187 Å²	187	130.9 Å²	130.9	82%	0.82	78%	0.775	S	S	*	*				-161.4	151.3	56.6	-89	-83.8	0	0	0	115.9
223	S	37.6	Very low	40.7	Very low	103 Å²	103	131.8 Å²	131.8	72%	0.72	78%	0.779	S	S	*	*			trans	62.6	114	146.5	-59.8	0	0	0	0	121.9
224	P	44.9	Very low	40.5	Very low	127 Å²	127	129.3 Å²	129.3	83%	0.825	78%	0.777	S	S	*	*				-139.3	129.2	129.4	35.6	-22.2	0	0	0	114
225	Q	38.5	Very low	40.7	Very low	189 Å²	189	132 Å²	132	88%	0.883	78%	0.781	S	S	*	*			trans	-164.2	170.2	163.7	-138.4	-174.3	-19.6	0	0	113.7
226	I	43.5	Very low	41.2	Very low	174 Å²	174	134.9 Å²	134.9	89%	0.892	78%	0.782	S	S	*	*			trans	75.5	119.4	177.7	-48.3	169.3	0	0	0	113.6
227	G	38.9	Very low	41	Very low	65 Å²	65	135.2 Å²	135.2	67%	0.67	78%	0.784	S	S	*	*			cis	-179.3	169.9	-6.6	0	0	0	0	0	112.2
228	P	41.2	Very low	41.2	Very low	123 Å²	123	138.3 Å²	138.3	80%	0.799	78%	0.778	S	S	*	*			trans	-119	133.8	-176.3	36.9	-24.3	0	0	0	114.9
229	L	37.5	Very low	40.7	Very low	166 Å²	166	136.3 Å²	136.3	87%	0.869	77%	0.769	S	S	*	*			trans	-164.1	149	153.8	-141.9	71.1	0	0	0	114.6
230	S	41.3	Very low	40.5	Very low	80 Å²	80	140.7 Å²	140.7	56%	0.559	77%	0.772	S	S	*	*			trans	59.6	115.7	152	-74.1	0	0	0	0	123.3
231	Q	41.1	Very low	39.9	Very low	165 Å²	165	143.9 Å²	143.9	77%	0.771	76%	0.764	S	S	*	*				80.7	146.7	123.9	-65.8	165.7	-10.8	0	0	118.3
232	H	40.6	Very low	40	Very low	169 Å²	169	145.6 Å²	145.6	78%	0.782	76%	0.761	S	S	*	*			cis	-136.8	-172.4	17.9	-129.3	-83.5	0	0	0	113.7
233	H	39.4	Very low	40	Very low	163 Å²	163	144.3 Å²	144.3	76%	0.755	76%	0.757	S	S	*	*			trans	-77.4	160.9	-173.2	-85.8	38.3	0	0	0	116.9
234	P	37.3	Very low	39.9	Very low	108 Å²	108	143.3 Å²	143.3	70%	0.701	75%	0.75	S	S	*	*			trans	-93.2	157.5	167.9	38.1	-34.2	0	0	0	113.5
235	H	41.1	Very low	39.7	Very low	189 Å²	189	145.3 Å²	145.3	88%	0.875	75%	0.748	S	S	*	*			trans	-160	162.9	156.3	-88.1	-52.8	0	0	0	113.5
236	H	44.2	Very low	39.9	Very low	169 Å²	169	143.1 Å²	143.1	78%	0.782	74%	0.738	S	S	*	*			trans	-63.5	171.6	173.6	-106.6	-118.4	0	0	0	112.9
237	P	42.9	Very low	39.8	Very low	122 Å²	122	141.5 Å²	141.5	79%	0.792	73%	0.726	S	S	*	*			cis	-155.8	-167	47.4	46	-23.1	0	0	0	120
238	H	41	Very low	40	Very low	140 Å²	140	145.9 Å²	145.9	65%	0.648	73%	0.729	S	S	*	*			trans	-42.1	141.8	176.1	-103	-122.6	0	0	0	121.6
239	F	36.8	Very low	40	Very low	172 Å²	172	147.3 Å²	147.3	75%	0.754	73%	0.725	S	S	*	*				62	146.4	123.2	-87.4	-116.5	0	0	0	124.7
240	Q	36.9	Very low	40.1	Very low	160 Å²	160	148.9 Å²	148.9	75%	0.748	72%	0.72	S	S	*	*			trans	77.7	104.9	150.5	-66.2	-139.1	-69.5	0	0	122.9
241	H	35.7	Very low	40	Very low	151 Å²	151	156.5 Å²	156.5	70%	0.699	74%	0.736	S	S	*	*				82.2	137.9	122.2	-110.6	-44.6	0	0	0	124.3
242	H	39.8	Very low	39.8	Very low	135 Å²	135	153.9 Å²	153.9	63%	0.625	74%	0.736	S	S	*	*			trans	93.2	120.9	139.2	-105.7	-74.3	0	0	0	121
243	H	40	Very low	39.9	Very low	161 Å²	161	151.8 Å²	151.8	75%	0.745	74%	0.737	S	S	*	*			trans	52.3	144.5	142.7	-94.2	39.2	0	0	0	119.4
244	S	34.8	Very low	40.1	Very low	82 Å²	82	148.9 Å²	148.9	57%	0.573	74%	0.742	S	S	*	*			cis	153.8	132.9	-4.4	-95.1	0	0	0	0	103.7
245	Q	41.4	Very low	40.2	Very low	168 Å²	168	149.3 Å²	149.3	79%	0.785	75%	0.747	S	S	*	*			trans	166	137.1	136.6	-95.7	178.8	17	0	0	113.1
246	H	43.4	Very low	40.3	Very low	144 Å²	144	145.2 Å²	145.2	67%	0.667	74%	0.738	S	S	*	*			trans	56.6	147.9	145.9	-57.7	-43.6	0	0	0	120.5
247	Q	40.8	Very low	40.4	Very low	140 Å²	140	145.6 Å²	145.6	65%	0.654	74%	0.739	S	S	*	*			cis	-153.7	134.9	-5.7	-129.1	162.4	-18.4	0	0	112.6
248	Q	42.6	Very low	40.7	Very low	156 Å²	156	144.6 Å²	144.6	73%	0.729	73%	0.733	S	S	*	*			trans	24.7	121.7	140.2	-54.5	167	-16.5	0	0	118.1
249	Q	42.4	Very low	41.2	Very low	154 Å²	154	143.4 Å²	143.4	72%	0.72	74%	0.738	S	S	*	*				172.2	162.4	89.7	-93.1	-169.6	91.8	0	0	110.4
250	R	38.4	Very low	41.5	Very low	198 Å²	198	140.1 Å²	140.1	75%	0.747	73%	0.733	S	S	*	*			cis	-138.5	160.1	-1.3	-61	-170.4	-163.9	-100.1	21.1	110.8
251	R	39.1	Very low	41.9	Very low	240 Å²	240	142.3 Å²	142.3	91%	0.906	74%	0.741	S	S	*	*			trans	43.5	114.7	144.9	-69.8	177.8	178.7	-94.9	-0.2	121.6
252	S	36.3	Very low	42.1	Very low	111 Å²	111	140.6 Å²	140.6	78%	0.776	74%	0.741	S	S	*	*			trans	-95.8	-162.3	154.6	48.2	0	0	0	0	110.7
253	P	44.2	Very low	41.9	Very low	124 Å²	124	142.5 Å²	142.5	81%	0.805	75%	0.75	S	S	*	*			cis	-125.6	167.3	-47.8	32.5	-17.4	0	0	0	113.6
254	A	42.8	Very low	41.8	Very low	102 Å²	102	145.8 Å²	145.8	84%	0.843	76%	0.756	S	S	*	*			trans	-159.9	135.2	158.4	0	0	0	0	0	113.7
255	S	38.8	Very low	41.8	Very low	117 Å²	117	148.3 Å²	148.3	82%	0.818	76%	0.763	S	S	*	*			trans	-93.9	166.5	153.9	-39.5	0	0	0	0	107.7
256	P	44.2	Very low	41.6	Very low	104 Å²	104	145 Å²	145	68%	0.675	76%	0.764	S	S	*	*				-160.3	-179	56.6	46	-24.4	0	0	0	119.3
257	H	45.3	Very low	41.4	Very low	176 Å²	176	142.9 Å²	142.9	82%	0.815	77%	0.772	S	S	*	*			trans	64.9	150.8	148.9	-68.8	-46	0	0	0	122.8
258	P	49	Very low	41.2	Very low	101 Å²	101	144.7 Å²	144.7	66%	0.656	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-86	168.8	178.5	37.4	-37.7	0	0	0	112.9	P260	P258-P260 WeakPolarHBondContact O-CD 3.41Å
259	P	53.3	Low	41.1	Very low	116 Å²	116	142.4 Å²	142.4	75%	0.753	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-77	124.2	178.2	30.1	-34.6	0	0	0	113.2
260	P	41.2	Very low	41	Very low	102 Å²	102	143.1 Å²	143.1	66%	0.662	77%	0.774	S	S	*	*	P	Polyproline II helix	trans	-99.8	133.4	166.7	35.3	-26.1	0	0	0	111.1	P258	P258-P260 WeakPolarHBondContact O-CD 3.41Å
261	F	46.1	Very low	40.8	Very low	207 Å²	207	141.4 Å²	141.4	91%	0.908	78%	0.779	S	S	*	*			trans	-110.4	92	165.9	-77.9	-71.4	0	0	0	109.8
262	T	39.5	Very low	41	Very low	115 Å²	115	134.2 Å²	134.2	71%	0.706	76%	0.763	S	S	*	*			trans	-101.5	134.7	179.7	47.3	0	0	0	0	112.2
263	H	37	Very low	41.1	Very low	174 Å²	174	136.9 Å²	136.9	81%	0.806	76%	0.763	S	S	*	*			trans	3.4	132.2	158	-52.5	-97.2	0	0	0	119.2
264	R	37.3	Very low	40.9	Very low	230 Å²	230	139.1 Å²	139.1	87%	0.868	77%	0.767	S	S	*	*				-166.4	131.9	104.4	-109.1	174.2	173	174.4	-1.5	116.4
265	N	34.8	Very low	40.7	Very low	136 Å²	136	138.1 Å²	138.1	73%	0.727	76%	0.759	S	S	*	*			trans	47.4	106.4	134.9	-65.9	24.6	0	0	0	121.9
266	A	36.6	Very low	40.7	Very low	97 Å²	97	139.7 Å²	139.7	80%	0.802	76%	0.758	S	S	*	*				88.7	155.1	106.7	0	0	0	0	0	121
267	A	39.6	Very low	40.4	Very low	100 Å²	100	140.8 Å²	140.8	83%	0.826	76%	0.759	S	S	*	*			trans	65.8	152.6	175.2	0	0	0	0	0	117
268	F	37.6	Very low	40.3	Very low	178 Å²	178	140.8 Å²	140.8	78%	0.781	76%	0.764	S	S	*	*			cis	-169.1	141.9	-35.2	-163	-121.6	0	0	0	106.4
269	N	39	Very low	39.9	Very low	109 Å²	109	141 Å²	141	58%	0.583	76%	0.759	S	S	*	*			trans	66.5	145	163.3	-80.1	-3.2	0	0	0	122.7
270	Q	40.8	Very low	39.1	Very low	169 Å²	169	144 Å²	144	79%	0.79	76%	0.761	S	S	*	*			trans	77.2	90.3	143.7	-70.9	164.2	25.8	0	0	121.4
271	L	35	Very low	39.1	Very low	162 Å²	162	144.7 Å²	144.7	85%	0.848	77%	0.765	S	S	*	*				-11.3	165.5	115.2	-77.1	164.7	0	0	0	117.6
272	P	43	Very low	38.8	Very low	89 Å²	89	140.4 Å²	140.4	58%	0.578	76%	0.758	S	S	*	*			cis	-144.5	-172.3	5.7	18.9	10.6	0	0	0	117.2
273	H	37.9	Very low	38.8	Very low	167 Å²	167	140.8 Å²	140.8	77%	0.773	77%	0.765	S	S	*	*			trans	96.2	152.2	147	-60.9	-51.4	0	0	0	123.1
274	L	40.4	Very low	38.8	Very low	170 Å²	170	138.4 Å²	138.4	89%	0.89	77%	0.765	S	S	*	*			trans	67.6	108.3	167.3	-62.2	157.1	0	0	0	116.8
275	A	39.1	Very low	38.9	Very low	82 Å²	82	139 Å²	139	68%	0.678	77%	0.768	S	S	*	*			cis	99	96.2	12	0	0	0	0	0	117.9
276	N	37.2	Very low	38.7	Very low	149 Å²	149	138 Å²	138	80%	0.797	77%	0.771	S	S	*	*			trans	177.1	135.4	139.1	-93.8	-22.9	0	0	0	108.6
277	N	38.2	Very low	38.5	Very low	128 Å²	128	138 Å²	138	68%	0.684	77%	0.766	S	S	*	*			cis	113.6	105.7	30.2	-101.4	-54.6	0	0	0	110.4
278	L	44.5	Very low	38.3	Very low	176 Å²	176	144.7 Å²	144.7	92%	0.921	77%	0.771	S	S	*	*			trans	-146.4	139.8	142.7	-153.5	61.6	0	0	0	111.6
279	N	39.6	Very low	38.2	Very low	106 Å²	106	145.2 Å²	145.2	57%	0.567	78%	0.776	S	S	*	*			trans	-88.9	174.2	-172.6	-78.2	-96.9	0	0	0	110.4
280	K	37.7	Very low	38	Very low	179 Å²	179	145.8 Å²	145.8	78%	0.778	79%	0.788	S	S	*	*			cis	-173.3	-170.7	0.2	-116.6	166.1	-173.9	162.3	0	106.6
281	P	40.5	Very low	37.9	Very low	115 Å²	115	143.6 Å²	143.6	75%	0.747	79%	0.789	S	S	*	*			cis	-126.9	171.4	-16.4	37.2	-21	0	0	0	114.7
282	P	39.3	Very low	37.9	Very low	118 Å²	118	141.6 Å²	141.6	77%	0.766	79%	0.788	S	S	*	*			trans	-105	168.8	171.7	39.6	-33.4	0	0	0	114.4
283	S	40	Very low	37.8	Very low	123 Å²	123	143.2 Å²	143.2	86%	0.86	80%	0.799	S	S	*	*			trans	-135.9	157.5	169.1	-75.6	0	0	0	0	111.5
284	P	36.5	Very low	38.1	Very low	124 Å²	124	141.4 Å²	141.4	81%	0.805	80%	0.8	S	S	*	*			trans	-124.9	135.2	-146.8	37.3	-22.5	0	0	0	117.3
285	W	38.8	Very low	37.9	Very low	242 Å²	242	139.4 Å²	139.4	92%	0.917	80%	0.797	S	S	*	*			trans	-151.8	113.7	142.7	-179.5	-86.3	0	0	0	109.7
286	S	30.4	Very low	38	Very low	115 Å²	115	141.4 Å²	141.4	80%	0.804	81%	0.806	S	S	*	*			trans	-163.1	103.2	171.8	-99.5	0	0	0	0	110.2
287	S	32.8	Very low	38	Very low	98 Å²	98	140.1 Å²	140.1	69%	0.685	81%	0.809	S	S	*	*			trans	-170	84	166.2	-85.1	0	0	0	0	111.2
288	Y	37	Very low	37.8	Very low	240 Å²	240	139.5 Å²	139.5	94%	0.941	82%	0.815	S	S	*	*			trans	-156.6	116.7	136.2	-91.2	-62	0	0	0	108
289	Q	34.6	Very low	37.3	Very low	188 Å²	188	141.3 Å²	141.3	88%	0.879	81%	0.809	S	S	*	*			trans	-91.5	142.4	-179	-65.7	174.8	-11	0	0	110.7
290	S	34.4	Very low	37.1	Very low	121 Å²	121	141.3 Å²	141.3	85%	0.846	82%	0.818	S	S	*	*			trans	-156.1	142.1	145.4	-80.4	0	0	0	0	109
291	P	39.5	Very low	37.1	Very low	123 Å²	123	139 Å²	139	80%	0.799	82%	0.821	S	S	*	*			trans	-98.7	152.6	-159.5	36.9	-35.9	0	0	0	114.9
292	S	35	Very low	36.8	Very low	120 Å²	120	137.2 Å²	137.2	84%	0.839	82%	0.823	S	S	*	*			trans	-72.8	150.8	164.5	-38.9	0	0	0	0	111.9
293	P	41	Very low	36.6	Very low	123 Å²	123	135.5 Å²	135.5	80%	0.799	83%	0.827	S	S	*	*			trans	-124.9	159.9	147.4	23.6	-5.9	0	0	0	113.3
294	T	43.8	Very low	36.3	Very low	129 Å²	129	133.8 Å²	133.8	79%	0.791	83%	0.829	S	S	*	*			trans	-76	156.7	-176.4	46.5	0	0	0	0	114.1
295	P	36.4	Very low	36.2	Very low	129 Å²	129	130.6 Å²	130.6	84%	0.838	82%	0.819	S	S	*	*			trans	-80.2	134.7	176.7	32.9	-34.5	0	0	0	112.9
296	S	41.6	Very low	36.1	Very low	123 Å²	123	130.4 Å²	130.4	86%	0.86	82%	0.819	S	S	*	*			trans	-156.5	149.3	157.9	55.3	0	0	0	0	110.3
297	S	35.9	Very low	36.3	Very low	123 Å²	123	128.5 Å²	128.5	86%	0.86	82%	0.818	S	S	*	*			trans	-104.7	133.4	-170.2	43.6	0	0	0	0	113
298	S	35.4	Very low	36.2	Very low	115 Å²	115	127.1 Å²	127.1	80%	0.804	82%	0.819	S	S	*	*			trans	-169.7	175.1	137.6	-159.3	0	0	0	0	110
299	W	33.8	Very low	36	Very low	214 Å²	214	128.2 Å²	128.2	81%	0.811	82%	0.822	S	S	*	*			trans	-104	138.8	-168.3	-55.9	-47	0	0	0	114.9
300	S	34.9	Very low	35.9	Very low	106 Å²	106	123.3 Å²	123.3	74%	0.741	82%	0.822	S	S	*	*			trans	12.8	163.7	132.9	-50.9	0	0	0	0	121.6
301	P	37.4	Very low	35.9	Very low	130 Å²	130	121.1 Å²	121.1	84%	0.844	82%	0.818	S	S	*	*			cis	-136.3	172.9	-37.8	37.7	-21.6	0	0	0	112.6
302	G	34.6	Very low	35.8	Very low	77 Å²	77	120.6 Å²	120.6	79%	0.794	82%	0.817	S	S	*	*			trans	-172.3	131.9	170.1	0	0	0	0	0	114.3
303	G	35.1	Very low	36	Very low	83 Å²	83	124.5 Å²	124.5	86%	0.856	82%	0.822	S	S	*	*			trans	-72.6	154.4	177.8	0	0	0	0	0	113.1
304	G	34.2	Very low	35.8	Very low	87 Å²	87	121.9 Å²	121.9	90%	0.897	82%	0.818	S	S	*	*			trans	-79.1	154	177.1	0	0	0	0	0	113.4
305	G	33.4	Very low	35.3	Very low	57 Å²	57	127.2 Å²	127.2	59%	0.588	82%	0.823	S	S	*	*			trans	166	107.3	172.8	0	0	0	0	0	112.7
306	Y	36.6	Very low	35.2	Very low	237 Å²	237	127.2 Å²	127.2	93%	0.929	82%	0.816	S	S	*	*			trans	51.4	149.3	168.8	72.1	-87.7	0	0	0	119
307	G	34	Very low	35	Very low	75 Å²	75	130.5 Å²	130.5	77%	0.773	82%	0.817	S	S	*	*			trans	-104.4	-177.7	-173.4	0	0	0	0	0	114.2
308	G	31.5	Very low	34.9	Very low	69 Å²	69	135.8 Å²	135.8	71%	0.711	82%	0.819	S	S	*	*			trans	140.4	107.8	169.9	0	0	0	0	0	113.6
309	W	33.5	Very low	35	Very low	264 Å²	264	142.5 Å²	142.5	100%	1	83%	0.826	S	S	*	*			trans	31.5	114.8	158.4	-57.3	-44	0	0	0	120.5
310	G	32.4	Very low	35	Very low	85 Å²	85	135.6 Å²	135.6	88%	0.876	82%	0.822	S	S	*	*			trans	-80	173.5	165.5	0	0	0	0	0	114
311	G	33.2	Very low	35.2	Very low	75 Å²	75	138.9 Å²	138.9	77%	0.773	83%	0.83	S	S	*	*			trans	177.2	65.8	-177.6	0	0	0	0	0	116
312	S	37.5	Very low	35.1	Very low	111 Å²	111	140.4 Å²	140.4	78%	0.776	83%	0.831	S	S	*	*			trans	30.4	129.6	148.3	-54.7	0	0	0	0	122.9
313	Q	40	Very low	35.2	Very low	202 Å²	202	140 Å²	140	94%	0.944	83%	0.826	S	S	*	*			trans	75.3	148.8	158.5	-37.8	-150.8	12.3	0	0	117.1
314	G	35.8	Very low	35.3	Very low	68 Å²	68	139.3 Å²	139.3	70%	0.701	82%	0.819	S	S	*	*			cis	166	164.8	-10	0	0	0	0	0	113.6
315	R	34.6	Very low	35.8	Very low	242 Å²	242	143.1 Å²	143.1	91%	0.913	82%	0.818	S	S	*	*			trans	75.6	143.3	168.2	-122.6	172.2	-166.3	163.5	5.2	119.9
316	D	33.4	Very low	36.3	Very low	129 Å²	129	146.2 Å²	146.2	69%	0.69	83%	0.825	S	S	*	*			trans	-59	163.7	-173.2	-43.2	-102.7	0	0	0	116.9
317	H	37	Very low	36.4	Very low	191 Å²	191	140.6 Å²	140.6	88%	0.884	82%	0.818	S	S	*	*				176.8	170.7	116.4	-93.6	73.3	0	0	0	113
318	R	34.2	Very low	36.9	Very low	235 Å²	235	145 Å²	145	89%	0.887	82%	0.823	S	S	*	*			trans	-98.6	161.7	-172.6	-77.7	-171.7	178.2	-131.6	11.3	115.1
319	R	37.2	Very low	37.2	Very low	255 Å²	255	148.8 Å²	148.8	96%	0.962	83%	0.827	S	S	*	*			trans	75.8	146.4	168.4	-54.2	-177.7	176.9	-151	-0.1	114.7
320	G	33.8	Very low	37.1	Very low	69 Å²	69	141.4 Å²	141.4	71%	0.711	82%	0.815	S	S	*	*			cis	160.6	167.9	-10	0	0	0	0	0	113.9
321	L	39.8	Very low	37.5	Very low	175 Å²	175	145.1 Å²	145.1	92%	0.916	81%	0.813	S	S	*	*			trans	73.2	119.2	163.9	-66.8	165.7	0	0	0	121.5
322	N	36.2	Very low	37.8	Very low	163 Å²	163	147.2 Å²	147.2	87%	0.872	82%	0.816	S	S	*	*				82.5	127.2	124.4	-171.2	71.3	0	0	0	122.9
323	G	36.3	Very low	37.9	Very low	67 Å²	67	146.3 Å²	146.3	69%	0.691	81%	0.808	S	S	*	*			trans	146.7	113.2	143.8	0	0	0	0	0	119.5
324	G	36.9	Very low	37.9	Very low	69 Å²	69	144.3 Å²	144.3	71%	0.711	80%	0.802	S	S	*	*			trans	92.5	125.1	160	0	0	0	0	0	116.7
325	I	45.4	Very low	38	Very low	168 Å²	168	148.5 Å²	148.5	86%	0.862	80%	0.802	S	S	*	*				61.4	132.5	52.3	90.9	166.1	0	0	0	113.4
326	T	43.3	Very low	38.5	Very low	121 Å²	121	146.9 Å²	146.9	74%	0.742	80%	0.801	S	S	*	*			cis	-141.1	162.9	24.4	49.1	0	0	0	0	114.7
327	P	39.3	Very low	38.4	Very low	119 Å²	119	145.9 Å²	145.9	77%	0.773	80%	0.796	S	S	*	*			trans	-93.2	167.7	172.7	38.7	-36.1	0	0	0	114.1
328	L	43.7	Very low	38.4	Very low	169 Å²	169	146.1 Å²	146.1	89%	0.885	79%	0.794	S	S	*	*			trans	-167.6	176.4	147.6	-110.5	170.1	0	0	0	113.3
329	N	37.3	Very low	38.8	Very low	148 Å²	148	139.6 Å²	139.6	79%	0.791	79%	0.791	S	S	*	*			trans	-85.9	162.7	-156.3	-84.1	-52.2	0	0	0	118.6
330	S	32.4	Very low	38.6	Very low	108 Å²	108	132.4 Å²	132.4	76%	0.755	78%	0.78	S	S	*	*			trans	-45	149.3	167.5	-42.4	0	0	0	0	116.8
331	I	40.1	Very low	39.1	Very low	163 Å²	163	137.4 Å²	137.4	84%	0.836	79%	0.79	S	S	*	*			trans	-159.6	146	143.2	-103.5	151.8	0	0	0	109.2	P333	I331-P333 HydrophobicContact CG2-CG 4.47Å
332	S	38.8	Very low	38.7	Very low	120 Å²	120	135.4 Å²	135.4	84%	0.839	78%	0.776	S	S	*	*			trans	-147.3	126.9	170.5	175.9	0	0	0	0	109.8
333	P	40.4	Very low	38.9	Very low	92 Å²	92	136 Å²	136	60%	0.597	78%	0.777	S	S	*	*			trans	-143	135.5	165.1	29.7	-9.3	0	0	0	116.4	I331	I331-P333 HydrophobicContact CG2-CG 4.47Å
334	L	39.5	Very low	38.8	Very low	159 Å²	159	139.5 Å²	139.5	83%	0.832	78%	0.775	S	S	*	*			trans	67.3	167.3	142.3	-83.1	56.7	0	0	0	120
335	K	38.6	Very low	38.4	Very low	157 Å²	157	142.8 Å²	142.8	68%	0.683	78%	0.776	S	S	*	*			cis	176.9	137.5	-41.6	-179.2	169.2	-173.2	175.1	0	107.8
336	K	44	Very low	38	Very low	208 Å²	208	142.8 Å²	142.8	90%	0.904	77%	0.773	S	S	*	*			trans	-131.4	150	157.4	-77.2	-170.6	176.6	179.3	0	109.4
337	N	33.1	Very low	37.3	Very low	107 Å²	107	145.6 Å²	145.6	57%	0.572	77%	0.774	S	S	*	*			trans	-149.8	-179.3	-164.1	-158.6	86	0	0	0	109.6
338	F	36.3	Very low	37	Very low	196 Å²	196	150.1 Å²	150.1	86%	0.86	78%	0.777	S	S	*	*			trans	77.8	145.1	-177.9	-51.1	-76.2	0	0	0	114.5
339	A	42	Very low	36.3	Very low	99 Å²	99	146.7 Å²	146.7	82%	0.818	77%	0.774	S	S	*	*			cis	-131.9	160.4	3.5	0	0	0	0	0	112.6
340	S	32.5	Very low	36.1	Very low	104 Å²	104	151 Å²	151	73%	0.727	78%	0.779	S	S	*	*			trans	-94.4	151.6	176	178.8	0	0	0	0	111.4
341	N	44.5	Very low	36.2	Very low	173 Å²	173	151.4 Å²	151.4	93%	0.925	78%	0.779	S	S	*	*			trans	-151.7	151.4	148.4	-109.4	-39.2	0	0	0	110.7
342	H	33	Very low	35.6	Very low	134 Å²	134	149.5 Å²	149.5	62%	0.62	78%	0.78	S	S	*	*			trans	-140	119.3	-154.8	164.1	-71.9	0	0	0	112.1	Q344	H342-Q344 VanDerWaalsContact CE1-CG 3.5Å; H342-Q344 WeakPolarHBondContact CE1-CG 3.5Å
343	I	38.9	Very low	35.4	Very low	174 Å²	174	148.2 Å²	148.2	89%	0.892	77%	0.771	S	S	*	*			trans	-131.4	144.1	169.3	-63.6	-177.2	0	0	0	108.6
344	Q	34.2	Very low	34.9	Very low	141 Å²	141	148.2 Å²	148.2	66%	0.659	78%	0.778	S	S	*	*			trans	-99.9	162.4	-161.7	-67.5	178.8	-35.3	0	0	114.7	H342	H342-Q344 VanDerWaalsContact CE1-CG 3.5Å; H342-Q344 WeakPolarHBondContact CE1-CG 3.5Å
345	L	29.3	Very low	34.9	Very low	138 Å²	138	150.1 Å²	150.1	72%	0.723	78%	0.78	S	S	*	*			trans	39.9	129	146.6	-91.4	69.3	0	0	0	119.5
346	Q	36.9	Very low	34.6	Very low	169 Å²	169	146.6 Å²	146.6	79%	0.79	78%	0.781	S	S	*	*				-145.6	154.4	94.9	-82	-132.6	-15.1	0	0	111.5
347	K	28.9	Very low	34.1	Very low	179 Å²	179	142.5 Å²	142.5	78%	0.778	78%	0.775	S	S	*	*			trans	-94.9	139.7	178.3	-63	174.6	179.6	176.1	0	109.6
348	Y	33.1	Very low	34.1	Very low	214 Å²	214	147 Å²	147	84%	0.839	79%	0.79	S	S	*	*			trans	-125.1	98.4	155	-78.8	-73.6	0	0	0	110
349	A	28.6	Very low	33.7	Very low	97 Å²	97	143.1 Å²	143.1	80%	0.802	79%	0.787	S	S	*	*	P	Polyproline II helix	trans	-72.4	133.8	161.2	0	0	0	0	0	108.4
350	R	34	Very low	33.5	Very low	240 Å²	240	149.9 Å²	149.9	91%	0.906	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-91.3	138.8	160.9	-85.6	-168.9	171.1	-150.7	-2	109
351	P	34.7	Very low	33.6	Very low	115 Å²	115	153.1 Å²	153.1	75%	0.747	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-70.3	148.4	179.6	30	-34.9	0	0	0	111
352	S	26.3	Very low	33	Very low	124 Å²	124	152.7 Å²	152.7	87%	0.867	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-69.9	131	156.5	-178.8	0	0	0	0	108.6
353	S	35.5	Very low	33.1	Very low	92 Å²	92	153 Å²	153	64%	0.643	80%	0.796	S	S	*	*			trans	-129.8	105.8	168.7	60.7	0	0	0	0	108.2
354	A	29.7	Very low	33.2	Very low	92 Å²	92	150.5 Å²	150.5	76%	0.76	79%	0.794	S	S	*	*			trans	-67.5	141.1	179.8	0	0	0	0	0	111.3
355	F	38.7	Very low	33.1	Very low	199 Å²	199	150.4 Å²	150.4	87%	0.873	80%	0.797	S	S	*	*			trans	-129.7	140.3	158.7	-85.7	-80.7	0	0	0	109.2
356	A	33.4	Very low	33.3	Very low	83 Å²	83	150.7 Å²	150.7	69%	0.686	80%	0.799	S	S	*	*			trans	-79.1	155.2	-158.5	0	0	0	0	0	114.2
357	P	32.6	Very low	33.3	Very low	122 Å²	122	154.2 Å²	154.2	79%	0.792	81%	0.805	S	S	*	*			trans	-64.5	133	166.5	29.4	-34.7	0	0	0	110.1	S359	P357-S359 PolarHBondContact O-N 3.41Å
358	K	32.4	Very low	33.7	Very low	203 Å²	203	149.8 Å²	149.8	88%	0.883	80%	0.802	S	S	*	*			trans	-91	83	173.7	-74.5	-165.8	173.7	-171.7	0	111.2
359	S	29	Very low	33.8	Very low	114 Å²	114	145.8 Å²	145.8	80%	0.797	80%	0.795	S	S	*	*			trans	-66.2	130.8	154.6	50.9	0	0	0	0	109.4	P357	P357-S359 PolarHBondContact O-N 3.41Å
360	W	37.9	Very low	34.2	Very low	241 Å²	241	149 Å²	149	91%	0.913	80%	0.799	S	S	*	*			trans	-129.1	99.5	163.5	66.5	-78.7	0	0	0	108.5
361	M	34	Very low	34.4	Very low	171 Å²	171	143.2 Å²	143.2	84%	0.842	79%	0.785	S	S	*	*			trans	-114.8	158.1	162.3	-84.1	172.1	163.7	0	0	106.6
362	E	32.1	Very low	34.6	Very low	165 Å²	165	147.1 Å²	147.1	77%	0.771	79%	0.79	S	S	*	*			trans	37.8	103.3	168.5	-88.9	74.4	150.1	0	0	117.1
363	D	34.7	Very low	35.3	Very low	140 Å²	140	146.4 Å²	146.4	75%	0.749	78%	0.783	S	S	*	*				-170.9	133.3	95.3	-137.6	-43.1	0	0	0	112.7
364	S	40.5	Very low	35.3	Very low	121 Å²	121	150.7 Å²	150.7	85%	0.846	79%	0.791	S	S	*	*			trans	167.6	76.7	158.4	-77.7	0	0	0	0	110.8
365	L	32.2	Very low	36	Very low	140 Å²	140	152.3 Å²	152.3	73%	0.733	79%	0.793	S	S	*	*			trans	-68.3	153.3	171.3	-94.2	65	0	0	0	112.5
366	N	34	Very low	35.9	Very low	144 Å²	144	149.4 Å²	149.4	77%	0.77	79%	0.787	S	S	*	*			trans	65.4	103.2	160.2	-62.1	-51.1	0	0	0	119.2
367	R	37.2	Very low	36.1	Very low	242 Å²	242	156.4 Å²	156.4	91%	0.913	80%	0.796	S	S	*	*				-176.2	139.5	96.6	-101.8	177.9	175	-176.7	-1.3	115
368	A	36.5	Very low	36.4	Very low	87 Å²	87	156.1 Å²	156.1	72%	0.719	79%	0.793	S	S	*	*			trans	43.5	110.7	154.6	0	0	0	0	0	119
369	D	35.1	Very low	36.7	Very low	129 Å²	129	157.2 Å²	157.2	69%	0.69	79%	0.792	S	S	*	*				63.4	112.8	76.8	-89.8	-67.5	0	0	0	115.5	I371	D369-I371 VanDerWaalsContact OD1-CD1 3.23Å; D369-I371 WeakPolarHBondContact OD1-CD1 3.26Å
370	N	38.8	Very low	37.2	Very low	165 Å²	165	158.3 Å²	158.3	88%	0.882	79%	0.794	S	S	*	*			trans	-165	119.4	136.3	-104.4	-75.8	0	0	0	108.6
371	I	37.6	Very low	37.4	Very low	119 Å²	119	155.7 Å²	155.7	61%	0.61	79%	0.789	S	S	*	*			trans	-98.4	140.1	-171.8	-80.7	62.5	0	0	0	110.8	D369	D369-I371 VanDerWaalsContact OD1-CD1 3.23Å; D369-I371 WeakPolarHBondContact OD1-CD1 3.26Å
372	F	38.1	Very low	37.8	Very low	196 Å²	196	152.5 Å²	152.5	86%	0.86	78%	0.776	S	S	*	*			trans	-136.5	135	151.3	-90	-81.6	0	0	0	110.4
373	P	40.6	Very low	38.8	Very low	110 Å²	110	151 Å²	151	71%	0.714	77%	0.77	S	S	*	*			trans	-91	139.7	-169.6	34	-35	0	0	0	114.3
374	F	36.8	Very low	40.1	Very low	182 Å²	182	150.8 Å²	150.8	80%	0.798	77%	0.765	S	S	*	*			trans	-86.7	137.6	164.3	-80.7	-101.7	0	0	0	111	D376	F374-D376 PolarHBondContact O-N 2.96Å
375	P	44.5	Very low	41.3	Very low	126 Å²	126	149 Å²	149	82%	0.818	75%	0.752	S	S	*	*			trans	-97	59	169.1	37.8	-33.1	0	0	0	111.6	R377	P375-R377 PolarHBondContact O-N 3.35Å
376	D	37	Very low	42.9	Very low	137 Å²	137	147.5 Å²	147.5	73%	0.733	74%	0.744	S	S	*	*			trans	-68.7	124.5	174.3	-86.8	-65.7	0	0	0	111.2	F374	F374-D376 PolarHBondContact O-N 2.96Å
377	R	36.9	Very low	44.5	Very low	231 Å²	231	146.7 Å²	146.7	87%	0.872	74%	0.736	S	S	*	*			trans	-113.9	104.1	-173.4	-160.2	173.4	-150.7	-132.2	0.4	110.9	P375 R379	P375-R377 PolarHBondContact O-N 3.35Å; R377-R379 PolarHBondContact O-N 2.94Å
378	P	39.6	Very low	46.2	Very low	115 Å²	115	138.4 Å²	138.4	75%	0.747	72%	0.715	S	S	*	*			trans	-66.8	127.3	179.4	27.5	-33.5	0	0	0	110.2
379	R	37.8	Very low	48	Very low	227 Å²	227	137.2 Å²	137.2	86%	0.857	70%	0.702	S	S	*	*			trans	-93.9	98.6	160.4	-76	-173.2	177	167.5	0.5	108.1	R377 F381	R377-R379 PolarHBondContact O-N 2.94Å; R379-F381 PolarHBondContact O-N 2.67Å
380	T	39.4	Very low	49.6	Very low	136 Å²	136	136.1 Å²	136.1	83%	0.834	70%	0.695	S	S	*	*			trans	-61.3	123.4	163.9	39.1	0	0	0	0	108.8
381	F	42.9	Very low	51.6	Low	187 Å²	187	131.4 Å²	131.4	82%	0.82	67%	0.669	S	S	*	*			trans	-85	113.5	168.9	-80.3	-93.6	0	0	0	108.2	R379 M383	R379-F381 PolarHBondContact O-N 2.67Å; F381-M383 PolarHBondContact O-N 3.03Å
382	D	41.8	Very low	53.3	Low	104 Å²	104	130 Å²	130	56%	0.556	66%	0.663	S	S	*	*			trans	-77.2	116	176.4	-178	12	0	0	0	110.6	H384	D382-H384 VanDerWaalsContact C-N 3.31Å; D382-H384 PolarHBondContact O-N 3.42Å; D382-H384 IonicContact OD1-CE1 3.09Å; D382-H384 IonicContact OD1-CG 2.87Å; D382-H384 PolarHBondContact OD1-N 3.33Å; D382-H384 IonicContact OD1-ND1 3.14Å; D382-H384 PolarHBondContact OD1-ND1 2.99Å
383	M	54	Low	55.2	Low	132 Å²	132	125.1 Å²	125.1	65%	0.65	65%	0.645	S	S	*	*	H	α-helix	trans	-68	-27.2	-178.1	-79.4	-68.1	-179.8	0	0	113.3	F381 S385 L386 E387	F381-M383 PolarHBondContact O-N 3.03Å; M383-S385 PolarHBondContact O-N 3.24Å; M383-S385 VanDerWaalsContact O-N 3.16Å; M383-L386 PolarHBondContact O-N 3.38Å; M383-L386 VanDerWaalsContact O-N 3.08Å; M383-L386 HydrophobicContact SD-CD1 4.16Å; M383-E387 PolarHBondContact O-N 2.77Å
384	H	61.8	Low	56.9	Low	137 Å²	137	126 Å²	126	63%	0.634	64%	0.641	S	S	*	*	H	α-helix	trans	-63.6	-26.1	-175.9	-57.6	93.9	0	0	0	113	D382 S388	D382-H384 VanDerWaalsContact C-N 3.31Å; D382-H384 PolarHBondContact O-N 3.42Å; D382-H384 IonicContact OD1-CE1 3.09Å; D382-H384 IonicContact OD1-CG 2.87Å; D382-H384 PolarHBondContact OD1-N 3.33Å; D382-H384 IonicContact OD1-ND1 3.14Å; D382-H384 PolarHBondContact OD1-ND1 2.99Å; H384-S388 WeakPolarHBondContact O-CB 3.3Å; H384-S388 PolarHBondContact O-N 2.84Å; H384-S388 VanDerWaalsContact O-N 3.09Å; H384-S388 PolarHBondContact O-OG 2.88Å
385	S	64.3	Low	58.7	Low	83 Å²	83	124 Å²	124	58%	0.58	63%	0.628	S	S	*	*	H	α-helix	trans	-71.5	-36	176.6	-168.3	0	0	0	0	112.5	M383 S389	M383-S385 PolarHBondContact O-N 3.24Å; M383-S385 VanDerWaalsContact O-N 3.16Å; S385-S389 WeakPolarHBondContact O-CB 3.48Å; S385-S389 PolarHBondContact O-N 3.01Å; S385-S389 VanDerWaalsContact O-N 3.11Å
386	L	65.8	Low	59.9	Low	109 Å²	109	121.3 Å²	121.3	57%	0.571	62%	0.616	S	S	*	*	H	α-helix	trans	-71.2	-40.5	176.3	-75.3	171.7	0	0	0	111.9	M383 S389 L390	M383-L386 PolarHBondContact O-N 3.38Å; M383-L386 VanDerWaalsContact O-N 3.08Å; M383-L386 HydrophobicContact SD-CD1 4.16Å; L386-S389 PolarHBondContact O-N 2.94Å; L386-L390 WeakPolarHBondContact O-CG 3.38Å; L386-L390 PolarHBondContact O-N 3.11Å
387	E	68.8	Low	61	Low	126 Å²	126	122.4 Å²	122.4	59%	0.589	62%	0.617	S	S	*	*	H	α-helix	trans	-67.3	-42.6	178	-167.5	163.4	170.8	0	0	111.5	M383 S389 L390 I391	M383-E387 PolarHBondContact O-N 2.77Å; E387-S389 VanDerWaalsContact C-N 3.33Å; E387-S389 PolarHBondContact O-N 2.87Å; E387-L390 PolarHBondContact O-N 3.35Å; E387-I391 HydrophobicContact CG-CD1 4.12Å; E387-I391 WeakPolarHBondContact O-CD1 3.17Å; E387-I391 VanDerWaalsContact O-CG1 3.26Å; E387-I391 WeakPolarHBondContact O-CG1 3.41Å; E387-I391 PolarHBondContact O-N 3.09Å
388	S	71.9	Confident	62.1	Low	69 Å²	69	117.7 Å²	117.7	48%	0.483	61%	0.609	S	S	.	*	H	α-helix	trans	-55.9	-46.4	172.2	-58.2	0	0	0	0	112	H384 I391 D392	H384-S388 WeakPolarHBondContact O-CB 3.3Å; H384-S388 PolarHBondContact O-N 2.84Å; H384-S388 VanDerWaalsContact O-N 3.09Å; H384-S388 PolarHBondContact O-OG 2.88Å; S388-I391 PolarHBondContact O-N 3.26Å; S388-D392 PolarHBondContact O-N 3.08Å
389	S	73.8	Confident	62.5	Low	62 Å²	62	119 Å²	119	43%	0.434	61%	0.61	S	S	.	*	H	α-helix	trans	-65.7	-37.7	178.8	-173.8	0	0	0	0	113	S385 L386 E387 D392 I393	S385-S389 WeakPolarHBondContact O-CB 3.48Å; S385-S389 PolarHBondContact O-N 3.01Å; S385-S389 VanDerWaalsContact O-N 3.11Å; L386-S389 PolarHBondContact O-N 2.94Å; E387-S389 VanDerWaalsContact C-N 3.33Å; E387-S389 PolarHBondContact O-N 2.87Å; S389-D392 PolarHBondContact O-N 3.16Å; S389-I393 VanDerWaalsContact O-CG1 3.3Å; S389-I393 WeakPolarHBondContact O-CG1 3.37Å; S389-I393 PolarHBondContact O-N 3.17Å
390	L	70.3	Confident	62.8	Low	105 Å²	105	114.1 Å²	114.1	55%	0.55	61%	0.605	S	S	.	*	H	α-helix	trans	-65.8	-40.6	174.1	-80.2	167.4	0	0	0	112.4	L386 E387 D392 I393 M394	L386-L390 WeakPolarHBondContact O-CG 3.38Å; L386-L390 PolarHBondContact O-N 3.11Å; E387-L390 PolarHBondContact O-N 3.35Å; L390-D392 VanDerWaalsContact C-N 3.34Å; L390-I393 PolarHBondContact O-N 3.37Å; L390-M394 WeakPolarHBondContact O-CG 3.41Å; L390-M394 PolarHBondContact O-N 3.1Å
391	I	79.4	Confident	62.9	Low	67 Å²	67	114.4 Å²	114.4	34%	0.344	60%	0.601	S	S	.	*	H	α-helix	trans	-66.2	-38	177	-61.6	161.8	0	0	0	110.7	E387 S388 M394 R395	E387-I391 HydrophobicContact CG-CD1 4.12Å; E387-I391 WeakPolarHBondContact O-CD1 3.17Å; E387-I391 VanDerWaalsContact O-CG1 3.26Å; E387-I391 WeakPolarHBondContact O-CG1 3.41Å; E387-I391 PolarHBondContact O-N 3.09Å; S388-I391 PolarHBondContact O-N 3.26Å; I391-M394 HydrophobicContact CG1-CE 4.35Å; I391-M394 PolarHBondContact O-N 2.85Å; I391-R395 PolarHBondContact O-N 3.05Å
392	D	75	Confident	62.7	Low	89 Å²	89	115.5 Å²	115.5	48%	0.476	61%	0.605	S	S	.	*	H	α-helix	trans	-66.7	-38.6	174.9	-77.4	-6.6	0	0	0	112.5	S388 S389 L390 R395 A396	S388-D392 PolarHBondContact O-N 3.08Å; S389-D392 PolarHBondContact O-N 3.16Å; L390-D392 VanDerWaalsContact C-N 3.34Å; D392-R395 PolarHBondContact O-N 3.43Å; D392-R395 IonicContact OD1-CZ 3.25Å; D392-R395 VanDerWaalsContact OD1-CZ 3.25Å; D392-R395 IonicContact OD1-NH1 2.67Å; D392-R395 PolarHBondContact OD1-NH1 3.21Å; D392-R395 IonicContact OD1-NH2 2.94Å; D392-R395 PolarHBondContact OD1-NH2 3Å; D392-A396 WeakPolarHBondContact O-CB 3.31Å; D392-A396 PolarHBondContact O-N 3.46Å
393	I	76.8	Confident	62.6	Low	93 Å²	93	114.5 Å²	114.5	48%	0.477	62%	0.619	S	S	.	*	H	α-helix	trans	-62.5	-47.1	172.3	-69.1	163.3	0	0	0	110.8	S389 L390 R395 A396 E397	S389-I393 VanDerWaalsContact O-CG1 3.3Å; S389-I393 WeakPolarHBondContact O-CG1 3.37Å; S389-I393 PolarHBondContact O-N 3.17Å; L390-I393 PolarHBondContact O-N 3.37Å; I393-R395 VanDerWaalsContact C-N 3.31Å; I393-R395 PolarHBondContact O-N 3.43Å; I393-A396 PolarHBondContact O-N 2.75Å; I393-E397 PolarHBondContact O-N 2.92Å
394	M	76.7	Confident	61.6	Low	128 Å²	128	119.9 Å²	119.9	63%	0.631	63%	0.632	S	S	*	*	H	α-helix	trans	-63.8	-33	178.3	-71.3	-168.2	-60.4	0	0	113.1	L390 I391	L390-M394 WeakPolarHBondContact O-CG 3.41Å; L390-M394 PolarHBondContact O-N 3.1Å; I391-M394 HydrophobicContact CG1-CE 4.35Å; I391-M394 PolarHBondContact O-N 2.85Å
395	R	75	Confident	60.3	Low	141 Å²	141	121.3 Å²	121.3	53%	0.532	64%	0.644	S	S	.	*	H	α-helix	trans	-70.7	-44.3	171.3	-80.1	-166.1	-101.6	85	0.7	111.8	I391 D392 I393 E397 N398	I391-R395 PolarHBondContact O-N 3.05Å; D392-R395 PolarHBondContact O-N 3.43Å; D392-R395 IonicContact OD1-CZ 3.25Å; D392-R395 VanDerWaalsContact OD1-CZ 3.25Å; D392-R395 IonicContact OD1-NH1 2.67Å; D392-R395 PolarHBondContact OD1-NH1 3.21Å; D392-R395 IonicContact OD1-NH2 2.94Å; D392-R395 PolarHBondContact OD1-NH2 3Å; I393-R395 VanDerWaalsContact C-N 3.31Å; I393-R395 PolarHBondContact O-N 3.43Å; R395-E397 VanDerWaalsContact C-N 3.33Å; R395-E397 PolarHBondContact O-N 3.03Å; R395-N398 PolarHBondContact O-N 2.75Å
396	A	68.1	Low	58.6	Low	70 Å²	70	123.5 Å²	123.5	58%	0.579	65%	0.649	S	S	*	*	H	α-helix	trans	-63.2	-34	-178	0	0	0	0	0	113.9	D392 I393 N398	D392-A396 WeakPolarHBondContact O-CB 3.31Å; D392-A396 PolarHBondContact O-N 3.46Å; I393-A396 PolarHBondContact O-N 2.75Å; A396-N398 VanDerWaalsContact C-N 3.33Å
397	E	60.9	Low	57.1	Low	159 Å²	159	129.7 Å²	129.7	74%	0.743	67%	0.666	S	S	*	*	H	α-helix	trans	-74.3	-23.3	179.5	-159.3	166.5	-177.7	0	0	112.8	I393 R395	I393-E397 PolarHBondContact O-N 2.92Å; R395-E397 VanDerWaalsContact C-N 3.33Å; R395-E397 PolarHBondContact O-N 3.03Å
398	N	59.2	Low	55.2	Low	133 Å²	133	128.8 Å²	128.8	71%	0.711	67%	0.674	S	S	*	*	H	α-helix	trans	-86.3	-18.5	-170.2	-161	54.5	0	0	0	115.1	R395 A396	R395-N398 PolarHBondContact O-N 2.75Å; A396-N398 VanDerWaalsContact C-N 3.33Å
399	D	49.8	Very low	53.4	Low	142 Å²	142	136.9 Å²	136.9	76%	0.759	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.1	-5.3	-174.6	-94	-46.4	0	0	0	115.1	I401	D399-I401 PolarHBondContact O-N 2.86Å
400	T	44	Very low	51.7	Low	124 Å²	124	139.9 Å²	139.9	76%	0.761	71%	0.713	S	S	*	*			trans	-80.7	19.6	-169.6	-51.3	0	0	0	0	114.3
401	I	41.4	Very low	50	Low	143 Å²	143	138.1 Å²	138.1	73%	0.733	72%	0.721	S	S	*	*			trans	-128.9	71	-173.7	-44.9	-178.1	0	0	0	113.3	D399	D399-I401 PolarHBondContact O-N 2.86Å
402	K	38.5	Very low	47.9	Very low	210 Å²	210	140.1 Å²	140.1	91%	0.913	74%	0.741	S	S	*	*			trans	175.6	128.8	144.1	-93.5	143.1	-165.2	166.8	0	111.1
403	G	38.3	Very low	45.9	Very low	83 Å²	83	143.2 Å²	143.2	86%	0.856	76%	0.757	S	S	*	*			trans	156.1	89.9	169.2	0	0	0	0	0	114.9
404	R	33.7	Very low	44	Very low	244 Å²	244	145 Å²	145	92%	0.921	78%	0.778	S	S	*	*			trans	-99.5	140	161.3	-69.1	-172	-177.8	-145.7	6.2	108.9
405	L	34.4	Very low	42	Very low	167 Å²	167	144.2 Å²	144.2	87%	0.874	79%	0.785	S	S	*	*				-177.3	162.4	120.3	-98.5	161.5	0	0	0	112.2
406	N	29.2	Very low	40.2	Very low	130 Å²	130	145 Å²	145	70%	0.695	80%	0.799	S	S	*	*			trans	-73.5	158.8	-170.1	-52.4	-12.7	0	0	0	113.1
407	Y	33.1	Very low	38.6	Very low	238 Å²	238	149.1 Å²	149.1	93%	0.933	81%	0.811	S	S	*	*				-160.9	152.8	109.3	-92.8	-66	0	0	0	110
408	S	29.4	Very low	37.3	Very low	107 Å²	107	148.1 Å²	148.1	75%	0.748	81%	0.809	S	S	*	*			trans	-147.6	140.2	-172.9	-48.8	0	0	0	0	111.8
409	Y	33.6	Very low	36	Very low	240 Å²	240	147.5 Å²	147.5	94%	0.941	81%	0.806	S	S	*	*			trans	-147.3	149.7	157.6	-104.9	-86	0	0	0	110
410	P	38.5	Very low	35.3	Very low	124 Å²	124	146 Å²	146	81%	0.805	81%	0.813	S	S	*	*			trans	-117.7	163.4	-162	40.5	-29.1	0	0	0	115.7
411	G	35.9	Very low	35	Very low	68 Å²	68	149.6 Å²	149.6	70%	0.701	81%	0.812	S	S	*	*			trans	174.4	128.3	165.6	0	0	0	0	0	115.7
412	S	35.5	Very low	34.8	Very low	109 Å²	109	148.9 Å²	148.9	76%	0.762	82%	0.815	S	S	*	*			trans	47.3	95.2	161.3	60.6	0	0	0	0	120.4
413	D	32.9	Very low	34.5	Very low	155 Å²	155	150.8 Å²	150.8	83%	0.829	82%	0.818	S	S	*	*				45	91.4	119.9	-50.8	-38.3	0	0	0	120.6
414	S	35.9	Very low	34.2	Very low	129 Å²	129	149.6 Å²	149.6	90%	0.902	81%	0.806	S	S	*	*				-157	142.4	126.8	-83.3	0	0	0	0	110.6
415	S	34.3	Very low	34.3	Very low	113 Å²	113	149.9 Å²	149.9	79%	0.79	81%	0.807	S	S	*	*			trans	-85.8	168.8	-172.9	-164.3	0	0	0	0	113.1
416	L	38.6	Very low	34.6	Very low	157 Å²	157	153.5 Å²	153.5	82%	0.822	81%	0.809	S	S	*	*			trans	77.6	76.7	177.7	-49.2	-176.1	0	0	0	116.1	I418	L416-I418 PolarHBondContact O-N 3.06Å
417	L	32.6	Very low	35	Very low	157 Å²	157	159.6 Å²	159.6	82%	0.822	82%	0.822	S	S	*	*			trans	-51.1	126.9	152.8	-70.5	149.1	0	0	0	109.4
418	I	34.3	Very low	35	Very low	137 Å²	137	151 Å²	151	70%	0.703	81%	0.806	S	S	*	*				53.1	100.5	81.9	-57.9	178	0	0	0	112.8	L416	L416-I418 PolarHBondContact O-N 3.06Å
419	N	32.7	Very low	35.2	Very low	121 Å²	121	153 Å²	153	65%	0.647	80%	0.804	S	S	*	*				-171.1	88.4	129.1	-102.3	-60.8	0	0	0	110.6	R421	N419-R421 PolarHBondContact O-N 3.3Å
420	A	33.8	Very low	35.4	Very low	110 Å²	110	146 Å²	146	91%	0.909	79%	0.789	S	S	*	*			trans	-76.6	106.8	165.4	0	0	0	0	0	108.8
421	R	38.6	Very low	35.3	Very low	200 Å²	200	144.7 Å²	144.7	76%	0.755	78%	0.783	S	S	*	*			trans	-133.5	113.6	178.8	-92.1	-179.4	163.9	153.4	-5.4	112.5	N419	N419-R421 PolarHBondContact O-N 3.3Å
422	T	36.7	Very low	35.7	Very low	127 Å²	127	146.4 Å²	146.4	78%	0.779	78%	0.776	S	S	*	*			trans	53.4	90.4	142.6	-37	0	0	0	0	117.4	G424	T422-G424 PolarHBondContact O-N 3.28Å
423	Y	31.6	Very low	36.3	Very low	250 Å²	250	147.3 Å²	147.3	98%	0.98	77%	0.766	S	S	*	*			trans	-66.8	101.4	160.8	-80.5	-89.2	0	0	0	110.2
424	G	33.4	Very low	36.6	Very low	58 Å²	58	145 Å²	145	60%	0.598	76%	0.76	S	S	*	*			trans	-165.2	117.8	178.5	0	0	0	0	0	113.9	T422	T422-G424 PolarHBondContact O-N 3.28Å
425	R	35.7	Very low	36.7	Very low	250 Å²	250	147 Å²	147	94%	0.943	76%	0.757	S	S	*	*			trans	33.9	93.7	158	-69	-81	-148.3	-136.9	0.3	117.3
426	R	39.9	Very low	37.1	Very low	244 Å²	244	150.4 Å²	150.4	92%	0.921	76%	0.761	S	S	*	*			trans	-131.5	130	133.2	-73.5	-163.5	-174.7	-89.2	-1.5	110.1	G428	R426-G428 PolarHBondContact O-N 3.05Å
427	R	37.4	Very low	37.2	Very low	257 Å²	257	150.4 Å²	150.4	97%	0.97	76%	0.762	S	S	*	*			trans	-72.8	105.3	160.2	-76.6	178.7	171.4	170.1	-4.9	106.7
428	G	34	Very low	37.4	Very low	58 Å²	58	146.4 Å²	146.4	60%	0.598	76%	0.758	S	S	*	*			trans	-84.8	146.4	158.7	0	0	0	0	0	109.1	R426 S430	R426-G428 PolarHBondContact O-N 3.05Å; G428-S430 PolarHBondContact O-N 3.43Å
429	Q	33.2	Very low	37.7	Very low	149 Å²	149	149.9 Å²	149.9	70%	0.696	77%	0.768	S	S	*	*			trans	-71.9	112.7	163	-71.6	-172.1	8	0	0	108
430	S	38.4	Very low	38.4	Very low	92 Å²	92	152.3 Å²	152.3	64%	0.643	78%	0.78	S	S	*	*			trans	-98.2	86.9	173.4	-61.7	0	0	0	0	109.3	G428 L432	G428-S430 PolarHBondContact O-N 3.43Å; S430-L432 PolarHBondContact O-N 2.9Å
431	S	36.1	Very low	38.9	Very low	97 Å²	97	154.8 Å²	154.8	68%	0.678	78%	0.778	S	S	*	*			trans	-67.6	78.8	163	41.5	0	0	0	0	109.1	F433	S431-F433 CarbonylContact O-C 3.49Å; S431-F433 PolarHBondContact O-N 2.99Å
432	L	44.5	Very low	39.2	Very low	104 Å²	104	151.3 Å²	151.3	55%	0.545	78%	0.775	S	S	.	*	S	Bend	trans	-65.9	8	-172	-73.6	168.7	0	0	0	115.4	S430 L576	S430-L432 PolarHBondContact O-N 2.9Å; L432-L576 HydrophobicContact CD1-CD1 4.06Å
433	F	48.1	Very low	39.6	Very low	128 Å²	128	148.8 Å²	148.8	56%	0.561	77%	0.774	S	S	*	*	S	Bend	trans	-136.4	99.5	165.6	-59.5	-77.3	0	0	0	108.3	S431	S431-F433 CarbonylContact O-C 3.49Å; S431-F433 PolarHBondContact O-N 2.99Å
434	P	39.1	Very low	40.2	Very low	108 Å²	108	147.9 Å²	147.9	70%	0.701	77%	0.769	S	S	*	*			trans	-63.1	133.6	165.6	-17.2	31.3	0	0	0	109.5
435	M	38.7	Very low	40.7	Very low	171 Å²	171	148.9 Å²	148.9	84%	0.842	78%	0.779	S	S	*	*			trans	-94.1	111	154.7	-79	-177.3	-70.9	0	0	106.6	D437	M435-D437 PolarHBondContact O-N 2.82Å
436	E	42.4	Very low	40.9	Very low	184 Å²	184	144.4 Å²	144.4	86%	0.86	77%	0.773	S	S	*	*			trans	-85.8	84.2	-178.5	53.3	-176.7	93.5	0	0	111.8
437	D	41	Very low	41	Very low	157 Å²	157	140.7 Å²	140.7	84%	0.84	77%	0.767	S	S	*	*			trans	-99.5	86.6	162.4	-88.6	-55.7	0	0	0	109.1	M435	M435-D437 PolarHBondContact O-N 2.82Å
438	G	35.1	Very low	41.2	Very low	72 Å²	72	133 Å²	133	74%	0.742	75%	0.75	S	S	*	*			trans	-89.5	109.1	-176.3	0	0	0	0	0	113.6
439	F	41.1	Very low	41.4	Very low	210 Å²	210	137 Å²	137	92%	0.921	76%	0.757	S	S	*	*			trans	-131	134.6	162.1	-92.5	-86.8	0	0	0	111.7
440	L	47.2	Very low	41.8	Very low	172 Å²	172	139.2 Å²	139.2	90%	0.901	77%	0.767	S	S	*	*			trans	-93.1	136.8	179.3	-68.4	160.8	0	0	0	110.7
441	D	45.5	Very low	41.6	Very low	162 Å²	162	140.6 Å²	140.6	87%	0.866	78%	0.776	S	S	*	*				-162.2	150	123.8	-156.1	23.2	0	0	0	110.6
442	D	44	Very low	41.9	Very low	128 Å²	128	139.7 Å²	139.7	68%	0.684	78%	0.782	S	S	*	*			trans	-130	123.4	172.1	-172	-48.6	0	0	0	109.3
443	G	46	Very low	41.9	Very low	74 Å²	74	143.7 Å²	143.7	76%	0.763	80%	0.804	S	S	*	*			trans	-147.9	69.7	-171.1	0	0	0	0	0	112.8
444	R	43.1	Very low	41.4	Very low	231 Å²	231	141.1 Å²	141.1	87%	0.872	81%	0.813	S	S	*	*			trans	-61.2	134.9	177.4	-67.4	178.6	173.7	-128.7	-2.6	113.3
445	G	44.6	Very low	41.3	Very low	78 Å²	78	141.8 Å²	141.8	80%	0.804	82%	0.82	S	S	*	*			trans	-131.7	147.8	162.5	0	0	0	0	0	109.6
446	D	40.2	Very low	41.2	Very low	156 Å²	156	139 Å²	139	83%	0.834	82%	0.815	S	S	*	*			trans	-128.7	161.8	-150.7	-145.5	-23.9	0	0	0	115.7
447	Q	41.4	Very low	40.8	Very low	166 Å²	166	139.8 Å²	139.8	78%	0.776	82%	0.818	S	S	*	*			trans	79.8	152	157.6	-68.9	-128.6	82.1	0	0	122.7
448	P	40.7	Very low	40.3	Very low	97 Å²	97	137.1 Å²	137.1	63%	0.63	81%	0.811	S	S	*	*			trans	-141.1	-150.3	-148.7	36.6	-10.6	0	0	0	114.8
449	L	40.1	Very low	40.2	Very low	142 Å²	142	143.5 Å²	143.5	74%	0.743	82%	0.818	S	S	*	*			trans	84.9	115.7	163.6	-50.9	-179.8	0	0	0	119.1
450	H	39.7	Very low	39.8	Very low	195 Å²	195	138 Å²	138	90%	0.903	81%	0.806	S	S	*	*				-156.6	152.7	123.1	-108.8	75.4	0	0	0	110.6
451	S	35.2	Very low	39.5	Very low	120 Å²	120	137 Å²	137	84%	0.839	80%	0.796	S	S	*	*			trans	-118.1	152.8	-171.5	-55.1	0	0	0	0	112.8
452	G	42.8	Very low	39.2	Very low	78 Å²	78	137.6 Å²	137.6	80%	0.804	79%	0.794	S	S	*	*			trans	-158.7	143	171.1	0	0	0	0	0	111.3
453	L	45.2	Very low	38.7	Very low	189 Å²	189	139.7 Å²	139.7	99%	0.99	81%	0.805	S	S	*	*			trans	-100.4	149.4	-171.6	-62	114.7	0	0	0	112.7
454	G	36.8	Very low	38.6	Very low	73 Å²	73	138.8 Å²	138.8	75%	0.753	80%	0.796	S	S	*	*			trans	-179.7	80.8	173.8	0	0	0	0	0	117.4
455	S	36.8	Very low	39	Very low	123 Å²	123	136.2 Å²	136.2	86%	0.86	79%	0.794	S	S	*	*			trans	62	159.8	161.1	-72.1	0	0	0	0	120.1
456	P	37.1	Very low	39.9	Very low	113 Å²	113	141.2 Å²	141.2	73%	0.734	79%	0.788	S	S	*	*			trans	-111	111.9	-164.9	36.1	-23.7	0	0	0	114
457	H	32.5	Very low	41.8	Very low	199 Å²	199	137.8 Å²	137.8	92%	0.921	77%	0.773	S	S	*	*			trans	-166.4	70.5	157.3	-107.9	-66.7	0	0	0	111.8
458	C	31.6	Very low	43.9	Very low	102 Å²	102	133.6 Å²	133.6	69%	0.689	75%	0.754	S	S	*	*			trans	-154.7	114.9	174.3	44.1	0	0	0	0	112.8	S460	C458-S460 PolarHBondContact O-N 3.47Å
459	F	33.7	Very low	46.4	Very low	205 Å²	205	136.6 Å²	136.6	90%	0.899	75%	0.752	S	S	*	*			trans	-75.5	75.6	161.2	-81.9	-81	0	0	0	109.2	H461	F459-H461 VanDerWaalsContact C-N 3.32Å; F459-H461 PolarHBondContact O-N 2.8Å
460	S	32.3	Very low	49.1	Very low	95 Å²	95	132.2 Å²	132.2	66%	0.664	73%	0.726	S	S	*	*			trans	-64	93.7	168.8	-68	0	0	0	0	109.1	C458 Q462	C458-S460 PolarHBondContact O-N 3.47Å; S460-Q462 PolarHBondContact O-N 3.06Å
461	H	39.6	Very low	51.8	Low	150 Å²	150	123 Å²	123	69%	0.694	68%	0.684	S	S	*	*			trans	-67.5	82	166.4	-100.9	-80.8	0	0	0	109	F459 N463	F459-H461 VanDerWaalsContact C-N 3.32Å; F459-H461 PolarHBondContact O-N 2.8Å; H461-N463 PolarHBondContact O-N 3.36Å
462	Q	40.4	Very low	54.7	Low	175 Å²	175	120.6 Å²	120.6	82%	0.818	66%	0.656	S	S	*	*			trans	-50.1	125.8	175.1	59.9	-170	9.6	0	0	111.1	S460 G464	S460-Q462 PolarHBondContact O-N 3.06Å; Q462-G464 PolarHBondContact O-N 3.29Å
463	N	33.3	Very low	57.3	Low	173 Å²	173	118.1 Å²	118.1	93%	0.925	62%	0.623	S	S	*	*	S	Bend	trans	-0.5	76	161.8	-166.9	82	0	0	0	116.6	H461	H461-N463 PolarHBondContact O-N 3.36Å
464	G	43.7	Very low	59.7	Low	55 Å²	55	109.1 Å²	109.1	57%	0.567	58%	0.576	S	S	*	*			trans	-133.7	122.3	158.3	0	0	0	0	0	105.4	Q462 R466	Q462-G464 PolarHBondContact O-N 3.29Å; G464-R466 PolarHBondContact O-N 3.49Å
465	E	51.7	Low	62.6	Low	177 Å²	177	107.9 Å²	107.9	83%	0.827	55%	0.55	S	S	*	*			trans	-50	112.2	-171.4	-170	178.4	176.2	0	0	110.5	V467	E465-V467 VanDerWaalsContact C-N 3.28Å; E465-V467 PolarHBondContact O-N 2.78Å
466	R	63.8	Low	65.5	Low	182 Å²	182	102.1 Å²	102.1	69%	0.687	51%	0.51	S	S	*	.			trans	-69.6	93.4	176.5	-85.1	-167.8	177.4	-168.7	0.1	107.3	G464 E468	G464-R466 PolarHBondContact O-N 3.49Å; R466-E468 PolarHBondContact O-N 3.42Å
467	V	79.1	Confident	68.3	Low	85 Å²	85	97 Å²	97	52%	0.515	48%	0.478	S	S	.	.			trans	-52.7	111.2	172.4	177.3	0	0	0	0	108.2	E465 R469	E465-V467 VanDerWaalsContact C-N 3.28Å; E465-V467 PolarHBondContact O-N 2.78Å; V467-R469 PolarHBondContact O-N 3.43Å
468	E	86	Confident	71.3	Confident	78 Å²	78	89.5 Å²	89.5	36%	0.364	45%	0.454	S	S	.	.			trans	-49.2	127.8	172.5	-66.4	178.3	169.7	0	0	109.3	R466 E525 L563 K619	R466-E468 PolarHBondContact O-N 3.42Å; E468-E525 HydrophobicContact CB-CG 4.05Å; E468-E525 HydrophobicContact CG-CB 4.17Å; E468-E525 HydrophobicContact CG-CG 4.22Å; E468-L563 HydrophobicContact CB-CD1 3.78Å; E468-K619 IonicContact OE2-NZ 3.25Å; E468-K619 PolarHBondContact OE2-NZ 2.85Å
469	R	92.6	Very high	74.3	Confident	160 Å²	160	84.9 Å²	84.9	60%	0.604	42%	0.422	S	S	*	.			trans	-101.6	-31.8	178.5	-60.6	-178.9	175.8	-172.2	-2.6	111.2	V467 E525 N562 L563	V467-R469 PolarHBondContact O-N 3.43Å; R469-E525 WeakPolarHBondContact CA-OE1 3.18Å; R469-E525 WeakPolarHBondContact CB-OE1 3.49Å; R469-E525 PolarHBondContact N-OE1 2.83Å; R469-N562 PolarHBondContact O-OD1 2.99Å; R469-L563 WeakPolarHBondContact O-CB 2.95Å; R469-L563 WeakPolarHBondContact O-CG 3.29Å; R469-L563 PolarHBondContact O-N 2.68Å
470	Y	96.1	Very high	77.2	Confident	49 Å²	49	75.2 Å²	75.2	19%	0.192	38%	0.38	C	S	.	.	B	Isolated β-bridge	trans	-120.1	149.9	-175	-59.9	-76.5	0	0	0	113.7	E525 V528 I532 P560 W561 N562	Y470-E525 PolarHBondContact N-OE1 3.33Å; Y470-E525 VanDerWaalsContact O-CG 3.25Å; Y470-E525 WeakPolarHBondContact O-CG 3.26Å; Y470-V528 HydrophobicContact CG-CG1 4.13Å; Y470-I532 HydrophobicContact CD1-CD1 3.77Å; Y470-I532 HydrophobicContact CD2-CD1 3.68Å; Y470-I532 HydrophobicContact CE1-CD1 3.62Å; Y470-I532 HydrophobicContact CE2-CD1 3.53Å; Y470-I532 HydrophobicContact CG-CD1 3.8Å; Y470-P560 HydrophobicContact CD1-CB 3.9Å; Y470-P560 HydrophobicContact CD1-CG 4.25Å; Y470-P560 HydrophobicContact CE1-CB 4.45Å; Y470-P560 HydrophobicContact CE1-CG 4.31Å; Y470-W561 CarbonylContact C-O 3.58Å; Y470-W561 WeakPolarHBondContact CA-O 3.42Å; Y470-N562 HydrophobicContact CD1-CB 4.28Å; Y470-N562 HydrophobicContact CE1-CB 4.11Å
471	S	96.5	Very high	80	Confident	1 Å²	1	75.4 Å²	75.4	1%	0.007	38%	0.379	C	S	.	.			trans	-64.5	136.4	164.3	174.4	0	0	0	0	110	K473 W561 L618 Y620	S471-K473 PolarHBondContact O-N 3.31Å; S471-K473 VanDerWaalsContact O-N 3.12Å; S471-K473 PolarHBondContact OG-N 2.75Å; S471-K473 VanDerWaalsContact OG-N 3.13Å; S471-K473 PolarHBondContact OG-O 3Å; S471-W561 PolarHBondContact N-O 3.25Å; S471-L618 WeakPolarHBondContact CB-O 3.35Å; S471-L618 PolarHBondContact OG-O 3.3Å; S471-Y620 WeakPolarHBondContact OG-CB 3.49Å
472	R	96.3	Very high	82.5	Confident	70 Å²	70	69.8 Å²	69.8	26%	0.264	35%	0.354	S	S	.	.	S	Bend	trans	-62.1	-12.9	171	-65.4	-171.2	-68.1	162.9	3.3	113.9	L521 F522 Q523 E617 L618	R472-L521 WeakPolarHBondContact O-CA 3.35Å; R472-F522 PolarHBondContact O-N 2.81Å; R472-Q523 WeakPolarHBondContact CD-O 3.45Å; R472-Q523 PolarHBondContact NH1-O 2.93Å; R472-E617 PolarHBondContact NH2-O 3.48Å; R472-L618 HydrophobicContact CB-CD2 4.49Å
473	K	97	Very high	85.1	Confident	27 Å²	27	61.5 Å²	61.5	12%	0.117	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	120.4	172.9	-170.9	159.2	-169.4	150.1	0	110.6	S471 D501 F519 L520 L521 L618 Y620	S471-K473 PolarHBondContact O-N 3.31Å; S471-K473 VanDerWaalsContact O-N 3.12Å; S471-K473 PolarHBondContact OG-N 2.75Å; S471-K473 VanDerWaalsContact OG-N 3.13Å; S471-K473 PolarHBondContact OG-O 3Å; K473-D501 IonicContact NZ-OD2 2.73Å; K473-D501 PolarHBondContact NZ-OD2 3.36Å; K473-F519 HydrophobicContact CD-CB 4.44Å; K473-F519 HydrophobicContact CD-CD1 4.5Å; K473-F519 VanDerWaalsContact CE-CG 3.41Å; K473-F519 HydrophobicContact CG-CB 4.23Å; K473-F519 HydrophobicContact CG-CD1 4.27Å; K473-L520 CarbonylContact C-O 3.6Å; K473-L520 WeakPolarHBondContact CA-O 3.48Å; K473-L521 HydrophobicContact CD-CD1 3.97Å; K473-L521 HydrophobicContact CD-CG 4.11Å; K473-L521 HydrophobicContact CG-CD1 4.08Å; K473-L521 HydrophobicContact CG-CG 4.22Å; K473-L618 HydrophobicContact CB-CB 4.34Å; K473-L618 HydrophobicContact CB-CD1 4.31Å; K473-L618 HydrophobicContact CD-CD1 3.97Å; K473-Y620 HydrophobicContact CB-CD2 3.79Å; K473-Y620 HydrophobicContact CB-CE2 4.49Å; K473-Y620 HydrophobicContact CB-CG 3.95Å; K473-Y620 HydrophobicContact CD-CD1 4.4Å; K473-Y620 HydrophobicContact CD-CG 4.35Å; K473-Y620 HydrophobicContact CG-CD2 4.11Å; K473-Y620 HydrophobicContact CG-CE2 4.43Å; K473-Y620 HydrophobicContact CG-CG 4.16Å; K473-Y620 WeakPolarHBondContact O-CD2 3.32Å; K473-Y620 VanDerWaalsContact O-CE2 3.25Å; K473-Y620 WeakPolarHBondContact O-CE2 3.27Å
474	V	97.4	Very high	87.8	Confident	0 Å²	0	55.4 Å²	55.4	0%	0	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	138.4	-179	179.3	0	0	0	0	108.9	F519 L520 F522 V528 L531 I558 P560	V474-F519 CarbonylContact O-C 3.47Å; V474-F519 WeakPolarHBondContact O-CA 3.49Å; V474-L520 HydrophobicContact CB-CB 4.42Å; V474-L520 PolarHBondContact N-O 2.93Å; V474-L520 PolarHBondContact O-N 3.09Å; V474-F522 HydrophobicContact CG2-CD2 4.42Å; V474-F522 HydrophobicContact CG2-CE2 4.39Å; V474-V528 HydrophobicContact CG2-CB 4.41Å; V474-V528 HydrophobicContact CG2-CG1 3.66Å; V474-V528 HydrophobicContact CG2-CG2 3.9Å; V474-L531 HydrophobicContact CG1-CD2 4.21Å; V474-I558 HydrophobicContact CG1-CG2 3.73Å; V474-P560 HydrophobicContact CG2-CB 4.43Å
475	F	97.1	Very high	90.2	Very high	47 Å²	47	55.6 Å²	55.6	21%	0.206	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	139	170.1	168.2	-84.1	0	0	0	110.1	Y517 F519 R559	F475-Y517 HydrophobicContact CD2-CD2 4.35Å; F475-Y517 AromaticContact CE2-CD2 3.66Å; F475-Y517 HydrophobicContact CE2-CD2 3.66Å; F475-Y517 HydrophobicContact CE2-CG 4Å; F475-Y517 HydrophobicContact CZ-CD2 4.5Å; F475-Y517 HydrophobicContact CZ-CG 4.42Å; F475-F519 HydrophobicContact CB-CD1 4.12Å; F475-F519 HydrophobicContact CB-CE1 4.05Å; F475-F519 HydrophobicContact CD2-CD1 4.4Å; F475-F519 AromaticContact CD2-CE1 3.84Å; F475-F519 HydrophobicContact CD2-CE1 3.84Å; F475-F519 HydrophobicContact CD2-CZ 4.14Å; F475-F519 HydrophobicContact CG-CE1 4.46Å; F475-R559 HydrophobicContact CB-CB 4.2Å; F475-R559 HydrophobicContact CD1-CB 3.96Å; F475-R559 HydrophobicContact CD1-CG 4.03Å; F475-R559 PolarHBondContact N-O 3.46Å; F475-R559 PolarHBondContact O-N 2.92Å
476	V	97.1	Very high	92.2	Very high	1 Å²	1	53.1 Å²	53.1	1%	0.006	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	124.9	173	-179.6	0	0	0	0	108.9	L479 F492 Y517 A518 L520 V556 Q557 I558	V476-L479 HydrophobicContact CG1-CD2 3.74Å; V476-L479 HydrophobicContact CG1-CG 4.12Å; V476-F492 HydrophobicContact CG1-CZ 4.21Å; V476-F492 HydrophobicContact CG2-CZ 4.2Å; V476-Y517 CarbonylContact O-C 3.59Å; V476-Y517 WeakPolarHBondContact O-CA 3.18Å; V476-Y517 WeakPolarHBondContact O-CB 3.44Å; V476-A518 PolarHBondContact N-O 3.32Å; V476-A518 PolarHBondContact O-N 2.69Å; V476-L520 HydrophobicContact CG2-CD1 3.74Å; V476-L520 HydrophobicContact CG2-CD2 4.25Å; V476-L520 HydrophobicContact CG2-CG 3.71Å; V476-V556 HydrophobicContact CG1-CB 4.16Å; V476-V556 HydrophobicContact CG1-CG2 3.69Å; V476-Q557 WeakPolarHBondContact CA-O 3.38Å; V476-I558 HydrophobicContact CG1-CD1 4.06Å; V476-I558 HydrophobicContact CG2-CD1 3.82Å
477	G	95.8	Very high	93.6	Very high	7 Å²	7	47 Å²	47	7%	0.072	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	156.3	-177.8	0	0	0	0	0	113	V556 Q557	G477-V556 CarbonylContact O-C 3.54Å; G477-Q557 PolarHBondContact N-O 3.2Å; G477-Q557 PolarHBondContact O-N 3.02Å
478	G	95.5	Very high	94.4	Very high	40 Å²	40	43 Å²	43	41%	0.412	22%	0.217	S	C	.	.	S	Bend	trans	80	16.7	-178.1	0	0	0	0	0	114.1	G516 K554	G478-G516 PolarHBondContact N-O 2.58Å; G478-K554 WeakPolarHBondContact O-CD 3.34Å; G478-K554 WeakPolarHBondContact O-CE 3.43Å; G478-K554 PolarHBondContact O-NZ 3.24Å
479	L	95.8	Very high	94.9	Very high	5 Å²	5	40.3 Å²	40.3	3%	0.026	21%	0.205	C	C	.	.			trans	-49.8	152.1	174.6	-67.9	168.6	0	0	0	111.8	V476 I483 I488 P513 G516 A518 K554 V556	V476-L479 HydrophobicContact CG1-CD2 3.74Å; V476-L479 HydrophobicContact CG1-CG 4.12Å; L479-I483 HydrophobicContact CB-CG2 4.09Å; L479-I483 HydrophobicContact CD2-CG2 4.45Å; L479-I488 HydrophobicContact CD1-CD1 3.94Å; L479-I488 HydrophobicContact CD2-CD1 4.41Å; L479-I488 HydrophobicContact CD2-CG1 4.29Å; L479-P513 HydrophobicContact CD1-CB 4.24Å; L479-P513 HydrophobicContact CD1-CG 4.06Å; L479-G516 PolarHBondContact N-O 2.94Å; L479-A518 HydrophobicContact CD1-CB 3.79Å; L479-K554 PolarHBondContact O-NZ 3.49Å; L479-V556 HydrophobicContact CD2-CG1 4.23Å
480	P	94.5	Very high	95	Very high	2 Å²	2	36 Å²	36	1%	0.013	20%	0.204	C	C	.	.			trans	-54.3	147.1	166.2	-21.8	32.1	0	0	0	111.3	D482 I483 S548 I551 K554	P480-D482 WeakPolarHBondContact CB-OD1 3.47Å; P480-D482 PolarHBondContact O-N 3.09Å; P480-I483 HydrophobicContact CB-CB 4.13Å; P480-I483 HydrophobicContact CB-CG2 4.44Å; P480-I483 HydrophobicContact CG-CB 4.3Å; P480-I483 HydrophobicContact CG-CD1 4.45Å; P480-I483 WeakPolarHBondContact O-CG2 3.43Å; P480-S548 VanDerWaalsContact CB-OG 3.26Å; P480-S548 WeakPolarHBondContact CB-OG 3.45Å; P480-I551 HydrophobicContact CB-CB 4.44Å; P480-I551 HydrophobicContact CB-CD1 4.35Å; P480-K554 HydrophobicContact CB-CD 4.34Å; P480-K554 HydrophobicContact CG-CB 4.25Å; P480-K554 HydrophobicContact CG-CD 3.86Å
481	P	91.4	Very high	94.9	Very high	100 Å²	100	35 Å²	35	65%	0.649	21%	0.205	S	C	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-11.9	-178.9	33.4	-36.2	0	0	0	113.1	I551	P481-I551 HydrophobicContact CG-CD1 4.46Å
482	D	91.8	Very high	94.9	Very high	32 Å²	32	35 Å²	35	17%	0.171	20%	0.204	C	C	.	.	T	Hydrogen-bonded Turn	trans	-115.4	9.1	-173.2	66.1	-44.3	0	0	0	113.2	P480 F512 S548 T550	P480-D482 WeakPolarHBondContact CB-OD1 3.47Å; P480-D482 PolarHBondContact O-N 3.09Å; D482-F512 WeakPolarHBondContact O-CE1 3.47Å; D482-S548 VanDerWaalsContact OD1-CB 3.32Å; D482-S548 WeakPolarHBondContact OD1-CB 3.31Å; D482-S548 PolarHBondContact OD1-OG 2.91Å; D482-S548 WeakPolarHBondContact OD2-CB 3.41Å; D482-S548 PolarHBondContact OD2-OG 2.88Å; D482-T550 VanDerWaalsContact OD2-CB 3.29Å; D482-T550 WeakPolarHBondContact OD2-CB 3.46Å; D482-T550 WeakPolarHBondContact OD2-CG2 3.06Å; D482-T550 PolarHBondContact OD2-N 3.32Å; D482-T550 PolarHBondContact OD2-OG1 3.28Å
483	I	93.6	Very high	94.9	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	22%	0.22	C	C	.	.			trans	-87.5	136.2	178.1	-156.8	172	0	0	0	111.6	L479 P480 E487 I488 F512 P513 V546	L479-I483 HydrophobicContact CB-CG2 4.09Å; L479-I483 HydrophobicContact CD2-CG2 4.45Å; P480-I483 HydrophobicContact CB-CB 4.13Å; P480-I483 HydrophobicContact CB-CG2 4.44Å; P480-I483 HydrophobicContact CG-CB 4.3Å; P480-I483 HydrophobicContact CG-CD1 4.45Å; P480-I483 WeakPolarHBondContact O-CG2 3.43Å; I483-E487 WeakPolarHBondContact CA-OE2 3.36Å; I483-E487 HydrophobicContact CD1-CB 4.13Å; I483-E487 HydrophobicContact CG1-CB 3.56Å; I483-E487 WeakPolarHBondContact CG1-OE2 3.45Å; I483-I488 HydrophobicContact CD1-CG1 3.86Å; I483-I488 HydrophobicContact CG1-CG1 4.05Å; I483-I488 HydrophobicContact CG2-CD1 4.03Å; I483-I488 HydrophobicContact CG2-CG1 3.97Å; I483-F512 WeakPolarHBondContact O-CD1 3.26Å; I483-P513 VanDerWaalsContact O-CD 3.31Å; I483-P513 WeakPolarHBondContact O-CD 3.02Å; I483-V546 HydrophobicContact CD1-CG1 3.4Å
484	D	91.8	Very high	94.8	Very high	45 Å²	45	45.6 Å²	45.6	24%	0.241	24%	0.244	C	C	.	.			trans	-98.6	-176	176.6	77.3	21.6	0	0	0	114.2	D486 E487 I488 F512	D484-D486 WeakPolarHBondContact OD1-CA 3.25Å; D484-D486 PolarHBondContact OD1-N 3.01Å; D484-E487 PolarHBondContact N-OE2 3.17Å; D484-E487 WeakPolarHBondContact OD1-CG 3.45Å; D484-E487 PolarHBondContact OD1-N 2.77Å; D484-I488 WeakPolarHBondContact O-CD1 3.39Å; D484-I488 WeakPolarHBondContact O-CG1 3.47Å; D484-I488 PolarHBondContact O-N 3.07Å; D484-F512 HydrophobicContact CB-CE1 4.46Å
485	E	93.1	Very high	94.8	Very high	60 Å²	60	47 Å²	47	28%	0.28	25%	0.249	S	C	.	.	H	α-helix	trans	-65.3	-39.8	177.6	172.8	162	-157.1	0	0	113.7	T489 V500 W502 K505	E485-T489 WeakPolarHBondContact O-CB 3.26Å; E485-T489 PolarHBondContact O-N 3.44Å; E485-T489 PolarHBondContact O-OG1 3.12Å; E485-V500 HydrophobicContact CG-CB 4.25Å; E485-W502 HydrophobicContact CB-CH2 4.01Å; E485-W502 HydrophobicContact CB-CZ3 4.29Å; E485-K505 IonicContact OE1-NZ 3.84Å; E485-K505 PolarHBondContact OE1-NZ 2.91Å; E485-K505 WeakPolarHBondContact OE2-CE 3.4Å; E485-K505 IonicContact OE2-NZ 3.54Å; E485-K505 PolarHBondContact OE2-NZ 2.84Å
486	D	93.4	Very high	94.7	Very high	124 Å²	124	45.5 Å²	45.5	66%	0.663	25%	0.248	S	C	*	.	H	α-helix	trans	-72.1	-34.7	-174.9	-76.1	-40.1	0	0	0	110.5	D484 T489 A490	D484-D486 WeakPolarHBondContact OD1-CA 3.25Å; D484-D486 PolarHBondContact OD1-N 3.01Å; D486-T489 PolarHBondContact O-N 3.09Å; D486-A490 VanDerWaalsContact O-CB 3.26Å; D486-A490 WeakPolarHBondContact O-CB 3.45Å; D486-A490 PolarHBondContact O-N 3.29Å
487	E	93.9	Very high	94.7	Very high	55 Å²	55	47.6 Å²	47.6	26%	0.257	26%	0.262	S	S	.	.	H	α-helix	trans	-72.8	-41.4	176.7	-66.4	168.8	155.9	0	0	112.6	I483 D484 S491 P549	I483-E487 WeakPolarHBondContact CA-OE2 3.36Å; I483-E487 HydrophobicContact CD1-CB 4.13Å; I483-E487 HydrophobicContact CG1-CB 3.56Å; I483-E487 WeakPolarHBondContact CG1-OE2 3.45Å; D484-E487 PolarHBondContact N-OE2 3.17Å; D484-E487 WeakPolarHBondContact OD1-CG 3.45Å; D484-E487 PolarHBondContact OD1-N 2.77Å; E487-S491 WeakPolarHBondContact O-CB 3.25Å; E487-S491 PolarHBondContact O-N 2.92Å; E487-S491 VanDerWaalsContact O-N 3.07Å; E487-S491 PolarHBondContact O-OG 3.11Å; E487-P549 VanDerWaalsContact OE1-CD 3.25Å; E487-P549 WeakPolarHBondContact OE1-CD 3.25Å; E487-P549 WeakPolarHBondContact OE1-CG 3.21Å; E487-P549 WeakPolarHBondContact OE2-CD 3.38Å
488	I	95.3	Very high	94.8	Very high	1 Å²	1	48 Å²	48	1%	0.005	26%	0.262	C	S	.	.	H	α-helix	trans	-60.4	-49.3	167.9	-65.6	165.3	0	0	0	109.2	L479 I483 D484 A490 S491 F492 V500 P513 L520	L479-I488 HydrophobicContact CD1-CD1 3.94Å; L479-I488 HydrophobicContact CD2-CD1 4.41Å; L479-I488 HydrophobicContact CD2-CG1 4.29Å; I483-I488 HydrophobicContact CD1-CG1 3.86Å; I483-I488 HydrophobicContact CG1-CG1 4.05Å; I483-I488 HydrophobicContact CG2-CD1 4.03Å; I483-I488 HydrophobicContact CG2-CG1 3.97Å; D484-I488 WeakPolarHBondContact O-CD1 3.39Å; D484-I488 WeakPolarHBondContact O-CG1 3.47Å; D484-I488 PolarHBondContact O-N 3.07Å; I488-A490 PolarHBondContact O-N 2.92Å; I488-S491 WeakPolarHBondContact O-CB 3.38Å; I488-S491 PolarHBondContact O-N 3.38Å; I488-F492 HydrophobicContact CG2-CD2 3.72Å; I488-F492 HydrophobicContact CG2-CE2 3.98Å; I488-F492 VanDerWaalsContact O-CD2 3.26Å; I488-F492 WeakPolarHBondContact O-CD2 3.28Å; I488-F492 PolarHBondContact O-N 3.21Å; I488-F492 VanDerWaalsContact O-N 3.09Å; I488-V500 HydrophobicContact CB-CG1 4.45Å; I488-V500 HydrophobicContact CB-CG2 4.18Å; I488-V500 HydrophobicContact CD1-CG1 4.17Å; I488-V500 HydrophobicContact CG2-CB 4.43Å; I488-V500 HydrophobicContact CG2-CG1 3.88Å; I488-V500 HydrophobicContact CG2-CG2 3.6Å; I488-P513 HydrophobicContact CD1-CG 3.76Å; I488-L520 HydrophobicContact CG2-CD2 3.83Å
489	T	95.7	Very high	94.7	Very high	20 Å²	20	49.5 Å²	49.5	12%	0.123	26%	0.26	C	S	.	.	H	α-helix	trans	-59.1	-48.6	-178.4	-62.5	0	0	0	0	110.7	E485 D486 S491 F492 R493 V500	E485-T489 WeakPolarHBondContact O-CB 3.26Å; E485-T489 PolarHBondContact O-N 3.44Å; E485-T489 PolarHBondContact O-OG1 3.12Å; D486-T489 PolarHBondContact O-N 3.09Å; T489-S491 VanDerWaalsContact C-N 3.31Å; T489-S491 PolarHBondContact O-N 3Å; T489-F492 PolarHBondContact O-N 3.33Å; T489-R493 WeakPolarHBondContact O-CB 3.45Å; T489-R493 PolarHBondContact O-N 2.96Å; T489-V500 WeakPolarHBondContact OG1-CG2 3.47Å
490	A	95	Very high	94.7	Very high	71 Å²	71	49.3 Å²	49.3	59%	0.587	26%	0.259	S	S	*	.	H	α-helix	trans	-58	-41.5	176.9	0	0	0	0	0	112.4	D486 I488 F492	D486-A490 VanDerWaalsContact O-CB 3.26Å; D486-A490 WeakPolarHBondContact O-CB 3.45Å; D486-A490 PolarHBondContact O-N 3.29Å; I488-A490 PolarHBondContact O-N 2.92Å; A490-F492 PolarHBondContact O-N 2.83Å
491	S	95	Very high	94.6	Very high	28 Å²	28	51.7 Å²	51.7	20%	0.196	27%	0.271	C	S	.	.	H	α-helix	trans	-63.8	-39.4	179.6	-60.9	0	0	0	0	113.2	E487 I488 T489	E487-S491 WeakPolarHBondContact O-CB 3.25Å; E487-S491 PolarHBondContact O-N 2.92Å; E487-S491 VanDerWaalsContact O-N 3.07Å; E487-S491 PolarHBondContact O-OG 3.11Å; I488-S491 WeakPolarHBondContact O-CB 3.38Å; I488-S491 PolarHBondContact O-N 3.38Å; T489-S491 VanDerWaalsContact C-N 3.31Å; T489-S491 PolarHBondContact O-N 3Å
492	F	96.7	Very high	94.6	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-98	-19.4	-176.1	-68.5	-73.8	0	0	0	114.7	V476 I488 T489 A490 R494 F495 L498 L520 L531 L544 V546 V556 I558	V476-F492 HydrophobicContact CG1-CZ 4.21Å; V476-F492 HydrophobicContact CG2-CZ 4.2Å; I488-F492 HydrophobicContact CG2-CD2 3.72Å; I488-F492 HydrophobicContact CG2-CE2 3.98Å; I488-F492 VanDerWaalsContact O-CD2 3.26Å; I488-F492 WeakPolarHBondContact O-CD2 3.28Å; I488-F492 PolarHBondContact O-N 3.21Å; I488-F492 VanDerWaalsContact O-N 3.09Å; T489-F492 PolarHBondContact O-N 3.33Å; A490-F492 PolarHBondContact O-N 2.83Å; F492-R494 PolarHBondContact O-N 2.96Å; F492-F495 HydrophobicContact CD1-CD2 4.26Å; F492-F495 HydrophobicContact CD1-CE2 4.14Å; F492-F495 VanDerWaalsContact O-CD2 3.28Å; F492-F495 WeakPolarHBondContact O-CD2 3.42Å; F492-F495 PolarHBondContact O-N 2.82Å; F492-L498 HydrophobicContact CB-CD1 3.81Å; F492-L498 HydrophobicContact CB-CD2 4.04Å; F492-L520 HydrophobicContact CB-CD1 4Å; F492-L520 HydrophobicContact CD1-CD1 3.5Å; F492-L520 VanDerWaalsContact CD1-CD1 3.5Å; F492-L520 HydrophobicContact CD2-CD1 3.74Å; F492-L520 HydrophobicContact CD2-CD2 3.9Å; F492-L520 HydrophobicContact CD2-CG 4.48Å; F492-L520 HydrophobicContact CE1-CD1 3.83Å; F492-L520 HydrophobicContact CE2-CD1 4.08Å; F492-L520 HydrophobicContact CE2-CD2 4.3Å; F492-L520 HydrophobicContact CG-CD1 3.46Å; F492-L520 VanDerWaalsContact CG-CD1 3.46Å; F492-L520 HydrophobicContact CG-CD2 4.33Å; F492-L520 HydrophobicContact CZ-CD1 4.12Å; F492-L531 HydrophobicContact CD1-CD1 3.87Å; F492-L531 HydrophobicContact CD1-CD2 4.46Å; F492-L531 HydrophobicContact CE1-CD1 3.82Å; F492-L544 HydrophobicContact CD1-CD2 4Å; F492-L544 HydrophobicContact CE1-CD2 3.43Å; F492-L544 VanDerWaalsContact CE1-CD2 3.43Å; F492-L544 HydrophobicContact CZ-CD2 4.16Å; F492-V546 HydrophobicContact CE2-CG2 4.12Å; F492-V546 HydrophobicContact CZ-CG2 3.91Å; F492-V556 HydrophobicContact CZ-CG2 4.27Å; F492-I558 HydrophobicContact CE1-CD1 3.71Å; F492-I558 HydrophobicContact CZ-CD1 3.76Å
493	R	96	Very high	94.4	Very high	157 Å²	157	47.9 Å²	47.9	59%	0.592	25%	0.248	S	C	*	.	G	3₁₀ helix	trans	-60.1	-20.7	-178.4	-175.8	178.3	-167	101.3	1.8	113.8	T489 F495 G496 L498	T489-R493 WeakPolarHBondContact O-CB 3.45Å; T489-R493 PolarHBondContact O-N 2.96Å; R493-F495 PolarHBondContact O-N 3.3Å; R493-G496 WeakPolarHBondContact CA-O 3.09Å; R493-G496 PolarHBondContact O-N 2.87Å; R493-G496 VanDerWaalsContact O-N 3.1Å; R493-L498 HydrophobicContact CB-CD2 4.11Å
494	R	95.5	Very high	93.7	Very high	163 Å²	163	53.7 Å²	53.7	62%	0.615	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-60.2	-21.2	173.1	70.6	-172.3	-174.3	-162.5	1.1	114.2	F492	F492-R494 PolarHBondContact O-N 2.96Å
495	F	96.8	Very high	93.2	Very high	28 Å²	28	54.2 Å²	54.2	12%	0.123	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-92.3	-15.4	176.8	-53.5	-62.7	0	0	0	113.2	F492 R493 F522 S527 A530 L531 A534 L544	F492-F495 HydrophobicContact CD1-CD2 4.26Å; F492-F495 HydrophobicContact CD1-CE2 4.14Å; F492-F495 VanDerWaalsContact O-CD2 3.28Å; F492-F495 WeakPolarHBondContact O-CD2 3.42Å; F492-F495 PolarHBondContact O-N 2.82Å; R493-F495 PolarHBondContact O-N 3.3Å; F495-F522 HydrophobicContact CB-CE1 4.2Å; F495-S527 WeakPolarHBondContact O-CA 3.35Å; F495-S527 WeakPolarHBondContact O-CB 3.47Å; F495-S527 PolarHBondContact O-OG 3.24Å; F495-A530 HydrophobicContact CD1-CB 4.34Å; F495-A530 VanDerWaalsContact CD1-O 3.31Å; F495-A530 WeakPolarHBondContact CD1-O 3.49Å; F495-A530 WeakPolarHBondContact CE1-O 3.43Å; F495-L531 HydrophobicContact CB-CB 4.36Å; F495-L531 HydrophobicContact CD1-CB 4.44Å; F495-L531 HydrophobicContact CD2-CB 3.98Å; F495-L531 HydrophobicContact CD2-CD1 3.84Å; F495-L531 HydrophobicContact CD2-CG 4.45Å; F495-L531 HydrophobicContact CE2-CB 4.36Å; F495-L531 HydrophobicContact CE2-CD1 3.51Å; F495-L531 HydrophobicContact CG-CB 4.01Å; F495-L531 HydrophobicContact CZ-CD1 4.07Å; F495-A534 HydrophobicContact CE1-CB 3.47Å; F495-A534 VanDerWaalsContact CE1-CB 3.47Å; F495-A534 HydrophobicContact CZ-CB 3.79Å; F495-L544 HydrophobicContact CE2-CD2 3.87Å; F495-L544 HydrophobicContact CZ-CD1 4.41Å; F495-L544 HydrophobicContact CZ-CD2 4.18Å
496	G	95.7	Very high	92.4	Very high	17 Å²	17	56.5 Å²	56.5	18%	0.175	30%	0.304	C	S	.	.	S	Bend	trans	145.1	179.3	179.9	0	0	0	0	0	113	R493 L498 S527	R493-G496 WeakPolarHBondContact CA-O 3.09Å; R493-G496 PolarHBondContact O-N 2.87Å; R493-G496 VanDerWaalsContact O-N 3.1Å; G496-L498 WeakPolarHBondContact O-CD2 3.22Å; G496-S527 WeakPolarHBondContact CA-OG 3.46Å
497	P	96.6	Very high	91.6	Very high	45 Å²	45	57.9 Å²	57.9	29%	0.292	31%	0.307	S	S	.	.			trans	-69.9	131	179	29.5	-34	0	0	0	111.4	F522 Q523	P497-F522 WeakPolarHBondContact O-CA 3.37Å; P497-Q523 HydrophobicContact CB-CG 4.12Å; P497-Q523 HydrophobicContact CG-CB 4.02Å; P497-Q523 HydrophobicContact CG-CG 3.93Å; P497-Q523 PolarHBondContact O-N 3.13Å
498	L	96.7	Very high	90.5	Very high	15 Å²	15	57.4 Å²	57.4	8%	0.079	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	163.7	178	72.1	150.2	0	0	0	112.7	F492 R493 G496 V500 L520 L521 F522	F492-L498 HydrophobicContact CB-CD1 3.81Å; F492-L498 HydrophobicContact CB-CD2 4.04Å; R493-L498 HydrophobicContact CB-CD2 4.11Å; G496-L498 WeakPolarHBondContact O-CD2 3.22Å; L498-V500 HydrophobicContact CD1-CG2 4.1Å; L498-L520 HydrophobicContact CD1-CB 3.91Å; L498-L520 HydrophobicContact CD1-CD1 4.27Å; L498-L520 HydrophobicContact CD1-CD2 3.69Å; L498-L520 HydrophobicContact CD1-CG 4.14Å; L498-L521 CarbonylContact C-O 3.56Å; L498-L521 WeakPolarHBondContact CA-O 3.45Å; L498-F522 HydrophobicContact CB-CD1 3.79Å; L498-F522 HydrophobicContact CB-CE1 3.94Å; L498-F522 HydrophobicContact CB-CG 4.2Å; L498-F522 HydrophobicContact CB-CZ 4.46Å; L498-F522 HydrophobicContact CD1-CZ 4.48Å; L498-F522 HydrophobicContact CD2-CE1 4.15Å; L498-F522 HydrophobicContact CG-CE1 4.44Å
499	I	95.2	Very high	89.3	Confident	72 Å²	72	67.4 Å²	67.4	37%	0.369	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.3	143.4	160.2	-68	-179.4	0	0	0	108.7	L521 W728	I499-L521 PolarHBondContact N-O 3.48Å; I499-L521 PolarHBondContact O-N 3.06Å; I499-W728 HydrophobicContact CD1-CE3 4.31Å; I499-W728 HydrophobicContact CD1-CH2 3.53Å; I499-W728 HydrophobicContact CD1-CZ2 4.46Å; I499-W728 HydrophobicContact CD1-CZ3 3.44Å; I499-W728 VanDerWaalsContact CD1-CZ3 3.44Å; I499-W728 HydrophobicContact CG1-CH2 4.03Å; I499-W728 HydrophobicContact CG1-CZ3 3.93Å
500	V	95	Very high	88.5	Confident	0 Å²	0	68.7 Å²	68.7	0%	0	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	132.2	171.6	-171.1	0	0	0	0	109.7	E485 I488 T489 L498 W502 K505 A518 F519 L520	E485-V500 HydrophobicContact CG-CB 4.25Å; I488-V500 HydrophobicContact CB-CG1 4.45Å; I488-V500 HydrophobicContact CB-CG2 4.18Å; I488-V500 HydrophobicContact CD1-CG1 4.17Å; I488-V500 HydrophobicContact CG2-CB 4.43Å; I488-V500 HydrophobicContact CG2-CG1 3.88Å; I488-V500 HydrophobicContact CG2-CG2 3.6Å; T489-V500 WeakPolarHBondContact OG1-CG2 3.47Å; L498-V500 HydrophobicContact CD1-CG2 4.1Å; V500-W502 HydrophobicContact CB-CZ3 4.5Å; V500-W502 HydrophobicContact CG1-CE3 3.95Å; V500-W502 HydrophobicContact CG1-CZ3 3.77Å; V500-K505 PolarHBondContact O-NZ 2.94Å; V500-A518 HydrophobicContact CG1-CB 4.02Å; V500-F519 WeakPolarHBondContact CA-O 3.18Å; V500-L520 HydrophobicContact CG2-CD2 4.2Å
501	D	92.9	Very high	87.9	Confident	53 Å²	53	73.8 Å²	73.8	28%	0.283	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.6	145.2	-175.7	170.9	44.3	0	0	0	111.2	K473 F519 L521	K473-D501 IonicContact NZ-OD2 2.73Å; K473-D501 PolarHBondContact NZ-OD2 3.36Å; D501-F519 PolarHBondContact N-O 3.15Å; D501-F519 PolarHBondContact O-N 2.89Å; D501-L521 HydrophobicContact CB-CD1 3.73Å
502	W	91.9	Very high	87.5	Confident	4 Å²	4	77.1 Å²	77.1	2%	0.015	38%	0.379	C	S	.	.			trans	-151	155	170.9	57.1	83.8	0	0	0	111.4	E485 V500 H504 K505 Y511 P513 A518	E485-W502 HydrophobicContact CB-CH2 4.01Å; E485-W502 HydrophobicContact CB-CZ3 4.29Å; V500-W502 HydrophobicContact CB-CZ3 4.5Å; V500-W502 HydrophobicContact CG1-CE3 3.95Å; V500-W502 HydrophobicContact CG1-CZ3 3.77Å; W502-H504 PolarHBondContact O-N 2.84Å; W502-K505 HydrophobicContact CD2-CB 4.17Å; W502-K505 HydrophobicContact CD2-CD 4.1Å; W502-K505 HydrophobicContact CD2-CG 4.13Å; W502-K505 HydrophobicContact CE3-CD 4.18Å; W502-K505 HydrophobicContact CG-CB 4.08Å; W502-K505 HydrophobicContact CH2-CD 4.35Å; W502-K505 HydrophobicContact CZ2-CD 4.24Å; W502-K505 HydrophobicContact CZ2-CG 3.94Å; W502-K505 HydrophobicContact CZ3-CD 4.3Å; W502-K505 VanDerWaalsContact O-CB 3.25Å; W502-K505 WeakPolarHBondContact O-CB 3.49Å; W502-K505 PolarHBondContact O-N 2.68Å; W502-Y511 WeakPolarHBondContact CH2-O 3.38Å; W502-Y511 WeakPolarHBondContact CZ2-O 3.47Å; W502-P513 HydrophobicContact CD2-CB 4.11Å; W502-P513 HydrophobicContact CD2-CG 4.21Å; W502-P513 HydrophobicContact CE3-CB 4.2Å; W502-P513 HydrophobicContact CE3-CG 3.9Å; W502-P513 HydrophobicContact CG-CB 4.35Å; W502-P513 HydrophobicContact CH2-CG 4.24Å; W502-P513 HydrophobicContact CZ3-CG 3.92Å; W502-A518 HydrophobicContact CE3-CB 4.3Å
503	P	86	Confident	87	Confident	47 Å²	47	77.7 Å²	77.7	31%	0.305	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	132.6	179.9	-28	38.2	0	0	0	112.2	K505 Y517	P503-K505 VanDerWaalsContact C-N 3.28Å; P503-K505 PolarHBondContact O-N 2.83Å; P503-Y517 HydrophobicContact CG-CE2 4.25Å; P503-Y517 WeakPolarHBondContact CG-OH 3.36Å
504	H	80.3	Confident	86.4	Confident	123 Å²	123	72.6 Å²	72.6	57%	0.569	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.1	16.6	-177.2	-47.1	-78.5	0	0	0	115.9	W502 A506 E507 S508	W502-H504 PolarHBondContact O-N 2.84Å; H504-A506 VanDerWaalsContact C-N 3.3Å; H504-A506 PolarHBondContact O-N 2.62Å; H504-E507 HydrophobicContact CB-CB 4.42Å; H504-E507 IonicContact CE1-OE2 2.64Å; H504-E507 IonicContact CG-OE2 2.84Å; H504-E507 IonicContact ND1-OE2 3.81Å; H504-E507 PolarHBondContact ND1-OE2 3.19Å; H504-E507 PolarHBondContact O-N 3.12Å; H504-E507 VanDerWaalsContact O-N 3.11Å; H504-S508 WeakPolarHBondContact O-CB 3.19Å; H504-S508 PolarHBondContact O-N 2.95Å; H504-S508 PolarHBondContact O-OG 2.89Å
505	K	81.4	Confident	85.9	Confident	55 Å²	55	73.1 Å²	73.1	24%	0.239	38%	0.377	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53.3	-41.6	175.9	-176.2	-177.8	179.3	-159.9	0	113.9	E485 V500 W502 P503	E485-K505 IonicContact OE1-NZ 3.84Å; E485-K505 PolarHBondContact OE1-NZ 2.91Å; E485-K505 WeakPolarHBondContact OE2-CE 3.4Å; E485-K505 IonicContact OE2-NZ 3.54Å; E485-K505 PolarHBondContact OE2-NZ 2.84Å; V500-K505 PolarHBondContact O-NZ 2.94Å; W502-K505 HydrophobicContact CD2-CB 4.17Å; W502-K505 HydrophobicContact CD2-CD 4.1Å; W502-K505 HydrophobicContact CD2-CG 4.13Å; W502-K505 HydrophobicContact CE3-CD 4.18Å; W502-K505 HydrophobicContact CG-CB 4.08Å; W502-K505 HydrophobicContact CH2-CD 4.35Å; W502-K505 HydrophobicContact CZ2-CD 4.24Å; W502-K505 HydrophobicContact CZ2-CG 3.94Å; W502-K505 HydrophobicContact CZ3-CD 4.3Å; W502-K505 VanDerWaalsContact O-CB 3.25Å; W502-K505 WeakPolarHBondContact O-CB 3.49Å; W502-K505 PolarHBondContact O-N 2.68Å; P503-K505 VanDerWaalsContact C-N 3.28Å; P503-K505 PolarHBondContact O-N 2.83Å
506	A	76	Confident	85.7	Confident	109 Å²	109	72.3 Å²	72.3	90%	0.901	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80	-14.9	-179.9	0	0	0	0	0	114.4	H504	H504-A506 VanDerWaalsContact C-N 3.3Å; H504-A506 PolarHBondContact O-N 2.62Å
507	E	76.8	Confident	85.7	Confident	153 Å²	153	74.2 Å²	74.2	72%	0.715	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.3	-35.5	-175.2	-64.7	169.3	175.1	0	0	111.7	H504	H504-E507 HydrophobicContact CB-CB 4.42Å; H504-E507 IonicContact CE1-OE2 2.64Å; H504-E507 IonicContact CG-OE2 2.84Å; H504-E507 IonicContact ND1-OE2 3.81Å; H504-E507 PolarHBondContact ND1-OE2 3.19Å; H504-E507 PolarHBondContact O-N 3.12Å; H504-E507 VanDerWaalsContact O-N 3.11Å
508	S	71	Confident	85.7	Confident	45 Å²	45	72.1 Å²	72.1	32%	0.315	37%	0.365	S	S	.	.	S	Bend	trans	-87.3	136.9	176	67.1	0	0	0	0	110.6	H504 S510	H504-S508 WeakPolarHBondContact O-CB 3.19Å; H504-S508 PolarHBondContact O-N 2.95Å; H504-S508 PolarHBondContact O-OG 2.89Å; S508-S510 PolarHBondContact O-N 3.02Å
509	K	68.8	Low	85.6	Confident	210 Å²	210	71.9 Å²	71.9	91%	0.913	36%	0.364	S	S	*	.			trans	-79	35	170.3	-59.1	-177.8	-179	-179.1	0	111.6
510	S	78.8	Confident	85.7	Confident	48 Å²	48	68.5 Å²	68.5	34%	0.336	35%	0.346	S	S	.	.			trans	-104.9	110.3	-175.1	-172	0	0	0	0	109.8	S508 F512	S508-S510 PolarHBondContact O-N 3.02Å; S510-F512 PolarHBondContact O-N 3.29Å; S510-F512 PolarHBondContact OG-N 3.3Å; S510-F512 PolarHBondContact OG-O 2.8Å
511	Y	82.7	Confident	85.8	Confident	177 Å²	177	69.8 Å²	69.8	69%	0.694	35%	0.353	S	S	*	.	S	Bend	trans	-69.4	-19.6	170.2	-59.2	-80.9	0	0	0	112.4	W502	W502-Y511 WeakPolarHBondContact CH2-O 3.38Å; W502-Y511 WeakPolarHBondContact CZ2-O 3.47Å
512	F	86.5	Confident	86	Confident	98 Å²	98	67.4 Å²	67.4	43%	0.43	34%	0.34	S	S	.	.	S	Bend	trans	-93.7	133.6	-178.9	-53.3	-72.4	0	0	0	111.6	D482 I483 D484 S510	D482-F512 WeakPolarHBondContact O-CE1 3.47Å; I483-F512 WeakPolarHBondContact O-CD1 3.26Å; D484-F512 HydrophobicContact CB-CE1 4.46Å; S510-F512 PolarHBondContact O-N 3.29Å; S510-F512 PolarHBondContact OG-N 3.3Å; S510-F512 PolarHBondContact OG-O 2.8Å
513	P	86.8	Confident	86.1	Confident	12 Å²	12	71.2 Å²	71.2	8%	0.078	36%	0.358	C	S	.	.	P	Polyproline II helix	trans	-67.2	122.3	179.1	-20.7	31.8	0	0	0	113.2	L479 I483 I488 W502 K515 G516 Y517 A518	L479-P513 HydrophobicContact CD1-CB 4.24Å; L479-P513 HydrophobicContact CD1-CG 4.06Å; I483-P513 VanDerWaalsContact O-CD 3.31Å; I483-P513 WeakPolarHBondContact O-CD 3.02Å; I488-P513 HydrophobicContact CD1-CG 3.76Å; W502-P513 HydrophobicContact CD2-CB 4.11Å; W502-P513 HydrophobicContact CD2-CG 4.21Å; W502-P513 HydrophobicContact CE3-CB 4.2Å; W502-P513 HydrophobicContact CE3-CG 3.9Å; W502-P513 HydrophobicContact CG-CB 4.35Å; W502-P513 HydrophobicContact CH2-CG 4.24Å; W502-P513 HydrophobicContact CZ3-CG 3.92Å; P513-K515 PolarHBondContact O-N 2.82Å; P513-G516 PolarHBondContact O-N 3.28Å; P513-G516 VanDerWaalsContact O-N 3.1Å; P513-Y517 VanDerWaalsContact CB-O 3.29Å; P513-Y517 WeakPolarHBondContact CB-O 3.25Å; P513-A518 HydrophobicContact CB-CB 4.38Å; P513-A518 HydrophobicContact CG-CB 4.44Å
514	P	82.4	Confident	86.6	Confident	51 Å²	51	72.7 Å²	72.7	33%	0.331	36%	0.364	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	127.5	-172.9	26.7	-33.9	0	0	0	111.6	G516 Y517	P514-G516 VanDerWaalsContact C-N 3.29Å; P514-Y517 WeakPolarHBondContact O-CD1 3.4Å; P514-Y517 WeakPolarHBondContact O-CE1 3.49Å
515	K	86.6	Confident	87.2	Confident	173 Å²	173	68.2 Å²	68.2	75%	0.752	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.9	17.2	-174.9	-41.1	175.3	-174.6	177	0	114.9	P513 Y517	P513-K515 PolarHBondContact O-N 2.82Å; K515-Y517 HydrophobicContact CB-CD1 4.1Å; K515-Y517 HydrophobicContact CB-CE1 4.06Å; K515-Y517 HydrophobicContact CD-CE1 4.44Å
516	G	92.5	Very high	87.9	Confident	12 Å²	12	68.4 Å²	68.4	12%	0.124	35%	0.351	C	S	.	.	S	Bend	trans	70.4	36.4	171.1	0	0	0	0	0	114.7	G478 L479 P513 P514	G478-G516 PolarHBondContact N-O 2.58Å; L479-G516 PolarHBondContact N-O 2.94Å; P513-G516 PolarHBondContact O-N 3.28Å; P513-G516 VanDerWaalsContact O-N 3.1Å; P514-G516 VanDerWaalsContact C-N 3.29Å
517	Y	94.9	Very high	88.9	Confident	57 Å²	57	63.5 Å²	63.5	22%	0.224	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.3	151.5	170	75	-81.6	0	0	0	111.1	F475 V476 P503 P513 P514 K515 F519	F475-Y517 HydrophobicContact CD2-CD2 4.35Å; F475-Y517 AromaticContact CE2-CD2 3.66Å; F475-Y517 HydrophobicContact CE2-CD2 3.66Å; F475-Y517 HydrophobicContact CE2-CG 4Å; F475-Y517 HydrophobicContact CZ-CD2 4.5Å; F475-Y517 HydrophobicContact CZ-CG 4.42Å; V476-Y517 CarbonylContact O-C 3.59Å; V476-Y517 WeakPolarHBondContact O-CA 3.18Å; V476-Y517 WeakPolarHBondContact O-CB 3.44Å; P503-Y517 HydrophobicContact CG-CE2 4.25Å; P503-Y517 WeakPolarHBondContact CG-OH 3.36Å; P513-Y517 VanDerWaalsContact CB-O 3.29Å; P513-Y517 WeakPolarHBondContact CB-O 3.25Å; P514-Y517 WeakPolarHBondContact O-CD1 3.4Å; P514-Y517 WeakPolarHBondContact O-CE1 3.49Å; K515-Y517 HydrophobicContact CB-CD1 4.1Å; K515-Y517 HydrophobicContact CB-CE1 4.06Å; K515-Y517 HydrophobicContact CD-CE1 4.44Å; Y517-F519 HydrophobicContact CE2-CE2 4.31Å
518	A	96	Very high	89.8	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	178.2	176.8	0	0	0	0	0	110.3	V476 L479 V500 W502 P513	V476-A518 PolarHBondContact N-O 3.32Å; V476-A518 PolarHBondContact O-N 2.69Å; L479-A518 HydrophobicContact CD1-CB 3.79Å; V500-A518 HydrophobicContact CG1-CB 4.02Å; W502-A518 HydrophobicContact CE3-CB 4.3Å; P513-A518 HydrophobicContact CB-CB 4.38Å; P513-A518 HydrophobicContact CG-CB 4.44Å
519	F	96	Very high	91	Very high	11 Å²	11	56.1 Å²	56.1	5%	0.048	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	139.6	167.8	-59	-87.5	0	0	0	110.1	K473 V474 F475 V500 D501 Y517 L521 Y620	K473-F519 HydrophobicContact CD-CB 4.44Å; K473-F519 HydrophobicContact CD-CD1 4.5Å; K473-F519 VanDerWaalsContact CE-CG 3.41Å; K473-F519 HydrophobicContact CG-CB 4.23Å; K473-F519 HydrophobicContact CG-CD1 4.27Å; V474-F519 CarbonylContact O-C 3.47Å; V474-F519 WeakPolarHBondContact O-CA 3.49Å; F475-F519 HydrophobicContact CB-CD1 4.12Å; F475-F519 HydrophobicContact CB-CE1 4.05Å; F475-F519 HydrophobicContact CD2-CD1 4.4Å; F475-F519 AromaticContact CD2-CE1 3.84Å; F475-F519 HydrophobicContact CD2-CE1 3.84Å; F475-F519 HydrophobicContact CD2-CZ 4.14Å; F475-F519 HydrophobicContact CG-CE1 4.46Å; V500-F519 WeakPolarHBondContact CA-O 3.18Å; D501-F519 PolarHBondContact N-O 3.15Å; D501-F519 PolarHBondContact O-N 2.89Å; Y517-F519 HydrophobicContact CE2-CE2 4.31Å; F519-L521 HydrophobicContact CB-CD1 4.06Å; F519-Y620 HydrophobicContact CE1-CE1 4.23Å
520	L	96.9	Very high	92.3	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	133.5	168.2	-45.5	179.3	0	0	0	108	K473 V474 V476 I488 F492 L498 V500 F522 L531	K473-L520 CarbonylContact C-O 3.6Å; K473-L520 WeakPolarHBondContact CA-O 3.48Å; V474-L520 HydrophobicContact CB-CB 4.42Å; V474-L520 PolarHBondContact N-O 2.93Å; V474-L520 PolarHBondContact O-N 3.09Å; V476-L520 HydrophobicContact CG2-CD1 3.74Å; V476-L520 HydrophobicContact CG2-CD2 4.25Å; V476-L520 HydrophobicContact CG2-CG 3.71Å; I488-L520 HydrophobicContact CG2-CD2 3.83Å; F492-L520 HydrophobicContact CB-CD1 4Å; F492-L520 HydrophobicContact CD1-CD1 3.5Å; F492-L520 VanDerWaalsContact CD1-CD1 3.5Å; F492-L520 HydrophobicContact CD2-CD1 3.74Å; F492-L520 HydrophobicContact CD2-CD2 3.9Å; F492-L520 HydrophobicContact CD2-CG 4.48Å; F492-L520 HydrophobicContact CE1-CD1 3.83Å; F492-L520 HydrophobicContact CE2-CD1 4.08Å; F492-L520 HydrophobicContact CE2-CD2 4.3Å; F492-L520 HydrophobicContact CG-CD1 3.46Å; F492-L520 VanDerWaalsContact CG-CD1 3.46Å; F492-L520 HydrophobicContact CG-CD2 4.33Å; F492-L520 HydrophobicContact CZ-CD1 4.12Å; L498-L520 HydrophobicContact CD1-CB 3.91Å; L498-L520 HydrophobicContact CD1-CD1 4.27Å; L498-L520 HydrophobicContact CD1-CD2 3.69Å; L498-L520 HydrophobicContact CD1-CG 4.14Å; V500-L520 HydrophobicContact CG2-CD2 4.2Å; L520-F522 HydrophobicContact CB-CD2 4.28Å; L520-F522 HydrophobicContact CB-CE2 3.81Å; L520-F522 HydrophobicContact CB-CZ 4.49Å; L520-F522 HydrophobicContact CD1-CE2 3.92Å; L520-F522 HydrophobicContact CD1-CZ 4.09Å; L520-L531 HydrophobicContact CD1-CD2 4.19Å
521	L	96.6	Very high	93.2	Very high	28 Å²	28	45.6 Å²	45.6	15%	0.147	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	98.4	173.9	-73.4	69.5	0	0	0	107.6	R472 K473 L498 I499 D501 F519 L618	R472-L521 WeakPolarHBondContact O-CA 3.35Å; K473-L521 HydrophobicContact CD-CD1 3.97Å; K473-L521 HydrophobicContact CD-CG 4.11Å; K473-L521 HydrophobicContact CG-CD1 4.08Å; K473-L521 HydrophobicContact CG-CG 4.22Å; L498-L521 CarbonylContact C-O 3.56Å; L498-L521 WeakPolarHBondContact CA-O 3.45Å; I499-L521 PolarHBondContact N-O 3.48Å; I499-L521 PolarHBondContact O-N 3.06Å; D501-L521 HydrophobicContact CB-CD1 3.73Å; F519-L521 HydrophobicContact CB-CD1 4.06Å; L521-L618 HydrophobicContact CD2-CD1 3.79Å; L521-L618 HydrophobicContact CG-CD1 4.23Å
522	F	96.7	Very high	93.9	Very high	3 Å²	3	38.3 Å²	38.3	1%	0.013	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.8	153.1	175.9	-70.6	-85.9	0	0	0	111.1	R472 V474 F495 P497 L498 L520 V528 L531	R472-F522 PolarHBondContact O-N 2.81Å; V474-F522 HydrophobicContact CG2-CD2 4.42Å; V474-F522 HydrophobicContact CG2-CE2 4.39Å; F495-F522 HydrophobicContact CB-CE1 4.2Å; P497-F522 WeakPolarHBondContact O-CA 3.37Å; L498-F522 HydrophobicContact CB-CD1 3.79Å; L498-F522 HydrophobicContact CB-CE1 3.94Å; L498-F522 HydrophobicContact CB-CG 4.2Å; L498-F522 HydrophobicContact CB-CZ 4.46Å; L498-F522 HydrophobicContact CD1-CZ 4.48Å; L498-F522 HydrophobicContact CD2-CE1 4.15Å; L498-F522 HydrophobicContact CG-CE1 4.44Å; L520-F522 HydrophobicContact CB-CD2 4.28Å; L520-F522 HydrophobicContact CB-CE2 3.81Å; L520-F522 HydrophobicContact CB-CZ 4.49Å; L520-F522 HydrophobicContact CD1-CE2 3.92Å; L520-F522 HydrophobicContact CD1-CZ 4.09Å; F522-V528 HydrophobicContact CB-CG2 4.2Å; F522-V528 HydrophobicContact CD2-CG2 3.69Å; F522-V528 HydrophobicContact CE2-CG2 4.41Å; F522-V528 HydrophobicContact CG-CG2 4.17Å; F522-L531 HydrophobicContact CE2-CD2 3.83Å; F522-L531 HydrophobicContact CZ-CD2 4.03Å
523	Q	95.2	Very high	94.3	Very high	84 Å²	84	39.1 Å²	39.1	39%	0.393	21%	0.208	S	C	.	.	S	Bend	trans	-72.4	-36.9	171.7	-60.4	-174.6	-2.9	0	0	111.4	R472 P497 W728	R472-Q523 WeakPolarHBondContact CD-O 3.45Å; R472-Q523 PolarHBondContact NH1-O 2.93Å; P497-Q523 HydrophobicContact CB-CG 4.12Å; P497-Q523 HydrophobicContact CG-CB 4.02Å; P497-Q523 HydrophobicContact CG-CG 3.93Å; P497-Q523 PolarHBondContact O-N 3.13Å; Q523-W728 HydrophobicContact CG-CH2 4.24Å; Q523-W728 HydrophobicContact CG-CZ3 4.23Å
524	D	94.7	Very high	94.8	Very high	78 Å²	78	40.9 Å²	40.9	42%	0.417	22%	0.223	S	C	.	.			trans	-117.7	146.8	-174	-55.5	-69.5	0	0	0	112.5	S526 S527	D524-S526 VanDerWaalsContact C-N 3.34Å; D524-S527 PolarHBondContact O-N 2.8Å
525	E	94.5	Very high	95.5	Very high	28 Å²	28	39.5 Å²	39.5	13%	0.131	22%	0.215	C	C	.	.	H	α-helix	trans	-70.2	-31.2	174.5	-174.6	-88.8	-179.5	0	0	112.4	E468 R469 Y470 S527 V528 Q529	E468-E525 HydrophobicContact CB-CG 4.05Å; E468-E525 HydrophobicContact CG-CB 4.17Å; E468-E525 HydrophobicContact CG-CG 4.22Å; R469-E525 WeakPolarHBondContact CA-OE1 3.18Å; R469-E525 WeakPolarHBondContact CB-OE1 3.49Å; R469-E525 PolarHBondContact N-OE1 2.83Å; Y470-E525 PolarHBondContact N-OE1 3.33Å; Y470-E525 VanDerWaalsContact O-CG 3.25Å; Y470-E525 WeakPolarHBondContact O-CG 3.26Å; E525-S527 PolarHBondContact O-N 3.33Å; E525-V528 WeakPolarHBondContact O-CA 3.29Å; E525-V528 WeakPolarHBondContact O-CB 3.38Å; E525-V528 PolarHBondContact O-N 2.8Å; E525-Q529 PolarHBondContact O-N 2.77Å; E525-Q529 VanDerWaalsContact O-N 3.09Å
526	S	95.1	Very high	95.9	Very high	59 Å²	59	36.3 Å²	36.3	41%	0.413	21%	0.205	S	C	.	.	H	α-helix	trans	-60.7	-29.3	176.1	54	0	0	0	0	113.2	D524 V528 Q529 A530	D524-S526 VanDerWaalsContact C-N 3.34Å; S526-V528 VanDerWaalsContact C-N 3.34Å; S526-Q529 PolarHBondContact O-N 2.86Å; S526-A530 WeakPolarHBondContact O-CB 3.07Å; S526-A530 PolarHBondContact O-N 2.9Å
527	S	96.8	Very high	96.1	Very high	7 Å²	7	42.5 Å²	42.5	5%	0.049	23%	0.23	C	C	.	.	H	α-helix	trans	-70	-30	172.5	-63.2	0	0	0	0	112.9	F495 G496 D524 E525 L531	F495-S527 WeakPolarHBondContact O-CA 3.35Å; F495-S527 WeakPolarHBondContact O-CB 3.47Å; F495-S527 PolarHBondContact O-OG 3.24Å; G496-S527 WeakPolarHBondContact CA-OG 3.46Å; D524-S527 PolarHBondContact O-N 2.8Å; E525-S527 PolarHBondContact O-N 3.33Å; S527-L531 WeakPolarHBondContact O-CB 3.32Å; S527-L531 PolarHBondContact O-N 3.4Å
528	V	96.9	Very high	96.1	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	25%	0.246	C	C	.	.	H	α-helix	trans	-73.1	-41.4	173.5	-177.7	0	0	0	0	110.3	Y470 V474 F522 E525 S526 L531 I532 P560	Y470-V528 HydrophobicContact CG-CG1 4.13Å; V474-V528 HydrophobicContact CG2-CB 4.41Å; V474-V528 HydrophobicContact CG2-CG1 3.66Å; V474-V528 HydrophobicContact CG2-CG2 3.9Å; F522-V528 HydrophobicContact CB-CG2 4.2Å; F522-V528 HydrophobicContact CD2-CG2 3.69Å; F522-V528 HydrophobicContact CE2-CG2 4.41Å; F522-V528 HydrophobicContact CG-CG2 4.17Å; E525-V528 WeakPolarHBondContact O-CA 3.29Å; E525-V528 WeakPolarHBondContact O-CB 3.38Å; E525-V528 PolarHBondContact O-N 2.8Å; S526-V528 VanDerWaalsContact C-N 3.34Å; V528-L531 PolarHBondContact O-N 3.06Å; V528-I532 HydrophobicContact CG1-CD1 4.01Å; V528-I532 WeakPolarHBondContact O-CD1 3.34Å; V528-I532 VanDerWaalsContact O-CG1 3.25Å; V528-I532 WeakPolarHBondContact O-CG1 3.46Å; V528-I532 PolarHBondContact O-N 2.97Å; V528-P560 HydrophobicContact CG1-CB 4.05Å
529	Q	95.9	Very high	95.9	Very high	42 Å²	42	51.9 Å²	51.9	20%	0.196	28%	0.281	C	S	.	.	H	α-helix	trans	-59.5	-48.7	171.3	-174.1	69.3	80.1	0	0	110.9	E525 S526 L531 I532 D533	E525-Q529 PolarHBondContact O-N 2.77Å; E525-Q529 VanDerWaalsContact O-N 3.09Å; S526-Q529 PolarHBondContact O-N 2.86Å; Q529-L531 VanDerWaalsContact C-N 3.28Å; Q529-L531 PolarHBondContact O-N 3.06Å; Q529-I532 WeakPolarHBondContact O-CB 3.46Å; Q529-I532 PolarHBondContact O-N 2.84Å; Q529-D533 PolarHBondContact NE2-OD1 2.73Å; Q529-D533 WeakPolarHBondContact O-CB 3.49Å; Q529-D533 PolarHBondContact O-N 2.84Å
530	A	96.6	Very high	95.6	Very high	38 Å²	38	54.3 Å²	54.3	31%	0.314	31%	0.309	S	S	.	.	H	α-helix	trans	-63.5	-29.7	178.5	0	0	0	0	0	114	F495 S526	F495-A530 HydrophobicContact CD1-CB 4.34Å; F495-A530 VanDerWaalsContact CD1-O 3.31Å; F495-A530 WeakPolarHBondContact CD1-O 3.49Å; F495-A530 WeakPolarHBondContact CE1-O 3.43Å; S526-A530 WeakPolarHBondContact O-CB 3.07Å; S526-A530 PolarHBondContact O-N 2.9Å
531	L	97.4	Very high	95.5	Very high	0 Å²	0	57.9 Å²	57.9	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-67.2	-46.9	169.7	165.7	60.3	0	0	0	111.2	V474 F492 F495 L520 F522 S527 V528 Q529 A534 C535 L544 I558	V474-L531 HydrophobicContact CG1-CD2 4.21Å; F492-L531 HydrophobicContact CD1-CD1 3.87Å; F492-L531 HydrophobicContact CD1-CD2 4.46Å; F492-L531 HydrophobicContact CE1-CD1 3.82Å; F495-L531 HydrophobicContact CB-CB 4.36Å; F495-L531 HydrophobicContact CD1-CB 4.44Å; F495-L531 HydrophobicContact CD2-CB 3.98Å; F495-L531 HydrophobicContact CD2-CD1 3.84Å; F495-L531 HydrophobicContact CD2-CG 4.45Å; F495-L531 HydrophobicContact CE2-CB 4.36Å; F495-L531 HydrophobicContact CE2-CD1 3.51Å; F495-L531 HydrophobicContact CG-CB 4.01Å; F495-L531 HydrophobicContact CZ-CD1 4.07Å; L520-L531 HydrophobicContact CD1-CD2 4.19Å; F522-L531 HydrophobicContact CE2-CD2 3.83Å; F522-L531 HydrophobicContact CZ-CD2 4.03Å; S527-L531 WeakPolarHBondContact O-CB 3.32Å; S527-L531 PolarHBondContact O-N 3.4Å; V528-L531 PolarHBondContact O-N 3.06Å; Q529-L531 VanDerWaalsContact C-N 3.28Å; Q529-L531 PolarHBondContact O-N 3.06Å; L531-A534 PolarHBondContact O-N 2.66Å; L531-C535 PolarHBondContact O-N 2.88Å; L531-C535 PolarHBondContact O-SG 2.77Å; L531-L544 HydrophobicContact CD1-CD2 3.97Å; L531-I558 HydrophobicContact CD1-CG2 4.42Å; L531-I558 HydrophobicContact CD2-CG2 3.95Å; L531-I558 HydrophobicContact CG-CG2 4.16Å
532	I	96.4	Very high	95.5	Very high	23 Å²	23	57.9 Å²	57.9	12%	0.118	33%	0.325	C	S	.	.	H	α-helix	trans	-62.1	-46.4	179	-68.2	163	0	0	0	110.8	Y470 V528 Q529 A534 C535 L542 P560	Y470-I532 HydrophobicContact CD1-CD1 3.77Å; Y470-I532 HydrophobicContact CD2-CD1 3.68Å; Y470-I532 HydrophobicContact CE1-CD1 3.62Å; Y470-I532 HydrophobicContact CE2-CD1 3.53Å; Y470-I532 HydrophobicContact CG-CD1 3.8Å; V528-I532 HydrophobicContact CG1-CD1 4.01Å; V528-I532 WeakPolarHBondContact O-CD1 3.34Å; V528-I532 VanDerWaalsContact O-CG1 3.25Å; V528-I532 WeakPolarHBondContact O-CG1 3.46Å; V528-I532 PolarHBondContact O-N 2.97Å; Q529-I532 WeakPolarHBondContact O-CB 3.46Å; Q529-I532 PolarHBondContact O-N 2.84Å; I532-A534 PolarHBondContact O-N 2.77Å; I532-C535 WeakPolarHBondContact O-CB 3.3Å; I532-C535 PolarHBondContact O-N 3.21Å; I532-L542 HydrophobicContact CB-CD1 4.36Å; I532-L542 HydrophobicContact CG1-CD1 3.99Å; I532-L542 HydrophobicContact CG2-CD1 3.93Å; I532-P560 HydrophobicContact CD1-CB 3.89Å; I532-P560 HydrophobicContact CD1-CG 3.7Å; I532-P560 HydrophobicContact CG1-CB 4.41Å; I532-P560 HydrophobicContact CG1-CG 4Å
533	D	96.1	Very high	95.5	Very high	116 Å²	116	60.1 Å²	60.1	62%	0.62	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.4	-15	-179.6	-61.1	-12.2	0	0	0	113.1	Q529	Q529-D533 PolarHBondContact NE2-OD1 2.73Å; Q529-D533 WeakPolarHBondContact O-CB 3.49Å; Q529-D533 PolarHBondContact O-N 2.84Å
534	A	96.4	Very high	95.6	Very high	48 Å²	48	56.5 Å²	56.5	40%	0.397	32%	0.316	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.5	5.1	177.3	0	0	0	0	0	113.9	F495 L531 I532 L544	F495-A534 HydrophobicContact CE1-CB 3.47Å; F495-A534 VanDerWaalsContact CE1-CB 3.47Å; F495-A534 HydrophobicContact CZ-CB 3.79Å; L531-A534 PolarHBondContact O-N 2.66Å; I532-A534 PolarHBondContact O-N 2.77Å; A534-L544 WeakPolarHBondContact O-CD1 3.49Å
535	C	96.9	Very high	95.7	Very high	23 Å²	23	55.3 Å²	55.3	16%	0.155	31%	0.314	C	S	.	.	S	Bend	trans	-83.2	154.2	173.3	-70.8	0	0	0	0	111.7	L531 I532 L542 Y543	L531-C535 PolarHBondContact O-N 2.88Å; L531-C535 PolarHBondContact O-SG 2.77Å; I532-C535 WeakPolarHBondContact O-CB 3.3Å; I532-C535 PolarHBondContact O-N 3.21Å; C535-L542 HydrophobicContact CB-CB 3.87Å; C535-L542 HydrophobicContact CB-CD2 4.07Å; C535-L542 HydrophobicContact CB-CG 4.4Å; C535-Y543 CarbonylContact C-O 3.52Å; C535-Y543 WeakPolarHBondContact CA-O 3.48Å; C535-Y543 WeakPolarHBondContact CB-O 2.94Å
536	I	96.1	Very high	95.7	Very high	105 Å²	105	54.1 Å²	54.1	54%	0.538	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.4	127.8	165.4	-57	171.5	0	0	0	107.1	L542 Y543	I536-L542 CarbonylContact O-C 3.45Å; I536-Y543 PolarHBondContact N-O 2.59Å; I536-Y543 PolarHBondContact O-N 3.49Å
537	E	95.9	Very high	95.7	Very high	142 Å²	142	53.4 Å²	53.4	66%	0.664	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-96.4	125.1	174.4	-169.7	176.5	171.4	0	0	110.8	K541 L542	E537-K541 WeakPolarHBondContact CA-O 3.08Å; E537-L542 HydrophobicContact CB-CD2 4.06Å; E537-L542 HydrophobicContact CG-CD2 4.17Å
538	E	94.5	Very high	95.5	Very high	119 Å²	119	53.6 Å²	53.6	56%	0.556	31%	0.305	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-141.6	128.4	178.4	-177.2	177.8	-144	0	0	108.8	G540 K541 Y543	E538-G540 PolarHBondContact O-N 3.13Å; E538-G540 VanDerWaalsContact O-N 3.15Å; E538-K541 PolarHBondContact N-O 2.89Å; E538-K541 WeakPolarHBondContact O-CA 3.32Å; E538-K541 VanDerWaalsContact O-CB 3.3Å; E538-K541 WeakPolarHBondContact O-CB 3.43Å; E538-K541 PolarHBondContact O-N 3.45Å; E538-Y543 HydrophobicContact CB-CD2 4.13Å; E538-Y543 HydrophobicContact CB-CE2 4.07Å
539	D	91.9	Very high	95.2	Very high	135 Å²	135	58 Å²	58	72%	0.722	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.4	32.3	-172.4	-62.5	-24.7	0	0	0	115.3	K541	D539-K541 HydrophobicContact CB-CD 4.17Å; D539-K541 VanDerWaalsContact CB-NZ 3.35Å; D539-K541 PolarHBondContact O-N 2.88Å; D539-K541 IonicContact OD2-NZ 2.75Å; D539-K541 PolarHBondContact OD2-NZ 2.76Å
540	G	90.4	Very high	95	Very high	63 Å²	63	61.3 Å²	61.3	65%	0.649	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.5	18.9	-174.4	0	0	0	0	0	114.1	E538	E538-G540 PolarHBondContact O-N 3.13Å; E538-G540 VanDerWaalsContact O-N 3.15Å
541	K	94.3	Very high	94.9	Very high	75 Å²	75	62.3 Å²	62.3	33%	0.326	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	141.3	173.1	-51.6	152.8	-162	151.2	0	107.8	E537 E538 D539 Y543	E537-K541 WeakPolarHBondContact CA-O 3.08Å; E538-K541 PolarHBondContact N-O 2.89Å; E538-K541 WeakPolarHBondContact O-CA 3.32Å; E538-K541 VanDerWaalsContact O-CB 3.3Å; E538-K541 WeakPolarHBondContact O-CB 3.43Å; E538-K541 PolarHBondContact O-N 3.45Å; D539-K541 HydrophobicContact CB-CD 4.17Å; D539-K541 VanDerWaalsContact CB-NZ 3.35Å; D539-K541 PolarHBondContact O-N 2.88Å; D539-K541 IonicContact OD2-NZ 2.75Å; D539-K541 PolarHBondContact OD2-NZ 2.76Å; K541-Y543 HydrophobicContact CB-CD2 4.37Å; K541-Y543 HydrophobicContact CB-CE2 3.63Å; K541-Y543 HydrophobicContact CD-CE2 4.21Å; K541-Y543 WeakPolarHBondContact CD-OH 3.32Å
542	L	97	Very high	94.7	Very high	28 Å²	28	70.4 Å²	70.4	15%	0.147	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	137.6	175.3	-59.5	176	0	0	0	110.2	I532 C535 I536 E537 Q557 I558 P560	I532-L542 HydrophobicContact CB-CD1 4.36Å; I532-L542 HydrophobicContact CG1-CD1 3.99Å; I532-L542 HydrophobicContact CG2-CD1 3.93Å; C535-L542 HydrophobicContact CB-CB 3.87Å; C535-L542 HydrophobicContact CB-CD2 4.07Å; C535-L542 HydrophobicContact CB-CG 4.4Å; I536-L542 CarbonylContact O-C 3.45Å; E537-L542 HydrophobicContact CB-CD2 4.06Å; E537-L542 HydrophobicContact CG-CD2 4.17Å; L542-Q557 CarbonylContact O-C 3.53Å; L542-Q557 WeakPolarHBondContact O-CA 3.35Å; L542-I558 HydrophobicContact CB-CB 4.14Å; L542-I558 PolarHBondContact O-N 3.02Å; L542-P560 HydrophobicContact CD1-CG 4.21Å
543	Y	97.7	Very high	94.5	Very high	49 Å²	49	74.4 Å²	74.4	19%	0.192	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	147.2	177.3	-66.7	-84.2	0	0	0	111.3	C535 I536 E538 K541 P555 V556 Q557	C535-Y543 CarbonylContact C-O 3.52Å; C535-Y543 WeakPolarHBondContact CA-O 3.48Å; C535-Y543 WeakPolarHBondContact CB-O 2.94Å; I536-Y543 PolarHBondContact N-O 2.59Å; I536-Y543 PolarHBondContact O-N 3.49Å; E538-Y543 HydrophobicContact CB-CD2 4.13Å; E538-Y543 HydrophobicContact CB-CE2 4.07Å; K541-Y543 HydrophobicContact CB-CD2 4.37Å; K541-Y543 HydrophobicContact CB-CE2 3.63Å; K541-Y543 HydrophobicContact CD-CE2 4.21Å; K541-Y543 WeakPolarHBondContact CD-OH 3.32Å; Y543-P555 HydrophobicContact CD1-CB 4.38Å; Y543-V556 WeakPolarHBondContact CA-O 3.47Å; Y543-Q557 HydrophobicContact CD1-CB 4.17Å; Y543-Q557 HydrophobicContact CE1-CB 3.91Å; Y543-Q557 HydrophobicContact CE1-CG 4.14Å
544	L	96.7	Very high	94.5	Very high	8 Å²	8	71.8 Å²	71.8	4%	0.042	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	137.4	171.7	-162.9	76.8	0	0	0	109.6	F492 F495 L531 A534 V556 I558	F492-L544 HydrophobicContact CD1-CD2 4Å; F492-L544 HydrophobicContact CE1-CD2 3.43Å; F492-L544 VanDerWaalsContact CE1-CD2 3.43Å; F492-L544 HydrophobicContact CZ-CD2 4.16Å; F495-L544 HydrophobicContact CE2-CD2 3.87Å; F495-L544 HydrophobicContact CZ-CD1 4.41Å; F495-L544 HydrophobicContact CZ-CD2 4.18Å; L531-L544 HydrophobicContact CD1-CD2 3.97Å; A534-L544 WeakPolarHBondContact O-CD1 3.49Å; L544-V556 PolarHBondContact N-O 2.75Å; L544-V556 WeakPolarHBondContact O-CG2 3.18Å; L544-V556 PolarHBondContact O-N 3.06Å; L544-I558 HydrophobicContact CB-CD1 4.07Å; L544-I558 HydrophobicContact CB-CG1 3.86Å
545	C	96	Very high	94.5	Very high	54 Å²	54	73.3 Å²	73.3	37%	0.365	40%	0.402	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	127.7	173.1	-61.7	0	0	0	0	110.4	D553 K554	C545-D553 HydrophobicContact CB-CB 4.25Å; C545-K554 WeakPolarHBondContact CA-O 3.35Å
546	V	95.7	Very high	94.5	Very high	3 Å²	3	72.2 Å²	72.2	2%	0.018	39%	0.394	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	137.7	177	174.1	0	0	0	0	108.7	I483 F492 K554 V556	I483-V546 HydrophobicContact CD1-CG1 3.4Å; F492-V546 HydrophobicContact CE2-CG2 4.12Å; F492-V546 HydrophobicContact CZ-CG2 3.91Å; V546-K554 PolarHBondContact N-O 3.14Å; V546-K554 PolarHBondContact O-N 3.2Å; V546-V556 HydrophobicContact CB-CG1 4.06Å; V546-V556 HydrophobicContact CB-CG2 4.23Å; V546-V556 HydrophobicContact CG2-CG1 4.4Å; V546-V556 HydrophobicContact CG2-CG2 3.65Å
547	S	94.1	Very high	94.5	Very high	44 Å²	44	69.4 Å²	69.4	31%	0.308	38%	0.379	S	S	.	.			trans	-108.1	143.4	179.2	-69.8	0	0	0	0	111.4	I551 K552 D553	S547-I551 CarbonylContact C-O 3.57Å; S547-I551 WeakPolarHBondContact CA-O 3.21Å; S547-K552 WeakPolarHBondContact OG-CA 3.29Å; S547-D553 PolarHBondContact OG-N 2.98Å; S547-D553 PolarHBondContact OG-OD1 2.79Å
548	S	92	Very high	94.6	Very high	11 Å²	11	62.7 Å²	62.7	8%	0.077	35%	0.348	C	S	.	.			trans	-115.7	175.2	166.1	66.3	0	0	0	0	110.3	P480 D482 T550 I551	P480-S548 VanDerWaalsContact CB-OG 3.26Å; P480-S548 WeakPolarHBondContact CB-OG 3.45Å; D482-S548 VanDerWaalsContact OD1-CB 3.32Å; D482-S548 WeakPolarHBondContact OD1-CB 3.31Å; D482-S548 PolarHBondContact OD1-OG 2.91Å; D482-S548 WeakPolarHBondContact OD2-CB 3.41Å; D482-S548 PolarHBondContact OD2-OG 2.88Å; S548-T550 PolarHBondContact O-N 3.14Å; S548-I551 PolarHBondContact N-O 2.84Å; S548-I551 PolarHBondContact OG-N 2.97Å; S548-I551 VanDerWaalsContact OG-N 3.11Å; S548-I551 PolarHBondContact OG-O 2.9Å
549	P	91.5	Very high	94.7	Very high	91 Å²	91	61.9 Å²	61.9	59%	0.591	34%	0.34	S	S	*	.	S	Bend	trans	-57.5	-30.6	178.8	-29.6	38.7	0	0	0	114.6	E487	E487-P549 VanDerWaalsContact OE1-CD 3.25Å; E487-P549 WeakPolarHBondContact OE1-CD 3.25Å; E487-P549 WeakPolarHBondContact OE1-CG 3.21Å; E487-P549 WeakPolarHBondContact OE2-CD 3.38Å
550	T	92.2	Very high	94.9	Very high	113 Å²	113	57 Å²	57	69%	0.693	32%	0.315	S	S	*	.	S	Bend	trans	-107.1	-23.2	178.8	73.2	0	0	0	0	114.9	D482 S548	D482-T550 VanDerWaalsContact OD2-CB 3.29Å; D482-T550 WeakPolarHBondContact OD2-CB 3.46Å; D482-T550 WeakPolarHBondContact OD2-CG2 3.06Å; D482-T550 PolarHBondContact OD2-N 3.32Å; D482-T550 PolarHBondContact OD2-OG1 3.28Å; S548-T550 PolarHBondContact O-N 3.14Å
551	I	93.1	Very high	95.2	Very high	59 Å²	59	54.8 Å²	54.8	30%	0.303	29%	0.287	S	S	.	.			trans	-121.6	112	-178.1	-47.9	-175.2	0	0	0	110.5	P480 P481 S547 S548 K554	P480-I551 HydrophobicContact CB-CB 4.44Å; P480-I551 HydrophobicContact CB-CD1 4.35Å; P481-I551 HydrophobicContact CG-CD1 4.46Å; S547-I551 CarbonylContact C-O 3.57Å; S547-I551 WeakPolarHBondContact CA-O 3.21Å; S548-I551 PolarHBondContact N-O 2.84Å; S548-I551 PolarHBondContact OG-N 2.97Å; S548-I551 VanDerWaalsContact OG-N 3.11Å; S548-I551 PolarHBondContact OG-O 2.9Å; I551-K554 HydrophobicContact CG2-CB 3.99Å; I551-K554 HydrophobicContact CG2-CD 4.42Å; I551-K554 HydrophobicContact CG2-CG 4.37Å
552	K	93.6	Very high	95.3	Very high	170 Å²	170	53.3 Å²	53.3	74%	0.739	28%	0.283	S	S	*	.			trans	-86.5	144.7	175.1	-62.2	-175	-179.4	-176.6	0	111.8	S547 K554	S547-K552 WeakPolarHBondContact OG-CA 3.29Å; K552-K554 PolarHBondContact O-N 2.75Å; K552-K554 VanDerWaalsContact O-N 3.13Å
553	D	93.3	Very high	95.2	Very high	106 Å²	106	53.3 Å²	53.3	57%	0.567	28%	0.283	S	S	*	.	S	Bend	trans	47.4	42.3	170.1	-57.7	-52	0	0	0	114.6	C545 S547 P555	C545-D553 HydrophobicContact CB-CB 4.25Å; S547-D553 PolarHBondContact OG-N 2.98Å; S547-D553 PolarHBondContact OG-OD1 2.79Å; D553-P555 WeakPolarHBondContact O-CD 3.1Å
554	K	94.9	Very high	95.1	Very high	61 Å²	61	54.8 Å²	54.8	27%	0.265	30%	0.3	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.9	125.6	175.1	-166.1	-174.1	-175.7	-168.6	0	109.1	G478 L479 P480 C545 V546 I551 K552 V556	G478-K554 WeakPolarHBondContact O-CD 3.34Å; G478-K554 WeakPolarHBondContact O-CE 3.43Å; G478-K554 PolarHBondContact O-NZ 3.24Å; L479-K554 PolarHBondContact O-NZ 3.49Å; P480-K554 HydrophobicContact CB-CD 4.34Å; P480-K554 HydrophobicContact CG-CB 4.25Å; P480-K554 HydrophobicContact CG-CD 3.86Å; C545-K554 WeakPolarHBondContact CA-O 3.35Å; V546-K554 PolarHBondContact N-O 3.14Å; V546-K554 PolarHBondContact O-N 3.2Å; I551-K554 HydrophobicContact CG2-CB 3.99Å; I551-K554 HydrophobicContact CG2-CD 4.42Å; I551-K554 HydrophobicContact CG2-CG 4.37Å; K552-K554 PolarHBondContact O-N 2.75Å; K552-K554 VanDerWaalsContact O-N 3.13Å; K554-V556 PolarHBondContact O-N 3.32Å
555	P	95.8	Very high	95.1	Very high	80 Å²	80	55.9 Å²	55.9	52%	0.519	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	118	171.9	27.6	-32.7	0	0	0	109.4	Y543 D553	Y543-P555 HydrophobicContact CD1-CB 4.38Å; D553-P555 WeakPolarHBondContact O-CD 3.1Å
556	V	97.1	Very high	95.1	Very high	0 Å²	0	54 Å²	54	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	137.5	174	-49.7	0	0	0	0	109.1	V476 G477 L479 F492 Y543 L544 V546 K554 I558	V476-V556 HydrophobicContact CG1-CB 4.16Å; V476-V556 HydrophobicContact CG1-CG2 3.69Å; G477-V556 CarbonylContact O-C 3.54Å; L479-V556 HydrophobicContact CD2-CG1 4.23Å; F492-V556 HydrophobicContact CZ-CG2 4.27Å; Y543-V556 WeakPolarHBondContact CA-O 3.47Å; L544-V556 PolarHBondContact N-O 2.75Å; L544-V556 WeakPolarHBondContact O-CG2 3.18Å; L544-V556 PolarHBondContact O-N 3.06Å; V546-V556 HydrophobicContact CB-CG1 4.06Å; V546-V556 HydrophobicContact CB-CG2 4.23Å; V546-V556 HydrophobicContact CG2-CG1 4.4Å; V546-V556 HydrophobicContact CG2-CG2 3.65Å; K554-V556 PolarHBondContact O-N 3.32Å; V556-I558 HydrophobicContact CG2-CD1 4.01Å; V556-I558 PolarHBondContact O-N 3.04Å
557	Q	97.2	Very high	95.1	Very high	46 Å²	46	58 Å²	58	22%	0.215	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	122.9	-177.4	-169	-173.1	46.7	0	0	110	V476 G477 L542 Y543 R559	V476-Q557 WeakPolarHBondContact CA-O 3.38Å; G477-Q557 PolarHBondContact N-O 3.2Å; G477-Q557 PolarHBondContact O-N 3.02Å; L542-Q557 CarbonylContact O-C 3.53Å; L542-Q557 WeakPolarHBondContact O-CA 3.35Å; Y543-Q557 HydrophobicContact CD1-CB 4.17Å; Y543-Q557 HydrophobicContact CE1-CB 3.91Å; Y543-Q557 HydrophobicContact CE1-CG 4.14Å; Q557-R559 HydrophobicContact CG-CG 4.09Å
558	I	97.9	Very high	95.3	Very high	2 Å²	2	59 Å²	59	1%	0.01	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	131.5	174.6	-50	-56.2	0	0	0	108.6	V474 V476 F492 L531 L542 L544 V556	V474-I558 HydrophobicContact CG1-CG2 3.73Å; V476-I558 HydrophobicContact CG1-CD1 4.06Å; V476-I558 HydrophobicContact CG2-CD1 3.82Å; F492-I558 HydrophobicContact CE1-CD1 3.71Å; F492-I558 HydrophobicContact CZ-CD1 3.76Å; L531-I558 HydrophobicContact CD1-CG2 4.42Å; L531-I558 HydrophobicContact CD2-CG2 3.95Å; L531-I558 HydrophobicContact CG-CG2 4.16Å; L542-I558 HydrophobicContact CB-CB 4.14Å; L542-I558 PolarHBondContact O-N 3.02Å; L544-I558 HydrophobicContact CB-CD1 4.07Å; L544-I558 HydrophobicContact CB-CG1 3.86Å; V556-I558 HydrophobicContact CG2-CD1 4.01Å; V556-I558 PolarHBondContact O-N 3.04Å
559	R	96.2	Very high	95.4	Very high	101 Å²	101	61.7 Å²	61.7	38%	0.381	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	89.9	177.5	-59.7	-176.3	68.8	162.7	4.6	110.3	F475 Q557	F475-R559 HydrophobicContact CB-CB 4.2Å; F475-R559 HydrophobicContact CD1-CB 3.96Å; F475-R559 HydrophobicContact CD1-CG 4.03Å; F475-R559 PolarHBondContact N-O 3.46Å; F475-R559 PolarHBondContact O-N 2.92Å; Q557-R559 HydrophobicContact CG-CG 4.09Å
560	P	96.6	Very high	95.5	Very high	33 Å²	33	61 Å²	61	21%	0.214	32%	0.32	C	S	.	.	P	Polyproline II helix	trans	-68.4	158.3	168.9	33.5	-37.2	0	0	0	109.8	Y470 V474 V528 I532 L542	Y470-P560 HydrophobicContact CD1-CB 3.9Å; Y470-P560 HydrophobicContact CD1-CG 4.25Å; Y470-P560 HydrophobicContact CE1-CB 4.45Å; Y470-P560 HydrophobicContact CE1-CG 4.31Å; V474-P560 HydrophobicContact CG2-CB 4.43Å; V528-P560 HydrophobicContact CG1-CB 4.05Å; I532-P560 HydrophobicContact CD1-CB 3.89Å; I532-P560 HydrophobicContact CD1-CG 3.7Å; I532-P560 HydrophobicContact CG1-CB 4.41Å; I532-P560 HydrophobicContact CG1-CG 4Å; L542-P560 HydrophobicContact CD1-CG 4.21Å
561	W	97.1	Very high	95.2	Very high	17 Å²	17	58.5 Å²	58.5	6%	0.064	30%	0.302	C	S	.	.	P	Polyproline II helix	trans	-98.5	121	164.6	178.8	-102.1	0	0	0	109.3	Y470 S471 D565 S566 R592 I612 Y620 P621	Y470-W561 CarbonylContact C-O 3.58Å; Y470-W561 WeakPolarHBondContact CA-O 3.42Å; S471-W561 PolarHBondContact N-O 3.25Å; W561-D565 HydrophobicContact CH2-CB 4.24Å; W561-D565 HydrophobicContact CZ2-CB 4.1Å; W561-S566 PolarHBondContact NE1-OG 3.31Å; W561-R592 HydrophobicContact CH2-CG 4.5Å; W561-I612 HydrophobicContact CH2-CG1 4.24Å; W561-I612 HydrophobicContact CZ2-CB 4.39Å; W561-I612 HydrophobicContact CZ2-CG1 4.23Å; W561-I612 HydrophobicContact CZ2-CG2 4.39Å; W561-Y620 HydrophobicContact CB-CD2 3.92Å; W561-Y620 HydrophobicContact CB-CE2 4Å; W561-P621 HydrophobicContact CD2-CG 3.32Å; W561-P621 VanDerWaalsContact CE2-CG 3.41Å; W561-P621 HydrophobicContact CE3-CG 3.48Å; W561-P621 VanDerWaalsContact CE3-CG 3.48Å; W561-P621 HydrophobicContact CG-CG 3.89Å; W561-P621 HydrophobicContact CH2-CG 3.8Å; W561-P621 HydrophobicContact CZ2-CG 3.67Å; W561-P621 HydrophobicContact CZ3-CG 3.71Å
562	N	96	Very high	94.7	Very high	44 Å²	44	58.9 Å²	58.9	24%	0.235	32%	0.321	C	S	.	.	B	Isolated β-bridge	trans	-79.6	126.3	173.5	167.8	25.1	0	0	0	109.5	R469 Y470 S564 D565	R469-N562 PolarHBondContact O-OD1 2.99Å; Y470-N562 HydrophobicContact CD1-CB 4.28Å; Y470-N562 HydrophobicContact CE1-CB 4.11Å; N562-S564 PolarHBondContact ND2-OG 2.85Å; N562-S564 PolarHBondContact O-N 2.83Å; N562-S564 PolarHBondContact OD1-N 3.34Å; N562-S564 VanDerWaalsContact OD1-N 3.09Å; N562-S564 PolarHBondContact OD1-OG 2.85Å; N562-D565 WeakPolarHBondContact CB-OD2 3.46Å; N562-D565 PolarHBondContact ND2-OD2 2.91Å; N562-D565 PolarHBondContact O-N 3.45Å; N562-D565 VanDerWaalsContact O-N 3.14Å
563	L	95.3	Very high	94.3	Very high	27 Å²	27	54.8 Å²	54.8	14%	0.141	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-64.5	-29.3	-176.9	-61.6	-174.3	0	0	0	112	E468 R469 D565 S566 K619	E468-L563 HydrophobicContact CB-CD1 3.78Å; R469-L563 WeakPolarHBondContact O-CB 2.95Å; R469-L563 WeakPolarHBondContact O-CG 3.29Å; R469-L563 PolarHBondContact O-N 2.68Å; L563-D565 PolarHBondContact O-N 3.44Å; L563-S566 WeakPolarHBondContact O-CB 3.25Å; L563-S566 PolarHBondContact O-N 2.99Å; L563-S566 VanDerWaalsContact O-N 3.14Å; L563-S566 PolarHBondContact O-OG 2.87Å; L563-K619 HydrophobicContact CD1-CD 3.95Å; L563-K619 HydrophobicContact CD2-CB 3.53Å; L563-K619 HydrophobicContact CD2-CD 4.31Å
564	S	95.3	Very high	93.6	Very high	80 Å²	80	53.7 Å²	53.7	56%	0.559	31%	0.305	S	S	*	.	G	3₁₀ helix	trans	-71.2	-7	177.4	86.5	0	0	0	0	114.7	N562	N562-S564 PolarHBondContact ND2-OG 2.85Å; N562-S564 PolarHBondContact O-N 2.83Å; N562-S564 PolarHBondContact OD1-N 3.34Å; N562-S564 VanDerWaalsContact OD1-N 3.09Å; N562-S564 PolarHBondContact OD1-OG 2.85Å
565	D	96.2	Very high	93	Very high	31 Å²	31	56 Å²	56	17%	0.166	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-93.4	1.2	174.4	-67.2	-48.5	0	0	0	112.3	W561 N562 L563 R592 A593	W561-D565 HydrophobicContact CH2-CB 4.24Å; W561-D565 HydrophobicContact CZ2-CB 4.1Å; N562-D565 WeakPolarHBondContact CB-OD2 3.46Å; N562-D565 PolarHBondContact ND2-OD2 2.91Å; N562-D565 PolarHBondContact O-N 3.45Å; N562-D565 VanDerWaalsContact O-N 3.14Å; L563-D565 PolarHBondContact O-N 3.44Å; D565-R592 HydrophobicContact CB-CB 4Å; D565-R592 HydrophobicContact CB-CG 3.83Å; D565-R592 VanDerWaalsContact CG-CD 3.43Å; D565-R592 WeakPolarHBondContact OD1-CD 3.14Å; D565-R592 IonicContact OD1-NH1 2.9Å; D565-A593 WeakPolarHBondContact O-CB 3.29Å; D565-A593 PolarHBondContact O-N 2.71Å
566	S	96.7	Very high	92.5	Very high	15 Å²	15	55.3 Å²	55.3	11%	0.105	32%	0.318	C	S	.	.	S	Bend	trans	-80.5	-20.9	-178	-46.4	0	0	0	0	113.9	W561 L563 G611 I612	W561-S566 PolarHBondContact NE1-OG 3.31Å; L563-S566 WeakPolarHBondContact O-CB 3.25Å; L563-S566 PolarHBondContact O-N 2.99Å; L563-S566 VanDerWaalsContact O-N 3.14Å; L563-S566 PolarHBondContact O-OG 2.87Å; S566-G611 CarbonylContact O-C 3.51Å; S566-G611 VanDerWaalsContact O-CA 3.31Å; S566-G611 WeakPolarHBondContact O-CA 3.5Å; S566-I612 PolarHBondContact O-N 3.39Å
567	D	95.9	Very high	92.1	Very high	87 Å²	87	57.9 Å²	57.9	47%	0.465	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	149.7	179.7	68	-80.7	0	0	0	111.8	A593 Y609	D567-A593 VanDerWaalsContact C-CB 3.48Å; D567-Y609 HydrophobicContact CB-CE2 4.03Å
568	F	96.9	Very high	91.6	Very high	65 Å²	65	58.4 Å²	58.4	29%	0.285	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	123.4	179.6	-177.7	-104.5	0	0	0	111	M570 A593 V594 A597 Y609 A610	F568-M570 HydrophobicContact CD1-CB 4.26Å; F568-M570 HydrophobicContact CE1-CB 3.68Å; F568-M570 HydrophobicContact CE1-CG 3.94Å; F568-M570 HydrophobicContact CE1-SD 4.43Å; F568-A593 HydrophobicContact CB-CB 3.78Å; F568-V594 HydrophobicContact CB-CB 4.3Å; F568-V594 HydrophobicContact CD1-CB 4.19Å; F568-V594 HydrophobicContact CD1-CG2 4.26Å; F568-V594 HydrophobicContact CD2-CB 3.71Å; F568-V594 HydrophobicContact CD2-CG2 3.94Å; F568-V594 HydrophobicContact CE1-CB 4.45Å; F568-V594 HydrophobicContact CE1-CG2 4.02Å; F568-V594 HydrophobicContact CE2-CB 4.02Å; F568-V594 HydrophobicContact CE2-CG2 3.7Å; F568-V594 HydrophobicContact CG-CB 3.8Å; F568-V594 HydrophobicContact CG-CG2 4.21Å; F568-V594 HydrophobicContact CZ-CB 4.38Å; F568-V594 HydrophobicContact CZ-CG2 3.74Å; F568-A597 HydrophobicContact CD1-CB 3.67Å; F568-A597 HydrophobicContact CE1-CB 4.13Å; F568-Y609 WeakPolarHBondContact O-CA 3.09Å; F568-Y609 VanDerWaalsContact O-CD2 3.28Å; F568-Y609 WeakPolarHBondContact O-CD2 3.46Å; F568-A610 PolarHBondContact N-O 3.28Å; F568-A610 PolarHBondContact O-N 2.9Å
569	V	95.4	Very high	91.3	Very high	68 Å²	68	62.4 Å²	62.4	41%	0.412	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	120.2	170.8	178.6	0	0	0	0	107.9	G572 Y609	V569-G572 VanDerWaalsContact CG1-CA 3.48Å; V569-Y609 HydrophobicContact CG2-CD2 3.84Å; V569-Y609 HydrophobicContact CG2-CE2 4.44Å
570	M	92.1	Very high	91.2	Very high	75 Å²	75	59.4 Å²	59.4	37%	0.369	34%	0.344	S	S	.	.	S	Bend	trans	-92.7	-38.9	178.1	-164.2	165.8	65.3	0	0	112.1	F568 D601 V607 C608	F568-M570 HydrophobicContact CD1-CB 4.26Å; F568-M570 HydrophobicContact CE1-CB 3.68Å; F568-M570 HydrophobicContact CE1-CG 3.94Å; F568-M570 HydrophobicContact CE1-SD 4.43Å; M570-D601 HydrophobicContact CE-CB 3.79Å; M570-V607 HydrophobicContact CE-CB 3.89Å; M570-V607 HydrophobicContact CE-CG1 4.36Å; M570-V607 WeakPolarHBondContact CE-O 3.21Å; M570-C608 PolarHBondContact N-O 2.85Å
571	D	87.4	Confident	91.2	Very high	61 Å²	61	58.5 Å²	58.5	33%	0.326	34%	0.338	S	S	.	.			trans	-128	102.3	169.3	-177.4	2.8	0	0	0	109.8	S573 Q574 C608	D571-S573 VanDerWaalsContact C-N 3.28Å; D571-S573 VanDerWaalsContact CG-OG 3.24Å; D571-S573 PolarHBondContact O-N 3.02Å; D571-S573 VanDerWaalsContact OD1-CB 3.24Å; D571-S573 WeakPolarHBondContact OD1-CB 3.37Å; D571-S573 PolarHBondContact OD1-N 3.1Å; D571-S573 PolarHBondContact OD1-OG 3.33Å; D571-S573 PolarHBondContact OD2-OG 2.84Å; D571-S573 VanDerWaalsContact OD2-OG 3.14Å; D571-Q574 WeakPolarHBondContact OD2-CG 3.28Å; D571-C608 PolarHBondContact N-O 2.95Å
572	G	82	Confident	91.1	Very high	67 Å²	67	57.7 Å²	57.7	69%	0.691	34%	0.335	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	3.7	177.6	0	0	0	0	0	114.7	V569	V569-G572 VanDerWaalsContact CG1-CA 3.48Å
573	S	84.3	Confident	91.2	Very high	84 Å²	84	58.6 Å²	58.6	59%	0.587	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	-22.6	173	73.3	0	0	0	0	112.9	D571	D571-S573 VanDerWaalsContact C-N 3.28Å; D571-S573 VanDerWaalsContact CG-OG 3.24Å; D571-S573 PolarHBondContact O-N 3.02Å; D571-S573 VanDerWaalsContact OD1-CB 3.24Å; D571-S573 WeakPolarHBondContact OD1-CB 3.37Å; D571-S573 PolarHBondContact OD1-N 3.1Å; D571-S573 PolarHBondContact OD1-OG 3.33Å; D571-S573 PolarHBondContact OD2-OG 2.84Å; D571-S573 VanDerWaalsContact OD2-OG 3.14Å
574	Q	78.5	Confident	91.3	Very high	84 Å²	84	57.3 Å²	57.3	39%	0.393	33%	0.33	S	S	.	.	S	Bend	trans	-90.2	134.3	-177.3	-55.5	-55.6	-43.7	0	0	111.4	D571 L576 C608	D571-Q574 WeakPolarHBondContact OD2-CG 3.28Å; Q574-L576 PolarHBondContact O-N 2.92Å; Q574-C608 HydrophobicContact CB-CB 4.36Å
575	P	82.3	Confident	91.3	Very high	110 Å²	110	54.1 Å²	54.1	71%	0.714	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-64.4	129.3	167.8	28.2	-32.9	0	0	0	109.4	D577	P575-D577 PolarHBondContact O-N 2.8Å
576	L	86.7	Confident	91.3	Very high	65 Å²	65	54.8 Å²	54.8	34%	0.34	32%	0.324	S	S	.	.	P	Polyproline II helix	trans	-71.4	122.4	176	-56.6	-172.7	0	0	0	109.3	L432 Q574 P578 C608 Y609	L432-L576 HydrophobicContact CD1-CD1 4.06Å; Q574-L576 PolarHBondContact O-N 2.92Å; L576-P578 WeakPolarHBondContact O-CD 3.41Å; L576-C608 HydrophobicContact CD2-CB 4.22Å; L576-C608 VanDerWaalsContact CD2-SG 3.54Å; L576-Y609 HydrophobicContact CD1-CD1 4.29Å; L576-Y609 HydrophobicContact CD1-CD2 4.13Å; L576-Y609 HydrophobicContact CD1-CG 3.85Å; L576-Y609 HydrophobicContact CD2-CG 4.49Å
577	D	87.2	Confident	91.3	Very high	54 Å²	54	54.3 Å²	54.3	29%	0.289	32%	0.32	S	S	.	.			trans	-103.6	111.7	178	179.8	-3	0	0	0	109.6	P575 R579 K580 T581	P575-D577 PolarHBondContact O-N 2.8Å; D577-R579 PolarHBondContact O-N 3.48Å; D577-R579 VanDerWaalsContact O-N 3.11Å; D577-R579 VanDerWaalsContact OD1-CB 3.28Å; D577-R579 WeakPolarHBondContact OD1-CB 3.41Å; D577-R579 PolarHBondContact OD1-N 3.04Å; D577-K580 HydrophobicContact CB-CB 4.35Å; D577-K580 HydrophobicContact CB-CG 4.45Å; D577-K580 PolarHBondContact O-N 2.86Å; D577-K580 VanDerWaalsContact OD2-CE 3.23Å; D577-K580 WeakPolarHBondContact OD2-CE 3.37Å; D577-T581 PolarHBondContact O-OG1 3.48Å
578	P	87.9	Confident	91.2	Very high	57 Å²	57	50.3 Å²	50.3	37%	0.37	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-55.1	-27.3	176.2	-28	37.6	0	0	0	113.7	L576 K580 T581 L662	L576-P578 WeakPolarHBondContact O-CD 3.41Å; P578-K580 VanDerWaalsContact C-N 3.35Å; P578-T581 WeakPolarHBondContact O-CB 3.31Å; P578-T581 PolarHBondContact O-N 2.86Å; P578-T581 PolarHBondContact O-OG1 2.9Å; P578-L662 HydrophobicContact CB-CD1 3.61Å; P578-L662 HydrophobicContact CB-CD2 3.9Å; P578-L662 HydrophobicContact CB-CG 4.38Å
579	R	91.5	Very high	91.1	Very high	85 Å²	85	52.2 Å²	52.2	32%	0.321	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-76.1	-18.9	179.3	-58.6	-173.4	60.5	150.9	3.7	114.1	D577 L662 D668	D577-R579 PolarHBondContact O-N 3.48Å; D577-R579 VanDerWaalsContact O-N 3.11Å; D577-R579 VanDerWaalsContact OD1-CB 3.28Å; D577-R579 WeakPolarHBondContact OD1-CB 3.41Å; D577-R579 PolarHBondContact OD1-N 3.04Å; R579-L662 HydrophobicContact CG-CD1 4.2Å; R579-D668 IonicContact CZ-OD1 2.71Å; R579-D668 VanDerWaalsContact CZ-OD1 3.24Å; R579-D668 IonicContact CZ-OD2 3.92Å; R579-D668 IonicContact NH1-OD1 2.65Å; R579-D668 PolarHBondContact NH1-OD1 3.43Å; R579-D668 IonicContact NH1-OD2 2.88Å; R579-D668 IonicContact NH2-OD1 2.83Å; R579-D668 PolarHBondContact NH2-OD1 3.46Å; R579-D668 IonicContact NH2-OD2 3.24Å; R579-D668 PolarHBondContact NH2-OD2 3.23Å
580	K	94.1	Very high	91	Very high	38 Å²	38	50.6 Å²	50.6	17%	0.165	30%	0.295	C	S	.	.	G	3₁₀ helix	trans	-99.2	19.9	172.8	-66.9	-179.2	-61	-170.1	0	112.3	D577 P578 F629 S630	D577-K580 HydrophobicContact CB-CB 4.35Å; D577-K580 HydrophobicContact CB-CG 4.45Å; D577-K580 PolarHBondContact O-N 2.86Å; D577-K580 VanDerWaalsContact OD2-CE 3.23Å; D577-K580 WeakPolarHBondContact OD2-CE 3.37Å; P578-K580 VanDerWaalsContact C-N 3.35Å; K580-F629 WeakPolarHBondContact CB-O 3.49Å; K580-F629 VanDerWaalsContact CE-O 3.32Å; K580-F629 WeakPolarHBondContact CE-O 3.24Å; K580-F629 PolarHBondContact O-N 3.23Å; K580-S630 PolarHBondContact NZ-O 2.82Å
581	T	95.8	Very high	91.1	Very high	15 Å²	15	47 Å²	47	9%	0.092	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	137.2	179.3	-57.9	0	0	0	0	111	D577 P578 R626 V627 A628 Y660	D577-T581 PolarHBondContact O-OG1 3.48Å; P578-T581 WeakPolarHBondContact O-CB 3.31Å; P578-T581 PolarHBondContact O-N 2.86Å; P578-T581 PolarHBondContact O-OG1 2.9Å; T581-R626 HydrophobicContact CG2-CB 4.16Å; T581-V627 CarbonylContact C-O 3.55Å; T581-V627 WeakPolarHBondContact CA-O 3.07Å; T581-A628 WeakPolarHBondContact OG1-CB 3.34Å; T581-Y660 HydrophobicContact CG2-CD2 4.22Å; T581-Y660 HydrophobicContact CG2-CG 4.02Å; T581-Y660 WeakPolarHBondContact O-CB 3.28Å; T581-Y660 PolarHBondContact O-N 3.06Å
582	I	96.6	Very high	91.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	148.4	170.8	68.1	169.2	0	0	0	110.4	V584 R626 V627 F629 Y635 A638 I639 V657 K658	I582-V584 HydrophobicContact CD1-CG2 3.88Å; I582-V584 HydrophobicContact CG1-CG2 4.06Å; I582-R626 CarbonylContact O-C 3.6Å; I582-R626 VanDerWaalsContact O-CA 3.23Å; I582-R626 WeakPolarHBondContact O-CA 3.29Å; I582-V627 HydrophobicContact CD1-CB 4.22Å; I582-V627 HydrophobicContact CG1-CB 3.85Å; I582-V627 WeakPolarHBondContact CG1-O 3.2Å; I582-V627 PolarHBondContact N-O 2.78Å; I582-V627 PolarHBondContact O-N 2.92Å; I582-F629 HydrophobicContact CD1-CE2 3.89Å; I582-F629 HydrophobicContact CD1-CZ 4.23Å; I582-F629 HydrophobicContact CG1-CE2 3.99Å; I582-F629 HydrophobicContact CG2-CD2 4.41Å; I582-F629 HydrophobicContact CG2-CE2 3.88Å; I582-Y635 HydrophobicContact CG2-CD2 3.66Å; I582-Y635 HydrophobicContact CG2-CE2 3.84Å; I582-A638 HydrophobicContact CD1-CB 4.08Å; I582-A638 HydrophobicContact CG2-CB 4.41Å; I582-I639 HydrophobicContact CB-CD1 4.16Å; I582-I639 HydrophobicContact CG2-CD1 3.48Å; I582-I639 VanDerWaalsContact CG2-CD1 3.48Å; I582-I639 HydrophobicContact CG2-CG1 4.03Å; I582-V657 HydrophobicContact CB-CG1 4.19Å; I582-V657 HydrophobicContact CD1-CG1 3.77Å; I582-V657 HydrophobicContact CD1-CG2 4.36Å; I582-V657 HydrophobicContact CG2-CG1 4.42Å; I582-K658 CarbonylContact C-O 3.44Å; I582-K658 WeakPolarHBondContact CA-O 3.33Å
583	F	96.8	Very high	92.3	Very high	62 Å²	62	45.5 Å²	45.5	27%	0.272	25%	0.246	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	139.1	162.3	176.7	-96	0	0	0	109.7	D613 A624 V657 K658 Y660	F583-D613 WeakPolarHBondContact CE2-OD2 3.23Å; F583-A624 HydrophobicContact CE2-CB 3.72Å; F583-A624 HydrophobicContact CZ-CB 3.59Å; F583-V657 WeakPolarHBondContact O-CA 3.23Å; F583-K658 HydrophobicContact CB-CB 4.45Å; F583-K658 HydrophobicContact CD1-CB 4.44Å; F583-K658 PolarHBondContact N-O 3.37Å; F583-K658 PolarHBondContact O-N 3.44Å; F583-Y660 HydrophobicContact CB-CD2 4.29Å
584	V	97.2	Very high	92.8	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	109.8	-179.1	-169.4	0	0	0	0	108.6	I582 V587 M600 A624 G625 V627 V655 E656	I582-V584 HydrophobicContact CD1-CG2 3.88Å; I582-V584 HydrophobicContact CG1-CG2 4.06Å; V584-V587 HydrophobicContact CB-CG2 4.09Å; V584-V587 HydrophobicContact CG1-CG2 3.73Å; V584-V587 WeakPolarHBondContact O-CG2 3.46Å; V584-M600 HydrophobicContact CG1-CE 3.89Å; V584-M600 HydrophobicContact CG2-CE 3.92Å; V584-A624 CarbonylContact O-C 3.57Å; V584-A624 WeakPolarHBondContact O-CA 3.09Å; V584-G625 PolarHBondContact N-O 2.83Å; V584-G625 PolarHBondContact O-N 2.79Å; V584-V627 HydrophobicContact CG2-CG2 4.13Å; V584-V655 HydrophobicContact CG1-CB 3.99Å; V584-V655 HydrophobicContact CG1-CG2 3.65Å; V584-E656 CarbonylContact C-O 3.51Å; V584-E656 WeakPolarHBondContact CA-O 3.33Å
585	G	96.7	Very high	93.7	Very high	14 Å²	14	40.8 Å²	40.8	14%	0.144	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	138.5	-177.5	0	0	0	0	0	113.2	V655 E656	G585-V655 WeakPolarHBondContact O-CA 3.39Å; G585-V655 VanDerWaalsContact O-CB 3.29Å; G585-V655 WeakPolarHBondContact O-CB 3.49Å; G585-E656 PolarHBondContact N-O 2.96Å; G585-E656 PolarHBondContact O-N 3.4Å
586	G	95.8	Very high	94.4	Very high	44 Å²	44	35.6 Å²	35.6	45%	0.454	18%	0.183	S	C	.	.	S	Bend	trans	94.2	10.9	179.8	0	0	0	0	0	114.8	G623	G586-G623 CarbonylContact C-O 3.58Å; G586-G623 WeakPolarHBondContact CA-O 3.45Å; G586-G623 PolarHBondContact N-O 2.85Å
587	V	96.4	Very high	94.9	Very high	6 Å²	6	32.5 Å²	32.5	4%	0.036	17%	0.167	C	C	.	.			trans	-53.7	134.6	179.4	179.4	0	0	0	0	110.9	V584 R589 L591 I612 G623	V584-V587 HydrophobicContact CB-CG2 4.09Å; V584-V587 HydrophobicContact CG1-CG2 3.73Å; V584-V587 WeakPolarHBondContact O-CG2 3.46Å; V587-R589 PolarHBondContact O-N 3.09Å; V587-L591 HydrophobicContact CG1-CB 4.04Å; V587-L591 HydrophobicContact CG1-CD2 3.67Å; V587-L591 HydrophobicContact CG1-CG 4.46Å; V587-I612 HydrophobicContact CG1-CD1 4.34Å; V587-G623 PolarHBondContact N-O 2.82Å; V587-G623 VanDerWaalsContact O-CA 3.23Å; V587-G623 WeakPolarHBondContact O-CA 3.49Å
588	P	94.2	Very high	95.3	Very high	2 Å²	2	35.8 Å²	35.8	1%	0.013	18%	0.182	C	C	.	.			trans	-58.5	131.9	173.7	-21	30.9	0	0	0	111.6	P590 L591 I651 K653	P588-P590 VanDerWaalsContact C-CD 3.42Å; P588-P590 VanDerWaalsContact C-N 3.27Å; P588-L591 HydrophobicContact CB-CB 4.26Å; P588-L591 VanDerWaalsContact O-CB 3.29Å; P588-L591 WeakPolarHBondContact O-CB 3.23Å; P588-L591 PolarHBondContact O-N 2.87Å; P588-I651 HydrophobicContact CB-CD1 4.41Å; P588-I651 HydrophobicContact CB-CG2 4.14Å; P588-I651 HydrophobicContact CG-CG2 3.97Å; P588-K653 HydrophobicContact CG-CD 4.33Å
589	R	93.4	Very high	95.6	Very high	105 Å²	105	35 Å²	35	40%	0.396	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-30.8	175.2	-85.6	-174.7	164.3	149.6	-1	115.4	V587 L591 P621	V587-R589 PolarHBondContact O-N 3.09Å; R589-L591 VanDerWaalsContact C-N 3.32Å; R589-P621 HydrophobicContact CG-CB 4.34Å; R589-P621 PolarHBondContact NE-O 3.22Å
590	P	93.2	Very high	95.8	Very high	34 Å²	34	30.9 Å²	30.9	22%	0.221	16%	0.159	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.5	-19.7	171.9	-27	38.6	0	0	0	115.8	P588 R592 I651	P588-P590 VanDerWaalsContact C-CD 3.42Å; P588-P590 VanDerWaalsContact C-N 3.27Å; P590-R592 PolarHBondContact O-N 3.25Å; P590-I651 HydrophobicContact CG-CD1 3.97Å
591	L	95	Very high	95.9	Very high	1 Å²	1	31.7 Å²	31.7	1%	0.005	17%	0.165	C	C	.	.			trans	-72.3	127.5	-169.7	-168.8	79.2	0	0	0	111	V587 P588 R589 E595 L596 I599 I612 L646 H648	V587-L591 HydrophobicContact CG1-CB 4.04Å; V587-L591 HydrophobicContact CG1-CD2 3.67Å; V587-L591 HydrophobicContact CG1-CG 4.46Å; P588-L591 HydrophobicContact CB-CB 4.26Å; P588-L591 VanDerWaalsContact O-CB 3.29Å; P588-L591 WeakPolarHBondContact O-CB 3.23Å; P588-L591 PolarHBondContact O-N 2.87Å; R589-L591 VanDerWaalsContact C-N 3.32Å; L591-E595 HydrophobicContact CD1-CB 3.61Å; L591-E595 HydrophobicContact CG-CB 4.16Å; L591-L596 HydrophobicContact CD2-CB 3.86Å; L591-L596 HydrophobicContact CD2-CD1 4.04Å; L591-L596 HydrophobicContact CD2-CG 4.47Å; L591-I599 HydrophobicContact CD1-CD1 4.23Å; L591-I612 WeakPolarHBondContact O-CD1 3.36Å; L591-L646 HydrophobicContact CD2-CD1 3.89Å; L591-H648 HydrophobicContact CD1-CB 3.79Å
592	R	96.2	Very high	95.9	Very high	96 Å²	96	41.9 Å²	41.9	36%	0.362	20%	0.202	S	C	.	.			trans	-89.3	156.3	179.6	-56.7	-178.1	-67.7	151.8	-2	111.2	W561 D565 P590 V594 E595 L596	W561-R592 HydrophobicContact CH2-CG 4.5Å; D565-R592 HydrophobicContact CB-CB 4Å; D565-R592 HydrophobicContact CB-CG 3.83Å; D565-R592 VanDerWaalsContact CG-CD 3.43Å; D565-R592 WeakPolarHBondContact OD1-CD 3.14Å; D565-R592 IonicContact OD1-NH1 2.9Å; P590-R592 PolarHBondContact O-N 3.25Å; R592-V594 HydrophobicContact CB-CG1 4.1Å; R592-V594 PolarHBondContact O-N 3.02Å; R592-E595 HydrophobicContact CB-CG 4.47Å; R592-E595 IonicContact CZ-OE1 2.62Å; R592-E595 PolarHBondContact N-OE2 3.03Å; R592-E595 IonicContact NE-OE1 2.66Å; R592-E595 PolarHBondContact NE-OE1 3.46Å; R592-E595 IonicContact NE-OE2 2.73Å; R592-E595 IonicContact NH2-OE1 3.8Å; R592-E595 PolarHBondContact NH2-OE1 3.26Å; R592-E595 PolarHBondContact O-N 2.97Å; R592-L596 PolarHBondContact O-N 3.05Å
593	A	97.6	Very high	95.8	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.224	C	C	.	.	H	α-helix	trans	-57.2	-37.3	-179.2	0	0	0	0	0	113	D565 D567 F568 E595 L596 A597 A610 I612	D565-A593 WeakPolarHBondContact O-CB 3.29Å; D565-A593 PolarHBondContact O-N 2.71Å; D567-A593 VanDerWaalsContact C-CB 3.48Å; F568-A593 HydrophobicContact CB-CB 3.78Å; A593-E595 PolarHBondContact O-N 2.97Å; A593-L596 PolarHBondContact O-N 2.6Å; A593-A597 PolarHBondContact O-N 3.14Å; A593-A610 WeakPolarHBondContact O-CB 3.34Å; A593-I612 HydrophobicContact CB-CG1 4.25Å
594	V	96.6	Very high	95.8	Very high	34 Å²	34	45.5 Å²	45.5	21%	0.206	22%	0.22	C	C	.	.	H	α-helix	trans	-61.9	-39.7	175.2	58.8	0	0	0	0	112.9	F568 R592 A597 M598	F568-V594 HydrophobicContact CB-CB 4.3Å; F568-V594 HydrophobicContact CD1-CB 4.19Å; F568-V594 HydrophobicContact CD1-CG2 4.26Å; F568-V594 HydrophobicContact CD2-CB 3.71Å; F568-V594 HydrophobicContact CD2-CG2 3.94Å; F568-V594 HydrophobicContact CE1-CB 4.45Å; F568-V594 HydrophobicContact CE1-CG2 4.02Å; F568-V594 HydrophobicContact CE2-CB 4.02Å; F568-V594 HydrophobicContact CE2-CG2 3.7Å; F568-V594 HydrophobicContact CG-CB 3.8Å; F568-V594 HydrophobicContact CG-CG2 4.21Å; F568-V594 HydrophobicContact CZ-CB 4.38Å; F568-V594 HydrophobicContact CZ-CG2 3.74Å; R592-V594 HydrophobicContact CB-CG1 4.1Å; R592-V594 PolarHBondContact O-N 3.02Å; V594-A597 PolarHBondContact O-N 3.06Å; V594-M598 HydrophobicContact CG2-SD 4.28Å; V594-M598 WeakPolarHBondContact O-CG 3.12Å; V594-M598 PolarHBondContact O-N 3.36Å
595	E	96	Very high	95.7	Very high	35 Å²	35	46.6 Å²	46.6	16%	0.164	23%	0.232	C	C	.	.	H	α-helix	trans	-72.2	-40	179.1	-66.4	155.2	178.6	0	0	110.8	L591 R592 A593 A597 M598 I599 H648	L591-E595 HydrophobicContact CD1-CB 3.61Å; L591-E595 HydrophobicContact CG-CB 4.16Å; R592-E595 HydrophobicContact CB-CG 4.47Å; R592-E595 IonicContact CZ-OE1 2.62Å; R592-E595 PolarHBondContact N-OE2 3.03Å; R592-E595 IonicContact NE-OE1 2.66Å; R592-E595 PolarHBondContact NE-OE1 3.46Å; R592-E595 IonicContact NE-OE2 2.73Å; R592-E595 IonicContact NH2-OE1 3.8Å; R592-E595 PolarHBondContact NH2-OE1 3.26Å; R592-E595 PolarHBondContact O-N 2.97Å; A593-E595 PolarHBondContact O-N 2.97Å; E595-A597 VanDerWaalsContact C-N 3.34Å; E595-A597 PolarHBondContact O-N 2.8Å; E595-M598 PolarHBondContact O-N 2.84Å; E595-I599 WeakPolarHBondContact O-CD1 3.35Å; E595-I599 VanDerWaalsContact O-CG1 3.25Å; E595-I599 WeakPolarHBondContact O-CG1 3.41Å; E595-I599 PolarHBondContact O-N 2.89Å; E595-H648 IonicContact OE1-CE1 2.71Å; E595-H648 IonicContact OE2-CE1 3.62Å; E595-H648 PolarHBondContact OE2-CE1 3.28Å; E595-H648 IonicContact OE2-ND1 2.64Å; E595-H648 PolarHBondContact OE2-ND1 3.11Å
596	L	96.9	Very high	95.6	Very high	0 Å²	0	47 Å²	47	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-60.9	-42.1	173.3	-177.8	60.1	0	0	0	111.8	L591 R592 A593 M600 A610 I612 V627 L646	L591-L596 HydrophobicContact CD2-CB 3.86Å; L591-L596 HydrophobicContact CD2-CD1 4.04Å; L591-L596 HydrophobicContact CD2-CG 4.47Å; R592-L596 PolarHBondContact O-N 3.05Å; A593-L596 PolarHBondContact O-N 2.6Å; L596-M600 HydrophobicContact CD1-CE 4.18Å; L596-M600 HydrophobicContact CD1-CG 4.21Å; L596-M600 WeakPolarHBondContact O-CB 3.34Å; L596-M600 WeakPolarHBondContact O-CG 3.44Å; L596-M600 PolarHBondContact O-N 3.38Å; L596-M600 VanDerWaalsContact O-N 3.1Å; L596-A610 HydrophobicContact CG-CB 4.47Å; L596-I612 HydrophobicContact CD2-CD1 4.08Å; L596-V627 HydrophobicContact CD1-CG2 4.41Å; L596-V627 HydrophobicContact CD2-CG2 3.88Å; L596-V627 HydrophobicContact CG-CG2 3.84Å; L596-L646 HydrophobicContact CD1-CD1 4.06Å
597	A	96.8	Very high	95.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-61.6	-51.9	174.9	0	0	0	0	0	111.7	F568 A593 V594 E595 I599 M600 D601 V607 A610	F568-A597 HydrophobicContact CD1-CB 3.67Å; F568-A597 HydrophobicContact CE1-CB 4.13Å; A593-A597 PolarHBondContact O-N 3.14Å; V594-A597 PolarHBondContact O-N 3.06Å; E595-A597 VanDerWaalsContact C-N 3.34Å; E595-A597 PolarHBondContact O-N 2.8Å; A597-I599 VanDerWaalsContact C-N 3.35Å; A597-I599 PolarHBondContact O-N 2.95Å; A597-M600 PolarHBondContact O-N 2.84Å; A597-D601 WeakPolarHBondContact O-CB 3.48Å; A597-D601 PolarHBondContact O-N 3.4Å; A597-V607 HydrophobicContact CB-CG1 4.23Å; A597-A610 HydrophobicContact CB-CB 3.77Å
598	M	95.7	Very high	95.6	Very high	124 Å²	124	45 Å²	45	61%	0.611	22%	0.215	S	C	*	.	H	α-helix	trans	-61.3	-39.3	-178.5	-73.4	178.9	131.3	0	0	113	V594 E595 R602	V594-M598 HydrophobicContact CG2-SD 4.28Å; V594-M598 WeakPolarHBondContact O-CG 3.12Å; V594-M598 PolarHBondContact O-N 3.36Å; E595-M598 PolarHBondContact O-N 2.84Å; M598-R602 WeakPolarHBondContact O-CB 3.41Å; M598-R602 PolarHBondContact O-N 2.71Å; M598-R602 VanDerWaalsContact O-N 3.12Å
599	I	95.1	Very high	95.8	Very high	39 Å²	39	46 Å²	46	20%	0.2	22%	0.218	C	C	.	.	H	α-helix	trans	-68.2	-45.8	177.1	-65	163.4	0	0	0	110.6	L591 E595 A597 R602 L603 L646	L591-I599 HydrophobicContact CD1-CD1 4.23Å; E595-I599 WeakPolarHBondContact O-CD1 3.35Å; E595-I599 VanDerWaalsContact O-CG1 3.25Å; E595-I599 WeakPolarHBondContact O-CG1 3.41Å; E595-I599 PolarHBondContact O-N 2.89Å; A597-I599 VanDerWaalsContact C-N 3.35Å; A597-I599 PolarHBondContact O-N 2.95Å; I599-R602 PolarHBondContact O-N 3.37Å; I599-L603 HydrophobicContact CG2-CD1 3.97Å; I599-L603 VanDerWaalsContact O-CG 3.29Å; I599-L603 WeakPolarHBondContact O-CG 3.37Å; I599-L603 PolarHBondContact O-N 3.36Å; I599-L646 HydrophobicContact CB-CD2 4.32Å; I599-L646 HydrophobicContact CD1-CD2 4.42Å; I599-L646 HydrophobicContact CG2-CD2 3.55Å
600	M	95.7	Very high	96	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-68.9	-35.5	-179.2	-70.8	-63.8	-172.5	0	0	112.8	V584 L596 A597 L603 Y604 V607 V627 V644 L646 V657	V584-M600 HydrophobicContact CG1-CE 3.89Å; V584-M600 HydrophobicContact CG2-CE 3.92Å; L596-M600 HydrophobicContact CD1-CE 4.18Å; L596-M600 HydrophobicContact CD1-CG 4.21Å; L596-M600 WeakPolarHBondContact O-CB 3.34Å; L596-M600 WeakPolarHBondContact O-CG 3.44Å; L596-M600 PolarHBondContact O-N 3.38Å; L596-M600 VanDerWaalsContact O-N 3.1Å; A597-M600 PolarHBondContact O-N 2.84Å; M600-L603 PolarHBondContact O-N 2.82Å; M600-Y604 PolarHBondContact O-N 2.91Å; M600-Y604 HydrophobicContact SD-CD2 4.19Å; M600-Y604 HydrophobicContact SD-CE2 3.93Å; M600-V607 HydrophobicContact CB-CG2 3.97Å; M600-V627 HydrophobicContact CB-CG1 4.24Å; M600-V627 HydrophobicContact CG-CG1 4.48Å; M600-V627 HydrophobicContact CG-CG2 4.24Å; M600-V644 HydrophobicContact CE-CB 4.31Å; M600-V644 HydrophobicContact CE-CG1 4.22Å; M600-V644 HydrophobicContact CE-CG2 4.21Å; M600-V644 HydrophobicContact SD-CG1 4.3Å; M600-V644 HydrophobicContact SD-CG2 4.35Å; M600-L646 HydrophobicContact CE-CD2 4.31Å; M600-V657 HydrophobicContact CE-CG2 4.29Å
601	D	95.8	Very high	96.1	Very high	55 Å²	55	39.3 Å²	39.3	29%	0.294	19%	0.189	S	C	.	.	H	α-helix	trans	-68.3	-40.6	175.6	-163.9	70.5	0	0	0	111.8	M570 A597 L603 Y604 G605 G606 V607	M570-D601 HydrophobicContact CE-CB 3.79Å; A597-D601 WeakPolarHBondContact O-CB 3.48Å; A597-D601 PolarHBondContact O-N 3.4Å; D601-L603 PolarHBondContact O-N 2.94Å; D601-L603 VanDerWaalsContact O-N 3.15Å; D601-Y604 PolarHBondContact O-N 3.31Å; D601-G605 WeakPolarHBondContact O-CA 3.33Å; D601-G605 PolarHBondContact O-N 3.43Å; D601-G605 WeakPolarHBondContact OD1-CA 3.25Å; D601-G606 PolarHBondContact OD1-N 3.25Å; D601-V607 HydrophobicContact CB-CB 4.06Å; D601-V607 HydrophobicContact CB-CG2 3.95Å; D601-V607 PolarHBondContact OD1-N 2.96Å
602	R	95.5	Very high	96.3	Very high	229 Å²	229	39.5 Å²	39.5	86%	0.864	19%	0.19	S	C	*	.	H	α-helix	trans	-60.6	-24.5	173.3	-173.7	175.5	179.3	-168.8	-0.2	113.3	M598 I599	M598-R602 WeakPolarHBondContact O-CB 3.41Å; M598-R602 PolarHBondContact O-N 2.71Å; M598-R602 VanDerWaalsContact O-N 3.12Å; I599-R602 PolarHBondContact O-N 3.37Å
603	L	95	Very high	96.3	Very high	90 Å²	90	36.6 Å²	36.6	47%	0.471	18%	0.181	S	C	.	.	H	α-helix	trans	-94.3	-35.1	-178.7	-69.2	169.9	0	0	0	114.1	I599 M600 D601 V644	I599-L603 HydrophobicContact CG2-CD1 3.97Å; I599-L603 VanDerWaalsContact O-CG 3.29Å; I599-L603 WeakPolarHBondContact O-CG 3.37Å; I599-L603 PolarHBondContact O-N 3.36Å; M600-L603 PolarHBondContact O-N 2.82Å; D601-L603 PolarHBondContact O-N 2.94Å; D601-L603 VanDerWaalsContact O-N 3.15Å; L603-V644 HydrophobicContact CD1-CG1 3.44Å; L603-V644 VanDerWaalsContact CD1-CG1 3.44Å
604	Y	96.4	Very high	96.2	Very high	47 Å²	47	38.8 Å²	38.8	18%	0.184	20%	0.195	C	C	.	.	H	α-helix	trans	-130.6	-13.6	-170.8	-57	-64.7	0	0	0	114.8	M600 D601 F629 S634 A637 A638 A641 V644	M600-Y604 PolarHBondContact O-N 2.91Å; M600-Y604 HydrophobicContact SD-CD2 4.19Å; M600-Y604 HydrophobicContact SD-CE2 3.93Å; D601-Y604 PolarHBondContact O-N 3.31Å; Y604-F629 HydrophobicContact CD2-CZ 4.44Å; Y604-S634 WeakPolarHBondContact O-CB 3.28Å; Y604-S634 PolarHBondContact O-OG 3.43Å; Y604-A637 HydrophobicContact CD1-CB 3.79Å; Y604-A637 HydrophobicContact CE1-CB 4.39Å; Y604-A638 HydrophobicContact CD1-CB 4.31Å; Y604-A638 HydrophobicContact CD2-CB 3.84Å; Y604-A638 HydrophobicContact CE1-CB 4.39Å; Y604-A638 HydrophobicContact CE2-CB 3.92Å; Y604-A638 HydrophobicContact CG-CB 4.04Å; Y604-A641 HydrophobicContact CE1-CB 4.34Å; Y604-A641 WeakPolarHBondContact OH-CB 3.45Å; Y604-V644 HydrophobicContact CE2-CG2 4.04Å; Y604-V644 VanDerWaalsContact OH-CG2 3.28Å; Y604-V644 WeakPolarHBondContact OH-CG2 3.48Å
605	G	95.6	Very high	96	Very high	24 Å²	24	39 Å²	39	25%	0.247	20%	0.195	C	C	.	.	S	Bend	trans	62.3	169.3	-172.5	0	0	0	0	0	114.2	D601 V607 F629 S634	D601-G605 WeakPolarHBondContact O-CA 3.33Å; D601-G605 PolarHBondContact O-N 3.43Å; D601-G605 WeakPolarHBondContact OD1-CA 3.25Å; G605-V607 VanDerWaalsContact C-N 3.3Å; G605-V607 PolarHBondContact O-N 3.48Å; G605-F629 WeakPolarHBondContact O-CD1 3.06Å; G605-S634 WeakPolarHBondContact O-CB 3.46Å; G605-S634 PolarHBondContact O-OG 3.44Å
606	G	94.9	Very high	95.8	Very high	21 Å²	21	42 Å²	42	22%	0.216	22%	0.217	C	C	.	.			trans	63.9	28.3	169.6	0	0	0	0	0	114.7	D601 F629 S630	D601-G606 PolarHBondContact OD1-N 3.25Å; G606-F629 CarbonylContact O-C 3.52Å; G606-F629 VanDerWaalsContact O-CA 3.27Å; G606-F629 WeakPolarHBondContact O-CA 3.45Å; G606-S630 PolarHBondContact O-N 3.42Å; G606-S630 PolarHBondContact O-OG 3.37Å; G606-S630 VanDerWaalsContact O-OG 3.07Å
607	V	96.6	Very high	95.5	Very high	6 Å²	6	45.8 Å²	45.8	4%	0.036	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.2	132.4	166.4	174.8	0	0	0	0	108.5	M570 A597 M600 D601 G605 V627 F629	M570-V607 HydrophobicContact CE-CB 3.89Å; M570-V607 HydrophobicContact CE-CG1 4.36Å; M570-V607 WeakPolarHBondContact CE-O 3.21Å; A597-V607 HydrophobicContact CB-CG1 4.23Å; M600-V607 HydrophobicContact CB-CG2 3.97Å; D601-V607 HydrophobicContact CB-CB 4.06Å; D601-V607 HydrophobicContact CB-CG2 3.95Å; D601-V607 PolarHBondContact OD1-N 2.96Å; G605-V607 VanDerWaalsContact C-N 3.3Å; G605-V607 PolarHBondContact O-N 3.48Å; V607-V627 HydrophobicContact CB-CG1 4.45Å; V607-V627 HydrophobicContact CG1-CG1 3.72Å; V607-V627 HydrophobicContact CG2-CG1 3.87Å; V607-F629 HydrophobicContact CG2-CD1 3.92Å; V607-F629 HydrophobicContact CG2-CE1 3.54Å; V607-F629 HydrophobicContact CG2-CZ 4.29Å
608	C	95.9	Very high	95.3	Very high	2 Å²	2	47.1 Å²	47.1	1%	0.014	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	-29.5	170.3	54.7	0	0	0	0	112.5	M570 D571 Q574 L576 A628	M570-C608 PolarHBondContact N-O 2.85Å; D571-C608 PolarHBondContact N-O 2.95Å; Q574-C608 HydrophobicContact CB-CB 4.36Å; L576-C608 HydrophobicContact CD2-CB 4.22Å; L576-C608 VanDerWaalsContact CD2-SG 3.54Å; C608-A628 PolarHBondContact N-O 3.1Å; C608-A628 PolarHBondContact SG-O 2.82Å
609	Y	97.2	Very high	95.2	Very high	23 Å²	23	45.4 Å²	45.4	9%	0.09	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	146.5	-177	168.8	-97.6	0	0	0	112.1	D567 F568 V569 L576 R626 V627 A628	D567-Y609 HydrophobicContact CB-CE2 4.03Å; F568-Y609 WeakPolarHBondContact O-CA 3.09Å; F568-Y609 VanDerWaalsContact O-CD2 3.28Å; F568-Y609 WeakPolarHBondContact O-CD2 3.46Å; V569-Y609 HydrophobicContact CG2-CD2 3.84Å; V569-Y609 HydrophobicContact CG2-CE2 4.44Å; L576-Y609 HydrophobicContact CD1-CD1 4.29Å; L576-Y609 HydrophobicContact CD1-CD2 4.13Å; L576-Y609 HydrophobicContact CD1-CG 3.85Å; L576-Y609 HydrophobicContact CD2-CG 4.49Å; Y609-R626 HydrophobicContact CE1-CG 4.26Å; Y609-R626 PolarHBondContact OH-NH2 3.36Å; Y609-V627 CarbonylContact O-C 3.58Å; Y609-V627 WeakPolarHBondContact O-CA 3.11Å; Y609-A628 HydrophobicContact CD1-CB 4.38Å; Y609-A628 PolarHBondContact N-O 2.88Å; Y609-A628 PolarHBondContact O-N 2.83Å
610	A	97.6	Very high	95.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	154	163.8	0	0	0	0	0	111.1	F568 A593 L596 A597 R626 V627	F568-A610 PolarHBondContact N-O 3.28Å; F568-A610 PolarHBondContact O-N 2.9Å; A593-A610 WeakPolarHBondContact O-CB 3.34Å; L596-A610 HydrophobicContact CG-CB 4.47Å; A597-A610 HydrophobicContact CB-CB 3.77Å; A610-R626 CarbonylContact C-O 3.57Å; A610-R626 WeakPolarHBondContact CA-O 3.37Å; A610-V627 HydrophobicContact CB-CG2 4.01Å
611	G	97.1	Very high	95.3	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	147.5	171.5	0	0	0	0	0	111.9	S566 G625 R626	S566-G611 CarbonylContact O-C 3.51Å; S566-G611 VanDerWaalsContact O-CA 3.31Å; S566-G611 WeakPolarHBondContact O-CA 3.5Å; G611-G625 CarbonylContact O-C 3.59Å; G611-G625 WeakPolarHBondContact O-CA 3.44Å; G611-R626 PolarHBondContact N-O 2.96Å; G611-R626 PolarHBondContact O-N 2.94Å
612	I	97.8	Very high	95.2	Very high	4 Å²	4	47.3 Å²	47.3	2%	0.021	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	141.7	169.7	-54.8	-55.5	0	0	0	108.2	W561 S566 V587 L591 A593 L596 P621 R626	W561-I612 HydrophobicContact CH2-CG1 4.24Å; W561-I612 HydrophobicContact CZ2-CB 4.39Å; W561-I612 HydrophobicContact CZ2-CG1 4.23Å; W561-I612 HydrophobicContact CZ2-CG2 4.39Å; S566-I612 PolarHBondContact O-N 3.39Å; V587-I612 HydrophobicContact CG1-CD1 4.34Å; L591-I612 WeakPolarHBondContact O-CD1 3.36Å; A593-I612 HydrophobicContact CB-CG1 4.25Å; L596-I612 HydrophobicContact CD2-CD1 4.08Å; I612-P621 HydrophobicContact CG2-CB 3.95Å; I612-P621 HydrophobicContact CG2-CG 4.22Å; I612-R626 PolarHBondContact O-NH1 2.97Å
613	D	96.3	Very high	95.2	Very high	35 Å²	35	37.2 Å²	37.2	19%	0.187	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	111.5	174.6	-73.6	0.6	0	0	0	108.9	F583 K622 A624 R626	F583-D613 WeakPolarHBondContact CE2-OD2 3.23Å; D613-K622 WeakPolarHBondContact O-CB 3.44Å; D613-K622 PolarHBondContact O-N 3.12Å; D613-A624 HydrophobicContact CB-CB 4.14Å; D613-A624 PolarHBondContact N-O 3.01Å; D613-R626 IonicContact OD1-CZ 3.2Å; D613-R626 IonicContact OD1-NH1 3.66Å; D613-R626 PolarHBondContact OD1-NH1 2.92Å
614	T	95.7	Very high	95.3	Very high	46 Å²	46	33.5 Å²	33.5	28%	0.282	19%	0.185	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	171.8	-176.6	52.9	0	0	0	0	112.1	Y620	T614-Y620 CarbonylContact C-O 3.57Å; T614-Y620 VanDerWaalsContact CA-O 3.29Å; T614-Y620 WeakPolarHBondContact CA-O 3.45Å
615	D	92.6	Very high	95.3	Very high	39 Å²	39	31.3 Å²	31.3	21%	0.209	18%	0.176	C	C	.	.			trans	-80.2	134.2	171.8	-170.6	-99.3	0	0	0	113	E617 L618 K619 Y620 K622	D615-E617 VanDerWaalsContact C-N 3.32Å; D615-E617 PolarHBondContact O-N 3.42Å; D615-E617 WeakPolarHBondContact OD1-CB 3.38Å; D615-E617 PolarHBondContact OD1-N 2.73Å; D615-L618 HydrophobicContact CB-CB 4.44Å; D615-L618 PolarHBondContact OD1-N 3.33Å; D615-K619 WeakPolarHBondContact O-CA 3.29Å; D615-K619 PolarHBondContact O-N 3.07Å; D615-Y620 PolarHBondContact N-O 3.4Å; D615-K622 WeakPolarHBondContact OD2-CE 3.42Å; D615-K622 IonicContact OD2-NZ 3.76Å; D615-K622 PolarHBondContact OD2-NZ 2.91Å
616	P	91.5	Very high	95.4	Very high	97 Å²	97	32.1 Å²	32.1	63%	0.63	17%	0.172	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-32.3	178.6	-26.7	35.8	0	0	0	115.4
617	E	90.6	Very high	95.5	Very high	81 Å²	81	31.1 Å²	31.1	38%	0.379	16%	0.161	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-41.5	-175.9	-177.5	-178	-177.4	0	0	111.7	R472 D615	R472-E617 PolarHBondContact NH2-O 3.48Å; D615-E617 VanDerWaalsContact C-N 3.32Å; D615-E617 PolarHBondContact O-N 3.42Å; D615-E617 WeakPolarHBondContact OD1-CB 3.38Å; D615-E617 PolarHBondContact OD1-N 2.73Å
618	L	92.3	Very high	95.5	Very high	28 Å²	28	30.9 Å²	30.9	15%	0.147	16%	0.16	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104	-10.1	-174.4	-60.5	178.4	0	0	0	114.1	S471 R472 K473 L521 D615 Y620	S471-L618 WeakPolarHBondContact CB-O 3.35Å; S471-L618 PolarHBondContact OG-O 3.3Å; R472-L618 HydrophobicContact CB-CD2 4.49Å; K473-L618 HydrophobicContact CB-CB 4.34Å; K473-L618 HydrophobicContact CB-CD1 4.31Å; K473-L618 HydrophobicContact CD-CD1 3.97Å; L521-L618 HydrophobicContact CD2-CD1 3.79Å; L521-L618 HydrophobicContact CG-CD1 4.23Å; D615-L618 HydrophobicContact CB-CB 4.44Å; D615-L618 PolarHBondContact OD1-N 3.33Å; L618-Y620 PolarHBondContact O-N 2.97Å
619	K	94	Very high	95.6	Very high	87 Å²	87	30.9 Å²	30.9	38%	0.378	16%	0.16	S	C	.	.			trans	55.4	29.1	-176.4	-57.6	178.2	-178.7	171.3	0	114	E468 L563 D615	E468-K619 IonicContact OE2-NZ 3.25Å; E468-K619 PolarHBondContact OE2-NZ 2.85Å; L563-K619 HydrophobicContact CD1-CD 3.95Å; L563-K619 HydrophobicContact CD2-CB 3.53Å; L563-K619 HydrophobicContact CD2-CD 4.31Å; D615-K619 WeakPolarHBondContact O-CA 3.29Å; D615-K619 PolarHBondContact O-N 3.07Å
620	Y	96	Very high	95.5	Very high	22 Å²	22	31.1 Å²	31.1	9%	0.086	17%	0.165	C	C	.	.			trans	-103.5	144	-175.1	-166.9	-96	0	0	0	113.3	S471 K473 F519 W561 T614 D615 L618 K622	S471-Y620 WeakPolarHBondContact OG-CB 3.49Å; K473-Y620 HydrophobicContact CB-CD2 3.79Å; K473-Y620 HydrophobicContact CB-CE2 4.49Å; K473-Y620 HydrophobicContact CB-CG 3.95Å; K473-Y620 HydrophobicContact CD-CD1 4.4Å; K473-Y620 HydrophobicContact CD-CG 4.35Å; K473-Y620 HydrophobicContact CG-CD2 4.11Å; K473-Y620 HydrophobicContact CG-CE2 4.43Å; K473-Y620 HydrophobicContact CG-CG 4.16Å; K473-Y620 WeakPolarHBondContact O-CD2 3.32Å; K473-Y620 VanDerWaalsContact O-CE2 3.25Å; K473-Y620 WeakPolarHBondContact O-CE2 3.27Å; F519-Y620 HydrophobicContact CE1-CE1 4.23Å; W561-Y620 HydrophobicContact CB-CD2 3.92Å; W561-Y620 HydrophobicContact CB-CE2 4Å; T614-Y620 CarbonylContact C-O 3.57Å; T614-Y620 VanDerWaalsContact CA-O 3.29Å; T614-Y620 WeakPolarHBondContact CA-O 3.45Å; D615-Y620 PolarHBondContact N-O 3.4Å; L618-Y620 PolarHBondContact O-N 2.97Å; Y620-K622 PolarHBondContact O-N 3.04Å
621	P	96.5	Very high	95.2	Very high	2 Å²	2	35.3 Å²	35.3	1%	0.013	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	129.5	-178.2	-29.1	36.5	0	0	0	116	W561 R589 I612	W561-P621 HydrophobicContact CD2-CG 3.32Å; W561-P621 VanDerWaalsContact CE2-CG 3.41Å; W561-P621 HydrophobicContact CE3-CG 3.48Å; W561-P621 VanDerWaalsContact CE3-CG 3.48Å; W561-P621 HydrophobicContact CG-CG 3.89Å; W561-P621 HydrophobicContact CH2-CG 3.8Å; W561-P621 HydrophobicContact CZ2-CG 3.67Å; W561-P621 HydrophobicContact CZ3-CG 3.71Å; R589-P621 HydrophobicContact CG-CB 4.34Å; R589-P621 PolarHBondContact NE-O 3.22Å; I612-P621 HydrophobicContact CG2-CB 3.95Å; I612-P621 HydrophobicContact CG2-CG 4.22Å
622	K	94.5	Very high	95.1	Very high	110 Å²	110	39.9 Å²	39.9	48%	0.478	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	-10.4	176.8	-73.2	-178.5	165.4	164.3	0	114.6	D613 D615 Y620	D613-K622 WeakPolarHBondContact O-CB 3.44Å; D613-K622 PolarHBondContact O-N 3.12Å; D615-K622 WeakPolarHBondContact OD2-CE 3.42Å; D615-K622 IonicContact OD2-NZ 3.76Å; D615-K622 PolarHBondContact OD2-NZ 2.91Å; Y620-K622 PolarHBondContact O-N 3.04Å
623	G	95.2	Very high	95	Very high	17 Å²	17	46.6 Å²	46.6	18%	0.175	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	85.5	30.4	-173.7	0	0	0	0	0	113.2	G586 V587	G586-G623 CarbonylContact C-O 3.58Å; G586-G623 WeakPolarHBondContact CA-O 3.45Å; G586-G623 PolarHBondContact N-O 2.85Å; V587-G623 PolarHBondContact N-O 2.82Å; V587-G623 VanDerWaalsContact O-CA 3.23Å; V587-G623 WeakPolarHBondContact O-CA 3.49Å
624	A	96.8	Very high	95	Very high	13 Å²	13	45.6 Å²	45.6	11%	0.107	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	171	170.5	0	0	0	0	0	109.4	F583 V584 D613	F583-A624 HydrophobicContact CE2-CB 3.72Å; F583-A624 HydrophobicContact CZ-CB 3.59Å; V584-A624 CarbonylContact O-C 3.57Å; V584-A624 WeakPolarHBondContact O-CA 3.09Å; D613-A624 HydrophobicContact CB-CB 4.14Å; D613-A624 PolarHBondContact N-O 3.01Å
625	G	97.1	Very high	95.1	Very high	0 Å²	0	43.7 Å²	43.7	0%	0	22%	0.223	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165	-178.7	174.2	0	0	0	0	0	112	V584 G611	V584-G625 PolarHBondContact N-O 2.83Å; V584-G625 PolarHBondContact O-N 2.79Å; G611-G625 CarbonylContact O-C 3.59Å; G611-G625 WeakPolarHBondContact O-CA 3.44Å
626	R	97	Very high	95.3	Very high	42 Å²	42	44 Å²	44	16%	0.158	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.6	141.6	-176.8	63.4	-161.2	175.3	-77.9	-10.3	110	T581 I582 Y609 A610 G611 I612 D613 Y660	T581-R626 HydrophobicContact CG2-CB 4.16Å; I582-R626 CarbonylContact O-C 3.6Å; I582-R626 VanDerWaalsContact O-CA 3.23Å; I582-R626 WeakPolarHBondContact O-CA 3.29Å; Y609-R626 HydrophobicContact CE1-CG 4.26Å; Y609-R626 PolarHBondContact OH-NH2 3.36Å; A610-R626 CarbonylContact C-O 3.57Å; A610-R626 WeakPolarHBondContact CA-O 3.37Å; G611-R626 PolarHBondContact N-O 2.96Å; G611-R626 PolarHBondContact O-N 2.94Å; I612-R626 PolarHBondContact O-NH1 2.97Å; D613-R626 IonicContact OD1-CZ 3.2Å; D613-R626 IonicContact OD1-NH1 3.66Å; D613-R626 PolarHBondContact OD1-NH1 2.92Å; R626-Y660 HydrophobicContact CB-CD2 4.43Å; R626-Y660 HydrophobicContact CB-CE2 4.41Å
627	V	97.3	Very high	95.6	Very high	0 Å²	0	41.1 Å²	41.1	0%	0	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	128.6	-179.4	-177.4	0	0	0	0	109	T581 I582 V584 L596 M600 V607 Y609 A610 F629	T581-V627 CarbonylContact C-O 3.55Å; T581-V627 WeakPolarHBondContact CA-O 3.07Å; I582-V627 HydrophobicContact CD1-CB 4.22Å; I582-V627 HydrophobicContact CG1-CB 3.85Å; I582-V627 WeakPolarHBondContact CG1-O 3.2Å; I582-V627 PolarHBondContact N-O 2.78Å; I582-V627 PolarHBondContact O-N 2.92Å; V584-V627 HydrophobicContact CG2-CG2 4.13Å; L596-V627 HydrophobicContact CD1-CG2 4.41Å; L596-V627 HydrophobicContact CD2-CG2 3.88Å; L596-V627 HydrophobicContact CG-CG2 3.84Å; M600-V627 HydrophobicContact CB-CG1 4.24Å; M600-V627 HydrophobicContact CG-CG1 4.48Å; M600-V627 HydrophobicContact CG-CG2 4.24Å; V607-V627 HydrophobicContact CB-CG1 4.45Å; V607-V627 HydrophobicContact CG1-CG1 3.72Å; V607-V627 HydrophobicContact CG2-CG1 3.87Å; Y609-V627 CarbonylContact O-C 3.58Å; Y609-V627 WeakPolarHBondContact O-CA 3.11Å; A610-V627 HydrophobicContact CB-CG2 4.01Å; V627-F629 HydrophobicContact CG1-CE2 4.42Å; V627-F629 HydrophobicContact CG1-CZ 4.31Å
628	A	97.1	Very high	95.9	Very high	1 Å²	1	37.3 Å²	37.3	1%	0.008	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	138.3	-179.7	0	0	0	0	0	110.9	T581 C608 Y609	T581-A628 WeakPolarHBondContact OG1-CB 3.34Å; C608-A628 PolarHBondContact N-O 3.1Å; C608-A628 PolarHBondContact SG-O 2.82Å; Y609-A628 HydrophobicContact CD1-CB 4.38Å; Y609-A628 PolarHBondContact N-O 2.88Å; Y609-A628 PolarHBondContact O-N 2.83Å
629	F	96.6	Very high	96.1	Very high	1 Å²	1	36.3 Å²	36.3	0%	0.004	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107	138.9	180	-63.6	-86.1	0	0	0	111.6	K580 I582 Y604 G605 G606 V607 V627 N631 S634 Y635 A638	K580-F629 WeakPolarHBondContact CB-O 3.49Å; K580-F629 VanDerWaalsContact CE-O 3.32Å; K580-F629 WeakPolarHBondContact CE-O 3.24Å; K580-F629 PolarHBondContact O-N 3.23Å; I582-F629 HydrophobicContact CD1-CE2 3.89Å; I582-F629 HydrophobicContact CD1-CZ 4.23Å; I582-F629 HydrophobicContact CG1-CE2 3.99Å; I582-F629 HydrophobicContact CG2-CD2 4.41Å; I582-F629 HydrophobicContact CG2-CE2 3.88Å; Y604-F629 HydrophobicContact CD2-CZ 4.44Å; G605-F629 WeakPolarHBondContact O-CD1 3.06Å; G606-F629 CarbonylContact O-C 3.52Å; G606-F629 VanDerWaalsContact O-CA 3.27Å; G606-F629 WeakPolarHBondContact O-CA 3.45Å; V607-F629 HydrophobicContact CG2-CD1 3.92Å; V607-F629 HydrophobicContact CG2-CE1 3.54Å; V607-F629 HydrophobicContact CG2-CZ 4.29Å; V627-F629 HydrophobicContact CG1-CE2 4.42Å; V627-F629 HydrophobicContact CG1-CZ 4.31Å; F629-N631 VanDerWaalsContact C-N 3.27Å; F629-S634 VanDerWaalsContact CD1-CB 3.46Å; F629-Y635 HydrophobicContact CD2-CD2 4.47Å; F629-A638 HydrophobicContact CE2-CB 3.92Å; F629-A638 HydrophobicContact CZ-CB 3.78Å
630	S	94.9	Very high	96.2	Very high	28 Å²	28	35 Å²	35	20%	0.196	19%	0.187	C	C	.	.	S	Bend	trans	-64.3	-37	167.5	58.7	0	0	0	0	111	K580 G606	K580-S630 PolarHBondContact NZ-O 2.82Å; G606-S630 PolarHBondContact O-N 3.42Å; G606-S630 PolarHBondContact O-OG 3.37Å; G606-S630 VanDerWaalsContact O-OG 3.07Å
631	N	92.9	Very high	96.1	Very high	88 Å²	88	36 Å²	36	47%	0.471	20%	0.201	S	C	.	.	S	Bend	trans	-108.8	132.8	-170.7	-66.2	-33.5	0	0	0	113.3	F629 Q633 S634 Y635	F629-N631 VanDerWaalsContact C-N 3.27Å; N631-Q633 PolarHBondContact O-N 3.07Å; N631-S634 PolarHBondContact O-N 3.27Å; N631-Y635 PolarHBondContact O-N 2.94Å
632	Q	94.3	Very high	96	Very high	97 Å²	97	43.6 Å²	43.6	45%	0.453	23%	0.229	S	C	.	.	H	α-helix	trans	-58.5	-34.7	175.8	-172.6	65.5	11.7	0	0	112.5	I636	Q632-I636 HydrophobicContact CG-CD1 3.94Å; Q632-I636 WeakPolarHBondContact O-CB 3.43Å; Q632-I636 WeakPolarHBondContact O-CG1 3.37Å; Q632-I636 PolarHBondContact O-N 2.94Å
633	Q	96.4	Very high	96.1	Very high	145 Å²	145	42.7 Å²	42.7	68%	0.678	23%	0.225	S	C	*	.	H	α-helix	trans	-64.6	-42.6	179.9	-171	64.7	14.7	0	0	112.2	N631 I636 A637	N631-Q633 PolarHBondContact O-N 3.07Å; Q633-I636 PolarHBondContact O-N 3.26Å; Q633-A637 WeakPolarHBondContact O-CB 3.38Å; Q633-A637 PolarHBondContact O-N 3.25Å
634	S	96.3	Very high	96.1	Very high	13 Å²	13	42.2 Å²	42.2	9%	0.091	22%	0.219	C	C	.	.	H	α-helix	trans	-68.6	-41.8	178.4	-58	0	0	0	0	111.8	Y604 G605 F629 N631 A637 A638	Y604-S634 WeakPolarHBondContact O-CB 3.28Å; Y604-S634 PolarHBondContact O-OG 3.43Å; G605-S634 WeakPolarHBondContact O-CB 3.46Å; G605-S634 PolarHBondContact O-OG 3.44Å; F629-S634 VanDerWaalsContact CD1-CB 3.46Å; N631-S634 PolarHBondContact O-N 3.27Å; S634-A637 PolarHBondContact O-N 3.27Å; S634-A638 PolarHBondContact O-N 3.12Å
635	Y	97.1	Very high	95.9	Very high	6 Å²	6	45.6 Å²	45.6	2%	0.024	23%	0.233	C	C	.	.	H	α-helix	trans	-56.3	-49.6	170.6	168.4	-110.3	0	0	0	111.8	I582 F629 N631 A637 A638 I639 L690	I582-Y635 HydrophobicContact CG2-CD2 3.66Å; I582-Y635 HydrophobicContact CG2-CE2 3.84Å; F629-Y635 HydrophobicContact CD2-CD2 4.47Å; N631-Y635 PolarHBondContact O-N 2.94Å; Y635-A637 PolarHBondContact O-N 2.93Å; Y635-A638 PolarHBondContact O-N 3.2Å; Y635-I639 HydrophobicContact CD2-CG1 4.2Å; Y635-I639 HydrophobicContact CE2-CD1 4.26Å; Y635-I639 HydrophobicContact CE2-CG1 3.81Å; Y635-I639 WeakPolarHBondContact O-CG1 3.15Å; Y635-I639 PolarHBondContact O-N 2.77Å; Y635-L690 HydrophobicContact CE1-CD1 3.95Å
636	I	96.8	Very high	95.6	Very high	45 Å²	45	45.6 Å²	45.6	23%	0.231	23%	0.233	C	C	.	.	H	α-helix	trans	-61	-42.2	177	-75	171.4	0	0	0	111.6	Q632 Q633 I639 S640 V687 L690	Q632-I636 HydrophobicContact CG-CD1 3.94Å; Q632-I636 WeakPolarHBondContact O-CB 3.43Å; Q632-I636 WeakPolarHBondContact O-CG1 3.37Å; Q632-I636 PolarHBondContact O-N 2.94Å; Q633-I636 PolarHBondContact O-N 3.26Å; I636-I639 PolarHBondContact O-N 2.78Å; I636-S640 VanDerWaalsContact O-CB 3.27Å; I636-S640 WeakPolarHBondContact O-CB 3.23Å; I636-S640 PolarHBondContact O-N 3.45Å; I636-S640 PolarHBondContact O-OG 3.15Å; I636-V687 HydrophobicContact CG2-CG1 3.96Å; I636-L690 HydrophobicContact CG1-CD1 3.95Å
637	A	97.2	Very high	95.2	Very high	38 Å²	38	49.9 Å²	49.9	31%	0.314	26%	0.255	S	S	.	.	H	α-helix	trans	-62.6	-44.5	178.6	0	0	0	0	0	112.1	Y604 Q633 S634 Y635 S640 A641	Y604-A637 HydrophobicContact CD1-CB 3.79Å; Y604-A637 HydrophobicContact CE1-CB 4.39Å; Q633-A637 WeakPolarHBondContact O-CB 3.38Å; Q633-A637 PolarHBondContact O-N 3.25Å; S634-A637 PolarHBondContact O-N 3.27Å; Y635-A637 PolarHBondContact O-N 2.93Å; A637-S640 PolarHBondContact O-N 3.33Å; A637-A641 PolarHBondContact O-N 3.11Å; A637-A641 VanDerWaalsContact O-N 3.16Å
638	A	97	Very high	94.4	Very high	0 Å²	0	52.1 Å²	52.1	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-63.9	-45.6	177.7	0	0	0	0	0	112.4	I582 Y604 F629 S634 Y635 S640 A641 V657	I582-A638 HydrophobicContact CD1-CB 4.08Å; I582-A638 HydrophobicContact CG2-CB 4.41Å; Y604-A638 HydrophobicContact CD1-CB 4.31Å; Y604-A638 HydrophobicContact CD2-CB 3.84Å; Y604-A638 HydrophobicContact CE1-CB 4.39Å; Y604-A638 HydrophobicContact CE2-CB 3.92Å; Y604-A638 HydrophobicContact CG-CB 4.04Å; F629-A638 HydrophobicContact CE2-CB 3.92Å; F629-A638 HydrophobicContact CZ-CB 3.78Å; S634-A638 PolarHBondContact O-N 3.12Å; Y635-A638 PolarHBondContact O-N 3.2Å; A638-S640 VanDerWaalsContact C-N 3.32Å; A638-S640 PolarHBondContact O-N 3.01Å; A638-A641 PolarHBondContact O-N 2.64Å; A638-V657 WeakPolarHBondContact O-CG1 3.42Å
639	I	96.3	Very high	93.8	Very high	7 Å²	7	56 Å²	56	4%	0.036	31%	0.305	C	S	.	.	H	α-helix	trans	-63.6	-37.3	175.1	-64.4	-50.9	0	0	0	112	I582 Y635 I636 A641 R642 V657 P659 V687 L690	I582-I639 HydrophobicContact CB-CD1 4.16Å; I582-I639 HydrophobicContact CG2-CD1 3.48Å; I582-I639 VanDerWaalsContact CG2-CD1 3.48Å; I582-I639 HydrophobicContact CG2-CG1 4.03Å; Y635-I639 HydrophobicContact CD2-CG1 4.2Å; Y635-I639 HydrophobicContact CE2-CD1 4.26Å; Y635-I639 HydrophobicContact CE2-CG1 3.81Å; Y635-I639 WeakPolarHBondContact O-CG1 3.15Å; Y635-I639 PolarHBondContact O-N 2.77Å; I636-I639 PolarHBondContact O-N 2.78Å; I639-A641 VanDerWaalsContact C-N 3.31Å; I639-A641 PolarHBondContact O-N 2.64Å; I639-R642 WeakPolarHBondContact O-CG 3.42Å; I639-R642 PolarHBondContact O-N 2.95Å; I639-V657 HydrophobicContact CD1-CG1 3.96Å; I639-P659 HydrophobicContact CD1-CB 4.33Å; I639-P659 HydrophobicContact CD1-CG 3.82Å; I639-P659 VanDerWaalsContact CD1-N 3.33Å; I639-P659 HydrophobicContact CG1-CG 4.23Å; I639-P659 HydrophobicContact CG2-CG 4.06Å; I639-V687 HydrophobicContact CG2-CG2 4.26Å; I639-L690 HydrophobicContact CG2-CD2 4.11Å
640	S	96	Very high	93.3	Very high	59 Å²	59	65.1 Å²	65.1	41%	0.413	35%	0.348	S	S	.	.	H	α-helix	trans	-65	-34.1	179.9	-61.5	0	0	0	0	112.7	I636 A637 A638	I636-S640 VanDerWaalsContact O-CB 3.27Å; I636-S640 WeakPolarHBondContact O-CB 3.23Å; I636-S640 PolarHBondContact O-N 3.45Å; I636-S640 PolarHBondContact O-OG 3.15Å; A637-S640 PolarHBondContact O-N 3.33Å; A638-S640 VanDerWaalsContact C-N 3.32Å; A638-S640 PolarHBondContact O-N 3.01Å
641	A	95.7	Very high	92.9	Very high	45 Å²	45	65.7 Å²	65.7	37%	0.372	35%	0.348	S	S	.	.	H	α-helix	trans	-67.5	-34	177.6	0	0	0	0	0	113.2	Y604 A637 A638 I639 F643	Y604-A641 HydrophobicContact CE1-CB 4.34Å; Y604-A641 WeakPolarHBondContact OH-CB 3.45Å; A637-A641 PolarHBondContact O-N 3.11Å; A637-A641 VanDerWaalsContact O-N 3.16Å; A638-A641 PolarHBondContact O-N 2.64Å; I639-A641 VanDerWaalsContact C-N 3.31Å; I639-A641 PolarHBondContact O-N 2.64Å; A641-F643 PolarHBondContact O-N 2.84Å
642	R	94.6	Very high	92.8	Very high	161 Å²	161	65.8 Å²	65.8	61%	0.608	35%	0.349	S	S	*	.			trans	58.9	-25	-175.5	-57.7	177.8	176.7	171.5	-0.7	116.7	I639 V657	I639-R642 WeakPolarHBondContact O-CG 3.42Å; I639-R642 PolarHBondContact O-N 2.95Å; R642-V657 PolarHBondContact O-N 3.05Å
643	F	96.2	Very high	92.8	Very high	90 Å²	90	64.7 Å²	64.7	40%	0.395	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	142.3	176.9	-63.5	-86.7	0	0	0	109.9	A641 R654 V655 E656	A641-F643 PolarHBondContact O-N 2.84Å; F643-R654 HydrophobicContact CB-CG 4.1Å; F643-R654 HydrophobicContact CD1-CG 4.14Å; F643-R654 HydrophobicContact CG-CG 4.49Å; F643-R654 VanDerWaalsContact CG-NH2 3.3Å; F643-V655 VanDerWaalsContact CA-O 3.22Å; F643-V655 WeakPolarHBondContact CA-O 3.46Å; F643-E656 HydrophobicContact CD1-CB 4.27Å; F643-E656 HydrophobicContact CD1-CG 4.43Å; F643-E656 HydrophobicContact CE1-CB 4.14Å; F643-E656 HydrophobicContact CE1-CG 4.03Å
644	V	94.3	Very high	92.7	Very high	7 Å²	7	65.5 Å²	65.5	4%	0.042	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	145	179	176.9	0	0	0	0	108.4	M600 L603 Y604 L646 R654 V655 V657	M600-V644 HydrophobicContact CE-CB 4.31Å; M600-V644 HydrophobicContact CE-CG1 4.22Å; M600-V644 HydrophobicContact CE-CG2 4.21Å; M600-V644 HydrophobicContact SD-CG1 4.3Å; M600-V644 HydrophobicContact SD-CG2 4.35Å; L603-V644 HydrophobicContact CD1-CG1 3.44Å; L603-V644 VanDerWaalsContact CD1-CG1 3.44Å; Y604-V644 HydrophobicContact CE2-CG2 4.04Å; Y604-V644 VanDerWaalsContact OH-CG2 3.28Å; Y604-V644 WeakPolarHBondContact OH-CG2 3.48Å; V644-L646 HydrophobicContact CG1-CD2 3.92Å; V644-R654 CarbonylContact O-C 3.57Å; V644-R654 WeakPolarHBondContact O-CA 3.22Å; V644-V655 HydrophobicContact CB-CG2 3.78Å; V644-V655 HydrophobicContact CG1-CG2 4.48Å; V644-V655 PolarHBondContact N-O 3.37Å; V644-V655 WeakPolarHBondContact O-CG2 3.35Å; V644-V655 PolarHBondContact O-N 3.36Å; V644-V657 HydrophobicContact CB-CG2 4.48Å; V644-V657 HydrophobicContact CG2-CG2 3.73Å
645	Q	92.2	Very high	92.7	Very high	84 Å²	84	65 Å²	65	39%	0.393	34%	0.335	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	114.9	169.8	-159.6	71.3	13.9	0	0	108.7	D652 R654	Q645-D652 WeakPolarHBondContact CG-OD1 3.33Å; Q645-D652 PolarHBondContact NE2-OD1 2.95Å; Q645-D652 PolarHBondContact NE2-OD2 3.26Å; Q645-R654 VanDerWaalsContact OE1-CB 3.28Å
646	L	91.8	Very high	92.7	Very high	0 Å²	0	67.9 Å²	67.9	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	119.1	171.8	-60.6	-173	0	0	0	109.2	L591 L596 I599 M600 V644 K653 V655	L591-L646 HydrophobicContact CD2-CD1 3.89Å; L596-L646 HydrophobicContact CD1-CD1 4.06Å; I599-L646 HydrophobicContact CB-CD2 4.32Å; I599-L646 HydrophobicContact CD1-CD2 4.42Å; I599-L646 HydrophobicContact CG2-CD2 3.55Å; M600-L646 HydrophobicContact CE-CD2 4.31Å; V644-L646 HydrophobicContact CG1-CD2 3.92Å; L646-K653 PolarHBondContact N-O 3.23Å; L646-K653 PolarHBondContact O-N 3.05Å; L646-V655 HydrophobicContact CB-CG1 4.48Å; L646-V655 HydrophobicContact CD1-CB 4.38Å; L646-V655 HydrophobicContact CD1-CG1 3.54Å; L646-V655 HydrophobicContact CD1-CG2 3.96Å; L646-V655 HydrophobicContact CD2-CG2 4.44Å; L646-V655 HydrophobicContact CG-CB 4.49Å; L646-V655 HydrophobicContact CG-CG1 3.85Å; L646-V655 HydrophobicContact CG-CG2 3.79Å
647	Q	87.3	Confident	92.8	Very high	133 Å²	133	66 Å²	66	62%	0.621	34%	0.34	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.2	122.3	173.1	-73.2	175.2	-8	0	0	108.9	I651 D652	Q647-I651 WeakPolarHBondContact CA-O 3.44Å; Q647-D652 HydrophobicContact CG-CB 4.26Å; Q647-D652 WeakPolarHBondContact CG-OD1 3.41Å; Q647-D652 PolarHBondContact NE2-OD1 3.25Å
648	H	81.8	Confident	92.7	Very high	47 Å²	47	68.2 Å²	68.2	22%	0.218	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	104.5	178.6	171.2	93.4	0	0	0	109.1	L591 E595 E650 I651	L591-H648 HydrophobicContact CD1-CB 3.79Å; E595-H648 IonicContact OE1-CE1 2.71Å; E595-H648 IonicContact OE2-CE1 3.62Å; E595-H648 PolarHBondContact OE2-CE1 3.28Å; E595-H648 IonicContact OE2-ND1 2.64Å; E595-H648 PolarHBondContact OE2-ND1 3.11Å; H648-E650 PolarHBondContact O-N 2.94Å; H648-I651 PolarHBondContact N-O 3Å; H648-I651 WeakPolarHBondContact O-CB 3.41Å; H648-I651 PolarHBondContact O-N 2.79Å
649	G	84.1	Confident	92.5	Very high	83 Å²	83	68.9 Å²	68.9	86%	0.856	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.4	-127.7	-171.5	0	0	0	0	0	111.3	I651	G649-I651 VanDerWaalsContact C-N 3.25Å; G649-I651 PolarHBondContact O-N 2.82Å
650	E	86.6	Confident	92.4	Very high	191 Å²	191	71.8 Å²	71.8	89%	0.893	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73	-10.3	174.4	65.5	-173.8	177.3	0	0	114.5	H648	H648-E650 PolarHBondContact O-N 2.94Å
651	I	86.4	Confident	92.1	Very high	40 Å²	40	71.3 Å²	71.3	21%	0.205	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	107.6	-173.8	-54.3	178.3	0	0	0	110	P588 P590 Q647 H648 G649 K653	P588-I651 HydrophobicContact CB-CD1 4.41Å; P588-I651 HydrophobicContact CB-CG2 4.14Å; P588-I651 HydrophobicContact CG-CG2 3.97Å; P590-I651 HydrophobicContact CG-CD1 3.97Å; Q647-I651 WeakPolarHBondContact CA-O 3.44Å; H648-I651 PolarHBondContact N-O 3Å; H648-I651 WeakPolarHBondContact O-CB 3.41Å; H648-I651 PolarHBondContact O-N 2.79Å; G649-I651 VanDerWaalsContact C-N 3.25Å; G649-I651 PolarHBondContact O-N 2.82Å; I651-K653 HydrophobicContact CG2-CD 3.99Å; I651-K653 HydrophobicContact CG2-CG 3.8Å
652	D	90.9	Very high	91.8	Very high	91 Å²	91	70.7 Å²	70.7	49%	0.487	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	115.4	168.1	-172.8	29.9	0	0	0	109.9	Q645 Q647	Q645-D652 WeakPolarHBondContact CG-OD1 3.33Å; Q645-D652 PolarHBondContact NE2-OD1 2.95Å; Q645-D652 PolarHBondContact NE2-OD2 3.26Å; Q647-D652 HydrophobicContact CG-CB 4.26Å; Q647-D652 WeakPolarHBondContact CG-OD1 3.41Å; Q647-D652 PolarHBondContact NE2-OD1 3.25Å
653	K	93.4	Very high	91.3	Very high	74 Å²	74	66.1 Å²	66.1	32%	0.322	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	133.4	-177.5	-76.3	-168.2	-177.5	-171.4	0	113.8	P588 L646 I651 V655	P588-K653 HydrophobicContact CG-CD 4.33Å; L646-K653 PolarHBondContact N-O 3.23Å; L646-K653 PolarHBondContact O-N 3.05Å; I651-K653 HydrophobicContact CG2-CD 3.99Å; I651-K653 HydrophobicContact CG2-CG 3.8Å; K653-V655 PolarHBondContact O-N 3.44Å
654	R	95.3	Very high	90.9	Very high	162 Å²	162	67 Å²	67	61%	0.611	34%	0.339	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	112	168.1	-169.1	173.8	168.5	-175.5	-3.4	110.4	F643 V644 Q645	F643-R654 HydrophobicContact CB-CG 4.1Å; F643-R654 HydrophobicContact CD1-CG 4.14Å; F643-R654 HydrophobicContact CG-CG 4.49Å; F643-R654 VanDerWaalsContact CG-NH2 3.3Å; V644-R654 CarbonylContact O-C 3.57Å; V644-R654 WeakPolarHBondContact O-CA 3.22Å; Q645-R654 VanDerWaalsContact OE1-CB 3.28Å
655	V	96.4	Very high	90.8	Very high	1 Å²	1	68.8 Å²	68.8	1%	0.006	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	157	171.8	-59.5	0	0	0	0	111.2	V584 G585 F643 V644 L646 K653	V584-V655 HydrophobicContact CG1-CB 3.99Å; V584-V655 HydrophobicContact CG1-CG2 3.65Å; G585-V655 WeakPolarHBondContact O-CA 3.39Å; G585-V655 VanDerWaalsContact O-CB 3.29Å; G585-V655 WeakPolarHBondContact O-CB 3.49Å; F643-V655 VanDerWaalsContact CA-O 3.22Å; F643-V655 WeakPolarHBondContact CA-O 3.46Å; V644-V655 HydrophobicContact CB-CG2 3.78Å; V644-V655 HydrophobicContact CG1-CG2 4.48Å; V644-V655 PolarHBondContact N-O 3.37Å; V644-V655 WeakPolarHBondContact O-CG2 3.35Å; V644-V655 PolarHBondContact O-N 3.36Å; L646-V655 HydrophobicContact CB-CG1 4.48Å; L646-V655 HydrophobicContact CD1-CB 4.38Å; L646-V655 HydrophobicContact CD1-CG1 3.54Å; L646-V655 HydrophobicContact CD1-CG2 3.96Å; L646-V655 HydrophobicContact CD2-CG2 4.44Å; L646-V655 HydrophobicContact CG-CB 4.49Å; L646-V655 HydrophobicContact CG-CG1 3.85Å; L646-V655 HydrophobicContact CG-CG2 3.79Å; K653-V655 PolarHBondContact O-N 3.44Å
656	E	97.2	Very high	90.8	Very high	68 Å²	68	68.4 Å²	68.4	32%	0.318	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.9	137.7	173.6	-170.1	-172.6	-157.3	0	0	110	V584 G585 F643 K658	V584-E656 CarbonylContact C-O 3.51Å; V584-E656 WeakPolarHBondContact CA-O 3.33Å; G585-E656 PolarHBondContact N-O 2.96Å; G585-E656 PolarHBondContact O-N 3.4Å; F643-E656 HydrophobicContact CD1-CB 4.27Å; F643-E656 HydrophobicContact CD1-CG 4.43Å; F643-E656 HydrophobicContact CE1-CB 4.14Å; F643-E656 HydrophobicContact CE1-CG 4.03Å; E656-K658 WeakPolarHBondContact OE1-CE 3.35Å; E656-K658 IonicContact OE1-NZ 2.75Å; E656-K658 PolarHBondContact OE1-NZ 3.02Å; E656-K658 WeakPolarHBondContact OE2-CE 3.16Å; E656-K658 IonicContact OE2-NZ 3.68Å; E656-K658 PolarHBondContact OE2-NZ 2.8Å
657	V	97.1	Very high	90.9	Very high	6 Å²	6	68.4 Å²	68.4	4%	0.036	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	129	178.7	170.5	0	0	0	0	110	I582 F583 M600 A638 I639 R642 V644	I582-V657 HydrophobicContact CB-CG1 4.19Å; I582-V657 HydrophobicContact CD1-CG1 3.77Å; I582-V657 HydrophobicContact CD1-CG2 4.36Å; I582-V657 HydrophobicContact CG2-CG1 4.42Å; F583-V657 WeakPolarHBondContact O-CA 3.23Å; M600-V657 HydrophobicContact CE-CG2 4.29Å; A638-V657 WeakPolarHBondContact O-CG1 3.42Å; I639-V657 HydrophobicContact CD1-CG1 3.96Å; R642-V657 PolarHBondContact O-N 3.05Å; V644-V657 HydrophobicContact CB-CG2 4.48Å; V644-V657 HydrophobicContact CG2-CG2 3.73Å
658	K	95	Very high	91.3	Very high	84 Å²	84	64.2 Å²	64.2	37%	0.365	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	153.3	-178.1	-79.5	167.7	168.8	152.6	0	111	I582 F583 E656	I582-K658 CarbonylContact C-O 3.44Å; I582-K658 WeakPolarHBondContact CA-O 3.33Å; F583-K658 HydrophobicContact CB-CB 4.45Å; F583-K658 HydrophobicContact CD1-CB 4.44Å; F583-K658 PolarHBondContact N-O 3.37Å; F583-K658 PolarHBondContact O-N 3.44Å; E656-K658 WeakPolarHBondContact OE1-CE 3.35Å; E656-K658 IonicContact OE1-NZ 2.75Å; E656-K658 PolarHBondContact OE1-NZ 3.02Å; E656-K658 WeakPolarHBondContact OE2-CE 3.16Å; E656-K658 IonicContact OE2-NZ 3.68Å; E656-K658 PolarHBondContact OE2-NZ 2.8Å
659	P	94.5	Very high	91.9	Very high	13 Å²	13	66.5 Å²	66.5	8%	0.084	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.3	140.1	168.2	-24.6	36.8	0	0	0	111	I639 V661 F683 A685 L690	I639-P659 HydrophobicContact CD1-CB 4.33Å; I639-P659 HydrophobicContact CD1-CG 3.82Å; I639-P659 VanDerWaalsContact CD1-N 3.33Å; I639-P659 HydrophobicContact CG1-CG 4.23Å; I639-P659 HydrophobicContact CG2-CG 4.06Å; P659-V661 PolarHBondContact O-N 2.87Å; P659-F683 HydrophobicContact CB-CE1 3.58Å; P659-F683 HydrophobicContact CB-CZ 3.83Å; P659-F683 HydrophobicContact CG-CE1 3.89Å; P659-F683 HydrophobicContact CG-CZ 4.32Å; P659-A685 HydrophobicContact CG-CB 4.18Å; P659-L690 HydrophobicContact CG-CD2 4.32Å
660	Y	92.9	Very high	92.4	Very high	69 Å²	69	63.4 Å²	63.4	27%	0.271	31%	0.305	S	S	.	.			trans	-78.2	112.1	170.5	-162.3	-88.4	0	0	0	108.8	T581 F583 R626 L662	T581-Y660 HydrophobicContact CG2-CD2 4.22Å; T581-Y660 HydrophobicContact CG2-CG 4.02Å; T581-Y660 WeakPolarHBondContact O-CB 3.28Å; T581-Y660 PolarHBondContact O-N 3.06Å; F583-Y660 HydrophobicContact CB-CD2 4.29Å; R626-Y660 HydrophobicContact CB-CD2 4.43Å; R626-Y660 HydrophobicContact CB-CE2 4.41Å; Y660-L662 HydrophobicContact CD1-CD2 3.78Å; Y660-L662 HydrophobicContact CD1-CG 4.48Å; Y660-L662 HydrophobicContact CE1-CD2 3.86Å
661	V	90.5	Very high	92.7	Very high	48 Å²	48	61.9 Å²	61.9	29%	0.291	30%	0.298	S	S	.	.			trans	-91.9	133.1	-176.2	-174.4	0	0	0	0	109.9	P659 F683 Y692 L713	P659-V661 PolarHBondContact O-N 2.87Å; V661-F683 HydrophobicContact CG1-CB 4.13Å; V661-F683 HydrophobicContact CG1-CG 4.48Å; V661-F683 HydrophobicContact CG2-CD1 3.88Å; V661-F683 HydrophobicContact CG2-CE1 4.37Å; V661-F683 HydrophobicContact CG2-CG 4.35Å; V661-Y692 HydrophobicContact CG1-CE1 4.17Å; V661-L713 HydrophobicContact CG2-CD1 3.97Å
662	L	89.9	Confident	92.9	Very high	32 Å²	32	60 Å²	60	17%	0.168	29%	0.289	C	S	.	.			trans	-112.5	150.4	-176.5	-56.3	166.1	0	0	0	109.3	P578 R579 Y660 Q665 Y692	P578-L662 HydrophobicContact CB-CD1 3.61Å; P578-L662 HydrophobicContact CB-CD2 3.9Å; P578-L662 HydrophobicContact CB-CG 4.38Å; R579-L662 HydrophobicContact CG-CD1 4.2Å; Y660-L662 HydrophobicContact CD1-CD2 3.78Å; Y660-L662 HydrophobicContact CD1-CG 4.48Å; Y660-L662 HydrophobicContact CE1-CD2 3.86Å; L662-Q665 HydrophobicContact CB-CG 3.63Å; L662-Q665 HydrophobicContact CD1-CG 4.14Å; L662-Y692 PolarHBondContact N-OH 2.98Å; L662-Y692 WeakPolarHBondContact O-CE1 3.27Å
663	D	83.9	Confident	93.1	Very high	66 Å²	66	60 Å²	60	35%	0.353	30%	0.301	S	S	.	.	S	Bend	trans	-90.5	-46.8	-171.6	-61.3	4.8	0	0	0	110.9	Q665 K715	D663-Q665 PolarHBondContact O-N 3.28Å; D663-K715 WeakPolarHBondContact OD1-CD 3.46Å; D663-K715 WeakPolarHBondContact OD1-CE 3.38Å; D663-K715 IonicContact OD1-NZ 2.79Å; D663-K715 PolarHBondContact OD1-NZ 2.61Å; D663-K715 IonicContact OD2-NZ 3.84Å; D663-K715 PolarHBondContact OD2-NZ 3.3Å
664	D	87.4	Confident	92.9	Very high	107 Å²	107	63.7 Å²	63.7	57%	0.572	31%	0.313	S	S	*	.	S	Bend	trans	-86.8	41.2	-170.6	-47.5	-76.4	0	0	0	113	F679	D664-F679 HydrophobicContact CB-CD1 4.36Å; D664-F679 HydrophobicContact CB-CD2 4.4Å; D664-F679 HydrophobicContact CB-CE1 3.91Å; D664-F679 HydrophobicContact CB-CE2 3.95Å; D664-F679 HydrophobicContact CB-CZ 3.69Å; D664-F679 WeakPolarHBondContact O-CE1 3.47Å; D664-F679 WeakPolarHBondContact OD1-CE2 3.16Å
665	Q	91.5	Very high	92.5	Very high	45 Å²	45	57.1 Å²	57.1	21%	0.21	29%	0.291	C	S	.	.	P	Polyproline II helix	trans	-99.2	126.6	-180	-63.6	-62.9	-88.6	0	0	111.3	L662 D663 F679 A680 Y692	L662-Q665 HydrophobicContact CB-CG 3.63Å; L662-Q665 HydrophobicContact CD1-CG 4.14Å; D663-Q665 PolarHBondContact O-N 3.28Å; Q665-F679 CarbonylContact O-C 3.5Å; Q665-F679 WeakPolarHBondContact O-CA 3.46Å; Q665-A680 WeakPolarHBondContact O-CB 3.38Å; Q665-A680 PolarHBondContact O-N 3.42Å; Q665-Y692 HydrophobicContact CB-CD1 3.65Å; Q665-Y692 HydrophobicContact CB-CD2 3.92Å; Q665-Y692 HydrophobicContact CB-CE1 3.92Å; Q665-Y692 HydrophobicContact CB-CE2 4.19Å; Q665-Y692 HydrophobicContact CB-CG 3.66Å; Q665-Y692 HydrophobicContact CG-CD1 4.16Å; Q665-Y692 HydrophobicContact CG-CD2 4.09Å; Q665-Y692 HydrophobicContact CG-CE1 3.91Å; Q665-Y692 HydrophobicContact CG-CE2 3.85Å; Q665-Y692 HydrophobicContact CG-CG 4.25Å
666	L	92.6	Very high	92.1	Very high	76 Å²	76	60.7 Å²	60.7	40%	0.398	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-69.6	154.7	168.1	-65.8	176.2	0	0	0	110.3	D668 G677 F679	L666-D668 PolarHBondContact O-N 2.91Å; L666-G677 WeakPolarHBondContact CD2-O 3.04Å; L666-F679 HydrophobicContact CD2-CD1 4.05Å; L666-F679 HydrophobicContact CD2-CE1 4.45Å; L666-F679 HydrophobicContact CG-CD1 4.49Å
667	C	94.8	Very high	91.6	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.007	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-64.4	124.4	176.3	173.1	0	0	0	0	111.4	E669 C670 Q671 A680 Y692 C694	C667-E669 PolarHBondContact O-N 3.37Å; C667-C670 PolarHBondContact O-N 2.81Å; C667-C670 VanDerWaalsContact SG-SG 3.68Å; C667-Q671 VanDerWaalsContact O-CA 3.27Å; C667-Q671 WeakPolarHBondContact O-CA 3.43Å; C667-Q671 PolarHBondContact O-N 3.5Å; C667-A680 HydrophobicContact CB-CB 4.15Å; C667-Y692 CarbonylContact C-O 3.53Å; C667-Y692 VanDerWaalsContact CA-O 3.31Å; C667-Y692 WeakPolarHBondContact CA-O 3.42Å; C667-C694 HydrophobicContact CB-CB 3.87Å; C667-C694 PolarHBondContact SG-N 3.33Å
668	D	94.1	Very high	91.3	Very high	44 Å²	44	66.8 Å²	66.8	24%	0.235	37%	0.367	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.8	-33.3	-177.7	-72.5	-56.1	0	0	0	113.4	R579 L666 Q691 Y692	R579-D668 IonicContact CZ-OD1 2.71Å; R579-D668 VanDerWaalsContact CZ-OD1 3.24Å; R579-D668 IonicContact CZ-OD2 3.92Å; R579-D668 IonicContact NH1-OD1 2.65Å; R579-D668 PolarHBondContact NH1-OD1 3.43Å; R579-D668 IonicContact NH1-OD2 2.88Å; R579-D668 IonicContact NH2-OD1 2.83Å; R579-D668 PolarHBondContact NH2-OD1 3.46Å; R579-D668 IonicContact NH2-OD2 3.24Å; R579-D668 PolarHBondContact NH2-OD2 3.23Å; L666-D668 PolarHBondContact O-N 2.91Å; D668-Q691 HydrophobicContact CB-CB 4.39Å; D668-Q691 HydrophobicContact CB-CG 4.1Å; D668-Q691 WeakPolarHBondContact OD2-CA 3.4Å; D668-Q691 WeakPolarHBondContact OD2-CB 3.44Å; D668-Q691 WeakPolarHBondContact OD2-CG 3.47Å; D668-Y692 PolarHBondContact N-O 3.29Å; D668-Y692 PolarHBondContact OD2-N 3.22Å
669	E	94.9	Very high	91.1	Very high	95 Å²	95	67.8 Å²	67.8	44%	0.444	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.6	-18.5	-174.6	-64.6	-80.3	169	0	0	114.5	C667 Y693 C697 I701	C667-E669 PolarHBondContact O-N 3.37Å; E669-Y693 HydrophobicContact CG-CD1 3.74Å; E669-Y693 HydrophobicContact CG-CE1 3.53Å; E669-C697 HydrophobicContact CB-CB 4.05Å; E669-C697 HydrophobicContact CG-CB 4.47Å; E669-I701 HydrophobicContact CB-CD1 4.36Å; E669-I701 HydrophobicContact CG-CD1 3.44Å; E669-I701 VanDerWaalsContact CG-CD1 3.44Å; E669-I701 WeakPolarHBondContact OE1-CD1 3.18Å
670	C	95.2	Very high	91	Very high	19 Å²	19	67.6 Å²	67.6	13%	0.128	37%	0.372	C	S	.	.	T	Hydrogen-bonded Turn	trans	-141.8	-0.9	-177.3	73.5	0	0	0	0	115.2	C667 G672 A673 R674	C667-C670 PolarHBondContact O-N 2.81Å; C667-C670 VanDerWaalsContact SG-SG 3.68Å; C670-G672 PolarHBondContact O-N 2.84Å; C670-G672 VanDerWaalsContact O-N 3.1Å; C670-A673 WeakPolarHBondContact O-CB 3.42Å; C670-A673 PolarHBondContact O-N 2.88Å; C670-R674 HydrophobicContact CB-CB 4.28Å; C670-R674 HydrophobicContact CB-CG 3.94Å
671	Q	93.6	Very high	91	Very high	158 Å²	158	67.4 Å²	67.4	74%	0.738	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.3	37.6	176.7	-58.8	179.5	-5.8	0	0	113.3	C667 A673	C667-Q671 VanDerWaalsContact O-CA 3.27Å; C667-Q671 WeakPolarHBondContact O-CA 3.43Å; C667-Q671 PolarHBondContact O-N 3.5Å; Q671-A673 VanDerWaalsContact C-N 3.33Å; Q671-A673 PolarHBondContact O-N 3.32Å
672	G	90.4	Very high	91.1	Very high	2 Å²	2	67.1 Å²	67.1	2%	0.021	37%	0.374	C	S	.	.	T	Hydrogen-bonded Turn	trans	86.6	-14.4	-177.7	0	0	0	0	0	115.4	C670 R674 C675 G676 G677	C670-G672 PolarHBondContact O-N 2.84Å; C670-G672 VanDerWaalsContact O-N 3.1Å; G672-R674 VanDerWaalsContact C-N 3.3Å; G672-R674 PolarHBondContact O-N 2.71Å; G672-C675 CarbonylContact O-C 3.53Å; G672-C675 PolarHBondContact O-N 2.83Å; G672-C675 PolarHBondContact O-SG 2.82Å; G672-G676 PolarHBondContact O-N 2.65Å; G672-G676 VanDerWaalsContact O-N 3.1Å; G672-G677 PolarHBondContact O-N 2.91Å
673	A	93.4	Very high	91.3	Very high	89 Å²	89	65.8 Å²	65.8	74%	0.736	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.5	-31.9	-170.6	0	0	0	0	0	114.3	C670 Q671	C670-A673 WeakPolarHBondContact O-CB 3.42Å; C670-A673 PolarHBondContact O-N 2.88Å; Q671-A673 VanDerWaalsContact C-N 3.33Å; Q671-A673 PolarHBondContact O-N 3.32Å
674	R	90.5	Very high	91.9	Very high	152 Å²	152	62.7 Å²	62.7	57%	0.574	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.6	-11.5	176.9	-66.2	-176	-179.4	-175	0.1	114.2	C670 G672 Y696	C670-R674 HydrophobicContact CB-CB 4.28Å; C670-R674 HydrophobicContact CB-CG 3.94Å; G672-R674 VanDerWaalsContact C-N 3.3Å; G672-R674 PolarHBondContact O-N 2.71Å; R674-Y696 HydrophobicContact CB-CD2 4.25Å; R674-Y696 WeakPolarHBondContact O-CD2 3.34Å; R674-Y696 WeakPolarHBondContact O-CE2 3.41Å
675	C	86.5	Confident	92.1	Very high	24 Å²	24	59.2 Å²	59.2	16%	0.162	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.2	18.4	-176.5	47.9	0	0	0	0	113.1	G672 G677 K678 C694	G672-C675 CarbonylContact O-C 3.53Å; G672-C675 PolarHBondContact O-N 2.83Å; G672-C675 PolarHBondContact O-SG 2.82Å; C675-G677 PolarHBondContact O-N 3.49Å; C675-K678 HydrophobicContact CB-CB 4.38Å; C675-K678 WeakPolarHBondContact O-CB 3.4Å; C675-K678 VanDerWaalsContact O-CG 3.27Å; C675-K678 WeakPolarHBondContact O-CG 3.47Å; C675-K678 PolarHBondContact O-N 3.4Å; C675-K678 PolarHBondContact SG-O 3.31Å; C675-C694 HydrophobicContact CB-CB 3.92Å; C675-C694 VanDerWaalsContact SG-CB 3.5Å
676	G	87.3	Confident	92.2	Very high	76 Å²	76	59.7 Å²	59.7	78%	0.784	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	35.2	176.4	0	0	0	0	0	113.6	G672 K678	G672-G676 PolarHBondContact O-N 2.65Å; G672-G676 VanDerWaalsContact O-N 3.1Å; G676-K678 VanDerWaalsContact C-N 3.26Å; G676-K678 PolarHBondContact O-N 2.67Å
677	G	88.2	Confident	92.2	Very high	50 Å²	50	58.6 Å²	58.6	52%	0.515	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	80.2	-3.5	-177.8	0	0	0	0	0	115.1	L666 G672 C675	L666-G677 WeakPolarHBondContact CD2-O 3.04Å; G672-G677 PolarHBondContact O-N 2.91Å; C675-G677 PolarHBondContact O-N 3.49Å
678	K	89.8	Confident	92.1	Very high	152 Å²	152	62.8 Å²	62.8	66%	0.661	36%	0.363	S	S	*	.			trans	-63.7	146.7	176.4	-64.6	178	-178	-175.6	0	112.1	C675 G676	C675-K678 HydrophobicContact CB-CB 4.38Å; C675-K678 WeakPolarHBondContact O-CB 3.4Å; C675-K678 VanDerWaalsContact O-CG 3.27Å; C675-K678 WeakPolarHBondContact O-CG 3.47Å; C675-K678 PolarHBondContact O-N 3.4Å; C675-K678 PolarHBondContact SG-O 3.31Å; G676-K678 VanDerWaalsContact C-N 3.26Å; G676-K678 PolarHBondContact O-N 2.67Å
679	F	91.4	Very high	92.1	Very high	105 Å²	105	61.4 Å²	61.4	46%	0.461	36%	0.356	S	S	.	.			trans	-59.4	160.5	169	-55.2	-52.7	0	0	0	112.6	D664 Q665 L666 P681	D664-F679 HydrophobicContact CB-CD1 4.36Å; D664-F679 HydrophobicContact CB-CD2 4.4Å; D664-F679 HydrophobicContact CB-CE1 3.91Å; D664-F679 HydrophobicContact CB-CE2 3.95Å; D664-F679 HydrophobicContact CB-CZ 3.69Å; D664-F679 WeakPolarHBondContact O-CE1 3.47Å; D664-F679 WeakPolarHBondContact OD1-CE2 3.16Å; Q665-F679 CarbonylContact O-C 3.5Å; Q665-F679 WeakPolarHBondContact O-CA 3.46Å; L666-F679 HydrophobicContact CD2-CD1 4.05Å; L666-F679 HydrophobicContact CD2-CE1 4.45Å; L666-F679 HydrophobicContact CG-CD1 4.49Å; F679-P681 WeakPolarHBondContact O-CD 3.27Å
680	A	92.3	Very high	92.1	Very high	9 Å²	9	57.7 Å²	57.7	7%	0.074	34%	0.339	C	S	.	.			trans	-87.4	112.6	-176.9	0	0	0	0	0	111.2	Q665 C667 F682 Y693	Q665-A680 WeakPolarHBondContact O-CB 3.38Å; Q665-A680 PolarHBondContact O-N 3.42Å; C667-A680 HydrophobicContact CB-CB 4.15Å; A680-F682 PolarHBondContact O-N 3.31Å; A680-Y693 WeakPolarHBondContact CB-O 3.25Å
681	P	91.7	Very high	92	Very high	66 Å²	66	59.7 Å²	59.7	43%	0.429	35%	0.346	S	S	.	.	S	Bend	trans	-74	-7.8	-177.3	32	-36.9	0	0	0	113.9	F679	F679-P681 WeakPolarHBondContact O-CD 3.27Å
682	F	93.8	Very high	92.1	Very high	41 Å²	41	52.5 Å²	52.5	18%	0.18	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	120.6	-174	-55	-44	0	0	0	111.9	A680 Y693 E695 W698 P712 V714	A680-F682 PolarHBondContact O-N 3.31Å; F682-Y693 PolarHBondContact N-O 3.28Å; F682-Y693 PolarHBondContact O-N 2.89Å; F682-E695 HydrophobicContact CE2-CB 4.15Å; F682-E695 HydrophobicContact CE2-CG 4.28Å; F682-W698 HydrophobicContact CB-CD2 4.21Å; F682-W698 HydrophobicContact CB-CE3 3.7Å; F682-W698 HydrophobicContact CB-CZ3 4.36Å; F682-W698 HydrophobicContact CD2-CB 3.77Å; F682-W698 HydrophobicContact CD2-CD2 4.34Å; F682-W698 AromaticContact CD2-CG 3.91Å; F682-W698 HydrophobicContact CD2-CG 3.91Å; F682-W698 HydrophobicContact CE2-CB 4.46Å; F682-W698 HydrophobicContact CG-CD2 4.47Å; F682-W698 HydrophobicContact CG-CE3 4.42Å; F682-W698 HydrophobicContact CG-CG 4.5Å; F682-P712 HydrophobicContact CB-CB 4.04Å; F682-P712 HydrophobicContact CD1-CB 3.96Å; F682-P712 HydrophobicContact CG-CB 4.16Å; F682-V714 HydrophobicContact CD1-CB 4.42Å; F682-V714 HydrophobicContact CD1-CG1 4.14Å; F682-V714 HydrophobicContact CD1-CG2 3.81Å; F682-V714 HydrophobicContact CE1-CB 4.48Å; F682-V714 HydrophobicContact CE1-CG1 3.93Å; F682-V714 HydrophobicContact CE1-CG2 3.82Å
683	F	94.6	Very high	92.3	Very high	5 Å²	5	52.4 Å²	52.4	2%	0.022	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	131.6	168.4	176.7	-98.4	0	0	0	110.8	P659 V661 A685 L690 Q691 Y692 L713	P659-F683 HydrophobicContact CB-CE1 3.58Å; P659-F683 HydrophobicContact CB-CZ 3.83Å; P659-F683 HydrophobicContact CG-CE1 3.89Å; P659-F683 HydrophobicContact CG-CZ 4.32Å; V661-F683 HydrophobicContact CG1-CB 4.13Å; V661-F683 HydrophobicContact CG1-CG 4.48Å; V661-F683 HydrophobicContact CG2-CD1 3.88Å; V661-F683 HydrophobicContact CG2-CE1 4.37Å; V661-F683 HydrophobicContact CG2-CG 4.35Å; F683-A685 HydrophobicContact CD1-CB 4.26Å; F683-A685 HydrophobicContact CE1-CB 3.97Å; F683-L690 HydrophobicContact CZ-CD2 4.46Å; F683-Q691 WeakPolarHBondContact CD2-O 3.27Å; F683-Y692 HydrophobicContact CB-CD1 4.02Å; F683-Y692 HydrophobicContact CB-CE1 3.89Å; F683-Y692 AromaticContact CD2-CD1 3.88Å; F683-Y692 HydrophobicContact CD2-CD1 3.88Å; F683-Y692 AromaticContact CD2-CD2 3.78Å; F683-Y692 HydrophobicContact CD2-CD2 3.78Å; F683-Y692 AromaticContact CD2-CE1 3.66Å; F683-Y692 HydrophobicContact CD2-CE1 3.66Å; F683-Y692 AromaticContact CD2-CE2 3.54Å; F683-Y692 HydrophobicContact CD2-CE2 3.54Å; F683-Y692 AromaticContact CD2-CG 3.93Å; F683-Y692 HydrophobicContact CD2-CG 3.93Å; F683-Y692 AromaticContact CD2-CZ 3.46Å; F683-Y692 VanDerWaalsContact CD2-CZ 3.46Å; F683-Y692 HydrophobicContact CE2-CD2 4.18Å; F683-Y692 AromaticContact CE2-CE2 3.76Å; F683-Y692 HydrophobicContact CE2-CE2 3.76Å; F683-Y692 AromaticContact CE2-CZ 3.99Å; F683-Y692 HydrophobicContact CG-CD1 4.41Å; F683-Y692 HydrophobicContact CG-CE1 4.09Å; F683-L713 HydrophobicContact CB-CB 4.48Å; F683-L713 HydrophobicContact CD1-CD1 4.22Å; F683-L713 PolarHBondContact N-O 3.13Å; F683-L713 PolarHBondContact O-N 2.92Å
684	C	94.9	Very high	92.3	Very high	0 Å²	0	48.2 Å²	48.2	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	102.5	176.1	-164.9	0	0	0	0	111.7	N686 C689 L690 Q691 Y693 W698 H702 H710	C684-N686 PolarHBondContact O-N 2.77Å; C684-N686 VanDerWaalsContact O-N 3.12Å; C684-C689 HydrophobicContact CB-CB 3.67Å; C684-L690 VanDerWaalsContact O-CA 3.27Å; C684-L690 WeakPolarHBondContact O-CA 3.31Å; C684-L690 PolarHBondContact O-N 3.16Å; C684-L690 VanDerWaalsContact O-N 3.09Å; C684-Q691 PolarHBondContact N-O 2.73Å; C684-Y693 HydrophobicContact CB-CD2 4.12Å; C684-Y693 HydrophobicContact CB-CE2 3.59Å; C684-W698 HydrophobicContact CB-CH2 4.22Å; C684-W698 HydrophobicContact CB-CZ3 3.72Å; C684-H702 PolarHBondContact SG-NE2 2.99Å; C684-H702 VanDerWaalsContact SG-NE2 3.37Å; C684-H710 PolarHBondContact SG-ND1 2.92Å
685	A	93.1	Very high	92.5	Very high	35 Å²	35	47.2 Å²	47.2	29%	0.289	28%	0.279	S	S	.	.			trans	-75.8	11.1	177.6	0	0	0	0	0	114.8	P659 F683 L713	P659-A685 HydrophobicContact CG-CB 4.18Å; F683-A685 HydrophobicContact CD1-CB 4.26Å; F683-A685 HydrophobicContact CE1-CB 3.97Å; A685-L713 HydrophobicContact CB-CD1 3.74Å; A685-L713 HydrophobicContact CB-CG 4Å
686	N	93.4	Very high	92.9	Very high	55 Å²	55	53 Å²	53	29%	0.294	30%	0.298	S	S	.	.	S	Bend	trans	-77.2	135.5	169.1	-169.3	-61.8	0	0	0	109.8	C684 T688 C689 L690 H710	C684-N686 PolarHBondContact O-N 2.77Å; C684-N686 VanDerWaalsContact O-N 3.12Å; N686-T688 PolarHBondContact O-N 3.49Å; N686-T688 VanDerWaalsContact O-N 3.12Å; N686-T688 PolarHBondContact OD1-N 3.1Å; N686-T688 PolarHBondContact OD1-OG1 3.01Å; N686-C689 PolarHBondContact O-N 3.2Å; N686-L690 WeakPolarHBondContact O-CD2 3.42Å; N686-L690 WeakPolarHBondContact O-CG 3.45Å; N686-L690 PolarHBondContact O-N 3.45Å; N686-H710 VanDerWaalsContact CG-NE2 3.3Å; N686-H710 PolarHBondContact ND2-CD2 3.25Å; N686-H710 VanDerWaalsContact ND2-CD2 3.31Å; N686-H710 PolarHBondContact ND2-NE2 2.76Å
687	V	92.5	Very high	93.2	Very high	53 Å²	53	49.6 Å²	49.6	32%	0.321	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.4	-30.2	179.6	179	0	0	0	0	113	I636 I639 C689	I636-V687 HydrophobicContact CG2-CG1 3.96Å; I639-V687 HydrophobicContact CG2-CG2 4.26Å; V687-C689 PolarHBondContact O-N 2.86Å
688	T	92.5	Very high	93.6	Very high	89 Å²	89	48.9 Å²	48.9	55%	0.546	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-78.6	1.5	177.3	64.1	0	0	0	0	114.4	N686 H710	N686-T688 PolarHBondContact O-N 3.49Å; N686-T688 VanDerWaalsContact O-N 3.12Å; N686-T688 PolarHBondContact OD1-N 3.1Å; N686-T688 PolarHBondContact OD1-OG1 3.01Å; T688-H710 PolarHBondContact OG1-CE1 3.31Å; T688-H710 VanDerWaalsContact OG1-CE1 3.25Å
689	C	93.8	Very high	93.8	Very high	14 Å²	14	44.4 Å²	44.4	10%	0.095	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-131.3	-68.9	179.7	-65.3	0	0	0	0	111.2	C684 N686 V687 Q691 Y693 H710	C684-C689 HydrophobicContact CB-CB 3.67Å; N686-C689 PolarHBondContact O-N 3.2Å; V687-C689 PolarHBondContact O-N 2.86Å; C689-Q691 VanDerWaalsContact O-CG 3.25Å; C689-Q691 WeakPolarHBondContact O-CG 3.37Å; C689-Q691 PolarHBondContact O-N 3.1Å; C689-Y693 HydrophobicContact CB-CE2 4.39Å; C689-H710 VanDerWaalsContact SG-CE1 3.52Å
690	L	94.1	Very high	93.9	Very high	17 Å²	17	41.4 Å²	41.4	9%	0.089	23%	0.23	C	C	.	.			trans	46.9	40.6	-177.8	-57.2	179.8	0	0	0	114	Y635 I636 I639 P659 F683 C684 N686	Y635-L690 HydrophobicContact CE1-CD1 3.95Å; I636-L690 HydrophobicContact CG1-CD1 3.95Å; I639-L690 HydrophobicContact CG2-CD2 4.11Å; P659-L690 HydrophobicContact CG-CD2 4.32Å; F683-L690 HydrophobicContact CZ-CD2 4.46Å; C684-L690 VanDerWaalsContact O-CA 3.27Å; C684-L690 WeakPolarHBondContact O-CA 3.31Å; C684-L690 PolarHBondContact O-N 3.16Å; C684-L690 VanDerWaalsContact O-N 3.09Å; N686-L690 WeakPolarHBondContact O-CD2 3.42Å; N686-L690 WeakPolarHBondContact O-CG 3.45Å; N686-L690 PolarHBondContact O-N 3.45Å
691	Q	94.1	Very high	93.9	Very high	61 Å²	61	41.8 Å²	41.8	29%	0.285	23%	0.23	S	C	.	.			trans	-134	158.1	-167.6	-87.5	172.9	-25.3	0	0	112	D668 F683 C684 C689 Y693	D668-Q691 HydrophobicContact CB-CB 4.39Å; D668-Q691 HydrophobicContact CB-CG 4.1Å; D668-Q691 WeakPolarHBondContact OD2-CA 3.4Å; D668-Q691 WeakPolarHBondContact OD2-CB 3.44Å; D668-Q691 WeakPolarHBondContact OD2-CG 3.47Å; F683-Q691 WeakPolarHBondContact CD2-O 3.27Å; C684-Q691 PolarHBondContact N-O 2.73Å; C689-Q691 VanDerWaalsContact O-CG 3.25Å; C689-Q691 WeakPolarHBondContact O-CG 3.37Å; C689-Q691 PolarHBondContact O-N 3.1Å; Q691-Y693 HydrophobicContact CB-CE1 4.22Å; Q691-Y693 HydrophobicContact CB-CE2 3.71Å; Q691-Y693 WeakPolarHBondContact CB-OH 3.18Å; Q691-Y693 WeakPolarHBondContact O-CD2 3.27Å; Q691-Y693 WeakPolarHBondContact O-CE2 3.22Å; Q691-Y693 PolarHBondContact OE1-OH 3.19Å
692	Y	94.8	Very high	94.1	Very high	8 Å²	8	39.2 Å²	39.2	3%	0.031	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	129.1	177.4	-68.9	-90.2	0	0	0	110.8	V661 L662 Q665 C667 D668 F683	V661-Y692 HydrophobicContact CG1-CE1 4.17Å; L662-Y692 PolarHBondContact N-OH 2.98Å; L662-Y692 WeakPolarHBondContact O-CE1 3.27Å; Q665-Y692 HydrophobicContact CB-CD1 3.65Å; Q665-Y692 HydrophobicContact CB-CD2 3.92Å; Q665-Y692 HydrophobicContact CB-CE1 3.92Å; Q665-Y692 HydrophobicContact CB-CE2 4.19Å; Q665-Y692 HydrophobicContact CB-CG 3.66Å; Q665-Y692 HydrophobicContact CG-CD1 4.16Å; Q665-Y692 HydrophobicContact CG-CD2 4.09Å; Q665-Y692 HydrophobicContact CG-CE1 3.91Å; Q665-Y692 HydrophobicContact CG-CE2 3.85Å; Q665-Y692 HydrophobicContact CG-CG 4.25Å; C667-Y692 CarbonylContact C-O 3.53Å; C667-Y692 VanDerWaalsContact CA-O 3.31Å; C667-Y692 WeakPolarHBondContact CA-O 3.42Å; D668-Y692 PolarHBondContact N-O 3.29Å; D668-Y692 PolarHBondContact OD2-N 3.22Å; F683-Y692 HydrophobicContact CB-CD1 4.02Å; F683-Y692 HydrophobicContact CB-CE1 3.89Å; F683-Y692 AromaticContact CD2-CD1 3.88Å; F683-Y692 HydrophobicContact CD2-CD1 3.88Å; F683-Y692 AromaticContact CD2-CD2 3.78Å; F683-Y692 HydrophobicContact CD2-CD2 3.78Å; F683-Y692 AromaticContact CD2-CE1 3.66Å; F683-Y692 HydrophobicContact CD2-CE1 3.66Å; F683-Y692 AromaticContact CD2-CE2 3.54Å; F683-Y692 HydrophobicContact CD2-CE2 3.54Å; F683-Y692 AromaticContact CD2-CG 3.93Å; F683-Y692 HydrophobicContact CD2-CG 3.93Å; F683-Y692 AromaticContact CD2-CZ 3.46Å; F683-Y692 VanDerWaalsContact CD2-CZ 3.46Å; F683-Y692 HydrophobicContact CE2-CD2 4.18Å; F683-Y692 AromaticContact CE2-CE2 3.76Å; F683-Y692 HydrophobicContact CE2-CE2 3.76Å; F683-Y692 AromaticContact CE2-CZ 3.99Å; F683-Y692 HydrophobicContact CG-CD1 4.41Å; F683-Y692 HydrophobicContact CG-CE1 4.09Å
693	Y	94.9	Very high	94	Very high	0 Å²	0	41.6 Å²	41.6	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	132.2	-175.7	-57.3	-78.9	0	0	0	111.9	E669 A680 F682 C684 C689 Q691 C697 W698 I701 H702	E669-Y693 HydrophobicContact CG-CD1 3.74Å; E669-Y693 HydrophobicContact CG-CE1 3.53Å; A680-Y693 WeakPolarHBondContact CB-O 3.25Å; F682-Y693 PolarHBondContact N-O 3.28Å; F682-Y693 PolarHBondContact O-N 2.89Å; C684-Y693 HydrophobicContact CB-CD2 4.12Å; C684-Y693 HydrophobicContact CB-CE2 3.59Å; C689-Y693 HydrophobicContact CB-CE2 4.39Å; Q691-Y693 HydrophobicContact CB-CE1 4.22Å; Q691-Y693 HydrophobicContact CB-CE2 3.71Å; Q691-Y693 WeakPolarHBondContact CB-OH 3.18Å; Q691-Y693 WeakPolarHBondContact O-CD2 3.27Å; Q691-Y693 WeakPolarHBondContact O-CE2 3.22Å; Q691-Y693 PolarHBondContact OE1-OH 3.19Å; Y693-C697 HydrophobicContact CD1-CB 4.32Å; Y693-W698 AromaticContact CD2-CE3 3.85Å; Y693-W698 HydrophobicContact CD2-CE3 3.85Å; Y693-W698 HydrophobicContact CD2-CZ3 4.17Å; Y693-W698 HydrophobicContact CG-CE3 4.33Å; Y693-I701 HydrophobicContact CD1-CD1 3.99Å; Y693-I701 HydrophobicContact CE1-CD1 3.66Å; Y693-H702 AromaticContact CD2-CE1 3.92Å; Y693-H702 AromaticContact CE2-CE1 3.64Å
694	C	94.4	Very high	93.8	Very high	1 Å²	1	49.2 Å²	49.2	1%	0.007	26%	0.263	C	S	.	.			trans	-70.9	160.1	161.2	71.7	0	0	0	0	109.5	C667 C675 Y696 C697 W698	C667-C694 HydrophobicContact CB-CB 3.87Å; C667-C694 PolarHBondContact SG-N 3.33Å; C675-C694 HydrophobicContact CB-CB 3.92Å; C675-C694 VanDerWaalsContact SG-CB 3.5Å; C694-Y696 VanDerWaalsContact C-N 3.3Å; C694-Y696 PolarHBondContact O-N 3.45Å; C694-C697 PolarHBondContact O-N 2.7Å; C694-W698 PolarHBondContact O-N 3.12Å
695	E	93.6	Very high	93.4	Very high	131 Å²	131	53.6 Å²	53.6	61%	0.612	30%	0.299	S	S	*	.	H	α-helix	trans	-49.1	-47.1	-177.2	-173.3	177.1	-179.5	0	0	113.4	F682 C697 W698 A699	F682-E695 HydrophobicContact CE2-CB 4.15Å; F682-E695 HydrophobicContact CE2-CG 4.28Å; E695-C697 PolarHBondContact O-N 3.45Å; E695-W698 PolarHBondContact O-N 2.81Å; E695-A699 PolarHBondContact O-N 3.05Å
696	Y	94.4	Very high	93.2	Very high	146 Å²	146	54.7 Å²	54.7	57%	0.573	31%	0.314	S	S	*	.	H	α-helix	trans	-62.9	-40.7	177.2	-56.7	-66.1	0	0	0	113.7	R674 C694 A700	R674-Y696 HydrophobicContact CB-CD2 4.25Å; R674-Y696 WeakPolarHBondContact O-CD2 3.34Å; R674-Y696 WeakPolarHBondContact O-CE2 3.41Å; C694-Y696 VanDerWaalsContact C-N 3.3Å; C694-Y696 PolarHBondContact O-N 3.45Å; Y696-A700 VanDerWaalsContact O-CB 3.32Å; Y696-A700 WeakPolarHBondContact O-CB 3.32Å; Y696-A700 PolarHBondContact O-N 2.84Å; Y696-A700 VanDerWaalsContact O-N 3.13Å
697	C	95.5	Very high	93.1	Very high	3 Å²	3	55.9 Å²	55.9	2%	0.02	31%	0.314	C	S	.	.	H	α-helix	trans	-76.7	-35.2	178.9	-71.7	0	0	0	0	111.8	E669 Y693 C694 E695 A700 I701	E669-C697 HydrophobicContact CB-CB 4.05Å; E669-C697 HydrophobicContact CG-CB 4.47Å; Y693-C697 HydrophobicContact CD1-CB 4.32Å; C694-C697 PolarHBondContact O-N 2.7Å; E695-C697 PolarHBondContact O-N 3.45Å; C697-A700 PolarHBondContact O-N 2.93Å; C697-I701 WeakPolarHBondContact O-CB 3.36Å; C697-I701 WeakPolarHBondContact O-CD1 3.34Å; C697-I701 WeakPolarHBondContact O-CG1 3.48Å; C697-I701 PolarHBondContact O-N 3.17Å; C697-I701 VanDerWaalsContact O-N 3.16Å
698	W	94.9	Very high	93	Very high	36 Å²	36	58.1 Å²	58.1	14%	0.136	32%	0.321	C	S	.	.	H	α-helix	trans	-56.5	-53.2	172.8	178	-85.4	0	0	0	110.2	F682 C684 Y693 C694 E695 A700 I701 H702 H710 P712	F682-W698 HydrophobicContact CB-CD2 4.21Å; F682-W698 HydrophobicContact CB-CE3 3.7Å; F682-W698 HydrophobicContact CB-CZ3 4.36Å; F682-W698 HydrophobicContact CD2-CB 3.77Å; F682-W698 HydrophobicContact CD2-CD2 4.34Å; F682-W698 AromaticContact CD2-CG 3.91Å; F682-W698 HydrophobicContact CD2-CG 3.91Å; F682-W698 HydrophobicContact CE2-CB 4.46Å; F682-W698 HydrophobicContact CG-CD2 4.47Å; F682-W698 HydrophobicContact CG-CE3 4.42Å; F682-W698 HydrophobicContact CG-CG 4.5Å; C684-W698 HydrophobicContact CB-CH2 4.22Å; C684-W698 HydrophobicContact CB-CZ3 3.72Å; Y693-W698 AromaticContact CD2-CE3 3.85Å; Y693-W698 HydrophobicContact CD2-CE3 3.85Å; Y693-W698 HydrophobicContact CD2-CZ3 4.17Å; Y693-W698 HydrophobicContact CG-CE3 4.33Å; C694-W698 PolarHBondContact O-N 3.12Å; E695-W698 PolarHBondContact O-N 2.81Å; W698-A700 PolarHBondContact O-N 3.06Å; W698-I701 PolarHBondContact O-N 3.09Å; W698-H702 AromaticContact CD2-CE1 3.99Å; W698-H702 AromaticContact CD2-ND1 3.38Å; W698-H702 AromaticContact CE2-CG 3.8Å; W698-H702 AromaticContact CE2-ND1 3.52Å; W698-H702 AromaticContact CE3-CE1 3.57Å; W698-H702 AromaticContact CE3-ND1 3.45Å; W698-H702 AromaticContact CG-ND1 3.96Å; W698-H702 AromaticContact CH2-CE1 3.67Å; W698-H702 AromaticContact CH2-CG 3.99Å; W698-H702 AromaticContact CH2-ND1 3.72Å; W698-H702 AromaticContact CH2-NE2 3.92Å; W698-H702 HydrophobicContact CZ2-CB 4.09Å; W698-H702 AromaticContact CZ2-CG 3.69Å; W698-H702 AromaticContact CZ2-ND1 3.67Å; W698-H702 AromaticContact CZ3-CE1 3.43Å; W698-H702 VanDerWaalsContact CZ3-CE1 3.43Å; W698-H702 WeakPolarHBondContact CZ3-CE1 3.4Å; W698-H702 AromaticContact CZ3-ND1 3.66Å; W698-H702 WeakPolarHBondContact O-CB 3.43Å; W698-H702 PolarHBondContact O-N 2.97Å; W698-H702 PolarHBondContact O-ND1 3.33Å; W698-H710 HydrophobicContact CH2-CB 4.37Å; W698-P712 HydrophobicContact CD2-CB 4.28Å; W698-P712 HydrophobicContact CE3-CB 4.09Å; W698-P712 VanDerWaalsContact CH2-CA 3.43Å; W698-P712 HydrophobicContact CH2-CB 3.61Å; W698-P712 HydrophobicContact CH2-CG 4.24Å; W698-P712 VanDerWaalsContact CH2-N 3.33Å; W698-P712 HydrophobicContact CZ2-CB 3.78Å; W698-P712 VanDerWaalsContact CZ2-CD 3.5Å; W698-P712 HydrophobicContact CZ2-CG 3.95Å; W698-P712 HydrophobicContact CZ3-CB 3.72Å
699	A	94.4	Very high	92.9	Very high	57 Å²	57	61.9 Å²	61.9	47%	0.471	33%	0.33	S	S	.	.	H	α-helix	trans	-60.9	-42.3	178.9	0	0	0	0	0	112.6	E695 I701 S703	E695-A699 PolarHBondContact O-N 3.05Å; A699-I701 VanDerWaalsContact C-N 3.27Å; A699-I701 PolarHBondContact O-N 2.9Å; A699-S703 WeakPolarHBondContact O-CB 3.46Å; A699-S703 PolarHBondContact O-N 3.12Å; A699-S703 PolarHBondContact O-OG 3.2Å
700	A	94	Very high	92.9	Very high	43 Å²	43	62.1 Å²	62.1	36%	0.355	33%	0.33	S	S	.	.	H	α-helix	trans	-70.9	-15.7	-178.2	0	0	0	0	0	115.1	Y696 C697 W698 R704	Y696-A700 VanDerWaalsContact O-CB 3.32Å; Y696-A700 WeakPolarHBondContact O-CB 3.32Å; Y696-A700 PolarHBondContact O-N 2.84Å; Y696-A700 VanDerWaalsContact O-N 3.13Å; C697-A700 PolarHBondContact O-N 2.93Å; W698-A700 PolarHBondContact O-N 3.06Å; A700-R704 PolarHBondContact O-NE 3.16Å
701	I	93.3	Very high	92.8	Very high	16 Å²	16	69.7 Å²	69.7	8%	0.082	36%	0.362	C	S	.	.	H	α-helix	trans	-111.2	-42.2	-174.4	-68.1	169.2	0	0	0	111.6	E669 Y693 C697 W698 A699 R704 R707	E669-I701 HydrophobicContact CB-CD1 4.36Å; E669-I701 HydrophobicContact CG-CD1 3.44Å; E669-I701 VanDerWaalsContact CG-CD1 3.44Å; E669-I701 WeakPolarHBondContact OE1-CD1 3.18Å; Y693-I701 HydrophobicContact CD1-CD1 3.99Å; Y693-I701 HydrophobicContact CE1-CD1 3.66Å; C697-I701 WeakPolarHBondContact O-CB 3.36Å; C697-I701 WeakPolarHBondContact O-CD1 3.34Å; C697-I701 WeakPolarHBondContact O-CG1 3.48Å; C697-I701 PolarHBondContact O-N 3.17Å; C697-I701 VanDerWaalsContact O-N 3.16Å; W698-I701 PolarHBondContact O-N 3.09Å; A699-I701 VanDerWaalsContact C-N 3.27Å; A699-I701 PolarHBondContact O-N 2.9Å; I701-R704 WeakPolarHBondContact O-CB 3.32Å; I701-R704 PolarHBondContact O-N 3.41Å; I701-R707 VanDerWaalsContact CG2-NH1 3.25Å
702	H	94.8	Very high	92.7	Very high	13 Å²	13	69 Å²	69	6%	0.06	36%	0.363	C	S	.	.	H	α-helix	trans	-87.2	-3.6	-179.7	-63.2	100.5	0	0	0	113.8	C684 Y693 W698 R704 E708 H710	C684-H702 PolarHBondContact SG-NE2 2.99Å; C684-H702 VanDerWaalsContact SG-NE2 3.37Å; Y693-H702 AromaticContact CD2-CE1 3.92Å; Y693-H702 AromaticContact CE2-CE1 3.64Å; W698-H702 AromaticContact CD2-CE1 3.99Å; W698-H702 AromaticContact CD2-ND1 3.38Å; W698-H702 AromaticContact CE2-CG 3.8Å; W698-H702 AromaticContact CE2-ND1 3.52Å; W698-H702 AromaticContact CE3-CE1 3.57Å; W698-H702 AromaticContact CE3-ND1 3.45Å; W698-H702 AromaticContact CG-ND1 3.96Å; W698-H702 AromaticContact CH2-CE1 3.67Å; W698-H702 AromaticContact CH2-CG 3.99Å; W698-H702 AromaticContact CH2-ND1 3.72Å; W698-H702 AromaticContact CH2-NE2 3.92Å; W698-H702 HydrophobicContact CZ2-CB 4.09Å; W698-H702 AromaticContact CZ2-CG 3.69Å; W698-H702 AromaticContact CZ2-ND1 3.67Å; W698-H702 AromaticContact CZ3-CE1 3.43Å; W698-H702 VanDerWaalsContact CZ3-CE1 3.43Å; W698-H702 WeakPolarHBondContact CZ3-CE1 3.4Å; W698-H702 AromaticContact CZ3-ND1 3.66Å; W698-H702 WeakPolarHBondContact O-CB 3.43Å; W698-H702 PolarHBondContact O-N 2.97Å; W698-H702 PolarHBondContact O-ND1 3.33Å; H702-R704 VanDerWaalsContact C-N 3.25Å; H702-E708 VanDerWaalsContact O-CA 3.3Å; H702-E708 WeakPolarHBondContact O-CA 3.43Å; H702-H710 VanDerWaalsContact CD2-CB 3.46Å; H702-H710 WeakPolarHBondContact CD2-CB 3.42Å; H702-H710 AromaticContact CD2-CG 3.68Å; H702-H710 AromaticContact CD2-ND1 3.35Å; H702-H710 PolarHBondContact CD2-ND1 3.47Å; H702-H710 VanDerWaalsContact CD2-ND1 3.35Å; H702-H710 AromaticContact NE2-CG 3.93Å; H702-H710 AromaticContact NE2-ND1 3.26Å; H702-H710 PolarHBondContact NE2-ND1 2.82Å
703	S	91.9	Very high	92.5	Very high	91 Å²	91	72.3 Å²	72.3	64%	0.636	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.6	-5.3	162.7	54.7	0	0	0	0	113.7	A699	A699-S703 WeakPolarHBondContact O-CB 3.46Å; A699-S703 PolarHBondContact O-N 3.12Å; A699-S703 PolarHBondContact O-OG 3.2Å
704	R	90.2	Very high	91.9	Very high	165 Å²	165	76.2 Å²	76.2	62%	0.623	40%	0.404	S	S	*	.	S	Bend	trans	-85.2	137.9	178.8	-58.5	-177.1	-177	-157.4	-2.3	110.6	A700 I701 H702 G706 R707 E708	A700-R704 PolarHBondContact O-NE 3.16Å; I701-R704 WeakPolarHBondContact O-CB 3.32Å; I701-R704 PolarHBondContact O-N 3.41Å; H702-R704 VanDerWaalsContact C-N 3.25Å; R704-G706 PolarHBondContact O-N 3.35Å; R704-R707 PolarHBondContact O-N 3.37Å; R704-E708 PolarHBondContact O-N 3.47Å
705	A	86.9	Confident	90.4	Very high	91 Å²	91	82.1 Å²	82.1	75%	0.752	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	136.9	175.8	0	0	0	0	0	111.8	R707	A705-R707 VanDerWaalsContact C-N 3.29Å; A705-R707 PolarHBondContact O-N 3.26Å
706	G	88	Confident	88.3	Confident	58 Å²	58	84.8 Å²	84.8	60%	0.598	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.5	-11.7	-172.9	0	0	0	0	0	114.8	R704 E708	R704-G706 PolarHBondContact O-N 3.35Å; G706-E708 PolarHBondContact N-OE1 3.46Å
707	R	91.7	Very high	85.8	Confident	80 Å²	80	80.4 Å²	80.4	30%	0.302	44%	0.441	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114.1	-7	173.1	-65.3	-167.4	178.9	-162.7	-2.1	113.6	I701 R704 A705 F709 H710	I701-R707 VanDerWaalsContact CG2-NH1 3.25Å; R704-R707 PolarHBondContact O-N 3.37Å; A705-R707 VanDerWaalsContact C-N 3.29Å; A705-R707 PolarHBondContact O-N 3.26Å; R707-F709 PolarHBondContact O-N 3.35Å; R707-H710 VanDerWaalsContact O-CB 3.32Å; R707-H710 WeakPolarHBondContact O-CB 3.3Å; R707-H710 VanDerWaalsContact O-CG 3.26Å; R707-H710 PolarHBondContact O-N 3.11Å; R707-H710 VanDerWaalsContact O-N 3.11Å
708	E	89.8	Confident	83.2	Confident	101 Å²	101	84 Å²	84	47%	0.472	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-21.9	-176.3	67.6	-106.1	102.6	0	0	114.6	H702 R704 G706 H710	H702-E708 VanDerWaalsContact O-CA 3.3Å; H702-E708 WeakPolarHBondContact O-CA 3.43Å; R704-E708 PolarHBondContact O-N 3.47Å; G706-E708 PolarHBondContact N-OE1 3.46Å; E708-H710 VanDerWaalsContact C-N 3.28Å; E708-H710 PolarHBondContact O-N 3.09Å
709	F	91.6	Very high	80.4	Confident	167 Å²	167	89.5 Å²	89.5	73%	0.732	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83	-1.6	177.9	-55.9	-75.1	0	0	0	113.8	R707	R707-F709 PolarHBondContact O-N 3.35Å
710	H	94.6	Very high	77.4	Confident	20 Å²	20	97.3 Å²	97.3	9%	0.093	53%	0.529	C	S	.	.	P	Polyproline II helix	trans	-76	129.2	-180	-64.9	-171.3	0	0	0	110.4	C684 N686 T688 C689 W698 H702 R707 E708	C684-H710 PolarHBondContact SG-ND1 2.92Å; N686-H710 VanDerWaalsContact CG-NE2 3.3Å; N686-H710 PolarHBondContact ND2-CD2 3.25Å; N686-H710 VanDerWaalsContact ND2-CD2 3.31Å; N686-H710 PolarHBondContact ND2-NE2 2.76Å; T688-H710 PolarHBondContact OG1-CE1 3.31Å; T688-H710 VanDerWaalsContact OG1-CE1 3.25Å; C689-H710 VanDerWaalsContact SG-CE1 3.52Å; W698-H710 HydrophobicContact CH2-CB 4.37Å; H702-H710 VanDerWaalsContact CD2-CB 3.46Å; H702-H710 WeakPolarHBondContact CD2-CB 3.42Å; H702-H710 AromaticContact CD2-CG 3.68Å; H702-H710 AromaticContact CD2-ND1 3.35Å; H702-H710 PolarHBondContact CD2-ND1 3.47Å; H702-H710 VanDerWaalsContact CD2-ND1 3.35Å; H702-H710 AromaticContact NE2-CG 3.93Å; H702-H710 AromaticContact NE2-ND1 3.26Å; H702-H710 PolarHBondContact NE2-ND1 2.82Å; R707-H710 VanDerWaalsContact O-CB 3.32Å; R707-H710 WeakPolarHBondContact O-CB 3.3Å; R707-H710 VanDerWaalsContact O-CG 3.26Å; R707-H710 PolarHBondContact O-N 3.11Å; R707-H710 VanDerWaalsContact O-N 3.11Å; E708-H710 VanDerWaalsContact C-N 3.28Å; E708-H710 PolarHBondContact O-N 3.09Å
711	K	91.9	Very high	74.7	Confident	176 Å²	176	100.7 Å²	100.7	77%	0.765	55%	0.547	S	S	*	.	P	Polyproline II helix	trans	-96.7	132.2	174.6	-64	-175.2	178.5	-175	0	109.6
712	P	91.4	Very high	72.1	Confident	45 Å²	45	110.3 Å²	110.3	29%	0.292	58%	0.582	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-70.2	136.4	172	29.3	-30.7	0	0	0	108.9	F682 W698 V714	F682-P712 HydrophobicContact CB-CB 4.04Å; F682-P712 HydrophobicContact CD1-CB 3.96Å; F682-P712 HydrophobicContact CG-CB 4.16Å; W698-P712 HydrophobicContact CD2-CB 4.28Å; W698-P712 HydrophobicContact CE3-CB 4.09Å; W698-P712 VanDerWaalsContact CH2-CA 3.43Å; W698-P712 HydrophobicContact CH2-CB 3.61Å; W698-P712 HydrophobicContact CH2-CG 4.24Å; W698-P712 VanDerWaalsContact CH2-N 3.33Å; W698-P712 HydrophobicContact CZ2-CB 3.78Å; W698-P712 VanDerWaalsContact CZ2-CD 3.5Å; W698-P712 HydrophobicContact CZ2-CG 3.95Å; W698-P712 HydrophobicContact CZ3-CB 3.72Å; P712-V714 HydrophobicContact CB-CG2 4.16Å; P712-V714 HydrophobicContact CG-CG2 4.09Å; P712-V714 PolarHBondContact O-N 3.45Å
713	L	89.9	Confident	69.1	Low	79 Å²	79	117.3 Å²	117.3	41%	0.414	61%	0.614	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-79.4	110.9	154.8	-61.8	-170.2	0	0	0	106.6	V661 F683 A685	V661-L713 HydrophobicContact CG2-CD1 3.97Å; F683-L713 HydrophobicContact CB-CB 4.48Å; F683-L713 HydrophobicContact CD1-CD1 4.22Å; F683-L713 PolarHBondContact N-O 3.13Å; F683-L713 PolarHBondContact O-N 2.92Å; A685-L713 HydrophobicContact CB-CD1 3.74Å; A685-L713 HydrophobicContact CB-CG 4Å
714	V	83.5	Confident	66.4	Low	82 Å²	82	118 Å²	118	50%	0.497	61%	0.61	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-100.9	129.8	172.2	-159.6	0	0	0	0	106.9	F682 P712 E716	F682-V714 HydrophobicContact CD1-CB 4.42Å; F682-V714 HydrophobicContact CD1-CG1 4.14Å; F682-V714 HydrophobicContact CD1-CG2 3.81Å; F682-V714 HydrophobicContact CE1-CB 4.48Å; F682-V714 HydrophobicContact CE1-CG1 3.93Å; F682-V714 HydrophobicContact CE1-CG2 3.82Å; P712-V714 HydrophobicContact CB-CG2 4.16Å; P712-V714 HydrophobicContact CG-CG2 4.09Å; P712-V714 PolarHBondContact O-N 3.45Å; V714-E716 PolarHBondContact O-N 3.3Å
715	K	63.2	Low	63.6	Low	125 Å²	125	113.9 Å²	113.9	54%	0.543	61%	0.607	S	S	.	*			trans	-91.3	104.1	174.9	-166.2	-179.1	-171.6	-178.8	0	110	D663 G717	D663-K715 WeakPolarHBondContact OD1-CD 3.46Å; D663-K715 WeakPolarHBondContact OD1-CE 3.38Å; D663-K715 IonicContact OD1-NZ 2.79Å; D663-K715 PolarHBondContact OD1-NZ 2.61Å; D663-K715 IonicContact OD2-NZ 3.84Å; D663-K715 PolarHBondContact OD2-NZ 3.3Å; K715-G717 PolarHBondContact O-N 2.91Å
716	E	49.7	Very low	60.8	Low	186 Å²	186	115.6 Å²	115.6	87%	0.869	60%	0.597	S	S	*	*			trans	-71.3	122.5	169.6	-66.7	-174	163.2	0	0	110.3	V714	V714-E716 PolarHBondContact O-N 3.3Å
717	G	41.3	Very low	58	Low	54 Å²	54	121 Å²	121	56%	0.557	60%	0.6	S	S	*	*			trans	86.8	72.3	162.4	0	0	0	0	0	116.8	K715 D719	K715-G717 PolarHBondContact O-N 2.91Å; G717-D719 PolarHBondContact O-N 3.32Å; G717-D719 VanDerWaalsContact O-N 3.12Å
718	G	40.1	Very low	55.5	Low	79 Å²	79	123.4 Å²	123.4	81%	0.814	61%	0.609	S	S	*	*	S	Bend	trans	-71	17.5	155.4	0	0	0	0	0	113.9
719	D	36.3	Very low	52.8	Low	151 Å²	151	127.2 Å²	127.2	81%	0.807	63%	0.632	S	S	*	*			trans	-138.7	41	-162.4	-149.6	-16.9	0	0	0	110.8	G717	G717-D719 PolarHBondContact O-N 3.32Å; G717-D719 VanDerWaalsContact O-N 3.12Å
720	R	32.5	Very low	50.8	Low	222 Å²	222	125.3 Å²	125.3	84%	0.838	63%	0.627	S	S	*	*			trans	-136.7	87.4	176.9	-161.8	170.7	-166	159.8	6.7	112	R722	R720-R722 PolarHBondContact O-N 3.36Å
721	P	37	Very low	48.5	Very low	113 Å²	113	130.8 Å²	130.8	73%	0.734	66%	0.656	S	S	*	*			trans	-53	125.7	172.3	-25.8	34.9	0	0	0	110.9	H723	P721-H723 PolarHBondContact O-N 3.25Å
722	R	37.3	Very low	46.1	Very low	219 Å²	219	128.3 Å²	128.3	83%	0.826	65%	0.649	S	S	*	*			trans	-82.2	41.3	-177.7	-68.8	-170.4	-66.8	-142.3	-4.2	112.9	R720 I724	R720-R722 PolarHBondContact O-N 3.36Å; R722-I724 PolarHBondContact O-N 3.38Å
723	H	31.7	Very low	43.5	Very low	159 Å²	159	133.2 Å²	133.2	74%	0.736	67%	0.67	S	S	*	*			trans	-80.4	83.6	177.7	-164.5	-115.8	0	0	0	110.5	P721 S725	P721-H723 PolarHBondContact O-N 3.25Å; H723-S725 PolarHBondContact CE1-OG 3.5Å; H723-S725 PolarHBondContact ND1-OG 3.18Å; H723-S725 PolarHBondContact O-N 3.48Å
724	I	36.5	Very low	40.6	Very low	106 Å²	106	136.6 Å²	136.6	54%	0.544	69%	0.687	S	S	.	*			trans	-88.9	94.4	167.3	-62.5	176.6	0	0	0	107	R722 F726	R722-I724 PolarHBondContact O-N 3.38Å; I724-F726 HydrophobicContact CG2-CD2 4.19Å; I724-F726 HydrophobicContact CG2-CE2 3.83Å; I724-F726 HydrophobicContact CG2-CZ 4.23Å; I724-F726 PolarHBondContact O-N 2.97Å
725	S	30	Very low	37.7	Very low	79 Å²	79	140.2 Å²	140.2	55%	0.552	70%	0.699	S	S	*	*			trans	-71.7	95.8	175.9	-51.9	0	0	0	0	111.1	H723 R727	H723-S725 PolarHBondContact CE1-OG 3.5Å; H723-S725 PolarHBondContact ND1-OG 3.18Å; H723-S725 PolarHBondContact O-N 3.48Å; S725-R727 VanDerWaalsContact C-N 3.29Å; S725-R727 PolarHBondContact O-N 2.72Å
726	F	29.6	Very low	35.9	Very low	127 Å²	127	141.3 Å²	141.3	56%	0.557	71%	0.71	S	S	*	*			trans	-71.1	93	155.1	-73.9	-69.3	0	0	0	108.4	I724 W728	I724-F726 HydrophobicContact CG2-CD2 4.19Å; I724-F726 HydrophobicContact CG2-CE2 3.83Å; I724-F726 HydrophobicContact CG2-CZ 4.23Å; I724-F726 PolarHBondContact O-N 2.97Å; F726-W728 VanDerWaalsContact C-N 3.34Å; F726-W728 PolarHBondContact O-N 3.47Å
727	R	28.8	Very low	34.8	Very low	171 Å²	171	137.8 Å²	137.8	65%	0.645	70%	0.698	S	S	*	*			trans	-73.3	89.4	174.5	-179.4	-177.6	161.5	153.4	-0.6	109.3	S725 N729	S725-R727 VanDerWaalsContact C-N 3.29Å; S725-R727 PolarHBondContact O-N 2.72Å; R727-N729 PolarHBondContact NE-OD1 3.43Å; R727-N729 PolarHBondContact NH2-OD1 3.29Å
728	W	38.2	Very low	34.3	Very low	131 Å²	131	144.8 Å²	144.8	50%	0.496	71%	0.71	S	S	.	*			trans	-54.3	138.3	160.3	-60.4	86.6	0	0	0	109.4	I499 Q523 F726	I499-W728 HydrophobicContact CD1-CE3 4.31Å; I499-W728 HydrophobicContact CD1-CH2 3.53Å; I499-W728 HydrophobicContact CD1-CZ2 4.46Å; I499-W728 HydrophobicContact CD1-CZ3 3.44Å; I499-W728 VanDerWaalsContact CD1-CZ3 3.44Å; I499-W728 HydrophobicContact CG1-CH2 4.03Å; I499-W728 HydrophobicContact CG1-CZ3 3.93Å; Q523-W728 HydrophobicContact CG-CH2 4.24Å; Q523-W728 HydrophobicContact CG-CZ3 4.23Å; F726-W728 VanDerWaalsContact C-N 3.34Å; F726-W728 PolarHBondContact O-N 3.47Å
729	N	33.7	Very low	33.8	Very low	181 Å²	181	150.8 Å²	150.8	97%	0.968	70%	0.7	S	S	*	*			trans	-156.3	0	-177.1	-150.4	126.1	0	0	0	110.5	R727	R727-N729 PolarHBondContact NE-OD1 3.43Å; R727-N729 PolarHBondContact NH2-OD1 3.29Å

Retrieved 729 of 729 residues in 410.7 ms (Link to these results)

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