A0A087XQ52_POEFO Loading...

E3 ubiquitin-protein ligase ZFP91

Atypical E3 ubiquitin-protein ligase that mediates 'Lys-63'-linked ubiquitination of MAP3K14/NIK, leading to stabilize and activate MAP3K14/NIK. It thereby acts as an activator of the non-canonical NF-kappa-B2/NFKB2 pathway. May also play an important role in cell proliferation and/or anti-apoptosis.

AlphaFold DB , UniProt , Accession A0A087XQ52, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 765 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	30.1	Very low	38.9	Very low	246 Å²	246	147.8 Å²	147.8	100%	1.212	81%	0.807	S	S	*	*				0	135	0	-78.3	162.8	156.8	0	0	107.4
2	E	42.3	Very low	38.4	Very low	184 Å²	184	146.4 Å²	146.4	86%	0.86	80%	0.798	S	S	*	*			trans	-75.4	176.7	156.1	-74	-156.5	128.4	0	0	108.9
3	P	60.6	Low	37.9	Very low	104 Å²	104	146.6 Å²	146.6	68%	0.675	79%	0.786	S	S	*	*			cis	-152.2	179.6	23.2	44.3	-22.9	0	0	0	120.1
4	V	40.8	Very low	37.4	Very low	124 Å²	124	143.7 Å²	143.7	75%	0.752	77%	0.771	S	S	*	*			trans	72.8	138.4	137.3	147.1	0	0	0	0	118.9
5	D	38.6	Very low	37	Very low	124 Å²	124	146.3 Å²	146.3	66%	0.663	78%	0.776	S	S	*	*			cis	-155.2	161.8	0.5	-133.7	-17.7	0	0	0	117.7
6	N	40.1	Very low	36.6	Very low	132 Å²	132	149.3 Å²	149.3	71%	0.706	78%	0.78	S	S	*	*			trans	-14.4	153.1	158.1	-79.2	-74.8	0	0	0	120.9
7	R	37.4	Very low	38	Very low	224 Å²	224	146.5 Å²	146.5	85%	0.845	77%	0.774	S	S	*	*				-174.2	141.6	75.1	-90.9	-168.4	173	163.5	2.2	117.3
8	V	36.3	Very low	37.5	Very low	137 Å²	137	147.2 Å²	147.2	83%	0.83	77%	0.769	S	S	*	*				53.5	137	127	-175.3	0	0	0	0	120
9	G	30.7	Very low	37.2	Very low	73 Å²	73	147.2 Å²	147.2	75%	0.753	76%	0.764	S	S	*	*			cis	178.6	-158.8	4.8	0	0	0	0	0	115.4
10	D	34.4	Very low	36.9	Very low	150 Å²	150	145.9 Å²	145.9	80%	0.802	76%	0.759	S	S	*	*			trans	-126.1	139.8	-157.4	-171.5	-36.3	0	0	0	112.8
11	V	37	Very low	36.8	Very low	128 Å²	128	147.7 Å²	147.7	78%	0.776	76%	0.761	S	S	*	*			trans	-147.9	105.9	169.4	-176.5	0	0	0	0	112
12	N	32.1	Very low	36.8	Very low	131 Å²	131	140.4 Å²	140.4	70%	0.701	74%	0.739	S	S	*	*			trans	34.2	157.6	130.4	-67.2	-72	0	0	0	122.4
13	K	32.3	Very low	36.4	Very low	149 Å²	149	136 Å²	136	65%	0.648	74%	0.735	S	S	*	*			cis	173.7	174.3	-17.5	-170.8	174.6	152.2	-73	0	106.8
14	D	30.8	Very low	35	Very low	106 Å²	106	138.6 Å²	138.6	57%	0.567	74%	0.738	S	S	*	*			trans	77.5	142.3	159.4	-63.1	-46.9	0	0	0	118.6
15	E	31.4	Very low	34.6	Very low	183 Å²	183	140.5 Å²	140.5	86%	0.855	74%	0.738	S	S	*	*			cis	-149.2	-163.6	-16.4	-136.2	-178.4	164.3	0	0	111.9
16	K	31.6	Very low	34.2	Very low	194 Å²	194	140.9 Å²	140.9	84%	0.843	75%	0.745	S	S	*	*			trans	-108.9	-152.8	-162.2	-151.7	-162.3	170.6	-175.2	0	114.6
17	P	59.7	Low	34.6	Very low	102 Å²	102	140 Å²	140	66%	0.662	75%	0.747	S	S	*	*				-111.6	-168.3	-129.6	44.2	-27.9	0	0	0	114.4
18	K	29.1	Very low	34.3	Very low	158 Å²	158	133.8 Å²	133.8	69%	0.687	74%	0.744	S	S	*	*			trans	-171.9	130.5	147.5	-102.3	170.1	170.2	-72	0	111.2
19	E	31	Very low	34	Very low	147 Å²	147	133.1 Å²	133.1	69%	0.687	74%	0.74	S	S	*	*				77.3	139.4	107.3	-74.5	167.1	-173.3	0	0	116
20	D	31.6	Very low	34.1	Very low	122 Å²	122	134.5 Å²	134.5	65%	0.652	74%	0.738	S	S	*	*			cis	-161.2	-168.7	-19	-147.7	-44.1	0	0	0	110.6
21	K	34.3	Very low	34	Very low	184 Å²	184	133.4 Å²	133.4	80%	0.8	74%	0.737	S	S	*	*			trans	-75.9	157.1	-166.9	-47.4	127.3	-172.6	139.6	0	118.5
22	A	31.5	Very low	33.7	Very low	92 Å²	92	134.8 Å²	134.8	76%	0.76	74%	0.738	S	S	*	*			trans	-168.9	130.3	131.7	0	0	0	0	0	108.8
23	A	33.5	Very low	33.6	Very low	92 Å²	92	131.5 Å²	131.5	76%	0.76	74%	0.735	S	S	*	*				63.4	135.2	79.8	0	0	0	0	0	114
24	E	30.2	Very low	33.4	Very low	159 Å²	159	130.5 Å²	130.5	74%	0.743	74%	0.742	S	S	*	*			cis	-162.9	174.3	2.2	-137.9	-173	109.5	0	0	112.7
25	Q	33.5	Very low	33.6	Very low	164 Å²	164	132.7 Å²	132.7	77%	0.766	75%	0.749	S	S	*	*			trans	72.5	129.6	155	-68.1	169.4	31.3	0	0	123.7
26	T	29.2	Very low	33.6	Very low	131 Å²	131	134.2 Å²	134.2	80%	0.804	75%	0.747	S	S	*	*			trans	-87.2	176.9	165.1	46.5	0	0	0	0	111.4
27	P	49.6	Very low	33.6	Very low	114 Å²	114	136 Å²	136	74%	0.74	75%	0.748	S	S	*	*			cis	-137.9	160.7	24.1	42.9	-22.4	0	0	0	117.2
28	A	30.3	Very low	32.2	Very low	94 Å²	94	135.3 Å²	135.3	78%	0.777	75%	0.751	S	S	*	*				55	145.7	102.8	0	0	0	0	0	116.7
29	T	30.7	Very low	32.4	Very low	122 Å²	122	134.7 Å²	134.7	75%	0.748	75%	0.754	S	S	*	*			cis	-140.4	135.9	21.3	44.8	0	0	0	0	111.6
30	S	31.8	Very low	32.6	Very low	103 Å²	103	136.8 Å²	136.8	72%	0.72	76%	0.756	S	S	*	*				67.5	136.5	86.9	106.1	0	0	0	0	115.4
31	T	33.1	Very low	32.7	Very low	126 Å²	126	136.5 Å²	136.5	77%	0.773	75%	0.751	S	S	*	*			cis	-122.3	-145.1	1.9	32.4	0	0	0	0	109.8
32	I	31.1	Very low	32.6	Very low	157 Å²	157	138.3 Å²	138.3	81%	0.805	75%	0.753	S	S	*	*			cis	-152.4	153.4	9.5	-56.8	167.3	0	0	0	105.9
33	G	30.5	Very low	32.5	Very low	62 Å²	62	137.3 Å²	137.3	64%	0.639	75%	0.751	S	S	*	*			cis	131.1	93.4	-2.2	0	0	0	0	0	113
34	T	27.9	Very low	32.6	Very low	129 Å²	129	138.4 Å²	138.4	79%	0.791	76%	0.76	S	S	*	*			trans	-146.8	139.8	-176.1	-18.5	0	0	0	0	115.6
35	Q	33.5	Very low	32.4	Very low	151 Å²	151	134.7 Å²	134.7	71%	0.706	76%	0.764	S	S	*	*			trans	68.6	159	172	-45.4	-166.7	6.6	0	0	115
36	R	31.4	Very low	32.4	Very low	216 Å²	216	138.4 Å²	138.4	82%	0.815	77%	0.771	S	S	*	*			cis	-165.4	168.3	21.8	-154.1	170.2	-130.6	-133.6	0.5	112.5
37	R	31.7	Very low	33.4	Very low	231 Å²	231	136.4 Å²	136.4	87%	0.872	76%	0.761	S	S	*	*			trans	115.9	116.9	135.8	-161.8	170	-168.2	168.6	2.3	119.1
38	A	31.3	Very low	32.4	Very low	87 Å²	87	141.8 Å²	141.8	72%	0.719	77%	0.766	S	S	*	*			trans	24.7	157.5	130.8	0	0	0	0	0	122.4
39	L	33.5	Very low	32.3	Very low	146 Å²	146	142.3 Å²	142.3	76%	0.764	76%	0.764	S	S	*	*			cis	174.9	165.9	-8	179.1	81.7	0	0	0	108.2
40	R	34.5	Very low	32.1	Very low	190 Å²	190	140.3 Å²	140.3	72%	0.717	77%	0.768	S	S	*	*			trans	76.4	159.9	154.2	-99.2	-175.4	-174.6	-145.2	14	117.5
41	E	33	Very low	32.3	Very low	116 Å²	116	141.9 Å²	141.9	54%	0.542	77%	0.773	S	S	.	*			cis	-106.6	-129.7	-8.7	-67.3	-158.6	140.7	0	0	110.9
42	R	34	Very low	32.6	Very low	223 Å²	223	141.7 Å²	141.7	84%	0.842	77%	0.774	S	S	*	*			cis	-159.6	164.3	-12.1	-153.6	158.6	-94.2	-178.3	-7	106.2
43	G	28.5	Very low	32.6	Very low	71 Å²	71	139.6 Å²	139.6	73%	0.732	77%	0.773	S	S	*	*			cis	-150.4	-123.5	3.5	0	0	0	0	0	111.5
44	A	34.8	Very low	32.7	Very low	115 Å²	115	141.9 Å²	141.9	95%	0.95	78%	0.779	S	S	*	*			trans	-151.2	159.9	-174.6	0	0	0	0	0	116.2
45	G	26.7	Very low	32.7	Very low	80 Å²	80	140.2 Å²	140.2	83%	0.825	78%	0.779	S	S	*	*			trans	-177.4	136.6	171.5	0	0	0	0	0	115.2
46	R	32.9	Very low	32.6	Very low	242 Å²	242	139.1 Å²	139.1	91%	0.913	78%	0.782	S	S	*	*			trans	-152.2	172.6	176.2	-125.1	-168.2	177.7	-127.9	0.6	106.8
47	P	50.2	Low	32.7	Very low	90 Å²	90	137.2 Å²	137.2	58%	0.584	78%	0.783	S	S	*	*			cis	-138.7	-153.2	0.8	37	-13	0	0	0	113.7
48	R	29.8	Very low	33	Very low	227 Å²	227	131.6 Å²	131.6	86%	0.857	77%	0.774	S	S	*	*			trans	72.6	163.8	164.4	-71.9	170.7	-177.7	-92.3	3.9	117
49	S	28.3	Very low	33.3	Very low	104 Å²	104	134.9 Å²	134.9	73%	0.727	78%	0.78	S	S	*	*			cis	-176.5	138.4	-42	54.9	0	0	0	0	108.9
50	G	26.7	Very low	33.2	Very low	81 Å²	81	130.7 Å²	130.7	84%	0.835	77%	0.771	S	S	*	*			trans	-178.8	131.8	171.9	0	0	0	0	0	115.8
51	V	34.2	Very low	33	Very low	135 Å²	135	127 Å²	127	82%	0.818	78%	0.781	S	S	*	*			trans	-119.4	160.9	164	-159.5	0	0	0	0	106.5
52	P	40.7	Very low	32.8	Very low	122 Å²	122	126 Å²	126	79%	0.792	79%	0.793	S	S	*	*			trans	-133.1	146.1	131.3	36.8	-28.6	0	0	0	114.2
53	S	31	Very low	33.6	Very low	113 Å²	113	121.8 Å²	121.8	79%	0.79	80%	0.795	S	S	*	*			trans	-72.9	175.7	158.8	-49.1	0	0	0	0	109.4
54	S	31.3	Very low	33.6	Very low	110 Å²	110	121.8 Å²	121.8	77%	0.769	79%	0.794	S	S	*	*			cis	-164	148.1	32.6	38.1	0	0	0	0	107.7
55	A	29.3	Very low	33.4	Very low	95 Å²	95	121 Å²	121	79%	0.785	79%	0.788	S	S	*	*			cis	89.5	99.7	48.4	0	0	0	0	0	115.2
56	T	31.6	Very low	33.7	Very low	127 Å²	127	125.8 Å²	125.8	78%	0.779	79%	0.789	S	S	*	*			trans	-153.9	115.5	150	44.5	0	0	0	0	105.6
57	E	33.6	Very low	33.6	Very low	176 Å²	176	121.2 Å²	121.2	82%	0.822	79%	0.788	S	S	*	*				69.5	136.1	70.6	-69.5	-153.4	129.9	0	0	113.7
58	V	38.2	Very low	32.7	Very low	114 Å²	114	122.6 Å²	122.6	69%	0.691	80%	0.8	S	S	*	*			cis	-159.5	171.7	-14.3	-90.9	0	0	0	0	106.5
59	N	37.2	Very low	32.9	Very low	156 Å²	156	115.5 Å²	115.5	83%	0.834	80%	0.797	S	S	*	*			cis	-154.7	-171.2	2.4	-129.4	-36.2	0	0	0	107.3
60	G	31.4	Very low	32.9	Very low	57 Å²	57	122.1 Å²	122.1	59%	0.588	81%	0.806	S	S	*	*			cis	169.1	176.8	-2.2	0	0	0	0	0	112.8
61	A	28.7	Very low	33.2	Very low	113 Å²	113	124 Å²	124	93%	0.934	80%	0.801	S	S	*	*			trans	81.9	141.6	173.3	0	0	0	0	0	120.3
62	A	29	Very low	33	Very low	95 Å²	95	125.2 Å²	125.2	79%	0.785	80%	0.802	S	S	*	*			trans	-140.3	-173.7	177.8	0	0	0	0	0	107.6
63	P	50.7	Low	32.6	Very low	135 Å²	135	130.1 Å²	130.1	88%	0.877	81%	0.805	S	S	*	*			cis	-118.6	-164.2	1.3	45.1	-30.3	0	0	0	111.9
64	G	29.4	Very low	32.5	Very low	70 Å²	70	132.6 Å²	132.6	72%	0.722	81%	0.809	S	S	*	*			cis	150.8	-154.6	-8.8	0	0	0	0	0	113
65	A	30.8	Very low	32.5	Very low	98 Å²	98	137.1 Å²	137.1	81%	0.81	81%	0.809	S	S	*	*			trans	55.3	101.1	169.2	0	0	0	0	0	121.2
66	Q	33	Very low	33	Very low	182 Å²	182	138.1 Å²	138.1	85%	0.85	81%	0.81	S	S	*	*			trans	50.8	123.5	139.9	-57.2	-177.4	-0.2	0	0	121.7
67	T	30.4	Very low	33.2	Very low	146 Å²	146	137.7 Å²	137.7	90%	0.896	81%	0.808	S	S	*	*				-174.7	173.4	108.1	25.2	0	0	0	0	112.4
68	S	32.5	Very low	33.5	Very low	119 Å²	119	140.1 Å²	140.1	83%	0.832	81%	0.81	S	S	*	*			trans	-82.2	157.3	-167.8	55.6	0	0	0	0	116.6
69	G	32.5	Very low	33.1	Very low	77 Å²	77	139 Å²	139	79%	0.794	81%	0.812	S	S	*	*			trans	104.5	93.1	142.3	0	0	0	0	0	116.6
70	R	29.8	Very low	32.9	Very low	243 Å²	243	137.3 Å²	137.3	92%	0.917	81%	0.807	S	S	*	*			trans	-107.4	97	167.5	-126.1	-177.6	-168	-151.5	2.6	111.4	L72	R70-L72 PolarHBondContact O-N 2.76Å
71	V	31.5	Very low	34.1	Very low	120 Å²	120	140.5 Å²	140.5	73%	0.727	82%	0.818	S	S	*	*			trans	-70.2	121.2	166.7	174.6	0	0	0	0	108.6	R73	V71-R73 HydrophobicContact CG1-CB 4.37Å; V71-R73 PolarHBondContact O-N 3.04Å
72	L	30.3	Very low	34.1	Very low	162 Å²	162	139.7 Å²	139.7	85%	0.848	81%	0.811	S	S	*	*			trans	-75.8	116.6	158.8	-102.6	77.1	0	0	0	108.2	R70	R70-L72 PolarHBondContact O-N 2.76Å
73	R	31.8	Very low	34.4	Very low	224 Å²	224	145.9 Å²	145.9	85%	0.845	81%	0.814	S	S	*	*			trans	-122.5	109.3	167.3	-136.7	179.4	-173	138.4	1.1	106.3	V71 R75	V71-R73 HydrophobicContact CG1-CB 4.37Å; V71-R73 PolarHBondContact O-N 3.04Å; R73-R75 PolarHBondContact O-N 3.06Å
74	D	30.7	Very low	33.5	Very low	166 Å²	166	145.4 Å²	145.4	89%	0.888	80%	0.804	S	S	*	*			trans	-60	135.2	176	-103.6	-61.1	0	0	0	110.5
75	R	30.3	Very low	33.6	Very low	204 Å²	204	151.1 Å²	151.1	77%	0.77	81%	0.809	S	S	*	*			trans	-135.3	111.4	-179.3	-179.5	173.8	177.1	170.9	0.6	110.6	R73	R73-R75 PolarHBondContact O-N 3.06Å
76	S	39	Very low	34	Very low	116 Å²	116	153.3 Å²	153.3	81%	0.811	81%	0.807	S	S	*	*			trans	-70.4	145.8	163.7	52.3	0	0	0	0	111.2
77	T	36.9	Very low	34.1	Very low	119 Å²	119	152.1 Å²	152.1	73%	0.73	81%	0.806	S	S	*	*			trans	-153.3	151.5	165.8	2.3	0	0	0	0	111.7
78	R	39.8	Very low	34	Very low	227 Å²	227	153.6 Å²	153.6	86%	0.857	80%	0.8	S	S	*	*			trans	-100.1	163.1	-175.8	-79.2	176.5	162.4	-175.5	-6	113.5
79	A	29.7	Very low	33.8	Very low	90 Å²	90	152.1 Å²	152.1	74%	0.744	79%	0.789	S	S	*	*			trans	-105.3	144.7	137.4	0	0	0	0	0	107.8
80	V	32.6	Very low	33.6	Very low	120 Å²	120	155.3 Å²	155.3	73%	0.727	79%	0.788	S	S	*	*			cis	73.7	141.6	5.2	-76.8	0	0	0	0	117.7
81	P	56.6	Low	33.9	Very low	124 Å²	124	152 Å²	152	81%	0.805	78%	0.783	S	S	*	*				-135.9	-174.7	-120.1	44.5	-28.8	0	0	0	116.6
82	A	29.9	Very low	33.9	Very low	97 Å²	97	154.8 Å²	154.8	80%	0.802	79%	0.788	S	S	*	*			trans	-146.3	158.3	167.5	0	0	0	0	0	114.1
83	W	35.3	Very low	33.9	Very low	225 Å²	225	154.8 Å²	154.8	85%	0.852	78%	0.783	S	S	*	*			trans	-99.6	160.2	-147.8	44.4	-70.5	0	0	0	116.7
84	L	30.8	Very low	33.8	Very low	124 Å²	124	151.5 Å²	151.5	65%	0.649	78%	0.783	S	S	*	*			trans	94.5	109.2	139.5	-157	81.2	0	0	0	122.3
85	K	31.2	Very low	34	Very low	190 Å²	190	150.9 Å²	150.9	83%	0.826	78%	0.775	S	S	*	*				179.1	136.4	108.4	-97.3	-178.1	-178	178.8	0	112.7
86	D	39.3	Very low	34.7	Very low	144 Å²	144	146.8 Å²	146.8	77%	0.77	78%	0.775	S	S	*	*			trans	-94.5	146.8	168.1	-61.1	-87.8	0	0	0	111.7
87	L	34.9	Very low	34.2	Very low	158 Å²	158	145.8 Å²	145.8	83%	0.827	77%	0.767	S	S	*	*				159.6	120.7	123.4	-87.6	161.3	0	0	0	114.7
88	K	28.6	Very low	34.7	Very low	177 Å²	177	144.9 Å²	144.9	77%	0.77	76%	0.764	S	S	*	*				79.8	127.4	129.5	-160.1	124.9	-179.2	172.2	0	121.8
89	S	28.5	Very low	34.1	Very low	87 Å²	87	141.4 Å²	141.4	61%	0.608	76%	0.762	S	S	*	*			trans	62.1	148.6	146.5	53.4	0	0	0	0	120.6
90	D	29	Very low	34.2	Very low	144 Å²	144	141.7 Å²	141.7	77%	0.77	76%	0.759	S	S	*	*			cis	-166.5	156.5	-16.4	-97.2	-34.3	0	0	0	109
91	E	34.3	Very low	34	Very low	175 Å²	175	141.2 Å²	141.2	82%	0.818	76%	0.76	S	S	*	*			trans	51.9	151.7	153.8	-55.5	-75	66.9	0	0	124.7
92	E	32.4	Very low	32.8	Very low	177 Å²	177	139 Å²	139	83%	0.827	75%	0.753	S	S	*	*			trans	100.1	152.8	155.2	-54.3	-154.8	126.4	0	0	122.6
93	E	31.2	Very low	33	Very low	162 Å²	162	139.8 Å²	139.8	76%	0.757	75%	0.748	S	S	*	*			trans	74.9	73.7	174.6	-52.3	-54.9	81.9	0	0	121.9
94	D	29.4	Very low	32.8	Very low	156 Å²	156	137.5 Å²	137.5	83%	0.834	74%	0.744	S	S	*	*				45.3	165.6	118.2	-121.4	-71.4	0	0	0	125.7
95	E	33.5	Very low	32.8	Very low	153 Å²	153	141 Å²	141	72%	0.715	75%	0.748	S	S	*	*			trans	-95.9	-169.4	-173.4	-88.6	-88.8	152.5	0	0	111.2
96	P	44.8	Very low	32.8	Very low	118 Å²	118	141.6 Å²	141.6	77%	0.766	75%	0.745	S	S	*	*			cis	-138.9	173.4	10	42.7	-23	0	0	0	120.1
97	S	28.9	Very low	32.5	Very low	94 Å²	94	144.4 Å²	144.4	66%	0.657	75%	0.751	S	S	*	*			trans	-61.8	-169.8	159.2	-138.3	0	0	0	0	113.4
98	P	48.7	Very low	32.1	Very low	101 Å²	101	143.9 Å²	143.9	66%	0.656	75%	0.754	S	S	*	*			cis	-147.1	177.2	7.3	45.4	-25.4	0	0	0	119.9
99	D	27.1	Very low	32.1	Very low	154 Å²	154	140.2 Å²	140.2	82%	0.824	75%	0.75	S	S	*	*			trans	61.7	150.9	139.8	-94.7	-45.6	0	0	0	123
100	S	30.7	Very low	32	Very low	96 Å²	96	142.1 Å²	142.1	67%	0.671	76%	0.764	S	S	*	*			cis	-160.8	-159.1	6	63.2	0	0	0	0	110
101	S	28.7	Very low	32.1	Very low	109 Å²	109	140.8 Å²	140.8	76%	0.762	77%	0.766	S	S	*	*			cis	-158	-89.7	-0.8	40	0	0	0	0	114
102	A	32.7	Very low	31.9	Very low	78 Å²	78	142.4 Å²	142.4	65%	0.645	77%	0.77	S	S	*	*			trans	-169.8	165.2	-148.1	0	0	0	0	0	112.6
103	T	32.5	Very low	31.7	Very low	113 Å²	113	145.2 Å²	145.2	69%	0.693	77%	0.773	S	S	*	*			cis	-166.1	166	-11.7	28.7	0	0	0	0	112.9
104	K	32.7	Very low	31.7	Very low	178 Å²	178	149.5 Å²	149.5	77%	0.774	78%	0.782	S	S	*	*			trans	68.2	118.5	142.4	-75	159.8	-174.4	165.5	0	123.7
105	R	30.1	Very low	31.9	Very low	197 Å²	197	152.1 Å²	152.1	74%	0.743	79%	0.786	S	S	*	*				84.6	122.1	123	-78.7	-177	156	-161.9	-0.8	124.6
106	R	30.8	Very low	31.7	Very low	203 Å²	203	147.5 Å²	147.5	77%	0.766	78%	0.78	S	S	*	*				76.7	109.2	128.9	-75.4	-173.6	169.4	-172.8	-4	123.1
107	K	33.1	Very low	31	Very low	202 Å²	202	150 Å²	150	88%	0.878	79%	0.785	S	S	*	*				28.1	125.8	126.9	-78.9	-172.2	171.6	-175.4	0	120.6
108	V	27.4	Very low	30.9	Very low	147 Å²	147	152 Å²	152	89%	0.891	79%	0.789	S	S	*	*			trans	-133.5	157.8	140.9	-179.4	0	0	0	0	109.2
109	S	27.1	Very low	30	Very low	100 Å²	100	152.2 Å²	152.2	70%	0.699	79%	0.793	S	S	*	*			trans	-93.3	148.8	-174.3	50.9	0	0	0	0	114.9
110	S	26.3	Very low	30.1	Very low	127 Å²	127	149.7 Å²	149.7	89%	0.888	79%	0.794	S	S	*	*			trans	-94.6	112	170.3	40.7	0	0	0	0	112.4
111	S	31.1	Very low	30	Very low	116 Å²	116	148.4 Å²	148.4	81%	0.811	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-93.1	143.9	179.5	-69	0	0	0	0	113
112	K	31.6	Very low	30	Very low	210 Å²	210	152.3 Å²	152.3	91%	0.913	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-86.5	128.4	-174.9	-165.4	166.6	-176.3	171.3	0	112.1
113	R	28.2	Very low	29.7	Very low	235 Å²	235	157.1 Å²	157.1	89%	0.887	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-66.4	134.9	-176.5	-164.4	-180	-170.8	-175.4	4.9	112.5
114	R	30.8	Very low	29.6	Very low	252 Å²	252	159.7 Å²	159.7	95%	0.951	82%	0.815	S	S	*	*			trans	-133.2	157	161.3	-86	-169	168	-162.6	-3.7	110.1
115	K	33.7	Very low	29.4	Very low	211 Å²	211	155.5 Å²	155.5	92%	0.917	81%	0.813	S	S	*	*			trans	-155.5	142.5	-176	-178.6	-174.4	-177.4	-172.4	0	105.5
116	G	28.4	Very low	29.4	Very low	56 Å²	56	149.3 Å²	149.3	58%	0.577	81%	0.81	S	S	*	*			cis	-163.7	-148.5	-5.7	0	0	0	0	0	107.6
117	L	30.9	Very low	29.4	Very low	170 Å²	170	149.6 Å²	149.6	89%	0.89	82%	0.821	S	S	*	*			trans	72.7	144.2	-179.8	-51.8	164.9	0	0	0	113.7
118	D	25.8	Very low	29.1	Very low	138 Å²	138	143 Å²	143	74%	0.738	81%	0.81	S	S	*	*			cis	-171.6	174.5	-26.6	-129.8	-104.3	0	0	0	107.3
119	S	29.4	Very low	29.5	Very low	104 Å²	104	144.5 Å²	144.5	73%	0.727	81%	0.812	S	S	*	*			cis	-146.5	-166.9	6.2	-66.3	0	0	0	0	110.6
120	A	29.5	Very low	29.6	Very low	102 Å²	102	146.4 Å²	146.4	84%	0.843	82%	0.82	S	S	*	*			trans	-77.5	171.3	166.2	0	0	0	0	0	113.1
121	G	28.3	Very low	29.9	Very low	68 Å²	68	143.6 Å²	143.6	70%	0.701	81%	0.811	S	S	*	*			cis	159.9	-175.4	-7.6	0	0	0	0	0	113.7
122	Q	29	Very low	29.8	Very low	192 Å²	192	146.1 Å²	146.1	90%	0.897	82%	0.815	S	S	*	*			trans	74.9	166.9	164.1	-68.6	-175.2	-103.8	0	0	121.8
123	E	26.3	Very low	30	Very low	179 Å²	179	140 Å²	140	84%	0.836	80%	0.798	S	S	*	*			trans	75.6	134.3	175.7	-57.2	-174.2	-176.1	0	0	117.9
124	E	30.8	Very low	30.2	Very low	166 Å²	166	135.8 Å²	135.8	78%	0.776	79%	0.793	S	S	*	*			cis	-161.1	-170.4	-20.3	-120.4	-48	122.2	0	0	109.6
125	A	29.3	Very low	30.4	Very low	91 Å²	91	133 Å²	133	75%	0.752	79%	0.791	S	S	*	*			trans	-54.8	168.8	177.4	0	0	0	0	0	116.1
126	G	29.2	Very low	30.4	Very low	66 Å²	66	126 Å²	126	68%	0.68	78%	0.779	S	S	*	*			cis	157.1	170.2	-1.6	0	0	0	0	0	112.2
127	E	31.4	Very low	30.7	Very low	209 Å²	209	129.5 Å²	129.5	98%	0.977	79%	0.789	S	S	*	*			trans	65.1	144.6	175.1	-50.2	-164.7	123.4	0	0	118.1
128	G	27.2	Very low	30.6	Very low	64 Å²	64	128.6 Å²	128.6	66%	0.66	79%	0.785	S	S	*	*			cis	173	168.9	-9.5	0	0	0	0	0	114.1
129	L	34.9	Very low	31.3	Very low	178 Å²	178	126.5 Å²	126.5	93%	0.932	78%	0.781	S	S	*	*			trans	66.8	143.4	163.9	-46.6	179.9	0	0	0	117
130	T	29.3	Very low	31.5	Very low	141 Å²	141	130 Å²	130	87%	0.865	79%	0.786	S	S	*	*			cis	-135.4	178.1	-5.5	54.6	0	0	0	0	108.2
131	G	33.5	Very low	32	Very low	67 Å²	67	132.3 Å²	132.3	69%	0.691	78%	0.784	S	S	*	*			cis	163.9	163.4	-5.5	0	0	0	0	0	111
132	D	28.1	Very low	33.3	Very low	169 Å²	169	133.7 Å²	133.7	90%	0.904	78%	0.781	S	S	*	*			trans	69.8	153.3	171.3	-139.6	-98.2	0	0	0	118.5
133	S	35.8	Very low	33.4	Very low	81 Å²	81	134.2 Å²	134.2	57%	0.566	78%	0.78	S	S	*	*			cis	-163.2	172.2	-49.1	-166.2	0	0	0	0	110.7
134	L	33.4	Very low	33.6	Very low	148 Å²	148	135.1 Å²	135.1	78%	0.775	78%	0.781	S	S	*	*			trans	65.2	128.5	172.1	-47.7	178.1	0	0	0	116.7
135	Q	34.6	Very low	34.1	Very low	192 Å²	192	132.8 Å²	132.8	90%	0.897	78%	0.78	S	S	*	*			cis	99.8	142.3	22.1	-65.7	-169.3	-5	0	0	116.6
136	G	32.9	Very low	34	Very low	65 Å²	65	133 Å²	133	67%	0.67	78%	0.782	S	S	*	*			trans	101.1	106.2	-176	0	0	0	0	0	113.4
137	T	36	Very low	34	Very low	130 Å²	130	134.9 Å²	134.9	80%	0.798	79%	0.785	S	S	*	*			cis	81.2	116.9	15.7	77.4	0	0	0	0	118.6
138	D	26.8	Very low	33.9	Very low	151 Å²	151	132 Å²	132	81%	0.807	78%	0.777	S	S	*	*			trans	-164.5	141	134.1	-114.8	-149.7	0	0	0	108.6
139	S	40.8	Very low	34.2	Very low	93 Å²	93	134 Å²	134	65%	0.65	78%	0.776	S	S	*	*			cis	94.9	139.3	27	-56.3	0	0	0	0	112.3
140	E	35.3	Very low	34.1	Very low	179 Å²	179	132.9 Å²	132.9	84%	0.836	77%	0.766	S	S	*	*			cis	-136.2	155.4	1	-65.8	-164.8	128	0	0	109.6
141	D	38.9	Very low	34	Very low	149 Å²	149	130.1 Å²	130.1	80%	0.797	76%	0.757	S	S	*	*				62.8	158.1	72.3	-120.6	-20.7	0	0	0	114.5
142	P	54.8	Low	33.8	Very low	97 Å²	97	134.7 Å²	134.7	63%	0.63	76%	0.764	S	S	*	*			cis	-144.4	175	-4.7	44.3	-25.2	0	0	0	120.4
143	K	31.9	Very low	34.1	Very low	203 Å²	203	134.3 Å²	134.3	88%	0.883	76%	0.762	S	S	*	*			trans	85.1	135.1	146.8	-85.2	166.5	-177.5	166.7	0	125
144	K	29.8	Very low	34.4	Very low	199 Å²	199	135.4 Å²	135.4	87%	0.865	77%	0.767	S	S	*	*			trans	-40	167.3	159.6	-82.1	-179.2	178.2	180	0	116.9
145	P	41.6	Very low	34.1	Very low	116 Å²	116	138.1 Å²	138.1	75%	0.753	77%	0.772	S	S	*	*			cis	-149.1	-170.5	36.1	44.9	-24.8	0	0	0	119
146	A	28.2	Very low	33.9	Very low	95 Å²	95	140.4 Å²	140.4	79%	0.785	77%	0.773	S	S	*	*			trans	67.2	166.7	162	0	0	0	0	0	116.2
147	S	29.6	Very low	34.9	Very low	106 Å²	106	142.5 Å²	142.5	74%	0.741	78%	0.775	S	S	*	*			cis	-169.1	132.4	-25.2	46.5	0	0	0	0	105.5
148	D	29.3	Very low	35	Very low	150 Å²	150	141.9 Å²	141.9	80%	0.802	77%	0.773	S	S	*	*				66.4	161.9	94	-153.2	-0.1	0	0	0	115.5
149	V	33.2	Very low	35	Very low	106 Å²	106	138.6 Å²	138.6	64%	0.642	77%	0.767	S	S	*	*			trans	73.3	134.1	165.1	173.9	0	0	0	0	117.4
150	Q	32.3	Very low	34.5	Very low	154 Å²	154	142 Å²	142	72%	0.72	77%	0.772	S	S	*	*			cis	-155.2	143.3	-17.3	-109	165.7	38.5	0	0	107.1
151	A	27.8	Very low	34.1	Very low	82 Å²	82	139.5 Å²	139.5	68%	0.678	77%	0.765	S	S	*	*				62.5	146.6	89	0	0	0	0	0	114.6
152	L	29.5	Very low	33.4	Very low	163 Å²	163	139 Å²	139	85%	0.853	76%	0.762	S	S	*	*			cis	-150.8	156.3	39.1	-77.4	161.9	0	0	0	114.6
153	L	32.8	Very low	32	Very low	162 Å²	162	138.2 Å²	138.2	85%	0.848	76%	0.763	S	S	*	*			trans	-87.6	-174.1	155.5	-75.1	161.9	0	0	0	109.5
154	P	42.4	Very low	31.8	Very low	104 Å²	104	135.1 Å²	135.1	68%	0.675	76%	0.762	S	S	*	*			cis	-130.8	-173.7	-14.6	30.6	-9.3	0	0	0	113
155	K	28.4	Very low	32	Very low	204 Å²	204	130.9 Å²	130.9	89%	0.887	76%	0.757	S	S	*	*				176.9	171.9	116.7	-95.2	168.7	-177.2	177.3	0	114.2
156	R	28.8	Very low	31.9	Very low	240 Å²	240	131.5 Å²	131.5	91%	0.906	76%	0.761	S	S	*	*			trans	-107.9	170	-171.4	-111	-170.3	171.6	176.3	-2.7	112.3
157	P	53.8	Low	31.9	Very low	109 Å²	109	131.8 Å²	131.8	71%	0.708	76%	0.763	S	S	*	*			trans	-92.5	176	-169.2	40	-39.3	0	0	0	114.6
158	P	38.8	Very low	31.8	Very low	117 Å²	117	130.1 Å²	130.1	76%	0.76	76%	0.763	S	S	*	*				-111.6	158.4	123.5	-2.9	24.1	0	0	0	110.7
159	A	27.3	Very low	31.9	Very low	82 Å²	82	135.2 Å²	135.2	68%	0.678	77%	0.771	S	S	*	*				63.3	142.1	57.4	0	0	0	0	0	112.3
160	Q	29.4	Very low	31.5	Very low	164 Å²	164	134.7 Å²	134.7	77%	0.766	78%	0.778	S	S	*	*			cis	-164.4	144.8	15.5	-137.1	162.2	-5.2	0	0	110.7
161	N	26.8	Very low	31.4	Very low	128 Å²	128	132.2 Å²	132.2	68%	0.684	78%	0.783	S	S	*	*			trans	47.4	-171.7	156.7	-40.8	-15.1	0	0	0	119.8
162	D	25.5	Very low	31.5	Very low	139 Å²	139	136.3 Å²	136.3	74%	0.743	78%	0.782	S	S	*	*			cis	-144.1	127.7	-5.5	-106.9	-51.3	0	0	0	106.3
163	A	25.4	Very low	31.6	Very low	79 Å²	79	132.9 Å²	132.9	65%	0.653	77%	0.771	S	S	*	*				97.8	165	84.2	0	0	0	0	0	115.8
164	T	27.9	Very low	31.6	Very low	138 Å²	138	129.2 Å²	129.2	85%	0.847	76%	0.755	S	S	*	*			trans	71	119.1	165.7	12.1	0	0	0	0	121.4
165	S	33.3	Very low	30.8	Very low	111 Å²	111	128.3 Å²	128.3	78%	0.776	76%	0.756	S	S	*	*			trans	-95.1	163.6	146.7	-47.8	0	0	0	0	109.8
166	P	39.6	Very low	31.2	Very low	129 Å²	129	127.8 Å²	127.8	84%	0.838	75%	0.754	S	S	*	*				-146.6	-173.9	120.6	37.2	-20.9	0	0	0	115.9
167	A	27.2	Very low	32.1	Very low	100 Å²	100	122.1 Å²	122.1	83%	0.826	75%	0.748	S	S	*	*			trans	-71.7	-175.9	179.4	0	0	0	0	0	113.9
168	G	28.2	Very low	30.9	Very low	71 Å²	71	122.6 Å²	122.6	73%	0.732	75%	0.749	S	S	*	*			cis	-169.6	165.5	12.6	0	0	0	0	0	111.9
169	R	30.5	Very low	30.2	Very low	258 Å²	258	122.3 Å²	122.3	97%	0.974	75%	0.749	S	S	*	*				82.2	104.6	66.1	-118.5	-166	-173.1	-157.7	3.2	116.5
170	A	26.1	Very low	30.2	Very low	95 Å²	95	127.9 Å²	127.9	79%	0.785	76%	0.758	S	S	*	*			trans	-164.2	142.8	149.2	0	0	0	0	0	107.9
171	A	29.3	Very low	30.1	Very low	101 Å²	101	126.4 Å²	126.4	84%	0.835	76%	0.76	S	S	*	*			cis	79.3	146.4	34.4	0	0	0	0	0	113.6
172	R	30.5	Very low	30.2	Very low	169 Å²	169	128.8 Å²	128.8	64%	0.638	77%	0.767	S	S	*	*			cis	-109.2	-141.2	12.2	-156.8	-158.5	-167.6	-108.5	7.7	113.7	A598 D599	R172-A598 PolarHBondContact NH1-O 3Å; R172-A598 PolarHBondContact NH2-O 2.87Å; R172-D599 PolarHBondContact NH1-O 3.22Å
173	S	31.8	Very low	31.1	Very low	90 Å²	90	128 Å²	128	63%	0.629	77%	0.77	S	S	*	*			trans	-176.1	175.3	-168.9	54.6	0	0	0	0	112.8
174	V	32.4	Very low	31.2	Very low	85 Å²	85	132.8 Å²	132.8	52%	0.515	78%	0.778	S	S	.	*			trans	118.2	133.7	155.7	171.5	0	0	0	0	119.3
175	A	26.7	Very low	31.3	Very low	85 Å²	85	135.2 Å²	135.2	70%	0.702	78%	0.782	S	S	*	*			trans	-159.2	147.6	139.5	0	0	0	0	0	112.1
176	K	37	Very low	31	Very low	193 Å²	193	139 Å²	139	84%	0.839	79%	0.788	S	S	*	*			trans	-157.6	147.3	175.3	-87.4	-170.5	177.1	-178.3	0	109.7
177	P	46.8	Very low	30.4	Very low	121 Å²	121	138.7 Å²	138.7	79%	0.786	78%	0.783	S	S	*	*				-147.8	-179.7	90.2	41.5	-23.3	0	0	0	113.5
178	V	28	Very low	31	Very low	119 Å²	119	139.7 Å²	139.7	72%	0.721	78%	0.782	S	S	*	*			cis	91.1	130.5	8.6	179.7	0	0	0	0	115.8
179	C	25	Very low	31	Very low	112 Å²	112	140.4 Å²	140.4	76%	0.757	78%	0.781	S	S	*	*			cis	-169.6	-173.5	-17.8	-98.5	0	0	0	0	109.7
180	K	26.5	Very low	31	Very low	199 Å²	199	132.2 Å²	132.2	87%	0.865	77%	0.768	S	S	*	*			trans	100.9	152.1	169.6	-60.9	-179.6	179	-177.9	0	116.6
181	T	27.6	Very low	31.1	Very low	133 Å²	133	133.9 Å²	133.9	82%	0.816	77%	0.768	S	S	*	*			cis	-161.6	170.1	-12.5	20.7	0	0	0	0	111
182	E	28.6	Very low	30.9	Very low	178 Å²	178	137 Å²	137	83%	0.832	77%	0.766	S	S	*	*			trans	-81.8	-178	173.7	-52.3	-179	123.5	0	0	113.5
183	P	45	Very low	30.8	Very low	123 Å²	123	136.5 Å²	136.5	80%	0.799	77%	0.771	S	S	*	*				-149.1	-170.6	81.5	42	-22.5	0	0	0	117.3
184	E	27.8	Very low	30.8	Very low	178 Å²	178	139.7 Å²	139.7	83%	0.832	78%	0.775	S	S	*	*			trans	-85.1	174.9	-166.7	-49.6	139.5	116.9	0	0	116.5
185	M	28.4	Very low	30.6	Very low	189 Å²	189	140.6 Å²	140.6	93%	0.931	79%	0.786	S	S	*	*				-178.1	177.1	113.1	65.5	177.9	-171.4	0	0	114
186	E	28.7	Very low	31	Very low	192 Å²	192	140.6 Å²	140.6	90%	0.897	79%	0.786	S	S	*	*			trans	-108.1	-169.3	-155.7	-56.1	-170.5	104.6	0	0	117.3
187	T	26.5	Very low	30.6	Very low	121 Å²	121	137.2 Å²	137.2	74%	0.742	78%	0.777	S	S	*	*			trans	-90.7	165	178.9	58.9	0	0	0	0	113.4
188	P	40.6	Very low	30.1	Very low	122 Å²	122	141.7 Å²	141.7	79%	0.792	78%	0.778	S	S	*	*				-134.5	166.3	95.5	16.5	5.9	0	0	0	112.3
189	A	28	Very low	30.1	Very low	86 Å²	86	143.7 Å²	143.7	71%	0.711	78%	0.78	S	S	*	*			cis	93.1	142.1	22.8	0	0	0	0	0	116.3
190	A	30.4	Very low	30.4	Very low	86 Å²	86	146.9 Å²	146.9	71%	0.711	78%	0.78	S	S	*	*			trans	78	127.8	172.8	0	0	0	0	0	116.6
191	V	26.9	Very low	30.3	Very low	130 Å²	130	141.7 Å²	141.7	79%	0.788	77%	0.768	S	S	*	*				98.2	142.8	86.8	-70.6	0	0	0	0	112.8
192	E	26.4	Very low	30.3	Very low	167 Å²	167	142.8 Å²	142.8	78%	0.78	76%	0.764	S	S	*	*			cis	-149.8	-163.4	-9	-90.4	-107	109.4	0	0	109.5
193	E	28.5	Very low	30.2	Very low	158 Å²	158	139.9 Å²	139.9	74%	0.738	76%	0.759	S	S	*	*			trans	-60.5	-170.8	-170.8	-43.9	-168.6	113.5	0	0	117.1
194	E	31.6	Very low	29.4	Very low	156 Å²	156	143.8 Å²	143.8	73%	0.729	76%	0.763	S	S	*	*			cis	-162.7	-168.9	18.4	-146.2	-130.3	98.7	0	0	114.2
195	S	28.7	Very low	29.6	Very low	105 Å²	105	144.5 Å²	144.5	73%	0.734	76%	0.764	S	S	*	*			trans	70.2	148.6	175	75.3	0	0	0	0	118.1
196	A	33.8	Very low	29.6	Very low	85 Å²	85	143.2 Å²	143.2	70%	0.702	75%	0.753	S	S	*	*			cis	-169.1	160.9	-25.7	0	0	0	0	0	105.4
197	D	29.8	Very low	29.6	Very low	122 Å²	122	141.2 Å²	141.2	65%	0.652	74%	0.743	S	S	*	*			cis	-142.1	147.5	20.6	-107.7	-70.8	0	0	0	109
198	R	34.8	Very low	29.9	Very low	215 Å²	215	144.2 Å²	144.2	81%	0.811	75%	0.749	S	S	*	*				55.4	140.1	101.5	-87.7	-169.3	178.7	103.9	-4.6	117
199	E	29.4	Very low	29.5	Very low	161 Å²	161	145.3 Å²	145.3	75%	0.752	75%	0.748	S	S	*	*			cis	-135	148	8.9	-68.6	-162	85.3	0	0	110
200	K	30.2	Very low	29.8	Very low	178 Å²	178	145.6 Å²	145.6	77%	0.774	75%	0.745	S	S	*	*				58.7	136.9	73.1	-167.5	176.1	-178.9	179.7	0	114.2
201	C	25.2	Very low	30	Very low	90 Å²	90	148.7 Å²	148.7	61%	0.608	74%	0.743	S	S	*	*			cis	-129.1	159.5	4	-112.2	0	0	0	0	109.1
202	E	27	Very low	30.2	Very low	156 Å²	156	149.1 Å²	149.1	73%	0.729	74%	0.736	S	S	*	*			cis	87.3	113.8	44.1	-125.7	-159.3	145.2	0	0	116.9
203	T	25.6	Very low	30.5	Very low	117 Å²	117	148.3 Å²	148.3	72%	0.718	74%	0.737	S	S	*	*			trans	61.6	126.1	157.8	63.3	0	0	0	0	123.2
204	K	28.1	Very low	30.8	Very low	205 Å²	205	145 Å²	145	89%	0.891	74%	0.737	S	S	*	*				-173.9	163.2	105	-109.5	177.4	-179.6	174	0	114.7
205	K	33.1	Very low	30.7	Very low	194 Å²	194	146.5 Å²	146.5	84%	0.843	74%	0.744	S	S	*	*			trans	-86.5	146.4	157.7	-59	176.5	177.6	-178.1	0	109.2
206	K	29	Very low	30.8	Very low	162 Å²	162	149.9 Å²	149.9	70%	0.704	75%	0.748	S	S	*	*				174.3	141.5	106.2	-121.3	-168.8	172.6	-137.3	0	113.1
207	E	27.3	Very low	30.9	Very low	149 Å²	149	152.2 Å²	152.2	70%	0.696	75%	0.753	S	S	*	*			trans	55.2	174.3	140.1	-81.4	157.6	-150.3	0	0	121.9
208	E	33.2	Very low	32.1	Very low	184 Å²	184	151.6 Å²	151.6	86%	0.86	76%	0.756	S	S	*	*			trans	-111.2	166.1	-158.6	-61.7	166.6	109.3	0	0	112.7
209	D	32	Very low	32.4	Very low	146 Å²	146	150.2 Å²	150.2	78%	0.781	76%	0.758	S	S	*	*			trans	56.1	125.8	148.2	-149.8	-109.6	0	0	0	121.1
210	S	35.4	Very low	32.7	Very low	92 Å²	92	149.2 Å²	149.2	64%	0.643	76%	0.758	S	S	*	*				171.2	158.6	99.1	50.8	0	0	0	0	115.6
211	K	34.8	Very low	33	Very low	151 Å²	151	148.4 Å²	148.4	66%	0.657	76%	0.757	S	S	*	*			trans	84	115.5	151.3	-79.1	178.3	164.7	-76.7	0	123.1
212	E	31.1	Very low	33.6	Very low	138 Å²	138	147.9 Å²	147.9	65%	0.645	75%	0.746	S	S	*	*				81.4	107.9	116.6	-69.3	169	179.1	0	0	123.4
213	D	32.3	Very low	34.8	Very low	151 Å²	151	145.5 Å²	145.5	81%	0.807	74%	0.737	S	S	*	*				83.9	138.5	120.8	-85.3	-73.4	0	0	0	125.8
214	A	34.7	Very low	35.7	Very low	89 Å²	89	145.2 Å²	145.2	74%	0.736	74%	0.738	S	S	*	*			trans	66.7	155.7	159	0	0	0	0	0	118.8
215	E	28.5	Very low	35.8	Very low	186 Å²	186	145.6 Å²	145.6	87%	0.869	74%	0.735	S	S	*	*			cis	-126	-154.3	5.4	-81.9	-168.4	93.8	0	0	113.2
216	Q	31.1	Very low	35.8	Very low	176 Å²	176	143.8 Å²	143.8	82%	0.822	73%	0.73	S	S	*	*			trans	-115	138.1	-150.1	-59.2	166.5	22.4	0	0	116.7
217	V	37.1	Very low	35.7	Very low	135 Å²	135	142.4 Å²	142.4	82%	0.818	73%	0.73	S	S	*	*			trans	5.6	138.2	131.4	177.1	0	0	0	0	116.7
218	P	55.3	Low	36	Very low	108 Å²	108	142.1 Å²	142.1	70%	0.701	73%	0.733	S	S	*	*			cis	-98.8	-165.2	39.9	-11.7	34.2	0	0	0	117.2
219	E	39.8	Very low	36	Very low	186 Å²	186	138.4 Å²	138.4	87%	0.869	73%	0.727	S	S	*	*			cis	-150.1	177.4	9.7	-139.7	143.1	-102.2	0	0	111.9
220	D	36.5	Very low	35.9	Very low	141 Å²	141	138.2 Å²	138.2	75%	0.754	73%	0.727	S	S	*	*			trans	-145.5	-164.8	-161	-141.6	-50.4	0	0	0	116.3
221	E	36.1	Very low	35.8	Very low	160 Å²	160	140.1 Å²	140.1	75%	0.748	73%	0.73	S	S	*	*			trans	81.9	156.7	-177.6	-55.2	-142.1	171.7	0	0	118.6
222	E	38.4	Very low	35.4	Very low	80 Å²	80	141.2 Å²	141.2	37%	0.374	74%	0.735	S	S	.	*			cis	-161.4	167.7	-49.4	-87.1	-129.1	120.5	0	0	109.7	S722 S723 S724	E222-S722 WeakPolarHBondContact OE2-CB 3.5Å; E222-S723 VanDerWaalsContact CD-CA 3.46Å; E222-S723 VanDerWaalsContact OE1-C 3.31Å; E222-S723 VanDerWaalsContact OE1-CA 3.26Å; E222-S723 WeakPolarHBondContact OE1-CA 3.29Å; E222-S723 WeakPolarHBondContact OE2-CA 3.2Å; E222-S723 PolarHBondContact OE2-N 3.48Å; E222-S724 WeakPolarHBondContact OE1-CB 3.48Å; E222-S724 PolarHBondContact OE1-N 2.89Å
223	L	51	Low	35.2	Very low	105 Å²	105	137.6 Å²	137.6	55%	0.55	73%	0.734	S	S	.	*	B	Isolated β-bridge	trans	-140.2	-152.3	178.7	-69.7	-179.8	0	0	0	113.5	S723 P725	L223-S723 CarbonylContact C-O 3.58Å; L223-S723 WeakPolarHBondContact CA-O 3.32Å; L223-S723 PolarHBondContact N-O 3.38Å; L223-S723 CarbonylContact O-C 3.59Å; L223-S723 PolarHBondContact O-N 3.15Å; L223-P725 HydrophobicContact CD1-CB 4.07Å; L223-P725 HydrophobicContact CD1-CG 4.04Å
224	P	44.2	Very low	34.9	Very low	112 Å²	112	140 Å²	140	73%	0.727	74%	0.738	S	S	*	*			trans	-150.9	-165.7	143.5	37.4	-17.3	0	0	0	116
225	Y	30	Very low	35	Very low	212 Å²	212	142.1 Å²	142.1	83%	0.831	73%	0.733	S	S	*	*			trans	-141.2	164.6	-170.4	-164.8	-126	0	0	0	114.1
226	Q	33.4	Very low	35.3	Very low	157 Å²	157	139.6 Å²	139.6	73%	0.734	73%	0.733	S	S	*	*			trans	72.7	164	173.6	-46.2	-165.8	-51.5	0	0	117.5
227	D	27.1	Very low	35.2	Very low	132 Å²	132	139.3 Å²	139.3	71%	0.706	72%	0.724	S	S	*	*			cis	-147.8	-174.6	9	-157.1	-100.2	0	0	0	113.5
228	D	34.1	Very low	35	Very low	144 Å²	144	137.9 Å²	137.9	77%	0.77	72%	0.72	S	S	*	*			trans	-98.4	175.4	-172.2	-86.7	-68.5	0	0	0	114.7
229	S	33.7	Very low	33.9	Very low	105 Å²	105	138.8 Å²	138.8	73%	0.734	72%	0.715	S	S	*	*			trans	175	149.1	139.4	-85.5	0	0	0	0	117.6
230	N	29.5	Very low	33.4	Very low	143 Å²	143	134.9 Å²	134.9	77%	0.765	71%	0.708	S	S	*	*			trans	66	124.1	164.4	-59.6	-27.7	0	0	0	118.6
231	D	32.3	Very low	32.9	Very low	132 Å²	132	134.2 Å²	134.2	71%	0.706	71%	0.714	S	S	*	*			cis	100	161.4	20.4	-161.1	35.1	0	0	0	116.2
232	F	27.6	Very low	32.7	Very low	174 Å²	174	129.8 Å²	129.8	76%	0.763	71%	0.712	S	S	*	*			trans	90	116.5	-175.4	-61.1	-77	0	0	0	117
233	G	27.1	Very low	32.3	Very low	62 Å²	62	134.8 Å²	134.8	64%	0.639	74%	0.735	S	S	*	*			cis	172.1	175.1	-10.6	0	0	0	0	0	118
234	F	25.6	Very low	31.4	Very low	200 Å²	200	137.5 Å²	137.5	88%	0.877	75%	0.745	S	S	*	*			trans	76.2	124.1	160.9	-87.5	-91.6	0	0	0	122.8
235	Q	36.8	Very low	30.8	Very low	135 Å²	135	139.9 Å²	139.9	63%	0.631	75%	0.746	S	S	*	*			trans	-89.8	-166.4	160.9	-58.1	-177.6	-7.3	0	0	110.7
236	P	33.9	Very low	30.8	Very low	133 Å²	133	137.4 Å²	137.4	86%	0.864	75%	0.747	S	S	*	*				-130	129.9	87.4	5.4	16.7	0	0	0	116.3
237	R	29.4	Very low	30.5	Very low	169 Å²	169	133 Å²	133	64%	0.638	74%	0.744	S	S	*	*			trans	-63.2	163.9	135.1	-93.2	170.9	161.5	-169.2	-0.7	109	Q239	R237-Q239 VanDerWaalsContact CD-OE1 3.22Å
238	S	32.3	Very low	30.9	Very low	106 Å²	106	135.3 Å²	135.3	74%	0.741	76%	0.756	S	S	*	*			cis	-142.6	152.2	41.4	16.6	0	0	0	0	111.1
239	Q	32.4	Very low	30.6	Very low	127 Å²	127	134 Å²	134	59%	0.593	76%	0.758	S	S	*	*				62.3	142.4	63.1	-62.2	176.8	-76.5	0	0	113.8	R237	R237-Q239 VanDerWaalsContact CD-OE1 3.22Å
240	S	30.9	Very low	30.9	Very low	103 Å²	103	133.5 Å²	133.5	72%	0.72	75%	0.754	S	S	*	*			cis	-174.8	137.3	-16.7	46.5	0	0	0	0	111.1
241	S	25.5	Very low	30.8	Very low	127 Å²	127	133.5 Å²	133.5	89%	0.888	75%	0.754	S	S	*	*			trans	-167.5	149.2	145.7	53	0	0	0	0	110.6
242	G	31	Very low	30.9	Very low	67 Å²	67	134.6 Å²	134.6	69%	0.691	76%	0.755	S	S	*	*			cis	165.6	-20.3	-9.4	0	0	0	0	0	116.1
243	E	29.9	Very low	31.3	Very low	186 Å²	186	132.6 Å²	132.6	87%	0.869	75%	0.752	S	S	*	*			trans	-145.7	158.9	-171.7	-64.3	162.9	-170	0	0	107
244	E	31.8	Very low	31.5	Very low	162 Å²	162	135.8 Å²	135.8	76%	0.757	76%	0.759	S	S	*	*			cis	178.8	153.3	-37.4	-115.3	-178.5	-161.4	0	0	104.1
245	E	32.9	Very low	32.1	Very low	161 Å²	161	131.4 Å²	131.4	75%	0.752	75%	0.75	S	S	*	*			trans	61.3	159.5	167.6	-51.5	-44.6	83.8	0	0	123.6
246	D	28.8	Very low	31.7	Very low	160 Å²	160	133.2 Å²	133.2	86%	0.856	76%	0.757	S	S	*	*			trans	61.7	110.2	161.4	-75.5	-33.1	0	0	0	123.2
247	G	28.3	Very low	31.8	Very low	64 Å²	64	137.7 Å²	137.7	66%	0.66	76%	0.756	S	S	*	*				97.3	91.7	88.3	0	0	0	0	0	118.8
248	L	35	Very low	32	Very low	182 Å²	182	135.9 Å²	135.9	95%	0.953	76%	0.759	S	S	*	*			trans	37.6	108.1	144.8	-57.9	176.8	0	0	0	119.6
249	S	27.8	Very low	32.2	Very low	117 Å²	117	138.5 Å²	138.5	82%	0.818	77%	0.765	S	S	*	*			trans	-151	139.6	134.1	-167.9	0	0	0	0	111.9
250	S	39.1	Very low	32.5	Very low	94 Å²	94	140.4 Å²	140.4	66%	0.657	78%	0.778	S	S	*	*			trans	-67.8	157.9	158.6	53.5	0	0	0	0	110.8
251	D	28.3	Very low	32.7	Very low	142 Å²	142	141.4 Å²	141.4	76%	0.759	78%	0.776	S	S	*	*				-163.2	160.9	99.7	-122.2	-70.4	0	0	0	112.9
252	E	33.9	Very low	33.2	Very low	155 Å²	155	141.4 Å²	141.4	72%	0.724	77%	0.766	S	S	*	*			trans	-75.3	178.4	172.1	-48	-90.7	78.6	0	0	108.1
253	D	35.6	Very low	33.3	Very low	133 Å²	133	146.2 Å²	146.2	71%	0.711	77%	0.77	S	S	*	*			cis	-164	153	18.7	-157.6	-22.8	0	0	0	108.9
254	V	32.2	Very low	33.7	Very low	129 Å²	129	142.4 Å²	142.4	78%	0.782	76%	0.764	S	S	*	*			trans	172.9	116.1	141.6	166.2	0	0	0	0	106.5	F256	V254-F256 PolarHBondContact O-N 3.46Å
255	P	39	Very low	33.8	Very low	107 Å²	107	142.8 Å²	142.8	70%	0.695	76%	0.76	S	S	*	*			trans	-75.7	108.6	178.5	29	-33.7	0	0	0	111.6	R257	P255-R257 PolarHBondContact O-N 2.83Å
256	F	27.3	Very low	33.8	Very low	173 Å²	173	140.5 Å²	140.5	76%	0.759	75%	0.753	S	S	*	*			trans	-71.3	122.1	166.3	-153.1	-97.8	0	0	0	109	V254 D258	V254-F256 PolarHBondContact O-N 3.46Å; F256-D258 PolarHBondContact O-N 2.95Å
257	R	36.1	Very low	34	Very low	228 Å²	228	138.3 Å²	138.3	86%	0.86	75%	0.748	S	S	*	*			trans	-91.6	94.6	175.6	-57.8	-171.7	84.9	174.2	6.1	108.6	P255	P255-R257 PolarHBondContact O-N 2.83Å
258	D	34.7	Very low	34.2	Very low	130 Å²	130	145.8 Å²	145.8	70%	0.695	76%	0.756	S	S	*	*			trans	-73.7	141.4	162.2	-77.3	-60.8	0	0	0	109.9	F256 L260	F256-D258 PolarHBondContact O-N 2.95Å; D258-L260 PolarHBondContact O-N 3.09Å; D258-L260 VanDerWaalsContact O-N 3.15Å
259	D	36.1	Very low	34.2	Very low	162 Å²	162	141 Å²	141	87%	0.866	74%	0.742	S	S	*	*			trans	-69.8	106.9	-170.6	-72.5	-62.2	0	0	0	113.5	N261	D259-N261 VanDerWaalsContact C-N 3.33Å; D259-N261 PolarHBondContact O-N 3.19Å
260	L	39.2	Very low	34.5	Very low	167 Å²	167	143.3 Å²	143.3	87%	0.874	74%	0.74	S	S	*	*			trans	-84.8	70.9	167.5	-67.4	-179.9	0	0	0	111.3	D258 D262	D258-L260 PolarHBondContact O-N 3.09Å; D258-L260 VanDerWaalsContact O-N 3.15Å; L260-D262 PolarHBondContact O-N 3.41Å
261	N	33.3	Very low	34.4	Very low	124 Å²	124	148.5 Å²	148.5	66%	0.663	75%	0.745	S	S	*	*			trans	-88.3	80.5	157.9	-173.8	55.6	0	0	0	109.7	D259 Q263	D259-N261 VanDerWaalsContact C-N 3.33Å; D259-N261 PolarHBondContact O-N 3.19Å; N261-Q263 PolarHBondContact OD1-NE2 2.84Å
262	D	36.3	Very low	34.7	Very low	126 Å²	126	151 Å²	151	67%	0.674	75%	0.75	S	S	*	*			trans	-120.8	61.7	178.6	-153.5	7.9	0	0	0	109.6	L260 S264	L260-D262 PolarHBondContact O-N 3.41Å; D262-S264 PolarHBondContact O-N 3.01Å; D262-S264 VanDerWaalsContact O-N 3.13Å
263	Q	33.8	Very low	34.5	Very low	168 Å²	168	151.7 Å²	151.7	79%	0.785	76%	0.757	S	S	*	*			trans	-83.1	74.4	-177.5	-70.2	-174	53.8	0	0	112	N261	N261-Q263 PolarHBondContact OD1-NE2 2.84Å
264	S	38.8	Very low	34.4	Very low	107 Å²	107	152.7 Å²	152.7	75%	0.748	76%	0.763	S	S	*	*			trans	174.2	108	143.6	36.5	0	0	0	0	112.4	D262	D262-S264 PolarHBondContact O-N 3.01Å; D262-S264 VanDerWaalsContact O-N 3.13Å
265	Y	33.9	Very low	34.4	Very low	169 Å²	169	153.5 Å²	153.5	66%	0.663	76%	0.761	S	S	*	*			trans	-151.7	104.4	153.2	-156.9	-92.3	0	0	0	110.8
266	D	32.4	Very low	34.1	Very low	114 Å²	114	153.3 Å²	153.3	61%	0.61	76%	0.758	S	S	*	*			trans	-82.6	118.9	174.4	-173	-22.1	0	0	0	109.2	R268	D266-R268 PolarHBondContact O-N 3.08Å; D266-R268 WeakPolarHBondContact OD1-CB 3.26Å; D266-R268 PolarHBondContact OD1-N 3.02Å; D266-R268 VanDerWaalsContact OD1-N 3.08Å
267	P	32.6	Very low	34.4	Very low	114 Å²	114	154 Å²	154	74%	0.74	76%	0.761	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.7	10.1	-176.9	32	-37.6	0	0	0	114.5
268	R	32.8	Very low	34.4	Very low	221 Å²	221	149.4 Å²	149.4	83%	0.834	76%	0.76	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-6.9	-170.7	-155	167.8	-168.1	148.5	0.5	115.8	D266	D266-R268 PolarHBondContact O-N 3.08Å; D266-R268 WeakPolarHBondContact OD1-CB 3.26Å; D266-R268 PolarHBondContact OD1-N 3.02Å; D266-R268 VanDerWaalsContact OD1-N 3.08Å
269	A	35	Very low	34.2	Very low	80 Å²	80	152.5 Å²	152.5	66%	0.661	77%	0.768	S	S	*	*	S	Bend	trans	-80.9	-29.9	-177.4	0	0	0	0	0	114.9	R271	A269-R271 VanDerWaalsContact C-N 3.28Å; A269-R271 PolarHBondContact O-N 3.5Å
270	E	33.3	Very low	33.9	Very low	166 Å²	166	156.5 Å²	156.5	78%	0.776	77%	0.771	S	S	*	*			trans	-80.8	70.8	-176	-70.8	-62.8	157	0	0	112.3
271	R	37	Very low	33.4	Very low	204 Å²	204	157.7 Å²	157.7	77%	0.77	77%	0.769	S	S	*	*			trans	-146.9	133.8	164.5	-163.3	-176	-61.4	-178.3	2.1	107.5	A269	A269-R271 VanDerWaalsContact C-N 3.28Å; A269-R271 PolarHBondContact O-N 3.5Å
272	F	34.9	Very low	33.3	Very low	195 Å²	195	158.6 Å²	158.6	86%	0.855	78%	0.778	S	S	*	*	S	Bend	trans	78.9	81.4	-164.2	-52.2	-73	0	0	0	115.1
273	L	31.2	Very low	32.9	Very low	168 Å²	168	159.6 Å²	159.6	88%	0.88	78%	0.783	S	S	*	*				-169.3	133.5	106.8	-94.9	167.8	0	0	0	109.3
274	D	33	Very low	32.8	Very low	155 Å²	155	157 Å²	157	83%	0.829	78%	0.781	S	S	*	*			trans	-151.6	101	-174.9	-175.7	7.6	0	0	0	111
275	I	32.5	Very low	32.1	Very low	145 Å²	145	163.9 Å²	163.9	74%	0.744	79%	0.79	S	S	*	*			trans	-138.8	92.1	178.8	-59.7	-175.1	0	0	0	111.5
276	T	32.2	Very low	31.8	Very low	104 Å²	104	164 Å²	164	64%	0.638	80%	0.797	S	S	*	*			trans	45.1	109.3	141.9	64.9	0	0	0	0	122.4
277	K	34.5	Very low	31.7	Very low	187 Å²	187	167.2 Å²	167.2	81%	0.813	81%	0.805	S	S	*	*				53.9	137.1	112.2	-70.5	166.9	-174.1	161.9	0	119.4
278	P	36.1	Very low	31.5	Very low	131 Å²	131	169.7 Å²	169.7	85%	0.851	81%	0.807	S	S	*	*				-140.7	173.4	70.5	38.9	-22.8	0	0	0	117
279	K	30.4	Very low	31.5	Very low	195 Å²	195	169 Å²	169	85%	0.848	81%	0.81	S	S	*	*			trans	-86.2	147.4	-179.2	-59.5	174.9	179.5	177.3	0	111.7
280	R	28.9	Very low	31	Very low	246 Å²	246	173.5 Å²	173.5	93%	0.928	82%	0.815	S	S	*	*			trans	-119.6	137.8	153.2	-104.6	179.4	169.9	156.2	-2.5	110
281	K	29.4	Very low	30.8	Very low	192 Å²	192	171.3 Å²	171.3	84%	0.835	81%	0.805	S	S	*	*			trans	-102.6	143.5	166.5	-66.4	-179.5	178.8	-179.5	0	108.1
282	V	30.6	Very low	30.2	Very low	143 Å²	143	169.1 Å²	169.1	87%	0.867	80%	0.801	S	S	*	*			trans	-133.9	142.6	156	-178.6	0	0	0	0	106.5
283	L	27.7	Very low	29.9	Very low	148 Å²	148	165 Å²	165	78%	0.775	79%	0.787	S	S	*	*			trans	-86	156.9	-170.8	-88.6	73.5	0	0	0	112.8
284	P	30.8	Very low	29.7	Very low	114 Å²	114	165.8 Å²	165.8	74%	0.74	78%	0.784	S	S	*	*			trans	-67.1	147.5	165.5	31.4	-35.4	0	0	0	110.7
285	R	25.3	Very low	29.5	Very low	250 Å²	250	162.4 Å²	162.4	94%	0.943	78%	0.777	S	S	*	*			trans	-97.4	115.5	-179.1	-160.9	177.2	-171.4	-175.3	2.5	110.4
286	H	27.7	Very low	29.6	Very low	171 Å²	171	160.7 Å²	160.7	79%	0.792	78%	0.776	S	S	*	*			trans	-86.9	135.7	167.7	-93.4	-122.7	0	0	0	110.8
287	K	29.2	Very low	29.3	Very low	182 Å²	182	164.2 Å²	164.2	79%	0.791	78%	0.782	S	S	*	*			trans	-145.2	103.4	139.1	-96.3	-156.8	160.7	-171.9	0	105.7
288	E	30	Very low	28.9	Very low	166 Å²	166	163.4 Å²	163.4	78%	0.776	78%	0.779	S	S	*	*				77.9	124.9	88.7	-75.1	-177.5	130.9	0	0	112.1
289	K	31	Very low	28.5	Very low	207 Å²	207	163 Å²	163	90%	0.9	77%	0.765	S	S	*	*			trans	-144.4	159.7	-169.6	172.1	-176.6	179.3	-178.6	0	106
290	K	25.6	Very low	28.5	Very low	174 Å²	174	160.2 Å²	160.2	76%	0.757	77%	0.765	S	S	*	*			trans	107.3	137.7	-177	-166.2	171.6	-177.7	-83.5	0	109.1
291	E	28.5	Very low	28.6	Very low	121 Å²	121	157.1 Å²	157.1	57%	0.565	76%	0.761	S	S	*	*			cis	-129.1	172.2	9.3	-138	155.5	132.3	0	0	108.8
292	K	26	Very low	28.4	Very low	158 Å²	158	157.6 Å²	157.6	69%	0.687	76%	0.763	S	S	*	*			cis	-141.7	-113.7	17.8	-170.2	155.6	-171.2	91.2	0	115.2
293	D	27.3	Very low	28.5	Very low	108 Å²	108	156.1 Å²	156.1	58%	0.578	76%	0.759	S	S	*	*			trans	-114.4	148.2	-160.9	-82.5	-67.8	0	0	0	109.7
294	K	26.8	Very low	28.5	Very low	185 Å²	185	156.9 Å²	156.9	80%	0.804	76%	0.759	S	S	*	*			cis	108.3	127.4	25.2	-177.5	-166.2	177.9	-174.4	0	110.5
295	A	28.2	Very low	28.6	Very low	83 Å²	83	159.5 Å²	159.5	69%	0.686	77%	0.765	S	S	*	*			trans	-58.2	162.9	172.4	0	0	0	0	0	111.9
296	P	36	Very low	28.8	Very low	110 Å²	110	156.3 Å²	156.3	71%	0.714	76%	0.758	S	S	*	*			cis	-139.5	-179.8	36.2	29.4	-2.5	0	0	0	114
297	K	26.3	Very low	29	Very low	178 Å²	178	154.2 Å²	154.2	77%	0.774	76%	0.757	S	S	*	*				-176.4	159.9	73.1	-85.7	165.3	179.2	173.4	0	107
298	K	26.2	Very low	29	Very low	170 Å²	170	154 Å²	154	74%	0.739	76%	0.759	S	S	*	*				65.2	134	54.9	-153.1	-169.1	178	-132.4	0	113.5
299	E	27.2	Very low	29	Very low	121 Å²	121	149.2 Å²	149.2	57%	0.565	75%	0.754	S	S	*	*			trans	71.6	118.9	174.4	-72.9	130.8	-139.3	0	0	118.7
300	T	29.4	Very low	29.1	Very low	137 Å²	137	144 Å²	144	84%	0.84	75%	0.749	S	S	*	*				170.7	91.7	127	41.5	0	0	0	0	105
301	E	31.8	Very low	29.3	Very low	182 Å²	182	142.5 Å²	142.5	85%	0.85	75%	0.749	S	S	*	*				62.6	136.2	70.9	-63.1	-153	124.4	0	0	114.5
302	F	25.8	Very low	29.8	Very low	201 Å²	201	142.5 Å²	142.5	88%	0.882	75%	0.753	S	S	*	*			trans	-108.8	110.3	-178.9	-172.3	-76	0	0	0	108.4
303	S	31.2	Very low	30.4	Very low	113 Å²	113	140.7 Å²	140.7	79%	0.79	75%	0.751	S	S	*	*			trans	-152.6	132.9	165	55	0	0	0	0	110.3
304	E	29.1	Very low	30.8	Very low	164 Å²	164	142.7 Å²	142.7	77%	0.766	76%	0.756	S	S	*	*			trans	-108.1	129.3	-174.7	175.7	-166.3	-176.8	0	0	109.2
305	I	31.9	Very low	31	Very low	169 Å²	169	140.3 Å²	140.3	87%	0.867	75%	0.75	S	S	*	*			trans	-139.7	125.4	161.8	-58.5	-175.9	0	0	0	109.5
306	K	29.8	Very low	31.2	Very low	182 Å²	182	141.6 Å²	141.6	79%	0.791	75%	0.749	S	S	*	*			trans	-48.9	157.1	172.7	-73.2	175.9	168.4	178.2	0	115.1
307	V	31.6	Very low	31	Very low	128 Å²	128	143.6 Å²	143.6	78%	0.776	75%	0.749	S	S	*	*				-163	159.9	110.5	139.7	0	0	0	0	110.6
308	E	29.2	Very low	31.2	Very low	178 Å²	178	142.8 Å²	142.8	83%	0.832	75%	0.748	S	S	*	*			trans	-56.8	162.5	179.7	-57.2	107.7	-174.7	0	0	114.2
309	G	30.8	Very low	31.7	Very low	65 Å²	65	142.7 Å²	142.7	67%	0.67	75%	0.75	S	S	*	*			cis	148.7	167	-1	0	0	0	0	0	111.8
310	A	33.3	Very low	31.9	Very low	97 Å²	97	142.1 Å²	142.1	80%	0.802	75%	0.754	S	S	*	*			trans	63.6	159.4	178.3	0	0	0	0	0	115
311	D	30	Very low	32	Very low	142 Å²	142	144 Å²	144	76%	0.759	75%	0.751	S	S	*	*			cis	-163.8	165.1	4.2	-123.9	11.5	0	0	0	106.3
312	N	38.4	Very low	32.1	Very low	121 Å²	121	140.9 Å²	140.9	65%	0.647	74%	0.739	S	S	*	*			cis	-174.6	-175.9	-25.6	-136.7	-33.4	0	0	0	106.1
313	L	37.9	Very low	32.7	Very low	121 Å²	121	138.8 Å²	138.8	63%	0.634	73%	0.732	S	S	*	*			cis	-158.1	116.9	1.7	-178.7	134.5	0	0	0	111.1
314	E	35	Very low	33	Very low	149 Å²	149	141.3 Å²	141.3	70%	0.696	73%	0.732	S	S	*	*			trans	49.7	-171.9	145.4	-52.8	177.4	122.6	0	0	119.7
315	M	32.9	Very low	33.3	Very low	136 Å²	136	141.5 Å²	141.5	67%	0.67	73%	0.733	S	S	*	*			cis	-154.9	-167.1	0.2	-149	167.3	60	0	0	111.6
316	V	31.1	Very low	33.2	Very low	110 Å²	110	139.7 Å²	139.7	67%	0.667	73%	0.729	S	S	*	*			trans	83.4	92	177.9	-170.2	0	0	0	0	112.4
317	Q	31.5	Very low	33.4	Very low	151 Å²	151	135.6 Å²	135.6	71%	0.706	73%	0.729	S	S	*	*				75.1	142.3	82	-65.8	160.3	-7.6	0	0	112.1
318	E	31.8	Very low	33.6	Very low	162 Å²	162	138.3 Å²	138.3	76%	0.757	73%	0.733	S	S	*	*			cis	-157.5	150.6	26	-161.3	160.9	-165.5	0	0	112.4
319	E	36.8	Very low	34	Very low	168 Å²	168	136.7 Å²	136.7	79%	0.785	73%	0.731	S	S	*	*			trans	57	145.2	154.5	-85.5	-167.9	164	0	0	123
320	V	31.4	Very low	34.3	Very low	108 Å²	108	141.3 Å²	141.3	66%	0.655	74%	0.739	S	S	*	*			cis	-152.4	148.7	-12.9	-139.3	0	0	0	0	110.8
321	K	30.8	Very low	34.4	Very low	176 Å²	176	144.2 Å²	144.2	77%	0.765	74%	0.741	S	S	*	*			trans	53.8	146	143.3	-92	-171.9	173.7	-170.3	0	122
322	L	33.9	Very low	34.6	Very low	117 Å²	117	140 Å²	140	61%	0.613	73%	0.731	S	S	*	*			cis	-139.9	137.8	0	-87.7	171.2	0	0	0	106.6
323	E	39.3	Very low	35.8	Very low	157 Å²	157	140.3 Å²	140.3	73%	0.734	74%	0.74	S	S	*	*				59	134.2	90.1	-64.9	160.3	-138.6	0	0	113.7
324	E	36.9	Very low	35.7	Very low	166 Å²	166	146 Å²	146	78%	0.776	75%	0.753	S	S	*	*			cis	-150.1	139.1	31.8	-135.6	173.6	113	0	0	112.7
325	E	34.9	Very low	35.7	Very low	169 Å²	169	148.3 Å²	148.3	79%	0.79	76%	0.761	S	S	*	*			trans	40	152.9	136.3	-64.8	-164.4	-169.7	0	0	124.2
326	V	29.9	Very low	35.6	Very low	131 Å²	131	154 Å²	154	79%	0.794	77%	0.774	S	S	*	*			cis	-148.1	173.5	3.2	102	0	0	0	0	112.3
327	A	34.4	Very low	35.6	Very low	95 Å²	95	152.3 Å²	152.3	79%	0.785	78%	0.78	S	S	*	*			trans	-77.2	-174.5	-163.6	0	0	0	0	0	118.8
328	E	34.9	Very low	36	Very low	185 Å²	185	155.3 Å²	155.3	86%	0.864	79%	0.785	S	S	*	*			trans	-96.2	165.4	-158	-52.9	-177.2	120	0	0	117.5
329	D	38.4	Very low	36.6	Very low	145 Å²	145	157.9 Å²	157.9	78%	0.775	79%	0.788	S	S	*	*			trans	60.1	140.9	147.2	-123.1	-47.4	0	0	0	123.6
330	L	37.1	Very low	37	Very low	162 Å²	162	159.2 Å²	159.2	85%	0.848	79%	0.791	S	S	*	*			trans	-157.3	103.6	168.9	-83.3	-173.5	0	0	0	112.3
331	D	33.9	Very low	37.4	Very low	157 Å²	157	162.1 Å²	162.1	84%	0.84	80%	0.795	S	S	*	*			trans	54.8	153.1	133	-142.5	-21.6	0	0	0	121.2
332	G	35.2	Very low	37.8	Very low	53 Å²	53	159.1 Å²	159.1	55%	0.546	79%	0.787	S	S	.	*			trans	-94.5	-141.8	178.5	0	0	0	0	0	115
333	P	63.1	Low	38.6	Very low	129 Å²	129	159.8 Å²	159.8	84%	0.838	79%	0.791	S	S	*	*				-117.6	130.8	-84.9	33.9	-29.9	0	0	0	113.1
334	R	36.1	Very low	39.2	Very low	239 Å²	239	161.1 Å²	161.1	90%	0.902	79%	0.794	S	S	*	*			trans	-136.6	110.3	-177.7	-68.9	-170	176	-173.9	0.8	116.8
335	K	34.9	Very low	39.3	Very low	199 Å²	199	159.6 Å²	159.6	87%	0.865	80%	0.796	S	S	*	*			trans	36.9	126.5	134.3	-61.5	179.8	-179.3	176.6	0	120.7
336	R	32.1	Very low	40	Very low	254 Å²	254	157.3 Å²	157.3	96%	0.958	80%	0.796	S	S	*	*			trans	39.5	104.5	143.5	-73.4	-171.4	169.9	-150.6	-0.6	118.7
337	G	31.1	Very low	41.1	Very low	76 Å²	76	161.2 Å²	161.2	78%	0.784	80%	0.797	S	S	*	*				116.3	147.8	103.4	0	0	0	0	0	120.1
338	R	38.6	Very low	42.1	Very low	214 Å²	214	164.2 Å²	164.2	81%	0.808	80%	0.799	S	S	*	*			trans	55.6	109.1	162	-79.1	-169.6	169.2	-157.7	0.1	119.9
339	R	45.4	Very low	42.8	Very low	216 Å²	216	161.4 Å²	161.4	82%	0.815	80%	0.796	S	S	*	*				56.9	114.6	123.6	-66.7	179.9	170.7	-170.5	-3.2	116.3
340	K	45.5	Very low	43.5	Very low	196 Å²	196	162.3 Å²	162.3	85%	0.852	79%	0.794	S	S	*	*				163.6	169.5	61.5	-172.2	176	176.5	-175.3	0	107
341	K	39	Very low	44.2	Very low	169 Å²	169	166.4 Å²	166.4	74%	0.735	80%	0.798	S	S	*	*			trans	75	140.9	178.4	-63.4	-175.7	145.4	-85	0	113.6
342	D	39.7	Very low	45.2	Very low	112 Å²	112	170.4 Å²	170.4	60%	0.599	80%	0.801	S	S	*	*			cis	-153.7	177.9	-12.6	-103.8	-16.8	0	0	0	110.8
343	D	49.8	Very low	46.3	Very low	132 Å²	132	177.5 Å²	177.5	71%	0.706	82%	0.817	S	S	*	*			trans	-6.3	154.9	164.6	-82.2	-70.6	0	0	0	122.8
344	K	52.5	Low	45.7	Very low	185 Å²	185	180.8 Å²	180.8	80%	0.804	82%	0.818	S	S	*	*			trans	81.3	64.6	166.4	-53	125.8	-176.9	175.7	0	116.8	P346	K344-P346 WeakPolarHBondContact O-CD 3.21Å
345	T	39.5	Very low	46.5	Very low	133 Å²	133	174.5 Å²	174.5	82%	0.816	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-60.9	124.9	131	34.4	0	0	0	0	108.5	R347	T345-R347 PolarHBondContact O-N 2.6Å; T345-R347 VanDerWaalsContact O-N 3.15Å
346	P	49.1	Very low	47.6	Very low	121 Å²	121	170.5 Å²	170.5	79%	0.786	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-65.4	117.9	172.4	26.5	-32.1	0	0	0	108.1	K344 L348	K344-P346 WeakPolarHBondContact O-CD 3.21Å; P346-L348 PolarHBondContact O-N 3.2Å
347	R	53.1	Low	48.9	Very low	214 Å²	214	162 Å²	162	81%	0.808	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-57.3	126	178.1	-76	175.3	165.9	159.6	-4.9	109.4	T345	T345-R347 PolarHBondContact O-N 2.6Å; T345-R347 VanDerWaalsContact O-N 3.15Å
348	L	54.8	Low	50.3	Low	157 Å²	157	165.7 Å²	165.7	82%	0.822	78%	0.775	S	S	*	*			trans	-40.2	134	167.6	-69.5	170.2	0	0	0	109.9	P346 K350	P346-L348 PolarHBondContact O-N 3.2Å; L348-K350 PolarHBondContact O-N 3.09Å
349	P	50.6	Low	51.5	Low	126 Å²	126	163 Å²	163	82%	0.818	77%	0.766	S	S	*	*			trans	-51.9	108	-177	-29.5	35.8	0	0	0	111.3	R351	P349-R351 PolarHBondContact O-N 3.42Å; P349-R351 VanDerWaalsContact O-N 3.12Å
350	K	52	Low	52.9	Low	165 Å²	165	154.9 Å²	154.9	72%	0.717	74%	0.741	S	S	*	*			trans	-51.6	123.7	179.5	-72.8	-178	177.2	-179.7	0	107.9	L348 R352	L348-K350 PolarHBondContact O-N 3.09Å; K350-R352 PolarHBondContact O-N 2.8Å
351	R	52.5	Low	54.2	Low	247 Å²	247	153.1 Å²	153.1	93%	0.932	73%	0.729	S	S	*	*			trans	-34.9	106.3	-178.9	-63.9	172.5	95.6	-163.1	12.3	109.4	P349 K353	P349-R351 PolarHBondContact O-N 3.42Å; P349-R351 VanDerWaalsContact O-N 3.12Å; R351-K353 PolarHBondContact O-N 3.29Å
352	R	54.4	Low	56	Low	242 Å²	242	145.2 Å²	145.2	91%	0.913	70%	0.695	S	S	*	*	P	Polyproline II helix	trans	-51.5	118.1	175	-90.9	179.8	156.8	-178.7	-6.9	106.3	K350 K354	K350-R352 PolarHBondContact O-N 2.8Å; R352-K354 PolarHBondContact O-N 3.4Å; R352-K354 VanDerWaalsContact O-N 3.08Å
353	K	57.6	Low	57.4	Low	202 Å²	202	148.6 Å²	148.6	88%	0.878	71%	0.707	S	S	*	*	P	Polyproline II helix	trans	-53.2	122.2	173.3	-67.6	-178.1	179.7	-179.3	0	105.6	R351	R351-K353 PolarHBondContact O-N 3.29Å
354	K	50.8	Low	58.2	Low	197 Å²	197	145.3 Å²	145.3	86%	0.857	69%	0.688	S	S	*	*	P	Polyproline II helix	trans	-52	129.6	176.6	-70.7	-173.7	176.6	-174.3	0	106.8	R352	R352-K354 PolarHBondContact O-N 3.4Å; R352-K354 VanDerWaalsContact O-N 3.08Å
355	P	54.3	Low	58.5	Low	108 Å²	108	145.7 Å²	145.7	70%	0.701	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-55.7	142	178.7	24.1	-33.3	0	0	0	108.4	V357	P355-V357 PolarHBondContact O-N 3.42Å
356	P	56.3	Low	59.3	Low	115 Å²	115	144 Å²	144	75%	0.747	70%	0.701	S	S	*	*	P	Polyproline II helix	trans	-59	118.3	-179.1	24.9	-33.1	0	0	0	108.4	Q358	P356-Q358 PolarHBondContact O-N 3.44Å
357	V	60	Low	60.2	Low	75 Å²	75	140 Å²	140	46%	0.455	68%	0.676	S	S	.	*			trans	-60.8	110.2	174.4	175	0	0	0	0	106.5	P355 Y359 A372	P355-V357 PolarHBondContact O-N 3.42Å; V357-Y359 HydrophobicContact CB-CD2 4.22Å; V357-Y359 HydrophobicContact CB-CE2 3.82Å; V357-Y359 HydrophobicContact CG1-CD1 4.22Å; V357-Y359 HydrophobicContact CG1-CD2 4.11Å; V357-Y359 HydrophobicContact CG1-CE1 3.96Å; V357-Y359 HydrophobicContact CG1-CE2 3.85Å; V357-Y359 HydrophobicContact CG1-CG 4.29Å; V357-Y359 WeakPolarHBondContact O-CD2 3.15Å; V357-Y359 PolarHBondContact O-N 3.02Å; V357-A372 HydrophobicContact CG1-CB 3.78Å
358	Q	60	Low	60.9	Low	153 Å²	153	131.8 Å²	131.8	72%	0.715	66%	0.658	S	S	*	*			trans	-73.6	87.2	178.4	-74.8	-174.6	-18	0	0	108.7	P356 V360	P356-Q358 PolarHBondContact O-N 3.44Å; Q358-V360 WeakPolarHBondContact O-CG2 3.48Å; Q358-V360 PolarHBondContact O-N 3.46Å
359	Y	65.5	Low	61.7	Low	158 Å²	158	126.8 Å²	126.8	62%	0.62	63%	0.634	S	S	*	*			trans	-66.7	92.3	174.3	-76.3	-70.1	0	0	0	110.3	V357 V370 L371 A372	V357-Y359 HydrophobicContact CB-CD2 4.22Å; V357-Y359 HydrophobicContact CB-CE2 3.82Å; V357-Y359 HydrophobicContact CG1-CD1 4.22Å; V357-Y359 HydrophobicContact CG1-CD2 4.11Å; V357-Y359 HydrophobicContact CG1-CE1 3.96Å; V357-Y359 HydrophobicContact CG1-CE2 3.85Å; V357-Y359 HydrophobicContact CG1-CG 4.29Å; V357-Y359 WeakPolarHBondContact O-CD2 3.15Å; V357-Y359 PolarHBondContact O-N 3.02Å; Y359-V370 HydrophobicContact CD1-CG1 4.05Å; Y359-V370 HydrophobicContact CG-CG1 4.18Å; Y359-L371 CarbonylContact C-O 3.49Å; Y359-L371 WeakPolarHBondContact CA-O 3.14Å; Y359-A372 HydrophobicContact CD1-CB 4.23Å; Y359-A372 HydrophobicContact CE1-CB 3.97Å
360	V	73.4	Confident	62.9	Low	46 Å²	46	124.3 Å²	124.3	28%	0.279	62%	0.616	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82	127.2	179.8	-158	0	0	0	0	109.3	Q358 L371 P374 L377	Q358-V360 WeakPolarHBondContact O-CG2 3.48Å; Q358-V360 PolarHBondContact O-N 3.46Å; V360-L371 PolarHBondContact N-O 3.39Å; V360-L371 PolarHBondContact O-N 2.84Å; V360-P374 HydrophobicContact CG2-CG 4.11Å; V360-L377 HydrophobicContact CB-CD2 3.83Å; V360-L377 HydrophobicContact CG1-CD2 3.4Å; V360-L377 VanDerWaalsContact CG1-CD2 3.4Å
361	R	73.5	Confident	64.3	Low	159 Å²	159	118.6 Å²	118.6	60%	0.6	59%	0.593	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-82.9	143.9	176.5	-174.7	176.4	-72.1	178.3	-0.2	110.1	E363 V370	R361-E363 PolarHBondContact O-N 3.34Å; R361-V370 HydrophobicContact CB-CG2 4.24Å; R361-V370 HydrophobicContact CG-CG2 4.17Å
362	C	76.6	Confident	65.4	Low	2 Å²	2	109.3 Å²	109.3	1%	0.014	57%	0.569	C	S	.	*			trans	-74.7	110.3	164.1	-173.6	0	0	0	0	109.4	M364 G368 T369 L377 H380	C362-M364 VanDerWaalsContact C-N 3.32Å; C362-M364 PolarHBondContact O-N 3.36Å; C362-G368 PolarHBondContact O-N 3.18Å; C362-T369 WeakPolarHBondContact CB-OG1 3.22Å; C362-T369 PolarHBondContact N-O 3.16Å; C362-L377 HydrophobicContact CB-CD1 3.72Å; C362-H380 VanDerWaalsContact SG-CD2 3.59Å; C362-H380 PolarHBondContact SG-NE2 3.43Å
363	E	69	Low	66.6	Low	183 Å²	183	102 Å²	102	86%	0.855	55%	0.546	S	S	*	.			trans	-81.2	-8.6	-173	-63.8	176.1	162	0	0	113.8	R361	R361-E363 PolarHBondContact O-N 3.34Å
364	M	67.6	Low	67.4	Low	64 Å²	64	95.3 Å²	95.3	32%	0.315	52%	0.522	S	S	.	.	S	Bend	trans	-69.5	139.4	176.9	-77.6	176.4	-75.2	0	0	112.4	C362 G366 C367 I381 H385	C362-M364 VanDerWaalsContact C-N 3.32Å; C362-M364 PolarHBondContact O-N 3.36Å; M364-G366 PolarHBondContact O-N 2.85Å; M364-C367 PolarHBondContact O-N 2.76Å; M364-I381 HydrophobicContact CE-CB 4.02Å; M364-I381 HydrophobicContact CE-CD1 4.12Å; M364-I381 HydrophobicContact CE-CG1 3.54Å; M364-I381 HydrophobicContact CE-CG2 3.79Å; M364-H385 HydrophobicContact CE-CB 3.53Å; M364-H385 WeakPolarHBondContact CE-CD2 3.42Å; M364-H385 HydrophobicContact SD-CB 3.5Å; M364-H385 VanDerWaalsContact SD-CB 3.5Å; M364-H385 VanDerWaalsContact SD-CG 3.5Å
365	E	57.8	Low	68.6	Low	193 Å²	193	94.6 Å²	94.6	90%	0.902	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.7	134	-173.7	-59.5	-176.3	138.2	0	0	113.2	C367	E365-C367 PolarHBondContact O-N 3.29Å; E365-C367 VanDerWaalsContact O-N 3.16Å
366	G	57.3	Low	69.7	Low	96 Å²	96	96.9 Å²	96.9	99%	0.99	51%	0.51	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.5	-2	176.7	0	0	0	0	0	116.5	M364	M364-G366 PolarHBondContact O-N 2.85Å
367	C	67.6	Low	70.6	Confident	39 Å²	39	92.3 Å²	92.3	26%	0.264	48%	0.479	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-58.6	-178.8	-169.3	0	0	0	0	113.5	M364 E365 T369 H380 H385	M364-C367 PolarHBondContact O-N 2.76Å; E365-C367 PolarHBondContact O-N 3.29Å; E365-C367 VanDerWaalsContact O-N 3.16Å; C367-T369 PolarHBondContact O-N 3.18Å; C367-H380 PolarHBondContact SG-CE1 2.91Å; C367-H380 PolarHBondContact SG-NE2 2.95Å; C367-H385 WeakPolarHBondContact CB-NE2 3.37Å; C367-H385 PolarHBondContact SG-NE2 3.47Å; C367-H385 VanDerWaalsContact SG-NE2 3.35Å
368	G	66.7	Low	71.2	Confident	41 Å²	41	95.2 Å²	95.2	42%	0.423	49%	0.488	S	S	.	.			trans	61.5	1.3	171.4	0	0	0	0	0	117.4	C362 V370	C362-G368 PolarHBondContact O-N 3.18Å; G368-V370 PolarHBondContact O-N 3.41Å
369	T	71.7	Confident	71.9	Confident	52 Å²	52	93.2 Å²	93.2	32%	0.319	48%	0.478	S	S	.	.			trans	-61.9	133.7	-176.3	57.6	0	0	0	0	111.5	C362 C367 H380	C362-T369 WeakPolarHBondContact CB-OG1 3.22Å; C362-T369 PolarHBondContact N-O 3.16Å; C367-T369 PolarHBondContact O-N 3.18Å; T369-H380 PolarHBondContact OG1-CE1 3.19Å; T369-H380 PolarHBondContact OG1-NE2 3.49Å
370	V	76.1	Confident	72.3	Confident	73 Å²	73	86.9 Å²	86.9	44%	0.442	45%	0.454	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.5	127.8	179.9	179.5	0	0	0	0	109.3	Y359 R361 G368	Y359-V370 HydrophobicContact CD1-CG1 4.05Å; Y359-V370 HydrophobicContact CG-CG1 4.18Å; R361-V370 HydrophobicContact CB-CG2 4.24Å; R361-V370 HydrophobicContact CG-CG2 4.17Å; G368-V370 PolarHBondContact O-N 3.41Å
371	L	81.1	Confident	72.3	Confident	45 Å²	45	87 Å²	87	24%	0.236	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	137.5	-171.8	-68.5	166.9	0	0	0	111.1	Y359 V360 H373 L377 H380	Y359-L371 CarbonylContact C-O 3.49Å; Y359-L371 WeakPolarHBondContact CA-O 3.14Å; V360-L371 PolarHBondContact N-O 3.39Å; V360-L371 PolarHBondContact O-N 2.84Å; L371-H373 PolarHBondContact O-N 2.91Å; L371-H373 VanDerWaalsContact O-N 3.15Å; L371-L377 HydrophobicContact CD1-CB 4.28Å; L371-L377 HydrophobicContact CD1-CD1 4.09Å; L371-H380 HydrophobicContact CD1-CB 3.49Å; L371-H380 VanDerWaalsContact CD1-CB 3.49Å
372	A	76.8	Confident	72.3	Confident	52 Å²	52	85 Å²	85	43%	0.43	45%	0.448	S	S	.	.	S	Bend	trans	-72.6	-4.3	-170.1	0	0	0	0	0	115.6	V357 Y359	V357-A372 HydrophobicContact CG1-CB 3.78Å; Y359-A372 HydrophobicContact CD1-CB 4.23Å; Y359-A372 HydrophobicContact CE1-CB 3.97Å
373	H	77.9	Confident	71.8	Confident	90 Å²	90	89.5 Å²	89.5	42%	0.417	47%	0.466	S	S	.	.	S	Bend	trans	-156.8	140.4	-178.7	-166.8	-110.3	0	0	0	112.4	L371 R375 Y376 L377	L371-H373 PolarHBondContact O-N 2.91Å; L371-H373 VanDerWaalsContact O-N 3.15Å; H373-R375 VanDerWaalsContact C-N 3.27Å; H373-R375 VanDerWaalsContact ND1-CB 3.35Å; H373-R375 WeakPolarHBondContact ND1-CB 3.33Å; H373-R375 PolarHBondContact ND1-N 2.94Å; H373-R375 PolarHBondContact O-N 3.33Å; H373-Y376 HydrophobicContact CB-CD2 3.75Å; H373-Y376 HydrophobicContact CB-CE2 4.24Å; H373-Y376 PolarHBondContact O-N 3.33Å; H373-L377 PolarHBondContact O-N 3.2Å; H373-L377 VanDerWaalsContact O-N 3.15Å
374	P	75.6	Confident	71.6	Confident	60 Å²	60	84.6 Å²	84.6	39%	0.39	44%	0.443	S	S	.	.	H	α-helix	trans	-54.6	-35.7	179.2	-28.1	34.6	0	0	0	114.8	V360 Y376 L377 Q378	V360-P374 HydrophobicContact CG2-CG 4.11Å; P374-Y376 VanDerWaalsContact C-N 3.32Å; P374-Y376 PolarHBondContact O-N 2.8Å; P374-L377 CarbonylContact O-C 2.81Å; P374-L377 PolarHBondContact O-N 3.41Å; P374-L377 VanDerWaalsContact O-N 3.14Å; P374-Q378 PolarHBondContact O-N 3.46Å
375	R	76.4	Confident	71.6	Confident	183 Å²	183	82.9 Å²	82.9	69%	0.691	43%	0.434	S	S	*	.	H	α-helix	trans	-61.6	-38.4	177	-166.2	-174.8	-69.4	172.4	-3.2	112.2	H373 H379	H373-R375 VanDerWaalsContact C-N 3.27Å; H373-R375 VanDerWaalsContact ND1-CB 3.35Å; H373-R375 WeakPolarHBondContact ND1-CB 3.33Å; H373-R375 PolarHBondContact ND1-N 2.94Å; H373-R375 PolarHBondContact O-N 3.33Å; R375-H379 PolarHBondContact O-N 3.45Å
376	Y	76.4	Confident	72	Confident	155 Å²	155	79.5 Å²	79.5	61%	0.608	42%	0.422	S	S	*	.	H	α-helix	trans	-73.6	-32.9	175	-63.5	-50.9	0	0	0	111.8	H373 P374 H379 H380	H373-Y376 HydrophobicContact CB-CD2 3.75Å; H373-Y376 HydrophobicContact CB-CE2 4.24Å; H373-Y376 PolarHBondContact O-N 3.33Å; P374-Y376 VanDerWaalsContact C-N 3.32Å; P374-Y376 PolarHBondContact O-N 2.8Å; Y376-H379 PolarHBondContact O-N 3.26Å; Y376-H380 VanDerWaalsContact O-CB 3.24Å; Y376-H380 WeakPolarHBondContact O-CB 3.25Å; Y376-H380 PolarHBondContact O-N 3.12Å
377	L	76.6	Confident	72	Confident	20 Å²	20	78.7 Å²	78.7	11%	0.105	39%	0.394	C	S	.	.	H	α-helix	trans	-64.6	-45.5	171	-179.8	60	0	0	0	111.5	V360 C362 L371 H373 P374 H379 H380 I381	V360-L377 HydrophobicContact CB-CD2 3.83Å; V360-L377 HydrophobicContact CG1-CD2 3.4Å; V360-L377 VanDerWaalsContact CG1-CD2 3.4Å; C362-L377 HydrophobicContact CB-CD1 3.72Å; L371-L377 HydrophobicContact CD1-CB 4.28Å; L371-L377 HydrophobicContact CD1-CD1 4.09Å; H373-L377 PolarHBondContact O-N 3.2Å; H373-L377 VanDerWaalsContact O-N 3.15Å; P374-L377 CarbonylContact O-C 2.81Å; P374-L377 PolarHBondContact O-N 3.41Å; P374-L377 VanDerWaalsContact O-N 3.14Å; L377-H379 VanDerWaalsContact C-N 3.33Å; L377-H379 PolarHBondContact O-N 2.94Å; L377-H380 CarbonylContact O-C 3.58Å; L377-H380 WeakPolarHBondContact O-CB 3.26Å; L377-H380 PolarHBondContact O-N 3.33Å; L377-I381 HydrophobicContact CD1-CD1 3.93Å; L377-I381 HydrophobicContact CD1-CG1 3.91Å; L377-I381 HydrophobicContact CD2-CD1 4.4Å; L377-I381 HydrophobicContact CG-CD1 3.8Å; L377-I381 HydrophobicContact CG-CG1 4.2Å; L377-I381 WeakPolarHBondContact O-CB 3.47Å; L377-I381 VanDerWaalsContact O-CG1 3.24Å; L377-I381 WeakPolarHBondContact O-CG1 3.4Å; L377-I381 PolarHBondContact O-N 3.42Å
378	Q	71.5	Confident	71.4	Confident	136 Å²	136	83.7 Å²	83.7	64%	0.636	41%	0.412	S	S	*	.	H	α-helix	trans	-59.5	-42.2	174.8	-73.4	175.5	-18.5	0	0	112.1	P374 I381 K382	P374-Q378 PolarHBondContact O-N 3.46Å; Q378-I381 PolarHBondContact O-N 2.9Å; Q378-K382 VanDerWaalsContact O-CB 3.3Å; Q378-K382 WeakPolarHBondContact O-CB 3.2Å; Q378-K382 PolarHBondContact O-N 2.86Å
379	H	74.4	Confident	70.7	Confident	111 Å²	111	90.8 Å²	90.8	51%	0.514	43%	0.431	S	S	.	.	H	α-helix	trans	-61.6	-46.1	173.5	-171.8	-88.3	0	0	0	111.8	R375 Y376 L377 K382 Y383	R375-H379 PolarHBondContact O-N 3.45Å; Y376-H379 PolarHBondContact O-N 3.26Å; L377-H379 VanDerWaalsContact C-N 3.33Å; L377-H379 PolarHBondContact O-N 2.94Å; H379-K382 PolarHBondContact O-N 3.33Å; H379-Y383 AromaticContact CD2-CD2 3.73Å; H379-Y383 AromaticContact CD2-CE2 3.54Å; H379-Y383 AromaticContact CE1-CD2 3.47Å; H379-Y383 VanDerWaalsContact CE1-CD2 3.47Å; H379-Y383 WeakPolarHBondContact CE1-CD2 3.3Å; H379-Y383 AromaticContact CE1-CE2 3.76Å; H379-Y383 AromaticContact CG-CD2 3.91Å; H379-Y383 AromaticContact ND1-CD2 3.75Å; H379-Y383 AromaticContact NE2-CD2 3.44Å; H379-Y383 WeakPolarHBondContact NE2-CD2 3.36Å; H379-Y383 AromaticContact NE2-CE2 3.23Å; H379-Y383 WeakPolarHBondContact NE2-CE2 3.45Å; H379-Y383 VanDerWaalsContact O-CD2 3.32Å; H379-Y383 WeakPolarHBondContact O-CD2 3.35Å; H379-Y383 PolarHBondContact O-N 3.3Å
380	H	74.7	Confident	70.4	Confident	24 Å²	24	94 Å²	94	11%	0.111	44%	0.44	C	S	.	.	H	α-helix	trans	-58.3	-51.6	174.8	169.4	102.6	0	0	0	111.5	C362 C367 T369 L371 Y376 L377 K382 Y383 Q384 H385	C362-H380 VanDerWaalsContact SG-CD2 3.59Å; C362-H380 PolarHBondContact SG-NE2 3.43Å; C367-H380 PolarHBondContact SG-CE1 2.91Å; C367-H380 PolarHBondContact SG-NE2 2.95Å; T369-H380 PolarHBondContact OG1-CE1 3.19Å; T369-H380 PolarHBondContact OG1-NE2 3.49Å; L371-H380 HydrophobicContact CD1-CB 3.49Å; L371-H380 VanDerWaalsContact CD1-CB 3.49Å; Y376-H380 VanDerWaalsContact O-CB 3.24Å; Y376-H380 WeakPolarHBondContact O-CB 3.25Å; Y376-H380 PolarHBondContact O-N 3.12Å; L377-H380 CarbonylContact O-C 3.58Å; L377-H380 WeakPolarHBondContact O-CB 3.26Å; L377-H380 PolarHBondContact O-N 3.33Å; H380-K382 VanDerWaalsContact C-N 3.32Å; H380-K382 PolarHBondContact O-N 3.38Å; H380-Y383 PolarHBondContact O-N 3.13Å; H380-Q384 WeakPolarHBondContact O-CB 3.25Å; H380-Q384 WeakPolarHBondContact O-CG 3.45Å; H380-Q384 PolarHBondContact O-N 2.84Å; H380-H385 AromaticContact NE2-CD2 3.84Å; H380-H385 AromaticContact NE2-NE2 3.59Å
381	I	73.5	Confident	70.1	Confident	49 Å²	49	94.8 Å²	94.8	25%	0.251	44%	0.436	S	S	.	.	I	π-helix	trans	-55.9	-47.3	177.3	-70.1	179.2	0	0	0	110.3	M364 L377 Q378 H385 L386	M364-I381 HydrophobicContact CE-CB 4.02Å; M364-I381 HydrophobicContact CE-CD1 4.12Å; M364-I381 HydrophobicContact CE-CG1 3.54Å; M364-I381 HydrophobicContact CE-CG2 3.79Å; L377-I381 HydrophobicContact CD1-CD1 3.93Å; L377-I381 HydrophobicContact CD1-CG1 3.91Å; L377-I381 HydrophobicContact CD2-CD1 4.4Å; L377-I381 HydrophobicContact CG-CD1 3.8Å; L377-I381 HydrophobicContact CG-CG1 4.2Å; L377-I381 WeakPolarHBondContact O-CB 3.47Å; L377-I381 VanDerWaalsContact O-CG1 3.24Å; L377-I381 WeakPolarHBondContact O-CG1 3.4Å; L377-I381 PolarHBondContact O-N 3.42Å; Q378-I381 PolarHBondContact O-N 2.9Å; I381-H385 WeakPolarHBondContact O-CB 3.5Å; I381-H385 PolarHBondContact O-N 2.71Å; I381-L386 HydrophobicContact CG2-CD1 3.97Å; I381-L386 HydrophobicContact CG2-CG 4.15Å; I381-L386 PolarHBondContact O-N 3.3Å
382	K	72.7	Confident	69.6	Low	116 Å²	116	96.6 Å²	96.6	50%	0.504	45%	0.449	S	S	.	.	I	π-helix	trans	-57.4	-54.8	177.4	-169.4	169.9	-177.7	175	0	111.9	Q378 H379 H380 L386 L387	Q378-K382 VanDerWaalsContact O-CB 3.3Å; Q378-K382 WeakPolarHBondContact O-CB 3.2Å; Q378-K382 PolarHBondContact O-N 2.86Å; H379-K382 PolarHBondContact O-N 3.33Å; H380-K382 VanDerWaalsContact C-N 3.32Å; H380-K382 PolarHBondContact O-N 3.38Å; K382-L386 PolarHBondContact O-N 3.06Å; K382-L387 HydrophobicContact CG-CD1 3.98Å; K382-L387 WeakPolarHBondContact O-CD1 3.48Å; K382-L387 PolarHBondContact O-N 3.37Å
383	Y	67.2	Low	69.6	Low	98 Å²	98	94.5 Å²	94.5	38%	0.384	43%	0.431	S	S	.	.	I	π-helix	trans	-88.1	-16.8	-171.4	-72.6	-76.6	0	0	0	116	H379 H380 L387	H379-Y383 AromaticContact CD2-CD2 3.73Å; H379-Y383 AromaticContact CD2-CE2 3.54Å; H379-Y383 AromaticContact CE1-CD2 3.47Å; H379-Y383 VanDerWaalsContact CE1-CD2 3.47Å; H379-Y383 WeakPolarHBondContact CE1-CD2 3.3Å; H379-Y383 AromaticContact CE1-CE2 3.76Å; H379-Y383 AromaticContact CG-CD2 3.91Å; H379-Y383 AromaticContact ND1-CD2 3.75Å; H379-Y383 AromaticContact NE2-CD2 3.44Å; H379-Y383 WeakPolarHBondContact NE2-CD2 3.36Å; H379-Y383 AromaticContact NE2-CE2 3.23Å; H379-Y383 WeakPolarHBondContact NE2-CE2 3.45Å; H379-Y383 VanDerWaalsContact O-CD2 3.32Å; H379-Y383 WeakPolarHBondContact O-CD2 3.35Å; H379-Y383 PolarHBondContact O-N 3.3Å; H380-Y383 PolarHBondContact O-N 3.13Å; Y383-L387 HydrophobicContact CD1-CD1 4.35Å; Y383-L387 HydrophobicContact CD1-CD2 3.84Å; Y383-L387 HydrophobicContact CE1-CD2 3.98Å
384	Q	63.6	Low	69.3	Low	79 Å²	79	95.3 Å²	95.3	37%	0.369	44%	0.444	S	S	.	.	I	π-helix	trans	-99.5	-35.7	178.4	-58.4	-69.3	-14.7	0	0	112.7	H380	H380-Q384 WeakPolarHBondContact O-CB 3.25Å; H380-Q384 WeakPolarHBondContact O-CG 3.45Å; H380-Q384 PolarHBondContact O-N 2.84Å
385	H	67.4	Low	69	Low	28 Å²	28	96 Å²	96	13%	0.13	44%	0.442	C	S	.	.	I	π-helix	trans	-119.5	-35.1	-168.2	-65.8	-92	0	0	0	114.4	M364 C367 H380 I381 K388	M364-H385 HydrophobicContact CE-CB 3.53Å; M364-H385 WeakPolarHBondContact CE-CD2 3.42Å; M364-H385 HydrophobicContact SD-CB 3.5Å; M364-H385 VanDerWaalsContact SD-CB 3.5Å; M364-H385 VanDerWaalsContact SD-CG 3.5Å; C367-H385 WeakPolarHBondContact CB-NE2 3.37Å; C367-H385 PolarHBondContact SG-NE2 3.47Å; C367-H385 VanDerWaalsContact SG-NE2 3.35Å; H380-H385 AromaticContact NE2-CD2 3.84Å; H380-H385 AromaticContact NE2-NE2 3.59Å; I381-H385 WeakPolarHBondContact O-CB 3.5Å; I381-H385 PolarHBondContact O-N 2.71Å; H385-K388 VanDerWaalsContact O-CD 3.24Å; H385-K388 WeakPolarHBondContact O-CD 3.19Å; H385-K388 WeakPolarHBondContact O-CE 3.28Å; H385-K388 VanDerWaalsContact O-CG 3.24Å; H385-K388 WeakPolarHBondContact O-CG 3.36Å
386	L	66.6	Low	68.4	Low	123 Å²	123	93.3 Å²	93.3	64%	0.644	45%	0.448	S	S	*	.	I	π-helix	trans	-89.1	-35.3	179.5	-60	177	0	0	0	112.8	I381 K382 K388	I381-L386 HydrophobicContact CG2-CD1 3.97Å; I381-L386 HydrophobicContact CG2-CG 4.15Å; I381-L386 PolarHBondContact O-N 3.3Å; K382-L386 PolarHBondContact O-N 3.06Å; L386-K388 PolarHBondContact O-N 3.49Å
387	L	57.7	Low	68.1	Low	79 Å²	79	90.9 Å²	90.9	41%	0.414	45%	0.454	S	S	.	.			trans	-73.6	49.9	167.8	-89.3	80.4	0	0	0	112.3	K382 Y383 K389	K382-L387 HydrophobicContact CG-CD1 3.98Å; K382-L387 WeakPolarHBondContact O-CD1 3.48Å; K382-L387 PolarHBondContact O-N 3.37Å; Y383-L387 HydrophobicContact CD1-CD1 4.35Å; Y383-L387 HydrophobicContact CD1-CD2 3.84Å; Y383-L387 HydrophobicContact CE1-CD2 3.98Å; L387-K389 PolarHBondContact O-N 2.67Å; L387-K389 VanDerWaalsContact O-N 3.14Å
388	K	55.6	Low	67.8	Low	144 Å²	144	91.4 Å²	91.4	63%	0.626	46%	0.459	S	S	*	.			trans	-70.7	3.9	176.1	-98.1	171.3	-173.5	175.7	0	114.4	H385 L386 K390	H385-K388 VanDerWaalsContact O-CD 3.24Å; H385-K388 WeakPolarHBondContact O-CD 3.19Å; H385-K388 WeakPolarHBondContact O-CE 3.28Å; H385-K388 VanDerWaalsContact O-CG 3.24Å; H385-K388 WeakPolarHBondContact O-CG 3.36Å; L386-K388 PolarHBondContact O-N 3.49Å; K388-K390 PolarHBondContact O-N 3.06Å
389	K	51.1	Low	67.5	Low	189 Å²	189	87.4 Å²	87.4	82%	0.822	45%	0.454	S	S	*	.			trans	-71.9	71	163.2	-72.6	-170.5	176.6	-177.6	0	109.6	L387 Y391	L387-K389 PolarHBondContact O-N 2.67Å; L387-K389 VanDerWaalsContact O-N 3.14Å; K389-Y391 PolarHBondContact O-N 3.08Å
390	K	64.9	Low	67.2	Low	119 Å²	119	89.4 Å²	89.4	52%	0.517	46%	0.457	S	S	.	.			trans	-69.9	124.7	-178.7	-58.5	-179.2	-170.5	176.3	0	109.7	K388 V392 L401	K388-K390 PolarHBondContact O-N 3.06Å; K390-V392 PolarHBondContact O-N 2.89Å; K390-V392 VanDerWaalsContact O-N 3.15Å; K390-L401 HydrophobicContact CB-CB 4.48Å; K390-L401 HydrophobicContact CB-CD2 4.2Å; K390-L401 HydrophobicContact CD-CB 4.3Å; K390-L401 HydrophobicContact CD-CD1 3.95Å; K390-L401 HydrophobicContact CD-CD2 4.28Å; K390-L401 HydrophobicContact CD-CG 4.41Å
391	Y	69.6	Low	67.3	Low	90 Å²	90	92.8 Å²	92.8	35%	0.353	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	99.6	172.4	-71.5	-83.8	0	0	0	108.8	K389 F402 Q405 L408	K389-Y391 PolarHBondContact O-N 3.08Å; Y391-F402 PolarHBondContact N-O 3.34Å; Y391-F402 PolarHBondContact O-N 2.95Å; Y391-Q405 HydrophobicContact CD1-CB 3.96Å; Y391-Q405 HydrophobicContact CD1-CG 4.06Å; Y391-Q405 HydrophobicContact CD2-CB 4.39Å; Y391-Q405 HydrophobicContact CE1-CB 3.67Å; Y391-Q405 HydrophobicContact CE1-CG 3.82Å; Y391-Q405 HydrophobicContact CE2-CB 4.13Å; Y391-Q405 HydrophobicContact CG-CB 4.31Å; Y391-L408 HydrophobicContact CD1-CD2 4.29Å
392	V	70.8	Confident	67.4	Low	84 Å²	84	92.1 Å²	92.1	51%	0.509	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.2	139.1	179.6	-164.9	0	0	0	0	109.9	K390 P394 L401 L408	K390-V392 PolarHBondContact O-N 2.89Å; K390-V392 VanDerWaalsContact O-N 3.15Å; V392-P394 WeakPolarHBondContact O-CD 3.22Å; V392-L401 HydrophobicContact CB-CD2 4.2Å; V392-L401 HydrophobicContact CG1-CD2 4.02Å; V392-L401 HydrophobicContact CG2-CD2 3.77Å; V392-L408 WeakPolarHBondContact O-CD2 3.35Å
393	C	77.5	Confident	67.3	Low	7 Å²	7	93 Å²	93	5%	0.047	47%	0.471	C	S	.	.			trans	-65.1	122.2	168.2	-170.9	0	0	0	0	110.4	H395 C398 R400 F402 L408 H411 H415	C393-H395 PolarHBondContact O-N 2.23Å; C393-C398 HydrophobicContact CB-CB 4.36Å; C393-R400 HydrophobicContact CB-CB 4.42Å; C393-R400 WeakPolarHBondContact CB-O 3.37Å; C393-R400 PolarHBondContact N-O 3.39Å; C393-F402 HydrophobicContact CB-CE2 4.39Å; C393-L408 HydrophobicContact CB-CD1 4.3Å; C393-H411 VanDerWaalsContact SG-CD2 3.56Å; C393-H411 PolarHBondContact SG-NE2 3.21Å; C393-H415 VanDerWaalsContact SG-CD2 3.54Å; C393-H415 PolarHBondContact SG-NE2 2.99Å; C393-H415 VanDerWaalsContact SG-NE2 3.37Å
394	P	70.9	Confident	67.8	Low	107 Å²	107	92.3 Å²	92.3	70%	0.695	47%	0.474	S	S	*	.	S	Bend	trans	-71.2	-9.6	178.9	30.2	-35.8	0	0	0	113	V392 P396	V392-P394 WeakPolarHBondContact O-CD 3.22Å; P394-P396 WeakPolarHBondContact O-CD 3.34Å
395	H	69.6	Low	68.4	Low	74 Å²	74	94.6 Å²	94.6	34%	0.343	48%	0.484	S	S	.	.	S	Bend	trans	-74.6	117.5	177	-161.4	-91.9	0	0	0	110.7	C393 S397 C398 H415	C393-H395 PolarHBondContact O-N 2.23Å; H395-S397 VanDerWaalsContact C-N 3.31Å; H395-S397 PolarHBondContact CE1-OG 3.15Å; H395-S397 PolarHBondContact ND1-OG 2.78Å; H395-S397 PolarHBondContact O-N 3.14Å; H395-C398 HydrophobicContact CB-CB 4.1Å; H395-C398 WeakPolarHBondContact O-CB 3.4Å; H395-C398 PolarHBondContact O-N 2.89Å; H395-H415 HydrophobicContact CB-CB 4.32Å; H395-H415 AromaticContact CD2-CG 3.96Å; H395-H415 AromaticContact CG-CG 3.68Å; H395-H415 AromaticContact CG-ND1 3.62Å; H395-H415 AromaticContact ND1-ND1 3.72Å
396	P	64.8	Low	69	Low	127 Å²	127	101.7 Å²	101.7	83%	0.825	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.5	-30.3	-164.2	23.9	-34.3	0	0	0	113.8	P394 C398	P394-P396 WeakPolarHBondContact O-CD 3.34Å; P396-C398 VanDerWaalsContact C-N 3.29Å; P396-C398 PolarHBondContact O-N 3.49Å
397	S	68.8	Low	69.5	Low	104 Å²	104	99.6 Å²	99.6	73%	0.727	50%	0.501	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.7	-4.7	176.4	65.2	0	0	0	0	114.5	H395	H395-S397 VanDerWaalsContact C-N 3.31Å; H395-S397 PolarHBondContact CE1-OG 3.15Å; H395-S397 PolarHBondContact ND1-OG 2.78Å; H395-S397 PolarHBondContact O-N 3.14Å
398	C	71.9	Confident	70.5	Confident	31 Å²	31	97.1 Å²	97.1	21%	0.209	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.6	-43.3	-169	-163.6	0	0	0	0	114.4	C393 H395 P396 R400 H411 H415	C393-C398 HydrophobicContact CB-CB 4.36Å; H395-C398 HydrophobicContact CB-CB 4.1Å; H395-C398 WeakPolarHBondContact O-CB 3.4Å; H395-C398 PolarHBondContact O-N 2.89Å; P396-C398 VanDerWaalsContact C-N 3.29Å; P396-C398 PolarHBondContact O-N 3.49Å; C398-R400 PolarHBondContact O-N 2.9Å; C398-H411 PolarHBondContact SG-NE2 2.93Å; C398-H415 PolarHBondContact SG-CE1 3.19Å; C398-H415 PolarHBondContact SG-NE2 3.48Å
399	G	63.2	Low	71.6	Confident	52 Å²	52	95.8 Å²	95.8	54%	0.536	49%	0.488	S	S	.	.			trans	59.2	2.4	176.5	0	0	0	0	0	117.1
400	R	70	Confident	72.9	Confident	154 Å²	154	95.6 Å²	95.6	58%	0.581	48%	0.482	S	S	*	.			trans	-67.9	141.5	-174.1	-71.4	-176.5	-174.6	-167.4	1.8	112	C393 C398 F402	C393-R400 HydrophobicContact CB-CB 4.42Å; C393-R400 WeakPolarHBondContact CB-O 3.37Å; C393-R400 PolarHBondContact N-O 3.39Å; C398-R400 PolarHBondContact O-N 2.9Å; R400-F402 HydrophobicContact CB-CE2 3.55Å; R400-F402 HydrophobicContact CB-CZ 3.67Å
401	L	75.2	Confident	73.5	Confident	95 Å²	95	90.9 Å²	90.9	50%	0.497	46%	0.461	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	122.3	-174.1	-61.1	168	0	0	0	109.7	K390 V392	K390-L401 HydrophobicContact CB-CB 4.48Å; K390-L401 HydrophobicContact CB-CD2 4.2Å; K390-L401 HydrophobicContact CD-CB 4.3Å; K390-L401 HydrophobicContact CD-CD1 3.95Å; K390-L401 HydrophobicContact CD-CD2 4.28Å; K390-L401 HydrophobicContact CD-CG 4.41Å; V392-L401 HydrophobicContact CB-CD2 4.2Å; V392-L401 HydrophobicContact CG1-CD2 4.02Å; V392-L401 HydrophobicContact CG2-CD2 3.77Å
402	F	77.1	Confident	73.7	Confident	35 Å²	35	87.9 Å²	87.9	15%	0.154	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	144.8	-176.8	-61.6	-83	0	0	0	111.7	Y391 C393 R400 Q407 L408 H411	Y391-F402 PolarHBondContact N-O 3.34Å; Y391-F402 PolarHBondContact O-N 2.95Å; C393-F402 HydrophobicContact CB-CE2 4.39Å; R400-F402 HydrophobicContact CB-CE2 3.55Å; R400-F402 HydrophobicContact CB-CZ 3.67Å; F402-Q407 HydrophobicContact CB-CB 4.13Å; F402-Q407 HydrophobicContact CD1-CB 3.82Å; F402-Q407 HydrophobicContact CG-CB 4.28Å; F402-L408 HydrophobicContact CB-CB 4.12Å; F402-L408 HydrophobicContact CD2-CB 4.02Å; F402-L408 HydrophobicContact CD2-CD1 3.98Å; F402-L408 HydrophobicContact CE2-CD1 4.33Å; F402-L408 HydrophobicContact CG-CB 4.2Å; F402-H411 HydrophobicContact CE1-CB 3.89Å; F402-H411 HydrophobicContact CE2-CB 3.9Å; F402-H411 AromaticContact CE2-CD2 3.21Å; F402-H411 WeakPolarHBondContact CE2-CD2 3.46Å; F402-H411 AromaticContact CE2-CG 3.66Å; F402-H411 HydrophobicContact CZ-CB 3.46Å; F402-H411 VanDerWaalsContact CZ-CB 3.46Å; F402-H411 AromaticContact CZ-CD2 3.25Å; F402-H411 WeakPolarHBondContact CZ-CD2 3.46Å; F402-H411 AromaticContact CZ-CG 3.23Å; F402-H411 AromaticContact CZ-ND1 3.95Å; F402-H411 AromaticContact CZ-NE2 3.94Å
403	R	69.9	Low	73.8	Confident	133 Å²	133	91 Å²	91	50%	0.502	46%	0.462	S	S	.	.	S	Bend	trans	-80.3	-28	178.9	-59.1	-174.4	-170.5	96	-0.7	112
404	L	77.9	Confident	73.4	Confident	85 Å²	85	96.4 Å²	96.4	45%	0.445	49%	0.486	S	S	.	.	S	Bend	trans	-124.6	141.4	179.3	-75.2	72.7	0	0	0	111	K406 Q407 L408	L404-K406 VanDerWaalsContact C-N 3.26Å; L404-K406 PolarHBondContact O-N 3.1Å; L404-Q407 HydrophobicContact CB-CB 4.49Å; L404-Q407 HydrophobicContact CB-CG 4.08Å; L404-Q407 WeakPolarHBondContact O-CA 3.37Å; L404-Q407 WeakPolarHBondContact O-CB 3.37Å; L404-Q407 PolarHBondContact O-N 2.91Å; L404-L408 PolarHBondContact O-N 2.97Å; L404-L408 VanDerWaalsContact O-N 3.15Å
405	Q	76.4	Confident	73.4	Confident	126 Å²	126	94.1 Å²	94.1	59%	0.589	47%	0.467	S	S	*	.	H	α-helix	trans	-56.8	-38.1	173.7	-166.8	-179.6	2.2	0	0	112.4	Y391 Q407 L408 L409	Y391-Q405 HydrophobicContact CD1-CB 3.96Å; Y391-Q405 HydrophobicContact CD1-CG 4.06Å; Y391-Q405 HydrophobicContact CD2-CB 4.39Å; Y391-Q405 HydrophobicContact CE1-CB 3.67Å; Y391-Q405 HydrophobicContact CE1-CG 3.82Å; Y391-Q405 HydrophobicContact CE2-CB 4.13Å; Y391-Q405 HydrophobicContact CG-CB 4.31Å; Q405-Q407 PolarHBondContact O-N 2.79Å; Q405-L408 PolarHBondContact O-N 3.25Å; Q405-L409 WeakPolarHBondContact O-CB 3.42Å; Q405-L409 PolarHBondContact O-N 3.36Å
406	K	78.6	Confident	73.3	Confident	177 Å²	177	93.7 Å²	93.7	77%	0.77	47%	0.469	S	S	*	.	H	α-helix	trans	-59.4	-31	174.6	-65.7	-174.4	178.7	-177.4	0	112.7	L404 R410	L404-K406 VanDerWaalsContact C-N 3.26Å; L404-K406 PolarHBondContact O-N 3.1Å; K406-R410 WeakPolarHBondContact O-CB 3.34Å; K406-R410 PolarHBondContact O-N 3.27Å
407	Q	77.3	Confident	73.3	Confident	79 Å²	79	92 Å²	92	37%	0.369	45%	0.453	S	S	.	.	H	α-helix	trans	-77.8	-42.3	175.6	-64.8	169.5	-16.2	0	0	111.4	F402 L404 Q405 L409 R410 H411	F402-Q407 HydrophobicContact CB-CB 4.13Å; F402-Q407 HydrophobicContact CD1-CB 3.82Å; F402-Q407 HydrophobicContact CG-CB 4.28Å; L404-Q407 HydrophobicContact CB-CB 4.49Å; L404-Q407 HydrophobicContact CB-CG 4.08Å; L404-Q407 WeakPolarHBondContact O-CA 3.37Å; L404-Q407 WeakPolarHBondContact O-CB 3.37Å; L404-Q407 PolarHBondContact O-N 2.91Å; Q405-Q407 PolarHBondContact O-N 2.79Å; Q407-L409 PolarHBondContact O-N 3.38Å; Q407-R410 PolarHBondContact O-N 2.7Å; Q407-H411 WeakPolarHBondContact O-CB 3.17Å; Q407-H411 PolarHBondContact O-N 3.43Å
408	L	80.1	Confident	72.9	Confident	27 Å²	27	93 Å²	93	14%	0.141	45%	0.446	C	S	.	.	H	α-helix	trans	-57.7	-47.9	171.7	168.8	61	0	0	0	110.9	Y391 V392 C393 F402 L404 Q405 R410 H411 A412	Y391-L408 HydrophobicContact CD1-CD2 4.29Å; V392-L408 WeakPolarHBondContact O-CD2 3.35Å; C393-L408 HydrophobicContact CB-CD1 4.3Å; F402-L408 HydrophobicContact CB-CB 4.12Å; F402-L408 HydrophobicContact CD2-CB 4.02Å; F402-L408 HydrophobicContact CD2-CD1 3.98Å; F402-L408 HydrophobicContact CE2-CD1 4.33Å; F402-L408 HydrophobicContact CG-CB 4.2Å; L404-L408 PolarHBondContact O-N 2.97Å; L404-L408 VanDerWaalsContact O-N 3.15Å; Q405-L408 PolarHBondContact O-N 3.25Å; L408-R410 PolarHBondContact O-N 3Å; L408-H411 CarbonylContact O-C 3.59Å; L408-H411 WeakPolarHBondContact O-CA 3.33Å; L408-H411 WeakPolarHBondContact O-CB 3.09Å; L408-H411 PolarHBondContact O-N 3.37Å; L408-H411 VanDerWaalsContact O-N 3.07Å; L408-A412 WeakPolarHBondContact O-CB 3.44Å; L408-A412 PolarHBondContact O-N 2.94Å
409	L	78.5	Confident	72.9	Confident	116 Å²	116	96.9 Å²	96.9	61%	0.607	46%	0.456	S	S	*	.	H	α-helix	trans	-65.1	-40	-176.9	-166.1	67.9	0	0	0	111.7	Q405 Q407 H411 A412 K413	Q405-L409 WeakPolarHBondContact O-CB 3.42Å; Q405-L409 PolarHBondContact O-N 3.36Å; Q407-L409 PolarHBondContact O-N 3.38Å; L409-H411 VanDerWaalsContact C-N 3.33Å; L409-H411 PolarHBondContact O-N 3.21Å; L409-A412 PolarHBondContact O-N 3.03Å; L409-K413 PolarHBondContact O-N 2.96Å
410	R	77.8	Confident	73.6	Confident	186 Å²	186	99.9 Å²	99.9	70%	0.702	46%	0.46	S	S	*	.	H	α-helix	trans	-60.4	-42.3	170.4	-171.7	-170	-63.8	-178.3	-2.4	111.4	K406 Q407 L408 K413 H414	K406-R410 WeakPolarHBondContact O-CB 3.34Å; K406-R410 PolarHBondContact O-N 3.27Å; Q407-R410 PolarHBondContact O-N 2.7Å; L408-R410 PolarHBondContact O-N 3Å; R410-K413 PolarHBondContact O-N 3.05Å; R410-H414 PolarHBondContact O-CD2 3.37Å
411	H	78.4	Confident	74.2	Confident	19 Å²	19	97 Å²	97	9%	0.088	45%	0.45	C	S	.	.	H	α-helix	trans	-69.7	-38.9	179	174.8	57.7	0	0	0	113.2	C393 C398 F402 Q407 L408 L409 K413 H414 H415	C393-H411 VanDerWaalsContact SG-CD2 3.56Å; C393-H411 PolarHBondContact SG-NE2 3.21Å; C398-H411 PolarHBondContact SG-NE2 2.93Å; F402-H411 HydrophobicContact CE1-CB 3.89Å; F402-H411 HydrophobicContact CE2-CB 3.9Å; F402-H411 AromaticContact CE2-CD2 3.21Å; F402-H411 WeakPolarHBondContact CE2-CD2 3.46Å; F402-H411 AromaticContact CE2-CG 3.66Å; F402-H411 HydrophobicContact CZ-CB 3.46Å; F402-H411 VanDerWaalsContact CZ-CB 3.46Å; F402-H411 AromaticContact CZ-CD2 3.25Å; F402-H411 WeakPolarHBondContact CZ-CD2 3.46Å; F402-H411 AromaticContact CZ-CG 3.23Å; F402-H411 AromaticContact CZ-ND1 3.95Å; F402-H411 AromaticContact CZ-NE2 3.94Å; Q407-H411 WeakPolarHBondContact O-CB 3.17Å; Q407-H411 PolarHBondContact O-N 3.43Å; L408-H411 CarbonylContact O-C 3.59Å; L408-H411 WeakPolarHBondContact O-CA 3.33Å; L408-H411 WeakPolarHBondContact O-CB 3.09Å; L408-H411 PolarHBondContact O-N 3.37Å; L408-H411 VanDerWaalsContact O-N 3.07Å; L409-H411 VanDerWaalsContact C-N 3.33Å; L409-H411 PolarHBondContact O-N 3.21Å; H411-K413 PolarHBondContact O-N 3.03Å; H411-H414 WeakPolarHBondContact O-CB 3.46Å; H411-H414 PolarHBondContact O-N 3.27Å; H411-H415 AromaticContact CD2-NE2 3.79Å; H411-H415 AromaticContact CE1-CE1 3.98Å; H411-H415 AromaticContact CE1-NE2 3.25Å; H411-H415 PolarHBondContact CE1-NE2 2.91Å; H411-H415 AromaticContact NE2-CD2 3.77Å; H411-H415 AromaticContact NE2-CE1 3.94Å; H411-H415 AromaticContact NE2-NE2 2.94Å; H411-H415 PolarHBondContact NE2-NE2 3.24Å
412	A	72.9	Confident	74.6	Confident	28 Å²	28	97.2 Å²	97.2	23%	0.231	45%	0.451	C	S	.	.	H	α-helix	trans	-58.1	-35.2	176.7	0	0	0	0	0	111.6	L408 L409 H414 H415 T416	L408-A412 WeakPolarHBondContact O-CB 3.44Å; L408-A412 PolarHBondContact O-N 2.94Å; L409-A412 PolarHBondContact O-N 3.03Å; A412-H414 PolarHBondContact O-N 3.31Å; A412-H414 VanDerWaalsContact O-N 3.08Å; A412-H415 PolarHBondContact O-N 2.88Å; A412-T416 PolarHBondContact O-N 2.85Å; A412-T416 VanDerWaalsContact O-N 3.14Å; A412-T416 PolarHBondContact O-OG1 3.1Å
413	K	73.6	Confident	75.2	Confident	149 Å²	149	95.6 Å²	95.6	65%	0.648	44%	0.443	S	S	*	.	H	α-helix	trans	-60.5	-12.6	172.3	-69.8	-169.6	175.6	-161.6	0	115.1	L409 R410 H411 T416	L409-K413 PolarHBondContact O-N 2.96Å; R410-K413 PolarHBondContact O-N 3.05Å; H411-K413 PolarHBondContact O-N 3.03Å; K413-T416 WeakPolarHBondContact CA-OG1 3.22Å; K413-T416 VanDerWaalsContact O-O 3.13Å; K413-T416 PolarHBondContact O-OG1 2.8Å
414	H	69	Low	76	Confident	120 Å²	120	96 Å²	96	56%	0.556	45%	0.451	S	S	*	.	H	α-helix	trans	-83.8	-30.8	170.6	-68.9	-101.5	0	0	0	112.8	R410 H411 A412 K431	R410-H414 PolarHBondContact O-CD2 3.37Å; H411-H414 WeakPolarHBondContact O-CB 3.46Å; H411-H414 PolarHBondContact O-N 3.27Å; A412-H414 PolarHBondContact O-N 3.31Å; A412-H414 VanDerWaalsContact O-N 3.08Å; H414-K431 PolarHBondContact O-NZ 3.46Å; H414-K431 VanDerWaalsContact O-NZ 3.09Å
415	H	71	Confident	76.3	Confident	60 Å²	60	97.8 Å²	97.8	28%	0.278	46%	0.455	S	S	.	.	H	α-helix	trans	-80.5	-33.7	178	-62.6	-60.7	0	0	0	112.4	C393 H395 C398 H411 A412 D417	C393-H415 VanDerWaalsContact SG-CD2 3.54Å; C393-H415 PolarHBondContact SG-NE2 2.99Å; C393-H415 VanDerWaalsContact SG-NE2 3.37Å; H395-H415 HydrophobicContact CB-CB 4.32Å; H395-H415 AromaticContact CD2-CG 3.96Å; H395-H415 AromaticContact CG-CG 3.68Å; H395-H415 AromaticContact CG-ND1 3.62Å; H395-H415 AromaticContact ND1-ND1 3.72Å; C398-H415 PolarHBondContact SG-CE1 3.19Å; C398-H415 PolarHBondContact SG-NE2 3.48Å; H411-H415 AromaticContact CD2-NE2 3.79Å; H411-H415 AromaticContact CE1-CE1 3.98Å; H411-H415 AromaticContact CE1-NE2 3.25Å; H411-H415 PolarHBondContact CE1-NE2 2.91Å; H411-H415 AromaticContact NE2-CD2 3.77Å; H411-H415 AromaticContact NE2-CE1 3.94Å; H411-H415 AromaticContact NE2-NE2 2.94Å; H411-H415 PolarHBondContact NE2-NE2 3.24Å; A412-H415 PolarHBondContact O-N 2.88Å; H415-D417 PolarHBondContact O-N 3.29Å
416	T	66.3	Low	76.8	Confident	65 Å²	65	94.3 Å²	94.3	40%	0.399	45%	0.445	S	S	.	.	S	Bend	trans	-69.3	100.3	161.4	55.3	0	0	0	0	107.7	A412 K413 Q418	A412-T416 PolarHBondContact O-N 2.85Å; A412-T416 VanDerWaalsContact O-N 3.14Å; A412-T416 PolarHBondContact O-OG1 3.1Å; K413-T416 WeakPolarHBondContact CA-OG1 3.22Å; K413-T416 VanDerWaalsContact O-O 3.13Å; K413-T416 PolarHBondContact O-OG1 2.8Å; T416-Q418 PolarHBondContact O-N 3.14Å
417	D	64.5	Low	77.2	Confident	90 Å²	90	89.7 Å²	89.7	48%	0.481	44%	0.439	S	S	.	.			trans	-72.5	40.5	173.6	-110.9	-64.8	0	0	0	112.4	H415 R419 K431	H415-D417 PolarHBondContact O-N 3.29Å; D417-R419 WeakPolarHBondContact O-CG 3.29Å; D417-R419 PolarHBondContact O-N 2.86Å; D417-R419 IonicContact OD1-CZ 3.43Å; D417-R419 IonicContact OD1-NE 2.7Å; D417-R419 PolarHBondContact OD1-NE 2.96Å; D417-R419 IonicContact OD1-NH2 2.67Å; D417-R419 PolarHBondContact OD1-NH2 3.22Å; D417-K431 VanDerWaalsContact CG-NZ 3.27Å; D417-K431 WeakPolarHBondContact OD1-CE 3.29Å; D417-K431 IonicContact OD1-NZ 2.88Å; D417-K431 PolarHBondContact OD1-NZ 3.37Å; D417-K431 IonicContact OD2-NZ 3.52Å
418	Q	61.9	Low	77.5	Confident	125 Å²	125	93.6 Å²	93.6	58%	0.584	45%	0.451	S	S	*	.			trans	-59.8	116.4	168.2	-78.6	178.9	-35.4	0	0	108.4	T416 K431	T416-Q418 PolarHBondContact O-N 3.14Å; Q418-K431 WeakPolarHBondContact O-CG 3.38Å
419	R	71.8	Confident	77.7	Confident	113 Å²	113	93.5 Å²	93.5	43%	0.426	45%	0.454	S	S	.	.			trans	-131.9	58.3	-170.1	-77.1	168.9	177	-111.6	7.6	108.2	D417 Y421 A429 F430 K431	D417-R419 WeakPolarHBondContact O-CG 3.29Å; D417-R419 PolarHBondContact O-N 2.86Å; D417-R419 IonicContact OD1-CZ 3.43Å; D417-R419 IonicContact OD1-NE 2.7Å; D417-R419 PolarHBondContact OD1-NE 2.96Å; D417-R419 IonicContact OD1-NH2 2.67Å; D417-R419 PolarHBondContact OD1-NH2 3.22Å; R419-Y421 PolarHBondContact O-N 2.85Å; R419-A429 HydrophobicContact CB-CB 3.6Å; R419-A429 WeakPolarHBondContact CD-O 3.33Å; R419-A429 HydrophobicContact CG-CB 4.49Å; R419-A429 PolarHBondContact NH1-O 3.44Å; R419-F430 CarbonylContact C-O 3.53Å; R419-F430 WeakPolarHBondContact CA-O 3.32Å; R419-K431 HydrophobicContact CG-CG 3.81Å
420	D	77.9	Confident	77.9	Confident	115 Å²	115	89.6 Å²	89.6	62%	0.615	43%	0.432	S	S	*	.			trans	-65.5	-12.2	-165.2	-39.9	-38.8	0	0	0	112.9	F430	D420-F430 PolarHBondContact N-O 3.41Å
421	Y	81.7	Confident	78.1	Confident	95 Å²	95	84.8 Å²	84.8	37%	0.373	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	89.8	-177.7	-56	-84	0	0	0	110.6	R419 F430 S432	R419-Y421 PolarHBondContact O-N 2.85Å; Y421-F430 WeakPolarHBondContact CB-O 3.42Å; Y421-F430 PolarHBondContact N-O 3.32Å; Y421-F430 PolarHBondContact O-N 2.81Å; Y421-S432 VanDerWaalsContact CD2-C 3.44Å; Y421-S432 VanDerWaalsContact CD2-CA 3.48Å
422	I	84.9	Confident	78.4	Confident	99 Å²	99	85.7 Å²	85.7	51%	0.508	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	140.9	-179.1	-56.9	177.3	0	0	0	110.8	A429 L436	I422-A429 HydrophobicContact CG1-CB 4.14Å; I422-L436 WeakPolarHBondContact O-CD2 3.17Å
423	C	89.7	Confident	79	Confident	0 Å²	0	87.6 Å²	87.6	0%	0	44%	0.436	C	S	.	.			trans	-85.2	117.2	172.3	-171.7	0	0	0	0	112.1	F425 C426 A427 R428 F430 L436 H439 H443	C423-F425 PolarHBondContact O-N 3.23Å; C423-C426 PolarHBondContact O-N 2.96Å; C423-A427 VanDerWaalsContact O-CA 3.25Å; C423-A427 WeakPolarHBondContact O-CA 3.47Å; C423-A427 PolarHBondContact O-N 3.48Å; C423-R428 WeakPolarHBondContact CB-O 3.24Å; C423-R428 PolarHBondContact N-O 3.4Å; C423-F430 HydrophobicContact CB-CE2 4.32Å; C423-L436 HydrophobicContact CB-CD1 3.63Å; C423-H439 PolarHBondContact SG-CD2 2.83Å; C423-H443 PolarHBondContact SG-NE2 2.79Å
424	E	86.1	Confident	79.6	Confident	141 Å²	141	86.4 Å²	86.4	66%	0.659	43%	0.433	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.3	-35.2	176.2	-71.8	137.7	-145.3	0	0	113.5	R440	E424-R440 VanDerWaalsContact CD-NH1 3.32Å; E424-R440 VanDerWaalsContact CD-NH2 3.27Å; E424-R440 IonicContact OE1-CZ 3.18Å; E424-R440 IonicContact OE1-NH1 3.3Å; E424-R440 PolarHBondContact OE1-NH1 3.18Å; E424-R440 IonicContact OE1-NH2 2.79Å; E424-R440 PolarHBondContact OE1-NH2 2.89Å; E424-R440 IonicContact OE2-CZ 3Å; E424-R440 IonicContact OE2-NH1 2.71Å; E424-R440 PolarHBondContact OE2-NH1 2.79Å; E424-R440 IonicContact OE2-NH2 3.44Å; E424-R440 PolarHBondContact OE2-NH2 2.95Å
425	F	84.5	Confident	80.4	Confident	123 Å²	123	84.7 Å²	84.7	54%	0.539	43%	0.428	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-17.8	-174.8	-58.8	-70.6	0	0	0	115.1	C423 H443	C423-F425 PolarHBondContact O-N 3.23Å; F425-H443 HydrophobicContact CB-CB 4.3Å; F425-H443 HydrophobicContact CD2-CB 3.92Å; F425-H443 AromaticContact CD2-CD2 3.9Å; F425-H443 AromaticContact CD2-CG 3.92Å; F425-H443 HydrophobicContact CE2-CB 4.46Å; F425-H443 HydrophobicContact CG-CB 4.07Å; F425-H443 AromaticContact CG-CG 3.93Å
426	C	87.4	Confident	81.2	Confident	54 Å²	54	82.5 Å²	82.5	37%	0.365	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-152.8	13.9	-175.3	67.3	0	0	0	0	115.4	C423 R428 H439 H443	C423-C426 PolarHBondContact O-N 2.96Å; C426-R428 PolarHBondContact O-N 3.45Å; C426-R428 VanDerWaalsContact SG-CB 3.56Å; C426-H439 PolarHBondContact SG-NE2 3.12Å; C426-H443 WeakPolarHBondContact CB-CE1 3.45Å; C426-H443 PolarHBondContact SG-CE1 2.91Å; C426-H443 PolarHBondContact SG-NE2 3.34Å
427	A	85.4	Confident	82.2	Confident	79 Å²	79	81.9 Å²	81.9	65%	0.653	42%	0.42	S	S	*	.			trans	54	7.8	-175.9	0	0	0	0	0	116.2	C423 A429	C423-A427 VanDerWaalsContact O-CA 3.25Å; C423-A427 WeakPolarHBondContact O-CA 3.47Å; C423-A427 PolarHBondContact O-N 3.48Å; A427-A429 PolarHBondContact O-N 3.31Å
428	R	83.8	Confident	83.2	Confident	161 Å²	161	78.5 Å²	78.5	61%	0.608	40%	0.402	S	S	*	.			trans	-71.5	126.4	-176.7	-165.7	169.1	-176.7	166.6	-0.8	110.5	C423 C426 F430	C423-R428 WeakPolarHBondContact CB-O 3.24Å; C423-R428 PolarHBondContact N-O 3.4Å; C426-R428 PolarHBondContact O-N 3.45Å; C426-R428 VanDerWaalsContact SG-CB 3.56Å; R428-F430 HydrophobicContact CB-CE2 3.99Å; R428-F430 HydrophobicContact CB-CZ 4.29Å; R428-F430 HydrophobicContact CG-CE2 3.97Å; R428-F430 HydrophobicContact CG-CZ 3.86Å; R428-F430 VanDerWaalsContact O-CD2 3.28Å; R428-F430 WeakPolarHBondContact O-CD2 3.26Å; R428-F430 WeakPolarHBondContact O-CE2 3.21Å
429	A	83.7	Confident	84.5	Confident	26 Å²	26	73.4 Å²	73.4	22%	0.215	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	134.3	-170.5	0	0	0	0	0	112.8	R419 I422 A427	R419-A429 HydrophobicContact CB-CB 3.6Å; R419-A429 WeakPolarHBondContact CD-O 3.33Å; R419-A429 HydrophobicContact CG-CB 4.49Å; R419-A429 PolarHBondContact NH1-O 3.44Å; I422-A429 HydrophobicContact CG1-CB 4.14Å; A427-A429 PolarHBondContact O-N 3.31Å
430	F	84.3	Confident	85.2	Confident	33 Å²	33	71.5 Å²	71.5	15%	0.145	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	150.9	-173.3	-62.6	-89.6	0	0	0	112.5	R419 D420 Y421 C423 R428 S432 N435 L436 H439	R419-F430 CarbonylContact C-O 3.53Å; R419-F430 WeakPolarHBondContact CA-O 3.32Å; D420-F430 PolarHBondContact N-O 3.41Å; Y421-F430 WeakPolarHBondContact CB-O 3.42Å; Y421-F430 PolarHBondContact N-O 3.32Å; Y421-F430 PolarHBondContact O-N 2.81Å; C423-F430 HydrophobicContact CB-CE2 4.32Å; R428-F430 HydrophobicContact CB-CE2 3.99Å; R428-F430 HydrophobicContact CB-CZ 4.29Å; R428-F430 HydrophobicContact CG-CE2 3.97Å; R428-F430 HydrophobicContact CG-CZ 3.86Å; R428-F430 VanDerWaalsContact O-CD2 3.28Å; R428-F430 WeakPolarHBondContact O-CD2 3.26Å; R428-F430 WeakPolarHBondContact O-CE2 3.21Å; F430-S432 VanDerWaalsContact C-N 3.29Å; F430-S432 PolarHBondContact O-N 3.18Å; F430-N435 HydrophobicContact CB-CB 4.34Å; F430-N435 HydrophobicContact CD1-CB 4.13Å; F430-L436 HydrophobicContact CB-CB 4.39Å; F430-L436 HydrophobicContact CD2-CB 4.24Å; F430-L436 HydrophobicContact CD2-CD1 4.08Å; F430-L436 HydrophobicContact CE2-CD1 4.37Å; F430-L436 HydrophobicContact CG-CB 4.49Å; F430-H439 HydrophobicContact CE1-CB 4.04Å; F430-H439 HydrophobicContact CE2-CB 3.89Å; F430-H439 AromaticContact CE2-CD2 3.36Å; F430-H439 WeakPolarHBondContact CE2-CD2 3.45Å; F430-H439 AromaticContact CE2-CG 3.59Å; F430-H439 HydrophobicContact CZ-CB 3.53Å; F430-H439 AromaticContact CZ-CD2 3.48Å; F430-H439 VanDerWaalsContact CZ-CD2 3.48Å; F430-H439 WeakPolarHBondContact CZ-CD2 3.5Å; F430-H439 AromaticContact CZ-CG 3.23Å; F430-H439 AromaticContact CZ-ND1 3.69Å
431	K	81.9	Confident	85.6	Confident	85 Å²	85	67.6 Å²	67.6	37%	0.37	35%	0.349	S	S	.	.	S	Bend	trans	-82.1	3.9	179.1	-52.2	-162.4	-179.8	-168.6	0	114.5	H414 D417 Q418 R419	H414-K431 PolarHBondContact O-NZ 3.46Å; H414-K431 VanDerWaalsContact O-NZ 3.09Å; D417-K431 VanDerWaalsContact CG-NZ 3.27Å; D417-K431 WeakPolarHBondContact OD1-CE 3.29Å; D417-K431 IonicContact OD1-NZ 2.88Å; D417-K431 PolarHBondContact OD1-NZ 3.37Å; D417-K431 IonicContact OD2-NZ 3.52Å; Q418-K431 WeakPolarHBondContact O-CG 3.38Å; R419-K431 HydrophobicContact CG-CG 3.81Å
432	S	83.9	Confident	85.8	Confident	38 Å²	38	66.8 Å²	66.8	27%	0.266	35%	0.351	S	S	.	.	S	Bend	trans	-158.9	142.1	-177.3	172.7	0	0	0	0	111.6	Y421 F430 H434 N435 L436	Y421-S432 VanDerWaalsContact CD2-C 3.44Å; Y421-S432 VanDerWaalsContact CD2-CA 3.48Å; F430-S432 VanDerWaalsContact C-N 3.29Å; F430-S432 PolarHBondContact O-N 3.18Å; S432-H434 VanDerWaalsContact C-N 3.28Å; S432-H434 PolarHBondContact O-N 3.24Å; S432-H434 PolarHBondContact OG-N 2.87Å; S432-N435 PolarHBondContact O-N 2.89Å; S432-L436 PolarHBondContact O-N 3.17Å
433	S	85.9	Confident	85.8	Confident	68 Å²	68	66.3 Å²	66.3	48%	0.476	35%	0.346	S	S	.	.	H	α-helix	trans	-58.4	-37.3	173.2	52.4	0	0	0	0	112.6	L436 A437	S433-L436 PolarHBondContact O-N 2.97Å; S433-A437 WeakPolarHBondContact O-CB 3.32Å; S433-A437 PolarHBondContact O-N 3.21Å
434	H	86.4	Confident	85.5	Confident	124 Å²	124	69.9 Å²	69.9	57%	0.574	37%	0.368	S	S	*	.	H	α-helix	trans	-62.3	-44.6	176.2	-178.9	76	0	0	0	111.4	S432 L436 A437 V438	S432-H434 VanDerWaalsContact C-N 3.28Å; S432-H434 PolarHBondContact O-N 3.24Å; S432-H434 PolarHBondContact OG-N 2.87Å; H434-L436 VanDerWaalsContact C-N 3.32Å; H434-L436 PolarHBondContact O-N 2.72Å; H434-A437 PolarHBondContact O-N 3.07Å; H434-V438 WeakPolarHBondContact O-CB 3.29Å; H434-V438 WeakPolarHBondContact O-CG2 3.29Å; H434-V438 PolarHBondContact O-N 2.82Å
435	N	85.7	Confident	85.3	Confident	85 Å²	85	65.1 Å²	65.1	46%	0.455	36%	0.357	S	S	.	.	H	α-helix	trans	-67.5	-35.8	179.5	-65.2	11.9	0	0	0	111.1	F430 S432 H439	F430-N435 HydrophobicContact CB-CB 4.34Å; F430-N435 HydrophobicContact CD1-CB 4.13Å; S432-N435 PolarHBondContact O-N 2.89Å; N435-H439 VanDerWaalsContact O-CB 3.29Å; N435-H439 WeakPolarHBondContact O-CB 3.26Å; N435-H439 PolarHBondContact O-N 3.4Å
436	L	88.5	Confident	85.1	Confident	14 Å²	14	64.7 Å²	64.7	7%	0.073	36%	0.357	C	S	.	.	H	α-helix	trans	-64.8	-45.6	171	172.2	59.5	0	0	0	112	I422 C423 F430 S432 S433 H434 V438 H439 R440	I422-L436 WeakPolarHBondContact O-CD2 3.17Å; C423-L436 HydrophobicContact CB-CD1 3.63Å; F430-L436 HydrophobicContact CB-CB 4.39Å; F430-L436 HydrophobicContact CD2-CB 4.24Å; F430-L436 HydrophobicContact CD2-CD1 4.08Å; F430-L436 HydrophobicContact CE2-CD1 4.37Å; F430-L436 HydrophobicContact CG-CB 4.49Å; S432-L436 PolarHBondContact O-N 3.17Å; S433-L436 PolarHBondContact O-N 2.97Å; H434-L436 VanDerWaalsContact C-N 3.32Å; H434-L436 PolarHBondContact O-N 2.72Å; L436-V438 PolarHBondContact O-N 3.39Å; L436-H439 CarbonylContact O-C 3.17Å; L436-H439 WeakPolarHBondContact O-CA 3.23Å; L436-H439 WeakPolarHBondContact O-CB 2.9Å; L436-H439 PolarHBondContact O-N 2.78Å; L436-H439 VanDerWaalsContact O-N 3.1Å; L436-R440 HydrophobicContact CD1-CG 4.26Å; L436-R440 WeakPolarHBondContact O-CG 3.2Å; L436-R440 PolarHBondContact O-N 3.28Å
437	A	86.3	Confident	84.8	Confident	52 Å²	52	66.1 Å²	66.1	43%	0.43	36%	0.357	S	S	.	.	H	α-helix	trans	-62.1	-43.4	178.1	0	0	0	0	0	111.9	S433 H434 H439 R440 M441	S433-A437 WeakPolarHBondContact O-CB 3.32Å; S433-A437 PolarHBondContact O-N 3.21Å; H434-A437 PolarHBondContact O-N 3.07Å; A437-H439 VanDerWaalsContact C-N 3.25Å; A437-H439 PolarHBondContact O-N 3.4Å; A437-R440 PolarHBondContact O-N 3.45Å; A437-R440 VanDerWaalsContact O-N 3.14Å; A437-M441 PolarHBondContact O-N 3.32Å
438	V	86.3	Confident	84.5	Confident	19 Å²	19	66.7 Å²	66.7	12%	0.115	35%	0.354	C	S	.	.	H	α-helix	trans	-63.1	-31.8	173.2	169.4	0	0	0	0	112.2	H434 L436 M441 Q460	H434-V438 WeakPolarHBondContact O-CB 3.29Å; H434-V438 WeakPolarHBondContact O-CG2 3.29Å; H434-V438 PolarHBondContact O-N 2.82Å; L436-V438 PolarHBondContact O-N 3.39Å; V438-M441 HydrophobicContact CB-CE 4.3Å; V438-M441 HydrophobicContact CG2-CE 4.01Å; V438-Q460 HydrophobicContact CG1-CG 3.52Å; V438-Q460 VanDerWaalsContact CG1-NE2 3.35Å
439	H	88.1	Confident	84.5	Confident	17 Å²	17	61.7 Å²	61.7	8%	0.079	34%	0.339	C	S	.	.	H	α-helix	trans	-75.7	-32.6	172.3	177.6	66.2	0	0	0	113.4	C423 C426 F430 N435 L436 A437 M441 I442 H443	C423-H439 PolarHBondContact SG-CD2 2.83Å; C426-H439 PolarHBondContact SG-NE2 3.12Å; F430-H439 HydrophobicContact CE1-CB 4.04Å; F430-H439 HydrophobicContact CE2-CB 3.89Å; F430-H439 AromaticContact CE2-CD2 3.36Å; F430-H439 WeakPolarHBondContact CE2-CD2 3.45Å; F430-H439 AromaticContact CE2-CG 3.59Å; F430-H439 HydrophobicContact CZ-CB 3.53Å; F430-H439 AromaticContact CZ-CD2 3.48Å; F430-H439 VanDerWaalsContact CZ-CD2 3.48Å; F430-H439 WeakPolarHBondContact CZ-CD2 3.5Å; F430-H439 AromaticContact CZ-CG 3.23Å; F430-H439 AromaticContact CZ-ND1 3.69Å; N435-H439 VanDerWaalsContact O-CB 3.29Å; N435-H439 WeakPolarHBondContact O-CB 3.26Å; N435-H439 PolarHBondContact O-N 3.4Å; L436-H439 CarbonylContact O-C 3.17Å; L436-H439 WeakPolarHBondContact O-CA 3.23Å; L436-H439 WeakPolarHBondContact O-CB 2.9Å; L436-H439 PolarHBondContact O-N 2.78Å; L436-H439 VanDerWaalsContact O-N 3.1Å; A437-H439 VanDerWaalsContact C-N 3.25Å; A437-H439 PolarHBondContact O-N 3.4Å; H439-M441 PolarHBondContact O-N 3.18Å; H439-I442 WeakPolarHBondContact O-CB 3.41Å; H439-I442 WeakPolarHBondContact O-CG1 3.35Å; H439-I442 PolarHBondContact O-N 3.31Å; H439-H443 AromaticContact CD2-NE2 3.14Å; H439-H443 PolarHBondContact CD2-NE2 3.28Å; H439-H443 AromaticContact CE1-NE2 2.93Å; H439-H443 PolarHBondContact CE1-NE2 3.18Å; H439-H443 AromaticContact ND1-NE2 3.95Å; H439-H443 AromaticContact NE2-CD2 3.9Å; H439-H443 AromaticContact NE2-NE2 2.23Å; H439-H443 PolarHBondContact NE2-NE2 3Å
440	R	86.3	Confident	84.6	Confident	73 Å²	73	66.2 Å²	66.2	28%	0.275	36%	0.356	S	S	.	.	H	α-helix	trans	-60.5	-34.5	173.4	-72.4	178.2	-171	-119.9	-0.8	111.7	E424 L436 A437 I442 H443 T444	E424-R440 VanDerWaalsContact CD-NH1 3.32Å; E424-R440 VanDerWaalsContact CD-NH2 3.27Å; E424-R440 IonicContact OE1-CZ 3.18Å; E424-R440 IonicContact OE1-NH1 3.3Å; E424-R440 PolarHBondContact OE1-NH1 3.18Å; E424-R440 IonicContact OE1-NH2 2.79Å; E424-R440 PolarHBondContact OE1-NH2 2.89Å; E424-R440 IonicContact OE2-CZ 3Å; E424-R440 IonicContact OE2-NH1 2.71Å; E424-R440 PolarHBondContact OE2-NH1 2.79Å; E424-R440 IonicContact OE2-NH2 3.44Å; E424-R440 PolarHBondContact OE2-NH2 2.95Å; L436-R440 HydrophobicContact CD1-CG 4.26Å; L436-R440 WeakPolarHBondContact O-CG 3.2Å; L436-R440 PolarHBondContact O-N 3.28Å; A437-R440 PolarHBondContact O-N 3.45Å; A437-R440 VanDerWaalsContact O-N 3.14Å; R440-I442 PolarHBondContact O-N 3.49Å; R440-H443 PolarHBondContact O-N 2.86Å; R440-T444 PolarHBondContact O-N 3.43Å; R440-T444 VanDerWaalsContact O-N 3.08Å
441	M	86.9	Confident	84.6	Confident	33 Å²	33	64.8 Å²	64.8	16%	0.163	35%	0.35	C	S	.	.	H	α-helix	trans	-60.5	-12.3	170.3	-70.7	-169.8	-80.2	0	0	114.6	A437 V438 H439 T444 G445 E446 P448 R459	A437-M441 PolarHBondContact O-N 3.32Å; V438-M441 HydrophobicContact CB-CE 4.3Å; V438-M441 HydrophobicContact CG2-CE 4.01Å; H439-M441 PolarHBondContact O-N 3.18Å; M441-T444 WeakPolarHBondContact CA-OG1 3.33Å; M441-G445 PolarHBondContact O-N 3.19Å; M441-E446 HydrophobicContact CG-CB 4.38Å; M441-P448 VanDerWaalsContact SD-CD 3.6Å; M441-P448 HydrophobicContact SD-CG 3.69Å; M441-R459 HydrophobicContact CB-CB 4.48Å; M441-R459 HydrophobicContact CB-CG 4Å; M441-R459 HydrophobicContact CE-CB 4.26Å; M441-R459 VanDerWaalsContact CE-O 3.22Å; M441-R459 WeakPolarHBondContact CE-O 3.36Å; M441-R459 PolarHBondContact O-NE 3.49Å; M441-R459 PolarHBondContact O-NH2 2.88Å
442	I	85.5	Confident	84.4	Confident	79 Å²	79	69.9 Å²	69.9	41%	0.405	38%	0.375	S	S	.	.	H	α-helix	trans	-72.5	-44.2	169.1	-53.4	-171.4	0	0	0	110.5	H439 R440	H439-I442 WeakPolarHBondContact O-CB 3.41Å; H439-I442 WeakPolarHBondContact O-CG1 3.35Å; H439-I442 PolarHBondContact O-N 3.31Å; R440-I442 PolarHBondContact O-N 3.49Å
443	H	84.9	Confident	83.8	Confident	88 Å²	88	69.3 Å²	69.3	41%	0.407	37%	0.368	S	S	.	.	H	α-helix	trans	-77.3	-36.9	-177.8	-59.5	-75.5	0	0	0	113.1	C423 F425 C426 H439 R440 G445	C423-H443 PolarHBondContact SG-NE2 2.79Å; F425-H443 HydrophobicContact CB-CB 4.3Å; F425-H443 HydrophobicContact CD2-CB 3.92Å; F425-H443 AromaticContact CD2-CD2 3.9Å; F425-H443 AromaticContact CD2-CG 3.92Å; F425-H443 HydrophobicContact CE2-CB 4.46Å; F425-H443 HydrophobicContact CG-CB 4.07Å; F425-H443 AromaticContact CG-CG 3.93Å; C426-H443 WeakPolarHBondContact CB-CE1 3.45Å; C426-H443 PolarHBondContact SG-CE1 2.91Å; C426-H443 PolarHBondContact SG-NE2 3.34Å; H439-H443 AromaticContact CD2-NE2 3.14Å; H439-H443 PolarHBondContact CD2-NE2 3.28Å; H439-H443 AromaticContact CE1-NE2 2.93Å; H439-H443 PolarHBondContact CE1-NE2 3.18Å; H439-H443 AromaticContact ND1-NE2 3.95Å; H439-H443 AromaticContact NE2-CD2 3.9Å; H439-H443 AromaticContact NE2-NE2 2.23Å; H439-H443 PolarHBondContact NE2-NE2 3Å; R440-H443 PolarHBondContact O-N 2.86Å; H443-G445 PolarHBondContact O-N 3.15Å
444	T	83	Confident	83.4	Confident	75 Å²	75	69.1 Å²	69.1	46%	0.46	37%	0.366	S	S	.	.	S	Bend	trans	-76.8	-10.2	174.7	62	0	0	0	0	113.3	R440 M441 E446	R440-T444 PolarHBondContact O-N 3.43Å; R440-T444 VanDerWaalsContact O-N 3.08Å; M441-T444 WeakPolarHBondContact CA-OG1 3.33Å; T444-E446 VanDerWaalsContact CB-OE2 3.22Å; T444-E446 WeakPolarHBondContact CB-OE2 3.49Å; T444-E446 PolarHBondContact O-N 2.78Å; T444-E446 VanDerWaalsContact O-N 3.09Å; T444-E446 WeakPolarHBondContact OG1-CG 2.84Å; T444-E446 PolarHBondContact OG1-OE2 3.02Å
445	G	81.9	Confident	82.9	Confident	42 Å²	42	64.7 Å²	64.7	43%	0.433	36%	0.355	S	S	.	.			trans	71.6	-7.5	-175.3	0	0	0	0	0	114.9	M441 H443	M441-G445 PolarHBondContact O-N 3.19Å; H443-G445 PolarHBondContact O-N 3.15Å
446	E	80.3	Confident	82.7	Confident	113 Å²	113	65.3 Å²	65.3	53%	0.528	35%	0.354	S	S	.	.			trans	-60.1	136.8	-173.5	-67.4	167.4	129.6	0	0	112.4	M441 T444 R459	M441-E446 HydrophobicContact CG-CB 4.38Å; T444-E446 VanDerWaalsContact CB-OE2 3.22Å; T444-E446 WeakPolarHBondContact CB-OE2 3.49Å; T444-E446 PolarHBondContact O-N 2.78Å; T444-E446 VanDerWaalsContact O-N 3.09Å; T444-E446 WeakPolarHBondContact OG1-CG 2.84Å; T444-E446 PolarHBondContact OG1-OE2 3.02Å; E446-R459 WeakPolarHBondContact O-CG 3.43Å
447	K	82.5	Confident	82.4	Confident	84 Å²	84	67.1 Å²	67.1	37%	0.365	37%	0.365	S	S	.	.			trans	-135	71	178.3	-64.8	171.2	-172.5	171.7	0	109	L449 T457 C458 R459	K447-L449 PolarHBondContact O-N 3.43Å; K447-L449 VanDerWaalsContact O-N 3.1Å; K447-T457 WeakPolarHBondContact CD-OG1 3.35Å; K447-C458 CarbonylContact C-O 3.53Å; K447-C458 VanDerWaalsContact C-O 3.26Å; K447-C458 WeakPolarHBondContact CA-O 3.42Å; K447-R459 HydrophobicContact CG-CG 4.36Å
448	P	79.6	Confident	82.3	Confident	91 Å²	91	65.1 Å²	65.1	59%	0.591	35%	0.348	S	S	*	.			trans	-68.1	-10.9	-167.6	27.3	-36.1	0	0	0	114.5	M441	M441-P448 VanDerWaalsContact SD-CD 3.6Å; M441-P448 HydrophobicContact SD-CG 3.69Å
449	L	82.7	Confident	82.3	Confident	56 Å²	56	67.3 Å²	67.3	29%	0.293	35%	0.354	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	105.4	-176.5	-62.8	174.6	0	0	0	110	K447 T457 C458 K461 L464	K447-L449 PolarHBondContact O-N 3.43Å; K447-L449 VanDerWaalsContact O-N 3.1Å; L449-T457 CarbonylContact O-C 3.26Å; L449-T457 WeakPolarHBondContact O-CA 3.27Å; L449-C458 PolarHBondContact N-O 2.76Å; L449-C458 PolarHBondContact O-N 3.17Å; L449-K461 HydrophobicContact CD1-CB 4.06Å; L449-L464 HydrophobicContact CB-CD2 4.27Å
450	Q	85.8	Confident	82.2	Confident	122 Å²	122	70.7 Å²	70.7	57%	0.57	37%	0.37	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	140.1	177.4	-170.6	162	42.7	0	0	111.9	G455 T457	Q450-G455 PolarHBondContact NE2-O 3.46Å; Q450-T457 HydrophobicContact CB-CG2 3.97Å; Q450-T457 HydrophobicContact CG-CG2 3.81Å
451	C	84.3	Confident	82.1	Confident	2 Å²	2	75.2 Å²	75.2	1%	0.014	39%	0.392	C	S	.	.			trans	-74.2	116.7	166.3	168.2	0	0	0	0	110.6	I453 C454 G455 F456 L464 H467 M468	C451-I453 PolarHBondContact O-N 2.83Å; C451-I453 PolarHBondContact SG-N 2.94Å; C451-I453 VanDerWaalsContact SG-N 3.45Å; C451-C454 PolarHBondContact SG-N 2.91Å; C451-C454 PolarHBondContact SG-SG 3.4Å; C451-G455 WeakPolarHBondContact O-CA 3.48Å; C451-G455 PolarHBondContact O-N 3.09Å; C451-F456 HydrophobicContact CB-CB 4Å; C451-F456 VanDerWaalsContact CB-O 3.24Å; C451-F456 WeakPolarHBondContact CB-O 3.46Å; C451-F456 PolarHBondContact N-O 3.19Å; C451-L464 HydrophobicContact CB-CD1 3.98Å; C451-H467 PolarHBondContact SG-NE2 3.48Å; C451-M468 HydrophobicContact CB-CE 3.96Å; C451-M468 WeakPolarHBondContact SG-CE 3.45Å
452	E	77.9	Confident	81.9	Confident	192 Å²	192	77 Å²	77	90%	0.897	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.4	-26.9	176.8	-62	174.7	-174.4	0	0	112.9
453	I	71.9	Confident	81.9	Confident	26 Å²	26	75.5 Å²	75.5	13%	0.133	41%	0.408	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.6	-48.7	-173.2	-58.1	-178.1	0	0	0	111.4	C451 M468 H471 Y477 K487	C451-I453 PolarHBondContact O-N 2.83Å; C451-I453 PolarHBondContact SG-N 2.94Å; C451-I453 VanDerWaalsContact SG-N 3.45Å; I453-M468 HydrophobicContact CD1-CE 3.99Å; I453-M468 HydrophobicContact CD1-SD 3.91Å; I453-M468 HydrophobicContact CG1-CE 4.25Å; I453-M468 HydrophobicContact CG1-SD 4.45Å; I453-H471 HydrophobicContact CD1-CB 3.7Å; I453-H471 HydrophobicContact CG2-CB 4.45Å; I453-H471 WeakPolarHBondContact CG2-ND1 3.38Å; I453-Y477 HydrophobicContact CG2-CD1 4.22Å; I453-K487 HydrophobicContact CG2-CB 3.66Å; I453-K487 HydrophobicContact CG2-CD 4.01Å; I453-K487 HydrophobicContact CG2-CG 4.46Å; I453-K487 PolarHBondContact O-N 2.95Å
454	C	75.8	Confident	82	Confident	64 Å²	64	72.8 Å²	72.8	43%	0.432	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-130.6	3.5	-174.3	73.9	0	0	0	0	115.4	C451 F456 H467	C451-C454 PolarHBondContact SG-N 2.91Å; C451-C454 PolarHBondContact SG-SG 3.4Å; C454-F456 VanDerWaalsContact C-N 3.32Å; C454-F456 PolarHBondContact O-N 2.61Å; C454-H467 PolarHBondContact SG-NE2 2.98Å
455	G	77.4	Confident	82.1	Confident	32 Å²	32	73.1 Å²	73.1	33%	0.33	40%	0.396	S	S	.	.			trans	80.5	-1.7	176.2	0	0	0	0	0	116.1	Q450 C451 T457	Q450-G455 PolarHBondContact NE2-O 3.46Å; C451-G455 WeakPolarHBondContact O-CA 3.48Å; C451-G455 PolarHBondContact O-N 3.09Å; G455-T457 PolarHBondContact O-N 3.41Å
456	F	80	Confident	82.1	Confident	98 Å²	98	79.3 Å²	79.3	43%	0.43	41%	0.406	S	S	.	.			trans	-56.3	125.7	176.9	172.5	-102.3	0	0	0	112.1	C451 C454 C458 H467	C451-F456 HydrophobicContact CB-CB 4Å; C451-F456 VanDerWaalsContact CB-O 3.24Å; C451-F456 WeakPolarHBondContact CB-O 3.46Å; C451-F456 PolarHBondContact N-O 3.19Å; C454-F456 VanDerWaalsContact C-N 3.32Å; C454-F456 PolarHBondContact O-N 2.61Å; F456-C458 HydrophobicContact CE1-CB 3.88Å; F456-C458 HydrophobicContact CZ-CB 4.32Å; F456-H467 HydrophobicContact CD1-CB 4.36Å; F456-H467 AromaticContact CD1-CD2 3.76Å; F456-H467 AromaticContact CD1-CE1 3.64Å; F456-H467 AromaticContact CD1-CG 3.68Å; F456-H467 AromaticContact CD1-ND1 3.6Å; F456-H467 AromaticContact CD1-NE2 3.75Å; F456-H467 HydrophobicContact CE1-CB 4.31Å; F456-H467 AromaticContact CE1-ND1 3.99Å; F456-H467 AromaticContact CG-CE1 3.69Å; F456-H467 AromaticContact CG-NE2 3.95Å
457	T	84.1	Confident	82.3	Confident	51 Å²	51	75.3 Å²	75.3	31%	0.313	39%	0.387	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.1	140.8	-179	56.7	0	0	0	0	112.1	K447 L449 Q450 G455	K447-T457 WeakPolarHBondContact CD-OG1 3.35Å; L449-T457 CarbonylContact O-C 3.26Å; L449-T457 WeakPolarHBondContact O-CA 3.27Å; Q450-T457 HydrophobicContact CB-CG2 3.97Å; Q450-T457 HydrophobicContact CG-CG2 3.81Å; G455-T457 PolarHBondContact O-N 3.41Å
458	C	83.8	Confident	82.1	Confident	11 Å²	11	73.5 Å²	73.5	7%	0.074	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	173.5	-179.2	72.3	0	0	0	0	113.3	K447 L449 F456 Q460	K447-C458 CarbonylContact C-O 3.53Å; K447-C458 VanDerWaalsContact C-O 3.26Å; K447-C458 WeakPolarHBondContact CA-O 3.42Å; L449-C458 PolarHBondContact N-O 2.76Å; L449-C458 PolarHBondContact O-N 3.17Å; F456-C458 HydrophobicContact CE1-CB 3.88Å; F456-C458 HydrophobicContact CZ-CB 4.32Å; C458-Q460 PolarHBondContact SG-O 3.39Å
459	R	85.8	Confident	82.3	Confident	64 Å²	64	74.7 Å²	74.7	24%	0.242	38%	0.376	C	S	.	.	S	Bend	trans	-96.8	-18.6	-174.5	-65.7	172.2	179.7	131.7	-2.7	114.3	M441 E446 K447	M441-R459 HydrophobicContact CB-CB 4.48Å; M441-R459 HydrophobicContact CB-CG 4Å; M441-R459 HydrophobicContact CE-CB 4.26Å; M441-R459 VanDerWaalsContact CE-O 3.22Å; M441-R459 WeakPolarHBondContact CE-O 3.36Å; M441-R459 PolarHBondContact O-NE 3.49Å; M441-R459 PolarHBondContact O-NH2 2.88Å; E446-R459 WeakPolarHBondContact O-CG 3.43Å; K447-R459 HydrophobicContact CG-CG 4.36Å
460	Q	85.9	Confident	81.9	Confident	89 Å²	89	77 Å²	77	42%	0.416	38%	0.384	S	S	.	.			trans	-132.6	139.1	-172.1	-62.5	-178.1	19	0	0	112.2	V438 C458 A462 S463 L464	V438-Q460 HydrophobicContact CG1-CG 3.52Å; V438-Q460 VanDerWaalsContact CG1-NE2 3.35Å; C458-Q460 PolarHBondContact SG-O 3.39Å; Q460-A462 PolarHBondContact O-N 2.87Å; Q460-S463 WeakPolarHBondContact O-CB 3.15Å; Q460-S463 PolarHBondContact O-N 3.05Å; Q460-S463 VanDerWaalsContact O-N 3.12Å; Q460-L464 PolarHBondContact O-N 3.14Å
461	K	83.4	Confident	81.3	Confident	168 Å²	168	72 Å²	72	73%	0.73	36%	0.36	S	S	*	.	H	α-helix	trans	-63.7	-29.9	176.4	-167.5	175	-178.9	179.2	0	112.4	L449 L464 N465	L449-K461 HydrophobicContact CD1-CB 4.06Å; K461-L464 PolarHBondContact O-N 3.09Å; K461-N465 WeakPolarHBondContact O-CB 3.14Å; K461-N465 PolarHBondContact O-N 3.36Å
462	A	84.4	Confident	80.5	Confident	69 Å²	69	77.6 Å²	77.6	57%	0.57	39%	0.391	S	S	*	.	H	α-helix	trans	-64.3	-44.9	172	0	0	0	0	0	112.1	Q460 N465 W466	Q460-A462 PolarHBondContact O-N 2.87Å; A462-N465 PolarHBondContact O-N 3.16Å; A462-W466 PolarHBondContact O-N 3.42Å
463	S	85.5	Confident	79.9	Confident	49 Å²	49	72.7 Å²	72.7	34%	0.343	38%	0.383	S	S	.	.	H	α-helix	trans	-64.1	-39.2	174.4	-49.7	0	0	0	0	112.1	Q460 H467	Q460-S463 WeakPolarHBondContact O-CB 3.15Å; Q460-S463 PolarHBondContact O-N 3.05Å; Q460-S463 VanDerWaalsContact O-N 3.12Å; S463-H467 VanDerWaalsContact O-CB 3.27Å; S463-H467 WeakPolarHBondContact O-CB 3.4Å; S463-H467 PolarHBondContact O-N 3.2Å
464	L	86.1	Confident	79.3	Confident	30 Å²	30	74.9 Å²	74.9	16%	0.157	40%	0.395	C	S	.	.	H	α-helix	trans	-63.4	-44.8	173.1	-173.5	62.7	0	0	0	111.4	L449 C451 Q460 K461 H467 M468	L449-L464 HydrophobicContact CB-CD2 4.27Å; C451-L464 HydrophobicContact CB-CD1 3.98Å; Q460-L464 PolarHBondContact O-N 3.14Å; K461-L464 PolarHBondContact O-N 3.09Å; L464-H467 CarbonylContact O-C 3.55Å; L464-H467 WeakPolarHBondContact O-CB 3.44Å; L464-H467 PolarHBondContact O-N 3.11Å; L464-M468 HydrophobicContact CD1-CE 4.36Å; L464-M468 WeakPolarHBondContact O-CG 3.32Å; L464-M468 PolarHBondContact O-N 2.94Å
465	N	84.9	Confident	78.3	Confident	83 Å²	83	75.2 Å²	75.2	44%	0.444	40%	0.402	S	S	.	.	H	α-helix	trans	-63.7	-44.3	179	-173.8	-68.2	0	0	0	111.9	K461 A462 H467 M468 K469	K461-N465 WeakPolarHBondContact O-CB 3.14Å; K461-N465 PolarHBondContact O-N 3.36Å; A462-N465 PolarHBondContact O-N 3.16Å; N465-H467 VanDerWaalsContact C-N 3.25Å; N465-H467 PolarHBondContact O-N 3.47Å; N465-M468 WeakPolarHBondContact O-CB 3.1Å; N465-M468 PolarHBondContact O-N 3.08Å; N465-K469 WeakPolarHBondContact O-CG 3.17Å; N465-K469 PolarHBondContact O-N 3.49Å; N465-K469 WeakPolarHBondContact OD1-CE 3.44Å
466	W	82.9	Confident	77.2	Confident	171 Å²	171	76 Å²	76	65%	0.648	40%	0.401	S	S	*	.	H	α-helix	trans	-62.7	-33.4	173.5	-178.6	71.3	0	0	0	112.6	A462 K470	A462-W466 PolarHBondContact O-N 3.42Å; W466-K470 VanDerWaalsContact CH2-CE 3.46Å; W466-K470 VanDerWaalsContact CH2-NZ 3.27Å; W466-K470 PolarHBondContact O-N 3.39Å
467	H	83.8	Confident	76.1	Confident	29 Å²	29	73.8 Å²	73.8	13%	0.134	39%	0.39	C	S	.	.	H	α-helix	trans	-70.8	-40.6	172.6	176.2	84.4	0	0	0	112.3	C451 C454 F456 S463 L464 N465 K470 H471	C451-H467 PolarHBondContact SG-NE2 3.48Å; C454-H467 PolarHBondContact SG-NE2 2.98Å; F456-H467 HydrophobicContact CD1-CB 4.36Å; F456-H467 AromaticContact CD1-CD2 3.76Å; F456-H467 AromaticContact CD1-CE1 3.64Å; F456-H467 AromaticContact CD1-CG 3.68Å; F456-H467 AromaticContact CD1-ND1 3.6Å; F456-H467 AromaticContact CD1-NE2 3.75Å; F456-H467 HydrophobicContact CE1-CB 4.31Å; F456-H467 AromaticContact CE1-ND1 3.99Å; F456-H467 AromaticContact CG-CE1 3.69Å; F456-H467 AromaticContact CG-NE2 3.95Å; S463-H467 VanDerWaalsContact O-CB 3.27Å; S463-H467 WeakPolarHBondContact O-CB 3.4Å; S463-H467 PolarHBondContact O-N 3.2Å; L464-H467 CarbonylContact O-C 3.55Å; L464-H467 WeakPolarHBondContact O-CB 3.44Å; L464-H467 PolarHBondContact O-N 3.11Å; N465-H467 VanDerWaalsContact C-N 3.25Å; N465-H467 PolarHBondContact O-N 3.47Å; H467-K470 WeakPolarHBondContact O-CB 3.45Å; H467-K470 PolarHBondContact O-N 3.35Å; H467-K470 VanDerWaalsContact O-N 3.09Å; H467-H471 AromaticContact CD2-CD2 3.94Å; H467-H471 AromaticContact CD2-NE2 3.54Å; H467-H471 AromaticContact CE1-NE2 3.46Å; H467-H471 PolarHBondContact CE1-NE2 3.2Å; H467-H471 AromaticContact NE2-CD2 3.82Å; H467-H471 AromaticContact NE2-CE1 3.99Å; H467-H471 AromaticContact NE2-NE2 2.96Å; H467-H471 PolarHBondContact NE2-NE2 3.27Å; H467-H471 PolarHBondContact O-CD2 3.41Å
468	M	78.7	Confident	75	Confident	47 Å²	47	78.1 Å²	78.1	23%	0.232	41%	0.406	C	S	.	.	H	α-helix	trans	-58.1	-47.1	170.7	-69.2	-66.7	95.3	0	0	111.3	C451 I453 L464 N465 K470 H471 D472	C451-M468 HydrophobicContact CB-CE 3.96Å; C451-M468 WeakPolarHBondContact SG-CE 3.45Å; I453-M468 HydrophobicContact CD1-CE 3.99Å; I453-M468 HydrophobicContact CD1-SD 3.91Å; I453-M468 HydrophobicContact CG1-CE 4.25Å; I453-M468 HydrophobicContact CG1-SD 4.45Å; L464-M468 HydrophobicContact CD1-CE 4.36Å; L464-M468 WeakPolarHBondContact O-CG 3.32Å; L464-M468 PolarHBondContact O-N 2.94Å; N465-M468 WeakPolarHBondContact O-CB 3.1Å; N465-M468 PolarHBondContact O-N 3.08Å; M468-K470 PolarHBondContact O-N 3.37Å; M468-H471 WeakPolarHBondContact O-CA 3.49Å; M468-H471 WeakPolarHBondContact O-CB 3.45Å; M468-H471 PolarHBondContact O-N 3.25Å; M468-D472 PolarHBondContact O-N 2.93Å
469	K	82.3	Confident	74.2	Confident	116 Å²	116	80.5 Å²	80.5	50%	0.504	42%	0.415	S	S	.	.	H	α-helix	trans	-56.7	-17	174.7	-73.8	177.7	175.1	177.4	0	113.9	N465 A473	N465-K469 WeakPolarHBondContact O-CG 3.17Å; N465-K469 PolarHBondContact O-N 3.49Å; N465-K469 WeakPolarHBondContact OD1-CE 3.44Å; K469-A473 WeakPolarHBondContact O-CB 3.3Å; K469-A473 PolarHBondContact O-N 3.22Å; K469-A473 VanDerWaalsContact O-N 3.11Å
470	K	75.5	Confident	73.7	Confident	105 Å²	105	80.5 Å²	80.5	46%	0.457	43%	0.425	S	S	.	.	H	α-helix	trans	-79.4	-41.5	168.4	-64.4	-172.6	178.7	-172.6	0	112.8	W466 H467 M468 D472 D474	W466-K470 VanDerWaalsContact CH2-CE 3.46Å; W466-K470 VanDerWaalsContact CH2-NZ 3.27Å; W466-K470 PolarHBondContact O-N 3.39Å; H467-K470 WeakPolarHBondContact O-CB 3.45Å; H467-K470 PolarHBondContact O-N 3.35Å; H467-K470 VanDerWaalsContact O-N 3.09Å; M468-K470 PolarHBondContact O-N 3.37Å; K470-D472 VanDerWaalsContact C-N 3.27Å; K470-D472 PolarHBondContact O-N 2.98Å; K470-D474 WeakPolarHBondContact O-CB 3.38Å; K470-D474 PolarHBondContact O-N 2.94Å
471	H	73.1	Confident	73.5	Confident	15 Å²	15	76.3 Å²	76.3	7%	0.069	41%	0.406	C	S	.	.	H	α-helix	trans	-65.9	-31.3	173	-60.1	-75.7	0	0	0	112.2	I453 H467 M468 Y477	I453-H471 HydrophobicContact CD1-CB 3.7Å; I453-H471 HydrophobicContact CG2-CB 4.45Å; I453-H471 WeakPolarHBondContact CG2-ND1 3.38Å; H467-H471 AromaticContact CD2-CD2 3.94Å; H467-H471 AromaticContact CD2-NE2 3.54Å; H467-H471 AromaticContact CE1-NE2 3.46Å; H467-H471 PolarHBondContact CE1-NE2 3.2Å; H467-H471 AromaticContact NE2-CD2 3.82Å; H467-H471 AromaticContact NE2-CE1 3.99Å; H467-H471 AromaticContact NE2-NE2 2.96Å; H467-H471 PolarHBondContact NE2-NE2 3.27Å; H467-H471 PolarHBondContact O-CD2 3.41Å; M468-H471 WeakPolarHBondContact O-CA 3.49Å; M468-H471 WeakPolarHBondContact O-CB 3.45Å; M468-H471 PolarHBondContact O-N 3.25Å; H471-Y477 HydrophobicContact CB-CG 4.45Å; H471-Y477 AromaticContact CE1-CD1 3.98Å; H471-Y477 AromaticContact CE1-CE1 3.64Å; H471-Y477 AromaticContact CE1-CZ 3.92Å; H471-Y477 AromaticContact ND1-CD1 3.29Å; H471-Y477 VanDerWaalsContact ND1-CD1 3.29Å; H471-Y477 WeakPolarHBondContact ND1-CD1 3.48Å; H471-Y477 AromaticContact ND1-CD2 3.81Å; H471-Y477 AromaticContact ND1-CE1 3.38Å; H471-Y477 WeakPolarHBondContact ND1-CE1 3.49Å; H471-Y477 AromaticContact ND1-CE2 3.91Å; H471-Y477 AromaticContact ND1-CG 3.51Å; H471-Y477 AromaticContact ND1-CZ 3.69Å
472	D	67.3	Low	73.2	Confident	121 Å²	121	73 Å²	73	65%	0.647	40%	0.404	S	S	*	.	H	α-helix	trans	-79.8	-38.6	178.1	-57	-41.8	0	0	0	112.7	M468 K470	M468-D472 PolarHBondContact O-N 2.93Å; K470-D472 VanDerWaalsContact C-N 3.27Å; K470-D472 PolarHBondContact O-N 2.98Å
473	A	65.1	Low	72.7	Confident	88 Å²	88	72.7 Å²	72.7	73%	0.727	39%	0.392	S	S	*	.	H	α-helix	trans	-78.3	-28.7	178.5	0	0	0	0	0	113	K469 A475	K469-A473 WeakPolarHBondContact O-CB 3.3Å; K469-A473 PolarHBondContact O-N 3.22Å; K469-A473 VanDerWaalsContact O-N 3.11Å; A473-A475 PolarHBondContact O-N 2.97Å
474	D	58.7	Low	72.3	Confident	73 Å²	73	72.6 Å²	72.6	39%	0.39	39%	0.391	S	S	.	.			trans	-97.5	87.6	177.8	-147.8	-33	0	0	0	109.4	K470 T476 Y477	K470-D474 WeakPolarHBondContact O-CB 3.38Å; K470-D474 PolarHBondContact O-N 2.94Å; D474-T476 PolarHBondContact O-N 3.21Å; D474-T476 PolarHBondContact O-OG1 3.46Å; D474-T476 WeakPolarHBondContact OD1-CB 3.46Å; D474-T476 WeakPolarHBondContact OD1-CG2 3.47Å; D474-T476 PolarHBondContact OD1-OG1 3.34Å; D474-Y477 HydrophobicContact CB-CD2 4.33Å; D474-Y477 PolarHBondContact O-N 3.44Å
475	A	55	Low	71.5	Confident	70 Å²	70	73.6 Å²	73.6	58%	0.579	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	6.5	-178.1	0	0	0	0	0	114.7	A473 Q478	A473-A475 PolarHBondContact O-N 2.97Å; A475-Q478 VanDerWaalsContact O-CG 3.3Å; A475-Q478 WeakPolarHBondContact O-CG 3.37Å
476	T	56.1	Low	70.8	Confident	50 Å²	50	75.1 Å²	75.1	31%	0.307	41%	0.411	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-24.2	171.8	57.6	0	0	0	0	113	D474 Q478 F479 E489	D474-T476 PolarHBondContact O-N 3.21Å; D474-T476 PolarHBondContact O-OG1 3.46Å; D474-T476 WeakPolarHBondContact OD1-CB 3.46Å; D474-T476 WeakPolarHBondContact OD1-CG2 3.47Å; D474-T476 PolarHBondContact OD1-OG1 3.34Å; T476-Q478 PolarHBondContact O-N 2.84Å; T476-F479 VanDerWaalsContact O-CD2 3.23Å; T476-F479 WeakPolarHBondContact O-CD2 3.44Å; T476-F479 WeakPolarHBondContact O-CE2 3.46Å; T476-E489 VanDerWaalsContact CB-O 3.29Å; T476-E489 WeakPolarHBondContact CB-O 3.47Å; T476-E489 CarbonylContact O-C 3.54Å
477	Y	55.7	Low	70.5	Confident	51 Å²	51	71.6 Å²	71.6	20%	0.2	40%	0.4	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.6	19.4	175.9	-77.5	-89.3	0	0	0	115.2	I453 H471 D474 F479 E489	I453-Y477 HydrophobicContact CG2-CD1 4.22Å; H471-Y477 HydrophobicContact CB-CG 4.45Å; H471-Y477 AromaticContact CE1-CD1 3.98Å; H471-Y477 AromaticContact CE1-CE1 3.64Å; H471-Y477 AromaticContact CE1-CZ 3.92Å; H471-Y477 AromaticContact ND1-CD1 3.29Å; H471-Y477 VanDerWaalsContact ND1-CD1 3.29Å; H471-Y477 WeakPolarHBondContact ND1-CD1 3.48Å; H471-Y477 AromaticContact ND1-CD2 3.81Å; H471-Y477 AromaticContact ND1-CE1 3.38Å; H471-Y477 WeakPolarHBondContact ND1-CE1 3.49Å; H471-Y477 AromaticContact ND1-CE2 3.91Å; H471-Y477 AromaticContact ND1-CG 3.51Å; H471-Y477 AromaticContact ND1-CZ 3.69Å; D474-Y477 HydrophobicContact CB-CD2 4.33Å; D474-Y477 PolarHBondContact O-N 3.44Å; Y477-F479 VanDerWaalsContact C-N 3.26Å; Y477-F479 PolarHBondContact O-N 3.49Å; Y477-E489 HydrophobicContact CD1-CB 4.49Å; Y477-E489 HydrophobicContact CD2-CB 4.38Å; Y477-E489 HydrophobicContact CD2-CG 4.33Å; Y477-E489 HydrophobicContact CE1-CB 3.92Å; Y477-E489 HydrophobicContact CE2-CB 3.78Å; Y477-E489 HydrophobicContact CE2-CG 3.64Å; Y477-E489 PolarHBondContact OH-OE2 3.2Å
478	Q	60.9	Low	70.1	Confident	141 Å²	141	72.2 Å²	72.2	66%	0.659	40%	0.403	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.4	-22.6	173.1	-77.3	176.1	3.3	0	0	113.6	A475 T476 S480	A475-Q478 VanDerWaalsContact O-CG 3.3Å; A475-Q478 WeakPolarHBondContact O-CG 3.37Å; T476-Q478 PolarHBondContact O-N 2.84Å; Q478-S480 PolarHBondContact O-N 3.5Å
479	F	66.7	Low	69.9	Low	61 Å²	61	73.2 Å²	73.2	27%	0.268	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	90.9	-167.8	-50.3	-61.6	0	0	0	111.8	T476 Y477 F488 K491 V494	T476-F479 VanDerWaalsContact O-CD2 3.23Å; T476-F479 WeakPolarHBondContact O-CD2 3.44Å; T476-F479 WeakPolarHBondContact O-CE2 3.46Å; Y477-F479 VanDerWaalsContact C-N 3.26Å; Y477-F479 PolarHBondContact O-N 3.49Å; F479-F488 PolarHBondContact O-N 2.85Å; F479-K491 HydrophobicContact CD1-CD 4.47Å; F479-K491 HydrophobicContact CD1-CG 3.7Å; F479-K491 HydrophobicContact CD2-CG 3.89Å; F479-K491 HydrophobicContact CE1-CD 4.16Å; F479-K491 HydrophobicContact CE1-CG 3.76Å; F479-K491 HydrophobicContact CE2-CG 3.92Å; F479-K491 HydrophobicContact CG-CG 3.79Å; F479-K491 HydrophobicContact CZ-CD 4.32Å; F479-K491 HydrophobicContact CZ-CG 3.87Å; F479-V494 HydrophobicContact CB-CG2 3.53Å; F479-V494 VanDerWaalsContact O-CG2 3.29Å; F479-V494 WeakPolarHBondContact O-CG2 3.23Å
480	S	76.9	Confident	69.6	Low	64 Å²	64	72.7 Å²	72.7	45%	0.448	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	143.9	168.4	55.2	0	0	0	0	112.2	Q478 S482 K486	Q478-S480 PolarHBondContact O-N 3.5Å; S480-S482 PolarHBondContact O-N 3.2Å; S480-K486 CarbonylContact C-O 3.5Å; S480-K486 WeakPolarHBondContact CA-O 3.46Å
481	C	80.4	Confident	69.5	Low	1 Å²	1	74 Å²	74	1%	0.007	41%	0.41	C	S	.	.			trans	-71.6	119.7	164.9	-178.5	0	0	0	0	109.3	I483 C484 G485 K486 F488 V494	C481-I483 PolarHBondContact O-N 3.45Å; C481-C484 PolarHBondContact O-N 3.45Å; C481-C484 VanDerWaalsContact SG-SG 3.63Å; C481-G485 WeakPolarHBondContact O-CA 3.21Å; C481-G485 PolarHBondContact O-N 3.07Å; C481-K486 PolarHBondContact N-O 2.93Å; C481-F488 HydrophobicContact CB-CE2 4.23Å; C481-V494 HydrophobicContact CB-CG1 4.08Å
482	S	76.4	Confident	69.9	Low	99 Å²	99	78.9 Å²	78.9	69%	0.692	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-12.8	-179	53.9	0	0	0	0	115	S480	S480-S482 PolarHBondContact O-N 3.2Å
483	I	75.4	Confident	70.5	Confident	63 Å²	63	75.8 Å²	75.8	32%	0.323	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.5	-28.7	-173.3	-51.6	164.9	0	0	0	111.8	C481 K498 H502 V505	C481-I483 PolarHBondContact O-N 3.45Å; I483-K498 HydrophobicContact CD1-CD 4.3Å; I483-K498 HydrophobicContact CD1-CG 4.17Å; I483-H502 HydrophobicContact CD1-CB 3.57Å; I483-H502 HydrophobicContact CG2-CB 4.3Å; I483-V505 HydrophobicContact CD1-CB 3.75Å; I483-V505 HydrophobicContact CD1-CG1 3.58Å; I483-V505 HydrophobicContact CD1-CG2 4.23Å; I483-V505 HydrophobicContact CG1-CG1 4.16Å; I483-V505 HydrophobicContact CG2-CG2 4.36Å
484	C	76.2	Confident	71.2	Confident	47 Å²	47	72.4 Å²	72.4	32%	0.318	39%	0.394	S	S	.	.	T	Hydrogen-bonded Turn	trans	-137.2	5.6	-174	68.8	0	0	0	0	115.1	C481 K486 H497 H502	C481-C484 PolarHBondContact O-N 3.45Å; C481-C484 VanDerWaalsContact SG-SG 3.63Å; C484-K486 PolarHBondContact O-N 2.76Å; C484-H497 PolarHBondContact SG-NE2 2.9Å; C484-H502 WeakPolarHBondContact CB-NE2 3.25Å; C484-H502 PolarHBondContact SG-NE2 2.78Å
485	G	69.1	Low	72.2	Confident	51 Å²	51	73.3 Å²	73.3	53%	0.526	40%	0.402	S	S	.	.			trans	73	-16.9	174.8	0	0	0	0	0	116.4	C481 K487	C481-G485 WeakPolarHBondContact O-CA 3.21Å; C481-G485 PolarHBondContact O-N 3.07Å; G485-K487 PolarHBondContact O-N 3.48Å
486	K	70.3	Confident	73.5	Confident	115 Å²	115	71.9 Å²	71.9	50%	0.5	39%	0.391	S	S	.	.			trans	-54.2	133.5	179.9	-67.4	177.9	-179.9	176.9	0	111.2	S480 C481 C484 F488	S480-K486 CarbonylContact C-O 3.5Å; S480-K486 WeakPolarHBondContact CA-O 3.46Å; C481-K486 PolarHBondContact N-O 2.93Å; C484-K486 PolarHBondContact O-N 2.76Å; K486-F488 HydrophobicContact CB-CE2 3.64Å; K486-F488 HydrophobicContact CB-CZ 3.89Å; K486-F488 WeakPolarHBondContact O-CD2 3.36Å; K486-F488 WeakPolarHBondContact O-CE2 3.5Å
487	K	76.1	Confident	74.7	Confident	97 Å²	97	71 Å²	71	42%	0.422	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	144	-175.1	-72.8	174.4	177.6	179	0	111	I453 G485	I453-K487 HydrophobicContact CG2-CB 3.66Å; I453-K487 HydrophobicContact CG2-CD 4.01Å; I453-K487 HydrophobicContact CG2-CG 4.46Å; I453-K487 PolarHBondContact O-N 2.95Å; G485-K487 PolarHBondContact O-N 3.48Å
488	F	75.4	Confident	75.9	Confident	42 Å²	42	69.9 Å²	69.9	18%	0.184	38%	0.379	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	144.1	-173.8	-59.7	-94.2	0	0	0	111.6	F479 C481 K486 K490 C493 V494 H497	F479-F488 PolarHBondContact O-N 2.85Å; C481-F488 HydrophobicContact CB-CE2 4.23Å; K486-F488 HydrophobicContact CB-CE2 3.64Å; K486-F488 HydrophobicContact CB-CZ 3.89Å; K486-F488 WeakPolarHBondContact O-CD2 3.36Å; K486-F488 WeakPolarHBondContact O-CE2 3.5Å; F488-K490 PolarHBondContact O-N 2.85Å; F488-C493 HydrophobicContact CB-CB 3.96Å; F488-C493 HydrophobicContact CD1-CB 3.88Å; F488-C493 HydrophobicContact CG-CB 4.22Å; F488-V494 HydrophobicContact CB-CG2 3.82Å; F488-V494 HydrophobicContact CD2-CB 4.46Å; F488-V494 HydrophobicContact CD2-CG2 3.76Å; F488-V494 HydrophobicContact CG-CG2 4.06Å; F488-H497 HydrophobicContact CE1-CB 3.98Å; F488-H497 HydrophobicContact CE2-CB 4.12Å; F488-H497 AromaticContact CE2-CD2 3.55Å; F488-H497 AromaticContact CE2-CG 3.9Å; F488-H497 HydrophobicContact CZ-CB 3.6Å; F488-H497 AromaticContact CZ-CD2 3.33Å; F488-H497 WeakPolarHBondContact CZ-CD2 3.18Å; F488-H497 AromaticContact CZ-CG 3.29Å; F488-H497 AromaticContact CZ-ND1 3.86Å; F488-H497 AromaticContact CZ-NE2 3.9Å
489	E	75.2	Confident	76.8	Confident	68 Å²	68	65.7 Å²	65.7	32%	0.318	37%	0.369	S	S	.	.	S	Bend	trans	-58.9	-26	176	-161.6	-179.9	94.1	0	0	113.6	T476 Y477	T476-E489 VanDerWaalsContact CB-O 3.29Å; T476-E489 WeakPolarHBondContact CB-O 3.47Å; T476-E489 CarbonylContact O-C 3.54Å; Y477-E489 HydrophobicContact CD1-CB 4.49Å; Y477-E489 HydrophobicContact CD2-CB 4.38Å; Y477-E489 HydrophobicContact CD2-CG 4.33Å; Y477-E489 HydrophobicContact CE1-CB 3.92Å; Y477-E489 HydrophobicContact CE2-CB 3.78Å; Y477-E489 HydrophobicContact CE2-CG 3.64Å; Y477-E489 PolarHBondContact OH-OE2 3.2Å
490	K	76.9	Confident	77.4	Confident	104 Å²	104	71.1 Å²	71.1	45%	0.452	39%	0.392	S	S	.	.	S	Bend	trans	-141.9	141	-170.3	-64.2	-178.9	174.3	105.8	0	110.5	F488 D492 C493 V494	F488-K490 PolarHBondContact O-N 2.85Å; K490-D492 PolarHBondContact O-N 3.27Å; K490-C493 HydrophobicContact CB-CB 4.45Å; K490-C493 WeakPolarHBondContact O-CB 3.24Å; K490-C493 PolarHBondContact O-N 2.96Å; K490-V494 PolarHBondContact O-N 3.15Å
491	K	73.4	Confident	77.3	Confident	132 Å²	132	70.4 Å²	70.4	57%	0.574	39%	0.387	S	S	*	.	H	α-helix	trans	-53.8	-41.3	175.2	-67.9	-177.2	178.6	-179.2	0	111.5	F479 C493 V494 V495	F479-K491 HydrophobicContact CD1-CD 4.47Å; F479-K491 HydrophobicContact CD1-CG 3.7Å; F479-K491 HydrophobicContact CD2-CG 3.89Å; F479-K491 HydrophobicContact CE1-CD 4.16Å; F479-K491 HydrophobicContact CE1-CG 3.76Å; F479-K491 HydrophobicContact CE2-CG 3.92Å; F479-K491 HydrophobicContact CG-CG 3.79Å; F479-K491 HydrophobicContact CZ-CD 4.32Å; F479-K491 HydrophobicContact CZ-CG 3.87Å; K491-C493 VanDerWaalsContact C-N 3.25Å; K491-C493 PolarHBondContact O-N 3.29Å; K491-V494 WeakPolarHBondContact O-CA 3.12Å; K491-V494 WeakPolarHBondContact O-CB 3.43Å; K491-V494 PolarHBondContact O-N 3.15Å; K491-V495 PolarHBondContact O-N 2.88Å
492	D	80.7	Confident	77.3	Confident	118 Å²	118	72.1 Å²	72.1	63%	0.631	40%	0.395	S	S	*	.	H	α-helix	trans	-63.4	-32.7	-179.7	-38.6	-52.9	0	0	0	111.9	K490 V495 A496	K490-D492 PolarHBondContact O-N 3.27Å; D492-V495 PolarHBondContact O-N 2.89Å; D492-A496 WeakPolarHBondContact O-CB 3.44Å; D492-A496 PolarHBondContact O-N 3.48Å
493	C	79.9	Confident	77.4	Confident	57 Å²	57	69.9 Å²	69.9	39%	0.385	38%	0.378	S	S	.	.	H	α-helix	trans	-69.2	-34.3	172.3	-62.8	0	0	0	0	111.9	F488 K490 K491 H497	F488-C493 HydrophobicContact CB-CB 3.96Å; F488-C493 HydrophobicContact CD1-CB 3.88Å; F488-C493 HydrophobicContact CG-CB 4.22Å; K490-C493 HydrophobicContact CB-CB 4.45Å; K490-C493 WeakPolarHBondContact O-CB 3.24Å; K490-C493 PolarHBondContact O-N 2.96Å; K491-C493 VanDerWaalsContact C-N 3.25Å; K491-C493 PolarHBondContact O-N 3.29Å; C493-H497 WeakPolarHBondContact O-CB 3.18Å; C493-H497 PolarHBondContact O-N 2.85Å
494	V	79.8	Confident	77.5	Confident	16 Å²	16	73.6 Å²	73.6	10%	0.097	39%	0.394	C	S	.	.	H	α-helix	trans	-67.1	-43.9	171.3	-169.9	0	0	0	0	111.3	F479 C481 F488 K490 K491 H497 K498	F479-V494 HydrophobicContact CB-CG2 3.53Å; F479-V494 VanDerWaalsContact O-CG2 3.29Å; F479-V494 WeakPolarHBondContact O-CG2 3.23Å; C481-V494 HydrophobicContact CB-CG1 4.08Å; F488-V494 HydrophobicContact CB-CG2 3.82Å; F488-V494 HydrophobicContact CD2-CB 4.46Å; F488-V494 HydrophobicContact CD2-CG2 3.76Å; F488-V494 HydrophobicContact CG-CG2 4.06Å; K490-V494 PolarHBondContact O-N 3.15Å; K491-V494 WeakPolarHBondContact O-CA 3.12Å; K491-V494 WeakPolarHBondContact O-CB 3.43Å; K491-V494 PolarHBondContact O-N 3.15Å; V494-H497 PolarHBondContact O-N 3.14Å; V494-K498 PolarHBondContact O-N 3.35Å
495	V	79.5	Confident	77.5	Confident	92 Å²	92	74.4 Å²	74.4	56%	0.558	40%	0.397	S	S	*	.	H	α-helix	trans	-63.6	-49.4	178.4	176.4	0	0	0	0	110.4	K491 D492 H497 K498 A499	K491-V495 PolarHBondContact O-N 2.88Å; D492-V495 PolarHBondContact O-N 2.89Å; V495-H497 PolarHBondContact O-N 2.81Å; V495-K498 PolarHBondContact O-N 3.22Å; V495-A499 WeakPolarHBondContact O-CB 3.3Å; V495-A499 PolarHBondContact O-N 3.31Å
496	A	82.1	Confident	77.9	Confident	41 Å²	41	74.3 Å²	74.3	34%	0.339	39%	0.385	S	S	.	.	H	α-helix	trans	-64.4	-23.8	175.1	0	0	0	0	0	113.1	D492 K500	D492-A496 WeakPolarHBondContact O-CB 3.44Å; D492-A496 PolarHBondContact O-N 3.48Å; A496-K500 WeakPolarHBondContact O-CB 3.32Å; A496-K500 VanDerWaalsContact O-CD 3.26Å; A496-K500 WeakPolarHBondContact O-CD 3.4Å; A496-K500 WeakPolarHBondContact O-CG 3.24Å; A496-K500 PolarHBondContact O-N 2.88Å
497	H	82.4	Confident	78.3	Confident	30 Å²	30	73.1 Å²	73.1	14%	0.139	38%	0.383	C	S	.	.	H	α-helix	trans	-78.6	-48.7	172.8	178.9	58.8	0	0	0	112.5	C484 F488 C493 V494 V495 A499 K500 S501	C484-H497 PolarHBondContact SG-NE2 2.9Å; F488-H497 HydrophobicContact CE1-CB 3.98Å; F488-H497 HydrophobicContact CE2-CB 4.12Å; F488-H497 AromaticContact CE2-CD2 3.55Å; F488-H497 AromaticContact CE2-CG 3.9Å; F488-H497 HydrophobicContact CZ-CB 3.6Å; F488-H497 AromaticContact CZ-CD2 3.33Å; F488-H497 WeakPolarHBondContact CZ-CD2 3.18Å; F488-H497 AromaticContact CZ-CG 3.29Å; F488-H497 AromaticContact CZ-ND1 3.86Å; F488-H497 AromaticContact CZ-NE2 3.9Å; C493-H497 WeakPolarHBondContact O-CB 3.18Å; C493-H497 PolarHBondContact O-N 2.85Å; V494-H497 PolarHBondContact O-N 3.14Å; V495-H497 PolarHBondContact O-N 2.81Å; H497-A499 PolarHBondContact O-N 2.95Å; H497-K500 PolarHBondContact O-N 3.41Å; H497-S501 PolarHBondContact CE1-OG 3.4Å; H497-S501 PolarHBondContact ND1-OG 2.8Å; H497-S501 PolarHBondContact NE2-OG 3.45Å; H497-S501 PolarHBondContact O-N 3.18Å; H497-S501 PolarHBondContact O-OG 3.36Å
498	K	79.3	Confident	78.3	Confident	28 Å²	28	71.1 Å²	71.1	12%	0.122	38%	0.384	C	S	.	.	H	α-helix	trans	-50.8	-48.2	171.3	-81.6	-164.5	170.5	-169.3	0	109.6	I483 V494 V495 K500 S501 H502 L506 E509	I483-K498 HydrophobicContact CD1-CD 4.3Å; I483-K498 HydrophobicContact CD1-CG 4.17Å; V494-K498 PolarHBondContact O-N 3.35Å; V495-K498 PolarHBondContact O-N 3.22Å; K498-K500 PolarHBondContact O-N 3.21Å; K498-K500 VanDerWaalsContact O-N 3.16Å; K498-S501 PolarHBondContact O-N 2.84Å; K498-H502 CarbonylContact O-C 3.1Å; K498-H502 WeakPolarHBondContact O-CA 3.24Å; K498-H502 PolarHBondContact O-N 3Å; K498-L506 HydrophobicContact CB-CD1 3.62Å; K498-L506 HydrophobicContact CB-CD2 4.26Å; K498-L506 HydrophobicContact CB-CG 3.91Å; K498-L506 HydrophobicContact CD-CD2 3.74Å; K498-L506 HydrophobicContact CD-CG 4.17Å; K498-E509 VanDerWaalsContact NZ-CD 3.29Å; K498-E509 IonicContact NZ-OE1 3.49Å; K498-E509 PolarHBondContact NZ-OE1 3.16Å; K498-E509 IonicContact NZ-OE2 3.47Å; K498-E509 PolarHBondContact NZ-OE2 3.49Å
499	A	80.6	Confident	78.6	Confident	54 Å²	54	73.9 Å²	73.9	45%	0.446	40%	0.398	S	S	.	.	H	α-helix	trans	-61.5	-22.1	179.1	0	0	0	0	0	115.4	V495 H497 L506	V495-A499 WeakPolarHBondContact O-CB 3.3Å; V495-A499 PolarHBondContact O-N 3.31Å; H497-A499 PolarHBondContact O-N 2.95Å; A499-L506 HydrophobicContact CB-CD1 4.04Å
500	K	78.4	Confident	78.7	Confident	175 Å²	175	73.1 Å²	73.1	76%	0.761	40%	0.403	S	S	*	.	H	α-helix	trans	-108.7	-16.5	-175.7	-69.2	173.4	-170.9	173.8	0	114.5	A496 H497 K498	A496-K500 WeakPolarHBondContact O-CB 3.32Å; A496-K500 VanDerWaalsContact O-CD 3.26Å; A496-K500 WeakPolarHBondContact O-CD 3.4Å; A496-K500 WeakPolarHBondContact O-CG 3.24Å; A496-K500 PolarHBondContact O-N 2.88Å; H497-K500 PolarHBondContact O-N 3.41Å; K498-K500 PolarHBondContact O-N 3.21Å; K498-K500 VanDerWaalsContact O-N 3.16Å
501	S	76.4	Confident	78.8	Confident	48 Å²	48	73.4 Å²	73.4	34%	0.336	41%	0.409	S	S	.	.	H	α-helix	trans	-127.2	-16.9	-176.4	60.2	0	0	0	0	114.3	H497 K498 P503	H497-S501 PolarHBondContact CE1-OG 3.4Å; H497-S501 PolarHBondContact ND1-OG 2.8Å; H497-S501 PolarHBondContact NE2-OG 3.45Å; H497-S501 PolarHBondContact O-N 3.18Å; H497-S501 PolarHBondContact O-OG 3.36Å; K498-S501 PolarHBondContact O-N 2.84Å; S501-P503 VanDerWaalsContact C-CD 3.46Å
502	H	80.8	Confident	79	Confident	38 Å²	38	70.2 Å²	70.2	18%	0.176	41%	0.407	C	S	.	.			trans	-136.1	48.4	177.9	-51.6	-59.4	0	0	0	112	I483 C484 K498 E504 V505 L506	I483-H502 HydrophobicContact CD1-CB 3.57Å; I483-H502 HydrophobicContact CG2-CB 4.3Å; C484-H502 WeakPolarHBondContact CB-NE2 3.25Å; C484-H502 PolarHBondContact SG-NE2 2.78Å; K498-H502 CarbonylContact O-C 3.1Å; K498-H502 WeakPolarHBondContact O-CA 3.24Å; K498-H502 PolarHBondContact O-N 3Å; H502-E504 VanDerWaalsContact C-N 3.32Å; H502-E504 PolarHBondContact O-N 2.81Å; H502-V505 HydrophobicContact CB-CB 4.29Å; H502-V505 HydrophobicContact CB-CG2 4.29Å; H502-V505 PolarHBondContact O-N 3.05Å; H502-L506 PolarHBondContact O-N 3.37Å
503	P	77.4	Confident	78.7	Confident	52 Å²	52	67.7 Å²	67.7	34%	0.338	40%	0.403	S	S	.	.	H	α-helix	trans	-56.7	-45.9	-179.4	24.6	-33.6	0	0	0	111.4	S501 V505 L506 I507	S501-P503 VanDerWaalsContact C-CD 3.46Å; P503-V505 VanDerWaalsContact C-N 3.25Å; P503-V505 PolarHBondContact O-N 3.33Å; P503-L506 PolarHBondContact O-N 3.27Å; P503-L506 VanDerWaalsContact O-N 3.09Å; P503-I507 VanDerWaalsContact O-CG1 3.29Å; P503-I507 WeakPolarHBondContact O-CG1 3.49Å; P503-I507 PolarHBondContact O-N 3.47Å
504	E	78.6	Confident	78.3	Confident	140 Å²	140	69.9 Å²	69.9	65%	0.654	41%	0.411	S	S	*	.	H	α-helix	trans	-52.7	-40.2	177.7	-48	-45	125	0	0	113.4	H502 I507 A508	H502-E504 VanDerWaalsContact C-N 3.32Å; H502-E504 PolarHBondContact O-N 2.81Å; E504-I507 PolarHBondContact O-N 3.5Å; E504-A508 WeakPolarHBondContact O-CB 3.44Å; E504-A508 PolarHBondContact O-N 2.88Å
505	V	75.2	Confident	77.7	Confident	64 Å²	64	72 Å²	72	39%	0.388	43%	0.429	S	S	.	.	H	α-helix	trans	-75.6	-36.8	-178.3	-173.8	0	0	0	0	110.8	I483 H502 P503 A508 E509	I483-V505 HydrophobicContact CD1-CB 3.75Å; I483-V505 HydrophobicContact CD1-CG1 3.58Å; I483-V505 HydrophobicContact CD1-CG2 4.23Å; I483-V505 HydrophobicContact CG1-CG1 4.16Å; I483-V505 HydrophobicContact CG2-CG2 4.36Å; H502-V505 HydrophobicContact CB-CB 4.29Å; H502-V505 HydrophobicContact CB-CG2 4.29Å; H502-V505 PolarHBondContact O-N 3.05Å; P503-V505 VanDerWaalsContact C-N 3.25Å; P503-V505 PolarHBondContact O-N 3.33Å; V505-A508 PolarHBondContact O-N 2.9Å; V505-E509 VanDerWaalsContact O-CB 3.25Å; V505-E509 WeakPolarHBondContact O-CB 3.42Å; V505-E509 PolarHBondContact O-N 2.89Å
506	L	78.2	Confident	76.6	Confident	49 Å²	49	69.9 Å²	69.9	26%	0.257	43%	0.426	S	S	.	.	H	α-helix	trans	-68.1	-35.3	171.6	-83.1	178.1	0	0	0	112.6	K498 A499 H502 P503 E509 A510	K498-L506 HydrophobicContact CB-CD1 3.62Å; K498-L506 HydrophobicContact CB-CD2 4.26Å; K498-L506 HydrophobicContact CB-CG 3.91Å; K498-L506 HydrophobicContact CD-CD2 3.74Å; K498-L506 HydrophobicContact CD-CG 4.17Å; A499-L506 HydrophobicContact CB-CD1 4.04Å; H502-L506 PolarHBondContact O-N 3.37Å; P503-L506 PolarHBondContact O-N 3.27Å; P503-L506 VanDerWaalsContact O-N 3.09Å; L506-E509 PolarHBondContact O-N 3.18Å; L506-A510 VanDerWaalsContact O-CB 3.26Å; L506-A510 WeakPolarHBondContact O-CB 3.37Å; L506-A510 PolarHBondContact O-N 3.44Å
507	I	77.8	Confident	75.2	Confident	90 Å²	90	71.2 Å²	71.2	46%	0.462	44%	0.437	S	S	.	.	H	α-helix	trans	-63.9	-44.8	174	-68.9	162.9	0	0	0	109	P503 E504 A510 L511	P503-I507 VanDerWaalsContact O-CG1 3.29Å; P503-I507 WeakPolarHBondContact O-CG1 3.49Å; P503-I507 PolarHBondContact O-N 3.47Å; E504-I507 PolarHBondContact O-N 3.5Å; I507-A510 PolarHBondContact O-N 3.4Å; I507-L511 HydrophobicContact CG2-CD1 3.78Å; I507-L511 HydrophobicContact CG2-CG 4.33Å; I507-L511 WeakPolarHBondContact O-CB 3.24Å; I507-L511 WeakPolarHBondContact O-CG 3.41Å; I507-L511 PolarHBondContact O-N 3.05Å
508	A	77.4	Confident	73.3	Confident	55 Å²	55	78.5 Å²	78.5	46%	0.455	47%	0.469	S	S	.	.	H	α-helix	trans	-63.1	-43.1	173	0	0	0	0	0	113.1	E504 V505 A510 L511 A512	E504-A508 WeakPolarHBondContact O-CB 3.44Å; E504-A508 PolarHBondContact O-N 2.88Å; V505-A508 PolarHBondContact O-N 2.9Å; A508-A510 VanDerWaalsContact C-N 3.33Å; A508-A510 PolarHBondContact O-N 3.45Å; A508-L511 PolarHBondContact O-N 3.4Å; A508-A512 VanDerWaalsContact O-CB 3.3Å; A508-A512 WeakPolarHBondContact O-CB 3.48Å; A508-A512 PolarHBondContact O-N 3.02Å
509	E	80.1	Confident	71.9	Confident	101 Å²	101	84.1 Å²	84.1	47%	0.472	50%	0.499	S	S	.	.	H	α-helix	trans	-61.8	-39.5	177.3	-164.4	169.8	-177.1	0	0	110.9	K498 V505 L506 A513	K498-E509 VanDerWaalsContact NZ-CD 3.29Å; K498-E509 IonicContact NZ-OE1 3.49Å; K498-E509 PolarHBondContact NZ-OE1 3.16Å; K498-E509 IonicContact NZ-OE2 3.47Å; K498-E509 PolarHBondContact NZ-OE2 3.49Å; V505-E509 VanDerWaalsContact O-CB 3.25Å; V505-E509 WeakPolarHBondContact O-CB 3.42Å; V505-E509 PolarHBondContact O-N 2.89Å; L506-E509 PolarHBondContact O-N 3.18Å; E509-A513 WeakPolarHBondContact O-CB 3.35Å; E509-A513 PolarHBondContact O-N 3.36Å; E509-A513 VanDerWaalsContact O-N 3.12Å
510	A	77.6	Confident	70.4	Confident	51 Å²	51	87 Å²	87	42%	0.421	51%	0.511	S	S	.	.	H	α-helix	trans	-75.5	-39.4	175.8	0	0	0	0	0	113.8	L506 I507 A508 A512 A513 N514	L506-A510 VanDerWaalsContact O-CB 3.26Å; L506-A510 WeakPolarHBondContact O-CB 3.37Å; L506-A510 PolarHBondContact O-N 3.44Å; I507-A510 PolarHBondContact O-N 3.4Å; A508-A510 VanDerWaalsContact C-N 3.33Å; A508-A510 PolarHBondContact O-N 3.45Å; A510-A512 VanDerWaalsContact C-N 3.34Å; A510-A513 PolarHBondContact O-N 2.83Å; A510-N514 WeakPolarHBondContact O-CB 3.35Å; A510-N514 VanDerWaalsContact O-CG 3.29Å; A510-N514 PolarHBondContact O-N 3.14Å; A510-N514 PolarHBondContact O-ND2 3.15Å
511	L	79.2	Confident	68.5	Low	111 Å²	111	84.9 Å²	84.9	58%	0.581	51%	0.513	S	S	*	.	H	α-helix	trans	-64.9	-39.1	174.9	-73.8	170.9	0	0	0	111.3	I507 A508 N514 A515	I507-L511 HydrophobicContact CG2-CD1 3.78Å; I507-L511 HydrophobicContact CG2-CG 4.33Å; I507-L511 WeakPolarHBondContact O-CB 3.24Å; I507-L511 WeakPolarHBondContact O-CG 3.41Å; I507-L511 PolarHBondContact O-N 3.05Å; A508-L511 PolarHBondContact O-N 3.4Å; L511-N514 PolarHBondContact O-N 3.01Å; L511-A515 WeakPolarHBondContact O-CB 3.13Å; L511-A515 PolarHBondContact O-N 3.12Å
512	A	76.9	Confident	67.3	Low	64 Å²	64	88.6 Å²	88.6	53%	0.529	54%	0.536	S	S	.	.	H	α-helix	trans	-64.8	-42.2	173.2	0	0	0	0	0	112.2	A508 A510 N514 A515 G516	A508-A512 VanDerWaalsContact O-CB 3.3Å; A508-A512 WeakPolarHBondContact O-CB 3.48Å; A508-A512 PolarHBondContact O-N 3.02Å; A510-A512 VanDerWaalsContact C-N 3.34Å; A512-N514 PolarHBondContact O-N 3.34Å; A512-A515 PolarHBondContact O-N 2.98Å; A512-G516 PolarHBondContact O-N 3.15Å
513	A	75.8	Confident	65.1	Low	66 Å²	66	91.9 Å²	91.9	55%	0.545	57%	0.569	S	S	.	*	H	α-helix	trans	-61.4	-42.5	174.8	0	0	0	0	0	112.3	E509 A510 G516	E509-A513 WeakPolarHBondContact O-CB 3.35Å; E509-A513 PolarHBondContact O-N 3.36Å; E509-A513 VanDerWaalsContact O-N 3.12Å; A510-A513 PolarHBondContact O-N 2.83Å; A513-G516 PolarHBondContact O-N 2.92Å
514	N	71	Confident	63.5	Low	103 Å²	103	94.6 Å²	94.6	55%	0.551	59%	0.59	S	S	*	*	H	α-helix	trans	-67.4	-38.9	176.2	-70.1	-18.3	0	0	0	112.3	A510 L511 A512 G516 A517	A510-N514 WeakPolarHBondContact O-CB 3.35Å; A510-N514 VanDerWaalsContact O-CG 3.29Å; A510-N514 PolarHBondContact O-N 3.14Å; A510-N514 PolarHBondContact O-ND2 3.15Å; L511-N514 PolarHBondContact O-N 3.01Å; A512-N514 PolarHBondContact O-N 3.34Å; N514-G516 VanDerWaalsContact C-N 3.3Å; N514-G516 PolarHBondContact O-N 2.86Å; N514-A517 PolarHBondContact O-N 2.88Å
515	A	67.5	Low	61.5	Low	59 Å²	59	95 Å²	95	49%	0.488	60%	0.596	S	S	.	*	H	α-helix	trans	-62.4	-37.1	175.5	0	0	0	0	0	112.2	L511 A512 A517 F518	L511-A515 WeakPolarHBondContact O-CB 3.13Å; L511-A515 PolarHBondContact O-N 3.12Å; A512-A515 PolarHBondContact O-N 2.98Å; A515-A517 PolarHBondContact O-N 3.04Å; A515-F518 PolarHBondContact O-N 3.08Å
516	G	56.3	Low	59.7	Low	48 Å²	48	100.8 Å²	100.8	50%	0.495	62%	0.623	S	S	.	*	H	α-helix	trans	-63.3	-24.6	175.4	0	0	0	0	0	114.6	A512 A513 N514	A512-G516 PolarHBondContact O-N 3.15Å; A513-G516 PolarHBondContact O-N 2.92Å; N514-G516 VanDerWaalsContact C-N 3.3Å; N514-G516 PolarHBondContact O-N 2.86Å
517	A	51.4	Low	57.7	Low	69 Å²	69	105.3 Å²	105.3	57%	0.57	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-13.5	-178.9	0	0	0	0	0	114.3	N514 A515	N514-A517 PolarHBondContact O-N 2.88Å; A515-A517 PolarHBondContact O-N 3.04Å
518	F	44.1	Very low	55.7	Low	184 Å²	184	108 Å²	108	81%	0.807	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.8	1.1	-177.3	-84.9	-80.7	0	0	0	114.7	A515	A515-F518 PolarHBondContact O-N 3.08Å
519	I	50.3	Low	54.3	Low	145 Å²	145	111.2 Å²	111.2	74%	0.744	67%	0.674	S	S	*	*	S	Bend	trans	-107.4	23.4	-176.5	-30.2	-176.8	0	0	0	112.3
520	T	47.7	Very low	51.9	Low	114 Å²	114	110.2 Å²	110.2	70%	0.699	69%	0.691	S	S	*	*			trans	-132.7	63.9	-179.9	61.4	0	0	0	0	113.2
521	T	38	Very low	49.7	Very low	131 Å²	131	115.2 Å²	115.2	80%	0.804	71%	0.711	S	S	*	*			trans	-120	127.6	156.7	43.7	0	0	0	0	109.1
522	P	52	Low	48.5	Very low	127 Å²	127	114.3 Å²	114.3	83%	0.825	71%	0.712	S	S	*	*			trans	-81.5	135.1	-172.7	31.5	-34.2	0	0	0	112
523	A	33.7	Very low	46.4	Very low	106 Å²	106	118.4 Å²	118.4	88%	0.876	73%	0.729	S	S	*	*			trans	-120.9	89.6	170	0	0	0	0	0	109.7
524	S	45.5	Very low	44.4	Very low	110 Å²	110	123.8 Å²	123.8	77%	0.769	74%	0.743	S	S	*	*			trans	-89.7	162.6	165.5	-64.8	0	0	0	0	110.4
525	L	36.3	Very low	42.5	Very low	149 Å²	149	123.4 Å²	123.4	78%	0.78	76%	0.755	S	S	*	*			trans	73.4	92.7	178.5	-60.9	166	0	0	0	116.2
526	L	36.8	Very low	40.6	Very low	184 Å²	184	127.3 Å²	127.3	96%	0.963	77%	0.767	S	S	*	*				-146.8	154.2	108.6	-102.4	169.2	0	0	0	109
527	E	36.9	Very low	39.4	Very low	145 Å²	145	131.9 Å²	131.9	68%	0.678	79%	0.785	S	S	*	*			trans	-124.5	139.5	-157.1	-84.1	-164.5	111.4	0	0	115.4
528	L	35.5	Very low	38.6	Very low	145 Å²	145	133.6 Å²	133.6	76%	0.759	80%	0.8	S	S	*	*			trans	61.9	175.4	140.4	-62.7	173.5	0	0	0	118.7
529	P	46.7	Very low	37.9	Very low	124 Å²	124	127.8 Å²	127.8	81%	0.805	79%	0.792	S	S	*	*			cis	-124.1	166.2	-26.5	19.3	2.6	0	0	0	113.7
530	G	30	Very low	37.2	Very low	80 Å²	80	129.4 Å²	129.4	83%	0.825	80%	0.798	S	S	*	*			trans	-168.4	127.2	166.9	0	0	0	0	0	111.5
531	N	32.6	Very low	36.4	Very low	156 Å²	156	132 Å²	132	83%	0.834	81%	0.808	S	S	*	*			trans	-134	-172.6	-160.3	-147.2	19.6	0	0	0	111.7
532	P	52.9	Low	36.2	Very low	92 Å²	92	128.8 Å²	128.8	60%	0.597	80%	0.801	S	S	*	*				-122.7	178	-96	39	-24.6	0	0	0	115.8
533	V	32.5	Very low	35.2	Very low	149 Å²	149	129.8 Å²	129.8	90%	0.903	80%	0.8	S	S	*	*			trans	-136.2	143	149.8	-177.1	0	0	0	0	108.8
534	Q	35.3	Very low	35.4	Very low	179 Å²	179	132.8 Å²	132.8	84%	0.836	80%	0.795	S	S	*	*			trans	-113.1	156.8	-177.7	-65	174	-46.7	0	0	112.3
535	A	30.1	Very low	34.6	Very low	96 Å²	96	134.3 Å²	134.3	79%	0.793	80%	0.8	S	S	*	*			trans	-160	101.2	153.1	0	0	0	0	0	112.6
536	D	28.7	Very low	34.4	Very low	140 Å²	140	130.1 Å²	130.1	75%	0.749	79%	0.792	S	S	*	*			trans	31	113.2	142.5	-74.6	-81.9	0	0	0	126
537	V	30.6	Very low	34.4	Very low	144 Å²	144	129.9 Å²	129.9	87%	0.873	79%	0.786	S	S	*	*			trans	49	173.4	130.2	-53.7	0	0	0	0	122.9
538	A	35.2	Very low	34	Very low	106 Å²	106	129.8 Å²	129.8	88%	0.876	79%	0.79	S	S	*	*			trans	-148.1	168.4	-160.1	0	0	0	0	0	114.3
539	G	28.8	Very low	33.7	Very low	62 Å²	62	126.1 Å²	126.1	64%	0.639	79%	0.788	S	S	*	*			trans	179.5	120.8	166.2	0	0	0	0	0	116.1
540	M	36.2	Very low	32.9	Very low	179 Å²	179	129.9 Å²	129.9	88%	0.882	79%	0.794	S	S	*	*			trans	50.1	158.1	142.9	-68.5	117.4	92.9	0	0	121
541	D	29.6	Very low	32.9	Very low	167 Å²	167	129.4 Å²	129.4	89%	0.893	78%	0.783	S	S	*	*			cis	-125	175.7	28	-55.8	-56.1	0	0	0	113.9
542	G	34	Very low	32.7	Very low	65 Å²	65	129.5 Å²	129.5	67%	0.67	78%	0.783	S	S	*	*			cis	166.1	164.4	-8.1	0	0	0	0	0	114.3
543	N	32.2	Very low	31.8	Very low	148 Å²	148	133.3 Å²	133.3	79%	0.791	79%	0.793	S	S	*	*			trans	73.8	142.4	169.5	-62.9	-15.6	0	0	0	121.4
544	H	36.9	Very low	31.7	Very low	168 Å²	168	134.3 Å²	134.3	78%	0.778	79%	0.792	S	S	*	*			cis	-173.7	168.2	-31.7	-117.3	-27.2	0	0	0	113.5
545	V	29.9	Very low	31.5	Very low	143 Å²	143	128.9 Å²	128.9	87%	0.867	78%	0.784	S	S	*	*			trans	69.9	138.1	170.9	-160.9	0	0	0	0	117.5
546	G	31.7	Very low	31.7	Very low	61 Å²	61	133 Å²	133	63%	0.629	79%	0.787	S	S	*	*			cis	148.2	120.8	-14	0	0	0	0	0	115.7
547	Q	35.3	Very low	31.8	Very low	178 Å²	178	134.1 Å²	134.1	83%	0.832	79%	0.793	S	S	*	*			trans	66.8	163.2	166.4	-63.6	-176.7	-101.5	0	0	117.4
548	D	28.4	Very low	31.8	Very low	143 Å²	143	130.7 Å²	130.7	77%	0.765	79%	0.787	S	S	*	*			cis	-166.9	174.3	-23.4	-92.7	-12.9	0	0	0	107.5
549	G	30.8	Very low	31.6	Very low	68 Å²	68	133.9 Å²	133.9	70%	0.701	78%	0.784	S	S	*	*			cis	165.8	-175.8	-2	0	0	0	0	0	112.7
550	H	28.5	Very low	31.7	Very low	203 Å²	203	139.5 Å²	139.5	94%	0.94	79%	0.793	S	S	*	*			trans	78.5	168.1	172.9	-134.4	-95.2	0	0	0	120.8
551	A	30.1	Very low	31.2	Very low	71 Å²	71	135.6 Å²	135.6	59%	0.587	78%	0.779	S	S	*	*			trans	-76.6	178.4	-166.8	0	0	0	0	0	115.1
552	D	28.7	Very low	31.1	Very low	157 Å²	157	133.2 Å²	133.2	84%	0.84	77%	0.77	S	S	*	*			cis	-154.8	-157.6	37	-148.2	-85.4	0	0	0	114.7
553	Q	34.5	Very low	30.9	Very low	172 Å²	172	138.5 Å²	138.5	80%	0.804	78%	0.778	S	S	*	*			trans	-110.5	-160	-159.9	-155.2	118.3	102.6	0	0	115.2
554	L	30.5	Very low	30.6	Very low	171 Å²	171	139.8 Å²	139.8	90%	0.895	78%	0.779	S	S	*	*			trans	79.7	138.2	-173.9	-49.6	173.6	0	0	0	115.2
555	G	29.8	Very low	30.1	Very low	65 Å²	65	137.6 Å²	137.6	67%	0.67	78%	0.777	S	S	*	*			cis	166.1	168.5	-6.1	0	0	0	0	0	112.3
556	Q	35.4	Very low	30.1	Very low	182 Å²	182	135.9 Å²	135.9	85%	0.85	77%	0.772	S	S	*	*			trans	73	110.8	179.6	-56.2	172.9	22.5	0	0	114.4
557	D	29.6	Very low	30.5	Very low	164 Å²	164	138.7 Å²	138.7	88%	0.877	78%	0.779	S	S	*	*				93.2	134.6	57.6	-72	-41.1	0	0	0	111.8
558	G	30.8	Very low	30.2	Very low	72 Å²	72	138.5 Å²	138.5	74%	0.742	78%	0.778	S	S	*	*			cis	-154	-177.8	4	0	0	0	0	0	113.6
559	Q	32.1	Very low	30.2	Very low	173 Å²	173	138.8 Å²	138.8	81%	0.808	78%	0.784	S	S	*	*			trans	-96.4	152.6	-166.1	-59.4	166.6	-8.8	0	0	113.9
560	H	29.5	Very low	30.2	Very low	179 Å²	179	140.9 Å²	140.9	83%	0.829	78%	0.783	S	S	*	*				-171.5	123.6	129.9	-111.5	-87.5	0	0	0	107.6
561	V	27.5	Very low	30.5	Very low	98 Å²	98	138.6 Å²	138.6	59%	0.594	78%	0.778	S	S	*	*			cis	66.1	99.5	44	-172.6	0	0	0	0	109.5
562	T	26.6	Very low	30.5	Very low	116 Å²	116	143.8 Å²	143.8	71%	0.712	79%	0.794	S	S	*	*				-154.3	154.4	69.4	39	0	0	0	0	116.6
563	Q	30.3	Very low	30.6	Very low	176 Å²	176	139.4 Å²	139.4	82%	0.822	79%	0.786	S	S	*	*				56.4	112.5	129.3	-156.7	154.3	89.5	0	0	118
564	Q	26.2	Very low	30.4	Very low	176 Å²	176	140.6 Å²	140.6	82%	0.822	79%	0.792	S	S	*	*				52.5	138.5	57.7	-120.7	-168.5	12.4	0	0	111.8
565	V	26.3	Very low	30.5	Very low	121 Å²	121	139.9 Å²	139.9	73%	0.733	79%	0.789	S	S	*	*			cis	-153.2	154	27.4	-176.8	0	0	0	0	109
566	S	29.3	Very low	31.3	Very low	108 Å²	108	142.3 Å²	142.3	76%	0.755	79%	0.793	S	S	*	*			trans	-86.8	148	169.8	-44.5	0	0	0	0	111.6
567	P	39.9	Very low	31.2	Very low	120 Å²	120	138.5 Å²	138.5	78%	0.779	79%	0.786	S	S	*	*				-156.3	152.1	87.3	39.2	-19.5	0	0	0	119
568	Q	29.2	Very low	31.6	Very low	173 Å²	173	138.8 Å²	138.8	81%	0.808	79%	0.787	S	S	*	*			trans	-7.6	123.2	140.5	-178.5	179.6	30.2	0	0	120.2
569	V	28.4	Very low	31.7	Very low	149 Å²	149	143.3 Å²	143.3	90%	0.903	79%	0.788	S	S	*	*			trans	-143.6	162.9	143.2	175.1	0	0	0	0	108.2
570	V	31.8	Very low	31.6	Very low	112 Å²	112	140.8 Å²	140.8	68%	0.679	79%	0.785	S	S	*	*			trans	-121.5	158.6	-163.1	168.5	0	0	0	0	112.9
571	L	33.3	Very low	31.7	Very low	156 Å²	156	139.8 Å²	139.8	82%	0.817	78%	0.782	S	S	*	*			trans	72.6	108.9	166	-89.7	162	0	0	0	118.9
572	L	31.3	Very low	31.9	Very low	179 Å²	179	143.5 Å²	143.5	94%	0.937	79%	0.793	S	S	*	*				-161.9	152.7	106.6	-98.9	166.2	0	0	0	108.8
573	G	29.3	Very low	32.6	Very low	65 Å²	65	144.1 Å²	144.1	67%	0.67	80%	0.797	S	S	*	*			trans	-114	154.6	-166	0	0	0	0	0	115.6
574	Q	31.7	Very low	33.1	Very low	198 Å²	198	141.2 Å²	141.2	93%	0.925	79%	0.793	S	S	*	*			trans	-155.8	129	160.7	-105.9	158	41.8	0	0	109.7
575	D	31.3	Very low	33.7	Very low	156 Å²	156	138.8 Å²	138.8	83%	0.834	79%	0.79	S	S	*	*			trans	-69.4	172.2	169.2	-70.2	-73.1	0	0	0	111.5
576	P	47.4	Very low	34	Very low	116 Å²	116	139.5 Å²	139.5	75%	0.753	80%	0.795	S	S	*	*			cis	-129.2	-179.8	11.4	45.1	-28.7	0	0	0	113.4
577	S	33.5	Very low	34.7	Very low	101 Å²	101	141.8 Å²	141.8	71%	0.706	80%	0.797	S	S	*	*			cis	-174.5	158.9	45.1	45.1	0	0	0	0	114.7
578	L	38	Very low	34.1	Very low	171 Å²	171	140.8 Å²	140.8	90%	0.895	80%	0.799	S	S	*	*			trans	58.9	94.5	159.5	-63.3	179.3	0	0	0	119.6
579	H	33.6	Very low	34.5	Very low	167 Å²	167	140.6 Å²	140.6	77%	0.773	80%	0.802	S	S	*	*			trans	-68.3	159.1	168.3	-78.6	57.6	0	0	0	115.6
580	T	30.2	Very low	34.9	Very low	120 Å²	120	139.8 Å²	139.8	74%	0.736	80%	0.798	S	S	*	*			trans	67.7	165.4	140.9	55.6	0	0	0	0	119.1
581	M	31.1	Very low	35.4	Very low	157 Å²	157	139.8 Å²	139.8	77%	0.773	80%	0.8	S	S	*	*			cis	-130.5	160.7	12.7	-94.3	-56.6	-65.3	0	0	113.8
582	Q	31.8	Very low	35.3	Very low	176 Å²	176	140.4 Å²	140.4	82%	0.822	80%	0.803	S	S	*	*			trans	-95	173.7	164.6	-66.2	-176.3	3.6	0	0	112.1
583	V	40.1	Very low	35.2	Very low	129 Å²	129	138.9 Å²	138.9	78%	0.782	80%	0.795	S	S	*	*			trans	-61.6	158	179.9	-140.9	0	0	0	0	112.8
584	P	41	Very low	36.3	Very low	115 Å²	115	141.2 Å²	141.2	75%	0.747	80%	0.799	S	S	*	*				-145.8	178.1	104.9	39.3	-24.7	0	0	0	115.6
585	V	39.4	Very low	37.1	Very low	125 Å²	125	137.6 Å²	137.6	76%	0.758	79%	0.792	S	S	*	*			trans	-117.9	140.1	176.5	172.5	0	0	0	0	110
586	T	33.2	Very low	37	Very low	137 Å²	137	135.6 Å²	135.6	84%	0.84	79%	0.791	S	S	*	*			trans	-158.9	176.8	162.9	4	0	0	0	0	113.6
587	I	43.9	Very low	36.8	Very low	156 Å²	156	135.7 Å²	135.7	80%	0.8	79%	0.791	S	S	*	*			trans	-129	152.8	-158.3	-59.6	159.5	0	0	0	111.5
588	A	26	Very low	36.7	Very low	98 Å²	98	133.3 Å²	133.3	81%	0.81	78%	0.778	S	S	*	*			trans	-146.6	171.1	167.7	0	0	0	0	0	112.7
589	L	37.3	Very low	36.3	Very low	170 Å²	170	129.6 Å²	129.6	89%	0.89	76%	0.759	S	S	*	*			trans	-124.9	178.5	-158.7	-69.1	165.5	0	0	0	115.8
590	T	37.2	Very low	36.2	Very low	131 Å²	131	125.9 Å²	125.9	80%	0.804	74%	0.744	S	S	*	*			trans	-87.6	168.9	-175.4	53.8	0	0	0	0	114.9
591	P	42.8	Very low	36.4	Very low	112 Å²	112	127.1 Å²	127.1	73%	0.727	74%	0.742	S	S	*	*				-158.4	144.6	108.3	37.6	-17.5	0	0	0	120.3
592	I	32	Very low	36.6	Very low	170 Å²	170	127 Å²	127	87%	0.872	74%	0.739	S	S	*	*			trans	69.6	141.5	134.2	-58	171.5	0	0	0	123.4
593	D	29.2	Very low	36.7	Very low	147 Å²	147	126.3 Å²	126.3	79%	0.786	74%	0.736	S	S	*	*			trans	-60.3	171.1	179	-86.8	-77.1	0	0	0	118.5
594	P	52.3	Low	36.1	Very low	113 Å²	113	125.6 Å²	125.6	73%	0.734	73%	0.732	S	S	*	*			cis	-135.3	-143.3	24.1	37.3	-12.1	0	0	0	113.3
595	P	48.6	Very low	35.7	Very low	123 Å²	123	127.9 Å²	127.9	80%	0.799	73%	0.732	S	S	*	*			cis	-140	-141.6	-6.6	44.8	-21.8	0	0	0	116.7
596	S	28.2	Very low	35.8	Very low	114 Å²	114	129.2 Å²	129.2	80%	0.797	73%	0.734	S	S	*	*			trans	-152.1	174	176.6	-122.9	0	0	0	0	110.9
597	P	42.5	Very low	35.6	Very low	118 Å²	118	131.5 Å²	131.5	77%	0.766	74%	0.736	S	S	*	*			cis	-144	-165.7	30.3	42.4	-20.5	0	0	0	118.4
598	A	31.6	Very low	35.4	Very low	51 Å²	51	131.8 Å²	131.8	42%	0.421	74%	0.738	S	S	.	*			trans	78	174.1	157.3	0	0	0	0	0	118.8	R172	R172-A598 PolarHBondContact NH1-O 3Å; R172-A598 PolarHBondContact NH2-O 2.87Å
599	D	29.7	Very low	35.7	Very low	92 Å²	92	136 Å²	136	49%	0.492	74%	0.741	S	S	.	*			cis	-166.4	-173.6	-33.4	-109.1	42	0	0	0	108.1	R172	R172-D599 PolarHBondContact NH1-O 3.22Å
600	N	31.4	Very low	35.5	Very low	89 Å²	89	135.9 Å²	135.9	48%	0.476	74%	0.738	S	S	.	*			cis	179.5	175.6	-36.9	-172.3	-1.4	0	0	0	109.9
601	H	35.1	Very low	36.4	Very low	147 Å²	147	134.1 Å²	134.1	68%	0.681	73%	0.729	S	S	*	*			trans	65.2	132.4	-177.8	-66.4	-98.9	0	0	0	116.2
602	Q	34.8	Very low	36.1	Very low	154 Å²	154	134.5 Å²	134.5	72%	0.72	73%	0.729	S	S	*	*				71.8	138.9	55.6	-64	-169.4	67.9	0	0	113.2
603	Q	34.8	Very low	36.2	Very low	162 Å²	162	133.4 Å²	133.4	76%	0.757	72%	0.72	S	S	*	*			cis	-158	180	24.8	-144.4	172.9	-15.4	0	0	114.2
604	T	27.6	Very low	36.2	Very low	114 Å²	114	134.8 Å²	134.8	70%	0.699	72%	0.719	S	S	*	*			trans	-34.7	161.6	171.1	51.6	0	0	0	0	118.6
605	H	32.3	Very low	35.1	Very low	162 Å²	162	134.8 Å²	134.8	75%	0.75	72%	0.717	S	S	*	*				-177	165.7	62.1	-172.3	-114.2	0	0	0	113.5
606	L	40.6	Very low	34.4	Very low	153 Å²	153	137.8 Å²	137.8	80%	0.801	72%	0.72	S	S	*	*			trans	-103.4	144.9	171.6	-78	79.1	0	0	0	111.8
607	Q	30.4	Very low	34.5	Very low	186 Å²	186	139.7 Å²	139.7	87%	0.869	72%	0.717	S	S	*	*			trans	-155.4	157.2	144.6	-134.9	163.4	-1.5	0	0	113.8
608	L	39.8	Very low	34.9	Very low	162 Å²	162	139.7 Å²	139.7	85%	0.848	72%	0.717	S	S	*	*			trans	-98.7	148	-178.2	-63.6	122.4	0	0	0	111.6
609	Q	32.3	Very low	35.2	Very low	187 Å²	187	144 Å²	144	87%	0.874	73%	0.728	S	S	*	*			trans	-152.1	148	159.6	-156.3	88.3	29.6	0	0	111.1
610	M	33.1	Very low	35.3	Very low	166 Å²	166	148.1 Å²	148.1	82%	0.818	75%	0.748	S	S	*	*			trans	-141.1	-171.9	173.2	-71.4	-81.4	-73.1	0	0	106.3
611	P	55	Low	35.4	Very low	95 Å²	95	150.4 Å²	150.4	62%	0.617	76%	0.756	S	S	*	*			cis	-140.1	-172.6	-3.3	25.6	1.4	0	0	0	115.7
612	V	36.2	Very low	35.2	Very low	120 Å²	120	150.9 Å²	150.9	73%	0.727	76%	0.758	S	S	*	*			trans	62.8	160.7	150.1	-72.7	0	0	0	0	120.7
613	Q	33.9	Very low	34.9	Very low	146 Å²	146	150.3 Å²	150.3	68%	0.682	76%	0.759	S	S	*	*			cis	-159	-173.3	3.7	-134.5	167.9	57.5	0	0	113.8
614	F	29.1	Very low	34.5	Very low	177 Å²	177	147.5 Å²	147.5	78%	0.776	75%	0.754	S	S	*	*			trans	73.2	152	168.2	-68.1	-86.6	0	0	0	118.6
615	V	31.1	Very low	34.4	Very low	112 Å²	112	148.5 Å²	148.5	68%	0.679	75%	0.754	S	S	*	*			cis	179.6	137	-38.9	125.3	0	0	0	0	109.6
616	Q	33.7	Very low	34.1	Very low	187 Å²	187	148.7 Å²	148.7	87%	0.874	76%	0.755	S	S	*	*				178.5	169.3	125.7	-126.7	157.3	104.9	0	0	114.1
617	Q	29	Very low	33.4	Very low	154 Å²	154	147.3 Å²	147.3	72%	0.72	76%	0.758	S	S	*	*			trans	-135	-176	-178.6	-117.6	-170.1	33.6	0	0	107.6
618	P	51.6	Low	33.3	Very low	118 Å²	118	141.8 Å²	141.8	77%	0.766	75%	0.751	S	S	*	*			cis	-140.1	-164.9	26.1	43	-21.8	0	0	0	116.3
619	Q	38.7	Very low	32.8	Very low	141 Å²	141	139.1 Å²	139.1	66%	0.659	75%	0.746	S	S	*	*			trans	-89.9	158	-178.4	-49.3	164.4	0.7	0	0	112.9
620	I	30.7	Very low	32.9	Very low	178 Å²	178	137.6 Å²	137.6	91%	0.913	74%	0.74	S	S	*	*			trans	-136.6	160.6	140.1	-67.1	-168.2	0	0	0	107.8
621	Q	33.7	Very low	32.6	Very low	138 Å²	138	135.7 Å²	135.7	65%	0.645	74%	0.738	S	S	*	*			trans	-145.4	170.2	-162.5	-167.1	-178.1	86.4	0	0	109.6
622	Q	30.9	Very low	31.5	Very low	157 Å²	157	136.2 Å²	136.2	73%	0.734	74%	0.739	S	S	*	*			trans	76.4	158.9	168.8	-50.5	179.1	15.5	0	0	116.3
623	L	28.6	Very low	31.2	Very low	141 Å²	141	138.1 Å²	138.1	74%	0.738	74%	0.74	S	S	*	*			cis	-168.7	160.9	-23.1	-106	173.4	0	0	0	110.4
624	T	25.6	Very low	31.1	Very low	104 Å²	104	138.5 Å²	138.5	64%	0.638	74%	0.742	S	S	*	*			trans	71.7	104.2	140.1	-63.6	0	0	0	0	123.4
625	L	25.4	Very low	31.3	Very low	134 Å²	134	136.8 Å²	136.8	70%	0.702	74%	0.737	S	S	*	*			trans	71.6	151	132.8	-61.1	177	0	0	0	125.2
626	H	27.4	Very low	32.1	Very low	167 Å²	167	136.6 Å²	136.6	77%	0.773	74%	0.738	S	S	*	*			trans	74	150.3	166.9	-37.5	102.7	0	0	0	115.9
627	S	26	Very low	32.1	Very low	123 Å²	123	134.3 Å²	134.3	86%	0.86	73%	0.727	S	S	*	*			cis	-143.6	164.7	7.1	-53.8	0	0	0	0	110.9
628	G	27.4	Very low	32.1	Very low	71 Å²	71	134.6 Å²	134.6	73%	0.732	73%	0.733	S	S	*	*			trans	-97	169.2	-175.5	0	0	0	0	0	117.6
629	S	29.8	Very low	31.2	Very low	105 Å²	105	137 Å²	137	73%	0.734	73%	0.734	S	S	*	*			trans	179.7	139.3	173.2	-79.1	0	0	0	0	107.6
630	M	33.2	Very low	31.4	Very low	155 Å²	155	135.6 Å²	135.6	76%	0.764	74%	0.736	S	S	*	*			cis	-136.6	145.2	-7.5	-57.8	-62	-177.9	0	0	105.6
631	V	28.5	Very low	31.3	Very low	126 Å²	126	133.8 Å²	133.8	76%	0.764	73%	0.726	S	S	*	*				50.2	121.1	76.3	-175	0	0	0	0	111.4
632	T	30.9	Very low	32	Very low	106 Å²	106	133.1 Å²	133.1	65%	0.65	73%	0.733	S	S	*	*			cis	-159.9	150.8	44.6	-16.8	0	0	0	0	113.8
633	Q	31	Very low	32.3	Very low	160 Å²	160	129.9 Å²	129.9	75%	0.748	73%	0.726	S	S	*	*			trans	57	150.8	146.2	-75.5	172.3	-0.1	0	0	121.1
634	H	31.1	Very low	32.4	Very low	154 Å²	154	134.6 Å²	134.6	71%	0.713	74%	0.736	S	S	*	*			cis	-147.4	142.6	-0.2	-132.8	-61.9	0	0	0	110.9
635	Q	33.5	Very low	32.7	Very low	142 Å²	142	134.3 Å²	134.3	66%	0.664	74%	0.744	S	S	*	*			trans	-106.2	161.7	157.1	-147	-155.6	47.7	0	0	108.2
636	P	47.6	Very low	33.6	Very low	108 Å²	108	133.7 Å²	133.7	70%	0.701	75%	0.748	S	S	*	*				-151	150	89	37.3	-19.6	0	0	0	116.8
637	Q	33.4	Very low	33.8	Very low	139 Å²	139	133.5 Å²	133.5	65%	0.65	75%	0.747	S	S	*	*			trans	54.4	146.8	137.1	-56.4	-66.7	-8.8	0	0	120.5
638	L	30	Very low	34.1	Very low	160 Å²	160	135.6 Å²	135.6	84%	0.838	74%	0.743	S	S	*	*			cis	-140.4	163.1	28.3	-75.8	163.7	0	0	0	113.6
639	Q	31.5	Very low	34.7	Very low	169 Å²	169	140.5 Å²	140.5	79%	0.79	75%	0.747	S	S	*	*			trans	-94.7	179.8	166.8	-78.5	-171.3	-15.2	0	0	111.2
640	P	43	Very low	34.8	Very low	110 Å²	110	142.6 Å²	142.6	71%	0.714	75%	0.75	S	S	*	*			cis	-137.8	158.2	9.4	39.5	-20.4	0	0	0	119.3
641	M	29.4	Very low	34.7	Very low	140 Å²	140	144.1 Å²	144.1	69%	0.69	76%	0.755	S	S	*	*			trans	19.5	145.1	131.1	-62.2	-56.5	-81.8	0	0	120.8	P643	M641-P643 HydrophobicContact CE-CB 4.13Å; M641-P643 HydrophobicContact CE-CG 3.95Å
642	P	47.3	Very low	35.2	Very low	124 Å²	124	142.8 Å²	142.8	81%	0.805	76%	0.758	S	S	*	*			cis	-136.2	175.4	48.2	36.5	-16.4	0	0	0	117
643	P	37.3	Very low	35.5	Very low	89 Å²	89	146.1 Å²	146.1	58%	0.578	77%	0.766	S	S	*	*			trans	-107.9	160.8	-159.4	39.8	-33.3	0	0	0	116	M641	M641-P643 HydrophobicContact CE-CB 4.13Å; M641-P643 HydrophobicContact CE-CG 3.95Å
644	Y	30.6	Very low	35.8	Very low	240 Å²	240	146.2 Å²	146.2	94%	0.941	77%	0.77	S	S	*	*			trans	-143.2	132	147.1	-95.1	-80.6	0	0	0	109.4
645	A	31.6	Very low	36.2	Very low	99 Å²	99	146.2 Å²	146.2	82%	0.818	77%	0.774	S	S	*	*			trans	-102.5	139.3	-178.7	0	0	0	0	0	111.7
646	P	45	Very low	36.2	Very low	120 Å²	120	147.9 Å²	147.9	78%	0.779	78%	0.782	S	S	*	*			trans	-94.2	159.7	173.7	37.3	-33.8	0	0	0	112.1
647	H	31.2	Very low	35.7	Very low	163 Å²	163	150.1 Å²	150.1	76%	0.755	79%	0.785	S	S	*	*			trans	-146.7	100.6	160.8	-157.5	-88.6	0	0	0	115.4
648	Q	33.2	Very low	35.6	Very low	168 Å²	168	149.8 Å²	149.8	79%	0.785	79%	0.793	S	S	*	*			trans	51.4	-175.5	141.1	-126.1	-178.1	41	0	0	120.7
649	Q	39.3	Very low	35.8	Very low	174 Å²	174	150.9 Å²	150.9	81%	0.813	79%	0.791	S	S	*	*			trans	-125.7	142.6	-152.7	-62	177.6	-61.9	0	0	114.1
650	N	31.5	Very low	35.8	Very low	148 Å²	148	151.7 Å²	151.7	79%	0.791	80%	0.795	S	S	*	*			trans	53.1	104.1	131.3	-169.5	21.3	0	0	0	119.3
651	Q	32.8	Very low	36.1	Very low	188 Å²	188	151.8 Å²	151.8	88%	0.879	80%	0.795	S	S	*	*			trans	-130	144.4	147.7	-69.5	-167.5	8.7	0	0	110.3
652	A	37.5	Very low	36	Very low	98 Å²	98	151.6 Å²	151.6	81%	0.81	80%	0.801	S	S	*	*			trans	-90.4	139.9	179.2	0	0	0	0	0	111.4
653	Q	37.3	Very low	35.2	Very low	176 Å²	176	150.3 Å²	150.3	82%	0.822	80%	0.796	S	S	*	*			trans	-121.3	140.1	173.7	-68.5	-172.8	-4.8	0	0	111.3
654	I	38.3	Very low	35	Very low	161 Å²	161	154.5 Å²	154.5	83%	0.826	81%	0.808	S	S	*	*			trans	-104.6	119.4	177	-61.5	171	0	0	0	107.5
655	L	37.9	Very low	35.1	Very low	155 Å²	155	147.8 Å²	147.8	81%	0.812	80%	0.796	S	S	*	*			trans	-92.7	139.1	171	-100.9	70.7	0	0	0	111.2
656	Q	34.7	Very low	35.3	Very low	177 Å²	177	151.4 Å²	151.4	83%	0.827	80%	0.796	S	S	*	*			trans	-109.5	136.2	167.8	-68.4	-173.4	-14.2	0	0	109.8
657	M	36	Very low	34.7	Very low	155 Å²	155	151.2 Å²	151.2	76%	0.764	79%	0.793	S	S	*	*			trans	-81.3	140.3	174	-75.4	-70.3	-67.8	0	0	111	F659	M657-F659 HydrophobicContact CE-CE2 4.17Å; M657-F659 HydrophobicContact CE-CZ 4.2Å
658	T	31.3	Very low	34.8	Very low	132 Å²	132	151.5 Å²	151.5	81%	0.81	79%	0.794	S	S	*	*			trans	-133.7	156.8	165.5	52	0	0	0	0	110
659	F	35	Very low	34.9	Very low	183 Å²	183	151.3 Å²	151.3	80%	0.803	79%	0.793	S	S	*	*			trans	-137.7	142.1	-174.4	-82.4	-86.8	0	0	0	110.6	M657	M657-F659 HydrophobicContact CE-CE2 4.17Å; M657-F659 HydrophobicContact CE-CZ 4.2Å
660	Q	30.5	Very low	34.4	Very low	186 Å²	186	149.4 Å²	149.4	87%	0.869	79%	0.793	S	S	*	*			trans	161	163	146.3	-96	-177.7	14.9	0	0	110.3
661	P	50.3	Low	34.5	Very low	111 Å²	111	150 Å²	150	72%	0.721	79%	0.79	S	S	*	*			cis	-135.2	-144.7	-30.5	38.5	-19.6	0	0	0	111.5
662	V	27.9	Very low	34.5	Very low	136 Å²	136	149.4 Å²	149.4	82%	0.824	79%	0.788	S	S	*	*			trans	102.6	160.2	173.2	-172.8	0	0	0	0	114.7
663	S	30.5	Very low	34.5	Very low	98 Å²	98	152 Å²	152	69%	0.685	79%	0.786	S	S	*	*				-155.3	172.6	-126.9	53.5	0	0	0	0	117.7
664	Q	33.4	Very low	34.9	Very low	177 Å²	177	148.8 Å²	148.8	83%	0.827	78%	0.781	S	S	*	*			trans	93.8	140.1	159.8	-60.2	-166.2	5.8	0	0	122.2
665	S	32.1	Very low	34.5	Very low	99 Å²	99	149.2 Å²	149.2	69%	0.692	78%	0.783	S	S	*	*			trans	60.8	104.2	145.9	58.2	0	0	0	0	124.1
666	Q	36.5	Very low	34.2	Very low	175 Å²	175	149.9 Å²	149.9	82%	0.818	79%	0.787	S	S	*	*				62.1	120.3	120.2	-74.6	-171.6	1.1	0	0	124.2
667	T	31.5	Very low	33.9	Very low	116 Å²	116	146.5 Å²	146.5	71%	0.712	79%	0.789	S	S	*	*			trans	88.1	152.6	132.3	63.4	0	0	0	0	123.8
668	H	32.8	Very low	33.7	Very low	169 Å²	169	144.1 Å²	144.1	78%	0.782	79%	0.794	S	S	*	*			trans	73.1	90.2	162.5	-68	-72.5	0	0	0	123.5
669	H	35.8	Very low	33.9	Very low	164 Å²	164	142.7 Å²	142.7	76%	0.759	79%	0.789	S	S	*	*				51.6	103.5	109.8	-164.4	-63.1	0	0	0	122.3
670	V	29.4	Very low	34.7	Very low	134 Å²	134	140.4 Å²	140.4	81%	0.812	79%	0.793	S	S	*	*			trans	-144.7	121.9	160.6	-178.3	0	0	0	0	106.7
671	Q	33.2	Very low	35	Very low	159 Å²	159	138.4 Å²	138.4	74%	0.743	78%	0.783	S	S	*	*				71.8	156	70.7	-73.1	-120.9	34.5	0	0	115.9
672	Q	32.7	Very low	34	Very low	177 Å²	177	141.7 Å²	141.7	83%	0.827	79%	0.794	S	S	*	*			trans	-113.8	-156.2	-148.2	-60.2	-177.9	-24.1	0	0	116
673	I	36.8	Very low	34.5	Very low	152 Å²	152	141.8 Å²	141.8	78%	0.779	79%	0.785	S	S	*	*			trans	84.3	160.3	160.2	4.6	-175.7	0	0	0	117.5
674	P	46.8	Very low	34.6	Very low	109 Å²	109	142.9 Å²	142.9	71%	0.708	79%	0.788	S	S	*	*				-130.7	-165.5	-98.6	46.1	-31	0	0	0	115.6
675	I	28.6	Very low	34.4	Very low	170 Å²	170	141.1 Å²	141.1	87%	0.872	78%	0.782	S	S	*	*			trans	-124.1	148	170.1	-62.3	179	0	0	0	110.9
676	L	32.8	Very low	34.3	Very low	169 Å²	169	143.9 Å²	143.9	89%	0.885	78%	0.783	S	S	*	*			trans	-93.6	155.9	-175.2	-69.7	158.7	0	0	0	114.1
677	A	29.1	Very low	33.9	Very low	106 Å²	106	142 Å²	142	88%	0.876	78%	0.784	S	S	*	*			trans	-147.3	153	156.6	0	0	0	0	0	109.9
678	A	31.4	Very low	33.7	Very low	105 Å²	105	141.4 Å²	141.4	87%	0.868	79%	0.791	S	S	*	*			trans	-104.9	162.3	-162.9	0	0	0	0	0	115.4
679	S	34.4	Very low	33.5	Very low	101 Å²	101	137.9 Å²	137.9	71%	0.706	79%	0.791	S	S	*	*			trans	-79.9	178	175.4	-42.1	0	0	0	0	113.2
680	P	52	Low	34.1	Very low	135 Å²	135	136.2 Å²	136.2	88%	0.877	80%	0.795	S	S	*	*				-129.5	171	95	37.9	-31.3	0	0	0	114.1
681	Q	37.8	Very low	34.2	Very low	144 Å²	144	134.9 Å²	134.9	67%	0.673	79%	0.792	S	S	*	*			trans	-103.7	156.6	-178.7	-64.4	-173.6	2.5	0	0	113.2
682	L	29.2	Very low	35.6	Very low	181 Å²	181	132.2 Å²	132.2	95%	0.948	79%	0.788	S	S	*	*			trans	-139.5	150.4	133.4	-104.4	170.3	0	0	0	108.6
683	Q	38.5	Very low	36.5	Very low	137 Å²	137	129.3 Å²	129.3	64%	0.64	78%	0.784	S	S	*	*			trans	-115.8	148	-170.6	-57.1	173	10.2	0	0	110.9
684	T	30.9	Very low	36.1	Very low	122 Å²	122	129.1 Å²	129.1	75%	0.748	78%	0.784	S	S	*	*				173.4	138.3	109.9	33.1	0	0	0	0	114.9
685	M	29.2	Very low	35.3	Very low	140 Å²	140	129.9 Å²	129.9	69%	0.69	79%	0.786	S	S	*	*			trans	73.9	122.9	143	-68.2	-47.8	123.3	0	0	125.1
686	H	31.4	Very low	35.4	Very low	156 Å²	156	127 Å²	127	72%	0.722	78%	0.781	S	S	*	*			trans	92.6	113.5	135.1	-66.8	-38.2	0	0	0	124.2
687	T	27.7	Very low	35.2	Very low	135 Å²	135	123.1 Å²	123.1	83%	0.828	77%	0.774	S	S	*	*			trans	89.4	144.3	132.2	44.4	0	0	0	0	124
688	A	26.7	Very low	35.2	Very low	105 Å²	105	123.6 Å²	123.6	87%	0.868	77%	0.771	S	S	*	*			trans	83.5	115.2	159.2	0	0	0	0	0	120.6
689	A	29.7	Very low	35.3	Very low	95 Å²	95	127.4 Å²	127.4	79%	0.785	77%	0.771	S	S	*	*			trans	-113.1	-179.7	153.6	0	0	0	0	0	107.2
690	P	47.5	Very low	36.1	Very low	128 Å²	128	127.3 Å²	127.3	83%	0.831	77%	0.767	S	S	*	*			cis	-144.5	-171.7	36.8	41.5	-19.1	0	0	0	117.7
691	S	32.2	Very low	35.1	Very low	107 Å²	107	129 Å²	129	75%	0.748	76%	0.764	S	S	*	*			trans	-109.1	-158.4	177.5	55	0	0	0	0	111
692	P	61.5	Low	34.5	Very low	102 Å²	102	127.2 Å²	127.2	66%	0.662	76%	0.763	S	S	*	*			cis	-102.9	-122.6	-14.5	42.2	-28.1	0	0	0	110.1
693	P	52.2	Low	34.6	Very low	116 Å²	116	126.4 Å²	126.4	75%	0.753	75%	0.754	S	S	*	*			cis	-66.9	-171.7	-19.2	-26.2	41.5	0	0	0	116.3
694	L	29.3	Very low	34.2	Very low	148 Å²	148	126.4 Å²	126.4	78%	0.775	76%	0.759	S	S	*	*			cis	78.8	150.8	6.2	-48.1	-178.9	0	0	0	117.7
695	V	29.9	Very low	35.7	Very low	125 Å²	125	126 Å²	126	76%	0.758	76%	0.758	S	S	*	*			cis	-130.7	146.4	2.5	-95.6	0	0	0	0	109.3
696	S	29	Very low	35.6	Very low	109 Å²	109	125.2 Å²	125.2	76%	0.762	77%	0.767	S	S	*	*				64.9	137.4	76.5	-38	0	0	0	0	114.6
697	A	29.5	Very low	35.6	Very low	89 Å²	89	122.9 Å²	122.9	74%	0.736	77%	0.768	S	S	*	*			cis	-160.8	176.1	9.4	0	0	0	0	0	114.9
698	S	28.9	Very low	35.9	Very low	116 Å²	116	121 Å²	121	81%	0.811	77%	0.765	S	S	*	*			trans	69.7	106.2	146	-56.8	0	0	0	0	124.8
699	Q	34.3	Very low	36.1	Very low	185 Å²	185	122.3 Å²	122.3	86%	0.864	76%	0.758	S	S	*	*				-8.2	170.5	123.2	-83.9	-174.7	-24.1	0	0	121.3
700	P	49.8	Very low	36.2	Very low	98 Å²	98	128 Å²	128	64%	0.636	76%	0.759	S	S	*	*			cis	-148.3	-176.2	-23.1	39.8	-19.4	0	0	0	117.9
701	Q	30.9	Very low	35.6	Very low	170 Å²	170	129 Å²	129	79%	0.794	76%	0.757	S	S	*	*			trans	84.7	131.3	140.2	-91.3	-177	-16.4	0	0	126
702	T	27.1	Very low	35.7	Very low	108 Å²	108	127.3 Å²	127.3	66%	0.663	75%	0.75	S	S	*	*			trans	66.5	107.4	140.8	51.4	0	0	0	0	126
703	Q	30.7	Very low	34.2	Very low	164 Å²	164	131.4 Å²	131.4	77%	0.766	76%	0.758	S	S	*	*				59.2	114.9	119.1	-65.3	-174.1	-66.5	0	0	124.3
704	D	30.3	Very low	33.2	Very low	136 Å²	136	133.3 Å²	133.3	73%	0.727	76%	0.76	S	S	*	*				63.5	169.4	129.9	-53.2	-40.2	0	0	0	121
705	P	62.5	Low	33.6	Very low	114 Å²	114	132 Å²	132	74%	0.74	75%	0.753	S	S	*	*				-134.3	163.9	-62.7	39.7	-26	0	0	0	114.3
706	S	26.7	Very low	33.5	Very low	124 Å²	124	133 Å²	133	87%	0.867	76%	0.755	S	S	*	*			trans	-171.3	152.9	154.9	29.2	0	0	0	0	118.5
707	S	32	Very low	33.4	Very low	107 Å²	107	134 Å²	134	75%	0.748	75%	0.751	S	S	*	*			trans	-20.2	142.5	169.6	59.4	0	0	0	0	125.4
708	A	34	Very low	34.6	Very low	94 Å²	94	135 Å²	135	78%	0.777	75%	0.75	S	S	*	*			trans	63.3	164.6	130.6	0	0	0	0	0	119.7
709	N	31.3	Very low	34.7	Very low	133 Å²	133	134.9 Å²	134.9	71%	0.711	75%	0.745	S	S	*	*			cis	-167.5	170	21.5	-157.6	-16.3	0	0	0	112.4
710	R	29.8	Very low	34.4	Very low	214 Å²	214	133.8 Å²	133.8	81%	0.808	74%	0.744	S	S	*	*			trans	75.4	138.6	163.2	-61.2	177.5	171.3	175.6	-5.1	118.7
711	N	35.4	Very low	33.3	Very low	149 Å²	149	133.9 Å²	133.9	80%	0.797	75%	0.747	S	S	*	*			cis	95.4	143.8	20.2	-66.2	8	0	0	0	115.1
712	A	34	Very low	33.2	Very low	73 Å²	73	128.6 Å²	128.6	60%	0.603	73%	0.729	S	S	*	*			cis	-175.7	-176	-14.7	0	0	0	0	0	111.1
713	F	31.4	Very low	33.3	Very low	187 Å²	187	126.8 Å²	126.8	82%	0.82	72%	0.721	S	S	*	*			trans	76.7	149.6	171	-66.5	-83.8	0	0	0	116.4	L715	F713-L715 HydrophobicContact CD1-CD1 4.13Å
714	I	30.8	Very low	33.4	Very low	156 Å²	156	121.9 Å²	121.9	80%	0.8	70%	0.704	S	S	*	*			cis	-127.4	169.7	29.6	-78.6	176.1	0	0	0	114.5
715	L	37.3	Very low	34.5	Very low	121 Å²	121	119.1 Å²	119.1	63%	0.634	69%	0.694	S	S	*	*			trans	-40.6	172.3	174	-74.8	61	0	0	0	117.1	F713	F713-L715 HydrophobicContact CD1-CD1 4.13Å
716	D	28.5	Very low	32.9	Very low	146 Å²	146	122.4 Å²	122.4	78%	0.781	70%	0.699	S	S	*	*			cis	-155	-177	25.6	-135.8	-38.3	0	0	0	115.7
717	N	27.3	Very low	32.8	Very low	130 Å²	130	122.8 Å²	122.8	70%	0.695	70%	0.7	S	S	*	*			trans	-103.7	-164.3	-178.1	-136	-0	0	0	0	111.5
718	P	53.6	Low	32.5	Very low	109 Å²	109	121.2 Å²	121.2	71%	0.708	70%	0.701	S	S	*	*			cis	-138.7	149.3	3	40.3	-19.5	0	0	0	120.9
719	V	30.3	Very low	32.3	Very low	115 Å²	115	122.1 Å²	122.1	70%	0.697	70%	0.702	S	S	*	*			trans	31.4	126.6	134.3	-171.1	0	0	0	0	124.1
720	L	28.1	Very low	32.3	Very low	161 Å²	161	122.5 Å²	122.5	84%	0.843	70%	0.703	S	S	*	*			trans	-151.9	168.9	146	-73.4	-172.2	0	0	0	108.3
721	S	28.1	Very low	32.4	Very low	101 Å²	101	119.3 Å²	119.3	71%	0.706	70%	0.697	S	S	*	*			cis	80.6	136.2	24.1	-76.1	0	0	0	0	116.5
722	S	28	Very low	32.2	Very low	59 Å²	59	120 Å²	120	41%	0.413	70%	0.696	S	S	.	*			cis	-160.3	173.6	-9.8	-73.2	0	0	0	0	110	E222	E222-S722 WeakPolarHBondContact OE2-CB 3.5Å
723	S	29.3	Very low	31.8	Very low	70 Å²	70	121.4 Å²	121.4	49%	0.49	70%	0.697	S	S	.	*	B	Isolated β-bridge	trans	-164.2	123.2	169.6	-66.6	0	0	0	0	117.4	E222 L223	E222-S723 VanDerWaalsContact CD-CA 3.46Å; E222-S723 VanDerWaalsContact OE1-C 3.31Å; E222-S723 VanDerWaalsContact OE1-CA 3.26Å; E222-S723 WeakPolarHBondContact OE1-CA 3.29Å; E222-S723 WeakPolarHBondContact OE2-CA 3.2Å; E222-S723 PolarHBondContact OE2-N 3.48Å; L223-S723 CarbonylContact C-O 3.58Å; L223-S723 WeakPolarHBondContact CA-O 3.32Å; L223-S723 PolarHBondContact N-O 3.38Å; L223-S723 CarbonylContact O-C 3.59Å; L223-S723 PolarHBondContact O-N 3.15Å
724	S	32.5	Very low	31.6	Very low	61 Å²	61	121 Å²	121	43%	0.427	70%	0.698	S	S	.	*			trans	-75.7	166.1	-172.2	-129.5	0	0	0	0	118.4	E222	E222-S724 WeakPolarHBondContact OE1-CB 3.48Å; E222-S724 PolarHBondContact OE1-N 2.89Å
725	P	54.2	Low	31.5	Very low	77 Å²	77	118 Å²	118	50%	0.5	70%	0.696	S	S	.	*			trans	-107.8	-176.1	-169.5	41.5	-34.9	0	0	0	117.6	L223	L223-P725 HydrophobicContact CD1-CB 4.07Å; L223-P725 HydrophobicContact CD1-CG 4.04Å
726	Q	29	Very low	31.1	Very low	183 Å²	183	119.5 Å²	119.5	86%	0.855	71%	0.71	S	S	*	*			trans	88.4	124	171.4	-59.1	-172.5	24.8	0	0	115.2
727	C	24	Very low	31	Very low	132 Å²	132	115.7 Å²	115.7	89%	0.892	71%	0.705	S	S	*	*				80.3	114.1	59.7	-162	0	0	0	0	112.7
728	G	26.7	Very low	31.2	Very low	75 Å²	75	118.3 Å²	118.3	77%	0.773	71%	0.713	S	S	*	*			trans	-172.1	157	179.7	0	0	0	0	0	110.5
729	S	29	Very low	30.1	Very low	113 Å²	113	119.3 Å²	119.3	79%	0.79	72%	0.723	S	S	*	*			trans	-152.1	155.8	-169.4	-155	0	0	0	0	114.7
730	L	31.3	Very low	30	Very low	141 Å²	141	117 Å²	117	74%	0.738	72%	0.722	S	S	*	*			trans	71.6	141.3	159.7	-77.6	161.6	0	0	0	121.1
731	Q	32.2	Very low	30.1	Very low	146 Å²	146	115.6 Å²	115.6	68%	0.682	72%	0.72	S	S	*	*			trans	72.8	120.2	149.8	-76.9	169.2	16.6	0	0	117.2
732	Q	29.9	Very low	30.2	Very low	164 Å²	164	116.9 Å²	116.9	77%	0.766	72%	0.723	S	S	*	*				76.2	143.4	90.3	-75.6	179.5	3.7	0	0	112.8
733	T	26.8	Very low	30.2	Very low	102 Å²	102	124 Å²	124	63%	0.626	74%	0.741	S	S	*	*			cis	-162.3	154.7	12.5	0.9	0	0	0	0	112.2
734	E	27.3	Very low	30.1	Very low	180 Å²	180	129.7 Å²	129.7	84%	0.841	76%	0.76	S	S	*	*			trans	68.7	167.3	142.3	-69.7	174.7	152.9	0	0	123.8
735	A	28.7	Very low	30.2	Very low	93 Å²	93	134.4 Å²	134.4	77%	0.769	78%	0.776	S	S	*	*			trans	65.1	127.3	175.1	0	0	0	0	0	117.8
736	V	28.3	Very low	29.1	Very low	152 Å²	152	137.6 Å²	137.6	92%	0.921	79%	0.794	S	S	*	*			cis	105	133.1	33.4	166.2	0	0	0	0	112.4
737	G	27.4	Very low	29.1	Very low	65 Å²	65	132 Å²	132	67%	0.67	79%	0.785	S	S	*	*			trans	112.3	114	-176.3	0	0	0	0	0	111.2
738	E	30.9	Very low	29.6	Very low	186 Å²	186	135.6 Å²	135.6	87%	0.869	79%	0.788	S	S	*	*			cis	98.6	122.2	32.5	-69	-159.3	130.2	0	0	115.8
739	S	30.8	Very low	29.7	Very low	130 Å²	130	135.5 Å²	135.5	91%	0.909	79%	0.788	S	S	*	*			trans	80.4	153.6	154.1	79.1	0	0	0	0	121.7
740	G	27.4	Very low	29.8	Very low	67 Å²	67	137.9 Å²	137.9	69%	0.691	79%	0.791	S	S	*	*			trans	85.3	107.3	178.6	0	0	0	0	0	114.6
741	V	30.7	Very low	29.8	Very low	131 Å²	131	137.6 Å²	137.6	79%	0.794	80%	0.795	S	S	*	*			cis	80.1	142.4	15.6	-167.1	0	0	0	0	115.2
742	V	29.3	Very low	29.7	Very low	128 Å²	128	139.5 Å²	139.5	78%	0.776	80%	0.804	S	S	*	*			trans	85	112	-172.7	-172.1	0	0	0	0	112.2
743	W	28.8	Very low	29.8	Very low	207 Å²	207	136.2 Å²	136.2	78%	0.784	81%	0.805	S	S	*	*			cis	98.4	115.5	33.9	-78.6	119.8	0	0	0	113.2
744	E	27.5	Very low	30	Very low	191 Å²	191	140 Å²	140	89%	0.893	82%	0.816	S	S	*	*			trans	168.6	130	141.8	-95.3	178.3	140.6	0	0	106.9
745	Q	34.3	Very low	30.3	Very low	160 Å²	160	139.3 Å²	139.3	75%	0.748	82%	0.818	S	S	*	*			cis	105.3	151.7	16.6	-162.9	163.7	58.8	0	0	114.3
746	T	30.3	Very low	30.4	Very low	144 Å²	144	138.5 Å²	138.5	88%	0.883	82%	0.818	S	S	*	*			trans	78.3	139.9	-169.2	74.8	0	0	0	0	114.7
747	G	29.8	Very low	30.6	Very low	64 Å²	64	140.1 Å²	140.1	66%	0.66	82%	0.816	S	S	*	*			cis	-160	140.2	-7.9	0	0	0	0	0	109.9
748	Q	33.5	Very low	30.8	Very low	208 Å²	208	143.4 Å²	143.4	97%	0.972	82%	0.817	S	S	*	*				82.6	139.6	89.4	-87.6	-172.6	-24.2	0	0	116.2
749	G	29	Very low	30.9	Very low	74 Å²	74	142.8 Å²	142.8	76%	0.763	81%	0.813	S	S	*	*			trans	100.3	93.7	179.9	0	0	0	0	0	113.8
750	D	31.5	Very low	31	Very low	162 Å²	162	141.1 Å²	141.1	87%	0.866	80%	0.797	S	S	*	*			cis	98.1	160.2	23.2	-141.1	-28.9	0	0	0	114.6
751	V	31.7	Very low	31.2	Very low	135 Å²	135	146 Å²	146	82%	0.818	80%	0.802	S	S	*	*			trans	88	130.2	-178.9	-171.8	0	0	0	0	118.1
752	Q	30.4	Very low	31.4	Very low	187 Å²	187	147.8 Å²	147.8	87%	0.874	80%	0.802	S	S	*	*			trans	-111	154.8	172.6	-55.5	163.9	-102.2	0	0	111.2
753	A	30.4	Very low	31.6	Very low	94 Å²	94	147 Å²	147	78%	0.777	80%	0.797	S	S	*	*			trans	168.3	164.5	144.6	0	0	0	0	0	111
754	E	31.3	Very low	31.8	Very low	182 Å²	182	144.4 Å²	144.4	85%	0.85	80%	0.797	S	S	*	*			cis	-158.5	179.4	-43.8	-85.6	-142.1	142.9	0	0	106.1
755	D	34.5	Very low	32.6	Very low	166 Å²	166	146.6 Å²	146.6	89%	0.888	81%	0.812	S	S	*	*			trans	-63.1	159.6	-161.7	-65.6	-73.4	0	0	0	119.1
756	G	29.9	Very low	32.5	Very low	75 Å²	75	145.9 Å²	145.9	77%	0.773	82%	0.816	S	S	*	*			trans	-163.2	119.5	167.5	0	0	0	0	0	114
757	E	32.8	Very low	32.6	Very low	187 Å²	187	146 Å²	146	87%	0.874	81%	0.812	S	S	*	*			trans	-72.1	-177.3	167.9	-63.4	-177.1	93	0	0	110.5
758	I	32.2	Very low	32.8	Very low	134 Å²	134	150.6 Å²	150.6	69%	0.687	82%	0.82	S	S	*	*			cis	-162	144.8	30.9	-50.1	161.6	0	0	0	109.9
759	H	32.8	Very low	32.7	Very low	173 Å²	173	147.2 Å²	147.2	80%	0.801	81%	0.812	S	S	*	*			trans	63.4	168	158.3	-88.1	47	0	0	0	119.2
760	V	32.5	Very low	33	Very low	95 Å²	95	151.8 Å²	151.8	58%	0.576	82%	0.815	S	S	*	*			cis	-177.8	149.4	-45.7	132.2	0	0	0	0	107.2
761	Q	32.3	Very low	33.1	Very low	169 Å²	169	151.1 Å²	151.1	79%	0.79	81%	0.811	S	S	*	*			trans	64.6	161.3	173.3	-76	153.9	15.6	0	0	117
762	Q	35.5	Very low	33.2	Very low	168 Å²	168	152.2 Å²	152.2	79%	0.785	81%	0.811	S	S	*	*			cis	-174.9	177.4	-34.6	-176	161.5	-17.6	0	0	106.5
763	V	31.7	Very low	33.4	Very low	113 Å²	113	149.5 Å²	149.5	69%	0.685	81%	0.806	S	S	*	*			trans	91.9	98.6	159.3	-170.9	0	0	0	0	117.6
764	I	33.3	Very low	33.6	Very low	151 Å²	151	154.2 Å²	154.2	77%	0.774	81%	0.808	S	S	*	*			trans	53.4	114.5	134.3	-53.2	172.7	0	0	0	119.4
765	I	45	Very low	33.9	Very low	237 Å²	237	151.6 Å²	151.6	100%	1.215	80%	0.804	S	S	*	*				-124.3	0	112.6	-58.6	-174.8	0	0	0	107.3

Retrieved 765 of 765 residues in 232.9 ms (Link to these results)

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