A0A087XCT9_POEFO Loading...

Cytoplasmic polyadenylation element binding protein 4

AlphaFold DB , UniProt , Accession A0A087XCT9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 752 aa.

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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	33.3	Very low	31.8	Very low	241 Å²	241	150.8 Å²	150.8	100%	1.187	85%	0.85	S	S	*	*				0	123.8	0	-62.2	66.9	178.6	0	0	105.3
2	G	33.8	Very low	31.5	Very low	65 Å²	65	151 Å²	151	67%	0.67	85%	0.847	S	S	*	*			cis	108.9	125.5	29.2	0	0	0	0	0	107.1
3	D	31	Very low	31.2	Very low	161 Å²	161	150.6 Å²	150.6	86%	0.861	84%	0.842	S	S	*	*			cis	-144.6	157.4	13.4	-96.1	-95.1	0	0	0	112.9
4	Y	31.9	Very low	31.2	Very low	235 Å²	235	149.4 Å²	149.4	92%	0.922	84%	0.841	S	S	*	*			trans	-100.5	97.1	169.8	-93.2	-88.2	0	0	0	109.8
5	G	32.7	Very low	31.1	Very low	82 Å²	82	144.6 Å²	144.6	85%	0.845	84%	0.838	S	S	*	*			trans	-92.5	102.8	175.1	0	0	0	0	0	112.4
6	F	33.1	Very low	31.3	Very low	202 Å²	202	146 Å²	146	89%	0.886	84%	0.841	S	S	*	*			trans	-93.3	133.4	172.2	-134.6	-86.5	0	0	0	110.4
7	G	30.4	Very low	31.3	Very low	72 Å²	72	149.4 Å²	149.4	74%	0.742	84%	0.844	S	S	*	*			trans	-127	136.6	178.4	0	0	0	0	0	111.5
8	V	33.8	Very low	31.4	Very low	118 Å²	118	147.1 Å²	147.1	72%	0.715	84%	0.839	S	S	*	*			trans	-120.2	133.3	-170.8	176.8	0	0	0	0	111.7
9	L	30.4	Very low	31.4	Very low	169 Å²	169	144.7 Å²	144.7	89%	0.885	84%	0.839	S	S	*	*			trans	-136.8	102.5	156.3	-84.6	167.3	0	0	0	106.2
10	V	29.9	Very low	31	Very low	123 Å²	123	147.7 Å²	147.7	75%	0.745	84%	0.842	S	S	*	*				61	106.8	85	179.4	0	0	0	0	111.6
11	Q	29.5	Very low	32.3	Very low	191 Å²	191	145.8 Å²	145.8	89%	0.893	84%	0.835	S	S	*	*			trans	-119.1	124.3	173.4	-174.6	170.8	1.1	0	0	108.9
12	N	27.9	Very low	32.2	Very low	153 Å²	153	140.6 Å²	140.6	82%	0.818	82%	0.817	S	S	*	*			trans	-90.9	150.9	180	-160.6	2.6	0	0	0	110.6
13	N	28.3	Very low	32.1	Very low	146 Å²	146	148.5 Å²	148.5	78%	0.781	83%	0.826	S	S	*	*			trans	-134.8	119.3	-169.2	-171.8	2	0	0	0	112.2
14	T	30.9	Very low	32	Very low	134 Å²	134	148.4 Å²	148.4	82%	0.822	82%	0.824	S	S	*	*			trans	-139.7	115.3	175.4	52.1	0	0	0	0	110.2
15	G	30.3	Very low	32	Very low	77 Å²	77	145.7 Å²	145.7	79%	0.794	82%	0.82	S	S	*	*			trans	-105.4	127.2	178.7	0	0	0	0	0	113
16	N	32.8	Very low	33	Very low	167 Å²	167	146.3 Å²	146.3	89%	0.893	81%	0.809	S	S	*	*			trans	-90.2	141.1	177.3	-93	-17.4	0	0	0	113.1
17	K	32.3	Very low	32.9	Very low	203 Å²	203	144.3 Å²	144.3	88%	0.883	80%	0.802	S	S	*	*			trans	-153.2	151.3	156.3	-69.1	-168.6	-178.2	178.8	0	109.9
18	S	33	Very low	33	Very low	108 Å²	108	148.4 Å²	148.4	76%	0.755	81%	0.806	S	S	*	*			cis	165.7	110.4	-43.9	49.9	0	0	0	0	109.4
19	A	30.6	Very low	32.9	Very low	102 Å²	102	149.7 Å²	149.7	84%	0.843	80%	0.804	S	S	*	*			trans	-172.2	161.7	162	0	0	0	0	0	113
20	F	24.8	Very low	33.2	Very low	205 Å²	205	147.2 Å²	147.2	90%	0.899	80%	0.798	S	S	*	*			trans	-127.9	-172.6	-179.8	-78	-90	0	0	0	109.2
21	P	58.5	Low	33.2	Very low	108 Å²	108	147.9 Å²	147.9	70%	0.701	79%	0.793	S	S	*	*				-130.9	-172.5	-54	36.8	-20	0	0	0	112.4
22	V	29.7	Very low	33.3	Very low	132 Å²	132	145.3 Å²	145.3	80%	0.8	78%	0.781	S	S	*	*				169.1	114.4	127.3	155.6	0	0	0	0	114.4
23	R	32	Very low	33.4	Very low	230 Å²	230	146.9 Å²	146.9	87%	0.868	78%	0.783	S	S	*	*			trans	15.6	126.6	138	-110.2	-179.1	-163.6	156.7	4.2	122.1
24	I	30.3	Very low	33.5	Very low	160 Å²	160	146.2 Å²	146.2	82%	0.821	78%	0.775	S	S	*	*				175.4	160.1	109.7	-90.4	158.6	0	0	0	112.1
25	H	31.5	Very low	33.5	Very low	178 Å²	178	146.9 Å²	146.9	82%	0.824	77%	0.769	S	S	*	*			trans	-127.1	-174.9	-174.1	-105.5	-93.6	0	0	0	109.6
26	P	54	Low	33.3	Very low	95 Å²	95	150 Å²	150	62%	0.617	77%	0.767	S	S	*	*			cis	-132.6	-176.1	-13.1	37.8	-20	0	0	0	114.2
27	H	30.8	Very low	33	Very low	160 Å²	160	147.6 Å²	147.6	74%	0.741	76%	0.758	S	S	*	*				-176.7	138.2	117.8	-110.7	-94.2	0	0	0	115.7
28	L	31.8	Very low	32.8	Very low	157 Å²	157	142.9 Å²	142.9	82%	0.822	75%	0.751	S	S	*	*			trans	58.4	120.7	151.5	-73.4	164.9	0	0	0	125.7
29	Q	31.1	Very low	32.5	Very low	145 Å²	145	146.6 Å²	146.6	68%	0.678	76%	0.756	S	S	*	*			trans	-71.1	-178	149.4	-96.5	176	-21.1	0	0	112.3	Q31	Q29-Q31 HydrophobicContact CG-CG 4.34Å
30	P	37.3	Very low	32.7	Very low	118 Å²	118	147.2 Å²	147.2	77%	0.766	75%	0.754	S	S	*	*			cis	-123.9	157	21	13.6	13.9	0	0	0	115.7
31	Q	29.7	Very low	33.2	Very low	136 Å²	136	143.6 Å²	143.6	64%	0.636	75%	0.751	S	S	*	*				64.9	141.5	66.3	-62.1	-135.3	-51.9	0	0	114.8	Q29	Q29-Q31 HydrophobicContact CG-CG 4.34Å
32	H	31.5	Very low	31.6	Very low	137 Å²	137	142.9 Å²	142.9	63%	0.634	75%	0.754	S	S	*	*			cis	172.2	141.4	-12.5	-119.7	-103.9	0	0	0	105
33	H	29.6	Very low	31.5	Very low	186 Å²	186	140.4 Å²	140.4	86%	0.861	75%	0.748	S	S	*	*			trans	-161.7	-178.8	141.8	-119.4	68.9	0	0	0	114.8
34	H	30.6	Very low	31.2	Very low	133 Å²	133	139 Å²	139	62%	0.616	75%	0.748	S	S	*	*			trans	-135.5	156.3	-145.1	-102.4	-44.8	0	0	0	116.6
35	Q	32.1	Very low	31	Very low	148 Å²	148	139 Å²	139	69%	0.692	75%	0.748	S	S	*	*			trans	58.5	119.8	140.9	-64.3	169.1	34.6	0	0	122.1
36	N	25.9	Very low	30.8	Very low	142 Å²	142	136.1 Å²	136.1	76%	0.759	74%	0.739	S	S	*	*				-173.9	132	102	-102.4	-15.7	0	0	0	109.7
37	V	26.5	Very low	29.5	Very low	117 Å²	117	137.4 Å²	137.4	71%	0.709	75%	0.75	S	S	*	*				82.2	103.7	71.1	172.7	0	0	0	0	114.4
38	S	27.5	Very low	29.3	Very low	103 Å²	103	135.1 Å²	135.1	72%	0.72	75%	0.748	S	S	*	*			trans	49.1	129.7	144.3	-52.5	0	0	0	0	122.5
39	Q	27.9	Very low	29	Very low	187 Å²	187	134.6 Å²	134.6	87%	0.874	75%	0.751	S	S	*	*				165.5	149.1	106.3	-88.1	-175.9	15.6	0	0	112.6
40	S	33.9	Very low	29	Very low	114 Å²	114	131.8 Å²	131.8	80%	0.797	75%	0.753	S	S	*	*			trans	-92.8	147.8	159.8	-48.3	0	0	0	0	109.6
41	P	35.5	Very low	28.5	Very low	129 Å²	129	133.6 Å²	133.6	84%	0.838	76%	0.762	S	S	*	*				-140.2	-173.4	126	38.8	-26.6	0	0	0	112.9
42	A	25.7	Very low	28.5	Very low	93 Å²	93	130.3 Å²	130.3	77%	0.769	77%	0.765	S	S	*	*			trans	-138.4	176	-177.9	0	0	0	0	0	111.9
43	A	26.3	Very low	28.3	Very low	80 Å²	80	132.4 Å²	132.4	66%	0.661	78%	0.781	S	S	*	*			trans	74.1	109.7	147.6	0	0	0	0	0	120.4
44	F	26.8	Very low	28.1	Very low	201 Å²	201	127.3 Å²	127.3	88%	0.882	78%	0.778	S	S	*	*			trans	68.2	168	152.3	-71	-88	0	0	0	115.4
45	I	26.2	Very low	28	Very low	160 Å²	160	127 Å²	127	82%	0.821	79%	0.786	S	S	*	*			cis	-140.9	138.7	33.5	-47.3	172.3	0	0	0	114.1
46	N	26.9	Very low	27.9	Very low	117 Å²	117	126.6 Å²	126.6	63%	0.626	79%	0.794	S	S	*	*			trans	-30.5	152.7	154.9	176.5	34.9	0	0	0	118.1
47	S	25.3	Very low	28	Very low	123 Å²	123	123.9 Å²	123.9	86%	0.86	80%	0.799	S	S	*	*			trans	-161.2	136.1	141	-85.6	0	0	0	0	114.7
48	T	26.6	Very low	28	Very low	112 Å²	112	122 Å²	122	69%	0.687	80%	0.803	S	S	*	*			trans	-85.6	152.7	-175.1	42.4	0	0	0	0	116.1
49	T	27	Very low	28.5	Very low	145 Å²	145	123 Å²	123	89%	0.89	81%	0.81	S	S	*	*			trans	-162.2	134.8	130.1	25	0	0	0	0	108.5
50	A	29.8	Very low	29.2	Very low	87 Å²	87	119.8 Å²	119.8	72%	0.719	81%	0.806	S	S	*	*			cis	103.5	87.8	13.2	0	0	0	0	0	116
51	T	28.3	Very low	29.3	Very low	155 Å²	155	125 Å²	125	95%	0.951	81%	0.808	S	S	*	*			trans	-151.1	161.6	156	30	0	0	0	0	108.4
52	G	27.9	Very low	28.9	Very low	67 Å²	67	127 Å²	127	69%	0.691	81%	0.811	S	S	*	*			trans	-162.7	-152.2	-171.8	0	0	0	0	0	116.1
53	N	27.9	Very low	29.4	Very low	182 Å²	182	131 Å²	131	97%	0.973	81%	0.811	S	S	*	*			trans	79.6	140.7	-168.5	-61.5	-12.2	0	0	0	115.5
54	G	26.2	Very low	29.8	Very low	79 Å²	79	133.3 Å²	133.3	81%	0.814	82%	0.82	S	S	*	*			trans	148.9	48.8	176.7	0	0	0	0	0	116.8
55	T	28.2	Very low	29.7	Very low	127 Å²	127	130.1 Å²	130.1	78%	0.779	82%	0.817	S	S	*	*			trans	-61.2	144.2	177.1	48.8	0	0	0	0	114.8
56	T	29.4	Very low	29.7	Very low	139 Å²	139	128 Å²	128	85%	0.853	82%	0.816	S	S	*	*				169.6	136.5	113.6	39.4	0	0	0	0	113.9
57	G	29.1	Very low	29.8	Very low	85 Å²	85	126.5 Å²	126.5	88%	0.876	82%	0.82	S	S	*	*			trans	70.4	153.1	156.7	0	0	0	0	0	118.1
58	G	26.6	Very low	29.9	Very low	76 Å²	76	127 Å²	127	78%	0.784	82%	0.818	S	S	*	*			cis	144.8	107.7	-5.7	0	0	0	0	0	112.2
59	S	36.8	Very low	30	Very low	125 Å²	125	128.7 Å²	128.7	87%	0.874	82%	0.818	S	S	*	*			trans	-66.4	150.4	177	-44.5	0	0	0	0	112.2
60	P	42.1	Very low	29.9	Very low	120 Å²	120	128.4 Å²	128.4	78%	0.779	81%	0.811	S	S	*	*				-144.5	169.7	115.7	38.7	-25.6	0	0	0	115.7
61	W	36.5	Very low	29.8	Very low	222 Å²	222	128.5 Å²	128.5	84%	0.841	81%	0.806	S	S	*	*			trans	-63.9	149.9	167.6	-61.6	76.8	0	0	0	113.1
62	L	27.3	Very low	29.8	Very low	172 Å²	172	127.1 Å²	127.1	90%	0.901	80%	0.797	S	S	*	*			trans	-153.1	138.4	140.7	-79.1	-170.9	0	0	0	111.1
63	F	35.9	Very low	29.9	Very low	177 Å²	177	131.1 Å²	131.1	78%	0.776	80%	0.798	S	S	*	*			trans	-92.4	159.7	152.3	-75.9	-89.2	0	0	0	108.6
64	P	34.8	Very low	30	Very low	129 Å²	129	127 Å²	127	84%	0.838	78%	0.776	S	S	*	*				-142.9	176.9	122.8	36.8	-22.2	0	0	0	115.9
65	T	24.3	Very low	30.3	Very low	134 Å²	134	130.4 Å²	130.4	82%	0.822	77%	0.771	S	S	*	*			trans	-102.3	149.1	-162.2	50.8	0	0	0	0	116.4
66	S	27.5	Very low	30.9	Very low	114 Å²	114	130.6 Å²	130.6	80%	0.797	77%	0.766	S	S	*	*			trans	-173.9	134.3	142.1	46	0	0	0	0	108.3
67	A	27.6	Very low	31.1	Very low	86 Å²	86	131.8 Å²	131.8	71%	0.711	77%	0.766	S	S	*	*				65.6	129.5	53.7	0	0	0	0	0	113.2
68	T	27.4	Very low	31.1	Very low	133 Å²	133	131 Å²	131	82%	0.816	76%	0.758	S	S	*	*			cis	-163.2	-174.5	-7.4	20	0	0	0	0	106.9
69	H	29.8	Very low	31.2	Very low	149 Å²	149	131.4 Å²	131.4	69%	0.69	76%	0.762	S	S	*	*			cis	-161	-172.4	15.8	-158.9	-108.3	0	0	0	110.8
70	N	25.4	Very low	30.7	Very low	138 Å²	138	130.2 Å²	130.2	74%	0.738	76%	0.759	S	S	*	*			trans	75	128.4	169.9	-52.5	-29.7	0	0	0	116.2
71	S	26.8	Very low	29.9	Very low	90 Å²	90	131.2 Å²	131.2	63%	0.629	75%	0.754	S	S	*	*			cis	80.8	133.8	29	-162.3	0	0	0	0	113.7
72	V	29.2	Very low	29.5	Very low	125 Å²	125	128 Å²	128	76%	0.758	75%	0.746	S	S	*	*			cis	-113	176.7	11.8	-68.4	0	0	0	0	112
73	Q	28.7	Very low	29.8	Very low	152 Å²	152	126.3 Å²	126.3	71%	0.71	75%	0.745	S	S	*	*			cis	78.4	145.1	20.5	-65.1	-173.8	-102	0	0	115.9
74	D	30.1	Very low	29.3	Very low	94 Å²	94	127.1 Å²	127.1	50%	0.503	75%	0.748	S	S	.	*			cis	-153.3	-169	3.3	-143.3	-95.5	0	0	0	113.2
75	E	31.9	Very low	29	Very low	152 Å²	152	125 Å²	125	71%	0.71	74%	0.742	S	S	*	*			trans	-103.2	157.1	-170.3	-79.2	-175.6	95.5	0	0	117.1
76	I	42.2	Very low	29.1	Very low	131 Å²	131	127.6 Å²	127.6	67%	0.672	75%	0.745	S	S	*	*			trans	32.9	143.9	132.3	-47.4	172.5	0	0	0	121.3
77	L	33.8	Very low	29	Very low	164 Å²	164	129.8 Å²	129.8	86%	0.859	74%	0.742	S	S	*	*			trans	146	148.8	135.9	-76.9	168.4	0	0	0	112.5
78	G	29.2	Very low	28.9	Very low	69 Å²	69	133 Å²	133	71%	0.711	74%	0.742	S	S	*	*			cis	167.9	164.9	-8.8	0	0	0	0	0	114.4
79	G	27.3	Very low	28.9	Very low	84 Å²	84	132.8 Å²	132.8	87%	0.866	73%	0.732	S	S	*	*			trans	87.2	159.7	171.5	0	0	0	0	0	116.3
80	A	26.6	Very low	28.6	Very low	99 Å²	99	132.4 Å²	132.4	82%	0.818	73%	0.731	S	S	*	*			cis	-170.8	161.4	-3.6	0	0	0	0	0	108
81	E	26.1	Very low	28.5	Very low	142 Å²	142	132.3 Å²	132.3	66%	0.664	73%	0.728	S	S	*	*			cis	-164.8	174.4	-9.4	50.2	133	24.7	0	0	110.5
82	K	28	Very low	28.4	Very low	154 Å²	154	135.5 Å²	135.5	67%	0.67	73%	0.732	S	S	*	*			trans	67.8	144.5	170.9	-72.7	-176.5	-178.4	76	0	117.6
83	P	34.2	Very low	28.3	Very low	136 Å²	136	138.5 Å²	138.5	88%	0.883	74%	0.738	S	S	*	*				-127.5	-173.3	82.1	39.6	-31	0	0	0	114.8
84	K	25.4	Very low	28	Very low	194 Å²	194	134.9 Å²	134.9	84%	0.843	73%	0.726	S	S	*	*			trans	-145.9	162.3	-176.6	-176.5	-176.6	177.1	-171.9	0	109
85	A	27.2	Very low	27.8	Very low	86 Å²	86	139.2 Å²	139.2	71%	0.711	74%	0.744	S	S	*	*			trans	74.1	156	171.3	0	0	0	0	0	115.9
86	Q	26.5	Very low	27.5	Very low	188 Å²	188	138.7 Å²	138.7	88%	0.879	74%	0.741	S	S	*	*			cis	-163.5	163.8	-25.8	176.1	159.8	-36.1	0	0	108.7
87	Q	26.5	Very low	26.7	Very low	159 Å²	159	139.9 Å²	139.9	74%	0.743	74%	0.742	S	S	*	*			trans	-103.9	163.4	179.2	-159.7	-179	28.1	0	0	110.8
88	Q	25.5	Very low	26.2	Very low	154 Å²	154	139.6 Å²	139.6	72%	0.72	74%	0.736	S	S	*	*			trans	70.7	144.5	175.8	-61.3	171.9	-60	0	0	113.9
89	Q	26	Very low	26	Very low	128 Å²	128	142.4 Å²	142.4	60%	0.598	73%	0.73	S	S	*	*			cis	-139.6	-134.8	-3.7	-141	150.6	-111.9	0	0	109.9
90	E	25	Very low	25.8	Very low	141 Å²	141	145.4 Å²	145.4	66%	0.659	72%	0.722	S	S	*	*			cis	-138.4	-150.5	8.5	-159.4	53.3	91.7	0	0	111.1
91	M	23.1	Very low	25.8	Very low	137 Å²	137	148 Å²	148	68%	0.675	72%	0.721	S	S	*	*			trans	-131.3	147.3	-161.9	-82.5	-176.1	-75.7	0	0	111.8
92	Q	24.2	Very low	25.6	Very low	156 Å²	156	146.4 Å²	146.4	73%	0.729	73%	0.726	S	S	*	*				50.8	108.8	126.3	-169.2	176.6	-9.3	0	0	120.9
93	E	26	Very low	26	Very low	189 Å²	189	145 Å²	145	88%	0.883	73%	0.732	S	S	*	*				-155.3	168.3	121.5	-102.4	-166.7	88.9	0	0	109.4
94	T	24.2	Very low	25.6	Very low	75 Å²	75	142.5 Å²	142.5	46%	0.46	73%	0.731	S	S	.	*				-176.1	130.7	-60.3	-84.7	0	0	0	0	106.7
95	Q	24.1	Very low	25.6	Very low	185 Å²	185	136.8 Å²	136.8	86%	0.864	73%	0.727	S	S	*	*			trans	61.4	170.7	168.5	-74.5	170	-29.6	0	0	116.2
96	E	25.7	Very low	25.5	Very low	142 Å²	142	141.3 Å²	141.3	66%	0.664	73%	0.734	S	S	*	*			cis	-128.1	142.4	5.4	-122.6	-168	129.1	0	0	111.1
97	K	25.6	Very low	25.5	Very low	155 Å²	155	140.8 Å²	140.8	67%	0.674	73%	0.731	S	S	*	*				61.5	114.4	123.7	-161.3	168.1	172.9	-170.9	0	119.4
98	Q	22.9	Very low	25.5	Very low	158 Å²	158	141 Å²	141	74%	0.738	73%	0.732	S	S	*	*				73.4	134.5	54.5	-156.3	-160.9	83.8	0	0	114.3
99	Q	25.5	Very low	25.6	Very low	128 Å²	128	140.5 Å²	140.5	60%	0.598	74%	0.74	S	S	*	*			trans	96.2	112.4	162.2	-52.2	-165.4	17.5	0	0	120.6
100	Q	24.5	Very low	25.7	Very low	148 Å²	148	137.5 Å²	137.5	69%	0.692	74%	0.743	S	S	*	*				88.3	138	118.9	-74.9	179.6	34	0	0	124
101	L	25	Very low	26	Very low	152 Å²	152	137.2 Å²	137.2	80%	0.796	76%	0.757	S	S	*	*			trans	68.3	118.3	142.1	-68.2	166.2	0	0	0	121.4
102	S	23.5	Very low	26.2	Very low	109 Å²	109	134.4 Å²	134.4	76%	0.762	76%	0.763	S	S	*	*			trans	-64.9	157	147.7	-33.7	0	0	0	0	110.5
103	P	36.5	Very low	26.4	Very low	125 Å²	125	131.2 Å²	131.2	81%	0.812	77%	0.772	S	S	*	*				-152.8	155.2	84.2	39	-21.1	0	0	0	117.9
104	G	24.4	Very low	26.5	Very low	83 Å²	83	125.2 Å²	125.2	86%	0.856	76%	0.761	S	S	*	*			trans	57.3	132.5	136.7	0	0	0	0	0	122
105	G	25.3	Very low	26.8	Very low	74 Å²	74	129.5 Å²	129.5	76%	0.763	78%	0.779	S	S	*	*			trans	-170.1	26.2	-179.1	0	0	0	0	0	122.1
106	H	25.1	Very low	27.2	Very low	182 Å²	182	127.9 Å²	127.9	84%	0.843	78%	0.775	S	S	*	*			trans	49.9	156.7	155	-83.6	-96.6	0	0	0	123.9
107	Q	27.5	Very low	27.4	Very low	177 Å²	177	124.6 Å²	124.6	83%	0.827	77%	0.772	S	S	*	*			trans	74.5	149.7	168.3	-63.8	175	33.7	0	0	118.4
108	E	26.7	Very low	27.5	Very low	164 Å²	164	125.3 Å²	125.3	77%	0.766	78%	0.777	S	S	*	*			cis	-170.9	172.8	-46.1	-122.2	-162.6	114.2	0	0	108.6
109	T	27.1	Very low	27.9	Very low	142 Å²	142	124 Å²	124	87%	0.871	78%	0.775	S	S	*	*			trans	66.8	140.1	177.4	76.1	0	0	0	0	116.1
110	G	28.1	Very low	27.9	Very low	66 Å²	66	124.3 Å²	124.3	68%	0.68	78%	0.777	S	S	*	*			cis	171.7	145.8	-12.5	0	0	0	0	0	113.1
111	S	30.1	Very low	28.1	Very low	135 Å²	135	124.4 Å²	124.4	94%	0.944	78%	0.775	S	S	*	*			trans	59.2	137.9	160.8	-55.8	0	0	0	0	119.8
112	G	27.9	Very low	28.2	Very low	77 Å²	77	122.1 Å²	122.1	79%	0.794	77%	0.771	S	S	*	*			cis	159.5	140.6	-7.8	0	0	0	0	0	113.3
113	G	27.8	Very low	28.4	Very low	89 Å²	89	126.7 Å²	126.7	92%	0.918	77%	0.772	S	S	*	*			trans	75.9	148.9	172.2	0	0	0	0	0	116.3
114	G	28.2	Very low	27.9	Very low	63 Å²	63	125.3 Å²	125.3	65%	0.649	77%	0.765	S	S	*	*			cis	150.2	147.9	-11.7	0	0	0	0	0	113.8
115	I	32.3	Very low	28	Very low	166 Å²	166	127.9 Å²	127.9	85%	0.851	76%	0.755	S	S	*	*			trans	58.8	151	155.6	65.3	166.4	0	0	0	119.3
116	I	32.2	Very low	28	Very low	150 Å²	150	132.6 Å²	132.6	77%	0.769	76%	0.757	S	S	*	*			cis	-163.6	180	-18.4	-110.6	166.9	0	0	0	107.7
117	A	29.1	Very low	28.1	Very low	73 Å²	73	129.1 Å²	129.1	60%	0.603	75%	0.748	S	S	*	*			trans	81.4	128.3	165.3	0	0	0	0	0	116.9
118	E	27.5	Very low	28.2	Very low	170 Å²	170	129 Å²	129	79%	0.794	75%	0.745	S	S	*	*				88.9	144.9	68.6	-81.8	-169.6	100.9	0	0	113.2
119	L	30.7	Very low	28.2	Very low	131 Å²	131	125.7 Å²	125.7	69%	0.686	74%	0.736	S	S	*	*			cis	-159.6	152.4	-9.8	-164.4	80.7	0	0	0	110.5
120	E	27.1	Very low	28.2	Very low	135 Å²	135	126.5 Å²	126.5	63%	0.631	73%	0.73	S	S	*	*			trans	62.2	155.7	148.3	-96.7	-151.6	134.9	0	0	126.1
121	K	27.1	Very low	28.1	Very low	150 Å²	150	130.6 Å²	130.6	65%	0.652	74%	0.736	S	S	*	*			trans	58.4	126.4	154.1	-71.3	-177.1	170.6	71.5	0	119.3
122	S	28.1	Very low	28	Very low	103 Å²	103	127.6 Å²	127.6	72%	0.72	73%	0.726	S	S	*	*				65	139.8	56	87.3	0	0	0	0	113.6
123	R	26.8	Very low	27.8	Very low	206 Å²	206	130.1 Å²	130.1	78%	0.777	73%	0.727	S	S	*	*			cis	-168.1	-175.4	-2	157.4	174.2	167.8	177	-3.7	105.8	E125	R123-E125 IonicContact CZ-OE2 2.65Å; R123-E125 VanDerWaalsContact CZ-OE2 3.25Å; R123-E125 IonicContact NE-OE2 3.75Å; R123-E125 PolarHBondContact NE-OE2 3.44Å; R123-E125 IonicContact NH2-OE2 2.78Å; R123-E125 PolarHBondContact NH2-OE2 2.72Å
124	S	26.4	Very low	27.8	Very low	95 Å²	95	131.1 Å²	131.1	66%	0.664	72%	0.72	S	S	*	*			trans	101.2	130.2	165.8	-55.2	0	0	0	0	113.3
125	E	26.2	Very low	27.5	Very low	137 Å²	137	137.1 Å²	137.1	64%	0.64	73%	0.731	S	S	*	*				69.3	128.8	55	-61.7	162.4	62	0	0	111.1	R123	R123-E125 IonicContact CZ-OE2 2.65Å; R123-E125 VanDerWaalsContact CZ-OE2 3.25Å; R123-E125 IonicContact NE-OE2 3.75Å; R123-E125 PolarHBondContact NE-OE2 3.44Å; R123-E125 IonicContact NH2-OE2 2.78Å; R123-E125 PolarHBondContact NH2-OE2 2.72Å
126	E	26.5	Very low	27.2	Very low	173 Å²	173	133 Å²	133	81%	0.808	73%	0.729	S	S	*	*			cis	-165.6	-157.5	-11.8	-158.6	-147.3	89.3	0	0	108.5
127	V	27.6	Very low	26.9	Very low	109 Å²	109	130.7 Å²	130.7	66%	0.661	73%	0.726	S	S	*	*			trans	70.2	94.7	160	-175.1	0	0	0	0	121.1
128	K	28.2	Very low	26.6	Very low	174 Å²	174	134.2 Å²	134.2	76%	0.757	74%	0.735	S	S	*	*				70.1	129	107.9	-140.3	-154.3	166.8	-154.8	0	123.9
129	T	26.4	Very low	26.6	Very low	96 Å²	96	129.6 Å²	129.6	59%	0.589	73%	0.733	S	S	*	*			trans	89.4	131.1	134.5	27	0	0	0	0	126.7
130	E	28.5	Very low	26.5	Very low	158 Å²	158	132.8 Å²	132.8	74%	0.738	74%	0.741	S	S	*	*			trans	87.9	114	145.1	-29.1	-137.2	156.2	0	0	125.1
131	N	26.3	Very low	26.5	Very low	153 Å²	153	135.3 Å²	135.3	82%	0.818	75%	0.753	S	S	*	*				59.4	142	127.1	-59.2	-21.1	0	0	0	125.6
132	G	26.3	Very low	26.6	Very low	71 Å²	71	136.8 Å²	136.8	73%	0.732	76%	0.759	S	S	*	*			trans	98.2	110.5	166.6	0	0	0	0	0	114.2
133	T	25.2	Very low	26.5	Very low	131 Å²	131	139.6 Å²	139.6	80%	0.804	76%	0.761	S	S	*	*			cis	95.1	102.2	27.1	-48.2	0	0	0	0	114.4
134	S	26.6	Very low	26.5	Very low	110 Å²	110	137.7 Å²	137.7	77%	0.769	77%	0.765	S	S	*	*			trans	59.2	146.3	165.4	58.6	0	0	0	0	118.1
135	E	23.6	Very low	26.4	Very low	189 Å²	189	142.7 Å²	142.7	88%	0.883	77%	0.77	S	S	*	*			cis	-148.9	162.9	28.9	-71.3	-178.1	68.9	0	0	114
136	G	24.4	Very low	26.5	Very low	78 Å²	78	143.6 Å²	143.6	80%	0.804	78%	0.778	S	S	*	*			trans	78.1	157.5	148.1	0	0	0	0	0	119.6
137	S	25.8	Very low	26.4	Very low	102 Å²	102	142.1 Å²	142.1	71%	0.713	77%	0.771	S	S	*	*			cis	-163.4	157.8	-16.8	80.9	0	0	0	0	112.3
138	N	23.3	Very low	26.2	Very low	147 Å²	147	141.7 Å²	141.7	79%	0.786	77%	0.773	S	S	*	*			trans	47.1	126.4	154.8	-68.3	-67.5	0	0	0	121.8
139	G	27.7	Very low	26.7	Very low	73 Å²	73	138.6 Å²	138.6	75%	0.753	77%	0.771	S	S	*	*			trans	-166.6	47.9	173.4	0	0	0	0	0	116.7	E141	G139-E141 PolarHBondContact O-N 2.92Å
140	K	27.6	Very low	26.7	Very low	198 Å²	198	139.7 Å²	139.7	86%	0.861	78%	0.777	S	S	*	*			trans	-48.4	127.7	-177	-62.1	164.6	-178.3	166.5	0	114.7
141	E	27.1	Very low	26.7	Very low	188 Å²	188	139.1 Å²	139.1	88%	0.879	78%	0.778	S	S	*	*			trans	-102.2	157.6	156.3	59.4	-167.8	102.4	0	0	111.7	G139	G139-E141 PolarHBondContact O-N 2.92Å
142	K	30.3	Very low	26.7	Very low	181 Å²	181	138.6 Å²	138.6	79%	0.787	78%	0.781	S	S	*	*			trans	-150.3	141.3	-169	-107.3	-166.4	174.8	-168.2	0	112
143	Q	25.2	Very low	26.6	Very low	162 Å²	162	138.3 Å²	138.3	76%	0.757	78%	0.778	S	S	*	*			trans	65.6	142.8	171.3	-86.1	152.2	-88.5	0	0	114.4
144	L	27	Very low	26.5	Very low	166 Å²	166	142.3 Å²	142.3	87%	0.869	78%	0.784	S	S	*	*			cis	-125.5	169.6	34.9	-71.9	158.9	0	0	0	115.8
145	R	25.5	Very low	26.5	Very low	201 Å²	201	143.3 Å²	143.3	76%	0.758	78%	0.781	S	S	*	*			trans	-85.5	174.3	166	-100.6	175.8	140.1	138.1	-7.4	109.4	E147	R145-E147 IonicContact NE-OE2 3.92Å; R145-E147 IonicContact NH2-OE2 3.81Å
146	L	27.7	Very low	26.6	Very low	156 Å²	156	144.6 Å²	144.6	82%	0.817	78%	0.78	S	S	*	*			cis	-136.8	167.6	29.4	-84.4	81.4	0	0	0	114.6
147	E	24.6	Very low	26.4	Very low	141 Å²	141	147.3 Å²	147.3	66%	0.659	77%	0.771	S	S	*	*			trans	-32.3	153.2	162.5	-70.2	156.5	72.3	0	0	117.7	R145	R145-E147 IonicContact NE-OE2 3.92Å; R145-E147 IonicContact NH2-OE2 3.81Å
148	S	23	Very low	26.2	Very low	100 Å²	100	149.1 Å²	149.1	70%	0.699	77%	0.769	S	S	*	*			cis	77.7	152.1	35.9	-157	0	0	0	0	113.9
149	P	38.9	Very low	26.3	Very low	110 Å²	110	148 Å²	148	71%	0.714	77%	0.767	S	S	*	*			cis	-116.5	159.9	-2.4	40.5	-26.7	0	0	0	114.6
150	V	27.1	Very low	26.2	Very low	119 Å²	119	149.8 Å²	149.8	72%	0.721	77%	0.768	S	S	*	*				58.6	115.4	74.4	-155.1	0	0	0	0	117.5
151	L	28.6	Very low	26.2	Very low	145 Å²	145	143.6 Å²	143.6	76%	0.759	76%	0.76	S	S	*	*				155.3	136	124.3	-84.4	175.9	0	0	0	115.9
152	T	25.2	Very low	26.4	Very low	142 Å²	142	143.3 Å²	143.3	87%	0.871	76%	0.764	S	S	*	*			trans	57.6	160.3	151.7	52.2	0	0	0	0	120.4
153	G	24.1	Very low	26.3	Very low	65 Å²	65	138.5 Å²	138.5	67%	0.67	77%	0.766	S	S	*	*			cis	162.6	160.3	-9.2	0	0	0	0	0	113.2
154	F	23.2	Very low	26.4	Very low	215 Å²	215	133.8 Å²	133.8	94%	0.943	76%	0.761	S	S	*	*			trans	64	146.2	166.4	-92.5	-90.4	0	0	0	123.1
155	D	27.3	Very low	26.6	Very low	131 Å²	131	133.2 Å²	133.2	70%	0.701	76%	0.764	S	S	*	*			trans	-45.1	155.3	170.5	-159.6	-80.2	0	0	0	117.2
156	Y	24.4	Very low	26.7	Very low	217 Å²	217	127 Å²	127	85%	0.851	76%	0.763	S	S	*	*			trans	-158.5	160.6	146.2	-130.7	-88.6	0	0	0	115.9
157	Q	21.3	Very low	27.6	Very low	135 Å²	135	125.5 Å²	125.5	63%	0.631	76%	0.762	S	S	*	*			trans	-83.8	153.2	-171.1	-109.7	172.5	-86.3	0	0	117.6
158	E	22.1	Very low	27.9	Very low	140 Å²	140	125 Å²	125	65%	0.654	77%	0.769	S	S	*	*				64.6	135.6	125.3	-164.2	176.1	139.2	0	0	123.4
159	T	24.2	Very low	28.2	Very low	123 Å²	123	128.1 Å²	128.1	76%	0.755	77%	0.772	S	S	*	*				171.5	117.9	123.6	32.3	0	0	0	0	111
160	S	26.7	Very low	27.7	Very low	110 Å²	110	128.4 Å²	128.4	77%	0.769	78%	0.777	S	S	*	*				72.1	131.2	99.7	-48.2	0	0	0	0	115.6
161	G	27.2	Very low	27.8	Very low	68 Å²	68	125.8 Å²	125.8	70%	0.701	76%	0.763	S	S	*	*			cis	-170.7	-163.2	-0.7	0	0	0	0	0	109
162	L	31.6	Very low	27.8	Very low	183 Å²	183	124.9 Å²	124.9	96%	0.958	76%	0.764	S	S	*	*			cis	-116.5	-118.5	-2.3	-63.8	72.9	0	0	0	108.6
163	G	27.2	Very low	27.9	Very low	80 Å²	80	123.8 Å²	123.8	83%	0.825	76%	0.757	S	S	*	*			cis	128.6	113.8	-11.3	0	0	0	0	0	113.8
164	G	28.1	Very low	28.2	Very low	63 Å²	63	125 Å²	125	65%	0.649	76%	0.755	S	S	*	*			cis	174.7	-170.3	-3	0	0	0	0	0	112.6
165	T	30.1	Very low	28.5	Very low	154 Å²	154	120 Å²	120	95%	0.945	75%	0.747	S	S	*	*			trans	70.2	138.7	175.8	70.1	0	0	0	0	118.7
166	G	27.3	Very low	28.6	Very low	70 Å²	70	118.6 Å²	118.6	72%	0.722	75%	0.748	S	S	*	*			trans	-122.8	-141.2	159.1	0	0	0	0	0	108.3
167	P	48.4	Very low	28.8	Very low	124 Å²	124	115.7 Å²	115.7	81%	0.805	75%	0.746	S	S	*	*			cis	-135.5	-141.1	-8.4	41.9	-22.8	0	0	0	111.9
168	V	29.8	Very low	29.2	Very low	132 Å²	132	116.1 Å²	116.1	80%	0.8	76%	0.758	S	S	*	*			trans	101.3	134.3	164.3	-171.9	0	0	0	0	117.1
169	Q	29.6	Very low	29.4	Very low	165 Å²	165	112.5 Å²	112.5	77%	0.771	76%	0.759	S	S	*	*			trans	-95.8	166.7	-177	-52.8	144.4	-58.7	0	0	111.8
170	S	27.6	Very low	29.5	Very low	116 Å²	116	116.6 Å²	116.6	81%	0.811	77%	0.767	S	S	*	*			trans	-166.7	145.9	138.5	-83.5	0	0	0	0	111.8
171	S	29.2	Very low	29.7	Very low	63 Å²	63	118.4 Å²	118.4	44%	0.441	77%	0.768	S	S	.	*			trans	-123	-160.3	-170.1	59	0	0	0	0	112.6
172	T	29.3	Very low	29.6	Very low	127 Å²	127	121.6 Å²	121.6	78%	0.779	77%	0.769	S	S	*	*			trans	79.3	153.4	171.1	72.9	0	0	0	0	117.5
173	T	28.3	Very low	29.4	Very low	118 Å²	118	123.8 Å²	123.8	72%	0.724	76%	0.764	S	S	*	*			cis	-152.6	151	14.8	-22.8	0	0	0	0	114.6
174	S	29.2	Very low	29.4	Very low	90 Å²	90	124.2 Å²	124.2	63%	0.629	75%	0.754	S	S	*	*			trans	36	127.5	144.1	62.6	0	0	0	0	123
175	S	30.1	Very low	29.7	Very low	110 Å²	110	126.2 Å²	126.2	77%	0.769	77%	0.765	S	S	*	*				71.8	147.5	84.6	-36.4	0	0	0	0	115.1
176	S	28.7	Very low	29.5	Very low	102 Å²	102	123.9 Å²	123.9	71%	0.713	76%	0.761	S	S	*	*			cis	-162	143.1	31.8	-80.9	0	0	0	0	115.6
177	L	29.3	Very low	30	Very low	157 Å²	157	128.1 Å²	128.1	82%	0.822	77%	0.766	S	S	*	*			trans	69.6	142.5	134.4	-63.1	173.1	0	0	0	125.6
178	T	29.6	Very low	29.4	Very low	143 Å²	143	127.7 Å²	127.7	88%	0.877	76%	0.763	S	S	*	*			trans	74.3	126.6	156	55.7	0	0	0	0	123.4
179	G	25.3	Very low	30.1	Very low	65 Å²	65	127.6 Å²	127.6	67%	0.67	77%	0.765	S	S	*	*				128	95.6	116.7	0	0	0	0	0	121.6
180	F	27.1	Very low	30.2	Very low	209 Å²	209	123.8 Å²	123.8	92%	0.917	76%	0.762	S	S	*	*			trans	67.2	-178.1	151.4	-68.8	-80.5	0	0	0	120.2
181	N	30.1	Very low	30.9	Very low	148 Å²	148	124.4 Å²	124.4	79%	0.791	76%	0.763	S	S	*	*			trans	-117.4	160.9	-149.3	-62.6	-80.7	0	0	0	115.8
182	N	26	Very low	31.1	Very low	135 Å²	135	126.3 Å²	126.3	72%	0.722	78%	0.776	S	S	*	*			trans	78.3	107.4	141.6	-169.3	23.5	0	0	0	120.5
183	W	28.1	Very low	31.5	Very low	229 Å²	229	126.4 Å²	126.4	87%	0.867	78%	0.777	S	S	*	*				-168.6	166.6	112.7	-155.7	-89.4	0	0	0	112.1
184	S	25.9	Very low	31.6	Very low	88 Å²	88	127.5 Å²	127.5	62%	0.615	78%	0.777	S	S	*	*			trans	-85.7	161.1	-176.1	-43.7	0	0	0	0	116.5
185	A	34	Very low	31.7	Very low	106 Å²	106	129.7 Å²	129.7	88%	0.876	78%	0.78	S	S	*	*			trans	49.8	131.4	140.2	0	0	0	0	0	122
186	A	27.8	Very low	31.5	Very low	104 Å²	104	131.3 Å²	131.3	86%	0.86	78%	0.78	S	S	*	*			trans	-139.2	157.4	164.4	0	0	0	0	0	111.4
187	I	35.8	Very low	31.5	Very low	160 Å²	160	133.9 Å²	133.9	82%	0.821	78%	0.781	S	S	*	*			trans	-123.5	138.8	-173.3	-62.7	168	0	0	0	109.4
188	P	36.8	Very low	31.4	Very low	115 Å²	115	133.9 Å²	133.9	75%	0.747	78%	0.782	S	S	*	*			trans	-85.3	152.2	170.2	33.8	-33	0	0	0	112.9
189	P	43.5	Very low	31.3	Very low	129 Å²	129	132.7 Å²	132.7	84%	0.838	77%	0.774	S	S	*	*			trans	-102.8	173.1	-157.8	40.2	-37.9	0	0	0	116
190	A	33.7	Very low	31.5	Very low	86 Å²	86	133.9 Å²	133.9	71%	0.711	77%	0.772	S	S	*	*			trans	-108	163.2	166.5	0	0	0	0	0	111.9
191	P	41.9	Very low	31.6	Very low	128 Å²	128	132.8 Å²	132.8	83%	0.831	77%	0.767	S	S	*	*			trans	-120.6	172.4	146.1	36.3	-26.1	0	0	0	112.4
192	S	33.6	Very low	31.4	Very low	103 Å²	103	135.4 Å²	135.4	72%	0.72	77%	0.772	S	S	*	*			trans	-134.4	-175.8	-156.8	-46.4	0	0	0	0	114.7
193	T	36	Very low	31.7	Very low	130 Å²	130	135 Å²	135	80%	0.798	77%	0.77	S	S	*	*			trans	87.1	152.5	169.6	78.8	0	0	0	0	115.8
194	I	30.9	Very low	32.5	Very low	140 Å²	140	129.7 Å²	129.7	72%	0.718	77%	0.765	S	S	*	*			cis	-155.5	153.5	11.6	-140.1	153.8	0	0	0	113.3
195	I	31	Very low	32.6	Very low	136 Å²	136	129 Å²	129	70%	0.697	77%	0.765	S	S	*	*			trans	41.2	117	154.4	-61.2	160.9	0	0	0	123.1
196	N	26.2	Very low	32.2	Very low	145 Å²	145	129.5 Å²	129.5	78%	0.775	76%	0.762	S	S	*	*				38.6	162.8	123.6	-146.9	44.5	0	0	0	125.4
197	E	28.5	Very low	32.4	Very low	156 Å²	156	128.8 Å²	128.8	73%	0.729	76%	0.756	S	S	*	*			trans	102.6	87.2	156.6	-59.3	177.4	-163.8	0	0	121.2
198	D	28.1	Very low	32.2	Very low	156 Å²	156	127.8 Å²	127.8	83%	0.834	75%	0.752	S	S	*	*				59.5	160.7	117.3	-122	-55.7	0	0	0	125.5
199	V	27.9	Very low	31.9	Very low	118 Å²	118	129 Å²	129	72%	0.715	75%	0.752	S	S	*	*			trans	71.3	84.5	164.2	-169.2	0	0	0	0	121.7
200	S	27.8	Very low	31.4	Very low	90 Å²	90	126.1 Å²	126.1	63%	0.629	75%	0.746	S	S	*	*				67.8	142	110.3	-58.1	0	0	0	0	127.6
201	F	29	Very low	32.1	Very low	186 Å²	186	127.5 Å²	127.5	82%	0.816	75%	0.748	S	S	*	*			trans	61.3	123.5	151.1	-64.3	-56.6	0	0	0	120.9
202	F	27.8	Very low	31.8	Very low	203 Å²	203	128.1 Å²	128.1	89%	0.89	74%	0.743	S	S	*	*				-151.8	160.3	69.7	-114.4	-87.2	0	0	0	115.2
203	N	31.7	Very low	31.8	Very low	126 Å²	126	130.3 Å²	130.3	67%	0.674	75%	0.746	S	S	*	*			trans	-154.8	145.1	170.8	-174.2	26.1	0	0	0	109.2	A205	N203-A205 PolarHBondContact OD1-N 3.01Å
204	P	43.7	Very low	31.3	Very low	118 Å²	118	133.7 Å²	133.7	77%	0.766	75%	0.75	S	S	*	*				-140.9	145.3	109.5	35.5	-21.7	0	0	0	113
205	A	28.4	Very low	31.3	Very low	74 Å²	74	133.4 Å²	133.4	61%	0.612	75%	0.746	S	S	*	*			cis	98.5	95.6	32.4	0	0	0	0	0	115.5	N203	N203-A205 PolarHBondContact OD1-N 3.01Å
206	S	25.3	Very low	31.2	Very low	117 Å²	117	132.2 Å²	132.2	82%	0.818	74%	0.741	S	S	*	*			trans	-165.1	121.1	141.8	-77.5	0	0	0	0	107
207	A	32.1	Very low	31.4	Very low	88 Å²	88	133.9 Å²	133.9	73%	0.727	74%	0.741	S	S	*	*				69.3	132.9	54.2	0	0	0	0	0	111.9
208	N	32.6	Very low	31.3	Very low	139 Å²	139	131.2 Å²	131.2	74%	0.743	74%	0.74	S	S	*	*			cis	-156.5	163.3	2.7	-136.2	4.2	0	0	0	107.7
209	N	31.2	Very low	31.7	Very low	141 Å²	141	132.9 Å²	132.9	75%	0.754	74%	0.742	S	S	*	*			cis	-153	165.5	28.3	-57.8	-85.8	0	0	0	111.3
210	G	32.6	Very low	32	Very low	69 Å²	69	135.7 Å²	135.7	71%	0.711	75%	0.747	S	S	*	*			trans	-110.7	-141.3	157.8	0	0	0	0	0	110.5
211	P	48	Very low	32.2	Very low	114 Å²	114	137.9 Å²	137.9	74%	0.74	76%	0.757	S	S	*	*			cis	-126.2	-178.2	-24.7	25.9	-1.3	0	0	0	111.2
212	L	35.3	Very low	32.3	Very low	142 Å²	142	134.5 Å²	134.5	74%	0.743	76%	0.756	S	S	*	*				173.6	135	78.7	-77.8	169.5	0	0	0	106.2
213	L	33.6	Very low	33.1	Very low	149 Å²	149	131.1 Å²	131.1	78%	0.78	76%	0.755	S	S	*	*				70.5	96.4	69.5	-76	177.1	0	0	0	116.6
214	F	26.6	Very low	33	Very low	201 Å²	201	128.6 Å²	128.6	88%	0.882	76%	0.759	S	S	*	*			trans	-156.3	177.3	139.6	-117.4	-71.4	0	0	0	112.5
215	Q	30.6	Very low	32.4	Very low	134 Å²	134	133.5 Å²	133.5	63%	0.626	77%	0.769	S	S	*	*			trans	-172.4	152.9	-130.7	173.8	-110.5	115.1	0	0	112.7
216	N	27.9	Very low	32.5	Very low	110 Å²	110	133.7 Å²	133.7	59%	0.588	78%	0.777	S	S	*	*			trans	65.3	155.8	-176.5	-102.4	-69.3	0	0	0	115.1
217	F	30.9	Very low	32.8	Very low	180 Å²	180	131.8 Å²	131.8	79%	0.789	78%	0.776	S	S	*	*			cis	-136.6	161.9	22.6	-78.7	-83.4	0	0	0	115.9
218	S	27.2	Very low	32.8	Very low	101 Å²	101	134.8 Å²	134.8	71%	0.706	78%	0.78	S	S	*	*			trans	-88.7	141.1	163.9	-57.7	0	0	0	0	112.3
219	H	35.1	Very low	32.7	Very low	190 Å²	190	138.1 Å²	138.1	88%	0.88	79%	0.788	S	S	*	*			trans	-97	139.6	173	-71.8	-75.3	0	0	0	112.8
220	H	35.3	Very low	32.6	Very low	177 Å²	177	136.5 Å²	136.5	82%	0.819	79%	0.788	S	S	*	*			trans	-128.6	166.5	175.1	54	-91.9	0	0	0	110.7
221	V	30.9	Very low	33.8	Very low	136 Å²	136	138.4 Å²	138.4	82%	0.824	79%	0.788	S	S	*	*			trans	-110.2	141.2	-165.8	-175.2	0	0	0	0	111.3
222	S	30.7	Very low	32.9	Very low	116 Å²	116	141 Å²	141	81%	0.811	79%	0.79	S	S	*	*			trans	-163.4	161.5	152.6	-87.1	0	0	0	0	113.4
223	P	45.9	Very low	32.8	Very low	131 Å²	131	141.2 Å²	141.2	85%	0.851	79%	0.79	S	S	*	*			trans	-116.9	178.8	-169.1	42.7	-32.4	0	0	0	114.6
224	G	30.1	Very low	32.6	Very low	74 Å²	74	137.4 Å²	137.4	76%	0.763	79%	0.787	S	S	*	*			trans	127.7	83.6	145.8	0	0	0	0	0	120
225	F	30.4	Very low	34	Very low	221 Å²	221	133.4 Å²	133.4	97%	0.969	78%	0.782	S	S	*	*			trans	31.3	117.8	131.5	-139.2	-91.9	0	0	0	122.4
226	G	30.4	Very low	34.2	Very low	77 Å²	77	131.6 Å²	131.6	79%	0.794	79%	0.789	S	S	*	*			trans	108	130.3	132.1	0	0	0	0	0	120.3
227	G	30.7	Very low	35.3	Very low	77 Å²	77	132.9 Å²	132.9	79%	0.794	80%	0.803	S	S	*	*			trans	141.7	120.4	162.1	0	0	0	0	0	115.8
228	N	31.9	Very low	35.3	Very low	151 Å²	151	128.4 Å²	128.4	81%	0.807	80%	0.8	S	S	*	*			trans	-90.4	148.7	172.8	-72.3	13.4	0	0	0	111.7
229	F	31.6	Very low	35.3	Very low	209 Å²	209	131.7 Å²	131.7	92%	0.917	81%	0.809	S	S	*	*				171.8	161.8	119.5	-95.2	-68.6	0	0	0	111.8
230	S	29.9	Very low	35.1	Very low	108 Å²	108	127 Å²	127	76%	0.755	80%	0.798	S	S	*	*			trans	-164.3	169.8	-177	-137.4	0	0	0	0	109.8
231	P	56.1	Low	35	Very low	108 Å²	108	126.1 Å²	126.1	70%	0.701	79%	0.794	S	S	*	*			cis	-120.7	-155.1	5.4	23.6	3.5	0	0	0	112.6
232	Q	30	Very low	35	Very low	169 Å²	169	127.4 Å²	127.4	79%	0.79	79%	0.79	S	S	*	*			cis	-156.7	-175.9	27.9	-65	-175.6	65.1	0	0	114.6
233	I	32.9	Very low	34.9	Very low	146 Å²	146	130.3 Å²	130.3	75%	0.749	79%	0.791	S	S	*	*			trans	-21.4	150.9	153.9	-65.3	158.4	0	0	0	115.7
234	G	28.8	Very low	35.1	Very low	69 Å²	69	129.7 Å²	129.7	71%	0.711	79%	0.786	S	S	*	*			cis	109.2	178.3	10.7	0	0	0	0	0	113.3
235	P	56.8	Low	35.3	Very low	118 Å²	118	130.5 Å²	130.5	77%	0.766	79%	0.786	S	S	*	*			cis	-131.4	159.2	-22	40.6	-25.4	0	0	0	115.9
236	A	35.7	Very low	36.3	Very low	95 Å²	95	125.8 Å²	125.8	79%	0.785	78%	0.778	S	S	*	*			trans	62.6	171.6	154	0	0	0	0	0	119.9
237	P	49.1	Very low	38	Very low	137 Å²	137	127.4 Å²	127.4	89%	0.89	77%	0.774	S	S	*	*			cis	-117.8	-150.4	-12	39.9	-23.1	0	0	0	113.2
238	A	31.4	Very low	39.1	Very low	87 Å²	87	129.3 Å²	129.3	72%	0.719	77%	0.773	S	S	*	*			trans	-136.2	165.1	-164.3	0	0	0	0	0	115.8
239	L	28.5	Very low	39.3	Very low	170 Å²	170	130.6 Å²	130.6	89%	0.89	77%	0.774	S	S	*	*			trans	150.5	152.5	143.1	-87	148.9	0	0	0	115.8
240	S	30.9	Very low	40.5	Very low	92 Å²	92	126 Å²	126	64%	0.643	76%	0.764	S	S	*	*			trans	89.9	110.3	154.9	-69.8	0	0	0	0	124.5
241	Q	31.8	Very low	40.9	Very low	158 Å²	158	128 Å²	128	74%	0.738	76%	0.762	S	S	*	*				87.8	116.9	120.5	-67.5	-177.9	49.3	0	0	125.6
242	H	31.5	Very low	39.9	Very low	163 Å²	163	130.4 Å²	130.4	76%	0.755	76%	0.761	S	S	*	*			trans	75.3	161.7	132.5	-66.5	-54.1	0	0	0	125.2
243	H	28.5	Very low	40	Very low	177 Å²	177	130.6 Å²	130.6	82%	0.819	76%	0.762	S	S	*	*			trans	-102.1	-163.8	-170.8	-47.6	-89.4	0	0	0	111.6
244	P	51.1	Low	40.1	Very low	117 Å²	117	131.8 Å²	131.8	76%	0.76	76%	0.764	S	S	*	*			cis	-143.2	169.9	-3.4	42.9	-23.3	0	0	0	119.6
245	A	33.4	Very low	41.2	Very low	92 Å²	92	134 Å²	134	76%	0.76	77%	0.766	S	S	*	*			trans	32	170.2	137.5	0	0	0	0	0	125.1
246	P	52.2	Low	40.3	Very low	122 Å²	122	136.4 Å²	136.4	79%	0.792	77%	0.767	S	S	*	*			cis	-125.2	-111.5	-18.6	21.6	5.6	0	0	0	118.7
247	P	64.2	Low	40.3	Very low	111 Å²	111	136.4 Å²	136.4	72%	0.721	75%	0.754	S	S	*	*				-117.1	-160	-127.1	43.1	-24.2	0	0	0	115.7
248	P	54.2	Low	39.7	Very low	116 Å²	116	136.8 Å²	136.8	75%	0.753	74%	0.743	S	S	*	*			cis	-142.6	-117.8	8.6	43.2	-17.9	0	0	0	118.2
249	H	36.2	Very low	39.9	Very low	179 Å²	179	139.4 Å²	139.4	83%	0.829	74%	0.74	S	S	*	*			trans	-141.6	-167.8	-170.7	-58.7	-95.5	0	0	0	111.5
250	P	56.8	Low	40.2	Very low	111 Å²	111	137.7 Å²	137.7	72%	0.721	73%	0.728	S	S	*	*			cis	-146.5	176.9	-3.5	44.9	-24.9	0	0	0	120.6
251	H	38.5	Very low	40.5	Very low	151 Å²	151	140.5 Å²	140.5	70%	0.699	73%	0.731	S	S	*	*			trans	74.8	138.1	138.6	-95.8	-63.4	0	0	0	130.1
252	F	35.6	Very low	40.6	Very low	158 Å²	158	140.6 Å²	140.6	69%	0.693	73%	0.731	S	S	*	*			trans	73.2	157.5	148.1	-73.6	-52.1	0	0	0	122.4
253	Q	32.4	Very low	40.6	Very low	173 Å²	173	143.4 Å²	143.4	81%	0.808	74%	0.735	S	S	*	*			cis	-150.4	-165.2	9.3	-135.8	167.6	31.9	0	0	116.4
254	H	33.6	Very low	40.7	Very low	171 Å²	171	145.8 Å²	145.8	79%	0.792	74%	0.737	S	S	*	*			trans	-100.1	-167	-163.6	-88.5	-75	0	0	0	116.2
255	P	52.9	Low	39.9	Very low	116 Å²	116	145.7 Å²	145.7	75%	0.753	74%	0.739	S	S	*	*			cis	-132.4	157.4	6.2	24.9	2.2	0	0	0	118.3
256	H	38.8	Very low	40.6	Very low	169 Å²	169	147.1 Å²	147.1	78%	0.782	74%	0.74	S	S	*	*				70.9	144.3	87.3	-145.7	44.6	0	0	0	115.9
257	N	34.8	Very low	39.5	Very low	95 Å²	95	146 Å²	146	51%	0.508	74%	0.742	S	S	.	*			cis	-146.3	-140.1	10.4	-157.7	8.8	0	0	0	111.9
258	Q	35.5	Very low	38.3	Very low	144 Å²	144	145.7 Å²	145.7	67%	0.673	74%	0.742	S	S	*	*			cis	-150.9	-104	5.4	-160.9	115.4	-14.8	0	0	117.8
259	H	35.6	Very low	38	Very low	142 Å²	142	146.1 Å²	146.1	66%	0.657	74%	0.744	S	S	*	*			trans	-155.1	173	-148.4	-81.5	6.5	0	0	0	115.8
260	Q	35.3	Very low	38	Very low	134 Å²	134	145.6 Å²	145.6	63%	0.626	74%	0.742	S	S	*	*			cis	-169.8	163.9	-19.3	-104.8	-168.7	56.5	0	0	114.4
261	Q	36.7	Very low	38	Very low	151 Å²	151	146.3 Å²	146.3	71%	0.706	75%	0.747	S	S	*	*			trans	69.2	117.7	150.3	-71.1	-166.4	52.2	0	0	129.2
262	H	34.9	Very low	38.8	Very low	161 Å²	161	144.5 Å²	144.5	75%	0.745	75%	0.749	S	S	*	*			trans	31.5	126.8	135.6	-55.5	-61.8	0	0	0	127.9
263	R	31.2	Very low	40.1	Very low	222 Å²	222	141.8 Å²	141.8	84%	0.838	75%	0.746	S	S	*	*				160.9	130.8	99.7	-91	-151.5	176.5	-147	-0	117.6
264	R	31	Very low	40.9	Very low	227 Å²	227	139.1 Å²	139.1	86%	0.857	74%	0.744	S	S	*	*			trans	47.6	148.8	142.3	-69	-169.8	172.5	-134.5	-1.9	125.7
265	S	34.7	Very low	41	Very low	114 Å²	114	139.9 Å²	139.9	80%	0.797	75%	0.746	S	S	*	*			trans	-83.1	-176	176.3	-15.8	0	0	0	0	114.3
266	P	46.8	Very low	40	Very low	123 Å²	123	138.7 Å²	138.7	80%	0.799	74%	0.74	S	S	*	*			cis	-158.7	-174.6	46.4	46	-23.3	0	0	0	121.3
267	A	30.3	Very low	39.7	Very low	99 Å²	99	139 Å²	139	82%	0.818	74%	0.742	S	S	*	*			trans	77.9	158	145.1	0	0	0	0	0	124.5
268	S	38.5	Very low	39.5	Very low	104 Å²	104	146.2 Å²	146.2	73%	0.727	76%	0.762	S	S	*	*			trans	-145.8	153.1	-177.5	-48.8	0	0	0	0	113.7
269	P	48.2	Very low	39.2	Very low	124 Å²	124	146.2 Å²	146.2	81%	0.805	77%	0.766	S	S	*	*			trans	-148.6	178.4	141.1	34.8	-14.8	0	0	0	116.3
270	H	35.4	Very low	39.9	Very low	169 Å²	169	144.9 Å²	144.9	78%	0.782	77%	0.77	S	S	*	*			trans	-144.4	179.3	-172	-49.9	-36.8	0	0	0	111.7
271	P	58	Low	39.8	Very low	125 Å²	125	142.5 Å²	142.5	81%	0.812	77%	0.773	S	S	*	*			cis	-114.2	-116.8	4.5	36.7	-14.3	0	0	0	113.5
272	P	54.3	Low	39.4	Very low	114 Å²	114	143.9 Å²	143.9	74%	0.74	78%	0.777	S	S	*	*			cis	-130.5	-171.2	8.1	45.7	-27	0	0	0	116.8
273	P	63.3	Low	39.3	Very low	100 Å²	100	141.1 Å²	141.1	65%	0.649	77%	0.768	S	S	*	*			trans	-115.4	171.4	-177.5	43.1	-33	0	0	0	116
274	P	48.8	Very low	39.4	Very low	117 Å²	117	138.8 Å²	138.8	76%	0.76	77%	0.767	S	S	*	*				-154.4	-149.8	94.2	43.3	-22.4	0	0	0	115.6
275	F	35.6	Very low	39.5	Very low	187 Å²	187	134.3 Å²	134.3	82%	0.82	76%	0.759	S	S	*	*			trans	-136.6	-173.4	-167	-41.8	-67.7	0	0	0	112.2
276	S	32.5	Very low	40.1	Very low	92 Å²	92	134.6 Å²	134.6	64%	0.643	76%	0.759	S	S	*	*			cis	-166.3	-174.4	11.1	-161	0	0	0	0	112.8
277	H	32.3	Very low	39.6	Very low	176 Å²	176	136.2 Å²	136.2	82%	0.815	76%	0.755	S	S	*	*			trans	74.9	161.9	171.5	-47.5	-69.4	0	0	0	117.1
278	R	29.6	Very low	39.7	Very low	245 Å²	245	140 Å²	140	93%	0.925	76%	0.76	S	S	*	*			cis	-154.9	163.8	17.3	-157.6	176.7	-172.4	176.8	2.1	113.3
279	N	29.9	Very low	39.3	Very low	144 Å²	144	139.9 Å²	139.9	77%	0.77	76%	0.76	S	S	*	*			trans	-86.9	-173.4	175.3	-129.1	19.1	0	0	0	112.4
280	P	51	Low	38.3	Very low	114 Å²	114	141.7 Å²	141.7	74%	0.74	76%	0.763	S	S	*	*			cis	-119.1	-159	17.8	35.9	-13.3	0	0	0	113.3
281	A	32.6	Very low	38.2	Very low	84 Å²	84	138.2 Å²	138.2	69%	0.694	76%	0.757	S	S	*	*			cis	-156.7	-163.3	20.6	0	0	0	0	0	111.1
282	F	27.9	Very low	36.9	Very low	180 Å²	180	140.5 Å²	140.5	79%	0.789	76%	0.762	S	S	*	*			cis	-149.2	-125.6	10.2	-168.7	-132.3	0	0	0	114.5
283	N	33.1	Very low	35.8	Very low	103 Å²	103	141.8 Å²	141.8	55%	0.551	76%	0.762	S	S	*	*			trans	-151.6	162.8	-154.8	-81.5	-22.5	0	0	0	111.3
284	Q	33.8	Very low	34.1	Very low	173 Å²	173	146.6 Å²	146.6	81%	0.808	77%	0.773	S	S	*	*			cis	-157.4	177.1	0.2	-125.4	172.3	72.9	0	0	113.3
285	L	33.7	Very low	34.6	Very low	134 Å²	134	146.5 Å²	146.5	70%	0.702	77%	0.773	S	S	*	*			trans	-101.7	164.5	177.8	-93.3	154.2	0	0	0	112.4
286	P	47.4	Very low	35.3	Very low	120 Å²	120	143.4 Å²	143.4	78%	0.779	77%	0.771	S	S	*	*				-151.3	-168.3	97.5	40.6	-21.5	0	0	0	115.6
287	H	36	Very low	35.4	Very low	157 Å²	157	144.2 Å²	144.2	73%	0.727	78%	0.777	S	S	*	*			trans	-117.8	156.7	-172.9	-36	-101.9	0	0	0	112.6
288	L	31.6	Very low	36	Very low	177 Å²	177	140.6 Å²	140.6	93%	0.927	77%	0.769	S	S	*	*			trans	-175.8	166.7	140.8	-107.3	167.8	0	0	0	112.5
289	S	29.6	Very low	36.1	Very low	103 Å²	103	140.8 Å²	140.8	72%	0.72	77%	0.77	S	S	*	*			trans	-129.5	133	-178	57.1	0	0	0	0	112.1
290	N	27.3	Very low	36	Very low	162 Å²	162	136.8 Å²	136.8	87%	0.866	76%	0.762	S	S	*	*			trans	-163.4	162.6	145.1	-137.7	-20.5	0	0	0	113.6
291	S	33.4	Very low	35.9	Very low	95 Å²	95	137.8 Å²	137.8	66%	0.664	77%	0.769	S	S	*	*			trans	-101.6	151.3	174.3	56.9	0	0	0	0	112.4
292	L	31.3	Very low	35.8	Very low	173 Å²	173	138.4 Å²	138.4	91%	0.906	77%	0.774	S	S	*	*			trans	-150.4	151.1	161.1	-150.9	65.8	0	0	0	112.6
293	N	30.3	Very low	36	Very low	141 Å²	141	134.7 Å²	134.7	75%	0.754	77%	0.77	S	S	*	*			trans	-105.3	148.8	-170.5	-57.4	-80.7	0	0	0	112.7
294	K	29	Very low	36.1	Very low	201 Å²	201	139.6 Å²	139.6	87%	0.874	78%	0.783	S	S	*	*				174	166.5	119.2	-94.7	169.9	179.1	-179.1	0	114
295	P	59.5	Low	35.9	Very low	116 Å²	116	139.9 Å²	139.9	75%	0.753	78%	0.784	S	S	*	*			trans	-109.1	-158.6	-163.5	50	-41.1	0	0	0	111.1
296	P	49	Very low	35.8	Very low	122 Å²	122	138.9 Å²	138.9	79%	0.792	79%	0.789	S	S	*	*			cis	-130.4	171.7	36.6	41.6	-24.3	0	0	0	117.4
297	S	34.4	Very low	35.5	Very low	108 Å²	108	138.7 Å²	138.7	76%	0.755	79%	0.787	S	S	*	*			trans	-77.3	179.5	166.9	-40.7	0	0	0	0	112.2
298	P	46.3	Very low	35.3	Very low	101 Å²	101	136.8 Å²	136.8	66%	0.656	79%	0.791	S	S	*	*				-156.8	156.9	87.4	42.4	-23.3	0	0	0	118.5
299	W	30.5	Very low	35.5	Very low	249 Å²	249	134.1 Å²	134.1	94%	0.943	79%	0.785	S	S	*	*			trans	61.7	140.1	174.4	-44.4	88.2	0	0	0	116.4
300	G	29	Very low	35.4	Very low	59 Å²	59	134.9 Å²	134.9	61%	0.608	79%	0.79	S	S	*	*			cis	104.7	138.2	5.7	0	0	0	0	0	111.8
301	P	48.8	Very low	35.8	Very low	135 Å²	135	133.7 Å²	133.7	88%	0.877	79%	0.791	S	S	*	*			cis	-79	-157.7	3.1	38	-39.7	0	0	0	112.3
302	A	30.7	Very low	35.7	Very low	98 Å²	98	132.7 Å²	132.7	81%	0.81	80%	0.796	S	S	*	*			cis	-149.2	-153	13	0	0	0	0	0	113.9
303	S	31.6	Very low	35.8	Very low	101 Å²	101	130 Å²	130	71%	0.706	79%	0.792	S	S	*	*			trans	-129.4	128.2	-151.3	51.4	0	0	0	0	117.7
304	Y	34.3	Very low	35.9	Very low	207 Å²	207	128.1 Å²	128.1	81%	0.812	79%	0.789	S	S	*	*			trans	70.8	111	148.4	-71.8	-68.5	0	0	0	123.9
305	Q	29.4	Very low	36	Very low	178 Å²	178	124.3 Å²	124.3	83%	0.832	78%	0.783	S	S	*	*			trans	67.1	128.8	133.8	-76.4	169.8	8.4	0	0	122.8
306	S	31.6	Very low	34.6	Very low	114 Å²	114	122.9 Å²	122.9	80%	0.797	78%	0.776	S	S	*	*			trans	-91.1	167.4	164.3	-30.1	0	0	0	0	110.6
307	P	42.1	Very low	33.5	Very low	116 Å²	116	128.1 Å²	128.1	75%	0.753	78%	0.78	S	S	*	*				-151.3	176.7	71.5	41.6	-22.4	0	0	0	117.7
308	S	31.2	Very low	33.1	Very low	116 Å²	116	128.1 Å²	128.1	81%	0.811	78%	0.78	S	S	*	*			trans	75.5	149.5	159.6	-61	0	0	0	0	119.4
309	P	35.3	Very low	32.9	Very low	122 Å²	122	129.7 Å²	129.7	79%	0.792	79%	0.79	S	S	*	*			trans	-106.1	140.8	-169.2	38.3	-31	0	0	0	114.8
310	S	28.6	Very low	32.8	Very low	118 Å²	118	121.5 Å²	121.5	83%	0.825	78%	0.784	S	S	*	*			trans	-138.7	124.2	161.5	-69.1	0	0	0	0	109.1
311	P	36.2	Very low	32.6	Very low	137 Å²	137	122.9 Å²	122.9	89%	0.89	80%	0.798	S	S	*	*			trans	-79.9	122.7	173.2	31	-31.4	0	0	0	110.5
312	G	29.8	Very low	31.5	Very low	75 Å²	75	119.6 Å²	119.6	77%	0.773	79%	0.789	S	S	*	*			trans	-174.8	104.5	178	0	0	0	0	0	115.7
313	S	34.4	Very low	31.4	Very low	117 Å²	117	126.1 Å²	126.1	82%	0.818	79%	0.794	S	S	*	*			trans	-178.3	148.3	166.7	52.4	0	0	0	0	108.2
314	S	32.9	Very low	31.1	Very low	100 Å²	100	124.3 Å²	124.3	70%	0.699	79%	0.791	S	S	*	*			cis	-166.3	163.5	-11.6	44.5	0	0	0	0	105.6
315	T	30.1	Very low	30.8	Very low	121 Å²	121	120.8 Å²	120.8	74%	0.742	80%	0.797	S	S	*	*				-157.3	151.2	52.9	34.2	0	0	0	0	109.8
316	S	30.2	Very low	30.7	Very low	87 Å²	87	116.1 Å²	116.1	61%	0.608	80%	0.797	S	S	*	*				86	139	52.2	-48.5	0	0	0	0	114.5
317	W	26	Very low	30.7	Very low	231 Å²	231	114.8 Å²	114.8	88%	0.875	80%	0.801	S	S	*	*			cis	-173.7	147.8	-15.3	-106.7	5.9	0	0	0	110
318	S	27.1	Very low	30.1	Very low	108 Å²	108	113.3 Å²	113.3	76%	0.755	81%	0.807	S	S	*	*			trans	60.9	176.5	156.4	-62.4	0	0	0	0	117.7
319	P	41.4	Very low	29.9	Very low	134 Å²	134	111.2 Å²	111.2	87%	0.87	80%	0.803	S	S	*	*			cis	-102.5	-151.6	-10.9	42.2	-29.2	0	0	0	110.6
320	G	27.3	Very low	29.7	Very low	78 Å²	78	117.8 Å²	117.8	80%	0.804	81%	0.813	S	S	*	*			cis	-167.2	-129.9	8.1	0	0	0	0	0	113.2
321	G	26.3	Very low	29.6	Very low	87 Å²	87	116 Å²	116	90%	0.897	81%	0.812	S	S	*	*			trans	-167.1	-178.4	-177	0	0	0	0	0	113.6
322	G	24.8	Very low	29.3	Very low	67 Å²	67	113.6 Å²	113.6	69%	0.691	81%	0.812	S	S	*	*			trans	142.4	123.8	169.1	0	0	0	0	0	117.5
323	Y	28.1	Very low	29.4	Very low	234 Å²	234	115.5 Å²	115.5	92%	0.918	81%	0.814	S	S	*	*			trans	1.1	159.1	155.6	72	-83.2	0	0	0	123.1
324	G	26	Very low	29.2	Very low	63 Å²	63	118.5 Å²	118.5	65%	0.649	82%	0.815	S	S	*	*			trans	145.9	81.3	148.3	0	0	0	0	0	119.5
325	S	27.7	Very low	29.1	Very low	133 Å²	133	116.7 Å²	116.7	93%	0.93	81%	0.813	S	S	*	*			trans	16.3	135.2	152.3	-55.9	0	0	0	0	123.1
326	G	28.3	Very low	29.2	Very low	81 Å²	81	122 Å²	122	84%	0.835	82%	0.819	S	S	*	*				145.4	119.3	128.5	0	0	0	0	0	118.6
327	G	30.7	Very low	29.3	Very low	86 Å²	86	124.7 Å²	124.7	89%	0.887	83%	0.827	S	S	*	*			trans	83.3	83.3	153.3	0	0	0	0	0	117.9
328	G	30.1	Very low	29.6	Very low	85 Å²	85	123.5 Å²	123.5	88%	0.876	82%	0.823	S	S	*	*			trans	-86.2	146.7	163.7	0	0	0	0	0	112.3
329	G	27.2	Very low	30	Very low	71 Å²	71	127.6 Å²	127.6	73%	0.732	82%	0.822	S	S	*	*			trans	-156.8	120.4	179.2	0	0	0	0	0	113.5
330	W	30	Very low	29.7	Very low	261 Å²	261	131.7 Å²	131.7	99%	0.989	82%	0.82	S	S	*	*			trans	-36.3	143.7	166.4	-46.3	74	0	0	0	113
331	G	28	Very low	29.6	Very low	79 Å²	79	131 Å²	131	81%	0.814	81%	0.814	S	S	*	*			cis	105.6	115.7	22	0	0	0	0	0	110
332	G	28.1	Very low	29.9	Very low	87 Å²	87	134.8 Å²	134.8	90%	0.897	81%	0.812	S	S	*	*			trans	172.3	150	-177.8	0	0	0	0	0	113.4
333	S	32.1	Very low	30.1	Very low	116 Å²	116	139.6 Å²	139.6	81%	0.811	82%	0.822	S	S	*	*			trans	-141.3	-177.9	177.2	-174.6	0	0	0	0	109.1
334	Q	31.7	Very low	30.1	Very low	179 Å²	179	132 Å²	132	84%	0.836	82%	0.815	S	S	*	*			trans	78.1	147.8	-167.6	-49.4	-72.2	-20.9	0	0	114.1
335	G	28.9	Very low	30.3	Very low	63 Å²	63	132.6 Å²	132.6	65%	0.649	82%	0.821	S	S	*	*			cis	158.5	151.5	-11.8	0	0	0	0	0	115.1
336	R	32.6	Very low	30.5	Very low	233 Å²	233	135.3 Å²	135.3	88%	0.879	82%	0.821	S	S	*	*			trans	67.8	146.3	165.9	-70.9	-173.9	172.5	-172.5	-1.8	121
337	D	32.7	Very low	30.9	Very low	143 Å²	143	137.6 Å²	137.6	77%	0.765	82%	0.819	S	S	*	*			trans	-79.4	163.9	171.9	-36.8	-111.6	0	0	0	113.4
338	Y	31.8	Very low	31.7	Very low	205 Å²	205	138.5 Å²	138.5	80%	0.804	81%	0.809	S	S	*	*				176.8	126	124.3	-94.6	-59.8	0	0	0	115.1
339	R	35.6	Very low	31.9	Very low	195 Å²	195	141.8 Å²	141.8	74%	0.736	81%	0.805	S	S	*	*			trans	28.1	135.8	146.1	-69	-179.6	-172	-106.2	11.2	123.6
340	R	35.3	Very low	32.1	Very low	220 Å²	220	144.9 Å²	144.9	83%	0.83	81%	0.805	S	S	*	*			trans	72.5	144.8	136.6	-163.5	-163.5	-56.4	-104.7	13.3	117.1
341	G	26	Very low	32.1	Very low	64 Å²	64	136.9 Å²	136.9	66%	0.66	79%	0.789	S	S	*	*			cis	162.6	168	-9	0	0	0	0	0	113.3
342	L	32.6	Very low	32.3	Very low	165 Å²	165	141.3 Å²	141.3	86%	0.864	79%	0.792	S	S	*	*			trans	50.9	116.1	166.6	-76.8	85.1	0	0	0	122.1
343	N	29.6	Very low	32.5	Very low	169 Å²	169	141.8 Å²	141.8	90%	0.904	78%	0.782	S	S	*	*				-175.1	156.9	121.1	-105.4	-7.3	0	0	0	108.8
344	G	27.7	Very low	33	Very low	74 Å²	74	142 Å²	142	76%	0.763	78%	0.78	S	S	*	*			cis	137.8	104.1	-2	0	0	0	0	0	111.4
345	G	29.2	Very low	33	Very low	75 Å²	75	140.4 Å²	140.4	77%	0.773	78%	0.777	S	S	*	*			trans	-177.9	128.7	-178.8	0	0	0	0	0	116.2
346	M	32.6	Very low	33	Very low	190 Å²	190	146.9 Å²	146.9	94%	0.936	79%	0.787	S	S	*	*			trans	-61.9	163.1	-167.7	-76.4	62.6	164.7	0	0	119.1
347	T	36.5	Very low	33	Very low	130 Å²	130	144.2 Å²	144.2	80%	0.798	78%	0.782	S	S	*	*			trans	-84.8	169.4	159.9	61.5	0	0	0	0	111.3
348	P	47.1	Very low	32.6	Very low	104 Å²	104	142.1 Å²	142.1	68%	0.675	77%	0.774	S	S	*	*				-157.5	155.6	91.4	40.8	-21.9	0	0	0	118
349	I	34.7	Very low	32.9	Very low	154 Å²	154	141.6 Å²	141.6	79%	0.79	78%	0.776	S	S	*	*			trans	52.9	158.6	152.1	72.2	175.7	0	0	0	120.3
350	N	31.3	Very low	33.1	Very low	137 Å²	137	138.5 Å²	138.5	73%	0.733	78%	0.781	S	S	*	*			cis	-147.2	173	7.5	-144.9	-11.6	0	0	0	114.1
351	S	29.5	Very low	32.7	Very low	93 Å²	93	133.3 Å²	133.3	65%	0.65	77%	0.77	S	S	*	*			trans	-60.2	157.1	-175.8	58.6	0	0	0	0	118.9
352	I	33.3	Very low	32.8	Very low	172 Å²	172	137.1 Å²	137.1	88%	0.882	78%	0.775	S	S	*	*			trans	-156.5	142.7	133.3	-98.9	149.3	0	0	0	110.1
353	S	32.8	Very low	32.7	Very low	97 Å²	97	135.7 Å²	135.7	68%	0.678	76%	0.764	S	S	*	*			trans	-162.7	147.5	168.9	177.8	0	0	0	0	110.6
354	P	42.3	Very low	32.6	Very low	120 Å²	120	133.8 Å²	133.8	78%	0.779	76%	0.758	S	S	*	*			trans	-126.8	143.7	150.2	35.1	-24.2	0	0	0	114.1
355	L	30.3	Very low	32.6	Very low	145 Å²	145	134.5 Å²	134.5	76%	0.759	76%	0.757	S	S	*	*			trans	-95	-172.5	178.3	-65.2	67	0	0	0	111.9
356	K	30.2	Very low	32.4	Very low	199 Å²	199	135.8 Å²	135.8	87%	0.865	75%	0.754	S	S	*	*			trans	109.2	150	160.8	-62.6	156.1	-171.7	173.7	0	114
357	K	31.6	Very low	32.1	Very low	178 Å²	178	134.6 Å²	134.6	77%	0.774	75%	0.746	S	S	*	*			cis	179.2	151.3	-31	-122.5	-172.8	146.7	-83.5	0	106.4
358	T	25.1	Very low	31.5	Very low	98 Å²	98	137 Å²	137	60%	0.601	75%	0.746	S	S	*	*			cis	-156.1	162.1	-4.7	-25.1	0	0	0	0	108.6
359	F	38.1	Very low	30.8	Very low	195 Å²	195	142.7 Å²	142.7	86%	0.855	76%	0.755	S	S	*	*			trans	-66.6	160.2	150.6	-75.5	-82.8	0	0	0	111.5
360	P	40.1	Very low	30.6	Very low	129 Å²	129	141 Å²	141	84%	0.838	75%	0.754	S	S	*	*				-122.4	172.4	129.9	36.6	-31.3	0	0	0	112.9
361	N	27.2	Very low	30.3	Very low	112 Å²	112	145.2 Å²	145.2	60%	0.599	76%	0.76	S	S	*	*			trans	-143.5	149	-169.1	162.1	41.1	0	0	0	109.4	H363	N361-H363 PolarHBondContact ND2-CD2 3.15Å; N361-H363 PolarHBondContact ND2-NE2 2.87Å
362	N	27	Very low	30	Very low	143 Å²	143	146.9 Å²	146.9	77%	0.765	76%	0.761	S	S	*	*			trans	-164	136.9	148.5	-92.1	-21.3	0	0	0	108.5
363	H	30.9	Very low	29.9	Very low	135 Å²	135	143.3 Å²	143.3	63%	0.625	75%	0.752	S	S	*	*			cis	76.6	135.6	44.7	-71.4	-64.4	0	0	0	114.2	N361	N361-H363 PolarHBondContact ND2-CD2 3.15Å; N361-H363 PolarHBondContact ND2-NE2 2.87Å
364	V	27.9	Very low	30.2	Very low	130 Å²	130	145.1 Å²	145.1	79%	0.788	76%	0.761	S	S	*	*			cis	-166.9	172.9	-16.9	90	0	0	0	0	111.2
365	A	26.1	Very low	29.5	Very low	89 Å²	89	144.4 Å²	144.4	74%	0.736	77%	0.765	S	S	*	*			trans	113.8	140	155.4	0	0	0	0	0	116.3
366	S	25.2	Very low	29.3	Very low	101 Å²	101	140.6 Å²	140.6	71%	0.706	76%	0.761	S	S	*	*			cis	125.6	102.1	-13.1	-169.7	0	0	0	0	115.6
367	Q	26.5	Very low	29.1	Very low	166 Å²	166	141.6 Å²	141.6	78%	0.776	77%	0.766	S	S	*	*			trans	-148.2	123.8	151.7	-63.1	-61	-9.7	0	0	105.3
368	K	25.3	Very low	29	Very low	181 Å²	181	139.3 Å²	139.3	79%	0.787	76%	0.762	S	S	*	*				91.9	120.1	56.6	-77.5	-166.1	-174	176.9	0	113.8
369	Y	30.6	Very low	29.7	Very low	223 Å²	223	140.4 Å²	140.4	88%	0.875	77%	0.771	S	S	*	*			trans	-90	173.4	177.6	-60.1	-93.2	0	0	0	112.2
370	P	30.3	Very low	29.1	Very low	117 Å²	117	139.6 Å²	139.6	76%	0.76	77%	0.767	S	S	*	*				-124.2	164.6	84	8.1	15	0	0	0	112.7
371	R	26.6	Very low	28.3	Very low	226 Å²	226	138.5 Å²	138.5	85%	0.853	76%	0.762	S	S	*	*			cis	68.3	142.5	49.1	-104.7	-165	157.9	144.6	2.8	113.5
372	N	23.4	Very low	28.4	Very low	128 Å²	128	144.8 Å²	144.8	68%	0.684	78%	0.778	S	S	*	*			cis	-158.5	162.1	11.6	-158.5	55.6	0	0	0	111.4
373	S	31.4	Very low	28.4	Very low	98 Å²	98	145.9 Å²	145.9	69%	0.685	78%	0.78	S	S	*	*			trans	-89	174	166.2	-43.6	0	0	0	0	111.9
374	P	37.6	Very low	28.2	Very low	134 Å²	134	146 Å²	146	87%	0.87	79%	0.785	S	S	*	*				-152.9	-170.4	92.2	41.4	-21.7	0	0	0	116
375	A	28.5	Very low	28.3	Very low	105 Å²	105	147 Å²	147	87%	0.868	79%	0.787	S	S	*	*			trans	-97.2	170.5	-167.2	0	0	0	0	0	116.4
376	G	25.7	Very low	28.4	Very low	65 Å²	65	145.7 Å²	145.7	67%	0.67	78%	0.781	S	S	*	*				125.6	140.1	121	0	0	0	0	0	120.3
377	F	26.5	Very low	28.7	Very low	221 Å²	221	147.4 Å²	147.4	97%	0.969	79%	0.787	S	S	*	*			trans	77.8	160	159.7	-73.2	-84.9	0	0	0	121.1
378	N	28.2	Very low	28.7	Very low	130 Å²	130	142.4 Å²	142.4	70%	0.695	78%	0.78	S	S	*	*			trans	-126.9	150.5	-160.7	179.1	7.4	0	0	0	108.5	K380	N378-K380 PolarHBondContact OD1-N 3.2Å
379	P	40.4	Very low	29.1	Very low	120 Å²	120	144.2 Å²	144.2	78%	0.779	78%	0.782	S	S	*	*				-148.1	121.7	115.1	34.7	-17.1	0	0	0	116.7
380	K	25.3	Very low	29.1	Very low	179 Å²	179	138.5 Å²	138.5	78%	0.778	77%	0.767	S	S	*	*			trans	52.5	144.6	132	-81.4	-171.4	173.4	-176.6	0	122.7	N378	N378-K380 PolarHBondContact OD1-N 3.2Å
381	S	23.4	Very low	29.1	Very low	106 Å²	106	139.4 Å²	139.4	74%	0.741	77%	0.765	S	S	*	*			trans	62.6	112.9	144.2	59	0	0	0	0	119.9
382	W	28.7	Very low	29.4	Very low	244 Å²	244	135.1 Å²	135.1	92%	0.924	76%	0.758	S	S	*	*				-112.7	152.9	117.5	72	-65.5	0	0	0	108.7
383	M	28.2	Very low	29.6	Very low	165 Å²	165	138 Å²	138	81%	0.813	77%	0.765	S	S	*	*			trans	-122	138.9	179.8	-107.4	170	140.3	0	0	108.5
384	D	26.4	Very low	30.6	Very low	137 Å²	137	138 Å²	138	73%	0.733	76%	0.762	S	S	*	*				56.2	118	127.7	-138.6	-141.6	0	0	0	120.6
385	D	29.7	Very low	30.1	Very low	153 Å²	153	140.1 Å²	140.1	82%	0.818	76%	0.758	S	S	*	*			trans	62.9	163.8	145.8	-129.4	-47.7	0	0	0	121.3
386	G	28.9	Very low	30.2	Very low	60 Å²	60	142.3 Å²	142.3	62%	0.619	75%	0.75	S	S	*	*			trans	135.8	66.4	159.4	0	0	0	0	0	119.2
387	V	30.1	Very low	30.1	Very low	138 Å²	138	146 Å²	146	84%	0.836	75%	0.75	S	S	*	*			trans	50	132.4	142.8	-165.5	0	0	0	0	119.3
388	G	28.5	Very low	30.3	Very low	61 Å²	61	145 Å²	145	63%	0.629	74%	0.74	S	S	*	*			cis	137.6	172.3	7.6	0	0	0	0	0	111.4
389	R	33	Very low	30.4	Very low	218 Å²	218	145.3 Å²	145.3	82%	0.823	75%	0.747	S	S	*	*			trans	68.1	152.2	174.2	-67.8	-176.4	170.7	-100.6	5	116.1
390	D	30.1	Very low	30	Very low	104 Å²	104	151.3 Å²	151.3	56%	0.556	75%	0.754	S	S	*	*			cis	-162.8	170.9	-8.4	-108	-20.3	0	0	0	112.1
391	N	31.6	Very low	30.1	Very low	136 Å²	136	148.8 Å²	148.8	73%	0.727	76%	0.758	S	S	*	*			trans	83.1	102.6	151.1	-65.4	-27.8	0	0	0	124.1
392	I	31.3	Very low	30.4	Very low	136 Å²	136	153 Å²	153	70%	0.697	76%	0.764	S	S	*	*				67.4	107.3	116	-84.9	62.9	0	0	0	121.3
393	F	28.6	Very low	30.4	Very low	188 Å²	188	148.2 Å²	148.2	83%	0.825	76%	0.757	S	S	*	*				28.7	166.3	113	-68.5	-59	0	0	0	123
394	P	51.5	Low	30.7	Very low	98 Å²	98	144.3 Å²	144.3	64%	0.636	75%	0.745	S	S	*	*			cis	-141.5	176.7	-31.2	37.7	-19.4	0	0	0	115.5
395	F	27	Very low	31.2	Very low	178 Å²	178	147 Å²	147	78%	0.781	75%	0.751	S	S	*	*			trans	150.9	129.4	140.3	-101.8	-95	0	0	0	109
396	Q	30.8	Very low	31.9	Very low	152 Å²	152	145 Å²	145	71%	0.71	74%	0.74	S	S	*	*			cis	100.8	93.1	20	-171.5	-174.2	102.7	0	0	115.2
397	E	24.7	Very low	33.3	Very low	143 Å²	143	148.6 Å²	148.6	67%	0.668	74%	0.743	S	S	*	*				-164	128.5	124.8	-100.5	-160.7	114.4	0	0	108.1
398	R	29.6	Very low	34.1	Very low	199 Å²	199	146.7 Å²	146.7	75%	0.751	73%	0.728	S	S	*	*				68.7	116.1	81.7	-170.8	-177.6	-70.1	154.7	-7.6	110.6
399	T	30.1	Very low	35.2	Very low	136 Å²	136	149.1 Å²	149.1	83%	0.834	73%	0.731	S	S	*	*			cis	-129.2	171.4	47.4	45.4	0	0	0	0	115.9
400	R	33.6	Very low	36.3	Very low	247 Å²	247	143.6 Å²	143.6	93%	0.932	72%	0.717	S	S	*	*			trans	-104.5	145.4	178.9	-62.4	175.9	177.4	168.4	-3.4	112.7
401	S	27.3	Very low	37.7	Very low	125 Å²	125	144.6 Å²	144.6	87%	0.874	72%	0.718	S	S	*	*			trans	-116.3	162.4	140.6	49.1	0	0	0	0	108.6
402	F	28.6	Very low	38.8	Very low	195 Å²	195	143 Å²	143	86%	0.855	71%	0.709	S	S	*	*			trans	-102.8	131.8	-164.9	-160	-86.8	0	0	0	110.8
403	D	29.7	Very low	40.4	Very low	144 Å²	144	139.5 Å²	139.5	77%	0.77	70%	0.697	S	S	*	*			trans	-136.2	144.3	171.6	-153.1	-26.6	0	0	0	110
404	S	33.3	Very low	41.8	Very low	83 Å²	83	135.6 Å²	135.6	58%	0.58	68%	0.684	S	S	*	*			trans	-114.4	12.8	-146.4	-164.2	0	0	0	0	115.5
405	F	37.8	Very low	42.7	Very low	194 Å²	194	134.5 Å²	134.5	85%	0.851	67%	0.672	S	S	*	*			trans	-130.9	57.3	-173.8	-64.8	-77.5	0	0	0	113.2
406	N	43.7	Very low	44.5	Very low	109 Å²	109	130.6 Å²	130.6	58%	0.583	66%	0.66	S	S	*	*			trans	-113.5	124.4	175.1	-169.1	-32.6	0	0	0	111.4	N408	N406-N408 WeakPolarHBondContact OD1-CB 3.47Å; N406-N408 PolarHBondContact OD1-N 2.92Å; N406-N408 VanDerWaalsContact OD1-N 3.08Å; N406-N408 PolarHBondContact OD1-OD1 2.81Å; N406-N408 VanDerWaalsContact OD1-OD1 3.1Å
407	M	57.6	Low	46.4	Very low	137 Å²	137	128.1 Å²	128.1	68%	0.675	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.5	-9.4	-173	-71.7	-71.5	-76.9	0	0	114.7	T409 L410	M407-T409 PolarHBondContact O-N 3.41Å; M407-L410 HydrophobicContact CE-CD1 3.55Å; M407-L410 PolarHBondContact O-N 2.94Å; M407-L410 HydrophobicContact SD-CD1 3.99Å
408	N	47.6	Very low	48.2	Very low	98 Å²	98	127.7 Å²	127.7	52%	0.524	65%	0.65	S	S	.	*	H	α-helix	trans	-62.1	-12.9	-172.2	-64.1	9.7	0	0	0	114.3	N406 N412	N406-N408 WeakPolarHBondContact OD1-CB 3.47Å; N406-N408 PolarHBondContact OD1-N 2.92Å; N406-N408 VanDerWaalsContact OD1-N 3.08Å; N406-N408 PolarHBondContact OD1-OD1 2.81Å; N406-N408 VanDerWaalsContact OD1-OD1 3.1Å; N408-N412 PolarHBondContact O-ND2 3.1Å
409	T	51.3	Low	49.8	Very low	112 Å²	112	125.5 Å²	125.5	69%	0.687	64%	0.641	S	S	*	*	H	α-helix	trans	-70.2	-29.8	174.9	-38.4	0	0	0	0	112.9	M407 S413	M407-T409 PolarHBondContact O-N 3.41Å; T409-S413 PolarHBondContact O-N 2.66Å
410	L	56.8	Low	50.7	Low	101 Å²	101	122.4 Å²	122.4	53%	0.529	63%	0.63	S	S	.	*	H	α-helix	trans	-74.5	-37.3	-177.6	-77.8	163.7	0	0	0	112.7	M407 S413 L414	M407-L410 HydrophobicContact CE-CD1 3.55Å; M407-L410 PolarHBondContact O-N 2.94Å; M407-L410 HydrophobicContact SD-CD1 3.99Å; L410-S413 WeakPolarHBondContact O-CB 3.41Å; L410-S413 PolarHBondContact O-N 2.87Å; L410-L414 PolarHBondContact O-N 3.08Å
411	E	58.6	Low	51.4	Low	126 Å²	126	118.1 Å²	118.1	59%	0.589	62%	0.62	S	S	*	*	H	α-helix	trans	-62.8	-45.4	177.5	-172.7	172	-149.3	0	0	111.3	S413 L414 I415	E411-S413 VanDerWaalsContact C-N 3.32Å; E411-S413 PolarHBondContact O-N 2.94Å; E411-L414 PolarHBondContact O-N 2.96Å; E411-I415 HydrophobicContact CG-CD1 4.14Å; E411-I415 WeakPolarHBondContact O-CD1 3.4Å; E411-I415 VanDerWaalsContact O-CG1 3.27Å; E411-I415 WeakPolarHBondContact O-CG1 3.27Å; E411-I415 PolarHBondContact O-N 3.28Å; E411-I415 VanDerWaalsContact O-N 3.08Å
412	N	55.8	Low	52.3	Low	102 Å²	102	120.5 Å²	120.5	55%	0.545	62%	0.618	S	S	.	*	H	α-helix	trans	-61.8	-37.9	174.5	-74.1	-85.5	0	0	0	112.4	N408 I415 D416	N408-N412 PolarHBondContact O-ND2 3.1Å; N412-I415 PolarHBondContact O-N 2.93Å; N412-D416 PolarHBondContact O-N 2.96Å; N412-D416 VanDerWaalsContact O-N 3.13Å
413	S	63.5	Low	52.8	Low	62 Å²	62	118.5 Å²	118.5	43%	0.434	62%	0.616	S	S	.	*	H	α-helix	trans	-65.5	-44.2	177.3	-169.5	0	0	0	0	112.6	T409 L410 E411 I415 D416 I417	T409-S413 PolarHBondContact O-N 2.66Å; L410-S413 WeakPolarHBondContact O-CB 3.41Å; L410-S413 PolarHBondContact O-N 2.87Å; E411-S413 VanDerWaalsContact C-N 3.32Å; E411-S413 PolarHBondContact O-N 2.94Å; S413-I415 VanDerWaalsContact C-N 3.32Å; S413-I415 PolarHBondContact O-N 3.36Å; S413-D416 PolarHBondContact O-N 2.79Å; S413-I417 WeakPolarHBondContact O-CG1 3.37Å; S413-I417 PolarHBondContact O-N 3.1Å
414	L	59.1	Low	53.3	Low	107 Å²	107	117.2 Å²	117.2	56%	0.56	61%	0.614	S	S	*	*	H	α-helix	trans	-62.4	-39.8	175.4	-73.7	167.8	0	0	0	112	L410 E411 D416 I417 M418	L410-L414 PolarHBondContact O-N 3.08Å; E411-L414 PolarHBondContact O-N 2.96Å; L414-D416 PolarHBondContact O-N 3.43Å; L414-I417 PolarHBondContact O-N 3.23Å; L414-M418 WeakPolarHBondContact O-CB 3.46Å; L414-M418 WeakPolarHBondContact O-CG 3.48Å; L414-M418 PolarHBondContact O-N 3.04Å
415	I	71	Confident	53.7	Low	74 Å²	74	120.9 Å²	120.9	38%	0.379	63%	0.626	S	S	.	*	H	α-helix	trans	-63.2	-39.1	177.5	-72.5	167.5	0	0	0	111.9	E411 N412 S413 R419	E411-I415 HydrophobicContact CG-CD1 4.14Å; E411-I415 WeakPolarHBondContact O-CD1 3.4Å; E411-I415 VanDerWaalsContact O-CG1 3.27Å; E411-I415 WeakPolarHBondContact O-CG1 3.27Å; E411-I415 PolarHBondContact O-N 3.28Å; E411-I415 VanDerWaalsContact O-N 3.08Å; N412-I415 PolarHBondContact O-N 2.93Å; S413-I415 VanDerWaalsContact C-N 3.32Å; S413-I415 PolarHBondContact O-N 3.36Å; I415-R419 VanDerWaalsContact O-CB 3.25Å; I415-R419 WeakPolarHBondContact O-CB 3.37Å; I415-R419 PolarHBondContact O-N 2.83Å
416	D	63	Low	53.5	Low	97 Å²	97	121.8 Å²	121.8	52%	0.519	63%	0.629	S	S	.	*	H	α-helix	trans	-74.2	-35.2	175.1	-90.2	-27.5	0	0	0	113.1	N412 S413 L414 R419 A420	N412-D416 PolarHBondContact O-N 2.96Å; N412-D416 VanDerWaalsContact O-N 3.13Å; S413-D416 PolarHBondContact O-N 2.79Å; L414-D416 PolarHBondContact O-N 3.43Å; D416-R419 PolarHBondContact O-N 2.81Å; D416-R419 IonicContact OD1-CZ 3.25Å; D416-R419 IonicContact OD1-NH1 2.72Å; D416-R419 PolarHBondContact OD1-NH1 2.86Å; D416-A420 WeakPolarHBondContact O-CB 3.4Å; D416-A420 PolarHBondContact O-N 2.91Å
417	I	71	Confident	52.7	Low	99 Å²	99	120.6 Å²	120.6	51%	0.508	64%	0.643	S	S	.	*	H	α-helix	trans	-62.2	-49.8	174.3	-68.5	164.3	0	0	0	110.5	S413 L414 R419 A420 E421	S413-I417 WeakPolarHBondContact O-CG1 3.37Å; S413-I417 PolarHBondContact O-N 3.1Å; L414-I417 PolarHBondContact O-N 3.23Å; I417-R419 PolarHBondContact O-N 3.22Å; I417-A420 PolarHBondContact O-N 2.89Å; I417-E421 PolarHBondContact O-N 2.76Å
418	M	64.1	Low	51.6	Low	135 Å²	135	124.5 Å²	124.5	67%	0.665	65%	0.65	S	S	*	*	H	α-helix	trans	-62.7	-27.3	177.2	-71.9	173.3	58.1	0	0	113.1	L414	L414-M418 WeakPolarHBondContact O-CB 3.46Å; L414-M418 WeakPolarHBondContact O-CG 3.48Å; L414-M418 PolarHBondContact O-N 3.04Å
419	R	62.6	Low	50.8	Low	152 Å²	152	127.3 Å²	127.3	57%	0.574	66%	0.664	S	S	*	*	H	α-helix	trans	-79.8	-35.8	176.7	-173.7	-177.7	-66.7	131.8	-1.8	112.4	I415 D416 I417	I415-R419 VanDerWaalsContact O-CB 3.25Å; I415-R419 WeakPolarHBondContact O-CB 3.37Å; I415-R419 PolarHBondContact O-N 2.83Å; D416-R419 PolarHBondContact O-N 2.81Å; D416-R419 IonicContact OD1-CZ 3.25Å; D416-R419 IonicContact OD1-NH1 2.72Å; D416-R419 PolarHBondContact OD1-NH1 2.86Å; I417-R419 PolarHBondContact O-N 3.22Å
420	A	49.5	Very low	49.7	Very low	72 Å²	72	125.5 Å²	125.5	60%	0.595	67%	0.668	S	S	*	*	H	α-helix	trans	-71.1	-28.6	179.1	0	0	0	0	0	113.3	D416 I417 Q422	D416-A420 WeakPolarHBondContact O-CB 3.4Å; D416-A420 PolarHBondContact O-N 2.91Å; I417-A420 PolarHBondContact O-N 2.89Å; A420-Q422 PolarHBondContact O-N 3.38Å
421	E	48	Very low	48.3	Very low	156 Å²	156	130.3 Å²	130.3	73%	0.729	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.9	-20.9	-175.4	-160.6	168.1	-163	0	0	113.8	I417	I417-E421 PolarHBondContact O-N 2.76Å
422	Q	46.7	Very low	47.4	Very low	175 Å²	175	130 Å²	130	82%	0.818	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.1	-15.1	-176.4	-74.7	-155.8	-22.3	0	0	116	A420	A420-Q422 PolarHBondContact O-N 3.38Å
423	D	39	Very low	46.1	Very low	153 Å²	153	132.9 Å²	132.9	82%	0.818	70%	0.704	S	S	*	*			trans	-111.2	41.2	-164.1	-139.3	-13.5	0	0	0	114.8
424	T	38.9	Very low	45.1	Very low	118 Å²	118	136 Å²	136	72%	0.724	72%	0.722	S	S	*	*			trans	-118.9	14.7	-179	54	0	0	0	0	115.2
425	L	41.3	Very low	43.7	Very low	159 Å²	159	133.8 Å²	133.8	83%	0.832	73%	0.726	S	S	*	*			trans	-113.1	71.2	-177.8	-75.1	173.8	0	0	0	114.6
426	K	33.5	Very low	41.6	Very low	213 Å²	213	134.6 Å²	134.6	93%	0.926	74%	0.743	S	S	*	*			trans	-166.1	137.4	157.4	-98.4	134.3	-174.2	171.8	0	112
427	G	28.6	Very low	40	Very low	85 Å²	85	137 Å²	137	88%	0.876	76%	0.756	S	S	*	*			trans	125.8	124	166.6	0	0	0	0	0	114.8
428	R	33.3	Very low	38.1	Very low	218 Å²	218	138 Å²	138	82%	0.823	76%	0.763	S	S	*	*			trans	-147.6	160.3	178.9	-163.3	-173	-167.4	-84.7	3.3	109.2
429	L	31.6	Very low	37.2	Very low	157 Å²	157	137.3 Å²	137.3	82%	0.822	77%	0.768	S	S	*	*			trans	77.8	144.7	178.7	-42.9	167	0	0	0	113
430	G	27.5	Very low	35.8	Very low	74 Å²	74	136.7 Å²	136.7	76%	0.763	78%	0.776	S	S	*	*			cis	-175.6	159.4	-5.8	0	0	0	0	0	112.2
431	F	28.3	Very low	35.5	Very low	202 Å²	202	138.1 Å²	138.1	89%	0.886	78%	0.779	S	S	*	*			trans	-73.2	170.9	177.8	-83.3	-89.2	0	0	0	113
432	P	40.1	Very low	34.7	Very low	120 Å²	120	139.1 Å²	139.1	78%	0.779	79%	0.789	S	S	*	*			cis	-139.8	-176.9	19.9	43	-23.5	0	0	0	118.7
433	H	28.6	Very low	33.9	Very low	163 Å²	163	138.6 Å²	138.6	76%	0.755	79%	0.791	S	S	*	*			trans	-77.6	164.7	168.3	-90.8	-73.1	0	0	0	113.3
434	P	41.8	Very low	33.4	Very low	126 Å²	126	136.2 Å²	136.2	82%	0.818	79%	0.793	S	S	*	*				-124.6	166.2	87.6	36.9	-30.7	0	0	0	113
435	G	28.9	Very low	33	Very low	62 Å²	62	142.2 Å²	142.2	64%	0.639	80%	0.802	S	S	*	*			cis	133.9	149.9	-4	0	0	0	0	0	112.2
436	A	28	Very low	32.4	Very low	90 Å²	90	139.9 Å²	139.9	74%	0.744	79%	0.79	S	S	*	*			cis	-99.9	-95.9	-1.8	0	0	0	0	0	112.8
437	D	27.9	Very low	32.2	Very low	147 Å²	147	139.2 Å²	139.2	79%	0.786	78%	0.783	S	S	*	*			cis	-147.2	151.1	-3.9	-94.7	-73.9	0	0	0	109.6
438	N	31.3	Very low	32.1	Very low	120 Å²	120	140.3 Å²	140.3	64%	0.642	78%	0.778	S	S	*	*			trans	-167.6	161.3	-162.2	-150.4	14.5	0	0	0	111.6	L440	N438-L440 WeakPolarHBondContact ND2-CD2 3.21Å
439	P	44.8	Very low	31.9	Very low	121 Å²	121	141.3 Å²	141.3	79%	0.786	78%	0.781	S	S	*	*				-148.3	168.8	89.8	38	-19.6	0	0	0	117.8
440	L	34.2	Very low	31.9	Very low	139 Å²	139	145.9 Å²	145.9	73%	0.728	79%	0.788	S	S	*	*			trans	-82.5	-174.6	-175.9	-52.7	174.5	0	0	0	112.9	N438	N438-L440 WeakPolarHBondContact ND2-CD2 3.21Å
441	P	42.2	Very low	32.2	Very low	102 Å²	102	154.1 Å²	154.1	66%	0.662	80%	0.796	S	S	*	*			cis	-136.3	158.5	-1.3	38.9	-21.1	0	0	0	117.5
442	L	31.6	Very low	32.2	Very low	178 Å²	178	146.9 Å²	146.9	93%	0.932	78%	0.778	S	S	*	*			trans	-100	143.5	148.2	-91.7	84.1	0	0	0	110.2
443	N	31	Very low	31.8	Very low	164 Å²	164	150.5 Å²	150.5	88%	0.877	78%	0.784	S	S	*	*			trans	-90.4	121.3	177.5	-87.7	-58.2	0	0	0	111.9
444	A	28	Very low	31.8	Very low	102 Å²	102	148.3 Å²	148.3	84%	0.843	79%	0.787	S	S	*	*			trans	-151.6	98.1	160.7	0	0	0	0	0	111.3
445	R	31.4	Very low	31.3	Very low	245 Å²	245	147.7 Å²	147.7	93%	0.925	79%	0.786	S	S	*	*			trans	-135	152.8	167.7	-88.5	-179.8	164.7	171.2	-5.7	108.1
446	N	28	Very low	31.3	Very low	109 Å²	109	152.3 Å²	152.3	58%	0.583	80%	0.795	S	S	*	*			cis	-166.7	152.8	-35.6	-153.3	-8.4	0	0	0	108
447	Y	28.3	Very low	31.7	Very low	200 Å²	200	157.6 Å²	157.6	78%	0.784	80%	0.802	S	S	*	*			trans	60.5	135	172.4	-47.4	-64.4	0	0	0	117.3
448	S	27	Very low	32.1	Very low	108 Å²	108	156.6 Å²	156.6	76%	0.755	80%	0.803	S	S	*	*				-172.7	152.7	59.8	-72.6	0	0	0	0	115.2
449	R	29.7	Very low	31.9	Very low	239 Å²	239	160 Å²	160	90%	0.902	82%	0.817	S	S	*	*			trans	55.8	109.1	152.2	-66.1	-173.1	-172.3	-133.4	1.3	122
450	R	31.1	Very low	31.3	Very low	253 Å²	253	163.3 Å²	163.3	96%	0.955	82%	0.823	S	S	*	*			trans	5.7	144.6	131.7	-49.9	179.9	-170.6	-131.1	4.4	119.3
451	R	34.2	Very low	31.2	Very low	247 Å²	247	163.8 Å²	163.8	93%	0.932	83%	0.826	S	S	*	*			trans	-139.3	129	145	-164.8	178.7	-68.2	-160.3	0.2	109.7
452	G	28.6	Very low	30.4	Very low	50 Å²	50	164.2 Å²	164.2	52%	0.515	83%	0.831	S	S	.	*			trans	-69.6	170	171.7	0	0	0	0	0	111.9
453	H	30.7	Very low	30.4	Very low	195 Å²	195	164.9 Å²	164.9	90%	0.903	83%	0.827	S	S	*	*			cis	50.1	78.4	42.7	-81.8	-90.8	0	0	0	112.2	S455	H453-S455 PolarHBondContact O-N 2.83Å
454	S	29.2	Very low	31.1	Very low	117 Å²	117	163.1 Å²	163.1	82%	0.818	82%	0.824	S	S	*	*			trans	-95.2	80.7	176.7	-57.6	0	0	0	0	110.9
455	S	30.6	Very low	31.3	Very low	114 Å²	114	166.4 Å²	166.4	80%	0.797	83%	0.828	S	S	*	*			trans	-71.2	133.5	159.7	-63.4	0	0	0	0	109	H453 F457	H453-S455 PolarHBondContact O-N 2.83Å; S455-F457 PolarHBondContact O-N 2.97Å
456	L	30.3	Very low	32	Very low	158 Å²	158	161.3 Å²	161.3	83%	0.827	82%	0.819	S	S	*	*			trans	-85.4	96.7	178.8	-69.4	167.9	0	0	0	110.6
457	F	34.6	Very low	32	Very low	201 Å²	201	163.2 Å²	163.2	88%	0.882	82%	0.824	S	S	*	*			trans	-161.9	147.3	148	-80.6	-55.4	0	0	0	110.1	S455	S455-F457 PolarHBondContact O-N 2.97Å
458	P	36.3	Very low	32.5	Very low	126 Å²	126	163.8 Å²	163.8	82%	0.818	83%	0.825	S	S	*	*			trans	-86	155.8	-179.9	35.4	-34.7	0	0	0	112.5
459	M	28.3	Very low	32.6	Very low	191 Å²	191	163.7 Å²	163.7	94%	0.941	83%	0.831	S	S	*	*			trans	-146.3	145.4	168.8	-159.4	166	-166.8	0	0	109.1
460	E	32	Very low	32.9	Very low	192 Å²	192	159.2 Å²	159.2	90%	0.897	83%	0.825	S	S	*	*			trans	-84.5	149.5	-177.7	-61.2	-167	102.6	0	0	112.2
461	D	32.1	Very low	33.1	Very low	148 Å²	148	156.1 Å²	156.1	79%	0.791	82%	0.821	S	S	*	*			trans	-91	132.1	176	-112.5	-52.2	0	0	0	110.3
462	S	25.3	Very low	33	Very low	112 Å²	112	147.9 Å²	147.9	78%	0.783	81%	0.813	S	S	*	*			trans	-153.2	132.1	165.2	-81.2	0	0	0	0	110.7
463	F	32.3	Very low	33.2	Very low	192 Å²	192	154.3 Å²	154.3	84%	0.842	83%	0.834	S	S	*	*			trans	-85.1	143.7	-170.5	-60.9	-100.6	0	0	0	111.7
464	P	45	Very low	33.2	Very low	126 Å²	126	149.9 Å²	149.9	82%	0.818	83%	0.832	S	S	*	*			trans	-85.7	140	157.9	34.3	-30.2	0	0	0	110.8
465	D	33.2	Very low	33.4	Very low	171 Å²	171	147.7 Å²	147.7	91%	0.914	83%	0.827	S	S	*	*			trans	-140	152.9	161.9	-167.2	-138.6	0	0	0	107.7
466	D	44.7	Very low	33.7	Very low	138 Å²	138	150.9 Å²	150.9	74%	0.738	83%	0.834	S	S	*	*			trans	-130.6	110.8	-162.6	-169.9	-19.8	0	0	0	111.8
467	E	29.6	Very low	33.7	Very low	149 Å²	149	147.4 Å²	147.4	70%	0.696	84%	0.837	S	S	*	*				-165.9	126.9	128.1	-109.4	-159.4	85.6	0	0	114.3
468	R	38	Very low	33.3	Very low	213 Å²	213	142.6 Å²	142.6	80%	0.804	83%	0.828	S	S	*	*				50.9	105.8	127	-167.3	-169.1	-121.7	118.2	0.1	120.2
469	A	30	Very low	33.4	Very low	106 Å²	106	142.2 Å²	142.2	88%	0.876	83%	0.826	S	S	*	*			trans	-144.2	140.3	144.9	0	0	0	0	0	111.3
470	D	35.8	Very low	33.7	Very low	144 Å²	144	141.3 Å²	141.3	77%	0.77	82%	0.819	S	S	*	*			trans	-98.8	129.5	176.9	175.6	-86.8	0	0	0	110.9
471	Q	33.6	Very low	33.5	Very low	189 Å²	189	137.8 Å²	137.8	88%	0.883	81%	0.814	S	S	*	*			trans	171.7	134.4	146.9	-97.1	148.7	96.8	0	0	109
472	G	32.1	Very low	33.4	Very low	73 Å²	73	140.3 Å²	140.3	75%	0.753	82%	0.818	S	S	*	*			trans	-120.6	156.1	-171.6	0	0	0	0	0	115.3
473	L	32.8	Very low	33.9	Very low	185 Å²	185	139 Å²	139	97%	0.969	81%	0.808	S	S	*	*			trans	-153.6	161.8	151.4	-141.6	72.4	0	0	0	110
474	A	31.9	Very low	34.4	Very low	103 Å²	103	139.7 Å²	139.7	85%	0.851	81%	0.813	S	S	*	*			trans	-91.3	148.6	-173.7	0	0	0	0	0	113.4
475	G	32.3	Very low	34.1	Very low	70 Å²	70	141.3 Å²	141.3	72%	0.722	81%	0.809	S	S	*	*			trans	164.3	137.2	164	0	0	0	0	0	115
476	L	38.7	Very low	34.1	Very low	181 Å²	181	140.3 Å²	140.3	95%	0.948	80%	0.804	S	S	*	*			trans	60.9	95.7	162.6	-49.8	-178.5	0	0	0	117.2
477	G	29	Very low	33.8	Very low	85 Å²	85	137.4 Å²	137.4	88%	0.876	81%	0.806	S	S	*	*			trans	-75.7	149.2	159.7	0	0	0	0	0	111.8
478	S	27.2	Very low	34.6	Very low	101 Å²	101	137.9 Å²	137.9	71%	0.706	81%	0.809	S	S	*	*			trans	-122.9	134.1	175	-170.9	0	0	0	0	110.4	H480	S478-H480 PolarHBondContact O-N 3.17Å; S478-H480 VanDerWaalsContact O-N 3.09Å
479	P	36.8	Very low	35.5	Very low	117 Å²	117	137.9 Å²	137.9	76%	0.76	81%	0.809	S	S	*	*			trans	-86.4	82.4	-165.2	34.3	-36.7	0	0	0	113.5
480	H	35.8	Very low	37.2	Very low	173 Å²	173	138.3 Å²	138.3	80%	0.801	80%	0.8	S	S	*	*			trans	-104	63.6	166.5	-86.5	-61.1	0	0	0	112.7	S478	S478-H480 PolarHBondContact O-N 3.17Å; S478-H480 VanDerWaalsContact O-N 3.09Å
481	C	26.6	Very low	39.5	Very low	117 Å²	117	135.8 Å²	135.8	79%	0.791	78%	0.784	S	S	*	*			trans	-143.9	95.8	163.1	-84.9	0	0	0	0	108.9	P483	C481-P483 WeakPolarHBondContact O-CD 3.47Å
482	F	30.6	Very low	42.3	Very low	201 Å²	201	134 Å²	134	88%	0.882	77%	0.769	S	S	*	*			trans	-81.8	112	157.2	-80.5	-78	0	0	0	107.1
483	P	36.9	Very low	45.3	Very low	86 Å²	86	131.7 Å²	131.7	56%	0.558	74%	0.738	S	S	*	*			trans	-76.7	128.7	-179.7	33.4	-34.8	0	0	0	109.2	C481 Q485	C481-P483 WeakPolarHBondContact O-CD 3.47Å; P483-Q485 VanDerWaalsContact C-N 3.28Å; P483-Q485 HydrophobicContact CB-CG 3.67Å; P483-Q485 HydrophobicContact CG-CG 4.11Å; P483-Q485 PolarHBondContact O-N 2.68Å
484	H	42.3	Very low	48.3	Very low	205 Å²	205	123 Å²	123	95%	0.949	69%	0.692	S	S	*	*			trans	-71	82.5	174.3	-100.1	-79.7	0	0	0	110.2
485	Q	38.3	Very low	51.4	Low	161 Å²	161	121.1 Å²	121.1	75%	0.752	66%	0.663	S	S	*	*			trans	-142.7	137	177.9	-4.4	-170.2	107	0	0	111.1	P483	P483-Q485 VanDerWaalsContact C-N 3.28Å; P483-Q485 HydrophobicContact CB-CG 3.67Å; P483-Q485 HydrophobicContact CG-CG 4.11Å; P483-Q485 PolarHBondContact O-N 2.68Å
486	N	34.2	Very low	54.5	Low	150 Å²	150	118.9 Å²	118.9	80%	0.802	63%	0.634	S	S	*	*			trans	67.9	129.8	-175.9	-151.5	40.1	0	0	0	116.6	E488	N486-E488 VanDerWaalsContact C-N 3.3Å; N486-E488 PolarHBondContact O-N 3.49Å
487	G	38.2	Very low	57.2	Low	76 Å²	76	110.3 Å²	110.3	78%	0.784	59%	0.588	S	S	*	*			trans	-89.2	38	-172.5	0	0	0	0	0	114.7	R489	G487-R489 PolarHBondContact O-N 3.29Å
488	E	45	Very low	60.5	Low	159 Å²	159	108.4 Å²	108.4	74%	0.743	56%	0.556	S	S	*	*			trans	-74.3	110.1	174.6	-169.9	160.9	-155.8	0	0	109	N486 V490	N486-E488 VanDerWaalsContact C-N 3.3Å; N486-E488 PolarHBondContact O-N 3.49Å; E488-V490 VanDerWaalsContact C-N 3.35Å; E488-V490 PolarHBondContact O-N 2.83Å
489	R	58	Low	63.8	Low	213 Å²	213	103.6 Å²	103.6	80%	0.804	52%	0.523	S	S	*	.			trans	-68.5	98	171.2	-68.8	-172.4	-164.5	139	1.9	107.4	G487 E491	G487-R489 PolarHBondContact O-N 3.29Å; R489-E491 PolarHBondContact O-N 2.58Å
490	V	65.6	Low	66.6	Low	115 Å²	115	98.4 Å²	98.4	70%	0.697	49%	0.491	S	S	*	.			trans	-47.4	114.6	167.5	179.6	0	0	0	0	107.6	E488	E488-V490 VanDerWaalsContact C-N 3.35Å; E488-V490 PolarHBondContact O-N 2.83Å
491	E	83.1	Confident	69.4	Low	92 Å²	92	92.2 Å²	92.2	43%	0.43	47%	0.473	S	S	.	.			trans	-63.8	141.8	-178	-66.3	-150.2	115.3	0	0	109.7	R489 Y493 N585	R489-E491 PolarHBondContact O-N 2.58Å; E491-Y493 HydrophobicContact CB-CD2 4.22Å; E491-Y493 HydrophobicContact CB-CE2 3.47Å; E491-Y493 VanDerWaalsContact CB-CE2 3.47Å; E491-Y493 PolarHBondContact OE2-OH 3.36Å; E491-N585 PolarHBondContact OE1-ND2 3.04Å
492	R	92.1	Very high	72.7	Confident	152 Å²	152	86.8 Å²	86.8	57%	0.574	44%	0.436	S	S	*	.			trans	-117.7	137.6	-173.6	-75.9	-159.1	-176	169.8	1.2	109.8	E548 N585 L586	R492-E548 WeakPolarHBondContact CA-OE1 3.48Å; R492-E548 WeakPolarHBondContact CB-OE1 3.43Å; R492-E548 WeakPolarHBondContact CG-OE1 3.49Å; R492-N585 CarbonylContact O-C 3.59Å; R492-N585 WeakPolarHBondContact O-CA 3.11Å; R492-N585 PolarHBondContact O-OD1 3.11Å; R492-L586 HydrophobicContact CB-CB 4.2Å; R492-L586 HydrophobicContact CB-CD1 4.14Å; R492-L586 HydrophobicContact CB-CG 4.26Å; R492-L586 PolarHBondContact O-N 2.69Å
493	Y	95.6	Very high	75.8	Confident	24 Å²	24	77.2 Å²	77.2	9%	0.094	39%	0.394	C	S	.	.	B	Isolated β-bridge	trans	-134.9	140	-163.2	-77	-72.7	0	0	0	112.3	E491 R495 E548 V551 I555 P583 W584 N585	E491-Y493 HydrophobicContact CB-CD2 4.22Å; E491-Y493 HydrophobicContact CB-CE2 3.47Å; E491-Y493 VanDerWaalsContact CB-CE2 3.47Å; E491-Y493 PolarHBondContact OE2-OH 3.36Å; Y493-R495 PolarHBondContact O-N 3.4Å; Y493-E548 PolarHBondContact N-OE1 3.26Å; Y493-V551 HydrophobicContact CG-CG1 4.29Å; Y493-I555 HydrophobicContact CD1-CD1 3.88Å; Y493-I555 HydrophobicContact CD2-CD1 3.59Å; Y493-I555 HydrophobicContact CE1-CD1 3.8Å; Y493-I555 HydrophobicContact CE2-CD1 3.52Å; Y493-I555 HydrophobicContact CG-CD1 3.78Å; Y493-P583 HydrophobicContact CD1-CB 3.7Å; Y493-P583 HydrophobicContact CD1-CG 4.15Å; Y493-P583 HydrophobicContact CE1-CB 4Å; Y493-P583 HydrophobicContact CE1-CG 3.91Å; Y493-W584 WeakPolarHBondContact CA-O 3.42Å; Y493-N585 HydrophobicContact CD1-CB 4.18Å; Y493-N585 HydrophobicContact CE1-CB 3.7Å; Y493-N585 PolarHBondContact OH-ND2 3.18Å
494	S	96.8	Very high	78.4	Confident	2 Å²	2	77.7 Å²	77.7	1%	0.014	40%	0.398	C	S	.	.			trans	-61.1	130.6	171.3	178	0	0	0	0	110	K496 W584 L641	S494-K496 PolarHBondContact O-N 3.26Å; S494-K496 PolarHBondContact OG-N 3.27Å; S494-K496 PolarHBondContact OG-O 3.32Å; S494-W584 PolarHBondContact N-O 3.41Å; S494-L641 PolarHBondContact OG-O 3.27Å
495	R	96.4	Very high	80.7	Confident	63 Å²	63	69.5 Å²	69.5	24%	0.238	36%	0.36	C	S	.	.	S	Bend	trans	-56.9	-15.6	170.1	-65.8	-170.8	-64.4	146.9	6	113.8	Y493 L544 F545 Q546 E640 L641	Y493-R495 PolarHBondContact O-N 3.4Å; R495-L544 WeakPolarHBondContact O-CA 3.36Å; R495-F545 PolarHBondContact O-N 3.24Å; R495-Q546 WeakPolarHBondContact CD-O 3.43Å; R495-Q546 PolarHBondContact NH1-O 3.49Å; R495-E640 PolarHBondContact NH2-O 3.23Å; R495-L641 HydrophobicContact CB-CD2 4.49Å
496	K	96.7	Very high	83.4	Confident	24 Å²	24	61.8 Å²	61.8	10%	0.104	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	118.1	171.5	-169.6	175.7	-178.7	86.7	0	109.8	S494 D524 F542 L543 L544 L641 Y643	S494-K496 PolarHBondContact O-N 3.26Å; S494-K496 PolarHBondContact OG-N 3.27Å; S494-K496 PolarHBondContact OG-O 3.32Å; K496-D524 IonicContact NZ-OD2 3.11Å; K496-D524 PolarHBondContact NZ-OD2 3.13Å; K496-F542 HydrophobicContact CD-CB 4.5Å; K496-F542 HydrophobicContact CD-CD1 4.4Å; K496-F542 VanDerWaalsContact CE-CG 3.43Å; K496-F542 HydrophobicContact CG-CB 4.17Å; K496-F542 HydrophobicContact CG-CD1 4.27Å; K496-L543 CarbonylContact C-O 3.54Å; K496-L543 VanDerWaalsContact CA-O 3.3Å; K496-L543 WeakPolarHBondContact CA-O 3.39Å; K496-L544 HydrophobicContact CD-CD1 4.47Å; K496-L544 HydrophobicContact CG-CD1 4.17Å; K496-L544 HydrophobicContact CG-CG 4.24Å; K496-L641 HydrophobicContact CB-CB 4.4Å; K496-L641 HydrophobicContact CB-CD1 4.3Å; K496-L641 HydrophobicContact CD-CD1 4.11Å; K496-Y643 HydrophobicContact CB-CD2 3.73Å; K496-Y643 HydrophobicContact CB-CE2 4.44Å; K496-Y643 HydrophobicContact CB-CG 4Å; K496-Y643 HydrophobicContact CD-CD1 4.1Å; K496-Y643 HydrophobicContact CD-CD2 4.31Å; K496-Y643 HydrophobicContact CD-CG 3.95Å; K496-Y643 HydrophobicContact CG-CD2 4.04Å; K496-Y643 HydrophobicContact CG-CE2 4.38Å; K496-Y643 HydrophobicContact CG-CG 4.19Å; K496-Y643 WeakPolarHBondContact O-CD2 3.14Å; K496-Y643 VanDerWaalsContact O-CE2 3.23Å; K496-Y643 WeakPolarHBondContact O-CE2 3.44Å
497	V	97.1	Very high	86.1	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	137.2	179.3	-179.2	0	0	0	0	108.7	F542 L543 F545 V551 L554 I581	V497-F542 CarbonylContact O-C 3.56Å; V497-F542 VanDerWaalsContact O-CA 3.24Å; V497-F542 WeakPolarHBondContact O-CA 3.47Å; V497-L543 HydrophobicContact CB-CB 4.42Å; V497-L543 PolarHBondContact N-O 3.22Å; V497-L543 PolarHBondContact O-N 3.45Å; V497-F545 HydrophobicContact CG2-CD2 4.22Å; V497-F545 HydrophobicContact CG2-CE2 4.21Å; V497-V551 HydrophobicContact CG2-CB 4.39Å; V497-V551 HydrophobicContact CG2-CG1 3.61Å; V497-V551 HydrophobicContact CG2-CG2 3.91Å; V497-L554 HydrophobicContact CG1-CD2 4.2Å; V497-I581 HydrophobicContact CG1-CG2 3.7Å
498	F	96.9	Very high	88.8	Confident	45 Å²	45	56.7 Å²	56.7	20%	0.197	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	138.6	170.2	168.4	-82.9	0	0	0	110.2	Y540 F542 R582	F498-Y540 HydrophobicContact CD2-CD2 4.33Å; F498-Y540 AromaticContact CE2-CD2 3.64Å; F498-Y540 HydrophobicContact CE2-CD2 3.64Å; F498-Y540 HydrophobicContact CE2-CG 4Å; F498-Y540 HydrophobicContact CZ-CD2 4.48Å; F498-Y540 HydrophobicContact CZ-CG 4.41Å; F498-F542 HydrophobicContact CB-CD1 4.11Å; F498-F542 HydrophobicContact CB-CE1 4.03Å; F498-F542 HydrophobicContact CD2-CD1 4.34Å; F498-F542 AromaticContact CD2-CE1 3.77Å; F498-F542 HydrophobicContact CD2-CE1 3.77Å; F498-F542 HydrophobicContact CD2-CZ 4.15Å; F498-F542 HydrophobicContact CG-CE1 4.4Å; F498-R582 HydrophobicContact CB-CB 4.19Å; F498-R582 HydrophobicContact CD1-CB 3.92Å; F498-R582 HydrophobicContact CD1-CG 3.95Å; F498-R582 PolarHBondContact N-O 2.85Å; F498-R582 PolarHBondContact O-N 2.89Å
499	V	96.9	Very high	91.1	Very high	1 Å²	1	55 Å²	55	1%	0.006	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.3	124.3	173	-179.3	0	0	0	0	109	L502 F515 Y540 A541 L543 V579 Q580 I581	V499-L502 HydrophobicContact CG1-CD2 3.68Å; V499-L502 HydrophobicContact CG1-CG 4.08Å; V499-F515 HydrophobicContact CG1-CZ 4.21Å; V499-F515 HydrophobicContact CG2-CZ 4.18Å; V499-Y540 CarbonylContact O-C 3.59Å; V499-Y540 WeakPolarHBondContact O-CA 3.34Å; V499-Y540 WeakPolarHBondContact O-CB 3.39Å; V499-A541 PolarHBondContact N-O 3.41Å; V499-A541 PolarHBondContact O-N 3.08Å; V499-L543 HydrophobicContact CG2-CD1 3.73Å; V499-L543 HydrophobicContact CG2-CD2 4.29Å; V499-L543 HydrophobicContact CG2-CG 3.72Å; V499-V579 HydrophobicContact CG1-CB 4.16Å; V499-V579 HydrophobicContact CG1-CG2 3.65Å; V499-Q580 CarbonylContact C-O 3.55Å; V499-Q580 WeakPolarHBondContact CA-O 3.17Å; V499-I581 HydrophobicContact CB-CD1 4.47Å; V499-I581 HydrophobicContact CG1-CD1 4.02Å; V499-I581 HydrophobicContact CG2-CD1 3.8Å
500	G	95.8	Very high	92.8	Very high	8 Å²	8	47.4 Å²	47.4	8%	0.082	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	155	-177.5	0	0	0	0	0	113.1	V579 Q580	G500-V579 CarbonylContact O-C 3.5Å; G500-Q580 PolarHBondContact N-O 2.9Å; G500-Q580 PolarHBondContact O-N 2.96Å
501	G	95.4	Very high	94.2	Very high	42 Å²	42	42 Å²	42	43%	0.433	21%	0.214	S	C	.	.	S	Bend	trans	79.8	17.2	-178.3	0	0	0	0	0	114.1	G539 K577	G501-G539 PolarHBondContact N-O 3.35Å; G501-K577 WeakPolarHBondContact O-CD 3.33Å; G501-K577 WeakPolarHBondContact O-CE 3.16Å; G501-K577 PolarHBondContact O-NZ 2.98Å
502	L	95.6	Very high	94.8	Very high	4 Å²	4	38.6 Å²	38.6	2%	0.021	20%	0.199	C	C	.	.			trans	-49.7	152.4	173.8	-67.8	170.2	0	0	0	111.9	V499 I506 I511 P536 G539 A541 K577 V579	V499-L502 HydrophobicContact CG1-CD2 3.68Å; V499-L502 HydrophobicContact CG1-CG 4.08Å; L502-I506 HydrophobicContact CB-CG2 4.01Å; L502-I506 HydrophobicContact CD2-CG2 4.45Å; L502-I511 HydrophobicContact CD1-CD1 3.98Å; L502-I511 HydrophobicContact CD2-CG1 4.38Å; L502-P536 HydrophobicContact CD1-CB 4.13Å; L502-P536 HydrophobicContact CD1-CG 3.79Å; L502-G539 PolarHBondContact N-O 2.83Å; L502-A541 HydrophobicContact CD1-CB 3.76Å; L502-K577 PolarHBondContact O-NZ 3.46Å; L502-V579 HydrophobicContact CD2-CB 4.45Å; L502-V579 HydrophobicContact CD2-CG1 4.2Å; L502-V579 HydrophobicContact CD2-CG2 4.44Å
503	P	94.6	Very high	95	Very high	0 Å²	0	34.7 Å²	34.7	0%	0	20%	0.2	C	C	.	.			trans	-54.5	146.6	166.4	-20.8	31.2	0	0	0	111.1	D505 I506 S571 I574 K577	P503-D505 WeakPolarHBondContact CB-OD1 3.46Å; P503-D505 PolarHBondContact O-N 3.03Å; P503-I506 HydrophobicContact CB-CB 4.1Å; P503-I506 HydrophobicContact CB-CG2 4.49Å; P503-I506 HydrophobicContact CG-CB 4.22Å; P503-I506 HydrophobicContact CG-CD1 4.39Å; P503-I506 WeakPolarHBondContact O-CG2 3.3Å; P503-S571 VanDerWaalsContact CB-OG 3.26Å; P503-S571 WeakPolarHBondContact CB-OG 3.46Å; P503-I574 HydrophobicContact CB-CB 4.39Å; P503-I574 HydrophobicContact CB-CD1 4.28Å; P503-K577 HydrophobicContact CB-CD 4.35Å; P503-K577 HydrophobicContact CG-CB 4.31Å; P503-K577 HydrophobicContact CG-CD 3.87Å
504	P	91.8	Very high	95	Very high	96 Å²	96	35.1 Å²	35.1	62%	0.623	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-13.6	-178.5	33	-36	0	0	0	113	I574	P504-I574 HydrophobicContact CG-CD1 4.45Å
505	D	91.5	Very high	95	Very high	32 Å²	32	35 Å²	35	17%	0.171	21%	0.206	C	C	.	.	T	Hydrogen-bonded Turn	trans	-111.9	5.1	-174.9	64.3	-40.5	0	0	0	113.5	P503 F535 S571 T573	P503-D505 WeakPolarHBondContact CB-OD1 3.46Å; P503-D505 PolarHBondContact O-N 3.03Å; D505-F535 WeakPolarHBondContact O-CE1 3.34Å; D505-S571 WeakPolarHBondContact OD1-CB 3.46Å; D505-S571 PolarHBondContact OD1-OG 3.44Å; D505-S571 PolarHBondContact OD2-OG 3.16Å; D505-T573 VanDerWaalsContact CG-OG1 3.26Å; D505-T573 VanDerWaalsContact OD2-CB 3.3Å; D505-T573 WeakPolarHBondContact OD2-CB 3.21Å; D505-T573 WeakPolarHBondContact OD2-CG2 3.18Å; D505-T573 PolarHBondContact OD2-N 3.44Å; D505-T573 PolarHBondContact OD2-OG1 2.88Å
506	I	93.8	Very high	95	Very high	0 Å²	0	38.4 Å²	38.4	0%	0	22%	0.219	C	C	.	.			trans	-80.8	136.6	177.9	-156.1	174.3	0	0	0	111.2	L502 P503 E510 I511 F535 P536 V569	L502-I506 HydrophobicContact CB-CG2 4.01Å; L502-I506 HydrophobicContact CD2-CG2 4.45Å; P503-I506 HydrophobicContact CB-CB 4.1Å; P503-I506 HydrophobicContact CB-CG2 4.49Å; P503-I506 HydrophobicContact CG-CB 4.22Å; P503-I506 HydrophobicContact CG-CD1 4.39Å; P503-I506 WeakPolarHBondContact O-CG2 3.3Å; I506-E510 WeakPolarHBondContact CA-OE2 3.06Å; I506-E510 HydrophobicContact CD1-CB 4.18Å; I506-E510 HydrophobicContact CG1-CB 3.59Å; I506-E510 WeakPolarHBondContact CG1-OE2 3.43Å; I506-I511 HydrophobicContact CD1-CG1 3.83Å; I506-I511 HydrophobicContact CG1-CG1 4.06Å; I506-I511 HydrophobicContact CG2-CD1 4.06Å; I506-I511 HydrophobicContact CG2-CG1 3.99Å; I506-F535 WeakPolarHBondContact O-CD1 3.42Å; I506-P536 HydrophobicContact CG2-CG 4.18Å; I506-P536 WeakPolarHBondContact O-CD 3.26Å; I506-V569 HydrophobicContact CD1-CG1 3.36Å
507	D	92.3	Very high	94.9	Very high	51 Å²	51	45.2 Å²	45.2	27%	0.273	24%	0.244	S	C	.	.			trans	-101.3	-179.1	176.9	71.4	31.2	0	0	0	113.8	D509 E510 I511 F535	D507-D509 WeakPolarHBondContact OD1-CA 3.38Å; D507-D509 PolarHBondContact OD1-N 2.87Å; D507-E510 PolarHBondContact N-OE2 3.22Å; D507-E510 PolarHBondContact OD1-N 3.26Å; D507-I511 WeakPolarHBondContact O-CD1 3.46Å; D507-I511 WeakPolarHBondContact O-CG1 3.33Å; D507-I511 PolarHBondContact O-N 2.97Å; D507-I511 VanDerWaalsContact O-N 3.11Å; D507-F535 HydrophobicContact CB-CE1 4.39Å
508	E	93.3	Very high	94.9	Very high	67 Å²	67	46.5 Å²	46.5	31%	0.313	25%	0.249	S	C	.	.	H	α-helix	trans	-62.2	-38.1	177.6	170	161.8	-149.5	0	0	113.6	T512 V523 W525 K528	E508-T512 WeakPolarHBondContact O-CB 3.41Å; E508-T512 PolarHBondContact O-N 2.93Å; E508-T512 PolarHBondContact O-OG1 3.05Å; E508-V523 HydrophobicContact CG-CB 4.27Å; E508-W525 HydrophobicContact CB-CH2 3.97Å; E508-W525 HydrophobicContact CB-CZ3 4.31Å; E508-K528 IonicContact OE1-NZ 3.61Å; E508-K528 PolarHBondContact OE1-NZ 3.36Å; E508-K528 WeakPolarHBondContact OE2-CE 3.25Å; E508-K528 IonicContact OE2-NZ 2.72Å; E508-K528 PolarHBondContact OE2-NZ 3.02Å
509	D	93.5	Very high	94.9	Very high	125 Å²	125	45.4 Å²	45.4	67%	0.668	25%	0.251	S	S	*	.	H	α-helix	trans	-74.7	-36.6	-174.9	-75.6	-42.5	0	0	0	110.6	D507 T512 A513	D507-D509 WeakPolarHBondContact OD1-CA 3.38Å; D507-D509 PolarHBondContact OD1-N 2.87Å; D509-T512 PolarHBondContact O-N 2.61Å; D509-A513 VanDerWaalsContact O-CB 3.26Å; D509-A513 WeakPolarHBondContact O-CB 3.44Å; D509-A513 PolarHBondContact O-N 2.91Å
510	E	94.2	Very high	94.8	Very high	52 Å²	52	49 Å²	49	24%	0.243	27%	0.268	C	S	.	.	H	α-helix	trans	-69.3	-41.9	173.3	-69.6	-174.9	139.9	0	0	113	I506 D507 T512 S514 P572	I506-E510 WeakPolarHBondContact CA-OE2 3.06Å; I506-E510 HydrophobicContact CD1-CB 4.18Å; I506-E510 HydrophobicContact CG1-CB 3.59Å; I506-E510 WeakPolarHBondContact CG1-OE2 3.43Å; D507-E510 PolarHBondContact N-OE2 3.22Å; D507-E510 PolarHBondContact OD1-N 3.26Å; E510-T512 VanDerWaalsContact C-N 3.34Å; E510-S514 WeakPolarHBondContact O-CB 3.48Å; E510-S514 PolarHBondContact O-N 2.93Å; E510-S514 PolarHBondContact O-OG 3.15Å; E510-P572 VanDerWaalsContact OE1-CD 3.23Å; E510-P572 WeakPolarHBondContact OE1-CD 3.27Å; E510-P572 VanDerWaalsContact OE1-CG 3.31Å; E510-P572 WeakPolarHBondContact OE1-CG 3.49Å; E510-P572 WeakPolarHBondContact OE2-CD 3.24Å
511	I	95.4	Very high	94.9	Very high	1 Å²	1	48.9 Å²	48.9	1%	0.005	27%	0.265	C	S	.	.	H	α-helix	trans	-59.1	-50.4	169.8	-65.9	163.8	0	0	0	108.7	L502 I506 D507 A513 S514 F515 V523 W525 P536 L543	L502-I511 HydrophobicContact CD1-CD1 3.98Å; L502-I511 HydrophobicContact CD2-CG1 4.38Å; I506-I511 HydrophobicContact CD1-CG1 3.83Å; I506-I511 HydrophobicContact CG1-CG1 4.06Å; I506-I511 HydrophobicContact CG2-CD1 4.06Å; I506-I511 HydrophobicContact CG2-CG1 3.99Å; D507-I511 WeakPolarHBondContact O-CD1 3.46Å; D507-I511 WeakPolarHBondContact O-CG1 3.33Å; D507-I511 PolarHBondContact O-N 2.97Å; D507-I511 VanDerWaalsContact O-N 3.11Å; I511-A513 PolarHBondContact O-N 2.77Å; I511-S514 PolarHBondContact O-N 2.85Å; I511-F515 HydrophobicContact CG2-CD2 3.77Å; I511-F515 HydrophobicContact CG2-CE2 4.02Å; I511-F515 VanDerWaalsContact O-CD2 3.23Å; I511-F515 WeakPolarHBondContact O-CD2 3.29Å; I511-F515 PolarHBondContact O-N 3.46Å; I511-F515 VanDerWaalsContact O-N 3.11Å; I511-V523 HydrophobicContact CB-CG1 4.44Å; I511-V523 HydrophobicContact CB-CG2 4.22Å; I511-V523 HydrophobicContact CD1-CG1 4.13Å; I511-V523 HydrophobicContact CG2-CB 4.45Å; I511-V523 HydrophobicContact CG2-CG1 3.88Å; I511-V523 HydrophobicContact CG2-CG2 3.64Å; I511-W525 HydrophobicContact CD1-CZ3 4.33Å; I511-P536 HydrophobicContact CD1-CG 4.32Å; I511-L543 HydrophobicContact CG2-CD2 3.73Å
512	T	95.9	Very high	94.9	Very high	21 Å²	21	51.8 Å²	51.8	13%	0.129	27%	0.266	C	S	.	.	H	α-helix	trans	-59.1	-48.1	-178.9	-61.4	0	0	0	0	110.9	E508 D509 E510 S514 F515 R516 V523	E508-T512 WeakPolarHBondContact O-CB 3.41Å; E508-T512 PolarHBondContact O-N 2.93Å; E508-T512 PolarHBondContact O-OG1 3.05Å; D509-T512 PolarHBondContact O-N 2.61Å; E510-T512 VanDerWaalsContact C-N 3.34Å; T512-S514 VanDerWaalsContact C-N 3.31Å; T512-S514 PolarHBondContact O-N 2.92Å; T512-F515 PolarHBondContact O-N 3Å; T512-R516 WeakPolarHBondContact O-CB 3.46Å; T512-R516 PolarHBondContact O-N 3.18Å; T512-V523 WeakPolarHBondContact OG1-CG2 3.29Å
513	A	95.1	Very high	94.8	Very high	71 Å²	71	51.8 Å²	51.8	59%	0.587	27%	0.266	S	S	*	.	H	α-helix	trans	-58.5	-40.9	177.4	0	0	0	0	0	112.5	D509 I511 F515	D509-A513 VanDerWaalsContact O-CB 3.26Å; D509-A513 WeakPolarHBondContact O-CB 3.44Å; D509-A513 PolarHBondContact O-N 2.91Å; I511-A513 PolarHBondContact O-N 2.77Å; A513-F515 PolarHBondContact O-N 3.11Å
514	S	95.4	Very high	94.7	Very high	33 Å²	33	54.6 Å²	54.6	23%	0.231	28%	0.281	C	S	.	.	H	α-helix	trans	-65.3	-36.8	179.8	-60	0	0	0	0	113.3	E510 I511 T512	E510-S514 WeakPolarHBondContact O-CB 3.48Å; E510-S514 PolarHBondContact O-N 2.93Å; E510-S514 PolarHBondContact O-OG 3.15Å; I511-S514 PolarHBondContact O-N 2.85Å; T512-S514 VanDerWaalsContact C-N 3.31Å; T512-S514 PolarHBondContact O-N 2.92Å
515	F	96.9	Very high	94.7	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-100.2	-18.4	-176.4	-67.6	-73.4	0	0	0	114.6	V499 I511 T512 A513 R517 F518 L521 L543 F545 L554 L567 V569 V579 I581	V499-F515 HydrophobicContact CG1-CZ 4.21Å; V499-F515 HydrophobicContact CG2-CZ 4.18Å; I511-F515 HydrophobicContact CG2-CD2 3.77Å; I511-F515 HydrophobicContact CG2-CE2 4.02Å; I511-F515 VanDerWaalsContact O-CD2 3.23Å; I511-F515 WeakPolarHBondContact O-CD2 3.29Å; I511-F515 PolarHBondContact O-N 3.46Å; I511-F515 VanDerWaalsContact O-N 3.11Å; T512-F515 PolarHBondContact O-N 3Å; A513-F515 PolarHBondContact O-N 3.11Å; F515-R517 PolarHBondContact O-N 3.28Å; F515-F518 HydrophobicContact CD1-CD2 4.26Å; F515-F518 HydrophobicContact CD1-CE2 4.14Å; F515-F518 VanDerWaalsContact O-CD2 3.29Å; F515-F518 WeakPolarHBondContact O-CD2 3.29Å; F515-F518 PolarHBondContact O-N 2.78Å; F515-L521 HydrophobicContact CB-CD1 3.82Å; F515-L521 HydrophobicContact CB-CD2 4Å; F515-L543 HydrophobicContact CB-CD1 4Å; F515-L543 HydrophobicContact CD1-CD1 3.5Å; F515-L543 VanDerWaalsContact CD1-CD1 3.5Å; F515-L543 HydrophobicContact CD2-CD1 3.69Å; F515-L543 HydrophobicContact CD2-CD2 3.84Å; F515-L543 HydrophobicContact CD2-CG 4.42Å; F515-L543 HydrophobicContact CE1-CD1 3.81Å; F515-L543 HydrophobicContact CE2-CD1 4.03Å; F515-L543 HydrophobicContact CE2-CD2 4.24Å; F515-L543 HydrophobicContact CG-CD1 3.44Å; F515-L543 VanDerWaalsContact CG-CD1 3.44Å; F515-L543 HydrophobicContact CG-CD2 4.31Å; F515-L543 HydrophobicContact CZ-CD1 4.09Å; F515-F545 HydrophobicContact CB-CZ 4.45Å; F515-L554 HydrophobicContact CD1-CD1 3.87Å; F515-L554 HydrophobicContact CD1-CD2 4.44Å; F515-L554 HydrophobicContact CE1-CD1 3.84Å; F515-L567 HydrophobicContact CD1-CD2 3.97Å; F515-L567 HydrophobicContact CE1-CD2 3.41Å; F515-L567 VanDerWaalsContact CE1-CD2 3.41Å; F515-L567 HydrophobicContact CZ-CD2 4.14Å; F515-V569 HydrophobicContact CE2-CG2 4.2Å; F515-V569 HydrophobicContact CZ-CG2 3.94Å; F515-V579 HydrophobicContact CZ-CG2 4.33Å; F515-I581 HydrophobicContact CE1-CD1 3.72Å; F515-I581 HydrophobicContact CZ-CD1 3.78Å
516	R	96.3	Very high	94.4	Very high	133 Å²	133	51 Å²	51	50%	0.502	26%	0.259	S	S	.	.	G	3₁₀ helix	trans	-61.4	-19	-178.2	-175	176	-168.9	92.8	2.4	114	T512 F518 G519 L521	T512-R516 WeakPolarHBondContact O-CB 3.46Å; T512-R516 PolarHBondContact O-N 3.18Å; R516-F518 PolarHBondContact O-N 2.79Å; R516-G519 WeakPolarHBondContact CA-O 3.21Å; R516-G519 PolarHBondContact O-N 3.28Å; R516-L521 HydrophobicContact CB-CD2 4.13Å
517	R	95.8	Very high	93.8	Very high	168 Å²	168	57.1 Å²	57.1	63%	0.634	29%	0.287	S	S	*	.	G	3₁₀ helix	trans	-61.5	-20.5	172.2	67.8	-178	-178.6	176.7	-0.5	114.2	F515	F515-R517 PolarHBondContact O-N 3.28Å
518	F	96.9	Very high	93.2	Very high	26 Å²	26	57.1 Å²	57.1	11%	0.114	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-93.7	-15.3	178.3	-53.4	-61.9	0	0	0	113.3	F515 R516 F545 S550 A553 L554 A557 L567	F515-F518 HydrophobicContact CD1-CD2 4.26Å; F515-F518 HydrophobicContact CD1-CE2 4.14Å; F515-F518 VanDerWaalsContact O-CD2 3.29Å; F515-F518 WeakPolarHBondContact O-CD2 3.29Å; F515-F518 PolarHBondContact O-N 2.78Å; R516-F518 PolarHBondContact O-N 2.79Å; F518-F545 HydrophobicContact CB-CE1 4.18Å; F518-S550 WeakPolarHBondContact O-CA 3.39Å; F518-S550 WeakPolarHBondContact O-CB 3.45Å; F518-S550 PolarHBondContact O-OG 3.2Å; F518-A553 HydrophobicContact CD1-CB 4.38Å; F518-A553 WeakPolarHBondContact CD1-O 3.47Å; F518-A553 VanDerWaalsContact CE1-O 3.29Å; F518-A553 WeakPolarHBondContact CE1-O 3.37Å; F518-L554 HydrophobicContact CB-CB 4.37Å; F518-L554 HydrophobicContact CD1-CB 4.46Å; F518-L554 HydrophobicContact CD2-CB 3.98Å; F518-L554 HydrophobicContact CD2-CD1 3.83Å; F518-L554 HydrophobicContact CD2-CG 4.45Å; F518-L554 HydrophobicContact CE2-CB 4.36Å; F518-L554 HydrophobicContact CE2-CD1 3.49Å; F518-L554 VanDerWaalsContact CE2-CD1 3.49Å; F518-L554 HydrophobicContact CG-CB 4.02Å; F518-L554 HydrophobicContact CZ-CD1 4.05Å; F518-A557 HydrophobicContact CE1-CB 3.43Å; F518-A557 VanDerWaalsContact CE1-CB 3.43Å; F518-A557 HydrophobicContact CZ-CB 3.74Å; F518-L567 HydrophobicContact CE2-CD2 3.9Å; F518-L567 HydrophobicContact CZ-CD1 4.4Å; F518-L567 HydrophobicContact CZ-CD2 4.24Å
519	G	95.7	Very high	92.3	Very high	23 Å²	23	58.9 Å²	58.9	24%	0.237	31%	0.311	C	S	.	.	S	Bend	trans	149.7	-171.9	179	0	0	0	0	0	113.1	R516 S550	R516-G519 WeakPolarHBondContact CA-O 3.21Å; R516-G519 PolarHBondContact O-N 3.28Å; G519-S550 WeakPolarHBondContact CA-OG 3.38Å
520	H	96.3	Very high	91.3	Very high	77 Å²	77	60.1 Å²	60.1	36%	0.356	31%	0.313	S	S	.	.			trans	-75.3	132.1	176	-162.5	-79.6	0	0	0	110.6	F522 F545 Q546	H520-F522 AromaticContact CE1-CE2 3.94Å; H520-F522 AromaticContact CE1-CZ 3.69Å; H520-F545 WeakPolarHBondContact O-CA 3.33Å; H520-Q546 HydrophobicContact CB-CB 4.06Å; H520-Q546 PolarHBondContact O-N 3.34Å
521	L	96.6	Very high	90	Very high	4 Å²	4	60.6 Å²	60.6	2%	0.021	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.8	165.2	176.2	72.8	147.5	0	0	0	112.4	F515 R516 V523 L543 L544 F545	F515-L521 HydrophobicContact CB-CD1 3.82Å; F515-L521 HydrophobicContact CB-CD2 4Å; R516-L521 HydrophobicContact CB-CD2 4.13Å; L521-V523 HydrophobicContact CD1-CG2 4.13Å; L521-L543 HydrophobicContact CD1-CB 3.95Å; L521-L543 HydrophobicContact CD1-CD1 4.33Å; L521-L543 HydrophobicContact CD1-CD2 3.7Å; L521-L543 HydrophobicContact CD1-CG 4.18Å; L521-L544 CarbonylContact C-O 3.58Å; L521-L544 VanDerWaalsContact CA-O 3.23Å; L521-L544 WeakPolarHBondContact CA-O 3.23Å; L521-F545 HydrophobicContact CB-CD1 3.8Å; L521-F545 HydrophobicContact CB-CE1 3.96Å; L521-F545 HydrophobicContact CB-CG 4.22Å; L521-F545 HydrophobicContact CD2-CE1 4.14Å; L521-F545 HydrophobicContact CG-CE1 4.46Å
522	F	95.1	Very high	88.7	Confident	104 Å²	104	69.2 Å²	69.2	46%	0.456	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	149.4	163.5	-59.9	-85.2	0	0	0	109.7	H520 L544	H520-F522 AromaticContact CE1-CE2 3.94Å; H520-F522 AromaticContact CE1-CZ 3.69Å; F522-L544 PolarHBondContact N-O 3.22Å; F522-L544 PolarHBondContact O-N 3.26Å
523	V	94.9	Very high	87.6	Confident	4 Å²	4	70.4 Å²	70.4	2%	0.024	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	129	178.7	-171.4	0	0	0	0	110.2	E508 I511 T512 L521 W525 K528 A541 L543	E508-V523 HydrophobicContact CG-CB 4.27Å; I511-V523 HydrophobicContact CB-CG1 4.44Å; I511-V523 HydrophobicContact CB-CG2 4.22Å; I511-V523 HydrophobicContact CD1-CG1 4.13Å; I511-V523 HydrophobicContact CG2-CB 4.45Å; I511-V523 HydrophobicContact CG2-CG1 3.88Å; I511-V523 HydrophobicContact CG2-CG2 3.64Å; T512-V523 WeakPolarHBondContact OG1-CG2 3.29Å; L521-V523 HydrophobicContact CD1-CG2 4.13Å; V523-W525 HydrophobicContact CG1-CE3 3.9Å; V523-W525 HydrophobicContact CG1-CZ3 3.69Å; V523-K528 PolarHBondContact O-NZ 3.11Å; V523-A541 HydrophobicContact CG1-CB 4.05Å; V523-L543 HydrophobicContact CG2-CD2 4.25Å
524	D	92.6	Very high	86.8	Confident	59 Å²	59	75.7 Å²	75.7	32%	0.316	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	143.8	-176.5	168.7	46.7	0	0	0	110.9	K496 F542 L544	K496-D524 IonicContact NZ-OD2 3.11Å; K496-D524 PolarHBondContact NZ-OD2 3.13Å; D524-F542 HydrophobicContact CB-CB 4.45Å; D524-F542 PolarHBondContact N-O 2.89Å; D524-F542 PolarHBondContact O-N 3.47Å; D524-L544 HydrophobicContact CB-CD1 3.66Å
525	W	91.7	Very high	86.4	Confident	3 Å²	3	78.9 Å²	78.9	1%	0.011	38%	0.384	C	S	.	.			trans	-148.7	154	166.9	55.1	82.2	0	0	0	110.6	E508 I511 V523 H527 K528 S533 Y534 P536 A541	E508-W525 HydrophobicContact CB-CH2 3.97Å; E508-W525 HydrophobicContact CB-CZ3 4.31Å; I511-W525 HydrophobicContact CD1-CZ3 4.33Å; V523-W525 HydrophobicContact CG1-CE3 3.9Å; V523-W525 HydrophobicContact CG1-CZ3 3.69Å; W525-H527 PolarHBondContact O-N 3.49Å; W525-K528 HydrophobicContact CD2-CB 4.26Å; W525-K528 HydrophobicContact CD2-CD 3.92Å; W525-K528 HydrophobicContact CD2-CG 4.14Å; W525-K528 HydrophobicContact CE3-CD 4.13Å; W525-K528 HydrophobicContact CG-CB 4.09Å; W525-K528 HydrophobicContact CG-CD 4.48Å; W525-K528 HydrophobicContact CG-CG 4.49Å; W525-K528 HydrophobicContact CH2-CD 4.26Å; W525-K528 HydrophobicContact CZ2-CD 4.02Å; W525-K528 HydrophobicContact CZ2-CG 3.91Å; W525-K528 HydrophobicContact CZ3-CD 4.3Å; W525-K528 VanDerWaalsContact O-CB 3.25Å; W525-K528 WeakPolarHBondContact O-CB 3.39Å; W525-K528 PolarHBondContact O-N 3.35Å; W525-S533 WeakPolarHBondContact CZ2-O 3.24Å; W525-Y534 VanDerWaalsContact CH2-O 3.29Å; W525-Y534 WeakPolarHBondContact CH2-O 3.37Å; W525-Y534 WeakPolarHBondContact CZ2-O 3.37Å; W525-P536 HydrophobicContact CD2-CB 4.17Å; W525-P536 HydrophobicContact CE3-CB 4.15Å; W525-A541 HydrophobicContact CE3-CB 4.19Å
526	P	85.5	Confident	85.9	Confident	50 Å²	50	79.2 Å²	79.2	33%	0.325	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.1	131.9	-178.1	-29.2	38.7	0	0	0	112.4	K528 Y540 F542	P526-K528 VanDerWaalsContact C-N 3.27Å; P526-K528 PolarHBondContact O-N 3.22Å; P526-Y540 HydrophobicContact CG-CE2 4.25Å; P526-Y540 WeakPolarHBondContact CG-OH 3.2Å; P526-F542 HydrophobicContact CG-CE2 4.48Å
527	H	80	Confident	85.2	Confident	127 Å²	127	75.4 Å²	75.4	59%	0.588	38%	0.379	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.7	17	-178.2	-48.7	-75.8	0	0	0	116	W525 A529 E530 S531	W525-H527 PolarHBondContact O-N 3.49Å; H527-A529 PolarHBondContact O-N 2.83Å; H527-E530 HydrophobicContact CB-CB 4.5Å; H527-E530 IonicContact CE1-OE2 3.25Å; H527-E530 IonicContact CG-OE2 3.82Å; H527-E530 IonicContact ND1-OE2 2.84Å; H527-E530 PolarHBondContact ND1-OE2 2.9Å; H527-E530 PolarHBondContact O-N 3.18Å; H527-E530 VanDerWaalsContact O-N 3.15Å; H527-S531 VanDerWaalsContact O-CB 3.24Å; H527-S531 WeakPolarHBondContact O-CB 3.36Å; H527-S531 PolarHBondContact O-N 3.01Å; H527-S531 PolarHBondContact O-OG 3.11Å
528	K	80.6	Confident	84.8	Confident	52 Å²	52	77 Å²	77	23%	0.226	39%	0.39	C	S	.	.	H	α-helix	trans	-49.7	-54.9	176.9	-176.4	176.7	179.1	-141.5	0	113.3	E508 V523 W525 P526 E530	E508-K528 IonicContact OE1-NZ 3.61Å; E508-K528 PolarHBondContact OE1-NZ 3.36Å; E508-K528 WeakPolarHBondContact OE2-CE 3.25Å; E508-K528 IonicContact OE2-NZ 2.72Å; E508-K528 PolarHBondContact OE2-NZ 3.02Å; V523-K528 PolarHBondContact O-NZ 3.11Å; W525-K528 HydrophobicContact CD2-CB 4.26Å; W525-K528 HydrophobicContact CD2-CD 3.92Å; W525-K528 HydrophobicContact CD2-CG 4.14Å; W525-K528 HydrophobicContact CE3-CD 4.13Å; W525-K528 HydrophobicContact CG-CB 4.09Å; W525-K528 HydrophobicContact CG-CD 4.48Å; W525-K528 HydrophobicContact CG-CG 4.49Å; W525-K528 HydrophobicContact CH2-CD 4.26Å; W525-K528 HydrophobicContact CZ2-CD 4.02Å; W525-K528 HydrophobicContact CZ2-CG 3.91Å; W525-K528 HydrophobicContact CZ3-CD 4.3Å; W525-K528 VanDerWaalsContact O-CB 3.25Å; W525-K528 WeakPolarHBondContact O-CB 3.39Å; W525-K528 PolarHBondContact O-N 3.35Å; P526-K528 VanDerWaalsContact C-N 3.27Å; P526-K528 PolarHBondContact O-N 3.22Å; K528-E530 VanDerWaalsContact C-N 3.29Å; K528-E530 PolarHBondContact O-N 2.95Å
529	A	74.3	Confident	84.5	Confident	103 Å²	103	76.2 Å²	76.2	85%	0.851	39%	0.389	S	S	*	.	H	α-helix	trans	-68.5	-22.7	-179.2	0	0	0	0	0	114.5	H527	H527-A529 PolarHBondContact O-N 2.83Å
530	E	73.1	Confident	84.5	Confident	152 Å²	152	78 Å²	78	71%	0.71	39%	0.39	S	S	*	.	H	α-helix	trans	-93.8	-38.5	-174.9	-62	174.4	153.9	0	0	112.2	H527 K528	H527-E530 HydrophobicContact CB-CB 4.5Å; H527-E530 IonicContact CE1-OE2 3.25Å; H527-E530 IonicContact CG-OE2 3.82Å; H527-E530 IonicContact ND1-OE2 2.84Å; H527-E530 PolarHBondContact ND1-OE2 2.9Å; H527-E530 PolarHBondContact O-N 3.18Å; H527-E530 VanDerWaalsContact O-N 3.15Å; K528-E530 VanDerWaalsContact C-N 3.29Å; K528-E530 PolarHBondContact O-N 2.95Å
531	S	66.6	Low	84.5	Confident	62 Å²	62	74.4 Å²	74.4	43%	0.434	37%	0.373	S	S	.	.	H	α-helix	trans	-81.8	-18.4	-170.7	61.5	0	0	0	0	114.8	H527 S533	H527-S531 VanDerWaalsContact O-CB 3.24Å; H527-S531 WeakPolarHBondContact O-CB 3.36Å; H527-S531 PolarHBondContact O-N 3.01Å; H527-S531 PolarHBondContact O-OG 3.11Å; S531-S533 PolarHBondContact O-N 2.75Å; S531-S533 VanDerWaalsContact O-N 3.14Å; S531-S533 WeakPolarHBondContact OG-CB 3.39Å; S531-S533 PolarHBondContact OG-N 2.87Å
532	K	66.7	Low	84.4	Confident	182 Å²	182	75.2 Å²	75.2	79%	0.791	38%	0.376	S	S	*	.			trans	54.7	18.2	-165.9	-54.4	-177.8	179.9	-179.6	0	114	Y534	K532-Y534 PolarHBondContact O-N 2.95Å
533	S	72.4	Confident	84.5	Confident	45 Å²	45	70.3 Å²	70.3	32%	0.315	35%	0.354	S	S	.	.			trans	-78.3	113	175	-173	0	0	0	0	109.5	W525 S531 F535	W525-S533 WeakPolarHBondContact CZ2-O 3.24Å; S531-S533 PolarHBondContact O-N 2.75Å; S531-S533 VanDerWaalsContact O-N 3.14Å; S531-S533 WeakPolarHBondContact OG-CB 3.39Å; S531-S533 PolarHBondContact OG-N 2.87Å; S533-F535 PolarHBondContact O-N 3.37Å; S533-F535 PolarHBondContact OG-N 2.88Å; S533-F535 PolarHBondContact OG-O 2.93Å
534	Y	80.3	Confident	84.6	Confident	183 Å²	183	72 Å²	72	72%	0.718	36%	0.363	S	S	*	.	S	Bend	trans	-67.5	-21.1	170	-66.6	-85.2	0	0	0	112.7	W525 K532	W525-Y534 VanDerWaalsContact CH2-O 3.29Å; W525-Y534 WeakPolarHBondContact CH2-O 3.37Å; W525-Y534 WeakPolarHBondContact CZ2-O 3.37Å; K532-Y534 PolarHBondContact O-N 2.95Å
535	F	86.1	Confident	84.8	Confident	99 Å²	99	69.3 Å²	69.3	43%	0.434	35%	0.349	S	S	.	.	S	Bend	trans	-99.8	142	-178.3	-54.3	-73.9	0	0	0	111.6	D505 I506 D507 S533	D505-F535 WeakPolarHBondContact O-CE1 3.34Å; I506-F535 WeakPolarHBondContact O-CD1 3.42Å; D507-F535 HydrophobicContact CB-CE1 4.39Å; S533-F535 PolarHBondContact O-N 3.37Å; S533-F535 PolarHBondContact OG-N 2.88Å; S533-F535 PolarHBondContact OG-O 2.93Å
536	P	85.9	Confident	85	Confident	8 Å²	8	73.6 Å²	73.6	5%	0.052	37%	0.369	C	S	.	.	P	Polyproline II helix	trans	-71.3	117.5	-180	26.9	-33.1	0	0	0	111.7	L502 I506 I511 W525 K538 G539 Y540 A541	L502-P536 HydrophobicContact CD1-CB 4.13Å; L502-P536 HydrophobicContact CD1-CG 3.79Å; I506-P536 HydrophobicContact CG2-CG 4.18Å; I506-P536 WeakPolarHBondContact O-CD 3.26Å; I511-P536 HydrophobicContact CD1-CG 4.32Å; W525-P536 HydrophobicContact CD2-CB 4.17Å; W525-P536 HydrophobicContact CE3-CB 4.15Å; P536-K538 PolarHBondContact O-N 3.5Å; P536-G539 PolarHBondContact O-N 3.32Å; P536-Y540 WeakPolarHBondContact CB-O 3.4Å; P536-A541 HydrophobicContact CB-CB 4.48Å
537	P	83	Confident	85.5	Confident	52 Å²	52	75 Å²	75	34%	0.338	37%	0.374	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66	127	-173.3	26.7	-34	0	0	0	111.3	G539 Y540	P537-G539 VanDerWaalsContact C-N 3.26Å; P537-G539 PolarHBondContact O-N 3.42Å; P537-Y540 VanDerWaalsContact O-CD1 3.29Å; P537-Y540 WeakPolarHBondContact O-CD1 3.38Å; P537-Y540 WeakPolarHBondContact O-CE1 3.47Å
538	K	86.4	Confident	86.1	Confident	203 Å²	203	72.5 Å²	72.5	88%	0.883	36%	0.362	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.3	18	-173.9	-43.3	178	-177.3	-178.9	0	114.8	P536 Y540	P536-K538 PolarHBondContact O-N 3.5Å; K538-Y540 HydrophobicContact CB-CD1 4.14Å; K538-Y540 HydrophobicContact CB-CE1 4.15Å
539	G	91.7	Very high	86.8	Confident	9 Å²	9	74 Å²	74	9%	0.093	38%	0.38	C	S	.	.	S	Bend	trans	69	39.1	171.7	0	0	0	0	0	114.3	G501 L502 P536 P537	G501-G539 PolarHBondContact N-O 3.35Å; L502-G539 PolarHBondContact N-O 2.83Å; P536-G539 PolarHBondContact O-N 3.32Å; P537-G539 VanDerWaalsContact C-N 3.26Å; P537-G539 PolarHBondContact O-N 3.42Å
540	Y	94.6	Very high	87.9	Confident	61 Å²	61	69.5 Å²	69.5	24%	0.239	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.3	150	170	75.8	-82.1	0	0	0	111.5	F498 V499 P526 P536 P537 K538 F542	F498-Y540 HydrophobicContact CD2-CD2 4.33Å; F498-Y540 AromaticContact CE2-CD2 3.64Å; F498-Y540 HydrophobicContact CE2-CD2 3.64Å; F498-Y540 HydrophobicContact CE2-CG 4Å; F498-Y540 HydrophobicContact CZ-CD2 4.48Å; F498-Y540 HydrophobicContact CZ-CG 4.41Å; V499-Y540 CarbonylContact O-C 3.59Å; V499-Y540 WeakPolarHBondContact O-CA 3.34Å; V499-Y540 WeakPolarHBondContact O-CB 3.39Å; P526-Y540 HydrophobicContact CG-CE2 4.25Å; P526-Y540 WeakPolarHBondContact CG-OH 3.2Å; P536-Y540 WeakPolarHBondContact CB-O 3.4Å; P537-Y540 VanDerWaalsContact O-CD1 3.29Å; P537-Y540 WeakPolarHBondContact O-CD1 3.38Å; P537-Y540 WeakPolarHBondContact O-CE1 3.47Å; K538-Y540 HydrophobicContact CB-CD1 4.14Å; K538-Y540 HydrophobicContact CB-CE1 4.15Å; Y540-F542 HydrophobicContact CE2-CE2 4.27Å
541	A	95.7	Very high	89	Confident	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	175.9	177.5	0	0	0	0	0	110.7	V499 L502 V523 W525 P536	V499-A541 PolarHBondContact N-O 3.41Å; V499-A541 PolarHBondContact O-N 3.08Å; L502-A541 HydrophobicContact CD1-CB 3.76Å; V523-A541 HydrophobicContact CG1-CB 4.05Å; W525-A541 HydrophobicContact CE3-CB 4.19Å; P536-A541 HydrophobicContact CB-CB 4.48Å
542	F	95.8	Very high	90.4	Very high	22 Å²	22	61.7 Å²	61.7	10%	0.096	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	132.2	168.1	-60.4	-81.6	0	0	0	109.5	K496 V497 F498 D524 P526 Y540 L544 Y643	K496-F542 HydrophobicContact CD-CB 4.5Å; K496-F542 HydrophobicContact CD-CD1 4.4Å; K496-F542 VanDerWaalsContact CE-CG 3.43Å; K496-F542 HydrophobicContact CG-CB 4.17Å; K496-F542 HydrophobicContact CG-CD1 4.27Å; V497-F542 CarbonylContact O-C 3.56Å; V497-F542 VanDerWaalsContact O-CA 3.24Å; V497-F542 WeakPolarHBondContact O-CA 3.47Å; F498-F542 HydrophobicContact CB-CD1 4.11Å; F498-F542 HydrophobicContact CB-CE1 4.03Å; F498-F542 HydrophobicContact CD2-CD1 4.34Å; F498-F542 AromaticContact CD2-CE1 3.77Å; F498-F542 HydrophobicContact CD2-CE1 3.77Å; F498-F542 HydrophobicContact CD2-CZ 4.15Å; F498-F542 HydrophobicContact CG-CE1 4.4Å; D524-F542 HydrophobicContact CB-CB 4.45Å; D524-F542 PolarHBondContact N-O 2.89Å; D524-F542 PolarHBondContact O-N 3.47Å; P526-F542 HydrophobicContact CG-CE2 4.48Å; Y540-F542 HydrophobicContact CE2-CE2 4.27Å; F542-L544 HydrophobicContact CB-CD1 4.11Å; F542-Y643 HydrophobicContact CE1-CE1 4.29Å
543	L	96.8	Very high	91.8	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	130.9	167.9	-46.6	179.4	0	0	0	107.7	K496 V497 V499 I511 F515 L521 V523 F545 L554	K496-L543 CarbonylContact C-O 3.54Å; K496-L543 VanDerWaalsContact CA-O 3.3Å; K496-L543 WeakPolarHBondContact CA-O 3.39Å; V497-L543 HydrophobicContact CB-CB 4.42Å; V497-L543 PolarHBondContact N-O 3.22Å; V497-L543 PolarHBondContact O-N 3.45Å; V499-L543 HydrophobicContact CG2-CD1 3.73Å; V499-L543 HydrophobicContact CG2-CD2 4.29Å; V499-L543 HydrophobicContact CG2-CG 3.72Å; I511-L543 HydrophobicContact CG2-CD2 3.73Å; F515-L543 HydrophobicContact CB-CD1 4Å; F515-L543 HydrophobicContact CD1-CD1 3.5Å; F515-L543 VanDerWaalsContact CD1-CD1 3.5Å; F515-L543 HydrophobicContact CD2-CD1 3.69Å; F515-L543 HydrophobicContact CD2-CD2 3.84Å; F515-L543 HydrophobicContact CD2-CG 4.42Å; F515-L543 HydrophobicContact CE1-CD1 3.81Å; F515-L543 HydrophobicContact CE2-CD1 4.03Å; F515-L543 HydrophobicContact CE2-CD2 4.24Å; F515-L543 HydrophobicContact CG-CD1 3.44Å; F515-L543 VanDerWaalsContact CG-CD1 3.44Å; F515-L543 HydrophobicContact CG-CD2 4.31Å; F515-L543 HydrophobicContact CZ-CD1 4.09Å; L521-L543 HydrophobicContact CD1-CB 3.95Å; L521-L543 HydrophobicContact CD1-CD1 4.33Å; L521-L543 HydrophobicContact CD1-CD2 3.7Å; L521-L543 HydrophobicContact CD1-CG 4.18Å; V523-L543 HydrophobicContact CG2-CD2 4.25Å; L543-F545 HydrophobicContact CB-CD2 4.19Å; L543-F545 HydrophobicContact CB-CE2 3.74Å; L543-F545 HydrophobicContact CB-CZ 4.42Å; L543-F545 HydrophobicContact CD1-CE2 3.82Å; L543-F545 HydrophobicContact CD1-CZ 3.99Å; L543-F545 HydrophobicContact CG-CE2 4.46Å; L543-L554 HydrophobicContact CD1-CD2 4.22Å
544	L	96.6	Very high	93	Very high	39 Å²	39	52.8 Å²	52.8	20%	0.204	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	97.4	171.8	-72.8	72	0	0	0	107.6	R495 K496 L521 F522 D524 F542 L641	R495-L544 WeakPolarHBondContact O-CA 3.36Å; K496-L544 HydrophobicContact CD-CD1 4.47Å; K496-L544 HydrophobicContact CG-CD1 4.17Å; K496-L544 HydrophobicContact CG-CG 4.24Å; L521-L544 CarbonylContact C-O 3.58Å; L521-L544 VanDerWaalsContact CA-O 3.23Å; L521-L544 WeakPolarHBondContact CA-O 3.23Å; F522-L544 PolarHBondContact N-O 3.22Å; F522-L544 PolarHBondContact O-N 3.26Å; D524-L544 HydrophobicContact CB-CD1 3.66Å; F542-L544 HydrophobicContact CB-CD1 4.11Å; L544-L641 HydrophobicContact CD2-CD1 3.83Å; L544-L641 HydrophobicContact CG-CD1 4.34Å
545	F	97	Very high	93.8	Very high	4 Å²	4	45.2 Å²	45.2	2%	0.018	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	149.6	175.8	-72.6	-84.7	0	0	0	111.2	R495 V497 F515 F518 H520 L521 L543 D547 S550 V551 L554	R495-F545 PolarHBondContact O-N 3.24Å; V497-F545 HydrophobicContact CG2-CD2 4.22Å; V497-F545 HydrophobicContact CG2-CE2 4.21Å; F515-F545 HydrophobicContact CB-CZ 4.45Å; F518-F545 HydrophobicContact CB-CE1 4.18Å; H520-F545 WeakPolarHBondContact O-CA 3.33Å; L521-F545 HydrophobicContact CB-CD1 3.8Å; L521-F545 HydrophobicContact CB-CE1 3.96Å; L521-F545 HydrophobicContact CB-CG 4.22Å; L521-F545 HydrophobicContact CD2-CE1 4.14Å; L521-F545 HydrophobicContact CG-CE1 4.46Å; L543-F545 HydrophobicContact CB-CD2 4.19Å; L543-F545 HydrophobicContact CB-CE2 3.74Å; L543-F545 HydrophobicContact CB-CZ 4.42Å; L543-F545 HydrophobicContact CD1-CE2 3.82Å; L543-F545 HydrophobicContact CD1-CZ 3.99Å; L543-F545 HydrophobicContact CG-CE2 4.46Å; F545-D547 VanDerWaalsContact C-N 3.34Å; F545-S550 VanDerWaalsContact CD1-CB 3.44Å; F545-V551 HydrophobicContact CB-CG2 4.11Å; F545-V551 HydrophobicContact CD2-CG2 3.73Å; F545-V551 HydrophobicContact CE2-CG2 4.49Å; F545-V551 HydrophobicContact CG-CG2 4.12Å; F545-L554 HydrophobicContact CE2-CD2 3.78Å; F545-L554 HydrophobicContact CZ-CD2 3.94Å
546	Q	96.3	Very high	94.2	Very high	93 Å²	93	45.9 Å²	45.9	44%	0.435	24%	0.241	S	C	.	.	S	Bend	trans	-66	-41.9	173.2	-178.2	54	63.7	0	0	110.9	R495 H520	R495-Q546 WeakPolarHBondContact CD-O 3.43Å; R495-Q546 PolarHBondContact NH1-O 3.49Å; H520-Q546 HydrophobicContact CB-CB 4.06Å; H520-Q546 PolarHBondContact O-N 3.34Å
547	D	95.1	Very high	94.7	Very high	79 Å²	79	47.8 Å²	47.8	42%	0.422	26%	0.257	S	S	.	.	S	Bend	trans	-124.4	150.3	-169.1	-53.7	-62.6	0	0	0	111.9	F545 S550	F545-D547 VanDerWaalsContact C-N 3.34Å; D547-S550 PolarHBondContact O-N 3.33Å
548	E	94.1	Very high	95.3	Very high	75 Å²	75	46.3 Å²	46.3	35%	0.35	25%	0.248	S	C	.	.	S	Bend	trans	-70.6	-35.6	179.8	177.6	167.9	-165.2	0	0	112.4	R492 Y493 S550 V551 Q552	R492-E548 WeakPolarHBondContact CA-OE1 3.48Å; R492-E548 WeakPolarHBondContact CB-OE1 3.43Å; R492-E548 WeakPolarHBondContact CG-OE1 3.49Å; Y493-E548 PolarHBondContact N-OE1 3.26Å; E548-S550 PolarHBondContact O-N 3.47Å; E548-V551 WeakPolarHBondContact O-CB 3.31Å; E548-V551 PolarHBondContact O-N 3.29Å; E548-Q552 PolarHBondContact O-N 2.98Å
549	S	95.3	Very high	95.8	Very high	84 Å²	84	41.8 Å²	41.8	59%	0.587	23%	0.232	S	C	*	.	H	α-helix	trans	-61.4	-28.5	176	49	0	0	0	0	113.5	V551 Q552 A553	S549-V551 VanDerWaalsContact C-N 3.28Å; S549-V551 PolarHBondContact O-N 2.88Å; S549-Q552 PolarHBondContact O-N 3.49Å; S549-A553 WeakPolarHBondContact O-CB 3.41Å; S549-A553 PolarHBondContact O-N 3.34Å
550	S	96.9	Very high	96	Very high	8 Å²	8	48.1 Å²	48.1	6%	0.056	26%	0.26	C	S	.	.	H	α-helix	trans	-68.7	-26.5	173.3	-63.2	0	0	0	0	113.3	F518 G519 F545 D547 E548 L554	F518-S550 WeakPolarHBondContact O-CA 3.39Å; F518-S550 WeakPolarHBondContact O-CB 3.45Å; F518-S550 PolarHBondContact O-OG 3.2Å; G519-S550 WeakPolarHBondContact CA-OG 3.38Å; F545-S550 VanDerWaalsContact CD1-CB 3.44Å; D547-S550 PolarHBondContact O-N 3.33Å; E548-S550 PolarHBondContact O-N 3.47Å; S550-L554 WeakPolarHBondContact O-CB 3.16Å; S550-L554 PolarHBondContact O-N 2.83Å
551	V	96.9	Very high	96	Very high	0 Å²	0	51 Å²	51	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-75.4	-40.3	173.2	-176.9	0	0	0	0	110.2	Y493 V497 F545 E548 S549 L554 I555 P583	Y493-V551 HydrophobicContact CG-CG1 4.29Å; V497-V551 HydrophobicContact CG2-CB 4.39Å; V497-V551 HydrophobicContact CG2-CG1 3.61Å; V497-V551 HydrophobicContact CG2-CG2 3.91Å; F545-V551 HydrophobicContact CB-CG2 4.11Å; F545-V551 HydrophobicContact CD2-CG2 3.73Å; F545-V551 HydrophobicContact CE2-CG2 4.49Å; F545-V551 HydrophobicContact CG-CG2 4.12Å; E548-V551 WeakPolarHBondContact O-CB 3.31Å; E548-V551 PolarHBondContact O-N 3.29Å; S549-V551 VanDerWaalsContact C-N 3.28Å; S549-V551 PolarHBondContact O-N 2.88Å; V551-L554 WeakPolarHBondContact O-CB 3.27Å; V551-L554 PolarHBondContact O-N 3.21Å; V551-I555 HydrophobicContact CG1-CD1 4.05Å; V551-I555 VanDerWaalsContact O-CG1 3.29Å; V551-I555 WeakPolarHBondContact O-CG1 3.44Å; V551-I555 PolarHBondContact O-N 3.03Å; V551-P583 HydrophobicContact CG1-CB 4.12Å
552	Q	95.8	Very high	95.8	Very high	49 Å²	49	57.5 Å²	57.5	23%	0.229	31%	0.31	C	S	.	.	H	α-helix	trans	-60.8	-50.1	173	-168.4	61.8	48.9	0	0	111.1	E548 S549 L554 I555 D556	E548-Q552 PolarHBondContact O-N 2.98Å; S549-Q552 PolarHBondContact O-N 3.49Å; Q552-L554 PolarHBondContact O-N 3.46Å; Q552-L554 VanDerWaalsContact O-N 3.15Å; Q552-I555 WeakPolarHBondContact O-CA 3.36Å; Q552-I555 WeakPolarHBondContact O-CB 3.14Å; Q552-I555 PolarHBondContact O-N 3.03Å; Q552-D556 PolarHBondContact NE2-OD1 2.78Å; Q552-D556 PolarHBondContact O-N 3.38Å
553	A	96.1	Very high	95.5	Very high	39 Å²	39	59.4 Å²	59.4	32%	0.322	34%	0.336	S	S	.	.	H	α-helix	trans	-61.8	-25.2	178.1	0	0	0	0	0	114	F518 S549 A557	F518-A553 HydrophobicContact CD1-CB 4.38Å; F518-A553 WeakPolarHBondContact CD1-O 3.47Å; F518-A553 VanDerWaalsContact CE1-O 3.29Å; F518-A553 WeakPolarHBondContact CE1-O 3.37Å; S549-A553 WeakPolarHBondContact O-CB 3.41Å; S549-A553 PolarHBondContact O-N 3.34Å; A553-A557 WeakPolarHBondContact O-CB 3.45Å
554	L	97.1	Very high	95.4	Very high	1 Å²	1	63 Å²	63	1%	0.005	35%	0.352	C	S	.	.	H	α-helix	trans	-71.9	-46	168.9	165.7	61.8	0	0	0	111.2	V497 F515 F518 L543 F545 S550 V551 Q552 A557 C558 L567 I581	V497-L554 HydrophobicContact CG1-CD2 4.2Å; F515-L554 HydrophobicContact CD1-CD1 3.87Å; F515-L554 HydrophobicContact CD1-CD2 4.44Å; F515-L554 HydrophobicContact CE1-CD1 3.84Å; F518-L554 HydrophobicContact CB-CB 4.37Å; F518-L554 HydrophobicContact CD1-CB 4.46Å; F518-L554 HydrophobicContact CD2-CB 3.98Å; F518-L554 HydrophobicContact CD2-CD1 3.83Å; F518-L554 HydrophobicContact CD2-CG 4.45Å; F518-L554 HydrophobicContact CE2-CB 4.36Å; F518-L554 HydrophobicContact CE2-CD1 3.49Å; F518-L554 VanDerWaalsContact CE2-CD1 3.49Å; F518-L554 HydrophobicContact CG-CB 4.02Å; F518-L554 HydrophobicContact CZ-CD1 4.05Å; L543-L554 HydrophobicContact CD1-CD2 4.22Å; F545-L554 HydrophobicContact CE2-CD2 3.78Å; F545-L554 HydrophobicContact CZ-CD2 3.94Å; S550-L554 WeakPolarHBondContact O-CB 3.16Å; S550-L554 PolarHBondContact O-N 2.83Å; V551-L554 WeakPolarHBondContact O-CB 3.27Å; V551-L554 PolarHBondContact O-N 3.21Å; Q552-L554 PolarHBondContact O-N 3.46Å; Q552-L554 VanDerWaalsContact O-N 3.15Å; L554-A557 PolarHBondContact O-N 3.06Å; L554-C558 PolarHBondContact O-N 2.78Å; L554-C558 PolarHBondContact O-SG 3.24Å; L554-L567 HydrophobicContact CD1-CD2 4.01Å; L554-I581 HydrophobicContact CD1-CG2 4.48Å; L554-I581 HydrophobicContact CD2-CG2 3.94Å; L554-I581 HydrophobicContact CG-CG2 4.19Å
555	I	96.1	Very high	95.4	Very high	24 Å²	24	62.5 Å²	62.5	12%	0.123	35%	0.349	C	S	.	.	H	α-helix	trans	-61.1	-48.5	178.3	-68.3	163.7	0	0	0	110.7	Y493 V551 Q552 A557 C558 L565 P583	Y493-I555 HydrophobicContact CD1-CD1 3.88Å; Y493-I555 HydrophobicContact CD2-CD1 3.59Å; Y493-I555 HydrophobicContact CE1-CD1 3.8Å; Y493-I555 HydrophobicContact CE2-CD1 3.52Å; Y493-I555 HydrophobicContact CG-CD1 3.78Å; V551-I555 HydrophobicContact CG1-CD1 4.05Å; V551-I555 VanDerWaalsContact O-CG1 3.29Å; V551-I555 WeakPolarHBondContact O-CG1 3.44Å; V551-I555 PolarHBondContact O-N 3.03Å; Q552-I555 WeakPolarHBondContact O-CA 3.36Å; Q552-I555 WeakPolarHBondContact O-CB 3.14Å; Q552-I555 PolarHBondContact O-N 3.03Å; I555-A557 PolarHBondContact O-N 2.94Å; I555-C558 WeakPolarHBondContact O-CB 3.42Å; I555-C558 PolarHBondContact O-N 2.98Å; I555-L565 HydrophobicContact CB-CD1 4.27Å; I555-L565 HydrophobicContact CG1-CD1 3.92Å; I555-L565 HydrophobicContact CG2-CD1 3.87Å; I555-P583 HydrophobicContact CD1-CB 3.87Å; I555-P583 HydrophobicContact CD1-CG 3.75Å; I555-P583 HydrophobicContact CG1-CB 4.34Å; I555-P583 HydrophobicContact CG1-CG 4.01Å
556	D	95.3	Very high	95.4	Very high	114 Å²	114	64.8 Å²	64.8	61%	0.61	36%	0.358	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-19.5	179.4	-56.4	-22.6	0	0	0	113.2	Q552	Q552-D556 PolarHBondContact NE2-OD1 2.78Å; Q552-D556 PolarHBondContact O-N 3.38Å
557	A	96.1	Very high	95.4	Very high	47 Å²	47	60.7 Å²	60.7	39%	0.388	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	-106.6	3.1	179.1	0	0	0	0	0	113.9	F518 A553 L554 I555 L567	F518-A557 HydrophobicContact CE1-CB 3.43Å; F518-A557 VanDerWaalsContact CE1-CB 3.43Å; F518-A557 HydrophobicContact CZ-CB 3.74Å; A553-A557 WeakPolarHBondContact O-CB 3.45Å; L554-A557 PolarHBondContact O-N 3.06Å; I555-A557 PolarHBondContact O-N 2.94Å; A557-L567 WeakPolarHBondContact O-CD1 3.4Å
558	C	96.8	Very high	95.5	Very high	22 Å²	22	59.9 Å²	59.9	15%	0.149	34%	0.339	C	S	.	.	S	Bend	trans	-82.2	155.8	172.5	-71.3	0	0	0	0	111.6	L554 I555 L565 Y566	L554-C558 PolarHBondContact O-N 2.78Å; L554-C558 PolarHBondContact O-SG 3.24Å; I555-C558 WeakPolarHBondContact O-CB 3.42Å; I555-C558 PolarHBondContact O-N 2.98Å; C558-L565 HydrophobicContact CB-CB 3.83Å; C558-L565 HydrophobicContact CB-CD2 4.04Å; C558-L565 HydrophobicContact CB-CG 4.36Å; C558-Y566 CarbonylContact C-O 3.45Å; C558-Y566 WeakPolarHBondContact CA-O 3.48Å; C558-Y566 WeakPolarHBondContact CB-O 3.26Å
559	I	96	Very high	95.6	Very high	108 Å²	108	56.4 Å²	56.4	55%	0.554	32%	0.323	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.1	125.9	166	-56.6	172.7	0	0	0	106.8	Y566	I559-Y566 PolarHBondContact N-O 2.8Å; I559-Y566 PolarHBondContact O-N 3.4Å
560	E	96.1	Very high	95.5	Very high	142 Å²	142	54.5 Å²	54.5	66%	0.664	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	126.5	172.8	-166.7	-176.5	162	0	0	110.7	G563 K564 L565	E560-G563 WeakPolarHBondContact OE1-CA 3.07Å; E560-K564 WeakPolarHBondContact CA-O 3.47Å; E560-L565 HydrophobicContact CB-CD2 4.14Å; E560-L565 HydrophobicContact CG-CD2 4.24Å
561	E	95.3	Very high	95.3	Very high	122 Å²	122	54.4 Å²	54.4	57%	0.57	31%	0.309	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-140.8	128.2	176.3	-173.9	173.8	-148.9	0	0	108.8	G563 K564 Y566	E561-G563 VanDerWaalsContact C-N 3.25Å; E561-G563 PolarHBondContact O-N 3.27Å; E561-K564 PolarHBondContact N-O 3.43Å; E561-K564 WeakPolarHBondContact O-CB 3.23Å; E561-K564 PolarHBondContact O-N 3.37Å; E561-Y566 HydrophobicContact CB-CD2 4.05Å; E561-Y566 HydrophobicContact CB-CE2 4.05Å
562	D	91.6	Very high	95.1	Very high	135 Å²	135	59 Å²	59	72%	0.722	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.1	37.2	-173.9	-67.1	-20.5	0	0	0	115.1	K564	D562-K564 HydrophobicContact CB-CD 4.3Å; D562-K564 PolarHBondContact O-N 2.95Å; D562-K564 IonicContact OD2-NZ 2.73Å; D562-K564 PolarHBondContact OD2-NZ 3.06Å
563	G	88.6	Confident	94.9	Very high	63 Å²	63	62 Å²	62	65%	0.649	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.2	22.8	-176.7	0	0	0	0	0	114	E560 E561	E560-G563 WeakPolarHBondContact OE1-CA 3.07Å; E561-G563 VanDerWaalsContact C-N 3.25Å; E561-G563 PolarHBondContact O-N 3.27Å
564	K	93.9	Very high	94.8	Very high	75 Å²	75	62.9 Å²	62.9	33%	0.326	36%	0.359	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	140.6	177	-53.5	150.2	-160.8	151.4	0	108.4	E560 E561 D562 Y566	E560-K564 WeakPolarHBondContact CA-O 3.47Å; E561-K564 PolarHBondContact N-O 3.43Å; E561-K564 WeakPolarHBondContact O-CB 3.23Å; E561-K564 PolarHBondContact O-N 3.37Å; D562-K564 HydrophobicContact CB-CD 4.3Å; D562-K564 PolarHBondContact O-N 2.95Å; D562-K564 IonicContact OD2-NZ 2.73Å; D562-K564 PolarHBondContact OD2-NZ 3.06Å; K564-Y566 HydrophobicContact CB-CD2 4.37Å; K564-Y566 HydrophobicContact CB-CE2 3.64Å; K564-Y566 HydrophobicContact CD-CE2 4.26Å; K564-Y566 WeakPolarHBondContact CD-OH 3.2Å
565	L	96.6	Very high	94.7	Very high	29 Å²	29	70.8 Å²	70.8	15%	0.152	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	137.7	176.2	-59.3	176.5	0	0	0	110.4	I555 C558 E560 Q580 I581 P583	I555-L565 HydrophobicContact CB-CD1 4.27Å; I555-L565 HydrophobicContact CG1-CD1 3.92Å; I555-L565 HydrophobicContact CG2-CD1 3.87Å; C558-L565 HydrophobicContact CB-CB 3.83Å; C558-L565 HydrophobicContact CB-CD2 4.04Å; C558-L565 HydrophobicContact CB-CG 4.36Å; E560-L565 HydrophobicContact CB-CD2 4.14Å; E560-L565 HydrophobicContact CG-CD2 4.24Å; L565-Q580 WeakPolarHBondContact O-CA 3.36Å; L565-I581 HydrophobicContact CB-CB 4.11Å; L565-I581 PolarHBondContact O-N 2.93Å; L565-P583 HydrophobicContact CD1-CG 4.11Å
566	Y	97.6	Very high	94.6	Very high	52 Å²	52	75 Å²	75	20%	0.204	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	145.1	177.2	-68.1	-85.4	0	0	0	111.2	C558 I559 E561 K564 P578 V579 Q580	C558-Y566 CarbonylContact C-O 3.45Å; C558-Y566 WeakPolarHBondContact CA-O 3.48Å; C558-Y566 WeakPolarHBondContact CB-O 3.26Å; I559-Y566 PolarHBondContact N-O 2.8Å; I559-Y566 PolarHBondContact O-N 3.4Å; E561-Y566 HydrophobicContact CB-CD2 4.05Å; E561-Y566 HydrophobicContact CB-CE2 4.05Å; K564-Y566 HydrophobicContact CB-CD2 4.37Å; K564-Y566 HydrophobicContact CB-CE2 3.64Å; K564-Y566 HydrophobicContact CD-CE2 4.26Å; K564-Y566 WeakPolarHBondContact CD-OH 3.2Å; Y566-P578 HydrophobicContact CD1-CB 4.37Å; Y566-V579 WeakPolarHBondContact CA-O 3.37Å; Y566-Q580 HydrophobicContact CD1-CB 4.15Å; Y566-Q580 HydrophobicContact CE1-CB 3.84Å; Y566-Q580 HydrophobicContact CE1-CG 4.08Å
567	L	96.8	Very high	94.6	Very high	7 Å²	7	72.4 Å²	72.4	4%	0.037	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	136.9	171.6	-160.2	77.9	0	0	0	109.6	F515 F518 L554 A557 V579 I581	F515-L567 HydrophobicContact CD1-CD2 3.97Å; F515-L567 HydrophobicContact CE1-CD2 3.41Å; F515-L567 VanDerWaalsContact CE1-CD2 3.41Å; F515-L567 HydrophobicContact CZ-CD2 4.14Å; F518-L567 HydrophobicContact CE2-CD2 3.9Å; F518-L567 HydrophobicContact CZ-CD1 4.4Å; F518-L567 HydrophobicContact CZ-CD2 4.24Å; L554-L567 HydrophobicContact CD1-CD2 4.01Å; A557-L567 WeakPolarHBondContact O-CD1 3.4Å; L567-V579 PolarHBondContact N-O 2.78Å; L567-V579 WeakPolarHBondContact O-CG2 3.36Å; L567-V579 PolarHBondContact O-N 3.05Å; L567-I581 HydrophobicContact CB-CD1 4.02Å; L567-I581 HydrophobicContact CB-CG1 3.85Å
568	C	96.2	Very high	94.6	Very high	61 Å²	61	74 Å²	74	41%	0.412	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.9	127.6	172.5	-63.4	0	0	0	0	110.4	D576 K577	C568-D576 HydrophobicContact CB-CB 4.4Å; C568-K577 WeakPolarHBondContact CA-O 3.29Å
569	V	95.9	Very high	94.6	Very high	3 Å²	3	73 Å²	73	2%	0.018	40%	0.399	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	143.1	178.9	175.1	0	0	0	0	108.9	I506 F515 K577 V579	I506-V569 HydrophobicContact CD1-CG1 3.36Å; F515-V569 HydrophobicContact CE2-CG2 4.2Å; F515-V569 HydrophobicContact CZ-CG2 3.94Å; V569-K577 PolarHBondContact N-O 3.41Å; V569-K577 WeakPolarHBondContact O-CB 3.39Å; V569-K577 PolarHBondContact O-N 3.43Å; V569-V579 HydrophobicContact CB-CG1 4.07Å; V569-V579 HydrophobicContact CB-CG2 4.22Å; V569-V579 HydrophobicContact CG2-CG1 4.43Å; V569-V579 HydrophobicContact CG2-CG2 3.65Å
570	S	94.4	Very high	94.6	Very high	43 Å²	43	70 Å²	70	30%	0.301	38%	0.382	S	S	.	.			trans	-114.8	150.3	179.7	-63.6	0	0	0	0	111.9	I574 K575 D576	S570-I574 CarbonylContact C-O 3.58Å; S570-I574 WeakPolarHBondContact CA-O 3.47Å; S570-K575 WeakPolarHBondContact OG-CA 3.25Å; S570-D576 PolarHBondContact OG-N 3.4Å
571	S	92.8	Very high	94.7	Very high	7 Å²	7	63.3 Å²	63.3	5%	0.049	35%	0.351	C	S	.	.			trans	-122.8	-178.8	168.1	66.3	0	0	0	0	109.5	P503 D505 T573 I574	P503-S571 VanDerWaalsContact CB-OG 3.26Å; P503-S571 WeakPolarHBondContact CB-OG 3.46Å; D505-S571 WeakPolarHBondContact OD1-CB 3.46Å; D505-S571 PolarHBondContact OD1-OG 3.44Å; D505-S571 PolarHBondContact OD2-OG 3.16Å; S571-T573 VanDerWaalsContact C-N 3.26Å; S571-T573 PolarHBondContact O-N 3.12Å; S571-I574 PolarHBondContact N-O 3.32Å; S571-I574 PolarHBondContact OG-N 2.78Å; S571-I574 VanDerWaalsContact OG-N 3.17Å; S571-I574 PolarHBondContact OG-O 3.09Å
572	P	91.2	Very high	94.7	Very high	95 Å²	95	62.3 Å²	62.3	62%	0.617	34%	0.342	S	S	*	.	S	Bend	trans	-64.7	-29.8	-178	-22.6	35.7	0	0	0	113	E510	E510-P572 VanDerWaalsContact OE1-CD 3.23Å; E510-P572 WeakPolarHBondContact OE1-CD 3.27Å; E510-P572 VanDerWaalsContact OE1-CG 3.31Å; E510-P572 WeakPolarHBondContact OE1-CG 3.49Å; E510-P572 WeakPolarHBondContact OE2-CD 3.24Å
573	T	92.3	Very high	95	Very high	113 Å²	113	57.4 Å²	57.4	69%	0.693	32%	0.318	S	S	*	.	S	Bend	trans	-106.3	-23	-179.2	74.2	0	0	0	0	114.5	D505 S571	D505-T573 VanDerWaalsContact CG-OG1 3.26Å; D505-T573 VanDerWaalsContact OD2-CB 3.3Å; D505-T573 WeakPolarHBondContact OD2-CB 3.21Å; D505-T573 WeakPolarHBondContact OD2-CG2 3.18Å; D505-T573 PolarHBondContact OD2-N 3.44Å; D505-T573 PolarHBondContact OD2-OG1 2.88Å; S571-T573 VanDerWaalsContact C-N 3.26Å; S571-T573 PolarHBondContact O-N 3.12Å
574	I	94.1	Very high	95.3	Very high	58 Å²	58	55.1 Å²	55.1	30%	0.297	29%	0.29	S	S	.	.			trans	-121.4	117.5	-178.6	-46.3	-173.2	0	0	0	110.5	P503 P504 S570 S571 K577	P503-I574 HydrophobicContact CB-CB 4.39Å; P503-I574 HydrophobicContact CB-CD1 4.28Å; P504-I574 HydrophobicContact CG-CD1 4.45Å; S570-I574 CarbonylContact C-O 3.58Å; S570-I574 WeakPolarHBondContact CA-O 3.47Å; S571-I574 PolarHBondContact N-O 3.32Å; S571-I574 PolarHBondContact OG-N 2.78Å; S571-I574 VanDerWaalsContact OG-N 3.17Å; S571-I574 PolarHBondContact OG-O 3.09Å; I574-K577 HydrophobicContact CG2-CB 3.99Å; I574-K577 HydrophobicContact CG2-CD 4.38Å; I574-K577 HydrophobicContact CG2-CG 4.36Å
575	K	94.8	Very high	95.4	Very high	166 Å²	166	52.3 Å²	52.3	72%	0.722	28%	0.278	S	S	*	.			trans	-94.6	147.6	175.5	-62.9	-171.1	178.4	-172.6	0	112.1	S570 K577	S570-K575 WeakPolarHBondContact OG-CA 3.25Å; K575-K577 PolarHBondContact O-N 3Å; K575-K577 VanDerWaalsContact O-N 3.1Å
576	D	93.7	Very high	95.3	Very high	112 Å²	112	52.9 Å²	52.9	60%	0.599	28%	0.281	S	S	*	.	S	Bend	trans	49	38.8	169.8	-56.6	-55.7	0	0	0	114.1	C568 S570 P578	C568-D576 HydrophobicContact CB-CB 4.4Å; S570-D576 PolarHBondContact OG-N 3.4Å; D576-P578 WeakPolarHBondContact O-CD 3.47Å
577	K	95.4	Very high	95.1	Very high	60 Å²	60	54.4 Å²	54.4	26%	0.261	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	124.2	177.9	-166.8	-173.6	-175	-169.5	0	108.9	G501 L502 P503 C568 V569 I574 K575 V579	G501-K577 WeakPolarHBondContact O-CD 3.33Å; G501-K577 WeakPolarHBondContact O-CE 3.16Å; G501-K577 PolarHBondContact O-NZ 2.98Å; L502-K577 PolarHBondContact O-NZ 3.46Å; P503-K577 HydrophobicContact CB-CD 4.35Å; P503-K577 HydrophobicContact CG-CB 4.31Å; P503-K577 HydrophobicContact CG-CD 3.87Å; C568-K577 WeakPolarHBondContact CA-O 3.29Å; V569-K577 PolarHBondContact N-O 3.41Å; V569-K577 WeakPolarHBondContact O-CB 3.39Å; V569-K577 PolarHBondContact O-N 3.43Å; I574-K577 HydrophobicContact CG2-CB 3.99Å; I574-K577 HydrophobicContact CG2-CD 4.38Å; I574-K577 HydrophobicContact CG2-CG 4.36Å; K575-K577 PolarHBondContact O-N 3Å; K575-K577 VanDerWaalsContact O-N 3.1Å; K577-V579 PolarHBondContact O-N 3.41Å
578	P	95.8	Very high	95.1	Very high	82 Å²	82	55.9 Å²	55.9	53%	0.532	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.8	117.6	171.9	27.6	-32.7	0	0	0	109.2	Y566 D576	Y566-P578 HydrophobicContact CD1-CB 4.37Å; D576-P578 WeakPolarHBondContact O-CD 3.47Å
579	V	97.1	Very high	95.1	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	136.8	174.2	-49.2	0	0	0	0	108.8	V499 G500 L502 F515 Y566 L567 V569 K577 I581	V499-V579 HydrophobicContact CG1-CB 4.16Å; V499-V579 HydrophobicContact CG1-CG2 3.65Å; G500-V579 CarbonylContact O-C 3.5Å; L502-V579 HydrophobicContact CD2-CB 4.45Å; L502-V579 HydrophobicContact CD2-CG1 4.2Å; L502-V579 HydrophobicContact CD2-CG2 4.44Å; F515-V579 HydrophobicContact CZ-CG2 4.33Å; Y566-V579 WeakPolarHBondContact CA-O 3.37Å; L567-V579 PolarHBondContact N-O 2.78Å; L567-V579 WeakPolarHBondContact O-CG2 3.36Å; L567-V579 PolarHBondContact O-N 3.05Å; V569-V579 HydrophobicContact CB-CG1 4.07Å; V569-V579 HydrophobicContact CB-CG2 4.22Å; V569-V579 HydrophobicContact CG2-CG1 4.43Å; V569-V579 HydrophobicContact CG2-CG2 3.65Å; K577-V579 PolarHBondContact O-N 3.41Å; V579-I581 HydrophobicContact CG2-CD1 4.04Å; V579-I581 PolarHBondContact O-N 2.94Å
580	Q	97.1	Very high	95	Very high	44 Å²	44	57.6 Å²	57.6	21%	0.206	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	122.1	-177.3	-168.8	-172.1	37.1	0	0	109.9	V499 G500 L565 Y566 R582	V499-Q580 CarbonylContact C-O 3.55Å; V499-Q580 WeakPolarHBondContact CA-O 3.17Å; G500-Q580 PolarHBondContact N-O 2.9Å; G500-Q580 PolarHBondContact O-N 2.96Å; L565-Q580 WeakPolarHBondContact O-CA 3.36Å; Y566-Q580 HydrophobicContact CD1-CB 4.15Å; Y566-Q580 HydrophobicContact CE1-CB 3.84Å; Y566-Q580 HydrophobicContact CE1-CG 4.08Å; Q580-R582 HydrophobicContact CG-CG 4.04Å
581	I	97.7	Very high	95.1	Very high	2 Å²	2	58.5 Å²	58.5	1%	0.01	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	132.4	172.6	-49.8	-55.6	0	0	0	108.2	V497 V499 F515 L554 L565 L567 V579	V497-I581 HydrophobicContact CG1-CG2 3.7Å; V499-I581 HydrophobicContact CB-CD1 4.47Å; V499-I581 HydrophobicContact CG1-CD1 4.02Å; V499-I581 HydrophobicContact CG2-CD1 3.8Å; F515-I581 HydrophobicContact CE1-CD1 3.72Å; F515-I581 HydrophobicContact CZ-CD1 3.78Å; L554-I581 HydrophobicContact CD1-CG2 4.48Å; L554-I581 HydrophobicContact CD2-CG2 3.94Å; L554-I581 HydrophobicContact CG-CG2 4.19Å; L565-I581 HydrophobicContact CB-CB 4.11Å; L565-I581 PolarHBondContact O-N 2.93Å; L567-I581 HydrophobicContact CB-CD1 4.02Å; L567-I581 HydrophobicContact CB-CG1 3.85Å; V579-I581 HydrophobicContact CG2-CD1 4.04Å; V579-I581 PolarHBondContact O-N 2.94Å
582	R	96.3	Very high	95.2	Very high	101 Å²	101	61.5 Å²	61.5	38%	0.381	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	91.8	176.8	-58.5	-177.7	70.2	161.3	5	109.4	F498 Q580	F498-R582 HydrophobicContact CB-CB 4.19Å; F498-R582 HydrophobicContact CD1-CB 3.92Å; F498-R582 HydrophobicContact CD1-CG 3.95Å; F498-R582 PolarHBondContact N-O 2.85Å; F498-R582 PolarHBondContact O-N 2.89Å; Q580-R582 HydrophobicContact CG-CG 4.04Å
583	P	96.2	Very high	95.1	Very high	32 Å²	32	60.4 Å²	60.4	21%	0.208	31%	0.311	C	S	.	.			trans	-70.5	170.9	169.2	35.6	-37.9	0	0	0	109.8	Y493 V551 I555 L565	Y493-P583 HydrophobicContact CD1-CB 3.7Å; Y493-P583 HydrophobicContact CD1-CG 4.15Å; Y493-P583 HydrophobicContact CE1-CB 4Å; Y493-P583 HydrophobicContact CE1-CG 3.91Å; V551-P583 HydrophobicContact CG1-CB 4.12Å; I555-P583 HydrophobicContact CD1-CB 3.87Å; I555-P583 HydrophobicContact CD1-CG 3.75Å; I555-P583 HydrophobicContact CG1-CB 4.34Å; I555-P583 HydrophobicContact CG1-CG 4.01Å; L565-P583 HydrophobicContact CD1-CG 4.11Å
584	W	96.3	Very high	94.6	Very high	16 Å²	16	58 Å²	58	6%	0.061	29%	0.294	C	S	.	.			trans	-119.5	114.1	170.3	172.7	-95.1	0	0	0	109.3	Y493 S494 D588 I635 Y643 P644	Y493-W584 WeakPolarHBondContact CA-O 3.42Å; S494-W584 PolarHBondContact N-O 3.41Å; W584-D588 HydrophobicContact CH2-CB 4.2Å; W584-D588 HydrophobicContact CZ2-CB 4.16Å; W584-I635 HydrophobicContact CH2-CB 4.48Å; W584-I635 HydrophobicContact CH2-CG1 4.12Å; W584-I635 HydrophobicContact CH2-CG2 4.33Å; W584-I635 HydrophobicContact CZ2-CB 4.26Å; W584-I635 HydrophobicContact CZ2-CG1 4.29Å; W584-I635 HydrophobicContact CZ2-CG2 4.25Å; W584-Y643 HydrophobicContact CB-CD2 4.13Å; W584-Y643 HydrophobicContact CB-CE2 4.16Å; W584-P644 HydrophobicContact CD2-CB 4.46Å; W584-P644 VanDerWaalsContact CD2-CD 3.48Å; W584-P644 HydrophobicContact CD2-CG 3.72Å; W584-P644 HydrophobicContact CE3-CB 4.46Å; W584-P644 HydrophobicContact CE3-CG 3.65Å; W584-P644 HydrophobicContact CG-CG 4.24Å; W584-P644 HydrophobicContact CH2-CB 4.3Å; W584-P644 HydrophobicContact CH2-CG 4.35Å; W584-P644 HydrophobicContact CZ2-CB 4.31Å; W584-P644 HydrophobicContact CZ2-CG 4.42Å; W584-P644 HydrophobicContact CZ3-CB 4.38Å; W584-P644 HydrophobicContact CZ3-CG 3.98Å
585	N	95.2	Very high	93.9	Very high	16 Å²	16	58.7 Å²	58.7	9%	0.086	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-71.6	130.2	177.5	-166.6	-42.7	0	0	0	109.1	E491 R492 Y493 N587 D588	E491-N585 PolarHBondContact OE1-ND2 3.04Å; R492-N585 CarbonylContact O-C 3.59Å; R492-N585 WeakPolarHBondContact O-CA 3.11Å; R492-N585 PolarHBondContact O-OD1 3.11Å; Y493-N585 HydrophobicContact CD1-CB 4.18Å; Y493-N585 HydrophobicContact CE1-CB 3.7Å; Y493-N585 PolarHBondContact OH-ND2 3.18Å; N585-N587 PolarHBondContact O-N 2.87Å; N585-N587 VanDerWaalsContact OD1-CB 3.27Å; N585-N587 WeakPolarHBondContact OD1-CB 3.29Å; N585-N587 PolarHBondContact OD1-N 2.88Å; N585-N587 PolarHBondContact OD1-ND2 2.88Å; N585-D588 PolarHBondContact O-N 2.83Å
586	L	94.1	Very high	93.2	Very high	40 Å²	40	55 Å²	55	21%	0.209	31%	0.31	C	S	.	.	G	3₁₀ helix	trans	-69.4	-26.3	-177.6	-59.4	-168.7	0	0	0	111.8	R492 D588 S589 K642	R492-L586 HydrophobicContact CB-CB 4.2Å; R492-L586 HydrophobicContact CB-CD1 4.14Å; R492-L586 HydrophobicContact CB-CG 4.26Å; R492-L586 PolarHBondContact O-N 2.69Å; L586-D588 PolarHBondContact O-N 3.31Å; L586-S589 WeakPolarHBondContact O-CB 3.06Å; L586-S589 PolarHBondContact O-N 2.93Å; L586-S589 VanDerWaalsContact O-N 3.16Å; L586-S589 PolarHBondContact O-OG 2.89Å; L586-K642 HydrophobicContact CD2-CB 3.57Å; L586-K642 HydrophobicContact CD2-CG 4.43Å
587	N	94.6	Very high	92.3	Very high	85 Å²	85	54.1 Å²	54.1	46%	0.455	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-67	-20.8	175.1	-58.3	-38.8	0	0	0	112.6	N585 S589	N585-N587 PolarHBondContact O-N 2.87Å; N585-N587 VanDerWaalsContact OD1-CB 3.27Å; N585-N587 WeakPolarHBondContact OD1-CB 3.29Å; N585-N587 PolarHBondContact OD1-N 2.88Å; N585-N587 PolarHBondContact OD1-ND2 2.88Å; N587-S589 VanDerWaalsContact C-N 3.26Å; N587-S589 PolarHBondContact O-N 3.25Å
588	D	95.3	Very high	91.6	Very high	37 Å²	37	56.7 Å²	56.7	20%	0.198	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-81.5	-2.7	175.7	-73.6	-38.6	0	0	0	113.3	W584 N585 L586 R615 A616	W584-D588 HydrophobicContact CH2-CB 4.2Å; W584-D588 HydrophobicContact CZ2-CB 4.16Å; N585-D588 PolarHBondContact O-N 2.83Å; L586-D588 PolarHBondContact O-N 3.31Å; D588-R615 HydrophobicContact CB-CB 4.01Å; D588-R615 HydrophobicContact CB-CG 3.93Å; D588-R615 WeakPolarHBondContact OD1-CD 3.44Å; D588-R615 IonicContact OD1-NH1 3.8Å; D588-R615 VanDerWaalsContact OD2-CD 3.24Å; D588-R615 WeakPolarHBondContact OD2-CD 3.23Å; D588-A616 VanDerWaalsContact O-CB 3.28Å; D588-A616 WeakPolarHBondContact O-CB 3.08Å; D588-A616 PolarHBondContact O-N 2.84Å
589	S	96.1	Very high	91.2	Very high	20 Å²	20	56.5 Å²	56.5	14%	0.14	32%	0.32	C	S	.	.	G	3₁₀ helix	trans	-83.3	-14.7	-176.7	76.9	0	0	0	0	114.8	L586 N587 G634 I635	L586-S589 WeakPolarHBondContact O-CB 3.06Å; L586-S589 PolarHBondContact O-N 2.93Å; L586-S589 VanDerWaalsContact O-N 3.16Å; L586-S589 PolarHBondContact O-OG 2.89Å; N587-S589 VanDerWaalsContact C-N 3.26Å; N587-S589 PolarHBondContact O-N 3.25Å; S589-G634 CarbonylContact O-C 3.5Å; S589-G634 WeakPolarHBondContact O-CA 3.25Å; S589-I635 PolarHBondContact O-N 3.29Å
590	D	95.4	Very high	90.8	Very high	81 Å²	81	59 Å²	59	43%	0.433	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.7	152.4	172.5	68.2	-86.1	0	0	0	112.6	A616 Y632	D590-A616 VanDerWaalsContact C-CB 3.47Å; D590-Y632 HydrophobicContact CB-CE2 3.89Å; D590-Y632 WeakPolarHBondContact CB-OH 3.36Å
591	F	96.3	Very high	90.4	Very high	61 Å²	61	60.3 Å²	60.3	27%	0.268	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.3	127.3	-178.5	179.2	-101.1	0	0	0	110.9	M593 A616 V617 A620 Y632 A633	F591-M593 HydrophobicContact CD1-CB 4.47Å; F591-M593 HydrophobicContact CE1-CB 3.81Å; F591-M593 HydrophobicContact CE1-CE 4.46Å; F591-M593 HydrophobicContact CE1-CG 4.12Å; F591-A616 HydrophobicContact CB-CB 3.74Å; F591-V617 HydrophobicContact CB-CB 4.27Å; F591-V617 HydrophobicContact CD1-CB 4.19Å; F591-V617 HydrophobicContact CD1-CG2 4.25Å; F591-V617 HydrophobicContact CD2-CB 3.66Å; F591-V617 HydrophobicContact CD2-CG2 3.87Å; F591-V617 HydrophobicContact CE1-CB 4.48Å; F591-V617 HydrophobicContact CE1-CG2 4.04Å; F591-V617 HydrophobicContact CE2-CB 4Å; F591-V617 HydrophobicContact CE2-CG2 3.65Å; F591-V617 HydrophobicContact CG-CB 3.76Å; F591-V617 HydrophobicContact CG-CG2 4.17Å; F591-V617 HydrophobicContact CZ-CB 4.4Å; F591-V617 HydrophobicContact CZ-CG2 3.75Å; F591-A620 HydrophobicContact CD1-CB 3.67Å; F591-A620 HydrophobicContact CE1-CB 4.12Å; F591-Y632 WeakPolarHBondContact O-CA 3.08Å; F591-Y632 VanDerWaalsContact O-CD2 3.23Å; F591-Y632 WeakPolarHBondContact O-CD2 3.27Å; F591-A633 PolarHBondContact N-O 3.47Å; F591-A633 PolarHBondContact O-N 3.02Å
592	V	94.3	Very high	90.1	Very high	70 Å²	70	64.7 Å²	64.7	42%	0.424	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	122	173	178.6	0	0	0	0	108.1	Y632	V592-Y632 HydrophobicContact CG2-CD2 3.88Å; V592-Y632 HydrophobicContact CG2-CE2 4.44Å
593	M	89.9	Confident	89.9	Confident	72 Å²	72	62.1 Å²	62.1	36%	0.355	35%	0.354	S	S	.	.	S	Bend	trans	-88.5	-38.2	177.6	-163.4	-178.4	-53.7	0	0	111.7	F591 A620 D624 V630 C631	F591-M593 HydrophobicContact CD1-CB 4.47Å; F591-M593 HydrophobicContact CE1-CB 3.81Å; F591-M593 HydrophobicContact CE1-CE 4.46Å; F591-M593 HydrophobicContact CE1-CG 4.12Å; M593-A620 HydrophobicContact CE-CB 3.64Å; M593-D624 HydrophobicContact CE-CB 3.93Å; M593-D624 HydrophobicContact SD-CB 4.41Å; M593-V630 HydrophobicContact CE-CB 4.02Å; M593-V630 HydrophobicContact CE-CG1 4.07Å; M593-C631 PolarHBondContact N-O 2.92Å
594	D	82.2	Confident	89.9	Confident	63 Å²	63	61.3 Å²	61.3	34%	0.337	35%	0.348	S	S	.	.			trans	-132.7	108.2	172.8	179.9	0.6	0	0	0	109	S596 Q597 C631	D594-S596 VanDerWaalsContact C-N 3.34Å; D594-S596 VanDerWaalsContact OD1-CB 3.25Å; D594-S596 WeakPolarHBondContact OD1-CB 3.23Å; D594-S596 PolarHBondContact OD1-N 3.3Å; D594-S596 PolarHBondContact OD1-OG 3.09Å; D594-S596 PolarHBondContact OD2-OG 2.61Å; D594-Q597 VanDerWaalsContact OD2-CG 3.27Å; D594-Q597 WeakPolarHBondContact OD2-CG 3.41Å; D594-C631 PolarHBondContact N-O 3.01Å
595	G	77.6	Confident	89.9	Confident	72 Å²	72	60.5 Å²	60.5	74%	0.742	35%	0.345	S	S	*	.	S	Bend	trans	-85.5	-0.9	178.3	0	0	0	0	0	114.5
596	S	80.3	Confident	90	Very high	88 Å²	88	62.5 Å²	62.5	62%	0.615	35%	0.353	S	S	*	.	S	Bend	trans	-81.1	-25.2	177	74.9	0	0	0	0	112.9	D594	D594-S596 VanDerWaalsContact C-N 3.34Å; D594-S596 VanDerWaalsContact OD1-CB 3.25Å; D594-S596 WeakPolarHBondContact OD1-CB 3.23Å; D594-S596 PolarHBondContact OD1-N 3.3Å; D594-S596 PolarHBondContact OD1-OG 3.09Å; D594-S596 PolarHBondContact OD2-OG 2.61Å
597	Q	75.6	Confident	90.2	Very high	94 Å²	94	60.6 Å²	60.6	44%	0.439	34%	0.343	S	S	.	.	S	Bend	trans	-93.1	133.1	-176.3	-60.7	-59.9	-40.4	0	0	111.5	D594 L599	D594-Q597 VanDerWaalsContact OD2-CG 3.27Å; D594-Q597 WeakPolarHBondContact OD2-CG 3.41Å; Q597-L599 PolarHBondContact O-N 3.3Å
598	P	81.1	Confident	90.3	Very high	115 Å²	115	57.1 Å²	57.1	75%	0.747	33%	0.327	S	S	*	.	P	Polyproline II helix	trans	-65.2	125.5	171.2	27.9	-33	0	0	0	109.9	D600	P598-D600 PolarHBondContact O-N 2.84Å
599	L	87.8	Confident	90.2	Very high	78 Å²	78	57.5 Å²	57.5	41%	0.408	34%	0.339	S	S	.	.	P	Polyproline II helix	trans	-67.4	125.7	177.5	-56.5	-176.5	0	0	0	110	Q597 P601 C631 Y632	Q597-L599 PolarHBondContact O-N 3.3Å; L599-P601 WeakPolarHBondContact O-CD 3.43Å; L599-C631 HydrophobicContact CD2-CB 3.91Å; L599-C631 WeakPolarHBondContact CD2-SG 3.32Å; L599-Y632 HydrophobicContact CD1-CD1 4.37Å; L599-Y632 HydrophobicContact CD1-CD2 4.08Å; L599-Y632 HydrophobicContact CD1-CG 3.83Å
600	D	87.8	Confident	90.2	Very high	52 Å²	52	56.8 Å²	56.8	28%	0.278	33%	0.334	S	S	.	.			trans	-98.5	110	176.8	-177.6	-9.1	0	0	0	110.2	P598 R602 K603 T604	P598-D600 PolarHBondContact O-N 2.84Å; D600-R602 PolarHBondContact O-N 2.85Å; D600-R602 VanDerWaalsContact O-N 3.15Å; D600-R602 VanDerWaalsContact OD1-CB 3.32Å; D600-R602 WeakPolarHBondContact OD1-CB 3.43Å; D600-R602 PolarHBondContact OD1-N 2.87Å; D600-K603 HydrophobicContact CB-CB 4.35Å; D600-K603 HydrophobicContact CB-CD 3.98Å; D600-K603 HydrophobicContact CB-CG 4.12Å; D600-K603 PolarHBondContact O-N 2.78Å; D600-K603 WeakPolarHBondContact OD2-CE 3.26Å; D600-K603 IonicContact OD2-NZ 3.22Å; D600-T604 PolarHBondContact O-OG1 3.44Å
601	P	88.5	Confident	90.2	Very high	71 Å²	71	53.1 Å²	53.1	46%	0.461	32%	0.315	S	S	.	.	G	3₁₀ helix	trans	-59.8	-25.8	179.2	-24.8	36.4	0	0	0	113.4	L599 K603 T604 L685	L599-P601 WeakPolarHBondContact O-CD 3.43Å; P601-K603 VanDerWaalsContact C-N 3.27Å; P601-K603 PolarHBondContact O-N 3.16Å; P601-T604 WeakPolarHBondContact O-CB 3.36Å; P601-T604 PolarHBondContact O-N 2.91Å; P601-T604 PolarHBondContact O-OG1 2.83Å; P601-L685 HydrophobicContact CB-CD1 3.76Å; P601-L685 HydrophobicContact CB-CD2 3.88Å; P601-L685 HydrophobicContact CB-CG 4.46Å
602	R	91	Very high	90	Very high	95 Å²	95	56.4 Å²	56.4	36%	0.358	33%	0.326	S	S	.	.	G	3₁₀ helix	trans	-74.1	-16.3	178.4	-66.1	178.2	155.5	-134.3	-7.6	113.5	D600 L685 Q688 D691	D600-R602 PolarHBondContact O-N 2.85Å; D600-R602 VanDerWaalsContact O-N 3.15Å; D600-R602 VanDerWaalsContact OD1-CB 3.32Å; D600-R602 WeakPolarHBondContact OD1-CB 3.43Å; D600-R602 PolarHBondContact OD1-N 2.87Å; R602-L685 HydrophobicContact CG-CD1 4.05Å; R602-Q688 VanDerWaalsContact CZ-OE1 3.25Å; R602-D691 IonicContact CZ-OD1 2.66Å; R602-D691 VanDerWaalsContact CZ-OD1 3.25Å; R602-D691 IonicContact NH1-OD1 4Å; R602-D691 PolarHBondContact NH1-OD1 2.76Å; R602-D691 IonicContact NH1-OD2 2.75Å; R602-D691 IonicContact NH2-OD1 2.61Å; R602-D691 PolarHBondContact NH2-OD1 3.28Å; R602-D691 IonicContact NH2-OD2 2.73Å
603	K	93.8	Very high	89.9	Confident	47 Å²	47	54.8 Å²	54.8	20%	0.204	32%	0.317	C	S	.	.	G	3₁₀ helix	trans	-98.9	14.7	173.6	-59.9	176.3	-167.9	159.1	0	112.9	D600 P601 F652 S653 Y658	D600-K603 HydrophobicContact CB-CB 4.35Å; D600-K603 HydrophobicContact CB-CD 3.98Å; D600-K603 HydrophobicContact CB-CG 4.12Å; D600-K603 PolarHBondContact O-N 2.78Å; D600-K603 WeakPolarHBondContact OD2-CE 3.26Å; D600-K603 IonicContact OD2-NZ 3.22Å; P601-K603 VanDerWaalsContact C-N 3.27Å; P601-K603 PolarHBondContact O-N 3.16Å; K603-F652 VanDerWaalsContact CB-O 3.29Å; K603-F652 WeakPolarHBondContact CB-O 3.39Å; K603-F652 WeakPolarHBondContact CD-O 3.35Å; K603-F652 PolarHBondContact O-N 3.36Å; K603-S653 WeakPolarHBondContact CD-O 3.45Å; K603-S653 PolarHBondContact NZ-O 2.97Å; K603-Y658 HydrophobicContact CB-CG 4.45Å; K603-Y658 WeakPolarHBondContact O-CD2 3.24Å
604	T	95.4	Very high	90.2	Very high	14 Å²	14	51.4 Å²	51.4	9%	0.086	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.2	135.6	179.9	-57.5	0	0	0	0	110.9	D600 P601 R649 V650 A651 Y683	D600-T604 PolarHBondContact O-OG1 3.44Å; P601-T604 WeakPolarHBondContact O-CB 3.36Å; P601-T604 PolarHBondContact O-N 2.91Å; P601-T604 PolarHBondContact O-OG1 2.83Å; T604-R649 HydrophobicContact CG2-CB 4.1Å; T604-V650 CarbonylContact C-O 3.51Å; T604-V650 WeakPolarHBondContact CA-O 3.37Å; T604-A651 WeakPolarHBondContact OG1-CB 3.28Å; T604-Y683 HydrophobicContact CG2-CD2 4.25Å; T604-Y683 HydrophobicContact CG2-CG 3.96Å; T604-Y683 WeakPolarHBondContact O-CB 3.5Å; T604-Y683 PolarHBondContact O-N 3.48Å
605	I	96.4	Very high	90.8	Very high	0 Å²	0	53 Å²	53	0%	0	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	148.2	169.7	68.6	169.3	0	0	0	110.3	V607 R649 V650 F652 Y658 A661 I662 V680 K681	I605-V607 HydrophobicContact CD1-CG2 3.83Å; I605-V607 HydrophobicContact CG1-CG2 4.01Å; I605-R649 CarbonylContact O-C 3.47Å; I605-R649 VanDerWaalsContact O-CA 3.23Å; I605-R649 WeakPolarHBondContact O-CA 3.42Å; I605-V650 HydrophobicContact CD1-CB 4.22Å; I605-V650 HydrophobicContact CG1-CB 3.84Å; I605-V650 WeakPolarHBondContact CG1-O 3.4Å; I605-V650 PolarHBondContact N-O 3.49Å; I605-V650 PolarHBondContact O-N 2.91Å; I605-F652 HydrophobicContact CD1-CE2 3.88Å; I605-F652 HydrophobicContact CD1-CZ 4.2Å; I605-F652 HydrophobicContact CG1-CE2 4Å; I605-F652 HydrophobicContact CG2-CD2 4.39Å; I605-F652 HydrophobicContact CG2-CE2 3.86Å; I605-Y658 HydrophobicContact CG2-CD2 3.61Å; I605-Y658 HydrophobicContact CG2-CE2 3.85Å; I605-A661 HydrophobicContact CD1-CB 4.04Å; I605-A661 HydrophobicContact CG2-CB 4.35Å; I605-I662 HydrophobicContact CB-CD1 4.08Å; I605-I662 HydrophobicContact CG2-CD1 3.45Å; I605-I662 VanDerWaalsContact CG2-CD1 3.45Å; I605-I662 HydrophobicContact CG2-CG1 4.02Å; I605-V680 HydrophobicContact CB-CG1 4.2Å; I605-V680 HydrophobicContact CD1-CG1 3.8Å; I605-V680 HydrophobicContact CD1-CG2 4.47Å; I605-V680 HydrophobicContact CG2-CG1 4.46Å; I605-K681 CarbonylContact C-O 3.58Å; I605-K681 WeakPolarHBondContact CA-O 3.36Å
606	F	96.9	Very high	91.8	Very high	58 Å²	58	49.6 Å²	49.6	25%	0.254	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	137.4	162.1	175.6	-95.8	0	0	0	109.6	D636 A647 V680 K681 Y683	F606-D636 WeakPolarHBondContact CE2-OD2 3.49Å; F606-A647 HydrophobicContact CE2-CB 3.75Å; F606-A647 HydrophobicContact CZ-CB 3.63Å; F606-V680 WeakPolarHBondContact O-CA 3.28Å; F606-K681 HydrophobicContact CB-CB 4.47Å; F606-K681 HydrophobicContact CD1-CB 4.44Å; F606-K681 PolarHBondContact N-O 3.35Å; F606-K681 PolarHBondContact O-N 3.03Å; F606-Y683 HydrophobicContact CB-CD2 4.32Å
607	V	97.3	Very high	92.5	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	108.4	-179.4	-168.4	0	0	0	0	108.7	I605 V610 M623 A647 G648 V650 V678 E679	I605-V607 HydrophobicContact CD1-CG2 3.83Å; I605-V607 HydrophobicContact CG1-CG2 4.01Å; V607-V610 HydrophobicContact CB-CG2 4.04Å; V607-V610 HydrophobicContact CG1-CG2 3.66Å; V607-V610 WeakPolarHBondContact O-CG2 3.08Å; V607-M623 HydrophobicContact CG1-CE 3.82Å; V607-M623 HydrophobicContact CG2-CE 3.91Å; V607-A647 CarbonylContact O-C 3.54Å; V607-A647 WeakPolarHBondContact O-CA 3.36Å; V607-A647 WeakPolarHBondContact O-CB 3.5Å; V607-G648 PolarHBondContact N-O 2.88Å; V607-G648 PolarHBondContact O-N 3.3Å; V607-V650 HydrophobicContact CG2-CG2 4.11Å; V607-V678 HydrophobicContact CG1-CB 4Å; V607-V678 HydrophobicContact CG1-CG2 3.65Å; V607-E679 CarbonylContact C-O 3.57Å; V607-E679 WeakPolarHBondContact CA-O 3.35Å
608	G	96.6	Very high	93.5	Very high	12 Å²	12	44.3 Å²	44.3	12%	0.124	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	138.7	-177.1	0	0	0	0	0	113.2	V678 E679	G608-V678 WeakPolarHBondContact O-CA 3.43Å; G608-V678 VanDerWaalsContact O-CB 3.32Å; G608-V678 WeakPolarHBondContact O-CB 3.46Å; G608-E679 PolarHBondContact N-O 2.86Å; G608-E679 PolarHBondContact O-N 2.65Å
609	G	95.1	Very high	94.2	Very high	44 Å²	44	38.8 Å²	38.8	45%	0.454	20%	0.198	S	C	.	.	S	Bend	trans	93.4	8.9	179.2	0	0	0	0	0	114.8	G646	G609-G646 CarbonylContact C-O 3.47Å; G609-G646 WeakPolarHBondContact CA-O 3.23Å; G609-G646 PolarHBondContact N-O 3.45Å
610	V	95.7	Very high	94.7	Very high	6 Å²	6	35.1 Å²	35.1	4%	0.036	18%	0.178	C	C	.	.			trans	-52	136.3	177.9	178.2	0	0	0	0	111.1	V607 R612 L614 I635 G646 L669 V678	V607-V610 HydrophobicContact CB-CG2 4.04Å; V607-V610 HydrophobicContact CG1-CG2 3.66Å; V607-V610 WeakPolarHBondContact O-CG2 3.08Å; V610-R612 PolarHBondContact O-N 2.89Å; V610-L614 HydrophobicContact CG1-CB 3.97Å; V610-L614 HydrophobicContact CG1-CD2 3.58Å; V610-L614 HydrophobicContact CG1-CG 4.36Å; V610-I635 HydrophobicContact CG1-CD1 4.46Å; V610-G646 PolarHBondContact N-O 3.15Å; V610-G646 CarbonylContact O-C 3.55Å; V610-G646 WeakPolarHBondContact O-CA 3.37Å; V610-L669 HydrophobicContact CG2-CD1 4.48Å; V610-V678 HydrophobicContact CG2-CG1 4.45Å
611	P	94.1	Very high	95	Very high	3 Å²	3	38.1 Å²	38.1	2%	0.019	19%	0.192	C	C	.	.			trans	-57.5	130.6	172.6	-20.5	30.9	0	0	0	111.2	P613 L614 I674 K676	P611-P613 VanDerWaalsContact C-CD 3.4Å; P611-P613 VanDerWaalsContact C-N 3.27Å; P611-L614 HydrophobicContact CB-CB 4.31Å; P611-L614 VanDerWaalsContact O-CB 3.27Å; P611-L614 WeakPolarHBondContact O-CB 3.23Å; P611-L614 PolarHBondContact O-N 3.01Å; P611-I674 HydrophobicContact CB-CG2 4.28Å; P611-I674 HydrophobicContact CG-CG2 4.09Å; P611-K676 HydrophobicContact CG-CD 4.36Å
612	R	93.2	Very high	95.4	Very high	131 Å²	131	36.7 Å²	36.7	49%	0.494	18%	0.18	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-27.7	176.9	-72.8	-171.7	176.3	112.8	14.5	115.4	V610 L614 P644 K645	V610-R612 PolarHBondContact O-N 2.89Å; R612-L614 VanDerWaalsContact C-N 3.33Å; R612-P644 HydrophobicContact CB-CG 4.4Å; R612-P644 WeakPolarHBondContact CD-O 3.29Å; R612-P644 PolarHBondContact NE-O 2.8Å; R612-K645 PolarHBondContact NE-O 3.48Å; R612-K645 PolarHBondContact NH2-O 2.89Å
613	P	92.8	Very high	95.6	Very high	36 Å²	36	32.1 Å²	32.1	23%	0.234	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.9	-15.8	170.6	-25.3	38	0	0	0	115.8	P611 R615 I674	P611-P613 VanDerWaalsContact C-CD 3.4Å; P611-P613 VanDerWaalsContact C-N 3.27Å; P613-R615 PolarHBondContact O-N 3.47Å; P613-I674 HydrophobicContact CG-CD1 4.34Å
614	L	94.9	Very high	95.7	Very high	1 Å²	1	32.5 Å²	32.5	1%	0.005	17%	0.167	C	C	.	.			trans	-70.8	126	-174.3	-171.7	76.7	0	0	0	110.5	V610 P611 R612 E618 L619 I622 I635 L669 H671	V610-L614 HydrophobicContact CG1-CB 3.97Å; V610-L614 HydrophobicContact CG1-CD2 3.58Å; V610-L614 HydrophobicContact CG1-CG 4.36Å; P611-L614 HydrophobicContact CB-CB 4.31Å; P611-L614 VanDerWaalsContact O-CB 3.27Å; P611-L614 WeakPolarHBondContact O-CB 3.23Å; P611-L614 PolarHBondContact O-N 3.01Å; R612-L614 VanDerWaalsContact C-N 3.33Å; L614-E618 HydrophobicContact CD1-CB 3.51Å; L614-E618 HydrophobicContact CG-CB 4.18Å; L614-L619 HydrophobicContact CD2-CB 3.76Å; L614-L619 HydrophobicContact CD2-CD1 3.94Å; L614-L619 HydrophobicContact CD2-CG 4.36Å; L614-L619 HydrophobicContact CG-CB 4.38Å; L614-I622 HydrophobicContact CD1-CD1 4.14Å; L614-I635 WeakPolarHBondContact O-CD1 3.3Å; L614-L669 HydrophobicContact CD2-CD1 3.99Å; L614-H671 HydrophobicContact CD1-CB 3.93Å; L614-H671 WeakPolarHBondContact CD1-ND1 3.41Å
615	R	95.7	Very high	95.7	Very high	97 Å²	97	42.6 Å²	42.6	37%	0.366	20%	0.204	S	C	.	.			trans	-87.8	156.8	-180	-56.2	179.1	-63	144.3	-3.1	110.8	D588 P613 V617 E618 L619	D588-R615 HydrophobicContact CB-CB 4.01Å; D588-R615 HydrophobicContact CB-CG 3.93Å; D588-R615 WeakPolarHBondContact OD1-CD 3.44Å; D588-R615 IonicContact OD1-NH1 3.8Å; D588-R615 VanDerWaalsContact OD2-CD 3.24Å; D588-R615 WeakPolarHBondContact OD2-CD 3.23Å; P613-R615 PolarHBondContact O-N 3.47Å; R615-V617 VanDerWaalsContact C-N 3.28Å; R615-V617 HydrophobicContact CB-CG1 4.23Å; R615-V617 PolarHBondContact O-N 2.61Å; R615-E618 HydrophobicContact CB-CG 4.32Å; R615-E618 IonicContact CZ-OE1 2.92Å; R615-E618 VanDerWaalsContact CZ-OE1 3.22Å; R615-E618 PolarHBondContact N-OE2 2.84Å; R615-E618 IonicContact NE-OE1 3.22Å; R615-E618 PolarHBondContact NE-OE1 2.84Å; R615-E618 IonicContact NE-OE2 2.66Å; R615-E618 IonicContact NH2-OE1 3.41Å; R615-E618 PolarHBondContact NH2-OE1 3.45Å; R615-E618 PolarHBondContact O-N 2.86Å; R615-L619 PolarHBondContact O-N 2.89Å
616	A	97.2	Very high	95.6	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	23%	0.226	C	C	.	.	H	α-helix	trans	-57.2	-40.1	-177.9	0	0	0	0	0	112.9	D588 D590 F591 E618 L619 A620 A633 I635	D588-A616 VanDerWaalsContact O-CB 3.28Å; D588-A616 WeakPolarHBondContact O-CB 3.08Å; D588-A616 PolarHBondContact O-N 2.84Å; D590-A616 VanDerWaalsContact C-CB 3.47Å; F591-A616 HydrophobicContact CB-CB 3.74Å; A616-E618 VanDerWaalsContact C-N 3.33Å; A616-E618 PolarHBondContact O-N 2.9Å; A616-L619 PolarHBondContact O-N 2.82Å; A616-A620 WeakPolarHBondContact O-CB 3.34Å; A616-A620 PolarHBondContact O-N 3.47Å; A616-A633 WeakPolarHBondContact O-CB 3.31Å; A616-I635 HydrophobicContact CB-CG1 4.21Å
617	V	96.4	Very high	95.6	Very high	31 Å²	31	46.4 Å²	46.4	19%	0.188	22%	0.223	C	C	.	.	H	α-helix	trans	-61	-38.5	175.7	60.4	0	0	0	0	113	F591 R615 A620 M621	F591-V617 HydrophobicContact CB-CB 4.27Å; F591-V617 HydrophobicContact CD1-CB 4.19Å; F591-V617 HydrophobicContact CD1-CG2 4.25Å; F591-V617 HydrophobicContact CD2-CB 3.66Å; F591-V617 HydrophobicContact CD2-CG2 3.87Å; F591-V617 HydrophobicContact CE1-CB 4.48Å; F591-V617 HydrophobicContact CE1-CG2 4.04Å; F591-V617 HydrophobicContact CE2-CB 4Å; F591-V617 HydrophobicContact CE2-CG2 3.65Å; F591-V617 HydrophobicContact CG-CB 3.76Å; F591-V617 HydrophobicContact CG-CG2 4.17Å; F591-V617 HydrophobicContact CZ-CB 4.4Å; F591-V617 HydrophobicContact CZ-CG2 3.75Å; R615-V617 VanDerWaalsContact C-N 3.28Å; R615-V617 HydrophobicContact CB-CG1 4.23Å; R615-V617 PolarHBondContact O-N 2.61Å; V617-A620 PolarHBondContact O-N 3.18Å; V617-M621 HydrophobicContact CG2-CE 4.07Å; V617-M621 HydrophobicContact CG2-SD 4.44Å; V617-M621 WeakPolarHBondContact O-CG 3.37Å; V617-M621 PolarHBondContact O-N 2.87Å
618	E	95.7	Very high	95.5	Very high	39 Å²	39	47.6 Å²	47.6	18%	0.182	24%	0.235	C	C	.	.	H	α-helix	trans	-72.5	-41	179.8	-63	164.4	172.1	0	0	110.8	L614 R615 A616 A620 M621 I622 H671	L614-E618 HydrophobicContact CD1-CB 3.51Å; L614-E618 HydrophobicContact CG-CB 4.18Å; R615-E618 HydrophobicContact CB-CG 4.32Å; R615-E618 IonicContact CZ-OE1 2.92Å; R615-E618 VanDerWaalsContact CZ-OE1 3.22Å; R615-E618 PolarHBondContact N-OE2 2.84Å; R615-E618 IonicContact NE-OE1 3.22Å; R615-E618 PolarHBondContact NE-OE1 2.84Å; R615-E618 IonicContact NE-OE2 2.66Å; R615-E618 IonicContact NH2-OE1 3.41Å; R615-E618 PolarHBondContact NH2-OE1 3.45Å; R615-E618 PolarHBondContact O-N 2.86Å; A616-E618 VanDerWaalsContact C-N 3.33Å; A616-E618 PolarHBondContact O-N 2.9Å; E618-A620 VanDerWaalsContact C-N 3.31Å; E618-A620 PolarHBondContact O-N 2.83Å; E618-M621 PolarHBondContact O-N 3.25Å; E618-I622 WeakPolarHBondContact O-CD1 3.37Å; E618-I622 VanDerWaalsContact O-CG1 3.25Å; E618-I622 WeakPolarHBondContact O-CG1 3.42Å; E618-I622 PolarHBondContact O-N 2.95Å; E618-H671 IonicContact OE2-CE1 2.78Å; E618-H671 PolarHBondContact OE2-CE1 2.89Å; E618-H671 IonicContact OE2-ND1 3.62Å; E618-H671 PolarHBondContact OE2-ND1 3.37Å
619	L	96.8	Very high	95.3	Very high	0 Å²	0	48 Å²	48	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-60.4	-41.5	172.4	-178.5	59.6	0	0	0	111.5	L614 R615 A616 M623 A633 I635 V650 L669	L614-L619 HydrophobicContact CD2-CB 3.76Å; L614-L619 HydrophobicContact CD2-CD1 3.94Å; L614-L619 HydrophobicContact CD2-CG 4.36Å; L614-L619 HydrophobicContact CG-CB 4.38Å; R615-L619 PolarHBondContact O-N 2.89Å; A616-L619 PolarHBondContact O-N 2.82Å; L619-M623 HydrophobicContact CD1-CE 4.19Å; L619-M623 HydrophobicContact CD1-CG 4.19Å; L619-M623 WeakPolarHBondContact O-CB 3.44Å; L619-M623 WeakPolarHBondContact O-CG 3.21Å; L619-M623 PolarHBondContact O-N 2.76Å; L619-M623 VanDerWaalsContact O-N 3.09Å; L619-A633 HydrophobicContact CG-CB 4.49Å; L619-I635 HydrophobicContact CB-CD1 4.48Å; L619-I635 HydrophobicContact CD2-CD1 3.96Å; L619-V650 HydrophobicContact CD1-CG2 4.39Å; L619-V650 HydrophobicContact CD2-CG2 3.85Å; L619-V650 HydrophobicContact CG-CG2 3.81Å; L619-L669 HydrophobicContact CD1-CD1 3.96Å
620	A	96.4	Very high	95.3	Very high	0 Å²	0	46.2 Å²	46.2	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-62	-51.7	176.1	0	0	0	0	0	111.5	F591 M593 A616 V617 E618 I622 M623 D624 V630 A633	F591-A620 HydrophobicContact CD1-CB 3.67Å; F591-A620 HydrophobicContact CE1-CB 4.12Å; M593-A620 HydrophobicContact CE-CB 3.64Å; A616-A620 WeakPolarHBondContact O-CB 3.34Å; A616-A620 PolarHBondContact O-N 3.47Å; V617-A620 PolarHBondContact O-N 3.18Å; E618-A620 VanDerWaalsContact C-N 3.31Å; E618-A620 PolarHBondContact O-N 2.83Å; A620-I622 VanDerWaalsContact C-N 3.35Å; A620-I622 PolarHBondContact O-N 3.19Å; A620-M623 PolarHBondContact O-N 2.9Å; A620-D624 WeakPolarHBondContact O-CB 3.29Å; A620-D624 PolarHBondContact O-N 3.37Å; A620-V630 HydrophobicContact CB-CG1 4.18Å; A620-A633 HydrophobicContact CB-CB 3.71Å
621	M	95.7	Very high	95.3	Very high	116 Å²	116	46.1 Å²	46.1	57%	0.571	22%	0.219	S	C	*	.	H	α-helix	trans	-61.6	-38	-179.7	-74.4	-177.5	173.1	0	0	113.3	V617 E618 R625	V617-M621 HydrophobicContact CG2-CE 4.07Å; V617-M621 HydrophobicContact CG2-SD 4.44Å; V617-M621 WeakPolarHBondContact O-CG 3.37Å; V617-M621 PolarHBondContact O-N 2.87Å; E618-M621 PolarHBondContact O-N 3.25Å; M621-R625 WeakPolarHBondContact O-CB 3.21Å; M621-R625 PolarHBondContact O-N 2.78Å; M621-R625 VanDerWaalsContact O-N 3.12Å
622	I	95.3	Very high	95.4	Very high	40 Å²	40	47.8 Å²	47.8	21%	0.205	23%	0.226	C	C	.	.	H	α-helix	trans	-70	-45.2	177.7	-63.3	162.4	0	0	0	110.5	L614 E618 A620 R625 L626 L669	L614-I622 HydrophobicContact CD1-CD1 4.14Å; E618-I622 WeakPolarHBondContact O-CD1 3.37Å; E618-I622 VanDerWaalsContact O-CG1 3.25Å; E618-I622 WeakPolarHBondContact O-CG1 3.42Å; E618-I622 PolarHBondContact O-N 2.95Å; A620-I622 VanDerWaalsContact C-N 3.35Å; A620-I622 PolarHBondContact O-N 3.19Å; I622-R625 PolarHBondContact O-N 3.44Å; I622-L626 HydrophobicContact CG2-CD1 3.99Å; I622-L626 VanDerWaalsContact O-CG 3.29Å; I622-L626 WeakPolarHBondContact O-CG 3.36Å; I622-L626 PolarHBondContact O-N 3.47Å; I622-L669 HydrophobicContact CB-CD2 4.28Å; I622-L669 HydrophobicContact CD1-CD2 4.5Å; I622-L669 HydrophobicContact CG2-CD2 3.5Å; I622-L669 VanDerWaalsContact CG2-CD2 3.5Å
623	M	95.9	Very high	95.6	Very high	0 Å²	0	41.5 Å²	41.5	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-69	-34.3	179.8	-70.1	-61.6	-172.6	0	0	112.7	V607 L619 A620 L626 Y627 V630 V650 V667 L669 V680	V607-M623 HydrophobicContact CG1-CE 3.82Å; V607-M623 HydrophobicContact CG2-CE 3.91Å; L619-M623 HydrophobicContact CD1-CE 4.19Å; L619-M623 HydrophobicContact CD1-CG 4.19Å; L619-M623 WeakPolarHBondContact O-CB 3.44Å; L619-M623 WeakPolarHBondContact O-CG 3.21Å; L619-M623 PolarHBondContact O-N 2.76Å; L619-M623 VanDerWaalsContact O-N 3.09Å; A620-M623 PolarHBondContact O-N 2.9Å; M623-L626 PolarHBondContact O-N 2.79Å; M623-Y627 PolarHBondContact O-N 2.66Å; M623-Y627 HydrophobicContact SD-CD2 4.22Å; M623-Y627 HydrophobicContact SD-CE2 3.94Å; M623-V630 HydrophobicContact CB-CG2 3.97Å; M623-V650 HydrophobicContact CB-CG1 4.2Å; M623-V650 HydrophobicContact CG-CG1 4.47Å; M623-V650 HydrophobicContact CG-CG2 4.23Å; M623-V667 HydrophobicContact CE-CB 4.5Å; M623-V667 HydrophobicContact CE-CG1 4.38Å; M623-V667 HydrophobicContact SD-CG1 4.45Å; M623-L669 HydrophobicContact CE-CD2 4.19Å; M623-V680 HydrophobicContact CE-CG2 4.34Å
624	D	95.8	Very high	95.8	Very high	54 Å²	54	39.8 Å²	39.8	29%	0.289	19%	0.191	S	C	.	.	H	α-helix	trans	-68.1	-41.5	175.4	-165.2	69.3	0	0	0	111.7	M593 A620 L626 Y627 G628 G629 V630	M593-D624 HydrophobicContact CE-CB 3.93Å; M593-D624 HydrophobicContact SD-CB 4.41Å; A620-D624 WeakPolarHBondContact O-CB 3.29Å; A620-D624 PolarHBondContact O-N 3.37Å; D624-L626 PolarHBondContact O-N 3.03Å; D624-L626 VanDerWaalsContact O-N 3.16Å; D624-Y627 PolarHBondContact O-N 3.41Å; D624-G628 WeakPolarHBondContact O-CA 2.98Å; D624-G628 PolarHBondContact O-N 2.72Å; D624-G628 WeakPolarHBondContact OD1-CA 3.22Å; D624-G629 PolarHBondContact OD1-N 2.8Å; D624-V630 HydrophobicContact CB-CB 4.01Å; D624-V630 HydrophobicContact CB-CG2 3.89Å; D624-V630 PolarHBondContact OD1-N 3Å
625	R	95.4	Very high	95.9	Very high	226 Å²	226	40 Å²	40	85%	0.853	19%	0.192	S	C	*	.	H	α-helix	trans	-59.2	-27.6	172.4	-174.8	178.7	-65.9	-178.3	0.3	113.3	M621 I622	M621-R625 WeakPolarHBondContact O-CB 3.21Å; M621-R625 PolarHBondContact O-N 2.78Å; M621-R625 VanDerWaalsContact O-N 3.12Å; I622-R625 PolarHBondContact O-N 3.44Å
626	L	95	Very high	95.9	Very high	89 Å²	89	37.1 Å²	37.1	47%	0.466	18%	0.184	S	C	.	.	H	α-helix	trans	-91.5	-33.4	-177.5	-69.7	170.4	0	0	0	114.1	I622 M623 D624 V667	I622-L626 HydrophobicContact CG2-CD1 3.99Å; I622-L626 VanDerWaalsContact O-CG 3.29Å; I622-L626 WeakPolarHBondContact O-CG 3.36Å; I622-L626 PolarHBondContact O-N 3.47Å; M623-L626 PolarHBondContact O-N 2.79Å; D624-L626 PolarHBondContact O-N 3.03Å; D624-L626 VanDerWaalsContact O-N 3.16Å; L626-V667 HydrophobicContact CD1-CG1 3.47Å; L626-V667 VanDerWaalsContact CD1-CG1 3.47Å
627	Y	96.3	Very high	95.8	Very high	49 Å²	49	39 Å²	39	19%	0.192	20%	0.195	C	C	.	.	H	α-helix	trans	-133.1	-15.3	-170.9	-56.9	-66	0	0	0	115	M623 D624 F652 S657 A660 A661 A664 V667	M623-Y627 PolarHBondContact O-N 2.66Å; M623-Y627 HydrophobicContact SD-CD2 4.22Å; M623-Y627 HydrophobicContact SD-CE2 3.94Å; D624-Y627 PolarHBondContact O-N 3.41Å; Y627-F652 HydrophobicContact CD2-CZ 4.33Å; Y627-S657 VanDerWaalsContact O-CB 3.31Å; Y627-S657 WeakPolarHBondContact O-CB 3.39Å; Y627-S657 PolarHBondContact O-OG 2.84Å; Y627-A660 HydrophobicContact CD1-CB 3.78Å; Y627-A660 HydrophobicContact CE1-CB 4.28Å; Y627-A661 HydrophobicContact CD1-CB 4.32Å; Y627-A661 HydrophobicContact CD2-CB 3.85Å; Y627-A661 HydrophobicContact CE1-CB 4.32Å; Y627-A661 HydrophobicContact CE2-CB 3.85Å; Y627-A661 HydrophobicContact CG-CB 4.1Å; Y627-A664 WeakPolarHBondContact OH-CB 3.43Å; Y627-V667 HydrophobicContact CE2-CG2 4.21Å; Y627-V667 WeakPolarHBondContact OH-CG2 3.19Å
628	G	94.8	Very high	95.7	Very high	25 Å²	25	39.5 Å²	39.5	26%	0.258	20%	0.197	S	C	.	.	S	Bend	trans	64.9	161.4	-175.2	0	0	0	0	0	114.8	D624 V630 S657	D624-G628 WeakPolarHBondContact O-CA 2.98Å; D624-G628 PolarHBondContact O-N 2.72Å; D624-G628 WeakPolarHBondContact OD1-CA 3.22Å; G628-V630 PolarHBondContact O-N 3.31Å; G628-S657 WeakPolarHBondContact O-CB 3.36Å; G628-S657 PolarHBondContact O-OG 3.07Å
629	G	93.2	Very high	95.5	Very high	22 Å²	22	42.1 Å²	42.1	23%	0.227	22%	0.217	C	C	.	.			trans	68	31.8	171.6	0	0	0	0	0	114.6	D624 C631 F652 S653	D624-G629 PolarHBondContact OD1-N 2.8Å; G629-C631 PolarHBondContact O-N 3.38Å; G629-F652 CarbonylContact O-C 3.55Å; G629-F652 VanDerWaalsContact O-CA 3.26Å; G629-F652 WeakPolarHBondContact O-CA 3.47Å; G629-S653 PolarHBondContact O-N 3.3Å; G629-S653 PolarHBondContact O-OG 3.05Å
630	V	95.6	Very high	95.2	Very high	6 Å²	6	48.5 Å²	48.5	4%	0.036	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-73.3	121.2	168.5	175.2	0	0	0	0	109	M593 A620 M623 D624 G628 V650 F652	M593-V630 HydrophobicContact CE-CB 4.02Å; M593-V630 HydrophobicContact CE-CG1 4.07Å; A620-V630 HydrophobicContact CB-CG1 4.18Å; M623-V630 HydrophobicContact CB-CG2 3.97Å; D624-V630 HydrophobicContact CB-CB 4.01Å; D624-V630 HydrophobicContact CB-CG2 3.89Å; D624-V630 PolarHBondContact OD1-N 3Å; G628-V630 PolarHBondContact O-N 3.31Å; V630-V650 HydrophobicContact CB-CG1 4.41Å; V630-V650 HydrophobicContact CG1-CG1 3.63Å; V630-V650 HydrophobicContact CG2-CG1 3.88Å; V630-F652 HydrophobicContact CG2-CD1 3.86Å; V630-F652 HydrophobicContact CG2-CE1 3.49Å; V630-F652 VanDerWaalsContact CG2-CE1 3.49Å; V630-F652 HydrophobicContact CG2-CZ 4.28Å
631	C	95.2	Very high	95	Very high	3 Å²	3	49.9 Å²	49.9	2%	0.02	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-29.7	173.4	51.3	0	0	0	0	112.6	M593 D594 L599 G629 A651	M593-C631 PolarHBondContact N-O 2.92Å; D594-C631 PolarHBondContact N-O 3.01Å; L599-C631 HydrophobicContact CD2-CB 3.91Å; L599-C631 WeakPolarHBondContact CD2-SG 3.32Å; G629-C631 PolarHBondContact O-N 3.38Å; C631-A651 PolarHBondContact N-O 3.38Å; C631-A651 PolarHBondContact SG-O 2.95Å
632	Y	96.4	Very high	94.9	Very high	38 Å²	38	49 Å²	49	15%	0.149	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149	145.8	-177	170.7	-98.6	0	0	0	112.2	D590 F591 V592 L599 R649 V650 A651	D590-Y632 HydrophobicContact CB-CE2 3.89Å; D590-Y632 WeakPolarHBondContact CB-OH 3.36Å; F591-Y632 WeakPolarHBondContact O-CA 3.08Å; F591-Y632 VanDerWaalsContact O-CD2 3.23Å; F591-Y632 WeakPolarHBondContact O-CD2 3.27Å; V592-Y632 HydrophobicContact CG2-CD2 3.88Å; V592-Y632 HydrophobicContact CG2-CE2 4.44Å; L599-Y632 HydrophobicContact CD1-CD1 4.37Å; L599-Y632 HydrophobicContact CD1-CD2 4.08Å; L599-Y632 HydrophobicContact CD1-CG 3.83Å; Y632-R649 HydrophobicContact CE1-CG 4.22Å; Y632-R649 PolarHBondContact OH-NH2 2.75Å; Y632-V650 CarbonylContact O-C 3.54Å; Y632-V650 WeakPolarHBondContact O-CA 3.37Å; Y632-A651 HydrophobicContact CD1-CB 4.47Å; Y632-A651 PolarHBondContact N-O 2.86Å; Y632-A651 PolarHBondContact O-N 3.25Å
633	A	97.1	Very high	94.9	Very high	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	153.9	162.4	0	0	0	0	0	110.9	F591 A616 L619 A620 R649 V650	F591-A633 PolarHBondContact N-O 3.47Å; F591-A633 PolarHBondContact O-N 3.02Å; A616-A633 WeakPolarHBondContact O-CB 3.31Å; L619-A633 HydrophobicContact CG-CB 4.49Å; A620-A633 HydrophobicContact CB-CB 3.71Å; A633-R649 CarbonylContact C-O 3.47Å; A633-R649 WeakPolarHBondContact CA-O 3.47Å; A633-V650 HydrophobicContact CB-CG2 4.03Å
634	G	96.8	Very high	94.9	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	148	171.1	0	0	0	0	0	111.8	S589 G648 R649	S589-G634 CarbonylContact O-C 3.5Å; S589-G634 WeakPolarHBondContact O-CA 3.25Å; G634-G648 CarbonylContact O-C 3.57Å; G634-G648 WeakPolarHBondContact O-CA 3.46Å; G634-R649 PolarHBondContact N-O 2.85Å; G634-R649 PolarHBondContact O-N 2.81Å
635	I	97.8	Very high	94.8	Very high	4 Å²	4	50.3 Å²	50.3	2%	0.021	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	139.2	172.7	-55	-57.3	0	0	0	108.3	W584 S589 V610 L614 A616 L619 T637 P644 R649	W584-I635 HydrophobicContact CH2-CB 4.48Å; W584-I635 HydrophobicContact CH2-CG1 4.12Å; W584-I635 HydrophobicContact CH2-CG2 4.33Å; W584-I635 HydrophobicContact CZ2-CB 4.26Å; W584-I635 HydrophobicContact CZ2-CG1 4.29Å; W584-I635 HydrophobicContact CZ2-CG2 4.25Å; S589-I635 PolarHBondContact O-N 3.29Å; V610-I635 HydrophobicContact CG1-CD1 4.46Å; L614-I635 WeakPolarHBondContact O-CD1 3.3Å; A616-I635 HydrophobicContact CB-CG1 4.21Å; L619-I635 HydrophobicContact CB-CD1 4.48Å; L619-I635 HydrophobicContact CD2-CD1 3.96Å; I635-T637 PolarHBondContact O-N 2.85Å; I635-P644 HydrophobicContact CG2-CB 3.75Å; I635-R649 VanDerWaalsContact C-NH1 3.34Å; I635-R649 PolarHBondContact O-NH1 3.43Å
636	D	95.8	Very high	94.8	Very high	38 Å²	38	40.3 Å²	40.3	20%	0.203	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	104.6	177.5	-77.5	4.4	0	0	0	108.8	F606 K645 A647 R649	F606-D636 WeakPolarHBondContact CE2-OD2 3.49Å; D636-K645 WeakPolarHBondContact O-CB 3.48Å; D636-K645 PolarHBondContact O-N 3.26Å; D636-A647 HydrophobicContact CB-CB 4.2Å; D636-A647 PolarHBondContact N-O 2.73Å; D636-R649 IonicContact OD1-CZ 3.87Å; D636-R649 IonicContact OD1-NH1 2.79Å; D636-R649 PolarHBondContact OD1-NH1 2.68Å
637	T	95.4	Very high	94.9	Very high	39 Å²	39	36.7 Å²	36.7	24%	0.239	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	168.6	-177.9	56.6	0	0	0	0	112.2	I635 K642 Y643	I635-T637 PolarHBondContact O-N 2.85Å; T637-K642 WeakPolarHBondContact CB-O 3.2Å; T637-K642 WeakPolarHBondContact CG2-O 3.29Å; T637-Y643 CarbonylContact C-O 3.59Å; T637-Y643 VanDerWaalsContact CA-O 3.29Å; T637-Y643 WeakPolarHBondContact CA-O 3.48Å
638	D	93	Very high	94.9	Very high	42 Å²	42	34.3 Å²	34.3	23%	0.225	19%	0.189	C	C	.	.			trans	-74.5	135.7	170.6	-170	-94.6	0	0	0	112.9	E640 L641 K642 Y643 K645	D638-E640 VanDerWaalsContact C-N 3.28Å; D638-E640 PolarHBondContact O-N 3.13Å; D638-E640 WeakPolarHBondContact OD1-CB 3.17Å; D638-E640 PolarHBondContact OD1-N 3.29Å; D638-L641 HydrophobicContact CB-CB 4.43Å; D638-L641 PolarHBondContact OD1-N 3.29Å; D638-K642 WeakPolarHBondContact O-CA 3.45Å; D638-K642 WeakPolarHBondContact O-CD 3.48Å; D638-K642 PolarHBondContact O-N 3.17Å; D638-Y643 PolarHBondContact N-O 2.85Å; D638-K645 WeakPolarHBondContact OD2-CE 3.44Å; D638-K645 IonicContact OD2-NZ 2.66Å; D638-K645 PolarHBondContact OD2-NZ 2.92Å
639	P	91.2	Very high	95	Very high	94 Å²	94	35.7 Å²	35.7	61%	0.61	19%	0.186	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	-35.9	178.5	-28.7	36.5	0	0	0	115.2	K642	P639-K642 WeakPolarHBondContact O-CE 3.14Å; P639-K642 PolarHBondContact O-NZ 2.81Å
640	E	91	Very high	95.1	Very high	133 Å²	133	34.6 Å²	34.6	62%	0.621	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-95.1	-40.6	-172.3	-176.8	-174.3	167.9	0	0	112.8	R495 D638	R495-E640 PolarHBondContact NH2-O 3.23Å; D638-E640 VanDerWaalsContact C-N 3.28Å; D638-E640 PolarHBondContact O-N 3.13Å; D638-E640 WeakPolarHBondContact OD1-CB 3.17Å; D638-E640 PolarHBondContact OD1-N 3.29Å
641	L	91.9	Very high	95.2	Very high	30 Å²	30	34.4 Å²	34.4	16%	0.157	17%	0.174	C	C	.	.	T	Hydrogen-bonded Turn	trans	-101.1	-11.9	-176.8	-62.6	176.7	0	0	0	113.7	S494 R495 K496 L544 D638 Y643	S494-L641 PolarHBondContact OG-O 3.27Å; R495-L641 HydrophobicContact CB-CD2 4.49Å; K496-L641 HydrophobicContact CB-CB 4.4Å; K496-L641 HydrophobicContact CB-CD1 4.3Å; K496-L641 HydrophobicContact CD-CD1 4.11Å; L544-L641 HydrophobicContact CD2-CD1 3.83Å; L544-L641 HydrophobicContact CG-CD1 4.34Å; D638-L641 HydrophobicContact CB-CB 4.43Å; D638-L641 PolarHBondContact OD1-N 3.29Å; L641-Y643 PolarHBondContact O-N 2.99Å; L641-Y643 VanDerWaalsContact O-N 3.13Å
642	K	93.8	Very high	95.2	Very high	98 Å²	98	34.3 Å²	34.3	43%	0.426	17%	0.174	S	C	.	.			trans	54.7	22.6	-173.6	-52.2	-51.3	-170.1	-160.8	0	114.9	L586 T637 D638 P639	L586-K642 HydrophobicContact CD2-CB 3.57Å; L586-K642 HydrophobicContact CD2-CG 4.43Å; T637-K642 WeakPolarHBondContact CB-O 3.2Å; T637-K642 WeakPolarHBondContact CG2-O 3.29Å; D638-K642 WeakPolarHBondContact O-CA 3.45Å; D638-K642 WeakPolarHBondContact O-CD 3.48Å; D638-K642 PolarHBondContact O-N 3.17Å; P639-K642 WeakPolarHBondContact O-CE 3.14Å; P639-K642 PolarHBondContact O-NZ 2.81Å
643	Y	95.4	Very high	95.1	Very high	31 Å²	31	34.5 Å²	34.5	12%	0.122	18%	0.18	C	C	.	.			trans	-90.4	142.2	-178.3	-165.4	-93.9	0	0	0	112.4	K496 F542 W584 T637 D638 L641 K645	K496-Y643 HydrophobicContact CB-CD2 3.73Å; K496-Y643 HydrophobicContact CB-CE2 4.44Å; K496-Y643 HydrophobicContact CB-CG 4Å; K496-Y643 HydrophobicContact CD-CD1 4.1Å; K496-Y643 HydrophobicContact CD-CD2 4.31Å; K496-Y643 HydrophobicContact CD-CG 3.95Å; K496-Y643 HydrophobicContact CG-CD2 4.04Å; K496-Y643 HydrophobicContact CG-CE2 4.38Å; K496-Y643 HydrophobicContact CG-CG 4.19Å; K496-Y643 WeakPolarHBondContact O-CD2 3.14Å; K496-Y643 VanDerWaalsContact O-CE2 3.23Å; K496-Y643 WeakPolarHBondContact O-CE2 3.44Å; F542-Y643 HydrophobicContact CE1-CE1 4.29Å; W584-Y643 HydrophobicContact CB-CD2 4.13Å; W584-Y643 HydrophobicContact CB-CE2 4.16Å; T637-Y643 CarbonylContact C-O 3.59Å; T637-Y643 VanDerWaalsContact CA-O 3.29Å; T637-Y643 WeakPolarHBondContact CA-O 3.48Å; D638-Y643 PolarHBondContact N-O 2.85Å; L641-Y643 PolarHBondContact O-N 2.99Å; L641-Y643 VanDerWaalsContact O-N 3.13Å; Y643-K645 PolarHBondContact O-N 2.88Å
644	P	96.2	Very high	94.9	Very high	3 Å²	3	38.6 Å²	38.6	2%	0.019	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65.5	127.7	-175	26	-38.1	0	0	0	113.8	W584 R612 I635	W584-P644 HydrophobicContact CD2-CB 4.46Å; W584-P644 VanDerWaalsContact CD2-CD 3.48Å; W584-P644 HydrophobicContact CD2-CG 3.72Å; W584-P644 HydrophobicContact CE3-CB 4.46Å; W584-P644 HydrophobicContact CE3-CG 3.65Å; W584-P644 HydrophobicContact CG-CG 4.24Å; W584-P644 HydrophobicContact CH2-CB 4.3Å; W584-P644 HydrophobicContact CH2-CG 4.35Å; W584-P644 HydrophobicContact CZ2-CB 4.31Å; W584-P644 HydrophobicContact CZ2-CG 4.42Å; W584-P644 HydrophobicContact CZ3-CB 4.38Å; W584-P644 HydrophobicContact CZ3-CG 3.98Å; R612-P644 HydrophobicContact CB-CG 4.4Å; R612-P644 WeakPolarHBondContact CD-O 3.29Å; R612-P644 PolarHBondContact NE-O 2.8Å; I635-P644 HydrophobicContact CG2-CB 3.75Å
645	K	94.3	Very high	94.7	Very high	87 Å²	87	43 Å²	43	38%	0.378	22%	0.223	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-21.7	-178.2	-72.4	-177.7	163.7	165.8	0	114.1	R612 D636 D638 Y643	R612-K645 PolarHBondContact NE-O 3.48Å; R612-K645 PolarHBondContact NH2-O 2.89Å; D636-K645 WeakPolarHBondContact O-CB 3.48Å; D636-K645 PolarHBondContact O-N 3.26Å; D638-K645 WeakPolarHBondContact OD2-CE 3.44Å; D638-K645 IonicContact OD2-NZ 2.66Å; D638-K645 PolarHBondContact OD2-NZ 2.92Å; Y643-K645 PolarHBondContact O-N 2.88Å
646	G	94.5	Very high	94.7	Very high	15 Å²	15	49.7 Å²	49.7	16%	0.155	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	97.4	33	-170.3	0	0	0	0	0	112.7	G609 V610	G609-G646 CarbonylContact C-O 3.47Å; G609-G646 WeakPolarHBondContact CA-O 3.23Å; G609-G646 PolarHBondContact N-O 3.45Å; V610-G646 PolarHBondContact N-O 3.15Å; V610-G646 CarbonylContact O-C 3.55Å; V610-G646 WeakPolarHBondContact O-CA 3.37Å
647	A	96.5	Very high	94.7	Very high	13 Å²	13	48.4 Å²	48.4	11%	0.107	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	169.4	172.3	0	0	0	0	0	108.8	F606 V607 D636	F606-A647 HydrophobicContact CE2-CB 3.75Å; F606-A647 HydrophobicContact CZ-CB 3.63Å; V607-A647 CarbonylContact O-C 3.54Å; V607-A647 WeakPolarHBondContact O-CA 3.36Å; V607-A647 WeakPolarHBondContact O-CB 3.5Å; D636-A647 HydrophobicContact CB-CB 4.2Å; D636-A647 PolarHBondContact N-O 2.73Å
648	G	96.8	Very high	94.7	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.4	-177.4	174.5	0	0	0	0	0	112.1	V607 G634	V607-G648 PolarHBondContact N-O 2.88Å; V607-G648 PolarHBondContact O-N 3.3Å; G634-G648 CarbonylContact O-C 3.57Å; G634-G648 WeakPolarHBondContact O-CA 3.46Å
649	R	96.5	Very high	94.9	Very high	53 Å²	53	47 Å²	47	20%	0.2	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.5	141.3	-177.6	63.2	-161.3	174.1	-78.2	-11.7	109.4	T604 I605 Y632 A633 G634 I635 D636 Y683	T604-R649 HydrophobicContact CG2-CB 4.1Å; I605-R649 CarbonylContact O-C 3.47Å; I605-R649 VanDerWaalsContact O-CA 3.23Å; I605-R649 WeakPolarHBondContact O-CA 3.42Å; Y632-R649 HydrophobicContact CE1-CG 4.22Å; Y632-R649 PolarHBondContact OH-NH2 2.75Å; A633-R649 CarbonylContact C-O 3.47Å; A633-R649 WeakPolarHBondContact CA-O 3.47Å; G634-R649 PolarHBondContact N-O 2.85Å; G634-R649 PolarHBondContact O-N 2.81Å; I635-R649 VanDerWaalsContact C-NH1 3.34Å; I635-R649 PolarHBondContact O-NH1 3.43Å; D636-R649 IonicContact OD1-CZ 3.87Å; D636-R649 IonicContact OD1-NH1 2.79Å; D636-R649 PolarHBondContact OD1-NH1 2.68Å; R649-Y683 HydrophobicContact CB-CD2 4.44Å; R649-Y683 HydrophobicContact CB-CE2 4.46Å
650	V	97.1	Very high	95.1	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	128.6	-179.7	-177.1	0	0	0	0	108.7	T604 I605 V607 L619 M623 V630 Y632 A633 F652	T604-V650 CarbonylContact C-O 3.51Å; T604-V650 WeakPolarHBondContact CA-O 3.37Å; I605-V650 HydrophobicContact CD1-CB 4.22Å; I605-V650 HydrophobicContact CG1-CB 3.84Å; I605-V650 WeakPolarHBondContact CG1-O 3.4Å; I605-V650 PolarHBondContact N-O 3.49Å; I605-V650 PolarHBondContact O-N 2.91Å; V607-V650 HydrophobicContact CG2-CG2 4.11Å; L619-V650 HydrophobicContact CD1-CG2 4.39Å; L619-V650 HydrophobicContact CD2-CG2 3.85Å; L619-V650 HydrophobicContact CG-CG2 3.81Å; M623-V650 HydrophobicContact CB-CG1 4.2Å; M623-V650 HydrophobicContact CG-CG1 4.47Å; M623-V650 HydrophobicContact CG-CG2 4.23Å; V630-V650 HydrophobicContact CB-CG1 4.41Å; V630-V650 HydrophobicContact CG1-CG1 3.63Å; V630-V650 HydrophobicContact CG2-CG1 3.88Å; Y632-V650 CarbonylContact O-C 3.54Å; Y632-V650 WeakPolarHBondContact O-CA 3.37Å; A633-V650 HydrophobicContact CB-CG2 4.03Å; V650-F652 HydrophobicContact CG1-CE2 4.46Å; V650-F652 HydrophobicContact CG1-CZ 4.31Å
651	A	96.3	Very high	95.4	Very high	1 Å²	1	38 Å²	38	1%	0.008	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.8	139	179	0	0	0	0	0	110.7	T604 C631 Y632	T604-A651 WeakPolarHBondContact OG1-CB 3.28Å; C631-A651 PolarHBondContact N-O 3.38Å; C631-A651 PolarHBondContact SG-O 2.95Å; Y632-A651 HydrophobicContact CD1-CB 4.47Å; Y632-A651 PolarHBondContact N-O 2.86Å; Y632-A651 PolarHBondContact O-N 3.25Å
652	F	95.8	Very high	95.6	Very high	1 Å²	1	37 Å²	37	0%	0.004	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	141.1	177.6	-61.5	-86.2	0	0	0	110.9	K603 I605 Y627 G629 V630 V650 N654 S657 A661	K603-F652 VanDerWaalsContact CB-O 3.29Å; K603-F652 WeakPolarHBondContact CB-O 3.39Å; K603-F652 WeakPolarHBondContact CD-O 3.35Å; K603-F652 PolarHBondContact O-N 3.36Å; I605-F652 HydrophobicContact CD1-CE2 3.88Å; I605-F652 HydrophobicContact CD1-CZ 4.2Å; I605-F652 HydrophobicContact CG1-CE2 4Å; I605-F652 HydrophobicContact CG2-CD2 4.39Å; I605-F652 HydrophobicContact CG2-CE2 3.86Å; Y627-F652 HydrophobicContact CD2-CZ 4.33Å; G629-F652 CarbonylContact O-C 3.55Å; G629-F652 VanDerWaalsContact O-CA 3.26Å; G629-F652 WeakPolarHBondContact O-CA 3.47Å; V630-F652 HydrophobicContact CG2-CD1 3.86Å; V630-F652 HydrophobicContact CG2-CE1 3.49Å; V630-F652 VanDerWaalsContact CG2-CE1 3.49Å; V630-F652 HydrophobicContact CG2-CZ 4.28Å; V650-F652 HydrophobicContact CG1-CE2 4.46Å; V650-F652 HydrophobicContact CG1-CZ 4.31Å; F652-N654 VanDerWaalsContact C-N 3.31Å; F652-S657 VanDerWaalsContact CD1-CB 3.5Å; F652-A661 HydrophobicContact CE2-CB 3.97Å; F652-A661 HydrophobicContact CZ-CB 3.9Å
653	S	94	Very high	95.6	Very high	42 Å²	42	35.1 Å²	35.1	29%	0.294	19%	0.189	S	C	.	.	S	Bend	trans	-65.9	-39.7	166	56.2	0	0	0	0	110.7	K603 G629	K603-S653 WeakPolarHBondContact CD-O 3.45Å; K603-S653 PolarHBondContact NZ-O 2.97Å; G629-S653 PolarHBondContact O-N 3.3Å; G629-S653 PolarHBondContact O-OG 3.05Å
654	N	92.3	Very high	95.6	Very high	86 Å²	86	35.9 Å²	35.9	46%	0.46	20%	0.201	S	C	.	.			trans	-95.6	128.2	-171.7	-67.2	-35	0	0	0	113.2	F652 Q656 S657 Y658	F652-N654 VanDerWaalsContact C-N 3.31Å; N654-Q656 PolarHBondContact O-N 2.93Å; N654-S657 PolarHBondContact O-N 2.81Å; N654-Y658 PolarHBondContact O-N 3.29Å
655	Q	94.2	Very high	95.5	Very high	93 Å²	93	43.3 Å²	43.3	44%	0.435	23%	0.229	S	C	.	.	H	α-helix	trans	-59.5	-34.9	174.5	-170.4	65.8	17.2	0	0	112.3	I659	Q655-I659 HydrophobicContact CG-CD1 3.96Å; Q655-I659 WeakPolarHBondContact O-CB 3.48Å; Q655-I659 VanDerWaalsContact O-CG1 3.32Å; Q655-I659 WeakPolarHBondContact O-CG1 3.18Å; Q655-I659 PolarHBondContact O-N 3.36Å
656	Q	96	Very high	95.6	Very high	145 Å²	145	43.2 Å²	43.2	68%	0.678	23%	0.229	S	C	*	.	H	α-helix	trans	-65.1	-43.1	-179.9	-172.3	66.1	6.3	0	0	112	N654 I659 A660	N654-Q656 PolarHBondContact O-N 2.93Å; Q656-I659 PolarHBondContact O-N 3.1Å; Q656-A660 WeakPolarHBondContact O-CB 3.15Å; Q656-A660 PolarHBondContact O-N 3.46Å
657	S	96	Very high	95.6	Very high	11 Å²	11	43 Å²	43	8%	0.077	22%	0.224	C	C	.	.	H	α-helix	trans	-67.5	-42.4	178.8	-54.7	0	0	0	0	111.8	Y627 G628 F652 N654 A660 A661	Y627-S657 VanDerWaalsContact O-CB 3.31Å; Y627-S657 WeakPolarHBondContact O-CB 3.39Å; Y627-S657 PolarHBondContact O-OG 2.84Å; G628-S657 WeakPolarHBondContact O-CB 3.36Å; G628-S657 PolarHBondContact O-OG 3.07Å; F652-S657 VanDerWaalsContact CD1-CB 3.5Å; N654-S657 PolarHBondContact O-N 2.81Å; S657-A660 PolarHBondContact O-N 3.45Å; S657-A661 PolarHBondContact O-N 2.97Å
658	Y	96.6	Very high	95.4	Very high	5 Å²	5	46.6 Å²	46.6	2%	0.02	24%	0.239	C	C	.	.	H	α-helix	trans	-56	-50.5	170.2	168.4	-111.6	0	0	0	111.7	K603 I605 N654 A660 A661 I662 L713	K603-Y658 HydrophobicContact CB-CG 4.45Å; K603-Y658 WeakPolarHBondContact O-CD2 3.24Å; I605-Y658 HydrophobicContact CG2-CD2 3.61Å; I605-Y658 HydrophobicContact CG2-CE2 3.85Å; N654-Y658 PolarHBondContact O-N 3.29Å; Y658-A660 PolarHBondContact O-N 2.8Å; Y658-A661 PolarHBondContact O-N 3.39Å; Y658-I662 HydrophobicContact CD2-CG1 4.18Å; Y658-I662 HydrophobicContact CE2-CD1 4.27Å; Y658-I662 HydrophobicContact CE2-CG1 3.81Å; Y658-I662 WeakPolarHBondContact O-CG1 3.25Å; Y658-I662 PolarHBondContact O-N 3.34Å; Y658-L713 HydrophobicContact CE1-CD1 3.96Å
659	I	95.9	Very high	95.2	Very high	46 Å²	46	46.6 Å²	46.6	24%	0.236	24%	0.239	C	C	.	.	H	α-helix	trans	-61.1	-41.6	177.7	-74.4	170.7	0	0	0	111.7	Q655 Q656 I662 S663 V710 L713	Q655-I659 HydrophobicContact CG-CD1 3.96Å; Q655-I659 WeakPolarHBondContact O-CB 3.48Å; Q655-I659 VanDerWaalsContact O-CG1 3.32Å; Q655-I659 WeakPolarHBondContact O-CG1 3.18Å; Q655-I659 PolarHBondContact O-N 3.36Å; Q656-I659 PolarHBondContact O-N 3.1Å; I659-I662 PolarHBondContact O-N 3.25Å; I659-S663 VanDerWaalsContact O-CB 3.28Å; I659-S663 WeakPolarHBondContact O-CB 3.41Å; I659-S663 PolarHBondContact O-N 3.35Å; I659-S663 PolarHBondContact O-OG 3.37Å; I659-V710 HydrophobicContact CG2-CG1 3.94Å; I659-L713 HydrophobicContact CG1-CD1 3.94Å
660	A	96.4	Very high	94.8	Very high	39 Å²	39	51 Å²	51	32%	0.322	26%	0.262	S	S	.	.	H	α-helix	trans	-63	-45.3	178.4	0	0	0	0	0	112	Y627 Q656 S657 Y658 S663 A664	Y627-A660 HydrophobicContact CD1-CB 3.78Å; Y627-A660 HydrophobicContact CE1-CB 4.28Å; Q656-A660 WeakPolarHBondContact O-CB 3.15Å; Q656-A660 PolarHBondContact O-N 3.46Å; S657-A660 PolarHBondContact O-N 3.45Å; Y658-A660 PolarHBondContact O-N 2.8Å; A660-S663 PolarHBondContact O-N 2.77Å; A660-A664 PolarHBondContact O-N 2.89Å; A660-A664 VanDerWaalsContact O-N 3.1Å
661	A	96.3	Very high	94.3	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-63.2	-44.6	177.6	0	0	0	0	0	112.4	I605 Y627 F652 S657 Y658 S663 A664 V680	I605-A661 HydrophobicContact CD1-CB 4.04Å; I605-A661 HydrophobicContact CG2-CB 4.35Å; Y627-A661 HydrophobicContact CD1-CB 4.32Å; Y627-A661 HydrophobicContact CD2-CB 3.85Å; Y627-A661 HydrophobicContact CE1-CB 4.32Å; Y627-A661 HydrophobicContact CE2-CB 3.85Å; Y627-A661 HydrophobicContact CG-CB 4.1Å; F652-A661 HydrophobicContact CE2-CB 3.97Å; F652-A661 HydrophobicContact CZ-CB 3.9Å; S657-A661 PolarHBondContact O-N 2.97Å; Y658-A661 PolarHBondContact O-N 3.39Å; A661-S663 VanDerWaalsContact C-N 3.32Å; A661-S663 PolarHBondContact O-N 3.15Å; A661-A664 PolarHBondContact O-N 2.74Å; A661-V680 HydrophobicContact CB-CG1 4.45Å; A661-V680 WeakPolarHBondContact O-CG1 3.38Å
662	I	95.8	Very high	93.8	Very high	7 Å²	7	56.1 Å²	56.1	4%	0.036	30%	0.304	C	S	.	.	H	α-helix	trans	-64.6	-36.2	174.8	-63.4	-47.8	0	0	0	112.1	I605 Y658 I659 A664 R665 V680 K681 P682 V710 L713	I605-I662 HydrophobicContact CB-CD1 4.08Å; I605-I662 HydrophobicContact CG2-CD1 3.45Å; I605-I662 VanDerWaalsContact CG2-CD1 3.45Å; I605-I662 HydrophobicContact CG2-CG1 4.02Å; Y658-I662 HydrophobicContact CD2-CG1 4.18Å; Y658-I662 HydrophobicContact CE2-CD1 4.27Å; Y658-I662 HydrophobicContact CE2-CG1 3.81Å; Y658-I662 WeakPolarHBondContact O-CG1 3.25Å; Y658-I662 PolarHBondContact O-N 3.34Å; I659-I662 PolarHBondContact O-N 3.25Å; I662-A664 VanDerWaalsContact C-N 3.33Å; I662-A664 PolarHBondContact O-N 2.87Å; I662-R665 WeakPolarHBondContact O-CG 3.32Å; I662-R665 PolarHBondContact O-N 3.34Å; I662-V680 HydrophobicContact CD1-CG1 3.92Å; I662-K681 WeakPolarHBondContact CD1-O 3.34Å; I662-P682 HydrophobicContact CD1-CB 4.36Å; I662-P682 HydrophobicContact CD1-CG 3.85Å; I662-P682 VanDerWaalsContact CD1-N 3.29Å; I662-P682 HydrophobicContact CG1-CG 4.11Å; I662-P682 HydrophobicContact CG2-CG 3.91Å; I662-V710 HydrophobicContact CG2-CG2 4.16Å; I662-L713 HydrophobicContact CG2-CD2 4.12Å
663	S	95.2	Very high	93.4	Very high	60 Å²	60	65.1 Å²	65.1	42%	0.42	35%	0.346	S	S	.	.	H	α-helix	trans	-66	-34.6	178.9	-61.2	0	0	0	0	112.5	I659 A660 A661	I659-S663 VanDerWaalsContact O-CB 3.28Å; I659-S663 WeakPolarHBondContact O-CB 3.41Å; I659-S663 PolarHBondContact O-N 3.35Å; I659-S663 PolarHBondContact O-OG 3.37Å; A660-S663 PolarHBondContact O-N 2.77Å; A661-S663 VanDerWaalsContact C-N 3.32Å; A661-S663 PolarHBondContact O-N 3.15Å
664	A	94.7	Very high	93.1	Very high	46 Å²	46	65.3 Å²	65.3	38%	0.38	34%	0.343	S	S	.	.	H	α-helix	trans	-65.7	-36	176.9	0	0	0	0	0	113	Y627 A660 A661 I662 F666	Y627-A664 WeakPolarHBondContact OH-CB 3.43Å; A660-A664 PolarHBondContact O-N 2.89Å; A660-A664 VanDerWaalsContact O-N 3.1Å; A661-A664 PolarHBondContact O-N 2.74Å; I662-A664 VanDerWaalsContact C-N 3.33Å; I662-A664 PolarHBondContact O-N 2.87Å; A664-F666 PolarHBondContact O-N 3.24Å
665	R	93.9	Very high	93	Very high	159 Å²	159	65.7 Å²	65.7	60%	0.6	35%	0.345	S	S	*	.			trans	58.7	-26	-176.3	-58.1	-179.9	176.7	-178.3	-0.2	117	I662 V680	I662-R665 WeakPolarHBondContact O-CG 3.32Å; I662-R665 PolarHBondContact O-N 3.34Å; R665-V680 PolarHBondContact O-N 2.78Å
666	F	96.5	Very high	92.9	Very high	86 Å²	86	66.1 Å²	66.1	38%	0.377	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	138.8	175.2	-65.1	-84.5	0	0	0	109.4	A664 R677 V678 E679	A664-F666 PolarHBondContact O-N 3.24Å; F666-R677 HydrophobicContact CB-CG 4.19Å; F666-R677 VanDerWaalsContact CB-CZ 3.41Å; F666-R677 VanDerWaalsContact CG-NH2 3.31Å; F666-V678 CarbonylContact C-O 3.56Å; F666-V678 WeakPolarHBondContact CA-O 3Å; F666-V678 WeakPolarHBondContact CD1-O 3.5Å; F666-E679 HydrophobicContact CD1-CB 4.04Å; F666-E679 HydrophobicContact CD1-CG 4.24Å; F666-E679 HydrophobicContact CE1-CB 3.86Å; F666-E679 HydrophobicContact CE1-CG 3.8Å; F666-E679 HydrophobicContact CZ-CG 4.28Å
667	V	94.9	Very high	92.9	Very high	9 Å²	9	66.7 Å²	66.7	6%	0.055	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.4	144.3	-177.4	177.3	0	0	0	0	108.3	M623 L626 Y627 L669 R677 V678 V680	M623-V667 HydrophobicContact CE-CB 4.5Å; M623-V667 HydrophobicContact CE-CG1 4.38Å; M623-V667 HydrophobicContact SD-CG1 4.45Å; L626-V667 HydrophobicContact CD1-CG1 3.47Å; L626-V667 VanDerWaalsContact CD1-CG1 3.47Å; Y627-V667 HydrophobicContact CE2-CG2 4.21Å; Y627-V667 WeakPolarHBondContact OH-CG2 3.19Å; V667-L669 HydrophobicContact CG1-CD2 4.07Å; V667-R677 CarbonylContact O-C 3.55Å; V667-R677 WeakPolarHBondContact O-CA 3.48Å; V667-V678 HydrophobicContact CB-CG2 3.87Å; V667-V678 PolarHBondContact N-O 3.14Å; V667-V678 WeakPolarHBondContact O-CG2 3.32Å; V667-V678 PolarHBondContact O-N 2.81Å; V667-V680 HydrophobicContact CB-CG2 4.43Å; V667-V680 HydrophobicContact CG2-CG2 3.74Å
668	Q	92.5	Very high	92.9	Very high	90 Å²	90	66.1 Å²	66.1	42%	0.421	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	114.1	170.8	-157.8	71.2	12.2	0	0	108.7	D675	Q668-D675 WeakPolarHBondContact CG-OD1 3.11Å; Q668-D675 PolarHBondContact NE2-OD1 2.88Å; Q668-D675 PolarHBondContact NE2-OD2 2.97Å
669	L	92.6	Very high	92.9	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	117	171.5	-63.8	-172.3	0	0	0	109.4	V610 L614 L619 I622 M623 V667 K676 V678	V610-L669 HydrophobicContact CG2-CD1 4.48Å; L614-L669 HydrophobicContact CD2-CD1 3.99Å; L619-L669 HydrophobicContact CD1-CD1 3.96Å; I622-L669 HydrophobicContact CB-CD2 4.28Å; I622-L669 HydrophobicContact CD1-CD2 4.5Å; I622-L669 HydrophobicContact CG2-CD2 3.5Å; I622-L669 VanDerWaalsContact CG2-CD2 3.5Å; M623-L669 HydrophobicContact CE-CD2 4.19Å; V667-L669 HydrophobicContact CG1-CD2 4.07Å; L669-K676 PolarHBondContact N-O 2.78Å; L669-K676 PolarHBondContact O-N 2.99Å; L669-V678 HydrophobicContact CB-CG1 4.35Å; L669-V678 HydrophobicContact CD1-CB 4.39Å; L669-V678 HydrophobicContact CD1-CG1 3.6Å; L669-V678 HydrophobicContact CD1-CG2 3.94Å; L669-V678 HydrophobicContact CG-CB 4.49Å; L669-V678 HydrophobicContact CG-CG1 3.88Å; L669-V678 HydrophobicContact CG-CG2 3.77Å
670	Q	88.9	Confident	93	Very high	145 Å²	145	67.2 Å²	67.2	68%	0.678	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	125.8	169.9	-172.4	-178.9	9.1	0	0	109.2
671	H	86.1	Confident	92.9	Very high	40 Å²	40	69.5 Å²	69.5	19%	0.185	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	104.5	176.2	169.4	91.7	0	0	0	109.2	L614 E618 E673 I674	L614-H671 HydrophobicContact CD1-CB 3.93Å; L614-H671 WeakPolarHBondContact CD1-ND1 3.41Å; E618-H671 IonicContact OE2-CE1 2.78Å; E618-H671 PolarHBondContact OE2-CE1 2.89Å; E618-H671 IonicContact OE2-ND1 3.62Å; E618-H671 PolarHBondContact OE2-ND1 3.37Å; H671-E673 PolarHBondContact O-N 3.06Å; H671-I674 PolarHBondContact N-O 3.41Å; H671-I674 WeakPolarHBondContact O-CB 3.45Å; H671-I674 PolarHBondContact O-N 3.28Å
672	G	85.8	Confident	92.8	Very high	69 Å²	69	70.1 Å²	70.1	71%	0.711	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	57.2	-128.2	-169.6	0	0	0	0	0	111.4	I674	G672-I674 VanDerWaalsContact C-N 3.28Å; G672-I674 PolarHBondContact O-N 3.15Å
673	E	86.2	Confident	92.7	Very high	190 Å²	190	73.9 Å²	73.9	89%	0.888	36%	0.363	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.3	-11.4	173.3	64.7	-174.3	-170.4	0	0	114.3	H671 D675	H671-E673 PolarHBondContact O-N 3.06Å; E673-D675 PolarHBondContact O-N 3.46Å
674	I	88.1	Confident	92.5	Very high	45 Å²	45	73.1 Å²	73.1	23%	0.231	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	105.3	-175.6	-54.5	177.5	0	0	0	109.5	P611 P613 H671 G672 K676	P611-I674 HydrophobicContact CB-CG2 4.28Å; P611-I674 HydrophobicContact CG-CG2 4.09Å; P613-I674 HydrophobicContact CG-CD1 4.34Å; H671-I674 PolarHBondContact N-O 3.41Å; H671-I674 WeakPolarHBondContact O-CB 3.45Å; H671-I674 PolarHBondContact O-N 3.28Å; G672-I674 VanDerWaalsContact C-N 3.28Å; G672-I674 PolarHBondContact O-N 3.15Å; I674-K676 HydrophobicContact CG2-CD 3.84Å; I674-K676 HydrophobicContact CG2-CG 3.82Å
675	D	90.2	Very high	92.3	Very high	94 Å²	94	72.2 Å²	72.2	50%	0.503	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	121.7	166.7	-177.1	38	0	0	0	110.7	Q668 E673	Q668-D675 WeakPolarHBondContact CG-OD1 3.11Å; Q668-D675 PolarHBondContact NE2-OD1 2.88Å; Q668-D675 PolarHBondContact NE2-OD2 2.97Å; E673-D675 PolarHBondContact O-N 3.46Å
676	K	93.3	Very high	91.8	Very high	102 Å²	102	69 Å²	69	44%	0.443	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.6	132	-176.2	-79.9	-172.5	-179.7	179.7	0	114.3	P611 L669 I674 V678	P611-K676 HydrophobicContact CG-CD 4.36Å; L669-K676 PolarHBondContact N-O 2.78Å; L669-K676 PolarHBondContact O-N 2.99Å; I674-K676 HydrophobicContact CG2-CD 3.84Å; I674-K676 HydrophobicContact CG2-CG 3.82Å; K676-V678 PolarHBondContact O-N 2.67Å
677	R	95.2	Very high	91.4	Very high	157 Å²	157	69.4 Å²	69.4	59%	0.592	35%	0.346	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.5	103.9	170.3	-162.1	167.3	176.7	-85.2	2.4	110.9	F666 V667	F666-R677 HydrophobicContact CB-CG 4.19Å; F666-R677 VanDerWaalsContact CB-CZ 3.41Å; F666-R677 VanDerWaalsContact CG-NH2 3.31Å; V667-R677 CarbonylContact O-C 3.55Å; V667-R677 WeakPolarHBondContact O-CA 3.48Å
678	V	96.5	Very high	91.2	Very high	0 Å²	0	70.4 Å²	70.4	0%	0	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	156.8	173.5	-59	0	0	0	0	111.5	V607 G608 V610 F666 V667 L669 K676	V607-V678 HydrophobicContact CG1-CB 4Å; V607-V678 HydrophobicContact CG1-CG2 3.65Å; G608-V678 WeakPolarHBondContact O-CA 3.43Å; G608-V678 VanDerWaalsContact O-CB 3.32Å; G608-V678 WeakPolarHBondContact O-CB 3.46Å; V610-V678 HydrophobicContact CG2-CG1 4.45Å; F666-V678 CarbonylContact C-O 3.56Å; F666-V678 WeakPolarHBondContact CA-O 3Å; F666-V678 WeakPolarHBondContact CD1-O 3.5Å; V667-V678 HydrophobicContact CB-CG2 3.87Å; V667-V678 PolarHBondContact N-O 3.14Å; V667-V678 WeakPolarHBondContact O-CG2 3.32Å; V667-V678 PolarHBondContact O-N 2.81Å; L669-V678 HydrophobicContact CB-CG1 4.35Å; L669-V678 HydrophobicContact CD1-CB 4.39Å; L669-V678 HydrophobicContact CD1-CG1 3.6Å; L669-V678 HydrophobicContact CD1-CG2 3.94Å; L669-V678 HydrophobicContact CG-CB 4.49Å; L669-V678 HydrophobicContact CG-CG1 3.88Å; L669-V678 HydrophobicContact CG-CG2 3.77Å; K676-V678 PolarHBondContact O-N 2.67Å
679	E	96.7	Very high	91.2	Very high	68 Å²	68	69.4 Å²	69.4	32%	0.318	35%	0.347	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	138.1	172.8	-171.6	-173.8	-149.4	0	0	110.1	V607 G608 F666 K681	V607-E679 CarbonylContact C-O 3.57Å; V607-E679 WeakPolarHBondContact CA-O 3.35Å; G608-E679 PolarHBondContact N-O 2.86Å; G608-E679 PolarHBondContact O-N 2.65Å; F666-E679 HydrophobicContact CD1-CB 4.04Å; F666-E679 HydrophobicContact CD1-CG 4.24Å; F666-E679 HydrophobicContact CE1-CB 3.86Å; F666-E679 HydrophobicContact CE1-CG 3.8Å; F666-E679 HydrophobicContact CZ-CG 4.28Å; E679-K681 WeakPolarHBondContact OE1-CE 3.37Å; E679-K681 IonicContact OE1-NZ 3.83Å; E679-K681 PolarHBondContact OE1-NZ 2.73Å; E679-K681 WeakPolarHBondContact OE2-CE 3.05Å; E679-K681 IonicContact OE2-NZ 2.72Å; E679-K681 PolarHBondContact OE2-NZ 2.95Å
680	V	96.9	Very high	91.3	Very high	5 Å²	5	69.4 Å²	69.4	3%	0.03	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	129	178.1	173.1	0	0	0	0	109.9	I605 F606 M623 A661 I662 R665 V667	I605-V680 HydrophobicContact CB-CG1 4.2Å; I605-V680 HydrophobicContact CD1-CG1 3.8Å; I605-V680 HydrophobicContact CD1-CG2 4.47Å; I605-V680 HydrophobicContact CG2-CG1 4.46Å; F606-V680 WeakPolarHBondContact O-CA 3.28Å; M623-V680 HydrophobicContact CE-CG2 4.34Å; A661-V680 HydrophobicContact CB-CG1 4.45Å; A661-V680 WeakPolarHBondContact O-CG1 3.38Å; I662-V680 HydrophobicContact CD1-CG1 3.92Å; R665-V680 PolarHBondContact O-N 2.78Å; V667-V680 HydrophobicContact CB-CG2 4.43Å; V667-V680 HydrophobicContact CG2-CG2 3.74Å
681	K	95.1	Very high	91.6	Very high	88 Å²	88	64.5 Å²	64.5	38%	0.383	33%	0.326	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	154.2	-178.5	-78.8	168.5	170.1	152.7	0	110.7	I605 F606 I662 E679	I605-K681 CarbonylContact C-O 3.58Å; I605-K681 WeakPolarHBondContact CA-O 3.36Å; F606-K681 HydrophobicContact CB-CB 4.47Å; F606-K681 HydrophobicContact CD1-CB 4.44Å; F606-K681 PolarHBondContact N-O 3.35Å; F606-K681 PolarHBondContact O-N 3.03Å; I662-K681 WeakPolarHBondContact CD1-O 3.34Å; E679-K681 WeakPolarHBondContact OE1-CE 3.37Å; E679-K681 IonicContact OE1-NZ 3.83Å; E679-K681 PolarHBondContact OE1-NZ 2.73Å; E679-K681 WeakPolarHBondContact OE2-CE 3.05Å; E679-K681 IonicContact OE2-NZ 2.72Å; E679-K681 PolarHBondContact OE2-NZ 2.95Å
682	P	94.4	Very high	92	Very high	12 Å²	12	67 Å²	67	8%	0.078	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.2	139.6	167.9	-25.7	37.5	0	0	0	110.9	I662 V684 F706 A708 L713	I662-P682 HydrophobicContact CD1-CB 4.36Å; I662-P682 HydrophobicContact CD1-CG 3.85Å; I662-P682 VanDerWaalsContact CD1-N 3.29Å; I662-P682 HydrophobicContact CG1-CG 4.11Å; I662-P682 HydrophobicContact CG2-CG 3.91Å; P682-V684 PolarHBondContact O-N 2.92Å; P682-F706 HydrophobicContact CB-CE1 3.51Å; P682-F706 HydrophobicContact CB-CZ 3.76Å; P682-F706 HydrophobicContact CG-CE1 3.86Å; P682-F706 HydrophobicContact CG-CZ 4.25Å; P682-A708 HydrophobicContact CG-CB 4Å; P682-L713 HydrophobicContact CG-CD2 4.17Å
683	Y	93.3	Very high	92.3	Very high	86 Å²	86	64.5 Å²	64.5	34%	0.337	31%	0.308	S	S	.	.	P	Polyproline II helix	trans	-76.6	120.8	169.7	-164.8	-91.8	0	0	0	108.9	T604 F606 R649 L685	T604-Y683 HydrophobicContact CG2-CD2 4.25Å; T604-Y683 HydrophobicContact CG2-CG 3.96Å; T604-Y683 WeakPolarHBondContact O-CB 3.5Å; T604-Y683 PolarHBondContact O-N 3.48Å; F606-Y683 HydrophobicContact CB-CD2 4.32Å; R649-Y683 HydrophobicContact CB-CD2 4.44Å; R649-Y683 HydrophobicContact CB-CE2 4.46Å; Y683-L685 HydrophobicContact CD1-CD2 3.79Å; Y683-L685 HydrophobicContact CD1-CG 4.46Å; Y683-L685 HydrophobicContact CE1-CD2 3.85Å
684	V	90.7	Very high	92.6	Very high	45 Å²	45	62.7 Å²	62.7	27%	0.273	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-97.5	128.9	-175.6	-174.6	0	0	0	0	109.9	P682 F706 Y715 L736	P682-V684 PolarHBondContact O-N 2.92Å; V684-F706 HydrophobicContact CG1-CB 4.09Å; V684-F706 HydrophobicContact CG1-CG 4.47Å; V684-F706 HydrophobicContact CG2-CD1 3.87Å; V684-F706 HydrophobicContact CG2-CE1 4.42Å; V684-F706 HydrophobicContact CG2-CG 4.33Å; V684-Y715 HydrophobicContact CG1-CE1 4.19Å; V684-L736 HydrophobicContact CG2-CD2 4.09Å
685	L	90.1	Very high	92.7	Very high	27 Å²	27	60.6 Å²	60.6	14%	0.141	29%	0.289	C	S	.	.			trans	-105.7	156.3	-176.7	-57.9	167.7	0	0	0	110.6	P601 R602 Y683 Q688 Y715	P601-L685 HydrophobicContact CB-CD1 3.76Å; P601-L685 HydrophobicContact CB-CD2 3.88Å; P601-L685 HydrophobicContact CB-CG 4.46Å; R602-L685 HydrophobicContact CG-CD1 4.05Å; Y683-L685 HydrophobicContact CD1-CD2 3.79Å; Y683-L685 HydrophobicContact CD1-CG 4.46Å; Y683-L685 HydrophobicContact CE1-CD2 3.85Å; L685-Q688 HydrophobicContact CB-CG 3.5Å; L685-Q688 HydrophobicContact CD1-CG 4.05Å; L685-Q688 HydrophobicContact CG-CG 4.43Å; L685-Y715 PolarHBondContact N-OH 3.07Å; L685-Y715 WeakPolarHBondContact O-CE1 3.48Å
686	D	83.3	Confident	92.7	Very high	92 Å²	92	62 Å²	62	49%	0.492	30%	0.302	S	S	.	.	S	Bend	trans	-103.7	-25.4	-166.9	-65.5	9.5	0	0	0	113.6	K738	D686-K738 WeakPolarHBondContact OD1-CD 3.42Å; D686-K738 WeakPolarHBondContact OD1-CE 3.46Å; D686-K738 IonicContact OD1-NZ 3.68Å; D686-K738 PolarHBondContact OD1-NZ 2.92Å; D686-K738 IonicContact OD2-NZ 3.59Å; D686-K738 PolarHBondContact OD2-NZ 3.11Å
687	D	88.3	Confident	92.5	Very high	93 Å²	93	64.7 Å²	64.7	50%	0.497	31%	0.309	S	S	.	.	S	Bend	trans	-98.9	15.6	-170.8	62.5	-20.8	0	0	0	112.7	F702	D687-F702 HydrophobicContact CB-CE1 4.26Å; D687-F702 HydrophobicContact CB-CZ 4.27Å; D687-F702 WeakPolarHBondContact O-CD1 3.43Å; D687-F702 WeakPolarHBondContact O-CE1 3.14Å
688	Q	91.8	Very high	91.9	Very high	30 Å²	30	58.6 Å²	58.6	14%	0.14	29%	0.29	C	S	.	.	P	Polyproline II helix	trans	-88.8	126.2	-172.1	-60	-58	-58.7	0	0	111.6	R602 L685 F702 A703 Y715	R602-Q688 VanDerWaalsContact CZ-OE1 3.25Å; L685-Q688 HydrophobicContact CB-CG 3.5Å; L685-Q688 HydrophobicContact CD1-CG 4.05Å; L685-Q688 HydrophobicContact CG-CG 4.43Å; Q688-F702 CarbonylContact O-C 3.55Å; Q688-F702 WeakPolarHBondContact O-CA 3.48Å; Q688-A703 PolarHBondContact O-N 2.84Å; Q688-Y715 HydrophobicContact CB-CD1 3.6Å; Q688-Y715 HydrophobicContact CB-CD2 3.93Å; Q688-Y715 HydrophobicContact CB-CE1 3.88Å; Q688-Y715 HydrophobicContact CB-CE2 4.21Å; Q688-Y715 HydrophobicContact CB-CG 3.64Å; Q688-Y715 HydrophobicContact CG-CD1 4.14Å; Q688-Y715 HydrophobicContact CG-CD2 4.16Å; Q688-Y715 HydrophobicContact CG-CE1 3.9Å; Q688-Y715 HydrophobicContact CG-CE2 3.93Å; Q688-Y715 HydrophobicContact CG-CG 4.28Å
689	L	92.9	Very high	91.4	Very high	69 Å²	69	62.3 Å²	62.3	36%	0.361	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-71.6	155.5	168.7	-63.9	176.1	0	0	0	110.5	D691 G700 F702	L689-D691 PolarHBondContact O-N 2.92Å; L689-G700 WeakPolarHBondContact CD2-O 3.47Å; L689-F702 HydrophobicContact CD2-CD1 3.99Å; L689-F702 HydrophobicContact CD2-CE1 4.41Å
690	C	94.2	Very high	90.9	Very high	1 Å²	1	61.4 Å²	61.4	1%	0.007	34%	0.337	C	S	.	.	P	Polyproline II helix	trans	-61.1	119.1	174.3	174.5	0	0	0	0	110.7	E692 C693 Q694 A703 Y715 C717	C690-E692 PolarHBondContact O-N 3.1Å; C690-C693 PolarHBondContact O-N 3.14Å; C690-Q694 VanDerWaalsContact O-CA 3.27Å; C690-Q694 WeakPolarHBondContact O-CA 3.26Å; C690-Q694 PolarHBondContact O-N 3.42Å; C690-A703 HydrophobicContact CB-CB 4.38Å; C690-Y715 CarbonylContact C-O 3.54Å; C690-Y715 WeakPolarHBondContact CA-O 3.36Å; C690-C717 HydrophobicContact CB-CB 3.85Å; C690-C717 PolarHBondContact SG-N 2.88Å
691	D	93.9	Very high	90.5	Very high	42 Å²	42	68.6 Å²	68.6	23%	0.225	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-30.2	-174.2	-65.8	-53.7	0	0	0	112.6	R602 L689 Q714 Y715	R602-D691 IonicContact CZ-OD1 2.66Å; R602-D691 VanDerWaalsContact CZ-OD1 3.25Å; R602-D691 IonicContact NH1-OD1 4Å; R602-D691 PolarHBondContact NH1-OD1 2.76Å; R602-D691 IonicContact NH1-OD2 2.75Å; R602-D691 IonicContact NH2-OD1 2.61Å; R602-D691 PolarHBondContact NH2-OD1 3.28Å; R602-D691 IonicContact NH2-OD2 2.73Å; L689-D691 PolarHBondContact O-N 2.92Å; D691-Q714 HydrophobicContact CB-CG 4.17Å; D691-Q714 WeakPolarHBondContact OD2-CA 3.27Å; D691-Y715 PolarHBondContact N-O 2.91Å; D691-Y715 PolarHBondContact OD2-N 2.93Å
692	E	94.3	Very high	90.3	Very high	93 Å²	93	70 Å²	70	44%	0.435	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.6	-22.3	-178.3	-69.6	-77.8	162.1	0	0	115.1	C690 Y716 C720 I724	C690-E692 PolarHBondContact O-N 3.1Å; E692-Y716 HydrophobicContact CG-CD1 3.69Å; E692-Y716 HydrophobicContact CG-CE1 3.5Å; E692-C720 HydrophobicContact CB-CB 3.98Å; E692-C720 HydrophobicContact CG-CB 4.39Å; E692-I724 HydrophobicContact CB-CD1 4.45Å; E692-I724 HydrophobicContact CG-CD1 3.45Å; E692-I724 VanDerWaalsContact CG-CD1 3.45Å; E692-I724 WeakPolarHBondContact OE1-CD1 3.47Å
693	C	93.5	Very high	90.2	Very high	15 Å²	15	70.1 Å²	70.1	10%	0.101	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	-143.6	7.6	-177.3	72.8	0	0	0	0	115.2	C690 G695 T696 R697 C717	C690-C693 PolarHBondContact O-N 3.14Å; C693-G695 PolarHBondContact O-N 3.09Å; C693-T696 VanDerWaalsContact O-CB 3.24Å; C693-T696 WeakPolarHBondContact O-CB 3.49Å; C693-T696 PolarHBondContact O-N 3.04Å; C693-T696 PolarHBondContact O-OG1 3.36Å; C693-R697 HydrophobicContact CB-CB 4.34Å; C693-R697 HydrophobicContact CB-CG 3.92Å; C693-C717 VanDerWaalsContact SG-SG 3.63Å
694	Q	93	Very high	90.1	Very high	152 Å²	152	69.2 Å²	69.2	71%	0.71	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.6	37	173.5	-59	177.9	-1.2	0	0	113.4	C690 T696	C690-Q694 VanDerWaalsContact O-CA 3.27Å; C690-Q694 WeakPolarHBondContact O-CA 3.26Å; C690-Q694 PolarHBondContact O-N 3.42Å; Q694-T696 PolarHBondContact O-N 3.32Å
695	G	89.8	Confident	90.2	Very high	1 Å²	1	68.9 Å²	68.9	1%	0.01	38%	0.376	C	S	.	.	T	Hydrogen-bonded Turn	trans	77.8	-10.4	-177.1	0	0	0	0	0	115.7	C693 R697 C698 G699 G700	C693-G695 PolarHBondContact O-N 3.09Å; G695-R697 VanDerWaalsContact C-N 3.33Å; G695-R697 PolarHBondContact O-N 2.72Å; G695-C698 CarbonylContact O-C 3.46Å; G695-C698 PolarHBondContact O-N 2.84Å; G695-G699 PolarHBondContact O-N 2.66Å; G695-G700 PolarHBondContact O-N 2.61Å
696	T	90.7	Very high	90.4	Very high	124 Å²	124	67.9 Å²	67.9	76%	0.761	37%	0.37	S	S	*	.	G	3₁₀ helix	trans	-56.7	-40.7	-175.6	-50.8	0	0	0	0	113	C693 Q694 C698	C693-T696 VanDerWaalsContact O-CB 3.24Å; C693-T696 WeakPolarHBondContact O-CB 3.49Å; C693-T696 PolarHBondContact O-N 3.04Å; C693-T696 PolarHBondContact O-OG1 3.36Å; Q694-T696 PolarHBondContact O-N 3.32Å; T696-C698 PolarHBondContact O-N 3.49Å
697	R	87.4	Confident	90.9	Very high	158 Å²	158	63.5 Å²	63.5	60%	0.596	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-77.7	-2	178.5	-63.8	-178.6	-179.5	171.8	1.6	114.2	C693 G695	C693-R697 HydrophobicContact CB-CB 4.34Å; C693-R697 HydrophobicContact CB-CG 3.92Å; G695-R697 VanDerWaalsContact C-N 3.33Å; G695-R697 PolarHBondContact O-N 2.72Å
698	C	84.2	Confident	91.1	Very high	29 Å²	29	60.4 Å²	60.4	20%	0.196	33%	0.334	C	S	.	.	G	3₁₀ helix	trans	-133.7	17.3	-172.3	-63.1	0	0	0	0	113.6	G695 T696 G700 K701 C717	G695-C698 CarbonylContact O-C 3.46Å; G695-C698 PolarHBondContact O-N 2.84Å; T696-C698 PolarHBondContact O-N 3.49Å; C698-G700 VanDerWaalsContact C-N 3.32Å; C698-G700 PolarHBondContact O-N 2.92Å; C698-K701 HydrophobicContact CB-CB 4.38Å; C698-K701 WeakPolarHBondContact O-CB 3.46Å; C698-K701 WeakPolarHBondContact O-CG 3.26Å; C698-K701 PolarHBondContact O-N 2.74Å; C698-C717 HydrophobicContact CB-CB 4.42Å; C698-C717 WeakPolarHBondContact SG-CB 3.5Å; C698-C717 PolarHBondContact SG-SG 2.82Å
699	G	84.9	Confident	91.1	Very high	78 Å²	78	61.5 Å²	61.5	80%	0.804	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.8	34.6	179	0	0	0	0	0	113.5	G695 K701	G695-G699 PolarHBondContact O-N 2.66Å; G699-K701 VanDerWaalsContact C-N 3.3Å; G699-K701 PolarHBondContact O-N 2.8Å
700	G	86.2	Confident	91	Very high	49 Å²	49	60.7 Å²	60.7	51%	0.505	34%	0.339	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	3.3	179.9	0	0	0	0	0	115.5	L689 G695 C698	L689-G700 WeakPolarHBondContact CD2-O 3.47Å; G695-G700 PolarHBondContact O-N 2.61Å; C698-G700 VanDerWaalsContact C-N 3.32Å; C698-G700 PolarHBondContact O-N 2.92Å
701	K	88.9	Confident	90.9	Very high	156 Å²	156	65 Å²	65	68%	0.678	37%	0.365	S	S	*	.	P	Polyproline II helix	trans	-65.1	144.7	175.6	-66.8	178	-179.3	-176.8	0	112.1	C698 G699	C698-K701 HydrophobicContact CB-CB 4.38Å; C698-K701 WeakPolarHBondContact O-CB 3.46Å; C698-K701 WeakPolarHBondContact O-CG 3.26Å; C698-K701 PolarHBondContact O-N 2.74Å; G699-K701 VanDerWaalsContact C-N 3.3Å; G699-K701 PolarHBondContact O-N 2.8Å
702	F	91.6	Very high	90.8	Very high	119 Å²	119	63.6 Å²	63.6	52%	0.522	36%	0.359	S	S	.	.	P	Polyproline II helix	trans	-60.7	158.4	169.1	-54.6	-53.8	0	0	0	112.2	D687 Q688 L689 P704	D687-F702 HydrophobicContact CB-CE1 4.26Å; D687-F702 HydrophobicContact CB-CZ 4.27Å; D687-F702 WeakPolarHBondContact O-CD1 3.43Å; D687-F702 WeakPolarHBondContact O-CE1 3.14Å; Q688-F702 CarbonylContact O-C 3.55Å; Q688-F702 WeakPolarHBondContact O-CA 3.48Å; L689-F702 HydrophobicContact CD2-CD1 3.99Å; L689-F702 HydrophobicContact CD2-CE1 4.41Å; F702-P704 WeakPolarHBondContact O-CD 3.44Å
703	A	92.1	Very high	90.7	Very high	13 Å²	13	60.4 Å²	60.4	11%	0.107	34%	0.344	C	S	.	.	P	Polyproline II helix	trans	-80.8	117.6	-178.6	0	0	0	0	0	111.4	Q688 C690 F705 Y716	Q688-A703 PolarHBondContact O-N 2.84Å; C690-A703 HydrophobicContact CB-CB 4.38Å; A703-F705 PolarHBondContact O-N 3.06Å; A703-Y716 WeakPolarHBondContact CB-O 3.46Å
704	P	90.9	Very high	90.7	Very high	67 Å²	67	62.8 Å²	62.8	44%	0.435	35%	0.354	S	S	.	.	S	Bend	trans	-75.7	-10.2	178.8	32.4	-36.3	0	0	0	113.6	F702	F702-P704 WeakPolarHBondContact O-CD 3.44Å
705	F	92.9	Very high	90.8	Very high	39 Å²	39	55.9 Å²	55.9	17%	0.171	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	123.8	-174	-54.3	-42.8	0	0	0	111.7	A703 Y716 E718 W721 P735 V737	A703-F705 PolarHBondContact O-N 3.06Å; F705-Y716 PolarHBondContact N-O 3.24Å; F705-Y716 PolarHBondContact O-N 2.71Å; F705-E718 HydrophobicContact CE2-CB 4.05Å; F705-E718 HydrophobicContact CE2-CG 4.25Å; F705-W721 HydrophobicContact CB-CD2 4.33Å; F705-W721 HydrophobicContact CB-CE3 3.79Å; F705-W721 HydrophobicContact CB-CZ3 4.44Å; F705-W721 HydrophobicContact CD2-CB 3.86Å; F705-W721 HydrophobicContact CD2-CD2 4.39Å; F705-W721 AromaticContact CD2-CG 3.98Å; F705-W721 HydrophobicContact CD2-CG 3.98Å; F705-W721 HydrophobicContact CG-CE3 4.5Å; F705-P735 HydrophobicContact CB-CB 3.97Å; F705-P735 HydrophobicContact CD1-CB 3.93Å; F705-P735 HydrophobicContact CG-CB 4.04Å; F705-V737 HydrophobicContact CD1-CB 4.36Å; F705-V737 HydrophobicContact CD1-CG1 4.19Å; F705-V737 HydrophobicContact CD1-CG2 3.8Å; F705-V737 HydrophobicContact CE1-CB 4.42Å; F705-V737 HydrophobicContact CE1-CG1 3.97Å; F705-V737 HydrophobicContact CE1-CG2 3.75Å
706	F	94	Very high	91	Very high	5 Å²	5	55.9 Å²	55.9	2%	0.022	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	136.7	168.2	176	-100.2	0	0	0	110.8	P682 V684 A708 L713 Q714 Y715 L736	P682-F706 HydrophobicContact CB-CE1 3.51Å; P682-F706 HydrophobicContact CB-CZ 3.76Å; P682-F706 HydrophobicContact CG-CE1 3.86Å; P682-F706 HydrophobicContact CG-CZ 4.25Å; V684-F706 HydrophobicContact CG1-CB 4.09Å; V684-F706 HydrophobicContact CG1-CG 4.47Å; V684-F706 HydrophobicContact CG2-CD1 3.87Å; V684-F706 HydrophobicContact CG2-CE1 4.42Å; V684-F706 HydrophobicContact CG2-CG 4.33Å; F706-A708 HydrophobicContact CD1-CB 4.22Å; F706-A708 HydrophobicContact CE1-CB 3.85Å; F706-L713 HydrophobicContact CZ-CD2 4.45Å; F706-Q714 WeakPolarHBondContact CD2-O 3.08Å; F706-Y715 HydrophobicContact CB-CD1 4.12Å; F706-Y715 HydrophobicContact CB-CE1 3.98Å; F706-Y715 AromaticContact CD2-CD1 3.92Å; F706-Y715 HydrophobicContact CD2-CD1 3.92Å; F706-Y715 AromaticContact CD2-CD2 3.81Å; F706-Y715 HydrophobicContact CD2-CD2 3.81Å; F706-Y715 AromaticContact CD2-CE1 3.7Å; F706-Y715 HydrophobicContact CD2-CE1 3.7Å; F706-Y715 AromaticContact CD2-CE2 3.56Å; F706-Y715 HydrophobicContact CD2-CE2 3.56Å; F706-Y715 AromaticContact CD2-CG 3.97Å; F706-Y715 HydrophobicContact CD2-CG 3.97Å; F706-Y715 AromaticContact CD2-CZ 3.48Å; F706-Y715 VanDerWaalsContact CD2-CZ 3.48Å; F706-Y715 HydrophobicContact CE2-CD2 4.19Å; F706-Y715 AromaticContact CE2-CE2 3.76Å; F706-Y715 HydrophobicContact CE2-CE2 3.76Å; F706-Y715 AromaticContact CE2-CZ 3.98Å; F706-Y715 HydrophobicContact CG-CD1 4.48Å; F706-Y715 HydrophobicContact CG-CE1 4.14Å; F706-L736 HydrophobicContact CB-CB 4.41Å; F706-L736 HydrophobicContact CD1-CB 4.45Å; F706-L736 HydrophobicContact CD1-CD2 4.36Å; F706-L736 PolarHBondContact N-O 3.04Å; F706-L736 PolarHBondContact O-N 2.69Å
707	C	93.8	Very high	91.1	Very high	0 Å²	0	50 Å²	50	0%	0	29%	0.286	C	S	.	.			trans	-99.9	98.2	177.6	-162.5	0	0	0	0	111.7	N709 C712 L713 Q714 Y716 W721 H725 H733	C707-N709 PolarHBondContact O-N 2.9Å; C707-C712 HydrophobicContact CB-CB 3.66Å; C707-L713 VanDerWaalsContact O-CA 3.26Å; C707-L713 WeakPolarHBondContact O-CA 3.42Å; C707-L713 PolarHBondContact O-N 3.36Å; C707-L713 VanDerWaalsContact O-N 3.1Å; C707-Q714 PolarHBondContact N-O 3.47Å; C707-Y716 HydrophobicContact CB-CD2 4.04Å; C707-Y716 HydrophobicContact CB-CE2 3.56Å; C707-W721 HydrophobicContact CB-CH2 4.19Å; C707-W721 HydrophobicContact CB-CZ3 3.68Å; C707-H725 PolarHBondContact SG-NE2 3.06Å; C707-H725 VanDerWaalsContact SG-NE2 3.36Å; C707-H733 PolarHBondContact SG-ND1 3.14Å
708	A	92.1	Very high	91.4	Very high	28 Å²	28	48.7 Å²	48.7	23%	0.231	29%	0.286	C	S	.	.			trans	-74	11.7	178.1	0	0	0	0	0	114.9	P682 F706 L736	P682-A708 HydrophobicContact CG-CB 4Å; F706-A708 HydrophobicContact CD1-CB 4.22Å; F706-A708 HydrophobicContact CE1-CB 3.85Å; A708-L736 HydrophobicContact CB-CD1 3.5Å; A708-L736 VanDerWaalsContact CB-CD1 3.5Å; A708-L736 HydrophobicContact CB-CD2 3.94Å; A708-L736 HydrophobicContact CB-CG 4.37Å
709	N	91.9	Very high	91.8	Very high	54 Å²	54	54.6 Å²	54.6	29%	0.289	31%	0.305	S	S	.	.	S	Bend	trans	-75.7	133.7	168.1	-169.6	-54	0	0	0	109.1	C707 T711 C712 L713 H733	C707-N709 PolarHBondContact O-N 2.9Å; N709-T711 PolarHBondContact O-N 3.04Å; N709-T711 VanDerWaalsContact O-N 3.09Å; N709-T711 PolarHBondContact OD1-N 3.41Å; N709-T711 PolarHBondContact OD1-OG1 2.94Å; N709-C712 PolarHBondContact O-N 3.3Å; N709-L713 WeakPolarHBondContact O-CD2 3.39Å; N709-L713 WeakPolarHBondContact O-CG 3.39Å; N709-L713 PolarHBondContact O-N 3.39Å; N709-H733 PolarHBondContact ND2-CD2 2.83Å; N709-H733 VanDerWaalsContact ND2-CD2 3.32Å; N709-H733 PolarHBondContact ND2-NE2 3.23Å
710	V	90.9	Very high	92.2	Very high	52 Å²	52	51 Å²	51	32%	0.315	27%	0.268	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.7	-29.2	179	176.9	0	0	0	0	113.1	I659 I662 C712	I659-V710 HydrophobicContact CG2-CG1 3.94Å; I662-V710 HydrophobicContact CG2-CG2 4.16Å; V710-C712 VanDerWaalsContact C-N 3.27Å; V710-C712 PolarHBondContact O-N 3.32Å
711	T	91.1	Very high	92.6	Very high	91 Å²	91	50.2 Å²	50.2	56%	0.558	25%	0.249	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-3.9	177	61.2	0	0	0	0	114.9	N709 H733	N709-T711 PolarHBondContact O-N 3.04Å; N709-T711 VanDerWaalsContact O-N 3.09Å; N709-T711 PolarHBondContact OD1-N 3.41Å; N709-T711 PolarHBondContact OD1-OG1 2.94Å; T711-H733 PolarHBondContact OG1-CE1 3.33Å; T711-H733 VanDerWaalsContact OG1-CE1 3.28Å
712	C	92.2	Very high	92.7	Very high	13 Å²	13	45.5 Å²	45.5	9%	0.088	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	-123.9	-66	175.7	-68.2	0	0	0	0	111.6	C707 N709 V710 Q714 Y716	C707-C712 HydrophobicContact CB-CB 3.66Å; N709-C712 PolarHBondContact O-N 3.3Å; V710-C712 VanDerWaalsContact C-N 3.27Å; V710-C712 PolarHBondContact O-N 3.32Å; C712-Q714 VanDerWaalsContact O-CG 3.26Å; C712-Q714 WeakPolarHBondContact O-CG 3.13Å; C712-Q714 PolarHBondContact O-N 3.46Å; C712-Q714 VanDerWaalsContact O-N 3.14Å; C712-Y716 HydrophobicContact CB-CE2 4.24Å; C712-Y716 WeakPolarHBondContact CB-OH 3.18Å
713	L	93	Very high	92.8	Very high	25 Å²	25	41.9 Å²	41.9	13%	0.131	23%	0.232	C	C	.	.			trans	44.8	40.2	-174.3	-58.3	179.6	0	0	0	114.1	Y658 I659 I662 P682 F706 C707 N709	Y658-L713 HydrophobicContact CE1-CD1 3.96Å; I659-L713 HydrophobicContact CG1-CD1 3.94Å; I662-L713 HydrophobicContact CG2-CD2 4.12Å; P682-L713 HydrophobicContact CG-CD2 4.17Å; F706-L713 HydrophobicContact CZ-CD2 4.45Å; C707-L713 VanDerWaalsContact O-CA 3.26Å; C707-L713 WeakPolarHBondContact O-CA 3.42Å; C707-L713 PolarHBondContact O-N 3.36Å; C707-L713 VanDerWaalsContact O-N 3.1Å; N709-L713 WeakPolarHBondContact O-CD2 3.39Å; N709-L713 WeakPolarHBondContact O-CG 3.39Å; N709-L713 PolarHBondContact O-N 3.39Å
714	Q	93.7	Very high	92.7	Very high	65 Å²	65	42 Å²	42	30%	0.304	23%	0.231	S	C	.	.			trans	-131.3	156.6	-167.9	-89.1	172.1	-19	0	0	112.2	D691 F706 C707 C712 Y716	D691-Q714 HydrophobicContact CB-CG 4.17Å; D691-Q714 WeakPolarHBondContact OD2-CA 3.27Å; F706-Q714 WeakPolarHBondContact CD2-O 3.08Å; C707-Q714 PolarHBondContact N-O 3.47Å; C712-Q714 VanDerWaalsContact O-CG 3.26Å; C712-Q714 WeakPolarHBondContact O-CG 3.13Å; C712-Q714 PolarHBondContact O-N 3.46Å; C712-Q714 VanDerWaalsContact O-N 3.14Å; Q714-Y716 HydrophobicContact CB-CD2 4.44Å; Q714-Y716 HydrophobicContact CB-CE1 4.25Å; Q714-Y716 HydrophobicContact CB-CE2 3.63Å; Q714-Y716 WeakPolarHBondContact CB-OH 3.4Å; Q714-Y716 WeakPolarHBondContact O-CD2 3.27Å; Q714-Y716 WeakPolarHBondContact O-CE2 3.39Å; Q714-Y716 PolarHBondContact OE1-OH 3.19Å
715	Y	94.4	Very high	92.8	Very high	8 Å²	8	39.5 Å²	39.5	3%	0.031	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	128.5	175.6	-68.9	-90.8	0	0	0	110.2	V684 L685 Q688 C690 D691 F706	V684-Y715 HydrophobicContact CG1-CE1 4.19Å; L685-Y715 PolarHBondContact N-OH 3.07Å; L685-Y715 WeakPolarHBondContact O-CE1 3.48Å; Q688-Y715 HydrophobicContact CB-CD1 3.6Å; Q688-Y715 HydrophobicContact CB-CD2 3.93Å; Q688-Y715 HydrophobicContact CB-CE1 3.88Å; Q688-Y715 HydrophobicContact CB-CE2 4.21Å; Q688-Y715 HydrophobicContact CB-CG 3.64Å; Q688-Y715 HydrophobicContact CG-CD1 4.14Å; Q688-Y715 HydrophobicContact CG-CD2 4.16Å; Q688-Y715 HydrophobicContact CG-CE1 3.9Å; Q688-Y715 HydrophobicContact CG-CE2 3.93Å; Q688-Y715 HydrophobicContact CG-CG 4.28Å; C690-Y715 CarbonylContact C-O 3.54Å; C690-Y715 WeakPolarHBondContact CA-O 3.36Å; D691-Y715 PolarHBondContact N-O 2.91Å; D691-Y715 PolarHBondContact OD2-N 2.93Å; F706-Y715 HydrophobicContact CB-CD1 4.12Å; F706-Y715 HydrophobicContact CB-CE1 3.98Å; F706-Y715 AromaticContact CD2-CD1 3.92Å; F706-Y715 HydrophobicContact CD2-CD1 3.92Å; F706-Y715 AromaticContact CD2-CD2 3.81Å; F706-Y715 HydrophobicContact CD2-CD2 3.81Å; F706-Y715 AromaticContact CD2-CE1 3.7Å; F706-Y715 HydrophobicContact CD2-CE1 3.7Å; F706-Y715 AromaticContact CD2-CE2 3.56Å; F706-Y715 HydrophobicContact CD2-CE2 3.56Å; F706-Y715 AromaticContact CD2-CG 3.97Å; F706-Y715 HydrophobicContact CD2-CG 3.97Å; F706-Y715 AromaticContact CD2-CZ 3.48Å; F706-Y715 VanDerWaalsContact CD2-CZ 3.48Å; F706-Y715 HydrophobicContact CE2-CD2 4.19Å; F706-Y715 AromaticContact CE2-CE2 3.76Å; F706-Y715 HydrophobicContact CE2-CE2 3.76Å; F706-Y715 AromaticContact CE2-CZ 3.98Å; F706-Y715 HydrophobicContact CG-CD1 4.48Å; F706-Y715 HydrophobicContact CG-CE1 4.14Å
716	Y	93.8	Very high	92.6	Very high	0 Å²	0	42 Å²	42	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	136.8	-177.6	-57.6	-81.8	0	0	0	111.5	E692 A703 F705 C707 C712 Q714 C720 W721 I724 H725	E692-Y716 HydrophobicContact CG-CD1 3.69Å; E692-Y716 HydrophobicContact CG-CE1 3.5Å; A703-Y716 WeakPolarHBondContact CB-O 3.46Å; F705-Y716 PolarHBondContact N-O 3.24Å; F705-Y716 PolarHBondContact O-N 2.71Å; C707-Y716 HydrophobicContact CB-CD2 4.04Å; C707-Y716 HydrophobicContact CB-CE2 3.56Å; C712-Y716 HydrophobicContact CB-CE2 4.24Å; C712-Y716 WeakPolarHBondContact CB-OH 3.18Å; Q714-Y716 HydrophobicContact CB-CD2 4.44Å; Q714-Y716 HydrophobicContact CB-CE1 4.25Å; Q714-Y716 HydrophobicContact CB-CE2 3.63Å; Q714-Y716 WeakPolarHBondContact CB-OH 3.4Å; Q714-Y716 WeakPolarHBondContact O-CD2 3.27Å; Q714-Y716 WeakPolarHBondContact O-CE2 3.39Å; Q714-Y716 PolarHBondContact OE1-OH 3.19Å; Y716-C720 HydrophobicContact CD1-CB 4.36Å; Y716-W721 AromaticContact CD2-CE3 3.91Å; Y716-W721 HydrophobicContact CD2-CE3 3.91Å; Y716-W721 HydrophobicContact CD2-CZ3 4.21Å; Y716-W721 HydrophobicContact CG-CE3 4.36Å; Y716-I724 HydrophobicContact CD1-CD1 4.05Å; Y716-I724 HydrophobicContact CE1-CD1 3.7Å; Y716-H725 AromaticContact CD2-CE1 3.85Å; Y716-H725 AromaticContact CE2-CE1 3.59Å; Y716-H725 AromaticContact CZ-CE1 3.96Å
717	C	93.8	Very high	92.2	Very high	2 Å²	2	49.5 Å²	49.5	1%	0.014	26%	0.264	C	S	.	.			trans	-74.2	162.2	160.8	68.8	0	0	0	0	110.9	C690 C693 C698 Y719 C720 W721	C690-C717 HydrophobicContact CB-CB 3.85Å; C690-C717 PolarHBondContact SG-N 2.88Å; C693-C717 VanDerWaalsContact SG-SG 3.63Å; C698-C717 HydrophobicContact CB-CB 4.42Å; C698-C717 WeakPolarHBondContact SG-CB 3.5Å; C698-C717 PolarHBondContact SG-SG 2.82Å; C717-Y719 VanDerWaalsContact C-N 3.34Å; C717-Y719 PolarHBondContact O-N 3.26Å; C717-C720 PolarHBondContact O-N 3.35Å; C717-C720 VanDerWaalsContact O-N 3.08Å; C717-C720 VanDerWaalsContact SG-SG 3.63Å; C717-W721 WeakPolarHBondContact O-CB 3.39Å; C717-W721 PolarHBondContact O-N 3.42Å
718	E	92.5	Very high	91.5	Very high	130 Å²	130	53.8 Å²	53.8	61%	0.607	30%	0.3	S	S	*	.	H	α-helix	trans	-50.2	-47.8	-178.1	-174	173.6	-165.4	0	0	113.7	F705 W721 A722	F705-E718 HydrophobicContact CE2-CB 4.05Å; F705-E718 HydrophobicContact CE2-CG 4.25Å; E718-W721 PolarHBondContact O-N 3.39Å; E718-A722 WeakPolarHBondContact O-CB 3.37Å; E718-A722 PolarHBondContact O-N 2.87Å
719	Y	92.6	Very high	91.1	Very high	152 Å²	152	55.2 Å²	55.2	60%	0.596	32%	0.316	S	S	*	.	H	α-helix	trans	-63.9	-41.8	177.6	-59.5	-62.8	0	0	0	113.5	C717 A723	C717-Y719 VanDerWaalsContact C-N 3.34Å; C717-Y719 PolarHBondContact O-N 3.26Å; Y719-A723 VanDerWaalsContact O-CB 3.3Å; Y719-A723 WeakPolarHBondContact O-CB 3.4Å; Y719-A723 PolarHBondContact O-N 2.82Å
720	C	93.8	Very high	90.9	Very high	2 Å²	2	56.9 Å²	56.9	1%	0.014	32%	0.319	C	S	.	.	H	α-helix	trans	-74.9	-36	178.8	-69.2	0	0	0	0	111.8	E692 Y716 C717 A723 I724	E692-C720 HydrophobicContact CB-CB 3.98Å; E692-C720 HydrophobicContact CG-CB 4.39Å; Y716-C720 HydrophobicContact CD1-CB 4.36Å; C717-C720 PolarHBondContact O-N 3.35Å; C717-C720 VanDerWaalsContact O-N 3.08Å; C717-C720 VanDerWaalsContact SG-SG 3.63Å; C720-A723 PolarHBondContact O-N 2.89Å; C720-I724 WeakPolarHBondContact O-CB 3.47Å; C720-I724 WeakPolarHBondContact O-CD1 3.24Å; C720-I724 WeakPolarHBondContact O-CG1 3.41Å; C720-I724 PolarHBondContact O-N 3.16Å; C720-I724 VanDerWaalsContact O-N 3.14Å
721	W	93.9	Very high	90.7	Very high	33 Å²	33	59.3 Å²	59.3	13%	0.125	33%	0.327	C	S	.	.	H	α-helix	trans	-55.9	-53.5	172.3	178.3	-83.5	0	0	0	110.1	F705 C707 Y716 C717 E718 A723 I724 H725 H733 P735	F705-W721 HydrophobicContact CB-CD2 4.33Å; F705-W721 HydrophobicContact CB-CE3 3.79Å; F705-W721 HydrophobicContact CB-CZ3 4.44Å; F705-W721 HydrophobicContact CD2-CB 3.86Å; F705-W721 HydrophobicContact CD2-CD2 4.39Å; F705-W721 AromaticContact CD2-CG 3.98Å; F705-W721 HydrophobicContact CD2-CG 3.98Å; F705-W721 HydrophobicContact CG-CE3 4.5Å; C707-W721 HydrophobicContact CB-CH2 4.19Å; C707-W721 HydrophobicContact CB-CZ3 3.68Å; Y716-W721 AromaticContact CD2-CE3 3.91Å; Y716-W721 HydrophobicContact CD2-CE3 3.91Å; Y716-W721 HydrophobicContact CD2-CZ3 4.21Å; Y716-W721 HydrophobicContact CG-CE3 4.36Å; C717-W721 WeakPolarHBondContact O-CB 3.39Å; C717-W721 PolarHBondContact O-N 3.42Å; E718-W721 PolarHBondContact O-N 3.39Å; W721-A723 PolarHBondContact O-N 2.86Å; W721-I724 PolarHBondContact O-N 3.49Å; W721-H725 AromaticContact CD2-ND1 3.37Å; W721-H725 AromaticContact CE2-CG 3.76Å; W721-H725 AromaticContact CE2-ND1 3.52Å; W721-H725 AromaticContact CE3-CE1 3.62Å; W721-H725 AromaticContact CE3-ND1 3.48Å; W721-H725 AromaticContact CG-ND1 3.91Å; W721-H725 AromaticContact CH2-CE1 3.78Å; W721-H725 AromaticContact CH2-ND1 3.78Å; W721-H725 HydrophobicContact CZ2-CB 4.01Å; W721-H725 AromaticContact CZ2-CG 3.68Å; W721-H725 AromaticContact CZ2-ND1 3.7Å; W721-H725 AromaticContact CZ3-CE1 3.53Å; W721-H725 AromaticContact CZ3-ND1 3.71Å; W721-H725 WeakPolarHBondContact O-CB 3.48Å; W721-H725 PolarHBondContact O-N 3.44Å; W721-H725 PolarHBondContact O-ND1 3.19Å; W721-H733 HydrophobicContact CH2-CB 4.28Å; W721-H733 HydrophobicContact CZ2-CB 4.49Å; W721-P735 HydrophobicContact CD2-CB 4.15Å; W721-P735 HydrophobicContact CE3-CB 4.01Å; W721-P735 VanDerWaalsContact CH2-CA 3.41Å; W721-P735 HydrophobicContact CH2-CB 3.66Å; W721-P735 HydrophobicContact CH2-CG 4.3Å; W721-P735 VanDerWaalsContact CH2-N 3.31Å; W721-P735 HydrophobicContact CZ2-CB 3.77Å; W721-P735 VanDerWaalsContact CZ2-CD 3.47Å; W721-P735 HydrophobicContact CZ2-CG 3.96Å; W721-P735 HydrophobicContact CZ3-CB 3.73Å
722	A	92.6	Very high	90.6	Very high	57 Å²	57	63.3 Å²	63.3	47%	0.471	34%	0.337	S	S	.	.	H	α-helix	trans	-60.1	-43.9	178.2	0	0	0	0	0	112.2	E718 I724 S726	E718-A722 WeakPolarHBondContact O-CB 3.37Å; E718-A722 PolarHBondContact O-N 2.87Å; A722-I724 VanDerWaalsContact C-N 3.25Å; A722-I724 PolarHBondContact O-N 2.98Å; A722-S726 WeakPolarHBondContact O-CB 3.45Å; A722-S726 PolarHBondContact O-N 3.33Å; A722-S726 PolarHBondContact O-OG 2.88Å
723	A	92.1	Very high	90.6	Very high	44 Å²	44	63.6 Å²	63.6	36%	0.364	34%	0.337	S	S	.	.	H	α-helix	trans	-69.1	-16.4	-177.7	0	0	0	0	0	115.3	Y719 C720 W721 R727	Y719-A723 VanDerWaalsContact O-CB 3.3Å; Y719-A723 WeakPolarHBondContact O-CB 3.4Å; Y719-A723 PolarHBondContact O-N 2.82Å; C720-A723 PolarHBondContact O-N 2.89Å; W721-A723 PolarHBondContact O-N 2.86Å; A723-R727 PolarHBondContact O-NE 3.28Å
724	I	90.9	Very high	90.4	Very high	16 Å²	16	70.8 Å²	70.8	8%	0.082	37%	0.367	C	S	.	.	H	α-helix	trans	-111.4	-43.2	-175.3	-67.3	167.6	0	0	0	111.6	E692 Y716 C720 W721 A722 R727	E692-I724 HydrophobicContact CB-CD1 4.45Å; E692-I724 HydrophobicContact CG-CD1 3.45Å; E692-I724 VanDerWaalsContact CG-CD1 3.45Å; E692-I724 WeakPolarHBondContact OE1-CD1 3.47Å; Y716-I724 HydrophobicContact CD1-CD1 4.05Å; Y716-I724 HydrophobicContact CE1-CD1 3.7Å; C720-I724 WeakPolarHBondContact O-CB 3.47Å; C720-I724 WeakPolarHBondContact O-CD1 3.24Å; C720-I724 WeakPolarHBondContact O-CG1 3.41Å; C720-I724 PolarHBondContact O-N 3.16Å; C720-I724 VanDerWaalsContact O-N 3.14Å; W721-I724 PolarHBondContact O-N 3.49Å; A722-I724 VanDerWaalsContact C-N 3.25Å; A722-I724 PolarHBondContact O-N 2.98Å; I724-R727 WeakPolarHBondContact O-CB 3.31Å; I724-R727 WeakPolarHBondContact O-CG 3.44Å; I724-R727 PolarHBondContact O-N 3.45Å
725	H	92.4	Very high	90.3	Very high	13 Å²	13	70 Å²	70	6%	0.06	37%	0.367	C	S	.	.	H	α-helix	trans	-88.5	-4.4	-178	-60.8	101.8	0	0	0	113.8	C707 Y716 W721 E731 H733	C707-H725 PolarHBondContact SG-NE2 3.06Å; C707-H725 VanDerWaalsContact SG-NE2 3.36Å; Y716-H725 AromaticContact CD2-CE1 3.85Å; Y716-H725 AromaticContact CE2-CE1 3.59Å; Y716-H725 AromaticContact CZ-CE1 3.96Å; W721-H725 AromaticContact CD2-ND1 3.37Å; W721-H725 AromaticContact CE2-CG 3.76Å; W721-H725 AromaticContact CE2-ND1 3.52Å; W721-H725 AromaticContact CE3-CE1 3.62Å; W721-H725 AromaticContact CE3-ND1 3.48Å; W721-H725 AromaticContact CG-ND1 3.91Å; W721-H725 AromaticContact CH2-CE1 3.78Å; W721-H725 AromaticContact CH2-ND1 3.78Å; W721-H725 HydrophobicContact CZ2-CB 4.01Å; W721-H725 AromaticContact CZ2-CG 3.68Å; W721-H725 AromaticContact CZ2-ND1 3.7Å; W721-H725 AromaticContact CZ3-CE1 3.53Å; W721-H725 AromaticContact CZ3-ND1 3.71Å; W721-H725 WeakPolarHBondContact O-CB 3.48Å; W721-H725 PolarHBondContact O-N 3.44Å; W721-H725 PolarHBondContact O-ND1 3.19Å; H725-E731 VanDerWaalsContact O-CA 3.31Å; H725-E731 WeakPolarHBondContact O-CA 3.3Å; H725-H733 VanDerWaalsContact CD2-CB 3.45Å; H725-H733 WeakPolarHBondContact CD2-CB 3.28Å; H725-H733 AromaticContact CD2-CG 3.64Å; H725-H733 AromaticContact CD2-ND1 3.32Å; H725-H733 PolarHBondContact CD2-ND1 3.32Å; H725-H733 VanDerWaalsContact CD2-ND1 3.32Å; H725-H733 AromaticContact NE2-CG 3.99Å; H725-H733 AromaticContact NE2-ND1 3.3Å; H725-H733 PolarHBondContact NE2-ND1 3.08Å
726	S	88.9	Confident	90	Very high	93 Å²	93	72.9 Å²	72.9	65%	0.65	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-4.7	162.4	58.9	0	0	0	0	113.7	A722	A722-S726 WeakPolarHBondContact O-CB 3.45Å; A722-S726 PolarHBondContact O-N 3.33Å; A722-S726 PolarHBondContact O-OG 2.88Å
727	R	85.9	Confident	89.5	Confident	161 Å²	161	77 Å²	77	61%	0.608	41%	0.408	S	S	*	.	S	Bend	trans	-85.1	139	-179.9	-57.3	-178.1	-175.8	-156	-2.4	110.5	A723 I724 G729 R730 E731	A723-R727 PolarHBondContact O-NE 3.28Å; I724-R727 WeakPolarHBondContact O-CB 3.31Å; I724-R727 WeakPolarHBondContact O-CG 3.44Å; I724-R727 PolarHBondContact O-N 3.45Å; R727-G729 PolarHBondContact O-N 2.75Å; R727-R730 PolarHBondContact O-N 3.01Å; R727-E731 PolarHBondContact O-N 3.02Å
728	A	79.6	Confident	88.1	Confident	91 Å²	91	82.2 Å²	82.2	75%	0.752	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.1	136	175.7	0	0	0	0	0	111.6	R730 E731	A728-R730 VanDerWaalsContact C-N 3.3Å; A728-R730 PolarHBondContact O-N 3.35Å; A728-E731 WeakPolarHBondContact CA-OE1 3.47Å
729	G	83.4	Confident	86	Confident	57 Å²	57	83 Å²	83	59%	0.588	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.6	-11.7	-174.1	0	0	0	0	0	115.1	R727 E731	R727-G729 PolarHBondContact O-N 2.75Å; G729-E731 PolarHBondContact N-OE1 2.82Å
730	R	87.8	Confident	83.6	Confident	90 Å²	90	78.4 Å²	78.4	34%	0.34	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.4	-5.1	172.3	-63.4	-167.3	-173.3	-155.4	2.2	113.8	R727 A728 F732 H733	R727-R730 PolarHBondContact O-N 3.01Å; A728-R730 VanDerWaalsContact C-N 3.3Å; A728-R730 PolarHBondContact O-N 3.35Å; R730-F732 PolarHBondContact O-N 3.22Å; R730-H733 VanDerWaalsContact O-CB 3.27Å; R730-H733 WeakPolarHBondContact O-CB 3.4Å; R730-H733 PolarHBondContact O-CD2 2.78Å; R730-H733 VanDerWaalsContact O-CG 3.26Å; R730-H733 PolarHBondContact O-N 3.45Å; R730-H733 VanDerWaalsContact O-N 3.07Å
731	E	86.6	Confident	81.1	Confident	103 Å²	103	81.9 Å²	81.9	48%	0.481	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-24	-178	67	-126.2	111.3	0	0	114.8	H725 R727 A728 G729 H733	H725-E731 VanDerWaalsContact O-CA 3.31Å; H725-E731 WeakPolarHBondContact O-CA 3.3Å; R727-E731 PolarHBondContact O-N 3.02Å; A728-E731 WeakPolarHBondContact CA-OE1 3.47Å; G729-E731 PolarHBondContact N-OE1 2.82Å; E731-H733 VanDerWaalsContact C-N 3.29Å; E731-H733 PolarHBondContact O-N 3.45Å
732	F	88.1	Confident	78.2	Confident	174 Å²	174	88 Å²	88	76%	0.763	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.7	-3.2	177.8	-54.9	-73.6	0	0	0	113.6	R730	R730-F732 PolarHBondContact O-N 3.22Å
733	H	92.4	Very high	75.2	Confident	20 Å²	20	94 Å²	94	9%	0.093	52%	0.515	C	S	.	.	P	Polyproline II helix	trans	-73.6	130.1	179	-66.2	-163.4	0	0	0	109.8	C707 N709 T711 W721 H725 R730 E731	C707-H733 PolarHBondContact SG-ND1 3.14Å; N709-H733 PolarHBondContact ND2-CD2 2.83Å; N709-H733 VanDerWaalsContact ND2-CD2 3.32Å; N709-H733 PolarHBondContact ND2-NE2 3.23Å; T711-H733 PolarHBondContact OG1-CE1 3.33Å; T711-H733 VanDerWaalsContact OG1-CE1 3.28Å; W721-H733 HydrophobicContact CH2-CB 4.28Å; W721-H733 HydrophobicContact CZ2-CB 4.49Å; H725-H733 VanDerWaalsContact CD2-CB 3.45Å; H725-H733 WeakPolarHBondContact CD2-CB 3.28Å; H725-H733 AromaticContact CD2-CG 3.64Å; H725-H733 AromaticContact CD2-ND1 3.32Å; H725-H733 PolarHBondContact CD2-ND1 3.32Å; H725-H733 VanDerWaalsContact CD2-ND1 3.32Å; H725-H733 AromaticContact NE2-CG 3.99Å; H725-H733 AromaticContact NE2-ND1 3.3Å; H725-H733 PolarHBondContact NE2-ND1 3.08Å; R730-H733 VanDerWaalsContact O-CB 3.27Å; R730-H733 WeakPolarHBondContact O-CB 3.4Å; R730-H733 PolarHBondContact O-CD2 2.78Å; R730-H733 VanDerWaalsContact O-CG 3.26Å; R730-H733 PolarHBondContact O-N 3.45Å; R730-H733 VanDerWaalsContact O-N 3.07Å; E731-H733 VanDerWaalsContact C-N 3.29Å; E731-H733 PolarHBondContact O-N 3.45Å
734	K	89.9	Confident	72.4	Confident	175 Å²	175	97.6 Å²	97.6	76%	0.761	53%	0.534	S	S	*	.	P	Polyproline II helix	trans	-101	131.9	176	-64	-173.3	178.6	-176.1	0	109.7
735	P	90	Very high	69.8	Low	49 Å²	49	106.8 Å²	106.8	32%	0.318	57%	0.568	S	S	.	*	P	Polyproline II helix	trans	-71.1	131.7	174.2	28.9	-30.6	0	0	0	108.9	F705 W721 V737	F705-P735 HydrophobicContact CB-CB 3.97Å; F705-P735 HydrophobicContact CD1-CB 3.93Å; F705-P735 HydrophobicContact CG-CB 4.04Å; W721-P735 HydrophobicContact CD2-CB 4.15Å; W721-P735 HydrophobicContact CE3-CB 4.01Å; W721-P735 VanDerWaalsContact CH2-CA 3.41Å; W721-P735 HydrophobicContact CH2-CB 3.66Å; W721-P735 HydrophobicContact CH2-CG 4.3Å; W721-P735 VanDerWaalsContact CH2-N 3.31Å; W721-P735 HydrophobicContact CZ2-CB 3.77Å; W721-P735 VanDerWaalsContact CZ2-CD 3.47Å; W721-P735 HydrophobicContact CZ2-CG 3.96Å; W721-P735 HydrophobicContact CZ3-CB 3.73Å; P735-V737 HydrophobicContact CB-CG2 4.34Å; P735-V737 HydrophobicContact CG-CG2 4.28Å; P735-V737 PolarHBondContact O-N 3Å
736	L	89.2	Confident	66.6	Low	68 Å²	68	114 Å²	114	36%	0.356	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-78.6	100.2	158.8	-80.7	67.7	0	0	0	105.8	V684 F706 A708	V684-L736 HydrophobicContact CG2-CD2 4.09Å; F706-L736 HydrophobicContact CB-CB 4.41Å; F706-L736 HydrophobicContact CD1-CB 4.45Å; F706-L736 HydrophobicContact CD1-CD2 4.36Å; F706-L736 PolarHBondContact N-O 3.04Å; F706-L736 PolarHBondContact O-N 2.69Å; A708-L736 HydrophobicContact CB-CD1 3.5Å; A708-L736 VanDerWaalsContact CB-CD1 3.5Å; A708-L736 HydrophobicContact CB-CD2 3.94Å; A708-L736 HydrophobicContact CB-CG 4.37Å
737	V	83	Confident	64.1	Low	87 Å²	87	115.6 Å²	115.6	53%	0.527	60%	0.601	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-83.6	128.6	168.5	-161.1	0	0	0	0	107.2	F705 P735 E739	F705-V737 HydrophobicContact CD1-CB 4.36Å; F705-V737 HydrophobicContact CD1-CG1 4.19Å; F705-V737 HydrophobicContact CD1-CG2 3.8Å; F705-V737 HydrophobicContact CE1-CB 4.42Å; F705-V737 HydrophobicContact CE1-CG1 3.97Å; F705-V737 HydrophobicContact CE1-CG2 3.75Å; P735-V737 HydrophobicContact CB-CG2 4.34Å; P735-V737 HydrophobicContact CG-CG2 4.28Å; P735-V737 PolarHBondContact O-N 3Å; V737-E739 PolarHBondContact O-N 3.26Å
738	K	64	Low	61.4	Low	111 Å²	111	112.3 Å²	112.3	48%	0.483	60%	0.603	S	S	.	*			trans	-79.9	113.1	168	-169.7	169.5	-167.8	178	0	108.8	D686 G740	D686-K738 WeakPolarHBondContact OD1-CD 3.42Å; D686-K738 WeakPolarHBondContact OD1-CE 3.46Å; D686-K738 IonicContact OD1-NZ 3.68Å; D686-K738 PolarHBondContact OD1-NZ 2.92Å; D686-K738 IonicContact OD2-NZ 3.59Å; D686-K738 PolarHBondContact OD2-NZ 3.11Å; K738-G740 PolarHBondContact O-N 3.33Å; K738-G740 VanDerWaalsContact O-N 3.16Å
739	E	48.5	Very low	59.1	Low	148 Å²	148	115.3 Å²	115.3	69%	0.692	60%	0.599	S	S	*	*			trans	-59	118.1	157.7	-83.8	-164.2	110.6	0	0	107	V737 R743	V737-E739 PolarHBondContact O-N 3.26Å; E739-R743 IonicContact OE1-CZ 2.67Å; E739-R743 IonicContact OE1-NH2 2.86Å; E739-R743 PolarHBondContact OE1-NH2 3.26Å
740	G	42.6	Very low	56.4	Low	55 Å²	55	124.1 Å²	124.1	57%	0.567	62%	0.615	S	S	*	*			trans	-59.3	154	-171.7	0	0	0	0	0	113.2	K738 D742	K738-G740 PolarHBondContact O-N 3.33Å; K738-G740 VanDerWaalsContact O-N 3.16Å; G740-D742 PolarHBondContact O-N 3.45Å
741	G	41.4	Very low	54.1	Low	75 Å²	75	130.2 Å²	130.2	77%	0.773	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.3	4.5	-177.1	0	0	0	0	0	116.4
742	D	32.5	Very low	51.5	Low	161 Å²	161	136 Å²	136	86%	0.861	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	17.6	-176	-90.9	-52.2	0	0	0	114.7	G740 P744	G740-D742 PolarHBondContact O-N 3.45Å; D742-P744 WeakPolarHBondContact O-CD 3.17Å
743	R	29.4	Very low	49.6	Very low	184 Å²	184	134.1 Å²	134.1	69%	0.694	67%	0.668	S	S	*	*	S	Bend	trans	-86.9	104.4	146.7	-70.8	-164.2	-166	174.2	17.3	108	E739 R745	E739-R743 IonicContact OE1-CZ 2.67Å; E739-R743 IonicContact OE1-NH2 2.86Å; E739-R743 PolarHBondContact OE1-NH2 3.26Å; R743-R745 PolarHBondContact O-N 2.6Å
744	P	33.8	Very low	47.4	Very low	118 Å²	118	140.1 Å²	140.1	77%	0.766	70%	0.698	S	S	*	*			trans	-54.1	111.9	152.8	25	-32.5	0	0	0	106.2	D742 H746	D742-P744 WeakPolarHBondContact O-CD 3.17Å; P744-H746 PolarHBondContact O-N 3.23Å
745	R	35.8	Very low	45	Very low	209 Å²	209	138.2 Å²	138.2	79%	0.789	69%	0.694	S	S	*	*			trans	-54.9	122.7	171.4	-85.4	-174.3	-76.6	-146.4	-9.1	105.7	R743 I747	R743-R745 PolarHBondContact O-N 2.6Å; R745-I747 WeakPolarHBondContact O-CG1 3.33Å; R745-I747 PolarHBondContact O-N 3.4Å
746	H	26.4	Very low	42.4	Very low	166 Å²	166	143.4 Å²	143.4	77%	0.769	72%	0.716	S	S	*	*			trans	-67.4	90.4	-176.3	-173.4	-75.5	0	0	0	108.5	P744 S748	P744-H746 PolarHBondContact O-N 3.23Å; H746-S748 VanDerWaalsContact C-N 3.3Å; H746-S748 PolarHBondContact ND1-OG 3.42Å; H746-S748 PolarHBondContact O-N 3.26Å; H746-S748 PolarHBondContact O-OG 3.31Å
747	I	35.9	Very low	39.4	Very low	125 Å²	125	148.1 Å²	148.1	64%	0.641	74%	0.739	S	S	*	*			trans	-68.1	94.7	175.7	-69.1	161.3	0	0	0	105.7	R745 F749	R745-I747 WeakPolarHBondContact O-CG1 3.33Å; R745-I747 PolarHBondContact O-N 3.4Å; I747-F749 HydrophobicContact CG2-CB 4.25Å; I747-F749 HydrophobicContact CG2-CD2 3.16Å; I747-F749 HydrophobicContact CG2-CE2 3.57Å; I747-F749 HydrophobicContact CG2-CG 3.79Å; I747-F749 HydrophobicContact CG2-CZ 4.48Å; I747-F749 PolarHBondContact O-N 2.96Å
748	S	29.8	Very low	36.5	Very low	92 Å²	92	152.2 Å²	152.2	64%	0.643	75%	0.753	S	S	*	*			trans	-74.8	43.6	-177.5	-61.1	0	0	0	0	112.6	H746 R750	H746-S748 VanDerWaalsContact C-N 3.3Å; H746-S748 PolarHBondContact ND1-OG 3.42Å; H746-S748 PolarHBondContact O-N 3.26Å; H746-S748 PolarHBondContact O-OG 3.31Å; S748-R750 PolarHBondContact O-N 2.94Å
749	F	30.8	Very low	34.6	Very low	154 Å²	154	155.1 Å²	155.1	68%	0.675	77%	0.772	S	S	*	*			trans	-73.2	76.3	163.1	-69.1	-41.1	0	0	0	109.3	I747 W751	I747-F749 HydrophobicContact CG2-CB 4.25Å; I747-F749 HydrophobicContact CG2-CD2 3.16Å; I747-F749 HydrophobicContact CG2-CE2 3.57Å; I747-F749 HydrophobicContact CG2-CG 3.79Å; I747-F749 HydrophobicContact CG2-CZ 4.48Å; I747-F749 PolarHBondContact O-N 2.96Å; F749-W751 VanDerWaalsContact C-N 3.29Å; F749-W751 PolarHBondContact O-N 3.18Å; F749-W751 VanDerWaalsContact O-N 3.11Å
750	R	26.5	Very low	33.5	Very low	242 Å²	242	155.7 Å²	155.7	91%	0.913	78%	0.779	S	S	*	*			trans	-74	91	156.7	-83.6	-168.4	166.2	-150.4	-3.8	108.3	S748	S748-R750 PolarHBondContact O-N 2.94Å
751	W	39.9	Very low	32.8	Very low	218 Å²	218	164.1 Å²	164.1	83%	0.826	80%	0.796	S	S	*	*			trans	-60.5	127.6	157.6	-69.9	86.2	0	0	0	109	F749	F749-W751 VanDerWaalsContact C-N 3.29Å; F749-W751 PolarHBondContact O-N 3.18Å; F749-W751 VanDerWaalsContact O-N 3.11Å
752	N	30.9	Very low	32	Very low	225 Å²	225	172.2 Å²	172.2	100%	1.203	80%	0.798	S	S	*	*			trans	-160.2	0	166.1	-151.3	128.2	0	0	0	110.1

Retrieved 752 of 752 residues in 624.6 ms (Link to these results)

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