A0A087XJQ3_POEFO Loading...

YTH domain-containing family protein

Specifically recognizes and binds N6-methyladenosine (m6A)-containing RNAs, and regulates mRNA stability. M6A is a modification present at internal sites of mRNAs and some non-coding RNAs and plays a role in mRNA stability and processing.

AlphaFold DB , UniProt , Accession A0A087XJQ3, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 603 aa.

Structure Viewer

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.3	Very low	41.6	Very low	248 Å²	248	150.3 Å²	150.3	100%	1.222	82%	0.82	S	S	*	*				0	145.2	0	-75.9	169.5	163.5	0	0	108.2
2	S	36.3	Very low	40.9	Very low	129 Å²	129	143 Å²	143	90%	0.902	81%	0.806	S	S	*	*			trans	-107.9	136.2	-179	-49.9	0	0	0	0	110.3
3	A	39	Very low	40.5	Very low	101 Å²	101	148.2 Å²	148.2	84%	0.835	82%	0.819	S	S	*	*			trans	-156.4	145.7	166	0	0	0	0	0	109.2
4	T	45.5	Very low	40	Very low	127 Å²	127	142.6 Å²	142.6	78%	0.779	81%	0.813	S	S	*	*			trans	-147.2	132.8	-167.4	49.5	0	0	0	0	113.7
5	T	42.2	Very low	40	Very low	138 Å²	138	143.8 Å²	143.8	85%	0.847	82%	0.816	S	S	*	*			trans	-157.5	124.6	160.2	-0.6	0	0	0	0	106.2
6	V	45.2	Very low	39.6	Very low	126 Å²	126	145.6 Å²	145.6	76%	0.764	81%	0.811	S	S	*	*			cis	73.4	113.2	37.1	-175.2	0	0	0	0	111.3
7	D	45.8	Very low	39.3	Very low	141 Å²	141	144.2 Å²	144.2	75%	0.754	81%	0.807	S	S	*	*			cis	-146.5	-136.1	-13.3	-161	20.9	0	0	0	108.5
8	Q	43.7	Very low	39	Very low	129 Å²	129	145.4 Å²	145.4	60%	0.603	81%	0.805	S	S	*	*			cis	-159.7	136.3	4.9	-149.8	-170.3	128.2	0	0	113.4
9	R	39.5	Very low	38.6	Very low	201 Å²	201	145.8 Å²	145.8	76%	0.758	81%	0.806	S	S	*	*			trans	67.3	144.7	149.1	-98.8	-179.5	171	125.2	-10.2	120.5
10	T	40.7	Very low	38.2	Very low	108 Å²	108	142.2 Å²	142.2	66%	0.663	80%	0.804	S	S	*	*			cis	-146.4	147.3	2.5	-37.1	0	0	0	0	113.6
11	K	37.8	Very low	37.8	Very low	205 Å²	205	141.8 Å²	141.8	89%	0.891	81%	0.81	S	S	*	*			trans	-13.3	157.3	158.3	-50.9	176.6	178.5	-175.8	0	119
12	G	33.6	Very low	37.8	Very low	63 Å²	63	137.3 Å²	137.3	65%	0.649	79%	0.788	S	S	*	*			cis	155.2	135.6	4.3	0	0	0	0	0	109.4
13	Q	35.6	Very low	37.8	Very low	210 Å²	210	138.6 Å²	138.6	98%	0.981	78%	0.779	S	S	*	*				49.4	139.2	88.1	-69.4	-171.1	-8	0	0	116.1
14	G	33.5	Very low	37.5	Very low	71 Å²	71	140.7 Å²	140.7	73%	0.732	77%	0.772	S	S	*	*			cis	152.7	137.8	-10.7	0	0	0	0	0	115.7
15	N	39	Very low	36.9	Very low	160 Å²	160	142 Å²	142	86%	0.856	77%	0.767	S	S	*	*			trans	57	150.2	147.7	-128	-3.4	0	0	0	124.3
16	K	34.6	Very low	36.3	Very low	172 Å²	172	142.1 Å²	142.1	75%	0.748	76%	0.762	S	S	*	*			trans	91.1	100.7	147.5	-86.1	-166	173.1	-170.7	0	125.7
17	V	33.9	Very low	35.6	Very low	122 Å²	122	140 Å²	140	74%	0.739	77%	0.766	S	S	*	*				61.9	139	126.2	-53	0	0	0	0	127.1
18	Q	33.8	Very low	35	Very low	166 Å²	166	139.5 Å²	139.5	78%	0.776	77%	0.768	S	S	*	*				113.5	123.6	127.1	-159.5	157.2	-13.9	0	0	122
19	N	32.3	Very low	34.2	Very low	154 Å²	154	141.1 Å²	141.1	82%	0.824	78%	0.78	S	S	*	*			trans	52.6	151.8	164.8	-75.7	3.1	0	0	0	120.8
20	G	30.7	Very low	33.7	Very low	73 Å²	73	137.5 Å²	137.5	75%	0.753	78%	0.776	S	S	*	*			cis	141.5	129.7	-10.8	0	0	0	0	0	114.8
21	S	30.1	Very low	33.3	Very low	134 Å²	134	139.9 Å²	139.9	94%	0.937	79%	0.785	S	S	*	*			trans	-168.7	175.9	163.6	-159.6	0	0	0	0	113.3
22	M	42.1	Very low	32.9	Very low	153 Å²	153	137.1 Å²	137.1	75%	0.754	78%	0.78	S	S	*	*			trans	-157.8	140.8	-162.3	176.3	-163.1	75.7	0	0	113.8
23	H	34.9	Very low	32.8	Very low	156 Å²	156	143.2 Å²	143.2	72%	0.722	79%	0.789	S	S	*	*			trans	164.7	161.7	158	-94.9	-73.8	0	0	0	109.2
24	Q	32.3	Very low	32.9	Very low	145 Å²	145	141.1 Å²	141.1	68%	0.678	78%	0.779	S	S	*	*			cis	-168.2	163.1	-34.8	-148.6	-178.1	48	0	0	110.5
25	K	33.5	Very low	33.7	Very low	156 Å²	156	141.7 Å²	141.7	68%	0.678	77%	0.77	S	S	*	*			trans	74	125.3	155.1	-70.3	-154.1	162	-152.6	0	123.2
26	D	29.8	Very low	33.2	Very low	139 Å²	139	143.8 Å²	143.8	74%	0.743	77%	0.767	S	S	*	*				42.6	126.8	115.8	-36.9	-29.3	0	0	0	121.1
27	G	30.6	Very low	33.1	Very low	82 Å²	82	142.8 Å²	142.8	85%	0.845	77%	0.769	S	S	*	*			trans	-171.7	109.8	164.2	0	0	0	0	0	111.8
28	V	32.5	Very low	32.8	Very low	130 Å²	130	142.7 Å²	142.7	79%	0.788	77%	0.774	S	S	*	*			trans	-82.4	156.9	175.3	-114.3	0	0	0	0	111.3
29	N	27	Very low	32.6	Very low	163 Å²	163	138.5 Å²	138.5	87%	0.872	78%	0.775	S	S	*	*			trans	-155.1	120.6	150.9	-126.9	-23.8	0	0	0	109
30	D	30.2	Very low	32.5	Very low	125 Å²	125	140.5 Å²	140.5	67%	0.668	78%	0.779	S	S	*	*			trans	-116	154.6	177	-67.9	-79.7	0	0	0	108.6
31	D	32.1	Very low	32.5	Very low	158 Å²	158	143 Å²	143	85%	0.845	78%	0.78	S	S	*	*			trans	50.9	122.6	167	-71.4	-59.6	0	0	0	120.8
32	D	29.5	Very low	32.6	Very low	147 Å²	147	144 Å²	144	79%	0.786	78%	0.775	S	S	*	*				-155.2	118.7	129.3	-137.3	-51.7	0	0	0	113.1
33	F	30.3	Very low	32.1	Very low	191 Å²	191	144.6 Å²	144.6	84%	0.838	78%	0.776	S	S	*	*			trans	55.2	112.2	154.7	-92.2	-115.9	0	0	0	125.5
34	E	37.4	Very low	31.8	Very low	167 Å²	167	143.8 Å²	143.8	78%	0.78	78%	0.777	S	S	*	*			trans	-60.7	-173.1	136.1	-86.2	-93.6	159.5	0	0	112.3
35	P	51.1	Low	31.6	Very low	83 Å²	83	143.3 Å²	143.3	54%	0.539	78%	0.779	S	S	.	*			cis	-130.8	-177.8	-5.1	38.7	-20.9	0	0	0	115
36	Y	28.1	Very low	31.4	Very low	203 Å²	203	140.2 Å²	140.2	80%	0.796	78%	0.777	S	S	*	*				175	103.9	117.6	-104.2	-75.2	0	0	0	115.2
37	L	32	Very low	31.4	Very low	152 Å²	152	143.1 Å²	143.1	80%	0.796	78%	0.779	S	S	*	*			trans	34.7	151.6	141.4	-79.7	165	0	0	0	125.4
38	S	29.1	Very low	31.8	Very low	120 Å²	120	144.4 Å²	144.4	84%	0.839	77%	0.773	S	S	*	*			trans	80.2	139.7	164.6	78.7	0	0	0	0	117.4
39	G	29.1	Very low	32.2	Very low	77 Å²	77	144.2 Å²	144.2	79%	0.794	77%	0.774	S	S	*	*			cis	141.4	86	-11	0	0	0	0	0	113.8
40	Q	30.2	Very low	32.4	Very low	196 Å²	196	145.7 Å²	145.7	92%	0.916	78%	0.778	S	S	*	*			trans	-148.6	146.5	170.7	-137.4	171.9	22.9	0	0	113.6
41	T	30.6	Very low	32.8	Very low	125 Å²	125	145.1 Å²	145.1	77%	0.767	78%	0.784	S	S	*	*			trans	-90.5	145.3	-174.9	47.1	0	0	0	0	112.3
42	N	31.7	Very low	32.7	Very low	155 Å²	155	145 Å²	145	83%	0.829	78%	0.783	S	S	*	*			trans	-131.6	105.3	154.6	-93.4	-67.9	0	0	0	107.5
43	Q	31.5	Very low	33.3	Very low	167 Å²	167	143.4 Å²	143.4	78%	0.78	78%	0.781	S	S	*	*				82.4	87.6	87.4	-76.4	-85.1	5.3	0	0	110.6
44	N	29.5	Very low	33.5	Very low	139 Å²	139	144.2 Å²	144.2	74%	0.743	78%	0.78	S	S	*	*			trans	-67.9	133.9	168.9	179	27.9	0	0	0	109.4
45	N	28.9	Very low	33.5	Very low	135 Å²	135	144 Å²	144	72%	0.722	78%	0.781	S	S	*	*			trans	-140.2	104.7	172.5	-153.6	1.5	0	0	0	110.6
46	S	28	Very low	32.9	Very low	91 Å²	91	144.9 Å²	144.9	64%	0.636	79%	0.787	S	S	*	*			trans	-92.9	141.2	178.7	-63.6	0	0	0	0	110.7
47	Y	30.9	Very low	33	Very low	200 Å²	200	140.8 Å²	140.8	78%	0.784	79%	0.788	S	S	*	*			trans	-118.8	145.1	162.8	-87.1	-92.6	0	0	0	109.6
48	P	38.9	Very low	33.2	Very low	109 Å²	109	144.2 Å²	144.2	71%	0.708	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-80.8	150.8	-166.2	32.1	-36.2	0	0	0	112.9
49	P	40.3	Very low	33.5	Very low	125 Å²	125	149.2 Å²	149.2	81%	0.812	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-73.7	127.4	168.1	30.8	-32.4	0	0	0	110.5
50	M	31.8	Very low	33.6	Very low	194 Å²	194	150 Å²	150	96%	0.956	79%	0.792	S	S	*	*	P	Polyproline II helix	trans	-73.9	128.3	162.6	-81.3	-175.8	163.7	0	0	109.6
51	S	37	Very low	34.4	Very low	114 Å²	114	146.3 Å²	146.3	80%	0.797	79%	0.785	S	S	*	*			trans	-93.4	112.6	173.6	55.4	0	0	0	0	110.8
52	D	31.2	Very low	34.7	Very low	156 Å²	156	146.2 Å²	146.2	83%	0.834	79%	0.79	S	S	*	*			trans	-86.7	119.1	173.4	-168.1	11.7	0	0	0	110.1	Y54	D52-Y54 PolarHBondContact O-N 3.17Å
53	P	41.3	Very low	35.1	Very low	113 Å²	113	147 Å²	147	73%	0.734	79%	0.792	S	S	*	*			trans	-93.6	64	-160	37.2	-38	0	0	0	114.5
54	Y	34.8	Very low	35.1	Very low	208 Å²	208	141.7 Å²	141.7	82%	0.816	78%	0.782	S	S	*	*			trans	-151.7	71.6	172.5	-139.1	-90.5	0	0	0	117.6	D52	D52-Y54 PolarHBondContact O-N 3.17Å
55	M	37.6	Very low	35.4	Very low	163 Å²	163	144.3 Å²	144.3	80%	0.803	79%	0.787	S	S	*	*			trans	-154	138.1	153	-102.9	-58	106.7	0	0	111.8
56	P	38.3	Very low	36.1	Very low	101 Å²	101	143.9 Å²	143.9	66%	0.656	79%	0.792	S	S	*	*			trans	-78.1	135.2	179.7	-13.9	30.2	0	0	0	113.6
57	S	31.1	Very low	36.3	Very low	117 Å²	117	149.2 Å²	149.2	82%	0.818	80%	0.799	S	S	*	*			trans	-83.6	113.5	173.7	-67	0	0	0	0	112.2
58	Y	35.1	Very low	36.4	Very low	224 Å²	224	145.5 Å²	145.5	88%	0.878	80%	0.803	S	S	*	*			trans	-97.7	94.9	164.3	-90.6	-86.9	0	0	0	110.6
59	Y	35.2	Very low	36.4	Very low	225 Å²	225	148.5 Å²	148.5	88%	0.882	81%	0.812	S	S	*	*			trans	-126.6	129.3	162.9	-98.3	-85.5	0	0	0	109
60	A	31.2	Very low	36	Very low	92 Å²	92	145.8 Å²	145.8	76%	0.76	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-90.3	145.7	175.2	0	0	0	0	0	110.7
61	P	48.7	Very low	36	Very low	119 Å²	119	145.5 Å²	145.5	77%	0.773	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-81.3	151.3	-175.4	32.8	-35.8	0	0	0	113.5
62	S	36.3	Very low	36.1	Very low	124 Å²	124	144.6 Å²	144.6	87%	0.867	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-74.3	142.9	174.4	-45.3	0	0	0	0	112.4
63	I	38.6	Very low	36.3	Very low	172 Å²	172	141 Å²	141	88%	0.882	79%	0.794	S	S	*	*			trans	-128.2	151.8	168.2	-60.1	176.5	0	0	0	107.4
64	G	31.5	Very low	36.1	Very low	54 Å²	54	148 Å²	148	56%	0.557	81%	0.806	S	S	*	*			trans	-149.8	178.2	-174.5	0	0	0	0	0	116.1
65	F	36.1	Very low	36.3	Very low	195 Å²	195	143.3 Å²	143.3	86%	0.855	80%	0.804	S	S	*	*			trans	72.5	158.3	-179.9	-51.3	-64.9	0	0	0	115.7
66	P	44.8	Very low	36.3	Very low	126 Å²	126	142.1 Å²	142.1	82%	0.818	81%	0.806	S	S	*	*			cis	-121.9	-169.9	5.8	41.7	-27	0	0	0	115.9
67	Y	32.6	Very low	36	Very low	202 Å²	202	141.9 Å²	141.9	79%	0.792	81%	0.813	S	S	*	*			trans	-86	166	-172.7	-84.9	-101.5	0	0	0	115.7
68	S	31.5	Very low	36.1	Very low	123 Å²	123	140.1 Å²	140.1	86%	0.86	81%	0.813	S	S	*	*			trans	-150.2	159	144.9	-76.5	0	0	0	0	109.9
69	L	40.2	Very low	36	Very low	172 Å²	172	136.3 Å²	136.3	90%	0.901	81%	0.808	S	S	*	*			trans	-145.7	135.7	-157.6	-165.6	159.4	0	0	0	112.6
70	G	31.9	Very low	36.6	Very low	67 Å²	67	131 Å²	131	69%	0.691	80%	0.801	S	S	*	*			trans	155.7	148.6	172.4	0	0	0	0	0	111.4
71	E	31.9	Very low	37.6	Very low	188 Å²	188	131.5 Å²	131.5	88%	0.879	80%	0.796	S	S	*	*			cis	-161.2	142.1	-5.1	-165.3	178.2	-161.7	0	0	110.1
72	A	38	Very low	37	Very low	96 Å²	96	134.4 Å²	134.4	79%	0.793	80%	0.802	S	S	*	*			trans	53.1	166.5	161.9	0	0	0	0	0	121.4
73	A	35.5	Very low	37.9	Very low	81 Å²	81	132.4 Å²	132.4	67%	0.669	79%	0.786	S	S	*	*			cis	-169.8	151	-45.8	0	0	0	0	0	109.4
74	W	36.3	Very low	37.8	Very low	258 Å²	258	134 Å²	134	98%	0.977	78%	0.783	S	S	*	*			trans	165.7	150.9	136.1	-86.7	16.8	0	0	0	111.6
75	S	40.2	Very low	37.9	Very low	111 Å²	111	138.4 Å²	138.4	78%	0.776	79%	0.792	S	S	*	*			trans	-90.7	-176.6	-170.4	-46.1	0	0	0	0	112.4
76	T	38.3	Very low	37.6	Very low	137 Å²	137	134.2 Å²	134.2	84%	0.84	78%	0.783	S	S	*	*			cis	-164	172.2	20.9	-14.3	0	0	0	0	107.1
77	A	31.8	Very low	37	Very low	96 Å²	96	134.1 Å²	134.1	79%	0.793	78%	0.78	S	S	*	*			cis	-159.1	175.4	3.7	0	0	0	0	0	109.9
78	G	32	Very low	37	Very low	81 Å²	81	135.6 Å²	135.6	84%	0.835	79%	0.786	S	S	*	*			trans	126.2	86.5	156.7	0	0	0	0	0	116.3
79	D	32.8	Very low	37.1	Very low	144 Å²	144	132.5 Å²	132.5	77%	0.77	77%	0.773	S	S	*	*			trans	-105.3	169.9	168.9	-138.4	33.1	0	0	0	108.4	P81	D79-P81 WeakPolarHBondContact OD1-CD 3.42Å
80	P	47.8	Very low	36.9	Very low	114 Å²	114	132.3 Å²	132.3	74%	0.74	77%	0.768	S	S	*	*			cis	-138.8	163.9	23.3	42.5	-24.3	0	0	0	118.9
81	P	52	Low	37	Very low	101 Å²	101	137.1 Å²	137.1	66%	0.656	77%	0.774	S	S	*	*			trans	-91.1	170	162.3	37.6	-34.9	0	0	0	113.2	D79	D79-P81 WeakPolarHBondContact OD1-CD 3.42Å
82	M	37.7	Very low	36.8	Very low	180 Å²	180	133.3 Å²	133.3	89%	0.887	77%	0.769	S	S	*	*			trans	-128.7	155.4	168.7	-83.1	-73.7	-70.4	0	0	110.8
83	P	53.9	Low	36.6	Very low	82 Å²	82	136.7 Å²	136.7	53%	0.532	77%	0.773	S	S	.	*			trans	-124	-165.9	-147.5	24.7	-0.9	0	0	0	115.2
84	Y	36.7	Very low	36.4	Very low	207 Å²	207	136.6 Å²	136.6	81%	0.812	78%	0.78	S	S	*	*			trans	87.3	146.8	169.2	-57.7	-61.9	0	0	0	116.7
85	L	33.8	Very low	36.1	Very low	145 Å²	145	133.3 Å²	133.3	76%	0.759	78%	0.775	S	S	*	*			cis	-154.5	156.8	5.3	-122	160.5	0	0	0	112.6
86	T	29.9	Very low	36.8	Very low	107 Å²	107	132.6 Å²	132.6	66%	0.656	77%	0.768	S	S	*	*			trans	4.1	130.2	149.9	-66.9	0	0	0	0	120.1
87	T	32.1	Very low	36.5	Very low	125 Å²	125	135.3 Å²	135.3	77%	0.767	77%	0.771	S	S	*	*				82	122.9	58.2	-86.5	0	0	0	0	117
88	Y	33.7	Very low	36.5	Very low	233 Å²	233	139.8 Å²	139.8	91%	0.914	77%	0.773	S	S	*	*			trans	-174.2	151.6	153.9	-105.3	-80.6	0	0	0	106.7
89	G	33.3	Very low	36.7	Very low	57 Å²	57	142.4 Å²	142.4	59%	0.588	77%	0.766	S	S	*	*			cis	133.3	76.4	1.9	0	0	0	0	0	111.2
90	Q	36	Very low	37.8	Very low	169 Å²	169	140.8 Å²	140.8	79%	0.79	76%	0.764	S	S	*	*				70.3	106.6	90.9	-144.8	-57.6	-49.1	0	0	116.1
91	M	32.9	Very low	37.2	Very low	167 Å²	167	142.8 Å²	142.8	82%	0.823	77%	0.768	S	S	*	*			trans	171.5	162.6	154	52.6	-166.5	73.5	0	0	109
92	S	28.8	Very low	36.3	Very low	109 Å²	109	141.1 Å²	141.1	76%	0.762	77%	0.77	S	S	*	*			cis	-150.3	176.6	15.7	-168.4	0	0	0	0	113.3
93	N	33.4	Very low	36.2	Very low	167 Å²	167	138.9 Å²	138.9	89%	0.893	77%	0.766	S	S	*	*			trans	-87.9	173.4	-164.9	-48.6	-24.5	0	0	0	116.5
94	G	31.2	Very low	35.1	Very low	78 Å²	78	144.1 Å²	144.1	80%	0.804	78%	0.78	S	S	*	*			trans	176.6	139.1	159.8	0	0	0	0	0	114.2
95	E	29.7	Very low	34.9	Very low	189 Å²	189	138.9 Å²	138.9	88%	0.883	77%	0.774	S	S	*	*			trans	-136.7	-173.3	-169	-118.3	-146.3	112.6	0	0	113.9
96	P	55.2	Low	34.8	Very low	96 Å²	96	140.8 Å²	140.8	62%	0.623	78%	0.779	S	S	*	*			trans	-107.6	176.3	-144.1	44.1	-39.7	0	0	0	116.2
97	H	31.8	Very low	35.7	Very low	194 Å²	194	141 Å²	141	90%	0.898	78%	0.782	S	S	*	*			trans	-142.1	165	171.5	-82.7	66.7	0	0	0	112.1
98	F	32.5	Very low	35.7	Very low	191 Å²	191	138.8 Å²	138.8	84%	0.838	78%	0.784	S	S	*	*			trans	-149.6	135.6	-154.8	-146.5	-113.2	0	0	0	113.1
99	I	35.5	Very low	35.7	Very low	136 Å²	136	132.7 Å²	132.7	70%	0.697	78%	0.782	S	S	*	*			trans	53.7	136.5	139.3	-62.2	-56.9	0	0	0	119.4
100	P	56	Low	35.7	Very low	110 Å²	110	138.8 Å²	138.8	71%	0.714	80%	0.8	S	S	*	*				-151.7	171.6	63.2	41.5	-20.3	0	0	0	120.6
101	D	34.6	Very low	35.3	Very low	155 Å²	155	134.5 Å²	134.5	83%	0.829	80%	0.801	S	S	*	*			trans	33.5	142.6	158.2	-79.8	-49	0	0	0	122.6
102	G	33.5	Very low	35.2	Very low	67 Å²	67	133.7 Å²	133.7	69%	0.691	80%	0.8	S	S	*	*			cis	171.7	-153.6	5.1	0	0	0	0	0	109.4
103	V	35	Very low	35.3	Very low	133 Å²	133	134.5 Å²	134.5	81%	0.806	80%	0.8	S	S	*	*			cis	-158.4	166.3	-4.4	-169.3	0	0	0	0	108
104	F	31.2	Very low	36.6	Very low	192 Å²	192	132.1 Å²	132.1	84%	0.842	79%	0.794	S	S	*	*			trans	104.5	103.4	151.4	-151.4	-108.9	0	0	0	121.7
105	S	31.8	Very low	37.6	Very low	96 Å²	96	133.8 Å²	133.8	67%	0.671	79%	0.791	S	S	*	*			trans	92.6	130.2	144.1	-70.1	0	0	0	0	123.4
106	Q	33.2	Very low	37.7	Very low	185 Å²	185	133.9 Å²	133.9	86%	0.864	79%	0.789	S	S	*	*			trans	-117.3	-167	175.8	-118.7	-162	1.6	0	0	108.2
107	P	48.6	Very low	36.6	Very low	112 Å²	112	137.1 Å²	137.1	73%	0.727	80%	0.8	S	S	*	*			cis	-121.3	166.5	-9.1	26.2	-3.3	0	0	0	113
108	G	31.5	Very low	36.6	Very low	78 Å²	78	131.7 Å²	131.7	80%	0.804	80%	0.797	S	S	*	*				109	157.9	83.1	0	0	0	0	0	110.7
109	A	33.2	Very low	36.5	Very low	106 Å²	106	130.8 Å²	130.8	88%	0.876	80%	0.795	S	S	*	*			cis	-154.8	-169.9	-4.8	0	0	0	0	0	110.8
110	L	33.9	Very low	36.4	Very low	185 Å²	185	132.6 Å²	132.6	97%	0.969	80%	0.8	S	S	*	*			trans	-92.5	164.9	-166.2	-57.4	166.9	0	0	0	115.1
111	G	27.5	Very low	35.1	Very low	78 Å²	78	131.1 Å²	131.1	80%	0.804	81%	0.805	S	S	*	*			trans	-165.8	148.6	168.5	0	0	0	0	0	113.1
112	N	30.6	Very low	35.1	Very low	150 Å²	150	132.8 Å²	132.8	80%	0.802	81%	0.805	S	S	*	*			trans	-148.7	149.6	-168	-152.5	10.9	0	0	0	114.1
113	T	32.1	Very low	35	Very low	126 Å²	126	136.9 Å²	136.9	77%	0.773	81%	0.811	S	S	*	*			trans	69.5	155.5	163.7	48	0	0	0	0	121.7
114	P	60.2	Low	35	Very low	118 Å²	118	138.4 Å²	138.4	77%	0.766	81%	0.807	S	S	*	*			trans	-111.1	179.3	-163.6	43.9	-35.5	0	0	0	115.3
115	P	52.8	Low	35.2	Very low	113 Å²	113	138 Å²	138	73%	0.734	81%	0.805	S	S	*	*				-158.7	164.3	103.8	40.1	-20.7	0	0	0	120.1
116	F	31.5	Very low	35.4	Very low	190 Å²	190	139.5 Å²	139.5	83%	0.833	81%	0.813	S	S	*	*			trans	83.9	129.6	138.6	-92.3	-139	0	0	0	126.3
117	L	32	Very low	35.1	Very low	165 Å²	165	133.9 Å²	133.9	86%	0.864	81%	0.805	S	S	*	*			trans	64	131.2	146.3	-64.6	173.2	0	0	0	123.3
118	G	31.3	Very low	34.3	Very low	80 Å²	80	134 Å²	134	83%	0.825	81%	0.809	S	S	*	*			trans	165.9	93.5	166.3	0	0	0	0	0	115.8
119	Q	31.3	Very low	34.4	Very low	172 Å²	172	135 Å²	135	80%	0.804	81%	0.809	S	S	*	*			trans	-57.4	148.5	-167	-79.1	-169.9	-39.9	0	0	121.3
120	H	32.9	Very low	34.2	Very low	173 Å²	173	137.1 Å²	137.1	80%	0.801	81%	0.805	S	S	*	*			trans	43	131.2	142.8	-55	-58.6	0	0	0	123.7
121	G	28.8	Very low	34.2	Very low	79 Å²	79	137 Å²	137	81%	0.814	80%	0.797	S	S	*	*			trans	165	106	153.8	0	0	0	0	0	115.3
122	F	35.3	Very low	34.4	Very low	191 Å²	191	139.1 Å²	139.1	84%	0.838	80%	0.8	S	S	*	*			trans	-94.7	136.8	176.6	-81.6	-99.3	0	0	0	112.4
123	N	30.2	Very low	34.3	Very low	153 Å²	153	136.1 Å²	136.1	82%	0.818	79%	0.788	S	S	*	*				-177.4	162.5	104.3	-102.8	-38.2	0	0	0	115.6
124	F	34.9	Very low	34.7	Very low	164 Å²	164	142.1 Å²	142.1	72%	0.719	80%	0.796	S	S	*	*			trans	-79.6	168.7	171.8	-74.8	-125.3	0	0	0	110.2
125	F	34.7	Very low	33.2	Very low	183 Å²	183	140 Å²	140	80%	0.803	80%	0.796	S	S	*	*			cis	-148.2	160.3	26.9	-68.6	-98.9	0	0	0	112.2
126	P	36.2	Very low	32.3	Very low	128 Å²	128	141.4 Å²	141.4	83%	0.831	80%	0.802	S	S	*	*				-113.8	169.6	117.6	35.2	-34	0	0	0	109.8
127	G	28.2	Very low	32.3	Very low	68 Å²	68	138.1 Å²	138.1	70%	0.701	80%	0.803	S	S	*	*			cis	140	131.7	11.9	0	0	0	0	0	107
128	S	30.9	Very low	32.3	Very low	115 Å²	115	136.8 Å²	136.8	80%	0.804	80%	0.802	S	S	*	*			trans	-62.5	136.2	-166.4	46.3	0	0	0	0	113.8
129	A	33.7	Very low	32.4	Very low	98 Å²	98	138.5 Å²	138.5	81%	0.81	80%	0.801	S	S	*	*			trans	-129.5	115.9	171.2	0	0	0	0	0	109.5
130	D	29.3	Very low	32.4	Very low	150 Å²	150	139.3 Å²	139.3	80%	0.802	81%	0.805	S	S	*	*			trans	-91.8	131.1	-177.7	-37.5	-60.1	0	0	0	109.5
131	F	33.6	Very low	32.3	Very low	182 Å²	182	134.6 Å²	134.6	80%	0.798	80%	0.802	S	S	*	*			trans	-140.3	104.1	176.8	-147.3	-106.5	0	0	0	113	T133	F131-T133 HydrophobicContact CE1-CG2 4.36Å; F131-T133 WeakPolarHBondContact CE1-OG1 3.31Å
132	S	32.4	Very low	32.4	Very low	123 Å²	123	139.7 Å²	139.7	86%	0.86	81%	0.805	S	S	*	*			trans	-98	124.1	160.9	-68	0	0	0	0	108.9
133	T	28.3	Very low	32.3	Very low	88 Å²	88	135.5 Å²	135.5	54%	0.54	80%	0.8	S	S	.	*			trans	-153.2	121.7	168.6	-81	0	0	0	0	109.3	F131	F131-T133 HydrophobicContact CE1-CG2 4.36Å; F131-T133 WeakPolarHBondContact CE1-OG1 3.31Å
134	W	39.4	Very low	32.3	Very low	251 Å²	251	133.8 Å²	133.8	95%	0.951	80%	0.795	S	S	*	*			trans	-171.7	104.1	133.2	-92.9	111.2	0	0	0	106.6
135	G	30.1	Very low	32.1	Very low	74 Å²	74	134.6 Å²	134.6	76%	0.763	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-90.6	142.5	179.7	0	0	0	0	0	111.9
136	T	34.3	Very low	31.8	Very low	142 Å²	142	131.7 Å²	131.7	87%	0.871	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-98.7	134.9	169.2	42.5	0	0	0	0	110.8
137	S	29.7	Very low	31.5	Very low	121 Å²	121	130.9 Å²	130.9	85%	0.846	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-75.2	130	-178.1	53	0	0	0	0	112.7
138	V	32.1	Very low	31.5	Very low	138 Å²	138	133.7 Å²	133.7	84%	0.836	80%	0.804	S	S	*	*			trans	-132	146.6	161.5	-179	0	0	0	0	108.6
139	S	34.5	Very low	31.4	Very low	115 Å²	115	139 Å²	139	80%	0.804	81%	0.808	S	S	*	*			trans	-68.9	153	-170.1	44.2	0	0	0	0	114.8
140	Q	31.8	Very low	31.1	Very low	190 Å²	190	138.5 Å²	138.5	89%	0.888	80%	0.798	S	S	*	*			trans	-81.7	137.7	-176.4	-169.8	177.2	42.7	0	0	112.3
141	G	30.5	Very low	30.9	Very low	73 Å²	73	137.6 Å²	137.6	75%	0.753	79%	0.794	S	S	*	*			trans	-152.3	129.5	170.8	0	0	0	0	0	110.9
142	Q	30.5	Very low	30.8	Very low	187 Å²	187	132.8 Å²	132.8	87%	0.874	78%	0.783	S	S	*	*			trans	-84.7	150.3	179.6	-64.5	167.8	-7.2	0	0	109.4
143	S	32.1	Very low	30.9	Very low	103 Å²	103	137 Å²	137	72%	0.72	78%	0.782	S	S	*	*			cis	-155.3	-163.4	-2.7	47.2	0	0	0	0	108
144	T	31.5	Very low	31	Very low	117 Å²	117	136 Å²	136	72%	0.718	79%	0.789	S	S	*	*			cis	-160.1	158.5	23.3	-23	0	0	0	0	113.3
145	Q	31	Very low	30.5	Very low	180 Å²	180	135.5 Å²	135.5	84%	0.841	79%	0.788	S	S	*	*			trans	-8.9	135.6	163.7	-63	172.9	34.2	0	0	122.2
146	S	28.5	Very low	30.6	Very low	123 Å²	123	136.3 Å²	136.3	86%	0.86	79%	0.788	S	S	*	*				-160	157.3	118.9	5.8	0	0	0	0	112.1
147	S	30.2	Very low	31.1	Very low	111 Å²	111	135.4 Å²	135.4	78%	0.776	78%	0.784	S	S	*	*			trans	-66.5	148.4	-174	-56.1	0	0	0	0	114
148	V	28.2	Very low	31.2	Very low	126 Å²	126	135.7 Å²	135.7	76%	0.764	79%	0.786	S	S	*	*			cis	79	117.7	41.4	179.5	0	0	0	0	114.4
149	Y	27.9	Very low	31.3	Very low	226 Å²	226	134.8 Å²	134.8	89%	0.886	79%	0.786	S	S	*	*			trans	140.9	151	157.6	-99.8	-93.6	0	0	0	110.8
150	S	27.5	Very low	31.4	Very low	88 Å²	88	136.9 Å²	136.9	62%	0.615	79%	0.787	S	S	*	*			cis	-175.4	154.5	-45.9	179.4	0	0	0	0	108.8
151	N	25.6	Very low	31.2	Very low	131 Å²	131	131.7 Å²	131.7	70%	0.701	78%	0.784	S	S	*	*			trans	111.1	129.6	167.9	-60.4	0.7	0	0	0	113.7
152	S	31.6	Very low	31.1	Very low	82 Å²	82	139.1 Å²	139.1	57%	0.573	79%	0.79	S	S	*	*			cis	70.1	137.7	43.7	83.8	0	0	0	0	112.8
153	Y	34.3	Very low	31.3	Very low	212 Å²	212	133.9 Å²	133.9	83%	0.831	78%	0.779	S	S	*	*			cis	-123	174.8	17.6	-65.6	-103.3	0	0	0	110.4
154	G	29.3	Very low	31.3	Very low	67 Å²	67	136.3 Å²	136.3	69%	0.691	78%	0.782	S	S	*	*			cis	112.9	101	9.5	0	0	0	0	0	111.4
155	Y	28.6	Very low	31.3	Very low	240 Å²	240	137.2 Å²	137.2	94%	0.941	79%	0.787	S	S	*	*			trans	-133.2	145.9	178.9	-97.1	-84.9	0	0	0	111.2
156	A	32.8	Very low	31.4	Very low	91 Å²	91	136.3 Å²	136.3	75%	0.752	79%	0.788	S	S	*	*			trans	-125.3	150.8	176	0	0	0	0	0	110.7
157	P	45.3	Very low	31.6	Very low	122 Å²	122	134 Å²	134	79%	0.792	78%	0.784	S	S	*	*			trans	-85	160.1	-178.4	35.1	-35.6	0	0	0	112.4
158	S	31.1	Very low	31.5	Very low	128 Å²	128	137.9 Å²	137.9	90%	0.895	79%	0.789	S	S	*	*			trans	-150.5	131.6	160.1	-79.4	0	0	0	0	111.4
159	S	33.9	Very low	31.8	Very low	118 Å²	118	136.9 Å²	136.9	83%	0.825	80%	0.795	S	S	*	*			trans	-90.5	143.6	167.2	49.4	0	0	0	0	109.8
160	L	36.8	Very low	31.9	Very low	160 Å²	160	129.7 Å²	129.7	84%	0.838	79%	0.789	S	S	*	*				-180	120.3	122	-170.8	65.4	0	0	0	109.7
161	G	28.8	Very low	32.1	Very low	80 Å²	80	136.2 Å²	136.2	83%	0.825	81%	0.807	S	S	*	*			trans	-100.2	120.5	166.5	0	0	0	0	0	110.2
162	R	28.6	Very low	32.2	Very low	230 Å²	230	133.4 Å²	133.4	87%	0.868	81%	0.809	S	S	*	*			trans	-143.1	148.3	168.5	-151.2	177.5	-167.8	-81.2	1.8	109.3
163	A	33.1	Very low	32.3	Very low	77 Å²	77	134.6 Å²	134.6	64%	0.636	82%	0.818	S	S	*	*			trans	-120.6	168.9	-164.6	0	0	0	0	0	113.8
164	I	33.2	Very low	32.3	Very low	154 Å²	154	131.2 Å²	131.2	79%	0.79	81%	0.814	S	S	*	*			trans	69.3	113.7	165.4	-30.2	177.6	0	0	0	116.8
165	T	32.2	Very low	32.4	Very low	136 Å²	136	134.2 Å²	134.2	83%	0.834	82%	0.819	S	S	*	*				-172.3	150.3	120	34.9	0	0	0	0	110.8
166	D	32.9	Very low	32.8	Very low	161 Å²	161	130 Å²	130	86%	0.861	81%	0.808	S	S	*	*			trans	-71.7	167	179.7	-51.2	-102.8	0	0	0	114.4
167	G	30.9	Very low	33	Very low	74 Å²	74	132.2 Å²	132.2	76%	0.763	81%	0.806	S	S	*	*			trans	166.2	52.3	172	0	0	0	0	0	122
168	Q	29.3	Very low	32.4	Very low	192 Å²	192	131.3 Å²	131.3	90%	0.897	80%	0.803	S	S	*	*			trans	40.2	101.7	136.2	-165.4	164.4	-23.7	0	0	122.6
169	A	35.2	Very low	32.4	Very low	106 Å²	106	134.9 Å²	134.9	88%	0.876	80%	0.802	S	S	*	*			trans	39.1	136.3	135.2	0	0	0	0	0	124.3
170	G	29.4	Very low	32.5	Very low	75 Å²	75	135 Å²	135	77%	0.773	80%	0.798	S	S	*	*			trans	174.1	129	157.4	0	0	0	0	0	116.8
171	F	30.4	Very low	33.4	Very low	224 Å²	224	133.2 Å²	133.2	98%	0.982	80%	0.796	S	S	*	*			trans	-49.3	151.9	172.8	-62.9	-98.5	0	0	0	113.9
172	G	29.6	Very low	33.7	Very low	73 Å²	73	134.2 Å²	134.2	75%	0.753	79%	0.786	S	S	*	*				115.8	158.6	58.1	0	0	0	0	0	108.7
173	S	32.7	Very low	34.3	Very low	107 Å²	107	130.7 Å²	130.7	75%	0.748	78%	0.783	S	S	*	*			cis	-165.5	151.8	3	51.6	0	0	0	0	111.9
174	D	33.3	Very low	34.5	Very low	141 Å²	141	133 Å²	133	75%	0.754	79%	0.785	S	S	*	*			trans	49.1	127.7	149.1	-72.7	-84.2	0	0	0	125
175	T	33.4	Very low	34.7	Very low	129 Å²	129	129.6 Å²	129.6	79%	0.791	78%	0.775	S	S	*	*				178.6	150.8	119.3	24.9	0	0	0	0	110.2
176	Q	36.4	Very low	34.8	Very low	153 Å²	153	130.2 Å²	130.2	72%	0.715	77%	0.772	S	S	*	*			cis	-174.1	162.8	-26.8	-114.4	-168.4	43	0	0	106.8
177	L	37.1	Very low	34.9	Very low	136 Å²	136	129.7 Å²	129.7	71%	0.712	76%	0.764	S	S	*	*			cis	-161.9	160.3	-7.1	-176.3	59	0	0	0	109.7
178	S	31.6	Very low	35.3	Very low	104 Å²	104	134 Å²	134	73%	0.727	76%	0.764	S	S	*	*			trans	82.9	144.7	159.4	82.5	0	0	0	0	118.7
179	K	32.6	Very low	35.4	Very low	202 Å²	202	128.4 Å²	128.4	88%	0.878	76%	0.758	S	S	*	*			cis	-136.8	149.4	21	-151.4	171.5	-173.3	176	0	113.4
180	V	35.8	Very low	35.5	Very low	120 Å²	120	132.6 Å²	132.6	73%	0.727	76%	0.762	S	S	*	*			trans	-120.9	179.4	-175.5	-110.3	0	0	0	0	109.8	V182	V180-V182 HydrophobicContact CG1-CG2 4.24Å
181	P	55.3	Low	35.9	Very low	124 Å²	124	135.5 Å²	135.5	81%	0.805	77%	0.765	S	S	*	*			cis	-126.1	-135.4	18.5	40.3	-20.8	0	0	0	116.7
182	V	35.8	Very low	35.9	Very low	100 Å²	100	128.1 Å²	128.1	61%	0.606	75%	0.752	S	S	*	*				-171.9	158.2	-121.7	149.9	0	0	0	0	109.4	V180	V180-V182 HydrophobicContact CG1-CG2 4.24Å
183	L	39.6	Very low	36.2	Very low	156 Å²	156	132.8 Å²	132.8	82%	0.817	76%	0.759	S	S	*	*			trans	171.3	118.1	146.8	-88.8	171.7	0	0	0	107.5
184	N	38.5	Very low	36	Very low	125 Å²	125	137.1 Å²	137.1	67%	0.668	76%	0.764	S	S	*	*				84.6	143.3	61.7	-73.5	12	0	0	0	113.3
185	S	35.9	Very low	35.9	Very low	83 Å²	83	138.4 Å²	138.4	58%	0.58	77%	0.77	S	S	*	*			cis	-171.5	-177.5	-0.9	-105.5	0	0	0	0	112.1
186	I	35.3	Very low	35.7	Very low	150 Å²	150	135 Å²	135	77%	0.769	76%	0.76	S	S	*	*			trans	76.4	148.4	156.5	-98.3	79.3	0	0	0	116.8
187	E	35.7	Very low	35.5	Very low	149 Å²	149	133.5 Å²	133.5	70%	0.696	76%	0.762	S	S	*	*			cis	-157.7	-173.8	-18.2	-163.7	148.5	-171.8	0	0	112.4
188	Q	38.4	Very low	35.1	Very low	165 Å²	165	132.7 Å²	132.7	77%	0.771	76%	0.758	S	S	*	*			trans	-60.7	146.2	-169.7	-55.5	164.4	55.6	0	0	118.6
189	G	32.1	Very low	35.1	Very low	74 Å²	74	136.2 Å²	136.2	76%	0.763	77%	0.765	S	S	*	*				89.6	116.2	111	0	0	0	0	0	121.1
190	M	36.8	Very low	35	Very low	194 Å²	194	133.1 Å²	133.1	96%	0.956	76%	0.763	S	S	*	*			trans	-160.6	162.4	144.5	-111.8	-177.4	89.8	0	0	112
191	T	37.5	Very low	34.7	Very low	137 Å²	137	132.3 Å²	132.3	84%	0.84	77%	0.769	S	S	*	*			trans	-119.3	147	-169.4	53.6	0	0	0	0	114.2
192	G	30	Very low	33.6	Very low	69 Å²	69	131 Å²	131	71%	0.711	77%	0.769	S	S	*	*			trans	115.7	160.3	148.7	0	0	0	0	0	117.2
193	L	36.2	Very low	33.4	Very low	171 Å²	171	132.5 Å²	132.5	90%	0.895	78%	0.778	S	S	*	*			trans	61.8	105.6	178.2	-49.8	179.3	0	0	0	113.6
194	K	29.1	Very low	33	Very low	197 Å²	197	130.1 Å²	130.1	86%	0.857	77%	0.77	S	S	*	*			cis	59.7	88	22.1	-165.8	-172.3	177	-178.1	0	114.8
195	L	31.6	Very low	32.7	Very low	169 Å²	169	133.1 Å²	133.1	89%	0.885	78%	0.777	S	S	*	*			trans	-148.1	118.1	136.4	-168.6	62.9	0	0	0	111.9
196	G	29.2	Very low	32.4	Very low	57 Å²	57	134.7 Å²	134.7	59%	0.588	78%	0.783	S	S	*	*			trans	-148.2	169	156.4	0	0	0	0	0	106.2
197	T	30.5	Very low	32.2	Very low	122 Å²	122	134.9 Å²	134.9	75%	0.748	79%	0.791	S	S	*	*			trans	66.2	144.9	-175.9	-75.2	0	0	0	0	113.8
198	D	29	Very low	31.8	Very low	118 Å²	118	130.9 Å²	130.9	63%	0.631	79%	0.79	S	S	*	*			cis	-166.3	168.6	-28.3	-94.7	-46.8	0	0	0	107.5
199	M	32.2	Very low	31.5	Very low	178 Å²	178	128.7 Å²	128.7	88%	0.877	79%	0.793	S	S	*	*			trans	153.3	118.3	134.7	-83.3	175.5	-90.7	0	0	109.9
200	V	30.2	Very low	32.3	Very low	137 Å²	137	130.7 Å²	130.7	83%	0.83	79%	0.792	S	S	*	*				81.4	101.4	51.1	177.7	0	0	0	0	113
201	A	29	Very low	32	Very low	103 Å²	103	129.6 Å²	129.6	85%	0.851	79%	0.789	S	S	*	*			trans	-154.1	142.4	148.4	0	0	0	0	0	108.1
202	A	33.4	Very low	31.6	Very low	97 Å²	97	126.9 Å²	126.9	80%	0.802	79%	0.788	S	S	*	*			trans	-125.3	161.3	178.4	0	0	0	0	0	110.2
203	V	31.5	Very low	31.5	Very low	131 Å²	131	127 Å²	127	79%	0.794	79%	0.789	S	S	*	*			trans	-175.5	108.4	145.9	137.9	0	0	0	0	113.2
204	T	31.1	Very low	31.3	Very low	106 Å²	106	125.1 Å²	125.1	65%	0.65	79%	0.785	S	S	*	*			trans	36.4	140.2	142.5	73.2	0	0	0	0	125.9
205	K	32.3	Very low	31.4	Very low	188 Å²	188	121.9 Å²	121.9	82%	0.817	78%	0.782	S	S	*	*			trans	72.8	150.8	132.7	-78.4	172.5	-178.4	-179	0	120.2
206	T	30.2	Very low	31.4	Very low	117 Å²	117	117.4 Å²	117.4	72%	0.718	78%	0.776	S	S	*	*			cis	-170.6	148.9	-33.8	5.2	0	0	0	0	110
207	V	30.6	Very low	31.9	Very low	153 Å²	153	122.3 Å²	122.3	93%	0.927	79%	0.786	S	S	*	*			trans	65.3	151.3	163.7	-178.9	0	0	0	0	114.6
208	G	27	Very low	31.9	Very low	65 Å²	65	123.1 Å²	123.1	67%	0.67	79%	0.786	S	S	*	*			cis	-176.2	179.5	-3.8	0	0	0	0	0	111.6
209	S	31.3	Very low	32.1	Very low	120 Å²	120	122.1 Å²	122.1	84%	0.839	79%	0.788	S	S	*	*			trans	-83.6	-175	-179.3	-42.8	0	0	0	0	112.5
210	P	49.8	Very low	32.1	Very low	115 Å²	115	118.7 Å²	118.7	75%	0.747	78%	0.777	S	S	*	*			cis	-147.2	-174.8	5.3	45.2	-25.3	0	0	0	118.3
211	L	31.3	Very low	32.1	Very low	172 Å²	172	120.6 Å²	120.6	90%	0.901	78%	0.779	S	S	*	*			trans	75.8	122.3	139.2	-152.3	74.7	0	0	0	123.4
212	G	28.2	Very low	32.2	Very low	79 Å²	79	120.2 Å²	120.2	81%	0.814	78%	0.776	S	S	*	*				104.8	144.7	128.8	0	0	0	0	0	120
213	G	28.4	Very low	32.2	Very low	71 Å²	71	122 Å²	122	73%	0.732	77%	0.772	S	S	*	*			trans	129.5	86.7	152.9	0	0	0	0	0	120.1
214	T	32	Very low	32.2	Very low	132 Å²	132	121.6 Å²	121.6	81%	0.81	77%	0.765	S	S	*	*			trans	41.6	120.2	136.4	54.4	0	0	0	0	124.3
215	V	31	Very low	32.5	Very low	130 Å²	130	124 Å²	124	79%	0.788	77%	0.773	S	S	*	*				49.9	123.9	123.5	-172.3	0	0	0	0	121.2	M217	V215-M217 HydrophobicContact CG1-CG 4.48Å; V215-M217 HydrophobicContact CG1-SD 4.43Å
216	G	31.6	Very low	33.6	Very low	74 Å²	74	120 Å²	120	76%	0.763	77%	0.767	S	S	*	*			trans	-154.7	143.8	154.8	0	0	0	0	0	110.5
217	M	38.4	Very low	34.6	Very low	160 Å²	160	120.7 Å²	120.7	79%	0.788	77%	0.773	S	S	*	*			trans	-138.5	166.4	-167.5	-68.9	169.9	63.9	0	0	113.2	V215	V215-M217 HydrophobicContact CG1-CG 4.48Å; V215-M217 HydrophobicContact CG1-SD 4.43Å
218	N	32.5	Very low	34.7	Very low	140 Å²	140	118.4 Å²	118.4	75%	0.749	76%	0.764	S	S	*	*			trans	71.8	124.3	170.6	-68.6	7.7	0	0	0	115.8
219	S	33	Very low	35	Very low	96 Å²	96	121.1 Å²	121.1	67%	0.671	77%	0.767	S	S	*	*				95.1	159.8	54	84.7	0	0	0	0	112.1
220	T	30.9	Very low	35	Very low	107 Å²	107	122.7 Å²	122.7	66%	0.656	77%	0.766	S	S	*	*			cis	-165.1	145	18.6	-14.5	0	0	0	0	110.9
221	M	31.5	Very low	34	Very low	176 Å²	176	122.1 Å²	122.1	87%	0.867	77%	0.765	S	S	*	*			trans	57.3	-172.6	163	-42.5	-51.5	-173.2	0	0	116.4
222	A	31.1	Very low	34	Very low	95 Å²	95	119.9 Å²	119.9	79%	0.785	76%	0.763	S	S	*	*			cis	-163.4	171.1	-17.2	0	0	0	0	0	109.2
223	N	33	Very low	34.4	Very low	134 Å²	134	120.6 Å²	120.6	72%	0.717	76%	0.762	S	S	*	*			cis	-168.6	158	-40.9	-168.3	30.3	0	0	0	111.8
224	N	30.5	Very low	35.2	Very low	123 Å²	123	123.1 Å²	123.1	66%	0.658	77%	0.765	S	S	*	*			trans	59	118	158.1	-84.4	1.3	0	0	0	125
225	L	38.1	Very low	35.3	Very low	157 Å²	157	126.6 Å²	126.6	82%	0.822	77%	0.769	S	S	*	*			trans	82.5	158.2	137.1	-86.1	84	0	0	0	123
226	P	55.8	Low	35.8	Very low	105 Å²	105	126.7 Å²	126.7	68%	0.682	77%	0.772	S	S	*	*			trans	-125.2	-169.1	-153.6	46	-31.8	0	0	0	115.8
227	P	51.7	Low	35.9	Very low	130 Å²	130	127.5 Å²	127.5	84%	0.844	77%	0.772	S	S	*	*				-135.6	-163	106.3	38.8	-26.9	0	0	0	115.7
228	S	32.9	Very low	35.7	Very low	106 Å²	106	126.7 Å²	126.7	74%	0.741	78%	0.777	S	S	*	*			trans	-96.2	-176.6	-163.8	57.4	0	0	0	0	114.6
229	V	32.3	Very low	35.8	Very low	121 Å²	121	132.2 Å²	132.2	73%	0.733	79%	0.787	S	S	*	*			cis	-155.7	155.6	21.7	-125.6	0	0	0	0	112
230	N	31	Very low	36.4	Very low	154 Å²	154	132.1 Å²	132.1	82%	0.824	79%	0.792	S	S	*	*			trans	37.7	143.6	147.9	-76.6	12	0	0	0	122.5
231	S	28.6	Very low	36.6	Very low	102 Å²	102	131.7 Å²	131.7	71%	0.713	80%	0.799	S	S	*	*			cis	-168.8	-179.3	8.3	48.9	0	0	0	0	113.2
232	S	32.2	Very low	37.2	Very low	125 Å²	125	130.8 Å²	130.8	87%	0.874	80%	0.796	S	S	*	*			trans	87.3	148.8	173.2	80.9	0	0	0	0	118.5
233	A	36	Very low	37.1	Very low	95 Å²	95	130.1 Å²	130.1	79%	0.785	79%	0.79	S	S	*	*			trans	-168.4	-175.9	-168.7	0	0	0	0	0	109.3
234	P	45.3	Very low	37.3	Very low	124 Å²	124	133.5 Å²	133.5	81%	0.805	80%	0.799	S	S	*	*			cis	-131.1	-171.6	-7.4	39.5	-21.1	0	0	0	114.5
235	K	33	Very low	37.8	Very low	204 Å²	204	137.4 Å²	137.4	89%	0.887	81%	0.81	S	S	*	*			trans	-123.2	151.7	163.9	-65.5	179.5	-179.8	177.8	0	110.3
236	P	41.9	Very low	38.3	Very low	132 Å²	132	135.7 Å²	135.7	86%	0.857	81%	0.808	S	S	*	*			trans	-91.5	139.8	172.4	34.6	-32.1	0	0	0	113
237	A	33.3	Very low	36.9	Very low	92 Å²	92	135.7 Å²	135.7	76%	0.76	82%	0.817	S	S	*	*			trans	-158	136.5	166	0	0	0	0	0	112.9
238	T	34.8	Very low	36.2	Very low	143 Å²	143	139 Å²	139	88%	0.877	82%	0.818	S	S	*	*			trans	32.8	123.6	148.6	-41.5	0	0	0	0	120.8
239	W	34.1	Very low	36.7	Very low	256 Å²	256	139.3 Å²	139.3	97%	0.97	82%	0.818	S	S	*	*			trans	-119	93.5	-174.6	-167.6	-89.1	0	0	0	114.5
240	A	45.4	Very low	36.8	Very low	94 Å²	94	141.4 Å²	141.4	78%	0.777	82%	0.819	S	S	*	*			trans	-161.5	69.8	174.7	0	0	0	0	0	116.2
241	A	35.9	Very low	37	Very low	97 Å²	97	140.3 Å²	140.3	80%	0.802	81%	0.813	S	S	*	*			trans	-174.4	157	163.6	0	0	0	0	0	112.3
242	I	43.3	Very low	37.2	Very low	158 Å²	158	144.1 Å²	144.1	81%	0.81	82%	0.817	S	S	*	*			cis	-161.5	129	-43	-117.6	160.5	0	0	0	110.3
243	A	29.9	Very low	37.3	Very low	80 Å²	80	145.4 Å²	145.4	66%	0.661	82%	0.819	S	S	*	*			trans	60.3	151.1	150.2	0	0	0	0	0	125.6
244	K	36.9	Very low	37.1	Very low	206 Å²	206	150.2 Å²	150.2	90%	0.896	82%	0.822	S	S	*	*			trans	95.9	153.3	149.8	-69.4	150.6	-174.8	176.7	0	120.8
245	K	40.8	Very low	36.4	Very low	205 Å²	205	149 Å²	149	89%	0.891	82%	0.823	S	S	*	*			trans	-102.4	-172.6	-163.4	-52.4	176	177	174.3	0	111
246	P	48.5	Very low	36.3	Very low	121 Å²	121	149 Å²	149	79%	0.786	82%	0.823	S	S	*	*			cis	-141.8	167.1	0.5	42.4	-24.5	0	0	0	118.3
247	A	27.9	Very low	35.8	Very low	105 Å²	105	147.3 Å²	147.3	87%	0.868	82%	0.82	S	S	*	*			trans	177.5	169.8	144.7	0	0	0	0	0	113.7
248	K	37.2	Very low	35.6	Very low	198 Å²	198	150.3 Å²	150.3	86%	0.861	82%	0.824	S	S	*	*			trans	-153.5	158.1	172.7	-105.8	-176.1	-180	-178.7	0	107.4
249	P	43.2	Very low	35.6	Very low	113 Å²	113	152 Å²	152	73%	0.734	82%	0.824	S	S	*	*				-157.3	166	54	42.5	-21	0	0	0	120.6
250	Q	34.4	Very low	35.4	Very low	165 Å²	165	143.5 Å²	143.5	77%	0.771	82%	0.815	S	S	*	*			trans	65.3	165.7	153.1	-71	-62.8	-19.4	0	0	119.2
251	L	35.1	Very low	34.8	Very low	132 Å²	132	148.3 Å²	148.3	69%	0.691	82%	0.824	S	S	*	*			cis	-149.7	167	10.3	-131.4	175.7	0	0	0	113.3
252	K	33	Very low	34.5	Very low	181 Å²	181	147.6 Å²	147.6	79%	0.787	83%	0.826	S	S	*	*			trans	-38.2	159.1	-175.8	-63.5	155	-167	165.9	0	122.2
253	V	33.8	Very low	33.9	Very low	152 Å²	152	144.1 Å²	144.1	92%	0.921	83%	0.829	S	S	*	*			trans	-132.3	163.9	137.6	-177.9	0	0	0	0	109.9
254	K	31.2	Very low	34	Very low	196 Å²	196	144.4 Å²	144.4	85%	0.852	84%	0.84	S	S	*	*			trans	-142.4	153.8	-172.4	174.9	-175.4	176.1	-174.6	0	111.3
255	A	31.4	Very low	33.9	Very low	100 Å²	100	139.6 Å²	139.6	83%	0.826	84%	0.839	S	S	*	*			trans	-135.3	159.7	171.7	0	0	0	0	0	113.3
256	K	30.9	Very low	33.7	Very low	202 Å²	202	134.4 Å²	134.4	88%	0.878	83%	0.834	S	S	*	*			trans	-156.7	139.7	170.4	-176.8	-173.2	177.7	-171	0	109
257	A	30.2	Very low	33.7	Very low	98 Å²	98	136.3 Å²	136.3	81%	0.81	84%	0.836	S	S	*	*			trans	-137.7	179.1	171.2	0	0	0	0	0	110.7
258	N	30.9	Very low	34.9	Very low	155 Å²	155	136.4 Å²	136.4	83%	0.829	83%	0.828	S	S	*	*			trans	-130.8	173.2	-164.7	-161.9	27.9	0	0	0	114.5
259	M	33	Very low	35.3	Very low	179 Å²	179	133 Å²	133	88%	0.882	83%	0.826	S	S	*	*			trans	-48.1	158.3	-176.7	-68.7	-176	156.8	0	0	118.7
260	G	30.5	Very low	35.3	Very low	76 Å²	76	133.3 Å²	133.3	78%	0.784	83%	0.827	S	S	*	*			trans	167.2	98.7	149.9	0	0	0	0	0	116.6
261	M	32.4	Very low	36.4	Very low	196 Å²	196	131.2 Å²	131.2	97%	0.966	83%	0.828	S	S	*	*			trans	4.3	141	160.7	-101.2	59	162.7	0	0	121.3
262	G	30.8	Very low	36.5	Very low	82 Å²	82	132.6 Å²	132.6	85%	0.845	84%	0.835	S	S	*	*			trans	-175.2	-9.6	167.5	0	0	0	0	0	124
263	G	30.2	Very low	36.7	Very low	85 Å²	85	133.3 Å²	133.3	88%	0.876	84%	0.838	S	S	*	*			trans	85	154.5	171.9	0	0	0	0	0	117.7
264	G	31.5	Very low	37	Very low	85 Å²	85	134.1 Å²	134.1	88%	0.876	83%	0.831	S	S	*	*			trans	107.3	117.8	178.7	0	0	0	0	0	114.5
265	A	36	Very low	37.4	Very low	106 Å²	106	132.1 Å²	132.1	88%	0.876	83%	0.83	S	S	*	*			trans	-102.5	160.6	174.8	0	0	0	0	0	110.4
266	A	36.3	Very low	37.8	Very low	96 Å²	96	136.6 Å²	136.6	79%	0.793	84%	0.836	S	S	*	*			cis	-144.2	168.8	1.1	0	0	0	0	0	110.5
267	I	48.6	Very low	38.3	Very low	161 Å²	161	133.8 Å²	133.8	83%	0.826	83%	0.831	S	S	*	*			trans	-120.9	139.4	-173.6	-62.3	175.7	0	0	0	110.9
268	P	51.8	Low	38.5	Very low	107 Å²	107	137 Å²	137	70%	0.695	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-80.7	148.5	177	32.8	-36.2	0	0	0	113.6
269	P	45.9	Very low	38.7	Very low	126 Å²	126	133.2 Å²	133.2	82%	0.818	83%	0.83	S	S	*	*	P	Polyproline II helix	trans	-87.1	130.2	179.1	32.7	-33.4	0	0	0	114
270	P	44.4	Very low	38.9	Very low	119 Å²	119	130.9 Å²	130.9	77%	0.773	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-88.2	172.9	167.2	36.4	-34.3	0	0	0	112.4
271	P	56.8	Low	39.2	Very low	122 Å²	122	140 Å²	140	79%	0.792	84%	0.837	S	S	*	*	P	Polyproline II helix	trans	-93.6	164.2	-166.4	37.1	-37.2	0	0	0	114.8
272	I	36.1	Very low	39.2	Very low	161 Å²	161	137.9 Å²	137.9	83%	0.826	83%	0.83	S	S	*	*			trans	-158.7	160.8	155.2	-109.5	153.1	0	0	0	111.7
273	K	39	Very low	39.7	Very low	196 Å²	196	140.3 Å²	140.3	85%	0.852	82%	0.824	S	S	*	*			trans	-107.9	153.4	-177.1	-47.4	169.6	-175.7	177	0	111.2
274	H	39.8	Very low	39.7	Very low	169 Å²	169	145.5 Å²	145.5	78%	0.782	82%	0.822	S	S	*	*			trans	-165.3	165.8	144.2	37.3	-84.5	0	0	0	112.5
275	N	39.6	Very low	39.6	Very low	154 Å²	154	145 Å²	145	82%	0.824	82%	0.816	S	S	*	*			trans	-86.7	159.5	-171.7	-46.9	11.9	0	0	0	111.7
276	M	40.2	Very low	39.2	Very low	193 Å²	193	146.3 Å²	146.3	95%	0.951	82%	0.819	S	S	*	*			trans	-141.7	163.3	152.4	-81.4	-142.1	-65.1	0	0	111.4
277	N	40	Very low	39	Very low	144 Å²	144	148.8 Å²	148.8	77%	0.77	82%	0.819	S	S	*	*			trans	-143.9	133.4	-177.1	-175	19.4	0	0	0	109.1
278	I	34.5	Very low	38.2	Very low	164 Å²	164	148.1 Å²	148.1	84%	0.841	82%	0.817	S	S	*	*			trans	48.1	133.1	164.1	-153.7	164.1	0	0	0	120.5
279	G	34.4	Very low	37.2	Very low	76 Å²	76	151.8 Å²	151.8	78%	0.784	82%	0.822	S	S	*	*			trans	159.7	119.5	167	0	0	0	0	0	114.8
280	T	38.4	Very low	37.9	Very low	131 Å²	131	151 Å²	151	80%	0.804	82%	0.816	S	S	*	*			trans	-99.6	141.5	-178.7	47	0	0	0	0	113.4
281	W	35.8	Very low	38.3	Very low	266 Å²	266	150.7 Å²	150.7	100%	1.008	82%	0.815	S	S	*	*			trans	-148.6	162.7	156.4	-86.5	90.6	0	0	0	109.6
282	D	33	Very low	37.3	Very low	152 Å²	152	151.5 Å²	151.5	81%	0.813	81%	0.811	S	S	*	*			trans	-132.8	-174.5	-156.5	-144.9	-62.8	0	0	0	114
283	D	41	Very low	37.1	Very low	134 Å²	134	147.9 Å²	147.9	72%	0.717	81%	0.806	S	S	*	*			trans	66.7	138	176.1	-99.5	-53.8	0	0	0	116.3
284	K	30.8	Very low	36.9	Very low	193 Å²	193	146.9 Å²	146.9	84%	0.839	80%	0.804	S	S	*	*			cis	-137.8	161.3	-0.4	-83.8	178.6	179.5	-177.3	0	108.9
285	G	28.5	Very low	36.5	Very low	74 Å²	74	144.1 Å²	144.1	76%	0.763	80%	0.799	S	S	*	*			cis	158.2	149.8	-2	0	0	0	0	0	110.6
286	S	28.6	Very low	36.1	Very low	134 Å²	134	145.3 Å²	145.3	94%	0.937	80%	0.802	S	S	*	*			trans	-152.7	166.8	171.4	-166	0	0	0	0	111
287	L	32.2	Very low	35.6	Very low	149 Å²	149	144.5 Å²	144.5	78%	0.78	80%	0.798	S	S	*	*			trans	-109.4	149.7	-150.1	-154.3	73.9	0	0	0	115.7
288	N	31.4	Very low	36.9	Very low	147 Å²	147	143.1 Å²	143.1	79%	0.786	80%	0.797	S	S	*	*			trans	84.8	145.3	162.9	-67.7	-24.1	0	0	0	121.2
289	K	31.2	Very low	37.6	Very low	183 Å²	183	141.4 Å²	141.4	80%	0.796	80%	0.796	S	S	*	*			trans	-167.7	-165.9	-169.9	-111	-178.2	-178.8	176.9	0	104.6
290	P	59.8	Low	37.6	Very low	109 Å²	109	146.3 Å²	146.3	71%	0.708	80%	0.799	S	S	*	*			cis	-122	-142.8	-14.9	39.9	-20	0	0	0	108.8
291	P	52.7	Low	39	Very low	114 Å²	114	145.1 Å²	145.1	74%	0.74	79%	0.794	S	S	*	*			cis	-119.3	169	-26.4	39.4	-24.7	0	0	0	113.2
292	L	35.8	Very low	38.7	Very low	138 Å²	138	140.8 Å²	140.8	72%	0.723	79%	0.789	S	S	*	*			cis	97.4	108.4	1.6	-146.6	179	0	0	0	118.3
293	A	32.6	Very low	38.9	Very low	86 Å²	86	138.9 Å²	138.9	71%	0.711	78%	0.783	S	S	*	*			trans	-143.6	117.9	153.4	0	0	0	0	0	108.3
294	Q	33.7	Very low	38.5	Very low	175 Å²	175	141 Å²	141	82%	0.818	79%	0.788	S	S	*	*				84.7	151.3	81.6	-76	-171.6	21.9	0	0	115.2
295	T	31.5	Very low	39.7	Very low	110 Å²	110	137 Å²	137	68%	0.675	78%	0.782	S	S	*	*				-159	164.4	-55.2	-19.4	0	0	0	0	111.6
296	M	31	Very low	41.3	Very low	179 Å²	179	138.3 Å²	138.3	88%	0.882	78%	0.777	S	S	*	*			trans	86.9	166.4	152.7	-69.1	172.8	-170.5	0	0	122.2
297	M	30.8	Very low	41.5	Very low	177 Å²	177	139 Å²	139	87%	0.872	77%	0.77	S	S	*	*			trans	-138.3	-150.9	-164.1	-56.2	174.3	85.6	0	0	110.7
298	P	67.3	Low	41.5	Very low	115 Å²	115	139.6 Å²	139.6	75%	0.747	77%	0.773	S	S	*	*				-107.5	-173.3	-86.3	40.7	-25.3	0	0	0	113.2
299	P	48.1	Very low	41.7	Very low	127 Å²	127	137.4 Å²	137.4	83%	0.825	78%	0.775	S	S	*	*				-156.9	-162.3	90.8	41.4	-19.3	0	0	0	116.3
300	Q	35.8	Very low	41.9	Very low	180 Å²	180	137.5 Å²	137.5	84%	0.841	78%	0.778	S	S	*	*			trans	-127	-165.3	171.7	-59	-172.1	-12.1	0	0	110.3
301	P	68.4	Low	41.6	Very low	106 Å²	106	136.8 Å²	136.8	69%	0.688	77%	0.773	S	S	*	*			cis	-127.9	174.1	-40.7	24.2	-2.8	0	0	0	114.1
302	L	29.2	Very low	40.8	Very low	174 Å²	174	140 Å²	140	91%	0.911	78%	0.779	S	S	*	*			trans	-153	-170.8	163.6	-141.8	64	0	0	0	115.9
303	V	35.7	Very low	41.8	Very low	112 Å²	112	138 Å²	138	68%	0.679	77%	0.774	S	S	*	*			trans	-152.3	130.9	-137.1	162.8	0	0	0	0	116.9
304	Q	34.3	Very low	41.9	Very low	178 Å²	178	141.3 Å²	141.3	83%	0.832	78%	0.779	S	S	*	*			trans	73.2	-167.4	153.1	-63.3	175.8	30.7	0	0	121.5
305	P	54.3	Low	42.1	Very low	109 Å²	109	139.9 Å²	139.9	71%	0.708	78%	0.776	S	S	*	*				-135	-146.5	-98.4	45	-24.3	0	0	0	114.7
306	P	64	Low	42.3	Very low	103 Å²	103	146.2 Å²	146.2	67%	0.669	79%	0.788	S	S	*	*				-125.4	-174.8	-59.4	29.1	-6.7	0	0	0	114.4
307	L	31.9	Very low	42.5	Very low	149 Å²	149	144.7 Å²	144.7	78%	0.78	78%	0.783	S	S	*	*				160.6	137.1	118.5	-82.2	-179.3	0	0	0	117.7
308	L	33.3	Very low	43.6	Very low	161 Å²	161	141.4 Å²	141.4	84%	0.843	78%	0.775	S	S	*	*			trans	36.3	120.6	146.3	-68.8	166.2	0	0	0	124.6
309	A	33.9	Very low	42.2	Very low	100 Å²	100	143.6 Å²	143.6	83%	0.826	78%	0.779	S	S	*	*				-172.4	154.1	116.8	0	0	0	0	0	113.3
310	Q	35.7	Very low	43	Very low	185 Å²	185	142.9 Å²	142.9	86%	0.864	78%	0.775	S	S	*	*			trans	-163.3	172	-179.8	-96.8	-159.7	15.5	0	0	109.8
311	P	53.7	Low	43.7	Very low	94 Å²	94	140.5 Å²	140.5	61%	0.61	78%	0.775	S	S	*	*			cis	-144.4	155.2	-39.9	40.2	-23	0	0	0	116.3
312	Q	36.1	Very low	42.3	Very low	182 Å²	182	144.2 Å²	144.2	85%	0.85	78%	0.783	S	S	*	*			trans	60.3	173.1	141	-80.7	-158.6	16.5	0	0	122.8
313	P	57.7	Low	43.9	Very low	97 Å²	97	141.1 Å²	141.1	63%	0.63	77%	0.773	S	S	*	*			cis	-137.2	-162.3	-36.5	37.7	-18.8	0	0	0	114.3
314	L	34.8	Very low	44.6	Very low	154 Å²	154	141.5 Å²	141.5	81%	0.806	78%	0.778	S	S	*	*			trans	119.6	141.2	160.7	-65.1	171	0	0	0	114.2
315	L	36.9	Very low	44.9	Very low	145 Å²	145	141.3 Å²	141.3	76%	0.759	78%	0.777	S	S	*	*			cis	-161	120.7	-20.5	-176.8	141.7	0	0	0	112.8
316	R	35.6	Very low	44.1	Very low	244 Å²	244	144.2 Å²	144.2	92%	0.921	78%	0.781	S	S	*	*			trans	52.7	141.2	150.4	-111.7	174.9	-177.2	-178.9	-0.5	125.9
317	N	35.4	Very low	43.6	Very low	147 Å²	147	144.1 Å²	144.1	79%	0.786	78%	0.781	S	S	*	*			trans	-80.9	-173	172.5	-117.1	15.8	0	0	0	114.1
318	P	54.7	Low	43.7	Very low	107 Å²	107	143.9 Å²	143.9	70%	0.695	78%	0.775	S	S	*	*			cis	-143.1	-175.2	-16.8	38.8	-17.2	0	0	0	118.1
319	L	36.5	Very low	43.8	Very low	161 Å²	161	143.6 Å²	143.6	84%	0.843	77%	0.769	S	S	*	*			trans	-3.6	164.2	162.1	-84.6	79.8	0	0	0	126.8
320	P	64.8	Low	43.8	Very low	112 Å²	112	145.3 Å²	145.3	73%	0.727	76%	0.76	S	S	*	*			trans	-106.9	173.6	-171.5	43.4	-37.7	0	0	0	117.5
321	P	50.6	Low	43.8	Very low	130 Å²	130	144.2 Å²	144.2	84%	0.844	76%	0.755	S	S	*	*				-149.2	-164.4	114.9	39.8	-21.7	0	0	0	116.2
322	Q	39.1	Very low	42.8	Very low	185 Å²	185	148 Å²	148	86%	0.864	76%	0.764	S	S	*	*			trans	-92.1	-157.2	-174.6	-60.6	-173.2	-9	0	0	115.6
323	P	62.7	Low	43.8	Very low	108 Å²	108	144 Å²	144	70%	0.701	75%	0.754	S	S	*	*				-118.8	176.2	-95.3	39.9	-22.9	0	0	0	115
324	P	51	Low	42.6	Very low	120 Å²	120	147.7 Å²	147.7	78%	0.779	76%	0.761	S	S	*	*				-158.6	163	121.8	37.7	-17.7	0	0	0	120.4
325	H	39.4	Very low	42.6	Very low	174 Å²	174	147.8 Å²	147.8	81%	0.806	76%	0.757	S	S	*	*			trans	1.3	134.7	153.8	-59.2	-72.6	0	0	0	127.4
326	Q	37.9	Very low	42.4	Very low	170 Å²	170	147.6 Å²	147.6	79%	0.794	76%	0.756	S	S	*	*				57.8	162	119.5	-124.9	-171.4	41.8	0	0	122.4
327	P	52.9	Low	42.4	Very low	102 Å²	102	143.5 Å²	143.5	66%	0.662	75%	0.747	S	S	*	*				-153.6	158.6	77.6	40.6	-20.4	0	0	0	120.1
328	Q	35.3	Very low	42.4	Very low	143 Å²	143	141.6 Å²	141.6	67%	0.668	75%	0.745	S	S	*	*			trans	54.6	153.9	144.3	-62.1	172.8	-41.5	0	0	121.5
329	H	35.7	Very low	41.3	Very low	155 Å²	155	143.1 Å²	143.1	72%	0.718	75%	0.746	S	S	*	*			cis	-149.1	-171.9	22.6	-75.9	-84.2	0	0	0	111.7
330	Q	33.1	Very low	41.2	Very low	136 Å²	136	143.5 Å²	143.5	64%	0.636	74%	0.744	S	S	*	*				-176.4	109.3	-50.6	-175.3	177	-25	0	0	114.4
331	H	36.6	Very low	39.7	Very low	162 Å²	162	143.5 Å²	143.5	75%	0.75	75%	0.746	S	S	*	*			trans	71.7	123.7	151.4	-64.6	42.4	0	0	0	119.7
332	Q	31.3	Very low	40	Very low	174 Å²	174	143 Å²	143	81%	0.813	74%	0.743	S	S	*	*				73.8	156.1	83.8	-86.1	-159.6	9	0	0	117.2
333	P	56.8	Low	39.7	Very low	97 Å²	97	141.6 Å²	141.6	63%	0.63	74%	0.737	S	S	*	*			cis	-146.6	-174.7	-30.4	42.6	-23.7	0	0	0	117.2
334	F	33.3	Very low	38.5	Very low	175 Å²	175	144 Å²	144	77%	0.768	74%	0.738	S	S	*	*			trans	77	125.5	155	-91.8	-86.2	0	0	0	125.2
335	Q	35.4	Very low	38.5	Very low	157 Å²	157	143.7 Å²	143.7	73%	0.734	74%	0.736	S	S	*	*			trans	38.9	159.3	143.1	-72.5	-176.6	-1.3	0	0	123.8
336	L	32.6	Very low	38.2	Very low	140 Å²	140	143.3 Å²	143.3	73%	0.733	74%	0.735	S	S	*	*			cis	-133.3	-128.5	3.7	-154.7	71.5	0	0	0	110.9
337	Q	35.9	Very low	38.8	Very low	159 Å²	159	140.6 Å²	140.6	74%	0.743	73%	0.731	S	S	*	*			cis	-160.7	130.7	-4.3	-167.3	161.2	8.5	0	0	113.7
338	S	35	Very low	38.2	Very low	106 Å²	106	142.5 Å²	142.5	74%	0.741	74%	0.735	S	S	*	*			trans	62.3	149.9	163.7	67.1	0	0	0	0	118.5
339	I	32.3	Very low	38.8	Very low	140 Å²	140	141.6 Å²	141.6	72%	0.718	74%	0.742	S	S	*	*			cis	-154.9	153	42.6	-81.9	-179.9	0	0	0	107.6
340	Q	34	Very low	38.7	Very low	169 Å²	169	143.3 Å²	143.3	79%	0.79	75%	0.75	S	S	*	*			cis	-159.5	-154.8	-12.1	-104.6	178.7	-3.8	0	0	108.7
341	S	32.6	Very low	38.5	Very low	111 Å²	111	140.3 Å²	140.3	78%	0.776	76%	0.755	S	S	*	*			trans	-153.6	-174	174.8	-46.9	0	0	0	0	110.4
342	P	57.1	Low	39.8	Very low	120 Å²	120	138.3 Å²	138.3	78%	0.779	76%	0.757	S	S	*	*				-146.4	-149.6	71.2	42.3	-20.6	0	0	0	112.8
343	Q	33.1	Very low	40.8	Very low	156 Å²	156	136.3 Å²	136.3	73%	0.729	76%	0.759	S	S	*	*			cis	-158.2	148.9	2.8	-136.6	-171.3	9.3	0	0	111.7
344	H	36.9	Very low	39.9	Very low	159 Å²	159	140.3 Å²	140.3	74%	0.736	77%	0.769	S	S	*	*			trans	66.3	160.1	149	-79.6	-39.4	0	0	0	122.9
345	P	50.3	Low	39.9	Very low	113 Å²	113	140.2 Å²	140.2	73%	0.734	78%	0.776	S	S	*	*				-134.1	-172.7	-128.1	48.2	-34.2	0	0	0	119.8
346	Q	34.8	Very low	40.2	Very low	166 Å²	166	140.4 Å²	140.4	78%	0.776	78%	0.776	S	S	*	*			trans	-22.9	165	159.1	-67.5	-94.9	-8.1	0	0	119.3
347	P	50.8	Low	40.2	Very low	112 Å²	112	140.6 Å²	140.6	73%	0.727	78%	0.777	S	S	*	*			cis	-138.4	-158.8	15.6	40.8	-19.1	0	0	0	116.9
348	L	39	Very low	41.1	Very low	142 Å²	142	138.1 Å²	138.1	74%	0.743	78%	0.775	S	S	*	*			trans	-68	166.3	-179.9	-61.3	95.9	0	0	0	116.1
349	P	48.3	Very low	41.2	Very low	124 Å²	124	138.5 Å²	138.5	81%	0.805	78%	0.777	S	S	*	*				-146.2	-165.4	109.3	40.9	-25.4	0	0	0	116.3
350	H	34.4	Very low	41.4	Very low	191 Å²	191	139.7 Å²	139.7	88%	0.884	78%	0.78	S	S	*	*			trans	-102.9	171.3	-171.6	-40	-78.5	0	0	0	115.4
351	G	29.1	Very low	42.1	Very low	73 Å²	73	137.5 Å²	137.5	75%	0.753	78%	0.78	S	S	*	*			trans	126.8	144.3	137.1	0	0	0	0	0	119
352	P	63.7	Low	42.2	Very low	120 Å²	120	134.9 Å²	134.9	78%	0.779	77%	0.771	S	S	*	*			trans	-101.4	-178.2	174.5	41.2	-35.8	0	0	0	113.5
353	P	50.9	Low	41	Very low	132 Å²	132	137 Å²	137	86%	0.857	78%	0.775	S	S	*	*				-142.4	-178.2	110.6	39.3	-26.1	0	0	0	116
354	H	38.7	Very low	41.7	Very low	182 Å²	182	135.4 Å²	135.4	84%	0.843	78%	0.778	S	S	*	*			trans	-118.6	161.4	-171.8	-114.2	-88.7	0	0	0	112.8
355	L	32.3	Very low	41.6	Very low	173 Å²	173	136.1 Å²	136.1	91%	0.906	78%	0.782	S	S	*	*			trans	-164.5	159.6	155.9	-112.9	145.8	0	0	0	111.6
356	H	41.6	Very low	40.8	Very low	160 Å²	160	138.3 Å²	138.3	74%	0.741	78%	0.782	S	S	*	*				-151.7	-167.6	-75.6	-168.1	42.4	0	0	0	111
357	L	33.4	Very low	40.5	Very low	144 Å²	144	136 Å²	136	75%	0.754	77%	0.774	S	S	*	*			trans	91.4	152.9	176.3	-103.5	65.8	0	0	0	116.7
358	P	55.5	Low	39.8	Very low	107 Å²	107	138.6 Å²	138.6	70%	0.695	78%	0.776	S	S	*	*				-126.9	-162.2	-109.6	41.1	-21.7	0	0	0	112.8
359	S	35.8	Very low	39.5	Very low	114 Å²	114	139.4 Å²	139.4	80%	0.797	78%	0.776	S	S	*	*			cis	-158.4	-169.7	15.6	-156.2	0	0	0	0	113.1
360	Q	36.7	Very low	38.7	Very low	166 Å²	166	142.5 Å²	142.5	78%	0.776	78%	0.78	S	S	*	*			trans	-150.2	169.5	176.7	-142	-164.6	77.1	0	0	111.5
361	P	49.6	Very low	38.7	Very low	122 Å²	122	141 Å²	141	79%	0.792	77%	0.773	S	S	*	*				-145.8	167.1	80.5	37.4	-18.7	0	0	0	116.9
362	G	33.3	Very low	39	Very low	57 Å²	57	143.8 Å²	143.8	59%	0.588	78%	0.778	S	S	*	*			trans	-88.5	-165.9	167.4	0	0	0	0	0	113.8
363	L	33.2	Very low	37.6	Very low	165 Å²	165	147.1 Å²	147.1	86%	0.864	78%	0.783	S	S	*	*			cis	-158.1	-175.8	8	-105.3	168.9	0	0	0	107.3
364	P	47	Very low	36.7	Very low	122 Å²	122	150.1 Å²	150.1	79%	0.792	79%	0.786	S	S	*	*			cis	-137.4	-138.3	25	42.5	-19	0	0	0	115.8
365	Q	35.1	Very low	36.4	Very low	173 Å²	173	150 Å²	150	81%	0.808	79%	0.791	S	S	*	*			trans	-109.6	159.3	-152.5	-54	178.9	-6.5	0	0	118
366	H	34.1	Very low	36.6	Very low	160 Å²	160	144.9 Å²	144.9	74%	0.741	78%	0.779	S	S	*	*				126.2	136.3	117.8	-153.3	-137	0	0	0	119.4
367	L	29.1	Very low	36.8	Very low	117 Å²	117	143 Å²	143	61%	0.613	78%	0.781	S	S	*	*			trans	67	98.2	150.8	-155.4	78.9	0	0	0	122.6
368	H	34.6	Very low	37.2	Very low	167 Å²	167	141.8 Å²	141.8	77%	0.773	78%	0.782	S	S	*	*				-165.5	164.3	103.9	-116.2	86.2	0	0	0	114.3
369	Q	33.9	Very low	36.7	Very low	159 Å²	159	142.8 Å²	142.8	74%	0.743	79%	0.788	S	S	*	*			trans	-127.9	139.6	-179.1	-178	-175.7	108.6	0	0	109.3
370	Q	31.1	Very low	36.8	Very low	189 Å²	189	145.2 Å²	145.2	88%	0.883	79%	0.793	S	S	*	*			trans	-138.6	139.8	169.3	-68.8	-167.8	10.9	0	0	111.4
371	Q	33.3	Very low	36.8	Very low	159 Å²	159	147.4 Å²	147.4	74%	0.743	79%	0.794	S	S	*	*			trans	-111.2	140.9	172.6	-67.4	177.9	-13.3	0	0	109.7
372	P	37.3	Very low	35.9	Very low	131 Å²	131	153.6 Å²	153.6	85%	0.851	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-66.7	135.5	160.2	-17.9	32.5	0	0	0	110.7
373	Q	32.4	Very low	36.3	Very low	190 Å²	190	157 Å²	157	89%	0.888	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-77.1	149.7	-177.3	-66.6	173.7	-25.5	0	0	112.5
374	Q	32.6	Very low	36.3	Very low	195 Å²	195	153 Å²	153	91%	0.911	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-83.8	131.2	167.9	-66.5	-176.3	6.5	0	0	110.5
375	L	32.2	Very low	35.8	Very low	181 Å²	181	153.6 Å²	153.6	95%	0.948	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-75.3	128.4	171.4	-79.3	160.1	0	0	0	110.6
376	G	36.7	Very low	36.4	Very low	64 Å²	64	156.3 Å²	156.3	66%	0.66	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-77.7	161	177.2	0	0	0	0	0	113.8
377	P	46.9	Very low	36.5	Very low	122 Å²	122	156.6 Å²	156.6	79%	0.792	81%	0.809	S	S	*	*	P	Polyproline II helix	trans	-73.3	154.9	176.7	31.7	-35.6	0	0	0	112.5
378	P	40.5	Very low	36.7	Very low	118 Å²	118	160.8 Å²	160.8	77%	0.766	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-71.7	150.7	-174	28.6	-35.9	0	0	0	113.9	N380	P378-N380 PolarHBondContact O-N 2.8Å
379	P	44.7	Very low	36.6	Very low	127 Å²	127	159.4 Å²	159.4	83%	0.825	82%	0.82	S	S	*	*	S	Bend	trans	-83.6	96.9	-174.5	33.1	-34.7	0	0	0	112.5
380	N	38.4	Very low	36.5	Very low	166 Å²	166	158.5 Å²	158.5	89%	0.888	82%	0.815	S	S	*	*			trans	-160.2	50.8	151.8	-112.9	-24.6	0	0	0	112.2	P378	P378-N380 PolarHBondContact O-N 2.8Å
381	R	36.6	Very low	36.7	Very low	211 Å²	211	152.6 Å²	152.6	80%	0.796	81%	0.805	S	S	*	*			trans	-123.1	107.4	170	-176	-174.3	-66.9	-150.8	0.1	109	I383	R381-I383 HydrophobicContact CG-CD1 4.42Å; R381-I383 HydrophobicContact CG-CG1 3.86Å; R381-I383 PolarHBondContact O-N 3.22Å
382	W	30.1	Very low	36.6	Very low	253 Å²	253	155.1 Å²	155.1	96%	0.958	81%	0.814	S	S	*	*			trans	-63.7	126.5	163.1	-84.4	88.3	0	0	0	109.2
383	I	41.7	Very low	36.4	Very low	129 Å²	129	154.6 Å²	154.6	66%	0.662	81%	0.814	S	S	*	*			trans	-124.9	124.9	174.2	-57.7	177.5	0	0	0	105.8	R381	R381-I383 HydrophobicContact CG-CD1 4.42Å; R381-I383 HydrophobicContact CG-CG1 3.86Å; R381-I383 PolarHBondContact O-N 3.22Å
384	A	34.4	Very low	36.6	Very low	81 Å²	81	154.2 Å²	154.2	67%	0.669	82%	0.817	S	S	*	*			trans	-63.8	135.2	175.9	0	0	0	0	0	110.2	R386	A384-R386 PolarHBondContact O-N 2.95Å
385	P	36.7	Very low	36.5	Very low	134 Å²	134	148.7 Å²	148.7	87%	0.87	81%	0.813	S	S	*	*			trans	-68.5	107.9	-176.6	27	-34	0	0	0	110.9
386	R	46.5	Very low	36.7	Very low	229 Å²	229	144.2 Å²	144.2	86%	0.864	81%	0.81	S	S	*	*			trans	-85	119.3	169.6	-82.3	-173.7	168.4	179.1	-3.3	110.1	A384 R388	A384-R386 PolarHBondContact O-N 2.95Å; R386-R388 PolarHBondContact O-N 3.27Å
387	N	36.8	Very low	36.6	Very low	166 Å²	166	144.8 Å²	144.8	89%	0.888	82%	0.816	S	S	*	*			trans	-59.9	127.5	167.4	-94.6	-33.5	0	0	0	110.3
388	R	33.1	Very low	36.1	Very low	206 Å²	206	145.1 Å²	145.1	78%	0.777	82%	0.816	S	S	*	*			trans	-101.6	108.9	173.2	179.5	178.2	178.3	149.9	-3.2	108.1	R386 E390	R386-R388 PolarHBondContact O-N 3.27Å; R388-E390 IonicContact CZ-OE1 3Å; R388-E390 IonicContact NE-OE1 3.32Å; R388-E390 PolarHBondContact NE-OE1 3.03Å; R388-E390 IonicContact NH2-OE1 3.27Å; R388-E390 PolarHBondContact NH2-OE1 3.06Å; R388-E390 PolarHBondContact O-N 2.89Å
389	V	32.5	Very low	36.2	Very low	138 Å²	138	145.8 Å²	145.8	84%	0.836	82%	0.82	S	S	*	*			trans	-83.9	107.6	177.5	-179	0	0	0	0	109.2
390	E	31.8	Very low	36	Very low	139 Å²	139	147.2 Å²	147.2	65%	0.65	82%	0.82	S	S	*	*			trans	-114	129.4	159.9	-75.6	173.7	-168.7	0	0	107.1	R388	R388-E390 IonicContact CZ-OE1 3Å; R388-E390 IonicContact NE-OE1 3.32Å; R388-E390 PolarHBondContact NE-OE1 3.03Å; R388-E390 IonicContact NH2-OE1 3.27Å; R388-E390 PolarHBondContact NH2-OE1 3.06Å; R388-E390 PolarHBondContact O-N 2.89Å
391	G	34.7	Very low	36.5	Very low	65 Å²	65	145.5 Å²	145.5	67%	0.67	82%	0.821	S	S	*	*			trans	-100.4	132.5	-160.1	0	0	0	0	0	114.3
392	F	31.6	Very low	36.6	Very low	213 Å²	213	139.7 Å²	139.7	93%	0.934	82%	0.817	S	S	*	*			trans	-135.2	141.6	159.4	-81	-83.6	0	0	0	109.5
393	S	32.3	Very low	37.3	Very low	119 Å²	119	132.8 Å²	132.8	83%	0.832	81%	0.808	S	S	*	*			trans	-111.4	127.7	-179.7	-62.2	0	0	0	0	110.6
394	L	37.1	Very low	37.3	Very low	182 Å²	182	131.9 Å²	131.9	95%	0.953	81%	0.81	S	S	*	*			trans	-175.9	146.3	153.2	-106.3	161.2	0	0	0	110.9
395	G	31.9	Very low	37.6	Very low	80 Å²	80	134.4 Å²	134.4	83%	0.825	82%	0.822	S	S	*	*			trans	86.3	129.3	171.3	0	0	0	0	0	115
396	G	36.3	Very low	37.9	Very low	87 Å²	87	131 Å²	131	90%	0.897	80%	0.801	S	S	*	*			trans	-108.5	148.5	176.5	0	0	0	0	0	112.5
397	G	32.9	Very low	38.2	Very low	76 Å²	76	124.1 Å²	124.1	78%	0.784	80%	0.801	S	S	*	*			trans	-168	139.6	176.4	0	0	0	0	0	111.6
398	V	36.4	Very low	39.4	Very low	129 Å²	129	123.6 Å²	123.6	78%	0.782	79%	0.794	S	S	*	*			trans	-26.6	137.2	-178.6	-74.5	0	0	0	0	118.2	L400	V398-L400 PolarHBondContact O-N 2.85Å
399	P	43.3	Very low	41.7	Very low	132 Å²	132	117.1 Å²	117.1	86%	0.857	78%	0.777	S	S	*	*			trans	-76.1	105.4	173	31.5	-33	0	0	0	111.1
400	L	40.9	Very low	44.4	Very low	157 Å²	157	112.9 Å²	112.9	82%	0.822	75%	0.748	S	S	*	*			trans	-76.2	149.1	156.4	-71.9	172.6	0	0	0	109.4	V398 A402	V398-L400 PolarHBondContact O-N 2.85Å; L400-A402 PolarHBondContact O-N 2.95Å
401	S	48.3	Very low	47.3	Very low	130 Å²	130	110.5 Å²	110.5	91%	0.909	74%	0.744	S	S	*	*			trans	-61.4	98.9	-169.6	-166	0	0	0	0	112.4
402	A	39.5	Very low	50	Low	88 Å²	88	109.7 Å²	109.7	73%	0.727	73%	0.726	S	S	*	*			trans	-82	129.3	173.7	0	0	0	0	0	109.7	L400	L400-A402 PolarHBondContact O-N 2.95Å
403	S	43.6	Very low	53	Low	108 Å²	108	99.8 Å²	99.8	76%	0.755	68%	0.683	S	S	*	*			trans	-55.8	141.6	171.4	-54.1	0	0	0	0	110.6	C405	S403-C405 VanDerWaalsContact C-N 3.28Å; S403-C405 PolarHBondContact O-N 3.34Å
404	P	42.2	Very low	55.8	Low	110 Å²	110	100 Å²	100	71%	0.714	67%	0.671	S	S	*	*			trans	-69.3	85.7	177.1	28.8	-34.5	0	0	0	110.5	S406	P404-S406 WeakPolarHBondContact CB-OG 3.33Å; P404-S406 PolarHBondContact O-N 2.95Å
405	C	40.9	Very low	58.5	Low	134 Å²	134	98.4 Å²	98.4	91%	0.905	66%	0.656	S	S	*	*			trans	-84.8	41.4	160.6	-156.8	0	0	0	0	109.7	S403	S403-C405 VanDerWaalsContact C-N 3.28Å; S403-C405 PolarHBondContact O-N 3.34Å
406	S	43.6	Very low	61.5	Low	63 Å²	63	95.5 Å²	95.5	44%	0.441	62%	0.622	S	S	.	*			trans	-76.9	147	171.8	34.4	0	0	0	0	109.8	P404 E408	P404-S406 WeakPolarHBondContact CB-OG 3.33Å; P404-S406 PolarHBondContact O-N 2.95Å; S406-E408 PolarHBondContact O-N 3.46Å; S406-E408 PolarHBondContact OG-OE2 2.92Å
407	G	53.2	Low	64.2	Low	84 Å²	84	96.8 Å²	96.8	87%	0.866	60%	0.599	S	S	*	*			trans	-74.8	42.6	175.7	0	0	0	0	0	113.7	V409	G407-V409 PolarHBondContact O-N 3.09Å
408	E	61.8	Low	66.9	Low	156 Å²	156	98.6 Å²	98.6	73%	0.729	60%	0.595	S	S	*	*			trans	-71.2	115.8	177.6	-72.7	-176.7	116.6	0	0	110.1	S406 H410	S406-E408 PolarHBondContact O-N 3.46Å; S406-E408 PolarHBondContact OG-OE2 2.92Å; E408-H410 PolarHBondContact O-N 2.88Å
409	V	80.7	Confident	69.5	Low	70 Å²	70	97.5 Å²	97.5	42%	0.424	59%	0.589	S	S	.	*			trans	-69.1	123.7	176.1	179.8	0	0	0	0	108.1	G407 L413 E414	G407-V409 PolarHBondContact O-N 3.09Å; V409-L413 HydrophobicContact CG1-CB 4.11Å; V409-L413 HydrophobicContact CG1-CD2 3.9Å; V409-L413 HydrophobicContact CG1-CG 3.86Å; V409-E414 HydrophobicContact CG1-CB 4.46Å
410	H	89.1	Confident	71.9	Confident	49 Å²	49	92.4 Å²	92.4	23%	0.227	55%	0.554	C	S	.	*			trans	-52.1	133.3	-178.9	-165.4	-109.1	0	0	0	111.1	E408 V412 L413 E414 F581 A582 E585	E408-H410 PolarHBondContact O-N 2.88Å; H410-V412 PolarHBondContact O-N 2.81Å; H410-V412 VanDerWaalsContact O-N 3.09Å; H410-L413 HydrophobicContact CB-CB 4.33Å; H410-L413 WeakPolarHBondContact O-CA 3.44Å; H410-L413 VanDerWaalsContact O-CB 3.31Å; H410-L413 WeakPolarHBondContact O-CB 3.34Å; H410-L413 PolarHBondContact O-N 2.63Å; H410-E414 PolarHBondContact O-N 2.61Å; H410-F581 HydrophobicContact CB-CD1 4.09Å; H410-F581 AromaticContact ND1-CE1 3.98Å; H410-A582 HydrophobicContact CB-CB 4.37Å; H410-E585 IonicContact CE1-OE2 3.13Å; H410-E585 PolarHBondContact CE1-OE2 3.06Å; H410-E585 VanDerWaalsContact CE1-OE2 3.23Å; H410-E585 IonicContact ND1-OE2 2.7Å; H410-E585 PolarHBondContact ND1-OE2 2.99Å
411	P	92.8	Very high	74.3	Confident	89 Å²	89	90.9 Å²	90.9	58%	0.578	55%	0.547	S	S	*	.	H	α-helix	trans	-61.4	-27.1	-170.9	21.2	-33.9	0	0	0	113.7	K415	P411-K415 WeakPolarHBondContact O-CB 3.45Å; P411-K415 PolarHBondContact O-N 3.42Å
412	V	92.8	Very high	76.6	Confident	47 Å²	47	85.9 Å²	85.9	29%	0.285	51%	0.508	S	S	.	.	H	α-helix	trans	-68.4	-38.5	172.2	179.9	0	0	0	0	111.4	H410 K415 L416 K452 F581 E585	H410-V412 PolarHBondContact O-N 2.81Å; H410-V412 VanDerWaalsContact O-N 3.09Å; V412-K415 PolarHBondContact O-N 3.31Å; V412-L416 HydrophobicContact CG1-CD1 4.06Å; V412-L416 HydrophobicContact CG1-CG 4.49Å; V412-L416 WeakPolarHBondContact O-CB 3.48Å; V412-L416 VanDerWaalsContact O-CG 3.23Å; V412-L416 WeakPolarHBondContact O-CG 3.4Å; V412-L416 PolarHBondContact O-N 3.09Å; V412-K452 HydrophobicContact CG1-CG 4.32Å; V412-F581 HydrophobicContact CB-CE1 4.19Å; V412-F581 HydrophobicContact CG1-CE1 4.24Å; V412-F581 HydrophobicContact CG1-CZ 4.2Å; V412-E585 WeakPolarHBondContact CB-OE2 3.37Å; V412-E585 WeakPolarHBondContact CG1-OE2 3.39Å; V412-E585 VanDerWaalsContact CG2-OE2 3.3Å; V412-E585 WeakPolarHBondContact CG2-OE2 3.15Å
413	L	92.8	Very high	79.3	Confident	6 Å²	6	83.7 Å²	83.7	3%	0.031	48%	0.484	C	S	.	.	H	α-helix	trans	-68.5	-40.6	175.8	176	55.5	0	0	0	111.8	V409 H410 L416 R417 F578 F581	V409-L413 HydrophobicContact CG1-CB 4.11Å; V409-L413 HydrophobicContact CG1-CD2 3.9Å; V409-L413 HydrophobicContact CG1-CG 3.86Å; H410-L413 HydrophobicContact CB-CB 4.33Å; H410-L413 WeakPolarHBondContact O-CA 3.44Å; H410-L413 VanDerWaalsContact O-CB 3.31Å; H410-L413 WeakPolarHBondContact O-CB 3.34Å; H410-L413 PolarHBondContact O-N 2.63Å; L413-L416 PolarHBondContact O-N 2.72Å; L413-R417 HydrophobicContact CD1-CG 4.12Å; L413-R417 WeakPolarHBondContact O-CB 3.23Å; L413-R417 VanDerWaalsContact O-CG 3.31Å; L413-R417 WeakPolarHBondContact O-CG 3.41Å; L413-R417 PolarHBondContact O-N 3.03Å; L413-F578 HydrophobicContact CD1-CB 4.33Å; L413-F578 HydrophobicContact CD1-CD1 3.26Å; L413-F578 HydrophobicContact CD1-CD2 4.25Å; L413-F578 HydrophobicContact CD1-CE1 3.32Å; L413-F578 HydrophobicContact CD1-CE2 4.31Å; L413-F578 HydrophobicContact CD1-CG 3.74Å; L413-F578 HydrophobicContact CD1-CZ 3.86Å; L413-F578 HydrophobicContact CD2-CB 4.19Å; L413-F578 HydrophobicContact CD2-CD1 4.42Å; L413-F578 HydrophobicContact CD2-CG 4.48Å; L413-F578 HydrophobicContact CG-CD1 4.49Å; L413-F581 HydrophobicContact CB-CD1 3.7Å; L413-F581 HydrophobicContact CB-CD2 4.44Å; L413-F581 HydrophobicContact CB-CE1 3.82Å; L413-F581 HydrophobicContact CB-CG 4.03Å; L413-F581 HydrophobicContact CB-CZ 4.25Å; L413-F581 HydrophobicContact CD1-CD2 4.14Å; L413-F581 HydrophobicContact CD1-CE2 4.33Å; L413-F581 HydrophobicContact CD1-CG 4.4Å; L413-F581 HydrophobicContact CD2-CB 3.8Å; L413-F581 HydrophobicContact CD2-CD1 4.35Å; L413-F581 HydrophobicContact CD2-CD2 4.44Å; L413-F581 HydrophobicContact CD2-CG 3.96Å; L413-F581 HydrophobicContact CG-CG 4.37Å
414	E	93	Very high	81.8	Confident	122 Å²	122	79.4 Å²	79.4	57%	0.57	45%	0.454	S	S	*	.	H	α-helix	trans	-60.3	-46.4	172.9	-175.7	175.8	-142.7	0	0	111.3	V409 H410 L416 R417 T418	V409-E414 HydrophobicContact CG1-CB 4.46Å; H410-E414 PolarHBondContact O-N 2.61Å; E414-L416 PolarHBondContact O-N 2.76Å; E414-R417 PolarHBondContact O-N 2.99Å; E414-T418 WeakPolarHBondContact O-CB 3.33Å; E414-T418 PolarHBondContact O-N 3.48Å; E414-T418 PolarHBondContact O-OG1 3.13Å
415	K	93.5	Very high	84.2	Confident	150 Å²	150	84.6 Å²	84.6	65%	0.652	47%	0.465	S	S	*	.	H	α-helix	trans	-59.6	-43.8	174.7	-175.9	178.5	179.8	179.9	0	112.2	P411 V412 T418 V419	P411-K415 WeakPolarHBondContact O-CB 3.45Å; P411-K415 PolarHBondContact O-N 3.42Å; V412-K415 PolarHBondContact O-N 3.31Å; K415-T418 PolarHBondContact O-N 2.9Å; K415-V419 WeakPolarHBondContact O-CG2 3.4Å; K415-V419 PolarHBondContact O-N 3.04Å
416	L	94	Very high	86.7	Confident	19 Å²	19	84.6 Å²	84.6	10%	0.099	46%	0.456	C	S	.	.	H	α-helix	trans	-62.4	-43.8	177.6	-75.3	165.5	0	0	0	111.9	V412 L413 E414 T418 V419 N420 Y422 I451 F581	V412-L416 HydrophobicContact CG1-CD1 4.06Å; V412-L416 HydrophobicContact CG1-CG 4.49Å; V412-L416 WeakPolarHBondContact O-CB 3.48Å; V412-L416 VanDerWaalsContact O-CG 3.23Å; V412-L416 WeakPolarHBondContact O-CG 3.4Å; V412-L416 PolarHBondContact O-N 3.09Å; L413-L416 PolarHBondContact O-N 2.72Å; E414-L416 PolarHBondContact O-N 2.76Å; L416-T418 VanDerWaalsContact C-N 3.34Å; L416-V419 PolarHBondContact O-N 3.38Å; L416-N420 WeakPolarHBondContact O-CB 3.2Å; L416-N420 PolarHBondContact O-N 2.9Å; L416-N420 PolarHBondContact O-ND2 3.1Å; L416-Y422 HydrophobicContact CB-CE2 4.25Å; L416-Y422 WeakPolarHBondContact O-CE2 3.4Å; L416-I451 HydrophobicContact CD1-CG2 4.49Å; L416-F581 HydrophobicContact CD1-CE2 3.96Å; L416-F581 HydrophobicContact CD1-CZ 3.61Å
417	R	92.5	Very high	89.2	Confident	114 Å²	114	82.8 Å²	82.8	43%	0.43	44%	0.441	S	S	.	.	H	α-helix	trans	-65.6	-33.4	175.1	-71.9	171.5	176.5	-178.8	-0.1	112.8	L413 E414 Y422	L413-R417 HydrophobicContact CD1-CG 4.12Å; L413-R417 WeakPolarHBondContact O-CB 3.23Å; L413-R417 VanDerWaalsContact O-CG 3.31Å; L413-R417 WeakPolarHBondContact O-CG 3.41Å; L413-R417 PolarHBondContact O-N 3.03Å; E414-R417 PolarHBondContact O-N 2.99Å; R417-Y422 HydrophobicContact CG-CD2 4.4Å
418	T	90.9	Very high	91.1	Very high	114 Å²	114	83.6 Å²	83.6	70%	0.699	43%	0.425	S	S	*	.	H	α-helix	trans	-71.2	-37.9	176.4	-56.1	0	0	0	0	111.9	E414 K415 L416	E414-T418 WeakPolarHBondContact O-CB 3.33Å; E414-T418 PolarHBondContact O-N 3.48Å; E414-T418 PolarHBondContact O-OG1 3.13Å; K415-T418 PolarHBondContact O-N 2.9Å; L416-T418 VanDerWaalsContact C-N 3.34Å
419	V	90.9	Very high	92.6	Very high	106 Å²	106	80.1 Å²	80.1	64%	0.642	41%	0.405	S	S	*	.	H	α-helix	trans	-81.2	-26.6	-179.2	173.3	0	0	0	0	112.5	K415 L416	K415-V419 WeakPolarHBondContact O-CG2 3.4Å; K415-V419 PolarHBondContact O-N 3.04Å; L416-V419 PolarHBondContact O-N 3.38Å
420	N	92	Very high	93.3	Very high	24 Å²	24	80.4 Å²	80.4	13%	0.128	41%	0.405	C	S	.	.			trans	-128	122.2	-172.5	-57.8	-84.1	0	0	0	112.6	L416 Y422	L416-N420 WeakPolarHBondContact O-CB 3.2Å; L416-N420 PolarHBondContact O-N 2.9Å; L416-N420 PolarHBondContact O-ND2 3.1Å; N420-Y422 VanDerWaalsContact C-N 3.28Å; N420-Y422 HydrophobicContact CB-CD1 3.9Å; N420-Y422 HydrophobicContact CB-CD2 4.15Å; N420-Y422 HydrophobicContact CB-CE1 3.45Å; N420-Y422 VanDerWaalsContact CB-CE1 3.45Å; N420-Y422 HydrophobicContact CB-CE2 3.75Å; N420-Y422 HydrophobicContact CB-CG 4.24Å; N420-Y422 PolarHBondContact ND2-OH 2.69Å; N420-Y422 PolarHBondContact O-N 3.25Å
421	N	92.7	Very high	93.4	Very high	125 Å²	125	78.6 Å²	78.6	67%	0.668	40%	0.396	S	S	*	.			trans	-71.9	80.5	168.6	-174.9	30.1	0	0	0	110.8
422	Y	96	Very high	93.4	Very high	26 Å²	26	83.4 Å²	83.4	10%	0.102	41%	0.408	C	S	.	.			trans	-76.9	151.5	176	-58.4	-57.2	0	0	0	112.2	L416 R417 N420 W523 I524 I526 F578	L416-Y422 HydrophobicContact CB-CE2 4.25Å; L416-Y422 WeakPolarHBondContact O-CE2 3.4Å; R417-Y422 HydrophobicContact CG-CD2 4.4Å; N420-Y422 VanDerWaalsContact C-N 3.28Å; N420-Y422 HydrophobicContact CB-CD1 3.9Å; N420-Y422 HydrophobicContact CB-CD2 4.15Å; N420-Y422 HydrophobicContact CB-CE1 3.45Å; N420-Y422 VanDerWaalsContact CB-CE1 3.45Å; N420-Y422 HydrophobicContact CB-CE2 3.75Å; N420-Y422 HydrophobicContact CB-CG 4.24Å; N420-Y422 PolarHBondContact ND2-OH 2.69Å; N420-Y422 PolarHBondContact O-N 3.25Å; Y422-W523 HydrophobicContact CD1-CB 4.41Å; Y422-W523 HydrophobicContact CE1-CB 3.88Å; Y422-I524 CarbonylContact C-O 3.47Å; Y422-I524 WeakPolarHBondContact CA-O 3.2Å; Y422-I526 HydrophobicContact CD1-CD1 3.63Å; Y422-I526 HydrophobicContact CD1-CG1 4.35Å; Y422-I526 HydrophobicContact CD2-CD1 4.32Å; Y422-I526 HydrophobicContact CE1-CD1 3.52Å; Y422-I526 HydrophobicContact CE2-CD1 4.22Å; Y422-I526 HydrophobicContact CG-CD1 4.03Å; Y422-F578 AromaticContact CD2-CE2 3.88Å; Y422-F578 HydrophobicContact CD2-CE2 3.88Å; Y422-F578 AromaticContact CD2-CZ 3.68Å; Y422-F578 HydrophobicContact CD2-CZ 3.68Å; Y422-F578 HydrophobicContact CE2-CE2 4.28Å; Y422-F578 AromaticContact CE2-CZ 3.6Å; Y422-F578 HydrophobicContact CE2-CZ 3.6Å; Y422-F578 HydrophobicContact CG-CE2 4.43Å; Y422-F578 HydrophobicContact CG-CZ 4.37Å
423	N	96.5	Very high	93.4	Very high	41 Å²	41	84.6 Å²	84.6	22%	0.219	41%	0.413	C	S	.	.	S	Bend	trans	53.4	48.3	-179.7	-61.9	-38.3	0	0	0	114.6	I524 F525 I526	N423-I524 PolarHBondContact N-O 3.48Å; N423-F525 HydrophobicContact CB-CD1 4.31Å; N423-F525 VanDerWaalsContact OD1-CA 3.29Å; N423-F525 WeakPolarHBondContact OD1-CA 3.38Å; N423-F525 WeakPolarHBondContact OD1-CD1 3.23Å; N423-I526 PolarHBondContact ND2-O 3.3Å; N423-I526 PolarHBondContact OD1-N 3.34Å; N423-I526 PolarHBondContact OD1-O 3.18Å
424	P	96.1	Very high	93.6	Very high	19 Å²	19	84.7 Å²	84.7	12%	0.123	42%	0.416	C	S	.	.			trans	-59.3	137.4	-179.6	24.5	-32.9	0	0	0	112.4	F427 I524 F525	P424-F427 HydrophobicContact CG-CB 4.25Å; P424-F427 HydrophobicContact CG-CD2 4.4Å; P424-I524 WeakPolarHBondContact CD-O 3.33Å; P424-I524 HydrophobicContact CG-CG2 3.89Å; P424-F525 HydrophobicContact CG-CZ 4.45Å
425	K	92.4	Very high	93.8	Very high	218 Å²	218	82.3 Å²	82.3	95%	0.948	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.8	-23.2	-176.8	-63.9	177.9	-178	173.3	0	112.8
426	D	93.1	Very high	94	Very high	135 Å²	135	75.2 Å²	75.2	72%	0.722	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.2	13.3	-175	56.5	-45.9	0	0	0	112.9	D428	D426-D428 PolarHBondContact O-N 3.01Å
427	F	95.4	Very high	94.3	Very high	25 Å²	25	74.3 Å²	74.3	11%	0.11	37%	0.366	C	S	.	.			trans	-62.3	120.5	-177.8	-177.7	-97.5	0	0	0	113.2	P424 W429 Y480 I524 F525 L565 A569	P424-F427 HydrophobicContact CG-CB 4.25Å; P424-F427 HydrophobicContact CG-CD2 4.4Å; F427-W429 HydrophobicContact CD1-CB 4.12Å; F427-W429 HydrophobicContact CE1-CB 4.14Å; F427-W429 PolarHBondContact O-N 3.24Å; F427-W429 VanDerWaalsContact O-N 3.07Å; F427-Y480 HydrophobicContact CE2-CE2 4.45Å; F427-Y480 AromaticContact CZ-CE2 3.88Å; F427-Y480 HydrophobicContact CZ-CE2 3.88Å; F427-I524 HydrophobicContact CD2-CG2 3.93Å; F427-I524 HydrophobicContact CE2-CD1 4.32Å; F427-I524 HydrophobicContact CE2-CG2 3.92Å; F427-F525 HydrophobicContact CB-CE2 4.15Å; F427-F525 HydrophobicContact CB-CZ 3.69Å; F427-F525 AromaticContact CD1-CE2 3.66Å; F427-F525 HydrophobicContact CD1-CE2 3.66Å; F427-F525 AromaticContact CD1-CZ 3.95Å; F427-F525 HydrophobicContact CD1-CZ 3.95Å; F427-F525 AromaticContact CD2-CE2 3.82Å; F427-F525 HydrophobicContact CD2-CE2 3.82Å; F427-F525 HydrophobicContact CD2-CZ 4.2Å; F427-F525 AromaticContact CE1-CE2 3.96Å; F427-F525 HydrophobicContact CE1-CE2 3.96Å; F427-F525 HydrophobicContact CE2-CE2 4.11Å; F427-F525 AromaticContact CG-CE2 3.59Å; F427-F525 HydrophobicContact CG-CE2 3.59Å; F427-F525 AromaticContact CG-CZ 3.67Å; F427-F525 HydrophobicContact CG-CZ 3.67Å; F427-F525 HydrophobicContact CZ-CE2 4.18Å; F427-L565 HydrophobicContact CE1-CB 4.37Å; F427-L565 HydrophobicContact CE1-CD2 4.26Å; F427-L565 HydrophobicContact CZ-CD2 4.4Å; F427-A569 HydrophobicContact CD1-CB 4.19Å
428	D	93.8	Very high	94.6	Very high	100 Å²	100	69 Å²	69	54%	0.535	35%	0.346	S	S	.	.			trans	-73.7	96.5	171.7	-173.9	10.8	0	0	0	111.3	D426 N430	D426-D428 PolarHBondContact O-N 3.01Å; D428-N430 VanDerWaalsContact C-N 3.28Å; D428-N430 WeakPolarHBondContact OD1-CA 3.41Å; D428-N430 WeakPolarHBondContact OD1-CB 3.18Å; D428-N430 PolarHBondContact OD1-N 3.27Å
429	W	93.9	Very high	94.9	Very high	84 Å²	84	63.5 Å²	63.5	32%	0.318	31%	0.313	S	S	.	.			trans	-78.8	-6.4	172.5	51.4	-93.4	0	0	0	113.3	F427 L431 L565 K566	F427-W429 HydrophobicContact CD1-CB 4.12Å; F427-W429 HydrophobicContact CE1-CB 4.14Å; F427-W429 PolarHBondContact O-N 3.24Å; F427-W429 VanDerWaalsContact O-N 3.07Å; W429-L431 PolarHBondContact O-N 3.39Å; W429-L565 HydrophobicContact CB-CB 3.92Å; W429-K566 HydrophobicContact CB-CB 4.34Å; W429-K566 HydrophobicContact CD2-CB 3.67Å; W429-K566 HydrophobicContact CD2-CD 4.15Å; W429-K566 HydrophobicContact CD2-CG 3.76Å; W429-K566 HydrophobicContact CE3-CB 3.74Å; W429-K566 HydrophobicContact CE3-CD 4Å; W429-K566 HydrophobicContact CE3-CG 4.03Å; W429-K566 HydrophobicContact CG-CB 3.92Å; W429-K566 HydrophobicContact CG-CG 4.24Å; W429-K566 HydrophobicContact CH2-CD 3.78Å; W429-K566 HydrophobicContact CH2-CG 4.43Å; W429-K566 HydrophobicContact CZ2-CD 3.9Å; W429-K566 HydrophobicContact CZ2-CG 4.16Å; W429-K566 HydrophobicContact CZ3-CB 4.41Å; W429-K566 HydrophobicContact CZ3-CD 3.83Å; W429-K566 HydrophobicContact CZ3-CG 4.36Å
430	N	94.2	Very high	95.3	Very high	76 Å²	76	59.7 Å²	59.7	41%	0.406	29%	0.287	S	S	.	.			trans	-95.6	58.5	-176.3	-171.8	27.4	0	0	0	112.2	D428 K432 K562	D428-N430 VanDerWaalsContact C-N 3.28Å; D428-N430 WeakPolarHBondContact OD1-CA 3.41Å; D428-N430 WeakPolarHBondContact OD1-CB 3.18Å; D428-N430 PolarHBondContact OD1-N 3.27Å; N430-K432 PolarHBondContact O-N 3.47Å; N430-K432 VanDerWaalsContact O-N 3.1Å; N430-K562 WeakPolarHBondContact OD1-CE 3.21Å
431	L	92.2	Very high	95.5	Very high	10 Å²	10	58.8 Å²	58.8	5%	0.052	28%	0.283	C	S	.	.			trans	-52.3	116.6	-176.7	-78	67.5	0	0	0	112.1	W429 N433 V436 P478 Y480 L558 K562 L565	W429-L431 PolarHBondContact O-N 3.39Å; L431-N433 VanDerWaalsContact C-N 3.34Å; L431-V436 HydrophobicContact CD2-CG2 4.17Å; L431-P478 HydrophobicContact CD2-CG 4.11Å; L431-Y480 HydrophobicContact CD1-CD2 4.41Å; L431-Y480 HydrophobicContact CD1-CE2 4.01Å; L431-Y480 HydrophobicContact CD2-CD2 3.79Å; L431-Y480 HydrophobicContact CD2-CE2 3.83Å; L431-Y480 HydrophobicContact CG-CE2 4.18Å; L431-L558 HydrophobicContact CB-CD1 3.86Å; L431-L558 HydrophobicContact CD2-CD1 4.3Å; L431-K562 WeakPolarHBondContact O-CE 3.34Å; L431-L565 HydrophobicContact CD1-CD1 3.57Å; L431-L565 HydrophobicContact CD2-CD1 4.34Å
432	K	92.6	Very high	95.6	Very high	190 Å²	190	60.6 Å²	60.6	83%	0.826	28%	0.281	S	S	*	.	S	Bend	trans	-71	-31.1	172.2	-61.9	178.9	-176.3	175.7	0	112.4	N430	N430-K432 PolarHBondContact O-N 3.47Å; N430-K432 VanDerWaalsContact O-N 3.1Å
433	N	93.4	Very high	95.6	Very high	72 Å²	72	60.1 Å²	60.1	39%	0.385	28%	0.282	S	S	.	.	S	Bend	trans	-154.3	156.6	173.9	-175.9	37.4	0	0	0	109.1	L431 K476	L431-N433 VanDerWaalsContact C-N 3.34Å; N433-K476 WeakPolarHBondContact ND2-CB 3.43Å; N433-K476 PolarHBondContact ND2-O 2.91Å
434	G	95.6	Very high	95.6	Very high	9 Å²	9	61.8 Å²	61.8	9%	0.093	29%	0.289	C	S	.	.			trans	144.3	174.1	-177.6	0	0	0	0	0	111.5	P478	G434-P478 WeakPolarHBondContact CA-O 3.26Å
435	R	97.9	Very high	95.6	Very high	71 Å²	71	62 Å²	62	27%	0.268	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	145.5	174.1	-61.9	-178.1	72	166.5	2	109.6	F437 S472 P478 L479 Y480 E555	R435-F437 HydrophobicContact CB-CE2 3.78Å; R435-F437 HydrophobicContact CB-CZ 4.48Å; R435-S472 PolarHBondContact NH1-OG 3.12Å; R435-P478 PolarHBondContact N-O 3.47Å; R435-P478 VanDerWaalsContact N-O 3.11Å; R435-L479 HydrophobicContact CB-CG 4.42Å; R435-L479 CarbonylContact O-C 3.55Å; R435-L479 VanDerWaalsContact O-CA 3.29Å; R435-L479 WeakPolarHBondContact O-CA 3.38Å; R435-Y480 PolarHBondContact O-N 2.9Å; R435-E555 IonicContact CZ-OE1 3Å; R435-E555 IonicContact CZ-OE2 3.56Å; R435-E555 IonicContact NE-OE1 3.37Å; R435-E555 PolarHBondContact NE-OE1 3.21Å; R435-E555 IonicContact NH2-OE1 2.83Å; R435-E555 PolarHBondContact NH2-OE1 3.46Å; R435-E555 IonicContact NH2-OE2 3.21Å; R435-E555 PolarHBondContact NH2-OE2 2.82Å
436	V	98.6	Very high	95.8	Very high	2 Å²	2	51.9 Å²	51.9	1%	0.012	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	129.9	-175.1	-175.3	0	0	0	0	110.3	L431 Y480 L482 V556 A561 L565	L431-V436 HydrophobicContact CD2-CG2 4.17Å; V436-Y480 WeakPolarHBondContact CA-O 3.29Å; V436-L482 HydrophobicContact CG1-CD1 3.59Å; V436-L482 HydrophobicContact CG1-CD2 4.22Å; V436-L482 HydrophobicContact CG1-CG 3.7Å; V436-V556 HydrophobicContact CB-CB 4.41Å; V436-V556 HydrophobicContact CG1-CB 4.46Å; V436-V556 PolarHBondContact O-N 2.88Å; V436-A561 HydrophobicContact CB-CB 3.69Å; V436-A561 HydrophobicContact CG1-CB 4.09Å; V436-A561 HydrophobicContact CG2-CB 3.66Å; V436-L565 HydrophobicContact CG2-CD1 4.41Å
437	F	98.8	Very high	96.1	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	147.7	-176.3	-64	-93.4	0	0	0	111.6	R435 L466 A469 L479 Y480 L481 L482 T553 Q554 E555	R435-F437 HydrophobicContact CB-CE2 3.78Å; R435-F437 HydrophobicContact CB-CZ 4.48Å; F437-L466 HydrophobicContact CB-CD2 3.95Å; F437-L466 HydrophobicContact CD1-CD2 4.08Å; F437-L466 HydrophobicContact CD2-CD2 3.84Å; F437-L466 HydrophobicContact CE2-CD2 4.36Å; F437-L466 HydrophobicContact CG-CD2 3.68Å; F437-A469 HydrophobicContact CE2-CB 3.6Å; F437-A469 HydrophobicContact CZ-CB 3.44Å; F437-A469 VanDerWaalsContact CZ-CB 3.44Å; F437-L479 HydrophobicContact CD2-CD1 4.41Å; F437-L479 HydrophobicContact CD2-CD2 3.73Å; F437-L479 HydrophobicContact CD2-CG 4.08Å; F437-L479 HydrophobicContact CE2-CD1 4.02Å; F437-L479 HydrophobicContact CE2-CD2 4.17Å; F437-L479 HydrophobicContact CE2-CG 4.04Å; F437-Y480 PolarHBondContact N-O 3.1Å; F437-L481 HydrophobicContact CB-CD2 3.98Å; F437-L481 CarbonylContact O-C 3.49Å; F437-L481 WeakPolarHBondContact O-CA 3.33Å; F437-L482 PolarHBondContact O-N 2.86Å; F437-T553 WeakPolarHBondContact CD1-O 3.37Å; F437-Q554 CarbonylContact C-O 3.42Å; F437-Q554 VanDerWaalsContact CA-O 3.25Å; F437-Q554 WeakPolarHBondContact CA-O 3.37Å; F437-E555 HydrophobicContact CD1-CB 3.87Å; F437-E555 HydrophobicContact CD1-CG 4.29Å; F437-E555 HydrophobicContact CE1-CB 3.61Å; F437-E555 HydrophobicContact CE1-CG 3.84Å; F437-E555 HydrophobicContact CZ-CB 4.36Å; F437-E555 HydrophobicContact CZ-CG 4.08Å; F437-E555 WeakPolarHBondContact CZ-OE1 3.45Å
438	I	98.8	Very high	96.2	Very high	1 Å²	1	44.4 Å²	44.4	1%	0.005	21%	0.206	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83	136	168.8	-49.9	-57.7	0	0	0	109	K440 L482 F491 V547 T553 Q554 V556	I438-K440 HydrophobicContact CG2-CD 3.77Å; I438-K440 HydrophobicContact CG2-CG 4.11Å; I438-L482 HydrophobicContact CD1-CB 3.99Å; I438-L482 HydrophobicContact CD1-CD1 3.76Å; I438-L482 HydrophobicContact CD1-CG 4.42Å; I438-F491 HydrophobicContact CD1-CE1 3.95Å; I438-F491 HydrophobicContact CD1-CZ 4.09Å; I438-F491 HydrophobicContact CG2-CE1 4.11Å; I438-F491 HydrophobicContact CG2-CZ 4.35Å; I438-V547 HydrophobicContact CD1-CG2 3.77Å; I438-V547 HydrophobicContact CG1-CG2 4.48Å; I438-T553 WeakPolarHBondContact O-CA 3.48Å; I438-T553 PolarHBondContact O-N 2.64Å; I438-Q554 HydrophobicContact CB-CB 4.26Å; I438-Q554 HydrophobicContact CG1-CB 4.16Å; I438-Q554 PolarHBondContact N-O 2.68Å; I438-V556 HydrophobicContact CD1-CG2 3.53Å; I438-V556 HydrophobicContact CG1-CG2 3.85Å
439	I	98.8	Very high	96.3	Very high	0 Å²	0	39.8 Å²	39.8	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	130.3	170.6	-61.8	-61.3	0	0	0	109.4	W456 L466 L481 L482 F483 S484 D552 T553	I439-W456 HydrophobicContact CG2-CH2 4.49Å; I439-W456 HydrophobicContact CG2-CZ2 3.53Å; I439-L466 HydrophobicContact CD1-CD1 3.95Å; I439-L481 HydrophobicContact CD1-CD2 4.13Å; I439-L481 HydrophobicContact CG1-CB 3.89Å; I439-L481 HydrophobicContact CG1-CD1 4.39Å; I439-L481 HydrophobicContact CG1-CD2 4.09Å; I439-L481 HydrophobicContact CG1-CG 4.34Å; I439-L482 PolarHBondContact N-O 2.78Å; I439-F483 HydrophobicContact CB-CD1 3.87Å; I439-F483 HydrophobicContact CB-CE1 3.95Å; I439-F483 HydrophobicContact CB-CG 4.24Å; I439-F483 HydrophobicContact CB-CZ 4.36Å; I439-F483 HydrophobicContact CG1-CE1 4.32Å; I439-F483 HydrophobicContact CG1-CZ 4.25Å; I439-F483 HydrophobicContact CG2-CD1 3.6Å; I439-F483 HydrophobicContact CG2-CE1 3.5Å; I439-F483 VanDerWaalsContact CG2-CE1 3.5Å; I439-F483 HydrophobicContact CG2-CG 4.45Å; I439-F483 HydrophobicContact CG2-CZ 4.24Å; I439-S484 PolarHBondContact O-N 2.92Å; I439-D552 WeakPolarHBondContact CA-OD1 3.49Å; I439-T553 HydrophobicContact CD1-CG2 4.15Å
440	K	98.2	Very high	96.5	Very high	26 Å²	26	35.8 Å²	35.8	11%	0.113	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	96.1	-176.5	-61.8	-59.7	-64.4	131.6	0	111.3	I438 S484 V485 N486 D552	I438-K440 HydrophobicContact CG2-CD 3.77Å; I438-K440 HydrophobicContact CG2-CG 4.11Å; K440-S484 WeakPolarHBondContact CA-O 3.42Å; K440-S484 PolarHBondContact NZ-O 3.39Å; K440-S484 PolarHBondContact NZ-OG 3.11Å; K440-V485 VanDerWaalsContact NZ-C 3.31Å; K440-V485 PolarHBondContact NZ-O 2.76Å; K440-N486 WeakPolarHBondContact CE-OD1 3.17Å; K440-N486 PolarHBondContact NZ-OD1 2.96Å; K440-D552 HydrophobicContact CB-CB 4.01Å; K440-D552 PolarHBondContact N-OD1 2.77Å
441	S	97.2	Very high	96.7	Very high	5 Å²	5	32.3 Å²	32.3	4%	0.035	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	149.8	175.2	-170.1	0	0	0	0	112.3	S443 S484 N486	S441-S443 PolarHBondContact OG-N 3.5Å; S441-S443 VanDerWaalsContact OG-N 3.15Å; S441-S443 PolarHBondContact OG-O 3.4Å; S441-S484 PolarHBondContact N-O 2.95Å; S441-N486 WeakPolarHBondContact O-CB 3.17Å; S441-N486 VanDerWaalsContact O-CG 3.29Å; S441-N486 PolarHBondContact O-N 2.74Å; S441-N486 PolarHBondContact O-ND2 2.85Å
442	Y	94.5	Very high	96.9	Very high	162 Å²	162	33.7 Å²	33.7	64%	0.635	15%	0.153	S	C	*	.	S	Bend	trans	-92.9	-9.8	169.5	-67.2	-89.2	0	0	0	113.3	N486 W515	Y442-N486 VanDerWaalsContact CD1-ND2 3.33Å; Y442-N486 WeakPolarHBondContact CD1-ND2 3.33Å; Y442-N486 VanDerWaalsContact CE1-ND2 3.29Å; Y442-N486 WeakPolarHBondContact CE1-ND2 3.29Å; Y442-W515 HydrophobicContact CD2-CZ2 4.33Å
443	S	94.9	Very high	97.1	Very high	17 Å²	17	28.8 Å²	28.8	12%	0.119	13%	0.13	C	C	.	.			trans	-140.8	145.6	-179.9	164.3	0	0	0	0	111.2	S441 D445	S441-S443 PolarHBondContact OG-N 3.5Å; S441-S443 VanDerWaalsContact OG-N 3.15Å; S441-S443 PolarHBondContact OG-O 3.4Å; S443-D445 VanDerWaalsContact OG-CB 3.23Å; S443-D445 WeakPolarHBondContact OG-CB 3.37Å; S443-D445 PolarHBondContact OG-N 3.37Å; S443-D445 PolarHBondContact OG-OD2 3.28Å
444	E	96.7	Very high	97.3	Very high	76 Å²	76	27.5 Å²	27.5	36%	0.355	13%	0.126	S	C	.	.	H	α-helix	trans	-76.3	-26.6	169.6	-75.7	161.8	-173.4	0	0	111.8	D446 I447 H448 V485 I577 Y584	E444-D446 VanDerWaalsContact C-N 3.29Å; E444-D446 PolarHBondContact O-N 3.06Å; E444-I447 WeakPolarHBondContact O-CB 3.46Å; E444-I447 PolarHBondContact O-N 3.38Å; E444-I447 VanDerWaalsContact O-N 3.07Å; E444-H448 PolarHBondContact O-N 2.63Å; E444-V485 HydrophobicContact CG-CB 4.38Å; E444-V485 HydrophobicContact CG-CG1 4.13Å; E444-V485 HydrophobicContact CG-CG2 3.78Å; E444-I577 HydrophobicContact CB-CD1 4.49Å; E444-Y584 HydrophobicContact CB-CE1 3.92Å; E444-Y584 VanDerWaalsContact CB-OH 3.23Å; E444-Y584 WeakPolarHBondContact CB-OH 3.4Å; E444-Y584 PolarHBondContact OE2-OH 3.13Å
445	D	96.7	Very high	97.4	Very high	22 Å²	22	28 Å²	28	12%	0.118	13%	0.126	C	C	.	.	H	α-helix	trans	-59.3	-40.3	172.2	-52.4	-90	0	0	0	111.6	S443 I447 H448 R449 Y584 R587	S443-D445 VanDerWaalsContact OG-CB 3.23Å; S443-D445 WeakPolarHBondContact OG-CB 3.37Å; S443-D445 PolarHBondContact OG-N 3.37Å; S443-D445 PolarHBondContact OG-OD2 3.28Å; D445-I447 VanDerWaalsContact C-N 3.31Å; D445-I447 PolarHBondContact O-N 2.86Å; D445-H448 PolarHBondContact O-N 3.31Å; D445-R449 WeakPolarHBondContact O-CB 3.49Å; D445-R449 WeakPolarHBondContact O-CG 3.49Å; D445-R449 PolarHBondContact O-N 2.86Å; D445-R449 IonicContact OD1-NH2 3.41Å; D445-Y584 WeakPolarHBondContact OD1-CD1 3.36Å; D445-R587 VanDerWaalsContact CG-NH1 3.29Å; D445-R587 WeakPolarHBondContact OD1-CD 3.39Å; D445-R587 IonicContact OD1-CZ 2.76Å; D445-R587 IonicContact OD1-NE 3.86Å; D445-R587 IonicContact OD1-NH1 3.15Å; D445-R587 PolarHBondContact OD1-NH1 2.77Å; D445-R587 IonicContact OD2-NH1 2.9Å; D445-R587 PolarHBondContact OD2-NH1 2.88Å; D445-R587 VanDerWaalsContact OD2-NH1 3.13Å
446	D	96.8	Very high	97.5	Very high	7 Å²	7	25.1 Å²	25.1	4%	0.037	12%	0.116	C	C	.	.	H	α-helix	trans	-65.8	-34.2	175.9	-69.8	-40.9	0	0	0	111.7	E444 S450 W456 W510 S511	E444-D446 VanDerWaalsContact C-N 3.29Å; E444-D446 PolarHBondContact O-N 3.06Å; D446-S450 VanDerWaalsContact O-CB 3.23Å; D446-S450 WeakPolarHBondContact O-CB 3.33Å; D446-S450 PolarHBondContact O-N 3.44Å; D446-W456 HydrophobicContact CB-CH2 4.17Å; D446-W456 HydrophobicContact CB-CZ3 4.2Å; D446-W510 HydrophobicContact CB-CE3 4.26Å; D446-W510 WeakPolarHBondContact OD1-CA 3.43Å; D446-S511 WeakPolarHBondContact OD1-CB 3.5Å; D446-S511 PolarHBondContact OD1-N 2.91Å; D446-S511 PolarHBondContact OD1-OG 3.33Å; D446-S511 WeakPolarHBondContact OD2-CB 3.48Å; D446-S511 PolarHBondContact OD2-OG 2.78Å
447	I	98.2	Very high	97.4	Very high	1 Å²	1	25.4 Å²	25.4	1%	0.005	12%	0.118	C	C	.	.	H	α-helix	trans	-67.3	-48.7	173.7	-57.3	-62.5	0	0	0	110.3	E444 D445 R449 S450 I451 W456 F483 V485 W523 I577	E444-I447 WeakPolarHBondContact O-CB 3.46Å; E444-I447 PolarHBondContact O-N 3.38Å; E444-I447 VanDerWaalsContact O-N 3.07Å; D445-I447 VanDerWaalsContact C-N 3.31Å; D445-I447 PolarHBondContact O-N 2.86Å; I447-R449 PolarHBondContact O-N 3.35Å; I447-S450 WeakPolarHBondContact O-CB 3.17Å; I447-S450 PolarHBondContact O-N 2.69Å; I447-I451 HydrophobicContact CG2-CD1 3.99Å; I447-I451 WeakPolarHBondContact O-CG1 3.5Å; I447-I451 PolarHBondContact O-N 3.26Å; I447-W456 HydrophobicContact CD1-CH2 4.05Å; I447-W456 HydrophobicContact CD1-CZ3 4.2Å; I447-F483 HydrophobicContact CD1-CB 4.39Å; I447-F483 HydrophobicContact CD1-CD1 3.63Å; I447-F483 HydrophobicContact CD1-CE1 4.39Å; I447-F483 HydrophobicContact CD1-CG 4.41Å; I447-V485 HydrophobicContact CD1-CG2 4.42Å; I447-V485 HydrophobicContact CG1-CG2 3.78Å; I447-W523 HydrophobicContact CD1-CH2 4.5Å; I447-W523 HydrophobicContact CG2-CH2 3.84Å; I447-W523 HydrophobicContact CG2-CZ2 4.3Å; I447-I577 HydrophobicContact CB-CD1 3.86Å; I447-I577 HydrophobicContact CG2-CD1 3.74Å
448	H	97.9	Very high	97.2	Very high	1 Å²	1	25.6 Å²	25.6	1%	0.005	12%	0.119	C	C	.	.	H	α-helix	trans	-55.5	-50.9	175.6	165	-106.3	0	0	0	111.4	E444 D445 S450 I451 K452 I577 F581 Y584 E585	E444-H448 PolarHBondContact O-N 2.63Å; D445-H448 PolarHBondContact O-N 3.31Å; H448-S450 VanDerWaalsContact C-N 3.3Å; H448-S450 PolarHBondContact O-N 3.42Å; H448-I451 PolarHBondContact O-N 3.33Å; H448-I451 VanDerWaalsContact O-N 3.15Å; H448-K452 WeakPolarHBondContact O-CB 3.46Å; H448-K452 PolarHBondContact O-N 2.94Å; H448-I577 HydrophobicContact CB-CD1 4.04Å; H448-F581 AromaticContact CD2-CD2 3.68Å; H448-F581 AromaticContact CD2-CE2 3.47Å; H448-F581 VanDerWaalsContact CD2-CE2 3.47Å; H448-F581 WeakPolarHBondContact CD2-CE2 3.4Å; H448-F581 AromaticContact CD2-CZ 3.91Å; H448-F581 AromaticContact NE2-CD2 3.97Å; H448-F581 AromaticContact NE2-CE1 3.82Å; H448-F581 AromaticContact NE2-CE2 3.55Å; H448-F581 AromaticContact NE2-CZ 3.46Å; H448-F581 WeakPolarHBondContact NE2-CZ 3.4Å; H448-Y584 HydrophobicContact CB-CD1 4.25Å; H448-Y584 HydrophobicContact CB-CD2 4.48Å; H448-Y584 HydrophobicContact CB-CG 3.98Å; H448-Y584 VanDerWaalsContact CG-CB 3.43Å; H448-E585 IonicContact CE1-OE1 2.7Å; H448-E585 PolarHBondContact CE1-OE1 2.8Å; H448-E585 IonicContact NE2-OE1 3.81Å; H448-E585 PolarHBondContact NE2-OE1 3.48Å
449	R	97	Very high	97	Very high	4 Å²	4	27.9 Å²	27.9	2%	0.015	13%	0.133	C	C	.	.	H	α-helix	trans	-65.6	-33.8	-179.8	-64.6	172.2	-151	-166.7	-0.2	111.1	D445 I447 K452 Y453 V509 E591	D445-R449 WeakPolarHBondContact O-CB 3.49Å; D445-R449 WeakPolarHBondContact O-CG 3.49Å; D445-R449 PolarHBondContact O-N 2.86Å; D445-R449 IonicContact OD1-NH2 3.41Å; I447-R449 PolarHBondContact O-N 3.35Å; R449-K452 PolarHBondContact O-N 2.9Å; R449-Y453 HydrophobicContact CB-CD2 4.23Å; R449-Y453 HydrophobicContact CB-CE2 4.46Å; R449-Y453 WeakPolarHBondContact O-CB 3.42Å; R449-Y453 WeakPolarHBondContact O-CD2 3.39Å; R449-Y453 PolarHBondContact O-N 2.82Å; R449-V509 WeakPolarHBondContact CD-O 3.45Å; R449-V509 PolarHBondContact NH1-O 2.94Å; R449-E591 IonicContact CZ-OE2 3.06Å; R449-E591 IonicContact NH1-OE1 2.79Å; R449-E591 PolarHBondContact NH1-OE1 2.87Å; R449-E591 IonicContact NH1-OE2 2.61Å; R449-E591 PolarHBondContact NH1-OE2 3.47Å; R449-E591 IonicContact NH2-OE2 3.06Å; R449-E591 PolarHBondContact NH2-OE2 2.89Å
450	S	98.2	Very high	96.8	Very high	0 Å²	0	34 Å²	34	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-62.6	-41.9	171.5	-175.8	0	0	0	0	113.3	D446 I447 H448 S454 I455 W523	D446-S450 VanDerWaalsContact O-CB 3.23Å; D446-S450 WeakPolarHBondContact O-CB 3.33Å; D446-S450 PolarHBondContact O-N 3.44Å; I447-S450 WeakPolarHBondContact O-CB 3.17Å; I447-S450 PolarHBondContact O-N 2.69Å; H448-S450 VanDerWaalsContact C-N 3.3Å; H448-S450 PolarHBondContact O-N 3.42Å; S450-S454 VanDerWaalsContact O-CA 3.32Å; S450-S454 WeakPolarHBondContact O-CA 3.38Å; S450-S454 PolarHBondContact O-N 3.49Å; S450-I455 WeakPolarHBondContact CA-O 3.42Å; S450-I455 VanDerWaalsContact CB-O 3.28Å; S450-I455 WeakPolarHBondContact CB-O 3.42Å; S450-I455 PolarHBondContact O-N 3.01Å; S450-I455 PolarHBondContact OG-O 3.3Å; S450-W523 PolarHBondContact O-NE1 3.03Å; S450-W523 PolarHBondContact OG-NE1 3.04Å
451	I	97.9	Very high	96.7	Very high	2 Å²	2	39.1 Å²	39.1	1%	0.01	19%	0.186	C	C	.	.	H	α-helix	trans	-67.7	-44.2	176.5	-66.9	162.2	0	0	0	110.4	L416 I447 H448 W523 I526 I577 F578	L416-I451 HydrophobicContact CD1-CG2 4.49Å; I447-I451 HydrophobicContact CG2-CD1 3.99Å; I447-I451 WeakPolarHBondContact O-CG1 3.5Å; I447-I451 PolarHBondContact O-N 3.26Å; H448-I451 PolarHBondContact O-N 3.33Å; H448-I451 VanDerWaalsContact O-N 3.15Å; I451-W523 HydrophobicContact CD1-CD2 4.45Å; I451-W523 HydrophobicContact CD1-CE3 4.43Å; I451-W523 HydrophobicContact CD1-CZ3 4.47Å; I451-W523 HydrophobicContact CG1-CD2 3.58Å; I451-W523 HydrophobicContact CG1-CE3 4.03Å; I451-W523 HydrophobicContact CG1-CG 3.91Å; I451-W523 HydrophobicContact CG1-CH2 4.34Å; I451-W523 HydrophobicContact CG1-CZ2 3.93Å; I451-W523 HydrophobicContact CG1-CZ3 4.38Å; I451-I526 HydrophobicContact CB-CD1 4.48Å; I451-I526 HydrophobicContact CD1-CD1 3.98Å; I451-I526 HydrophobicContact CD1-CG1 4.18Å; I451-I526 HydrophobicContact CD1-CG2 4.07Å; I451-I526 HydrophobicContact CG1-CD1 3.95Å; I451-I526 HydrophobicContact CG1-CG1 4.42Å; I451-I526 HydrophobicContact CG2-CD1 3.67Å; I451-I577 HydrophobicContact CD1-CG2 3.58Å; I451-F578 HydrophobicContact CG2-CE1 3.95Å; I451-F578 HydrophobicContact CG2-CZ 4.44Å
452	K	96.7	Very high	96.7	Very high	39 Å²	39	38.9 Å²	38.9	17%	0.17	18%	0.184	C	C	.	.	H	α-helix	trans	-64.8	-37.7	-179.1	-178.2	177.1	176.7	-177.2	0	113.4	V412 H448 R449 E585	V412-K452 HydrophobicContact CG1-CG 4.32Å; H448-K452 WeakPolarHBondContact O-CB 3.46Å; H448-K452 PolarHBondContact O-N 2.94Å; R449-K452 PolarHBondContact O-N 2.9Å; K452-E585 VanDerWaalsContact CD-OE1 3.32Å; K452-E585 WeakPolarHBondContact CD-OE1 3.49Å; K452-E585 WeakPolarHBondContact CE-OE1 3.22Å; K452-E585 IonicContact NZ-OE1 3.55Å; K452-E585 PolarHBondContact NZ-OE1 2.63Å; K452-E585 IonicContact NZ-OE2 3.27Å
453	Y	96.8	Very high	96.8	Very high	88 Å²	88	31.2 Å²	31.2	35%	0.345	15%	0.154	S	C	.	.	H	α-helix	trans	-110.2	0.5	-173.9	-62.1	-64.3	0	0	0	114.9	R449 I455 V509 Q588	R449-Y453 HydrophobicContact CB-CD2 4.23Å; R449-Y453 HydrophobicContact CB-CE2 4.46Å; R449-Y453 WeakPolarHBondContact O-CB 3.42Å; R449-Y453 WeakPolarHBondContact O-CD2 3.39Å; R449-Y453 PolarHBondContact O-N 2.82Å; Y453-I455 VanDerWaalsContact C-N 3.28Å; Y453-I455 PolarHBondContact O-N 2.75Å; Y453-V509 HydrophobicContact CD2-CB 4.34Å; Y453-V509 HydrophobicContact CD2-CG1 4.09Å; Y453-V509 HydrophobicContact CD2-CG2 4.24Å; Y453-V509 HydrophobicContact CE2-CB 4.24Å; Y453-V509 HydrophobicContact CE2-CG1 3.8Å; Y453-Q588 PolarHBondContact OH-NE2 3.31Å
454	S	97.9	Very high	97	Very high	45 Å²	45	35.6 Å²	35.6	32%	0.315	17%	0.171	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	39.2	-179.4	-62.2	0	0	0	0	114.1	S450 E520 V521	S450-S454 VanDerWaalsContact O-CA 3.32Å; S450-S454 WeakPolarHBondContact O-CA 3.38Å; S450-S454 PolarHBondContact O-N 3.49Å; S454-E520 CarbonylContact O-C 3.47Å; S454-E520 WeakPolarHBondContact O-CA 2.91Å; S454-V521 CarbonylContact C-O 3.53Å; S454-V521 WeakPolarHBondContact CA-O 3.28Å; S454-V521 WeakPolarHBondContact CB-O 3.41Å; S454-V521 PolarHBondContact O-N 2.81Å
455	I	97.9	Very high	97	Very high	18 Å²	18	36.1 Å²	36.1	9%	0.092	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	160.3	-178.6	54.8	168.5	0	0	0	112.3	S450 Y453 A507 V509 W510 K518 F519 E520	S450-I455 WeakPolarHBondContact CA-O 3.42Å; S450-I455 VanDerWaalsContact CB-O 3.28Å; S450-I455 WeakPolarHBondContact CB-O 3.42Å; S450-I455 PolarHBondContact O-N 3.01Å; S450-I455 PolarHBondContact OG-O 3.3Å; Y453-I455 VanDerWaalsContact C-N 3.28Å; Y453-I455 PolarHBondContact O-N 2.75Å; I455-A507 HydrophobicContact CD1-CB 3.98Å; I455-V509 HydrophobicContact CD1-CG2 4.2Å; I455-W510 HydrophobicContact CD1-CH2 4.26Å; I455-W510 HydrophobicContact CD1-CZ2 4.08Å; I455-W510 HydrophobicContact CG1-CH2 4.02Å; I455-W510 HydrophobicContact CG1-CZ2 4.23Å; I455-K518 HydrophobicContact CB-CD 4.44Å; I455-K518 HydrophobicContact CB-CG 4.09Å; I455-K518 HydrophobicContact CD1-CD 3.99Å; I455-K518 HydrophobicContact CD1-CG 4.17Å; I455-K518 HydrophobicContact CG2-CD 4.02Å; I455-K518 HydrophobicContact CG2-CG 4.05Å; I455-F519 CarbonylContact C-O 3.5Å; I455-F519 WeakPolarHBondContact CA-O 3.39Å; I455-F519 WeakPolarHBondContact CB-O 3.3Å; I455-E520 HydrophobicContact CG2-CG 4.42Å
456	W	98.2	Very high	97.1	Very high	11 Å²	11	35.1 Å²	35.1	4%	0.042	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	163	168.4	-167.3	-109.8	0	0	0	112.4	I439 D446 I447 F483 W510 F519 V521	I439-W456 HydrophobicContact CG2-CH2 4.49Å; I439-W456 HydrophobicContact CG2-CZ2 3.53Å; D446-W456 HydrophobicContact CB-CH2 4.17Å; D446-W456 HydrophobicContact CB-CZ3 4.2Å; I447-W456 HydrophobicContact CD1-CH2 4.05Å; I447-W456 HydrophobicContact CD1-CZ3 4.2Å; W456-F483 AromaticContact CD2-CE1 3.67Å; W456-F483 HydrophobicContact CD2-CE1 3.67Å; W456-F483 HydrophobicContact CD2-CZ 4.18Å; W456-F483 AromaticContact CE2-CE1 3.84Å; W456-F483 AromaticContact CE3-CE1 3.74Å; W456-F483 HydrophobicContact CE3-CE1 3.74Å; W456-F483 HydrophobicContact CE3-CZ 4.4Å; W456-F483 HydrophobicContact CG-CE1 4.26Å; W456-F483 HydrophobicContact CG-CZ 4.31Å; W456-F483 HydrophobicContact CH2-CE1 4.15Å; W456-F483 HydrophobicContact CZ2-CE1 4.09Å; W456-F483 AromaticContact CZ3-CE1 3.97Å; W456-F483 HydrophobicContact CZ3-CE1 3.97Å; W456-W510 HydrophobicContact CE3-CH2 4.21Å; W456-W510 HydrophobicContact CE3-CZ3 4.23Å; W456-W510 HydrophobicContact CZ3-CZ3 4.33Å; W456-F519 HydrophobicContact CB-CD2 4.42Å; W456-F519 HydrophobicContact CB-CE1 4.22Å; W456-F519 HydrophobicContact CB-CE2 3.85Å; W456-F519 HydrophobicContact CB-CZ 3.77Å; W456-F519 AromaticContact CD1-CE1 3.96Å; W456-F519 AromaticContact CD1-CZ 3.58Å; W456-F519 HydrophobicContact CG-CZ 4.07Å; W456-F519 PolarHBondContact N-O 3.1Å; W456-F519 WeakPolarHBondContact O-CD1 3.26Å; W456-F519 PolarHBondContact O-N 2.89Å; W456-V521 HydrophobicContact CB-CG1 3.91Å; W456-V521 HydrophobicContact CB-CG2 4.46Å
457	C	96.4	Very high	97.2	Very high	8 Å²	8	35.3 Å²	35.3	5%	0.054	17%	0.165	C	C	.	.			trans	-144.7	130.8	166	-174.3	0	0	0	0	109.1	N463 W510 K516 G517	C457-N463 PolarHBondContact SG-ND2 3.46Å; C457-N463 VanDerWaalsContact SG-ND2 3.44Å; C457-W510 HydrophobicContact CB-CZ2 3.88Å; C457-K516 PolarHBondContact SG-O 3.49Å; C457-K516 VanDerWaalsContact SG-O 3.34Å; C457-G517 WeakPolarHBondContact CB-O 3.36Å; C457-G517 PolarHBondContact SG-O 2.7Å
458	S	95.4	Very high	97.2	Very high	4 Å²	4	38.8 Å²	38.8	3%	0.028	19%	0.19	C	C	.	.			trans	-99.2	-176.5	170.9	175.3	0	0	0	0	110.2	G462 N463 D552 T553	S458-G462 WeakPolarHBondContact OG-CA 3.4Å; S458-N463 WeakPolarHBondContact CA-OD1 3.25Å; S458-N463 WeakPolarHBondContact CB-OD1 3.14Å; S458-N463 PolarHBondContact N-OD1 2.86Å; S458-N463 PolarHBondContact O-ND2 3.28Å; S458-N463 VanDerWaalsContact O-ND2 3.14Å; S458-D552 PolarHBondContact OG-OD2 2.85Å; S458-T553 WeakPolarHBondContact OG-CG2 3.23Å
459	T	94.6	Very high	97.1	Very high	50 Å²	50	38.8 Å²	38.8	31%	0.307	19%	0.19	S	C	.	.			trans	-50.5	157.2	159.5	63.8	0	0	0	0	111.5	H461 G462 N463 W515	T459-H461 VanDerWaalsContact C-N 3.28Å; T459-H461 PolarHBondContact O-N 3.48Å; T459-G462 CarbonylContact O-C 3.42Å; T459-G462 PolarHBondContact O-N 2.85Å; T459-G462 VanDerWaalsContact O-N 3.1Å; T459-G462 PolarHBondContact OG1-N 3.38Å; T459-N463 WeakPolarHBondContact O-CB 3.49Å; T459-N463 PolarHBondContact O-N 2.78Å; T459-W515 HydrophobicContact CG2-CH2 4.36Å; T459-W515 HydrophobicContact CG2-CZ3 3.98Å
460	E	94.4	Very high	97.2	Very high	127 Å²	127	41 Å²	41	59%	0.593	20%	0.198	S	C	*	.	H	α-helix	trans	-56.5	-40.9	177.9	-167.1	-159.8	135.2	0	0	112.8	K464	E460-K464 WeakPolarHBondContact O-CG 3.34Å; E460-K464 PolarHBondContact O-N 2.89Å; E460-K464 WeakPolarHBondContact OE1-CE 3.31Å; E460-K464 IonicContact OE1-NZ 3.71Å; E460-K464 PolarHBondContact OE1-NZ 3.28Å
461	H	95.9	Very high	97.1	Very high	134 Å²	134	47.3 Å²	47.3	62%	0.62	22%	0.222	S	C	*	.	H	α-helix	trans	-64.2	-46.2	175.1	179.9	88.1	0	0	0	111.7	T459 K464 R465	T459-H461 VanDerWaalsContact C-N 3.28Å; T459-H461 PolarHBondContact O-N 3.48Å; H461-K464 PolarHBondContact O-N 3.45Å; H461-R465 WeakPolarHBondContact O-CB 3.44Å; H461-R465 PolarHBondContact O-N 2.9Å
462	G	97.6	Very high	97	Very high	0 Å²	0	50.2 Å²	50.2	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-63.9	-40.6	177.2	0	0	0	0	0	112.7	S458 T459 R465 L466	S458-G462 WeakPolarHBondContact OG-CA 3.4Å; T459-G462 CarbonylContact O-C 3.42Å; T459-G462 PolarHBondContact O-N 2.85Å; T459-G462 VanDerWaalsContact O-N 3.1Å; T459-G462 PolarHBondContact OG1-N 3.38Å; G462-R465 PolarHBondContact O-N 2.84Å; G462-L466 WeakPolarHBondContact O-CB 3.42Å; G462-L466 VanDerWaalsContact O-CG 3.27Å; G462-L466 WeakPolarHBondContact O-CG 3.2Å; G462-L466 PolarHBondContact O-N 2.84Å
463	N	97.5	Very high	96.8	Very high	1 Å²	1	49 Å²	49	1%	0.005	24%	0.238	C	C	.	.	H	α-helix	trans	-57.8	-49.4	172.5	-78.1	-16.8	0	0	0	111.3	C457 S458 T459 R465 L466 D467 V501 Y503 K516	C457-N463 PolarHBondContact SG-ND2 3.46Å; C457-N463 VanDerWaalsContact SG-ND2 3.44Å; S458-N463 WeakPolarHBondContact CA-OD1 3.25Å; S458-N463 WeakPolarHBondContact CB-OD1 3.14Å; S458-N463 PolarHBondContact N-OD1 2.86Å; S458-N463 PolarHBondContact O-ND2 3.28Å; S458-N463 VanDerWaalsContact O-ND2 3.14Å; T459-N463 WeakPolarHBondContact O-CB 3.49Å; T459-N463 PolarHBondContact O-N 2.78Å; N463-R465 VanDerWaalsContact C-N 3.31Å; N463-R465 PolarHBondContact O-N 2.93Å; N463-L466 PolarHBondContact O-N 2.84Å; N463-D467 VanDerWaalsContact O-CB 3.26Å; N463-D467 WeakPolarHBondContact O-CB 3.45Å; N463-D467 PolarHBondContact O-N 3.18Å; N463-V501 HydrophobicContact CB-CG1 4.21Å; N463-Y503 HydrophobicContact CB-CE1 4.07Å; N463-K516 PolarHBondContact ND2-O 2.81Å
464	K	97.7	Very high	96.3	Very high	109 Å²	109	48.8 Å²	48.8	47%	0.474	25%	0.249	S	C	.	.	H	α-helix	trans	-57.8	-42	175.3	-75	169	171.3	172.8	0	112.5	E460 H461 S468 Y503	E460-K464 WeakPolarHBondContact O-CG 3.34Å; E460-K464 PolarHBondContact O-N 2.89Å; E460-K464 WeakPolarHBondContact OE1-CE 3.31Å; E460-K464 IonicContact OE1-NZ 3.71Å; E460-K464 PolarHBondContact OE1-NZ 3.28Å; H461-K464 PolarHBondContact O-N 3.45Å; K464-S468 VanDerWaalsContact O-CB 3.23Å; K464-S468 WeakPolarHBondContact O-CB 3.25Å; K464-S468 PolarHBondContact O-N 3.49Å; K464-Y503 WeakPolarHBondContact CA-OH 3.33Å; K464-Y503 HydrophobicContact CG-CE1 3.94Å
465	R	98.1	Very high	95.5	Very high	88 Å²	88	53.7 Å²	53.7	33%	0.332	27%	0.271	S	S	.	.	H	α-helix	trans	-68.8	-42.6	-179.8	179.9	171.8	159.6	96.1	5.9	112.5	H461 G462 N463 A469 T553 E555	H461-R465 WeakPolarHBondContact O-CB 3.44Å; H461-R465 PolarHBondContact O-N 2.9Å; G462-R465 PolarHBondContact O-N 2.84Å; N463-R465 VanDerWaalsContact C-N 3.31Å; N463-R465 PolarHBondContact O-N 2.93Å; R465-A469 WeakPolarHBondContact O-CB 3.2Å; R465-A469 PolarHBondContact O-N 3.12Å; R465-T553 VanDerWaalsContact CZ-O 3.25Å; R465-T553 PolarHBondContact NE-O 2.83Å; R465-T553 PolarHBondContact NH2-O 3.14Å; R465-E555 VanDerWaalsContact NH2-N 3.1Å
466	L	98.3	Very high	95.1	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-71.5	-41.8	176.6	-68.8	174.9	0	0	0	112.4	F437 I439 G462 N463 A469 Y470 L479 L481 M497 F519 T553	F437-L466 HydrophobicContact CB-CD2 3.95Å; F437-L466 HydrophobicContact CD1-CD2 4.08Å; F437-L466 HydrophobicContact CD2-CD2 3.84Å; F437-L466 HydrophobicContact CE2-CD2 4.36Å; F437-L466 HydrophobicContact CG-CD2 3.68Å; I439-L466 HydrophobicContact CD1-CD1 3.95Å; G462-L466 WeakPolarHBondContact O-CB 3.42Å; G462-L466 VanDerWaalsContact O-CG 3.27Å; G462-L466 WeakPolarHBondContact O-CG 3.2Å; G462-L466 PolarHBondContact O-N 2.84Å; N463-L466 PolarHBondContact O-N 2.84Å; L466-A469 PolarHBondContact O-N 2.85Å; L466-Y470 WeakPolarHBondContact O-CB 2.95Å; L466-Y470 PolarHBondContact O-N 2.92Å; L466-L479 HydrophobicContact CD2-CD2 4.49Å; L466-L481 HydrophobicContact CD2-CD2 3.83Å; L466-M497 HydrophobicContact CB-CE 4.34Å; L466-M497 HydrophobicContact CB-SD 4.17Å; L466-F519 HydrophobicContact CD1-CE1 4.09Å; L466-F519 HydrophobicContact CD1-CZ 3.72Å; L466-T553 HydrophobicContact CD1-CG2 3.85Å; L466-T553 HydrophobicContact CD2-CG2 4.38Å; L466-T553 HydrophobicContact CG-CG2 3.94Å
467	D	97.9	Very high	94.8	Very high	11 Å²	11	60.8 Å²	60.8	6%	0.059	31%	0.31	C	S	.	.	H	α-helix	trans	-63.2	-44.4	176.2	-167.8	45.8	0	0	0	111.5	N463 A469 Y470 R471 P500 V501 Y503	N463-D467 VanDerWaalsContact O-CB 3.26Å; N463-D467 WeakPolarHBondContact O-CB 3.45Å; N463-D467 PolarHBondContact O-N 3.18Å; D467-A469 VanDerWaalsContact C-N 3.34Å; D467-A469 PolarHBondContact O-N 3.45Å; D467-Y470 PolarHBondContact O-N 2.9Å; D467-R471 WeakPolarHBondContact O-CB 3.23Å; D467-R471 VanDerWaalsContact O-CG 3.23Å; D467-R471 WeakPolarHBondContact O-CG 3.41Å; D467-R471 PolarHBondContact O-N 2.7Å; D467-R471 IonicContact OD1-CZ 2.63Å; D467-R471 IonicContact OD1-NE 2.84Å; D467-R471 PolarHBondContact OD1-NE 3.25Å; D467-R471 IonicContact OD1-NH2 3.35Å; D467-R471 PolarHBondContact OD1-NH2 2.91Å; D467-R471 IonicContact OD2-CZ 3.23Å; D467-R471 IonicContact OD2-NE 3.86Å; D467-R471 PolarHBondContact OD2-NE 2.87Å; D467-R471 IonicContact OD2-NH2 3.25Å; D467-R471 PolarHBondContact OD2-NH2 3.33Å; D467-P500 WeakPolarHBondContact OD1-CA 3.23Å; D467-P500 VanDerWaalsContact OD1-CB 3.3Å; D467-P500 WeakPolarHBondContact OD1-CB 3.39Å; D467-V501 HydrophobicContact CB-CB 3.96Å; D467-V501 HydrophobicContact CB-CG2 3.67Å; D467-V501 PolarHBondContact OD1-N 3.05Å; D467-Y503 WeakPolarHBondContact CB-OH 3.41Å; D467-Y503 PolarHBondContact OD2-OH 3.39Å
468	S	98	Very high	94.8	Very high	74 Å²	74	61.7 Å²	61.7	52%	0.517	32%	0.315	S	S	.	.	H	α-helix	trans	-58	-45.9	172.1	-179.7	0	0	0	0	111.4	K464 S472	K464-S468 VanDerWaalsContact O-CB 3.23Å; K464-S468 WeakPolarHBondContact O-CB 3.25Å; K464-S468 PolarHBondContact O-N 3.49Å; S468-S472 VanDerWaalsContact O-CB 3.24Å; S468-S472 WeakPolarHBondContact O-CB 3.47Å; S468-S472 PolarHBondContact O-N 2.83Å; S468-S472 PolarHBondContact O-OG 3.34Å
469	A	97.6	Very high	95	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.008	31%	0.314	C	S	.	.	H	α-helix	trans	-63.6	-45.8	177.7	0	0	0	0	0	112.8	F437 R465 L466 D467 S472 L473 L479	F437-A469 HydrophobicContact CE2-CB 3.6Å; F437-A469 HydrophobicContact CZ-CB 3.44Å; F437-A469 VanDerWaalsContact CZ-CB 3.44Å; R465-A469 WeakPolarHBondContact O-CB 3.2Å; R465-A469 PolarHBondContact O-N 3.12Å; L466-A469 PolarHBondContact O-N 2.85Å; D467-A469 VanDerWaalsContact C-N 3.34Å; D467-A469 PolarHBondContact O-N 3.45Å; A469-S472 WeakPolarHBondContact CA-OG 3.24Å; A469-S472 PolarHBondContact O-N 2.9Å; A469-S472 PolarHBondContact O-OG 3.49Å; A469-L473 PolarHBondContact O-N 2.96Å; A469-L479 HydrophobicContact CB-CD1 3.76Å
470	Y	97.5	Very high	95.2	Very high	50 Å²	50	60.4 Å²	60.4	20%	0.196	30%	0.304	C	S	.	.	H	α-helix	trans	-60.8	-48.6	177.9	-172.6	-100.9	0	0	0	111.6	L466 D467 L473 L479 M497 R498 S499 P500	L466-Y470 WeakPolarHBondContact O-CB 2.95Å; L466-Y470 PolarHBondContact O-N 2.92Å; D467-Y470 PolarHBondContact O-N 2.9Å; Y470-L473 PolarHBondContact O-N 2.85Å; Y470-L479 HydrophobicContact CD2-CB 4.41Å; Y470-L479 HydrophobicContact CD2-CD1 4.43Å; Y470-M497 HydrophobicContact CD2-CB 4.08Å; Y470-M497 HydrophobicContact CD2-CE 4.42Å; Y470-M497 HydrophobicContact CD2-CG 3.69Å; Y470-M497 HydrophobicContact CD2-SD 4.05Å; Y470-M497 HydrophobicContact CE2-CB 4.39Å; Y470-M497 HydrophobicContact CE2-CG 4.13Å; Y470-M497 WeakPolarHBondContact CE2-O 3.49Å; Y470-M497 HydrophobicContact CG-CE 4.05Å; Y470-M497 HydrophobicContact CG-CG 4.26Å; Y470-M497 HydrophobicContact CG-SD 4.19Å; Y470-R498 VanDerWaalsContact OH-C 3.32Å; Y470-R498 PolarHBondContact OH-O 3.38Å; Y470-R498 VanDerWaalsContact OH-O 3.04Å; Y470-S499 VanDerWaalsContact CE1-C 3.49Å; Y470-P500 HydrophobicContact CD1-CB 4.27Å
471	R	96.2	Very high	95.4	Very high	133 Å²	133	54.3 Å²	54.3	50%	0.502	28%	0.276	S	S	.	.	H	α-helix	trans	-62.8	-43.3	176.2	-68.1	174.7	-163.5	-83.7	-1.9	111.9	D467 L473 C474	D467-R471 WeakPolarHBondContact O-CB 3.23Å; D467-R471 VanDerWaalsContact O-CG 3.23Å; D467-R471 WeakPolarHBondContact O-CG 3.41Å; D467-R471 PolarHBondContact O-N 2.7Å; D467-R471 IonicContact OD1-CZ 2.63Å; D467-R471 IonicContact OD1-NE 2.84Å; D467-R471 PolarHBondContact OD1-NE 3.25Å; D467-R471 IonicContact OD1-NH2 3.35Å; D467-R471 PolarHBondContact OD1-NH2 2.91Å; D467-R471 IonicContact OD2-CZ 3.23Å; D467-R471 IonicContact OD2-NE 3.86Å; D467-R471 PolarHBondContact OD2-NE 2.87Å; D467-R471 IonicContact OD2-NH2 3.25Å; D467-R471 PolarHBondContact OD2-NH2 3.33Å; R471-L473 PolarHBondContact O-N 3.27Å; R471-C474 PolarHBondContact O-N 3.07Å; R471-C474 PolarHBondContact O-SG 2.86Å
472	S	95.4	Very high	95.5	Very high	63 Å²	63	48 Å²	48	44%	0.441	25%	0.247	S	C	.	.	H	α-helix	trans	-60.4	-27	179.3	73.6	0	0	0	0	113.5	R435 S468 A469	R435-S472 PolarHBondContact NH1-OG 3.12Å; S468-S472 VanDerWaalsContact O-CB 3.24Å; S468-S472 WeakPolarHBondContact O-CB 3.47Å; S468-S472 PolarHBondContact O-N 2.83Å; S468-S472 PolarHBondContact O-OG 3.34Å; A469-S472 WeakPolarHBondContact CA-OG 3.24Å; A469-S472 PolarHBondContact O-N 2.9Å; A469-S472 PolarHBondContact O-OG 3.49Å
473	L	93.1	Very high	95.6	Very high	14 Å²	14	48 Å²	48	7%	0.073	25%	0.247	C	C	.	.	H	α-helix	trans	-78.2	-20	-177.2	-167.9	52.8	0	0	0	112.5	A469 Y470 R471 N475 K476 G477 P478 L479	A469-L473 PolarHBondContact O-N 2.96Å; Y470-L473 PolarHBondContact O-N 2.85Å; R471-L473 PolarHBondContact O-N 3.27Å; L473-N475 VanDerWaalsContact C-N 3.26Å; L473-N475 PolarHBondContact O-N 3.34Å; L473-N475 VanDerWaalsContact O-N 3.1Å; L473-K476 WeakPolarHBondContact O-CB 3.41Å; L473-K476 VanDerWaalsContact O-CG 3.29Å; L473-K476 WeakPolarHBondContact O-CG 3.08Å; L473-K476 PolarHBondContact O-N 3.04Å; L473-G477 WeakPolarHBondContact CD2-O 3.39Å; L473-P478 WeakPolarHBondContact CD2-O 3.43Å; L473-L479 HydrophobicContact CD2-CB 4.18Å
474	C	85.8	Confident	95.6	Very high	83 Å²	83	48.1 Å²	48.1	56%	0.561	25%	0.248	S	C	*	.	T	Hydrogen-bonded Turn	trans	44.2	43.8	173.9	-65.4	0	0	0	0	114.6	R471 K476	R471-C474 PolarHBondContact O-N 3.07Å; R471-C474 PolarHBondContact O-SG 2.86Å; C474-K476 PolarHBondContact O-N 2.87Å; C474-K476 VanDerWaalsContact O-N 3.13Å
475	N	82	Confident	95.6	Very high	148 Å²	148	43.4 Å²	43.4	79%	0.791	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.8	13.8	-175.9	-53.8	-19	0	0	0	115.7	L473 G477	L473-N475 VanDerWaalsContact C-N 3.26Å; L473-N475 PolarHBondContact O-N 3.34Å; L473-N475 VanDerWaalsContact O-N 3.1Å; N475-G477 PolarHBondContact O-N 2.82Å
476	K	89.8	Confident	95.6	Very high	152 Å²	152	42.2 Å²	42.2	66%	0.661	23%	0.228	S	C	*	.	S	Bend	trans	-78.2	-0.9	-179.7	-58.6	171.4	-179.5	174.4	0	113.9	N433 L473 C474	N433-K476 WeakPolarHBondContact ND2-CB 3.43Å; N433-K476 PolarHBondContact ND2-O 2.91Å; L473-K476 WeakPolarHBondContact O-CB 3.41Å; L473-K476 VanDerWaalsContact O-CG 3.29Å; L473-K476 WeakPolarHBondContact O-CG 3.08Å; L473-K476 PolarHBondContact O-N 3.04Å; C474-K476 PolarHBondContact O-N 2.87Å; C474-K476 VanDerWaalsContact O-N 3.13Å
477	G	92.6	Very high	95.6	Very high	27 Å²	27	46.3 Å²	46.3	28%	0.278	27%	0.271	S	S	.	.	S	Bend	trans	174.9	175.3	-178.8	0	0	0	0	0	111.2	L473 N475	L473-G477 WeakPolarHBondContact CD2-O 3.39Å; N475-G477 PolarHBondContact O-N 2.82Å
478	P	96.3	Very high	95.5	Very high	26 Å²	26	47.4 Å²	47.4	17%	0.169	28%	0.279	C	S	.	.			trans	-80.1	152.6	175.5	33	-34.9	0	0	0	112.2	L431 G434 R435 L473 Y480 E496	L431-P478 HydrophobicContact CD2-CG 4.11Å; G434-P478 WeakPolarHBondContact CA-O 3.26Å; R435-P478 PolarHBondContact N-O 3.47Å; R435-P478 VanDerWaalsContact N-O 3.11Å; L473-P478 WeakPolarHBondContact CD2-O 3.43Å; P478-Y480 HydrophobicContact CB-CD1 4.24Å; P478-Y480 HydrophobicContact CB-CD2 4.43Å; P478-Y480 HydrophobicContact CB-CE1 3.74Å; P478-Y480 HydrophobicContact CB-CE2 3.96Å; P478-Y480 HydrophobicContact CG-CD2 4.25Å; P478-Y480 HydrophobicContact CG-CE1 4.32Å; P478-Y480 HydrophobicContact CG-CE2 3.63Å; P478-E496 HydrophobicContact CB-CG 4.17Å
479	L	98.1	Very high	95.5	Very high	2 Å²	2	45.8 Å²	45.8	1%	0.01	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.8	107.9	163	-168.7	165.5	0	0	0	108.3	R435 F437 L466 A469 Y470 L473 L481 E496 M497	R435-L479 HydrophobicContact CB-CG 4.42Å; R435-L479 CarbonylContact O-C 3.55Å; R435-L479 VanDerWaalsContact O-CA 3.29Å; R435-L479 WeakPolarHBondContact O-CA 3.38Å; F437-L479 HydrophobicContact CD2-CD1 4.41Å; F437-L479 HydrophobicContact CD2-CD2 3.73Å; F437-L479 HydrophobicContact CD2-CG 4.08Å; F437-L479 HydrophobicContact CE2-CD1 4.02Å; F437-L479 HydrophobicContact CE2-CD2 4.17Å; F437-L479 HydrophobicContact CE2-CG 4.04Å; L466-L479 HydrophobicContact CD2-CD2 4.49Å; A469-L479 HydrophobicContact CB-CD1 3.76Å; Y470-L479 HydrophobicContact CD2-CB 4.41Å; Y470-L479 HydrophobicContact CD2-CD1 4.43Å; L473-L479 HydrophobicContact CD2-CB 4.18Å; L479-L481 HydrophobicContact CD2-CD2 3.49Å; L479-L481 VanDerWaalsContact CD2-CD2 3.49Å; L479-L481 HydrophobicContact CD2-CG 4.09Å; L479-E496 WeakPolarHBondContact O-CA 3.29Å; L479-M497 HydrophobicContact CB-CB 4.3Å; L479-M497 HydrophobicContact CD1-SD 4.14Å; L479-M497 HydrophobicContact CD2-CB 3.98Å; L479-M497 HydrophobicContact CD2-SD 4.22Å; L479-M497 PolarHBondContact O-N 3Å
480	Y	98.6	Very high	95.6	Very high	25 Å²	25	47.5 Å²	47.5	10%	0.098	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	145.6	-179.9	-65.3	-45.4	0	0	0	112.7	F427 L431 R435 V436 F437 P478 A495 E496 I524 L565	F427-Y480 HydrophobicContact CE2-CE2 4.45Å; F427-Y480 AromaticContact CZ-CE2 3.88Å; F427-Y480 HydrophobicContact CZ-CE2 3.88Å; L431-Y480 HydrophobicContact CD1-CD2 4.41Å; L431-Y480 HydrophobicContact CD1-CE2 4.01Å; L431-Y480 HydrophobicContact CD2-CD2 3.79Å; L431-Y480 HydrophobicContact CD2-CE2 3.83Å; L431-Y480 HydrophobicContact CG-CE2 4.18Å; R435-Y480 PolarHBondContact O-N 2.9Å; V436-Y480 WeakPolarHBondContact CA-O 3.29Å; F437-Y480 PolarHBondContact N-O 3.1Å; P478-Y480 HydrophobicContact CB-CD1 4.24Å; P478-Y480 HydrophobicContact CB-CD2 4.43Å; P478-Y480 HydrophobicContact CB-CE1 3.74Å; P478-Y480 HydrophobicContact CB-CE2 3.96Å; P478-Y480 HydrophobicContact CG-CD2 4.25Å; P478-Y480 HydrophobicContact CG-CE1 4.32Å; P478-Y480 HydrophobicContact CG-CE2 3.63Å; Y480-A495 CarbonylContact C-O 3.51Å; Y480-A495 WeakPolarHBondContact CA-O 3.49Å; Y480-E496 HydrophobicContact CD1-CB 3.77Å; Y480-E496 HydrophobicContact CD1-CG 3.88Å; Y480-E496 HydrophobicContact CE1-CB 3.77Å; Y480-E496 HydrophobicContact CE1-CG 3.69Å; Y480-I524 HydrophobicContact CD1-CD1 4.12Å; Y480-I524 HydrophobicContact CE1-CD1 3.46Å; Y480-I524 VanDerWaalsContact CE1-CD1 3.46Å; Y480-L565 HydrophobicContact CD2-CD1 3.99Å
481	L	98.8	Very high	95.6	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.3	117.6	-176.7	-60.3	-177.4	0	0	0	108.4	F437 I439 L466 L479 F483 V494 A495 M497 F519 V521	F437-L481 HydrophobicContact CB-CD2 3.98Å; F437-L481 CarbonylContact O-C 3.49Å; F437-L481 WeakPolarHBondContact O-CA 3.33Å; I439-L481 HydrophobicContact CD1-CD2 4.13Å; I439-L481 HydrophobicContact CG1-CB 3.89Å; I439-L481 HydrophobicContact CG1-CD1 4.39Å; I439-L481 HydrophobicContact CG1-CD2 4.09Å; I439-L481 HydrophobicContact CG1-CG 4.34Å; L466-L481 HydrophobicContact CD2-CD2 3.83Å; L479-L481 HydrophobicContact CD2-CD2 3.49Å; L479-L481 VanDerWaalsContact CD2-CD2 3.49Å; L479-L481 HydrophobicContact CD2-CG 4.09Å; L481-F483 HydrophobicContact CB-CD2 4.25Å; L481-F483 HydrophobicContact CB-CE2 3.56Å; L481-F483 HydrophobicContact CB-CZ 4.2Å; L481-F483 HydrophobicContact CD1-CE2 4.48Å; L481-F483 HydrophobicContact CD1-CZ 4.42Å; L481-F483 WeakPolarHBondContact O-CD2 3.38Å; L481-V494 VanDerWaalsContact O-CA 3.31Å; L481-V494 WeakPolarHBondContact O-CA 3.23Å; L481-A495 PolarHBondContact N-O 2.94Å; L481-A495 PolarHBondContact O-N 2.68Å; L481-M497 HydrophobicContact CD1-CB 4.36Å; L481-F519 HydrophobicContact CD1-CE2 3.73Å; L481-F519 HydrophobicContact CD1-CZ 4.12Å; L481-V521 HydrophobicContact CD1-CG1 3.99Å
482	L	98.8	Very high	95.7	Very high	0 Å²	0	39.2 Å²	39.2	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.5	105.9	-176.7	-55.5	178.2	0	0	0	109	V436 F437 I438 I439 F491 V494 V556 V564 L565 I568	V436-L482 HydrophobicContact CG1-CD1 3.59Å; V436-L482 HydrophobicContact CG1-CD2 4.22Å; V436-L482 HydrophobicContact CG1-CG 3.7Å; F437-L482 PolarHBondContact O-N 2.86Å; I438-L482 HydrophobicContact CD1-CB 3.99Å; I438-L482 HydrophobicContact CD1-CD1 3.76Å; I438-L482 HydrophobicContact CD1-CG 4.42Å; I439-L482 PolarHBondContact N-O 2.78Å; L482-F491 HydrophobicContact CB-CD1 4.06Å; L482-F491 HydrophobicContact CB-CE1 3.89Å; L482-V494 HydrophobicContact CD2-CB 4.33Å; L482-V494 HydrophobicContact CD2-CG1 3.92Å; L482-V494 HydrophobicContact CD2-CG2 3.59Å; L482-V556 HydrophobicContact CD1-CG2 4.41Å; L482-V564 HydrophobicContact CD1-CB 4.39Å; L482-V564 HydrophobicContact CD1-CG1 3.62Å; L482-L565 HydrophobicContact CD2-CD2 3.84Å; L482-I568 HydrophobicContact CD2-CD1 4.09Å
483	F	98.8	Very high	95.9	Very high	0 Å²	0	36.3 Å²	36.3	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.6	133.3	-171	-73.8	-99.4	0	0	0	112.3	I439 I447 W456 L481 F491 C492 G493 A495 W523	I439-F483 HydrophobicContact CB-CD1 3.87Å; I439-F483 HydrophobicContact CB-CE1 3.95Å; I439-F483 HydrophobicContact CB-CG 4.24Å; I439-F483 HydrophobicContact CB-CZ 4.36Å; I439-F483 HydrophobicContact CG1-CE1 4.32Å; I439-F483 HydrophobicContact CG1-CZ 4.25Å; I439-F483 HydrophobicContact CG2-CD1 3.6Å; I439-F483 HydrophobicContact CG2-CE1 3.5Å; I439-F483 VanDerWaalsContact CG2-CE1 3.5Å; I439-F483 HydrophobicContact CG2-CG 4.45Å; I439-F483 HydrophobicContact CG2-CZ 4.24Å; I447-F483 HydrophobicContact CD1-CB 4.39Å; I447-F483 HydrophobicContact CD1-CD1 3.63Å; I447-F483 HydrophobicContact CD1-CE1 4.39Å; I447-F483 HydrophobicContact CD1-CG 4.41Å; W456-F483 AromaticContact CD2-CE1 3.67Å; W456-F483 HydrophobicContact CD2-CE1 3.67Å; W456-F483 HydrophobicContact CD2-CZ 4.18Å; W456-F483 AromaticContact CE2-CE1 3.84Å; W456-F483 AromaticContact CE3-CE1 3.74Å; W456-F483 HydrophobicContact CE3-CE1 3.74Å; W456-F483 HydrophobicContact CE3-CZ 4.4Å; W456-F483 HydrophobicContact CG-CE1 4.26Å; W456-F483 HydrophobicContact CG-CZ 4.31Å; W456-F483 HydrophobicContact CH2-CE1 4.15Å; W456-F483 HydrophobicContact CZ2-CE1 4.09Å; W456-F483 AromaticContact CZ3-CE1 3.97Å; W456-F483 HydrophobicContact CZ3-CE1 3.97Å; L481-F483 HydrophobicContact CB-CD2 4.25Å; L481-F483 HydrophobicContact CB-CE2 3.56Å; L481-F483 HydrophobicContact CB-CZ 4.2Å; L481-F483 HydrophobicContact CD1-CE2 4.48Å; L481-F483 HydrophobicContact CD1-CZ 4.42Å; L481-F483 WeakPolarHBondContact O-CD2 3.38Å; F483-F491 CarbonylContact O-C 3.58Å; F483-F491 VanDerWaalsContact O-CA 3.26Å; F483-F491 WeakPolarHBondContact O-CA 3.36Å; F483-F491 WeakPolarHBondContact O-CD1 3.35Å; F483-C492 PolarHBondContact O-N 2.8Å; F483-G493 PolarHBondContact N-O 3.3Å; F483-A495 HydrophobicContact CD2-CB 4.47Å; F483-A495 HydrophobicContact CE2-CB 3.73Å; F483-W523 HydrophobicContact CB-CH2 3.79Å; F483-W523 HydrophobicContact CB-CZ3 4.19Å; F483-W523 AromaticContact CD1-CH2 3.69Å; F483-W523 HydrophobicContact CD1-CH2 3.69Å; F483-W523 AromaticContact CD1-CZ2 3.99Å; F483-W523 HydrophobicContact CD1-CZ2 3.99Å; F483-W523 AromaticContact CD2-CH2 3.52Å; F483-W523 HydrophobicContact CD2-CH2 3.52Å; F483-W523 HydrophobicContact CD2-CZ2 4.02Å; F483-W523 AromaticContact CD2-CZ3 3.9Å; F483-W523 HydrophobicContact CD2-CZ3 3.9Å; F483-W523 HydrophobicContact CE1-CH2 4.08Å; F483-W523 AromaticContact CE1-CZ2 3.9Å; F483-W523 HydrophobicContact CE1-CZ2 3.9Å; F483-W523 AromaticContact CE2-CH2 3.95Å; F483-W523 HydrophobicContact CE2-CH2 3.95Å; F483-W523 AromaticContact CE2-CZ2 3.95Å; F483-W523 HydrophobicContact CE2-CZ2 3.95Å; F483-W523 HydrophobicContact CE2-CZ3 4.48Å; F483-W523 AromaticContact CG-CH2 3.38Å; F483-W523 HydrophobicContact CG-CH2 3.38Å; F483-W523 HydrophobicContact CG-CZ2 4.04Å; F483-W523 HydrophobicContact CG-CZ3 4.04Å; F483-W523 HydrophobicContact CZ-CH2 4.21Å; F483-W523 AromaticContact CZ-CZ2 3.89Å; F483-W523 HydrophobicContact CZ-CZ2 3.89Å
484	S	98.6	Very high	96.1	Very high	5 Å²	5	35.6 Å²	35.6	4%	0.035	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.7	132.6	172.6	169.3	0	0	0	0	109.2	I439 K440 S441 H490	I439-S484 PolarHBondContact O-N 2.92Å; K440-S484 WeakPolarHBondContact CA-O 3.42Å; K440-S484 PolarHBondContact NZ-O 3.39Å; K440-S484 PolarHBondContact NZ-OG 3.11Å; S441-S484 PolarHBondContact N-O 2.95Å; S484-H490 VanDerWaalsContact CB-O 3.3Å; S484-H490 WeakPolarHBondContact CB-O 3.41Å; S484-H490 PolarHBondContact OG-O 2.89Å
485	V	98.4	Very high	96.7	Very high	10 Å²	10	31.7 Å²	31.7	6%	0.061	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	151.4	176.2	-179.1	0	0	0	0	110.1	K440 E444 I447 S488	K440-V485 VanDerWaalsContact NZ-C 3.31Å; K440-V485 PolarHBondContact NZ-O 2.76Å; E444-V485 HydrophobicContact CG-CB 4.38Å; E444-V485 HydrophobicContact CG-CG1 4.13Å; E444-V485 HydrophobicContact CG-CG2 3.78Å; I447-V485 HydrophobicContact CD1-CG2 4.42Å; I447-V485 HydrophobicContact CG1-CG2 3.78Å; V485-S488 PolarHBondContact O-OG 2.8Å
486	N	97.4	Very high	97.5	Very high	62 Å²	62	26 Å²	26	33%	0.332	17%	0.17	S	C	.	.	S	Bend	trans	-69.6	129.3	176.3	-70.7	-29.2	0	0	0	110.3	K440 S441 Y442 S488	K440-N486 WeakPolarHBondContact CE-OD1 3.17Å; K440-N486 PolarHBondContact NZ-OD1 2.96Å; S441-N486 WeakPolarHBondContact O-CB 3.17Å; S441-N486 VanDerWaalsContact O-CG 3.29Å; S441-N486 PolarHBondContact O-N 2.74Å; S441-N486 PolarHBondContact O-ND2 2.85Å; Y442-N486 VanDerWaalsContact CD1-ND2 3.33Å; Y442-N486 WeakPolarHBondContact CD1-ND2 3.33Å; Y442-N486 VanDerWaalsContact CE1-ND2 3.29Å; Y442-N486 WeakPolarHBondContact CE1-ND2 3.29Å; N486-S488 VanDerWaalsContact C-N 3.28Å; N486-S488 PolarHBondContact O-N 2.9Å
487	G	97.2	Very high	97.9	Very high	87 Å²	87	18.8 Å²	18.8	90%	0.897	14%	0.138	S	C	*	.	S	Bend	trans	82.1	-21.3	-176.8	0	0	0	0	0	116.2	G489	G487-G489 PolarHBondContact O-N 3.09Å; G487-G489 VanDerWaalsContact O-N 3.1Å
488	S	97.1	Very high	98.1	Very high	33 Å²	33	22.9 Å²	22.9	23%	0.231	15%	0.145	C	C	.	.	S	Bend	trans	-68.7	-14.2	-170.1	81.4	0	0	0	0	115.9	V485 N486 H490	V485-S488 PolarHBondContact O-OG 2.8Å; N486-S488 VanDerWaalsContact C-N 3.28Å; N486-S488 PolarHBondContact O-N 2.9Å; S488-H490 VanDerWaalsContact C-N 3.25Å; S488-H490 WeakPolarHBondContact CB-CE1 3.49Å; S488-H490 PolarHBondContact O-N 2.93Å; S488-H490 PolarHBondContact O-ND1 3.3Å; S488-H490 PolarHBondContact OG-CE1 3.44Å; S488-H490 VanDerWaalsContact OG-CE1 3.26Å; S488-H490 PolarHBondContact OG-ND1 3.13Å; S488-H490 PolarHBondContact OG-NE2 2.96Å; S488-H490 PolarHBondContact OG-O 2.75Å
489	G	98.1	Very high	98.2	Very high	40 Å²	40	22.7 Å²	22.7	41%	0.412	15%	0.145	S	C	.	.	S	Bend	trans	72.8	9.4	176.5	0	0	0	0	0	115.5	G487 N531	G487-G489 PolarHBondContact O-N 3.09Å; G487-G489 VanDerWaalsContact O-N 3.1Å; G489-N531 VanDerWaalsContact C-CG 3.44Å; G489-N531 WeakPolarHBondContact O-CB 3.37Å; G489-N531 PolarHBondContact O-N 3.47Å; G489-N531 PolarHBondContact O-ND2 3.03Å
490	H	98.6	Very high	98.2	Very high	37 Å²	37	25.2 Å²	25.2	17%	0.171	16%	0.161	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	167.7	-178.3	64	-95.9	0	0	0	112.6	S484 S488 D528 V529	S484-H490 VanDerWaalsContact CB-O 3.3Å; S484-H490 WeakPolarHBondContact CB-O 3.41Å; S484-H490 PolarHBondContact OG-O 2.89Å; S488-H490 VanDerWaalsContact C-N 3.25Å; S488-H490 WeakPolarHBondContact CB-CE1 3.49Å; S488-H490 PolarHBondContact O-N 2.93Å; S488-H490 PolarHBondContact O-ND1 3.3Å; S488-H490 PolarHBondContact OG-CE1 3.44Å; S488-H490 VanDerWaalsContact OG-CE1 3.26Å; S488-H490 PolarHBondContact OG-ND1 3.13Å; S488-H490 PolarHBondContact OG-NE2 2.96Å; S488-H490 PolarHBondContact OG-O 2.75Å; H490-D528 IonicContact CD2-OD1 2.72Å; H490-D528 IonicContact NE2-OD1 3.42Å; H490-V529 WeakPolarHBondContact CA-O 3.24Å; H490-V529 WeakPolarHBondContact CB-O 3.49Å
491	F	98.8	Very high	98.1	Very high	4 Å²	4	24.3 Å²	24.3	2%	0.018	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	131.9	160	-77.8	-101.7	0	0	0	108.7	I438 L482 F483 D528 V529 L534 T548	I438-F491 HydrophobicContact CD1-CE1 3.95Å; I438-F491 HydrophobicContact CD1-CZ 4.09Å; I438-F491 HydrophobicContact CG2-CE1 4.11Å; I438-F491 HydrophobicContact CG2-CZ 4.35Å; L482-F491 HydrophobicContact CB-CD1 4.06Å; L482-F491 HydrophobicContact CB-CE1 3.89Å; F483-F491 CarbonylContact O-C 3.58Å; F483-F491 VanDerWaalsContact O-CA 3.26Å; F483-F491 WeakPolarHBondContact O-CA 3.36Å; F483-F491 WeakPolarHBondContact O-CD1 3.35Å; F491-D528 CarbonylContact O-C 3.58Å; F491-D528 WeakPolarHBondContact O-CA 3.47Å; F491-V529 PolarHBondContact N-O 2.87Å; F491-V529 PolarHBondContact O-N 3.24Å; F491-L534 HydrophobicContact CB-CD1 4.44Å; F491-L534 HydrophobicContact CD2-CD1 3.48Å; F491-L534 VanDerWaalsContact CD2-CD1 3.48Å; F491-L534 HydrophobicContact CE2-CD1 3.92Å; F491-L534 HydrophobicContact CG-CD1 4.07Å; F491-T548 HydrophobicContact CE2-CG2 4.31Å
492	C	98.3	Very high	98	Very high	5 Å²	5	28.1 Å²	28.1	3%	0.034	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	-10	-174.5	53.6	0	0	0	0	113.6	F483 K527	F483-C492 PolarHBondContact O-N 2.8Å; C492-K527 CarbonylContact C-O 3.57Å; C492-K527 VanDerWaalsContact C-O 3.23Å; C492-K527 CarbonylContact O-C 3.6Å; C492-K527 PolarHBondContact O-N 3.19Å; C492-K527 VanDerWaalsContact O-O 3.12Å
493	G	98.1	Very high	97.8	Very high	2 Å²	2	32 Å²	32	2%	0.021	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.1	-172.6	173.8	0	0	0	0	0	115.6	F483 F525	F483-G493 PolarHBondContact N-O 3.3Å; G493-F525 CarbonylContact C-O 3.5Å; G493-F525 WeakPolarHBondContact CA-O 3.46Å
494	V	98.8	Very high	97.4	Very high	0 Å²	0	39.5 Å²	39.5	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.2	131.8	179.9	-176.8	0	0	0	0	109.1	L481 L482 I524 F525 L565 I568	L481-V494 VanDerWaalsContact O-CA 3.31Å; L481-V494 WeakPolarHBondContact O-CA 3.23Å; L482-V494 HydrophobicContact CD2-CB 4.33Å; L482-V494 HydrophobicContact CD2-CG1 3.92Å; L482-V494 HydrophobicContact CD2-CG2 3.59Å; V494-I524 PolarHBondContact O-N 3.04Å; V494-F525 HydrophobicContact CB-CB 4.11Å; V494-F525 HydrophobicContact CB-CD2 4.11Å; V494-F525 HydrophobicContact CG2-CB 4.19Å; V494-F525 HydrophobicContact CG2-CD2 4.19Å; V494-F525 PolarHBondContact N-O 2.88Å; V494-F525 PolarHBondContact O-N 2.86Å; V494-L565 HydrophobicContact CG1-CD2 4.2Å; V494-L565 HydrophobicContact CG2-CD2 4.43Å; V494-I568 HydrophobicContact CG2-CD1 3.98Å; V494-I568 HydrophobicContact CG2-CG2 3.91Å
495	A	98.7	Very high	97	Very high	0 Å²	0	40.1 Å²	40.1	0%	0	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	163.1	169.4	0	0	0	0	0	111.5	Y480 L481 F483 V521 K522 W523	Y480-A495 CarbonylContact C-O 3.51Å; Y480-A495 WeakPolarHBondContact CA-O 3.49Å; L481-A495 PolarHBondContact N-O 2.94Å; L481-A495 PolarHBondContact O-N 2.68Å; F483-A495 HydrophobicContact CD2-CB 4.47Å; F483-A495 HydrophobicContact CE2-CB 3.73Å; A495-V521 HydrophobicContact CB-CB 4.04Å; A495-V521 HydrophobicContact CB-CG2 4.39Å; A495-K522 CarbonylContact C-O 3.23Å; A495-K522 VanDerWaalsContact CA-O 3.25Å; A495-K522 WeakPolarHBondContact CA-O 3.36Å; A495-K522 WeakPolarHBondContact CB-O 3.48Å; A495-W523 HydrophobicContact CB-CB 4.45Å; A495-W523 HydrophobicContact CB-CD2 3.92Å; A495-W523 HydrophobicContact CB-CE3 4.35Å; A495-W523 HydrophobicContact CB-CG 3.97Å
496	E	98	Very high	96.3	Very high	29 Å²	29	44.9 Å²	44.9	14%	0.136	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	131.8	172.3	-168.5	-174.3	151.8	0	0	109.4	P478 L479 Y480 R498 V521 K522 I524	P478-E496 HydrophobicContact CB-CG 4.17Å; L479-E496 WeakPolarHBondContact O-CA 3.29Å; Y480-E496 HydrophobicContact CD1-CB 3.77Å; Y480-E496 HydrophobicContact CD1-CG 3.88Å; Y480-E496 HydrophobicContact CE1-CB 3.77Å; Y480-E496 HydrophobicContact CE1-CG 3.69Å; E496-R498 VanDerWaalsContact CD-NE 3.28Å; E496-R498 IonicContact OE1-CZ 3.87Å; E496-R498 IonicContact OE1-NE 3.66Å; E496-R498 PolarHBondContact OE1-NE 2.89Å; E496-R498 IonicContact OE1-NH1 3.58Å; E496-R498 IonicContact OE1-NH2 3.21Å; E496-R498 PolarHBondContact OE1-NH2 2.68Å; E496-R498 IonicContact OE2-CZ 2.8Å; E496-R498 VanDerWaalsContact OE2-CZ 3.32Å; E496-R498 IonicContact OE2-NE 2.85Å; E496-R498 PolarHBondContact OE2-NE 3.07Å; E496-R498 IonicContact OE2-NH2 2.74Å; E496-R498 PolarHBondContact OE2-NH2 3.46Å; E496-V521 CarbonylContact O-C 3.59Å; E496-V521 VanDerWaalsContact O-CA 3.23Å; E496-V521 WeakPolarHBondContact O-CA 3.37Å; E496-K522 PolarHBondContact N-O 3.33Å; E496-K522 PolarHBondContact O-N 2.98Å; E496-I524 HydrophobicContact CB-CD1 4.03Å
497	M	98.2	Very high	95.7	Very high	1 Å²	1	43 Å²	43	1%	0.005	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	130.9	172.3	-174.1	166.8	177.5	0	0	109.6	L466 Y470 L479 L481 S499 V501 F519	L466-M497 HydrophobicContact CB-CE 4.34Å; L466-M497 HydrophobicContact CB-SD 4.17Å; Y470-M497 HydrophobicContact CD2-CB 4.08Å; Y470-M497 HydrophobicContact CD2-CE 4.42Å; Y470-M497 HydrophobicContact CD2-CG 3.69Å; Y470-M497 HydrophobicContact CD2-SD 4.05Å; Y470-M497 HydrophobicContact CE2-CB 4.39Å; Y470-M497 HydrophobicContact CE2-CG 4.13Å; Y470-M497 WeakPolarHBondContact CE2-O 3.49Å; Y470-M497 HydrophobicContact CG-CE 4.05Å; Y470-M497 HydrophobicContact CG-CG 4.26Å; Y470-M497 HydrophobicContact CG-SD 4.19Å; L479-M497 HydrophobicContact CB-CB 4.3Å; L479-M497 HydrophobicContact CD1-SD 4.14Å; L479-M497 HydrophobicContact CD2-CB 3.98Å; L479-M497 HydrophobicContact CD2-SD 4.22Å; L479-M497 PolarHBondContact O-N 3Å; L481-M497 HydrophobicContact CD1-CB 4.36Å; M497-S499 WeakPolarHBondContact CE-O 3.42Å; M497-V501 HydrophobicContact CE-CG2 3.92Å; M497-F519 HydrophobicContact CE-CB 4.21Å; M497-F519 HydrophobicContact CE-CD1 4.47Å; M497-F519 HydrophobicContact CE-CD2 3.92Å; M497-F519 HydrophobicContact CE-CE2 4.3Å; M497-F519 HydrophobicContact CE-CG 3.98Å; M497-F519 HydrophobicContact CG-CD2 3.74Å; M497-F519 HydrophobicContact CG-CE2 3.95Å; M497-F519 HydrophobicContact SD-CD2 4.07Å; M497-F519 HydrophobicContact SD-CE2 3.98Å
498	R	97.4	Very high	95.2	Very high	113 Å²	113	40.4 Å²	40.4	43%	0.426	22%	0.223	S	C	.	.			trans	-120.9	-12	-171.9	-69.1	-58.5	-171.2	153.4	-10	114.9	Y470 E496 E520 K522	Y470-R498 VanDerWaalsContact OH-C 3.32Å; Y470-R498 PolarHBondContact OH-O 3.38Å; Y470-R498 VanDerWaalsContact OH-O 3.04Å; E496-R498 VanDerWaalsContact CD-NE 3.28Å; E496-R498 IonicContact OE1-CZ 3.87Å; E496-R498 IonicContact OE1-NE 3.66Å; E496-R498 PolarHBondContact OE1-NE 2.89Å; E496-R498 IonicContact OE1-NH1 3.58Å; E496-R498 IonicContact OE1-NH2 3.21Å; E496-R498 PolarHBondContact OE1-NH2 2.68Å; E496-R498 IonicContact OE2-CZ 2.8Å; E496-R498 VanDerWaalsContact OE2-CZ 3.32Å; E496-R498 IonicContact OE2-NE 2.85Å; E496-R498 PolarHBondContact OE2-NE 3.07Å; E496-R498 IonicContact OE2-NH2 2.74Å; E496-R498 PolarHBondContact OE2-NH2 3.46Å; R498-E520 HydrophobicContact CB-CB 4.19Å; R498-E520 PolarHBondContact N-O 2.7Å; R498-K522 HydrophobicContact CG-CB 3.86Å
499	S	97.4	Very high	94.8	Very high	22 Å²	22	40.1 Å²	40.1	15%	0.154	22%	0.22	C	C	.	.	S	Bend	trans	-132.5	159.8	171.9	81	0	0	0	0	111	Y470 M497 F519 E520	Y470-S499 VanDerWaalsContact CE1-C 3.49Å; M497-S499 WeakPolarHBondContact CE-O 3.42Å; S499-F519 WeakPolarHBondContact OG-CA 3.27Å; S499-F519 WeakPolarHBondContact OG-CB 3.4Å; S499-E520 PolarHBondContact OG-N 3.21Å
500	P	97.3	Very high	94.4	Very high	55 Å²	55	38.6 Å²	38.6	36%	0.357	20%	0.202	S	C	.	.			trans	-62.4	170.3	157.3	31.3	-36.2	0	0	0	110.7	D467 Y470	D467-P500 WeakPolarHBondContact OD1-CA 3.23Å; D467-P500 VanDerWaalsContact OD1-CB 3.3Å; D467-P500 WeakPolarHBondContact OD1-CB 3.39Å; Y470-P500 HydrophobicContact CD1-CB 4.27Å
501	V	97.4	Very high	93.8	Very high	6 Å²	6	38.7 Å²	38.7	4%	0.036	21%	0.206	C	C	.	.			trans	-82.2	125.2	176	-175.4	0	0	0	0	110.9	N463 D467 M497 Y503 F519	N463-V501 HydrophobicContact CB-CG1 4.21Å; D467-V501 HydrophobicContact CB-CB 3.96Å; D467-V501 HydrophobicContact CB-CG2 3.67Å; D467-V501 PolarHBondContact OD1-N 3.05Å; M497-V501 HydrophobicContact CE-CG2 3.92Å; V501-Y503 HydrophobicContact CB-CD2 4.47Å; V501-Y503 HydrophobicContact CB-CE1 4.43Å; V501-Y503 HydrophobicContact CB-CE2 4.01Å; V501-Y503 HydrophobicContact CG1-CD1 4.07Å; V501-Y503 HydrophobicContact CG1-CD2 4.22Å; V501-Y503 HydrophobicContact CG1-CE1 4.02Å; V501-Y503 HydrophobicContact CG1-CE2 4.16Å; V501-Y503 HydrophobicContact CG1-CG 4.18Å; V501-Y503 WeakPolarHBondContact O-CE2 3.31Å; V501-F519 HydrophobicContact CG2-CB 4.13Å; V501-F519 HydrophobicContact CG2-CD1 3.69Å; V501-F519 HydrophobicContact CG2-CE1 4.38Å; V501-F519 HydrophobicContact CG2-CG 4.17Å
502	D	96.2	Very high	93.1	Very high	79 Å²	79	42.5 Å²	42.5	42%	0.422	22%	0.224	S	C	.	.	B	Isolated β-bridge	trans	-88	112.7	158.3	179.1	-7	0	0	0	107.9	N504 A505 G517 K518	D502-N504 WeakPolarHBondContact OD1-CA 3.47Å; D502-N504 PolarHBondContact OD1-N 2.83Å; D502-A505 HydrophobicContact CB-CB 3.91Å; D502-A505 PolarHBondContact OD1-N 2.61Å; D502-A505 WeakPolarHBondContact OD2-CB 3.42Å; D502-G517 CarbonylContact O-C 3.43Å; D502-G517 WeakPolarHBondContact O-CA 3.42Å; D502-K518 PolarHBondContact N-O 3.35Å; D502-K518 PolarHBondContact O-N 3.24Å
503	Y	94.9	Very high	92.2	Very high	83 Å²	83	46.5 Å²	46.5	33%	0.325	25%	0.245	S	C	.	.	S	Bend	trans	-80.7	-17.5	-178.8	-60.4	-94.2	0	0	0	113.4	N463 K464 D467 V501	N463-Y503 HydrophobicContact CB-CE1 4.07Å; K464-Y503 WeakPolarHBondContact CA-OH 3.33Å; K464-Y503 HydrophobicContact CG-CE1 3.94Å; D467-Y503 WeakPolarHBondContact CB-OH 3.41Å; D467-Y503 PolarHBondContact OD2-OH 3.39Å; V501-Y503 HydrophobicContact CB-CD2 4.47Å; V501-Y503 HydrophobicContact CB-CE1 4.43Å; V501-Y503 HydrophobicContact CB-CE2 4.01Å; V501-Y503 HydrophobicContact CG1-CD1 4.07Å; V501-Y503 HydrophobicContact CG1-CD2 4.22Å; V501-Y503 HydrophobicContact CG1-CE1 4.02Å; V501-Y503 HydrophobicContact CG1-CE2 4.16Å; V501-Y503 HydrophobicContact CG1-CG 4.18Å; V501-Y503 WeakPolarHBondContact O-CE2 3.31Å
504	N	91.3	Very high	91.5	Very high	156 Å²	156	52.1 Å²	52.1	83%	0.834	27%	0.269	S	S	*	.	S	Bend	trans	-90.7	-22.4	179.3	-62.7	-45.5	0	0	0	111.7	D502 Y506	D502-N504 WeakPolarHBondContact OD1-CA 3.47Å; D502-N504 PolarHBondContact OD1-N 2.83Å; N504-Y506 PolarHBondContact O-N 3.15Å
505	A	89.3	Confident	90.6	Very high	18 Å²	18	54 Å²	54	15%	0.149	28%	0.276	C	S	.	.			trans	-57.3	126.6	173.7	0	0	0	0	0	111.9	D502 G517 K518	D502-A505 HydrophobicContact CB-CB 3.91Å; D502-A505 PolarHBondContact OD1-N 2.61Å; D502-A505 WeakPolarHBondContact OD2-CB 3.42Å; A505-G517 CarbonylContact O-C 3.49Å; A505-G517 WeakPolarHBondContact O-CA 3.42Å; A505-G517 PolarHBondContact O-N 3.39Å; A505-K518 HydrophobicContact CB-CB 3.57Å
506	Y	84.8	Confident	90.1	Very high	110 Å²	110	61.5 Å²	61.5	43%	0.431	31%	0.309	S	S	.	.			trans	-107.4	119.4	165.4	-167.2	-106.7	0	0	0	108.9	N504 D513	N504-Y506 PolarHBondContact O-N 3.15Å; Y506-D513 WeakPolarHBondContact CE2-O 3.45Å; Y506-D513 WeakPolarHBondContact OH-CA 3.35Å; Y506-D513 WeakPolarHBondContact OH-CB 3.16Å; Y506-D513 VanDerWaalsContact OH-CG 3.23Å; Y506-D513 PolarHBondContact OH-O 3.1Å; Y506-D513 PolarHBondContact OH-OD1 3.26Å
507	A	85	Confident	89.8	Confident	24 Å²	24	60.1 Å²	60.1	20%	0.198	30%	0.302	C	S	.	.			trans	-80	-25.4	-175.7	0	0	0	0	0	113.2	I455 V509 W510 K518	I455-A507 HydrophobicContact CD1-CB 3.98Å; A507-V509 HydrophobicContact CB-CG2 4.07Å; A507-V509 PolarHBondContact O-N 2.78Å; A507-W510 HydrophobicContact CB-CZ2 4.32Å; A507-K518 HydrophobicContact CB-CD 4.33Å
508	G	85.8	Confident	89.7	Confident	31 Å²	31	63.5 Å²	63.5	32%	0.32	32%	0.317	S	S	.	.	S	Bend	trans	67.3	-11.3	-179.3	0	0	0	0	0	116.3	R595	G508-R595 PolarHBondContact O-NH1 3.35Å
509	V	87.8	Confident	89.7	Confident	27 Å²	27	58.1 Å²	58.1	16%	0.164	30%	0.297	C	S	.	.			trans	-93.7	-13.4	-176.1	-62.2	0	0	0	0	114.6	R449 Y453 I455 A507	R449-V509 WeakPolarHBondContact CD-O 3.45Å; R449-V509 PolarHBondContact NH1-O 2.94Å; Y453-V509 HydrophobicContact CD2-CB 4.34Å; Y453-V509 HydrophobicContact CD2-CG1 4.09Å; Y453-V509 HydrophobicContact CD2-CG2 4.24Å; Y453-V509 HydrophobicContact CE2-CB 4.24Å; Y453-V509 HydrophobicContact CE2-CG1 3.8Å; I455-V509 HydrophobicContact CD1-CG2 4.2Å; A507-V509 HydrophobicContact CB-CG2 4.07Å; A507-V509 PolarHBondContact O-N 2.78Å
510	W	90.5	Very high	89.8	Confident	9 Å²	9	62.1 Å²	62.1	3%	0.034	31%	0.313	C	S	.	.	S	Bend	trans	-71.4	149.8	-173.4	-53.8	125.6	0	0	0	113.3	D446 I455 W456 C457 A507 Q512 W515	D446-W510 HydrophobicContact CB-CE3 4.26Å; D446-W510 WeakPolarHBondContact OD1-CA 3.43Å; I455-W510 HydrophobicContact CD1-CH2 4.26Å; I455-W510 HydrophobicContact CD1-CZ2 4.08Å; I455-W510 HydrophobicContact CG1-CH2 4.02Å; I455-W510 HydrophobicContact CG1-CZ2 4.23Å; W456-W510 HydrophobicContact CE3-CH2 4.21Å; W456-W510 HydrophobicContact CE3-CZ3 4.23Å; W456-W510 HydrophobicContact CZ3-CZ3 4.33Å; C457-W510 HydrophobicContact CB-CZ2 3.88Å; A507-W510 HydrophobicContact CB-CZ2 4.32Å; W510-Q512 PolarHBondContact O-N 3.04Å; W510-W515 HydrophobicContact CG-CB 4.25Å
511	S	85.5	Confident	89.8	Confident	38 Å²	38	59.7 Å²	59.7	27%	0.266	30%	0.297	S	S	.	.	S	Bend	trans	-57.9	-17.5	179	71.5	0	0	0	0	114.3	D446	D446-S511 WeakPolarHBondContact OD1-CB 3.5Å; D446-S511 PolarHBondContact OD1-N 2.91Å; D446-S511 PolarHBondContact OD1-OG 3.33Å; D446-S511 WeakPolarHBondContact OD2-CB 3.48Å; D446-S511 PolarHBondContact OD2-OG 2.78Å
512	Q	83.9	Confident	89.9	Confident	85 Å²	85	63.9 Å²	63.9	40%	0.397	32%	0.315	S	S	.	.	S	Bend	trans	-136.3	122.1	174.7	-60.8	-176.7	8.9	0	0	109.4	W510 K514 W515	W510-Q512 PolarHBondContact O-N 3.04Å; Q512-K514 HydrophobicContact CB-CD 4.33Å; Q512-K514 HydrophobicContact CB-CG 4.18Å; Q512-K514 PolarHBondContact O-N 2.83Å; Q512-W515 VanDerWaalsContact O-CD1 3.22Å; Q512-W515 PolarHBondContact O-N 3.23Å
513	D	79.5	Confident	90	Very high	89 Å²	89	60.3 Å²	60.3	48%	0.476	30%	0.295	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	2.3	-178.1	-86.2	-22.2	0	0	0	115	Y506 R595	Y506-D513 WeakPolarHBondContact CE2-O 3.45Å; Y506-D513 WeakPolarHBondContact OH-CA 3.35Å; Y506-D513 WeakPolarHBondContact OH-CB 3.16Å; Y506-D513 VanDerWaalsContact OH-CG 3.23Å; Y506-D513 PolarHBondContact OH-O 3.1Å; Y506-D513 PolarHBondContact OH-OD1 3.26Å; D513-R595 IonicContact OD1-CZ 3.19Å; D513-R595 VanDerWaalsContact OD1-CZ 3.27Å; D513-R595 IonicContact OD1-NH1 3.79Å; D513-R595 PolarHBondContact OD1-NH1 2.9Å; D513-R595 IonicContact OD1-NH2 3.44Å; D513-R595 PolarHBondContact OD1-NH2 2.7Å; D513-R595 IonicContact OD2-CZ 3.45Å; D513-R595 IonicContact OD2-NH1 3.96Å; D513-R595 IonicContact OD2-NH2 2.69Å; D513-R595 PolarHBondContact OD2-NH2 2.79Å
514	K	83.1	Confident	90.1	Very high	119 Å²	119	57.1 Å²	57.1	52%	0.517	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-21.2	-179.1	77.3	-171.5	-171.8	-165.3	0	114.6	Q512 K516	Q512-K514 HydrophobicContact CB-CD 4.33Å; Q512-K514 HydrophobicContact CB-CG 4.18Å; Q512-K514 PolarHBondContact O-N 2.83Å; K514-K516 PolarHBondContact O-N 3.38Å
515	W	81.4	Confident	90.5	Very high	40 Å²	40	49.8 Å²	49.8	15%	0.152	24%	0.244	C	C	.	.			trans	-77.9	110.7	-170.7	-58.9	122.5	0	0	0	111.2	Y442 T459 W510 Q512	Y442-W515 HydrophobicContact CD2-CZ2 4.33Å; T459-W515 HydrophobicContact CG2-CH2 4.36Å; T459-W515 HydrophobicContact CG2-CZ3 3.98Å; W510-W515 HydrophobicContact CG-CB 4.25Å; Q512-W515 VanDerWaalsContact O-CD1 3.22Å; Q512-W515 PolarHBondContact O-N 3.23Å
516	K	87.8	Confident	90.9	Very high	158 Å²	158	48.9 Å²	48.9	69%	0.687	24%	0.237	S	C	*	.			trans	-105.6	136.5	178.9	-68.5	-175.1	179.2	-178.7	0	111.3	C457 N463 K514	C457-K516 PolarHBondContact SG-O 3.49Å; C457-K516 VanDerWaalsContact SG-O 3.34Å; N463-K516 PolarHBondContact ND2-O 2.81Å; K514-K516 PolarHBondContact O-N 3.38Å
517	G	91.9	Very high	91.5	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	22%	0.219	C	C	.	.			trans	106.8	159	-174.1	0	0	0	0	0	112.1	C457 D502 A505	C457-G517 WeakPolarHBondContact CB-O 3.36Å; C457-G517 PolarHBondContact SG-O 2.7Å; D502-G517 CarbonylContact O-C 3.43Å; D502-G517 WeakPolarHBondContact O-CA 3.42Å; A505-G517 CarbonylContact O-C 3.49Å; A505-G517 WeakPolarHBondContact O-CA 3.42Å; A505-G517 PolarHBondContact O-N 3.39Å
518	K	96.1	Very high	92.2	Very high	71 Å²	71	44.1 Å²	44.1	31%	0.309	22%	0.215	S	C	.	.	B	Isolated β-bridge	trans	-153.6	141.8	177.3	-165.1	-173	71.5	169.3	0	110	I455 D502 A505 A507	I455-K518 HydrophobicContact CB-CD 4.44Å; I455-K518 HydrophobicContact CB-CG 4.09Å; I455-K518 HydrophobicContact CD1-CD 3.99Å; I455-K518 HydrophobicContact CD1-CG 4.17Å; I455-K518 HydrophobicContact CG2-CD 4.02Å; I455-K518 HydrophobicContact CG2-CG 4.05Å; D502-K518 PolarHBondContact N-O 3.35Å; D502-K518 PolarHBondContact O-N 3.24Å; A505-K518 HydrophobicContact CB-CB 3.57Å; A507-K518 HydrophobicContact CB-CD 4.33Å
519	F	97.9	Very high	92.8	Very high	1 Å²	1	42.7 Å²	42.7	0%	0.004	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	157	163.5	60.1	-89.9	0	0	0	110.7	I455 W456 L466 L481 M497 S499 V501 V521	I455-F519 CarbonylContact C-O 3.5Å; I455-F519 WeakPolarHBondContact CA-O 3.39Å; I455-F519 WeakPolarHBondContact CB-O 3.3Å; W456-F519 HydrophobicContact CB-CD2 4.42Å; W456-F519 HydrophobicContact CB-CE1 4.22Å; W456-F519 HydrophobicContact CB-CE2 3.85Å; W456-F519 HydrophobicContact CB-CZ 3.77Å; W456-F519 AromaticContact CD1-CE1 3.96Å; W456-F519 AromaticContact CD1-CZ 3.58Å; W456-F519 HydrophobicContact CG-CZ 4.07Å; W456-F519 PolarHBondContact N-O 3.1Å; W456-F519 WeakPolarHBondContact O-CD1 3.26Å; W456-F519 PolarHBondContact O-N 2.89Å; L466-F519 HydrophobicContact CD1-CE1 4.09Å; L466-F519 HydrophobicContact CD1-CZ 3.72Å; L481-F519 HydrophobicContact CD1-CE2 3.73Å; L481-F519 HydrophobicContact CD1-CZ 4.12Å; M497-F519 HydrophobicContact CE-CB 4.21Å; M497-F519 HydrophobicContact CE-CD1 4.47Å; M497-F519 HydrophobicContact CE-CD2 3.92Å; M497-F519 HydrophobicContact CE-CE2 4.3Å; M497-F519 HydrophobicContact CE-CG 3.98Å; M497-F519 HydrophobicContact CG-CD2 3.74Å; M497-F519 HydrophobicContact CG-CE2 3.95Å; M497-F519 HydrophobicContact SD-CD2 4.07Å; M497-F519 HydrophobicContact SD-CE2 3.98Å; S499-F519 WeakPolarHBondContact OG-CA 3.27Å; S499-F519 WeakPolarHBondContact OG-CB 3.4Å; V501-F519 HydrophobicContact CG2-CB 4.13Å; V501-F519 HydrophobicContact CG2-CD1 3.69Å; V501-F519 HydrophobicContact CG2-CE1 4.38Å; V501-F519 HydrophobicContact CG2-CG 4.17Å; F519-V521 HydrophobicContact CD2-CG1 3.72Å; F519-V521 HydrophobicContact CE2-CG1 3.49Å; F519-V521 VanDerWaalsContact CE2-CG1 3.49Å
520	E	98.1	Very high	93.3	Very high	106 Å²	106	43.3 Å²	43.3	50%	0.495	21%	0.205	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	141.6	-179.6	-62.9	179	177.1	0	0	111	S454 I455 R498 S499	S454-E520 CarbonylContact O-C 3.47Å; S454-E520 WeakPolarHBondContact O-CA 2.91Å; I455-E520 HydrophobicContact CG2-CG 4.42Å; R498-E520 HydrophobicContact CB-CB 4.19Å; R498-E520 PolarHBondContact N-O 2.7Å; S499-E520 PolarHBondContact OG-N 3.21Å
521	V	98.4	Very high	93.7	Very high	3 Å²	3	44.7 Å²	44.7	2%	0.018	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.3	137.9	175.9	-60.7	0	0	0	0	110.9	S454 W456 L481 A495 E496 F519	S454-V521 CarbonylContact C-O 3.53Å; S454-V521 WeakPolarHBondContact CA-O 3.28Å; S454-V521 WeakPolarHBondContact CB-O 3.41Å; S454-V521 PolarHBondContact O-N 2.81Å; W456-V521 HydrophobicContact CB-CG1 3.91Å; W456-V521 HydrophobicContact CB-CG2 4.46Å; L481-V521 HydrophobicContact CD1-CG1 3.99Å; A495-V521 HydrophobicContact CB-CB 4.04Å; A495-V521 HydrophobicContact CB-CG2 4.39Å; E496-V521 CarbonylContact O-C 3.59Å; E496-V521 VanDerWaalsContact O-CA 3.23Å; E496-V521 WeakPolarHBondContact O-CA 3.37Å; F519-V521 HydrophobicContact CD2-CG1 3.72Å; F519-V521 HydrophobicContact CE2-CG1 3.49Å; F519-V521 VanDerWaalsContact CE2-CG1 3.49Å
522	K	98.1	Very high	94.3	Very high	94 Å²	94	46.8 Å²	46.8	41%	0.409	22%	0.221	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	109.9	169.7	-177	-179.9	-178.7	-178.9	0	109.2	A495 E496 R498	A495-K522 CarbonylContact C-O 3.23Å; A495-K522 VanDerWaalsContact CA-O 3.25Å; A495-K522 WeakPolarHBondContact CA-O 3.36Å; A495-K522 WeakPolarHBondContact CB-O 3.48Å; E496-K522 PolarHBondContact N-O 3.33Å; E496-K522 PolarHBondContact O-N 2.98Å; R498-K522 HydrophobicContact CG-CB 3.86Å
523	W	98.4	Very high	95	Very high	5 Å²	5	46.4 Å²	46.4	2%	0.019	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67	134	173.5	-74	83.7	0	0	0	111	Y422 I447 S450 I451 F483 A495 I526	Y422-W523 HydrophobicContact CD1-CB 4.41Å; Y422-W523 HydrophobicContact CE1-CB 3.88Å; I447-W523 HydrophobicContact CD1-CH2 4.5Å; I447-W523 HydrophobicContact CG2-CH2 3.84Å; I447-W523 HydrophobicContact CG2-CZ2 4.3Å; S450-W523 PolarHBondContact O-NE1 3.03Å; S450-W523 PolarHBondContact OG-NE1 3.04Å; I451-W523 HydrophobicContact CD1-CD2 4.45Å; I451-W523 HydrophobicContact CD1-CE3 4.43Å; I451-W523 HydrophobicContact CD1-CZ3 4.47Å; I451-W523 HydrophobicContact CG1-CD2 3.58Å; I451-W523 HydrophobicContact CG1-CE3 4.03Å; I451-W523 HydrophobicContact CG1-CG 3.91Å; I451-W523 HydrophobicContact CG1-CH2 4.34Å; I451-W523 HydrophobicContact CG1-CZ2 3.93Å; I451-W523 HydrophobicContact CG1-CZ3 4.38Å; F483-W523 HydrophobicContact CB-CH2 3.79Å; F483-W523 HydrophobicContact CB-CZ3 4.19Å; F483-W523 AromaticContact CD1-CH2 3.69Å; F483-W523 HydrophobicContact CD1-CH2 3.69Å; F483-W523 AromaticContact CD1-CZ2 3.99Å; F483-W523 HydrophobicContact CD1-CZ2 3.99Å; F483-W523 AromaticContact CD2-CH2 3.52Å; F483-W523 HydrophobicContact CD2-CH2 3.52Å; F483-W523 HydrophobicContact CD2-CZ2 4.02Å; F483-W523 AromaticContact CD2-CZ3 3.9Å; F483-W523 HydrophobicContact CD2-CZ3 3.9Å; F483-W523 HydrophobicContact CE1-CH2 4.08Å; F483-W523 AromaticContact CE1-CZ2 3.9Å; F483-W523 HydrophobicContact CE1-CZ2 3.9Å; F483-W523 AromaticContact CE2-CH2 3.95Å; F483-W523 HydrophobicContact CE2-CH2 3.95Å; F483-W523 AromaticContact CE2-CZ2 3.95Å; F483-W523 HydrophobicContact CE2-CZ2 3.95Å; F483-W523 HydrophobicContact CE2-CZ3 4.48Å; F483-W523 AromaticContact CG-CH2 3.38Å; F483-W523 HydrophobicContact CG-CH2 3.38Å; F483-W523 HydrophobicContact CG-CZ2 4.04Å; F483-W523 HydrophobicContact CG-CZ3 4.04Å; F483-W523 HydrophobicContact CZ-CH2 4.21Å; F483-W523 AromaticContact CZ-CZ2 3.89Å; F483-W523 HydrophobicContact CZ-CZ2 3.89Å; A495-W523 HydrophobicContact CB-CB 4.45Å; A495-W523 HydrophobicContact CB-CD2 3.92Å; A495-W523 HydrophobicContact CB-CE3 4.35Å; A495-W523 HydrophobicContact CB-CG 3.97Å; W523-I526 HydrophobicContact CB-CD1 3.95Å; W523-I526 HydrophobicContact CB-CG1 4.19Å; W523-I526 HydrophobicContact CD2-CG1 4.38Å; W523-I526 HydrophobicContact CE3-CD1 4.48Å; W523-I526 HydrophobicContact CE3-CG1 3.79Å; W523-I526 HydrophobicContact CG-CD1 4.42Å
524	I	98.1	Very high	95.9	Very high	16 Å²	16	42.1 Å²	42.1	8%	0.082	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	-52.1	-176.8	-62.5	174	0	0	0	109.7	Y422 N423 P424 F427 Y480 V494 E496	Y422-I524 CarbonylContact C-O 3.47Å; Y422-I524 WeakPolarHBondContact CA-O 3.2Å; N423-I524 PolarHBondContact N-O 3.48Å; P424-I524 WeakPolarHBondContact CD-O 3.33Å; P424-I524 HydrophobicContact CG-CG2 3.89Å; F427-I524 HydrophobicContact CD2-CG2 3.93Å; F427-I524 HydrophobicContact CE2-CD1 4.32Å; F427-I524 HydrophobicContact CE2-CG2 3.92Å; Y480-I524 HydrophobicContact CD1-CD1 4.12Å; Y480-I524 HydrophobicContact CE1-CD1 3.46Å; Y480-I524 VanDerWaalsContact CE1-CD1 3.46Å; V494-I524 PolarHBondContact O-N 3.04Å; E496-I524 HydrophobicContact CB-CD1 4.03Å
525	F	98.4	Very high	96.6	Very high	1 Å²	1	44 Å²	44	0%	0.004	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	132.7	172.5	-69.4	-75.8	0	0	0	109.7	N423 P424 F427 G493 V494 K527 I568 A569	N423-F525 HydrophobicContact CB-CD1 4.31Å; N423-F525 VanDerWaalsContact OD1-CA 3.29Å; N423-F525 WeakPolarHBondContact OD1-CA 3.38Å; N423-F525 WeakPolarHBondContact OD1-CD1 3.23Å; P424-F525 HydrophobicContact CG-CZ 4.45Å; F427-F525 HydrophobicContact CB-CE2 4.15Å; F427-F525 HydrophobicContact CB-CZ 3.69Å; F427-F525 AromaticContact CD1-CE2 3.66Å; F427-F525 HydrophobicContact CD1-CE2 3.66Å; F427-F525 AromaticContact CD1-CZ 3.95Å; F427-F525 HydrophobicContact CD1-CZ 3.95Å; F427-F525 AromaticContact CD2-CE2 3.82Å; F427-F525 HydrophobicContact CD2-CE2 3.82Å; F427-F525 HydrophobicContact CD2-CZ 4.2Å; F427-F525 AromaticContact CE1-CE2 3.96Å; F427-F525 HydrophobicContact CE1-CE2 3.96Å; F427-F525 HydrophobicContact CE2-CE2 4.11Å; F427-F525 AromaticContact CG-CE2 3.59Å; F427-F525 HydrophobicContact CG-CE2 3.59Å; F427-F525 AromaticContact CG-CZ 3.67Å; F427-F525 HydrophobicContact CG-CZ 3.67Å; F427-F525 HydrophobicContact CZ-CE2 4.18Å; G493-F525 CarbonylContact C-O 3.5Å; G493-F525 WeakPolarHBondContact CA-O 3.46Å; V494-F525 HydrophobicContact CB-CB 4.11Å; V494-F525 HydrophobicContact CB-CD2 4.11Å; V494-F525 HydrophobicContact CG2-CB 4.19Å; V494-F525 HydrophobicContact CG2-CD2 4.19Å; V494-F525 PolarHBondContact N-O 2.88Å; V494-F525 PolarHBondContact O-N 2.86Å; F525-K527 HydrophobicContact CD1-CD 4.43Å; F525-I568 HydrophobicContact CB-CG2 4.31Å; F525-I568 HydrophobicContact CD2-CG2 4.32Å; F525-I568 HydrophobicContact CG-CG2 4.2Å; F525-A569 HydrophobicContact CE1-CB 4.34Å; F525-A569 HydrophobicContact CE2-CB 4.28Å; F525-A569 HydrophobicContact CZ-CB 3.72Å
526	I	98.3	Very high	97.4	Very high	0 Å²	0	48 Å²	48	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	94.1	172.7	-63.4	170	0	0	0	104.9	Y422 N423 I451 W523 I577 F578	Y422-I526 HydrophobicContact CD1-CD1 3.63Å; Y422-I526 HydrophobicContact CD1-CG1 4.35Å; Y422-I526 HydrophobicContact CD2-CD1 4.32Å; Y422-I526 HydrophobicContact CE1-CD1 3.52Å; Y422-I526 HydrophobicContact CE2-CD1 4.22Å; Y422-I526 HydrophobicContact CG-CD1 4.03Å; N423-I526 PolarHBondContact ND2-O 3.3Å; N423-I526 PolarHBondContact OD1-N 3.34Å; N423-I526 PolarHBondContact OD1-O 3.18Å; I451-I526 HydrophobicContact CB-CD1 4.48Å; I451-I526 HydrophobicContact CD1-CD1 3.98Å; I451-I526 HydrophobicContact CD1-CG1 4.18Å; I451-I526 HydrophobicContact CD1-CG2 4.07Å; I451-I526 HydrophobicContact CG1-CD1 3.95Å; I451-I526 HydrophobicContact CG1-CG1 4.42Å; I451-I526 HydrophobicContact CG2-CD1 3.67Å; W523-I526 HydrophobicContact CB-CD1 3.95Å; W523-I526 HydrophobicContact CB-CG1 4.19Å; W523-I526 HydrophobicContact CD2-CG1 4.38Å; W523-I526 HydrophobicContact CE3-CD1 4.48Å; W523-I526 HydrophobicContact CE3-CG1 3.79Å; W523-I526 HydrophobicContact CG-CD1 4.42Å; I526-I577 HydrophobicContact CG2-CG2 3.78Å; I526-F578 HydrophobicContact CB-CD2 4.47Å; I526-F578 HydrophobicContact CB-CE2 3.98Å; I526-F578 HydrophobicContact CB-CZ 4.17Å; I526-F578 HydrophobicContact CD1-CE1 3.92Å; I526-F578 HydrophobicContact CD1-CE2 3.98Å; I526-F578 HydrophobicContact CD1-CZ 3.35Å; I526-F578 HydrophobicContact CG1-CZ 4.35Å; I526-F578 HydrophobicContact CG2-CD1 4.18Å; I526-F578 HydrophobicContact CG2-CD2 3.93Å; I526-F578 HydrophobicContact CG2-CE1 4.09Å; I526-F578 HydrophobicContact CG2-CE2 3.82Å; I526-F578 HydrophobicContact CG2-CG 4.13Å; I526-F578 HydrophobicContact CG2-CZ 3.92Å
527	K	97.8	Very high	97.9	Very high	11 Å²	11	40.6 Å²	40.6	5%	0.048	19%	0.188	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.8	147	-174.8	57.5	176.9	-171.8	172.3	0	111.7	C492 F525 I568 A569 Y571 H573	C492-K527 CarbonylContact C-O 3.57Å; C492-K527 VanDerWaalsContact C-O 3.23Å; C492-K527 CarbonylContact O-C 3.6Å; C492-K527 PolarHBondContact O-N 3.19Å; C492-K527 VanDerWaalsContact O-O 3.12Å; F525-K527 HydrophobicContact CD1-CD 4.43Å; K527-I568 WeakPolarHBondContact CE-O 3.15Å; K527-I568 PolarHBondContact NZ-O 2.89Å; K527-A569 PolarHBondContact NZ-O 3.09Å; K527-Y571 PolarHBondContact NZ-O 3.32Å; K527-H573 HydrophobicContact CB-CB 3.72Å; K527-H573 WeakPolarHBondContact CB-CD2 3.34Å; K527-H573 VanDerWaalsContact CB-CG 3.4Å; K527-H573 HydrophobicContact CD-CB 4.16Å; K527-H573 HydrophobicContact CG-CB 4.43Å
528	D	98.5	Very high	98.2	Very high	22 Å²	22	47.1 Å²	47.1	12%	0.118	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	128.7	-176.5	-51.1	-29.1	0	0	0	111.5	H490 F491 Y571 T575 S576	H490-D528 IonicContact CD2-OD1 2.72Å; H490-D528 IonicContact NE2-OD1 3.42Å; F491-D528 CarbonylContact O-C 3.58Å; F491-D528 WeakPolarHBondContact O-CA 3.47Å; D528-Y571 WeakPolarHBondContact O-CD1 3.44Å; D528-Y571 WeakPolarHBondContact O-CE1 3.34Å; D528-T575 PolarHBondContact N-O 3.43Å; D528-T575 VanDerWaalsContact N-O 3.12Å; D528-T575 VanDerWaalsContact OD2-CB 3.23Å; D528-T575 WeakPolarHBondContact OD2-CB 3.49Å; D528-T575 PolarHBondContact OD2-OG1 2.93Å; D528-S576 WeakPolarHBondContact OD2-CA 3.48Å; D528-S576 PolarHBondContact OD2-N 2.78Å
529	V	98.7	Very high	98.3	Very high	1 Å²	1	43.7 Å²	43.7	1%	0.006	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	103.5	178.2	-175.2	0	0	0	0	107.9	H490 F491 Q533 L534 V567 I568 Y571	H490-V529 WeakPolarHBondContact CA-O 3.24Å; H490-V529 WeakPolarHBondContact CB-O 3.49Å; F491-V529 PolarHBondContact N-O 2.87Å; F491-V529 PolarHBondContact O-N 3.24Å; V529-Q533 HydrophobicContact CG1-CB 4.28Å; V529-Q533 HydrophobicContact CG1-CG 4.49Å; V529-L534 HydrophobicContact CG1-CD1 4.09Å; V529-L534 HydrophobicContact CG1-CG 4.42Å; V529-V567 HydrophobicContact CG1-CG1 4.39Å; V529-I568 HydrophobicContact CB-CG1 4.48Å; V529-I568 HydrophobicContact CG1-CG1 4.36Å; V529-I568 HydrophobicContact CG2-CB 4.43Å; V529-I568 HydrophobicContact CG2-CG1 4.19Å; V529-I568 HydrophobicContact CG2-CG2 4.23Å; V529-Y571 HydrophobicContact CB-CD1 4.33Å; V529-Y571 HydrophobicContact CG1-CD1 4.32Å; V529-Y571 HydrophobicContact CG1-CG 4.17Å; V529-Y571 HydrophobicContact CG2-CD1 3.91Å; V529-Y571 HydrophobicContact CG2-CG 4.29Å
530	P	98.6	Very high	98.3	Very high	40 Å²	40	48 Å²	48	26%	0.26	22%	0.218	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.2	143.9	-174.9	-26.1	35.5	0	0	0	113.3	N532 Q533 Y571	P530-N532 PolarHBondContact O-N 3.37Å; P530-Q533 WeakPolarHBondContact O-CB 3.31Å; P530-Q533 PolarHBondContact O-N 2.97Å; P530-Y571 WeakPolarHBondContact CD-OH 3.44Å
531	N	98.6	Very high	98.3	Very high	38 Å²	38	46.5 Å²	46.5	20%	0.203	21%	0.214	C	C	.	.	H	α-helix	trans	-58.3	-22.3	-177.5	-77.6	-6.2	0	0	0	113.5	G489 Q533 L534 R535 T548	G489-N531 VanDerWaalsContact C-CG 3.44Å; G489-N531 WeakPolarHBondContact O-CB 3.37Å; G489-N531 PolarHBondContact O-N 3.47Å; G489-N531 PolarHBondContact O-ND2 3.03Å; N531-Q533 PolarHBondContact O-N 3.18Å; N531-L534 PolarHBondContact O-N 3.3Å; N531-L534 VanDerWaalsContact O-N 3.13Å; N531-R535 WeakPolarHBondContact O-CB 3.42Å; N531-R535 PolarHBondContact O-N 3.26Å; N531-T548 HydrophobicContact CB-CG2 3.62Å
532	N	98.3	Very high	98.3	Very high	82 Å²	82	47.6 Å²	47.6	44%	0.439	22%	0.219	S	C	.	.	H	α-helix	trans	-63.5	-24.3	175.2	69.3	6.4	0	0	0	113.6	P530	P530-N532 PolarHBondContact O-N 3.37Å
533	Q	98.6	Very high	98.3	Very high	77 Å²	77	48.8 Å²	48.8	36%	0.36	23%	0.23	S	C	.	.	H	α-helix	trans	-75.8	-27.8	174.7	-55.5	-55.6	-63.5	0	0	112.5	V529 P530 N531 H536 V567 Y571	V529-Q533 HydrophobicContact CG1-CB 4.28Å; V529-Q533 HydrophobicContact CG1-CG 4.49Å; P530-Q533 WeakPolarHBondContact O-CB 3.31Å; P530-Q533 PolarHBondContact O-N 2.97Å; N531-Q533 PolarHBondContact O-N 3.18Å; Q533-H536 PolarHBondContact O-CE1 3.26Å; Q533-H536 PolarHBondContact O-ND1 3.08Å; Q533-V567 HydrophobicContact CB-CG1 3.89Å; Q533-Y571 HydrophobicContact CG-CD2 4Å; Q533-Y571 HydrophobicContact CG-CE2 3.77Å
534	L	98.5	Very high	98.2	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	25%	0.252	C	S	.	.	H	α-helix	trans	-110.2	-22.4	-169.1	-68.8	169.7	0	0	0	114	F491 V529 N531 H536 I537 V547 T548 V564 V567 I568	F491-L534 HydrophobicContact CB-CD1 4.44Å; F491-L534 HydrophobicContact CD2-CD1 3.48Å; F491-L534 VanDerWaalsContact CD2-CD1 3.48Å; F491-L534 HydrophobicContact CE2-CD1 3.92Å; F491-L534 HydrophobicContact CG-CD1 4.07Å; V529-L534 HydrophobicContact CG1-CD1 4.09Å; V529-L534 HydrophobicContact CG1-CG 4.42Å; N531-L534 PolarHBondContact O-N 3.3Å; N531-L534 VanDerWaalsContact O-N 3.13Å; L534-H536 PolarHBondContact O-N 3.27Å; L534-I537 HydrophobicContact CD2-CD1 4.06Å; L534-I537 WeakPolarHBondContact O-CB 3.35Å; L534-I537 PolarHBondContact O-N 3.02Å; L534-V547 HydrophobicContact CB-CG1 4.09Å; L534-V547 WeakPolarHBondContact O-CG1 3.39Å; L534-T548 HydrophobicContact CB-CG2 3.87Å; L534-V564 HydrophobicContact CD2-CB 4.3Å; L534-V564 HydrophobicContact CD2-CG1 3.93Å; L534-V564 HydrophobicContact CD2-CG2 4.33Å; L534-V567 HydrophobicContact CD2-CB 3.77Å; L534-V567 HydrophobicContact CD2-CG1 3.62Å; L534-V567 HydrophobicContact CD2-CG2 4.39Å; L534-V567 HydrophobicContact CG-CG1 4.17Å; L534-I568 HydrophobicContact CD1-CG1 4.4Å
535	R	97.8	Very high	98.3	Very high	159 Å²	159	56.2 Å²	56.2	60%	0.6	27%	0.266	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57	-15.9	-176.4	65.8	-179.8	176.4	-169.8	2.9	116.1	N531 P546 T548	N531-R535 WeakPolarHBondContact O-CB 3.42Å; N531-R535 PolarHBondContact O-N 3.26Å; R535-P546 WeakPolarHBondContact O-CB 3.23Å; R535-T548 HydrophobicContact CB-CG2 4.26Å
536	H	98.4	Very high	98.3	Very high	124 Å²	124	57.3 Å²	57.3	57%	0.574	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-23.5	176.7	70	-93.1	0	0	0	112.2	Q533 L534 R538	Q533-H536 PolarHBondContact O-CE1 3.26Å; Q533-H536 PolarHBondContact O-ND1 3.08Å; L534-H536 PolarHBondContact O-N 3.27Å; H536-R538 PolarHBondContact O-N 3.03Å
537	I	98.6	Very high	98.3	Very high	2 Å²	2	57.3 Å²	57.3	1%	0.01	27%	0.273	C	S	.	.			trans	-79.8	110.9	177.7	-51.9	173.4	0	0	0	108	L534 P546 V547 K560 Q563 V564	L534-I537 HydrophobicContact CD2-CD1 4.06Å; L534-I537 WeakPolarHBondContact O-CB 3.35Å; L534-I537 PolarHBondContact O-N 3.02Å; I537-P546 WeakPolarHBondContact O-CA 3.34Å; I537-V547 HydrophobicContact CB-CG1 4.06Å; I537-V547 PolarHBondContact O-N 3.19Å; I537-K560 HydrophobicContact CG2-CB 4.03Å; I537-K560 HydrophobicContact CG2-CD 4.08Å; I537-Q563 HydrophobicContact CD1-CB 3.77Å; I537-Q563 HydrophobicContact CG1-CB 4.4Å; I537-V564 HydrophobicContact CB-CG2 4.49Å; I537-V564 HydrophobicContact CD1-CB 4.36Å; I537-V564 HydrophobicContact CD1-CG2 3.61Å; I537-V564 HydrophobicContact CG2-CG2 4.14Å
538	R	98.6	Very high	98.3	Very high	136 Å²	136	57.8 Å²	57.8	51%	0.513	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	145.2	178.8	-70	176.9	175.9	-91.7	5.7	111.6	H536 N544 K545 K560	H536-R538 PolarHBondContact O-N 3.03Å; R538-N544 WeakPolarHBondContact CB-O 3.47Å; R538-N544 VanDerWaalsContact CD-O 3.31Å; R538-N544 WeakPolarHBondContact CD-O 3.31Å; R538-N544 WeakPolarHBondContact CG-O 3.46Å; R538-N544 PolarHBondContact NH1-O 3.26Å; R538-K545 WeakPolarHBondContact CA-O 3.14Å; R538-K560 PolarHBondContact O-NZ 3.45Å
539	L	98.6	Very high	98.3	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	111.2	-178.2	-57.8	-170.6	0	0	0	111.3	N541 N542 N544 K545 V547 S550 Q554 V556 K560	L539-N541 PolarHBondContact O-N 2.89Å; L539-N542 HydrophobicContact CB-CB 4.02Å; L539-N542 CarbonylContact O-C 3.59Å; L539-N542 PolarHBondContact O-N 2.69Å; L539-N542 VanDerWaalsContact O-N 3.09Å; L539-N544 WeakPolarHBondContact O-CA 3.09Å; L539-N544 PolarHBondContact O-N 3.39Å; L539-K545 PolarHBondContact N-O 2.9Å; L539-V547 HydrophobicContact CD1-CB 4.35Å; L539-V547 HydrophobicContact CD1-CG2 4.22Å; L539-V547 HydrophobicContact CD2-CB 4.13Å; L539-V547 HydrophobicContact CD2-CG2 4.26Å; L539-V547 HydrophobicContact CG-CB 4.15Å; L539-V547 HydrophobicContact CG-CG2 4.45Å; L539-S550 WeakPolarHBondContact CD1-OG 3.45Å; L539-Q554 HydrophobicContact CD1-CG 3.87Å; L539-V556 HydrophobicContact CD2-CG1 3.89Å; L539-K560 HydrophobicContact CD2-CB 4.07Å; L539-K560 HydrophobicContact CD2-CG 4.46Å
540	E	97.9	Very high	98.3	Very high	92 Å²	92	62.2 Å²	62.2	43%	0.43	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-31.8	177.6	55.5	-86.9	-151.2	0	0	112.5	N542 P557 K560	E540-N542 VanDerWaalsContact C-N 3.29Å; E540-N542 PolarHBondContact O-N 3.27Å; E540-P557 HydrophobicContact CG-CG 4.16Å; E540-P557 WeakPolarHBondContact OE1-CB 3.49Å; E540-K560 IonicContact OE1-NZ 3.87Å; E540-K560 WeakPolarHBondContact OE2-CG 3.18Å; E540-K560 IonicContact OE2-NZ 2.63Å; E540-K560 PolarHBondContact OE2-NZ 3.27Å
541	N	97.8	Very high	98.3	Very high	74 Å²	74	70.5 Å²	70.5	40%	0.396	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89	18.4	176.6	71.1	-22.4	0	0	0	114.1	L539 Q554 E555 P557	L539-N541 PolarHBondContact O-N 2.89Å; N541-Q554 PolarHBondContact OD1-NE2 2.86Å; N541-E555 PolarHBondContact ND2-O 3.42Å; N541-E555 PolarHBondContact OD1-O 3.37Å; N541-P557 HydrophobicContact CB-CG 4.38Å; N541-P557 WeakPolarHBondContact OD1-CD 3.48Å
542	N	97.8	Very high	98.3	Very high	25 Å²	25	70.5 Å²	70.5	13%	0.134	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-152.7	59.5	177.1	179.8	24.6	0	0	0	109.3	L539 E540 N544 K545	L539-N542 HydrophobicContact CB-CB 4.02Å; L539-N542 CarbonylContact O-C 3.59Å; L539-N542 PolarHBondContact O-N 2.69Å; L539-N542 VanDerWaalsContact O-N 3.09Å; E540-N542 VanDerWaalsContact C-N 3.29Å; E540-N542 PolarHBondContact O-N 3.27Å; N542-N544 PolarHBondContact O-N 3.22Å; N542-K545 VanDerWaalsContact O-CB 3.23Å; N542-K545 WeakPolarHBondContact O-CB 2.88Å; N542-K545 WeakPolarHBondContact O-CG 3.33Å; N542-K545 PolarHBondContact O-N 2.89Å
543	D	97.9	Very high	98.3	Very high	119 Å²	119	66.8 Å²	66.8	64%	0.636	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.2	29.7	175.8	-43.9	-35.9	0	0	0	115.1	K545	D543-K545 HydrophobicContact CB-CD 4.06Å; D543-K545 HydrophobicContact CB-CG 4.24Å; D543-K545 PolarHBondContact O-N 3.46Å; D543-K545 VanDerWaalsContact O-N 3.09Å; D543-K545 WeakPolarHBondContact OD2-CE 3.38Å; D543-K545 IonicContact OD2-NZ 2.61Å; D543-K545 PolarHBondContact OD2-NZ 3.15Å
544	N	97.8	Very high	98.3	Very high	89 Å²	89	64.5 Å²	64.5	48%	0.476	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.5	24.2	-170.9	-70.5	-70.7	0	0	0	114.3	R538 L539 N542	R538-N544 WeakPolarHBondContact CB-O 3.47Å; R538-N544 VanDerWaalsContact CD-O 3.31Å; R538-N544 WeakPolarHBondContact CD-O 3.31Å; R538-N544 WeakPolarHBondContact CG-O 3.46Å; R538-N544 PolarHBondContact NH1-O 3.26Å; L539-N544 WeakPolarHBondContact O-CA 3.09Å; L539-N544 PolarHBondContact O-N 3.39Å; N542-N544 PolarHBondContact O-N 3.22Å
545	K	98.4	Very high	98.3	Very high	88 Å²	88	66.5 Å²	66.5	38%	0.383	31%	0.307	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.1	151.2	174	-68.9	159.8	178.8	160.9	0	110.2	R538 L539 N542 D543	R538-K545 WeakPolarHBondContact CA-O 3.14Å; L539-K545 PolarHBondContact N-O 2.9Å; N542-K545 VanDerWaalsContact O-CB 3.23Å; N542-K545 WeakPolarHBondContact O-CB 2.88Å; N542-K545 WeakPolarHBondContact O-CG 3.33Å; N542-K545 PolarHBondContact O-N 2.89Å; D543-K545 HydrophobicContact CB-CD 4.06Å; D543-K545 HydrophobicContact CB-CG 4.24Å; D543-K545 PolarHBondContact O-N 3.46Å; D543-K545 VanDerWaalsContact O-N 3.09Å; D543-K545 WeakPolarHBondContact OD2-CE 3.38Å; D543-K545 IonicContact OD2-NZ 2.61Å; D543-K545 PolarHBondContact OD2-NZ 3.15Å
546	P	98.6	Very high	98.3	Very high	24 Å²	24	59.1 Å²	59.1	16%	0.156	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.3	144.5	170.3	-26.9	36.6	0	0	0	112.1	R535 I537 T548 N549	R535-P546 WeakPolarHBondContact O-CB 3.23Å; I537-P546 WeakPolarHBondContact O-CA 3.34Å; P546-T548 WeakPolarHBondContact CB-OG1 3.28Å; P546-T548 PolarHBondContact O-N 3.05Å; P546-T548 VanDerWaalsContact O-N 3.1Å; P546-N549 WeakPolarHBondContact O-CB 3.32Å; P546-N549 PolarHBondContact O-N 2.93Å
547	V	98.7	Very high	98.3	Very high	0 Å²	0	54.6 Å²	54.6	0%	0	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-55.6	-29.4	175	64.9	0	0	0	0	112.5	I438 L534 I537 L539 N549 S550 V556 V564	I438-V547 HydrophobicContact CD1-CG2 3.77Å; I438-V547 HydrophobicContact CG1-CG2 4.48Å; L534-V547 HydrophobicContact CB-CG1 4.09Å; L534-V547 WeakPolarHBondContact O-CG1 3.39Å; I537-V547 HydrophobicContact CB-CG1 4.06Å; I537-V547 PolarHBondContact O-N 3.19Å; L539-V547 HydrophobicContact CD1-CB 4.35Å; L539-V547 HydrophobicContact CD1-CG2 4.22Å; L539-V547 HydrophobicContact CD2-CB 4.13Å; L539-V547 HydrophobicContact CD2-CG2 4.26Å; L539-V547 HydrophobicContact CG-CB 4.15Å; L539-V547 HydrophobicContact CG-CG2 4.45Å; V547-N549 PolarHBondContact O-N 3.45Å; V547-S550 VanDerWaalsContact O-CB 3.26Å; V547-S550 WeakPolarHBondContact O-CB 3.34Å; V547-S550 PolarHBondContact O-N 2.99Å; V547-S550 PolarHBondContact O-OG 3.41Å; V547-V556 HydrophobicContact CG2-CG2 4.37Å; V547-V564 HydrophobicContact CG1-CG2 4.14Å; V547-V564 HydrophobicContact CG2-CG2 4.13Å
548	T	98.4	Very high	98.2	Very high	22 Å²	22	56.9 Å²	56.9	14%	0.135	27%	0.273	C	S	.	.	G	3₁₀ helix	trans	-65.8	-15.9	175.4	52.6	0	0	0	0	114.4	F491 N531 L534 R535 P546	F491-T548 HydrophobicContact CE2-CG2 4.31Å; N531-T548 HydrophobicContact CB-CG2 3.62Å; L534-T548 HydrophobicContact CB-CG2 3.87Å; R535-T548 HydrophobicContact CB-CG2 4.26Å; P546-T548 WeakPolarHBondContact CB-OG1 3.28Å; P546-T548 PolarHBondContact O-N 3.05Å; P546-T548 VanDerWaalsContact O-N 3.1Å
549	N	98.3	Very high	98.2	Very high	107 Å²	107	55.3 Å²	55.3	57%	0.572	27%	0.272	S	S	*	.	G	3₁₀ helix	trans	-104.8	14.6	-177.9	-65.2	57.4	0	0	0	111.9	P546 V547	P546-N549 WeakPolarHBondContact O-CB 3.32Å; P546-N549 PolarHBondContact O-N 2.93Å; V547-N549 PolarHBondContact O-N 3.45Å
550	S	98.4	Very high	98.2	Very high	8 Å²	8	57.5 Å²	57.5	6%	0.056	28%	0.281	C	S	.	.	P	Polyproline II helix	trans	-72.6	147	179.3	-60.4	0	0	0	0	113	L539 V547	L539-S550 WeakPolarHBondContact CD1-OG 3.45Å; V547-S550 VanDerWaalsContact O-CB 3.26Å; V547-S550 WeakPolarHBondContact O-CB 3.34Å; V547-S550 PolarHBondContact O-N 2.99Å; V547-S550 PolarHBondContact O-OG 3.41Å
551	R	98.2	Very high	98.2	Very high	214 Å²	214	53.1 Å²	53.1	81%	0.808	26%	0.26	S	S	*	.	P	Polyproline II helix	trans	-84.5	171.4	170.4	-70.8	-177.7	171.4	177.2	-2.9	111.5	T553 Q554	R551-T553 PolarHBondContact O-N 2.83Å; R551-Q554 WeakPolarHBondContact O-CB 3.25Å; R551-Q554 PolarHBondContact O-N 3.01Å; R551-Q554 VanDerWaalsContact O-N 3.14Å
552	D	98.3	Very high	98.2	Very high	38 Å²	38	51 Å²	51	20%	0.203	25%	0.248	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.9	135.9	176	-166.7	41.8	0	0	0	111.6	I439 K440 S458 Q554	I439-D552 WeakPolarHBondContact CA-OD1 3.49Å; K440-D552 HydrophobicContact CB-CB 4.01Å; K440-D552 PolarHBondContact N-OD1 2.77Å; S458-D552 PolarHBondContact OG-OD2 2.85Å; D552-Q554 PolarHBondContact O-N 2.85Å
553	T	98.3	Very high	98.3	Very high	5 Å²	5	53.8 Å²	53.8	3%	0.031	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	57.5	19.9	-173.5	71.9	0	0	0	0	116.1	F437 I438 I439 S458 R465 L466 R551 E555	F437-T553 WeakPolarHBondContact CD1-O 3.37Å; I438-T553 WeakPolarHBondContact O-CA 3.48Å; I438-T553 PolarHBondContact O-N 2.64Å; I439-T553 HydrophobicContact CD1-CG2 4.15Å; S458-T553 WeakPolarHBondContact OG-CG2 3.23Å; R465-T553 VanDerWaalsContact CZ-O 3.25Å; R465-T553 PolarHBondContact NE-O 2.83Å; R465-T553 PolarHBondContact NH2-O 3.14Å; L466-T553 HydrophobicContact CD1-CG2 3.85Å; L466-T553 HydrophobicContact CD2-CG2 4.38Å; L466-T553 HydrophobicContact CG-CG2 3.94Å; R551-T553 PolarHBondContact O-N 2.83Å; T553-E555 PolarHBondContact O-N 3.01Å
554	Q	98.6	Very high	98.3	Very high	29 Å²	29	48.1 Å²	48.1	14%	0.136	23%	0.23	C	C	.	.	P	Polyproline II helix	trans	-55.4	133.4	167.3	176.4	58.8	45.4	0	0	109.9	F437 I438 L539 N541 R551 D552	F437-Q554 CarbonylContact C-O 3.42Å; F437-Q554 VanDerWaalsContact CA-O 3.25Å; F437-Q554 WeakPolarHBondContact CA-O 3.37Å; I438-Q554 HydrophobicContact CB-CB 4.26Å; I438-Q554 HydrophobicContact CG1-CB 4.16Å; I438-Q554 PolarHBondContact N-O 2.68Å; L539-Q554 HydrophobicContact CD1-CG 3.87Å; N541-Q554 PolarHBondContact OD1-NE2 2.86Å; R551-Q554 WeakPolarHBondContact O-CB 3.25Å; R551-Q554 PolarHBondContact O-N 3.01Å; R551-Q554 VanDerWaalsContact O-N 3.14Å; D552-Q554 PolarHBondContact O-N 2.85Å
555	E	98.6	Very high	98.3	Very high	42 Å²	42	43.9 Å²	43.9	20%	0.196	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	136	176.6	-174.7	155.9	-154.3	0	0	110	R435 F437 R465 N541 T553	R435-E555 IonicContact CZ-OE1 3Å; R435-E555 IonicContact CZ-OE2 3.56Å; R435-E555 IonicContact NE-OE1 3.37Å; R435-E555 PolarHBondContact NE-OE1 3.21Å; R435-E555 IonicContact NH2-OE1 2.83Å; R435-E555 PolarHBondContact NH2-OE1 3.46Å; R435-E555 IonicContact NH2-OE2 3.21Å; R435-E555 PolarHBondContact NH2-OE2 2.82Å; F437-E555 HydrophobicContact CD1-CB 3.87Å; F437-E555 HydrophobicContact CD1-CG 4.29Å; F437-E555 HydrophobicContact CE1-CB 3.61Å; F437-E555 HydrophobicContact CE1-CG 3.84Å; F437-E555 HydrophobicContact CZ-CB 4.36Å; F437-E555 HydrophobicContact CZ-CG 4.08Å; F437-E555 WeakPolarHBondContact CZ-OE1 3.45Å; R465-E555 VanDerWaalsContact NH2-N 3.1Å; N541-E555 PolarHBondContact ND2-O 3.42Å; N541-E555 PolarHBondContact OD1-O 3.37Å; T553-E555 PolarHBondContact O-N 3.01Å
556	V	98.7	Very high	98.3	Very high	3 Å²	3	44.2 Å²	44.2	2%	0.018	21%	0.209	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	117.1	178.2	-173.8	0	0	0	0	108.1	V436 I438 L482 L539 V547 K560 A561	V436-V556 HydrophobicContact CB-CB 4.41Å; V436-V556 HydrophobicContact CG1-CB 4.46Å; V436-V556 PolarHBondContact O-N 2.88Å; I438-V556 HydrophobicContact CD1-CG2 3.53Å; I438-V556 HydrophobicContact CG1-CG2 3.85Å; L482-V556 HydrophobicContact CD1-CG2 4.41Å; L539-V556 HydrophobicContact CD2-CG1 3.89Å; V547-V556 HydrophobicContact CG2-CG2 4.37Å; V556-K560 HydrophobicContact CG1-CB 3.97Å; V556-A561 HydrophobicContact CB-CB 4.19Å; V556-A561 HydrophobicContact CG1-CB 3.78Å
557	P	98.1	Very high	98.3	Very high	30 Å²	30	44.5 Å²	44.5	20%	0.195	21%	0.21	C	C	.	.	P	Polyproline II helix	trans	-55.5	142.1	175.8	-27.1	37.4	0	0	0	111.6	E540 N541 E559 K560 A561	E540-P557 HydrophobicContact CG-CG 4.16Å; E540-P557 WeakPolarHBondContact OE1-CB 3.49Å; N541-P557 HydrophobicContact CB-CG 4.38Å; N541-P557 WeakPolarHBondContact OD1-CD 3.48Å; P557-E559 VanDerWaalsContact C-N 3.31Å; P557-E559 PolarHBondContact O-N 3.1Å; P557-E559 VanDerWaalsContact O-N 3.12Å; P557-K560 CarbonylContact O-C 3.56Å; P557-K560 WeakPolarHBondContact O-CA 3.35Å; P557-K560 WeakPolarHBondContact O-CB 3.26Å; P557-K560 PolarHBondContact O-N 3.05Å; P557-A561 PolarHBondContact O-N 3.19Å
558	L	97.1	Very high	98.3	Very high	50 Å²	50	44.6 Å²	44.6	26%	0.262	21%	0.21	S	C	.	.	H	α-helix	trans	-54.5	-41.3	-163.8	-173.1	61.8	0	0	0	113.7	L431 K560 A561 K562	L431-L558 HydrophobicContact CB-CD1 3.86Å; L431-L558 HydrophobicContact CD2-CD1 4.3Å; L558-K560 PolarHBondContact O-N 2.83Å; L558-A561 WeakPolarHBondContact O-CB 3.29Å; L558-A561 PolarHBondContact O-N 3.14Å; L558-K562 WeakPolarHBondContact O-CG 3.23Å; L558-K562 PolarHBondContact O-N 2.87Å
559	E	97.8	Very high	98.2	Very high	103 Å²	103	44.7 Å²	44.7	48%	0.481	21%	0.213	S	C	.	.	H	α-helix	trans	-68.2	-33.3	178.5	-58.5	-45.4	118.3	0	0	113.3	P557 K562 Q563	P557-E559 VanDerWaalsContact C-N 3.31Å; P557-E559 PolarHBondContact O-N 3.1Å; P557-E559 VanDerWaalsContact O-N 3.12Å; E559-K562 IonicContact OE1-NZ 3.01Å; E559-K562 PolarHBondContact OE1-NZ 3.44Å; E559-K562 WeakPolarHBondContact OE2-CD 3.36Å; E559-K562 IonicContact OE2-NZ 2.68Å; E559-K562 PolarHBondContact OE2-NZ 3.34Å; E559-Q563 WeakPolarHBondContact O-CG 3.31Å; E559-Q563 PolarHBondContact O-N 3.37Å; E559-Q563 PolarHBondContact O-NE2 3Å
560	K	98.4	Very high	98.2	Very high	45 Å²	45	44 Å²	44	20%	0.196	21%	0.213	C	C	.	.	H	α-helix	trans	-74.2	-34.2	171.5	-56.1	-58	174.4	61.2	0	111	I537 R538 L539 E540 V556 P557 L558 Q563 V564	I537-K560 HydrophobicContact CG2-CB 4.03Å; I537-K560 HydrophobicContact CG2-CD 4.08Å; R538-K560 PolarHBondContact O-NZ 3.45Å; L539-K560 HydrophobicContact CD2-CB 4.07Å; L539-K560 HydrophobicContact CD2-CG 4.46Å; E540-K560 IonicContact OE1-NZ 3.87Å; E540-K560 WeakPolarHBondContact OE2-CG 3.18Å; E540-K560 IonicContact OE2-NZ 2.63Å; E540-K560 PolarHBondContact OE2-NZ 3.27Å; V556-K560 HydrophobicContact CG1-CB 3.97Å; P557-K560 CarbonylContact O-C 3.56Å; P557-K560 WeakPolarHBondContact O-CA 3.35Å; P557-K560 WeakPolarHBondContact O-CB 3.26Å; P557-K560 PolarHBondContact O-N 3.05Å; L558-K560 PolarHBondContact O-N 2.83Å; K560-Q563 WeakPolarHBondContact O-CB 3.49Å; K560-Q563 PolarHBondContact O-N 3.29Å; K560-V564 WeakPolarHBondContact O-CG2 3.39Å; K560-V564 PolarHBondContact O-N 3Å
561	A	98.3	Very high	98.2	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-64.8	-42.3	176.6	0	0	0	0	0	112.1	V436 V556 P557 L558 Q563 V564 L565	V436-A561 HydrophobicContact CB-CB 3.69Å; V436-A561 HydrophobicContact CG1-CB 4.09Å; V436-A561 HydrophobicContact CG2-CB 3.66Å; V556-A561 HydrophobicContact CB-CB 4.19Å; V556-A561 HydrophobicContact CG1-CB 3.78Å; P557-A561 PolarHBondContact O-N 3.19Å; L558-A561 WeakPolarHBondContact O-CB 3.29Å; L558-A561 PolarHBondContact O-N 3.14Å; A561-Q563 VanDerWaalsContact C-N 3.3Å; A561-Q563 PolarHBondContact O-N 3.13Å; A561-V564 PolarHBondContact O-N 2.83Å; A561-L565 WeakPolarHBondContact O-CB 2.8Å; A561-L565 VanDerWaalsContact O-CG 3.31Å; A561-L565 WeakPolarHBondContact O-CG 3.12Å; A561-L565 PolarHBondContact O-N 3.06Å
562	K	98.2	Very high	98.1	Very high	30 Å²	30	45.3 Å²	45.3	13%	0.13	22%	0.222	C	C	.	.	H	α-helix	trans	-55.3	-43.7	171.4	-69.9	169.8	-178.4	166.6	0	112	N430 L431 L558 E559 K566	N430-K562 WeakPolarHBondContact OD1-CE 3.21Å; L431-K562 WeakPolarHBondContact O-CE 3.34Å; L558-K562 WeakPolarHBondContact O-CG 3.23Å; L558-K562 PolarHBondContact O-N 2.87Å; E559-K562 IonicContact OE1-NZ 3.01Å; E559-K562 PolarHBondContact OE1-NZ 3.44Å; E559-K562 WeakPolarHBondContact OE2-CD 3.36Å; E559-K562 IonicContact OE2-NZ 2.68Å; E559-K562 PolarHBondContact OE2-NZ 3.34Å; K562-K566 VanDerWaalsContact O-CB 3.25Å; K562-K566 WeakPolarHBondContact O-CB 3.44Å; K562-K566 PolarHBondContact O-N 3.06Å
563	Q	98.4	Very high	98.1	Very high	84 Å²	84	47 Å²	47	39%	0.393	23%	0.229	S	C	.	.	H	α-helix	trans	-63.8	-47.1	178	-65	167.2	21.6	0	0	111.5	I537 E559 K560 A561 K566 V567	I537-Q563 HydrophobicContact CD1-CB 3.77Å; I537-Q563 HydrophobicContact CG1-CB 4.4Å; E559-Q563 WeakPolarHBondContact O-CG 3.31Å; E559-Q563 PolarHBondContact O-N 3.37Å; E559-Q563 PolarHBondContact O-NE2 3Å; K560-Q563 WeakPolarHBondContact O-CB 3.49Å; K560-Q563 PolarHBondContact O-N 3.29Å; A561-Q563 VanDerWaalsContact C-N 3.3Å; A561-Q563 PolarHBondContact O-N 3.13Å; Q563-K566 PolarHBondContact O-N 2.84Å; Q563-V567 WeakPolarHBondContact O-CG2 3.34Å; Q563-V567 PolarHBondContact O-N 3.1Å
564	V	98.6	Very high	98	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-61.9	-47.4	177.4	175.6	0	0	0	0	111.4	L482 L534 I537 V547 K560 A561 K566 V567 I568	L482-V564 HydrophobicContact CD1-CB 4.39Å; L482-V564 HydrophobicContact CD1-CG1 3.62Å; L534-V564 HydrophobicContact CD2-CB 4.3Å; L534-V564 HydrophobicContact CD2-CG1 3.93Å; L534-V564 HydrophobicContact CD2-CG2 4.33Å; I537-V564 HydrophobicContact CB-CG2 4.49Å; I537-V564 HydrophobicContact CD1-CB 4.36Å; I537-V564 HydrophobicContact CD1-CG2 3.61Å; I537-V564 HydrophobicContact CG2-CG2 4.14Å; V547-V564 HydrophobicContact CG1-CG2 4.14Å; V547-V564 HydrophobicContact CG2-CG2 4.13Å; K560-V564 WeakPolarHBondContact O-CG2 3.39Å; K560-V564 PolarHBondContact O-N 3Å; A561-V564 PolarHBondContact O-N 2.83Å; V564-K566 VanDerWaalsContact C-N 3.34Å; V564-K566 PolarHBondContact O-N 2.91Å; V564-V567 PolarHBondContact O-N 3.17Å; V564-I568 HydrophobicContact CG1-CD1 3.69Å; V564-I568 HydrophobicContact CG1-CG1 4.38Å; V564-I568 WeakPolarHBondContact O-CG1 3.3Å; V564-I568 PolarHBondContact O-N 3.18Å
565	L	98.5	Very high	97.9	Very high	0 Å²	0	54 Å²	54	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-37.6	178.8	-73	169.5	0	0	0	112.2	F427 W429 L431 V436 Y480 L482 V494 A561 I568 A569	F427-L565 HydrophobicContact CE1-CB 4.37Å; F427-L565 HydrophobicContact CE1-CD2 4.26Å; F427-L565 HydrophobicContact CZ-CD2 4.4Å; W429-L565 HydrophobicContact CB-CB 3.92Å; L431-L565 HydrophobicContact CD1-CD1 3.57Å; L431-L565 HydrophobicContact CD2-CD1 4.34Å; V436-L565 HydrophobicContact CG2-CD1 4.41Å; Y480-L565 HydrophobicContact CD2-CD1 3.99Å; L482-L565 HydrophobicContact CD2-CD2 3.84Å; V494-L565 HydrophobicContact CG1-CD2 4.2Å; V494-L565 HydrophobicContact CG2-CD2 4.43Å; A561-L565 WeakPolarHBondContact O-CB 2.8Å; A561-L565 VanDerWaalsContact O-CG 3.31Å; A561-L565 WeakPolarHBondContact O-CG 3.12Å; A561-L565 PolarHBondContact O-N 3.06Å; L565-I568 PolarHBondContact O-N 2.61Å; L565-A569 WeakPolarHBondContact O-CB 3.46Å; L565-A569 PolarHBondContact O-N 3.28Å
566	K	98.2	Very high	97.9	Very high	95 Å²	95	52.5 Å²	52.5	41%	0.413	27%	0.268	S	S	.	.	H	α-helix	trans	-62.7	-46.5	173.6	-173.7	-179.2	-176.1	178	0	111.8	W429 K562 Q563 V564 T570	W429-K566 HydrophobicContact CB-CB 4.34Å; W429-K566 HydrophobicContact CD2-CB 3.67Å; W429-K566 HydrophobicContact CD2-CD 4.15Å; W429-K566 HydrophobicContact CD2-CG 3.76Å; W429-K566 HydrophobicContact CE3-CB 3.74Å; W429-K566 HydrophobicContact CE3-CD 4Å; W429-K566 HydrophobicContact CE3-CG 4.03Å; W429-K566 HydrophobicContact CG-CB 3.92Å; W429-K566 HydrophobicContact CG-CG 4.24Å; W429-K566 HydrophobicContact CH2-CD 3.78Å; W429-K566 HydrophobicContact CH2-CG 4.43Å; W429-K566 HydrophobicContact CZ2-CD 3.9Å; W429-K566 HydrophobicContact CZ2-CG 4.16Å; W429-K566 HydrophobicContact CZ3-CB 4.41Å; W429-K566 HydrophobicContact CZ3-CD 3.83Å; W429-K566 HydrophobicContact CZ3-CG 4.36Å; K562-K566 VanDerWaalsContact O-CB 3.25Å; K562-K566 WeakPolarHBondContact O-CB 3.44Å; K562-K566 PolarHBondContact O-N 3.06Å; Q563-K566 PolarHBondContact O-N 2.84Å; V564-K566 VanDerWaalsContact C-N 3.34Å; V564-K566 PolarHBondContact O-N 2.91Å; K566-T570 WeakPolarHBondContact O-CB 3.45Å; K566-T570 WeakPolarHBondContact O-CG2 3.48Å; K566-T570 PolarHBondContact O-N 3.04Å; K566-T570 PolarHBondContact O-OG1 2.98Å
567	V	98.3	Very high	97.8	Very high	29 Å²	29	53.2 Å²	53.2	18%	0.176	27%	0.271	C	S	.	.	H	α-helix	trans	-61.7	-49.2	176.4	171.7	0	0	0	0	110.2	V529 Q533 L534 Q563 V564 T570 Y571	V529-V567 HydrophobicContact CG1-CG1 4.39Å; Q533-V567 HydrophobicContact CB-CG1 3.89Å; L534-V567 HydrophobicContact CD2-CB 3.77Å; L534-V567 HydrophobicContact CD2-CG1 3.62Å; L534-V567 HydrophobicContact CD2-CG2 4.39Å; L534-V567 HydrophobicContact CG-CG1 4.17Å; Q563-V567 WeakPolarHBondContact O-CG2 3.34Å; Q563-V567 PolarHBondContact O-N 3.1Å; V564-V567 PolarHBondContact O-N 3.17Å; V567-T570 PolarHBondContact O-N 2.83Å; V567-T570 PolarHBondContact O-OG1 3.17Å; V567-Y571 VanDerWaalsContact O-CB 3.28Å; V567-Y571 WeakPolarHBondContact O-CB 3.23Å; V567-Y571 PolarHBondContact O-N 3.4Å
568	I	98.3	Very high	97.7	Very high	3 Å²	3	52.6 Å²	52.6	2%	0.015	27%	0.265	C	S	.	.	H	α-helix	trans	-60.1	-51	178.3	-67.7	170.1	0	0	0	111	L482 V494 F525 K527 V529 L534 V564 L565 T570 Y571	L482-I568 HydrophobicContact CD2-CD1 4.09Å; V494-I568 HydrophobicContact CG2-CD1 3.98Å; V494-I568 HydrophobicContact CG2-CG2 3.91Å; F525-I568 HydrophobicContact CB-CG2 4.31Å; F525-I568 HydrophobicContact CD2-CG2 4.32Å; F525-I568 HydrophobicContact CG-CG2 4.2Å; K527-I568 WeakPolarHBondContact CE-O 3.15Å; K527-I568 PolarHBondContact NZ-O 2.89Å; V529-I568 HydrophobicContact CB-CG1 4.48Å; V529-I568 HydrophobicContact CG1-CG1 4.36Å; V529-I568 HydrophobicContact CG2-CB 4.43Å; V529-I568 HydrophobicContact CG2-CG1 4.19Å; V529-I568 HydrophobicContact CG2-CG2 4.23Å; L534-I568 HydrophobicContact CD1-CG1 4.4Å; V564-I568 HydrophobicContact CG1-CD1 3.69Å; V564-I568 HydrophobicContact CG1-CG1 4.38Å; V564-I568 WeakPolarHBondContact O-CG1 3.3Å; V564-I568 PolarHBondContact O-N 3.18Å; L565-I568 PolarHBondContact O-N 2.61Å; I568-T570 PolarHBondContact O-N 3.32Å; I568-Y571 PolarHBondContact O-N 3.23Å
569	A	97.6	Very high	97.6	Very high	23 Å²	23	54.9 Å²	54.9	19%	0.19	28%	0.278	C	S	.	.	H	α-helix	trans	-57.8	-49.6	-178.9	0	0	0	0	0	111.6	F427 F525 K527 L565 Y571	F427-A569 HydrophobicContact CD1-CB 4.19Å; F525-A569 HydrophobicContact CE1-CB 4.34Å; F525-A569 HydrophobicContact CE2-CB 4.28Å; F525-A569 HydrophobicContact CZ-CB 3.72Å; K527-A569 PolarHBondContact NZ-O 3.09Å; L565-A569 WeakPolarHBondContact O-CB 3.46Å; L565-A569 PolarHBondContact O-N 3.28Å; A569-Y571 PolarHBondContact O-N 3.25Å
570	T	97.4	Very high	97.5	Very high	93 Å²	93	54.4 Å²	54.4	57%	0.571	28%	0.279	S	S	*	.	H	α-helix	trans	-76.2	-18.1	-177.3	58.1	0	0	0	0	115.2	K566 V567 I568 K572	K566-T570 WeakPolarHBondContact O-CB 3.45Å; K566-T570 WeakPolarHBondContact O-CG2 3.48Å; K566-T570 PolarHBondContact O-N 3.04Å; K566-T570 PolarHBondContact O-OG1 2.98Å; V567-T570 PolarHBondContact O-N 2.83Å; V567-T570 PolarHBondContact O-OG1 3.17Å; I568-T570 PolarHBondContact O-N 3.32Å; T570-K572 PolarHBondContact O-N 2.9Å
571	Y	98	Very high	97.3	Very high	59 Å²	59	52.4 Å²	52.4	23%	0.231	27%	0.27	C	S	.	.			trans	-64.4	125.5	-177.4	-172.5	-104.1	0	0	0	112.7	K527 D528 V529 P530 Q533 V567 I568 A569 H573	K527-Y571 PolarHBondContact NZ-O 3.32Å; D528-Y571 WeakPolarHBondContact O-CD1 3.44Å; D528-Y571 WeakPolarHBondContact O-CE1 3.34Å; V529-Y571 HydrophobicContact CB-CD1 4.33Å; V529-Y571 HydrophobicContact CG1-CD1 4.32Å; V529-Y571 HydrophobicContact CG1-CG 4.17Å; V529-Y571 HydrophobicContact CG2-CD1 3.91Å; V529-Y571 HydrophobicContact CG2-CG 4.29Å; P530-Y571 WeakPolarHBondContact CD-OH 3.44Å; Q533-Y571 HydrophobicContact CG-CD2 4Å; Q533-Y571 HydrophobicContact CG-CE2 3.77Å; V567-Y571 VanDerWaalsContact O-CB 3.28Å; V567-Y571 WeakPolarHBondContact O-CB 3.23Å; V567-Y571 PolarHBondContact O-N 3.4Å; I568-Y571 PolarHBondContact O-N 3.23Å; A569-Y571 PolarHBondContact O-N 3.25Å; Y571-H573 HydrophobicContact CD1-CB 4.17Å; Y571-H573 HydrophobicContact CE1-CB 4.27Å; Y571-H573 PolarHBondContact O-N 3.44Å; Y571-H573 VanDerWaalsContact O-N 3.13Å
572	K	97.3	Very high	97.1	Very high	190 Å²	190	54.9 Å²	54.9	83%	0.826	29%	0.291	S	S	*	.			trans	-82	80.8	174.1	-65.7	-177.9	-179.1	179	0	109.9	T570	T570-K572 PolarHBondContact O-N 2.9Å
573	H	96.7	Very high	96.9	Very high	74 Å²	74	58.1 Å²	58.1	34%	0.343	31%	0.306	S	S	.	.			trans	-57.8	151.5	174.7	70.7	-53.3	0	0	0	113.5	K527 Y571 T575	K527-H573 HydrophobicContact CB-CB 3.72Å; K527-H573 WeakPolarHBondContact CB-CD2 3.34Å; K527-H573 VanDerWaalsContact CB-CG 3.4Å; K527-H573 HydrophobicContact CD-CB 4.16Å; K527-H573 HydrophobicContact CG-CB 4.43Å; Y571-H573 HydrophobicContact CD1-CB 4.17Å; Y571-H573 HydrophobicContact CE1-CB 4.27Å; Y571-H573 PolarHBondContact O-N 3.44Å; Y571-H573 VanDerWaalsContact O-N 3.13Å; H573-T575 PolarHBondContact CD2-O 3.02Å
574	T	96.3	Very high	96.8	Very high	129 Å²	129	54.6 Å²	54.6	79%	0.791	29%	0.289	S	S	*	.	S	Bend	trans	-118.5	-7.3	173.8	53.5	0	0	0	0	112.9
575	T	97.4	Very high	96.6	Very high	53 Å²	53	54.7 Å²	54.7	33%	0.325	29%	0.29	S	S	.	.			trans	-145.3	157.1	179.4	56.3	0	0	0	0	111	D528 H573 D579	D528-T575 PolarHBondContact N-O 3.43Å; D528-T575 VanDerWaalsContact N-O 3.12Å; D528-T575 VanDerWaalsContact OD2-CB 3.23Å; D528-T575 WeakPolarHBondContact OD2-CB 3.49Å; D528-T575 PolarHBondContact OD2-OG1 2.93Å; H573-T575 PolarHBondContact CD2-O 3.02Å; T575-D579 WeakPolarHBondContact CA-OD2 3.42Å
576	S	97.6	Very high	96.4	Very high	10 Å²	10	60.6 Å²	60.6	7%	0.07	32%	0.316	C	S	.	.			trans	-158.8	163.4	168.8	68.4	0	0	0	0	111.1	D528 F578 D579	D528-S576 WeakPolarHBondContact OD2-CA 3.48Å; D528-S576 PolarHBondContact OD2-N 2.78Å; S576-F578 PolarHBondContact O-N 3.41Å; S576-F578 WeakPolarHBondContact OG-CB 3.34Å; S576-F578 PolarHBondContact OG-N 2.8Å; S576-D579 PolarHBondContact N-OD2 2.88Å; S576-D579 WeakPolarHBondContact O-CB 3.47Å; S576-D579 VanDerWaalsContact O-CG 3.24Å; S576-D579 PolarHBondContact O-N 3.29Å
577	I	96.6	Very high	96.2	Very high	17 Å²	17	60.3 Å²	60.3	9%	0.087	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-11.4	170.6	-161.6	170.7	0	0	0	114.3	E444 I447 H448 I451 I526 D579 F581 Y584	E444-I577 HydrophobicContact CB-CD1 4.49Å; I447-I577 HydrophobicContact CB-CD1 3.86Å; I447-I577 HydrophobicContact CG2-CD1 3.74Å; H448-I577 HydrophobicContact CB-CD1 4.04Å; I451-I577 HydrophobicContact CD1-CG2 3.58Å; I526-I577 HydrophobicContact CG2-CG2 3.78Å; I577-D579 VanDerWaalsContact C-N 3.29Å; I577-F581 PolarHBondContact O-N 3Å; I577-Y584 HydrophobicContact CD1-CE2 4.34Å; I577-Y584 HydrophobicContact CG1-CD2 4.18Å; I577-Y584 HydrophobicContact CG1-CE2 3.87Å
578	F	96.5	Very high	95.9	Very high	17 Å²	17	59.2 Å²	59.2	8%	0.075	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	-72.8	-18.9	170.5	-70.1	-30.3	0	0	0	114.1	L413 Y422 I451 I526 S576 D580 F581	L413-F578 HydrophobicContact CD1-CB 4.33Å; L413-F578 HydrophobicContact CD1-CD1 3.26Å; L413-F578 HydrophobicContact CD1-CD2 4.25Å; L413-F578 HydrophobicContact CD1-CE1 3.32Å; L413-F578 HydrophobicContact CD1-CE2 4.31Å; L413-F578 HydrophobicContact CD1-CG 3.74Å; L413-F578 HydrophobicContact CD1-CZ 3.86Å; L413-F578 HydrophobicContact CD2-CB 4.19Å; L413-F578 HydrophobicContact CD2-CD1 4.42Å; L413-F578 HydrophobicContact CD2-CG 4.48Å; L413-F578 HydrophobicContact CG-CD1 4.49Å; Y422-F578 AromaticContact CD2-CE2 3.88Å; Y422-F578 HydrophobicContact CD2-CE2 3.88Å; Y422-F578 AromaticContact CD2-CZ 3.68Å; Y422-F578 HydrophobicContact CD2-CZ 3.68Å; Y422-F578 HydrophobicContact CE2-CE2 4.28Å; Y422-F578 AromaticContact CE2-CZ 3.6Å; Y422-F578 HydrophobicContact CE2-CZ 3.6Å; Y422-F578 HydrophobicContact CG-CE2 4.43Å; Y422-F578 HydrophobicContact CG-CZ 4.37Å; I451-F578 HydrophobicContact CG2-CE1 3.95Å; I451-F578 HydrophobicContact CG2-CZ 4.44Å; I526-F578 HydrophobicContact CB-CD2 4.47Å; I526-F578 HydrophobicContact CB-CE2 3.98Å; I526-F578 HydrophobicContact CB-CZ 4.17Å; I526-F578 HydrophobicContact CD1-CE1 3.92Å; I526-F578 HydrophobicContact CD1-CE2 3.98Å; I526-F578 HydrophobicContact CD1-CZ 3.35Å; I526-F578 HydrophobicContact CG1-CZ 4.35Å; I526-F578 HydrophobicContact CG2-CD1 4.18Å; I526-F578 HydrophobicContact CG2-CD2 3.93Å; I526-F578 HydrophobicContact CG2-CE1 4.09Å; I526-F578 HydrophobicContact CG2-CE2 3.82Å; I526-F578 HydrophobicContact CG2-CG 4.13Å; I526-F578 HydrophobicContact CG2-CZ 3.92Å; S576-F578 PolarHBondContact O-N 3.41Å; S576-F578 WeakPolarHBondContact OG-CB 3.34Å; S576-F578 PolarHBondContact OG-N 2.8Å; F578-D580 VanDerWaalsContact C-N 3.33Å; F578-F581 AromaticContact CD1-CD2 3.93Å; F578-F581 HydrophobicContact CD1-CD2 3.93Å; F578-F581 HydrophobicContact CD1-CE2 4.44Å; F578-F581 HydrophobicContact CE1-CD2 4.38Å; F578-F581 HydrophobicContact CE1-CE2 4.45Å
579	D	95.7	Very high	95.7	Very high	98 Å²	98	65 Å²	65	52%	0.524	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-33.3	179.9	-54.2	-29.3	0	0	0	110.7	T575 S576 I577	T575-D579 WeakPolarHBondContact CA-OD2 3.42Å; S576-D579 PolarHBondContact N-OD2 2.88Å; S576-D579 WeakPolarHBondContact O-CB 3.47Å; S576-D579 VanDerWaalsContact O-CG 3.24Å; S576-D579 PolarHBondContact O-N 3.29Å; I577-D579 VanDerWaalsContact C-N 3.29Å
580	D	94.4	Very high	95.5	Very high	93 Å²	93	68.7 Å²	68.7	50%	0.497	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.6	10.6	178.8	-62.7	-60.8	0	0	0	113.4	F578 A582 H583 Y584	F578-D580 VanDerWaalsContact C-N 3.33Å; D580-A582 PolarHBondContact O-N 3.31Å; D580-H583 WeakPolarHBondContact O-CB 3.21Å; D580-H583 PolarHBondContact O-N 2.99Å; D580-Y584 HydrophobicContact CB-CD2 4.11Å; D580-Y584 HydrophobicContact CB-CE2 3.76Å; D580-Y584 WeakPolarHBondContact O-CD2 3.19Å; D580-Y584 PolarHBondContact O-N 3.5Å
581	F	94.4	Very high	95.1	Very high	3 Å²	3	67.6 Å²	67.6	1%	0.013	33%	0.333	C	S	.	.	H	α-helix	trans	-56.9	-44.2	-168.5	-166.2	-85.1	0	0	0	113.8	H410 V412 L413 L416 H448 I577 F578 H583 Y584 E585	H410-F581 HydrophobicContact CB-CD1 4.09Å; H410-F581 AromaticContact ND1-CE1 3.98Å; V412-F581 HydrophobicContact CB-CE1 4.19Å; V412-F581 HydrophobicContact CG1-CE1 4.24Å; V412-F581 HydrophobicContact CG1-CZ 4.2Å; L413-F581 HydrophobicContact CB-CD1 3.7Å; L413-F581 HydrophobicContact CB-CD2 4.44Å; L413-F581 HydrophobicContact CB-CE1 3.82Å; L413-F581 HydrophobicContact CB-CG 4.03Å; L413-F581 HydrophobicContact CB-CZ 4.25Å; L413-F581 HydrophobicContact CD1-CD2 4.14Å; L413-F581 HydrophobicContact CD1-CE2 4.33Å; L413-F581 HydrophobicContact CD1-CG 4.4Å; L413-F581 HydrophobicContact CD2-CB 3.8Å; L413-F581 HydrophobicContact CD2-CD1 4.35Å; L413-F581 HydrophobicContact CD2-CD2 4.44Å; L413-F581 HydrophobicContact CD2-CG 3.96Å; L413-F581 HydrophobicContact CG-CG 4.37Å; L416-F581 HydrophobicContact CD1-CE2 3.96Å; L416-F581 HydrophobicContact CD1-CZ 3.61Å; H448-F581 AromaticContact CD2-CD2 3.68Å; H448-F581 AromaticContact CD2-CE2 3.47Å; H448-F581 VanDerWaalsContact CD2-CE2 3.47Å; H448-F581 WeakPolarHBondContact CD2-CE2 3.4Å; H448-F581 AromaticContact CD2-CZ 3.91Å; H448-F581 AromaticContact NE2-CD2 3.97Å; H448-F581 AromaticContact NE2-CE1 3.82Å; H448-F581 AromaticContact NE2-CE2 3.55Å; H448-F581 AromaticContact NE2-CZ 3.46Å; H448-F581 WeakPolarHBondContact NE2-CZ 3.4Å; I577-F581 PolarHBondContact O-N 3Å; F578-F581 AromaticContact CD1-CD2 3.93Å; F578-F581 HydrophobicContact CD1-CD2 3.93Å; F578-F581 HydrophobicContact CD1-CE2 4.44Å; F578-F581 HydrophobicContact CE1-CD2 4.38Å; F578-F581 HydrophobicContact CE1-CE2 4.45Å; F581-H583 PolarHBondContact O-N 3.03Å; F581-Y584 PolarHBondContact O-N 3Å; F581-E585 HydrophobicContact CD1-CG 3.56Å; F581-E585 HydrophobicContact CE1-CG 3.36Å; F581-E585 WeakPolarHBondContact CE1-OE2 3.14Å; F581-E585 HydrophobicContact CZ-CG 4.28Å; F581-E585 WeakPolarHBondContact O-CG 3.32Å; F581-E585 PolarHBondContact O-N 3.06Å
582	A	94.4	Very high	94.7	Very high	53 Å²	53	68 Å²	68	44%	0.438	34%	0.337	S	S	.	.	H	α-helix	trans	-63.4	-28	-179.9	0	0	0	0	0	113	H410 D580 K586	H410-A582 HydrophobicContact CB-CB 4.37Å; D580-A582 PolarHBondContact O-N 3.31Å; A582-K586 WeakPolarHBondContact O-CB 3.34Å; A582-K586 PolarHBondContact O-N 3.39Å; A582-K586 VanDerWaalsContact O-N 3.08Å
583	H	94.9	Very high	94.4	Very high	97 Å²	97	61.6 Å²	61.6	45%	0.449	32%	0.32	S	S	.	.	H	α-helix	trans	-74.3	-39.9	175.5	159.3	87	0	0	0	111.6	D580 F581 R587	D580-H583 WeakPolarHBondContact O-CB 3.21Å; D580-H583 PolarHBondContact O-N 2.99Å; F581-H583 PolarHBondContact O-N 3.03Å; H583-R587 PolarHBondContact NE2-NH2 3.5Å; H583-R587 VanDerWaalsContact O-CB 3.31Å; H583-R587 WeakPolarHBondContact O-CB 3.4Å; H583-R587 PolarHBondContact O-N 3.33Å
584	Y	95.5	Very high	94.1	Very high	11 Å²	11	62.3 Å²	62.3	4%	0.043	33%	0.326	C	S	.	.	H	α-helix	trans	-67	-36.5	172.4	-72.5	-72.1	0	0	0	113.2	E444 D445 H448 I577 D580 F581 Q588	E444-Y584 HydrophobicContact CB-CE1 3.92Å; E444-Y584 VanDerWaalsContact CB-OH 3.23Å; E444-Y584 WeakPolarHBondContact CB-OH 3.4Å; E444-Y584 PolarHBondContact OE2-OH 3.13Å; D445-Y584 WeakPolarHBondContact OD1-CD1 3.36Å; H448-Y584 HydrophobicContact CB-CD1 4.25Å; H448-Y584 HydrophobicContact CB-CD2 4.48Å; H448-Y584 HydrophobicContact CB-CG 3.98Å; H448-Y584 VanDerWaalsContact CG-CB 3.43Å; I577-Y584 HydrophobicContact CD1-CE2 4.34Å; I577-Y584 HydrophobicContact CG1-CD2 4.18Å; I577-Y584 HydrophobicContact CG1-CE2 3.87Å; D580-Y584 HydrophobicContact CB-CD2 4.11Å; D580-Y584 HydrophobicContact CB-CE2 3.76Å; D580-Y584 WeakPolarHBondContact O-CD2 3.19Å; D580-Y584 PolarHBondContact O-N 3.5Å; F581-Y584 PolarHBondContact O-N 3Å; Y584-Q588 PolarHBondContact O-N 2.87Å
585	E	95.1	Very high	93.6	Very high	2 Å²	2	60.5 Å²	60.5	1%	0.009	31%	0.305	C	S	.	.	H	α-helix	trans	-62.9	-54.6	174.7	-71.1	-79.2	64.5	0	0	111.4	H410 V412 H448 K452 F581 R587 Q588 E589	H410-E585 IonicContact CE1-OE2 3.13Å; H410-E585 PolarHBondContact CE1-OE2 3.06Å; H410-E585 VanDerWaalsContact CE1-OE2 3.23Å; H410-E585 IonicContact ND1-OE2 2.7Å; H410-E585 PolarHBondContact ND1-OE2 2.99Å; V412-E585 WeakPolarHBondContact CB-OE2 3.37Å; V412-E585 WeakPolarHBondContact CG1-OE2 3.39Å; V412-E585 VanDerWaalsContact CG2-OE2 3.3Å; V412-E585 WeakPolarHBondContact CG2-OE2 3.15Å; H448-E585 IonicContact CE1-OE1 2.7Å; H448-E585 PolarHBondContact CE1-OE1 2.8Å; H448-E585 IonicContact NE2-OE1 3.81Å; H448-E585 PolarHBondContact NE2-OE1 3.48Å; K452-E585 VanDerWaalsContact CD-OE1 3.32Å; K452-E585 WeakPolarHBondContact CD-OE1 3.49Å; K452-E585 WeakPolarHBondContact CE-OE1 3.22Å; K452-E585 IonicContact NZ-OE1 3.55Å; K452-E585 PolarHBondContact NZ-OE1 2.63Å; K452-E585 IonicContact NZ-OE2 3.27Å; F581-E585 HydrophobicContact CD1-CG 3.56Å; F581-E585 HydrophobicContact CE1-CG 3.36Å; F581-E585 WeakPolarHBondContact CE1-OE2 3.14Å; F581-E585 HydrophobicContact CZ-CG 4.28Å; F581-E585 WeakPolarHBondContact O-CG 3.32Å; F581-E585 PolarHBondContact O-N 3.06Å; E585-R587 VanDerWaalsContact C-N 3.3Å; E585-R587 PolarHBondContact O-N 2.84Å; E585-Q588 WeakPolarHBondContact O-CB 3.12Å; E585-Q588 PolarHBondContact O-N 2.95Å; E585-E589 PolarHBondContact O-N 2.94Å
586	K	94.6	Very high	93.1	Very high	124 Å²	124	63.9 Å²	63.9	54%	0.539	32%	0.315	S	S	.	.	H	α-helix	trans	-54.2	-46.6	176.5	175.7	178.6	168.8	179.5	0	111.8	A582 Q588 E589 E590	A582-K586 WeakPolarHBondContact O-CB 3.34Å; A582-K586 PolarHBondContact O-N 3.39Å; A582-K586 VanDerWaalsContact O-N 3.08Å; K586-Q588 VanDerWaalsContact C-N 3.31Å; K586-Q588 PolarHBondContact O-N 2.99Å; K586-E589 PolarHBondContact O-N 2.89Å; K586-E590 WeakPolarHBondContact CE-OE1 3.38Å; K586-E590 IonicContact NZ-OE1 2.75Å; K586-E590 WeakPolarHBondContact O-CG 3.44Å; K586-E590 PolarHBondContact O-N 3.35Å
587	R	93.8	Very high	92.7	Very high	89 Å²	89	68.1 Å²	68.1	34%	0.336	33%	0.334	S	S	.	.	H	α-helix	trans	-61.8	-38	178.7	-174.5	-164.2	-75.7	173.8	-8.3	111.9	D445 H583 E585 E591	D445-R587 VanDerWaalsContact CG-NH1 3.29Å; D445-R587 WeakPolarHBondContact OD1-CD 3.39Å; D445-R587 IonicContact OD1-CZ 2.76Å; D445-R587 IonicContact OD1-NE 3.86Å; D445-R587 IonicContact OD1-NH1 3.15Å; D445-R587 PolarHBondContact OD1-NH1 2.77Å; D445-R587 IonicContact OD2-NH1 2.9Å; D445-R587 PolarHBondContact OD2-NH1 2.88Å; D445-R587 VanDerWaalsContact OD2-NH1 3.13Å; H583-R587 PolarHBondContact NE2-NH2 3.5Å; H583-R587 VanDerWaalsContact O-CB 3.31Å; H583-R587 WeakPolarHBondContact O-CB 3.4Å; H583-R587 PolarHBondContact O-N 3.33Å; E585-R587 VanDerWaalsContact C-N 3.3Å; E585-R587 PolarHBondContact O-N 2.84Å; R587-E591 WeakPolarHBondContact O-CB 3.34Å; R587-E591 PolarHBondContact O-N 2.84Å
588	Q	92.6	Very high	92.2	Very high	5 Å²	5	75.9 Å²	75.9	2%	0.023	36%	0.362	C	S	.	.	H	α-helix	trans	-65.1	-42.6	174.5	-172.2	-170.8	-29.6	0	0	111.2	Y453 Y584 E585 K586 E590 E591 E592	Y453-Q588 PolarHBondContact OH-NE2 3.31Å; Y584-Q588 PolarHBondContact O-N 2.87Å; E585-Q588 WeakPolarHBondContact O-CB 3.12Å; E585-Q588 PolarHBondContact O-N 2.95Å; K586-Q588 VanDerWaalsContact C-N 3.31Å; K586-Q588 PolarHBondContact O-N 2.99Å; Q588-E590 PolarHBondContact O-N 2.94Å; Q588-E591 PolarHBondContact O-N 3.07Å; Q588-E592 HydrophobicContact CG-CG 4.48Å; Q588-E592 PolarHBondContact NE2-OE1 2.84Å; Q588-E592 WeakPolarHBondContact O-CB 3.49Å; Q588-E592 WeakPolarHBondContact O-CG 3.3Å; Q588-E592 PolarHBondContact O-N 3.44Å
589	E	92.9	Very high	91.6	Very high	126 Å²	126	78.3 Å²	78.3	59%	0.589	38%	0.381	S	S	*	.	H	α-helix	trans	-62.7	-41.6	178	-68.3	-177.4	166.8	0	0	112.1	E585 K586 E592 A593	E585-E589 PolarHBondContact O-N 2.94Å; K586-E589 PolarHBondContact O-N 2.89Å; E589-E592 PolarHBondContact O-N 3.29Å; E589-A593 WeakPolarHBondContact O-CB 3.43Å; E589-A593 PolarHBondContact O-N 2.95Å
590	E	93.1	Very high	91.1	Very high	99 Å²	99	82.1 Å²	82.1	46%	0.463	39%	0.388	S	S	.	.	H	α-helix	trans	-63.5	-46.6	174.4	-70.8	173.9	162.2	0	0	112.1	K586 Q588 E592 A593 L594	K586-E590 WeakPolarHBondContact CE-OE1 3.38Å; K586-E590 IonicContact NZ-OE1 2.75Å; K586-E590 WeakPolarHBondContact O-CG 3.44Å; K586-E590 PolarHBondContact O-N 3.35Å; Q588-E590 PolarHBondContact O-N 2.94Å; E590-E592 PolarHBondContact O-N 2.79Å; E590-A593 PolarHBondContact O-N 2.88Å; E590-L594 WeakPolarHBondContact O-CG 3.42Å; E590-L594 PolarHBondContact O-N 3.04Å
591	E	90.1	Very high	90.4	Very high	70 Å²	70	83.1 Å²	83.1	33%	0.327	39%	0.393	S	S	.	.	H	α-helix	trans	-61.7	-43.7	176.1	-171	-169.4	138.7	0	0	111.6	R449 R587 Q588 L594 R595	R449-E591 IonicContact CZ-OE2 3.06Å; R449-E591 IonicContact NH1-OE1 2.79Å; R449-E591 PolarHBondContact NH1-OE1 2.87Å; R449-E591 IonicContact NH1-OE2 2.61Å; R449-E591 PolarHBondContact NH1-OE2 3.47Å; R449-E591 IonicContact NH2-OE2 3.06Å; R449-E591 PolarHBondContact NH2-OE2 2.89Å; R587-E591 WeakPolarHBondContact O-CB 3.34Å; R587-E591 PolarHBondContact O-N 2.84Å; Q588-E591 PolarHBondContact O-N 3.07Å; E591-L594 PolarHBondContact O-N 3.17Å; E591-R595 WeakPolarHBondContact O-CB 3.33Å; E591-R595 PolarHBondContact O-N 2.96Å
592	E	89.4	Confident	89.4	Confident	68 Å²	68	91.8 Å²	91.8	32%	0.318	43%	0.431	S	S	.	.	H	α-helix	trans	-65.8	-38.5	176.6	-84.1	-166.8	-142.2	0	0	112.8	Q588 E589 E590 R595 K596	Q588-E592 HydrophobicContact CG-CG 4.48Å; Q588-E592 PolarHBondContact NE2-OE1 2.84Å; Q588-E592 WeakPolarHBondContact O-CB 3.49Å; Q588-E592 WeakPolarHBondContact O-CG 3.3Å; Q588-E592 PolarHBondContact O-N 3.44Å; E589-E592 PolarHBondContact O-N 3.29Å; E590-E592 PolarHBondContact O-N 2.79Å; E592-R595 PolarHBondContact O-N 2.91Å; E592-K596 WeakPolarHBondContact O-CB 3.2Å; E592-K596 VanDerWaalsContact O-CD 3.24Å; E592-K596 WeakPolarHBondContact O-CD 3.24Å; E592-K596 WeakPolarHBondContact O-CG 3.32Å; E592-K596 PolarHBondContact O-N 2.86Å; E592-K596 WeakPolarHBondContact OE2-CE 3.16Å; E592-K596 IonicContact OE2-NZ 2.86Å; E592-K596 PolarHBondContact OE2-NZ 3.48Å
593	A	91.2	Very high	87.6	Confident	56 Å²	56	100.4 Å²	100.4	46%	0.463	46%	0.462	S	S	.	.	H	α-helix	trans	-62.6	-48.9	175.7	0	0	0	0	0	110.9	E589 E590 R595 K596 E597	E589-A593 WeakPolarHBondContact O-CB 3.43Å; E589-A593 PolarHBondContact O-N 2.95Å; E590-A593 PolarHBondContact O-N 2.88Å; A593-R595 VanDerWaalsContact C-N 3.29Å; A593-R595 PolarHBondContact O-N 3.12Å; A593-K596 PolarHBondContact O-N 3.32Å; A593-E597 PolarHBondContact O-N 3.5Å
594	L	89.6	Confident	87.2	Confident	89 Å²	89	100.6 Å²	100.6	47%	0.466	46%	0.463	S	S	.	.	H	α-helix	trans	-60.8	-36.9	174.7	-69.6	168.4	0	0	0	112.1	E590 E591 R598	E590-L594 WeakPolarHBondContact O-CG 3.42Å; E590-L594 PolarHBondContact O-N 3.04Å; E591-L594 PolarHBondContact O-N 3.17Å; L594-R598 VanDerWaalsContact O-CB 3.32Å; L594-R598 WeakPolarHBondContact O-CB 3.48Å; L594-R598 WeakPolarHBondContact O-CG 3.48Å; L594-R598 PolarHBondContact O-N 3.02Å
595	R	85.8	Confident	86.7	Confident	91 Å²	91	105.3 Å²	105.3	34%	0.343	49%	0.485	S	S	.	.	H	α-helix	trans	-65.2	-44	174.5	-167.9	174.8	-172	143.6	12.9	111.5	G508 D513 E591 E592 A593 R598 S599	G508-R595 PolarHBondContact O-NH1 3.35Å; D513-R595 IonicContact OD1-CZ 3.19Å; D513-R595 VanDerWaalsContact OD1-CZ 3.27Å; D513-R595 IonicContact OD1-NH1 3.79Å; D513-R595 PolarHBondContact OD1-NH1 2.9Å; D513-R595 IonicContact OD1-NH2 3.44Å; D513-R595 PolarHBondContact OD1-NH2 2.7Å; D513-R595 IonicContact OD2-CZ 3.45Å; D513-R595 IonicContact OD2-NH1 3.96Å; D513-R595 IonicContact OD2-NH2 2.69Å; D513-R595 PolarHBondContact OD2-NH2 2.79Å; E591-R595 WeakPolarHBondContact O-CB 3.33Å; E591-R595 PolarHBondContact O-N 2.96Å; E592-R595 PolarHBondContact O-N 2.91Å; A593-R595 VanDerWaalsContact C-N 3.29Å; A593-R595 PolarHBondContact O-N 3.12Å; R595-R598 PolarHBondContact O-N 3.41Å; R595-S599 PolarHBondContact O-N 3.05Å; R595-S599 PolarHBondContact O-OG 3.38Å; R595-S599 VanDerWaalsContact O-OG 3.12Å
596	K	87.6	Confident	86.3	Confident	124 Å²	124	111.1 Å²	111.1	54%	0.539	51%	0.511	S	S	.	.	H	α-helix	trans	-65.4	-40.1	177.7	-69.8	156.9	-165.2	165.9	0	111.6	E592 A593 S599 R600	E592-K596 WeakPolarHBondContact O-CB 3.2Å; E592-K596 VanDerWaalsContact O-CD 3.24Å; E592-K596 WeakPolarHBondContact O-CD 3.24Å; E592-K596 WeakPolarHBondContact O-CG 3.32Å; E592-K596 PolarHBondContact O-N 2.86Å; E592-K596 WeakPolarHBondContact OE2-CE 3.16Å; E592-K596 IonicContact OE2-NZ 2.86Å; E592-K596 PolarHBondContact OE2-NZ 3.48Å; A593-K596 PolarHBondContact O-N 3.32Å; K596-S599 PolarHBondContact O-N 3.05Å; K596-R600 PolarHBondContact O-N 2.85Å
597	E	89.4	Confident	85.8	Confident	99 Å²	99	110.3 Å²	110.3	46%	0.463	51%	0.51	S	S	.	.	H	α-helix	trans	-65.3	-49.7	174.3	-176.2	179.7	-157.6	0	0	112.2	A593 S599 R600 N601	A593-E597 PolarHBondContact O-N 3.5Å; E597-S599 PolarHBondContact O-N 3.02Å; E597-S599 VanDerWaalsContact O-N 3.16Å; E597-R600 WeakPolarHBondContact O-CB 3.48Å; E597-R600 PolarHBondContact O-N 3.16Å; E597-N601 PolarHBondContact O-N 2.92Å
598	R	85.9	Confident	85.3	Confident	179 Å²	179	111.6 Å²	111.6	68%	0.675	52%	0.52	S	S	*	.	H	α-helix	trans	-61	-22.8	175.7	-73.2	172.7	-179.9	-166.5	1.7	113.8	L594 R595 K602	L594-R598 VanDerWaalsContact O-CB 3.32Å; L594-R598 WeakPolarHBondContact O-CB 3.48Å; L594-R598 WeakPolarHBondContact O-CG 3.48Å; L594-R598 PolarHBondContact O-N 3.02Å; R595-R598 PolarHBondContact O-N 3.41Å; R598-K602 WeakPolarHBondContact O-CD 3.46Å; R598-K602 WeakPolarHBondContact O-CG 3.36Å
599	S	84.1	Confident	84.8	Confident	68 Å²	68	118.7 Å²	118.7	48%	0.476	55%	0.554	S	S	.	*	H	α-helix	trans	-80.6	-39.6	171.2	-68.6	0	0	0	0	112.4	R595 K596 E597 K602	R595-S599 PolarHBondContact O-N 3.05Å; R595-S599 PolarHBondContact O-OG 3.38Å; R595-S599 VanDerWaalsContact O-OG 3.12Å; K596-S599 PolarHBondContact O-N 3.05Å; E597-S599 PolarHBondContact O-N 3.02Å; E597-S599 VanDerWaalsContact O-N 3.16Å; S599-K602 PolarHBondContact O-N 2.97Å
600	R	85.1	Confident	84.2	Confident	179 Å²	179	118.2 Å²	118.2	68%	0.675	55%	0.551	S	S	*	*	H	α-helix	trans	-63.5	-43.8	175.5	-172.5	-174.9	-61.7	166.5	2.4	111.6	K596 E597 K602 Q603	K596-R600 PolarHBondContact O-N 2.85Å; E597-R600 WeakPolarHBondContact O-CB 3.48Å; E597-R600 PolarHBondContact O-N 3.16Å; R600-K602 PolarHBondContact O-N 3.37Å; R600-Q603 PolarHBondContact O-N 3.15Å; R600-Q603 VanDerWaalsContact O-N 3.15Å
601	N	78.9	Confident	83.6	Confident	114 Å²	114	119.7 Å²	119.7	61%	0.61	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.4	18.3	-179.2	-58.2	-1.6	0	0	0	113.2	E597	E597-N601 PolarHBondContact O-N 2.92Å
602	K	73.9	Confident	83	Confident	184 Å²	184	123.8 Å²	123.8	80%	0.8	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-126.4	6.1	173.6	-73.1	-177.4	178.1	-173.1	0	112.7	R598 S599 R600	R598-K602 WeakPolarHBondContact O-CD 3.46Å; R598-K602 WeakPolarHBondContact O-CG 3.36Å; S599-K602 PolarHBondContact O-N 2.97Å; R600-K602 PolarHBondContact O-N 3.37Å
603	Q	55.1	Low	82.4	Confident	235 Å²	235	128.9 Å²	128.9	100%	1.098	60%	0.601	S	S	*	*			trans	-109.2	0	170.8	-61.6	-168.6	-85.7	0	0	109.7	R600	R600-Q603 PolarHBondContact O-N 3.15Å; R600-Q603 VanDerWaalsContact O-N 3.15Å

Retrieved 603 of 603 residues in 657.3 ms (Link to these results)

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