A0A096MY78_PAPAN Loading...

Amyloid beta protein binding family B member 2

AlphaFold DB , UniProt , Accession A0A096MY78, Species PAPAN (Papio anubis, Olive baboon), Gene APBB2, Length 759 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	32.4	Very low	38.3	Very low	227 Å²	227	133.8 Å²	133.8	100%	1.118	81%	0.811	S	S	*	*				0	87.6	0	-65.6	165.3	178.9	0	0	105.9
2	S	35.6	Very low	37.9	Very low	101 Å²	101	134.1 Å²	134.1	71%	0.706	80%	0.804	S	S	*	*			cis	61.6	137.1	26.2	-25.7	0	0	0	0	110.7
3	E	35.3	Very low	37.6	Very low	186 Å²	186	135.2 Å²	135.2	87%	0.869	81%	0.813	S	S	*	*			cis	-134.4	-172	13.9	-67.3	146.8	44.7	0	0	109.6
4	V	35.2	Very low	37.4	Very low	125 Å²	125	136.4 Å²	136.4	76%	0.758	81%	0.812	S	S	*	*			cis	-154.9	179.5	9.9	83.3	0	0	0	0	111
5	L	44.6	Very low	36.9	Very low	154 Å²	154	133.5 Å²	133.5	81%	0.806	81%	0.809	S	S	*	*			trans	-136.7	-174.1	167.1	-68.2	173.3	0	0	0	107.9
6	P	60.7	Low	36.6	Very low	114 Å²	114	131.7 Å²	131.7	74%	0.74	80%	0.798	S	S	*	*			cis	-134	-161.2	-15	29.3	-4.5	0	0	0	113.5
7	A	40.1	Very low	36.3	Very low	87 Å²	87	134.6 Å²	134.6	72%	0.719	80%	0.798	S	S	*	*			trans	83.6	157.7	141.9	0	0	0	0	0	119.6
8	D	35.2	Very low	36.2	Very low	152 Å²	152	136.1 Å²	136.1	81%	0.813	80%	0.797	S	S	*	*			cis	-154.6	170.2	5.4	-150.4	-4	0	0	0	115.5
9	S	36.9	Very low	36.1	Very low	112 Å²	112	133.5 Å²	133.5	78%	0.783	79%	0.793	S	S	*	*			trans	69	142.7	168.1	72.3	0	0	0	0	118.2
10	G	32.7	Very low	35.7	Very low	73 Å²	73	133.3 Å²	133.3	75%	0.753	80%	0.798	S	S	*	*			cis	167.7	174.9	-1.6	0	0	0	0	0	109.8
11	V	32.4	Very low	35.4	Very low	141 Å²	141	132.6 Å²	132.6	86%	0.855	80%	0.8	S	S	*	*			cis	-154.2	155.6	-3.7	-173	0	0	0	0	108.5
12	D	34.2	Very low	35.2	Very low	137 Å²	137	125.1 Å²	125.1	73%	0.733	78%	0.781	S	S	*	*			trans	-67.3	165.3	-179.2	-57.8	-91.1	0	0	0	116.3
13	T	33.6	Very low	35	Very low	149 Å²	149	126.4 Å²	126.4	91%	0.914	79%	0.785	S	S	*	*				-169.5	170.8	81.1	24	0	0	0	0	115.6
14	L	35.3	Very low	34.9	Very low	152 Å²	152	123.6 Å²	123.6	80%	0.796	78%	0.781	S	S	*	*			trans	-133.3	163.5	-155.8	-128.9	165.6	0	0	0	112.5	V16	L14-V16 HydrophobicContact CD2-CG2 4.03Å
15	A	29.3	Very low	34.5	Very low	93 Å²	93	125 Å²	125	77%	0.769	78%	0.784	S	S	*	*			trans	-137	148.4	165.3	0	0	0	0	0	111.1
16	V	32	Very low	33.9	Very low	104 Å²	104	123.5 Å²	123.5	63%	0.63	78%	0.781	S	S	*	*			trans	-146	124	-140.6	161.7	0	0	0	0	114.5	L14	L14-V16 HydrophobicContact CD2-CG2 4.03Å
17	F	31.6	Very low	32.5	Very low	182 Å²	182	123.8 Å²	123.8	80%	0.798	78%	0.781	S	S	*	*			trans	61	176	146.5	-74.9	-149.7	0	0	0	116.8
18	M	35.4	Very low	32	Very low	161 Å²	161	126 Å²	126	79%	0.793	78%	0.78	S	S	*	*			cis	-161.2	176	-14.3	-116.6	-166.6	-41.7	0	0	106.7
19	A	34.3	Very low	31.9	Very low	86 Å²	86	128.7 Å²	128.7	71%	0.711	78%	0.779	S	S	*	*			cis	-166.6	161.5	-11.7	0	0	0	0	0	109.1
20	S	26.6	Very low	31.6	Very low	129 Å²	129	129.9 Å²	129.9	90%	0.902	78%	0.777	S	S	*	*			trans	-160.3	171.5	148.7	-159.4	0	0	0	0	111.4
21	S	30.6	Very low	31.5	Very low	119 Å²	119	131.8 Å²	131.8	83%	0.832	78%	0.778	S	S	*	*			trans	-136.3	158.5	-159.7	56.4	0	0	0	0	115.2
22	G	28	Very low	31.9	Very low	70 Å²	70	131 Å²	131	72%	0.722	78%	0.776	S	S	*	*			trans	165.4	73.7	170	0	0	0	0	0	119.6
23	T	31.6	Very low	31.7	Very low	128 Å²	128	129.4 Å²	129.4	79%	0.785	78%	0.782	S	S	*	*			trans	16.7	144.4	143.7	52.5	0	0	0	0	124.7
24	T	32.1	Very low	31.7	Very low	128 Å²	128	128.6 Å²	128.6	79%	0.785	78%	0.777	S	S	*	*			trans	66	126.5	154.1	49.8	0	0	0	0	118.7
25	D	27.4	Very low	31.6	Very low	155 Å²	155	127 Å²	127	83%	0.829	78%	0.776	S	S	*	*			cis	93	161.4	36.6	-163.8	19.2	0	0	0	113.8
26	V	31.3	Very low	31.8	Very low	122 Å²	122	128.7 Å²	128.7	74%	0.739	78%	0.779	S	S	*	*			trans	108.4	89.5	177.8	-174.6	0	0	0	0	117.7
27	T	31	Very low	31.7	Very low	119 Å²	119	130.8 Å²	130.8	73%	0.73	79%	0.787	S	S	*	*				77.4	80.7	126.8	-47.8	0	0	0	0	123.1
28	N	30.5	Very low	31.7	Very low	134 Å²	134	128 Å²	128	72%	0.717	78%	0.784	S	S	*	*				4.9	124.3	116.3	179.2	26.5	0	0	0	120
29	R	33.5	Very low	31.5	Very low	209 Å²	209	128.6 Å²	128.6	79%	0.789	79%	0.79	S	S	*	*				-177.8	144.2	115.1	-104.8	-168.3	159	161.1	-0.8	119.9
30	N	30.8	Very low	31.3	Very low	137 Å²	137	132 Å²	132	73%	0.733	80%	0.796	S	S	*	*			trans	76	131.5	147.8	-68.4	9.8	0	0	0	122.3
31	S	29.3	Very low	31.6	Very low	112 Å²	112	134 Å²	134	78%	0.783	80%	0.796	S	S	*	*			trans	-95.2	-168.8	172.6	23.9	0	0	0	0	111.8
32	P	42.4	Very low	31.8	Very low	125 Å²	125	140.2 Å²	140.2	81%	0.812	80%	0.801	S	S	*	*			cis	-125	170.8	-25.9	33.3	-17.2	0	0	0	113.1
33	A	28.9	Very low	32.1	Very low	103 Å²	103	142.8 Å²	142.8	85%	0.851	81%	0.808	S	S	*	*			trans	-149.4	140.4	165.5	0	0	0	0	0	113.2
34	T	33.7	Very low	32.4	Very low	132 Å²	132	141.5 Å²	141.5	81%	0.81	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-83.8	155.9	171.9	31.2	0	0	0	0	112.1
35	P	33.3	Very low	32.4	Very low	119 Å²	119	143.8 Å²	143.8	77%	0.773	81%	0.806	S	S	*	*	P	Polyproline II helix	trans	-76.6	136.6	178.1	31	-34.2	0	0	0	111.9
36	P	34.1	Very low	33	Very low	129 Å²	129	142.5 Å²	142.5	84%	0.838	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-74.8	138.2	167.7	30.8	-32.7	0	0	0	110.6
37	N	28.9	Very low	33.3	Very low	148 Å²	148	144.8 Å²	144.8	79%	0.791	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-85.8	164.1	178.4	-138.9	-18.7	0	0	0	111.3
38	T	32.3	Very low	33.6	Very low	122 Å²	122	145.9 Å²	145.9	75%	0.748	80%	0.802	S	S	*	*			trans	73.3	125.1	174.4	74.5	0	0	0	0	118.7
39	L	29.8	Very low	33.7	Very low	175 Å²	175	147.1 Å²	147.1	92%	0.916	81%	0.808	S	S	*	*			trans	-133.8	137.9	151.5	-97.4	173.1	0	0	0	108
40	N	32.1	Very low	33.8	Very low	156 Å²	156	144.3 Å²	144.3	83%	0.834	81%	0.809	S	S	*	*			trans	-84.5	138.2	-174.5	-89	-75.6	0	0	0	112.4	R42	N40-R42 PolarHBondContact O-N 2.65Å
41	L	32.8	Very low	34.1	Very low	173 Å²	173	141.9 Å²	141.9	91%	0.906	81%	0.808	S	S	*	*			trans	-78	100.3	174.2	-74.6	166.7	0	0	0	111.5
42	R	33.6	Very low	34.3	Very low	248 Å²	248	145.2 Å²	145.2	94%	0.936	81%	0.811	S	S	*	*			trans	-169.7	97.2	154.5	-115.3	177.1	-176.1	-157.9	1.7	115.1	N40	N40-R42 PolarHBondContact O-N 2.65Å
43	S	34.2	Very low	34	Very low	124 Å²	124	147.2 Å²	147.2	87%	0.867	81%	0.813	S	S	*	*			trans	-164.7	152.8	142.9	55.7	0	0	0	0	109.8
44	S	37.6	Very low	34	Very low	102 Å²	102	151.3 Å²	151.3	71%	0.713	81%	0.812	S	S	*	*			trans	-91.3	135.7	-179.9	46.3	0	0	0	0	111.4	N46	S44-N46 PolarHBondContact O-N 2.99Å
45	H	32.5	Very low	33.9	Very low	175 Å²	175	152.4 Å²	152.4	81%	0.81	81%	0.808	S	S	*	*	S	Bend	trans	-71.8	84.7	178.1	-175.9	91.3	0	0	0	111.1
46	N	39.9	Very low	33.7	Very low	129 Å²	129	153.8 Å²	153.8	69%	0.69	81%	0.814	S	S	*	*			trans	-151.7	6.2	176.6	-133.6	-21.4	0	0	0	115.8	S44	S44-N46 PolarHBondContact O-N 2.99Å
47	E	38.8	Very low	33.4	Very low	169 Å²	169	155.7 Å²	155.7	79%	0.79	81%	0.811	S	S	*	*	S	Bend	trans	-101.2	-11.5	-178.1	-68.9	-170	119.2	0	0	114.8	L49	E47-L49 VanDerWaalsContact C-N 3.34Å; E47-L49 PolarHBondContact O-N 3.22Å
48	L	36.3	Very low	33.4	Very low	142 Å²	142	154 Å²	154	74%	0.743	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.5	5.8	-172.9	-84.7	167.9	0	0	0	116.1
49	L	33.8	Very low	33.4	Very low	161 Å²	161	156.5 Å²	156.5	84%	0.843	81%	0.807	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.2	4	178.8	-72.3	175	0	0	0	114.9	E47	E47-L49 VanDerWaalsContact C-N 3.34Å; E47-L49 PolarHBondContact O-N 3.22Å
50	N	34.7	Very low	33.3	Very low	150 Å²	150	155.4 Å²	155.4	80%	0.802	80%	0.803	S	S	*	*	S	Bend	trans	-121	10.3	-179.1	-71.2	-63.4	0	0	0	113.9
51	A	37.5	Very low	33.1	Very low	86 Å²	86	154 Å²	154	71%	0.711	80%	0.804	S	S	*	*	S	Bend	trans	-105.5	0.4	-165.8	0	0	0	0	0	115.7
52	E	32.8	Very low	33	Very low	182 Å²	182	151.7 Å²	151.7	85%	0.85	80%	0.798	S	S	*	*			trans	-125.1	151.8	177	-164.9	160.2	-146.1	0	0	111.1
53	I	36.9	Very low	33.5	Very low	167 Å²	167	145 Å²	145	86%	0.856	79%	0.787	S	S	*	*			trans	83.9	68.4	-169.2	-46.8	171.2	0	0	0	114.7
54	K	28.3	Very low	33.6	Very low	188 Å²	188	145.2 Å²	145.2	82%	0.817	79%	0.785	S	S	*	*			trans	-148	137.3	148.2	-74.8	-171.6	175.8	175.4	0	107.4
55	H	32	Very low	33.4	Very low	156 Å²	156	149.7 Å²	149.7	72%	0.722	79%	0.792	S	S	*	*			cis	-156.7	141.1	-14.6	-103.7	-72.8	0	0	0	106.5
56	T	28.3	Very low	33.1	Very low	148 Å²	148	147.2 Å²	147.2	91%	0.908	79%	0.793	S	S	*	*			trans	-143.1	130.8	154.6	25.6	0	0	0	0	109.5
57	E	29.6	Very low	32.7	Very low	168 Å²	168	152.8 Å²	152.8	79%	0.785	80%	0.804	S	S	*	*			trans	-86.1	154.7	-177.9	-56.3	-174.7	128.2	0	0	109.9
58	T	27.9	Very low	32.5	Very low	114 Å²	114	154.1 Å²	154.1	70%	0.699	81%	0.807	S	S	*	*				-171.1	159.9	70.9	10.4	0	0	0	0	114.1
59	K	31.4	Very low	32.1	Very low	174 Å²	174	156 Å²	156	76%	0.757	81%	0.809	S	S	*	*			trans	66.2	91.1	152.1	-70.5	168	-176.1	174	0	118.5
60	N	28.8	Very low	31.9	Very low	152 Å²	152	158 Å²	158	81%	0.813	81%	0.807	S	S	*	*				159.7	155.3	88.4	-84.1	-19.2	0	0	0	114.5
61	S	27.6	Very low	31.8	Very low	125 Å²	125	155.3 Å²	155.3	87%	0.874	81%	0.806	S	S	*	*			trans	77.4	149.4	170.7	-151	0	0	0	0	117.8
62	T	30.5	Very low	31.8	Very low	125 Å²	125	159.5 Å²	159.5	77%	0.767	82%	0.815	S	S	*	*			trans	-120	138	-160.3	-43.6	0	0	0	0	111.3
63	P	43.3	Very low	32	Very low	109 Å²	109	157.3 Å²	157.3	71%	0.708	82%	0.815	S	S	*	*			trans	-78.9	168	175.7	34.2	-37.4	0	0	0	112.5
64	P	37.3	Very low	32.1	Very low	128 Å²	128	154 Å²	154	83%	0.831	80%	0.799	S	S	*	*				-135.8	160	128.3	37.3	-27.6	0	0	0	114.5
65	K	32.6	Very low	32.8	Very low	195 Å²	195	151.9 Å²	151.9	85%	0.848	80%	0.795	S	S	*	*			trans	-89.5	158.6	177.4	-68.7	-179.1	176	177.4	0	112.8
66	C	27.3	Very low	33.5	Very low	123 Å²	123	151.7 Å²	151.7	83%	0.831	79%	0.794	S	S	*	*			trans	63.6	116.4	151.1	-65.2	0	0	0	0	120.5
67	R	30.6	Very low	34.3	Very low	247 Å²	247	148.9 Å²	148.9	93%	0.932	79%	0.786	S	S	*	*			trans	-150.3	139.4	132.1	-137.4	175	-170.6	179	3.6	113
68	K	34.5	Very low	34.9	Very low	196 Å²	196	145 Å²	145	85%	0.852	78%	0.782	S	S	*	*			trans	-75.1	143.1	163.9	-64	175.6	175.8	178.7	0	109.3
69	K	28.5	Very low	35.5	Very low	181 Å²	181	146.8 Å²	146.8	79%	0.787	79%	0.785	S	S	*	*				176.7	140.1	124.1	-97.9	-177.6	179.1	-171.8	0	113.5
70	Y	29.3	Very low	36	Very low	204 Å²	204	141.8 Å²	141.8	80%	0.8	78%	0.783	S	S	*	*			trans	12.3	135.4	158.3	-47.8	-68.1	0	0	0	122.6
71	A	32.3	Very low	36.5	Very low	93 Å²	93	142.4 Å²	142.4	77%	0.769	79%	0.785	S	S	*	*				-144.6	142.3	113.9	0	0	0	0	0	110.5
72	L	37.7	Very low	36.8	Very low	175 Å²	175	142 Å²	142	92%	0.916	78%	0.782	S	S	*	*			trans	-113	128.9	162.5	-81.8	167.7	0	0	0	106.5
73	T	38	Very low	36.9	Very low	136 Å²	136	143.8 Å²	143.8	83%	0.834	79%	0.787	S	S	*	*			trans	-100.4	115.1	178.3	-48.1	0	0	0	0	109.6
74	N	38.7	Very low	37.3	Very low	97 Å²	97	144.1 Å²	144.1	52%	0.519	79%	0.789	S	S	.	*			trans	-80.7	124.2	176.4	-177.5	-3.3	0	0	0	110.3	Q76 A77	N74-Q76 PolarHBondContact ND2-OE1 3.43Å; N74-Q76 VanDerWaalsContact ND2-OE1 3.16Å; N74-Q76 PolarHBondContact O-N 3.14Å; N74-Q76 PolarHBondContact OD1-N 2.64Å; N74-A77 PolarHBondContact O-N 3.34Å
75	I	42.9	Very low	36.9	Very low	143 Å²	143	142.7 Å²	142.7	73%	0.733	79%	0.788	S	S	*	*	G	3₁₀ helix	trans	-59.8	-28.3	-178.3	-54.6	173.9	0	0	0	112	A77 A78	I75-A77 PolarHBondContact O-N 3.09Å; I75-A78 WeakPolarHBondContact O-CB 3.18Å; I75-A78 PolarHBondContact O-N 3.39Å; I75-A78 VanDerWaalsContact O-N 3.07Å
76	Q	47.3	Very low	36.7	Very low	153 Å²	153	138 Å²	138	72%	0.715	79%	0.786	S	S	*	*	G	3₁₀ helix	trans	-63.6	-23.5	-178.7	-66	175.9	-59.9	0	0	114	N74 A78	N74-Q76 PolarHBondContact ND2-OE1 3.43Å; N74-Q76 VanDerWaalsContact ND2-OE1 3.16Å; N74-Q76 PolarHBondContact O-N 3.14Å; N74-Q76 PolarHBondContact OD1-N 2.64Å; Q76-A78 VanDerWaalsContact C-N 3.28Å; Q76-A78 PolarHBondContact O-N 3.22Å
77	A	43.9	Very low	36.8	Very low	88 Å²	88	141.4 Å²	141.4	73%	0.727	79%	0.789	S	S	*	*	G	3₁₀ helix	trans	-73.4	-18.8	176.3	0	0	0	0	0	113.2	N74 I75 M79	N74-A77 PolarHBondContact O-N 3.34Å; I75-A77 PolarHBondContact O-N 3.09Å; A77-M79 VanDerWaalsContact C-N 3.31Å; A77-M79 PolarHBondContact O-N 3.44Å
78	A	43.3	Very low	37.8	Very low	87 Å²	87	134.7 Å²	134.7	72%	0.719	78%	0.778	S	S	*	*	G	3₁₀ helix	trans	-80.6	-5.5	-175.7	0	0	0	0	0	114.3	I75 Q76	I75-A78 WeakPolarHBondContact O-CB 3.18Å; I75-A78 PolarHBondContact O-N 3.39Å; I75-A78 VanDerWaalsContact O-N 3.07Å; Q76-A78 VanDerWaalsContact C-N 3.28Å; Q76-A78 PolarHBondContact O-N 3.22Å
79	M	40.1	Very low	37.4	Very low	152 Å²	152	132.7 Å²	132.7	75%	0.749	78%	0.775	S	S	*	*	G	3₁₀ helix	trans	-118.8	14.7	-177.1	-58.9	-156.3	-57	0	0	114.8	A77 L81	A77-M79 VanDerWaalsContact C-N 3.31Å; A77-M79 PolarHBondContact O-N 3.44Å; M79-L81 PolarHBondContact O-N 3.39Å
80	G	41.5	Very low	37.3	Very low	69 Å²	69	132 Å²	132	71%	0.711	78%	0.78	S	S	*	*			trans	63.6	35.4	157.1	0	0	0	0	0	117.9
81	L	40.2	Very low	37	Very low	165 Å²	165	125.9 Å²	125.9	86%	0.864	78%	0.779	S	S	*	*			trans	-129.5	92.8	179.7	-70.5	175.9	0	0	0	113.1	M79	M79-L81 PolarHBondContact O-N 3.39Å
82	S	34.1	Very low	36.7	Very low	116 Å²	116	130 Å²	130	81%	0.811	79%	0.787	S	S	*	*			trans	-166.9	129.8	160.9	59.7	0	0	0	0	112.4
83	D	32.6	Very low	36.1	Very low	163 Å²	163	125.2 Å²	125.2	87%	0.872	78%	0.78	S	S	*	*			trans	-156.8	158.5	149	-125.4	19.2	0	0	0	109.2
84	P	50.4	Low	35.7	Very low	116 Å²	116	124.6 Å²	124.6	75%	0.753	78%	0.782	S	S	*	*			trans	-132.6	168.7	-142.3	42.1	-27.4	0	0	0	116.9
85	A	29.3	Very low	35.4	Very low	98 Å²	98	124 Å²	124	81%	0.81	79%	0.791	S	S	*	*			trans	-160	143.7	154.9	0	0	0	0	0	115.1
86	A	29.3	Very low	34.8	Very low	96 Å²	96	124 Å²	124	79%	0.793	79%	0.792	S	S	*	*			trans	36.2	102.7	146	0	0	0	0	0	122.3
87	Q	27.7	Very low	34.2	Very low	195 Å²	195	124.2 Å²	124.2	91%	0.911	80%	0.796	S	S	*	*				23	162.2	113.6	-84.9	-155.3	-15.3	0	0	123.7
88	P	51.4	Low	33.6	Very low	106 Å²	106	129.5 Å²	129.5	69%	0.688	80%	0.803	S	S	*	*			trans	-112.4	-175.5	-138	44.3	-39.6	0	0	0	115.9
89	L	26.4	Very low	33.1	Very low	153 Å²	153	133.1 Å²	133.1	80%	0.801	81%	0.809	S	S	*	*			trans	-175.7	145	131.6	-95.4	160.7	0	0	0	113.2
90	L	26.9	Very low	32.7	Very low	168 Å²	168	131.6 Å²	131.6	88%	0.88	81%	0.809	S	S	*	*			trans	43.1	135.4	150.6	-61	167.8	0	0	0	123.5
91	G	23.6	Very low	32.8	Very low	75 Å²	75	137.1 Å²	137.1	77%	0.773	81%	0.813	S	S	*	*			trans	150.8	120.9	149.8	0	0	0	0	0	117.6
92	N	25.6	Very low	32.6	Very low	178 Å²	178	136.5 Å²	136.5	95%	0.952	81%	0.81	S	S	*	*			trans	-68.1	156.7	170.2	-54.7	-12.7	0	0	0	110.9
93	G	24.8	Very low	32.7	Very low	75 Å²	75	134.9 Å²	134.9	77%	0.773	81%	0.812	S	S	*	*			cis	-167.8	-170.9	-0.2	0	0	0	0	0	108
94	S	29.4	Very low	32.9	Very low	124 Å²	124	136.7 Å²	136.7	87%	0.867	82%	0.815	S	S	*	*			cis	-162.4	-176.1	12.9	62.3	0	0	0	0	110.9
95	A	31.8	Very low	32.6	Very low	85 Å²	85	138.3 Å²	138.3	70%	0.702	82%	0.817	S	S	*	*			trans	94.5	112	171.3	0	0	0	0	0	119.6
96	N	31.6	Very low	33.1	Very low	143 Å²	143	142.1 Å²	142.1	77%	0.765	82%	0.818	S	S	*	*			trans	49.6	85	147.4	-56	-18.2	0	0	0	118.8
97	I	33.8	Very low	33.5	Very low	156 Å²	156	145.7 Å²	145.7	80%	0.8	82%	0.824	S	S	*	*				88.9	124.4	83	-73.8	162.6	0	0	0	114
98	K	30.8	Very low	34.1	Very low	199 Å²	199	148.5 Å²	148.5	87%	0.865	83%	0.826	S	S	*	*			trans	-129.5	127.1	171.4	-77.8	179.7	176.6	176.8	0	110.3
99	L	32.9	Very low	33.6	Very low	163 Å²	163	153 Å²	153	85%	0.853	83%	0.834	S	S	*	*			trans	-177.3	146.1	162.8	-97.3	145.1	0	0	0	105
100	V	32.5	Very low	33.9	Very low	121 Å²	121	149.7 Å²	149.7	73%	0.733	83%	0.829	S	S	*	*			cis	-131.9	160	15.7	176.1	0	0	0	0	110.2
101	K	42.8	Very low	34.2	Very low	185 Å²	185	146.5 Å²	146.5	80%	0.804	83%	0.827	S	S	*	*			trans	-113.6	141.5	161.6	179.3	179	176.7	178.5	0	108.8
102	N	36.6	Very low	35.1	Very low	151 Å²	151	151.9 Å²	151.9	81%	0.807	83%	0.832	S	S	*	*			trans	91.3	135.9	-171.7	-51.2	-18.5	0	0	0	113.3
103	G	36.4	Very low	35.3	Very low	82 Å²	82	152.8 Å²	152.8	85%	0.845	83%	0.83	S	S	*	*			trans	158.6	-8.5	168.2	0	0	0	0	0	120.3
104	E	37.8	Very low	35.5	Very low	202 Å²	202	152.8 Å²	152.8	94%	0.944	83%	0.83	S	S	*	*			trans	-119.2	53.4	-168	-154.7	161.6	-151.6	0	0	115.2
105	N	42.9	Very low	35.7	Very low	149 Å²	149	155.1 Å²	155.1	80%	0.797	83%	0.828	S	S	*	*	S	Bend	trans	-144.3	85.7	160.2	-177.1	8.8	0	0	0	110
106	Q	40.3	Very low	35.6	Very low	178 Å²	178	160 Å²	160	83%	0.832	84%	0.836	S	S	*	*	S	Bend	trans	-168.4	-16.5	160.5	-117.6	160	108	0	0	116.4	R108	Q106-R108 PolarHBondContact O-N 3.48Å
107	L	37.1	Very low	35.9	Very low	172 Å²	172	160.1 Å²	160.1	90%	0.901	84%	0.836	S	S	*	*			trans	-93.3	57.3	-176.3	-74.4	172.1	0	0	0	114.3
108	R	40	Very low	36.1	Very low	253 Å²	253	157.5 Å²	157.5	96%	0.955	83%	0.83	S	S	*	*	S	Bend	trans	-127.6	35.4	161.2	-137.2	176.7	-164	-178.9	5.1	112.5	Q106	Q106-R108 PolarHBondContact O-N 3.48Å
109	K	40.8	Very low	36.1	Very low	201 Å²	201	154.2 Å²	154.2	87%	0.874	82%	0.822	S	S	*	*	S	Bend	trans	-140.8	48.3	-179.8	-158.7	-177.9	-178.1	-179.2	0	112.2
110	A	33.6	Very low	36.1	Very low	83 Å²	83	154.5 Å²	154.5	69%	0.686	82%	0.816	S	S	*	*			trans	-151.9	33.5	-178.2	0	0	0	0	0	113.2
111	A	33.8	Very low	35.9	Very low	101 Å²	101	155.3 Å²	155.3	84%	0.835	82%	0.816	S	S	*	*	S	Bend	trans	-112.2	11.6	-174.4	0	0	0	0	0	114.5
112	E	41.5	Very low	35.2	Very low	188 Å²	188	154.8 Å²	154.8	88%	0.879	82%	0.822	S	S	*	*	S	Bend	trans	-133.8	42.7	179.9	-72.4	-162.2	118.7	0	0	113.1
113	Q	30.6	Very low	34.7	Very low	197 Å²	197	152.5 Å²	152.5	92%	0.921	82%	0.817	S	S	*	*	S	Bend	trans	-162.8	136.6	164.1	-113	153.4	28.4	0	0	112.5
114	G	29	Very low	35.1	Very low	75 Å²	75	153.6 Å²	153.6	77%	0.773	81%	0.81	S	S	*	*			trans	92.2	78.3	160.2	0	0	0	0	0	117.5
115	Q	32.4	Very low	34.7	Very low	174 Å²	174	150.3 Å²	150.3	81%	0.813	80%	0.803	S	S	*	*			trans	-116.6	112.1	132.2	-87.7	-162.4	-42.7	0	0	109.5
116	Q	30.2	Very low	34	Very low	187 Å²	187	147.5 Å²	147.5	87%	0.874	80%	0.801	S	S	*	*			trans	-129.7	112.9	155.9	-81.8	-170.8	-51.1	0	0	105.7	P118	Q116-P118 WeakPolarHBondContact O-CD 3.49Å
117	D	37.6	Very low	33.4	Very low	145 Å²	145	145.2 Å²	145.2	78%	0.775	80%	0.799	S	S	*	*			trans	-85.3	132.8	173.8	-67.9	-45.4	0	0	0	110.6
118	P	38.6	Very low	33.2	Very low	102 Å²	102	144 Å²	144	66%	0.662	79%	0.792	S	S	*	*			trans	-120.6	144.4	171.6	37.4	-25.8	0	0	0	113.6	Q116	Q116-P118 WeakPolarHBondContact O-CD 3.49Å
119	N	30.5	Very low	32.6	Very low	130 Å²	130	139 Å²	139	70%	0.695	78%	0.784	S	S	*	*			trans	83.6	144.7	170.1	-57.3	-77	0	0	0	116.9
120	K	33.2	Very low	32.3	Very low	168 Å²	168	134.6 Å²	134.6	73%	0.73	77%	0.773	S	S	*	*			cis	-155.4	140.1	4.9	-127	157.7	-163	172.2	0	113.9
121	N	28.6	Very low	32	Very low	138 Å²	138	136.6 Å²	136.6	74%	0.738	78%	0.777	S	S	*	*			trans	30.1	126.7	147.5	-55.2	-2.9	0	0	0	121.9
122	L	28.5	Very low	31.9	Very low	175 Å²	175	136 Å²	136	92%	0.916	77%	0.767	S	S	*	*				-170.7	169.5	105.3	-96.9	166	0	0	0	111.5
123	S	26	Very low	31.2	Very low	103 Å²	103	135.7 Å²	135.7	72%	0.72	77%	0.766	S	S	*	*			trans	-133	-173.2	-170.4	63.5	0	0	0	0	110.4
124	P	45	Very low	31.4	Very low	105 Å²	105	133.3 Å²	133.3	68%	0.682	75%	0.752	S	S	*	*			cis	-146.6	-174.9	8.5	41.5	-19.5	0	0	0	118.9
125	T	28	Very low	31.5	Very low	132 Å²	132	137.8 Å²	137.8	81%	0.81	76%	0.757	S	S	*	*			trans	98.6	140.2	144.5	-57.1	0	0	0	0	121.6
126	A	28.8	Very low	31.4	Very low	90 Å²	90	136.5 Å²	136.5	74%	0.744	75%	0.751	S	S	*	*			trans	85.7	146	165.1	0	0	0	0	0	120.2
127	V	27.8	Very low	31.2	Very low	130 Å²	130	131 Å²	131	79%	0.788	75%	0.745	S	S	*	*				-176.4	158.3	-50.8	136.9	0	0	0	0	109.9
128	I	32	Very low	30.7	Very low	147 Å²	147	134.6 Å²	134.6	75%	0.754	75%	0.754	S	S	*	*			trans	81.7	119.1	179.9	-48.5	-169.9	0	0	0	113.9
129	N	28.9	Very low	30.1	Very low	148 Å²	148	137 Å²	137	79%	0.791	76%	0.756	S	S	*	*				81.7	147.7	56.9	-82.3	0.7	0	0	0	113.5
130	V	33	Very low	30.5	Very low	108 Å²	108	135.9 Å²	135.9	66%	0.655	76%	0.756	S	S	*	*			cis	-166	152	8.6	99.4	0	0	0	0	113.7
131	T	28.7	Very low	30.1	Very low	125 Å²	125	135.3 Å²	135.3	77%	0.767	76%	0.756	S	S	*	*			trans	58.9	165	160.2	60.9	0	0	0	0	119.3
132	S	31	Very low	30.9	Very low	89 Å²	89	133 Å²	133	62%	0.622	75%	0.749	S	S	*	*			cis	-164	175.1	-2.4	-123.2	0	0	0	0	109.3
133	E	27.7	Very low	30.8	Very low	182 Å²	182	133 Å²	133	85%	0.85	74%	0.744	S	S	*	*			cis	-152.8	-135	-5.1	-149.3	150.6	121	0	0	111.5
134	K	33.8	Very low	30.7	Very low	147 Å²	147	134.1 Å²	134.1	64%	0.639	74%	0.742	S	S	*	*			trans	-153	151.9	-178	-172	-154.7	172.6	-167	0	111.2	E136	K134-E136 WeakPolarHBondContact CE-OE2 3.22Å; K134-E136 IonicContact NZ-OE2 2.65Å; K134-E136 PolarHBondContact NZ-OE2 3.31Å
135	L	31.9	Very low	29.8	Very low	168 Å²	168	134.4 Å²	134.4	88%	0.88	75%	0.746	S	S	*	*			trans	-167.9	176.2	137.7	-106.8	163.4	0	0	0	114
136	E	29	Very low	29.8	Very low	147 Å²	147	134.2 Å²	134.2	69%	0.687	75%	0.75	S	S	*	*			trans	-160	141.4	-148.6	179	-170.7	140.7	0	0	111.5	K134	K134-E136 WeakPolarHBondContact CE-OE2 3.22Å; K134-E136 IonicContact NZ-OE2 2.65Å; K134-E136 PolarHBondContact NZ-OE2 3.31Å
137	G	26.5	Very low	29.6	Very low	72 Å²	72	133.5 Å²	133.5	74%	0.742	75%	0.752	S	S	*	*			trans	165.3	106.7	167.6	0	0	0	0	0	121.7
138	K	28	Very low	29.4	Very low	220 Å²	220	133.5 Å²	133.5	96%	0.957	76%	0.756	S	S	*	*			trans	69.5	141.1	143.1	-68.2	-173.7	173.6	-177.1	0	124.2
139	E	26	Very low	29.2	Very low	152 Å²	152	134.1 Å²	134.1	71%	0.71	76%	0.756	S	S	*	*			trans	-94.9	-179.3	169.3	-113.7	-115.7	115.9	0	0	110.8	H141	E139-H141 PolarHBondContact OE1-N 3.48Å
140	P	38.9	Very low	29.5	Very low	108 Å²	108	133.8 Å²	133.8	70%	0.701	75%	0.753	S	S	*	*			cis	-139.9	156.1	18.4	40.1	-20.1	0	0	0	121.1
141	H	23.9	Very low	29.1	Very low	155 Å²	155	136.4 Å²	136.4	72%	0.718	76%	0.762	S	S	*	*			trans	44.2	158.3	135.1	-130	61.5	0	0	0	123.4	E139	E139-H141 PolarHBondContact OE1-N 3.48Å
142	P	45.7	Very low	29.6	Very low	91 Å²	91	135.9 Å²	135.9	59%	0.591	76%	0.761	S	S	*	*				-129.2	172.6	-59.8	43	-31.6	0	0	0	114
143	Q	25.3	Very low	29.4	Very low	175 Å²	175	137.4 Å²	137.4	82%	0.818	77%	0.772	S	S	*	*				-174.2	143.4	124.4	-105.6	-163.6	-83.6	0	0	114.3
144	D	24	Very low	29.4	Very low	125 Å²	125	137.5 Å²	137.5	67%	0.668	77%	0.772	S	S	*	*			trans	19.2	133.2	156.5	-57.4	-54.7	0	0	0	124.8
145	S	27.2	Very low	29.2	Very low	111 Å²	111	136.4 Å²	136.4	78%	0.776	78%	0.78	S	S	*	*			trans	88.6	160.3	138.2	81.8	0	0	0	0	120.9
146	S	27.2	Very low	29.1	Very low	128 Å²	128	139.9 Å²	139.9	90%	0.895	78%	0.781	S	S	*	*			trans	64.7	151.3	-166.7	76.8	0	0	0	0	115.1
147	G	25.4	Very low	29.3	Very low	75 Å²	75	144.5 Å²	144.5	77%	0.773	79%	0.792	S	S	*	*			trans	-130.1	168.7	177.4	0	0	0	0	0	110.7
148	C	24.3	Very low	29.8	Very low	131 Å²	131	148 Å²	148	89%	0.885	80%	0.799	S	S	*	*			trans	-152.6	-177.4	171.6	-146.1	0	0	0	0	112.2
149	E	26.3	Very low	30.7	Very low	160 Å²	160	144 Å²	144	75%	0.748	78%	0.782	S	S	*	*			trans	-81.7	161.6	-160.1	-60.7	-174.4	115	0	0	116.3
150	I	35.6	Very low	31.5	Very low	141 Å²	141	141 Å²	141	72%	0.723	78%	0.778	S	S	*	*			trans	32.3	120.7	136.1	-56.7	162.3	0	0	0	118.1
151	L	24.2	Very low	31.6	Very low	163 Å²	163	143.1 Å²	143.1	85%	0.853	78%	0.776	S	S	*	*			trans	-155.3	171	134	-102.8	-177.3	0	0	0	109.1
152	P	40.2	Very low	32.7	Very low	113 Å²	113	142.3 Å²	142.3	73%	0.734	78%	0.777	S	S	*	*				-117	169.4	-124.9	41.5	-31.5	0	0	0	115.4
153	S	27	Very low	32.6	Very low	122 Å²	122	141.5 Å²	141.5	85%	0.853	77%	0.767	S	S	*	*			trans	-144.7	159.8	161.7	60.6	0	0	0	0	112.3
154	Q	26.4	Very low	33.8	Very low	183 Å²	183	140 Å²	140	86%	0.855	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-81.7	168.6	-164.1	-105.8	-172.6	-5.1	0	0	114.7
155	P	30	Very low	35.2	Very low	124 Å²	124	140.3 Å²	140.3	81%	0.805	75%	0.748	S	S	*	*	P	Polyproline II helix	trans	-72.4	137.7	-150.5	27.9	-36.9	0	0	0	114.6
156	R	29.8	Very low	36.4	Very low	241 Å²	241	137.4 Å²	137.4	91%	0.909	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-92.9	137.5	166.7	-67.2	-174.1	175.6	-167.9	-1.6	109.9
157	R	34.3	Very low	37.6	Very low	244 Å²	244	134.7 Å²	134.7	92%	0.921	71%	0.706	S	S	*	*	P	Polyproline II helix	trans	-55.9	147.9	178.2	-72.8	178.4	165	113.6	-5.3	111.5	K159	R157-K159 PolarHBondContact O-N 3.39Å
158	T	37.2	Very low	38.9	Very low	145 Å²	145	135.3 Å²	135.3	89%	0.89	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-53.9	117.8	170.6	3.9	0	0	0	0	110.8
159	K	45.8	Very low	40.1	Very low	138 Å²	138	134.3 Å²	134.3	60%	0.6	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-69.7	137.7	164.6	-84	-175.1	165.8	-175.3	0	108.7	R157 N163 D167	R157-K159 PolarHBondContact O-N 3.39Å; K159-N163 HydrophobicContact CD-CB 4.45Å; K159-D167 IonicContact NZ-OD1 2.64Å; K159-D167 IonicContact NZ-OD2 2.68Å; K159-D167 PolarHBondContact NZ-OD2 2.86Å
160	S	43.2	Very low	41.4	Very low	89 Å²	89	130.8 Å²	130.8	62%	0.622	66%	0.663	S	S	*	*	P	Polyproline II helix	trans	-71.1	149.9	172.4	-176.4	0	0	0	0	111.5	L162 N163	S160-L162 VanDerWaalsContact C-N 3.26Å; S160-L162 PolarHBondContact O-N 3.31Å; S160-L162 VanDerWaalsContact O-N 3.11Å; S160-N163 WeakPolarHBondContact O-CB 3.32Å; S160-N163 PolarHBondContact O-N 2.63Å
161	F	41.3	Very low	42.3	Very low	152 Å²	152	127.7 Å²	127.7	67%	0.667	65%	0.654	S	S	*	*	T	Hydrogen-bonded Turn	trans	-49.7	-38.3	-173.3	-174.3	-107	0	0	0	114.3	N163 Y164 Y165	F161-N163 PolarHBondContact O-N 3.27Å; F161-Y164 WeakPolarHBondContact O-CB 3.38Å; F161-Y164 PolarHBondContact O-N 3.4Å; F161-Y165 HydrophobicContact CD1-CE2 4.18Å; F161-Y165 HydrophobicContact CE1-CD2 4.44Å; F161-Y165 AromaticContact CE1-CE2 3.62Å; F161-Y165 HydrophobicContact CE1-CE2 3.62Å; F161-Y165 HydrophobicContact CE2-CE2 4.37Å; F161-Y165 AromaticContact CZ-CE2 3.73Å; F161-Y165 HydrophobicContact CZ-CE2 3.73Å
162	L	46.7	Very low	43.4	Very low	138 Å²	138	122.6 Å²	122.6	72%	0.723	64%	0.635	S	S	*	*	H	α-helix	trans	-62.3	-28.2	178.4	-75.8	166.7	0	0	0	113.8	S160 Y164 Y165 A166	S160-L162 VanDerWaalsContact C-N 3.26Å; S160-L162 PolarHBondContact O-N 3.31Å; S160-L162 VanDerWaalsContact O-N 3.11Å; L162-Y164 VanDerWaalsContact C-N 3.27Å; L162-Y164 PolarHBondContact O-N 2.93Å; L162-Y165 PolarHBondContact O-N 3.26Å; L162-A166 PolarHBondContact O-N 3.12Å
163	N	43.3	Very low	43.8	Very low	73 Å²	73	124 Å²	124	39%	0.39	63%	0.626	S	S	.	*	H	α-helix	trans	-73.3	-22.6	-177.2	-144.1	87.6	0	0	0	112.4	K159 S160 F161 D167	K159-N163 HydrophobicContact CD-CB 4.45Å; S160-N163 WeakPolarHBondContact O-CB 3.32Å; S160-N163 PolarHBondContact O-N 2.63Å; F161-N163 PolarHBondContact O-N 3.27Å; N163-D167 PolarHBondContact O-N 2.98Å; N163-D167 VanDerWaalsContact O-N 3.12Å
164	Y	49.4	Very low	44.6	Very low	143 Å²	143	125.1 Å²	125.1	56%	0.561	62%	0.618	S	S	*	*	H	α-helix	trans	-66.8	-42.5	174.2	179	-101.4	0	0	0	111.5	F161 L162 D167 L168	F161-Y164 WeakPolarHBondContact O-CB 3.38Å; F161-Y164 PolarHBondContact O-N 3.4Å; L162-Y164 VanDerWaalsContact C-N 3.27Å; L162-Y164 PolarHBondContact O-N 2.93Å; Y164-D167 PolarHBondContact O-N 3.36Å; Y164-L168 HydrophobicContact CE1-CD1 4.13Å; Y164-L168 HydrophobicContact CE1-CD2 4.29Å; Y164-L168 HydrophobicContact CE2-CD1 4.24Å; Y164-L168 WeakPolarHBondContact O-CB 3.46Å; Y164-L168 PolarHBondContact O-N 3.13Å
165	Y	54	Low	45.3	Very low	132 Å²	132	122.4 Å²	122.4	52%	0.518	61%	0.608	S	S	.	*	H	α-helix	trans	-67.7	-36.8	177.4	-74.4	-88.2	0	0	0	112.6	F161 L162 L168 E169	F161-Y165 HydrophobicContact CD1-CE2 4.18Å; F161-Y165 HydrophobicContact CE1-CD2 4.44Å; F161-Y165 AromaticContact CE1-CE2 3.62Å; F161-Y165 HydrophobicContact CE1-CE2 3.62Å; F161-Y165 HydrophobicContact CE2-CE2 4.37Å; F161-Y165 AromaticContact CZ-CE2 3.73Å; F161-Y165 HydrophobicContact CZ-CE2 3.73Å; L162-Y165 PolarHBondContact O-N 3.26Å; Y165-L168 PolarHBondContact O-N 3.29Å; Y165-E169 WeakPolarHBondContact O-CB 3.45Å; Y165-E169 PolarHBondContact O-N 3.11Å
166	A	52.8	Low	45.9	Very low	50 Å²	50	123.7 Å²	123.7	41%	0.413	60%	0.603	S	S	.	*	H	α-helix	trans	-63.3	-48.2	173.7	0	0	0	0	0	111.9	L162 L168 E169 T170	L162-A166 PolarHBondContact O-N 3.12Å; A166-L168 VanDerWaalsContact C-N 3.26Å; A166-L168 PolarHBondContact O-N 3.19Å; A166-E169 PolarHBondContact O-N 3.44Å; A166-T170 PolarHBondContact O-N 3.37Å; A166-T170 VanDerWaalsContact O-N 3.13Å; A166-T170 PolarHBondContact O-OG1 3.01Å; A166-T170 VanDerWaalsContact O-OG1 3.09Å
167	D	52.1	Low	46.5	Very low	71 Å²	71	120 Å²	120	38%	0.38	60%	0.597	S	S	.	*	H	α-helix	trans	-60.2	-36.7	176.4	-65.6	-28	0	0	0	110.9	K159 N163 Y164 T170 S171	K159-D167 IonicContact NZ-OD1 2.64Å; K159-D167 IonicContact NZ-OD2 2.68Å; K159-D167 PolarHBondContact NZ-OD2 2.86Å; N163-D167 PolarHBondContact O-N 2.98Å; N163-D167 VanDerWaalsContact O-N 3.12Å; Y164-D167 PolarHBondContact O-N 3.36Å; D167-T170 PolarHBondContact O-OG1 3.35Å; D167-S171 PolarHBondContact O-N 3.22Å
168	L	52.9	Low	46.6	Very low	88 Å²	88	115.6 Å²	115.6	46%	0.461	59%	0.591	S	S	.	*	H	α-helix	trans	-67.7	-45.5	175	-125.3	73.6	0	0	0	113.4	Y164 Y165 A166 T170 S171 A172	Y164-L168 HydrophobicContact CE1-CD1 4.13Å; Y164-L168 HydrophobicContact CE1-CD2 4.29Å; Y164-L168 HydrophobicContact CE2-CD1 4.24Å; Y164-L168 WeakPolarHBondContact O-CB 3.46Å; Y164-L168 PolarHBondContact O-N 3.13Å; Y165-L168 PolarHBondContact O-N 3.29Å; A166-L168 VanDerWaalsContact C-N 3.26Å; A166-L168 PolarHBondContact O-N 3.19Å; L168-T170 VanDerWaalsContact C-N 3.3Å; L168-T170 PolarHBondContact O-N 2.96Å; L168-S171 PolarHBondContact O-N 2.82Å; L168-A172 PolarHBondContact O-N 3.44Å
169	E	50.3	Low	46.6	Very low	110 Å²	110	119.4 Å²	119.4	51%	0.514	59%	0.589	S	S	.	*	H	α-helix	trans	-67.8	-31.4	-177.8	-162.5	-172	168.8	0	0	111.7	Y165 A166 R173	Y165-E169 WeakPolarHBondContact O-CB 3.45Å; Y165-E169 PolarHBondContact O-N 3.11Å; A166-E169 PolarHBondContact O-N 3.44Å; E169-R173 PolarHBondContact O-N 3.46Å; E169-R173 IonicContact OE1-CZ 2.83Å; E169-R173 IonicContact OE1-NH1 2.63Å; E169-R173 PolarHBondContact OE1-NH1 3.24Å; E169-R173 IonicContact OE1-NH2 3.54Å; E169-R173 PolarHBondContact OE1-NH2 3.2Å
170	T	53.6	Low	46.1	Very low	87 Å²	87	115.6 Å²	115.6	53%	0.534	59%	0.589	S	S	.	*	H	α-helix	trans	-67	-46.1	168.7	41.6	0	0	0	0	112.4	A166 D167 L168 A172 R173 E174	A166-T170 PolarHBondContact O-N 3.37Å; A166-T170 VanDerWaalsContact O-N 3.13Å; A166-T170 PolarHBondContact O-OG1 3.01Å; A166-T170 VanDerWaalsContact O-OG1 3.09Å; D167-T170 PolarHBondContact O-OG1 3.35Å; L168-T170 VanDerWaalsContact C-N 3.3Å; L168-T170 PolarHBondContact O-N 2.96Å; T170-A172 VanDerWaalsContact C-N 3.32Å; T170-A172 PolarHBondContact O-N 2.83Å; T170-R173 PolarHBondContact O-N 3.38Å; T170-R173 VanDerWaalsContact O-N 3.14Å; T170-E174 PolarHBondContact O-N 3.35Å
171	S	54.7	Low	45.6	Very low	75 Å²	75	118.6 Å²	118.6	52%	0.524	60%	0.598	S	S	.	*	H	α-helix	trans	-62.9	-37.6	-179.2	-173.2	0	0	0	0	112.5	D167 L168 R173 E174 L175	D167-S171 PolarHBondContact O-N 3.22Å; L168-S171 PolarHBondContact O-N 2.82Å; S171-R173 VanDerWaalsContact C-N 3.34Å; S171-R173 PolarHBondContact O-N 3.12Å; S171-E174 PolarHBondContact O-N 2.97Å; S171-L175 PolarHBondContact O-N 3.32Å
172	A	45.5	Very low	45.1	Very low	56 Å²	56	121 Å²	121	46%	0.463	61%	0.611	S	S	.	*	H	α-helix	trans	-60.8	-39.9	174.1	0	0	0	0	0	112.8	L168 T170 L175 E176	L168-A172 PolarHBondContact O-N 3.44Å; T170-A172 VanDerWaalsContact C-N 3.32Å; T170-A172 PolarHBondContact O-N 2.83Å; A172-L175 PolarHBondContact O-N 2.95Å; A172-E176 PolarHBondContact O-N 2.71Å
173	R	49.3	Very low	44.2	Very low	144 Å²	144	123.5 Å²	123.5	54%	0.543	62%	0.619	S	S	.	*	H	α-helix	trans	-73.8	-31	-179.1	-76.7	-173.8	167.8	115.2	7.9	113.7	E169 T170 S171 L175 E176 Q177	E169-R173 PolarHBondContact O-N 3.46Å; E169-R173 IonicContact OE1-CZ 2.83Å; E169-R173 IonicContact OE1-NH1 2.63Å; E169-R173 PolarHBondContact OE1-NH1 3.24Å; E169-R173 IonicContact OE1-NH2 3.54Å; E169-R173 PolarHBondContact OE1-NH2 3.2Å; T170-R173 PolarHBondContact O-N 3.38Å; T170-R173 VanDerWaalsContact O-N 3.14Å; S171-R173 VanDerWaalsContact C-N 3.34Å; S171-R173 PolarHBondContact O-N 3.12Å; R173-L175 VanDerWaalsContact C-N 3.3Å; R173-E176 PolarHBondContact O-N 3.22Å; R173-Q177 PolarHBondContact O-N 2.86Å
174	E	43	Very low	43.3	Very low	145 Å²	145	123 Å²	123	68%	0.678	63%	0.631	S	S	*	*	H	α-helix	trans	-67.9	-31.4	173.4	-67.8	-172.9	152.1	0	0	111.9	T170 S171	T170-E174 PolarHBondContact O-N 3.35Å; S171-E174 PolarHBondContact O-N 2.97Å
175	L	43	Very low	42.3	Very low	126 Å²	126	124 Å²	124	66%	0.66	65%	0.645	S	S	*	*	H	α-helix	trans	-70.5	-35.4	176.2	-170.3	65.3	0	0	0	113.1	S171 A172 R173	S171-L175 PolarHBondContact O-N 3.32Å; A172-L175 PolarHBondContact O-N 2.95Å; R173-L175 VanDerWaalsContact C-N 3.3Å
176	E	42.7	Very low	40.9	Very low	150 Å²	150	122.4 Å²	122.4	70%	0.701	66%	0.659	S	S	*	*	H	α-helix	trans	-72.3	-40.2	178.2	-69	-170.6	141.1	0	0	112.6	A172 R173 N178 R179	A172-E176 PolarHBondContact O-N 2.71Å; R173-E176 PolarHBondContact O-N 3.22Å; E176-N178 VanDerWaalsContact C-N 3.26Å; E176-N178 PolarHBondContact O-N 2.89Å; E176-R179 PolarHBondContact O-N 3.47Å
177	Q	40.6	Very low	39.7	Very low	165 Å²	165	129.2 Å²	129.2	77%	0.771	68%	0.682	S	S	*	*	H	α-helix	trans	-67.7	-24.8	-178.7	-69.1	-175.3	10.3	0	0	113.3	R173 R179	R173-Q177 PolarHBondContact O-N 2.86Å; Q177-R179 VanDerWaalsContact C-N 3.35Å; Q177-R179 PolarHBondContact O-N 3.39Å
178	N	36.4	Very low	38.4	Very low	150 Å²	150	134.8 Å²	134.8	80%	0.802	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.4	2.8	-177.4	-133.2	-13.7	0	0	0	114.4	E176	E176-N178 VanDerWaalsContact C-N 3.26Å; E176-N178 PolarHBondContact O-N 2.89Å
179	R	37.2	Very low	37.1	Very low	225 Å²	225	139.3 Å²	139.3	85%	0.849	72%	0.721	S	S	*	*	T	Hydrogen-bonded Turn	trans	-105.3	7.3	175.8	-64.9	-174.5	68.2	-171.5	0.7	113.8	E176 Q177	E176-R179 PolarHBondContact O-N 3.47Å; Q177-R179 VanDerWaalsContact C-N 3.35Å; Q177-R179 PolarHBondContact O-N 3.39Å
180	G	35.5	Very low	35.8	Very low	58 Å²	58	139.8 Å²	139.8	60%	0.598	74%	0.737	S	S	*	*	S	Bend	trans	-117.4	30.4	-166	0	0	0	0	0	116.7
181	N	33.9	Very low	34.3	Very low	153 Å²	153	144.4 Å²	144.4	82%	0.818	75%	0.753	S	S	*	*			trans	-161.7	106.9	169.5	-107.9	-24.7	0	0	0	113.6
182	H	29.7	Very low	34	Very low	201 Å²	201	146.3 Å²	146.3	93%	0.931	76%	0.763	S	S	*	*			trans	-175.9	153.9	139.5	-92.6	-59.7	0	0	0	108.5
183	H	27.9	Very low	32.9	Very low	191 Å²	191	149.5 Å²	149.5	88%	0.884	77%	0.772	S	S	*	*			trans	-154.9	141.3	-156.8	-172.8	90.3	0	0	0	111.9
184	G	25.6	Very low	31.8	Very low	63 Å²	63	150.5 Å²	150.5	65%	0.649	78%	0.783	S	S	*	*			trans	153.8	95	166.7	0	0	0	0	0	119.1
185	I	27.4	Very low	30.9	Very low	165 Å²	165	146.8 Å²	146.8	85%	0.846	78%	0.784	S	S	*	*			trans	43.5	119.7	130.5	-55.1	164.7	0	0	0	120.4
186	A	25.3	Very low	30.2	Very low	98 Å²	98	150 Å²	150	81%	0.81	80%	0.795	S	S	*	*			trans	-162.2	148.6	132	0	0	0	0	0	111
187	E	26.5	Very low	29.3	Very low	192 Å²	192	147.1 Å²	147.1	90%	0.897	80%	0.797	S	S	*	*			trans	-111.3	155.5	173.1	-63.1	178.1	88.1	0	0	110.7
188	E	25.6	Very low	28.6	Very low	189 Å²	189	145.2 Å²	145.2	88%	0.883	80%	0.802	S	S	*	*				-176	170.2	113.3	-168.9	151.9	173	0	0	111.2
189	K	25.1	Very low	28.1	Very low	182 Å²	182	144.2 Å²	144.2	79%	0.791	80%	0.802	S	S	*	*			trans	-91	160.1	-173.9	-53.4	154.2	-178.7	160.7	0	112.2
190	S	23.5	Very low	27.6	Very low	121 Å²	121	140.7 Å²	140.7	85%	0.846	80%	0.798	S	S	*	*				172.6	157.5	106.6	45.7	0	0	0	0	114.9
191	Q	22.1	Very low	27.3	Very low	184 Å²	184	145.8 Å²	145.8	86%	0.86	81%	0.81	S	S	*	*			trans	-127.5	178.8	166.3	-77	-170.2	-46.8	0	0	106.7
192	P	48.1	Very low	26.9	Very low	114 Å²	114	141.6 Å²	141.6	74%	0.74	80%	0.803	S	S	*	*				-130.9	-155.6	-51	37.6	-19.9	0	0	0	109.9
193	D	21.8	Very low	26.8	Very low	124 Å²	124	140.3 Å²	140.3	66%	0.663	80%	0.803	S	S	*	*				127.2	150.4	129.7	-157.6	26.5	0	0	0	117.3
194	Q	27	Very low	26.7	Very low	164 Å²	164	134.9 Å²	134.9	77%	0.766	80%	0.799	S	S	*	*			trans	60.8	145.2	168.2	-76	162.5	65.6	0	0	119.7
195	G	24.3	Very low	26.8	Very low	67 Å²	67	139.1 Å²	139.1	69%	0.691	81%	0.807	S	S	*	*			cis	159.9	168.3	-10.8	0	0	0	0	0	116.1
196	Q	27.3	Very low	26.8	Very low	194 Å²	194	138.6 Å²	138.6	91%	0.907	81%	0.805	S	S	*	*			trans	78.1	150.5	168.4	-52.7	-165.4	5.5	0	0	118.7
197	A	24.6	Very low	26.9	Very low	90 Å²	90	141.2 Å²	141.2	74%	0.744	80%	0.804	S	S	*	*			trans	-138.9	178.5	-170.4	0	0	0	0	0	110.2
198	S	26.6	Very low	26.8	Very low	124 Å²	124	139.2 Å²	139.2	87%	0.867	80%	0.799	S	S	*	*			trans	-153.2	153.9	156.9	-81	0	0	0	0	111.5
199	T	25.7	Very low	26.7	Very low	130 Å²	130	138.8 Å²	138.8	80%	0.798	80%	0.797	S	S	*	*			trans	-128.4	-178.5	-169.4	46.8	0	0	0	0	111.6
200	I	26.9	Very low	26.7	Very low	151 Å²	151	138 Å²	138	77%	0.774	79%	0.794	S	S	*	*			trans	121	109.6	172.6	-69	158.4	0	0	0	110.1
201	I	29	Very low	27.3	Very low	164 Å²	164	137.6 Å²	137.6	84%	0.841	79%	0.788	S	S	*	*				67.9	132.5	64.7	-58	168.7	0	0	0	112.1
202	G	24.8	Very low	27.4	Very low	65 Å²	65	134.6 Å²	134.6	67%	0.67	78%	0.778	S	S	*	*			cis	168.7	149.9	-6.5	0	0	0	0	0	113
203	N	27.6	Very low	26.4	Very low	174 Å²	174	136.8 Å²	136.8	93%	0.93	78%	0.776	S	S	*	*			trans	21.6	145	166.9	-63.2	20	0	0	0	124.8
204	G	26.4	Very low	26.9	Very low	78 Å²	78	137 Å²	137	80%	0.804	78%	0.784	S	S	*	*			trans	-179.3	135	157.1	0	0	0	0	0	114.2
205	D	28.2	Very low	26.8	Very low	151 Å²	151	136.2 Å²	136.2	81%	0.807	78%	0.78	S	S	*	*			trans	-106.9	150.5	-171.3	-74.1	-73	0	0	0	115.5
206	L	26.5	Very low	26.7	Very low	155 Å²	155	138.6 Å²	138.6	81%	0.812	79%	0.786	S	S	*	*				163.8	132.4	115.8	-87.9	168.6	0	0	0	116.2
207	L	26.6	Very low	26.6	Very low	152 Å²	152	134.5 Å²	134.5	80%	0.796	78%	0.779	S	S	*	*			trans	23	128	151.2	-67.3	171.7	0	0	0	123
208	L	25	Very low	27.3	Very low	150 Å²	150	134.9 Å²	134.9	79%	0.785	77%	0.774	S	S	*	*				-165.6	127.4	120.4	-132.8	79.9	0	0	0	116.8
209	Q	24.2	Very low	27.4	Very low	181 Å²	181	137.5 Å²	137.5	85%	0.846	77%	0.773	S	S	*	*			trans	63.8	162.8	143.4	-79.3	-177.9	50.8	0	0	125.8
210	K	23.9	Very low	27.4	Very low	166 Å²	166	138.4 Å²	138.4	72%	0.722	77%	0.772	S	S	*	*			trans	-96.2	-178.5	-171.9	-128	-164.2	-179.5	-166.4	0	110.5	N212	K210-N212 WeakPolarHBondContact CE-OD1 3.15Å; K210-N212 PolarHBondContact NZ-OD1 3.41Å
211	P	36.5	Very low	27.3	Very low	112 Å²	112	134.1 Å²	134.1	73%	0.727	77%	0.765	S	S	*	*			cis	-152.3	152.9	44.4	41.9	-19.4	0	0	0	121.5
212	N	24.7	Very low	27.1	Very low	121 Å²	121	134.6 Å²	134.6	65%	0.647	76%	0.764	S	S	*	*			trans	53.8	143.2	133.3	-64.8	-5.4	0	0	0	126.6	K210	K210-N212 WeakPolarHBondContact CE-OD1 3.15Å; K210-N212 PolarHBondContact NZ-OD1 3.41Å
213	K	27.3	Very low	27.1	Very low	159 Å²	159	137.7 Å²	137.7	69%	0.691	77%	0.77	S	S	*	*			trans	-59.1	166.2	155.4	-146.6	-170.8	-169.3	-174.7	0	113	Q215	K213-Q215 HydrophobicContact CD-CB 4.49Å
214	P	31.3	Very low	27	Very low	128 Å²	128	133.3 Å²	133.3	83%	0.831	76%	0.758	S	S	*	*				-130.5	168.2	126.1	37.8	-30.7	0	0	0	114.4
215	Q	25.1	Very low	26.9	Very low	149 Å²	149	136.1 Å²	136.1	70%	0.696	76%	0.759	S	S	*	*			trans	-156.5	140.3	-179.7	170.9	-176.6	-17.9	0	0	108	K213	K213-Q215 HydrophobicContact CD-CB 4.49Å
216	S	21.9	Very low	26.8	Very low	116 Å²	116	134.8 Å²	134.8	81%	0.811	76%	0.756	S	S	*	*			trans	-155	124	176.8	54.3	0	0	0	0	113.6
217	S	25.3	Very low	26.8	Very low	108 Å²	108	132.5 Å²	132.5	76%	0.755	75%	0.754	S	S	*	*			trans	-88.3	-178	154	-45.9	0	0	0	0	109.1
218	P	40.5	Very low	26.7	Very low	99 Å²	99	130.4 Å²	130.4	64%	0.643	75%	0.752	S	S	*	*				-156	178.5	73.9	42.7	-22.1	0	0	0	117.8
219	E	27.6	Very low	26.8	Very low	179 Å²	179	128.7 Å²	128.7	84%	0.836	75%	0.752	S	S	*	*			trans	52.5	151.9	141.1	-74.6	165	100.8	0	0	122.2
220	D	26.3	Very low	27.7	Very low	148 Å²	148	125.2 Å²	125.2	79%	0.791	75%	0.746	S	S	*	*			cis	-166.8	177.9	-14.4	-176.5	25.3	0	0	0	109
221	G	24.6	Very low	27.9	Very low	61 Å²	61	124.7 Å²	124.7	63%	0.629	75%	0.745	S	S	*	*			trans	121.4	78.3	148.6	0	0	0	0	0	122.3
222	Q	25.1	Very low	27.5	Very low	174 Å²	174	124.2 Å²	124.2	81%	0.813	74%	0.741	S	S	*	*			trans	24.1	138	133.3	-63.6	-171.8	27.6	0	0	125.8
223	V	25.4	Very low	27.6	Very low	130 Å²	130	125.7 Å²	125.7	79%	0.788	74%	0.741	S	S	*	*			trans	90.9	104.4	135.9	171.1	0	0	0	0	124.1
224	A	24.7	Very low	27.6	Very low	83 Å²	83	126 Å²	126	69%	0.686	74%	0.743	S	S	*	*				57.4	144.8	129.7	0	0	0	0	0	127.7
225	T	24.9	Very low	27.3	Very low	136 Å²	136	125.8 Å²	125.8	83%	0.834	74%	0.735	S	S	*	*			trans	74.3	148.4	156.8	10.4	0	0	0	0	117.3
226	V	26.4	Very low	27.7	Very low	123 Å²	123	126.9 Å²	126.9	75%	0.745	74%	0.739	S	S	*	*			cis	-141.6	160.6	17.5	-175.6	0	0	0	0	112
227	S	24.7	Very low	28.6	Very low	108 Å²	108	126.5 Å²	126.5	76%	0.755	73%	0.734	S	S	*	*			trans	0.8	159.6	164.3	85.5	0	0	0	0	122.7
228	S	24.7	Very low	28.9	Very low	108 Å²	108	130.3 Å²	130.3	76%	0.755	74%	0.737	S	S	*	*			cis	-161.4	167.3	34.5	52.6	0	0	0	0	115.6
229	S	28.3	Very low	28.4	Very low	113 Å²	113	132.2 Å²	132.2	79%	0.79	75%	0.747	S	S	*	*			trans	-140.2	164	166.6	-53.6	0	0	0	0	108.8
230	P	43.4	Very low	28.3	Very low	109 Å²	109	127.3 Å²	127.3	71%	0.708	75%	0.745	S	S	*	*				-145.1	136.9	104.8	37.6	-22	0	0	0	114.3
231	E	28	Very low	28.5	Very low	154 Å²	154	125 Å²	125	72%	0.72	75%	0.747	S	S	*	*				83.7	138.9	114.2	-74.3	-159.1	96	0	0	116.3	K233	E231-K233 IonicContact OE1-NZ 3.2Å; E231-K233 PolarHBondContact OE1-NZ 3.29Å
232	T	27.4	Very low	28.7	Very low	102 Å²	102	131.9 Å²	131.9	63%	0.626	76%	0.759	S	S	*	*			cis	-169.2	-177.9	4.1	33.7	0	0	0	0	111.1
233	K	26.9	Very low	28.9	Very low	152 Å²	152	129.1 Å²	129.1	66%	0.661	75%	0.754	S	S	*	*			cis	-147.4	150.2	-8.9	-116.9	135.5	-170.3	128.4	0	105.5	E231	E231-K233 IonicContact OE1-NZ 3.2Å; E231-K233 PolarHBondContact OE1-NZ 3.29Å
234	K	27.2	Very low	29	Very low	166 Å²	166	130 Å²	130	72%	0.722	76%	0.755	S	S	*	*				43.6	137.2	101.9	-99	-178.3	155.4	-74	0	115.7
235	D	24	Very low	29.3	Very low	124 Å²	124	131.6 Å²	131.6	66%	0.663	76%	0.759	S	S	*	*			cis	-150.4	164.7	23.4	-116.5	-49.4	0	0	0	115
236	H	35.1	Very low	29.5	Very low	172 Å²	172	130 Å²	130	80%	0.796	76%	0.76	S	S	*	*			trans	-145.7	146.7	167.4	-130.5	-20.9	0	0	0	105.8
237	P	40.2	Very low	29.8	Very low	108 Å²	108	131.4 Å²	131.4	70%	0.701	76%	0.763	S	S	*	*				-164.4	168.6	91.1	43.4	-23	0	0	0	119.3
238	K	31.7	Very low	30	Very low	187 Å²	187	133 Å²	133	81%	0.813	76%	0.758	S	S	*	*			trans	54.6	120.3	135.7	-74	-179.7	176	-178.5	0	124.2
239	T	29.9	Very low	30.3	Very low	139 Å²	139	137.1 Å²	137.1	85%	0.853	76%	0.757	S	S	*	*				70.5	120.1	117.9	-50	0	0	0	0	120.7
240	G	25.2	Very low	30.4	Very low	77 Å²	77	138.3 Å²	138.3	79%	0.794	75%	0.753	S	S	*	*			trans	-168.4	142.8	158.1	0	0	0	0	0	110.5
241	A	29.8	Very low	29.8	Very low	100 Å²	100	140.4 Å²	140.4	83%	0.826	75%	0.753	S	S	*	*			trans	-132.5	142	-178.8	0	0	0	0	0	111.1
242	K	28.7	Very low	29.8	Very low	204 Å²	204	139.9 Å²	139.9	89%	0.887	76%	0.755	S	S	*	*			trans	-173	160.2	144.8	-112.5	171.8	-178.8	-177.2	0	114.9
243	T	30.3	Very low	29.8	Very low	117 Å²	117	143.8 Å²	143.8	72%	0.718	77%	0.771	S	S	*	*			trans	-48	159.8	157.5	52.1	0	0	0	0	111.8
244	D	27.6	Very low	30	Very low	148 Å²	148	140.8 Å²	140.8	79%	0.791	78%	0.775	S	S	*	*				-175.7	-176.5	54.6	-160.4	-0.7	0	0	0	111.5
245	C	32.1	Very low	30.2	Very low	116 Å²	116	138.9 Å²	138.9	78%	0.784	78%	0.78	S	S	*	*			trans	-91.6	149.6	179.2	-47.6	0	0	0	0	113.1
246	A	28.1	Very low	30.3	Very low	103 Å²	103	138.7 Å²	138.7	85%	0.851	79%	0.788	S	S	*	*			trans	-160.3	147.5	152.8	0	0	0	0	0	112.8
247	L	33.1	Very low	30.4	Very low	153 Å²	153	137.3 Å²	137.3	80%	0.801	79%	0.787	S	S	*	*			trans	-107.7	175.3	172.3	-80.9	169.3	0	0	0	111.5
248	H	29	Very low	30.1	Very low	140 Å²	140	140.8 Å²	140.8	65%	0.648	79%	0.793	S	S	*	*			trans	111.9	115.1	158.2	-57.9	-47.9	0	0	0	115.5
249	R	30.1	Very low	30.1	Very low	196 Å²	196	140.1 Å²	140.1	74%	0.74	79%	0.793	S	S	*	*				82.4	118.6	83.5	-158	-166.7	-75.6	150.4	-5.3	108.8
250	I	31.6	Very low	30.3	Very low	138 Å²	138	137.1 Å²	137.1	71%	0.708	78%	0.778	S	S	*	*				-161.7	121.9	77.8	-79.7	163.5	0	0	0	111.2
251	Q	30.3	Very low	30.6	Very low	152 Å²	152	138 Å²	138	71%	0.71	77%	0.772	S	S	*	*				45.8	127	129.4	-57.2	176.3	-35.3	0	0	124.9
252	N	28.4	Very low	30.5	Very low	143 Å²	143	143.8 Å²	143.8	77%	0.765	77%	0.772	S	S	*	*				63.5	114	127	-56.3	-3.2	0	0	0	122.6
253	L	27.4	Very low	30.7	Very low	184 Å²	184	139.3 Å²	139.3	96%	0.963	76%	0.763	S	S	*	*				-160.4	161.3	121	-105.2	158.9	0	0	0	109.7
254	A	29.8	Very low	30.8	Very low	90 Å²	90	139.2 Å²	139.2	74%	0.744	76%	0.762	S	S	*	*			trans	-109.1	160.4	-161.2	0	0	0	0	0	115.3
255	P	32.6	Very low	30.8	Very low	126 Å²	126	138.5 Å²	138.5	82%	0.818	76%	0.757	S	S	*	*				-126.9	162.6	128	37.7	-29.4	0	0	0	109.8
256	S	26.2	Very low	30.7	Very low	120 Å²	120	138.4 Å²	138.4	84%	0.839	76%	0.758	S	S	*	*			cis	179.2	151.6	-12.2	178.5	0	0	0	0	103.8
257	D	36.1	Very low	30.8	Very low	143 Å²	143	141 Å²	141	77%	0.765	75%	0.753	S	S	*	*			trans	-96.3	-164	-171.4	-142.2	-34.1	0	0	0	113.1
258	E	33.8	Very low	30.5	Very low	180 Å²	180	140.9 Å²	140.9	84%	0.841	75%	0.753	S	S	*	*			trans	104.5	85	164.7	-55.8	-70	104.3	0	0	117.8
259	E	32.7	Very low	30.6	Very low	173 Å²	173	139.4 Å²	139.4	81%	0.808	76%	0.758	S	S	*	*			trans	-13.7	156.1	148.1	-104.8	-161.9	76	0	0	124.4
260	S	33.4	Very low	30.4	Very low	77 Å²	77	134.4 Å²	134.4	54%	0.538	76%	0.758	S	S	.	*			trans	63.8	111.3	133.4	-73.4	0	0	0	0	125.7
261	S	31	Very low	30.3	Very low	95 Å²	95	133.2 Å²	133.2	66%	0.664	76%	0.762	S	S	*	*				80.6	169.2	120.8	-60.3	0	0	0	0	121.6
262	W	29.2	Very low	30	Very low	221 Å²	221	133.5 Å²	133.5	84%	0.837	77%	0.768	S	S	*	*			trans	78.4	110.4	168.4	-51.4	106.6	0	0	0	116.5
263	T	33.1	Very low	29.9	Very low	111 Å²	111	132.1 Å²	132.1	68%	0.681	77%	0.77	S	S	*	*				64.5	146.3	76.3	65	0	0	0	0	116
264	T	32.3	Very low	29.9	Very low	115 Å²	115	128.6 Å²	128.6	71%	0.706	76%	0.76	S	S	*	*			cis	-171.8	177.6	-14.5	-77.1	0	0	0	0	107
265	L	27.5	Very low	30.5	Very low	132 Å²	132	129.8 Å²	129.8	69%	0.691	76%	0.761	S	S	*	*			trans	83.8	150.6	171.2	-52.7	173.3	0	0	0	116	Q267	L265-Q267 HydrophobicContact CD2-CG 4.4Å
266	S	28.5	Very low	30.4	Very low	114 Å²	114	130.7 Å²	130.7	80%	0.797	76%	0.758	S	S	*	*			cis	-122	157.4	4.6	-47.3	0	0	0	0	110.8
267	Q	30.9	Very low	30.9	Very low	158 Å²	158	132.7 Å²	132.7	74%	0.738	76%	0.755	S	S	*	*			cis	71.6	94.8	34.5	-80	-166.1	-23.1	0	0	117	L265	L265-Q267 HydrophobicContact CD2-CG 4.4Å
268	D	25.8	Very low	30.7	Very low	151 Å²	151	131.2 Å²	131.2	81%	0.807	75%	0.751	S	S	*	*				-171.1	121.3	126.8	-103.7	-31.2	0	0	0	109
269	S	32.1	Very low	30.5	Very low	109 Å²	109	127.1 Å²	127.1	76%	0.762	75%	0.748	S	S	*	*				82.4	128.4	74.4	-60.7	0	0	0	0	113.2
270	A	25	Very low	30.4	Very low	90 Å²	90	126.3 Å²	126.3	74%	0.744	75%	0.749	S	S	*	*			cis	-155.7	157.8	10.3	0	0	0	0	0	114.7
271	S	29.6	Very low	30.5	Very low	113 Å²	113	130.3 Å²	130.3	79%	0.79	76%	0.763	S	S	*	*			trans	46.7	144.5	143.5	-56.4	0	0	0	0	121.9
272	L	25.8	Very low	30.9	Very low	158 Å²	158	138.3 Å²	138.3	83%	0.827	78%	0.778	S	S	*	*			cis	-148	141.6	46.2	-78.2	161.1	0	0	0	115.9
273	S	24.7	Very low	30.9	Very low	115 Å²	115	132.8 Å²	132.8	80%	0.804	77%	0.774	S	S	*	*			trans	67.4	130	143.8	-52.8	0	0	0	0	123.1
274	S	26.9	Very low	30.8	Very low	109 Å²	109	134.5 Å²	134.5	76%	0.762	78%	0.779	S	S	*	*			trans	-102.7	-161.9	167.2	68.8	0	0	0	0	110.1
275	P	42.9	Very low	30.7	Very low	116 Å²	116	136.7 Å²	136.7	75%	0.753	78%	0.781	S	S	*	*			cis	-102.8	157.5	11.5	4.5	20.8	0	0	0	114.3
276	D	31.6	Very low	31.1	Very low	144 Å²	144	134.2 Å²	134.2	77%	0.77	78%	0.775	S	S	*	*				82.1	147.3	53.2	-138.1	20.3	0	0	0	111.8
277	E	35.6	Very low	31.5	Very low	163 Å²	163	138 Å²	138	76%	0.762	78%	0.777	S	S	*	*			cis	-141	168	5.1	-147.6	-166.3	160.4	0	0	105.6
278	T	31.9	Very low	31.8	Very low	112 Å²	112	139.3 Å²	139.3	69%	0.687	78%	0.783	S	S	*	*			cis	-144.7	143.9	11.1	55	0	0	0	0	110.3
279	A	31	Very low	32.7	Very low	94 Å²	94	137.4 Å²	137.4	78%	0.777	78%	0.777	S	S	*	*			trans	-169.9	105.6	154.4	0	0	0	0	0	112.2
280	D	30.1	Very low	33.7	Very low	155 Å²	155	133.9 Å²	133.9	83%	0.829	75%	0.75	S	S	*	*			trans	172.3	107.9	142	-96.8	-22	0	0	0	110.5
281	I	34.2	Very low	35.2	Very low	161 Å²	161	135.3 Å²	135.3	83%	0.826	75%	0.752	S	S	*	*			trans	-126.2	65.6	174	-48.5	178.4	0	0	0	109.4
282	W	40.1	Very low	36.8	Very low	263 Å²	263	134.2 Å²	134.2	100%	0.996	74%	0.737	S	S	*	*			trans	-162.6	87.1	152.7	-80.8	-32.3	0	0	0	110
283	S	28.7	Very low	39.1	Very low	106 Å²	106	127.6 Å²	127.6	74%	0.741	70%	0.702	S	S	*	*			trans	-129.9	144.1	169	-82.5	0	0	0	0	110.3	H285	S283-H285 PolarHBondContact O-N 2.93Å
284	D	32	Very low	41.7	Very low	147 Å²	147	123.5 Å²	123.5	79%	0.786	67%	0.673	S	S	*	*	S	Bend	trans	-90	61.8	-150.8	-152.2	-1.7	0	0	0	114.3
285	H	29.8	Very low	44.1	Very low	160 Å²	160	124.2 Å²	124.2	74%	0.741	68%	0.675	S	S	*	*			trans	-128.4	14.6	-170.9	-68.2	-15.8	0	0	0	115	S283 F287	S283-H285 PolarHBondContact O-N 2.93Å; H285-F287 VanDerWaalsContact C-N 3.29Å; H285-F287 PolarHBondContact O-N 2.97Å; H285-F287 VanDerWaalsContact O-N 3.13Å
286	S	36.5	Very low	45.9	Very low	81 Å²	81	119.9 Å²	119.9	57%	0.566	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.3	11.9	-167.9	77.4	0	0	0	0	117.4
287	F	36.1	Very low	48.4	Very low	193 Å²	193	115 Å²	115	85%	0.846	62%	0.622	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	3.4	177	-76.9	-70.7	0	0	0	115	H285 T289	H285-F287 VanDerWaalsContact C-N 3.29Å; H285-F287 PolarHBondContact O-N 2.97Å; H285-F287 VanDerWaalsContact O-N 3.13Å; F287-T289 PolarHBondContact O-N 2.95Å
288	Q	37.2	Very low	50.9	Low	186 Å²	186	111.2 Å²	111.2	87%	0.869	60%	0.603	S	S	*	*			trans	-79	111	174.1	-158.6	164	77.9	0	0	109.8
289	T	44.2	Very low	53.6	Low	111 Å²	111	110.7 Å²	110.7	68%	0.681	59%	0.588	S	S	*	*			trans	-69.3	130	172.8	41.7	0	0	0	0	110.5	F287	F287-T289 PolarHBondContact O-N 2.95Å
290	D	54.2	Low	56.3	Low	34 Å²	34	107.9 Å²	107.9	18%	0.182	56%	0.561	C	S	.	*			trans	-58.2	113.3	176.9	-166.3	24.1	0	0	0	109.4	D292 L293 R299	D290-D292 PolarHBondContact O-N 3.1Å; D290-D292 VanDerWaalsContact O-N 3.1Å; D290-L293 HydrophobicContact CB-CD1 3.92Å; D290-L293 HydrophobicContact CB-CG 4.06Å; D290-L293 PolarHBondContact O-N 3.35Å; D290-L293 WeakPolarHBondContact OD2-CD1 2.99Å; D290-R299 IonicContact OD1-CZ 2.67Å; D290-R299 IonicContact OD1-NH1 2.81Å; D290-R299 PolarHBondContact OD1-NH1 3.45Å; D290-R299 IonicContact OD1-NH2 2.79Å; D290-R299 IonicContact OD2-CZ 3.66Å; D290-R299 VanDerWaalsContact OD2-CZ 3.23Å; D290-R299 IonicContact OD2-NE 3.15Å; D290-R299 IonicContact OD2-NH1 2.57Å; D290-R299 PolarHBondContact OD2-NH1 2.7Å; D290-R299 IonicContact OD2-NH2 3.17Å
291	P	55.5	Low	59	Low	121 Å²	121	105.9 Å²	105.9	79%	0.786	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	-16.6	-163.9	25.7	-35.2	0	0	0	114.4	L293	P291-L293 VanDerWaalsContact C-N 3.33Å
292	D	63.2	Low	61.3	Low	90 Å²	90	102.7 Å²	102.7	48%	0.481	54%	0.535	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.1	-8.6	175	-75.2	-0.2	0	0	0	113.5	D290 R320	D290-D292 PolarHBondContact O-N 3.1Å; D290-D292 VanDerWaalsContact O-N 3.1Å; D292-R320 IonicContact OD2-NH1 2.92Å; D292-R320 PolarHBondContact OD2-NH1 3.47Å; D292-R320 VanDerWaalsContact OD2-NH1 3.11Å
293	L	74.9	Confident	63.1	Low	19 Å²	19	98.3 Å²	98.3	10%	0.099	53%	0.53	C	S	.	.	S	Bend	trans	-102	145.8	-173.5	-65.3	-173.8	0	0	0	113.5	D290 P291 W297 R299 Y308 R320	D290-L293 HydrophobicContact CB-CD1 3.92Å; D290-L293 HydrophobicContact CB-CG 4.06Å; D290-L293 PolarHBondContact O-N 3.35Å; D290-L293 WeakPolarHBondContact OD2-CD1 2.99Å; P291-L293 VanDerWaalsContact C-N 3.33Å; L293-W297 HydrophobicContact CB-CB 4.18Å; L293-W297 HydrophobicContact CD1-CB 4.26Å; L293-R299 HydrophobicContact CD1-CB 4.17Å; L293-Y308 HydrophobicContact CD1-CD1 3.92Å; L293-Y308 HydrophobicContact CD1-CE1 4.33Å; L293-Y308 HydrophobicContact CD2-CD1 3.84Å; L293-Y308 HydrophobicContact CD2-CE1 3.86Å; L293-R320 HydrophobicContact CD2-CG 3.91Å
294	P	80	Confident	65.3	Low	28 Å²	28	96.8 Å²	96.8	18%	0.182	52%	0.524	C	S	.	.	P	Polyproline II helix	trans	-61.3	152.3	172	-19.1	31.4	0	0	0	112.2	G296 W297 P321	P294-G296 PolarHBondContact O-N 3Å; P294-W297 WeakPolarHBondContact O-CB 3.37Å; P294-W297 PolarHBondContact O-N 3.44Å; P294-W297 VanDerWaalsContact O-N 3.14Å; P294-P321 HydrophobicContact CG-CB 4.04Å
295	P	76.8	Confident	67.7	Low	124 Å²	124	91.3 Å²	91.3	81%	0.805	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.4	135.9	-179.1	-28.6	35.6	0	0	0	113.4	W297	P295-W297 VanDerWaalsContact C-N 3.34Å
296	G	79.8	Confident	70.4	Confident	25 Å²	25	86.4 Å²	86.4	26%	0.258	48%	0.483	S	S	.	.	T	Hydrogen-bonded Turn	trans	87	-10.7	-178.7	0	0	0	0	0	115.4	P294 H310 I311	P294-G296 PolarHBondContact O-N 3Å; G296-H310 VanDerWaalsContact C-CD2 3.49Å; G296-H310 PolarHBondContact O-CD2 3.46Å; G296-I311 PolarHBondContact O-N 2.98Å
297	W	84.2	Confident	72.9	Confident	41 Å²	41	85.6 Å²	85.6	16%	0.155	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.6	143.6	176.6	-69.5	88.1	0	0	0	113	L293 P294 P295 W309 H310 Q317 P321	L293-W297 HydrophobicContact CB-CB 4.18Å; L293-W297 HydrophobicContact CD1-CB 4.26Å; P294-W297 WeakPolarHBondContact O-CB 3.37Å; P294-W297 PolarHBondContact O-N 3.44Å; P294-W297 VanDerWaalsContact O-N 3.14Å; P295-W297 VanDerWaalsContact C-N 3.34Å; W297-W309 CarbonylContact C-O 3.59Å; W297-W309 WeakPolarHBondContact CA-O 3.37Å; W297-H310 AromaticContact CD1-CD2 3.47Å; W297-H310 VanDerWaalsContact CD1-CD2 3.47Å; W297-H310 HydrophobicContact CD2-CB 3.76Å; W297-H310 AromaticContact CD2-CD2 3.88Å; W297-H310 AromaticContact CE2-CD2 3.65Å; W297-H310 AromaticContact CE2-CG 3.84Å; W297-H310 HydrophobicContact CE3-CB 3.76Å; W297-H310 HydrophobicContact CG-CB 4.49Å; W297-H310 AromaticContact CG-CD2 3.83Å; W297-H310 HydrophobicContact CH2-CB 3.81Å; W297-H310 HydrophobicContact CZ2-CB 3.79Å; W297-H310 HydrophobicContact CZ3-CB 3.78Å; W297-H310 AromaticContact NE1-CD2 3.35Å; W297-H310 PolarHBondContact NE1-CD2 3.06Å; W297-H310 VanDerWaalsContact NE1-CD2 3.35Å; W297-H310 AromaticContact NE1-CG 3.98Å; W297-Q317 HydrophobicContact CH2-CG 3.96Å; W297-Q317 HydrophobicContact CZ3-CG 3.76Å; W297-P321 HydrophobicContact CB-CG 4.49Å; W297-P321 HydrophobicContact CD2-CB 4.05Å; W297-P321 HydrophobicContact CD2-CG 3.46Å; W297-P321 VanDerWaalsContact CD2-CG 3.46Å; W297-P321 HydrophobicContact CE3-CG 3.48Å; W297-P321 VanDerWaalsContact CE3-CG 3.48Å; W297-P321 HydrophobicContact CG-CB 4.27Å; W297-P321 HydrophobicContact CG-CG 3.94Å; W297-P321 HydrophobicContact CH2-CG 4.22Å; W297-P321 HydrophobicContact CZ2-CB 4.48Å; W297-P321 HydrophobicContact CZ2-CG 4.21Å; W297-P321 HydrophobicContact CZ3-CG 3.88Å
298	K	88.4	Confident	75.4	Confident	85 Å²	85	77.3 Å²	77.3	37%	0.37	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132	130.7	176.1	179.1	166.1	-178.8	165.5	0	110.5	Y308 W309 I311	K298-Y308 WeakPolarHBondContact O-CA 3.47Å; K298-W309 PolarHBondContact N-O 2.99Å; K298-W309 PolarHBondContact O-N 3.28Å; K298-I311 HydrophobicContact CB-CD1 4.08Å; K298-I311 HydrophobicContact CB-CG1 4.39Å; K298-I311 HydrophobicContact CD-CD1 4.32Å
299	R	88.5	Confident	77.7	Confident	100 Å²	100	73.3 Å²	73.3	38%	0.377	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.4	133.9	168.5	-171.6	170.9	66.5	-134.5	3.3	109.7	D290 L293 T306 Y308	D290-R299 IonicContact OD1-CZ 2.67Å; D290-R299 IonicContact OD1-NH1 2.81Å; D290-R299 PolarHBondContact OD1-NH1 3.45Å; D290-R299 IonicContact OD1-NH2 2.79Å; D290-R299 IonicContact OD2-CZ 3.66Å; D290-R299 VanDerWaalsContact OD2-CZ 3.23Å; D290-R299 IonicContact OD2-NE 3.15Å; D290-R299 IonicContact OD2-NH1 2.57Å; D290-R299 PolarHBondContact OD2-NH1 2.7Å; D290-R299 IonicContact OD2-NH2 3.17Å; L293-R299 HydrophobicContact CD1-CB 4.17Å; R299-T306 HydrophobicContact CG-CG2 3.58Å; R299-Y308 HydrophobicContact CB-CD1 4.16Å; R299-Y308 HydrophobicContact CB-CE1 4.08Å; R299-Y308 HydrophobicContact CG-CD1 4.32Å; R299-Y308 HydrophobicContact CG-CE1 3.89Å
300	V	87.9	Confident	79.8	Confident	35 Å²	35	69.8 Å²	69.8	21%	0.212	38%	0.384	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	134.2	176.4	-172	0	0	0	0	108.1	T306 Y307 W309	V300-T306 CarbonylContact O-C 3.58Å; V300-T306 WeakPolarHBondContact O-CA 3.38Å; V300-Y307 HydrophobicContact CB-CD1 4.29Å; V300-Y307 HydrophobicContact CB-CD2 4.24Å; V300-Y307 HydrophobicContact CB-CE1 3.95Å; V300-Y307 HydrophobicContact CB-CE2 3.9Å; V300-Y307 HydrophobicContact CB-CG 4.44Å; V300-Y307 HydrophobicContact CG1-CE1 3.75Å; V300-Y307 HydrophobicContact CG1-CE2 4.22Å; V300-Y307 HydrophobicContact CG2-CE2 4.15Å; V300-Y307 PolarHBondContact N-O 2.92Å; V300-Y307 PolarHBondContact O-N 3.42Å; V300-W309 HydrophobicContact CG2-CB 4.27Å
301	N	86.5	Confident	81.3	Confident	113 Å²	113	72.7 Å²	72.7	60%	0.604	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-113.9	131.3	175.4	-65.7	-12.5	0	0	0	108.3	T306	N301-T306 WeakPolarHBondContact OD1-CB 3.39Å; N301-T306 WeakPolarHBondContact OD1-CG2 3.44Å; N301-T306 PolarHBondContact OD1-OG1 3.27Å
302	D	83.4	Confident	82.4	Confident	94 Å²	94	71.5 Å²	71.5	50%	0.503	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.3	176.2	177.1	-175.6	29.6	0	0	0	109.9	A304 G305 Y307	D302-A304 PolarHBondContact O-N 3.06Å; D302-G305 PolarHBondContact N-O 2.87Å; D302-G305 PolarHBondContact O-N 2.68Å; D302-Y307 HydrophobicContact CB-CE1 4.16Å
303	I	77.9	Confident	83.1	Confident	172 Å²	172	71.4 Å²	71.4	88%	0.882	39%	0.394	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-18.7	179.4	62.8	173.4	0	0	0	114.2
304	A	73.9	Confident	83.5	Confident	74 Å²	74	72.6 Å²	72.6	61%	0.612	41%	0.411	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-3.6	175.1	0	0	0	0	0	114.1	D302 W318	D302-A304 PolarHBondContact O-N 3.06Å; A304-W318 HydrophobicContact CB-CH2 3.87Å; A304-W318 HydrophobicContact CB-CZ3 4.49Å
305	G	82.1	Confident	83.6	Confident	32 Å²	32	74.8 Å²	74.8	33%	0.33	42%	0.424	S	S	.	.	E	Extended strand (participates in β ladder)	trans	118.2	-166	-179.9	0	0	0	0	0	114.2	D302	D302-G305 PolarHBondContact N-O 2.87Å; D302-G305 PolarHBondContact O-N 2.68Å
306	T	88.4	Confident	84.2	Confident	57 Å²	57	73.1 Å²	73.1	35%	0.35	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	128.1	177.9	-61.5	0	0	0	0	111.3	R299 V300 N301 Y308	R299-T306 HydrophobicContact CG-CG2 3.58Å; V300-T306 CarbonylContact O-C 3.58Å; V300-T306 WeakPolarHBondContact O-CA 3.38Å; N301-T306 WeakPolarHBondContact OD1-CB 3.39Å; N301-T306 WeakPolarHBondContact OD1-CG2 3.44Å; N301-T306 PolarHBondContact OD1-OG1 3.27Å; T306-Y308 HydrophobicContact CG2-CE2 4.14Å
307	Y	87.4	Confident	84.6	Confident	63 Å²	63	75.2 Å²	75.2	25%	0.247	42%	0.415	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	168.3	166.8	68.2	-86.7	0	0	0	111.1	V300 D302 T316 W318	V300-Y307 HydrophobicContact CB-CD1 4.29Å; V300-Y307 HydrophobicContact CB-CD2 4.24Å; V300-Y307 HydrophobicContact CB-CE1 3.95Å; V300-Y307 HydrophobicContact CB-CE2 3.9Å; V300-Y307 HydrophobicContact CB-CG 4.44Å; V300-Y307 HydrophobicContact CG1-CE1 3.75Å; V300-Y307 HydrophobicContact CG1-CE2 4.22Å; V300-Y307 HydrophobicContact CG2-CE2 4.15Å; V300-Y307 PolarHBondContact N-O 2.92Å; V300-Y307 PolarHBondContact O-N 3.42Å; D302-Y307 HydrophobicContact CB-CE1 4.16Å; Y307-T316 HydrophobicContact CD2-CG2 3.98Å; Y307-T316 HydrophobicContact CE2-CG2 3.83Å; Y307-W318 HydrophobicContact CD1-CH2 4.12Å; Y307-W318 HydrophobicContact CD1-CZ3 4.17Å
308	Y	89.6	Confident	84.8	Confident	20 Å²	20	80.8 Å²	80.8	8%	0.078	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	134.2	-177.3	-56.4	-92.6	0	0	0	109	L293 K298 R299 T306 T316 Q317 E319 R320 P321	L293-Y308 HydrophobicContact CD1-CD1 3.92Å; L293-Y308 HydrophobicContact CD1-CE1 4.33Å; L293-Y308 HydrophobicContact CD2-CD1 3.84Å; L293-Y308 HydrophobicContact CD2-CE1 3.86Å; K298-Y308 WeakPolarHBondContact O-CA 3.47Å; R299-Y308 HydrophobicContact CB-CD1 4.16Å; R299-Y308 HydrophobicContact CB-CE1 4.08Å; R299-Y308 HydrophobicContact CG-CD1 4.32Å; R299-Y308 HydrophobicContact CG-CE1 3.89Å; T306-Y308 HydrophobicContact CG2-CE2 4.14Å; Y308-T316 CarbonylContact O-C 3.6Å; Y308-T316 VanDerWaalsContact O-CA 3.31Å; Y308-T316 WeakPolarHBondContact O-CA 3.46Å; Y308-Q317 PolarHBondContact N-O 3.19Å; Y308-Q317 PolarHBondContact O-N 3.18Å; Y308-E319 VanDerWaalsContact CD2-O 3.29Å; Y308-E319 WeakPolarHBondContact CD2-O 3.35Å; Y308-R320 HydrophobicContact CE1-CB 4.23Å; Y308-R320 HydrophobicContact CE1-CG 3.89Å; Y308-R320 VanDerWaalsContact CE2-CA 3.48Å; Y308-R320 HydrophobicContact CE2-CB 3.88Å; Y308-R320 HydrophobicContact CE2-CG 4.46Å; Y308-R320 PolarHBondContact OH-NE 2.74Å; Y308-P321 HydrophobicContact CG-CG 4.39Å
309	W	86.1	Confident	84.4	Confident	102 Å²	102	84.3 Å²	84.3	39%	0.386	45%	0.453	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	126.9	-175.1	-178.8	40.5	0	0	0	110.4	W297 K298 V300 I311 G314 T316	W297-W309 CarbonylContact C-O 3.59Å; W297-W309 WeakPolarHBondContact CA-O 3.37Å; K298-W309 PolarHBondContact N-O 2.99Å; K298-W309 PolarHBondContact O-N 3.28Å; V300-W309 HydrophobicContact CG2-CB 4.27Å; W309-I311 HydrophobicContact CE3-CG1 4.22Å; W309-I311 HydrophobicContact CZ3-CG1 4.39Å; W309-G314 PolarHBondContact NE1-O 3.19Å; W309-G314 VanDerWaalsContact NE1-O 3.17Å; W309-T316 HydrophobicContact CB-CG2 4.08Å; W309-T316 VanDerWaalsContact CD1-CG2 3.48Å; W309-T316 HydrophobicContact CG-CG2 4Å
310	H	87.9	Confident	84.2	Confident	36 Å²	36	85.2 Å²	85.2	17%	0.167	46%	0.457	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	105.1	174.8	-169.1	-122.5	0	0	0	109.7	G296 W297 T313 G314 T315	G296-H310 VanDerWaalsContact C-CD2 3.49Å; G296-H310 PolarHBondContact O-CD2 3.46Å; W297-H310 AromaticContact CD1-CD2 3.47Å; W297-H310 VanDerWaalsContact CD1-CD2 3.47Å; W297-H310 HydrophobicContact CD2-CB 3.76Å; W297-H310 AromaticContact CD2-CD2 3.88Å; W297-H310 AromaticContact CE2-CD2 3.65Å; W297-H310 AromaticContact CE2-CG 3.84Å; W297-H310 HydrophobicContact CE3-CB 3.76Å; W297-H310 HydrophobicContact CG-CB 4.49Å; W297-H310 AromaticContact CG-CD2 3.83Å; W297-H310 HydrophobicContact CH2-CB 3.81Å; W297-H310 HydrophobicContact CZ2-CB 3.79Å; W297-H310 HydrophobicContact CZ3-CB 3.78Å; W297-H310 AromaticContact NE1-CD2 3.35Å; W297-H310 PolarHBondContact NE1-CD2 3.06Å; W297-H310 VanDerWaalsContact NE1-CD2 3.35Å; W297-H310 AromaticContact NE1-CG 3.98Å; H310-T313 PolarHBondContact ND1-OG1 2.8Å; H310-T313 PolarHBondContact O-N 2.84Å; H310-G314 WeakPolarHBondContact O-CA 3.4Å; H310-G314 PolarHBondContact O-N 3.14Å; H310-T315 PolarHBondContact N-O 3.29Å
311	I	84.6	Confident	83.7	Confident	95 Å²	95	84.1 Å²	84.1	49%	0.487	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-41.5	-172.7	-58.5	167.8	0	0	0	112.4	G296 K298 W309 T313	G296-I311 PolarHBondContact O-N 2.98Å; K298-I311 HydrophobicContact CB-CD1 4.08Å; K298-I311 HydrophobicContact CB-CG1 4.39Å; K298-I311 HydrophobicContact CD-CD1 4.32Å; W309-I311 HydrophobicContact CE3-CG1 4.22Å; W309-I311 HydrophobicContact CZ3-CG1 4.39Å; I311-T313 PolarHBondContact O-N 2.93Å
312	P	79.1	Confident	83.2	Confident	96 Å²	96	84.4 Å²	84.4	62%	0.623	46%	0.456	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-24.7	-178.7	-22.4	34.7	0	0	0	116
313	T	78.6	Confident	81.7	Confident	88 Å²	88	83.1 Å²	83.1	54%	0.54	45%	0.454	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.7	-8	-176.8	57.3	0	0	0	0	113.7	H310 I311 T315	H310-T313 PolarHBondContact ND1-OG1 2.8Å; H310-T313 PolarHBondContact O-N 2.84Å; I311-T313 PolarHBondContact O-N 2.93Å; T313-T315 PolarHBondContact O-N 3.12Å; T313-T315 PolarHBondContact OG1-OG1 3.35Å
314	G	83.3	Confident	80	Confident	44 Å²	44	82.3 Å²	82.3	45%	0.454	45%	0.45	S	S	.	.			trans	74.7	-3.3	-176.8	0	0	0	0	0	115.2	W309 H310	W309-G314 PolarHBondContact NE1-O 3.19Å; W309-G314 VanDerWaalsContact NE1-O 3.17Å; H310-G314 WeakPolarHBondContact O-CA 3.4Å; H310-G314 PolarHBondContact O-N 3.14Å
315	T	81.6	Confident	78.3	Confident	74 Å²	74	84.5 Å²	84.5	45%	0.454	46%	0.458	S	S	.	.			trans	-74.6	136.2	-172.9	48	0	0	0	0	112.8	H310 T313	H310-T315 PolarHBondContact N-O 3.29Å; T313-T315 PolarHBondContact O-N 3.12Å; T313-T315 PolarHBondContact OG1-OG1 3.35Å
316	T	88.9	Confident	76.1	Confident	90 Å²	90	88 Å²	88	55%	0.552	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.2	148.1	176.9	50.9	0	0	0	0	112.1	Y307 Y308 W309	Y307-T316 HydrophobicContact CD2-CG2 3.98Å; Y307-T316 HydrophobicContact CE2-CG2 3.83Å; Y308-T316 CarbonylContact O-C 3.6Å; Y308-T316 VanDerWaalsContact O-CA 3.31Å; Y308-T316 WeakPolarHBondContact O-CA 3.46Å; W309-T316 HydrophobicContact CB-CG2 4.08Å; W309-T316 VanDerWaalsContact CD1-CG2 3.48Å; W309-T316 HydrophobicContact CG-CG2 4Å
317	Q	88.1	Confident	73.5	Confident	69 Å²	69	92.3 Å²	92.3	32%	0.322	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-150	151.3	174	59.5	-179.4	67.4	0	0	111.2	W297 Y308 E319	W297-Q317 HydrophobicContact CH2-CG 3.96Å; W297-Q317 HydrophobicContact CZ3-CG 3.76Å; Y308-Q317 PolarHBondContact N-O 3.19Å; Y308-Q317 PolarHBondContact O-N 3.18Å; Q317-E319 PolarHBondContact NE2-O 3.26Å
318	W	88.3	Confident	71	Confident	157 Å²	157	97.4 Å²	97.4	60%	0.595	54%	0.535	S	S	*	.	S	Bend	trans	-83.7	-23.7	178.8	-64.3	94.7	0	0	0	113.2	A304 Y307	A304-W318 HydrophobicContact CB-CH2 3.87Å; A304-W318 HydrophobicContact CB-CZ3 4.49Å; Y307-W318 HydrophobicContact CD1-CH2 4.12Å; Y307-W318 HydrophobicContact CD1-CZ3 4.17Å
319	E	80.5	Confident	68.3	Low	160 Å²	160	105.7 Å²	105.7	75%	0.748	58%	0.575	S	S	*	*	S	Bend	trans	-84	143.2	179.8	-62.4	176.6	162.5	0	0	111.2	Y308 Q317 P321	Y308-E319 VanDerWaalsContact CD2-O 3.29Å; Y308-E319 WeakPolarHBondContact CD2-O 3.35Å; Q317-E319 PolarHBondContact NE2-O 3.26Å; E319-P321 WeakPolarHBondContact O-CD 3.46Å
320	R	84.6	Confident	65.5	Low	118 Å²	118	104.4 Å²	104.4	45%	0.445	59%	0.593	S	S	.	*	P	Polyproline II helix	trans	-68	123	180	-173.7	-178.1	-73.9	-157.8	0.5	110.5	D292 L293 Y308 V322	D292-R320 IonicContact OD2-NH1 2.92Å; D292-R320 PolarHBondContact OD2-NH1 3.47Å; D292-R320 VanDerWaalsContact OD2-NH1 3.11Å; L293-R320 HydrophobicContact CD2-CG 3.91Å; Y308-R320 HydrophobicContact CE1-CB 4.23Å; Y308-R320 HydrophobicContact CE1-CG 3.89Å; Y308-R320 VanDerWaalsContact CE2-CA 3.48Å; Y308-R320 HydrophobicContact CE2-CB 3.88Å; Y308-R320 HydrophobicContact CE2-CG 4.46Å; Y308-R320 PolarHBondContact OH-NE 2.74Å; R320-V322 PolarHBondContact O-N 3.42Å
321	P	77.5	Confident	62.9	Low	12 Å²	12	107.1 Å²	107.1	8%	0.078	62%	0.616	C	S	.	*	P	Polyproline II helix	trans	-61.5	127	170.6	-16.4	27.7	0	0	0	110.3	P294 W297 Y308 E319	P294-P321 HydrophobicContact CG-CB 4.04Å; W297-P321 HydrophobicContact CB-CG 4.49Å; W297-P321 HydrophobicContact CD2-CB 4.05Å; W297-P321 HydrophobicContact CD2-CG 3.46Å; W297-P321 VanDerWaalsContact CD2-CG 3.46Å; W297-P321 HydrophobicContact CE3-CG 3.48Å; W297-P321 VanDerWaalsContact CE3-CG 3.48Å; W297-P321 HydrophobicContact CG-CB 4.27Å; W297-P321 HydrophobicContact CG-CG 3.94Å; W297-P321 HydrophobicContact CH2-CG 4.22Å; W297-P321 HydrophobicContact CZ2-CB 4.48Å; W297-P321 HydrophobicContact CZ2-CG 4.21Å; W297-P321 HydrophobicContact CZ3-CG 3.88Å; Y308-P321 HydrophobicContact CG-CG 4.39Å; E319-P321 WeakPolarHBondContact O-CD 3.46Å
322	V	74.9	Confident	60.5	Low	120 Å²	120	113.8 Å²	113.8	73%	0.727	64%	0.635	S	S	*	*	P	Polyproline II helix	trans	-93.5	125.5	-175.8	-174.2	0	0	0	0	110.5	R320	R320-V322 PolarHBondContact O-N 3.42Å
323	S	53.1	Low	58.4	Low	66 Å²	66	119.2 Å²	119.2	46%	0.462	65%	0.649	S	S	.	*	P	Polyproline II helix	trans	-76.5	119.8	167.2	40	0	0	0	0	109.9	P325	S323-P325 WeakPolarHBondContact O-CD 3.34Å
324	I	40.9	Very low	55.9	Low	155 Å²	155	118.7 Å²	118.7	80%	0.795	66%	0.661	S	S	*	*	P	Polyproline II helix	trans	-85.3	117.8	178.5	-57.9	176.2	0	0	0	108.8
325	P	37.8	Very low	53.3	Low	121 Å²	121	121.8 Å²	121.8	79%	0.786	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-72.4	131.4	175.2	-14.7	30.8	0	0	0	110.7	S323 D327	S323-P325 WeakPolarHBondContact O-CD 3.34Å; P325-D327 PolarHBondContact O-N 2.92Å
326	A	37.3	Very low	50.9	Low	105 Å²	105	125.9 Å²	125.9	87%	0.868	69%	0.694	S	S	*	*			trans	-98	80.1	179.5	0	0	0	0	0	111.8
327	D	33.7	Very low	48.1	Very low	147 Å²	147	127 Å²	127	79%	0.786	71%	0.705	S	S	*	*			trans	-159.4	123.5	144.1	-138.8	-18.3	0	0	0	114.3	P325	P325-D327 PolarHBondContact O-N 2.92Å
328	L	33.8	Very low	45.3	Very low	170 Å²	170	129.3 Å²	129.3	89%	0.89	73%	0.729	S	S	*	*			trans	173.1	119.6	150	-102.1	170.2	0	0	0	109.6
329	Q	33.7	Very low	42.5	Very low	195 Å²	195	127.7 Å²	127.7	91%	0.911	74%	0.736	S	S	*	*			trans	-73.4	136.7	178.3	-68.1	-170.4	-16.7	0	0	112.6
330	G	27.7	Very low	40.2	Very low	74 Å²	74	126.2 Å²	126.2	76%	0.763	74%	0.739	S	S	*	*			trans	-146.4	9.1	-167.9	0	0	0	0	0	119.7
331	S	32.1	Very low	37.9	Very low	94 Å²	94	126.5 Å²	126.5	66%	0.657	76%	0.756	S	S	*	*			trans	61.2	111.5	166.1	162.5	0	0	0	0	120.1
332	R	35.6	Very low	35.5	Very low	234 Å²	234	131.2 Å²	131.2	88%	0.883	79%	0.789	S	S	*	*			trans	72.8	147.2	154.8	-56.7	165.8	-179.6	-176.4	-0.3	115.3
333	K	34.1	Very low	33.8	Very low	211 Å²	211	131.6 Å²	131.6	92%	0.917	79%	0.794	S	S	*	*			cis	-160.2	146	7.6	-143.3	-175.5	-178	-171.7	0	109.9
334	G	27.1	Very low	32.6	Very low	76 Å²	76	134.7 Å²	134.7	78%	0.784	81%	0.81	S	S	*	*			trans	139.7	121	159.6	0	0	0	0	0	117.2
335	S	28.5	Very low	32.6	Very low	109 Å²	109	132.7 Å²	132.7	76%	0.762	81%	0.807	S	S	*	*			trans	-19.9	128.5	171.7	-56.9	0	0	0	0	118.4
336	L	31.8	Very low	32.1	Very low	160 Å²	160	135.7 Å²	135.7	84%	0.838	81%	0.81	S	S	*	*				68.8	133.1	70.3	-65.9	166.5	0	0	0	113.5
337	S	29	Very low	31.6	Very low	113 Å²	113	137.5 Å²	137.5	79%	0.79	81%	0.806	S	S	*	*			cis	-160.4	164.2	0.1	42.2	0	0	0	0	112.8
338	S	28.5	Very low	31.4	Very low	118 Å²	118	136.5 Å²	136.5	83%	0.825	80%	0.796	S	S	*	*			trans	-92.9	-178.7	-173.5	57.5	0	0	0	0	115.4
339	V	31	Very low	31.2	Very low	124 Å²	124	136.3 Å²	136.3	75%	0.752	79%	0.788	S	S	*	*			trans	-95.5	172.5	-175	-145.3	0	0	0	0	112.8
340	T	31.9	Very low	30.9	Very low	129 Å²	129	134.9 Å²	134.9	79%	0.791	78%	0.782	S	S	*	*			trans	69.7	162.6	160.4	44.6	0	0	0	0	117.5
341	P	36.3	Very low	31.2	Very low	124 Å²	124	136.9 Å²	136.9	81%	0.805	78%	0.781	S	S	*	*			cis	-130.2	-174.8	11.1	43	-26.6	0	0	0	116.8
342	S	27.6	Very low	31.2	Very low	110 Å²	110	144.2 Å²	144.2	77%	0.769	80%	0.795	S	S	*	*			trans	-96.2	164.3	170.8	-44.6	0	0	0	0	112.3
343	P	37.7	Very low	31.1	Very low	128 Å²	128	138.8 Å²	138.8	83%	0.831	79%	0.792	S	S	*	*				-149.3	-175.7	102.1	38.5	-20.4	0	0	0	116.4
344	T	27.7	Very low	31	Very low	132 Å²	132	135.2 Å²	135.2	81%	0.81	78%	0.783	S	S	*	*			trans	-96.8	-175.2	-177.2	52.9	0	0	0	0	112.9
345	P	42.1	Very low	31	Very low	112 Å²	112	141.8 Å²	141.8	73%	0.727	79%	0.791	S	S	*	*			cis	-141	-163	7.5	29.9	-2	0	0	0	116.9
346	E	26.5	Very low	31.3	Very low	184 Å²	184	141 Å²	141	86%	0.86	79%	0.791	S	S	*	*			trans	90.7	98	155.7	-53.3	-157.7	123	0	0	123.3
347	N	27.7	Very low	31.5	Very low	143 Å²	143	139.8 Å²	139.8	77%	0.765	79%	0.789	S	S	*	*				43.1	109.8	126	-165.8	38.2	0	0	0	122.8
348	E	28.7	Very low	31.7	Very low	127 Å²	127	142.3 Å²	142.3	59%	0.593	79%	0.793	S	S	*	*				175.7	140.9	106.1	-93	-152.4	134.8	0	0	114.3
349	K	29.8	Very low	32	Very low	166 Å²	166	144.6 Å²	144.6	72%	0.722	80%	0.796	S	S	*	*			trans	66.1	133.6	150.8	-66.5	158.9	-174.6	152.4	0	121.9
350	Q	26.9	Very low	32.5	Very low	165 Å²	165	143.1 Å²	143.1	77%	0.771	81%	0.806	S	S	*	*			trans	-59.6	171.3	166.5	-105.1	93.8	-12.9	0	0	114.3
351	P	34.6	Very low	32.7	Very low	115 Å²	115	140 Å²	140	75%	0.747	80%	0.799	S	S	*	*			cis	-131.4	174.9	18.4	35.9	-16	0	0	0	117.5
352	W	33.1	Very low	33.2	Very low	249 Å²	249	144.1 Å²	144.1	94%	0.943	80%	0.804	S	S	*	*			trans	-76.3	129.4	172.6	-56.3	-47	0	0	0	112.6
353	S	32.3	Very low	34.1	Very low	119 Å²	119	144.4 Å²	144.4	83%	0.832	80%	0.796	S	S	*	*			trans	-168.7	34	158.5	51.5	0	0	0	0	116.3
354	D	31.7	Very low	34.9	Very low	136 Å²	136	143.6 Å²	143.6	73%	0.727	79%	0.785	S	S	*	*			trans	-149.2	120.4	163.9	-157.1	-8.5	0	0	0	114
355	F	28.3	Very low	35.8	Very low	215 Å²	215	141.8 Å²	141.8	94%	0.943	78%	0.778	S	S	*	*			trans	180	61	156.6	-113.2	-144.8	0	0	0	109.7
356	A	33.5	Very low	36.3	Very low	93 Å²	93	141.4 Å²	141.4	77%	0.769	77%	0.769	S	S	*	*			trans	-136.9	17.5	-173.1	0	0	0	0	0	116
357	V	36.3	Very low	37.6	Very low	133 Å²	133	137.2 Å²	137.2	81%	0.806	75%	0.752	S	S	*	*			trans	-136.4	69.4	178.7	-164.1	0	0	0	0	113.4
358	L	34.3	Very low	38.8	Very low	167 Å²	167	138.1 Å²	138.1	87%	0.874	75%	0.745	S	S	*	*	S	Bend	trans	-146.1	67.7	154.8	-86.3	-169.8	0	0	0	112.2
359	N	33.2	Very low	39.8	Very low	166 Å²	166	139.1 Å²	139.1	89%	0.888	75%	0.747	S	S	*	*	S	Bend	trans	-177.8	136.2	133.2	-92.8	-31.9	0	0	0	110.1	G361	N359-G361 PolarHBondContact O-N 2.95Å
360	G	43	Very low	40.9	Very low	92 Å²	92	136.9 Å²	136.9	95%	0.948	74%	0.743	S	S	*	*			trans	-76.7	105.1	-172.7	0	0	0	0	0	113.4
361	G	36.2	Very low	42.1	Very low	63 Å²	63	134.2 Å²	134.2	65%	0.649	73%	0.733	S	S	*	*			trans	-147.5	125.7	170.8	0	0	0	0	0	111.6	N359 I363	N359-G361 PolarHBondContact O-N 2.95Å; G361-I363 PolarHBondContact O-N 2.95Å
362	K	45.8	Very low	42.8	Very low	211 Å²	211	134.5 Å²	134.5	92%	0.917	73%	0.725	S	S	*	*			trans	-72.5	107.2	172	-91.6	-175.3	172.3	-179.4	0	109.5
363	I	47.3	Very low	43.6	Very low	117 Å²	117	125.5 Å²	125.5	60%	0.6	70%	0.703	S	S	*	*			trans	-76.7	138.5	163.2	56.6	173.8	0	0	0	109.8	G361 I367	G361-I363 PolarHBondContact O-N 2.95Å; I363-I367 HydrophobicContact CB-CD1 4.32Å
364	N	52.8	Low	44.3	Very low	110 Å²	110	123 Å²	123	59%	0.588	69%	0.69	S	S	*	*			trans	-79.7	152.4	-178.2	-75.8	-34.9	0	0	0	112	D366 I367	N364-D366 PolarHBondContact O-N 2.83Å; N364-D366 VanDerWaalsContact O-N 3.11Å; N364-I367 PolarHBondContact O-N 3.36Å
365	S	47.3	Very low	45.2	Very low	94 Å²	94	121.2 Å²	121.2	66%	0.657	68%	0.684	S	S	*	*	H	α-helix	trans	-55.3	-29.9	-177.2	-163.3	0	0	0	0	113.6	I367 W368	S365-I367 PolarHBondContact O-N 2.91Å; S365-W368 WeakPolarHBondContact O-CB 3.49Å; S365-W368 PolarHBondContact O-N 2.93Å
366	D	52.8	Low	46.2	Very low	104 Å²	104	116 Å²	116	56%	0.556	67%	0.669	S	S	*	*	H	α-helix	trans	-72.3	-31.1	-174.8	-47	-73.2	0	0	0	112.3	N364 W368 K369 D370	N364-D366 PolarHBondContact O-N 2.83Å; N364-D366 VanDerWaalsContact O-N 3.11Å; D366-W368 PolarHBondContact O-N 2.92Å; D366-K369 WeakPolarHBondContact O-CB 3.39Å; D366-K369 PolarHBondContact O-N 2.87Å; D366-D370 PolarHBondContact O-N 2.9Å
367	I	54.7	Low	47	Very low	96 Å²	96	118 Å²	118	49%	0.492	67%	0.667	S	S	.	*	H	α-helix	trans	-61.9	-33	174.8	-56.1	173.4	0	0	0	110.7	I363 N364 S365 K369 L371	I363-I367 HydrophobicContact CB-CD1 4.32Å; N364-I367 PolarHBondContact O-N 3.36Å; S365-I367 PolarHBondContact O-N 2.91Å; I367-K369 VanDerWaalsContact C-N 3.31Å; I367-K369 PolarHBondContact O-N 3.15Å; I367-L371 WeakPolarHBondContact O-CB 3.32Å; I367-L371 PolarHBondContact O-N 2.85Å
368	W	51.6	Low	47.6	Very low	162 Å²	162	115.3 Å²	115.3	61%	0.614	65%	0.652	S	S	*	*	H	α-helix	trans	-70.8	-23.3	176.1	-100.3	84	0	0	0	113.5	S365 D366 H372	S365-W368 WeakPolarHBondContact O-CB 3.49Å; S365-W368 PolarHBondContact O-N 2.93Å; D366-W368 PolarHBondContact O-N 2.92Å; W368-H372 PolarHBondContact O-N 3.14Å
369	K	49.7	Very low	48.5	Very low	148 Å²	148	111.4 Å²	111.4	64%	0.643	63%	0.633	S	S	*	*	H	α-helix	trans	-75.9	-46.5	173.3	-77.7	-179	173.5	174.5	0	111.7	D366 I367 L371 H372 A373	D366-K369 WeakPolarHBondContact O-CB 3.39Å; D366-K369 PolarHBondContact O-N 2.87Å; I367-K369 VanDerWaalsContact C-N 3.31Å; I367-K369 PolarHBondContact O-N 3.15Å; K369-L371 VanDerWaalsContact C-N 3.32Å; K369-L371 PolarHBondContact O-N 2.77Å; K369-H372 PolarHBondContact O-N 3.21Å; K369-H372 VanDerWaalsContact O-N 3.11Å; K369-A373 PolarHBondContact O-N 3.26Å
370	D	52.6	Low	49.6	Very low	119 Å²	119	108.2 Å²	108.2	64%	0.636	62%	0.621	S	S	*	*	H	α-helix	trans	-64.6	-38.2	-178.7	-68	-15.5	0	0	0	111.6	D366 H372 A373 A374	D366-D370 PolarHBondContact O-N 2.9Å; D370-H372 VanDerWaalsContact C-N 3.3Å; D370-H372 PolarHBondContact O-N 3.26Å; D370-A373 PolarHBondContact O-N 3.37Å; D370-A374 PolarHBondContact O-N 2.88Å
371	L	52.4	Low	50.1	Low	109 Å²	109	107.1 Å²	107.1	57%	0.571	60%	0.599	S	S	*	*	H	α-helix	trans	-63.3	-34	173.8	-172.5	63.5	0	0	0	112.7	I367 K369 T375	I367-L371 WeakPolarHBondContact O-CB 3.32Å; I367-L371 PolarHBondContact O-N 2.85Å; K369-L371 VanDerWaalsContact C-N 3.32Å; K369-L371 PolarHBondContact O-N 2.77Å; L371-T375 PolarHBondContact O-N 2.82Å; L371-T375 PolarHBondContact O-OG1 2.92Å
372	H	48.9	Very low	50.9	Low	122 Å²	122	109.4 Å²	109.4	57%	0.565	60%	0.596	S	S	*	*	H	α-helix	trans	-75	-37.8	174.6	-131.1	54.5	0	0	0	111.6	W368 K369 D370 T375 V376	W368-H372 PolarHBondContact O-N 3.14Å; K369-H372 PolarHBondContact O-N 3.21Å; K369-H372 VanDerWaalsContact O-N 3.11Å; D370-H372 VanDerWaalsContact C-N 3.3Å; D370-H372 PolarHBondContact O-N 3.26Å; H372-T375 WeakPolarHBondContact O-CB 3.48Å; H372-T375 PolarHBondContact O-N 3Å; H372-V376 WeakPolarHBondContact O-CG2 3.33Å; H372-V376 PolarHBondContact O-N 2.89Å; H372-V376 VanDerWaalsContact O-N 3.14Å
373	A	49.8	Very low	51.5	Low	60 Å²	60	106.1 Å²	106.1	50%	0.496	58%	0.581	S	S	.	*	H	α-helix	trans	-61.5	-44.1	174.9	0	0	0	0	0	112	K369 D370 T375 V376 N377	K369-A373 PolarHBondContact O-N 3.26Å; D370-A373 PolarHBondContact O-N 3.37Å; A373-T375 VanDerWaalsContact C-N 3.26Å; A373-T375 PolarHBondContact O-N 3.03Å; A373-V376 PolarHBondContact O-N 2.82Å; A373-N377 PolarHBondContact O-N 2.97Å
374	A	47	Very low	52	Low	66 Å²	66	107.5 Å²	107.5	55%	0.545	59%	0.585	S	S	.	*	H	α-helix	trans	-63.7	-28.4	175	0	0	0	0	0	113.5	D370	D370-A374 PolarHBondContact O-N 2.88Å
375	T	51.7	Low	52.6	Low	99 Å²	99	109 Å²	109	61%	0.607	59%	0.587	S	S	*	*	H	α-helix	trans	-75.1	-30.5	175.1	-55.5	0	0	0	0	112.5	L371 H372 A373	L371-T375 PolarHBondContact O-N 2.82Å; L371-T375 PolarHBondContact O-OG1 2.92Å; H372-T375 WeakPolarHBondContact O-CB 3.48Å; H372-T375 PolarHBondContact O-N 3Å; A373-T375 VanDerWaalsContact C-N 3.26Å; A373-T375 PolarHBondContact O-N 3.03Å
376	V	49.6	Very low	53.1	Low	104 Å²	104	110.4 Å²	110.4	63%	0.63	58%	0.583	S	S	*	*	H	α-helix	trans	-88.8	-24.2	-175.1	174.2	0	0	0	0	113.1	H372 A373	H372-V376 WeakPolarHBondContact O-CG2 3.33Å; H372-V376 PolarHBondContact O-N 2.89Å; H372-V376 VanDerWaalsContact O-N 3.14Å; A373-V376 PolarHBondContact O-N 2.82Å
377	N	50.8	Low	53.6	Low	135 Å²	135	106.8 Å²	106.8	72%	0.722	57%	0.57	S	S	*	*	S	Bend	trans	-129.1	90.4	167.6	-83.3	-70.2	0	0	0	110.4	A373	A373-N377 PolarHBondContact O-N 2.97Å
378	P	47.5	Very low	53.9	Low	77 Å²	77	104.1 Å²	104.1	50%	0.5	56%	0.562	S	S	.	*			trans	-66.6	136.6	169.8	28.3	-34	0	0	0	110.3
379	D	53.8	Low	54.4	Low	86 Å²	86	99.7 Å²	99.7	46%	0.46	55%	0.553	S	S	.	*			trans	-57.8	130.4	175.6	-169.9	-56	0	0	0	110.3	S381 L382 K383	D379-S381 VanDerWaalsContact CG-OG 3.31Å; D379-S381 PolarHBondContact O-N 3.15Å; D379-S381 VanDerWaalsContact O-N 3.15Å; D379-S381 VanDerWaalsContact OD1-CB 3.31Å; D379-S381 WeakPolarHBondContact OD1-CB 3.31Å; D379-S381 PolarHBondContact OD1-N 2.92Å; D379-S381 PolarHBondContact OD1-OG 2.79Å; D379-L382 HydrophobicContact CB-CB 4.43Å; D379-L382 HydrophobicContact CB-CD1 4.46Å; D379-L382 PolarHBondContact O-N 3.05Å; D379-K383 PolarHBondContact O-N 3.12Å
380	P	56.7	Low	54.9	Low	98 Å²	98	97.7 Å²	97.7	64%	0.636	55%	0.549	S	S	*	.	H	α-helix	trans	-51.8	-37	177.9	-28.2	35.6	0	0	0	113.5	L382 K383 E384	P380-L382 PolarHBondContact O-N 2.93Å; P380-K383 PolarHBondContact O-N 2.94Å; P380-E384 PolarHBondContact O-N 2.73Å
381	S	52.8	Low	55	Low	69 Å²	69	100.1 Å²	100.1	48%	0.483	55%	0.549	S	S	.	.	H	α-helix	trans	-68.1	-33.4	-179.7	66.9	0	0	0	0	113.3	D379 E384 F385	D379-S381 VanDerWaalsContact CG-OG 3.31Å; D379-S381 PolarHBondContact O-N 3.15Å; D379-S381 VanDerWaalsContact O-N 3.15Å; D379-S381 VanDerWaalsContact OD1-CB 3.31Å; D379-S381 WeakPolarHBondContact OD1-CB 3.31Å; D379-S381 PolarHBondContact OD1-N 2.92Å; D379-S381 PolarHBondContact OD1-OG 2.79Å; S381-E384 PolarHBondContact O-N 3.11Å; S381-F385 WeakPolarHBondContact O-CB 3.17Å; S381-F385 PolarHBondContact O-N 3.44Å
382	L	52.8	Low	54.8	Low	112 Å²	112	102.3 Å²	102.3	59%	0.586	55%	0.551	S	S	*	*	H	α-helix	trans	-68.6	-37.6	172.6	-92.9	168.4	0	0	0	111.1	D379 P380 F385 E386	D379-L382 HydrophobicContact CB-CB 4.43Å; D379-L382 HydrophobicContact CB-CD1 4.46Å; D379-L382 PolarHBondContact O-N 3.05Å; P380-L382 PolarHBondContact O-N 2.93Å; L382-F385 PolarHBondContact O-N 3.37Å; L382-E386 WeakPolarHBondContact O-CB 3.33Å; L382-E386 PolarHBondContact O-N 2.9Å
383	K	59.6	Low	54.5	Low	142 Å²	142	98.9 Å²	98.9	62%	0.617	54%	0.543	S	S	*	.	H	α-helix	trans	-69.6	-34.6	177.3	-150.3	171.8	-171.6	176.1	0	112	D379 P380 G387	D379-K383 PolarHBondContact O-N 3.12Å; P380-K383 PolarHBondContact O-N 2.94Å; K383-G387 PolarHBondContact O-N 3.3Å
384	E	56.6	Low	54.1	Low	145 Å²	145	99.6 Å²	99.6	68%	0.678	55%	0.545	S	S	*	.	H	α-helix	trans	-69.4	-39.5	169.4	-72.5	-169.8	139.1	0	0	112.5	P380 S381 G387 A388	P380-E384 PolarHBondContact O-N 2.73Å; S381-E384 PolarHBondContact O-N 3.11Å; E384-G387 CarbonylContact O-C 3.57Å; E384-G387 PolarHBondContact O-N 2.94Å; E384-A388 VanDerWaalsContact O-CB 3.23Å; E384-A388 WeakPolarHBondContact O-CB 3.49Å; E384-A388 PolarHBondContact O-N 3.37Å
385	F	65.6	Low	54.2	Low	142 Å²	142	102 Å²	102	62%	0.623	55%	0.548	S	S	*	.	H	α-helix	trans	-67.3	-43	176.9	-179.6	-97.3	0	0	0	112.5	S381 L382 A388 T389	S381-F385 WeakPolarHBondContact O-CB 3.17Å; S381-F385 PolarHBondContact O-N 3.44Å; L382-F385 PolarHBondContact O-N 3.37Å; F385-A388 PolarHBondContact O-N 3.38Å; F385-T389 WeakPolarHBondContact O-CB 3.49Å; F385-T389 PolarHBondContact O-N 2.83Å; F385-T389 PolarHBondContact O-OG1 2.9Å
386	E	57.6	Low	53.7	Low	124 Å²	124	106.3 Å²	106.3	58%	0.579	56%	0.558	S	S	*	*	H	α-helix	trans	-65	-43.7	173.4	-172.2	172.3	-135.6	0	0	110.6	L382 A388 T389 L390	L382-E386 WeakPolarHBondContact O-CB 3.33Å; L382-E386 PolarHBondContact O-N 2.9Å; E386-A388 VanDerWaalsContact C-N 3.33Å; E386-A388 PolarHBondContact O-N 3.49Å; E386-T389 PolarHBondContact O-N 3.09Å; E386-L390 HydrophobicContact CG-CD1 4.09Å; E386-L390 WeakPolarHBondContact O-CB 3.29Å; E386-L390 WeakPolarHBondContact O-CG 3.48Å; E386-L390 PolarHBondContact O-N 2.97Å
387	G	62.9	Low	53.1	Low	27 Å²	27	108.5 Å²	108.5	28%	0.278	57%	0.566	S	S	.	*	H	α-helix	trans	-65.8	-27.7	173.4	0	0	0	0	0	114.6	K383 E384 R391	K383-G387 PolarHBondContact O-N 3.3Å; E384-G387 CarbonylContact O-C 3.57Å; E384-G387 PolarHBondContact O-N 2.94Å; G387-R391 WeakPolarHBondContact O-CB 3.44Å; G387-R391 VanDerWaalsContact O-CG 3.29Å; G387-R391 WeakPolarHBondContact O-CG 3.17Å; G387-R391 PolarHBondContact O-N 3.21Å; G387-R391 PolarHBondContact O-NE 3.44Å; G387-R391 VanDerWaalsContact O-NE 3.14Å
388	A	60.9	Low	52.2	Low	40 Å²	40	113.3 Å²	113.3	33%	0.331	57%	0.574	S	S	.	*	H	α-helix	trans	-74.9	-42.6	171.2	0	0	0	0	0	111.1	E384 F385 E386 R391 Y392	E384-A388 VanDerWaalsContact O-CB 3.23Å; E384-A388 WeakPolarHBondContact O-CB 3.49Å; E384-A388 PolarHBondContact O-N 3.37Å; F385-A388 PolarHBondContact O-N 3.38Å; E386-A388 VanDerWaalsContact C-N 3.33Å; E386-A388 PolarHBondContact O-N 3.49Å; A388-R391 PolarHBondContact O-N 2.85Å; A388-Y392 PolarHBondContact O-N 3.3Å
389	T	63.8	Low	51.5	Low	69 Å²	69	117.5 Å²	117.5	42%	0.423	59%	0.592	S	S	.	*	H	α-helix	trans	-64.5	-44	177.2	-58.2	0	0	0	0	111.4	F385 E386 Y392 A393	F385-T389 WeakPolarHBondContact O-CB 3.49Å; F385-T389 PolarHBondContact O-N 2.83Å; F385-T389 PolarHBondContact O-OG1 2.9Å; E386-T389 PolarHBondContact O-N 3.09Å; T389-Y392 PolarHBondContact O-N 2.88Å; T389-A393 WeakPolarHBondContact O-CB 3.32Å; T389-A393 PolarHBondContact O-N 3.48Å
390	L	58.8	Low	50.3	Low	106 Å²	106	117.4 Å²	117.4	56%	0.555	60%	0.603	S	S	*	*	H	α-helix	trans	-66.1	-37.4	175	-73	170.8	0	0	0	112.1	E386 A393 S394	E386-L390 HydrophobicContact CG-CD1 4.09Å; E386-L390 WeakPolarHBondContact O-CB 3.29Å; E386-L390 WeakPolarHBondContact O-CG 3.48Å; E386-L390 PolarHBondContact O-N 2.97Å; L390-A393 PolarHBondContact O-N 3.02Å; L390-S394 WeakPolarHBondContact O-CB 3.2Å; L390-S394 PolarHBondContact O-N 3.49Å; L390-S394 PolarHBondContact O-OG 2.82Å
391	R	55.8	Low	49.5	Very low	171 Å²	171	119.1 Å²	119.1	65%	0.645	61%	0.614	S	S	*	*	H	α-helix	trans	-61.3	-47.6	169.4	-81.4	-176.6	-74.6	174.1	-4.1	111.6	G387 A388 A393 S394 L395	G387-R391 WeakPolarHBondContact O-CB 3.44Å; G387-R391 VanDerWaalsContact O-CG 3.29Å; G387-R391 WeakPolarHBondContact O-CG 3.17Å; G387-R391 PolarHBondContact O-N 3.21Å; G387-R391 PolarHBondContact O-NE 3.44Å; G387-R391 VanDerWaalsContact O-NE 3.14Å; A388-R391 PolarHBondContact O-N 2.85Å; R391-A393 VanDerWaalsContact C-N 3.33Å; R391-A393 PolarHBondContact O-N 3.35Å; R391-S394 WeakPolarHBondContact O-CB 3.36Å; R391-S394 PolarHBondContact O-N 2.81Å; R391-S394 VanDerWaalsContact O-N 3.1Å; R391-L395 WeakPolarHBondContact O-CD1 3.19Å; R391-L395 PolarHBondContact O-N 3.19Å; R391-L395 VanDerWaalsContact O-N 3.12Å
392	Y	48.8	Very low	48.2	Very low	155 Å²	155	123.8 Å²	123.8	61%	0.608	63%	0.628	S	S	*	*	H	α-helix	trans	-61.4	-37.2	177	-118.1	-94.5	0	0	0	113.2	A388 T389	A388-Y392 PolarHBondContact O-N 3.3Å; T389-Y392 PolarHBondContact O-N 2.88Å
393	A	41	Very low	47.8	Very low	49 Å²	49	123 Å²	123	41%	0.405	63%	0.629	S	S	.	*	H	α-helix	trans	-68.5	-37.5	173.2	0	0	0	0	0	112.1	T389 L390 R391 L395 K396	T389-A393 WeakPolarHBondContact O-CB 3.32Å; T389-A393 PolarHBondContact O-N 3.48Å; L390-A393 PolarHBondContact O-N 3.02Å; R391-A393 VanDerWaalsContact C-N 3.33Å; R391-A393 PolarHBondContact O-N 3.35Å; A393-L395 VanDerWaalsContact C-N 3.32Å; A393-L395 PolarHBondContact O-N 3.47Å; A393-K396 PolarHBondContact O-N 3.38Å
394	S	42.2	Very low	46.7	Very low	75 Å²	75	122.3 Å²	122.3	52%	0.524	63%	0.633	S	S	.	*	H	α-helix	trans	-66	-33.3	179.7	-58.7	0	0	0	0	112.5	L390 R391 K396 L397	L390-S394 WeakPolarHBondContact O-CB 3.2Å; L390-S394 PolarHBondContact O-N 3.49Å; L390-S394 PolarHBondContact O-OG 2.82Å; R391-S394 WeakPolarHBondContact O-CB 3.36Å; R391-S394 PolarHBondContact O-N 2.81Å; R391-S394 VanDerWaalsContact O-N 3.1Å; S394-K396 PolarHBondContact O-N 3.19Å; S394-K396 VanDerWaalsContact O-N 3.15Å; S394-L397 PolarHBondContact O-N 3.02Å
395	L	47.9	Very low	45.8	Very low	118 Å²	118	122.9 Å²	122.9	62%	0.618	64%	0.64	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59	-21.4	171.7	-92.9	76.8	0	0	0	113.3	R391 A393	R391-L395 WeakPolarHBondContact O-CD1 3.19Å; R391-L395 PolarHBondContact O-N 3.19Å; R391-L395 VanDerWaalsContact O-N 3.12Å; A393-L395 VanDerWaalsContact C-N 3.32Å; A393-L395 PolarHBondContact O-N 3.47Å
396	K	41.7	Very low	44.8	Very low	188 Å²	188	123.7 Å²	123.7	82%	0.817	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-1.7	-179.6	-92.3	-173	172.2	-178	0	115.8	A393 S394	A393-K396 PolarHBondContact O-N 3.38Å; S394-K396 PolarHBondContact O-N 3.19Å; S394-K396 VanDerWaalsContact O-N 3.15Å
397	L	37.3	Very low	43.5	Very low	151 Å²	151	124.7 Å²	124.7	79%	0.791	66%	0.66	S	S	*	*	T	Hydrogen-bonded Turn	trans	-127.6	-4.9	-171.3	-82.4	169.3	0	0	0	116.3	S394 N399	S394-L397 PolarHBondContact O-N 3.02Å; L397-N399 PolarHBondContact O-N 3.49Å
398	R	32.3	Very low	42.4	Very low	235 Å²	235	128 Å²	128	89%	0.887	68%	0.679	S	S	*	*			trans	-78.9	82.1	179.7	-173	171.8	170.6	162.8	-2.9	112
399	N	33.1	Very low	40.9	Very low	166 Å²	166	132 Å²	132	89%	0.888	70%	0.704	S	S	*	*			trans	-140.4	57.6	168.7	-136.1	11	0	0	0	112.5	L397	L397-N399 PolarHBondContact O-N 3.49Å
400	A	28.9	Very low	39.2	Very low	83 Å²	83	133.8 Å²	133.8	69%	0.686	72%	0.719	S	S	*	*	S	Bend	trans	-150.6	140	165.9	0	0	0	0	0	109.1
401	P	38.2	Very low	38.2	Very low	135 Å²	135	133.7 Å²	133.7	88%	0.877	72%	0.718	S	S	*	*			trans	-84.8	133.3	177.6	32.7	-32.4	0	0	0	111.7
402	H	26.7	Very low	37	Very low	166 Å²	166	133.3 Å²	133.3	77%	0.769	73%	0.728	S	S	*	*			trans	-130.1	131.7	156.6	-162.4	-65.8	0	0	0	106.1
403	P	44.8	Very low	36.4	Very low	95 Å²	95	130 Å²	130	62%	0.617	73%	0.728	S	S	*	*			trans	-76	178.5	174.9	34.9	-37.3	0	0	0	111.4
404	D	35.3	Very low	36.4	Very low	129 Å²	129	131.9 Å²	131.9	69%	0.69	73%	0.732	S	S	*	*			trans	109.9	102.1	160.9	-50.5	-18.2	0	0	0	115.5
405	D	38.6	Very low	36.9	Very low	157 Å²	157	134.8 Å²	134.8	84%	0.84	75%	0.749	S	S	*	*			trans	66.2	127.7	149.6	-54.1	-15.8	0	0	0	123.4
406	D	43.9	Very low	37.5	Very low	158 Å²	158	134.1 Å²	134.1	85%	0.845	74%	0.742	S	S	*	*			trans	-15.6	127.7	172.9	-69.3	-43.3	0	0	0	120.1
407	D	31.1	Very low	39.2	Very low	145 Å²	145	127 Å²	127	78%	0.775	72%	0.718	S	S	*	*				-153	144.6	97.7	-143	-36.2	0	0	0	113.3	C409	D407-C409 PolarHBondContact O-N 2.91Å
408	S	38.5	Very low	41.8	Very low	97 Å²	97	122.5 Å²	122.5	68%	0.678	69%	0.692	S	S	*	*	S	Bend	trans	-0.1	82.4	167.3	48.8	0	0	0	0	120.8
409	C	30.9	Very low	44.7	Very low	124 Å²	124	114.7 Å²	114.7	84%	0.838	67%	0.673	S	S	*	*			trans	179.3	48.8	137	-96.3	0	0	0	0	113.7	D407 I411	D407-C409 PolarHBondContact O-N 2.91Å; C409-I411 PolarHBondContact O-N 2.92Å; C409-I411 VanDerWaalsContact O-N 3.13Å
410	S	27.4	Very low	47.7	Very low	106 Å²	106	107.8 Å²	107.8	74%	0.741	64%	0.635	S	S	*	*			trans	-69.1	105.3	162.7	39.7	0	0	0	0	109.6	N412	S410-N412 PolarHBondContact O-N 3.04Å
411	I	37.2	Very low	50.8	Low	105 Å²	105	105.4 Å²	105.4	54%	0.538	62%	0.615	S	S	.	*			trans	-56.9	122	155.7	-64.1	176.3	0	0	0	105.5	C409 S413	C409-I411 PolarHBondContact O-N 2.92Å; C409-I411 VanDerWaalsContact O-N 3.13Å; I411-S413 PolarHBondContact O-N 3.36Å; I411-S413 PolarHBondContact O-OG 3.37Å
412	N	30.6	Very low	53.5	Low	162 Å²	162	99.1 Å²	99.1	87%	0.866	58%	0.575	S	S	*	*			trans	-63.2	81.8	166.7	-80.9	-56.3	0	0	0	107.7	S410 D414	S410-N412 PolarHBondContact O-N 3.04Å; N412-D414 PolarHBondContact O-N 3.03Å; N412-D414 VanDerWaalsContact O-N 3.11Å
413	S	36.2	Very low	56.6	Low	86 Å²	86	96.6 Å²	96.6	60%	0.601	56%	0.558	S	S	*	*			trans	-82.2	94.6	-172.4	-55.6	0	0	0	0	106.1	I411	I411-S413 PolarHBondContact O-N 3.36Å; I411-S413 PolarHBondContact O-OG 3.37Å
414	D	40.8	Very low	58.8	Low	89 Å²	89	92.2 Å²	92.2	48%	0.476	53%	0.53	S	S	.	.			trans	-49.6	126.4	166.4	-170.4	-43.4	0	0	0	107.7	N412 E416 A417	N412-D414 PolarHBondContact O-N 3.03Å; N412-D414 VanDerWaalsContact O-N 3.11Å; D414-E416 PolarHBondContact O-N 2.99Å; D414-E416 WeakPolarHBondContact OD1-CB 3.36Å; D414-E416 PolarHBondContact OD1-N 2.97Å; D414-A417 WeakPolarHBondContact O-CB 3.37Å; D414-A417 PolarHBondContact O-N 3.18Å
415	P	53.3	Low	61.4	Low	136 Å²	136	87.1 Å²	87.1	88%	0.883	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-7.3	-179.4	24.5	-34.7	0	0	0	114.2
416	E	61	Low	63.9	Low	104 Å²	104	79.7 Å²	79.7	49%	0.486	46%	0.463	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	-16.2	170.9	-158.2	167.6	-148.7	0	0	114.2	D414 K418 K548	D414-E416 PolarHBondContact O-N 2.99Å; D414-E416 WeakPolarHBondContact OD1-CB 3.36Å; D414-E416 PolarHBondContact OD1-N 2.97Å; E416-K418 PolarHBondContact O-N 2.77Å; E416-K548 IonicContact OE1-NZ 3.71Å; E416-K548 PolarHBondContact OE1-NZ 3.37Å; E416-K548 IonicContact OE2-NZ 2.83Å; E416-K548 PolarHBondContact OE2-NZ 3.1Å
417	A	78	Confident	66.1	Low	37 Å²	37	75.5 Å²	75.5	31%	0.306	44%	0.436	S	S	.	.			trans	-74.9	121.6	-177.5	0	0	0	0	0	113.1	D414 E476	D414-A417 WeakPolarHBondContact O-CB 3.37Å; D414-A417 PolarHBondContact O-N 3.18Å; A417-E476 HydrophobicContact CB-CB 4.38Å; A417-E476 HydrophobicContact CB-CG 3.8Å
418	K	90.8	Very high	69.1	Low	57 Å²	57	69.8 Å²	69.8	25%	0.248	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	118	-173.9	-64.8	175.9	-179.1	177.8	0	112.6	E416 F420 I474 L475 S541 E544	E416-K418 PolarHBondContact O-N 2.77Å; K418-F420 HydrophobicContact CB-CE2 3.85Å; K418-F420 HydrophobicContact CB-CZ 4.11Å; K418-I474 CarbonylContact O-C 3.59Å; K418-I474 WeakPolarHBondContact O-CA 3.13Å; K418-L475 HydrophobicContact CB-CB 4.41Å; K418-L475 PolarHBondContact N-O 2.63Å; K418-L475 PolarHBondContact O-N 3.11Å; K418-S541 WeakPolarHBondContact CD-OG 3.5Å; K418-S541 PolarHBondContact NZ-OG 2.84Å; K418-E544 IonicContact NZ-OE2 2.78Å; K418-E544 PolarHBondContact NZ-OE2 3.2Å
419	C	93.9	Very high	71.7	Confident	72 Å²	72	70.9 Å²	70.9	49%	0.486	40%	0.4	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	137.6	-177.3	-176.7	0	0	0	0	112.5	Y472 I474	C419-Y472 WeakPolarHBondContact SG-CD1 3.43Å; C419-I474 HydrophobicContact CB-CG1 4.31Å
420	F	95.5	Very high	74.8	Confident	21 Å²	21	65.7 Å²	65.7	9%	0.092	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	128.8	-179	-54.2	-87.3	0	0	0	111.1	K418 V422 Y472 L473 L475 A537 I538	K418-F420 HydrophobicContact CB-CE2 3.85Å; K418-F420 HydrophobicContact CB-CZ 4.11Å; F420-V422 HydrophobicContact CB-CG1 4.33Å; F420-V422 PolarHBondContact O-N 2.86Å; F420-Y472 WeakPolarHBondContact O-CA 3.47Å; F420-L473 HydrophobicContact CD2-CD2 4.17Å; F420-L473 PolarHBondContact N-O 2.89Å; F420-L473 PolarHBondContact O-N 3.41Å; F420-L475 HydrophobicContact CE2-CD1 3.93Å; F420-L475 HydrophobicContact CE2-CG 4.29Å; F420-A537 HydrophobicContact CE1-CB 4.04Å; F420-I538 HydrophobicContact CB-CD1 3.84Å; F420-I538 HydrophobicContact CB-CG1 4.14Å; F420-I538 HydrophobicContact CD1-CD1 4.36Å; F420-I538 HydrophobicContact CD1-CG1 3.72Å; F420-I538 HydrophobicContact CD2-CD1 4.35Å; F420-I538 HydrophobicContact CD2-CG1 3.95Å; F420-I538 HydrophobicContact CE1-CG1 4.07Å; F420-I538 HydrophobicContact CE2-CG1 4.29Å; F420-I538 HydrophobicContact CG-CD1 3.94Å; F420-I538 HydrophobicContact CG-CG1 3.66Å; F420-I538 HydrophobicContact CZ-CG1 4.34Å
421	A	94.4	Very high	77.9	Confident	32 Å²	32	62.3 Å²	62.3	26%	0.264	34%	0.343	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	124.6	170.1	0	0	0	0	0	110.5	Y472 D532	A421-Y472 HydrophobicContact CB-CD1 4.41Å; A421-Y472 HydrophobicContact CB-CE1 4.17Å; A421-D532 HydrophobicContact CB-CB 4.26Å; A421-D532 PolarHBondContact O-N 3.39Å
422	V	94.5	Very high	80.5	Confident	4 Å²	4	61.4 Å²	61.4	2%	0.024	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	155.9	-177	-56.1	0	0	0	0	112.2	F420 D470 M471 L473 F529 R530 C531 I538	F420-V422 HydrophobicContact CB-CG1 4.33Å; F420-V422 PolarHBondContact O-N 2.86Å; V422-D470 CarbonylContact O-C 3.59Å; V422-D470 WeakPolarHBondContact O-CA 3.32Å; V422-M471 PolarHBondContact N-O 3.4Å; V422-M471 PolarHBondContact O-N 2.87Å; V422-L473 HydrophobicContact CG1-CB 4.08Å; V422-L473 HydrophobicContact CG2-CB 3.84Å; V422-F529 HydrophobicContact CB-CB 4.19Å; V422-F529 HydrophobicContact CG2-CB 4.47Å; V422-F529 HydrophobicContact CG2-CD1 4.02Å; V422-R530 CarbonylContact C-O 3.56Å; V422-R530 VanDerWaalsContact CA-O 3.29Å; V422-R530 WeakPolarHBondContact CA-O 3Å; V422-C531 HydrophobicContact CG1-CB 4.28Å; V422-I538 HydrophobicContact CG1-CD1 3.92Å
423	R	92.1	Very high	83.5	Confident	112 Å²	112	59.5 Å²	59.5	42%	0.423	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	126	170.7	-176.8	172.5	-63.4	-168.4	-4.3	109.8	K469 D470 F529 R530	R423-K469 VanDerWaalsContact CA-O 3.29Å; R423-K469 WeakPolarHBondContact CA-O 3.41Å; R423-D470 IonicContact CZ-OD1 2.95Å; R423-D470 IonicContact CZ-OD2 2.84Å; R423-D470 IonicContact NE-OD1 3.79Å; R423-D470 PolarHBondContact NE-OD1 3.4Å; R423-D470 IonicContact NE-OD2 2.6Å; R423-D470 IonicContact NH2-OD1 2.69Å; R423-D470 PolarHBondContact NH2-OD1 2.8Å; R423-D470 IonicContact NH2-OD2 2.7Å; R423-D470 PolarHBondContact NH2-OD2 2.73Å; R423-F529 CarbonylContact O-C 3.41Å; R423-F529 VanDerWaalsContact O-CA 3.27Å; R423-F529 WeakPolarHBondContact O-CA 3.39Å; R423-R530 PolarHBondContact N-O 3.3Å; R423-R530 PolarHBondContact O-N 2.96Å
424	S	91.8	Very high	86.3	Confident	4 Å²	4	58.5 Å²	58.5	3%	0.028	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.9	136.2	175.5	161.9	0	0	0	0	110.7	G426 W465 G466 G468 K469	S424-G426 PolarHBondContact OG-N 3.12Å; S424-G426 VanDerWaalsContact OG-N 3.11Å; S424-W465 PolarHBondContact OG-O 2.81Å; S424-G466 WeakPolarHBondContact CB-O 3.37Å; S424-G466 PolarHBondContact OG-O 3.03Å; S424-G468 PolarHBondContact O-N 3.22Å; S424-K469 PolarHBondContact N-O 3.47Å; S424-K469 VanDerWaalsContact N-O 3.12Å
425	L	89.4	Confident	88.8	Confident	21 Å²	21	54.9 Å²	54.9	11%	0.11	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	12.9	172	-53.1	-174.7	0	0	0	111.2	L451 V528 R530	L425-L451 HydrophobicContact CB-CB 4.02Å; L425-V528 HydrophobicContact CB-CB 4.42Å; L425-V528 HydrophobicContact CB-CG1 4.33Å; L425-V528 HydrophobicContact CD1-CG1 4.04Å; L425-V528 PolarHBondContact N-O 3.37Å; L425-R530 HydrophobicContact CD1-CB 4.28Å; L425-R530 HydrophobicContact CD2-CB 4.19Å; L425-R530 HydrophobicContact CG-CB 4.33Å
426	G	89.9	Confident	90.6	Very high	2 Å²	2	50 Å²	50	2%	0.021	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	88.4	-155.9	-173.9	0	0	0	0	0	113.6	S424 V528	S424-G426 PolarHBondContact OG-N 3.12Å; S424-G426 VanDerWaalsContact OG-N 3.11Å; G426-V528 PolarHBondContact O-N 3Å; G426-V528 VanDerWaalsContact O-N 3.08Å
427	W	92	Very high	92	Very high	70 Å²	70	51.3 Å²	51.3	27%	0.265	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.9	158.3	-179.8	58	-90.6	0	0	0	111.7	E429 K525 C526	W427-E429 HydrophobicContact CZ3-CB 4.34Å; W427-K525 HydrophobicContact CD2-CB 4.43Å; W427-K525 HydrophobicContact CD2-CD 3.93Å; W427-K525 HydrophobicContact CD2-CG 4.18Å; W427-K525 HydrophobicContact CE3-CB 4.09Å; W427-K525 HydrophobicContact CE3-CD 3.85Å; W427-K525 HydrophobicContact CE3-CG 3.66Å; W427-K525 HydrophobicContact CH2-CD 4.32Å; W427-K525 HydrophobicContact CZ2-CD 4.37Å; W427-K525 HydrophobicContact CZ3-CD 4.05Å; W427-K525 HydrophobicContact CZ3-CG 3.93Å; W427-C526 CarbonylContact C-O 3.59Å; W427-C526 WeakPolarHBondContact CA-O 3.26Å; W427-C526 WeakPolarHBondContact CB-O 3.31Å
428	V	92.4	Very high	92.5	Very high	25 Å²	25	52.7 Å²	52.7	15%	0.152	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	141.6	173.7	-167.7	0	0	0	0	109.2	C447 L451 C526	V428-C447 HydrophobicContact CB-CB 4.39Å; V428-C447 HydrophobicContact CG2-CB 4.11Å; V428-L451 HydrophobicContact CG2-CD1 3.68Å; V428-L451 HydrophobicContact CG2-CD2 4.15Å; V428-L451 HydrophobicContact CG2-CG 3.8Å; V428-C526 PolarHBondContact N-O 2.94Å; V428-C526 PolarHBondContact O-N 3.16Å
429	E	94.6	Very high	92.6	Very high	120 Å²	120	55.2 Å²	55.2	56%	0.561	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.4	138.8	170.6	173.1	159.1	-167.8	0	0	111.2	W427 I523	W427-E429 HydrophobicContact CZ3-CB 4.34Å; E429-I523 HydrophobicContact CB-CG2 4.2Å; E429-I523 VanDerWaalsContact CD-CG2 3.48Å; E429-I523 HydrophobicContact CG-CG2 3.58Å; E429-I523 WeakPolarHBondContact OE1-CG2 3.45Å
430	M	94.2	Very high	92.7	Very high	14 Å²	14	52.8 Å²	52.8	7%	0.069	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	137.9	-175.9	-59.5	-61	-57.4	0	0	111.6	D434 L435 A443 C447 V515 L524 C526	M430-D434 HydrophobicContact CE-CB 4.21Å; M430-L435 HydrophobicContact CE-CD2 4.1Å; M430-A443 HydrophobicContact CE-CB 3.77Å; M430-C447 PolarHBondContact SD-SG 2.99Å; M430-V515 HydrophobicContact CB-CG1 4.46Å; M430-V515 HydrophobicContact CG-CG1 4.01Å; M430-L524 HydrophobicContact CB-CB 3.88Å; M430-L524 PolarHBondContact N-O 3.42Å; M430-C526 HydrophobicContact CG-CB 3.64Å; M430-C526 HydrophobicContact SD-CB 3.63Å
431	A	93.8	Very high	92.6	Very high	36 Å²	36	54.3 Å²	54.3	30%	0.298	31%	0.305	S	S	.	.			trans	-75.1	154.4	166.9	0	0	0	0	0	111.2	E433 D434	A431-E433 VanDerWaalsContact C-N 3.34Å; A431-E433 HydrophobicContact CB-CG 3.99Å; A431-E433 WeakPolarHBondContact CB-OE2 3.4Å; A431-D434 PolarHBondContact O-N 2.96Å
432	E	92.1	Very high	92.6	Very high	85 Å²	85	56.5 Å²	56.5	40%	0.397	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.5	-38.4	179.8	178.6	68.6	-128	0	0	110.5	D434 L435 R500 R517 L524	E432-D434 VanDerWaalsContact C-N 3.3Å; E432-D434 PolarHBondContact O-N 3.22Å; E432-L435 PolarHBondContact O-N 2.87Å; E432-R500 IonicContact OE1-CZ 2.79Å; E432-R500 IonicContact OE1-NH1 3.74Å; E432-R500 PolarHBondContact OE1-NH1 3.03Å; E432-R500 IonicContact OE1-NH2 2.78Å; E432-R500 PolarHBondContact OE1-NH2 3.43Å; E432-R500 IonicContact OE2-CZ 3.98Å; E432-R500 IonicContact OE2-NH1 3.31Å; E432-R500 PolarHBondContact OE2-NH1 3.13Å; E432-R517 IonicContact OE2-NH2 2.75Å; E432-R517 PolarHBondContact OE2-NH2 3.27Å; E432-L524 HydrophobicContact CB-CD1 4.29Å
433	E	92.8	Very high	92.6	Very high	122 Å²	122	56.9 Å²	56.9	57%	0.57	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-19.3	178.6	58.5	-95.8	-127	0	0	114.9	A431 A436 K439	A431-E433 VanDerWaalsContact C-N 3.34Å; A431-E433 HydrophobicContact CB-CG 3.99Å; A431-E433 WeakPolarHBondContact CB-OE2 3.4Å; E433-A436 WeakPolarHBondContact O-CB 3.22Å; E433-K439 VanDerWaalsContact O-CD 3.26Å; E433-K439 WeakPolarHBondContact O-CD 3.49Å; E433-K439 PolarHBondContact O-NZ 2.8Å
434	D	94.3	Very high	92.8	Very high	66 Å²	66	51.6 Å²	51.6	35%	0.353	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.5	-25.6	173.8	-78.7	-33	0	0	0	112	M430 A431 E432 A436 K439 S440 A443	M430-D434 HydrophobicContact CE-CB 4.21Å; A431-D434 PolarHBondContact O-N 2.96Å; E432-D434 VanDerWaalsContact C-N 3.3Å; E432-D434 PolarHBondContact O-N 3.22Å; D434-A436 PolarHBondContact O-N 3.43Å; D434-K439 CarbonylContact O-C 3.5Å; D434-K439 WeakPolarHBondContact O-CB 3.36Å; D434-S440 WeakPolarHBondContact O-CA 3.42Å; D434-S440 PolarHBondContact O-N 2.82Å; D434-S440 VanDerWaalsContact O-N 3.14Å; D434-A443 HydrophobicContact CB-CB 3.98Å
435	L	93.8	Very high	92.9	Very high	13 Å²	13	52.4 Å²	52.4	7%	0.068	30%	0.303	C	S	.	.	S	Bend	trans	-81.4	1.8	174.5	-56.1	-174.8	0	0	0	113.1	M430 E432 V501 V515 L524	M430-L435 HydrophobicContact CE-CD2 4.1Å; E432-L435 PolarHBondContact O-N 2.87Å; L435-V501 HydrophobicContact CD2-CG2 4.16Å; L435-V515 HydrophobicContact CD1-CG1 3.75Å; L435-V515 HydrophobicContact CD2-CB 4.38Å; L435-V515 HydrophobicContact CD2-CG1 4.05Å; L435-V515 HydrophobicContact CD2-CG2 4.16Å; L435-L524 HydrophobicContact CD1-CD1 3.8Å; L435-L524 HydrophobicContact CD1-CD2 3.99Å; L435-L524 HydrophobicContact CD1-CG 4.32Å
436	A	91.8	Very high	93.1	Very high	33 Å²	33	55.8 Å²	55.8	27%	0.273	32%	0.321	S	S	.	.	S	Bend	trans	-58.6	147	175.2	0	0	0	0	0	112.1	E433 D434 G438 K439 S440	E433-A436 WeakPolarHBondContact O-CB 3.22Å; D434-A436 PolarHBondContact O-N 3.43Å; A436-G438 PolarHBondContact O-N 3.43Å; A436-K439 HydrophobicContact CB-CD 4.36Å; A436-K439 PolarHBondContact O-N 3.33Å; A436-S440 PolarHBondContact O-N 3.49Å; A436-S440 VanDerWaalsContact O-N 3.11Å
437	P	90	Very high	93.3	Very high	131 Å²	131	56 Å²	56	85%	0.851	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.5	134.2	175.5	-27.8	35.7	0	0	0	112.4	K439	P437-K439 VanDerWaalsContact C-N 3.27Å; P437-K439 PolarHBondContact O-N 3Å
438	G	88.5	Confident	93.3	Very high	67 Å²	67	53 Å²	53	69%	0.691	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.4	-33.8	-174.7	0	0	0	0	0	114.7	A436	A436-G438 PolarHBondContact O-N 3.43Å
439	K	93.7	Very high	93.3	Very high	109 Å²	109	57.8 Å²	57.8	47%	0.474	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86	-41	176.9	-67.7	-175.4	-179.5	-178.1	0	113.5	E433 D434 A436 P437 S441 V442 A443	E433-K439 VanDerWaalsContact O-CD 3.26Å; E433-K439 WeakPolarHBondContact O-CD 3.49Å; E433-K439 PolarHBondContact O-NZ 2.8Å; D434-K439 CarbonylContact O-C 3.5Å; D434-K439 WeakPolarHBondContact O-CB 3.36Å; A436-K439 HydrophobicContact CB-CD 4.36Å; A436-K439 PolarHBondContact O-N 3.33Å; P437-K439 VanDerWaalsContact C-N 3.27Å; P437-K439 PolarHBondContact O-N 3Å; K439-S441 VanDerWaalsContact C-N 3.27Å; K439-S441 PolarHBondContact O-N 3.01Å; K439-S441 VanDerWaalsContact O-N 3.08Å; K439-V442 WeakPolarHBondContact O-CA 3.36Å; K439-V442 WeakPolarHBondContact O-CB 3.33Å; K439-V442 PolarHBondContact O-N 2.97Å; K439-A443 PolarHBondContact O-N 2.76Å; K439-A443 VanDerWaalsContact O-N 3.12Å
440	S	95.4	Very high	93	Very high	22 Å²	22	56.8 Å²	56.8	15%	0.154	32%	0.322	C	S	.	.	H	α-helix	trans	-51.5	-39.8	-169.6	60.7	0	0	0	0	114.9	D434 A436 V442 A443 V444	D434-S440 WeakPolarHBondContact O-CA 3.42Å; D434-S440 PolarHBondContact O-N 2.82Å; D434-S440 VanDerWaalsContact O-N 3.14Å; A436-S440 PolarHBondContact O-N 3.49Å; A436-S440 VanDerWaalsContact O-N 3.11Å; S440-V442 VanDerWaalsContact C-N 3.3Å; S440-V442 PolarHBondContact O-N 2.65Å; S440-A443 PolarHBondContact O-N 2.89Å; S440-V444 WeakPolarHBondContact O-CB 3.44Å; S440-V444 WeakPolarHBondContact O-CG2 3.22Å; S440-V444 PolarHBondContact O-N 2.83Å
441	S	93.4	Very high	92.7	Very high	53 Å²	53	57.3 Å²	57.3	37%	0.371	33%	0.325	S	S	.	.	H	α-helix	trans	-66.6	-28.8	179	74.8	0	0	0	0	113.9	K439 N445	K439-S441 VanDerWaalsContact C-N 3.27Å; K439-S441 PolarHBondContact O-N 3.01Å; K439-S441 VanDerWaalsContact O-N 3.08Å; S441-N445 PolarHBondContact O-N 3.03Å; S441-N445 PolarHBondContact O-ND2 2.82Å
442	V	93.8	Very high	92.3	Very high	78 Å²	78	56.6 Å²	56.6	47%	0.473	32%	0.318	S	S	.	.	H	α-helix	trans	-78.3	-47.9	175.1	-177.9	0	0	0	0	109.4	K439 S440 V444 N445 N446	K439-V442 WeakPolarHBondContact O-CA 3.36Å; K439-V442 WeakPolarHBondContact O-CB 3.33Å; K439-V442 PolarHBondContact O-N 2.97Å; S440-V442 VanDerWaalsContact C-N 3.3Å; S440-V442 PolarHBondContact O-N 2.65Å; V442-V444 PolarHBondContact O-N 2.85Å; V442-N445 PolarHBondContact O-N 3.32Å; V442-N445 VanDerWaalsContact O-N 3.16Å; V442-N446 PolarHBondContact O-N 3.35Å
443	A	95.3	Very high	91.6	Very high	11 Å²	11	60.1 Å²	60.1	9%	0.091	33%	0.329	C	S	.	.	H	α-helix	trans	-58.8	-47.8	-179.8	0	0	0	0	0	111.9	M430 D434 K439 S440 N445 N446 C447	M430-A443 HydrophobicContact CE-CB 3.77Å; D434-A443 HydrophobicContact CB-CB 3.98Å; K439-A443 PolarHBondContact O-N 2.76Å; K439-A443 VanDerWaalsContact O-N 3.12Å; S440-A443 PolarHBondContact O-N 2.89Å; A443-N445 PolarHBondContact O-N 2.83Å; A443-N446 WeakPolarHBondContact O-CB 3.36Å; A443-N446 PolarHBondContact O-N 3.12Å; A443-N446 VanDerWaalsContact O-N 3.11Å; A443-C447 PolarHBondContact O-N 2.87Å; A443-C447 PolarHBondContact O-SG 2.9Å
444	V	95.5	Very high	90.3	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.006	32%	0.321	C	S	.	.	H	α-helix	trans	-63.1	-37.9	176.1	173.3	0	0	0	0	112.4	S440 V442 N446 C447 I448 V501 A513 V515	S440-V444 WeakPolarHBondContact O-CB 3.44Å; S440-V444 WeakPolarHBondContact O-CG2 3.22Å; S440-V444 PolarHBondContact O-N 2.83Å; V442-V444 PolarHBondContact O-N 2.85Å; V444-N446 VanDerWaalsContact C-N 3.33Å; V444-C447 PolarHBondContact O-N 2.83Å; V444-I448 HydrophobicContact CG1-CD1 4.15Å; V444-I448 VanDerWaalsContact O-CG1 3.31Å; V444-I448 WeakPolarHBondContact O-CG1 3.43Å; V444-I448 PolarHBondContact O-N 2.78Å; V444-V501 HydrophobicContact CG2-CG1 3.95Å; V444-A513 HydrophobicContact CG1-CB 3.84Å; V444-V515 HydrophobicContact CG2-CG2 3.63Å
445	N	94.1	Very high	88.4	Confident	22 Å²	22	64.1 Å²	64.1	12%	0.118	35%	0.348	C	S	.	.	H	α-helix	trans	-67.7	-33.4	174.4	-88.2	-90.8	0	0	0	112.2	S441 V442 A443 I448 R449 R506	S441-N445 PolarHBondContact O-N 3.03Å; S441-N445 PolarHBondContact O-ND2 2.82Å; V442-N445 PolarHBondContact O-N 3.32Å; V442-N445 VanDerWaalsContact O-N 3.16Å; A443-N445 PolarHBondContact O-N 2.83Å; N445-I448 PolarHBondContact O-N 2.96Å; N445-R449 WeakPolarHBondContact O-CB 3.26Å; N445-R449 VanDerWaalsContact O-CG 3.27Å; N445-R449 WeakPolarHBondContact O-CG 3.45Å; N445-R449 PolarHBondContact O-N 2.79Å; N445-R506 PolarHBondContact OD1-N 3.33Å
446	N	93.6	Very high	86.5	Confident	91 Å²	91	68 Å²	68	49%	0.487	37%	0.369	S	S	.	.	H	α-helix	trans	-65.1	-42.9	173.5	-70.1	-14.8	0	0	0	111.4	V442 A443 V444 I448 R449 Q450	V442-N446 PolarHBondContact O-N 3.35Å; A443-N446 WeakPolarHBondContact O-CB 3.36Å; A443-N446 PolarHBondContact O-N 3.12Å; A443-N446 VanDerWaalsContact O-N 3.11Å; V444-N446 VanDerWaalsContact C-N 3.33Å; N446-I448 PolarHBondContact O-N 3.13Å; N446-R449 PolarHBondContact O-N 3.28Å; N446-Q450 WeakPolarHBondContact O-CB 3.47Å; N446-Q450 PolarHBondContact O-N 2.86Å
447	C	93.4	Very high	84.3	Confident	8 Å²	8	71.2 Å²	71.2	5%	0.054	38%	0.381	C	S	.	.	H	α-helix	trans	-63.2	-40.7	174.6	-59	0	0	0	0	112.5	V428 M430 A443 V444 Q450 L451 C526	V428-C447 HydrophobicContact CB-CB 4.39Å; V428-C447 HydrophobicContact CG2-CB 4.11Å; M430-C447 PolarHBondContact SD-SG 2.99Å; A443-C447 PolarHBondContact O-N 2.87Å; A443-C447 PolarHBondContact O-SG 2.9Å; V444-C447 PolarHBondContact O-N 2.83Å; C447-Q450 PolarHBondContact O-N 3Å; C447-L451 PolarHBondContact O-N 2.67Å; C447-C526 HydrophobicContact CB-CB 4.22Å
448	I	93	Very high	82.4	Confident	5 Å²	5	72.3 Å²	72.3	3%	0.026	38%	0.378	C	S	.	.	H	α-helix	trans	-60.2	-46.3	173.7	-69	168.6	0	0	0	110.7	V444 N445 N446 S452 D511 A513 V528	V444-I448 HydrophobicContact CG1-CD1 4.15Å; V444-I448 VanDerWaalsContact O-CG1 3.31Å; V444-I448 WeakPolarHBondContact O-CG1 3.43Å; V444-I448 PolarHBondContact O-N 2.78Å; N445-I448 PolarHBondContact O-N 2.96Å; N446-I448 PolarHBondContact O-N 3.13Å; I448-S452 WeakPolarHBondContact O-CB 3.46Å; I448-S452 PolarHBondContact O-N 2.79Å; I448-S452 PolarHBondContact O-OG 3.22Å; I448-D511 HydrophobicContact CG2-CB 3.62Å; I448-A513 HydrophobicContact CD1-CB 3.76Å; I448-A513 HydrophobicContact CG1-CB 3.66Å; I448-V528 HydrophobicContact CB-CG1 4.49Å; I448-V528 HydrophobicContact CG1-CG1 4.1Å; I448-V528 HydrophobicContact CG1-CG2 4.25Å
449	R	91.3	Very high	80.4	Confident	126 Å²	126	78.1 Å²	78.1	48%	0.475	38%	0.38	S	S	.	.	H	α-helix	trans	-62.8	-45.8	177.7	-74.4	175	133.7	-139	-13	112	N445 N446 S452 Y453 D507	N445-R449 WeakPolarHBondContact O-CB 3.26Å; N445-R449 VanDerWaalsContact O-CG 3.27Å; N445-R449 WeakPolarHBondContact O-CG 3.45Å; N445-R449 PolarHBondContact O-N 2.79Å; N446-R449 PolarHBondContact O-N 3.28Å; R449-S452 PolarHBondContact O-N 3.43Å; R449-Y453 HydrophobicContact CB-CD2 4.28Å; R449-Y453 HydrophobicContact CB-CE2 4.43Å; R449-Y453 HydrophobicContact CG-CE2 4.32Å; R449-Y453 WeakPolarHBondContact O-CB 3.3Å; R449-Y453 WeakPolarHBondContact O-CD2 3.28Å; R449-Y453 PolarHBondContact O-N 3.22Å; R449-D507 IonicContact CZ-OD2 2.82Å; R449-D507 IonicContact NE-OD1 3.92Å; R449-D507 IonicContact NE-OD2 3.18Å; R449-D507 PolarHBondContact NE-OD2 3.16Å; R449-D507 IonicContact NH2-OD1 3.23Å; R449-D507 IonicContact NH2-OD2 3.11Å; R449-D507 PolarHBondContact NH2-OD2 2.72Å
450	Q	89.9	Confident	77.9	Confident	99 Å²	99	80.1 Å²	80.1	46%	0.463	40%	0.395	S	S	.	.	H	α-helix	trans	-54.6	-59.3	176.2	-176.8	177.3	-3.7	0	0	110.2	N446 C447 S452 Y453 C454	N446-Q450 WeakPolarHBondContact O-CB 3.47Å; N446-Q450 PolarHBondContact O-N 2.86Å; C447-Q450 PolarHBondContact O-N 3Å; Q450-S452 VanDerWaalsContact C-N 3.35Å; Q450-S452 PolarHBondContact O-N 3.33Å; Q450-Y453 PolarHBondContact O-N 3.46Å; Q450-C454 WeakPolarHBondContact O-CB 3.43Å; Q450-C454 PolarHBondContact O-N 3.38Å; Q450-C454 PolarHBondContact O-SG 3.21Å
451	L	88.1	Confident	75.3	Confident	25 Å²	25	83.3 Å²	83.3	13%	0.131	41%	0.414	C	S	.	.	H	α-helix	trans	-74.7	-19.8	-176.6	-62.9	-179.7	0	0	0	114.3	L425 V428 C447 V528	L425-L451 HydrophobicContact CB-CB 4.02Å; V428-L451 HydrophobicContact CG2-CD1 3.68Å; V428-L451 HydrophobicContact CG2-CD2 4.15Å; V428-L451 HydrophobicContact CG2-CG 3.8Å; C447-L451 PolarHBondContact O-N 2.67Å; L451-V528 HydrophobicContact CB-CB 4.35Å; L451-V528 HydrophobicContact CB-CG1 4.49Å; L451-V528 HydrophobicContact CD1-CB 3.87Å; L451-V528 HydrophobicContact CD1-CG2 3.75Å
452	S	84.9	Confident	72.7	Confident	22 Å²	22	88.3 Å²	88.3	15%	0.154	44%	0.442	C	S	.	.	H	α-helix	trans	-81.4	-27.8	175.7	-69.8	0	0	0	0	114.4	I448 R449 Q450 D511 R530	I448-S452 WeakPolarHBondContact O-CB 3.46Å; I448-S452 PolarHBondContact O-N 2.79Å; I448-S452 PolarHBondContact O-OG 3.22Å; R449-S452 PolarHBondContact O-N 3.43Å; Q450-S452 VanDerWaalsContact C-N 3.35Å; Q450-S452 PolarHBondContact O-N 3.33Å; S452-D511 PolarHBondContact OG-OD2 2.96Å; S452-R530 PolarHBondContact O-NH2 2.57Å; S452-R530 PolarHBondContact OG-NH2 2.95Å; S452-R530 VanDerWaalsContact OG-NH2 3.12Å
453	Y	76.6	Confident	70.6	Confident	159 Å²	159	87.3 Å²	87.3	62%	0.624	45%	0.448	S	S	*	.	H	α-helix	trans	-107.6	-24.5	-179	-62.9	-59.6	0	0	0	113.9	R449 Q450 K455	R449-Y453 HydrophobicContact CB-CD2 4.28Å; R449-Y453 HydrophobicContact CB-CE2 4.43Å; R449-Y453 HydrophobicContact CG-CE2 4.32Å; R449-Y453 WeakPolarHBondContact O-CB 3.3Å; R449-Y453 WeakPolarHBondContact O-CD2 3.28Å; R449-Y453 PolarHBondContact O-N 3.22Å; Q450-Y453 PolarHBondContact O-N 3.46Å; Y453-K455 PolarHBondContact O-N 2.68Å
454	C	65.8	Low	68.5	Low	60 Å²	60	88.7 Å²	88.7	41%	0.405	45%	0.453	S	S	.	.			trans	-71.2	99	171	-73.6	0	0	0	0	110.7	Q450 N456	Q450-C454 WeakPolarHBondContact O-CB 3.43Å; Q450-C454 PolarHBondContact O-N 3.38Å; Q450-C454 PolarHBondContact O-SG 3.21Å; C454-N456 VanDerWaalsContact C-N 3.27Å; C454-N456 PolarHBondContact O-N 2.81Å; C454-N456 VanDerWaalsContact O-N 3.08Å
455	K	55	Low	66.4	Low	212 Å²	212	96.8 Å²	96.8	92%	0.922	48%	0.484	S	S	*	.			trans	-80.9	76	166.8	-170.4	-177.8	-178.8	-178.4	0	109.3	Y453	Y453-K455 PolarHBondContact O-N 2.68Å
456	N	53.2	Low	64.5	Low	94 Å²	94	96.3 Å²	96.3	50%	0.503	48%	0.484	S	S	.	.			trans	-67.8	150.8	-177.8	-73.4	-11.4	0	0	0	111.9	C454	C454-N456 VanDerWaalsContact C-N 3.27Å; C454-N456 PolarHBondContact O-N 2.81Å; C454-N456 VanDerWaalsContact O-N 3.08Å
457	D	46.6	Very low	62.9	Low	100 Å²	100	96.1 Å²	96.1	54%	0.535	48%	0.48	S	S	.	.			trans	-85.5	132.3	175.8	-167.2	-6.8	0	0	0	108.9	R459	D457-R459 PolarHBondContact O-N 3.39Å; D457-R459 IonicContact OD1-CZ 3.72Å; D457-R459 IonicContact OD1-NH1 2.77Å; D457-R459 PolarHBondContact OD1-NH1 2.82Å; D457-R459 IonicContact OD1-NH2 2.87Å; D457-R459 IonicContact OD2-CZ 2.67Å; D457-R459 IonicContact OD2-NH1 2.79Å; D457-R459 PolarHBondContact OD2-NH1 2.84Å; D457-R459 IonicContact OD2-NH2 2.84Å; D457-R459 PolarHBondContact OD2-NH2 2.86Å
458	I	48.7	Very low	61.6	Low	154 Å²	154	97.9 Å²	97.9	79%	0.79	50%	0.499	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	12.1	-154.5	-64	157.8	0	0	0	114
459	R	47.1	Very low	60.7	Low	190 Å²	190	102.9 Å²	102.9	72%	0.717	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.8	-8.7	-164.6	-66.1	-165.5	-60.8	-70.5	-9.2	116.6	D457	D457-R459 PolarHBondContact O-N 3.39Å; D457-R459 IonicContact OD1-CZ 3.72Å; D457-R459 IonicContact OD1-NH1 2.77Å; D457-R459 PolarHBondContact OD1-NH1 2.82Å; D457-R459 IonicContact OD1-NH2 2.87Å; D457-R459 IonicContact OD2-CZ 2.67Å; D457-R459 IonicContact OD2-NH1 2.79Å; D457-R459 PolarHBondContact OD2-NH1 2.84Å; D457-R459 IonicContact OD2-NH2 2.84Å; D457-R459 PolarHBondContact OD2-NH2 2.86Å
460	D	40.7	Very low	60.5	Low	150 Å²	150	100.7 Å²	100.7	80%	0.802	52%	0.519	S	S	*	.	S	Bend	trans	-125.7	29.5	-161.7	-145.9	18.2	0	0	0	116.6
461	T	41.4	Very low	60.7	Low	89 Å²	89	96.4 Å²	96.4	55%	0.546	50%	0.499	S	S	.	.			trans	-149.2	95.5	157.8	-36.5	0	0	0	0	114	G463 I464	T461-G463 PolarHBondContact O-N 3.12Å; T461-I464 HydrophobicContact CG2-CD1 3.75Å; T461-I464 HydrophobicContact CG2-CG1 3.62Å
462	V	39.5	Very low	61	Low	158 Å²	158	99.5 Å²	99.5	96%	0.958	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	101.9	167.4	179	0	0	0	0	108.8
463	G	48.6	Very low	61.5	Low	58 Å²	58	98.4 Å²	98.4	60%	0.598	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	136.7	-10.6	175.9	0	0	0	0	0	115.9	T461 W465	T461-G463 PolarHBondContact O-N 3.12Å; G463-W465 PolarHBondContact O-N 3.36Å
464	I	50.6	Low	62.4	Low	40 Å²	40	92.6 Å²	92.6	21%	0.205	48%	0.481	C	S	.	.			trans	-74.6	120.5	174.7	-63.2	-179.5	0	0	0	109.9	T461 G466 E467	T461-I464 HydrophobicContact CG2-CD1 3.75Å; T461-I464 HydrophobicContact CG2-CG1 3.62Å; I464-G466 PolarHBondContact O-N 3.37Å; I464-G466 VanDerWaalsContact O-N 3.14Å; I464-E467 HydrophobicContact CG2-CB 4.27Å
465	W	53.3	Low	63.8	Low	171 Å²	171	89.8 Å²	89.8	65%	0.648	46%	0.462	S	S	*	.	S	Bend	trans	-74.4	104.1	173.4	-73	5.1	0	0	0	111.1	S424 G463 L491 H492	S424-W465 PolarHBondContact OG-O 2.81Å; G463-W465 PolarHBondContact O-N 3.36Å; W465-L491 WeakPolarHBondContact CH2-O 3.32Å; W465-L491 WeakPolarHBondContact CZ3-O 3.45Å; W465-H492 HydrophobicContact CE3-CB 4.02Å; W465-H492 AromaticContact CE3-ND1 3.91Å; W465-H492 HydrophobicContact CZ3-CB 3.75Å; W465-H492 AromaticContact CZ3-CG 3.99Å; W465-H492 AromaticContact CZ3-ND1 3.42Å; W465-H492 WeakPolarHBondContact CZ3-ND1 3.42Å
466	G	54	Low	65.6	Low	12 Å²	12	83.6 Å²	83.6	12%	0.124	44%	0.436	C	S	.	.			trans	80.4	29.9	157.6	0	0	0	0	0	116.7	S424 I464 G468 K469	S424-G466 WeakPolarHBondContact CB-O 3.37Å; S424-G466 PolarHBondContact OG-O 3.03Å; I464-G466 PolarHBondContact O-N 3.37Å; I464-G466 VanDerWaalsContact O-N 3.14Å; G466-G468 PolarHBondContact O-N 3Å; G466-K469 WeakPolarHBondContact O-CB 3.29Å; G466-K469 PolarHBondContact O-N 3.24Å
467	E	59.4	Low	67.2	Low	87 Å²	87	85.3 Å²	85.3	41%	0.407	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-50.6	119.7	165.2	-173.5	-175	174.7	0	0	109.6	I464 K469	I464-E467 HydrophobicContact CG2-CB 4.27Å; E467-K469 VanDerWaalsContact C-N 3.26Å; E467-K469 PolarHBondContact O-N 2.93Å
468	G	66.8	Low	69.4	Low	44 Å²	44	83.3 Å²	83.3	45%	0.454	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.5	-4.1	-176.9	0	0	0	0	0	116.3	S424 G466	S424-G468 PolarHBondContact O-N 3.22Å; G466-G468 PolarHBondContact O-N 3Å
469	K	73.6	Confident	71.6	Confident	111 Å²	111	78.7 Å²	78.7	48%	0.483	41%	0.41	S	S	.	.			trans	-79.1	134.4	175.3	-76.1	-164.7	173	-162.4	0	112	R423 S424 G466 E467	R423-K469 VanDerWaalsContact CA-O 3.29Å; R423-K469 WeakPolarHBondContact CA-O 3.41Å; S424-K469 PolarHBondContact N-O 3.47Å; S424-K469 VanDerWaalsContact N-O 3.12Å; G466-K469 WeakPolarHBondContact O-CB 3.29Å; G466-K469 PolarHBondContact O-N 3.24Å; E467-K469 VanDerWaalsContact C-N 3.26Å; E467-K469 PolarHBondContact O-N 2.93Å
470	D	86.9	Confident	73.9	Confident	80 Å²	80	69.6 Å²	69.6	43%	0.428	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.3	137.9	164.7	-64.2	-39	0	0	0	110.3	V422 R423 P485	V422-D470 CarbonylContact O-C 3.59Å; V422-D470 WeakPolarHBondContact O-CA 3.32Å; R423-D470 IonicContact CZ-OD1 2.95Å; R423-D470 IonicContact CZ-OD2 2.84Å; R423-D470 IonicContact NE-OD1 3.79Å; R423-D470 PolarHBondContact NE-OD1 3.4Å; R423-D470 IonicContact NE-OD2 2.6Å; R423-D470 IonicContact NH2-OD1 2.69Å; R423-D470 PolarHBondContact NH2-OD1 2.8Å; R423-D470 IonicContact NH2-OD2 2.7Å; R423-D470 PolarHBondContact NH2-OD2 2.73Å; D470-P485 VanDerWaalsContact O-CD 3.27Å; D470-P485 WeakPolarHBondContact O-CD 3.41Å; D470-P485 VanDerWaalsContact O-CG 3.3Å; D470-P485 WeakPolarHBondContact O-CG 3.28Å
471	M	93.3	Very high	76.5	Confident	9 Å²	9	63.6 Å²	63.6	4%	0.044	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.4	161.1	-176.3	-66.7	-178.2	-68.2	0	0	110.1	V422 L482 L491 F529	V422-M471 PolarHBondContact N-O 3.4Å; V422-M471 PolarHBondContact O-N 2.87Å; M471-L482 HydrophobicContact CE-CD1 4.33Å; M471-L482 HydrophobicContact SD-CB 4.41Å; M471-L491 HydrophobicContact CG-CD1 3.92Å; M471-L491 HydrophobicContact SD-CD1 3.52Å; M471-L491 VanDerWaalsContact SD-CD1 3.52Å; M471-F529 HydrophobicContact CE-CE1 4.26Å
472	Y	94.6	Very high	79	Confident	89 Å²	89	59.9 Å²	59.9	35%	0.349	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.7	128	164.7	-70.1	-67.2	0	0	0	110.3	C419 F420 A421 L482 V483 P485	C419-Y472 WeakPolarHBondContact SG-CD1 3.43Å; F420-Y472 WeakPolarHBondContact O-CA 3.47Å; A421-Y472 HydrophobicContact CB-CD1 4.41Å; A421-Y472 HydrophobicContact CB-CE1 4.17Å; Y472-L482 CarbonylContact O-C 3.49Å; Y472-L482 WeakPolarHBondContact O-CA 3.49Å; Y472-V483 PolarHBondContact N-O 3.44Å; Y472-V483 PolarHBondContact O-N 2.87Å; Y472-P485 HydrophobicContact CD2-CB 4.14Å; Y472-P485 HydrophobicContact CD2-CG 4.38Å; Y472-P485 HydrophobicContact CE2-CB 3.77Å; Y472-P485 HydrophobicContact CE2-CG 4.4Å
473	L	96.3	Very high	81.6	Confident	0 Å²	0	53 Å²	53	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	115.5	166	-174	161.5	0	0	0	107.5	F420 V422 L475 L480 S481 L482 F512 I538	F420-L473 HydrophobicContact CD2-CD2 4.17Å; F420-L473 PolarHBondContact N-O 2.89Å; F420-L473 PolarHBondContact O-N 3.41Å; V422-L473 HydrophobicContact CG1-CB 4.08Å; V422-L473 HydrophobicContact CG2-CB 3.84Å; L473-L475 HydrophobicContact CD2-CD2 3.76Å; L473-L475 HydrophobicContact CD2-CG 3.88Å; L473-L480 HydrophobicContact CD1-CD1 4.35Å; L473-L480 HydrophobicContact CD1-CD2 4.26Å; L473-L480 HydrophobicContact CD1-CG 4.45Å; L473-L480 HydrophobicContact CD2-CD1 4.41Å; L473-L480 HydrophobicContact CD2-CD2 4.49Å; L473-L480 HydrophobicContact CD2-CG 4.08Å; L473-L480 HydrophobicContact CG-CD2 4.01Å; L473-L480 HydrophobicContact CG-CG 4.14Å; L473-S481 WeakPolarHBondContact CA-O 3.36Å; L473-L482 HydrophobicContact CB-CD2 3.99Å; L473-L482 HydrophobicContact CD1-CD2 4.22Å; L473-L482 HydrophobicContact CG-CD2 4.01Å; L473-F512 HydrophobicContact CD1-CD1 4.21Å; L473-F512 HydrophobicContact CD1-CE1 4.18Å; L473-I538 HydrophobicContact CD1-CD1 4.43Å; L473-I538 HydrophobicContact CD1-CG2 4.4Å; L473-I538 HydrophobicContact CD2-CG2 3.97Å
474	I	95.4	Very high	83.7	Confident	37 Å²	37	51.4 Å²	51.4	19%	0.19	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	132.2	-179.4	-52.8	-174.7	0	0	0	108.9	K418 C419 E476 L480 S481 V483	K418-I474 CarbonylContact O-C 3.59Å; K418-I474 WeakPolarHBondContact O-CA 3.13Å; C419-I474 HydrophobicContact CB-CG1 4.31Å; I474-E476 HydrophobicContact CG2-CB 4.12Å; I474-L480 WeakPolarHBondContact O-CA 3.27Å; I474-S481 PolarHBondContact N-O 3.06Å; I474-S481 PolarHBondContact O-N 2.78Å; I474-V483 HydrophobicContact CD1-CB 4.31Å; I474-V483 HydrophobicContact CD1-CG2 3.85Å; I474-V483 HydrophobicContact CG1-CG2 4.33Å
475	L	95.8	Very high	85.5	Confident	0 Å²	0	51.5 Å²	51.5	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.1	111.6	171.7	-57.6	178.6	0	0	0	108.3	K418 F420 L473 L480 I496 I538 L542 I545	K418-L475 HydrophobicContact CB-CB 4.41Å; K418-L475 PolarHBondContact N-O 2.63Å; K418-L475 PolarHBondContact O-N 3.11Å; F420-L475 HydrophobicContact CE2-CD1 3.93Å; F420-L475 HydrophobicContact CE2-CG 4.29Å; L473-L475 HydrophobicContact CD2-CD2 3.76Å; L473-L475 HydrophobicContact CD2-CG 3.88Å; L475-L480 HydrophobicContact CD2-CB 3.86Å; L475-L480 HydrophobicContact CD2-CD1 4.08Å; L475-L480 HydrophobicContact CD2-CG 3.76Å; L475-I496 HydrophobicContact CD2-CD1 4.27Å; L475-I538 HydrophobicContact CD1-CG2 4.34Å; L475-L542 HydrophobicContact CD1-CD2 4.24Å; L475-L542 HydrophobicContact CD1-CG 3.86Å; L475-L542 HydrophobicContact CD2-CD2 3.65Å; L475-L542 HydrophobicContact CD2-CG 4.03Å; L475-I545 HydrophobicContact CB-CD1 3.7Å; L475-I545 HydrophobicContact CD1-CD1 4.36Å
476	E	92.3	Very high	87.1	Confident	83 Å²	83	49.6 Å²	49.6	39%	0.388	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	144.9	-172.3	-164	-167.2	147	0	0	109.2	A417 I474 D478 M479	A417-E476 HydrophobicContact CB-CB 4.38Å; A417-E476 HydrophobicContact CB-CG 3.8Å; I474-E476 HydrophobicContact CG2-CB 4.12Å; E476-D478 VanDerWaalsContact C-N 3.32Å; E476-D478 PolarHBondContact O-N 2.83Å; E476-M479 PolarHBondContact N-O 2.81Å; E476-M479 VanDerWaalsContact N-O 3.14Å; E476-M479 WeakPolarHBondContact O-CA 3.36Å; E476-M479 WeakPolarHBondContact O-CB 3.27Å; E476-M479 PolarHBondContact O-N 2.97Å; E476-M479 VanDerWaalsContact O-O 3.13Å
477	N	86.6	Confident	88.8	Confident	129 Å²	129	54.3 Å²	54.3	69%	0.69	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.7	45.7	172.3	-57.8	-41.9	0	0	0	114.6	M479	N477-M479 WeakPolarHBondContact O-CG 3.39Å; N477-M479 PolarHBondContact O-N 3.31Å; N477-M479 VanDerWaalsContact O-N 3.1Å
478	D	92	Very high	90.1	Very high	58 Å²	58	58.7 Å²	58.7	31%	0.31	30%	0.297	S	S	.	.	T	Hydrogen-bonded Turn	trans	57.6	15.5	-174.7	-66.3	-11.9	0	0	0	116.1	E476 I496 I549	E476-D478 VanDerWaalsContact C-N 3.32Å; E476-D478 PolarHBondContact O-N 2.83Å; D478-I496 VanDerWaalsContact O-CB 3.3Å; D478-I496 WeakPolarHBondContact O-CB 3.33Å; D478-I496 WeakPolarHBondContact O-CG1 3.42Å; D478-I496 PolarHBondContact O-N 3.19Å; D478-I549 HydrophobicContact CB-CD1 4.07Å; D478-I549 WeakPolarHBondContact OD1-CD1 3.36Å; D478-I549 VanDerWaalsContact OD1-CG1 3.32Å; D478-I549 WeakPolarHBondContact OD1-CG1 3.49Å; D478-I549 WeakPolarHBondContact OD2-CG1 3.08Å
479	M	94.8	Very high	91.2	Very high	57 Å²	57	58.8 Å²	58.8	28%	0.281	29%	0.291	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.9	145.2	179.4	-61.3	-65.6	-65.2	0	0	111.7	E476 N477 S493 P495	E476-M479 PolarHBondContact N-O 2.81Å; E476-M479 VanDerWaalsContact N-O 3.14Å; E476-M479 WeakPolarHBondContact O-CA 3.36Å; E476-M479 WeakPolarHBondContact O-CB 3.27Å; E476-M479 PolarHBondContact O-N 2.97Å; E476-M479 VanDerWaalsContact O-O 3.13Å; N477-M479 WeakPolarHBondContact O-CG 3.39Å; N477-M479 PolarHBondContact O-N 3.31Å; N477-M479 VanDerWaalsContact O-N 3.1Å; M479-S493 WeakPolarHBondContact CE-OG 3.49Å; M479-P495 HydrophobicContact CE-CB 4.46Å; M479-P495 HydrophobicContact CE-CG 3.87Å; M479-P495 VanDerWaalsContact SD-CA 3.52Å; M479-P495 HydrophobicContact SD-CB 3.84Å; M479-P495 HydrophobicContact SD-CG 3.78Å
480	L	96.4	Very high	92.1	Very high	0 Å²	0	58 Å²	58	0%	0	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	110.1	163.1	-176.1	166.5	0	0	0	107.4	L473 I474 L475 L482 Q494 I496 I499 Y514 L542	L473-L480 HydrophobicContact CD1-CD1 4.35Å; L473-L480 HydrophobicContact CD1-CD2 4.26Å; L473-L480 HydrophobicContact CD1-CG 4.45Å; L473-L480 HydrophobicContact CD2-CD1 4.41Å; L473-L480 HydrophobicContact CD2-CD2 4.49Å; L473-L480 HydrophobicContact CD2-CG 4.08Å; L473-L480 HydrophobicContact CG-CD2 4.01Å; L473-L480 HydrophobicContact CG-CG 4.14Å; I474-L480 WeakPolarHBondContact O-CA 3.27Å; L475-L480 HydrophobicContact CD2-CB 3.86Å; L475-L480 HydrophobicContact CD2-CD1 4.08Å; L475-L480 HydrophobicContact CD2-CG 3.76Å; L480-L482 HydrophobicContact CD2-CD2 4.15Å; L480-L482 HydrophobicContact CD2-CG 4.39Å; L480-Q494 HydrophobicContact CB-CB 4.48Å; L480-Q494 PolarHBondContact N-O 2.86Å; L480-Q494 PolarHBondContact O-N 2.82Å; L480-I496 HydrophobicContact CB-CG1 4.24Å; L480-I499 HydrophobicContact CB-CD1 4.35Å; L480-I499 HydrophobicContact CD1-CD1 3.84Å; L480-Y514 HydrophobicContact CD1-CD1 3.89Å; L480-Y514 HydrophobicContact CD1-CE1 3.97Å; L480-Y514 HydrophobicContact CD1-CG 4.49Å; L480-Y514 HydrophobicContact CD2-CE1 3.97Å; L480-L542 HydrophobicContact CD1-CD1 4.4Å; L480-L542 HydrophobicContact CD1-CD2 4.47Å
481	S	95.4	Very high	92.2	Very high	23 Å²	23	56.7 Å²	56.7	16%	0.161	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	137.5	178.8	-67.1	0	0	0	0	111	L473 I474 H492 S493	L473-S481 WeakPolarHBondContact CA-O 3.36Å; I474-S481 PolarHBondContact N-O 3.06Å; I474-S481 PolarHBondContact O-N 2.78Å; S481-H492 CarbonylContact C-O 3.59Å; S481-H492 WeakPolarHBondContact CA-O 3.4Å; S481-S493 PolarHBondContact OG-OG 3.34Å
482	L	94.3	Very high	92	Very high	11 Å²	11	58.3 Å²	58.3	6%	0.058	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	127.2	168	-58.3	178.7	0	0	0	108.3	M471 Y472 L473 L480 L491 H492 F529	M471-L482 HydrophobicContact CE-CD1 4.33Å; M471-L482 HydrophobicContact SD-CB 4.41Å; Y472-L482 CarbonylContact O-C 3.49Å; Y472-L482 WeakPolarHBondContact O-CA 3.49Å; L473-L482 HydrophobicContact CB-CD2 3.99Å; L473-L482 HydrophobicContact CD1-CD2 4.22Å; L473-L482 HydrophobicContact CG-CD2 4.01Å; L480-L482 HydrophobicContact CD2-CD2 4.15Å; L480-L482 HydrophobicContact CD2-CG 4.39Å; L482-L491 PolarHBondContact O-N 3.02Å; L482-H492 HydrophobicContact CB-CB 4.05Å; L482-H492 HydrophobicContact CD1-CB 4.05Å; L482-H492 HydrophobicContact CG-CB 4.22Å; L482-H492 PolarHBondContact N-O 2.95Å; L482-H492 PolarHBondContact O-N 3.39Å; L482-F529 HydrophobicContact CD1-CE1 3.7Å; L482-F529 HydrophobicContact CD1-CZ 3.84Å; L482-F529 HydrophobicContact CD2-CE1 3.93Å; L482-F529 HydrophobicContact CD2-CZ 4.25Å
483	V	94.4	Very high	92	Very high	13 Å²	13	55.9 Å²	55.9	8%	0.079	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.9	136.5	-171.1	176	0	0	0	0	109.9	Y472 I474 R488 S489 V490	Y472-V483 PolarHBondContact N-O 3.44Å; Y472-V483 PolarHBondContact O-N 2.87Å; I474-V483 HydrophobicContact CD1-CB 4.31Å; I474-V483 HydrophobicContact CD1-CG2 3.85Å; I474-V483 HydrophobicContact CG1-CG2 4.33Å; V483-R488 HydrophobicContact CG1-CB 4.27Å; V483-S489 VanDerWaalsContact CA-O 3.3Å; V483-S489 WeakPolarHBondContact CA-O 3.16Å; V483-V490 HydrophobicContact CG2-CG2 4.25Å
484	D	90.7	Very high	91.9	Very high	26 Å²	26	56.4 Å²	56.4	14%	0.139	29%	0.294	C	S	.	.			trans	-69.9	135.2	177.2	-166.1	-74.1	0	0	0	110.9	M486 D487 R488 S489 L491	D484-M486 VanDerWaalsContact C-N 3.26Å; D484-M486 PolarHBondContact O-N 3.38Å; D484-M486 WeakPolarHBondContact OD1-CB 3.41Å; D484-M486 PolarHBondContact OD1-N 3.14Å; D484-D487 WeakPolarHBondContact CB-OD1 3.36Å; D484-R488 WeakPolarHBondContact O-CA 3.5Å; D484-R488 PolarHBondContact O-N 3.32Å; D484-S489 PolarHBondContact N-O 2.92Å; D484-L491 HydrophobicContact CB-CD1 3.92Å; D484-L491 HydrophobicContact CB-CD2 4.24Å; D484-L491 HydrophobicContact CB-CG 4.09Å
485	P	88.5	Confident	91.9	Very high	42 Å²	42	56.2 Å²	56.2	27%	0.273	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-19.8	-177.2	-19.8	34.4	0	0	0	114.6	D470 Y472	D470-P485 VanDerWaalsContact O-CD 3.27Å; D470-P485 WeakPolarHBondContact O-CD 3.41Å; D470-P485 VanDerWaalsContact O-CG 3.3Å; D470-P485 WeakPolarHBondContact O-CG 3.28Å; Y472-P485 HydrophobicContact CD2-CB 4.14Å; Y472-P485 HydrophobicContact CD2-CG 4.38Å; Y472-P485 HydrophobicContact CE2-CB 3.77Å; Y472-P485 HydrophobicContact CE2-CG 4.4Å
486	M	87.1	Confident	91.9	Very high	130 Å²	130	56.3 Å²	56.3	64%	0.64	30%	0.295	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	-49.4	-171.5	-64.2	-62.7	-55.9	0	0	112.8	D484	D484-M486 VanDerWaalsContact C-N 3.26Å; D484-M486 PolarHBondContact O-N 3.38Å; D484-M486 WeakPolarHBondContact OD1-CB 3.41Å; D484-M486 PolarHBondContact OD1-N 3.14Å
487	D	89.4	Confident	91.9	Very high	111 Å²	111	55 Å²	55	59%	0.594	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.5	-4.1	-176.1	70.3	7.4	0	0	0	114.2	D484 S489	D484-D487 WeakPolarHBondContact CB-OD1 3.36Å; D487-S489 PolarHBondContact O-N 3.11Å; D487-S489 WeakPolarHBondContact OD1-CB 3.46Å; D487-S489 PolarHBondContact OD1-N 3.08Å; D487-S489 PolarHBondContact OD1-OG 2.88Å; D487-S489 PolarHBondContact OD2-OG 3.12Å
488	R	86.6	Confident	92.3	Very high	179 Å²	179	51.3 Å²	51.3	68%	0.675	28%	0.277	S	S	*	.			trans	59.8	20.4	-175.7	-57.6	176.5	174.4	-104.3	1.9	114.4	V483 D484	V483-R488 HydrophobicContact CG1-CB 4.27Å; D484-R488 WeakPolarHBondContact O-CA 3.5Å; D484-R488 PolarHBondContact O-N 3.32Å
489	S	91.2	Very high	92.5	Very high	46 Å²	46	49.3 Å²	49.3	32%	0.322	27%	0.266	S	S	.	.			trans	-64.6	139	171.9	61	0	0	0	0	111.2	V483 D484 D487 L491	V483-S489 VanDerWaalsContact CA-O 3.3Å; V483-S489 WeakPolarHBondContact CA-O 3.16Å; D484-S489 PolarHBondContact N-O 2.92Å; D487-S489 PolarHBondContact O-N 3.11Å; D487-S489 WeakPolarHBondContact OD1-CB 3.46Å; D487-S489 PolarHBondContact OD1-N 3.08Å; D487-S489 PolarHBondContact OD1-OG 2.88Å; D487-S489 PolarHBondContact OD2-OG 3.12Å; S489-L491 PolarHBondContact O-N 3.39Å
490	V	91.3	Very high	92.5	Very high	94 Å²	94	51.8 Å²	51.8	57%	0.57	27%	0.272	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77	102.7	172.6	-178.9	0	0	0	0	108.1	V483 H492	V483-V490 HydrophobicContact CG2-CG2 4.25Å; V490-H492 WeakPolarHBondContact CG1-O 3.38Å
491	L	89.8	Confident	92.5	Very high	53 Å²	53	52.9 Å²	52.9	28%	0.277	28%	0.279	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	-46.8	177.9	-62	173.9	0	0	0	110.6	W465 M471 L482 D484 S489	W465-L491 WeakPolarHBondContact CH2-O 3.32Å; W465-L491 WeakPolarHBondContact CZ3-O 3.45Å; M471-L491 HydrophobicContact CG-CD1 3.92Å; M471-L491 HydrophobicContact SD-CD1 3.52Å; M471-L491 VanDerWaalsContact SD-CD1 3.52Å; L482-L491 PolarHBondContact O-N 3.02Å; D484-L491 HydrophobicContact CB-CD1 3.92Å; D484-L491 HydrophobicContact CB-CD2 4.24Å; D484-L491 HydrophobicContact CB-CG 4.09Å; S489-L491 PolarHBondContact O-N 3.39Å
492	H	90.1	Very high	92.5	Very high	44 Å²	44	55.5 Å²	55.5	20%	0.204	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.3	151.1	-179.8	-169.6	81.6	0	0	0	110.8	W465 S481 L482 V490	W465-H492 HydrophobicContact CE3-CB 4.02Å; W465-H492 AromaticContact CE3-ND1 3.91Å; W465-H492 HydrophobicContact CZ3-CB 3.75Å; W465-H492 AromaticContact CZ3-CG 3.99Å; W465-H492 AromaticContact CZ3-ND1 3.42Å; W465-H492 WeakPolarHBondContact CZ3-ND1 3.42Å; S481-H492 CarbonylContact C-O 3.59Å; S481-H492 WeakPolarHBondContact CA-O 3.4Å; L482-H492 HydrophobicContact CB-CB 4.05Å; L482-H492 HydrophobicContact CD1-CB 4.05Å; L482-H492 HydrophobicContact CG-CB 4.22Å; L482-H492 PolarHBondContact N-O 2.95Å; L482-H492 PolarHBondContact O-N 3.39Å; V490-H492 WeakPolarHBondContact CG1-O 3.38Å
493	S	93.5	Very high	92.6	Very high	37 Å²	37	55.6 Å²	55.6	26%	0.259	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.5	123.7	170.9	-161.1	0	0	0	0	112.2	M479 S481	M479-S493 WeakPolarHBondContact CE-OG 3.49Å; S481-S493 PolarHBondContact OG-OG 3.34Å
494	Q	95.1	Very high	92.6	Very high	12 Å²	12	56.9 Å²	56.9	6%	0.056	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	115.8	-168.7	169.6	55.9	56.2	0	0	109.5	L480 I496 I499 Y514 A516	L480-Q494 HydrophobicContact CB-CB 4.48Å; L480-Q494 PolarHBondContact N-O 2.86Å; L480-Q494 PolarHBondContact O-N 2.82Å; Q494-I496 PolarHBondContact O-N 3Å; Q494-I499 HydrophobicContact CG-CD1 4.2Å; Q494-I499 HydrophobicContact CG-CG1 3.8Å; Q494-Y514 HydrophobicContact CG-CE2 3.94Å; Q494-A516 HydrophobicContact CG-CB 4.3Å; Q494-A516 VanDerWaalsContact OE1-CB 3.31Å
495	P	95	Very high	92.6	Very high	32 Å²	32	55.8 Å²	55.8	21%	0.208	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.5	128.9	174.6	-21.8	31.6	0	0	0	111.3	M479 V497 S498 I499	M479-P495 HydrophobicContact CE-CB 4.46Å; M479-P495 HydrophobicContact CE-CG 3.87Å; M479-P495 VanDerWaalsContact SD-CA 3.52Å; M479-P495 HydrophobicContact SD-CB 3.84Å; M479-P495 HydrophobicContact SD-CG 3.78Å; P495-V497 HydrophobicContact CB-CG2 3.82Å; P495-V497 PolarHBondContact O-N 2.85Å; P495-S498 PolarHBondContact O-N 2.83Å; P495-I499 PolarHBondContact O-N 2.85Å
496	I	95.3	Very high	92.5	Very high	3 Å²	3	62.8 Å²	62.8	2%	0.015	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-61.7	-35.9	-178.9	-68	170.8	0	0	0	110	L475 D478 L480 Q494 S498 I499 L542 I545 C546 I549	L475-I496 HydrophobicContact CD2-CD1 4.27Å; D478-I496 VanDerWaalsContact O-CB 3.3Å; D478-I496 WeakPolarHBondContact O-CB 3.33Å; D478-I496 WeakPolarHBondContact O-CG1 3.42Å; D478-I496 PolarHBondContact O-N 3.19Å; L480-I496 HydrophobicContact CB-CG1 4.24Å; Q494-I496 PolarHBondContact O-N 3Å; I496-S498 PolarHBondContact O-N 2.93Å; I496-S498 VanDerWaalsContact O-N 3.08Å; I496-I499 HydrophobicContact CG1-CD1 4.46Å; I496-I499 WeakPolarHBondContact O-CB 3.37Å; I496-I499 PolarHBondContact O-N 2.69Å; I496-L542 HydrophobicContact CD1-CD2 3.86Å; I496-L542 HydrophobicContact CG1-CD2 3.82Å; I496-L542 HydrophobicContact CG2-CD2 3.97Å; I496-I545 HydrophobicContact CD1-CB 4.38Å; I496-I545 HydrophobicContact CD1-CD1 4.12Å; I496-I545 HydrophobicContact CD1-CG2 3.74Å; I496-I545 HydrophobicContact CG2-CG2 4.46Å; I496-C546 WeakPolarHBondContact CG2-SG 3.48Å; I496-I549 HydrophobicContact CG2-CD1 4.3Å
497	V	93.4	Very high	92	Very high	56 Å²	56	60.7 Å²	60.7	34%	0.339	30%	0.304	S	S	.	.	G	3₁₀ helix	trans	-60.1	-15.1	173.5	-59.9	0	0	0	0	115.2	P495 I549	P495-V497 HydrophobicContact CB-CG2 3.82Å; P495-V497 PolarHBondContact O-N 2.85Å; V497-I549 HydrophobicContact CG1-CD1 3.95Å; V497-I549 HydrophobicContact CG1-CG2 4Å
498	S	94.4	Very high	91.3	Very high	50 Å²	50	59.3 Å²	59.3	35%	0.35	30%	0.297	S	S	.	.	G	3₁₀ helix	trans	-110.5	0.4	179.4	-62.3	0	0	0	0	112.9	P495 I496	P495-S498 PolarHBondContact O-N 2.83Å; I496-S498 PolarHBondContact O-N 2.93Å; I496-S498 VanDerWaalsContact O-N 3.08Å
499	I	95.8	Very high	91.2	Very high	16 Å²	16	52.2 Å²	52.2	8%	0.082	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	127.2	166.5	-60	175.7	0	0	0	107.6	L480 Q494 P495 I496 W502 Y514 L542	L480-I499 HydrophobicContact CB-CD1 4.35Å; L480-I499 HydrophobicContact CD1-CD1 3.84Å; Q494-I499 HydrophobicContact CG-CD1 4.2Å; Q494-I499 HydrophobicContact CG-CG1 3.8Å; P495-I499 PolarHBondContact O-N 2.85Å; I496-I499 HydrophobicContact CG1-CD1 4.46Å; I496-I499 WeakPolarHBondContact O-CB 3.37Å; I496-I499 PolarHBondContact O-N 2.69Å; I499-W502 HydrophobicContact CG2-CE3 4.1Å; I499-Y514 HydrophobicContact CD1-CD2 4.44Å; I499-Y514 HydrophobicContact CD1-CG 4.49Å; I499-Y514 HydrophobicContact CG1-CD2 4.3Å; I499-Y514 HydrophobicContact CG2-CD2 4.5Å; I499-L542 HydrophobicContact CD1-CD2 4.27Å
500	R	94.5	Very high	91.3	Very high	109 Å²	109	55.2 Å²	55.2	41%	0.411	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	-39.2	-175.7	-61.9	-167.9	66.2	-174.6	1.8	113.2	E432 V515	E432-R500 IonicContact OE1-CZ 2.79Å; E432-R500 IonicContact OE1-NH1 3.74Å; E432-R500 PolarHBondContact OE1-NH1 3.03Å; E432-R500 IonicContact OE1-NH2 2.78Å; E432-R500 PolarHBondContact OE1-NH2 3.43Å; E432-R500 IonicContact OE2-CZ 3.98Å; E432-R500 IonicContact OE2-NH1 3.31Å; E432-R500 PolarHBondContact OE2-NH1 3.13Å; R500-V515 PolarHBondContact N-O 3.3Å
501	V	96.2	Very high	91.4	Very high	24 Å²	24	51 Å²	51	15%	0.145	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	142.6	-177	-173.5	0	0	0	0	107.2	L435 V444 Y514 V515	L435-V501 HydrophobicContact CD2-CG2 4.16Å; V444-V501 HydrophobicContact CG2-CG1 3.95Å; V501-Y514 CarbonylContact O-C 3.54Å; V501-Y514 WeakPolarHBondContact O-CA 3.38Å; V501-V515 HydrophobicContact CB-CB 4.41Å; V501-V515 HydrophobicContact CB-CG2 4.26Å; V501-V515 PolarHBondContact O-N 2.89Å
502	W	96.4	Very high	91.7	Very high	77 Å²	77	48.4 Å²	48.4	29%	0.292	25%	0.245	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	161.5	162.2	64.4	90.5	0	0	0	110.4	I499 F512 A513 A539 L542 H543 C546	I499-W502 HydrophobicContact CG2-CE3 4.1Å; W502-F512 HydrophobicContact CB-CE2 3.97Å; W502-F512 HydrophobicContact CB-CZ 4Å; W502-F512 HydrophobicContact CG-CE2 4.35Å; W502-A513 CarbonylContact C-O 3.49Å; W502-A513 WeakPolarHBondContact CA-O 3.02Å; W502-A513 WeakPolarHBondContact CB-O 3.27Å; W502-A539 PolarHBondContact NE1-O 2.76Å; W502-L542 HydrophobicContact CD2-CB 4.46Å; W502-L542 HydrophobicContact CG-CD1 4.35Å; W502-L542 HydrophobicContact CZ2-CB 4.33Å; W502-H543 HydrophobicContact CZ2-CB 4.07Å; W502-C546 HydrophobicContact CH2-CB 4.09Å; W502-C546 VanDerWaalsContact CH2-SG 3.52Å
503	G	95.2	Very high	92	Very high	13 Å²	13	46.3 Å²	46.3	13%	0.134	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	163.6	-175.1	0	0	0	0	0	112.9	F512 A513	G503-F512 WeakPolarHBondContact O-CD2 3.38Å; G503-A513 PolarHBondContact N-O 2.6Å; G503-A513 PolarHBondContact O-N 2.86Å
504	V	95.8	Very high	92.2	Very high	41 Å²	41	44.6 Å²	44.6	25%	0.248	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	133.3	172.8	175.2	0	0	0	0	107.5	R506 D511 F512 A535 A539	V504-R506 PolarHBondContact O-N 3.01Å; V504-D511 WeakPolarHBondContact CA-O 3.38Å; V504-F512 HydrophobicContact CG2-CD2 4.48Å; V504-A535 HydrophobicContact CB-CB 4.49Å; V504-A535 HydrophobicContact CG1-CB 3.84Å; V504-A535 HydrophobicContact CG2-CB 4.07Å; V504-A539 HydrophobicContact CG2-CB 3.7Å
505	G	91.1	Very high	92.3	Very high	3 Å²	3	44 Å²	44	3%	0.031	22%	0.22	C	C	.	.			trans	-66.2	117.5	-178.4	0	0	0	0	0	111.5	D507 G509 D511	G505-D507 VanDerWaalsContact C-N 3.25Å; G505-D507 PolarHBondContact O-N 3.14Å; G505-G509 WeakPolarHBondContact O-CA 3.43Å; G505-G509 PolarHBondContact O-N 3.33Å; G505-D511 PolarHBondContact N-O 3.1Å
506	R	84.6	Confident	92.4	Very high	188 Å²	188	42.6 Å²	42.6	71%	0.709	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-59.2	-35.1	-178	-66.9	177.9	-174	-176.5	3	113.3	N445 V504 N508	N445-R506 PolarHBondContact OD1-N 3.33Å; V504-R506 PolarHBondContact O-N 3.01Å; R506-N508 PolarHBondContact O-N 3.13Å
507	D	77.1	Confident	92.4	Very high	86 Å²	86	47 Å²	47	46%	0.46	23%	0.227	S	C	.	.	T	Hydrogen-bonded Turn	trans	-74.5	-24.8	-170	-60.5	-4.7	0	0	0	113.7	R449 G505	R449-D507 IonicContact CZ-OD2 2.82Å; R449-D507 IonicContact NE-OD1 3.92Å; R449-D507 IonicContact NE-OD2 3.18Å; R449-D507 PolarHBondContact NE-OD2 3.16Å; R449-D507 IonicContact NH2-OD1 3.23Å; R449-D507 IonicContact NH2-OD2 3.11Å; R449-D507 PolarHBondContact NH2-OD2 2.72Å; G505-D507 VanDerWaalsContact C-N 3.25Å; G505-D507 PolarHBondContact O-N 3.14Å
508	N	74.7	Confident	92.2	Very high	82 Å²	82	46 Å²	46	44%	0.439	22%	0.22	S	C	.	.	T	Hydrogen-bonded Turn	trans	-136.1	-18.1	-170.4	-171.3	28.5	0	0	0	113.7	R506 R510 D511	R506-N508 PolarHBondContact O-N 3.13Å; N508-R510 PolarHBondContact O-N 3.05Å; N508-D511 PolarHBondContact ND2-OD2 3.13Å
509	G	85.6	Confident	91.6	Very high	31 Å²	31	50.5 Å²	50.5	32%	0.32	23%	0.233	S	C	.	.	S	Bend	trans	64.4	-5.3	178.3	0	0	0	0	0	116.5	G505 A535	G505-G509 WeakPolarHBondContact O-CA 3.43Å; G505-G509 PolarHBondContact O-N 3.33Å; G509-A535 PolarHBondContact O-N 2.98Å
510	R	91.8	Very high	91.1	Very high	109 Å²	109	56.8 Å²	56.8	41%	0.411	27%	0.267	S	S	.	.			trans	-103.3	-17.9	-179	-71.3	-179.4	163.1	-76.4	-0.6	114	N508 C531 D532	N508-R510 PolarHBondContact O-N 3.05Å; R510-C531 PolarHBondContact NH1-O 3.28Å; R510-C531 VanDerWaalsContact O-CB 3.27Å; R510-C531 WeakPolarHBondContact O-CB 3.32Å; R510-C531 PolarHBondContact O-N 2.86Å; R510-D532 PolarHBondContact NH1-O 3.02Å
511	D	94.4	Very high	90.8	Very high	4 Å²	4	55 Å²	55	2%	0.021	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.9	120.2	-179.7	-53.8	-63.4	0	0	0	109.3	I448 S452 V504 G505 N508 F529 R530	I448-D511 HydrophobicContact CG2-CB 3.62Å; S452-D511 PolarHBondContact OG-OD2 2.96Å; V504-D511 WeakPolarHBondContact CA-O 3.38Å; G505-D511 PolarHBondContact N-O 3.1Å; N508-D511 PolarHBondContact ND2-OD2 3.13Å; D511-F529 CarbonylContact C-O 3.57Å; D511-F529 WeakPolarHBondContact CA-O 3.49Å; D511-R530 WeakPolarHBondContact OD1-CG 3.46Å; D511-R530 IonicContact OD1-CZ 3.46Å; D511-R530 IonicContact OD1-NE 2.63Å; D511-R530 PolarHBondContact OD1-NE 3.02Å; D511-R530 IonicContact OD1-NH2 3.51Å; D511-R530 PolarHBondContact OD1-NH2 3.47Å; D511-R530 IonicContact OD2-NH2 3.96Å
512	F	96.3	Very high	90.4	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	147.6	176.2	176.1	-110.9	0	0	0	109.9	L473 W502 G503 V504 Y514 F529 C531 A535 I538 A539 L542	L473-F512 HydrophobicContact CD1-CD1 4.21Å; L473-F512 HydrophobicContact CD1-CE1 4.18Å; W502-F512 HydrophobicContact CB-CE2 3.97Å; W502-F512 HydrophobicContact CB-CZ 4Å; W502-F512 HydrophobicContact CG-CE2 4.35Å; G503-F512 WeakPolarHBondContact O-CD2 3.38Å; V504-F512 HydrophobicContact CG2-CD2 4.48Å; F512-Y514 HydrophobicContact CE1-CD1 4.06Å; F512-F529 HydrophobicContact CD1-CD2 4.18Å; F512-F529 PolarHBondContact N-O 3.45Å; F512-F529 PolarHBondContact O-N 3.35Å; F512-C531 VanDerWaalsContact CB-SG 3.6Å; F512-A535 HydrophobicContact CB-CB 3.74Å; F512-I538 HydrophobicContact CD1-CD1 4.49Å; F512-I538 HydrophobicContact CD1-CG2 4.11Å; F512-I538 HydrophobicContact CD2-CB 4.26Å; F512-I538 HydrophobicContact CD2-CG2 4.28Å; F512-I538 HydrophobicContact CE1-CG2 3.95Å; F512-I538 HydrophobicContact CE2-CB 4.47Å; F512-I538 HydrophobicContact CE2-CG2 4.14Å; F512-I538 HydrophobicContact CG-CB 4.39Å; F512-I538 HydrophobicContact CG-CD1 4.46Å; F512-I538 HydrophobicContact CG-CG2 4.3Å; F512-I538 HydrophobicContact CZ-CG2 3.99Å; F512-A539 HydrophobicContact CE2-CB 4.34Å; F512-L542 HydrophobicContact CE1-CD1 4.26Å; F512-L542 HydrophobicContact CE2-CD1 4.01Å; F512-L542 HydrophobicContact CZ-CD1 3.38Å
513	A	96.7	Very high	90.2	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	149.6	171.4	0	0	0	0	0	112.5	V444 I448 W502 G503 H527 V528	V444-A513 HydrophobicContact CG1-CB 3.84Å; I448-A513 HydrophobicContact CD1-CB 3.76Å; I448-A513 HydrophobicContact CG1-CB 3.66Å; W502-A513 CarbonylContact C-O 3.49Å; W502-A513 WeakPolarHBondContact CA-O 3.02Å; W502-A513 WeakPolarHBondContact CB-O 3.27Å; G503-A513 PolarHBondContact N-O 2.6Å; G503-A513 PolarHBondContact O-N 2.86Å; A513-H527 WeakPolarHBondContact CA-O 3.23Å; A513-H527 WeakPolarHBondContact CB-O 3.26Å; A513-V528 HydrophobicContact CB-CG2 3.96Å
514	Y	97.4	Very high	90.2	Very high	0 Å²	0	60.9 Å²	60.9	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	150.1	167.8	75.9	-99.8	0	0	0	111.3	L480 Q494 I499 V501 F512 A516 C526 H527 F529	L480-Y514 HydrophobicContact CD1-CD1 3.89Å; L480-Y514 HydrophobicContact CD1-CE1 3.97Å; L480-Y514 HydrophobicContact CD1-CG 4.49Å; L480-Y514 HydrophobicContact CD2-CE1 3.97Å; Q494-Y514 HydrophobicContact CG-CE2 3.94Å; I499-Y514 HydrophobicContact CD1-CD2 4.44Å; I499-Y514 HydrophobicContact CD1-CG 4.49Å; I499-Y514 HydrophobicContact CG1-CD2 4.3Å; I499-Y514 HydrophobicContact CG2-CD2 4.5Å; V501-Y514 CarbonylContact O-C 3.54Å; V501-Y514 WeakPolarHBondContact O-CA 3.38Å; F512-Y514 HydrophobicContact CE1-CD1 4.06Å; Y514-A516 HydrophobicContact CD2-CB 4.15Å; Y514-A516 HydrophobicContact CE2-CB 4Å; Y514-C526 CarbonylContact O-C 3.6Å; Y514-C526 WeakPolarHBondContact O-CA 3.4Å; Y514-H527 HydrophobicContact CD1-CB 4.38Å; Y514-H527 HydrophobicContact CE1-CB 4.04Å; Y514-H527 HydrophobicContact CE2-CB 4.33Å; Y514-H527 AromaticContact CE2-CD2 3.72Å; Y514-H527 AromaticContact CZ-CD2 3.95Å; Y514-H527 PolarHBondContact N-O 2.84Å; Y514-H527 PolarHBondContact O-N 2.82Å; Y514-F529 AromaticContact CD1-CE2 3.73Å; Y514-F529 HydrophobicContact CD1-CE2 3.73Å; Y514-F529 AromaticContact CE1-CE2 3.45Å; Y514-F529 HydrophobicContact CE1-CE2 3.45Å; Y514-F529 VanDerWaalsContact CE1-CE2 3.45Å; Y514-F529 AromaticContact CE1-CZ 3.8Å; Y514-F529 HydrophobicContact CE1-CZ 3.8Å
515	V	97.3	Very high	90.2	Very high	0 Å²	0	60.1 Å²	60.1	0%	0	28%	0.281	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	120.9	175.8	-166.1	0	0	0	0	109.6	M430 L435 V444 R500 V501 L524 K525 C526	M430-V515 HydrophobicContact CB-CG1 4.46Å; M430-V515 HydrophobicContact CG-CG1 4.01Å; L435-V515 HydrophobicContact CD1-CG1 3.75Å; L435-V515 HydrophobicContact CD2-CB 4.38Å; L435-V515 HydrophobicContact CD2-CG1 4.05Å; L435-V515 HydrophobicContact CD2-CG2 4.16Å; V444-V515 HydrophobicContact CG2-CG2 3.63Å; R500-V515 PolarHBondContact N-O 3.3Å; V501-V515 HydrophobicContact CB-CB 4.41Å; V501-V515 HydrophobicContact CB-CG2 4.26Å; V501-V515 PolarHBondContact O-N 2.89Å; V515-L524 HydrophobicContact CG1-CB 4.43Å; V515-K525 WeakPolarHBondContact CA-O 3.49Å; V515-C526 HydrophobicContact CG2-CB 3.93Å
516	A	96.7	Very high	90.4	Very high	2 Å²	2	60 Å²	60	2%	0.017	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	162.2	174.7	0	0	0	0	0	110.3	Q494 Y514 L524 K525	Q494-A516 HydrophobicContact CG-CB 4.3Å; Q494-A516 VanDerWaalsContact OE1-CB 3.31Å; Y514-A516 HydrophobicContact CD2-CB 4.15Å; Y514-A516 HydrophobicContact CE2-CB 4Å; A516-L524 WeakPolarHBondContact O-CA 3.42Å; A516-K525 PolarHBondContact N-O 2.88Å; A516-K525 PolarHBondContact O-N 3.11Å
517	R	94.1	Very high	90.9	Very high	96 Å²	96	52.6 Å²	52.6	36%	0.362	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	121.7	168.8	-179.4	167.1	-77.7	149	5.8	108.9	E432 R522 L524	E432-R517 IonicContact OE2-NH2 2.75Å; E432-R517 PolarHBondContact OE2-NH2 3.27Å; R517-R522 VanDerWaalsContact CD-O 3.31Å; R517-R522 WeakPolarHBondContact CD-O 3.31Å; R517-R522 VanDerWaalsContact CG-O 3.27Å; R517-R522 WeakPolarHBondContact CG-O 3.43Å; R517-R522 PolarHBondContact NE-O 3.41Å; R517-R522 VanDerWaalsContact NE-O 3.12Å; R517-L524 HydrophobicContact CB-CD2 3.93Å
518	D	89.9	Confident	91.7	Very high	35 Å²	35	48.5 Å²	48.5	19%	0.187	23%	0.231	C	C	.	.			trans	-59.4	138.7	174.6	-173.5	90.1	0	0	0	110.9	D520 T521 R522 I523 K525	D518-D520 PolarHBondContact OD2-N 3.17Å; D518-T521 WeakPolarHBondContact CB-OG1 3.47Å; D518-T521 WeakPolarHBondContact OD2-CB 3.5Å; D518-T521 PolarHBondContact OD2-N 3.25Å; D518-T521 PolarHBondContact OD2-OG1 3.39Å; D518-R522 VanDerWaalsContact O-CA 3.31Å; D518-R522 WeakPolarHBondContact O-CA 3.29Å; D518-R522 PolarHBondContact O-N 2.85Å; D518-I523 WeakPolarHBondContact CB-O 3.27Å; D518-I523 PolarHBondContact N-O 2.94Å; D518-K525 HydrophobicContact CB-CD 4.07Å; D518-K525 HydrophobicContact CB-CG 4.47Å; D518-K525 VanDerWaalsContact CG-NZ 3.26Å; D518-K525 WeakPolarHBondContact OD1-CE 3.43Å; D518-K525 IonicContact OD1-NZ 3.89Å; D518-K525 PolarHBondContact OD1-NZ 2.89Å; D518-K525 IonicContact OD2-NZ 3.84Å
519	K	82.8	Confident	92.7	Very high	144 Å²	144	44.8 Å²	44.8	63%	0.626	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-67.1	-44.7	-172.3	-68.1	-178.2	-176.2	172.5	0	111.9
520	D	84.8	Confident	93	Very high	149 Å²	149	47.4 Å²	47.4	80%	0.797	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-92.7	-46.5	-167.6	-49.1	-57.3	0	0	0	111.4	D518	D518-D520 PolarHBondContact OD2-N 3.17Å
521	T	87.6	Confident	93.1	Very high	72 Å²	72	42.3 Å²	42.3	44%	0.442	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-14.9	-179.5	62.4	0	0	0	0	113.7	D518 I523	D518-T521 WeakPolarHBondContact CB-OG1 3.47Å; D518-T521 WeakPolarHBondContact OD2-CB 3.5Å; D518-T521 PolarHBondContact OD2-N 3.25Å; D518-T521 PolarHBondContact OD2-OG1 3.39Å; T521-I523 PolarHBondContact O-N 3.33Å
522	R	88.4	Confident	93	Very high	177 Å²	177	47.6 Å²	47.6	67%	0.668	22%	0.221	S	C	*	.			trans	58.9	2.4	-171.3	-53.5	-59.7	-148.3	163.7	8.9	115.6	R517 D518	R517-R522 VanDerWaalsContact CD-O 3.31Å; R517-R522 WeakPolarHBondContact CD-O 3.31Å; R517-R522 VanDerWaalsContact CG-O 3.27Å; R517-R522 WeakPolarHBondContact CG-O 3.43Å; R517-R522 PolarHBondContact NE-O 3.41Å; R517-R522 VanDerWaalsContact NE-O 3.12Å; D518-R522 VanDerWaalsContact O-CA 3.31Å; D518-R522 WeakPolarHBondContact O-CA 3.29Å; D518-R522 PolarHBondContact O-N 2.85Å
523	I	92.6	Very high	92.7	Very high	53 Å²	53	50.3 Å²	50.3	27%	0.272	24%	0.237	S	C	.	.			trans	-68.4	146.7	176.3	-67.1	170.9	0	0	0	109.9	E429 D518 T521 K525	E429-I523 HydrophobicContact CB-CG2 4.2Å; E429-I523 VanDerWaalsContact CD-CG2 3.48Å; E429-I523 HydrophobicContact CG-CG2 3.58Å; E429-I523 WeakPolarHBondContact OE1-CG2 3.45Å; D518-I523 WeakPolarHBondContact CB-O 3.27Å; D518-I523 PolarHBondContact N-O 2.94Å; T521-I523 PolarHBondContact O-N 3.33Å; I523-K525 HydrophobicContact CG2-CG 4.27Å
524	L	95.3	Very high	92.5	Very high	7 Å²	7	54.2 Å²	54.2	4%	0.037	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	122.4	171.4	-66.9	158.7	0	0	0	108.9	M430 E432 L435 V515 A516 R517	M430-L524 HydrophobicContact CB-CB 3.88Å; M430-L524 PolarHBondContact N-O 3.42Å; E432-L524 HydrophobicContact CB-CD1 4.29Å; L435-L524 HydrophobicContact CD1-CD1 3.8Å; L435-L524 HydrophobicContact CD1-CD2 3.99Å; L435-L524 HydrophobicContact CD1-CG 4.32Å; V515-L524 HydrophobicContact CG1-CB 4.43Å; A516-L524 WeakPolarHBondContact O-CA 3.42Å; R517-L524 HydrophobicContact CB-CD2 3.93Å
525	K	95.2	Very high	92.4	Very high	24 Å²	24	54.2 Å²	54.2	10%	0.104	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.1	121.6	-177.9	-64.2	-179.3	-179.3	170.3	0	109.8	W427 V515 A516 D518 I523 H527	W427-K525 HydrophobicContact CD2-CB 4.43Å; W427-K525 HydrophobicContact CD2-CD 3.93Å; W427-K525 HydrophobicContact CD2-CG 4.18Å; W427-K525 HydrophobicContact CE3-CB 4.09Å; W427-K525 HydrophobicContact CE3-CD 3.85Å; W427-K525 HydrophobicContact CE3-CG 3.66Å; W427-K525 HydrophobicContact CH2-CD 4.32Å; W427-K525 HydrophobicContact CZ2-CD 4.37Å; W427-K525 HydrophobicContact CZ3-CD 4.05Å; W427-K525 HydrophobicContact CZ3-CG 3.93Å; V515-K525 WeakPolarHBondContact CA-O 3.49Å; A516-K525 PolarHBondContact N-O 2.88Å; A516-K525 PolarHBondContact O-N 3.11Å; D518-K525 HydrophobicContact CB-CD 4.07Å; D518-K525 HydrophobicContact CB-CG 4.47Å; D518-K525 VanDerWaalsContact CG-NZ 3.26Å; D518-K525 WeakPolarHBondContact OD1-CE 3.43Å; D518-K525 IonicContact OD1-NZ 3.89Å; D518-K525 PolarHBondContact OD1-NZ 2.89Å; D518-K525 IonicContact OD2-NZ 3.84Å; I523-K525 HydrophobicContact CG2-CG 4.27Å; K525-H527 WeakPolarHBondContact CB-NE2 2.91Å; K525-H527 PolarHBondContact O-CD2 3.16Å; K525-H527 PolarHBondContact O-N 3.41Å
526	C	96.3	Very high	92.3	Very high	0 Å²	0	61.3 Å²	61.3	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	97.7	168.5	-178.9	0	0	0	0	108.8	W427 V428 M430 C447 Y514 V515	W427-C526 CarbonylContact C-O 3.59Å; W427-C526 WeakPolarHBondContact CA-O 3.26Å; W427-C526 WeakPolarHBondContact CB-O 3.31Å; V428-C526 PolarHBondContact N-O 2.94Å; V428-C526 PolarHBondContact O-N 3.16Å; M430-C526 HydrophobicContact CG-CB 3.64Å; M430-C526 HydrophobicContact SD-CB 3.63Å; C447-C526 HydrophobicContact CB-CB 4.22Å; Y514-C526 CarbonylContact O-C 3.6Å; Y514-C526 WeakPolarHBondContact O-CA 3.4Å; V515-C526 HydrophobicContact CG2-CB 3.93Å
527	H	94.4	Very high	92.2	Very high	34 Å²	34	63.1 Å²	63.1	16%	0.157	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.1	131.6	175.8	-63.2	-92.2	0	0	0	109.8	A513 Y514 K525 F529	A513-H527 WeakPolarHBondContact CA-O 3.23Å; A513-H527 WeakPolarHBondContact CB-O 3.26Å; Y514-H527 HydrophobicContact CD1-CB 4.38Å; Y514-H527 HydrophobicContact CE1-CB 4.04Å; Y514-H527 HydrophobicContact CE2-CB 4.33Å; Y514-H527 AromaticContact CE2-CD2 3.72Å; Y514-H527 AromaticContact CZ-CD2 3.95Å; Y514-H527 PolarHBondContact N-O 2.84Å; Y514-H527 PolarHBondContact O-N 2.82Å; K525-H527 WeakPolarHBondContact CB-NE2 2.91Å; K525-H527 PolarHBondContact O-CD2 3.16Å; K525-H527 PolarHBondContact O-N 3.41Å; H527-F529 HydrophobicContact CB-CE2 3.56Å; H527-F529 HydrophobicContact CB-CZ 3.82Å
528	V	94.2	Very high	92.3	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	136.7	-177.1	-176.9	0	0	0	0	110.4	L425 G426 I448 L451 A513	L425-V528 HydrophobicContact CB-CB 4.42Å; L425-V528 HydrophobicContact CB-CG1 4.33Å; L425-V528 HydrophobicContact CD1-CG1 4.04Å; L425-V528 PolarHBondContact N-O 3.37Å; G426-V528 PolarHBondContact O-N 3Å; G426-V528 VanDerWaalsContact O-N 3.08Å; I448-V528 HydrophobicContact CB-CG1 4.49Å; I448-V528 HydrophobicContact CG1-CG1 4.1Å; I448-V528 HydrophobicContact CG1-CG2 4.25Å; L451-V528 HydrophobicContact CB-CB 4.35Å; L451-V528 HydrophobicContact CB-CG1 4.49Å; L451-V528 HydrophobicContact CD1-CB 3.87Å; L451-V528 HydrophobicContact CD1-CG2 3.75Å; A513-V528 HydrophobicContact CB-CG2 3.96Å
529	F	94.2	Very high	92.6	Very high	3 Å²	3	57.6 Å²	57.6	1%	0.013	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	140.3	-176.1	-53.7	-92.6	0	0	0	110.4	V422 R423 M471 L482 D511 F512 Y514 H527	V422-F529 HydrophobicContact CB-CB 4.19Å; V422-F529 HydrophobicContact CG2-CB 4.47Å; V422-F529 HydrophobicContact CG2-CD1 4.02Å; R423-F529 CarbonylContact O-C 3.41Å; R423-F529 VanDerWaalsContact O-CA 3.27Å; R423-F529 WeakPolarHBondContact O-CA 3.39Å; M471-F529 HydrophobicContact CE-CE1 4.26Å; L482-F529 HydrophobicContact CD1-CE1 3.7Å; L482-F529 HydrophobicContact CD1-CZ 3.84Å; L482-F529 HydrophobicContact CD2-CE1 3.93Å; L482-F529 HydrophobicContact CD2-CZ 4.25Å; D511-F529 CarbonylContact C-O 3.57Å; D511-F529 WeakPolarHBondContact CA-O 3.49Å; F512-F529 HydrophobicContact CD1-CD2 4.18Å; F512-F529 PolarHBondContact N-O 3.45Å; F512-F529 PolarHBondContact O-N 3.35Å; Y514-F529 AromaticContact CD1-CE2 3.73Å; Y514-F529 HydrophobicContact CD1-CE2 3.73Å; Y514-F529 AromaticContact CE1-CE2 3.45Å; Y514-F529 HydrophobicContact CE1-CE2 3.45Å; Y514-F529 VanDerWaalsContact CE1-CE2 3.45Å; Y514-F529 AromaticContact CE1-CZ 3.8Å; Y514-F529 HydrophobicContact CE1-CZ 3.8Å; H527-F529 HydrophobicContact CB-CE2 3.56Å; H527-F529 HydrophobicContact CB-CZ 3.82Å
530	R	92.4	Very high	93.2	Very high	87 Å²	87	53.5 Å²	53.5	33%	0.328	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.1	129.2	168.4	-173.8	158.8	-67.7	152.1	4.3	109.5	V422 R423 L425 S452 D511	V422-R530 CarbonylContact C-O 3.56Å; V422-R530 VanDerWaalsContact CA-O 3.29Å; V422-R530 WeakPolarHBondContact CA-O 3Å; R423-R530 PolarHBondContact N-O 3.3Å; R423-R530 PolarHBondContact O-N 2.96Å; L425-R530 HydrophobicContact CD1-CB 4.28Å; L425-R530 HydrophobicContact CD2-CB 4.19Å; L425-R530 HydrophobicContact CG-CB 4.33Å; S452-R530 PolarHBondContact O-NH2 2.57Å; S452-R530 PolarHBondContact OG-NH2 2.95Å; S452-R530 VanDerWaalsContact OG-NH2 3.12Å; D511-R530 WeakPolarHBondContact OD1-CG 3.46Å; D511-R530 IonicContact OD1-CZ 3.46Å; D511-R530 IonicContact OD1-NE 2.63Å; D511-R530 PolarHBondContact OD1-NE 3.02Å; D511-R530 IonicContact OD1-NH2 3.51Å; D511-R530 PolarHBondContact OD1-NH2 3.47Å; D511-R530 IonicContact OD2-NH2 3.96Å
531	C	93.7	Very high	93.7	Very high	1 Å²	1	46.9 Å²	46.9	1%	0.007	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	138.8	-171.4	-52.3	0	0	0	0	112	V422 R510 F512 T533 A535 I538	V422-C531 HydrophobicContact CG1-CB 4.28Å; R510-C531 PolarHBondContact NH1-O 3.28Å; R510-C531 VanDerWaalsContact O-CB 3.27Å; R510-C531 WeakPolarHBondContact O-CB 3.32Å; R510-C531 PolarHBondContact O-N 2.86Å; F512-C531 VanDerWaalsContact CB-SG 3.6Å; C531-T533 CarbonylContact C-O 3.54Å; C531-T533 WeakPolarHBondContact CB-O 3.29Å; C531-A535 HydrophobicContact CB-CB 4.49Å; C531-I538 HydrophobicContact CB-CD1 4.37Å; C531-I538 WeakPolarHBondContact SG-CD1 3.45Å
532	D	91.9	Very high	94.1	Very high	115 Å²	115	43.5 Å²	43.5	62%	0.615	22%	0.22	S	C	*	.	S	Bend	trans	-71.8	-34.6	174	-80.5	-5	0	0	0	111.4	A421 R510	A421-D532 HydrophobicContact CB-CB 4.26Å; A421-D532 PolarHBondContact O-N 3.39Å; R510-D532 PolarHBondContact NH1-O 3.02Å
533	T	90.9	Very high	94.4	Very high	57 Å²	57	40.2 Å²	40.2	35%	0.35	21%	0.212	S	C	.	.	S	Bend	trans	-86.1	158.2	165.4	54.9	0	0	0	0	110.7	C531 A535	C531-T533 CarbonylContact C-O 3.54Å; C531-T533 WeakPolarHBondContact CB-O 3.29Å; T533-A535 PolarHBondContact O-N 3.42Å
534	P	93.2	Very high	94.5	Very high	82 Å²	82	42.3 Å²	42.3	53%	0.532	22%	0.221	S	C	.	.			trans	-57.6	127	173	-23.3	34.2	0	0	0	111	K536 A537	P534-K536 PolarHBondContact O-N 3.26Å; P534-A537 WeakPolarHBondContact O-CB 3.36Å; P534-A537 PolarHBondContact O-N 3.24Å
535	A	95.4	Very high	94.4	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-19.8	-174.4	0	0	0	0	0	113.6	V504 G509 F512 C531 T533 A537 I538 A539	V504-A535 HydrophobicContact CB-CB 4.49Å; V504-A535 HydrophobicContact CG1-CB 3.84Å; V504-A535 HydrophobicContact CG2-CB 4.07Å; G509-A535 PolarHBondContact O-N 2.98Å; F512-A535 HydrophobicContact CB-CB 3.74Å; C531-A535 HydrophobicContact CB-CB 4.49Å; T533-A535 PolarHBondContact O-N 3.42Å; A535-A537 PolarHBondContact O-N 2.84Å; A535-I538 PolarHBondContact O-N 2.8Å; A535-A539 PolarHBondContact O-N 2.84Å; A535-A539 VanDerWaalsContact O-N 3.12Å
536	K	94.8	Very high	94.3	Very high	149 Å²	149	42.7 Å²	42.7	65%	0.648	23%	0.225	S	C	*	.	H	α-helix	trans	-54.3	-35.3	168.1	-172.9	178.5	178.1	-176.2	0	112.7	P534 I538 A539 T540	P534-K536 PolarHBondContact O-N 3.26Å; K536-I538 PolarHBondContact O-N 3.06Å; K536-A539 PolarHBondContact O-N 3.5Å; K536-T540 WeakPolarHBondContact O-CB 3.31Å; K536-T540 PolarHBondContact O-N 2.88Å; K536-T540 PolarHBondContact O-OG1 3.42Å
537	A	95	Very high	94.2	Very high	40 Å²	40	44.9 Å²	44.9	33%	0.331	24%	0.24	S	C	.	.	H	α-helix	trans	-64.2	-39.6	179.3	0	0	0	0	0	112.4	F420 P534 A535 S541	F420-A537 HydrophobicContact CE1-CB 4.04Å; P534-A537 WeakPolarHBondContact O-CB 3.36Å; P534-A537 PolarHBondContact O-N 3.24Å; A535-A537 PolarHBondContact O-N 2.84Å; A537-S541 VanDerWaalsContact O-CB 3.31Å; A537-S541 WeakPolarHBondContact O-CB 3.42Å; A537-S541 PolarHBondContact O-N 3.47Å; A537-S541 PolarHBondContact O-OG 2.78Å
538	I	95.6	Very high	94	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-67.3	-47.7	174.3	-49.5	-172.1	0	0	0	109.9	F420 V422 L473 L475 F512 C531 A535 K536 T540 S541 L542	F420-I538 HydrophobicContact CB-CD1 3.84Å; F420-I538 HydrophobicContact CB-CG1 4.14Å; F420-I538 HydrophobicContact CD1-CD1 4.36Å; F420-I538 HydrophobicContact CD1-CG1 3.72Å; F420-I538 HydrophobicContact CD2-CD1 4.35Å; F420-I538 HydrophobicContact CD2-CG1 3.95Å; F420-I538 HydrophobicContact CE1-CG1 4.07Å; F420-I538 HydrophobicContact CE2-CG1 4.29Å; F420-I538 HydrophobicContact CG-CD1 3.94Å; F420-I538 HydrophobicContact CG-CG1 3.66Å; F420-I538 HydrophobicContact CZ-CG1 4.34Å; V422-I538 HydrophobicContact CG1-CD1 3.92Å; L473-I538 HydrophobicContact CD1-CD1 4.43Å; L473-I538 HydrophobicContact CD1-CG2 4.4Å; L473-I538 HydrophobicContact CD2-CG2 3.97Å; L475-I538 HydrophobicContact CD1-CG2 4.34Å; F512-I538 HydrophobicContact CD1-CD1 4.49Å; F512-I538 HydrophobicContact CD1-CG2 4.11Å; F512-I538 HydrophobicContact CD2-CB 4.26Å; F512-I538 HydrophobicContact CD2-CG2 4.28Å; F512-I538 HydrophobicContact CE1-CG2 3.95Å; F512-I538 HydrophobicContact CE2-CB 4.47Å; F512-I538 HydrophobicContact CE2-CG2 4.14Å; F512-I538 HydrophobicContact CG-CB 4.39Å; F512-I538 HydrophobicContact CG-CD1 4.46Å; F512-I538 HydrophobicContact CG-CG2 4.3Å; F512-I538 HydrophobicContact CZ-CG2 3.99Å; C531-I538 HydrophobicContact CB-CD1 4.37Å; C531-I538 WeakPolarHBondContact SG-CD1 3.45Å; A535-I538 PolarHBondContact O-N 2.8Å; K536-I538 PolarHBondContact O-N 3.06Å; I538-T540 PolarHBondContact O-N 3.01Å; I538-S541 PolarHBondContact O-N 2.68Å; I538-S541 VanDerWaalsContact O-N 3.17Å; I538-L542 HydrophobicContact CG2-CD1 4.27Å; I538-L542 PolarHBondContact O-N 3.42Å
539	A	96.3	Very high	93.9	Very high	15 Å²	15	47.2 Å²	47.2	12%	0.124	25%	0.25	C	S	.	.	H	α-helix	trans	-63.8	-36.3	-179.6	0	0	0	0	0	113.5	W502 V504 F512 A535 K536 H543	W502-A539 PolarHBondContact NE1-O 2.76Å; V504-A539 HydrophobicContact CG2-CB 3.7Å; F512-A539 HydrophobicContact CE2-CB 4.34Å; A535-A539 PolarHBondContact O-N 2.84Å; A535-A539 VanDerWaalsContact O-N 3.12Å; K536-A539 PolarHBondContact O-N 3.5Å; A539-H543 WeakPolarHBondContact O-CB 3.42Å; A539-H543 PolarHBondContact O-N 2.76Å; A539-H543 VanDerWaalsContact O-N 3.08Å
540	T	95	Very high	93.6	Very high	58 Å²	58	52.6 Å²	52.6	36%	0.356	28%	0.277	S	S	.	.	H	α-helix	trans	-68.6	-42.4	171.8	-71.5	0	0	0	0	111.1	K536 I538 H543 E544	K536-T540 WeakPolarHBondContact O-CB 3.31Å; K536-T540 PolarHBondContact O-N 2.88Å; K536-T540 PolarHBondContact O-OG1 3.42Å; I538-T540 PolarHBondContact O-N 3.01Å; T540-H543 WeakPolarHBondContact O-CB 3.42Å; T540-H543 PolarHBondContact O-N 3.36Å; T540-H543 VanDerWaalsContact O-N 3.12Å; T540-E544 VanDerWaalsContact CG2-OE1 3.26Å; T540-E544 WeakPolarHBondContact CG2-OE1 3.45Å; T540-E544 WeakPolarHBondContact O-CG 3.34Å; T540-E544 PolarHBondContact O-N 3.27Å
541	S	95.4	Very high	93.4	Very high	11 Å²	11	50.6 Å²	50.6	8%	0.077	28%	0.279	C	S	.	.	H	α-helix	trans	-66.2	-40	178.9	-62	0	0	0	0	113	K418 A537 I538 H543 E544 I545	K418-S541 WeakPolarHBondContact CD-OG 3.5Å; K418-S541 PolarHBondContact NZ-OG 2.84Å; A537-S541 VanDerWaalsContact O-CB 3.31Å; A537-S541 WeakPolarHBondContact O-CB 3.42Å; A537-S541 PolarHBondContact O-N 3.47Å; A537-S541 PolarHBondContact O-OG 2.78Å; I538-S541 PolarHBondContact O-N 2.68Å; I538-S541 VanDerWaalsContact O-N 3.17Å; S541-H543 VanDerWaalsContact C-N 3.33Å; S541-E544 PolarHBondContact O-N 3.45Å; S541-I545 WeakPolarHBondContact O-CG1 3.19Å; S541-I545 PolarHBondContact O-N 3.33Å; S541-I545 VanDerWaalsContact O-N 3.09Å
542	L	96.1	Very high	93	Very high	0 Å²	0	55.1 Å²	55.1	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-61.8	-40.4	169.2	-82.1	168.1	0	0	0	111.9	L475 L480 I496 I499 W502 F512 I538 I545 C546	L475-L542 HydrophobicContact CD1-CD2 4.24Å; L475-L542 HydrophobicContact CD1-CG 3.86Å; L475-L542 HydrophobicContact CD2-CD2 3.65Å; L475-L542 HydrophobicContact CD2-CG 4.03Å; L480-L542 HydrophobicContact CD1-CD1 4.4Å; L480-L542 HydrophobicContact CD1-CD2 4.47Å; I496-L542 HydrophobicContact CD1-CD2 3.86Å; I496-L542 HydrophobicContact CG1-CD2 3.82Å; I496-L542 HydrophobicContact CG2-CD2 3.97Å; I499-L542 HydrophobicContact CD1-CD2 4.27Å; W502-L542 HydrophobicContact CD2-CB 4.46Å; W502-L542 HydrophobicContact CG-CD1 4.35Å; W502-L542 HydrophobicContact CZ2-CB 4.33Å; F512-L542 HydrophobicContact CE1-CD1 4.26Å; F512-L542 HydrophobicContact CE2-CD1 4.01Å; F512-L542 HydrophobicContact CZ-CD1 3.38Å; I538-L542 HydrophobicContact CG2-CD1 4.27Å; I538-L542 PolarHBondContact O-N 3.42Å; L542-I545 PolarHBondContact O-N 2.76Å; L542-C546 VanDerWaalsContact O-CB 3.28Å; L542-C546 WeakPolarHBondContact O-CB 3.44Å; L542-C546 PolarHBondContact O-N 3.07Å; L542-C546 PolarHBondContact O-SG 3.35Å
543	H	94.8	Very high	92.5	Very high	108 Å²	108	55 Å²	55	50%	0.5	29%	0.291	S	S	.	.	H	α-helix	trans	-65.2	-39	177.4	-176.7	65.2	0	0	0	112.8	W502 A539 T540 S541 S547	W502-H543 HydrophobicContact CZ2-CB 4.07Å; A539-H543 WeakPolarHBondContact O-CB 3.42Å; A539-H543 PolarHBondContact O-N 2.76Å; A539-H543 VanDerWaalsContact O-N 3.08Å; T540-H543 WeakPolarHBondContact O-CB 3.42Å; T540-H543 PolarHBondContact O-N 3.36Å; T540-H543 VanDerWaalsContact O-N 3.12Å; S541-H543 VanDerWaalsContact C-N 3.33Å; H543-S547 VanDerWaalsContact O-CB 3.26Å; H543-S547 WeakPolarHBondContact O-CB 3.43Å; H543-S547 PolarHBondContact O-N 3.07Å; H543-S547 PolarHBondContact O-OG 3.19Å
544	E	94.3	Very high	92	Very high	97 Å²	97	59.5 Å²	59.5	45%	0.453	31%	0.306	S	S	.	.	H	α-helix	trans	-62.1	-50	173.5	-74.2	165.6	-157.6	0	0	111.3	K418 T540 S541 S547 K548	K418-E544 IonicContact NZ-OE2 2.78Å; K418-E544 PolarHBondContact NZ-OE2 3.2Å; T540-E544 VanDerWaalsContact CG2-OE1 3.26Å; T540-E544 WeakPolarHBondContact CG2-OE1 3.45Å; T540-E544 WeakPolarHBondContact O-CG 3.34Å; T540-E544 PolarHBondContact O-N 3.27Å; S541-E544 PolarHBondContact O-N 3.45Å; E544-S547 CarbonylContact O-C 3.57Å; E544-S547 WeakPolarHBondContact O-CA 3.27Å; E544-S547 WeakPolarHBondContact O-CB 3.47Å; E544-S547 PolarHBondContact O-N 2.87Å; E544-S547 VanDerWaalsContact O-N 3.08Å; E544-K548 PolarHBondContact O-N 3.34Å
545	I	93.9	Very high	91	Very high	20 Å²	20	60.1 Å²	60.1	10%	0.103	31%	0.305	C	S	.	.	H	α-helix	trans	-63.2	-45	178.2	-64.6	163.8	0	0	0	110.8	L475 I496 S541 L542 S547 K548 I549	L475-I545 HydrophobicContact CB-CD1 3.7Å; L475-I545 HydrophobicContact CD1-CD1 4.36Å; I496-I545 HydrophobicContact CD1-CB 4.38Å; I496-I545 HydrophobicContact CD1-CD1 4.12Å; I496-I545 HydrophobicContact CD1-CG2 3.74Å; I496-I545 HydrophobicContact CG2-CG2 4.46Å; S541-I545 WeakPolarHBondContact O-CG1 3.19Å; S541-I545 PolarHBondContact O-N 3.33Å; S541-I545 VanDerWaalsContact O-N 3.09Å; L542-I545 PolarHBondContact O-N 2.76Å; I545-S547 PolarHBondContact O-N 3.45Å; I545-K548 WeakPolarHBondContact O-CB 3.42Å; I545-K548 PolarHBondContact O-N 3.39Å; I545-K548 VanDerWaalsContact O-N 3.17Å; I545-I549 HydrophobicContact CG2-CD1 3.83Å; I545-I549 HydrophobicContact CG2-CG1 4.41Å; I545-I549 VanDerWaalsContact O-CG1 3.26Å; I545-I549 WeakPolarHBondContact O-CG1 3.33Å; I545-I549 PolarHBondContact O-N 3.14Å
546	C	92.9	Very high	89.9	Confident	19 Å²	19	63 Å²	63	13%	0.128	33%	0.328	C	S	.	.	H	α-helix	trans	-59.3	-35	173.6	-69	0	0	0	0	112.2	I496 W502 L542 M550	I496-C546 WeakPolarHBondContact CG2-SG 3.48Å; W502-C546 HydrophobicContact CH2-CB 4.09Å; W502-C546 VanDerWaalsContact CH2-SG 3.52Å; L542-C546 VanDerWaalsContact O-CB 3.28Å; L542-C546 WeakPolarHBondContact O-CB 3.44Å; L542-C546 PolarHBondContact O-N 3.07Å; L542-C546 PolarHBondContact O-SG 3.35Å; C546-M550 HydrophobicContact CB-CE 4.41Å; C546-M550 VanDerWaalsContact O-CB 3.32Å; C546-M550 WeakPolarHBondContact O-CB 3.44Å; C546-M550 WeakPolarHBondContact O-CE 3.35Å; C546-M550 VanDerWaalsContact O-CG 3.23Å; C546-M550 WeakPolarHBondContact O-CG 3.19Å; C546-M550 PolarHBondContact O-N 3.41Å
547	S	93.2	Very high	88.2	Confident	46 Å²	46	63 Å²	63	32%	0.322	33%	0.328	S	S	.	.	H	α-helix	trans	-72.4	-37.7	177.1	-61	0	0	0	0	112.2	H543 E544 I545 M550 A551	H543-S547 VanDerWaalsContact O-CB 3.26Å; H543-S547 WeakPolarHBondContact O-CB 3.43Å; H543-S547 PolarHBondContact O-N 3.07Å; H543-S547 PolarHBondContact O-OG 3.19Å; E544-S547 CarbonylContact O-C 3.57Å; E544-S547 WeakPolarHBondContact O-CA 3.27Å; E544-S547 WeakPolarHBondContact O-CB 3.47Å; E544-S547 PolarHBondContact O-N 2.87Å; E544-S547 VanDerWaalsContact O-N 3.08Å; I545-S547 PolarHBondContact O-N 3.45Å; S547-M550 PolarHBondContact O-N 2.79Å; S547-A551 VanDerWaalsContact O-CB 3.25Å; S547-A551 WeakPolarHBondContact O-CB 3.27Å; S547-A551 PolarHBondContact O-N 3.41Å
548	K	91.4	Very high	86.3	Confident	75 Å²	75	63.6 Å²	63.6	33%	0.326	33%	0.334	S	S	.	.	H	α-helix	trans	-58.4	-55.4	169.9	-177	179.2	-179.1	-178.3	0	110.4	E416 E544 I545 M550 A551 E552	E416-K548 IonicContact OE1-NZ 3.71Å; E416-K548 PolarHBondContact OE1-NZ 3.37Å; E416-K548 IonicContact OE2-NZ 2.83Å; E416-K548 PolarHBondContact OE2-NZ 3.1Å; E544-K548 PolarHBondContact O-N 3.34Å; I545-K548 WeakPolarHBondContact O-CB 3.42Å; I545-K548 PolarHBondContact O-N 3.39Å; I545-K548 VanDerWaalsContact O-N 3.17Å; K548-M550 VanDerWaalsContact C-N 3.31Å; K548-M550 PolarHBondContact O-N 3.24Å; K548-A551 PolarHBondContact O-N 2.99Å; K548-E552 WeakPolarHBondContact CE-OE1 3.26Å; K548-E552 VanDerWaalsContact CG-OE1 3.23Å; K548-E552 WeakPolarHBondContact CG-OE1 3.47Å; K548-E552 WeakPolarHBondContact O-CB 3.31Å; K548-E552 WeakPolarHBondContact O-CG 3.38Å; K548-E552 PolarHBondContact O-N 3.34Å
549	I	90.9	Very high	84.5	Confident	9 Å²	9	69.4 Å²	69.4	5%	0.046	36%	0.364	C	S	.	.	H	α-helix	trans	-54.2	-44.4	175.5	-63.7	163.1	0	0	0	111.8	D478 I496 V497 I545 R553	D478-I549 HydrophobicContact CB-CD1 4.07Å; D478-I549 WeakPolarHBondContact OD1-CD1 3.36Å; D478-I549 VanDerWaalsContact OD1-CG1 3.32Å; D478-I549 WeakPolarHBondContact OD1-CG1 3.49Å; D478-I549 WeakPolarHBondContact OD2-CG1 3.08Å; I496-I549 HydrophobicContact CG2-CD1 4.3Å; V497-I549 HydrophobicContact CG1-CD1 3.95Å; V497-I549 HydrophobicContact CG1-CG2 4Å; I545-I549 HydrophobicContact CG2-CD1 3.83Å; I545-I549 HydrophobicContact CG2-CG1 4.41Å; I545-I549 VanDerWaalsContact O-CG1 3.26Å; I545-I549 WeakPolarHBondContact O-CG1 3.33Å; I545-I549 PolarHBondContact O-N 3.14Å; I549-R553 HydrophobicContact CG2-CG 4.44Å; I549-R553 VanDerWaalsContact O-CB 3.24Å; I549-R553 WeakPolarHBondContact O-CB 3.43Å; I549-R553 WeakPolarHBondContact O-CD 3.38Å; I549-R553 WeakPolarHBondContact O-CG 3.42Å; I549-R553 PolarHBondContact O-N 2.79Å
550	M	88.9	Confident	82.4	Confident	115 Å²	115	72 Å²	72	57%	0.567	39%	0.385	S	S	*	.	H	α-helix	trans	-68.9	-37	178.4	-77.4	-172.9	-67.8	0	0	112.7	C546 S547 K548 K554	C546-M550 HydrophobicContact CB-CE 4.41Å; C546-M550 VanDerWaalsContact O-CB 3.32Å; C546-M550 WeakPolarHBondContact O-CB 3.44Å; C546-M550 WeakPolarHBondContact O-CE 3.35Å; C546-M550 VanDerWaalsContact O-CG 3.23Å; C546-M550 WeakPolarHBondContact O-CG 3.19Å; C546-M550 PolarHBondContact O-N 3.41Å; S547-M550 PolarHBondContact O-N 2.79Å; K548-M550 VanDerWaalsContact C-N 3.31Å; K548-M550 PolarHBondContact O-N 3.24Å; M550-K554 WeakPolarHBondContact O-CB 3.38Å; M550-K554 PolarHBondContact O-N 3.29Å
551	A	88.1	Confident	80.1	Confident	45 Å²	45	73.6 Å²	73.6	37%	0.372	40%	0.398	S	S	.	.	H	α-helix	trans	-69.5	-43.1	176.5	0	0	0	0	0	111.5	S547 K548 K554 N555	S547-A551 VanDerWaalsContact O-CB 3.25Å; S547-A551 WeakPolarHBondContact O-CB 3.27Å; S547-A551 PolarHBondContact O-N 3.41Å; K548-A551 PolarHBondContact O-N 2.99Å; A551-K554 CarbonylContact O-C 3.58Å; A551-K554 WeakPolarHBondContact O-CB 3.23Å; A551-K554 PolarHBondContact O-N 3.21Å; A551-K554 VanDerWaalsContact O-N 3.13Å; A551-N555 WeakPolarHBondContact O-CB 3.32Å; A551-N555 VanDerWaalsContact O-CG 3.32Å; A551-N555 PolarHBondContact O-N 2.86Å; A551-N555 PolarHBondContact O-ND2 2.89Å
552	E	85.1	Confident	77.4	Confident	96 Å²	96	76.6 Å²	76.6	45%	0.449	42%	0.419	S	S	.	.	H	α-helix	trans	-63.4	-46.8	174.5	-71.7	169.6	-176.3	0	0	111.1	K548 K554 N555 A556	K548-E552 WeakPolarHBondContact CE-OE1 3.26Å; K548-E552 VanDerWaalsContact CG-OE1 3.23Å; K548-E552 WeakPolarHBondContact CG-OE1 3.47Å; K548-E552 WeakPolarHBondContact O-CB 3.31Å; K548-E552 WeakPolarHBondContact O-CG 3.38Å; K548-E552 PolarHBondContact O-N 3.34Å; E552-K554 PolarHBondContact O-N 3.09Å; E552-N555 PolarHBondContact O-N 3.32Å; E552-N555 VanDerWaalsContact O-N 3.16Å; E552-A556 WeakPolarHBondContact O-CB 3.32Å; E552-A556 PolarHBondContact O-N 3.13Å
553	R	81.4	Confident	74.6	Confident	112 Å²	112	80.6 Å²	80.6	42%	0.423	45%	0.447	S	S	.	.	H	α-helix	trans	-61.3	-24.9	172.2	-73.2	171.8	177.1	-169.5	-5.5	113.5	I549 K557	I549-R553 HydrophobicContact CG2-CG 4.44Å; I549-R553 VanDerWaalsContact O-CB 3.24Å; I549-R553 WeakPolarHBondContact O-CB 3.43Å; I549-R553 WeakPolarHBondContact O-CD 3.38Å; I549-R553 WeakPolarHBondContact O-CG 3.42Å; I549-R553 PolarHBondContact O-N 2.79Å; R553-K557 VanDerWaalsContact O-CD 3.27Å; R553-K557 WeakPolarHBondContact O-CD 3.35Å; R553-K557 WeakPolarHBondContact O-CG 3.42Å
554	K	79.5	Confident	72.2	Confident	152 Å²	152	82.9 Å²	82.9	66%	0.661	46%	0.462	S	S	*	.	H	α-helix	trans	-80.5	-42.5	173.2	-175.6	-174.4	176.4	-171	0	111.4	M550 A551 E552 K557 A558	M550-K554 WeakPolarHBondContact O-CB 3.38Å; M550-K554 PolarHBondContact O-N 3.29Å; A551-K554 CarbonylContact O-C 3.58Å; A551-K554 WeakPolarHBondContact O-CB 3.23Å; A551-K554 PolarHBondContact O-N 3.21Å; A551-K554 VanDerWaalsContact O-N 3.13Å; E552-K554 PolarHBondContact O-N 3.09Å; K554-K557 PolarHBondContact O-N 3.2Å; K554-A558 PolarHBondContact O-N 3.39Å
555	N	74.1	Confident	69.7	Low	96 Å²	96	86.5 Å²	86.5	51%	0.513	48%	0.479	S	S	.	.	H	α-helix	trans	-69.6	-40.6	179.5	-72.1	-27.4	0	0	0	111.7	A551 E552 K557 A558 L559	A551-N555 WeakPolarHBondContact O-CB 3.32Å; A551-N555 VanDerWaalsContact O-CG 3.32Å; A551-N555 PolarHBondContact O-N 2.86Å; A551-N555 PolarHBondContact O-ND2 2.89Å; E552-N555 PolarHBondContact O-N 3.32Å; E552-N555 VanDerWaalsContact O-N 3.16Å; N555-K557 VanDerWaalsContact C-N 3.3Å; N555-K557 PolarHBondContact O-N 2.99Å; N555-A558 WeakPolarHBondContact O-CB 3.33Å; N555-A558 PolarHBondContact O-N 3.45Å; N555-A558 VanDerWaalsContact O-N 3.09Å; N555-L559 WeakPolarHBondContact O-CB 3.2Å; N555-L559 WeakPolarHBondContact O-CG 3.47Å; N555-L559 PolarHBondContact O-N 3.11Å
556	A	71.1	Confident	67	Low	60 Å²	60	94.2 Å²	94.2	50%	0.496	51%	0.514	S	S	.	.	H	α-helix	trans	-57.6	-42.9	171.2	0	0	0	0	0	111.7	E552 A560	E552-A556 WeakPolarHBondContact O-CB 3.32Å; E552-A556 PolarHBondContact O-N 3.13Å; A556-A560 VanDerWaalsContact O-CB 3.28Å; A556-A560 WeakPolarHBondContact O-CB 3.21Å; A556-A560 PolarHBondContact O-N 2.72Å
557	K	59.5	Low	64.5	Low	148 Å²	148	104.8 Å²	104.8	64%	0.643	55%	0.551	S	S	*	*	H	α-helix	trans	-67.2	-34.2	173.8	-72.2	173.2	-172.9	178.7	0	113.1	R553 K554 N555 C561	R553-K557 VanDerWaalsContact O-CD 3.27Å; R553-K557 WeakPolarHBondContact O-CD 3.35Å; R553-K557 WeakPolarHBondContact O-CG 3.42Å; K554-K557 PolarHBondContact O-N 3.2Å; N555-K557 VanDerWaalsContact C-N 3.3Å; N555-K557 PolarHBondContact O-N 2.99Å; K557-C561 PolarHBondContact O-N 3.31Å; K557-C561 PolarHBondContact O-SG 3.12Å; K557-C561 VanDerWaalsContact O-SG 3.33Å
558	A	55	Low	61.9	Low	54 Å²	54	106.5 Å²	106.5	45%	0.446	57%	0.568	S	S	.	*	H	α-helix	trans	-68.9	-45.7	175.8	0	0	0	0	0	111.5	K554 N555 A560 C561 S562	K554-A558 PolarHBondContact O-N 3.39Å; N555-A558 WeakPolarHBondContact O-CB 3.33Å; N555-A558 PolarHBondContact O-N 3.45Å; N555-A558 VanDerWaalsContact O-N 3.09Å; A558-A560 VanDerWaalsContact C-N 3.32Å; A558-A560 PolarHBondContact O-N 2.95Å; A558-C561 CarbonylContact O-C 3.5Å; A558-C561 PolarHBondContact O-N 3.05Å; A558-S562 PolarHBondContact O-N 3.46Å; A558-S562 PolarHBondContact O-OG 2.96Å
559	L	57.2	Low	59.2	Low	122 Å²	122	110.3 Å²	110.3	64%	0.639	59%	0.593	S	S	*	*	H	α-helix	trans	-61.5	-39.3	175.3	-69.4	166.8	0	0	0	111.8	N555 C561 S562	N555-L559 WeakPolarHBondContact O-CB 3.2Å; N555-L559 WeakPolarHBondContact O-CG 3.47Å; N555-L559 PolarHBondContact O-N 3.11Å; L559-C561 PolarHBondContact O-N 3.45Å; L559-S562 WeakPolarHBondContact CA-OG 3.16Å; L559-S562 PolarHBondContact O-OG 3.31Å; L559-S562 VanDerWaalsContact O-OG 3.11Å
560	A	52.6	Low	56.4	Low	69 Å²	69	114.8 Å²	114.8	57%	0.57	63%	0.631	S	S	*	*	H	α-helix	trans	-70.1	-10.7	172.8	0	0	0	0	0	114.4	A556 A558 S563	A556-A560 VanDerWaalsContact O-CB 3.28Å; A556-A560 WeakPolarHBondContact O-CB 3.21Å; A556-A560 PolarHBondContact O-N 2.72Å; A558-A560 VanDerWaalsContact C-N 3.32Å; A558-A560 PolarHBondContact O-N 2.95Å; A560-S563 PolarHBondContact O-OG 2.85Å
561	C	46.2	Very low	54	Low	91 Å²	91	116.9 Å²	116.9	62%	0.615	64%	0.644	S	S	*	*	H	α-helix	trans	-104.2	-31	173.3	-73.1	0	0	0	0	113.2	K557 A558 L559 S563 L564	K557-C561 PolarHBondContact O-N 3.31Å; K557-C561 PolarHBondContact O-SG 3.12Å; K557-C561 VanDerWaalsContact O-SG 3.33Å; A558-C561 CarbonylContact O-C 3.5Å; A558-C561 PolarHBondContact O-N 3.05Å; L559-C561 PolarHBondContact O-N 3.45Å; C561-S563 VanDerWaalsContact C-N 3.25Å; C561-S563 PolarHBondContact O-N 3.42Å; C561-L564 PolarHBondContact O-N 2.89Å
562	S	38.4	Very low	51.7	Low	74 Å²	74	123.5 Å²	123.5	52%	0.517	67%	0.673	S	S	.	*	H	α-helix	trans	-67.3	-26.5	177.4	50.8	0	0	0	0	113.1	A558 L559 L564 Q565	A558-S562 PolarHBondContact O-N 3.46Å; A558-S562 PolarHBondContact O-OG 2.96Å; L559-S562 WeakPolarHBondContact CA-OG 3.16Å; L559-S562 PolarHBondContact O-OG 3.31Å; L559-S562 VanDerWaalsContact O-OG 3.11Å; S562-L564 PolarHBondContact O-N 2.83Å; S562-L564 VanDerWaalsContact O-N 3.1Å; S562-Q565 PolarHBondContact O-N 3.04Å
563	S	37.5	Very low	49.3	Very low	85 Å²	85	125.5 Å²	125.5	59%	0.594	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.4	-13.5	175.5	55.8	0	0	0	0	114.8	A560 C561	A560-S563 PolarHBondContact O-OG 2.85Å; C561-S563 VanDerWaalsContact C-N 3.25Å; C561-S563 PolarHBondContact O-N 3.42Å
564	L	44.7	Very low	47.2	Very low	156 Å²	156	125.9 Å²	125.9	82%	0.817	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-1	-176.6	-122.6	172.3	0	0	0	114.5	C561 S562	C561-L564 PolarHBondContact O-N 2.89Å; S562-L564 PolarHBondContact O-N 2.83Å; S562-L564 VanDerWaalsContact O-N 3.1Å
565	Q	41.9	Very low	45.6	Very low	172 Å²	172	124 Å²	124	80%	0.804	70%	0.704	S	S	*	*	S	Bend	trans	-112.9	-9.5	-177.4	-167.9	52.4	86.5	0	0	114.3	S562	S562-Q565 PolarHBondContact O-N 3.04Å
566	E	38	Very low	43.8	Very low	182 Å²	182	126.9 Å²	126.9	85%	0.85	72%	0.719	S	S	*	*			trans	-135.5	77.9	-175.1	-165.4	160.6	-136.6	0	0	113.1
567	R	39.6	Very low	42.3	Very low	241 Å²	241	132.4 Å²	132.4	91%	0.909	73%	0.734	S	S	*	*			trans	-144.3	80.5	155.6	-168	174.5	-69.5	-175.8	-1.4	111.8
568	A	37.8	Very low	41.3	Very low	82 Å²	82	130.4 Å²	130.4	68%	0.678	73%	0.734	S	S	*	*	S	Bend	trans	-118.9	119.4	153.6	0	0	0	0	0	108.3
569	N	35.3	Very low	40.3	Very low	156 Å²	156	133.9 Å²	133.9	83%	0.834	75%	0.745	S	S	*	*	S	Bend	trans	82.7	160.5	175.4	-45.8	-50.3	0	0	0	118.1
570	A	33.5	Very low	39.1	Very low	103 Å²	103	135.9 Å²	135.9	85%	0.851	75%	0.749	S	S	*	*			trans	72.3	119.5	179	0	0	0	0	0	117.5
571	N	38.4	Very low	38.4	Very low	158 Å²	158	138.1 Å²	138.1	85%	0.845	76%	0.758	S	S	*	*			trans	-93.9	141.6	168.1	-53.9	-83.7	0	0	0	109.6
572	L	37.9	Very low	37.9	Very low	185 Å²	185	139.3 Å²	139.3	97%	0.969	76%	0.763	S	S	*	*			trans	-161.1	166.4	131.1	-132.8	70	0	0	0	110.8
573	D	35.5	Very low	37.8	Very low	138 Å²	138	140.6 Å²	140.6	74%	0.738	77%	0.769	S	S	*	*			trans	-107.9	124	-165.9	170.1	36.3	0	0	0	112.6
574	V	38.3	Very low	38.3	Very low	119 Å²	119	142.1 Å²	142.1	72%	0.721	77%	0.765	S	S	*	*			trans	-156.9	129.4	152	179.4	0	0	0	0	108.6	L576	V574-L576 HydrophobicContact CG1-CG 4.31Å
575	P	45.6	Very low	38.4	Very low	113 Å²	113	139.8 Å²	139.8	73%	0.734	76%	0.757	S	S	*	*			trans	-89.6	112.3	172.2	32.8	-31.6	0	0	0	112.4
576	L	36.4	Very low	39.2	Very low	157 Å²	157	134.2 Å²	134.2	82%	0.822	73%	0.731	S	S	*	*			trans	-135.4	67.3	165.9	-75.4	178.5	0	0	0	110.7	V574 V578	V574-L576 HydrophobicContact CG1-CG 4.31Å; L576-V578 PolarHBondContact O-N 3.08Å
577	Q	39.1	Very low	40.6	Very low	175 Å²	175	131.6 Å²	131.6	82%	0.818	72%	0.723	S	S	*	*			trans	-90	82.5	170.4	-174.3	172.3	-7.6	0	0	109.5
578	V	37.3	Very low	42.9	Very low	106 Å²	106	123 Å²	123	64%	0.642	70%	0.697	S	S	*	*			trans	-90.8	93.9	160.1	-176.9	0	0	0	0	106.2	L576 F580	L576-V578 PolarHBondContact O-N 3.08Å; V578-F580 HydrophobicContact CG1-CE2 4.28Å; V578-F580 WeakPolarHBondContact O-CD2 3.24Å; V578-F580 PolarHBondContact O-N 2.96Å
579	D	35.8	Very low	45.6	Very low	127 Å²	127	123.7 Å²	123.7	68%	0.679	69%	0.686	S	S	*	*			trans	-68.6	130.2	176.3	-153.1	-22.3	0	0	0	109	P581	D579-P581 WeakPolarHBondContact O-CD 3.35Å
580	F	30.2	Very low	48.4	Very low	164 Å²	164	120.8 Å²	120.8	72%	0.719	67%	0.666	S	S	*	*			trans	-95.1	104.5	-176	-92.7	-95.1	0	0	0	109	V578 T582	V578-F580 HydrophobicContact CG1-CE2 4.28Å; V578-F580 WeakPolarHBondContact O-CD2 3.24Å; V578-F580 PolarHBondContact O-N 2.96Å; F580-T582 VanDerWaalsContact C-N 3.33Å; F580-T582 PolarHBondContact O-N 3.3Å
581	P	39.4	Very low	51.4	Low	116 Å²	116	117.6 Å²	117.6	75%	0.753	63%	0.633	S	S	*	*			trans	-65.6	94.2	179.9	27.4	-35.2	0	0	0	109.6	D579 P583	D579-P581 WeakPolarHBondContact O-CD 3.35Å; P581-P583 VanDerWaalsContact O-CD 3.26Å; P581-P583 WeakPolarHBondContact O-CD 3.28Å
582	T	35.7	Very low	54.2	Low	117 Å²	117	115.8 Å²	115.8	72%	0.718	62%	0.619	S	S	*	*			trans	-58.6	120.8	179.7	-65.3	0	0	0	0	108.3	F580 K584	F580-T582 VanDerWaalsContact C-N 3.33Å; F580-T582 PolarHBondContact O-N 3.3Å; T582-K584 PolarHBondContact O-N 3.06Å
583	P	34.9	Very low	57	Low	101 Å²	101	107.4 Å²	107.4	66%	0.656	58%	0.576	S	S	*	*			trans	-63.6	93.3	-176	-26.2	36.4	0	0	0	112	P581 T585	P581-P583 VanDerWaalsContact O-CD 3.26Å; P581-P583 WeakPolarHBondContact O-CD 3.28Å; P583-T585 PolarHBondContact O-N 3.08Å
584	K	48.2	Very low	59.9	Low	116 Å²	116	102.8 Å²	102.8	50%	0.504	55%	0.549	S	S	.	.			trans	-71.1	94.8	175	-72.6	-172.5	-179.4	-177.4	0	108.9	T582 E586	T582-K584 PolarHBondContact O-N 3.06Å; K584-E586 HydrophobicContact CB-CB 4.28Å; K584-E586 PolarHBondContact O-N 2.86Å
585	T	47.4	Very low	62.7	Low	107 Å²	107	98.4 Å²	98.4	66%	0.656	52%	0.52	S	S	*	.			trans	-75.7	18.4	161.4	49	0	0	0	0	112.8	P583	P583-T585 PolarHBondContact O-N 3.08Å
586	E	58.7	Low	65.1	Low	56 Å²	56	93.8 Å²	93.8	26%	0.262	49%	0.489	S	S	.	.	S	Bend	trans	-64.7	145.2	163.5	-150.9	171.8	174.3	0	0	108.4	K584 V588 A634 D635 A636	K584-E586 HydrophobicContact CB-CB 4.28Å; K584-E586 PolarHBondContact O-N 2.86Å; E586-V588 HydrophobicContact CB-CG2 4.45Å; E586-V588 PolarHBondContact O-N 3.08Å; E586-A634 HydrophobicContact CG-CB 3.91Å; E586-A634 WeakPolarHBondContact OE1-CB 3.19Å; E586-D635 HydrophobicContact CG-CB 4.18Å; E586-D635 WeakPolarHBondContact OE1-CB 3.49Å; E586-D635 PolarHBondContact OE1-N 3.31Å; E586-A636 PolarHBondContact OE1-N 3.29Å
587	L	68.6	Low	67.9	Low	127 Å²	127	87 Å²	87	67%	0.665	46%	0.457	S	S	*	.			trans	-79.3	74.3	-178.4	-76	168.8	0	0	0	110.6	Q589	L587-Q589 PolarHBondContact O-N 2.86Å
588	V	86.8	Confident	70.6	Confident	61 Å²	61	82.1 Å²	82.1	37%	0.37	44%	0.435	S	S	.	.	P	Polyproline II helix	trans	-70.5	120	179.4	-173.3	0	0	0	0	110.6	E586 N632 V633 A634	E586-V588 HydrophobicContact CB-CG2 4.45Å; E586-V588 PolarHBondContact O-N 3.08Å; V588-N632 HydrophobicContact CG1-CB 3.6Å; V588-V633 WeakPolarHBondContact CA-O 3.41Å; V588-A634 HydrophobicContact CG2-CB 4.09Å
589	Q	93.6	Very high	73.5	Confident	96 Å²	96	79.3 Å²	79.3	45%	0.449	42%	0.416	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	116.9	167.7	-63.3	-178.6	80.1	0	0	108.8	L587 F591 N632 V633	L587-Q589 PolarHBondContact O-N 2.86Å; Q589-F591 HydrophobicContact CB-CD2 4.45Å; Q589-F591 HydrophobicContact CB-CE2 3.58Å; Q589-F591 HydrophobicContact CB-CZ 3.88Å; Q589-N632 CarbonylContact O-C 3.57Å; Q589-N632 WeakPolarHBondContact O-CA 3.28Å; Q589-V633 PolarHBondContact N-O 2.89Å; Q589-V633 PolarHBondContact O-N 3.12Å
590	K	95.1	Very high	76.4	Confident	94 Å²	94	77.6 Å²	77.6	41%	0.409	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.6	117.9	-179.6	-175.9	171	-179.6	173.7	0	109.7	N630 N632 E646	K590-N630 WeakPolarHBondContact CE-OD1 3.46Å; K590-N630 HydrophobicContact CG-CB 4.36Å; K590-N632 WeakPolarHBondContact CB-OD1 3.42Å; K590-N632 WeakPolarHBondContact CG-OD1 3.26Å; K590-E646 IonicContact NZ-OE1 3.99Å; K590-E646 PolarHBondContact NZ-OE1 2.83Å
591	F	96.6	Very high	79.6	Confident	36 Å²	36	70.5 Å²	70.5	16%	0.158	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.8	131.5	176.5	-57.6	-84.3	0	0	0	109.8	Q589 V593 N630 M631 V633 N694 V695 A698	Q589-F591 HydrophobicContact CB-CD2 4.45Å; Q589-F591 HydrophobicContact CB-CE2 3.58Å; Q589-F591 HydrophobicContact CB-CZ 3.88Å; F591-V593 HydrophobicContact CB-CG1 4.23Å; F591-N630 CarbonylContact O-C 3.5Å; F591-N630 WeakPolarHBondContact O-CA 3.05Å; F591-M631 HydrophobicContact CB-CB 4.48Å; F591-M631 PolarHBondContact N-O 3.07Å; F591-M631 PolarHBondContact O-N 3.47Å; F591-V633 HydrophobicContact CD2-CG2 4.06Å; F591-V633 HydrophobicContact CE2-CB 4.29Å; F591-V633 HydrophobicContact CE2-CG2 3.92Å; F591-N694 HydrophobicContact CE1-CB 4.05Å; F591-V695 HydrophobicContact CB-CG2 4.11Å; F591-V695 HydrophobicContact CD1-CG2 3.91Å; F591-V695 HydrophobicContact CD2-CG2 4.49Å; F591-V695 HydrophobicContact CE1-CG2 4.48Å; F591-V695 HydrophobicContact CG-CG2 3.92Å; F591-A698 HydrophobicContact CE2-CB 3.62Å; F591-A698 HydrophobicContact CZ-CB 3.55Å
592	H	96.6	Very high	82.1	Confident	120 Å²	120	72.7 Å²	72.7	56%	0.556	39%	0.387	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-87.2	119.4	172.2	-54.6	80.7	0	0	0	107.5	N630 E643	H592-N630 PolarHBondContact CD2-OD1 3.35Å; H592-N630 PolarHBondContact NE2-OD1 3.37Å; H592-E643 IonicContact CD2-OE1 2.71Å
593	V	97.1	Very high	85	Confident	10 Å²	10	71.8 Å²	71.8	6%	0.061	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	163.2	-176.6	-59.1	0	0	0	0	109.3	F591 V629 M631 F686 W687 C688 V695	F591-V593 HydrophobicContact CB-CG1 4.23Å; V593-V629 HydrophobicContact CG2-CG2 3.62Å; V593-V629 PolarHBondContact N-O 3.11Å; V593-V629 WeakPolarHBondContact O-CG2 3.39Å; V593-V629 PolarHBondContact O-N 3.42Å; V593-M631 HydrophobicContact CG2-CB 4.04Å; V593-F686 HydrophobicContact CG2-CB 4.33Å; V593-F686 HydrophobicContact CG2-CD1 3.92Å; V593-F686 HydrophobicContact CG2-CG 4.47Å; V593-W687 WeakPolarHBondContact CB-O 3.33Å; V593-C688 HydrophobicContact CG1-CB 4.34Å; V593-C688 VanDerWaalsContact CG1-SG 3.6Å; V593-V695 HydrophobicContact CG1-CG2 4.26Å
594	Q	96.8	Very high	87.9	Confident	40 Å²	40	69.4 Å²	69.4	19%	0.187	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	136.5	170.1	-53.8	-177.6	-89.9	0	0	109.5	W626 L627 F686 W687	Q594-W626 HydrophobicContact CB-CB 3.95Å; Q594-W626 HydrophobicContact CB-CE3 4.2Å; Q594-L627 CarbonylContact C-O 3.47Å; Q594-L627 WeakPolarHBondContact CA-O 3.42Å; Q594-F686 CarbonylContact O-C 3.57Å; Q594-F686 VanDerWaalsContact O-CA 3.22Å; Q594-F686 WeakPolarHBondContact O-CA 3.3Å; Q594-W687 HydrophobicContact CB-CB 4.28Å; Q594-W687 PolarHBondContact N-O 3.06Å; Q594-W687 PolarHBondContact O-N 3.43Å
595	Y	97.1	Very high	90.1	Very high	28 Å²	28	67.8 Å²	67.8	11%	0.11	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	122.6	177.8	-178.2	-131.8	0	0	0	110.3	G597 L627 V651 H684 V685 F686	Y595-G597 WeakPolarHBondContact CE2-O 3.47Å; Y595-L627 PolarHBondContact N-O 3.14Å; Y595-L627 PolarHBondContact O-N 2.83Å; Y595-V651 HydrophobicContact CE2-CG2 4.4Å; Y595-H684 HydrophobicContact CE2-CB 4.22Å; Y595-H684 AromaticContact CZ-ND1 3.92Å; Y595-H684 PolarHBondContact OH-ND1 2.7Å; Y595-V685 WeakPolarHBondContact CD2-O 3.27Å; Y595-F686 AromaticContact CD2-CD1 3.75Å; Y595-F686 HydrophobicContact CD2-CD1 3.75Å; Y595-F686 AromaticContact CD2-CE1 3.35Å; Y595-F686 HydrophobicContact CD2-CE1 3.35Å; Y595-F686 AromaticContact CD2-CZ 3.91Å; Y595-F686 HydrophobicContact CD2-CZ 3.91Å; Y595-F686 AromaticContact CE2-CE1 3.88Å; Y595-F686 HydrophobicContact CE2-CE1 3.88Å; Y595-F686 AromaticContact CE2-CZ 3.97Å; Y595-F686 HydrophobicContact CE2-CZ 3.97Å; Y595-F686 HydrophobicContact CG-CD1 4.49Å; Y595-F686 HydrophobicContact CG-CE1 4.2Å
596	L	96.1	Very high	92.4	Very high	16 Å²	16	63.2 Å²	63.2	8%	0.084	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	-28.6	-179.8	-80	68.2	0	0	0	111.4	L617 M618 W626 V685 W687	L596-L617 HydrophobicContact CB-CB 4.37Å; L596-M618 HydrophobicContact CD2-CG 3.92Å; L596-M618 HydrophobicContact CD2-SD 3.49Å; L596-M618 WeakPolarHBondContact CD2-SD 3.44Å; L596-W626 HydrophobicContact CD1-CD2 3.63Å; L596-W626 HydrophobicContact CD1-CE3 3.73Å; L596-W626 HydrophobicContact CD1-CG 4.02Å; L596-W626 HydrophobicContact CD1-CZ2 4.44Å; L596-W626 HydrophobicContact CD1-CZ3 4.18Å; L596-W626 HydrophobicContact CD2-CD2 4.39Å; L596-W626 HydrophobicContact CD2-CH2 4.25Å; L596-W626 HydrophobicContact CD2-CZ2 3.82Å; L596-W626 HydrophobicContact CG-CD2 3.71Å; L596-W626 HydrophobicContact CG-CE3 4.26Å; L596-W626 HydrophobicContact CG-CG 3.98Å; L596-W626 HydrophobicContact CG-CZ2 4.05Å; L596-V685 HydrophobicContact CB-CB 4.27Å; L596-V685 HydrophobicContact CB-CG1 4.2Å; L596-V685 HydrophobicContact CD2-CG1 3.98Å; L596-V685 PolarHBondContact N-O 3.13Å; L596-W687 HydrophobicContact CD1-CB 3.79Å
597	G	95.4	Very high	94.3	Very high	14 Å²	14	64 Å²	64	14%	0.144	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	136.4	-163.9	177.7	0	0	0	0	0	113.6	Y595 V685	Y595-G597 WeakPolarHBondContact CE2-O 3.47Å; G597-V685 PolarHBondContact O-N 3.17Å
598	M	95.8	Very high	95.6	Very high	72 Å²	72	62.5 Å²	62.5	36%	0.355	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	139.1	178.2	177	-84.2	-75.3	0	0	109.2	P600 E682 C683	M598-P600 HydrophobicContact SD-CG 3.99Å; M598-E682 HydrophobicContact CE-CG 4.31Å; M598-E682 HydrophobicContact CG-CB 3.85Å; M598-E682 HydrophobicContact CG-CG 4.28Å; M598-E682 HydrophobicContact SD-CB 4.01Å; M598-E682 HydrophobicContact SD-CG 3.81Å; M598-C683 WeakPolarHBondContact CA-O 3.42Å
599	L	96.9	Very high	96.1	Very high	48 Å²	48	61 Å²	61	25%	0.251	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124	129.3	167.6	-166.2	73.5	0	0	0	109.9	A613 N616 L617 C683	L599-A613 HydrophobicContact CB-CB 4.23Å; L599-A613 HydrophobicContact CD2-CB 3.97Å; L599-N616 HydrophobicContact CD2-CB 4.06Å; L599-N616 WeakPolarHBondContact CD2-ND2 3.42Å; L599-L617 HydrophobicContact CB-CD1 4.35Å; L599-C683 PolarHBondContact N-O 3.11Å; L599-C683 WeakPolarHBondContact O-CB 3.48Å; L599-C683 PolarHBondContact O-N 2.95Å
600	P	96.7	Very high	96.3	Very high	90 Å²	90	56.5 Å²	56.5	58%	0.584	30%	0.298	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-63.6	142.3	169.4	-20.6	33.5	0	0	0	111	M598 F681	M598-P600 HydrophobicContact SD-CG 3.99Å; P600-F681 WeakPolarHBondContact CA-O 3.27Å
601	V	97.1	Very high	96.4	Very high	16 Å²	16	53 Å²	53	10%	0.097	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	143.1	-178.4	-64.5	0	0	0	0	112.5	K603 I609 A613 I673 F681 C683	V601-K603 VanDerWaalsContact C-N 3.26Å; V601-K603 PolarHBondContact O-N 3.31Å; V601-I609 HydrophobicContact CB-CG2 3.61Å; V601-I609 HydrophobicContact CG1-CG2 3.73Å; V601-I609 HydrophobicContact CG2-CG2 4.12Å; V601-A613 HydrophobicContact CG1-CB 4.34Å; V601-I673 HydrophobicContact CG2-CD1 4.25Å; V601-I673 HydrophobicContact CG2-CG1 4.44Å; V601-I673 HydrophobicContact CG2-CG2 3.73Å; V601-F681 HydrophobicContact CG2-CB 3.81Å; V601-F681 PolarHBondContact N-O 2.78Å; V601-C683 HydrophobicContact CG1-CB 3.84Å; V601-C683 HydrophobicContact CG2-CB 4.25Å
602	D	93.5	Very high	96.5	Very high	161 Å²	161	53.9 Å²	53.9	86%	0.861	29%	0.294	S	S	*	.	S	Bend	trans	-75.7	-8.9	-173.4	-56.8	-46.3	0	0	0	114.5
603	K	96	Very high	96.5	Very high	98 Å²	98	48.2 Å²	48.2	43%	0.426	27%	0.268	S	S	.	.			trans	-135.7	143.5	-175	-54.8	-178	-162	158.9	0	111.2	V601 V605 D608 I609	V601-K603 VanDerWaalsContact C-N 3.26Å; V601-K603 PolarHBondContact O-N 3.31Å; K603-V605 VanDerWaalsContact C-N 3.29Å; K603-V605 PolarHBondContact O-N 3.42Å; K603-D608 IonicContact NZ-OD2 3.53Å; K603-I609 HydrophobicContact CB-CG1 4.25Å; K603-I609 HydrophobicContact CD-CD1 4Å; K603-I609 HydrophobicContact CD-CG1 3.94Å; K603-I609 HydrophobicContact CG-CD1 4.42Å; K603-I609 HydrophobicContact CG-CG1 4.39Å
604	P	95	Very high	96.5	Very high	52 Å²	52	48.1 Å²	48.1	34%	0.338	27%	0.267	S	S	.	.	S	Bend	trans	-71.7	-20.9	176.2	28.4	-34.6	0	0	0	113.7	S659 F660 F681	P604-S659 WeakPolarHBondContact O-CB 3.2Å; P604-S659 PolarHBondContact O-OG 2.67Å; P604-F660 WeakPolarHBondContact O-CB 3.43Å; P604-F681 HydrophobicContact CB-CD1 3.88Å; P604-F681 HydrophobicContact CB-CD2 4.49Å; P604-F681 HydrophobicContact CB-CE1 3.67Å; P604-F681 HydrophobicContact CB-CE2 4.3Å; P604-F681 HydrophobicContact CB-CG 4.3Å; P604-F681 HydrophobicContact CB-CZ 3.89Å; P604-F681 HydrophobicContact CG-CE1 4.41Å; P604-F681 HydrophobicContact CG-CE2 4.38Å; P604-F681 HydrophobicContact CG-CZ 4.13Å
605	V	95.9	Very high	96.5	Very high	81 Å²	81	50.1 Å²	50.1	49%	0.491	28%	0.277	S	S	.	.			trans	-143.3	136.5	-170.3	179	0	0	0	0	109.2	K603 F660	K603-V605 VanDerWaalsContact C-N 3.29Å; K603-V605 PolarHBondContact O-N 3.42Å; V605-F660 HydrophobicContact CB-CB 4.49Å; V605-F660 HydrophobicContact CG1-CD2 3.81Å; V605-F660 HydrophobicContact CG1-CE2 4.14Å; V605-F660 HydrophobicContact CG1-CG 4.25Å; V605-F660 HydrophobicContact CG2-CB 4.28Å
606	G	96.1	Very high	96.5	Very high	11 Å²	11	52.8 Å²	52.8	11%	0.113	29%	0.293	C	S	.	.			trans	158.9	125.3	173.3	0	0	0	0	0	111.9	D608 I609 L610 F660	G606-D608 VanDerWaalsContact C-N 3.29Å; G606-D608 VanDerWaalsContact C-OD1 3.25Å; G606-D608 WeakPolarHBondContact CA-OD1 3.17Å; G606-I609 PolarHBondContact O-N 3.29Å; G606-L610 WeakPolarHBondContact O-CB 3.19Å; G606-L610 PolarHBondContact O-N 3.47Å; G606-F660 WeakPolarHBondContact O-CE1 3.46Å
607	M	96.9	Very high	96.5	Very high	73 Å²	73	52.8 Å²	52.8	36%	0.36	29%	0.293	S	S	.	.	H	α-helix	trans	-75.9	-23.7	175.3	-159.6	64.6	-156.4	0	0	111.9	L610 N611 F660 V663	M607-L610 HydrophobicContact CE-CD2 3.63Å; M607-L610 HydrophobicContact SD-CD2 4.12Å; M607-N611 WeakPolarHBondContact O-CB 3.42Å; M607-N611 PolarHBondContact O-N 3.46Å; M607-N611 VanDerWaalsContact O-N 3.12Å; M607-N611 PolarHBondContact O-ND2 3.06Å; M607-F660 HydrophobicContact CB-CZ 4.38Å; M607-F660 HydrophobicContact SD-CE1 4.04Å; M607-F660 HydrophobicContact SD-CZ 4.06Å; M607-V663 WeakPolarHBondContact CE-O 3.47Å
608	D	97	Very high	96.3	Very high	96 Å²	96	55.5 Å²	55.5	51%	0.513	30%	0.303	S	S	.	.	H	α-helix	trans	-60.8	-52.2	163.9	56.8	-40.5	0	0	0	111.1	K603 G606 S612	K603-D608 IonicContact NZ-OD2 3.53Å; G606-D608 VanDerWaalsContact C-N 3.29Å; G606-D608 VanDerWaalsContact C-OD1 3.25Å; G606-D608 WeakPolarHBondContact CA-OD1 3.17Å; D608-S612 WeakPolarHBondContact O-CB 3.38Å; D608-S612 PolarHBondContact O-N 3.16Å
609	I	97.2	Very high	96.2	Very high	30 Å²	30	58 Å²	58	15%	0.154	32%	0.322	C	S	.	.	H	α-helix	trans	-63.5	-47.4	-179.1	-57.3	-58.1	0	0	0	111.1	V601 K603 G606 S612 A613 I673	V601-I609 HydrophobicContact CB-CG2 3.61Å; V601-I609 HydrophobicContact CG1-CG2 3.73Å; V601-I609 HydrophobicContact CG2-CG2 4.12Å; K603-I609 HydrophobicContact CB-CG1 4.25Å; K603-I609 HydrophobicContact CD-CD1 4Å; K603-I609 HydrophobicContact CD-CG1 3.94Å; K603-I609 HydrophobicContact CG-CD1 4.42Å; K603-I609 HydrophobicContact CG-CG1 4.39Å; G606-I609 PolarHBondContact O-N 3.29Å; I609-S612 PolarHBondContact O-N 3.33Å; I609-A613 PolarHBondContact O-N 3.3Å; I609-I673 HydrophobicContact CG2-CD1 4.23Å
610	L	97.8	Very high	95.9	Very high	0 Å²	0	60 Å²	60	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-64.6	-44.6	-179.3	-176.8	147.2	0	0	0	112	G606 M607 A613 I614 F660 A671	G606-L610 WeakPolarHBondContact O-CB 3.19Å; G606-L610 PolarHBondContact O-N 3.47Å; M607-L610 HydrophobicContact CE-CD2 3.63Å; M607-L610 HydrophobicContact SD-CD2 4.12Å; L610-A613 PolarHBondContact O-N 2.89Å; L610-I614 HydrophobicContact CD2-CD1 3.63Å; L610-I614 WeakPolarHBondContact O-CG1 3.46Å; L610-I614 PolarHBondContact O-N 2.7Å; L610-I614 VanDerWaalsContact O-N 3.1Å; L610-F660 HydrophobicContact CB-CD1 4.28Å; L610-F660 HydrophobicContact CB-CE1 4.08Å; L610-F660 HydrophobicContact CD1-CD1 3.75Å; L610-F660 HydrophobicContact CD1-CE1 3.85Å; L610-A671 HydrophobicContact CD1-CB 3.96Å; L610-A671 HydrophobicContact CD2-CB 4.05Å; L610-A671 HydrophobicContact CG-CB 3.83Å
611	N	97.6	Very high	95.6	Very high	20 Å²	20	56.8 Å²	56.8	11%	0.107	32%	0.32	C	S	.	.	H	α-helix	trans	-66.6	-37.1	175	-78.6	-59.9	0	0	0	112.4	M607 A613 I614 E615 G664 K665	M607-N611 WeakPolarHBondContact O-CB 3.42Å; M607-N611 PolarHBondContact O-N 3.46Å; M607-N611 VanDerWaalsContact O-N 3.12Å; M607-N611 PolarHBondContact O-ND2 3.06Å; N611-A613 VanDerWaalsContact C-N 3.31Å; N611-A613 PolarHBondContact O-N 3.08Å; N611-I614 PolarHBondContact O-N 3.4Å; N611-E615 WeakPolarHBondContact O-CB 3.41Å; N611-E615 WeakPolarHBondContact O-CG 3.25Å; N611-E615 PolarHBondContact O-N 2.84Å; N611-G664 WeakPolarHBondContact OD1-CA 2.93Å; N611-K665 PolarHBondContact OD1-N 2.8Å
612	S	97.5	Very high	95.1	Very high	56 Å²	56	61 Å²	61	39%	0.392	34%	0.342	S	S	.	.	H	α-helix	trans	-62.6	-38.8	175.6	-177.2	0	0	0	0	111.8	D608 I609 E615 N616	D608-S612 WeakPolarHBondContact O-CB 3.38Å; D608-S612 PolarHBondContact O-N 3.16Å; I609-S612 PolarHBondContact O-N 3.33Å; S612-E615 PolarHBondContact O-N 2.84Å; S612-N616 WeakPolarHBondContact O-CB 3.4Å; S612-N616 PolarHBondContact O-N 2.91Å; S612-N616 PolarHBondContact O-ND2 2.84Å
613	A	97.5	Very high	94.7	Very high	1 Å²	1	57.2 Å²	57.2	1%	0.008	32%	0.318	C	S	.	.	H	α-helix	trans	-64.6	-41.1	174	0	0	0	0	0	112.8	L599 V601 I609 L610 N611 L617 C683	L599-A613 HydrophobicContact CB-CB 4.23Å; L599-A613 HydrophobicContact CD2-CB 3.97Å; V601-A613 HydrophobicContact CG1-CB 4.34Å; I609-A613 PolarHBondContact O-N 3.3Å; L610-A613 PolarHBondContact O-N 2.89Å; N611-A613 VanDerWaalsContact C-N 3.31Å; N611-A613 PolarHBondContact O-N 3.08Å; A613-L617 PolarHBondContact O-N 3.1Å; A613-C683 HydrophobicContact CB-CB 3.9Å
614	I	97.1	Very high	94.3	Very high	8 Å²	8	60.4 Å²	60.4	4%	0.041	33%	0.334	C	S	.	.	H	α-helix	trans	-61.9	-50.7	173.9	-64.9	169.5	0	0	0	110.6	L610 N611 N616 L617 M618 T669 A671 V685	L610-I614 HydrophobicContact CD2-CD1 3.63Å; L610-I614 WeakPolarHBondContact O-CG1 3.46Å; L610-I614 PolarHBondContact O-N 2.7Å; L610-I614 VanDerWaalsContact O-N 3.1Å; N611-I614 PolarHBondContact O-N 3.4Å; I614-N616 PolarHBondContact O-N 3.12Å; I614-L617 PolarHBondContact O-N 3.44Å; I614-M618 HydrophobicContact CG2-CG 3.94Å; I614-M618 VanDerWaalsContact O-CB 3.29Å; I614-M618 WeakPolarHBondContact O-CB 3.37Å; I614-M618 WeakPolarHBondContact O-CG 3.26Å; I614-M618 PolarHBondContact O-N 2.84Å; I614-T669 HydrophobicContact CG2-CG2 3.95Å; I614-A671 HydrophobicContact CD1-CB 4.02Å; I614-A671 HydrophobicContact CG1-CB 4.1Å; I614-V685 HydrophobicContact CB-CG1 4.37Å; I614-V685 HydrophobicContact CG1-CG1 3.8Å; I614-V685 HydrophobicContact CG1-CG2 3.89Å; I614-V685 HydrophobicContact CG2-CG1 4.38Å
615	E	96.4	Very high	94	Very high	82 Å²	82	62.7 Å²	62.7	38%	0.383	34%	0.343	S	S	.	.	H	α-helix	trans	-62.1	-40.3	-177.7	-76.2	167	-160.5	0	0	112.5	N611 S612 T619 K665	N611-E615 WeakPolarHBondContact O-CB 3.41Å; N611-E615 WeakPolarHBondContact O-CG 3.25Å; N611-E615 PolarHBondContact O-N 2.84Å; S612-E615 PolarHBondContact O-N 2.84Å; E615-T619 WeakPolarHBondContact O-CB 3.37Å; E615-T619 PolarHBondContact O-N 3.17Å; E615-T619 PolarHBondContact O-OG1 2.85Å; E615-K665 VanDerWaalsContact OE1-CD 3.32Å; E615-K665 WeakPolarHBondContact OE1-CD 3.08Å; E615-K665 WeakPolarHBondContact OE1-CE 3.26Å; E615-K665 IonicContact OE1-NZ 3.86Å; E615-K665 PolarHBondContact OE1-NZ 2.84Å; E615-K665 IonicContact OE2-NZ 3.78Å
616	N	96.3	Very high	93.9	Very high	83 Å²	83	59.9 Å²	59.9	44%	0.444	32%	0.324	S	S	.	.	H	α-helix	trans	-60.8	-50.1	174.3	-73.7	-31.6	0	0	0	111.7	L599 S612 I614 T619 S620	L599-N616 HydrophobicContact CD2-CB 4.06Å; L599-N616 WeakPolarHBondContact CD2-ND2 3.42Å; S612-N616 WeakPolarHBondContact O-CB 3.4Å; S612-N616 PolarHBondContact O-N 2.91Å; S612-N616 PolarHBondContact O-ND2 2.84Å; I614-N616 PolarHBondContact O-N 3.12Å; N616-T619 PolarHBondContact O-N 3.26Å; N616-S620 PolarHBondContact O-N 3.08Å; N616-S620 PolarHBondContact O-OG 2.9Å
617	L	95.8	Very high	93.8	Very high	17 Å²	17	62.9 Å²	62.9	9%	0.089	34%	0.337	C	S	.	.	H	α-helix	trans	-69.5	-38.6	-177.6	-72.2	169.6	0	0	0	112.8	L596 L599 A613 I614 T619 S620 S621 V685	L596-L617 HydrophobicContact CB-CB 4.37Å; L599-L617 HydrophobicContact CB-CD1 4.35Å; A613-L617 PolarHBondContact O-N 3.1Å; I614-L617 PolarHBondContact O-N 3.44Å; L617-T619 PolarHBondContact O-N 2.93Å; L617-S620 WeakPolarHBondContact CA-OG 3.48Å; L617-S620 PolarHBondContact O-N 2.81Å; L617-S620 PolarHBondContact O-OG 2.91Å; L617-S621 PolarHBondContact O-N 2.83Å; L617-S621 PolarHBondContact O-OG 3.27Å; L617-V685 HydrophobicContact CD1-CB 3.86Å; L617-V685 HydrophobicContact CD1-CG2 3.67Å
618	M	93.1	Very high	93.7	Very high	71 Å²	71	61.7 Å²	61.7	35%	0.35	34%	0.336	S	S	.	.	H	α-helix	trans	-62.7	-26.2	171.8	-72.5	-76.9	-66.8	0	0	112.8	L596 I614 W626 T669 W687	L596-M618 HydrophobicContact CD2-CG 3.92Å; L596-M618 HydrophobicContact CD2-SD 3.49Å; L596-M618 WeakPolarHBondContact CD2-SD 3.44Å; I614-M618 HydrophobicContact CG2-CG 3.94Å; I614-M618 VanDerWaalsContact O-CB 3.29Å; I614-M618 WeakPolarHBondContact O-CB 3.37Å; I614-M618 WeakPolarHBondContact O-CG 3.26Å; I614-M618 PolarHBondContact O-N 2.84Å; M618-W626 HydrophobicContact CE-CH2 4.18Å; M618-W626 HydrophobicContact CE-CZ2 4.44Å; M618-W626 HydrophobicContact SD-CH2 3.61Å; M618-W626 HydrophobicContact SD-CZ2 3.61Å; M618-T669 HydrophobicContact SD-CG2 4.48Å; M618-W687 HydrophobicContact CE-CE3 4.46Å; M618-W687 HydrophobicContact CE-CZ3 3.98Å; M618-W687 HydrophobicContact SD-CE3 4.31Å; M618-W687 HydrophobicContact SD-CZ3 4.4Å
619	T	92.9	Very high	93.8	Very high	124 Å²	124	57.1 Å²	57.1	76%	0.761	31%	0.312	S	S	*	.	H	α-helix	trans	-88.9	-26.6	177.4	-53.5	0	0	0	0	112.1	E615 N616 L617	E615-T619 WeakPolarHBondContact O-CB 3.37Å; E615-T619 PolarHBondContact O-N 3.17Å; E615-T619 PolarHBondContact O-OG1 2.85Å; N616-T619 PolarHBondContact O-N 3.26Å; L617-T619 PolarHBondContact O-N 2.93Å
620	S	90.4	Very high	93.7	Very high	91 Å²	91	55.9 Å²	55.9	64%	0.636	31%	0.305	S	S	*	.	H	α-helix	trans	-91.5	-8.8	-178.1	66.6	0	0	0	0	115.2	N616 L617	N616-S620 PolarHBondContact O-N 3.08Å; N616-S620 PolarHBondContact O-OG 2.9Å; L617-S620 WeakPolarHBondContact CA-OG 3.48Å; L617-S620 PolarHBondContact O-N 2.81Å; L617-S620 PolarHBondContact O-OG 2.91Å
621	S	89.4	Confident	93.7	Very high	22 Å²	22	55.9 Å²	55.9	15%	0.154	31%	0.305	C	S	.	.	S	Bend	trans	-142.3	140.1	-175.3	63.2	0	0	0	0	111.9	L617 W626	L617-S621 PolarHBondContact O-N 2.83Å; L617-S621 PolarHBondContact O-OG 3.27Å; S621-W626 PolarHBondContact OG-NE1 3.31Å
622	N	87.9	Confident	93.6	Very high	105 Å²	105	55.9 Å²	55.9	56%	0.561	31%	0.305	S	S	*	.			trans	-87.6	159.8	177.3	-45	-85.3	0	0	0	110	E624 D625 W626	N622-E624 VanDerWaalsContact CB-OE2 3.26Å; N622-E624 WeakPolarHBondContact CB-OE2 3.47Å; N622-E624 PolarHBondContact O-N 2.75Å; N622-E624 VanDerWaalsContact O-N 3.11Å; N622-D625 WeakPolarHBondContact CB-OD2 3.48Å; N622-D625 PolarHBondContact N-OD2 2.82Å; N622-D625 PolarHBondContact ND2-OD2 2.79Å; N622-D625 WeakPolarHBondContact O-CB 3.32Å; N622-D625 PolarHBondContact O-N 2.78Å; N622-W626 PolarHBondContact O-NE1 2.82Å; N622-W626 VanDerWaalsContact O-NE1 3.15Å
623	K	85.2	Confident	93.6	Very high	81 Å²	81	53.3 Å²	53.3	35%	0.352	29%	0.287	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.1	-20.2	-177.2	-176.2	158.1	-175.4	171.8	0	113	W626 E689	K623-W626 HydrophobicContact CB-CD2 4.35Å; K623-W626 HydrophobicContact CB-CE3 4.16Å; K623-W626 HydrophobicContact CB-CH2 4.1Å; K623-W626 HydrophobicContact CB-CZ2 4.27Å; K623-W626 HydrophobicContact CB-CZ3 4.04Å; K623-W626 HydrophobicContact CD-CE3 4.25Å; K623-W626 HydrophobicContact CD-CH2 4.24Å; K623-W626 HydrophobicContact CD-CZ3 3.71Å; K623-W626 HydrophobicContact CG-CD2 4.33Å; K623-W626 HydrophobicContact CG-CE3 3.71Å; K623-W626 HydrophobicContact CG-CH2 4.17Å; K623-W626 HydrophobicContact CG-CZ3 3.62Å; K623-E689 IonicContact NZ-OE1 3.76Å; K623-E689 PolarHBondContact NZ-OE1 2.9Å
624	E	87.4	Confident	93.4	Very high	165 Å²	165	53.5 Å²	53.5	77%	0.771	29%	0.289	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-25.9	173.3	-61.4	71.1	-158.1	0	0	113.3	N622	N622-E624 VanDerWaalsContact CB-OE2 3.26Å; N622-E624 WeakPolarHBondContact CB-OE2 3.47Å; N622-E624 PolarHBondContact O-N 2.75Å; N622-E624 VanDerWaalsContact O-N 3.11Å
625	D	88.9	Confident	92.9	Very high	99 Å²	99	55.4 Å²	55.4	53%	0.529	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.1	-17.4	-177.6	-58.8	-52.6	0	0	0	112.7	N622	N622-D625 WeakPolarHBondContact CB-OD2 3.48Å; N622-D625 PolarHBondContact N-OD2 2.82Å; N622-D625 PolarHBondContact ND2-OD2 2.79Å; N622-D625 WeakPolarHBondContact O-CB 3.32Å; N622-D625 PolarHBondContact O-N 2.78Å
626	W	94.1	Very high	92.6	Very high	22 Å²	22	53.2 Å²	53.2	8%	0.083	30%	0.295	C	S	.	.	S	Bend	trans	-70.4	130	-174.6	-56.1	-14.4	0	0	0	112	Q594 L596 M618 S621 N622 K623 S628 W687	Q594-W626 HydrophobicContact CB-CB 3.95Å; Q594-W626 HydrophobicContact CB-CE3 4.2Å; L596-W626 HydrophobicContact CD1-CD2 3.63Å; L596-W626 HydrophobicContact CD1-CE3 3.73Å; L596-W626 HydrophobicContact CD1-CG 4.02Å; L596-W626 HydrophobicContact CD1-CZ2 4.44Å; L596-W626 HydrophobicContact CD1-CZ3 4.18Å; L596-W626 HydrophobicContact CD2-CD2 4.39Å; L596-W626 HydrophobicContact CD2-CH2 4.25Å; L596-W626 HydrophobicContact CD2-CZ2 3.82Å; L596-W626 HydrophobicContact CG-CD2 3.71Å; L596-W626 HydrophobicContact CG-CE3 4.26Å; L596-W626 HydrophobicContact CG-CG 3.98Å; L596-W626 HydrophobicContact CG-CZ2 4.05Å; M618-W626 HydrophobicContact CE-CH2 4.18Å; M618-W626 HydrophobicContact CE-CZ2 4.44Å; M618-W626 HydrophobicContact SD-CH2 3.61Å; M618-W626 HydrophobicContact SD-CZ2 3.61Å; S621-W626 PolarHBondContact OG-NE1 3.31Å; N622-W626 PolarHBondContact O-NE1 2.82Å; N622-W626 VanDerWaalsContact O-NE1 3.15Å; K623-W626 HydrophobicContact CB-CD2 4.35Å; K623-W626 HydrophobicContact CB-CE3 4.16Å; K623-W626 HydrophobicContact CB-CH2 4.1Å; K623-W626 HydrophobicContact CB-CZ2 4.27Å; K623-W626 HydrophobicContact CB-CZ3 4.04Å; K623-W626 HydrophobicContact CD-CE3 4.25Å; K623-W626 HydrophobicContact CD-CH2 4.24Å; K623-W626 HydrophobicContact CD-CZ3 3.71Å; K623-W626 HydrophobicContact CG-CD2 4.33Å; K623-W626 HydrophobicContact CG-CE3 3.71Å; K623-W626 HydrophobicContact CG-CH2 4.17Å; K623-W626 HydrophobicContact CG-CZ3 3.62Å; W626-S628 PolarHBondContact O-N 2.88Å; W626-W687 HydrophobicContact CE3-CB 3.95Å; W626-W687 HydrophobicContact CE3-CG 4.26Å; W626-W687 HydrophobicContact CH2-CD2 4.22Å; W626-W687 AromaticContact CH2-CE3 3.83Å; W626-W687 HydrophobicContact CH2-CE3 3.83Å; W626-W687 HydrophobicContact CH2-CZ3 4.43Å; W626-W687 HydrophobicContact CZ3-CB 3.7Å; W626-W687 AromaticContact CZ3-CD2 3.67Å; W626-W687 HydrophobicContact CZ3-CD2 3.67Å; W626-W687 AromaticContact CZ3-CE3 3.78Å; W626-W687 HydrophobicContact CZ3-CE3 3.78Å; W626-W687 AromaticContact CZ3-CG 3.64Å; W626-W687 HydrophobicContact CZ3-CG 3.64Å
627	L	93.6	Very high	92.5	Very high	74 Å²	74	49.9 Å²	49.9	39%	0.387	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.8	125.1	-177.3	-74	75.2	0	0	0	110.1	Q594 Y595 V629 L650	Q594-L627 CarbonylContact C-O 3.47Å; Q594-L627 WeakPolarHBondContact CA-O 3.42Å; Y595-L627 PolarHBondContact N-O 3.14Å; Y595-L627 PolarHBondContact O-N 2.83Å; L627-V629 HydrophobicContact CB-CG1 4.1Å; L627-V629 PolarHBondContact O-N 3.14Å; L627-L650 HydrophobicContact CD2-CD1 4.2Å
628	S	95.5	Very high	92.6	Very high	48 Å²	48	49.1 Å²	49.1	34%	0.336	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.5	126	165.6	-51.4	0	0	0	0	110.2	W626 E643	W626-S628 PolarHBondContact O-N 2.88Å; S628-E643 WeakPolarHBondContact CB-OE2 3.38Å; S628-E643 VanDerWaalsContact O-CB 3.27Å; S628-E643 WeakPolarHBondContact O-CB 3.32Å; S628-E643 PolarHBondContact O-N 3.1Å; S628-E643 VanDerWaalsContact O-N 3.13Å
629	V	97.3	Very high	92.8	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.006	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	157.6	-173.4	-61.2	0	0	0	0	112.3	V593 L627 V640 I641 L650	V593-V629 HydrophobicContact CG2-CG2 3.62Å; V593-V629 PolarHBondContact N-O 3.11Å; V593-V629 WeakPolarHBondContact O-CG2 3.39Å; V593-V629 PolarHBondContact O-N 3.42Å; L627-V629 HydrophobicContact CB-CG1 4.1Å; L627-V629 PolarHBondContact O-N 3.14Å; V629-V640 HydrophobicContact CB-CG1 3.71Å; V629-V640 HydrophobicContact CG1-CG1 4.05Å; V629-V640 HydrophobicContact CG2-CG1 3.62Å; V629-I641 CarbonylContact C-O 3.58Å; V629-I641 WeakPolarHBondContact CA-O 3.44Å; V629-I641 WeakPolarHBondContact CB-O 3.45Å; V629-L650 HydrophobicContact CG1-CD1 3.47Å; V629-L650 VanDerWaalsContact CG1-CD1 3.47Å
630	N	96.3	Very high	93	Very high	4 Å²	4	40.8 Å²	40.8	2%	0.021	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	105.2	173.4	-73.7	-68	0	0	0	110.1	K590 F591 H592 N632 I641	K590-N630 WeakPolarHBondContact CE-OD1 3.46Å; K590-N630 HydrophobicContact CG-CB 4.36Å; F591-N630 CarbonylContact O-C 3.5Å; F591-N630 WeakPolarHBondContact O-CA 3.05Å; H592-N630 PolarHBondContact CD2-OD1 3.35Å; H592-N630 PolarHBondContact NE2-OD1 3.37Å; N630-N632 PolarHBondContact O-ND2 2.88Å; N630-I641 PolarHBondContact N-O 2.86Å; N630-I641 PolarHBondContact O-N 3.17Å
631	M	97.3	Very high	93.2	Very high	0 Å²	0	37.9 Å²	37.9	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	113.3	169.2	-175.2	179.9	-66.3	0	0	109.6	F591 V593 V633 V638 V640 F670 F672 F686 V695	F591-M631 HydrophobicContact CB-CB 4.48Å; F591-M631 PolarHBondContact N-O 3.07Å; F591-M631 PolarHBondContact O-N 3.47Å; V593-M631 HydrophobicContact CG2-CB 4.04Å; M631-V633 HydrophobicContact CG-CG2 4.14Å; M631-V633 HydrophobicContact SD-CG2 4.29Å; M631-V638 HydrophobicContact CG-CG1 3.72Å; M631-V638 HydrophobicContact SD-CG1 3.97Å; M631-V640 HydrophobicContact CE-CG2 4.36Å; M631-V640 HydrophobicContact CG-CG2 4.48Å; M631-F670 HydrophobicContact CE-CD1 4.12Å; M631-F670 HydrophobicContact CE-CE1 4.16Å; M631-F670 HydrophobicContact SD-CD1 4.48Å; M631-F670 HydrophobicContact SD-CE1 4.18Å; M631-F672 HydrophobicContact CE-CE1 4.33Å; M631-F686 HydrophobicContact CE-CB 4.44Å; M631-F686 HydrophobicContact CE-CD1 3.57Å; M631-F686 HydrophobicContact CE-CD2 3.52Å; M631-F686 HydrophobicContact CE-CE1 3.57Å; M631-F686 HydrophobicContact CE-CE2 3.54Å; M631-F686 HydrophobicContact CE-CG 3.55Å; M631-F686 HydrophobicContact CE-CZ 3.56Å; M631-V695 HydrophobicContact CE-CG1 4.45Å; M631-V695 HydrophobicContact SD-CG1 3.56Å; M631-V695 VanDerWaalsContact SD-CG1 3.56Å
632	N	96.4	Very high	93.3	Very high	19 Å²	19	37 Å²	37	10%	0.102	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	108.2	-180	-70.7	-69.1	0	0	0	109.2	V588 Q589 K590 N630 V638 T639	V588-N632 HydrophobicContact CG1-CB 3.6Å; Q589-N632 CarbonylContact O-C 3.57Å; Q589-N632 WeakPolarHBondContact O-CA 3.28Å; K590-N632 WeakPolarHBondContact CB-OD1 3.42Å; K590-N632 WeakPolarHBondContact CG-OD1 3.26Å; N630-N632 PolarHBondContact O-ND2 2.88Å; N632-V638 CarbonylContact O-C 3.58Å; N632-V638 WeakPolarHBondContact O-CA 3.32Å; N632-T639 PolarHBondContact N-O 3.22Å; N632-T639 PolarHBondContact O-N 3.17Å
633	V	96.7	Very high	93.4	Very high	2 Å²	2	36.7 Å²	36.7	1%	0.012	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	122.6	-178.9	-178	0	0	0	0	109.9	V588 Q589 F591 M631 V638 A698 V699 A702	V588-V633 WeakPolarHBondContact CA-O 3.41Å; Q589-V633 PolarHBondContact N-O 2.89Å; Q589-V633 PolarHBondContact O-N 3.12Å; F591-V633 HydrophobicContact CD2-CG2 4.06Å; F591-V633 HydrophobicContact CE2-CB 4.29Å; F591-V633 HydrophobicContact CE2-CG2 3.92Å; M631-V633 HydrophobicContact CG-CG2 4.14Å; M631-V633 HydrophobicContact SD-CG2 4.29Å; V633-V638 HydrophobicContact CG1-CG2 4.29Å; V633-V638 HydrophobicContact CG2-CG1 4.29Å; V633-V638 HydrophobicContact CG2-CG2 4.34Å; V633-A698 HydrophobicContact CB-CB 4.43Å; V633-A698 HydrophobicContact CG1-CB 4.19Å; V633-V699 HydrophobicContact CG1-CG2 4.1Å; V633-V699 HydrophobicContact CG2-CG2 3.66Å; V633-A702 HydrophobicContact CG1-CB 4.14Å
634	A	93.3	Very high	93.4	Very high	5 Å²	5	41.6 Å²	41.6	4%	0.041	21%	0.214	C	C	.	.			trans	-134	162.4	-179	0	0	0	0	0	111.5	E586 V588 A636 T637	E586-A634 HydrophobicContact CG-CB 3.91Å; E586-A634 WeakPolarHBondContact OE1-CB 3.19Å; V588-A634 HydrophobicContact CG2-CB 4.09Å; A634-A636 PolarHBondContact O-N 2.82Å; A634-T637 WeakPolarHBondContact CB-O 3.45Å; A634-T637 PolarHBondContact N-O 3.18Å; A634-T637 PolarHBondContact O-N 2.81Å
635	D	86.8	Confident	93.4	Very high	48 Å²	48	37.1 Å²	37.1	26%	0.257	20%	0.196	S	C	.	.	S	Bend	trans	-44.1	-36.4	-177.3	-76	44.9	0	0	0	115	E586 K709	E586-D635 HydrophobicContact CG-CB 4.18Å; E586-D635 WeakPolarHBondContact OE1-CB 3.49Å; E586-D635 PolarHBondContact OE1-N 3.31Å; D635-K709 IonicContact OD2-NZ 3.52Å; D635-K709 PolarHBondContact OD2-NZ 3.43Å
636	A	90.1	Very high	93	Very high	37 Å²	37	38.8 Å²	38.8	31%	0.306	20%	0.2	S	C	.	.	S	Bend	trans	-114.7	-14.9	-177.7	0	0	0	0	0	115.5	E586 A634 V655 R706	E586-A636 PolarHBondContact OE1-N 3.29Å; A634-A636 PolarHBondContact O-N 2.82Å; A636-V655 PolarHBondContact O-N 3.09Å; A636-R706 PolarHBondContact O-NH1 2.93Å
637	T	94.8	Very high	92.4	Very high	13 Å²	13	46.1 Å²	46.1	8%	0.08	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.6	139	-170.6	56.5	0	0	0	0	112.7	A634 C653 R654	A634-T637 WeakPolarHBondContact CB-O 3.45Å; A634-T637 PolarHBondContact N-O 3.18Å; A634-T637 PolarHBondContact O-N 2.81Å; T637-C653 WeakPolarHBondContact CA-O 3.47Å; T637-R654 HydrophobicContact CG2-CG 4.2Å
638	V	96.8	Very high	92.2	Very high	0 Å²	0	46.7 Å²	46.7	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	122.3	158	-178.1	0	0	0	0	107.3	M631 N632 V633 C653 V655 F672 V699	M631-V638 HydrophobicContact CG-CG1 3.72Å; M631-V638 HydrophobicContact SD-CG1 3.97Å; N632-V638 CarbonylContact O-C 3.58Å; N632-V638 WeakPolarHBondContact O-CA 3.32Å; V633-V638 HydrophobicContact CG1-CG2 4.29Å; V633-V638 HydrophobicContact CG2-CG1 4.29Å; V633-V638 HydrophobicContact CG2-CG2 4.34Å; V638-C653 HydrophobicContact CB-CB 4.31Å; V638-C653 PolarHBondContact N-O 3.41Å; V638-C653 PolarHBondContact O-N 2.82Å; V638-V655 HydrophobicContact CG2-CG2 4.33Å; V638-F672 HydrophobicContact CG1-CE1 4.46Å; V638-V699 HydrophobicContact CG2-CG1 4.16Å; V638-V699 HydrophobicContact CG2-CG2 4Å
639	T	96.8	Very high	92	Very high	20 Å²	20	48.2 Å²	48.2	12%	0.123	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	136.8	173.3	48.3	0	0	0	0	110.9	N632 V651 E652	N632-T639 PolarHBondContact N-O 3.22Å; N632-T639 PolarHBondContact O-N 3.17Å; T639-V651 CarbonylContact C-O 3.59Å; T639-V651 VanDerWaalsContact CA-O 3.29Å; T639-V651 WeakPolarHBondContact CA-O 3.45Å; T639-E652 HydrophobicContact CG2-CB 4.25Å; T639-E652 HydrophobicContact CG2-CG 3.84Å
640	V	97.2	Very high	91.9	Very high	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	123.5	175.3	-178	0	0	0	0	107.8	V629 M631 V649 L650 V651 F686	V629-V640 HydrophobicContact CB-CG1 3.71Å; V629-V640 HydrophobicContact CG1-CG1 4.05Å; V629-V640 HydrophobicContact CG2-CG1 3.62Å; M631-V640 HydrophobicContact CE-CG2 4.36Å; M631-V640 HydrophobicContact CG-CG2 4.48Å; V640-V649 CarbonylContact O-C 3.58Å; V640-L650 HydrophobicContact CG1-CB 4.37Å; V640-L650 PolarHBondContact O-N 2.98Å; V640-V651 HydrophobicContact CB-CB 3.91Å; V640-V651 HydrophobicContact CB-CG2 4.07Å; V640-V651 HydrophobicContact CG2-CB 3.93Å; V640-V651 HydrophobicContact CG2-CG2 4.17Å; V640-V651 PolarHBondContact N-O 3.37Å; V640-V651 PolarHBondContact O-N 2.77Å; V640-F686 HydrophobicContact CB-CE1 4.5Å; V640-F686 HydrophobicContact CG1-CE1 4.07Å; V640-F686 HydrophobicContact CG2-CE1 3.64Å; V640-F686 HydrophobicContact CG2-CZ 3.76Å
641	I	94.6	Very high	91.8	Very high	30 Å²	30	51 Å²	51	15%	0.154	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	138.1	-175.7	-52.1	-175.3	0	0	0	108.9	V629 N630 E643 E646 E648 V649	V629-I641 CarbonylContact C-O 3.58Å; V629-I641 WeakPolarHBondContact CA-O 3.44Å; V629-I641 WeakPolarHBondContact CB-O 3.45Å; N630-I641 PolarHBondContact N-O 2.86Å; N630-I641 PolarHBondContact O-N 3.17Å; I641-E643 PolarHBondContact O-N 2.86Å; I641-E646 WeakPolarHBondContact CG2-O 3.4Å; I641-E648 WeakPolarHBondContact CA-O 3.27Å; I641-V649 HydrophobicContact CG1-CG2 4.3Å
642	S	92.8	Very high	91.7	Very high	5 Å²	5	55.1 Å²	55.1	4%	0.035	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-56.2	131.9	175.2	-166.6	0	0	0	0	111.2	K644 N645 E648	S642-K644 PolarHBondContact O-N 2.96Å; S642-N645 WeakPolarHBondContact CB-O 3.3Å; S642-N645 CarbonylContact O-C 3.51Å; S642-N645 PolarHBondContact O-N 3.27Å; S642-N645 VanDerWaalsContact O-O 3.1Å; S642-E648 WeakPolarHBondContact CB-OE2 3.4Å; S642-E648 PolarHBondContact N-O 2.85Å; S642-E648 PolarHBondContact OG-OE2 2.83Å
643	E	89.6	Confident	91.7	Very high	97 Å²	97	54.2 Å²	54.2	45%	0.453	27%	0.272	S	S	.	.	S	Bend	trans	-69.9	-23.4	173.9	-172	175.9	-134.2	0	0	111.7	H592 S628 I641	H592-E643 IonicContact CD2-OE1 2.71Å; S628-E643 WeakPolarHBondContact CB-OE2 3.38Å; S628-E643 VanDerWaalsContact O-CB 3.27Å; S628-E643 WeakPolarHBondContact O-CB 3.32Å; S628-E643 PolarHBondContact O-N 3.1Å; S628-E643 VanDerWaalsContact O-N 3.13Å; I641-E643 PolarHBondContact O-N 2.86Å
644	K	86.2	Confident	91.6	Very high	185 Å²	185	59.6 Å²	59.6	80%	0.804	29%	0.293	S	S	*	.	S	Bend	trans	-81.4	-18.9	179.1	-64	173.5	-176.3	169.3	0	113.3	S642	S642-K644 PolarHBondContact O-N 2.96Å
645	N	85.4	Confident	91.6	Very high	71 Å²	71	59.8 Å²	59.8	38%	0.38	29%	0.293	S	S	.	.			trans	-152.5	106.9	-179.9	-179	10.1	0	0	0	110.4	S642 E647 E648	S642-N645 WeakPolarHBondContact CB-O 3.3Å; S642-N645 CarbonylContact O-C 3.51Å; S642-N645 PolarHBondContact O-N 3.27Å; S642-N645 VanDerWaalsContact O-O 3.1Å; N645-E647 PolarHBondContact O-N 3.48Å; N645-E647 VanDerWaalsContact O-N 3.13Å; N645-E647 PolarHBondContact OD1-N 3.23Å; N645-E647 VanDerWaalsContact OD1-N 3.14Å; N645-E648 HydrophobicContact CB-CB 3.97Å; N645-E648 PolarHBondContact O-N 3.3Å
646	E	81.4	Confident	91.9	Very high	134 Å²	134	65.3 Å²	65.3	63%	0.626	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.8	-9.3	-177.9	-63.6	-157	124.4	0	0	114	K590 I641	K590-E646 IonicContact NZ-OE1 3.99Å; K590-E646 PolarHBondContact NZ-OE1 2.83Å; I641-E646 WeakPolarHBondContact CG2-O 3.4Å
647	E	81.7	Confident	92.1	Very high	175 Å²	175	66.3 Å²	66.3	82%	0.818	31%	0.308	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.2	-17.3	171	-59.3	-177.8	170.2	0	0	113	N645 V649	N645-E647 PolarHBondContact O-N 3.48Å; N645-E647 VanDerWaalsContact O-N 3.13Å; N645-E647 PolarHBondContact OD1-N 3.23Å; N645-E647 VanDerWaalsContact OD1-N 3.14Å; E647-V649 PolarHBondContact O-N 3.33Å
648	E	89	Confident	92.2	Very high	86 Å²	86	66.9 Å²	66.9	40%	0.402	31%	0.31	S	S	.	.			trans	-87.3	91.3	-175.6	-177.8	-179.5	-145.6	0	0	111.5	I641 S642 N645 L650	I641-E648 WeakPolarHBondContact CA-O 3.27Å; S642-E648 WeakPolarHBondContact CB-OE2 3.4Å; S642-E648 PolarHBondContact N-O 2.85Å; S642-E648 PolarHBondContact OG-OE2 2.83Å; N645-E648 HydrophobicContact CB-CB 3.97Å; N645-E648 PolarHBondContact O-N 3.3Å; E648-L650 HydrophobicContact CG-CD2 3.94Å; E648-L650 HydrophobicContact CG-CG 4.38Å; E648-L650 PolarHBondContact O-N 3.12Å
649	V	91.8	Very high	92.1	Very high	81 Å²	81	68.8 Å²	68.8	49%	0.491	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.8	107.2	172.4	-173.7	0	0	0	0	110.1	V640 I641 E647	V640-V649 CarbonylContact O-C 3.58Å; I641-V649 HydrophobicContact CG1-CG2 4.3Å; E647-V649 PolarHBondContact O-N 3.33Å
650	L	93.9	Very high	92.2	Very high	54 Å²	54	70.2 Å²	70.2	28%	0.283	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	-30.1	-179.1	-62.9	169.4	0	0	0	112.9	L627 V629 V640 E648	L627-L650 HydrophobicContact CD2-CD1 4.2Å; V629-L650 HydrophobicContact CG1-CD1 3.47Å; V629-L650 VanDerWaalsContact CG1-CD1 3.47Å; V640-L650 HydrophobicContact CG1-CB 4.37Å; V640-L650 PolarHBondContact O-N 2.98Å; E648-L650 HydrophobicContact CG-CD2 3.94Å; E648-L650 HydrophobicContact CG-CG 4.38Å; E648-L650 PolarHBondContact O-N 3.12Å
651	V	95.7	Very high	92.2	Very high	10 Å²	10	72 Å²	72	6%	0.061	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.8	130.6	177.7	-169.5	0	0	0	0	110.3	Y595 T639 V640 F672 M674	Y595-V651 HydrophobicContact CE2-CG2 4.4Å; T639-V651 CarbonylContact C-O 3.59Å; T639-V651 VanDerWaalsContact CA-O 3.29Å; T639-V651 WeakPolarHBondContact CA-O 3.45Å; V640-V651 HydrophobicContact CB-CB 3.91Å; V640-V651 HydrophobicContact CB-CG2 4.07Å; V640-V651 HydrophobicContact CG2-CB 3.93Å; V640-V651 HydrophobicContact CG2-CG2 4.17Å; V640-V651 PolarHBondContact N-O 3.37Å; V640-V651 PolarHBondContact O-N 2.77Å; V651-F672 HydrophobicContact CG1-CZ 4.28Å; V651-M674 HydrophobicContact CG1-SD 4.22Å
652	E	95.5	Very high	92.3	Very high	85 Å²	85	71.2 Å²	71.2	40%	0.397	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	96.3	162.9	-171.7	-162.6	155.5	0	0	110.3	T639 R654	T639-E652 HydrophobicContact CG2-CB 4.25Å; T639-E652 HydrophobicContact CG2-CG 3.84Å; E652-R654 WeakPolarHBondContact OE1-CG 3.49Å; E652-R654 IonicContact OE1-CZ 2.72Å; E652-R654 IonicContact OE1-NE 3.46Å; E652-R654 PolarHBondContact OE1-NE 3.17Å; E652-R654 IonicContact OE1-NH2 3.92Å; E652-R654 PolarHBondContact OE1-NH2 3Å; E652-R654 IonicContact OE2-CZ 3.47Å; E652-R654 IonicContact OE2-NH2 2.68Å; E652-R654 PolarHBondContact OE2-NH2 2.86Å
653	C	95.8	Very high	92.6	Very high	0 Å²	0	73.3 Å²	73.3	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	109.5	171.8	-172.1	0	0	0	0	110.6	T637 V638 F672 M674	T637-C653 WeakPolarHBondContact CA-O 3.47Å; V638-C653 HydrophobicContact CB-CB 4.31Å; V638-C653 PolarHBondContact N-O 3.41Å; V638-C653 PolarHBondContact O-N 2.82Å; C653-F672 HydrophobicContact CB-CD2 4.49Å; C653-F672 HydrophobicContact CB-CE2 3.61Å; C653-F672 HydrophobicContact CB-CZ 3.82Å; C653-M674 HydrophobicContact CB-SD 3.58Å; C653-M674 VanDerWaalsContact CB-SD 3.58Å; C653-M674 VanDerWaalsContact SG-SD 3.63Å
654	R	94	Very high	92.9	Very high	115 Å²	115	69.2 Å²	69.2	43%	0.434	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	127.9	170.4	-56.1	-173.2	172.9	131.1	14.4	108.5	T637 E652 R656 F657 L658	T637-R654 HydrophobicContact CG2-CG 4.2Å; E652-R654 WeakPolarHBondContact OE1-CG 3.49Å; E652-R654 IonicContact OE1-CZ 2.72Å; E652-R654 IonicContact OE1-NE 3.46Å; E652-R654 PolarHBondContact OE1-NE 3.17Å; E652-R654 IonicContact OE1-NH2 3.92Å; E652-R654 PolarHBondContact OE1-NH2 3Å; E652-R654 IonicContact OE2-CZ 3.47Å; E652-R654 IonicContact OE2-NH2 2.68Å; E652-R654 PolarHBondContact OE2-NH2 2.86Å; R654-R656 HydrophobicContact CB-CG 4.48Å; R654-R656 PolarHBondContact O-N 3.42Å; R654-F657 HydrophobicContact CB-CD2 3.86Å; R654-F657 HydrophobicContact CB-CE2 4.37Å; R654-F657 HydrophobicContact CG-CD2 4.46Å; R654-F657 WeakPolarHBondContact O-CB 3.47Å; R654-F657 PolarHBondContact O-N 2.89Å; R654-L658 PolarHBondContact O-N 3.2Å
655	V	94.7	Very high	93.3	Very high	10 Å²	10	68 Å²	68	6%	0.061	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-8.4	-173.2	175.8	0	0	0	0	114.2	A636 V638 A702 C703 R706	A636-V655 PolarHBondContact O-N 3.09Å; V638-V655 HydrophobicContact CG2-CG2 4.33Å; V655-A702 HydrophobicContact CG2-CB 4.27Å; V655-C703 HydrophobicContact CG1-CB 4.31Å; V655-R706 HydrophobicContact CG1-CB 4.17Å
656	R	92.3	Very high	93.8	Very high	164 Å²	164	67.5 Å²	67.5	62%	0.619	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.9	-13.9	169.5	75.6	-175.1	-164.8	113.2	-11.4	115.1	R654	R654-R656 HydrophobicContact CB-CG 4.48Å; R654-R656 PolarHBondContact O-N 3.42Å
657	F	94.6	Very high	94.5	Very high	58 Å²	58	65.5 Å²	65.5	25%	0.254	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-110.4	-14.9	-177.9	-62.1	-48	0	0	0	112.1	R654 S659 M674 D675	R654-F657 HydrophobicContact CB-CD2 3.86Å; R654-F657 HydrophobicContact CB-CE2 4.37Å; R654-F657 HydrophobicContact CG-CD2 4.46Å; R654-F657 WeakPolarHBondContact O-CB 3.47Å; R654-F657 PolarHBondContact O-N 2.89Å; F657-S659 PolarHBondContact O-N 3.06Å; F657-S659 VanDerWaalsContact O-N 3.09Å; F657-M674 CarbonylContact O-C 3.38Å; F657-M674 VanDerWaalsContact O-CA 3.3Å; F657-M674 WeakPolarHBondContact O-CA 3.29Å; F657-D675 PolarHBondContact O-N 3.48Å
658	L	95.9	Very high	95.3	Very high	24 Å²	24	59.4 Å²	59.4	13%	0.126	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.3	112.4	165.8	-169.9	158.7	0	0	0	107.7	R654 M661 F672 V699	R654-L658 PolarHBondContact O-N 3.2Å; L658-M661 HydrophobicContact CD2-CB 4.14Å; L658-M661 HydrophobicContact CD2-CG 4.09Å; L658-M661 HydrophobicContact CD2-SD 4.24Å; L658-F672 HydrophobicContact CD1-CB 4.02Å; L658-F672 HydrophobicContact CD1-CD2 4.48Å; L658-F672 HydrophobicContact CD1-CG 4.23Å; L658-F672 HydrophobicContact CG-CB 4.22Å; L658-V699 HydrophobicContact CD1-CG1 3.51Å
659	S	95.4	Very high	95.6	Very high	41 Å²	41	55.5 Å²	55.5	29%	0.287	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	-30.2	-173.8	57	0	0	0	0	112.3	P604 F657 I673	P604-S659 WeakPolarHBondContact O-CB 3.2Å; P604-S659 PolarHBondContact O-OG 2.67Å; F657-S659 PolarHBondContact O-N 3.06Å; F657-S659 VanDerWaalsContact O-N 3.09Å; S659-I673 PolarHBondContact N-O 2.81Å; S659-I673 PolarHBondContact OG-O 2.79Å
660	F	97.8	Very high	96	Very high	50 Å²	50	51.6 Å²	51.6	22%	0.219	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.9	159	174.2	-170.3	-119.1	0	0	0	110.9	P604 V605 G606 M607 L610 F672 I673	P604-F660 WeakPolarHBondContact O-CB 3.43Å; V605-F660 HydrophobicContact CB-CB 4.49Å; V605-F660 HydrophobicContact CG1-CD2 3.81Å; V605-F660 HydrophobicContact CG1-CE2 4.14Å; V605-F660 HydrophobicContact CG1-CG 4.25Å; V605-F660 HydrophobicContact CG2-CB 4.28Å; G606-F660 WeakPolarHBondContact O-CE1 3.46Å; M607-F660 HydrophobicContact CB-CZ 4.38Å; M607-F660 HydrophobicContact SD-CE1 4.04Å; M607-F660 HydrophobicContact SD-CZ 4.06Å; L610-F660 HydrophobicContact CB-CD1 4.28Å; L610-F660 HydrophobicContact CB-CE1 4.08Å; L610-F660 HydrophobicContact CD1-CD1 3.75Å; L610-F660 HydrophobicContact CD1-CE1 3.85Å; F660-F672 CarbonylContact O-C 3.58Å; F660-F672 WeakPolarHBondContact O-CA 3.47Å; F660-I673 HydrophobicContact CB-CB 4.24Å; F660-I673 HydrophobicContact CB-CD1 4.19Å; F660-I673 HydrophobicContact CB-CG1 4.37Å; F660-I673 HydrophobicContact CD1-CD1 4.03Å; F660-I673 PolarHBondContact N-O 2.79Å; F660-I673 PolarHBondContact O-N 2.91Å
661	M	97.7	Very high	96.2	Very high	38 Å²	38	49 Å²	49	19%	0.187	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.9	154.5	176.2	55.2	178.9	-70.4	0	0	110.1	L658 F670 A671 F672 S696 V699 Q700	L658-M661 HydrophobicContact CD2-CB 4.14Å; L658-M661 HydrophobicContact CD2-CG 4.09Å; L658-M661 HydrophobicContact CD2-SD 4.24Å; M661-F670 HydrophobicContact CE-CE2 3.96Å; M661-F670 HydrophobicContact CE-CZ 4.08Å; M661-A671 WeakPolarHBondContact CA-O 3.33Å; M661-F672 HydrophobicContact CB-CB 3.98Å; M661-S696 VanDerWaalsContact CE-O 3.26Å; M661-S696 WeakPolarHBondContact CE-O 3.4Å; M661-V699 HydrophobicContact CE-CB 3.8Å; M661-V699 HydrophobicContact CE-CG1 3.88Å; M661-V699 HydrophobicContact SD-CB 4.3Å; M661-V699 HydrophobicContact SD-CG1 3.76Å; M661-Q700 HydrophobicContact CE-CB 4.08Å; M661-Q700 HydrophobicContact SD-CB 4.42Å
662	G	97.3	Very high	96.3	Very high	12 Å²	12	48.6 Å²	48.6	12%	0.124	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-169	159.6	179	0	0	0	0	0	113.6	F670 A671	G662-F670 WeakPolarHBondContact O-CD2 3.37Å; G662-A671 PolarHBondContact N-O 3.49Å; G662-A671 PolarHBondContact O-N 2.84Å
663	V	97.9	Very high	96.4	Very high	49 Å²	49	44.5 Å²	44.5	30%	0.297	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	129.9	161.4	179.2	0	0	0	0	107	M607 T669 A692	M607-V663 WeakPolarHBondContact CE-O 3.47Å; V663-T669 CarbonylContact C-O 3.57Å; V663-T669 VanDerWaalsContact CA-O 3.31Å; V663-T669 WeakPolarHBondContact CA-O 3.46Å; V663-T669 WeakPolarHBondContact CG1-O 3.35Å; V663-A692 HydrophobicContact CB-CB 4.4Å; V663-A692 HydrophobicContact CG1-CB 3.95Å; V663-A692 HydrophobicContact CG2-CB 3.73Å
664	G	95.9	Very high	96.5	Very high	12 Å²	12	45.5 Å²	45.5	12%	0.124	22%	0.221	C	C	.	.			trans	-71.3	-169.4	-176.1	0	0	0	0	0	113.9	N611 D666 T669	N611-G664 WeakPolarHBondContact OD1-CA 2.93Å; G664-D666 PolarHBondContact O-N 2.84Å; G664-T669 WeakPolarHBondContact CA-OG1 3.4Å; G664-T669 PolarHBondContact N-O 2.79Å; G664-T669 PolarHBondContact N-OG1 2.86Å
665	K	95.7	Very high	96.6	Very high	158 Å²	158	42.6 Å²	42.6	69%	0.687	21%	0.214	S	C	*	.	S	Bend	trans	-56.1	-30.4	173	-71.7	174.4	-174.6	170.6	0	113	N611 E615	N611-K665 PolarHBondContact OD1-N 2.8Å; E615-K665 VanDerWaalsContact OE1-CD 3.32Å; E615-K665 WeakPolarHBondContact OE1-CD 3.08Å; E615-K665 WeakPolarHBondContact OE1-CE 3.26Å; E615-K665 IonicContact OE1-NZ 3.86Å; E615-K665 PolarHBondContact OE1-NZ 2.84Å; E615-K665 IonicContact OE2-NZ 3.78Å
666	D	95.5	Very high	96.5	Very high	62 Å²	62	44.4 Å²	44.4	33%	0.332	23%	0.225	S	C	.	.	S	Bend	trans	-97.6	130.3	170.7	-170.7	-33.1	0	0	0	109.7	G664 H668 T669 W687	G664-D666 PolarHBondContact O-N 2.84Å; D666-H668 PolarHBondContact O-N 2.77Å; D666-H668 VanDerWaalsContact O-N 3.12Å; D666-H668 IonicContact OD1-CE1 3.13Å; D666-H668 IonicContact OD1-CG 3.59Å; D666-H668 PolarHBondContact OD1-N 2.99Å; D666-H668 IonicContact OD1-ND1 2.84Å; D666-H668 PolarHBondContact OD1-ND1 2.83Å; D666-H668 IonicContact OD2-ND1 3.9Å; D666-T669 HydrophobicContact CB-CG2 4.07Å; D666-T669 PolarHBondContact O-N 2.7Å; D666-T669 PolarHBondContact O-OG1 2.84Å; D666-W687 WeakPolarHBondContact OD2-CH2 3.35Å
667	V	97.1	Very high	96.3	Very high	91 Å²	91	37.9 Å²	37.9	55%	0.552	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-18.7	-179.9	-61	0	0	0	0	114.1	N691 A692	V667-N691 HydrophobicContact CB-CB 4.45Å; V667-N691 HydrophobicContact CG2-CB 4.42Å; V667-N691 WeakPolarHBondContact O-CB 3.3Å; V667-A692 VanDerWaalsContact O-CB 3.32Å; V667-A692 WeakPolarHBondContact O-CB 3.14Å; V667-A692 PolarHBondContact O-N 3.39Å
668	H	96.9	Very high	95.9	Very high	48 Å²	48	42.4 Å²	42.4	22%	0.222	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	-17.9	174.1	-49.6	88	0	0	0	112.7	D666 W687 C688 E689 P690	D666-H668 PolarHBondContact O-N 2.77Å; D666-H668 VanDerWaalsContact O-N 3.12Å; D666-H668 IonicContact OD1-CE1 3.13Å; D666-H668 IonicContact OD1-CG 3.59Å; D666-H668 PolarHBondContact OD1-N 2.99Å; D666-H668 IonicContact OD1-ND1 2.84Å; D666-H668 PolarHBondContact OD1-ND1 2.83Å; D666-H668 IonicContact OD2-ND1 3.9Å; H668-W687 HydrophobicContact CB-CD2 3.79Å; H668-W687 VanDerWaalsContact CB-CE2 3.42Å; H668-W687 HydrophobicContact CB-CE3 4.09Å; H668-W687 HydrophobicContact CB-CG 4.48Å; H668-W687 HydrophobicContact CB-CH2 3.7Å; H668-W687 HydrophobicContact CB-CZ2 3.39Å; H668-W687 HydrophobicContact CB-CZ3 4.04Å; H668-W687 AromaticContact CG-CE2 3.94Å; H668-W687 AromaticContact CG-CH2 3.97Å; H668-W687 AromaticContact CG-CZ2 3.52Å; H668-W687 AromaticContact ND1-CH2 3.96Å; H668-W687 AromaticContact ND1-CZ2 3.83Å; H668-C688 PolarHBondContact O-N 2.84Å; H668-E689 IonicContact CD2-OE2 3.92Å; H668-P690 PolarHBondContact CD2-O 3.15Å; H668-P690 PolarHBondContact NE2-O 3.44Å
669	T	97.3	Very high	95.4	Very high	3 Å²	3	49.4 Å²	49.4	2%	0.018	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	121.3	-177.2	59.4	0	0	0	0	111.8	I614 M618 V663 G664 D666 W687	I614-T669 HydrophobicContact CG2-CG2 3.95Å; M618-T669 HydrophobicContact SD-CG2 4.48Å; V663-T669 CarbonylContact C-O 3.57Å; V663-T669 VanDerWaalsContact CA-O 3.31Å; V663-T669 WeakPolarHBondContact CA-O 3.46Å; V663-T669 WeakPolarHBondContact CG1-O 3.35Å; G664-T669 WeakPolarHBondContact CA-OG1 3.4Å; G664-T669 PolarHBondContact N-O 2.79Å; G664-T669 PolarHBondContact N-OG1 2.86Å; D666-T669 HydrophobicContact CB-CG2 4.07Å; D666-T669 PolarHBondContact O-N 2.7Å; D666-T669 PolarHBondContact O-OG1 2.84Å; T669-W687 HydrophobicContact CG2-CE3 3.84Å; T669-W687 HydrophobicContact CG2-CZ3 3.94Å
670	F	98.4	Very high	95.3	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	140.4	172.5	-179	-117.3	0	0	0	110.3	M631 M661 G662 F672 F686 A692 V695 V699	M631-F670 HydrophobicContact CE-CD1 4.12Å; M631-F670 HydrophobicContact CE-CE1 4.16Å; M631-F670 HydrophobicContact SD-CD1 4.48Å; M631-F670 HydrophobicContact SD-CE1 4.18Å; M661-F670 HydrophobicContact CE-CE2 3.96Å; M661-F670 HydrophobicContact CE-CZ 4.08Å; G662-F670 WeakPolarHBondContact O-CD2 3.37Å; F670-F672 HydrophobicContact CE1-CD1 4.01Å; F670-F686 HydrophobicContact CB-CB 4.46Å; F670-F686 HydrophobicContact CD1-CD2 4.01Å; F670-F686 PolarHBondContact N-O 3.31Å; F670-F686 PolarHBondContact O-N 2.95Å; F670-A692 HydrophobicContact CB-CB 3.81Å; F670-V695 HydrophobicContact CD1-CG1 3.61Å; F670-V695 HydrophobicContact CE1-CG1 3.73Å; F670-V695 HydrophobicContact CG-CG1 4.12Å; F670-V695 HydrophobicContact CZ-CG1 4.35Å; F670-V699 HydrophobicContact CE1-CG2 4.26Å; F670-V699 HydrophobicContact CZ-CB 4.18Å; F670-V699 HydrophobicContact CZ-CG1 4.44Å; F670-V699 HydrophobicContact CZ-CG2 4.06Å
671	A	98.3	Very high	95.3	Very high	0 Å²	0	53.6 Å²	53.6	0%	0	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.1	154.4	172.9	0	0	0	0	0	112.8	L610 I614 M661 G662 H684 V685	L610-A671 HydrophobicContact CD1-CB 3.96Å; L610-A671 HydrophobicContact CD2-CB 4.05Å; L610-A671 HydrophobicContact CG-CB 3.83Å; I614-A671 HydrophobicContact CD1-CB 4.02Å; I614-A671 HydrophobicContact CG1-CB 4.1Å; M661-A671 WeakPolarHBondContact CA-O 3.33Å; G662-A671 PolarHBondContact N-O 3.49Å; G662-A671 PolarHBondContact O-N 2.84Å; A671-H684 WeakPolarHBondContact CA-O 3.47Å; A671-H684 WeakPolarHBondContact CB-O 3.49Å; A671-V685 HydrophobicContact CB-CG2 3.98Å
672	F	98.4	Very high	95.3	Very high	0 Å²	0	54 Å²	54	0%	0	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.6	147.9	168.4	66.1	-101.2	0	0	0	111.7	M631 V638 V651 C653 L658 F660 M661 F670 M674 C683 H684 F686	M631-F672 HydrophobicContact CE-CE1 4.33Å; V638-F672 HydrophobicContact CG1-CE1 4.46Å; V651-F672 HydrophobicContact CG1-CZ 4.28Å; C653-F672 HydrophobicContact CB-CD2 4.49Å; C653-F672 HydrophobicContact CB-CE2 3.61Å; C653-F672 HydrophobicContact CB-CZ 3.82Å; L658-F672 HydrophobicContact CD1-CB 4.02Å; L658-F672 HydrophobicContact CD1-CD2 4.48Å; L658-F672 HydrophobicContact CD1-CG 4.23Å; L658-F672 HydrophobicContact CG-CB 4.22Å; F660-F672 CarbonylContact O-C 3.58Å; F660-F672 WeakPolarHBondContact O-CA 3.47Å; M661-F672 HydrophobicContact CB-CB 3.98Å; F670-F672 HydrophobicContact CE1-CD1 4.01Å; F672-M674 HydrophobicContact CD2-CB 4.45Å; F672-M674 HydrophobicContact CE2-CB 4.47Å; F672-M674 HydrophobicContact CE2-CG 4.21Å; F672-M674 HydrophobicContact CE2-SD 3.88Å; F672-C683 WeakPolarHBondContact O-CA 3.31Å; F672-H684 HydrophobicContact CE1-CB 4.33Å; F672-H684 HydrophobicContact CE2-CB 4.1Å; F672-H684 AromaticContact CE2-CD2 3.64Å; F672-H684 HydrophobicContact CZ-CB 3.96Å; F672-H684 PolarHBondContact N-O 2.9Å; F672-H684 VanDerWaalsContact N-O 3.15Å; F672-H684 PolarHBondContact O-N 3.17Å; F672-F686 AromaticContact CD1-CE2 3.89Å; F672-F686 HydrophobicContact CD1-CE2 3.89Å; F672-F686 AromaticContact CE1-CE2 3.44Å; F672-F686 HydrophobicContact CE1-CE2 3.44Å; F672-F686 VanDerWaalsContact CE1-CE2 3.44Å; F672-F686 AromaticContact CE1-CZ 3.82Å; F672-F686 HydrophobicContact CE1-CZ 3.82Å; F672-F686 HydrophobicContact CZ-CE2 4.2Å; F672-F686 HydrophobicContact CZ-CZ 4.27Å
673	I	98.3	Very high	95.3	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	125.5	175.7	-54.2	178.6	0	0	0	108.3	V601 I609 S659 F660 F681 E682 C683	V601-I673 HydrophobicContact CG2-CD1 4.25Å; V601-I673 HydrophobicContact CG2-CG1 4.44Å; V601-I673 HydrophobicContact CG2-CG2 3.73Å; I609-I673 HydrophobicContact CG2-CD1 4.23Å; S659-I673 PolarHBondContact N-O 2.81Å; S659-I673 PolarHBondContact OG-O 2.79Å; F660-I673 HydrophobicContact CB-CB 4.24Å; F660-I673 HydrophobicContact CB-CD1 4.19Å; F660-I673 HydrophobicContact CB-CG1 4.37Å; F660-I673 HydrophobicContact CD1-CD1 4.03Å; F660-I673 PolarHBondContact N-O 2.79Å; F660-I673 PolarHBondContact O-N 2.91Å; I673-F681 HydrophobicContact CG2-CB 3.74Å; I673-E682 WeakPolarHBondContact CA-O 3.39Å; I673-C683 HydrophobicContact CG1-CB 4.1Å
674	M	96.6	Very high	95.3	Very high	20 Å²	20	51.7 Å²	51.7	10%	0.099	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	141.6	175.3	60.9	179.7	-90.4	0	0	113.5	V651 C653 F657 F672 T676 F681 E682	V651-M674 HydrophobicContact CG1-SD 4.22Å; C653-M674 HydrophobicContact CB-SD 3.58Å; C653-M674 VanDerWaalsContact CB-SD 3.58Å; C653-M674 VanDerWaalsContact SG-SD 3.63Å; F657-M674 CarbonylContact O-C 3.38Å; F657-M674 VanDerWaalsContact O-CA 3.3Å; F657-M674 WeakPolarHBondContact O-CA 3.29Å; F672-M674 HydrophobicContact CD2-CB 4.45Å; F672-M674 HydrophobicContact CE2-CB 4.47Å; F672-M674 HydrophobicContact CE2-CG 4.21Å; F672-M674 HydrophobicContact CE2-SD 3.88Å; M674-T676 HydrophobicContact CE-CG2 3.92Å; M674-T676 HydrophobicContact CG-CG2 4.47Å; M674-T676 PolarHBondContact O-N 2.84Å; M674-F681 VanDerWaalsContact O-CA 3.32Å; M674-F681 WeakPolarHBondContact O-CA 3.5Å; M674-E682 PolarHBondContact N-O 2.97Å; M674-E682 PolarHBondContact O-N 2.95Å
675	D	96	Very high	95.4	Very high	54 Å²	54	51.1 Å²	51.1	29%	0.289	26%	0.255	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	113.2	172.3	179.9	9.9	0	0	0	110.1	F657 G677 F681	F657-D675 PolarHBondContact O-N 3.48Å; D675-G677 VanDerWaalsContact C-N 3.31Å; D675-G677 VanDerWaalsContact OD1-CA 3.28Å; D675-G677 WeakPolarHBondContact OD1-CA 3.23Å; D675-G677 PolarHBondContact OD1-N 2.63Å; D675-F681 HydrophobicContact CB-CD1 3.94Å; D675-F681 HydrophobicContact CB-CE1 3.87Å
676	T	92.8	Very high	95.5	Very high	49 Å²	49	43.6 Å²	43.6	30%	0.301	22%	0.222	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	9.6	174.2	63	0	0	0	0	112.7	M674 R680 E682	M674-T676 HydrophobicContact CE-CG2 3.92Å; M674-T676 HydrophobicContact CG-CG2 4.47Å; M674-T676 PolarHBondContact O-N 2.84Å; T676-R680 PolarHBondContact N-O 2.95Å; T676-R680 PolarHBondContact OG1-O 2.89Å; T676-E682 WeakPolarHBondContact CB-OE1 3.13Å; T676-E682 HydrophobicContact CG2-CB 4.25Å; T676-E682 VanDerWaalsContact CG2-CD 3.42Å; T676-E682 HydrophobicContact CG2-CG 4.1Å; T676-E682 WeakPolarHBondContact CG2-OE1 3.08Å; T676-E682 PolarHBondContact OG1-OE1 3.27Å
677	G	88.3	Confident	95.6	Very high	26 Å²	26	41.8 Å²	41.8	27%	0.268	21%	0.211	S	C	.	.	E	Extended strand (participates in β ladder)	trans	97.1	157.9	175.9	0	0	0	0	0	113.2	D675 Q679 R680	D675-G677 VanDerWaalsContact C-N 3.31Å; D675-G677 VanDerWaalsContact OD1-CA 3.28Å; D675-G677 WeakPolarHBondContact OD1-CA 3.23Å; D675-G677 PolarHBondContact OD1-N 2.63Å; G677-Q679 VanDerWaalsContact C-N 3.29Å; G677-Q679 PolarHBondContact O-N 2.75Å; G677-R680 PolarHBondContact O-N 3.49Å
678	N	86.8	Confident	95.6	Very high	153 Å²	153	37.6 Å²	37.6	82%	0.818	19%	0.185	S	C	*	.	T	Hydrogen-bonded Turn	trans	57.7	36.5	-179.9	-55.1	-23.1	0	0	0	113.8	R680	N678-R680 VanDerWaalsContact C-N 3.26Å; N678-R680 PolarHBondContact O-N 2.6Å
679	Q	86	Confident	95.5	Very high	171 Å²	171	40.5 Å²	40.5	80%	0.799	20%	0.199	S	C	*	.	T	Hydrogen-bonded Turn	trans	61.5	27.8	-177	-51.8	-178.8	9.8	0	0	114.1	G677 F681	G677-Q679 VanDerWaalsContact C-N 3.29Å; G677-Q679 PolarHBondContact O-N 2.75Å; Q679-F681 HydrophobicContact CB-CE2 4.36Å; Q679-F681 HydrophobicContact CB-CZ 4.41Å; Q679-F681 VanDerWaalsContact O-CE2 3.32Å; Q679-F681 WeakPolarHBondContact O-CE2 3.29Å
680	R	92.8	Very high	95.3	Very high	154 Å²	154	45 Å²	45	58%	0.581	23%	0.228	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-100.4	130.8	169.7	-62	-174.6	-60.1	176.8	7.1	109.3	T676 G677 N678	T676-R680 PolarHBondContact N-O 2.95Å; T676-R680 PolarHBondContact OG1-O 2.89Å; G677-R680 PolarHBondContact O-N 3.49Å; N678-R680 VanDerWaalsContact C-N 3.26Å; N678-R680 PolarHBondContact O-N 2.6Å
681	F	97.4	Very high	95.2	Very high	26 Å²	26	48 Å²	48	11%	0.114	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	137	-177.1	-50.3	-73.9	0	0	0	109.5	P600 V601 P604 I673 M674 D675 Q679	P600-F681 WeakPolarHBondContact CA-O 3.27Å; V601-F681 HydrophobicContact CG2-CB 3.81Å; V601-F681 PolarHBondContact N-O 2.78Å; P604-F681 HydrophobicContact CB-CD1 3.88Å; P604-F681 HydrophobicContact CB-CD2 4.49Å; P604-F681 HydrophobicContact CB-CE1 3.67Å; P604-F681 HydrophobicContact CB-CE2 4.3Å; P604-F681 HydrophobicContact CB-CG 4.3Å; P604-F681 HydrophobicContact CB-CZ 3.89Å; P604-F681 HydrophobicContact CG-CE1 4.41Å; P604-F681 HydrophobicContact CG-CE2 4.38Å; P604-F681 HydrophobicContact CG-CZ 4.13Å; I673-F681 HydrophobicContact CG2-CB 3.74Å; M674-F681 VanDerWaalsContact O-CA 3.32Å; M674-F681 WeakPolarHBondContact O-CA 3.5Å; D675-F681 HydrophobicContact CB-CD1 3.94Å; D675-F681 HydrophobicContact CB-CE1 3.87Å; Q679-F681 HydrophobicContact CB-CE2 4.36Å; Q679-F681 HydrophobicContact CB-CZ 4.41Å; Q679-F681 VanDerWaalsContact O-CE2 3.32Å; Q679-F681 WeakPolarHBondContact O-CE2 3.29Å
682	E	97.4	Very high	95.1	Very high	47 Å²	47	48 Å²	48	22%	0.22	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	122	-176	-72.5	169	-135.2	0	0	108.6	M598 I673 M674 T676	M598-E682 HydrophobicContact CE-CG 4.31Å; M598-E682 HydrophobicContact CG-CB 3.85Å; M598-E682 HydrophobicContact CG-CG 4.28Å; M598-E682 HydrophobicContact SD-CB 4.01Å; M598-E682 HydrophobicContact SD-CG 3.81Å; I673-E682 WeakPolarHBondContact CA-O 3.39Å; M674-E682 PolarHBondContact N-O 2.97Å; M674-E682 PolarHBondContact O-N 2.95Å; T676-E682 WeakPolarHBondContact CB-OE1 3.13Å; T676-E682 HydrophobicContact CG2-CB 4.25Å; T676-E682 VanDerWaalsContact CG2-CD 3.42Å; T676-E682 HydrophobicContact CG2-CG 4.1Å; T676-E682 WeakPolarHBondContact CG2-OE1 3.08Å; T676-E682 PolarHBondContact OG1-OE1 3.27Å
683	C	98.1	Very high	95	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	111.9	179.6	-171.7	0	0	0	0	109.4	M598 L599 V601 A613 F672 I673	M598-C683 WeakPolarHBondContact CA-O 3.42Å; L599-C683 PolarHBondContact N-O 3.11Å; L599-C683 WeakPolarHBondContact O-CB 3.48Å; L599-C683 PolarHBondContact O-N 2.95Å; V601-C683 HydrophobicContact CG1-CB 3.84Å; V601-C683 HydrophobicContact CG2-CB 4.25Å; A613-C683 HydrophobicContact CB-CB 3.9Å; F672-C683 WeakPolarHBondContact O-CA 3.31Å; I673-C683 HydrophobicContact CG1-CB 4.1Å
684	H	98.1	Very high	94.9	Very high	11 Å²	11	54.2 Å²	54.2	5%	0.051	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	134.2	176.4	-63.4	-88.3	0	0	0	110	Y595 A671 F672 F686	Y595-H684 HydrophobicContact CE2-CB 4.22Å; Y595-H684 AromaticContact CZ-ND1 3.92Å; Y595-H684 PolarHBondContact OH-ND1 2.7Å; A671-H684 WeakPolarHBondContact CA-O 3.47Å; A671-H684 WeakPolarHBondContact CB-O 3.49Å; F672-H684 HydrophobicContact CE1-CB 4.33Å; F672-H684 HydrophobicContact CE2-CB 4.1Å; F672-H684 AromaticContact CE2-CD2 3.64Å; F672-H684 HydrophobicContact CZ-CB 3.96Å; F672-H684 PolarHBondContact N-O 2.9Å; F672-H684 VanDerWaalsContact N-O 3.15Å; F672-H684 PolarHBondContact O-N 3.17Å; H684-F686 HydrophobicContact CB-CE2 3.65Å; H684-F686 HydrophobicContact CB-CZ 3.77Å
685	V	98	Very high	94.9	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	137.5	-173.9	-178.3	0	0	0	0	111.7	Y595 L596 G597 I614 L617 A671	Y595-V685 WeakPolarHBondContact CD2-O 3.27Å; L596-V685 HydrophobicContact CB-CB 4.27Å; L596-V685 HydrophobicContact CB-CG1 4.2Å; L596-V685 HydrophobicContact CD2-CG1 3.98Å; L596-V685 PolarHBondContact N-O 3.13Å; G597-V685 PolarHBondContact O-N 3.17Å; I614-V685 HydrophobicContact CB-CG1 4.37Å; I614-V685 HydrophobicContact CG1-CG1 3.8Å; I614-V685 HydrophobicContact CG1-CG2 3.89Å; I614-V685 HydrophobicContact CG2-CG1 4.38Å; L617-V685 HydrophobicContact CD1-CB 3.86Å; L617-V685 HydrophobicContact CD1-CG2 3.67Å; A671-V685 HydrophobicContact CB-CG2 3.98Å
686	F	98	Very high	94.9	Very high	0 Å²	0	52 Å²	52	0%	0	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	148.4	-174.3	-50.7	-90.2	0	0	0	111.2	V593 Q594 Y595 M631 V640 F670 F672 H684	V593-F686 HydrophobicContact CG2-CB 4.33Å; V593-F686 HydrophobicContact CG2-CD1 3.92Å; V593-F686 HydrophobicContact CG2-CG 4.47Å; Q594-F686 CarbonylContact O-C 3.57Å; Q594-F686 VanDerWaalsContact O-CA 3.22Å; Q594-F686 WeakPolarHBondContact O-CA 3.3Å; Y595-F686 AromaticContact CD2-CD1 3.75Å; Y595-F686 HydrophobicContact CD2-CD1 3.75Å; Y595-F686 AromaticContact CD2-CE1 3.35Å; Y595-F686 HydrophobicContact CD2-CE1 3.35Å; Y595-F686 AromaticContact CD2-CZ 3.91Å; Y595-F686 HydrophobicContact CD2-CZ 3.91Å; Y595-F686 AromaticContact CE2-CE1 3.88Å; Y595-F686 HydrophobicContact CE2-CE1 3.88Å; Y595-F686 AromaticContact CE2-CZ 3.97Å; Y595-F686 HydrophobicContact CE2-CZ 3.97Å; Y595-F686 HydrophobicContact CG-CD1 4.49Å; Y595-F686 HydrophobicContact CG-CE1 4.2Å; M631-F686 HydrophobicContact CE-CB 4.44Å; M631-F686 HydrophobicContact CE-CD1 3.57Å; M631-F686 HydrophobicContact CE-CD2 3.52Å; M631-F686 HydrophobicContact CE-CE1 3.57Å; M631-F686 HydrophobicContact CE-CE2 3.54Å; M631-F686 HydrophobicContact CE-CG 3.55Å; M631-F686 HydrophobicContact CE-CZ 3.56Å; V640-F686 HydrophobicContact CB-CE1 4.5Å; V640-F686 HydrophobicContact CG1-CE1 4.07Å; V640-F686 HydrophobicContact CG2-CE1 3.64Å; V640-F686 HydrophobicContact CG2-CZ 3.76Å; F670-F686 HydrophobicContact CB-CB 4.46Å; F670-F686 HydrophobicContact CD1-CD2 4.01Å; F670-F686 PolarHBondContact N-O 3.31Å; F670-F686 PolarHBondContact O-N 2.95Å; F672-F686 AromaticContact CD1-CE2 3.89Å; F672-F686 HydrophobicContact CD1-CE2 3.89Å; F672-F686 AromaticContact CE1-CE2 3.44Å; F672-F686 HydrophobicContact CE1-CE2 3.44Å; F672-F686 VanDerWaalsContact CE1-CE2 3.44Å; F672-F686 AromaticContact CE1-CZ 3.82Å; F672-F686 HydrophobicContact CE1-CZ 3.82Å; F672-F686 HydrophobicContact CZ-CE2 4.2Å; F672-F686 HydrophobicContact CZ-CZ 4.27Å; H684-F686 HydrophobicContact CB-CE2 3.65Å; H684-F686 HydrophobicContact CB-CZ 3.77Å
687	W	97.7	Very high	95.1	Very high	25 Å²	25	56 Å²	56	10%	0.095	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	128.6	168.4	-176.3	-80.6	0	0	0	109.8	V593 Q594 L596 M618 W626 D666 H668 T669 E689	V593-W687 WeakPolarHBondContact CB-O 3.33Å; Q594-W687 HydrophobicContact CB-CB 4.28Å; Q594-W687 PolarHBondContact N-O 3.06Å; Q594-W687 PolarHBondContact O-N 3.43Å; L596-W687 HydrophobicContact CD1-CB 3.79Å; M618-W687 HydrophobicContact CE-CE3 4.46Å; M618-W687 HydrophobicContact CE-CZ3 3.98Å; M618-W687 HydrophobicContact SD-CE3 4.31Å; M618-W687 HydrophobicContact SD-CZ3 4.4Å; W626-W687 HydrophobicContact CE3-CB 3.95Å; W626-W687 HydrophobicContact CE3-CG 4.26Å; W626-W687 HydrophobicContact CH2-CD2 4.22Å; W626-W687 AromaticContact CH2-CE3 3.83Å; W626-W687 HydrophobicContact CH2-CE3 3.83Å; W626-W687 HydrophobicContact CH2-CZ3 4.43Å; W626-W687 HydrophobicContact CZ3-CB 3.7Å; W626-W687 AromaticContact CZ3-CD2 3.67Å; W626-W687 HydrophobicContact CZ3-CD2 3.67Å; W626-W687 AromaticContact CZ3-CE3 3.78Å; W626-W687 HydrophobicContact CZ3-CE3 3.78Å; W626-W687 AromaticContact CZ3-CG 3.64Å; W626-W687 HydrophobicContact CZ3-CG 3.64Å; D666-W687 WeakPolarHBondContact OD2-CH2 3.35Å; H668-W687 HydrophobicContact CB-CD2 3.79Å; H668-W687 VanDerWaalsContact CB-CE2 3.42Å; H668-W687 HydrophobicContact CB-CE3 4.09Å; H668-W687 HydrophobicContact CB-CG 4.48Å; H668-W687 HydrophobicContact CB-CH2 3.7Å; H668-W687 HydrophobicContact CB-CZ2 3.39Å; H668-W687 HydrophobicContact CB-CZ3 4.04Å; H668-W687 AromaticContact CG-CE2 3.94Å; H668-W687 AromaticContact CG-CH2 3.97Å; H668-W687 AromaticContact CG-CZ2 3.52Å; H668-W687 AromaticContact ND1-CH2 3.96Å; H668-W687 AromaticContact ND1-CZ2 3.83Å; T669-W687 HydrophobicContact CG2-CE3 3.84Å; T669-W687 HydrophobicContact CG2-CZ3 3.94Å; W687-E689 PolarHBondContact NE1-OE1 3.26Å
688	C	97.3	Very high	95.5	Very high	2 Å²	2	55 Å²	55	1%	0.014	28%	0.279	C	S	.	.			trans	-122.4	119.4	-170	-58.8	0	0	0	0	110.6	V593 H668 N691 A692 V695	V593-C688 HydrophobicContact CG1-CB 4.34Å; V593-C688 VanDerWaalsContact CG1-SG 3.6Å; H668-C688 PolarHBondContact O-N 2.84Å; C688-N691 WeakPolarHBondContact CB-O 3.38Å; C688-N691 CarbonylContact O-C 3.4Å; C688-N691 WeakPolarHBondContact O-CA 3.46Å; C688-N691 PolarHBondContact O-N 2.85Å; C688-N691 VanDerWaalsContact O-N 3.14Å; C688-A692 HydrophobicContact CB-CB 4.21Å; C688-V695 HydrophobicContact CB-CG2 4.43Å
689	E	93.3	Very high	96	Very high	110 Å²	110	47.8 Å²	47.8	51%	0.514	24%	0.24	S	C	.	.	S	Bend	trans	-98.9	134.5	174.3	-61.1	-71.2	175.2	0	0	109.2	K623 H668 W687	K623-E689 IonicContact NZ-OE1 3.76Å; K623-E689 PolarHBondContact NZ-OE1 2.9Å; H668-E689 IonicContact CD2-OE2 3.92Å; W687-E689 PolarHBondContact NE1-OE1 3.26Å
690	P	92.9	Very high	96.5	Very high	97 Å²	97	44.5 Å²	44.5	63%	0.63	23%	0.225	S	C	*	.	S	Bend	cis	-85.4	0.6	-2.2	37	-37.3	0	0	0	113.9	H668	H668-P690 PolarHBondContact CD2-O 3.15Å; H668-P690 PolarHBondContact NE2-O 3.44Å
691	N	96.5	Very high	96.6	Very high	64 Å²	64	38.6 Å²	38.6	34%	0.342	21%	0.209	S	C	.	.			trans	-174.6	171.3	166.7	54.1	83.9	0	0	0	110.1	V667 C688 G693	V667-N691 HydrophobicContact CB-CB 4.45Å; V667-N691 HydrophobicContact CG2-CB 4.42Å; V667-N691 WeakPolarHBondContact O-CB 3.3Å; C688-N691 WeakPolarHBondContact CB-O 3.38Å; C688-N691 CarbonylContact O-C 3.4Å; C688-N691 WeakPolarHBondContact O-CA 3.46Å; C688-N691 PolarHBondContact O-N 2.85Å; C688-N691 VanDerWaalsContact O-N 3.14Å; N691-G693 VanDerWaalsContact C-N 3.28Å; N691-G693 PolarHBondContact O-N 3.26Å; N691-G693 WeakPolarHBondContact OD1-CA 3.42Å; N691-G693 PolarHBondContact OD1-N 2.89Å
692	A	97.4	Very high	96.4	Very high	0 Å²	0	37.6 Å²	37.6	0%	0	21%	0.205	C	C	.	.	S	Bend	trans	-74.6	-5.2	178	0	0	0	0	0	115.2	V663 V667 F670 C688 V695 S696	V663-A692 HydrophobicContact CB-CB 4.4Å; V663-A692 HydrophobicContact CG1-CB 3.95Å; V663-A692 HydrophobicContact CG2-CB 3.73Å; V667-A692 VanDerWaalsContact O-CB 3.32Å; V667-A692 WeakPolarHBondContact O-CB 3.14Å; V667-A692 PolarHBondContact O-N 3.39Å; F670-A692 HydrophobicContact CB-CB 3.81Å; C688-A692 HydrophobicContact CB-CB 4.21Å; A692-V695 PolarHBondContact O-N 3.1Å; A692-S696 WeakPolarHBondContact O-CB 3.45Å; A692-S696 PolarHBondContact O-N 2.79Å; A692-S696 PolarHBondContact O-OG 3.17Å
693	G	95.3	Very high	96.3	Very high	27 Å²	27	37 Å²	37	28%	0.278	21%	0.206	S	C	.	.	H	α-helix	trans	-52.8	-62.9	-171.9	0	0	0	0	0	113.1	N691 V695 S696 E697	N691-G693 VanDerWaalsContact C-N 3.28Å; N691-G693 PolarHBondContact O-N 3.26Å; N691-G693 WeakPolarHBondContact OD1-CA 3.42Å; N691-G693 PolarHBondContact OD1-N 2.89Å; G693-V695 PolarHBondContact O-N 2.66Å; G693-S696 PolarHBondContact O-N 2.9Å; G693-S696 VanDerWaalsContact O-N 3.14Å; G693-S696 PolarHBondContact O-OG 3.12Å; G693-E697 PolarHBondContact O-N 2.8Å
694	N	95.5	Very high	96	Very high	102 Å²	102	42 Å²	42	55%	0.545	23%	0.231	S	C	.	.	H	α-helix	trans	-57.4	-36.3	-178.7	-58.1	-7	0	0	0	113	F591 A698	F591-N694 HydrophobicContact CE1-CB 4.05Å; N694-A698 WeakPolarHBondContact O-CB 3.17Å; N694-A698 PolarHBondContact O-N 2.86Å
695	V	96.9	Very high	95.6	Very high	5 Å²	5	45.6 Å²	45.6	3%	0.03	25%	0.25	C	C	.	.	H	α-helix	trans	-69.7	-46.7	179.4	-177.9	0	0	0	0	110.2	F591 V593 M631 F670 C688 A692 G693 A698 V699	F591-V695 HydrophobicContact CB-CG2 4.11Å; F591-V695 HydrophobicContact CD1-CG2 3.91Å; F591-V695 HydrophobicContact CD2-CG2 4.49Å; F591-V695 HydrophobicContact CE1-CG2 4.48Å; F591-V695 HydrophobicContact CG-CG2 3.92Å; V593-V695 HydrophobicContact CG1-CG2 4.26Å; M631-V695 HydrophobicContact CE-CG1 4.45Å; M631-V695 HydrophobicContact SD-CG1 3.56Å; M631-V695 VanDerWaalsContact SD-CG1 3.56Å; F670-V695 HydrophobicContact CD1-CG1 3.61Å; F670-V695 HydrophobicContact CE1-CG1 3.73Å; F670-V695 HydrophobicContact CG-CG1 4.12Å; F670-V695 HydrophobicContact CZ-CG1 4.35Å; C688-V695 HydrophobicContact CB-CG2 4.43Å; A692-V695 PolarHBondContact O-N 3.1Å; G693-V695 PolarHBondContact O-N 2.66Å; V695-A698 PolarHBondContact O-N 3.14Å; V695-V699 WeakPolarHBondContact O-CG2 3.23Å; V695-V699 PolarHBondContact O-N 3.4Å
696	S	97.5	Very high	95.1	Very high	23 Å²	23	48.5 Å²	48.5	16%	0.161	26%	0.261	C	S	.	.	H	α-helix	trans	-63.5	-41.1	177	70.9	0	0	0	0	112.2	M661 A692 G693 Q700	M661-S696 VanDerWaalsContact CE-O 3.26Å; M661-S696 WeakPolarHBondContact CE-O 3.4Å; A692-S696 WeakPolarHBondContact O-CB 3.45Å; A692-S696 PolarHBondContact O-N 2.79Å; A692-S696 PolarHBondContact O-OG 3.17Å; G693-S696 PolarHBondContact O-N 2.9Å; G693-S696 VanDerWaalsContact O-N 3.14Å; G693-S696 PolarHBondContact O-OG 3.12Å; S696-Q700 WeakPolarHBondContact O-CB 3.44Å; S696-Q700 PolarHBondContact O-N 3.33Å
697	E	96.8	Very high	94.7	Very high	134 Å²	134	55.9 Å²	55.9	63%	0.626	29%	0.29	S	S	*	.	H	α-helix	trans	-62.5	-45.5	175.2	-176.1	175	-166.9	0	0	111.5	G693 Q700 A701	G693-E697 PolarHBondContact O-N 2.8Å; E697-Q700 PolarHBondContact O-N 3.25Å; E697-A701 VanDerWaalsContact O-CB 3.28Å; E697-A701 WeakPolarHBondContact O-CB 3.44Å; E697-A701 PolarHBondContact O-N 2.84Å
698	A	96.4	Very high	94.2	Very high	5 Å²	5	59.8 Å²	59.8	4%	0.041	31%	0.309	C	S	.	.	H	α-helix	trans	-63.7	-44.3	179.4	0	0	0	0	0	112.8	F591 V633 N694 V695 A701 A702	F591-A698 HydrophobicContact CE2-CB 3.62Å; F591-A698 HydrophobicContact CZ-CB 3.55Å; V633-A698 HydrophobicContact CB-CB 4.43Å; V633-A698 HydrophobicContact CG1-CB 4.19Å; N694-A698 WeakPolarHBondContact O-CB 3.17Å; N694-A698 PolarHBondContact O-N 2.86Å; V695-A698 PolarHBondContact O-N 3.14Å; A698-A701 PolarHBondContact O-N 3.33Å; A698-A702 PolarHBondContact O-N 2.89Å
699	V	96.8	Very high	93.6	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-68.9	-38.1	177.8	179.3	0	0	0	0	110.9	V633 V638 L658 M661 F670 V695 A702 C703	V633-V699 HydrophobicContact CG1-CG2 4.1Å; V633-V699 HydrophobicContact CG2-CG2 3.66Å; V638-V699 HydrophobicContact CG2-CG1 4.16Å; V638-V699 HydrophobicContact CG2-CG2 4Å; L658-V699 HydrophobicContact CD1-CG1 3.51Å; M661-V699 HydrophobicContact CE-CB 3.8Å; M661-V699 HydrophobicContact CE-CG1 3.88Å; M661-V699 HydrophobicContact SD-CB 4.3Å; M661-V699 HydrophobicContact SD-CG1 3.76Å; F670-V699 HydrophobicContact CE1-CG2 4.26Å; F670-V699 HydrophobicContact CZ-CB 4.18Å; F670-V699 HydrophobicContact CZ-CG1 4.44Å; F670-V699 HydrophobicContact CZ-CG2 4.06Å; V695-V699 WeakPolarHBondContact O-CG2 3.23Å; V695-V699 PolarHBondContact O-N 3.4Å; V699-A702 PolarHBondContact O-N 2.76Å; V699-C703 PolarHBondContact O-N 2.95Å; V699-C703 PolarHBondContact O-SG 3.07Å
700	Q	96.1	Very high	93.1	Very high	102 Å²	102	63.5 Å²	63.5	48%	0.477	33%	0.333	S	S	.	.	H	α-helix	trans	-63.3	-42.7	173.6	-175.5	-174.2	-33.5	0	0	111.1	M661 S696 E697 A702 C703 M704	M661-Q700 HydrophobicContact CE-CB 4.08Å; M661-Q700 HydrophobicContact SD-CB 4.42Å; S696-Q700 WeakPolarHBondContact O-CB 3.44Å; S696-Q700 PolarHBondContact O-N 3.33Å; E697-Q700 PolarHBondContact O-N 3.25Å; Q700-A702 PolarHBondContact O-N 3.44Å; Q700-C703 WeakPolarHBondContact O-CB 3.34Å; Q700-C703 PolarHBondContact O-N 3.18Å; Q700-M704 HydrophobicContact CG-CE 4.11Å; Q700-M704 HydrophobicContact CG-CG 4.5Å; Q700-M704 HydrophobicContact CG-SD 4.36Å; Q700-M704 WeakPolarHBondContact O-CG 3.4Å; Q700-M704 PolarHBondContact O-N 2.59Å
701	A	94.7	Very high	92.7	Very high	30 Å²	30	62.2 Å²	62.2	25%	0.248	32%	0.32	C	S	.	.	H	α-helix	trans	-61.1	-42.9	176.2	0	0	0	0	0	111.8	E697 A698 C703 M704 L705	E697-A701 VanDerWaalsContact O-CB 3.28Å; E697-A701 WeakPolarHBondContact O-CB 3.44Å; E697-A701 PolarHBondContact O-N 2.84Å; A698-A701 PolarHBondContact O-N 3.33Å; A701-C703 PolarHBondContact O-N 3.3Å; A701-M704 PolarHBondContact O-N 3.48Å; A701-L705 WeakPolarHBondContact O-CB 3.36Å; A701-L705 VanDerWaalsContact O-CG 3.29Å; A701-L705 WeakPolarHBondContact O-CG 3.29Å; A701-L705 PolarHBondContact O-N 2.83Å
702	A	94.4	Very high	91.7	Very high	5 Å²	5	64.4 Å²	64.4	4%	0.041	34%	0.336	C	S	.	.	H	α-helix	trans	-60.5	-42.8	173.3	0	0	0	0	0	112	V633 V655 A698 V699 Q700 R706	V633-A702 HydrophobicContact CG1-CB 4.14Å; V655-A702 HydrophobicContact CG2-CB 4.27Å; A698-A702 PolarHBondContact O-N 2.89Å; V699-A702 PolarHBondContact O-N 2.76Å; Q700-A702 PolarHBondContact O-N 3.44Å; A702-R706 WeakPolarHBondContact O-CB 3.34Å; A702-R706 PolarHBondContact O-N 3.2Å
703	C	93.8	Very high	90.4	Very high	35 Å²	35	68.3 Å²	68.3	24%	0.236	37%	0.368	C	S	.	.	H	α-helix	trans	-60.5	-46.6	174.4	-64.7	0	0	0	0	112.1	V655 V699 Q700 A701 R706 Y707	V655-C703 HydrophobicContact CG1-CB 4.31Å; V699-C703 PolarHBondContact O-N 2.95Å; V699-C703 PolarHBondContact O-SG 3.07Å; Q700-C703 WeakPolarHBondContact O-CB 3.34Å; Q700-C703 PolarHBondContact O-N 3.18Å; A701-C703 PolarHBondContact O-N 3.3Å; C703-R706 PolarHBondContact O-N 3.49Å; C703-Y707 WeakPolarHBondContact O-CB 3.36Å; C703-Y707 PolarHBondContact O-N 3.25Å
704	M	91.9	Very high	89	Confident	105 Å²	105	76.1 Å²	76.1	52%	0.517	39%	0.389	S	S	.	.	H	α-helix	trans	-65.5	-44	178.9	-69	-172.9	-60.3	0	0	112.3	Q700 A701 R706 Y707 Q708	Q700-M704 HydrophobicContact CG-CE 4.11Å; Q700-M704 HydrophobicContact CG-CG 4.5Å; Q700-M704 HydrophobicContact CG-SD 4.36Å; Q700-M704 WeakPolarHBondContact O-CG 3.4Å; Q700-M704 PolarHBondContact O-N 2.59Å; A701-M704 PolarHBondContact O-N 3.48Å; M704-R706 VanDerWaalsContact C-N 3.32Å; M704-R706 PolarHBondContact O-N 3.15Å; M704-Y707 PolarHBondContact O-N 3.21Å; M704-Q708 WeakPolarHBondContact O-CB 3.35Å; M704-Q708 PolarHBondContact O-N 3.26Å
705	L	90.1	Very high	86.9	Confident	86 Å²	86	76.1 Å²	76.1	45%	0.45	39%	0.394	S	S	.	.	H	α-helix	trans	-60.7	-41.2	175.2	-74.8	170.6	0	0	0	111.5	A701 K709	A701-L705 WeakPolarHBondContact O-CB 3.36Å; A701-L705 VanDerWaalsContact O-CG 3.29Å; A701-L705 WeakPolarHBondContact O-CG 3.29Å; A701-L705 PolarHBondContact O-N 2.83Å; L705-K709 WeakPolarHBondContact O-CB 3.31Å; L705-K709 VanDerWaalsContact O-CG 3.27Å; L705-K709 WeakPolarHBondContact O-CG 3.48Å; L705-K709 PolarHBondContact O-N 3.4Å
706	R	88.6	Confident	84.7	Confident	62 Å²	62	81.9 Å²	81.9	23%	0.234	43%	0.432	C	S	.	.	H	α-helix	trans	-64.6	-46.7	175.8	-170.7	174.9	-157.4	125	9.2	111.9	A636 V655 A702 C703 M704 Q708 K709 C710	A636-R706 PolarHBondContact O-NH1 2.93Å; V655-R706 HydrophobicContact CG1-CB 4.17Å; A702-R706 WeakPolarHBondContact O-CB 3.34Å; A702-R706 PolarHBondContact O-N 3.2Å; C703-R706 PolarHBondContact O-N 3.49Å; M704-R706 VanDerWaalsContact C-N 3.32Å; M704-R706 PolarHBondContact O-N 3.15Å; R706-Q708 PolarHBondContact O-N 3.27Å; R706-K709 PolarHBondContact O-N 3.19Å; R706-C710 PolarHBondContact O-N 3.47Å; R706-C710 PolarHBondContact O-SG 2.81Å
707	Y	88.1	Confident	82.3	Confident	154 Å²	154	86.3 Å²	86.3	60%	0.604	46%	0.463	S	S	*	.	H	α-helix	trans	-58.1	-47.5	176.5	178.3	-105	0	0	0	111.5	C703 M704 K709 C710 L711	C703-Y707 WeakPolarHBondContact O-CB 3.36Å; C703-Y707 PolarHBondContact O-N 3.25Å; M704-Y707 PolarHBondContact O-N 3.21Å; Y707-K709 PolarHBondContact O-N 3.2Å; Y707-C710 WeakPolarHBondContact O-CB 3.36Å; Y707-C710 PolarHBondContact O-N 3.11Å; Y707-C710 VanDerWaalsContact O-N 3.12Å; Y707-L711 HydrophobicContact CD1-CD1 4.06Å; Y707-L711 HydrophobicContact CD1-CG 4.41Å; Y707-L711 HydrophobicContact CE1-CD1 3.46Å; Y707-L711 VanDerWaalsContact CE1-CD1 3.46Å; Y707-L711 HydrophobicContact CE1-CG 4.05Å; Y707-L711 HydrophobicContact CE2-CD2 4.46Å; Y707-L711 HydrophobicContact CE2-CG 4.49Å; Y707-L711 PolarHBondContact O-N 3.2Å
708	Q	87.8	Confident	79.8	Confident	107 Å²	107	88.7 Å²	88.7	50%	0.5	47%	0.474	S	S	.	.	H	α-helix	trans	-61.9	-42.5	178.3	-173.2	63.5	7.7	0	0	112.4	M704 R706 C710 L711 V712	M704-Q708 WeakPolarHBondContact O-CB 3.35Å; M704-Q708 PolarHBondContact O-N 3.26Å; R706-Q708 PolarHBondContact O-N 3.27Å; Q708-C710 VanDerWaalsContact C-N 3.31Å; Q708-C710 PolarHBondContact O-N 3.45Å; Q708-L711 PolarHBondContact O-N 3.11Å; Q708-V712 WeakPolarHBondContact O-CG2 3.42Å; Q708-V712 PolarHBondContact O-N 3.35Å
709	K	84.6	Confident	77.2	Confident	108 Å²	108	98 Å²	98	47%	0.47	51%	0.514	S	S	.	.	H	α-helix	trans	-60.6	-39.6	173.6	-72.5	170.5	-173.2	178.4	0	111.9	D635 L705 R706 Y707 A713	D635-K709 IonicContact OD2-NZ 3.52Å; D635-K709 PolarHBondContact OD2-NZ 3.43Å; L705-K709 WeakPolarHBondContact O-CB 3.31Å; L705-K709 VanDerWaalsContact O-CG 3.27Å; L705-K709 WeakPolarHBondContact O-CG 3.48Å; L705-K709 PolarHBondContact O-N 3.4Å; R706-K709 PolarHBondContact O-N 3.19Å; Y707-K709 PolarHBondContact O-N 3.2Å; K709-A713 VanDerWaalsContact O-CB 3.23Å; K709-A713 WeakPolarHBondContact O-CB 3.47Å; K709-A713 PolarHBondContact O-N 3.5Å
710	C	83	Confident	74.6	Confident	82 Å²	82	104.8 Å²	104.8	55%	0.554	56%	0.555	S	S	*	*	H	α-helix	trans	-69.3	-31.1	175.5	-71.9	0	0	0	0	113.8	R706 Y707 Q708	R706-C710 PolarHBondContact O-N 3.47Å; R706-C710 PolarHBondContact O-SG 2.81Å; Y707-C710 WeakPolarHBondContact O-CB 3.36Å; Y707-C710 PolarHBondContact O-N 3.11Å; Y707-C710 VanDerWaalsContact O-N 3.12Å; Q708-C710 VanDerWaalsContact C-N 3.31Å; Q708-C710 PolarHBondContact O-N 3.45Å
711	L	83.6	Confident	72.2	Confident	70 Å²	70	110.8 Å²	110.8	37%	0.366	57%	0.573	S	S	.	*	H	α-helix	trans	-70.4	-48	172	-70.4	-174.7	0	0	0	111.9	Y707 Q708 A713 R714	Y707-L711 HydrophobicContact CD1-CD1 4.06Å; Y707-L711 HydrophobicContact CD1-CG 4.41Å; Y707-L711 HydrophobicContact CE1-CD1 3.46Å; Y707-L711 VanDerWaalsContact CE1-CD1 3.46Å; Y707-L711 HydrophobicContact CE1-CG 4.05Å; Y707-L711 HydrophobicContact CE2-CD2 4.46Å; Y707-L711 HydrophobicContact CE2-CG 4.49Å; Y707-L711 PolarHBondContact O-N 3.2Å; Q708-L711 PolarHBondContact O-N 3.11Å; L711-A713 VanDerWaalsContact C-N 3.31Å; L711-A713 PolarHBondContact O-N 3.3Å; L711-R714 VanDerWaalsContact O-CB 3.27Å; L711-R714 WeakPolarHBondContact O-CB 3.46Å; L711-R714 PolarHBondContact O-N 3.18Å; L711-R714 VanDerWaalsContact O-N 3.13Å
712	V	76.5	Confident	70	Confident	111 Å²	111	114.3 Å²	114.3	67%	0.673	59%	0.593	S	S	*	*	H	α-helix	trans	-67.5	-31.2	-178.5	174.6	0	0	0	0	112.1	Q708 R714	Q708-V712 WeakPolarHBondContact O-CG2 3.42Å; Q708-V712 PolarHBondContact O-N 3.35Å; V712-R714 PolarHBondContact O-N 3.01Å
713	A	70.6	Confident	67.8	Low	81 Å²	81	119.7 Å²	119.7	67%	0.669	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.3	-5.1	174.7	0	0	0	0	0	114.2	K709 L711 P715	K709-A713 VanDerWaalsContact O-CB 3.23Å; K709-A713 WeakPolarHBondContact O-CB 3.47Å; K709-A713 PolarHBondContact O-N 3.5Å; L711-A713 VanDerWaalsContact C-N 3.31Å; L711-A713 PolarHBondContact O-N 3.3Å; A713-P715 WeakPolarHBondContact O-CD 3.41Å
714	R	64.8	Low	65.5	Low	192 Å²	192	123.6 Å²	123.6	73%	0.725	65%	0.653	S	S	*	*	S	Bend	trans	-85	115.2	177.5	-136.7	176.3	-162.9	167.6	5.5	108.8	L711 V712	L711-R714 VanDerWaalsContact O-CB 3.27Å; L711-R714 WeakPolarHBondContact O-CB 3.46Å; L711-R714 PolarHBondContact O-N 3.18Å; L711-R714 VanDerWaalsContact O-N 3.13Å; V712-R714 PolarHBondContact O-N 3.01Å
715	P	51.4	Low	63.3	Low	101 Å²	101	124 Å²	124	66%	0.656	66%	0.663	S	S	*	*			trans	-60.7	148.3	174.9	26.5	-34.1	0	0	0	109.9	A713 S717	A713-P715 WeakPolarHBondContact O-CD 3.41Å; P715-S717 PolarHBondContact O-N 3.33Å; P715-S717 VanDerWaalsContact O-N 3.16Å
716	P	51	Low	61.1	Low	126 Å²	126	125.9 Å²	125.9	82%	0.818	68%	0.68	S	S	*	*			trans	-56	125.4	178.5	24.1	-33.7	0	0	0	108.9	Q718	P716-Q718 PolarHBondContact O-N 2.96Å
717	S	47.1	Very low	58.9	Low	117 Å²	117	127.8 Å²	127.8	82%	0.818	71%	0.71	S	S	*	*			trans	-61.3	107.9	-171.4	33.3	0	0	0	0	110.4	P715 K719	P715-S717 PolarHBondContact O-N 3.33Å; P715-S717 VanDerWaalsContact O-N 3.16Å; S717-K719 PolarHBondContact O-N 3.18Å
718	Q	44.7	Very low	56.7	Low	184 Å²	184	127.9 Å²	127.9	86%	0.86	72%	0.721	S	S	*	*			trans	-53.9	117.2	167	-73.3	-173.6	-9.7	0	0	107.4	P716 V720	P716-Q718 PolarHBondContact O-N 2.96Å; Q718-V720 PolarHBondContact O-N 3.24Å; Q718-V720 VanDerWaalsContact O-N 3.12Å
719	K	41.9	Very low	54.2	Low	200 Å²	200	128.5 Å²	128.5	87%	0.87	74%	0.737	S	S	*	*			trans	-51.5	123.6	170.5	-71.2	-179.9	177.7	177.5	0	106.9	S717 R721	S717-K719 PolarHBondContact O-N 3.18Å; K719-R721 PolarHBondContact O-N 2.9Å
720	V	41.6	Very low	52.1	Low	142 Å²	142	129.7 Å²	129.7	86%	0.861	75%	0.753	S	S	*	*			trans	-55.3	102	-174.9	178.1	0	0	0	0	108.7	Q718	Q718-V720 PolarHBondContact O-N 3.24Å; Q718-V720 VanDerWaalsContact O-N 3.12Å
721	R	47	Very low	50	Low	229 Å²	229	131.3 Å²	131.3	86%	0.864	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-71.8	124.9	174.7	-168.7	175.7	-172.6	166.7	2.2	105.9	K719	K719-R721 PolarHBondContact O-N 2.9Å
722	P	46.9	Very low	47.9	Very low	104 Å²	104	138.9 Å²	138.9	68%	0.675	78%	0.784	S	S	*	*	P	Polyproline II helix	trans	-57.2	144.9	174.9	24.9	-33.5	0	0	0	109.2
723	P	49.4	Very low	46.1	Very low	117 Å²	117	144.9 Å²	144.9	76%	0.76	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-59.3	145.4	-177	25	-34.3	0	0	0	110.5
724	P	44.7	Very low	44.4	Very low	117 Å²	117	147.7 Å²	147.7	76%	0.76	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-62.1	143.8	175.4	28	-34.3	0	0	0	110
725	P	46.6	Very low	43.2	Very low	113 Å²	113	144 Å²	144	73%	0.734	80%	0.802	S	S	*	*	P	Polyproline II helix	trans	-64.7	149.6	174.4	29.1	-34.8	0	0	0	110.5	A727	P725-A727 PolarHBondContact O-N 3.14Å
726	P	42.3	Very low	42.5	Very low	126 Å²	126	145.7 Å²	145.7	82%	0.818	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-63.1	133.3	176.1	27.4	-34.2	0	0	0	110.3	D728	P726-D728 PolarHBondContact O-N 3.18Å
727	A	44.3	Very low	41.8	Very low	103 Å²	103	147.6 Å²	147.6	85%	0.851	81%	0.814	S	S	*	*			trans	-83.9	76.9	-176.6	0	0	0	0	0	111.5	P725	P725-A727 PolarHBondContact O-N 3.14Å
728	D	41.9	Very low	41.2	Very low	156 Å²	156	148.5 Å²	148.5	83%	0.834	81%	0.814	S	S	*	*			trans	-153.1	95.9	164.8	-114.6	-32.1	0	0	0	113.1	P726	P726-D728 PolarHBondContact O-N 3.18Å
729	S	35.3	Very low	40.9	Very low	120 Å²	120	149.3 Å²	149.3	84%	0.839	82%	0.815	S	S	*	*			trans	179.5	126.7	132.6	38.3	0	0	0	0	111.8
730	V	40.3	Very low	40.7	Very low	132 Å²	132	151.6 Å²	151.6	80%	0.8	82%	0.818	S	S	*	*			trans	-82.9	130.1	168.3	174.8	0	0	0	0	108.6
731	T	38.5	Very low	40.1	Very low	116 Å²	116	147.8 Å²	147.8	71%	0.712	81%	0.808	S	S	*	*				179.6	156.8	111.2	-6	0	0	0	0	114.4
732	R	39.6	Very low	39.6	Very low	229 Å²	229	143.3 Å²	143.3	86%	0.864	81%	0.805	S	S	*	*			trans	71.6	115.6	151.5	-72	166.6	-162.2	-104.6	-1.8	120
733	R	39.1	Very low	38.9	Very low	238 Å²	238	146 Å²	146	90%	0.898	81%	0.813	S	S	*	*			trans	-32.5	149.4	149.5	-57.1	168.8	172.6	165.9	-4.9	114
734	V	33.8	Very low	38.3	Very low	139 Å²	139	144.8 Å²	144.8	84%	0.842	81%	0.807	S	S	*	*				-165.1	151.8	95.8	147.1	0	0	0	0	110.5
735	T	39.9	Very low	37.8	Very low	116 Å²	116	145.9 Å²	145.9	71%	0.712	81%	0.806	S	S	*	*			trans	-79.9	149.3	-179.6	49.3	0	0	0	0	113.5
736	T	35.7	Very low	37.5	Very low	135 Å²	135	147.2 Å²	147.2	83%	0.828	81%	0.806	S	S	*	*				177.3	147	118.8	25.8	0	0	0	0	112.5
737	N	38.1	Very low	37.1	Very low	166 Å²	166	147.9 Å²	147.9	89%	0.888	80%	0.802	S	S	*	*			trans	-97.6	138.9	165.1	-83.5	-16.6	0	0	0	109.8
738	V	34.4	Very low	36.7	Very low	137 Å²	137	147.8 Å²	147.8	83%	0.83	79%	0.791	S	S	*	*			trans	-137.2	125.5	161.3	-179.2	0	0	0	0	109.8
739	K	37	Very low	36.5	Very low	200 Å²	200	147.9 Å²	147.9	87%	0.87	79%	0.791	S	S	*	*			trans	-85.4	164.1	169.3	-85.1	-179.7	172.9	175.8	0	110.2
740	R	38.1	Very low	36.6	Very low	249 Å²	249	150 Å²	150	94%	0.94	79%	0.785	S	S	*	*			trans	78.4	130.9	165.4	-166.6	-167.8	-69.3	149.7	-7.9	114.1
741	G	29.2	Very low	36.3	Very low	62 Å²	62	151.4 Å²	151.4	64%	0.639	78%	0.783	S	S	*	*			cis	149.6	160.2	-14.3	0	0	0	0	0	114.4
742	V	35.7	Very low	36.1	Very low	134 Å²	134	154.9 Å²	154.9	81%	0.812	79%	0.788	S	S	*	*			trans	66.8	147.8	159.5	-160.2	0	0	0	0	117.4
743	L	33.6	Very low	35.9	Very low	161 Å²	161	154.1 Å²	154.1	84%	0.843	79%	0.785	S	S	*	*			trans	73.3	151.6	-176.5	-46.5	177.6	0	0	0	113.2
744	S	36.5	Very low	36.2	Very low	92 Å²	92	147.7 Å²	147.7	64%	0.643	77%	0.774	S	S	*	*			cis	-148.3	147.7	15	-150.9	0	0	0	0	114
745	L	34.9	Very low	36.3	Very low	139 Å²	139	147.3 Å²	147.3	73%	0.728	77%	0.772	S	S	*	*			trans	26	134.6	141	-57.4	174	0	0	0	122
746	I	40	Very low	36	Very low	142 Å²	142	147 Å²	147	73%	0.728	77%	0.77	S	S	*	*				65.6	139.3	126.2	-61.7	175.4	0	0	0	116.6
747	D	34.3	Very low	36	Very low	139 Å²	139	149.2 Å²	149.2	74%	0.743	77%	0.771	S	S	*	*			cis	-149.2	-173	36.7	-143.6	-33.1	0	0	0	115.2
748	T	34.4	Very low	35.8	Very low	102 Å²	102	147.2 Å²	147.2	63%	0.626	77%	0.765	S	S	*	*			trans	-79.7	146.7	-176.4	53.3	0	0	0	0	115.9
749	L	37.7	Very low	36.7	Very low	158 Å²	158	150.1 Å²	150.1	83%	0.827	79%	0.787	S	S	*	*				-165.8	127.4	123.4	-122.6	71.4	0	0	0	105.8
750	K	37	Very low	36.7	Very low	163 Å²	163	147.6 Å²	147.6	71%	0.709	78%	0.782	S	S	*	*				47	119.5	57.8	-67.4	-170.3	173.8	-176.6	0	112.3
751	Q	35.8	Very low	36.6	Very low	163 Å²	163	142.3 Å²	142.3	76%	0.762	77%	0.774	S	S	*	*			cis	-152	-178.2	-2.9	-117	155	-108	0	0	106.9
752	K	33.6	Very low	37.1	Very low	188 Å²	188	146.7 Å²	146.7	82%	0.817	78%	0.782	S	S	*	*			cis	-152.4	-147	27.8	-158.6	-163.2	166.6	-173	0	109.9
753	R	35.6	Very low	37.1	Very low	214 Å²	214	147.5 Å²	147.5	81%	0.808	78%	0.78	S	S	*	*			trans	-154	-179.4	168.2	-83.3	-168.5	-177.3	171.7	-0	105.9
754	P	45.8	Very low	37.4	Very low	102 Å²	102	146.6 Å²	146.6	66%	0.662	78%	0.776	S	S	*	*				-134	-173.5	-56.3	37.8	-20	0	0	0	112.1
755	V	34.2	Very low	37.4	Very low	131 Å²	131	150.3 Å²	150.3	79%	0.794	79%	0.785	S	S	*	*			trans	56	170	166.1	-99.4	0	0	0	0	116.7
756	T	35.3	Very low	37.6	Very low	110 Å²	110	151.1 Å²	151.1	68%	0.675	79%	0.789	S	S	*	*			cis	-146.2	175.8	3.5	-18.1	0	0	0	0	110.9
757	E	34.3	Very low	37.4	Very low	181 Å²	181	151.8 Å²	151.8	85%	0.846	79%	0.793	S	S	*	*			trans	76.5	143.5	150.7	-76.7	170.1	141	0	0	121.5
758	T	34.4	Very low	37.7	Very low	124 Å²	124	152.8 Å²	152.8	76%	0.761	80%	0.798	S	S	*	*			trans	-92.8	169.1	173.1	45.3	0	0	0	0	109.8
759	P	54.1	Low	38	Very low	198 Å²	198	157.5 Å²	157.5	100%	1.286	81%	0.813	S	S	*	*				-95.3	0	66.6	-18.9	35.3	0	0	0	116

Retrieved 759 of 759 residues in 148.8 ms (Link to these results)

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